#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d2r n PRO 21 N 0.00 0.70 -0.09 5.55 -0.02 -1.26 -4.75 135.00 135.13 3d2r n PRO 21 Ca 0.00 0.30 0.03 0.00 -2.02 0.00 0.00 63.50 61.81 3d2r n PRO 21 Cb 0.00 -2.41 0.35 0.00 -0.02 0.00 0.00 33.50 31.42 3d2r n PRO 21 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3d2r h ARG 22 N -0.05 0.72 -0.44 -0.52 3.08 -2.05 -1.77 114.38 113.34 3d2r h ARG 22 Ca -0.49 -0.04 -0.08 0.00 0.07 0.00 0.00 59.98 59.44 3d2r h ARG 22 Cb 1.33 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 31.20 3d2r h ARG 22 CO 0.49 0.48 -0.06 0.93 -1.07 0.00 0.00 179.97 180.74 3d2r h GLU 23 N 0.74 0.76 0.15 0.04 3.07 -1.99 0.01 114.58 117.35 3d2r h GLU 23 Ca 0.20 -0.23 -0.01 0.00 -0.50 0.00 0.00 59.36 58.83 3d2r h GLU 23 Cb -0.08 -0.08 0.00 0.00 -0.84 0.00 0.00 28.75 27.75 3d2r h GLU 23 CO -0.04 0.81 -0.07 0.28 -1.40 0.00 0.00 179.01 178.59 3d2r h VAL 24 N 0.70 0.95 -0.52 3.13 2.07 -1.68 -1.02 116.25 119.87 3d2r h VAL 24 Ca 0.13 -0.39 0.07 0.00 0.82 0.00 0.00 66.70 67.33 3d2r h VAL 24 Cb 0.52 1.19 -0.06 0.00 -1.52 0.00 0.00 31.29 31.42 3d2r h VAL 24 CO 0.03 0.09 0.19 -0.08 0.02 0.00 0.00 177.57 177.82 3d2r h GLU 25 N -0.38 0.37 0.70 1.57 4.57 -1.26 -1.64 114.58 118.50 3d2r h GLU 25 Ca -0.02 -0.02 -0.03 0.00 -1.18 0.00 0.00 59.36 58.11 3d2r h GLU 25 Cb 0.30 -0.08 -0.00 0.00 -0.16 0.00 0.00 28.75 28.80 3d2r h GLU 25 CO 0.03 0.24 -0.44 1.25 -1.18 0.00 0.00 179.01 178.92 3d2r h HIS 26 N 0.38 -1.16 0.00 0.92 2.76 -0.90 -2.97 115.15 114.18 3d2r h HIS 26 Ca 0.25 -0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.41 3d2r h HIS 26 Cb 0.26 0.41 0.00 0.00 1.55 0.00 0.00 27.41 29.64 3d2r h HIS 26 CO -0.16 -0.65 0.00 1.19 -1.30 0.00 0.00 177.93 177.01 3d2r n PHE 27 N -5.57 0.86 0.37 5.26 3.01 -0.40 -1.66 117.46 119.33 3d2r n PHE 27 Ca -0.14 0.34 0.13 0.00 1.01 0.00 0.00 57.45 58.80 3d2r n PHE 27 Cb 0.45 -1.06 0.39 0.00 -0.01 0.00 0.00 39.48 39.26 3d2r n PHE 27 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 3d2r h SER 28 N 0.00 0.00 0.72 4.37 4.64 -1.13 -3.00 113.55 119.15 3d2r h SER 28 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3d2r h SER 28 Cb 0.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.43 3d2r h SER 28 CO 0.00 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 176.50 3d2r n ARG 29 N -2.75 0.15 -3.26 4.77 1.74 -0.66 -4.74 116.66 111.91 3d2r n ARG 29 Ca 0.03 0.36 -0.27 0.00 -0.77 0.00 0.00 57.85 57.21 3d2r n ARG 29 Cb 0.41 -1.77 -0.02 0.00 -1.02 0.00 0.00 32.46 30.07 3d2r n ARG 29 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 3d2r s TYR 30 N -3.22 3.50 0.18 -1.55 1.51 -1.13 -5.09 117.35 111.54 3d2r s TYR 30 Ca 0.06 0.55 -0.09 0.00 -1.01 0.00 0.00 57.07 56.58 3d2r s TYR 30 Cb 0.10 -2.05 -0.07 0.00 -0.11 0.00 0.00 41.96 39.83 3d2r s TYR 30 CO 0.38 0.09 0.48 -1.54 -1.11 0.00 0.00 175.55 173.85 3d2r s SER 31 N -3.63 6.61 0.72 2.29 1.04 -1.26 -4.91 113.70 114.56 3d2r s SER 31 Ca 0.43 0.82 -0.16 0.00 0.48 0.00 0.00 55.95 57.52 3d2r s SER 31 Cb -0.10 -2.19 0.02 0.00 0.10 0.00 0.00 66.02 63.85 3d2r s SER 31 CO 0.34 0.01 1.09 -2.65 0.98 0.00 0.00 173.24 173.01 3d2r n PRO 32 N 0.15 0.57 -3.75 4.02 -0.02 -1.26 -4.99 135.00 129.72 3d2r n PRO 32 Ca -0.02 0.25 -0.38 0.00 -2.02 0.00 0.00 63.50 61.34 3d2r n PRO 32 Cb 0.52 -2.34 -0.12 0.00 -0.02 0.00 0.00 33.50 31.54 3d2r n PRO 32 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 3d2r s SER 33 N -1.69 5.31 0.25 2.55 0.01 -1.26 -5.10 113.70 113.78 3d2r s SER 33 Ca 0.75 -1.25 -0.30 0.00 1.31 0.00 0.00 55.95 56.46 3d2r s SER 33 Cb -0.34 -1.87 -0.09 0.00 0.21 0.00 0.00 66.02 63.93 3d2r s SER 33 CO 0.48 -0.36 0.99 -2.16 0.41 0.00 0.00 173.24 172.60 3d2r s PRO 34 N 1.37 4.79 0.16 12.44 0.04 -1.26 -5.05 135.00 147.49 3d2r s PRO 34 Ca -0.01 1.58 0.04 0.00 0.04 0.00 0.00 61.00 62.66 3d2r s PRO 34 Cb -0.20 -3.25 -0.04 0.00 0.04 0.00 0.00 34.50 31.05 3d2r s PRO 34 CO 0.02 0.42 0.19 -0.51 0.04 0.00 0.00 177.00 177.16 3d2r s LEU 35 N -1.27 4.00 0.48 -3.56 1.43 -1.26 -4.83 118.68 113.68 3d2r s LEU 35 Ca 0.42 -0.02 -0.02 0.00 -1.03 0.00 0.00 54.13 53.49 3d2r s LEU 35 Cb -0.28 -2.60 -0.01 0.00 0.03 0.00 0.00 46.19 43.34 3d2r s LEU 35 CO 0.35 0.06 0.73 -0.94 0.23 0.00 0.00 176.35 176.78 3d2r s SER 36 N -3.14 5.86 0.40 2.29 1.04 -1.26 -0.97 113.70 117.92 3d2r s SER 36 Ca 0.32 0.49 0.10 0.00 0.48 0.00 0.00 55.95 57.34 3d2r s SER 36 Cb -0.10 -1.71 0.83 0.00 0.10 0.00 0.00 66.02 65.13 3d2r s SER 36 CO 0.25 -0.74 1.94 -0.03 0.98 0.00 0.00 173.24 175.64 3d2r h MET 37 N 0.26 0.25 -0.58 4.02 4.05 -0.95 -1.27 114.93 120.71 3d2r h MET 37 Ca -0.46 -0.05 0.06 0.00 -0.28 0.00 0.00 59.70 58.97 3d2r h MET 37 Cb 1.24 -0.04 -0.05 0.00 -0.80 0.00 0.00 31.60 31.95 3d2r h MET 37 CO 0.59 0.35 0.28 -0.22 0.23 0.00 0.00 176.91 178.14 3d2r h LYS 38 N 0.24 0.52 -0.37 0.39 3.64 -1.75 -0.49 116.57 118.75 3d2r h LYS 38 Ca 0.05 -0.03 -0.09 0.00 -1.27 0.00 0.00 60.65 59.31 3d2r h LYS 38 Cb 0.31 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.00 3d2r h LYS 38 CO 0.02 0.34 -0.11 1.96 -2.27 0.00 0.00 179.45 179.39 3d2r h GLN 39 N 0.53 0.73 -0.41 1.90 4.20 -1.68 -1.51 115.11 118.88 3d2r h GLN 39 Ca 0.26 -0.29 0.03 0.00 0.06 0.00 0.00 58.65 58.71 3d2r h GLN 39 Cb 0.20 -0.04 -0.03 0.00 0.30 0.00 0.00 27.48 27.91 3d2r h GLN 39 CO -0.20 0.89 0.21 -0.07 -0.67 0.00 0.00 178.83 178.99 3d2r h LEU 40 N 0.53 0.31 -0.91 1.46 3.38 -1.13 -1.02 115.31 117.93 3d2r h LEU 40 Ca 0.09 0.02 0.05 0.00 0.09 0.00 0.00 57.88 58.13 3d2r h LEU 40 Cb 0.64 -0.04 -0.06 0.00 0.09 0.00 0.00 40.66 41.29 3d2r h LEU 40 CO 0.04 0.22 0.58 -0.07 0.09 0.00 0.00 178.44 179.30 3d2r h LEU 41 N 0.42 0.95 -0.65 1.67 3.38 -0.93 -2.89 115.31 117.26 3d2r h LEU 41 Ca 0.17 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 58.05 3d2r h LEU 41 Cb 0.08 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 3d2r h LEU 41 CO -0.12 0.64 -0.02 0.44 0.09 0.00 0.00 178.44 179.46 3d2r h ASP 42 N 1.10 1.01 -0.81 -0.43 3.32 -0.55 -2.20 116.42 117.85 3d2r h ASP 42 Ca 0.38 -0.29 0.20 0.00 0.02 0.00 0.00 57.03 57.33 3d2r h ASP 42 Cb 0.07 -0.27 -0.13 0.00 0.22 0.00 0.00 39.33 39.21 3d2r h ASP 42 CO -0.14 1.07 0.12 -0.26 -1.72 0.00 0.00 179.24 178.31 3d2r h PHE 43 N 0.93 0.14 -0.49 4.55 0.04 -1.02 -0.13 116.94 120.97 3d2r h PHE 43 Ca 0.16 0.05 0.00 0.00 2.80 0.00 0.00 57.97 60.99 3d2r h PHE 43 Cb 0.57 0.07 0.00 0.00 2.20 0.00 0.00 35.95 38.79 3d2r h PHE 43 CO 0.04 -0.22 0.00 0.41 -0.60 0.00 0.00 178.31 177.94 3d2r n GLY 44 N -1.40 1.73 0.24 -1.45 0.00 -1.11 -4.03 105.19 99.18 3d2r n GLY 44 Ca 0.17 -0.59 -0.11 0.00 0.00 0.00 0.00 46.02 45.50 3d2r n GLY 44 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3d2r h SER 45 N 2.97 0.81 -5.34 1.61 4.64 -0.37 -3.47 113.55 114.40 3d2r h SER 45 Ca 0.00 -0.38 -0.11 0.00 -0.47 0.00 0.00 61.79 60.83 3d2r h SER 45 Cb 0.92 -0.23 -0.10 0.00 -0.31 0.00 0.00 62.40 62.68 3d2r h SER 45 CO 0.09 1.12 -0.24 -1.83 -0.87 0.00 0.00 176.83 175.10 3d2r s GLU 46 N -4.28 1.49 0.19 4.77 -1.05 -1.26 -5.06 118.70 113.51 3d2r s GLU 46 Ca -0.09 -1.37 -0.06 0.00 -0.15 0.00 0.00 54.97 53.29 3d2r s GLU 46 Cb 0.12 0.42 0.12 0.00 -0.44 0.00 0.00 34.13 34.35 3d2r s GLU 46 CO 0.86 -0.60 1.59 -0.91 0.95 0.00 0.00 175.26 177.15 3d2r h ASN 47 N 2.33 0.87 0.16 0.83 2.35 -1.90 -3.01 115.58 117.21 3d2r h ASN 47 Ca -0.29 -0.33 0.00 0.00 -0.55 0.00 0.00 56.30 55.14 3d2r h ASN 47 Cb 1.25 -0.24 0.00 0.00 0.05 0.00 0.00 38.32 39.38 3d2r h ASN 47 CO 0.40 1.07 0.00 0.00 -1.65 0.00 0.00 177.43 177.24 3d2r h ALA 48 N 0.99 1.00 0.00 -0.83 0.00 -1.97 -1.93 119.26 116.53 3d2r h ALA 48 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.00 3d2r h ALA 48 Cb 0.78 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.57 3d2r h ALA 48 CO 0.06 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.31 3d2r h GLU 50 N 0.00 1.00 -0.30 0.00 4.81 -1.55 0.16 114.58 118.69 3d2r h GLU 50 Ca 0.00 -0.06 -0.08 0.00 -0.13 0.00 0.00 59.36 59.09 3d2r h GLU 50 Cb 0.27 -0.23 -0.02 0.00 0.63 0.00 0.00 28.75 29.41 3d2r h GLU 50 CO 0.00 0.66 -0.14 0.07 -0.73 0.00 0.00 179.01 178.88 3d2r h ARG 51 N 1.03 0.53 -0.36 1.92 0.11 -1.83 -0.50 114.38 115.29 3d2r h ARG 51 Ca 0.28 -0.16 -0.05 0.00 0.10 0.00 0.00 59.98 60.15 3d2r h ARG 51 Cb -0.11 -0.05 -0.01 0.00 1.11 0.00 0.00 29.97 30.91 3d2r h ARG 51 CO -0.07 0.65 0.02 1.15 0.10 0.00 0.00 179.97 181.83 3d2r h THR 52 N 0.48 1.25 -0.53 0.08 2.02 -1.57 -1.28 112.91 113.36 3d2r h THR 52 Ca 0.09 -0.93 -0.04 0.00 0.77 0.00 0.00 66.41 66.30 3d2r h THR 52 Cb 0.52 1.15 -0.02 0.00 -1.74 0.00 0.00 68.15 68.06 3d2r h THR 52 CO 0.03 0.31 0.18 -1.28 0.37 0.00 0.00 175.52 175.14 3d2r h SER 53 N 0.44 0.76 0.10 4.18 0.87 -0.72 -0.32 113.55 118.85 3d2r h SER 53 Ca 0.10 -0.19 0.02 0.00 -1.23 0.00 0.00 61.79 60.49 3d2r h SER 53 Cb 0.42 -0.20 -0.04 0.00 -0.44 0.00 0.00 62.40 62.14 3d2r h SER 53 CO 0.01 0.75 -0.27 0.15 -0.53 0.00 0.00 176.83 176.94 3d2r h PHE 54 N 0.73 -0.74 -0.86 2.24 3.57 -1.04 0.81 116.94 121.65 3d2r h PHE 54 Ca 0.17 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.70 3d2r h PHE 54 Cb 0.25 0.31 -0.04 0.00 2.79 0.00 0.00 35.95 39.26 3d2r h PHE 54 CO 0.01 -0.38 0.57 0.00 -2.23 0.00 0.00 178.31 176.28 3d2r h ALA 55 N 0.26 1.09 0.82 2.41 0.00 -1.03 -1.26 119.26 121.54 3d2r h ALA 55 Ca 0.04 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 3d2r h ALA 55 Cb 0.51 -0.35 0.01 0.00 0.00 0.00 0.00 17.79 17.97 3d2r h ALA 55 CO -0.17 0.49 -0.39 0.35 0.00 0.00 0.00 179.25 179.52 3d2r h PHE 56 N 1.16 -1.02 -0.10 0.00 3.04 -0.94 -3.34 116.94 115.74 3d2r h PHE 56 Ca 0.32 -0.02 -0.03 0.00 3.98 0.00 0.00 57.97 62.21 3d2r h PHE 56 Cb -0.13 0.34 -0.01 0.00 2.56 0.00 0.00 35.95 38.71 3d2r h PHE 56 CO -0.01 -0.63 -0.07 -0.07 -2.02 0.00 0.00 178.31 175.51 3d2r h LEU 57 N -1.21 0.14 -1.59 0.59 3.38 -0.80 0.19 115.31 116.00 3d2r h LEU 57 Ca -0.11 -0.02 -0.05 0.00 0.09 0.00 0.00 57.88 57.79 3d2r h LEU 57 Cb 0.84 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.55 3d2r h LEU 57 CO 0.18 0.23 -0.22 0.08 0.09 0.00 0.00 178.44 178.81 3d2r h ARG 58 N 0.15 0.00 0.06 1.13 0.11 -1.36 -1.14 114.38 113.33 3d2r h ARG 58 Ca 0.03 0.00 -0.31 0.00 0.10 0.00 0.00 59.98 59.81 3d2r h ARG 58 Cb 0.22 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 31.27 3d2r h ARG 58 CO 0.01 0.22 -1.68 1.04 0.10 0.00 0.00 179.97 179.67 3d2r n GLN 59 N -3.92 0.66 -0.15 0.08 1.13 -1.00 -4.45 117.38 109.73 3d2r n GLN 59 Ca -0.02 0.41 -0.11 0.00 -1.94 0.00 0.00 57.00 55.34 3d2r n GLN 59 Cb 0.31 -1.72 -0.01 0.00 0.11 0.00 0.00 30.24 28.93 3d2r n GLN 59 CO 0.00 0.00 0.00 1.49 -1.44 0.00 0.00 177.06 177.11 3d2r h GLU 60 N -0.45 0.88 -0.38 -1.09 4.57 -0.81 -2.53 114.58 114.77 3d2r h GLU 60 Ca -0.40 -0.34 -0.03 0.00 -1.18 0.00 0.00 59.36 57.41 3d2r h GLU 60 Cb 1.69 -0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 30.21 3d2r h GLU 60 CO -0.07 0.98 0.11 -0.07 -1.18 0.00 0.00 179.01 178.78 3d2r h LEU 61 N 0.72 0.56 -0.81 1.64 3.38 -1.46 -1.16 115.31 118.18 3d2r h LEU 61 Ca 0.11 -0.22 0.05 0.00 0.09 0.00 0.00 57.88 57.91 3d2r h LEU 61 Cb 0.67 -0.15 -0.05 0.00 0.09 0.00 0.00 40.66 41.21 3d2r h LEU 61 CO 0.05 0.63 0.51 -0.65 0.09 0.00 0.00 178.44 179.06 3d2r h PRO 62 N 0.46 0.93 -0.24 1.13 0.11 -1.76 -0.61 132.00 132.02 3d2r h PRO 62 Ca 0.12 -0.06 0.02 0.00 0.11 0.00 0.00 66.00 66.19 3d2r h PRO 62 Cb 0.28 -0.21 -0.02 0.00 0.11 0.00 0.00 31.00 31.16 3d2r h PRO 62 CO -0.00 0.61 0.10 0.28 -0.21 0.00 0.00 178.00 178.78 3d2r h VAL 63 N 0.95 0.96 -0.61 3.15 2.07 -1.12 0.47 116.25 122.12 3d2r h VAL 63 Ca 0.34 -0.08 -0.09 0.00 0.82 0.00 0.00 66.70 67.69 3d2r h VAL 63 Cb 0.10 0.72 -0.02 0.00 -1.52 0.00 0.00 31.29 30.56 3d2r h VAL 63 CO -0.15 0.04 0.03 0.03 0.02 0.00 0.00 177.57 177.54 3d2r h ARG 64 N 0.22 1.05 -0.36 1.57 3.08 -0.86 -1.07 114.38 118.02 3d2r h ARG 64 Ca 0.10 -0.31 -0.15 0.00 0.07 0.00 0.00 59.98 59.69 3d2r h ARG 64 Cb 0.05 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 29.99 3d2r h ARG 64 CO -0.09 1.01 -0.35 -0.07 -1.07 0.00 0.00 179.97 179.40 3d2r h LEU 65 N 0.97 0.93 -0.51 3.04 3.38 -1.01 -2.65 115.31 119.46 3d2r h LEU 65 Ca 0.18 -0.47 -0.14 0.00 0.09 0.00 0.00 57.88 57.55 3d2r h LEU 65 Cb 0.52 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 3d2r h LEU 65 CO 0.02 1.21 -0.26 0.00 0.09 0.00 0.00 178.44 179.50 3d2r h ALA 66 N 0.75 0.70 -0.80 1.53 0.00 -0.76 -0.32 119.26 120.36 3d2r h ALA 66 Ca 0.06 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.56 3d2r h ALA 66 Cb 0.94 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.54 3d2r h ALA 66 CO 0.09 0.67 0.51 -0.91 0.00 0.00 0.00 179.25 179.61 3d2r h ASN 67 N 0.80 0.94 0.72 0.00 2.35 -1.05 -1.69 115.58 117.64 3d2r h ASN 67 Ca 0.09 -0.04 -0.24 0.00 -0.55 0.00 0.00 56.30 55.56 3d2r h ASN 67 Cb 0.83 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.96 3d2r h ASN 67 CO 0.07 0.70 -1.09 -0.29 -1.65 0.00 0.00 177.43 175.18 3d2r h ILE 68 N 1.09 1.56 -0.80 2.81 6.09 -1.33 -2.44 117.51 124.50 3d2r h ILE 68 Ca 0.29 -3.06 0.06 0.00 -1.37 0.00 0.00 64.86 60.79 3d2r h ILE 68 Cb -0.09 2.80 -0.06 0.00 0.47 0.00 0.00 36.82 39.94 3d2r h ILE 68 CO -0.06 0.89 0.48 -0.07 -3.07 0.00 0.00 178.15 176.32 3d2r h LEU 69 N 0.06 0.74 -0.75 2.19 3.38 -0.86 -0.55 115.31 119.52 3d2r h LEU 69 Ca -0.08 0.02 -0.12 0.00 0.09 0.00 0.00 57.88 57.79 3d2r h LEU 69 Cb 1.80 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 42.42 3d2r h LEU 69 CO 0.17 0.47 -0.40 0.11 0.09 0.00 0.00 178.44 178.88 3d2r h LYS 70 N 0.87 0.48 -0.17 1.13 1.79 -1.18 -2.71 116.57 116.78 3d2r h LYS 70 Ca 0.35 -0.24 0.01 0.00 -2.18 0.00 0.00 60.65 58.59 3d2r h LYS 70 Cb 0.20 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.84 3d2r h LYS 70 CO -0.18 0.80 0.10 0.93 -1.08 0.00 0.00 179.45 180.02 3d2r h GLU 71 N 0.40 0.20 -0.77 3.15 5.08 -1.07 -2.95 114.58 118.62 3d2r h GLU 71 Ca 0.04 -0.01 0.18 0.00 -1.00 0.00 0.00 59.36 58.56 3d2r h GLU 71 Cb 0.87 -0.04 -0.13 0.00 0.50 0.00 0.00 28.75 29.95 3d2r h GLU 71 CO 0.07 0.13 0.07 0.82 -1.00 0.00 0.00 179.01 179.11 3d2r h ILE 72 N 0.20 0.37 0.00 3.13 2.04 -0.88 -0.82 117.51 121.55 3d2r h ILE 72 Ca 0.06 -0.05 0.00 0.00 1.00 0.00 0.00 64.86 65.87 3d2r h ILE 72 Cb -0.01 0.21 0.00 0.00 -0.74 0.00 0.00 36.82 36.28 3d2r h ILE 72 CO -0.03 0.03 0.00 0.47 0.00 0.00 0.00 178.15 178.62 3d2r n ASP 73 N -5.29 0.48 -0.02 1.72 10.43 -1.04 -0.94 116.55 121.88 3d2r n ASP 73 Ca 0.15 0.66 0.14 0.00 2.57 0.00 0.00 54.79 58.31 3d2r n ASP 73 Cb 0.50 -0.74 0.61 0.00 1.84 0.00 0.00 41.12 43.33 3d2r n ASP 73 CO 0.00 0.00 0.00 -0.38 -1.07 0.00 0.00 177.20 175.75 3d2r n ILE 74 N -2.07 0.00 -1.67 0.53 5.41 -0.31 -4.94 119.36 116.30 3d2r n ILE 74 Ca 0.01 -0.01 -0.30 0.00 1.00 0.00 0.00 62.75 63.45 3d2r n ILE 74 Cb 0.13 -0.34 0.09 0.00 -0.71 0.00 0.00 39.64 38.82 3d2r n ILE 74 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 3d2r s LEU 75 N -2.78 2.55 0.30 1.39 1.43 -0.12 -4.95 118.68 116.49 3d2r s LEU 75 Ca 0.20 1.14 -0.30 0.00 -1.03 0.00 0.00 54.13 54.15 3d2r s LEU 75 Cb 0.19 -3.73 -0.12 0.00 0.03 0.00 0.00 46.19 42.56 3d2r s LEU 75 CO 0.52 -1.92 1.45 -2.65 0.23 0.00 0.00 176.35 173.97 3d2r n PRO 76 N -3.38 2.34 -0.34 1.29 -0.02 -1.26 -4.76 135.00 128.87 3d2r n PRO 76 Ca 0.07 0.83 0.15 0.00 -2.02 0.00 0.00 63.50 62.53 3d2r n PRO 76 Cb 0.58 -2.51 0.35 0.00 -0.02 0.00 0.00 33.50 31.89 3d2r n PRO 76 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 3d2r h THR 77 N 3.01 0.58 0.00 3.45 2.02 -1.95 0.34 112.91 120.35 3d2r h THR 77 Ca -0.47 -0.21 -0.00 0.00 0.77 0.00 0.00 66.41 66.51 3d2r h THR 77 Cb 1.26 -0.07 -0.00 0.00 -1.74 0.00 0.00 68.15 67.60 3d2r h THR 77 CO 0.72 0.11 -0.01 1.56 0.37 0.00 0.00 175.52 178.27 3d2r h GLN 78 N 0.60 0.00 0.03 6.66 1.08 -1.98 -2.03 115.11 119.47 3d2r h GLN 78 Ca 0.60 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.80 3d2r h GLN 78 Cb 1.08 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.51 3d2r h GLN 78 CO -0.45 0.01 -0.01 1.25 -0.95 0.00 0.00 178.83 178.67 3d2r h LEU 79 N 0.00 -0.03 -0.89 1.46 5.85 -0.71 -3.33 115.31 117.65 3d2r h LEU 79 Ca -0.00 -0.45 0.13 0.00 0.84 0.00 0.00 57.88 58.40 3d2r h LEU 79 Cb 0.60 0.01 -0.09 0.00 0.37 0.00 0.00 40.66 41.55 3d2r h LEU 79 CO 0.00 0.68 0.51 0.58 -0.34 0.00 0.00 178.44 179.86 3d2r h VAL 80 N -0.99 0.81 0.00 1.05 2.07 -1.28 -0.81 116.25 117.10 3d2r h VAL 80 Ca -0.00 -0.26 0.00 0.00 0.82 0.00 0.00 66.70 67.26 3d2r h VAL 80 Cb 0.48 -0.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.24 3d2r h VAL 80 CO 0.01 0.14 0.00 0.59 0.02 0.00 0.00 177.57 178.32 3d2r n ASN 81 N -4.77 0.00 -4.75 0.57 3.02 -0.77 -3.43 115.26 105.13 3d2r n ASN 81 Ca 0.17 -1.16 -0.36 0.00 -0.03 0.00 0.00 54.58 53.20 3d2r n ASN 81 Cb 0.39 0.00 0.05 0.00 -0.61 0.00 0.00 39.78 39.61 3d2r n ASN 81 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 3d2r s THR 82 N -2.00 2.43 0.42 3.41 -4.23 -0.31 -4.82 115.64 110.54 3d2r s THR 82 Ca 0.34 0.27 0.09 0.00 -1.18 0.00 0.00 61.69 61.21 3d2r s THR 82 Cb 0.15 -3.10 0.29 0.00 1.34 0.00 0.00 72.50 71.18 3d2r s THR 82 CO 0.26 -0.06 2.03 0.77 -0.54 0.00 0.00 174.62 177.08 3d2r h SER 83 N 0.76 0.43 -0.20 3.99 4.64 -1.89 0.10 113.55 121.39 3d2r h SER 83 Ca -0.51 -0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 60.77 3d2r h SER 83 Cb 1.31 -0.10 -0.01 0.00 -0.31 0.00 0.00 62.40 63.29 3d2r h SER 83 CO 0.54 0.30 -0.02 0.28 -0.87 0.00 0.00 176.83 177.06 3d2r h SER 84 N 0.50 0.36 0.07 4.97 0.02 -1.89 0.58 113.55 118.16 3d2r h SER 84 Ca 0.19 -0.33 -0.17 0.00 -0.84 0.00 0.00 61.79 60.64 3d2r h SER 84 Cb 0.15 -0.10 -0.00 0.00 0.14 0.00 0.00 62.40 62.58 3d2r h SER 84 CO -0.05 0.61 -0.61 0.58 -1.14 0.00 0.00 176.83 176.22 3d2r h VAL 85 N 0.10 1.33 -1.01 2.27 2.07 -1.74 -1.99 116.25 117.28 3d2r h VAL 85 Ca 0.05 -1.89 0.04 0.00 0.82 0.00 0.00 66.70 65.72 3d2r h VAL 85 Cb 0.44 1.87 -0.06 0.00 -1.52 0.00 0.00 31.29 32.02 3d2r h VAL 85 CO 0.01 0.58 0.66 1.56 0.02 0.00 0.00 177.57 180.41 3d2r h GLN 86 N 0.39 1.24 0.09 1.57 1.08 -0.92 -1.76 115.11 116.80 3d2r h GLN 86 Ca -0.01 -0.07 0.00 0.00 -1.45 0.00 0.00 58.65 57.12 3d2r h GLN 86 Cb 1.16 -0.28 -0.01 0.00 -0.05 0.00 0.00 27.48 28.30 3d2r h GLN 86 CO 0.11 0.82 -0.08 -0.07 -0.95 0.00 0.00 178.83 178.66 3d2r h LEU 87 N 1.28 -0.21 -0.47 1.46 3.38 -0.70 -0.76 115.31 119.29 3d2r h LEU 87 Ca 0.40 0.02 0.06 0.00 0.09 0.00 0.00 57.88 58.45 3d2r h LEU 87 Cb -0.01 0.07 -0.05 0.00 0.09 0.00 0.00 40.66 40.77 3d2r h LEU 87 CO -0.12 -0.13 0.18 0.58 0.09 0.00 0.00 178.44 179.04 3d2r h VAL 88 N -0.18 0.87 -0.47 1.22 2.07 -1.24 -0.47 116.25 118.05 3d2r h VAL 88 Ca 0.00 -0.13 -0.03 0.00 0.82 0.00 0.00 66.70 67.37 3d2r h VAL 88 Cb 0.18 0.47 -0.02 0.00 -1.52 0.00 0.00 31.29 30.40 3d2r h VAL 88 CO -0.02 0.07 0.18 0.50 0.02 0.00 0.00 177.57 178.31 3d2r h LYS 89 N 0.37 0.72 -0.24 1.57 3.64 -1.28 -0.58 116.57 120.76 3d2r h LYS 89 Ca 0.22 -0.14 -0.03 0.00 -1.27 0.00 0.00 60.65 59.43 3d2r h LYS 89 Cb 0.20 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 31.90 3d2r h LYS 89 CO -0.21 0.66 -0.00 0.66 -2.27 0.00 0.00 179.45 178.29 3d2r h SER 90 N 0.63 0.33 -0.01 4.20 4.64 -0.70 -1.52 113.55 121.11 3d2r h SER 90 Ca 0.16 -0.05 -0.00 0.00 -0.47 0.00 0.00 61.79 61.43 3d2r h SER 90 Cb 0.22 -0.09 -0.00 0.00 -0.31 0.00 0.00 62.40 62.22 3d2r h SER 90 CO -0.01 0.39 -0.01 -0.50 -0.87 0.00 0.00 176.83 175.83 3d2r h TRP 91 N 0.35 0.02 -0.88 4.77 6.55 -0.54 -1.89 115.95 124.34 3d2r h TRP 91 Ca 0.08 -0.01 0.08 0.00 0.95 0.00 0.00 58.89 59.99 3d2r h TRP 91 Cb 0.24 -0.01 -0.07 0.00 -0.86 0.00 0.00 29.16 28.47 3d2r h TRP 91 CO 0.01 0.48 0.54 1.88 -1.05 0.00 0.00 178.44 180.30 3d2r h TYR 92 N -0.44 0.99 -0.17 0.49 -1.99 -1.02 -0.45 116.97 114.39 3d2r h TYR 92 Ca 0.00 0.03 -0.05 0.00 2.00 0.00 0.00 58.73 60.72 3d2r h TYR 92 Cb 0.48 -0.31 -0.00 0.00 2.00 0.00 0.00 36.73 38.89 3d2r h TYR 92 CO 0.09 0.46 -0.07 0.82 -0.00 0.00 0.00 178.16 179.45 3d2r h ILE 93 N 0.94 1.31 -0.80 -2.88 2.04 -1.28 -0.78 117.51 116.05 3d2r h ILE 93 Ca 0.40 -1.11 -0.02 0.00 1.00 0.00 0.00 64.86 65.14 3d2r h ILE 93 Cb 0.27 1.68 -0.04 0.00 -0.74 0.00 0.00 36.82 38.00 3d2r h ILE 93 CO -0.21 0.33 0.42 -0.61 0.00 0.00 0.00 178.15 178.08 3d2r h GLN 94 N 0.03 1.14 -0.63 2.37 5.75 -0.90 -1.91 115.11 120.95 3d2r h GLN 94 Ca 0.04 -0.15 -0.02 0.00 -0.15 0.00 0.00 58.65 58.37 3d2r h GLN 94 Cb 0.54 -0.21 -0.03 0.00 1.07 0.00 0.00 27.48 28.85 3d2r h GLN 94 CO 0.02 0.86 0.31 0.77 -2.65 0.00 0.00 178.83 178.14 3d2r h SER 95 N 1.13 0.83 -0.63 -0.69 0.02 -1.01 -0.22 113.55 112.98 3d2r h SER 95 Ca 0.28 -0.13 -0.02 0.00 -0.84 0.00 0.00 61.79 61.08 3d2r h SER 95 Cb 0.07 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 62.37 3d2r h SER 95 CO -0.04 0.72 0.30 0.25 -1.14 0.00 0.00 176.83 176.93 3d2r h LEU 96 N 0.87 0.83 -0.31 5.07 6.46 -0.79 -2.05 115.31 125.39 3d2r h LEU 96 Ca 0.22 -0.13 -0.02 0.00 -0.12 0.00 0.00 57.88 57.82 3d2r h LEU 96 Cb 0.11 -0.21 -0.01 0.00 -0.73 0.00 0.00 40.66 39.82 3d2r h LEU 96 CO -0.03 0.73 0.11 0.24 -0.62 0.00 0.00 178.44 178.87 3d2r h MET 97 N 0.87 0.48 -0.85 1.25 2.86 -0.95 -1.89 114.93 116.69 3d2r h MET 97 Ca 0.22 -0.10 0.16 0.00 -2.06 0.00 0.00 59.70 57.92 3d2r h MET 97 Cb 0.12 -0.07 -0.10 0.00 0.06 0.00 0.00 31.60 31.61 3d2r h MET 97 CO -0.03 0.51 0.41 -0.44 1.06 0.00 0.00 176.91 178.42 3d2r h ASP 98 N 0.35 0.46 -0.18 1.22 3.32 -0.85 -0.86 116.42 119.87 3d2r h ASP 98 Ca 0.10 0.11 -0.18 0.00 0.02 0.00 0.00 57.03 57.08 3d2r h ASP 98 Cb 0.22 0.04 0.01 0.00 0.22 0.00 0.00 39.33 39.82 3d2r h ASP 98 CO -0.01 0.16 -0.59 -0.07 -1.72 0.00 0.00 179.24 177.02 3d2r h LEU 99 N 0.56 0.82 -1.23 1.55 3.38 -1.15 -3.25 115.31 115.98 3d2r h LEU 99 Ca 0.48 -0.60 -0.07 0.00 0.09 0.00 0.00 57.88 57.78 3d2r h LEU 99 Cb 0.74 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 3d2r h LEU 99 CO -0.40 1.28 -0.35 0.58 0.09 0.00 0.00 178.44 179.64 3d2r h VAL 100 N 0.41 1.05 -0.55 1.22 2.07 -0.94 -2.06 116.25 117.44 3d2r h VAL 100 Ca -0.02 -1.29 0.16 0.00 0.82 0.00 0.00 66.70 66.36 3d2r h VAL 100 Cb 1.21 1.74 -0.02 0.00 -1.52 0.00 0.00 31.29 32.70 3d2r h VAL 100 CO 0.12 0.34 0.50 -0.33 0.02 0.00 0.00 177.57 178.23 3d2r h GLU 101 N 0.00 0.00 -0.00 1.57 5.08 -1.20 -0.96 114.58 119.06 3d2r h GLU 101 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3d2r h GLU 101 Cb 0.71 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.96 3d2r h GLU 101 CO 0.05 0.00 -0.05 1.19 -1.00 0.00 0.00 179.01 179.19 3d2r n PHE 102 N -3.91 0.00 0.21 4.33 3.01 -0.78 -4.16 117.46 116.16 3d2r n PHE 102 Ca 0.11 0.00 0.05 0.00 1.01 0.00 0.00 57.45 58.62 3d2r n PHE 102 Cb 0.72 -0.21 0.47 0.00 -0.01 0.00 0.00 39.48 40.45 3d2r n PHE 102 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 3d2r h HIS 103 N 0.29 0.00 -0.00 1.38 3.86 -1.32 -1.98 115.15 117.37 3d2r h HIS 103 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 3d2r h HIS 103 Cb 0.30 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.77 3d2r h HIS 103 CO 0.00 0.25 -0.14 -0.85 0.86 0.00 0.00 177.93 178.05 3d2r n GLU 104 N -4.16 0.24 -3.03 2.45 0.28 -1.26 -4.90 120.64 110.26 3d2r n GLU 104 Ca -0.02 -0.06 -0.33 0.00 -0.16 0.00 0.00 57.16 56.58 3d2r n GLU 104 Cb 0.31 -1.50 -0.06 0.00 1.43 0.00 0.00 31.44 31.62 3d2r n GLU 104 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 177.13 177.12 3d2r s LYS 105 N -2.81 4.11 0.07 3.44 -0.14 -0.75 -5.05 119.74 118.62 3d2r s LYS 105 Ca 0.19 0.84 -0.30 0.00 -1.36 0.00 0.00 55.97 55.34 3d2r s LYS 105 Cb 0.19 -2.42 -0.05 0.00 -1.68 0.00 0.00 37.83 33.87 3d2r s LYS 105 CO 0.54 0.13 1.09 0.45 -0.76 0.00 0.00 175.35 176.81 3d2r s SER 106 N -2.16 7.24 0.56 2.83 0.15 -1.26 -4.93 113.70 116.12 3d2r s SER 106 Ca 0.55 1.90 0.36 0.00 0.70 0.00 0.00 55.95 59.46 3d2r s SER 106 Cb -0.11 -2.58 1.96 0.00 -1.71 0.00 0.00 66.02 63.58 3d2r s SER 106 CO 0.17 -0.33 2.10 -0.65 1.20 0.00 0.00 173.24 175.73 3d2r h PRO 107 N 6.38 0.00 -0.01 5.44 0.11 -1.95 -0.49 132.00 141.48 3d2r h PRO 107 Ca -0.42 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.69 3d2r h PRO 107 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 3d2r h PRO 107 CO 0.77 0.00 -0.10 -0.25 -0.21 0.00 0.00 178.00 178.21 3d2r n ASP 108 N -2.80 0.78 -4.54 -2.05 10.43 -1.26 -4.64 116.55 112.48 3d2r n ASP 108 Ca -0.02 -0.91 -0.42 0.00 2.57 0.00 0.00 54.79 56.00 3d2r n ASP 108 Cb 0.10 -0.00 -0.03 0.00 1.84 0.00 0.00 41.12 43.02 3d2r n ASP 108 CO 0.00 0.00 0.00 -0.62 -1.07 0.00 0.00 177.20 175.51 3d2r s ASP 109 N -2.31 6.24 0.36 -2.24 -1.08 -0.19 -4.89 116.67 112.57 3d2r s ASP 109 Ca 0.32 -0.42 0.03 0.00 -0.52 0.00 0.00 52.55 51.97 3d2r s ASP 109 Cb 0.20 -2.52 0.69 0.00 -1.46 0.00 0.00 42.92 39.84 3d2r s ASP 109 CO 0.44 -1.62 2.02 -0.61 0.52 0.00 0.00 175.17 175.92 3d2r h GLN 110 N 9.76 0.76 -0.55 4.34 5.75 -1.86 -0.98 115.11 132.34 3d2r h GLN 110 Ca -0.27 -0.05 -0.06 0.00 -0.15 0.00 0.00 58.65 58.12 3d2r h GLN 110 Cb 1.06 -0.17 -0.02 0.00 1.07 0.00 0.00 27.48 29.41 3d2r h GLN 110 CO 1.22 0.51 0.11 -0.22 -2.65 0.00 0.00 178.83 177.79 3d2r h LYS 111 N 0.79 0.89 -0.99 1.69 3.64 -1.96 -1.66 116.57 118.97 3d2r h LYS 111 Ca 0.21 -0.23 0.07 0.00 -1.27 0.00 0.00 60.65 59.43 3d2r h LYS 111 Cb -0.09 -0.11 -0.07 0.00 -0.41 0.00 0.00 32.23 31.55 3d2r h LYS 111 CO -0.05 0.86 0.63 0.00 -2.27 0.00 0.00 179.45 178.62 3d2r h ALA 112 N 1.00 1.38 -0.33 5.00 0.00 -1.55 -1.01 119.26 123.75 3d2r h ALA 112 Ca 0.17 -0.02 -0.16 0.00 0.00 0.00 0.00 54.91 54.90 3d2r h ALA 112 Cb 0.38 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 3d2r h ALA 112 CO 0.01 0.40 -0.44 -0.07 0.00 0.00 0.00 179.25 179.15 3d2r h LEU 113 N 1.14 0.93 -0.41 0.00 3.38 -1.10 0.65 115.31 119.89 3d2r h LEU 113 Ca 0.43 -0.45 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 3d2r h LEU 113 Cb 0.20 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 3d2r h LEU 113 CO -0.18 1.23 0.19 -1.28 0.09 0.00 0.00 178.44 178.48 3d2r h SER 114 N 0.69 0.54 -0.55 -0.43 0.87 -1.11 -2.55 113.55 111.01 3d2r h SER 114 Ca 0.04 -0.14 -0.09 0.00 -1.23 0.00 0.00 61.79 60.38 3d2r h SER 114 Cb 1.03 -0.14 -0.02 0.00 -0.44 0.00 0.00 62.40 62.82 3d2r h SER 114 CO 0.10 0.53 0.00 0.44 -0.53 0.00 0.00 176.83 177.38 3d2r h ASP 115 N 0.52 0.97 -0.45 6.23 3.32 -0.96 -2.41 116.42 123.63 3d2r h ASP 115 Ca 0.14 -0.26 0.05 0.00 0.02 0.00 0.00 57.03 56.98 3d2r h ASP 115 Cb 0.14 -0.26 -0.05 0.00 0.22 0.00 0.00 39.33 39.38 3d2r h ASP 115 CO -0.02 1.02 0.19 0.15 -1.72 0.00 0.00 179.24 178.86 3d2r h PHE 116 N 0.91 0.34 -0.55 4.55 3.57 -0.75 0.18 116.94 125.18 3d2r h PHE 116 Ca 0.17 0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.72 3d2r h PHE 116 Cb 0.52 -0.09 -0.04 0.00 2.79 0.00 0.00 35.95 39.14 3d2r h PHE 116 CO 0.03 0.15 0.32 0.28 -2.23 0.00 0.00 178.31 176.86 3d2r h VAL 117 N 0.38 1.04 -0.74 1.41 2.07 -1.21 -0.08 116.25 119.11 3d2r h VAL 117 Ca 0.21 -0.22 -0.05 0.00 0.82 0.00 0.00 66.70 67.46 3d2r h VAL 117 Cb 0.17 0.34 -0.03 0.00 -1.52 0.00 0.00 31.29 30.25 3d2r h VAL 117 CO -0.18 0.12 0.27 0.44 0.02 0.00 0.00 177.57 178.24 3d2r h ASP 118 N 0.64 1.04 -0.80 0.57 3.32 -0.86 -0.95 116.42 119.38 3d2r h ASP 118 Ca 0.23 -0.19 0.00 0.00 0.02 0.00 0.00 57.03 57.09 3d2r h ASP 118 Cb 0.05 -0.27 -0.04 0.00 0.22 0.00 0.00 39.33 39.29 3d2r h ASP 118 CO -0.11 0.94 0.50 0.74 -1.72 0.00 0.00 179.24 179.59 3d2r h THR 119 N 1.07 1.22 -0.39 0.35 2.02 -0.22 -1.19 112.91 115.77 3d2r h THR 119 Ca 0.24 -0.45 -0.09 0.00 0.77 0.00 0.00 66.41 66.89 3d2r h THR 119 Cb 0.25 0.08 -0.02 0.00 -1.74 0.00 0.00 68.15 66.72 3d2r h THR 119 CO -0.02 0.22 -0.12 -0.07 0.37 0.00 0.00 175.52 175.90 3d2r h LEU 120 N 1.09 0.68 -0.83 2.58 3.38 -0.48 -0.06 115.31 121.67 3d2r h LEU 120 Ca 0.29 -0.20 -0.06 0.00 0.09 0.00 0.00 57.88 58.00 3d2r h LEU 120 Cb -0.07 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.47 3d2r h LEU 120 CO -0.06 0.83 0.17 0.40 0.09 0.00 0.00 178.44 179.87 3d2r h ILE 121 N 0.63 1.25 -0.33 1.22 2.04 -0.99 0.19 117.51 121.52 3d2r h ILE 121 Ca 0.11 -0.92 -0.10 0.00 1.00 0.00 0.00 64.86 64.95 3d2r h ILE 121 Cb 0.57 0.55 -0.01 0.00 -0.74 0.00 0.00 36.82 37.20 3d2r h ILE 121 CO 0.04 0.35 -0.20 0.50 0.00 0.00 0.00 178.15 178.84 3d2r h LYS 122 N 1.00 0.72 -0.24 2.37 3.64 -0.51 -1.39 116.57 122.16 3d2r h LYS 122 Ca 0.21 -0.33 -0.01 0.00 -1.27 0.00 0.00 60.65 59.25 3d2r h LYS 122 Cb 0.34 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.13 3d2r h LYS 122 CO -0.00 0.94 0.12 0.28 -2.27 0.00 0.00 179.45 178.51 3d2r h VAL 123 N 0.49 1.14 -0.35 2.00 2.07 -0.93 0.13 116.25 120.80 3d2r h VAL 123 Ca 0.07 -0.42 0.07 0.00 0.82 0.00 0.00 66.70 67.24 3d2r h VAL 123 Cb 0.75 0.98 -0.06 0.00 -1.52 0.00 0.00 31.29 31.43 3d2r h VAL 123 CO 0.06 0.14 -0.05 -0.09 0.02 0.00 0.00 177.57 177.65 3d2r h ARG 124 N 0.26 0.04 -0.73 1.57 2.43 -0.57 0.68 114.38 118.06 3d2r h ARG 124 Ca 0.08 -0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 59.20 3d2r h ARG 124 Cb 0.12 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.63 3d2r h ARG 124 CO -0.01 0.03 0.24 -0.91 -1.51 0.00 0.00 179.97 177.81 3d2r h ASN 125 N 0.04 1.03 -0.05 -3.80 2.35 -0.93 -2.47 115.58 111.76 3d2r h ASN 125 Ca 0.17 -0.18 -0.07 0.00 -0.55 0.00 0.00 56.30 55.67 3d2r h ASN 125 Cb 0.25 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.34 3d2r h ASN 125 CO -0.33 0.95 -0.14 -0.09 -1.65 0.00 0.00 177.43 176.16 3d2r h ARG 126 N 1.07 0.38 -0.23 0.81 2.43 -0.07 -2.41 114.38 116.36 3d2r h ARG 126 Ca 0.24 -0.11 0.00 0.00 -0.81 0.00 0.00 59.98 59.30 3d2r h ARG 126 Cb 0.27 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.78 3d2r h ARG 126 CO -0.01 0.53 0.00 0.72 -1.51 0.00 0.00 179.97 179.70 3d2r n HIS 127 N -4.22 0.30 -0.30 2.20 8.25 0.17 -4.45 115.22 117.17 3d2r n HIS 127 Ca 0.00 -0.15 -0.03 0.00 -0.26 0.00 0.00 57.72 57.28 3d2r n HIS 127 Cb 0.31 0.00 0.09 0.00 1.12 0.00 0.00 29.99 31.52 3d2r n HIS 127 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 3d2r h HIS 128 N 2.43 1.00 -0.93 4.41 6.17 -0.99 -1.81 115.15 125.43 3d2r h HIS 128 Ca 0.00 0.03 -0.44 0.00 0.71 0.00 0.00 60.37 60.66 3d2r h HIS 128 Cb 0.54 -0.33 -0.26 0.00 2.52 0.00 0.00 27.41 29.87 3d2r h HIS 128 CO 0.15 0.59 0.56 0.09 0.71 0.00 0.00 177.93 180.04 3d2r n ASN 129 N -4.56 4.02 0.01 3.26 3.02 -1.26 -4.63 115.26 115.11 3d2r n ASN 129 Ca 0.09 -3.50 -0.12 0.00 -0.03 0.00 0.00 54.58 51.02 3d2r n ASN 129 Cb 0.06 -0.82 -0.07 0.00 -0.61 0.00 0.00 39.78 38.35 3d2r n ASN 129 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 3d2r h VAL 130 N 1.40 1.10 0.47 2.41 2.07 -1.63 -1.68 116.25 120.39 3d2r h VAL 130 Ca 0.55 -0.28 -0.02 0.00 0.82 0.00 0.00 66.70 67.77 3d2r h VAL 130 Cb 2.74 1.18 0.00 0.00 -1.52 0.00 0.00 31.29 33.69 3d2r h VAL 130 CO 1.02 0.08 -0.23 0.58 0.02 0.00 0.00 177.57 179.04 3d2r h VAL 131 N -0.02 0.53 0.00 2.57 2.07 -1.83 -0.29 116.25 119.28 3d2r h VAL 131 Ca 0.02 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.53 3d2r h VAL 131 Cb 0.10 0.53 -0.00 0.00 -1.52 0.00 0.00 31.29 30.40 3d2r h VAL 131 CO -0.00 0.00 -0.03 1.55 0.02 0.00 0.00 177.57 179.11 3d2r h PRO 132 N -0.63 0.00 -0.02 1.57 0.13 -1.91 -0.52 132.00 130.61 3d2r h PRO 132 Ca -0.06 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 65.01 3d2r h PRO 132 Cb 0.49 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.62 3d2r h PRO 132 CO 0.10 0.03 -0.20 1.15 -0.23 0.00 0.00 178.00 178.84 3d2r h THR 133 N 0.00 1.51 -0.43 1.56 2.02 -0.56 -2.20 112.91 114.81 3d2r h THR 133 Ca -0.00 -1.78 0.03 0.00 0.77 0.00 0.00 66.41 65.42 3d2r h THR 133 Cb 0.12 2.60 -0.03 0.00 -1.74 0.00 0.00 68.15 69.10 3d2r h THR 133 CO 0.00 0.49 0.23 -0.03 0.37 0.00 0.00 175.52 176.58 3d2r h MET 134 N -0.44 0.44 -0.86 6.66 1.85 -0.91 -1.30 114.93 120.37 3d2r h MET 134 Ca -0.02 -0.03 0.04 0.00 -0.61 0.00 0.00 59.70 59.09 3d2r h MET 134 Cb 0.91 -0.10 -0.05 0.00 0.43 0.00 0.00 31.60 32.78 3d2r h MET 134 CO 0.04 0.29 0.55 0.00 -0.40 0.00 0.00 176.91 177.39 3d2r h ALA 135 N 1.21 1.15 -0.92 0.39 0.00 -1.12 0.17 119.26 120.14 3d2r h ALA 135 Ca 0.18 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.08 3d2r h ALA 135 Cb 0.06 -0.27 -0.05 0.00 0.00 0.00 0.00 17.79 17.53 3d2r h ALA 135 CO -0.11 0.35 0.61 1.96 0.00 0.00 0.00 179.25 182.06 3d2r h GLN 136 N 1.04 1.18 -0.67 0.00 1.08 -1.21 -1.42 115.11 115.11 3d2r h GLN 136 Ca 0.35 -0.07 0.02 0.00 -1.45 0.00 0.00 58.65 57.51 3d2r h GLN 136 Cb 0.07 -0.27 -0.04 0.00 -0.05 0.00 0.00 27.48 27.19 3d2r h GLN 136 CO -0.14 0.78 0.42 0.78 -0.95 0.00 0.00 178.83 179.72 3d2r h GLY 137 N 1.22 0.95 0.82 3.46 0.00 0.45 -0.42 103.07 109.55 3d2r h GLY 137 Ca 0.35 -0.32 -0.02 0.00 0.00 0.00 0.00 47.33 47.34 3d2r h GLY 137 CO -0.09 0.28 -0.33 -2.22 0.00 0.00 0.00 176.54 174.18 3d2r h ILE 138 N 0.83 0.31 -0.49 2.60 1.08 -0.85 0.53 117.51 121.54 3d2r h ILE 138 Ca 0.26 0.00 0.06 0.00 -0.39 0.00 0.00 64.86 64.80 3d2r h ILE 138 Cb -0.01 0.31 -0.09 0.00 -3.07 0.00 0.00 36.82 33.97 3d2r h ILE 138 CO -0.09 0.00 -0.51 0.40 -0.69 0.00 0.00 178.15 177.25 3d2r h ILE 139 N -0.81 0.04 -0.07 -0.67 2.04 -1.14 0.24 117.51 117.14 3d2r h ILE 139 Ca -0.06 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.81 3d2r h ILE 139 Cb 0.67 0.04 -0.01 0.00 -0.74 0.00 0.00 36.82 36.77 3d2r h ILE 139 CO 0.04 0.00 -0.09 -0.33 0.00 0.00 0.00 178.15 177.77 3d2r h GLU 140 N -0.33 -0.06 -0.98 2.37 3.07 -0.85 -2.38 114.58 115.44 3d2r h GLU 140 Ca 0.11 0.00 0.23 0.00 -0.50 0.00 0.00 59.36 59.21 3d2r h GLU 140 Cb 0.58 0.01 -0.18 0.00 -0.84 0.00 0.00 28.75 28.32 3d2r h GLU 140 CO -0.64 -0.04 -0.10 -0.92 -1.40 0.00 0.00 179.01 175.92 3d2r h TYR 141 N -0.06 -0.26 0.00 4.33 -0.00 -0.60 -0.54 116.97 119.85 3d2r h TYR 141 Ca 0.01 0.08 0.00 0.00 -0.00 0.00 0.00 58.73 58.82 3d2r h TYR 141 Cb 0.10 0.27 0.00 0.00 -0.00 0.00 0.00 36.73 37.10 3d2r h TYR 141 CO -0.64 -0.42 0.00 1.17 -0.00 0.00 0.00 178.16 178.27 3d2r n LYS 142 N -5.54 0.03 0.00 1.82 4.81 0.83 -1.45 118.16 118.66 3d2r n LYS 142 Ca 0.19 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.63 3d2r n LYS 142 Cb 0.63 -1.10 0.00 0.00 0.02 0.00 0.00 35.03 34.58 3d2r n LYS 142 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3d2r n ALA 144 N 0.58 0.00 0.00 3.14 0.00 -0.21 -0.88 120.51 123.14 3d2r n ALA 144 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3d2r n ALA 144 Cb 0.01 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.46 3d2r n ALA 144 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3d2r n THR 146 N -0.62 0.00 -1.84 0.00 -1.04 -0.06 -4.97 114.28 105.75 3d2r n THR 146 Ca 0.00 0.00 -0.38 0.00 -2.04 0.00 0.00 64.05 61.63 3d2r n THR 146 Cb 0.00 0.00 0.04 0.00 -1.82 0.00 0.00 70.33 68.55 3d2r n THR 146 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 3d2r s VAL 147 N -0.64 2.21 0.11 12.58 1.01 -1.26 -4.85 120.40 129.56 3d2r s VAL 147 Ca 0.00 0.15 -0.13 0.00 0.00 0.00 0.00 61.98 62.00 3d2r s VAL 147 Cb 0.00 -3.07 0.02 0.00 0.00 0.00 0.00 36.38 33.33 3d2r s VAL 147 CO 0.00 -0.01 0.32 -0.62 0.00 0.00 0.00 175.10 174.79 3d2r s ASP 148 N -1.12 -0.09 0.30 3.32 2.15 -1.26 -3.78 116.67 116.18 3d2r s ASP 148 Ca 0.73 -0.43 0.23 0.00 0.43 0.00 0.00 52.55 53.51 3d2r s ASP 148 Cb -0.38 0.42 0.26 0.00 -0.30 0.00 0.00 42.92 42.92 3d2r s ASP 148 CO 0.44 -0.79 1.39 -0.65 -0.17 0.00 0.00 175.17 175.38 3d2r h PRO 149 N 2.56 0.00 0.00 4.34 0.11 -1.78 0.55 132.00 137.77 3d2r h PRO 149 Ca -0.34 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 65.68 3d2r h PRO 149 Cb 1.23 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 3d2r h PRO 149 CO 0.50 0.00 -0.45 0.28 -0.21 0.00 0.00 178.00 178.13 3d2r h VAL 150 N 0.00 1.16 -0.00 3.15 2.07 -1.92 -3.27 116.25 117.45 3d2r h VAL 150 Ca 0.00 -1.61 0.00 0.00 0.82 0.00 0.00 66.70 65.91 3d2r h VAL 150 Cb 0.95 1.91 0.00 0.00 -1.52 0.00 0.00 31.29 32.63 3d2r h VAL 150 CO 0.00 0.44 -0.28 0.35 0.02 0.00 0.00 177.57 178.09 3d2r n THR 151 N -3.78 0.00 -3.91 2.57 -2.24 -1.13 -4.89 114.28 100.89 3d2r n THR 151 Ca -0.01 -0.36 -0.34 0.00 -2.27 0.00 0.00 64.05 61.07 3d2r n THR 151 Cb 0.50 1.00 -0.13 0.00 -2.10 0.00 0.00 70.33 69.60 3d2r n THR 151 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 3d2r s ASN 152 N -1.56 4.93 0.43 3.42 2.47 0.19 -4.96 114.94 119.86 3d2r s ASN 152 Ca 0.02 -1.78 0.18 0.00 0.42 0.00 0.00 52.86 51.70 3d2r s ASN 152 Cb 0.05 -1.71 0.96 0.00 -1.45 0.00 0.00 41.25 39.09 3d2r s ASN 152 CO 0.25 -0.38 1.91 1.56 -3.72 0.00 0.00 177.10 176.72 3d2r h GLN 153 N 7.89 0.00 -0.31 0.43 4.20 -1.83 -2.58 115.11 122.91 3d2r h GLN 153 Ca -0.14 0.00 -0.12 0.00 0.06 0.00 0.00 58.65 58.45 3d2r h GLN 153 Cb 1.04 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.81 3d2r h GLN 153 CO 0.58 0.27 -0.31 -0.91 -0.67 0.00 0.00 178.83 177.79 3d2r h ASN 154 N 0.00 0.69 -0.26 1.46 2.35 -1.93 -0.49 115.58 117.39 3d2r h ASN 154 Ca -0.00 -0.27 -0.11 0.00 -0.55 0.00 0.00 56.30 55.37 3d2r h ASN 154 Cb 0.55 -0.19 -0.00 0.00 0.05 0.00 0.00 38.32 38.72 3d2r h ASN 154 CO 0.04 0.95 -0.26 0.25 -1.65 0.00 0.00 177.43 176.76 3d2r h LEU 155 N 0.57 0.68 -0.45 1.61 6.46 -1.79 -1.31 115.31 121.08 3d2r h LEU 155 Ca 0.07 -0.47 0.04 0.00 -0.12 0.00 0.00 57.88 57.39 3d2r h LEU 155 Cb 0.81 -0.19 -0.04 0.00 -0.73 0.00 0.00 40.66 40.51 3d2r h LEU 155 CO 0.07 1.02 0.22 -0.61 -0.62 0.00 0.00 178.44 178.52 3d2r h GLN 156 N 0.36 0.44 -0.14 1.25 5.75 -1.34 -1.23 115.11 120.20 3d2r h GLN 156 Ca 0.04 -0.03 -0.00 0.00 -0.15 0.00 0.00 58.65 58.51 3d2r h GLN 156 Cb 0.82 -0.10 -0.01 0.00 1.07 0.00 0.00 27.48 29.27 3d2r h GLN 156 CO 0.06 0.29 0.07 -0.92 -2.65 0.00 0.00 178.83 175.68 3d2r h TYR 157 N 0.45 0.20 -0.35 3.99 3.20 -1.03 -1.89 116.97 121.53 3d2r h TYR 157 Ca 0.19 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.08 3d2r h TYR 157 Cb 0.10 -0.06 -0.03 0.00 1.54 0.00 0.00 36.73 38.27 3d2r h TYR 157 CO -0.10 0.23 0.18 0.35 -1.64 0.00 0.00 178.16 177.17 3d2r h PHE 158 N 0.11 0.32 -0.68 -3.82 3.57 -1.15 -2.60 116.94 112.69 3d2r h PHE 158 Ca 0.05 0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.52 3d2r h PHE 158 Cb 0.10 -0.09 -0.03 0.00 2.79 0.00 0.00 35.95 38.72 3d2r h PHE 158 CO -0.03 0.17 0.27 -0.07 -2.23 0.00 0.00 178.31 176.42 3d2r h LEU 159 N 0.36 0.93 -0.68 0.59 3.38 -1.06 0.26 115.31 119.08 3d2r h LEU 159 Ca 0.15 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 57.99 3d2r h LEU 159 Cb 0.06 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.53 3d2r h LEU 159 CO -0.10 0.83 0.44 0.44 0.09 0.00 0.00 178.44 180.14 3d2r h ASP 160 N 0.99 0.80 -0.10 -0.43 3.32 -1.12 -0.54 116.42 119.33 3d2r h ASP 160 Ca 0.23 -0.03 -0.11 0.00 0.02 0.00 0.00 57.03 57.14 3d2r h ASP 160 Cb 0.20 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 39.55 3d2r h ASP 160 CO -0.02 0.59 -0.36 0.03 -1.72 0.00 0.00 179.24 177.76 3d2r h ARG 161 N 0.93 0.42 -0.30 3.56 3.08 -1.04 -1.05 114.38 119.98 3d2r h ARG 161 Ca 0.25 -0.32 -0.00 0.00 0.07 0.00 0.00 59.98 59.98 3d2r h ARG 161 Cb -0.09 0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.01 3d2r h ARG 161 CO -0.05 0.94 0.17 0.35 -1.07 0.00 0.00 179.97 180.32 3d2r h PHE 162 N -0.01 0.41 -0.11 3.04 3.57 -0.37 -0.45 116.94 123.02 3d2r h PHE 162 Ca -0.02 -0.01 -0.21 0.00 3.53 0.00 0.00 57.97 61.27 3d2r h PHE 162 Cb 0.98 -0.13 0.00 0.00 2.79 0.00 0.00 35.95 39.60 3d2r h PHE 162 CO 0.12 0.32 -0.78 1.88 -2.23 0.00 0.00 178.31 177.62 3d2r h TYR 163 N 0.38 0.82 -0.65 0.41 0.99 -1.14 -1.29 116.97 116.49 3d2r h TYR 163 Ca 0.11 -0.37 -0.05 0.00 2.00 0.00 0.00 58.73 60.41 3d2r h TYR 163 Cb 0.04 -0.12 -0.03 0.00 1.00 0.00 0.00 36.73 37.62 3d2r h TYR 163 CO -0.04 1.17 0.20 1.98 -0.00 0.00 0.00 178.16 181.47 3d2r h MET 164 N 0.41 1.01 -0.09 4.88 4.05 -1.08 0.68 114.93 124.78 3d2r h MET 164 Ca -0.05 -0.22 0.03 0.00 -0.28 0.00 0.00 59.70 59.18 3d2r h MET 164 Cb 1.39 -0.14 -0.04 0.00 -0.80 0.00 0.00 31.60 32.00 3d2r h MET 164 CO 0.15 0.89 -0.12 -0.97 0.23 0.00 0.00 176.91 177.09 3d2r h ASN 165 N 0.94 -0.37 -0.36 1.39 -0.73 -0.97 -0.88 115.58 114.60 3d2r h ASN 165 Ca 0.21 0.07 0.06 0.00 1.87 0.00 0.00 56.30 58.51 3d2r h ASN 165 Cb 0.30 0.18 -0.06 0.00 0.27 0.00 0.00 38.32 39.02 3d2r h ASN 165 CO -0.01 -0.16 0.01 -0.09 -0.37 0.00 0.00 177.43 176.81 3d2r h ARG 166 N -0.16 0.11 -0.84 6.67 2.43 -0.99 -1.25 114.38 120.35 3d2r h ARG 166 Ca 0.08 -0.01 0.13 0.00 -0.81 0.00 0.00 59.98 59.37 3d2r h ARG 166 Cb 0.27 -0.02 -0.09 0.00 -0.42 0.00 0.00 29.97 29.71 3d2r h ARG 166 CO -0.19 0.07 0.44 0.82 -1.51 0.00 0.00 179.97 179.60 3d2r h ILE 167 N 0.11 0.78 -0.29 1.20 2.04 -0.40 -0.94 117.51 120.01 3d2r h ILE 167 Ca 0.17 -0.23 -0.13 0.00 1.00 0.00 0.00 64.86 65.67 3d2r h ILE 167 Cb 0.23 0.06 -0.00 0.00 -0.74 0.00 0.00 36.82 36.37 3d2r h ILE 167 CO -0.28 0.12 -0.34 0.77 0.00 0.00 0.00 178.15 178.42 3d2r h SER 168 N 0.66 0.79 0.26 1.72 4.64 -0.73 -1.61 113.55 119.29 3d2r h SER 168 Ca 0.44 -0.49 -0.20 0.00 -0.47 0.00 0.00 61.79 61.07 3d2r h SER 168 Cb 0.57 -0.22 -0.00 0.00 -0.31 0.00 0.00 62.40 62.44 3d2r h SER 168 CO -0.33 1.12 -0.82 0.71 -0.87 0.00 0.00 176.83 176.64 3d2r h THR 169 N 0.48 1.38 -0.52 2.95 1.35 -0.99 -2.01 112.91 115.55 3d2r h THR 169 Ca 0.04 -2.26 0.00 0.00 -0.55 0.00 0.00 66.41 63.64 3d2r h THR 169 Cb 0.92 2.23 -0.03 0.00 -1.73 0.00 0.00 68.15 69.54 3d2r h THR 169 CO 0.08 0.68 0.33 -0.09 -0.25 0.00 0.00 175.52 176.27 3d2r h ARG 170 N 0.27 0.70 -0.00 4.72 2.43 -1.20 -1.46 114.38 119.84 3d2r h ARG 170 Ca -0.05 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.07 3d2r h ARG 170 Cb 1.42 -0.15 -0.00 0.00 -0.42 0.00 0.00 29.97 30.82 3d2r h ARG 170 CO 0.14 0.49 -0.00 1.98 -1.51 0.00 0.00 179.97 181.07 3d2r h MET 171 N 0.70 -0.00 -0.43 0.20 4.05 -1.13 0.96 114.93 119.28 3d2r h MET 171 Ca 0.19 0.00 -0.04 0.00 -0.28 0.00 0.00 59.70 59.57 3d2r h MET 171 Cb -0.04 0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 30.74 3d2r h MET 171 CO -0.04 -0.00 0.10 -0.07 0.23 0.00 0.00 176.91 177.13 3d2r h LEU 172 N -0.00 0.65 -0.32 3.39 4.07 -1.24 -0.91 115.31 120.95 3d2r h LEU 172 Ca 0.00 -0.23 -0.16 0.00 0.08 0.00 0.00 57.88 57.57 3d2r h LEU 172 Cb 0.01 -0.17 -0.00 0.00 1.08 0.00 0.00 40.66 41.57 3d2r h LEU 172 CO -0.01 0.71 -0.42 0.24 -1.08 0.00 0.00 178.44 177.89 3d2r h MET 173 N 0.55 0.85 -0.94 1.13 2.86 -1.18 -2.94 114.93 115.26 3d2r h MET 173 Ca 0.13 -0.49 -0.01 0.00 -2.06 0.00 0.00 59.70 57.28 3d2r h MET 173 Cb 0.32 0.04 -0.05 0.00 0.06 0.00 0.00 31.60 31.97 3d2r h MET 173 CO 0.00 1.13 0.56 -0.91 1.06 0.00 0.00 176.91 178.75 3d2r h ASN 174 N 0.64 1.13 -0.41 1.22 -0.26 -0.70 -1.38 115.58 115.83 3d2r h ASN 174 Ca 0.04 -0.07 0.08 0.00 -0.56 0.00 0.00 56.30 55.78 3d2r h ASN 174 Cb 1.02 -0.29 -0.07 0.00 -1.06 0.00 0.00 38.32 37.92 3d2r h ASN 174 CO 0.10 0.87 -0.00 -0.61 -1.06 0.00 0.00 177.43 176.73 3d2r h GLN 175 N 1.30 0.10 -0.20 0.81 5.75 -1.01 0.24 115.11 122.11 3d2r h GLN 175 Ca 0.34 -0.01 -0.05 0.00 -0.15 0.00 0.00 58.65 58.79 3d2r h GLN 175 Cb -0.05 -0.02 -0.01 0.00 1.07 0.00 0.00 27.48 28.47 3d2r h GLN 175 CO -0.06 0.07 -0.05 1.25 -2.65 0.00 0.00 178.83 177.38 3d2r h HIS 176 N 0.10 0.43 -0.28 3.99 2.76 -1.31 -2.11 115.15 118.73 3d2r h HIS 176 Ca 0.20 -0.10 0.04 0.00 -2.20 0.00 0.00 60.37 58.32 3d2r h HIS 176 Cb 0.29 -0.10 -0.04 0.00 1.55 0.00 0.00 27.41 29.10 3d2r h HIS 176 CO -0.27 0.64 0.02 0.82 -1.30 0.00 0.00 177.93 177.84 3d2r h ILE 177 N 0.10 0.83 0.00 6.26 2.04 -1.08 -0.65 117.51 125.01 3d2r h ILE 177 Ca 0.05 -0.04 0.00 0.00 1.00 0.00 0.00 64.86 65.87 3d2r h ILE 177 Cb 0.51 0.70 0.00 0.00 -0.74 0.00 0.00 36.82 37.29 3d2r h ILE 177 CO 0.02 0.02 0.00 -0.07 0.00 0.00 0.00 178.15 178.12 3d2r h LEU 178 N 0.12 0.00 0.07 1.44 3.38 -0.39 -1.01 115.31 118.91 3d2r h LEU 178 Ca 0.13 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.74 3d2r h LEU 178 Cb 0.16 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.87 3d2r h LEU 178 CO -0.20 0.00 -2.09 -0.38 0.09 0.00 0.00 178.44 175.86 3d2r n ILE 179 N -2.71 1.65 0.24 1.22 5.41 -0.81 -4.41 119.36 119.95 3d2r n ILE 179 Ca 0.03 -0.54 0.07 0.00 1.00 0.00 0.00 62.75 63.31 3d2r n ILE 179 Cb 0.39 -1.69 -0.09 0.00 -0.71 0.00 0.00 39.64 37.53 3d2r n ILE 179 CO 0.00 0.00 0.00 0.49 0.00 0.00 0.00 176.55 177.04 3d2r n PHE 180 N -3.59 0.00 -1.45 1.39 3.01 -0.26 -5.01 117.46 111.56 3d2r n PHE 180 Ca -0.38 0.00 -0.33 0.00 1.01 0.00 0.00 57.45 57.75 3d2r n PHE 180 Cb 0.98 -0.19 0.08 0.00 -0.01 0.00 0.00 39.48 40.34 3d2r n PHE 180 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 3d2r s SER 181 N -3.04 4.41 0.18 4.37 1.04 -0.39 -4.96 113.70 115.30 3d2r s SER 181 Ca -0.01 2.15 -0.06 0.00 0.48 0.00 0.00 55.95 58.51 3d2r s SER 181 Cb 0.09 -2.57 0.07 0.00 0.10 0.00 0.00 66.02 63.71 3d2r s SER 181 CO 0.55 -2.11 1.50 0.44 0.98 0.00 0.00 173.24 174.61 3d2r h ASP 182 N -0.45 0.76 0.00 7.02 3.45 -1.95 -3.40 116.42 121.85 3d2r h ASP 182 Ca -0.46 -0.38 -0.03 0.00 0.43 0.00 0.00 57.03 56.58 3d2r h ASP 182 Cb 1.27 -0.22 -0.01 0.00 -0.56 0.00 0.00 39.33 39.82 3d2r h ASP 182 CO 0.50 1.12 -1.43 -1.54 -1.57 0.00 0.00 179.24 176.33 3d2r n SER 183 N -4.00 3.06 -3.96 6.45 3.41 -1.26 -4.80 113.62 112.51 3d2r n SER 183 Ca -0.03 0.00 -0.30 0.00 -0.26 0.00 0.00 58.87 58.28 3d2r n SER 183 Cb 0.58 1.22 -0.14 0.00 -0.26 0.00 0.00 64.21 65.61 3d2r n SER 183 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 3d2r s GLN 184 N -2.49 1.90 0.00 4.33 -0.21 -1.26 -4.97 119.66 116.96 3d2r s GLN 184 Ca -0.03 -2.49 0.19 0.00 0.02 0.00 0.00 55.36 53.04 3d2r s GLN 184 Cb 0.05 -3.31 0.07 0.00 1.00 0.00 0.00 33.01 30.82 3d2r s GLN 184 CO 0.35 -1.08 1.03 0.25 -2.12 0.00 0.00 175.29 173.72 3d2r n THR 185 N 3.31 0.00 -1.40 -0.19 -2.24 -1.26 -4.08 114.28 108.42 3d2r n THR 185 Ca 0.05 -0.40 0.19 0.00 -2.27 0.00 0.00 64.05 61.62 3d2r n THR 185 Cb 0.34 1.31 -0.05 0.00 -2.10 0.00 0.00 70.33 69.83 3d2r n THR 185 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3d2r n GLY 186 N 1.18 -1.94 3.70 3.38 0.00 -1.26 -4.68 105.19 105.57 3d2r n GLY 186 Ca 0.10 -1.16 -0.43 0.00 0.00 0.00 0.00 46.02 44.52 3d2r n GLY 186 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3d2r n ASN 187 N -4.15 3.90 0.30 1.61 4.13 -1.26 -4.87 115.26 114.92 3d2r n ASN 187 Ca 0.01 1.03 0.20 0.00 1.68 0.00 0.00 54.58 57.50 3d2r n ASN 187 Cb 0.64 -1.54 1.05 0.00 -1.54 0.00 0.00 39.78 38.39 3d2r n ASN 187 CO 0.00 0.00 0.00 -0.65 0.28 0.00 0.00 177.26 176.89 3d2r h PRO 188 N 7.48 0.00 -0.01 3.52 0.11 -1.97 -0.72 132.00 140.41 3d2r h PRO 188 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 3d2r h PRO 188 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 3d2r h PRO 188 CO 0.95 0.00 -0.25 -1.13 -0.21 0.00 0.00 178.00 177.35 3d2r n SER 189 N -2.92 1.15 -4.82 -2.05 3.41 -1.26 -4.88 113.62 102.25 3d2r n SER 189 Ca -0.02 -0.99 -0.22 0.00 -0.26 0.00 0.00 58.87 57.38 3d2r n SER 189 Cb 0.09 0.15 -0.04 0.00 -0.26 0.00 0.00 64.21 64.15 3d2r n SER 189 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 3d2r s HIS 190 N -2.46 3.09 -0.47 7.33 3.76 -0.28 -4.66 115.29 121.61 3d2r s HIS 190 Ca 0.25 -0.12 -0.13 0.00 -0.15 0.00 0.00 55.06 54.91 3d2r s HIS 190 Cb 0.19 -1.42 0.09 0.00 1.11 0.00 0.00 32.58 32.56 3d2r s HIS 190 CO 0.51 0.51 0.36 0.42 -0.85 0.00 0.00 174.74 175.68 3d2r s ILE 191 N -2.15 4.74 0.00 0.60 1.01 0.25 -4.86 121.20 120.80 3d2r s ILE 191 Ca 0.33 -1.36 0.00 0.00 0.00 0.00 0.00 60.65 59.62 3d2r s ILE 191 Cb -0.08 -3.93 0.00 0.00 0.01 0.00 0.00 42.46 38.46 3d2r s ILE 191 CO 0.25 -0.63 0.00 0.61 0.00 0.00 0.00 174.94 175.17 3d2r n GLY 192 N 5.07 3.66 1.09 6.18 0.00 -1.26 -1.28 105.19 118.65 3d2r n GLY 192 Ca -0.11 -0.05 0.10 0.00 0.00 0.00 0.00 46.02 45.96 3d2r n GLY 192 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3d2r n SER 193 N 8.43 3.47 -4.72 1.61 3.41 -1.26 -4.64 113.62 119.92 3d2r n SER 193 Ca 0.00 -1.96 -0.37 0.00 -0.26 0.00 0.00 58.87 56.28 3d2r n SER 193 Cb 0.00 -0.32 -0.07 0.00 -0.26 0.00 0.00 64.21 63.56 3d2r n SER 193 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 3d2r s ILE 194 N -1.17 5.28 -0.47 -1.33 1.01 -0.40 -4.16 121.20 119.95 3d2r s ILE 194 Ca 0.38 0.63 -0.18 0.00 0.00 0.00 0.00 60.65 61.48 3d2r s ILE 194 Cb 0.21 -3.67 0.05 0.00 0.01 0.00 0.00 42.46 39.06 3d2r s ILE 194 CO 0.28 0.36 0.54 -0.62 0.00 0.00 0.00 174.94 175.50 3d2r s ASP 195 N 0.58 6.21 0.00 3.58 3.68 -0.04 -0.58 116.67 130.10 3d2r s ASP 195 Ca 0.18 -0.86 0.13 0.00 2.13 0.00 0.00 52.55 54.13 3d2r s ASP 195 Cb -0.13 -2.26 0.64 0.00 -1.45 0.00 0.00 42.92 39.72 3d2r s ASP 195 CO 0.05 -0.75 1.37 -0.81 0.13 0.00 0.00 175.17 175.16 3d2r n PRO 196 N 5.86 0.14 -2.86 4.34 -0.04 -1.26 -1.51 135.00 139.67 3d2r n PRO 196 Ca -0.07 0.19 -0.14 0.00 -0.04 0.00 0.00 63.50 63.44 3d2r n PRO 196 Cb 0.46 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.42 3d2r n PRO 196 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 3d2r n ASN 197 N -1.34 1.56 -4.67 3.54 5.15 -1.25 -3.75 115.26 114.49 3d2r n ASN 197 Ca 0.05 -2.93 -0.42 0.00 -0.60 0.00 0.00 54.58 50.68 3d2r n ASN 197 Cb 0.12 -0.56 -0.03 0.00 -0.53 0.00 0.00 39.78 38.78 3d2r n ASN 197 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3d2r s ASP 199 N 2.44 6.30 0.10 0.00 3.68 -1.26 -2.51 116.67 125.43 3d2r s ASP 199 Ca 0.65 -1.15 -0.23 0.00 2.13 0.00 0.00 52.55 53.94 3d2r s ASP 199 Cb -0.29 -2.57 -0.11 0.00 -1.45 0.00 0.00 42.92 38.51 3d2r s ASP 199 CO 0.24 -1.69 1.71 0.58 0.13 0.00 0.00 175.17 176.14 3d2r h VAL 200 N 6.69 0.83 -0.95 1.11 2.07 -1.87 -1.85 116.25 122.27 3d2r h VAL 200 Ca 0.09 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.69 3d2r h VAL 200 Cb 1.02 0.83 -0.07 0.00 -1.52 0.00 0.00 31.29 31.54 3d2r h VAL 200 CO 1.38 0.00 0.60 0.58 0.02 0.00 0.00 177.57 180.15 3d2r h VAL 201 N -0.12 1.01 -0.72 2.57 2.07 -1.90 -0.66 116.25 118.51 3d2r h VAL 201 Ca 0.03 -0.36 0.03 0.00 0.82 0.00 0.00 66.70 67.22 3d2r h VAL 201 Cb 0.15 -0.12 -0.05 0.00 -1.52 0.00 0.00 31.29 29.76 3d2r h VAL 201 CO -0.07 0.19 0.45 0.00 0.02 0.00 0.00 177.57 178.16 3d2r h ALA 202 N 1.47 0.94 -0.43 1.67 0.00 -1.78 -0.72 119.26 120.40 3d2r h ALA 202 Ca 0.43 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 55.21 3d2r h ALA 202 Cb 0.28 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 3d2r h ALA 202 CO -0.21 0.23 -0.17 0.28 0.00 0.00 0.00 179.25 179.38 3d2r h VAL 203 N 0.88 1.27 -0.28 0.00 2.07 -0.51 -1.68 116.25 118.00 3d2r h VAL 203 Ca 0.29 -1.27 0.04 0.00 0.82 0.00 0.00 66.70 66.58 3d2r h VAL 203 Cb 0.03 1.11 -0.04 0.00 -1.52 0.00 0.00 31.29 30.87 3d2r h VAL 203 CO -0.11 0.43 0.02 0.58 0.02 0.00 0.00 177.57 178.51 3d2r h VAL 204 N 0.73 0.83 -0.17 2.57 2.07 -0.43 -1.23 116.25 120.62 3d2r h VAL 204 Ca 0.11 -0.04 -0.13 0.00 0.82 0.00 0.00 66.70 67.46 3d2r h VAL 204 Cb 0.68 0.71 -0.01 0.00 -1.52 0.00 0.00 31.29 31.14 3d2r h VAL 204 CO 0.05 0.02 -0.46 1.56 0.02 0.00 0.00 177.57 178.77 3d2r h GLN 205 N 0.12 0.43 -0.02 1.57 4.20 -0.96 -0.83 115.11 119.62 3d2r h GLN 205 Ca 0.13 -0.23 -0.00 0.00 0.06 0.00 0.00 58.65 58.60 3d2r h GLN 205 Cb 0.16 0.01 -0.00 0.00 0.30 0.00 0.00 27.48 27.95 3d2r h GLN 205 CO -0.20 0.80 -0.00 0.22 -0.67 0.00 0.00 178.83 178.98 3d2r h ASP 206 N 0.35 0.04 -0.77 1.46 3.58 -1.10 -1.59 116.42 118.39 3d2r h ASP 206 Ca 0.02 -0.36 -0.04 0.00 0.42 0.00 0.00 57.03 57.07 3d2r h ASP 206 Cb 0.94 -0.01 -0.03 0.00 1.72 0.00 0.00 39.33 41.94 3d2r h ASP 206 CO 0.08 0.39 0.33 0.00 -2.88 0.00 0.00 179.24 177.15 3d2r h ALA 207 N 0.65 1.11 -0.14 -0.78 0.00 -1.05 -1.37 119.26 117.68 3d2r h ALA 207 Ca 0.01 -0.18 0.03 0.00 0.00 0.00 0.00 54.91 54.77 3d2r h ALA 207 Cb 0.37 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 3d2r h ALA 207 CO 0.00 0.64 -0.06 0.35 0.00 0.00 0.00 179.25 180.19 3d2r h PHE 208 N 1.12 -0.13 -0.61 0.00 3.57 -1.12 -1.63 116.94 118.14 3d2r h PHE 208 Ca 0.26 0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.85 3d2r h PHE 208 Cb 0.18 0.08 -0.06 0.00 2.79 0.00 0.00 35.95 38.95 3d2r h PHE 208 CO 0.02 -0.09 0.29 0.93 -2.23 0.00 0.00 178.31 177.22 3d2r h GLU 209 N -0.04 0.51 -0.46 1.11 4.39 -0.78 0.11 114.58 119.41 3d2r h GLU 209 Ca 0.08 -0.03 0.05 0.00 0.34 0.00 0.00 59.36 59.80 3d2r h GLU 209 Cb 0.15 -0.11 -0.05 0.00 -0.10 0.00 0.00 28.75 28.64 3d2r h GLU 209 CO -0.17 0.33 0.19 0.00 -1.16 0.00 0.00 179.01 178.21 3d2r h SER 211 N 0.39 0.77 -0.67 0.00 0.87 -0.92 -2.74 113.55 111.24 3d2r h SER 211 Ca 0.21 -0.22 0.11 0.00 -1.23 0.00 0.00 61.79 60.65 3d2r h SER 211 Cb 0.18 -0.20 -0.08 0.00 -0.44 0.00 0.00 62.40 61.86 3d2r h SER 211 CO -0.19 0.79 0.28 -0.09 -0.53 0.00 0.00 176.83 177.09 3d2r h ARG 212 N 0.71 0.45 -0.45 2.24 1.12 -0.42 -0.03 114.38 118.00 3d2r h ARG 212 Ca 0.16 -0.03 -0.03 0.00 -1.11 0.00 0.00 59.98 58.97 3d2r h ARG 212 Cb 0.32 -0.10 -0.02 0.00 -0.01 0.00 0.00 29.97 30.16 3d2r h ARG 212 CO -0.00 0.30 0.15 0.52 -3.11 0.00 0.00 179.97 177.82 3d2r h MET 213 N 0.46 0.69 -0.11 0.20 2.86 -0.98 0.74 114.93 118.79 3d2r h MET 213 Ca 0.35 -0.14 -0.02 0.00 -2.06 0.00 0.00 59.70 57.83 3d2r h MET 213 Cb 0.44 -0.10 -0.00 0.00 0.06 0.00 0.00 31.60 32.00 3d2r h MET 213 CO -0.32 0.66 0.01 -0.07 1.06 0.00 0.00 176.91 178.24 3d2r h LEU 214 N 0.58 0.19 -0.58 1.22 3.38 -1.16 -3.00 115.31 115.93 3d2r h LEU 214 Ca 0.14 -0.28 0.11 0.00 0.09 0.00 0.00 57.88 57.94 3d2r h LEU 214 Cb 0.25 -0.05 -0.08 0.00 0.09 0.00 0.00 40.66 40.87 3d2r h LEU 214 CO -0.01 0.42 0.11 0.00 0.09 0.00 0.00 178.44 179.06 3d2r h ASP 216 N 0.24 0.18 0.67 0.00 3.45 -0.79 -0.65 116.42 119.53 3d2r h ASP 216 Ca 0.30 -0.00 -0.15 0.00 0.43 0.00 0.00 57.03 57.61 3d2r h ASP 216 Cb 0.44 -0.04 -0.02 0.00 -0.56 0.00 0.00 39.33 39.15 3d2r h ASP 216 CO -0.39 0.12 -0.71 1.56 -1.57 0.00 0.00 179.24 178.25 3d2r h GLN 217 N 0.21 0.03 0.00 3.56 4.20 -1.20 0.78 115.11 122.68 3d2r h GLN 217 Ca 0.11 -0.03 -0.18 0.00 0.06 0.00 0.00 58.65 58.61 3d2r h GLN 217 Cb 0.18 0.01 -0.03 0.00 0.30 0.00 0.00 27.48 27.93 3d2r h GLN 217 CO -0.02 0.73 -1.13 1.88 -0.67 0.00 0.00 178.83 179.62 3d2r h TYR 218 N 0.02 0.00 0.00 2.96 -1.99 -0.98 -3.43 116.97 113.56 3d2r h TYR 218 Ca -0.01 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.72 3d2r h TYR 218 Cb 1.26 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.99 3d2r h TYR 218 CO 0.00 0.71 -0.16 0.66 -0.00 0.00 0.00 178.16 179.37 3d2r n TYR 219 N -3.10 0.00 -2.44 4.88 4.01 -0.33 -5.01 117.16 115.17 3d2r n TYR 219 Ca -0.06 0.00 -0.21 0.00 -0.16 0.00 0.00 57.90 57.47 3d2r n TYR 219 Cb 0.86 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.89 3d2r n TYR 219 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 3d2r n LEU 220 N -0.62 -2.00 -3.56 7.72 4.77 0.26 -4.97 117.00 118.60 3d2r n LEU 220 Ca 0.00 -0.04 -0.06 0.00 -0.03 0.00 0.00 56.01 55.88 3d2r n LEU 220 Cb 0.00 -2.96 -0.02 0.00 -2.33 0.00 0.00 43.42 38.12 3d2r n LEU 220 CO 0.00 -0.19 0.80 -0.94 -1.33 0.00 0.00 177.39 175.73 3d2r s SER 221 N -2.09 -0.26 0.10 -1.43 1.04 -1.26 -5.02 113.70 104.78 3d2r s SER 221 Ca 0.02 -0.05 -0.16 0.00 0.48 0.00 0.00 55.95 56.24 3d2r s SER 221 Cb -0.01 0.31 0.03 0.00 0.10 0.00 0.00 66.02 66.46 3d2r s SER 221 CO 0.02 -0.52 0.39 -0.94 0.98 0.00 0.00 173.24 173.18 3d2r s SER 222 N -2.47 -0.23 0.75 7.02 1.04 -1.26 -4.06 113.70 114.49 3d2r s SER 222 Ca 0.07 -0.26 -0.11 0.00 0.48 0.00 0.00 55.95 56.14 3d2r s SER 222 Cb -0.01 0.46 0.04 0.00 0.10 0.00 0.00 66.02 66.61 3d2r s SER 222 CO -0.06 -0.80 1.08 -2.84 0.98 0.00 0.00 173.24 171.60 3d2r s PRO 223 N -3.49 2.44 0.56 4.02 0.02 -1.26 -4.97 135.00 132.32 3d2r s PRO 223 Ca 0.01 1.12 -0.08 0.00 0.02 0.00 0.00 61.00 62.07 3d2r s PRO 223 Cb 0.01 -1.92 -0.03 0.00 0.02 0.00 0.00 34.50 32.58 3d2r s PRO 223 CO -0.10 -1.50 0.91 -1.21 -0.33 0.00 0.00 177.00 174.77 3d2r s GLU 224 N -4.93 3.50 -0.17 5.54 2.02 -1.26 -4.82 118.70 118.59 3d2r s GLU 224 Ca 0.60 0.43 -0.14 0.00 0.02 0.00 0.00 54.97 55.89 3d2r s GLU 224 Cb -0.16 -2.23 -0.05 0.00 0.10 0.00 0.00 34.13 31.79 3d2r s GLU 224 CO 0.56 -0.43 0.31 -1.17 0.02 0.00 0.00 175.26 174.54 3d2r s LEU 225 N -4.97 4.23 -0.27 1.80 2.96 -1.26 -1.06 118.68 120.10 3d2r s LEU 225 Ca 0.51 0.51 -0.01 0.00 -0.22 0.00 0.00 54.13 54.92 3d2r s LEU 225 Cb -0.11 -2.39 0.04 0.00 0.50 0.00 0.00 46.19 44.23 3d2r s LEU 225 CO 0.49 0.07 -0.04 -0.75 -1.32 0.00 0.00 176.35 174.81 3d2r s LYS 226 N 0.58 2.63 -0.06 1.98 2.20 -0.18 -4.96 119.74 121.94 3d2r s LYS 226 Ca 0.17 -1.12 0.03 0.00 -0.36 0.00 0.00 55.97 54.69 3d2r s LYS 226 Cb -0.13 -3.07 -0.02 0.00 -1.51 0.00 0.00 37.83 33.09 3d2r s LYS 226 CO 0.04 -0.51 -0.14 -1.17 -0.36 0.00 0.00 175.35 173.22 3d2r s LEU 227 N 1.28 2.73 0.08 5.43 0.20 -1.26 -0.68 118.68 126.46 3d2r s LEU 227 Ca -0.03 -0.21 0.06 0.00 0.69 0.00 0.00 54.13 54.65 3d2r s LEU 227 Cb -0.18 -1.56 -0.03 0.00 -0.43 0.00 0.00 46.19 43.99 3d2r s LEU 227 CO -0.03 0.33 -0.17 -0.89 -0.29 0.00 0.00 176.35 175.30 3d2r s THR 228 N -0.65 1.38 0.01 3.68 2.01 0.43 -4.97 115.64 117.53 3d2r s THR 228 Ca 0.10 -1.39 -0.03 0.00 0.31 0.00 0.00 61.69 60.67 3d2r s THR 228 Cb -0.11 -1.28 -0.01 0.00 0.01 0.00 0.00 72.50 71.11 3d2r s THR 228 CO 0.01 -0.14 0.04 0.00 -0.69 0.00 0.00 174.62 173.84 3d2r s GLN 229 N -1.78 0.33 -0.13 4.92 -2.07 -1.26 -1.38 119.66 118.29 3d2r s GLN 229 Ca 0.02 -0.42 -0.03 0.00 -1.82 0.00 0.00 55.36 53.11 3d2r s GLN 229 Cb -0.10 0.13 0.05 0.00 -1.09 0.00 0.00 33.01 32.00 3d2r s GLN 229 CO 0.03 -0.07 0.05 0.08 -1.32 0.00 0.00 175.29 174.06 3d2r s VAL 230 N -1.19 0.20 -0.56 3.63 1.01 0.16 -4.95 120.40 118.69 3d2r s VAL 230 Ca -0.13 -0.10 -0.16 0.00 0.00 0.00 0.00 61.98 61.58 3d2r s VAL 230 Cb -0.08 -0.62 0.13 0.00 0.00 0.00 0.00 36.38 35.81 3d2r s VAL 230 CO 0.00 -0.05 0.54 0.21 0.00 0.00 0.00 175.10 175.80 3d2r s ASN 231 N 2.02 6.20 0.18 3.32 3.84 -1.26 -0.87 114.94 128.38 3d2r s ASN 231 Ca 0.02 -1.75 0.04 0.00 0.21 0.00 0.00 52.86 51.39 3d2r s ASN 231 Cb -0.15 -2.23 0.03 0.00 -0.55 0.00 0.00 41.25 38.36 3d2r s ASN 231 CO -0.07 -0.90 1.41 1.23 -2.79 0.00 0.00 177.10 175.98 3d2r h GLY 232 N 9.05 0.15 0.74 1.21 0.00 -0.94 -2.87 103.07 110.42 3d2r h GLY 232 Ca -0.29 -0.27 -0.02 0.00 0.00 0.00 0.00 47.33 46.76 3d2r h GLY 232 CO 1.04 0.24 -0.17 1.70 0.00 0.00 0.00 176.54 179.35 3d2r h LYS 233 N 0.08 -0.45 -3.72 4.80 3.64 -1.70 -3.39 116.57 115.82 3d2r h LYS 233 Ca -0.03 0.03 -0.57 0.00 -1.27 0.00 0.00 60.65 58.81 3d2r h LYS 233 Cb 1.46 0.10 -0.40 0.00 -0.41 0.00 0.00 32.23 32.99 3d2r h LYS 233 CO 0.12 -0.16 -0.76 -0.06 -2.27 0.00 0.00 179.45 176.32 3d2r s PHE 234 N -4.97 1.73 0.49 1.91 0.40 -1.25 -5.06 117.98 111.22 3d2r s PHE 234 Ca -0.15 -1.57 -0.21 0.00 -0.60 0.00 0.00 56.93 54.40 3d2r s PHE 234 Cb 0.03 -1.57 -0.10 0.00 0.51 0.00 0.00 43.02 41.88 3d2r s PHE 234 CO 0.56 -0.80 0.64 -2.30 0.70 0.00 0.00 175.22 174.02 3d2r n PRO 235 N 4.85 0.70 -0.47 0.24 -0.02 -1.08 -2.14 135.00 137.07 3d2r n PRO 235 Ca -0.05 0.26 0.00 0.00 -2.02 0.00 0.00 63.50 61.69 3d2r n PRO 235 Cb 0.44 -1.71 0.00 0.00 -0.02 0.00 0.00 33.50 32.21 3d2r n PRO 235 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 3d2r n ASP 236 N 0.74 0.00 -4.82 2.55 8.00 -1.26 -4.97 116.55 116.79 3d2r n ASP 236 Ca 0.11 0.00 -0.35 0.00 0.71 0.00 0.00 54.79 55.26 3d2r n ASP 236 Cb 0.43 -1.57 -0.06 0.00 -0.02 0.00 0.00 41.12 39.90 3d2r n ASP 236 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 3d2r s GLN 237 N -0.51 4.20 0.46 -1.24 -1.52 -0.91 -5.06 119.66 115.08 3d2r s GLN 237 Ca 0.00 0.82 -0.22 0.00 -1.95 0.00 0.00 55.36 54.00 3d2r s GLN 237 Cb 0.00 -2.81 -0.11 0.00 -0.22 0.00 0.00 33.01 29.88 3d2r s GLN 237 CO 0.00 0.36 0.74 -2.30 -0.25 0.00 0.00 175.29 173.84 3d2r n PRO 238 N 0.55 0.85 -3.42 2.91 -0.02 -1.26 -4.70 135.00 129.91 3d2r n PRO 238 Ca -0.01 0.31 -0.42 0.00 -2.02 0.00 0.00 63.50 61.36 3d2r n PRO 238 Cb 0.51 -1.77 -0.10 0.00 -0.02 0.00 0.00 33.50 32.13 3d2r n PRO 238 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3d2r s ILE 239 N -1.44 5.20 0.01 4.25 1.01 -1.26 -5.04 121.20 123.92 3d2r s ILE 239 Ca 0.65 -0.31 0.03 0.00 0.00 0.00 0.00 60.65 61.02 3d2r s ILE 239 Cb -0.55 -3.89 -0.01 0.00 0.01 0.00 0.00 42.46 38.02 3d2r s ILE 239 CO 0.56 -0.23 -0.10 -1.00 0.00 0.00 0.00 174.94 174.18 3d2r s HIS 240 N 1.90 0.85 0.20 3.97 3.76 -1.26 -2.86 115.29 121.85 3d2r s HIS 240 Ca 0.09 -0.22 0.01 0.00 -0.15 0.00 0.00 55.06 54.78 3d2r s HIS 240 Cb -0.18 -0.53 -0.05 0.00 1.11 0.00 0.00 32.58 32.93 3d2r s HIS 240 CO 0.11 -0.01 0.06 0.96 -0.85 0.00 0.00 174.74 175.02 3d2r s ILE 241 N -0.45 0.44 -0.15 0.60 -4.36 -1.04 -4.86 121.20 111.38 3d2r s ILE 241 Ca 0.02 -1.98 -0.29 0.00 -0.26 0.00 0.00 60.65 58.13 3d2r s ILE 241 Cb -0.05 -2.35 -0.03 0.00 1.25 0.00 0.00 42.46 41.28 3d2r s ILE 241 CO 0.00 -0.23 1.46 -0.69 0.24 0.00 0.00 174.94 175.73 3d2r s VAL 242 N -3.83 3.92 0.19 8.37 1.01 -1.25 -0.15 120.40 128.67 3d2r s VAL 242 Ca 0.31 1.10 -0.19 0.00 0.00 0.00 0.00 61.98 63.20 3d2r s VAL 242 Cb 0.07 -3.77 0.04 0.00 0.00 0.00 0.00 36.38 32.72 3d2r s VAL 242 CO 0.08 -0.16 0.56 -0.47 0.00 0.00 0.00 175.10 175.11 3d2r s TYR 243 N 4.05 -0.26 -0.52 5.22 5.04 -0.57 -4.84 117.35 125.46 3d2r s TYR 243 Ca 0.64 -0.06 -0.20 0.00 -2.44 0.00 0.00 57.07 55.02 3d2r s TYR 243 Cb -0.26 0.47 0.06 0.00 0.35 0.00 0.00 41.96 42.58 3d2r s TYR 243 CO 0.23 -0.92 0.69 0.08 -1.34 0.00 0.00 175.55 174.29 3d2r s VAL 244 N -3.84 4.78 0.41 3.14 1.01 -1.26 -0.86 120.40 123.79 3d2r s VAL 244 Ca 0.06 -0.41 0.20 0.00 0.00 0.00 0.00 61.98 61.84 3d2r s VAL 244 Cb -0.01 -4.36 0.22 0.00 0.00 0.00 0.00 36.38 32.23 3d2r s VAL 244 CO -0.05 -0.89 2.00 1.55 0.00 0.00 0.00 175.10 177.70 3d2r h PRO 245 N 9.07 0.00 -0.51 2.72 0.13 -1.93 -1.94 132.00 139.54 3d2r h PRO 245 Ca -0.27 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.76 3d2r h PRO 245 Cb 1.09 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.20 3d2r h PRO 245 CO 1.00 0.19 -0.05 0.66 -0.23 0.00 0.00 178.00 179.56 3d2r h SER 246 N 0.00 0.89 -0.28 1.44 4.64 -1.93 0.21 113.55 118.52 3d2r h SER 246 Ca -0.00 -0.26 -0.03 0.00 -0.47 0.00 0.00 61.79 61.03 3d2r h SER 246 Cb 0.39 -0.24 -0.01 0.00 -0.31 0.00 0.00 62.40 62.23 3d2r h SER 246 CO 0.02 0.98 0.04 0.45 -0.87 0.00 0.00 176.83 177.46 3d2r h HIS 247 N 0.83 0.49 -0.44 4.77 3.86 -1.77 -1.62 115.15 121.26 3d2r h HIS 247 Ca 0.14 -0.07 0.00 0.00 -1.16 0.00 0.00 60.37 59.29 3d2r h HIS 247 Cb 0.57 -0.13 -0.02 0.00 1.06 0.00 0.00 27.41 28.88 3d2r h HIS 247 CO 0.03 0.57 0.29 1.25 0.86 0.00 0.00 177.93 180.94 3d2r h LEU 248 N 0.27 0.51 -0.85 2.43 5.85 -1.28 -2.17 115.31 120.08 3d2r h LEU 248 Ca 0.08 -0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.80 3d2r h LEU 248 Cb 0.34 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 41.20 3d2r h LEU 248 CO 0.01 0.37 0.55 -0.74 -0.34 0.00 0.00 178.44 178.28 3d2r h HIS 249 N 0.60 1.08 -0.48 1.25 2.76 -0.52 -1.40 115.15 118.44 3d2r h HIS 249 Ca 0.16 0.02 -0.05 0.00 -2.20 0.00 0.00 60.37 58.30 3d2r h HIS 249 Cb -0.07 -0.36 -0.02 0.00 1.55 0.00 0.00 27.41 28.51 3d2r h HIS 249 CO -0.05 0.69 0.09 1.25 -1.30 0.00 0.00 177.93 178.62 3d2r h HIS 250 N 1.15 0.83 -0.26 5.26 -0.00 -0.92 0.83 115.15 122.04 3d2r h HIS 250 Ca 0.31 -0.11 -0.00 0.00 -0.00 0.00 0.00 60.37 60.57 3d2r h HIS 250 Cb -0.11 -0.23 -0.01 0.00 -0.00 0.00 0.00 27.41 27.06 3d2r h HIS 250 CO -0.01 0.76 0.15 0.52 -0.00 0.00 0.00 177.93 179.36 3d2r h MET 251 N 0.66 0.35 -0.35 5.26 2.07 -1.19 -1.26 114.93 120.47 3d2r h MET 251 Ca 0.15 -0.03 -0.04 0.00 -2.07 0.00 0.00 59.70 57.71 3d2r h MET 251 Cb 0.37 -0.07 -0.01 0.00 -1.87 0.00 0.00 31.60 30.01 3d2r h MET 251 CO 0.01 0.28 0.06 -0.07 1.07 0.00 0.00 176.91 178.26 3d2r h LEU 252 N 0.32 0.56 -0.36 1.22 3.38 -1.05 -1.59 115.31 117.78 3d2r h LEU 252 Ca 0.09 -0.25 0.02 0.00 0.09 0.00 0.00 57.88 57.83 3d2r h LEU 252 Cb 0.02 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.59 3d2r h LEU 252 CO -0.02 0.67 0.20 0.15 0.09 0.00 0.00 178.44 179.53 3d2r h PHE 253 N 0.42 0.37 -0.83 1.13 3.57 -0.75 0.15 116.94 121.00 3d2r h PHE 253 Ca 0.11 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.59 3d2r h PHE 253 Cb 0.34 -0.11 -0.04 0.00 2.79 0.00 0.00 35.95 38.93 3d2r h PHE 253 CO 0.02 0.21 0.39 0.93 -2.23 0.00 0.00 178.31 177.63 3d2r h GLU 254 N 0.41 1.21 -0.03 1.11 4.39 -1.11 -0.78 114.58 119.77 3d2r h GLU 254 Ca 0.15 -0.19 -0.17 0.00 0.34 0.00 0.00 59.36 59.50 3d2r h GLU 254 Cb 0.03 -0.21 -0.01 0.00 -0.10 0.00 0.00 28.75 28.46 3d2r h GLU 254 CO -0.09 0.94 -0.72 -0.07 -1.16 0.00 0.00 179.01 177.91 3d2r h LEU 255 N 1.19 0.23 -0.48 1.33 3.38 -0.97 -2.74 115.31 117.25 3d2r h LEU 255 Ca 0.28 -0.15 -0.14 0.00 0.09 0.00 0.00 57.88 57.96 3d2r h LEU 255 Cb 0.14 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 3d2r h LEU 255 CO -0.03 0.87 -0.27 -0.26 0.09 0.00 0.00 178.44 178.84 3d2r h PHE 256 N 0.13 1.11 -0.83 1.13 0.05 -0.48 -1.07 116.94 116.97 3d2r h PHE 256 Ca -0.02 -0.29 -0.03 0.00 3.82 0.00 0.00 57.97 61.45 3d2r h PHE 256 Cb 1.28 -0.25 -0.04 0.00 2.00 0.00 0.00 35.95 38.94 3d2r h PHE 256 CO 0.02 1.11 0.41 0.87 -0.18 0.00 0.00 178.31 180.54 3d2r h LYS 257 N 0.81 1.18 -0.14 1.51 1.57 -1.08 -1.17 116.57 119.25 3d2r h LYS 257 Ca 0.09 -0.16 -0.01 0.00 -1.87 0.00 0.00 60.65 58.70 3d2r h LYS 257 Cb 0.85 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.94 3d2r h LYS 257 CO 0.08 0.90 0.06 -0.91 -0.57 0.00 0.00 179.45 179.00 3d2r h ASN 258 N 1.17 0.19 -0.31 0.86 2.35 -1.36 -1.19 115.58 117.29 3d2r h ASN 258 Ca 0.29 -0.15 -0.07 0.00 -0.55 0.00 0.00 56.30 55.82 3d2r h ASN 258 Cb 0.09 -0.05 -0.02 0.00 0.05 0.00 0.00 38.32 38.40 3d2r h ASN 258 CO -0.04 0.28 -0.03 0.00 -1.65 0.00 0.00 177.43 175.99 3d2r h ALA 259 N 0.91 1.18 -0.05 -0.83 0.00 -1.08 -2.25 119.26 117.15 3d2r h ALA 259 Ca 0.05 -0.26 -0.13 0.00 0.00 0.00 0.00 54.91 54.57 3d2r h ALA 259 Cb 0.15 -0.17 0.01 0.00 0.00 0.00 0.00 17.79 17.78 3d2r h ALA 259 CO -0.00 0.53 -0.47 0.52 0.00 0.00 0.00 179.25 179.83 3d2r h MET 260 N 0.63 0.40 -0.50 0.00 2.86 -1.20 0.54 114.93 117.66 3d2r h MET 260 Ca 0.12 -0.37 0.04 0.00 -2.06 0.00 0.00 59.70 57.44 3d2r h MET 260 Cb 0.44 0.09 -0.04 0.00 0.06 0.00 0.00 31.60 32.15 3d2r h MET 260 CO 0.02 1.02 0.26 -0.09 1.06 0.00 0.00 176.91 179.18 3d2r h ARG 261 N -0.09 0.49 -0.49 1.72 2.43 -1.22 -1.25 114.38 115.97 3d2r h ARG 261 Ca -0.05 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.07 3d2r h ARG 261 Cb 1.15 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 30.57 3d2r h ARG 261 CO 0.10 0.32 0.21 0.00 -1.51 0.00 0.00 179.97 179.09 3d2r h ALA 262 N 1.27 0.63 0.24 2.80 0.00 -1.36 -1.49 119.26 121.35 3d2r h ALA 262 Ca 0.22 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 3d2r h ALA 262 Cb 0.12 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.72 3d2r h ALA 262 CO -0.15 0.22 -0.11 1.15 0.00 0.00 0.00 179.25 180.35 3d2r h THR 263 N 0.64 0.79 -0.51 0.00 2.02 -0.68 -1.52 112.91 113.66 3d2r h THR 263 Ca 0.16 -0.12 -0.00 0.00 0.77 0.00 0.00 66.41 67.22 3d2r h THR 263 Cb 0.16 0.86 -0.02 0.00 -1.74 0.00 0.00 68.15 67.40 3d2r h THR 263 CO -0.02 0.03 0.32 0.58 0.37 0.00 0.00 175.52 176.80 3d2r h VAL 264 N -0.38 1.15 -0.10 3.16 2.07 -1.17 -0.78 116.25 120.19 3d2r h VAL 264 Ca -0.03 -0.32 -0.17 0.00 0.82 0.00 0.00 66.70 67.00 3d2r h VAL 264 Cb 0.29 0.44 -0.01 0.00 -1.52 0.00 0.00 31.29 30.50 3d2r h VAL 264 CO 0.05 0.15 -0.65 -0.33 0.02 0.00 0.00 177.57 176.82 3d2r h GLU 265 N 0.68 0.40 -0.36 1.57 5.08 -1.21 -2.08 114.58 118.66 3d2r h GLU 265 Ca 0.18 -0.29 -0.12 0.00 -1.00 0.00 0.00 59.36 58.13 3d2r h GLU 265 Cb -0.03 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.26 3d2r h GLU 265 CO -0.04 0.91 -0.26 1.25 -1.00 0.00 0.00 179.01 179.87 3d2r h HIS 266 N 0.29 0.85 -0.63 4.33 2.76 -1.20 -3.24 115.15 118.31 3d2r h HIS 266 Ca -0.01 -0.20 0.00 0.00 -2.20 0.00 0.00 60.37 57.95 3d2r h HIS 266 Cb 1.19 -0.20 0.00 0.00 1.55 0.00 0.00 27.41 29.95 3d2r h HIS 266 CO 0.04 0.92 0.00 1.04 -1.30 0.00 0.00 177.93 178.63 3d2r n GLN 267 N -4.10 3.83 0.18 5.26 6.02 -0.30 -4.79 117.38 123.49 3d2r n GLN 267 Ca -0.00 -2.91 0.18 0.00 -0.01 0.00 0.00 57.00 54.26 3d2r n GLN 267 Cb 0.45 -1.92 0.81 0.00 1.02 0.00 0.00 30.24 30.60 3d2r n GLN 267 CO 0.00 0.00 0.00 1.05 -1.01 0.00 0.00 177.06 177.10 3d2r h GLU 268 N 4.00 0.00 -0.51 -1.09 4.11 -1.41 -1.54 114.58 118.14 3d2r h GLU 268 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 3d2r h GLU 268 Cb 1.50 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.75 3d2r h GLU 268 CO 0.25 0.00 0.00 -1.71 0.07 0.00 0.00 179.01 177.62 3d2r n ASN 269 N -3.71 4.51 -4.88 3.06 5.15 -1.26 -4.97 115.26 113.17 3d2r n ASN 269 Ca 0.03 -2.60 -0.29 0.00 -0.60 0.00 0.00 54.58 51.11 3d2r n ASN 269 Cb 0.41 -0.55 -0.04 0.00 -0.53 0.00 0.00 39.78 39.07 3d2r n ASN 269 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 3d2r s GLN 270 N -2.12 3.27 0.59 1.20 -0.21 -0.58 -5.01 119.66 116.79 3d2r s GLN 270 Ca 0.46 -0.57 0.28 0.00 0.02 0.00 0.00 55.36 55.55 3d2r s GLN 270 Cb 0.32 -2.92 1.65 0.00 1.00 0.00 0.00 33.01 33.06 3d2r s GLN 270 CO 0.18 0.57 2.11 -1.35 -2.12 0.00 0.00 175.29 174.68 3d2r h PRO 271 N 2.82 0.00 -3.16 2.91 0.11 -1.93 -3.44 132.00 129.31 3d2r h PRO 271 Ca -0.46 0.00 0.03 0.00 0.11 0.00 0.00 66.00 65.67 3d2r h PRO 271 Cb 1.17 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.23 3d2r h PRO 271 CO 0.71 0.00 0.16 -1.54 -0.21 0.00 0.00 178.00 177.11 3d2r s SER 272 N -5.86 -0.17 -0.18 -2.05 1.04 -1.26 -5.15 113.70 100.06 3d2r s SER 272 Ca -0.05 -0.75 -0.19 0.00 0.48 0.00 0.00 55.95 55.44 3d2r s SER 272 Cb 0.15 0.71 -0.03 0.00 0.10 0.00 0.00 66.02 66.95 3d2r s SER 272 CO 0.56 -1.34 0.55 -0.76 0.98 0.00 0.00 173.24 173.22 3d2r s LEU 273 N -2.96 4.17 0.21 2.42 1.43 -1.26 -5.05 118.68 117.63 3d2r s LEU 273 Ca 0.14 0.75 -0.32 0.00 -1.03 0.00 0.00 54.13 53.67 3d2r s LEU 273 Cb -0.05 -2.76 -0.13 0.00 0.03 0.00 0.00 46.19 43.29 3d2r s LEU 273 CO 0.08 -0.18 1.65 0.35 0.23 0.00 0.00 176.35 178.49 3d2r n THR 274 N 4.44 0.16 -0.76 5.49 -2.24 -1.26 -4.74 114.28 115.37 3d2r n THR 274 Ca -0.04 -0.04 -0.30 0.00 -2.27 0.00 0.00 64.05 61.40 3d2r n THR 274 Cb 0.50 -1.83 0.17 0.00 -2.10 0.00 0.00 70.33 67.08 3d2r n THR 274 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 3d2r s PRO 275 N 0.83 0.75 -0.11 -0.78 0.04 -1.26 -4.68 135.00 129.79 3d2r s PRO 275 Ca 0.75 1.31 -0.22 0.00 0.04 0.00 0.00 61.00 62.87 3d2r s PRO 275 Cb -0.56 -1.71 -0.03 0.00 0.04 0.00 0.00 34.50 32.23 3d2r s PRO 275 CO 0.37 -2.73 0.67 0.42 0.04 0.00 0.00 177.00 175.76 3d2r s ILE 276 N -2.66 5.04 -0.19 0.56 1.01 -0.23 -4.64 121.20 120.10 3d2r s ILE 276 Ca 0.66 1.35 -0.11 0.00 0.00 0.00 0.00 60.65 62.55 3d2r s ILE 276 Cb -0.22 -4.00 -0.05 0.00 0.01 0.00 0.00 42.46 38.20 3d2r s ILE 276 CO 0.59 0.21 0.18 -1.61 0.00 0.00 0.00 174.94 174.31 3d2r s GLU 277 N 1.11 4.19 -0.07 2.79 2.02 -0.05 -1.01 118.70 127.68 3d2r s GLU 277 Ca 0.34 -0.12 0.04 0.00 0.02 0.00 0.00 54.97 55.25 3d2r s GLU 277 Cb -0.17 -3.42 0.00 0.00 0.10 0.00 0.00 34.13 30.65 3d2r s GLU 277 CO 0.15 0.29 -0.19 0.08 0.02 0.00 0.00 175.26 175.61 3d2r s VAL 278 N 0.36 1.62 -0.08 2.63 1.01 0.14 -0.46 120.40 125.62 3d2r s VAL 278 Ca 0.11 -0.79 0.03 0.00 0.00 0.00 0.00 61.98 61.33 3d2r s VAL 278 Cb -0.12 -1.41 -0.01 0.00 0.00 0.00 0.00 36.38 34.84 3d2r s VAL 278 CO -0.00 0.46 -0.19 -0.51 0.00 0.00 0.00 175.10 174.86 3d2r s ILE 279 N 0.31 2.61 -0.18 2.22 2.07 -0.40 -0.43 121.20 127.39 3d2r s ILE 279 Ca -0.12 -0.85 -0.01 0.00 -1.41 0.00 0.00 60.65 58.25 3d2r s ILE 279 Cb -0.15 -2.02 -0.00 0.00 0.13 0.00 0.00 42.46 40.41 3d2r s ILE 279 CO 0.05 0.56 -0.12 -0.69 -1.91 0.00 0.00 174.94 172.83 3d2r s VAL 280 N -0.07 2.89 -0.08 4.00 1.01 -0.48 -0.86 120.40 126.81 3d2r s VAL 280 Ca -0.04 -0.68 0.02 0.00 0.00 0.00 0.00 61.98 61.29 3d2r s VAL 280 Cb -0.14 -2.26 0.01 0.00 0.00 0.00 0.00 36.38 33.99 3d2r s VAL 280 CO 0.04 0.49 -0.16 -0.69 0.00 0.00 0.00 175.10 174.78 3d2r s VAL 281 N 1.05 1.43 -0.26 2.92 1.01 0.23 -0.67 120.40 126.12 3d2r s VAL 281 Ca -0.00 -0.64 -0.08 0.00 0.00 0.00 0.00 61.98 61.26 3d2r s VAL 281 Cb -0.15 -1.28 -0.03 0.00 0.00 0.00 0.00 36.38 34.92 3d2r s VAL 281 CO -0.03 0.42 0.09 -0.22 0.00 0.00 0.00 175.10 175.37 3d2r s LEU 282 N 0.68 3.55 0.00 3.92 2.96 -0.05 -1.27 118.68 128.47 3d2r s LEU 282 Ca -0.14 -0.19 0.00 0.00 -0.22 0.00 0.00 54.13 53.58 3d2r s LEU 282 Cb -0.16 -1.95 0.00 0.00 0.50 0.00 0.00 46.19 44.57 3d2r s LEU 282 CO 0.04 -0.04 0.00 0.61 -1.32 0.00 0.00 176.35 175.63 3d2r n GLY 283 N 4.95 4.06 0.15 7.98 0.00 0.84 -0.18 105.19 122.99 3d2r n GLY 283 Ca -0.16 -2.18 -0.11 0.00 0.00 0.00 0.00 46.02 43.58 3d2r n GLY 283 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3d2r h LYS 284 N 0.00 0.41 0.00 1.61 1.57 -1.97 -3.31 116.57 114.87 3d2r h LYS 284 Ca 0.00 -0.11 0.00 0.00 -1.87 0.00 0.00 60.65 58.67 3d2r h LYS 284 Cb 0.00 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.26 3d2r h LYS 284 CO 0.00 0.53 -1.84 0.39 -0.57 0.00 0.00 179.45 177.96 3d2r n GLU 285 N -4.70 0.57 -4.11 3.15 1.02 -1.26 -4.81 120.64 110.50 3d2r n GLU 285 Ca -0.03 -0.17 -0.15 0.00 -0.02 0.00 0.00 57.16 56.79 3d2r n GLU 285 Cb 0.19 -1.44 -0.12 0.00 -0.02 0.00 0.00 31.44 30.06 3d2r n GLU 285 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3d2r s ASP 286 N -4.12 1.14 -0.16 1.62 1.01 -1.25 -1.07 116.67 113.84 3d2r s ASP 286 Ca -0.07 -0.56 -0.03 0.00 0.71 0.00 0.00 52.55 52.60 3d2r s ASP 286 Cb 0.12 0.00 -0.02 0.00 1.01 0.00 0.00 42.92 44.03 3d2r s ASP 286 CO 0.77 -0.15 -0.05 -0.22 0.21 0.00 0.00 175.17 175.73 3d2r s LEU 287 N -1.59 3.15 -0.02 1.23 1.98 -0.19 -0.11 118.68 123.13 3d2r s LEU 287 Ca -0.07 -0.18 0.04 0.00 -2.89 0.00 0.00 54.13 51.04 3d2r s LEU 287 Cb -0.10 -1.76 -0.01 0.00 0.66 0.00 0.00 46.19 44.99 3d2r s LEU 287 CO 0.01 0.15 -0.14 -0.89 -1.89 0.00 0.00 176.35 173.59 3d2r s THR 288 N 0.44 1.17 -0.14 3.68 2.01 -0.40 -0.35 115.64 122.06 3d2r s THR 288 Ca -0.05 -0.61 0.00 0.00 0.31 0.00 0.00 61.69 61.34 3d2r s THR 288 Cb -0.14 -1.00 0.03 0.00 0.01 0.00 0.00 72.50 71.40 3d2r s THR 288 CO 0.03 0.34 -0.11 -0.63 -0.69 0.00 0.00 174.62 173.56 3d2r s ILE 289 N -0.16 1.34 -0.18 1.82 1.01 -0.63 -0.60 121.20 123.80 3d2r s ILE 289 Ca 0.02 -0.54 -0.05 0.00 0.00 0.00 0.00 60.65 60.08 3d2r s ILE 289 Cb -0.08 -1.32 -0.03 0.00 0.01 0.00 0.00 42.46 41.04 3d2r s ILE 289 CO 0.00 0.37 -0.00 -0.75 0.00 0.00 0.00 174.94 174.56 3d2r s LYS 290 N 1.57 3.69 -0.24 2.79 2.20 -0.04 -1.22 119.74 128.50 3d2r s LYS 290 Ca 0.04 -0.49 -0.03 0.00 -0.36 0.00 0.00 55.97 55.13 3d2r s LYS 290 Cb -0.13 -3.04 0.01 0.00 -1.51 0.00 0.00 37.83 33.16 3d2r s LYS 290 CO -0.09 0.13 -0.04 0.42 -0.36 0.00 0.00 175.35 175.41 3d2r s ILE 291 N 0.68 3.18 -0.12 5.43 1.01 0.88 -1.28 121.20 130.98 3d2r s ILE 291 Ca -0.00 -0.77 0.02 0.00 0.00 0.00 0.00 60.65 59.89 3d2r s ILE 291 Cb -0.14 -2.55 -0.00 0.00 0.01 0.00 0.00 42.46 39.78 3d2r s ILE 291 CO 0.02 0.28 -0.18 -0.44 0.00 0.00 0.00 174.94 174.62 3d2r s SER 292 N 1.41 3.52 0.30 3.58 0.01 0.39 -0.12 113.70 122.78 3d2r s SER 292 Ca 0.03 -0.46 0.06 0.00 1.31 0.00 0.00 55.95 56.88 3d2r s SER 292 Cb -0.16 -1.51 -0.06 0.00 0.21 0.00 0.00 66.02 64.50 3d2r s SER 292 CO -0.03 0.14 -0.02 1.51 0.41 0.00 0.00 173.24 175.24 3d2r s ASP 293 N 0.46 2.71 -0.58 2.44 3.84 -0.59 -0.87 116.67 124.07 3d2r s ASP 293 Ca -0.13 -1.25 0.04 0.00 -0.00 0.00 0.00 52.55 51.22 3d2r s ASP 293 Cb -0.17 -0.16 0.36 0.00 -1.38 0.00 0.00 42.92 41.58 3d2r s ASP 293 CO 0.05 -0.42 1.12 0.54 -0.00 0.00 0.00 175.17 176.46 3d2r n ARG 294 N -0.63 3.46 -0.76 2.11 1.74 -1.26 -2.55 116.66 118.77 3d2r n ARG 294 Ca -0.05 -4.68 0.07 0.00 -0.77 0.00 0.00 57.85 52.42 3d2r n ARG 294 Cb 0.64 -2.26 0.36 0.00 -1.02 0.00 0.00 32.46 30.18 3d2r n ARG 294 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3d2r n GLY 295 N -0.32 2.76 2.46 -0.13 0.00 -1.21 -4.71 105.19 104.04 3d2r n GLY 295 Ca 0.36 -0.82 0.00 0.00 0.00 0.00 0.00 46.02 45.56 3d2r n GLY 295 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d2r n GLY 296 N 0.66 2.46 7.00 -0.02 0.00 -0.52 -4.54 105.19 110.23 3d2r n GLY 296 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.27 3d2r n GLY 296 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d2r n GLY 297 N -2.00 -1.66 3.06 -0.02 0.00 -1.26 -0.06 105.19 103.25 3d2r n GLY 297 Ca 0.00 -1.31 -0.13 0.00 0.00 0.00 0.00 46.02 44.58 3d2r n GLY 297 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3d2r s VAL 298 N 0.00 -0.02 0.32 1.61 1.01 -1.26 -4.73 120.40 117.32 3d2r s VAL 298 Ca 0.00 0.09 -0.29 0.00 0.00 0.00 0.00 61.98 61.78 3d2r s VAL 298 Cb 0.00 -0.33 -0.12 0.00 0.00 0.00 0.00 36.38 35.93 3d2r s VAL 298 CO 0.00 0.04 1.44 -2.65 0.00 0.00 0.00 175.10 173.93 3d2r n PRO 299 N 3.70 2.38 -0.16 2.72 -0.02 -1.26 -4.16 135.00 138.21 3d2r n PRO 299 Ca -0.20 0.84 0.13 0.00 -2.02 0.00 0.00 63.50 62.25 3d2r n PRO 299 Cb 0.55 -2.53 0.47 0.00 -0.02 0.00 0.00 33.50 31.98 3d2r n PRO 299 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 3d2r h LEU 300 N 3.59 0.44 -1.41 2.45 5.85 -2.00 -1.22 115.31 123.01 3d2r h LEU 300 Ca -0.47 0.02 0.19 0.00 0.84 0.00 0.00 57.88 58.46 3d2r h LEU 300 Cb 1.26 -0.07 -0.07 0.00 0.37 0.00 0.00 40.66 42.14 3d2r h LEU 300 CO 0.70 0.24 0.59 -0.09 -0.34 0.00 0.00 178.44 179.55 3d2r h ARG 301 N 0.48 0.49 -0.04 1.25 2.43 -2.04 -1.90 114.38 115.05 3d2r h ARG 301 Ca 0.35 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.49 3d2r h ARG 301 Cb 0.70 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 30.14 3d2r h ARG 301 CO -0.12 0.32 0.00 0.44 -1.51 0.00 0.00 179.97 179.11 3d2r n ILE 302 N -4.55 0.02 -0.22 1.20 -5.35 -0.47 -4.50 119.36 105.49 3d2r n ILE 302 Ca 0.19 -0.51 -0.01 0.00 -0.27 0.00 0.00 62.75 62.16 3d2r n ILE 302 Cb 0.64 1.41 0.11 0.00 -1.74 0.00 0.00 39.64 40.05 3d2r n ILE 302 CO 0.00 0.00 0.00 0.40 -1.76 0.00 0.00 176.55 175.19 3d2r h ILE 303 N 4.01 0.89 -0.62 7.28 1.08 -1.20 -2.09 117.51 126.84 3d2r h ILE 303 Ca 0.00 -0.20 -0.09 0.00 -0.39 0.00 0.00 64.86 64.18 3d2r h ILE 303 Cb 0.85 0.25 -0.02 0.00 -3.07 0.00 0.00 36.82 34.83 3d2r h ILE 303 CO 0.00 0.11 0.05 0.44 -0.69 0.00 0.00 178.15 178.06 3d2r h ASP 304 N 0.58 1.03 -0.97 1.72 3.32 -1.79 -2.13 116.42 118.19 3d2r h ASP 304 Ca 0.31 -0.28 0.19 0.00 0.02 0.00 0.00 57.03 57.27 3d2r h ASP 304 Cb 0.28 -0.28 -0.09 0.00 0.22 0.00 0.00 39.33 39.47 3d2r h ASP 304 CO -0.23 1.06 0.61 -0.09 -1.72 0.00 0.00 179.24 178.87 3d2r h ARG 305 N 0.97 0.62 -0.73 3.56 2.43 -1.68 -2.07 114.38 117.48 3d2r h ARG 305 Ca 0.18 -0.04 0.19 0.00 -0.81 0.00 0.00 59.98 59.51 3d2r h ARG 305 Cb 0.50 -0.14 -0.04 0.00 -0.42 0.00 0.00 29.97 29.87 3d2r h ARG 305 CO 0.02 0.41 0.51 -0.07 -1.51 0.00 0.00 179.97 179.34 3d2r h LEU 306 N 0.64 0.10 -0.89 3.80 3.38 -0.86 -0.81 115.31 120.68 3d2r h LEU 306 Ca 0.53 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.51 3d2r h LEU 306 Cb 0.98 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.72 3d2r h LEU 306 CO -0.29 0.05 0.00 0.49 0.09 0.00 0.00 178.44 178.78 3d2r n PHE 307 N -4.37 0.01 -2.56 1.13 3.72 -0.78 -4.74 117.46 109.87 3d2r n PHE 307 Ca 0.14 -0.01 -0.39 0.00 -0.05 0.00 0.00 57.45 57.15 3d2r n PHE 307 Cb 0.72 0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 39.22 3d2r n PHE 307 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 3d2r s SER 308 N -1.97 7.18 0.32 4.37 0.01 -0.31 -4.13 113.70 119.17 3d2r s SER 308 Ca 0.38 2.12 -0.29 0.00 1.31 0.00 0.00 55.95 59.47 3d2r s SER 308 Cb 0.21 -2.61 -0.11 0.00 0.21 0.00 0.00 66.02 63.72 3d2r s SER 308 CO 0.33 -0.19 1.51 -0.31 0.41 0.00 0.00 173.24 174.99 3d2r s TYR 309 N -1.35 2.74 0.00 2.43 1.51 -1.26 -1.67 117.35 119.75 3d2r s TYR 309 Ca 0.48 1.02 0.00 0.00 -1.01 0.00 0.00 57.07 57.56 3d2r s TYR 309 Cb -0.27 -3.99 0.00 0.00 -0.11 0.00 0.00 41.96 37.59 3d2r s TYR 309 CO 0.34 -3.10 0.00 0.25 -1.11 0.00 0.00 175.55 171.93 3d2r n THR 310 N 1.40 0.00 -2.12 -0.71 -2.24 -0.67 -4.22 114.28 105.72 3d2r n THR 310 Ca 0.04 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.40 3d2r n THR 310 Cb 0.39 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.59 3d2r n THR 310 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 3d2r s TYR 311 N -1.42 2.56 -0.12 4.78 5.04 -0.67 -4.44 117.35 123.08 3d2r s TYR 311 Ca 0.00 0.58 -0.14 0.00 -2.44 0.00 0.00 57.07 55.07 3d2r s TYR 311 Cb 0.00 -3.77 0.04 0.00 0.35 0.00 0.00 41.96 38.57 3d2r s TYR 311 CO 0.00 -3.02 0.38 0.45 -1.34 0.00 0.00 175.55 172.02 3d2r s SER 312 N 2.34 -0.37 0.00 4.32 0.15 -1.26 -4.23 113.70 114.65 3d2r s SER 312 Ca 0.68 0.64 0.28 0.00 0.70 0.00 0.00 55.95 58.25 3d2r s SER 312 Cb -0.33 0.69 1.34 0.00 -1.71 0.00 0.00 66.02 66.01 3d2r s SER 312 CO 0.28 -0.21 1.90 0.35 1.20 0.00 0.00 173.24 176.76 3d2r n THR 313 N 2.50 0.02 -3.41 6.45 -2.24 -1.26 -4.86 114.28 111.48 3d2r n THR 313 Ca -0.15 -0.15 -0.27 0.00 -2.27 0.00 0.00 64.05 61.21 3d2r n THR 313 Cb 0.57 0.07 -0.02 0.00 -2.10 0.00 0.00 70.33 68.84 3d2r n THR 313 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3d2r s ALA 314 N -1.98 3.69 0.62 6.98 0.00 -1.26 -5.06 121.76 124.74 3d2r s ALA 314 Ca 0.40 -0.74 -0.18 0.00 0.00 0.00 0.00 51.96 51.44 3d2r s ALA 314 Cb 0.20 -2.18 -0.02 0.00 0.00 0.00 0.00 23.12 21.12 3d2r s ALA 314 CO 0.33 0.17 1.25 -2.14 0.00 0.00 0.00 175.76 175.38 3d2r s PRO 315 N -3.81 2.75 0.18 0.00 0.02 -1.26 -4.75 135.00 128.13 3d2r s PRO 315 Ca 0.41 1.95 -0.30 0.00 0.02 0.00 0.00 61.00 63.08 3d2r s PRO 315 Cb -0.10 -1.89 -0.08 0.00 0.02 0.00 0.00 34.50 32.45 3d2r s PRO 315 CO 0.32 -1.41 1.24 0.99 -0.33 0.00 0.00 177.00 177.81 3d2r s THR 316 N -1.50 3.47 0.00 0.99 2.01 -1.26 -4.49 115.64 114.85 3d2r s THR 316 Ca 0.80 1.21 0.00 0.00 0.31 0.00 0.00 61.69 64.01 3d2r s THR 316 Cb -0.34 -3.77 0.00 0.00 0.01 0.00 0.00 72.50 68.40 3d2r s THR 316 CO 0.37 0.18 0.00 -2.65 -0.69 0.00 0.00 174.62 171.83 3d2r n PRO 317 N 2.66 0.00 0.00 4.92 -0.02 -1.26 -5.06 135.00 136.24 3d2r n PRO 317 Ca 0.05 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.53 3d2r n PRO 317 Cb 0.44 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.92 3d2r n PRO 317 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 3d2r n PRO 326 N 0.00 0.00 0.00 0.52 -0.05 -1.26 -5.04 135.00 129.17 3d2r n PRO 326 Ca 0.00 0.00 -0.13 0.00 -0.05 0.00 0.00 63.50 63.32 3d2r n PRO 326 Cb 0.00 0.00 -0.10 0.00 -0.05 0.00 0.00 33.50 33.35 3d2r n PRO 326 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 175.50 176.70 3d2r h LEU 327 N 0.00 -0.06 -7.80 1.53 5.85 -2.00 -3.48 115.31 109.34 3d2r h LEU 327 Ca 0.00 -0.51 -0.08 0.00 0.84 0.00 0.00 57.88 58.13 3d2r h LEU 327 Cb 0.00 0.02 -0.13 0.00 0.37 0.00 0.00 40.66 40.91 3d2r h LEU 327 CO 0.00 0.51 -0.29 0.00 -0.34 0.00 0.00 178.44 178.32 3d2r s ALA 328 N -3.85 -0.31 0.00 1.25 0.00 -1.26 -4.92 121.76 112.66 3d2r s ALA 328 Ca -0.15 -0.57 0.00 0.00 0.00 0.00 0.00 51.96 51.23 3d2r s ALA 328 Cb 0.01 0.63 0.00 0.00 0.00 0.00 0.00 23.12 23.76 3d2r s ALA 328 CO 0.62 -0.58 0.00 0.41 0.00 0.00 0.00 175.76 176.21 3d2r n GLY 329 N -0.14 1.27 0.19 0.00 0.00 -1.26 -4.58 105.19 100.67 3d2r n GLY 329 Ca -0.13 0.00 0.10 0.00 0.00 0.00 0.00 46.02 45.99 3d2r n GLY 329 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 3d2r h PHE 330 N 0.00 0.00 -3.30 1.61 0.04 -1.90 -3.41 116.94 109.98 3d2r h PHE 330 Ca 0.00 0.00 -0.23 0.00 2.80 0.00 0.00 57.97 60.54 3d2r h PHE 330 Cb 0.00 0.00 0.06 0.00 2.20 0.00 0.00 35.95 38.21 3d2r h PHE 330 CO 0.00 0.11 -0.37 0.41 -0.60 0.00 0.00 178.31 177.86 3d2r n GLY 331 N 1.14 0.04 0.00 -1.45 0.00 -1.26 -3.47 105.19 100.20 3d2r n GLY 331 Ca 0.03 -0.20 0.04 0.00 0.00 0.00 0.00 46.02 45.89 3d2r n GLY 331 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3d2r n TYR 332 N -3.96 0.00 -0.09 1.61 4.02 -1.26 -1.67 117.16 115.81 3d2r n TYR 332 Ca -0.03 0.00 -0.07 0.00 -0.01 0.00 0.00 57.90 57.80 3d2r n TYR 332 Cb 0.55 -0.11 -0.00 0.00 -0.02 0.00 0.00 39.34 39.76 3d2r n TYR 332 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 3d2r h GLY 333 N 1.65 0.00 0.66 2.72 0.00 -1.95 -2.14 103.07 104.01 3d2r h GLY 333 Ca 0.00 0.26 -0.02 0.00 0.00 0.00 0.00 47.33 47.57 3d2r h GLY 333 CO 0.00 -0.19 -0.22 1.41 0.00 0.00 0.00 176.54 177.54 3d2r h LEU 334 N -0.16 -0.52 -1.07 3.11 3.38 -1.86 -2.38 115.31 115.82 3d2r h LEU 334 Ca 0.17 -0.09 -0.05 0.00 0.09 0.00 0.00 57.88 58.00 3d2r h LEU 334 Cb 0.42 0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.29 3d2r h LEU 334 CO -0.43 -0.14 0.08 1.55 0.09 0.00 0.00 178.44 179.59 3d2r h PRO 335 N -0.97 0.74 -0.22 1.13 0.13 -1.71 -0.45 132.00 130.66 3d2r h PRO 335 Ca -0.06 -0.16 -0.07 0.00 -0.87 0.00 0.00 66.00 64.84 3d2r h PRO 335 Cb 0.58 -0.11 -0.00 0.00 0.13 0.00 0.00 31.00 31.59 3d2r h PRO 335 CO 0.10 0.70 -0.14 0.82 -0.23 0.00 0.00 178.00 179.25 3d2r h ILE 336 N 0.71 1.31 -0.78 -3.56 1.08 -1.51 -1.49 117.51 113.28 3d2r h ILE 336 Ca 0.15 -1.25 -0.04 0.00 -0.39 0.00 0.00 64.86 63.34 3d2r h ILE 336 Cb 0.32 1.66 -0.04 0.00 -3.07 0.00 0.00 36.82 35.70 3d2r h ILE 336 CO 0.00 0.38 0.34 0.28 -0.69 0.00 0.00 178.15 178.47 3d2r h SER 337 N 0.17 1.04 -0.40 1.72 0.02 -1.25 -1.37 113.55 113.48 3d2r h SER 337 Ca 0.04 -0.14 -0.05 0.00 -0.84 0.00 0.00 61.79 60.81 3d2r h SER 337 Cb 0.66 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 62.91 3d2r h SER 337 CO 0.04 0.90 0.10 -0.09 -1.14 0.00 0.00 176.83 176.65 3d2r h ARG 338 N 1.12 0.72 -0.55 3.45 2.43 -1.03 -1.68 114.38 118.84 3d2r h ARG 338 Ca 0.26 -0.14 -0.04 0.00 -0.81 0.00 0.00 59.98 59.26 3d2r h ARG 338 Cb 0.16 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.58 3d2r h ARG 338 CO -0.03 0.66 0.19 -0.07 -1.51 0.00 0.00 179.97 179.22 3d2r h LEU 339 N 0.70 0.78 -0.68 3.80 3.38 -0.23 -0.26 115.31 122.81 3d2r h LEU 339 Ca 0.16 -0.19 0.08 0.00 0.09 0.00 0.00 57.88 58.02 3d2r h LEU 339 Cb 0.28 -0.20 -0.07 0.00 0.09 0.00 0.00 40.66 40.76 3d2r h LEU 339 CO -0.00 0.76 0.33 1.88 0.09 0.00 0.00 178.44 181.51 3d2r h TYR 340 N 0.76 0.60 -0.25 1.13 0.99 -1.00 0.38 116.97 119.57 3d2r h TYR 340 Ca 0.18 0.03 -0.05 0.00 2.00 0.00 0.00 58.73 60.88 3d2r h TYR 340 Cb 0.25 -0.17 -0.01 0.00 1.00 0.00 0.00 36.73 37.80 3d2r h TYR 340 CO 0.01 0.23 -0.05 0.00 -0.00 0.00 0.00 178.16 178.36 3d2r h ALA 341 N 1.40 0.34 0.00 3.88 0.00 -1.02 -2.96 119.26 120.90 3d2r h ALA 341 Ca 0.33 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 3d2r h ALA 341 Cb 0.32 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 3d2r h ALA 341 CO -0.25 0.13 -0.14 0.87 0.00 0.00 0.00 179.25 179.86 3d2r h LYS 342 N 0.23 0.00 -0.95 0.00 1.57 -0.72 0.34 116.57 117.04 3d2r h LYS 342 Ca 0.06 0.00 0.17 0.00 -1.87 0.00 0.00 60.65 59.02 3d2r h LYS 342 Cb 0.51 0.00 -0.10 0.00 0.08 0.00 0.00 32.23 32.72 3d2r h LYS 342 CO 0.02 0.14 0.54 -0.92 -0.57 0.00 0.00 179.45 178.67 3d2r h TYR 343 N 0.00 0.95 -0.73 -1.35 3.20 -0.75 -1.03 116.97 117.26 3d2r h TYR 343 Ca -0.00 0.03 -0.48 0.00 3.14 0.00 0.00 58.73 61.43 3d2r h TYR 343 Cb 0.72 -0.28 -0.28 0.00 1.54 0.00 0.00 36.73 38.43 3d2r h TYR 343 CO 0.00 0.22 0.06 1.19 -1.64 0.00 0.00 178.16 177.99 3d2r n PHE 344 N -4.81 2.43 -1.31 -3.82 0.99 -1.25 -0.45 117.46 109.24 3d2r n PHE 344 Ca 0.21 -2.26 -0.06 0.00 -0.00 0.00 0.00 57.45 55.34 3d2r n PHE 344 Cb 0.51 -0.79 -0.02 0.00 -1.00 0.00 0.00 39.48 38.18 3d2r n PHE 344 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.76 177.80 3d2r n GLN 345 N -0.94 -0.44 -0.02 -1.08 1.13 -0.39 -3.81 117.38 111.83 3d2r n GLN 345 Ca 0.48 0.66 0.00 0.00 -1.94 0.00 0.00 57.00 56.20 3d2r n GLN 345 Cb 0.96 -4.43 0.00 0.00 0.11 0.00 0.00 30.24 26.88 3d2r n GLN 345 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3d2r n GLY 346 N -2.06 0.36 3.71 1.08 0.00 0.11 -4.65 105.19 103.74 3d2r n GLY 346 Ca -0.06 -1.81 -0.06 0.00 0.00 0.00 0.00 46.02 44.09 3d2r n GLY 346 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3d2r s ASP 347 N -1.00 -0.25 -0.07 1.61 -1.08 0.11 -3.93 116.67 112.06 3d2r s ASP 347 Ca 0.00 -0.34 -0.03 0.00 -0.52 0.00 0.00 52.55 51.66 3d2r s ASP 347 Cb 0.00 0.52 0.04 0.00 -1.46 0.00 0.00 42.92 42.02 3d2r s ASP 347 CO 0.00 -0.94 0.15 -0.22 0.52 0.00 0.00 175.17 174.68 3d2r s LEU 348 N -2.84 0.54 0.11 -1.34 0.20 -1.26 -0.33 118.68 113.75 3d2r s LEU 348 Ca 0.10 0.30 0.03 0.00 0.69 0.00 0.00 54.13 55.25 3d2r s LEU 348 Cb -0.02 0.33 -0.04 0.00 -0.43 0.00 0.00 46.19 46.03 3d2r s LEU 348 CO 0.00 -0.17 -0.08 0.20 -0.29 0.00 0.00 176.35 176.01 3d2r s ASN 349 N 1.43 1.31 -0.02 3.68 0.01 -0.49 -4.96 114.94 115.90 3d2r s ASN 349 Ca -0.06 -0.98 0.04 0.00 -0.71 0.00 0.00 52.86 51.14 3d2r s ASN 349 Cb -0.12 0.06 -0.01 0.00 0.41 0.00 0.00 41.25 41.60 3d2r s ASN 349 CO -0.06 -0.41 -0.12 -0.22 -1.51 0.00 0.00 177.10 174.77 3d2r s LEU 350 N -3.00 1.94 -0.07 0.60 2.96 -1.26 -0.76 118.68 119.08 3d2r s LEU 350 Ca 0.12 -0.24 0.01 0.00 -0.22 0.00 0.00 54.13 53.80 3d2r s LEU 350 Cb 0.04 -0.67 0.02 0.00 0.50 0.00 0.00 46.19 46.07 3d2r s LEU 350 CO -0.03 0.13 -0.07 -0.31 -1.32 0.00 0.00 176.35 174.75 3d2r s TYR 351 N -0.11 1.12 0.16 5.38 1.51 -0.20 -5.02 117.35 120.20 3d2r s TYR 351 Ca 0.01 -0.42 0.11 0.00 -1.01 0.00 0.00 57.07 55.76 3d2r s TYR 351 Cb -0.07 -0.93 -0.04 0.00 -0.11 0.00 0.00 41.96 40.81 3d2r s TYR 351 CO 0.00 -0.30 -0.24 0.45 -1.11 0.00 0.00 175.55 174.35 3d2r s SER 352 N 1.13 3.49 -0.48 2.29 0.15 -1.26 -0.85 113.70 118.16 3d2r s SER 352 Ca -0.07 -0.77 -0.03 0.00 0.70 0.00 0.00 55.95 55.78 3d2r s SER 352 Cb -0.14 -0.30 0.13 0.00 -1.71 0.00 0.00 66.02 64.00 3d2r s SER 352 CO -0.01 0.15 0.28 -0.76 1.20 0.00 0.00 173.24 174.10 3d2r s LEU 353 N -2.40 5.26 0.11 3.45 1.43 0.14 -4.88 118.68 121.78 3d2r s LEU 353 Ca 0.18 -2.29 -0.32 0.00 -1.03 0.00 0.00 54.13 50.66 3d2r s LEU 353 Cb -0.09 -1.84 -0.12 0.00 0.03 0.00 0.00 46.19 44.17 3d2r s LEU 353 CO 0.09 -0.49 1.77 -0.24 0.23 0.00 0.00 176.35 177.71 3d2r n SER 354 N 4.25 3.73 0.00 2.29 2.88 -1.26 -0.39 113.62 125.11 3d2r n SER 354 Ca 0.01 1.02 0.00 0.00 -1.33 0.00 0.00 58.87 58.56 3d2r n SER 354 Cb 0.40 -1.49 0.00 0.00 -0.75 0.00 0.00 64.21 62.37 3d2r n SER 354 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3d2r n GLY 355 N 4.04 0.46 1.81 0.46 0.00 0.92 -4.90 105.19 107.98 3d2r n GLY 355 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 3d2r n GLY 355 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 3d2r n TYR 356 N -1.40 -1.99 -0.90 1.61 9.36 0.47 -4.82 117.16 119.50 3d2r n TYR 356 Ca 0.00 0.35 0.00 0.00 3.32 0.00 0.00 57.90 61.57 3d2r n TYR 356 Cb 0.00 0.48 0.00 0.00 -0.63 0.00 0.00 39.34 39.19 3d2r n TYR 356 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 3d2r n GLY 357 N 1.90 -1.39 2.98 2.98 0.00 -0.71 -1.44 105.19 109.51 3d2r n GLY 357 Ca 0.00 -1.02 -0.14 0.00 0.00 0.00 0.00 46.02 44.86 3d2r n GLY 357 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3d2r s THR 358 N -2.28 0.36 -0.21 2.61 2.01 -1.06 0.24 115.64 117.31 3d2r s THR 358 Ca 0.00 -0.48 -0.05 0.00 0.31 0.00 0.00 61.69 61.47 3d2r s THR 358 Cb 0.00 -0.36 -0.02 0.00 0.01 0.00 0.00 72.50 72.12 3d2r s THR 358 CO 0.00 -0.09 0.01 -1.81 -0.69 0.00 0.00 174.62 172.04 3d2r s ASP 359 N -0.61 4.85 -0.15 3.53 -0.00 -0.03 -1.55 116.67 122.71 3d2r s ASP 359 Ca -0.03 -0.22 -0.05 0.00 -0.00 0.00 0.00 52.55 52.25 3d2r s ASP 359 Cb -0.05 -1.84 -0.03 0.00 -0.00 0.00 0.00 42.92 41.00 3d2r s ASP 359 CO -0.00 0.03 0.01 0.00 -0.00 0.00 0.00 175.17 175.21 3d2r s ALA 360 N 1.21 3.22 -0.08 5.23 0.00 0.83 -1.03 121.76 131.13 3d2r s ALA 360 Ca 0.03 -0.79 0.01 0.00 0.00 0.00 0.00 51.96 51.22 3d2r s ALA 360 Cb -0.15 -1.67 0.02 0.00 0.00 0.00 0.00 23.12 21.32 3d2r s ALA 360 CO 0.01 0.30 -0.10 -1.50 0.00 0.00 0.00 175.76 174.47 3d2r s ILE 361 N 0.04 1.08 -0.16 0.00 2.07 0.06 -0.08 121.20 124.21 3d2r s ILE 361 Ca 0.03 -0.40 -0.08 0.00 -1.41 0.00 0.00 60.65 58.78 3d2r s ILE 361 Cb -0.13 -1.03 -0.04 0.00 0.13 0.00 0.00 42.46 41.39 3d2r s ILE 361 CO 0.02 0.35 0.13 -0.63 -1.91 0.00 0.00 174.94 172.90 3d2r s ILE 362 N 1.03 5.39 -0.09 2.00 1.01 -0.36 -1.40 121.20 128.78 3d2r s ILE 362 Ca -0.08 0.17 0.04 0.00 0.00 0.00 0.00 60.65 60.79 3d2r s ILE 362 Cb -0.15 -3.40 -0.00 0.00 0.01 0.00 0.00 42.46 38.92 3d2r s ILE 362 CO -0.01 0.52 -0.23 -0.31 0.00 0.00 0.00 174.94 174.91 3d2r s TYR 363 N -0.27 2.56 0.08 3.97 1.51 0.55 -1.60 117.35 124.15 3d2r s TYR 363 Ca 0.11 -0.95 0.08 0.00 -1.01 0.00 0.00 57.07 55.29 3d2r s TYR 363 Cb -0.12 -1.70 -0.03 0.00 -0.11 0.00 0.00 41.96 40.01 3d2r s TYR 363 CO 0.01 -0.36 -0.21 -0.51 -1.11 0.00 0.00 175.55 173.37 3d2r s LEU 364 N 0.24 2.24 0.21 -1.29 1.43 0.52 -0.72 118.68 121.32 3d2r s LEU 364 Ca -0.15 -0.61 -0.30 0.00 -1.03 0.00 0.00 54.13 52.03 3d2r s LEU 364 Cb -0.17 -0.91 -0.09 0.00 0.03 0.00 0.00 46.19 45.05 3d2r s LEU 364 CO 0.08 0.10 1.35 -0.54 0.23 0.00 0.00 176.35 177.56 3d2r s LYS 365 N -1.59 4.35 0.16 1.70 -0.14 -1.26 -1.03 119.74 121.93 3d2r s LYS 365 Ca 0.07 2.12 0.26 0.00 -1.36 0.00 0.00 55.97 57.06 3d2r s LYS 365 Cb -0.09 -3.17 0.81 0.00 -1.68 0.00 0.00 37.83 33.69 3d2r s LYS 365 CO 0.03 -0.31 1.73 0.00 -0.76 0.00 0.00 175.35 176.05 3d2r n ALA 366 N 2.60 2.42 -3.22 5.17 0.00 -0.24 -4.71 120.51 122.53 3d2r n ALA 366 Ca 0.07 -0.08 -0.34 0.00 0.00 0.00 0.00 53.44 53.08 3d2r n ALA 366 Cb 0.42 -1.42 -0.13 0.00 0.00 0.00 0.00 19.45 18.32 3d2r n ALA 366 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3d2r s LEU 367 N -4.18 3.02 0.51 0.00 1.43 -1.26 -4.69 118.68 113.51 3d2r s LEU 367 Ca 0.11 -0.28 0.21 0.00 -1.03 0.00 0.00 54.13 53.13 3d2r s LEU 367 Cb 0.14 -1.75 1.29 0.00 0.03 0.00 0.00 46.19 45.91 3d2r s LEU 367 CO 0.61 0.07 2.04 0.77 0.23 0.00 0.00 176.35 180.06 3d2r h SER 368 N 7.44 0.07 1.28 2.29 4.64 -1.88 -1.82 113.55 125.56 3d2r h SER 368 Ca -0.35 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 60.95 3d2r h SER 368 Cb 1.18 -0.01 -0.00 0.00 -0.31 0.00 0.00 62.40 63.25 3d2r h SER 368 CO 0.60 0.04 -0.10 0.77 -0.87 0.00 0.00 176.83 177.27 3d2r h SER 369 N 0.07 0.00 0.04 4.97 4.64 -1.94 -2.62 113.55 118.71 3d2r h SER 369 Ca 0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.50 3d2r h SER 369 Cb 0.63 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.72 3d2r h SER 369 CO -0.01 0.10 -0.45 -0.62 -0.87 0.00 0.00 176.83 174.97 3d2r n GLU 370 N -3.18 1.08 -2.75 4.77 1.02 -0.72 -4.71 120.64 116.15 3d2r n GLU 370 Ca 0.01 -0.85 -0.43 0.00 -0.02 0.00 0.00 57.16 55.87 3d2r n GLU 370 Cb 0.43 -1.48 -0.02 0.00 -0.02 0.00 0.00 31.44 30.35 3d2r n GLU 370 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 3d2r s SER 371 N -2.51 6.74 -0.06 1.62 0.01 -1.03 -4.77 113.70 113.71 3d2r s SER 371 Ca 0.19 -2.19 0.04 0.00 1.31 0.00 0.00 55.95 55.30 3d2r s SER 371 Cb 0.18 -2.49 -0.02 0.00 0.21 0.00 0.00 66.02 63.91 3d2r s SER 371 CO 0.57 -1.14 -0.18 -0.63 0.41 0.00 0.00 173.24 172.28 3d2r s ILE 372 N 3.40 2.72 0.35 1.44 1.01 -1.25 -0.84 121.20 128.04 3d2r s ILE 372 Ca 0.43 -0.84 -0.28 0.00 0.00 0.00 0.00 60.65 59.97 3d2r s ILE 372 Cb -0.01 -2.05 -0.12 0.00 0.01 0.00 0.00 42.46 40.29 3d2r s ILE 372 CO -0.04 0.57 1.42 -0.62 0.00 0.00 0.00 174.94 176.28 3d2r n GLU 373 N 2.66 2.45 -3.67 2.79 1.02 -0.15 -3.79 120.64 121.95 3d2r n GLU 373 Ca -0.17 0.86 -0.39 0.00 -0.02 0.00 0.00 57.16 57.44 3d2r n GLU 373 Cb 0.52 -2.54 -0.11 0.00 -0.02 0.00 0.00 31.44 29.30 3d2r n GLU 373 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 3d2r s LYS 374 N -1.85 2.56 0.01 3.49 2.20 0.40 -4.77 119.74 121.79 3d2r s LYS 374 Ca 0.55 -1.38 0.08 0.00 -0.36 0.00 0.00 55.97 54.85 3d2r s LYS 374 Cb -0.52 -3.65 -0.03 0.00 -1.51 0.00 0.00 37.83 32.13 3d2r s LYS 374 CO 0.62 -0.86 -0.23 -0.51 -0.36 0.00 0.00 175.35 174.01 3d2r s LEU 375 N 1.39 2.30 0.42 5.43 1.43 -1.26 -4.84 118.68 123.55 3d2r s LEU 375 Ca 0.02 -0.46 -0.22 0.00 -1.03 0.00 0.00 54.13 52.43 3d2r s LEU 375 Cb -0.22 -1.39 -0.10 0.00 0.03 0.00 0.00 46.19 44.52 3d2r s LEU 375 CO 0.02 0.29 1.00 -2.16 0.23 0.00 0.00 176.35 175.73 3d2r s PRO 376 N -1.00 4.15 -0.03 1.29 0.04 -1.26 -5.06 135.00 133.14 3d2r s PRO 376 Ca 0.12 1.33 0.04 0.00 0.04 0.00 0.00 61.00 62.52 3d2r s PRO 376 Cb -0.10 -2.36 -0.00 0.00 0.04 0.00 0.00 34.50 32.08 3d2r s PRO 376 CO 0.01 -0.12 -0.14 0.08 0.04 0.00 0.00 177.00 176.87 3d2r s VAL 377 N -1.89 1.16 -0.59 -0.36 1.01 -1.26 -4.77 120.40 113.70 3d2r s VAL 377 Ca 0.60 -0.59 -0.24 0.00 0.00 0.00 0.00 61.98 61.76 3d2r s VAL 377 Cb -0.16 -1.00 0.05 0.00 0.00 0.00 0.00 36.38 35.27 3d2r s VAL 377 CO 0.21 0.34 0.95 0.12 0.00 0.00 0.00 175.10 176.72 3d2r s PHE 378 N -0.05 2.74 0.06 5.22 5.36 -1.26 -4.67 117.98 125.37 3d2r s PHE 378 Ca -0.00 -0.20 0.01 0.00 -0.96 0.00 0.00 56.93 55.78 3d2r s PHE 378 Cb -0.09 -4.15 -0.00 0.00 -0.34 0.00 0.00 43.02 38.44 3d2r s PHE 378 CO 0.01 -1.47 0.06 0.27 -1.46 0.00 0.00 175.22 172.63 3d2r n ASN 379 N 7.59 -0.16 -0.22 6.13 0.23 -1.26 -4.99 115.26 122.58 3d2r n ASN 379 Ca -0.00 -1.34 -0.01 0.00 -0.53 0.00 0.00 54.58 52.70 3d2r n ASN 379 Cb 0.47 0.34 0.10 0.00 -2.08 0.00 0.00 39.78 38.61 3d2r n ASN 379 CO 0.00 0.00 0.00 0.50 -0.93 0.00 0.00 177.26 176.83 3d2r h LYS 380 N 0.00 0.54 -0.47 -3.83 3.64 -1.99 -1.32 116.57 113.14 3d2r h LYS 380 Ca -0.04 -0.03 -0.08 0.00 -1.27 0.00 0.00 60.65 59.23 3d2r h LYS 380 Cb 0.20 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 31.87 3d2r h LYS 380 CO 0.06 0.36 -0.03 1.03 -2.27 0.00 0.00 179.45 178.60 3d2r h SER 381 N 0.56 0.77 -0.28 4.20 0.87 -1.96 -0.84 113.55 116.86 3d2r h SER 381 Ca 0.30 -0.20 -0.02 0.00 -1.23 0.00 0.00 61.79 60.65 3d2r h SER 381 Cb 0.28 -0.20 -0.01 0.00 -0.44 0.00 0.00 62.40 62.02 3d2r h SER 381 CO -0.23 0.85 0.10 0.00 -0.53 0.00 0.00 176.83 177.02 3d2r h ALA 382 N 1.23 0.36 -0.98 6.23 0.00 -1.72 -2.39 119.26 121.99 3d2r h ALA 382 Ca 0.14 -0.13 0.07 0.00 0.00 0.00 0.00 54.91 54.99 3d2r h ALA 382 Cb 0.49 -0.11 -0.07 0.00 0.00 0.00 0.00 17.79 18.10 3d2r h ALA 382 CO 0.02 -0.02 0.63 0.35 0.00 0.00 0.00 179.25 180.23 3d2r h PHE 383 N 0.30 1.16 0.04 0.00 3.57 -0.87 -2.80 116.94 118.34 3d2r h PHE 383 Ca 0.09 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.62 3d2r h PHE 383 Cb 0.21 -0.38 0.00 0.00 2.79 0.00 0.00 35.95 38.57 3d2r h PHE 383 CO -0.00 0.58 -0.02 0.87 -2.23 0.00 0.00 178.31 177.51 3d2r h LYS 384 N 1.12 -0.05 -1.47 1.11 1.57 -1.05 -2.03 116.57 115.77 3d2r h LYS 384 Ca 0.43 0.00 0.43 0.00 -1.87 0.00 0.00 60.65 59.64 3d2r h LYS 384 Cb 0.21 0.01 -0.06 0.00 0.08 0.00 0.00 32.23 32.47 3d2r h LYS 384 CO -0.19 0.16 1.05 0.45 -0.57 0.00 0.00 179.45 180.36 3d2r h HIS 385 N -0.26 0.04 -0.20 -1.35 3.86 -1.18 -3.52 115.15 112.55 3d2r h HIS 385 Ca -0.01 0.00 -0.41 0.00 -1.16 0.00 0.00 60.37 58.79 3d2r h HIS 385 Cb 0.24 -0.01 -0.05 0.00 1.06 0.00 0.00 27.41 28.64 3d2r h HIS 385 CO -0.00 -0.01 1.23 0.66 0.86 0.00 0.00 177.93 180.67 3d2r n TYR 386 N -4.13 1.12 0.00 2.45 4.01 -0.77 -4.96 117.16 114.88 3d2r n TYR 386 Ca 0.33 -2.14 0.00 0.00 -0.16 0.00 0.00 57.90 55.93 3d2r n TYR 386 Cb 1.52 -1.87 0.00 0.00 -0.31 0.00 0.00 39.34 38.68 3d2r n TYR 386 CO 0.00 0.00 0.00 -0.40 -0.46 0.00 0.00 176.86 176.00 3d2r n ASP 394 N 2.61 0.00 -4.28 7.72 5.75 -1.26 -5.03 116.55 122.06 3d2r n ASP 394 Ca 0.56 0.00 -0.31 0.00 -0.01 0.00 0.00 54.79 55.03 3d2r n ASP 394 Cb 0.62 0.00 -0.16 0.00 -1.03 0.00 0.00 41.12 40.54 3d2r n ASP 394 CO 0.00 0.00 0.00 0.26 -0.11 0.00 0.00 177.20 177.35 3d2r s TRP 395 N -0.31 2.34 -0.69 2.11 0.52 -1.26 -5.07 118.94 116.58 3d2r s TRP 395 Ca 0.00 -0.57 -0.21 0.00 0.02 0.00 0.00 56.10 55.34 3d2r s TRP 395 Cb 0.00 -1.52 0.09 0.00 -1.15 0.00 0.00 33.47 30.89 3d2r s TRP 395 CO 0.00 -0.13 0.91 0.00 0.02 0.00 0.00 176.95 177.76