#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hcr s LYS 66 N 0.00 3.80 0.11 -0.14 1.02 -1.26 -5.03 119.74 118.25 3hcr s LYS 66 Ca 0.00 1.07 -0.30 0.00 0.02 0.00 0.00 55.97 56.76 3hcr s LYS 66 Cb 0.00 -2.11 -0.07 0.00 -0.52 0.00 0.00 37.83 35.13 3hcr s LYS 66 CO 0.00 -0.40 1.20 -1.25 -0.92 0.00 0.00 175.35 173.97 3hcr s PRO 67 N -3.92 4.46 -0.18 -1.68 0.04 -1.26 -4.73 135.00 127.73 3hcr s PRO 67 Ca 0.61 1.81 -0.14 0.00 0.04 0.00 0.00 61.00 63.32 3hcr s PRO 67 Cb -0.12 -3.30 -0.08 0.00 0.04 0.00 0.00 34.50 31.04 3hcr s PRO 67 CO 0.30 -0.18 -0.19 1.17 0.04 0.00 0.00 177.00 178.14 3hcr n LYS 68 N 3.32 0.51 -3.77 4.56 4.81 -0.79 -4.41 118.16 122.39 3hcr n LYS 68 Ca 0.07 0.40 -0.37 0.00 -0.87 0.00 0.00 58.31 57.54 3hcr n LYS 68 Cb 0.46 -1.60 -0.13 0.00 0.02 0.00 0.00 35.03 33.78 3hcr n LYS 68 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 3hcr s THR 69 N -2.50 3.97 -0.13 3.15 2.01 -1.04 -2.36 115.64 118.73 3hcr s THR 69 Ca -0.25 -0.61 -0.07 0.00 0.31 0.00 0.00 61.69 61.07 3hcr s THR 69 Cb 0.05 -3.01 -0.04 0.00 0.01 0.00 0.00 72.50 69.51 3hcr s THR 69 CO 0.38 0.13 0.13 -0.83 -0.69 0.00 0.00 174.62 173.74 3hcr s GLY 70 N 1.51 2.11 -0.27 4.40 0.00 -0.21 -1.62 107.32 113.25 3hcr s GLY 70 Ca 0.03 -0.66 -0.01 0.00 0.00 0.00 0.00 44.72 44.08 3hcr s GLY 70 CO 0.02 -0.28 -0.05 -0.42 0.00 0.00 0.00 173.10 172.37 3hcr s ILE 71 N -0.72 2.83 -0.42 0.90 1.09 0.54 -1.22 121.20 124.21 3hcr s ILE 71 Ca 0.13 -1.22 -0.19 0.00 -1.10 0.00 0.00 60.65 58.28 3hcr s ILE 71 Cb -0.12 -2.53 0.02 0.00 -1.06 0.00 0.00 42.46 38.78 3hcr s ILE 71 CO 0.03 0.07 0.53 -0.22 -0.10 0.00 0.00 174.94 175.24 3hcr s LEU 72 N 1.27 4.66 -0.42 2.97 2.96 -0.17 -0.22 118.68 129.74 3hcr s LEU 72 Ca -0.03 -0.47 -0.23 0.00 -0.22 0.00 0.00 54.13 53.18 3hcr s LEU 72 Cb -0.18 -2.54 0.02 0.00 0.50 0.00 0.00 46.19 43.98 3hcr s LEU 72 CO -0.03 -0.65 0.79 -0.04 -1.32 0.00 0.00 176.35 175.10 3hcr s MET 73 N 2.44 3.55 -0.05 1.98 -1.94 -0.22 -0.45 119.30 124.60 3hcr s MET 73 Ca 0.17 0.07 -0.13 0.00 -1.71 0.00 0.00 55.69 54.09 3hcr s MET 73 Cb -0.16 -3.89 -0.05 0.00 2.01 0.00 0.00 34.83 32.75 3hcr s MET 73 CO 0.16 -1.01 0.33 -0.51 -0.01 0.00 0.00 175.02 173.98 3hcr s LEU 74 N 3.23 4.42 0.03 -0.03 1.43 -0.39 -0.71 118.68 126.66 3hcr s LEU 74 Ca 0.31 0.78 -0.28 0.00 -1.03 0.00 0.00 54.13 53.91 3hcr s LEU 74 Cb -0.12 -2.45 0.09 0.00 0.03 0.00 0.00 46.19 43.74 3hcr s LEU 74 CO 0.21 0.30 0.94 0.21 0.23 0.00 0.00 176.35 178.23 3hcr s ASN 75 N -0.78 -0.29 0.50 2.29 3.84 -1.08 -0.99 114.94 118.42 3hcr s ASN 75 Ca 0.21 -0.11 0.29 0.00 0.21 0.00 0.00 52.86 53.46 3hcr s ASN 75 Cb -0.15 0.39 1.15 0.00 -0.55 0.00 0.00 41.25 42.09 3hcr s ASN 75 CO 0.10 -0.67 1.91 0.00 -2.79 0.00 0.00 177.10 175.65 3hcr h MET 76 N 2.00 0.00 0.00 0.43 -0.00 -1.93 0.50 114.93 115.92 3hcr h MET 76 Ca -0.22 0.00 0.03 0.00 -0.00 0.00 0.00 59.70 59.51 3hcr h MET 76 Cb 1.23 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 32.83 3hcr h MET 76 CO 0.29 0.10 -0.04 0.41 -0.00 0.00 0.00 176.91 177.67 3hcr n GLY 77 N 0.09 -2.03 3.52 -3.00 0.00 -1.26 -1.97 105.19 100.54 3hcr n GLY 77 Ca 0.00 -1.40 -0.11 0.00 0.00 0.00 0.00 46.02 44.51 3hcr n GLY 77 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3hcr s GLY 78 N -2.33 -0.43 0.04 -0.02 0.00 -1.26 -4.92 107.32 98.40 3hcr s GLY 78 Ca 0.00 1.38 -0.30 0.00 0.00 0.00 0.00 44.72 45.80 3hcr s GLY 78 CO 0.00 0.68 1.87 2.56 0.00 0.00 0.00 173.10 178.21 3hcr s PRO 79 N -2.10 4.15 0.26 2.90 0.04 -1.26 -4.78 135.00 134.20 3hcr s PRO 79 Ca -0.01 2.52 0.01 0.00 0.04 0.00 0.00 61.00 63.57 3hcr s PRO 79 Cb -0.01 -3.98 0.33 0.00 0.04 0.00 0.00 34.50 30.88 3hcr s PRO 79 CO -0.02 -0.90 1.66 1.49 0.04 0.00 0.00 177.00 179.27 3hcr h GLU 80 N 9.87 0.48 -4.80 4.56 4.81 -1.90 0.95 114.58 128.55 3hcr h GLU 80 Ca -0.47 -0.22 -0.32 0.00 -0.13 0.00 0.00 59.36 58.23 3hcr h GLU 80 Cb 1.22 -0.01 -0.15 0.00 0.63 0.00 0.00 28.75 30.45 3hcr h GLU 80 CO 0.94 0.77 -0.62 0.95 -0.73 0.00 0.00 179.01 180.32 3hcr s THR 81 N -4.33 0.40 -0.31 0.32 -4.23 -1.26 -4.21 115.64 102.02 3hcr s THR 81 Ca -0.07 -2.00 0.24 0.00 -1.18 0.00 0.00 61.69 58.68 3hcr s THR 81 Cb 0.13 -2.60 0.25 0.00 1.34 0.00 0.00 72.50 71.62 3hcr s THR 81 CO 0.80 0.00 1.72 -0.07 -0.54 0.00 0.00 174.62 176.54 3hcr h LEU 82 N 2.45 0.00 -0.06 4.79 3.38 -1.84 -2.10 115.31 121.93 3hcr h LEU 82 Ca -0.38 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.52 3hcr h LEU 82 Cb 1.25 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.99 3hcr h LEU 82 CO 0.59 0.00 -0.34 1.23 0.09 0.00 0.00 178.44 180.00 3hcr h GLY 83 N 1.28 0.00 -0.19 0.83 0.00 -1.95 -3.23 103.07 99.81 3hcr h GLY 83 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3hcr h GLY 83 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 176.54 177.76 3hcr n ASP 84 N -3.20 0.94 -0.20 0.19 8.00 -0.79 -4.24 116.55 117.24 3hcr n ASP 84 Ca 0.02 -1.57 -0.09 0.00 0.71 0.00 0.00 54.79 53.86 3hcr n ASP 84 Cb 0.66 -0.06 0.02 0.00 -0.02 0.00 0.00 41.12 41.73 3hcr n ASP 84 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 3hcr h VAL 85 N 1.26 1.27 0.05 2.53 2.07 -1.68 -2.87 116.25 118.88 3hcr h VAL 85 Ca 0.00 -1.17 -0.00 0.00 0.82 0.00 0.00 66.70 66.34 3hcr h VAL 85 Cb 0.27 0.85 0.00 0.00 -1.52 0.00 0.00 31.29 30.89 3hcr h VAL 85 CO 0.00 0.42 -0.02 -0.74 0.02 0.00 0.00 177.57 177.25 3hcr h HIS 86 N 0.95 -0.06 -0.02 1.57 -0.00 -1.85 -1.89 115.15 113.85 3hcr h HIS 86 Ca 0.16 -0.00 -0.07 0.00 -0.00 0.00 0.00 60.37 60.46 3hcr h HIS 86 Cb 0.58 0.02 -0.01 0.00 -0.00 0.00 0.00 27.41 28.00 3hcr h HIS 86 CO 0.04 0.07 -0.33 -0.44 -0.00 0.00 0.00 177.93 177.27 3hcr h ASP 87 N -0.18 0.05 0.31 3.26 3.32 -1.85 0.22 116.42 121.54 3hcr h ASP 87 Ca -0.01 -0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.01 3hcr h ASP 87 Cb 0.16 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 39.70 3hcr h ASP 87 CO 0.01 0.38 -0.15 0.15 -1.72 0.00 0.00 179.24 177.91 3hcr h PHE 88 N 0.04 -0.38 -0.74 4.55 3.57 -1.35 -1.40 116.94 121.22 3hcr h PHE 88 Ca 0.00 -0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.44 3hcr h PHE 88 Cb 0.61 0.13 -0.03 0.00 2.79 0.00 0.00 35.95 39.45 3hcr h PHE 88 CO 0.00 -0.17 0.24 -0.07 -2.23 0.00 0.00 178.31 176.08 3hcr h LEU 89 N -0.52 1.07 0.27 0.59 3.38 -1.15 -2.00 115.31 116.95 3hcr h LEU 89 Ca -0.04 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 57.73 3hcr h LEU 89 Cb 0.39 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.82 3hcr h LEU 89 CO 0.07 0.99 -0.48 0.25 0.09 0.00 0.00 178.44 179.36 3hcr h LEU 90 N 1.10 -1.40 -1.73 1.67 7.12 -0.79 0.15 115.31 121.44 3hcr h LEU 90 Ca 0.24 0.14 -0.02 0.00 0.13 0.00 0.00 57.88 58.36 3hcr h LEU 90 Cb 0.30 0.50 -0.01 0.00 -0.53 0.00 0.00 40.66 40.92 3hcr h LEU 90 CO -0.01 -0.58 -0.09 0.03 -0.13 0.00 0.00 178.44 177.66 3hcr h ARG 91 N -0.82 0.06 0.24 1.25 3.08 -1.20 -2.51 114.38 114.47 3hcr h ARG 91 Ca -0.02 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.01 3hcr h ARG 91 Cb 0.78 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.82 3hcr h ARG 91 CO -0.18 0.15 -0.11 1.25 -1.07 0.00 0.00 179.97 180.00 3hcr h LEU 92 N 0.06 -0.27 -0.11 3.04 6.46 -0.63 -2.76 115.31 121.09 3hcr h LEU 92 Ca 0.01 -0.22 0.00 0.00 -0.12 0.00 0.00 57.88 57.56 3hcr h LEU 92 Cb 0.20 0.07 0.00 0.00 -0.73 0.00 0.00 40.66 40.20 3hcr h LEU 92 CO 0.01 0.09 0.00 0.49 -0.62 0.00 0.00 178.44 178.42 3hcr n PHE 93 N -5.08 0.13 0.77 1.25 3.01 -0.03 -1.71 117.46 115.80 3hcr n PHE 93 Ca -0.09 0.05 0.12 0.00 1.01 0.00 0.00 57.45 58.54 3hcr n PHE 93 Cb 0.25 -0.58 0.22 0.00 -0.01 0.00 0.00 39.48 39.35 3hcr n PHE 93 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 3hcr n LEU 94 N -1.62 0.58 -4.58 4.37 4.77 -0.96 -4.75 117.00 114.81 3hcr n LEU 94 Ca 0.03 0.13 -0.41 0.00 -0.03 0.00 0.00 56.01 55.73 3hcr n LEU 94 Cb 0.18 -0.22 -0.03 0.00 -2.33 0.00 0.00 43.42 41.02 3hcr n LEU 94 CO 0.14 0.03 1.59 -0.62 -1.33 0.00 0.00 177.39 177.20 3hcr s ASP 95 N -3.63 5.59 0.46 -1.43 3.68 -0.70 -4.84 116.67 115.80 3hcr s ASP 95 Ca 0.08 0.99 0.30 0.00 2.13 0.00 0.00 52.55 56.05 3hcr s ASP 95 Cb 0.15 -2.53 1.10 0.00 -1.45 0.00 0.00 42.92 40.20 3hcr s ASP 95 CO 0.71 -2.00 1.86 -0.09 0.13 0.00 0.00 175.17 175.78 3hcr h ARG 96 N 14.00 0.00 0.00 4.34 9.65 -1.89 -2.07 114.38 138.41 3hcr h ARG 96 Ca -0.31 0.00 -0.01 0.00 -1.10 0.00 0.00 59.98 58.56 3hcr h ARG 96 Cb 1.17 0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 29.75 3hcr h ARG 96 CO 1.10 0.00 -0.17 -0.44 2.80 0.00 0.00 179.97 183.26 3hcr h ASP 97 N 0.00 0.00 0.10 -3.80 3.32 -1.96 -3.33 116.42 110.75 3hcr h ASP 97 Ca 0.00 0.00 -0.36 0.00 0.02 0.00 0.00 57.03 56.69 3hcr h ASP 97 Cb 0.57 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.10 3hcr h ASP 97 CO 0.00 0.05 -1.98 -0.11 -1.72 0.00 0.00 179.24 175.48 3hcr n LEU 98 N -3.06 2.58 -3.51 1.55 7.94 -0.93 -4.59 117.00 116.97 3hcr n LEU 98 Ca 0.03 0.20 -0.15 0.00 -1.11 0.00 0.00 56.01 54.99 3hcr n LEU 98 Cb 0.55 -1.08 -0.04 0.00 0.53 0.00 0.00 43.42 43.38 3hcr n LEU 98 CO 0.35 0.79 0.36 0.00 -1.11 0.00 0.00 177.39 177.79 3hcr s MET 99 N -2.53 1.12 -0.15 1.96 0.23 -0.82 -4.95 119.30 114.15 3hcr s MET 99 Ca -0.25 -0.16 0.01 0.00 -1.03 0.00 0.00 55.69 54.26 3hcr s MET 99 Cb 0.07 0.52 0.02 0.00 -1.53 0.00 0.00 34.83 33.90 3hcr s MET 99 CO 0.73 -0.42 -0.18 0.99 -2.03 0.00 0.00 175.02 174.11 3hcr s THR 100 N -2.48 1.82 0.25 3.16 2.01 -1.26 -4.09 115.64 115.05 3hcr s THR 100 Ca -0.05 -0.80 0.10 0.00 0.31 0.00 0.00 61.69 61.24 3hcr s THR 100 Cb -0.01 -1.66 -0.05 0.00 0.01 0.00 0.00 72.50 70.80 3hcr s THR 100 CO -0.02 0.50 -0.16 -0.76 -0.69 0.00 0.00 174.62 173.49 3hcr s LEU 101 N 1.25 2.57 0.38 4.42 1.43 -1.26 -5.11 118.68 122.37 3hcr s LEU 101 Ca 0.02 -1.04 -0.25 0.00 -1.03 0.00 0.00 54.13 51.83 3hcr s LEU 101 Cb -0.14 -0.88 -0.09 0.00 0.03 0.00 0.00 46.19 45.12 3hcr s LEU 101 CO -0.09 -0.08 1.09 -2.84 0.23 0.00 0.00 176.35 174.66 3hcr s PRO 102 N -3.59 4.18 -1.05 1.29 0.02 -1.26 -3.40 135.00 131.19 3hcr s PRO 102 Ca 0.27 1.65 -0.19 0.00 0.02 0.00 0.00 61.00 62.75 3hcr s PRO 102 Cb -0.02 -2.67 0.03 0.00 0.02 0.00 0.00 34.50 31.86 3hcr s PRO 102 CO 0.11 -0.16 0.35 0.44 -0.33 0.00 0.00 177.00 177.42 3hcr n ILE 103 N 0.13 -1.62 -0.25 2.83 -5.35 -1.26 -4.70 119.36 109.14 3hcr n ILE 103 Ca 0.04 -0.44 -0.03 0.00 -0.27 0.00 0.00 62.75 62.05 3hcr n ILE 103 Cb 0.48 -1.42 0.08 0.00 -1.74 0.00 0.00 39.64 37.04 3hcr n ILE 103 CO 0.00 0.00 0.00 -0.61 -1.76 0.00 0.00 176.55 174.18 3hcr h GLN 104 N -1.38 0.86 0.00 6.28 4.15 -1.97 -1.69 115.11 121.36 3hcr h GLN 104 Ca -0.55 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 58.82 3hcr h GLN 104 Cb 1.11 -0.19 0.00 0.00 0.21 0.00 0.00 27.48 28.61 3hcr h GLN 104 CO 0.46 0.57 0.14 -0.91 -1.93 0.00 0.00 178.83 177.15 3hcr h ASN 105 N 0.88 0.00 0.00 -0.69 4.21 -1.91 0.16 115.58 118.23 3hcr h ASN 105 Ca 0.29 0.00 -0.33 0.00 1.21 0.00 0.00 56.30 57.47 3hcr h ASN 105 Cb 0.01 0.00 -0.06 0.00 -1.12 0.00 0.00 38.32 37.15 3hcr h ASN 105 CO -0.11 0.00 -2.25 0.29 -1.29 0.00 0.00 177.43 174.07 3hcr n LYS 106 N -2.70 0.61 0.01 0.81 4.76 -0.89 -4.56 118.16 116.20 3hcr n LYS 106 Ca -0.02 0.12 -0.11 0.00 -2.87 0.00 0.00 58.31 55.42 3hcr n LYS 106 Cb 0.18 -1.44 0.02 0.00 -1.84 0.00 0.00 35.03 31.95 3hcr n LYS 106 CO 0.00 0.00 0.00 1.25 -1.37 0.00 0.00 177.40 177.28 3hcr h LEU 107 N 0.00 0.63 0.11 -0.35 5.85 -0.85 -3.33 115.31 117.37 3hcr h LEU 107 Ca -0.49 -0.38 0.02 0.00 0.84 0.00 0.00 57.88 57.87 3hcr h LEU 107 Cb 1.79 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 42.59 3hcr h LEU 107 CO -0.07 1.12 -0.36 0.00 -0.34 0.00 0.00 178.44 178.79 3hcr h ALA 108 N 0.88 -0.62 -0.99 1.25 0.00 -0.94 -1.23 119.26 117.61 3hcr h ALA 108 Ca -0.02 -0.06 0.21 0.00 0.00 0.00 0.00 54.91 55.05 3hcr h ALA 108 Cb 1.22 0.60 -0.12 0.00 0.00 0.00 0.00 17.79 19.50 3hcr h ALA 108 CO 0.12 -0.91 0.58 -1.35 0.00 0.00 0.00 179.25 177.69 3hcr h PRO 109 N -0.58 0.64 0.36 0.00 0.11 -1.81 -0.35 132.00 130.37 3hcr h PRO 109 Ca 0.03 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 66.09 3hcr h PRO 109 Cb 0.62 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 31.59 3hcr h PRO 109 CO -0.22 0.42 -0.17 0.35 -0.21 0.00 0.00 178.00 178.17 3hcr h PHE 110 N 0.66 -0.45 -0.45 0.65 3.57 -1.50 -2.12 116.94 117.29 3hcr h PHE 110 Ca 0.60 -0.01 0.08 0.00 3.53 0.00 0.00 57.97 62.17 3hcr h PHE 110 Cb 1.04 0.15 -0.07 0.00 2.79 0.00 0.00 35.95 39.86 3hcr h PHE 110 CO -0.02 -0.13 0.05 0.82 -2.23 0.00 0.00 178.31 176.80 3hcr h ILE 111 N -0.77 0.71 -0.54 1.41 2.04 -0.60 0.80 117.51 120.57 3hcr h ILE 111 Ca -0.05 -0.06 0.07 0.00 1.00 0.00 0.00 64.86 65.82 3hcr h ILE 111 Cb 0.52 0.52 -0.06 0.00 -0.74 0.00 0.00 36.82 37.06 3hcr h ILE 111 CO 0.08 0.03 0.21 0.00 0.00 0.00 0.00 178.15 178.48 3hcr h ALA 112 N 1.37 0.68 -0.43 1.87 0.00 -1.08 -0.47 119.26 121.20 3hcr h ALA 112 Ca 0.22 0.06 -0.13 0.00 0.00 0.00 0.00 54.91 55.06 3hcr h ALA 112 Cb 0.30 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 3hcr h ALA 112 CO -0.32 -0.18 -0.25 -0.22 0.00 0.00 0.00 179.25 178.28 3hcr h LYS 113 N 0.41 0.90 0.00 0.00 3.11 -0.72 -2.27 116.57 117.99 3hcr h LYS 113 Ca 0.26 -0.39 -0.04 0.00 -2.81 0.00 0.00 60.65 57.66 3hcr h LYS 113 Cb 0.26 -0.03 -0.01 0.00 -1.00 0.00 0.00 32.23 31.46 3hcr h LYS 113 CO -0.24 1.04 -0.21 -0.09 -2.81 0.00 0.00 179.45 177.14 3hcr h ARG 114 N 0.77 0.00 0.00 1.90 2.43 -0.16 -3.25 114.38 116.07 3hcr h ARG 114 Ca 0.10 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.27 3hcr h ARG 114 Cb 0.81 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.36 3hcr h ARG 114 CO 0.07 0.21 -1.11 0.54 -1.51 0.00 0.00 179.97 178.17 3hcr n ARG 115 N -3.50 1.23 -0.21 0.20 1.74 -0.25 -4.64 116.66 111.23 3hcr n ARG 115 Ca -0.01 -0.05 0.02 0.00 -0.77 0.00 0.00 57.85 57.04 3hcr n ARG 115 Cb 0.37 -1.32 0.12 0.00 -1.02 0.00 0.00 32.46 30.61 3hcr n ARG 115 CO 0.00 0.00 0.00 1.15 -1.52 0.00 0.00 177.63 177.26 3hcr h THR 116 N 0.00 0.53 -0.14 0.55 2.02 -1.44 -2.05 112.91 112.39 3hcr h THR 116 Ca 0.00 -0.06 0.05 0.00 0.77 0.00 0.00 66.41 67.17 3hcr h THR 116 Cb 0.52 0.34 -0.06 0.00 -1.74 0.00 0.00 68.15 67.20 3hcr h THR 116 CO 0.00 0.03 -0.25 -0.65 0.37 0.00 0.00 175.52 175.02 3hcr h PRO 117 N 0.18 -0.31 -0.51 6.66 0.11 -1.82 0.25 132.00 136.57 3hcr h PRO 117 Ca 0.34 0.02 0.03 0.00 0.11 0.00 0.00 66.00 66.50 3hcr h PRO 117 Cb 0.55 0.07 -0.04 0.00 0.11 0.00 0.00 31.00 31.69 3hcr h PRO 117 CO -0.49 -0.20 0.29 -0.22 -0.21 0.00 0.00 178.00 177.16 3hcr h LYS 118 N -0.32 0.55 -0.23 1.05 3.64 -1.78 -0.42 116.57 119.06 3hcr h LYS 118 Ca 0.10 -0.03 -0.12 0.00 -1.27 0.00 0.00 60.65 59.33 3hcr h LYS 118 Cb 0.47 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.16 3hcr h LYS 118 CO -0.32 0.36 -0.36 0.82 -2.27 0.00 0.00 179.45 177.68 3hcr h ILE 119 N 0.56 1.29 -0.43 2.00 1.08 -0.94 -0.62 117.51 120.45 3hcr h ILE 119 Ca 0.21 -1.49 -0.03 0.00 -0.39 0.00 0.00 64.86 63.16 3hcr h ILE 119 Cb 0.07 1.51 -0.02 0.00 -3.07 0.00 0.00 36.82 35.31 3hcr h ILE 119 CO -0.12 0.47 0.13 1.56 -0.69 0.00 0.00 178.15 179.50 3hcr h GLN 120 N 0.43 0.67 -0.68 2.37 4.20 -0.12 -0.40 115.11 121.58 3hcr h GLN 120 Ca 0.05 -0.15 0.04 0.00 0.06 0.00 0.00 58.65 58.65 3hcr h GLN 120 Cb 0.83 -0.10 -0.05 0.00 0.30 0.00 0.00 27.48 28.47 3hcr h GLN 120 CO 0.07 0.66 0.41 1.49 -0.67 0.00 0.00 178.83 180.79 3hcr h GLU 121 N 0.56 0.77 -0.21 1.46 4.57 -0.78 0.19 114.58 121.12 3hcr h GLU 121 Ca 0.14 -0.05 -0.02 0.00 -1.18 0.00 0.00 59.36 58.26 3hcr h GLU 121 Cb 0.27 -0.17 -0.01 0.00 -0.16 0.00 0.00 28.75 28.67 3hcr h GLU 121 CO -0.00 0.51 0.07 1.96 -1.18 0.00 0.00 179.01 180.36 3hcr h GLN 122 N 0.79 0.33 0.00 1.92 1.08 -0.71 -2.18 115.11 116.34 3hcr h GLN 122 Ca 0.28 -0.07 -0.05 0.00 -1.45 0.00 0.00 58.65 57.36 3hcr h GLN 122 Cb 0.08 -0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 27.45 3hcr h GLN 122 CO -0.13 0.42 -0.24 1.88 -0.95 0.00 0.00 178.83 179.81 3hcr h TYR 123 N 0.18 0.00 -0.54 2.96 -1.99 -0.69 -2.37 116.97 114.52 3hcr h TYR 123 Ca 0.07 0.00 -0.12 0.00 2.00 0.00 0.00 58.73 60.68 3hcr h TYR 123 Cb 0.23 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 38.94 3hcr h TYR 123 CO 0.00 0.24 -0.13 -0.09 -0.00 0.00 0.00 178.16 178.18 3hcr h ARG 124 N 0.00 1.04 0.00 4.88 2.43 -0.64 0.22 114.38 122.31 3hcr h ARG 124 Ca -0.00 -0.40 0.00 0.00 -0.81 0.00 0.00 59.98 58.77 3hcr h ARG 124 Cb 0.47 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 29.96 3hcr h ARG 124 CO 0.03 1.09 0.00 0.00 -1.51 0.00 0.00 179.97 179.58 3hcr h ARG 125 N 0.91 0.00 -0.12 0.20 2.47 -0.85 -1.97 114.38 115.02 3hcr h ARG 125 Ca 0.14 0.00 -0.00 0.00 -1.26 0.00 0.00 59.98 58.85 3hcr h ARG 125 Cb 0.71 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 29.03 3hcr h ARG 125 CO 0.05 0.00 -0.01 0.44 0.56 0.00 0.00 179.97 181.02 3hcr n ILE 126 N -2.43 2.09 0.00 2.04 -5.35 -0.87 -4.94 119.36 109.90 3hcr n ILE 126 Ca -0.01 -2.12 0.00 0.00 -0.27 0.00 0.00 62.75 60.35 3hcr n ILE 126 Cb 0.06 -0.25 0.00 0.00 -1.74 0.00 0.00 39.64 37.71 3hcr n ILE 126 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3hcr n GLY 127 N -1.01 1.47 0.00 3.28 0.00 -0.75 -4.68 105.19 103.50 3hcr n GLY 127 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 3hcr n GLY 127 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hcr n GLY 128 N -0.04 0.63 0.00 -0.02 0.00 0.72 -4.95 105.19 101.54 3hcr n GLY 128 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3hcr n GLY 128 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hcr n GLY 129 N -1.65 -1.39 3.68 -0.02 0.00 -1.14 -2.80 105.19 101.87 3hcr n GLY 129 Ca 0.00 -1.03 -0.35 0.00 0.00 0.00 0.00 46.02 44.64 3hcr n GLY 129 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3hcr s SER 130 N -3.54 5.43 -0.09 1.61 0.15 0.33 -4.95 113.70 112.63 3hcr s SER 130 Ca 0.00 0.15 0.18 0.00 0.70 0.00 0.00 55.95 56.98 3hcr s SER 130 Cb 0.00 -1.68 0.70 0.00 -1.71 0.00 0.00 66.02 63.32 3hcr s SER 130 CO 0.00 0.32 1.60 -0.81 1.20 0.00 0.00 173.24 175.55 3hcr n PRO 131 N 2.54 3.51 -0.31 5.44 -0.04 -1.26 -4.40 135.00 140.48 3hcr n PRO 131 Ca -0.18 -2.76 0.11 0.00 -0.04 0.00 0.00 63.50 60.63 3hcr n PRO 131 Cb 0.53 -1.83 0.33 0.00 -0.04 0.00 0.00 33.50 32.49 3hcr n PRO 131 CO 0.00 0.00 0.00 0.97 -0.04 0.00 0.00 175.50 176.43 3hcr h ILE 132 N 4.04 0.83 -0.42 0.52 2.10 -1.91 -2.42 117.51 120.26 3hcr h ILE 132 Ca 0.00 -0.27 -0.03 0.00 1.08 0.00 0.00 64.86 65.64 3hcr h ILE 132 Cb 1.35 -0.02 -0.02 0.00 -1.09 0.00 0.00 36.82 37.04 3hcr h ILE 132 CO 0.19 0.14 0.16 0.50 -1.08 0.00 0.00 178.15 178.06 3hcr h LYS 133 N 0.79 0.63 -0.37 2.19 3.64 -1.90 -1.41 116.57 120.13 3hcr h LYS 133 Ca 0.49 -0.12 -0.04 0.00 -1.27 0.00 0.00 60.65 59.71 3hcr h LYS 133 Cb 0.70 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.40 3hcr h LYS 133 CO -0.25 0.60 0.08 0.82 -2.27 0.00 0.00 179.45 178.43 3hcr h ILE 134 N 0.53 1.23 -0.22 2.00 2.04 -1.81 -2.33 117.51 118.96 3hcr h ILE 134 Ca 0.14 -0.80 -0.11 0.00 1.00 0.00 0.00 64.86 65.08 3hcr h ILE 134 Cb 0.21 1.04 -0.01 0.00 -0.74 0.00 0.00 36.82 37.32 3hcr h ILE 134 CO -0.01 0.27 -0.35 -0.50 0.00 0.00 0.00 178.15 177.56 3hcr h TRP 135 N 0.46 0.54 -0.24 1.37 -0.00 -1.41 -1.93 115.95 114.74 3hcr h TRP 135 Ca 0.12 -0.14 -0.13 0.00 -0.00 0.00 0.00 58.89 58.74 3hcr h TRP 135 Cb 0.33 -0.12 -0.01 0.00 -0.00 0.00 0.00 29.16 29.35 3hcr h TRP 135 CO 0.02 0.76 -0.39 1.15 -0.00 0.00 0.00 178.44 179.98 3hcr h THR 136 N 0.40 1.30 -0.02 1.49 2.02 -1.18 -0.44 112.91 116.47 3hcr h THR 136 Ca 0.04 -1.54 -0.00 0.00 0.77 0.00 0.00 66.41 65.68 3hcr h THR 136 Cb 0.81 1.54 -0.00 0.00 -1.74 0.00 0.00 68.15 68.76 3hcr h THR 136 CO 0.07 0.49 -0.00 0.28 0.37 0.00 0.00 175.52 176.72 3hcr h SER 137 N 0.46 0.04 -0.05 4.18 0.02 -1.28 0.26 113.55 117.18 3hcr h SER 137 Ca 0.04 -0.35 0.03 0.00 -0.84 0.00 0.00 61.79 60.68 3hcr h SER 137 Cb 0.88 -0.01 -0.04 0.00 0.14 0.00 0.00 62.40 63.37 3hcr h SER 137 CO 0.08 0.38 -0.18 0.50 -1.14 0.00 0.00 176.83 176.47 3hcr h LYS 138 N -0.30 -0.25 -0.49 3.45 1.63 -1.25 0.22 116.57 119.57 3hcr h LYS 138 Ca 0.01 0.02 -0.05 0.00 -0.85 0.00 0.00 60.65 59.78 3hcr h LYS 138 Cb 0.36 0.06 -0.02 0.00 -0.60 0.00 0.00 32.23 32.03 3hcr h LYS 138 CO 0.00 -0.17 0.12 1.96 -3.45 0.00 0.00 179.45 177.91 3hcr h GLN 139 N -0.26 0.74 -0.06 1.90 1.08 -1.05 -1.74 115.11 115.72 3hcr h GLN 139 Ca 0.07 -0.14 -0.00 0.00 -1.45 0.00 0.00 58.65 57.13 3hcr h GLN 139 Cb 0.36 -0.12 -0.00 0.00 -0.05 0.00 0.00 27.48 27.67 3hcr h GLN 139 CO -0.21 0.68 0.03 0.78 -0.95 0.00 0.00 178.83 179.16 3hcr h GLY 140 N 0.92 0.09 1.01 3.46 0.00 0.60 0.12 103.07 109.27 3hcr h GLY 140 Ca 0.16 -0.04 -0.01 0.00 0.00 0.00 0.00 47.33 47.44 3hcr h GLY 140 CO -0.00 0.04 0.45 0.83 0.00 0.00 0.00 176.54 177.86 3hcr h GLU 141 N 0.01 1.02 -0.10 4.80 5.08 -0.43 0.47 114.58 125.42 3hcr h GLU 141 Ca 0.02 -0.10 -0.08 0.00 -1.00 0.00 0.00 59.36 58.20 3hcr h GLU 141 Cb 0.09 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.11 3hcr h GLU 141 CO -0.00 0.72 -0.31 0.78 -1.00 0.00 0.00 179.01 179.20 3hcr h GLY 142 N 1.02 0.21 0.44 -3.84 0.00 -1.08 -1.16 103.07 98.67 3hcr h GLY 142 Ca 0.27 -0.17 -0.01 0.00 0.00 0.00 0.00 47.33 47.41 3hcr h GLY 142 CO -0.05 0.16 -0.05 1.98 0.00 0.00 0.00 176.54 178.58 3hcr h MET 143 N 0.18 0.06 -0.31 4.80 1.85 -0.03 -2.90 114.93 118.57 3hcr h MET 143 Ca 0.02 -0.04 0.02 0.00 -0.61 0.00 0.00 59.70 59.09 3hcr h MET 143 Cb 0.64 0.01 -0.03 0.00 0.43 0.00 0.00 31.60 32.65 3hcr h MET 143 CO 0.05 0.66 0.15 0.28 -0.40 0.00 0.00 176.91 177.65 3hcr h VAL 144 N -0.53 0.98 -0.82 -5.77 2.07 -0.83 -0.91 116.25 110.44 3hcr h VAL 144 Ca -0.00 -0.11 0.04 0.00 0.82 0.00 0.00 66.70 67.45 3hcr h VAL 144 Cb 0.67 0.64 -0.05 0.00 -1.52 0.00 0.00 31.29 31.03 3hcr h VAL 144 CO 0.01 0.06 0.54 0.50 0.02 0.00 0.00 177.57 178.69 3hcr h LYS 145 N 0.32 0.95 0.00 1.57 3.64 -1.30 -1.86 116.57 119.89 3hcr h LYS 145 Ca 0.13 -0.06 -0.15 0.00 -1.27 0.00 0.00 60.65 59.31 3hcr h LYS 145 Cb 0.05 -0.21 -0.02 0.00 -0.41 0.00 0.00 32.23 31.64 3hcr h LYS 145 CO -0.10 0.63 -0.71 -0.07 -2.27 0.00 0.00 179.45 176.94 3hcr h LEU 146 N 0.98 0.00 0.01 5.20 3.38 -1.23 -3.32 115.31 120.33 3hcr h LEU 146 Ca 0.33 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.30 3hcr h LEU 146 Cb 0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.83 3hcr h LEU 146 CO -0.10 0.71 -0.00 -0.07 0.09 0.00 0.00 178.44 179.06 3hcr h LEU 147 N 0.00 -0.01 -1.21 1.67 3.38 -0.39 -2.39 115.31 116.36 3hcr h LEU 147 Ca -0.01 -0.44 0.06 0.00 0.09 0.00 0.00 57.88 57.58 3hcr h LEU 147 Cb 1.38 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.13 3hcr h LEU 147 CO 0.09 0.44 0.69 0.44 0.09 0.00 0.00 178.44 180.19 3hcr h ASP 148 N -0.45 0.00 0.04 -0.43 3.32 -1.50 0.37 116.42 117.76 3hcr h ASP 148 Ca -0.00 0.00 -0.38 0.00 0.02 0.00 0.00 57.03 56.67 3hcr h ASP 148 Cb 0.45 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 39.94 3hcr h ASP 148 CO 0.00 0.00 -2.35 -0.62 -1.72 0.00 0.00 179.24 174.55 3hcr n GLU 149 N -2.93 0.68 -0.12 3.56 -0.58 -1.16 -4.18 120.64 115.91 3hcr n GLU 149 Ca 0.03 0.17 -0.13 0.00 -0.42 0.00 0.00 57.16 56.81 3hcr n GLU 149 Cb 0.77 -1.57 -0.03 0.00 -0.57 0.00 0.00 31.44 30.05 3hcr n GLU 149 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 3hcr h LEU 150 N 0.02 0.99 -6.77 -4.62 3.38 -0.15 -3.38 115.31 104.78 3hcr h LEU 150 Ca -0.54 -0.47 -0.61 0.00 0.09 0.00 0.00 57.88 56.36 3hcr h LEU 150 Cb 1.95 -0.28 -0.41 0.00 0.09 0.00 0.00 40.66 42.01 3hcr h LEU 150 CO -0.04 1.25 -0.72 -0.24 0.09 0.00 0.00 178.44 178.79 3hcr n SER 151 N -4.07 1.90 -0.06 -0.43 2.88 0.98 -4.95 113.62 109.86 3hcr n SER 151 Ca -0.02 -2.95 0.02 0.00 -1.33 0.00 0.00 58.87 54.58 3hcr n SER 151 Cb 0.55 -0.69 0.35 0.00 -0.75 0.00 0.00 64.21 63.67 3hcr n SER 151 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 3hcr h PRO 152 N 5.34 0.67 -0.36 -1.46 0.11 -1.76 -2.19 132.00 132.36 3hcr h PRO 152 Ca 0.19 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 66.23 3hcr h PRO 152 Cb 0.80 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 31.75 3hcr h PRO 152 CO 0.61 0.48 0.20 -0.91 -0.21 0.00 0.00 178.00 178.17 3hcr h ASN 153 N 0.68 0.42 0.12 -2.05 2.35 -1.93 -2.23 115.58 112.95 3hcr h ASN 153 Ca 0.18 -0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.91 3hcr h ASN 153 Cb -0.00 -0.11 0.00 0.00 0.05 0.00 0.00 38.32 38.26 3hcr h ASN 153 CO -0.03 0.34 -0.73 0.35 -1.65 0.00 0.00 177.43 175.71 3hcr n THR 154 N -4.45 0.00 -1.97 2.81 -2.24 -1.03 -4.95 114.28 102.44 3hcr n THR 154 Ca 0.02 -0.06 -0.35 0.00 -2.27 0.00 0.00 64.05 61.39 3hcr n THR 154 Cb 0.09 0.84 0.04 0.00 -2.10 0.00 0.00 70.33 69.20 3hcr n THR 154 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3hcr s ALA 155 N -2.85 2.52 0.38 6.98 0.00 -0.84 -3.32 121.76 124.62 3hcr s ALA 155 Ca 0.12 0.92 -0.22 0.00 0.00 0.00 0.00 51.96 52.78 3hcr s ALA 155 Cb 0.17 -3.42 -0.10 0.00 0.00 0.00 0.00 23.12 19.76 3hcr s ALA 155 CO 0.75 -1.18 0.93 -1.25 0.00 0.00 0.00 175.76 175.01 3hcr s PRO 156 N -3.45 4.34 0.17 0.00 0.04 -1.26 -4.80 135.00 130.03 3hcr s PRO 156 Ca 0.75 1.15 0.05 0.00 0.04 0.00 0.00 61.00 62.99 3hcr s PRO 156 Cb -0.28 -2.43 -0.04 0.00 0.04 0.00 0.00 34.50 31.79 3hcr s PRO 156 CO 0.34 0.10 0.18 -1.01 0.04 0.00 0.00 177.00 176.65 3hcr s HIS 157 N -1.95 3.22 -0.05 0.56 3.76 -1.26 -1.89 115.29 117.68 3hcr s HIS 157 Ca 0.57 0.00 -0.02 0.00 -0.15 0.00 0.00 55.06 55.47 3hcr s HIS 157 Cb -0.13 -1.54 0.04 0.00 1.11 0.00 0.00 32.58 32.06 3hcr s HIS 157 CO 0.17 0.52 0.10 0.21 -0.85 0.00 0.00 174.74 174.89 3hcr s LYS 158 N -3.20 0.04 0.09 1.40 2.20 -0.64 -4.97 119.74 114.66 3hcr s LYS 158 Ca 0.32 0.30 -0.07 0.00 -0.36 0.00 0.00 55.97 56.15 3hcr s LYS 158 Cb -0.10 -0.21 -0.05 0.00 -1.51 0.00 0.00 37.83 35.95 3hcr s LYS 158 CO 0.25 -0.17 0.36 1.52 -0.36 0.00 0.00 175.35 176.95 3hcr s TYR 159 N 1.15 3.54 0.09 4.03 -0.85 -1.26 -0.34 117.35 123.71 3hcr s TYR 159 Ca -0.09 0.65 0.06 0.00 -0.52 0.00 0.00 57.07 57.17 3hcr s TYR 159 Cb -0.12 -2.06 -0.03 0.00 0.38 0.00 0.00 41.96 40.13 3hcr s TYR 159 CO -0.05 0.51 -0.17 0.71 -1.52 0.00 0.00 175.55 175.04 3hcr s TYR 160 N -1.47 1.44 -0.25 -3.49 1.51 0.69 -4.90 117.35 110.89 3hcr s TYR 160 Ca 0.35 -0.45 -0.09 0.00 -1.01 0.00 0.00 57.07 55.87 3hcr s TYR 160 Cb -0.13 -0.80 -0.04 0.00 -0.11 0.00 0.00 41.96 40.88 3hcr s TYR 160 CO 0.20 0.12 0.11 0.42 -1.11 0.00 0.00 175.55 175.29 3hcr s ILE 161 N -1.32 4.74 -0.63 2.71 -1.09 -1.26 -1.06 121.20 123.28 3hcr s ILE 161 Ca 0.02 -0.03 0.03 0.00 -2.23 0.00 0.00 60.65 58.44 3hcr s ILE 161 Cb -0.09 -3.22 0.16 0.00 -1.58 0.00 0.00 42.46 37.72 3hcr s ILE 161 CO 0.03 0.33 0.41 -0.83 -1.23 0.00 0.00 174.94 173.65 3hcr s GLY 162 N 1.46 2.69 0.31 6.18 0.00 0.11 -4.66 107.32 113.41 3hcr s GLY 162 Ca 0.06 -3.53 -0.17 0.00 0.00 0.00 0.00 44.72 41.09 3hcr s GLY 162 CO 0.06 1.06 0.76 -1.36 0.00 0.00 0.00 173.10 173.61 3hcr s PHE 163 N -0.77 3.44 -0.01 1.90 2.99 -0.41 -2.64 117.98 122.48 3hcr s PHE 163 Ca 0.21 1.31 -0.15 0.00 0.00 0.00 0.00 56.93 58.29 3hcr s PHE 163 Cb -0.16 -2.59 -0.33 0.00 0.00 0.00 0.00 43.02 39.94 3hcr s PHE 163 CO -0.07 0.13 0.85 -0.09 -0.00 0.00 0.00 175.22 176.04 3hcr h ARG 164 N 2.51 0.45 -0.13 0.44 9.65 -0.85 -0.01 114.38 126.43 3hcr h ARG 164 Ca -0.48 -0.76 0.00 0.00 -1.10 0.00 0.00 59.98 57.64 3hcr h ARG 164 Cb 1.18 0.28 0.00 0.00 -1.39 0.00 0.00 29.97 30.04 3hcr h ARG 164 CO 0.65 1.36 0.00 0.66 2.80 0.00 0.00 179.97 185.44 3hcr n TYR 165 N -3.76 0.17 -3.67 2.20 0.53 -0.83 -4.76 117.16 107.03 3hcr n TYR 165 Ca -0.20 -0.24 -0.11 0.00 -1.02 0.00 0.00 57.90 56.33 3hcr n TYR 165 Cb 1.04 -0.02 -0.06 0.00 -1.03 0.00 0.00 39.34 39.28 3hcr n TYR 165 CO 0.00 0.00 0.00 0.14 -1.02 0.00 0.00 176.86 175.98 3hcr s VAL 166 N -0.84 0.07 0.33 -0.72 -7.23 -1.26 -4.23 120.40 106.53 3hcr s VAL 166 Ca 0.13 -0.60 -0.29 0.00 -1.81 0.00 0.00 61.98 59.42 3hcr s VAL 166 Cb 0.08 -1.09 -0.10 0.00 0.56 0.00 0.00 36.38 35.82 3hcr s VAL 166 CO 0.11 -0.33 1.38 -1.00 -0.31 0.00 0.00 175.10 174.95 3hcr s HIS 167 N -3.29 2.91 -0.34 2.82 3.76 -1.26 -3.07 115.29 116.82 3hcr s HIS 167 Ca -0.00 1.29 -0.29 0.00 -0.15 0.00 0.00 55.06 55.91 3hcr s HIS 167 Cb 0.01 -3.80 0.00 0.00 1.11 0.00 0.00 32.58 29.91 3hcr s HIS 167 CO -0.08 -2.30 1.33 -2.14 -0.85 0.00 0.00 174.74 170.70 3hcr s PRO 168 N -1.70 3.79 0.83 8.40 0.02 -1.26 -4.98 135.00 140.10 3hcr s PRO 168 Ca 0.51 1.12 -0.12 0.00 0.02 0.00 0.00 61.00 62.53 3hcr s PRO 168 Cb -0.42 -3.93 0.09 0.00 0.02 0.00 0.00 34.50 30.26 3hcr s PRO 168 CO 0.55 -1.28 1.17 -0.51 -0.33 0.00 0.00 177.00 176.59 3hcr s LEU 169 N 4.74 3.06 0.14 -5.54 1.43 -1.17 -1.29 118.68 120.04 3hcr s LEU 169 Ca 0.58 2.24 -0.19 0.00 -1.03 0.00 0.00 54.13 55.73 3hcr s LEU 169 Cb -0.15 -4.57 0.01 0.00 0.03 0.00 0.00 46.19 41.50 3hcr s LEU 169 CO 0.27 -2.68 1.71 0.74 0.23 0.00 0.00 176.35 176.61 3hcr h THR 170 N -1.17 0.79 -0.38 5.49 2.02 -1.24 -1.62 112.91 116.80 3hcr h THR 170 Ca -0.45 -0.02 0.03 0.00 0.77 0.00 0.00 66.41 66.74 3hcr h THR 170 Cb 1.28 0.73 -0.03 0.00 -1.74 0.00 0.00 68.15 68.39 3hcr h THR 170 CO 0.46 0.01 0.18 -0.33 0.37 0.00 0.00 175.52 176.21 3hcr h GLU 171 N 0.05 0.36 -0.77 6.66 3.07 -1.90 -1.35 114.58 120.70 3hcr h GLU 171 Ca 0.12 -0.02 0.07 0.00 -0.50 0.00 0.00 59.36 59.03 3hcr h GLU 171 Cb 0.17 -0.08 -0.05 0.00 -0.84 0.00 0.00 28.75 27.95 3hcr h GLU 171 CO -0.23 0.24 0.50 0.93 -1.40 0.00 0.00 179.01 179.05 3hcr h GLU 172 N 0.37 0.77 -0.19 2.33 5.08 -1.77 0.61 114.58 121.78 3hcr h GLU 172 Ca 0.16 -0.05 -0.14 0.00 -1.00 0.00 0.00 59.36 58.34 3hcr h GLU 172 Cb 0.08 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.16 3hcr h GLU 172 CO -0.12 0.51 -0.42 0.00 -1.00 0.00 0.00 179.01 177.97 3hcr h ALA 173 N 1.59 0.31 0.24 3.43 0.00 -0.63 -2.59 119.26 121.62 3hcr h ALA 173 Ca 0.34 -0.46 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 3hcr h ALA 173 Cb 0.29 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.04 3hcr h ALA 173 CO -0.12 0.43 -0.12 0.82 0.00 0.00 0.00 179.25 180.26 3hcr h ILE 174 N 0.30 0.80 -1.01 0.00 2.04 -0.63 0.38 117.51 119.39 3hcr h ILE 174 Ca 0.00 -0.27 0.25 0.00 1.00 0.00 0.00 64.86 65.84 3hcr h ILE 174 Cb 1.03 0.96 -0.09 0.00 -0.74 0.00 0.00 36.82 37.98 3hcr h ILE 174 CO 0.09 0.06 0.65 -0.08 0.00 0.00 0.00 178.15 178.88 3hcr h GLU 175 N -0.46 0.40 0.00 2.37 4.81 -0.95 0.26 114.58 121.00 3hcr h GLU 175 Ca -0.03 -0.02 -0.22 0.00 -0.13 0.00 0.00 59.36 58.96 3hcr h GLU 175 Cb 0.35 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.61 3hcr h GLU 175 CO 0.06 0.26 -1.06 1.49 -0.73 0.00 0.00 179.01 179.03 3hcr h GLU 176 N 0.41 0.00 -0.38 1.92 4.81 -1.08 -3.20 114.58 117.06 3hcr h GLU 176 Ca 0.56 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.74 3hcr h GLU 176 Cb 1.41 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.77 3hcr h GLU 176 CO -0.26 0.93 0.00 0.52 -0.73 0.00 0.00 179.01 179.47 3hcr h MET 177 N 0.00 0.59 0.72 1.92 2.86 0.17 -2.59 114.93 118.60 3hcr h MET 177 Ca -0.04 -0.13 -0.04 0.00 -2.06 0.00 0.00 59.70 57.43 3hcr h MET 177 Cb 1.78 -0.08 0.01 0.00 0.06 0.00 0.00 31.60 33.37 3hcr h MET 177 CO 0.12 0.61 -0.35 0.93 1.06 0.00 0.00 176.91 179.29 3hcr h GLU 178 N 0.56 -0.94 -1.03 1.72 4.39 -1.29 -3.14 114.58 114.85 3hcr h GLU 178 Ca 0.12 0.06 0.29 0.00 0.34 0.00 0.00 59.36 60.17 3hcr h GLU 178 Cb 0.36 0.21 -0.13 0.00 -0.10 0.00 0.00 28.75 29.09 3hcr h GLU 178 CO 0.01 -0.60 0.62 0.00 -1.16 0.00 0.00 179.01 177.89 3hcr h ARG 179 N -1.13 0.42 0.00 2.33 3.08 -1.53 0.59 114.38 118.15 3hcr h ARG 179 Ca -0.10 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.93 3hcr h ARG 179 Cb 0.77 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.72 3hcr h ARG 179 CO 0.16 0.28 0.00 -0.25 -1.07 0.00 0.00 179.97 179.09 3hcr n ASP 180 N -4.87 0.00 -3.17 7.04 9.92 -0.99 -4.89 116.55 119.60 3hcr n ASP 180 Ca 0.29 0.40 -0.16 0.00 -0.53 0.00 0.00 54.79 54.79 3hcr n ASP 180 Cb 0.90 -0.45 0.08 0.00 -0.64 0.00 0.00 41.12 41.01 3hcr n ASP 180 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3hcr n GLY 181 N -0.28 -0.29 3.79 0.44 0.00 0.21 -4.59 105.19 104.47 3hcr n GLY 181 Ca 0.04 0.05 -0.34 0.00 0.00 0.00 0.00 46.02 45.77 3hcr n GLY 181 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hcr s LEU 182 N -5.98 3.62 -0.10 0.99 1.02 -1.24 -4.91 118.68 112.07 3hcr s LEU 182 Ca 0.08 1.98 0.14 0.00 0.02 0.00 0.00 54.13 56.35 3hcr s LEU 182 Cb -0.04 -4.56 0.38 0.00 0.02 0.00 0.00 46.19 42.00 3hcr s LEU 182 CO 0.65 -1.19 1.30 -1.84 0.02 0.00 0.00 176.35 175.28 3hcr n GLU 183 N -1.67 2.70 -3.52 1.70 0.28 -1.00 -4.53 120.64 114.59 3hcr n GLU 183 Ca 0.10 -2.45 0.01 0.00 -0.16 0.00 0.00 57.16 54.66 3hcr n GLU 183 Cb 0.52 -1.55 -0.06 0.00 1.43 0.00 0.00 31.44 31.78 3hcr n GLU 183 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 177.13 177.47 3hcr s ARG 184 N -2.13 0.15 -0.05 3.44 3.52 -1.23 -4.23 118.95 118.43 3hcr s ARG 184 Ca 0.31 0.30 0.04 0.00 -0.13 0.00 0.00 55.73 56.25 3hcr s ARG 184 Cb 0.24 0.09 0.00 0.00 -1.56 0.00 0.00 34.95 33.71 3hcr s ARG 184 CO 0.09 -0.04 -0.15 0.00 -0.81 0.00 0.00 175.30 174.39 3hcr s ALA 185 N 1.49 1.40 -0.24 6.12 0.00 -0.10 -1.05 121.76 129.38 3hcr s ALA 185 Ca -0.06 -0.59 0.00 0.00 0.00 0.00 0.00 51.96 51.31 3hcr s ALA 185 Cb -0.03 -0.50 0.04 0.00 0.00 0.00 0.00 23.12 22.63 3hcr s ALA 185 CO -0.13 0.22 -0.10 0.42 0.00 0.00 0.00 175.76 176.17 3hcr s ILE 186 N 0.21 2.51 -0.54 0.00 1.01 -0.35 -2.14 121.20 121.88 3hcr s ILE 186 Ca -0.07 -1.22 -0.27 0.00 0.00 0.00 0.00 60.65 59.09 3hcr s ILE 186 Cb -0.12 -2.30 0.03 0.00 0.01 0.00 0.00 42.46 40.07 3hcr s ILE 186 CO 0.03 0.17 1.11 0.00 0.00 0.00 0.00 174.94 176.25 3hcr s ALA 187 N 1.24 3.08 -0.38 9.38 0.00 0.14 -1.00 121.76 134.23 3hcr s ALA 187 Ca -0.02 -0.82 -0.05 0.00 0.00 0.00 0.00 51.96 51.07 3hcr s ALA 187 Cb -0.17 -3.92 0.08 0.00 0.00 0.00 0.00 23.12 19.11 3hcr s ALA 187 CO -0.06 -2.47 0.16 0.12 0.00 0.00 0.00 175.76 173.51 3hcr s PHE 188 N 4.56 3.38 0.33 0.00 5.99 0.41 -1.31 117.98 131.34 3hcr s PHE 188 Ca 0.41 -1.85 -0.28 0.00 0.00 0.00 0.00 56.93 55.22 3hcr s PHE 188 Cb -0.08 -2.74 -0.09 0.00 0.00 0.00 0.00 43.02 40.10 3hcr s PHE 188 CO 0.26 -0.86 1.12 -0.08 -0.00 0.00 0.00 175.22 175.66 3hcr s THR 189 N 1.30 3.40 -2.24 0.12 -1.32 -1.03 -1.26 115.64 114.61 3hcr s THR 189 Ca 0.02 1.29 0.20 0.00 -1.21 0.00 0.00 61.69 61.99 3hcr s THR 189 Cb -0.22 -3.78 0.45 0.00 -1.51 0.00 0.00 72.50 67.44 3hcr s THR 189 CO -0.00 0.22 1.44 0.00 -2.21 0.00 0.00 174.62 174.07 3hcr n GLN 190 N 0.70 2.15 -3.58 7.08 1.13 -0.16 -4.75 117.38 119.96 3hcr n GLN 190 Ca 0.01 -1.75 -0.39 0.00 -1.94 0.00 0.00 57.00 52.92 3hcr n GLN 190 Cb 0.46 -1.44 -0.11 0.00 0.11 0.00 0.00 30.24 29.26 3hcr n GLN 190 CO 0.00 0.00 0.00 0.71 -1.44 0.00 0.00 177.06 176.33 3hcr s TYR 191 N -1.52 3.21 0.32 1.08 1.51 -1.26 -4.72 117.35 115.97 3hcr s TYR 191 Ca 0.35 -0.21 0.02 0.00 -1.01 0.00 0.00 57.07 56.22 3hcr s TYR 191 Cb 0.19 -2.42 0.53 0.00 -0.11 0.00 0.00 41.96 40.15 3hcr s TYR 191 CO 0.27 -0.33 1.88 -1.35 -1.11 0.00 0.00 175.55 174.90 3hcr h PRO 192 N 8.43 0.69 -5.38 -1.71 0.11 -1.85 -3.42 132.00 128.87 3hcr h PRO 192 Ca -0.33 -0.12 -0.62 0.00 0.11 0.00 0.00 66.00 65.04 3hcr h PRO 192 Cb 1.16 -0.11 -0.14 0.00 0.11 0.00 0.00 31.00 32.02 3hcr h PRO 192 CO 0.61 0.62 -0.55 -0.65 -0.21 0.00 0.00 178.00 177.82 3hcr s GLN 193 N -5.18 3.86 0.08 1.05 1.11 -1.26 -1.23 119.66 118.09 3hcr s GLN 193 Ca -0.09 -0.31 -0.30 0.00 0.01 0.00 0.00 55.36 54.67 3hcr s GLN 193 Cb 0.16 -3.20 -0.05 0.00 -1.01 0.00 0.00 33.01 28.91 3hcr s GLN 193 CO 0.78 0.37 0.99 -0.47 0.01 0.00 0.00 175.29 176.97 3hcr s TYR 194 N 0.11 3.72 0.01 0.91 5.04 -1.26 -4.85 117.35 121.03 3hcr s TYR 194 Ca 0.06 1.72 0.00 0.00 -2.44 0.00 0.00 57.07 56.41 3hcr s TYR 194 Cb -0.12 -3.11 -0.01 0.00 0.35 0.00 0.00 41.96 39.07 3hcr s TYR 194 CO 0.00 -0.01 -0.02 0.45 -1.34 0.00 0.00 175.55 174.63 3hcr s SER 195 N 0.39 0.22 0.45 4.32 0.15 -1.26 -1.67 113.70 116.31 3hcr s SER 195 Ca 0.49 -0.24 0.21 0.00 0.70 0.00 0.00 55.95 57.12 3hcr s SER 195 Cb -0.23 0.03 1.10 0.00 -1.71 0.00 0.00 66.02 65.21 3hcr s SER 195 CO 0.30 -0.12 1.95 0.00 1.20 0.00 0.00 173.24 176.56 3hcr n SER 197 N -3.79 0.35 0.00 0.00 3.41 -1.26 -1.63 113.62 110.71 3hcr n SER 197 Ca -0.02 0.44 0.00 0.00 -0.26 0.00 0.00 58.87 59.04 3hcr n SER 197 Cb 0.33 -0.50 0.00 0.00 -0.26 0.00 0.00 64.21 63.77 3hcr n SER 197 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3hcr n THR 198 N -1.79 0.00 -0.36 6.66 -2.24 -0.90 -4.53 114.28 111.11 3hcr n THR 198 Ca 0.06 0.00 -0.00 0.00 -2.27 0.00 0.00 64.05 61.84 3hcr n THR 198 Cb 0.38 -0.32 0.13 0.00 -2.10 0.00 0.00 70.33 68.42 3hcr n THR 198 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 3hcr h THR 199 N 0.00 1.18 -0.57 4.28 2.02 -1.72 -2.36 112.91 115.74 3hcr h THR 199 Ca 0.00 -0.43 0.06 0.00 0.77 0.00 0.00 66.41 66.81 3hcr h THR 199 Cb 0.00 -0.18 -0.05 0.00 -1.74 0.00 0.00 68.15 66.18 3hcr h THR 199 CO 0.00 0.23 0.28 1.23 0.37 0.00 0.00 175.52 177.63 3hcr h GLY 200 N 1.25 0.81 0.95 2.16 0.00 -1.28 -0.22 103.07 106.74 3hcr h GLY 200 Ca 0.39 -0.19 -0.06 0.00 0.00 0.00 0.00 47.33 47.46 3hcr h GLY 200 CO -0.12 0.11 0.00 0.23 0.00 0.00 0.00 176.54 176.76 3hcr h SER 201 N 0.54 0.70 -0.62 0.19 0.87 -0.93 0.49 113.55 114.80 3hcr h SER 201 Ca 0.26 -0.30 -0.06 0.00 -1.23 0.00 0.00 61.79 60.45 3hcr h SER 201 Cb 0.18 -0.19 -0.03 0.00 -0.44 0.00 0.00 62.40 61.93 3hcr h SER 201 CO -0.19 0.83 0.17 0.28 -0.53 0.00 0.00 176.83 177.40 3hcr h SER 202 N 0.55 0.95 -0.16 6.23 0.02 -1.05 -0.05 113.55 120.04 3hcr h SER 202 Ca 0.12 -0.18 -0.19 0.00 -0.84 0.00 0.00 61.79 60.69 3hcr h SER 202 Cb 0.47 -0.25 0.00 0.00 0.14 0.00 0.00 62.40 62.76 3hcr h SER 202 CO 0.02 0.91 -0.61 -0.07 -1.14 0.00 0.00 176.83 175.94 3hcr h LEU 203 N 0.97 0.87 -1.81 5.07 3.38 -0.93 -2.80 115.31 120.05 3hcr h LEU 203 Ca 0.21 -0.49 -0.00 0.00 0.09 0.00 0.00 57.88 57.68 3hcr h LEU 203 Cb 0.32 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 3hcr h LEU 203 CO -0.00 1.27 0.06 0.78 0.09 0.00 0.00 178.44 180.64 3hcr h ASN 204 N 0.57 0.16 0.25 -0.43 4.21 -0.51 -1.55 115.58 118.28 3hcr h ASN 204 Ca -0.00 -0.01 -0.09 0.00 1.21 0.00 0.00 56.30 57.41 3hcr h ASN 204 Cb 1.21 -0.04 -0.01 0.00 -1.12 0.00 0.00 38.32 38.35 3hcr h ASN 204 CO 0.13 0.14 -0.36 0.00 -1.29 0.00 0.00 177.43 176.05 3hcr h ALA 205 N 1.88 1.24 -0.47 -0.83 0.00 -0.75 0.11 119.26 120.44 3hcr h ALA 205 Ca 0.05 -0.37 -0.13 0.00 0.00 0.00 0.00 54.91 54.46 3hcr h ALA 205 Cb 0.03 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 3hcr h ALA 205 CO -0.01 0.53 -0.22 0.82 0.00 0.00 0.00 179.25 180.37 3hcr h ILE 206 N 0.15 1.27 -0.28 0.00 2.04 -1.16 -1.48 117.51 118.05 3hcr h ILE 206 Ca 0.02 -1.38 -0.16 0.00 1.00 0.00 0.00 64.86 64.33 3hcr h ILE 206 Cb 0.72 1.15 -0.00 0.00 -0.74 0.00 0.00 36.82 37.95 3hcr h ILE 206 CO 0.05 0.48 -0.46 0.22 0.00 0.00 0.00 178.15 178.44 3hcr h TYR 207 N 0.83 1.01 0.00 1.37 3.20 -1.29 -2.95 116.97 119.14 3hcr h TYR 207 Ca 0.11 -0.34 -0.01 0.00 3.14 0.00 0.00 58.73 61.62 3hcr h TYR 207 Cb 0.80 -0.19 -0.00 0.00 1.54 0.00 0.00 36.73 38.87 3hcr h TYR 207 CO 0.05 1.15 -0.05 0.00 -1.64 0.00 0.00 178.16 177.68 3hcr h ARG 208 N 0.58 0.00 0.36 1.82 3.08 -0.65 -2.08 114.38 117.49 3hcr h ARG 208 Ca 0.02 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.06 3hcr h ARG 208 Cb 1.06 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.11 3hcr h ARG 208 CO 0.10 0.05 -0.18 -0.92 -1.07 0.00 0.00 179.97 177.96 3hcr h TYR 209 N 0.00 -0.45 -0.05 3.04 3.20 -1.09 -3.12 116.97 118.49 3hcr h TYR 209 Ca -0.00 -0.01 0.01 0.00 3.14 0.00 0.00 58.73 61.87 3hcr h TYR 209 Cb 0.20 0.15 -0.00 0.00 1.54 0.00 0.00 36.73 38.62 3hcr h TYR 209 CO 0.00 -0.27 0.05 1.88 -1.64 0.00 0.00 178.16 178.18 3hcr h TYR 210 N -1.13 0.00 -0.14 -3.82 -1.99 -1.50 0.20 116.97 108.60 3hcr h TYR 210 Ca -0.05 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.68 3hcr h TYR 210 Cb 0.39 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.12 3hcr h TYR 210 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 178.16 176.45 3hcr n ASN 211 N -4.08 0.89 -0.01 3.88 2.85 -0.79 -2.92 115.26 115.08 3hcr n ASN 211 Ca -0.02 -2.02 -0.03 0.00 -0.11 0.00 0.00 54.58 52.41 3hcr n ASN 211 Cb 0.14 -0.14 -0.01 0.00 1.24 0.00 0.00 39.78 41.01 3hcr n ASN 211 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 3hcr n GLN 212 N -0.06 0.06 0.00 1.20 1.13 0.62 -4.54 117.38 115.79 3hcr n GLN 212 Ca 0.05 0.03 0.01 0.00 -1.94 0.00 0.00 57.00 55.14 3hcr n GLN 212 Cb 0.16 -0.60 0.05 0.00 0.11 0.00 0.00 30.24 29.95 3hcr n GLN 212 CO 0.00 0.00 0.00 1.33 -1.44 0.00 0.00 177.06 176.95 3hcr n VAL 213 N -3.21 0.00 -0.44 5.09 0.24 -0.70 -4.80 118.33 114.52 3hcr n VAL 213 Ca -0.05 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.25 3hcr n VAL 213 Cb 0.46 -0.32 0.00 0.00 -1.47 0.00 0.00 33.84 32.51 3hcr n VAL 213 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3hcr n GLY 214 N -0.03 0.00 3.82 7.63 0.00 -1.15 -4.89 105.19 110.57 3hcr n GLY 214 Ca 0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.73 3hcr n GLY 214 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 3hcr n ARG 215 N -0.01 0.70 -4.21 1.61 1.85 -1.21 -5.03 116.66 110.36 3hcr n ARG 215 Ca 0.00 -3.68 -0.23 0.00 -1.00 0.00 0.00 57.85 52.94 3hcr n ARG 215 Cb 0.15 0.72 -0.06 0.00 -1.05 0.00 0.00 32.46 32.22 3hcr n ARG 215 CO 0.00 0.00 0.00 0.15 -0.01 0.00 0.00 177.63 177.77 3hcr s LYS 216 N -4.09 2.56 0.43 2.89 1.02 -1.26 -4.64 119.74 116.66 3hcr s LYS 216 Ca 0.15 -1.24 -0.25 0.00 0.02 0.00 0.00 55.97 54.64 3hcr s LYS 216 Cb -0.01 -2.34 -0.09 0.00 -0.52 0.00 0.00 37.83 34.86 3hcr s LYS 216 CO 0.09 0.39 1.36 -2.30 -0.92 0.00 0.00 175.35 173.98 3hcr n PRO 217 N -0.94 2.13 -0.26 -1.68 -0.02 -1.26 -4.91 135.00 128.06 3hcr n PRO 217 Ca -0.07 0.76 0.11 0.00 -2.02 0.00 0.00 63.50 62.27 3hcr n PRO 217 Cb 0.58 -2.52 0.25 0.00 -0.02 0.00 0.00 33.50 31.78 3hcr n PRO 217 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 3hcr n THR 218 N -0.18 0.77 -4.12 3.45 -2.24 -1.26 -4.94 114.28 105.76 3hcr n THR 218 Ca 0.06 -0.89 -0.09 0.00 -2.27 0.00 0.00 64.05 60.86 3hcr n THR 218 Cb 0.40 0.72 -0.10 0.00 -2.10 0.00 0.00 70.33 69.25 3hcr n THR 218 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3hcr s MET 219 N -1.18 0.79 -0.24 -0.78 0.23 -1.26 -4.89 119.30 111.98 3hcr s MET 219 Ca 0.40 -1.35 -0.23 0.00 -1.03 0.00 0.00 55.69 53.49 3hcr s MET 219 Cb 0.22 0.23 -0.01 0.00 -1.53 0.00 0.00 34.83 33.73 3hcr s MET 219 CO 0.29 -0.19 0.73 0.15 -2.03 0.00 0.00 175.02 173.97 3hcr s LYS 220 N -3.99 4.16 0.21 3.16 1.02 -1.26 -4.89 119.74 118.15 3hcr s LYS 220 Ca 0.17 0.76 -0.04 0.00 0.02 0.00 0.00 55.97 56.87 3hcr s LYS 220 Cb 0.08 -3.64 -0.05 0.00 -0.52 0.00 0.00 37.83 33.70 3hcr s LYS 220 CO -0.03 -0.44 0.45 -1.58 -0.92 0.00 0.00 175.35 172.83 3hcr s TRP 221 N 2.58 3.47 0.18 3.18 0.52 -1.26 -0.92 118.94 126.68 3hcr s TRP 221 Ca 0.31 0.56 -0.20 0.00 0.02 0.00 0.00 56.10 56.79 3hcr s TRP 221 Cb -0.15 -2.02 0.05 0.00 -1.15 0.00 0.00 33.47 30.19 3hcr s TRP 221 CO 0.08 0.33 0.56 -1.54 0.02 0.00 0.00 176.95 176.40 3hcr s SER 222 N -2.82 -0.40 -0.02 2.95 1.04 -0.91 -4.83 113.70 108.70 3hcr s SER 222 Ca 0.42 -0.24 -0.04 0.00 0.48 0.00 0.00 55.95 56.56 3hcr s SER 222 Cb -0.11 0.59 0.00 0.00 0.10 0.00 0.00 66.02 66.60 3hcr s SER 222 CO 0.27 -1.01 0.10 0.28 0.98 0.00 0.00 173.24 173.86 3hcr s THR 223 N -3.81 0.04 -0.61 2.02 -1.32 0.69 -0.68 115.64 111.96 3hcr s THR 223 Ca 0.05 -0.31 -0.08 0.00 -1.21 0.00 0.00 61.69 60.13 3hcr s THR 223 Cb -0.01 -0.25 0.16 0.00 -1.51 0.00 0.00 72.50 70.89 3hcr s THR 223 CO -0.08 -0.17 0.48 -0.63 -2.21 0.00 0.00 174.62 172.01 3hcr s ILE 224 N -0.54 4.40 -1.83 5.08 1.01 -0.43 -3.90 121.20 124.99 3hcr s ILE 224 Ca -0.06 -2.34 0.26 0.00 0.00 0.00 0.00 60.65 58.51 3hcr s ILE 224 Cb -0.04 -3.83 0.29 0.00 0.01 0.00 0.00 42.46 38.89 3hcr s ILE 224 CO 0.00 -0.87 1.57 -0.90 0.00 0.00 0.00 174.94 174.74 3hcr n ASP 225 N 4.21 1.09 -3.59 3.58 5.75 -1.26 -2.46 116.55 123.86 3hcr n ASP 225 Ca 0.03 -0.95 -0.06 0.00 -0.01 0.00 0.00 54.79 53.79 3hcr n ASP 225 Cb 0.41 0.13 -0.03 0.00 -1.03 0.00 0.00 41.12 40.60 3hcr n ASP 225 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3hcr s ARG 226 N -2.46 0.39 -0.41 0.11 1.70 -1.26 -4.62 118.95 112.40 3hcr s ARG 226 Ca 0.25 -0.06 0.06 0.00 -0.47 0.00 0.00 55.73 55.52 3hcr s ARG 226 Cb 0.19 0.18 0.32 0.00 -0.57 0.00 0.00 34.95 35.07 3hcr s ARG 226 CO 0.50 -0.15 1.22 -2.67 -1.08 0.00 0.00 175.30 173.12 3hcr n TRP 227 N 0.19 -2.10 0.27 5.89 4.27 -0.36 -5.03 117.44 120.55 3hcr n TRP 227 Ca -0.03 -1.69 0.12 0.00 -3.89 0.00 0.00 57.50 52.00 3hcr n TRP 227 Cb 0.59 1.50 0.74 0.00 -1.36 0.00 0.00 31.31 32.78 3hcr n TRP 227 CO 0.00 0.00 0.00 -1.00 -2.29 0.00 0.00 177.69 174.40 3hcr h PRO 228 N 2.52 0.00 0.00 -2.67 0.13 -1.78 -3.18 132.00 127.02 3hcr h PRO 228 Ca -0.21 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.90 3hcr h PRO 228 Cb 1.17 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.27 3hcr h PRO 228 CO 0.04 0.09 -0.37 0.25 -0.23 0.00 0.00 178.00 177.78 3hcr n THR 229 N -3.89 1.81 -1.69 1.56 -2.24 -1.26 -4.10 114.28 104.46 3hcr n THR 229 Ca -0.02 -2.56 -0.42 0.00 -2.27 0.00 0.00 64.05 58.78 3hcr n THR 229 Cb 0.18 -0.10 -0.03 0.00 -2.10 0.00 0.00 70.33 68.28 3hcr n THR 229 CO 0.00 0.00 0.00 1.57 -0.57 0.00 0.00 175.07 176.07 3hcr n HIS 230 N -1.04 2.66 -0.33 4.78 -0.00 -1.20 -4.84 115.22 115.24 3hcr n HIS 230 Ca 0.16 -0.16 0.18 0.00 0.46 0.00 0.00 57.72 58.36 3hcr n HIS 230 Cb 0.71 -2.74 0.42 0.00 -0.12 0.00 0.00 29.99 28.26 3hcr n HIS 230 CO 0.00 0.00 0.00 1.12 0.46 0.00 0.00 176.34 177.92 3hcr h HIS 231 N 8.53 0.88 0.00 1.57 2.07 -1.96 0.11 115.15 126.34 3hcr h HIS 231 Ca -0.46 0.03 -0.08 0.00 -2.85 0.00 0.00 60.37 57.01 3hcr h HIS 231 Cb 1.22 -0.26 -0.01 0.00 2.57 0.00 0.00 27.41 30.93 3hcr h HIS 231 CO 0.78 0.11 -0.38 -0.07 -3.07 0.00 0.00 177.93 175.31 3hcr h LEU 232 N 0.55 0.00 -0.16 6.12 3.38 -1.95 -1.63 115.31 121.63 3hcr h LEU 232 Ca 0.60 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.48 3hcr h LEU 232 Cb 1.23 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.98 3hcr h LEU 232 CO -0.37 0.38 -0.24 0.25 0.09 0.00 0.00 178.44 178.55 3hcr h LEU 233 N 0.00 0.48 -0.72 1.67 5.85 -1.18 -2.29 115.31 119.12 3hcr h LEU 233 Ca -0.00 -0.52 0.00 0.00 0.84 0.00 0.00 57.88 58.20 3hcr h LEU 233 Cb 1.03 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 41.89 3hcr h LEU 233 CO 0.05 0.91 0.47 0.40 -0.34 0.00 0.00 178.44 179.93 3hcr h ILE 234 N 0.07 1.19 -0.65 4.05 1.08 -1.10 -2.04 117.51 120.10 3hcr h ILE 234 Ca 0.02 -0.36 -0.03 0.00 -0.39 0.00 0.00 64.86 64.09 3hcr h ILE 234 Cb 0.81 0.15 -0.03 0.00 -3.07 0.00 0.00 36.82 34.67 3hcr h ILE 234 CO 0.05 0.19 0.28 -0.61 -0.69 0.00 0.00 178.15 177.37 3hcr h GLN 235 N 0.98 0.96 -0.28 2.37 4.15 -1.28 -1.36 115.11 120.65 3hcr h GLN 235 Ca 0.26 -0.16 0.02 0.00 0.77 0.00 0.00 58.65 59.54 3hcr h GLN 235 Cb -0.09 -0.16 -0.02 0.00 0.21 0.00 0.00 27.48 27.41 3hcr h GLN 235 CO -0.05 0.79 0.14 0.00 -1.93 0.00 0.00 178.83 177.78 3hcr h PHE 237 N 0.30 0.31 -0.71 0.00 0.05 -1.06 -1.02 116.94 114.81 3hcr h PHE 237 Ca 0.12 0.01 -0.04 0.00 3.82 0.00 0.00 57.97 61.88 3hcr h PHE 237 Cb 0.03 -0.10 -0.03 0.00 2.00 0.00 0.00 35.95 37.85 3hcr h PHE 237 CO -0.09 0.18 0.30 0.00 -0.18 0.00 0.00 178.31 178.52 3hcr h ALA 238 N 1.12 1.19 -0.33 2.45 0.00 -1.06 -1.17 119.26 121.46 3hcr h ALA 238 Ca 0.11 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 3hcr h ALA 238 Cb -0.01 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 3hcr h ALA 238 CO -0.05 0.60 0.09 -0.44 0.00 0.00 0.00 179.25 179.45 3hcr h ASP 239 N 1.02 0.49 0.22 0.00 3.45 -0.60 -0.86 116.42 120.14 3hcr h ASP 239 Ca 0.24 -0.21 -0.07 0.00 0.43 0.00 0.00 57.03 57.42 3hcr h ASP 239 Cb 0.17 -0.13 -0.01 0.00 -0.56 0.00 0.00 39.33 38.80 3hcr h ASP 239 CO -0.02 0.57 -0.29 0.45 -1.57 0.00 0.00 179.24 178.38 3hcr h HIS 240 N 0.38 0.12 -0.07 4.55 3.86 -0.95 -1.56 115.15 121.47 3hcr h HIS 240 Ca 0.11 -0.02 -0.04 0.00 -1.16 0.00 0.00 60.37 59.25 3hcr h HIS 240 Cb 0.27 -0.03 -0.00 0.00 1.06 0.00 0.00 27.41 28.71 3hcr h HIS 240 CO 0.01 0.39 -0.12 0.82 0.86 0.00 0.00 177.93 179.90 3hcr h ILE 241 N 0.10 1.40 -0.31 2.45 2.04 -0.94 -2.03 117.51 120.22 3hcr h ILE 241 Ca 0.01 -1.36 0.01 0.00 1.00 0.00 0.00 64.86 64.52 3hcr h ILE 241 Cb 0.56 2.12 -0.02 0.00 -0.74 0.00 0.00 36.82 38.75 3hcr h ILE 241 CO 0.04 0.38 0.19 -0.07 0.00 0.00 0.00 178.15 178.69 3hcr h LEU 242 N -0.25 0.31 -1.35 1.44 3.38 -1.04 0.16 115.31 117.96 3hcr h LEU 242 Ca 0.01 -0.00 0.10 0.00 0.09 0.00 0.00 57.88 58.07 3hcr h LEU 242 Cb 0.67 -0.07 -0.05 0.00 0.09 0.00 0.00 40.66 41.30 3hcr h LEU 242 CO 0.03 0.23 0.52 0.50 0.09 0.00 0.00 178.44 179.80 3hcr h LYS 243 N 0.39 0.70 0.11 1.13 3.64 -1.29 -1.92 116.57 119.33 3hcr h LYS 243 Ca 0.12 -0.04 -0.27 0.00 -1.27 0.00 0.00 60.65 59.19 3hcr h LYS 243 Cb -0.02 -0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 31.65 3hcr h LYS 243 CO -0.05 0.46 -1.21 1.49 -2.27 0.00 0.00 179.45 177.87 3hcr h GLU 244 N 0.72 0.23 -0.13 1.90 4.57 -0.80 -3.22 114.58 117.85 3hcr h GLU 244 Ca 0.37 -0.39 0.03 0.00 -1.18 0.00 0.00 59.36 58.18 3hcr h GLU 244 Cb 0.46 0.15 -0.01 0.00 -0.16 0.00 0.00 28.75 29.19 3hcr h GLU 244 CO -0.14 1.18 0.09 -0.07 -1.18 0.00 0.00 179.01 178.90 3hcr h LEU 245 N 0.06 0.03 -0.33 1.64 3.38 -0.20 -0.40 115.31 119.48 3hcr h LEU 245 Ca -0.12 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.85 3hcr h LEU 245 Cb 1.94 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 42.69 3hcr h LEU 245 CO 0.19 0.02 0.00 0.47 0.09 0.00 0.00 178.44 179.21 3hcr n ASP 246 N -4.51 0.33 -0.28 -0.43 10.43 -0.94 -2.30 116.55 118.85 3hcr n ASP 246 Ca -0.00 0.58 0.14 0.00 2.57 0.00 0.00 54.79 58.08 3hcr n ASP 246 Cb 0.19 -0.65 0.64 0.00 1.84 0.00 0.00 41.12 43.14 3hcr n ASP 246 CO 0.00 0.00 0.00 1.41 -1.07 0.00 0.00 177.20 177.54 3hcr n HIS 247 N -1.86 0.00 -3.96 1.24 8.25 -0.16 -4.82 115.22 113.91 3hcr n HIS 247 Ca 0.03 0.00 -0.26 0.00 -0.26 0.00 0.00 57.72 57.23 3hcr n HIS 247 Cb 0.20 -0.04 -0.03 0.00 1.12 0.00 0.00 29.99 31.24 3hcr n HIS 247 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 3hcr s PHE 248 N -2.11 3.46 0.34 4.41 0.40 -0.97 -5.05 117.98 118.46 3hcr s PHE 248 Ca 0.38 0.10 -0.29 0.00 -0.60 0.00 0.00 56.93 56.53 3hcr s PHE 248 Cb 0.21 -1.65 -0.11 0.00 0.51 0.00 0.00 43.02 41.97 3hcr s PHE 248 CO 0.38 0.52 1.49 -2.30 0.70 0.00 0.00 175.22 176.00 3hcr n PRO 249 N -0.54 2.58 0.29 0.24 -0.02 -1.26 -4.83 135.00 131.45 3hcr n PRO 249 Ca -0.07 0.91 0.16 0.00 -2.02 0.00 0.00 63.50 62.48 3hcr n PRO 249 Cb 0.54 -2.63 0.89 0.00 -0.02 0.00 0.00 33.50 32.28 3hcr n PRO 249 CO 0.00 0.00 0.00 1.37 1.98 0.00 0.00 175.50 178.85 3hcr h LEU 250 N 3.45 0.00 -0.07 2.45 -0.00 -1.92 -1.53 115.31 117.68 3hcr h LEU 250 Ca -0.49 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.39 3hcr h LEU 250 Cb 1.24 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.90 3hcr h LEU 250 CO 0.68 0.05 0.00 -1.84 -0.00 0.00 0.00 178.44 177.33 3hcr n GLU 251 N -3.52 1.05 0.00 0.17 0.00 -1.26 -3.27 120.64 113.81 3hcr n GLU 251 Ca -0.02 -0.07 0.00 0.00 0.00 0.00 0.00 57.16 57.06 3hcr n GLU 251 Cb 0.16 -1.37 0.00 0.00 0.00 0.00 0.00 31.44 30.23 3hcr n GLU 251 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 3hcr n LYS 252 N -0.79 2.38 -0.05 3.44 4.76 -0.61 -4.86 118.16 122.44 3hcr n LYS 252 Ca 0.18 -0.15 -0.11 0.00 -2.87 0.00 0.00 58.31 55.36 3hcr n LYS 252 Cb 0.10 -0.55 -0.05 0.00 -1.84 0.00 0.00 35.03 32.68 3hcr n LYS 252 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3hcr h ARG 253 N 0.00 -0.41 0.00 1.97 3.08 -1.46 -1.33 114.38 116.23 3hcr h ARG 253 Ca 0.00 0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.08 3hcr h ARG 253 Cb 0.07 0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.21 3hcr h ARG 253 CO 0.00 -0.27 0.00 -1.13 -1.07 0.00 0.00 179.97 177.50 3hcr n SER 254 N -5.43 0.00 -0.00 7.04 3.41 -1.26 -1.29 113.62 116.09 3hcr n SER 254 Ca -0.03 0.48 0.08 0.00 -0.26 0.00 0.00 58.87 59.14 3hcr n SER 254 Cb 0.36 -0.48 -0.11 0.00 -0.26 0.00 0.00 64.21 63.72 3hcr n SER 254 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3hcr n GLU 255 N -1.48 1.16 -1.70 4.33 4.71 -0.53 -4.81 120.64 122.33 3hcr n GLU 255 Ca 0.00 -0.03 -0.43 0.00 -0.01 0.00 0.00 57.16 56.69 3hcr n GLU 255 Cb 0.01 -1.33 -0.03 0.00 -1.01 0.00 0.00 31.44 29.07 3hcr n GLU 255 CO 0.00 0.00 0.00 0.28 0.09 0.00 0.00 177.13 177.50 3hcr n VAL 256 N -1.54 0.08 -3.25 2.62 0.31 -0.41 -4.79 118.33 111.36 3hcr n VAL 256 Ca 0.02 -0.02 -0.39 0.00 -0.01 0.00 0.00 64.34 63.95 3hcr n VAL 256 Cb 0.30 -1.92 -0.06 0.00 -0.91 0.00 0.00 33.84 31.25 3hcr n VAL 256 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 3hcr s VAL 257 N 1.49 5.13 -0.36 2.52 1.01 -0.14 -4.23 120.40 125.83 3hcr s VAL 257 Ca 0.78 1.02 -0.19 0.00 0.00 0.00 0.00 61.98 63.58 3hcr s VAL 257 Cb -0.54 -3.86 0.00 0.00 0.00 0.00 0.00 36.38 31.98 3hcr s VAL 257 CO 0.35 0.24 0.56 -0.63 0.00 0.00 0.00 175.10 175.62 3hcr s ILE 258 N 1.15 4.97 -0.46 2.22 1.01 -0.34 -0.45 121.20 129.30 3hcr s ILE 258 Ca 0.26 0.39 -0.10 0.00 0.00 0.00 0.00 60.65 61.20 3hcr s ILE 258 Cb -0.15 -4.01 0.10 0.00 0.01 0.00 0.00 42.46 38.40 3hcr s ILE 258 CO 0.11 -0.27 0.33 -0.22 0.00 0.00 0.00 174.94 174.88 3hcr s LEU 259 N 2.51 5.53 0.01 2.97 2.96 0.46 -1.77 118.68 131.34 3hcr s LEU 259 Ca 0.21 -1.70 -0.30 0.00 -0.22 0.00 0.00 54.13 52.11 3hcr s LEU 259 Cb -0.15 -2.03 -0.04 0.00 0.50 0.00 0.00 46.19 44.47 3hcr s LEU 259 CO 0.14 -0.64 1.15 -0.36 -1.32 0.00 0.00 176.35 175.31 3hcr s PHE 260 N 1.43 3.41 -0.19 5.38 0.40 -0.19 -1.03 117.98 127.18 3hcr s PHE 260 Ca 0.04 1.37 0.00 0.00 -0.60 0.00 0.00 56.93 57.74 3hcr s PHE 260 Cb -0.25 -3.35 0.04 0.00 0.51 0.00 0.00 43.02 39.97 3hcr s PHE 260 CO 0.01 -0.99 -0.09 0.45 0.70 0.00 0.00 175.22 175.30 3hcr s SER 261 N 1.18 3.27 0.29 1.36 0.15 0.48 -0.49 113.70 119.93 3hcr s SER 261 Ca 0.56 -0.84 0.10 0.00 0.70 0.00 0.00 55.95 56.47 3hcr s SER 261 Cb -0.26 -1.15 -0.05 0.00 -1.71 0.00 0.00 66.02 62.85 3hcr s SER 261 CO 0.26 -0.16 -0.03 0.00 1.20 0.00 0.00 173.24 174.51 3hcr s ALA 262 N 1.46 3.10 0.13 5.45 0.00 -0.86 -3.27 121.76 127.77 3hcr s ALA 262 Ca -0.01 -1.76 -0.31 0.00 0.00 0.00 0.00 51.96 49.88 3hcr s ALA 262 Cb -0.16 -0.59 -0.08 0.00 0.00 0.00 0.00 23.12 22.29 3hcr s ALA 262 CO -0.08 0.22 1.34 -1.01 0.00 0.00 0.00 175.76 176.23 3hcr s HIS 263 N -2.40 3.28 0.99 0.00 3.76 -1.26 -0.41 115.29 119.25 3hcr s HIS 263 Ca 0.32 1.07 -0.12 0.00 -0.15 0.00 0.00 55.06 56.18 3hcr s HIS 263 Cb -0.05 -3.62 0.18 0.00 1.11 0.00 0.00 32.58 30.20 3hcr s HIS 263 CO 0.19 -2.10 1.09 0.45 -0.85 0.00 0.00 174.74 173.52 3hcr s SER 264 N 0.89 2.67 0.08 1.40 0.15 -0.83 -4.79 113.70 113.27 3hcr s SER 264 Ca 0.62 1.23 0.06 0.00 0.70 0.00 0.00 55.95 58.55 3hcr s SER 264 Cb -0.36 -1.90 -0.03 0.00 -1.71 0.00 0.00 66.02 62.02 3hcr s SER 264 CO 0.32 -3.11 -0.15 -0.76 1.20 0.00 0.00 173.24 170.74 3hcr s LEU 265 N -6.45 2.29 0.53 3.45 1.43 -1.26 -4.99 118.68 113.68 3hcr s LEU 265 Ca 0.65 -0.65 -0.21 0.00 -1.03 0.00 0.00 54.13 52.90 3hcr s LEU 265 Cb -0.19 -0.57 -0.06 0.00 0.03 0.00 0.00 46.19 45.40 3hcr s LEU 265 CO 0.58 -0.06 1.20 -2.84 0.23 0.00 0.00 176.35 175.46 3hcr s PRO 266 N -1.86 3.35 0.61 1.29 0.02 -1.26 -1.40 135.00 135.74 3hcr s PRO 266 Ca 0.00 1.83 0.34 0.00 0.02 0.00 0.00 61.00 63.20 3hcr s PRO 266 Cb -0.09 -2.17 1.97 0.00 0.02 0.00 0.00 34.50 34.23 3hcr s PRO 266 CO 0.03 -0.90 2.27 0.52 -0.33 0.00 0.00 177.00 178.59 3hcr h MET 267 N 1.45 0.00 0.00 5.54 2.86 -1.15 0.32 114.93 123.95 3hcr h MET 267 Ca -0.50 0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 57.05 3hcr h MET 267 Cb 1.27 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.92 3hcr h MET 267 CO 0.58 0.01 -0.42 0.66 1.06 0.00 0.00 176.91 178.80 3hcr h SER 268 N 0.00 0.00 0.21 1.22 4.64 -1.90 -0.72 113.55 117.00 3hcr h SER 268 Ca -0.00 0.00 -0.30 0.00 -0.47 0.00 0.00 61.79 61.02 3hcr h SER 268 Cb 0.04 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 62.15 3hcr h SER 268 CO 0.00 0.42 -1.37 0.58 -0.87 0.00 0.00 176.83 175.59 3hcr h VAL 269 N 0.00 1.25 0.20 0.95 2.07 -1.30 -3.01 116.25 116.41 3hcr h VAL 269 Ca -0.00 -2.60 0.00 0.00 0.82 0.00 0.00 66.70 64.91 3hcr h VAL 269 Cb 0.93 3.01 -0.01 0.00 -1.52 0.00 0.00 31.29 33.70 3hcr h VAL 269 CO 0.05 0.79 -0.17 0.58 0.02 0.00 0.00 177.57 178.85 3hcr h VAL 270 N -0.02 0.64 0.00 2.57 2.07 -1.32 -2.35 116.25 117.84 3hcr h VAL 270 Ca -0.25 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.27 3hcr h VAL 270 Cb 2.00 0.64 0.00 0.00 -1.52 0.00 0.00 31.29 32.41 3hcr h VAL 270 CO 0.21 0.00 0.00 0.78 0.02 0.00 0.00 177.57 178.58 3hcr h ASN 271 N -0.38 0.00 1.44 0.57 2.35 -1.25 0.92 115.58 119.24 3hcr h ASN 271 Ca -0.01 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.72 3hcr h ASN 271 Cb 0.35 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.71 3hcr h ASN 271 CO -0.02 0.00 -0.11 -0.09 -1.65 0.00 0.00 177.43 175.55 3hcr h ARG 272 N 0.00 0.00 0.00 0.81 2.43 -1.27 -3.47 114.38 112.88 3hcr h ARG 272 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3hcr h ARG 272 Cb 0.08 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.63 3hcr h ARG 272 CO 0.00 0.11 0.00 0.41 -1.51 0.00 0.00 179.97 178.98 3hcr n GLY 273 N 0.63 1.75 3.74 2.80 0.00 0.31 -1.91 105.19 112.51 3hcr n GLY 273 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 3hcr n GLY 273 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3hcr s ASP 274 N -2.00 6.42 0.00 1.61 2.15 -1.18 -4.63 116.67 119.04 3hcr s ASP 274 Ca 0.00 2.87 0.26 0.00 0.43 0.00 0.00 52.55 56.11 3hcr s ASP 274 Cb 0.00 -2.62 1.11 0.00 -0.30 0.00 0.00 42.92 41.11 3hcr s ASP 274 CO 0.00 -0.90 1.83 -0.81 -0.17 0.00 0.00 175.17 175.11 3hcr n PRO 275 N 2.90 0.02 -0.01 4.34 -0.04 -1.26 -4.38 135.00 136.57 3hcr n PRO 275 Ca 0.11 0.06 -0.12 0.00 -0.04 0.00 0.00 63.50 63.51 3hcr n PRO 275 Cb 0.37 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.28 3hcr n PRO 275 CO 0.00 0.00 0.00 -0.92 -0.04 0.00 0.00 175.50 174.54 3hcr h TYR 276 N 0.00 -1.13 -0.99 0.54 3.20 -1.67 -2.55 116.97 114.37 3hcr h TYR 276 Ca 0.00 0.05 0.15 0.00 3.14 0.00 0.00 58.73 62.07 3hcr h TYR 276 Cb 0.43 0.52 -0.09 0.00 1.54 0.00 0.00 36.73 39.13 3hcr h TYR 276 CO 0.00 -0.46 0.62 -1.35 -1.64 0.00 0.00 178.16 175.33 3hcr h PRO 277 N -0.46 0.84 -0.15 1.82 0.11 -1.87 -0.29 132.00 131.99 3hcr h PRO 277 Ca 0.09 -0.05 -0.17 0.00 0.11 0.00 0.00 66.00 65.98 3hcr h PRO 277 Cb 0.61 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 31.52 3hcr h PRO 277 CO -0.40 0.56 -0.60 0.37 -0.21 0.00 0.00 178.00 177.71 3hcr h GLN 278 N 0.87 0.52 -0.08 1.05 -0.00 -1.80 -2.23 115.11 113.44 3hcr h GLN 278 Ca 0.52 -0.35 -0.21 0.00 -0.00 0.00 0.00 58.65 58.61 3hcr h GLN 278 Cb 0.67 0.05 0.00 0.00 0.00 0.00 0.00 27.48 28.21 3hcr h GLN 278 CO -0.29 0.97 -0.80 0.93 0.00 0.00 0.00 178.83 179.63 3hcr h GLU 279 N 0.39 0.54 -0.67 1.69 5.08 -0.99 -2.36 114.58 118.25 3hcr h GLU 279 Ca -0.00 -0.47 -0.07 0.00 -1.00 0.00 0.00 59.36 57.82 3hcr h GLU 279 Cb 1.15 0.11 -0.03 0.00 0.50 0.00 0.00 28.75 30.48 3hcr h GLU 279 CO 0.11 1.10 0.16 0.28 -1.00 0.00 0.00 179.01 179.67 3hcr h VAL 280 N 0.36 1.26 -0.46 3.13 2.07 -1.07 -1.97 116.25 119.56 3hcr h VAL 280 Ca -0.05 -0.94 -0.03 0.00 0.82 0.00 0.00 66.70 66.50 3hcr h VAL 280 Cb 1.41 0.56 -0.02 0.00 -1.52 0.00 0.00 31.29 31.72 3hcr h VAL 280 CO 0.15 0.36 0.16 0.28 0.02 0.00 0.00 177.57 178.54 3hcr h SER 281 N 1.02 0.60 -0.44 0.57 0.02 -1.30 -2.12 113.55 111.89 3hcr h SER 281 Ca 0.21 -0.07 -0.13 0.00 -0.84 0.00 0.00 61.79 60.96 3hcr h SER 281 Cb 0.36 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.73 3hcr h SER 281 CO 0.00 0.56 -0.22 0.00 -1.14 0.00 0.00 176.83 176.03 3hcr h ALA 282 N 1.53 0.72 -0.36 3.77 0.00 -0.83 -2.30 119.26 121.79 3hcr h ALA 282 Ca 0.16 -0.39 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 3hcr h ALA 282 Cb 0.17 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 3hcr h ALA 282 CO -0.01 0.67 0.17 1.15 0.00 0.00 0.00 179.25 181.23 3hcr h THR 283 N 0.83 1.16 -0.49 0.00 2.02 -1.00 -2.21 112.91 113.22 3hcr h THR 283 Ca 0.11 -0.46 0.07 0.00 0.77 0.00 0.00 66.41 66.89 3hcr h THR 283 Cb 0.79 0.81 -0.06 0.00 -1.74 0.00 0.00 68.15 67.96 3hcr h THR 283 CO 0.07 0.17 0.17 0.58 0.37 0.00 0.00 175.52 176.87 3hcr h VAL 284 N 0.44 0.82 -0.63 3.16 2.07 -1.24 -1.50 116.25 119.37 3hcr h VAL 284 Ca 0.12 -0.12 -0.08 0.00 0.82 0.00 0.00 66.70 67.45 3hcr h VAL 284 Cb 0.11 0.45 -0.02 0.00 -1.52 0.00 0.00 31.29 30.31 3hcr h VAL 284 CO -0.02 0.06 0.08 -0.61 0.02 0.00 0.00 177.57 177.10 3hcr h GLN 285 N 0.34 1.06 -0.72 1.57 5.75 -1.25 -1.90 115.11 119.96 3hcr h GLN 285 Ca 0.24 -0.30 -0.03 0.00 -0.15 0.00 0.00 58.65 58.41 3hcr h GLN 285 Cb 0.26 -0.12 -0.03 0.00 1.07 0.00 0.00 27.48 28.66 3hcr h GLN 285 CO -0.25 0.99 0.33 0.87 -2.65 0.00 0.00 178.83 178.12 3hcr h LYS 286 N 0.97 1.04 -0.42 1.69 6.56 -1.02 -1.12 116.57 124.28 3hcr h LYS 286 Ca 0.19 -0.16 -0.05 0.00 -1.06 0.00 0.00 60.65 59.56 3hcr h LYS 286 Cb 0.47 -0.18 -0.02 0.00 -0.57 0.00 0.00 32.23 31.93 3hcr h LYS 286 CO 0.02 0.83 0.07 0.28 -2.06 0.00 0.00 179.45 178.59 3hcr h VAL 287 N 1.01 1.24 -0.18 0.50 2.07 -1.07 -2.17 116.25 117.65 3hcr h VAL 287 Ca 0.24 -0.87 -0.11 0.00 0.82 0.00 0.00 66.70 66.78 3hcr h VAL 287 Cb 0.15 0.99 -0.01 0.00 -1.52 0.00 0.00 31.29 30.90 3hcr h VAL 287 CO -0.03 0.30 -0.38 0.24 0.02 0.00 0.00 177.57 177.72 3hcr h MET 288 N 0.55 0.40 -0.55 1.57 2.86 -1.13 -2.12 114.93 116.51 3hcr h MET 288 Ca 0.13 -0.19 -0.03 0.00 -2.06 0.00 0.00 59.70 57.55 3hcr h MET 288 Cb 0.37 -0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.00 3hcr h MET 288 CO 0.01 0.73 0.22 0.93 1.06 0.00 0.00 176.91 179.85 3hcr h GLU 289 N 0.34 0.83 0.00 1.72 5.08 -1.07 -0.43 114.58 121.05 3hcr h GLU 289 Ca 0.03 -0.15 -0.02 0.00 -1.00 0.00 0.00 59.36 58.22 3hcr h GLU 289 Cb 0.82 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 29.94 3hcr h GLU 289 CO 0.07 0.73 -0.08 -0.09 -1.00 0.00 0.00 179.01 178.64 3hcr h ARG 290 N 0.76 0.00 -0.17 2.33 9.65 -1.13 -1.55 114.38 124.27 3hcr h ARG 290 Ca 0.18 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.06 3hcr h ARG 290 Cb 0.21 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.79 3hcr h ARG 290 CO -0.01 0.08 0.00 1.28 2.80 0.00 0.00 179.97 184.11 3hcr n LEU 291 N -4.28 2.58 -1.13 3.80 4.77 -0.82 -4.95 117.00 116.96 3hcr n LEU 291 Ca -0.03 -1.00 -0.13 0.00 -0.03 0.00 0.00 56.01 54.83 3hcr n LEU 291 Cb 0.16 -0.10 -0.04 0.00 -2.33 0.00 0.00 43.42 41.10 3hcr n LEU 291 CO 0.34 0.50 -0.14 -0.62 -1.33 0.00 0.00 177.39 176.14 3hcr n GLU 292 N 0.95 -0.95 -3.86 3.23 -0.58 -0.57 -2.66 120.64 116.21 3hcr n GLU 292 Ca 0.17 0.87 -0.28 0.00 -0.42 0.00 0.00 57.16 57.51 3hcr n GLU 292 Cb 0.50 -4.98 0.03 0.00 -0.57 0.00 0.00 31.44 26.42 3hcr n GLU 292 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 3hcr n TYR 293 N -2.99 -2.22 0.27 -0.32 4.01 -0.28 -4.83 117.16 110.80 3hcr n TYR 293 Ca -0.14 0.89 0.14 0.00 -0.16 0.00 0.00 57.90 58.63 3hcr n TYR 293 Cb 0.48 -4.11 0.74 0.00 -0.31 0.00 0.00 39.34 36.14 3hcr n TYR 293 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3hcr s ASN 295 N -6.06 1.06 0.55 0.00 -0.87 -1.26 -4.90 114.94 103.45 3hcr s ASN 295 Ca -0.02 -1.10 -0.15 0.00 -1.57 0.00 0.00 52.86 50.01 3hcr s ASN 295 Cb 0.13 0.13 -0.06 0.00 -0.02 0.00 0.00 41.25 41.42 3hcr s ASN 295 CO 0.57 -0.54 1.01 -2.16 -2.57 0.00 0.00 177.10 173.41 3hcr s PRO 296 N -3.89 3.77 0.17 -0.60 0.04 -1.26 -4.90 135.00 128.32 3hcr s PRO 296 Ca 0.18 0.97 -0.10 0.00 0.04 0.00 0.00 61.00 62.08 3hcr s PRO 296 Cb 0.06 -2.11 -0.00 0.00 0.04 0.00 0.00 34.50 32.49 3hcr s PRO 296 CO -0.01 -0.43 0.32 1.52 0.04 0.00 0.00 177.00 178.45 3hcr s TYR 297 N -2.69 0.31 -0.03 0.56 -0.85 -1.26 -1.20 117.35 112.19 3hcr s TYR 297 Ca 0.59 -0.67 -0.12 0.00 -0.52 0.00 0.00 57.07 56.34 3hcr s TYR 297 Cb -0.11 0.02 0.02 0.00 0.38 0.00 0.00 41.96 42.26 3hcr s TYR 297 CO 0.36 -0.75 0.27 1.03 -1.52 0.00 0.00 175.55 174.94 3hcr s ARG 298 N -3.95 0.57 -0.30 -3.49 1.81 -0.73 -4.97 118.95 107.90 3hcr s ARG 298 Ca 0.16 -0.13 -0.10 0.00 -1.72 0.00 0.00 55.73 53.93 3hcr s ARG 298 Cb 0.03 0.25 -0.02 0.00 -0.45 0.00 0.00 34.95 34.76 3hcr s ARG 298 CO -0.01 -0.14 0.16 -1.17 -0.68 0.00 0.00 175.30 173.46 3hcr s LEU 299 N -1.08 4.04 0.33 2.53 2.96 -1.26 -1.03 118.68 125.16 3hcr s LEU 299 Ca -0.11 -0.33 0.08 0.00 -0.22 0.00 0.00 54.13 53.55 3hcr s LEU 299 Cb -0.05 -2.04 -0.06 0.00 0.50 0.00 0.00 46.19 44.54 3hcr s LEU 299 CO 0.03 -0.14 -0.06 0.68 -1.32 0.00 0.00 176.35 175.54 3hcr s VAL 300 N 1.67 1.95 -0.08 1.68 -7.23 0.36 -4.74 120.40 114.00 3hcr s VAL 300 Ca 0.06 -2.15 0.04 0.00 -1.81 0.00 0.00 61.98 58.12 3hcr s VAL 300 Cb -0.16 -2.62 0.00 0.00 0.56 0.00 0.00 36.38 34.16 3hcr s VAL 300 CO 0.08 -0.21 -0.20 0.26 -0.31 0.00 0.00 175.10 174.71 3hcr s TRP 301 N -2.80 2.19 0.51 2.82 0.52 0.46 -2.02 118.94 120.62 3hcr s TRP 301 Ca 0.32 -0.85 0.07 0.00 0.02 0.00 0.00 56.10 55.66 3hcr s TRP 301 Cb 0.04 -1.49 0.03 0.00 -1.15 0.00 0.00 33.47 30.89 3hcr s TRP 301 CO 0.15 -0.35 0.45 1.14 0.02 0.00 0.00 176.95 178.36 3hcr s GLN 302 N 0.36 2.35 -1.48 4.98 -2.07 0.46 -1.73 119.66 122.52 3hcr s GLN 302 Ca -0.16 -1.81 -0.11 0.00 -1.82 0.00 0.00 55.36 51.47 3hcr s GLN 302 Cb -0.17 -2.26 0.07 0.00 -1.09 0.00 0.00 33.01 29.56 3hcr s GLN 302 CO 0.07 -0.51 0.93 0.43 -1.32 0.00 0.00 175.29 174.89 3hcr n SER 303 N -1.76 -4.11 -0.30 12.60 7.64 -1.26 -1.97 113.62 124.47 3hcr n SER 303 Ca 0.03 -0.78 -0.06 0.00 1.01 0.00 0.00 58.87 59.07 3hcr n SER 303 Cb 0.63 -3.95 -0.04 0.00 -1.01 0.00 0.00 64.21 59.84 3hcr n SER 303 CO 0.00 0.00 0.00 2.29 -3.01 0.00 0.00 175.04 174.32 3hcr n LYS 304 N -4.62 -0.28 -2.49 1.43 0.00 -1.26 -4.84 118.16 106.11 3hcr n LYS 304 Ca -0.03 1.10 -0.02 0.00 -0.00 0.00 0.00 58.31 59.36 3hcr n LYS 304 Cb 0.56 -1.62 -0.01 0.00 -0.00 0.00 0.00 35.03 33.95 3hcr n LYS 304 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.40 178.73 3hcr n VAL 305 N -4.95 -8.40 0.00 0.58 0.24 -1.26 -5.00 118.33 99.54 3hcr n VAL 305 Ca 0.03 1.87 0.00 0.00 -2.04 0.00 0.00 64.34 64.20 3hcr n VAL 305 Cb 0.22 -4.68 0.00 0.00 -1.47 0.00 0.00 33.84 27.91 3hcr n VAL 305 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3hcr n GLY 306 N 1.98 1.63 0.06 7.63 0.00 -1.26 -4.90 105.19 110.32 3hcr n GLY 306 Ca -0.13 -2.21 0.06 0.00 0.00 0.00 0.00 46.02 43.74 3hcr n GLY 306 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3hcr n PRO 307 N -0.69 0.65 -1.10 1.61 -0.04 -1.26 -4.99 135.00 129.17 3hcr n PRO 307 Ca 0.00 -0.05 -0.30 0.00 -0.04 0.00 0.00 63.50 63.12 3hcr n PRO 307 Cb 0.00 -1.62 0.15 0.00 -0.04 0.00 0.00 33.50 31.99 3hcr n PRO 307 CO 0.00 0.00 0.00 -1.64 -0.04 0.00 0.00 175.50 173.82 3hcr s MET 308 N -3.23 1.02 0.05 0.54 -1.94 -1.26 -4.98 119.30 109.50 3hcr s MET 308 Ca -0.06 0.87 -0.30 0.00 -1.71 0.00 0.00 55.69 54.49 3hcr s MET 308 Cb 0.11 -1.78 -0.05 0.00 2.01 0.00 0.00 34.83 35.12 3hcr s MET 308 CO 0.86 -2.42 1.11 -1.25 -0.01 0.00 0.00 175.02 173.31 3hcr s PRO 309 N -4.87 4.50 0.30 2.03 0.04 -1.26 -4.99 135.00 130.74 3hcr s PRO 309 Ca 0.64 1.64 0.11 0.00 0.04 0.00 0.00 61.00 63.44 3hcr s PRO 309 Cb -0.19 -3.38 -0.05 0.00 0.04 0.00 0.00 34.50 30.92 3hcr s PRO 309 CO 0.58 -0.15 -0.17 -1.58 0.04 0.00 0.00 177.00 175.72 3hcr s TRP 310 N 0.90 2.32 0.11 0.56 0.52 -1.26 -0.61 118.94 121.48 3hcr s TRP 310 Ca 0.55 -0.37 -0.31 0.00 0.02 0.00 0.00 56.10 55.99 3hcr s TRP 310 Cb -0.26 -1.09 -0.09 0.00 -1.15 0.00 0.00 33.47 30.88 3hcr s TRP 310 CO 0.29 0.69 1.52 -1.17 0.02 0.00 0.00 176.95 178.30 3hcr s LEU 311 N -3.54 4.36 0.00 2.99 2.96 -0.50 -4.73 118.68 120.23 3hcr s LEU 311 Ca 0.31 2.45 0.01 0.00 -0.22 0.00 0.00 54.13 56.68 3hcr s LEU 311 Cb -0.03 -3.58 0.01 0.00 0.50 0.00 0.00 46.19 43.09 3hcr s LEU 311 CO 0.15 -0.78 0.09 0.61 -1.32 0.00 0.00 176.35 175.10 3hcr n GLY 312 N 3.73 3.48 3.77 7.98 0.00 -1.26 -4.69 105.19 118.20 3hcr n GLY 312 Ca 0.14 -2.28 -0.37 0.00 0.00 0.00 0.00 46.02 43.51 3hcr n GLY 312 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3hcr s PRO 313 N -3.14 3.44 0.32 1.61 0.04 -1.26 -4.83 135.00 131.18 3hcr s PRO 313 Ca 0.07 1.82 -0.27 0.00 0.04 0.00 0.00 61.00 62.66 3hcr s PRO 313 Cb -0.01 -2.22 -0.10 0.00 0.04 0.00 0.00 34.50 32.22 3hcr s PRO 313 CO 0.04 -0.82 0.97 -0.65 0.04 0.00 0.00 177.00 176.58 3hcr s GLN 314 N -2.96 4.57 0.19 4.56 -0.21 -1.25 -0.40 119.66 124.16 3hcr s GLN 314 Ca 0.69 1.42 -0.11 0.00 0.02 0.00 0.00 55.36 57.37 3hcr s GLN 314 Cb -0.30 -2.86 0.16 0.00 1.00 0.00 0.00 33.01 31.01 3hcr s GLN 314 CO 0.35 0.25 1.82 1.15 -2.12 0.00 0.00 175.29 176.73 3hcr h THR 315 N 2.67 1.03 0.28 -0.19 2.02 -1.67 -1.41 112.91 115.65 3hcr h THR 315 Ca -0.47 -0.24 0.00 0.00 0.77 0.00 0.00 66.41 66.48 3hcr h THR 315 Cb 1.20 0.29 -0.04 0.00 -1.74 0.00 0.00 68.15 67.86 3hcr h THR 315 CO 0.65 0.13 -0.46 0.44 0.37 0.00 0.00 175.52 176.65 3hcr h ASP 316 N 0.69 -1.30 0.21 4.18 3.32 -1.93 -1.77 116.42 119.82 3hcr h ASP 316 Ca 0.25 0.13 -0.05 0.00 0.02 0.00 0.00 57.03 57.38 3hcr h ASP 316 Cb 0.07 0.46 -0.01 0.00 0.22 0.00 0.00 39.33 40.08 3hcr h ASP 316 CO -0.13 -0.56 -0.22 1.05 -1.72 0.00 0.00 179.24 177.66 3hcr h GLU 317 N -0.80 0.03 -0.51 3.56 4.11 -1.94 -2.62 114.58 116.41 3hcr h GLU 317 Ca -0.02 -0.01 -0.10 0.00 0.07 0.00 0.00 59.36 59.31 3hcr h GLU 317 Cb 0.76 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.99 3hcr h GLU 317 CO -0.17 0.25 -0.07 0.77 0.07 0.00 0.00 179.01 179.86 3hcr h SER 318 N 0.02 0.95 -0.36 3.06 0.02 -0.92 0.24 113.55 116.55 3hcr h SER 318 Ca 0.00 -0.34 -0.03 0.00 -0.84 0.00 0.00 61.79 60.59 3hcr h SER 318 Cb 0.41 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.68 3hcr h SER 318 CO 0.03 1.06 0.12 0.40 -1.14 0.00 0.00 176.83 177.30 3hcr h ILE 319 N 0.81 1.21 -0.30 3.27 2.04 -1.12 0.35 117.51 123.77 3hcr h ILE 319 Ca 0.14 -0.67 -0.02 0.00 1.00 0.00 0.00 64.86 65.31 3hcr h ILE 319 Cb 0.62 0.97 -0.01 0.00 -0.74 0.00 0.00 36.82 37.65 3hcr h ILE 319 CO 0.04 0.23 0.12 0.50 0.00 0.00 0.00 178.15 179.04 3hcr h LYS 320 N 0.44 0.45 -0.45 2.37 3.64 -1.32 -1.61 116.57 120.08 3hcr h LYS 320 Ca 0.12 -0.08 -0.01 0.00 -1.27 0.00 0.00 60.65 59.41 3hcr h LYS 320 Cb 0.24 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.97 3hcr h LYS 320 CO -0.00 0.46 0.25 0.78 -2.27 0.00 0.00 179.45 178.66 3hcr h GLY 321 N 0.34 0.68 1.36 5.01 0.00 -0.31 -1.06 103.07 109.08 3hcr h GLY 321 Ca 0.10 -0.31 -0.02 0.00 0.00 0.00 0.00 47.33 47.10 3hcr h GLY 321 CO -0.01 0.30 0.29 1.41 0.00 0.00 0.00 176.54 178.53 3hcr h LEU 322 N 0.59 0.75 -0.46 3.11 3.38 -0.15 -2.47 115.31 120.06 3hcr h LEU 322 Ca 0.16 -0.07 -0.17 0.00 0.09 0.00 0.00 57.88 57.89 3hcr h LEU 322 Cb 0.06 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.61 3hcr h LEU 322 CO -0.03 0.63 -0.63 0.00 0.09 0.00 0.00 178.44 178.51 3hcr n GLU 324 N -3.91 0.09 -0.40 0.00 1.02 -0.43 -2.34 120.64 114.66 3hcr n GLU 324 Ca -0.04 0.24 0.07 0.00 -0.02 0.00 0.00 57.16 57.41 3hcr n GLU 324 Cb 0.65 -1.50 0.18 0.00 -0.02 0.00 0.00 31.44 30.75 3hcr n GLU 324 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3hcr n ARG 325 N -1.39 1.51 -0.62 3.49 1.74 -1.02 -4.99 116.66 115.38 3hcr n ARG 325 Ca 0.04 -3.01 0.00 0.00 -0.77 0.00 0.00 57.85 54.11 3hcr n ARG 325 Cb 0.12 -1.59 0.00 0.00 -1.02 0.00 0.00 32.46 29.97 3hcr n ARG 325 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3hcr n GLY 326 N -1.23 1.26 3.49 -0.13 0.00 -0.99 -4.99 105.19 102.60 3hcr n GLY 326 Ca 0.18 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.78 3hcr n GLY 326 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hcr s ARG 327 N -0.19 3.44 0.15 1.61 1.81 -0.39 -4.85 118.95 120.53 3hcr s ARG 327 Ca 0.00 -1.23 0.08 0.00 -1.72 0.00 0.00 55.73 52.87 3hcr s ARG 327 Cb 0.00 -4.80 -0.15 0.00 -0.45 0.00 0.00 34.95 29.55 3hcr s ARG 327 CO 0.00 -1.93 1.32 0.87 -0.68 0.00 0.00 175.30 174.87 3hcr h LYS 328 N 9.38 0.00 -4.82 3.54 6.56 -1.89 -3.33 116.57 126.01 3hcr h LYS 328 Ca 0.02 0.00 -0.68 0.00 -1.06 0.00 0.00 60.65 58.93 3hcr h LYS 328 Cb 1.03 0.00 -0.28 0.00 -0.57 0.00 0.00 32.23 32.41 3hcr h LYS 328 CO 1.23 0.91 -0.66 -0.80 -2.06 0.00 0.00 179.45 178.07 3hcr s ASN 329 N -6.68 4.93 -0.07 0.86 -0.87 -1.26 -2.37 114.94 109.49 3hcr s ASN 329 Ca 0.01 -0.82 0.05 0.00 -1.57 0.00 0.00 52.86 50.53 3hcr s ASN 329 Cb 0.10 -1.82 -0.00 0.00 -0.02 0.00 0.00 41.25 39.51 3hcr s ASN 329 CO 0.81 -0.19 -0.23 -0.63 -2.57 0.00 0.00 177.10 174.29 3hcr s ILE 330 N 1.43 1.90 -0.28 0.60 1.01 0.12 -0.96 121.20 125.03 3hcr s ILE 330 Ca 0.01 -0.96 -0.01 0.00 0.00 0.00 0.00 60.65 59.68 3hcr s ILE 330 Cb -0.17 -1.63 0.04 0.00 0.01 0.00 0.00 42.46 40.71 3hcr s ILE 330 CO 0.01 0.53 -0.03 -0.22 0.00 0.00 0.00 174.94 175.23 3hcr s LEU 331 N 0.07 3.63 -0.01 2.97 2.96 0.41 -1.45 118.68 127.26 3hcr s LEU 331 Ca -0.09 -1.14 -0.22 0.00 -0.22 0.00 0.00 54.13 52.46 3hcr s LEU 331 Cb -0.15 -1.69 -0.05 0.00 0.50 0.00 0.00 46.19 44.81 3hcr s LEU 331 CO 0.05 -0.21 0.64 -0.76 -1.32 0.00 0.00 176.35 174.75 3hcr s LEU 332 N 1.27 4.40 -0.15 -0.68 1.43 0.16 -0.40 118.68 124.70 3hcr s LEU 332 Ca -0.04 1.19 0.01 0.00 -1.03 0.00 0.00 54.13 54.26 3hcr s LEU 332 Cb -0.19 -2.99 0.02 0.00 0.03 0.00 0.00 46.19 43.06 3hcr s LEU 332 CO -0.02 0.04 -0.16 -0.69 0.23 0.00 0.00 176.35 175.75 3hcr s VAL 333 N 0.06 1.69 -1.07 -1.59 1.01 -0.20 -0.97 120.40 119.34 3hcr s VAL 333 Ca 0.33 -0.71 -0.22 0.00 0.00 0.00 0.00 61.98 61.38 3hcr s VAL 333 Cb -0.18 -1.57 0.04 0.00 0.00 0.00 0.00 36.38 34.67 3hcr s VAL 333 CO 0.18 0.48 1.57 -2.16 0.00 0.00 0.00 175.10 175.17 3hcr s PRO 334 N 1.39 3.54 0.05 2.72 0.04 -1.26 -0.39 135.00 141.09 3hcr s PRO 334 Ca 0.04 -1.23 0.27 0.00 0.04 0.00 0.00 61.00 60.12 3hcr s PRO 334 Cb -0.13 -5.37 0.95 0.00 0.04 0.00 0.00 34.50 29.99 3hcr s PRO 334 CO -0.10 -2.39 1.76 1.51 0.04 0.00 0.00 177.00 177.82 3hcr n ILE 335 N 6.91 0.14 -0.38 0.56 0.13 -1.20 -4.34 119.36 121.18 3hcr n ILE 335 Ca 0.37 -0.08 0.00 0.00 -1.10 0.00 0.00 62.75 61.95 3hcr n ILE 335 Cb 0.49 -0.35 0.00 0.00 -0.84 0.00 0.00 39.64 38.95 3hcr n ILE 335 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 3hcr n ALA 336 N -1.58 1.59 -3.65 1.51 0.00 -1.26 -4.97 120.51 112.15 3hcr n ALA 336 Ca 0.06 -0.56 -0.19 0.00 0.00 0.00 0.00 53.44 52.75 3hcr n ALA 336 Cb 0.36 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.65 3hcr n ALA 336 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 3hcr s PHE 337 N -0.31 -0.09 -1.56 0.00 2.19 -1.26 -4.72 117.98 112.23 3hcr s PHE 337 Ca 0.00 0.39 0.00 0.00 0.33 0.00 0.00 56.93 57.65 3hcr s PHE 337 Cb 0.00 -0.37 0.00 0.00 -1.31 0.00 0.00 43.02 41.34 3hcr s PHE 337 CO 0.00 -0.30 0.77 0.25 1.83 0.00 0.00 175.22 177.76 3hcr n THR 338 N 5.31 0.00 -3.93 0.12 -2.24 -1.26 -4.85 114.28 107.43 3hcr n THR 338 Ca -0.04 0.00 -0.08 0.00 -2.27 0.00 0.00 64.05 61.65 3hcr n THR 338 Cb 0.50 -0.22 -0.08 0.00 -2.10 0.00 0.00 70.33 68.43 3hcr n THR 338 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3hcr s SER 339 N -0.58 0.22 0.35 3.42 1.04 -1.26 -3.44 113.70 113.45 3hcr s SER 339 Ca 0.00 -0.76 -0.27 0.00 0.48 0.00 0.00 55.95 55.39 3hcr s SER 339 Cb 0.00 0.31 -0.12 0.00 0.10 0.00 0.00 66.02 66.31 3hcr s SER 339 CO 0.00 -0.70 1.22 0.47 0.98 0.00 0.00 173.24 175.20 3hcr n ASP 340 N -0.02 2.36 -2.69 7.02 8.00 -1.26 -5.00 116.55 124.95 3hcr n ASP 340 Ca -0.14 1.17 -0.13 0.00 0.71 0.00 0.00 54.79 56.40 3hcr n ASP 340 Cb 0.62 -1.44 -0.03 0.00 -0.02 0.00 0.00 41.12 40.25 3hcr n ASP 340 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3hcr n HIS 341 N 0.17 -1.18 -1.80 1.24 1.44 -1.26 -4.76 115.22 109.06 3hcr n HIS 341 Ca 0.06 -2.02 -0.42 0.00 -2.01 0.00 0.00 57.72 53.34 3hcr n HIS 341 Cb 0.36 0.43 -0.02 0.00 0.12 0.00 0.00 29.99 30.88 3hcr n HIS 341 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 3hcr s ILE 342 N -2.81 2.12 0.72 0.61 1.01 -1.26 -5.00 121.20 116.60 3hcr s ILE 342 Ca 0.26 0.10 -0.04 0.00 0.00 0.00 0.00 60.65 60.97 3hcr s ILE 342 Cb -0.00 -3.07 0.15 0.00 0.01 0.00 0.00 42.46 39.55 3hcr s ILE 342 CO 0.18 0.02 0.99 -0.62 0.00 0.00 0.00 174.94 175.51 3hcr n GLU 343 N 2.33 -0.31 -2.17 2.79 1.02 -1.26 -5.02 120.64 118.01 3hcr n GLU 343 Ca 0.09 -2.37 -0.26 0.00 -0.02 0.00 0.00 57.16 54.59 3hcr n GLU 343 Cb 0.37 -0.76 0.09 0.00 -0.02 0.00 0.00 31.44 31.13 3hcr n GLU 343 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 3hcr s THR 344 N -3.02 2.20 0.26 2.62 -4.23 -1.26 -4.89 115.64 107.32 3hcr s THR 344 Ca 0.63 -0.24 -0.03 0.00 -1.18 0.00 0.00 61.69 60.87 3hcr s THR 344 Cb -0.03 -2.96 0.27 0.00 1.34 0.00 0.00 72.50 71.12 3hcr s THR 344 CO 0.42 0.00 1.88 0.25 -0.54 0.00 0.00 174.62 176.63 3hcr h LEU 345 N -0.77 1.01 0.00 4.79 5.85 -1.98 -2.05 115.31 122.17 3hcr h LEU 345 Ca -0.44 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.29 3hcr h LEU 345 Cb 1.30 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 42.13 3hcr h LEU 345 CO 0.56 0.64 0.00 -1.22 -0.34 0.00 0.00 178.44 178.08 3hcr n TYR 346 N -4.52 0.00 -0.09 1.25 4.02 -1.26 -2.14 117.16 114.41 3hcr n TYR 346 Ca 0.15 0.00 -0.12 0.00 -0.01 0.00 0.00 57.90 57.92 3hcr n TYR 346 Cb 0.19 -0.27 -0.15 0.00 -0.02 0.00 0.00 39.34 39.09 3hcr n TYR 346 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 176.86 176.24 3hcr n GLU 347 N -1.27 0.68 0.00 -0.72 1.02 -0.85 -4.68 120.64 114.82 3hcr n GLU 347 Ca 0.15 0.08 0.00 0.00 -0.02 0.00 0.00 57.16 57.37 3hcr n GLU 347 Cb 0.23 -1.57 0.00 0.00 -0.02 0.00 0.00 31.44 30.08 3hcr n GLU 347 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 3hcr n LEU 348 N -2.94 0.62 -4.51 -4.62 4.77 -0.83 -4.91 117.00 104.58 3hcr n LEU 348 Ca -0.33 0.03 -0.51 0.00 -0.03 0.00 0.00 56.01 55.17 3hcr n LEU 348 Cb 1.10 -0.11 -0.07 0.00 -2.33 0.00 0.00 43.42 42.02 3hcr n LEU 348 CO 0.40 -0.11 1.72 -0.67 -1.33 0.00 0.00 177.39 177.39 3hcr n ASP 349 N -1.48 2.35 0.21 -1.43 -0.08 -0.91 -4.84 116.55 110.37 3hcr n ASP 349 Ca 0.00 0.54 0.09 0.00 -1.51 0.00 0.00 54.79 53.91 3hcr n ASP 349 Cb 0.00 -1.27 0.35 0.00 2.34 0.00 0.00 41.12 42.54 3hcr n ASP 349 CO 0.00 0.00 0.00 -0.29 0.12 0.00 0.00 177.20 177.03 3hcr h ILE 350 N 6.71 0.56 -0.51 5.18 2.10 -1.91 -3.03 117.51 126.60 3hcr h ILE 350 Ca -0.32 -1.32 -0.09 0.00 1.08 0.00 0.00 64.86 64.21 3hcr h ILE 350 Cb 1.31 1.91 -0.02 0.00 -1.09 0.00 0.00 36.82 38.93 3hcr h ILE 350 CO 1.00 0.25 -0.06 -0.33 -1.08 0.00 0.00 178.15 177.94 3hcr h GLU 351 N 0.00 0.91 -0.01 2.19 5.08 -1.95 -2.98 114.58 117.82 3hcr h GLU 351 Ca -0.00 -0.29 -0.21 0.00 -1.00 0.00 0.00 59.36 57.86 3hcr h GLU 351 Cb 0.89 -0.08 0.02 0.00 0.50 0.00 0.00 28.75 30.08 3hcr h GLU 351 CO 0.03 0.94 -0.81 1.88 -1.00 0.00 0.00 179.01 180.05 3hcr h TYR 352 N 0.83 0.83 -0.59 4.33 0.05 -1.89 -3.04 116.97 117.49 3hcr h TYR 352 Ca 0.14 -0.45 0.09 0.00 0.05 0.00 0.00 58.73 58.57 3hcr h TYR 352 Cb 0.57 -0.10 -0.04 0.00 1.01 0.00 0.00 36.73 38.18 3hcr h TYR 352 CO 0.03 1.27 0.40 0.66 -1.05 0.00 0.00 178.16 179.47 3hcr h SER 353 N 0.15 0.37 -0.02 3.88 4.64 -1.52 -1.10 113.55 119.94 3hcr h SER 353 Ca -0.10 0.01 -0.08 0.00 -0.47 0.00 0.00 61.79 61.14 3hcr h SER 353 Cb 1.49 -0.07 0.01 0.00 -0.31 0.00 0.00 62.40 63.52 3hcr h SER 353 CO 0.16 0.22 -0.32 1.56 -0.87 0.00 0.00 176.83 177.59 3hcr h GLN 354 N 0.41 0.24 -0.34 4.77 4.20 -1.57 -0.98 115.11 121.84 3hcr h GLN 354 Ca 0.27 -0.24 0.05 0.00 0.06 0.00 0.00 58.65 58.80 3hcr h GLN 354 Cb 0.52 0.06 -0.05 0.00 0.30 0.00 0.00 27.48 28.32 3hcr h GLN 354 CO -0.07 0.94 0.06 0.28 -0.67 0.00 0.00 178.83 179.36 3hcr h VAL 355 N -0.37 0.82 -0.35 -0.54 2.07 -1.33 -1.11 116.25 115.44 3hcr h VAL 355 Ca -0.04 -0.06 0.01 0.00 0.82 0.00 0.00 66.70 67.44 3hcr h VAL 355 Cb 1.04 0.63 -0.02 0.00 -1.52 0.00 0.00 31.29 31.41 3hcr h VAL 355 CO 0.06 0.03 0.20 0.25 0.02 0.00 0.00 177.57 178.14 3hcr h LEU 356 N 0.17 0.33 -1.97 2.57 5.85 -1.26 0.23 115.31 121.23 3hcr h LEU 356 Ca 0.16 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.87 3hcr h LEU 356 Cb 0.19 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 41.15 3hcr h LEU 356 CO -0.22 0.24 -0.06 0.00 -0.34 0.00 0.00 178.44 178.06 3hcr h ALA 357 N 1.15 1.79 0.00 1.25 0.00 -0.44 -2.66 119.26 120.35 3hcr h ALA 357 Ca 0.14 -0.05 -0.28 0.00 0.00 0.00 0.00 54.91 54.71 3hcr h ALA 357 Cb -0.00 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.72 3hcr h ALA 357 CO -0.06 0.07 -2.13 1.63 0.00 0.00 0.00 179.25 178.77 3hcr n LYS 358 N -4.30 1.19 0.06 0.00 4.76 -0.49 -1.96 118.16 117.42 3hcr n LYS 358 Ca -0.03 -0.02 -0.06 0.00 -2.87 0.00 0.00 58.31 55.33 3hcr n LYS 358 Cb 0.14 -1.43 0.13 0.00 -1.84 0.00 0.00 35.03 32.03 3hcr n LYS 358 CO 0.00 0.00 0.00 0.93 -1.37 0.00 0.00 177.40 176.96 3hcr h GLU 359 N 0.00 0.35 -0.09 1.97 5.08 -0.55 -3.35 114.58 117.99 3hcr h GLU 359 Ca -0.42 -0.21 -0.19 0.00 -1.00 0.00 0.00 59.36 57.54 3hcr h GLU 359 Cb 1.93 0.02 -0.38 0.00 0.50 0.00 0.00 28.75 30.83 3hcr h GLU 359 CO 0.02 0.79 -1.01 0.00 -1.00 0.00 0.00 179.01 177.80 3hcr n GLY 361 N 0.22 0.06 3.78 0.00 0.00 -0.83 -4.80 105.19 103.62 3hcr n GLY 361 Ca 0.04 0.36 -0.39 0.00 0.00 0.00 0.00 46.02 46.04 3hcr n GLY 361 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hcr s VAL 362 N -0.47 4.73 0.00 1.61 0.11 -1.20 -4.87 120.40 120.31 3hcr s VAL 362 Ca 0.12 1.36 0.00 0.00 -2.93 0.00 0.00 61.98 60.53 3hcr s VAL 362 Cb -0.01 -3.98 0.00 0.00 -1.53 0.00 0.00 36.38 30.86 3hcr s VAL 362 CO 0.27 0.48 0.00 -0.62 -3.33 0.00 0.00 175.10 171.91 3hcr n GLU 363 N 2.14 0.00 -4.39 1.54 1.02 -1.03 -4.85 120.64 115.07 3hcr n GLU 363 Ca -0.08 0.24 -0.23 0.00 -0.02 0.00 0.00 57.16 57.08 3hcr n GLU 363 Cb 0.50 -0.70 -0.16 0.00 -0.02 0.00 0.00 31.44 31.06 3hcr n GLU 363 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 3hcr s ASN 364 N -2.77 1.44 -0.21 1.62 0.02 -1.00 -5.02 114.94 109.02 3hcr s ASN 364 Ca 0.00 -0.23 0.01 0.00 -1.02 0.00 0.00 52.86 51.62 3hcr s ASN 364 Cb 0.00 -0.67 0.05 0.00 0.02 0.00 0.00 41.25 40.65 3hcr s ASN 364 CO 0.00 -0.01 -0.07 -0.63 0.02 0.00 0.00 177.10 176.41 3hcr s ILE 365 N 0.79 1.49 0.16 0.60 1.01 -1.26 -0.70 121.20 123.30 3hcr s ILE 365 Ca -0.13 -1.02 0.08 0.00 0.00 0.00 0.00 60.65 59.58 3hcr s ILE 365 Cb -0.15 -1.66 -0.04 0.00 0.01 0.00 0.00 42.46 40.61 3hcr s ILE 365 CO 0.02 0.05 -0.17 -0.13 0.00 0.00 0.00 174.94 174.71 3hcr s ARG 366 N 1.44 1.25 -0.14 2.79 0.52 -0.53 -5.01 118.95 119.27 3hcr s ARG 366 Ca -0.03 -1.41 0.02 0.00 -0.52 0.00 0.00 55.73 53.80 3hcr s ARG 366 Cb -0.17 -1.24 0.01 0.00 0.52 0.00 0.00 34.95 34.06 3hcr s ARG 366 CO -0.07 0.24 -0.21 0.50 0.02 0.00 0.00 175.30 175.78 3hcr s ARG 367 N -2.89 3.06 0.81 3.54 3.52 -1.26 0.39 118.95 126.12 3hcr s ARG 367 Ca 0.16 -0.84 -0.12 0.00 -0.13 0.00 0.00 55.73 54.80 3hcr s ARG 367 Cb -0.05 -2.46 0.09 0.00 -1.56 0.00 0.00 34.95 30.96 3hcr s ARG 367 CO 0.06 -0.00 1.17 0.00 -0.81 0.00 0.00 175.30 175.72 3hcr s ALA 368 N 0.80 1.87 0.61 6.12 0.00 -0.14 -4.95 121.76 126.06 3hcr s ALA 368 Ca -0.07 0.69 -0.17 0.00 0.00 0.00 0.00 51.96 52.41 3hcr s ALA 368 Cb -0.16 -3.44 -0.03 0.00 0.00 0.00 0.00 23.12 19.50 3hcr s ALA 368 CO -0.01 -2.23 1.11 -1.21 0.00 0.00 0.00 175.76 173.42 3hcr s GLU 369 N -4.34 3.08 0.42 0.00 2.02 -1.26 -4.74 118.70 113.88 3hcr s GLU 369 Ca 0.70 1.45 -0.21 0.00 0.02 0.00 0.00 54.97 56.92 3hcr s GLU 369 Cb -0.25 -1.98 -0.11 0.00 0.10 0.00 0.00 34.13 31.89 3hcr s GLU 369 CO 0.52 -1.04 0.95 -1.12 0.02 0.00 0.00 175.26 174.59 3hcr s SER 370 N -2.30 6.97 -1.02 -0.19 0.01 -1.26 -4.88 113.70 111.03 3hcr s SER 370 Ca 0.69 1.70 -0.14 0.00 1.31 0.00 0.00 55.95 59.50 3hcr s SER 370 Cb -0.21 -2.54 -0.08 0.00 0.21 0.00 0.00 66.02 63.39 3hcr s SER 370 CO 0.35 -0.34 2.14 0.18 0.41 0.00 0.00 173.24 175.99 3hcr n LEU 371 N -0.54 5.30 0.00 2.44 4.77 -1.22 -4.59 117.00 123.15 3hcr n LEU 371 Ca 0.07 -3.25 0.00 0.00 -0.03 0.00 0.00 56.01 52.80 3hcr n LEU 371 Cb 0.54 -1.24 0.00 0.00 -2.33 0.00 0.00 43.42 40.38 3hcr n LEU 371 CO 0.38 0.45 0.01 0.59 -1.33 0.00 0.00 177.39 177.48 3hcr n ASN 372 N 5.79 0.00 -0.74 -1.43 3.02 -1.25 -4.74 115.26 115.91 3hcr n ASN 372 Ca 0.51 0.05 0.10 0.00 -0.03 0.00 0.00 54.58 55.22 3hcr n ASN 372 Cb 0.29 -0.04 0.06 0.00 -0.61 0.00 0.00 39.78 39.49 3hcr n ASN 372 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3hcr n GLY 373 N 2.37 0.52 3.71 7.41 0.00 -1.26 -4.83 105.19 113.11 3hcr n GLY 373 Ca 0.00 -0.60 -0.59 0.00 0.00 0.00 0.00 46.02 44.84 3hcr n GLY 373 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3hcr n ASN 374 N 0.87 2.21 0.10 1.61 4.05 -1.26 -4.81 115.26 118.02 3hcr n ASN 374 Ca 0.11 1.09 0.05 0.00 0.45 0.00 0.00 54.58 56.28 3hcr n ASN 374 Cb 0.50 -1.11 0.49 0.00 1.23 0.00 0.00 39.78 40.89 3hcr n ASN 374 CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 177.26 175.76 3hcr h PRO 375 N 6.85 0.33 0.00 1.20 0.13 -2.00 0.03 132.00 138.55 3hcr h PRO 375 Ca -0.46 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 3hcr h PRO 375 Cb 1.33 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.38 3hcr h PRO 375 CO 0.96 0.24 0.00 -0.11 -0.23 0.00 0.00 178.00 178.86 3hcr n LEU 376 N -4.48 0.55 -0.02 1.56 7.94 -1.26 -1.00 117.00 120.30 3hcr n LEU 376 Ca 0.01 0.73 -0.17 0.00 -1.11 0.00 0.00 56.01 55.47 3hcr n LEU 376 Cb 0.09 -0.76 -0.14 0.00 0.53 0.00 0.00 43.42 43.14 3hcr n LEU 376 CO 0.35 -0.85 0.23 0.15 -1.11 0.00 0.00 177.39 176.17 3hcr h PHE 377 N 0.00 0.25 -0.97 1.96 -0.00 -1.32 -2.35 116.94 114.50 3hcr h PHE 377 Ca 0.00 -0.18 0.11 0.00 -0.00 0.00 0.00 57.97 57.90 3hcr h PHE 377 Cb 0.08 -0.01 -0.08 0.00 -0.00 0.00 0.00 35.95 35.94 3hcr h PHE 377 CO 0.00 1.14 0.60 0.77 -0.00 0.00 0.00 178.31 180.82 3hcr h SER 378 N -0.71 0.89 0.40 0.41 0.02 -1.08 0.62 113.55 114.10 3hcr h SER 378 Ca -0.06 0.04 -0.05 0.00 -0.84 0.00 0.00 61.79 60.88 3hcr h SER 378 Cb 1.29 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 63.69 3hcr h SER 378 CO 0.07 0.49 -0.24 0.50 -1.14 0.00 0.00 176.83 176.50 3hcr h LYS 379 N 0.97 0.00 -0.05 3.45 3.64 -1.26 -0.09 116.57 123.23 3hcr h LYS 379 Ca 0.47 0.00 -0.10 0.00 -1.27 0.00 0.00 60.65 59.75 3hcr h LYS 379 Cb 0.43 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.26 3hcr h LYS 379 CO -0.25 0.24 -0.37 0.00 -2.27 0.00 0.00 179.45 176.80 3hcr h ALA 380 N 1.76 0.12 -0.76 5.00 0.00 0.62 -1.66 119.26 124.33 3hcr h ALA 380 Ca -0.00 -0.47 0.03 0.00 0.00 0.00 0.00 54.91 54.46 3hcr h ALA 380 Cb 0.51 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.25 3hcr h ALA 380 CO 0.03 0.21 0.49 -0.07 0.00 0.00 0.00 179.25 179.91 3hcr h LEU 381 N -0.17 0.81 -0.26 0.00 3.38 -0.03 -1.91 115.31 117.14 3hcr h LEU 381 Ca -0.03 -0.01 -0.20 0.00 0.09 0.00 0.00 57.88 57.73 3hcr h LEU 381 Cb 1.04 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.61 3hcr h LEU 381 CO 0.07 0.57 -0.66 0.00 0.09 0.00 0.00 178.44 178.51 3hcr h ALA 382 N 1.31 0.42 -0.02 1.53 0.00 -1.07 -2.76 119.26 118.67 3hcr h ALA 382 Ca 0.30 -0.56 -0.04 0.00 0.00 0.00 0.00 54.91 54.61 3hcr h ALA 382 Cb -0.02 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 3hcr h ALA 382 CO -0.10 0.69 -0.16 0.22 0.00 0.00 0.00 179.25 179.90 3hcr h ASP 383 N 0.57 0.03 -0.03 0.00 3.58 -1.01 -1.45 116.42 118.11 3hcr h ASP 383 Ca -0.02 -0.01 -0.02 0.00 0.42 0.00 0.00 57.03 57.40 3hcr h ASP 383 Cb 1.27 -0.01 0.00 0.00 1.72 0.00 0.00 39.33 42.31 3hcr h ASP 383 CO 0.14 0.20 -0.06 -0.07 -2.88 0.00 0.00 179.24 176.56 3hcr h LEU 384 N 0.04 0.11 -0.52 2.28 3.38 -1.24 -1.95 115.31 117.40 3hcr h LEU 384 Ca 0.01 -0.57 -0.00 0.00 0.09 0.00 0.00 57.88 57.41 3hcr h LEU 384 Cb 0.30 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 40.99 3hcr h LEU 384 CO 0.02 0.66 0.32 0.58 0.09 0.00 0.00 178.44 180.11 3hcr h VAL 385 N -0.43 1.16 0.19 1.22 2.07 -1.32 0.03 116.25 119.17 3hcr h VAL 385 Ca 0.00 -0.34 -0.00 0.00 0.82 0.00 0.00 66.70 67.18 3hcr h VAL 385 Cb 0.64 0.43 -0.01 0.00 -1.52 0.00 0.00 31.29 30.84 3hcr h VAL 385 CO 0.01 0.16 -0.15 -0.74 0.02 0.00 0.00 177.57 176.88 3hcr h HIS 386 N 0.71 -0.38 -0.86 1.57 -0.00 -1.31 0.24 115.15 115.12 3hcr h HIS 386 Ca 0.19 -0.00 0.02 0.00 -0.00 0.00 0.00 60.37 60.58 3hcr h HIS 386 Cb -0.02 0.14 -0.05 0.00 -0.00 0.00 0.00 27.41 27.48 3hcr h HIS 386 CO -0.03 -0.23 0.57 0.77 -0.00 0.00 0.00 177.93 179.01 3hcr h SER 387 N -0.35 0.95 -0.22 3.26 0.02 -1.19 -1.82 113.55 114.21 3hcr h SER 387 Ca -0.01 -0.02 -0.00 0.00 -0.84 0.00 0.00 61.79 60.92 3hcr h SER 387 Cb 0.31 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.61 3hcr h SER 387 CO -0.00 0.67 0.12 -0.74 -1.14 0.00 0.00 176.83 175.74 3hcr h HIS 388 N 1.11 0.30 -0.50 3.45 6.17 -0.53 -2.00 115.15 123.16 3hcr h HIS 388 Ca 0.33 -0.01 -0.05 0.00 0.71 0.00 0.00 60.37 61.35 3hcr h HIS 388 Cb -0.05 -0.10 -0.02 0.00 2.52 0.00 0.00 27.41 29.76 3hcr h HIS 388 CO -0.00 0.26 0.11 0.82 0.71 0.00 0.00 177.93 179.83 3hcr h ILE 389 N 0.25 1.22 0.00 6.26 2.04 -0.42 -2.89 117.51 123.96 3hcr h ILE 389 Ca 0.08 -0.79 0.00 0.00 1.00 0.00 0.00 64.86 65.15 3hcr h ILE 389 Cb 0.05 0.71 0.00 0.00 -0.74 0.00 0.00 36.82 36.85 3hcr h ILE 389 CO -0.01 0.29 -0.24 0.00 0.00 0.00 0.00 178.15 178.18 3hcr n GLN 390 N -4.28 0.23 0.11 2.37 6.02 -0.73 -3.43 117.38 117.67 3hcr n GLN 390 Ca 0.03 0.14 0.07 0.00 -0.01 0.00 0.00 57.00 57.23 3hcr n GLN 390 Cb 0.22 -1.71 0.01 0.00 1.02 0.00 0.00 30.24 29.78 3hcr n GLN 390 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 3hcr h SER 391 N 0.00 0.00 -0.01 1.08 4.64 -1.18 -3.48 113.55 114.60 3hcr h SER 391 Ca 0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3hcr h SER 391 Cb 0.70 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.79 3hcr h SER 391 CO 0.00 0.24 -0.00 0.59 -0.87 0.00 0.00 176.83 176.78 3hcr n ASN 392 N -2.90 -4.58 -4.79 4.97 4.13 -1.11 -5.00 115.26 105.99 3hcr n ASN 392 Ca -0.02 0.00 -0.33 0.00 1.68 0.00 0.00 54.58 55.91 3hcr n ASN 392 Cb 0.65 -2.09 0.01 0.00 -1.54 0.00 0.00 39.78 36.82 3hcr n ASN 392 CO 0.00 0.00 0.00 -1.83 0.28 0.00 0.00 177.26 175.71 3hcr s GLU 393 N -1.08 3.23 -0.01 3.52 -1.05 -1.26 -4.96 118.70 117.08 3hcr s GLU 393 Ca 0.00 1.37 0.22 0.00 -0.15 0.00 0.00 54.97 56.41 3hcr s GLU 393 Cb 0.00 -2.01 -0.29 0.00 -0.44 0.00 0.00 34.13 31.39 3hcr s GLU 393 CO 0.00 -0.91 0.52 1.28 0.95 0.00 0.00 175.26 177.11 3hcr n LEU 394 N -1.85 0.11 -3.66 1.83 4.77 -1.26 -4.74 117.00 112.20 3hcr n LEU 394 Ca 0.10 0.04 -0.00 0.00 -0.03 0.00 0.00 56.01 56.12 3hcr n LEU 394 Cb 0.52 0.02 -0.01 0.00 -2.33 0.00 0.00 43.42 41.63 3hcr n LEU 394 CO 0.45 0.01 0.96 0.00 -1.33 0.00 0.00 177.39 177.48 3hcr s SER 396 N -2.95 5.64 0.34 0.00 1.04 -1.26 -4.93 113.70 111.58 3hcr s SER 396 Ca 0.13 1.64 0.02 0.00 0.48 0.00 0.00 55.95 58.23 3hcr s SER 396 Cb 0.03 -2.50 0.62 0.00 0.10 0.00 0.00 66.02 64.27 3hcr s SER 396 CO -0.02 -1.26 1.99 0.50 0.98 0.00 0.00 173.24 175.43 3hcr h LYS 397 N -0.30 0.86 -0.11 4.02 1.63 -2.01 -2.19 116.57 118.47 3hcr h LYS 397 Ca -0.45 -0.05 0.03 0.00 -0.85 0.00 0.00 60.65 59.33 3hcr h LYS 397 Cb 1.21 -0.19 -0.00 0.00 -0.60 0.00 0.00 32.23 32.64 3hcr h LYS 397 CO 0.58 0.57 0.10 1.96 -3.45 0.00 0.00 179.45 179.21 3hcr h GLN 398 N 0.89 0.00 0.00 1.90 1.08 -1.95 -1.03 115.11 116.00 3hcr h GLN 398 Ca 0.26 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.46 3hcr h GLN 398 Cb -0.04 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.39 3hcr h GLN 398 CO -0.06 0.00 -0.01 1.25 -0.95 0.00 0.00 178.83 179.06 3hcr h LEU 399 N 0.00 0.00 0.00 1.46 5.85 -1.76 -2.76 115.31 118.10 3hcr h LEU 399 Ca 0.05 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.77 3hcr h LEU 399 Cb 0.25 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.28 3hcr h LEU 399 CO -0.00 0.01 0.00 0.35 -0.34 0.00 0.00 178.44 178.46 3hcr n THR 400 N -3.10 0.36 -4.04 1.05 -2.24 -0.39 -4.60 114.28 101.32 3hcr n THR 400 Ca 0.01 0.09 -0.34 0.00 -2.27 0.00 0.00 64.05 61.55 3hcr n THR 400 Cb 0.36 -0.72 -0.15 0.00 -2.10 0.00 0.00 70.33 67.72 3hcr n THR 400 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 3hcr s LEU 401 N -2.71 2.46 0.50 3.22 2.96 -1.04 -5.12 118.68 118.94 3hcr s LEU 401 Ca 0.18 -0.61 -0.08 0.00 -0.22 0.00 0.00 54.13 53.40 3hcr s LEU 401 Cb 0.15 -1.57 -0.04 0.00 0.50 0.00 0.00 46.19 45.22 3hcr s LEU 401 CO 0.36 -0.02 0.84 -0.44 -1.32 0.00 0.00 176.35 175.78 3hcr s SER 402 N 1.34 6.32 0.46 3.68 0.01 -1.26 -5.01 113.70 119.25 3hcr s SER 402 Ca 0.05 1.10 -0.23 0.00 1.31 0.00 0.00 55.95 58.18 3hcr s SER 402 Cb -0.14 -2.32 -0.10 0.00 0.21 0.00 0.00 66.02 63.67 3hcr s SER 402 CO -0.09 -0.61 0.87 0.00 0.41 0.00 0.00 173.24 173.82 3hcr h PRO 404 N 1.14 0.80 -0.65 0.00 0.11 -1.82 -2.77 132.00 128.81 3hcr h PRO 404 Ca -0.44 -0.05 -0.45 0.00 0.11 0.00 0.00 66.00 65.17 3hcr h PRO 404 Cb 1.36 -0.18 -0.29 0.00 0.11 0.00 0.00 31.00 32.00 3hcr h PRO 404 CO 0.54 0.53 -0.26 1.28 -0.21 0.00 0.00 178.00 179.88 3hcr n LEU 405 N -4.63 5.16 -4.76 2.35 4.77 -0.80 -5.05 117.00 114.05 3hcr n LEU 405 Ca 0.20 -4.36 -0.41 0.00 -0.03 0.00 0.00 56.01 51.41 3hcr n LEU 405 Cb 0.46 -0.56 -0.02 0.00 -2.33 0.00 0.00 43.42 40.97 3hcr n LEU 405 CO 0.27 1.72 1.10 0.00 -1.33 0.00 0.00 177.39 179.15 3hcr n VAL 407 N 1.65 0.87 -3.77 0.00 0.24 -1.26 -4.97 118.33 111.09 3hcr n VAL 407 Ca 0.04 -1.37 -0.36 0.00 -2.04 0.00 0.00 64.34 60.61 3hcr n VAL 407 Cb 0.40 0.30 -0.11 0.00 -1.47 0.00 0.00 33.84 32.95 3hcr n VAL 407 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 3hcr s ASN 408 N -2.10 5.25 0.38 -1.34 3.84 -1.26 -4.98 114.94 114.74 3hcr s ASN 408 Ca 0.23 -2.12 0.21 0.00 0.21 0.00 0.00 52.86 51.38 3hcr s ASN 408 Cb 0.22 -1.83 1.12 0.00 -0.55 0.00 0.00 41.25 40.22 3hcr s ASN 408 CO -0.04 -0.53 1.59 1.55 -2.79 0.00 0.00 177.10 176.88 3hcr h PRO 409 N 7.94 0.00 0.01 0.43 0.13 -2.02 -1.87 132.00 136.61 3hcr h PRO 409 Ca -0.12 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.82 3hcr h PRO 409 Cb 1.04 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.14 3hcr h PRO 409 CO 0.70 0.00 -0.90 0.28 -0.23 0.00 0.00 178.00 177.85 3hcr h VAL 410 N 0.00 1.61 -0.37 1.56 2.07 -2.00 -3.35 116.25 115.76 3hcr h VAL 410 Ca 0.00 -2.97 0.08 0.00 0.82 0.00 0.00 66.70 64.63 3hcr h VAL 410 Cb 0.31 2.62 -0.09 0.00 -1.52 0.00 0.00 31.29 32.62 3hcr h VAL 410 CO 0.00 0.85 -0.24 0.00 0.02 0.00 0.00 177.57 178.20 3hcr h ARG 412 N -0.19 0.00 -0.00 0.00 -0.00 -1.76 -1.19 114.38 111.24 3hcr h ARG 412 Ca 0.18 0.00 -0.24 0.00 -0.00 0.00 0.00 59.98 59.92 3hcr h ARG 412 Cb 0.47 0.00 0.01 0.00 -0.00 0.00 0.00 29.97 30.45 3hcr h ARG 412 CO -0.48 0.08 -0.97 0.93 -0.00 0.00 0.00 179.97 179.53 3hcr h GLU 413 N 0.00 0.49 -0.41 0.08 4.39 -1.25 -2.02 114.58 115.87 3hcr h GLU 413 Ca -0.00 -0.53 -0.11 0.00 0.34 0.00 0.00 59.36 59.06 3hcr h GLU 413 Cb 0.49 0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 29.28 3hcr h GLU 413 CO 0.01 1.17 -0.20 1.15 -1.16 0.00 0.00 179.01 179.98 3hcr h THR 414 N 0.28 1.27 0.85 1.13 2.02 -0.42 -1.22 112.91 116.82 3hcr h THR 414 Ca -0.09 -1.31 -0.04 0.00 0.77 0.00 0.00 66.41 65.74 3hcr h THR 414 Cb 1.61 1.17 0.00 0.00 -1.74 0.00 0.00 68.15 69.19 3hcr h THR 414 CO 0.17 0.44 -0.46 0.50 0.37 0.00 0.00 175.52 176.55 3hcr h LYS 415 N 0.70 -1.16 -0.71 6.66 3.64 -1.17 -2.73 116.57 121.80 3hcr h LYS 415 Ca 0.10 0.08 0.12 0.00 -1.27 0.00 0.00 60.65 59.68 3hcr h LYS 415 Cb 0.71 0.26 -0.05 0.00 -0.41 0.00 0.00 32.23 32.75 3hcr h LYS 415 CO 0.05 -0.77 0.47 0.77 -2.27 0.00 0.00 179.45 177.70 3hcr h SER 416 N -1.21 0.44 -0.50 4.20 0.02 -1.28 -1.64 113.55 113.60 3hcr h SER 416 Ca -0.12 0.02 0.06 0.00 -0.84 0.00 0.00 61.79 60.91 3hcr h SER 416 Cb 0.94 -0.07 -0.05 0.00 0.14 0.00 0.00 62.40 63.36 3hcr h SER 416 CO 0.16 0.25 0.21 0.15 -1.14 0.00 0.00 176.83 176.47 3hcr h PHE 417 N 0.48 0.38 0.19 3.45 3.57 -0.92 -0.50 116.94 123.60 3hcr h PHE 417 Ca 0.34 0.02 -0.31 0.00 3.53 0.00 0.00 57.97 61.55 3hcr h PHE 417 Cb 0.65 -0.10 0.02 0.00 2.79 0.00 0.00 35.95 39.31 3hcr h PHE 417 CO -0.00 0.16 -1.38 0.74 -2.23 0.00 0.00 178.31 175.60 3hcr h PHE 418 N 0.42 0.75 0.00 0.41 -1.00 -1.10 -3.27 116.94 113.15 3hcr h PHE 418 Ca 0.23 -0.55 0.00 0.00 2.81 0.00 0.00 57.97 60.46 3hcr h PHE 418 Cb 0.20 -0.03 0.00 0.00 3.61 0.00 0.00 35.95 39.73 3hcr h PHE 418 CO -0.13 1.43 0.00 1.79 -1.61 0.00 0.00 178.31 179.79 3hcr h THR 419 N 0.11 0.00 -0.02 -1.55 1.35 -1.28 -3.11 112.91 108.41 3hcr h THR 419 Ca -0.20 -0.57 0.00 0.00 -0.55 0.00 0.00 66.41 65.09 3hcr h THR 419 Cb 2.08 1.52 0.00 0.00 -1.73 0.00 0.00 68.15 70.01 3hcr h THR 419 CO 0.24 0.00 -0.03 -1.20 -0.25 0.00 0.00 175.52 174.28 3hcr n SER 420 N -2.76 1.96 -4.76 5.36 7.64 -0.20 -4.98 113.62 115.88 3hcr n SER 420 Ca 0.03 -1.62 -0.37 0.00 1.01 0.00 0.00 58.87 57.91 3hcr n SER 420 Cb 0.37 0.02 0.03 0.00 -1.01 0.00 0.00 64.21 63.62 3hcr n SER 420 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 3hcr s GLN 421 N -2.04 3.23 0.35 1.43 -1.52 -1.18 -4.96 119.66 114.97 3hcr s GLN 421 Ca 0.33 1.99 -0.28 0.00 -1.95 0.00 0.00 55.36 55.45 3hcr s GLN 421 Cb 0.20 -2.19 -0.11 0.00 -0.22 0.00 0.00 33.01 30.70 3hcr s GLN 421 CO 0.34 -1.04 1.43 -1.14 -0.25 0.00 0.00 175.29 174.62 3hcr s GLN 422 N -2.99 4.20 0.00 2.91 0.74 -1.26 -5.06 119.66 118.21 3hcr s GLN 422 Ca 0.72 2.44 0.00 0.00 0.05 0.00 0.00 55.36 58.56 3hcr s GLN 422 Cb -0.34 -3.01 0.00 0.00 1.10 0.00 0.00 33.01 30.75 3hcr s GLN 422 CO 0.40 -0.41 0.00 1.28 -0.55 0.00 0.00 175.29 176.01