#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2h4r n ILE -1 N 0.00 0.21 0.32 3.84 -5.35 -1.26 -4.09 119.36 113.03 2h4r n ILE -1 Ca 0.00 -0.24 0.19 0.00 -0.27 0.00 0.00 62.75 62.42 2h4r n ILE -1 Cb 0.00 0.13 1.06 0.00 -1.74 0.00 0.00 39.64 39.08 2h4r n ILE -1 CO 0.00 0.00 0.00 0.28 -1.76 0.00 0.00 176.55 175.07 2h4r h SER 0 N 0.00 0.00 -0.02 7.28 0.02 -1.96 -1.75 113.55 117.12 2h4r h SER 0 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2h4r h SER 0 Cb 0.73 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.27 2h4r h SER 0 CO 0.00 0.00 -0.35 1.15 -1.14 0.00 0.00 176.83 176.49 2h4r n MET 1 N -3.50 1.50 0.05 3.45 0.00 -1.26 -3.45 117.12 113.91 2h4r n MET 1 Ca -0.03 -1.04 -0.09 0.00 0.00 0.00 0.00 57.70 56.54 2h4r n MET 1 Cb 0.08 -1.39 -0.13 0.00 0.00 0.00 0.00 33.22 31.79 2h4r n MET 1 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 175.97 176.90 2h4r h GLU 2 N 2.44 0.06 -0.13 3.17 5.08 -1.52 -2.87 114.58 120.82 2h4r h GLU 2 Ca 0.00 -0.10 -0.02 0.00 -1.00 0.00 0.00 59.36 58.23 2h4r h GLU 2 Cb 0.69 0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.98 2h4r h GLU 2 CO 0.00 0.96 -0.01 1.96 -1.00 0.00 0.00 179.01 180.92 2h4r h GLN 3 N 0.02 0.24 -0.75 2.33 4.20 -1.69 -0.02 115.11 119.44 2h4r h GLN 3 Ca -0.09 -0.08 0.03 0.00 0.06 0.00 0.00 58.65 58.57 2h4r h GLN 3 Cb 1.86 -0.02 -0.05 0.00 0.30 0.00 0.00 27.48 29.57 2h4r h GLN 3 CO 0.14 0.50 0.48 0.28 -0.67 0.00 0.00 178.83 179.55 2h4r h VAL 4 N -0.05 1.11 -0.50 -0.54 2.07 -1.67 0.28 116.25 116.96 2h4r h VAL 4 Ca 0.04 -0.32 -0.07 0.00 0.82 0.00 0.00 66.70 67.16 2h4r h VAL 4 Cb 0.40 0.10 -0.02 0.00 -1.52 0.00 0.00 31.29 30.25 2h4r h VAL 4 CO 0.01 0.17 0.03 0.28 0.02 0.00 0.00 177.57 178.08 2h4r h SER 5 N 0.93 0.84 -0.02 0.57 0.02 -1.46 -1.90 113.55 112.52 2h4r h SER 5 Ca 0.30 -0.29 -0.00 0.00 -0.84 0.00 0.00 61.79 60.96 2h4r h SER 5 Cb 0.01 -0.22 -0.00 0.00 0.14 0.00 0.00 62.40 62.33 2h4r h SER 5 CO -0.11 0.92 0.01 0.00 -1.14 0.00 0.00 176.83 176.51 2h4r h ALA 6 N 0.95 0.03 -0.28 3.77 0.00 -0.55 -1.90 119.26 121.28 2h4r h ALA 6 Ca 0.14 -0.06 0.03 0.00 0.00 0.00 0.00 54.91 55.02 2h4r h ALA 6 Cb 0.47 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 2h4r h ALA 6 CO 0.02 -0.41 0.19 0.66 0.00 0.00 0.00 179.25 179.71 2h4r h SER 7 N -0.08 0.22 0.09 0.00 4.64 -0.43 -0.84 113.55 117.15 2h4r h SER 7 Ca 0.01 -0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2h4r h SER 7 Cb 0.12 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.16 2h4r h SER 7 CO -0.00 0.16 -0.04 0.40 -0.87 0.00 0.00 176.83 176.47 2h4r h ILE 8 N 0.26 1.15 -0.85 0.95 2.04 -1.12 0.38 117.51 120.32 2h4r h ILE 8 Ca 0.12 -1.20 0.06 0.00 1.00 0.00 0.00 64.86 64.84 2h4r h ILE 8 Cb 0.14 1.88 -0.05 0.00 -0.74 0.00 0.00 36.82 38.05 2h4r h ILE 8 CO -0.02 0.28 0.56 1.23 0.00 0.00 0.00 178.15 180.19 2h4r h GLY 9 N -0.71 1.22 0.55 5.37 0.00 -1.11 0.97 103.07 109.35 2h4r h GLY 9 Ca -0.01 -0.39 -0.01 0.00 0.00 0.00 0.00 47.33 46.92 2h4r h GLY 9 CO 0.02 0.29 -0.06 3.43 0.00 0.00 0.00 176.54 180.22 2h4r h ASN 10 N 0.96 -0.14 -0.79 0.19 4.21 -1.20 -3.03 115.58 115.79 2h4r h ASN 10 Ca 0.36 -0.35 0.15 0.00 1.21 0.00 0.00 56.30 57.68 2h4r h ASN 10 Cb 0.19 0.04 -0.10 0.00 -1.12 0.00 0.00 38.32 37.33 2h4r h ASN 10 CO -0.13 0.31 0.33 0.15 -1.29 0.00 0.00 177.43 176.79 2h4r h PHE 11 N -0.62 0.55 -0.26 1.19 3.57 0.64 -2.80 116.94 119.21 2h4r h PHE 11 Ca -0.02 0.04 0.04 0.00 3.53 0.00 0.00 57.97 61.56 2h4r h PHE 11 Cb 0.48 -0.13 -0.07 0.00 2.79 0.00 0.00 35.95 39.02 2h4r h PHE 11 CO 0.07 0.06 -0.55 1.15 -2.23 0.00 0.00 178.31 176.81 2h4r h THR 12 N 0.46 0.00 -0.39 4.41 2.02 0.98 0.93 112.91 121.32 2h4r h THR 12 Ca 0.44 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.62 2h4r h THR 12 Cb 0.69 0.00 -0.02 0.00 -1.74 0.00 0.00 68.15 67.08 2h4r h THR 12 CO -0.42 0.00 0.25 0.58 0.37 0.00 0.00 175.52 176.29 2h4r h VAL 13 N -0.49 1.11 -0.20 3.16 2.07 -1.39 0.15 116.25 120.66 2h4r h VAL 13 Ca 0.05 -0.23 0.01 0.00 0.82 0.00 0.00 66.70 67.35 2h4r h VAL 13 Cb 0.64 0.58 -0.02 0.00 -1.52 0.00 0.00 31.29 30.97 2h4r h VAL 13 CO -0.51 0.11 0.10 0.44 0.02 0.00 0.00 177.57 177.74 2h4r h ASP 14 N 0.52 0.16 -0.82 0.57 3.32 -1.27 0.27 116.42 119.17 2h4r h ASP 14 Ca 0.14 0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.19 2h4r h ASP 14 Cb -0.03 -0.03 -0.04 0.00 0.22 0.00 0.00 39.33 39.45 2h4r h ASP 14 CO -0.03 0.12 0.49 0.25 -1.72 0.00 0.00 179.24 178.35 2h4r h LEU 15 N 0.22 0.99 -0.29 1.55 5.85 -0.46 -0.67 115.31 122.50 2h4r h LEU 15 Ca 0.08 -0.07 0.01 0.00 0.84 0.00 0.00 57.88 58.74 2h4r h LEU 15 Cb 0.01 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 40.77 2h4r h LEU 15 CO -0.05 0.77 0.18 0.15 -0.34 0.00 0.00 178.44 179.15 2h4r h PHE 16 N 1.13 0.34 -0.71 1.25 3.57 -0.22 -2.58 116.94 119.71 2h4r h PHE 16 Ca 0.29 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.78 2h4r h PHE 16 Cb -0.04 -0.11 -0.03 0.00 2.79 0.00 0.00 35.95 38.56 2h4r h PHE 16 CO -0.00 0.21 0.36 -0.91 -2.23 0.00 0.00 178.31 175.73 2h4r h ASN 17 N 0.37 0.90 -0.55 0.41 2.35 0.39 0.30 115.58 119.75 2h4r h ASN 17 Ca 0.11 -0.09 -0.09 0.00 -0.55 0.00 0.00 56.30 55.68 2h4r h ASN 17 Cb -0.02 -0.23 -0.02 0.00 0.05 0.00 0.00 38.32 38.10 2h4r h ASN 17 CO -0.04 0.75 -0.01 0.11 -1.65 0.00 0.00 177.43 176.58 2h4r h LYS 18 N 1.00 1.01 0.02 0.81 1.79 -1.05 -2.94 116.57 117.21 2h4r h LYS 18 Ca 0.25 -0.32 -0.00 0.00 -2.18 0.00 0.00 60.65 58.40 2h4r h LYS 18 Cb 0.07 -0.09 0.00 0.00 -1.58 0.00 0.00 32.23 30.63 2h4r h LYS 18 CO -0.04 1.00 -0.01 -0.07 -1.08 0.00 0.00 179.45 179.26 2h4r h LEU 19 N 0.92 -0.02 -0.88 2.94 3.38 -1.05 -3.32 115.31 117.29 2h4r h LEU 19 Ca 0.16 -0.58 0.18 0.00 0.09 0.00 0.00 57.88 57.74 2h4r h LEU 19 Cb 0.56 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 41.20 2h4r h LEU 19 CO 0.03 0.58 0.42 -1.13 0.09 0.00 0.00 178.44 178.43 2h4r h ASN 20 N -0.62 0.45 0.64 -0.43 -1.24 -0.45 0.51 115.58 114.43 2h4r h ASN 20 Ca -0.00 0.12 -0.01 0.00 0.71 0.00 0.00 56.30 57.12 2h4r h ASN 20 Cb 0.59 0.07 -0.00 0.00 0.73 0.00 0.00 38.32 39.71 2h4r h ASN 20 CO 0.00 0.12 -0.04 1.05 -1.29 0.00 0.00 177.43 177.27 2h4r h GLU 21 N 0.52 0.00 0.00 6.67 4.11 -1.63 -3.26 114.58 120.99 2h4r h GLU 21 Ca 0.52 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.95 2h4r h GLU 21 Cb 0.86 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.11 2h4r h GLU 21 CO -0.44 0.04 0.00 2.41 0.07 0.00 0.00 179.01 181.09 2h4r n THR 22 N -3.21 0.00 -3.68 -1.06 -1.04 0.13 -4.81 114.28 100.61 2h4r n THR 22 Ca -0.01 0.39 -0.39 0.00 -2.04 0.00 0.00 64.05 62.01 2h4r n THR 22 Cb 0.25 -1.05 -0.11 0.00 -1.82 0.00 0.00 70.33 67.60 2h4r n THR 22 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 2h4r s ASN 23 N -2.25 5.46 0.00 8.00 2.20 -0.96 -4.94 114.94 122.45 2h4r s ASN 23 Ca 0.00 -1.60 0.29 0.00 -0.94 0.00 0.00 52.86 50.61 2h4r s ASN 23 Cb 0.00 -1.92 1.25 0.00 -2.00 0.00 0.00 41.25 38.58 2h4r s ASN 23 CO 0.00 -0.51 1.86 0.54 -2.94 0.00 0.00 177.10 176.06 2h4r n ARG 24 N 4.81 0.96 0.00 3.55 5.12 -1.24 -4.11 116.66 125.75 2h4r n ARG 24 Ca -0.09 -0.38 0.00 0.00 -1.93 0.00 0.00 57.85 55.46 2h4r n ARG 24 Cb 0.43 -1.49 0.00 0.00 -1.16 0.00 0.00 32.46 30.23 2h4r n ARG 24 CO 0.00 0.00 0.00 -0.40 -1.93 0.00 0.00 177.63 175.30 2h4r n ASP 25 N -0.69 1.25 -4.55 0.55 5.68 -1.26 -4.96 116.55 112.57 2h4r n ASP 25 Ca 0.17 -1.34 -0.26 0.00 -0.50 0.00 0.00 54.79 52.86 2h4r n ASP 25 Cb 0.27 0.00 -0.11 0.00 -1.14 0.00 0.00 41.12 40.15 2h4r n ASP 25 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 2h4r s LYS 26 N -0.34 1.82 0.25 0.11 1.02 -1.26 -4.89 119.74 116.46 2h4r s LYS 26 Ca 0.00 -1.95 -0.30 0.00 0.02 0.00 0.00 55.97 53.75 2h4r s LYS 26 Cb 0.00 -1.69 -0.09 0.00 -0.52 0.00 0.00 37.83 35.53 2h4r s LYS 26 CO 0.00 0.12 1.30 -0.80 -0.92 0.00 0.00 175.35 175.06 2h4r s ASN 27 N -3.61 6.87 -0.23 2.83 0.01 -1.26 -4.89 114.94 114.66 2h4r s ASN 27 Ca 0.33 2.49 -0.01 0.00 -0.71 0.00 0.00 52.86 54.96 2h4r s ASN 27 Cb 0.03 -2.62 0.02 0.00 0.41 0.00 0.00 41.25 39.09 2h4r s ASN 27 CO 0.16 -0.51 -0.09 -0.63 -1.51 0.00 0.00 177.10 174.53 2h4r s ILE 28 N -0.36 2.80 -0.12 0.60 1.01 -1.10 -4.99 121.20 119.05 2h4r s ILE 28 Ca 0.54 -0.91 -0.07 0.00 0.00 0.00 0.00 60.65 60.21 2h4r s ILE 28 Cb -0.37 -2.35 0.05 0.00 0.01 0.00 0.00 42.46 39.79 2h4r s ILE 28 CO 0.43 0.31 0.28 0.12 0.00 0.00 0.00 174.94 176.08 2h4r s PHE 29 N 1.34 -0.37 0.19 3.97 5.36 -1.26 0.28 117.98 127.49 2h4r s PHE 29 Ca 0.02 0.87 -0.19 0.00 -0.96 0.00 0.00 56.93 56.67 2h4r s PHE 29 Cb -0.15 0.10 0.04 0.00 -0.34 0.00 0.00 43.02 42.66 2h4r s PHE 29 CO -0.06 -0.24 0.56 -0.59 -1.46 0.00 0.00 175.22 173.44 2h4r s PHE 30 N 1.10 -0.25 -0.47 10.12 -0.12 -0.72 -4.72 117.98 122.92 2h4r s PHE 30 Ca -0.08 -0.08 -0.07 0.00 -0.05 0.00 0.00 56.93 56.65 2h4r s PHE 30 Cb -0.09 0.47 0.12 0.00 -0.63 0.00 0.00 43.02 42.90 2h4r s PHE 30 CO -0.08 -0.93 0.32 0.45 -0.05 0.00 0.00 175.22 174.93 2h4r s SER 31 N -2.84 5.57 0.48 1.98 0.15 -1.26 -1.83 113.70 115.96 2h4r s SER 31 Ca 0.07 -2.02 0.16 0.00 0.70 0.00 0.00 55.95 54.86 2h4r s SER 31 Cb -0.02 -1.96 1.15 0.00 -1.71 0.00 0.00 66.02 63.49 2h4r s SER 31 CO -0.05 -0.63 2.07 1.55 1.20 0.00 0.00 173.24 177.38 2h4r h PRO 32 N 8.24 0.00 -0.23 5.44 0.13 -1.82 -0.64 132.00 143.11 2h4r h PRO 32 Ca -0.17 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.87 2h4r h PRO 32 Cb 1.06 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.18 2h4r h PRO 32 CO 0.80 0.10 -0.20 2.35 -0.23 0.00 0.00 178.00 180.83 2h4r h TRP 33 N 0.00 0.64 -0.27 1.56 2.91 -1.66 -0.79 115.95 118.34 2h4r h TRP 33 Ca -0.00 -0.19 -0.02 0.00 1.13 0.00 0.00 58.89 59.81 2h4r h TRP 33 Cb 0.18 -0.14 -0.01 0.00 -0.51 0.00 0.00 29.16 28.68 2h4r h TRP 33 CO 0.00 0.86 0.08 1.03 -1.03 0.00 0.00 178.44 179.38 2h4r h SER 34 N 0.24 0.39 0.10 2.65 0.87 -1.67 -0.63 113.55 115.51 2h4r h SER 34 Ca 0.04 -0.21 -0.01 0.00 -1.23 0.00 0.00 61.79 60.39 2h4r h SER 34 Cb 0.74 -0.10 0.00 0.00 -0.44 0.00 0.00 62.40 62.60 2h4r h SER 34 CO 0.05 0.50 -0.05 0.40 -0.53 0.00 0.00 176.83 177.20 2h4r h ILE 35 N 0.27 1.00 -0.13 2.23 2.04 -1.17 -2.28 117.51 119.47 2h4r h ILE 35 Ca 0.09 -0.38 -0.01 0.00 1.00 0.00 0.00 64.86 65.55 2h4r h ILE 35 Cb 0.25 1.25 -0.01 0.00 -0.74 0.00 0.00 36.82 37.57 2h4r h ILE 35 CO -0.00 0.09 0.04 -1.28 0.00 0.00 0.00 178.15 177.00 2h4r h SER 36 N -0.32 0.19 0.05 1.72 0.87 -1.17 -1.72 113.55 113.18 2h4r h SER 36 Ca -0.01 -0.21 -0.01 0.00 -1.23 0.00 0.00 61.79 60.33 2h4r h SER 36 Cb 0.26 -0.05 -0.00 0.00 -0.44 0.00 0.00 62.40 62.17 2h4r h SER 36 CO 0.02 0.35 -0.03 0.77 -0.53 0.00 0.00 176.83 177.42 2h4r h SER 37 N 0.02 0.00 0.52 6.23 4.64 -1.13 -1.49 113.55 122.34 2h4r h SER 37 Ca 0.04 0.00 -0.29 0.00 -0.47 0.00 0.00 61.79 61.07 2h4r h SER 37 Cb 0.23 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.30 2h4r h SER 37 CO -0.00 0.03 -1.48 0.00 -0.87 0.00 0.00 176.83 174.50 2h4r h ALA 38 N 1.97 0.31 0.00 5.18 0.00 -1.14 -3.27 119.26 122.31 2h4r h ALA 38 Ca -0.00 -1.11 -0.04 0.00 0.00 0.00 0.00 54.91 53.76 2h4r h ALA 38 Cb 0.06 0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 2h4r h ALA 38 CO 0.00 1.18 -0.19 -0.07 0.00 0.00 0.00 179.25 180.18 2h4r h LEU 39 N 0.06 0.00 -1.21 0.00 3.38 -0.87 -2.62 115.31 114.05 2h4r h LEU 39 Ca -0.22 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.72 2h4r h LEU 39 Cb 1.99 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.71 2h4r h LEU 39 CO 0.15 0.19 0.22 0.00 0.09 0.00 0.00 178.44 179.10 2h4r h ALA 40 N 1.81 1.38 -0.75 1.53 0.00 -1.34 0.49 119.26 122.38 2h4r h ALA 40 Ca -0.00 -0.14 0.06 0.00 0.00 0.00 0.00 54.91 54.83 2h4r h ALA 40 Cb 0.78 -0.22 -0.06 0.00 0.00 0.00 0.00 17.79 18.29 2h4r h ALA 40 CO 0.02 0.47 0.45 -0.07 0.00 0.00 0.00 179.25 180.13 2h4r h LEU 41 N 0.77 0.69 0.06 0.00 4.07 -1.54 0.07 115.31 119.43 2h4r h LEU 41 Ca 0.19 0.02 -0.25 0.00 0.08 0.00 0.00 57.88 57.91 2h4r h LEU 41 Cb 0.14 -0.12 -0.02 0.00 1.08 0.00 0.00 40.66 41.74 2h4r h LEU 41 CO -0.02 0.45 -1.22 0.71 -1.08 0.00 0.00 178.44 177.28 2h4r h THR 42 N 0.83 1.49 -0.68 0.22 1.35 -1.32 -3.23 112.91 111.58 2h4r h THR 42 Ca 0.33 -3.15 -0.04 0.00 -0.55 0.00 0.00 66.41 63.00 2h4r h THR 42 Cb 0.15 2.84 -0.03 0.00 -1.73 0.00 0.00 68.15 69.38 2h4r h THR 42 CO -0.17 0.89 0.28 0.22 -0.25 0.00 0.00 175.52 176.49 2h4r h TYR 43 N 0.04 1.01 -0.61 4.73 3.20 0.13 -1.96 116.97 123.50 2h4r h TYR 43 Ca -0.11 -0.06 0.13 0.00 3.14 0.00 0.00 58.73 61.83 2h4r h TYR 43 Cb 1.90 -0.31 -0.03 0.00 1.54 0.00 0.00 36.73 39.83 2h4r h TYR 43 CO 0.03 0.77 0.41 1.25 -1.64 0.00 0.00 178.16 178.98 2h4r h LEU 44 N 0.98 0.25 -0.74 2.82 5.85 -1.00 -2.12 115.31 121.36 2h4r h LEU 44 Ca 0.23 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.96 2h4r h LEU 44 Cb 0.18 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.17 2h4r h LEU 44 CO -0.02 0.14 -0.39 0.00 -0.34 0.00 0.00 178.44 177.83 2h4r n ALA 45 N -2.56 3.37 -2.28 1.25 0.00 -0.78 -4.82 120.51 114.69 2h4r n ALA 45 Ca 0.11 -0.53 -0.34 0.00 0.00 0.00 0.00 53.44 52.67 2h4r n ALA 45 Cb 0.48 -0.95 -0.06 0.00 0.00 0.00 0.00 19.45 18.92 2h4r n ALA 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2h4r s ALA 46 N -2.50 3.50 0.29 0.00 0.00 -0.80 -1.05 121.76 121.19 2h4r s ALA 46 Ca 0.21 -0.07 0.10 0.00 0.00 0.00 0.00 51.96 52.19 2h4r s ALA 46 Cb 0.19 -2.60 -0.06 0.00 0.00 0.00 0.00 23.12 20.65 2h4r s ALA 46 CO 0.56 0.42 -0.13 0.15 0.00 0.00 0.00 175.76 176.75 2h4r s LYS 47 N -2.31 1.65 4.08 0.00 -0.14 0.86 -4.60 119.74 119.27 2h4r s LYS 47 Ca 0.43 -1.80 0.00 0.00 -1.36 0.00 0.00 55.97 53.25 2h4r s LYS 47 Cb -0.14 -1.54 0.00 0.00 -1.68 0.00 0.00 37.83 34.47 2h4r s LYS 47 CO 0.20 0.20 0.00 0.41 -0.76 0.00 0.00 175.35 175.39 2h4r n GLY 48 N -0.63 2.29 0.14 -3.33 0.00 -1.26 -2.38 105.19 100.02 2h4r n GLY 48 Ca -0.06 -0.38 0.13 0.00 0.00 0.00 0.00 46.02 45.72 2h4r n GLY 48 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2h4r h SER 49 N 7.03 0.00 -0.07 1.61 4.64 -1.98 -1.76 113.55 123.03 2h4r h SER 49 Ca 0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2h4r h SER 49 Cb 0.00 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2h4r h SER 49 CO 0.00 0.00 0.03 0.74 -0.87 0.00 0.00 176.83 176.73 2h4r h THR 50 N 0.00 1.11 -0.30 2.95 2.02 -1.83 -1.50 112.91 115.36 2h4r h THR 50 Ca 0.00 -0.32 -0.09 0.00 0.77 0.00 0.00 66.41 66.77 2h4r h THR 50 Cb 0.53 1.20 -0.02 0.00 -1.74 0.00 0.00 68.15 68.13 2h4r h THR 50 CO 0.00 0.09 -0.18 0.00 0.37 0.00 0.00 175.52 175.81 2h4r h ALA 51 N 0.91 1.13 -0.16 6.16 0.00 -1.08 -3.17 119.26 123.05 2h4r h ALA 51 Ca 0.02 -0.31 -0.11 0.00 0.00 0.00 0.00 54.91 54.52 2h4r h ALA 51 Cb 0.12 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.78 2h4r h ALA 51 CO -0.00 0.54 -0.32 -0.09 0.00 0.00 0.00 179.25 179.38 2h4r h ARG 52 N 0.49 0.50 -0.48 0.00 2.43 -1.21 -2.28 114.38 113.83 2h4r h ARG 52 Ca 0.08 -0.32 0.00 0.00 -0.81 0.00 0.00 59.98 58.93 2h4r h ARG 52 Cb 0.59 0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.16 2h4r h ARG 52 CO 0.04 0.93 0.30 0.93 -1.51 0.00 0.00 179.97 180.66 2h4r h GLU 53 N 0.13 0.63 0.27 0.20 5.08 -1.31 -1.03 114.58 118.54 2h4r h GLU 53 Ca 0.00 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.31 2h4r h GLU 53 Cb 0.92 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 30.03 2h4r h GLU 53 CO 0.07 0.43 -0.13 0.52 -1.00 0.00 0.00 179.01 178.90 2h4r h MET 54 N 0.65 -0.35 -0.85 2.33 2.86 -1.51 -2.38 114.93 115.68 2h4r h MET 54 Ca 0.17 0.02 0.22 0.00 -2.06 0.00 0.00 59.70 58.06 2h4r h MET 54 Cb -0.05 0.08 -0.05 0.00 0.06 0.00 0.00 31.60 31.65 2h4r h MET 54 CO -0.03 0.00 0.59 0.00 1.06 0.00 0.00 176.91 178.53 2h4r h ALA 55 N -0.40 2.55 0.03 6.32 0.00 -1.23 0.65 119.26 127.19 2h4r h ALA 55 Ca -0.04 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.79 2h4r h ALA 55 Cb 0.51 0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.34 2h4r h ALA 55 CO 0.06 -0.81 -0.31 0.93 0.00 0.00 0.00 179.25 179.12 2h4r h GLU 56 N 0.16 0.15 -0.27 0.00 5.08 -1.15 0.82 114.58 119.37 2h4r h GLU 56 Ca 0.42 -0.21 -0.16 0.00 -1.00 0.00 0.00 59.36 58.41 2h4r h GLU 56 Cb 1.41 0.07 -0.00 0.00 0.50 0.00 0.00 28.75 30.73 2h4r h GLU 56 CO -0.07 1.02 -0.49 -0.24 -1.00 0.00 0.00 179.01 178.23 2h4r h VAL 57 N -0.62 1.29 0.00 3.13 3.04 -1.02 -2.93 116.25 119.14 2h4r h VAL 57 Ca -0.05 -1.69 0.00 0.00 -1.01 0.00 0.00 66.70 63.96 2h4r h VAL 57 Cb 1.15 1.60 0.00 0.00 -2.01 0.00 0.00 31.29 32.04 2h4r h VAL 57 CO 0.06 0.54 0.00 0.18 -1.01 0.00 0.00 177.57 177.34 2h4r n LEU 58 N -4.01 0.33 -0.44 3.16 4.77 0.19 -4.73 117.00 116.27 2h4r n LEU 58 Ca -0.03 0.56 -0.05 0.00 -0.03 0.00 0.00 56.01 56.46 2h4r n LEU 58 Cb 0.58 -0.50 -0.02 0.00 -2.33 0.00 0.00 43.42 41.16 2h4r n LEU 58 CO 0.48 -0.29 -0.05 1.41 -1.33 0.00 0.00 177.39 177.60 2h4r n HIS 59 N -1.84 -0.02 0.10 -1.77 8.25 -0.78 -4.56 115.22 114.59 2h4r n HIS 59 Ca 0.04 0.00 0.01 0.00 -0.26 0.00 0.00 57.72 57.51 2h4r n HIS 59 Cb 0.26 -1.33 0.33 0.00 1.12 0.00 0.00 29.99 30.37 2h4r n HIS 59 CO 0.00 0.00 0.00 0.74 0.64 0.00 0.00 176.34 177.72 2h4r h PHE 60 N 0.00 0.29 -4.21 4.41 0.04 0.37 -3.43 116.94 114.41 2h4r h PHE 60 Ca -0.11 -0.04 -0.14 0.00 2.80 0.00 0.00 57.97 60.47 2h4r h PHE 60 Cb 0.43 -0.08 -0.14 0.00 2.20 0.00 0.00 35.95 38.35 2h4r h PHE 60 CO 0.15 0.46 -0.57 0.95 -0.60 0.00 0.00 178.31 178.70 2h4r s THR 61 N -4.58 0.14 -0.19 -1.55 -4.23 -0.79 -4.61 115.64 99.83 2h4r s THR 61 Ca -0.05 -1.71 -0.20 0.00 -1.18 0.00 0.00 61.69 58.55 2h4r s THR 61 Cb 0.15 -1.76 -0.17 0.00 1.34 0.00 0.00 72.50 72.05 2h4r s THR 61 CO 0.75 -0.63 0.23 -0.33 -0.54 0.00 0.00 174.62 174.10 2h4r h GLU 62 N 2.89 0.00 0.00 3.99 5.08 -1.86 -3.37 114.58 121.30 2h4r h GLU 62 Ca -0.34 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.02 2h4r h GLU 62 Cb 1.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.44 2h4r h GLU 62 CO 0.59 0.85 -0.93 0.00 -1.00 0.00 0.00 179.01 178.52 2h4r n ALA 63 N -3.32 3.38 0.00 3.43 0.00 -1.26 -4.91 120.51 117.83 2h4r n ALA 63 Ca -0.25 -0.36 0.00 0.00 0.00 0.00 0.00 53.44 52.82 2h4r n ALA 63 Cb 0.58 -0.48 0.00 0.00 0.00 0.00 0.00 19.45 19.55 2h4r n ALA 63 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2h4r n ALA 91 N -1.52 0.00 -0.18 0.00 0.00 -1.26 -4.86 120.51 112.69 2h4r n ALA 91 Ca 0.01 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.44 2h4r n ALA 91 Cb 0.25 0.00 0.09 0.00 0.00 0.00 0.00 19.45 19.79 2h4r n ALA 91 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2h4r h GLU 92 N 0.00 0.34 -0.81 0.00 5.08 -2.00 -2.11 114.58 115.08 2h4r h GLU 92 Ca 0.00 -0.02 0.04 0.00 -1.00 0.00 0.00 59.36 58.38 2h4r h GLU 92 Cb 0.00 -0.08 -0.05 0.00 0.50 0.00 0.00 28.75 29.13 2h4r h GLU 92 CO 0.00 0.23 0.53 -0.97 -1.00 0.00 0.00 179.01 177.80 2h4r h ASN 93 N 0.35 0.85 -0.01 1.42 -0.73 -1.99 -1.30 115.58 114.17 2h4r h ASN 93 Ca 0.28 -0.01 -0.00 0.00 1.87 0.00 0.00 56.30 58.44 2h4r h ASN 93 Cb 0.35 -0.19 -0.00 0.00 0.27 0.00 0.00 38.32 38.74 2h4r h ASN 93 CO -0.30 0.58 -0.01 0.40 -0.37 0.00 0.00 177.43 177.73 2h4r h ILE 94 N 0.98 1.38 -0.26 2.57 1.08 -1.66 -2.04 117.51 119.55 2h4r h ILE 94 Ca 0.33 -1.12 -0.06 0.00 -0.39 0.00 0.00 64.86 63.62 2h4r h ILE 94 Cb 0.07 2.12 -0.02 0.00 -3.07 0.00 0.00 36.82 35.92 2h4r h ILE 94 CO -0.10 0.30 -0.09 0.45 -0.69 0.00 0.00 178.15 178.02 2h4r h HIS 95 N -0.44 0.45 -0.24 1.37 3.86 -1.28 -1.13 115.15 117.74 2h4r h HIS 95 Ca 0.00 -0.05 -0.04 0.00 -1.16 0.00 0.00 60.37 59.12 2h4r h HIS 95 Cb 0.49 -0.13 -0.01 0.00 1.06 0.00 0.00 27.41 28.82 2h4r h HIS 95 CO 0.09 0.51 -0.01 1.03 0.86 0.00 0.00 177.93 180.41 2h4r h SER 96 N 0.40 0.42 -0.36 2.45 0.87 -1.24 -2.15 113.55 113.94 2h4r h SER 96 Ca 0.08 -0.32 -0.13 0.00 -1.23 0.00 0.00 61.79 60.19 2h4r h SER 96 Cb 0.40 -0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 62.24 2h4r h SER 96 CO 0.02 0.64 -0.26 1.23 -0.53 0.00 0.00 176.83 177.93 2h4r h GLY 97 N 0.19 0.95 0.93 5.77 0.00 -1.22 -2.80 103.07 106.88 2h4r h GLY 97 Ca 0.07 -0.86 0.01 0.00 0.00 0.00 0.00 47.33 46.55 2h4r h GLY 97 CO 0.01 0.78 0.25 0.74 0.00 0.00 0.00 176.54 178.32 2h4r h PHE 98 N 0.75 0.47 -0.33 5.60 0.05 -1.21 -1.33 116.94 120.93 2h4r h PHE 98 Ca 0.09 0.01 0.05 0.00 3.82 0.00 0.00 57.97 61.95 2h4r h PHE 98 Cb 0.81 -0.15 -0.05 0.00 2.00 0.00 0.00 35.95 38.56 2h4r h PHE 98 CO 0.05 0.28 0.05 -0.22 -0.18 0.00 0.00 178.31 178.28 2h4r h LYS 99 N 0.51 0.15 0.00 1.51 3.64 -1.32 0.15 116.57 121.22 2h4r h LYS 99 Ca 0.16 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.53 2h4r h LYS 99 Cb -0.01 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 31.78 2h4r h LYS 99 CO -0.06 0.10 0.00 0.39 -2.27 0.00 0.00 179.45 177.61 2h4r n GLU 100 N -5.11 0.20 -0.01 1.90 -0.58 -1.06 0.20 120.64 116.17 2h4r n GLU 100 Ca 0.01 0.34 -0.16 0.00 -0.42 0.00 0.00 57.16 56.92 2h4r n GLU 100 Cb 0.15 -1.82 -0.14 0.00 -0.57 0.00 0.00 31.44 29.07 2h4r n GLU 100 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 2h4r n LEU 101 N -2.18 1.91 -0.14 -4.62 4.77 -0.52 -2.57 117.00 113.66 2h4r n LEU 101 Ca 0.03 0.29 -0.11 0.00 -0.03 0.00 0.00 56.01 56.20 2h4r n LEU 101 Cb 0.29 -0.59 -0.01 0.00 -2.33 0.00 0.00 43.42 40.78 2h4r n LEU 101 CO 0.23 0.67 0.77 0.25 -1.33 0.00 0.00 177.39 177.97 2h4r h LEU 102 N 0.04 0.74 -0.68 2.23 5.85 -0.44 -0.32 115.31 122.73 2h4r h LEU 102 Ca -0.37 -0.33 0.02 0.00 0.84 0.00 0.00 57.88 58.04 2h4r h LEU 102 Cb 2.03 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 42.82 2h4r h LEU 102 CO 0.08 0.89 0.44 0.74 -0.34 0.00 0.00 178.44 180.26 2h4r h THR 103 N 0.58 1.14 -0.41 1.05 2.02 -0.38 -2.37 112.91 114.53 2h4r h THR 103 Ca 0.11 -0.30 -0.15 0.00 0.77 0.00 0.00 66.41 66.84 2h4r h THR 103 Cb 0.53 0.18 -0.01 0.00 -1.74 0.00 0.00 68.15 67.11 2h4r h THR 103 CO 0.03 0.16 -0.32 0.00 0.37 0.00 0.00 175.52 175.76 2h4r h ALA 104 N 1.27 0.59 0.00 6.16 0.00 -1.31 -3.13 119.26 122.84 2h4r h ALA 104 Ca 0.26 -0.43 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 2h4r h ALA 104 Cb -0.05 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 2h4r h ALA 104 CO -0.08 0.66 -0.00 0.74 0.00 0.00 0.00 179.25 180.56 2h4r h PHE 105 N 0.77 0.00 -0.49 0.00 0.05 -0.93 -3.07 116.94 113.27 2h4r h PHE 105 Ca 0.08 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.87 2h4r h PHE 105 Cb 0.91 0.00 0.00 0.00 2.00 0.00 0.00 35.95 38.86 2h4r h PHE 105 CO 0.06 0.00 0.00 0.09 -0.18 0.00 0.00 178.31 178.28 2h4r n ASN 106 N -3.10 4.44 -4.47 2.17 4.13 -0.90 -4.74 115.26 112.79 2h4r n ASN 106 Ca 0.02 -2.61 -0.32 0.00 1.68 0.00 0.00 54.58 53.34 2h4r n ASN 106 Cb 0.38 -0.54 0.14 0.00 -1.54 0.00 0.00 39.78 38.22 2h4r n ASN 106 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 2h4r n LYS 107 N 0.53 -0.50 0.06 3.52 5.02 -1.16 -4.94 118.16 120.69 2h4r n LYS 107 Ca 0.23 -0.10 -0.16 0.00 -2.02 0.00 0.00 58.31 56.26 2h4r n LYS 107 Cb 0.88 -1.99 -0.14 0.00 -0.02 0.00 0.00 35.03 33.76 2h4r n LYS 107 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 2h4r h PRO 108 N -1.72 0.23 -0.12 1.97 0.14 -1.93 -3.33 132.00 127.24 2h4r h PRO 108 Ca -0.45 -0.40 0.00 0.00 0.14 0.00 0.00 66.00 65.29 2h4r h PRO 108 Cb 1.29 0.15 0.00 0.00 0.14 0.00 0.00 31.00 32.57 2h4r h PRO 108 CO 0.37 1.10 0.00 0.54 0.14 0.00 0.00 178.00 180.14 2h4r n ARG 109 N -3.44 1.30 -1.95 0.86 1.74 -1.26 -4.89 116.66 109.01 2h4r n ARG 109 Ca -0.15 -0.47 -0.41 0.00 -0.77 0.00 0.00 57.85 56.05 2h4r n ARG 109 Cb 1.04 -1.16 -0.02 0.00 -1.02 0.00 0.00 32.46 31.30 2h4r n ARG 109 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 2h4r s ASN 110 N -1.15 6.57 -1.11 0.55 0.01 -1.25 -4.93 114.94 113.62 2h4r s ASN 110 Ca 0.14 2.81 -0.04 0.00 -0.71 0.00 0.00 52.86 55.06 2h4r s ASN 110 Cb 0.07 -2.64 0.28 0.00 0.41 0.00 0.00 41.25 39.37 2h4r s ASN 110 CO 0.11 -0.73 1.62 0.59 -1.51 0.00 0.00 177.10 177.17 2h4r n ASN 111 N 1.40 6.40 0.00 -1.22 3.02 -1.26 -4.86 115.26 118.74 2h4r n ASN 111 Ca 0.04 -3.40 0.00 0.00 -0.03 0.00 0.00 54.58 51.19 2h4r n ASN 111 Cb 0.40 -1.29 0.00 0.00 -0.61 0.00 0.00 39.78 38.28 2h4r n ASN 111 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2h4r n TYR 112 N 1.52 0.00 -4.92 3.10 0.18 -1.26 -4.51 117.16 111.28 2h4r n TYR 112 Ca 0.32 0.00 -0.28 0.00 1.88 0.00 0.00 57.90 59.82 2h4r n TYR 112 Cb 0.32 0.00 -0.17 0.00 -0.38 0.00 0.00 39.34 39.12 2h4r n TYR 112 CO 0.00 0.00 0.00 -1.12 -2.08 0.00 0.00 176.86 173.66 2h4r s SER 113 N 0.00 2.43 -0.55 9.48 0.01 0.43 -4.99 113.70 120.50 2h4r s SER 113 Ca 0.00 -0.42 -0.01 0.00 1.31 0.00 0.00 55.95 56.83 2h4r s SER 113 Cb 0.00 -1.01 0.14 0.00 0.21 0.00 0.00 66.02 65.36 2h4r s SER 113 CO 0.00 0.12 0.33 -0.76 0.41 0.00 0.00 173.24 173.34 2h4r s LEU 114 N 0.38 4.96 -1.04 2.44 1.02 -1.26 -0.96 118.68 124.22 2h4r s LEU 114 Ca -0.14 -2.73 -0.21 0.00 0.02 0.00 0.00 54.13 51.08 2h4r s LEU 114 Cb -0.16 -1.78 0.09 0.00 0.02 0.00 0.00 46.19 44.36 2h4r s LEU 114 CO 0.05 -0.36 1.38 -0.13 0.02 0.00 0.00 176.35 177.32 2h4r s ARG 115 N 0.11 3.67 -0.09 1.70 1.81 -0.01 -4.94 118.95 121.20 2h4r s ARG 115 Ca 0.15 -1.51 -0.08 0.00 -1.72 0.00 0.00 55.73 52.57 2h4r s ARG 115 Cb -0.22 -5.22 -0.04 0.00 -0.45 0.00 0.00 34.95 29.01 2h4r s ARG 115 CO -0.03 -2.05 0.19 0.45 -0.68 0.00 0.00 175.30 173.18 2h4r s SER 116 N 4.34 6.47 -0.53 0.23 0.15 -1.26 -0.32 113.70 122.77 2h4r s SER 116 Ca 0.43 0.56 0.07 0.00 0.70 0.00 0.00 55.95 57.71 2h4r s SER 116 Cb -0.01 -2.10 0.34 0.00 -1.71 0.00 0.00 66.02 62.53 2h4r s SER 116 CO -0.07 0.39 0.89 0.00 1.20 0.00 0.00 173.24 175.65 2h4r n ALA 117 N 1.92 4.05 -2.67 5.45 0.00 -0.27 -4.84 120.51 124.15 2h4r n ALA 117 Ca -0.19 -4.41 -0.40 0.00 0.00 0.00 0.00 53.44 48.45 2h4r n ALA 117 Cb 0.54 -0.78 -0.06 0.00 0.00 0.00 0.00 19.45 19.16 2h4r n ALA 117 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2h4r s ASN 118 N -3.20 6.71 -0.12 0.00 0.02 -1.26 -3.20 114.94 113.90 2h4r s ASN 118 Ca 0.47 0.86 -0.30 0.00 -1.02 0.00 0.00 52.86 52.87 2h4r s ASN 118 Cb 0.29 -2.35 0.08 0.00 0.02 0.00 0.00 41.25 39.29 2h4r s ASN 118 CO -0.12 -0.25 0.76 -0.60 0.02 0.00 0.00 177.10 176.90 2h4r s ARG 119 N 1.77 0.92 -0.18 -0.60 3.52 -0.89 -4.92 118.95 118.57 2h4r s ARG 119 Ca 0.29 0.38 -0.06 0.00 -0.13 0.00 0.00 55.73 56.22 2h4r s ARG 119 Cb -0.16 0.44 -0.03 0.00 -1.56 0.00 0.00 34.95 33.63 2h4r s ARG 119 CO 0.11 -0.25 0.02 0.96 -0.81 0.00 0.00 175.30 175.32 2h4r s ILE 120 N -0.85 4.31 -0.30 4.11 -4.36 -1.26 -1.52 121.20 121.33 2h4r s ILE 120 Ca -0.07 -0.20 -0.09 0.00 -0.26 0.00 0.00 60.65 60.03 2h4r s ILE 120 Cb -0.01 -2.93 -0.01 0.00 1.25 0.00 0.00 42.46 40.76 2h4r s ILE 120 CO 0.06 0.46 0.14 -0.31 0.24 0.00 0.00 174.94 175.53 2h4r s TYR 121 N 0.53 3.17 0.12 1.37 1.51 0.18 -2.16 117.35 122.07 2h4r s TYR 121 Ca 0.00 -0.55 0.06 0.00 -1.01 0.00 0.00 57.07 55.57 2h4r s TYR 121 Cb -0.14 -2.34 -0.04 0.00 -0.11 0.00 0.00 41.96 39.34 2h4r s TYR 121 CO 0.02 -0.44 -0.02 0.54 -1.11 0.00 0.00 175.55 174.54 2h4r s VAL 122 N 1.61 3.81 0.31 0.71 0.11 0.07 -0.78 120.40 126.24 2h4r s VAL 122 Ca 0.05 -1.17 -0.29 0.00 -2.93 0.00 0.00 61.98 57.64 2h4r s VAL 122 Cb -0.17 -2.84 -0.12 0.00 -1.53 0.00 0.00 36.38 31.73 2h4r s VAL 122 CO 0.06 0.05 1.52 1.21 -3.33 0.00 0.00 175.10 174.61 2h4r n GLU 123 N 0.40 2.56 0.05 1.54 4.07 -0.39 -1.87 120.64 127.00 2h4r n GLU 123 Ca -0.11 0.91 0.20 0.00 -0.06 0.00 0.00 57.16 58.10 2h4r n GLU 123 Cb 0.53 -2.64 0.73 0.00 -0.06 0.00 0.00 31.44 30.00 2h4r n GLU 123 CO 0.00 0.00 0.00 -0.22 -0.06 0.00 0.00 177.13 176.85 2h4r h LYS 124 N 4.03 0.00 -0.01 5.31 3.64 -1.00 -2.46 116.57 126.09 2h4r h LYS 124 Ca -0.48 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.90 2h4r h LYS 124 Cb 1.24 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.06 2h4r h LYS 124 CO 0.73 0.00 -0.05 0.25 -2.27 0.00 0.00 179.45 178.11 2h4r n THR 125 N -4.06 0.00 -3.00 1.00 -2.24 -1.26 -4.83 114.28 99.89 2h4r n THR 125 Ca 0.08 -0.12 -0.40 0.00 -2.27 0.00 0.00 64.05 61.34 2h4r n THR 125 Cb 0.59 0.06 -0.04 0.00 -2.10 0.00 0.00 70.33 68.84 2h4r n THR 125 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 2h4r s TYR 126 N -2.17 3.59 -0.58 4.78 2.02 -0.93 -5.02 117.35 119.04 2h4r s TYR 126 Ca 0.37 1.31 -0.26 0.00 -0.37 0.00 0.00 57.07 58.12 2h4r s TYR 126 Cb 0.21 -2.84 0.04 0.00 -0.40 0.00 0.00 41.96 38.96 2h4r s TYR 126 CO 0.40 0.08 1.06 0.00 -1.57 0.00 0.00 175.55 175.52 2h4r s ALA 127 N 0.81 3.06 0.45 3.71 0.00 -1.26 -5.00 121.76 123.53 2h4r s ALA 127 Ca 0.39 -1.13 -0.21 0.00 0.00 0.00 0.00 51.96 51.01 2h4r s ALA 127 Cb -0.18 -3.90 -0.09 0.00 0.00 0.00 0.00 23.12 18.95 2h4r s ALA 127 CO 0.19 -2.58 1.01 -0.51 0.00 0.00 0.00 175.76 173.87 2h4r s LEU 128 N 4.47 3.93 -0.02 0.00 1.43 -1.25 -3.39 118.68 123.85 2h4r s LEU 128 Ca 0.35 1.86 -0.22 0.00 -1.03 0.00 0.00 54.13 55.09 2h4r s LEU 128 Cb -0.11 -4.48 -0.05 0.00 0.03 0.00 0.00 46.19 41.58 2h4r s LEU 128 CO 0.21 -0.58 0.63 -0.76 0.23 0.00 0.00 176.35 176.08 2h4r s LEU 129 N -3.22 4.38 0.21 1.79 1.02 0.32 -4.93 118.68 118.25 2h4r s LEU 129 Ca 0.64 1.17 -0.10 0.00 0.02 0.00 0.00 54.13 55.86 2h4r s LEU 129 Cb -0.15 -2.98 0.23 0.00 0.02 0.00 0.00 46.19 43.31 2h4r s LEU 129 CO 0.19 0.02 1.81 -0.65 0.02 0.00 0.00 176.35 177.74 2h4r h PRO 130 N 6.04 0.66 -0.77 1.29 0.11 -1.94 -2.11 132.00 135.28 2h4r h PRO 130 Ca -0.44 -0.04 0.09 0.00 0.11 0.00 0.00 66.00 65.72 2h4r h PRO 130 Cb 1.20 -0.15 -0.07 0.00 0.11 0.00 0.00 31.00 32.09 2h4r h PRO 130 CO 0.72 0.44 0.42 1.15 -0.21 0.00 0.00 178.00 180.52 2h4r h THR 131 N 0.68 0.90 -0.55 -1.15 2.02 -1.94 -0.01 112.91 112.87 2h4r h THR 131 Ca 0.29 -0.25 -0.07 0.00 0.77 0.00 0.00 66.41 67.15 2h4r h THR 131 Cb 0.17 0.12 -0.02 0.00 -1.74 0.00 0.00 68.15 66.68 2h4r h THR 131 CO -0.17 0.13 0.04 0.22 0.37 0.00 0.00 175.52 176.11 2h4r h TYR 132 N 0.72 0.97 -0.44 3.16 3.20 -1.58 -0.12 116.97 122.87 2h4r h TYR 132 Ca 0.37 -0.13 -0.03 0.00 3.14 0.00 0.00 58.73 62.07 2h4r h TYR 132 Cb 0.33 -0.27 -0.02 0.00 1.54 0.00 0.00 36.73 38.32 2h4r h TYR 132 CO -0.08 0.85 0.15 -0.07 -1.64 0.00 0.00 178.16 177.37 2h4r h LEU 133 N 0.85 0.58 0.00 2.82 3.38 -0.46 0.82 115.31 123.29 2h4r h LEU 133 Ca 0.17 -0.07 -0.14 0.00 0.09 0.00 0.00 57.88 57.93 2h4r h LEU 133 Cb 0.44 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 2h4r h LEU 133 CO 0.02 0.55 -1.19 0.06 0.09 0.00 0.00 178.44 177.96 2h4r h GLN 134 N 0.63 0.00 0.06 1.13 3.07 -0.90 -2.78 115.11 116.31 2h4r h GLN 134 Ca 0.15 0.00 -0.28 0.00 0.09 0.00 0.00 58.65 58.61 2h4r h GLN 134 Cb 0.17 0.00 0.02 0.00 0.08 0.00 0.00 27.48 27.75 2h4r h GLN 134 CO -0.01 0.29 -1.12 -0.07 0.09 0.00 0.00 178.83 178.01 2h4r h LEU 135 N 0.00 0.83 -0.64 0.06 3.38 -0.91 -2.78 115.31 115.25 2h4r h LEU 135 Ca -0.12 -0.71 -0.10 0.00 0.09 0.00 0.00 57.88 57.05 2h4r h LEU 135 Cb 1.48 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.95 2h4r h LEU 135 CO 0.04 1.52 -0.02 -1.28 0.09 0.00 0.00 178.44 178.79 2h4r h SER 136 N 0.31 1.02 -0.23 -0.43 0.87 -0.95 -2.69 113.55 111.45 2h4r h SER 136 Ca -0.15 -0.30 -0.10 0.00 -1.23 0.00 0.00 61.79 60.02 2h4r h SER 136 Cb 1.78 -0.27 -0.02 0.00 -0.44 0.00 0.00 62.40 63.45 2h4r h SER 136 CO 0.21 1.08 -0.18 0.50 -0.53 0.00 0.00 176.83 177.91 2h4r h LYS 137 N 0.94 0.67 0.52 2.24 3.64 -1.52 -2.11 116.57 120.96 2h4r h LYS 137 Ca 0.16 -0.24 -0.03 0.00 -1.27 0.00 0.00 60.65 59.28 2h4r h LYS 137 Cb 0.58 -0.05 0.01 0.00 -0.41 0.00 0.00 32.23 32.35 2h4r h LYS 137 CO 0.03 0.81 -0.25 -0.22 -2.27 0.00 0.00 179.45 177.56 2h4r h LYS 138 N 0.60 -0.68 0.00 1.90 3.64 -1.36 -2.09 116.57 118.59 2h4r h LYS 138 Ca 0.09 0.05 -0.08 0.00 -1.27 0.00 0.00 60.65 59.44 2h4r h LYS 138 Cb 0.64 0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.60 2h4r h LYS 138 CO 0.05 -0.39 -0.39 1.88 -2.27 0.00 0.00 179.45 178.33 2h4r h TYR 139 N -1.11 0.00 0.00 1.91 -1.99 -1.57 -3.38 116.97 110.84 2h4r h TYR 139 Ca -0.07 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.66 2h4r h TYR 139 Cb 0.59 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.32 2h4r h TYR 139 CO 0.01 0.39 0.00 0.66 -0.00 0.00 0.00 178.16 179.21 2h4r n TYR 140 N -3.20 0.00 -3.66 4.88 4.01 -0.80 -3.59 117.16 114.79 2h4r n TYR 140 Ca 0.02 0.00 -0.27 0.00 -0.16 0.00 0.00 57.90 57.49 2h4r n TYR 140 Cb 0.68 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.69 2h4r n TYR 140 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 2h4r n LYS 141 N -0.45 -2.89 -3.97 -0.72 4.01 -0.78 -4.94 118.16 108.41 2h4r n LYS 141 Ca 0.00 0.35 -0.12 0.00 -0.51 0.00 0.00 58.31 58.03 2h4r n LYS 141 Cb 0.02 -5.02 -0.13 0.00 -0.51 0.00 0.00 35.03 29.39 2h4r n LYS 141 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2h4r s ALA 142 N -2.97 0.17 0.01 7.82 0.00 -1.24 -5.01 121.76 120.55 2h4r s ALA 142 Ca 0.51 -0.32 -0.02 0.00 0.00 0.00 0.00 51.96 52.13 2h4r s ALA 142 Cb -0.28 0.04 -0.01 0.00 0.00 0.00 0.00 23.12 22.87 2h4r s ALA 142 CO 0.63 -0.04 0.02 -1.83 0.00 0.00 0.00 175.76 174.53 2h4r s GLU 143 N -0.70 0.29 0.16 0.00 -1.05 -1.26 -3.46 118.70 112.68 2h4r s GLU 143 Ca -0.06 -0.42 -0.31 0.00 -0.15 0.00 0.00 54.97 54.02 2h4r s GLU 143 Cb -0.05 0.11 -0.09 0.00 -0.44 0.00 0.00 34.13 33.66 2h4r s GLU 143 CO -0.00 -0.05 1.48 -1.25 0.95 0.00 0.00 175.26 176.38 2h4r s PRO 144 N -1.12 4.26 -0.11 -4.83 0.04 -1.26 -4.70 135.00 127.28 2h4r s PRO 144 Ca -0.12 2.24 -0.08 0.00 0.04 0.00 0.00 61.00 63.08 2h4r s PRO 144 Cb -0.07 -3.18 -0.04 0.00 0.04 0.00 0.00 34.50 31.24 2h4r s PRO 144 CO -0.00 -0.51 0.18 -0.65 0.04 0.00 0.00 177.00 176.06 2h4r s GLN 145 N 0.87 3.56 -0.40 4.56 -1.52 -0.92 -4.94 119.66 120.87 2h4r s GLN 145 Ca 0.66 -0.05 -0.14 0.00 -1.95 0.00 0.00 55.36 53.88 2h4r s GLN 145 Cb -0.41 -3.21 0.02 0.00 -0.22 0.00 0.00 33.01 29.19 2h4r s GLN 145 CO 0.33 0.74 0.27 0.15 -0.25 0.00 0.00 175.29 176.53 2h4r s LYS 146 N -0.95 2.95 0.12 2.91 1.02 -1.26 -0.75 119.74 123.79 2h4r s LYS 146 Ca 0.16 -1.02 0.09 0.00 0.02 0.00 0.00 55.97 55.22 2h4r s LYS 146 Cb -0.13 -3.91 -0.04 0.00 -0.52 0.00 0.00 37.83 33.24 2h4r s LYS 146 CO 0.05 -0.72 -0.16 0.14 -0.92 0.00 0.00 175.35 173.73 2h4r s VAL 147 N 1.65 2.95 -1.03 3.17 -7.23 -0.78 -4.77 120.40 114.36 2h4r s VAL 147 Ca 0.04 -1.48 -0.23 0.00 -1.81 0.00 0.00 61.98 58.50 2h4r s VAL 147 Cb -0.19 -2.37 0.04 0.00 0.56 0.00 0.00 36.38 34.43 2h4r s VAL 147 CO 0.09 0.08 1.50 0.21 -0.31 0.00 0.00 175.10 176.67 2h4r s ASN 148 N -2.21 6.43 0.03 4.85 2.47 -1.26 -0.36 114.94 124.90 2h4r s ASN 148 Ca 0.19 -1.46 -0.19 0.00 0.42 0.00 0.00 52.86 51.82 2h4r s ASN 148 Cb -0.10 -2.57 -0.17 0.00 -1.45 0.00 0.00 41.25 36.96 2h4r s ASN 148 CO 0.11 -1.57 1.26 -0.26 -3.72 0.00 0.00 177.10 172.92 2h4r h PHE 149 N 9.77 0.55 -0.60 0.43 0.05 -1.87 -2.99 116.94 122.29 2h4r h PHE 149 Ca 0.21 -0.22 0.10 0.00 3.82 0.00 0.00 57.97 61.89 2h4r h PHE 149 Cb 1.00 -0.10 -0.11 0.00 2.00 0.00 0.00 35.95 38.74 2h4r h PHE 149 CO 1.28 0.94 -0.34 0.87 -0.18 0.00 0.00 178.31 180.88 2h4r h LYS 150 N 0.01 -0.16 -0.03 1.51 1.57 -1.83 -2.87 116.57 114.77 2h4r h LYS 150 Ca -0.01 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2h4r h LYS 150 Cb 0.93 0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.28 2h4r h LYS 150 CO 0.07 -0.10 0.00 0.25 -0.57 0.00 0.00 179.45 179.10 2h4r n THR 151 N -5.43 0.25 -3.01 -0.16 -2.24 -1.26 -4.63 114.28 97.79 2h4r n THR 151 Ca 0.04 -0.62 -0.15 0.00 -2.27 0.00 0.00 64.05 61.05 2h4r n THR 151 Cb 0.36 0.94 0.01 0.00 -2.10 0.00 0.00 70.33 69.53 2h4r n THR 151 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2h4r n ALA 152 N 0.13 0.93 -0.27 6.98 0.00 -1.13 -5.00 120.51 122.15 2h4r n ALA 152 Ca 0.03 -2.65 -0.03 0.00 0.00 0.00 0.00 53.44 50.79 2h4r n ALA 152 Cb 0.15 -1.02 0.09 0.00 0.00 0.00 0.00 19.45 18.67 2h4r n ALA 152 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2h4r h PRO 153 N 3.12 0.89 -0.44 0.00 0.13 -1.61 -2.32 132.00 131.78 2h4r h PRO 153 Ca 0.02 -0.05 -0.09 0.00 -0.87 0.00 0.00 66.00 65.00 2h4r h PRO 153 Cb 1.01 -0.20 -0.02 0.00 0.13 0.00 0.00 31.00 31.92 2h4r h PRO 153 CO 0.36 0.59 -0.11 0.93 -0.23 0.00 0.00 178.00 179.55 2h4r h GLU 154 N 0.92 0.79 -0.19 0.86 4.39 -1.90 0.24 114.58 119.68 2h4r h GLU 154 Ca 0.30 -0.26 -0.10 0.00 0.34 0.00 0.00 59.36 59.64 2h4r h GLU 154 Cb 0.02 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 28.59 2h4r h GLU 154 CO -0.11 0.87 -0.30 0.37 -1.16 0.00 0.00 179.01 178.68 2h4r h GLN 155 N 0.72 0.38 -0.23 2.33 4.15 -1.88 -0.34 115.11 120.24 2h4r h GLN 155 Ca 0.12 -0.15 -0.10 0.00 0.77 0.00 0.00 58.65 59.30 2h4r h GLN 155 Cb 0.59 -0.02 -0.00 0.00 0.21 0.00 0.00 27.48 28.26 2h4r h GLN 155 CO 0.04 0.65 -0.23 0.77 -1.93 0.00 0.00 178.83 178.13 2h4r h SER 156 N 0.33 0.60 0.58 -0.69 0.02 -1.08 -2.48 113.55 110.83 2h4r h SER 156 Ca 0.05 -0.48 -0.03 0.00 -0.84 0.00 0.00 61.79 60.49 2h4r h SER 156 Cb 0.70 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 63.07 2h4r h SER 156 CO 0.05 0.95 -0.29 -0.09 -1.14 0.00 0.00 176.83 176.31 2h4r h ARG 157 N 0.25 -0.77 -0.92 3.45 2.43 -0.25 -0.47 114.38 118.11 2h4r h ARG 157 Ca 0.04 0.05 0.05 0.00 -0.81 0.00 0.00 59.98 59.30 2h4r h ARG 157 Cb 0.78 0.17 -0.06 0.00 -0.42 0.00 0.00 29.97 30.45 2h4r h ARG 157 CO 0.06 -0.51 0.60 0.87 -1.51 0.00 0.00 179.97 179.48 2h4r h LYS 158 N -0.80 1.09 -0.58 0.20 1.57 -1.17 0.63 116.57 117.51 2h4r h LYS 158 Ca -0.08 -0.07 -0.03 0.00 -1.87 0.00 0.00 60.65 58.61 2h4r h LYS 158 Cb 0.62 -0.25 -0.03 0.00 0.08 0.00 0.00 32.23 32.66 2h4r h LYS 158 CO 0.12 0.72 0.26 1.49 -0.57 0.00 0.00 179.45 181.47 2h4r h GLU 159 N 1.12 0.85 -0.00 3.15 4.81 -1.23 -1.29 114.58 121.98 2h4r h GLU 159 Ca 0.37 -0.14 -0.00 0.00 -0.13 0.00 0.00 59.36 59.47 2h4r h GLU 159 Cb 0.07 -0.15 -0.00 0.00 0.63 0.00 0.00 28.75 29.31 2h4r h GLU 159 CO -0.12 0.70 -0.00 0.82 -0.73 0.00 0.00 179.01 179.68 2h4r h ILE 160 N 0.79 1.32 -0.08 2.32 2.04 -0.34 -2.60 117.51 120.95 2h4r h ILE 160 Ca 0.20 -0.93 0.02 0.00 1.00 0.00 0.00 64.86 65.15 2h4r h ILE 160 Cb 0.15 1.95 -0.00 0.00 -0.74 0.00 0.00 36.82 38.17 2h4r h ILE 160 CO -0.02 0.24 0.07 0.78 0.00 0.00 0.00 178.15 179.22 2h4r h ASN 161 N -0.39 0.00 -0.12 1.72 2.35 -0.85 -0.72 115.58 117.56 2h4r h ASN 161 Ca 0.00 0.00 -0.21 0.00 -0.55 0.00 0.00 56.30 55.54 2h4r h ASN 161 Cb 0.40 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.78 2h4r h ASN 161 CO 0.00 0.00 -0.76 0.74 -1.65 0.00 0.00 177.43 175.77 2h4r h THR 162 N 0.00 1.30 -0.07 2.81 2.02 -1.19 -2.20 112.91 115.59 2h4r h THR 162 Ca 0.04 -1.98 -0.02 0.00 0.77 0.00 0.00 66.41 65.23 2h4r h THR 162 Cb 0.18 2.08 -0.00 0.00 -1.74 0.00 0.00 68.15 68.66 2h4r h THR 162 CO -0.00 0.62 -0.02 -0.25 0.37 0.00 0.00 175.52 176.24 2h4r h TRP 163 N 0.43 0.14 -0.48 3.16 7.01 -0.98 -1.35 115.95 123.89 2h4r h TRP 163 Ca -0.06 -0.03 0.08 0.00 2.11 0.00 0.00 58.89 60.98 2h4r h TRP 163 Cb 1.39 -0.03 -0.03 0.00 -2.10 0.00 0.00 29.16 28.39 2h4r h TRP 163 CO 0.10 0.47 0.33 0.28 -2.79 0.00 0.00 178.44 176.82 2h4r h VAL 164 N -0.22 0.93 0.12 2.65 2.07 -1.24 -0.56 116.25 120.00 2h4r h VAL 164 Ca 0.02 -0.11 -0.28 0.00 0.82 0.00 0.00 66.70 67.14 2h4r h VAL 164 Cb 0.43 0.56 0.02 0.00 -1.52 0.00 0.00 31.29 30.78 2h4r h VAL 164 CO 0.01 0.06 -1.22 -0.08 0.02 0.00 0.00 177.57 176.36 2h4r h GLU 165 N 0.33 0.44 0.00 1.57 4.81 -1.27 -2.79 114.58 117.67 2h4r h GLU 165 Ca 0.22 -0.63 -0.03 0.00 -0.13 0.00 0.00 59.36 58.78 2h4r h GLU 165 Cb 0.42 0.22 -0.00 0.00 0.63 0.00 0.00 28.75 30.02 2h4r h GLU 165 CO -0.05 1.27 -0.15 0.87 -0.73 0.00 0.00 179.01 180.22 2h4r h LYS 166 N 0.17 0.00 0.01 1.92 1.57 -0.62 0.64 116.57 120.27 2h4r h LYS 166 Ca -0.16 0.00 -0.25 0.00 -1.87 0.00 0.00 60.65 58.38 2h4r h LYS 166 Cb 1.90 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 34.18 2h4r h LYS 166 CO 0.22 0.15 -1.29 1.96 -0.57 0.00 0.00 179.45 179.92 2h4r h GLN 167 N 0.00 0.03 -1.03 3.15 1.08 -1.18 -3.34 115.11 113.81 2h4r h GLN 167 Ca -0.00 -0.05 -0.52 0.00 -1.45 0.00 0.00 58.65 56.63 2h4r h GLN 167 Cb 0.91 0.02 -0.28 0.00 -0.05 0.00 0.00 27.48 28.08 2h4r h GLN 167 CO 0.02 0.84 0.67 0.25 -0.95 0.00 0.00 178.83 179.66 2h4r n THR 168 N -3.26 3.17 -4.16 -0.54 -2.24 -1.05 -4.39 114.28 101.81 2h4r n THR 168 Ca -0.07 -2.07 -0.30 0.00 -2.27 0.00 0.00 64.05 59.34 2h4r n THR 168 Cb 0.99 -0.74 -0.06 0.00 -2.10 0.00 0.00 70.33 68.42 2h4r n THR 168 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2h4r n GLU 169 N -0.90 -1.75 -0.06 -0.78 1.02 -1.22 -0.89 120.64 116.06 2h4r n GLU 169 Ca 0.56 0.21 0.00 0.00 -0.02 0.00 0.00 57.16 57.90 2h4r n GLU 169 Cb 1.27 -3.87 0.00 0.00 -0.02 0.00 0.00 31.44 28.82 2h4r n GLU 169 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 2h4r n SER 170 N -2.88 0.00 0.24 1.62 7.64 0.22 -4.81 113.62 115.66 2h4r n SER 170 Ca -0.31 0.00 0.17 0.00 1.01 0.00 0.00 58.87 59.74 2h4r n SER 170 Cb 0.69 -1.16 0.75 0.00 -1.01 0.00 0.00 64.21 63.47 2h4r n SER 170 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 2h4r h LYS 171 N 0.56 0.00 -3.05 1.43 1.79 -1.20 -3.37 116.57 112.74 2h4r h LYS 171 Ca 0.00 0.00 -0.59 0.00 -2.18 0.00 0.00 60.65 57.88 2h4r h LYS 171 Cb 0.00 0.00 -0.40 0.00 -1.58 0.00 0.00 32.23 30.25 2h4r h LYS 171 CO 0.00 0.00 -0.77 0.42 -1.08 0.00 0.00 179.45 178.02 2h4r s ILE 172 N -3.68 0.84 0.45 1.86 1.01 -1.26 -5.02 121.20 115.39 2h4r s ILE 172 Ca 0.00 -1.87 0.07 0.00 0.00 0.00 0.00 60.65 58.85 2h4r s ILE 172 Cb 0.10 -1.61 0.02 0.00 0.01 0.00 0.00 42.46 40.97 2h4r s ILE 172 CO 0.44 -0.84 0.61 -0.75 0.00 0.00 0.00 174.94 174.40 2h4r s LYS 173 N 1.04 2.77 -1.68 2.79 2.47 -1.26 -3.11 119.74 122.75 2h4r s LYS 173 Ca 0.15 -1.16 -0.18 0.00 -1.56 0.00 0.00 55.97 53.22 2h4r s LYS 173 Cb -0.21 -2.71 0.15 0.00 -1.46 0.00 0.00 37.83 33.60 2h4r s LYS 173 CO -0.10 -0.37 0.82 0.09 0.16 0.00 0.00 175.35 175.95 2h4r n ASN 174 N -1.95 -3.51 -0.09 1.43 3.02 -1.26 -4.86 115.26 108.04 2h4r n ASN 174 Ca 0.08 -0.98 -0.06 0.00 -0.03 0.00 0.00 54.58 53.59 2h4r n ASN 174 Cb 0.59 -2.93 0.01 0.00 -0.61 0.00 0.00 39.78 36.84 2h4r n ASN 174 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 2h4r h LEU 175 N -1.59 -0.16 -9.35 3.41 5.85 -1.86 -3.39 115.31 108.23 2h4r h LEU 175 Ca -0.59 0.08 -0.59 0.00 0.84 0.00 0.00 57.88 57.62 2h4r h LEU 175 Cb 1.38 0.14 -0.09 0.00 0.37 0.00 0.00 40.66 42.46 2h4r h LEU 175 CO 0.76 -0.04 -0.30 -0.76 -0.34 0.00 0.00 178.44 177.76 2h4r s LEU 176 N -10.46 4.27 0.68 2.25 1.43 -1.26 -5.04 118.68 110.56 2h4r s LEU 176 Ca -0.13 0.58 -0.03 0.00 -1.03 0.00 0.00 54.13 53.52 2h4r s LEU 176 Cb 0.13 -2.41 0.09 0.00 0.03 0.00 0.00 46.19 44.02 2h4r s LEU 176 CO 0.70 0.12 0.96 -0.94 0.23 0.00 0.00 176.35 177.42 2h4r s SER 177 N 0.29 4.65 0.46 2.29 1.04 -1.26 -4.96 113.70 116.21 2h4r s SER 177 Ca 0.18 -0.00 0.11 0.00 0.48 0.00 0.00 55.95 56.73 2h4r s SER 177 Cb -0.13 -0.58 1.06 0.00 0.10 0.00 0.00 66.02 66.47 2h4r s SER 177 CO 0.05 -1.64 2.10 0.77 0.98 0.00 0.00 173.24 175.50 2h4r h SER 178 N -0.45 0.25 0.72 7.02 4.64 -1.97 -1.61 113.55 122.15 2h4r h SER 178 Ca -0.41 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.91 2h4r h SER 178 Cb 1.29 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 2h4r h SER 178 CO 0.49 0.18 0.00 -0.67 -0.87 0.00 0.00 176.83 175.96 2h4r n ASP 179 N -4.50 0.00 0.05 4.97 -0.08 -1.26 -3.51 116.55 112.22 2h4r n ASP 179 Ca 0.00 0.10 0.12 0.00 -1.51 0.00 0.00 54.79 53.51 2h4r n ASP 179 Cb 0.08 -0.37 0.17 0.00 2.34 0.00 0.00 41.12 43.34 2h4r n ASP 179 CO 0.00 0.00 0.00 0.47 0.12 0.00 0.00 177.20 177.79 2h4r n ASP 180 N -1.37 0.68 -3.88 1.67 8.00 -0.60 -4.81 116.55 116.24 2h4r n ASP 180 Ca 0.11 0.08 -0.29 0.00 0.71 0.00 0.00 54.79 55.40 2h4r n ASP 180 Cb 0.27 0.21 -0.16 0.00 -0.02 0.00 0.00 41.12 41.42 2h4r n ASP 180 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2h4r s VAL 181 N -3.16 1.18 0.43 2.53 1.01 -1.23 -4.92 120.40 116.24 2h4r s VAL 181 Ca 0.06 -0.94 0.03 0.00 0.00 0.00 0.00 61.98 61.14 2h4r s VAL 181 Cb 0.14 -1.50 -0.04 0.00 0.00 0.00 0.00 36.38 34.98 2h4r s VAL 181 CO 0.72 -0.09 0.05 -0.54 0.00 0.00 0.00 175.10 175.24 2h4r s LYS 182 N 1.56 1.98 0.56 2.72 1.02 -1.26 -4.73 119.74 121.59 2h4r s LYS 182 Ca -0.03 -2.19 0.27 0.00 0.02 0.00 0.00 55.97 54.03 2h4r s LYS 182 Cb -0.18 -1.19 1.63 0.00 -0.52 0.00 0.00 37.83 37.57 2h4r s LYS 182 CO -0.07 -0.30 2.19 0.00 -0.92 0.00 0.00 175.35 176.25 2h4r h ALA 183 N 1.69 1.55 0.20 5.17 0.00 -1.82 -2.54 119.26 123.50 2h4r h ALA 183 Ca -0.41 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.46 2h4r h ALA 183 Cb 1.28 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.06 2h4r h ALA 183 CO 0.70 0.05 -0.10 1.15 0.00 0.00 0.00 179.25 181.05 2h4r h THR 184 N 0.00 0.89 -0.49 0.00 2.02 -1.89 -3.36 112.91 110.07 2h4r h THR 184 Ca -0.00 -0.53 -0.40 0.00 0.77 0.00 0.00 66.41 66.25 2h4r h THR 184 Cb 0.09 1.20 0.02 0.00 -1.74 0.00 0.00 68.15 67.72 2h4r h THR 184 CO 0.00 0.12 0.09 0.35 0.37 0.00 0.00 175.52 176.45 2h4r n THR 185 N -5.09 0.00 -0.02 3.16 -2.24 -0.96 -4.91 114.28 104.22 2h4r n THR 185 Ca -0.09 0.00 -0.04 0.00 -2.27 0.00 0.00 64.05 61.65 2h4r n THR 185 Cb 0.22 -0.05 -0.02 0.00 -2.10 0.00 0.00 70.33 68.38 2h4r n THR 185 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2h4r n ARG 186 N 0.98 0.11 -3.81 -0.78 1.74 -1.26 -4.65 116.66 108.99 2h4r n ARG 186 Ca 0.11 0.03 -0.15 0.00 -0.77 0.00 0.00 57.85 57.07 2h4r n ARG 186 Cb 0.03 -0.94 -0.16 0.00 -1.02 0.00 0.00 32.46 30.37 2h4r n ARG 186 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 2h4r s LEU 187 N -5.64 1.17 -0.19 0.55 2.96 -1.25 -1.26 118.68 115.01 2h4r s LEU 187 Ca -0.07 0.02 0.01 0.00 -0.22 0.00 0.00 54.13 53.88 2h4r s LEU 187 Cb 0.02 -0.10 0.02 0.00 0.50 0.00 0.00 46.19 46.64 2h4r s LEU 187 CO 0.10 -0.11 -0.19 -0.63 -1.32 0.00 0.00 176.35 174.20 2h4r s ILE 188 N 0.97 2.05 -0.65 6.68 -1.09 0.04 -1.41 121.20 127.78 2h4r s ILE 188 Ca -0.08 -0.99 -0.17 0.00 -2.23 0.00 0.00 60.65 57.18 2h4r s ILE 188 Cb -0.12 -1.88 0.14 0.00 -1.58 0.00 0.00 42.46 39.02 2h4r s ILE 188 CO -0.02 0.48 0.67 -0.22 -1.23 0.00 0.00 174.94 174.62 2h4r s LEU 189 N 1.28 6.00 0.18 2.97 2.96 -0.45 0.48 118.68 132.09 2h4r s LEU 189 Ca 0.04 -1.91 -0.20 0.00 -0.22 0.00 0.00 54.13 51.84 2h4r s LEU 189 Cb -0.14 -2.25 -0.08 0.00 0.50 0.00 0.00 46.19 44.22 2h4r s LEU 189 CO -0.12 -0.89 0.68 0.68 -1.32 0.00 0.00 176.35 175.39 2h4r s VAL 190 N 1.67 4.60 -0.30 1.68 -7.23 -0.58 -2.22 120.40 118.03 2h4r s VAL 190 Ca 0.11 1.29 0.02 0.00 -1.81 0.00 0.00 61.98 61.59 2h4r s VAL 190 Cb -0.22 -3.90 0.16 0.00 0.56 0.00 0.00 36.38 32.98 2h4r s VAL 190 CO 0.00 0.33 0.41 0.54 -0.31 0.00 0.00 175.10 176.07 2h4r s ASN 191 N -1.48 0.45 0.39 4.85 2.20 -0.81 -2.09 114.94 118.45 2h4r s ASN 191 Ca 0.39 -0.52 0.08 0.00 -0.94 0.00 0.00 52.86 51.86 2h4r s ASN 191 Cb -0.18 1.06 -0.06 0.00 -2.00 0.00 0.00 41.25 40.07 2h4r s ASN 191 CO 0.21 -0.34 0.10 0.00 -2.94 0.00 0.00 177.10 174.13 2h4r s ALA 192 N 2.42 3.40 -0.28 3.54 0.00 -1.19 -2.27 121.76 127.37 2h4r s ALA 192 Ca 0.10 -2.09 -0.16 0.00 0.00 0.00 0.00 51.96 49.82 2h4r s ALA 192 Cb -0.12 -0.30 0.09 0.00 0.00 0.00 0.00 23.12 22.78 2h4r s ALA 192 CO -0.27 -0.08 0.72 -1.50 0.00 0.00 0.00 175.76 174.63 2h4r s ILE 193 N -2.59 -0.04 -0.15 0.00 2.07 -0.37 -1.12 121.20 119.00 2h4r s ILE 193 Ca 0.38 0.00 -0.01 0.00 -1.41 0.00 0.00 60.65 59.61 2h4r s ILE 193 Cb 0.03 -1.00 -0.02 0.00 0.13 0.00 0.00 42.46 41.61 2h4r s ILE 193 CO 0.21 0.00 -0.10 -0.47 -1.91 0.00 0.00 174.94 172.67 2h4r s TYR 194 N 1.65 2.87 -0.23 3.50 6.14 0.56 -1.49 117.35 130.35 2h4r s TYR 194 Ca -0.10 -0.65 -0.09 0.00 0.64 0.00 0.00 57.07 56.87 2h4r s TYR 194 Cb -0.05 -1.91 -0.04 0.00 0.42 0.00 0.00 41.96 40.38 2h4r s TYR 194 CO -0.19 -0.25 0.11 0.12 0.64 0.00 0.00 175.55 175.98 2h4r s PHE 195 N 0.55 3.20 -0.15 4.97 5.36 -0.99 -0.83 117.98 130.07 2h4r s PHE 195 Ca -0.07 -0.06 0.01 0.00 -0.96 0.00 0.00 56.93 55.85 2h4r s PHE 195 Cb -0.15 -2.23 0.02 0.00 -0.34 0.00 0.00 43.02 40.32 2h4r s PHE 195 CO 0.03 -0.10 -0.18 0.15 -1.46 0.00 0.00 175.22 173.66 2h4r s LYS 196 N 1.20 2.72 0.00 10.12 1.02 -0.14 -4.75 119.74 129.91 2h4r s LYS 196 Ca 0.06 -0.73 -0.29 0.00 0.02 0.00 0.00 55.97 55.03 2h4r s LYS 196 Cb -0.14 -2.33 0.08 0.00 -0.52 0.00 0.00 37.83 34.91 2h4r s LYS 196 CO 0.04 -0.16 0.69 0.00 -0.92 0.00 0.00 175.35 175.01 2h4r s ALA 197 N 1.20 -1.74 -0.02 5.17 0.00 -1.26 0.16 121.76 125.27 2h4r s ALA 197 Ca 0.01 1.09 0.04 0.00 0.00 0.00 0.00 51.96 53.10 2h4r s ALA 197 Cb -0.14 0.21 -0.03 0.00 0.00 0.00 0.00 23.12 23.17 2h4r s ALA 197 CO -0.09 -0.49 -0.11 -2.00 0.00 0.00 0.00 175.76 173.07 2h4r s GLU 198 N -2.00 2.48 0.58 0.00 2.12 -1.26 -1.47 118.70 119.15 2h4r s GLU 198 Ca -0.06 -0.73 -0.20 0.00 0.36 0.00 0.00 54.97 54.34 2h4r s GLU 198 Cb -0.00 -2.42 -0.04 0.00 0.26 0.00 0.00 34.13 31.93 2h4r s GLU 198 CO 0.02 0.61 1.25 -1.58 -0.54 0.00 0.00 175.26 175.02 2h4r s TRP 199 N -0.86 2.36 0.01 5.30 0.23 0.16 -0.45 118.94 125.69 2h4r s TRP 199 Ca 0.14 1.48 -0.25 0.00 -2.03 0.00 0.00 56.10 55.44 2h4r s TRP 199 Cb -0.11 -3.58 -0.19 0.00 0.03 0.00 0.00 33.47 29.63 2h4r s TRP 199 CO 0.04 -2.41 1.41 1.49 0.96 0.00 0.00 176.95 178.44 2h4r h GLU 200 N 1.07 0.01 -5.00 4.98 4.57 -1.27 -3.39 114.58 115.55 2h4r h GLU 200 Ca -0.51 -0.00 -0.67 0.00 -1.18 0.00 0.00 59.36 57.00 2h4r h GLU 200 Cb 1.30 -0.00 -0.35 0.00 -0.16 0.00 0.00 28.75 29.54 2h4r h GLU 200 CO 0.56 0.35 -0.82 0.08 -1.18 0.00 0.00 179.01 177.99 2h4r s VAL 201 N -4.84 2.27 0.16 0.32 1.01 -1.26 -4.95 120.40 113.11 2h4r s VAL 201 Ca -0.15 -1.06 0.03 0.00 0.00 0.00 0.00 61.98 60.81 2h4r s VAL 201 Cb 0.03 -2.06 -0.04 0.00 0.00 0.00 0.00 36.38 34.31 2h4r s VAL 201 CO 0.67 0.38 0.27 -1.59 0.00 0.00 0.00 175.10 174.83 2h4r s LYS 202 N 1.27 3.35 0.78 2.72 -2.85 -1.26 -5.05 119.74 118.70 2h4r s LYS 202 Ca 0.02 -0.66 -0.11 0.00 -1.00 0.00 0.00 55.97 54.21 2h4r s LYS 202 Cb -0.15 -2.90 0.06 0.00 -2.06 0.00 0.00 37.83 32.78 2h4r s LYS 202 CO -0.10 0.50 1.08 -0.06 0.10 0.00 0.00 175.35 176.88 2h4r s PHE 203 N -1.77 2.76 -0.25 1.78 0.40 -0.25 -5.00 117.98 115.63 2h4r s PHE 203 Ca 0.34 1.34 -0.09 0.00 -0.60 0.00 0.00 56.93 57.91 2h4r s PHE 203 Cb -0.11 -3.04 -0.04 0.00 0.51 0.00 0.00 43.02 40.34 2h4r s PHE 203 CO 0.28 -1.74 0.13 -0.65 0.70 0.00 0.00 175.22 173.93 2h4r s GLN 204 N -5.03 3.86 0.29 0.44 -1.52 -1.26 -4.68 119.66 111.76 2h4r s GLN 204 Ca 0.61 -0.37 0.03 0.00 -1.95 0.00 0.00 55.36 53.67 2h4r s GLN 204 Cb -0.16 -3.48 0.73 0.00 -0.22 0.00 0.00 33.01 29.88 2h4r s GLN 204 CO 0.55 -0.11 1.66 0.00 -0.25 0.00 0.00 175.29 177.14 2h4r h ALA 205 N 8.07 1.34 0.00 6.09 0.00 -1.95 0.12 119.26 132.93 2h4r h ALA 205 Ca -0.37 0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 2h4r h ALA 205 Cb 1.18 0.27 -0.00 0.00 0.00 0.00 0.00 17.79 19.24 2h4r h ALA 205 CO 0.59 -0.45 -0.06 1.05 0.00 0.00 0.00 179.25 180.38 2h4r h GLU 206 N 0.25 0.00 -0.01 0.00 9.09 -1.96 -2.74 114.58 119.21 2h4r h GLU 206 Ca 0.56 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.97 2h4r h GLU 206 Cb 1.13 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.23 2h4r h GLU 206 CO -0.62 0.06 -0.27 1.63 0.05 0.00 0.00 179.01 179.86 2h4r n LYS 207 N -3.48 1.07 -2.61 1.06 5.02 0.42 -4.86 118.16 114.78 2h4r n LYS 207 Ca -0.02 -0.71 -0.42 0.00 -2.02 0.00 0.00 58.31 55.14 2h4r n LYS 207 Cb 0.19 -1.49 -0.03 0.00 -0.02 0.00 0.00 35.03 33.68 2h4r n LYS 207 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 2h4r s THR 208 N -2.42 4.57 0.11 -0.18 2.01 -1.04 -4.20 115.64 114.49 2h4r s THR 208 Ca 0.25 1.85 -0.07 0.00 0.31 0.00 0.00 61.69 64.03 2h4r s THR 208 Cb 0.19 -4.18 -0.01 0.00 0.01 0.00 0.00 72.50 68.50 2h4r s THR 208 CO 0.50 0.13 0.17 -0.94 -0.69 0.00 0.00 174.62 173.79 2h4r s SER 209 N 1.05 0.17 -0.02 3.53 1.04 -0.77 -4.95 113.70 113.76 2h4r s SER 209 Ca 0.54 -0.83 -0.30 0.00 0.48 0.00 0.00 55.95 55.84 2h4r s SER 209 Cb -0.24 0.34 -0.04 0.00 0.10 0.00 0.00 66.02 66.19 2h4r s SER 209 CO 0.27 -0.76 1.15 -0.63 0.98 0.00 0.00 173.24 174.26 2h4r s ILE 210 N -3.92 4.34 0.00 -1.02 -1.09 -1.26 -0.49 121.20 117.77 2h4r s ILE 210 Ca 0.11 1.67 -0.08 0.00 -2.23 0.00 0.00 60.65 60.11 2h4r s ILE 210 Cb 0.05 -4.07 0.00 0.00 -1.58 0.00 0.00 42.46 36.87 2h4r s ILE 210 CO -0.06 0.06 0.16 -1.10 -1.23 0.00 0.00 174.94 172.76 2h4r s GLN 211 N 1.69 0.52 0.15 2.79 -1.52 -0.63 -4.91 119.66 117.75 2h4r s GLN 211 Ca 0.55 -0.40 -0.30 0.00 -1.95 0.00 0.00 55.36 53.26 2h4r s GLN 211 Cb -0.25 0.22 -0.08 0.00 -0.22 0.00 0.00 33.01 32.68 2h4r s GLN 211 CO 0.24 -0.13 1.30 -1.25 -0.25 0.00 0.00 175.29 175.21 2h4r s PRO 212 N -1.47 4.39 -0.23 2.91 0.04 -1.26 -1.58 135.00 137.79 2h4r s PRO 212 Ca -0.14 1.99 -0.05 0.00 0.04 0.00 0.00 61.00 62.84 2h4r s PRO 212 Cb -0.07 -3.24 -0.01 0.00 0.04 0.00 0.00 34.50 31.22 2h4r s PRO 212 CO 0.01 -0.28 -0.00 0.12 0.04 0.00 0.00 177.00 176.89 2h4r s PHE 213 N 0.50 3.01 -0.50 0.56 5.36 0.24 -4.87 117.98 122.28 2h4r s PHE 213 Ca 0.59 -0.82 -0.29 0.00 -0.96 0.00 0.00 56.93 55.44 2h4r s PHE 213 Cb -0.35 -2.15 0.02 0.00 -0.34 0.00 0.00 43.02 40.20 2h4r s PHE 213 CO 0.34 -0.51 1.24 1.03 -1.46 0.00 0.00 175.22 175.87 2h4r s ARG 214 N 1.51 3.60 -0.02 10.12 0.52 0.15 -0.41 118.95 134.43 2h4r s ARG 214 Ca 0.06 0.56 -0.18 0.00 -0.52 0.00 0.00 55.73 55.64 2h4r s ARG 214 Cb -0.15 -3.98 -0.10 0.00 0.52 0.00 0.00 34.95 31.24 2h4r s ARG 214 CO -0.01 -1.55 0.78 -0.07 0.02 0.00 0.00 175.30 174.47 2h4r h LEU 215 N 11.80 -0.56 0.00 2.53 4.07 -1.71 -3.35 115.31 128.10 2h4r h LEU 215 Ca -0.25 0.02 0.00 0.00 0.08 0.00 0.00 57.88 57.73 2h4r h LEU 215 Cb 1.07 0.14 0.00 0.00 1.08 0.00 0.00 40.66 42.96 2h4r h LEU 215 CO 1.14 -0.17 0.00 -0.24 -1.08 0.00 0.00 178.44 178.09 2h4r n SER 216 N -5.07 1.03 0.05 -0.43 2.88 -0.70 -4.39 113.62 107.01 2h4r n SER 216 Ca -0.08 -0.89 -0.15 0.00 -1.33 0.00 0.00 58.87 56.42 2h4r n SER 216 Cb 0.26 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.67 2h4r n SER 216 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 2h4r h LYS 217 N 0.00 0.50 0.09 -1.46 1.57 -1.86 -3.38 116.57 112.03 2h4r h LYS 217 Ca 0.00 -0.52 -0.18 0.00 -1.87 0.00 0.00 60.65 58.08 2h4r h LYS 217 Cb 0.00 0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.45 2h4r h LYS 217 CO 0.00 1.16 -0.90 -0.91 -0.57 0.00 0.00 179.45 178.23 2h4r h ASN 218 N 0.29 0.29 -2.80 0.86 2.35 -1.95 -3.47 115.58 111.14 2h4r h ASN 218 Ca -0.09 -0.88 -0.65 0.00 -0.55 0.00 0.00 56.30 54.14 2h4r h ASN 218 Cb 1.57 -0.09 -0.06 0.00 0.05 0.00 0.00 38.32 39.79 2h4r h ASN 218 CO 0.17 1.40 -0.50 -0.54 -1.65 0.00 0.00 177.43 176.31 2h4r s LYS 219 N -2.39 3.40 0.25 0.81 1.02 -1.26 -5.08 119.74 116.48 2h4r s LYS 219 Ca -0.19 -0.29 0.01 0.00 0.02 0.00 0.00 55.97 55.52 2h4r s LYS 219 Cb 0.02 -3.09 -0.03 0.00 -0.52 0.00 0.00 37.83 34.20 2h4r s LYS 219 CO 0.75 0.70 0.20 -1.54 -0.92 0.00 0.00 175.35 174.54 2h4r s SER 220 N -1.69 0.70 -0.16 2.83 1.04 -1.26 -1.72 113.70 113.44 2h4r s SER 220 Ca 0.24 -1.51 -0.13 0.00 0.48 0.00 0.00 55.95 55.03 2h4r s SER 220 Cb -0.12 0.46 0.04 0.00 0.10 0.00 0.00 66.02 66.50 2h4r s SER 220 CO 0.15 -0.94 0.41 -0.75 0.98 0.00 0.00 173.24 173.09 2h4r s LYS 221 N -3.87 0.46 0.57 4.02 2.20 0.46 -4.85 119.74 118.73 2h4r s LYS 221 Ca 0.39 0.63 -0.17 0.00 -0.36 0.00 0.00 55.97 56.46 2h4r s LYS 221 Cb 0.05 0.17 -0.04 0.00 -1.51 0.00 0.00 37.83 36.49 2h4r s LYS 221 CO 0.18 -0.08 1.07 -2.14 -0.36 0.00 0.00 175.35 174.01 2h4r s PRO 222 N 0.51 3.37 0.05 4.03 0.02 -1.26 0.82 135.00 142.54 2h4r s PRO 222 Ca -0.02 1.29 -0.16 0.00 0.02 0.00 0.00 61.00 62.13 2h4r s PRO 222 Cb -0.04 -2.03 0.03 0.00 0.02 0.00 0.00 34.50 32.47 2h4r s PRO 222 CO -0.03 -0.78 0.35 0.08 -0.33 0.00 0.00 177.00 176.30 2h4r s VAL 223 N -2.28 0.07 -0.20 3.83 1.01 -0.61 -4.82 120.40 117.40 2h4r s VAL 223 Ca 0.66 -0.58 -0.29 0.00 0.00 0.00 0.00 61.98 61.76 2h4r s VAL 223 Cb -0.17 -0.95 -0.02 0.00 0.00 0.00 0.00 36.38 35.23 2h4r s VAL 223 CO 0.33 -0.32 1.52 -0.54 0.00 0.00 0.00 175.10 176.09 2h4r s LYS 224 N -2.57 3.93 -0.30 2.72 1.02 -1.26 -1.60 119.74 121.68 2h4r s LYS 224 Ca -0.05 1.67 -0.10 0.00 0.02 0.00 0.00 55.97 57.51 2h4r s LYS 224 Cb -0.01 -3.96 -0.02 0.00 -0.52 0.00 0.00 37.83 33.32 2h4r s LYS 224 CO -0.03 -1.12 0.15 1.41 -0.92 0.00 0.00 175.35 174.84 2h4r s MET 225 N 4.34 3.47 0.53 1.68 1.75 0.36 -0.98 119.30 130.46 2h4r s MET 225 Ca 0.67 -0.63 -0.11 0.00 -1.25 0.00 0.00 55.69 54.37 2h4r s MET 225 Cb -0.24 -3.57 -0.05 0.00 2.84 0.00 0.00 34.83 33.81 2h4r s MET 225 CO 0.26 -0.36 0.93 -1.64 -0.65 0.00 0.00 175.02 173.57 2h4r s MET 226 N 1.64 3.72 -0.07 4.11 1.00 -0.73 -1.84 119.30 127.13 2h4r s MET 226 Ca 0.05 0.66 -0.19 0.00 0.00 0.00 0.00 55.69 56.22 2h4r s MET 226 Cb -0.17 -2.20 0.04 0.00 0.00 0.00 0.00 34.83 32.51 2h4r s MET 226 CO 0.07 -0.33 0.44 -0.47 0.00 0.00 0.00 175.02 174.73 2h4r s TYR 227 N -2.81 -0.39 -0.01 -0.03 5.04 -1.26 -1.86 117.35 116.02 2h4r s TYR 227 Ca 0.54 0.74 -0.27 0.00 -2.44 0.00 0.00 57.07 55.65 2h4r s TYR 227 Cb -0.10 0.20 0.06 0.00 0.35 0.00 0.00 41.96 42.46 2h4r s TYR 227 CO 0.42 -0.41 0.60 0.00 -1.34 0.00 0.00 175.55 174.82 2h4r s MET 228 N -0.88 1.02 -0.34 4.97 0.23 -0.99 -4.27 119.30 119.04 2h4r s MET 228 Ca -0.09 0.06 -0.09 0.00 -1.03 0.00 0.00 55.69 54.54 2h4r s MET 228 Cb -0.03 0.48 0.02 0.00 -1.53 0.00 0.00 34.83 33.77 2h4r s MET 228 CO 0.05 -0.34 0.14 1.03 -2.03 0.00 0.00 175.02 173.87 2h4r s ARG 229 N -1.62 2.86 0.27 3.16 0.52 -1.26 -1.51 118.95 121.37 2h4r s ARG 229 Ca -0.09 -1.03 -0.21 0.00 -0.52 0.00 0.00 55.73 53.87 2h4r s ARG 229 Cb -0.01 -3.56 0.02 0.00 0.52 0.00 0.00 34.95 31.93 2h4r s ARG 229 CO 0.05 -0.61 0.74 0.34 0.02 0.00 0.00 175.30 175.85 2h4r s ASP 230 N 1.50 -0.25 -0.09 0.23 -1.08 -0.76 -4.96 116.67 111.26 2h4r s ASP 230 Ca 0.01 -0.59 -0.19 0.00 -0.52 0.00 0.00 52.55 51.26 2h4r s ASP 230 Cb -0.19 0.71 -0.04 0.00 -1.46 0.00 0.00 42.92 41.94 2h4r s ASP 230 CO 0.05 -1.31 0.54 -0.89 0.52 0.00 0.00 175.17 174.08 2h4r s THR 231 N -3.86 5.12 0.05 1.71 2.01 -1.26 1.00 115.64 120.41 2h4r s THR 231 Ca 0.11 1.09 -0.03 0.00 0.31 0.00 0.00 61.69 63.17 2h4r s THR 231 Cb -0.06 -3.88 -0.03 0.00 0.01 0.00 0.00 72.50 68.55 2h4r s THR 231 CO 0.06 0.33 0.04 -0.36 -0.69 0.00 0.00 174.62 174.01 2h4r s PHE 232 N 0.49 0.36 0.02 4.92 0.40 0.15 -4.85 117.98 119.47 2h4r s PHE 232 Ca 0.29 -0.82 -0.30 0.00 -0.60 0.00 0.00 56.93 55.50 2h4r s PHE 232 Cb -0.16 -0.26 -0.07 0.00 0.51 0.00 0.00 43.02 43.04 2h4r s PHE 232 CO 0.13 -0.40 1.63 -2.14 0.70 0.00 0.00 175.22 175.15 2h4r s PRO 233 N -3.47 4.20 -0.03 0.24 0.02 -1.26 -0.27 135.00 134.42 2h4r s PRO 233 Ca 0.03 2.25 0.01 0.00 0.02 0.00 0.00 61.00 63.30 2h4r s PRO 233 Cb 0.04 -3.75 0.02 0.00 0.02 0.00 0.00 34.50 30.83 2h4r s PRO 233 CO -0.08 -0.76 -0.04 0.08 -0.33 0.00 0.00 177.00 175.86 2h4r s VAL 234 N 3.16 0.46 -0.16 3.83 1.01 -0.08 -0.86 120.40 127.76 2h4r s VAL 234 Ca 0.73 -0.11 -0.04 0.00 0.00 0.00 0.00 61.98 62.56 2h4r s VAL 234 Cb -0.37 -0.48 -0.03 0.00 0.00 0.00 0.00 36.38 35.51 2h4r s VAL 234 CO 0.31 0.19 -0.03 -0.22 0.00 0.00 0.00 175.10 175.36 2h4r s LEU 235 N 0.72 3.28 -0.78 3.92 2.96 -0.10 -1.84 118.68 126.85 2h4r s LEU 235 Ca -0.09 -0.13 -0.07 0.00 -0.22 0.00 0.00 54.13 53.62 2h4r s LEU 235 Cb -0.12 -1.80 0.20 0.00 0.50 0.00 0.00 46.19 44.97 2h4r s LEU 235 CO -0.00 0.16 0.66 -0.63 -1.32 0.00 0.00 176.35 175.22 2h4r s ILE 236 N 0.44 4.71 -1.14 6.68 1.01 -1.26 -0.95 121.20 130.69 2h4r s ILE 236 Ca -0.03 -2.94 -0.17 0.00 0.00 0.00 0.00 60.65 57.50 2h4r s ILE 236 Cb -0.14 -3.95 0.12 0.00 0.01 0.00 0.00 42.46 38.49 2h4r s ILE 236 CO 0.03 -0.99 1.45 -0.04 0.00 0.00 0.00 174.94 175.39 2h4r s MET 237 N -0.26 3.88 0.16 2.79 -1.94 -0.89 -4.85 119.30 118.19 2h4r s MET 237 Ca 0.20 -2.01 -0.12 0.00 -1.71 0.00 0.00 55.69 52.05 2h4r s MET 237 Cb -0.14 -5.20 0.04 0.00 2.01 0.00 0.00 34.83 31.53 2h4r s MET 237 CO -0.07 -1.97 1.63 0.93 -0.01 0.00 0.00 175.02 175.53 2h4r h GLU 238 N 8.06 0.92 0.00 2.03 5.08 -1.95 -2.34 114.58 126.38 2h4r h GLU 238 Ca 0.30 -0.28 -0.01 0.00 -1.00 0.00 0.00 59.36 58.37 2h4r h GLU 238 Cb 0.93 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 30.08 2h4r h GLU 238 CO 1.30 0.92 -0.03 0.87 -1.00 0.00 0.00 179.01 181.07 2h4r h LYS 239 N 0.80 0.00 -0.22 2.33 1.57 -1.94 -2.78 116.57 116.33 2h4r h LYS 239 Ca 0.16 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.94 2h4r h LYS 239 Cb 0.49 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.80 2h4r h LYS 239 CO 0.02 0.03 0.00 -0.12 -0.57 0.00 0.00 179.45 178.82 2h4r n MET 240 N -4.24 1.90 -3.42 3.15 1.56 -1.15 -5.03 117.12 109.89 2h4r n MET 240 Ca -0.03 -1.73 -0.19 0.00 -0.27 0.00 0.00 57.70 55.48 2h4r n MET 240 Cb 0.12 -1.28 0.06 0.00 2.15 0.00 0.00 33.22 34.27 2h4r n MET 240 CO 0.00 0.00 0.00 0.09 -0.73 0.00 0.00 175.97 175.33 2h4r n ASN 241 N 0.70 -4.75 -3.68 6.12 4.13 -0.91 -4.92 115.26 111.94 2h4r n ASN 241 Ca 0.11 -0.76 -0.05 0.00 1.68 0.00 0.00 54.58 55.56 2h4r n ASN 241 Cb 0.39 -4.75 -0.01 0.00 -1.54 0.00 0.00 39.78 33.88 2h4r n ASN 241 CO 0.00 0.00 0.00 0.72 0.28 0.00 0.00 177.26 178.26 2h4r s PHE 242 N -3.43 -0.11 0.02 3.10 -0.12 -1.01 -1.90 117.98 114.52 2h4r s PHE 242 Ca 0.31 -0.30 0.02 0.00 -0.05 0.00 0.00 56.93 56.90 2h4r s PHE 242 Cb -0.06 0.69 -0.01 0.00 -0.63 0.00 0.00 43.02 43.01 2h4r s PHE 242 CO 0.77 -1.07 -0.06 0.15 -0.05 0.00 0.00 175.22 174.95 2h4r s LYS 243 N -3.35 0.45 -0.01 1.99 1.02 -0.23 -2.10 119.74 117.52 2h4r s LYS 243 Ca 0.13 -0.49 0.05 0.00 0.02 0.00 0.00 55.97 55.68 2h4r s LYS 243 Cb -0.04 -0.31 -0.01 0.00 -0.52 0.00 0.00 37.83 36.95 2h4r s LYS 243 CO 0.05 0.07 -0.16 1.41 -0.92 0.00 0.00 175.35 175.80 2h4r s MET 244 N -0.91 1.28 0.12 1.68 1.75 -0.12 -1.26 119.30 121.84 2h4r s MET 244 Ca -0.05 -0.58 0.10 0.00 -1.25 0.00 0.00 55.69 53.92 2h4r s MET 244 Cb -0.06 -1.24 -0.04 0.00 2.84 0.00 0.00 34.83 36.32 2h4r s MET 244 CO 0.00 0.34 -0.25 -1.50 -0.65 0.00 0.00 175.02 172.96 2h4r s ILE 245 N -0.39 2.35 -0.21 10.11 2.07 -0.86 -0.92 121.20 133.34 2h4r s ILE 245 Ca 0.06 -1.67 -0.04 0.00 -1.41 0.00 0.00 60.65 57.59 2h4r s ILE 245 Cb -0.06 -2.03 -0.01 0.00 0.13 0.00 0.00 42.46 40.48 2h4r s ILE 245 CO -0.01 0.13 -0.03 -0.70 -1.91 0.00 0.00 174.94 172.43 2h4r s GLU 246 N -1.97 3.45 -0.54 3.50 2.12 -0.03 -2.06 118.70 123.17 2h4r s GLU 246 Ca 0.14 -0.59 -0.01 0.00 0.36 0.00 0.00 54.97 54.87 2h4r s GLU 246 Cb -0.10 -3.04 0.14 0.00 0.26 0.00 0.00 34.13 31.39 2h4r s GLU 246 CO 0.06 -0.13 0.33 -0.51 -0.54 0.00 0.00 175.26 174.47 2h4r s LEU 247 N 1.34 5.03 0.44 2.70 1.43 -0.56 -4.11 118.68 124.95 2h4r s LEU 247 Ca 0.04 -2.68 -0.24 0.00 -1.03 0.00 0.00 54.13 50.22 2h4r s LEU 247 Cb -0.14 -1.79 -0.08 0.00 0.03 0.00 0.00 46.19 44.21 2h4r s LEU 247 CO -0.01 -0.38 1.24 -2.84 0.23 0.00 0.00 176.35 174.59 2h4r s PRO 248 N 0.19 3.78 0.39 1.29 0.02 -1.26 -1.93 135.00 137.48 2h4r s PRO 248 Ca 0.15 1.99 -0.04 0.00 0.02 0.00 0.00 61.00 63.12 2h4r s PRO 248 Cb -0.22 -2.55 0.08 0.00 0.02 0.00 0.00 34.50 31.84 2h4r s PRO 248 CO -0.03 -0.59 0.53 0.66 -0.33 0.00 0.00 177.00 177.23 2h4r n TYR 249 N -0.27 -3.58 -1.73 6.54 4.02 0.70 -1.18 117.16 121.66 2h4r n TYR 249 Ca 0.06 -0.67 -0.42 0.00 -0.01 0.00 0.00 57.90 56.86 2h4r n TYR 249 Cb 0.46 -0.40 -0.03 0.00 -0.02 0.00 0.00 39.34 39.35 2h4r n TYR 249 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 176.86 176.13 2h4r n VAL 250 N -2.44 0.25 -0.86 -0.72 0.31 0.40 -0.89 118.33 114.38 2h4r n VAL 250 Ca 0.08 -0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.34 2h4r n VAL 250 Cb 0.27 -1.99 0.00 0.00 -0.91 0.00 0.00 33.84 31.20 2h4r n VAL 250 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 2h4r n LYS 251 N 3.54 -0.96 -2.57 5.55 5.02 -1.26 -3.21 118.16 124.27 2h4r n LYS 251 Ca 0.14 0.24 -0.21 0.00 -2.02 0.00 0.00 58.31 56.46 2h4r n LYS 251 Cb 0.35 -4.32 0.00 0.00 -0.02 0.00 0.00 35.03 31.05 2h4r n LYS 251 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 2h4r n ARG 252 N -0.72 -2.56 -0.01 1.97 0.63 -0.07 -4.88 116.66 111.02 2h4r n ARG 252 Ca 0.00 0.97 -0.12 0.00 -0.92 0.00 0.00 57.85 57.78 2h4r n ARG 252 Cb 0.24 -5.66 0.01 0.00 0.45 0.00 0.00 32.46 27.49 2h4r n ARG 252 CO 0.00 0.00 0.00 0.93 -2.51 0.00 0.00 177.63 176.05 2h4r h GLU 253 N -0.40 0.64 -6.33 -0.14 5.08 -1.74 -3.44 114.58 108.26 2h4r h GLU 253 Ca -0.50 -0.45 -0.59 0.00 -1.00 0.00 0.00 59.36 56.82 2h4r h GLU 253 Cb 1.36 0.07 -0.20 0.00 0.50 0.00 0.00 28.75 30.48 2h4r h GLU 253 CO 0.57 1.07 -0.82 -0.51 -1.00 0.00 0.00 179.01 178.31 2h4r s LEU 254 N -8.35 2.35 0.03 1.33 1.02 -1.26 -2.00 118.68 111.80 2h4r s LEU 254 Ca -0.08 -0.77 -0.05 0.00 0.02 0.00 0.00 54.13 53.25 2h4r s LEU 254 Cb 0.10 -0.98 -0.01 0.00 0.02 0.00 0.00 46.19 45.32 2h4r s LEU 254 CO 0.86 0.07 0.09 -0.44 0.02 0.00 0.00 176.35 176.96 2h4r s SER 255 N -2.22 0.17 -0.21 2.29 0.01 -0.81 -0.21 113.70 112.72 2h4r s SER 255 Ca 0.12 -0.49 -0.03 0.00 1.31 0.00 0.00 55.95 56.86 2h4r s SER 255 Cb -0.09 0.22 -0.00 0.00 0.21 0.00 0.00 66.02 66.36 2h4r s SER 255 CO 0.06 -0.48 -0.08 -0.32 0.41 0.00 0.00 173.24 172.83 2h4r s MET 256 N -2.40 3.31 -0.08 12.44 1.75 -0.81 -0.06 119.30 133.44 2h4r s MET 256 Ca -0.07 -0.66 -0.11 0.00 -1.25 0.00 0.00 55.69 53.60 2h4r s MET 256 Cb -0.02 -2.91 -0.05 0.00 2.84 0.00 0.00 34.83 34.69 2h4r s MET 256 CO -0.04 -0.17 0.26 -0.06 -0.65 0.00 0.00 175.02 174.36 2h4r s PHE 257 N 1.36 3.63 -0.14 4.11 0.40 -0.12 -1.50 117.98 125.72 2h4r s PHE 257 Ca 0.05 0.71 0.01 0.00 -0.60 0.00 0.00 56.93 57.09 2h4r s PHE 257 Cb -0.14 -2.12 0.02 0.00 0.51 0.00 0.00 43.02 41.29 2h4r s PHE 257 CO -0.04 0.64 -0.14 0.42 0.70 0.00 0.00 175.22 176.79 2h4r s ILE 258 N -0.86 1.56 -0.43 0.64 1.01 -0.87 -1.60 121.20 120.64 2h4r s ILE 258 Ca 0.18 -0.63 -0.12 0.00 0.00 0.00 0.00 60.65 60.08 2h4r s ILE 258 Cb -0.14 -1.45 0.06 0.00 0.01 0.00 0.00 42.46 40.94 2h4r s ILE 258 CO 0.07 0.46 0.30 -0.76 0.00 0.00 0.00 174.94 175.01 2h4r s LEU 259 N 1.41 5.24 -0.29 2.97 1.02 0.35 -2.04 118.68 127.34 2h4r s LEU 259 Ca 0.03 -1.30 -0.11 0.00 0.02 0.00 0.00 54.13 52.77 2h4r s LEU 259 Cb -0.13 -2.08 -0.05 0.00 0.02 0.00 0.00 46.19 43.96 2h4r s LEU 259 CO -0.09 -0.54 0.20 -0.76 0.02 0.00 0.00 176.35 175.17 2h4r s LEU 260 N 1.54 4.08 0.22 1.79 1.43 -0.39 -2.75 118.68 124.61 2h4r s LEU 260 Ca 0.03 -0.06 -0.32 0.00 -1.03 0.00 0.00 54.13 52.76 2h4r s LEU 260 Cb -0.22 -2.12 -0.13 0.00 0.03 0.00 0.00 46.19 43.74 2h4r s LEU 260 CO 0.05 -0.07 1.48 -0.81 0.23 0.00 0.00 176.35 177.23 2h4r n PRO 261 N 5.07 2.15 -0.68 1.29 -0.04 -1.26 -1.07 135.00 140.46 2h4r n PRO 261 Ca -0.14 0.77 0.51 0.00 -0.04 0.00 0.00 63.50 64.60 2h4r n PRO 261 Cb 0.52 -2.47 0.79 0.00 -0.04 0.00 0.00 33.50 32.30 2h4r n PRO 261 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2h4r n ASP 262 N 2.50 0.00 -3.73 3.54 8.00 -0.80 -4.65 116.55 121.41 2h4r n ASP 262 Ca 0.13 0.96 0.02 0.00 0.71 0.00 0.00 54.79 56.61 2h4r n ASP 262 Cb 0.31 -0.48 0.01 0.00 -0.02 0.00 0.00 41.12 40.95 2h4r n ASP 262 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2h4r s ASP 263 N -3.84 -0.01 -0.71 -2.24 3.68 -1.26 -5.05 116.67 107.24 2h4r s ASP 263 Ca -0.05 -0.24 -0.27 0.00 2.13 0.00 0.00 52.55 54.13 2h4r s ASP 263 Cb 0.26 0.19 0.02 0.00 -1.45 0.00 0.00 42.92 41.93 2h4r s ASP 263 CO 0.86 -0.36 1.38 -0.63 0.13 0.00 0.00 175.17 176.54 2h4r s ILE 264 N -2.13 3.67 -0.32 4.11 1.01 -1.26 -4.82 121.20 121.46 2h4r s ILE 264 Ca 0.25 0.40 0.06 0.00 0.00 0.00 0.00 60.65 61.37 2h4r s ILE 264 Cb 0.01 -4.73 0.46 0.00 0.01 0.00 0.00 42.46 38.20 2h4r s ILE 264 CO -0.01 -1.66 1.26 0.29 0.00 0.00 0.00 174.94 174.83 2h4r n LYS 265 N 9.29 3.42 -4.17 2.79 4.76 -1.26 -4.98 118.16 128.01 2h4r n LYS 265 Ca 0.06 -4.04 -0.11 0.00 -2.87 0.00 0.00 58.31 51.35 2h4r n LYS 265 Cb 0.50 -2.24 -0.10 0.00 -1.84 0.00 0.00 35.03 31.34 2h4r n LYS 265 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2h4r s ASP 266 N -3.42 0.96 0.00 4.39 1.01 -1.26 -4.96 116.67 113.38 2h4r s ASP 266 Ca 0.51 -1.07 0.16 0.00 0.71 0.00 0.00 52.55 52.87 2h4r s ASP 266 Cb 0.42 0.14 0.71 0.00 1.01 0.00 0.00 42.92 45.19 2h4r s ASP 266 CO 0.03 -0.55 1.53 0.61 0.21 0.00 0.00 175.17 177.00 2h4r n GLY 267 N -0.08 -1.07 0.00 0.21 0.00 -1.26 -4.69 105.19 98.30 2h4r n GLY 267 Ca -0.10 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.86 2h4r n GLY 267 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2h4r n THR 268 N -1.50 0.00 -0.02 2.61 5.66 -1.26 -4.93 114.28 114.85 2h4r n THR 268 Ca 0.04 0.00 -0.11 0.00 -3.05 0.00 0.00 64.05 60.93 2h4r n THR 268 Cb 0.19 0.00 -0.14 0.00 -1.55 0.00 0.00 70.33 68.83 2h4r n THR 268 CO 0.00 0.00 0.00 0.35 -3.05 0.00 0.00 175.07 172.37 2h4r n THR 269 N 0.00 1.64 0.00 1.09 -2.24 -1.26 -4.22 114.28 109.28 2h4r n THR 269 Ca 0.00 -0.77 0.00 0.00 -2.27 0.00 0.00 64.05 61.01 2h4r n THR 269 Cb 0.00 -1.15 0.00 0.00 -2.10 0.00 0.00 70.33 67.08 2h4r n THR 269 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2h4r n GLY 270 N 1.63 0.40 0.68 3.38 0.00 -1.26 -4.17 105.19 105.85 2h4r n GLY 270 Ca -0.20 0.00 0.12 0.00 0.00 0.00 0.00 46.02 45.94 2h4r n GLY 270 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2h4r n LEU 271 N 0.00 2.32 0.09 0.99 4.77 -1.26 -4.48 117.00 119.43 2h4r n LEU 271 Ca 0.00 -0.80 0.20 0.00 -0.03 0.00 0.00 56.01 55.39 2h4r n LEU 271 Cb 0.00 -0.01 0.75 0.00 -2.33 0.00 0.00 43.42 41.83 2h4r n LEU 271 CO 0.00 0.40 1.18 -0.33 -1.33 0.00 0.00 177.39 177.31 2h4r h GLU 272 N 3.35 0.00 0.20 3.23 5.08 -1.97 -0.67 114.58 123.79 2h4r h GLU 272 Ca 0.00 0.00 -0.34 0.00 -1.00 0.00 0.00 59.36 58.02 2h4r h GLU 272 Cb 0.82 0.00 0.02 0.00 0.50 0.00 0.00 28.75 30.08 2h4r h GLU 272 CO 0.00 0.00 -1.62 0.37 -1.00 0.00 0.00 179.01 176.76 2h4r h GLN 273 N 0.00 0.41 -0.33 2.33 4.15 -1.98 -3.00 115.11 116.70 2h4r h GLN 273 Ca 0.19 -0.71 -0.14 0.00 0.77 0.00 0.00 58.65 58.76 2h4r h GLN 273 Cb 1.02 0.26 -0.01 0.00 0.21 0.00 0.00 27.48 28.96 2h4r h GLN 273 CO -0.00 1.32 -0.37 -0.07 -1.93 0.00 0.00 178.83 177.78 2h4r h LEU 274 N 0.11 0.82 -0.27 -2.39 3.38 -1.47 -2.67 115.31 112.82 2h4r h LEU 274 Ca -0.29 -0.36 -0.21 0.00 0.09 0.00 0.00 57.88 57.11 2h4r h LEU 274 Cb 2.11 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 42.63 2h4r h LEU 274 CO 0.21 1.10 -0.77 -0.33 0.09 0.00 0.00 178.44 178.73 2h4r h GLU 275 N 0.64 0.59 0.00 1.13 5.08 -1.42 0.39 114.58 120.98 2h4r h GLU 275 Ca 0.06 -0.49 0.00 0.00 -1.00 0.00 0.00 59.36 57.93 2h4r h GLU 275 Cb 0.92 0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.27 2h4r h GLU 275 CO 0.08 1.11 0.00 -2.13 -1.00 0.00 0.00 179.01 177.08 2h4r n ARG 276 N -3.88 0.48 0.00 2.33 0.63 -1.13 -2.72 116.66 112.37 2h4r n ARG 276 Ca -0.06 0.05 0.00 0.00 -0.92 0.00 0.00 57.85 56.92 2h4r n ARG 276 Cb 0.74 -1.50 0.00 0.00 0.45 0.00 0.00 32.46 32.15 2h4r n ARG 276 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 2h4r n GLU 277 N -1.13 0.72 -1.82 -0.14 1.02 -1.01 -5.06 120.64 113.21 2h4r n GLU 277 Ca 0.13 -0.71 -0.41 0.00 -0.02 0.00 0.00 57.16 56.14 2h4r n GLU 277 Cb 0.11 -0.64 -0.01 0.00 -0.02 0.00 0.00 31.44 30.88 2h4r n GLU 277 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 2h4r s LEU 278 N -0.25 4.34 -0.03 -4.62 2.96 0.11 -5.00 118.68 116.19 2h4r s LEU 278 Ca 0.00 2.97 -0.25 0.00 -0.22 0.00 0.00 54.13 56.63 2h4r s LEU 278 Cb 0.00 -3.65 0.05 0.00 0.50 0.00 0.00 46.19 43.09 2h4r s LEU 278 CO 0.00 -0.86 0.55 -0.89 -1.32 0.00 0.00 176.35 173.83 2h4r s THR 279 N -0.62 0.02 0.04 3.68 2.01 -1.26 -5.05 115.64 114.46 2h4r s THR 279 Ca 0.57 -0.17 -0.01 0.00 0.31 0.00 0.00 61.69 62.38 2h4r s THR 279 Cb -0.46 -0.88 -0.27 0.00 0.01 0.00 0.00 72.50 70.90 2h4r s THR 279 CO 0.55 -0.10 0.99 0.22 -0.69 0.00 0.00 174.62 175.60 2h4r h TYR 280 N 3.25 0.39 -0.50 4.92 3.20 -1.95 -2.25 116.97 124.03 2h4r h TYR 280 Ca -0.28 -0.28 0.02 0.00 3.14 0.00 0.00 58.73 61.33 2h4r h TYR 280 Cb 1.16 -0.02 -0.03 0.00 1.54 0.00 0.00 36.73 39.38 2h4r h TYR 280 CO 0.42 1.28 0.30 1.49 -1.64 0.00 0.00 178.16 180.02 2h4r h GLU 281 N 0.06 0.58 -0.10 1.82 4.81 -1.97 -1.36 114.58 118.41 2h4r h GLU 281 Ca -0.18 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.00 2h4r h GLU 281 Cb 1.97 -0.13 -0.00 0.00 0.63 0.00 0.00 28.75 31.22 2h4r h GLU 281 CO 0.17 0.38 0.02 0.00 -0.73 0.00 0.00 179.01 178.85 2h4r h ARG 282 N 0.60 0.16 -0.13 1.92 3.08 -1.97 -1.98 114.38 116.06 2h4r h ARG 282 Ca 0.20 -0.04 0.05 0.00 0.07 0.00 0.00 59.98 60.26 2h4r h ARG 282 Cb 0.02 -0.02 -0.06 0.00 0.08 0.00 0.00 29.97 29.99 2h4r h ARG 282 CO -0.09 0.35 -0.26 1.25 -1.07 0.00 0.00 179.97 180.14 2h4r h LEU 283 N -0.05 -0.82 -0.97 3.04 5.85 -1.13 0.65 115.31 121.88 2h4r h LEU 283 Ca 0.03 0.13 -0.11 0.00 0.84 0.00 0.00 57.88 58.77 2h4r h LEU 283 Cb 0.26 0.36 -0.01 0.00 0.37 0.00 0.00 40.66 41.63 2h4r h LEU 283 CO 0.00 -0.31 -0.49 0.28 -0.34 0.00 0.00 178.44 177.58 2h4r h SER 284 N -0.33 0.05 -0.52 1.25 0.02 -1.34 -1.91 113.55 110.78 2h4r h SER 284 Ca 0.10 -0.02 -0.03 0.00 -0.84 0.00 0.00 61.79 60.99 2h4r h SER 284 Cb 0.48 -0.01 -0.02 0.00 0.14 0.00 0.00 62.40 62.99 2h4r h SER 284 CO -0.32 0.54 0.20 -0.08 -1.14 0.00 0.00 176.83 176.02 2h4r h GLU 285 N 0.04 0.79 -0.24 3.45 4.81 -0.42 -2.68 114.58 120.33 2h4r h GLU 285 Ca -0.00 -0.15 -0.16 0.00 -0.13 0.00 0.00 59.36 58.91 2h4r h GLU 285 Cb 0.89 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 30.14 2h4r h GLU 285 CO 0.07 0.71 -0.51 -1.49 -0.73 0.00 0.00 179.01 177.05 2h4r h TRP 286 N 0.71 0.83 -0.80 0.92 6.55 -0.81 -1.37 115.95 121.99 2h4r h TRP 286 Ca 0.17 -0.28 0.09 0.00 0.95 0.00 0.00 58.89 59.82 2h4r h TRP 286 Cb 0.22 -0.16 -0.05 0.00 -0.86 0.00 0.00 29.16 28.30 2h4r h TRP 286 CO 0.01 1.04 0.52 0.00 -1.05 0.00 0.00 178.44 178.96 2h4r h ALA 287 N 0.90 1.74 0.00 1.49 0.00 -1.11 -2.63 119.26 119.66 2h4r h ALA 287 Ca 0.02 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 2h4r h ALA 287 Cb 1.07 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.68 2h4r h ALA 287 CO 0.10 0.10 -0.08 -0.25 0.00 0.00 0.00 179.25 179.12 2h4r n ASP 288 N -4.51 2.23 -4.69 0.00 8.00 -1.03 -5.04 116.55 111.51 2h4r n ASP 288 Ca 0.13 -3.18 -0.42 0.00 0.71 0.00 0.00 54.79 52.03 2h4r n ASP 288 Cb 0.32 -0.44 -0.03 0.00 -0.02 0.00 0.00 41.12 40.95 2h4r n ASP 288 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 2h4r s SER 289 N -2.90 6.44 0.15 -2.24 0.15 -0.52 -4.82 113.70 109.97 2h4r s SER 289 Ca 0.32 2.73 0.12 0.00 0.70 0.00 0.00 55.95 59.82 2h4r s SER 289 Cb 0.29 -2.56 0.61 0.00 -1.71 0.00 0.00 66.02 62.65 2h4r s SER 289 CO 0.02 -1.00 1.36 0.29 1.20 0.00 0.00 173.24 175.11 2h4r n LYS 290 N 5.94 0.07 0.00 5.44 4.76 -1.26 0.07 118.16 133.19 2h4r n LYS 290 Ca 0.18 0.53 0.15 0.00 -2.87 0.00 0.00 58.31 56.30 2h4r n LYS 290 Cb 0.39 -1.72 0.72 0.00 -1.84 0.00 0.00 35.03 32.58 2h4r n LYS 290 CO 0.00 0.00 0.00 -0.12 -1.37 0.00 0.00 177.40 175.91 2h4r n MET 291 N -1.87 1.00 -3.31 1.97 1.56 -1.26 -4.70 117.12 110.51 2h4r n MET 291 Ca -0.00 -0.29 -0.38 0.00 -0.27 0.00 0.00 57.70 56.75 2h4r n MET 291 Cb 0.04 -1.49 -0.06 0.00 2.15 0.00 0.00 33.22 33.86 2h4r n MET 291 CO 0.00 0.00 0.00 1.41 -0.73 0.00 0.00 175.97 176.65 2h4r s MET 292 N -2.21 4.29 0.02 2.12 0.00 0.11 -4.54 119.30 119.09 2h4r s MET 292 Ca 0.38 0.51 -0.04 0.00 0.00 0.00 0.00 55.69 56.54 2h4r s MET 292 Cb 0.21 -3.39 -0.01 0.00 0.00 0.00 0.00 34.83 31.63 2h4r s MET 292 CO 0.41 0.26 0.05 -0.08 0.00 0.00 0.00 175.02 175.65 2h4r s THR 293 N 0.28 0.12 0.28 10.11 -1.32 -0.76 -4.84 115.64 119.51 2h4r s THR 293 Ca 0.27 -0.95 -0.30 0.00 -1.21 0.00 0.00 61.69 59.50 2h4r s THR 293 Cb -0.16 -0.56 -0.13 0.00 -1.51 0.00 0.00 72.50 70.15 2h4r s THR 293 CO 0.12 -0.52 1.43 -0.62 -2.21 0.00 0.00 174.62 172.82 2h4r n GLU 294 N 1.24 2.25 -3.73 7.08 -0.58 -1.26 -0.90 120.64 124.74 2h4r n GLU 294 Ca -0.22 0.80 -0.13 0.00 -0.42 0.00 0.00 57.16 57.20 2h4r n GLU 294 Cb 0.56 -2.47 -0.10 0.00 -0.57 0.00 0.00 31.44 28.86 2h4r n GLU 294 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 2h4r s THR 295 N -0.32 -0.01 -0.12 2.62 2.01 0.62 -4.88 115.64 115.57 2h4r s THR 295 Ca 0.64 0.02 -0.29 0.00 0.31 0.00 0.00 61.69 62.37 2h4r s THR 295 Cb -0.58 -0.55 -0.02 0.00 0.01 0.00 0.00 72.50 71.35 2h4r s THR 295 CO 0.53 0.01 1.30 -0.22 -0.69 0.00 0.00 174.62 175.54 2h4r s LEU 296 N 0.49 4.22 -0.08 4.42 2.96 -1.26 0.30 118.68 129.73 2h4r s LEU 296 Ca -0.02 1.79 0.05 0.00 -0.22 0.00 0.00 54.13 55.73 2h4r s LEU 296 Cb -0.04 -3.54 -0.00 0.00 0.50 0.00 0.00 46.19 43.10 2h4r s LEU 296 CO -0.03 -0.74 -0.24 -0.69 -1.32 0.00 0.00 176.35 173.34 2h4r s VAL 297 N 3.22 2.01 -0.91 1.68 1.01 0.28 -2.13 120.40 125.56 2h4r s VAL 297 Ca 0.57 -1.02 -0.19 0.00 0.00 0.00 0.00 61.98 61.35 2h4r s VAL 297 Cb -0.24 -1.73 0.13 0.00 0.00 0.00 0.00 36.38 34.55 2h4r s VAL 297 CO 0.18 0.55 1.10 -0.62 0.00 0.00 0.00 175.10 176.32 2h4r s ASP 298 N 0.12 6.61 -0.26 3.32 2.15 -0.21 -1.83 116.67 126.57 2h4r s ASP 298 Ca -0.12 -2.01 -0.14 0.00 0.43 0.00 0.00 52.55 50.72 2h4r s ASP 298 Cb -0.16 -2.39 -0.04 0.00 -0.30 0.00 0.00 42.92 40.03 2h4r s ASP 298 CO 0.06 -1.06 0.31 -0.22 -0.17 0.00 0.00 175.17 174.08 2h4r s LEU 299 N 2.66 4.06 -0.30 -1.34 2.96 -0.57 -0.71 118.68 125.44 2h4r s LEU 299 Ca 0.31 0.22 -0.01 0.00 -0.22 0.00 0.00 54.13 54.44 2h4r s LEU 299 Cb -0.06 -2.32 0.06 0.00 0.50 0.00 0.00 46.19 44.37 2h4r s LEU 299 CO -0.08 -0.11 -0.02 -1.00 -1.32 0.00 0.00 176.35 173.82 2h4r s HIS 300 N 1.79 3.29 -0.20 5.38 3.76 -0.38 -2.35 115.29 126.57 2h4r s HIS 300 Ca 0.13 -2.01 0.01 0.00 -0.15 0.00 0.00 55.06 53.03 2h4r s HIS 300 Cb -0.15 -2.13 0.04 0.00 1.11 0.00 0.00 32.58 31.45 2h4r s HIS 300 CO 0.09 -0.83 -0.10 -1.17 -0.85 0.00 0.00 174.74 171.88 2h4r s LEU 301 N 1.21 2.31 0.36 0.89 2.96 -0.78 -0.48 118.68 125.16 2h4r s LEU 301 Ca -0.05 -0.91 -0.28 0.00 -0.22 0.00 0.00 54.13 52.67 2h4r s LEU 301 Cb -0.20 -1.23 -0.10 0.00 0.50 0.00 0.00 46.19 45.16 2h4r s LEU 301 CO -0.02 -0.15 1.36 -2.16 -1.32 0.00 0.00 176.35 174.06 2h4r s PRO 302 N 1.39 4.19 0.32 0.98 0.04 -1.26 -1.78 135.00 138.88 2h4r s PRO 302 Ca -0.02 2.32 -0.29 0.00 0.04 0.00 0.00 61.00 63.06 2h4r s PRO 302 Cb -0.16 -2.97 -0.10 0.00 0.04 0.00 0.00 34.50 31.31 2h4r s PRO 302 CO -0.08 -0.37 1.21 0.15 0.04 0.00 0.00 177.00 177.95 2h4r s LYS 303 N -1.99 4.43 -0.21 4.56 1.02 -0.15 -4.87 119.74 122.53 2h4r s LYS 303 Ca 0.52 2.01 -0.27 0.00 0.02 0.00 0.00 55.97 58.25 2h4r s LYS 303 Cb -0.42 -3.07 0.10 0.00 -0.52 0.00 0.00 37.83 33.92 2h4r s LYS 303 CO 0.55 -0.05 0.86 -0.59 -0.92 0.00 0.00 175.35 175.21 2h4r s PHE 304 N -1.18 -0.59 -0.21 3.18 -0.12 -1.06 -4.72 117.98 113.27 2h4r s PHE 304 Ca 0.48 1.30 0.02 0.00 -0.05 0.00 0.00 56.93 58.68 2h4r s PHE 304 Cb -0.36 0.36 0.04 0.00 -0.63 0.00 0.00 43.02 42.43 2h4r s PHE 304 CO 0.47 -0.37 -0.14 0.45 -0.05 0.00 0.00 175.22 175.58 2h4r s SER 305 N -0.22 3.68 -0.20 1.98 0.15 -1.26 -0.63 113.70 117.20 2h4r s SER 305 Ca -0.01 -0.99 -0.08 0.00 0.70 0.00 0.00 55.95 55.56 2h4r s SER 305 Cb -0.03 -1.42 -0.04 0.00 -1.71 0.00 0.00 66.02 62.81 2h4r s SER 305 CO 0.00 -0.11 0.09 -0.76 1.20 0.00 0.00 173.24 173.66 2h4r s LEU 306 N 1.26 3.87 -0.27 3.45 1.43 0.38 -4.98 118.68 123.82 2h4r s LEU 306 Ca -0.02 0.07 0.17 0.00 -1.03 0.00 0.00 54.13 53.32 2h4r s LEU 306 Cb -0.17 -2.00 0.49 0.00 0.03 0.00 0.00 46.19 44.55 2h4r s LEU 306 CO -0.09 0.13 1.14 -1.84 0.23 0.00 0.00 176.35 175.93 2h4r n GLU 307 N 3.82 2.47 -1.61 1.70 0.28 -1.25 -0.77 120.64 125.28 2h4r n GLU 307 Ca -0.16 -3.77 -0.48 0.00 -0.16 0.00 0.00 57.16 52.59 2h4r n GLU 307 Cb 0.52 -1.87 -0.04 0.00 1.43 0.00 0.00 31.44 31.48 2h4r n GLU 307 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 2h4r n ASP 308 N -0.64 1.85 -4.00 -1.84 10.43 -1.18 -4.70 116.55 116.46 2h4r n ASP 308 Ca 0.22 1.13 -0.30 0.00 2.57 0.00 0.00 54.79 58.41 2h4r n ASP 308 Cb 0.87 -1.28 -0.16 0.00 1.84 0.00 0.00 41.12 42.39 2h4r n ASP 308 CO 0.00 0.00 0.00 -0.60 -1.07 0.00 0.00 177.20 175.53 2h4r s ARG 309 N -0.13 2.19 -0.16 -1.24 3.52 -1.26 -2.08 118.95 119.78 2h4r s ARG 309 Ca 0.74 -0.58 0.01 0.00 -0.13 0.00 0.00 55.73 55.78 2h4r s ARG 309 Cb -0.81 -2.12 0.02 0.00 -1.56 0.00 0.00 34.95 30.48 2h4r s ARG 309 CO 0.49 -0.27 -0.18 -1.50 -0.81 0.00 0.00 175.30 173.03 2h4r s ILE 310 N 1.49 1.90 -0.56 4.11 1.10 0.45 -4.96 121.20 124.73 2h4r s ILE 310 Ca 0.04 -0.85 -0.28 0.00 -0.51 0.00 0.00 60.65 59.05 2h4r s ILE 310 Cb -0.13 -1.72 0.03 0.00 0.15 0.00 0.00 42.46 40.78 2h4r s ILE 310 CO -0.10 0.51 1.25 -0.62 -2.11 0.00 0.00 174.94 173.87 2h4r s ASP 311 N 1.25 6.39 0.00 4.50 2.15 -1.26 -0.07 116.67 129.63 2h4r s ASP 311 Ca 0.02 0.21 0.29 0.00 0.43 0.00 0.00 52.55 53.50 2h4r s ASP 311 Cb -0.13 -2.55 1.26 0.00 -0.30 0.00 0.00 42.92 41.19 2h4r s ASP 311 CO -0.10 -1.51 1.88 0.18 -0.17 0.00 0.00 175.17 175.44 2h4r n LEU 312 N 8.67 0.53 0.00 -1.34 4.77 0.76 -4.62 117.00 125.77 2h4r n LEU 312 Ca 0.10 -0.05 0.00 0.00 -0.03 0.00 0.00 56.01 56.03 2h4r n LEU 312 Cb 0.49 -0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.43 2h4r n LEU 312 CO 0.71 0.10 0.33 -1.14 -1.33 0.00 0.00 177.39 176.06 2h4r n ARG 313 N -0.85 0.00 -0.27 3.23 0.63 -1.26 -0.68 116.66 117.46 2h4r n ARG 313 Ca 0.16 0.47 0.14 0.00 -0.92 0.00 0.00 57.85 57.69 2h4r n ARG 313 Cb 0.27 -1.16 0.41 0.00 0.45 0.00 0.00 32.46 32.43 2h4r n ARG 313 CO 0.00 0.00 0.00 -0.44 -2.51 0.00 0.00 177.63 174.68 2h4r h ASP 314 N 0.00 0.61 -0.69 6.15 5.19 -1.98 -0.46 116.42 125.23 2h4r h ASP 314 Ca 0.00 0.05 -0.01 0.00 -0.62 0.00 0.00 57.03 56.45 2h4r h ASP 314 Cb 0.00 -0.07 -0.03 0.00 0.18 0.00 0.00 39.33 39.41 2h4r h ASP 314 CO 0.00 0.28 0.40 0.74 -3.12 0.00 0.00 179.24 177.54 2h4r h THR 315 N 0.63 1.21 -0.32 0.35 2.02 -1.78 -0.95 112.91 114.07 2h4r h THR 315 Ca 0.47 -0.49 -0.16 0.00 0.77 0.00 0.00 66.41 66.99 2h4r h THR 315 Cb 0.85 0.28 -0.01 0.00 -1.74 0.00 0.00 68.15 67.53 2h4r h THR 315 CO -0.22 0.22 -0.43 -0.07 0.37 0.00 0.00 175.52 175.40 2h4r h LEU 316 N 0.95 0.86 -1.42 2.58 3.38 0.65 -2.27 115.31 120.05 2h4r h LEU 316 Ca 0.25 -0.41 -0.06 0.00 0.09 0.00 0.00 57.88 57.75 2h4r h LEU 316 Cb 0.01 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 2h4r h LEU 316 CO -0.04 1.17 -0.29 0.03 0.09 0.00 0.00 178.44 179.40 2h4r h ARG 317 N 0.65 0.00 -0.01 1.13 3.08 -1.03 -0.82 114.38 117.38 2h4r h ARG 317 Ca 0.04 0.00 -0.19 0.00 0.07 0.00 0.00 59.98 59.91 2h4r h ARG 317 Cb 1.00 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.04 2h4r h ARG 317 CO 0.10 0.29 -0.82 -0.91 -1.07 0.00 0.00 179.97 177.55 2h4r h ASN 318 N 0.00 0.27 0.72 7.04 2.35 -1.01 -3.06 115.58 121.89 2h4r h ASN 318 Ca -0.00 -0.21 0.00 0.00 -0.55 0.00 0.00 56.30 55.54 2h4r h ASN 318 Cb 0.57 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 38.85 2h4r h ASN 318 CO 0.04 0.98 0.00 0.23 -1.65 0.00 0.00 177.43 177.03 2h4r n MET 319 N -3.71 0.09 0.00 0.81 2.81 -0.84 -4.88 117.12 111.41 2h4r n MET 319 Ca -0.03 0.08 0.00 0.00 -1.81 0.00 0.00 57.70 55.94 2h4r n MET 319 Cb 0.77 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.78 2h4r n MET 319 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2h4r n GLY 320 N 0.90 1.06 3.45 3.03 0.00 -0.92 -4.77 105.19 107.93 2h4r n GLY 320 Ca 0.07 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.65 2h4r n GLY 320 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2h4r s MET 321 N 0.00 3.71 -0.11 1.61 -2.45 -0.37 -4.84 119.30 116.85 2h4r s MET 321 Ca 0.00 -1.97 -0.09 0.00 -1.25 0.00 0.00 55.69 52.38 2h4r s MET 321 Cb 0.00 -4.94 -0.03 0.00 1.25 0.00 0.00 34.83 31.11 2h4r s MET 321 CO 0.00 -1.76 -0.18 2.41 1.05 0.00 0.00 175.02 176.54 2h4r n THR 322 N 5.25 1.01 -0.28 10.11 -1.04 -1.26 -3.50 114.28 124.57 2h4r n THR 322 Ca 0.27 0.28 0.02 0.00 -2.04 0.00 0.00 64.05 62.58 2h4r n THR 322 Cb 0.48 -2.11 0.23 0.00 -1.82 0.00 0.00 70.33 67.11 2h4r n THR 322 CO 0.00 0.00 0.00 0.74 -0.64 0.00 0.00 175.07 175.17 2h4r h THR 323 N -0.69 1.13 -0.30 12.58 2.02 -1.89 -2.45 112.91 123.30 2h4r h THR 323 Ca 0.00 -0.36 0.09 0.00 0.77 0.00 0.00 66.41 66.90 2h4r h THR 323 Cb 0.51 -0.03 -0.01 0.00 -1.74 0.00 0.00 68.15 66.88 2h4r h THR 323 CO 0.00 0.19 0.37 0.00 0.37 0.00 0.00 175.52 176.45 2h4r h ALA 324 N 1.50 1.93 -0.42 6.16 0.00 -1.84 -1.36 119.26 125.24 2h4r h ALA 324 Ca 0.35 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.25 2h4r h ALA 324 Cb 0.07 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.88 2h4r h ALA 324 CO -0.11 -0.52 0.00 1.19 0.00 0.00 0.00 179.25 179.81 2h4r n PHE 325 N -3.62 0.55 -3.77 0.00 3.01 -0.92 -0.83 117.46 111.88 2h4r n PHE 325 Ca 0.05 -0.34 -0.24 0.00 1.01 0.00 0.00 57.45 57.93 2h4r n PHE 325 Cb 0.51 -0.01 -0.02 0.00 -0.01 0.00 0.00 39.48 39.95 2h4r n PHE 325 CO 0.00 0.00 0.00 0.95 1.01 0.00 0.00 176.76 178.72 2h4r s THR 326 N -1.21 2.12 -0.71 4.37 -4.23 -0.53 -4.81 115.64 110.64 2h4r s THR 326 Ca 0.35 -1.45 0.19 0.00 -1.18 0.00 0.00 61.69 59.60 2h4r s THR 326 Cb 0.20 -2.57 0.18 0.00 1.34 0.00 0.00 72.50 71.65 2h4r s THR 326 CO 0.27 0.00 1.58 0.35 -0.54 0.00 0.00 174.62 176.28 2h4r n THR 327 N -1.63 0.95 1.28 3.99 -2.24 -1.26 -2.19 114.28 113.17 2h4r n THR 327 Ca 0.01 0.26 0.12 0.00 -2.27 0.00 0.00 64.05 62.17 2h4r n THR 327 Cb 0.63 -1.12 0.41 0.00 -2.10 0.00 0.00 70.33 68.15 2h4r n THR 327 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2h4r n ASN 328 N -1.90 1.73 -4.56 3.42 3.02 -1.26 -4.87 115.26 110.84 2h4r n ASN 328 Ca 0.03 -1.65 -0.40 0.00 -0.03 0.00 0.00 54.58 52.52 2h4r n ASN 328 Cb 0.19 -0.07 0.03 0.00 -0.61 0.00 0.00 39.78 39.32 2h4r n ASN 328 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2h4r n ALA 329 N 0.36 -0.28 -3.76 5.41 0.00 -0.93 -4.94 120.51 116.37 2h4r n ALA 329 Ca 0.17 0.11 -0.30 0.00 0.00 0.00 0.00 53.44 53.43 2h4r n ALA 329 Cb 0.36 -2.00 -0.14 0.00 0.00 0.00 0.00 19.45 17.67 2h4r n ALA 329 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2h4r s ASP 330 N -0.99 3.94 -0.40 0.00 -1.08 -1.26 -4.66 116.67 112.22 2h4r s ASP 330 Ca 0.68 -2.19 0.04 0.00 -0.52 0.00 0.00 52.55 50.56 2h4r s ASP 330 Cb -0.50 -1.04 0.46 0.00 -1.46 0.00 0.00 42.92 40.37 2h4r s ASP 330 CO 0.54 -0.34 1.43 0.49 0.52 0.00 0.00 175.17 177.81 2h4r n PHE 331 N 4.13 2.90 1.41 -5.34 3.01 -1.26 -0.10 117.46 122.21 2h4r n PHE 331 Ca 0.04 -2.47 0.00 0.00 1.01 0.00 0.00 57.45 56.03 2h4r n PHE 331 Cb 0.38 -0.64 0.00 0.00 -0.01 0.00 0.00 39.48 39.21 2h4r n PHE 331 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 2h4r n ARG 332 N -0.76 0.77 0.18 -1.08 1.74 -1.18 -1.73 116.66 114.60 2h4r n ARG 332 Ca 0.49 0.00 0.10 0.00 -0.77 0.00 0.00 57.85 57.67 2h4r n ARG 332 Cb 0.87 -1.06 0.11 0.00 -1.02 0.00 0.00 32.46 31.35 2h4r n ARG 332 CO 0.00 0.00 0.00 0.78 -1.52 0.00 0.00 177.63 176.89 2h4r h GLY 333 N 4.52 0.00 0.00 -0.13 0.00 -1.40 -3.38 103.07 102.69 2h4r h GLY 333 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.28 2h4r h GLY 333 CO 0.00 0.00 -1.25 1.15 0.00 0.00 0.00 176.54 176.44 2h4r n MET 334 N -3.02 2.41 -4.37 4.80 0.00 -0.71 -4.27 117.12 111.96 2h4r n MET 334 Ca 0.02 -0.01 -0.21 0.00 0.00 0.00 0.00 57.70 57.50 2h4r n MET 334 Cb 0.57 -1.10 -0.10 0.00 0.00 0.00 0.00 33.22 32.58 2h4r n MET 334 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 175.97 176.96 2h4r s THR 335 N -2.15 1.95 0.16 3.17 2.01 -1.01 0.12 115.64 119.88 2h4r s THR 335 Ca -0.02 -2.15 -0.00 0.00 0.31 0.00 0.00 61.69 59.83 2h4r s THR 335 Cb 0.02 -2.04 -0.15 0.00 0.01 0.00 0.00 72.50 70.34 2h4r s THR 335 CO 0.17 -0.44 1.37 -0.78 -0.69 0.00 0.00 174.62 174.24 2h4r h ASP 336 N 2.75 0.37 -2.70 3.53 1.82 -1.85 -3.37 116.42 116.97 2h4r h ASP 336 Ca -0.40 -0.29 -0.60 0.00 -0.39 0.00 0.00 57.03 55.35 2h4r h ASP 336 Cb 1.22 -0.11 -0.12 0.00 0.68 0.00 0.00 39.33 41.00 2h4r h ASP 336 CO 0.57 1.08 -0.68 -0.54 -1.61 0.00 0.00 179.24 178.06 2h4r s LYS 337 N -3.29 2.21 -1.33 0.28 -0.14 -1.26 -5.01 119.74 111.20 2h4r s LYS 337 Ca -0.04 -1.29 -0.11 0.00 -1.36 0.00 0.00 55.97 53.17 2h4r s LYS 337 Cb 0.10 -2.20 0.13 0.00 -1.68 0.00 0.00 37.83 34.18 2h4r s LYS 337 CO 0.84 0.41 1.96 1.17 -0.76 0.00 0.00 175.35 178.98 2h4r n LYS 338 N -0.31 3.39 -0.44 1.68 4.81 -1.26 -4.38 118.16 121.64 2h4r n LYS 338 Ca -0.09 -3.26 0.00 0.00 -0.87 0.00 0.00 58.31 54.09 2h4r n LYS 338 Cb 0.57 -3.04 0.00 0.00 0.02 0.00 0.00 35.03 32.57 2h4r n LYS 338 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 2h4r n ASP 339 N 4.64 0.00 -4.21 3.14 5.68 -1.26 -4.98 116.55 119.56 2h4r n ASP 339 Ca 0.43 -1.84 -0.33 0.00 -0.50 0.00 0.00 54.79 52.55 2h4r n ASP 339 Cb 0.37 -0.17 -0.16 0.00 -1.14 0.00 0.00 41.12 40.03 2h4r n ASP 339 CO 0.00 0.00 0.00 -0.22 -1.33 0.00 0.00 177.20 175.65 2h4r s LEU 340 N 0.00 2.34 0.12 -2.12 0.20 -1.26 -5.12 118.68 112.83 2h4r s LEU 340 Ca 0.00 -0.54 0.06 0.00 0.69 0.00 0.00 54.13 54.34 2h4r s LEU 340 Cb 0.00 -1.53 -0.04 0.00 -0.43 0.00 0.00 46.19 44.20 2h4r s LEU 340 CO 0.00 0.06 -0.14 0.00 -0.29 0.00 0.00 176.35 175.98 2h4r s ALA 341 N 0.96 1.47 0.16 5.97 0.00 -1.26 -4.39 121.76 124.67 2h4r s ALA 341 Ca -0.03 -1.27 -0.30 0.00 0.00 0.00 0.00 51.96 50.36 2h4r s ALA 341 Cb -0.15 -0.08 -0.07 0.00 0.00 0.00 0.00 23.12 22.82 2h4r s ALA 341 CO -0.03 0.11 1.16 0.42 0.00 0.00 0.00 175.76 177.41 2h4r s ILE 342 N -2.07 3.77 -0.24 0.00 1.01 -0.01 -3.96 121.20 119.69 2h4r s ILE 342 Ca 0.08 1.46 -0.14 0.00 0.00 0.00 0.00 60.65 62.05 2h4r s ILE 342 Cb -0.05 -3.93 -0.10 0.00 0.01 0.00 0.00 42.46 38.39 2h4r s ILE 342 CO 0.03 0.22 -0.33 -1.20 0.00 0.00 0.00 174.94 173.66 2h4r n SER 343 N 2.68 1.83 -3.99 3.58 7.64 -0.50 -4.60 113.62 120.26 2h4r n SER 343 Ca 0.04 0.32 -0.17 0.00 1.01 0.00 0.00 58.87 60.06 2h4r n SER 343 Cb 0.46 -0.75 -0.15 0.00 -1.01 0.00 0.00 64.21 62.76 2h4r n SER 343 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2h4r s LYS 344 N -2.55 0.60 -0.33 1.43 -0.14 -1.01 -5.02 119.74 112.73 2h4r s LYS 344 Ca -0.34 -0.25 0.02 0.00 -1.36 0.00 0.00 55.97 54.03 2h4r s LYS 344 Cb 0.12 -0.58 0.10 0.00 -1.68 0.00 0.00 37.83 35.79 2h4r s LYS 344 CO 0.44 0.15 0.08 0.08 -0.76 0.00 0.00 175.35 175.34 2h4r s VAL 345 N -0.13 1.56 -0.24 3.17 1.01 -1.26 -1.34 120.40 123.17 2h4r s VAL 345 Ca 0.02 -1.87 -0.03 0.00 0.00 0.00 0.00 61.98 60.10 2h4r s VAL 345 Cb -0.03 -2.17 0.01 0.00 0.00 0.00 0.00 36.38 34.19 2h4r s VAL 345 CO -0.00 -0.64 -0.04 -0.63 0.00 0.00 0.00 175.10 173.78 2h4r s ILE 346 N 1.26 3.20 0.03 2.22 1.09 -0.94 -0.17 121.20 127.89 2h4r s ILE 346 Ca 0.10 -0.72 0.03 0.00 -1.10 0.00 0.00 60.65 58.96 2h4r s ILE 346 Cb -0.18 -2.53 -0.04 0.00 -1.06 0.00 0.00 42.46 38.65 2h4r s ILE 346 CO -0.17 0.31 -0.04 -2.28 -0.10 0.00 0.00 174.94 172.67 2h4r s HIS 347 N 1.42 2.95 -0.24 3.97 2.46 0.90 -1.92 115.29 124.83 2h4r s HIS 347 Ca 0.03 -0.01 -0.14 0.00 0.47 0.00 0.00 55.06 55.41 2h4r s HIS 347 Cb -0.15 -1.59 0.07 0.00 -0.13 0.00 0.00 32.58 30.77 2h4r s HIS 347 CO -0.04 0.43 0.58 -1.14 -2.47 0.00 0.00 174.74 172.11 2h4r s GLN 348 N -1.73 0.60 0.04 2.88 0.74 -0.96 0.17 119.66 121.40 2h4r s GLN 348 Ca 0.20 1.05 0.07 0.00 0.05 0.00 0.00 55.36 56.73 2h4r s GLN 348 Cb -0.11 0.10 -0.02 0.00 1.10 0.00 0.00 33.01 34.07 2h4r s GLN 348 CO 0.11 -0.15 -0.20 -1.54 -0.55 0.00 0.00 175.29 172.97 2h4r s SER 349 N 1.46 2.35 -0.24 6.67 1.04 -0.89 -1.24 113.70 122.86 2h4r s SER 349 Ca -0.09 -0.50 0.02 0.00 0.48 0.00 0.00 55.95 55.86 2h4r s SER 349 Cb -0.06 -0.19 0.05 0.00 0.10 0.00 0.00 66.02 65.91 2h4r s SER 349 CO -0.16 0.15 -0.13 0.12 0.98 0.00 0.00 173.24 174.20 2h4r s PHE 350 N -0.78 3.08 -0.02 5.02 5.36 -0.55 -3.13 117.98 126.95 2h4r s PHE 350 Ca 0.07 -2.11 0.02 0.00 -0.96 0.00 0.00 56.93 53.94 2h4r s PHE 350 Cb -0.09 -1.90 0.01 0.00 -0.34 0.00 0.00 43.02 40.70 2h4r s PHE 350 CO 0.02 -0.85 -0.06 0.08 -1.46 0.00 0.00 175.22 172.94 2h4r s VAL 351 N 1.17 0.56 0.11 3.12 1.01 0.05 -2.36 120.40 124.06 2h4r s VAL 351 Ca -0.05 -0.23 0.07 0.00 0.00 0.00 0.00 61.98 61.77 2h4r s VAL 351 Cb -0.18 -0.52 -0.04 0.00 0.00 0.00 0.00 36.38 35.64 2h4r s VAL 351 CO -0.07 0.19 -0.11 0.00 0.00 0.00 0.00 175.10 175.11 2h4r s ALA 352 N 0.31 2.91 -0.30 5.51 0.00 -1.26 -0.47 121.76 128.46 2h4r s ALA 352 Ca -0.04 -1.27 0.03 0.00 0.00 0.00 0.00 51.96 50.68 2h4r s ALA 352 Cb -0.08 -0.85 0.08 0.00 0.00 0.00 0.00 23.12 22.27 2h4r s ALA 352 CO 0.00 0.63 -0.01 0.08 0.00 0.00 0.00 175.76 176.46 2h4r s VAL 353 N -1.22 1.99 0.00 0.00 1.01 0.20 -4.28 120.40 118.11 2h4r s VAL 353 Ca 0.21 -1.89 0.00 0.00 0.00 0.00 0.00 61.98 60.30 2h4r s VAL 353 Cb -0.11 -2.34 0.00 0.00 0.00 0.00 0.00 36.38 33.93 2h4r s VAL 353 CO 0.13 -0.37 0.00 -0.67 0.00 0.00 0.00 175.10 174.19 2h4r n ASP 354 N 4.42 0.91 -0.01 3.32 -0.08 0.16 -2.58 116.55 122.69 2h4r n ASP 354 Ca -0.04 -0.11 -0.13 0.00 -1.51 0.00 0.00 54.79 53.00 2h4r n ASP 354 Cb 0.42 0.00 -0.10 0.00 2.34 0.00 0.00 41.12 43.78 2h4r n ASP 354 CO 0.00 0.00 0.00 -0.33 0.12 0.00 0.00 177.20 176.99 2h4r h GLU 355 N 0.00 -0.02 0.00 -0.67 5.08 -1.90 -3.20 114.58 113.87 2h4r h GLU 355 Ca 0.00 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 2h4r h GLU 355 Cb 0.00 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.25 2h4r h GLU 355 CO 0.00 0.53 -0.11 0.87 -1.00 0.00 0.00 179.01 179.30 2h4r h LYS 356 N -0.58 0.00 0.00 2.33 1.57 -1.62 -0.65 116.57 117.62 2h4r h LYS 356 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2h4r h LYS 356 Cb 0.56 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.87 2h4r h LYS 356 CO 0.00 0.11 0.00 0.41 -0.57 0.00 0.00 179.45 179.40 2h4r n GLY 357 N 0.96 0.81 0.03 3.86 0.00 -1.21 0.40 105.19 110.04 2h4r n GLY 357 Ca 0.03 -0.25 0.12 0.00 0.00 0.00 0.00 46.02 45.92 2h4r n GLY 357 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2h4r n THR 358 N 0.00 0.14 -4.45 2.61 -2.24 -0.54 0.38 114.28 110.19 2h4r n THR 358 Ca 0.00 -0.12 -0.24 0.00 -2.27 0.00 0.00 64.05 61.42 2h4r n THR 358 Cb 0.00 0.10 -0.10 0.00 -2.10 0.00 0.00 70.33 68.23 2h4r n THR 358 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2h4r s GLU 359 N -3.08 1.75 0.38 -0.78 0.41 -1.26 -4.63 118.70 111.49 2h4r s GLU 359 Ca 0.09 -1.73 -0.09 0.00 -0.41 0.00 0.00 54.97 52.83 2h4r s GLU 359 Cb 0.16 -1.82 -0.06 0.00 -1.78 0.00 0.00 34.13 30.63 2h4r s GLU 359 CO 0.72 0.33 0.72 0.00 -0.49 0.00 0.00 175.26 176.54 2h4r s ALA 360 N -2.49 3.41 0.66 5.21 0.00 -1.26 -1.76 121.76 125.53 2h4r s ALA 360 Ca 0.30 -0.29 -0.09 0.00 0.00 0.00 0.00 51.96 51.88 2h4r s ALA 360 Cb -0.05 -2.61 0.01 0.00 0.00 0.00 0.00 23.12 20.47 2h4r s ALA 360 CO 0.16 0.05 1.01 0.00 0.00 0.00 0.00 175.76 176.98 2h4r s ALA 361 N -2.30 3.07 -0.86 0.00 0.00 -1.26 -4.73 121.76 115.68 2h4r s ALA 361 Ca 0.49 -0.48 0.27 0.00 0.00 0.00 0.00 51.96 52.24 2h4r s ALA 361 Cb -0.10 -2.85 1.01 0.00 0.00 0.00 0.00 23.12 21.18 2h4r s ALA 361 CO 0.31 -0.99 1.84 0.00 0.00 0.00 0.00 175.76 176.92 2h4r n ALA 362 N -2.82 2.28 0.00 0.00 0.00 -1.26 -4.98 120.51 113.72 2h4r n ALA 362 Ca 0.06 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2h4r n ALA 362 Cb 0.57 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.56 2h4r n ALA 362 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2h4r n VAL 378 N -1.89 0.00 -2.51 0.00 0.31 -1.26 -5.04 118.33 107.93 2h4r n VAL 378 Ca 0.06 0.00 -0.42 0.00 -0.01 0.00 0.00 64.34 63.97 2h4r n VAL 378 Cb 0.38 0.00 -0.03 0.00 -0.91 0.00 0.00 33.84 33.28 2h4r n VAL 378 CO 0.00 0.00 0.00 -0.22 -1.32 0.00 0.00 176.83 175.29 2h4r s LEU 379 N 0.00 4.32 -0.35 7.52 2.96 -0.90 -4.83 118.68 127.40 2h4r s LEU 379 Ca 0.00 1.83 -0.29 0.00 -0.22 0.00 0.00 54.13 55.45 2h4r s LEU 379 Cb 0.00 -3.57 0.01 0.00 0.50 0.00 0.00 46.19 43.14 2h4r s LEU 379 CO 0.00 -0.48 1.21 -0.54 -1.32 0.00 0.00 176.35 175.22 2h4r s LYS 380 N 1.61 3.91 -0.75 1.98 1.02 -1.26 -1.04 119.74 125.21 2h4r s LYS 380 Ca 0.55 1.05 0.02 0.00 0.02 0.00 0.00 55.97 57.61 2h4r s LYS 380 Cb -0.25 -3.85 0.18 0.00 -0.52 0.00 0.00 37.83 33.40 2h4r s LYS 380 CO 0.25 -1.13 0.57 0.12 -0.92 0.00 0.00 175.35 174.24 2h4r s PHE 381 N 4.23 3.64 -0.44 3.18 2.19 0.11 -4.92 117.98 125.96 2h4r s PHE 381 Ca 0.52 -3.14 -0.14 0.00 0.33 0.00 0.00 56.93 54.49 2h4r s PHE 381 Cb -0.13 -2.97 0.06 0.00 -1.31 0.00 0.00 43.02 38.67 2h4r s PHE 381 CO 0.23 -0.67 0.34 0.21 1.83 0.00 0.00 175.22 177.16 2h4r s LYS 382 N -1.15 2.89 -1.18 10.12 2.20 -1.26 -1.25 119.74 130.11 2h4r s LYS 382 Ca 0.24 -1.31 -0.17 0.00 -0.36 0.00 0.00 55.97 54.38 2h4r s LYS 382 Cb -0.09 -4.01 0.12 0.00 -1.51 0.00 0.00 37.83 32.34 2h4r s LYS 382 CO -0.12 -0.95 1.49 0.08 -0.36 0.00 0.00 175.35 175.50 2h4r s VAL 383 N 1.59 4.57 -0.14 4.02 1.01 0.37 -4.64 120.40 127.18 2h4r s VAL 383 Ca 0.04 -2.06 0.17 0.00 0.00 0.00 0.00 61.98 60.13 2h4r s VAL 383 Cb -0.23 -5.00 0.43 0.00 0.00 0.00 0.00 36.38 31.57 2h4r s VAL 383 CO 0.06 -1.78 1.20 -0.90 0.00 0.00 0.00 175.10 173.68 2h4r n ASP 384 N 7.03 1.58 -3.74 3.32 3.85 -1.26 -4.29 116.55 123.03 2h4r n ASP 384 Ca 0.39 -3.17 -0.11 0.00 -0.71 0.00 0.00 54.79 51.19 2h4r n ASP 384 Cb 0.46 -0.44 -0.07 0.00 -1.35 0.00 0.00 41.12 39.72 2h4r n ASP 384 CO 0.00 0.00 0.00 -1.38 -1.01 0.00 0.00 177.20 174.81 2h4r s HIS 385 N -2.10 -0.08 0.24 2.11 -3.43 -1.26 0.34 115.29 111.10 2h4r s HIS 385 Ca 0.37 -0.16 -0.29 0.00 -0.80 0.00 0.00 55.06 54.18 2h4r s HIS 385 Cb 0.38 0.11 -0.15 0.00 -1.43 0.00 0.00 32.58 31.48 2h4r s HIS 385 CO -0.10 -0.56 0.90 -2.30 -2.00 0.00 0.00 174.74 170.68 2h4r n PRO 386 N 0.25 0.94 -3.84 -0.38 -0.02 -1.26 -4.97 135.00 125.72 2h4r n PRO 386 Ca -0.17 0.33 -0.12 0.00 -2.02 0.00 0.00 63.50 61.52 2h4r n PRO 386 Cb 0.61 -1.62 -0.10 0.00 -0.02 0.00 0.00 33.50 32.37 2h4r n PRO 386 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 2h4r s PHE 387 N -0.90 -0.07 0.21 6.00 -0.71 0.15 -4.57 117.98 118.09 2h4r s PHE 387 Ca 0.63 0.13 -0.13 0.00 -1.04 0.00 0.00 56.93 56.51 2h4r s PHE 387 Cb -0.79 0.01 -0.08 0.00 -1.21 0.00 0.00 43.02 40.95 2h4r s PHE 387 CO 0.58 -0.24 0.60 -1.01 -1.34 0.00 0.00 175.22 173.81 2h4r s HIS 388 N -0.88 3.51 0.18 3.49 3.76 -1.11 -0.46 115.29 123.78 2h4r s HIS 388 Ca -0.10 1.06 -0.17 0.00 -0.15 0.00 0.00 55.06 55.70 2h4r s HIS 388 Cb -0.05 -2.39 0.03 0.00 1.11 0.00 0.00 32.58 31.28 2h4r s HIS 388 CO 0.01 0.30 0.49 -0.59 -0.85 0.00 0.00 174.74 174.11 2h4r s PHE 389 N -1.68 -0.11 -0.24 1.40 -0.12 -0.69 -0.50 117.98 116.04 2h4r s PHE 389 Ca 0.45 -0.23 -0.26 0.00 -0.05 0.00 0.00 56.93 56.84 2h4r s PHE 389 Cb -0.13 0.35 0.09 0.00 -0.63 0.00 0.00 43.02 42.70 2h4r s PHE 389 CO 0.20 -0.87 0.82 -0.59 -0.05 0.00 0.00 175.22 174.72 2h4r s PHE 390 N -3.87 -0.66 -0.31 3.49 -0.12 -0.63 -2.02 117.98 113.87 2h4r s PHE 390 Ca 0.09 1.55 -0.15 0.00 -0.05 0.00 0.00 56.93 58.37 2h4r s PHE 390 Cb -0.00 0.32 -0.02 0.00 -0.63 0.00 0.00 43.02 42.68 2h4r s PHE 390 CO -0.04 -0.36 0.36 0.42 -0.05 0.00 0.00 175.22 175.54 2h4r s ILE 391 N 0.08 5.18 0.14 -4.49 1.01 -0.32 -0.94 121.20 121.86 2h4r s ILE 391 Ca -0.00 0.26 0.06 0.00 0.00 0.00 0.00 60.65 60.97 2h4r s ILE 391 Cb -0.04 -3.76 -0.04 0.00 0.01 0.00 0.00 42.46 38.63 2h4r s ILE 391 CO -0.00 0.02 0.00 -0.60 0.00 0.00 0.00 174.94 174.37 2h4r s ARG 392 N 2.03 2.46 -0.55 2.79 3.52 0.91 -0.48 118.95 129.61 2h4r s ARG 392 Ca 0.13 -1.01 -0.18 0.00 -0.13 0.00 0.00 55.73 54.54 2h4r s ARG 392 Cb -0.16 -2.43 0.09 0.00 -1.56 0.00 0.00 34.95 30.90 2h4r s ARG 392 CO 0.11 0.49 0.63 -1.58 -0.81 0.00 0.00 175.30 174.14 2h4r s HIS 393 N -1.57 3.06 0.16 5.12 5.65 0.57 -1.92 115.29 126.36 2h4r s HIS 393 Ca 0.27 -0.90 -0.21 0.00 0.25 0.00 0.00 55.06 54.47 2h4r s HIS 393 Cb -0.10 -3.80 0.06 0.00 -1.18 0.00 0.00 32.58 27.56 2h4r s HIS 393 CO 0.18 -1.15 1.62 -0.91 -0.65 0.00 0.00 174.74 173.83 2h4r h ASN 394 N 9.07 -0.83 -0.31 9.88 2.35 -1.69 0.18 115.58 134.24 2h4r h ASN 394 Ca -0.29 0.16 0.07 0.00 -0.55 0.00 0.00 56.30 55.69 2h4r h ASN 394 Cb 1.09 0.41 -0.07 0.00 0.05 0.00 0.00 38.32 39.79 2h4r h ASN 394 CO 1.04 -0.28 -0.20 0.50 -1.65 0.00 0.00 177.43 176.84 2h4r h LYS 395 N -0.21 -0.17 -0.00 0.81 1.63 -1.90 -2.72 116.57 114.02 2h4r h LYS 395 Ca 0.17 0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.98 2h4r h LYS 395 Cb 0.47 0.04 0.00 0.00 -0.60 0.00 0.00 32.23 32.14 2h4r h LYS 395 CO -0.46 -0.11 -0.55 -1.13 -3.45 0.00 0.00 179.45 173.75 2h4r n SER 396 N -5.36 0.93 -2.99 4.20 3.41 -1.15 -4.98 113.62 107.67 2h4r n SER 396 Ca 0.00 -0.73 -0.22 0.00 -0.26 0.00 0.00 58.87 57.67 2h4r n SER 396 Cb 0.28 0.42 0.04 0.00 -0.26 0.00 0.00 64.21 64.69 2h4r n SER 396 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2h4r n LYS 397 N -1.11 -5.23 -3.17 4.33 5.02 0.63 -4.85 118.16 113.78 2h4r n LYS 397 Ca 0.07 0.86 -0.40 0.00 -2.02 0.00 0.00 58.31 56.83 2h4r n LYS 397 Cb 0.35 -5.68 -0.06 0.00 -0.02 0.00 0.00 35.03 29.62 2h4r n LYS 397 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 2h4r s THR 398 N -3.18 5.04 -0.08 -0.18 2.01 -1.10 -4.84 115.64 113.31 2h4r s THR 398 Ca 0.34 1.08 -0.30 0.00 0.31 0.00 0.00 61.69 63.12 2h4r s THR 398 Cb -0.15 -3.90 -0.04 0.00 0.01 0.00 0.00 72.50 68.42 2h4r s THR 398 CO 0.42 0.11 1.40 -0.63 -0.69 0.00 0.00 174.62 175.23 2h4r s ILE 399 N 1.97 3.94 -0.17 1.82 1.01 -1.26 -0.32 121.20 128.18 2h4r s ILE 399 Ca 0.26 1.20 -0.08 0.00 0.00 0.00 0.00 60.65 62.04 2h4r s ILE 399 Cb -0.16 -3.78 -0.22 0.00 0.01 0.00 0.00 42.46 38.32 2h4r s ILE 399 CO 0.10 -0.07 0.17 0.18 0.00 0.00 0.00 174.94 175.31 2h4r n LEU 400 N 6.28 2.54 -4.04 2.97 4.77 0.36 -3.83 117.00 126.05 2h4r n LEU 400 Ca 0.14 0.18 -0.14 0.00 -0.03 0.00 0.00 56.01 56.16 2h4r n LEU 400 Cb 0.44 -1.03 -0.12 0.00 -2.33 0.00 0.00 43.42 40.38 2h4r n LEU 400 CO 0.58 0.76 -0.41 -0.36 -1.33 0.00 0.00 177.39 176.64 2h4r s PHE 401 N -2.52 0.66 -0.06 -1.77 0.40 -1.06 -3.45 117.98 110.18 2h4r s PHE 401 Ca -0.27 -0.40 -0.14 0.00 -0.60 0.00 0.00 56.93 55.52 2h4r s PHE 401 Cb 0.08 -0.40 0.03 0.00 0.51 0.00 0.00 43.02 43.23 2h4r s PHE 401 CO 0.69 -0.06 0.33 0.12 0.70 0.00 0.00 175.22 177.00 2h4r s PHE 402 N -1.07 -0.28 0.00 0.36 5.36 -0.76 -1.18 117.98 120.42 2h4r s PHE 402 Ca -0.07 0.57 -0.28 0.00 -0.96 0.00 0.00 56.93 56.19 2h4r s PHE 402 Cb -0.08 0.12 0.10 0.00 -0.34 0.00 0.00 43.02 42.81 2h4r s PHE 402 CO 0.00 -0.31 1.26 0.20 -1.46 0.00 0.00 175.22 174.92 2h4r s GLY 403 N -0.69 -0.14 -0.20 13.12 0.00 -0.86 -1.76 107.32 116.80 2h4r s GLY 403 Ca -0.08 0.09 0.01 0.00 0.00 0.00 0.00 44.72 44.74 2h4r s GLY 403 CO 0.03 4.54 -0.15 -1.60 0.00 0.00 0.00 173.10 175.92 2h4r s ARG 404 N -2.09 2.55 -0.26 2.90 3.00 0.14 -1.71 118.95 123.49 2h4r s ARG 404 Ca 0.27 -0.90 -0.14 0.00 -1.00 0.00 0.00 55.73 53.95 2h4r s ARG 404 Cb 0.00 -2.54 -0.04 0.00 0.00 0.00 0.00 34.95 32.38 2h4r s ARG 404 CO -0.01 -0.33 0.35 0.12 0.00 0.00 0.00 175.30 175.43 2h4r s PHE 405 N 1.30 3.27 0.00 5.12 5.36 0.39 -2.70 117.98 130.73 2h4r s PHE 405 Ca 0.01 0.41 0.00 0.00 -0.96 0.00 0.00 56.93 56.39 2h4r s PHE 405 Cb -0.15 -2.53 0.00 0.00 -0.34 0.00 0.00 43.02 40.00 2h4r s PHE 405 CO -0.10 -0.16 0.00 0.00 -1.46 0.00 0.00 175.22 173.50 2h4r n PRO 408 N 3.06 0.00 -0.05 0.00 -0.02 -1.26 -4.68 135.00 132.05 2h4r n PRO 408 Ca 0.26 0.00 -0.13 0.00 -2.02 0.00 0.00 63.50 61.61 2h4r n PRO 408 Cb 0.45 -1.33 -0.08 0.00 -0.02 0.00 0.00 33.50 32.53 2h4r n PRO 408 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2h4r h VAL 409 N 4.14 1.36 0.00 -1.45 2.07 -1.99 -3.52 116.25 116.86 2h4r h VAL 409 Ca -0.40 -1.33 0.00 0.00 0.82 0.00 0.00 66.70 65.79 2h4r h VAL 409 Cb 1.22 1.96 0.00 0.00 -1.52 0.00 0.00 31.29 32.95 2h4r h VAL 409 CO 0.82 0.38 0.00 -0.62 0.02 0.00 0.00 177.57 178.17