#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rcu n ASP 33 N 0.00 3.05 -4.65 -1.12 10.43 -1.26 -4.88 116.55 118.12 2rcu n ASP 33 Ca 0.00 -2.36 -0.35 0.00 2.57 0.00 0.00 54.79 54.66 2rcu n ASP 33 Cb 0.00 -0.51 -0.10 0.00 1.84 0.00 0.00 41.12 42.35 2rcu n ASP 33 CO 0.00 0.00 0.00 -0.31 -1.07 0.00 0.00 177.20 175.82 2rcu s TYR 34 N -1.79 3.16 -2.24 1.24 2.02 -1.26 -4.51 117.35 113.97 2rcu s TYR 34 Ca 0.27 0.10 0.26 0.00 -0.37 0.00 0.00 57.07 57.33 2rcu s TYR 34 Cb 0.19 -1.86 0.74 0.00 -0.40 0.00 0.00 41.96 40.63 2rcu s TYR 34 CO 0.10 0.34 1.56 1.47 -1.57 0.00 0.00 175.55 177.46 2rcu n LEU 35 N 2.57 1.54 -3.63 -1.29 -0.00 -1.26 -4.92 117.00 110.01 2rcu n LEU 35 Ca -0.18 -0.49 -0.12 0.00 -0.00 0.00 0.00 56.01 55.22 2rcu n LEU 35 Cb 0.53 -0.05 -0.05 0.00 -0.00 0.00 0.00 43.42 43.85 2rcu n LEU 35 CO 0.30 0.27 0.17 -1.58 -0.00 0.00 0.00 177.39 176.55 2rcu s GLN 36 N -2.23 1.01 -0.42 1.47 0.74 -1.26 -5.04 119.66 113.93 2rcu s GLN 36 Ca 0.30 -0.52 0.10 0.00 0.05 0.00 0.00 55.36 55.30 2rcu s GLN 36 Cb 0.20 0.45 0.36 0.00 1.10 0.00 0.00 33.01 35.11 2rcu s GLN 36 CO 0.42 -0.37 0.81 0.72 -0.55 0.00 0.00 175.29 176.32 2rcu n HIS 37 N 0.13 1.33 -1.80 1.67 8.25 -1.22 -4.64 115.22 118.93 2rcu n HIS 37 Ca -0.17 -3.79 -0.42 0.00 -0.26 0.00 0.00 57.72 53.08 2rcu n HIS 37 Cb 0.62 -0.43 -0.03 0.00 1.12 0.00 0.00 29.99 31.27 2rcu n HIS 37 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2rcu s SER 38 N -2.77 6.45 0.33 0.41 0.15 0.24 -4.90 113.70 113.61 2rcu s SER 38 Ca 0.42 2.80 0.22 0.00 0.70 0.00 0.00 55.95 60.09 2rcu s SER 38 Cb 0.34 -2.60 0.18 0.00 -1.71 0.00 0.00 66.02 62.23 2rcu s SER 38 CO -0.09 -0.91 1.35 0.16 1.20 0.00 0.00 173.24 174.95 2rcu h ILE 39 N 3.81 0.03 -3.49 6.45 -0.00 -1.91 -3.43 117.51 118.97 2rcu h ILE 39 Ca -0.43 -1.05 -0.61 0.00 -0.00 0.00 0.00 64.86 62.77 2rcu h ILE 39 Cb 1.20 1.80 -0.12 0.00 -0.00 0.00 0.00 36.82 39.71 2rcu h ILE 39 CO 0.92 0.02 0.15 -0.69 -0.00 0.00 0.00 178.15 178.55 2rcu s VAL 40 N -3.26 4.97 0.33 0.16 1.01 -1.26 -4.91 120.40 117.45 2rcu s VAL 40 Ca 0.04 1.06 -0.27 0.00 0.00 0.00 0.00 61.98 62.80 2rcu s VAL 40 Cb 0.07 -3.95 -0.13 0.00 0.00 0.00 0.00 36.38 32.38 2rcu s VAL 40 CO 0.72 -0.01 1.09 -2.65 0.00 0.00 0.00 175.10 174.25 2rcu n PRO 41 N 5.75 1.58 -0.30 2.72 -0.02 -1.26 -4.50 135.00 138.97 2rcu n PRO 41 Ca -0.01 0.56 0.13 0.00 -2.02 0.00 0.00 63.50 62.16 2rcu n PRO 41 Cb 0.49 -2.03 0.28 0.00 -0.02 0.00 0.00 33.50 32.22 2rcu n PRO 41 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 2rcu h THR 42 N 2.05 0.26 -0.56 3.45 2.02 -1.42 -2.10 112.91 116.60 2rcu h THR 42 Ca -0.43 -0.05 0.00 0.00 0.77 0.00 0.00 66.41 66.70 2rcu h THR 42 Cb 1.32 0.09 0.00 0.00 -1.74 0.00 0.00 68.15 67.82 2rcu h THR 42 CO 0.60 0.03 0.00 0.23 0.37 0.00 0.00 175.52 176.75 2rcu n MET 43 N -5.28 4.08 0.21 6.66 2.81 -1.26 -4.11 117.12 120.22 2rcu n MET 43 Ca 0.21 -2.77 0.12 0.00 -1.81 0.00 0.00 57.70 53.45 2rcu n MET 43 Cb 0.69 -2.04 0.71 0.00 -0.71 0.00 0.00 33.22 31.87 2rcu n MET 43 CO 0.00 0.00 0.00 1.25 1.51 0.00 0.00 175.97 178.73 2rcu h HIS 44 N 3.73 0.00 0.00 2.03 6.17 -1.72 -2.31 115.15 123.05 2rcu h HIS 44 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 60.37 61.08 2rcu h HIS 44 Cb 1.62 0.00 0.00 0.00 2.52 0.00 0.00 27.41 31.55 2rcu h HIS 44 CO 0.87 0.00 -0.98 0.66 0.71 0.00 0.00 177.93 179.19 2rcu n TYR 45 N -4.33 0.01 -0.20 5.26 4.01 -1.26 -4.38 117.16 116.27 2rcu n TYR 45 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 2rcu n TYR 45 Cb 0.22 -0.07 0.11 0.00 -0.31 0.00 0.00 39.34 39.29 2rcu n TYR 45 CO 0.00 0.00 0.00 1.96 -0.46 0.00 0.00 176.86 178.36 2rcu h GLN 46 N 0.00 0.37 0.00 -0.72 1.08 -1.73 -1.78 115.11 112.33 2rcu h GLN 46 Ca 0.00 -0.02 -0.03 0.00 -1.45 0.00 0.00 58.65 57.15 2rcu h GLN 46 Cb 0.53 -0.08 -0.00 0.00 -0.05 0.00 0.00 27.48 27.87 2rcu h GLN 46 CO 0.00 0.24 -0.13 -0.44 -0.95 0.00 0.00 178.83 177.56 2rcu h ASP 47 N 0.38 0.00 -0.34 1.46 3.32 -1.79 -3.18 116.42 116.27 2rcu h ASP 47 Ca 0.31 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.36 2rcu h ASP 47 Cb 0.40 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.95 2rcu h ASP 47 CO -0.32 0.13 0.00 -1.54 -1.72 0.00 0.00 179.24 175.78 2rcu n SER 48 N -4.22 2.93 -4.72 6.45 3.41 -0.69 -4.90 113.62 111.88 2rcu n SER 48 Ca -0.03 -1.91 -0.41 0.00 -0.26 0.00 0.00 58.87 56.26 2rcu n SER 48 Cb 0.20 -0.23 0.01 0.00 -0.26 0.00 0.00 64.21 63.93 2rcu n SER 48 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2rcu n LEU 49 N 0.74 4.16 -4.76 1.04 4.77 -1.06 -4.66 117.00 117.23 2rcu n LEU 49 Ca 0.13 1.14 -0.35 0.00 -0.03 0.00 0.00 56.01 56.90 2rcu n LEU 49 Cb 0.44 -1.52 0.03 0.00 -2.33 0.00 0.00 43.42 40.04 2rcu n LEU 49 CO 0.09 -0.46 0.81 -2.16 -1.33 0.00 0.00 177.39 174.34 2rcu s PRO 50 N -2.16 2.97 0.33 3.23 0.04 -1.26 -4.59 135.00 133.55 2rcu s PRO 50 Ca 0.59 1.71 -0.26 0.00 0.04 0.00 0.00 61.00 63.08 2rcu s PRO 50 Cb -0.51 -1.94 -0.10 0.00 0.04 0.00 0.00 34.50 31.99 2rcu s PRO 50 CO 0.59 -1.18 0.99 1.03 0.04 0.00 0.00 177.00 178.48 2rcu s ARG 51 N -3.46 4.53 -0.07 4.56 0.52 -1.26 -0.89 118.95 122.87 2rcu s ARG 51 Ca 0.75 1.46 -0.34 0.00 -0.52 0.00 0.00 55.73 57.07 2rcu s ARG 51 Cb -0.27 -2.85 -0.12 0.00 0.52 0.00 0.00 34.95 32.23 2rcu s ARG 51 CO 0.34 0.20 1.88 -0.11 0.02 0.00 0.00 175.30 177.62 2rcu n LEU 52 N 0.61 3.48 -4.76 2.53 7.94 -1.26 -4.85 117.00 120.68 2rcu n LEU 52 Ca 0.02 0.97 -0.38 0.00 -1.11 0.00 0.00 56.01 55.51 2rcu n LEU 52 Cb 0.49 -1.38 0.02 0.00 0.53 0.00 0.00 43.42 43.07 2rcu n LEU 52 CO 0.46 -0.04 0.94 -2.84 -1.11 0.00 0.00 177.39 174.80 2rcu s PRO 53 N 3.98 3.51 -0.26 1.96 0.02 -1.26 -4.80 135.00 138.15 2rcu s PRO 53 Ca 0.92 2.11 -0.09 0.00 0.02 0.00 0.00 61.00 63.96 2rcu s PRO 53 Cb -0.68 -2.42 -0.04 0.00 0.02 0.00 0.00 34.50 31.38 2rcu s PRO 53 CO 0.51 -0.85 0.12 0.42 -0.33 0.00 0.00 177.00 176.86 2rcu s ILE 54 N -1.36 4.70 0.89 2.83 1.01 -1.26 -4.89 121.20 123.13 2rcu s ILE 54 Ca 0.66 -0.04 -0.10 0.00 0.00 0.00 0.00 60.65 61.17 2rcu s ILE 54 Cb -0.37 -3.22 0.13 0.00 0.01 0.00 0.00 42.46 39.02 2rcu s ILE 54 CO 0.45 0.31 1.14 -2.84 0.00 0.00 0.00 174.94 173.99 2rcu s PRO 55 N 1.65 1.20 0.32 2.79 0.02 -1.26 -4.97 135.00 134.75 2rcu s PRO 55 Ca 0.07 1.47 -0.29 0.00 0.02 0.00 0.00 61.00 62.27 2rcu s PRO 55 Cb -0.15 -1.75 -0.11 0.00 0.02 0.00 0.00 34.50 32.50 2rcu s PRO 55 CO 0.06 -2.48 1.47 0.15 -0.33 0.00 0.00 177.00 175.87 2rcu s LYS 56 N -4.69 4.19 0.41 5.54 1.02 -1.26 -4.92 119.74 120.03 2rcu s LYS 56 Ca 0.66 2.45 0.10 0.00 0.02 0.00 0.00 55.97 59.19 2rcu s LYS 56 Cb -0.22 -3.03 0.90 0.00 -0.52 0.00 0.00 37.83 34.96 2rcu s LYS 56 CO 0.58 -0.47 2.00 1.25 -0.92 0.00 0.00 175.35 177.79 2rcu h LEU 57 N 3.99 0.48 -0.78 3.17 5.85 -2.00 -2.01 115.31 124.00 2rcu h LEU 57 Ca -0.48 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.22 2rcu h LEU 57 Cb 1.23 -0.10 -0.04 0.00 0.37 0.00 0.00 40.66 42.12 2rcu h LEU 57 CO 0.71 0.31 0.41 1.05 -0.34 0.00 0.00 178.44 180.59 2rcu h GLU 58 N 0.54 1.10 -0.15 1.25 4.11 -1.96 -1.73 114.58 117.74 2rcu h GLU 58 Ca 0.25 -0.14 0.00 0.00 0.07 0.00 0.00 59.36 59.54 2rcu h GLU 58 Cb 0.29 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 2rcu h GLU 58 CO -0.07 0.83 0.10 -0.44 0.07 0.00 0.00 179.01 179.50 2rcu h ASP 59 N 1.09 0.18 -0.55 3.06 3.32 -1.78 -2.38 116.42 119.37 2rcu h ASP 59 Ca 0.27 -0.02 0.07 0.00 0.02 0.00 0.00 57.03 57.37 2rcu h ASP 59 Cb 0.06 -0.04 -0.06 0.00 0.22 0.00 0.00 39.33 39.51 2rcu h ASP 59 CO -0.04 0.14 0.24 0.74 -1.72 0.00 0.00 179.24 178.60 2rcu h THR 60 N 0.20 0.87 -0.45 0.35 2.02 -1.14 -0.90 112.91 113.87 2rcu h THR 60 Ca 0.06 -0.15 -0.10 0.00 0.77 0.00 0.00 66.41 66.98 2rcu h THR 60 Cb -0.01 0.38 -0.01 0.00 -1.74 0.00 0.00 68.15 66.77 2rcu h THR 60 CO -0.01 0.08 -0.13 0.24 0.37 0.00 0.00 175.52 176.07 2rcu h MET 61 N 0.45 0.88 -0.04 6.66 2.86 -1.29 -0.24 114.93 124.20 2rcu h MET 61 Ca 0.26 -0.34 0.01 0.00 -2.06 0.00 0.00 59.70 57.57 2rcu h MET 61 Cb 0.24 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 31.84 2rcu h MET 61 CO -0.22 0.99 -0.04 -0.22 1.06 0.00 0.00 176.91 178.47 2rcu h LYS 62 N 0.71 -0.05 -0.72 1.72 1.63 -1.17 -0.97 116.57 117.73 2rcu h LYS 62 Ca 0.11 0.00 0.01 0.00 -0.85 0.00 0.00 60.65 59.93 2rcu h LYS 62 Cb 0.67 0.01 -0.04 0.00 -0.60 0.00 0.00 32.23 32.28 2rcu h LYS 62 CO 0.05 -0.03 0.47 0.00 -3.45 0.00 0.00 179.45 176.49 2rcu h ARG 63 N -0.05 0.93 0.23 1.90 3.08 -1.09 0.93 114.38 120.30 2rcu h ARG 63 Ca 0.03 -0.06 0.01 0.00 0.07 0.00 0.00 59.98 60.03 2rcu h ARG 63 Cb 0.09 -0.21 -0.03 0.00 0.08 0.00 0.00 29.97 29.91 2rcu h ARG 63 CO -0.07 0.61 -0.30 -0.92 -1.07 0.00 0.00 179.97 178.23 2rcu h TYR 64 N 0.95 -0.79 -0.98 3.04 3.20 -0.85 -1.43 116.97 120.11 2rcu h TYR 64 Ca 0.27 0.01 0.05 0.00 3.14 0.00 0.00 58.73 62.20 2rcu h TYR 64 Cb -0.09 0.32 -0.06 0.00 1.54 0.00 0.00 36.73 38.44 2rcu h TYR 64 CO -0.03 -0.42 0.64 -0.07 -1.64 0.00 0.00 178.16 176.65 2rcu h LEU 65 N -0.58 1.04 -1.19 2.82 3.38 -0.99 -1.39 115.31 118.40 2rcu h LEU 65 Ca 0.00 0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.01 2rcu h LEU 65 Cb 0.56 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 41.04 2rcu h LEU 65 CO -0.10 0.69 0.56 0.78 0.09 0.00 0.00 178.44 180.45 2rcu h ASN 66 N 1.20 0.91 1.72 -0.43 2.35 -0.43 -0.88 115.58 120.02 2rcu h ASN 66 Ca 0.41 -0.01 -0.02 0.00 -0.55 0.00 0.00 56.30 56.13 2rcu h ASN 66 Cb 0.08 -0.21 -0.00 0.00 0.05 0.00 0.00 38.32 38.24 2rcu h ASN 66 CO -0.15 0.62 -0.11 0.00 -1.65 0.00 0.00 177.43 176.14 2rcu h ALA 67 N 1.51 0.94 0.00 -0.83 0.00 -0.71 -3.14 119.26 117.02 2rcu h ALA 67 Ca 0.34 -0.10 -0.09 0.00 0.00 0.00 0.00 54.91 55.05 2rcu h ALA 67 Cb 0.03 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2rcu h ALA 67 CO -0.10 0.14 -0.50 1.96 0.00 0.00 0.00 179.25 180.75 2rcu h GLN 68 N 0.00 0.00 -0.56 0.00 1.08 -0.13 -3.38 115.11 112.12 2rcu h GLN 68 Ca -0.00 0.00 0.11 0.00 -1.45 0.00 0.00 58.65 57.31 2rcu h GLN 68 Cb 1.00 0.00 -0.09 0.00 -0.05 0.00 0.00 27.48 28.34 2rcu h GLN 68 CO 0.01 0.41 0.02 -0.22 -0.95 0.00 0.00 178.83 178.10 2rcu h LYS 69 N 0.00 0.13 0.00 1.46 1.63 -1.16 0.10 116.57 118.73 2rcu h LYS 69 Ca -0.01 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.78 2rcu h LYS 69 Cb 1.34 -0.03 0.00 0.00 -0.60 0.00 0.00 32.23 32.94 2rcu h LYS 69 CO 0.05 0.09 0.00 -0.35 -3.45 0.00 0.00 179.45 175.79 2rcu n PRO 70 N -5.24 0.15 -0.03 1.90 -0.04 -1.26 -3.89 135.00 126.58 2rcu n PRO 70 Ca 0.07 0.29 0.07 0.00 -0.04 0.00 0.00 63.50 63.89 2rcu n PRO 70 Cb 0.31 -1.73 -0.16 0.00 -0.04 0.00 0.00 33.50 31.88 2rcu n PRO 70 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2rcu n LEU 71 N -2.00 0.00 -4.58 1.53 4.77 -0.06 -4.86 117.00 111.80 2rcu n LEU 71 Ca 0.04 0.00 -0.33 0.00 -0.03 0.00 0.00 56.01 55.69 2rcu n LEU 71 Cb 0.28 0.08 -0.11 0.00 -2.33 0.00 0.00 43.42 41.34 2rcu n LEU 71 CO 0.22 0.08 -0.39 -0.76 -1.33 0.00 0.00 177.39 175.22 2rcu s LEU 72 N -4.65 3.14 1.02 2.23 1.43 -0.71 -5.05 118.68 116.09 2rcu s LEU 72 Ca -0.08 -0.08 -0.12 0.00 -1.03 0.00 0.00 54.13 52.82 2rcu s LEU 72 Cb 0.12 -1.73 0.20 0.00 0.03 0.00 0.00 46.19 44.82 2rcu s LEU 72 CO 0.87 0.33 1.08 1.51 0.23 0.00 0.00 176.35 180.38 2rcu s ASP 73 N -1.03 2.37 0.21 2.29 1.47 -1.26 -4.72 116.67 116.00 2rcu s ASP 73 Ca 0.14 1.26 -0.08 0.00 1.18 0.00 0.00 52.55 55.05 2rcu s ASP 73 Cb -0.11 -1.95 0.29 0.00 -0.34 0.00 0.00 42.92 40.81 2rcu s ASP 73 CO 0.04 -3.30 1.78 0.44 0.68 0.00 0.00 175.17 174.81 2rcu h ASP 74 N -2.01 0.45 -0.31 2.11 3.32 -1.99 -0.21 116.42 117.78 2rcu h ASP 74 Ca -0.55 0.05 -0.09 0.00 0.02 0.00 0.00 57.03 56.46 2rcu h ASP 74 Cb 1.33 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 40.84 2rcu h ASP 74 CO 0.56 0.27 -0.16 -1.28 -1.72 0.00 0.00 179.24 176.91 2rcu h SER 75 N 0.59 0.68 -0.56 6.45 0.87 -1.99 -1.67 113.55 117.91 2rcu h SER 75 Ca 0.32 -0.41 0.01 0.00 -1.23 0.00 0.00 61.79 60.47 2rcu h SER 75 Cb 0.30 -0.19 -0.03 0.00 -0.44 0.00 0.00 62.40 62.04 2rcu h SER 75 CO -0.24 0.94 0.37 1.56 -0.53 0.00 0.00 176.83 178.93 2rcu h GLN 76 N 0.41 0.73 -0.45 2.24 4.20 -1.83 -1.81 115.11 118.61 2rcu h GLN 76 Ca 0.07 -0.04 -0.02 0.00 0.06 0.00 0.00 58.65 58.71 2rcu h GLN 76 Cb 0.69 -0.17 -0.02 0.00 0.30 0.00 0.00 27.48 28.28 2rcu h GLN 76 CO 0.05 0.49 0.20 0.35 -0.67 0.00 0.00 178.83 179.24 2rcu h PHE 77 N 0.76 0.66 -0.93 2.96 3.57 -0.91 -0.84 116.94 122.20 2rcu h PHE 77 Ca 0.21 -0.04 0.04 0.00 3.53 0.00 0.00 57.97 61.70 2rcu h PHE 77 Cb -0.08 -0.20 -0.06 0.00 2.79 0.00 0.00 35.95 38.40 2rcu h PHE 77 CO -0.04 0.55 0.60 0.00 -2.23 0.00 0.00 178.31 177.20 2rcu h ARG 78 N 0.58 1.13 -0.28 1.11 3.08 -1.08 0.50 114.38 119.41 2rcu h ARG 78 Ca 0.15 -0.07 -0.02 0.00 0.07 0.00 0.00 59.98 60.11 2rcu h ARG 78 Cb 0.16 -0.25 -0.01 0.00 0.08 0.00 0.00 29.97 29.94 2rcu h ARG 78 CO -0.02 0.75 0.08 -0.09 -1.07 0.00 0.00 179.97 179.62 2rcu h ARG 79 N 1.16 0.45 -0.59 0.04 2.43 -0.91 -1.95 114.38 115.01 2rcu h ARG 79 Ca 0.38 -0.10 -0.04 0.00 -0.81 0.00 0.00 59.98 59.41 2rcu h ARG 79 Cb 0.03 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 29.49 2rcu h ARG 79 CO -0.13 0.52 0.23 1.15 -1.51 0.00 0.00 179.97 180.22 2rcu h THR 80 N 0.29 1.23 -0.42 0.20 2.02 -0.66 -1.89 112.91 113.69 2rcu h THR 80 Ca 0.09 -0.73 0.07 0.00 0.77 0.00 0.00 66.41 66.61 2rcu h THR 80 Cb 0.26 0.61 -0.06 0.00 -1.74 0.00 0.00 68.15 67.22 2rcu h THR 80 CO -0.00 0.28 0.04 -0.08 0.37 0.00 0.00 175.52 176.13 2rcu h GLU 81 N 0.82 0.15 -0.87 6.66 4.81 0.10 -0.27 114.58 125.97 2rcu h GLU 81 Ca 0.19 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.41 2rcu h GLU 81 Cb 0.22 -0.03 -0.04 0.00 0.63 0.00 0.00 28.75 29.52 2rcu h GLU 81 CO -0.01 0.10 0.54 0.00 -0.73 0.00 0.00 179.01 178.90 2rcu h ALA 82 N 1.34 1.30 -0.40 2.92 0.00 -1.07 -1.63 119.26 121.72 2rcu h ALA 82 Ca 0.21 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.97 2rcu h ALA 82 Cb 0.28 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 2rcu h ALA 82 CO -0.31 0.61 0.05 -0.07 0.00 0.00 0.00 179.25 179.53 2rcu h LEU 83 N 1.20 0.65 -0.64 0.00 3.38 -0.79 -2.48 115.31 116.64 2rcu h LEU 83 Ca 0.32 -0.27 0.02 0.00 0.09 0.00 0.00 57.88 58.03 2rcu h LEU 83 Cb -0.07 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 40.47 2rcu h LEU 83 CO -0.06 0.76 0.40 0.00 0.09 0.00 0.00 178.44 179.63 2rcu h LYS 85 N 0.80 0.10 -0.22 0.00 1.57 -1.24 0.07 116.57 117.66 2rcu h LYS 85 Ca 0.25 -0.01 -0.11 0.00 -1.87 0.00 0.00 60.65 58.92 2rcu h LYS 85 Cb -0.01 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.27 2rcu h LYS 85 CO -0.09 0.07 -0.33 -0.91 -0.57 0.00 0.00 179.45 177.62 2rcu h ASN 86 N 0.10 0.46 -0.17 0.86 2.35 -1.14 -2.89 115.58 115.15 2rcu h ASN 86 Ca 0.13 -0.18 -0.03 0.00 -0.55 0.00 0.00 56.30 55.67 2rcu h ASN 86 Cb 0.15 -0.13 -0.01 0.00 0.05 0.00 0.00 38.32 38.39 2rcu h ASN 86 CO -0.20 0.76 0.01 0.15 -1.65 0.00 0.00 177.43 176.50 2rcu h PHE 87 N 0.38 0.32 -0.54 1.19 3.57 -0.67 -0.44 116.94 120.75 2rcu h PHE 87 Ca 0.05 -0.05 -0.01 0.00 3.53 0.00 0.00 57.97 61.48 2rcu h PHE 87 Cb 0.76 -0.08 -0.03 0.00 2.79 0.00 0.00 35.95 39.39 2rcu h PHE 87 CO 0.02 0.50 0.28 1.49 -2.23 0.00 0.00 178.31 178.37 2rcu h GLU 88 N 0.05 0.74 -0.01 1.11 4.81 -0.89 -0.74 114.58 119.65 2rcu h GLU 88 Ca 0.05 -0.08 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 2rcu h GLU 88 Cb 0.36 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 29.59 2rcu h GLU 88 CO 0.01 0.56 -0.58 0.25 -0.73 0.00 0.00 179.01 178.52 2rcu n THR 89 N -4.39 0.00 0.00 0.32 -2.24 -1.10 -3.64 114.28 103.23 2rcu n THR 89 Ca 0.05 -0.10 0.00 0.00 -2.27 0.00 0.00 64.05 61.72 2rcu n THR 89 Cb 0.11 0.77 0.00 0.00 -2.10 0.00 0.00 70.33 69.11 2rcu n THR 89 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2rcu n GLY 90 N 1.44 1.70 0.27 3.38 0.00 -0.18 -4.81 105.19 106.99 2rcu n GLY 90 Ca 0.08 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.15 2rcu n GLY 90 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2rcu h VAL 91 N 0.00 1.09 -0.31 1.61 3.04 -1.74 -2.56 116.25 117.38 2rcu h VAL 91 Ca 0.00 -0.29 -0.02 0.00 -1.01 0.00 0.00 66.70 65.39 2rcu h VAL 91 Cb 0.00 0.87 -0.01 0.00 -2.01 0.00 0.00 31.29 30.13 2rcu h VAL 91 CO 0.00 0.11 0.13 1.23 -1.01 0.00 0.00 177.57 178.03 2rcu h GLY 92 N 0.41 0.49 0.18 3.17 0.00 -1.44 0.31 103.07 106.20 2rcu h GLY 92 Ca 0.07 -0.26 0.07 0.00 0.00 0.00 0.00 47.33 47.21 2rcu h GLY 92 CO -0.01 0.25 -0.16 1.70 0.00 0.00 0.00 176.54 178.33 2rcu h LYS 93 N 0.36 -0.10 -0.40 4.80 3.64 -1.19 0.12 116.57 123.80 2rcu h LYS 93 Ca 0.10 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.49 2rcu h LYS 93 Cb 0.17 0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 31.99 2rcu h LYS 93 CO -0.01 -0.07 0.23 0.93 -2.27 0.00 0.00 179.45 178.26 2rcu h GLU 94 N -0.10 0.56 -0.71 1.90 4.39 -1.37 -1.23 114.58 118.01 2rcu h GLU 94 Ca 0.17 -0.06 -0.04 0.00 0.34 0.00 0.00 59.36 59.77 2rcu h GLU 94 Cb 0.36 -0.11 -0.03 0.00 -0.10 0.00 0.00 28.75 28.87 2rcu h GLU 94 CO -0.40 0.44 0.26 -0.07 -1.16 0.00 0.00 179.01 178.08 2rcu h LEU 95 N 0.52 0.98 -0.41 1.33 3.38 -0.59 -2.42 115.31 118.11 2rcu h LEU 95 Ca 0.14 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 2rcu h LEU 95 Cb 0.03 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.51 2rcu h LEU 95 CO -0.02 0.88 0.17 -0.74 0.09 0.00 0.00 178.44 178.82 2rcu h HIS 96 N 1.03 0.62 -0.81 1.13 2.76 -0.50 0.68 115.15 120.07 2rcu h HIS 96 Ca 0.24 -0.04 0.09 0.00 -2.20 0.00 0.00 60.37 58.45 2rcu h HIS 96 Cb 0.23 -0.19 -0.07 0.00 1.55 0.00 0.00 27.41 28.93 2rcu h HIS 96 CO 0.02 0.54 0.47 0.00 -1.30 0.00 0.00 177.93 177.66 2rcu h ALA 97 N 1.01 1.14 -0.49 5.26 0.00 -1.15 -0.15 119.26 124.89 2rcu h ALA 97 Ca 0.14 0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.96 2rcu h ALA 97 Cb 0.18 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 2rcu h ALA 97 CO -0.01 0.12 -0.11 1.25 0.00 0.00 0.00 179.25 180.50 2rcu h HIS 98 N 0.81 1.05 -0.42 0.00 6.17 -0.96 -1.00 115.15 120.79 2rcu h HIS 98 Ca 0.38 -0.22 0.01 0.00 0.71 0.00 0.00 60.37 61.25 2rcu h HIS 98 Cb 0.31 -0.26 -0.03 0.00 2.52 0.00 0.00 27.41 29.96 2rcu h HIS 98 CO -0.06 1.01 0.26 1.25 0.71 0.00 0.00 177.93 181.10 2rcu h LEU 99 N 0.79 0.43 -0.25 0.26 5.85 -0.39 0.52 115.31 122.52 2rcu h LEU 99 Ca 0.12 -0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.83 2rcu h LEU 99 Cb 0.67 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.59 2rcu h LEU 99 CO 0.05 0.31 0.12 -0.07 -0.34 0.00 0.00 178.44 178.50 2rcu h LEU 100 N 0.53 0.34 -0.66 2.25 3.38 -0.89 -1.12 115.31 119.14 2rcu h LEU 100 Ca 0.16 -0.14 0.08 0.00 0.09 0.00 0.00 57.88 58.07 2rcu h LEU 100 Cb -0.02 -0.09 -0.06 0.00 0.09 0.00 0.00 40.66 40.58 2rcu h LEU 100 CO -0.06 0.38 0.33 0.00 0.09 0.00 0.00 178.44 179.18 2rcu h ALA 101 N 0.97 0.88 -0.54 1.53 0.00 -0.95 -2.06 119.26 119.09 2rcu h ALA 101 Ca 0.09 0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.93 2rcu h ALA 101 Cb 0.14 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 2rcu h ALA 101 CO -0.01 -0.04 -0.10 0.37 0.00 0.00 0.00 179.25 179.47 2rcu h GLN 102 N 0.59 1.03 -0.76 0.00 4.15 -0.74 -2.70 115.11 116.67 2rcu h GLN 102 Ca 0.31 -0.38 -0.03 0.00 0.77 0.00 0.00 58.65 59.32 2rcu h GLN 102 Cb 0.28 -0.07 -0.04 0.00 0.21 0.00 0.00 27.48 27.87 2rcu h GLN 102 CO -0.23 1.07 0.35 0.22 -1.93 0.00 0.00 178.83 178.30 2rcu h ASP 103 N 0.90 1.00 1.15 -0.69 3.58 -0.85 -2.33 116.42 119.19 2rcu h ASP 103 Ca 0.14 -0.12 0.00 0.00 0.42 0.00 0.00 57.03 57.47 2rcu h ASP 103 Cb 0.67 -0.26 0.00 0.00 1.72 0.00 0.00 39.33 41.46 2rcu h ASP 103 CO 0.05 0.86 0.00 0.11 -2.88 0.00 0.00 179.24 177.38 2rcu h LYS 104 N 1.09 0.00 -0.02 0.28 1.57 -1.19 -1.74 116.57 116.56 2rcu h LYS 104 Ca 0.26 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.04 2rcu h LYS 104 Cb 0.14 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.45 2rcu h LYS 104 CO -0.03 0.00 0.00 1.04 -0.57 0.00 0.00 179.45 179.89 2rcu n GLN 105 N -2.75 1.65 -2.92 3.15 6.02 -0.90 -4.40 117.38 117.21 2rcu n GLN 105 Ca 0.02 -0.94 -0.13 0.00 -0.01 0.00 0.00 57.00 55.94 2rcu n GLN 105 Cb 0.33 -1.48 0.01 0.00 1.02 0.00 0.00 30.24 30.12 2rcu n GLN 105 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2rcu n ASN 106 N 0.15 0.88 0.00 1.08 3.02 -0.67 -4.93 115.26 114.78 2rcu n ASN 106 Ca 0.19 -2.89 0.09 0.00 -0.03 0.00 0.00 54.58 51.94 2rcu n ASN 106 Cb 0.35 -0.43 0.48 0.00 -0.61 0.00 0.00 39.78 39.57 2rcu n ASN 106 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2rcu n LYS 107 N 0.11 0.33 0.00 3.52 5.02 -1.14 -2.74 118.16 123.25 2rcu n LYS 107 Ca 0.16 0.09 0.14 0.00 -2.02 0.00 0.00 58.31 56.68 2rcu n LYS 107 Cb 0.74 -1.50 0.52 0.00 -0.02 0.00 0.00 35.03 34.76 2rcu n LYS 107 CO 0.00 0.00 0.00 -2.39 -0.52 0.00 0.00 177.40 174.49 2rcu n HIS 108 N -1.22 0.00 -2.85 2.13 1.44 -1.26 -4.93 115.22 108.53 2rcu n HIS 108 Ca 0.10 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.81 2rcu n HIS 108 Cb 0.13 -0.25 0.00 0.00 0.12 0.00 0.00 29.99 29.99 2rcu n HIS 108 CO 0.00 0.00 0.00 -2.37 -2.81 0.00 0.00 176.34 171.16 2rcu n THR 109 N -1.14 0.00 -4.44 0.61 5.66 -1.11 -4.89 114.28 108.97 2rcu n THR 109 Ca 0.11 0.00 -0.22 0.00 -3.05 0.00 0.00 64.05 60.89 2rcu n THR 109 Cb 0.31 0.00 -0.10 0.00 -1.55 0.00 0.00 70.33 68.99 2rcu n THR 109 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 2rcu s SER 110 N 1.11 3.28 0.44 1.09 1.04 -1.26 -4.71 113.70 114.69 2rcu s SER 110 Ca 0.00 -1.05 0.30 0.00 0.48 0.00 0.00 55.95 55.68 2rcu s SER 110 Cb 0.00 -0.25 1.31 0.00 0.10 0.00 0.00 66.02 67.18 2rcu s SER 110 CO 0.00 -0.06 1.90 0.10 0.98 0.00 0.00 173.24 176.17 2rcu h TYR 111 N 2.33 0.00 0.00 5.02 -0.00 -1.90 -3.04 116.97 119.38 2rcu h TYR 111 Ca -0.40 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.33 2rcu h TYR 111 Cb 1.25 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.98 2rcu h TYR 111 CO 0.78 0.00 -1.09 1.51 -0.00 0.00 0.00 178.16 179.36 2rcu n ILE 112 N -2.72 0.00 -0.04 -0.90 0.13 -1.26 -4.64 119.36 109.93 2rcu n ILE 112 Ca 0.01 -0.22 -0.09 0.00 -1.10 0.00 0.00 62.75 61.35 2rcu n ILE 112 Cb 0.24 0.69 -0.03 0.00 -0.84 0.00 0.00 39.64 39.70 2rcu n ILE 112 CO 0.00 0.00 0.00 -1.28 2.80 0.00 0.00 176.55 178.07 2rcu h SER 113 N 0.00 -0.13 0.47 9.51 0.87 -1.84 0.90 113.55 123.32 2rcu h SER 113 Ca 0.00 0.05 -0.02 0.00 -1.23 0.00 0.00 61.79 60.59 2rcu h SER 113 Cb 0.49 0.10 0.00 0.00 -0.44 0.00 0.00 62.40 62.56 2rcu h SER 113 CO 0.00 -0.04 -0.23 1.23 -0.53 0.00 0.00 176.83 177.26 2rcu h GLY 114 N 0.03 -0.66 0.30 5.77 0.00 -1.82 -0.70 103.07 105.98 2rcu h GLY 114 Ca 0.09 0.25 0.17 0.00 0.00 0.00 0.00 47.33 47.84 2rcu h GLY 114 CO -0.18 -0.24 0.61 -2.55 0.00 0.00 0.00 176.54 174.18 2rcu h PRO 115 N -0.68 0.71 0.03 4.80 0.11 -1.79 -1.40 132.00 133.79 2rcu h PRO 115 Ca -0.06 -0.04 -0.28 0.00 0.11 0.00 0.00 66.00 65.73 2rcu h PRO 115 Cb 0.51 -0.16 0.02 0.00 0.11 0.00 0.00 31.00 31.48 2rcu h PRO 115 CO 0.11 0.47 -1.09 2.35 -0.21 0.00 0.00 178.00 179.62 2rcu h TRP 116 N 0.73 1.04 -0.97 0.65 2.91 -0.55 -0.25 115.95 119.51 2rcu h TRP 116 Ca 0.52 -0.59 0.03 0.00 1.13 0.00 0.00 58.89 59.98 2rcu h TRP 116 Cb 0.84 -0.11 -0.05 0.00 -0.51 0.00 0.00 29.16 29.33 2rcu h TRP 116 CO -0.00 1.43 0.64 0.74 -1.03 0.00 0.00 178.44 180.21 2rcu h PHE 117 N 0.36 1.21 -0.83 2.65 0.04 -0.97 -2.23 116.94 117.17 2rcu h PHE 117 Ca -0.15 0.03 0.03 0.00 2.80 0.00 0.00 57.97 60.68 2rcu h PHE 117 Cb 1.75 -0.40 -0.05 0.00 2.20 0.00 0.00 35.95 39.45 2rcu h PHE 117 CO 0.11 0.72 0.53 -0.44 -0.60 0.00 0.00 178.31 178.63 2rcu h ASP 118 N 1.27 0.89 -0.83 2.17 5.19 -1.00 -0.08 116.42 124.02 2rcu h ASP 118 Ca 0.38 -0.01 0.07 0.00 -0.62 0.00 0.00 57.03 56.85 2rcu h ASP 118 Cb -0.06 -0.20 -0.06 0.00 0.18 0.00 0.00 39.33 39.19 2rcu h ASP 118 CO -0.11 0.61 0.50 -0.03 -3.12 0.00 0.00 179.24 177.10 2rcu h MET 119 N 1.04 0.88 -0.02 3.56 4.05 -0.41 0.04 114.93 124.06 2rcu h MET 119 Ca 0.33 -0.05 -0.07 0.00 -0.28 0.00 0.00 59.70 59.63 2rcu h MET 119 Cb 0.00 -0.20 0.00 0.00 -0.80 0.00 0.00 31.60 30.61 2rcu h MET 119 CO -0.11 0.58 -0.25 1.88 0.23 0.00 0.00 176.91 179.24 2rcu h TYR 120 N 0.90 0.30 0.00 1.39 -1.99 -1.38 -3.31 116.97 112.89 2rcu h TYR 120 Ca 0.37 -0.15 -0.09 0.00 2.00 0.00 0.00 58.73 60.87 2rcu h TYR 120 Cb 0.22 -0.04 -0.01 0.00 2.00 0.00 0.00 36.73 38.89 2rcu h TYR 120 CO -0.04 0.90 -0.51 -0.07 -0.00 0.00 0.00 178.16 178.44 2rcu h LEU 121 N -0.39 0.00 0.00 3.88 3.38 -0.69 -2.93 115.31 118.56 2rcu h LEU 121 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 2rcu h LEU 121 Cb 0.95 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.70 2rcu h LEU 121 CO 0.05 0.42 -0.37 0.35 0.09 0.00 0.00 178.44 178.99 2rcu n THR 122 N -3.17 0.39 -1.81 0.22 -2.24 -0.03 -1.17 114.28 106.48 2rcu n THR 122 Ca 0.01 -0.24 -0.42 0.00 -2.27 0.00 0.00 64.05 61.13 2rcu n THR 122 Cb 0.71 -0.28 -0.03 0.00 -2.10 0.00 0.00 70.33 68.63 2rcu n THR 122 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2rcu s ALA 123 N -3.12 3.88 -0.49 6.98 0.00 -1.11 -4.81 121.76 123.08 2rcu s ALA 123 Ca 0.09 1.50 0.23 0.00 0.00 0.00 0.00 51.96 53.77 2rcu s ALA 123 Cb 0.14 -3.67 -0.05 0.00 0.00 0.00 0.00 23.12 19.54 2rcu s ALA 123 CO 0.67 -0.87 0.92 0.54 0.00 0.00 0.00 175.76 177.02 2rcu n ARG 124 N 3.97 0.37 -1.39 0.00 5.12 -1.26 -4.80 116.66 118.66 2rcu n ARG 124 Ca 0.15 -0.02 -0.31 0.00 -1.93 0.00 0.00 57.85 55.73 2rcu n ARG 124 Cb 0.36 -1.60 0.08 0.00 -1.16 0.00 0.00 32.46 30.14 2rcu n ARG 124 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 2rcu s ASP 125 N -4.13 4.78 0.21 0.55 1.01 -1.26 -0.10 116.67 117.72 2rcu s ASP 125 Ca 0.01 1.79 -0.31 0.00 0.71 0.00 0.00 52.55 54.76 2rcu s ASP 125 Cb 0.14 -2.52 -0.16 0.00 1.01 0.00 0.00 42.92 41.39 2rcu s ASP 125 CO 0.82 -1.85 0.99 -0.24 0.21 0.00 0.00 175.17 175.11 2rcu n SER 126 N -3.30 0.80 0.24 0.27 2.88 -1.26 -4.50 113.62 108.75 2rcu n SER 126 Ca 0.09 1.15 0.13 0.00 -1.33 0.00 0.00 58.87 58.92 2rcu n SER 126 Cb 0.53 -1.18 0.47 0.00 -0.75 0.00 0.00 64.21 63.28 2rcu n SER 126 CO 0.00 0.00 0.00 0.16 -1.23 0.00 0.00 175.04 173.97 2rcu h ILE 127 N 2.17 0.18 -3.32 2.46 3.07 -1.83 -3.37 117.51 116.87 2rcu h ILE 127 Ca -0.40 -0.87 -0.53 0.00 1.55 0.00 0.00 64.86 64.62 2rcu h ILE 127 Cb 1.36 1.74 0.02 0.00 -0.27 0.00 0.00 36.82 39.67 2rcu h ILE 127 CO 0.64 0.08 0.59 -0.69 -1.05 0.00 0.00 178.15 177.73 2rcu s VAL 128 N -3.52 3.63 0.00 0.16 1.01 -1.26 -1.33 120.40 119.10 2rcu s VAL 128 Ca 0.03 1.27 0.00 0.00 0.00 0.00 0.00 61.98 63.28 2rcu s VAL 128 Cb 0.08 -3.81 0.00 0.00 0.00 0.00 0.00 36.38 32.65 2rcu s VAL 128 CO 0.61 0.16 0.00 0.18 0.00 0.00 0.00 175.10 176.04 2rcu n LEU 129 N 3.15 0.00 -0.24 3.92 4.77 -1.26 -4.57 117.00 122.77 2rcu n LEU 129 Ca 0.07 0.00 0.17 0.00 -0.03 0.00 0.00 56.01 56.22 2rcu n LEU 129 Cb 0.45 0.00 0.48 0.00 -2.33 0.00 0.00 43.42 42.01 2rcu n LEU 129 CO 0.56 0.00 1.22 0.78 -1.33 0.00 0.00 177.39 178.62 2rcu h ASN 130 N 0.00 0.47 0.00 -1.43 -0.26 -1.73 -3.34 115.58 109.29 2rcu h ASN 130 Ca 0.00 0.04 0.00 0.00 -0.56 0.00 0.00 56.30 55.78 2rcu h ASN 130 Cb 0.00 -0.05 0.00 0.00 -1.06 0.00 0.00 38.32 37.21 2rcu h ASN 130 CO 0.00 0.20 -0.20 0.49 -1.06 0.00 0.00 177.43 176.86 2rcu n PHE 131 N -4.53 -0.59 -1.81 1.19 3.72 -1.00 -4.87 117.46 109.57 2rcu n PHE 131 Ca 0.19 0.10 -0.43 0.00 -0.05 0.00 0.00 57.45 57.26 2rcu n PHE 131 Cb 0.63 0.37 -0.03 0.00 -0.94 0.00 0.00 39.48 39.52 2rcu n PHE 131 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 176.76 175.91 2rcu s ASN 132 N -5.09 6.07 0.69 4.37 -0.87 -0.44 -4.72 114.94 114.95 2rcu s ASN 132 Ca 0.00 2.01 0.00 0.00 -1.57 0.00 0.00 52.86 53.31 2rcu s ASN 132 Cb 0.00 -2.52 0.11 0.00 -0.02 0.00 0.00 41.25 38.82 2rcu s ASN 132 CO 0.00 -1.45 0.95 -2.16 -2.57 0.00 0.00 177.10 171.87 2rcu s PRO 133 N 5.21 1.81 0.08 -0.60 0.05 -1.23 -4.44 135.00 135.90 2rcu s PRO 133 Ca 0.87 -1.13 0.02 0.00 0.05 0.00 0.00 61.00 60.81 2rcu s PRO 133 Cb -0.33 -2.37 -0.03 0.00 0.05 0.00 0.00 34.50 31.81 2rcu s PRO 133 CO 0.35 -1.33 -0.08 -0.59 0.05 0.00 0.00 177.00 175.41 2rcu s PHE 134 N -3.06 0.84 -0.06 0.56 -0.12 -0.66 -2.04 117.98 113.44 2rcu s PHE 134 Ca 0.65 -0.73 0.03 0.00 -0.05 0.00 0.00 56.93 56.83 2rcu s PHE 134 Cb -0.06 -0.49 0.01 0.00 -0.63 0.00 0.00 43.02 41.85 2rcu s PHE 134 CO 0.43 -0.10 -0.14 0.00 -0.05 0.00 0.00 175.22 175.36 2rcu s MET 135 N -2.87 1.80 -0.04 1.99 0.23 -0.29 -1.51 119.30 118.60 2rcu s MET 135 Ca 0.03 -0.50 -0.02 0.00 -1.03 0.00 0.00 55.69 54.17 2rcu s MET 135 Cb -0.01 -1.49 -0.04 0.00 -1.53 0.00 0.00 34.83 31.76 2rcu s MET 135 CO -0.02 0.10 0.09 0.00 -2.03 0.00 0.00 175.02 173.15 2rcu s ALA 136 N 0.46 3.62 0.40 3.16 0.00 0.83 -0.47 121.76 129.77 2rcu s ALA 136 Ca -0.12 -0.80 -0.22 0.00 0.00 0.00 0.00 51.96 50.82 2rcu s ALA 136 Cb -0.15 -1.67 -0.11 0.00 0.00 0.00 0.00 23.12 21.20 2rcu s ALA 136 CO 0.04 0.66 0.95 -0.06 0.00 0.00 0.00 175.76 177.34 2rcu s PHE 137 N -1.11 3.40 0.83 0.00 0.08 0.01 -0.67 117.98 120.52 2rcu s PHE 137 Ca 0.20 1.65 -0.11 0.00 0.12 0.00 0.00 56.93 58.79 2rcu s PHE 137 Cb -0.12 -2.86 0.09 0.00 -0.57 0.00 0.00 43.02 39.56 2rcu s PHE 137 CO 0.10 -0.03 1.12 -0.80 -0.10 0.00 0.00 175.22 175.52 2rcu s ASN 138 N -2.04 3.79 0.86 1.36 0.02 -0.16 -4.38 114.94 114.38 2rcu s ASN 138 Ca 0.59 2.03 -0.10 0.00 -1.02 0.00 0.00 52.86 54.36 2rcu s ASN 138 Cb -0.11 -2.55 0.11 0.00 0.02 0.00 0.00 41.25 38.72 2rcu s ASN 138 CO 0.16 -2.52 1.12 -2.16 0.02 0.00 0.00 177.10 173.72 2rcu s PRO 139 N -4.69 1.50 0.20 -0.60 0.04 -1.26 -4.93 135.00 125.26 2rcu s PRO 139 Ca 0.65 1.36 -0.31 0.00 0.04 0.00 0.00 61.00 62.74 2rcu s PRO 139 Cb -0.21 -1.80 -0.10 0.00 0.04 0.00 0.00 34.50 32.43 2rcu s PRO 139 CO 0.56 -2.24 1.56 0.34 0.04 0.00 0.00 177.00 177.25 2rcu s ASP 140 N -2.99 6.56 0.66 6.66 -1.08 -1.26 -4.87 116.67 120.35 2rcu s ASP 140 Ca 0.64 2.68 0.37 0.00 -0.52 0.00 0.00 52.55 55.72 2rcu s ASP 140 Cb -0.20 -2.60 2.01 0.00 -1.46 0.00 0.00 42.92 40.66 2rcu s ASP 140 CO 0.57 -0.82 2.16 -0.65 0.52 0.00 0.00 175.17 176.95 2rcu h PRO 141 N 6.21 0.00 -5.40 4.34 0.11 -1.95 -3.38 132.00 131.93 2rcu h PRO 141 Ca -0.44 0.00 -0.65 0.00 0.11 0.00 0.00 66.00 65.02 2rcu h PRO 141 Cb 1.21 0.00 -0.15 0.00 0.11 0.00 0.00 31.00 32.17 2rcu h PRO 141 CO 0.88 0.00 0.13 0.15 -0.21 0.00 0.00 178.00 178.95 2rcu s LYS 142 N -4.20 3.27 0.23 1.05 1.02 -1.26 -4.98 119.74 114.87 2rcu s LYS 142 Ca -0.04 -0.39 -0.15 0.00 0.02 0.00 0.00 55.97 55.41 2rcu s LYS 142 Cb 0.12 -3.96 0.27 0.00 -0.52 0.00 0.00 37.83 33.74 2rcu s LYS 142 CO 0.38 -1.03 1.57 0.77 -0.92 0.00 0.00 175.35 176.12 2rcu h SER 143 N 8.89 -1.15 0.94 2.83 0.02 -2.01 -1.93 113.55 121.16 2rcu h SER 143 Ca -0.25 0.27 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 2rcu h SER 143 Cb 1.09 0.64 0.00 0.00 0.14 0.00 0.00 62.40 64.27 2rcu h SER 143 CO 0.90 -0.29 0.00 -0.62 -1.14 0.00 0.00 176.83 175.68 2rcu n GLU 144 N -5.50 0.16 0.00 3.45 1.02 -1.26 -1.97 120.64 116.55 2rcu n GLU 144 Ca 0.10 0.29 0.11 0.00 -0.02 0.00 0.00 57.16 57.63 2rcu n GLU 144 Cb 0.41 -1.75 0.58 0.00 -0.02 0.00 0.00 31.44 30.65 2rcu n GLU 144 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2rcu n TYR 145 N -2.04 0.00 0.92 -0.32 4.02 -0.72 -2.99 117.16 116.02 2rcu n TYR 145 Ca 0.04 0.00 0.09 0.00 -0.01 0.00 0.00 57.90 58.02 2rcu n TYR 145 Cb 0.29 -0.24 0.27 0.00 -0.02 0.00 0.00 39.34 39.65 2rcu n TYR 145 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 2rcu n ASN 146 N -1.24 2.04 -4.66 7.72 3.02 -0.83 -3.88 115.26 117.43 2rcu n ASN 146 Ca 0.12 -1.86 -0.45 0.00 -0.03 0.00 0.00 54.58 52.35 2rcu n ASN 146 Cb 0.16 -0.19 -0.03 0.00 -0.61 0.00 0.00 39.78 39.11 2rcu n ASN 146 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 2rcu n ASP 147 N 0.58 2.68 0.00 6.41 2.03 -1.16 -2.44 116.55 124.64 2rcu n ASP 147 Ca 0.15 1.13 -0.09 0.00 0.52 0.00 0.00 54.79 56.50 2rcu n ASP 147 Cb 0.36 -1.41 -0.03 0.00 -0.72 0.00 0.00 41.12 39.32 2rcu n ASP 147 CO 0.00 0.00 0.00 -0.61 -1.92 0.00 0.00 177.20 174.67 2rcu h GLN 148 N 4.45 -0.12 -0.30 -0.67 4.15 -1.83 0.24 115.11 121.03 2rcu h GLN 148 Ca -0.45 0.01 -0.01 0.00 0.77 0.00 0.00 58.65 58.97 2rcu h GLN 148 Cb 1.28 0.03 -0.01 0.00 0.21 0.00 0.00 27.48 28.98 2rcu h GLN 148 CO 0.78 -0.08 0.13 1.25 -1.93 0.00 0.00 178.83 178.98 2rcu h LEU 149 N -0.13 0.40 -0.10 -2.39 5.85 -1.92 0.96 115.31 117.98 2rcu h LEU 149 Ca 0.08 -0.14 0.02 0.00 0.84 0.00 0.00 57.88 58.67 2rcu h LEU 149 Cb 0.24 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.15 2rcu h LEU 149 CO -0.19 0.43 0.00 0.74 -0.34 0.00 0.00 178.44 179.08 2rcu h THR 150 N 0.35 0.93 -0.07 1.05 2.02 -1.83 -1.79 112.91 113.57 2rcu h THR 150 Ca 0.10 -0.01 -0.19 0.00 0.77 0.00 0.00 66.41 67.08 2rcu h THR 150 Cb 0.15 0.89 -0.00 0.00 -1.74 0.00 0.00 68.15 67.44 2rcu h THR 150 CO -0.01 0.01 -0.75 -0.09 0.37 0.00 0.00 175.52 175.04 2rcu h ARG 151 N 0.04 0.41 -0.75 6.66 2.43 -0.37 -1.05 114.38 121.75 2rcu h ARG 151 Ca 0.05 -0.34 -0.02 0.00 -0.81 0.00 0.00 59.98 58.85 2rcu h ARG 151 Cb 0.05 0.08 -0.03 0.00 -0.42 0.00 0.00 29.97 29.64 2rcu h ARG 151 CO -0.08 0.99 0.38 0.00 -1.51 0.00 0.00 179.97 179.75 2rcu h ALA 152 N 0.91 0.97 0.07 2.80 0.00 -0.77 0.97 119.26 124.20 2rcu h ALA 152 Ca -0.04 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.73 2rcu h ALA 152 Cb 1.34 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.83 2rcu h ALA 152 CO 0.13 0.51 -0.03 1.15 0.00 0.00 0.00 179.25 181.01 2rcu h THR 153 N 1.05 1.07 -0.74 0.00 2.02 -1.20 -1.77 112.91 113.34 2rcu h THR 153 Ca 0.26 -0.46 -0.05 0.00 0.77 0.00 0.00 66.41 66.93 2rcu h THR 153 Cb 0.08 1.37 -0.03 0.00 -1.74 0.00 0.00 68.15 67.83 2rcu h THR 153 CO -0.04 0.12 0.26 0.78 0.37 0.00 0.00 175.52 177.01 2rcu h ASN 154 N -0.30 1.04 -0.37 4.18 2.35 -0.92 -0.40 115.58 121.16 2rcu h ASN 154 Ca -0.01 -0.17 -0.13 0.00 -0.55 0.00 0.00 56.30 55.44 2rcu h ASN 154 Cb 0.26 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.35 2rcu h ASN 154 CO 0.02 0.94 -0.28 -0.07 -1.65 0.00 0.00 177.43 176.39 2rcu h LEU 155 N 1.09 0.89 -0.22 1.61 3.38 -0.83 -1.62 115.31 119.61 2rcu h LEU 155 Ca 0.24 -0.44 0.00 0.00 0.09 0.00 0.00 57.88 57.78 2rcu h LEU 155 Cb 0.25 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 2rcu h LEU 155 CO -0.01 1.14 0.14 0.74 0.09 0.00 0.00 178.44 180.54 2rcu h THR 156 N 0.65 1.07 -0.75 0.22 2.02 -1.00 -1.16 112.91 113.96 2rcu h THR 156 Ca 0.07 -0.14 -0.06 0.00 0.77 0.00 0.00 66.41 67.05 2rcu h THR 156 Cb 0.85 0.77 -0.03 0.00 -1.74 0.00 0.00 68.15 68.00 2rcu h THR 156 CO 0.07 0.07 0.22 0.58 0.37 0.00 0.00 175.52 176.83 2rcu h VAL 157 N 0.29 1.26 -0.55 3.16 2.07 -1.02 -1.44 116.25 120.02 2rcu h VAL 157 Ca 0.08 -0.93 -0.04 0.00 0.82 0.00 0.00 66.70 66.63 2rcu h VAL 157 Cb -0.01 0.45 -0.02 0.00 -1.52 0.00 0.00 31.29 30.18 2rcu h VAL 157 CO -0.02 0.37 0.20 0.28 0.02 0.00 0.00 177.57 178.42 2rcu h SER 158 N 1.12 0.77 -0.85 0.57 0.02 -1.13 0.16 113.55 114.21 2rcu h SER 158 Ca 0.24 -0.18 0.01 0.00 -0.84 0.00 0.00 61.79 61.02 2rcu h SER 158 Cb 0.32 -0.20 -0.04 0.00 0.14 0.00 0.00 62.40 62.62 2rcu h SER 158 CO -0.01 0.74 0.56 0.00 -1.14 0.00 0.00 176.83 176.99 2rcu h ALA 159 N 1.06 1.40 -0.04 3.77 0.00 -0.91 0.15 119.26 124.70 2rcu h ALA 159 Ca 0.18 -0.06 -0.19 0.00 0.00 0.00 0.00 54.91 54.85 2rcu h ALA 159 Cb 0.23 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 2rcu h ALA 159 CO -0.01 0.55 -0.78 0.28 0.00 0.00 0.00 179.25 179.29 2rcu h VAL 160 N 1.14 1.43 -0.79 0.00 2.07 -0.81 -1.96 116.25 117.32 2rcu h VAL 160 Ca 0.31 -2.32 -0.01 0.00 0.82 0.00 0.00 66.70 65.51 2rcu h VAL 160 Cb -0.12 2.25 -0.04 0.00 -1.52 0.00 0.00 31.29 31.87 2rcu h VAL 160 CO -0.07 0.69 0.45 0.03 0.02 0.00 0.00 177.57 178.69 2rcu h ARG 161 N 0.19 1.09 -0.29 1.57 3.08 0.07 -1.56 114.38 118.52 2rcu h ARG 161 Ca -0.04 -0.11 0.03 0.00 0.07 0.00 0.00 59.98 59.93 2rcu h ARG 161 Cb 1.37 -0.22 -0.03 0.00 0.08 0.00 0.00 29.97 31.17 2rcu h ARG 161 CO 0.13 0.79 0.09 0.35 -1.07 0.00 0.00 179.97 180.25 2rcu h PHE 162 N 1.09 0.17 -0.52 3.04 3.57 -0.53 -0.53 116.94 123.22 2rcu h PHE 162 Ca 0.28 0.01 0.09 0.00 3.53 0.00 0.00 57.97 61.88 2rcu h PHE 162 Cb -0.00 -0.03 -0.07 0.00 2.79 0.00 0.00 35.95 38.64 2rcu h PHE 162 CO -0.00 0.07 0.13 1.25 -2.23 0.00 0.00 178.31 177.53 2rcu h LEU 163 N 0.22 0.06 -0.64 0.59 6.46 -0.88 -0.74 115.31 120.38 2rcu h LEU 163 Ca 0.13 0.09 -0.11 0.00 -0.12 0.00 0.00 57.88 57.87 2rcu h LEU 163 Cb 0.10 0.11 -0.02 0.00 -0.73 0.00 0.00 40.66 40.12 2rcu h LEU 163 CO -0.14 0.05 -0.09 0.11 -0.62 0.00 0.00 178.44 177.76 2rcu h LYS 164 N 0.28 0.98 -0.34 1.25 1.57 -0.96 -1.43 116.57 117.92 2rcu h LYS 164 Ca 0.26 -0.34 -0.04 0.00 -1.87 0.00 0.00 60.65 58.66 2rcu h LYS 164 Cb 0.35 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.57 2rcu h LYS 164 CO -0.32 1.01 0.07 1.15 -0.57 0.00 0.00 179.45 180.79 2rcu h THR 165 N 0.88 1.23 -0.27 -0.16 2.02 -0.61 0.22 112.91 116.22 2rcu h THR 165 Ca 0.14 -0.80 0.01 0.00 0.77 0.00 0.00 66.41 66.54 2rcu h THR 165 Cb 0.63 1.10 -0.02 0.00 -1.74 0.00 0.00 68.15 68.13 2rcu h THR 165 CO 0.04 0.27 0.16 0.25 0.37 0.00 0.00 175.52 176.61 2rcu h LEU 166 N 0.39 0.26 -1.28 2.58 5.85 -1.04 -1.01 115.31 121.06 2rcu h LEU 166 Ca 0.10 0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.75 2rcu h LEU 166 Cb 0.33 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.30 2rcu h LEU 166 CO 0.00 0.19 -0.36 1.56 -0.34 0.00 0.00 178.44 179.49 2rcu h GLN 167 N 0.32 0.00 0.00 1.25 4.20 -0.96 -1.44 115.11 118.48 2rcu h GLN 167 Ca 0.11 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.82 2rcu h GLN 167 Cb -0.00 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.78 2rcu h GLN 167 CO -0.05 0.36 0.00 0.00 -0.67 0.00 0.00 178.83 178.47 2rcu n ALA 168 N -2.45 2.17 -1.22 3.87 0.00 0.04 -4.90 120.51 118.02 2rcu n ALA 168 Ca -0.02 -0.06 -0.08 0.00 0.00 0.00 0.00 53.44 53.29 2rcu n ALA 168 Cb 0.40 -1.43 -0.03 0.00 0.00 0.00 0.00 19.45 18.39 2rcu n ALA 168 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2rcu n GLY 169 N 1.12 0.95 0.25 0.00 0.00 -0.54 -4.93 105.19 102.04 2rcu n GLY 169 Ca 0.06 -0.61 0.12 0.00 0.00 0.00 0.00 46.02 45.59 2rcu n GLY 169 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2rcu n LEU 170 N -0.86 1.19 -4.72 0.99 4.77 -0.41 -1.86 117.00 116.10 2rcu n LEU 170 Ca -0.08 -0.36 -0.41 0.00 -0.03 0.00 0.00 56.01 55.13 2rcu n LEU 170 Cb 0.26 -0.10 -0.04 0.00 -2.33 0.00 0.00 43.42 41.21 2rcu n LEU 170 CO 0.11 0.23 0.73 -0.22 -1.33 0.00 0.00 177.39 176.92 2rcu s LEU 171 N -2.61 4.45 0.34 2.23 2.96 -1.10 -0.59 118.68 124.36 2rcu s LEU 171 Ca 0.20 1.87 -0.28 0.00 -0.22 0.00 0.00 54.13 55.69 2rcu s LEU 171 Cb 0.18 -3.59 -0.10 0.00 0.50 0.00 0.00 46.19 43.18 2rcu s LEU 171 CO 0.59 -0.21 1.35 -1.61 -1.32 0.00 0.00 176.35 175.15 2rcu s GLU 172 N 0.29 4.28 0.50 1.98 2.02 -1.26 -3.56 118.70 122.94 2rcu s GLU 172 Ca 0.50 2.29 -0.23 0.00 0.02 0.00 0.00 54.97 57.56 2rcu s GLU 172 Cb -0.25 -3.03 -0.08 0.00 0.10 0.00 0.00 34.13 30.87 2rcu s GLU 172 CO 0.31 -0.28 1.16 -2.30 0.02 0.00 0.00 175.26 174.17 2rcu n PRO 173 N 0.69 1.50 -2.31 0.39 -0.02 -1.26 -4.92 135.00 129.08 2rcu n PRO 173 Ca 0.00 0.55 -0.43 0.00 -2.02 0.00 0.00 63.50 61.61 2rcu n PRO 173 Cb 0.41 -2.31 -0.02 0.00 -0.02 0.00 0.00 33.50 31.56 2rcu n PRO 173 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 2rcu s GLU 174 N -2.46 4.25 -0.03 -0.52 2.56 -1.26 -5.01 118.70 116.22 2rcu s GLU 174 Ca 0.68 1.82 -0.01 0.00 0.00 0.00 0.00 54.97 57.46 2rcu s GLU 174 Cb -0.47 -3.75 0.03 0.00 2.00 0.00 0.00 34.13 31.94 2rcu s GLU 174 CO 0.53 -0.67 0.05 0.08 -0.56 0.00 0.00 175.26 174.69 2rcu s VAL 175 N 3.23 -0.07 -0.13 3.70 1.01 -1.26 -1.11 120.40 125.77 2rcu s VAL 175 Ca 0.60 0.25 -0.24 0.00 0.00 0.00 0.00 61.98 62.59 2rcu s VAL 175 Cb -0.26 -0.12 -0.02 0.00 0.00 0.00 0.00 36.38 35.97 2rcu s VAL 175 CO 0.21 0.10 0.75 0.12 0.00 0.00 0.00 175.10 176.28 2rcu s PHE 176 N 1.29 3.48 -0.16 5.22 5.36 -0.28 -4.88 117.98 128.01 2rcu s PHE 176 Ca -0.07 1.21 -0.03 0.00 -0.96 0.00 0.00 56.93 57.09 2rcu s PHE 176 Cb -0.13 -2.90 -0.02 0.00 -0.34 0.00 0.00 43.02 39.63 2rcu s PHE 176 CO -0.04 -0.10 -0.06 -1.01 -1.46 0.00 0.00 175.22 172.56 2rcu s HIS 177 N 1.57 2.96 0.34 10.12 3.76 -1.26 0.51 115.29 133.29 2rcu s HIS 177 Ca 0.37 -0.50 0.22 0.00 -0.15 0.00 0.00 55.06 55.00 2rcu s HIS 177 Cb -0.17 -1.96 1.08 0.00 1.11 0.00 0.00 32.58 32.64 2rcu s HIS 177 CO 0.15 -0.18 1.93 -0.07 -0.85 0.00 0.00 174.74 175.72 2rcu h LEU 178 N 6.99 0.00 -6.33 0.89 3.38 -1.71 -3.38 115.31 115.14 2rcu h LEU 178 Ca -0.32 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 57.33 2rcu h LEU 178 Cb 1.19 0.00 -0.30 0.00 0.09 0.00 0.00 40.66 41.64 2rcu h LEU 178 CO 0.60 0.23 -0.65 0.21 0.09 0.00 0.00 178.44 178.92 2rcu s ASN 179 N -6.42 0.92 0.58 -0.43 2.47 -1.26 -5.02 114.94 105.79 2rcu s ASN 179 Ca -0.02 -1.37 0.28 0.00 0.42 0.00 0.00 52.86 52.17 2rcu s ASN 179 Cb 0.13 0.71 1.51 0.00 -1.45 0.00 0.00 41.25 42.15 2rcu s ASN 179 CO 0.64 -0.27 1.95 -0.65 -3.72 0.00 0.00 177.10 175.06 2rcu h PRO 180 N 7.22 0.00 -0.72 0.43 0.11 -1.96 -1.20 132.00 135.88 2rcu h PRO 180 Ca 0.03 0.00 0.03 0.00 0.11 0.00 0.00 66.00 66.16 2rcu h PRO 180 Cb 1.07 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.14 2rcu h PRO 180 CO 0.21 0.00 0.47 0.77 -0.21 0.00 0.00 178.00 179.24 2rcu h SER 181 N 0.00 0.77 0.07 -2.05 0.02 -1.95 -1.39 113.55 109.03 2rcu h SER 181 Ca 0.19 -0.01 -0.35 0.00 -0.84 0.00 0.00 61.79 60.78 2rcu h SER 181 Cb 1.02 -0.18 -0.03 0.00 0.14 0.00 0.00 62.40 63.35 2rcu h SER 181 CO -0.00 0.54 -1.98 1.17 -1.14 0.00 0.00 176.83 175.41 2rcu n LYS 182 N -4.45 0.70 -0.03 3.45 4.81 -0.49 -4.76 118.16 117.39 2rcu n LYS 182 Ca 0.09 0.30 0.02 0.00 -0.87 0.00 0.00 58.31 57.84 2rcu n LYS 182 Cb 0.10 -1.67 -0.12 0.00 0.02 0.00 0.00 35.03 33.36 2rcu n LYS 182 CO 0.00 0.00 0.00 -1.13 1.17 0.00 0.00 177.40 177.44 2rcu n SER 183 N -3.67 1.45 -3.72 3.14 3.41 -1.02 -4.57 113.62 108.65 2rcu n SER 183 Ca -0.36 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 57.84 2rcu n SER 183 Cb 0.96 1.35 0.00 0.00 -0.26 0.00 0.00 64.21 66.27 2rcu n SER 183 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2rcu n ASP 184 N -2.25 6.47 -4.11 4.04 2.03 -0.53 -4.74 116.55 117.48 2rcu n ASP 184 Ca -0.11 -3.19 -0.11 0.00 0.52 0.00 0.00 54.79 51.90 2rcu n ASP 184 Cb 0.64 -1.39 -0.11 0.00 -0.72 0.00 0.00 41.12 39.54 2rcu n ASP 184 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 2rcu s THR 185 N -0.80 0.53 0.41 5.18 -4.23 -1.26 -4.83 115.64 110.63 2rcu s THR 185 Ca 0.44 -1.56 0.11 0.00 -1.18 0.00 0.00 61.69 59.50 2rcu s THR 185 Cb 0.13 -1.20 0.16 0.00 1.34 0.00 0.00 72.50 72.93 2rcu s THR 185 CO -0.03 -0.71 1.94 0.44 -0.54 0.00 0.00 174.62 175.72 2rcu h ASP 186 N 3.61 0.13 -0.20 3.99 3.32 -1.97 -1.08 116.42 124.23 2rcu h ASP 186 Ca -0.35 -0.03 0.03 0.00 0.02 0.00 0.00 57.03 56.70 2rcu h ASP 186 Cb 1.18 -0.04 -0.03 0.00 0.22 0.00 0.00 39.33 40.67 2rcu h ASP 186 CO 0.55 0.31 0.04 0.00 -1.72 0.00 0.00 179.24 178.43 2rcu h ALA 187 N 1.71 0.21 -0.20 3.45 0.00 -1.96 0.21 119.26 122.67 2rcu h ALA 187 Ca 0.03 0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.89 2rcu h ALA 187 Cb 0.37 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 2rcu h ALA 187 CO 0.02 -0.39 -0.19 0.35 0.00 0.00 0.00 179.25 179.04 2rcu h PHE 188 N 0.12 0.57 -0.79 0.00 3.57 -1.79 -3.16 116.94 115.46 2rcu h PHE 188 Ca 0.09 -0.17 0.11 0.00 3.53 0.00 0.00 57.97 61.53 2rcu h PHE 188 Cb 0.08 -0.12 -0.08 0.00 2.79 0.00 0.00 35.95 38.63 2rcu h PHE 188 CO -0.14 0.83 0.42 0.87 -2.23 0.00 0.00 178.31 178.06 2rcu h LYS 189 N 0.15 0.65 -0.97 1.11 1.57 -1.02 -0.71 116.57 117.34 2rcu h LYS 189 Ca 0.03 -0.04 0.18 0.00 -1.87 0.00 0.00 60.65 58.96 2rcu h LYS 189 Cb 0.74 -0.15 -0.09 0.00 0.08 0.00 0.00 32.23 32.81 2rcu h LYS 189 CO 0.05 0.43 0.61 0.00 -0.57 0.00 0.00 179.45 179.97 2rcu h ARG 190 N 0.67 0.67 0.09 3.15 3.08 -0.56 -2.85 114.38 118.63 2rcu h ARG 190 Ca 0.40 -0.04 -0.27 0.00 0.07 0.00 0.00 59.98 60.14 2rcu h ARG 190 Cb 0.45 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.34 2rcu h ARG 190 CO -0.29 0.44 -1.40 -0.07 -1.07 0.00 0.00 179.97 177.58 2rcu h LEU 191 N 0.69 0.30 -1.70 3.04 3.38 -1.29 -3.39 115.31 116.34 2rcu h LEU 191 Ca 0.53 -0.81 -0.03 0.00 0.09 0.00 0.00 57.88 57.66 2rcu h LEU 191 Cb 0.92 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.57 2rcu h LEU 191 CO -0.30 1.60 -0.17 -0.29 0.09 0.00 0.00 178.44 179.37 2rcu h ILE 192 N -0.42 0.66 0.00 1.22 6.09 -1.07 -1.40 117.51 122.59 2rcu h ILE 192 Ca -0.32 -0.71 -0.00 0.00 -1.37 0.00 0.00 64.86 62.46 2rcu h ILE 192 Cb 1.68 1.45 -0.00 0.00 0.47 0.00 0.00 36.82 40.42 2rcu h ILE 192 CO 0.01 0.16 -0.00 0.08 -3.07 0.00 0.00 178.15 175.33 2rcu h ARG 193 N 0.00 0.00 0.00 2.19 -0.00 -1.69 -2.06 114.38 112.82 2rcu h ARG 193 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.98 59.98 2rcu h ARG 193 Cb 0.44 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 30.41 2rcu h ARG 193 CO 0.02 0.00 -0.69 0.74 -0.00 0.00 0.00 179.97 180.05 2rcu h PHE 194 N 0.00 0.00 -3.22 4.08 0.04 -1.48 -3.46 116.94 112.91 2rcu h PHE 194 Ca -0.00 0.00 -0.55 0.00 2.80 0.00 0.00 57.97 60.22 2rcu h PHE 194 Cb 0.23 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.35 2rcu h PHE 194 CO 0.00 0.00 0.59 0.08 -0.60 0.00 0.00 178.31 178.38 2rcu s VAL 195 N -3.21 4.61 0.47 -0.55 1.01 -0.78 -5.00 120.40 116.94 2rcu s VAL 195 Ca 0.05 1.89 -0.24 0.00 0.00 0.00 0.00 61.98 63.67 2rcu s VAL 195 Cb 0.12 -4.21 -0.08 0.00 0.00 0.00 0.00 36.38 32.21 2rcu s VAL 195 CO 0.73 0.02 1.32 -0.81 0.00 0.00 0.00 175.10 176.36 2rcu n PRO 196 N 4.94 1.91 0.08 2.72 -0.04 -1.26 -4.54 135.00 138.81 2rcu n PRO 196 Ca 0.09 0.69 0.20 0.00 -0.04 0.00 0.00 63.50 64.44 2rcu n PRO 196 Cb 0.48 -2.49 0.69 0.00 -0.04 0.00 0.00 33.50 32.14 2rcu n PRO 196 CO 0.00 0.00 0.00 -1.35 -0.04 0.00 0.00 175.50 174.11 2rcu h PRO 197 N 1.91 0.00 0.00 0.54 0.11 -1.95 0.21 132.00 132.82 2rcu h PRO 197 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2rcu h PRO 197 Cb 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 2rcu h PRO 197 CO 0.59 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 179.04 2rcu h SER 198 N 0.00 0.00 0.00 -2.05 4.64 -1.89 -3.18 113.55 111.06 2rcu h SER 198 Ca 0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.53 2rcu h SER 198 Cb 1.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.43 2rcu h SER 198 CO -0.00 0.00 -0.06 0.18 -0.87 0.00 0.00 176.83 176.08 2rcu n LEU 199 N -2.83 0.00 -0.22 5.97 4.77 0.57 -4.72 117.00 120.54 2rcu n LEU 199 Ca 0.00 -0.39 -0.00 0.00 -0.03 0.00 0.00 56.01 55.59 2rcu n LEU 199 Cb 0.24 0.00 0.11 0.00 -2.33 0.00 0.00 43.42 41.44 2rcu n LEU 199 CO 0.24 0.00 1.03 0.77 -1.33 0.00 0.00 177.39 178.10 2rcu h SER 200 N 0.00 0.37 -0.95 -1.43 4.64 -1.13 -2.08 113.55 112.97 2rcu h SER 200 Ca 0.00 0.06 0.20 0.00 -0.47 0.00 0.00 61.79 61.58 2rcu h SER 200 Cb 0.00 -0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 62.01 2rcu h SER 200 CO 0.00 0.23 0.61 -0.25 -0.87 0.00 0.00 176.83 176.55 2rcu h TRP 201 N 0.53 0.74 -0.23 4.77 7.01 -1.83 -0.98 115.95 125.96 2rcu h TRP 201 Ca 0.31 0.02 -0.13 0.00 2.11 0.00 0.00 58.89 61.21 2rcu h TRP 201 Cb 0.32 -0.22 -0.01 0.00 -2.10 0.00 0.00 29.16 27.14 2rcu h TRP 201 CO -0.12 0.19 -0.40 1.88 -2.79 0.00 0.00 178.44 177.20 2rcu h TYR 202 N 0.54 0.62 -0.44 2.65 0.05 -1.69 -0.16 116.97 118.54 2rcu h TYR 202 Ca 0.51 -0.17 -0.01 0.00 0.05 0.00 0.00 58.73 59.11 2rcu h TYR 202 Cb 1.07 -0.13 -0.02 0.00 1.01 0.00 0.00 36.73 38.66 2rcu h TYR 202 CO -0.00 0.84 0.24 0.78 -1.05 0.00 0.00 178.16 178.97 2rcu h GLY 203 N 1.08 0.65 0.91 3.88 0.00 -1.19 -0.76 103.07 107.64 2rcu h GLY 203 Ca 0.04 -0.29 -0.00 0.00 0.00 0.00 0.00 47.33 47.08 2rcu h GLY 203 CO 0.08 0.28 0.02 0.00 0.00 0.00 0.00 176.54 176.91 2rcu h ALA 204 N 1.09 0.05 -0.74 3.60 0.00 -1.30 -3.17 119.26 118.80 2rcu h ALA 204 Ca 0.15 -0.05 0.13 0.00 0.00 0.00 0.00 54.91 55.14 2rcu h ALA 204 Cb 0.04 -0.02 -0.09 0.00 0.00 0.00 0.00 17.79 17.73 2rcu h ALA 204 CO -0.03 -0.41 0.31 -0.92 0.00 0.00 0.00 179.25 178.21 2rcu h TYR 205 N -0.03 0.55 0.00 0.00 5.03 -0.74 -0.22 116.97 121.55 2rcu h TYR 205 Ca 0.01 0.03 -0.01 0.00 2.58 0.00 0.00 58.73 61.35 2rcu h TYR 205 Cb 0.09 -0.13 -0.00 0.00 1.55 0.00 0.00 36.73 38.24 2rcu h TYR 205 CO -0.04 0.11 -0.04 -0.07 -1.32 0.00 0.00 178.16 176.80 2rcu h LEU 206 N 0.49 0.00 -3.41 2.82 4.07 -1.11 -0.29 115.31 117.87 2rcu h LEU 206 Ca 0.39 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.35 2rcu h LEU 206 Cb 0.54 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.28 2rcu h LEU 206 CO -0.36 0.04 0.00 1.33 -1.08 0.00 0.00 178.44 178.37 2rcu n VAL 207 N -3.37 2.47 -3.27 1.22 0.24 -0.22 -4.95 118.33 110.43 2rcu n VAL 207 Ca -0.02 -1.50 -0.17 0.00 -2.04 0.00 0.00 64.34 60.61 2rcu n VAL 207 Cb 0.18 -0.19 0.06 0.00 -1.47 0.00 0.00 33.84 32.42 2rcu n VAL 207 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 2rcu n ASN 208 N 0.38 -4.73 -4.22 -1.34 4.13 -0.12 -4.71 115.26 104.65 2rcu n ASN 208 Ca 0.25 -0.41 -0.24 0.00 1.68 0.00 0.00 54.58 55.86 2rcu n ASN 208 Cb 1.05 -3.89 -0.14 0.00 -1.54 0.00 0.00 39.78 35.27 2rcu n ASN 208 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2rcu s ALA 209 N -3.24 1.61 -0.41 5.41 0.00 -0.43 -1.86 121.76 122.83 2rcu s ALA 209 Ca 0.36 -1.01 0.02 0.00 0.00 0.00 0.00 51.96 51.33 2rcu s ALA 209 Cb -0.16 -0.30 0.14 0.00 0.00 0.00 0.00 23.12 22.80 2rcu s ALA 209 CO 0.54 0.35 0.24 0.71 0.00 0.00 0.00 175.76 177.60 2rcu s TYR 210 N -0.83 1.53 0.40 0.00 2.02 0.18 -2.55 117.35 118.10 2rcu s TYR 210 Ca 0.06 -2.16 -0.25 0.00 -0.37 0.00 0.00 57.07 54.34 2rcu s TYR 210 Cb -0.09 -1.51 -0.11 0.00 -0.40 0.00 0.00 41.96 39.86 2rcu s TYR 210 CO 0.02 -0.80 1.10 -2.30 -1.57 0.00 0.00 175.55 172.00 2rcu n PRO 211 N 3.63 1.56 -4.18 -1.71 -0.02 -1.26 -1.12 135.00 131.90 2rcu n PRO 211 Ca 0.11 0.56 -0.23 0.00 -2.02 0.00 0.00 63.50 61.92 2rcu n PRO 211 Cb 0.36 -2.12 -0.06 0.00 -0.02 0.00 0.00 33.50 31.66 2rcu n PRO 211 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2rcu s LEU 212 N -0.71 3.55 0.42 2.45 1.43 -0.27 -4.63 118.68 120.92 2rcu s LEU 212 Ca 0.61 -0.39 -0.26 0.00 -1.03 0.00 0.00 54.13 53.06 2rcu s LEU 212 Cb -0.57 -2.10 -0.09 0.00 0.03 0.00 0.00 46.19 43.46 2rcu s LEU 212 CO 0.58 -0.00 1.44 -0.62 0.23 0.00 0.00 176.35 177.97 2rcu s ASP 213 N -3.63 6.09 -0.04 2.29 2.15 0.15 -4.77 116.67 118.91 2rcu s ASP 213 Ca 0.32 2.94 0.06 0.00 0.43 0.00 0.00 52.55 56.29 2rcu s ASP 213 Cb -0.08 -2.66 0.09 0.00 -0.30 0.00 0.00 42.92 39.97 2rcu s ASP 213 CO 0.22 -1.03 1.04 0.23 -0.17 0.00 0.00 175.17 175.46 2rcu n MET 214 N 0.08 0.38 0.29 4.34 2.81 -1.26 -4.85 117.12 118.91 2rcu n MET 214 Ca 0.03 -1.47 0.16 0.00 -1.81 0.00 0.00 57.70 54.61 2rcu n MET 214 Cb 0.41 -0.80 0.88 0.00 -0.71 0.00 0.00 33.22 33.00 2rcu n MET 214 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 2rcu h SER 215 N 0.00 0.00 1.22 7.83 4.64 -1.99 -2.43 113.55 122.83 2rcu h SER 215 Ca 0.00 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.29 2rcu h SER 215 Cb 1.28 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.37 2rcu h SER 215 CO 0.00 0.05 -0.12 1.56 -0.87 0.00 0.00 176.83 177.45 2rcu h GLN 216 N 0.00 0.00 0.00 4.77 4.20 -1.88 -3.21 115.11 118.99 2rcu h GLN 216 Ca -0.00 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.70 2rcu h GLN 216 Cb 0.19 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.97 2rcu h GLN 216 CO 0.01 0.12 -0.05 1.88 -0.67 0.00 0.00 178.83 180.13 2rcu h TYR 217 N 0.00 0.00 0.00 2.96 -1.99 -1.80 0.08 116.97 116.22 2rcu h TYR 217 Ca -0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 2rcu h TYR 217 Cb 0.77 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.50 2rcu h TYR 217 CO 0.00 0.05 0.00 0.34 -0.00 0.00 0.00 178.16 178.55 2rcu n PHE 218 N -3.71 0.45 0.14 4.88 7.35 -1.21 -2.34 117.46 123.02 2rcu n PHE 218 Ca -0.03 0.21 0.04 0.00 -0.76 0.00 0.00 57.45 56.92 2rcu n PHE 218 Cb 0.14 -0.84 0.06 0.00 0.35 0.00 0.00 39.48 39.20 2rcu n PHE 218 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 2rcu n ARG 219 N -1.94 1.27 -0.27 -4.13 1.74 0.01 -4.60 116.66 108.73 2rcu n ARG 219 Ca 0.01 -1.35 -0.06 0.00 -0.77 0.00 0.00 57.85 55.68 2rcu n ARG 219 Cb 0.09 -1.17 0.06 0.00 -1.02 0.00 0.00 32.46 30.42 2rcu n ARG 219 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 2rcu h LEU 220 N 1.51 0.96 -8.85 0.55 3.38 -1.49 -3.43 115.31 107.94 2rcu h LEU 220 Ca 0.00 -0.12 -0.54 0.00 0.09 0.00 0.00 57.88 57.31 2rcu h LEU 220 Cb 0.47 -0.25 -0.18 0.00 0.09 0.00 0.00 40.66 40.79 2rcu h LEU 220 CO 0.00 0.81 -0.79 -0.36 0.09 0.00 0.00 178.44 178.19 2rcu s PHE 221 N -5.74 1.89 -1.72 1.13 0.08 -1.26 -4.59 117.98 107.76 2rcu s PHE 221 Ca -0.13 -0.45 -0.00 0.00 0.12 0.00 0.00 56.93 56.47 2rcu s PHE 221 Cb 0.15 -0.94 0.00 0.00 -0.57 0.00 0.00 43.02 41.66 2rcu s PHE 221 CO 0.81 0.35 0.05 0.09 -0.10 0.00 0.00 175.22 176.42 2rcu n ASN 222 N 0.31 -5.81 -3.99 1.36 4.13 -0.54 -4.81 115.26 105.91 2rcu n ASN 222 Ca -0.13 -0.03 -0.10 0.00 1.68 0.00 0.00 54.58 56.00 2rcu n ASN 222 Cb 0.57 -4.83 -0.11 0.00 -1.54 0.00 0.00 39.78 33.86 2rcu n ASN 222 CO 0.00 0.00 0.00 -0.44 0.28 0.00 0.00 177.26 177.10 2rcu s SER 223 N -2.10 0.37 0.24 6.41 0.01 -1.25 -0.93 113.70 116.44 2rcu s SER 223 Ca 0.03 -0.45 -0.17 0.00 1.31 0.00 0.00 55.95 56.66 2rcu s SER 223 Cb -0.01 0.07 0.02 0.00 0.21 0.00 0.00 66.02 66.31 2rcu s SER 223 CO 0.03 -0.24 0.58 0.28 0.41 0.00 0.00 173.24 174.31 2rcu s THR 224 N -1.26 0.01 -0.23 1.44 -1.32 -0.33 -1.15 115.64 112.79 2rcu s THR 224 Ca -0.13 -1.03 -0.07 0.00 -1.21 0.00 0.00 61.69 59.25 2rcu s THR 224 Cb -0.09 -1.91 -0.03 0.00 -1.51 0.00 0.00 72.50 68.96 2rcu s THR 224 CO -0.01 -0.04 0.06 -0.60 -2.21 0.00 0.00 174.62 171.83 2rcu s ARG 225 N -3.93 3.68 -0.24 7.08 3.52 -0.68 -1.01 118.95 127.37 2rcu s ARG 225 Ca 0.14 -0.47 -0.10 0.00 -0.13 0.00 0.00 55.73 55.16 2rcu s ARG 225 Cb -0.03 -3.27 -0.05 0.00 -1.56 0.00 0.00 34.95 30.04 2rcu s ARG 225 CO 0.04 -0.11 0.14 0.42 -0.81 0.00 0.00 175.30 174.98 2rcu s ILE 226 N 1.40 5.23 0.20 4.11 1.01 0.81 -4.81 121.20 129.15 2rcu s ILE 226 Ca 0.05 0.13 -0.31 0.00 0.00 0.00 0.00 60.65 60.53 2rcu s ILE 226 Cb -0.15 -3.43 -0.10 0.00 0.01 0.00 0.00 42.46 38.79 2rcu s ILE 226 CO 0.03 0.35 1.44 -2.16 0.00 0.00 0.00 174.94 174.61 2rcu s PRO 227 N 1.04 4.28 0.05 2.79 0.04 -1.26 -1.07 135.00 140.88 2rcu s PRO 227 Ca 0.07 2.24 -0.04 0.00 0.04 0.00 0.00 61.00 63.32 2rcu s PRO 227 Cb -0.14 -3.15 -0.02 0.00 0.04 0.00 0.00 34.50 31.23 2rcu s PRO 227 CO 0.04 -0.44 0.05 1.03 0.04 0.00 0.00 177.00 177.72 2rcu s ARG 228 N 0.26 0.61 0.47 4.56 1.81 -1.26 -4.62 118.95 120.78 2rcu s ARG 228 Ca 0.62 -0.96 -0.24 0.00 -1.72 0.00 0.00 55.73 53.44 2rcu s ARG 228 Cb -0.41 0.23 -0.08 0.00 -0.45 0.00 0.00 34.95 34.24 2rcu s ARG 228 CO 0.38 -0.14 1.25 -2.30 -0.68 0.00 0.00 175.30 173.80 2rcu n PRO 229 N 0.45 1.75 0.00 3.54 -0.02 -1.26 -3.76 135.00 135.69 2rcu n PRO 229 Ca -0.17 0.63 0.00 0.00 -2.02 0.00 0.00 63.50 61.94 2rcu n PRO 229 Cb 0.60 -2.39 0.00 0.00 -0.02 0.00 0.00 33.50 31.68 2rcu n PRO 229 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2rcu n ASN 230 N -0.17 0.00 -3.65 2.55 3.02 -1.26 -4.66 115.26 111.10 2rcu n ASN 230 Ca 0.08 0.00 -0.03 0.00 -0.03 0.00 0.00 54.58 54.60 2rcu n ASN 230 Cb 0.42 0.00 -0.05 0.00 -0.61 0.00 0.00 39.78 39.54 2rcu n ASN 230 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 2rcu s ARG 231 N 0.00 0.62 0.90 3.52 3.52 -1.25 -4.45 118.95 121.81 2rcu s ARG 231 Ca 0.00 1.39 -0.11 0.00 -0.13 0.00 0.00 55.73 56.88 2rcu s ARG 231 Cb 0.00 0.65 0.13 0.00 -1.56 0.00 0.00 34.95 34.17 2rcu s ARG 231 CO 0.00 -0.18 1.10 -0.51 -0.81 0.00 0.00 175.30 174.89 2rcu s ASP 232 N 2.51 3.28 -0.07 -2.12 1.01 -0.31 -4.43 116.67 116.55 2rcu s ASP 232 Ca -0.07 1.73 0.04 0.00 0.71 0.00 0.00 52.55 54.96 2rcu s ASP 232 Cb -0.10 -2.36 -0.02 0.00 1.01 0.00 0.00 42.92 41.46 2rcu s ASP 232 CO -0.19 -2.79 -0.19 -0.70 0.21 0.00 0.00 175.17 171.50 2rcu s GLU 233 N -4.81 2.67 -0.33 8.23 2.12 -0.23 -4.92 118.70 121.43 2rcu s GLU 233 Ca 0.64 -0.79 -0.19 0.00 0.36 0.00 0.00 54.97 54.99 2rcu s GLU 233 Cb -0.20 -2.32 -0.01 0.00 0.26 0.00 0.00 34.13 31.87 2rcu s GLU 233 CO 0.58 0.44 0.56 -0.51 -0.54 0.00 0.00 175.26 175.79 2rcu s LEU 234 N -0.28 4.25 -0.13 2.70 1.43 -1.26 -0.13 118.68 125.26 2rcu s LEU 234 Ca 0.01 0.15 -0.04 0.00 -1.03 0.00 0.00 54.13 53.23 2rcu s LEU 234 Cb -0.13 -2.68 -0.03 0.00 0.03 0.00 0.00 46.19 43.38 2rcu s LEU 234 CO 0.03 -0.49 -0.01 0.12 0.23 0.00 0.00 176.35 176.23 2rcu s PHE 235 N 2.50 3.11 0.03 0.29 5.36 -0.18 -5.00 117.98 124.10 2rcu s PHE 235 Ca 0.21 -0.04 0.04 0.00 -0.96 0.00 0.00 56.93 56.18 2rcu s PHE 235 Cb -0.15 -1.91 -0.02 0.00 -0.34 0.00 0.00 43.02 40.60 2rcu s PHE 235 CO 0.13 0.20 -0.12 0.99 -1.46 0.00 0.00 175.22 174.96 2rcu s THR 236 N -0.13 0.90 -0.36 0.12 2.01 -1.26 -1.19 115.64 115.73 2rcu s THR 236 Ca 0.04 -0.88 -0.00 0.00 0.31 0.00 0.00 61.69 61.16 2rcu s THR 236 Cb -0.13 -0.83 0.13 0.00 0.01 0.00 0.00 72.50 71.68 2rcu s THR 236 CO 0.02 -0.04 0.20 -0.62 -0.69 0.00 0.00 174.62 173.49 2rcu s ASP 237 N -1.03 3.33 0.28 3.53 2.15 -0.11 -5.01 116.67 119.82 2rcu s ASP 237 Ca -0.00 -2.13 0.23 0.00 0.43 0.00 0.00 52.55 51.08 2rcu s ASP 237 Cb -0.07 -0.61 1.03 0.00 -0.30 0.00 0.00 42.92 42.97 2rcu s ASP 237 CO 0.01 -0.33 1.71 1.07 -0.17 0.00 0.00 175.17 177.46 2rcu n THR 238 N 4.15 0.86 0.54 1.71 5.66 -1.26 -2.35 114.28 123.60 2rcu n THR 238 Ca 0.07 0.33 0.13 0.00 -3.05 0.00 0.00 64.05 61.53 2rcu n THR 238 Cb 0.37 -1.28 0.44 0.00 -1.55 0.00 0.00 70.33 68.32 2rcu n THR 238 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 2rcu n LYS 239 N -2.26 0.23 -2.44 1.09 5.02 -1.26 -4.87 118.16 113.67 2rcu n LYS 239 Ca 0.01 0.30 -0.40 0.00 -2.02 0.00 0.00 58.31 56.20 2rcu n LYS 239 Cb 0.19 -1.83 -0.04 0.00 -0.02 0.00 0.00 35.03 33.33 2rcu n LYS 239 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2rcu s ALA 240 N -3.19 3.36 -0.61 7.82 0.00 -0.99 -4.94 121.76 123.21 2rcu s ALA 240 Ca 0.08 0.91 0.05 0.00 0.00 0.00 0.00 51.96 53.00 2rcu s ALA 240 Cb 0.11 -3.34 0.05 0.00 0.00 0.00 0.00 23.12 19.94 2rcu s ALA 240 CO 0.52 -0.23 0.70 0.54 0.00 0.00 0.00 175.76 177.28 2rcu n ARG 241 N 0.92 -0.04 -3.99 0.00 1.74 -1.26 -4.83 116.66 109.21 2rcu n ARG 241 Ca 0.00 -0.88 -0.30 0.00 -0.77 0.00 0.00 57.85 55.91 2rcu n ARG 241 Cb 0.45 -1.10 -0.05 0.00 -1.02 0.00 0.00 32.46 30.74 2rcu n ARG 241 CO 0.00 0.00 0.00 -3.38 -1.52 0.00 0.00 177.63 172.73 2rcu s HIS 242 N -0.47 3.34 0.12 -1.55 -3.43 -1.26 -1.17 115.29 110.87 2rcu s HIS 242 Ca 0.06 0.14 -0.11 0.00 -0.80 0.00 0.00 55.06 54.35 2rcu s HIS 242 Cb 0.04 -1.67 -0.06 0.00 -1.43 0.00 0.00 32.58 29.46 2rcu s HIS 242 CO 0.06 0.55 0.45 -1.17 -2.00 0.00 0.00 174.74 172.63 2rcu s LEU 243 N -2.60 4.32 -0.21 5.38 2.96 0.16 -0.92 118.68 127.78 2rcu s LEU 243 Ca 0.32 0.86 -0.08 0.00 -0.22 0.00 0.00 54.13 55.01 2rcu s LEU 243 Cb -0.12 -3.15 -0.04 0.00 0.50 0.00 0.00 46.19 43.38 2rcu s LEU 243 CO 0.25 0.12 0.09 -0.22 -1.32 0.00 0.00 176.35 175.27 2rcu s LEU 244 N -2.07 3.86 -0.09 -0.68 2.96 -1.11 -2.52 118.68 119.03 2rcu s LEU 244 Ca 0.36 0.05 0.04 0.00 -0.22 0.00 0.00 54.13 54.37 2rcu s LEU 244 Cb -0.14 -2.00 -0.00 0.00 0.50 0.00 0.00 46.19 44.55 2rcu s LEU 244 CO 0.19 0.12 -0.24 -0.69 -1.32 0.00 0.00 176.35 174.41 2rcu s VAL 245 N 0.73 2.10 -0.23 1.68 1.01 0.83 -0.01 120.40 126.51 2rcu s VAL 245 Ca 0.05 -1.01 -0.07 0.00 0.00 0.00 0.00 61.98 60.95 2rcu s VAL 245 Cb -0.13 -1.79 -0.03 0.00 0.00 0.00 0.00 36.38 34.43 2rcu s VAL 245 CO 0.02 0.56 0.05 -0.76 0.00 0.00 0.00 175.10 174.97 2rcu s LEU 246 N 0.26 3.42 -0.05 3.92 1.43 0.28 -0.63 118.68 127.31 2rcu s LEU 246 Ca -0.16 -0.18 0.00 0.00 -1.03 0.00 0.00 54.13 52.76 2rcu s LEU 246 Cb -0.17 -1.90 0.02 0.00 0.03 0.00 0.00 46.19 44.17 2rcu s LEU 246 CO 0.08 0.01 -0.03 -0.60 0.23 0.00 0.00 176.35 176.03 2rcu s ARG 247 N 1.36 0.78 -1.25 1.70 3.52 -0.84 -0.79 118.95 123.44 2rcu s ARG 247 Ca 0.05 -0.06 -0.06 0.00 -0.13 0.00 0.00 55.73 55.53 2rcu s ARG 247 Cb -0.15 -0.87 0.04 0.00 -1.56 0.00 0.00 34.95 32.42 2rcu s ARG 247 CO 0.03 -0.13 0.37 1.63 -0.81 0.00 0.00 175.30 176.39 2rcu n LYS 248 N 4.30 -3.28 -0.41 5.12 5.02 -1.26 -1.25 118.16 126.39 2rcu n LYS 248 Ca -0.21 0.56 0.00 0.00 -2.02 0.00 0.00 58.31 56.64 2rcu n LYS 248 Cb 0.51 -5.26 0.00 0.00 -0.02 0.00 0.00 35.03 30.26 2rcu n LYS 248 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2rcu n GLY 249 N -1.12 1.94 3.82 0.72 0.00 -1.24 -4.07 105.19 105.24 2rcu n GLY 249 Ca -0.06 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.60 2rcu n GLY 249 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2rcu s HIS 250 N -3.32 3.61 -0.17 1.61 3.76 -0.38 -4.55 115.29 115.84 2rcu s HIS 250 Ca 0.00 1.33 -0.06 0.00 -0.15 0.00 0.00 55.06 56.18 2rcu s HIS 250 Cb 0.00 -2.58 -0.03 0.00 1.11 0.00 0.00 32.58 31.08 2rcu s HIS 250 CO 0.00 0.31 0.01 -0.06 -0.85 0.00 0.00 174.74 174.15 2rcu s PHE 251 N -1.58 3.13 0.03 1.40 2.99 -1.26 -1.98 117.98 120.71 2rcu s PHE 251 Ca 0.44 -0.15 0.05 0.00 0.00 0.00 0.00 56.93 57.27 2rcu s PHE 251 Cb -0.16 -2.03 -0.02 0.00 0.00 0.00 0.00 43.02 40.82 2rcu s PHE 251 CO 0.20 0.02 -0.14 0.71 -0.00 0.00 0.00 175.22 176.01 2rcu s TYR 252 N 0.45 1.25 -0.00 0.36 2.02 0.19 -0.89 117.35 120.73 2rcu s TYR 252 Ca -0.00 -0.34 0.02 0.00 -0.37 0.00 0.00 57.07 56.38 2rcu s TYR 252 Cb -0.13 -0.75 -0.01 0.00 -0.40 0.00 0.00 41.96 40.67 2rcu s TYR 252 CO 0.02 0.03 -0.08 0.14 -1.57 0.00 0.00 175.55 174.09 2rcu s VAL 253 N -0.79 0.61 0.03 0.71 -7.23 -0.12 -0.12 120.40 113.50 2rcu s VAL 253 Ca 0.02 -0.40 -0.19 0.00 -1.81 0.00 0.00 61.98 59.60 2rcu s VAL 253 Cb -0.08 -0.53 0.04 0.00 0.56 0.00 0.00 36.38 36.37 2rcu s VAL 253 CO 0.01 0.13 0.44 0.72 -0.31 0.00 0.00 175.10 176.08 2rcu s PHE 254 N -0.28 -0.31 0.14 2.82 -0.12 -1.05 -0.93 117.98 118.24 2rcu s PHE 254 Ca 0.02 0.34 -0.30 0.00 -0.05 0.00 0.00 56.93 56.93 2rcu s PHE 254 Cb -0.04 0.24 -0.07 0.00 -0.63 0.00 0.00 43.02 42.52 2rcu s PHE 254 CO -0.00 -0.56 1.23 -0.51 -0.05 0.00 0.00 175.22 175.33 2rcu s ASP 255 N -1.85 7.04 0.00 1.98 1.01 -1.26 0.40 116.67 123.98 2rcu s ASP 255 Ca -0.07 2.19 0.08 0.00 0.71 0.00 0.00 52.55 55.46 2rcu s ASP 255 Cb -0.01 -2.60 -0.06 0.00 1.01 0.00 0.00 42.92 41.26 2rcu s ASP 255 CO -0.00 -0.45 0.42 1.33 0.21 0.00 0.00 175.17 176.68 2rcu n VAL 256 N 3.16 0.00 -5.00 -1.27 0.24 -0.32 -4.84 118.33 110.30 2rcu n VAL 256 Ca 0.07 -0.35 -0.29 0.00 -2.04 0.00 0.00 64.34 61.73 2rcu n VAL 256 Cb 0.45 1.03 -0.17 0.00 -1.47 0.00 0.00 33.84 33.69 2rcu n VAL 256 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2rcu s LEU 257 N -2.08 1.95 0.00 1.34 1.43 -0.95 -1.08 118.68 119.30 2rcu s LEU 257 Ca 0.04 -0.45 -0.14 0.00 -1.03 0.00 0.00 54.13 52.56 2rcu s LEU 257 Cb 0.06 -1.17 0.20 0.00 0.03 0.00 0.00 46.19 45.31 2rcu s LEU 257 CO 0.29 0.15 0.98 -0.90 0.23 0.00 0.00 176.35 177.10 2rcu n ASP 258 N 3.37 -0.67 0.08 2.29 5.68 0.66 -4.86 116.55 123.10 2rcu n ASP 258 Ca -0.19 -1.24 0.10 0.00 -0.50 0.00 0.00 54.79 52.96 2rcu n ASP 258 Cb 0.53 -0.80 0.43 0.00 -1.14 0.00 0.00 41.12 40.14 2rcu n ASP 258 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2rcu n GLN 259 N -3.57 0.13 0.00 0.11 10.64 -1.26 -1.97 117.38 121.45 2rcu n GLN 259 Ca 0.13 0.34 0.11 0.00 -1.83 0.00 0.00 57.00 55.75 2rcu n GLN 259 Cb 0.46 -1.73 -0.05 0.00 -0.86 0.00 0.00 30.24 28.06 2rcu n GLN 259 CO 0.00 0.00 0.00 -0.25 -1.83 0.00 0.00 177.06 174.98 2rcu n ASP 260 N -1.97 1.38 0.00 2.61 8.00 -1.26 -4.96 116.55 120.35 2rcu n ASP 260 Ca 0.03 -1.17 0.00 0.00 0.71 0.00 0.00 54.79 54.36 2rcu n ASP 260 Cb 0.22 0.75 0.00 0.00 -0.02 0.00 0.00 41.12 42.07 2rcu n ASP 260 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2rcu n GLY 261 N 1.47 0.46 3.83 0.44 0.00 -0.83 -5.08 105.19 105.47 2rcu n GLY 261 Ca 0.06 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.76 2rcu n GLY 261 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2rcu s ASN 262 N -2.86 6.64 0.19 1.61 0.02 -1.26 -4.74 114.94 114.55 2rcu s ASN 262 Ca 0.00 1.65 -0.30 0.00 -1.02 0.00 0.00 52.86 53.19 2rcu s ASN 262 Cb 0.00 -2.52 -0.09 0.00 0.02 0.00 0.00 41.25 38.66 2rcu s ASN 262 CO 0.00 -0.57 1.33 -0.63 0.02 0.00 0.00 177.10 177.25 2rcu s ILE 263 N -2.43 3.17 0.34 0.60 1.01 -1.26 -0.24 121.20 122.38 2rcu s ILE 263 Ca 0.61 0.95 -0.29 0.00 0.00 0.00 0.00 60.65 61.92 2rcu s ILE 263 Cb -0.10 -3.60 -0.12 0.00 0.01 0.00 0.00 42.46 38.64 2rcu s ILE 263 CO 0.25 0.13 1.47 0.52 0.00 0.00 0.00 174.94 177.32 2rcu n VAL 264 N 2.77 1.69 -1.32 2.92 0.31 -0.24 -4.78 118.33 119.67 2rcu n VAL 264 Ca 0.07 -0.42 -0.53 0.00 -0.01 0.00 0.00 64.34 63.45 2rcu n VAL 264 Cb 0.42 -1.86 -0.08 0.00 -0.91 0.00 0.00 33.84 31.41 2rcu n VAL 264 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 2rcu n ASN 265 N 1.05 0.90 0.18 4.52 2.85 -1.26 -4.73 115.26 118.77 2rcu n ASN 265 Ca 0.04 0.88 0.17 0.00 -0.11 0.00 0.00 54.58 55.56 2rcu n ASN 265 Cb 0.37 -0.70 0.80 0.00 1.24 0.00 0.00 39.78 41.50 2rcu n ASN 265 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 2rcu h PRO 266 N 4.49 0.00 0.00 1.20 0.11 -1.94 0.53 132.00 136.39 2rcu h PRO 266 Ca -0.30 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 65.71 2rcu h PRO 266 Cb 1.09 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 2rcu h PRO 266 CO 0.79 0.00 -0.44 -0.07 -0.21 0.00 0.00 178.00 178.07 2rcu h LEU 267 N 0.00 0.00 0.01 2.35 3.38 -1.92 0.12 115.31 119.25 2rcu h LEU 267 Ca 0.11 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.95 2rcu h LEU 267 Cb 0.56 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.32 2rcu h LEU 267 CO -0.00 0.44 -0.48 -0.33 0.09 0.00 0.00 178.44 178.16 2rcu h GLU 268 N 0.00 0.30 -0.50 1.13 5.08 -1.27 -0.59 114.58 118.74 2rcu h GLU 268 Ca -0.00 -0.34 0.10 0.00 -1.00 0.00 0.00 59.36 58.11 2rcu h GLU 268 Cb 0.87 0.10 -0.09 0.00 0.50 0.00 0.00 28.75 30.13 2rcu h GLU 268 CO 0.06 1.05 -0.09 0.82 -1.00 0.00 0.00 179.01 179.85 2rcu h ILE 269 N -0.31 0.53 -0.56 3.13 2.04 -1.24 0.61 117.51 121.71 2rcu h ILE 269 Ca -0.06 -0.01 0.06 0.00 1.00 0.00 0.00 64.86 65.84 2rcu h ILE 269 Cb 1.23 0.50 -0.05 0.00 -0.74 0.00 0.00 36.82 37.76 2rcu h ILE 269 CO 0.09 0.01 0.28 -0.61 0.00 0.00 0.00 178.15 177.92 2rcu h GLN 270 N 0.03 0.51 -0.88 2.37 4.15 -0.99 0.11 115.11 120.41 2rcu h GLN 270 Ca 0.24 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.63 2rcu h GLN 270 Cb 0.37 -0.12 -0.04 0.00 0.21 0.00 0.00 27.48 27.90 2rcu h GLN 270 CO -0.49 0.34 0.55 0.00 -1.93 0.00 0.00 178.83 177.30 2rcu h ALA 271 N 1.32 1.12 -0.26 3.38 0.00 -0.41 -0.26 119.26 124.15 2rcu h ALA 271 Ca 0.26 -0.08 -0.18 0.00 0.00 0.00 0.00 54.91 54.90 2rcu h ALA 271 Cb 0.19 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 2rcu h ALA 271 CO -0.19 0.56 -0.56 0.45 0.00 0.00 0.00 179.25 179.51 2rcu h HIS 272 N 1.20 1.00 -0.61 0.00 3.86 -0.08 -0.38 115.15 120.14 2rcu h HIS 272 Ca 0.32 -0.36 -0.08 0.00 -1.16 0.00 0.00 60.37 59.08 2rcu h HIS 272 Cb -0.09 -0.19 -0.02 0.00 1.06 0.00 0.00 27.41 28.17 2rcu h HIS 272 CO -0.00 1.17 0.05 -0.07 0.86 0.00 0.00 177.93 179.94 2rcu h LEU 273 N 0.61 1.00 -0.58 2.43 3.38 -0.64 -1.96 115.31 119.55 2rcu h LEU 273 Ca 0.01 -0.25 -0.04 0.00 0.09 0.00 0.00 57.88 57.69 2rcu h LEU 273 Cb 1.16 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 41.61 2rcu h LEU 273 CO 0.12 1.02 0.21 0.50 0.09 0.00 0.00 178.44 180.39 2rcu h LYS 274 N 0.96 0.87 -0.40 1.13 3.64 -0.84 0.18 116.57 122.10 2rcu h LYS 274 Ca 0.18 -0.17 0.07 0.00 -1.27 0.00 0.00 60.65 59.47 2rcu h LYS 274 Cb 0.48 -0.14 -0.07 0.00 -0.41 0.00 0.00 32.23 32.10 2rcu h LYS 274 CO 0.02 0.76 -0.01 -0.92 -2.27 0.00 0.00 179.45 177.04 2rcu h TYR 275 N 0.80 -0.04 -0.59 1.91 3.20 -0.90 0.21 116.97 121.56 2rcu h TYR 275 Ca 0.19 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 62.06 2rcu h TYR 275 Cb 0.23 0.08 -0.03 0.00 1.54 0.00 0.00 36.73 38.55 2rcu h TYR 275 CO 0.01 -0.09 0.26 0.82 -1.64 0.00 0.00 178.16 177.52 2rcu h ILE 276 N 0.10 1.22 0.00 1.81 2.04 -1.07 -2.70 117.51 118.90 2rcu h ILE 276 Ca 0.20 -0.66 -0.04 0.00 1.00 0.00 0.00 64.86 65.36 2rcu h ILE 276 Cb 0.28 0.55 -0.01 0.00 -0.74 0.00 0.00 36.82 36.91 2rcu h ILE 276 CO -0.34 0.26 -0.18 -0.07 0.00 0.00 0.00 178.15 177.83 2rcu h LEU 277 N 0.82 0.00 0.00 1.44 3.38 -0.38 -2.62 115.31 117.95 2rcu h LEU 277 Ca 0.20 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.17 2rcu h LEU 277 Cb 0.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.92 2rcu h LEU 277 CO -0.02 0.18 -0.23 -1.20 0.09 0.00 0.00 178.44 177.26 2rcu n SER 278 N -4.07 0.50 -4.77 -0.43 7.64 0.68 -4.93 113.62 108.25 2rcu n SER 278 Ca -0.02 0.31 -0.41 0.00 1.01 0.00 0.00 58.87 59.76 2rcu n SER 278 Cb 0.25 -0.31 -0.02 0.00 -1.01 0.00 0.00 64.21 63.13 2rcu n SER 278 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2rcu s ASP 279 N -3.76 6.68 0.00 6.43 2.15 -0.99 -4.92 116.67 122.25 2rcu s ASP 279 Ca 0.11 2.75 0.20 0.00 0.43 0.00 0.00 52.55 56.03 2rcu s ASP 279 Cb 0.15 -2.65 0.21 0.00 -0.30 0.00 0.00 42.92 40.34 2rcu s ASP 279 CO 0.62 -0.62 1.17 -1.54 -0.17 0.00 0.00 175.17 174.63 2rcu n SER 280 N 0.99 2.79 -4.76 -0.34 3.41 -1.26 -4.99 113.62 109.46 2rcu n SER 280 Ca 0.01 -1.85 -0.41 0.00 -0.26 0.00 0.00 58.87 56.36 2rcu n SER 280 Cb 0.41 -0.06 -0.01 0.00 -0.26 0.00 0.00 64.21 64.29 2rcu n SER 280 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2rcu s SER 281 N -1.55 6.46 0.89 4.04 0.01 -1.26 -5.01 113.70 117.28 2rcu s SER 281 Ca 0.26 2.91 -0.12 0.00 1.31 0.00 0.00 55.95 60.31 2rcu s SER 281 Cb 0.17 -2.65 0.12 0.00 0.21 0.00 0.00 66.02 63.88 2rcu s SER 281 CO 0.25 -0.82 1.14 -2.16 0.41 0.00 0.00 173.24 172.06 2rcu s PRO 282 N -1.28 1.34 0.24 12.44 0.04 -1.26 -4.96 135.00 141.56 2rcu s PRO 282 Ca 0.57 0.32 -0.31 0.00 0.04 0.00 0.00 61.00 61.61 2rcu s PRO 282 Cb -0.45 -1.86 -0.14 0.00 0.04 0.00 0.00 34.50 32.09 2rcu s PRO 282 CO 0.54 -2.07 1.27 0.28 0.04 0.00 0.00 177.00 177.06 2rcu n VAL 283 N -3.68 1.23 -1.22 -0.36 0.31 -1.26 -4.92 118.33 108.42 2rcu n VAL 283 Ca 0.07 -0.31 -0.35 0.00 -0.01 0.00 0.00 64.34 63.74 2rcu n VAL 283 Cb 0.59 -1.25 0.10 0.00 -0.91 0.00 0.00 33.84 32.37 2rcu n VAL 283 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 2rcu n PRO 284 N 1.58 0.31 -0.28 5.55 -0.02 -1.26 -4.91 135.00 135.97 2rcu n PRO 284 Ca 0.11 0.16 -0.01 0.00 -2.02 0.00 0.00 63.50 61.74 2rcu n PRO 284 Cb 0.30 -2.16 0.17 0.00 -0.02 0.00 0.00 33.50 31.80 2rcu n PRO 284 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2rcu h GLU 285 N -0.56 1.13 -2.80 -0.52 4.81 -1.99 -3.34 114.58 111.31 2rcu h GLU 285 Ca -0.46 -0.09 -0.61 0.00 -0.13 0.00 0.00 59.36 58.07 2rcu h GLU 285 Cb 1.32 -0.25 -0.40 0.00 0.63 0.00 0.00 28.75 30.06 2rcu h GLU 285 CO 0.45 0.77 -0.76 -0.06 -0.73 0.00 0.00 179.01 178.68 2rcu s PHE 286 N -5.90 2.32 -0.09 0.92 0.08 -1.26 -5.04 117.98 109.01 2rcu s PHE 286 Ca -0.12 -2.77 -0.29 0.00 0.12 0.00 0.00 56.93 53.86 2rcu s PHE 286 Cb 0.18 -1.87 -0.06 0.00 -0.57 0.00 0.00 43.02 40.69 2rcu s PHE 286 CO 0.80 -0.70 1.91 -2.14 -0.10 0.00 0.00 175.22 175.00 2rcu s PRO 287 N -0.52 3.83 0.46 0.24 0.02 -1.26 -4.87 135.00 132.91 2rcu s PRO 287 Ca 0.26 2.22 0.20 0.00 0.02 0.00 0.00 61.00 63.71 2rcu s PRO 287 Cb -0.06 -4.16 1.10 0.00 0.02 0.00 0.00 34.50 31.40 2rcu s PRO 287 CO -0.14 -1.29 1.96 0.28 -0.33 0.00 0.00 177.00 177.48 2rcu h VAL 288 N 6.09 0.89 0.00 3.83 2.07 -1.89 -2.98 116.25 124.25 2rcu h VAL 288 Ca -0.43 -0.83 -0.00 0.00 0.82 0.00 0.00 66.70 66.26 2rcu h VAL 288 Cb 1.21 1.48 -0.00 0.00 -1.52 0.00 0.00 31.29 32.46 2rcu h VAL 288 CO 0.96 0.21 -0.01 0.00 0.02 0.00 0.00 177.57 178.75 2rcu h ALA 289 N 1.78 1.45 -0.98 1.67 0.00 -1.83 -2.22 119.26 119.13 2rcu h ALA 289 Ca -0.00 -0.01 0.21 0.00 0.00 0.00 0.00 54.91 55.10 2rcu h ALA 289 Cb 0.47 -0.00 -0.09 0.00 0.00 0.00 0.00 17.79 18.16 2rcu h ALA 289 CO 0.03 0.02 0.62 1.88 0.00 0.00 0.00 179.25 181.79 2rcu h TYR 290 N 0.00 0.85 -0.81 0.00 0.99 -1.34 -2.35 116.97 114.31 2rcu h TYR 290 Ca -0.00 0.03 0.13 0.00 2.00 0.00 0.00 58.73 60.89 2rcu h TYR 290 Cb 0.04 -0.26 -0.06 0.00 1.00 0.00 0.00 36.73 37.46 2rcu h TYR 290 CO 0.00 0.18 0.53 -0.07 -0.00 0.00 0.00 178.16 178.80 2rcu h LEU 291 N 0.60 0.55 0.00 3.88 3.38 -1.65 -1.24 115.31 120.83 2rcu h LEU 291 Ca 0.55 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.55 2rcu h LEU 291 Cb 1.09 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.76 2rcu h LEU 291 CO -0.31 0.30 0.00 0.35 0.09 0.00 0.00 178.44 178.87 2rcu n THR 292 N -4.52 1.21 1.09 0.22 -2.24 -0.88 -2.30 114.28 106.86 2rcu n THR 292 Ca 0.15 0.30 0.12 0.00 -2.27 0.00 0.00 64.05 62.36 2rcu n THR 292 Cb 0.45 -1.12 0.24 0.00 -2.10 0.00 0.00 70.33 67.81 2rcu n THR 292 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2rcu n SER 293 N -1.48 2.56 -4.84 3.42 3.41 -0.47 -4.61 113.62 111.62 2rcu n SER 293 Ca 0.03 -1.85 -0.30 0.00 -0.26 0.00 0.00 58.87 56.49 2rcu n SER 293 Cb 0.12 -0.03 0.07 0.00 -0.26 0.00 0.00 64.21 64.11 2rcu n SER 293 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 2rcu s GLU 294 N -1.94 2.51 0.37 4.33 0.41 -0.97 -4.63 118.70 118.78 2rcu s GLU 294 Ca 0.32 0.62 -0.25 0.00 -0.41 0.00 0.00 54.97 55.25 2rcu s GLU 294 Cb 0.20 -1.97 -0.12 0.00 -1.78 0.00 0.00 34.13 30.47 2rcu s GLU 294 CO 0.31 -1.32 0.94 -1.71 -0.49 0.00 0.00 175.26 172.99 2rcu n ASN 295 N -3.23 0.96 0.14 -0.19 2.85 -1.26 -4.15 115.26 110.39 2rcu n ASN 295 Ca 0.07 1.07 -0.01 0.00 -0.11 0.00 0.00 54.58 55.60 2rcu n ASN 295 Cb 0.56 -1.30 0.22 0.00 1.24 0.00 0.00 39.78 40.50 2rcu n ASN 295 CO 0.00 0.00 0.00 0.03 -2.11 0.00 0.00 177.26 175.18 2rcu h ARG 296 N 1.59 0.04 -0.38 1.20 2.47 -0.74 -0.52 114.38 118.04 2rcu h ARG 296 Ca -0.42 -0.03 -0.12 0.00 -1.26 0.00 0.00 59.98 58.15 2rcu h ARG 296 Cb 1.35 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.66 2rcu h ARG 296 CO 0.57 0.57 -0.25 -0.44 0.56 0.00 0.00 179.97 180.99 2rcu h ASP 297 N 0.03 0.88 -0.31 7.04 3.32 -1.87 0.18 116.42 125.69 2rcu h ASP 297 Ca -0.00 -0.43 -0.03 0.00 0.02 0.00 0.00 57.03 56.59 2rcu h ASP 297 Cb 0.96 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 40.25 2rcu h ASP 297 CO 0.07 1.12 0.07 0.58 -1.72 0.00 0.00 179.24 179.36 2rcu h VAL 298 N 0.65 1.22 -0.34 -1.35 2.07 -1.85 -1.66 116.25 114.99 2rcu h VAL 298 Ca 0.08 -0.74 -0.15 0.00 0.82 0.00 0.00 66.70 66.71 2rcu h VAL 298 Cb 0.82 1.11 -0.01 0.00 -1.52 0.00 0.00 31.29 31.69 2rcu h VAL 298 CO 0.07 0.25 -0.38 -0.25 0.02 0.00 0.00 177.57 177.27 2rcu h TRP 299 N 0.34 0.96 -0.51 1.57 -0.00 -1.13 -1.84 115.95 115.34 2rcu h TRP 299 Ca 0.10 -0.28 0.05 0.00 -0.00 0.00 0.00 58.89 58.76 2rcu h TRP 299 Cb 0.30 -0.20 -0.05 0.00 -0.00 0.00 0.00 29.16 29.21 2rcu h TRP 299 CO 0.02 1.06 0.25 0.00 -0.00 0.00 0.00 178.44 179.76 2rcu h ALA 300 N 0.91 0.66 -0.06 2.65 0.00 -0.41 0.30 119.26 123.30 2rcu h ALA 300 Ca 0.06 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 2rcu h ALA 300 Cb 0.94 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.67 2rcu h ALA 300 CO 0.09 -0.10 0.03 1.49 0.00 0.00 0.00 179.25 180.75 2rcu h GLU 301 N 0.49 0.09 -0.61 0.00 4.81 -1.13 -2.36 114.58 115.87 2rcu h GLU 301 Ca 0.23 -0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 59.40 2rcu h GLU 301 Cb 0.15 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.49 2rcu h GLU 301 CO -0.17 0.22 0.21 -0.07 -0.73 0.00 0.00 179.01 178.47 2rcu h LEU 302 N -0.06 0.83 -0.69 1.64 3.38 -1.07 -1.11 115.31 118.24 2rcu h LEU 302 Ca 0.02 -0.13 -0.07 0.00 0.09 0.00 0.00 57.88 57.80 2rcu h LEU 302 Cb 0.16 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.67 2rcu h LEU 302 CO -0.00 0.77 0.17 -0.09 0.09 0.00 0.00 178.44 179.38 2rcu h ARG 303 N 0.88 1.10 -0.83 1.13 2.43 -0.89 -0.50 114.38 117.69 2rcu h ARG 303 Ca 0.20 -0.26 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 2rcu h ARG 303 Cb 0.22 -0.15 -0.04 0.00 -0.42 0.00 0.00 29.97 29.59 2rcu h ARG 303 CO -0.01 0.97 0.54 1.96 -1.51 0.00 0.00 179.97 181.92 2rcu h GLN 304 N 1.03 1.10 -0.52 0.20 4.20 -0.83 -1.86 115.11 118.44 2rcu h GLN 304 Ca 0.22 -0.07 -0.12 0.00 0.06 0.00 0.00 58.65 58.73 2rcu h GLN 304 Cb 0.36 -0.24 -0.02 0.00 0.30 0.00 0.00 27.48 27.88 2rcu h GLN 304 CO 0.00 0.74 -0.16 0.87 -0.67 0.00 0.00 178.83 179.62 2rcu h LYS 305 N 1.13 1.01 -0.66 1.46 1.57 -0.76 -0.51 116.57 119.81 2rcu h LYS 305 Ca 0.30 -0.40 0.07 0.00 -1.87 0.00 0.00 60.65 58.75 2rcu h LYS 305 Cb -0.11 -0.05 -0.06 0.00 0.08 0.00 0.00 32.23 32.09 2rcu h LYS 305 CO -0.06 1.08 0.34 -0.07 -0.57 0.00 0.00 179.45 180.17 2rcu h LEU 306 N 0.89 0.48 -0.35 2.94 3.38 -0.71 -0.80 115.31 121.14 2rcu h LEU 306 Ca 0.13 0.04 -0.00 0.00 0.09 0.00 0.00 57.88 58.14 2rcu h LEU 306 Cb 0.73 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.42 2rcu h LEU 306 CO 0.06 0.30 0.21 0.40 0.09 0.00 0.00 178.44 179.50 2rcu h ILE 307 N 0.62 1.12 -0.90 1.22 1.08 -1.05 -0.97 117.51 118.63 2rcu h ILE 307 Ca 0.31 -0.27 0.10 0.00 -0.39 0.00 0.00 64.86 64.61 2rcu h ILE 307 Cb 0.26 0.66 -0.07 0.00 -3.07 0.00 0.00 36.82 34.60 2rcu h ILE 307 CO -0.22 0.12 0.58 0.15 -0.69 0.00 0.00 178.15 178.09 2rcu h PHE 308 N 0.46 0.96 -0.19 1.37 3.57 -0.52 -1.59 116.94 121.00 2rcu h PHE 308 Ca 0.13 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.65 2rcu h PHE 308 Cb 0.00 -0.31 0.00 0.00 2.79 0.00 0.00 35.95 38.43 2rcu h PHE 308 CO -0.04 0.44 0.00 -0.25 -2.23 0.00 0.00 178.31 176.23 2rcu n ASP 309 N -4.53 1.15 0.00 0.41 8.00 -0.36 -4.87 116.55 116.35 2rcu n ASP 309 Ca 0.15 -2.03 0.00 0.00 0.71 0.00 0.00 54.79 53.63 2rcu n ASP 309 Cb 0.31 -0.17 0.00 0.00 -0.02 0.00 0.00 41.12 41.24 2rcu n ASP 309 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2rcu n GLY 310 N 0.74 0.74 0.79 0.44 0.00 -0.60 -4.80 105.19 102.51 2rcu n GLY 310 Ca 0.06 -0.35 0.08 0.00 0.00 0.00 0.00 46.02 45.81 2rcu n GLY 310 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2rcu n ASN 311 N 0.64 2.31 -0.18 1.61 3.02 -0.41 -4.57 115.26 117.68 2rcu n ASN 311 Ca 0.00 -1.96 -0.08 0.00 -0.03 0.00 0.00 54.58 52.51 2rcu n ASN 311 Cb 0.00 -0.27 0.02 0.00 -0.61 0.00 0.00 39.78 38.92 2rcu n ASN 311 CO 0.00 0.00 0.00 -0.08 -2.62 0.00 0.00 177.26 174.56 2rcu h GLU 312 N 2.61 0.72 -0.52 3.52 4.81 -1.80 0.67 114.58 124.59 2rcu h GLU 312 Ca 0.00 -0.10 0.04 0.00 -0.13 0.00 0.00 59.36 59.17 2rcu h GLU 312 Cb 0.59 -0.14 -0.04 0.00 0.63 0.00 0.00 28.75 29.80 2rcu h GLU 312 CO 0.00 0.58 0.28 1.49 -0.73 0.00 0.00 179.01 180.63 2rcu h GLU 313 N 0.68 0.53 -0.02 1.92 4.81 -1.99 0.85 114.58 121.36 2rcu h GLU 313 Ca 0.18 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.38 2rcu h GLU 313 Cb 0.08 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 29.34 2rcu h GLU 313 CO -0.03 0.35 0.01 1.15 -0.73 0.00 0.00 179.01 179.77 2rcu h THR 314 N 0.55 1.05 -0.93 0.32 2.02 -1.80 -2.57 112.91 111.54 2rcu h THR 314 Ca 0.22 -0.13 0.10 0.00 0.77 0.00 0.00 66.41 67.37 2rcu h THR 314 Cb 0.10 1.10 -0.07 0.00 -1.74 0.00 0.00 68.15 67.54 2rcu h THR 314 CO -0.14 0.04 0.60 -0.07 0.37 0.00 0.00 175.52 176.32 2rcu h LEU 315 N -0.03 0.86 -1.20 2.58 3.38 -0.45 -1.77 115.31 118.68 2rcu h LEU 315 Ca 0.01 0.03 -0.08 0.00 0.09 0.00 0.00 57.88 57.92 2rcu h LEU 315 Cb 0.05 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 2rcu h LEU 315 CO -0.00 0.50 -0.32 0.11 0.09 0.00 0.00 178.44 178.82 2rcu h LYS 316 N 0.95 0.13 -0.53 1.13 1.79 -0.61 0.12 116.57 119.54 2rcu h LYS 316 Ca 0.44 -0.05 -0.11 0.00 -2.18 0.00 0.00 60.65 58.75 2rcu h LYS 316 Cb 0.40 -0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 31.02 2rcu h LYS 316 CO -0.20 0.45 -0.09 0.87 -1.08 0.00 0.00 179.45 179.40 2rcu h LYS 317 N 0.12 0.98 0.18 3.15 1.57 -0.93 -1.54 116.57 120.10 2rcu h LYS 317 Ca 0.02 -0.35 -0.01 0.00 -1.87 0.00 0.00 60.65 58.44 2rcu h LYS 317 Cb 0.63 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.87 2rcu h LYS 317 CO 0.05 1.02 -0.09 0.28 -0.57 0.00 0.00 179.45 180.14 2rcu h VAL 318 N 0.88 0.92 -0.93 0.50 2.07 -0.95 -3.11 116.25 115.63 2rcu h VAL 318 Ca 0.14 -0.54 0.03 0.00 0.82 0.00 0.00 66.70 67.14 2rcu h VAL 318 Cb 0.64 1.25 -0.05 0.00 -1.52 0.00 0.00 31.29 31.61 2rcu h VAL 318 CO 0.04 0.12 0.61 0.44 0.02 0.00 0.00 177.57 178.81 2rcu h ASP 319 N -0.51 1.02 0.11 0.57 3.32 -0.71 -3.12 116.42 117.10 2rcu h ASP 319 Ca -0.02 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.01 2rcu h ASP 319 Cb 0.39 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.70 2rcu h ASP 319 CO 0.04 0.72 -0.39 -1.54 -1.72 0.00 0.00 179.24 176.34 2rcu n SER 320 N -4.43 1.50 -4.67 6.45 3.41 -0.59 -4.02 113.62 111.27 2rcu n SER 320 Ca 0.12 -1.19 -0.35 0.00 -0.26 0.00 0.00 58.87 57.20 2rcu n SER 320 Cb 0.07 0.33 0.11 0.00 -0.26 0.00 0.00 64.21 64.46 2rcu n SER 320 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2rcu n ALA 321 N -0.39 0.06 -0.30 7.33 0.00 -1.18 -4.41 120.51 121.62 2rcu n ALA 321 Ca 0.10 -0.24 0.04 0.00 0.00 0.00 0.00 53.44 53.34 2rcu n ALA 321 Cb 0.41 -2.22 0.18 0.00 0.00 0.00 0.00 19.45 17.82 2rcu n ALA 321 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.50 177.11 2rcu h VAL 322 N -0.50 0.89 -2.68 0.00 -1.51 -1.35 -3.04 116.25 108.07 2rcu h VAL 322 Ca -0.47 -0.27 0.08 0.00 -1.23 0.00 0.00 66.70 64.80 2rcu h VAL 322 Cb 1.31 0.03 -0.01 0.00 -2.13 0.00 0.00 31.29 30.49 2rcu h VAL 322 CO 0.47 0.14 0.44 2.22 -1.23 0.00 0.00 177.57 179.61 2rcu n PHE 323 N -4.74 -1.72 -3.82 5.19 1.16 -1.26 -1.46 117.46 110.81 2rcu n PHE 323 Ca 0.14 -1.43 -0.36 0.00 -1.87 0.00 0.00 57.45 53.94 2rcu n PHE 323 Cb 0.30 0.70 -0.13 0.00 -1.61 0.00 0.00 39.48 38.74 2rcu n PHE 323 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 2rcu s LEU 325 N 1.53 4.22 -0.19 0.00 2.96 0.98 -0.16 118.68 128.02 2rcu s LEU 325 Ca 0.05 0.58 -0.01 0.00 -0.22 0.00 0.00 54.13 54.54 2rcu s LEU 325 Cb -0.15 -2.50 0.00 0.00 0.50 0.00 0.00 46.19 44.04 2rcu s LEU 325 CO 0.01 0.01 -0.13 0.00 -1.32 0.00 0.00 176.35 174.92 2rcu s LEU 327 N 1.27 5.03 0.02 0.00 1.43 0.03 -1.14 118.68 125.31 2rcu s LEU 327 Ca 0.03 -1.37 -0.15 0.00 -1.03 0.00 0.00 54.13 51.61 2rcu s LEU 327 Cb -0.14 -1.99 -0.06 0.00 0.03 0.00 0.00 46.19 44.03 2rcu s LEU 327 CO -0.07 -0.50 0.43 -1.81 0.23 0.00 0.00 176.35 174.64 2rcu s ASP 328 N 1.97 6.84 -0.89 2.29 1.11 -0.94 -4.37 116.67 122.69 2rcu s ASP 328 Ca 0.02 1.00 -0.01 0.00 0.18 0.00 0.00 52.55 53.74 2rcu s ASP 328 Cb -0.22 -2.26 0.34 0.00 1.07 0.00 0.00 42.92 41.85 2rcu s ASP 328 CO 0.03 0.31 1.92 0.47 1.18 0.00 0.00 175.17 179.08 2rcu n ASP 329 N 1.75 7.34 -3.53 0.27 8.00 -1.26 -2.63 116.55 126.49 2rcu n ASP 329 Ca -0.13 -3.79 -0.17 0.00 0.71 0.00 0.00 54.79 51.41 2rcu n ASP 329 Cb 0.52 -1.07 -0.06 0.00 -0.02 0.00 0.00 41.12 40.49 2rcu n ASP 329 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 2rcu s PHE 330 N -4.13 -0.64 0.71 1.24 -0.12 -1.26 -4.92 117.98 108.86 2rcu s PHE 330 Ca 0.48 1.12 -0.08 0.00 -0.05 0.00 0.00 56.93 58.40 2rcu s PHE 330 Cb 0.36 0.41 0.05 0.00 -0.63 0.00 0.00 43.02 43.21 2rcu s PHE 330 CO -0.32 -0.57 1.04 -1.25 -0.05 0.00 0.00 175.22 174.07 2rcu s PRO 331 N -1.11 2.30 -0.14 1.99 0.04 -1.26 -2.17 135.00 134.65 2rcu s PRO 331 Ca -0.10 -0.07 -0.26 0.00 0.04 0.00 0.00 61.00 60.61 2rcu s PRO 331 Cb -0.00 -2.12 -0.02 0.00 0.04 0.00 0.00 34.50 32.40 2rcu s PRO 331 CO 0.09 -1.23 0.86 -1.64 0.04 0.00 0.00 177.00 175.12 2rcu s MET 332 N -5.30 4.35 0.14 4.56 -1.94 -1.26 -4.95 119.30 114.90 2rcu s MET 332 Ca 0.59 1.10 -0.11 0.00 -1.71 0.00 0.00 55.69 55.56 2rcu s MET 332 Cb -0.11 -3.55 -0.04 0.00 2.01 0.00 0.00 34.83 33.14 2rcu s MET 332 CO 0.46 -0.27 1.47 0.87 -0.01 0.00 0.00 175.02 177.55 2rcu h LYS 333 N 7.19 0.94 0.00 2.03 1.57 -1.96 -3.49 116.57 122.85 2rcu h LYS 333 Ca -0.31 -0.49 0.18 0.00 -1.87 0.00 0.00 60.65 58.15 2rcu h LYS 333 Cb 1.15 0.02 -0.03 0.00 0.08 0.00 0.00 32.23 33.44 2rcu h LYS 333 CO 0.83 1.15 0.51 -0.40 -0.57 0.00 0.00 179.45 180.97 2rcu n ASP 334 N -4.07 -0.98 0.12 0.86 5.68 -1.26 -5.01 116.55 111.90 2rcu n ASP 334 Ca -0.02 -1.38 -0.01 0.00 -0.50 0.00 0.00 54.79 52.88 2rcu n ASP 334 Cb 0.54 1.56 0.25 0.00 -1.14 0.00 0.00 41.12 42.33 2rcu n ASP 334 CO 0.00 0.00 0.00 -0.07 -1.33 0.00 0.00 177.20 175.80 2rcu h LEU 335 N 0.00 0.16 0.01 -2.12 3.38 -1.98 0.15 115.31 114.90 2rcu h LEU 335 Ca -0.16 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 57.74 2rcu h LEU 335 Cb 0.80 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.51 2rcu h LEU 335 CO 0.23 0.57 -0.00 0.40 0.09 0.00 0.00 178.44 179.72 2rcu h ILE 336 N 0.12 1.05 -0.75 1.22 2.04 -1.97 0.75 117.51 119.98 2rcu h ILE 336 Ca 0.01 -0.18 0.07 0.00 1.00 0.00 0.00 64.86 65.76 2rcu h ILE 336 Cb 0.82 1.17 -0.06 0.00 -0.74 0.00 0.00 36.82 38.00 2rcu h ILE 336 CO 0.06 0.05 0.43 -0.74 0.00 0.00 0.00 178.15 177.95 2rcu h HIS 337 N -0.09 0.79 -0.27 1.37 2.76 -1.84 -1.51 115.15 116.36 2rcu h HIS 337 Ca -0.00 0.03 0.01 0.00 -2.20 0.00 0.00 60.37 58.21 2rcu h HIS 337 Cb 0.08 -0.24 -0.02 0.00 1.55 0.00 0.00 27.41 28.78 2rcu h HIS 337 CO -0.05 0.36 0.14 1.25 -1.30 0.00 0.00 177.93 178.33 2rcu h LEU 338 N 0.77 0.22 -0.06 0.26 6.46 -0.62 -1.24 115.31 121.10 2rcu h LEU 338 Ca 0.34 0.01 -0.00 0.00 -0.12 0.00 0.00 57.88 58.11 2rcu h LEU 338 Cb 0.23 -0.04 -0.00 0.00 -0.73 0.00 0.00 40.66 40.12 2rcu h LEU 338 CO -0.20 0.17 0.04 0.28 -0.62 0.00 0.00 178.44 178.10 2rcu h SER 339 N 0.30 0.07 -0.65 1.25 0.02 -0.36 -0.92 113.55 113.25 2rcu h SER 339 Ca 0.11 -0.03 0.03 0.00 -0.84 0.00 0.00 61.79 61.06 2rcu h SER 339 Cb 0.02 -0.02 -0.04 0.00 0.14 0.00 0.00 62.40 62.50 2rcu h SER 339 CO -0.06 0.08 0.40 0.45 -1.14 0.00 0.00 176.83 176.55 2rcu h HIS 340 N 0.05 0.74 -0.58 3.45 3.86 -1.22 0.95 115.15 122.40 2rcu h HIS 340 Ca 0.02 0.02 0.02 0.00 -1.16 0.00 0.00 60.37 59.27 2rcu h HIS 340 Cb 0.02 -0.24 -0.03 0.00 1.06 0.00 0.00 27.41 28.22 2rcu h HIS 340 CO -0.06 0.41 0.37 1.15 0.86 0.00 0.00 177.93 180.66 2rcu h THR 341 N 0.77 1.11 0.00 2.45 2.02 -0.82 0.06 112.91 118.50 2rcu h THR 341 Ca 0.27 -0.26 -0.25 0.00 0.77 0.00 0.00 66.41 66.94 2rcu h THR 341 Cb 0.04 0.30 -0.04 0.00 -1.74 0.00 0.00 68.15 66.71 2rcu h THR 341 CO -0.12 0.14 -1.45 0.24 0.37 0.00 0.00 175.52 174.70 2rcu h MET 342 N 0.75 0.00 -0.01 6.66 2.07 -0.99 -2.53 114.93 120.89 2rcu h MET 342 Ca 0.22 0.00 -0.25 0.00 -2.07 0.00 0.00 59.70 57.61 2rcu h MET 342 Cb -0.04 0.00 0.01 0.00 -1.87 0.00 0.00 31.60 29.70 2rcu h MET 342 CO -0.07 0.59 -0.98 1.25 1.07 0.00 0.00 176.91 178.76 2rcu h LEU 343 N 0.00 0.73 0.00 1.22 5.85 -0.70 -3.44 115.31 118.97 2rcu h LEU 343 Ca -0.19 -0.58 0.00 0.00 0.84 0.00 0.00 57.88 57.95 2rcu h LEU 343 Cb 1.87 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 42.68 2rcu h LEU 343 CO 0.09 1.38 0.00 0.00 -0.34 0.00 0.00 178.44 179.57 2rcu n HIS 344 N -3.81 0.00 -4.80 1.25 1.44 -0.13 -4.66 115.22 104.51 2rcu n HIS 344 Ca -0.09 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.62 2rcu n HIS 344 Cb 0.85 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.96 2rcu n HIS 344 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2rcu n GLY 345 N 0.34 0.27 0.88 -1.39 0.00 -0.39 -4.10 105.19 100.80 2rcu n GLY 345 Ca 0.00 -0.94 0.11 0.00 0.00 0.00 0.00 46.02 45.19 2rcu n GLY 345 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2rcu n ASP 346 N -2.39 2.64 0.00 1.61 5.75 -1.26 -4.91 116.55 117.99 2rcu n ASP 346 Ca 0.00 -1.87 0.00 0.00 -0.01 0.00 0.00 54.79 52.91 2rcu n ASP 346 Cb 0.00 -0.17 0.00 0.00 -1.03 0.00 0.00 41.12 39.92 2rcu n ASP 346 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2rcu n GLY 347 N 1.33 2.65 0.04 6.12 0.00 -1.26 -4.93 105.19 109.14 2rcu n GLY 347 Ca 0.18 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.28 2rcu n GLY 347 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2rcu n THR 348 N -1.82 0.27 -2.06 2.61 -2.24 -1.26 -2.64 114.28 107.13 2rcu n THR 348 Ca 0.00 -0.55 0.02 0.00 -2.27 0.00 0.00 64.05 61.25 2rcu n THR 348 Cb 0.00 -0.12 0.11 0.00 -2.10 0.00 0.00 70.33 68.22 2rcu n THR 348 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2rcu n ASN 349 N -2.39 1.72 -3.87 3.42 4.05 -1.26 -3.72 115.26 113.21 2rcu n ASN 349 Ca -0.06 -3.04 -0.16 0.00 0.45 0.00 0.00 54.58 51.76 2rcu n ASN 349 Cb 0.63 -0.42 -0.15 0.00 1.23 0.00 0.00 39.78 41.07 2rcu n ASN 349 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 177.26 174.08 2rcu s ARG 350 N -2.10 0.33 -0.90 1.20 1.81 -1.26 -4.80 118.95 113.23 2rcu s ARG 350 Ca 0.37 -0.03 -0.15 0.00 -1.72 0.00 0.00 55.73 54.20 2rcu s ARG 350 Cb 0.38 -0.41 0.19 0.00 -0.45 0.00 0.00 34.95 34.65 2rcu s ARG 350 CO -0.10 -0.04 0.95 -0.46 -0.68 0.00 0.00 175.30 174.98 2rcu s TRP 351 N 0.53 3.54 0.55 -0.53 -0.11 -1.26 -4.79 118.94 116.86 2rcu s TRP 351 Ca -0.05 -1.82 0.22 0.00 1.22 0.00 0.00 56.10 55.67 2rcu s TRP 351 Cb -0.08 -4.02 1.51 0.00 -1.50 0.00 0.00 33.47 29.38 2rcu s TRP 351 CO -0.01 -1.19 2.19 0.74 -4.62 0.00 0.00 176.95 174.06 2rcu h PHE 352 N 8.08 0.00 0.00 5.86 0.04 -1.85 -1.56 116.94 127.51 2rcu h PHE 352 Ca 0.14 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.88 2rcu h PHE 352 Cb 1.02 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.16 2rcu h PHE 352 CO 1.07 0.01 -0.15 -0.44 -0.60 0.00 0.00 178.31 178.20 2rcu h ASP 353 N 0.00 0.00 -4.12 2.17 3.32 -1.87 -3.41 116.42 112.51 2rcu h ASP 353 Ca -0.00 0.00 -0.55 0.00 0.02 0.00 0.00 57.03 56.50 2rcu h ASP 353 Cb 0.02 0.00 0.15 0.00 0.22 0.00 0.00 39.33 39.72 2rcu h ASP 353 CO 0.00 0.15 0.49 -0.75 -1.72 0.00 0.00 179.24 177.41 2rcu s LYS 354 N -4.18 2.56 0.25 3.56 2.47 -0.59 -1.69 119.74 122.13 2rcu s LYS 354 Ca -0.03 1.97 -0.07 0.00 -1.56 0.00 0.00 55.97 56.29 2rcu s LYS 354 Cb 0.13 -1.86 0.46 0.00 -1.46 0.00 0.00 37.83 35.10 2rcu s LYS 354 CO 0.61 -1.56 1.61 0.66 0.16 0.00 0.00 175.35 176.83 2rcu h SER 355 N 0.48 -0.50 -5.09 1.43 4.64 -1.42 -3.33 113.55 109.76 2rcu h SER 355 Ca -0.50 0.22 -0.06 0.00 -0.47 0.00 0.00 61.79 60.98 2rcu h SER 355 Cb 1.32 0.42 -0.13 0.00 -0.31 0.00 0.00 62.40 63.70 2rcu h SER 355 CO 0.53 -0.23 -0.12 0.72 -0.87 0.00 0.00 176.83 176.85 2rcu s PHE 356 N -6.14 -0.14 -0.16 4.77 -0.12 -1.26 -2.00 117.98 112.93 2rcu s PHE 356 Ca -0.14 -0.19 -0.02 0.00 -0.05 0.00 0.00 56.93 56.53 2rcu s PHE 356 Cb 0.24 0.21 -0.02 0.00 -0.63 0.00 0.00 43.02 42.82 2rcu s PHE 356 CO 0.76 -0.68 -0.08 -0.80 -0.05 0.00 0.00 175.22 174.37 2rcu s ASN 357 N -2.81 4.32 -0.38 1.98 0.01 0.59 -2.88 114.94 115.76 2rcu s ASN 357 Ca 0.03 -0.28 -0.15 0.00 -0.71 0.00 0.00 52.86 51.76 2rcu s ASN 357 Cb 0.02 -1.69 0.00 0.00 0.41 0.00 0.00 41.25 40.00 2rcu s ASN 357 CO -0.12 0.13 0.33 -0.22 -1.51 0.00 0.00 177.10 175.71 2rcu s LEU 358 N 0.59 4.76 -0.16 0.60 2.96 0.77 -1.16 118.68 127.04 2rcu s LEU 358 Ca -0.05 -0.58 -0.06 0.00 -0.22 0.00 0.00 54.13 53.21 2rcu s LEU 358 Cb -0.15 -2.24 -0.04 0.00 0.50 0.00 0.00 46.19 44.26 2rcu s LEU 358 CO 0.03 -0.40 0.06 -0.63 -1.32 0.00 0.00 176.35 174.09 2rcu s ILE 359 N 1.86 4.76 -0.13 6.68 1.01 -0.23 -0.47 121.20 134.67 2rcu s ILE 359 Ca 0.08 -0.05 -0.01 0.00 0.00 0.00 0.00 60.65 60.67 2rcu s ILE 359 Cb -0.18 -3.11 0.04 0.00 0.01 0.00 0.00 42.46 39.22 2rcu s ILE 359 CO 0.11 0.51 -0.03 -0.69 0.00 0.00 0.00 174.94 174.84 2rcu s VAL 360 N -0.01 0.79 0.88 2.92 1.01 -0.29 -1.39 120.40 124.31 2rcu s VAL 360 Ca 0.06 -0.33 -0.11 0.00 0.00 0.00 0.00 61.98 61.60 2rcu s VAL 360 Cb -0.12 -0.98 0.17 0.00 0.00 0.00 0.00 36.38 35.46 2rcu s VAL 360 CO 0.01 0.16 1.21 0.00 0.00 0.00 0.00 175.10 176.49 2rcu s ALA 361 N 1.78 2.74 0.42 5.51 0.00 0.92 -2.22 121.76 130.93 2rcu s ALA 361 Ca 0.03 -1.38 0.22 0.00 0.00 0.00 0.00 51.96 50.82 2rcu s ALA 361 Cb -0.14 -2.51 1.26 0.00 0.00 0.00 0.00 23.12 21.72 2rcu s ALA 361 CO -0.07 -2.10 2.03 1.49 0.00 0.00 0.00 175.76 177.10 2rcu h GLU 362 N -1.26 0.00 -0.64 0.00 4.22 -1.19 -1.46 114.58 114.25 2rcu h GLU 362 Ca -0.42 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.02 2rcu h GLU 362 Cb 1.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.50 2rcu h GLU 362 CO 0.39 0.16 0.00 -0.40 -2.18 0.00 0.00 179.01 176.98 2rcu n ASP 363 N -3.89 4.64 0.00 1.04 5.68 -1.26 -4.11 116.55 118.64 2rcu n ASP 363 Ca -0.02 -2.59 0.00 0.00 -0.50 0.00 0.00 54.79 51.68 2rcu n ASP 363 Cb 0.25 -0.60 0.00 0.00 -1.14 0.00 0.00 41.12 39.63 2rcu n ASP 363 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2rcu n GLY 364 N 0.79 1.48 3.69 6.12 0.00 -0.55 -4.76 105.19 111.96 2rcu n GLY 364 Ca 0.23 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.82 2rcu n GLY 364 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2rcu n THR 365 N -2.00 0.26 -4.26 2.61 -1.04 -1.26 -4.64 114.28 103.94 2rcu n THR 365 Ca 0.00 -0.05 -0.19 0.00 -2.04 0.00 0.00 64.05 61.77 2rcu n THR 365 Cb 0.00 -2.00 -0.11 0.00 -1.82 0.00 0.00 70.33 66.40 2rcu n THR 365 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2rcu s ALA 366 N 2.26 1.63 0.16 2.41 0.00 -1.26 -0.05 121.76 126.91 2rcu s ALA 366 Ca 0.81 -1.34 -0.18 0.00 0.00 0.00 0.00 51.96 51.25 2rcu s ALA 366 Cb -0.53 -0.11 0.04 0.00 0.00 0.00 0.00 23.12 22.53 2rcu s ALA 366 CO 0.37 0.14 0.50 0.00 0.00 0.00 0.00 175.76 176.77 2rcu s ALA 367 N -2.09 -1.10 -0.21 0.00 0.00 -0.49 -0.81 121.76 117.07 2rcu s ALA 367 Ca 0.10 0.02 -0.03 0.00 0.00 0.00 0.00 51.96 52.05 2rcu s ALA 367 Cb -0.05 0.80 -0.01 0.00 0.00 0.00 0.00 23.12 23.86 2rcu s ALA 367 CO 0.04 -0.74 -0.06 0.08 0.00 0.00 0.00 175.76 175.08 2rcu s VAL 368 N -3.82 3.31 -0.17 0.00 1.01 0.39 -1.07 120.40 120.05 2rcu s VAL 368 Ca 0.05 -0.52 -0.04 0.00 0.00 0.00 0.00 61.98 61.47 2rcu s VAL 368 Cb 0.00 -2.49 -0.02 0.00 0.00 0.00 0.00 36.38 33.87 2rcu s VAL 368 CO -0.09 0.44 -0.04 -2.28 0.00 0.00 0.00 175.10 173.14 2rcu s HIS 369 N 1.31 3.00 0.08 5.22 5.04 -0.31 -1.14 115.29 128.50 2rcu s HIS 369 Ca 0.04 -0.44 0.04 0.00 -1.54 0.00 0.00 55.06 53.16 2rcu s HIS 369 Cb -0.14 -1.99 -0.03 0.00 0.04 0.00 0.00 32.58 30.45 2rcu s HIS 369 CO -0.03 -0.16 -0.11 -0.59 -2.34 0.00 0.00 174.74 171.51 2rcu s PHE 370 N 0.63 1.09 0.07 3.88 -0.12 -0.86 -0.30 117.98 122.36 2rcu s PHE 370 Ca -0.03 -0.56 -0.27 0.00 -0.05 0.00 0.00 56.93 56.03 2rcu s PHE 370 Cb -0.14 -0.60 -0.06 0.00 -0.63 0.00 0.00 43.02 41.59 2rcu s PHE 370 CO 0.02 0.02 0.85 -2.00 -0.05 0.00 0.00 175.22 174.06 2rcu s GLU 371 N -2.25 4.58 0.15 1.99 -6.30 -0.85 -3.46 118.70 112.56 2rcu s GLU 371 Ca 0.01 1.22 0.24 0.00 -2.50 0.00 0.00 54.97 53.94 2rcu s GLU 371 Cb -0.07 -3.37 0.22 0.00 0.00 0.00 0.00 34.13 30.92 2rcu s GLU 371 CO 0.01 0.25 1.23 1.25 0.02 0.00 0.00 175.26 178.02 2rcu h HIS 372 N 5.66 0.00 -0.37 5.30 -0.00 -1.88 -3.38 115.15 120.48 2rcu h HIS 372 Ca -0.43 0.00 -0.03 0.00 -0.00 0.00 0.00 60.37 59.90 2rcu h HIS 372 Cb 1.21 0.00 -0.02 0.00 -0.00 0.00 0.00 27.41 28.60 2rcu h HIS 372 CO 0.65 0.00 0.09 0.66 -0.00 0.00 0.00 177.93 179.33 2rcu h SER 373 N 0.00 0.50 1.08 3.26 4.64 -1.94 -3.02 113.55 118.06 2rcu h SER 373 Ca 0.00 -0.07 0.00 0.00 -0.47 0.00 0.00 61.79 61.25 2rcu h SER 373 Cb 0.83 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 62.79 2rcu h SER 373 CO 0.00 0.50 -0.92 4.11 -0.87 0.00 0.00 176.83 179.65 2rcu h TRP 374 N 0.53 0.00 -4.22 4.77 5.08 -1.98 -3.47 115.95 116.67 2rcu h TRP 374 Ca 0.13 0.00 -0.19 0.00 1.08 0.00 0.00 58.89 59.91 2rcu h TRP 374 Cb 0.20 0.00 -0.12 0.00 -3.00 0.00 0.00 29.16 26.24 2rcu h TRP 374 CO 0.01 0.00 -0.39 0.20 -1.28 0.00 0.00 178.44 176.98 2rcu s GLY 375 N -4.35 1.16 0.08 11.11 0.00 -1.14 -4.80 107.32 109.37 2rcu s GLY 375 Ca 0.00 -1.40 0.01 0.00 0.00 0.00 0.00 44.72 43.32 2rcu s GLY 375 CO 0.78 -1.09 -0.05 0.99 0.00 0.00 0.00 173.10 173.73 2rcu s ASP 376 N -3.13 0.85 0.25 1.64 1.01 -1.26 -4.84 116.67 111.20 2rcu s ASP 376 Ca 0.32 -0.98 -0.11 0.00 0.71 0.00 0.00 52.55 52.49 2rcu s ASP 376 Cb 0.03 0.14 0.37 0.00 1.01 0.00 0.00 42.92 44.47 2rcu s ASP 376 CO 0.12 -0.51 1.58 1.23 0.21 0.00 0.00 175.17 177.80 2rcu h GLY 377 N 3.11 0.56 0.38 0.21 0.00 -1.99 -1.26 103.07 104.08 2rcu h GLY 377 Ca -0.35 0.32 0.15 0.00 0.00 0.00 0.00 47.33 47.46 2rcu h GLY 377 CO 0.64 -0.32 0.61 -0.24 0.00 0.00 0.00 176.54 177.23 2rcu h VAL 378 N -0.01 0.82 0.09 4.60 3.04 -1.98 0.23 116.25 123.05 2rcu h VAL 378 Ca 0.41 -0.27 -0.16 0.00 -1.01 0.00 0.00 66.70 65.67 2rcu h VAL 378 Cb 0.64 -0.05 0.01 0.00 -2.01 0.00 0.00 31.29 29.88 2rcu h VAL 378 CO -0.92 0.15 -0.77 0.00 -1.01 0.00 0.00 177.57 175.01 2rcu h ALA 379 N 1.59 0.01 -1.00 3.17 0.00 -1.65 -2.68 119.26 118.70 2rcu h ALA 379 Ca 0.50 -0.76 0.05 0.00 0.00 0.00 0.00 54.91 54.69 2rcu h ALA 379 Cb 0.72 0.20 -0.06 0.00 0.00 0.00 0.00 17.79 18.65 2rcu h ALA 379 CO -0.27 0.40 0.65 0.28 0.00 0.00 0.00 179.25 180.31 2rcu h VAL 380 N -0.55 1.15 -0.55 0.00 2.07 -1.25 -2.38 116.25 114.74 2rcu h VAL 380 Ca -0.16 -0.42 -0.07 0.00 0.82 0.00 0.00 66.70 66.87 2rcu h VAL 380 Cb 1.49 -0.19 -0.02 0.00 -1.52 0.00 0.00 31.29 31.04 2rcu h VAL 380 CO 0.07 0.22 0.07 0.25 0.02 0.00 0.00 177.57 178.20 2rcu h LEU 381 N 1.23 0.84 -0.12 2.57 5.85 -0.57 0.17 115.31 125.28 2rcu h LEU 381 Ca 0.41 -0.19 -0.00 0.00 0.84 0.00 0.00 57.88 58.94 2rcu h LEU 381 Cb 0.05 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 40.85 2rcu h LEU 381 CO -0.14 0.86 0.07 -0.09 -0.34 0.00 0.00 178.44 178.80 2rcu h ARG 382 N 0.83 0.16 0.21 1.25 9.65 -1.08 0.45 114.38 125.85 2rcu h ARG 382 Ca 0.17 -0.02 0.01 0.00 -1.10 0.00 0.00 59.98 59.04 2rcu h ARG 382 Cb 0.40 -0.03 -0.02 0.00 -1.39 0.00 0.00 29.97 28.92 2rcu h ARG 382 CO 0.01 0.18 -0.26 0.35 2.80 0.00 0.00 179.97 183.04 2rcu h PHE 383 N 0.10 -0.71 -0.54 2.20 3.57 -1.21 -1.05 116.94 119.31 2rcu h PHE 383 Ca 0.04 0.01 0.10 0.00 3.53 0.00 0.00 57.97 61.65 2rcu h PHE 383 Cb 0.06 0.28 -0.08 0.00 2.79 0.00 0.00 35.95 39.00 2rcu h PHE 383 CO -0.05 -0.38 0.07 0.35 -2.23 0.00 0.00 178.31 176.07 2rcu h PHE 384 N -0.53 0.09 -0.60 0.41 3.57 -0.45 -0.18 116.94 119.26 2rcu h PHE 384 Ca 0.01 0.04 -0.09 0.00 3.53 0.00 0.00 57.97 61.45 2rcu h PHE 384 Cb 0.51 0.04 -0.02 0.00 2.79 0.00 0.00 35.95 39.27 2rcu h PHE 384 CO -0.20 -0.06 0.03 -0.91 -2.23 0.00 0.00 178.31 174.94 2rcu h ASN 385 N 0.19 1.01 0.02 0.41 2.35 0.13 -1.15 115.58 118.53 2rcu h ASN 385 Ca 0.28 -0.29 -0.19 0.00 -0.55 0.00 0.00 56.30 55.55 2rcu h ASN 385 Cb 0.41 -0.27 -0.00 0.00 0.05 0.00 0.00 38.32 38.51 2rcu h ASN 385 CO -0.39 1.05 -0.66 -0.33 -1.65 0.00 0.00 177.43 175.45 2rcu h GLU 386 N 0.93 0.61 -0.50 0.81 4.39 -0.72 -1.61 114.58 118.49 2rcu h GLU 386 Ca 0.17 -0.44 -0.11 0.00 0.34 0.00 0.00 59.36 59.32 2rcu h GLU 386 Cb 0.52 0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 29.23 2rcu h GLU 386 CO 0.02 1.06 -0.13 0.28 -1.16 0.00 0.00 179.01 179.09 2rcu h VAL 387 N 0.44 1.27 -0.05 3.13 2.07 -0.99 -0.26 116.25 121.85 2rcu h VAL 387 Ca -0.02 -1.26 -0.00 0.00 0.82 0.00 0.00 66.70 66.23 2rcu h VAL 387 Cb 1.24 1.02 -0.00 0.00 -1.52 0.00 0.00 31.29 32.03 2rcu h VAL 387 CO 0.13 0.44 0.01 0.15 0.02 0.00 0.00 177.57 178.32 2rcu h PHE 388 N 0.84 0.09 0.11 1.57 3.57 -1.10 -0.96 116.94 121.06 2rcu h PHE 388 Ca 0.13 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.64 2rcu h PHE 388 Cb 0.67 -0.03 -0.03 0.00 2.79 0.00 0.00 35.95 39.35 2rcu h PHE 388 CO 0.04 0.28 -0.25 -0.09 -2.23 0.00 0.00 178.31 176.06 2rcu h ARG 389 N -0.13 -0.43 -0.56 1.11 2.43 -1.23 -2.40 114.38 113.18 2rcu h ARG 389 Ca 0.02 0.03 -0.10 0.00 -0.81 0.00 0.00 59.98 59.12 2rcu h ARG 389 Cb 0.23 0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.86 2rcu h ARG 389 CO -0.00 -0.29 -0.04 0.22 -1.51 0.00 0.00 179.97 178.36 2rcu h ASP 390 N -0.45 0.97 1.41 -3.80 3.58 -1.04 -0.57 116.42 116.53 2rcu h ASP 390 Ca 0.03 -0.28 -0.01 0.00 0.42 0.00 0.00 57.03 57.19 2rcu h ASP 390 Cb 0.48 -0.26 -0.00 0.00 1.72 0.00 0.00 39.33 41.26 2rcu h ASP 390 CO -0.15 1.05 -0.07 0.77 -2.88 0.00 0.00 179.24 177.96 2rcu h SER 391 N 0.90 0.00 0.01 2.28 4.64 -1.08 -0.98 113.55 119.31 2rcu h SER 391 Ca 0.16 0.00 -0.38 0.00 -0.47 0.00 0.00 61.79 61.10 2rcu h SER 391 Cb 0.57 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.60 2rcu h SER 391 CO 0.03 0.07 -2.41 0.35 -0.87 0.00 0.00 176.83 174.00 2rcu n THR 392 N -3.14 1.43 -0.03 2.95 -2.24 -0.91 -3.71 114.28 108.63 2rcu n THR 392 Ca 0.02 -0.75 -0.05 0.00 -2.27 0.00 0.00 64.05 61.00 2rcu n THR 392 Cb 0.44 -0.85 -0.13 0.00 -2.10 0.00 0.00 70.33 67.69 2rcu n THR 392 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2rcu n GLN 393 N -2.96 0.65 -3.12 -0.78 6.02 -0.23 -4.56 117.38 112.40 2rcu n GLN 393 Ca -0.38 0.17 -0.18 0.00 -0.01 0.00 0.00 57.00 56.60 2rcu n GLN 393 Cb 1.09 -1.71 -0.03 0.00 1.02 0.00 0.00 30.24 30.62 2rcu n GLN 393 CO 0.00 0.00 0.00 -2.37 -1.01 0.00 0.00 177.06 173.68 2rcu n THR 394 N -2.88 0.21 -1.71 5.09 5.66 -0.38 -5.06 114.28 115.21 2rcu n THR 394 Ca -0.18 -4.53 -0.42 0.00 -3.05 0.00 0.00 64.05 55.86 2rcu n THR 394 Cb 0.99 -0.28 -0.01 0.00 -1.55 0.00 0.00 70.33 69.49 2rcu n THR 394 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 175.07 171.21 2rcu n PRO 395 N 0.20 2.19 -0.21 1.09 -0.04 -1.22 -4.70 135.00 132.32 2rcu n PRO 395 Ca 0.24 0.77 -0.09 0.00 -0.04 0.00 0.00 63.50 64.38 2rcu n PRO 395 Cb 0.65 -2.37 0.02 0.00 -0.04 0.00 0.00 33.50 31.77 2rcu n PRO 395 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2rcu h ALA 396 N 2.62 0.81 -2.20 0.55 0.00 -1.86 -3.45 119.26 115.72 2rcu h ALA 396 Ca -0.47 -0.32 -0.39 0.00 0.00 0.00 0.00 54.91 53.73 2rcu h ALA 396 Cb 1.28 -0.22 -0.14 0.00 0.00 0.00 0.00 17.79 18.71 2rcu h ALA 396 CO 0.63 0.67 -0.70 0.96 0.00 0.00 0.00 179.25 180.81 2rcu s ILE 397 N -5.00 1.34 0.44 0.00 -4.36 -1.26 -4.98 121.20 107.38 2rcu s ILE 397 Ca -0.12 -2.10 0.08 0.00 -0.26 0.00 0.00 60.65 58.25 2rcu s ILE 397 Cb 0.13 -2.10 -0.00 0.00 1.25 0.00 0.00 42.46 41.74 2rcu s ILE 397 CO 0.86 -0.55 0.45 0.42 0.24 0.00 0.00 174.94 176.36 2rcu s THR 398 N -3.22 2.57 -0.79 8.37 -4.23 -1.26 -4.95 115.64 112.13 2rcu s THR 398 Ca 0.23 -1.27 0.13 0.00 -1.18 0.00 0.00 61.69 59.60 2rcu s THR 398 Cb 0.03 -2.85 0.13 0.00 1.34 0.00 0.00 72.50 71.14 2rcu s THR 398 CO 0.06 0.00 1.42 -2.65 -0.54 0.00 0.00 174.62 172.90 2rcu n PRO 399 N -1.67 0.06 -0.01 3.99 -0.02 -1.26 -2.03 135.00 134.06 2rcu n PRO 399 Ca 0.05 0.40 0.08 0.00 -2.02 0.00 0.00 63.50 62.01 2rcu n PRO 399 Cb 0.62 -1.63 0.07 0.00 -0.02 0.00 0.00 33.50 32.53 2rcu n PRO 399 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2rcu n GLN 400 N -1.75 1.32 -1.66 -0.52 3.00 -1.26 -5.01 117.38 111.50 2rcu n GLN 400 Ca 0.02 -1.50 -0.42 0.00 -0.01 0.00 0.00 57.00 55.09 2rcu n GLN 400 Cb 0.12 -1.32 0.01 0.00 0.00 0.00 0.00 30.24 29.05 2rcu n GLN 400 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.06 177.49 2rcu n SER 401 N 0.93 2.04 -4.57 1.08 7.64 -0.86 -4.98 113.62 114.90 2rcu n SER 401 Ca 0.10 1.11 -0.40 0.00 1.01 0.00 0.00 58.87 60.69 2rcu n SER 401 Cb 0.41 -1.43 -0.10 0.00 -1.01 0.00 0.00 64.21 62.09 2rcu n SER 401 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 2rcu s GLN 402 N -2.02 3.74 0.34 1.43 -1.52 -1.26 -4.98 119.66 115.40 2rcu s GLN 402 Ca 0.60 -0.35 -0.27 0.00 -1.95 0.00 0.00 55.36 53.40 2rcu s GLN 402 Cb -0.55 -3.74 -0.13 0.00 -0.22 0.00 0.00 33.01 28.37 2rcu s GLN 402 CO 0.59 -0.36 1.02 -2.30 -0.25 0.00 0.00 175.29 173.99 2rcu n PRO 403 N 5.22 1.42 -1.69 2.91 -0.02 -1.26 -4.91 135.00 136.67 2rcu n PRO 403 Ca -0.11 0.50 -0.39 0.00 -2.02 0.00 0.00 63.50 61.48 2rcu n PRO 403 Cb 0.50 -1.95 0.03 0.00 -0.02 0.00 0.00 33.50 32.07 2rcu n PRO 403 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2rcu n ALA 404 N -0.03 1.03 -2.53 3.55 0.00 -0.33 -4.89 120.51 117.31 2rcu n ALA 404 Ca 0.09 0.15 -0.41 0.00 0.00 0.00 0.00 53.44 53.27 2rcu n ALA 404 Cb 0.35 -2.25 -0.02 0.00 0.00 0.00 0.00 19.45 17.53 2rcu n ALA 404 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2rcu s ALA 405 N -1.31 2.89 0.11 0.00 0.00 -1.26 -4.76 121.76 117.43 2rcu s ALA 405 Ca 0.69 -2.50 0.08 0.00 0.00 0.00 0.00 51.96 50.23 2rcu s ALA 405 Cb -0.46 -4.58 -0.04 0.00 0.00 0.00 0.00 23.12 18.04 2rcu s ALA 405 CO 0.52 -3.58 -0.21 -0.08 0.00 0.00 0.00 175.76 172.41 2rcu s THR 406 N 5.05 1.72 -1.38 0.00 -1.32 -1.26 -5.05 115.64 113.40 2rcu s THR 406 Ca 0.51 -1.58 -0.16 0.00 -1.21 0.00 0.00 61.69 59.25 2rcu s THR 406 Cb 0.01 -1.58 0.04 0.00 -1.51 0.00 0.00 72.50 69.46 2rcu s THR 406 CO -0.02 -0.09 2.07 -3.20 -2.21 0.00 0.00 174.62 171.18 2rcu n ASN 407 N 1.01 4.11 0.23 8.08 5.15 -1.26 -4.75 115.26 127.83 2rcu n ASN 407 Ca -0.19 -2.85 0.09 0.00 -0.60 0.00 0.00 54.58 51.02 2rcu n ASN 407 Cb 0.54 -1.66 0.54 0.00 -0.53 0.00 0.00 39.78 38.67 2rcu n ASN 407 CO 0.00 0.00 0.00 0.28 1.40 0.00 0.00 177.26 178.94 2rcu h SER 408 N 6.62 0.00 -0.22 1.20 0.02 -1.96 -1.56 113.55 117.65 2rcu h SER 408 Ca 0.52 0.00 0.06 0.00 -0.84 0.00 0.00 61.79 61.53 2rcu h SER 408 Cb 0.71 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.25 2rcu h SER 408 CO 1.75 0.23 0.18 0.28 -1.14 0.00 0.00 176.83 178.13 2rcu h SER 409 N 0.00 0.00 0.05 3.07 0.02 -1.85 0.16 113.55 114.99 2rcu h SER 409 Ca -0.00 0.00 -0.38 0.00 -0.84 0.00 0.00 61.79 60.57 2rcu h SER 409 Cb 0.54 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 63.04 2rcu h SER 409 CO 0.03 0.00 -2.25 0.00 -1.14 0.00 0.00 176.83 173.47 2rcu n ALA 410 N -2.50 1.19 0.18 3.77 0.00 -0.67 -4.50 120.51 117.98 2rcu n ALA 410 Ca 0.02 -0.89 0.06 0.00 0.00 0.00 0.00 53.44 52.63 2rcu n ALA 410 Cb 0.32 -0.32 0.24 0.00 0.00 0.00 0.00 19.45 19.69 2rcu n ALA 410 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 2rcu h SER 411 N -0.10 0.00 -3.56 0.00 0.02 -1.14 -3.42 113.55 105.35 2rcu h SER 411 Ca -0.52 0.00 -0.64 0.00 -0.84 0.00 0.00 61.79 59.79 2rcu h SER 411 Cb 1.90 0.00 -0.21 0.00 0.14 0.00 0.00 62.40 64.22 2rcu h SER 411 CO -0.06 0.37 -0.62 -0.69 -1.14 0.00 0.00 176.83 174.69 2rcu s VAL 412 N -3.35 4.36 -0.21 2.27 1.01 0.54 -4.47 120.40 120.55 2rcu s VAL 412 Ca 0.02 -0.16 -0.11 0.00 0.00 0.00 0.00 61.98 61.72 2rcu s VAL 412 Cb 0.09 -3.02 -0.05 0.00 0.00 0.00 0.00 36.38 33.41 2rcu s VAL 412 CO 0.69 0.37 0.20 -0.70 0.00 0.00 0.00 175.10 175.66 2rcu s GLU 413 N 1.32 4.16 -0.41 2.72 2.12 -0.11 -4.74 118.70 123.76 2rcu s GLU 413 Ca 0.05 -0.13 -0.20 0.00 0.36 0.00 0.00 54.97 55.04 2rcu s GLU 413 Cb -0.15 -3.47 0.02 0.00 0.26 0.00 0.00 34.13 30.79 2rcu s GLU 413 CO 0.03 0.17 0.63 0.99 -0.54 0.00 0.00 175.26 176.55 2rcu s THR 414 N 0.71 4.86 0.64 -1.70 2.01 -1.26 -0.94 115.64 119.96 2rcu s THR 414 Ca 0.11 0.28 -0.18 0.00 0.31 0.00 0.00 61.69 62.21 2rcu s THR 414 Cb -0.13 -4.15 -0.01 0.00 0.01 0.00 0.00 72.50 68.22 2rcu s THR 414 CO 0.02 -0.48 1.23 -0.76 -0.69 0.00 0.00 174.62 173.94 2rcu s LEU 415 N 2.76 3.55 -0.08 4.42 1.43 -0.07 -5.01 118.68 125.69 2rcu s LEU 415 Ca 0.23 2.43 -0.01 0.00 -1.03 0.00 0.00 54.13 55.75 2rcu s LEU 415 Cb -0.14 -4.60 0.03 0.00 0.03 0.00 0.00 46.19 41.50 2rcu s LEU 415 CO 0.17 -1.85 -0.03 -0.55 0.23 0.00 0.00 176.35 174.32 2rcu s SER 416 N -1.67 1.67 -0.12 2.29 0.15 -1.26 -4.70 113.70 110.06 2rcu s SER 416 Ca 0.78 -0.15 -0.07 0.00 0.70 0.00 0.00 55.95 57.21 2rcu s SER 416 Cb -0.32 -0.56 -0.04 0.00 -1.71 0.00 0.00 66.02 63.39 2rcu s SER 416 CO 0.38 -0.15 0.13 -0.36 1.20 0.00 0.00 173.24 174.43 2rcu s PHE 417 N 1.74 3.54 -0.58 3.44 0.08 -1.26 -4.96 117.98 119.99 2rcu s PHE 417 Ca 0.03 0.48 -0.22 0.00 0.12 0.00 0.00 56.93 57.33 2rcu s PHE 417 Cb -0.13 -1.95 0.06 0.00 -0.57 0.00 0.00 43.02 40.44 2rcu s PHE 417 CO -0.05 0.67 0.87 1.21 -0.10 0.00 0.00 175.22 177.82 2rcu s ASN 418 N -0.89 6.25 -0.24 1.36 2.47 -1.26 -5.03 114.94 117.60 2rcu s ASN 418 Ca 0.14 -0.74 -0.10 0.00 0.42 0.00 0.00 52.86 52.58 2rcu s ASN 418 Cb -0.12 -2.39 -0.05 0.00 -1.45 0.00 0.00 41.25 37.24 2rcu s ASN 418 CO 0.03 -1.22 0.15 -0.76 -3.72 0.00 0.00 177.10 171.58 2rcu s LEU 419 N 3.65 4.04 0.87 3.21 1.43 -1.26 -4.89 118.68 125.74 2rcu s LEU 419 Ca 0.23 0.07 -0.13 0.00 -1.03 0.00 0.00 54.13 53.28 2rcu s LEU 419 Cb -0.16 -2.09 0.12 0.00 0.03 0.00 0.00 46.19 44.09 2rcu s LEU 419 CO 0.14 0.05 1.18 -0.94 0.23 0.00 0.00 176.35 177.01 2rcu s SER 420 N 1.14 3.91 0.33 2.29 1.04 -1.26 -4.86 113.70 116.28 2rcu s SER 420 Ca 0.07 0.78 0.05 0.00 0.48 0.00 0.00 55.95 57.33 2rcu s SER 420 Cb -0.14 -1.24 0.69 0.00 0.10 0.00 0.00 66.02 65.43 2rcu s SER 420 CO 0.05 -2.28 1.89 1.23 0.98 0.00 0.00 173.24 175.10 2rcu h GLY 421 N -1.32 1.28 1.08 7.32 0.00 -1.99 -1.75 103.07 107.69 2rcu h GLY 421 Ca -0.47 -0.35 -0.10 0.00 0.00 0.00 0.00 47.33 46.41 2rcu h GLY 421 CO 0.61 0.17 0.00 0.00 0.00 0.00 0.00 176.54 177.32 2rcu h ALA 422 N 1.57 0.82 -0.36 3.60 0.00 -1.99 -2.02 119.26 120.88 2rcu h ALA 422 Ca 0.42 -0.31 -0.08 0.00 0.00 0.00 0.00 54.91 54.94 2rcu h ALA 422 Cb 0.49 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 2rcu h ALA 422 CO -0.19 0.66 -0.12 -0.07 0.00 0.00 0.00 179.25 179.53 2rcu h LEU 423 N 0.98 0.62 -0.43 0.00 -0.00 -1.71 -0.41 115.31 114.36 2rcu h LEU 423 Ca 0.17 -0.18 -0.17 0.00 -0.00 0.00 0.00 57.88 57.70 2rcu h LEU 423 Cb 0.56 -0.17 -0.00 0.00 -0.00 0.00 0.00 40.66 41.05 2rcu h LEU 423 CO 0.03 0.78 -0.56 0.11 -0.00 0.00 0.00 178.44 178.80 2rcu h LYS 424 N 0.58 0.67 -0.63 1.13 1.57 -1.16 -0.41 116.57 118.33 2rcu h LYS 424 Ca 0.10 -0.43 -0.07 0.00 -1.87 0.00 0.00 60.65 58.38 2rcu h LYS 424 Cb 0.55 0.05 -0.03 0.00 0.08 0.00 0.00 32.23 32.88 2rcu h LYS 424 CO 0.03 1.05 0.11 0.00 -0.57 0.00 0.00 179.45 180.07 2rcu h ALA 425 N 0.86 1.01 -0.76 3.86 0.00 -1.27 -1.59 119.26 121.38 2rcu h ALA 425 Ca 0.01 -0.25 -0.06 0.00 0.00 0.00 0.00 54.91 54.61 2rcu h ALA 425 Cb 1.13 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.64 2rcu h ALA 425 CO 0.11 0.63 0.26 0.78 0.00 0.00 0.00 179.25 181.03 2rcu h GLY 426 N 1.04 1.26 0.97 0.00 0.00 -0.79 -0.92 103.07 104.63 2rcu h GLY 426 Ca 0.19 -0.73 -0.12 0.00 0.00 0.00 0.00 47.33 46.68 2rcu h GLY 426 CO 0.01 0.68 -0.27 -2.22 0.00 0.00 0.00 176.54 174.75 2rcu h ILE 427 N 1.13 1.30 -0.90 2.60 2.04 -0.86 0.01 117.51 122.82 2rcu h ILE 427 Ca 0.25 -1.42 -0.02 0.00 1.00 0.00 0.00 64.86 64.67 2rcu h ILE 427 Cb 0.28 1.54 -0.04 0.00 -0.74 0.00 0.00 36.82 37.86 2rcu h ILE 427 CO -0.01 0.46 0.50 0.74 0.00 0.00 0.00 178.15 179.83 2rcu h THR 428 N 0.47 1.26 -0.25 -0.27 2.02 -1.15 -0.47 112.91 114.52 2rcu h THR 428 Ca 0.05 -0.64 -0.14 0.00 0.77 0.00 0.00 66.41 66.45 2rcu h THR 428 Cb 0.83 0.03 -0.01 0.00 -1.74 0.00 0.00 68.15 67.27 2rcu h THR 428 CO 0.07 0.29 -0.42 0.00 0.37 0.00 0.00 175.52 175.83 2rcu h ALA 429 N 1.27 0.80 -0.48 6.16 0.00 -1.07 -1.97 119.26 123.97 2rcu h ALA 429 Ca 0.32 -0.45 0.01 0.00 0.00 0.00 0.00 54.91 54.79 2rcu h ALA 429 Cb 0.02 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 2rcu h ALA 429 CO -0.05 0.65 0.30 0.00 0.00 0.00 0.00 179.25 180.16 2rcu h ALA 430 N 1.04 0.61 -0.75 0.00 0.00 -0.44 -1.79 119.26 117.93 2rcu h ALA 430 Ca 0.04 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 2rcu h ALA 430 Cb 0.94 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.53 2rcu h ALA 430 CO 0.08 0.02 0.35 -0.22 0.00 0.00 0.00 179.25 179.49 2rcu h LYS 431 N 0.61 1.09 -0.32 0.00 3.64 -0.99 -0.99 116.57 119.62 2rcu h LYS 431 Ca 0.18 -0.17 -0.03 0.00 -1.27 0.00 0.00 60.65 59.37 2rcu h LYS 431 Cb -0.03 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 31.58 2rcu h LYS 431 CO -0.06 0.86 0.09 0.93 -2.27 0.00 0.00 179.45 179.00 2rcu h GLU 432 N 1.06 0.51 -0.14 1.90 4.39 -1.13 0.65 114.58 121.81 2rcu h GLU 432 Ca 0.26 -0.11 -0.00 0.00 0.34 0.00 0.00 59.36 59.84 2rcu h GLU 432 Cb 0.13 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 28.70 2rcu h GLU 432 CO -0.03 0.56 0.07 -0.22 -1.16 0.00 0.00 179.01 178.23 2rcu h LYS 433 N 0.37 0.20 0.06 2.33 3.64 -1.30 -1.92 116.57 119.94 2rcu h LYS 433 Ca 0.10 -0.03 0.02 0.00 -1.27 0.00 0.00 60.65 59.48 2rcu h LYS 433 Cb 0.26 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 32.02 2rcu h LYS 433 CO -0.00 0.25 -0.19 0.35 -2.27 0.00 0.00 179.45 177.58 2rcu h PHE 434 N 0.11 -0.50 -0.86 1.91 3.57 -0.97 -1.59 116.94 118.60 2rcu h PHE 434 Ca 0.05 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.56 2rcu h PHE 434 Cb 0.11 0.22 -0.04 0.00 2.79 0.00 0.00 35.95 39.02 2rcu h PHE 434 CO -0.03 -0.28 0.52 -0.44 -2.23 0.00 0.00 178.31 175.85 2rcu h ASP 435 N -0.34 1.03 -0.29 0.41 3.32 -0.85 -1.24 116.42 118.46 2rcu h ASP 435 Ca 0.04 -0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.03 2rcu h ASP 435 Cb 0.39 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.66 2rcu h ASP 435 CO -0.14 0.79 0.18 0.74 -1.72 0.00 0.00 179.24 179.09 2rcu h THR 436 N 1.18 1.09 -0.27 0.35 2.02 -1.11 -2.31 112.91 113.87 2rcu h THR 436 Ca 0.31 -0.19 -0.03 0.00 0.77 0.00 0.00 66.41 67.26 2rcu h THR 436 Cb -0.05 0.70 -0.01 0.00 -1.74 0.00 0.00 68.15 67.04 2rcu h THR 436 CO -0.06 0.09 0.04 0.74 0.37 0.00 0.00 175.52 176.70 2rcu h THR 437 N 0.38 1.23 -0.52 3.16 2.02 -1.00 -3.17 112.91 115.01 2rcu h THR 437 Ca 0.11 -0.79 -0.02 0.00 0.77 0.00 0.00 66.41 66.48 2rcu h THR 437 Cb -0.01 1.24 -0.03 0.00 -1.74 0.00 0.00 68.15 67.61 2rcu h THR 437 CO -0.02 0.25 0.24 0.58 0.37 0.00 0.00 175.52 176.94 2rcu h VAL 438 N 0.25 1.18 -0.68 3.16 2.07 -1.17 -0.97 116.25 120.10 2rcu h VAL 438 Ca 0.08 -0.53 0.13 0.00 0.82 0.00 0.00 66.70 67.20 2rcu h VAL 438 Cb 0.34 0.53 -0.04 0.00 -1.52 0.00 0.00 31.29 30.59 2rcu h VAL 438 CO 0.01 0.22 0.46 0.50 0.02 0.00 0.00 177.57 178.77 2rcu h LYS 439 N 0.74 0.37 0.00 1.57 3.64 -1.39 -2.01 116.57 119.49 2rcu h LYS 439 Ca 0.18 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.54 2rcu h LYS 439 Cb 0.10 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 31.84 2rcu h LYS 439 CO -0.02 0.24 0.00 0.25 -2.27 0.00 0.00 179.45 177.65 2rcu n THR 440 N -4.47 0.08 -3.66 1.00 -2.24 -0.37 -4.85 114.28 99.77 2rcu n THR 440 Ca 0.12 0.02 -0.36 0.00 -2.27 0.00 0.00 64.05 61.56 2rcu n THR 440 Cb 0.48 -0.54 -0.09 0.00 -2.10 0.00 0.00 70.33 68.08 2rcu n THR 440 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 2rcu s LEU 441 N -2.78 4.16 0.11 3.22 2.96 -0.76 -2.31 118.68 123.28 2rcu s LEU 441 Ca 0.20 0.20 0.10 0.00 -0.22 0.00 0.00 54.13 54.42 2rcu s LEU 441 Cb 0.19 -2.14 -0.04 0.00 0.50 0.00 0.00 46.19 44.69 2rcu s LEU 441 CO 0.47 0.10 -0.25 -0.44 -1.32 0.00 0.00 176.35 174.91 2rcu s SER 442 N 0.78 3.43 -0.02 3.68 0.01 0.70 -4.98 113.70 117.29 2rcu s SER 442 Ca 0.09 -0.68 -0.03 0.00 1.31 0.00 0.00 55.95 56.64 2rcu s SER 442 Cb -0.13 -0.31 0.00 0.00 0.21 0.00 0.00 66.02 65.80 2rcu s SER 442 CO 0.02 0.19 0.08 -0.63 0.41 0.00 0.00 173.24 173.32 2rcu s ILE 443 N -1.03 0.03 0.23 1.44 1.01 -1.26 -0.87 121.20 120.75 2rcu s ILE 443 Ca 0.14 -0.28 -0.22 0.00 0.00 0.00 0.00 60.65 60.29 2rcu s ILE 443 Cb -0.10 -0.21 0.04 0.00 0.01 0.00 0.00 42.46 42.20 2rcu s ILE 443 CO 0.06 -0.15 0.78 -0.62 0.00 0.00 0.00 174.94 175.00 2rcu s ASP 444 N -0.47 -0.27 0.05 3.58 2.15 -0.66 -4.82 116.67 116.22 2rcu s ASP 444 Ca -0.05 -0.49 -0.01 0.00 0.43 0.00 0.00 52.55 52.43 2rcu s ASP 444 Cb -0.03 0.65 -0.04 0.00 -0.30 0.00 0.00 42.92 43.20 2rcu s ASP 444 CO 0.00 -1.18 -0.03 -0.94 -0.17 0.00 0.00 175.17 172.85 2rcu s SER 445 N -2.90 0.50 0.14 -0.34 1.04 -1.26 -0.26 113.70 110.62 2rcu s SER 445 Ca 0.10 -0.93 0.05 0.00 0.48 0.00 0.00 55.95 55.65 2rcu s SER 445 Cb -0.04 0.18 -0.04 0.00 0.10 0.00 0.00 66.02 66.22 2rcu s SER 445 CO 0.04 -0.55 -0.12 0.27 0.98 0.00 0.00 173.24 173.85 2rcu s ILE 446 N -3.57 1.29 -0.31 -1.02 -4.36 -0.55 -5.00 121.20 107.69 2rcu s ILE 446 Ca 0.04 -1.92 -0.01 0.00 -0.26 0.00 0.00 60.65 58.50 2rcu s ILE 446 Cb 0.05 -1.72 0.10 0.00 1.25 0.00 0.00 42.46 42.14 2rcu s ILE 446 CO -0.08 -0.59 0.09 -1.10 0.24 0.00 0.00 174.94 173.50 2rcu s GLN 447 N -3.26 0.73 -0.46 0.37 1.11 -1.26 -2.22 119.66 114.66 2rcu s GLN 447 Ca 0.14 -1.07 -0.27 0.00 0.01 0.00 0.00 55.36 54.16 2rcu s GLN 447 Cb -0.01 -2.01 0.03 0.00 -1.01 0.00 0.00 33.01 30.00 2rcu s GLN 447 CO 0.02 -0.98 1.04 0.12 0.01 0.00 0.00 175.29 175.51 2rcu s PHE 448 N 1.61 2.89 -1.30 0.91 5.36 0.66 -4.90 117.98 123.20 2rcu s PHE 448 Ca 0.09 0.61 0.23 0.00 -0.96 0.00 0.00 56.93 56.91 2rcu s PHE 448 Cb -0.17 -4.18 0.20 0.00 -0.34 0.00 0.00 43.02 38.53 2rcu s PHE 448 CO -0.25 -1.16 1.20 1.04 -1.46 0.00 0.00 175.22 174.60 2rcu n GLN 449 N 7.48 0.34 0.03 10.12 1.13 -1.26 -1.54 117.38 133.68 2rcu n GLN 449 Ca 0.09 -0.25 -0.02 0.00 -1.94 0.00 0.00 57.00 54.89 2rcu n GLN 449 Cb 0.49 -1.49 0.25 0.00 0.11 0.00 0.00 30.24 29.59 2rcu n GLN 449 CO 0.00 0.00 0.00 -0.09 -1.44 0.00 0.00 177.06 175.53 2rcu h ARG 450 N 0.61 0.45 -1.24 -1.09 2.43 -1.91 -3.44 114.38 110.18 2rcu h ARG 450 Ca 0.00 -0.14 0.37 0.00 -0.81 0.00 0.00 59.98 59.40 2rcu h ARG 450 Cb 0.54 -0.04 -0.13 0.00 -0.42 0.00 0.00 29.97 29.93 2rcu h ARG 450 CO 0.00 0.61 0.93 0.20 -1.51 0.00 0.00 179.97 180.20 2rcu s GLY 451 N -3.98 -0.45 0.00 2.80 0.00 -1.18 -4.99 107.32 99.52 2rcu s GLY 451 Ca -0.07 0.81 0.00 0.00 0.00 0.00 0.00 44.72 45.46 2rcu s GLY 451 CO 0.77 0.62 0.00 0.61 0.00 0.00 0.00 173.10 175.11 2rcu n GLY 452 N -0.53 4.24 0.24 0.20 0.00 -1.23 -3.56 105.19 104.54 2rcu n GLY 452 Ca -0.08 -0.40 0.01 0.00 0.00 0.00 0.00 46.02 45.55 2rcu n GLY 452 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2rcu h LYS 453 N 0.00 0.21 0.08 1.61 1.57 -0.63 -2.03 116.57 117.38 2rcu h LYS 453 Ca 0.00 -0.01 0.01 0.00 -1.87 0.00 0.00 60.65 58.78 2rcu h LYS 453 Cb 0.00 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.25 2rcu h LYS 453 CO 0.00 0.14 -0.12 1.49 -0.57 0.00 0.00 179.45 180.39 2rcu h GLU 454 N 0.22 -0.23 -0.00 3.15 4.81 -1.64 0.79 114.58 121.67 2rcu h GLU 454 Ca 0.33 0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.58 2rcu h GLU 454 Cb 0.51 0.05 -0.00 0.00 0.63 0.00 0.00 28.75 29.95 2rcu h GLU 454 CO -0.45 -0.15 0.00 0.35 -0.73 0.00 0.00 179.01 178.03 2rcu h PHE 455 N -0.24 0.00 -0.62 0.92 3.57 -1.74 -2.72 116.94 116.11 2rcu h PHE 455 Ca 0.02 -0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.47 2rcu h PHE 455 Cb 0.25 -0.00 -0.03 0.00 2.79 0.00 0.00 35.95 38.97 2rcu h PHE 455 CO -0.14 0.12 0.19 -0.07 -2.23 0.00 0.00 178.31 176.18 2rcu h LEU 456 N -0.12 0.91 -1.39 0.59 3.38 -1.22 -1.91 115.31 115.55 2rcu h LEU 456 Ca 0.00 -0.21 0.01 0.00 0.09 0.00 0.00 57.88 57.78 2rcu h LEU 456 Cb 0.12 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.60 2rcu h LEU 456 CO -0.00 0.88 0.42 0.11 0.09 0.00 0.00 178.44 179.94 2rcu h LYS 457 N 0.89 0.81 0.00 1.13 1.57 -0.87 -1.27 116.57 118.83 2rcu h LYS 457 Ca 0.20 -0.05 -0.06 0.00 -1.87 0.00 0.00 60.65 58.87 2rcu h LYS 457 Cb 0.29 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.41 2rcu h LYS 457 CO -0.01 0.53 -0.29 0.87 -0.57 0.00 0.00 179.45 179.99 2rcu h LYS 458 N 0.83 0.00 -0.28 3.15 1.57 -1.07 -1.04 116.57 119.73 2rcu h LYS 458 Ca 0.24 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.02 2rcu h LYS 458 Cb -0.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.26 2rcu h LYS 458 CO -0.06 0.29 0.00 1.63 -0.57 0.00 0.00 179.45 180.74 2rcu n LYS 459 N -3.85 1.60 -3.02 3.15 4.76 -0.70 -4.91 118.16 115.18 2rcu n LYS 459 Ca -0.02 -0.87 -0.22 0.00 -2.87 0.00 0.00 58.31 54.33 2rcu n LYS 459 Cb 0.37 -1.22 0.02 0.00 -1.84 0.00 0.00 35.03 32.37 2rcu n LYS 459 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 2rcu n GLN 460 N 0.20 -4.29 -4.19 1.97 1.13 -0.40 -5.01 117.38 106.80 2rcu n GLN 460 Ca 0.08 0.82 -0.28 0.00 -1.94 0.00 0.00 57.00 55.69 2rcu n GLN 460 Cb 0.22 -5.64 -0.08 0.00 0.11 0.00 0.00 30.24 24.86 2rcu n GLN 460 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 2rcu s LEU 461 N -6.57 3.29 -0.19 1.08 1.43 -0.56 -5.02 118.68 112.14 2rcu s LEU 461 Ca 0.29 -0.36 -0.29 0.00 -1.03 0.00 0.00 54.13 52.74 2rcu s LEU 461 Cb -0.13 -1.98 -0.01 0.00 0.03 0.00 0.00 46.19 44.09 2rcu s LEU 461 CO 0.36 0.12 1.31 -0.55 0.23 0.00 0.00 176.35 177.82 2rcu s SER 462 N -2.69 6.85 0.24 2.29 0.15 -1.26 -3.89 113.70 115.38 2rcu s SER 462 Ca 0.26 1.63 -0.04 0.00 0.70 0.00 0.00 55.95 58.50 2rcu s SER 462 Cb -0.10 -2.54 0.42 0.00 -1.71 0.00 0.00 66.02 62.10 2rcu s SER 462 CO 0.18 -0.85 1.77 -0.65 1.20 0.00 0.00 173.24 174.88 2rcu h PRO 463 N 8.61 0.57 -0.33 5.44 0.11 -1.91 -1.52 132.00 142.96 2rcu h PRO 463 Ca -0.27 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 65.80 2rcu h PRO 463 Cb 1.11 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 32.07 2rcu h PRO 463 CO 0.98 0.38 0.20 0.22 -0.21 0.00 0.00 178.00 179.57 2rcu h ASP 464 N 0.59 0.39 -0.72 -2.05 3.58 -1.98 -2.04 116.42 114.19 2rcu h ASP 464 Ca 0.40 -0.05 0.05 0.00 0.42 0.00 0.00 57.03 57.85 2rcu h ASP 464 Cb 0.51 -0.10 -0.04 0.00 1.72 0.00 0.00 39.33 41.41 2rcu h ASP 464 CO -0.32 0.32 0.47 0.00 -2.88 0.00 0.00 179.24 176.83 2rcu h ALA 465 N 1.08 1.64 -0.29 -0.78 0.00 -1.80 -2.13 119.26 116.98 2rcu h ALA 465 Ca 0.12 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.90 2rcu h ALA 465 Cb 0.00 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 2rcu h ALA 465 CO -0.02 0.27 -0.22 0.28 0.00 0.00 0.00 179.25 179.56 2rcu h VAL 466 N 0.81 1.30 -0.62 0.00 2.07 -0.71 -0.06 116.25 119.04 2rcu h VAL 466 Ca 0.30 -1.36 0.00 0.00 0.82 0.00 0.00 66.70 66.47 2rcu h VAL 466 Cb 0.15 1.54 -0.03 0.00 -1.52 0.00 0.00 31.29 31.43 2rcu h VAL 466 CO -0.09 0.43 0.40 0.00 0.02 0.00 0.00 177.57 178.33 2rcu h ALA 467 N 0.73 0.79 -0.59 1.67 0.00 -1.18 -1.06 119.26 119.61 2rcu h ALA 467 Ca 0.06 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 2rcu h ALA 467 Cb 0.76 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 2rcu h ALA 467 CO 0.06 0.23 0.07 1.96 0.00 0.00 0.00 179.25 181.57 2rcu h GLN 468 N 0.84 0.98 -0.50 0.00 1.08 -1.28 -2.07 115.11 114.16 2rcu h GLN 468 Ca 0.23 -0.26 0.00 0.00 -1.45 0.00 0.00 58.65 57.17 2rcu h GLN 468 Cb -0.08 -0.12 -0.02 0.00 -0.05 0.00 0.00 27.48 27.21 2rcu h GLN 468 CO -0.05 0.92 0.33 1.25 -0.95 0.00 0.00 178.83 180.33 2rcu h LEU 469 N 0.92 0.57 -0.95 1.46 5.85 -0.59 -2.38 115.31 120.19 2rcu h LEU 469 Ca 0.18 -0.02 0.09 0.00 0.84 0.00 0.00 57.88 58.98 2rcu h LEU 469 Cb 0.44 -0.14 -0.07 0.00 0.37 0.00 0.00 40.66 41.25 2rcu h LEU 469 CO 0.01 0.42 0.59 0.00 -0.34 0.00 0.00 178.44 179.12 2rcu h ALA 470 N 1.18 1.37 -0.48 1.25 0.00 -0.64 0.14 119.26 122.08 2rcu h ALA 470 Ca 0.18 0.01 -0.10 0.00 0.00 0.00 0.00 54.91 55.00 2rcu h ALA 470 Cb -0.08 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.47 2rcu h ALA 470 CO -0.04 0.27 -0.11 0.74 0.00 0.00 0.00 179.25 180.12 2rcu h PHE 471 N 1.01 1.03 0.10 0.00 0.04 -1.00 0.27 116.94 118.40 2rcu h PHE 471 Ca 0.44 -0.22 0.00 0.00 2.80 0.00 0.00 57.97 61.00 2rcu h PHE 471 Cb 0.33 -0.25 -0.01 0.00 2.20 0.00 0.00 35.95 38.22 2rcu h PHE 471 CO -0.02 1.00 -0.09 1.96 -0.60 0.00 0.00 178.31 180.55 2rcu h GLN 472 N 0.77 -0.21 -0.68 1.51 1.08 -0.87 -0.83 115.11 115.89 2rcu h GLN 472 Ca 0.12 0.01 -0.01 0.00 -1.45 0.00 0.00 58.65 57.33 2rcu h GLN 472 Cb 0.66 0.05 -0.03 0.00 -0.05 0.00 0.00 27.48 28.10 2rcu h GLN 472 CO 0.05 -0.14 0.38 1.98 -0.95 0.00 0.00 178.83 180.15 2rcu h MET 473 N -0.21 0.94 -0.71 1.46 4.05 -0.57 -1.60 114.93 118.28 2rcu h MET 473 Ca 0.00 -0.11 -0.03 0.00 -0.28 0.00 0.00 59.70 59.29 2rcu h MET 473 Cb 0.20 -0.19 -0.03 0.00 -0.80 0.00 0.00 31.60 30.78 2rcu h MET 473 CO -0.02 0.70 0.33 0.00 0.23 0.00 0.00 176.91 178.15 2rcu h ALA 474 N 1.19 0.92 -0.37 0.39 0.00 -0.33 -1.39 119.26 119.66 2rcu h ALA 474 Ca 0.24 -0.16 -0.09 0.00 0.00 0.00 0.00 54.91 54.90 2rcu h ALA 474 Cb 0.03 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 2rcu h ALA 474 CO -0.04 0.50 -0.15 0.35 0.00 0.00 0.00 179.25 179.91 2rcu h PHE 475 N 1.00 0.75 -0.45 0.00 3.57 -0.79 -0.07 116.94 120.96 2rcu h PHE 475 Ca 0.24 -0.14 -0.02 0.00 3.53 0.00 0.00 57.97 61.58 2rcu h PHE 475 Cb 0.14 -0.19 -0.02 0.00 2.79 0.00 0.00 35.95 38.67 2rcu h PHE 475 CO 0.01 0.79 0.21 1.25 -2.23 0.00 0.00 178.31 178.34 2rcu h LEU 476 N 0.61 0.59 -0.60 0.59 5.85 -1.03 0.12 115.31 121.45 2rcu h LEU 476 Ca 0.10 -0.14 -0.08 0.00 0.84 0.00 0.00 57.88 58.61 2rcu h LEU 476 Cb 0.61 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.46 2rcu h LEU 476 CO 0.04 0.56 0.07 -0.09 -0.34 0.00 0.00 178.44 178.68 2rcu h ARG 477 N 0.58 1.01 0.11 1.25 2.43 -0.89 0.14 114.38 119.01 2rcu h ARG 477 Ca 0.15 -0.29 -0.27 0.00 -0.81 0.00 0.00 59.98 58.76 2rcu h ARG 477 Cb 0.13 -0.11 0.03 0.00 -0.42 0.00 0.00 29.97 29.60 2rcu h ARG 477 CO -0.02 0.96 -1.14 0.37 -1.51 0.00 0.00 179.97 178.64 2rcu h GLN 478 N 0.91 0.57 0.00 0.20 4.15 -0.86 -3.41 115.11 116.68 2rcu h GLN 478 Ca 0.18 -0.77 0.00 0.00 0.77 0.00 0.00 58.65 58.83 2rcu h GLN 478 Cb 0.46 0.25 0.00 0.00 0.21 0.00 0.00 27.48 28.41 2rcu h GLN 478 CO 0.02 1.34 0.00 0.66 -1.93 0.00 0.00 178.83 178.92 2rcu n TYR 479 N -3.87 0.00 -2.54 3.99 4.01 0.40 -5.02 117.16 114.13 2rcu n TYR 479 Ca -0.14 0.00 -0.18 0.00 -0.16 0.00 0.00 57.90 57.43 2rcu n TYR 479 Cb 0.94 0.00 0.01 0.00 -0.31 0.00 0.00 39.34 39.98 2rcu n TYR 479 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2rcu n GLY 480 N 0.82 -0.33 3.22 2.72 0.00 0.48 -5.00 105.19 107.10 2rcu n GLY 480 Ca 0.00 -0.11 -0.13 0.00 0.00 0.00 0.00 46.02 45.78 2rcu n GLY 480 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2rcu s GLN 481 N -5.10 1.01 -0.18 1.61 -0.21 -1.26 -5.00 119.66 110.53 2rcu s GLN 481 Ca 0.09 -1.45 -0.01 0.00 0.02 0.00 0.00 55.36 54.01 2rcu s GLN 481 Cb -0.04 -0.37 -0.00 0.00 1.00 0.00 0.00 33.01 33.59 2rcu s GLN 481 CO 0.12 -0.03 -0.12 0.99 -2.12 0.00 0.00 175.29 174.13 2rcu s THR 482 N -3.53 2.90 0.20 -0.19 2.01 -1.26 -3.76 115.64 112.00 2rcu s THR 482 Ca 0.18 -0.68 0.07 0.00 0.31 0.00 0.00 61.69 61.57 2rcu s THR 482 Cb 0.05 -2.26 -0.05 0.00 0.01 0.00 0.00 72.50 70.25 2rcu s THR 482 CO 0.00 0.49 -0.12 0.68 -0.69 0.00 0.00 174.62 174.98 2rcu s VAL 483 N 1.01 1.57 -0.15 3.82 -7.23 -1.26 -4.82 120.40 113.35 2rcu s VAL 483 Ca -0.01 -2.17 -0.39 0.00 -1.81 0.00 0.00 61.98 57.60 2rcu s VAL 483 Cb -0.15 -2.04 -0.17 0.00 0.56 0.00 0.00 36.38 34.59 2rcu s VAL 483 CO -0.02 -0.60 1.54 0.00 -0.31 0.00 0.00 175.10 175.71 2rcu n ALA 484 N -0.35 -0.82 -3.08 1.32 0.00 -1.26 -4.84 120.51 111.47 2rcu n ALA 484 Ca -0.08 0.46 -0.20 0.00 0.00 0.00 0.00 53.44 53.62 2rcu n ALA 484 Cb 0.61 -2.11 -0.16 0.00 0.00 0.00 0.00 19.45 17.79 2rcu n ALA 484 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2rcu s THR 485 N 2.14 0.74 -0.07 0.00 2.01 -1.26 -2.16 115.64 117.05 2rcu s THR 485 Ca 0.93 -0.33 0.04 0.00 0.31 0.00 0.00 61.69 62.64 2rcu s THR 485 Cb -1.08 -0.67 0.00 0.00 0.01 0.00 0.00 72.50 70.76 2rcu s THR 485 CO 0.60 0.24 -0.18 -0.47 -0.69 0.00 0.00 174.62 174.11 2rcu s TYR 486 N 0.26 1.99 -0.12 4.92 6.04 0.14 -4.28 117.35 126.29 2rcu s TYR 486 Ca -0.04 -0.73 0.00 0.00 0.04 0.00 0.00 57.07 56.34 2rcu s TYR 486 Cb -0.09 -1.36 0.02 0.00 -1.04 0.00 0.00 41.96 39.49 2rcu s TYR 486 CO 0.00 -0.31 -0.12 -2.00 -1.54 0.00 0.00 175.55 171.59 2rcu s GLU 487 N 0.37 1.93 0.41 4.97 2.12 -0.50 -0.31 118.70 127.69 2rcu s GLU 487 Ca -0.13 -0.43 -0.26 0.00 0.36 0.00 0.00 54.97 54.51 2rcu s GLU 487 Cb -0.16 -1.80 -0.09 0.00 0.26 0.00 0.00 34.13 32.35 2rcu s GLU 487 CO 0.05 -0.19 1.31 -1.12 -0.54 0.00 0.00 175.26 174.77 2rcu s SER 488 N 1.40 6.24 -0.05 -1.70 0.01 -1.04 -0.97 113.70 117.60 2rcu s SER 488 Ca 0.01 2.67 -0.02 0.00 1.31 0.00 0.00 55.95 59.92 2rcu s SER 488 Cb -0.13 -2.64 0.03 0.00 0.21 0.00 0.00 66.02 63.49 2rcu s SER 488 CO -0.07 -0.90 0.10 0.00 0.41 0.00 0.00 173.24 172.79 2rcu s SER 490 N 0.79 7.36 -0.28 0.00 0.15 -1.26 -0.40 113.70 120.06 2rcu s SER 490 Ca -0.06 1.84 0.11 0.00 0.70 0.00 0.00 55.95 58.54 2rcu s SER 490 Cb -0.08 -2.58 0.55 0.00 -1.71 0.00 0.00 66.02 62.20 2rcu s SER 490 CO -0.03 -0.21 1.54 0.35 1.20 0.00 0.00 173.24 176.09 2rcu n THR 491 N 3.19 2.59 1.10 6.45 -2.24 -0.29 -4.58 114.28 120.50 2rcu n THR 491 Ca 0.04 -2.31 0.09 0.00 -2.27 0.00 0.00 64.05 59.60 2rcu n THR 491 Cb 0.49 -0.32 0.53 0.00 -2.10 0.00 0.00 70.33 68.92 2rcu n THR 491 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2rcu n ALA 492 N -0.87 2.15 0.44 6.98 0.00 -1.25 -1.91 120.51 126.04 2rcu n ALA 492 Ca 0.34 -0.11 0.11 0.00 0.00 0.00 0.00 53.44 53.78 2rcu n ALA 492 Cb 1.10 -1.29 0.45 0.00 0.00 0.00 0.00 19.45 19.71 2rcu n ALA 492 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2rcu n ALA 493 N -1.02 1.70 -2.66 0.00 0.00 -1.26 0.34 120.51 117.62 2rcu n ALA 493 Ca 0.13 0.05 -0.27 0.00 0.00 0.00 0.00 53.44 53.35 2rcu n ALA 493 Cb 0.07 -1.36 -0.08 0.00 0.00 0.00 0.00 19.45 18.07 2rcu n ALA 493 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2rcu s PHE 494 N -3.24 2.84 -0.04 0.00 0.08 -0.80 -4.42 117.98 112.39 2rcu s PHE 494 Ca 0.05 -0.14 -0.36 0.00 0.12 0.00 0.00 56.93 56.61 2rcu s PHE 494 Cb 0.10 -1.38 -0.14 0.00 -0.57 0.00 0.00 43.02 41.02 2rcu s PHE 494 CO 0.38 0.51 1.67 1.17 -0.10 0.00 0.00 175.22 178.85 2rcu n LYS 495 N -0.07 1.71 -1.43 0.44 3.00 -0.07 -0.52 118.16 121.22 2rcu n LYS 495 Ca -0.10 0.62 -0.15 0.00 -0.00 0.00 0.00 58.31 58.68 2rcu n LYS 495 Cb 0.55 -2.37 -0.07 0.00 0.00 0.00 0.00 35.03 33.14 2rcu n LYS 495 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.40 178.12 2rcu n HIS 496 N 4.72 -0.05 -2.13 5.64 8.25 -1.26 -4.21 115.22 126.19 2rcu n HIS 496 Ca 0.21 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.27 2rcu n HIS 496 Cb 0.23 -3.03 -0.02 0.00 1.12 0.00 0.00 29.99 28.29 2rcu n HIS 496 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 2rcu s GLY 497 N -2.49 2.89 0.00 -1.41 0.00 0.32 -4.80 107.32 101.83 2rcu s GLY 497 Ca 0.00 1.24 0.00 0.00 0.00 0.00 0.00 44.72 45.96 2rcu s GLY 497 CO 0.00 1.95 0.00 0.54 0.00 0.00 0.00 173.10 175.59 2rcu n ARG 498 N 1.11 0.00 -4.19 2.90 1.74 -1.26 -4.04 116.66 112.92 2rcu n ARG 498 Ca 0.01 0.00 -0.11 0.00 -0.77 0.00 0.00 57.85 56.98 2rcu n ARG 498 Cb 0.42 0.00 -0.10 0.00 -1.02 0.00 0.00 32.46 31.76 2rcu n ARG 498 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 2rcu s THR 499 N 0.16 0.72 0.14 0.55 -4.23 -1.26 -1.14 115.64 110.58 2rcu s THR 499 Ca 0.00 -1.96 0.06 0.00 -1.18 0.00 0.00 61.69 58.62 2rcu s THR 499 Cb 0.00 -1.79 -0.04 0.00 1.34 0.00 0.00 72.50 72.01 2rcu s THR 499 CO 0.00 -0.78 -0.14 -0.70 -0.54 0.00 0.00 174.62 172.46 2rcu s GLU 500 N -3.85 1.11 -0.27 3.99 2.56 0.46 -4.80 118.70 117.91 2rcu s GLU 500 Ca 0.15 -1.35 -0.18 0.00 0.00 0.00 0.00 54.97 53.59 2rcu s GLU 500 Cb 0.05 -0.96 -0.02 0.00 2.00 0.00 0.00 34.13 35.20 2rcu s GLU 500 CO -0.02 0.18 0.52 0.99 -0.56 0.00 0.00 175.26 176.37 2rcu s THR 501 N -2.41 5.06 0.10 -1.70 2.01 -1.26 -1.44 115.64 115.99 2rcu s THR 501 Ca 0.13 0.85 -0.29 0.00 0.31 0.00 0.00 61.69 62.68 2rcu s THR 501 Cb -0.03 -3.85 -0.06 0.00 0.01 0.00 0.00 72.50 68.57 2rcu s THR 501 CO 0.04 0.05 0.94 -0.63 -0.69 0.00 0.00 174.62 174.32 2rcu s ILE 502 N 2.34 4.54 -0.70 1.82 1.01 -0.14 -4.74 121.20 125.33 2rcu s ILE 502 Ca 0.21 2.02 -0.09 0.00 0.00 0.00 0.00 60.65 62.79 2rcu s ILE 502 Cb -0.16 -4.30 0.18 0.00 0.01 0.00 0.00 42.46 38.20 2rcu s ILE 502 CO 0.10 0.32 0.59 -0.13 0.00 0.00 0.00 174.94 175.81 2rcu s ARG 503 N 0.03 3.08 0.52 2.79 1.81 -1.26 -1.42 118.95 124.50 2rcu s ARG 503 Ca 0.46 -2.38 0.30 0.00 -1.72 0.00 0.00 55.73 52.39 2rcu s ARG 503 Cb -0.23 -4.11 1.30 0.00 -0.45 0.00 0.00 34.95 31.45 2rcu s ARG 503 CO 0.29 -1.24 1.97 -1.35 -0.68 0.00 0.00 175.30 174.29 2rcu h PRO 504 N 7.63 0.00 -6.22 3.54 0.11 -1.94 -3.41 132.00 131.71 2rcu h PRO 504 Ca 0.01 0.00 -0.56 0.00 0.11 0.00 0.00 66.00 65.56 2rcu h PRO 504 Cb 1.01 0.00 -0.09 0.00 0.11 0.00 0.00 31.00 32.03 2rcu h PRO 504 CO 0.76 0.09 0.97 0.00 -0.21 0.00 0.00 178.00 179.61 2rcu s ALA 505 N -3.76 2.82 0.45 -0.75 0.00 -1.26 -4.77 121.76 114.49 2rcu s ALA 505 Ca 0.00 -1.42 0.05 0.00 0.00 0.00 0.00 51.96 50.59 2rcu s ALA 505 Cb 0.10 -4.18 -0.05 0.00 0.00 0.00 0.00 23.12 18.99 2rcu s ALA 505 CO 0.57 -3.17 0.02 -1.54 0.00 0.00 0.00 175.76 171.64 2rcu s SER 506 N 3.68 4.00 0.22 0.00 1.04 -1.26 -4.80 113.70 116.58 2rcu s SER 506 Ca 0.33 -1.45 -0.08 0.00 0.48 0.00 0.00 55.95 55.23 2rcu s SER 506 Cb -0.09 -0.08 0.26 0.00 0.10 0.00 0.00 66.02 66.21 2rcu s SER 506 CO 0.15 -0.60 1.84 0.40 0.98 0.00 0.00 173.24 176.01 2rcu h ILE 507 N 1.60 1.05 -0.33 -1.02 2.04 -1.93 -0.57 117.51 118.35 2rcu h ILE 507 Ca -0.44 -0.30 -0.03 0.00 1.00 0.00 0.00 64.86 65.09 2rcu h ILE 507 Cb 1.27 0.09 -0.01 0.00 -0.74 0.00 0.00 36.82 37.42 2rcu h ILE 507 CO 0.78 0.16 0.10 -0.26 0.00 0.00 0.00 178.15 178.93 2rcu h PHE 508 N 0.88 0.53 -0.28 1.37 0.04 -1.95 -1.17 116.94 116.36 2rcu h PHE 508 Ca 0.33 -0.06 -0.11 0.00 2.80 0.00 0.00 57.97 60.93 2rcu h PHE 508 Cb 0.12 -0.15 -0.01 0.00 2.20 0.00 0.00 35.95 38.10 2rcu h PHE 508 CO -0.04 0.54 -0.30 1.79 -0.60 0.00 0.00 178.31 179.70 2rcu h THR 509 N 0.37 1.28 -0.38 -1.55 1.35 -1.78 -1.64 112.91 110.57 2rcu h THR 509 Ca 0.10 -1.39 -0.01 0.00 -0.55 0.00 0.00 66.41 64.56 2rcu h THR 509 Cb 0.26 1.38 -0.02 0.00 -1.73 0.00 0.00 68.15 68.05 2rcu h THR 509 CO -0.00 0.45 0.18 0.50 -0.25 0.00 0.00 175.52 176.39 2rcu h LYS 510 N 0.51 0.54 -0.19 4.72 3.64 -1.04 0.14 116.57 124.90 2rcu h LYS 510 Ca 0.06 -0.08 -0.01 0.00 -1.27 0.00 0.00 60.65 59.36 2rcu h LYS 510 Cb 0.77 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.48 2rcu h LYS 510 CO 0.06 0.49 0.09 -0.09 -2.27 0.00 0.00 179.45 177.73 2rcu h ARG 511 N 0.47 0.27 -0.33 1.90 2.43 -1.10 -0.96 114.38 117.07 2rcu h ARG 511 Ca 0.13 -0.04 -0.13 0.00 -0.81 0.00 0.00 59.98 59.13 2rcu h ARG 511 Cb 0.12 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.61 2rcu h ARG 511 CO -0.02 0.29 -0.31 0.00 -1.51 0.00 0.00 179.97 178.43 2rcu h SER 513 N 0.61 0.84 -0.71 0.00 0.02 -0.59 -2.39 113.55 111.33 2rcu h SER 513 Ca 0.07 -0.34 0.07 0.00 -0.84 0.00 0.00 61.79 60.75 2rcu h SER 513 Cb 0.83 -0.23 -0.06 0.00 0.14 0.00 0.00 62.40 63.08 2rcu h SER 513 CO 0.07 0.99 0.40 -0.08 -1.14 0.00 0.00 176.83 177.06 2rcu h GLU 514 N 0.68 0.69 -0.23 3.45 4.57 -1.02 -0.60 114.58 122.12 2rcu h GLU 514 Ca 0.12 -0.04 -0.01 0.00 -1.18 0.00 0.00 59.36 58.25 2rcu h GLU 514 Cb 0.60 -0.16 -0.01 0.00 -0.16 0.00 0.00 28.75 29.02 2rcu h GLU 514 CO 0.04 0.46 0.12 0.00 -1.18 0.00 0.00 179.01 178.44 2rcu h ALA 515 N 1.38 0.30 -0.26 2.92 0.00 -1.12 -0.01 119.26 122.47 2rcu h ALA 515 Ca 0.33 -0.08 -0.17 0.00 0.00 0.00 0.00 54.91 54.99 2rcu h ALA 515 Cb 0.24 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.94 2rcu h ALA 515 CO -0.20 -0.15 -0.51 0.74 0.00 0.00 0.00 179.25 179.12 2rcu h PHE 516 N 0.26 1.03 0.02 0.00 -1.00 -1.22 -1.55 116.94 114.48 2rcu h PHE 516 Ca 0.08 -0.37 -0.23 0.00 2.81 0.00 0.00 57.97 60.27 2rcu h PHE 516 Cb 0.09 -0.19 -0.03 0.00 3.61 0.00 0.00 35.95 39.43 2rcu h PHE 516 CO -0.03 1.18 -1.22 0.28 -1.61 0.00 0.00 178.31 176.92 2rcu h VAL 517 N 0.57 0.99 0.00 -0.55 2.07 -1.07 -3.37 116.25 114.90 2rcu h VAL 517 Ca 0.01 -2.23 -0.06 0.00 0.82 0.00 0.00 66.70 65.24 2rcu h VAL 517 Cb 1.12 2.42 -0.01 0.00 -1.52 0.00 0.00 31.29 33.30 2rcu h VAL 517 CO 0.11 0.44 -2.06 0.54 0.02 0.00 0.00 177.57 176.63 2rcu n ARG 518 N -4.31 0.66 -2.84 1.57 1.74 -0.04 -4.70 116.66 108.75 2rcu n ARG 518 Ca -0.29 -0.17 -0.11 0.00 -0.77 0.00 0.00 57.85 56.51 2rcu n ARG 518 Cb 0.72 -1.52 0.05 0.00 -1.02 0.00 0.00 32.46 30.69 2rcu n ARG 518 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 2rcu n ASP 519 N -2.33 -0.45 0.30 0.55 3.85 -1.10 -4.98 116.55 112.38 2rcu n ASP 519 Ca -0.08 -3.00 0.18 0.00 -0.71 0.00 0.00 54.79 51.17 2rcu n ASP 519 Cb 0.66 0.43 0.95 0.00 -1.35 0.00 0.00 41.12 41.81 2rcu n ASP 519 CO 0.00 0.00 0.00 1.55 -1.01 0.00 0.00 177.20 177.74 2rcu h PRO 520 N 2.78 0.00 0.00 0.11 0.13 -1.45 -0.93 132.00 132.65 2rcu h PRO 520 Ca -0.08 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.05 2rcu h PRO 520 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 2rcu h PRO 520 CO 0.28 0.03 0.00 0.66 -0.23 0.00 0.00 178.00 178.74 2rcu h SER 521 N 0.00 0.00 0.70 1.44 4.64 -1.94 -3.28 113.55 115.11 2rcu h SER 521 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2rcu h SER 521 Cb 0.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.27 2rcu h SER 521 CO 0.00 0.00 -0.06 0.29 -0.87 0.00 0.00 176.83 176.19 2rcu n LYS 522 N -2.50 0.27 -4.45 4.77 5.02 -0.35 -4.84 118.16 116.08 2rcu n LYS 522 Ca 0.04 -0.04 -0.20 0.00 -2.02 0.00 0.00 58.31 56.09 2rcu n LYS 522 Cb 0.41 -1.50 -0.15 0.00 -0.02 0.00 0.00 35.03 33.77 2rcu n LYS 522 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 2rcu s HIS 523 N -2.76 0.98 0.71 2.13 3.76 -1.24 -5.14 115.29 113.73 2rcu s HIS 523 Ca 0.21 -0.21 -0.12 0.00 -0.15 0.00 0.00 55.06 54.80 2rcu s HIS 523 Cb 0.20 -0.66 0.02 0.00 1.11 0.00 0.00 32.58 33.25 2rcu s HIS 523 CO 0.51 -0.05 1.08 -1.54 -0.85 0.00 0.00 174.74 173.89 2rcu s SER 524 N -0.07 4.99 0.29 1.40 1.04 -1.26 -4.86 113.70 115.23 2rcu s SER 524 Ca 0.01 1.79 0.00 0.00 0.48 0.00 0.00 55.95 58.23 2rcu s SER 524 Cb -0.06 -2.52 0.52 0.00 0.10 0.00 0.00 66.02 64.06 2rcu s SER 524 CO -0.00 -1.71 1.88 1.62 0.98 0.00 0.00 173.24 176.01 2rcu h VAL 525 N -0.67 1.02 -0.77 5.02 3.04 -1.94 -0.95 116.25 121.01 2rcu h VAL 525 Ca -0.44 -0.36 -0.02 0.00 -1.01 0.00 0.00 66.70 64.86 2rcu h VAL 525 Cb 1.23 -0.12 -0.04 0.00 -2.01 0.00 0.00 31.29 30.35 2rcu h VAL 525 CO 0.54 0.19 0.38 1.23 -1.01 0.00 0.00 177.57 178.91 2rcu h GLY 526 N 1.05 1.17 1.10 3.17 0.00 -1.93 -0.29 103.07 107.35 2rcu h GLY 526 Ca 0.44 -0.57 -0.08 0.00 0.00 0.00 0.00 47.33 47.12 2rcu h GLY 526 CO -0.19 0.54 0.11 0.83 0.00 0.00 0.00 176.54 177.83 2rcu h GLU 527 N 1.07 1.10 -0.39 4.80 5.08 -1.71 -0.35 114.58 124.19 2rcu h GLU 527 Ca 0.27 -0.29 -0.05 0.00 -1.00 0.00 0.00 59.36 58.28 2rcu h GLU 527 Cb 0.09 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.20 2rcu h GLU 527 CO -0.04 1.01 0.04 -0.07 -1.00 0.00 0.00 179.01 178.96 2rcu h LEU 528 N 1.03 0.63 -0.67 1.33 3.38 -0.95 -1.37 115.31 118.70 2rcu h LEU 528 Ca 0.20 -0.27 0.05 0.00 0.09 0.00 0.00 57.88 57.95 2rcu h LEU 528 Cb 0.44 -0.17 -0.05 0.00 0.09 0.00 0.00 40.66 40.97 2rcu h LEU 528 CO 0.01 0.75 0.39 1.56 0.09 0.00 0.00 178.44 181.24 2rcu h GLN 529 N 0.49 0.72 -0.17 1.13 4.20 -0.87 -0.84 115.11 119.77 2rcu h GLN 529 Ca 0.12 -0.04 0.01 0.00 0.06 0.00 0.00 58.65 58.79 2rcu h GLN 529 Cb 0.40 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 28.00 2rcu h GLN 529 CO 0.01 0.47 0.08 1.25 -0.67 0.00 0.00 178.83 179.98 2rcu h HIS 530 N 0.74 0.15 -0.84 2.96 2.76 -0.85 -0.86 115.15 119.20 2rcu h HIS 530 Ca 0.29 0.01 0.15 0.00 -2.20 0.00 0.00 60.37 58.62 2rcu h HIS 530 Cb 0.12 -0.04 -0.10 0.00 1.55 0.00 0.00 27.41 28.94 2rcu h HIS 530 CO -0.06 0.09 0.42 0.52 -1.30 0.00 0.00 177.93 177.59 2rcu h MET 531 N 0.18 0.57 -0.38 5.26 2.86 -0.80 -0.68 114.93 121.95 2rcu h MET 531 Ca 0.07 -0.03 -0.08 0.00 -2.06 0.00 0.00 59.70 57.60 2rcu h MET 531 Cb 0.02 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 31.54 2rcu h MET 531 CO -0.05 0.38 -0.06 0.52 1.06 0.00 0.00 176.91 178.76 2rcu h MET 532 N 0.59 0.71 -0.88 1.72 2.07 -0.83 -1.55 114.93 116.76 2rcu h MET 532 Ca 0.47 -0.26 0.15 0.00 -2.07 0.00 0.00 59.70 57.99 2rcu h MET 532 Cb 0.69 -0.05 -0.09 0.00 -1.87 0.00 0.00 31.60 30.27 2rcu h MET 532 CO -0.38 0.84 0.48 0.00 1.07 0.00 0.00 176.91 178.92 2rcu h ALA 533 N 0.85 1.35 -0.25 6.32 0.00 -0.71 -0.11 119.26 126.71 2rcu h ALA 533 Ca 0.10 0.08 -0.09 0.00 0.00 0.00 0.00 54.91 55.00 2rcu h ALA 533 Cb 0.56 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 2rcu h ALA 533 CO 0.03 -0.04 -0.19 0.93 0.00 0.00 0.00 179.25 179.98 2rcu h GLU 534 N 0.69 0.56 -0.43 0.00 4.39 -0.94 -0.02 114.58 118.83 2rcu h GLU 534 Ca 0.48 -0.28 0.08 0.00 0.34 0.00 0.00 59.36 59.98 2rcu h GLU 534 Cb 0.66 -0.00 -0.07 0.00 -0.10 0.00 0.00 28.75 29.24 2rcu h GLU 534 CO -0.35 0.86 0.01 0.00 -1.16 0.00 0.00 179.01 178.36 2rcu h SER 536 N 0.12 0.61 -0.05 0.00 0.87 -0.82 -0.37 113.55 113.91 2rcu h SER 536 Ca 0.22 -0.25 0.01 0.00 -1.23 0.00 0.00 61.79 60.53 2rcu h SER 536 Cb 0.31 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 62.10 2rcu h SER 536 CO -0.35 0.71 -0.02 0.50 -0.53 0.00 0.00 176.83 177.14 2rcu h LYS 537 N 0.48 -0.01 -0.79 2.24 3.64 -0.63 -1.08 116.57 120.42 2rcu h LYS 537 Ca 0.12 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.47 2rcu h LYS 537 Cb 0.35 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.14 2rcu h LYS 537 CO 0.01 -0.01 0.38 -0.92 -2.27 0.00 0.00 179.45 176.64 2rcu h TYR 538 N -0.01 1.14 -0.58 1.91 3.20 -0.99 -0.12 116.97 121.51 2rcu h TYR 538 Ca 0.03 -0.06 -0.03 0.00 3.14 0.00 0.00 58.73 61.81 2rcu h TYR 538 Cb 0.05 -0.35 -0.03 0.00 1.54 0.00 0.00 36.73 37.94 2rcu h TYR 538 CO -0.12 0.83 0.26 1.25 -1.64 0.00 0.00 178.16 178.75 2rcu h HIS 539 N 1.12 0.86 -0.63 -3.82 2.76 -0.82 -0.45 115.15 114.17 2rcu h HIS 539 Ca 0.27 -0.05 0.07 0.00 -2.20 0.00 0.00 60.37 58.46 2rcu h HIS 539 Cb 0.12 -0.26 -0.06 0.00 1.55 0.00 0.00 27.41 28.76 2rcu h HIS 539 CO 0.01 0.67 0.32 0.78 -1.30 0.00 0.00 177.93 178.42 2rcu h GLY 540 N 0.80 0.91 0.88 5.26 0.00 -0.90 0.61 103.07 110.63 2rcu h GLY 540 Ca 0.20 -0.21 -0.01 0.00 0.00 0.00 0.00 47.33 47.31 2rcu h GLY 540 CO -0.02 0.11 0.05 -1.61 0.00 0.00 0.00 176.54 175.06 2rcu h GLN 541 N 0.59 0.17 -0.88 4.80 5.75 -0.57 -1.36 115.11 123.61 2rcu h GLN 541 Ca 0.29 -0.03 0.08 0.00 -0.15 0.00 0.00 58.65 58.84 2rcu h GLN 541 Cb 0.23 -0.03 -0.07 0.00 1.07 0.00 0.00 27.48 28.68 2rcu h GLN 541 CO -0.21 0.26 0.54 -0.07 -2.65 0.00 0.00 178.83 176.70 2rcu h LEU 542 N 0.04 0.82 -0.13 -2.39 3.38 -0.80 -1.67 115.31 114.55 2rcu h LEU 542 Ca 0.04 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 2rcu h LEU 542 Cb 0.15 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 2rcu h LEU 542 CO -0.00 0.50 0.04 0.74 0.09 0.00 0.00 178.44 179.80 2rcu h THR 543 N 0.94 1.19 -0.56 0.22 2.02 -0.77 0.75 112.91 116.70 2rcu h THR 543 Ca 0.40 -0.59 0.00 0.00 0.77 0.00 0.00 66.41 66.99 2rcu h THR 543 Cb 0.26 1.33 -0.03 0.00 -1.74 0.00 0.00 68.15 67.97 2rcu h THR 543 CO -0.20 0.18 0.36 0.50 0.37 0.00 0.00 175.52 176.72 2rcu h LYS 544 N 0.02 0.74 -0.29 6.66 3.64 -1.10 -1.86 116.57 124.39 2rcu h LYS 544 Ca 0.04 -0.05 -0.03 0.00 -1.27 0.00 0.00 60.65 59.34 2rcu h LYS 544 Cb 0.24 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 31.89 2rcu h LYS 544 CO -0.00 0.51 0.07 0.93 -2.27 0.00 0.00 179.45 178.68 2rcu h GLU 545 N 0.75 0.46 -0.59 1.90 5.08 -1.16 -2.79 114.58 118.24 2rcu h GLU 545 Ca 0.20 -0.11 -0.03 0.00 -1.00 0.00 0.00 59.36 58.42 2rcu h GLU 545 Cb -0.06 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.10 2rcu h GLU 545 CO -0.04 0.54 0.25 0.00 -1.00 0.00 0.00 179.01 178.76 2rcu h ALA 546 N 0.90 0.76 0.00 3.43 0.00 -0.64 0.22 119.26 123.94 2rcu h ALA 546 Ca 0.09 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 2rcu h ALA 546 Cb 0.29 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 2rcu h ALA 546 CO 0.00 0.36 -0.00 0.00 0.00 0.00 0.00 179.25 179.61 2rcu h ALA 547 N 1.09 1.83 -0.40 0.00 0.00 -1.33 -1.16 119.26 119.28 2rcu h ALA 547 Ca 0.20 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.10 2rcu h ALA 547 Cb 0.18 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2rcu h ALA 547 CO -0.02 0.00 0.00 -1.33 0.00 0.00 0.00 179.25 177.91 2rcu n MET 548 N -4.30 2.43 -1.06 0.00 2.00 -0.42 -4.70 117.12 111.07 2rcu n MET 548 Ca -0.03 -1.66 -0.02 0.00 0.00 0.00 0.00 57.70 55.99 2rcu n MET 548 Cb 0.09 -1.54 -0.01 0.00 0.00 0.00 0.00 33.22 31.76 2rcu n MET 548 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2rcu n GLY 549 N 0.93 0.56 1.94 3.03 0.00 -0.44 -4.61 105.19 106.60 2rcu n GLY 549 Ca 0.15 -0.47 -0.16 0.00 0.00 0.00 0.00 46.02 45.53 2rcu n GLY 549 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2rcu n GLN 550 N -2.57 2.38 -1.64 1.61 1.13 0.66 -4.52 117.38 114.43 2rcu n GLN 550 Ca -0.02 -3.06 -0.30 0.00 -1.94 0.00 0.00 57.00 51.68 2rcu n GLN 550 Cb 0.12 -2.10 0.21 0.00 0.11 0.00 0.00 30.24 28.58 2rcu n GLN 550 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 2rcu s GLY 551 N -1.55 1.73 -0.02 1.08 0.00 -1.26 -4.54 107.32 102.77 2rcu s GLY 551 Ca 0.54 -1.17 0.15 0.00 0.00 0.00 0.00 44.72 44.24 2rcu s GLY 551 CO 0.09 -0.33 0.40 1.97 0.00 0.00 0.00 173.10 175.23 2rcu n PHE 552 N -4.16 0.00 0.02 1.90 1.16 -1.26 -4.75 117.46 110.37 2rcu n PHE 552 Ca 0.15 0.00 -0.13 0.00 -1.87 0.00 0.00 57.45 55.60 2rcu n PHE 552 Cb 0.59 -0.26 -0.09 0.00 -1.61 0.00 0.00 39.48 38.11 2rcu n PHE 552 CO 0.00 0.00 0.00 -0.44 -1.87 0.00 0.00 176.76 174.45 2rcu h ASP 553 N 0.00 -0.03 -0.65 5.98 3.32 -1.95 -1.86 116.42 121.22 2rcu h ASP 553 Ca 0.00 -0.32 -0.06 0.00 0.02 0.00 0.00 57.03 56.66 2rcu h ASP 553 Cb 0.61 0.01 -0.03 0.00 0.22 0.00 0.00 39.33 40.14 2rcu h ASP 553 CO 0.00 0.31 0.17 0.03 -1.72 0.00 0.00 179.24 178.03 2rcu h ARG 554 N -0.38 1.05 0.11 3.56 2.47 -1.93 0.49 114.38 119.76 2rcu h ARG 554 Ca -0.00 -0.24 -0.01 0.00 -1.26 0.00 0.00 59.98 58.47 2rcu h ARG 554 Cb 0.35 -0.15 0.00 0.00 -1.65 0.00 0.00 29.97 28.53 2rcu h ARG 554 CO 0.01 0.93 -0.06 1.25 0.56 0.00 0.00 179.97 182.66 2rcu h HIS 555 N 1.00 -0.14 -0.82 3.04 2.76 -1.83 -0.13 115.15 119.03 2rcu h HIS 555 Ca 0.21 -0.00 0.07 0.00 -2.20 0.00 0.00 60.37 58.45 2rcu h HIS 555 Cb 0.34 0.05 -0.05 0.00 1.55 0.00 0.00 27.41 29.29 2rcu h HIS 555 CO 0.02 0.15 0.54 -0.07 -1.30 0.00 0.00 177.93 177.27 2rcu h LEU 556 N -0.43 0.78 -0.30 0.26 3.38 -1.28 -2.11 115.31 115.61 2rcu h LEU 556 Ca -0.02 0.01 0.03 0.00 0.09 0.00 0.00 57.88 57.99 2rcu h LEU 556 Cb 0.35 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.92 2rcu h LEU 556 CO 0.03 0.50 0.13 0.22 0.09 0.00 0.00 178.44 179.41 2rcu h TYR 557 N 0.89 0.24 -0.17 1.13 3.20 -0.62 -2.32 116.97 119.31 2rcu h TYR 557 Ca 0.36 0.01 -0.10 0.00 3.14 0.00 0.00 58.73 62.15 2rcu h TYR 557 Cb 0.26 -0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.45 2rcu h TYR 557 CO -0.00 0.12 -0.32 0.00 -1.64 0.00 0.00 178.16 176.32 2rcu h ALA 558 N 1.17 1.14 -0.42 1.82 0.00 -0.54 -1.24 119.26 121.19 2rcu h ALA 558 Ca 0.13 -0.36 -0.12 0.00 0.00 0.00 0.00 54.91 54.56 2rcu h ALA 558 Cb 0.07 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2rcu h ALA 558 CO -0.11 0.55 -0.20 -0.07 0.00 0.00 0.00 179.25 179.43 2rcu h LEU 559 N 0.29 0.89 -0.35 0.00 3.38 -1.27 -0.84 115.31 117.42 2rcu h LEU 559 Ca 0.04 -0.40 -0.04 0.00 0.09 0.00 0.00 57.88 57.56 2rcu h LEU 559 Cb 0.71 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.20 2rcu h LEU 559 CO 0.05 1.10 0.04 -0.09 0.09 0.00 0.00 178.44 179.64 2rcu h ARG 560 N 0.69 0.58 -0.76 1.13 2.43 -1.18 -2.07 114.38 115.21 2rcu h ARG 560 Ca 0.09 -0.16 0.03 0.00 -0.81 0.00 0.00 59.98 59.13 2rcu h ARG 560 Cb 0.76 -0.06 -0.05 0.00 -0.42 0.00 0.00 29.97 30.20 2rcu h ARG 560 CO 0.06 0.67 0.48 -0.92 -1.51 0.00 0.00 179.97 178.75 2rcu h TYR 561 N 0.41 0.89 -0.48 2.20 3.20 -1.14 -1.67 116.97 120.37 2rcu h TYR 561 Ca 0.10 0.02 -0.05 0.00 3.14 0.00 0.00 58.73 61.95 2rcu h TYR 561 Cb 0.38 -0.29 -0.02 0.00 1.54 0.00 0.00 36.73 38.34 2rcu h TYR 561 CO 0.03 0.50 0.12 1.25 -1.64 0.00 0.00 178.16 178.42 2rcu h LEU 562 N 0.92 0.73 -0.45 2.82 5.85 -0.95 0.25 115.31 124.49 2rcu h LEU 562 Ca 0.31 -0.23 0.05 0.00 0.84 0.00 0.00 57.88 58.85 2rcu h LEU 562 Cb 0.04 -0.19 -0.05 0.00 0.37 0.00 0.00 40.66 40.83 2rcu h LEU 562 CO -0.12 0.77 0.17 0.00 -0.34 0.00 0.00 178.44 178.92 2rcu h ALA 563 N 0.99 0.54 -0.25 1.25 0.00 -1.06 -1.16 119.26 119.57 2rcu h ALA 563 Ca 0.15 0.05 -0.04 0.00 0.00 0.00 0.00 54.91 55.07 2rcu h ALA 563 Cb 0.32 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 2rcu h ALA 563 CO 0.00 -0.22 -0.01 1.15 0.00 0.00 0.00 179.25 180.18 2rcu h THR 564 N 0.35 1.26 -0.14 0.00 2.02 -1.01 -0.96 112.91 114.42 2rcu h THR 564 Ca 0.21 -0.93 -0.05 0.00 0.77 0.00 0.00 66.41 66.41 2rcu h THR 564 Cb 0.19 1.38 -0.01 0.00 -1.74 0.00 0.00 68.15 67.97 2rcu h THR 564 CO -0.20 0.29 -0.14 0.00 0.37 0.00 0.00 175.52 175.84 2rcu h ALA 565 N 0.80 1.52 -0.01 6.16 0.00 -0.29 -1.33 119.26 126.10 2rcu h ALA 565 Ca 0.07 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2rcu h ALA 565 Cb 0.43 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.14 2rcu h ALA 565 CO 0.01 0.34 0.00 0.54 0.00 0.00 0.00 179.25 180.15 2rcu n ARG 566 N -4.28 1.20 -1.37 0.00 5.12 -0.46 -4.92 116.66 111.95 2rcu n ARG 566 Ca -0.01 -0.30 0.00 0.00 -1.93 0.00 0.00 57.85 55.61 2rcu n ARG 566 Cb 0.27 -1.46 0.00 0.00 -1.16 0.00 0.00 32.46 30.11 2rcu n ARG 566 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2rcu n GLY 567 N 1.02 0.53 3.93 -0.13 0.00 -0.50 -5.06 105.19 104.97 2rcu n GLY 567 Ca 0.21 -0.85 -0.24 0.00 0.00 0.00 0.00 46.02 45.14 2rcu n GLY 567 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2rcu s LEU 568 N 0.00 4.23 0.49 0.99 1.43 -0.39 -5.04 118.68 120.38 2rcu s LEU 568 Ca 0.00 0.06 -0.23 0.00 -1.03 0.00 0.00 54.13 52.93 2rcu s LEU 568 Cb 0.00 -2.79 -0.07 0.00 0.03 0.00 0.00 46.19 43.37 2rcu s LEU 568 CO 0.00 -0.00 1.23 0.20 0.23 0.00 0.00 176.35 178.00 2rcu s ASN 569 N -3.58 5.88 -0.01 2.29 -0.87 -1.26 -4.39 114.94 112.99 2rcu s ASN 569 Ca 0.34 2.45 -0.34 0.00 -1.57 0.00 0.00 52.86 53.74 2rcu s ASN 569 Cb -0.10 -2.61 -0.13 0.00 -0.02 0.00 0.00 41.25 38.39 2rcu s ASN 569 CO 0.28 -1.13 1.76 -0.11 -2.57 0.00 0.00 177.10 175.33 2rcu n LEU 570 N -0.66 3.22 -4.58 0.60 7.94 -1.26 -4.92 117.00 117.34 2rcu n LEU 570 Ca 0.08 1.02 -0.38 0.00 -1.11 0.00 0.00 56.01 55.62 2rcu n LEU 570 Cb 0.47 -1.37 0.05 0.00 0.53 0.00 0.00 43.42 43.10 2rcu n LEU 570 CO 0.49 -0.18 0.42 -2.65 -1.11 0.00 0.00 177.39 174.36 2rcu n PRO 571 N 5.42 0.79 0.27 1.96 -0.02 -1.26 -4.90 135.00 137.27 2rcu n PRO 571 Ca 0.21 0.31 0.11 0.00 -2.02 0.00 0.00 63.50 62.11 2rcu n PRO 571 Cb 0.28 -2.04 0.75 0.00 -0.02 0.00 0.00 33.50 32.47 2rcu n PRO 571 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 2rcu h GLU 572 N 0.43 0.00 -0.95 -0.52 5.08 -1.98 -1.15 114.58 115.49 2rcu h GLU 572 Ca -0.48 0.00 0.10 0.00 -1.00 0.00 0.00 59.36 57.98 2rcu h GLU 572 Cb 1.37 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 30.55 2rcu h GLU 572 CO 0.50 0.04 0.61 1.25 -1.00 0.00 0.00 179.01 180.41 2rcu h LEU 573 N 0.00 0.89 0.00 1.33 5.85 -1.90 -2.09 115.31 119.39 2rcu h LEU 573 Ca -0.00 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.75 2rcu h LEU 573 Cb 0.09 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 40.96 2rcu h LEU 573 CO 0.01 0.52 -0.06 -1.22 -0.34 0.00 0.00 178.44 177.34 2rcu n TYR 574 N -4.55 0.13 0.65 1.25 4.01 -0.44 -3.05 117.16 115.17 2rcu n TYR 574 Ca 0.16 0.04 0.12 0.00 -0.16 0.00 0.00 57.90 58.06 2rcu n TYR 574 Cb 0.29 -0.54 0.11 0.00 -0.31 0.00 0.00 39.34 38.89 2rcu n TYR 574 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 2rcu n LEU 575 N -1.61 0.63 -4.68 7.72 4.77 -0.80 -4.69 117.00 118.34 2rcu n LEU 575 Ca 0.07 0.06 -0.46 0.00 -0.03 0.00 0.00 56.01 55.64 2rcu n LEU 575 Cb 0.35 -0.15 -0.04 0.00 -2.33 0.00 0.00 43.42 41.25 2rcu n LEU 575 CO 0.28 0.03 1.45 -0.67 -1.33 0.00 0.00 177.39 177.15 2rcu n ASP 576 N -1.93 3.58 0.08 -1.43 2.03 -1.12 -4.85 116.55 112.91 2rcu n ASP 576 Ca 0.03 0.99 0.19 0.00 0.52 0.00 0.00 54.79 56.52 2rcu n ASP 576 Cb 0.42 -1.43 0.73 0.00 -0.72 0.00 0.00 41.12 40.12 2rcu n ASP 576 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 2rcu h PRO 577 N 8.68 0.00 -0.26 -0.67 0.11 -1.90 0.89 132.00 138.84 2rcu h PRO 577 Ca -0.48 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.59 2rcu h PRO 577 Cb 1.26 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.35 2rcu h PRO 577 CO 0.94 0.00 -0.04 0.00 -0.21 0.00 0.00 178.00 178.68 2rcu h ALA 578 N 1.71 1.44 -0.20 -0.75 0.00 -1.94 0.27 119.26 119.80 2rcu h ALA 578 Ca 0.19 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 2rcu h ALA 578 Cb 0.86 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 2rcu h ALA 578 CO -0.00 0.39 -0.02 -0.92 0.00 0.00 0.00 179.25 178.70 2rcu h TYR 579 N 0.39 0.40 -0.40 0.00 3.20 -1.09 -1.06 116.97 118.41 2rcu h TYR 579 Ca 0.08 -0.08 0.02 0.00 3.14 0.00 0.00 58.73 61.90 2rcu h TYR 579 Cb 0.33 -0.10 -0.03 0.00 1.54 0.00 0.00 36.73 38.47 2rcu h TYR 579 CO 0.01 0.58 0.23 1.96 -1.64 0.00 0.00 178.16 179.30 2rcu h GLN 580 N 0.11 0.45 -0.84 1.82 7.50 -1.29 -2.64 115.11 120.21 2rcu h GLN 580 Ca 0.05 -0.03 -0.02 0.00 0.50 0.00 0.00 58.65 59.16 2rcu h GLN 580 Cb 0.43 -0.10 -0.04 0.00 0.05 0.00 0.00 27.48 27.82 2rcu h GLN 580 CO 0.01 0.30 0.46 0.37 -1.50 0.00 0.00 178.83 178.47 2rcu h GLN 581 N 0.46 1.16 0.00 1.46 4.15 -0.41 -1.97 115.11 119.96 2rcu h GLN 581 Ca 0.16 -0.13 -0.03 0.00 0.77 0.00 0.00 58.65 59.42 2rcu h GLN 581 Cb 0.02 -0.23 -0.00 0.00 0.21 0.00 0.00 27.48 27.47 2rcu h GLN 581 CO -0.08 0.85 -0.14 1.98 -1.93 0.00 0.00 178.83 179.51 2rcu h MET 582 N 1.17 0.00 -0.44 1.69 4.05 -0.86 -2.58 114.93 117.97 2rcu h MET 582 Ca 0.30 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.72 2rcu h MET 582 Cb 0.03 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 30.83 2rcu h MET 582 CO -0.05 0.14 0.00 0.09 0.23 0.00 0.00 176.91 177.33 2rcu n ASN 583 N -3.93 3.81 -4.15 1.39 4.13 -0.81 -4.65 115.26 111.04 2rcu n ASN 583 Ca -0.02 -2.41 -0.38 0.00 1.68 0.00 0.00 54.58 53.45 2rcu n ASN 583 Cb 0.23 -0.43 -0.06 0.00 -1.54 0.00 0.00 39.78 37.98 2rcu n ASN 583 CO 0.00 0.00 0.00 -2.28 0.28 0.00 0.00 177.26 175.26 2rcu s HIS 584 N -1.74 3.78 -1.03 3.10 2.46 -0.81 -5.04 115.29 116.01 2rcu s HIS 584 Ca 0.38 -2.78 -0.20 0.00 0.47 0.00 0.00 55.06 52.92 2rcu s HIS 584 Cb 0.25 -3.36 0.09 0.00 -0.13 0.00 0.00 32.58 29.43 2rcu s HIS 584 CO 0.18 -0.82 1.36 -0.80 -2.47 0.00 0.00 174.74 172.19 2rcu s ASN 585 N 0.51 6.63 0.28 9.88 0.01 -1.26 -4.65 114.94 126.34 2rcu s ASN 585 Ca 0.24 -1.90 0.01 0.00 -0.71 0.00 0.00 52.86 50.50 2rcu s ASN 585 Cb -0.12 -2.49 0.53 0.00 0.41 0.00 0.00 41.25 39.57 2rcu s ASN 585 CO -0.09 -1.25 1.85 0.40 -1.51 0.00 0.00 177.10 176.50 2rcu h ILE 586 N 6.15 0.96 -3.54 0.60 2.04 -1.79 -3.32 117.51 118.60 2rcu h ILE 586 Ca 0.22 -0.36 -0.70 0.00 1.00 0.00 0.00 64.86 65.02 2rcu h ILE 586 Cb 0.99 -0.17 -0.31 0.00 -0.74 0.00 0.00 36.82 36.59 2rcu h ILE 586 CO 1.30 0.19 -0.55 -0.76 0.00 0.00 0.00 178.15 178.33 2rcu s LEU 587 N -10.21 4.89 -0.20 1.44 1.43 -0.92 -0.60 118.68 114.51 2rcu s LEU 587 Ca -0.12 -1.62 -0.05 0.00 -1.03 0.00 0.00 54.13 51.31 2rcu s LEU 587 Cb 0.22 -1.87 -0.02 0.00 0.03 0.00 0.00 46.19 44.55 2rcu s LEU 587 CO 0.81 -0.47 -0.01 -0.55 0.23 0.00 0.00 176.35 176.36 2rcu s SER 588 N 1.80 4.77 0.06 2.29 0.15 -0.89 -0.69 113.70 121.20 2rcu s SER 588 Ca 0.03 -0.22 0.04 0.00 0.70 0.00 0.00 55.95 56.50 2rcu s SER 588 Cb -0.22 -1.81 -0.03 0.00 -1.71 0.00 0.00 66.02 62.25 2rcu s SER 588 CO -0.01 0.06 -0.11 0.42 1.20 0.00 0.00 173.24 174.80 2rcu s THR 589 N 1.02 0.88 -0.06 6.45 -4.23 0.57 -0.45 115.64 119.81 2rcu s THR 589 Ca 0.02 -1.28 -0.31 0.00 -1.18 0.00 0.00 61.69 58.94 2rcu s THR 589 Cb -0.14 -0.95 0.07 0.00 1.34 0.00 0.00 72.50 72.81 2rcu s THR 589 CO 0.01 -0.34 0.68 -0.55 -0.54 0.00 0.00 174.62 173.89 2rcu s SER 590 N -1.80 -0.66 0.03 3.99 0.15 -0.79 -2.50 113.70 112.11 2rcu s SER 590 Ca -0.04 0.77 0.02 0.00 0.70 0.00 0.00 55.95 57.40 2rcu s SER 590 Cb -0.09 0.60 -0.02 0.00 -1.71 0.00 0.00 66.02 64.80 2rcu s SER 590 CO 0.01 -0.59 -0.07 0.28 1.20 0.00 0.00 173.24 174.08 2rcu s THR 591 N -1.09 0.47 0.06 6.45 -1.32 -1.26 -1.91 115.64 117.03 2rcu s THR 591 Ca -0.10 -0.80 0.03 0.00 -1.21 0.00 0.00 61.69 59.61 2rcu s THR 591 Cb -0.00 -0.50 -0.03 0.00 -1.51 0.00 0.00 72.50 70.46 2rcu s THR 591 CO 0.09 -0.24 -0.10 -0.76 -2.21 0.00 0.00 174.62 171.41 2rcu s LEU 592 N -1.12 2.28 -0.24 9.08 1.43 -1.25 -5.02 118.68 123.84 2rcu s LEU 592 Ca -0.07 -0.61 0.02 0.00 -1.03 0.00 0.00 54.13 52.45 2rcu s LEU 592 Cb -0.07 -0.28 0.05 0.00 0.03 0.00 0.00 46.19 45.92 2rcu s LEU 592 CO 0.00 -0.18 -0.12 0.20 0.23 0.00 0.00 176.35 176.49 2rcu s ASN 593 N -1.75 4.12 -0.28 2.29 0.01 -1.26 -4.74 114.94 113.33 2rcu s ASN 593 Ca -0.05 -1.23 -0.22 0.00 -0.71 0.00 0.00 52.86 50.64 2rcu s ASN 593 Cb -0.09 -1.48 0.08 0.00 0.41 0.00 0.00 41.25 40.18 2rcu s ASN 593 CO 0.01 -0.16 0.77 -0.55 -1.51 0.00 0.00 177.10 175.65 2rcu s SER 594 N 1.18 -0.75 0.00 -1.22 0.15 -1.26 -5.02 113.70 106.78 2rcu s SER 594 Ca -0.06 1.36 0.19 0.00 0.70 0.00 0.00 55.95 58.14 2rcu s SER 594 Cb -0.19 1.36 0.95 0.00 -1.71 0.00 0.00 66.02 66.43 2rcu s SER 594 CO -0.06 -0.23 1.60 -0.81 1.20 0.00 0.00 173.24 174.93 2rcu n PRO 595 N 3.11 0.24 0.08 5.44 -0.04 -1.26 -2.52 135.00 140.05 2rcu n PRO 595 Ca -0.16 0.11 0.12 0.00 -0.04 0.00 0.00 63.50 63.54 2rcu n PRO 595 Cb 0.56 -1.50 0.17 0.00 -0.04 0.00 0.00 33.50 32.70 2rcu n PRO 595 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2rcu h ALA 596 N 2.88 0.65 -2.78 0.55 0.00 -1.95 -3.46 119.26 115.15 2rcu h ALA 596 Ca 0.00 0.00 -0.61 0.00 0.00 0.00 0.00 54.91 54.30 2rcu h ALA 596 Cb 0.20 0.00 -0.12 0.00 0.00 0.00 0.00 17.79 17.87 2rcu h ALA 596 CO 0.00 0.00 -0.17 0.08 0.00 0.00 0.00 179.25 179.16 2rcu s VAL 597 N -3.19 5.17 -0.12 0.00 1.01 -1.05 -0.99 120.40 121.23 2rcu s VAL 597 Ca 0.06 0.73 -0.17 0.00 0.00 0.00 0.00 61.98 62.59 2rcu s VAL 597 Cb 0.12 -3.75 -0.26 0.00 0.00 0.00 0.00 36.38 32.50 2rcu s VAL 597 CO 0.71 0.20 0.51 0.77 0.00 0.00 0.00 175.10 177.29 2rcu h SER 598 N 7.62 0.29 -5.39 3.32 4.64 -1.10 -3.44 113.55 119.50 2rcu h SER 598 Ca -0.34 -0.81 0.18 0.00 -0.47 0.00 0.00 61.79 60.35 2rcu h SER 598 Cb 1.16 -0.10 -0.06 0.00 -0.31 0.00 0.00 62.40 63.09 2rcu h SER 598 CO 0.70 1.57 0.54 -1.48 -0.87 0.00 0.00 176.83 177.29 2rcu s LEU 599 N -7.62 -0.10 0.37 5.97 2.34 -1.24 -5.01 118.68 113.39 2rcu s LEU 599 Ca -0.21 -0.50 -0.10 0.00 0.06 0.00 0.00 54.13 53.38 2rcu s LEU 599 Cb 0.04 2.09 0.03 0.00 -0.56 0.00 0.00 46.19 47.79 2rcu s LEU 599 CO 0.73 -0.91 0.65 -0.83 -1.06 0.00 0.00 176.35 174.93 2rcu s GLY 600 N -3.11 0.88 -0.24 -3.48 0.00 -1.26 -0.12 107.32 100.00 2rcu s GLY 600 Ca 0.16 -1.10 -0.37 0.00 0.00 0.00 0.00 44.72 43.41 2rcu s GLY 600 CO 0.03 -0.62 1.31 -0.32 0.00 0.00 0.00 173.10 173.50 2rcu s GLY 601 N -3.15 -0.25 -0.01 0.20 0.00 -0.57 -4.77 107.32 98.76 2rcu s GLY 601 Ca 0.22 1.73 -0.23 0.00 0.00 0.00 0.00 44.72 46.44 2rcu s GLY 601 CO 0.16 0.57 0.50 -0.11 0.00 0.00 0.00 173.10 174.21 2rcu s PHE 602 N -2.20 -0.42 0.82 1.90 -0.12 -1.26 -1.65 117.98 115.04 2rcu s PHE 602 Ca 0.11 0.64 -0.11 0.00 -0.05 0.00 0.00 56.93 57.51 2rcu s PHE 602 Cb -0.01 0.27 0.08 0.00 -0.63 0.00 0.00 43.02 42.74 2rcu s PHE 602 CO -0.03 -0.54 1.09 0.00 -0.05 0.00 0.00 175.22 175.69 2rcu s ALA 603 N -1.57 2.05 0.77 1.99 0.00 -1.25 -4.37 121.76 119.38 2rcu s ALA 603 Ca -0.10 -0.07 -0.13 0.00 0.00 0.00 0.00 51.96 51.66 2rcu s ALA 603 Cb -0.02 -3.16 0.06 0.00 0.00 0.00 0.00 23.12 20.00 2rcu s ALA 603 CO 0.05 -1.90 1.15 -2.14 0.00 0.00 0.00 175.76 172.92 2rcu s PRO 604 N -5.04 2.00 0.00 0.00 0.02 -1.26 -4.49 135.00 126.23 2rcu s PRO 604 Ca 0.61 1.51 0.25 0.00 0.02 0.00 0.00 61.00 63.40 2rcu s PRO 604 Cb -0.16 -1.84 0.42 0.00 0.02 0.00 0.00 34.50 32.94 2rcu s PRO 604 CO 0.55 -1.89 1.36 1.33 -0.33 0.00 0.00 177.00 178.02 2rcu n VAL 605 N -3.22 0.00 -4.06 3.83 0.24 -1.26 -4.73 118.33 109.13 2rcu n VAL 605 Ca 0.12 -0.14 -0.08 0.00 -2.04 0.00 0.00 64.34 62.20 2rcu n VAL 605 Cb 0.52 0.67 -0.10 0.00 -1.47 0.00 0.00 33.84 33.45 2rcu n VAL 605 CO 0.00 0.00 0.00 0.68 -2.14 0.00 0.00 176.83 175.37 2rcu s VAL 606 N -2.61 0.23 0.37 3.34 -7.23 -1.26 -4.93 120.40 108.30 2rcu s VAL 606 Ca 0.19 -1.54 0.08 0.00 -1.81 0.00 0.00 61.98 58.90 2rcu s VAL 606 Cb 0.18 -1.14 0.31 0.00 0.56 0.00 0.00 36.38 36.29 2rcu s VAL 606 CO 0.59 -0.83 1.93 -0.65 -0.31 0.00 0.00 175.10 175.83 2rcu h PRO 607 N 3.61 0.68 -0.91 4.82 0.11 -1.98 -1.97 132.00 136.36 2rcu h PRO 607 Ca -0.34 -0.04 -0.61 0.00 0.11 0.00 0.00 66.00 65.13 2rcu h PRO 607 Cb 1.16 -0.15 -0.31 0.00 0.11 0.00 0.00 31.00 31.81 2rcu h PRO 607 CO 0.58 0.45 0.47 -0.40 -0.21 0.00 0.00 178.00 178.89 2rcu n ASP 608 N -4.50 6.41 -4.80 -2.05 5.75 -1.26 -4.46 116.55 111.63 2rcu n ASP 608 Ca 0.13 -3.76 -0.23 0.00 -0.01 0.00 0.00 54.79 50.92 2rcu n ASP 608 Cb 0.33 -0.82 -0.05 0.00 -1.03 0.00 0.00 41.12 39.54 2rcu n ASP 608 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 2rcu s GLY 609 N -2.15 2.25 -0.07 6.12 0.00 -0.74 -4.83 107.32 107.89 2rcu s GLY 609 Ca 0.60 -2.01 0.02 0.00 0.00 0.00 0.00 44.72 43.33 2rcu s GLY 609 CO 0.01 -1.82 -0.11 -1.36 0.00 0.00 0.00 173.10 169.82 2rcu s PHE 610 N -2.54 2.80 -0.44 1.90 0.08 0.23 -4.13 117.98 115.88 2rcu s PHE 610 Ca 0.44 -0.19 -0.15 0.00 0.12 0.00 0.00 56.93 57.16 2rcu s PHE 610 Cb 0.01 -1.70 0.05 0.00 -0.57 0.00 0.00 43.02 40.81 2rcu s PHE 610 CO 0.25 0.16 0.34 0.20 -0.10 0.00 0.00 175.22 176.07 2rcu s GLY 611 N -0.53 2.02 -0.41 4.36 0.00 -0.71 -2.09 107.32 109.97 2rcu s GLY 611 Ca 0.07 -1.97 -0.08 0.00 0.00 0.00 0.00 44.72 42.74 2rcu s GLY 611 CO 0.02 0.99 0.24 -0.42 0.00 0.00 0.00 173.10 173.93 2rcu s ILE 612 N 1.63 4.11 -0.21 0.90 1.01 0.41 -0.93 121.20 128.12 2rcu s ILE 612 Ca 0.04 -1.41 -0.12 0.00 0.00 0.00 0.00 60.65 59.16 2rcu s ILE 612 Cb -0.22 -3.51 -0.05 0.00 0.01 0.00 0.00 42.46 38.69 2rcu s ILE 612 CO 0.07 -0.48 0.23 0.00 0.00 0.00 0.00 174.94 174.76 2rcu s ALA 613 N 1.40 3.61 0.11 9.38 0.00 -0.64 -1.89 121.76 133.74 2rcu s ALA 613 Ca 0.03 -0.70 -0.03 0.00 0.00 0.00 0.00 51.96 51.26 2rcu s ALA 613 Cb -0.23 -2.37 -0.03 0.00 0.00 0.00 0.00 23.12 20.49 2rcu s ALA 613 CO 0.02 -0.09 0.07 1.52 0.00 0.00 0.00 175.76 177.27 2rcu s TYR 614 N 0.87 0.64 -0.11 0.00 -0.85 -0.80 -0.30 117.35 116.79 2rcu s TYR 614 Ca 0.12 -1.07 -0.08 0.00 -0.52 0.00 0.00 57.07 55.51 2rcu s TYR 614 Cb -0.13 -0.36 0.03 0.00 0.38 0.00 0.00 41.96 41.88 2rcu s TYR 614 CO 0.04 -0.51 0.27 0.00 -1.52 0.00 0.00 175.55 173.84 2rcu s ALA 615 N -3.98 -0.67 -0.33 9.51 0.00 -0.51 -3.82 121.76 121.96 2rcu s ALA 615 Ca 0.17 0.88 -0.13 0.00 0.00 0.00 0.00 51.96 52.88 2rcu s ALA 615 Cb 0.07 -0.53 -0.02 0.00 0.00 0.00 0.00 23.12 22.63 2rcu s ALA 615 CO -0.03 -0.16 0.24 0.08 0.00 0.00 0.00 175.76 175.90 2rcu s VAL 616 N 0.53 5.28 0.59 0.00 1.01 -1.26 -1.31 120.40 125.23 2rcu s VAL 616 Ca -0.03 -0.09 0.05 0.00 0.00 0.00 0.00 61.98 61.90 2rcu s VAL 616 Cb -0.05 -3.68 0.07 0.00 0.00 0.00 0.00 36.38 32.73 2rcu s VAL 616 CO -0.03 0.05 0.81 -1.00 0.00 0.00 0.00 175.10 174.93 2rcu s HIS 617 N 1.76 1.99 0.35 5.22 3.76 0.77 -4.76 115.29 124.39 2rcu s HIS 617 Ca 0.07 -0.39 0.08 0.00 -0.15 0.00 0.00 55.06 54.66 2rcu s HIS 617 Cb -0.17 -2.58 0.77 0.00 1.11 0.00 0.00 32.58 31.71 2rcu s HIS 617 CO 0.11 -1.14 1.88 -0.44 -0.85 0.00 0.00 174.74 174.30 2rcu h ASP 618 N 0.03 0.69 -0.00 1.40 3.32 -1.96 0.17 116.42 120.07 2rcu h ASP 618 Ca -0.36 0.03 0.00 0.00 0.02 0.00 0.00 57.03 56.72 2rcu h ASP 618 Cb 1.28 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 40.73 2rcu h ASP 618 CO 0.44 0.37 -0.03 0.47 -1.72 0.00 0.00 179.24 178.76 2rcu n ASP 619 N -4.55 0.04 -3.79 6.45 8.00 -1.26 -2.02 116.55 119.41 2rcu n ASP 619 Ca 0.16 -0.52 -0.09 0.00 0.71 0.00 0.00 54.79 55.06 2rcu n ASP 619 Cb 0.42 1.00 -0.03 0.00 -0.02 0.00 0.00 41.12 42.48 2rcu n ASP 619 CO 0.00 0.00 0.00 -1.66 -0.39 0.00 0.00 177.20 175.15 2rcu s TRP 620 N -1.06 -0.13 -0.06 1.24 1.48 -1.23 -3.11 118.94 116.07 2rcu s TRP 620 Ca 0.00 -0.25 0.01 0.00 -1.06 0.00 0.00 56.10 54.80 2rcu s TRP 620 Cb 0.01 0.51 0.02 0.00 -1.16 0.00 0.00 33.47 32.85 2rcu s TRP 620 CO 0.03 -1.05 -0.07 0.42 -4.06 0.00 0.00 176.95 172.21 2rcu s ILE 621 N -3.90 0.80 0.03 0.66 1.01 -0.59 -0.16 121.20 119.05 2rcu s ILE 621 Ca 0.11 -0.25 0.06 0.00 0.00 0.00 0.00 60.65 60.56 2rcu s ILE 621 Cb -0.03 -0.79 -0.03 0.00 0.01 0.00 0.00 42.46 41.61 2rcu s ILE 621 CO 0.02 0.29 -0.13 -0.83 0.00 0.00 0.00 174.94 174.29 2rcu s GLY 622 N 1.01 1.65 -0.01 6.18 0.00 -0.43 -0.25 107.32 115.47 2rcu s GLY 622 Ca -0.09 -1.13 0.01 0.00 0.00 0.00 0.00 44.72 43.50 2rcu s GLY 622 CO -0.00 -1.02 -0.03 0.00 0.00 0.00 0.00 173.10 172.05 2rcu s ASN 624 N 0.06 3.57 -0.12 0.00 2.47 0.58 -1.47 114.94 120.03 2rcu s ASN 624 Ca -0.00 -0.99 0.01 0.00 0.42 0.00 0.00 52.86 52.30 2rcu s ASN 624 Cb -0.03 -1.24 -0.01 0.00 -1.45 0.00 0.00 41.25 38.52 2rcu s ASN 624 CO -0.00 -0.17 -0.17 -0.69 -3.72 0.00 0.00 177.10 172.35 2rcu s VAL 625 N 1.38 2.72 0.24 -5.21 1.01 0.64 -1.62 120.40 119.56 2rcu s VAL 625 Ca -0.03 -0.78 0.06 0.00 0.00 0.00 0.00 61.98 61.23 2rcu s VAL 625 Cb -0.17 -2.11 -0.03 0.00 0.00 0.00 0.00 36.38 34.06 2rcu s VAL 625 CO -0.07 0.54 0.23 -0.94 0.00 0.00 0.00 175.10 174.85 2rcu s SER 626 N 0.35 5.71 0.08 3.32 1.04 -0.11 -1.65 113.70 122.44 2rcu s SER 626 Ca -0.13 -0.17 -0.24 0.00 0.48 0.00 0.00 55.95 55.89 2rcu s SER 626 Cb -0.17 -1.51 0.06 0.00 0.10 0.00 0.00 66.02 64.50 2rcu s SER 626 CO 0.07 -0.04 0.59 -0.55 0.98 0.00 0.00 173.24 174.29 2rcu s SER 627 N -3.81 -0.54 0.39 7.02 0.15 -0.05 -1.73 113.70 115.14 2rcu s SER 627 Ca 0.33 0.20 0.01 0.00 0.70 0.00 0.00 55.95 57.19 2rcu s SER 627 Cb -0.08 0.55 0.04 0.00 -1.71 0.00 0.00 66.02 64.82 2rcu s SER 627 CO 0.26 -0.81 0.29 -1.22 1.20 0.00 0.00 173.24 172.97 2rcu n TYR 628 N 0.16 -3.10 -0.12 3.44 4.01 -1.26 -0.22 117.16 120.07 2rcu n TYR 628 Ca -0.18 -0.59 0.10 0.00 -0.16 0.00 0.00 57.90 57.08 2rcu n TYR 628 Cb 0.62 -0.21 0.45 0.00 -0.31 0.00 0.00 39.34 39.89 2rcu n TYR 628 CO 0.00 0.00 0.00 0.77 -0.46 0.00 0.00 176.86 177.17 2rcu h SER 629 N -0.12 0.47 0.42 7.72 0.02 -1.74 -2.82 113.55 117.50 2rcu h SER 629 Ca -0.10 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.86 2rcu h SER 629 Cb 0.39 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 62.84 2rcu h SER 629 CO 0.11 0.29 0.00 0.61 -1.14 0.00 0.00 176.83 176.70 2rcu n GLY 630 N -1.49 -1.08 3.43 -3.77 0.00 -1.26 -4.77 105.19 96.25 2rcu n GLY 630 Ca 0.10 -0.12 -0.21 0.00 0.00 0.00 0.00 46.02 45.79 2rcu n GLY 630 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2rcu s ARG 631 N -2.52 1.60 -0.30 1.61 1.81 -1.06 -4.96 118.95 115.13 2rcu s ARG 631 Ca 0.25 -1.87 0.01 0.00 -1.72 0.00 0.00 55.73 52.40 2rcu s ARG 631 Cb 0.17 -0.88 0.09 0.00 -0.45 0.00 0.00 34.95 33.88 2rcu s ARG 631 CO 0.37 -0.14 0.05 1.21 -0.68 0.00 0.00 175.30 176.11 2rcu s ASN 632 N -3.46 4.23 0.29 0.23 3.84 -1.26 -4.68 114.94 114.13 2rcu s ASN 632 Ca 0.35 -1.71 0.04 0.00 0.21 0.00 0.00 52.86 51.74 2rcu s ASN 632 Cb 0.08 -1.19 0.44 0.00 -0.55 0.00 0.00 41.25 40.03 2rcu s ASN 632 CO 0.14 -0.37 1.73 0.00 -2.79 0.00 0.00 177.10 175.81 2rcu h ALA 633 N 7.90 1.13 -0.28 1.71 0.00 -1.90 -1.75 119.26 126.06 2rcu h ALA 633 Ca -0.11 -0.35 -0.03 0.00 0.00 0.00 0.00 54.91 54.42 2rcu h ALA 633 Cb 1.03 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 2rcu h ALA 633 CO 0.47 0.55 0.07 -0.09 0.00 0.00 0.00 179.25 180.25 2rcu h ARG 634 N 0.37 0.45 -0.47 0.00 2.43 -1.93 -1.10 114.38 114.13 2rcu h ARG 634 Ca 0.05 -0.11 -0.06 0.00 -0.81 0.00 0.00 59.98 59.05 2rcu h ARG 634 Cb 0.68 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.15 2rcu h ARG 634 CO 0.05 0.54 0.04 1.49 -1.51 0.00 0.00 179.97 180.58 2rcu h GLU 635 N 0.29 0.80 -0.54 0.20 4.57 -1.98 -2.10 114.58 115.82 2rcu h GLU 635 Ca 0.09 -0.23 0.07 0.00 -1.18 0.00 0.00 59.36 58.10 2rcu h GLU 635 Cb 0.29 -0.08 -0.06 0.00 -0.16 0.00 0.00 28.75 28.74 2rcu h GLU 635 CO 0.00 0.83 0.22 0.35 -1.18 0.00 0.00 179.01 179.24 2rcu h PHE 636 N 0.67 0.40 -0.21 0.92 3.57 -1.14 -0.19 116.94 120.96 2rcu h PHE 636 Ca 0.14 0.02 -0.09 0.00 3.53 0.00 0.00 57.97 61.57 2rcu h PHE 636 Cb 0.44 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 39.07 2rcu h PHE 636 CO 0.03 0.15 -0.26 -0.07 -2.23 0.00 0.00 178.31 175.93 2rcu h LEU 637 N 0.43 0.40 -1.08 0.59 3.38 -1.11 0.22 115.31 118.14 2rcu h LEU 637 Ca 0.26 -0.14 -0.05 0.00 0.09 0.00 0.00 57.88 58.04 2rcu h LEU 637 Cb 0.25 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 2rcu h LEU 637 CO -0.23 0.67 0.05 0.45 0.09 0.00 0.00 178.44 179.47 2rcu h HIS 638 N 0.36 0.73 -0.30 1.13 3.86 -0.74 -0.88 115.15 119.32 2rcu h HIS 638 Ca 0.05 -0.08 -0.15 0.00 -1.16 0.00 0.00 60.37 59.03 2rcu h HIS 638 Cb 0.66 -0.21 -0.00 0.00 1.06 0.00 0.00 27.41 28.91 2rcu h HIS 638 CO 0.02 0.66 -0.41 0.00 0.86 0.00 0.00 177.93 179.06 2rcu h VAL 640 N 0.56 0.96 -0.44 0.00 2.07 -0.34 -0.69 116.25 118.38 2rcu h VAL 640 Ca 0.03 -0.08 0.06 0.00 0.82 0.00 0.00 66.70 67.54 2rcu h VAL 640 Cb 1.00 0.72 -0.05 0.00 -1.52 0.00 0.00 31.29 31.44 2rcu h VAL 640 CO 0.10 0.04 0.13 -0.61 0.02 0.00 0.00 177.57 177.25 2rcu h GLN 641 N 0.22 0.28 -0.44 1.57 5.75 -1.17 0.10 115.11 121.43 2rcu h GLN 641 Ca 0.10 -0.02 -0.02 0.00 -0.15 0.00 0.00 58.65 58.56 2rcu h GLN 641 Cb 0.05 -0.06 -0.02 0.00 1.07 0.00 0.00 27.48 28.52 2rcu h GLN 641 CO -0.09 0.19 0.19 -0.22 -2.65 0.00 0.00 178.83 176.25 2rcu h LYS 642 N 0.29 0.64 -0.84 1.69 1.63 -1.24 -0.86 116.57 117.88 2rcu h LYS 642 Ca 0.21 -0.11 -0.02 0.00 -0.85 0.00 0.00 60.65 59.88 2rcu h LYS 642 Cb 0.22 -0.11 -0.04 0.00 -0.60 0.00 0.00 32.23 31.70 2rcu h LYS 642 CO -0.23 0.57 0.44 0.00 -3.45 0.00 0.00 179.45 176.78 2rcu h LEU 644 N 1.18 0.91 -0.28 0.00 3.38 -0.56 -0.57 115.31 119.36 2rcu h LEU 644 Ca 0.29 -0.29 0.02 0.00 0.09 0.00 0.00 57.88 58.00 2rcu h LEU 644 Cb 0.07 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.55 2rcu h LEU 644 CO -0.04 1.03 0.13 -0.33 0.09 0.00 0.00 178.44 179.31 2rcu h GLU 645 N 0.82 0.26 -0.71 1.13 4.39 -0.77 -1.08 114.58 118.62 2rcu h GLU 645 Ca 0.13 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.82 2rcu h GLU 645 Cb 0.63 -0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 29.19 2rcu h GLU 645 CO 0.04 0.17 0.45 -0.44 -1.16 0.00 0.00 179.01 178.07 2rcu h ASP 646 N 0.27 0.84 -0.20 1.42 3.32 -0.61 0.21 116.42 121.67 2rcu h ASP 646 Ca 0.12 -0.05 -0.01 0.00 0.02 0.00 0.00 57.03 57.11 2rcu h ASP 646 Cb 0.06 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.39 2rcu h ASP 646 CO -0.10 0.63 0.08 0.40 -1.72 0.00 0.00 179.24 178.54 2rcu h ILE 647 N 0.97 1.16 -0.23 0.35 2.04 -0.97 -0.91 117.51 119.91 2rcu h ILE 647 Ca 0.26 -0.48 -0.16 0.00 1.00 0.00 0.00 64.86 65.47 2rcu h ILE 647 Cb -0.07 1.11 -0.01 0.00 -0.74 0.00 0.00 36.82 37.12 2rcu h ILE 647 CO -0.05 0.16 -0.52 -0.26 0.00 0.00 0.00 178.15 177.48 2rcu h PHE 648 N 0.17 0.80 0.13 1.37 -1.00 -1.04 -1.65 116.94 115.72 2rcu h PHE 648 Ca 0.07 -0.27 0.02 0.00 2.81 0.00 0.00 57.97 60.59 2rcu h PHE 648 Cb 0.17 -0.16 -0.04 0.00 3.61 0.00 0.00 35.95 39.54 2rcu h PHE 648 CO -0.01 1.03 -0.31 -0.44 -1.61 0.00 0.00 178.31 176.97 2rcu h ASP 649 N 0.50 -0.89 -0.97 2.17 3.32 -0.80 -1.32 116.42 118.43 2rcu h ASP 649 Ca 0.02 0.10 0.03 0.00 0.02 0.00 0.00 57.03 57.20 2rcu h ASP 649 Cb 1.07 0.34 -0.06 0.00 0.22 0.00 0.00 39.33 40.90 2rcu h ASP 649 CO 0.10 -0.40 0.63 0.00 -1.72 0.00 0.00 179.24 177.86 2rcu h ALA 650 N 0.12 1.27 0.00 3.45 0.00 -1.05 -0.37 119.26 122.70 2rcu h ALA 650 Ca 0.03 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 2rcu h ALA 650 Cb 0.56 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 2rcu h ALA 650 CO -0.18 0.54 -0.25 -0.07 0.00 0.00 0.00 179.25 179.29 2rcu h LEU 651 N 1.24 0.00 -0.98 0.00 3.38 -1.10 -1.63 115.31 116.22 2rcu h LEU 651 Ca 0.38 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.35 2rcu h LEU 651 Cb -0.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.72 2rcu h LEU 651 CO -0.11 0.25 0.00 -0.62 0.09 0.00 0.00 178.44 178.04 2rcu n GLU 652 N -4.17 1.64 -1.00 1.13 1.02 -0.51 -4.92 120.64 113.84 2rcu n GLU 652 Ca -0.02 -0.97 0.00 0.00 -0.02 0.00 0.00 57.16 56.15 2rcu n GLU 652 Cb 0.30 -1.38 0.00 0.00 -0.02 0.00 0.00 31.44 30.35 2rcu n GLU 652 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2rcu n GLY 653 N 1.09 0.58 3.74 0.62 0.00 -0.61 -5.00 105.19 105.60 2rcu n GLY 653 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 2rcu n GLY 653 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2rcu s LYS 654 N -0.07 4.76 0.30 1.61 1.02 -0.24 -4.97 119.74 122.14 2rcu s LYS 654 Ca 0.00 1.47 -0.29 0.00 0.02 0.00 0.00 55.97 57.17 2rcu s LYS 654 Cb 0.00 -3.34 -0.10 0.00 -0.52 0.00 0.00 37.83 33.87 2rcu s LYS 654 CO 0.00 0.33 1.43 0.00 -0.92 0.00 0.00 175.35 176.20 2rcu s ALA 655 N -0.47 3.60 0.32 5.17 0.00 -1.26 -3.77 121.76 125.34 2rcu s ALA 655 Ca 0.45 1.38 -0.28 0.00 0.00 0.00 0.00 51.96 53.51 2rcu s ALA 655 Cb -0.24 -3.56 -0.09 0.00 0.00 0.00 0.00 23.12 19.22 2rcu s ALA 655 CO 0.31 -0.80 1.12 0.96 0.00 0.00 0.00 175.76 177.35 2rcu s ILE 656 N -0.47 3.40 -0.16 0.00 -4.36 -1.26 -4.96 121.20 113.38 2rcu s ILE 656 Ca 0.56 1.33 -0.29 0.00 -0.26 0.00 0.00 60.65 61.99 2rcu s ILE 656 Cb -0.43 -3.82 -0.01 0.00 1.25 0.00 0.00 42.46 39.45 2rcu s ILE 656 CO 0.50 0.26 1.24 -0.54 0.24 0.00 0.00 174.94 176.63 2rcu s LYS 657 N -1.73 4.24 0.00 0.37 1.02 -1.26 -5.09 119.74 117.29 2rcu s LYS 657 Ca 0.48 1.63 0.00 0.00 0.02 0.00 0.00 55.97 58.11 2rcu s LYS 657 Cb -0.31 -3.74 0.00 0.00 -0.52 0.00 0.00 37.83 33.26 2rcu s LYS 657 CO 0.40 -0.68 0.42 0.25 -0.92 0.00 0.00 175.35 174.82