#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hj4 s PRO 27 N 0.00 2.45 -0.24 3.49 0.04 -1.26 -4.97 135.00 134.51 1hj4 s PRO 27 Ca 0.00 1.90 0.02 0.00 0.04 0.00 0.00 61.00 62.96 1hj4 s PRO 27 Cb 0.00 -1.85 0.05 0.00 0.04 0.00 0.00 34.50 32.74 1hj4 s PRO 27 CO 0.00 -1.63 -0.11 0.45 0.04 0.00 0.00 177.00 175.75 1hj4 s SER 28 N -1.69 4.05 -1.29 6.66 0.15 -1.26 -3.51 113.70 116.80 1hj4 s SER 28 Ca 0.78 -1.20 -0.07 0.00 0.70 0.00 0.00 55.95 56.16 1hj4 s SER 28 Cb -0.33 -1.44 0.15 0.00 -1.71 0.00 0.00 66.02 62.69 1hj4 s SER 28 CO 0.41 -0.17 2.15 0.18 1.20 0.00 0.00 173.24 177.01 1hj4 n LEU 29 N 4.53 7.47 0.20 3.45 4.77 -1.12 -4.71 117.00 131.58 1hj4 n LEU 29 Ca -0.15 -4.82 0.07 0.00 -0.03 0.00 0.00 56.01 51.08 1hj4 n LEU 29 Cb 0.44 -1.40 0.38 0.00 -2.33 0.00 0.00 43.42 40.51 1hj4 n LEU 29 CO 0.21 1.80 0.72 -2.24 -1.33 0.00 0.00 177.39 176.55 1hj4 h ASP 30 N 5.05 0.00 -0.13 -1.43 2.03 -1.82 -3.06 116.42 117.06 1hj4 h ASP 30 Ca 0.57 0.00 -0.20 0.00 -0.73 0.00 0.00 57.03 56.67 1hj4 h ASP 30 Cb 0.44 0.00 0.01 0.00 -0.83 0.00 0.00 39.33 38.95 1hj4 h ASP 30 CO 1.53 0.33 -0.71 -1.13 -1.03 0.00 0.00 179.24 178.22 1hj4 h ASN 31 N 0.00 0.85 0.59 4.15 -0.73 -1.84 -3.19 115.58 115.41 1hj4 h ASN 31 Ca -0.00 -0.64 -0.02 0.00 1.87 0.00 0.00 56.30 57.50 1hj4 h ASN 31 Cb 0.83 -0.25 -0.00 0.00 0.27 0.00 0.00 38.32 39.16 1hj4 h ASN 31 CO 0.04 1.35 -0.12 0.25 -0.37 0.00 0.00 177.43 178.59 1hj4 h LEU 32 N 0.40 0.00 0.00 0.34 6.46 -1.73 -2.82 115.31 117.96 1hj4 h LEU 32 Ca -0.05 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.71 1hj4 h LEU 32 Cb 1.35 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.28 1hj4 h LEU 32 CO 0.15 0.12 0.00 0.00 -0.62 0.00 0.00 178.44 178.08 1hj4 n ALA 33 N -2.22 2.26 1.45 1.25 0.00 -1.17 -3.33 120.51 118.76 1hj4 n ALA 33 Ca -0.01 -0.10 0.11 0.00 0.00 0.00 0.00 53.44 53.44 1hj4 n ALA 33 Cb 0.29 -1.43 0.46 0.00 0.00 0.00 0.00 19.45 18.77 1hj4 n ALA 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1hj4 n GLN 34 N -1.44 1.55 -3.25 0.00 10.64 -1.06 -4.41 117.38 119.40 1hj4 n GLN 34 Ca 0.08 -0.82 -0.39 0.00 -1.83 0.00 0.00 57.00 54.05 1hj4 n GLN 34 Cb 0.28 -1.40 -0.06 0.00 -0.86 0.00 0.00 30.24 28.21 1hj4 n GLN 34 CO 0.00 0.00 0.00 -1.14 -1.83 0.00 0.00 177.06 174.09 1hj4 s GLN 35 N -1.88 4.29 -0.29 2.61 0.74 -1.21 -5.05 119.66 118.87 1hj4 s GLN 35 Ca 0.33 0.64 -0.18 0.00 0.05 0.00 0.00 55.36 56.20 1hj4 s GLN 35 Cb 0.17 -3.36 -0.02 0.00 1.10 0.00 0.00 33.01 30.91 1hj4 s GLN 35 CO 0.27 0.34 0.51 -0.51 -0.55 0.00 0.00 175.29 175.34 1hj4 s ASP 36 N -0.04 6.38 0.13 6.67 1.01 -1.26 -4.87 116.67 124.69 1hj4 s ASP 36 Ca 0.29 0.32 0.04 0.00 0.71 0.00 0.00 52.55 53.92 1hj4 s ASP 36 Cb -0.17 -2.27 -0.04 0.00 1.01 0.00 0.00 42.92 41.45 1hj4 s ASP 36 CO 0.15 -0.35 0.11 0.68 0.21 0.00 0.00 175.17 175.97 1hj4 s VAL 37 N 2.33 4.47 0.48 -1.27 -7.23 -1.26 -5.11 120.40 112.81 1hj4 s VAL 37 Ca 0.20 -0.97 -0.20 0.00 -1.81 0.00 0.00 61.98 59.21 1hj4 s VAL 37 Cb -0.16 -3.23 -0.09 0.00 0.56 0.00 0.00 36.38 33.47 1hj4 s VAL 37 CO 0.11 -0.01 1.00 0.00 -0.31 0.00 0.00 175.10 175.88 1hj4 s ALA 38 N -1.60 2.96 -0.08 1.32 0.00 -1.26 -4.62 121.76 118.48 1hj4 s ALA 38 Ca 0.30 0.44 -0.30 0.00 0.00 0.00 0.00 51.96 52.40 1hj4 s ALA 38 Cb -0.11 -3.19 -0.04 0.00 0.00 0.00 0.00 23.12 19.78 1hj4 s ALA 38 CO 0.23 -0.17 1.45 0.00 0.00 0.00 0.00 175.76 177.27 1hj4 s ALA 39 N -2.21 3.62 1.06 0.00 0.00 -1.26 -4.98 121.76 117.99 1hj4 s ALA 39 Ca 0.63 0.76 -0.16 0.00 0.00 0.00 0.00 51.96 53.19 1hj4 s ALA 39 Cb -0.12 -3.66 0.22 0.00 0.00 0.00 0.00 23.12 19.56 1hj4 s ALA 39 CO 0.20 -1.19 1.15 -1.25 0.00 0.00 0.00 175.76 174.68 1hj4 s PRO 40 N 3.42 -0.08 0.52 0.00 0.04 -1.26 -4.98 135.00 132.66 1hj4 s PRO 40 Ca 0.64 0.03 -0.07 0.00 0.04 0.00 0.00 61.00 61.65 1hj4 s PRO 40 Cb -0.29 -1.72 -0.04 0.00 0.04 0.00 0.00 34.50 32.49 1hj4 s PRO 40 CO 0.24 -2.97 0.85 0.20 0.04 0.00 0.00 177.00 175.36 1hj4 s GLY 41 N -4.05 1.55 -0.20 0.56 0.00 -1.26 -4.80 107.32 99.12 1hj4 s GLY 41 Ca 0.69 -0.38 -0.02 0.00 0.00 0.00 0.00 44.72 45.01 1hj4 s GLY 41 CO 0.55 -0.19 -0.11 0.00 0.00 0.00 0.00 173.10 173.35 1hj4 s ALA 42 N -2.85 2.60 1.17 3.20 0.00 -1.26 -4.54 121.76 120.08 1hj4 s ALA 42 Ca 0.50 -1.18 -0.16 0.00 0.00 0.00 0.00 51.96 51.12 1hj4 s ALA 42 Cb -0.10 -1.46 0.27 0.00 0.00 0.00 0.00 23.12 21.82 1hj4 s ALA 42 CO 0.47 -0.37 1.05 -1.25 0.00 0.00 0.00 175.76 175.67 1hj4 s PRO 43 N 1.35 -0.96 0.17 0.00 0.04 -1.26 -4.85 135.00 129.49 1hj4 s PRO 43 Ca 0.05 0.36 -0.32 0.00 0.04 0.00 0.00 61.00 61.13 1hj4 s PRO 43 Cb -0.14 -1.59 -0.12 0.00 0.04 0.00 0.00 34.50 32.70 1hj4 s PRO 43 CO -0.07 -3.63 1.76 -1.91 0.04 0.00 0.00 177.00 173.19 1hj4 n GLU 44 N -4.78 2.73 -0.30 4.56 2.13 -1.26 -2.06 120.64 121.66 1hj4 n GLU 44 Ca 0.08 0.99 0.00 0.00 0.66 0.00 0.00 57.16 58.88 1hj4 n GLU 44 Cb 0.58 -2.85 0.00 0.00 0.27 0.00 0.00 31.44 29.44 1hj4 n GLU 44 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1hj4 n GLY 45 N 4.03 0.77 3.09 8.31 0.00 -1.26 -5.04 105.19 115.08 1hj4 n GLY 45 Ca 0.17 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.95 1hj4 n GLY 45 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1hj4 s VAL 46 N -2.24 1.19 0.21 1.61 1.01 -0.88 -5.13 120.40 116.17 1hj4 s VAL 46 Ca 0.00 -0.59 -0.23 0.00 0.00 0.00 0.00 61.98 61.16 1hj4 s VAL 46 Cb 0.00 -1.03 -0.08 0.00 0.00 0.00 0.00 36.38 35.27 1hj4 s VAL 46 CO 0.00 0.35 0.78 -0.44 0.00 0.00 0.00 175.10 175.79 1hj4 s SER 47 N 0.08 7.26 0.44 3.32 0.01 -1.26 -4.59 113.70 118.96 1hj4 s SER 47 Ca -0.03 1.59 -0.04 0.00 1.31 0.00 0.00 55.95 58.78 1hj4 s SER 47 Cb -0.10 -2.48 -0.04 0.00 0.21 0.00 0.00 66.02 63.61 1hj4 s SER 47 CO 0.01 0.10 0.71 0.00 0.41 0.00 0.00 173.24 174.48 1hj4 s ALA 48 N -1.36 3.49 0.05 1.44 0.00 -1.26 -4.91 121.76 119.20 1hj4 s ALA 48 Ca 0.40 -0.60 0.06 0.00 0.00 0.00 0.00 51.96 51.82 1hj4 s ALA 48 Cb -0.20 -2.46 -0.04 0.00 0.00 0.00 0.00 23.12 20.43 1hj4 s ALA 48 CO 0.24 -0.23 -0.11 -0.51 0.00 0.00 0.00 175.76 175.14 1hj4 s LEU 49 N -4.55 2.94 1.10 0.00 1.43 -1.26 -5.10 118.68 113.24 1hj4 s LEU 49 Ca 0.45 -0.31 -0.13 0.00 -1.03 0.00 0.00 54.13 53.11 1hj4 s LEU 49 Cb -0.10 -1.72 0.25 0.00 0.03 0.00 0.00 46.19 44.64 1hj4 s LEU 49 CO 0.41 0.24 1.06 -0.94 0.23 0.00 0.00 176.35 177.36 1hj4 s SER 50 N -1.67 1.65 0.12 2.29 1.04 -1.26 -4.69 113.70 111.18 1hj4 s SER 50 Ca 0.18 1.23 -0.20 0.00 0.48 0.00 0.00 55.95 57.64 1hj4 s SER 50 Cb -0.11 -1.92 -0.06 0.00 0.10 0.00 0.00 66.02 64.03 1hj4 s SER 50 CO 0.09 -3.75 1.77 0.44 0.98 0.00 0.00 173.24 172.77 1hj4 h ASP 51 N -2.31 0.20 0.12 7.02 5.19 -1.95 0.14 116.42 124.82 1hj4 h ASP 51 Ca -0.57 -0.00 0.01 0.00 -0.62 0.00 0.00 57.03 55.84 1hj4 h ASP 51 Cb 1.33 -0.04 -0.01 0.00 0.18 0.00 0.00 39.33 40.79 1hj4 h ASP 51 CO 0.53 0.15 -0.13 0.00 -3.12 0.00 0.00 179.24 176.66 1hj4 h ALA 52 N 1.08 -0.25 -0.35 3.45 0.00 -1.94 0.17 119.26 121.43 1hj4 h ALA 52 Ca 0.08 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.97 1hj4 h ALA 52 Cb -0.01 0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 1hj4 h ALA 52 CO -0.03 -0.66 0.18 1.96 0.00 0.00 0.00 179.25 180.70 1hj4 h GLN 53 N -0.28 0.36 -0.67 0.00 4.20 -1.88 -0.57 115.11 116.27 1hj4 h GLN 53 Ca 0.01 -0.02 -0.03 0.00 0.06 0.00 0.00 58.65 58.66 1hj4 h GLN 53 Cb 0.28 -0.08 -0.03 0.00 0.30 0.00 0.00 27.48 27.95 1hj4 h GLN 53 CO -0.04 0.24 0.29 -0.92 -0.67 0.00 0.00 178.83 177.72 1hj4 h TYR 54 N 0.37 0.99 -0.69 2.96 3.20 -0.44 -1.47 116.97 121.88 1hj4 h TYR 54 Ca 0.14 -0.06 -0.06 0.00 3.14 0.00 0.00 58.73 61.89 1hj4 h TYR 54 Cb 0.04 -0.30 -0.03 0.00 1.54 0.00 0.00 36.73 37.98 1hj4 h TYR 54 CO -0.09 0.76 0.19 -0.91 -1.64 0.00 0.00 178.16 176.47 1hj4 h ASN 55 N 0.93 1.03 -0.74 -2.11 2.35 -0.38 0.19 115.58 116.85 1hj4 h ASN 55 Ca 0.22 -0.22 -0.03 0.00 -0.55 0.00 0.00 56.30 55.72 1hj4 h ASN 55 Cb 0.17 -0.27 -0.03 0.00 0.05 0.00 0.00 38.32 38.24 1hj4 h ASN 55 CO -0.02 0.98 0.33 -0.08 -1.65 0.00 0.00 177.43 176.99 1hj4 h GLU 56 N 1.03 1.09 -0.42 0.81 4.81 -0.85 -1.29 114.58 119.75 1hj4 h GLU 56 Ca 0.22 -0.18 -0.14 0.00 -0.13 0.00 0.00 59.36 59.14 1hj4 h GLU 56 Cb 0.34 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 29.52 1hj4 h GLU 56 CO -0.00 0.87 -0.28 0.00 -0.73 0.00 0.00 179.01 178.87 1hj4 h ALA 57 N 1.16 0.70 -0.32 2.92 0.00 -0.91 -2.55 119.26 120.26 1hj4 h ALA 57 Ca 0.25 -0.41 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 1hj4 h ALA 57 Cb 0.16 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1hj4 h ALA 57 CO -0.03 0.67 0.16 -0.97 0.00 0.00 0.00 179.25 179.08 1hj4 h ASN 58 N 0.78 0.41 -0.51 0.00 -0.00 -0.27 0.13 115.58 116.12 1hj4 h ASN 58 Ca 0.09 -0.11 0.00 0.00 -0.00 0.00 0.00 56.30 56.28 1hj4 h ASN 58 Cb 0.84 -0.11 -0.02 0.00 -0.00 0.00 0.00 38.32 39.03 1hj4 h ASN 58 CO 0.07 0.41 0.32 0.11 -0.00 0.00 0.00 177.43 178.34 1hj4 h LYS 59 N 0.39 0.68 -0.46 6.67 1.57 -1.21 -1.67 116.57 122.53 1hj4 h LYS 59 Ca 0.11 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 1hj4 h LYS 59 Cb 0.10 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.24 1hj4 h LYS 59 CO -0.02 0.48 0.31 0.82 -0.57 0.00 0.00 179.45 180.47 1hj4 h ILE 60 N 0.68 1.12 0.03 1.86 2.04 -1.25 -0.62 117.51 121.38 1hj4 h ILE 60 Ca 0.18 -0.22 0.03 0.00 1.00 0.00 0.00 64.86 65.85 1hj4 h ILE 60 Cb -0.04 0.44 -0.04 0.00 -0.74 0.00 0.00 36.82 36.45 1hj4 h ILE 60 CO -0.04 0.12 -0.24 0.22 0.00 0.00 0.00 178.15 178.21 1hj4 h TYR 61 N 0.63 -0.64 -0.38 1.37 3.20 -0.11 0.10 116.97 121.13 1hj4 h TYR 61 Ca 0.17 0.02 -0.07 0.00 3.14 0.00 0.00 58.73 61.98 1hj4 h TYR 61 Cb -0.07 0.28 -0.01 0.00 1.54 0.00 0.00 36.73 38.47 1hj4 h TYR 61 CO -0.04 -0.33 -0.05 0.74 -1.64 0.00 0.00 178.16 176.83 1hj4 h PHE 62 N -0.40 0.79 -0.55 -3.82 0.04 -1.22 0.67 116.94 112.45 1hj4 h PHE 62 Ca 0.05 -0.15 -0.08 0.00 2.80 0.00 0.00 57.97 60.58 1hj4 h PHE 62 Cb 0.46 -0.20 -0.02 0.00 2.20 0.00 0.00 35.95 38.39 1hj4 h PHE 62 CO -0.26 0.83 0.01 0.93 -0.60 0.00 0.00 178.31 179.22 1hj4 h GLU 63 N 0.52 0.97 0.00 1.51 5.08 -0.95 -2.97 114.58 118.74 1hj4 h GLU 63 Ca 0.10 -0.30 0.00 0.00 -1.00 0.00 0.00 59.36 58.16 1hj4 h GLU 63 Cb 0.54 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.70 1hj4 h GLU 63 CO 0.03 0.97 -0.43 0.54 -1.00 0.00 0.00 179.01 179.11 1hj4 n ARG 64 N -4.27 4.29 -0.02 2.33 1.74 0.34 -4.35 116.66 116.71 1hj4 n ARG 64 Ca 0.02 -0.01 -0.03 0.00 -0.77 0.00 0.00 57.85 57.06 1hj4 n ARG 64 Cb 0.32 -0.76 -0.03 0.00 -1.02 0.00 0.00 32.46 30.97 1hj4 n ARG 64 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1hj4 h ALA 66 N 0.08 1.26 -0.27 0.00 0.00 -1.02 -2.44 119.26 116.88 1hj4 h ALA 66 Ca -0.12 -0.08 0.05 0.00 0.00 0.00 0.00 54.91 54.75 1hj4 h ALA 66 Cb 1.22 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.95 1hj4 h ALA 66 CO -0.01 0.11 0.00 0.78 0.00 0.00 0.00 179.25 180.14 1hj4 h GLY 67 N 0.79 0.26 1.01 0.00 0.00 -1.81 0.50 103.07 103.82 1hj4 h GLY 67 Ca -0.00 0.03 -0.33 0.00 0.00 0.00 0.00 47.33 47.03 1hj4 h GLY 67 CO 0.01 -0.05 -1.70 0.00 0.00 0.00 0.00 176.54 174.80 1hj4 n HIS 69 N -3.43 0.22 0.00 0.00 8.25 -0.93 0.18 115.22 119.52 1hj4 n HIS 69 Ca -0.21 0.06 0.00 0.00 -0.26 0.00 0.00 57.72 57.31 1hj4 n HIS 69 Cb 1.05 -0.39 0.00 0.00 1.12 0.00 0.00 29.99 31.78 1hj4 n HIS 69 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1hj4 n GLY 70 N 1.39 0.35 0.30 -1.41 0.00 0.18 -1.09 105.19 104.90 1hj4 n GLY 70 Ca 0.02 -1.50 0.00 0.00 0.00 0.00 0.00 46.02 44.55 1hj4 n GLY 70 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1hj4 h VAL 71 N 0.00 0.99 -0.15 1.61 2.07 -1.95 -1.68 116.25 117.14 1hj4 h VAL 71 Ca 0.00 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 67.23 1hj4 h VAL 71 Cb 0.00 0.08 0.00 0.00 -1.52 0.00 0.00 31.29 29.85 1hj4 h VAL 71 CO 0.00 0.15 0.00 0.18 0.02 0.00 0.00 177.57 177.92 1hj4 n LEU 72 N -4.70 1.67 -1.85 2.57 4.77 -1.26 -4.94 117.00 113.26 1hj4 n LEU 72 Ca 0.11 -0.68 -0.17 0.00 -0.03 0.00 0.00 56.01 55.24 1hj4 n LEU 72 Cb 0.19 -0.09 -0.02 0.00 -2.33 0.00 0.00 43.42 41.17 1hj4 n LEU 72 CO 0.30 0.34 -0.21 0.54 -1.33 0.00 0.00 177.39 177.02 1hj4 n ARG 73 N 0.32 -1.35 0.00 3.23 1.74 -0.63 -4.82 116.66 115.15 1hj4 n ARG 73 Ca 0.17 0.89 0.13 0.00 -0.77 0.00 0.00 57.85 58.27 1hj4 n ARG 73 Cb 0.34 -5.31 0.38 0.00 -1.02 0.00 0.00 32.46 26.85 1hj4 n ARG 73 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1hj4 n LYS 74 N -2.63 0.38 0.00 5.56 4.01 -1.18 -0.23 118.16 124.07 1hj4 n LYS 74 Ca -0.20 -0.19 0.00 0.00 -0.51 0.00 0.00 58.31 57.41 1hj4 n LYS 74 Cb 0.64 -1.50 0.00 0.00 -0.51 0.00 0.00 35.03 33.66 1hj4 n LYS 74 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1hj4 n GLY 75 N 1.41 -0.01 0.68 0.72 0.00 -0.25 -4.34 105.19 103.40 1hj4 n GLY 75 Ca 0.09 -1.46 0.00 0.00 0.00 0.00 0.00 46.02 44.66 1hj4 n GLY 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hj4 n ALA 76 N 0.64 2.25 0.37 4.61 0.00 -1.00 -4.78 120.51 122.60 1hj4 n ALA 76 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.53 1hj4 n ALA 76 Cb 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.32 1hj4 n ALA 76 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1hj4 n THR 77 N -1.51 0.00 -4.23 0.00 -1.04 -0.53 -4.95 114.28 102.02 1hj4 n THR 77 Ca 0.00 -0.27 -0.24 0.00 -2.04 0.00 0.00 64.05 61.50 1hj4 n THR 77 Cb 0.00 0.48 -0.08 0.00 -1.82 0.00 0.00 70.33 68.92 1hj4 n THR 77 CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 1hj4 s GLY 78 N -3.50 2.00 0.72 3.41 0.00 0.13 -5.00 107.32 105.08 1hj4 s GLY 78 Ca -0.01 -1.90 -0.13 0.00 0.00 0.00 0.00 44.72 42.69 1hj4 s GLY 78 CO 0.76 -1.83 1.10 0.54 0.00 0.00 0.00 173.10 173.67 1hj4 s LYS 79 N -3.77 2.48 0.34 2.90 1.02 -1.26 -4.41 119.74 117.03 1hj4 s LYS 79 Ca 0.36 1.30 -0.29 0.00 0.02 0.00 0.00 55.97 57.36 1hj4 s LYS 79 Cb -0.01 -1.92 -0.10 0.00 -0.52 0.00 0.00 37.83 35.28 1hj4 s LYS 79 CO 0.21 -1.49 1.36 0.00 -0.92 0.00 0.00 175.35 174.51 1hj4 s ALA 80 N -2.61 3.52 -0.21 5.17 0.00 -1.26 -4.44 121.76 121.94 1hj4 s ALA 80 Ca 0.64 1.34 0.11 0.00 0.00 0.00 0.00 51.96 54.06 1hj4 s ALA 80 Cb -0.19 -3.52 0.42 0.00 0.00 0.00 0.00 23.12 19.84 1hj4 s ALA 80 CO 0.49 -0.75 1.22 1.28 0.00 0.00 0.00 175.76 178.00 1hj4 n LEU 81 N 0.82 2.75 -4.77 0.00 4.77 0.69 -4.89 117.00 116.36 1hj4 n LEU 81 Ca 0.01 -3.87 -0.35 0.00 -0.03 0.00 0.00 56.01 51.77 1hj4 n LEU 81 Cb 0.41 -0.49 0.01 0.00 -2.33 0.00 0.00 43.42 41.02 1hj4 n LEU 81 CO 0.60 1.41 0.78 0.42 -1.33 0.00 0.00 177.39 179.27 1hj4 s THR 82 N -3.17 3.16 0.45 -5.08 -4.23 -1.16 -4.73 115.64 100.88 1hj4 s THR 82 Ca 0.39 0.69 0.19 0.00 -1.18 0.00 0.00 61.69 61.78 1hj4 s THR 82 Cb 0.37 -3.25 0.38 0.00 1.34 0.00 0.00 72.50 71.34 1hj4 s THR 82 CO -0.07 -0.19 1.91 -0.65 -0.54 0.00 0.00 174.62 175.08 1hj4 h PRO 83 N 1.00 0.30 -0.51 3.99 0.11 -1.83 -0.47 132.00 134.58 1hj4 h PRO 83 Ca -0.50 -0.02 -0.06 0.00 0.11 0.00 0.00 66.00 65.54 1hj4 h PRO 83 Cb 1.26 -0.07 -0.02 0.00 0.11 0.00 0.00 31.00 32.28 1hj4 h PRO 83 CO 0.56 0.20 0.09 0.38 -0.21 0.00 0.00 178.00 179.03 1hj4 h ASP 84 N 0.31 0.75 0.21 -2.05 2.03 -1.93 -2.23 116.42 113.51 1hj4 h ASP 84 Ca 0.39 -0.14 -0.33 0.00 -0.73 0.00 0.00 57.03 56.22 1hj4 h ASP 84 Cb 1.07 -0.20 0.02 0.00 -0.83 0.00 0.00 39.33 39.39 1hj4 h ASP 84 CO -0.11 0.76 -1.54 -0.07 -1.03 0.00 0.00 179.24 177.26 1hj4 h LEU 85 N 0.77 0.69 -0.73 0.15 3.38 -1.51 -3.31 115.31 114.74 1hj4 h LEU 85 Ca 0.17 -0.93 -0.12 0.00 0.09 0.00 0.00 57.88 57.08 1hj4 h LEU 85 Cb 0.33 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 1hj4 h LEU 85 CO 0.00 1.71 -0.37 0.71 0.09 0.00 0.00 178.44 180.59 1hj4 h THR 86 N 0.05 1.29 -0.27 0.22 1.35 -1.18 -2.71 112.91 111.66 1hj4 h THR 86 Ca -0.29 -1.51 -0.09 0.00 -0.55 0.00 0.00 66.41 63.97 1hj4 h THR 86 Cb 2.07 1.51 -0.01 0.00 -1.73 0.00 0.00 68.15 69.98 1hj4 h THR 86 CO 0.21 0.48 -0.22 0.03 -0.25 0.00 0.00 175.52 175.77 1hj4 h ARG 87 N 0.46 0.50 -0.51 4.72 3.08 -1.56 0.61 114.38 121.68 1hj4 h ARG 87 Ca 0.05 -0.17 -0.08 0.00 0.07 0.00 0.00 59.98 59.84 1hj4 h ARG 87 Cb 0.85 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.84 1hj4 h ARG 87 CO 0.07 0.68 -0.00 -0.44 -1.07 0.00 0.00 179.97 179.21 1hj4 h ASP 88 N 0.44 0.82 -0.27 7.04 5.19 -1.61 -2.93 116.42 125.11 1hj4 h ASP 88 Ca 0.07 -0.21 -0.12 0.00 -0.62 0.00 0.00 57.03 56.15 1hj4 h ASP 88 Cb 0.62 -0.22 -0.00 0.00 0.18 0.00 0.00 39.33 39.91 1hj4 h ASP 88 CO 0.04 0.89 -0.31 -0.07 -3.12 0.00 0.00 179.24 176.68 1hj4 h LEU 89 N 0.79 0.73 0.00 1.55 3.38 -1.13 -3.50 115.31 117.14 1hj4 h LEU 89 Ca 0.15 -0.49 0.00 0.00 0.09 0.00 0.00 57.88 57.63 1hj4 h LEU 89 Cb 0.48 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.02 1hj4 h LEU 89 CO 0.02 1.07 0.00 0.61 0.09 0.00 0.00 178.44 180.23 1hj4 n GLY 90 N 0.21 0.24 0.17 0.83 0.00 0.16 -4.37 105.19 102.43 1hj4 n GLY 90 Ca -0.04 -1.69 -0.08 0.00 0.00 0.00 0.00 46.02 44.21 1hj4 n GLY 90 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1hj4 h PHE 91 N 0.00 -0.28 -0.62 1.61 3.57 -1.88 -2.22 116.94 117.12 1hj4 h PHE 91 Ca 0.00 0.02 0.08 0.00 3.53 0.00 0.00 57.97 61.60 1hj4 h PHE 91 Cb 0.00 0.15 -0.06 0.00 2.79 0.00 0.00 35.95 38.83 1hj4 h PHE 91 CO 0.00 -0.17 0.28 -0.44 -2.23 0.00 0.00 178.31 175.74 1hj4 h ASP 92 N -0.11 0.34 -0.36 0.41 3.32 -1.99 0.20 116.42 118.24 1hj4 h ASP 92 Ca 0.11 0.06 -0.00 0.00 0.02 0.00 0.00 57.03 57.21 1hj4 h ASP 92 Cb 0.27 0.01 -0.02 0.00 0.22 0.00 0.00 39.33 39.81 1hj4 h ASP 92 CO -0.25 0.21 0.21 0.22 -1.72 0.00 0.00 179.24 177.91 1hj4 h TYR 93 N 0.50 0.48 -0.35 4.55 5.03 -1.69 -1.12 116.97 124.38 1hj4 h TYR 93 Ca 0.30 -0.01 -0.02 0.00 2.58 0.00 0.00 58.73 61.58 1hj4 h TYR 93 Cb 0.31 -0.16 -0.02 0.00 1.55 0.00 0.00 36.73 38.42 1hj4 h TYR 93 CO -0.13 0.36 0.13 -0.07 -1.32 0.00 0.00 178.16 177.13 1hj4 h LEU 94 N 0.46 0.50 -0.37 2.82 3.38 -0.79 -0.82 115.31 120.49 1hj4 h LEU 94 Ca 0.13 -0.18 0.02 0.00 0.09 0.00 0.00 57.88 57.93 1hj4 h LEU 94 Cb 0.03 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 1hj4 h LEU 94 CO -0.02 0.55 0.21 -0.61 0.09 0.00 0.00 178.44 178.66 1hj4 h GLN 95 N 0.42 0.42 -0.32 1.13 4.15 -0.50 -1.41 115.11 119.01 1hj4 h GLN 95 Ca 0.12 -0.03 -0.03 0.00 0.77 0.00 0.00 58.65 59.48 1hj4 h GLN 95 Cb 0.22 -0.10 -0.01 0.00 0.21 0.00 0.00 27.48 27.80 1hj4 h GLN 95 CO -0.01 0.28 0.09 1.03 -1.93 0.00 0.00 178.83 178.30 1hj4 h SER 96 N 0.44 0.48 -0.75 -0.69 0.87 -1.09 -1.77 113.55 111.03 1hj4 h SER 96 Ca 0.15 -0.21 -0.06 0.00 -1.23 0.00 0.00 61.79 60.43 1hj4 h SER 96 Cb 0.01 -0.13 -0.03 0.00 -0.44 0.00 0.00 62.40 61.81 1hj4 h SER 96 CO -0.07 0.56 0.23 0.15 -0.53 0.00 0.00 176.83 177.18 1hj4 h PHE 97 N 0.37 1.21 0.00 2.24 3.04 -0.96 -2.20 116.94 120.63 1hj4 h PHE 97 Ca 0.10 -0.12 -0.11 0.00 3.98 0.00 0.00 57.97 61.82 1hj4 h PHE 97 Cb 0.26 -0.35 -0.02 0.00 2.56 0.00 0.00 35.95 38.41 1hj4 h PHE 97 CO 0.01 0.95 -0.51 0.82 -2.02 0.00 0.00 178.31 177.56 1hj4 h ILE 98 N 1.12 1.34 0.22 1.41 2.04 -1.21 -0.46 117.51 121.96 1hj4 h ILE 98 Ca 0.24 -1.76 -0.01 0.00 1.00 0.00 0.00 64.86 64.34 1hj4 h ILE 98 Cb 0.31 1.95 0.00 0.00 -0.74 0.00 0.00 36.82 38.35 1hj4 h ILE 98 CO -0.01 0.50 -0.11 0.74 0.00 0.00 0.00 178.15 179.27 1hj4 h THR 99 N 0.00 0.50 0.00 -0.27 2.02 -0.83 -2.42 112.91 111.91 1hj4 h THR 99 Ca -0.01 -0.98 0.00 0.00 0.77 0.00 0.00 66.41 66.20 1hj4 h THR 99 Cb 0.91 0.86 0.00 0.00 -1.74 0.00 0.00 68.15 68.18 1hj4 h THR 99 CO 0.07 0.13 -1.00 -1.22 0.37 0.00 0.00 175.52 173.87 1hj4 n TYR 100 N -4.97 0.01 -4.64 3.16 4.01 -0.87 -1.51 117.16 112.35 1hj4 n TYR 100 Ca -0.07 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.68 1hj4 n TYR 100 Cb 0.23 -0.06 0.00 0.00 -0.31 0.00 0.00 39.34 39.20 1hj4 n TYR 100 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1hj4 n GLY 101 N 1.48 0.35 3.49 2.72 0.00 -0.18 -4.42 105.19 108.63 1hj4 n GLY 101 Ca 0.04 -0.86 -0.09 0.00 0.00 0.00 0.00 46.02 45.10 1hj4 n GLY 101 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1hj4 s SER 102 N -4.00 -0.18 0.55 1.61 1.04 -0.66 -4.91 113.70 107.16 1hj4 s SER 102 Ca 0.00 -0.60 0.31 0.00 0.48 0.00 0.00 55.95 56.14 1hj4 s SER 102 Cb 0.00 0.55 1.61 0.00 0.10 0.00 0.00 66.02 68.28 1hj4 s SER 102 CO 0.00 -1.03 2.11 -0.65 0.98 0.00 0.00 173.24 174.65 1hj4 h PRO 103 N 2.28 0.00 -1.18 4.02 0.11 -1.93 -3.23 132.00 132.07 1hj4 h PRO 103 Ca -0.29 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.75 1hj4 h PRO 103 Cb 1.25 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.32 1hj4 h PRO 103 CO 0.39 0.08 0.09 0.00 -0.21 0.00 0.00 178.00 178.35 1hj4 n ALA 104 N -2.22 3.19 0.00 -0.75 0.00 -1.26 -4.74 120.51 114.73 1hj4 n ALA 104 Ca -0.02 -0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.03 1hj4 n ALA 104 Cb 0.22 -1.07 0.00 0.00 0.00 0.00 0.00 19.45 18.60 1hj4 n ALA 104 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1hj4 n GLY 105 N 0.47 0.79 3.39 0.00 0.00 -1.24 -5.08 105.19 103.52 1hj4 n GLY 105 Ca 0.08 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.71 1hj4 n GLY 105 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1hj4 s MET 106 N -0.89 3.11 0.67 1.61 -2.45 -1.22 -5.04 119.30 115.09 1hj4 s MET 106 Ca 0.00 -0.87 -0.17 0.00 -1.25 0.00 0.00 55.69 53.40 1hj4 s MET 106 Cb 0.00 -3.54 0.00 0.00 1.25 0.00 0.00 34.83 32.55 1hj4 s MET 106 CO 0.00 -0.50 1.28 -2.14 1.05 0.00 0.00 175.02 174.71 1hj4 s PRO 107 N 1.55 2.42 -1.21 4.11 0.02 -1.26 -1.65 135.00 138.98 1hj4 s PRO 107 Ca 0.03 2.03 -0.14 0.00 0.02 0.00 0.00 61.00 62.93 1hj4 s PRO 107 Cb -0.18 -1.83 0.16 0.00 0.02 0.00 0.00 34.50 32.67 1hj4 s PRO 107 CO 0.05 -1.69 1.47 0.54 -0.33 0.00 0.00 177.00 177.03 1hj4 s ASN 108 N -1.50 7.03 0.25 2.53 4.22 -1.26 -3.98 114.94 122.23 1hj4 s ASN 108 Ca 0.81 -2.89 -0.05 0.00 -2.14 0.00 0.00 52.86 48.60 1hj4 s ASN 108 Cb -0.36 -2.43 0.34 0.00 1.28 0.00 0.00 41.25 40.08 1hj4 s ASN 108 CO 0.41 -0.81 1.87 -0.50 -2.04 0.00 0.00 177.10 176.03 1hj4 h TRP 109 N 7.27 1.10 0.13 1.54 4.06 -1.50 -2.08 115.95 126.47 1hj4 h TRP 109 Ca 0.33 0.03 -0.01 0.00 2.06 0.00 0.00 58.89 61.30 1hj4 h TRP 109 Cb 0.88 -0.36 0.00 0.00 -1.00 0.00 0.00 29.16 28.68 1hj4 h TRP 109 CO 1.15 0.59 -0.06 0.78 -3.56 0.00 0.00 178.44 177.34 1hj4 h GLY 110 N 1.10 -0.18 2.00 1.49 0.00 -1.20 -1.23 103.07 105.05 1hj4 h GLY 110 Ca 0.39 0.07 -0.00 0.00 0.00 0.00 0.00 47.33 47.79 1hj4 h GLY 110 CO -0.16 -0.06 -0.01 -0.91 0.00 0.00 0.00 176.54 175.41 1hj4 h THR 111 N -0.95 0.01 0.00 4.70 1.35 -1.32 -2.35 112.91 114.35 1hj4 h THR 111 Ca -0.02 -0.55 -0.01 0.00 -0.55 0.00 0.00 66.41 65.29 1hj4 h THR 111 Cb 0.47 1.54 -0.00 0.00 -1.73 0.00 0.00 68.15 68.43 1hj4 h THR 111 CO 0.03 0.00 -0.27 0.77 -0.25 0.00 0.00 175.52 175.81 1hj4 h SER 112 N 0.00 0.00 0.00 5.36 4.64 -1.52 -3.47 113.55 118.55 1hj4 h SER 112 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1hj4 h SER 112 Cb 0.54 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.63 1hj4 h SER 112 CO 0.00 0.03 0.00 0.61 -0.87 0.00 0.00 176.83 176.60 1hj4 n GLY 113 N 1.13 0.85 0.20 -0.77 0.00 -0.89 -4.94 105.19 100.77 1hj4 n GLY 113 Ca 0.03 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.03 1hj4 n GLY 113 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1hj4 h GLU 114 N 3.78 0.29 -5.84 1.61 4.39 -1.76 -3.39 114.58 113.66 1hj4 h GLU 114 Ca 0.00 -0.02 -0.67 0.00 0.34 0.00 0.00 59.36 59.01 1hj4 h GLU 114 Cb 0.00 -0.06 -0.25 0.00 -0.10 0.00 0.00 28.75 28.34 1hj4 h GLU 114 CO 0.00 0.19 -0.76 -0.51 -1.16 0.00 0.00 179.01 176.76 1hj4 s LEU 115 N -10.43 2.74 1.07 1.33 1.43 -0.48 -5.06 118.68 109.28 1hj4 s LEU 115 Ca -0.13 -0.25 -0.12 0.00 -1.03 0.00 0.00 54.13 52.60 1hj4 s LEU 115 Cb 0.15 -1.59 0.23 0.00 0.03 0.00 0.00 46.19 45.02 1hj4 s LEU 115 CO 0.73 0.26 1.06 -0.94 0.23 0.00 0.00 176.35 177.69 1hj4 s SER 116 N -0.22 1.84 0.33 2.29 1.04 -1.26 -4.32 113.70 113.39 1hj4 s SER 116 Ca 0.01 1.53 0.02 0.00 0.48 0.00 0.00 55.95 57.99 1hj4 s SER 116 Cb -0.13 -2.23 0.58 0.00 0.10 0.00 0.00 66.02 64.34 1hj4 s SER 116 CO 0.03 -3.67 1.96 0.00 0.98 0.00 0.00 173.24 172.54 1hj4 h ALA 117 N -2.26 1.46 -0.55 5.32 0.00 -1.96 -1.23 119.26 120.04 1hj4 h ALA 117 Ca -0.56 -0.09 -0.11 0.00 0.00 0.00 0.00 54.91 54.14 1hj4 h ALA 117 Cb 1.32 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.85 1hj4 h ALA 117 CO 0.51 0.45 -0.10 0.93 0.00 0.00 0.00 179.25 181.04 1hj4 h GLU 118 N 0.81 1.04 -0.28 0.00 4.39 -2.00 -2.69 114.58 115.85 1hj4 h GLU 118 Ca 0.21 -0.38 -0.10 0.00 0.34 0.00 0.00 59.36 59.42 1hj4 h GLU 118 Cb 0.02 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 28.59 1hj4 h GLU 118 CO -0.03 1.08 -0.26 1.96 -1.16 0.00 0.00 179.01 180.59 1hj4 h GLN 119 N 0.92 0.54 -0.16 2.33 4.20 -1.72 -1.61 115.11 119.61 1hj4 h GLN 119 Ca 0.14 -0.21 0.01 0.00 0.06 0.00 0.00 58.65 58.65 1hj4 h GLN 119 Cb 0.68 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.41 1hj4 h GLN 119 CO 0.05 0.76 0.08 0.28 -0.67 0.00 0.00 178.83 179.32 1hj4 h VAL 120 N 0.48 0.99 -0.75 -0.54 2.07 -1.09 -1.36 116.25 116.05 1hj4 h VAL 120 Ca 0.07 -0.06 -0.02 0.00 0.82 0.00 0.00 66.70 67.51 1hj4 h VAL 120 Cb 0.70 0.81 -0.04 0.00 -1.52 0.00 0.00 31.29 31.25 1hj4 h VAL 120 CO 0.05 0.03 0.37 0.44 0.02 0.00 0.00 177.57 178.49 1hj4 h ASP 121 N 0.17 0.95 -0.77 0.57 3.32 -1.22 -1.56 116.42 117.88 1hj4 h ASP 121 Ca 0.07 -0.10 0.04 0.00 0.02 0.00 0.00 57.03 57.06 1hj4 h ASP 121 Cb 0.02 -0.24 -0.05 0.00 0.22 0.00 0.00 39.33 39.27 1hj4 h ASP 121 CO -0.05 0.79 0.48 -0.07 -1.72 0.00 0.00 179.24 178.68 1hj4 h LEU 122 N 1.05 0.79 -0.49 1.55 3.38 -0.86 -1.38 115.31 119.35 1hj4 h LEU 122 Ca 0.26 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 58.08 1hj4 h LEU 122 Cb 0.08 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 1hj4 h LEU 122 CO -0.04 0.54 -0.36 0.24 0.09 0.00 0.00 178.44 178.91 1hj4 h MET 123 N 0.93 0.84 -0.43 1.13 2.86 -0.62 0.49 114.93 120.13 1hj4 h MET 123 Ca 0.31 -0.42 -0.01 0.00 -2.06 0.00 0.00 59.70 57.51 1hj4 h MET 123 Cb 0.04 0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.69 1hj4 h MET 123 CO -0.12 1.06 0.21 0.00 1.06 0.00 0.00 176.91 179.13 1hj4 h ALA 124 N 0.89 0.56 -0.46 6.32 0.00 -0.98 -0.89 119.26 124.69 1hj4 h ALA 124 Ca 0.06 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 1hj4 h ALA 124 Cb 0.93 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 1hj4 h ALA 124 CO 0.09 0.11 0.10 -0.91 0.00 0.00 0.00 179.25 178.63 1hj4 h ASN 125 N 0.56 0.71 -0.92 0.00 4.21 -1.15 -2.90 115.58 116.08 1hj4 h ASN 125 Ca 0.15 -0.24 0.07 0.00 1.21 0.00 0.00 56.30 57.49 1hj4 h ASN 125 Cb 0.10 -0.19 -0.06 0.00 -1.12 0.00 0.00 38.32 37.05 1hj4 h ASN 125 CO -0.02 0.77 0.60 0.22 -1.29 0.00 0.00 177.43 177.71 1hj4 h TYR 126 N 0.61 1.06 0.00 1.19 3.20 -0.52 -2.11 116.97 120.40 1hj4 h TYR 126 Ca 0.14 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 62.03 1hj4 h TYR 126 Cb 0.35 -0.35 -0.00 0.00 1.54 0.00 0.00 36.73 38.27 1hj4 h TYR 126 CO 0.02 0.54 -0.03 -0.07 -1.64 0.00 0.00 178.16 176.98 1hj4 h LEU 127 N 1.03 0.00 0.00 2.82 3.38 -0.96 -2.40 115.31 119.18 1hj4 h LEU 127 Ca 0.40 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.37 1hj4 h LEU 127 Cb 0.23 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.98 1hj4 h LEU 127 CO -0.16 0.03 -0.34 0.18 0.09 0.00 0.00 178.44 178.24 1hj4 n LEU 128 N -3.14 0.38 -4.93 1.67 4.77 -0.80 -4.31 117.00 110.64 1hj4 n LEU 128 Ca 0.01 0.20 -0.26 0.00 -0.03 0.00 0.00 56.01 55.93 1hj4 n LEU 128 Cb 0.33 -0.32 -0.03 0.00 -2.33 0.00 0.00 43.42 41.07 1hj4 n LEU 128 CO 0.28 0.05 0.07 -0.76 -1.33 0.00 0.00 177.39 175.70 1hj4 s LEU 129 N -3.20 4.17 -0.39 2.23 1.43 -0.90 -4.86 118.68 117.16 1hj4 s LEU 129 Ca 0.11 0.39 -0.25 0.00 -1.03 0.00 0.00 54.13 53.35 1hj4 s LEU 129 Cb 0.17 -3.19 0.02 0.00 0.03 0.00 0.00 46.19 43.22 1hj4 s LEU 129 CO 0.65 -0.12 0.90 -1.81 0.23 0.00 0.00 176.35 176.19 1hj4 s ASP 130 N -3.48 6.60 0.04 2.29 1.01 -1.26 -4.65 116.67 117.22 1hj4 s ASP 130 Ca 0.39 0.41 -0.30 0.00 0.71 0.00 0.00 52.55 53.75 1hj4 s ASP 130 Cb -0.10 -2.45 -0.05 0.00 1.01 0.00 0.00 42.92 41.33 1hj4 s ASP 130 CO 0.31 -0.89 1.22 -2.16 0.21 0.00 0.00 175.17 173.86 1hj4 s PRO 131 N 3.48 4.41 0.64 8.23 0.04 -1.26 -4.83 135.00 145.70 1hj4 s PRO 131 Ca 0.36 1.78 -0.18 0.00 0.04 0.00 0.00 61.00 63.01 1hj4 s PRO 131 Cb -0.12 -3.39 -0.02 0.00 0.04 0.00 0.00 34.50 31.02 1hj4 s PRO 131 CO 0.20 -0.31 1.27 0.00 0.04 0.00 0.00 177.00 178.21 1hj4 s ALA 132 N 1.31 2.41 0.30 8.56 0.00 -1.26 -4.92 121.76 128.16 1hj4 s ALA 132 Ca 0.59 1.16 -0.29 0.00 0.00 0.00 0.00 51.96 53.42 1hj4 s ALA 132 Cb -0.29 -3.53 -0.11 0.00 0.00 0.00 0.00 23.12 19.19 1hj4 s ALA 132 CO 0.28 -1.51 1.52 0.00 0.00 0.00 0.00 175.76 176.05 1hj4 s ALA 133 N -1.45 3.66 0.58 0.00 0.00 -1.26 -4.97 121.76 118.32 1hj4 s ALA 133 Ca 0.81 1.50 -0.19 0.00 0.00 0.00 0.00 51.96 54.08 1hj4 s ALA 133 Cb -0.36 -3.61 -0.04 0.00 0.00 0.00 0.00 23.12 19.11 1hj4 s ALA 133 CO 0.38 -0.92 1.15 -2.14 0.00 0.00 0.00 175.76 174.23 1hj4 s PRO 134 N -0.92 3.14 0.34 0.00 0.02 -1.26 -4.95 135.00 131.36 1hj4 s PRO 134 Ca 0.59 1.66 -0.29 0.00 0.02 0.00 0.00 61.00 62.98 1hj4 s PRO 134 Cb -0.46 -1.97 -0.11 0.00 0.02 0.00 0.00 34.50 31.98 1hj4 s PRO 134 CO 0.51 -1.03 1.49 -1.25 -0.33 0.00 0.00 177.00 176.38 1hj4 s PRO 135 N -3.40 4.16 0.86 5.54 0.04 -1.26 -5.03 135.00 135.91 1hj4 s PRO 135 Ca 0.74 2.50 -0.12 0.00 0.04 0.00 0.00 61.00 64.16 1hj4 s PRO 135 Cb -0.26 -3.01 0.14 0.00 0.04 0.00 0.00 34.50 31.42 1hj4 s PRO 135 CO 0.31 -0.51 1.21 -1.21 0.04 0.00 0.00 177.00 176.84 1hj4 s GLU 136 N -1.45 1.30 -0.42 4.56 0.41 -1.26 -4.72 118.70 117.12 1hj4 s GLU 136 Ca 0.56 -0.34 0.05 0.00 -0.41 0.00 0.00 54.97 54.82 1hj4 s GLU 136 Cb -0.46 -1.97 0.17 0.00 -1.78 0.00 0.00 34.13 30.09 1hj4 s GLU 136 CO 0.56 -1.94 0.47 0.12 -0.49 0.00 0.00 175.26 173.98 1hj4 s PHE 137 N -3.64 -0.44 0.00 1.61 2.19 -1.26 -5.01 117.98 111.44 1hj4 s PHE 137 Ca 0.68 -0.99 0.00 0.00 0.33 0.00 0.00 56.93 56.96 1hj4 s PHE 137 Cb -0.07 -0.28 0.00 0.00 -1.31 0.00 0.00 43.02 41.36 1hj4 s PHE 137 CO 0.50 -1.03 0.00 0.41 1.83 0.00 0.00 175.22 176.93 1hj4 n GLY 138 N 3.67 1.28 0.32 13.12 0.00 -1.26 -4.85 105.19 117.47 1hj4 n GLY 138 Ca 0.17 -1.93 -0.06 0.00 0.00 0.00 0.00 46.02 44.19 1hj4 n GLY 138 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1hj4 h MET 139 N 0.00 1.10 -0.36 1.61 4.05 -2.00 -0.66 114.93 118.66 1hj4 h MET 139 Ca 0.00 -0.21 -0.00 0.00 -0.28 0.00 0.00 59.70 59.21 1hj4 h MET 139 Cb 0.00 -0.17 -0.02 0.00 -0.80 0.00 0.00 31.60 30.61 1hj4 h MET 139 CO 0.00 0.91 0.21 -0.22 0.23 0.00 0.00 176.91 178.04 1hj4 h LYS 140 N 1.05 0.50 -0.51 0.39 3.64 -1.99 0.02 116.57 119.67 1hj4 h LYS 140 Ca 0.24 -0.05 -0.08 0.00 -1.27 0.00 0.00 60.65 59.49 1hj4 h LYS 140 Cb 0.24 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 31.94 1hj4 h LYS 140 CO -0.02 0.39 -0.01 0.93 -2.27 0.00 0.00 179.45 178.48 1hj4 h GLU 141 N 0.47 0.90 -0.21 1.90 3.07 -1.83 -1.63 114.58 117.25 1hj4 h GLU 141 Ca 0.13 -0.29 -0.01 0.00 -0.50 0.00 0.00 59.36 58.69 1hj4 h GLU 141 Cb 0.03 -0.08 -0.01 0.00 -0.84 0.00 0.00 28.75 27.85 1hj4 h GLU 141 CO -0.02 0.94 0.08 0.52 -1.40 0.00 0.00 179.01 179.13 1hj4 h MET 142 N 0.77 0.31 -0.09 2.33 2.86 -0.92 -2.59 114.93 117.59 1hj4 h MET 142 Ca 0.14 -0.05 -0.04 0.00 -2.06 0.00 0.00 59.70 57.69 1hj4 h MET 142 Cb 0.53 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 32.13 1hj4 h MET 142 CO 0.03 0.36 -0.13 0.00 1.06 0.00 0.00 176.91 178.23 1hj4 h ARG 143 N 0.18 0.14 -0.15 1.72 3.08 -0.84 -1.27 114.38 117.24 1hj4 h ARG 143 Ca 0.07 -0.03 -0.09 0.00 0.07 0.00 0.00 59.98 60.00 1hj4 h ARG 143 Cb 0.17 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.18 1hj4 h ARG 143 CO -0.01 0.27 -0.29 0.93 -1.07 0.00 0.00 179.97 179.81 1hj4 h GLU 144 N 0.13 0.29 0.00 0.04 5.08 -1.05 -2.59 114.58 116.49 1hj4 h GLU 144 Ca 0.03 -0.11 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 1hj4 h GLU 144 Cb 0.31 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.54 1hj4 h GLU 144 CO 0.02 0.56 -0.46 -1.13 -1.00 0.00 0.00 179.01 177.00 1hj4 n SER 145 N -4.12 0.47 -4.65 1.42 3.41 -0.77 -4.89 113.62 104.49 1hj4 n SER 145 Ca -0.01 -0.09 -0.43 0.00 -0.26 0.00 0.00 58.87 58.08 1hj4 n SER 145 Cb 0.40 0.14 -0.02 0.00 -0.26 0.00 0.00 64.21 64.46 1hj4 n SER 145 CO 0.00 0.00 0.00 0.86 -0.16 0.00 0.00 175.04 175.74 1hj4 s TRP 146 N -3.03 2.77 -0.09 7.33 -0.00 -0.55 -4.26 118.94 121.11 1hj4 s TRP 146 Ca 0.11 0.95 0.02 0.00 -0.00 0.00 0.00 56.10 57.17 1hj4 s TRP 146 Cb 0.17 -3.68 0.02 0.00 -0.00 0.00 0.00 33.47 29.98 1hj4 s TRP 146 CO 0.68 -1.71 -0.13 0.15 -0.00 0.00 0.00 176.95 175.94 1hj4 s LYS 147 N 3.80 1.91 -0.46 5.86 1.02 -0.19 -5.00 119.74 126.68 1hj4 s LYS 147 Ca 0.55 -0.45 -0.09 0.00 0.02 0.00 0.00 55.97 56.00 1hj4 s LYS 147 Cb -0.19 -1.66 0.11 0.00 -0.52 0.00 0.00 37.83 35.56 1hj4 s LYS 147 CO 0.18 -0.06 0.32 0.08 -0.92 0.00 0.00 175.35 174.95 1hj4 s VAL 148 N 0.99 4.23 0.04 3.17 1.01 -1.26 -0.72 120.40 127.85 1hj4 s VAL 148 Ca -0.08 -1.68 -0.19 0.00 0.00 0.00 0.00 61.98 60.03 1hj4 s VAL 148 Cb -0.15 -3.73 -0.16 0.00 0.00 0.00 0.00 36.38 32.34 1hj4 s VAL 148 CO -0.01 -0.70 1.28 0.45 0.00 0.00 0.00 175.10 176.12 1hj4 h HIS 149 N 8.45 0.55 -3.57 5.22 -0.00 -0.84 -3.41 115.15 121.54 1hj4 h HIS 149 Ca -0.22 -0.20 -0.62 0.00 -0.00 0.00 0.00 60.37 59.33 1hj4 h HIS 149 Cb 1.08 -0.10 -0.39 0.00 -0.00 0.00 0.00 27.41 28.00 1hj4 h HIS 149 CO 0.63 0.91 -0.76 0.08 -0.00 0.00 0.00 177.93 178.79 1hj4 s VAL 150 N -3.98 1.66 0.55 2.45 1.01 -0.86 -5.04 120.40 116.19 1hj4 s VAL 150 Ca -0.14 -1.61 -0.20 0.00 0.00 0.00 0.00 61.98 60.03 1hj4 s VAL 150 Cb 0.05 -2.06 -0.06 0.00 0.00 0.00 0.00 36.38 34.31 1hj4 s VAL 150 CO 0.78 -0.35 1.07 0.00 0.00 0.00 0.00 175.10 176.60 1hj4 n ALA 151 N 4.57 0.52 -0.34 5.51 0.00 -1.26 -4.82 120.51 124.69 1hj4 n ALA 151 Ca -0.06 0.08 0.17 0.00 0.00 0.00 0.00 53.44 53.63 1hj4 n ALA 151 Cb 0.43 -2.16 0.37 0.00 0.00 0.00 0.00 19.45 18.09 1hj4 n ALA 151 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1hj4 h PRO 152 N 0.94 0.53 -0.15 0.00 0.11 -1.96 0.60 132.00 132.08 1hj4 h PRO 152 Ca -0.48 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 65.59 1hj4 h PRO 152 Cb 1.34 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 1hj4 h PRO 152 CO 0.54 0.35 0.07 0.93 -0.21 0.00 0.00 178.00 179.68 1hj4 h GLU 153 N 0.55 0.19 -0.01 1.05 3.07 -2.00 -2.37 114.58 115.06 1hj4 h GLU 153 Ca 0.63 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 59.47 1hj4 h GLU 153 Cb 1.19 -0.04 0.00 0.00 -0.84 0.00 0.00 28.75 29.06 1hj4 h GLU 153 CO -0.49 0.15 -0.10 -0.25 -1.40 0.00 0.00 179.01 176.92 1hj4 n ASP 154 N -4.49 1.43 -4.92 1.42 8.00 0.19 -4.95 116.55 113.23 1hj4 n ASP 154 Ca -0.01 -1.31 -0.26 0.00 0.71 0.00 0.00 54.79 53.92 1hj4 n ASP 154 Cb 0.10 0.06 0.02 0.00 -0.02 0.00 0.00 41.12 41.28 1hj4 n ASP 154 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1hj4 s ARG 155 N -2.19 3.11 0.72 -1.24 0.52 -0.89 -4.96 118.95 114.01 1hj4 s ARG 155 Ca 0.32 -0.03 -0.16 0.00 -0.52 0.00 0.00 55.73 55.34 1hj4 s ARG 155 Cb 0.20 -2.34 0.02 0.00 0.52 0.00 0.00 34.95 33.35 1hj4 s ARG 155 CO 0.41 -0.50 1.11 -2.30 0.02 0.00 0.00 175.30 174.03 1hj4 n PRO 156 N -2.42 0.61 0.00 3.54 -0.02 -1.26 -4.93 135.00 130.52 1hj4 n PRO 156 Ca 0.03 0.27 0.10 0.00 -2.02 0.00 0.00 63.50 61.88 1hj4 n PRO 156 Cb 0.57 -2.35 -0.01 0.00 -0.02 0.00 0.00 33.50 31.69 1hj4 n PRO 156 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1hj4 n THR 157 N -2.51 0.00 -3.62 3.45 -2.24 -1.26 -4.96 114.28 103.14 1hj4 n THR 157 Ca 0.14 -0.27 -0.10 0.00 -2.27 0.00 0.00 64.05 61.54 1hj4 n THR 157 Cb 0.49 1.23 -0.04 0.00 -2.10 0.00 0.00 70.33 69.91 1hj4 n THR 157 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1hj4 s GLN 158 N -2.32 1.26 0.13 -0.78 -2.07 -1.26 -5.13 119.66 109.50 1hj4 s GLN 158 Ca 0.16 -0.71 -0.31 0.00 -1.82 0.00 0.00 55.36 52.68 1hj4 s GLN 158 Cb 0.16 0.52 -0.11 0.00 -1.09 0.00 0.00 33.01 32.50 1hj4 s GLN 158 CO 0.53 -0.53 1.83 -1.14 -1.32 0.00 0.00 175.29 174.67 1hj4 s GLN 159 N -3.82 4.13 -0.32 9.60 0.74 -1.26 -4.85 119.66 123.87 1hj4 s GLN 159 Ca 0.05 2.61 0.07 0.00 0.05 0.00 0.00 55.36 58.15 1hj4 s GLN 159 Cb -0.00 -3.56 0.48 0.00 1.10 0.00 0.00 33.01 31.04 1hj4 s GLN 159 CO -0.08 -0.84 1.44 0.39 -0.55 0.00 0.00 175.29 175.64 1hj4 n GLU 160 N 5.56 2.29 -4.19 1.67 1.02 0.16 -4.97 120.64 122.19 1hj4 n GLU 160 Ca 0.18 -3.44 -0.12 0.00 -0.02 0.00 0.00 57.16 53.76 1hj4 n GLU 160 Cb 0.38 -1.95 -0.10 0.00 -0.02 0.00 0.00 31.44 29.75 1hj4 n GLU 160 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1hj4 s ASN 161 N -2.77 0.16 -0.16 1.62 2.20 -1.26 -3.12 114.94 111.62 1hj4 s ASN 161 Ca 0.48 -1.37 0.16 0.00 -0.94 0.00 0.00 52.86 51.19 1hj4 s ASN 161 Cb 0.42 0.37 0.69 0.00 -2.00 0.00 0.00 41.25 40.73 1hj4 s ASN 161 CO -0.00 -0.83 1.61 -0.90 -2.94 0.00 0.00 177.10 174.04 1hj4 n ASP 162 N -0.25 4.81 -4.78 3.54 5.68 -1.26 -5.00 116.55 119.29 1hj4 n ASP 162 Ca 0.01 -2.67 -0.36 0.00 -0.50 0.00 0.00 54.79 51.27 1hj4 n ASP 162 Cb 0.66 -0.58 -0.01 0.00 -1.14 0.00 0.00 41.12 40.04 1hj4 n ASP 162 CO 0.00 0.00 0.00 0.26 -1.33 0.00 0.00 177.20 176.13 1hj4 s TRP 163 N -2.25 2.84 -1.01 2.11 0.52 -1.26 -4.96 118.94 114.94 1hj4 s TRP 163 Ca 0.49 1.55 -0.18 0.00 0.02 0.00 0.00 56.10 57.99 1hj4 s TRP 163 Cb 0.35 -3.28 0.14 0.00 -1.15 0.00 0.00 33.47 29.53 1hj4 s TRP 163 CO 0.19 -1.36 1.22 0.34 0.02 0.00 0.00 176.95 177.36 1hj4 s ASP 164 N -1.63 6.74 0.29 2.95 -1.08 -1.26 -4.88 116.67 117.81 1hj4 s ASP 164 Ca 0.67 -2.28 -0.01 0.00 -0.52 0.00 0.00 52.55 50.41 1hj4 s ASP 164 Cb -0.24 -2.41 0.48 0.00 -1.46 0.00 0.00 42.92 39.29 1hj4 s ASP 164 CO 0.29 -0.99 1.91 -0.07 0.52 0.00 0.00 175.17 176.83 1hj4 h LEU 165 N 10.32 0.96 -1.90 -1.34 3.38 -1.96 -2.24 115.31 122.52 1hj4 h LEU 165 Ca 0.20 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.16 1hj4 h LEU 165 Cb 0.98 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.52 1hj4 h LEU 165 CO 1.16 0.63 -0.10 -0.33 0.09 0.00 0.00 178.44 179.89 1hj4 h GLU 166 N 1.10 0.00 -0.56 1.13 5.08 -1.93 -2.04 114.58 117.36 1hj4 h GLU 166 Ca 0.39 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.75 1hj4 h GLU 166 Cb 0.14 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.39 1hj4 h GLU 166 CO -0.14 0.10 0.00 -1.71 -1.00 0.00 0.00 179.01 176.26 1hj4 n ASN 167 N -3.47 3.76 -4.78 1.42 5.15 -0.86 -1.71 115.26 114.77 1hj4 n ASN 167 Ca -0.01 -2.14 -0.37 0.00 -0.60 0.00 0.00 54.58 51.45 1hj4 n ASN 167 Cb 0.25 -0.42 -0.06 0.00 -0.53 0.00 0.00 39.78 39.02 1hj4 n ASN 167 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 1hj4 s LEU 168 N -1.26 4.33 -0.14 1.20 2.96 -0.77 -1.69 118.68 123.32 1hj4 s LEU 168 Ca 0.40 1.91 -0.02 0.00 -0.22 0.00 0.00 54.13 56.21 1hj4 s LEU 168 Cb 0.23 -4.00 -0.02 0.00 0.50 0.00 0.00 46.19 42.89 1hj4 s LEU 168 CO 0.24 -0.15 -0.09 -0.36 -1.32 0.00 0.00 176.35 174.68 1hj4 s PHE 169 N -1.57 2.91 -0.38 5.38 0.40 0.04 -1.12 117.98 123.65 1hj4 s PHE 169 Ca 0.51 -0.44 -0.14 0.00 -0.60 0.00 0.00 56.93 56.26 1hj4 s PHE 169 Cb -0.21 -1.88 0.01 0.00 0.51 0.00 0.00 43.02 41.45 1hj4 s PHE 169 CO 0.26 -0.10 0.26 0.45 0.70 0.00 0.00 175.22 176.80 1hj4 s SER 170 N 0.28 6.01 -0.17 1.36 0.15 0.34 -0.81 113.70 120.85 1hj4 s SER 170 Ca -0.06 -0.77 -0.00 0.00 0.70 0.00 0.00 55.95 55.81 1hj4 s SER 170 Cb -0.15 -2.12 0.00 0.00 -1.71 0.00 0.00 66.02 62.04 1hj4 s SER 170 CO 0.04 -0.37 -0.14 -0.69 1.20 0.00 0.00 173.24 173.28 1hj4 s VAL 171 N 1.67 2.73 0.08 4.45 1.01 -0.41 -0.96 120.40 128.97 1hj4 s VAL 171 Ca 0.05 -0.74 -0.31 0.00 0.00 0.00 0.00 61.98 60.98 1hj4 s VAL 171 Cb -0.18 -2.17 -0.07 0.00 0.00 0.00 0.00 36.38 33.95 1hj4 s VAL 171 CO 0.09 0.50 1.42 -0.89 0.00 0.00 0.00 175.10 176.22 1hj4 s THR 172 N 1.01 3.37 -0.98 3.92 2.01 0.53 0.08 115.64 125.57 1hj4 s THR 172 Ca -0.01 0.93 -0.04 0.00 0.31 0.00 0.00 61.69 62.88 1hj4 s THR 172 Cb -0.15 -3.59 0.26 0.00 0.01 0.00 0.00 72.50 69.03 1hj4 s THR 172 CO -0.03 0.05 1.02 0.18 -0.69 0.00 0.00 174.62 175.15 1hj4 n LEU 173 N 4.45 5.00 0.00 4.42 4.77 -0.36 -1.40 117.00 133.88 1hj4 n LEU 173 Ca 0.12 -5.15 0.00 0.00 -0.03 0.00 0.00 56.01 50.95 1hj4 n LEU 173 Cb 0.42 -1.20 0.00 0.00 -2.33 0.00 0.00 43.42 40.31 1hj4 n LEU 173 CO 0.59 1.58 0.38 -1.14 -1.33 0.00 0.00 177.39 177.47 1hj4 n ARG 174 N 2.06 0.00 0.15 3.23 0.63 -0.70 -2.02 116.66 120.01 1hj4 n ARG 174 Ca 0.24 0.76 0.13 0.00 -0.92 0.00 0.00 57.85 58.06 1hj4 n ARG 174 Cb 0.37 -1.15 0.53 0.00 0.45 0.00 0.00 32.46 32.66 1hj4 n ARG 174 CO 0.00 0.00 0.00 -0.44 -2.51 0.00 0.00 177.63 174.68 1hj4 h ASP 175 N 0.00 0.00 0.32 6.15 3.32 -1.79 -2.25 116.42 122.18 1hj4 h ASP 175 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1hj4 h ASP 175 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1hj4 h ASP 175 CO 0.00 0.00 -0.34 0.00 -1.72 0.00 0.00 179.24 177.18 1hj4 n ALA 176 N -1.82 3.24 -3.47 3.45 0.00 -0.86 -4.91 120.51 116.15 1hj4 n ALA 176 Ca 0.02 -0.39 -0.23 0.00 0.00 0.00 0.00 53.44 52.84 1hj4 n ALA 176 Cb 0.23 -1.13 0.07 0.00 0.00 0.00 0.00 19.45 18.62 1hj4 n ALA 176 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1hj4 n GLY 177 N 1.39 -0.51 3.24 0.00 0.00 -0.89 -4.91 105.19 103.52 1hj4 n GLY 177 Ca 0.10 0.21 -0.14 0.00 0.00 0.00 0.00 46.02 46.19 1hj4 n GLY 177 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1hj4 s GLN 178 N -6.17 1.35 0.09 1.61 -0.21 -1.16 -0.67 119.66 114.50 1hj4 s GLN 178 Ca 0.52 -1.74 0.04 0.00 0.02 0.00 0.00 55.36 54.21 1hj4 s GLN 178 Cb -0.23 0.18 -0.03 0.00 1.00 0.00 0.00 33.01 33.93 1hj4 s GLN 178 CO 0.65 -0.43 -0.11 0.96 -2.12 0.00 0.00 175.29 174.24 1hj4 s ILE 179 N -3.94 0.99 -0.13 1.08 -4.36 -0.02 -1.22 121.20 113.59 1hj4 s ILE 179 Ca 0.39 -1.56 0.00 0.00 -0.26 0.00 0.00 60.65 59.22 1hj4 s ILE 179 Cb 0.06 -1.28 -0.01 0.00 1.25 0.00 0.00 42.46 42.48 1hj4 s ILE 179 CO 0.15 -0.48 -0.14 0.00 0.24 0.00 0.00 174.94 174.71 1hj4 s ALA 180 N -2.15 2.56 -0.37 2.27 0.00 0.11 -1.02 121.76 123.16 1hj4 s ALA 180 Ca 0.04 -0.94 -0.18 0.00 0.00 0.00 0.00 51.96 50.88 1hj4 s ALA 180 Cb -0.05 -1.19 0.00 0.00 0.00 0.00 0.00 23.12 21.89 1hj4 s ALA 180 CO 0.01 0.18 0.48 -0.51 0.00 0.00 0.00 175.76 175.91 1hj4 s LEU 181 N 0.47 4.50 -0.10 0.00 1.43 -0.06 -1.28 118.68 123.64 1hj4 s LEU 181 Ca -0.10 -0.25 0.03 0.00 -1.03 0.00 0.00 54.13 52.78 1hj4 s LEU 181 Cb -0.16 -2.50 -0.01 0.00 0.03 0.00 0.00 46.19 43.55 1hj4 s LEU 181 CO 0.05 -0.50 -0.19 -0.63 0.23 0.00 0.00 176.35 175.30 1hj4 s ILE 182 N 2.30 2.51 0.09 -0.59 1.01 0.01 -0.11 121.20 126.42 1hj4 s ILE 182 Ca 0.16 -0.87 -0.31 0.00 0.00 0.00 0.00 60.65 59.63 1hj4 s ILE 182 Cb -0.16 -1.99 -0.08 0.00 0.01 0.00 0.00 42.46 40.24 1hj4 s ILE 182 CO 0.14 0.55 1.57 -0.62 0.00 0.00 0.00 174.94 176.58 1hj4 s ASP 183 N 0.17 6.66 0.58 3.58 -1.08 -0.12 -0.78 116.67 125.68 1hj4 s ASP 183 Ca -0.11 2.45 0.36 0.00 -0.52 0.00 0.00 52.55 54.73 1hj4 s ASP 183 Cb -0.16 -2.57 1.64 0.00 -1.46 0.00 0.00 42.92 40.37 1hj4 s ASP 183 CO 0.06 -0.83 2.08 1.23 0.52 0.00 0.00 175.17 178.24 1hj4 h GLY 184 N 7.94 0.00 0.00 2.66 0.00 -1.66 -0.88 103.07 111.13 1hj4 h GLY 184 Ca -0.42 0.00 -0.23 0.00 0.00 0.00 0.00 47.33 46.68 1hj4 h GLY 184 CO 0.92 0.00 -1.87 0.00 0.00 0.00 0.00 176.54 175.59 1hj4 n ALA 185 N -2.09 1.68 0.56 3.60 0.00 -1.26 -4.64 120.51 118.35 1hj4 n ALA 185 Ca -0.00 -0.70 0.11 0.00 0.00 0.00 0.00 53.44 52.85 1hj4 n ALA 185 Cb 0.25 0.11 -0.02 0.00 0.00 0.00 0.00 19.45 19.78 1hj4 n ALA 185 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1hj4 n THR 186 N -2.83 0.12 -1.38 0.00 -2.24 -1.25 -4.96 114.28 101.75 1hj4 n THR 186 Ca -0.25 -0.24 -0.13 0.00 -2.27 0.00 0.00 64.05 61.16 1hj4 n THR 186 Cb 0.82 0.30 -0.06 0.00 -2.10 0.00 0.00 70.33 69.29 1hj4 n THR 186 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1hj4 n TYR 187 N -1.93 0.00 -2.73 4.78 4.01 -0.33 -4.96 117.16 116.00 1hj4 n TYR 187 Ca 0.01 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.34 1hj4 n TYR 187 Cb 0.44 -2.39 -0.03 0.00 -0.31 0.00 0.00 39.34 37.05 1hj4 n TYR 187 CO 0.00 0.00 0.00 -2.00 -0.46 0.00 0.00 176.86 174.40 1hj4 s GLU 188 N -3.06 4.55 -0.57 -0.72 2.12 -1.25 -4.74 118.70 115.03 1hj4 s GLU 188 Ca 0.00 1.39 -0.27 0.00 0.36 0.00 0.00 54.97 56.45 1hj4 s GLU 188 Cb 0.00 -3.46 -0.01 0.00 0.26 0.00 0.00 34.13 30.92 1hj4 s GLU 188 CO 0.00 -0.05 1.70 0.42 -0.54 0.00 0.00 175.26 176.79 1hj4 s ILE 189 N 1.02 3.50 0.16 -3.70 1.01 -1.26 -0.95 121.20 120.97 1hj4 s ILE 189 Ca 0.51 0.37 -0.09 0.00 0.00 0.00 0.00 60.65 61.44 1hj4 s ILE 189 Cb -0.21 -4.09 -0.03 0.00 0.01 0.00 0.00 42.46 38.14 1hj4 s ILE 189 CO 0.27 -0.97 1.50 0.11 0.00 0.00 0.00 174.94 175.85 1hj4 h LYS 190 N 13.37 0.90 -1.81 2.79 1.79 -0.88 -3.47 116.57 129.26 1hj4 h LYS 190 Ca -0.27 -0.46 0.00 0.00 -2.18 0.00 0.00 60.65 57.74 1hj4 h LYS 190 Cb 1.14 0.01 -0.21 0.00 -1.58 0.00 0.00 32.23 31.59 1hj4 h LYS 190 CO 1.19 1.11 0.34 0.45 -1.08 0.00 0.00 179.45 181.46 1hj4 s SER 191 N -6.83 -0.54 -0.21 0.86 0.15 -1.14 -5.01 113.70 100.98 1hj4 s SER 191 Ca -0.11 0.62 0.00 0.00 0.70 0.00 0.00 55.95 57.16 1hj4 s SER 191 Cb 0.11 0.48 0.02 0.00 -1.71 0.00 0.00 66.02 64.92 1hj4 s SER 191 CO 0.87 -0.48 -0.15 -0.69 1.20 0.00 0.00 173.24 174.00 1hj4 s VAL 192 N -1.08 2.37 -0.07 4.45 1.01 -1.26 -0.88 120.40 124.95 1hj4 s VAL 192 Ca -0.07 -0.98 0.01 0.00 0.00 0.00 0.00 61.98 60.95 1hj4 s VAL 192 Cb -0.00 -2.09 -0.03 0.00 0.00 0.00 0.00 36.38 34.25 1hj4 s VAL 192 CO 0.06 0.40 -0.07 -0.76 0.00 0.00 0.00 175.10 174.73 1hj4 s LEU 193 N 1.30 3.15 -0.08 3.92 1.43 -0.19 -4.97 118.68 123.24 1hj4 s LEU 193 Ca 0.03 -0.03 -0.21 0.00 -1.03 0.00 0.00 54.13 52.88 1hj4 s LEU 193 Cb -0.15 -1.69 -0.04 0.00 0.03 0.00 0.00 46.19 44.35 1hj4 s LEU 193 CO -0.09 0.36 0.61 -1.81 0.23 0.00 0.00 176.35 175.65 1hj4 s ASP 194 N -0.82 6.87 0.00 2.29 1.11 -1.26 -0.84 116.67 124.02 1hj4 s ASP 194 Ca 0.12 1.05 0.00 0.00 0.18 0.00 0.00 52.55 53.90 1hj4 s ASP 194 Cb -0.11 -2.36 0.00 0.00 1.07 0.00 0.00 42.92 41.52 1hj4 s ASP 194 CO 0.01 -0.06 0.00 0.35 1.18 0.00 0.00 175.17 176.65 1hj4 n THR 195 N 3.70 0.00 -1.59 -1.27 -2.24 0.16 -4.95 114.28 108.09 1hj4 n THR 195 Ca -0.04 0.00 -0.31 0.00 -2.27 0.00 0.00 64.05 61.43 1hj4 n THR 195 Cb 0.51 0.00 0.05 0.00 -2.10 0.00 0.00 70.33 68.80 1hj4 n THR 195 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1hj4 s GLY 196 N 0.00 1.76 0.27 3.38 0.00 -1.26 -4.73 107.32 106.74 1hj4 s GLY 196 Ca 0.00 0.19 -0.30 0.00 0.00 0.00 0.00 44.72 44.61 1hj4 s GLY 196 CO 0.00 0.51 1.59 -0.47 0.00 0.00 0.00 173.10 174.73 1hj4 s TYR 197 N -2.89 2.81 -1.06 1.90 5.04 -1.26 -3.51 117.35 118.38 1hj4 s TYR 197 Ca 0.60 0.75 -0.19 0.00 -2.44 0.00 0.00 57.07 55.78 1hj4 s TYR 197 Cb -0.15 -4.05 0.01 0.00 0.35 0.00 0.00 41.96 38.13 1hj4 s TYR 197 CO 0.52 -3.58 0.70 0.00 -1.34 0.00 0.00 175.55 171.85 1hj4 n ALA 198 N 2.48 -2.64 -1.60 3.97 0.00 -0.92 -1.88 120.51 119.92 1hj4 n ALA 198 Ca 0.09 -0.36 -0.50 0.00 0.00 0.00 0.00 53.44 52.67 1hj4 n ALA 198 Cb 0.37 -2.50 -0.05 0.00 0.00 0.00 0.00 19.45 17.28 1hj4 n ALA 198 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1hj4 n VAL 199 N -3.93 0.29 0.00 0.00 0.24 -1.23 -3.04 118.33 110.65 1hj4 n VAL 199 Ca -0.15 -0.07 -0.22 0.00 -2.04 0.00 0.00 64.34 61.86 1hj4 n VAL 199 Cb 0.60 -0.95 -0.14 0.00 -1.47 0.00 0.00 33.84 31.89 1hj4 n VAL 199 CO 0.00 0.00 0.00 -0.74 -2.14 0.00 0.00 176.83 173.95 1hj4 h HIS 200 N 4.39 0.43 -3.69 6.34 2.76 -1.28 -3.46 115.15 120.63 1hj4 h HIS 200 Ca -0.46 -0.31 -0.10 0.00 -2.20 0.00 0.00 60.37 57.30 1hj4 h HIS 200 Cb 1.32 -0.02 -0.16 0.00 1.55 0.00 0.00 27.41 30.11 1hj4 h HIS 200 CO 0.58 1.62 -0.38 0.96 -1.30 0.00 0.00 177.93 179.41 1hj4 s ILE 201 N -2.49 0.13 -0.08 6.26 -4.36 -1.26 -4.78 121.20 114.61 1hj4 s ILE 201 Ca -0.21 -1.05 0.01 0.00 -0.26 0.00 0.00 60.65 59.14 1hj4 s ILE 201 Cb 0.05 -1.14 -0.03 0.00 1.25 0.00 0.00 42.46 42.60 1hj4 s ILE 201 CO 0.75 -0.58 -0.10 -0.44 0.24 0.00 0.00 174.94 174.82 1hj4 s SER 202 N -2.50 4.36 0.06 4.36 0.01 -1.26 -3.21 113.70 115.52 1hj4 s SER 202 Ca 0.00 -0.14 0.04 0.00 1.31 0.00 0.00 55.95 57.16 1hj4 s SER 202 Cb 0.02 -1.22 -0.03 0.00 0.21 0.00 0.00 66.02 65.00 1hj4 s SER 202 CO -0.08 0.30 -0.12 -0.13 0.41 0.00 0.00 173.24 173.63 1hj4 s ARG 203 N -0.43 0.70 -0.03 12.44 1.81 0.28 -4.93 118.95 128.79 1hj4 s ARG 203 Ca 0.06 -0.88 0.02 0.00 -1.72 0.00 0.00 55.73 53.21 1hj4 s ARG 203 Cb -0.12 -0.61 -0.03 0.00 -0.45 0.00 0.00 34.95 33.74 1hj4 s ARG 203 CO 0.02 0.13 -0.08 -0.51 -0.68 0.00 0.00 175.30 174.18 1hj4 s LEU 204 N -1.70 3.10 0.95 2.53 2.01 -1.26 -0.11 118.68 124.19 1hj4 s LEU 204 Ca -0.05 -0.11 -0.11 0.00 0.01 0.00 0.00 54.13 53.87 1hj4 s LEU 204 Cb -0.10 -1.73 0.16 0.00 0.01 0.00 0.00 46.19 44.54 1hj4 s LEU 204 CO 0.01 0.32 1.11 -0.94 1.01 0.00 0.00 176.35 177.87 1hj4 s SER 205 N -1.11 2.75 0.57 2.29 1.04 0.18 -4.65 113.70 114.77 1hj4 s SER 205 Ca 0.15 1.97 0.33 0.00 0.48 0.00 0.00 55.95 58.87 1hj4 s SER 205 Cb -0.11 -2.48 1.74 0.00 0.10 0.00 0.00 66.02 65.27 1hj4 s SER 205 CO 0.04 -3.17 2.16 0.00 0.98 0.00 0.00 173.24 173.26 1hj4 h ALA 206 N -1.91 1.21 0.00 5.32 0.00 -1.86 -0.88 119.26 121.13 1hj4 h ALA 206 Ca -0.47 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.39 1hj4 h ALA 206 Cb 1.28 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1hj4 h ALA 206 CO 0.45 0.07 -0.56 0.66 0.00 0.00 0.00 179.25 179.87 1hj4 h SER 207 N 0.00 0.00 0.00 0.00 4.64 -1.93 -3.48 113.55 112.78 1hj4 h SER 207 Ca -0.00 -0.17 0.00 0.00 -0.47 0.00 0.00 61.79 61.15 1hj4 h SER 207 Cb 0.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.32 1hj4 h SER 207 CO 0.01 0.09 0.00 0.61 -0.87 0.00 0.00 176.83 176.66 1hj4 n GLY 208 N 1.32 0.79 0.11 -0.77 0.00 -0.33 -4.93 105.19 101.38 1hj4 n GLY 208 Ca 0.03 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.86 1hj4 n GLY 208 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1hj4 h ARG 209 N 3.15 0.28 -5.36 1.61 2.43 -1.93 -3.46 114.38 111.11 1hj4 h ARG 209 Ca 0.00 -0.45 -0.62 0.00 -0.81 0.00 0.00 59.98 58.10 1hj4 h ARG 209 Cb 0.00 0.16 -0.15 0.00 -0.42 0.00 0.00 29.97 29.56 1hj4 h ARG 209 CO 0.00 1.20 -0.55 0.71 -1.51 0.00 0.00 179.97 179.82 1hj4 s TYR 210 N -2.51 3.29 -0.26 2.20 2.02 -1.26 -1.49 117.35 119.33 1hj4 s TYR 210 Ca -0.14 0.15 -0.08 0.00 -0.37 0.00 0.00 57.07 56.63 1hj4 s TYR 210 Cb 0.01 -2.06 -0.02 0.00 -0.40 0.00 0.00 41.96 39.49 1hj4 s TYR 210 CO 0.81 0.24 0.09 -1.17 -1.57 0.00 0.00 175.55 173.96 1hj4 s LEU 211 N 0.16 3.59 -0.15 -1.29 2.96 -0.30 -0.65 118.68 123.00 1hj4 s LEU 211 Ca 0.05 -0.27 -0.04 0.00 -0.22 0.00 0.00 54.13 53.65 1hj4 s LEU 211 Cb -0.12 -1.94 -0.03 0.00 0.50 0.00 0.00 46.19 44.60 1hj4 s LEU 211 CO 0.00 -0.07 -0.01 -0.36 -1.32 0.00 0.00 176.35 174.59 1hj4 s PHE 212 N 1.62 3.09 0.05 5.38 0.40 0.84 0.24 117.98 129.59 1hj4 s PHE 212 Ca 0.06 -0.15 0.06 0.00 -0.60 0.00 0.00 56.93 56.30 1hj4 s PHE 212 Cb -0.16 -1.96 -0.03 0.00 0.51 0.00 0.00 43.02 41.39 1hj4 s PHE 212 CO 0.04 0.07 -0.18 0.14 0.70 0.00 0.00 175.22 176.00 1hj4 s VAL 213 N 0.19 1.40 -0.12 -0.44 -7.23 -0.49 -0.56 120.40 113.16 1hj4 s VAL 213 Ca -0.00 -1.18 0.01 0.00 -1.81 0.00 0.00 61.98 59.00 1hj4 s VAL 213 Cb -0.13 -1.26 0.02 0.00 0.56 0.00 0.00 36.38 35.57 1hj4 s VAL 213 CO 0.02 0.05 -0.13 -0.51 -0.31 0.00 0.00 175.10 174.22 1hj4 s ILE 214 N -0.91 1.37 0.67 -0.62 2.07 -1.20 -1.37 121.20 121.22 1hj4 s ILE 214 Ca 0.04 -0.54 -0.11 0.00 -1.41 0.00 0.00 60.65 58.63 1hj4 s ILE 214 Cb -0.09 -1.29 -0.01 0.00 0.13 0.00 0.00 42.46 41.21 1hj4 s ILE 214 CO 0.02 0.42 1.07 -0.83 -1.91 0.00 0.00 174.94 173.71 1hj4 s GLY 215 N 1.28 1.64 0.52 1.50 0.00 0.76 -0.80 107.32 112.22 1hj4 s GLY 215 Ca -0.01 -0.24 0.20 0.00 0.00 0.00 0.00 44.72 44.66 1hj4 s GLY 215 CO -0.05 0.09 2.14 3.21 0.00 0.00 0.00 173.10 178.49 1hj4 h ARG 216 N -0.52 0.00 0.00 2.90 3.08 -1.29 -1.48 114.38 117.06 1hj4 h ARG 216 Ca -0.45 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.60 1hj4 h ARG 216 Cb 1.23 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.28 1hj4 h ARG 216 CO 0.63 0.04 0.00 -0.40 -1.07 0.00 0.00 179.97 179.17 1hj4 n ASP 217 N -4.29 0.00 0.00 7.04 5.68 -1.26 -1.20 116.55 122.52 1hj4 n ASP 217 Ca -0.03 -1.14 0.00 0.00 -0.50 0.00 0.00 54.79 53.13 1hj4 n ASP 217 Cb 0.12 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.10 1hj4 n ASP 217 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1hj4 n GLY 218 N 0.72 0.69 3.68 6.12 0.00 -0.56 -4.43 105.19 111.42 1hj4 n GLY 218 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 1hj4 n GLY 218 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1hj4 s LYS 219 N -0.32 4.33 -0.16 1.61 2.47 -1.25 -0.88 119.74 125.55 1hj4 s LYS 219 Ca 0.00 0.94 -0.04 0.00 -1.56 0.00 0.00 55.97 55.31 1hj4 s LYS 219 Cb 0.00 -3.53 -0.03 0.00 -1.46 0.00 0.00 37.83 32.81 1hj4 s LYS 219 CO 0.00 -0.19 -0.03 0.08 0.16 0.00 0.00 175.35 175.37 1hj4 s VAL 220 N 1.69 3.96 -0.04 4.02 1.01 0.10 -0.17 120.40 130.98 1hj4 s VAL 220 Ca 0.37 -0.33 0.05 0.00 0.00 0.00 0.00 61.98 62.07 1hj4 s VAL 220 Cb -0.17 -2.74 -0.02 0.00 0.00 0.00 0.00 36.38 33.45 1hj4 s VAL 220 CO 0.14 0.49 -0.19 0.20 0.00 0.00 0.00 175.10 175.75 1hj4 s ASN 221 N 0.36 3.64 -0.16 3.32 0.01 -0.47 -1.55 114.94 120.09 1hj4 s ASN 221 Ca -0.04 -0.31 0.00 0.00 -0.71 0.00 0.00 52.86 51.81 1hj4 s ASN 221 Cb -0.14 -0.68 0.00 0.00 0.41 0.00 0.00 41.25 40.84 1hj4 s ASN 221 CO 0.03 0.33 -0.16 -0.32 -1.51 0.00 0.00 177.10 175.47 1hj4 s MET 222 N -0.64 3.19 -0.09 -0.60 -2.45 -0.29 -1.39 119.30 117.02 1hj4 s MET 222 Ca 0.10 -0.76 0.03 0.00 -1.25 0.00 0.00 55.69 53.81 1hj4 s MET 222 Cb -0.11 -2.63 -0.01 0.00 1.25 0.00 0.00 34.83 33.33 1hj4 s MET 222 CO 0.00 -0.02 -0.19 0.42 1.05 0.00 0.00 175.02 176.28 1hj4 s ILE 223 N 0.91 2.61 -0.46 10.11 1.01 0.14 -0.62 121.20 134.89 1hj4 s ILE 223 Ca -0.04 -0.85 -0.19 0.00 0.00 0.00 0.00 60.65 59.57 1hj4 s ILE 223 Cb -0.15 -2.02 0.04 0.00 0.01 0.00 0.00 42.46 40.33 1hj4 s ILE 223 CO -0.02 0.56 0.58 -0.62 0.00 0.00 0.00 174.94 175.44 1hj4 s ASP 224 N -0.04 6.24 0.00 3.58 -1.08 -1.05 -1.15 116.67 123.18 1hj4 s ASP 224 Ca -0.05 -0.68 0.23 0.00 -0.52 0.00 0.00 52.55 51.53 1hj4 s ASP 224 Cb -0.14 -2.28 1.22 0.00 -1.46 0.00 0.00 42.92 40.25 1hj4 s ASP 224 CO 0.04 -0.77 1.76 0.18 0.52 0.00 0.00 175.17 176.90 1hj4 n LEU 225 N 6.04 0.00 0.00 -1.34 4.77 -0.56 -2.87 117.00 123.04 1hj4 n LEU 225 Ca -0.05 0.22 0.12 0.00 -0.03 0.00 0.00 56.01 56.27 1hj4 n LEU 225 Cb 0.47 -0.22 0.32 0.00 -2.33 0.00 0.00 43.42 41.66 1hj4 n LEU 225 CO 0.52 -0.05 0.56 0.79 -1.33 0.00 0.00 177.39 177.87 1hj4 n TRP 226 N -1.22 0.04 -2.02 -1.77 7.02 -1.26 -4.84 117.44 113.40 1hj4 n TRP 226 Ca 0.12 0.01 -0.34 0.00 -1.02 0.00 0.00 57.50 56.28 1hj4 n TRP 226 Cb 0.16 -0.33 0.02 0.00 -2.42 0.00 0.00 31.31 28.74 1hj4 n TRP 226 CO 0.00 0.00 0.00 -1.64 -2.02 0.00 0.00 177.69 174.03 1hj4 s MET 227 N -3.01 3.08 0.22 -0.99 -1.94 -1.14 0.41 119.30 115.92 1hj4 s MET 227 Ca 0.11 1.52 -0.09 0.00 -1.71 0.00 0.00 55.69 55.52 1hj4 s MET 227 Cb 0.18 -1.98 0.33 0.00 2.01 0.00 0.00 34.83 35.37 1hj4 s MET 227 CO 0.67 -1.05 1.69 -0.22 -0.01 0.00 0.00 175.02 176.09 1hj4 h LYS 228 N 0.65 0.20 -2.87 2.03 1.63 -1.90 -3.21 116.57 113.10 1hj4 h LYS 228 Ca -0.49 -0.01 -0.61 0.00 -0.85 0.00 0.00 60.65 58.69 1hj4 h LYS 228 Cb 1.26 -0.05 -0.40 0.00 -0.60 0.00 0.00 32.23 32.44 1hj4 h LYS 228 CO 0.55 0.13 -0.73 -1.21 -3.45 0.00 0.00 179.45 174.75 1hj4 s GLU 229 N -6.11 1.70 0.08 1.90 2.02 -1.26 -4.76 118.70 112.28 1hj4 s GLU 229 Ca -0.13 -2.62 -0.36 0.00 0.02 0.00 0.00 54.97 51.88 1hj4 s GLU 229 Cb 0.19 -2.58 -0.18 0.00 0.10 0.00 0.00 34.13 31.66 1hj4 s GLU 229 CO 0.74 -1.27 1.06 -2.30 0.02 0.00 0.00 175.26 173.51 1hj4 n PRO 230 N 2.67 0.48 -3.98 0.39 -0.02 -1.21 -4.97 135.00 128.36 1hj4 n PRO 230 Ca 0.19 0.17 -0.12 0.00 -2.02 0.00 0.00 63.50 61.72 1hj4 n PRO 230 Cb 0.38 -1.63 -0.02 0.00 -0.02 0.00 0.00 33.50 32.22 1hj4 n PRO 230 CO 0.00 0.00 0.00 -0.08 1.98 0.00 0.00 175.50 177.40 1hj4 s THR 231 N -0.10 0.00 -0.02 3.45 -1.32 -1.26 -4.98 115.64 111.41 1hj4 s THR 231 Ca 0.82 -1.36 -0.30 0.00 -1.21 0.00 0.00 61.69 59.64 1hj4 s THR 231 Cb -1.06 -2.71 -0.06 0.00 -1.51 0.00 0.00 72.50 67.16 1hj4 s THR 231 CO 0.54 0.00 1.49 -0.89 -2.21 0.00 0.00 174.62 173.55 1hj4 s THR 232 N -2.80 3.62 -0.16 5.08 2.01 -1.26 -2.53 115.64 119.60 1hj4 s THR 232 Ca 0.24 0.94 0.21 0.00 0.31 0.00 0.00 61.69 63.39 1hj4 s THR 232 Cb -0.02 -3.60 -0.31 0.00 0.01 0.00 0.00 72.50 68.58 1hj4 s THR 232 CO 0.16 -0.03 0.51 1.33 -0.69 0.00 0.00 174.62 175.91 1hj4 n VAL 233 N 4.94 0.00 -3.55 3.82 0.24 0.21 -4.73 118.33 119.26 1hj4 n VAL 233 Ca 0.15 -0.41 -0.17 0.00 -2.04 0.00 0.00 64.34 61.86 1hj4 n VAL 233 Cb 0.43 0.16 -0.06 0.00 -1.47 0.00 0.00 33.84 32.90 1hj4 n VAL 233 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1hj4 s ALA 234 N -3.37 -1.68 0.05 2.33 0.00 -1.18 -0.15 121.76 117.77 1hj4 s ALA 234 Ca -0.05 1.27 -0.08 0.00 0.00 0.00 0.00 51.96 53.09 1hj4 s ALA 234 Cb 0.14 -0.06 -0.00 0.00 0.00 0.00 0.00 23.12 23.19 1hj4 s ALA 234 CO 0.86 -0.36 0.17 -1.83 0.00 0.00 0.00 175.76 174.60 1hj4 s GLU 235 N -1.11 0.72 0.00 0.00 -1.05 0.10 -1.14 118.70 116.22 1hj4 s GLU 235 Ca -0.11 -0.76 -0.28 0.00 -0.15 0.00 0.00 54.97 53.67 1hj4 s GLU 235 Cb -0.01 0.29 0.09 0.00 -0.44 0.00 0.00 34.13 34.06 1hj4 s GLU 235 CO 0.09 -0.21 0.75 -1.50 0.95 0.00 0.00 175.26 175.34 1hj4 s ILE 236 N -2.99 0.00 -0.13 1.83 2.07 -0.59 -1.02 121.20 120.37 1hj4 s ILE 236 Ca -0.02 0.00 -0.02 0.00 -1.41 0.00 0.00 60.65 59.21 1hj4 s ILE 236 Cb 0.01 -1.00 -0.02 0.00 0.13 0.00 0.00 42.46 41.58 1hj4 s ILE 236 CO -0.06 0.00 -0.08 -0.75 -1.91 0.00 0.00 174.94 172.14 1hj4 s LYS 237 N -2.32 3.41 0.00 3.50 2.20 -1.26 0.03 119.74 125.30 1hj4 s LYS 237 Ca -0.03 -0.59 0.07 0.00 -0.36 0.00 0.00 55.97 55.07 1hj4 s LYS 237 Cb -0.01 -2.75 0.04 0.00 -1.51 0.00 0.00 37.83 33.59 1hj4 s LYS 237 CO -0.02 0.30 0.65 0.44 -0.36 0.00 0.00 175.35 176.36 1hj4 n ILE 238 N 3.31 0.00 -3.26 5.43 -6.64 -0.06 -4.51 119.36 113.63 1hj4 n ILE 238 Ca -0.18 -0.47 0.00 0.00 -1.77 0.00 0.00 62.75 60.33 1hj4 n ILE 238 Cb 0.53 1.12 0.00 0.00 -1.44 0.00 0.00 39.64 39.85 1hj4 n ILE 238 CO 0.00 0.00 0.00 0.61 -1.77 0.00 0.00 176.55 175.39 1hj4 n GLY 239 N 0.53 -1.15 0.12 3.28 0.00 -1.26 -4.85 105.19 101.85 1hj4 n GLY 239 Ca 0.04 -0.88 -0.15 0.00 0.00 0.00 0.00 46.02 45.03 1hj4 n GLY 239 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1hj4 n SER 240 N 0.66 1.27 -3.83 1.61 7.64 0.56 -4.35 113.62 117.18 1hj4 n SER 240 Ca 0.00 0.07 -0.20 0.00 1.01 0.00 0.00 58.87 59.74 1hj4 n SER 240 Cb 0.00 -0.06 -0.17 0.00 -1.01 0.00 0.00 64.21 62.98 1hj4 n SER 240 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 1hj4 s GLU 241 N -2.53 0.62 0.03 1.43 0.41 -0.80 -4.33 118.70 113.53 1hj4 s GLU 241 Ca -0.20 0.02 -0.10 0.00 -0.41 0.00 0.00 54.97 54.28 1hj4 s GLU 241 Cb 0.07 -0.81 0.01 0.00 -1.78 0.00 0.00 34.13 31.62 1hj4 s GLU 241 CO 0.74 -0.18 0.21 0.00 -0.49 0.00 0.00 175.26 175.53 1hj4 s ALA 242 N 1.36 -0.42 0.00 5.21 0.00 -0.34 -0.04 121.76 127.54 1hj4 s ALA 242 Ca -0.04 -0.19 0.00 0.00 0.00 0.00 0.00 51.96 51.72 1hj4 s ALA 242 Cb -0.13 0.25 0.00 0.00 0.00 0.00 0.00 23.12 23.24 1hj4 s ALA 242 CO -0.02 -0.34 0.00 0.54 0.00 0.00 0.00 175.76 175.94 1hj4 n ARG 243 N 0.81 2.82 -4.23 0.00 5.12 -1.21 -4.06 116.66 115.90 1hj4 n ARG 243 Ca -0.19 0.00 -0.18 0.00 -1.93 0.00 0.00 57.85 55.55 1hj4 n ARG 243 Cb 0.58 -0.31 -0.13 0.00 -1.16 0.00 0.00 32.46 31.45 1hj4 n ARG 243 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 1hj4 s SER 244 N -0.27 1.46 -0.09 0.55 1.04 -1.24 -4.57 113.70 110.57 1hj4 s SER 244 Ca 0.00 -0.50 -0.19 0.00 0.48 0.00 0.00 55.95 55.73 1hj4 s SER 244 Cb 0.00 -0.06 0.04 0.00 0.10 0.00 0.00 66.02 66.10 1hj4 s SER 244 CO 0.00 -0.04 0.47 -0.51 0.98 0.00 0.00 173.24 174.14 1hj4 s ILE 245 N -1.04 0.02 0.12 -1.02 2.07 -1.26 -0.99 121.20 119.11 1hj4 s ILE 245 Ca -0.02 -0.17 -0.16 0.00 -1.41 0.00 0.00 60.65 58.89 1hj4 s ILE 245 Cb -0.09 -0.73 0.04 0.00 0.13 0.00 0.00 42.46 41.81 1hj4 s ILE 245 CO 0.01 -0.09 0.41 -0.70 -1.91 0.00 0.00 174.94 172.66 1hj4 s GLU 246 N -0.63 1.07 0.22 3.50 2.56 -0.22 -4.85 118.70 120.35 1hj4 s GLU 246 Ca -0.07 -0.67 0.11 0.00 0.00 0.00 0.00 54.97 54.33 1hj4 s GLU 246 Cb -0.03 0.47 -0.04 0.00 2.00 0.00 0.00 34.13 36.52 1hj4 s GLU 246 CO 0.04 -0.42 -0.16 0.95 -0.56 0.00 0.00 175.26 175.12 1hj4 s THR 247 N -3.71 2.77 0.01 -1.70 -4.23 -1.26 -0.60 115.64 106.92 1hj4 s THR 247 Ca 0.02 -2.00 -0.30 0.00 -1.18 0.00 0.00 61.69 58.23 1hj4 s THR 247 Cb 0.02 -2.39 -0.07 0.00 1.34 0.00 0.00 72.50 71.40 1hj4 s THR 247 CO -0.11 -0.22 1.56 -0.94 -0.54 0.00 0.00 174.62 174.37 1hj4 s SER 248 N -3.05 6.71 0.00 3.99 1.04 -0.53 -4.68 113.70 117.18 1hj4 s SER 248 Ca 0.26 2.29 0.00 0.00 0.48 0.00 0.00 55.95 58.98 1hj4 s SER 248 Cb -0.07 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.50 1hj4 s SER 248 CO 0.14 -0.84 0.98 0.29 0.98 0.00 0.00 173.24 174.80 1hj4 n LYS 249 N 5.88 2.84 -2.56 4.02 5.02 -1.26 -4.33 118.16 127.78 1hj4 n LYS 249 Ca 0.15 -1.47 -0.41 0.00 -2.02 0.00 0.00 58.31 54.56 1hj4 n LYS 249 Cb 0.42 -1.00 -0.04 0.00 -0.02 0.00 0.00 35.03 34.39 1hj4 n LYS 249 CO 0.00 0.00 0.00 1.41 -0.52 0.00 0.00 177.40 178.29 1hj4 s MET 250 N -0.96 4.58 0.18 1.97 1.75 -1.18 -4.62 119.30 121.02 1hj4 s MET 250 Ca 0.00 1.65 -0.33 0.00 -1.25 0.00 0.00 55.69 55.76 1hj4 s MET 250 Cb 0.00 -3.33 -0.14 0.00 2.84 0.00 0.00 34.83 34.20 1hj4 s MET 250 CO 0.00 0.02 1.41 -1.91 -0.65 0.00 0.00 175.02 173.89 1hj4 n GLU 251 N 2.90 1.79 0.00 4.11 2.13 -1.26 -0.78 120.64 129.52 1hj4 n GLU 251 Ca 0.04 0.64 0.00 0.00 0.66 0.00 0.00 57.16 58.50 1hj4 n GLU 251 Cb 0.47 -2.30 0.00 0.00 0.27 0.00 0.00 31.44 29.88 1hj4 n GLU 251 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1hj4 n GLY 252 N 2.57 1.87 0.73 8.31 0.00 -1.26 -4.88 105.19 112.53 1hj4 n GLY 252 Ca 0.15 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.21 1hj4 n GLY 252 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1hj4 n TRP 253 N -2.00 0.54 -1.82 1.61 7.02 0.04 -5.01 117.44 117.81 1hj4 n TRP 253 Ca 0.00 -1.32 -0.42 0.00 -1.02 0.00 0.00 57.50 54.74 1hj4 n TRP 253 Cb 0.00 -0.32 -0.03 0.00 -2.42 0.00 0.00 31.31 28.54 1hj4 n TRP 253 CO 0.00 0.00 0.00 -1.21 -2.02 0.00 0.00 177.69 174.46 1hj4 s GLU 254 N -3.09 4.16 0.00 -0.99 8.01 -1.26 -2.15 118.70 123.39 1hj4 s GLU 254 Ca 0.40 2.50 0.00 0.00 0.01 0.00 0.00 54.97 57.88 1hj4 s GLU 254 Cb 0.36 -3.09 0.00 0.00 -4.31 0.00 0.00 34.13 27.08 1hj4 s GLU 254 CO 0.00 -0.66 0.00 -0.25 0.01 0.00 0.00 175.26 174.36 1hj4 n ASP 255 N 3.57 -4.02 -0.03 -0.19 8.00 -1.26 -4.88 116.55 117.74 1hj4 n ASP 255 Ca 0.13 0.00 -0.14 0.00 0.71 0.00 0.00 54.79 55.49 1hj4 n ASP 255 Cb 0.37 -2.38 -0.10 0.00 -0.02 0.00 0.00 41.12 38.99 1hj4 n ASP 255 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 1hj4 h LYS 256 N 0.44 0.21 -4.22 -1.24 1.79 -1.75 -3.35 116.57 108.45 1hj4 h LYS 256 Ca 0.00 -0.17 -0.13 0.00 -2.18 0.00 0.00 60.65 58.17 1hj4 h LYS 256 Cb 0.54 0.03 -0.16 0.00 -1.58 0.00 0.00 32.23 31.07 1hj4 h LYS 256 CO 0.00 0.82 -0.68 0.71 -1.08 0.00 0.00 179.45 179.21 1hj4 s TYR 257 N -3.61 0.50 0.14 -1.35 2.02 -1.26 -0.76 117.35 113.03 1hj4 s TYR 257 Ca -0.15 -0.97 0.07 0.00 -0.37 0.00 0.00 57.07 55.65 1hj4 s TYR 257 Cb 0.02 -0.37 -0.04 0.00 -0.40 0.00 0.00 41.96 41.18 1hj4 s TYR 257 CO 0.74 -0.34 -0.16 0.00 -1.57 0.00 0.00 175.55 174.22 1hj4 s ALA 258 N -3.49 1.73 -0.01 3.71 0.00 -0.37 -1.45 121.76 121.87 1hj4 s ALA 258 Ca 0.03 -1.38 0.01 0.00 0.00 0.00 0.00 51.96 50.63 1hj4 s ALA 258 Cb 0.05 -0.13 0.00 0.00 0.00 0.00 0.00 23.12 23.04 1hj4 s ALA 258 CO -0.08 0.17 -0.05 -1.50 0.00 0.00 0.00 175.76 174.30 1hj4 s ILE 259 N -2.05 0.43 0.06 0.00 2.07 0.23 -0.09 121.20 121.85 1hj4 s ILE 259 Ca 0.12 -0.18 0.08 0.00 -1.41 0.00 0.00 60.65 59.26 1hj4 s ILE 259 Cb -0.05 -0.40 -0.03 0.00 0.13 0.00 0.00 42.46 42.10 1hj4 s ILE 259 CO 0.05 0.15 -0.23 0.00 -1.91 0.00 0.00 174.94 172.99 1hj4 s ALA 260 N 0.19 1.99 -0.04 1.50 0.00 -0.23 -1.05 121.76 124.12 1hj4 s ALA 260 Ca -0.02 -1.19 0.05 0.00 0.00 0.00 0.00 51.96 50.80 1hj4 s ALA 260 Cb -0.06 -0.38 -0.02 0.00 0.00 0.00 0.00 23.12 22.66 1hj4 s ALA 260 CO -0.00 0.45 -0.18 0.20 0.00 0.00 0.00 175.76 176.22 1hj4 s GLY 261 N -1.36 1.44 0.08 0.00 0.00 -0.16 -0.87 107.32 106.44 1hj4 s GLY 261 Ca 0.09 -1.03 0.10 0.00 0.00 0.00 0.00 44.72 43.88 1hj4 s GLY 261 CO 0.03 -0.81 -0.26 0.00 0.00 0.00 0.00 173.10 172.06 1hj4 s ALA 262 N -0.66 2.33 0.01 3.20 0.00 -0.22 -3.36 121.76 123.07 1hj4 s ALA 262 Ca 0.10 -1.34 -0.19 0.00 0.00 0.00 0.00 51.96 50.54 1hj4 s ALA 262 Cb -0.11 -0.46 -0.26 0.00 0.00 0.00 0.00 23.12 22.29 1hj4 s ALA 262 CO 0.00 0.54 1.06 1.88 0.00 0.00 0.00 175.76 179.24 1hj4 h TYR 263 N 4.42 0.72 -3.17 0.00 -1.99 -0.68 -2.32 116.97 113.95 1hj4 h TYR 263 Ca -0.48 -0.43 -0.24 0.00 2.00 0.00 0.00 58.73 59.58 1hj4 h TYR 263 Cb 1.15 -0.07 -0.32 0.00 2.00 0.00 0.00 36.73 39.50 1hj4 h TYR 263 CO 0.53 1.28 -0.58 -0.46 -0.00 0.00 0.00 178.16 178.93 1hj4 s TRP 264 N -3.00 -0.21 1.00 4.88 -0.11 -1.04 -3.76 118.94 116.70 1hj4 s TRP 264 Ca -0.12 0.58 -0.12 0.00 1.22 0.00 0.00 56.10 57.66 1hj4 s TRP 264 Cb 0.04 -0.07 0.19 0.00 -1.50 0.00 0.00 33.47 32.12 1hj4 s TRP 264 CO 0.86 -0.20 1.08 -2.14 -4.62 0.00 0.00 176.95 171.93 1hj4 s PRO 265 N 1.36 0.44 -0.79 5.86 0.02 -1.26 -0.32 135.00 140.30 1hj4 s PRO 265 Ca -0.07 0.76 -0.26 0.00 0.02 0.00 0.00 61.00 61.45 1hj4 s PRO 265 Cb -0.11 -1.72 0.01 0.00 0.02 0.00 0.00 34.50 32.69 1hj4 s PRO 265 CO -0.07 -2.79 1.59 -2.14 -0.33 0.00 0.00 177.00 173.26 1hj4 s PRO 266 N -4.82 3.01 0.01 5.54 0.02 -1.25 -4.55 135.00 132.96 1hj4 s PRO 266 Ca 0.65 -0.21 -0.29 0.00 0.02 0.00 0.00 61.00 61.18 1hj4 s PRO 266 Cb -0.20 -4.64 0.10 0.00 0.02 0.00 0.00 34.50 29.78 1hj4 s PRO 266 CO 0.59 -2.53 0.97 1.14 -0.33 0.00 0.00 177.00 176.84 1hj4 s GLN 267 N 6.15 0.81 0.10 5.54 -2.07 -1.25 -1.17 119.66 127.76 1hj4 s GLN 267 Ca 0.52 -0.35 0.06 0.00 -1.82 0.00 0.00 55.36 53.77 1hj4 s GLN 267 Cb -0.07 0.34 -0.03 0.00 -1.09 0.00 0.00 33.01 32.15 1hj4 s GLN 267 CO 0.09 -0.36 -0.16 1.52 -1.32 0.00 0.00 175.29 175.05 1hj4 s TYR 268 N -3.02 1.46 -0.07 9.60 -0.85 -0.62 -1.06 117.35 122.78 1hj4 s TYR 268 Ca 0.08 -0.47 0.01 0.00 -0.52 0.00 0.00 57.07 56.17 1hj4 s TYR 268 Cb -0.01 -0.79 0.02 0.00 0.38 0.00 0.00 41.96 41.56 1hj4 s TYR 268 CO -0.06 0.13 -0.07 0.08 -1.52 0.00 0.00 175.55 174.12 1hj4 s VAL 269 N -1.47 0.81 -0.19 -3.49 1.01 -0.05 -1.18 120.40 115.83 1hj4 s VAL 269 Ca 0.04 -0.23 -0.17 0.00 0.00 0.00 0.00 61.98 61.61 1hj4 s VAL 269 Cb -0.09 -0.82 -0.04 0.00 0.00 0.00 0.00 36.38 35.44 1hj4 s VAL 269 CO 0.03 0.30 0.45 -0.63 0.00 0.00 0.00 175.10 175.26 1hj4 s ILE 270 N 1.20 5.16 0.21 2.22 1.01 0.18 -1.06 121.20 130.12 1hj4 s ILE 270 Ca -0.06 0.82 0.11 0.00 0.00 0.00 0.00 60.65 61.53 1hj4 s ILE 270 Cb -0.14 -3.78 -0.04 0.00 0.01 0.00 0.00 42.46 38.50 1hj4 s ILE 270 CO -0.02 0.23 -0.21 -0.04 0.00 0.00 0.00 174.94 174.90 1hj4 s MET 271 N 1.38 1.62 0.23 2.79 -1.94 0.87 -0.72 119.30 123.52 1hj4 s MET 271 Ca 0.22 -1.54 -0.31 0.00 -1.71 0.00 0.00 55.69 52.35 1hj4 s MET 271 Cb -0.15 -1.87 -0.11 0.00 2.01 0.00 0.00 34.83 34.71 1hj4 s MET 271 CO 0.09 0.39 1.59 0.34 -0.01 0.00 0.00 175.02 177.42 1hj4 s ASP 272 N -2.84 6.49 0.00 3.03 -1.08 0.71 -1.23 116.67 121.75 1hj4 s ASP 272 Ca 0.23 2.77 0.17 0.00 -0.52 0.00 0.00 52.55 55.21 1hj4 s ASP 272 Cb -0.08 -2.61 0.75 0.00 -1.46 0.00 0.00 42.92 39.52 1hj4 s ASP 272 CO 0.11 -0.86 1.55 0.61 0.52 0.00 0.00 175.17 177.10 1hj4 n GLY 273 N 3.09 -1.08 0.04 2.66 0.00 0.06 -0.81 105.19 109.15 1hj4 n GLY 273 Ca 0.11 -0.06 -0.02 0.00 0.00 0.00 0.00 46.02 46.05 1hj4 n GLY 273 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1hj4 n GLU 274 N -1.49 1.74 -0.00 1.61 1.02 -1.26 -4.79 120.64 117.48 1hj4 n GLU 274 Ca 0.04 -0.03 0.00 0.00 -0.02 0.00 0.00 57.16 57.15 1hj4 n GLU 274 Cb 0.20 -1.27 -0.00 0.00 -0.02 0.00 0.00 31.44 30.35 1hj4 n GLU 274 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1hj4 n THR 275 N -2.24 0.00 -1.02 2.62 -2.24 -1.22 -4.80 114.28 105.38 1hj4 n THR 275 Ca -0.13 -0.17 -0.01 0.00 -2.27 0.00 0.00 64.05 61.47 1hj4 n THR 275 Cb 0.68 0.66 -0.00 0.00 -2.10 0.00 0.00 70.33 69.57 1hj4 n THR 275 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1hj4 n LEU 276 N -1.34 0.07 -4.70 3.22 4.77 0.01 -4.76 117.00 114.27 1hj4 n LEU 276 Ca -0.00 0.02 -0.43 0.00 -0.03 0.00 0.00 56.01 55.56 1hj4 n LEU 276 Cb 0.01 -0.81 -0.03 0.00 -2.33 0.00 0.00 43.42 40.25 1hj4 n LEU 276 CO 0.01 -0.15 1.33 1.21 -1.33 0.00 0.00 177.39 178.45 1hj4 n GLU 277 N -2.50 2.60 -2.34 3.23 2.13 -1.26 -4.43 120.64 118.07 1hj4 n GLU 277 Ca -0.01 0.94 -0.43 0.00 0.66 0.00 0.00 57.16 58.33 1hj4 n GLU 277 Cb 0.08 -2.77 -0.02 0.00 0.27 0.00 0.00 31.44 29.00 1hj4 n GLU 277 CO 0.00 0.00 0.00 -1.25 -0.41 0.00 0.00 177.13 175.47 1hj4 s PRO 278 N 1.16 4.27 -0.15 5.31 0.04 -1.26 -0.21 135.00 144.16 1hj4 s PRO 278 Ca 0.76 1.79 -0.00 0.00 0.04 0.00 0.00 61.00 63.59 1hj4 s PRO 278 Cb -0.55 -3.69 -0.09 0.00 0.04 0.00 0.00 34.50 30.20 1hj4 s PRO 278 CO 0.34 -0.63 -0.14 1.63 0.04 0.00 0.00 177.00 178.24 1hj4 n LYS 279 N 6.03 0.35 -3.67 4.56 4.76 0.10 -4.94 118.16 125.35 1hj4 n LYS 279 Ca 0.13 0.09 -0.13 0.00 -2.87 0.00 0.00 58.31 55.53 1hj4 n LYS 279 Cb 0.45 -1.25 -0.13 0.00 -1.84 0.00 0.00 35.03 32.26 1hj4 n LYS 279 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 1hj4 s LYS 280 N -2.29 0.15 -0.19 1.97 2.47 -1.03 -5.00 119.74 115.82 1hj4 s LYS 280 Ca -0.20 0.71 -0.04 0.00 -1.56 0.00 0.00 55.97 54.87 1hj4 s LYS 280 Cb 0.06 -0.06 -0.02 0.00 -1.46 0.00 0.00 37.83 36.34 1hj4 s LYS 280 CO 0.32 -0.27 -0.02 0.42 0.16 0.00 0.00 175.35 175.97 1hj4 s ILE 281 N 2.23 3.84 -0.13 5.43 1.01 -1.26 -0.64 121.20 131.68 1hj4 s ILE 281 Ca -0.00 -0.35 0.03 0.00 0.00 0.00 0.00 60.65 60.32 1hj4 s ILE 281 Cb -0.12 -2.72 0.01 0.00 0.01 0.00 0.00 42.46 39.64 1hj4 s ILE 281 CO -0.08 0.44 -0.22 -1.10 0.00 0.00 0.00 174.94 173.98 1hj4 s GLN 282 N 0.90 3.02 0.41 2.79 -1.52 -0.33 -5.00 119.66 119.93 1hj4 s GLN 282 Ca 0.00 -0.86 -0.24 0.00 -1.95 0.00 0.00 55.36 52.31 1hj4 s GLN 282 Cb -0.14 -2.40 -0.08 0.00 -0.22 0.00 0.00 33.01 30.16 1hj4 s GLN 282 CO 0.02 0.03 1.12 0.45 -0.25 0.00 0.00 175.29 176.66 1hj4 s SER 283 N 0.70 6.55 0.00 5.90 0.15 -1.26 -1.59 113.70 124.15 1hj4 s SER 283 Ca -0.10 2.22 0.15 0.00 0.70 0.00 0.00 55.95 58.92 1hj4 s SER 283 Cb -0.16 -2.60 0.26 0.00 -1.71 0.00 0.00 66.02 61.81 1hj4 s SER 283 CO 0.01 -0.64 1.16 0.35 1.20 0.00 0.00 173.24 175.31 1hj4 n THR 284 N -0.07 0.45 -1.86 6.45 -2.24 -0.31 -4.91 114.28 111.78 1hj4 n THR 284 Ca 0.05 -0.73 -0.41 0.00 -2.27 0.00 0.00 64.05 60.69 1hj4 n THR 284 Cb 0.48 0.95 -0.01 0.00 -2.10 0.00 0.00 70.33 69.65 1hj4 n THR 284 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1hj4 s ARG 285 N -1.16 4.16 0.00 -0.78 0.52 -1.26 -4.58 118.95 115.84 1hj4 s ARG 285 Ca 0.25 2.51 0.00 0.00 -0.52 0.00 0.00 55.73 57.96 1hj4 s ARG 285 Cb 0.15 -3.00 0.00 0.00 0.52 0.00 0.00 34.95 32.62 1hj4 s ARG 285 CO 0.21 -0.49 0.00 0.41 0.02 0.00 0.00 175.30 175.44 1hj4 n GLY 286 N 0.93 -0.53 3.86 -3.53 0.00 -1.11 -5.03 105.19 99.78 1hj4 n GLY 286 Ca 0.02 -0.87 -0.36 0.00 0.00 0.00 0.00 46.02 44.81 1hj4 n GLY 286 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1hj4 s MET 287 N -1.08 3.76 0.51 1.61 -1.94 -1.26 0.22 119.30 121.12 1hj4 s MET 287 Ca 0.00 0.20 -0.22 0.00 -1.71 0.00 0.00 55.69 53.96 1hj4 s MET 287 Cb 0.00 -3.13 -0.06 0.00 2.01 0.00 0.00 34.83 33.65 1hj4 s MET 287 CO 0.00 0.66 1.26 0.95 -0.01 0.00 0.00 175.02 177.88 1hj4 s THR 288 N -1.20 2.59 0.25 2.05 -4.23 -0.22 -4.85 115.64 110.04 1hj4 s THR 288 Ca 0.26 0.44 -0.01 0.00 -1.18 0.00 0.00 61.69 61.20 1hj4 s THR 288 Cb -0.15 -3.22 0.06 0.00 1.34 0.00 0.00 72.50 70.54 1hj4 s THR 288 CO 0.14 -0.01 1.69 0.10 -0.54 0.00 0.00 174.62 176.00 1hj4 h TYR 289 N 1.68 0.71 0.00 3.99 -0.00 -1.38 -2.56 116.97 119.41 1hj4 h TYR 289 Ca -0.50 -0.15 -0.08 0.00 -0.00 0.00 0.00 58.73 58.00 1hj4 h TYR 289 Cb 1.28 -0.18 -0.01 0.00 -0.00 0.00 0.00 36.73 37.82 1hj4 h TYR 289 CO 0.49 0.79 -0.96 -0.40 -0.00 0.00 0.00 178.16 178.08 1hj4 n ASP 290 N -4.14 1.86 -0.01 0.10 5.75 -1.26 -4.43 116.55 114.43 1hj4 n ASP 290 Ca 0.00 0.49 0.13 0.00 -0.01 0.00 0.00 54.79 55.41 1hj4 n ASP 290 Cb 0.40 -0.85 0.45 0.00 -1.03 0.00 0.00 41.12 40.09 1hj4 n ASP 290 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1hj4 n GLU 291 N -4.51 0.06 -3.73 0.11 1.02 -1.26 -4.97 120.64 107.36 1hj4 n GLU 291 Ca -0.18 -0.02 -0.27 0.00 -0.02 0.00 0.00 57.16 56.67 1hj4 n GLU 291 Cb 0.46 -1.50 0.01 0.00 -0.02 0.00 0.00 31.44 30.39 1hj4 n GLU 291 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1hj4 n GLN 292 N -1.45 -1.16 -4.98 3.49 6.02 -0.96 -4.98 117.38 113.35 1hj4 n GLN 292 Ca 0.07 0.65 -0.27 0.00 -0.01 0.00 0.00 57.00 57.44 1hj4 n GLN 292 Cb 0.33 -3.19 -0.16 0.00 1.02 0.00 0.00 30.24 28.24 1hj4 n GLN 292 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 1hj4 s GLU 293 N -5.43 1.66 0.23 -1.09 2.12 -1.26 -4.83 118.70 110.11 1hj4 s GLU 293 Ca 0.21 -0.72 -0.31 0.00 0.36 0.00 0.00 54.97 54.51 1hj4 s GLU 293 Cb -0.09 -1.59 -0.11 0.00 0.26 0.00 0.00 34.13 32.59 1hj4 s GLU 293 CO 0.89 0.42 1.61 -0.47 -0.54 0.00 0.00 175.26 177.17 1hj4 s TYR 294 N -0.44 2.91 -0.17 5.30 5.04 -1.26 -1.06 117.35 127.67 1hj4 s TYR 294 Ca 0.07 0.64 0.01 0.00 -2.44 0.00 0.00 57.07 55.34 1hj4 s TYR 294 Cb -0.08 -4.03 0.02 0.00 0.35 0.00 0.00 41.96 38.22 1hj4 s TYR 294 CO -0.01 -3.66 -0.17 -1.58 -1.34 0.00 0.00 175.55 168.79 1hj4 s HIS 295 N 0.63 2.56 -2.17 4.97 5.65 0.13 -4.91 115.29 122.16 1hj4 s HIS 295 Ca 0.68 -1.51 0.30 0.00 0.25 0.00 0.00 55.06 54.78 1hj4 s HIS 295 Cb -0.47 -1.79 1.56 0.00 -1.18 0.00 0.00 32.58 30.70 1hj4 s HIS 295 CO 0.38 -0.76 2.03 -0.35 -0.65 0.00 0.00 174.74 175.40 1hj4 n PRO 296 N 4.67 1.23 -2.98 2.88 -0.04 -1.26 -2.75 135.00 136.75 1hj4 n PRO 296 Ca -0.19 -0.33 -0.15 0.00 -0.04 0.00 0.00 63.50 62.79 1hj4 n PRO 296 Cb 0.50 -1.48 0.01 0.00 -0.04 0.00 0.00 33.50 32.49 1hj4 n PRO 296 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1hj4 n GLU 297 N -0.58 0.88 -2.87 0.54 2.13 -1.26 -4.91 120.64 114.57 1hj4 n GLU 297 Ca 0.22 -2.62 -0.43 0.00 0.66 0.00 0.00 57.16 54.99 1hj4 n GLU 297 Cb 0.19 -1.36 -0.04 0.00 0.27 0.00 0.00 31.44 30.50 1hj4 n GLU 297 CO 0.00 0.00 0.00 -2.14 -0.41 0.00 0.00 177.13 174.58 1hj4 s PRO 298 N -0.78 3.19 0.37 5.31 0.02 -1.26 -4.79 135.00 137.06 1hj4 s PRO 298 Ca 0.32 -1.00 -0.27 0.00 0.02 0.00 0.00 61.00 60.07 1hj4 s PRO 298 Cb 0.27 -4.36 -0.09 0.00 0.02 0.00 0.00 34.50 30.34 1hj4 s PRO 298 CO -0.11 -1.81 1.25 1.03 -0.33 0.00 0.00 177.00 177.03 1hj4 s ARG 299 N 3.81 4.17 -0.14 5.54 0.52 -1.26 -4.67 118.95 126.91 1hj4 s ARG 299 Ca 0.24 2.05 -0.27 0.00 -0.52 0.00 0.00 55.73 57.23 1hj4 s ARG 299 Cb -0.15 -2.86 -0.01 0.00 0.52 0.00 0.00 34.95 32.44 1hj4 s ARG 299 CO 0.07 -0.29 0.89 0.08 0.02 0.00 0.00 175.30 176.07 1hj4 s VAL 300 N -1.26 4.85 0.00 3.52 1.01 -0.87 -1.13 120.40 126.53 1hj4 s VAL 300 Ca 0.53 1.78 0.00 0.00 0.00 0.00 0.00 61.98 64.29 1hj4 s VAL 300 Cb -0.36 -4.20 0.00 0.00 0.00 0.00 0.00 36.38 31.82 1hj4 s VAL 300 CO 0.46 0.03 0.00 0.00 0.00 0.00 0.00 175.10 175.60 1hj4 n ALA 301 N 5.06 0.00 -1.72 5.51 0.00 -0.19 -4.48 120.51 124.69 1hj4 n ALA 301 Ca 0.06 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.09 1hj4 n ALA 301 Cb 0.49 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.95 1hj4 n ALA 301 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1hj4 n ALA 302 N -3.00 1.61 -3.88 0.00 0.00 -0.65 -4.63 120.51 109.95 1hj4 n ALA 302 Ca 0.00 0.29 -0.29 0.00 0.00 0.00 0.00 53.44 53.44 1hj4 n ALA 302 Cb 0.00 -2.31 -0.17 0.00 0.00 0.00 0.00 19.45 16.97 1hj4 n ALA 302 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1hj4 s ILE 303 N -1.17 1.40 0.45 0.00 1.01 -1.26 -1.48 121.20 120.16 1hj4 s ILE 303 Ca 0.59 -0.55 0.05 0.00 0.00 0.00 0.00 60.65 60.75 1hj4 s ILE 303 Cb -0.50 -1.33 -0.04 0.00 0.01 0.00 0.00 42.46 40.60 1hj4 s ILE 303 CO 0.59 0.43 0.09 -0.76 0.00 0.00 0.00 174.94 175.30 1hj4 s LEU 304 N 1.38 2.78 -0.10 2.97 1.02 -0.01 -4.67 118.68 122.06 1hj4 s LEU 304 Ca 0.01 -1.35 0.02 0.00 0.02 0.00 0.00 54.13 52.84 1hj4 s LEU 304 Cb -0.13 -1.04 0.01 0.00 0.02 0.00 0.00 46.19 45.05 1hj4 s LEU 304 CO -0.07 -0.64 -0.16 0.00 0.02 0.00 0.00 176.35 175.50 1hj4 s ALA 305 N -2.73 1.65 0.46 4.21 0.00 -1.26 -0.78 121.76 123.31 1hj4 s ALA 305 Ca 0.29 -0.68 -0.23 0.00 0.00 0.00 0.00 51.96 51.34 1hj4 s ALA 305 Cb 0.05 -0.76 -0.07 0.00 0.00 0.00 0.00 23.12 22.34 1hj4 s ALA 305 CO 0.16 0.03 1.22 0.45 0.00 0.00 0.00 175.76 177.61 1hj4 s SER 306 N 0.81 6.06 0.00 0.00 0.15 -0.54 -4.82 113.70 115.36 1hj4 s SER 306 Ca -0.10 2.44 0.16 0.00 0.70 0.00 0.00 55.95 59.14 1hj4 s SER 306 Cb -0.16 -2.61 0.05 0.00 -1.71 0.00 0.00 66.02 61.59 1hj4 s SER 306 CO 0.01 -1.00 0.91 1.41 1.20 0.00 0.00 173.24 175.77 1hj4 n HIS 307 N -0.44 0.00 -0.08 3.44 8.25 -1.26 -3.09 115.22 122.03 1hj4 n HIS 307 Ca 0.07 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.45 1hj4 n HIS 307 Cb 0.47 0.00 -0.13 0.00 1.12 0.00 0.00 29.99 31.45 1hj4 n HIS 307 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1hj4 n TYR 308 N 0.30 0.00 -4.09 4.41 4.02 -1.26 -4.64 117.16 115.90 1hj4 n TYR 308 Ca 0.08 0.00 -0.10 0.00 -0.01 0.00 0.00 57.90 57.87 1hj4 n TYR 308 Cb 0.36 -0.82 -0.10 0.00 -0.02 0.00 0.00 39.34 38.75 1hj4 n TYR 308 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 176.86 176.88 1hj4 s ARG 309 N -2.40 0.61 -0.96 -0.72 0.52 -1.26 -4.99 118.95 109.75 1hj4 s ARG 309 Ca -0.09 -1.05 -0.20 0.00 -0.52 0.00 0.00 55.73 53.87 1hj4 s ARG 309 Cb 0.05 -0.04 -0.10 0.00 0.52 0.00 0.00 34.95 35.38 1hj4 s ARG 309 CO 0.67 -0.04 2.02 -0.35 0.02 0.00 0.00 175.30 177.62 1hj4 n PRO 310 N 0.61 1.89 -4.09 3.54 -0.04 -1.26 -4.49 135.00 131.16 1hj4 n PRO 310 Ca -0.17 -2.04 -0.12 0.00 -0.04 0.00 0.00 63.50 61.13 1hj4 n PRO 310 Cb 0.59 -3.01 -0.11 0.00 -0.04 0.00 0.00 33.50 30.93 1hj4 n PRO 310 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1hj4 s GLU 311 N 4.47 0.60 -0.00 0.54 2.02 -1.26 -1.75 118.70 123.33 1hj4 s GLU 311 Ca 0.54 -0.93 -0.02 0.00 0.02 0.00 0.00 54.97 54.59 1hj4 s GLU 311 Cb 0.14 -0.22 -0.04 0.00 0.10 0.00 0.00 34.13 34.12 1hj4 s GLU 311 CO 0.06 0.02 0.17 -0.06 0.02 0.00 0.00 175.26 175.47 1hj4 s PHE 312 N -2.11 3.51 -0.34 1.61 0.08 -0.27 -1.47 117.98 118.99 1hj4 s PHE 312 Ca -0.04 0.32 -0.05 0.00 0.12 0.00 0.00 56.93 57.29 1hj4 s PHE 312 Cb -0.05 -1.81 0.05 0.00 -0.57 0.00 0.00 43.02 40.65 1hj4 s PHE 312 CO -0.02 0.63 0.10 0.42 -0.10 0.00 0.00 175.22 176.25 1hj4 s ILE 313 N -1.33 3.49 -0.24 0.64 1.01 0.04 -1.01 121.20 123.80 1hj4 s ILE 313 Ca 0.27 -1.35 -0.03 0.00 0.00 0.00 0.00 60.65 59.54 1hj4 s ILE 313 Cb -0.13 -3.05 0.01 0.00 0.01 0.00 0.00 42.46 39.30 1hj4 s ILE 313 CO 0.19 -0.25 -0.04 -0.69 0.00 0.00 0.00 174.94 174.15 1hj4 s VAL 314 N 1.32 3.16 -0.08 2.92 1.01 -0.01 -0.83 120.40 127.88 1hj4 s VAL 314 Ca -0.01 -0.79 -0.28 0.00 0.00 0.00 0.00 61.98 60.90 1hj4 s VAL 314 Cb -0.20 -2.54 -0.02 0.00 0.00 0.00 0.00 36.38 33.62 1hj4 s VAL 314 CO 0.01 0.27 0.92 0.20 0.00 0.00 0.00 175.10 176.50 1hj4 s ASN 315 N 1.40 7.18 -0.35 3.32 0.01 -0.55 -0.40 114.94 125.56 1hj4 s ASN 315 Ca 0.03 1.45 -0.01 0.00 -0.71 0.00 0.00 52.86 53.62 1hj4 s ASN 315 Cb -0.16 -2.52 0.09 0.00 0.41 0.00 0.00 41.25 39.07 1hj4 s ASN 315 CO -0.04 -0.34 0.10 -0.69 -1.51 0.00 0.00 177.10 174.62 1hj4 s VAL 316 N 1.60 2.91 0.02 1.60 1.01 0.20 -1.03 120.40 126.71 1hj4 s VAL 316 Ca 0.46 -1.92 -0.07 0.00 0.00 0.00 0.00 61.98 60.45 1hj4 s VAL 316 Cb -0.19 -2.92 -0.03 0.00 0.00 0.00 0.00 36.38 33.24 1hj4 s VAL 316 CO 0.20 -0.47 1.10 0.50 0.00 0.00 0.00 175.10 176.43 1hj4 h LYS 317 N 7.92 -0.18 0.00 2.72 3.64 -1.30 -2.28 116.57 127.09 1hj4 h LYS 317 Ca -0.13 0.01 -0.06 0.00 -1.27 0.00 0.00 60.65 59.19 1hj4 h LYS 317 Cb 1.04 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.90 1hj4 h LYS 317 CO 0.60 -0.12 -0.30 0.93 -2.27 0.00 0.00 179.45 178.29 1hj4 h GLU 318 N -0.18 0.00 0.00 1.90 3.07 -1.87 0.37 114.58 117.87 1hj4 h GLU 318 Ca -0.01 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.85 1hj4 h GLU 318 Cb 0.16 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.07 1hj4 h GLU 318 CO -0.02 0.30 -0.67 0.25 -1.40 0.00 0.00 179.01 177.48 1hj4 n THR 319 N -3.90 0.11 -3.14 1.13 -2.24 -1.25 -4.69 114.28 100.30 1hj4 n THR 319 Ca -0.02 -0.11 -0.14 0.00 -2.27 0.00 0.00 64.05 61.52 1hj4 n THR 319 Cb 0.38 0.21 0.05 0.00 -2.10 0.00 0.00 70.33 68.86 1hj4 n THR 319 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1hj4 n GLY 320 N 1.44 0.07 3.29 3.38 0.00 -0.88 -1.06 105.19 111.42 1hj4 n GLY 320 Ca 0.04 -0.13 -0.31 0.00 0.00 0.00 0.00 46.02 45.62 1hj4 n GLY 320 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1hj4 s LYS 321 N -5.75 2.50 -0.25 1.61 1.02 -1.05 -0.77 119.74 117.05 1hj4 s LYS 321 Ca 0.34 -0.90 -0.08 0.00 0.02 0.00 0.00 55.97 55.36 1hj4 s LYS 321 Cb -0.15 -2.16 -0.03 0.00 -0.52 0.00 0.00 37.83 34.97 1hj4 s LYS 321 CO 0.43 0.42 0.08 0.42 -0.92 0.00 0.00 175.35 175.77 1hj4 s ILE 322 N -0.25 4.39 -0.17 2.17 1.01 -0.40 -0.63 121.20 127.32 1hj4 s ILE 322 Ca -0.01 -0.15 -0.13 0.00 0.00 0.00 0.00 60.65 60.37 1hj4 s ILE 322 Cb -0.13 -3.05 -0.05 0.00 0.01 0.00 0.00 42.46 39.24 1hj4 s ILE 322 CO 0.03 0.33 0.25 -0.76 0.00 0.00 0.00 174.94 174.80 1hj4 s LEU 323 N 1.61 4.24 -0.42 2.97 1.43 0.47 -0.65 118.68 128.33 1hj4 s LEU 323 Ca 0.06 0.44 -0.10 0.00 -1.03 0.00 0.00 54.13 53.50 1hj4 s LEU 323 Cb -0.15 -2.31 0.07 0.00 0.03 0.00 0.00 46.19 43.83 1hj4 s LEU 323 CO 0.04 0.12 0.26 -0.76 0.23 0.00 0.00 176.35 176.25 1hj4 s LEU 324 N 0.43 5.12 -0.32 1.79 1.43 0.12 -0.83 118.68 126.42 1hj4 s LEU 324 Ca 0.14 -1.37 -0.09 0.00 -1.03 0.00 0.00 54.13 51.78 1hj4 s LEU 324 Cb -0.12 -2.02 0.01 0.00 0.03 0.00 0.00 46.19 44.08 1hj4 s LEU 324 CO 0.02 -0.52 0.14 -0.69 0.23 0.00 0.00 176.35 175.54 1hj4 s VAL 325 N 1.48 4.39 -0.35 -1.59 1.01 -0.18 -0.89 120.40 124.27 1hj4 s VAL 325 Ca 0.03 -0.61 -0.26 0.00 0.00 0.00 0.00 61.98 61.14 1hj4 s VAL 325 Cb -0.22 -3.29 0.01 0.00 0.00 0.00 0.00 36.38 32.88 1hj4 s VAL 325 CO 0.04 0.00 0.94 -0.62 0.00 0.00 0.00 175.10 175.46 1hj4 s ASP 326 N 1.56 6.73 -0.04 3.32 -1.08 -0.66 -1.11 116.67 125.39 1hj4 s ASP 326 Ca 0.03 0.69 0.11 0.00 -0.52 0.00 0.00 52.55 52.87 1hj4 s ASP 326 Cb -0.18 -2.47 0.40 0.00 -1.46 0.00 0.00 42.92 39.21 1hj4 s ASP 326 CO 0.05 -0.83 1.28 0.00 0.52 0.00 0.00 175.17 176.19 1hj4 n TYR 327 N 6.72 0.75 0.20 -5.34 0.18 -0.71 -4.13 117.16 114.82 1hj4 n TYR 327 Ca 0.08 -0.32 0.07 0.00 1.88 0.00 0.00 57.90 59.61 1hj4 n TYR 327 Cb 0.48 -0.10 0.33 0.00 -0.38 0.00 0.00 39.34 39.67 1hj4 n TYR 327 CO 0.00 0.00 0.00 1.79 -2.08 0.00 0.00 176.86 176.57 1hj4 h THR 328 N 2.40 0.68 -2.18 -3.48 1.35 -1.92 -3.41 112.91 106.35 1hj4 h THR 328 Ca 0.00 -1.44 -0.27 0.00 -0.55 0.00 0.00 66.41 64.15 1hj4 h THR 328 Cb 0.79 1.95 -0.33 0.00 -1.73 0.00 0.00 68.15 68.83 1hj4 h THR 328 CO 0.08 0.30 -0.59 -0.62 -0.25 0.00 0.00 175.52 174.45 1hj4 s ASP 329 N -6.31 1.12 0.01 5.36 -1.08 -1.26 -5.02 116.67 109.50 1hj4 s ASP 329 Ca 0.01 -0.30 0.27 0.00 -0.52 0.00 0.00 52.55 52.01 1hj4 s ASP 329 Cb 0.10 0.66 0.83 0.00 -1.46 0.00 0.00 42.92 43.05 1hj4 s ASP 329 CO 0.67 -0.34 1.65 0.18 0.52 0.00 0.00 175.17 177.85 1hj4 n LEU 330 N 5.33 0.30 -0.03 -1.34 4.77 -1.26 -3.62 117.00 121.15 1hj4 n LEU 330 Ca -0.03 0.25 -0.21 0.00 -0.03 0.00 0.00 56.01 55.98 1hj4 n LEU 330 Cb 0.49 -0.36 -0.13 0.00 -2.33 0.00 0.00 43.42 41.08 1hj4 n LEU 330 CO 0.04 0.05 -0.90 0.47 -1.33 0.00 0.00 177.39 175.73 1hj4 n ASP 331 N -1.55 2.08 -4.08 -1.43 8.00 -1.26 -4.44 116.55 113.87 1hj4 n ASP 331 Ca 0.06 0.17 -0.37 0.00 0.71 0.00 0.00 54.79 55.36 1hj4 n ASP 331 Cb 0.34 -0.79 -0.05 0.00 -0.02 0.00 0.00 41.12 40.60 1hj4 n ASP 331 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1hj4 n ASN 332 N -3.53 4.55 -4.62 -2.24 3.02 -1.25 -5.03 115.26 106.15 1hj4 n ASN 332 Ca -0.35 -3.17 -0.43 0.00 -0.03 0.00 0.00 54.58 50.60 1hj4 n ASN 332 Cb 1.01 -1.09 -0.02 0.00 -0.61 0.00 0.00 39.78 39.07 1hj4 n ASN 332 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1hj4 s LEU 333 N -1.58 3.82 -0.21 3.41 2.96 -1.24 -4.73 118.68 121.11 1hj4 s LEU 333 Ca 0.29 0.94 -0.19 0.00 -0.22 0.00 0.00 54.13 54.96 1hj4 s LEU 333 Cb -0.05 -3.54 -0.03 0.00 0.50 0.00 0.00 46.19 43.07 1hj4 s LEU 333 CO -0.09 -1.08 0.54 -0.54 -1.32 0.00 0.00 176.35 173.86 1hj4 s LYS 334 N 4.11 4.17 0.13 1.98 1.02 -1.26 -5.03 119.74 124.86 1hj4 s LYS 334 Ca 0.51 0.45 0.05 0.00 0.02 0.00 0.00 55.97 57.00 1hj4 s LYS 334 Cb -0.12 -3.58 -0.04 0.00 -0.52 0.00 0.00 37.83 33.57 1hj4 s LYS 334 CO 0.23 -0.20 -0.12 0.95 -0.92 0.00 0.00 175.35 175.28 1hj4 s THR 335 N 1.82 1.23 -0.24 2.17 -4.23 -1.26 -1.65 115.64 113.48 1hj4 s THR 335 Ca 0.25 -1.79 0.02 0.00 -1.18 0.00 0.00 61.69 58.99 1hj4 s THR 335 Cb -0.16 -1.57 0.05 0.00 1.34 0.00 0.00 72.50 72.16 1hj4 s THR 335 CO 0.10 -0.52 -0.12 -0.89 -0.54 0.00 0.00 174.62 172.65 1hj4 s THR 336 N -2.46 2.25 -0.56 3.99 2.01 -0.07 -4.96 115.64 115.85 1hj4 s THR 336 Ca 0.10 -1.38 -0.20 0.00 0.31 0.00 0.00 61.69 60.53 1hj4 s THR 336 Cb -0.03 -2.21 0.08 0.00 0.01 0.00 0.00 72.50 70.35 1hj4 s THR 336 CO 0.02 0.14 0.70 -1.61 -0.69 0.00 0.00 174.62 173.19 1hj4 s GLU 337 N 1.18 3.10 -0.33 4.92 2.02 -1.26 -0.70 118.70 127.63 1hj4 s GLU 337 Ca -0.04 -1.04 -0.17 0.00 0.02 0.00 0.00 54.97 53.74 1hj4 s GLU 337 Cb -0.18 -4.18 -0.01 0.00 0.10 0.00 0.00 34.13 29.86 1hj4 s GLU 337 CO -0.07 -1.42 0.48 0.42 0.02 0.00 0.00 175.26 174.69 1hj4 s ILE 338 N 2.85 5.06 -0.02 -1.63 1.01 0.18 -4.94 121.20 123.70 1hj4 s ILE 338 Ca 0.15 0.41 -0.30 0.00 0.00 0.00 0.00 60.65 60.91 1hj4 s ILE 338 Cb -0.21 -3.90 -0.06 0.00 0.01 0.00 0.00 42.46 38.31 1hj4 s ILE 338 CO 0.10 -0.12 1.53 -0.44 0.00 0.00 0.00 174.94 176.01 1hj4 s SER 339 N 1.71 6.74 0.00 3.58 0.01 -1.26 -1.28 113.70 123.21 1hj4 s SER 339 Ca 0.18 2.19 0.00 0.00 1.31 0.00 0.00 55.95 59.63 1hj4 s SER 339 Cb -0.16 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.53 1hj4 s SER 339 CO 0.12 -0.83 0.00 0.00 0.41 0.00 0.00 173.24 172.94 1hj4 n ALA 340 N 6.20 0.00 -3.20 1.44 0.00 0.05 -4.90 120.51 120.10 1hj4 n ALA 340 Ca 0.15 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.46 1hj4 n ALA 340 Cb 0.43 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.78 1hj4 n ALA 340 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1hj4 s GLU 341 N 1.61 0.46 0.80 0.00 2.56 -1.22 -5.02 118.70 117.89 1hj4 s GLU 341 Ca 0.00 0.16 -0.12 0.00 0.00 0.00 0.00 54.97 55.01 1hj4 s GLU 341 Cb 0.00 0.21 0.08 0.00 2.00 0.00 0.00 34.13 36.42 1hj4 s GLU 341 CO 0.00 -0.09 1.16 1.03 -0.56 0.00 0.00 175.26 176.80 1hj4 s ARG 342 N -0.43 1.82 -0.47 4.30 0.52 -1.26 -3.91 118.95 119.52 1hj4 s ARG 342 Ca -0.05 1.55 0.00 0.00 -0.52 0.00 0.00 55.73 56.70 1hj4 s ARG 342 Cb -0.04 -1.82 0.00 0.00 0.52 0.00 0.00 34.95 33.62 1hj4 s ARG 342 CO 0.02 -2.03 0.00 1.19 0.02 0.00 0.00 175.30 174.50 1hj4 n PHE 343 N -3.37 -0.19 -1.70 -0.53 3.72 0.09 -4.59 117.46 110.88 1hj4 n PHE 343 Ca 0.12 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 57.09 1hj4 n PHE 343 Cb 0.52 -1.63 -0.01 0.00 -0.94 0.00 0.00 39.48 37.42 1hj4 n PHE 343 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 1hj4 n LEU 344 N -0.71 3.59 0.00 4.37 4.77 -1.23 -1.83 117.00 125.95 1hj4 n LEU 344 Ca -0.06 1.18 0.00 0.00 -0.03 0.00 0.00 56.01 57.10 1hj4 n LEU 344 Cb 0.46 -1.49 0.00 0.00 -2.33 0.00 0.00 43.42 40.06 1hj4 n LEU 344 CO 0.07 -0.36 0.00 1.57 -1.33 0.00 0.00 177.39 177.34 1hj4 n HIS 345 N 1.07 0.00 -3.28 -1.77 -0.00 -0.22 -4.23 115.22 106.80 1hj4 n HIS 345 Ca 0.07 0.00 -0.19 0.00 0.46 0.00 0.00 57.72 58.06 1hj4 n HIS 345 Cb 0.35 0.00 -0.00 0.00 -0.12 0.00 0.00 29.99 30.21 1hj4 n HIS 345 CO 0.00 0.00 0.00 0.16 0.46 0.00 0.00 176.34 176.96 1hj4 s ASP 346 N 1.00 5.33 0.00 0.26 -4.77 -1.26 -1.64 116.67 115.58 1hj4 s ASP 346 Ca 0.00 -0.61 0.00 0.00 -3.30 0.00 0.00 52.55 48.64 1hj4 s ASP 346 Cb 0.00 -0.53 0.00 0.00 -1.09 0.00 0.00 42.92 41.30 1hj4 s ASP 346 CO 0.00 -0.76 0.00 0.61 0.70 0.00 0.00 175.17 175.72 1hj4 n GLY 347 N -1.74 -0.83 3.60 2.12 0.00 -0.86 -1.12 105.19 106.36 1hj4 n GLY 347 Ca 0.06 -1.03 -0.09 0.00 0.00 0.00 0.00 46.02 44.96 1hj4 n GLY 347 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1hj4 s GLY 348 N 0.00 0.35 0.33 -0.02 0.00 -0.41 -4.13 107.32 103.45 1hj4 s GLY 348 Ca 0.00 -0.70 -0.19 0.00 0.00 0.00 0.00 44.72 43.83 1hj4 s GLY 348 CO 0.00 -0.51 0.82 1.08 0.00 0.00 0.00 173.10 174.49 1hj4 s LEU 349 N -2.98 4.12 0.00 0.66 1.43 -1.26 -0.80 118.68 119.86 1hj4 s LEU 349 Ca 0.19 1.49 -0.22 0.00 -1.03 0.00 0.00 54.13 54.55 1hj4 s LEU 349 Cb -0.01 -4.09 0.33 0.00 0.03 0.00 0.00 46.19 42.45 1hj4 s LEU 349 CO 0.06 -0.18 0.99 -0.90 0.23 0.00 0.00 176.35 176.55 1hj4 n ASP 350 N -0.10 -2.92 0.10 2.29 5.75 -0.22 -4.83 116.55 116.62 1hj4 n ASP 350 Ca 0.03 -1.04 0.11 0.00 -0.01 0.00 0.00 54.79 53.88 1hj4 n ASP 350 Cb 0.53 -0.99 0.59 0.00 -1.03 0.00 0.00 41.12 40.22 1hj4 n ASP 350 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 1hj4 h GLY 351 N -3.06 0.19 1.16 6.12 0.00 -1.90 -1.01 103.07 104.58 1hj4 h GLY 351 Ca -0.40 -0.06 0.00 0.00 0.00 0.00 0.00 47.33 46.87 1hj4 h GLY 351 CO 0.25 0.05 -0.28 -1.14 0.00 0.00 0.00 176.54 175.43 1hj4 n SER 352 N -4.48 0.42 -0.94 0.19 3.41 -1.26 -4.93 113.62 106.03 1hj4 n SER 352 Ca 0.03 -0.19 -0.12 0.00 -0.26 0.00 0.00 58.87 58.34 1hj4 n SER 352 Cb 0.25 -0.01 -0.05 0.00 -0.26 0.00 0.00 64.21 64.15 1hj4 n SER 352 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1hj4 n HIS 353 N -1.31 -0.06 -0.12 7.33 8.25 -0.38 -4.89 115.22 124.04 1hj4 n HIS 353 Ca 0.08 0.00 -0.17 0.00 -0.26 0.00 0.00 57.72 57.37 1hj4 n HIS 353 Cb 0.33 -2.23 -0.13 0.00 1.12 0.00 0.00 29.99 29.08 1hj4 n HIS 353 CO 0.00 0.00 0.00 -2.13 0.64 0.00 0.00 176.34 174.85 1hj4 n ARG 354 N -2.61 0.66 -4.20 -0.41 0.63 -1.26 -4.39 116.66 105.08 1hj4 n ARG 354 Ca -0.12 0.13 -0.34 0.00 -0.92 0.00 0.00 57.85 56.59 1hj4 n ARG 354 Cb 0.41 -1.52 -0.10 0.00 0.45 0.00 0.00 32.46 31.70 1hj4 n ARG 354 CO 0.00 0.00 0.00 0.71 -2.51 0.00 0.00 177.63 175.83 1hj4 s TYR 355 N -2.52 3.18 -0.32 -0.14 2.02 -1.26 -1.19 117.35 117.13 1hj4 s TYR 355 Ca -0.31 0.02 -0.14 0.00 -0.37 0.00 0.00 57.07 56.27 1hj4 s TYR 355 Cb 0.09 -1.97 -0.02 0.00 -0.40 0.00 0.00 41.96 39.65 1hj4 s TYR 355 CO 0.64 0.20 0.29 0.12 -1.57 0.00 0.00 175.55 175.23 1hj4 s PHE 356 N 0.00 3.22 -0.27 2.71 5.36 -0.33 -1.05 117.98 127.62 1hj4 s PHE 356 Ca 0.04 -0.02 -0.05 0.00 -0.96 0.00 0.00 56.93 55.94 1hj4 s PHE 356 Cb -0.13 -2.55 0.01 0.00 -0.34 0.00 0.00 43.02 40.02 1hj4 s PHE 356 CO 0.02 -0.34 0.02 0.42 -1.46 0.00 0.00 175.22 173.87 1hj4 s ILE 357 N 1.88 3.57 0.03 3.12 1.01 0.02 -0.75 121.20 130.08 1hj4 s ILE 357 Ca 0.09 -0.73 0.04 0.00 0.00 0.00 0.00 60.65 60.05 1hj4 s ILE 357 Cb -0.17 -2.79 -0.02 0.00 0.01 0.00 0.00 42.46 39.50 1hj4 s ILE 357 CO 0.11 0.18 -0.11 0.28 0.00 0.00 0.00 174.94 175.41 1hj4 s THR 358 N 1.45 0.84 -0.19 2.92 -1.32 -0.00 -1.29 115.64 118.05 1hj4 s THR 358 Ca 0.03 -0.88 -0.23 0.00 -1.21 0.00 0.00 61.69 59.39 1hj4 s THR 358 Cb -0.16 -0.79 -0.02 0.00 -1.51 0.00 0.00 72.50 70.02 1hj4 s THR 358 CO -0.00 -0.08 0.74 0.00 -2.21 0.00 0.00 174.62 173.07 1hj4 s ALA 359 N -0.86 3.54 -1.15 11.08 0.00 -0.27 0.24 121.76 134.34 1hj4 s ALA 359 Ca -0.01 -0.12 -0.11 0.00 0.00 0.00 0.00 51.96 51.72 1hj4 s ALA 359 Cb -0.07 -3.12 0.24 0.00 0.00 0.00 0.00 23.12 20.16 1hj4 s ALA 359 CO 0.01 -0.64 1.23 0.00 0.00 0.00 0.00 175.76 176.36 1hj4 n ALA 360 N 5.25 4.12 -0.08 0.00 0.00 0.68 -1.05 120.51 129.43 1hj4 n ALA 360 Ca 0.02 -4.52 -0.07 0.00 0.00 0.00 0.00 53.44 48.87 1hj4 n ALA 360 Cb 0.49 -2.67 0.00 0.00 0.00 0.00 0.00 19.45 17.27 1hj4 n ALA 360 CO 0.00 0.00 0.00 -2.95 0.00 0.00 0.00 177.50 174.55 1hj4 h ASN 361 N 6.80 -0.11 0.51 0.00 -0.00 -1.60 -2.41 115.58 118.78 1hj4 h ASN 361 Ca 0.23 0.07 0.00 0.00 -0.00 0.00 0.00 56.30 56.60 1hj4 h ASN 361 Cb 0.87 0.11 0.00 0.00 -0.00 0.00 0.00 38.32 39.30 1hj4 h ASN 361 CO 1.10 -0.02 0.00 0.00 -0.00 0.00 0.00 177.43 178.51 1hj4 h ALA 362 N 1.26 1.00 -0.52 4.14 0.00 -1.86 -1.60 119.26 121.68 1hj4 h ALA 362 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1hj4 h ALA 362 Cb 0.19 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1hj4 h ALA 362 CO -0.24 0.00 0.00 0.54 0.00 0.00 0.00 179.25 179.55 1hj4 n ARG 363 N -2.96 2.62 -3.04 0.00 1.74 -1.04 -4.91 116.66 109.07 1hj4 n ARG 363 Ca -0.01 -2.34 -0.21 0.00 -0.77 0.00 0.00 57.85 54.52 1hj4 n ARG 363 Cb 0.18 -1.45 0.01 0.00 -1.02 0.00 0.00 32.46 30.18 1hj4 n ARG 363 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1hj4 n ASN 364 N 1.23 -4.78 -4.51 0.55 3.02 -0.60 -4.96 115.26 105.20 1hj4 n ASN 364 Ca 0.19 -0.24 -0.28 0.00 -0.03 0.00 0.00 54.58 54.21 1hj4 n ASN 364 Cb 0.54 -3.93 -0.11 0.00 -0.61 0.00 0.00 39.78 35.68 1hj4 n ASN 364 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1hj4 s LYS 365 N -5.70 1.86 -0.19 3.52 -0.14 -0.95 -1.58 119.74 116.56 1hj4 s LYS 365 Ca 0.28 -1.23 -0.06 0.00 -1.36 0.00 0.00 55.97 53.60 1hj4 s LYS 365 Cb -0.14 -2.11 -0.03 0.00 -1.68 0.00 0.00 37.83 33.86 1hj4 s LYS 365 CO 0.35 0.46 0.03 -0.51 -0.76 0.00 0.00 175.35 174.92 1hj4 s LEU 366 N -2.42 3.57 -0.16 3.17 1.43 0.73 -0.23 118.68 124.77 1hj4 s LEU 366 Ca 0.21 -0.04 -0.06 0.00 -1.03 0.00 0.00 54.13 53.21 1hj4 s LEU 366 Cb -0.10 -1.90 -0.04 0.00 0.03 0.00 0.00 46.19 44.19 1hj4 s LEU 366 CO 0.12 0.14 0.05 -0.69 0.23 0.00 0.00 176.35 176.19 1hj4 s VAL 367 N 0.59 4.66 -0.18 -1.59 1.01 0.14 -1.14 120.40 123.89 1hj4 s VAL 367 Ca 0.01 -0.09 -0.01 0.00 0.00 0.00 0.00 61.98 61.90 1hj4 s VAL 367 Cb -0.13 -3.07 -0.00 0.00 0.00 0.00 0.00 36.38 33.17 1hj4 s VAL 367 CO 0.02 0.50 -0.12 -0.69 0.00 0.00 0.00 175.10 174.80 1hj4 s VAL 368 N 0.11 2.84 -0.08 2.92 1.01 0.37 -0.82 120.40 126.75 1hj4 s VAL 368 Ca 0.04 -0.70 0.02 0.00 0.00 0.00 0.00 61.98 61.35 1hj4 s VAL 368 Cb -0.12 -2.23 -0.02 0.00 0.00 0.00 0.00 36.38 34.00 1hj4 s VAL 368 CO 0.01 0.49 -0.13 -0.63 0.00 0.00 0.00 175.10 174.85 1hj4 s ILE 369 N 1.03 3.18 -0.47 2.22 -1.09 0.07 -0.66 121.20 125.49 1hj4 s ILE 369 Ca -0.01 -0.66 -0.23 0.00 -2.23 0.00 0.00 60.65 57.52 1hj4 s ILE 369 Cb -0.15 -2.28 0.03 0.00 -1.58 0.00 0.00 42.46 38.48 1hj4 s ILE 369 CO -0.03 0.57 0.81 -0.62 -1.23 0.00 0.00 174.94 174.45 1hj4 s ASP 370 N -0.43 6.40 0.37 3.58 -1.08 -0.05 -1.19 116.67 124.27 1hj4 s ASP 370 Ca 0.05 -0.17 0.27 0.00 -0.52 0.00 0.00 52.55 52.18 1hj4 s ASP 370 Cb -0.12 -2.39 1.00 0.00 -1.46 0.00 0.00 42.92 39.94 1hj4 s ASP 370 CO 0.02 -0.98 1.80 0.71 0.52 0.00 0.00 175.17 177.24 1hj4 h THR 371 N 5.99 0.00 0.01 1.71 1.35 -1.46 0.19 112.91 120.70 1hj4 h THR 371 Ca -0.25 -0.47 -0.08 0.00 -0.55 0.00 0.00 66.41 65.06 1hj4 h THR 371 Cb 1.08 1.37 0.01 0.00 -1.73 0.00 0.00 68.15 68.88 1hj4 h THR 371 CO 0.99 0.00 -0.32 0.50 -0.25 0.00 0.00 175.52 176.44 1hj4 h LYS 372 N 0.00 0.20 -0.00 4.72 3.64 -1.91 -3.35 116.57 119.87 1hj4 h LYS 372 Ca 0.00 -0.23 0.00 0.00 -1.27 0.00 0.00 60.65 59.15 1hj4 h LYS 372 Cb 0.56 0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.45 1hj4 h LYS 372 CO 0.00 0.97 -0.60 0.39 -2.27 0.00 0.00 179.45 177.94 1hj4 n GLU 373 N -4.45 0.12 -3.30 1.90 -0.58 -1.19 -4.98 120.64 108.16 1hj4 n GLU 373 Ca -0.10 -0.08 -0.17 0.00 -0.42 0.00 0.00 57.16 56.39 1hj4 n GLU 373 Cb 0.55 -1.50 0.07 0.00 -0.57 0.00 0.00 31.44 29.99 1hj4 n GLU 373 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1hj4 n GLY 374 N 1.48 -0.27 3.13 0.62 0.00 0.64 -5.02 105.19 105.76 1hj4 n GLY 374 Ca 0.06 0.05 -0.10 0.00 0.00 0.00 0.00 46.02 46.03 1hj4 n GLY 374 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1hj4 s LYS 375 N -5.51 0.59 0.24 1.61 1.02 -1.08 -4.99 119.74 111.62 1hj4 s LYS 375 Ca 0.18 -0.66 -0.30 0.00 0.02 0.00 0.00 55.97 55.21 1hj4 s LYS 375 Cb -0.08 0.24 -0.10 0.00 -0.52 0.00 0.00 37.83 37.37 1hj4 s LYS 375 CO 0.62 -0.15 1.38 -1.17 -0.92 0.00 0.00 175.35 175.11 1hj4 s LEU 376 N -1.97 4.40 -0.04 3.17 2.96 -1.26 -0.87 118.68 125.07 1hj4 s LEU 376 Ca -0.07 2.58 0.06 0.00 -0.22 0.00 0.00 54.13 56.47 1hj4 s LEU 376 Cb -0.02 -3.62 -0.09 0.00 0.50 0.00 0.00 46.19 42.96 1hj4 s LEU 376 CO -0.03 -0.62 0.07 1.33 -1.32 0.00 0.00 176.35 175.78 1hj4 n VAL 377 N 2.26 0.23 -3.56 1.68 0.24 0.17 -4.86 118.33 114.49 1hj4 n VAL 377 Ca 0.06 -0.21 -0.11 0.00 -2.04 0.00 0.00 64.34 62.04 1hj4 n VAL 377 Cb 0.41 -0.32 -0.05 0.00 -1.47 0.00 0.00 33.84 32.41 1hj4 n VAL 377 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1hj4 s ALA 378 N -2.28 -1.89 -0.12 2.33 0.00 -1.09 -4.99 121.76 113.71 1hj4 s ALA 378 Ca -0.03 1.47 -0.02 0.00 0.00 0.00 0.00 51.96 53.38 1hj4 s ALA 378 Cb 0.03 -0.45 0.04 0.00 0.00 0.00 0.00 23.12 22.75 1hj4 s ALA 378 CO 0.25 -0.37 0.02 0.42 0.00 0.00 0.00 175.76 176.08 1hj4 s ILE 379 N -1.42 0.37 -0.02 0.00 1.01 -1.26 -0.48 121.20 119.40 1hj4 s ILE 379 Ca -0.02 -0.14 0.03 0.00 0.00 0.00 0.00 60.65 60.52 1hj4 s ILE 379 Cb -0.00 -0.71 -0.00 0.00 0.01 0.00 0.00 42.46 41.76 1hj4 s ILE 379 CO 0.01 0.04 -0.12 -1.61 0.00 0.00 0.00 174.94 173.26 1hj4 s GLU 380 N 1.95 1.09 0.23 2.79 0.41 -0.29 -4.96 118.70 119.93 1hj4 s GLU 380 Ca 0.03 -0.41 -0.30 0.00 -0.41 0.00 0.00 54.97 53.88 1hj4 s GLU 380 Cb -0.14 -1.02 -0.09 0.00 -1.78 0.00 0.00 34.13 31.10 1hj4 s GLU 380 CO -0.07 0.20 1.00 0.34 -0.49 0.00 0.00 175.26 176.25 1hj4 s ASP 381 N -0.05 7.49 0.23 -0.19 -1.08 -1.26 -0.19 116.67 121.61 1hj4 s ASP 381 Ca 0.01 2.04 0.25 0.00 -0.52 0.00 0.00 52.55 54.32 1hj4 s ASP 381 Cb -0.07 -2.61 0.57 0.00 -1.46 0.00 0.00 42.92 39.34 1hj4 s ASP 381 CO 0.00 0.02 1.59 0.71 0.52 0.00 0.00 175.17 178.02 1hj4 h THR 382 N 3.27 0.00 0.00 1.71 1.35 -1.65 -3.46 112.91 114.13 1hj4 h THR 382 Ca -0.45 -0.60 0.00 0.00 -0.55 0.00 0.00 66.41 64.81 1hj4 h THR 382 Cb 1.21 1.47 0.00 0.00 -1.73 0.00 0.00 68.15 69.09 1hj4 h THR 382 CO 0.68 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.56 1hj4 n GLY 383 N 1.27 1.41 3.89 5.82 0.00 -1.26 -4.89 105.19 111.42 1hj4 n GLY 383 Ca 0.04 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.81 1hj4 n GLY 383 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1hj4 s GLY 384 N -1.83 2.37 -0.32 -0.02 0.00 -1.26 -5.11 107.32 101.15 1hj4 s GLY 384 Ca 0.00 -1.34 -0.09 0.00 0.00 0.00 0.00 44.72 43.29 1hj4 s GLY 384 CO 0.00 -1.93 0.13 1.20 0.00 0.00 0.00 173.10 172.50 1hj4 s GLN 385 N -4.23 3.13 -0.61 2.90 -1.52 -1.26 -4.75 119.66 113.31 1hj4 s GLN 385 Ca 0.35 -0.85 -0.00 0.00 -1.95 0.00 0.00 55.36 52.90 1hj4 s GLN 385 Cb -0.02 -3.51 -0.00 0.00 -0.22 0.00 0.00 33.01 29.26 1hj4 s GLN 385 CO 0.21 -0.48 0.57 2.41 -0.25 0.00 0.00 175.29 177.75 1hj4 n THR 386 N 4.93 -8.33 -1.71 -0.19 -1.04 -1.25 -0.59 114.28 106.10 1hj4 n THR 386 Ca -0.14 -0.25 -0.43 0.00 -2.04 0.00 0.00 64.05 61.19 1hj4 n THR 386 Cb 0.48 -6.23 -0.02 0.00 -1.82 0.00 0.00 70.33 62.74 1hj4 n THR 386 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 1hj4 n PRO 387 N -1.70 2.34 -3.38 -2.82 -0.04 -1.26 -1.34 135.00 126.81 1hj4 n PRO 387 Ca -0.00 0.83 -0.26 0.00 -0.04 0.00 0.00 63.50 64.03 1hj4 n PRO 387 Cb 0.51 -2.53 -0.10 0.00 -0.04 0.00 0.00 33.50 31.33 1hj4 n PRO 387 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 1hj4 s HIS 388 N -0.18 0.76 -0.36 0.54 2.46 -0.55 -4.64 115.29 113.32 1hj4 s HIS 388 Ca 0.65 -1.95 0.22 0.00 0.47 0.00 0.00 55.06 54.45 1hj4 s HIS 388 Cb -0.57 -0.82 0.36 0.00 -0.13 0.00 0.00 32.58 31.43 1hj4 s HIS 388 CO 0.51 -0.86 1.61 -1.00 -2.47 0.00 0.00 174.74 172.53 1hj4 h PRO 389 N 6.08 0.00 0.00 2.88 0.13 -1.77 -3.39 132.00 135.93 1hj4 h PRO 389 Ca 0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.32 1hj4 h PRO 389 Cb 0.95 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.08 1hj4 h PRO 389 CO 0.31 0.08 0.00 0.41 -0.23 0.00 0.00 178.00 178.57 1hj4 n GLY 390 N 1.04 2.83 0.15 1.56 0.00 -1.26 -0.72 105.19 108.79 1hj4 n GLY 390 Ca 0.03 -0.24 0.12 0.00 0.00 0.00 0.00 46.02 45.93 1hj4 n GLY 390 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1hj4 n ARG 391 N 13.05 0.44 0.00 1.61 1.74 -1.26 -2.02 116.66 130.22 1hj4 n ARG 391 Ca 0.00 -0.29 0.00 0.00 -0.77 0.00 0.00 57.85 56.79 1hj4 n ARG 391 Cb 0.00 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 29.95 1hj4 n ARG 391 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1hj4 n GLY 392 N 1.44 -2.07 2.75 -0.13 0.00 0.10 -3.47 105.19 103.80 1hj4 n GLY 392 Ca 0.08 -1.51 -0.24 0.00 0.00 0.00 0.00 46.02 44.35 1hj4 n GLY 392 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hj4 s ALA 393 N -1.12 0.76 -0.08 4.61 0.00 -0.93 -4.75 121.76 120.24 1hj4 s ALA 393 Ca 0.00 -0.29 -0.12 0.00 0.00 0.00 0.00 51.96 51.55 1hj4 s ALA 393 Cb 0.00 -0.88 -0.05 0.00 0.00 0.00 0.00 23.12 22.19 1hj4 s ALA 393 CO 0.00 -0.70 0.30 -0.80 0.00 0.00 0.00 175.76 174.56 1hj4 s ASN 394 N 1.95 6.58 0.17 0.00 0.01 -1.24 -0.35 114.94 122.06 1hj4 s ASN 394 Ca 0.03 0.69 -0.22 0.00 -0.71 0.00 0.00 52.86 52.65 1hj4 s ASN 394 Cb -0.14 -2.18 0.06 0.00 0.41 0.00 0.00 41.25 39.40 1hj4 s ASN 394 CO -0.06 0.28 0.60 0.72 -1.51 0.00 0.00 177.10 177.12 1hj4 s PHE 395 N -0.58 -0.46 -0.59 2.20 -0.71 -0.74 -4.75 117.98 112.35 1hj4 s PHE 395 Ca 0.19 0.20 -0.21 0.00 -1.04 0.00 0.00 56.93 56.07 1hj4 s PHE 395 Cb -0.14 0.55 0.07 0.00 -1.21 0.00 0.00 43.02 42.29 1hj4 s PHE 395 CO 0.08 -0.89 0.83 0.08 -1.34 0.00 0.00 175.22 173.98 1hj4 s VAL 396 N -3.78 4.55 0.17 -2.49 1.01 -1.26 -0.70 120.40 117.90 1hj4 s VAL 396 Ca 0.03 -0.37 -0.30 0.00 0.00 0.00 0.00 61.98 61.33 1hj4 s VAL 396 Cb -0.01 -4.53 -0.08 0.00 0.00 0.00 0.00 36.38 31.75 1hj4 s VAL 396 CO -0.10 -1.18 1.34 -2.28 0.00 0.00 0.00 175.10 172.88 1hj4 s HIS 397 N 3.46 3.25 0.47 5.22 2.46 -0.20 -4.90 115.29 125.04 1hj4 s HIS 397 Ca 0.20 1.13 0.23 0.00 0.47 0.00 0.00 55.06 57.09 1hj4 s HIS 397 Cb -0.18 -3.63 1.24 0.00 -0.13 0.00 0.00 32.58 29.88 1hj4 s HIS 397 CO 0.12 -2.05 1.88 -1.35 -2.47 0.00 0.00 174.74 170.86 1hj4 h PRO 398 N 5.82 0.24 0.00 2.88 0.11 -1.82 -1.34 132.00 137.90 1hj4 h PRO 398 Ca -0.44 -0.01 -0.11 0.00 0.11 0.00 0.00 66.00 65.55 1hj4 h PRO 398 Cb 1.21 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 32.25 1hj4 h PRO 398 CO 0.80 0.16 -1.42 0.25 -0.21 0.00 0.00 178.00 177.58 1hj4 n THR 399 N -4.42 0.42 0.13 -1.15 -2.24 -1.26 -4.73 114.28 101.02 1hj4 n THR 399 Ca 0.18 -0.24 0.04 0.00 -2.27 0.00 0.00 64.05 61.76 1hj4 n THR 399 Cb 0.77 -0.83 0.02 0.00 -2.10 0.00 0.00 70.33 68.20 1hj4 n THR 399 CO 0.00 0.00 0.00 -0.26 -0.57 0.00 0.00 175.07 174.24 1hj4 h PHE 400 N 0.00 0.00 0.00 4.78 0.04 -1.93 -3.51 116.94 116.33 1hj4 h PHE 400 Ca -0.17 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.60 1hj4 h PHE 400 Cb 1.36 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.51 1hj4 h PHE 400 CO 0.00 0.39 0.00 0.41 -0.60 0.00 0.00 178.31 178.52 1hj4 n GLY 401 N 1.23 -1.80 3.68 -1.45 0.00 -0.51 -4.91 105.19 101.43 1hj4 n GLY 401 Ca -0.00 -1.83 -0.45 0.00 0.00 0.00 0.00 46.02 43.73 1hj4 n GLY 401 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1hj4 n PRO 402 N 0.00 2.41 -4.23 1.61 -0.02 -1.26 -1.03 135.00 132.48 1hj4 n PRO 402 Ca 0.00 0.88 -0.13 0.00 -2.02 0.00 0.00 63.50 62.23 1hj4 n PRO 402 Cb 0.00 -2.73 -0.10 0.00 -0.02 0.00 0.00 33.50 30.65 1hj4 n PRO 402 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1hj4 s VAL 403 N 2.92 0.78 -0.05 -1.45 -7.23 0.12 -1.61 120.40 113.88 1hj4 s VAL 403 Ca 0.86 -1.99 0.04 0.00 -1.81 0.00 0.00 61.98 59.08 1hj4 s VAL 403 Cb -0.60 -1.98 0.00 0.00 0.56 0.00 0.00 36.38 34.36 1hj4 s VAL 403 CO 0.43 -0.61 -0.16 0.86 -0.31 0.00 0.00 175.10 175.31 1hj4 s TRP 404 N -3.58 1.70 0.09 2.82 -0.00 -0.44 -1.80 118.94 117.73 1hj4 s TRP 404 Ca 0.20 -0.53 0.08 0.00 -0.00 0.00 0.00 56.10 55.85 1hj4 s TRP 404 Cb 0.05 -1.16 -0.04 0.00 -0.00 0.00 0.00 33.47 32.33 1hj4 s TRP 404 CO 0.01 -0.20 -0.17 0.00 -0.00 0.00 0.00 176.95 176.59 1hj4 s ALA 405 N 0.18 2.69 0.02 5.86 0.00 0.52 -0.97 121.76 130.07 1hj4 s ALA 405 Ca -0.07 -1.30 0.01 0.00 0.00 0.00 0.00 51.96 50.61 1hj4 s ALA 405 Cb -0.13 -0.70 -0.02 0.00 0.00 0.00 0.00 23.12 22.27 1hj4 s ALA 405 CO 0.03 0.59 -0.05 -0.08 0.00 0.00 0.00 175.76 176.25 1hj4 s THR 406 N -1.09 0.37 0.53 0.00 -1.32 -0.84 -2.20 115.64 111.09 1hj4 s THR 406 Ca 0.17 -0.74 0.08 0.00 -1.21 0.00 0.00 61.69 59.99 1hj4 s THR 406 Cb -0.11 -0.42 0.08 0.00 -1.51 0.00 0.00 72.50 70.55 1hj4 s THR 406 CO 0.09 -0.25 0.66 -1.54 -2.21 0.00 0.00 174.62 171.37 1hj4 n SER 407 N 1.99 2.10 -4.20 8.08 3.41 -1.26 -0.80 113.62 122.95 1hj4 n SER 407 Ca -0.20 -2.50 -0.20 0.00 -0.26 0.00 0.00 58.87 55.72 1hj4 n SER 407 Cb 0.56 -0.32 -0.12 0.00 -0.26 0.00 0.00 64.21 64.07 1hj4 n SER 407 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 1hj4 s HIS 408 N -2.37 1.35 0.07 7.33 3.76 -1.11 -1.47 115.29 122.85 1hj4 s HIS 408 Ca 0.50 -0.44 -0.06 0.00 -0.15 0.00 0.00 55.06 54.91 1hj4 s HIS 408 Cb -0.04 -0.76 -0.29 0.00 1.11 0.00 0.00 32.58 32.60 1hj4 s HIS 408 CO 0.32 0.09 1.12 0.52 -0.85 0.00 0.00 174.74 175.94 1hj4 h MET 409 N 4.30 0.31 0.00 1.40 2.86 -1.16 -2.28 114.93 120.37 1hj4 h MET 409 Ca -0.42 -0.53 0.00 0.00 -2.06 0.00 0.00 59.70 56.69 1hj4 h MET 409 Cb 1.19 0.20 0.00 0.00 0.06 0.00 0.00 31.60 33.04 1hj4 h MET 409 CO 0.40 1.25 -0.36 0.41 1.06 0.00 0.00 176.91 179.68 1hj4 n GLY 410 N 1.55 -1.34 3.74 8.32 0.00 0.24 -0.76 105.19 116.94 1hj4 n GLY 410 Ca -0.10 -0.27 -0.10 0.00 0.00 0.00 0.00 46.02 45.56 1hj4 n GLY 410 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1hj4 s ASP 411 N -3.11 0.16 -0.03 1.61 1.47 -1.24 -4.78 116.67 110.75 1hj4 s ASP 411 Ca 0.12 -1.15 0.07 0.00 1.18 0.00 0.00 52.55 52.77 1hj4 s ASP 411 Cb 0.18 0.79 0.27 0.00 -0.34 0.00 0.00 42.92 43.81 1hj4 s ASP 411 CO 0.65 -1.55 1.13 -0.90 0.68 0.00 0.00 175.17 175.17 1hj4 n ASP 412 N -1.27 1.93 -4.86 2.11 5.68 -1.26 -4.11 116.55 114.77 1hj4 n ASP 412 Ca -0.06 -2.12 -0.32 0.00 -0.50 0.00 0.00 54.79 51.79 1hj4 n ASP 412 Cb 0.60 -0.32 -0.06 0.00 -1.14 0.00 0.00 41.12 40.21 1hj4 n ASP 412 CO 0.00 0.00 0.00 -0.94 -1.33 0.00 0.00 177.20 174.93 1hj4 s SER 413 N -0.76 6.71 -0.14 -1.12 1.04 -1.26 0.03 113.70 118.20 1hj4 s SER 413 Ca 0.19 1.15 0.02 0.00 0.48 0.00 0.00 55.95 57.79 1hj4 s SER 413 Cb 0.12 -2.32 0.00 0.00 0.10 0.00 0.00 66.02 63.92 1hj4 s SER 413 CO 0.10 -0.17 -0.19 -0.69 0.98 0.00 0.00 173.24 173.27 1hj4 s VAL 414 N -1.95 2.33 -0.01 5.02 1.01 0.33 -2.73 120.40 124.41 1hj4 s VAL 414 Ca 0.52 -0.89 0.05 0.00 0.00 0.00 0.00 61.98 61.65 1hj4 s VAL 414 Cb -0.10 -1.95 -0.03 0.00 0.00 0.00 0.00 36.38 34.30 1hj4 s VAL 414 CO 0.19 0.54 -0.15 0.00 0.00 0.00 0.00 175.10 175.68 1hj4 s ALA 415 N 0.72 2.66 -0.12 5.51 0.00 0.02 -1.62 121.76 128.93 1hj4 s ALA 415 Ca -0.08 -1.07 -0.00 0.00 0.00 0.00 0.00 51.96 50.81 1hj4 s ALA 415 Cb -0.16 -0.89 -0.02 0.00 0.00 0.00 0.00 23.12 22.05 1hj4 s ALA 415 CO 0.01 0.57 -0.10 -0.51 0.00 0.00 0.00 175.76 175.73 1hj4 s LEU 416 N -1.06 2.92 -0.08 0.00 1.43 -0.51 -1.98 118.68 119.40 1hj4 s LEU 416 Ca 0.13 -0.21 0.04 0.00 -1.03 0.00 0.00 54.13 53.06 1hj4 s LEU 416 Cb -0.11 -1.66 -0.01 0.00 0.03 0.00 0.00 46.19 44.45 1hj4 s LEU 416 CO 0.03 0.22 -0.22 -0.51 0.23 0.00 0.00 176.35 176.10 1hj4 s ILE 417 N 0.02 2.27 0.24 -0.59 2.07 -0.15 -0.70 121.20 124.36 1hj4 s ILE 417 Ca -0.03 -0.97 -0.30 0.00 -1.41 0.00 0.00 60.65 57.95 1hj4 s ILE 417 Cb -0.14 -1.86 -0.10 0.00 0.13 0.00 0.00 42.46 40.49 1hj4 s ILE 417 CO 0.04 0.56 1.37 -0.83 -1.91 0.00 0.00 174.94 174.16 1hj4 s GLY 418 N 0.03 2.46 -0.17 1.50 0.00 -0.97 -1.33 107.32 108.85 1hj4 s GLY 418 Ca -0.09 1.22 0.14 0.00 0.00 0.00 0.00 44.72 46.00 1hj4 s GLY 418 CO 0.05 2.14 1.19 -1.30 0.00 0.00 0.00 173.10 175.19 1hj4 n THR 419 N 2.29 1.89 -3.60 0.90 -2.24 -0.63 -0.49 114.28 112.40 1hj4 n THR 419 Ca 0.06 -2.71 -0.28 0.00 -2.27 0.00 0.00 64.05 58.85 1hj4 n THR 419 Cb 0.41 -0.13 -0.11 0.00 -2.10 0.00 0.00 70.33 68.41 1hj4 n THR 419 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1hj4 s ASP 420 N -2.98 2.83 0.37 3.42 2.15 -1.26 -4.96 116.67 116.24 1hj4 s ASP 420 Ca 0.35 -3.32 0.08 0.00 0.43 0.00 0.00 52.55 50.09 1hj4 s ASP 420 Cb 0.33 -0.91 0.71 0.00 -0.30 0.00 0.00 42.92 42.76 1hj4 s ASP 420 CO -0.05 -0.15 1.90 1.55 -0.17 0.00 0.00 175.17 178.25 1hj4 h PRO 421 N 5.64 0.34 0.11 4.34 0.13 -1.91 0.89 132.00 141.54 1hj4 h PRO 421 Ca 0.20 -0.08 -0.18 0.00 -0.87 0.00 0.00 66.00 65.08 1hj4 h PRO 421 Cb 0.85 -0.05 0.02 0.00 0.13 0.00 0.00 31.00 31.96 1hj4 h PRO 421 CO 0.50 0.44 -0.77 0.93 -0.23 0.00 0.00 178.00 178.88 1hj4 h GLU 422 N 0.33 0.32 0.00 0.86 5.08 -1.95 -3.30 114.58 115.92 1hj4 h GLU 422 Ca 0.07 -0.50 -0.20 0.00 -1.00 0.00 0.00 59.36 57.73 1hj4 h GLU 422 Cb 0.37 0.18 -0.04 0.00 0.50 0.00 0.00 28.75 29.76 1hj4 h GLU 422 CO 0.02 1.21 -1.77 0.41 -1.00 0.00 0.00 179.01 177.88 1hj4 n GLY 423 N 1.54 -1.10 2.26 -3.84 0.00 -1.12 -4.47 105.19 98.46 1hj4 n GLY 423 Ca -0.13 -0.23 -0.24 0.00 0.00 0.00 0.00 46.02 45.41 1hj4 n GLY 423 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1hj4 n HIS 424 N -2.77 0.68 -0.07 1.61 8.25 0.29 -5.02 115.22 118.18 1hj4 n HIS 424 Ca -0.15 -3.72 -0.07 0.00 -0.26 0.00 0.00 57.72 53.52 1hj4 n HIS 424 Cb 0.89 -0.41 -0.01 0.00 1.12 0.00 0.00 29.99 31.59 1hj4 n HIS 424 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 1hj4 h PRO 425 N 3.96 0.04 -0.42 -0.41 0.11 -1.64 -1.97 132.00 131.67 1hj4 h PRO 425 Ca 0.10 -0.00 0.02 0.00 0.11 0.00 0.00 66.00 66.23 1hj4 h PRO 425 Cb 0.83 -0.01 -0.02 0.00 0.11 0.00 0.00 31.00 31.91 1hj4 h PRO 425 CO 0.56 0.03 0.28 -0.44 -0.21 0.00 0.00 178.00 178.21 1hj4 h ASP 426 N 0.04 0.43 1.48 -2.05 3.32 -1.91 -2.52 116.42 115.21 1hj4 h ASP 426 Ca 0.14 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.18 1hj4 h ASP 426 Cb 0.20 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.64 1hj4 h ASP 426 CO -0.26 0.30 -0.18 0.78 -1.72 0.00 0.00 179.24 178.16 1hj4 h ASN 427 N 0.50 0.00 -2.68 6.45 2.35 -1.74 -3.46 115.58 117.00 1hj4 h ASN 427 Ca 0.16 -0.04 -0.52 0.00 -0.55 0.00 0.00 56.30 55.35 1hj4 h ASN 427 Cb 0.03 0.00 0.04 0.00 0.05 0.00 0.00 38.32 38.44 1hj4 h ASN 427 CO -0.04 0.02 1.00 0.00 -1.65 0.00 0.00 177.43 176.76 1hj4 s ALA 428 N -3.16 3.82 -1.93 -0.83 0.00 -0.81 -2.58 121.76 116.27 1hj4 s ALA 428 Ca 0.08 1.44 0.00 0.00 0.00 0.00 0.00 51.96 53.48 1hj4 s ALA 428 Cb 0.10 -3.69 0.00 0.00 0.00 0.00 0.00 23.12 19.53 1hj4 s ALA 428 CO 0.65 -0.98 0.00 0.91 0.00 0.00 0.00 175.76 176.34 1hj4 n TRP 429 N 4.62 -0.59 -4.75 0.00 5.03 0.36 -4.90 117.44 117.21 1hj4 n TRP 429 Ca 0.16 0.00 -0.31 0.00 3.03 0.00 0.00 57.50 60.38 1hj4 n TRP 429 Cb 0.38 -3.74 -0.13 0.00 -1.03 0.00 0.00 31.31 26.78 1hj4 n TRP 429 CO 0.00 0.00 0.00 0.15 -0.03 0.00 0.00 177.69 177.81 1hj4 s LYS 430 N -4.52 2.06 -0.25 -0.99 -0.14 -1.06 -4.84 119.74 109.99 1hj4 s LYS 430 Ca 0.00 -0.98 -0.29 0.00 -1.36 0.00 0.00 55.97 53.34 1hj4 s LYS 430 Cb 0.00 -2.16 -0.01 0.00 -1.68 0.00 0.00 37.83 33.97 1hj4 s LYS 430 CO 0.00 0.54 1.48 0.42 -0.76 0.00 0.00 175.35 177.03 1hj4 s ILE 431 N -0.87 3.89 -0.14 2.17 -1.09 -1.26 -2.29 121.20 121.61 1hj4 s ILE 431 Ca 0.14 1.00 0.19 0.00 -2.23 0.00 0.00 60.65 59.75 1hj4 s ILE 431 Cb -0.10 -3.90 -0.17 0.00 -1.58 0.00 0.00 42.46 36.71 1hj4 s ILE 431 CO 0.04 -0.37 0.69 0.18 -1.23 0.00 0.00 174.94 174.25 1hj4 n LEU 432 N 8.08 0.58 -3.52 2.97 4.77 0.12 -4.98 117.00 125.02 1hj4 n LEU 432 Ca 0.17 0.25 -0.14 0.00 -0.03 0.00 0.00 56.01 56.26 1hj4 n LEU 432 Cb 0.46 0.10 -0.05 0.00 -2.33 0.00 0.00 43.42 41.60 1hj4 n LEU 432 CO 0.64 0.11 0.56 -0.62 -1.33 0.00 0.00 177.39 176.75 1hj4 s ASP 433 N -5.43 -0.53 -0.11 -1.43 2.15 -1.24 -5.01 116.67 105.06 1hj4 s ASP 433 Ca -0.04 0.43 -0.06 0.00 0.43 0.00 0.00 52.55 53.31 1hj4 s ASP 433 Cb 0.09 0.46 0.05 0.00 -0.30 0.00 0.00 42.92 43.23 1hj4 s ASP 433 CO 0.83 -0.59 0.26 -0.55 -0.17 0.00 0.00 175.17 174.95 1hj4 s SER 434 N -1.56 -0.23 0.08 -0.34 0.15 -1.26 -1.42 113.70 109.12 1hj4 s SER 434 Ca -0.05 0.57 -0.16 0.00 0.70 0.00 0.00 55.95 57.01 1hj4 s SER 434 Cb -0.00 0.47 0.03 0.00 -1.71 0.00 0.00 66.02 64.81 1hj4 s SER 434 CO 0.02 -0.18 0.37 0.72 1.20 0.00 0.00 173.24 175.38 1hj4 s PHE 435 N 1.39 -0.18 0.33 3.44 -0.12 -0.64 -4.95 117.98 117.25 1hj4 s PHE 435 Ca -0.08 -0.02 -0.21 0.00 -0.05 0.00 0.00 56.93 56.56 1hj4 s PHE 435 Cb -0.10 0.20 -0.10 0.00 -0.63 0.00 0.00 43.02 42.39 1hj4 s PHE 435 CO -0.09 -0.61 0.86 -1.25 -0.05 0.00 0.00 175.22 174.08 1hj4 s PRO 436 N -3.17 4.31 0.00 1.99 0.04 -1.26 -0.51 135.00 136.41 1hj4 s PRO 436 Ca -0.01 1.05 0.00 0.00 0.04 0.00 0.00 61.00 62.08 1hj4 s PRO 436 Cb 0.01 -2.59 0.00 0.00 0.04 0.00 0.00 34.50 31.96 1hj4 s PRO 436 CO -0.07 0.20 0.00 0.00 0.04 0.00 0.00 177.00 177.17 1hj4 n ALA 437 N 0.11 0.00 -0.06 8.56 0.00 0.10 -4.90 120.51 124.33 1hj4 n ALA 437 Ca 0.03 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.32 1hj4 n ALA 437 Cb 0.52 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.93 1hj4 n ALA 437 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1hj4 h LEU 438 N 0.00 0.96 0.00 0.00 3.38 -1.88 -3.49 115.31 114.28 1hj4 h LEU 438 Ca 0.00 -0.54 0.00 0.00 0.09 0.00 0.00 57.88 57.43 1hj4 h LEU 438 Cb 0.00 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.47 1hj4 h LEU 438 CO 0.00 1.34 0.00 0.61 0.09 0.00 0.00 178.44 180.48 1hj4 n GLY 439 N 0.43 -1.96 3.68 0.83 0.00 -1.26 -5.04 105.19 101.87 1hj4 n GLY 439 Ca -0.05 -1.16 -0.29 0.00 0.00 0.00 0.00 46.02 44.53 1hj4 n GLY 439 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1hj4 s GLY 440 N 0.00 1.57 0.00 -0.02 0.00 -1.26 -4.12 107.32 103.49 1hj4 s GLY 440 Ca 0.00 -0.37 0.00 0.00 0.00 0.00 0.00 44.72 44.35 1hj4 s GLY 440 CO 0.00 0.24 0.00 0.61 0.00 0.00 0.00 173.10 173.95 1hj4 n GLY 441 N -1.16 0.64 3.77 0.20 0.00 0.06 -3.73 105.19 104.98 1hj4 n GLY 441 Ca 0.05 -0.72 -0.38 0.00 0.00 0.00 0.00 46.02 44.97 1hj4 n GLY 441 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1hj4 s SER 442 N -2.68 7.12 -0.02 1.61 0.15 -0.86 -0.70 113.70 118.31 1hj4 s SER 442 Ca 0.00 2.02 0.00 0.00 0.70 0.00 0.00 55.95 58.67 1hj4 s SER 442 Cb 0.00 -2.59 -0.02 0.00 -1.71 0.00 0.00 66.02 61.70 1hj4 s SER 442 CO 0.00 -0.23 -0.02 0.18 1.20 0.00 0.00 173.24 174.36 1hj4 n LEU 443 N 0.52 2.98 -3.92 3.45 4.77 -1.26 -3.16 117.00 120.39 1hj4 n LEU 443 Ca 0.02 -0.01 -0.17 0.00 -0.03 0.00 0.00 56.01 55.82 1hj4 n LEU 443 Cb 0.48 -0.08 -0.15 0.00 -2.33 0.00 0.00 43.42 41.34 1hj4 n LEU 443 CO 0.47 0.54 -0.40 -0.36 -1.33 0.00 0.00 177.39 176.31 1hj4 s PHE 444 N -2.05 0.52 -0.01 -1.77 0.08 -1.26 -3.99 117.98 109.50 1hj4 s PHE 444 Ca -0.03 -0.10 0.07 0.00 0.12 0.00 0.00 56.93 56.98 1hj4 s PHE 444 Cb 0.01 -0.42 -0.03 0.00 -0.57 0.00 0.00 43.02 42.01 1hj4 s PHE 444 CO 0.05 -0.08 -0.20 -1.50 -0.10 0.00 0.00 175.22 173.39 1hj4 s ILE 445 N 0.37 2.57 -0.09 0.64 2.07 -1.26 -2.14 121.20 123.35 1hj4 s ILE 445 Ca -0.04 -1.04 -0.12 0.00 -1.41 0.00 0.00 60.65 58.04 1hj4 s ILE 445 Cb -0.08 -1.99 0.03 0.00 0.13 0.00 0.00 42.46 40.55 1hj4 s ILE 445 CO -0.00 0.50 0.32 -0.75 -1.91 0.00 0.00 174.94 173.09 1hj4 s LYS 446 N -0.93 0.46 0.35 3.50 2.47 0.25 -4.45 119.74 121.39 1hj4 s LYS 446 Ca 0.12 0.25 -0.06 0.00 -1.56 0.00 0.00 55.97 54.71 1hj4 s LYS 446 Cb -0.10 0.22 0.02 0.00 -1.46 0.00 0.00 37.83 36.50 1hj4 s LYS 446 CO 0.01 -0.09 0.55 -0.08 0.16 0.00 0.00 175.35 175.91 1hj4 s THR 447 N -0.29 0.00 -0.05 3.43 -1.32 -1.26 -0.65 115.64 115.50 1hj4 s THR 447 Ca -0.04 -1.44 -0.17 0.00 -1.21 0.00 0.00 61.69 58.83 1hj4 s THR 447 Cb -0.03 -2.67 0.03 0.00 -1.51 0.00 0.00 72.50 68.32 1hj4 s THR 447 CO 0.02 0.00 0.38 -2.28 -2.21 0.00 0.00 174.62 170.53 1hj4 s HIS 448 N -2.93 -0.30 0.54 9.09 2.46 -1.26 -4.71 115.29 118.18 1hj4 s HIS 448 Ca 0.26 0.57 0.24 0.00 0.47 0.00 0.00 55.06 56.60 1hj4 s HIS 448 Cb -0.02 0.15 1.43 0.00 -0.13 0.00 0.00 32.58 34.01 1hj4 s HIS 448 CO 0.17 -0.38 2.06 -1.35 -2.47 0.00 0.00 174.74 172.78 1hj4 h PRO 449 N 4.13 0.00 -0.01 2.88 0.11 -1.95 -0.90 132.00 136.26 1hj4 h PRO 449 Ca -0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 1hj4 h PRO 449 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1hj4 h PRO 449 CO 0.36 0.00 -0.08 0.09 -0.21 0.00 0.00 178.00 178.17 1hj4 n ASN 450 N -4.28 1.17 -4.75 -2.05 3.02 -1.26 -4.90 115.26 102.21 1hj4 n ASN 450 Ca 0.04 -1.22 -0.30 0.00 -0.03 0.00 0.00 54.58 53.07 1hj4 n ASN 450 Cb 0.41 0.03 -0.07 0.00 -0.61 0.00 0.00 39.78 39.53 1hj4 n ASN 450 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1hj4 s SER 451 N -2.17 5.37 -0.03 6.41 0.15 -0.34 -4.92 113.70 118.16 1hj4 s SER 451 Ca 0.34 -0.07 0.17 0.00 0.70 0.00 0.00 55.95 57.09 1hj4 s SER 451 Cb 0.21 -1.39 0.53 0.00 -1.71 0.00 0.00 66.02 63.66 1hj4 s SER 451 CO 0.40 0.17 1.45 0.00 1.20 0.00 0.00 173.24 176.45 1hj4 n GLN 452 N 0.44 3.00 -4.58 5.44 10.64 -1.26 -4.68 117.38 126.37 1hj4 n GLN 452 Ca -0.09 -2.51 -0.30 0.00 -1.83 0.00 0.00 57.00 52.27 1hj4 n GLN 452 Cb 0.52 -1.55 -0.13 0.00 -0.86 0.00 0.00 30.24 28.23 1hj4 n GLN 452 CO 0.00 0.00 0.00 0.71 -1.83 0.00 0.00 177.06 175.94 1hj4 s TYR 453 N -1.29 2.52 -0.24 2.61 2.02 -1.26 -0.03 117.35 121.67 1hj4 s TYR 453 Ca 0.40 -0.28 0.02 0.00 -0.37 0.00 0.00 57.07 56.84 1hj4 s TYR 453 Cb 0.23 -1.42 0.05 0.00 -0.40 0.00 0.00 41.96 40.42 1hj4 s TYR 453 CO 0.24 0.28 -0.12 -1.17 -1.57 0.00 0.00 175.55 173.20 1hj4 s LEU 454 N -1.62 3.12 -0.16 -1.29 2.96 0.05 -4.51 118.68 117.23 1hj4 s LEU 454 Ca 0.15 -1.14 -0.10 0.00 -0.22 0.00 0.00 54.13 52.82 1hj4 s LEU 454 Cb -0.10 -1.56 -0.05 0.00 0.50 0.00 0.00 46.19 44.98 1hj4 s LEU 454 CO 0.06 -0.14 0.16 -0.31 -1.32 0.00 0.00 176.35 174.80 1hj4 s TYR 455 N 1.18 3.48 -0.10 5.38 1.51 0.18 -1.05 117.35 127.94 1hj4 s TYR 455 Ca -0.04 0.44 -0.01 0.00 -1.01 0.00 0.00 57.07 56.45 1hj4 s TYR 455 Cb -0.18 -2.12 0.03 0.00 -0.11 0.00 0.00 41.96 39.58 1hj4 s TYR 455 CO -0.07 0.43 -0.04 0.08 -1.11 0.00 0.00 175.55 174.85 1hj4 s VAL 456 N -0.10 0.73 0.86 0.71 1.01 0.24 -0.59 120.40 123.26 1hj4 s VAL 456 Ca 0.12 -0.13 -0.11 0.00 0.00 0.00 0.00 61.98 61.85 1hj4 s VAL 456 Cb -0.12 -0.83 0.15 0.00 0.00 0.00 0.00 36.38 35.58 1hj4 s VAL 456 CO 0.01 0.29 1.19 1.51 0.00 0.00 0.00 175.10 178.10 1hj4 s ASP 457 N 1.83 3.79 -0.32 3.32 1.47 -0.91 -1.22 116.67 124.61 1hj4 s ASP 457 Ca 0.05 0.22 0.16 0.00 1.18 0.00 0.00 52.55 54.16 1hj4 s ASP 457 Cb -0.13 -0.48 0.45 0.00 -0.34 0.00 0.00 42.92 42.42 1hj4 s ASP 457 CO -0.07 -2.29 1.23 0.00 0.68 0.00 0.00 175.17 174.73 1hj4 n ALA 458 N -3.40 2.59 -0.28 2.11 0.00 -1.26 -4.36 120.51 115.91 1hj4 n ALA 458 Ca 0.13 -2.09 0.10 0.00 0.00 0.00 0.00 53.44 51.57 1hj4 n ALA 458 Cb 0.60 -0.90 0.24 0.00 0.00 0.00 0.00 19.45 19.38 1hj4 n ALA 458 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1hj4 h THR 459 N 3.83 0.40 -0.42 0.00 2.02 -1.59 -1.69 112.91 115.45 1hj4 h THR 459 Ca -0.24 -0.08 0.00 0.00 0.77 0.00 0.00 66.41 66.86 1hj4 h THR 459 Cb 1.26 0.14 0.00 0.00 -1.74 0.00 0.00 68.15 67.81 1hj4 h THR 459 CO 0.11 0.04 0.00 0.18 0.37 0.00 0.00 175.52 176.22 1hj4 n LEU 460 N -5.20 2.78 -4.77 2.58 4.77 0.12 -4.75 117.00 112.53 1hj4 n LEU 460 Ca 0.18 -1.30 -0.40 0.00 -0.03 0.00 0.00 56.01 54.47 1hj4 n LEU 460 Cb 0.58 -0.28 0.01 0.00 -2.33 0.00 0.00 43.42 41.40 1hj4 n LEU 460 CO 0.09 0.65 1.01 0.21 -1.33 0.00 0.00 177.39 178.02 1hj4 s ASN 461 N -1.25 6.11 0.47 -1.43 3.84 -0.64 -4.75 114.94 117.29 1hj4 s ASN 461 Ca 0.36 2.77 0.26 0.00 0.21 0.00 0.00 52.86 56.47 1hj4 s ASN 461 Cb 0.20 -2.64 0.99 0.00 -0.55 0.00 0.00 41.25 39.24 1hj4 s ASN 461 CO 0.27 -1.00 1.85 1.55 -2.79 0.00 0.00 177.10 176.98 1hj4 h PRO 462 N 2.51 0.00 -5.82 0.43 0.13 -1.90 -3.42 132.00 123.94 1hj4 h PRO 462 Ca -0.50 0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.03 1hj4 h PRO 462 Cb 1.26 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 32.30 1hj4 h PRO 462 CO 0.62 0.16 0.49 -1.21 -0.23 0.00 0.00 178.00 177.83 1hj4 s GLU 463 N -3.62 4.16 0.27 0.86 0.41 -1.26 -4.95 118.70 114.57 1hj4 s GLU 463 Ca 0.01 0.92 0.00 0.00 -0.41 0.00 0.00 54.97 55.50 1hj4 s GLU 463 Cb 0.10 -3.66 0.53 0.00 -1.78 0.00 0.00 34.13 29.32 1hj4 s GLU 463 CO 0.62 -0.56 1.82 0.00 -0.49 0.00 0.00 175.26 176.65 1hj4 h ALA 464 N 7.74 1.42 -0.75 5.21 0.00 -1.97 0.49 119.26 131.40 1hj4 h ALA 464 Ca -0.23 0.04 0.03 0.00 0.00 0.00 0.00 54.91 54.75 1hj4 h ALA 464 Cb 1.09 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.68 1hj4 h ALA 464 CO 0.88 0.14 0.49 1.49 0.00 0.00 0.00 179.25 182.26 1hj4 h GLU 465 N 0.89 0.90 0.21 0.00 4.57 -1.96 -0.82 114.58 118.37 1hj4 h GLU 465 Ca 0.48 -0.05 -0.34 0.00 -1.18 0.00 0.00 59.36 58.26 1hj4 h GLU 465 Cb 0.51 -0.20 0.02 0.00 -0.16 0.00 0.00 28.75 28.92 1hj4 h GLU 465 CO -0.28 0.59 -1.60 0.82 -1.18 0.00 0.00 179.01 177.36 1hj4 h ILE 466 N 0.92 1.12 0.00 2.32 2.04 -1.56 -3.29 117.51 119.06 1hj4 h ILE 466 Ca 0.29 -2.64 -0.05 0.00 1.00 0.00 0.00 64.86 63.47 1hj4 h ILE 466 Cb 0.03 2.89 -0.01 0.00 -0.74 0.00 0.00 36.82 38.99 1hj4 h ILE 466 CO -0.08 0.84 -0.21 0.77 0.00 0.00 0.00 178.15 179.46 1hj4 h SER 467 N 0.12 0.00 -0.59 1.72 4.64 -0.68 -1.65 113.55 117.11 1hj4 h SER 467 Ca -0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.03 1hj4 h SER 467 Cb 2.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.21 1hj4 h SER 467 CO 0.22 0.21 0.00 0.61 -0.87 0.00 0.00 176.83 177.01 1hj4 n GLY 468 N -0.59 2.95 3.36 -0.77 0.00 -0.34 -0.94 105.19 108.87 1hj4 n GLY 468 Ca -0.02 -0.90 -0.18 0.00 0.00 0.00 0.00 46.02 44.92 1hj4 n GLY 468 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1hj4 s SER 469 N -0.91 1.92 -0.01 1.61 0.01 -0.62 -1.14 113.70 114.56 1hj4 s SER 469 Ca 0.52 -1.28 0.02 0.00 1.31 0.00 0.00 55.95 56.52 1hj4 s SER 469 Cb 0.37 -0.00 -0.01 0.00 0.21 0.00 0.00 66.02 66.60 1hj4 s SER 469 CO 0.20 -0.56 -0.07 -0.69 0.41 0.00 0.00 173.24 172.52 1hj4 s VAL 470 N -3.42 0.58 0.02 3.43 1.01 -0.66 -4.19 120.40 117.18 1hj4 s VAL 470 Ca 0.32 -0.31 -0.19 0.00 0.00 0.00 0.00 61.98 61.80 1hj4 s VAL 470 Cb 0.07 -0.49 -0.06 0.00 0.00 0.00 0.00 36.38 35.90 1hj4 s VAL 470 CO 0.11 0.16 0.53 0.00 0.00 0.00 0.00 175.10 175.91 1hj4 s ALA 471 N -0.16 3.58 -0.16 5.51 0.00 -0.36 -0.85 121.76 129.31 1hj4 s ALA 471 Ca 0.03 -0.04 0.00 0.00 0.00 0.00 0.00 51.96 51.95 1hj4 s ALA 471 Cb -0.03 -2.61 0.03 0.00 0.00 0.00 0.00 23.12 20.51 1hj4 s ALA 471 CO -0.00 0.33 -0.11 0.08 0.00 0.00 0.00 175.76 176.05 1hj4 s VAL 472 N -0.73 1.47 -0.08 0.00 1.01 0.03 -0.59 120.40 121.52 1hj4 s VAL 472 Ca 0.28 -0.70 -0.05 0.00 0.00 0.00 0.00 61.98 61.51 1hj4 s VAL 472 Cb -0.18 -1.47 -0.04 0.00 0.00 0.00 0.00 36.38 34.69 1hj4 s VAL 472 CO 0.17 0.33 0.14 -0.36 0.00 0.00 0.00 175.10 175.38 1hj4 s PHE 473 N 1.51 3.54 -0.51 5.22 0.40 -0.22 -1.04 117.98 126.87 1hj4 s PHE 473 Ca 0.03 0.44 -0.20 0.00 -0.60 0.00 0.00 56.93 56.60 1hj4 s PHE 473 Cb -0.14 -1.88 0.06 0.00 0.51 0.00 0.00 43.02 41.56 1hj4 s PHE 473 CO -0.09 0.68 0.67 0.34 0.70 0.00 0.00 175.22 177.52 1hj4 s ASP 474 N -1.34 6.24 0.25 1.36 -1.08 -1.26 -0.77 116.67 120.07 1hj4 s ASP 474 Ca 0.19 -0.83 -0.05 0.00 -0.52 0.00 0.00 52.55 51.35 1hj4 s ASP 474 Cb -0.12 -2.31 0.34 0.00 -1.46 0.00 0.00 42.92 39.37 1hj4 s ASP 474 CO 0.09 -0.93 1.88 0.40 0.52 0.00 0.00 175.17 177.13 1hj4 h ILE 475 N 5.88 1.11 -0.03 4.11 2.04 -0.81 -1.68 117.51 128.14 1hj4 h ILE 475 Ca -0.27 -0.39 0.01 0.00 1.00 0.00 0.00 64.86 65.21 1hj4 h ILE 475 Cb 1.09 -0.13 -0.00 0.00 -0.74 0.00 0.00 36.82 37.04 1hj4 h ILE 475 CO 0.98 0.21 0.03 0.11 0.00 0.00 0.00 178.15 179.48 1hj4 h LYS 476 N 1.14 0.00 -0.00 2.37 1.57 -1.93 -1.35 116.57 118.37 1hj4 h LYS 476 Ca 0.39 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.17 1hj4 h LYS 476 Cb 0.09 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.40 1hj4 h LYS 476 CO -0.15 0.00 -0.30 0.00 -0.57 0.00 0.00 179.45 178.43 1hj4 n ALA 477 N -2.41 3.12 -2.20 3.86 0.00 -0.64 -4.89 120.51 117.35 1hj4 n ALA 477 Ca -0.02 -0.33 -0.42 0.00 0.00 0.00 0.00 53.44 52.67 1hj4 n ALA 477 Cb 0.12 -1.20 -0.03 0.00 0.00 0.00 0.00 19.45 18.34 1hj4 n ALA 477 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1hj4 s MET 478 N -2.74 4.34 -0.00 0.00 -1.94 -0.51 -4.90 119.30 113.56 1hj4 s MET 478 Ca 0.19 2.02 0.07 0.00 -1.71 0.00 0.00 55.69 56.26 1hj4 s MET 478 Cb 0.19 -3.26 -0.08 0.00 2.01 0.00 0.00 34.83 33.69 1hj4 s MET 478 CO 0.58 -0.39 0.29 0.25 -0.01 0.00 0.00 175.02 175.74 1hj4 n THR 479 N 3.87 0.00 -3.92 2.05 -2.24 -1.26 -4.55 114.28 108.22 1hj4 n THR 479 Ca 0.11 -0.33 -0.25 0.00 -2.27 0.00 0.00 64.05 61.30 1hj4 n THR 479 Cb 0.43 0.99 -0.01 0.00 -2.10 0.00 0.00 70.33 69.64 1hj4 n THR 479 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1hj4 n GLY 480 N 1.18 -0.25 0.97 3.38 0.00 -1.26 -4.83 105.19 104.38 1hj4 n GLY 480 Ca 0.01 0.14 0.09 0.00 0.00 0.00 0.00 46.02 46.26 1hj4 n GLY 480 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1hj4 n ASP 481 N -2.98 3.37 0.00 1.61 5.75 -1.26 -4.95 116.55 118.09 1hj4 n ASP 481 Ca -0.28 -1.98 0.00 0.00 -0.01 0.00 0.00 54.79 52.52 1hj4 n ASP 481 Cb 0.67 -0.33 0.00 0.00 -1.03 0.00 0.00 41.12 40.43 1hj4 n ASP 481 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1hj4 n GLY 482 N 1.07 3.18 3.77 6.12 0.00 -1.26 -5.05 105.19 113.02 1hj4 n GLY 482 Ca 0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 1hj4 n GLY 482 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1hj4 s SER 483 N -0.05 4.66 -0.17 1.61 1.04 -1.26 -4.99 113.70 114.53 1hj4 s SER 483 Ca 0.00 1.85 -0.23 0.00 0.48 0.00 0.00 55.95 58.06 1hj4 s SER 483 Cb 0.00 -2.53 -0.02 0.00 0.10 0.00 0.00 66.02 63.57 1hj4 s SER 483 CO 0.00 -1.93 0.71 -1.81 0.98 0.00 0.00 173.24 171.19 1hj4 s ASP 484 N -3.23 6.82 0.31 7.02 1.01 -1.26 -4.92 116.67 122.42 1hj4 s ASP 484 Ca 0.62 1.00 -0.29 0.00 0.71 0.00 0.00 52.55 54.59 1hj4 s ASP 484 Cb -0.18 -2.40 -0.11 0.00 1.01 0.00 0.00 42.92 41.25 1hj4 s ASP 484 CO 0.53 -0.30 1.45 -2.84 0.21 0.00 0.00 175.17 174.22 1hj4 s PRO 485 N 1.88 4.22 0.64 8.23 0.02 -1.26 -4.99 135.00 143.73 1hj4 s PRO 485 Ca 0.33 2.41 -0.13 0.00 0.02 0.00 0.00 61.00 63.64 1hj4 s PRO 485 Cb -0.16 -3.04 -0.02 0.00 0.02 0.00 0.00 34.50 31.30 1hj4 s PRO 485 CO 0.12 -0.44 1.05 -1.21 -0.33 0.00 0.00 177.00 176.19 1hj4 s GLU 486 N -1.23 3.19 0.11 5.54 2.02 -1.26 -4.92 118.70 122.15 1hj4 s GLU 486 Ca 0.56 1.01 0.03 0.00 0.02 0.00 0.00 54.97 56.59 1hj4 s GLU 486 Cb -0.44 -2.02 -0.04 0.00 0.10 0.00 0.00 34.13 31.73 1hj4 s GLU 486 CO 0.52 -0.90 -0.09 -0.59 0.02 0.00 0.00 175.26 174.22 1hj4 s PHE 487 N -2.84 1.05 0.01 1.61 -0.12 -1.26 -4.51 117.98 111.92 1hj4 s PHE 487 Ca 0.60 -0.75 -0.08 0.00 -0.05 0.00 0.00 56.93 56.64 1hj4 s PHE 487 Cb -0.14 -0.57 -0.05 0.00 -0.63 0.00 0.00 43.02 41.63 1hj4 s PHE 487 CO 0.47 -0.02 0.30 0.21 -0.05 0.00 0.00 175.22 176.13 1hj4 s LYS 488 N -3.28 3.65 -0.27 1.99 2.20 -0.21 -4.86 119.74 118.96 1hj4 s LYS 488 Ca 0.10 0.03 -0.10 0.00 -0.36 0.00 0.00 55.97 55.64 1hj4 s LYS 488 Cb 0.01 -3.08 -0.04 0.00 -1.51 0.00 0.00 37.83 33.20 1hj4 s LYS 488 CO -0.01 0.64 0.15 0.99 -0.36 0.00 0.00 175.35 176.76 1hj4 s THR 489 N -1.27 4.98 -0.24 3.43 2.01 -1.26 -0.79 115.64 122.49 1hj4 s THR 489 Ca 0.27 0.06 -0.13 0.00 0.31 0.00 0.00 61.69 62.20 1hj4 s THR 489 Cb -0.14 -3.36 -0.04 0.00 0.01 0.00 0.00 72.50 68.97 1hj4 s THR 489 CO 0.15 0.29 0.27 -0.76 -0.69 0.00 0.00 174.62 173.88 1hj4 s LEU 490 N 1.66 4.10 -1.37 4.42 1.43 -0.03 -4.95 118.68 123.94 1hj4 s LEU 490 Ca 0.07 0.24 -0.11 0.00 -1.03 0.00 0.00 54.13 53.30 1hj4 s LEU 490 Cb -0.16 -2.28 0.11 0.00 0.03 0.00 0.00 46.19 43.89 1hj4 s LEU 490 CO 0.08 -0.04 2.06 -0.81 0.23 0.00 0.00 176.35 177.88 1hj4 n PRO 491 N 4.65 3.30 -0.00 1.29 -0.04 -1.26 -1.65 135.00 141.29 1hj4 n PRO 491 Ca -0.12 -3.09 -0.09 0.00 -0.04 0.00 0.00 63.50 60.16 1hj4 n PRO 491 Cb 0.51 -3.08 -0.03 0.00 -0.04 0.00 0.00 33.50 30.86 1hj4 n PRO 491 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 1hj4 h ILE 492 N 3.82 0.70 -0.81 0.52 1.08 -1.85 0.72 117.51 121.70 1hj4 h ILE 492 Ca 0.49 0.00 -0.03 0.00 -0.39 0.00 0.00 64.86 64.93 1hj4 h ILE 492 Cb 0.62 0.70 -0.04 0.00 -3.07 0.00 0.00 36.82 35.03 1hj4 h ILE 492 CO 1.75 0.00 0.40 0.00 -0.69 0.00 0.00 178.15 179.60 1hj4 h ALA 493 N 0.98 1.04 -0.65 1.87 0.00 -1.44 -2.05 119.26 119.00 1hj4 h ALA 493 Ca 0.08 -0.15 -0.06 0.00 0.00 0.00 0.00 54.91 54.78 1hj4 h ALA 493 Cb 0.24 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 1hj4 h ALA 493 CO -0.20 0.59 0.16 1.49 0.00 0.00 0.00 179.25 181.29 1hj4 h GLU 494 N 1.14 1.05 -0.55 0.00 4.81 -1.65 -1.62 114.58 117.76 1hj4 h GLU 494 Ca 0.28 -0.25 0.06 0.00 -0.13 0.00 0.00 59.36 59.32 1hj4 h GLU 494 Cb 0.10 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 29.31 1hj4 h GLU 494 CO -0.04 0.94 0.36 -1.49 -0.73 0.00 0.00 179.01 178.06 1hj4 h TRP 495 N 0.97 0.50 0.00 0.92 6.55 -0.46 -0.75 115.95 123.68 1hj4 h TRP 495 Ca 0.20 0.01 0.00 0.00 0.95 0.00 0.00 58.89 60.06 1hj4 h TRP 495 Cb 0.36 -0.17 0.00 0.00 -0.86 0.00 0.00 29.16 28.50 1hj4 h TRP 495 CO 0.03 0.27 0.00 0.00 -1.05 0.00 0.00 178.44 177.69 1hj4 n ALA 496 N -2.49 2.06 -2.09 1.49 0.00 -0.64 -4.90 120.51 113.93 1hj4 n ALA 496 Ca 0.08 -0.01 -0.07 0.00 0.00 0.00 0.00 53.44 53.44 1hj4 n ALA 496 Cb 0.25 -1.43 -0.00 0.00 0.00 0.00 0.00 19.45 18.26 1hj4 n ALA 496 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1hj4 n GLY 497 N 0.86 0.11 3.24 0.00 0.00 -0.29 -5.01 105.19 104.11 1hj4 n GLY 497 Ca 0.05 -0.60 -0.34 0.00 0.00 0.00 0.00 46.02 45.12 1hj4 n GLY 497 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1hj4 s ILE 498 N -2.35 2.97 0.00 -0.61 1.01 -1.05 -4.92 121.20 116.25 1hj4 s ILE 498 Ca 0.00 -0.73 0.00 0.00 0.00 0.00 0.00 60.65 59.92 1hj4 s ILE 498 Cb 0.00 -2.38 0.00 0.00 0.01 0.00 0.00 42.46 40.09 1hj4 s ILE 498 CO 0.00 0.38 0.00 0.35 0.00 0.00 0.00 174.94 175.67 1hj4 n THR 499 N 4.73 0.00 -1.96 2.92 -2.24 -1.26 -4.49 114.28 111.98 1hj4 n THR 499 Ca -0.18 0.00 -0.40 0.00 -2.27 0.00 0.00 64.05 61.19 1hj4 n THR 499 Cb 0.50 -0.25 -0.01 0.00 -2.10 0.00 0.00 70.33 68.47 1hj4 n THR 499 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1hj4 s GLU 500 N -1.51 4.10 2.25 -0.78 2.12 -1.26 -4.75 118.70 118.86 1hj4 s GLU 500 Ca 0.00 2.34 0.00 0.00 0.36 0.00 0.00 54.97 57.67 1hj4 s GLU 500 Cb 0.00 -2.91 0.00 0.00 0.26 0.00 0.00 34.13 31.48 1hj4 s GLU 500 CO 0.00 -0.45 0.00 0.41 -0.54 0.00 0.00 175.26 174.68 1hj4 n GLY 501 N 0.63 -0.53 3.21 -1.50 0.00 -1.26 -4.29 105.19 101.45 1hj4 n GLY 501 Ca 0.02 -1.08 -0.42 0.00 0.00 0.00 0.00 46.02 44.54 1hj4 n GLY 501 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1hj4 s GLN 502 N 0.00 3.04 -0.32 1.61 0.74 -1.26 -5.04 119.66 118.44 1hj4 s GLN 502 Ca 0.00 -2.46 -0.29 0.00 0.05 0.00 0.00 55.36 52.67 1hj4 s GLN 502 Cb 0.00 -4.07 -0.01 0.00 1.10 0.00 0.00 33.01 30.04 1hj4 s GLN 502 CO 0.00 -1.23 1.51 -1.25 -0.55 0.00 0.00 175.29 173.77 1hj4 s PRO 503 N 0.13 3.67 -0.28 1.67 0.04 -1.26 -4.47 135.00 134.50 1hj4 s PRO 503 Ca 0.17 1.30 -0.07 0.00 0.04 0.00 0.00 61.00 62.44 1hj4 s PRO 503 Cb -0.16 -4.03 -0.01 0.00 0.04 0.00 0.00 34.50 30.35 1hj4 s PRO 503 CO -0.06 -1.44 0.07 1.03 0.04 0.00 0.00 177.00 176.65 1hj4 s ARG 504 N 4.82 3.31 0.03 4.56 0.52 0.44 -4.37 118.95 128.25 1hj4 s ARG 504 Ca 0.66 -0.71 -0.30 0.00 -0.52 0.00 0.00 55.73 54.86 1hj4 s ARG 504 Cb -0.19 -3.34 -0.05 0.00 0.52 0.00 0.00 34.95 31.89 1hj4 s ARG 504 CO 0.30 -0.34 1.23 0.08 0.02 0.00 0.00 175.30 176.58 1hj4 s VAL 505 N 1.54 4.03 -0.05 3.52 1.01 -0.12 -1.64 120.40 128.69 1hj4 s VAL 505 Ca 0.04 1.43 -0.05 0.00 0.00 0.00 0.00 61.98 63.40 1hj4 s VAL 505 Cb -0.16 -3.92 0.01 0.00 0.00 0.00 0.00 36.38 32.31 1hj4 s VAL 505 CO 0.03 0.07 0.15 0.54 0.00 0.00 0.00 175.10 175.88 1hj4 s VAL 506 N 1.50 0.00 -0.06 2.92 0.11 -0.28 -3.83 120.40 120.76 1hj4 s VAL 506 Ca 0.59 -0.03 -0.05 0.00 -2.93 0.00 0.00 61.98 59.56 1hj4 s VAL 506 Cb -0.29 -0.22 0.02 0.00 -1.53 0.00 0.00 36.38 34.36 1hj4 s VAL 506 CO 0.27 -0.01 0.10 1.67 -3.33 0.00 0.00 175.10 173.80 1hj4 n GLN 507 N 2.94 -4.85 -2.50 1.54 7.27 -1.26 -2.08 117.38 118.43 1hj4 n GLN 507 Ca -0.13 3.57 -0.39 0.00 0.07 0.00 0.00 57.00 60.12 1hj4 n GLN 507 Cb 0.59 -4.76 -0.04 0.00 2.41 0.00 0.00 30.24 28.44 1hj4 n GLN 507 CO 0.00 0.00 0.00 0.20 0.07 0.00 0.00 177.06 177.33 1hj4 s GLY 508 N -0.61 2.96 -0.09 1.69 0.00 -1.26 -4.26 107.32 105.75 1hj4 s GLY 508 Ca -0.12 0.82 -0.04 0.00 0.00 0.00 0.00 44.72 45.39 1hj4 s GLY 508 CO 0.32 1.37 0.20 1.85 0.00 0.00 0.00 173.10 176.83 1hj4 s GLU 509 N -1.79 0.14 0.43 2.90 2.56 -0.54 -4.89 118.70 117.50 1hj4 s GLU 509 Ca 0.49 0.49 -0.04 0.00 0.00 0.00 0.00 54.97 55.91 1hj4 s GLU 509 Cb -0.28 -0.15 -0.04 0.00 2.00 0.00 0.00 34.13 35.65 1hj4 s GLU 509 CO 0.36 -0.19 0.71 -0.06 -0.56 0.00 0.00 175.26 175.52 1hj4 s PHE 510 N 1.44 3.53 0.99 5.30 0.40 -1.26 -0.30 117.98 128.09 1hj4 s PHE 510 Ca -0.07 0.71 -0.16 0.00 -0.60 0.00 0.00 56.93 56.81 1hj4 s PHE 510 Cb -0.11 -2.20 0.20 0.00 0.51 0.00 0.00 43.02 41.42 1hj4 s PHE 510 CO -0.07 -0.13 1.24 0.54 0.70 0.00 0.00 175.22 177.49 1hj4 s ASN 511 N -3.94 2.82 0.30 1.36 4.22 -0.81 -4.60 114.94 114.29 1hj4 s ASN 511 Ca 0.46 0.49 -0.02 0.00 -2.14 0.00 0.00 52.86 51.65 1hj4 s ASN 511 Cb -0.10 -0.69 0.45 0.00 1.28 0.00 0.00 41.25 42.19 1hj4 s ASN 511 CO 0.40 -2.93 1.96 0.50 -2.04 0.00 0.00 177.10 174.99 1hj4 h LYS 512 N -1.77 1.08 0.00 3.55 3.64 -1.87 -2.47 116.57 118.73 1hj4 h LYS 512 Ca -0.45 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 58.86 1hj4 h LYS 512 Cb 1.27 -0.24 0.00 0.00 -0.41 0.00 0.00 32.23 32.85 1hj4 h LYS 512 CO 0.43 0.72 -0.13 -0.25 -2.27 0.00 0.00 179.45 177.95 1hj4 n ASP 513 N -4.42 0.48 -1.07 4.20 8.00 -1.26 -4.93 116.55 117.54 1hj4 n ASP 513 Ca 0.10 0.41 -0.09 0.00 0.71 0.00 0.00 54.79 55.92 1hj4 n ASP 513 Cb 0.06 -0.47 -0.00 0.00 -0.02 0.00 0.00 41.12 40.69 1hj4 n ASP 513 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1hj4 n GLY 514 N 1.40 0.00 0.00 0.44 0.00 -0.93 -4.78 105.19 101.32 1hj4 n GLY 514 Ca 0.06 -0.49 0.07 0.00 0.00 0.00 0.00 46.02 45.65 1hj4 n GLY 514 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1hj4 n THR 515 N -4.00 0.00 -4.03 2.61 -2.24 -1.26 -4.28 114.28 101.08 1hj4 n THR 515 Ca -0.11 -0.20 -0.12 0.00 -2.27 0.00 0.00 64.05 61.36 1hj4 n THR 515 Cb 0.58 0.87 -0.11 0.00 -2.10 0.00 0.00 70.33 69.56 1hj4 n THR 515 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1hj4 s GLU 516 N -2.40 0.45 -0.05 -0.78 2.02 -1.26 -1.50 118.70 115.19 1hj4 s GLU 516 Ca 0.03 -0.71 0.02 0.00 0.02 0.00 0.00 54.97 54.34 1hj4 s GLU 516 Cb 0.10 -0.15 0.01 0.00 0.10 0.00 0.00 34.13 34.19 1hj4 s GLU 516 CO 0.56 0.02 -0.11 0.54 0.02 0.00 0.00 175.26 176.29 1hj4 s VAL 517 N -1.41 1.03 -0.07 2.63 0.11 -0.29 -1.93 120.40 120.47 1hj4 s VAL 517 Ca -0.12 -0.44 -0.02 0.00 -2.93 0.00 0.00 61.98 58.47 1hj4 s VAL 517 Cb -0.10 -0.93 -0.04 0.00 -1.53 0.00 0.00 36.38 33.78 1hj4 s VAL 517 CO -0.00 0.32 0.05 0.26 -3.33 0.00 0.00 175.10 172.40 1hj4 s TRP 518 N 0.51 3.27 0.02 1.54 0.52 0.59 -0.36 118.94 125.03 1hj4 s TRP 518 Ca -0.10 0.25 0.05 0.00 0.02 0.00 0.00 56.10 56.32 1hj4 s TRP 518 Cb -0.14 -1.80 -0.02 0.00 -1.15 0.00 0.00 33.47 30.37 1hj4 s TRP 518 CO 0.02 0.54 -0.15 -0.06 0.02 0.00 0.00 176.95 177.32 1hj4 s PHE 519 N -1.00 1.31 -0.09 -1.98 0.08 -0.00 -1.47 117.98 114.82 1hj4 s PHE 519 Ca 0.16 -0.32 -0.18 0.00 0.12 0.00 0.00 56.93 56.71 1hj4 s PHE 519 Cb -0.12 -0.80 -0.04 0.00 -0.57 0.00 0.00 43.02 41.49 1hj4 s PHE 519 CO 0.06 0.02 0.50 -1.12 -0.10 0.00 0.00 175.22 174.58 1hj4 s SER 520 N -0.89 6.74 -0.82 1.36 0.01 -0.88 -0.84 113.70 118.37 1hj4 s SER 520 Ca 0.03 0.88 -0.13 0.00 1.31 0.00 0.00 55.95 58.05 1hj4 s SER 520 Cb -0.07 -2.30 0.22 0.00 0.21 0.00 0.00 66.02 64.08 1hj4 s SER 520 CO 0.01 0.03 0.75 -0.69 0.41 0.00 0.00 173.24 173.75 1hj4 s VAL 521 N 0.41 5.47 -0.46 3.43 1.01 0.12 -1.13 120.40 129.25 1hj4 s VAL 521 Ca 0.27 -2.53 -0.25 0.00 0.00 0.00 0.00 61.98 59.47 1hj4 s VAL 521 Cb -0.16 -4.39 0.03 0.00 0.00 0.00 0.00 36.38 31.86 1hj4 s VAL 521 CO 0.12 -1.02 0.87 0.86 0.00 0.00 0.00 175.10 175.93 1hj4 s TRP 522 N 0.11 2.95 0.46 5.22 -0.00 -0.65 -2.26 118.94 124.77 1hj4 s TRP 522 Ca 0.18 0.30 0.05 0.00 -0.00 0.00 0.00 56.10 56.64 1hj4 s TRP 522 Cb -0.11 -3.84 -0.04 0.00 -0.00 0.00 0.00 33.47 29.48 1hj4 s TRP 522 CO -0.09 -1.05 0.11 1.21 -0.00 0.00 0.00 176.95 177.13 1hj4 s ASN 523 N 2.21 4.21 0.96 5.86 3.84 -1.26 -0.42 114.94 130.33 1hj4 s ASN 523 Ca 0.34 -1.35 -0.10 0.00 0.21 0.00 0.00 52.86 51.96 1hj4 s ASN 523 Cb -0.11 -0.07 0.17 0.00 -0.55 0.00 0.00 41.25 40.69 1hj4 s ASN 523 CO 0.25 -0.67 1.13 -0.83 -2.79 0.00 0.00 177.10 174.19 1hj4 s GLY 524 N -3.89 1.67 0.54 1.21 0.00 -1.26 -4.20 107.32 101.40 1hj4 s GLY 524 Ca 0.29 0.49 0.22 0.00 0.00 0.00 0.00 44.72 45.72 1hj4 s GLY 524 CO 0.16 0.96 2.18 0.07 0.00 0.00 0.00 173.10 176.46 1hj4 h LYS 525 N -2.02 0.00 -0.53 2.90 2.10 -1.99 -0.92 116.57 116.11 1hj4 h LYS 525 Ca -0.46 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.19 1hj4 h LYS 525 Cb 1.28 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.61 1hj4 h LYS 525 CO 0.43 0.02 0.00 -0.25 -2.00 0.00 0.00 179.45 177.65 1hj4 n ASP 526 N -4.16 4.68 -4.73 7.07 8.00 -1.26 -4.86 116.55 121.29 1hj4 n ASP 526 Ca -0.03 -2.63 -0.29 0.00 0.71 0.00 0.00 54.79 52.55 1hj4 n ASP 526 Cb 0.11 -0.57 -0.08 0.00 -0.02 0.00 0.00 41.12 40.56 1hj4 n ASP 526 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1hj4 s GLN 527 N -2.17 2.13 -0.14 -1.24 -1.52 -0.35 -5.12 119.66 111.26 1hj4 s GLN 527 Ca 0.48 -2.18 -0.20 0.00 -1.95 0.00 0.00 55.36 51.52 1hj4 s GLN 527 Cb 0.33 -1.70 -0.04 0.00 -0.22 0.00 0.00 33.01 31.39 1hj4 s GLN 527 CO 0.19 -0.25 0.55 -2.00 -0.25 0.00 0.00 175.29 173.53 1hj4 s GLU 528 N -3.87 4.30 0.53 2.91 2.12 -1.26 -4.76 118.70 118.67 1hj4 s GLU 528 Ca 0.24 0.55 0.04 0.00 0.36 0.00 0.00 54.97 56.15 1hj4 s GLU 528 Cb 0.04 -3.49 0.02 0.00 0.26 0.00 0.00 34.13 30.96 1hj4 s GLU 528 CO 0.13 0.00 0.24 -1.12 -0.54 0.00 0.00 175.26 173.97 1hj4 s SER 529 N 0.87 4.43 0.24 -1.70 0.01 -1.26 -4.59 113.70 111.69 1hj4 s SER 529 Ca 0.28 -1.41 -0.22 0.00 1.31 0.00 0.00 55.95 55.90 1hj4 s SER 529 Cb -0.16 0.46 0.04 0.00 0.21 0.00 0.00 66.02 66.57 1hj4 s SER 529 CO 0.11 -1.00 0.76 0.00 0.41 0.00 0.00 173.24 173.53 1hj4 s ALA 530 N -2.81 -1.36 -0.08 1.44 0.00 -0.96 -4.74 121.76 113.25 1hj4 s ALA 530 Ca 0.22 -0.11 0.03 0.00 0.00 0.00 0.00 51.96 52.10 1hj4 s ALA 530 Cb -0.01 0.80 -0.02 0.00 0.00 0.00 0.00 23.12 23.89 1hj4 s ALA 530 CO 0.14 -1.01 -0.16 -0.51 0.00 0.00 0.00 175.76 174.21 1hj4 s LEU 531 N -2.90 2.57 -0.21 0.00 1.43 -0.35 0.13 118.68 119.35 1hj4 s LEU 531 Ca 0.10 -0.32 -0.04 0.00 -1.03 0.00 0.00 54.13 52.85 1hj4 s LEU 531 Cb -0.04 -1.53 -0.01 0.00 0.03 0.00 0.00 46.19 44.63 1hj4 s LEU 531 CO 0.04 0.26 -0.04 -0.69 0.23 0.00 0.00 176.35 176.14 1hj4 s VAL 532 N -0.21 3.42 -0.29 -1.59 1.01 -0.02 -0.05 120.40 122.66 1hj4 s VAL 532 Ca -0.00 -0.48 -0.12 0.00 0.00 0.00 0.00 61.98 61.38 1hj4 s VAL 532 Cb -0.13 -2.55 -0.04 0.00 0.00 0.00 0.00 36.38 33.66 1hj4 s VAL 532 CO 0.03 0.43 0.24 -0.69 0.00 0.00 0.00 175.10 175.11 1hj4 s VAL 533 N 1.37 5.27 -0.14 2.92 1.01 0.48 -0.82 120.40 130.49 1hj4 s VAL 533 Ca 0.04 0.17 -0.07 0.00 0.00 0.00 0.00 61.98 62.12 1hj4 s VAL 533 Cb -0.14 -3.61 -0.04 0.00 0.00 0.00 0.00 36.38 32.59 1hj4 s VAL 533 CO -0.02 0.17 0.10 -0.69 0.00 0.00 0.00 175.10 174.66 1hj4 s VAL 534 N 1.82 5.14 -0.44 2.92 1.01 0.52 -1.04 120.40 130.33 1hj4 s VAL 534 Ca 0.08 0.08 -0.29 0.00 0.00 0.00 0.00 61.98 61.85 1hj4 s VAL 534 Cb -0.16 -3.26 0.02 0.00 0.00 0.00 0.00 36.38 32.98 1hj4 s VAL 534 CO 0.11 0.56 1.18 -0.62 0.00 0.00 0.00 175.10 176.33 1hj4 s ASP 535 N -0.51 6.62 0.46 3.32 -1.08 -0.20 -1.14 116.67 124.14 1hj4 s ASP 535 Ca 0.11 0.61 0.19 0.00 -0.52 0.00 0.00 52.55 52.94 1hj4 s ASP 535 Cb -0.12 -2.55 1.10 0.00 -1.46 0.00 0.00 42.92 39.89 1hj4 s ASP 535 CO 0.02 -1.24 1.98 -0.78 0.52 0.00 0.00 175.17 175.67 1hj4 h ASP 536 N 9.34 0.00 -0.28 -0.34 3.58 -1.59 0.34 116.42 127.47 1hj4 h ASP 536 Ca -0.24 0.00 -0.10 0.00 0.42 0.00 0.00 57.03 57.12 1hj4 h ASP 536 Cb 1.07 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 42.11 1hj4 h ASP 536 CO 1.11 0.21 -0.21 0.50 -2.88 0.00 0.00 179.24 177.96 1hj4 h LYS 537 N 0.00 0.64 0.00 0.28 3.64 -1.91 -3.35 116.57 115.86 1hj4 h LYS 537 Ca -0.00 -0.31 0.00 0.00 -1.27 0.00 0.00 60.65 59.07 1hj4 h LYS 537 Cb 0.42 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.24 1hj4 h LYS 537 CO 0.03 0.91 -1.25 0.25 -2.27 0.00 0.00 179.45 177.12 1hj4 n THR 538 N -4.35 0.00 -2.63 1.00 -2.24 -1.13 -4.98 114.28 99.96 1hj4 n THR 538 Ca -0.04 -0.24 -0.20 0.00 -2.27 0.00 0.00 64.05 61.31 1hj4 n THR 538 Cb 0.42 0.60 0.01 0.00 -2.10 0.00 0.00 70.33 69.25 1hj4 n THR 538 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1hj4 n LEU 539 N -1.72 -2.21 -4.62 3.22 4.77 0.12 -5.00 117.00 111.57 1hj4 n LEU 539 Ca 0.00 -0.13 -0.24 0.00 -0.03 0.00 0.00 56.01 55.61 1hj4 n LEU 539 Cb 0.35 -2.77 -0.08 0.00 -2.33 0.00 0.00 43.42 38.59 1hj4 n LEU 539 CO 0.35 -0.01 -0.36 -1.61 -1.33 0.00 0.00 177.39 174.43 1hj4 s GLU 540 N -5.25 2.21 0.19 3.23 2.02 -1.22 -4.91 118.70 114.97 1hj4 s GLU 540 Ca 0.13 -1.37 -0.33 0.00 0.02 0.00 0.00 54.97 53.42 1hj4 s GLU 540 Cb -0.06 -2.16 -0.12 0.00 0.10 0.00 0.00 34.13 31.89 1hj4 s GLU 540 CO 0.15 0.39 1.69 -0.11 0.02 0.00 0.00 175.26 177.41 1hj4 n LEU 541 N -0.56 3.76 -0.09 1.80 7.94 -1.26 -1.03 117.00 127.56 1hj4 n LEU 541 Ca -0.08 1.06 -0.16 0.00 -1.11 0.00 0.00 56.01 55.73 1hj4 n LEU 541 Cb 0.58 -1.53 -0.05 0.00 0.53 0.00 0.00 43.42 42.94 1hj4 n LEU 541 CO 0.39 0.06 -0.92 1.17 -1.11 0.00 0.00 177.39 176.97 1hj4 n LYS 542 N 3.93 0.43 -3.67 1.96 3.00 -0.20 -4.80 118.16 118.81 1hj4 n LYS 542 Ca 0.16 0.18 -0.14 0.00 -0.00 0.00 0.00 58.31 58.52 1hj4 n LYS 542 Cb 0.33 -1.24 -0.08 0.00 0.00 0.00 0.00 35.03 34.04 1hj4 n LYS 542 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.40 175.82 1hj4 s HIS 543 N -2.53 -0.57 -0.20 5.64 5.04 -1.03 -5.01 115.29 116.63 1hj4 s HIS 543 Ca -0.27 1.30 -0.04 0.00 -1.54 0.00 0.00 55.06 54.52 1hj4 s HIS 543 Cb 0.08 0.23 -0.01 0.00 0.04 0.00 0.00 32.58 32.91 1hj4 s HIS 543 CO 0.36 -0.35 -0.04 0.08 -2.34 0.00 0.00 174.74 172.44 1hj4 s VAL 544 N -0.11 3.50 -0.36 0.89 1.01 -1.26 -0.38 120.40 123.69 1hj4 s VAL 544 Ca -0.03 -0.46 -0.15 0.00 0.00 0.00 0.00 61.98 61.33 1hj4 s VAL 544 Cb -0.03 -2.57 -0.01 0.00 0.00 0.00 0.00 36.38 33.77 1hj4 s VAL 544 CO 0.03 0.44 0.35 -0.63 0.00 0.00 0.00 175.10 175.28 1hj4 s ILE 545 N 1.13 5.19 0.02 2.22 1.01 0.93 -4.97 121.20 126.74 1hj4 s ILE 545 Ca 0.02 -0.12 0.05 0.00 0.00 0.00 0.00 60.65 60.60 1hj4 s ILE 545 Cb -0.15 -3.84 -0.02 0.00 0.01 0.00 0.00 42.46 38.47 1hj4 s ILE 545 CO -0.00 -0.14 -0.14 -0.54 0.00 0.00 0.00 174.94 174.11 1hj4 s LYS 546 N 1.95 1.04 -0.24 2.79 1.02 -1.26 -1.21 119.74 123.83 1hj4 s LYS 546 Ca 0.10 -0.66 -0.27 0.00 0.02 0.00 0.00 55.97 55.17 1hj4 s LYS 546 Cb -0.17 -1.03 0.12 0.00 -0.52 0.00 0.00 37.83 36.23 1hj4 s LYS 546 CO 0.12 0.27 0.99 0.34 -0.92 0.00 0.00 175.35 176.15 1hj4 s ASP 547 N -0.81 -0.45 0.56 2.83 -1.08 -1.26 -5.02 116.67 111.44 1hj4 s ASP 547 Ca 0.03 0.77 0.24 0.00 -0.52 0.00 0.00 52.55 53.08 1hj4 s ASP 547 Cb -0.07 0.74 1.56 0.00 -1.46 0.00 0.00 42.92 43.69 1hj4 s ASP 547 CO 0.01 -0.23 2.17 -0.33 0.52 0.00 0.00 175.17 177.31 1hj4 h GLU 548 N 3.76 0.00 0.00 4.34 4.39 -2.01 -1.10 114.58 123.95 1hj4 h GLU 548 Ca -0.26 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.44 1hj4 h GLU 548 Cb 1.17 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.82 1hj4 h GLU 548 CO 0.17 0.00 0.00 0.00 -1.16 0.00 0.00 179.01 178.02 1hj4 h ARG 549 N 0.00 0.00 -4.55 2.33 3.08 -2.02 -3.41 114.38 109.81 1hj4 h ARG 549 Ca 0.04 0.00 -0.69 0.00 0.07 0.00 0.00 59.98 59.40 1hj4 h ARG 549 Cb 0.17 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.18 1hj4 h ARG 549 CO -0.00 0.00 2.77 -0.11 -1.07 0.00 0.00 179.97 181.56 1hj4 n LEU 550 N -2.30 6.04 -4.67 3.04 7.94 -0.42 -4.93 117.00 121.70 1hj4 n LEU 550 Ca 0.05 -3.95 -0.39 0.00 -1.11 0.00 0.00 56.01 50.60 1hj4 n LEU 550 Cb 0.40 -1.64 -0.06 0.00 0.53 0.00 0.00 43.42 42.64 1hj4 n LEU 550 CO 0.28 0.66 0.29 -0.69 -1.11 0.00 0.00 177.39 176.83 1hj4 s VAL 551 N 3.84 5.08 -1.26 1.96 1.01 -1.26 -4.43 120.40 125.34 1hj4 s VAL 551 Ca 0.50 1.07 -0.24 0.00 0.00 0.00 0.00 61.98 63.31 1hj4 s VAL 551 Cb 0.11 -3.89 0.02 0.00 0.00 0.00 0.00 36.38 32.63 1hj4 s VAL 551 CO -0.02 0.17 0.60 0.35 0.00 0.00 0.00 175.10 176.19 1hj4 n THR 552 N 4.50 -3.31 -1.99 3.92 -2.24 -1.26 -3.65 114.28 110.25 1hj4 n THR 552 Ca -0.03 -0.67 -0.42 0.00 -2.27 0.00 0.00 64.05 60.65 1hj4 n THR 552 Cb 0.50 -2.67 -0.03 0.00 -2.10 0.00 0.00 70.33 66.04 1hj4 n THR 552 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 1hj4 s PRO 553 N -7.01 4.23 0.00 -0.78 0.04 -1.26 -1.73 135.00 128.50 1hj4 s PRO 553 Ca 0.39 2.27 0.00 0.00 0.04 0.00 0.00 61.00 63.69 1hj4 s PRO 553 Cb -0.19 -3.41 0.00 0.00 0.04 0.00 0.00 34.50 30.94 1hj4 s PRO 553 CO 0.94 -0.64 0.00 0.25 0.04 0.00 0.00 177.00 177.60 1hj4 n THR 554 N 4.37 0.00 -1.95 1.26 -2.24 -0.49 -4.28 114.28 110.95 1hj4 n THR 554 Ca 0.14 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.51 1hj4 n THR 554 Cb 0.40 0.00 -0.01 0.00 -2.10 0.00 0.00 70.33 68.62 1hj4 n THR 554 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1hj4 s GLY 555 N 0.00 2.69 -0.07 3.38 0.00 -1.26 -4.70 107.32 107.36 1hj4 s GLY 555 Ca 0.00 1.41 0.03 0.00 0.00 0.00 0.00 44.72 46.16 1hj4 s GLY 555 CO 0.00 2.20 -0.14 0.54 0.00 0.00 0.00 173.10 175.70 1hj4 s LYS 556 N -1.33 1.82 -0.14 2.90 1.02 -1.26 -0.35 119.74 122.40 1hj4 s LYS 556 Ca 0.55 -0.48 -0.01 0.00 0.02 0.00 0.00 55.97 56.05 1hj4 s LYS 556 Cb -0.43 -1.50 0.04 0.00 -0.52 0.00 0.00 37.83 35.42 1hj4 s LYS 556 CO 0.53 0.07 -0.03 -0.06 -0.92 0.00 0.00 175.35 174.93 1hj4 s PHE 557 N 0.55 1.36 0.13 3.18 0.08 -0.13 -4.83 117.98 118.31 1hj4 s PHE 557 Ca -0.14 -0.80 -0.30 0.00 0.12 0.00 0.00 56.93 55.82 1hj4 s PHE 557 Cb -0.15 -1.16 -0.07 0.00 -0.57 0.00 0.00 43.02 41.08 1hj4 s PHE 557 CO 0.04 -0.54 1.10 1.21 -0.10 0.00 0.00 175.22 176.93 1hj4 s ASN 558 N 1.75 7.26 0.13 1.36 3.84 -1.26 -0.51 114.94 127.51 1hj4 s ASN 558 Ca 0.02 2.01 -0.24 0.00 0.21 0.00 0.00 52.86 54.86 1hj4 s ASN 558 Cb -0.14 -2.59 -0.03 0.00 -0.55 0.00 0.00 41.25 37.93 1hj4 s ASN 558 CO -0.07 -0.26 1.65 0.58 -2.79 0.00 0.00 177.10 176.21 1hj4 h VAL 559 N 4.02 0.52 -0.26 -5.21 2.07 -1.24 -1.18 116.25 114.97 1hj4 h VAL 559 Ca -0.43 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.06 1hj4 h VAL 559 Cb 1.21 0.52 -0.01 0.00 -1.52 0.00 0.00 31.29 31.49 1hj4 h VAL 559 CO 0.74 0.00 0.06 0.22 0.02 0.00 0.00 177.57 178.62 1hj4 h TYR 560 N -0.28 0.44 0.00 1.57 3.20 -1.60 -0.65 116.97 119.66 1hj4 h TYR 560 Ca 0.08 -0.05 -0.07 0.00 3.14 0.00 0.00 58.73 61.83 1hj4 h TYR 560 Cb 0.39 -0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.53 1hj4 h TYR 560 CO -0.28 0.51 -0.32 -0.91 -1.64 0.00 0.00 178.16 175.52 1hj4 h ASN 561 N 0.25 0.00 0.15 -2.11 2.35 -1.81 -1.95 115.58 112.46 1hj4 h ASN 561 Ca 0.08 0.00 -0.22 0.00 -0.55 0.00 0.00 56.30 55.61 1hj4 h ASN 561 Cb 0.29 0.00 0.02 0.00 0.05 0.00 0.00 38.32 38.68 1hj4 h ASN 561 CO 0.00 0.32 -1.02 0.74 -1.65 0.00 0.00 177.43 175.82 1hj4 h THR 562 N 0.00 1.39 -0.27 2.81 2.02 -1.02 -0.36 112.91 117.47 1hj4 h THR 562 Ca -0.00 -2.53 -0.05 0.00 0.77 0.00 0.00 66.41 64.60 1hj4 h THR 562 Cb 0.59 3.08 -0.02 0.00 -1.74 0.00 0.00 68.15 70.06 1hj4 h THR 562 CO 0.04 0.73 -0.03 0.00 0.37 0.00 0.00 175.52 176.62 1hj4 h MET 563 N -0.30 0.41 -0.06 6.66 -0.00 -1.01 -2.83 114.93 117.80 1hj4 h MET 563 Ca -0.19 -0.08 0.00 0.00 -0.00 0.00 0.00 59.70 59.43 1hj4 h MET 563 Cb 1.73 -0.06 0.00 0.00 -0.00 0.00 0.00 31.60 33.27 1hj4 h MET 563 CO 0.15 0.47 0.00 0.25 -0.00 0.00 0.00 176.91 177.77 1hj4 n THR 564 N -4.29 0.05 -3.73 -0.10 -2.24 -0.74 -4.77 114.28 98.46 1hj4 n THR 564 Ca 0.01 -0.48 -0.22 0.00 -2.27 0.00 0.00 64.05 61.08 1hj4 n THR 564 Cb 0.24 1.28 0.03 0.00 -2.10 0.00 0.00 70.33 69.78 1hj4 n THR 564 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1hj4 n ASP 565 N 1.17 -1.33 -4.38 3.42 8.00 -0.96 -4.93 116.55 117.55 1hj4 n ASP 565 Ca 0.15 -0.83 -0.45 0.00 0.71 0.00 0.00 54.79 54.38 1hj4 n ASP 565 Cb 0.56 -4.00 -0.06 0.00 -0.02 0.00 0.00 41.12 37.61 1hj4 n ASP 565 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1hj4 s THR 566 N -3.66 4.99 0.00 -3.53 2.01 -0.19 -5.02 115.64 110.25 1hj4 s THR 566 Ca 0.04 -1.01 0.00 0.00 0.31 0.00 0.00 61.69 61.03 1hj4 s THR 566 Cb -0.02 -4.35 0.00 0.00 0.01 0.00 0.00 72.50 68.14 1hj4 s THR 566 CO 0.82 -0.90 0.00 0.00 -0.69 0.00 0.00 174.62 173.84