#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2h4t n ASP 32 N 0.00 0.35 -1.76 0.00 5.68 -1.26 -5.02 116.55 114.53 2h4t n ASP 32 Ca 0.00 -1.28 0.08 0.00 -0.50 0.00 0.00 54.79 53.09 2h4t n ASP 32 Cb 0.00 -0.13 0.38 0.00 -1.14 0.00 0.00 41.12 40.23 2h4t n ASP 32 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 2h4t n ASP 33 N -2.95 5.30 -4.86 -1.12 8.00 -1.26 -4.93 116.55 114.73 2h4t n ASP 33 Ca 0.04 -2.73 -0.37 0.00 0.71 0.00 0.00 54.79 52.44 2h4t n ASP 33 Cb 0.13 -0.65 -0.06 0.00 -0.02 0.00 0.00 41.12 40.53 2h4t n ASP 33 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 2h4t s TYR 34 N -2.40 3.57 -2.30 1.24 4.12 -1.26 -4.46 117.35 115.86 2h4t s TYR 34 Ca 0.52 0.50 0.23 0.00 0.02 0.00 0.00 57.07 58.34 2h4t s TYR 34 Cb 0.38 -1.95 0.51 0.00 -1.52 0.00 0.00 41.96 39.39 2h4t s TYR 34 CO 0.19 0.70 1.45 1.47 0.02 0.00 0.00 175.55 179.38 2h4t n LEU 35 N 2.08 3.46 -3.53 -1.29 -0.00 -1.26 -4.91 117.00 111.55 2h4t n LEU 35 Ca -0.20 -1.58 -0.16 0.00 -0.00 0.00 0.00 56.01 54.08 2h4t n LEU 35 Cb 0.55 -0.32 -0.05 0.00 -0.00 0.00 0.00 43.42 43.60 2h4t n LEU 35 CO 0.31 0.79 0.37 -1.58 -0.00 0.00 0.00 177.39 177.28 2h4t s GLN 36 N -1.36 1.07 -0.39 1.47 0.74 -1.26 -5.03 119.66 114.90 2h4t s GLN 36 Ca 0.41 -0.01 0.11 0.00 0.05 0.00 0.00 55.36 55.92 2h4t s GLN 36 Cb 0.23 0.50 0.33 0.00 1.10 0.00 0.00 33.01 35.17 2h4t s GLN 36 CO 0.31 -0.37 0.71 0.72 -0.55 0.00 0.00 175.29 176.11 2h4t n HIS 37 N 0.59 0.36 -1.72 1.67 8.25 -1.23 -4.68 115.22 118.47 2h4t n HIS 37 Ca -0.19 -3.79 -0.43 0.00 -0.26 0.00 0.00 57.72 53.06 2h4t n HIS 37 Cb 0.59 -0.41 -0.02 0.00 1.12 0.00 0.00 29.99 31.27 2h4t n HIS 37 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2h4t n SER 38 N 0.45 3.66 -0.33 0.41 2.88 -0.11 -4.87 113.62 115.71 2h4t n SER 38 Ca 0.25 1.13 0.14 0.00 -1.33 0.00 0.00 58.87 59.05 2h4t n SER 38 Cb 0.62 -1.55 0.55 0.00 -0.75 0.00 0.00 64.21 63.07 2h4t n SER 38 CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 175.04 176.11 2h4t n ILE 39 N 2.51 0.00 -3.93 2.46 -5.35 -1.26 -4.64 119.36 109.15 2h4t n ILE 39 Ca 0.11 -0.17 -0.35 0.00 -0.27 0.00 0.00 62.75 62.07 2h4t n ILE 39 Cb 0.35 0.30 -0.14 0.00 -1.74 0.00 0.00 39.64 38.41 2h4t n ILE 39 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 2h4t s VAL 40 N -2.17 3.15 0.25 7.28 1.01 -1.26 -4.84 120.40 123.82 2h4t s VAL 40 Ca 0.35 -0.66 -0.29 0.00 0.00 0.00 0.00 61.98 61.38 2h4t s VAL 40 Cb 0.21 -2.47 -0.15 0.00 0.00 0.00 0.00 36.38 33.97 2h4t s VAL 40 CO 0.40 0.38 0.96 -2.65 0.00 0.00 0.00 175.10 174.19 2h4t n PRO 41 N 4.76 1.09 -0.23 2.72 -0.02 -1.26 -4.50 135.00 137.56 2h4t n PRO 41 Ca -0.18 0.38 0.03 0.00 -2.02 0.00 0.00 63.50 61.71 2h4t n PRO 41 Cb 0.50 -1.72 0.14 0.00 -0.02 0.00 0.00 33.50 32.39 2h4t n PRO 41 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 2h4t h THR 42 N 1.98 0.48 -0.39 3.45 2.02 -1.50 -0.78 112.91 118.18 2h4t h THR 42 Ca -0.38 -0.06 -0.00 0.00 0.77 0.00 0.00 66.41 66.73 2h4t h THR 42 Cb 1.36 0.30 -0.00 0.00 -1.74 0.00 0.00 68.15 68.06 2h4t h THR 42 CO 0.62 0.03 0.00 0.23 0.37 0.00 0.00 175.52 176.77 2h4t n MET 43 N -5.24 3.60 -0.00 6.66 2.81 -1.26 -4.15 117.12 119.53 2h4t n MET 43 Ca 0.11 -2.11 0.19 0.00 -1.81 0.00 0.00 57.70 54.09 2h4t n MET 43 Cb 0.41 -2.01 0.68 0.00 -0.71 0.00 0.00 33.22 31.58 2h4t n MET 43 CO 0.00 0.00 0.00 1.25 1.51 0.00 0.00 175.97 178.73 2h4t h HIS 44 N 2.66 0.03 -0.01 2.03 6.17 -1.47 -2.50 115.15 122.05 2h4t h HIS 44 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 60.37 61.08 2h4t h HIS 44 Cb 1.50 -0.01 0.00 0.00 2.52 0.00 0.00 27.41 31.42 2h4t h HIS 44 CO 0.74 0.01 -0.54 0.66 0.71 0.00 0.00 177.93 179.51 2h4t n TYR 45 N -4.39 0.00 -0.37 5.26 4.01 -1.26 -4.34 117.16 116.07 2h4t n TYR 45 Ca 0.10 0.00 0.03 0.00 -0.16 0.00 0.00 57.90 57.87 2h4t n TYR 45 Cb 0.58 0.00 0.18 0.00 -0.31 0.00 0.00 39.34 39.80 2h4t n TYR 45 CO 0.00 0.00 0.00 1.96 -0.46 0.00 0.00 176.86 178.36 2h4t h GLN 46 N 2.08 1.14 0.00 -0.72 1.08 -1.77 -2.48 115.11 114.43 2h4t h GLN 46 Ca 0.00 -0.07 -0.04 0.00 -1.45 0.00 0.00 58.65 57.09 2h4t h GLN 46 Cb 0.71 -0.26 -0.01 0.00 -0.05 0.00 0.00 27.48 27.88 2h4t h GLN 46 CO 0.00 0.75 -0.19 -0.44 -0.95 0.00 0.00 178.83 178.00 2h4t h ASP 47 N 1.17 0.00 -0.44 1.46 3.32 -1.79 -3.20 116.42 116.94 2h4t h ASP 47 Ca 0.44 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.49 2h4t h ASP 47 Cb 0.19 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.74 2h4t h ASP 47 CO -0.18 0.19 0.00 -1.54 -1.72 0.00 0.00 179.24 175.99 2h4t n SER 48 N -3.49 3.37 -4.77 6.45 3.41 -0.95 -4.85 113.62 112.79 2h4t n SER 48 Ca -0.01 -2.13 -0.40 0.00 -0.26 0.00 0.00 58.87 56.08 2h4t n SER 48 Cb 0.36 -0.34 0.01 0.00 -0.26 0.00 0.00 64.21 63.98 2h4t n SER 48 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2h4t s LEU 49 N -1.23 4.14 0.62 1.04 1.43 -1.09 -4.63 118.68 118.95 2h4t s LEU 49 Ca 0.32 2.86 -0.18 0.00 -1.03 0.00 0.00 54.13 56.11 2h4t s LEU 49 Cb 0.18 -3.92 -0.02 0.00 0.03 0.00 0.00 46.19 42.46 2h4t s LEU 49 CO 0.19 -1.10 1.17 -2.84 0.23 0.00 0.00 176.35 174.01 2h4t s PRO 50 N -2.40 2.90 0.34 1.29 0.02 -1.26 -4.46 135.00 131.43 2h4t s PRO 50 Ca 0.60 1.68 -0.26 0.00 0.02 0.00 0.00 61.00 63.05 2h4t s PRO 50 Cb -0.42 -1.94 -0.10 0.00 0.02 0.00 0.00 34.50 32.06 2h4t s PRO 50 CO 0.55 -1.23 0.99 1.03 -0.33 0.00 0.00 177.00 178.00 2h4t s ARG 51 N -3.55 4.48 -0.07 5.54 0.52 -1.26 0.12 118.95 124.72 2h4t s ARG 51 Ca 0.74 1.42 -0.30 0.00 -0.52 0.00 0.00 55.73 57.07 2h4t s ARG 51 Cb -0.27 -2.76 -0.06 0.00 0.52 0.00 0.00 34.95 32.38 2h4t s ARG 51 CO 0.35 0.16 1.73 -1.17 0.02 0.00 0.00 175.30 176.39 2h4t s LEU 52 N -2.16 4.23 0.60 2.53 2.96 -1.26 -4.82 118.68 120.76 2h4t s LEU 52 Ca 0.52 2.20 -0.16 0.00 -0.22 0.00 0.00 54.13 56.46 2h4t s LEU 52 Cb -0.21 -3.53 -0.03 0.00 0.50 0.00 0.00 46.19 42.92 2h4t s LEU 52 CO 0.26 -1.05 1.08 -2.16 -1.32 0.00 0.00 176.35 173.16 2h4t s PRO 53 N 4.32 3.20 -0.21 0.98 0.04 -1.26 -4.78 135.00 137.29 2h4t s PRO 53 Ca 0.77 1.31 -0.06 0.00 0.04 0.00 0.00 61.00 63.06 2h4t s PRO 53 Cb -0.34 -2.01 -0.03 0.00 0.04 0.00 0.00 34.50 32.16 2h4t s PRO 53 CO 0.32 -0.92 0.04 0.42 0.04 0.00 0.00 177.00 176.90 2h4t s ILE 54 N -2.31 4.29 0.82 0.56 1.01 -1.26 -4.90 121.20 119.41 2h4t s ILE 54 Ca 0.66 -0.19 -0.11 0.00 0.00 0.00 0.00 60.65 61.00 2h4t s ILE 54 Cb -0.18 -2.96 0.09 0.00 0.01 0.00 0.00 42.46 39.42 2h4t s ILE 54 CO 0.36 0.40 1.13 -2.84 0.00 0.00 0.00 174.94 174.00 2h4t s PRO 55 N 1.06 1.72 0.28 2.79 0.02 -1.26 -4.97 135.00 134.64 2h4t s PRO 55 Ca 0.03 1.43 -0.29 0.00 0.02 0.00 0.00 61.00 62.19 2h4t s PRO 55 Cb -0.14 -1.82 -0.10 0.00 0.02 0.00 0.00 34.50 32.47 2h4t s PRO 55 CO 0.03 -2.09 1.19 0.15 -0.33 0.00 0.00 177.00 175.94 2h4t s LYS 56 N -4.60 4.52 0.32 5.54 -0.14 -1.26 -4.90 119.74 119.22 2h4t s LYS 56 Ca 0.66 1.96 0.07 0.00 -1.36 0.00 0.00 55.97 57.29 2h4t s LYS 56 Cb -0.21 -3.16 0.74 0.00 -1.68 0.00 0.00 37.83 33.52 2h4t s LYS 56 CO 0.54 0.03 1.83 1.25 -0.76 0.00 0.00 175.35 178.24 2h4t h LEU 57 N 3.92 0.75 -0.77 3.17 5.85 -1.99 -1.24 115.31 125.00 2h4t h LEU 57 Ca -0.47 0.06 0.02 0.00 0.84 0.00 0.00 57.88 58.33 2h4t h LEU 57 Cb 1.22 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 42.12 2h4t h LEU 57 CO 0.68 0.35 0.50 -0.08 -0.34 0.00 0.00 178.44 179.54 2h4t h GLU 58 N 0.78 0.96 -0.43 1.25 4.81 -1.96 -1.40 114.58 118.59 2h4t h GLU 58 Ca 0.50 -0.06 -0.13 0.00 -0.13 0.00 0.00 59.36 59.55 2h4t h GLU 58 Cb 0.75 -0.22 -0.01 0.00 0.63 0.00 0.00 28.75 29.90 2h4t h GLU 58 CO -0.27 0.63 -0.23 -0.44 -0.73 0.00 0.00 179.01 177.97 2h4t h ASP 59 N 0.99 0.95 -0.53 1.04 3.32 -1.62 -2.61 116.42 117.95 2h4t h ASP 59 Ca 0.30 -0.41 -0.00 0.00 0.02 0.00 0.00 57.03 56.93 2h4t h ASP 59 Cb -0.04 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.22 2h4t h ASP 59 CO -0.09 1.15 0.32 0.74 -1.72 0.00 0.00 179.24 179.65 2h4t h THR 60 N 0.75 1.16 -0.55 0.35 2.02 -1.09 0.24 112.91 115.78 2h4t h THR 60 Ca 0.09 -0.35 -0.08 0.00 0.77 0.00 0.00 66.41 66.84 2h4t h THR 60 Cb 0.81 0.43 -0.02 0.00 -1.74 0.00 0.00 68.15 67.63 2h4t h THR 60 CO 0.07 0.16 0.03 0.24 0.37 0.00 0.00 175.52 176.39 2h4t h MET 61 N 0.71 0.92 -0.38 6.66 2.86 -1.24 -0.29 114.93 124.18 2h4t h MET 61 Ca 0.19 -0.26 -0.10 0.00 -2.06 0.00 0.00 59.70 57.47 2h4t h MET 61 Cb -0.02 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 31.52 2h4t h MET 61 CO -0.04 0.90 -0.16 -0.22 1.06 0.00 0.00 176.91 178.46 2h4t h LYS 62 N 0.86 0.78 -0.47 1.72 3.64 -1.12 -1.69 116.57 120.29 2h4t h LYS 62 Ca 0.17 -0.33 -0.08 0.00 -1.27 0.00 0.00 60.65 59.14 2h4t h LYS 62 Cb 0.47 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.24 2h4t h LYS 62 CO 0.02 0.95 -0.03 0.00 -2.27 0.00 0.00 179.45 178.12 2h4t h ARG 63 N 0.58 0.80 -0.47 1.90 3.08 -0.77 0.02 114.38 119.52 2h4t h ARG 63 Ca 0.09 -0.23 -0.03 0.00 0.07 0.00 0.00 59.98 59.88 2h4t h ARG 63 Cb 0.70 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.64 2h4t h ARG 63 CO 0.05 0.82 0.16 -0.92 -1.07 0.00 0.00 179.97 179.01 2h4t h TYR 64 N 0.74 0.75 -0.43 3.04 3.20 -0.92 -1.82 116.97 121.53 2h4t h TYR 64 Ca 0.14 -0.07 -0.11 0.00 3.14 0.00 0.00 58.73 61.83 2h4t h TYR 64 Cb 0.49 -0.22 -0.02 0.00 1.54 0.00 0.00 36.73 38.52 2h4t h TYR 64 CO 0.03 0.66 -0.15 -0.07 -1.64 0.00 0.00 178.16 176.98 2h4t h LEU 65 N 0.63 0.82 -0.83 2.82 3.38 -0.98 -2.28 115.31 118.86 2h4t h LEU 65 Ca 0.15 -0.27 -0.00 0.00 0.09 0.00 0.00 57.88 57.85 2h4t h LEU 65 Cb 0.25 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.73 2h4t h LEU 65 CO -0.01 0.97 0.51 0.78 0.09 0.00 0.00 178.44 180.79 2h4t h ASN 66 N 0.73 0.99 0.86 -0.43 2.35 -0.73 -1.29 115.58 118.06 2h4t h ASN 66 Ca 0.11 -0.06 -0.03 0.00 -0.55 0.00 0.00 56.30 55.77 2h4t h ASN 66 Cb 0.66 -0.25 -0.00 0.00 0.05 0.00 0.00 38.32 38.78 2h4t h ASN 66 CO 0.05 0.75 -0.16 0.00 -1.65 0.00 0.00 177.43 176.42 2h4t h ALA 67 N 1.28 1.05 0.00 -0.83 0.00 -1.07 -2.87 119.26 116.81 2h4t h ALA 67 Ca 0.30 -0.15 -0.15 0.00 0.00 0.00 0.00 54.91 54.91 2h4t h ALA 67 Cb -0.06 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 2h4t h ALA 67 CO -0.06 0.20 -0.89 1.96 0.00 0.00 0.00 179.25 180.47 2h4t h GLN 68 N 0.00 0.00 -0.80 0.00 1.08 -0.77 -3.38 115.11 111.24 2h4t h GLN 68 Ca -0.00 0.00 0.18 0.00 -1.45 0.00 0.00 58.65 57.38 2h4t h GLN 68 Cb 0.63 0.00 -0.14 0.00 -0.05 0.00 0.00 27.48 27.92 2h4t h GLN 68 CO 0.02 0.55 -0.06 0.87 -0.95 0.00 0.00 178.83 179.26 2h4t h LYS 69 N 0.00 0.05 0.00 1.46 1.57 -1.03 0.16 116.57 118.78 2h4t h LYS 69 Ca -0.06 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 2h4t h LYS 69 Cb 1.55 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.84 2h4t h LYS 69 CO 0.07 0.04 0.00 -0.35 -0.57 0.00 0.00 179.45 178.64 2h4t n PRO 70 N -5.42 0.04 -0.03 3.15 -0.04 -1.26 -3.82 135.00 127.62 2h4t n PRO 70 Ca 0.14 0.07 0.01 0.00 -0.04 0.00 0.00 63.50 63.68 2h4t n PRO 70 Cb 0.48 -1.55 -0.14 0.00 -0.04 0.00 0.00 33.50 32.25 2h4t n PRO 70 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2h4t n LEU 71 N -1.63 0.23 -4.63 1.53 4.77 0.45 -4.86 117.00 112.85 2h4t n LEU 71 Ca 0.06 0.10 -0.31 0.00 -0.03 0.00 0.00 56.01 55.83 2h4t n LEU 71 Cb 0.33 0.19 -0.09 0.00 -2.33 0.00 0.00 43.42 41.51 2h4t n LEU 71 CO 0.26 0.20 -0.36 -0.76 -1.33 0.00 0.00 177.39 175.39 2h4t s LEU 72 N -5.17 3.29 0.87 2.23 1.43 -0.63 -5.06 118.68 115.64 2h4t s LEU 72 Ca -0.07 -0.16 -0.13 0.00 -1.03 0.00 0.00 54.13 52.73 2h4t s LEU 72 Cb 0.10 -1.96 0.13 0.00 0.03 0.00 0.00 46.19 44.49 2h4t s LEU 72 CO 0.85 0.24 1.23 1.51 0.23 0.00 0.00 176.35 180.42 2h4t s ASP 73 N -1.79 3.98 0.19 2.29 3.84 -1.26 -4.72 116.67 119.20 2h4t s ASP 73 Ca 0.20 0.58 -0.13 0.00 -0.00 0.00 0.00 52.55 53.20 2h4t s ASP 73 Cb -0.11 -0.90 0.20 0.00 -1.38 0.00 0.00 42.92 40.72 2h4t s ASP 73 CO 0.12 -2.22 1.69 0.44 -0.00 0.00 0.00 175.17 175.20 2h4t h ASP 74 N -1.27 -0.19 -0.20 2.11 3.32 -1.99 -0.72 116.42 117.48 2h4t h ASP 74 Ca -0.45 0.12 0.02 0.00 0.02 0.00 0.00 57.03 56.73 2h4t h ASP 74 Cb 1.29 0.20 -0.02 0.00 0.22 0.00 0.00 39.33 41.03 2h4t h ASP 74 CO 0.55 -0.06 0.08 0.28 -1.72 0.00 0.00 179.24 178.37 2h4t h SER 75 N 0.13 0.11 -0.63 6.45 0.02 -2.00 -1.44 113.55 116.20 2h4t h SER 75 Ca 0.26 0.02 -0.03 0.00 -0.84 0.00 0.00 61.79 61.19 2h4t h SER 75 Cb 0.38 -0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.90 2h4t h SER 75 CO -0.41 0.09 0.26 1.56 -1.14 0.00 0.00 176.83 177.19 2h4t h GLN 76 N 0.18 0.93 -0.43 3.45 4.20 -1.83 -2.61 115.11 118.99 2h4t h GLN 76 Ca 0.08 -0.16 -0.02 0.00 0.06 0.00 0.00 58.65 58.61 2h4t h GLN 76 Cb 0.04 -0.15 -0.02 0.00 0.30 0.00 0.00 27.48 27.65 2h4t h GLN 76 CO -0.08 0.78 0.18 0.35 -0.67 0.00 0.00 178.83 179.39 2h4t h PHE 77 N 0.87 0.64 -0.56 2.96 3.57 -0.91 -1.19 116.94 122.33 2h4t h PHE 77 Ca 0.21 -0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.67 2h4t h PHE 77 Cb 0.19 -0.20 -0.03 0.00 2.79 0.00 0.00 35.95 38.71 2h4t h PHE 77 CO 0.01 0.55 0.36 0.00 -2.23 0.00 0.00 178.31 177.00 2h4t h ARG 78 N 0.55 0.75 -0.13 1.11 3.08 -1.18 0.20 114.38 118.77 2h4t h ARG 78 Ca 0.15 -0.06 -0.00 0.00 0.07 0.00 0.00 59.98 60.14 2h4t h ARG 78 Cb 0.17 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.05 2h4t h ARG 78 CO -0.01 0.52 0.07 0.00 -1.07 0.00 0.00 179.97 179.47 2h4t h ARG 79 N 0.76 0.18 -0.92 0.04 3.08 -1.26 -1.25 114.38 115.02 2h4t h ARG 79 Ca 0.20 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.22 2h4t h ARG 79 Cb -0.06 -0.03 -0.04 0.00 0.08 0.00 0.00 29.97 29.91 2h4t h ARG 79 CO -0.04 0.23 0.55 1.15 -1.07 0.00 0.00 179.97 180.78 2h4t h THR 80 N 0.10 1.25 -0.87 2.04 2.02 -0.92 -1.83 112.91 114.70 2h4t h THR 80 Ca 0.05 -0.56 -0.02 0.00 0.77 0.00 0.00 66.41 66.64 2h4t h THR 80 Cb 0.10 -0.03 -0.04 0.00 -1.74 0.00 0.00 68.15 66.44 2h4t h THR 80 CO -0.01 0.27 0.46 -0.08 0.37 0.00 0.00 175.52 176.53 2h4t h GLU 81 N 1.26 1.23 -0.64 6.66 4.81 -0.31 -0.59 114.58 126.99 2h4t h GLU 81 Ca 0.33 -0.15 -0.05 0.00 -0.13 0.00 0.00 59.36 59.35 2h4t h GLU 81 Cb -0.05 -0.24 -0.03 0.00 0.63 0.00 0.00 28.75 29.07 2h4t h GLU 81 CO -0.06 0.91 0.19 0.00 -0.73 0.00 0.00 179.01 179.32 2h4t h ALA 82 N 1.28 1.12 -0.48 2.92 0.00 -0.62 -1.55 119.26 121.94 2h4t h ALA 82 Ca 0.31 -0.21 -0.10 0.00 0.00 0.00 0.00 54.91 54.91 2h4t h ALA 82 Cb 0.05 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 2h4t h ALA 82 CO -0.05 0.60 -0.11 -0.07 0.00 0.00 0.00 179.25 179.63 2h4t h LEU 83 N 0.95 0.86 -0.62 0.00 3.38 -0.57 -2.04 115.31 117.27 2h4t h LEU 83 Ca 0.21 -0.27 -0.05 0.00 0.09 0.00 0.00 57.88 57.87 2h4t h LEU 83 Cb 0.29 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.78 2h4t h LEU 83 CO -0.01 0.98 0.21 0.00 0.09 0.00 0.00 178.44 179.71 2h4t h LYS 85 N 0.88 -0.06 -0.70 0.00 1.79 -1.03 0.13 116.57 117.58 2h4t h LYS 85 Ca 0.20 0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.64 2h4t h LYS 85 Cb 0.27 0.01 -0.03 0.00 -1.58 0.00 0.00 32.23 30.90 2h4t h LYS 85 CO -0.01 -0.04 0.30 -0.91 -1.08 0.00 0.00 179.45 177.71 2h4t h ASN 86 N -0.06 0.92 -0.25 0.86 2.35 -1.21 -2.54 115.58 115.66 2h4t h ASN 86 Ca 0.02 -0.12 -0.03 0.00 -0.55 0.00 0.00 56.30 55.62 2h4t h ASN 86 Cb 0.09 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.22 2h4t h ASN 86 CO -0.06 0.81 0.02 0.15 -1.65 0.00 0.00 177.43 176.70 2h4t h PHE 87 N 1.00 0.46 -0.30 1.19 3.57 -0.56 0.22 116.94 122.53 2h4t h PHE 87 Ca 0.24 -0.07 -0.04 0.00 3.53 0.00 0.00 57.97 61.63 2h4t h PHE 87 Cb 0.16 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 38.76 2h4t h PHE 87 CO 0.01 0.57 0.01 1.49 -2.23 0.00 0.00 178.31 178.17 2h4t h GLU 88 N 0.22 0.45 0.00 1.11 4.81 -0.58 -0.46 114.58 120.13 2h4t h GLU 88 Ca 0.07 -0.08 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 2h4t h GLU 88 Cb 0.37 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.68 2h4t h GLU 88 CO 0.01 0.47 -1.11 0.25 -0.73 0.00 0.00 179.01 177.90 2h4t n THR 89 N -4.31 0.05 0.00 0.32 -2.24 -0.97 -3.89 114.28 103.24 2h4t n THR 89 Ca 0.01 -0.15 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 2h4t n THR 89 Cb 0.22 0.52 0.00 0.00 -2.10 0.00 0.00 70.33 68.97 2h4t n THR 89 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2h4t n GLY 90 N 1.42 1.08 0.37 3.38 0.00 0.78 -4.78 105.19 107.44 2h4t n GLY 90 Ca 0.02 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.11 2h4t n GLY 90 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2h4t h VAL 91 N 0.00 0.97 -0.64 1.61 3.04 -1.75 -1.59 116.25 117.89 2h4t h VAL 91 Ca 0.00 -0.34 0.06 0.00 -1.01 0.00 0.00 66.70 65.41 2h4t h VAL 91 Cb 0.00 -0.09 -0.05 0.00 -2.01 0.00 0.00 31.29 29.13 2h4t h VAL 91 CO 0.00 0.18 0.35 1.23 -1.01 0.00 0.00 177.57 178.32 2h4t h GLY 92 N 0.98 0.93 0.85 3.17 0.00 -1.38 0.12 103.07 107.73 2h4t h GLY 92 Ca 0.45 -0.24 0.04 0.00 0.00 0.00 0.00 47.33 47.57 2h4t h GLY 92 CO -0.21 0.14 0.50 1.70 0.00 0.00 0.00 176.54 178.68 2h4t h LYS 93 N 0.65 0.95 -0.25 4.80 3.64 -1.02 0.30 116.57 125.64 2h4t h LYS 93 Ca 0.29 -0.06 -0.15 0.00 -1.27 0.00 0.00 60.65 59.46 2h4t h LYS 93 Cb 0.18 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 31.79 2h4t h LYS 93 CO -0.18 0.63 -0.44 0.93 -2.27 0.00 0.00 179.45 178.12 2h4t h GLU 94 N 0.97 0.73 -0.58 1.90 4.39 -1.14 -2.44 114.58 118.42 2h4t h GLU 94 Ca 0.32 -0.46 0.02 0.00 0.34 0.00 0.00 59.36 59.58 2h4t h GLU 94 Cb 0.03 0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 28.70 2h4t h GLU 94 CO -0.12 1.08 0.37 -0.07 -1.16 0.00 0.00 179.01 179.11 2h4t h LEU 95 N 0.46 0.62 -0.79 1.33 3.38 -0.44 -1.87 115.31 118.00 2h4t h LEU 95 Ca 0.01 -0.01 0.03 0.00 0.09 0.00 0.00 57.88 58.01 2h4t h LEU 95 Cb 1.04 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 41.60 2h4t h LEU 95 CO 0.10 0.44 0.50 -0.74 0.09 0.00 0.00 178.44 178.83 2h4t h HIS 96 N 0.74 0.93 -0.79 1.13 2.76 -0.86 0.16 115.15 119.23 2h4t h HIS 96 Ca 0.22 0.02 -0.04 0.00 -2.20 0.00 0.00 60.37 58.38 2h4t h HIS 96 Cb -0.04 -0.31 -0.04 0.00 1.55 0.00 0.00 27.41 28.58 2h4t h HIS 96 CO -0.05 0.53 0.33 0.00 -1.30 0.00 0.00 177.93 177.45 2h4t h ALA 97 N 1.33 1.02 -0.39 5.26 0.00 -0.94 -0.40 119.26 125.14 2h4t h ALA 97 Ca 0.32 -0.18 -0.12 0.00 0.00 0.00 0.00 54.91 54.93 2h4t h ALA 97 Cb 0.02 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 2h4t h ALA 97 CO -0.12 0.62 -0.23 0.45 0.00 0.00 0.00 179.25 179.98 2h4t h HIS 98 N 1.13 0.90 -0.58 0.00 -0.00 -0.57 -0.96 115.15 115.06 2h4t h HIS 98 Ca 0.26 -0.21 -0.02 0.00 -0.00 0.00 0.00 60.37 60.41 2h4t h HIS 98 Cb 0.19 -0.21 -0.03 0.00 -0.00 0.00 0.00 27.41 27.36 2h4t h HIS 98 CO 0.02 0.94 0.28 1.25 -0.00 0.00 0.00 177.93 180.42 2h4t h LEU 99 N 0.69 0.75 -0.39 2.43 5.85 -0.18 -0.61 115.31 123.84 2h4t h LEU 99 Ca 0.09 -0.12 -0.03 0.00 0.84 0.00 0.00 57.88 58.66 2h4t h LEU 99 Cb 0.74 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.56 2h4t h LEU 99 CO 0.06 0.66 0.14 -0.07 -0.34 0.00 0.00 178.44 178.89 2h4t h LEU 100 N 0.78 0.55 -0.60 2.25 3.38 -0.82 -1.61 115.31 119.25 2h4t h LEU 100 Ca 0.20 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2h4t h LEU 100 Cb 0.11 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.68 2h4t h LEU 100 CO -0.03 0.59 0.38 0.00 0.09 0.00 0.00 178.44 179.47 2h4t h ALA 101 N 0.98 0.76 -0.60 1.53 0.00 -0.90 -2.03 119.26 119.00 2h4t h ALA 101 Ca 0.13 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 2h4t h ALA 101 Cb 0.22 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 2h4t h ALA 101 CO -0.01 0.22 0.20 0.37 0.00 0.00 0.00 179.25 180.03 2h4t h GLN 102 N 0.81 0.91 -0.69 0.00 4.15 -0.95 -2.49 115.11 116.85 2h4t h GLN 102 Ca 0.22 -0.17 -0.05 0.00 0.77 0.00 0.00 58.65 59.42 2h4t h GLN 102 Cb -0.05 -0.15 -0.03 0.00 0.21 0.00 0.00 27.48 27.46 2h4t h GLN 102 CO -0.04 0.77 0.22 0.22 -1.93 0.00 0.00 178.83 178.07 2h4t h ASP 103 N 0.88 0.99 0.51 -0.69 3.58 -0.81 -2.25 116.42 118.64 2h4t h ASP 103 Ca 0.20 -0.20 -0.03 0.00 0.42 0.00 0.00 57.03 57.42 2h4t h ASP 103 Cb 0.24 -0.26 -0.00 0.00 1.72 0.00 0.00 39.33 41.03 2h4t h ASP 103 CO -0.01 0.93 -0.12 0.11 -2.88 0.00 0.00 179.24 177.27 2h4t h LYS 104 N 1.00 0.00 -0.01 0.28 1.57 -0.96 -1.47 116.57 116.98 2h4t h LYS 104 Ca 0.22 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.00 2h4t h LYS 104 Cb 0.29 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.60 2h4t h LYS 104 CO -0.01 0.12 -0.11 1.04 -0.57 0.00 0.00 179.45 179.93 2h4t n GLN 105 N -3.51 1.19 -3.11 3.15 6.02 -0.88 -4.25 117.38 116.00 2h4t n GLN 105 Ca -0.01 -0.64 -0.17 0.00 -0.01 0.00 0.00 57.00 56.16 2h4t n GLN 105 Cb 0.27 -1.49 -0.02 0.00 1.02 0.00 0.00 30.24 30.03 2h4t n GLN 105 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2h4t n ASN 106 N -0.34 0.14 0.00 1.08 4.13 -0.56 -4.97 115.26 114.74 2h4t n ASN 106 Ca 0.16 -3.07 0.10 0.00 1.68 0.00 0.00 54.58 53.45 2h4t n ASN 106 Cb 0.33 -0.17 0.52 0.00 -1.54 0.00 0.00 39.78 38.92 2h4t n ASN 106 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 2h4t n LYS 107 N 0.51 0.31 -0.38 3.52 5.02 -1.14 -2.99 118.16 123.02 2h4t n LYS 107 Ca 0.21 0.09 0.11 0.00 -2.02 0.00 0.00 58.31 56.70 2h4t n LYS 107 Cb 0.64 -1.50 0.32 0.00 -0.02 0.00 0.00 35.03 34.47 2h4t n LYS 107 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 2h4t n HIS 108 N -1.27 0.98 -3.70 2.13 8.25 -1.26 -4.93 115.22 115.42 2h4t n HIS 108 Ca 0.10 -0.51 0.00 0.00 -0.26 0.00 0.00 57.72 57.05 2h4t n HIS 108 Cb 0.16 -0.02 0.00 0.00 1.12 0.00 0.00 29.99 31.25 2h4t n HIS 108 CO 0.00 0.00 0.00 -2.37 0.64 0.00 0.00 176.34 174.61 2h4t n THR 109 N 1.55 0.00 -4.46 1.59 5.66 -1.16 -4.81 114.28 112.64 2h4t n THR 109 Ca 0.24 0.00 -0.24 0.00 -3.05 0.00 0.00 64.05 61.00 2h4t n THR 109 Cb 0.63 0.00 -0.10 0.00 -1.55 0.00 0.00 70.33 69.31 2h4t n THR 109 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 2h4t s SER 110 N -0.45 3.54 0.52 1.09 1.04 -1.26 -4.74 113.70 113.45 2h4t s SER 110 Ca 0.00 -1.02 0.30 0.00 0.48 0.00 0.00 55.95 55.71 2h4t s SER 110 Cb 0.00 -0.29 1.28 0.00 0.10 0.00 0.00 66.02 67.10 2h4t s SER 110 CO 0.00 0.03 1.96 0.10 0.98 0.00 0.00 173.24 176.31 2h4t h TYR 111 N 2.32 0.00 0.00 5.02 -0.00 -1.90 -3.28 116.97 119.13 2h4t h TYR 111 Ca -0.40 0.00 -0.22 0.00 0.00 0.00 0.00 58.73 58.10 2h4t h TYR 111 Cb 1.26 0.00 -0.04 0.00 0.00 0.00 0.00 36.73 37.94 2h4t h TYR 111 CO 0.80 0.09 -1.98 1.51 -0.00 0.00 0.00 178.16 178.58 2h4t n ILE 112 N -3.25 1.03 0.14 -0.90 0.13 -1.26 -4.56 119.36 110.70 2h4t n ILE 112 Ca 0.00 -0.73 -0.14 0.00 -1.10 0.00 0.00 62.75 60.79 2h4t n ILE 112 Cb 0.33 -0.47 -0.06 0.00 -0.84 0.00 0.00 39.64 38.59 2h4t n ILE 112 CO 0.00 0.00 0.00 -1.28 2.80 0.00 0.00 176.55 178.07 2h4t h SER 113 N 0.00 -0.83 0.25 9.51 0.87 -1.79 -0.89 113.55 120.67 2h4t h SER 113 Ca -0.30 0.09 0.01 0.00 -1.23 0.00 0.00 61.79 60.36 2h4t h SER 113 Cb 1.76 0.30 -0.04 0.00 -0.44 0.00 0.00 62.40 63.99 2h4t h SER 113 CO 0.03 -0.40 -0.47 1.23 -0.53 0.00 0.00 176.83 176.69 2h4t h GLY 114 N -0.55 -1.04 1.24 5.77 0.00 -1.82 -1.68 103.07 104.99 2h4t h GLY 114 Ca 0.01 0.56 0.06 0.00 0.00 0.00 0.00 47.33 47.96 2h4t h GLY 114 CO -0.13 -0.30 0.37 -2.55 0.00 0.00 0.00 176.54 173.92 2h4t h PRO 115 N -0.79 0.50 -0.21 4.80 0.11 -1.79 -1.73 132.00 132.90 2h4t h PRO 115 Ca -0.01 -0.03 -0.05 0.00 0.11 0.00 0.00 66.00 66.02 2h4t h PRO 115 Cb 0.76 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 31.75 2h4t h PRO 115 CO -0.19 0.33 -0.05 2.35 -0.21 0.00 0.00 178.00 180.23 2h4t h TRP 116 N 0.52 0.45 -0.68 0.65 2.91 -0.78 -1.57 115.95 117.44 2h4t h TRP 116 Ca 0.24 -0.10 0.01 0.00 1.13 0.00 0.00 58.89 60.17 2h4t h TRP 116 Cb 0.28 -0.11 -0.03 0.00 -0.51 0.00 0.00 29.16 28.78 2h4t h TRP 116 CO -0.00 0.65 0.45 0.74 -1.03 0.00 0.00 178.44 179.25 2h4t h PHE 117 N 0.12 0.86 -0.86 2.65 0.05 -0.95 -2.60 116.94 116.21 2h4t h PHE 117 Ca 0.05 0.02 0.00 0.00 3.82 0.00 0.00 57.97 61.86 2h4t h PHE 117 Cb 0.50 -0.29 -0.04 0.00 2.00 0.00 0.00 35.95 38.12 2h4t h PHE 117 CO 0.05 0.54 0.54 0.22 -0.18 0.00 0.00 178.31 179.49 2h4t h ASP 118 N 0.93 1.02 -0.29 2.17 -0.00 -1.21 0.05 116.42 119.08 2h4t h ASP 118 Ca 0.25 -0.05 0.03 0.00 -0.00 0.00 0.00 57.03 57.26 2h4t h ASP 118 Cb -0.11 -0.26 -0.03 0.00 -0.00 0.00 0.00 39.33 38.94 2h4t h ASP 118 CO -0.05 0.76 0.11 -0.03 -0.00 0.00 0.00 179.24 180.03 2h4t h MET 119 N 1.18 0.24 0.02 0.28 4.05 -0.90 -0.64 114.93 119.15 2h4t h MET 119 Ca 0.31 -0.01 -0.21 0.00 -0.28 0.00 0.00 59.70 59.51 2h4t h MET 119 Cb -0.09 -0.05 -0.02 0.00 -0.80 0.00 0.00 31.60 30.64 2h4t h MET 119 CO -0.06 0.16 -0.96 1.88 0.23 0.00 0.00 176.91 178.15 2h4t h TYR 120 N 0.25 0.15 0.00 1.39 -1.99 -1.28 -2.46 116.97 113.02 2h4t h TYR 120 Ca 0.13 -0.10 -0.07 0.00 2.00 0.00 0.00 58.73 60.69 2h4t h TYR 120 Cb 0.08 -0.01 -0.01 0.00 2.00 0.00 0.00 36.73 38.79 2h4t h TYR 120 CO -0.12 0.99 -0.34 -0.07 -0.00 0.00 0.00 178.16 178.62 2h4t h LEU 121 N 0.04 0.00 0.00 3.88 3.38 -0.88 -3.19 115.31 118.54 2h4t h LEU 121 Ca -0.04 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.72 2h4t h LEU 121 Cb 1.66 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.38 2h4t h LEU 121 CO 0.14 0.34 -1.19 0.74 0.09 0.00 0.00 178.44 178.56 2h4t h THR 122 N 0.00 1.15 -2.61 0.22 2.02 -1.12 0.46 112.91 113.03 2h4t h THR 122 Ca -0.00 -2.81 -0.59 0.00 0.77 0.00 0.00 66.41 63.77 2h4t h THR 122 Cb 1.03 2.54 0.08 0.00 -1.74 0.00 0.00 68.15 70.06 2h4t h THR 122 CO 0.04 0.65 0.57 0.00 0.37 0.00 0.00 175.52 177.16 2h4t n ALA 123 N -2.40 0.91 0.75 6.16 0.00 -0.93 -4.72 120.51 120.29 2h4t n ALA 123 Ca -0.06 0.42 0.11 0.00 0.00 0.00 0.00 53.44 53.90 2h4t n ALA 123 Cb 0.93 -2.25 -0.03 0.00 0.00 0.00 0.00 19.45 18.09 2h4t n ALA 123 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2h4t n ARG 124 N 1.98 0.16 -1.27 0.00 5.12 -1.26 -4.83 116.66 116.56 2h4t n ARG 124 Ca 0.12 -0.03 -0.34 0.00 -1.93 0.00 0.00 57.85 55.68 2h4t n ARG 124 Cb 0.31 -1.53 0.11 0.00 -1.16 0.00 0.00 32.46 30.19 2h4t n ARG 124 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 2h4t s ASP 125 N -3.45 3.90 0.33 0.55 -0.00 -1.26 0.07 116.67 116.80 2h4t s ASP 125 Ca 0.05 2.34 -0.29 0.00 -0.00 0.00 0.00 52.55 54.65 2h4t s ASP 125 Cb 0.15 -2.59 -0.12 0.00 -0.00 0.00 0.00 42.92 40.37 2h4t s ASP 125 CO 0.83 -2.46 1.33 -0.24 -0.00 0.00 0.00 175.17 174.63 2h4t n SER 126 N -3.05 2.85 0.17 0.27 2.88 -1.26 -4.48 113.62 111.00 2h4t n SER 126 Ca 0.13 1.20 0.13 0.00 -1.33 0.00 0.00 58.87 59.00 2h4t n SER 126 Cb 0.50 -1.49 0.34 0.00 -0.75 0.00 0.00 64.21 62.82 2h4t n SER 126 CO 0.00 0.00 0.00 0.16 -1.23 0.00 0.00 175.04 173.97 2h4t h ILE 127 N 2.67 0.00 -3.38 2.46 3.07 -1.81 -3.37 117.51 117.14 2h4t h ILE 127 Ca -0.46 -0.66 -0.53 0.00 1.55 0.00 0.00 64.86 64.76 2h4t h ILE 127 Cb 1.28 1.64 0.00 0.00 -0.27 0.00 0.00 36.82 39.47 2h4t h ILE 127 CO 0.65 0.00 0.52 -0.69 -1.05 0.00 0.00 178.15 177.58 2h4t s VAL 128 N -3.20 3.95 0.00 0.16 1.01 -1.26 -1.18 120.40 119.87 2h4t s VAL 128 Ca 0.08 1.53 0.00 0.00 0.00 0.00 0.00 61.98 63.59 2h4t s VAL 128 Cb 0.09 -3.98 0.00 0.00 0.00 0.00 0.00 36.38 32.49 2h4t s VAL 128 CO 0.60 0.19 0.00 0.18 0.00 0.00 0.00 175.10 176.08 2h4t n LEU 129 N 3.14 0.00 -0.16 3.92 4.77 -1.26 -4.54 117.00 122.87 2h4t n LEU 129 Ca 0.06 0.00 0.01 0.00 -0.03 0.00 0.00 56.01 56.04 2h4t n LEU 129 Cb 0.46 0.00 0.27 0.00 -2.33 0.00 0.00 43.42 41.82 2h4t n LEU 129 CO 0.55 0.00 1.17 0.78 -1.33 0.00 0.00 177.39 178.56 2h4t h ASN 130 N 0.00 0.77 0.00 -1.43 2.35 -1.73 -3.34 115.58 112.21 2h4t h ASN 130 Ca 0.00 -0.04 0.00 0.00 -0.55 0.00 0.00 56.30 55.71 2h4t h ASN 130 Cb 0.00 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 38.18 2h4t h ASN 130 CO 0.00 0.60 -0.38 0.49 -1.65 0.00 0.00 177.43 176.49 2h4t n PHE 131 N -4.40 0.00 -1.98 1.19 3.01 -1.00 -4.86 117.46 109.41 2h4t n PHE 131 Ca 0.06 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 58.10 2h4t n PHE 131 Cb 0.07 0.13 -0.03 0.00 -0.01 0.00 0.00 39.48 39.65 2h4t n PHE 131 CO 0.00 0.00 0.00 -0.80 1.01 0.00 0.00 176.76 176.97 2h4t s ASN 132 N -4.08 6.65 0.41 4.37 -0.87 -0.33 -4.60 114.94 116.50 2h4t s ASN 132 Ca 0.00 2.37 0.04 0.00 -1.57 0.00 0.00 52.86 53.70 2h4t s ASN 132 Cb 0.00 -2.55 0.04 0.00 -0.02 0.00 0.00 41.25 38.72 2h4t s ASN 132 CO 0.00 -0.88 0.34 -0.81 -2.57 0.00 0.00 177.10 173.19 2h4t n PRO 133 N 6.03 0.86 -3.90 -0.60 -0.04 -1.24 -4.35 135.00 131.75 2h4t n PRO 133 Ca 0.16 -2.54 -0.09 0.00 -0.04 0.00 0.00 63.50 60.99 2h4t n PRO 133 Cb 0.42 0.22 -0.09 0.00 -0.04 0.00 0.00 33.50 34.01 2h4t n PRO 133 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 2h4t s PHE 134 N -2.00 0.18 -0.05 0.54 -0.12 -0.76 -2.57 117.98 113.20 2h4t s PHE 134 Ca 0.26 -0.52 -0.00 0.00 -0.05 0.00 0.00 56.93 56.62 2h4t s PHE 134 Cb -0.02 -0.12 0.03 0.00 -0.63 0.00 0.00 43.02 42.28 2h4t s PHE 134 CO 0.17 -0.43 -0.01 -1.64 -0.05 0.00 0.00 175.22 173.25 2h4t s MET 135 N -3.08 0.59 -0.10 1.99 -1.94 -0.33 -1.89 119.30 114.54 2h4t s MET 135 Ca -0.01 0.04 -0.08 0.00 -1.71 0.00 0.00 55.69 53.93 2h4t s MET 135 Cb 0.01 -0.80 -0.04 0.00 2.01 0.00 0.00 34.83 36.01 2h4t s MET 135 CO -0.07 -0.19 0.18 0.00 -0.01 0.00 0.00 175.02 174.93 2h4t s ALA 136 N 1.40 3.86 0.54 3.03 0.00 0.18 -0.53 121.76 130.24 2h4t s ALA 136 Ca -0.04 -0.59 -0.17 0.00 0.00 0.00 0.00 51.96 51.17 2h4t s ALA 136 Cb -0.13 -2.02 -0.06 0.00 0.00 0.00 0.00 23.12 20.90 2h4t s ALA 136 CO -0.03 0.60 1.02 -0.06 0.00 0.00 0.00 175.76 177.29 2h4t s PHE 137 N -1.04 3.24 0.50 0.00 0.40 0.36 -0.97 117.98 120.47 2h4t s PHE 137 Ca 0.16 1.49 -0.17 0.00 -0.60 0.00 0.00 56.93 57.82 2h4t s PHE 137 Cb -0.13 -2.89 -0.08 0.00 0.51 0.00 0.00 43.02 40.43 2h4t s PHE 137 CO 0.05 -0.68 0.98 -0.80 0.70 0.00 0.00 175.22 175.47 2h4t s ASN 138 N -2.88 6.66 0.89 1.36 0.01 -0.58 -4.36 114.94 116.04 2h4t s ASN 138 Ca 0.61 1.58 -0.11 0.00 -0.71 0.00 0.00 52.86 54.23 2h4t s ASN 138 Cb -0.13 -2.51 0.13 0.00 0.41 0.00 0.00 41.25 39.15 2h4t s ASN 138 CO 0.32 -0.56 1.09 -2.16 -1.51 0.00 0.00 177.10 174.29 2h4t s PRO 139 N -3.95 1.29 0.21 -0.60 0.04 -1.26 -4.95 135.00 125.78 2h4t s PRO 139 Ca 0.59 0.82 -0.30 0.00 0.04 0.00 0.00 61.00 62.15 2h4t s PRO 139 Cb -0.10 -1.81 -0.09 0.00 0.04 0.00 0.00 34.50 32.54 2h4t s PRO 139 CO 0.29 -2.22 1.25 0.34 0.04 0.00 0.00 177.00 176.71 2h4t s ASP 140 N -3.43 6.98 0.44 6.66 -1.08 -1.26 -4.88 116.67 120.10 2h4t s ASP 140 Ca 0.63 2.35 0.21 0.00 -0.52 0.00 0.00 52.55 55.23 2h4t s ASP 140 Cb -0.18 -2.61 1.19 0.00 -1.46 0.00 0.00 42.92 39.86 2h4t s ASP 140 CO 0.57 -0.45 1.85 -0.65 0.52 0.00 0.00 175.17 177.01 2h4t h PRO 141 N 5.09 0.30 -5.62 4.34 0.11 -1.94 -3.34 132.00 130.93 2h4t h PRO 141 Ca -0.45 -0.02 -0.63 0.00 0.11 0.00 0.00 66.00 65.02 2h4t h PRO 141 Cb 1.21 -0.07 -0.14 0.00 0.11 0.00 0.00 31.00 32.12 2h4t h PRO 141 CO 0.75 0.20 0.48 0.15 -0.21 0.00 0.00 178.00 179.37 2h4t s LYS 142 N -5.33 3.24 0.25 1.05 1.02 -1.26 -4.94 119.74 113.78 2h4t s LYS 142 Ca -0.07 -0.50 -0.11 0.00 0.02 0.00 0.00 55.97 55.30 2h4t s LYS 142 Cb 0.23 -4.10 0.36 0.00 -0.52 0.00 0.00 37.83 33.79 2h4t s LYS 142 CO 0.78 -1.53 1.58 0.66 -0.92 0.00 0.00 175.35 175.92 2h4t h SER 143 N 9.33 -0.92 -1.05 2.83 4.64 -2.00 -0.72 113.55 125.67 2h4t h SER 143 Ca -0.27 0.27 0.28 0.00 -0.47 0.00 0.00 61.79 61.60 2h4t h SER 143 Cb 1.08 0.58 -0.10 0.00 -0.31 0.00 0.00 62.40 63.64 2h4t h SER 143 CO 1.09 -0.29 0.67 1.05 -0.87 0.00 0.00 176.83 178.48 2h4t h GLU 144 N -0.01 0.38 0.00 4.77 4.11 -1.92 0.19 114.58 122.10 2h4t h GLU 144 Ca 0.41 -0.02 0.00 0.00 0.07 0.00 0.00 59.36 59.81 2h4t h GLU 144 Cb 0.64 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.80 2h4t h GLU 144 CO -0.91 0.25 0.00 0.66 0.07 0.00 0.00 179.01 179.08 2h4t n TYR 145 N -4.67 0.00 -0.05 2.06 4.02 -0.28 -3.04 117.16 115.21 2h4t n TYR 145 Ca 0.26 0.00 0.05 0.00 -0.01 0.00 0.00 57.90 58.20 2h4t n TYR 145 Cb 0.90 -0.09 0.24 0.00 -0.02 0.00 0.00 39.34 40.37 2h4t n TYR 145 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 2h4t n ASN 146 N -1.09 3.67 -4.76 7.72 3.02 0.66 -3.84 115.26 120.64 2h4t n ASN 146 Ca 0.14 -2.49 -0.41 0.00 -0.03 0.00 0.00 54.58 51.79 2h4t n ASN 146 Cb 0.10 -0.57 -0.03 0.00 -0.61 0.00 0.00 39.78 38.67 2h4t n ASN 146 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2h4t s ASP 147 N -0.53 6.91 0.11 6.41 2.15 -1.17 -3.67 116.67 126.88 2h4t s ASP 147 Ca 0.32 2.52 -0.33 0.00 0.43 0.00 0.00 52.55 55.49 2h4t s ASP 147 Cb 0.24 -2.63 -0.12 0.00 -0.30 0.00 0.00 42.92 40.10 2h4t s ASP 147 CO 0.11 -0.45 1.57 -0.61 -0.17 0.00 0.00 175.17 175.62 2h4t h GLN 148 N 4.05 -0.67 -0.36 4.34 4.15 -1.83 0.20 115.11 125.00 2h4t h GLN 148 Ca -0.47 0.05 0.05 0.00 0.77 0.00 0.00 58.65 59.05 2h4t h GLN 148 Cb 1.22 0.15 -0.05 0.00 0.21 0.00 0.00 27.48 29.01 2h4t h GLN 148 CO 0.69 -0.45 0.07 1.25 -1.93 0.00 0.00 178.83 178.46 2h4t h LEU 149 N -0.70 0.01 -0.00 -2.39 5.85 -1.93 0.14 115.31 116.29 2h4t h LEU 149 Ca 0.01 0.06 0.01 0.00 0.84 0.00 0.00 57.88 58.80 2h4t h LEU 149 Cb 0.73 0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.83 2h4t h LEU 149 CO -0.30 0.04 -0.03 0.74 -0.34 0.00 0.00 178.44 178.55 2h4t h THR 150 N 0.19 0.91 -0.22 1.05 2.02 -1.81 -1.63 112.91 113.41 2h4t h THR 150 Ca 0.17 0.00 -0.16 0.00 0.77 0.00 0.00 66.41 67.19 2h4t h THR 150 Cb 0.20 0.91 -0.01 0.00 -1.74 0.00 0.00 68.15 67.51 2h4t h THR 150 CO -0.23 0.00 -0.51 -0.09 0.37 0.00 0.00 175.52 175.06 2h4t h ARG 151 N -0.06 0.64 -0.85 6.66 2.43 -0.33 -0.52 114.38 122.34 2h4t h ARG 151 Ca 0.02 -0.38 -0.02 0.00 -0.81 0.00 0.00 59.98 58.79 2h4t h ARG 151 Cb 0.08 0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 29.63 2h4t h ARG 151 CO -0.04 1.00 0.47 0.00 -1.51 0.00 0.00 179.97 179.89 2h4t h ALA 152 N 0.93 1.22 -0.05 2.80 0.00 -0.67 0.24 119.26 123.73 2h4t h ALA 152 Ca 0.02 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 2h4t h ALA 152 Cb 1.07 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 18.51 2h4t h ALA 152 CO 0.10 0.63 -0.01 1.15 0.00 0.00 0.00 179.25 181.12 2h4t h THR 153 N 1.19 1.29 -0.66 0.00 2.02 -1.06 -1.12 112.91 114.58 2h4t h THR 153 Ca 0.30 -0.91 -0.08 0.00 0.77 0.00 0.00 66.41 66.49 2h4t h THR 153 Cb 0.02 1.81 -0.03 0.00 -1.74 0.00 0.00 68.15 68.21 2h4t h THR 153 CO -0.05 0.25 0.10 0.78 0.37 0.00 0.00 175.52 176.97 2h4t h ASN 154 N -0.25 1.05 -0.12 4.18 2.35 -0.81 -0.58 115.58 121.39 2h4t h ASN 154 Ca 0.01 -0.25 -0.13 0.00 -0.55 0.00 0.00 56.30 55.39 2h4t h ASN 154 Cb 0.40 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.48 2h4t h ASN 154 CO 0.00 1.04 -0.34 -0.07 -1.65 0.00 0.00 177.43 176.42 2h4t h LEU 155 N 1.02 0.65 -0.22 1.61 3.38 -0.56 -1.37 115.31 119.82 2h4t h LEU 155 Ca 0.20 -0.27 -0.06 0.00 0.09 0.00 0.00 57.88 57.84 2h4t h LEU 155 Cb 0.44 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 2h4t h LEU 155 CO 0.01 0.94 -0.10 0.74 0.09 0.00 0.00 178.44 180.12 2h4t h THR 156 N 0.53 1.30 -0.35 0.22 2.02 -0.93 -1.28 112.91 114.42 2h4t h THR 156 Ca 0.06 -1.15 -0.09 0.00 0.77 0.00 0.00 66.41 65.99 2h4t h THR 156 Cb 0.84 1.59 -0.02 0.00 -1.74 0.00 0.00 68.15 68.82 2h4t h THR 156 CO 0.07 0.35 -0.16 -0.37 0.37 0.00 0.00 175.52 175.78 2h4t h VAL 157 N 0.17 1.26 -0.48 3.16 -1.51 -1.06 -1.65 116.25 116.14 2h4t h VAL 157 Ca 0.05 -1.19 -0.11 0.00 -1.23 0.00 0.00 66.70 64.22 2h4t h VAL 157 Cb 0.59 1.16 -0.02 0.00 -2.13 0.00 0.00 31.29 30.89 2h4t h VAL 157 CO 0.03 0.39 -0.14 0.28 -1.23 0.00 0.00 177.57 176.90 2h4t h SER 158 N 0.58 0.91 -0.71 4.19 0.02 -1.20 -0.58 113.55 116.76 2h4t h SER 158 Ca 0.09 -0.31 -0.04 0.00 -0.84 0.00 0.00 61.79 60.70 2h4t h SER 158 Cb 0.61 -0.25 -0.03 0.00 0.14 0.00 0.00 62.40 62.87 2h4t h SER 158 CO 0.04 1.05 0.30 0.00 -1.14 0.00 0.00 176.83 177.08 2h4t h ALA 159 N 1.02 0.92 -0.08 3.77 0.00 -0.82 -0.26 119.26 123.82 2h4t h ALA 159 Ca 0.12 -0.17 -0.13 0.00 0.00 0.00 0.00 54.91 54.72 2h4t h ALA 159 Cb 0.68 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 2h4t h ALA 159 CO 0.05 0.53 -0.55 0.28 0.00 0.00 0.00 179.25 179.56 2h4t h VAL 160 N 1.01 1.37 -0.53 0.00 2.07 -1.11 -1.50 116.25 117.56 2h4t h VAL 160 Ca 0.24 -1.85 -0.07 0.00 0.82 0.00 0.00 66.70 65.83 2h4t h VAL 160 Cb 0.19 1.91 -0.02 0.00 -1.52 0.00 0.00 31.29 31.85 2h4t h VAL 160 CO -0.02 0.55 0.03 0.03 0.02 0.00 0.00 177.57 178.18 2h4t h ARG 161 N 0.18 0.88 -0.30 1.57 3.08 -0.63 -0.67 114.38 118.49 2h4t h ARG 161 Ca 0.00 -0.23 -0.02 0.00 0.07 0.00 0.00 59.98 59.79 2h4t h ARG 161 Cb 1.02 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.96 2h4t h ARG 161 CO 0.08 0.86 0.10 0.35 -1.07 0.00 0.00 179.97 180.29 2h4t h PHE 162 N 0.82 0.47 -0.33 3.04 3.57 -0.54 0.73 116.94 124.71 2h4t h PHE 162 Ca 0.16 -0.05 0.05 0.00 3.53 0.00 0.00 57.97 61.67 2h4t h PHE 162 Cb 0.45 -0.14 -0.05 0.00 2.79 0.00 0.00 35.95 39.00 2h4t h PHE 162 CO 0.03 0.49 0.02 1.25 -2.23 0.00 0.00 178.31 177.87 2h4t h LEU 163 N 0.32 -0.08 -0.40 0.59 6.46 -0.85 0.23 115.31 121.59 2h4t h LEU 163 Ca 0.10 0.07 -0.00 0.00 -0.12 0.00 0.00 57.88 57.92 2h4t h LEU 163 Cb 0.23 0.11 -0.02 0.00 -0.73 0.00 0.00 40.66 40.25 2h4t h LEU 163 CO -0.00 -0.01 0.25 0.11 -0.62 0.00 0.00 178.44 178.17 2h4t h LYS 164 N 0.12 0.53 -0.41 1.25 1.79 -0.86 -1.01 116.57 117.99 2h4t h LYS 164 Ca 0.16 -0.04 -0.02 0.00 -2.18 0.00 0.00 60.65 58.57 2h4t h LYS 164 Cb 0.20 -0.11 -0.02 0.00 -1.58 0.00 0.00 32.23 30.72 2h4t h LYS 164 CO -0.24 0.39 0.19 1.15 -1.08 0.00 0.00 179.45 179.85 2h4t h THR 165 N 0.53 1.18 -0.10 -0.16 2.02 -0.24 -1.40 112.91 114.75 2h4t h THR 165 Ca 0.14 -0.53 -0.00 0.00 0.77 0.00 0.00 66.41 66.79 2h4t h THR 165 Cb -0.02 0.77 -0.00 0.00 -1.74 0.00 0.00 68.15 67.16 2h4t h THR 165 CO -0.03 0.20 0.05 0.25 0.37 0.00 0.00 175.52 176.36 2h4t h LEU 166 N 0.52 0.12 -1.60 2.58 6.46 -0.40 -1.60 115.31 121.39 2h4t h LEU 166 Ca 0.14 -0.09 -0.05 0.00 -0.12 0.00 0.00 57.88 57.77 2h4t h LEU 166 Cb 0.14 -0.03 -0.01 0.00 -0.73 0.00 0.00 40.66 40.03 2h4t h LEU 166 CO -0.02 0.17 -0.22 1.56 -0.62 0.00 0.00 178.44 179.32 2h4t h GLN 167 N 0.06 0.00 -0.00 1.25 4.20 -1.08 -2.13 115.11 117.41 2h4t h GLN 167 Ca 0.03 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.74 2h4t h GLN 167 Cb 0.08 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.86 2h4t h GLN 167 CO -0.01 0.22 -0.11 0.00 -0.67 0.00 0.00 178.83 178.26 2h4t n ALA 168 N -2.42 2.74 -1.54 3.87 0.00 -0.54 -4.91 120.51 117.70 2h4t n ALA 168 Ca -0.02 -0.25 -0.08 0.00 0.00 0.00 0.00 53.44 53.10 2h4t n ALA 168 Cb 0.29 -1.35 -0.02 0.00 0.00 0.00 0.00 19.45 18.37 2h4t n ALA 168 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2h4t n GLY 169 N 1.30 0.66 0.90 0.00 0.00 -0.80 -4.91 105.19 102.34 2h4t n GLY 169 Ca 0.14 -0.65 0.12 0.00 0.00 0.00 0.00 46.02 45.62 2h4t n GLY 169 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2h4t n LEU 170 N -0.96 2.86 -4.73 0.99 4.77 -0.64 -2.20 117.00 117.10 2h4t n LEU 170 Ca -0.08 -0.98 -0.41 0.00 -0.03 0.00 0.00 56.01 54.50 2h4t n LEU 170 Cb 0.36 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.41 2h4t n LEU 170 CO 0.11 0.48 0.72 -0.22 -1.33 0.00 0.00 177.39 177.16 2h4t s LEU 171 N -1.96 4.51 0.36 2.23 2.96 -1.18 -0.93 118.68 124.66 2h4t s LEU 171 Ca 0.26 1.94 -0.28 0.00 -0.22 0.00 0.00 54.13 55.83 2h4t s LEU 171 Cb 0.19 -3.60 -0.11 0.00 0.50 0.00 0.00 46.19 43.18 2h4t s LEU 171 CO 0.31 -0.11 1.46 -1.61 -1.32 0.00 0.00 176.35 175.07 2h4t s GLU 172 N -0.29 4.17 0.52 1.98 2.02 -1.26 -3.61 118.70 122.23 2h4t s GLU 172 Ca 0.47 2.49 -0.22 0.00 0.02 0.00 0.00 54.97 57.74 2h4t s GLU 172 Cb -0.26 -3.00 -0.07 0.00 0.10 0.00 0.00 34.13 30.90 2h4t s GLU 172 CO 0.32 -0.46 1.14 -2.30 0.02 0.00 0.00 175.26 173.97 2h4t n PRO 173 N 0.72 1.37 -2.41 0.39 -0.02 -1.26 -4.89 135.00 128.91 2h4t n PRO 173 Ca 0.01 0.51 -0.43 0.00 -2.02 0.00 0.00 63.50 61.57 2h4t n PRO 173 Cb 0.40 -2.30 -0.02 0.00 -0.02 0.00 0.00 33.50 31.56 2h4t n PRO 173 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 2h4t s GLU 174 N -2.57 4.25 -0.04 -0.52 2.56 -1.26 -5.00 118.70 116.13 2h4t s GLU 174 Ca 0.70 1.69 -0.02 0.00 0.00 0.00 0.00 54.97 57.34 2h4t s GLU 174 Cb -0.46 -3.73 0.02 0.00 2.00 0.00 0.00 34.13 31.97 2h4t s GLU 174 CO 0.51 -0.66 0.09 0.08 -0.56 0.00 0.00 175.26 174.72 2h4t s VAL 175 N 3.23 -0.03 -0.26 3.70 1.01 -1.26 -0.88 120.40 125.91 2h4t s VAL 175 Ca 0.56 0.11 -0.14 0.00 0.00 0.00 0.00 61.98 62.50 2h4t s VAL 175 Cb -0.23 -0.15 -0.04 0.00 0.00 0.00 0.00 36.38 35.96 2h4t s VAL 175 CO 0.17 0.04 0.35 0.12 0.00 0.00 0.00 175.10 175.79 2h4t s PHE 176 N 0.65 3.26 -0.20 5.22 5.36 -0.22 -4.91 117.98 127.15 2h4t s PHE 176 Ca -0.05 0.41 -0.07 0.00 -0.96 0.00 0.00 56.93 56.25 2h4t s PHE 176 Cb -0.07 -2.54 -0.04 0.00 -0.34 0.00 0.00 43.02 40.04 2h4t s PHE 176 CO -0.03 -0.18 0.06 -1.01 -1.46 0.00 0.00 175.22 172.60 2h4t s HIS 177 N 1.90 3.17 -0.09 10.12 3.76 -1.26 0.03 115.29 132.91 2h4t s HIS 177 Ca 0.15 -0.13 0.28 0.00 -0.15 0.00 0.00 55.06 55.20 2h4t s HIS 177 Cb -0.16 -2.13 0.89 0.00 1.11 0.00 0.00 32.58 32.29 2h4t s HIS 177 CO 0.09 -0.05 1.81 -0.07 -0.85 0.00 0.00 174.74 175.67 2h4t h LEU 178 N 7.27 0.00 -5.79 0.89 3.38 -1.82 -3.38 115.31 115.85 2h4t h LEU 178 Ca -0.36 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.53 2h4t h LEU 178 Cb 1.17 0.00 -0.18 0.00 0.09 0.00 0.00 40.66 41.74 2h4t h LEU 178 CO 0.64 0.06 -0.46 0.21 0.09 0.00 0.00 178.44 178.99 2h4t s ASN 179 N -5.98 -1.52 0.57 -0.43 2.47 -1.26 -5.03 114.94 103.77 2h4t s ASN 179 Ca 0.03 -0.97 0.27 0.00 0.42 0.00 0.00 52.86 52.61 2h4t s ASN 179 Cb 0.08 1.95 1.54 0.00 -1.45 0.00 0.00 41.25 43.36 2h4t s ASN 179 CO 0.61 -0.14 2.03 1.55 -3.72 0.00 0.00 177.10 177.42 2h4t h PRO 180 N 6.58 0.00 -0.95 0.43 0.13 -1.96 -2.49 132.00 133.75 2h4t h PRO 180 Ca 0.05 0.00 0.20 0.00 -0.87 0.00 0.00 66.00 65.38 2h4t h PRO 180 Cb 1.17 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 32.21 2h4t h PRO 180 CO 0.08 0.00 0.61 0.77 -0.23 0.00 0.00 178.00 179.23 2h4t h SER 181 N 0.00 0.56 0.00 1.44 0.02 -1.96 -0.15 113.55 113.46 2h4t h SER 181 Ca 0.15 0.06 -0.25 0.00 -0.84 0.00 0.00 61.79 60.91 2h4t h SER 181 Cb 0.76 -0.04 -0.05 0.00 0.14 0.00 0.00 62.40 63.21 2h4t h SER 181 CO -0.00 0.21 -1.97 0.29 -1.14 0.00 0.00 176.83 174.22 2h4t n LYS 182 N -4.60 1.61 -0.04 3.45 5.02 -0.95 -4.74 118.16 117.90 2h4t n LYS 182 Ca 0.21 -0.01 -0.15 0.00 -2.02 0.00 0.00 58.31 56.34 2h4t n LYS 182 Cb 0.66 -1.37 -0.14 0.00 -0.02 0.00 0.00 35.03 34.16 2h4t n LYS 182 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 2h4t n SER 183 N -2.51 1.32 -3.66 4.39 3.41 -1.10 -4.51 113.62 110.96 2h4t n SER 183 Ca -0.23 0.18 -0.41 0.00 -0.26 0.00 0.00 58.87 58.15 2h4t n SER 183 Cb 0.95 -0.20 0.01 0.00 -0.26 0.00 0.00 64.21 64.70 2h4t n SER 183 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2h4t n ASP 184 N -3.17 7.23 -4.42 4.04 2.03 -0.08 -4.76 116.55 117.42 2h4t n ASP 184 Ca -0.30 -3.42 -0.21 0.00 0.52 0.00 0.00 54.79 51.39 2h4t n ASP 184 Cb 1.06 -1.28 -0.10 0.00 -0.72 0.00 0.00 41.12 40.08 2h4t n ASP 184 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 2h4t s THR 185 N -2.62 1.77 0.31 5.18 -4.23 -1.26 -4.86 115.64 109.93 2h4t s THR 185 Ca 0.43 -2.17 0.12 0.00 -1.18 0.00 0.00 61.69 58.89 2h4t s THR 185 Cb 0.16 -2.36 0.04 0.00 1.34 0.00 0.00 72.50 71.67 2h4t s THR 185 CO -0.07 -0.36 1.72 0.44 -0.54 0.00 0.00 174.62 175.80 2h4t h ASP 186 N 2.32 0.00 -0.39 3.99 3.32 -1.97 -1.89 116.42 121.80 2h4t h ASP 186 Ca -0.40 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.65 2h4t h ASP 186 Cb 1.23 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.77 2h4t h ASP 186 CO 0.66 0.49 0.24 0.00 -1.72 0.00 0.00 179.24 178.92 2h4t h ALA 187 N 1.51 0.49 -0.20 3.45 0.00 -1.96 0.24 119.26 122.78 2h4t h ALA 187 Ca -0.00 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.81 2h4t h ALA 187 Cb 0.89 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 2h4t h ALA 187 CO 0.06 -0.03 -0.06 0.35 0.00 0.00 0.00 179.25 179.57 2h4t h PHE 188 N 0.52 0.45 -0.97 0.00 3.57 -1.82 -3.05 116.94 115.64 2h4t h PHE 188 Ca 0.14 -0.10 0.07 0.00 3.53 0.00 0.00 57.97 61.60 2h4t h PHE 188 Cb -0.03 -0.11 -0.07 0.00 2.79 0.00 0.00 35.95 38.54 2h4t h PHE 188 CO -0.04 0.66 0.62 0.87 -2.23 0.00 0.00 178.31 178.19 2h4t h LYS 189 N 0.11 1.10 0.00 1.11 1.57 -1.02 0.19 116.57 119.63 2h4t h LYS 189 Ca 0.05 -0.07 -0.03 0.00 -1.87 0.00 0.00 60.65 58.73 2h4t h LYS 189 Cb 0.52 -0.25 -0.00 0.00 0.08 0.00 0.00 32.23 32.58 2h4t h LYS 189 CO 0.02 0.73 -0.15 0.00 -0.57 0.00 0.00 179.45 179.48 2h4t h ARG 190 N 1.13 0.00 0.02 3.15 3.08 -0.50 -2.37 114.38 118.90 2h4t h ARG 190 Ca 0.42 0.00 -0.22 0.00 0.07 0.00 0.00 59.98 60.25 2h4t h ARG 190 Cb 0.17 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.20 2h4t h ARG 190 CO -0.17 0.15 -1.20 -0.07 -1.07 0.00 0.00 179.97 177.60 2h4t h LEU 191 N 0.00 0.08 -1.94 3.04 3.38 -1.08 -3.38 115.31 115.41 2h4t h LEU 191 Ca -0.00 -0.64 -0.00 0.00 0.09 0.00 0.00 57.88 57.33 2h4t h LEU 191 Cb 0.35 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.07 2h4t h LEU 191 CO 0.02 1.48 0.02 -0.29 0.09 0.00 0.00 178.44 179.76 2h4t h ILE 192 N -0.84 1.02 0.00 1.22 6.09 -0.65 -1.92 117.51 122.43 2h4t h ILE 192 Ca -0.31 -0.05 0.00 0.00 -1.37 0.00 0.00 64.86 63.13 2h4t h ILE 192 Cb 1.38 0.96 0.00 0.00 0.47 0.00 0.00 36.82 39.63 2h4t h ILE 192 CO -0.13 0.02 0.00 0.08 -3.07 0.00 0.00 178.15 175.05 2h4t h ARG 193 N 0.06 0.00 0.00 2.19 0.11 -1.60 -1.10 114.38 114.04 2h4t h ARG 193 Ca 0.02 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.10 2h4t h ARG 193 Cb 0.01 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.09 2h4t h ARG 193 CO -0.00 0.00 -0.84 1.19 0.10 0.00 0.00 179.97 180.42 2h4t n PHE 194 N -2.80 0.33 -2.80 4.08 3.01 -0.72 -4.85 117.46 113.71 2h4t n PHE 194 Ca -0.02 0.10 -0.41 0.00 1.01 0.00 0.00 57.45 58.13 2h4t n PHE 194 Cb 0.12 -0.48 -0.03 0.00 -0.01 0.00 0.00 39.48 39.07 2h4t n PHE 194 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 2h4t s VAL 195 N -3.16 4.90 0.57 -4.37 1.01 -0.42 -5.02 120.40 113.91 2h4t s VAL 195 Ca 0.05 1.88 -0.20 0.00 0.00 0.00 0.00 61.98 63.71 2h4t s VAL 195 Cb 0.14 -4.24 -0.04 0.00 0.00 0.00 0.00 36.38 32.24 2h4t s VAL 195 CO 0.77 0.14 1.27 -2.16 0.00 0.00 0.00 175.10 175.12 2h4t s PRO 196 N 1.23 3.04 0.54 2.72 0.04 -1.26 -4.57 135.00 136.73 2h4t s PRO 196 Ca 0.47 2.01 0.37 0.00 0.04 0.00 0.00 61.00 63.88 2h4t s PRO 196 Cb -0.19 -2.08 1.55 0.00 0.04 0.00 0.00 34.50 33.82 2h4t s PRO 196 CO 0.23 -1.20 1.79 -1.35 0.04 0.00 0.00 177.00 176.50 2h4t h PRO 197 N 1.15 0.02 0.00 0.56 0.11 -1.96 0.34 132.00 132.21 2h4t h PRO 197 Ca -0.51 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.60 2h4t h PRO 197 Cb 1.30 -0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.41 2h4t h PRO 197 CO 0.56 0.01 -0.03 0.77 -0.21 0.00 0.00 178.00 179.10 2h4t h SER 198 N 0.02 0.00 0.00 -2.05 0.02 -1.88 -3.04 113.55 106.61 2h4t h SER 198 Ca 0.59 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.54 2h4t h SER 198 Cb 2.34 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.88 2h4t h SER 198 CO -0.02 0.03 0.00 0.18 -1.14 0.00 0.00 176.83 175.88 2h4t n LEU 199 N -4.17 0.41 -0.36 5.07 7.99 0.10 -4.67 117.00 121.38 2h4t n LEU 199 Ca -0.03 -0.58 0.11 0.00 -0.01 0.00 0.00 56.01 55.50 2h4t n LEU 199 Cb 0.12 0.00 0.29 0.00 -0.11 0.00 0.00 43.42 43.72 2h4t n LEU 199 CO 0.31 0.10 1.21 0.77 -1.51 0.00 0.00 177.39 178.28 2h4t h SER 200 N 0.00 0.84 -0.90 -1.43 4.64 -1.17 -2.22 113.55 113.31 2h4t h SER 200 Ca 0.00 0.08 0.09 0.00 -0.47 0.00 0.00 61.79 61.48 2h4t h SER 200 Cb 0.07 -0.08 -0.07 0.00 -0.31 0.00 0.00 62.40 62.01 2h4t h SER 200 CO 0.00 0.36 0.55 -0.25 -0.87 0.00 0.00 176.83 176.62 2h4t h TRP 201 N 0.86 1.01 -0.89 4.77 7.01 -1.82 -1.87 115.95 125.02 2h4t h TRP 201 Ca 0.55 0.03 0.00 0.00 2.11 0.00 0.00 58.89 61.58 2h4t h TRP 201 Cb 0.74 -0.32 -0.04 0.00 -2.10 0.00 0.00 29.16 27.44 2h4t h TRP 201 CO -0.00 0.46 0.57 1.88 -2.79 0.00 0.00 178.44 178.55 2h4t h TYR 202 N 0.95 1.14 -0.72 2.65 -1.99 -1.71 0.13 116.97 117.41 2h4t h TYR 202 Ca 0.42 0.01 -0.03 0.00 2.00 0.00 0.00 58.73 61.13 2h4t h TYR 202 Cb 0.31 -0.38 -0.03 0.00 2.00 0.00 0.00 36.73 38.62 2h4t h TYR 202 CO -0.03 0.73 0.33 0.78 -0.00 0.00 0.00 178.16 179.97 2h4t h GLY 203 N 1.22 1.11 1.07 3.88 0.00 -1.37 0.19 103.07 109.16 2h4t h GLY 203 Ca 0.32 -0.55 -0.17 0.00 0.00 0.00 0.00 47.33 46.93 2h4t h GLY 203 CO -0.07 0.52 -0.52 0.00 0.00 0.00 0.00 176.54 176.47 2h4t h ALA 204 N 1.34 0.38 -0.97 3.60 0.00 -1.06 -3.10 119.26 119.44 2h4t h ALA 204 Ca 0.25 -0.50 0.05 0.00 0.00 0.00 0.00 54.91 54.71 2h4t h ALA 204 Cb 0.13 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 17.80 2h4t h ALA 204 CO -0.03 0.57 0.63 -0.92 0.00 0.00 0.00 179.25 179.50 2h4t h TYR 205 N 0.50 1.17 -0.03 0.00 3.20 -0.19 0.50 116.97 122.13 2h4t h TYR 205 Ca 0.00 0.03 0.01 0.00 3.14 0.00 0.00 58.73 61.91 2h4t h TYR 205 Cb 1.14 -0.39 -0.00 0.00 1.54 0.00 0.00 36.73 39.02 2h4t h TYR 205 CO 0.08 0.63 0.02 -0.07 -1.64 0.00 0.00 178.16 177.18 2h4t h LEU 206 N 1.17 0.00 -3.61 2.82 3.38 -0.90 -1.41 115.31 116.76 2h4t h LEU 206 Ca 0.41 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 58.23 2h4t h LEU 206 Cb 0.10 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 40.77 2h4t h LEU 206 CO -0.15 0.00 0.16 1.33 0.09 0.00 0.00 178.44 179.87 2h4t n VAL 207 N -4.51 2.79 -3.37 1.22 0.24 -0.79 -4.93 118.33 108.98 2h4t n VAL 207 Ca -0.02 -1.74 -0.24 0.00 -2.04 0.00 0.00 64.34 60.30 2h4t n VAL 207 Cb 0.12 -0.33 0.06 0.00 -1.47 0.00 0.00 33.84 32.22 2h4t n VAL 207 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 2h4t n ASN 208 N -0.18 -6.19 -4.46 -1.34 4.13 -0.53 -4.61 115.26 102.09 2h4t n ASN 208 Ca 0.36 -0.44 -0.32 0.00 1.68 0.00 0.00 54.58 55.85 2h4t n ASN 208 Cb 1.26 -4.93 -0.13 0.00 -1.54 0.00 0.00 39.78 34.44 2h4t n ASN 208 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2h4t s ALA 209 N -3.26 2.60 -0.33 5.41 0.00 0.10 -2.49 121.76 123.79 2h4t s ALA 209 Ca 0.47 -1.00 0.03 0.00 0.00 0.00 0.00 51.96 51.46 2h4t s ALA 209 Cb -0.21 -0.91 0.10 0.00 0.00 0.00 0.00 23.12 22.10 2h4t s ALA 209 CO 0.58 0.55 0.06 0.71 0.00 0.00 0.00 175.76 177.67 2h4t s TYR 210 N -0.72 3.19 0.56 0.00 1.51 0.11 -3.07 117.35 118.93 2h4t s TYR 210 Ca 0.11 -2.66 -0.21 0.00 -1.01 0.00 0.00 57.07 53.31 2h4t s TYR 210 Cb -0.11 -2.59 -0.04 0.00 -0.11 0.00 0.00 41.96 39.11 2h4t s TYR 210 CO 0.00 -0.93 1.33 -2.14 -1.11 0.00 0.00 175.55 172.71 2h4t s PRO 211 N 1.09 3.07 0.25 -1.71 0.02 -1.26 -1.05 135.00 135.40 2h4t s PRO 211 Ca 0.11 2.16 0.09 0.00 0.02 0.00 0.00 61.00 63.39 2h4t s PRO 211 Cb -0.19 -2.18 -0.04 0.00 0.02 0.00 0.00 34.50 32.11 2h4t s PRO 211 CO -0.13 -1.23 -0.02 -0.51 -0.33 0.00 0.00 177.00 174.78 2h4t s LEU 212 N -3.66 3.15 0.48 -5.54 1.43 -0.06 -4.63 118.68 109.84 2h4t s LEU 212 Ca 0.73 -0.63 -0.24 0.00 -1.03 0.00 0.00 54.13 52.97 2h4t s LEU 212 Cb -0.39 -1.71 -0.07 0.00 0.03 0.00 0.00 46.19 44.06 2h4t s LEU 212 CO 0.45 0.03 1.30 -0.62 0.23 0.00 0.00 176.35 177.74 2h4t s ASP 213 N -3.48 5.83 -0.02 2.29 2.15 0.68 -4.70 116.67 119.43 2h4t s ASP 213 Ca 0.30 2.64 0.02 0.00 0.43 0.00 0.00 52.55 55.94 2h4t s ASP 213 Cb -0.07 -2.63 0.03 0.00 -0.30 0.00 0.00 42.92 39.96 2h4t s ASP 213 CO 0.19 -1.18 0.91 0.23 -0.17 0.00 0.00 175.17 175.15 2h4t n MET 214 N -0.50 0.28 0.17 4.34 2.81 -1.26 -4.86 117.12 118.09 2h4t n MET 214 Ca 0.07 -1.10 0.12 0.00 -1.81 0.00 0.00 57.70 54.99 2h4t n MET 214 Cb 0.45 -0.64 0.59 0.00 -0.71 0.00 0.00 33.22 32.91 2h4t n MET 214 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 2h4t h SER 215 N 0.00 0.00 0.64 7.83 4.64 -1.99 -2.69 113.55 121.97 2h4t h SER 215 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2h4t h SER 215 Cb 1.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 2h4t h SER 215 CO 0.00 0.00 -1.13 0.00 -0.87 0.00 0.00 176.83 174.83 2h4t n GLN 216 N -2.34 0.47 -0.16 4.77 6.02 -1.26 -4.51 117.38 120.37 2h4t n GLN 216 Ca 0.00 0.03 0.18 0.00 -0.01 0.00 0.00 57.00 57.20 2h4t n GLN 216 Cb 0.14 -1.69 0.55 0.00 1.02 0.00 0.00 30.24 30.26 2h4t n GLN 216 CO 0.00 0.00 0.00 1.88 -1.01 0.00 0.00 177.06 177.93 2h4t h TYR 217 N 0.00 0.38 0.00 1.08 0.99 -1.86 -2.23 116.97 115.33 2h4t h TYR 217 Ca 0.00 0.01 -0.02 0.00 2.00 0.00 0.00 58.73 60.72 2h4t h TYR 217 Cb 0.88 -0.12 -0.00 0.00 1.00 0.00 0.00 36.73 38.49 2h4t h TYR 217 CO 0.00 0.13 -0.12 0.27 -0.00 0.00 0.00 178.16 178.44 2h4t h PHE 218 N 0.31 0.00 0.00 4.88 -5.15 -1.80 -2.32 116.94 112.87 2h4t h PHE 218 Ca 0.38 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 58.15 2h4t h PHE 218 Cb 1.03 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.20 2h4t h PHE 218 CO -0.00 0.12 0.00 0.54 -2.00 0.00 0.00 178.31 176.97 2h4t n ARG 219 N -4.10 0.68 0.08 6.09 1.74 -0.84 -2.88 116.66 117.43 2h4t n ARG 219 Ca -0.02 0.00 -0.00 0.00 -0.77 0.00 0.00 57.85 57.05 2h4t n ARG 219 Cb 0.20 -1.34 0.29 0.00 -1.02 0.00 0.00 32.46 30.60 2h4t n ARG 219 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 2h4t h LEU 220 N 0.00 0.31 -9.02 0.55 3.38 -1.60 -3.41 115.31 105.51 2h4t h LEU 220 Ca 0.00 -0.09 -0.64 0.00 0.09 0.00 0.00 57.88 57.24 2h4t h LEU 220 Cb 0.00 -0.08 -0.18 0.00 0.09 0.00 0.00 40.66 40.48 2h4t h LEU 220 CO 0.00 0.54 -0.82 -0.36 0.09 0.00 0.00 178.44 177.89 2h4t s PHE 221 N -4.54 2.25 -1.11 1.13 0.40 -1.14 -4.65 117.98 110.33 2h4t s PHE 221 Ca -0.06 -0.37 -0.04 0.00 -0.60 0.00 0.00 56.93 55.87 2h4t s PHE 221 Cb 0.14 -1.11 0.03 0.00 0.51 0.00 0.00 43.02 42.59 2h4t s PHE 221 CO 0.76 0.49 0.21 0.09 0.70 0.00 0.00 175.22 177.47 2h4t n ASN 222 N 0.26 -3.78 -4.26 1.36 3.02 -0.20 -4.75 115.26 106.92 2h4t n ASN 222 Ca -0.12 -0.03 -0.20 0.00 -0.03 0.00 0.00 54.58 54.20 2h4t n ASN 222 Cb 0.56 -3.18 -0.11 0.00 -0.61 0.00 0.00 39.78 36.44 2h4t n ASN 222 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 2h4t s SER 223 N -2.32 2.18 0.23 6.41 0.01 -1.26 -1.21 113.70 117.74 2h4t s SER 223 Ca 0.16 -0.78 -0.22 0.00 1.31 0.00 0.00 55.95 56.43 2h4t s SER 223 Cb -0.09 -0.09 0.04 0.00 0.21 0.00 0.00 66.02 66.09 2h4t s SER 223 CO 0.20 -0.08 0.72 0.28 0.41 0.00 0.00 173.24 174.77 2h4t s THR 224 N -1.86 0.00 -0.22 1.44 -1.32 -0.32 -1.83 115.64 111.53 2h4t s THR 224 Ca 0.08 -0.72 -0.08 0.00 -1.21 0.00 0.00 61.69 59.76 2h4t s THR 224 Cb -0.06 -1.75 -0.04 0.00 -1.51 0.00 0.00 72.50 69.14 2h4t s THR 224 CO 0.04 0.00 0.09 -0.60 -2.21 0.00 0.00 174.62 171.94 2h4t s ARG 225 N -3.80 3.87 -0.22 7.08 3.52 -0.38 -0.71 118.95 128.31 2h4t s ARG 225 Ca 0.09 -0.38 -0.12 0.00 -0.13 0.00 0.00 55.73 55.18 2h4t s ARG 225 Cb -0.04 -3.33 -0.05 0.00 -1.56 0.00 0.00 34.95 29.97 2h4t s ARG 225 CO 0.02 0.04 0.23 0.42 -0.81 0.00 0.00 175.30 175.20 2h4t s ILE 226 N 1.02 5.32 0.10 4.11 -1.09 0.69 -4.83 121.20 126.52 2h4t s ILE 226 Ca 0.05 0.34 -0.31 0.00 -2.23 0.00 0.00 60.65 58.50 2h4t s ILE 226 Cb -0.14 -3.56 -0.07 0.00 -1.58 0.00 0.00 42.46 37.11 2h4t s ILE 226 CO 0.03 0.33 1.27 -2.16 -1.23 0.00 0.00 174.94 173.18 2h4t s PRO 227 N 1.02 4.40 0.02 2.79 0.05 -1.26 -1.77 135.00 140.25 2h4t s PRO 227 Ca 0.11 1.90 -0.01 0.00 0.05 0.00 0.00 61.00 63.06 2h4t s PRO 227 Cb -0.14 -3.29 -0.02 0.00 0.05 0.00 0.00 34.50 31.10 2h4t s PRO 227 CO 0.05 -0.29 -0.02 1.03 0.05 0.00 0.00 177.00 177.82 2h4t s ARG 228 N 0.82 0.36 0.00 4.56 1.81 -1.26 -4.58 118.95 120.66 2h4t s ARG 228 Ca 0.60 -0.67 0.00 0.00 -1.72 0.00 0.00 55.73 53.94 2h4t s ARG 228 Cb -0.33 0.13 0.00 0.00 -0.45 0.00 0.00 34.95 34.30 2h4t s ARG 228 CO 0.31 -0.06 0.00 -2.30 -0.68 0.00 0.00 175.30 172.57 2h4t n PRO 229 N 1.42 0.00 0.02 3.54 -0.02 -1.26 -3.35 135.00 135.35 2h4t n PRO 229 Ca -0.23 0.00 0.11 0.00 -2.02 0.00 0.00 63.50 61.36 2h4t n PRO 229 Cb 0.56 -0.04 -0.01 0.00 -0.02 0.00 0.00 33.50 33.99 2h4t n PRO 229 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2h4t n ASN 230 N 0.00 0.60 -3.71 2.55 4.13 -1.26 -4.50 115.26 113.06 2h4t n ASN 230 Ca 0.00 -0.24 -0.12 0.00 1.68 0.00 0.00 54.58 55.90 2h4t n ASN 230 Cb 0.00 0.90 -0.13 0.00 -1.54 0.00 0.00 39.78 39.02 2h4t n ASN 230 CO 0.00 0.00 0.00 -0.60 0.28 0.00 0.00 177.26 176.94 2h4t s ARG 231 N -3.21 0.23 0.78 3.52 3.52 -1.21 -4.59 118.95 117.98 2h4t s ARG 231 Ca 0.03 0.61 -0.12 0.00 -0.13 0.00 0.00 55.73 56.12 2h4t s ARG 231 Cb 0.14 -0.09 0.06 0.00 -1.56 0.00 0.00 34.95 33.50 2h4t s ARG 231 CO 0.82 -0.18 1.11 -0.51 -0.81 0.00 0.00 175.30 175.73 2h4t s ASP 232 N 1.42 4.74 0.06 -2.12 1.11 0.15 -4.27 116.67 117.76 2h4t s ASP 232 Ca -0.08 1.12 0.05 0.00 0.18 0.00 0.00 52.55 53.82 2h4t s ASP 232 Cb -0.10 -1.82 -0.03 0.00 1.07 0.00 0.00 42.92 42.04 2h4t s ASP 232 CO -0.09 -1.79 -0.15 -1.83 1.18 0.00 0.00 175.17 172.49 2h4t s GLU 233 N -5.31 0.92 -0.05 8.23 -1.05 -0.73 -4.85 118.70 115.86 2h4t s GLU 233 Ca 0.60 -0.88 -0.17 0.00 -0.15 0.00 0.00 54.97 54.37 2h4t s GLU 233 Cb -0.13 -0.96 -0.05 0.00 -0.44 0.00 0.00 34.13 32.56 2h4t s GLU 233 CO 0.52 0.23 0.48 -0.51 0.95 0.00 0.00 175.26 176.93 2h4t s LEU 234 N -1.44 4.38 -0.03 1.83 1.43 -1.26 -0.22 118.68 123.36 2h4t s LEU 234 Ca 0.01 0.95 0.07 0.00 -1.03 0.00 0.00 54.13 54.12 2h4t s LEU 234 Cb -0.09 -2.71 -0.01 0.00 0.03 0.00 0.00 46.19 43.41 2h4t s LEU 234 CO 0.02 0.15 -0.23 0.12 0.23 0.00 0.00 176.35 176.64 2h4t s PHE 235 N -0.21 2.15 -0.01 0.29 5.36 0.12 -4.94 117.98 120.73 2h4t s PHE 235 Ca 0.26 -0.50 0.00 0.00 -0.96 0.00 0.00 56.93 55.73 2h4t s PHE 235 Cb -0.16 -1.40 0.01 0.00 -0.34 0.00 0.00 43.02 41.13 2h4t s PHE 235 CO 0.13 -0.10 0.01 0.99 -1.46 0.00 0.00 175.22 174.78 2h4t s THR 236 N -0.37 0.04 -0.46 0.12 2.01 -1.26 -1.17 115.64 114.54 2h4t s THR 236 Ca 0.04 0.07 0.02 0.00 0.31 0.00 0.00 61.69 62.14 2h4t s THR 236 Cb -0.11 -0.10 0.14 0.00 0.01 0.00 0.00 72.50 72.44 2h4t s THR 236 CO 0.01 0.06 0.27 -0.62 -0.69 0.00 0.00 174.62 173.65 2h4t s ASP 237 N 0.53 3.57 0.67 3.53 2.15 -0.35 -4.98 116.67 121.79 2h4t s ASP 237 Ca -0.05 -2.77 0.40 0.00 0.43 0.00 0.00 52.55 50.56 2h4t s ASP 237 Cb -0.07 -1.04 2.16 0.00 -0.30 0.00 0.00 42.92 43.67 2h4t s ASP 237 CO -0.01 -0.24 2.22 0.00 -0.17 0.00 0.00 175.17 176.96 2h4t h THR 238 N 5.13 0.01 0.00 1.71 1.03 -1.90 -2.56 112.91 116.32 2h4t h THR 238 Ca 0.03 0.00 0.00 0.00 -0.01 0.00 0.00 66.41 66.43 2h4t h THR 238 Cb 0.91 0.88 0.00 0.00 -1.07 0.00 0.00 68.15 68.87 2h4t h THR 238 CO 0.49 0.00 -0.30 0.29 -0.01 0.00 0.00 175.52 176.00 2h4t n LYS 239 N -3.02 0.18 -2.23 0.00 5.02 -1.26 -4.89 118.16 111.97 2h4t n LYS 239 Ca -0.03 0.10 -0.39 0.00 -2.02 0.00 0.00 58.31 55.97 2h4t n LYS 239 Cb 0.18 -1.66 -0.02 0.00 -0.02 0.00 0.00 35.03 33.52 2h4t n LYS 239 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2h4t s ALA 240 N -3.09 3.18 0.00 7.82 0.00 -0.97 -4.95 121.76 123.75 2h4t s ALA 240 Ca 0.10 1.04 0.00 0.00 0.00 0.00 0.00 51.96 53.10 2h4t s ALA 240 Cb 0.15 -3.41 0.00 0.00 0.00 0.00 0.00 23.12 19.86 2h4t s ALA 240 CO 0.64 -0.62 0.73 0.54 0.00 0.00 0.00 175.76 177.06 2h4t n ARG 241 N 0.08 0.95 -3.99 0.00 1.74 -1.26 -4.79 116.66 109.38 2h4t n ARG 241 Ca 0.04 -0.97 -0.24 0.00 -0.77 0.00 0.00 57.85 55.91 2h4t n ARG 241 Cb 0.46 -0.99 -0.03 0.00 -1.02 0.00 0.00 32.46 30.88 2h4t n ARG 241 CO 0.00 0.00 0.00 -3.38 -1.52 0.00 0.00 177.63 172.73 2h4t s HIS 242 N -0.48 3.38 0.01 -1.55 -3.43 -1.26 -1.65 115.29 110.32 2h4t s HIS 242 Ca 0.00 0.03 -0.01 0.00 -0.80 0.00 0.00 55.06 54.28 2h4t s HIS 242 Cb 0.00 -1.58 -0.04 0.00 -1.43 0.00 0.00 32.58 29.53 2h4t s HIS 242 CO 0.00 0.49 0.11 -1.17 -2.00 0.00 0.00 174.74 172.18 2h4t s LEU 243 N -3.51 4.03 -0.17 5.38 2.96 0.09 -0.65 118.68 126.80 2h4t s LEU 243 Ca 0.34 0.18 -0.04 0.00 -0.22 0.00 0.00 54.13 54.39 2h4t s LEU 243 Cb -0.10 -2.42 -0.03 0.00 0.50 0.00 0.00 46.19 44.14 2h4t s LEU 243 CO 0.27 0.25 -0.02 -0.22 -1.32 0.00 0.00 176.35 175.32 2h4t s LEU 244 N -1.91 3.29 -0.07 -0.68 2.96 -1.11 -2.54 118.68 118.62 2h4t s LEU 244 Ca 0.25 -0.14 0.05 0.00 -0.22 0.00 0.00 54.13 54.07 2h4t s LEU 244 Cb -0.12 -1.81 -0.01 0.00 0.50 0.00 0.00 46.19 44.75 2h4t s LEU 244 CO 0.17 0.13 -0.24 -0.69 -1.32 0.00 0.00 176.35 174.40 2h4t s VAL 245 N 0.60 1.96 -0.13 1.68 1.01 0.12 -0.76 120.40 124.88 2h4t s VAL 245 Ca -0.01 -1.00 -0.00 0.00 0.00 0.00 0.00 61.98 60.96 2h4t s VAL 245 Cb -0.14 -1.67 -0.02 0.00 0.00 0.00 0.00 36.38 34.55 2h4t s VAL 245 CO 0.02 0.54 -0.13 -0.76 0.00 0.00 0.00 175.10 174.78 2h4t s LEU 246 N 0.02 2.74 -0.12 3.92 1.02 0.28 -1.06 118.68 125.48 2h4t s LEU 246 Ca -0.08 -0.32 -0.05 0.00 0.02 0.00 0.00 54.13 53.70 2h4t s LEU 246 Cb -0.15 -1.62 0.06 0.00 0.02 0.00 0.00 46.19 44.50 2h4t s LEU 246 CO 0.05 0.16 0.26 -0.60 0.02 0.00 0.00 176.35 176.25 2h4t s ARG 247 N 0.37 0.18 -1.33 1.70 3.52 -1.00 -0.45 118.95 121.93 2h4t s ARG 247 Ca -0.10 0.67 -0.02 0.00 -0.13 0.00 0.00 55.73 56.14 2h4t s ARG 247 Cb -0.16 -0.06 0.01 0.00 -1.56 0.00 0.00 34.95 33.18 2h4t s ARG 247 CO 0.05 -0.23 0.15 1.63 -0.81 0.00 0.00 175.30 176.10 2h4t n LYS 248 N 4.87 -2.63 -0.64 5.12 5.02 -1.26 -0.89 118.16 127.74 2h4t n LYS 248 Ca -0.14 0.72 0.00 0.00 -2.02 0.00 0.00 58.31 56.87 2h4t n LYS 248 Cb 0.51 -5.39 0.00 0.00 -0.02 0.00 0.00 35.03 30.13 2h4t n LYS 248 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2h4t n GLY 249 N -1.01 1.34 3.86 0.72 0.00 -1.25 -4.04 105.19 104.82 2h4t n GLY 249 Ca -0.15 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.54 2h4t n GLY 249 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2h4t s HIS 250 N -3.50 3.51 -0.19 1.61 3.76 -0.07 -4.69 115.29 115.72 2h4t s HIS 250 Ca 0.00 0.95 -0.05 0.00 -0.15 0.00 0.00 55.06 55.81 2h4t s HIS 250 Cb 0.00 -2.30 -0.03 0.00 1.11 0.00 0.00 32.58 31.36 2h4t s HIS 250 CO 0.00 0.35 -0.00 -0.06 -0.85 0.00 0.00 174.74 174.18 2h4t s PHE 251 N -1.65 3.05 0.07 1.40 0.40 -1.26 -2.37 117.98 117.63 2h4t s PHE 251 Ca 0.43 -0.38 0.06 0.00 -0.60 0.00 0.00 56.93 56.44 2h4t s PHE 251 Cb -0.13 -2.06 -0.03 0.00 0.51 0.00 0.00 43.02 41.31 2h4t s PHE 251 CO 0.20 -0.16 -0.16 0.71 0.70 0.00 0.00 175.22 176.51 2h4t s TYR 252 N 0.81 1.38 0.01 0.36 1.51 -0.22 0.03 117.35 121.23 2h4t s TYR 252 Ca 0.00 -0.43 0.00 0.00 -1.01 0.00 0.00 57.07 55.63 2h4t s TYR 252 Cb -0.14 -0.78 -0.01 0.00 -0.11 0.00 0.00 41.96 40.92 2h4t s TYR 252 CO 0.02 0.09 -0.01 0.14 -1.11 0.00 0.00 175.55 174.68 2h4t s VAL 253 N -1.17 0.08 0.02 0.71 -7.23 -0.59 0.14 120.40 112.36 2h4t s VAL 253 Ca 0.01 -0.28 -0.26 0.00 -1.81 0.00 0.00 61.98 59.64 2h4t s VAL 253 Cb -0.10 -0.12 0.06 0.00 0.56 0.00 0.00 36.38 36.79 2h4t s VAL 253 CO 0.03 -0.12 0.59 0.72 -0.31 0.00 0.00 175.10 176.00 2h4t s PHE 254 N -0.41 -0.53 0.29 2.82 -0.12 -1.05 -1.46 117.98 117.51 2h4t s PHE 254 Ca -0.04 0.73 -0.29 0.00 -0.05 0.00 0.00 56.93 57.28 2h4t s PHE 254 Cb -0.03 0.39 -0.10 0.00 -0.63 0.00 0.00 43.02 42.66 2h4t s PHE 254 CO -0.00 -0.65 1.26 -0.51 -0.05 0.00 0.00 175.22 175.27 2h4t s ASP 255 N -1.71 6.91 -0.00 1.98 -0.00 -1.26 -0.73 116.67 121.85 2h4t s ASP 255 Ca -0.07 2.53 0.03 0.00 -0.00 0.00 0.00 52.55 55.04 2h4t s ASP 255 Cb -0.01 -2.64 -0.04 0.00 -0.00 0.00 0.00 42.92 40.24 2h4t s ASP 255 CO 0.02 -0.44 0.12 1.33 -0.00 0.00 0.00 175.17 176.19 2h4t n VAL 256 N 1.28 0.00 -4.54 -1.27 0.24 -0.66 -4.84 118.33 108.54 2h4t n VAL 256 Ca 0.01 -0.31 -0.23 0.00 -2.04 0.00 0.00 64.34 61.77 2h4t n VAL 256 Cb 0.43 0.81 -0.16 0.00 -1.47 0.00 0.00 33.84 33.45 2h4t n VAL 256 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2h4t s LEU 257 N -2.50 1.71 0.75 1.34 1.43 -1.13 -0.04 118.68 120.24 2h4t s LEU 257 Ca 0.00 -0.26 -0.05 0.00 -1.03 0.00 0.00 54.13 52.80 2h4t s LEU 257 Cb 0.02 -0.74 0.12 0.00 0.03 0.00 0.00 46.19 45.63 2h4t s LEU 257 CO 0.13 0.06 1.04 1.51 0.23 0.00 0.00 176.35 179.33 2h4t s ASP 258 N 0.42 4.26 0.33 2.29 1.47 0.22 -4.82 116.67 120.84 2h4t s ASP 258 Ca -0.09 -0.07 0.24 0.00 1.18 0.00 0.00 52.55 53.81 2h4t s ASP 258 Cb -0.13 -0.33 1.19 0.00 -0.34 0.00 0.00 42.92 43.31 2h4t s ASP 258 CO 0.02 -1.93 1.73 1.56 0.68 0.00 0.00 175.17 177.23 2h4t h GLN 259 N -0.71 0.00 -0.00 2.11 4.20 -2.00 -0.68 115.11 118.02 2h4t h GLN 259 Ca -0.40 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.31 2h4t h GLN 259 Cb 1.27 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.05 2h4t h GLN 259 CO 0.44 0.00 -0.30 -0.25 -0.67 0.00 0.00 178.83 178.05 2h4t n ASP 260 N -2.33 0.53 0.00 1.46 8.00 -1.26 -4.93 116.55 118.02 2h4t n ASP 260 Ca -0.00 -0.33 0.00 0.00 0.71 0.00 0.00 54.79 55.17 2h4t n ASP 260 Cb 0.11 0.05 0.00 0.00 -0.02 0.00 0.00 41.12 41.26 2h4t n ASP 260 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2h4t n GLY 261 N 1.42 0.65 3.90 0.44 0.00 -0.26 -5.07 105.19 106.27 2h4t n GLY 261 Ca 0.09 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.82 2h4t n GLY 261 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2h4t s ASN 262 N -2.92 6.44 0.23 1.61 0.01 -1.26 -4.80 114.94 114.26 2h4t s ASN 262 Ca 0.00 0.86 -0.30 0.00 -0.71 0.00 0.00 52.86 52.72 2h4t s ASN 262 Cb 0.00 -2.21 -0.09 0.00 0.41 0.00 0.00 41.25 39.36 2h4t s ASN 262 CO 0.00 -0.31 1.18 -0.63 -1.51 0.00 0.00 177.10 175.83 2h4t s ILE 263 N -2.26 3.43 0.46 0.60 1.01 -1.26 -0.61 121.20 122.57 2h4t s ILE 263 Ca 0.47 1.30 -0.25 0.00 0.00 0.00 0.00 60.65 62.17 2h4t s ILE 263 Cb -0.10 -3.83 -0.08 0.00 0.01 0.00 0.00 42.46 38.46 2h4t s ILE 263 CO 0.32 0.25 1.37 -0.69 0.00 0.00 0.00 174.94 176.19 2h4t s VAL 264 N -0.52 2.26 -0.38 2.92 1.01 0.95 -4.83 120.40 121.81 2h4t s VAL 264 Ca 0.50 0.22 -0.43 0.00 0.00 0.00 0.00 61.98 62.27 2h4t s VAL 264 Cb -0.33 -3.13 -0.17 0.00 0.00 0.00 0.00 36.38 32.75 2h4t s VAL 264 CO 0.40 0.02 1.71 -3.20 0.00 0.00 0.00 175.10 174.03 2h4t n ASN 265 N -0.32 1.87 -0.23 3.32 4.05 -1.26 -4.76 115.26 117.94 2h4t n ASN 265 Ca 0.06 1.09 0.28 0.00 0.45 0.00 0.00 54.58 56.46 2h4t n ASN 265 Cb 0.43 -1.03 0.68 0.00 1.23 0.00 0.00 39.78 41.09 2h4t n ASN 265 CO 0.00 0.00 0.00 -0.65 -3.05 0.00 0.00 177.26 173.56 2h4t h PRO 266 N 6.52 0.10 0.00 1.20 0.11 -1.94 0.45 132.00 138.43 2h4t h PRO 266 Ca -0.44 -0.01 -0.06 0.00 0.11 0.00 0.00 66.00 65.60 2h4t h PRO 266 Cb 1.34 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.42 2h4t h PRO 266 CO 0.98 0.06 -0.30 -0.07 -0.21 0.00 0.00 178.00 178.46 2h4t h LEU 267 N 0.10 0.00 0.19 2.35 3.38 -1.92 -0.20 115.31 119.21 2h4t h LEU 267 Ca 0.47 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 58.12 2h4t h LEU 267 Cb 1.71 0.00 0.02 0.00 0.09 0.00 0.00 40.66 42.47 2h4t h LEU 267 CO -0.06 0.30 -1.53 -0.08 0.09 0.00 0.00 178.44 177.16 2h4t h GLU 268 N 0.00 0.41 -0.66 1.13 4.81 -0.50 -1.12 114.58 118.65 2h4t h GLU 268 Ca -0.00 -0.69 -0.02 0.00 -0.13 0.00 0.00 59.36 58.51 2h4t h GLU 268 Cb 0.99 0.26 -0.03 0.00 0.63 0.00 0.00 28.75 30.60 2h4t h GLU 268 CO 0.04 1.31 0.32 0.82 -0.73 0.00 0.00 179.01 180.77 2h4t h ILE 269 N 0.11 1.22 -0.60 2.32 2.04 -1.00 0.15 117.51 121.75 2h4t h ILE 269 Ca -0.26 -0.63 0.01 0.00 1.00 0.00 0.00 64.86 64.98 2h4t h ILE 269 Cb 2.09 0.42 -0.03 0.00 -0.74 0.00 0.00 36.82 38.56 2h4t h ILE 269 CO 0.22 0.26 0.39 -0.61 0.00 0.00 0.00 178.15 178.41 2h4t h GLN 270 N 0.92 0.77 -0.30 2.37 4.15 -1.06 -1.19 115.11 120.77 2h4t h GLN 270 Ca 0.23 -0.05 -0.00 0.00 0.77 0.00 0.00 58.65 59.60 2h4t h GLN 270 Cb 0.12 -0.17 -0.01 0.00 0.21 0.00 0.00 27.48 27.62 2h4t h GLN 270 CO -0.03 0.51 0.19 0.00 -1.93 0.00 0.00 178.83 177.57 2h4t h ALA 271 N 1.23 0.38 -0.51 3.38 0.00 -0.75 -0.28 119.26 122.71 2h4t h ALA 271 Ca 0.22 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 55.03 2h4t h ALA 271 Cb -0.07 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 2h4t h ALA 271 CO -0.06 -0.13 0.07 0.45 0.00 0.00 0.00 179.25 179.58 2h4t h HIS 272 N 0.39 0.84 -0.23 0.00 3.86 -0.66 0.08 115.15 119.44 2h4t h HIS 272 Ca 0.11 -0.10 -0.17 0.00 -1.16 0.00 0.00 60.37 59.06 2h4t h HIS 272 Cb -0.01 -0.24 -0.00 0.00 1.06 0.00 0.00 27.41 28.22 2h4t h HIS 272 CO -0.05 0.74 -0.54 -0.07 0.86 0.00 0.00 177.93 178.88 2h4t h LEU 273 N 0.77 0.75 -0.62 2.43 3.38 -1.02 -1.62 115.31 119.38 2h4t h LEU 273 Ca 0.16 -0.40 -0.04 0.00 0.09 0.00 0.00 57.88 57.70 2h4t h LEU 273 Cb 0.37 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.88 2h4t h LEU 273 CO 0.01 1.14 0.24 0.50 0.09 0.00 0.00 178.44 180.42 2h4t h LYS 274 N 0.52 0.93 -0.23 1.13 3.64 -0.70 0.84 116.57 122.70 2h4t h LYS 274 Ca 0.01 -0.18 0.02 0.00 -1.27 0.00 0.00 60.65 59.24 2h4t h LYS 274 Cb 1.10 -0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 32.75 2h4t h LYS 274 CO 0.11 0.80 0.09 -0.92 -2.27 0.00 0.00 179.45 177.25 2h4t h TYR 275 N 0.87 0.16 -0.64 1.91 3.20 -0.77 -0.73 116.97 120.96 2h4t h TYR 275 Ca 0.21 0.01 -0.06 0.00 3.14 0.00 0.00 58.73 62.02 2h4t h TYR 275 Cb 0.22 -0.04 -0.03 0.00 1.54 0.00 0.00 36.73 38.42 2h4t h TYR 275 CO 0.01 0.08 0.15 0.82 -1.64 0.00 0.00 178.16 177.59 2h4t h ILE 276 N 0.20 1.25 0.00 1.81 2.04 -0.99 -2.26 117.51 119.57 2h4t h ILE 276 Ca 0.10 -0.93 -0.02 0.00 1.00 0.00 0.00 64.86 65.01 2h4t h ILE 276 Cb 0.06 0.59 -0.00 0.00 -0.74 0.00 0.00 36.82 36.73 2h4t h ILE 276 CO -0.09 0.35 -0.08 -0.07 0.00 0.00 0.00 178.15 178.26 2h4t h LEU 277 N 0.97 0.00 -0.24 1.44 3.38 -0.30 -2.47 115.31 118.09 2h4t h LEU 277 Ca 0.20 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.17 2h4t h LEU 277 Cb 0.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.10 2h4t h LEU 277 CO 0.00 0.08 -0.30 -1.54 0.09 0.00 0.00 178.44 176.76 2h4t n SER 278 N -3.29 0.68 -4.71 -0.43 3.41 -0.33 -4.89 113.62 104.05 2h4t n SER 278 Ca -0.01 -0.51 -0.42 0.00 -0.26 0.00 0.00 58.87 57.67 2h4t n SER 278 Cb 0.28 0.10 -0.03 0.00 -0.26 0.00 0.00 64.21 64.30 2h4t n SER 278 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2h4t s ASP 279 N -2.71 6.41 0.00 4.04 -1.08 -0.93 -4.88 116.67 117.52 2h4t s ASP 279 Ca 0.20 2.80 0.24 0.00 -0.52 0.00 0.00 52.55 55.26 2h4t s ASP 279 Cb 0.19 -2.58 0.25 0.00 -1.46 0.00 0.00 42.92 39.31 2h4t s ASP 279 CO 0.58 -0.98 1.27 -1.54 0.52 0.00 0.00 175.17 175.02 2h4t n SER 280 N 4.76 2.28 -4.67 -0.34 3.41 -1.26 -4.98 113.62 112.82 2h4t n SER 280 Ca 0.17 -1.65 -0.45 0.00 -0.26 0.00 0.00 58.87 56.68 2h4t n SER 280 Cb 0.37 0.21 -0.03 0.00 -0.26 0.00 0.00 64.21 64.49 2h4t n SER 280 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2h4t n SER 281 N 0.49 2.90 -4.80 4.04 7.64 -1.26 -4.97 113.62 117.66 2h4t n SER 281 Ca 0.12 1.13 -0.30 0.00 1.01 0.00 0.00 58.87 60.83 2h4t n SER 281 Cb 0.50 -1.44 0.09 0.00 -1.01 0.00 0.00 64.21 62.35 2h4t n SER 281 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 2h4t s PRO 282 N -0.09 2.12 0.31 1.43 0.04 -1.26 -4.97 135.00 132.58 2h4t s PRO 282 Ca 0.70 0.66 -0.29 0.00 0.04 0.00 0.00 61.00 62.12 2h4t s PRO 282 Cb -0.65 -1.92 -0.13 0.00 0.04 0.00 0.00 34.50 31.85 2h4t s PRO 282 CO 0.47 -1.60 1.33 1.55 0.04 0.00 0.00 177.00 178.78 2h4t n VAL 283 N -3.42 1.67 -1.79 -0.36 3.14 -1.26 -4.92 118.33 111.39 2h4t n VAL 283 Ca 0.07 -0.42 -0.35 0.00 -2.96 0.00 0.00 64.34 60.69 2h4t n VAL 283 Cb 0.56 -1.54 0.05 0.00 -1.06 0.00 0.00 33.84 31.85 2h4t n VAL 283 CO 0.00 0.00 0.00 -2.16 -6.46 0.00 0.00 176.83 168.21 2h4t s PRO 284 N -1.41 2.70 0.52 1.45 0.04 -1.26 -4.88 135.00 132.15 2h4t s PRO 284 Ca 0.59 1.69 0.25 0.00 0.04 0.00 0.00 61.00 63.57 2h4t s PRO 284 Cb -0.59 -1.91 1.41 0.00 0.04 0.00 0.00 34.50 33.44 2h4t s PRO 284 CO 0.58 -1.39 2.07 0.93 0.04 0.00 0.00 177.00 179.24 2h4t h GLU 285 N 0.34 0.00 -2.63 4.56 5.08 -1.99 -3.32 114.58 116.62 2h4t h GLU 285 Ca -0.49 0.00 -0.60 0.00 -1.00 0.00 0.00 59.36 57.27 2h4t h GLU 285 Cb 1.28 0.00 -0.39 0.00 0.50 0.00 0.00 28.75 30.14 2h4t h GLU 285 CO 0.53 0.12 -0.84 -0.06 -1.00 0.00 0.00 179.01 177.77 2h4t s PHE 286 N -4.30 1.87 -0.12 4.33 0.40 -1.26 -5.05 117.98 113.84 2h4t s PHE 286 Ca -0.03 -2.61 -0.29 0.00 -0.60 0.00 0.00 56.93 53.40 2h4t s PHE 286 Cb 0.14 -1.51 -0.06 0.00 0.51 0.00 0.00 43.02 42.10 2h4t s PHE 286 CO 0.60 -0.74 1.94 -2.14 0.70 0.00 0.00 175.22 175.58 2h4t s PRO 287 N -0.33 3.71 0.44 0.24 0.02 -1.25 -4.88 135.00 132.95 2h4t s PRO 287 Ca 0.29 2.13 0.13 0.00 0.02 0.00 0.00 61.00 63.56 2h4t s PRO 287 Cb -0.02 -4.19 0.96 0.00 0.02 0.00 0.00 34.50 31.27 2h4t s PRO 287 CO -0.17 -1.43 1.99 0.28 -0.33 0.00 0.00 177.00 177.35 2h4t h VAL 288 N 6.28 1.13 -0.66 3.83 2.07 -1.90 -2.81 116.25 124.18 2h4t h VAL 288 Ca -0.42 -0.56 0.19 0.00 0.82 0.00 0.00 66.70 66.73 2h4t h VAL 288 Cb 1.21 1.20 -0.03 0.00 -1.52 0.00 0.00 31.29 32.15 2h4t h VAL 288 CO 0.97 0.17 0.55 0.00 0.02 0.00 0.00 177.57 179.28 2h4t h ALA 289 N 1.78 2.52 -0.72 1.67 0.00 -1.83 -0.80 119.26 121.89 2h4t h ALA 289 Ca 0.02 -0.02 0.15 0.00 0.00 0.00 0.00 54.91 55.06 2h4t h ALA 289 Cb 0.27 0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.06 2h4t h ALA 289 CO 0.02 -0.89 0.48 1.88 0.00 0.00 0.00 179.25 180.74 2h4t h TYR 290 N 0.00 0.42 -0.25 0.00 -1.99 -1.37 -2.36 116.97 111.42 2h4t h TYR 290 Ca 0.31 0.01 0.02 0.00 2.00 0.00 0.00 58.73 61.08 2h4t h TYR 290 Cb 1.41 -0.13 -0.01 0.00 2.00 0.00 0.00 36.73 39.99 2h4t h TYR 290 CO 0.00 0.17 0.17 -0.07 -0.00 0.00 0.00 178.16 178.42 2h4t h LEU 291 N 0.37 0.22 0.00 3.88 3.38 -1.38 -1.92 115.31 119.85 2h4t h LEU 291 Ca 0.35 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.32 2h4t h LEU 291 Cb 0.85 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.54 2h4t h LEU 291 CO -0.10 0.15 0.00 0.35 0.09 0.00 0.00 178.44 178.93 2h4t n THR 292 N -4.50 0.77 1.06 0.22 -2.24 -0.89 -1.97 114.28 106.73 2h4t n THR 292 Ca 0.01 0.19 0.12 0.00 -2.27 0.00 0.00 64.05 62.10 2h4t n THR 292 Cb 0.14 -0.97 0.11 0.00 -2.10 0.00 0.00 70.33 67.51 2h4t n THR 292 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2h4t n SER 293 N -1.35 2.30 -4.83 3.42 3.41 -0.72 -4.66 113.62 111.18 2h4t n SER 293 Ca 0.05 -1.66 -0.29 0.00 -0.26 0.00 0.00 58.87 56.71 2h4t n SER 293 Cb 0.12 0.23 0.09 0.00 -0.26 0.00 0.00 64.21 64.40 2h4t n SER 293 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 2h4t s GLU 294 N -2.26 1.94 0.38 4.33 0.41 -0.83 -4.59 118.70 118.08 2h4t s GLU 294 Ca 0.24 0.40 -0.26 0.00 -0.41 0.00 0.00 54.97 54.94 2h4t s GLU 294 Cb 0.19 -1.92 -0.11 0.00 -1.78 0.00 0.00 34.13 30.51 2h4t s GLU 294 CO 0.44 -1.67 1.20 -1.71 -0.49 0.00 0.00 175.26 173.04 2h4t n ASN 295 N -3.42 2.26 0.22 -0.19 2.85 -1.26 -4.30 115.26 111.42 2h4t n ASN 295 Ca 0.07 1.14 0.05 0.00 -0.11 0.00 0.00 54.58 55.73 2h4t n ASN 295 Cb 0.58 -1.44 0.49 0.00 1.24 0.00 0.00 39.78 40.65 2h4t n ASN 295 CO 0.00 0.00 0.00 0.03 -2.11 0.00 0.00 177.26 175.18 2h4t h ARG 296 N 2.15 0.00 -0.11 1.20 2.47 -0.59 -0.66 114.38 118.84 2h4t h ARG 296 Ca -0.46 0.00 -0.22 0.00 -1.26 0.00 0.00 59.98 58.04 2h4t h ARG 296 Cb 1.30 0.00 0.01 0.00 -1.65 0.00 0.00 29.97 29.63 2h4t h ARG 296 CO 0.60 0.20 -0.82 -0.44 0.56 0.00 0.00 179.97 180.08 2h4t h ASP 297 N 0.00 0.82 -0.34 7.04 3.32 -1.79 -0.63 116.42 124.83 2h4t h ASP 297 Ca -0.00 -0.56 -0.04 0.00 0.02 0.00 0.00 57.03 56.45 2h4t h ASP 297 Cb 0.36 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.65 2h4t h ASP 297 CO 0.03 1.35 0.05 0.58 -1.72 0.00 0.00 179.24 179.52 2h4t h VAL 298 N 0.45 1.24 -0.53 -1.35 2.07 -1.81 -2.48 116.25 113.83 2h4t h VAL 298 Ca -0.06 -0.85 -0.11 0.00 0.82 0.00 0.00 66.70 66.50 2h4t h VAL 298 Cb 1.44 1.14 -0.02 0.00 -1.52 0.00 0.00 31.29 32.33 2h4t h VAL 298 CO 0.16 0.28 -0.11 -0.25 0.02 0.00 0.00 177.57 177.67 2h4t h TRP 299 N 0.40 1.12 -0.80 1.57 -0.00 -1.17 -1.81 115.95 115.26 2h4t h TRP 299 Ca 0.10 -0.23 0.04 0.00 -0.00 0.00 0.00 58.89 58.80 2h4t h TRP 299 Cb 0.37 -0.28 -0.05 0.00 -0.00 0.00 0.00 29.16 29.20 2h4t h TRP 299 CO 0.03 1.04 0.50 0.00 -0.00 0.00 0.00 178.44 180.00 2h4t h ALA 300 N 0.97 1.06 -0.29 2.65 0.00 -0.98 0.15 119.26 122.82 2h4t h ALA 300 Ca 0.14 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.91 2h4t h ALA 300 Cb 0.67 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 2h4t h ALA 300 CO 0.05 0.29 -0.29 1.49 0.00 0.00 0.00 179.25 180.79 2h4t h GLU 301 N 0.96 0.71 -0.16 0.00 4.81 -1.23 -2.61 114.58 117.05 2h4t h GLU 301 Ca 0.33 -0.37 -0.09 0.00 -0.13 0.00 0.00 59.36 59.09 2h4t h GLU 301 Cb 0.05 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.43 2h4t h GLU 301 CO -0.13 0.99 -0.30 -0.07 -0.73 0.00 0.00 179.01 178.77 2h4t h LEU 302 N 0.45 0.30 -0.69 1.64 3.38 -0.95 -2.27 115.31 117.18 2h4t h LEU 302 Ca 0.05 -0.10 -0.11 0.00 0.09 0.00 0.00 57.88 57.80 2h4t h LEU 302 Cb 0.86 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.51 2h4t h LEU 302 CO 0.07 0.60 -0.21 -0.09 0.09 0.00 0.00 178.44 178.90 2h4t h ARG 303 N 0.27 0.79 -0.64 1.13 2.43 -0.66 -0.97 114.38 116.72 2h4t h ARG 303 Ca 0.04 -0.31 -0.06 0.00 -0.81 0.00 0.00 59.98 58.83 2h4t h ARG 303 Cb 0.67 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 30.15 2h4t h ARG 303 CO 0.05 0.93 0.16 0.37 -1.51 0.00 0.00 179.97 179.97 2h4t h GLN 304 N 0.69 1.00 -0.45 0.20 5.75 -1.12 -0.83 115.11 120.35 2h4t h GLN 304 Ca 0.10 -0.22 -0.12 0.00 -0.15 0.00 0.00 58.65 58.25 2h4t h GLN 304 Cb 0.73 -0.14 -0.01 0.00 1.07 0.00 0.00 27.48 29.12 2h4t h GLN 304 CO 0.06 0.89 -0.20 0.87 -2.65 0.00 0.00 178.83 177.80 2h4t h LYS 305 N 0.96 0.94 -0.84 1.69 1.57 -1.13 -1.48 116.57 118.27 2h4t h LYS 305 Ca 0.20 -0.40 0.04 0.00 -1.87 0.00 0.00 60.65 58.63 2h4t h LYS 305 Cb 0.34 -0.03 -0.05 0.00 0.08 0.00 0.00 32.23 32.56 2h4t h LYS 305 CO -0.00 1.06 0.53 1.25 -0.57 0.00 0.00 179.45 181.72 2h4t h LEU 306 N 0.78 0.87 0.31 2.94 5.85 -0.80 -0.35 115.31 124.90 2h4t h LEU 306 Ca 0.10 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.81 2h4t h LEU 306 Cb 0.77 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 41.61 2h4t h LEU 306 CO 0.06 0.59 -0.15 0.40 -0.34 0.00 0.00 178.44 179.00 2h4t h ILE 307 N 1.02 0.71 0.00 4.05 1.08 -0.82 -2.42 117.51 121.13 2h4t h ILE 307 Ca 0.34 -0.11 0.00 0.00 -0.39 0.00 0.00 64.86 64.71 2h4t h ILE 307 Cb 0.06 0.77 0.00 0.00 -3.07 0.00 0.00 36.82 34.58 2h4t h ILE 307 CO -0.13 0.02 0.00 -0.26 -0.69 0.00 0.00 178.15 177.09 2h4t h PHE 308 N -0.47 0.00 -0.44 1.37 0.05 -0.72 -1.47 116.94 115.27 2h4t h PHE 308 Ca -0.04 0.00 -0.13 0.00 3.82 0.00 0.00 57.97 61.62 2h4t h PHE 308 Cb 0.35 0.00 -0.08 0.00 2.00 0.00 0.00 35.95 38.23 2h4t h PHE 308 CO -0.04 0.00 0.16 -0.25 -0.18 0.00 0.00 178.31 178.00 2h4t n ASP 309 N -2.94 3.62 -1.08 2.17 8.00 -0.19 -4.88 116.55 121.24 2h4t n ASP 309 Ca -0.02 -2.70 -0.08 0.00 0.71 0.00 0.00 54.79 52.70 2h4t n ASP 309 Cb 0.10 -0.65 0.01 0.00 -0.02 0.00 0.00 41.12 40.56 2h4t n ASP 309 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2h4t n GLY 310 N 0.02 0.20 0.54 0.44 0.00 -0.56 -4.70 105.19 101.13 2h4t n GLY 310 Ca 0.24 -0.51 0.06 0.00 0.00 0.00 0.00 46.02 45.81 2h4t n GLY 310 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2h4t n ASN 311 N 0.39 2.99 -0.05 1.61 3.02 -1.05 -4.73 115.26 117.44 2h4t n ASN 311 Ca -0.06 -2.44 -0.08 0.00 -0.03 0.00 0.00 54.58 51.97 2h4t n ASN 311 Cb 0.55 -0.31 -0.02 0.00 -0.61 0.00 0.00 39.78 39.39 2h4t n ASN 311 CO 0.00 0.00 0.00 -0.08 -2.62 0.00 0.00 177.26 174.56 2h4t h GLU 312 N 1.37 0.10 -0.77 3.52 4.81 -1.79 0.11 114.58 121.93 2h4t h GLU 312 Ca 0.00 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.22 2h4t h GLU 312 Cb 0.94 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 30.26 2h4t h GLU 312 CO 0.07 0.06 0.47 1.49 -0.73 0.00 0.00 179.01 180.37 2h4t h GLU 313 N 0.10 1.04 -0.14 1.92 4.81 -1.95 0.34 114.58 120.70 2h4t h GLU 313 Ca 0.10 -0.09 -0.01 0.00 -0.13 0.00 0.00 59.36 59.23 2h4t h GLU 313 Cb 0.12 -0.22 -0.01 0.00 0.63 0.00 0.00 28.75 29.27 2h4t h GLU 313 CO -0.15 0.73 0.04 1.15 -0.73 0.00 0.00 179.01 180.04 2h4t h THR 314 N 1.05 1.19 0.00 0.32 2.02 -1.80 -2.36 112.91 113.34 2h4t h THR 314 Ca 0.28 -0.60 -0.04 0.00 0.77 0.00 0.00 66.41 66.81 2h4t h THR 314 Cb -0.05 1.33 -0.01 0.00 -1.74 0.00 0.00 68.15 67.68 2h4t h THR 314 CO -0.05 0.18 -0.21 -0.07 0.37 0.00 0.00 175.52 175.74 2h4t h LEU 315 N 0.03 0.00 -0.66 2.58 3.38 -0.73 -2.00 115.31 117.91 2h4t h LEU 315 Ca 0.04 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.92 2h4t h LEU 315 Cb 0.24 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 2h4t h LEU 315 CO -0.00 0.21 0.04 0.50 0.09 0.00 0.00 178.44 179.28 2h4t h LYS 316 N 0.00 1.08 -0.46 1.13 3.64 -0.63 -0.75 116.57 120.59 2h4t h LYS 316 Ca -0.00 -0.32 -0.10 0.00 -1.27 0.00 0.00 60.65 58.96 2h4t h LYS 316 Cb 0.38 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.07 2h4t h LYS 316 CO 0.03 1.03 -0.11 0.87 -2.27 0.00 0.00 179.45 179.00 2h4t h LYS 317 N 1.00 0.89 0.08 1.90 1.57 -0.86 -2.41 116.57 118.74 2h4t h LYS 317 Ca 0.19 -0.34 -0.00 0.00 -1.87 0.00 0.00 60.65 58.62 2h4t h LYS 317 Cb 0.51 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.77 2h4t h LYS 317 CO 0.02 0.98 -0.04 0.28 -0.57 0.00 0.00 179.45 180.13 2h4t h VAL 318 N 0.73 1.03 -0.83 0.50 2.07 -1.17 -2.94 116.25 115.64 2h4t h VAL 318 Ca 0.12 -0.37 0.02 0.00 0.82 0.00 0.00 66.70 67.28 2h4t h VAL 318 Cb 0.65 1.27 -0.04 0.00 -1.52 0.00 0.00 31.29 31.65 2h4t h VAL 318 CO 0.04 0.09 0.55 0.44 0.02 0.00 0.00 177.57 178.72 2h4t h ASP 319 N -0.28 0.92 0.10 0.57 3.32 -1.11 -3.18 116.42 116.76 2h4t h ASP 319 Ca -0.01 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.02 2h4t h ASP 319 Cb 0.24 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 39.56 2h4t h ASP 319 CO 0.02 0.65 -0.16 -1.54 -1.72 0.00 0.00 179.24 176.49 2h4t n SER 320 N -4.43 1.46 -4.68 6.45 3.41 -0.91 -4.19 113.62 110.74 2h4t n SER 320 Ca 0.10 -1.27 -0.38 0.00 -0.26 0.00 0.00 58.87 57.06 2h4t n SER 320 Cb 0.06 0.10 0.05 0.00 -0.26 0.00 0.00 64.21 64.17 2h4t n SER 320 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2h4t n ALA 321 N -0.11 0.78 -0.34 7.33 0.00 -1.11 -4.45 120.51 122.61 2h4t n ALA 321 Ca 0.15 0.04 0.14 0.00 0.00 0.00 0.00 53.44 53.77 2h4t n ALA 321 Cb 0.38 -2.23 0.33 0.00 0.00 0.00 0.00 19.45 17.93 2h4t n ALA 321 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.50 177.11 2h4t h VAL 322 N 0.77 0.64 -2.00 0.00 -1.51 -1.19 -3.03 116.25 109.92 2h4t h VAL 322 Ca -0.50 -0.23 0.19 0.00 -1.23 0.00 0.00 66.70 64.93 2h4t h VAL 322 Cb 1.34 -0.08 -0.03 0.00 -2.13 0.00 0.00 31.29 30.38 2h4t h VAL 322 CO 0.53 0.12 0.54 2.22 -1.23 0.00 0.00 177.57 179.75 2h4t n PHE 323 N -4.84 -0.62 -4.12 5.19 1.16 -1.26 -1.03 117.46 111.94 2h4t n PHE 323 Ca 0.24 -0.64 -0.34 0.00 -1.87 0.00 0.00 57.45 54.84 2h4t n PHE 323 Cb 0.61 0.30 -0.15 0.00 -1.61 0.00 0.00 39.48 38.63 2h4t n PHE 323 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 2h4t s LEU 325 N 1.25 4.03 -0.25 0.00 2.96 0.06 -0.09 118.68 126.64 2h4t s LEU 325 Ca 0.03 0.02 -0.06 0.00 -0.22 0.00 0.00 54.13 53.90 2h4t s LEU 325 Cb -0.14 -2.11 -0.01 0.00 0.50 0.00 0.00 46.19 44.43 2h4t s LEU 325 CO -0.06 -0.02 0.02 0.00 -1.32 0.00 0.00 176.35 174.98 2h4t s LEU 327 N 1.53 5.62 0.18 0.00 1.43 0.40 -1.45 118.68 126.39 2h4t s LEU 327 Ca 0.05 -1.51 -0.22 0.00 -1.03 0.00 0.00 54.13 51.42 2h4t s LEU 327 Cb -0.15 -2.12 -0.08 0.00 0.03 0.00 0.00 46.19 43.87 2h4t s LEU 327 CO 0.00 -0.66 0.73 -1.81 0.23 0.00 0.00 176.35 174.84 2h4t s ASP 328 N 2.68 7.21 -0.59 2.29 1.01 -1.07 -4.37 116.67 123.83 2h4t s ASP 328 Ca 0.04 1.51 -0.01 0.00 0.71 0.00 0.00 52.55 54.80 2h4t s ASP 328 Cb -0.25 -2.45 0.46 0.00 1.01 0.00 0.00 42.92 41.69 2h4t s ASP 328 CO 0.04 0.14 2.00 0.47 0.21 0.00 0.00 175.17 178.03 2h4t n ASP 329 N 1.21 6.80 -3.72 0.27 8.00 -1.26 -2.55 116.55 125.31 2h4t n ASP 329 Ca -0.05 -3.67 -0.13 0.00 0.71 0.00 0.00 54.79 51.66 2h4t n ASP 329 Cb 0.50 -0.96 -0.08 0.00 -0.02 0.00 0.00 41.12 40.57 2h4t n ASP 329 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 2h4t s PHE 330 N -3.50 -0.21 0.65 1.24 -0.12 -1.26 -4.88 117.98 109.90 2h4t s PHE 330 Ca 0.60 0.22 -0.06 0.00 -0.05 0.00 0.00 56.93 57.64 2h4t s PHE 330 Cb 0.47 0.14 0.04 0.00 -0.63 0.00 0.00 43.02 43.05 2h4t s PHE 330 CO 0.01 -0.48 0.96 -1.25 -0.05 0.00 0.00 175.22 174.41 2h4t s PRO 331 N -1.96 2.49 -0.16 1.99 0.04 -1.26 -2.60 135.00 133.54 2h4t s PRO 331 Ca -0.09 -0.18 -0.25 0.00 0.04 0.00 0.00 61.00 60.53 2h4t s PRO 331 Cb -0.03 -2.22 -0.02 0.00 0.04 0.00 0.00 34.50 32.27 2h4t s PRO 331 CO 0.01 -1.01 0.79 -1.64 0.04 0.00 0.00 177.00 175.19 2h4t s MET 332 N -5.13 4.31 0.13 4.56 -1.94 -1.26 -4.95 119.30 115.02 2h4t s MET 332 Ca 0.58 0.95 -0.09 0.00 -1.71 0.00 0.00 55.69 55.42 2h4t s MET 332 Cb -0.11 -3.56 -0.07 0.00 2.01 0.00 0.00 34.83 33.10 2h4t s MET 332 CO 0.45 -0.26 1.37 0.87 -0.01 0.00 0.00 175.02 177.43 2h4t h LYS 333 N 7.27 0.71 -2.48 2.03 1.57 -1.96 -3.49 116.57 120.23 2h4t h LYS 333 Ca -0.31 -0.54 0.18 0.00 -1.87 0.00 0.00 60.65 58.11 2h4t h LYS 333 Cb 1.14 0.10 -0.04 0.00 0.08 0.00 0.00 32.23 33.51 2h4t h LYS 333 CO 0.82 1.16 0.62 0.16 -0.57 0.00 0.00 179.45 181.63 2h4t s ASP 334 N -7.04 -0.00 0.47 0.86 1.47 -1.26 -5.00 116.67 106.17 2h4t s ASP 334 Ca -0.09 -0.61 0.13 0.00 1.18 0.00 0.00 52.55 53.15 2h4t s ASP 334 Cb 0.10 0.46 1.09 0.00 -0.34 0.00 0.00 42.92 44.23 2h4t s ASP 334 CO 0.88 -0.91 2.09 -0.07 0.68 0.00 0.00 175.17 177.84 2h4t h LEU 335 N 2.00 0.22 -0.25 2.11 3.38 -1.99 0.30 115.31 121.10 2h4t h LEU 335 Ca -0.27 -0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.56 2h4t h LEU 335 Cb 1.21 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.91 2h4t h LEU 335 CO 0.35 0.16 -0.38 0.40 0.09 0.00 0.00 178.44 179.06 2h4t h ILE 336 N 0.26 1.31 -0.60 1.22 2.04 -1.96 -0.84 117.51 118.93 2h4t h ILE 336 Ca 0.11 -1.58 -0.10 0.00 1.00 0.00 0.00 64.86 64.28 2h4t h ILE 336 Cb 0.10 1.72 -0.02 0.00 -0.74 0.00 0.00 36.82 37.88 2h4t h ILE 336 CO -0.02 0.50 -0.01 -0.74 0.00 0.00 0.00 178.15 177.88 2h4t h HIS 337 N 0.42 1.17 0.05 1.37 2.76 -1.78 -1.58 115.15 117.55 2h4t h HIS 337 Ca 0.02 -0.21 -0.00 0.00 -2.20 0.00 0.00 60.37 57.98 2h4t h HIS 337 Cb 0.98 -0.30 0.00 0.00 1.55 0.00 0.00 27.41 29.63 2h4t h HIS 337 CO 0.08 1.04 -0.02 1.25 -1.30 0.00 0.00 177.93 178.97 2h4t h LEU 338 N 0.97 -0.05 -0.49 0.26 6.46 -0.88 -0.65 115.31 120.93 2h4t h LEU 338 Ca 0.17 -0.01 0.05 0.00 -0.12 0.00 0.00 57.88 57.97 2h4t h LEU 338 Cb 0.58 0.01 -0.05 0.00 -0.73 0.00 0.00 40.66 40.47 2h4t h LEU 338 CO 0.03 -0.03 0.23 0.28 -0.62 0.00 0.00 178.44 178.33 2h4t h SER 339 N -0.07 0.31 -0.47 1.25 0.02 -0.96 -0.98 113.55 112.66 2h4t h SER 339 Ca -0.01 0.04 -0.04 0.00 -0.84 0.00 0.00 61.79 60.94 2h4t h SER 339 Cb 0.06 -0.02 -0.02 0.00 0.14 0.00 0.00 62.40 62.56 2h4t h SER 339 CO 0.01 0.22 0.14 0.45 -1.14 0.00 0.00 176.83 176.50 2h4t h HIS 340 N 0.45 0.76 -0.64 3.45 3.86 -1.13 -0.59 115.15 121.32 2h4t h HIS 340 Ca 0.22 -0.08 0.03 0.00 -1.16 0.00 0.00 60.37 59.38 2h4t h HIS 340 Cb 0.16 -0.22 -0.04 0.00 1.06 0.00 0.00 27.41 28.37 2h4t h HIS 340 CO -0.12 0.68 0.39 1.15 0.86 0.00 0.00 177.93 180.89 2h4t h THR 341 N 0.62 1.06 0.00 2.45 2.02 -0.59 -0.93 112.91 117.54 2h4t h THR 341 Ca 0.15 -0.26 -0.21 0.00 0.77 0.00 0.00 66.41 66.86 2h4t h THR 341 Cb 0.29 0.24 -0.03 0.00 -1.74 0.00 0.00 68.15 66.91 2h4t h THR 341 CO -0.00 0.14 -1.02 0.24 0.37 0.00 0.00 175.52 175.24 2h4t h MET 342 N 0.75 0.00 -0.02 6.66 2.86 -1.10 -2.68 114.93 121.39 2h4t h MET 342 Ca 0.26 0.00 -0.24 0.00 -2.06 0.00 0.00 59.70 57.66 2h4t h MET 342 Cb 0.05 0.00 0.01 0.00 0.06 0.00 0.00 31.60 31.73 2h4t h MET 342 CO -0.12 0.92 -0.97 1.25 1.06 0.00 0.00 176.91 179.05 2h4t h LEU 343 N 0.00 0.77 0.00 1.22 5.85 -0.95 -3.43 115.31 118.77 2h4t h LEU 343 Ca -0.03 -0.60 0.00 0.00 0.84 0.00 0.00 57.88 58.09 2h4t h LEU 343 Cb 1.76 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 42.56 2h4t h LEU 343 CO 0.12 1.40 0.00 0.00 -0.34 0.00 0.00 178.44 179.62 2h4t n HIS 344 N -3.83 0.00 -4.50 1.25 1.44 -0.48 -4.65 115.22 104.46 2h4t n HIS 344 Ca -0.09 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.62 2h4t n HIS 344 Cb 0.84 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.95 2h4t n HIS 344 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2h4t n GLY 345 N 0.45 -0.90 0.53 -1.39 0.00 -0.48 -3.85 105.19 99.55 2h4t n GLY 345 Ca 0.00 -1.14 0.11 0.00 0.00 0.00 0.00 46.02 44.99 2h4t n GLY 345 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2h4t n ASP 346 N -1.24 1.59 0.00 1.61 5.68 -1.26 -4.92 116.55 118.02 2h4t n ASP 346 Ca 0.00 -1.65 0.00 0.00 -0.50 0.00 0.00 54.79 52.64 2h4t n ASP 346 Cb 0.00 -0.08 0.00 0.00 -1.14 0.00 0.00 41.12 39.90 2h4t n ASP 346 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2h4t n GLY 347 N 1.13 1.36 0.03 6.12 0.00 -1.25 -4.90 105.19 107.69 2h4t n GLY 347 Ca 0.17 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.25 2h4t n GLY 347 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2h4t n THR 348 N -2.00 0.33 -1.88 2.61 -2.24 -1.26 -2.91 114.28 106.92 2h4t n THR 348 Ca 0.00 -0.58 -0.12 0.00 -2.27 0.00 0.00 64.05 61.08 2h4t n THR 348 Cb 0.00 -0.12 0.09 0.00 -2.10 0.00 0.00 70.33 68.21 2h4t n THR 348 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2h4t n ASN 349 N -2.38 3.62 -3.76 3.42 5.15 -1.26 -3.89 115.26 116.16 2h4t n ASN 349 Ca -0.10 -3.77 -0.13 0.00 -0.60 0.00 0.00 54.58 49.98 2h4t n ASN 349 Cb 0.70 -0.41 -0.14 0.00 -0.53 0.00 0.00 39.78 39.39 2h4t n ASN 349 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 2h4t s ARG 350 N -3.43 0.10 -0.89 1.20 1.81 -1.26 -4.82 118.95 111.65 2h4t s ARG 350 Ca 0.46 0.35 -0.12 0.00 -1.72 0.00 0.00 55.73 54.69 2h4t s ARG 350 Cb 0.39 -0.15 0.23 0.00 -0.45 0.00 0.00 34.95 34.97 2h4t s ARG 350 CO -0.00 -0.15 0.84 -0.46 -0.68 0.00 0.00 175.30 174.84 2h4t s TRP 351 N 1.04 3.87 0.55 -0.53 -0.11 -1.26 -4.80 118.94 117.71 2h4t s TRP 351 Ca -0.08 -2.22 0.30 0.00 1.22 0.00 0.00 56.10 55.32 2h4t s TRP 351 Cb -0.10 -3.78 1.47 0.00 -1.50 0.00 0.00 33.47 29.55 2h4t s TRP 351 CO -0.05 -0.97 1.90 0.74 -4.62 0.00 0.00 176.95 173.95 2h4t h PHE 352 N 7.43 0.00 0.00 5.86 -1.00 -1.86 -2.22 116.94 125.15 2h4t h PHE 352 Ca 0.12 0.00 -0.05 0.00 2.81 0.00 0.00 57.97 60.85 2h4t h PHE 352 Cb 0.99 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.54 2h4t h PHE 352 CO 0.95 0.00 -0.26 -0.44 -1.61 0.00 0.00 178.31 176.95 2h4t h ASP 353 N 0.00 0.00 -4.04 2.17 3.32 -1.88 -3.41 116.42 112.58 2h4t h ASP 353 Ca 0.38 0.00 -0.56 0.00 0.02 0.00 0.00 57.03 56.87 2h4t h ASP 353 Cb 1.57 0.00 0.16 0.00 0.22 0.00 0.00 39.33 41.28 2h4t h ASP 353 CO -0.00 0.26 0.43 1.17 -1.72 0.00 0.00 179.24 179.37 2h4t n LYS 354 N -3.43 0.95 -0.33 3.56 3.00 -0.84 -1.25 118.16 119.81 2h4t n LYS 354 Ca 0.00 0.38 0.15 0.00 -0.00 0.00 0.00 58.31 58.85 2h4t n LYS 354 Cb 0.45 -2.47 0.35 0.00 0.00 0.00 0.00 35.03 33.36 2h4t n LYS 354 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 2h4t h SER 355 N 0.31 0.59 -4.71 3.14 4.64 -1.66 -3.30 113.55 112.56 2h4t h SER 355 Ca -0.50 0.13 0.02 0.00 -0.47 0.00 0.00 61.79 60.98 2h4t h SER 355 Cb 1.34 0.05 -0.17 0.00 -0.31 0.00 0.00 62.40 63.30 2h4t h SER 355 CO 0.52 0.10 0.35 0.72 -0.87 0.00 0.00 176.83 177.65 2h4t s PHE 356 N -5.82 -0.49 -0.16 4.77 -0.71 -1.26 -1.85 117.98 112.46 2h4t s PHE 356 Ca -0.11 0.60 0.00 0.00 -1.04 0.00 0.00 56.93 56.38 2h4t s PHE 356 Cb 0.26 0.49 -0.00 0.00 -1.21 0.00 0.00 43.02 42.56 2h4t s PHE 356 CO 0.79 -0.59 -0.15 -0.80 -1.34 0.00 0.00 175.22 173.13 2h4t s ASN 357 N -1.86 3.63 -0.32 1.98 0.01 0.17 -2.91 114.94 115.64 2h4t s ASN 357 Ca -0.02 -0.48 -0.13 0.00 -0.71 0.00 0.00 52.86 51.51 2h4t s ASN 357 Cb -0.01 -1.56 -0.02 0.00 0.41 0.00 0.00 41.25 40.07 2h4t s ASN 357 CO -0.02 0.08 0.28 -0.22 -1.51 0.00 0.00 177.10 175.70 2h4t s LEU 358 N 0.87 4.37 -0.14 0.60 2.96 0.86 -1.00 118.68 127.21 2h4t s LEU 358 Ca -0.04 -0.24 -0.04 0.00 -0.22 0.00 0.00 54.13 53.58 2h4t s LEU 358 Cb -0.15 -2.21 -0.03 0.00 0.50 0.00 0.00 46.19 44.29 2h4t s LEU 358 CO -0.01 -0.23 0.01 -0.63 -1.32 0.00 0.00 176.35 174.17 2h4t s ILE 359 N 1.84 4.37 -0.16 6.68 1.01 0.56 -0.42 121.20 135.08 2h4t s ILE 359 Ca 0.09 -0.20 -0.02 0.00 0.00 0.00 0.00 60.65 60.51 2h4t s ILE 359 Cb -0.17 -2.91 0.05 0.00 0.01 0.00 0.00 42.46 39.44 2h4t s ILE 359 CO 0.11 0.52 0.01 -0.69 0.00 0.00 0.00 174.94 174.89 2h4t s VAL 360 N -0.07 0.61 0.82 2.92 1.01 -0.53 -1.06 120.40 124.10 2h4t s VAL 360 Ca 0.04 -0.43 -0.12 0.00 0.00 0.00 0.00 61.98 61.47 2h4t s VAL 360 Cb -0.13 -0.98 0.09 0.00 0.00 0.00 0.00 36.38 35.36 2h4t s VAL 360 CO 0.02 -0.05 1.18 0.00 0.00 0.00 0.00 175.10 176.25 2h4t s ALA 361 N 1.84 2.58 0.51 5.51 0.00 0.53 -2.58 121.76 130.14 2h4t s ALA 361 Ca 0.01 -0.64 0.36 0.00 0.00 0.00 0.00 51.96 51.68 2h4t s ALA 361 Cb -0.16 -2.96 1.94 0.00 0.00 0.00 0.00 23.12 21.94 2h4t s ALA 361 CO -0.07 -1.74 2.23 1.49 0.00 0.00 0.00 175.76 177.67 2h4t h GLU 362 N -1.10 0.00 0.00 0.00 4.81 -1.23 0.38 114.58 117.43 2h4t h GLU 362 Ca -0.46 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.77 2h4t h GLU 362 Cb 1.33 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.71 2h4t h GLU 362 CO 0.65 0.03 -0.11 -3.47 -0.73 0.00 0.00 179.01 175.38 2h4t n ASP 363 N -3.36 0.53 0.00 1.04 4.64 -1.26 -4.34 116.55 113.80 2h4t n ASP 363 Ca -0.02 0.44 0.00 0.00 -1.38 0.00 0.00 54.79 53.83 2h4t n ASP 363 Cb 0.15 -0.51 0.00 0.00 -1.04 0.00 0.00 41.12 39.71 2h4t n ASP 363 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 2h4t n GLY 364 N 1.38 0.89 3.70 0.27 0.00 0.12 -4.82 105.19 106.74 2h4t n GLY 364 Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 2h4t n GLY 364 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2h4t s THR 365 N -2.30 2.47 0.15 2.61 2.01 -1.26 -4.67 115.64 114.65 2h4t s THR 365 Ca 0.00 0.08 0.09 0.00 0.31 0.00 0.00 61.69 62.17 2h4t s THR 365 Cb 0.00 -3.05 -0.04 0.00 0.01 0.00 0.00 72.50 69.42 2h4t s THR 365 CO 0.00 0.00 -0.21 0.00 -0.69 0.00 0.00 174.62 173.72 2h4t s ALA 366 N 2.38 2.05 0.24 7.40 0.00 -1.26 -0.35 121.76 132.22 2h4t s ALA 366 Ca 0.79 -1.43 -0.22 0.00 0.00 0.00 0.00 51.96 51.10 2h4t s ALA 366 Cb -0.46 -0.24 0.04 0.00 0.00 0.00 0.00 23.12 22.45 2h4t s ALA 366 CO 0.35 0.33 0.74 0.00 0.00 0.00 0.00 175.76 177.18 2h4t s ALA 367 N -1.62 -1.35 -0.12 0.00 0.00 -0.23 -0.48 121.76 117.95 2h4t s ALA 367 Ca 0.13 -0.09 0.02 0.00 0.00 0.00 0.00 51.96 52.02 2h4t s ALA 367 Cb -0.08 0.82 0.02 0.00 0.00 0.00 0.00 23.12 23.87 2h4t s ALA 367 CO 0.06 -0.99 -0.16 0.08 0.00 0.00 0.00 175.76 174.75 2h4t s VAL 368 N -3.78 1.61 -0.17 0.00 1.01 0.31 -0.32 120.40 119.06 2h4t s VAL 368 Ca 0.09 -0.70 -0.04 0.00 0.00 0.00 0.00 61.98 61.34 2h4t s VAL 368 Cb -0.04 -1.47 -0.02 0.00 0.00 0.00 0.00 36.38 34.84 2h4t s VAL 368 CO 0.03 0.46 -0.03 -2.28 0.00 0.00 0.00 175.10 173.28 2h4t s HIS 369 N 1.07 3.01 0.10 5.22 5.04 -0.17 -1.18 115.29 128.38 2h4t s HIS 369 Ca -0.04 -0.39 0.04 0.00 -1.54 0.00 0.00 55.06 53.12 2h4t s HIS 369 Cb -0.15 -1.99 -0.04 0.00 0.04 0.00 0.00 32.58 30.45 2h4t s HIS 369 CO -0.04 -0.13 -0.10 -0.59 -2.34 0.00 0.00 174.74 171.55 2h4t s PHE 370 N 0.58 1.08 -0.09 3.88 -0.12 -1.06 0.46 117.98 122.72 2h4t s PHE 370 Ca -0.03 -0.67 -0.30 0.00 -0.05 0.00 0.00 56.93 55.89 2h4t s PHE 370 Cb -0.14 -0.59 -0.02 0.00 -0.63 0.00 0.00 43.02 41.64 2h4t s PHE 370 CO 0.02 0.01 1.15 -2.00 -0.05 0.00 0.00 175.22 174.35 2h4t s GLU 371 N -2.91 4.35 0.26 1.99 -6.30 -0.77 -3.71 118.70 111.60 2h4t s GLU 371 Ca 0.07 1.58 -0.02 0.00 -2.50 0.00 0.00 54.97 54.09 2h4t s GLU 371 Cb -0.02 -3.58 0.33 0.00 0.00 0.00 0.00 34.13 30.85 2h4t s GLU 371 CO -0.00 -0.46 1.75 1.25 0.02 0.00 0.00 175.26 177.82 2h4t h HIS 372 N 7.46 0.84 -0.25 5.30 -0.00 -1.90 -3.36 115.15 123.24 2h4t h HIS 372 Ca -0.31 -0.12 -0.02 0.00 -0.00 0.00 0.00 60.37 59.91 2h4t h HIS 372 Cb 1.14 -0.23 -0.01 0.00 -0.00 0.00 0.00 27.41 28.31 2h4t h HIS 372 CO 0.74 0.78 0.05 0.66 -0.00 0.00 0.00 177.93 180.16 2h4t h SER 373 N 0.73 0.32 0.93 3.26 4.64 -1.93 -3.26 113.55 118.25 2h4t h SER 373 Ca 0.14 -0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 2h4t h SER 373 Cb 0.47 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.48 2h4t h SER 373 CO 0.02 0.34 0.00 -2.67 -0.87 0.00 0.00 176.83 173.66 2h4t n TRP 374 N -4.38 0.55 -3.84 4.77 4.27 -1.26 -4.90 117.44 112.65 2h4t n TRP 374 Ca 0.01 0.19 0.00 0.00 -3.89 0.00 0.00 57.50 53.81 2h4t n TRP 374 Cb 0.17 -0.81 0.01 0.00 -1.36 0.00 0.00 31.31 29.32 2h4t n TRP 374 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 2h4t n GLY 375 N 0.60 0.60 1.08 -1.67 0.00 -1.23 -4.95 105.19 99.63 2h4t n GLY 375 Ca 0.04 -1.01 0.09 0.00 0.00 0.00 0.00 46.02 45.14 2h4t n GLY 375 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2h4t n ASP 376 N -0.84 3.15 0.00 1.61 8.00 -1.26 -4.92 116.55 122.28 2h4t n ASP 376 Ca 0.01 -2.07 0.00 0.00 0.71 0.00 0.00 54.79 53.44 2h4t n ASP 376 Cb 0.35 -0.40 0.00 0.00 -0.02 0.00 0.00 41.12 41.05 2h4t n ASP 376 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2h4t n GLY 377 N 1.30 2.37 0.32 0.44 0.00 -1.26 -4.87 105.19 103.49 2h4t n GLY 377 Ca 0.19 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.13 2h4t n GLY 377 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2h4t h VAL 378 N 0.00 1.26 -0.78 1.61 2.07 -2.00 -1.51 116.25 116.91 2h4t h VAL 378 Ca 0.00 -1.03 -0.02 0.00 0.82 0.00 0.00 66.70 66.47 2h4t h VAL 378 Cb 0.00 0.61 -0.04 0.00 -1.52 0.00 0.00 31.29 30.34 2h4t h VAL 378 CO 0.00 0.39 0.41 0.00 0.02 0.00 0.00 177.57 178.39 2h4t h ALA 379 N 1.07 1.26 -0.51 1.67 0.00 -1.95 -1.24 119.26 119.55 2h4t h ALA 379 Ca 0.21 -0.13 -0.10 0.00 0.00 0.00 0.00 54.91 54.89 2h4t h ALA 379 Cb 0.43 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 2h4t h ALA 379 CO 0.01 0.59 -0.08 0.28 0.00 0.00 0.00 179.25 180.05 2h4t h VAL 380 N 1.09 1.26 -0.44 0.00 2.07 -1.83 -0.69 116.25 117.72 2h4t h VAL 380 Ca 0.27 -1.20 -0.13 0.00 0.82 0.00 0.00 66.70 66.47 2h4t h VAL 380 Cb 0.05 0.96 -0.01 0.00 -1.52 0.00 0.00 31.29 30.76 2h4t h VAL 380 CO -0.04 0.42 -0.23 0.25 0.02 0.00 0.00 177.57 177.99 2h4t h LEU 381 N 0.84 0.91 -0.10 2.57 5.85 -0.81 0.23 115.31 124.80 2h4t h LEU 381 Ca 0.14 -0.34 -0.01 0.00 0.84 0.00 0.00 57.88 58.51 2h4t h LEU 381 Cb 0.61 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 41.39 2h4t h LEU 381 CO 0.04 1.10 0.03 -0.09 -0.34 0.00 0.00 178.44 179.18 2h4t h ARG 382 N 0.77 0.15 -0.20 1.25 9.65 -1.05 0.50 114.38 125.46 2h4t h ARG 382 Ca 0.10 -0.03 0.05 0.00 -1.10 0.00 0.00 59.98 59.00 2h4t h ARG 382 Cb 0.78 -0.02 -0.05 0.00 -1.39 0.00 0.00 29.97 29.28 2h4t h ARG 382 CO 0.06 0.31 -0.13 0.35 2.80 0.00 0.00 179.97 183.37 2h4t h PHE 383 N -0.03 -0.33 -0.22 2.20 3.57 -0.99 -0.58 116.94 120.56 2h4t h PHE 383 Ca 0.03 0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.61 2h4t h PHE 383 Cb 0.23 0.17 -0.06 0.00 2.79 0.00 0.00 35.95 39.08 2h4t h PHE 383 CO -0.00 -0.20 -0.14 0.35 -2.23 0.00 0.00 178.31 176.10 2h4t h PHE 384 N -0.13 -0.34 -0.56 0.41 3.57 -0.27 0.23 116.94 119.86 2h4t h PHE 384 Ca 0.11 0.03 -0.09 0.00 3.53 0.00 0.00 57.97 61.55 2h4t h PHE 384 Cb 0.30 0.18 -0.02 0.00 2.79 0.00 0.00 35.95 39.20 2h4t h PHE 384 CO -0.28 -0.20 0.00 -0.91 -2.23 0.00 0.00 178.31 174.68 2h4t h ASN 385 N -0.13 0.97 -0.39 0.41 2.35 -0.55 -1.91 115.58 116.34 2h4t h ASN 385 Ca 0.12 -0.31 -0.14 0.00 -0.55 0.00 0.00 56.30 55.42 2h4t h ASN 385 Cb 0.31 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.41 2h4t h ASN 385 CO -0.30 1.04 -0.30 -0.33 -1.65 0.00 0.00 177.43 175.89 2h4t h GLU 386 N 0.87 0.92 -0.29 0.81 4.39 -0.88 -2.06 114.58 118.34 2h4t h GLU 386 Ca 0.16 -0.43 -0.14 0.00 0.34 0.00 0.00 59.36 59.29 2h4t h GLU 386 Cb 0.54 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.17 2h4t h GLU 386 CO 0.03 1.09 -0.39 0.28 -1.16 0.00 0.00 179.01 178.85 2h4t h VAL 387 N 0.77 1.29 -0.37 3.13 2.07 -0.91 -0.84 116.25 121.39 2h4t h VAL 387 Ca 0.08 -1.56 -0.05 0.00 0.82 0.00 0.00 66.70 65.98 2h4t h VAL 387 Cb 0.87 1.49 -0.01 0.00 -1.52 0.00 0.00 31.29 32.12 2h4t h VAL 387 CO 0.08 0.50 0.02 0.15 0.02 0.00 0.00 177.57 178.34 2h4t h PHE 388 N 0.57 0.70 0.01 1.57 3.57 -1.28 -1.21 116.94 120.85 2h4t h PHE 388 Ca 0.05 -0.11 -0.00 0.00 3.53 0.00 0.00 57.97 61.43 2h4t h PHE 388 Cb 0.93 -0.18 0.00 0.00 2.79 0.00 0.00 35.95 39.48 2h4t h PHE 388 CO 0.04 0.72 -0.00 -0.09 -2.23 0.00 0.00 178.31 176.75 2h4t h ARG 389 N 0.47 -0.01 -0.63 1.11 2.43 -1.27 -2.44 114.38 114.04 2h4t h ARG 389 Ca 0.11 0.00 -0.06 0.00 -0.81 0.00 0.00 59.98 59.22 2h4t h ARG 389 Cb 0.43 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.96 2h4t h ARG 389 CO 0.02 0.18 0.16 0.22 -1.51 0.00 0.00 179.97 179.03 2h4t h ASP 390 N -0.20 0.95 1.22 -3.80 3.58 -1.15 0.18 116.42 117.20 2h4t h ASP 390 Ca -0.00 -0.23 -0.04 0.00 0.42 0.00 0.00 57.03 57.18 2h4t h ASP 390 Cb 0.20 -0.25 -0.01 0.00 1.72 0.00 0.00 39.33 40.99 2h4t h ASP 390 CO 0.00 0.94 -0.18 0.77 -2.88 0.00 0.00 179.24 177.88 2h4t h SER 391 N 0.92 0.00 0.05 2.28 4.64 -1.24 -0.83 113.55 119.38 2h4t h SER 391 Ca 0.20 0.00 -0.33 0.00 -0.47 0.00 0.00 61.79 61.19 2h4t h SER 391 Cb 0.35 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.38 2h4t h SER 391 CO 0.00 0.18 -2.28 0.35 -0.87 0.00 0.00 176.83 174.21 2h4t n THR 392 N -3.25 1.27 -0.05 2.95 -2.24 -0.92 -3.69 114.28 108.35 2h4t n THR 392 Ca 0.01 -0.82 -0.09 0.00 -2.27 0.00 0.00 64.05 60.88 2h4t n THR 392 Cb 0.47 -0.47 -0.15 0.00 -2.10 0.00 0.00 70.33 68.09 2h4t n THR 392 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2h4t n GLN 393 N -2.73 0.65 -3.16 -0.78 6.02 0.04 -4.64 117.38 112.78 2h4t n GLN 393 Ca -0.29 0.19 -0.19 0.00 -0.01 0.00 0.00 57.00 56.70 2h4t n GLN 393 Cb 1.09 -1.70 -0.03 0.00 1.02 0.00 0.00 30.24 30.62 2h4t n GLN 393 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 2h4t n THR 394 N -2.95 -0.30 -1.66 5.09 -2.24 -0.32 -5.06 114.28 106.83 2h4t n THR 394 Ca -0.23 -4.26 -0.41 0.00 -2.27 0.00 0.00 64.05 56.88 2h4t n THR 394 Cb 1.09 -0.61 0.02 0.00 -2.10 0.00 0.00 70.33 68.73 2h4t n THR 394 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 2h4t n PRO 395 N 0.60 1.60 -0.04 -0.78 -0.02 -1.21 -4.65 135.00 130.50 2h4t n PRO 395 Ca 0.23 0.57 -0.13 0.00 -2.02 0.00 0.00 63.50 62.15 2h4t n PRO 395 Cb 0.63 -2.25 -0.01 0.00 -0.02 0.00 0.00 33.50 31.85 2h4t n PRO 395 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2h4t h ALA 396 N 1.68 0.54 -2.34 3.55 0.00 -1.86 -3.46 119.26 117.37 2h4t h ALA 396 Ca -0.47 -0.52 -0.32 0.00 0.00 0.00 0.00 54.91 53.60 2h4t h ALA 396 Cb 1.32 -0.07 -0.15 0.00 0.00 0.00 0.00 17.79 18.89 2h4t h ALA 396 CO 0.58 0.69 -0.63 0.96 0.00 0.00 0.00 179.25 180.84 2h4t s ILE 397 N -4.04 0.54 0.41 0.00 -4.36 -1.26 -4.98 121.20 107.51 2h4t s ILE 397 Ca -0.09 -1.99 0.07 0.00 -0.26 0.00 0.00 60.65 58.38 2h4t s ILE 397 Cb 0.10 -2.45 -0.07 0.00 1.25 0.00 0.00 42.46 41.29 2h4t s ILE 397 CO 0.87 -0.16 0.07 0.42 0.24 0.00 0.00 174.94 176.39 2h4t s THR 398 N -3.76 2.11 -1.60 8.37 -4.23 -1.26 -4.94 115.64 110.32 2h4t s THR 398 Ca 0.33 -1.89 0.16 0.00 -1.18 0.00 0.00 61.69 59.11 2h4t s THR 398 Cb 0.07 -3.00 0.33 0.00 1.34 0.00 0.00 72.50 71.24 2h4t s THR 398 CO 0.10 0.00 1.42 -0.81 -0.54 0.00 0.00 174.62 174.79 2h4t n PRO 399 N -1.07 0.31 0.00 3.99 -0.04 -1.26 -1.70 135.00 135.23 2h4t n PRO 399 Ca -0.04 0.10 0.08 0.00 -0.04 0.00 0.00 63.50 63.61 2h4t n PRO 399 Cb 0.66 -1.50 0.04 0.00 -0.04 0.00 0.00 33.50 32.66 2h4t n PRO 399 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2h4t n GLN 400 N -1.20 1.52 -2.01 0.54 3.00 -1.26 -4.98 117.38 112.99 2h4t n GLN 400 Ca 0.09 -1.24 -0.41 0.00 -0.01 0.00 0.00 57.00 55.43 2h4t n GLN 400 Cb 0.10 -1.32 -0.02 0.00 0.00 0.00 0.00 30.24 29.01 2h4t n GLN 400 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.06 175.94 2h4t s SER 401 N -1.65 6.64 -0.27 1.08 0.01 -0.69 -4.98 113.70 113.83 2h4t s SER 401 Ca 0.18 2.76 -0.14 0.00 1.31 0.00 0.00 55.95 60.05 2h4t s SER 401 Cb 0.14 -2.64 -0.04 0.00 0.21 0.00 0.00 66.02 63.69 2h4t s SER 401 CO 0.30 -0.67 0.35 -1.10 0.41 0.00 0.00 173.24 172.53 2h4t s GLN 402 N -1.29 4.01 0.28 12.44 -1.52 -1.26 -4.95 119.66 127.38 2h4t s GLN 402 Ca 0.54 0.01 -0.30 0.00 -1.95 0.00 0.00 55.36 53.66 2h4t s GLN 402 Cb -0.42 -3.65 -0.13 0.00 -0.22 0.00 0.00 33.01 28.59 2h4t s GLN 402 CO 0.51 -0.26 1.30 -0.35 -0.25 0.00 0.00 175.29 176.24 2h4t n PRO 403 N 5.27 1.94 -1.41 2.91 -0.04 -1.26 -4.91 135.00 137.51 2h4t n PRO 403 Ca -0.09 0.69 -0.34 0.00 -0.04 0.00 0.00 63.50 63.71 2h4t n PRO 403 Cb 0.51 -2.27 0.10 0.00 -0.04 0.00 0.00 33.50 31.80 2h4t n PRO 403 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2h4t s ALA 404 N -0.60 2.09 -0.19 0.55 0.00 -0.48 -4.93 121.76 118.20 2h4t s ALA 404 Ca 0.62 0.92 -0.29 0.00 0.00 0.00 0.00 51.96 53.21 2h4t s ALA 404 Cb -0.63 -3.49 0.00 0.00 0.00 0.00 0.00 23.12 19.00 2h4t s ALA 404 CO 0.56 -1.93 1.06 0.00 0.00 0.00 0.00 175.76 175.46 2h4t s ALA 405 N -1.94 3.61 -0.02 0.00 0.00 -1.26 -4.82 121.76 117.34 2h4t s ALA 405 Ca 0.75 0.28 -0.28 0.00 0.00 0.00 0.00 51.96 52.70 2h4t s ALA 405 Cb -0.30 -3.53 0.09 0.00 0.00 0.00 0.00 23.12 19.38 2h4t s ALA 405 CO 0.46 -0.95 0.80 -0.08 0.00 0.00 0.00 175.76 175.99 2h4t s THR 406 N 2.91 0.00 -1.17 0.00 -1.32 -1.26 -5.08 115.64 109.72 2h4t s THR 406 Ca 0.47 0.00 -0.16 0.00 -1.21 0.00 0.00 61.69 60.79 2h4t s THR 406 Cb -0.17 -1.00 0.14 0.00 -1.51 0.00 0.00 72.50 69.96 2h4t s THR 406 CO 0.10 0.00 1.45 0.21 -2.21 0.00 0.00 174.62 174.18 2h4t s ASN 407 N -1.89 6.92 0.47 8.08 2.47 -1.26 -4.82 114.94 124.91 2h4t s ASN 407 Ca -0.01 -2.64 0.13 0.00 0.42 0.00 0.00 52.86 50.75 2h4t s ASN 407 Cb -0.01 -2.45 1.07 0.00 -1.45 0.00 0.00 41.25 38.42 2h4t s ASN 407 CO -0.03 -0.93 2.08 0.28 -3.72 0.00 0.00 177.10 174.78 2h4t h SER 408 N 7.66 0.16 -0.00 -4.21 0.02 -1.97 -0.86 113.55 114.35 2h4t h SER 408 Ca 0.31 -0.01 -0.02 0.00 -0.84 0.00 0.00 61.79 61.23 2h4t h SER 408 Cb 0.90 -0.04 -0.01 0.00 0.14 0.00 0.00 62.40 63.40 2h4t h SER 408 CO 1.28 0.16 -0.04 0.77 -1.14 0.00 0.00 176.83 177.85 2h4t h SER 409 N 0.18 0.12 0.55 3.07 4.64 -1.87 0.32 113.55 120.54 2h4t h SER 409 Ca 0.05 -0.01 -0.29 0.00 -0.47 0.00 0.00 61.79 61.07 2h4t h SER 409 Cb 0.06 -0.03 -0.04 0.00 -0.31 0.00 0.00 62.40 62.08 2h4t h SER 409 CO -0.00 0.18 -1.58 0.00 -0.87 0.00 0.00 176.83 174.56 2h4t h ALA 410 N 1.83 0.59 0.00 5.18 0.00 -1.61 -3.36 119.26 121.89 2h4t h ALA 410 Ca 0.03 -1.31 -0.11 0.00 0.00 0.00 0.00 54.91 53.52 2h4t h ALA 410 Cb 0.17 0.36 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 2h4t h ALA 410 CO 0.01 1.44 -0.80 0.77 0.00 0.00 0.00 179.25 180.67 2h4t h SER 411 N 0.02 0.00 -3.67 0.00 0.02 -0.87 -3.43 113.55 105.61 2h4t h SER 411 Ca -0.24 0.00 -0.66 0.00 -0.84 0.00 0.00 61.79 60.05 2h4t h SER 411 Cb 1.97 0.00 -0.22 0.00 0.14 0.00 0.00 62.40 64.29 2h4t h SER 411 CO 0.10 0.48 -0.58 -0.69 -1.14 0.00 0.00 176.83 174.99 2h4t s VAL 412 N -2.98 4.51 -0.20 2.27 1.01 0.11 -4.51 120.40 120.61 2h4t s VAL 412 Ca 0.02 -0.29 -0.12 0.00 0.00 0.00 0.00 61.98 61.59 2h4t s VAL 412 Cb 0.08 -3.22 -0.05 0.00 0.00 0.00 0.00 36.38 33.19 2h4t s VAL 412 CO 0.77 0.19 0.22 -0.70 0.00 0.00 0.00 175.10 175.57 2h4t s GLU 413 N 1.62 4.18 -0.38 2.72 2.12 -0.54 -4.74 118.70 123.69 2h4t s GLU 413 Ca 0.05 -0.09 -0.22 0.00 0.36 0.00 0.00 54.97 55.07 2h4t s GLU 413 Cb -0.16 -3.46 0.01 0.00 0.26 0.00 0.00 34.13 30.77 2h4t s GLU 413 CO 0.05 0.18 0.73 0.99 -0.54 0.00 0.00 175.26 176.68 2h4t s THR 414 N 0.67 4.77 0.38 -1.70 2.01 -1.26 -1.54 115.64 118.97 2h4t s THR 414 Ca 0.12 0.66 -0.26 0.00 0.31 0.00 0.00 61.69 62.52 2h4t s THR 414 Cb -0.13 -4.19 -0.09 0.00 0.01 0.00 0.00 72.50 68.11 2h4t s THR 414 CO 0.02 -0.46 1.19 -0.76 -0.69 0.00 0.00 174.62 173.93 2h4t s LEU 415 N 3.00 4.26 -0.01 4.42 1.43 0.10 -5.00 118.68 126.89 2h4t s LEU 415 Ca 0.28 2.41 0.07 0.00 -1.03 0.00 0.00 54.13 55.86 2h4t s LEU 415 Cb -0.13 -3.92 -0.02 0.00 0.03 0.00 0.00 46.19 42.15 2h4t s LEU 415 CO 0.17 -0.62 -0.22 -0.94 0.23 0.00 0.00 176.35 174.98 2h4t s SER 416 N -0.99 2.55 -0.09 2.29 1.04 -1.26 -4.57 113.70 112.66 2h4t s SER 416 Ca 0.55 -0.41 0.02 0.00 0.48 0.00 0.00 55.95 56.59 2h4t s SER 416 Cb -0.33 -0.27 -0.02 0.00 0.10 0.00 0.00 66.02 65.50 2h4t s SER 416 CO 0.42 0.26 -0.15 -0.36 0.98 0.00 0.00 173.24 174.38 2h4t s PHE 417 N -0.55 2.73 -0.51 5.02 0.08 -1.26 -4.91 117.98 118.59 2h4t s PHE 417 Ca 0.08 -0.49 -0.21 0.00 0.12 0.00 0.00 56.93 56.43 2h4t s PHE 417 Cb -0.08 -1.74 0.04 0.00 -0.57 0.00 0.00 43.02 40.67 2h4t s PHE 417 CO -0.00 -0.08 0.75 -0.80 -0.10 0.00 0.00 175.22 174.98 2h4t s ASN 418 N -0.09 6.29 -0.26 1.36 0.01 -1.26 -5.02 114.94 115.98 2h4t s ASN 418 Ca -0.03 -0.57 -0.09 0.00 -0.71 0.00 0.00 52.86 51.47 2h4t s ASN 418 Cb -0.14 -2.35 -0.04 0.00 0.41 0.00 0.00 41.25 39.13 2h4t s ASN 418 CO 0.04 -0.99 0.12 -0.76 -1.51 0.00 0.00 177.10 174.00 2h4t s LEU 419 N 3.15 3.72 0.89 0.60 1.43 -1.26 -4.92 118.68 122.29 2h4t s LEU 419 Ca 0.23 -0.10 -0.12 0.00 -1.03 0.00 0.00 54.13 53.11 2h4t s LEU 419 Cb -0.16 -2.01 0.17 0.00 0.03 0.00 0.00 46.19 44.22 2h4t s LEU 419 CO 0.16 -0.02 1.23 -0.94 0.23 0.00 0.00 176.35 177.01 2h4t s SER 420 N 1.56 3.59 0.28 2.29 1.04 -1.26 -4.82 113.70 116.38 2h4t s SER 420 Ca 0.06 0.23 -0.02 0.00 0.48 0.00 0.00 55.95 56.71 2h4t s SER 420 Cb -0.15 -0.42 0.40 0.00 0.10 0.00 0.00 66.02 65.95 2h4t s SER 420 CO 0.06 -2.42 1.85 1.23 0.98 0.00 0.00 173.24 174.95 2h4t h GLY 421 N -1.32 0.97 1.41 7.32 0.00 -1.99 -1.05 103.07 108.41 2h4t h GLY 421 Ca -0.43 -0.51 -0.08 0.00 0.00 0.00 0.00 47.33 46.31 2h4t h GLY 421 CO 0.43 0.48 -0.06 0.00 0.00 0.00 0.00 176.54 177.39 2h4t h ALA 422 N 1.36 1.11 -0.24 3.60 0.00 -1.98 -0.70 119.26 122.40 2h4t h ALA 422 Ca 0.21 -0.28 -0.17 0.00 0.00 0.00 0.00 54.91 54.67 2h4t h ALA 422 Cb 0.20 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2h4t h ALA 422 CO -0.02 0.56 -0.52 -0.07 0.00 0.00 0.00 179.25 179.21 2h4t h LEU 423 N 0.66 0.88 -0.79 0.00 -0.00 -1.79 0.30 115.31 114.56 2h4t h LEU 423 Ca 0.12 -0.55 -0.03 0.00 -0.00 0.00 0.00 57.88 57.42 2h4t h LEU 423 Cb 0.50 -0.25 -0.04 0.00 -0.00 0.00 0.00 40.66 40.87 2h4t h LEU 423 CO 0.03 1.26 0.37 0.11 -0.00 0.00 0.00 178.44 180.22 2h4t h LYS 424 N 0.52 1.15 -0.78 1.13 1.57 -0.98 0.17 116.57 119.35 2h4t h LYS 424 Ca 0.00 -0.17 -0.05 0.00 -1.87 0.00 0.00 60.65 58.56 2h4t h LYS 424 Cb 1.13 -0.20 -0.03 0.00 0.08 0.00 0.00 32.23 33.20 2h4t h LYS 424 CO 0.11 0.89 0.28 0.00 -0.57 0.00 0.00 179.45 180.17 2h4t h ALA 425 N 1.20 1.02 -0.49 3.86 0.00 -1.00 -0.93 119.26 122.91 2h4t h ALA 425 Ca 0.27 -0.21 -0.09 0.00 0.00 0.00 0.00 54.91 54.88 2h4t h ALA 425 Cb 0.13 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 2h4t h ALA 425 CO -0.03 0.67 -0.07 0.78 0.00 0.00 0.00 179.25 180.60 2h4t h GLY 426 N 1.14 0.94 1.11 0.00 0.00 -0.00 -0.87 103.07 105.40 2h4t h GLY 426 Ca 0.26 -0.69 -0.12 0.00 0.00 0.00 0.00 47.33 46.78 2h4t h GLY 426 CO -0.02 0.64 -0.12 -2.22 0.00 0.00 0.00 176.54 174.83 2h4t h ILE 427 N 0.79 1.27 -0.44 2.60 2.04 -0.31 0.10 117.51 123.57 2h4t h ILE 427 Ca 0.14 -1.28 -0.02 0.00 1.00 0.00 0.00 64.86 64.70 2h4t h ILE 427 Cb 0.57 0.97 -0.02 0.00 -0.74 0.00 0.00 36.82 37.60 2h4t h ILE 427 CO 0.03 0.45 0.19 0.74 0.00 0.00 0.00 178.15 179.56 2h4t h THR 428 N 0.92 1.20 -0.55 -0.27 2.02 -0.91 -0.75 112.91 114.56 2h4t h THR 428 Ca 0.14 -0.59 -0.09 0.00 0.77 0.00 0.00 66.41 66.65 2h4t h THR 428 Cb 0.69 0.77 -0.02 0.00 -1.74 0.00 0.00 68.15 67.84 2h4t h THR 428 CO 0.05 0.22 -0.01 0.00 0.37 0.00 0.00 175.52 176.15 2h4t h ALA 429 N 1.03 0.96 -0.70 6.16 0.00 -0.95 -1.86 119.26 123.90 2h4t h ALA 429 Ca 0.15 -0.29 -0.03 0.00 0.00 0.00 0.00 54.91 54.73 2h4t h ALA 429 Cb 0.17 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 2h4t h ALA 429 CO -0.01 0.63 0.31 0.00 0.00 0.00 0.00 179.25 180.18 2h4t h ALA 430 N 1.12 0.90 -0.36 0.00 0.00 -0.67 -1.88 119.26 118.37 2h4t h ALA 430 Ca 0.16 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 2h4t h ALA 430 Cb 0.52 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 2h4t h ALA 430 CO 0.03 0.49 0.15 -0.22 0.00 0.00 0.00 179.25 179.70 2h4t h LYS 431 N 0.98 0.53 -0.74 0.00 3.64 -0.83 -0.32 116.57 119.84 2h4t h LYS 431 Ca 0.24 -0.09 0.01 0.00 -1.27 0.00 0.00 60.65 59.53 2h4t h LYS 431 Cb 0.16 -0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 31.85 2h4t h LYS 431 CO -0.03 0.51 0.49 0.93 -2.27 0.00 0.00 179.45 179.09 2h4t h GLU 432 N 0.43 0.96 -0.26 1.90 5.08 -1.12 0.11 114.58 121.68 2h4t h GLU 432 Ca 0.12 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.40 2h4t h GLU 432 Cb 0.18 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.20 2h4t h GLU 432 CO -0.01 0.64 0.09 -0.22 -1.00 0.00 0.00 179.01 178.50 2h4t h LYS 433 N 0.99 0.41 0.22 2.33 3.64 -1.15 -1.00 116.57 122.02 2h4t h LYS 433 Ca 0.27 -0.09 -0.01 0.00 -1.27 0.00 0.00 60.65 59.56 2h4t h LYS 433 Cb -0.10 -0.06 -0.00 0.00 -0.41 0.00 0.00 32.23 31.66 2h4t h LYS 433 CO -0.07 0.47 -0.12 0.35 -2.27 0.00 0.00 179.45 177.81 2h4t h PHE 434 N 0.26 -0.32 -0.66 1.91 3.57 -0.66 -1.99 116.94 119.05 2h4t h PHE 434 Ca 0.09 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.55 2h4t h PHE 434 Cb 0.23 0.11 -0.03 0.00 2.79 0.00 0.00 35.95 39.05 2h4t h PHE 434 CO 0.00 -0.20 0.28 -0.44 -2.23 0.00 0.00 178.31 175.72 2h4t h ASP 435 N -0.33 0.88 -0.42 0.41 3.32 -0.76 -0.29 116.42 119.24 2h4t h ASP 435 Ca -0.02 -0.12 -0.02 0.00 0.02 0.00 0.00 57.03 56.89 2h4t h ASP 435 Cb 0.26 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.57 2h4t h ASP 435 CO 0.03 0.78 0.19 0.74 -1.72 0.00 0.00 179.24 179.26 2h4t h THR 436 N 0.95 1.19 0.02 0.35 2.02 -1.01 -2.11 112.91 114.32 2h4t h THR 436 Ca 0.23 -0.56 -0.00 0.00 0.77 0.00 0.00 66.41 66.84 2h4t h THR 436 Cb 0.17 0.78 0.00 0.00 -1.74 0.00 0.00 68.15 67.35 2h4t h THR 436 CO -0.02 0.21 -0.01 0.74 0.37 0.00 0.00 175.52 176.81 2h4t h THR 437 N 0.54 1.43 -0.54 3.16 2.02 -1.14 -3.27 112.91 115.11 2h4t h THR 437 Ca 0.14 -1.39 0.12 0.00 0.77 0.00 0.00 66.41 66.06 2h4t h THR 437 Cb 0.16 2.36 -0.03 0.00 -1.74 0.00 0.00 68.15 68.89 2h4t h THR 437 CO -0.01 0.35 0.37 0.58 0.37 0.00 0.00 175.52 177.18 2h4t h VAL 438 N -0.62 0.83 0.00 3.16 2.07 -1.07 -1.04 116.25 119.57 2h4t h VAL 438 Ca -0.00 -0.07 0.00 0.00 0.82 0.00 0.00 66.70 67.45 2h4t h VAL 438 Cb 0.60 0.60 0.00 0.00 -1.52 0.00 0.00 31.29 30.96 2h4t h VAL 438 CO 0.00 0.04 0.00 1.17 0.02 0.00 0.00 177.57 178.80 2h4t n LYS 439 N -4.44 0.05 0.00 1.57 4.81 -0.80 -2.15 118.16 117.20 2h4t n LYS 439 Ca 0.09 0.26 0.12 0.00 -0.87 0.00 0.00 58.31 57.91 2h4t n LYS 439 Cb 0.46 -1.59 0.16 0.00 0.02 0.00 0.00 35.03 34.09 2h4t n LYS 439 CO 0.00 0.00 0.00 0.25 1.17 0.00 0.00 177.40 178.82 2h4t n THR 440 N -1.67 0.00 -3.27 3.15 -2.24 -0.40 -4.93 114.28 104.92 2h4t n THR 440 Ca 0.04 -0.18 -0.38 0.00 -2.27 0.00 0.00 64.05 61.25 2h4t n THR 440 Cb 0.21 0.84 -0.06 0.00 -2.10 0.00 0.00 70.33 69.22 2h4t n THR 440 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 2h4t s LEU 441 N -2.53 4.34 0.04 3.22 2.96 -0.91 -2.16 118.68 123.64 2h4t s LEU 441 Ca 0.20 0.97 0.07 0.00 -0.22 0.00 0.00 54.13 55.15 2h4t s LEU 441 Cb 0.18 -2.79 -0.02 0.00 0.50 0.00 0.00 46.19 44.06 2h4t s LEU 441 CO 0.57 0.06 -0.19 -0.44 -1.32 0.00 0.00 176.35 175.02 2h4t s SER 442 N 0.21 2.24 -0.02 3.68 0.01 -0.13 -5.00 113.70 114.70 2h4t s SER 442 Ca 0.28 -0.48 -0.03 0.00 1.31 0.00 0.00 55.95 57.03 2h4t s SER 442 Cb -0.16 -0.19 0.00 0.00 0.21 0.00 0.00 66.02 65.88 2h4t s SER 442 CO 0.13 0.14 0.07 -0.63 0.41 0.00 0.00 173.24 173.36 2h4t s ILE 443 N -0.76 0.03 0.21 1.44 1.01 -1.26 -1.19 121.20 120.67 2h4t s ILE 443 Ca 0.06 -0.21 -0.21 0.00 0.00 0.00 0.00 60.65 60.29 2h4t s ILE 443 Cb -0.08 -0.17 0.04 0.00 0.01 0.00 0.00 42.46 42.26 2h4t s ILE 443 CO 0.01 -0.11 0.62 -0.62 0.00 0.00 0.00 174.94 174.84 2h4t s ASP 444 N -0.33 -0.39 0.21 3.58 2.15 -0.63 -4.83 116.67 116.42 2h4t s ASP 444 Ca -0.04 -0.33 0.00 0.00 0.43 0.00 0.00 52.55 52.61 2h4t s ASP 444 Cb -0.03 0.64 -0.04 0.00 -0.30 0.00 0.00 42.92 43.19 2h4t s ASP 444 CO 0.00 -1.13 0.09 -0.94 -0.17 0.00 0.00 175.17 173.03 2h4t s SER 445 N -2.84 0.66 0.04 -0.34 1.04 -1.26 -0.55 113.70 110.45 2h4t s SER 445 Ca 0.07 -1.34 -0.03 0.00 0.48 0.00 0.00 55.95 55.12 2h4t s SER 445 Cb -0.03 0.26 -0.02 0.00 0.10 0.00 0.00 66.02 66.34 2h4t s SER 445 CO -0.03 -0.76 0.04 0.27 0.98 0.00 0.00 173.24 173.74 2h4t s ILE 446 N -3.95 0.15 -0.34 -1.02 -4.36 -0.66 -5.00 121.20 106.02 2h4t s ILE 446 Ca 0.35 -1.22 -0.00 0.00 -0.26 0.00 0.00 60.65 59.51 2h4t s ILE 446 Cb 0.07 -0.92 0.11 0.00 1.25 0.00 0.00 42.46 42.97 2h4t s ILE 446 CO 0.10 -0.67 0.14 -1.10 0.24 0.00 0.00 174.94 173.65 2h4t s GLN 447 N -2.71 0.80 -0.44 0.37 -0.21 -1.26 -2.24 119.66 113.97 2h4t s GLN 447 Ca -0.04 -1.29 -0.29 0.00 0.02 0.00 0.00 55.36 53.76 2h4t s GLN 447 Cb -0.01 -1.96 0.01 0.00 1.00 0.00 0.00 33.01 32.06 2h4t s GLN 447 CO -0.05 -1.05 1.39 0.12 -2.12 0.00 0.00 175.29 173.58 2h4t s PHE 448 N 1.29 2.41 -2.92 0.91 5.36 0.35 -4.87 117.98 120.51 2h4t s PHE 448 Ca 0.12 0.65 0.24 0.00 -0.96 0.00 0.00 56.93 56.99 2h4t s PHE 448 Cb -0.19 -4.33 0.31 0.00 -0.34 0.00 0.00 43.02 38.46 2h4t s PHE 448 CO -0.17 -1.93 1.33 1.04 -1.46 0.00 0.00 175.22 174.02 2h4t n GLN 449 N 8.14 2.25 0.20 10.12 6.02 -1.26 -1.10 117.38 141.75 2h4t n GLN 449 Ca 0.16 -1.82 0.05 0.00 -0.01 0.00 0.00 57.00 55.37 2h4t n GLN 449 Cb 0.48 -1.46 0.41 0.00 1.02 0.00 0.00 30.24 30.69 2h4t n GLN 449 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 177.06 175.96 2h4t h ARG 450 N 4.40 0.00 0.00 -1.09 2.43 -1.90 -3.45 114.38 114.78 2h4t h ARG 450 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2h4t h ARG 450 Cb 0.94 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.49 2h4t h ARG 450 CO 0.00 0.33 0.00 0.41 -1.51 0.00 0.00 179.97 179.20 2h4t n GLY 451 N -0.39 -0.58 0.00 2.80 0.00 -1.18 -5.00 105.19 100.84 2h4t n GLY 451 Ca -0.02 -1.05 0.00 0.00 0.00 0.00 0.00 46.02 44.95 2h4t n GLY 451 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2h4t n GLY 452 N -0.29 3.81 0.21 -0.02 0.00 -1.22 -3.34 105.19 104.33 2h4t n GLY 452 Ca 0.00 -0.23 -0.02 0.00 0.00 0.00 0.00 46.02 45.77 2h4t n GLY 452 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2h4t h LYS 453 N 0.00 0.27 -0.06 1.61 3.64 -0.23 -2.48 116.57 119.32 2h4t h LYS 453 Ca 0.00 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 2h4t h LYS 453 Cb 0.00 -0.06 -0.00 0.00 -0.41 0.00 0.00 32.23 31.76 2h4t h LYS 453 CO 0.00 0.18 0.04 0.93 -2.27 0.00 0.00 179.45 178.32 2h4t h GLU 454 N 0.27 0.07 0.06 1.90 5.08 -1.74 0.13 114.58 120.36 2h4t h GLU 454 Ca 0.26 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.61 2h4t h GLU 454 Cb 0.34 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.57 2h4t h GLU 454 CO -0.32 0.06 -0.03 0.35 -1.00 0.00 0.00 179.01 178.08 2h4t h PHE 455 N 0.07 -0.07 -0.70 4.33 3.57 -1.77 -2.36 116.94 120.00 2h4t h PHE 455 Ca 0.02 -0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.48 2h4t h PHE 455 Cb 0.00 0.02 -0.03 0.00 2.79 0.00 0.00 35.95 38.74 2h4t h PHE 455 CO -0.07 -0.02 0.28 -0.07 -2.23 0.00 0.00 178.31 176.19 2h4t h LEU 456 N -0.10 0.95 -1.28 0.59 3.38 -1.36 -2.37 115.31 115.12 2h4t h LEU 456 Ca -0.01 -0.14 -0.07 0.00 0.09 0.00 0.00 57.88 57.75 2h4t h LEU 456 Cb 0.08 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 2h4t h LEU 456 CO 0.01 0.85 -0.32 0.11 0.09 0.00 0.00 178.44 179.18 2h4t h LYS 457 N 1.01 0.07 0.00 1.13 1.57 -0.62 -1.46 116.57 118.27 2h4t h LYS 457 Ca 0.24 -0.02 -0.06 0.00 -1.87 0.00 0.00 60.65 58.93 2h4t h LYS 457 Cb 0.20 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.49 2h4t h LYS 457 CO -0.02 0.38 -0.31 0.87 -0.57 0.00 0.00 179.45 179.81 2h4t h LYS 458 N 0.06 0.00 -0.47 3.15 1.57 -0.92 -2.06 116.57 117.90 2h4t h LYS 458 Ca 0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 2h4t h LYS 458 Cb 0.60 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.91 2h4t h LYS 458 CO 0.04 0.31 0.00 1.63 -0.57 0.00 0.00 179.45 180.86 2h4t n LYS 459 N -3.50 2.10 -3.36 3.15 4.76 -0.64 -4.91 118.16 115.77 2h4t n LYS 459 Ca -0.00 -1.33 -0.23 0.00 -2.87 0.00 0.00 58.31 53.88 2h4t n LYS 459 Cb 0.47 -1.43 0.06 0.00 -1.84 0.00 0.00 35.03 32.28 2h4t n LYS 459 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 2h4t n GLN 460 N 0.47 -6.71 -4.33 1.97 1.13 -0.77 -5.01 117.38 104.13 2h4t n GLN 460 Ca 0.12 0.87 -0.25 0.00 -1.94 0.00 0.00 57.00 55.80 2h4t n GLN 460 Cb 0.41 -5.85 -0.13 0.00 0.11 0.00 0.00 30.24 24.78 2h4t n GLN 460 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 2h4t s LEU 461 N -7.06 2.29 -0.15 1.08 1.43 -0.68 -5.01 118.68 110.58 2h4t s LEU 461 Ca 0.47 -0.68 -0.29 0.00 -1.03 0.00 0.00 54.13 52.60 2h4t s LEU 461 Cb -0.21 -0.94 -0.01 0.00 0.03 0.00 0.00 46.19 45.07 2h4t s LEU 461 CO 0.58 0.08 1.10 -0.55 0.23 0.00 0.00 176.35 177.79 2h4t s SER 462 N -1.87 7.11 0.42 2.29 0.15 -1.26 -3.99 113.70 116.55 2h4t s SER 462 Ca 0.07 1.55 0.10 0.00 0.70 0.00 0.00 55.95 58.38 2h4t s SER 462 Cb -0.10 -2.55 0.91 0.00 -1.71 0.00 0.00 66.02 62.58 2h4t s SER 462 CO 0.04 -0.61 2.01 1.55 1.20 0.00 0.00 173.24 177.44 2h4t h PRO 463 N 7.48 0.27 -0.56 5.44 0.13 -1.91 -1.88 132.00 140.97 2h4t h PRO 463 Ca -0.26 -0.04 -0.08 0.00 -0.87 0.00 0.00 66.00 64.75 2h4t h PRO 463 Cb 1.11 -0.05 -0.02 0.00 0.13 0.00 0.00 31.00 32.17 2h4t h PRO 463 CO 0.92 0.29 0.05 0.22 -0.23 0.00 0.00 178.00 179.26 2h4t h ASP 464 N 0.27 0.92 -0.82 1.44 3.58 -1.99 -1.64 116.42 118.18 2h4t h ASP 464 Ca 0.07 -0.28 -0.02 0.00 0.42 0.00 0.00 57.03 57.21 2h4t h ASP 464 Cb 0.16 -0.25 -0.04 0.00 1.72 0.00 0.00 39.33 40.93 2h4t h ASP 464 CO 0.00 0.97 0.42 0.00 -2.88 0.00 0.00 179.24 177.75 2h4t h ALA 465 N 0.98 1.05 -0.66 -0.78 0.00 -1.81 -1.69 119.26 116.36 2h4t h ALA 465 Ca 0.16 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 2h4t h ALA 465 Cb 0.47 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 2h4t h ALA 465 CO 0.02 0.59 0.21 0.28 0.00 0.00 0.00 179.25 180.35 2h4t h VAL 466 N 1.15 1.25 -0.56 0.00 2.07 -1.03 0.24 116.25 119.37 2h4t h VAL 466 Ca 0.28 -0.85 -0.04 0.00 0.82 0.00 0.00 66.70 66.91 2h4t h VAL 466 Cb 0.08 0.56 -0.02 0.00 -1.52 0.00 0.00 31.29 30.39 2h4t h VAL 466 CO -0.04 0.33 0.18 0.00 0.02 0.00 0.00 177.57 178.06 2h4t h ALA 467 N 1.08 0.73 -0.49 1.67 0.00 -0.99 -1.01 119.26 120.26 2h4t h ALA 467 Ca 0.21 -0.19 -0.09 0.00 0.00 0.00 0.00 54.91 54.84 2h4t h ALA 467 Cb 0.29 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 2h4t h ALA 467 CO -0.01 0.39 -0.06 1.96 0.00 0.00 0.00 179.25 181.54 2h4t h GLN 468 N 0.78 0.85 -0.72 0.00 1.08 -1.03 -2.22 115.11 113.85 2h4t h GLN 468 Ca 0.18 -0.26 -0.03 0.00 -1.45 0.00 0.00 58.65 57.09 2h4t h GLN 468 Cb 0.27 -0.08 -0.03 0.00 -0.05 0.00 0.00 27.48 27.59 2h4t h GLN 468 CO -0.01 0.88 0.35 1.25 -0.95 0.00 0.00 178.83 180.36 2h4t h LEU 469 N 0.78 0.94 -0.81 1.46 5.85 -0.60 -1.79 115.31 121.13 2h4t h LEU 469 Ca 0.14 -0.13 0.02 0.00 0.84 0.00 0.00 57.88 58.74 2h4t h LEU 469 Cb 0.54 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 41.29 2h4t h LEU 469 CO 0.03 0.81 0.53 0.00 -0.34 0.00 0.00 178.44 179.47 2h4t h ALA 470 N 1.17 1.04 -0.49 1.25 0.00 -0.77 0.12 119.26 121.58 2h4t h ALA 470 Ca 0.25 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.09 2h4t h ALA 470 Cb 0.11 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 2h4t h ALA 470 CO -0.03 0.41 0.24 0.74 0.00 0.00 0.00 179.25 180.61 2h4t h PHE 471 N 1.08 0.70 -0.25 0.00 0.05 -0.93 0.35 116.94 117.94 2h4t h PHE 471 Ca 0.31 -0.03 -0.01 0.00 3.82 0.00 0.00 57.97 62.06 2h4t h PHE 471 Cb -0.09 -0.22 -0.01 0.00 2.00 0.00 0.00 35.95 37.63 2h4t h PHE 471 CO -0.02 0.55 0.12 1.96 -0.18 0.00 0.00 178.31 180.75 2h4t h GLN 472 N 0.65 0.36 -0.57 1.51 1.08 -0.81 -1.16 115.11 116.16 2h4t h GLN 472 Ca 0.17 -0.05 -0.05 0.00 -1.45 0.00 0.00 58.65 57.27 2h4t h GLN 472 Cb 0.11 -0.07 -0.02 0.00 -0.05 0.00 0.00 27.48 27.45 2h4t h GLN 472 CO -0.02 0.35 0.17 1.98 -0.95 0.00 0.00 178.83 180.36 2h4t h MET 473 N 0.28 0.90 -0.73 1.46 4.05 -0.53 -1.90 114.93 118.45 2h4t h MET 473 Ca 0.09 -0.20 -0.05 0.00 -0.28 0.00 0.00 59.70 59.26 2h4t h MET 473 Cb 0.11 -0.13 -0.03 0.00 -0.80 0.00 0.00 31.60 30.75 2h4t h MET 473 CO -0.01 0.81 0.26 0.00 0.23 0.00 0.00 176.91 178.20 2h4t h ALA 474 N 1.04 0.95 -0.64 0.39 0.00 -0.13 -1.54 119.26 119.33 2h4t h ALA 474 Ca 0.18 -0.21 -0.09 0.00 0.00 0.00 0.00 54.91 54.80 2h4t h ALA 474 Cb 0.30 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2h4t h ALA 474 CO -0.00 0.60 0.05 0.35 0.00 0.00 0.00 179.25 180.25 2h4t h PHE 475 N 1.06 1.18 -0.56 0.00 3.57 -1.03 -0.68 116.94 120.47 2h4t h PHE 475 Ca 0.24 -0.18 -0.04 0.00 3.53 0.00 0.00 57.97 61.51 2h4t h PHE 475 Cb 0.26 -0.31 -0.02 0.00 2.79 0.00 0.00 35.95 38.66 2h4t h PHE 475 CO 0.02 1.01 0.20 1.25 -2.23 0.00 0.00 178.31 178.56 2h4t h LEU 476 N 1.00 0.80 -0.65 0.59 5.85 -1.07 0.29 115.31 122.13 2h4t h LEU 476 Ca 0.19 -0.19 -0.10 0.00 0.84 0.00 0.00 57.88 58.61 2h4t h LEU 476 Cb 0.51 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.31 2h4t h LEU 476 CO 0.02 0.77 -0.08 -0.09 -0.34 0.00 0.00 178.44 178.73 2h4t h ARG 477 N 0.78 0.98 0.21 1.25 2.43 -1.08 0.48 114.38 119.42 2h4t h ARG 477 Ca 0.18 -0.34 -0.32 0.00 -0.81 0.00 0.00 59.98 58.70 2h4t h ARG 477 Cb 0.24 -0.08 0.04 0.00 -0.42 0.00 0.00 29.97 29.75 2h4t h ARG 477 CO -0.01 1.01 -1.37 0.37 -1.51 0.00 0.00 179.97 178.46 2h4t h GLN 478 N 0.88 0.56 -0.00 0.20 4.15 -0.90 -3.39 115.11 116.60 2h4t h GLN 478 Ca 0.15 -0.88 0.00 0.00 0.77 0.00 0.00 58.65 58.69 2h4t h GLN 478 Cb 0.62 0.32 0.00 0.00 0.21 0.00 0.00 27.48 28.63 2h4t h GLN 478 CO 0.04 1.41 -0.00 0.66 -1.93 0.00 0.00 178.83 179.01 2h4t n TYR 479 N -3.77 0.00 -2.62 3.99 4.02 0.10 -5.03 117.16 113.84 2h4t n TYR 479 Ca -0.16 0.00 -0.17 0.00 -0.01 0.00 0.00 57.90 57.57 2h4t n TYR 479 Cb 1.05 0.00 0.01 0.00 -0.02 0.00 0.00 39.34 40.38 2h4t n TYR 479 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2h4t n GLY 480 N 0.40 -0.26 3.52 2.72 0.00 0.17 -4.99 105.19 106.75 2h4t n GLY 480 Ca 0.00 -0.14 -0.09 0.00 0.00 0.00 0.00 46.02 45.79 2h4t n GLY 480 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2h4t s GLN 481 N -5.17 1.45 -0.16 1.61 -2.07 -1.26 -5.00 119.66 109.07 2h4t s GLN 481 Ca 0.14 -1.24 -0.02 0.00 -1.82 0.00 0.00 55.36 52.42 2h4t s GLN 481 Cb -0.06 0.45 -0.02 0.00 -1.09 0.00 0.00 33.01 32.29 2h4t s GLN 481 CO 0.17 -0.59 -0.08 0.99 -1.32 0.00 0.00 175.29 174.46 2h4t s THR 482 N -4.01 3.36 0.30 3.63 2.01 -1.26 -3.82 115.64 115.85 2h4t s THR 482 Ca 0.22 -0.54 0.04 0.00 0.31 0.00 0.00 61.69 61.72 2h4t s THR 482 Cb 0.00 -2.46 -0.06 0.00 0.01 0.00 0.00 72.50 70.00 2h4t s THR 482 CO 0.07 0.49 0.03 0.68 -0.69 0.00 0.00 174.62 175.20 2h4t s VAL 483 N 0.62 1.23 0.18 3.82 -7.23 -1.26 -4.86 120.40 112.91 2h4t s VAL 483 Ca -0.05 -2.03 -0.33 0.00 -1.81 0.00 0.00 61.98 57.76 2h4t s VAL 483 Cb -0.15 -2.65 -0.13 0.00 0.56 0.00 0.00 36.38 34.01 2h4t s VAL 483 CO 0.03 -0.11 1.64 0.00 -0.31 0.00 0.00 175.10 176.34 2h4t n ALA 484 N -0.61 2.02 -2.62 1.32 0.00 -1.26 -4.88 120.51 114.47 2h4t n ALA 484 Ca -0.03 0.43 -0.22 0.00 0.00 0.00 0.00 53.44 53.61 2h4t n ALA 484 Cb 0.65 -2.43 -0.15 0.00 0.00 0.00 0.00 19.45 17.53 2h4t n ALA 484 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2h4t s THR 485 N 1.01 1.09 -0.05 0.00 2.01 -1.26 -2.28 115.64 116.17 2h4t s THR 485 Ca 0.77 -0.58 0.04 0.00 0.31 0.00 0.00 61.69 62.22 2h4t s THR 485 Cb -0.60 -0.92 0.00 0.00 0.01 0.00 0.00 72.50 70.99 2h4t s THR 485 CO 0.35 0.31 -0.15 -0.47 -0.69 0.00 0.00 174.62 173.97 2h4t s TYR 486 N -0.27 1.58 -0.08 4.92 5.04 0.63 -4.43 117.35 124.75 2h4t s TYR 486 Ca 0.04 -0.48 0.01 0.00 -2.44 0.00 0.00 57.07 54.20 2h4t s TYR 486 Cb -0.06 -1.08 0.02 0.00 0.35 0.00 0.00 41.96 41.19 2h4t s TYR 486 CO -0.00 -0.18 -0.07 -2.00 -1.34 0.00 0.00 175.55 171.96 2h4t s GLU 487 N 0.18 1.27 0.38 4.97 2.12 -0.77 -0.09 118.70 126.75 2h4t s GLU 487 Ca -0.06 -0.21 -0.26 0.00 0.36 0.00 0.00 54.97 54.80 2h4t s GLU 487 Cb -0.12 -1.26 -0.09 0.00 0.26 0.00 0.00 34.13 32.93 2h4t s GLU 487 CO 0.02 -0.14 1.14 0.45 -0.54 0.00 0.00 175.26 176.20 2h4t s SER 488 N 1.25 6.70 -0.05 -1.70 0.15 -0.93 -0.91 113.70 118.20 2h4t s SER 488 Ca -0.05 2.30 -0.11 0.00 0.70 0.00 0.00 55.95 58.79 2h4t s SER 488 Cb -0.14 -2.61 0.02 0.00 -1.71 0.00 0.00 66.02 61.58 2h4t s SER 488 CO -0.02 -0.55 0.27 0.00 1.20 0.00 0.00 173.24 174.14 2h4t s SER 490 N -0.71 6.47 -0.28 0.00 0.15 -1.26 -0.40 113.70 117.67 2h4t s SER 490 Ca -0.08 0.56 0.10 0.00 0.70 0.00 0.00 55.95 57.22 2h4t s SER 490 Cb -0.04 -2.14 0.50 0.00 -1.71 0.00 0.00 66.02 62.63 2h4t s SER 490 CO 0.02 0.29 1.44 0.35 1.20 0.00 0.00 173.24 176.54 2h4t n THR 491 N 2.51 2.51 0.82 6.45 -2.24 -0.45 -4.58 114.28 119.30 2h4t n THR 491 Ca -0.16 -2.73 0.07 0.00 -2.27 0.00 0.00 64.05 58.96 2h4t n THR 491 Cb 0.53 -0.31 0.39 0.00 -2.10 0.00 0.00 70.33 68.85 2h4t n THR 491 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2h4t n ALA 492 N -1.09 1.98 0.78 6.98 0.00 -1.24 -2.11 120.51 125.81 2h4t n ALA 492 Ca 0.31 -0.08 0.12 0.00 0.00 0.00 0.00 53.44 53.79 2h4t n ALA 492 Cb 1.00 -1.22 0.50 0.00 0.00 0.00 0.00 19.45 19.73 2h4t n ALA 492 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2h4t n ALA 493 N -1.03 2.08 -2.62 0.00 0.00 -1.26 -0.23 120.51 117.46 2h4t n ALA 493 Ca 0.10 -0.07 -0.23 0.00 0.00 0.00 0.00 53.44 53.24 2h4t n ALA 493 Cb 0.05 -1.39 -0.06 0.00 0.00 0.00 0.00 19.45 18.05 2h4t n ALA 493 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2h4t s PHE 494 N -3.02 2.80 0.11 0.00 0.40 -0.89 -4.37 117.98 113.00 2h4t s PHE 494 Ca 0.11 -0.27 -0.31 0.00 -0.60 0.00 0.00 56.93 55.86 2h4t s PHE 494 Cb 0.15 -1.46 -0.11 0.00 0.51 0.00 0.00 43.02 42.11 2h4t s PHE 494 CO 0.44 0.45 1.85 1.17 0.70 0.00 0.00 175.22 179.83 2h4t n LYS 495 N -1.09 2.77 -3.40 0.44 3.00 0.12 -0.84 118.16 119.16 2h4t n LYS 495 Ca -0.05 1.01 -0.24 0.00 -0.00 0.00 0.00 58.31 59.03 2h4t n LYS 495 Cb 0.60 -2.91 0.01 0.00 0.00 0.00 0.00 35.03 32.73 2h4t n LYS 495 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.40 178.12 2h4t n HIS 496 N 5.82 -1.90 -1.95 5.64 8.25 -1.26 -4.01 115.22 125.80 2h4t n HIS 496 Ca 0.18 0.55 -0.34 0.00 -0.26 0.00 0.00 57.72 57.86 2h4t n HIS 496 Cb 0.37 -3.39 0.03 0.00 1.12 0.00 0.00 29.99 28.12 2h4t n HIS 496 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 2h4t s GLY 497 N -2.82 2.32 0.00 -1.41 0.00 -0.02 -4.46 107.32 100.93 2h4t s GLY 497 Ca 0.43 0.63 0.00 0.00 0.00 0.00 0.00 44.72 45.78 2h4t s GLY 497 CO 0.53 0.98 0.00 0.54 0.00 0.00 0.00 173.10 175.15 2h4t n ARG 498 N -2.00 0.00 -4.18 2.90 5.12 -1.25 -4.50 116.66 112.75 2h4t n ARG 498 Ca 0.11 0.00 -0.11 0.00 -1.93 0.00 0.00 57.85 55.92 2h4t n ARG 498 Cb 0.52 0.00 -0.10 0.00 -1.16 0.00 0.00 32.46 31.72 2h4t n ARG 498 CO 0.00 0.00 0.00 0.95 -1.93 0.00 0.00 177.63 176.65 2h4t s THR 499 N 2.15 0.62 0.07 0.55 -4.23 -1.26 -1.34 115.64 112.19 2h4t s THR 499 Ca 0.00 -1.93 0.02 0.00 -1.18 0.00 0.00 61.69 58.59 2h4t s THR 499 Cb 0.00 -1.78 -0.03 0.00 1.34 0.00 0.00 72.50 72.02 2h4t s THR 499 CO 0.00 -0.78 -0.07 -0.70 -0.54 0.00 0.00 174.62 172.54 2h4t s GLU 500 N -3.87 0.65 -0.19 3.99 2.56 0.47 -4.78 118.70 117.54 2h4t s GLU 500 Ca 0.15 -1.02 -0.17 0.00 0.00 0.00 0.00 54.97 53.92 2h4t s GLU 500 Cb 0.06 -0.21 -0.04 0.00 2.00 0.00 0.00 34.13 35.94 2h4t s GLU 500 CO -0.03 0.01 0.46 0.99 -0.56 0.00 0.00 175.26 176.13 2h4t s THR 501 N -2.46 5.16 -0.12 -1.70 2.01 -1.26 -2.15 115.64 115.12 2h4t s THR 501 Ca -0.00 0.85 -0.15 0.00 0.31 0.00 0.00 61.69 62.69 2h4t s THR 501 Cb -0.03 -3.79 -0.05 0.00 0.01 0.00 0.00 72.50 68.65 2h4t s THR 501 CO -0.02 0.23 0.38 -0.63 -0.69 0.00 0.00 174.62 173.88 2h4t s ILE 502 N 1.35 5.22 -0.71 1.82 1.01 -0.09 -4.73 121.20 125.07 2h4t s ILE 502 Ca 0.22 0.74 -0.11 0.00 0.00 0.00 0.00 60.65 61.51 2h4t s ILE 502 Cb -0.15 -3.71 0.18 0.00 0.01 0.00 0.00 42.46 38.79 2h4t s ILE 502 CO 0.09 0.40 0.61 -0.13 0.00 0.00 0.00 174.94 175.91 2h4t s ARG 503 N 0.23 3.14 0.32 2.79 1.81 -1.26 -1.85 118.95 124.13 2h4t s ARG 503 Ca 0.21 -2.34 0.26 0.00 -1.72 0.00 0.00 55.73 52.15 2h4t s ARG 503 Cb -0.14 -4.17 0.98 0.00 -0.45 0.00 0.00 34.95 31.16 2h4t s ARG 503 CO 0.08 -1.25 1.78 -1.00 -0.68 0.00 0.00 175.30 174.22 2h4t h PRO 504 N 7.75 0.00 -6.53 3.54 0.13 -1.94 -3.41 132.00 131.54 2h4t h PRO 504 Ca 0.00 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.56 2h4t h PRO 504 Cb 1.03 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 32.07 2h4t h PRO 504 CO 0.78 0.00 0.81 0.00 -0.23 0.00 0.00 178.00 179.37 2h4t s ALA 505 N -3.34 3.17 0.38 -0.56 0.00 -1.26 -4.78 121.76 115.37 2h4t s ALA 505 Ca 0.05 -0.60 0.04 0.00 0.00 0.00 0.00 51.96 51.45 2h4t s ALA 505 Cb 0.10 -3.82 -0.04 0.00 0.00 0.00 0.00 23.12 19.35 2h4t s ALA 505 CO 0.49 -2.21 0.08 -1.54 0.00 0.00 0.00 175.76 172.58 2h4t s SER 506 N 2.42 2.79 0.49 0.00 1.04 -1.26 -4.85 113.70 114.32 2h4t s SER 506 Ca 0.44 -1.52 0.17 0.00 0.48 0.00 0.00 55.95 55.51 2h4t s SER 506 Cb -0.08 0.20 1.18 0.00 0.10 0.00 0.00 66.02 67.43 2h4t s SER 506 CO 0.30 -0.76 2.06 0.40 0.98 0.00 0.00 173.24 176.22 2h4t h ILE 507 N 1.89 0.92 -0.04 -1.02 5.03 -1.94 -0.93 117.51 121.42 2h4t h ILE 507 Ca -0.39 -0.06 -0.03 0.00 -0.12 0.00 0.00 64.86 64.26 2h4t h ILE 507 Cb 1.26 0.72 0.00 0.00 -3.03 0.00 0.00 36.82 35.78 2h4t h ILE 507 CO 0.66 0.03 -0.07 -0.26 -0.68 0.00 0.00 178.15 177.82 2h4t h PHE 508 N 0.18 0.15 -0.04 1.37 -1.00 -1.95 -1.18 116.94 114.48 2h4t h PHE 508 Ca 0.15 -0.05 -0.08 0.00 2.81 0.00 0.00 57.97 60.80 2h4t h PHE 508 Cb 0.38 -0.03 -0.01 0.00 3.61 0.00 0.00 35.95 39.90 2h4t h PHE 508 CO -0.00 0.66 -0.37 1.79 -1.61 0.00 0.00 178.31 178.78 2h4t h THR 509 N -0.40 1.28 -0.18 -1.55 1.35 -1.78 0.97 112.91 112.60 2h4t h THR 509 Ca 0.00 -1.33 -0.05 0.00 -0.55 0.00 0.00 66.41 64.48 2h4t h THR 509 Cb 0.65 1.66 -0.00 0.00 -1.73 0.00 0.00 68.15 68.73 2h4t h THR 509 CO 0.02 0.39 -0.10 0.50 -0.25 0.00 0.00 175.52 176.07 2h4t h LYS 510 N 0.07 0.38 -0.38 4.72 3.64 -1.17 -0.01 116.57 123.83 2h4t h LYS 510 Ca 0.01 -0.18 -0.02 0.00 -1.27 0.00 0.00 60.65 59.19 2h4t h LYS 510 Cb 0.69 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.49 2h4t h LYS 510 CO 0.05 0.70 0.15 -0.09 -2.27 0.00 0.00 179.45 177.99 2h4t h ARG 511 N 0.06 0.57 -0.58 1.90 2.43 -0.93 -1.19 114.38 116.63 2h4t h ARG 511 Ca 0.04 -0.10 -0.07 0.00 -0.81 0.00 0.00 59.98 59.03 2h4t h ARG 511 Cb 0.60 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 30.03 2h4t h ARG 511 CO 0.03 0.55 0.10 0.00 -1.51 0.00 0.00 179.97 179.13 2h4t h SER 513 N 0.86 0.62 -0.78 0.00 0.02 -0.82 -2.04 113.55 111.41 2h4t h SER 513 Ca 0.18 -0.16 0.01 0.00 -0.84 0.00 0.00 61.79 60.97 2h4t h SER 513 Cb 0.42 -0.16 -0.04 0.00 0.14 0.00 0.00 62.40 62.76 2h4t h SER 513 CO 0.01 0.62 0.51 -0.33 -1.14 0.00 0.00 176.83 176.50 2h4t h GLU 514 N 0.59 1.03 -0.24 3.45 5.08 -1.06 0.26 114.58 123.69 2h4t h GLU 514 Ca 0.15 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.43 2h4t h GLU 514 Cb 0.19 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.20 2h4t h GLU 514 CO -0.01 0.68 0.09 0.00 -1.00 0.00 0.00 179.01 178.77 2h4t h ALA 515 N 1.51 0.31 -0.27 3.43 0.00 -0.86 -1.44 119.26 121.94 2h4t h ALA 515 Ca 0.28 -0.12 -0.18 0.00 0.00 0.00 0.00 54.91 54.89 2h4t h ALA 515 Cb -0.11 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.59 2h4t h ALA 515 CO -0.06 -0.09 -0.54 0.74 0.00 0.00 0.00 179.25 179.30 2h4t h PHE 516 N 0.23 1.06 0.00 0.00 -1.00 -1.02 -3.00 116.94 113.21 2h4t h PHE 516 Ca 0.08 -0.38 -0.03 0.00 2.81 0.00 0.00 57.97 60.44 2h4t h PHE 516 Cb 0.19 -0.20 -0.00 0.00 3.61 0.00 0.00 35.95 39.55 2h4t h PHE 516 CO -0.01 1.21 -0.31 0.28 -1.61 0.00 0.00 178.31 177.87 2h4t h VAL 517 N 0.62 0.49 0.00 -0.55 2.07 -0.96 -3.38 116.25 114.54 2h4t h VAL 517 Ca 0.01 -1.44 0.00 0.00 0.82 0.00 0.00 66.70 66.09 2h4t h VAL 517 Cb 1.15 1.00 0.00 0.00 -1.52 0.00 0.00 31.29 31.92 2h4t h VAL 517 CO 0.12 0.17 0.00 -1.14 0.02 0.00 0.00 177.57 176.74 2h4t n ARG 518 N -4.65 0.00 -3.70 1.57 3.00 -0.55 -4.60 116.66 107.73 2h4t n ARG 518 Ca -0.08 0.22 -0.31 0.00 -0.00 0.00 0.00 57.85 57.68 2h4t n ARG 518 Cb 0.26 -1.05 -0.09 0.00 0.00 0.00 0.00 32.46 31.58 2h4t n ARG 518 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.63 177.23 2h4t n ASP 519 N -1.16 3.66 -0.16 6.15 5.68 -1.23 -4.90 116.55 124.59 2h4t n ASP 519 Ca 0.00 -3.25 -0.05 0.00 -0.50 0.00 0.00 54.79 51.00 2h4t n ASP 519 Cb 0.00 -0.85 0.14 0.00 -1.14 0.00 0.00 41.12 39.27 2h4t n ASP 519 CO 0.00 0.00 0.00 -0.65 -1.33 0.00 0.00 177.20 175.22 2h4t h PRO 520 N 5.33 0.91 0.00 0.11 0.11 -1.71 -2.95 132.00 133.79 2h4t h PRO 520 Ca 0.17 -0.22 -0.03 0.00 0.11 0.00 0.00 66.00 66.03 2h4t h PRO 520 Cb 0.74 -0.12 -0.00 0.00 0.11 0.00 0.00 31.00 31.73 2h4t h PRO 520 CO 0.81 0.84 -0.13 0.77 -0.21 0.00 0.00 178.00 180.08 2h4t h SER 521 N 0.86 0.00 -0.00 -2.05 0.02 -1.87 -2.70 113.55 107.81 2h4t h SER 521 Ca 0.18 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.13 2h4t h SER 521 Cb 0.38 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.92 2h4t h SER 521 CO 0.01 0.13 0.00 0.29 -1.14 0.00 0.00 176.83 176.12 2h4t n LYS 522 N -3.70 1.01 -4.62 3.45 5.02 -1.11 -4.80 118.16 113.42 2h4t n LYS 522 Ca -0.02 -0.02 -0.23 0.00 -2.02 0.00 0.00 58.31 56.02 2h4t n LYS 522 Cb 0.24 -1.31 -0.14 0.00 -0.02 0.00 0.00 35.03 33.80 2h4t n LYS 522 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 2h4t s HIS 523 N -2.00 1.46 0.56 2.13 3.76 -1.02 -5.14 115.29 115.04 2h4t s HIS 523 Ca 0.29 -0.32 -0.07 0.00 -0.15 0.00 0.00 55.06 54.82 2h4t s HIS 523 Cb 0.14 -0.90 -0.02 0.00 1.11 0.00 0.00 32.58 32.90 2h4t s HIS 523 CO 0.23 0.02 0.89 -1.54 -0.85 0.00 0.00 174.74 173.49 2h4t s SER 524 N -0.77 6.02 0.20 1.40 1.04 -1.26 -4.93 113.70 115.40 2h4t s SER 524 Ca 0.05 1.00 -0.10 0.00 0.48 0.00 0.00 55.95 57.38 2h4t s SER 524 Cb -0.07 -2.13 0.20 0.00 0.10 0.00 0.00 66.02 64.12 2h4t s SER 524 CO 0.00 -0.83 1.81 0.58 0.98 0.00 0.00 173.24 175.79 2h4t h VAL 525 N -0.07 0.99 -0.82 5.02 2.07 -1.93 -1.75 116.25 119.76 2h4t h VAL 525 Ca -0.46 -0.23 0.04 0.00 0.82 0.00 0.00 66.70 66.88 2h4t h VAL 525 Cb 1.22 0.26 -0.05 0.00 -1.52 0.00 0.00 31.29 31.20 2h4t h VAL 525 CO 0.62 0.12 0.54 1.23 0.02 0.00 0.00 177.57 180.09 2h4t h GLY 526 N 0.67 1.15 1.07 2.17 0.00 -1.93 -0.72 103.07 105.47 2h4t h GLY 526 Ca 0.27 -0.39 -0.10 0.00 0.00 0.00 0.00 47.33 47.12 2h4t h GLY 526 CO -0.16 0.33 -0.05 0.83 0.00 0.00 0.00 176.54 177.49 2h4t h GLU 527 N 0.98 1.00 -0.39 4.80 5.08 -1.72 -1.66 114.58 122.68 2h4t h GLU 527 Ca 0.33 -0.34 -0.06 0.00 -1.00 0.00 0.00 59.36 58.29 2h4t h GLU 527 Cb 0.08 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 2h4t h GLU 527 CO -0.10 1.02 0.03 -0.07 -1.00 0.00 0.00 179.01 178.89 2h4t h LEU 528 N 0.88 0.66 -1.18 1.33 3.38 -0.79 -1.84 115.31 117.75 2h4t h LEU 528 Ca 0.15 -0.29 -0.01 0.00 0.09 0.00 0.00 57.88 57.82 2h4t h LEU 528 Cb 0.60 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.14 2h4t h LEU 528 CO 0.04 0.78 0.37 1.56 0.09 0.00 0.00 178.44 181.28 2h4t h GLN 529 N 0.51 0.94 -0.29 1.13 4.20 -1.01 -1.09 115.11 119.49 2h4t h GLN 529 Ca 0.11 -0.10 -0.16 0.00 0.06 0.00 0.00 58.65 58.57 2h4t h GLN 529 Cb 0.43 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 28.02 2h4t h GLN 529 CO 0.02 0.69 -0.44 1.25 -0.67 0.00 0.00 178.83 179.68 2h4t h HIS 530 N 0.94 0.91 -0.41 2.96 2.76 -1.06 -1.49 115.15 119.75 2h4t h HIS 530 Ca 0.24 -0.28 -0.06 0.00 -2.20 0.00 0.00 60.37 58.07 2h4t h HIS 530 Cb 0.03 -0.19 -0.02 0.00 1.55 0.00 0.00 27.41 28.78 2h4t h HIS 530 CO 0.01 1.05 0.00 0.52 -1.30 0.00 0.00 177.93 178.21 2h4t h MET 531 N 0.60 0.66 -0.37 5.26 2.86 -0.85 -0.81 114.93 122.28 2h4t h MET 531 Ca 0.04 -0.16 -0.13 0.00 -2.06 0.00 0.00 59.70 57.39 2h4t h MET 531 Cb 1.00 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 32.56 2h4t h MET 531 CO 0.09 0.68 -0.31 0.52 1.06 0.00 0.00 176.91 178.95 2h4t h MET 532 N 0.62 0.81 -0.64 1.72 2.07 -0.94 -1.53 114.93 117.03 2h4t h MET 532 Ca 0.13 -0.38 -0.06 0.00 -2.07 0.00 0.00 59.70 57.32 2h4t h MET 532 Cb 0.39 -0.01 -0.03 0.00 -1.87 0.00 0.00 31.60 30.08 2h4t h MET 532 CO 0.01 1.01 0.17 0.00 1.07 0.00 0.00 176.91 179.17 2h4t h ALA 533 N 0.96 1.09 -0.63 6.32 0.00 -0.78 -1.46 119.26 124.76 2h4t h ALA 533 Ca 0.08 -0.22 -0.06 0.00 0.00 0.00 0.00 54.91 54.70 2h4t h ALA 533 Cb 0.85 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.36 2h4t h ALA 533 CO 0.07 0.61 0.15 0.93 0.00 0.00 0.00 179.25 181.01 2h4t h GLU 534 N 0.96 1.00 -0.04 0.00 5.08 -0.85 0.07 114.58 120.79 2h4t h GLU 534 Ca 0.21 -0.23 -0.00 0.00 -1.00 0.00 0.00 59.36 58.34 2h4t h GLU 534 Cb 0.32 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.43 2h4t h GLU 534 CO -0.00 0.89 0.02 0.00 -1.00 0.00 0.00 179.01 178.92 2h4t h SER 536 N -0.07 0.92 0.24 0.00 0.87 -1.07 -0.48 113.55 113.97 2h4t h SER 536 Ca 0.01 -0.08 -0.01 0.00 -1.23 0.00 0.00 61.79 60.49 2h4t h SER 536 Cb 0.14 -0.23 -0.00 0.00 -0.44 0.00 0.00 62.40 61.86 2h4t h SER 536 CO -0.00 0.73 -0.15 0.50 -0.53 0.00 0.00 176.83 177.38 2h4t h LYS 537 N 1.04 -0.36 -0.58 2.24 3.64 -0.88 -0.46 116.57 121.20 2h4t h LYS 537 Ca 0.27 0.02 -0.07 0.00 -1.27 0.00 0.00 60.65 59.60 2h4t h LYS 537 Cb -0.01 0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 31.87 2h4t h LYS 537 CO -0.05 -0.24 0.08 -0.92 -2.27 0.00 0.00 179.45 176.05 2h4t h TYR 538 N -0.38 1.03 -0.36 1.91 3.20 -1.32 -2.16 116.97 118.90 2h4t h TYR 538 Ca -0.02 -0.15 -0.02 0.00 3.14 0.00 0.00 58.73 61.68 2h4t h TYR 538 Cb 0.31 -0.28 -0.02 0.00 1.54 0.00 0.00 36.73 38.28 2h4t h TYR 538 CO -0.09 0.90 0.13 1.25 -1.64 0.00 0.00 178.16 178.72 2h4t h HIS 539 N 0.86 0.50 -0.10 -3.82 2.76 -0.95 -0.53 115.15 113.87 2h4t h HIS 539 Ca 0.17 -0.02 -0.11 0.00 -2.20 0.00 0.00 60.37 58.22 2h4t h HIS 539 Cb 0.44 -0.16 -0.01 0.00 1.55 0.00 0.00 27.41 29.23 2h4t h HIS 539 CO 0.03 0.41 -0.44 0.78 -1.30 0.00 0.00 177.93 177.41 2h4t h GLY 540 N 0.67 0.27 0.68 5.26 0.00 -0.69 -0.80 103.07 108.46 2h4t h GLY 540 Ca 0.12 -0.26 -0.03 0.00 0.00 0.00 0.00 47.33 47.16 2h4t h GLY 540 CO -0.01 0.24 -0.05 -1.61 0.00 0.00 0.00 176.54 175.11 2h4t h GLN 541 N 0.20 0.20 -0.33 4.80 4.15 -0.53 -1.91 115.11 121.71 2h4t h GLN 541 Ca 0.02 -0.09 -0.05 0.00 0.77 0.00 0.00 58.65 59.30 2h4t h GLN 541 Cb 0.86 -0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.53 2h4t h GLN 541 CO 0.07 0.57 -0.01 -0.07 -1.93 0.00 0.00 178.83 177.45 2h4t h LEU 542 N -0.17 0.48 -0.24 -2.39 3.38 -1.08 -1.27 115.31 114.02 2h4t h LEU 542 Ca 0.02 -0.09 -0.02 0.00 0.09 0.00 0.00 57.88 57.88 2h4t h LEU 542 Cb 0.51 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 2h4t h LEU 542 CO 0.01 0.55 0.06 0.74 0.09 0.00 0.00 178.44 179.89 2h4t h THR 543 N 0.49 1.21 -0.66 0.22 2.02 -1.03 -0.14 112.91 115.02 2h4t h THR 543 Ca 0.10 -0.69 -0.06 0.00 0.77 0.00 0.00 66.41 66.53 2h4t h THR 543 Cb 0.34 1.22 -0.03 0.00 -1.74 0.00 0.00 68.15 67.93 2h4t h THR 543 CO 0.01 0.22 0.17 0.11 0.37 0.00 0.00 175.52 176.40 2h4t h LYS 544 N 0.21 1.05 -0.57 6.66 1.57 -1.07 -2.06 116.57 122.36 2h4t h LYS 544 Ca 0.07 -0.25 -0.10 0.00 -1.87 0.00 0.00 60.65 58.51 2h4t h LYS 544 Cb 0.28 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.43 2h4t h LYS 544 CO 0.00 0.94 -0.03 0.93 -0.57 0.00 0.00 179.45 180.72 2h4t h GLU 545 N 0.98 1.03 -0.55 3.15 5.08 -1.10 -2.57 114.58 120.59 2h4t h GLU 545 Ca 0.21 -0.34 -0.02 0.00 -1.00 0.00 0.00 59.36 58.20 2h4t h GLU 545 Cb 0.35 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.49 2h4t h GLU 545 CO 0.00 1.03 0.25 0.00 -1.00 0.00 0.00 179.01 179.29 2h4t h ALA 546 N 0.96 0.71 0.00 3.43 0.00 -0.85 0.70 119.26 124.21 2h4t h ALA 546 Ca 0.16 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 2h4t h ALA 546 Cb 0.59 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.16 2h4t h ALA 546 CO 0.04 0.29 -0.00 1.15 0.00 0.00 0.00 179.25 180.72 2h4t h THR 547 N 0.74 0.99 -0.36 0.00 2.02 -1.24 -0.80 112.91 114.27 2h4t h THR 547 Ca 0.19 -0.01 0.00 0.00 0.77 0.00 0.00 66.41 67.36 2h4t h THR 547 Cb 0.14 1.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.56 2h4t h THR 547 CO -0.02 0.00 0.00 0.23 0.37 0.00 0.00 175.52 176.10 2h4t n MET 548 N -4.52 1.97 -1.01 6.66 2.00 -0.70 -4.67 117.12 116.84 2h4t n MET 548 Ca -0.03 -1.49 -0.00 0.00 0.00 0.00 0.00 57.70 56.17 2h4t n MET 548 Cb 0.09 -1.36 -0.00 0.00 0.00 0.00 0.00 33.22 31.95 2h4t n MET 548 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2h4t n GLY 549 N 1.20 0.47 2.19 3.03 0.00 -0.30 -4.68 105.19 107.09 2h4t n GLY 549 Ca 0.15 -0.46 -0.25 0.00 0.00 0.00 0.00 46.02 45.47 2h4t n GLY 549 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2h4t n GLN 550 N -2.89 2.27 -1.04 1.61 1.13 0.24 -4.57 117.38 114.14 2h4t n GLN 550 Ca -0.00 -2.92 -0.10 0.00 -1.94 0.00 0.00 57.00 52.04 2h4t n GLN 550 Cb 0.03 -2.14 0.06 0.00 0.11 0.00 0.00 30.24 28.30 2h4t n GLN 550 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2h4t n GLY 551 N -1.02 -0.29 0.01 1.08 0.00 -1.25 -4.57 105.19 99.14 2h4t n GLY 551 Ca 0.58 -1.83 0.01 0.00 0.00 0.00 0.00 46.02 44.77 2h4t n GLY 551 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2h4t n PHE 552 N -2.33 0.00 0.07 1.61 1.16 -1.26 -4.77 117.46 111.94 2h4t n PHE 552 Ca 0.06 0.00 -0.11 0.00 -1.87 0.00 0.00 57.45 55.53 2h4t n PHE 552 Cb 0.22 -0.11 -0.05 0.00 -1.61 0.00 0.00 39.48 37.93 2h4t n PHE 552 CO 0.00 0.00 0.00 -0.44 -1.87 0.00 0.00 176.76 174.45 2h4t h ASP 553 N 0.00 -0.50 -0.66 5.98 5.19 -1.95 -1.80 116.42 122.68 2h4t h ASP 553 Ca -0.03 0.07 -0.06 0.00 -0.62 0.00 0.00 57.03 56.39 2h4t h ASP 553 Cb 0.55 0.20 -0.03 0.00 0.18 0.00 0.00 39.33 40.23 2h4t h ASP 553 CO 0.00 -0.24 0.20 0.03 -3.12 0.00 0.00 179.24 176.11 2h4t h ARG 554 N -0.30 1.05 -0.13 3.56 2.47 -1.92 -1.26 114.38 117.85 2h4t h ARG 554 Ca 0.05 -0.22 -0.00 0.00 -1.26 0.00 0.00 59.98 58.54 2h4t h ARG 554 Cb 0.35 -0.15 -0.01 0.00 -1.65 0.00 0.00 29.97 28.51 2h4t h ARG 554 CO -0.14 0.91 0.07 1.25 0.56 0.00 0.00 179.97 182.61 2h4t h HIS 555 N 1.01 0.19 -0.14 3.04 2.76 -1.82 0.15 115.15 120.34 2h4t h HIS 555 Ca 0.22 -0.01 -0.07 0.00 -2.20 0.00 0.00 60.37 58.32 2h4t h HIS 555 Cb 0.31 -0.06 -0.01 0.00 1.55 0.00 0.00 27.41 29.20 2h4t h HIS 555 CO 0.02 0.22 -0.21 -0.07 -1.30 0.00 0.00 177.93 176.59 2h4t h LEU 556 N 0.10 0.23 -0.25 0.26 3.38 -1.16 -1.47 115.31 116.40 2h4t h LEU 556 Ca 0.05 -0.06 -0.12 0.00 0.09 0.00 0.00 57.88 57.83 2h4t h LEU 556 Cb 0.10 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 40.79 2h4t h LEU 556 CO -0.01 0.46 -0.32 0.22 0.09 0.00 0.00 178.44 178.88 2h4t h TYR 557 N 0.22 0.80 -0.40 1.13 5.03 -0.86 -2.32 116.97 120.57 2h4t h TYR 557 Ca 0.04 -0.26 -0.03 0.00 2.58 0.00 0.00 58.73 61.06 2h4t h TYR 557 Cb 0.50 -0.16 -0.02 0.00 1.55 0.00 0.00 36.73 38.60 2h4t h TYR 557 CO 0.01 1.00 0.12 0.00 -1.32 0.00 0.00 178.16 177.97 2h4t h ALA 558 N 0.66 1.48 -0.35 1.82 0.00 -0.65 0.35 119.26 122.57 2h4t h ALA 558 Ca 0.03 -0.14 -0.11 0.00 0.00 0.00 0.00 54.91 54.70 2h4t h ALA 558 Cb 0.90 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 2h4t h ALA 558 CO 0.08 0.39 -0.20 -0.07 0.00 0.00 0.00 179.25 179.44 2h4t h LEU 559 N 0.57 0.78 -0.43 0.00 3.38 -1.18 -1.48 115.31 116.95 2h4t h LEU 559 Ca 0.14 -0.42 -0.03 0.00 0.09 0.00 0.00 57.88 57.65 2h4t h LEU 559 Cb 0.17 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 2h4t h LEU 559 CO -0.01 1.03 0.13 -0.09 0.09 0.00 0.00 178.44 179.60 2h4t h ARG 560 N 0.53 0.67 -0.80 1.13 2.43 -0.91 -0.89 114.38 116.53 2h4t h ARG 560 Ca 0.07 -0.14 -0.00 0.00 -0.81 0.00 0.00 59.98 59.10 2h4t h ARG 560 Cb 0.76 -0.10 -0.04 0.00 -0.42 0.00 0.00 29.97 30.17 2h4t h ARG 560 CO 0.06 0.65 0.50 -0.92 -1.51 0.00 0.00 179.97 178.75 2h4t h TYR 561 N 0.55 1.04 -0.26 2.20 3.20 -0.88 -2.06 116.97 120.76 2h4t h TYR 561 Ca 0.14 0.01 -0.11 0.00 3.14 0.00 0.00 58.73 61.91 2h4t h TYR 561 Cb 0.26 -0.35 -0.00 0.00 1.54 0.00 0.00 36.73 38.18 2h4t h TYR 561 CO 0.01 0.68 -0.27 1.25 -1.64 0.00 0.00 178.16 178.19 2h4t h LEU 562 N 1.10 0.70 -0.59 2.82 5.85 -0.96 -2.17 115.31 122.06 2h4t h LEU 562 Ca 0.29 -0.48 0.07 0.00 0.84 0.00 0.00 57.88 58.61 2h4t h LEU 562 Cb -0.07 -0.20 -0.06 0.00 0.37 0.00 0.00 40.66 40.70 2h4t h LEU 562 CO -0.06 1.03 0.28 0.00 -0.34 0.00 0.00 178.44 179.35 2h4t h ALA 563 N 0.69 0.77 -0.57 1.25 0.00 -0.76 0.13 119.26 120.76 2h4t h ALA 563 Ca 0.04 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 2h4t h ALA 563 Cb 0.84 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.57 2h4t h ALA 563 CO 0.07 -0.10 0.30 1.15 0.00 0.00 0.00 179.25 180.66 2h4t h THR 564 N 0.51 1.20 0.00 0.00 2.02 -1.31 -1.26 112.91 114.06 2h4t h THR 564 Ca 0.28 -0.53 -0.06 0.00 0.77 0.00 0.00 66.41 66.88 2h4t h THR 564 Cb 0.26 0.49 -0.01 0.00 -1.74 0.00 0.00 68.15 67.15 2h4t h THR 564 CO -0.23 0.22 -0.27 0.00 0.37 0.00 0.00 175.52 175.61 2h4t h ALA 565 N 1.13 1.42 -0.00 6.16 0.00 -0.62 -2.16 119.26 125.19 2h4t h ALA 565 Ca 0.20 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2h4t h ALA 565 Cb 0.08 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2h4t h ALA 565 CO -0.03 0.34 -0.04 0.54 0.00 0.00 0.00 179.25 180.07 2h4t n ARG 566 N -4.02 0.41 -1.78 0.00 5.12 0.35 -4.91 116.66 111.83 2h4t n ARG 566 Ca -0.02 -0.04 0.00 0.00 -1.93 0.00 0.00 57.85 55.86 2h4t n ARG 566 Cb 0.34 -1.50 0.00 0.00 -1.16 0.00 0.00 32.46 30.14 2h4t n ARG 566 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2h4t n GLY 567 N 1.32 0.54 3.85 -0.13 0.00 -0.81 -5.07 105.19 104.90 2h4t n GLY 567 Ca 0.13 -0.80 -0.25 0.00 0.00 0.00 0.00 46.02 45.10 2h4t n GLY 567 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2h4t s LEU 568 N 0.00 3.98 0.60 0.99 1.02 -0.52 -5.04 118.68 119.71 2h4t s LEU 568 Ca 0.00 -0.06 -0.15 0.00 0.02 0.00 0.00 54.13 53.94 2h4t s LEU 568 Cb 0.00 -2.56 -0.04 0.00 0.02 0.00 0.00 46.19 43.61 2h4t s LEU 568 CO 0.00 0.03 1.04 0.20 0.02 0.00 0.00 176.35 177.64 2h4t s ASN 569 N -3.35 5.91 0.05 2.29 0.01 -1.26 -4.40 114.94 114.19 2h4t s ASN 569 Ca 0.32 1.70 -0.32 0.00 -0.71 0.00 0.00 52.86 53.86 2h4t s ASN 569 Cb -0.10 -2.52 -0.11 0.00 0.41 0.00 0.00 41.25 38.94 2h4t s ASN 569 CO 0.25 -1.08 1.86 0.18 -1.51 0.00 0.00 177.10 176.81 2h4t n LEU 570 N -2.19 3.82 -4.72 0.60 7.99 -1.26 -4.92 117.00 116.32 2h4t n LEU 570 Ca 0.08 0.97 -0.38 0.00 -0.01 0.00 0.00 56.01 56.67 2h4t n LEU 570 Cb 0.53 -1.48 0.06 0.00 -0.11 0.00 0.00 43.42 42.42 2h4t n LEU 570 CO 0.49 0.07 0.90 -2.65 -1.51 0.00 0.00 177.39 174.70 2h4t n PRO 571 N 6.17 1.28 0.01 3.23 -0.02 -1.26 -4.85 135.00 139.57 2h4t n PRO 571 Ca 0.20 0.49 0.22 0.00 -2.02 0.00 0.00 63.50 62.39 2h4t n PRO 571 Cb 0.35 -2.52 0.73 0.00 -0.02 0.00 0.00 33.50 32.04 2h4t n PRO 571 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 2h4t h GLU 572 N 0.81 0.00 -1.01 -0.52 5.08 -1.98 -1.44 114.58 115.53 2h4t h GLU 572 Ca -0.51 0.00 0.15 0.00 -1.00 0.00 0.00 59.36 58.01 2h4t h GLU 572 Cb 1.33 0.00 -0.10 0.00 0.50 0.00 0.00 28.75 30.49 2h4t h GLU 572 CO 0.54 0.00 0.62 1.25 -1.00 0.00 0.00 179.01 180.42 2h4t h LEU 573 N 0.00 0.87 0.00 1.33 5.85 -1.88 -0.71 115.31 120.76 2h4t h LEU 573 Ca 0.26 0.07 0.00 0.00 0.84 0.00 0.00 57.88 59.05 2h4t h LEU 573 Cb 1.20 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 42.13 2h4t h LEU 573 CO -0.00 0.39 -0.37 -1.22 -0.34 0.00 0.00 178.44 176.90 2h4t n TYR 574 N -4.69 0.57 0.39 1.25 4.02 -0.54 -3.29 117.16 114.87 2h4t n TYR 574 Ca 0.21 0.17 0.12 0.00 -0.01 0.00 0.00 57.90 58.39 2h4t n TYR 574 Cb 0.46 -0.69 0.20 0.00 -0.02 0.00 0.00 39.34 39.29 2h4t n TYR 574 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 176.86 175.78 2h4t h LEU 575 N 0.00 0.00 -9.53 7.72 3.38 -1.16 -3.42 115.31 112.30 2h4t h LEU 575 Ca 0.00 -0.05 -0.55 0.00 0.09 0.00 0.00 57.88 57.37 2h4t h LEU 575 Cb 0.70 0.00 0.05 0.00 0.09 0.00 0.00 40.66 41.50 2h4t h LEU 575 CO 0.00 0.02 0.97 -0.67 0.09 0.00 0.00 178.44 178.86 2h4t n ASP 576 N -2.57 3.64 0.07 -0.43 4.64 -0.83 -4.86 116.55 116.21 2h4t n ASP 576 Ca 0.04 1.04 0.17 0.00 -1.38 0.00 0.00 54.79 54.66 2h4t n ASP 576 Cb 0.49 -1.50 0.68 0.00 -1.04 0.00 0.00 41.12 39.75 2h4t n ASP 576 CO 0.00 0.00 0.00 -0.65 -0.82 0.00 0.00 177.20 175.73 2h4t h PRO 577 N 7.20 0.00 -0.22 -0.67 0.11 -1.91 -0.65 132.00 135.86 2h4t h PRO 577 Ca -0.45 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.58 2h4t h PRO 577 Cb 1.23 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 2h4t h PRO 577 CO 0.93 0.00 -0.21 0.00 -0.21 0.00 0.00 178.00 178.51 2h4t h ALA 578 N 1.80 1.23 -0.25 -0.75 0.00 -1.94 -0.80 119.26 118.55 2h4t h ALA 578 Ca 0.19 -0.30 -0.18 0.00 0.00 0.00 0.00 54.91 54.61 2h4t h ALA 578 Cb 0.76 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.44 2h4t h ALA 578 CO -0.00 0.50 -0.56 -0.92 0.00 0.00 0.00 179.25 178.27 2h4t h TYR 579 N 0.36 1.05 -0.61 0.00 5.03 -1.39 -1.23 116.97 120.18 2h4t h TYR 579 Ca 0.06 -0.39 -0.08 0.00 2.58 0.00 0.00 58.73 60.90 2h4t h TYR 579 Cb 0.58 -0.19 -0.02 0.00 1.55 0.00 0.00 36.73 38.64 2h4t h TYR 579 CO 0.02 1.21 0.07 1.96 -1.32 0.00 0.00 178.16 180.10 2h4t h GLN 580 N 0.59 1.01 -0.53 1.82 4.20 -1.27 -2.50 115.11 118.44 2h4t h GLN 580 Ca 0.00 -0.27 -0.08 0.00 0.06 0.00 0.00 58.65 58.36 2h4t h GLN 580 Cb 1.17 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 28.81 2h4t h GLN 580 CO 0.12 0.95 0.02 0.37 -0.67 0.00 0.00 178.83 179.62 2h4t h GLN 581 N 0.95 0.92 0.00 1.46 4.15 -1.06 -2.48 115.11 119.05 2h4t h GLN 581 Ca 0.19 -0.29 -0.01 0.00 0.77 0.00 0.00 58.65 59.31 2h4t h GLN 581 Cb 0.45 -0.09 -0.00 0.00 0.21 0.00 0.00 27.48 28.05 2h4t h GLN 581 CO 0.02 0.93 -0.03 1.98 -1.93 0.00 0.00 178.83 179.80 2h4t h MET 582 N 0.80 0.00 -0.45 1.69 4.05 -0.95 -2.00 114.93 118.07 2h4t h MET 582 Ca 0.15 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.57 2h4t h MET 582 Cb 0.51 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.31 2h4t h MET 582 CO 0.02 0.03 0.00 0.09 0.23 0.00 0.00 176.91 177.28 2h4t n ASN 583 N -4.10 4.54 -4.01 1.39 4.13 -0.96 -4.60 115.26 111.64 2h4t n ASN 583 Ca -0.03 -2.77 -0.32 0.00 1.68 0.00 0.00 54.58 53.14 2h4t n ASN 583 Cb 0.11 -0.56 -0.09 0.00 -1.54 0.00 0.00 39.78 37.70 2h4t n ASN 583 CO 0.00 0.00 0.00 -2.28 0.28 0.00 0.00 177.26 175.26 2h4t s HIS 584 N -2.42 3.69 -0.95 3.10 2.46 -0.75 -5.04 115.29 115.38 2h4t s HIS 584 Ca 0.46 -3.15 -0.24 0.00 0.47 0.00 0.00 55.06 52.60 2h4t s HIS 584 Cb 0.34 -2.99 0.01 0.00 -0.13 0.00 0.00 32.58 29.81 2h4t s HIS 584 CO 0.15 -0.66 1.65 -0.80 -2.47 0.00 0.00 174.74 172.61 2h4t s ASN 585 N -0.66 5.92 0.22 9.88 0.01 -1.26 -4.63 114.94 124.42 2h4t s ASN 585 Ca 0.25 -1.05 -0.06 0.00 -0.71 0.00 0.00 52.86 51.28 2h4t s ASN 585 Cb -0.08 -2.56 0.19 0.00 0.41 0.00 0.00 41.25 39.21 2h4t s ASN 585 CO -0.13 -2.03 1.75 0.40 -1.51 0.00 0.00 177.10 175.58 2h4t h ILE 586 N 6.95 1.26 -3.37 0.60 2.04 -1.85 -3.35 117.51 119.79 2h4t h ILE 586 Ca 0.13 -0.92 -0.72 0.00 1.00 0.00 0.00 64.86 64.35 2h4t h ILE 586 Cb 1.01 0.52 -0.31 0.00 -0.74 0.00 0.00 36.82 37.30 2h4t h ILE 586 CO 1.33 0.35 -0.43 -0.76 0.00 0.00 0.00 178.15 178.65 2h4t s LEU 587 N -9.52 5.57 -0.22 1.44 1.43 -0.97 0.33 118.68 116.74 2h4t s LEU 587 Ca -0.12 -2.01 -0.07 0.00 -1.03 0.00 0.00 54.13 50.91 2h4t s LEU 587 Cb 0.15 -1.95 -0.03 0.00 0.03 0.00 0.00 46.19 44.39 2h4t s LEU 587 CO 0.84 -0.63 0.05 -0.44 0.23 0.00 0.00 176.35 176.39 2h4t s SER 588 N 2.32 5.15 0.11 2.29 0.01 -0.96 -0.27 113.70 122.34 2h4t s SER 588 Ca 0.07 -0.14 0.03 0.00 1.31 0.00 0.00 55.95 57.23 2h4t s SER 588 Cb -0.25 -1.90 -0.04 0.00 0.21 0.00 0.00 66.02 64.05 2h4t s SER 588 CO -0.02 0.05 -0.09 0.42 0.41 0.00 0.00 173.24 174.01 2h4t s THR 589 N 1.12 0.91 -0.24 1.44 -4.23 0.87 0.01 115.64 115.52 2h4t s THR 589 Ca 0.04 -1.77 -0.19 0.00 -1.18 0.00 0.00 61.69 58.58 2h4t s THR 589 Cb -0.14 -1.50 0.06 0.00 1.34 0.00 0.00 72.50 72.26 2h4t s THR 589 CO 0.03 -0.66 0.62 -0.55 -0.54 0.00 0.00 174.62 173.51 2h4t s SER 590 N -2.70 -0.70 0.12 3.99 0.15 -0.43 -2.19 113.70 111.94 2h4t s SER 590 Ca 0.09 1.28 -0.02 0.00 0.70 0.00 0.00 55.95 57.99 2h4t s SER 590 Cb -0.00 1.25 -0.05 0.00 -1.71 0.00 0.00 66.02 65.51 2h4t s SER 590 CO -0.01 -0.22 0.32 0.28 1.20 0.00 0.00 173.24 174.81 2h4t s THR 591 N 0.73 5.25 -0.19 6.45 -1.32 -1.26 -2.13 115.64 123.17 2h4t s THR 591 Ca -0.03 -0.18 -0.04 0.00 -1.21 0.00 0.00 61.69 60.23 2h4t s THR 591 Cb -0.05 -3.64 0.09 0.00 -1.51 0.00 0.00 72.50 67.39 2h4t s THR 591 CO -0.05 0.04 0.21 -0.22 -2.21 0.00 0.00 174.62 172.39 2h4t s LEU 592 N -2.70 -0.08 -0.21 9.08 2.96 -0.90 -4.93 118.68 121.90 2h4t s LEU 592 Ca 0.38 -0.18 -0.02 0.00 -0.22 0.00 0.00 54.13 54.09 2h4t s LEU 592 Cb -0.12 0.34 0.00 0.00 0.50 0.00 0.00 46.19 46.91 2h4t s LEU 592 CO 0.26 -0.32 -0.10 0.20 -1.32 0.00 0.00 176.35 175.07 2h4t s ASN 593 N 2.31 3.86 -0.29 3.68 -0.87 -1.26 -4.61 114.94 117.77 2h4t s ASN 593 Ca 0.06 -0.50 -0.23 0.00 -1.57 0.00 0.00 52.86 50.62 2h4t s ASN 593 Cb -0.15 -1.64 0.16 0.00 -0.02 0.00 0.00 41.25 39.59 2h4t s ASN 593 CO -0.11 -0.01 1.19 -0.55 -2.57 0.00 0.00 177.10 175.04 2h4t s SER 594 N 1.41 -0.29 0.13 -1.22 0.15 -1.26 -5.01 113.70 107.61 2h4t s SER 594 Ca 0.05 0.53 0.22 0.00 0.70 0.00 0.00 55.95 57.46 2h4t s SER 594 Cb -0.14 0.66 0.89 0.00 -1.71 0.00 0.00 66.02 65.72 2h4t s SER 594 CO -0.07 -0.09 1.69 -0.81 1.20 0.00 0.00 173.24 175.16 2h4t n PRO 595 N 2.26 0.12 0.09 5.44 -0.04 -1.26 -2.53 135.00 139.09 2h4t n PRO 595 Ca -0.13 0.26 0.12 0.00 -0.04 0.00 0.00 63.50 63.71 2h4t n PRO 595 Cb 0.56 -1.69 0.05 0.00 -0.04 0.00 0.00 33.50 32.38 2h4t n PRO 595 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2h4t h ALA 596 N 2.51 0.51 -3.01 0.55 0.00 -1.94 -3.46 119.26 114.43 2h4t h ALA 596 Ca 0.00 0.00 -0.60 0.00 0.00 0.00 0.00 54.91 54.31 2h4t h ALA 596 Cb 0.43 0.00 -0.11 0.00 0.00 0.00 0.00 17.79 18.11 2h4t h ALA 596 CO 0.00 0.00 -0.30 0.08 0.00 0.00 0.00 179.25 179.03 2h4t s VAL 597 N -3.30 5.27 -0.15 0.00 1.01 -1.05 -1.53 120.40 120.66 2h4t s VAL 597 Ca 0.02 0.57 -0.02 0.00 0.00 0.00 0.00 61.98 62.55 2h4t s VAL 597 Cb 0.11 -3.66 -0.24 0.00 0.00 0.00 0.00 36.38 32.59 2h4t s VAL 597 CO 0.77 0.33 0.25 -1.54 0.00 0.00 0.00 175.10 174.91 2h4t n SER 598 N 4.01 1.89 -3.46 3.32 3.41 -0.15 -4.77 113.62 117.87 2h4t n SER 598 Ca -0.11 0.14 -0.11 0.00 -0.26 0.00 0.00 58.87 58.53 2h4t n SER 598 Cb 0.52 -0.62 -0.02 0.00 -0.26 0.00 0.00 64.21 63.82 2h4t n SER 598 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 2h4t s LEU 599 N -6.78 -0.50 0.28 1.04 2.96 -1.22 -5.02 118.68 109.44 2h4t s LEU 599 Ca -0.23 0.08 -0.10 0.00 -0.22 0.00 0.00 54.13 53.66 2h4t s LEU 599 Cb 0.07 2.37 -0.00 0.00 0.50 0.00 0.00 46.19 49.13 2h4t s LEU 599 CO 0.74 -0.79 0.48 -0.83 -1.32 0.00 0.00 176.35 174.62 2h4t s GLY 600 N -2.46 0.79 -0.09 7.98 0.00 -1.26 0.48 107.32 112.76 2h4t s GLY 600 Ca 0.01 -1.06 -0.33 0.00 0.00 0.00 0.00 44.72 43.34 2h4t s GLY 600 CO -0.09 -0.73 1.38 -0.32 0.00 0.00 0.00 173.10 173.34 2h4t s GLY 601 N -3.08 -0.45 -0.04 0.20 0.00 -0.79 -4.75 107.32 98.41 2h4t s GLY 601 Ca 0.25 0.98 -0.30 0.00 0.00 0.00 0.00 44.72 45.65 2h4t s GLY 601 CO 0.12 0.21 0.71 -0.11 0.00 0.00 0.00 173.10 174.03 2h4t s PHE 602 N -2.16 -0.61 0.81 1.90 -0.12 -1.26 -1.83 117.98 114.71 2h4t s PHE 602 Ca 0.14 0.97 -0.12 0.00 -0.05 0.00 0.00 56.93 57.88 2h4t s PHE 602 Cb 0.06 0.43 0.08 0.00 -0.63 0.00 0.00 43.02 42.96 2h4t s PHE 602 CO -0.05 -0.60 1.13 0.00 -0.05 0.00 0.00 175.22 175.64 2h4t s ALA 603 N -1.48 2.34 0.74 1.99 0.00 -1.25 -4.48 121.76 119.62 2h4t s ALA 603 Ca -0.08 -0.43 -0.14 0.00 0.00 0.00 0.00 51.96 51.30 2h4t s ALA 603 Cb -0.00 -3.03 0.05 0.00 0.00 0.00 0.00 23.12 20.13 2h4t s ALA 603 CO 0.06 -1.76 1.17 -2.14 0.00 0.00 0.00 175.76 173.10 2h4t s PRO 604 N -5.33 2.14 0.00 0.00 0.02 -1.26 -4.55 135.00 126.02 2h4t s PRO 604 Ca 0.61 1.62 0.25 0.00 0.02 0.00 0.00 61.00 63.50 2h4t s PRO 604 Cb -0.13 -1.85 0.42 0.00 0.02 0.00 0.00 34.50 32.96 2h4t s PRO 604 CO 0.52 -1.80 1.35 1.33 -0.33 0.00 0.00 177.00 178.07 2h4t n VAL 605 N -2.89 0.00 -4.05 3.83 0.24 -1.26 -4.76 118.33 109.43 2h4t n VAL 605 Ca 0.12 -0.14 -0.10 0.00 -2.04 0.00 0.00 64.34 62.18 2h4t n VAL 605 Cb 0.51 0.69 -0.11 0.00 -1.47 0.00 0.00 33.84 33.46 2h4t n VAL 605 CO 0.00 0.00 0.00 0.68 -2.14 0.00 0.00 176.83 175.37 2h4t s VAL 606 N -2.58 0.33 0.32 3.34 -7.23 -1.26 -4.96 120.40 108.36 2h4t s VAL 606 Ca 0.20 -1.30 0.09 0.00 -1.81 0.00 0.00 61.98 59.16 2h4t s VAL 606 Cb 0.18 -0.83 0.32 0.00 0.56 0.00 0.00 36.38 36.61 2h4t s VAL 606 CO 0.58 -0.63 1.77 -0.65 -0.31 0.00 0.00 175.10 175.86 2h4t h PRO 607 N 4.04 0.65 -0.77 4.82 0.11 -1.97 -2.04 132.00 136.84 2h4t h PRO 607 Ca -0.34 -0.04 -0.45 0.00 0.11 0.00 0.00 66.00 65.29 2h4t h PRO 607 Cb 1.19 -0.15 -0.25 0.00 0.11 0.00 0.00 31.00 31.90 2h4t h PRO 607 CO 0.50 0.43 0.33 -0.40 -0.21 0.00 0.00 178.00 178.65 2h4t n ASP 608 N -4.76 4.22 -4.29 -2.05 5.75 -1.26 -4.44 116.55 109.71 2h4t n ASP 608 Ca 0.24 -3.72 -0.23 0.00 -0.01 0.00 0.00 54.79 51.06 2h4t n ASP 608 Cb 0.64 -0.76 -0.02 0.00 -1.03 0.00 0.00 41.12 39.96 2h4t n ASP 608 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2h4t n GLY 609 N -1.06 3.10 3.27 6.12 0.00 -0.77 -4.84 105.19 111.01 2h4t n GLY 609 Ca 0.51 -2.30 -0.27 0.00 0.00 0.00 0.00 46.02 43.96 2h4t n GLY 609 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2h4t s PHE 610 N -2.34 1.95 -0.37 1.61 2.99 0.15 -4.22 117.98 117.75 2h4t s PHE 610 Ca 0.17 -0.38 -0.09 0.00 0.00 0.00 0.00 56.93 56.63 2h4t s PHE 610 Cb -0.01 -1.18 0.04 0.00 0.00 0.00 0.00 43.02 41.87 2h4t s PHE 610 CO 0.11 0.07 0.17 0.20 -0.00 0.00 0.00 175.22 175.77 2h4t s GLY 611 N -1.03 1.90 -0.31 4.36 0.00 -0.74 -2.26 107.32 109.23 2h4t s GLY 611 Ca 0.09 -1.81 -0.05 0.00 0.00 0.00 0.00 44.72 42.94 2h4t s GLY 611 CO 0.01 0.84 0.06 -0.42 0.00 0.00 0.00 173.10 173.59 2h4t s ILE 612 N 1.46 3.58 -0.18 0.90 1.01 0.10 -1.26 121.20 126.81 2h4t s ILE 612 Ca 0.01 -1.07 -0.06 0.00 0.00 0.00 0.00 60.65 59.53 2h4t s ILE 612 Cb -0.20 -2.97 -0.03 0.00 0.01 0.00 0.00 42.46 39.27 2h4t s ILE 612 CO 0.04 -0.07 0.03 0.00 0.00 0.00 0.00 174.94 174.95 2h4t s ALA 613 N 1.39 3.23 0.10 9.38 0.00 -0.51 -1.31 121.76 134.04 2h4t s ALA 613 Ca -0.01 -0.83 -0.06 0.00 0.00 0.00 0.00 51.96 51.06 2h4t s ALA 613 Cb -0.19 -1.82 -0.02 0.00 0.00 0.00 0.00 23.12 21.09 2h4t s ALA 613 CO 0.01 0.09 0.13 1.52 0.00 0.00 0.00 175.76 177.51 2h4t s TYR 614 N 0.56 0.40 -0.15 0.00 1.13 -0.90 -0.04 117.35 118.34 2h4t s TYR 614 Ca 0.01 -0.84 -0.08 0.00 -1.41 0.00 0.00 57.07 54.75 2h4t s TYR 614 Cb -0.13 -0.21 0.05 0.00 -1.10 0.00 0.00 41.96 40.57 2h4t s TYR 614 CO 0.02 -0.53 0.35 0.00 -2.51 0.00 0.00 175.55 172.88 2h4t s ALA 615 N -3.92 -0.88 -0.34 9.51 0.00 -0.41 -2.11 121.76 123.60 2h4t s ALA 615 Ca 0.11 1.34 -0.12 0.00 0.00 0.00 0.00 51.96 53.28 2h4t s ALA 615 Cb 0.06 -0.82 -0.01 0.00 0.00 0.00 0.00 23.12 22.35 2h4t s ALA 615 CO -0.07 -0.24 0.22 0.08 0.00 0.00 0.00 175.76 175.76 2h4t s VAL 616 N 1.31 5.05 0.64 0.00 1.01 -1.26 -1.08 120.40 126.06 2h4t s VAL 616 Ca -0.09 -0.38 0.05 0.00 0.00 0.00 0.00 61.98 61.55 2h4t s VAL 616 Cb -0.09 -3.64 0.12 0.00 0.00 0.00 0.00 36.38 32.77 2h4t s VAL 616 CO -0.11 -0.05 0.89 1.41 0.00 0.00 0.00 175.10 177.24 2h4t n HIS 617 N 5.07 -2.63 -0.19 5.22 8.25 0.96 -4.77 115.22 127.14 2h4t n HIS 617 Ca -0.13 -1.91 -0.07 0.00 -0.26 0.00 0.00 57.72 55.35 2h4t n HIS 617 Cb 0.49 -0.63 0.02 0.00 1.12 0.00 0.00 29.99 30.99 2h4t n HIS 617 CO 0.00 0.00 0.00 -0.44 0.64 0.00 0.00 176.34 176.54 2h4t h ASP 618 N -0.24 0.71 -0.04 0.41 3.32 -1.96 0.26 116.42 118.88 2h4t h ASP 618 Ca -0.30 -0.12 0.00 0.00 0.02 0.00 0.00 57.03 56.63 2h4t h ASP 618 Cb 1.21 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 40.58 2h4t h ASP 618 CO 0.36 0.63 0.00 0.47 -1.72 0.00 0.00 179.24 178.99 2h4t n ASP 619 N -4.58 1.58 -3.59 6.45 8.00 -1.26 -2.55 116.55 120.61 2h4t n ASP 619 Ca 0.03 -1.38 -0.09 0.00 0.71 0.00 0.00 54.79 54.06 2h4t n ASP 619 Cb 0.11 -0.02 -0.02 0.00 -0.02 0.00 0.00 41.12 41.17 2h4t n ASP 619 CO 0.00 0.00 0.00 -1.66 -0.39 0.00 0.00 177.20 175.15 2h4t s TRP 620 N -0.50 0.18 -0.05 1.24 1.48 -1.21 -3.13 118.94 116.95 2h4t s TRP 620 Ca 0.05 -0.64 0.00 0.00 -1.06 0.00 0.00 56.10 54.46 2h4t s TRP 620 Cb 0.03 0.52 0.02 0.00 -1.16 0.00 0.00 33.47 32.89 2h4t s TRP 620 CO 0.05 -1.25 -0.03 0.42 -4.06 0.00 0.00 176.95 172.08 2h4t s ILE 621 N -3.43 0.42 0.08 0.66 1.01 -0.26 -0.03 121.20 119.65 2h4t s ILE 621 Ca 0.17 -0.03 0.07 0.00 0.00 0.00 0.00 60.65 60.87 2h4t s ILE 621 Cb -0.04 -0.49 -0.04 0.00 0.01 0.00 0.00 42.46 41.90 2h4t s ILE 621 CO 0.10 0.22 -0.15 -0.83 0.00 0.00 0.00 174.94 174.27 2h4t s GLY 622 N 1.17 1.68 -0.03 6.18 0.00 -0.24 -0.50 107.32 115.58 2h4t s GLY 622 Ca -0.07 -1.25 -0.02 0.00 0.00 0.00 0.00 44.72 43.38 2h4t s GLY 622 CO -0.01 -1.19 0.06 0.00 0.00 0.00 0.00 173.10 171.96 2h4t s ASN 624 N 0.39 3.56 -0.08 0.00 3.04 0.94 -1.65 114.94 121.14 2h4t s ASN 624 Ca -0.03 -0.97 0.04 0.00 0.04 0.00 0.00 52.86 51.94 2h4t s ASN 624 Cb -0.04 -1.26 -0.01 0.00 -1.54 0.00 0.00 41.25 38.39 2h4t s ASN 624 CO -0.01 -0.16 -0.22 -0.69 -3.04 0.00 0.00 177.10 172.98 2h4t s VAL 625 N 1.36 2.27 0.28 -5.21 1.01 0.29 -1.43 120.40 118.98 2h4t s VAL 625 Ca -0.03 -0.97 0.08 0.00 0.00 0.00 0.00 61.98 61.07 2h4t s VAL 625 Cb -0.17 -1.86 -0.04 0.00 0.00 0.00 0.00 36.38 34.31 2h4t s VAL 625 CO -0.08 0.56 0.11 -0.94 0.00 0.00 0.00 175.10 174.76 2h4t s SER 626 N 0.05 4.94 0.07 3.32 1.04 -0.39 -1.61 113.70 121.12 2h4t s SER 626 Ca -0.09 -0.54 -0.26 0.00 0.48 0.00 0.00 55.95 55.54 2h4t s SER 626 Cb -0.15 -1.00 0.09 0.00 0.10 0.00 0.00 66.02 65.05 2h4t s SER 626 CO 0.06 -0.11 0.78 -0.94 0.98 0.00 0.00 173.24 174.01 2h4t s SER 627 N -3.79 -0.43 0.27 7.02 1.04 -0.34 -1.80 113.70 115.68 2h4t s SER 627 Ca 0.34 -0.04 0.04 0.00 0.48 0.00 0.00 55.95 56.77 2h4t s SER 627 Cb -0.06 0.48 0.04 0.00 0.10 0.00 0.00 66.02 66.58 2h4t s SER 627 CO 0.23 -0.79 0.29 -1.22 0.98 0.00 0.00 173.24 172.73 2h4t n TYR 628 N -0.31 -1.87 -0.22 5.02 4.01 -1.26 -0.95 117.16 121.57 2h4t n TYR 628 Ca -0.12 -1.07 0.21 0.00 -0.16 0.00 0.00 57.90 56.76 2h4t n TYR 628 Cb 0.63 -0.24 0.56 0.00 -0.31 0.00 0.00 39.34 39.97 2h4t n TYR 628 CO 0.00 0.00 0.00 0.77 -0.46 0.00 0.00 176.86 177.17 2h4t h SER 629 N 0.18 0.32 0.56 7.72 0.02 -1.72 -2.01 113.55 118.62 2h4t h SER 629 Ca -0.15 0.03 -0.02 0.00 -0.84 0.00 0.00 61.79 60.81 2h4t h SER 629 Cb 0.61 -0.03 -0.00 0.00 0.14 0.00 0.00 62.40 63.12 2h4t h SER 629 CO 0.22 0.13 -0.10 1.23 -1.14 0.00 0.00 176.83 177.17 2h4t h GLY 630 N 0.32 0.00 -1.02 -3.77 0.00 -1.91 -3.45 103.07 93.25 2h4t h GLY 630 Ca 0.45 0.00 -0.62 0.00 0.00 0.00 0.00 47.33 47.17 2h4t h GLY 630 CO -0.14 0.00 -0.54 0.50 0.00 0.00 0.00 176.54 176.36 2h4t s ARG 631 N -3.98 2.02 -0.34 4.80 1.81 -0.76 -5.01 118.95 117.49 2h4t s ARG 631 Ca -0.02 -2.23 -0.00 0.00 -1.72 0.00 0.00 55.73 51.76 2h4t s ARG 631 Cb 0.12 -1.23 0.11 0.00 -0.45 0.00 0.00 34.95 33.49 2h4t s ARG 631 CO 0.57 -0.32 0.13 1.21 -0.68 0.00 0.00 175.30 176.21 2h4t s ASN 632 N -3.73 3.92 0.21 0.23 3.84 -1.26 -4.58 114.94 113.56 2h4t s ASN 632 Ca 0.19 -1.85 -0.10 0.00 0.21 0.00 0.00 52.86 51.31 2h4t s ASN 632 Cb 0.04 -0.88 0.19 0.00 -0.55 0.00 0.00 41.25 40.05 2h4t s ASN 632 CO 0.10 -0.38 1.84 0.00 -2.79 0.00 0.00 177.10 175.87 2h4t h ALA 633 N 7.78 0.89 -0.07 1.71 0.00 -1.89 -1.22 119.26 126.47 2h4t h ALA 633 Ca -0.10 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.80 2h4t h ALA 633 Cb 1.00 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 2h4t h ALA 633 CO 0.46 0.18 -0.02 -0.09 0.00 0.00 0.00 179.25 179.79 2h4t h ARG 634 N 0.82 0.00 -0.64 0.00 2.43 -1.94 -0.46 114.38 114.59 2h4t h ARG 634 Ca 0.28 -0.00 -0.07 0.00 -0.81 0.00 0.00 59.98 59.38 2h4t h ARG 634 Cb 0.04 -0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.57 2h4t h ARG 634 CO -0.12 0.00 0.11 1.49 -1.51 0.00 0.00 179.97 179.95 2h4t h GLU 635 N 0.00 1.05 -0.46 0.20 4.81 -1.95 -2.15 114.58 116.09 2h4t h GLU 635 Ca 0.03 -0.28 0.03 0.00 -0.13 0.00 0.00 59.36 59.02 2h4t h GLU 635 Cb 0.05 -0.13 -0.04 0.00 0.63 0.00 0.00 28.75 29.27 2h4t h GLU 635 CO -0.07 0.97 0.24 0.35 -0.73 0.00 0.00 179.01 179.77 2h4t h PHE 636 N 0.97 0.45 -0.12 0.92 3.57 -0.95 -1.28 116.94 120.50 2h4t h PHE 636 Ca 0.20 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.66 2h4t h PHE 636 Cb 0.42 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 39.02 2h4t h PHE 636 CO 0.03 0.23 -0.15 -0.07 -2.23 0.00 0.00 178.31 176.12 2h4t h LEU 637 N 0.48 0.18 -0.60 0.59 3.38 -0.90 0.14 115.31 118.58 2h4t h LEU 637 Ca 0.19 -0.04 -0.12 0.00 0.09 0.00 0.00 57.88 58.01 2h4t h LEU 637 Cb 0.08 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 2h4t h LEU 637 CO -0.12 0.36 -0.18 0.45 0.09 0.00 0.00 178.44 179.03 2h4t h HIS 638 N 0.18 1.05 -0.15 1.13 3.86 -0.65 -0.56 115.15 120.02 2h4t h HIS 638 Ca 0.04 -0.23 -0.14 0.00 -1.16 0.00 0.00 60.37 58.87 2h4t h HIS 638 Cb 0.39 -0.25 -0.01 0.00 1.06 0.00 0.00 27.41 28.60 2h4t h HIS 638 CO 0.00 1.02 -0.49 0.00 0.86 0.00 0.00 177.93 179.32 2h4t h VAL 640 N 0.32 1.26 -0.25 0.00 2.07 -0.45 0.71 116.25 119.91 2h4t h VAL 640 Ca 0.02 -1.16 -0.00 0.00 0.82 0.00 0.00 66.70 66.37 2h4t h VAL 640 Cb 0.98 0.85 -0.01 0.00 -1.52 0.00 0.00 31.29 31.59 2h4t h VAL 640 CO 0.09 0.42 0.13 -0.61 0.02 0.00 0.00 177.57 177.62 2h4t h GLN 641 N 0.92 0.34 -0.79 1.57 5.75 -0.86 -0.99 115.11 121.04 2h4t h GLN 641 Ca 0.16 -0.04 -0.05 0.00 -0.15 0.00 0.00 58.65 58.57 2h4t h GLN 641 Cb 0.57 -0.07 -0.04 0.00 1.07 0.00 0.00 27.48 29.02 2h4t h GLN 641 CO 0.03 0.31 0.32 0.87 -2.65 0.00 0.00 178.83 177.71 2h4t h LYS 642 N 0.29 1.19 -0.37 1.69 1.57 -0.91 -1.80 116.57 118.23 2h4t h LYS 642 Ca 0.09 -0.22 -0.14 0.00 -1.87 0.00 0.00 60.65 58.52 2h4t h LYS 642 Cb 0.07 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.17 2h4t h LYS 642 CO -0.01 0.96 -0.32 0.00 -0.57 0.00 0.00 179.45 179.51 2h4t h LEU 644 N 0.68 0.63 -0.28 0.00 3.38 -0.97 0.88 115.31 119.63 2h4t h LEU 644 Ca 0.07 -0.16 -0.02 0.00 0.09 0.00 0.00 57.88 57.86 2h4t h LEU 644 Cb 0.86 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.43 2h4t h LEU 644 CO 0.08 0.75 0.08 -0.33 0.09 0.00 0.00 178.44 179.11 2h4t h GLU 645 N 0.60 0.45 -0.70 1.13 4.39 -1.10 -1.14 114.58 118.22 2h4t h GLU 645 Ca 0.11 -0.10 -0.06 0.00 0.34 0.00 0.00 59.36 59.66 2h4t h GLU 645 Cb 0.49 -0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 29.05 2h4t h GLU 645 CO 0.03 0.51 0.21 -0.44 -1.16 0.00 0.00 179.01 178.15 2h4t h ASP 646 N 0.30 1.02 -0.40 1.42 3.32 -0.95 -0.05 116.42 121.09 2h4t h ASP 646 Ca 0.09 -0.21 -0.03 0.00 0.02 0.00 0.00 57.03 56.90 2h4t h ASP 646 Cb 0.25 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.52 2h4t h ASP 646 CO -0.00 0.97 0.14 0.40 -1.72 0.00 0.00 179.24 179.03 2h4t h ILE 647 N 1.03 1.21 -0.39 0.35 2.04 -0.70 -0.82 117.51 120.23 2h4t h ILE 647 Ca 0.22 -0.66 -0.09 0.00 1.00 0.00 0.00 64.86 65.33 2h4t h ILE 647 Cb 0.32 0.89 -0.02 0.00 -0.74 0.00 0.00 36.82 37.27 2h4t h ILE 647 CO -0.01 0.23 -0.15 -0.26 0.00 0.00 0.00 178.15 177.97 2h4t h PHE 648 N 0.50 0.78 0.35 1.37 -1.00 -1.00 -1.56 116.94 116.39 2h4t h PHE 648 Ca 0.13 -0.15 -0.02 0.00 2.81 0.00 0.00 57.97 60.75 2h4t h PHE 648 Cb 0.22 -0.20 0.00 0.00 3.61 0.00 0.00 35.95 39.59 2h4t h PHE 648 CO 0.00 0.81 -0.17 -0.44 -1.61 0.00 0.00 178.31 176.91 2h4t h ASP 649 N 0.63 -0.40 -0.81 2.17 3.32 -0.69 -2.08 116.42 118.56 2h4t h ASP 649 Ca 0.10 -0.05 0.10 0.00 0.02 0.00 0.00 57.03 57.20 2h4t h ASP 649 Cb 0.61 0.10 -0.07 0.00 0.22 0.00 0.00 39.33 40.19 2h4t h ASP 649 CO 0.04 -0.21 0.45 0.00 -1.72 0.00 0.00 179.24 177.81 2h4t h ALA 650 N 0.05 1.15 0.00 3.45 0.00 -1.08 0.22 119.26 123.04 2h4t h ALA 650 Ca -0.05 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2h4t h ALA 650 Cb 0.42 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2h4t h ALA 650 CO 0.08 0.07 0.00 -0.07 0.00 0.00 0.00 179.25 179.33 2h4t h LEU 651 N 0.75 0.00 -0.31 0.00 3.38 -1.10 -1.27 115.31 116.77 2h4t h LEU 651 Ca 0.39 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.36 2h4t h LEU 651 Cb 0.37 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.12 2h4t h LEU 651 CO -0.25 0.00 -0.62 -0.62 0.09 0.00 0.00 178.44 177.03 2h4t n GLU 652 N -2.98 0.42 0.00 1.13 1.02 0.65 -4.95 120.64 115.92 2h4t n GLU 652 Ca -0.01 -0.31 0.00 0.00 -0.02 0.00 0.00 57.16 56.82 2h4t n GLU 652 Cb 0.18 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.11 2h4t n GLU 652 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2h4t n GLY 653 N 1.45 0.71 3.78 0.62 0.00 -0.48 -5.08 105.19 106.19 2h4t n GLY 653 Ca 0.07 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.70 2h4t n GLY 653 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2h4t s LYS 654 N -0.91 4.38 0.44 1.61 1.02 -0.45 -4.97 119.74 120.87 2h4t s LYS 654 Ca 0.00 0.91 -0.21 0.00 0.02 0.00 0.00 55.97 56.69 2h4t s LYS 654 Cb 0.00 -3.30 -0.10 0.00 -0.52 0.00 0.00 37.83 33.91 2h4t s LYS 654 CO 0.00 0.48 0.97 0.00 -0.92 0.00 0.00 175.35 175.88 2h4t s ALA 655 N -0.67 3.02 -2.83 5.17 0.00 -1.26 -3.37 121.76 121.81 2h4t s ALA 655 Ca 0.33 0.42 0.25 0.00 0.00 0.00 0.00 51.96 52.96 2h4t s ALA 655 Cb -0.20 -3.16 0.48 0.00 0.00 0.00 0.00 23.12 20.24 2h4t s ALA 655 CO 0.21 0.04 1.42 -0.89 0.00 0.00 0.00 175.76 176.55