#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nj2 h PHE 20 N 0.00 -0.17 -1.23 -1.84 3.57 -1.99 -2.86 116.94 112.41 1nj2 h PHE 20 Ca 0.00 -0.00 0.36 0.00 3.53 0.00 0.00 57.97 61.85 1nj2 h PHE 20 Cb 0.00 0.06 -0.09 0.00 2.79 0.00 0.00 35.95 38.71 1nj2 h PHE 20 CO 0.00 0.16 0.83 1.03 -2.23 0.00 0.00 178.31 178.10 1nj2 h SER 21 N -0.52 0.22 0.16 0.41 0.87 -2.00 0.60 113.55 113.29 1nj2 h SER 21 Ca -0.02 0.06 -0.23 0.00 -1.23 0.00 0.00 61.79 60.38 1nj2 h SER 21 Cb 0.41 0.03 0.03 0.00 -0.44 0.00 0.00 62.40 62.43 1nj2 h SER 21 CO 0.03 -0.01 -0.98 -0.33 -0.53 0.00 0.00 176.83 175.00 1nj2 h GLU 22 N 0.16 0.39 -0.30 2.24 5.08 -1.99 -3.18 114.58 116.98 1nj2 h GLU 22 Ca 0.67 -0.63 0.06 0.00 -1.00 0.00 0.00 59.36 58.46 1nj2 h GLU 22 Cb 2.19 0.23 -0.06 0.00 0.50 0.00 0.00 28.75 31.61 1nj2 h GLU 22 CO -0.21 1.29 -0.09 2.35 -1.00 0.00 0.00 179.01 181.35 1nj2 h TRP 23 N -0.19 -0.20 -0.01 4.33 7.01 -0.72 -2.12 115.95 124.05 1nj2 h TRP 23 Ca -0.17 0.03 0.01 0.00 2.11 0.00 0.00 58.89 60.87 1nj2 h TRP 23 Cb 1.76 0.14 -0.02 0.00 -2.10 0.00 0.00 29.16 28.94 1nj2 h TRP 23 CO 0.17 -0.15 -0.20 0.35 -2.79 0.00 0.00 178.44 175.82 1nj2 h PHE 24 N -0.02 -0.58 -0.36 2.65 3.57 -1.29 -1.37 116.94 119.54 1nj2 h PHE 24 Ca 0.15 0.02 0.08 0.00 3.53 0.00 0.00 57.97 61.74 1nj2 h PHE 24 Cb 0.25 0.26 -0.08 0.00 2.79 0.00 0.00 35.95 39.17 1nj2 h PHE 24 CO -0.30 -0.21 -0.18 0.45 -2.23 0.00 0.00 178.31 175.84 1nj2 h HIS 25 N -0.24 -0.44 -0.60 0.41 3.86 -1.50 -1.38 115.15 115.25 1nj2 h HIS 25 Ca 0.01 0.04 0.12 0.00 -1.16 0.00 0.00 60.37 59.37 1nj2 h HIS 25 Cb 0.26 0.25 -0.04 0.00 1.06 0.00 0.00 27.41 28.94 1nj2 h HIS 25 CO -0.44 -0.26 0.41 -0.91 0.86 0.00 0.00 177.93 177.59 1nj2 h ASN 26 N -0.12 0.30 0.75 2.45 2.35 -1.15 -2.13 115.58 118.03 1nj2 h ASN 26 Ca 0.18 0.01 -0.24 0.00 -0.55 0.00 0.00 56.30 55.70 1nj2 h ASN 26 Cb 0.39 -0.05 -0.01 0.00 0.05 0.00 0.00 38.32 38.70 1nj2 h ASN 26 CO -0.43 0.17 -1.11 -0.29 -1.65 0.00 0.00 177.43 174.12 1nj2 h ILE 27 N 0.33 1.58 -0.46 2.81 6.09 -0.17 -1.86 117.51 125.82 1nj2 h ILE 27 Ca 0.28 -3.14 0.03 0.00 -1.37 0.00 0.00 64.86 60.66 1nj2 h ILE 27 Cb 0.67 2.85 -0.03 0.00 0.47 0.00 0.00 36.82 40.78 1nj2 h ILE 27 CO -0.07 0.91 0.26 -0.07 -3.07 0.00 0.00 178.15 176.11 1nj2 h LEU 28 N 0.05 0.40 -0.33 2.19 3.38 -0.75 -0.76 115.31 119.50 1nj2 h LEU 28 Ca -0.08 0.01 -0.19 0.00 0.09 0.00 0.00 57.88 57.72 1nj2 h LEU 28 Cb 1.84 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 42.52 1nj2 h LEU 28 CO 0.17 0.28 -0.58 -0.08 0.09 0.00 0.00 178.44 178.33 1nj2 h GLU 29 N 0.51 0.80 -0.20 1.13 4.81 -1.50 0.27 114.58 120.41 1nj2 h GLU 29 Ca 0.19 -0.52 -0.21 0.00 -0.13 0.00 0.00 59.36 58.69 1nj2 h GLU 29 Cb 0.05 0.07 0.01 0.00 0.63 0.00 0.00 28.75 29.50 1nj2 h GLU 29 CO -0.11 1.15 -0.68 1.49 -0.73 0.00 0.00 179.01 180.13 1nj2 h GLU 30 N 0.60 0.79 -0.52 1.92 4.81 -1.01 -2.90 114.58 118.28 1nj2 h GLU 30 Ca 0.01 -0.59 0.00 0.00 -0.13 0.00 0.00 59.36 58.65 1nj2 h GLU 30 Cb 1.18 0.10 0.00 0.00 0.63 0.00 0.00 28.75 30.66 1nj2 h GLU 30 CO 0.12 1.21 0.00 0.00 -0.73 0.00 0.00 179.01 179.61 1nj2 n ALA 31 N -2.58 2.67 -3.73 2.92 0.00 -0.32 -4.94 120.51 114.52 1nj2 n ALA 31 Ca -0.06 -0.86 -0.33 0.00 0.00 0.00 0.00 53.44 52.19 1nj2 n ALA 31 Cb 0.70 -0.99 0.04 0.00 0.00 0.00 0.00 19.45 19.19 1nj2 n ALA 31 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1nj2 n GLU 32 N 0.67 -1.06 -0.10 0.00 1.02 -1.06 -4.70 120.64 115.41 1nj2 n GLU 32 Ca 0.15 0.44 -0.19 0.00 -0.02 0.00 0.00 57.16 57.54 1nj2 n GLU 32 Cb 0.49 -3.81 -0.10 0.00 -0.02 0.00 0.00 31.44 28.00 1nj2 n GLU 32 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 1nj2 h ILE 33 N -1.87 0.81 -3.75 -3.67 2.04 -0.73 -3.11 117.51 107.24 1nj2 h ILE 33 Ca -0.65 -2.02 -0.16 0.00 1.00 0.00 0.00 64.86 63.02 1nj2 h ILE 33 Cb 1.36 1.94 -0.21 0.00 -0.74 0.00 0.00 36.82 39.17 1nj2 h ILE 33 CO 0.47 0.27 -0.61 0.27 0.00 0.00 0.00 178.15 178.56 1nj2 s ILE 34 N -2.34 0.09 -0.27 -0.67 -4.36 -1.25 -2.59 121.20 109.81 1nj2 s ILE 34 Ca -0.27 -0.74 -0.06 0.00 -0.26 0.00 0.00 60.65 59.33 1nj2 s ILE 34 Cb 0.05 -0.32 0.00 0.00 1.25 0.00 0.00 42.46 43.45 1nj2 s ILE 34 CO 0.54 -0.40 0.05 -0.62 0.24 0.00 0.00 174.94 174.75 1nj2 s ASP 35 N -1.29 4.94 0.17 4.36 -1.08 -0.58 -4.55 116.67 118.65 1nj2 s ASP 35 Ca -0.14 -0.62 0.26 0.00 -0.52 0.00 0.00 52.55 51.53 1nj2 s ASP 35 Cb -0.08 -1.85 0.89 0.00 -1.46 0.00 0.00 42.92 40.43 1nj2 s ASP 35 CO 0.00 -0.14 1.80 0.00 0.52 0.00 0.00 175.17 177.34 1nj2 n GLN 36 N 4.84 0.21 -0.12 4.34 6.02 -1.26 -2.88 117.38 128.53 1nj2 n GLN 36 Ca -0.15 0.19 0.00 0.00 -0.01 0.00 0.00 57.00 57.03 1nj2 n GLN 36 Cb 0.49 -1.75 0.00 0.00 1.02 0.00 0.00 30.24 29.99 1nj2 n GLN 36 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1nj2 n ARG 37 N -2.12 0.40 -3.05 -1.09 1.74 -1.26 -4.86 116.66 106.42 1nj2 n ARG 37 Ca 0.06 0.00 -0.38 0.00 -0.77 0.00 0.00 57.85 56.75 1nj2 n ARG 37 Cb 0.40 -1.30 -0.06 0.00 -1.02 0.00 0.00 32.46 30.48 1nj2 n ARG 37 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 1nj2 s TYR 38 N 0.97 3.82 -1.18 -1.55 5.04 -1.26 -4.92 117.35 118.27 1nj2 s TYR 38 Ca 0.00 1.52 0.00 0.00 -2.44 0.00 0.00 57.07 56.15 1nj2 s TYR 38 Cb 0.00 -2.69 0.00 0.00 0.35 0.00 0.00 41.96 39.62 1nj2 s TYR 38 CO 0.00 0.47 0.00 -0.35 -1.34 0.00 0.00 175.55 174.33 1nj2 n PRO 39 N 1.34 0.00 -3.75 4.97 -0.04 -1.26 -4.46 135.00 131.81 1nj2 n PRO 39 Ca -0.05 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.28 1nj2 n PRO 39 Cb 0.50 -0.95 -0.11 0.00 -0.04 0.00 0.00 33.50 32.90 1nj2 n PRO 39 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1nj2 s VAL 40 N -1.18 -0.01 -0.13 0.52 1.01 -1.26 -5.13 120.40 114.21 1nj2 s VAL 40 Ca 0.00 0.02 -0.29 0.00 0.00 0.00 0.00 61.98 61.71 1nj2 s VAL 40 Cb 0.00 -0.48 -0.01 0.00 0.00 0.00 0.00 36.38 35.88 1nj2 s VAL 40 CO 0.00 0.01 1.13 -0.54 0.00 0.00 0.00 175.10 175.70 1nj2 s LYS 41 N 0.43 4.32 0.00 2.72 1.02 -1.26 -3.45 119.74 123.51 1nj2 s LYS 41 Ca -0.02 1.53 0.00 0.00 0.02 0.00 0.00 55.97 57.50 1nj2 s LYS 41 Cb -0.04 -3.62 0.00 0.00 -0.52 0.00 0.00 37.83 33.65 1nj2 s LYS 41 CO -0.02 -0.52 0.00 0.41 -0.92 0.00 0.00 175.35 174.30 1nj2 n GLY 42 N 3.34 0.79 3.03 -3.33 0.00 -1.26 -4.80 105.19 102.96 1nj2 n GLY 42 Ca 0.11 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.82 1nj2 n GLY 42 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1nj2 s MET 43 N -0.90 2.25 0.22 1.61 -1.94 -1.22 -1.88 119.30 117.44 1nj2 s MET 43 Ca 0.00 -0.83 0.11 0.00 -1.71 0.00 0.00 55.69 53.26 1nj2 s MET 43 Cb 0.00 -2.42 -0.05 0.00 2.01 0.00 0.00 34.83 34.37 1nj2 s MET 43 CO 0.00 -0.37 -0.22 -1.01 -0.01 0.00 0.00 175.02 173.41 1nj2 s HIS 44 N 1.37 2.24 -0.25 -0.03 3.76 -1.26 -4.55 115.29 116.57 1nj2 s HIS 44 Ca 0.00 -0.37 -0.09 0.00 -0.15 0.00 0.00 55.06 54.45 1nj2 s HIS 44 Cb -0.15 -1.07 -0.04 0.00 1.11 0.00 0.00 32.58 32.43 1nj2 s HIS 44 CO -0.09 0.54 0.14 0.08 -0.85 0.00 0.00 174.74 174.56 1nj2 s VAL 45 N -1.98 5.01 -0.07 -0.90 1.01 -1.14 -4.97 120.40 117.36 1nj2 s VAL 45 Ca 0.23 0.06 -0.30 0.00 0.00 0.00 0.00 61.98 61.97 1nj2 s VAL 45 Cb -0.07 -3.35 -0.03 0.00 0.00 0.00 0.00 36.38 32.93 1nj2 s VAL 45 CO 0.11 0.32 1.24 0.26 0.00 0.00 0.00 175.10 177.03 1nj2 s TRP 46 N 1.35 3.08 0.54 5.22 0.52 -1.26 -1.53 118.94 126.86 1nj2 s TRP 46 Ca 0.06 1.12 0.00 0.00 0.02 0.00 0.00 56.10 57.31 1nj2 s TRP 46 Cb -0.15 -3.47 0.03 0.00 -1.15 0.00 0.00 33.47 28.73 1nj2 s TRP 46 CO 0.06 -1.55 0.78 -1.64 0.02 0.00 0.00 176.95 174.62 1nj2 s MET 47 N 2.48 2.62 0.20 4.98 -1.94 -1.07 -4.79 119.30 121.78 1nj2 s MET 47 Ca 0.57 -0.68 -0.22 0.00 -1.71 0.00 0.00 55.69 53.66 1nj2 s MET 47 Cb -0.25 -2.47 0.14 0.00 2.01 0.00 0.00 34.83 34.26 1nj2 s MET 47 CO 0.21 -0.67 1.56 -1.35 -0.01 0.00 0.00 175.02 174.76 1nj2 h PRO 48 N 0.07 -0.06 0.19 2.03 0.11 -1.88 0.42 132.00 132.88 1nj2 h PRO 48 Ca -0.43 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.67 1nj2 h PRO 48 Cb 1.29 0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.41 1nj2 h PRO 48 CO 0.54 -0.04 -0.09 1.25 -0.21 0.00 0.00 178.00 179.45 1nj2 h HIS 49 N -0.06 -0.24 -0.22 0.65 2.76 -1.88 -2.03 115.15 114.14 1nj2 h HIS 49 Ca 0.27 -0.01 0.06 0.00 -2.20 0.00 0.00 60.37 58.49 1nj2 h HIS 49 Cb 0.56 0.08 -0.07 0.00 1.55 0.00 0.00 27.41 29.53 1nj2 h HIS 49 CO -0.84 -0.04 -0.23 0.78 -1.30 0.00 0.00 177.93 176.29 1nj2 h GLY 50 N -0.38 -0.16 -0.02 5.26 0.00 -1.32 -1.59 103.07 104.85 1nj2 h GLY 50 Ca -0.03 0.29 0.15 0.00 0.00 0.00 0.00 47.33 47.74 1nj2 h GLY 50 CO 0.04 -0.19 0.16 -2.75 0.00 0.00 0.00 176.54 173.80 1nj2 h PHE 51 N -0.25 0.25 -0.38 5.60 3.57 -0.82 -1.51 116.94 123.40 1nj2 h PHE 51 Ca 0.13 0.04 0.05 0.00 3.53 0.00 0.00 57.97 61.72 1nj2 h PHE 51 Cb 0.45 -0.00 -0.04 0.00 2.79 0.00 0.00 35.95 39.14 1nj2 h PHE 51 CO -0.38 -0.07 0.12 1.98 -2.23 0.00 0.00 178.31 177.73 1nj2 h MET 52 N 0.27 0.26 -0.54 1.11 4.05 -0.54 0.14 114.93 119.67 1nj2 h MET 52 Ca 0.39 -0.02 0.03 0.00 -0.28 0.00 0.00 59.70 59.82 1nj2 h MET 52 Cb 0.65 -0.06 -0.04 0.00 -0.80 0.00 0.00 31.60 31.35 1nj2 h MET 52 CO -0.49 0.17 0.32 0.82 0.23 0.00 0.00 176.91 177.97 1nj2 h ILE 53 N 0.27 1.05 -0.85 1.77 2.04 -0.93 -1.82 117.51 119.04 1nj2 h ILE 53 Ca 0.18 -0.22 -0.03 0.00 1.00 0.00 0.00 64.86 65.79 1nj2 h ILE 53 Cb 0.17 0.35 -0.04 0.00 -0.74 0.00 0.00 36.82 36.56 1nj2 h ILE 53 CO -0.19 0.12 0.43 -0.09 0.00 0.00 0.00 178.15 178.42 1nj2 h ARG 54 N 0.64 1.21 -0.61 2.37 2.43 -0.74 -0.92 114.38 118.75 1nj2 h ARG 54 Ca 0.22 -0.16 -0.01 0.00 -0.81 0.00 0.00 59.98 59.22 1nj2 h ARG 54 Cb 0.03 -0.23 -0.03 0.00 -0.42 0.00 0.00 29.97 29.33 1nj2 h ARG 54 CO -0.10 0.91 0.33 -0.22 -1.51 0.00 0.00 179.97 179.37 1nj2 h LYS 55 N 1.20 0.86 0.00 0.20 3.64 -0.06 -1.62 116.57 120.79 1nj2 h LYS 55 Ca 0.30 -0.10 -0.14 0.00 -1.27 0.00 0.00 60.65 59.43 1nj2 h LYS 55 Cb 0.08 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 31.71 1nj2 h LYS 55 CO -0.04 0.66 -0.68 -0.91 -2.27 0.00 0.00 179.45 176.20 1nj2 h ASN 56 N 0.83 0.00 -0.48 4.20 2.35 -1.06 -2.75 115.58 118.67 1nj2 h ASN 56 Ca 0.21 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.90 1nj2 h ASN 56 Cb 0.06 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.41 1nj2 h ASN 56 CO -0.03 0.68 0.05 0.74 -1.65 0.00 0.00 177.43 177.22 1nj2 h THR 57 N 0.00 1.25 0.00 2.81 2.02 -0.88 -2.82 112.91 115.29 1nj2 h THR 57 Ca -0.01 -0.98 -0.09 0.00 0.77 0.00 0.00 66.41 66.11 1nj2 h THR 57 Cb 1.30 0.95 -0.01 0.00 -1.74 0.00 0.00 68.15 68.65 1nj2 h THR 57 CO 0.09 0.34 -0.43 -0.07 0.37 0.00 0.00 175.52 175.82 1nj2 h LEU 58 N 0.68 0.00 -0.89 2.58 3.38 -1.24 -2.84 115.31 116.98 1nj2 h LEU 58 Ca 0.14 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.11 1nj2 h LEU 58 Cb 0.44 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.14 1nj2 h LEU 58 CO 0.01 0.43 0.54 0.11 0.09 0.00 0.00 178.44 179.63 1nj2 h LYS 59 N 0.00 1.21 0.05 1.13 1.57 -1.23 0.10 116.57 119.40 1nj2 h LYS 59 Ca -0.00 -0.11 -0.00 0.00 -1.87 0.00 0.00 60.65 58.66 1nj2 h LYS 59 Cb 0.77 -0.25 0.00 0.00 0.08 0.00 0.00 32.23 32.83 1nj2 h LYS 59 CO 0.06 0.85 -0.02 0.82 -0.57 0.00 0.00 179.45 180.58 1nj2 h ILE 60 N 1.23 1.19 -0.01 1.86 2.04 -1.44 -2.01 117.51 120.36 1nj2 h ILE 60 Ca 0.32 -0.77 0.03 0.00 1.00 0.00 0.00 64.86 65.44 1nj2 h ILE 60 Cb -0.05 1.69 -0.04 0.00 -0.74 0.00 0.00 36.82 37.69 1nj2 h ILE 60 CO -0.06 0.19 -0.17 0.25 0.00 0.00 0.00 178.15 178.36 1nj2 h LEU 61 N -0.40 -0.51 -1.39 1.44 5.85 -1.24 -2.62 115.31 116.43 1nj2 h LEU 61 Ca -0.01 0.08 -0.04 0.00 0.84 0.00 0.00 57.88 58.75 1nj2 h LEU 61 Cb 0.37 0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.60 1nj2 h LEU 61 CO 0.01 -0.24 0.00 0.03 -0.34 0.00 0.00 178.44 177.91 1nj2 h ARG 62 N -0.28 0.40 0.00 1.25 3.08 -0.83 -2.32 114.38 115.68 1nj2 h ARG 62 Ca 0.06 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 60.04 1nj2 h ARG 62 Cb 0.36 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.34 1nj2 h ARG 62 CO -0.18 0.43 0.00 0.07 -1.07 0.00 0.00 179.97 179.22 1nj2 h ARG 63 N 0.39 0.00 0.00 0.04 0.11 -0.97 -0.77 114.38 113.19 1nj2 h ARG 63 Ca 0.09 0.00 -0.21 0.00 0.10 0.00 0.00 59.98 59.96 1nj2 h ARG 63 Cb 0.26 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 31.31 1nj2 h ARG 63 CO 0.01 0.00 -1.33 -0.89 0.10 0.00 0.00 179.97 177.85 1nj2 n ILE 64 N -2.70 1.50 -0.18 0.08 5.41 -0.91 -4.37 119.36 118.19 1nj2 n ILE 64 Ca -0.00 -0.03 -0.01 0.00 1.00 0.00 0.00 62.75 63.71 1nj2 n ILE 64 Cb 0.18 -2.11 0.09 0.00 -0.71 0.00 0.00 39.64 37.09 1nj2 n ILE 64 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 1nj2 h LEU 65 N -1.00 0.05 0.00 1.39 3.38 -1.33 -1.85 115.31 115.95 1nj2 h LEU 65 Ca -0.32 0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.75 1nj2 h LEU 65 Cb 1.17 0.12 0.00 0.00 0.09 0.00 0.00 40.66 42.04 1nj2 h LEU 65 CO -0.19 0.04 0.02 0.47 0.09 0.00 0.00 178.44 178.87 1nj2 n ASP 66 N -5.09 0.00 -0.05 -0.43 8.00 -0.31 -1.60 116.55 117.07 1nj2 n ASP 66 Ca 0.08 0.15 -0.13 0.00 0.71 0.00 0.00 54.79 55.60 1nj2 n ASP 66 Cb 0.28 -0.15 -0.07 0.00 -0.02 0.00 0.00 41.12 41.15 1nj2 n ASP 66 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 1nj2 h ARG 67 N 0.00 0.31 0.00 -1.24 3.08 -1.54 -3.39 114.38 111.61 1nj2 h ARG 67 Ca 0.00 -0.17 0.00 0.00 0.07 0.00 0.00 59.98 59.88 1nj2 h ARG 67 Cb 0.04 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.09 1nj2 h ARG 67 CO 0.00 0.71 -0.06 -0.25 -1.07 0.00 0.00 179.97 179.30 1nj2 n ASP 68 N -4.59 0.75 -4.66 7.04 8.00 -1.00 -5.08 116.55 117.01 1nj2 n ASP 68 Ca -0.06 -1.57 -0.24 0.00 0.71 0.00 0.00 54.79 53.63 1nj2 n ASP 68 Cb 0.35 -0.06 -0.08 0.00 -0.02 0.00 0.00 41.12 41.31 1nj2 n ASP 68 CO 0.00 0.00 0.00 -1.00 -0.39 0.00 0.00 177.20 175.81 1nj2 s HIS 69 N -0.50 2.61 -0.14 1.24 3.76 -0.63 -4.73 115.29 116.91 1nj2 s HIS 69 Ca 0.02 -0.38 0.00 0.00 -0.15 0.00 0.00 55.06 54.56 1nj2 s HIS 69 Cb 0.02 -1.46 0.02 0.00 1.11 0.00 0.00 32.58 32.27 1nj2 s HIS 69 CO 0.00 0.47 -0.13 -1.21 -0.85 0.00 0.00 174.74 173.03 1nj2 s GLU 70 N -3.74 2.12 0.30 1.40 2.02 0.12 -4.61 118.70 116.31 1nj2 s GLU 70 Ca 0.35 -0.49 -0.27 0.00 0.02 0.00 0.00 54.97 54.58 1nj2 s GLU 70 Cb -0.02 -1.98 -0.09 0.00 0.10 0.00 0.00 34.13 32.14 1nj2 s GLU 70 CO 0.20 -0.24 0.98 -2.00 0.02 0.00 0.00 175.26 174.22 1nj2 s GLU 71 N 1.52 4.63 0.00 1.61 2.12 -1.26 -2.66 118.70 124.66 1nj2 s GLU 71 Ca 0.05 1.46 0.00 0.00 0.36 0.00 0.00 54.97 56.84 1nj2 s GLU 71 Cb -0.13 -2.97 0.00 0.00 0.26 0.00 0.00 34.13 31.29 1nj2 s GLU 71 CO -0.10 0.30 0.00 1.33 -0.54 0.00 0.00 175.26 176.25 1nj2 n VAL 72 N 0.86 0.00 -3.15 3.70 0.24 -0.54 -4.92 118.33 114.53 1nj2 n VAL 72 Ca 0.01 0.00 0.05 0.00 -2.04 0.00 0.00 64.34 62.36 1nj2 n VAL 72 Cb 0.48 0.00 -0.01 0.00 -1.47 0.00 0.00 33.84 32.85 1nj2 n VAL 72 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 1nj2 s LEU 73 N 0.00 -0.74 0.72 1.34 2.96 -1.26 -4.57 118.68 117.13 1nj2 s LEU 73 Ca 0.00 0.20 -0.03 0.00 -0.22 0.00 0.00 54.13 54.08 1nj2 s LEU 73 Cb 0.00 1.51 0.11 0.00 0.50 0.00 0.00 46.19 48.31 1nj2 s LEU 73 CO 0.00 -0.14 1.00 -0.36 -1.32 0.00 0.00 176.35 175.53 1nj2 s PHE 74 N 2.92 2.03 1.10 5.38 0.40 -1.26 -5.10 117.98 123.46 1nj2 s PHE 74 Ca 0.16 -0.04 -0.19 0.00 -0.60 0.00 0.00 56.93 56.26 1nj2 s PHE 74 Cb -0.07 -3.12 0.26 0.00 0.51 0.00 0.00 43.02 40.61 1nj2 s PHE 74 CO -0.20 -1.63 1.25 -2.14 0.70 0.00 0.00 175.22 173.20 1nj2 s PRO 75 N -5.18 -0.49 -0.12 0.24 0.02 -1.26 -5.04 135.00 123.17 1nj2 s PRO 75 Ca 0.65 -0.37 0.06 0.00 0.02 0.00 0.00 61.00 61.36 1nj2 s PRO 75 Cb -0.07 -1.71 -0.24 0.00 0.02 0.00 0.00 34.50 32.51 1nj2 s PRO 75 CO 0.44 -3.18 0.36 -0.11 -0.33 0.00 0.00 177.00 174.19 1nj2 n LEU 76 N -4.31 1.52 -4.84 -5.54 7.94 -1.26 -4.97 117.00 105.54 1nj2 n LEU 76 Ca 0.16 0.22 -0.38 0.00 -1.11 0.00 0.00 56.01 54.90 1nj2 n LEU 76 Cb 0.59 -0.30 -0.06 0.00 0.53 0.00 0.00 43.42 44.19 1nj2 n LEU 76 CO 0.43 0.62 0.06 -0.76 -1.11 0.00 0.00 177.39 176.63 1nj2 s LEU 77 N -6.33 4.45 -0.09 -1.96 1.43 -1.26 -2.23 118.68 112.69 1nj2 s LEU 77 Ca -0.15 0.87 0.02 0.00 -1.03 0.00 0.00 54.13 53.84 1nj2 s LEU 77 Cb 0.07 -2.50 0.01 0.00 0.03 0.00 0.00 46.19 43.80 1nj2 s LEU 77 CO 0.78 0.32 -0.14 -0.69 0.23 0.00 0.00 176.35 176.85 1nj2 s VAL 78 N -0.97 1.39 0.35 -1.59 1.01 -0.40 -4.91 120.40 115.29 1nj2 s VAL 78 Ca 0.22 -0.60 -0.28 0.00 0.00 0.00 0.00 61.98 61.33 1nj2 s VAL 78 Cb -0.16 -1.27 -0.12 0.00 0.00 0.00 0.00 36.38 34.83 1nj2 s VAL 78 CO 0.12 0.42 1.26 -2.65 0.00 0.00 0.00 175.10 174.25 1nj2 n PRO 79 N 4.07 2.04 -0.10 2.72 -0.02 -1.26 -0.85 135.00 141.60 1nj2 n PRO 79 Ca -0.20 0.72 0.05 0.00 -2.02 0.00 0.00 63.50 62.05 1nj2 n PRO 79 Cb 0.51 -2.30 0.38 0.00 -0.02 0.00 0.00 33.50 32.08 1nj2 n PRO 79 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1nj2 h GLU 80 N 2.44 0.66 0.42 -0.52 4.81 -1.61 -2.84 114.58 117.95 1nj2 h GLU 80 Ca -0.46 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 58.71 1nj2 h GLU 80 Cb 1.29 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 30.52 1nj2 h GLU 80 CO 0.62 0.44 -0.20 0.22 -0.73 0.00 0.00 179.01 179.35 1nj2 h ASP 81 N 0.68 -0.48 -1.10 1.04 1.82 -1.91 -3.12 116.42 113.35 1nj2 h ASP 81 Ca 0.24 0.02 0.32 0.00 -0.39 0.00 0.00 57.03 57.21 1nj2 h ASP 81 Cb 0.10 0.12 -0.12 0.00 0.68 0.00 0.00 39.33 40.12 1nj2 h ASP 81 CO -0.06 -0.24 0.68 -0.33 -1.61 0.00 0.00 179.24 177.68 1nj2 h GLU 82 N -0.78 0.31 0.00 0.28 4.39 -1.91 -3.02 114.58 113.85 1nj2 h GLU 82 Ca -0.06 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.62 1nj2 h GLU 82 Cb 0.44 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.01 1nj2 h GLU 82 CO 0.10 0.21 0.00 1.28 -1.16 0.00 0.00 179.01 179.43 1nj2 n LEU 83 N -4.76 0.67 -3.82 1.33 4.77 -1.08 -4.94 117.00 109.16 1nj2 n LEU 83 Ca 0.30 0.40 -0.31 0.00 -0.03 0.00 0.00 56.01 56.37 1nj2 n LEU 83 Cb 1.02 -0.01 0.01 0.00 -2.33 0.00 0.00 43.42 42.11 1nj2 n LEU 83 CO 0.20 -0.01 -0.16 0.00 -1.33 0.00 0.00 177.39 176.09 1nj2 n ALA 84 N -0.54 -2.70 0.00 -1.18 0.00 -1.15 -5.05 120.51 109.89 1nj2 n ALA 84 Ca 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.09 1nj2 n ALA 84 Cb 0.00 -1.74 0.00 0.00 0.00 0.00 0.00 19.45 17.71 1nj2 n ALA 84 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1nj2 n GLU 96 N -3.52 0.00 -4.02 0.00 1.02 -1.26 -5.17 120.64 107.69 1nj2 n GLU 96 Ca -0.21 0.00 -0.31 0.00 -0.02 0.00 0.00 57.16 56.63 1nj2 n GLU 96 Cb 0.63 0.00 -0.16 0.00 -0.02 0.00 0.00 31.44 31.89 1nj2 n GLU 96 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1nj2 s VAL 97 N 0.00 1.65 0.23 2.62 1.01 -1.26 -2.93 120.40 121.73 1nj2 s VAL 97 Ca 0.00 -0.80 -0.31 0.00 0.00 0.00 0.00 61.98 60.87 1nj2 s VAL 97 Cb 0.00 -1.60 -0.14 0.00 0.00 0.00 0.00 36.38 34.64 1nj2 s VAL 97 CO 0.00 0.37 1.32 -1.22 0.00 0.00 0.00 175.10 175.57 1nj2 n TYR 98 N 4.72 1.91 -5.07 5.22 4.02 -1.26 -4.93 117.16 121.77 1nj2 n TYR 98 Ca -0.17 0.52 -0.32 0.00 -0.01 0.00 0.00 57.90 57.92 1nj2 n TYR 98 Cb 0.49 -2.40 -0.14 0.00 -0.02 0.00 0.00 39.34 37.26 1nj2 n TYR 98 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 176.86 174.27 1nj2 s TRP 99 N -0.23 2.54 -0.30 -0.72 0.52 -1.26 -2.95 118.94 116.55 1nj2 s TRP 99 Ca 0.68 -0.28 -0.11 0.00 0.02 0.00 0.00 56.10 56.41 1nj2 s TRP 99 Cb -0.69 -1.57 -0.03 0.00 -1.15 0.00 0.00 33.47 30.03 1nj2 s TRP 99 CO 0.52 0.09 0.17 0.08 0.02 0.00 0.00 176.95 177.83 1nj2 s VAL 100 N -0.67 4.94 -0.15 4.03 1.01 0.17 -4.97 120.40 124.75 1nj2 s VAL 100 Ca 0.11 -0.16 -0.07 0.00 0.00 0.00 0.00 61.98 61.85 1nj2 s VAL 100 Cb -0.10 -3.45 -0.07 0.00 0.00 0.00 0.00 36.38 32.76 1nj2 s VAL 100 CO -0.00 0.14 -0.19 0.35 0.00 0.00 0.00 175.10 175.40 1nj2 n THR 101 N 5.03 0.83 -4.04 3.92 -2.24 -1.26 -2.10 114.28 114.42 1nj2 n THR 101 Ca -0.14 -0.22 -0.22 0.00 -2.27 0.00 0.00 64.05 61.20 1nj2 n THR 101 Cb 0.50 -1.67 -0.03 0.00 -2.10 0.00 0.00 70.33 67.03 1nj2 n THR 101 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1nj2 s HIS 102 N -2.28 3.29 -0.43 4.78 3.76 -1.26 -1.76 115.29 121.39 1nj2 s HIS 102 Ca -0.21 -0.04 0.05 0.00 -0.15 0.00 0.00 55.06 54.70 1nj2 s HIS 102 Cb 0.08 -1.51 0.43 0.00 1.11 0.00 0.00 32.58 32.69 1nj2 s HIS 102 CO 0.27 0.49 1.23 0.41 -0.85 0.00 0.00 174.74 176.28 1nj2 n GLY 103 N -1.12 6.08 0.00 -2.22 0.00 0.27 -4.90 105.19 103.30 1nj2 n GLY 103 Ca -0.08 -2.71 0.00 0.00 0.00 0.00 0.00 46.02 43.23 1nj2 n GLY 103 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nj2 n GLY 104 N -0.56 1.33 0.20 -0.02 0.00 -1.26 -4.41 105.19 100.47 1nj2 n GLY 104 Ca 0.42 -0.96 0.05 0.00 0.00 0.00 0.00 46.02 45.52 1nj2 n GLY 104 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1nj2 n LEU 105 N 0.00 1.11 -4.63 0.99 4.77 -1.26 -4.93 117.00 113.05 1nj2 n LEU 105 Ca 0.00 -0.74 -0.40 0.00 -0.03 0.00 0.00 56.01 54.84 1nj2 n LEU 105 Cb 0.00 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.02 1nj2 n LEU 105 CO 0.00 0.23 0.34 -0.94 -1.33 0.00 0.00 177.39 175.69 1nj2 s SER 106 N -1.38 6.55 0.03 -1.43 1.04 -1.26 -5.04 113.70 112.21 1nj2 s SER 106 Ca 0.08 0.67 -0.30 0.00 0.48 0.00 0.00 55.95 56.87 1nj2 s SER 106 Cb 0.08 -2.32 -0.05 0.00 0.10 0.00 0.00 66.02 63.83 1nj2 s SER 106 CO 0.26 -0.32 1.20 -0.75 0.98 0.00 0.00 173.24 174.61 1nj2 s LYS 107 N 2.33 4.41 0.90 4.02 2.20 -1.26 -0.57 119.74 131.77 1nj2 s LYS 107 Ca 0.25 1.75 -0.14 0.00 -0.36 0.00 0.00 55.97 57.47 1nj2 s LYS 107 Cb -0.16 -3.40 0.14 0.00 -1.51 0.00 0.00 37.83 32.90 1nj2 s LYS 107 CO 0.09 -0.31 1.20 -0.51 -0.36 0.00 0.00 175.35 175.46 1nj2 s LEU 108 N 1.37 2.31 -0.30 5.43 1.43 -0.72 -4.93 118.68 123.27 1nj2 s LEU 108 Ca 0.58 0.69 0.10 0.00 -1.03 0.00 0.00 54.13 54.47 1nj2 s LEU 108 Cb -0.28 -2.97 0.58 0.00 0.03 0.00 0.00 46.19 43.54 1nj2 s LEU 108 CO 0.28 -2.43 1.59 0.00 0.23 0.00 0.00 176.35 176.01 1nj2 n GLN 109 N -3.65 2.44 0.00 1.70 6.02 -1.26 -4.82 117.38 117.81 1nj2 n GLN 109 Ca 0.10 -3.07 0.00 0.00 -0.01 0.00 0.00 57.00 54.02 1nj2 n GLN 109 Cb 0.60 -1.95 0.00 0.00 1.02 0.00 0.00 30.24 29.91 1nj2 n GLN 109 CO 0.00 0.00 0.00 -2.13 -1.01 0.00 0.00 177.06 173.92 1nj2 n ARG 110 N -0.85 0.00 -1.87 -1.09 0.63 -1.26 -5.14 116.66 107.08 1nj2 n ARG 110 Ca 0.37 0.00 -0.36 0.00 -0.92 0.00 0.00 57.85 56.93 1nj2 n ARG 110 Cb 1.17 0.00 0.05 0.00 0.45 0.00 0.00 32.46 34.14 1nj2 n ARG 110 CO 0.00 0.00 0.00 0.15 -2.51 0.00 0.00 177.63 175.27 1nj2 s LYS 111 N 0.00 2.74 -0.11 -0.14 1.02 -1.26 -4.81 119.74 117.18 1nj2 s LYS 111 Ca 0.00 1.95 0.01 0.00 0.02 0.00 0.00 55.97 57.95 1nj2 s LYS 111 Cb 0.00 -1.88 -0.02 0.00 -0.52 0.00 0.00 37.83 35.41 1nj2 s LYS 111 CO 0.00 -1.42 -0.13 -0.51 -0.92 0.00 0.00 175.35 172.37 1nj2 s LEU 112 N -4.24 2.74 -0.06 3.17 1.43 -0.89 -1.58 118.68 119.26 1nj2 s LEU 112 Ca 0.80 -0.29 0.02 0.00 -1.03 0.00 0.00 54.13 53.63 1nj2 s LEU 112 Cb -0.34 -1.60 -0.03 0.00 0.03 0.00 0.00 46.19 44.25 1nj2 s LEU 112 CO 0.37 0.21 -0.10 0.00 0.23 0.00 0.00 176.35 177.05 1nj2 s ALA 113 N 0.10 2.83 -0.03 4.21 0.00 -0.03 0.46 121.76 129.30 1nj2 s ALA 113 Ca -0.06 -0.93 -0.30 0.00 0.00 0.00 0.00 51.96 50.67 1nj2 s ALA 113 Cb -0.15 -1.11 -0.04 0.00 0.00 0.00 0.00 23.12 21.81 1nj2 s ALA 113 CO 0.04 0.56 1.35 -0.51 0.00 0.00 0.00 175.76 177.20 1nj2 s LEU 114 N -0.75 4.29 -0.43 0.00 1.43 -1.15 -1.27 118.68 120.80 1nj2 s LEU 114 Ca 0.11 2.00 -0.42 0.00 -1.03 0.00 0.00 54.13 54.80 1nj2 s LEU 114 Cb -0.11 -3.56 -0.17 0.00 0.03 0.00 0.00 46.19 42.39 1nj2 s LEU 114 CO 0.01 -0.70 2.01 -2.11 0.23 0.00 0.00 176.35 175.79 1nj2 n ARG 115 N 5.56 0.45 0.18 1.70 1.85 -0.94 -4.69 116.66 120.76 1nj2 n ARG 115 Ca 0.13 0.14 -0.10 0.00 -1.00 0.00 0.00 57.85 57.02 1nj2 n ARG 115 Cb 0.44 -1.83 -0.05 0.00 -1.05 0.00 0.00 32.46 29.97 1nj2 n ARG 115 CO 0.00 0.00 0.00 -1.35 -0.01 0.00 0.00 177.63 176.27 1nj2 h PRO 116 N 8.97 -0.50 -2.28 2.89 0.11 -1.89 -3.16 132.00 136.15 1nj2 h PRO 116 Ca -0.25 0.03 -0.07 0.00 0.11 0.00 0.00 66.00 65.82 1nj2 h PRO 116 Cb 1.37 0.11 -0.22 0.00 0.11 0.00 0.00 31.00 32.37 1nj2 h PRO 116 CO 1.04 -0.26 -0.01 0.99 -0.21 0.00 0.00 178.00 179.54 1nj2 s THR 117 N -3.52 -0.00 0.63 -1.15 2.01 -1.26 -4.72 115.64 107.63 1nj2 s THR 117 Ca -0.10 0.00 0.28 0.00 0.31 0.00 0.00 61.69 62.18 1nj2 s THR 117 Cb 0.01 -0.84 0.32 0.00 0.01 0.00 0.00 72.50 72.00 1nj2 s THR 117 CO 0.31 0.00 1.84 0.28 -0.69 0.00 0.00 174.62 176.36 1nj2 h SER 118 N 5.25 0.00 -0.14 3.53 0.02 -1.99 -3.34 113.55 116.88 1nj2 h SER 118 Ca -0.28 0.00 0.01 0.00 -0.84 0.00 0.00 61.79 60.68 1nj2 h SER 118 Cb 1.17 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.69 1nj2 h SER 118 CO 0.13 0.00 -0.08 -0.62 -1.14 0.00 0.00 176.83 175.11 1nj2 n GLU 119 N -3.21 -0.06 0.29 3.45 -0.58 -1.26 -0.80 120.64 118.47 1nj2 n GLU 119 Ca 0.03 0.40 0.17 0.00 -0.42 0.00 0.00 57.16 57.34 1nj2 n GLU 119 Cb 0.56 -0.59 0.88 0.00 -0.57 0.00 0.00 31.44 31.72 1nj2 n GLU 119 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1nj2 h THR 120 N 0.00 0.10 0.00 2.62 1.03 -1.93 -3.24 112.91 111.50 1nj2 h THR 120 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 66.41 66.42 1nj2 h THR 120 Cb 0.06 0.74 0.00 0.00 -1.07 0.00 0.00 68.15 67.88 1nj2 h THR 120 CO -0.13 0.00 0.00 0.52 -0.01 0.00 0.00 175.52 175.90 1nj2 n VAL 121 N -3.13 0.03 0.02 0.00 0.31 0.02 -4.54 118.33 111.05 1nj2 n VAL 121 Ca -0.01 -0.18 -0.10 0.00 -0.01 0.00 0.00 64.34 64.04 1nj2 n VAL 121 Cb 0.35 1.59 -0.13 0.00 -0.91 0.00 0.00 33.84 34.74 1nj2 n VAL 121 CO 0.00 0.00 0.00 0.24 -1.32 0.00 0.00 176.83 175.75 1nj2 h MET 122 N 0.00 0.06 0.56 5.55 2.07 -1.41 -3.37 114.93 118.40 1nj2 h MET 122 Ca 0.00 -0.11 -0.03 0.00 -2.07 0.00 0.00 59.70 57.50 1nj2 h MET 122 Cb 0.39 0.04 0.01 0.00 -1.87 0.00 0.00 31.60 30.16 1nj2 h MET 122 CO 0.00 0.82 -0.27 1.88 1.07 0.00 0.00 176.91 180.41 1nj2 h TYR 123 N 0.02 -0.70 -1.02 -0.22 -1.99 -1.78 -1.17 116.97 110.10 1nj2 h TYR 123 Ca -0.19 -0.02 0.28 0.00 2.00 0.00 0.00 58.73 60.81 1nj2 h TYR 123 Cb 1.93 0.23 -0.13 0.00 2.00 0.00 0.00 36.73 40.77 1nj2 h TYR 123 CO 0.02 -0.39 0.61 -1.00 -0.00 0.00 0.00 178.16 177.40 1nj2 h PRO 124 N -1.13 0.43 -0.36 4.88 0.13 -1.80 0.90 132.00 135.05 1nj2 h PRO 124 Ca -0.08 -0.03 -0.12 0.00 -0.87 0.00 0.00 66.00 64.91 1nj2 h PRO 124 Cb 0.63 -0.10 -0.01 0.00 0.13 0.00 0.00 31.00 31.64 1nj2 h PRO 124 CO 0.13 0.28 -0.24 1.98 -0.23 0.00 0.00 178.00 179.92 1nj2 h MET 125 N 0.44 0.73 0.00 0.86 1.85 -1.70 -2.36 114.93 114.76 1nj2 h MET 125 Ca 0.68 -0.30 -0.01 0.00 -0.61 0.00 0.00 59.70 59.46 1nj2 h MET 125 Cb 1.49 -0.03 -0.00 0.00 0.43 0.00 0.00 31.60 33.49 1nj2 h MET 125 CO -0.49 0.91 -0.02 0.74 -0.40 0.00 0.00 176.91 177.64 1nj2 h PHE 126 N 0.64 0.00 -0.75 1.39 0.05 0.21 -0.39 116.94 118.09 1nj2 h PHE 126 Ca 0.09 0.00 -0.00 0.00 3.82 0.00 0.00 57.97 61.87 1nj2 h PHE 126 Cb 0.75 0.00 -0.04 0.00 2.00 0.00 0.00 35.95 38.66 1nj2 h PHE 126 CO 0.04 0.02 0.45 0.00 -0.18 0.00 0.00 178.31 178.64 1nj2 h ALA 127 N 1.98 0.95 0.00 2.45 0.00 -0.69 -2.39 119.26 121.55 1nj2 h ALA 127 Ca -0.00 -0.09 -0.12 0.00 0.00 0.00 0.00 54.91 54.70 1nj2 h ALA 127 Cb 0.06 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 1nj2 h ALA 127 CO 0.00 0.42 -0.57 -0.07 0.00 0.00 0.00 179.25 179.03 1nj2 h LEU 128 N 1.02 0.00 0.00 0.00 3.38 -1.14 -3.20 115.31 115.37 1nj2 h LEU 128 Ca 0.27 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.24 1nj2 h LEU 128 Cb -0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.71 1nj2 h LEU 128 CO -0.05 0.57 -0.05 -0.50 0.09 0.00 0.00 178.44 178.50 1nj2 h TRP 129 N 0.00 0.00 -3.70 1.13 4.06 -1.11 -3.44 115.95 112.89 1nj2 h TRP 129 Ca -0.01 0.00 -0.64 0.00 2.06 0.00 0.00 58.89 60.30 1nj2 h TRP 129 Cb 1.17 0.00 -0.21 0.00 -1.00 0.00 0.00 29.16 29.13 1nj2 h TRP 129 CO 0.00 0.00 -0.59 0.08 -3.56 0.00 0.00 178.44 174.37 1nj2 s VAL 130 N -3.20 4.63 -0.37 1.49 1.01 -0.93 -4.96 120.40 118.07 1nj2 s VAL 130 Ca 0.07 -0.06 0.11 0.00 0.00 0.00 0.00 61.98 62.10 1nj2 s VAL 130 Cb 0.06 -3.18 0.40 0.00 0.00 0.00 0.00 36.38 33.67 1nj2 s VAL 130 CO 0.66 0.32 1.40 0.54 0.00 0.00 0.00 175.10 178.02 1nj2 n ARG 131 N 4.88 1.27 0.00 2.72 1.74 -1.26 -4.73 116.66 121.28 1nj2 n ARG 131 Ca -0.16 -1.73 0.00 0.00 -0.77 0.00 0.00 57.85 55.20 1nj2 n ARG 131 Cb 0.52 0.02 0.00 0.00 -1.02 0.00 0.00 32.46 31.97 1nj2 n ARG 131 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1nj2 n SER 132 N -0.90 0.00 0.00 0.55 7.64 -1.26 -4.59 113.62 115.06 1nj2 n SER 132 Ca -0.07 0.00 0.04 0.00 1.01 0.00 0.00 58.87 59.85 1nj2 n SER 132 Cb 0.86 0.00 0.24 0.00 -1.01 0.00 0.00 64.21 64.30 1nj2 n SER 132 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1nj2 n HIS 133 N -0.37 0.00 0.15 1.43 1.44 -0.74 -0.58 115.22 116.55 1nj2 n HIS 133 Ca 0.00 0.00 0.06 0.00 -2.01 0.00 0.00 57.72 55.77 1nj2 n HIS 133 Cb 0.00 -0.16 0.06 0.00 0.12 0.00 0.00 29.99 30.00 1nj2 n HIS 133 CO 0.00 0.00 0.00 1.79 -2.81 0.00 0.00 176.34 175.32 1nj2 h THR 134 N 0.00 0.54 -0.01 0.61 1.35 -1.93 -3.33 112.91 110.14 1nj2 h THR 134 Ca 0.00 -1.78 -0.05 0.00 -0.55 0.00 0.00 66.41 64.03 1nj2 h THR 134 Cb 0.05 2.22 0.00 0.00 -1.73 0.00 0.00 68.15 68.69 1nj2 h THR 134 CO 0.00 0.31 -0.19 0.44 -0.25 0.00 0.00 175.52 175.82 1nj2 h ASP 135 N 0.00 0.19 -4.12 5.36 3.32 -1.23 -3.46 116.42 116.49 1nj2 h ASP 135 Ca -0.02 -0.74 -0.51 0.00 0.02 0.00 0.00 57.03 55.79 1nj2 h ASP 135 Cb 1.27 -0.06 0.08 0.00 0.22 0.00 0.00 39.33 40.85 1nj2 h ASP 135 CO 0.04 0.90 0.42 -0.76 -1.72 0.00 0.00 179.24 178.12 1nj2 s LEU 136 N -8.62 3.64 0.63 1.55 1.43 -1.24 -4.59 118.68 111.48 1nj2 s LEU 136 Ca -0.16 2.15 -0.08 0.00 -1.03 0.00 0.00 54.13 55.01 1nj2 s LEU 136 Cb 0.01 -4.58 0.01 0.00 0.03 0.00 0.00 46.19 41.66 1nj2 s LEU 136 CO 0.73 -1.37 0.97 -2.16 0.23 0.00 0.00 176.35 174.75 1nj2 s PRO 137 N -3.50 2.93 -0.01 1.29 0.04 -1.26 -4.99 135.00 129.50 1nj2 s PRO 137 Ca 0.72 0.18 0.02 0.00 0.04 0.00 0.00 61.00 61.96 1nj2 s PRO 137 Cb -0.24 -2.18 -0.00 0.00 0.04 0.00 0.00 34.50 32.12 1nj2 s PRO 137 CO 0.31 -0.80 -0.06 -1.64 0.04 0.00 0.00 177.00 174.85 1nj2 s MET 138 N -5.12 0.58 -0.25 4.56 -1.94 -0.96 -4.99 119.30 111.18 1nj2 s MET 138 Ca 0.55 -0.22 -0.03 0.00 -1.71 0.00 0.00 55.69 54.28 1nj2 s MET 138 Cb -0.11 -0.57 0.08 0.00 2.01 0.00 0.00 34.83 36.25 1nj2 s MET 138 CO 0.48 0.12 0.09 1.03 -0.01 0.00 0.00 175.02 176.72 1nj2 s ARG 139 N -0.01 0.45 0.46 2.03 0.52 -1.26 -1.34 118.95 119.79 1nj2 s ARG 139 Ca 0.01 -0.56 0.06 0.00 -0.52 0.00 0.00 55.73 54.72 1nj2 s ARG 139 Cb -0.04 -1.77 -0.02 0.00 0.52 0.00 0.00 34.95 33.63 1nj2 s ARG 139 CO -0.00 -0.84 0.24 -0.06 0.02 0.00 0.00 175.30 174.66 1nj2 s PHE 140 N 1.91 2.31 -0.22 -0.53 2.99 -0.72 0.14 117.98 123.86 1nj2 s PHE 140 Ca 0.05 -0.67 -0.32 0.00 0.00 0.00 0.00 56.93 55.99 1nj2 s PHE 140 Cb -0.17 -1.94 0.16 0.00 0.00 0.00 0.00 43.02 41.07 1nj2 s PHE 140 CO -0.21 -0.01 1.21 1.52 -0.00 0.00 0.00 175.22 177.73 1nj2 s TYR 141 N -2.65 -0.16 0.03 0.36 -0.85 -1.09 -2.07 117.35 110.92 1nj2 s TYR 141 Ca 0.37 0.21 -0.06 0.00 -0.52 0.00 0.00 57.07 57.07 1nj2 s TYR 141 Cb 0.01 0.49 -0.01 0.00 0.38 0.00 0.00 41.96 42.84 1nj2 s TYR 141 CO 0.21 -0.18 0.11 1.14 -1.52 0.00 0.00 175.55 175.32 1nj2 s GLN 142 N -1.57 0.57 -0.38 -3.49 -2.07 -0.97 -1.46 119.66 110.28 1nj2 s GLN 142 Ca 0.06 -0.66 -0.02 0.00 -1.82 0.00 0.00 55.36 52.93 1nj2 s GLN 142 Cb -0.01 0.23 0.10 0.00 -1.09 0.00 0.00 33.01 32.24 1nj2 s GLN 142 CO -0.04 -0.14 0.15 0.08 -1.32 0.00 0.00 175.29 174.01 1nj2 s VAL 143 N -2.31 3.11 0.21 3.63 1.01 -1.26 -1.90 120.40 122.88 1nj2 s VAL 143 Ca -0.07 -1.98 0.01 0.00 0.00 0.00 0.00 61.98 59.94 1nj2 s VAL 143 Cb -0.03 -3.09 -0.01 0.00 0.00 0.00 0.00 36.38 33.26 1nj2 s VAL 143 CO -0.03 -0.58 0.05 1.33 0.00 0.00 0.00 175.10 175.87 1nj2 n VAL 144 N 4.55 0.00 -4.45 2.92 0.24 -1.02 -4.87 118.33 115.70 1nj2 n VAL 144 Ca -0.03 -1.15 -0.31 0.00 -2.04 0.00 0.00 64.34 60.81 1nj2 n VAL 144 Cb 0.42 0.36 -0.11 0.00 -1.47 0.00 0.00 33.84 33.04 1nj2 n VAL 144 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1nj2 s ASN 145 N -2.24 4.29 0.24 -1.34 4.22 -1.26 -1.53 114.94 117.32 1nj2 s ASN 145 Ca 0.07 -0.31 0.05 0.00 -2.14 0.00 0.00 52.86 50.53 1nj2 s ASN 145 Cb 0.00 -0.85 -0.05 0.00 1.28 0.00 0.00 41.25 41.63 1nj2 s ASN 145 CO 0.05 0.24 -0.05 -0.89 -2.04 0.00 0.00 177.10 174.41 1nj2 s THR 146 N -1.04 1.38 0.04 0.54 2.01 -1.01 -4.92 115.64 112.64 1nj2 s THR 146 Ca 0.18 -2.09 0.04 0.00 0.31 0.00 0.00 61.69 60.13 1nj2 s THR 146 Cb -0.11 -2.32 -0.02 0.00 0.01 0.00 0.00 72.50 70.06 1nj2 s THR 146 CO 0.09 -0.37 -0.13 -0.36 -0.69 0.00 0.00 174.62 173.16 1nj2 s PHE 147 N -3.19 1.10 -0.14 4.92 0.40 -1.19 -1.79 117.98 118.09 1nj2 s PHE 147 Ca 0.27 -0.38 -0.05 0.00 -0.60 0.00 0.00 56.93 56.17 1nj2 s PHE 147 Cb 0.04 -0.65 0.07 0.00 0.51 0.00 0.00 43.02 42.99 1nj2 s PHE 147 CO 0.09 0.02 0.29 1.03 0.70 0.00 0.00 175.22 177.35 1nj2 s ARG 148 N -1.29 0.18 -0.43 0.44 0.52 -0.88 -4.54 118.95 112.95 1nj2 s ARG 148 Ca -0.01 0.79 -0.24 0.00 -0.52 0.00 0.00 55.73 55.75 1nj2 s ARG 148 Cb -0.08 0.03 0.02 0.00 0.52 0.00 0.00 34.95 35.44 1nj2 s ARG 148 CO 0.01 -0.28 0.85 -0.47 0.02 0.00 0.00 175.30 175.44 1nj2 s TYR 149 N 2.42 2.99 0.33 -0.53 5.04 -1.15 -4.47 117.35 121.97 1nj2 s TYR 149 Ca 0.00 0.36 0.05 0.00 -2.44 0.00 0.00 57.07 55.05 1nj2 s TYR 149 Cb -0.12 -3.74 -0.03 0.00 0.35 0.00 0.00 41.96 38.42 1nj2 s TYR 149 CO -0.09 -0.98 0.21 -1.21 -1.34 0.00 0.00 175.55 172.14 1nj2 s GLU 150 N 3.46 1.70 0.12 4.97 2.02 -1.26 -4.82 118.70 124.88 1nj2 s GLU 150 Ca 0.34 -1.98 -0.07 0.00 0.02 0.00 0.00 54.97 53.27 1nj2 s GLU 150 Cb -0.11 0.03 -0.01 0.00 0.10 0.00 0.00 34.13 34.14 1nj2 s GLU 150 CO 0.23 -0.54 0.18 0.99 0.02 0.00 0.00 175.26 176.14 1nj2 s THR 151 N -3.51 0.12 -1.86 3.63 2.01 -1.26 -4.93 115.64 109.83 1nj2 s THR 151 Ca 0.36 -1.43 0.00 0.00 0.31 0.00 0.00 61.69 60.93 1nj2 s THR 151 Cb 0.03 -1.65 0.00 0.00 0.01 0.00 0.00 72.50 70.89 1nj2 s THR 151 CO 0.21 -0.52 0.00 0.29 -0.69 0.00 0.00 174.62 173.91 1nj2 n LYS 152 N -0.11 -1.44 -3.24 4.92 5.02 -1.26 -4.91 118.16 117.15 1nj2 n LYS 152 Ca -0.11 1.06 -0.08 0.00 -2.02 0.00 0.00 58.31 57.17 1nj2 n LYS 152 Cb 0.63 -5.40 -0.04 0.00 -0.02 0.00 0.00 35.03 30.20 1nj2 n LYS 152 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 1nj2 s HIS 153 N -2.48 -1.05 -0.51 2.13 3.76 -1.26 -5.09 115.29 110.78 1nj2 s HIS 153 Ca 0.00 -0.35 0.04 0.00 -0.15 0.00 0.00 55.06 54.60 1nj2 s HIS 153 Cb 0.00 -0.01 0.13 0.00 1.11 0.00 0.00 32.58 33.81 1nj2 s HIS 153 CO 0.00 -1.09 0.25 0.99 -0.85 0.00 0.00 174.74 174.04 1nj2 s THR 154 N 1.52 2.56 -0.23 1.30 2.01 -1.26 -4.78 115.64 116.77 1nj2 s THR 154 Ca 0.18 -3.28 -0.02 0.00 0.31 0.00 0.00 61.69 58.88 1nj2 s THR 154 Cb -0.08 -2.78 0.01 0.00 0.01 0.00 0.00 72.50 69.66 1nj2 s THR 154 CO -0.05 -0.79 -0.08 -0.13 -0.69 0.00 0.00 174.62 172.87 1nj2 s ARG 155 N -0.25 3.04 -0.08 4.92 0.52 -0.94 -5.03 118.95 121.13 1nj2 s ARG 155 Ca 0.17 -0.84 -0.40 0.00 -0.52 0.00 0.00 55.73 54.14 1nj2 s ARG 155 Cb -0.26 -2.91 -0.19 0.00 0.52 0.00 0.00 34.95 32.11 1nj2 s ARG 155 CO -0.00 -0.30 1.26 -2.30 0.02 0.00 0.00 175.30 173.98 1nj2 n PRO 156 N 4.70 0.34 -0.10 3.54 -0.02 -1.26 -0.36 135.00 141.84 1nj2 n PRO 156 Ca -0.18 0.12 0.00 0.00 -2.02 0.00 0.00 63.50 61.42 1nj2 n PRO 156 Cb 0.49 -1.67 0.00 0.00 -0.02 0.00 0.00 33.50 32.30 1nj2 n PRO 156 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1nj2 n LEU 157 N 2.41 0.20 -0.05 2.45 4.77 -1.26 -4.57 117.00 120.95 1nj2 n LEU 157 Ca 0.22 0.00 -0.05 0.00 -0.03 0.00 0.00 56.01 56.15 1nj2 n LEU 157 Cb 0.09 -0.69 -0.08 0.00 -2.33 0.00 0.00 43.42 40.40 1nj2 n LEU 157 CO 0.67 -0.10 -0.85 -0.38 -1.33 0.00 0.00 177.39 175.41 1nj2 n ILE 158 N -2.00 0.73 -3.18 -0.08 5.41 -0.82 -3.55 119.36 115.86 1nj2 n ILE 158 Ca 0.00 -0.45 0.02 0.00 1.00 0.00 0.00 62.75 63.32 1nj2 n ILE 158 Cb 0.00 -0.72 -0.02 0.00 -0.71 0.00 0.00 39.64 38.19 1nj2 n ILE 158 CO 0.00 0.00 0.00 -0.60 0.00 0.00 0.00 176.55 175.95 1nj2 s ARG 159 N -2.26 0.53 0.00 0.38 3.52 0.52 -4.97 118.95 116.67 1nj2 s ARG 159 Ca -0.05 0.80 0.00 0.00 -0.13 0.00 0.00 55.73 56.35 1nj2 s ARG 159 Cb 0.03 0.31 -0.00 0.00 -1.56 0.00 0.00 34.95 33.73 1nj2 s ARG 159 CO 0.43 -0.74 0.00 1.33 -0.81 0.00 0.00 175.30 175.52 1nj2 n VAL 160 N 5.42 0.00 -0.09 7.11 0.24 -1.26 -2.21 118.33 127.53 1nj2 n VAL 160 Ca 0.00 -0.02 -0.17 0.00 -2.04 0.00 0.00 64.34 62.11 1nj2 n VAL 160 Cb 0.51 0.01 -0.13 0.00 -1.47 0.00 0.00 33.84 32.76 1nj2 n VAL 160 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1nj2 n ARG 161 N -0.01 0.68 -3.99 7.34 5.12 -0.79 -4.71 116.66 120.32 1nj2 n ARG 161 Ca 0.00 0.16 -0.34 0.00 -1.93 0.00 0.00 57.85 55.75 1nj2 n ARG 161 Cb 0.00 -1.58 -0.14 0.00 -1.16 0.00 0.00 32.46 29.58 1nj2 n ARG 161 CO 0.00 0.00 0.00 -2.00 -1.93 0.00 0.00 177.63 173.70 1nj2 s GLU 162 N -2.53 2.51 -0.72 5.56 2.12 -1.20 -2.07 118.70 122.37 1nj2 s GLU 162 Ca -0.27 -1.19 -0.20 0.00 0.36 0.00 0.00 54.97 53.67 1nj2 s GLU 162 Cb 0.08 -3.00 0.10 0.00 0.26 0.00 0.00 34.13 31.57 1nj2 s GLU 162 CO 0.68 -0.52 0.92 0.42 -0.54 0.00 0.00 175.26 176.22 1nj2 s ILE 163 N 1.23 4.63 0.30 -3.70 1.01 -0.74 -4.84 121.20 119.09 1nj2 s ILE 163 Ca -0.04 -0.96 -0.01 0.00 0.00 0.00 0.00 60.65 59.63 1nj2 s ILE 163 Cb -0.19 -4.64 0.25 0.00 0.01 0.00 0.00 42.46 37.89 1nj2 s ILE 163 CO -0.04 -1.35 1.96 0.71 0.00 0.00 0.00 174.94 176.21 1nj2 h THR 164 N 5.87 1.21 -3.62 2.92 1.35 -1.87 -2.68 112.91 116.09 1nj2 h THR 164 Ca -0.16 -0.42 -0.66 0.00 -0.55 0.00 0.00 66.41 64.62 1nj2 h THR 164 Cb 1.06 0.11 -0.40 0.00 -1.73 0.00 0.00 68.15 67.19 1nj2 h THR 164 CO 1.12 0.21 -0.69 -0.89 -0.25 0.00 0.00 175.52 175.02 1nj2 s THR 165 N -5.81 2.41 -0.25 6.82 2.01 -1.26 -4.19 115.64 115.36 1nj2 s THR 165 Ca -0.11 -2.54 -0.01 0.00 0.31 0.00 0.00 61.69 59.33 1nj2 s THR 165 Cb 0.17 -2.75 0.07 0.00 0.01 0.00 0.00 72.50 70.01 1nj2 s THR 165 CO 0.79 -0.65 0.04 0.12 -0.69 0.00 0.00 174.62 174.23 1nj2 s PHE 166 N 0.66 1.56 -0.14 4.92 5.36 -0.58 -2.96 117.98 126.80 1nj2 s PHE 166 Ca 0.12 -1.37 -0.21 0.00 -0.96 0.00 0.00 56.93 54.51 1nj2 s PHE 166 Cb -0.21 -1.40 -0.03 0.00 -0.34 0.00 0.00 43.02 41.05 1nj2 s PHE 166 CO -0.06 -0.74 0.62 0.21 -1.46 0.00 0.00 175.22 173.79 1nj2 s LYS 167 N 1.67 4.31 -0.05 10.12 2.36 -0.99 -2.43 119.74 134.73 1nj2 s LYS 167 Ca 0.02 0.67 0.01 0.00 -2.55 0.00 0.00 55.97 54.12 1nj2 s LYS 167 Cb -0.17 -3.51 0.02 0.00 -1.05 0.00 0.00 37.83 33.12 1nj2 s LYS 167 CO -0.14 -0.06 -0.06 -1.83 1.55 0.00 0.00 175.35 174.81 1nj2 s GLU 168 N 1.30 1.03 -0.05 4.03 -1.05 -0.80 -2.55 118.70 120.61 1nj2 s GLU 168 Ca 0.31 -0.17 0.04 0.00 -0.15 0.00 0.00 54.97 55.00 1nj2 s GLU 168 Cb -0.16 -0.97 -0.02 0.00 -0.44 0.00 0.00 34.13 32.53 1nj2 s GLU 168 CO 0.13 -0.06 -0.17 0.00 0.95 0.00 0.00 175.26 176.11 1nj2 s ALA 169 N 0.87 2.55 0.05 -0.84 0.00 0.32 -2.30 121.76 122.40 1nj2 s ALA 169 Ca -0.12 -1.00 0.07 0.00 0.00 0.00 0.00 51.96 50.92 1nj2 s ALA 169 Cb -0.15 -0.91 -0.03 0.00 0.00 0.00 0.00 23.12 22.04 1nj2 s ALA 169 CO 0.01 0.51 -0.21 -1.01 0.00 0.00 0.00 175.76 175.06 1nj2 s HIS 170 N -0.56 1.86 0.00 0.00 3.76 -0.88 -1.43 115.29 118.04 1nj2 s HIS 170 Ca 0.08 -0.38 0.02 0.00 -0.15 0.00 0.00 55.06 54.62 1nj2 s HIS 170 Cb -0.11 -1.10 -0.01 0.00 1.11 0.00 0.00 32.58 32.47 1nj2 s HIS 170 CO 0.01 0.10 -0.05 0.95 -0.85 0.00 0.00 174.74 174.90 1nj2 s THR 171 N -0.82 0.39 -0.08 1.30 -4.23 -0.02 -1.75 115.64 110.44 1nj2 s THR 171 Ca 0.08 -0.32 0.03 0.00 -1.18 0.00 0.00 61.69 60.30 1nj2 s THR 171 Cb -0.09 -0.35 -0.02 0.00 1.34 0.00 0.00 72.50 73.38 1nj2 s THR 171 CO 0.02 0.03 -0.18 -0.63 -0.54 0.00 0.00 174.62 173.33 1nj2 s ILE 172 N -0.29 2.72 0.21 2.99 1.01 -0.45 -2.21 121.20 125.18 1nj2 s ILE 172 Ca 0.00 -0.82 0.03 0.00 0.00 0.00 0.00 60.65 59.86 1nj2 s ILE 172 Cb -0.03 -2.07 -0.05 0.00 0.01 0.00 0.00 42.46 40.32 1nj2 s ILE 172 CO -0.00 0.56 -0.01 -1.00 0.00 0.00 0.00 174.94 174.49 1nj2 s HIS 173 N -0.16 1.47 -0.17 3.97 3.76 0.17 -2.27 115.29 122.05 1nj2 s HIS 173 Ca -0.02 -0.93 -0.21 0.00 -0.15 0.00 0.00 55.06 53.76 1nj2 s HIS 173 Cb -0.14 -0.84 -0.23 0.00 1.11 0.00 0.00 32.58 32.49 1nj2 s HIS 173 CO 0.03 -0.06 0.40 0.00 -0.85 0.00 0.00 174.74 174.26 1nj2 h ALA 174 N 2.54 0.21 -3.25 -1.40 0.00 -1.94 -2.12 119.26 113.30 1nj2 h ALA 174 Ca -0.38 -1.07 -0.64 0.00 0.00 0.00 0.00 54.91 52.82 1nj2 h ALA 174 Cb 1.22 0.55 -0.11 0.00 0.00 0.00 0.00 17.79 19.45 1nj2 h ALA 174 CO 0.64 0.65 -0.64 -0.08 0.00 0.00 0.00 179.25 179.82 1nj2 s THR 175 N -2.38 4.15 0.33 0.00 -1.32 -1.26 -4.68 115.64 110.48 1nj2 s THR 175 Ca -0.25 -0.97 0.36 0.00 -1.21 0.00 0.00 61.69 59.62 1nj2 s THR 175 Cb 0.04 -3.00 0.39 0.00 -1.51 0.00 0.00 72.50 68.42 1nj2 s THR 175 CO 0.66 0.09 2.11 0.00 -2.21 0.00 0.00 174.62 175.28 1nj2 h ALA 176 N 3.30 1.04 0.23 11.08 0.00 -1.95 -2.98 119.26 129.98 1nj2 h ALA 176 Ca -0.47 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.40 1nj2 h ALA 176 Cb 1.17 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1nj2 h ALA 176 CO 0.61 0.04 -0.11 0.66 0.00 0.00 0.00 179.25 180.45 1nj2 h SER 177 N 0.00 -0.26 -0.27 0.00 4.64 -2.01 -3.25 113.55 112.41 1nj2 h SER 177 Ca -0.00 -0.20 0.08 0.00 -0.47 0.00 0.00 61.79 61.20 1nj2 h SER 177 Cb 0.34 0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 62.49 1nj2 h SER 177 CO 0.00 0.26 0.38 -0.33 -0.87 0.00 0.00 176.83 176.27 1nj2 h GLU 178 N -0.98 0.00 0.69 4.77 5.08 -1.95 0.30 114.58 122.49 1nj2 h GLU 178 Ca -0.03 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.29 1nj2 h GLU 178 Cb 0.44 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.70 1nj2 h GLU 178 CO 0.05 0.00 -0.33 0.00 -1.00 0.00 0.00 179.01 177.73 1nj2 h ALA 179 N 1.49 -0.93 -0.14 3.43 0.00 -1.56 -1.49 119.26 120.07 1nj2 h ALA 179 Ca 0.13 -0.21 0.04 0.00 0.00 0.00 0.00 54.91 54.87 1nj2 h ALA 179 Cb 0.88 0.36 -0.01 0.00 0.00 0.00 0.00 17.79 19.03 1nj2 h ALA 179 CO -0.00 -1.00 0.11 0.93 0.00 0.00 0.00 179.25 179.29 1nj2 h GLU 180 N -0.97 0.00 -0.28 0.00 5.08 -0.48 0.10 114.58 118.03 1nj2 h GLU 180 Ca -0.10 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.15 1nj2 h GLU 180 Cb 0.73 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.96 1nj2 h GLU 180 CO 0.16 0.00 -0.31 1.49 -1.00 0.00 0.00 179.01 179.35 1nj2 h GLU 181 N 0.00 0.59 -0.08 2.33 4.81 -0.92 -2.75 114.58 118.56 1nj2 h GLU 181 Ca 0.07 -0.26 -0.00 0.00 -0.13 0.00 0.00 59.36 59.03 1nj2 h GLU 181 Cb 0.29 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.64 1nj2 h GLU 181 CO -0.00 0.83 0.03 0.37 -0.73 0.00 0.00 179.01 179.51 1nj2 h GLN 182 N 0.51 0.13 -1.02 1.92 5.75 0.23 -1.43 115.11 121.19 1nj2 h GLN 182 Ca 0.06 -0.02 0.26 0.00 -0.15 0.00 0.00 58.65 58.80 1nj2 h GLN 182 Cb 0.78 -0.02 -0.09 0.00 1.07 0.00 0.00 27.48 29.22 1nj2 h GLN 182 CO 0.06 0.24 0.66 0.28 -2.65 0.00 0.00 178.83 177.43 1nj2 h VAL 183 N -0.02 0.55 -0.04 2.39 2.07 -1.15 0.56 116.25 120.60 1nj2 h VAL 183 Ca 0.03 -0.13 -0.03 0.00 0.82 0.00 0.00 66.70 67.39 1nj2 h VAL 183 Cb 0.16 0.13 0.00 0.00 -1.52 0.00 0.00 31.29 30.06 1nj2 h VAL 183 CO -0.00 0.07 -0.08 -0.33 0.02 0.00 0.00 177.57 177.25 1nj2 h GLU 184 N 0.39 0.12 -0.18 1.57 5.08 -1.05 -2.64 114.58 117.87 1nj2 h GLU 184 Ca 0.57 -0.08 0.03 0.00 -1.00 0.00 0.00 59.36 58.89 1nj2 h GLU 184 Cb 1.47 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 30.70 1nj2 h GLU 184 CO -0.26 0.66 -0.03 0.00 -1.00 0.00 0.00 179.01 178.38 1nj2 h ARG 185 N -0.40 0.01 -0.71 2.33 3.08 0.05 -1.61 114.38 117.13 1nj2 h ARG 185 Ca 0.00 -0.00 0.13 0.00 0.07 0.00 0.00 59.98 60.18 1nj2 h ARG 185 Cb 0.66 -0.00 -0.13 0.00 0.08 0.00 0.00 29.97 30.57 1nj2 h ARG 185 CO 0.02 0.01 -0.27 0.00 -1.07 0.00 0.00 179.97 178.66 1nj2 h ALA 186 N 1.17 0.24 -0.36 0.04 0.00 0.01 0.15 119.26 120.52 1nj2 h ALA 186 Ca 0.09 0.24 0.01 0.00 0.00 0.00 0.00 54.91 55.25 1nj2 h ALA 186 Cb 0.12 0.70 -0.02 0.00 0.00 0.00 0.00 17.79 18.60 1nj2 h ALA 186 CO -0.17 -0.54 0.22 0.28 0.00 0.00 0.00 179.25 179.03 1nj2 h VAL 187 N -0.07 1.05 0.00 0.00 2.07 -0.98 -1.17 116.25 117.15 1nj2 h VAL 187 Ca 0.31 -0.15 -0.00 0.00 0.82 0.00 0.00 66.70 67.67 1nj2 h VAL 187 Cb 0.56 0.57 -0.00 0.00 -1.52 0.00 0.00 31.29 30.89 1nj2 h VAL 187 CO -0.76 0.08 -0.01 -0.08 0.02 0.00 0.00 177.57 176.82 1nj2 h GLU 188 N 0.45 0.00 -0.01 1.57 4.57 -0.10 -2.00 114.58 119.05 1nj2 h GLU 188 Ca 0.14 0.00 -0.03 0.00 -1.18 0.00 0.00 59.36 58.29 1nj2 h GLU 188 Cb -0.01 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.58 1nj2 h GLU 188 CO -0.06 0.01 -0.11 0.82 -1.18 0.00 0.00 179.01 178.49 1nj2 h ILE 189 N 0.00 1.54 0.00 2.32 2.04 0.04 -2.90 117.51 120.55 1nj2 h ILE 189 Ca -0.00 -1.75 -0.04 0.00 1.00 0.00 0.00 64.86 64.07 1nj2 h ILE 189 Cb 0.10 2.66 -0.01 0.00 -0.74 0.00 0.00 36.82 38.84 1nj2 h ILE 189 CO 0.00 0.47 -0.19 1.88 0.00 0.00 0.00 178.15 180.31 1nj2 h TYR 190 N -0.57 0.00 0.63 1.37 0.99 -1.06 -1.45 116.97 116.88 1nj2 h TYR 190 Ca -0.01 0.00 -0.03 0.00 2.00 0.00 0.00 58.73 60.69 1nj2 h TYR 190 Cb 0.83 0.00 0.01 0.00 1.00 0.00 0.00 36.73 38.56 1nj2 h TYR 190 CO 0.17 0.19 -0.30 0.87 -0.00 0.00 0.00 178.16 179.09 1nj2 h LYS 191 N 0.00 -0.81 -0.71 4.88 1.57 -1.41 -1.02 116.57 119.06 1nj2 h LYS 191 Ca -0.00 0.06 0.11 0.00 -1.87 0.00 0.00 60.65 58.95 1nj2 h LYS 191 Cb 0.44 0.18 -0.08 0.00 0.08 0.00 0.00 32.23 32.86 1nj2 h LYS 191 CO 0.02 -0.50 0.31 1.49 -0.57 0.00 0.00 179.45 180.21 1nj2 h GLU 192 N -1.06 0.49 0.54 3.15 4.81 -1.25 0.20 114.58 121.47 1nj2 h GLU 192 Ca -0.09 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.09 1nj2 h GLU 192 Cb 0.69 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.95 1nj2 h GLU 192 CO 0.14 0.33 -0.41 0.35 -0.73 0.00 0.00 179.01 178.69 1nj2 h PHE 193 N 0.51 -1.11 -0.85 0.92 3.57 -1.23 -2.30 116.94 116.45 1nj2 h PHE 193 Ca 0.37 -0.00 0.13 0.00 3.53 0.00 0.00 57.97 62.00 1nj2 h PHE 193 Cb 0.47 0.41 -0.09 0.00 2.79 0.00 0.00 35.95 39.53 1nj2 h PHE 193 CO -0.14 -0.58 0.46 0.74 -2.23 0.00 0.00 178.31 176.56 1nj2 h PHE 194 N -0.91 0.81 -0.31 0.41 0.05 -0.55 0.87 116.94 117.31 1nj2 h PHE 194 Ca -0.07 0.03 0.05 0.00 3.82 0.00 0.00 57.97 61.80 1nj2 h PHE 194 Cb 0.76 -0.23 -0.02 0.00 2.00 0.00 0.00 35.95 38.46 1nj2 h PHE 194 CO -0.14 0.24 0.21 -0.91 -0.18 0.00 0.00 178.31 177.53 1nj2 h ASN 195 N 0.68 0.19 0.75 2.17 -0.26 -0.44 0.69 115.58 119.36 1nj2 h ASN 195 Ca 0.45 -0.00 -0.11 0.00 -0.56 0.00 0.00 56.30 56.08 1nj2 h ASN 195 Cb 0.58 -0.04 -0.02 0.00 -1.06 0.00 0.00 38.32 37.78 1nj2 h ASN 195 CO -0.33 0.13 -0.53 0.28 -1.06 0.00 0.00 177.43 175.92 1nj2 h SER 196 N 0.22 0.00 0.23 5.81 0.02 -0.25 -1.76 113.55 117.81 1nj2 h SER 196 Ca 0.13 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.08 1nj2 h SER 196 Cb 0.26 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.80 1nj2 h SER 196 CO -0.02 0.53 -0.26 0.18 -1.14 0.00 0.00 176.83 176.12 1nj2 n LEU 197 N -3.67 1.04 -2.65 5.07 4.77 -0.14 -4.93 117.00 116.49 1nj2 n LEU 197 Ca -0.01 -0.27 -0.14 0.00 -0.03 0.00 0.00 56.01 55.56 1nj2 n LEU 197 Cb 0.59 -0.12 0.06 0.00 -2.33 0.00 0.00 43.42 41.61 1nj2 n LEU 197 CO 0.40 0.19 0.13 0.61 -1.33 0.00 0.00 177.39 177.39 1nj2 n GLY 198 N 1.34 -0.09 3.38 -0.72 0.00 0.05 -4.84 105.19 104.32 1nj2 n GLY 198 Ca 0.12 -0.06 -0.33 0.00 0.00 0.00 0.00 46.02 45.76 1nj2 n GLY 198 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1nj2 s ILE 199 N -3.23 3.07 0.55 -0.61 1.01 -0.71 -4.62 121.20 116.66 1nj2 s ILE 199 Ca 0.22 -0.66 -0.14 0.00 0.00 0.00 0.00 60.65 60.07 1nj2 s ILE 199 Cb -0.10 -2.29 -0.06 0.00 0.01 0.00 0.00 42.46 40.03 1nj2 s ILE 199 CO 0.50 0.53 0.99 -2.16 0.00 0.00 0.00 174.94 174.80 1nj2 s PRO 200 N 0.27 3.81 0.14 2.79 0.04 -1.26 -4.51 135.00 136.28 1nj2 s PRO 200 Ca -0.09 0.86 -0.15 0.00 0.04 0.00 0.00 61.00 61.65 1nj2 s PRO 200 Cb -0.16 -2.12 0.03 0.00 0.04 0.00 0.00 34.50 32.29 1nj2 s PRO 200 CO 0.05 -0.38 0.40 1.52 0.04 0.00 0.00 177.00 178.64 1nj2 s TYR 201 N -2.83 -0.12 -0.19 0.56 -0.85 -1.26 -4.58 117.35 108.08 1nj2 s TYR 201 Ca 0.57 -0.21 0.00 0.00 -0.52 0.00 0.00 57.07 56.91 1nj2 s TYR 201 Cb -0.10 0.24 0.04 0.00 0.38 0.00 0.00 41.96 42.52 1nj2 s TYR 201 CO 0.40 -0.73 -0.09 -1.17 -1.52 0.00 0.00 175.55 172.44 1nj2 s LEU 202 N -2.83 2.10 -0.32 -3.49 2.96 -0.10 -4.94 118.68 112.06 1nj2 s LEU 202 Ca 0.05 -0.83 -0.17 0.00 -0.22 0.00 0.00 54.13 52.96 1nj2 s LEU 202 Cb 0.02 -1.15 -0.02 0.00 0.50 0.00 0.00 46.19 45.55 1nj2 s LEU 202 CO -0.09 -0.16 0.46 -0.63 -1.32 0.00 0.00 176.35 174.61 1nj2 s ILE 203 N 1.46 5.08 0.00 6.68 1.01 -1.26 -2.34 121.20 131.84 1nj2 s ILE 203 Ca -0.01 0.42 0.00 0.00 0.00 0.00 0.00 60.65 61.07 1nj2 s ILE 203 Cb -0.16 -3.86 0.00 0.00 0.01 0.00 0.00 42.46 38.45 1nj2 s ILE 203 CO -0.08 -0.07 0.00 0.35 0.00 0.00 0.00 174.94 175.14 1nj2 n THR 204 N 5.29 0.00 -3.57 2.92 -2.24 -0.55 -4.98 114.28 111.14 1nj2 n THR 204 Ca -0.06 0.00 -0.29 0.00 -2.27 0.00 0.00 64.05 61.43 1nj2 n THR 204 Cb 0.49 0.00 -0.14 0.00 -2.10 0.00 0.00 70.33 68.58 1nj2 n THR 204 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 1nj2 s ARG 205 N 0.92 0.48 0.32 -0.78 3.52 -1.09 -2.20 118.95 120.12 1nj2 s ARG 205 Ca 0.00 -0.97 -0.19 0.00 -0.13 0.00 0.00 55.73 54.44 1nj2 s ARG 205 Cb 0.00 -1.46 -0.13 0.00 -1.56 0.00 0.00 34.95 31.79 1nj2 s ARG 205 CO 0.00 -1.07 0.12 0.54 -0.81 0.00 0.00 175.30 174.08 1nj2 n ARG 206 N 4.71 0.00 -2.29 5.12 5.12 -1.07 -2.70 116.66 125.56 1nj2 n ARG 206 Ca 0.01 0.00 -0.36 0.00 -1.93 0.00 0.00 57.85 55.57 1nj2 n ARG 206 Cb 0.40 -0.85 -0.00 0.00 -1.16 0.00 0.00 32.46 30.85 1nj2 n ARG 206 CO 0.00 0.00 0.00 -2.14 -1.93 0.00 0.00 177.63 173.56 1nj2 s PRO 207 N -0.85 3.51 0.19 5.56 0.02 -1.26 -4.72 135.00 137.45 1nj2 s PRO 207 Ca 0.51 1.63 0.10 0.00 0.02 0.00 0.00 61.00 63.26 1nj2 s PRO 207 Cb -0.58 -2.12 0.53 0.00 0.02 0.00 0.00 34.50 32.35 1nj2 s PRO 207 CO 0.52 -0.73 1.21 -0.35 -0.33 0.00 0.00 177.00 177.32 1nj2 n PRO 208 N -1.04 0.06 0.00 5.54 -0.04 -1.26 -0.18 135.00 138.08 1nj2 n PRO 208 Ca 0.10 0.51 0.12 0.00 -0.04 0.00 0.00 63.50 64.19 1nj2 n PRO 208 Cb 0.50 -1.88 0.23 0.00 -0.04 0.00 0.00 33.50 32.32 1nj2 n PRO 208 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 1nj2 n TRP 209 N -1.83 0.00 -0.00 0.54 2.14 -1.26 -4.16 117.44 112.87 1nj2 n TRP 209 Ca -0.01 0.00 0.01 0.00 2.07 0.00 0.00 57.50 59.58 1nj2 n TRP 209 Cb 0.18 -0.04 -0.03 0.00 -0.81 0.00 0.00 31.31 30.61 1nj2 n TRP 209 CO 0.00 0.00 0.00 -0.25 2.07 0.00 0.00 177.69 179.51 1nj2 n ASP 210 N 0.07 4.19 -4.28 -0.67 8.00 0.74 -5.06 116.55 119.54 1nj2 n ASP 210 Ca 0.13 0.00 -0.32 0.00 0.71 0.00 0.00 54.79 55.30 1nj2 n ASP 210 Cb 0.43 1.10 0.17 0.00 -0.02 0.00 0.00 41.12 42.81 1nj2 n ASP 210 CO 0.00 0.00 0.00 2.29 -0.39 0.00 0.00 177.20 179.10 1nj2 n LYS 211 N -1.68 -1.54 -2.40 -1.24 2.85 -0.63 -4.87 118.16 108.65 1nj2 n LYS 211 Ca -0.01 -0.43 -0.42 0.00 -1.05 0.00 0.00 58.31 56.40 1nj2 n LYS 211 Cb 0.15 -1.70 -0.03 0.00 -0.65 0.00 0.00 35.03 32.80 1nj2 n LYS 211 CO 0.00 0.00 0.00 0.12 -0.05 0.00 0.00 177.40 177.47 1nj2 s PHE 212 N -2.24 3.25 -0.43 5.58 5.36 -1.26 -4.92 117.98 123.33 1nj2 s PHE 212 Ca 0.56 1.19 -0.41 0.00 -0.96 0.00 0.00 56.93 57.31 1nj2 s PHE 212 Cb -0.12 -3.46 -0.16 0.00 -0.34 0.00 0.00 43.02 38.94 1nj2 s PHE 212 CO 0.66 -1.48 2.09 -2.30 -1.46 0.00 0.00 175.22 172.73 1nj2 n PRO 213 N 4.62 0.48 0.00 10.12 -0.02 -1.26 -0.42 135.00 148.53 1nj2 n PRO 213 Ca 0.10 0.14 0.00 0.00 -2.02 0.00 0.00 63.50 61.72 1nj2 n PRO 213 Cb 0.46 -1.89 0.00 0.00 -0.02 0.00 0.00 33.50 32.05 1nj2 n PRO 213 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1nj2 n GLY 214 N 6.64 3.34 3.74 -1.23 0.00 -1.26 -5.06 105.19 111.35 1nj2 n GLY 214 Ca 0.46 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.18 1nj2 n GLY 214 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1nj2 s SER 215 N -0.52 3.91 -0.07 1.61 1.04 0.44 -4.66 113.70 115.45 1nj2 s SER 215 Ca 0.00 1.68 -0.25 0.00 0.48 0.00 0.00 55.95 57.86 1nj2 s SER 215 Cb 0.00 -2.36 -0.26 0.00 0.10 0.00 0.00 66.02 63.51 1nj2 s SER 215 CO 0.00 -2.39 0.95 -0.33 0.98 0.00 0.00 173.24 172.44 1nj2 h GLU 216 N -1.38 0.17 -1.72 4.02 4.39 -1.23 -3.47 114.58 115.35 1nj2 h GLU 216 Ca -0.46 -0.22 0.07 0.00 0.34 0.00 0.00 59.36 59.09 1nj2 h GLU 216 Cb 1.26 0.07 -0.25 0.00 -0.10 0.00 0.00 28.75 29.73 1nj2 h GLU 216 CO 0.52 1.01 0.26 1.52 -1.16 0.00 0.00 179.01 181.16 1nj2 s TYR 217 N -2.78 -0.74 -0.10 4.33 -0.85 -1.22 -5.04 117.35 110.95 1nj2 s TYR 217 Ca -0.16 1.51 -0.05 0.00 -0.52 0.00 0.00 57.07 57.85 1nj2 s TYR 217 Cb 0.00 0.44 -0.04 0.00 0.38 0.00 0.00 41.96 42.74 1nj2 s TYR 217 CO 0.75 -0.36 0.11 0.99 -1.52 0.00 0.00 175.55 175.51 1nj2 s THR 218 N 1.28 5.19 0.01 -3.49 2.01 -1.26 -2.65 115.64 116.73 1nj2 s THR 218 Ca -0.08 0.06 0.05 0.00 0.31 0.00 0.00 61.69 62.03 1nj2 s THR 218 Cb -0.04 -3.26 -0.03 0.00 0.01 0.00 0.00 72.50 69.18 1nj2 s THR 218 CO -0.15 0.59 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.57 1nj2 s VAL 219 N -1.02 3.32 0.06 3.82 1.01 0.15 -2.61 120.40 125.13 1nj2 s VAL 219 Ca 0.15 -0.90 0.05 0.00 0.00 0.00 0.00 61.98 61.28 1nj2 s VAL 219 Cb -0.12 -2.42 -0.03 0.00 0.00 0.00 0.00 36.38 33.82 1nj2 s VAL 219 CO 0.05 0.39 -0.13 0.00 0.00 0.00 0.00 175.10 175.41 1nj2 s ALA 220 N -0.95 1.07 -0.19 5.51 0.00 -0.93 -1.36 121.76 124.91 1nj2 s ALA 220 Ca 0.16 -0.94 -0.03 0.00 0.00 0.00 0.00 51.96 51.15 1nj2 s ALA 220 Cb -0.11 -0.09 -0.01 0.00 0.00 0.00 0.00 23.12 22.91 1nj2 s ALA 220 CO 0.06 0.14 -0.06 -0.06 0.00 0.00 0.00 175.76 175.84 1nj2 s PHE 221 N -1.23 2.93 0.11 0.00 0.40 -0.33 -1.49 117.98 118.38 1nj2 s PHE 221 Ca -0.03 -0.78 0.08 0.00 -0.60 0.00 0.00 56.93 55.60 1nj2 s PHE 221 Cb -0.10 -2.02 -0.04 0.00 0.51 0.00 0.00 43.02 41.38 1nj2 s PHE 221 CO 0.02 -0.39 -0.18 -0.51 0.70 0.00 0.00 175.22 174.85 1nj2 s ASP 222 N 1.04 2.37 0.06 1.36 1.01 -0.99 -1.50 116.67 120.03 1nj2 s ASP 222 Ca 0.00 -0.73 -0.01 0.00 0.71 0.00 0.00 52.55 52.52 1nj2 s ASP 222 Cb -0.15 -0.12 -0.04 0.00 1.01 0.00 0.00 42.92 43.62 1nj2 s ASP 222 CO -0.00 -0.01 -0.04 0.28 0.21 0.00 0.00 175.17 175.61 1nj2 s THR 223 N -1.51 0.30 -0.13 -1.27 -1.32 -0.71 -0.92 115.64 110.08 1nj2 s THR 223 Ca 0.08 -1.80 -0.13 0.00 -1.21 0.00 0.00 61.69 58.63 1nj2 s THR 223 Cb -0.08 -1.51 -0.05 0.00 -1.51 0.00 0.00 72.50 69.35 1nj2 s THR 223 CO 0.04 -0.96 0.28 -0.22 -2.21 0.00 0.00 174.62 171.55 1nj2 s LEU 224 N -2.89 4.31 0.52 9.08 2.96 -1.26 -1.74 118.68 129.66 1nj2 s LEU 224 Ca 0.07 0.57 -0.02 0.00 -0.22 0.00 0.00 54.13 54.53 1nj2 s LEU 224 Cb 0.07 -2.35 0.01 0.00 0.50 0.00 0.00 46.19 44.41 1nj2 s LEU 224 CO -0.09 0.20 0.78 -0.04 -1.32 0.00 0.00 176.35 175.88 1nj2 s MET 225 N -0.07 2.95 0.42 1.98 -1.94 0.44 -4.94 119.30 118.14 1nj2 s MET 225 Ca 0.17 -0.30 0.17 0.00 -1.71 0.00 0.00 55.69 54.02 1nj2 s MET 225 Cb -0.13 -2.42 0.92 0.00 2.01 0.00 0.00 34.83 35.20 1nj2 s MET 225 CO 0.05 -0.50 1.89 -1.35 -0.01 0.00 0.00 175.02 175.11 1nj2 h PRO 226 N 0.11 0.00 -0.99 2.03 0.11 -1.89 -2.26 132.00 129.11 1nj2 h PRO 226 Ca -0.45 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.64 1nj2 h PRO 226 Cb 1.26 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.36 1nj2 h PRO 226 CO 0.58 0.29 0.01 -0.40 -0.21 0.00 0.00 178.00 178.27 1nj2 n ASP 227 N -3.94 2.08 -0.99 -2.05 3.85 -1.26 -4.81 116.55 109.42 1nj2 n ASP 227 Ca -0.02 -2.05 -0.13 0.00 -0.71 0.00 0.00 54.79 51.88 1nj2 n ASP 227 Cb 0.36 -0.51 -0.06 0.00 -1.35 0.00 0.00 41.12 39.56 1nj2 n ASP 227 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1nj2 n GLY 228 N 0.22 1.27 3.87 6.12 0.00 -0.85 -4.96 105.19 110.86 1nj2 n GLY 228 Ca 0.02 -0.06 -0.21 0.00 0.00 0.00 0.00 46.02 45.77 1nj2 n GLY 228 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nj2 s LYS 229 N -3.04 2.58 -0.09 1.61 -0.14 -1.26 -2.51 119.74 116.89 1nj2 s LYS 229 Ca 0.00 -1.47 -0.00 0.00 -1.36 0.00 0.00 55.97 53.14 1nj2 s LYS 229 Cb 0.00 -2.40 -0.03 0.00 -1.68 0.00 0.00 37.83 33.72 1nj2 s LYS 229 CO 0.00 -0.11 -0.05 0.99 -0.76 0.00 0.00 175.35 175.41 1nj2 s THR 230 N -2.43 3.82 -0.06 2.17 2.01 -0.32 -0.42 115.64 120.41 1nj2 s THR 230 Ca 0.46 -0.42 0.04 0.00 0.31 0.00 0.00 61.69 62.07 1nj2 s THR 230 Cb -0.04 -2.59 -0.02 0.00 0.01 0.00 0.00 72.50 69.86 1nj2 s THR 230 CO 0.27 0.58 -0.18 -0.22 -0.69 0.00 0.00 174.62 174.39 1nj2 s LEU 231 N -0.60 2.51 -0.15 4.42 2.96 -0.71 -1.60 118.68 125.50 1nj2 s LEU 231 Ca 0.09 -0.32 -0.24 0.00 -0.22 0.00 0.00 54.13 53.44 1nj2 s LEU 231 Cb -0.12 -1.50 -0.02 0.00 0.50 0.00 0.00 46.19 45.05 1nj2 s LEU 231 CO 0.02 0.28 0.74 -1.58 -1.32 0.00 0.00 176.35 174.50 1nj2 s GLN 232 N -0.37 4.30 -0.11 1.98 0.74 -1.26 -1.73 119.66 123.20 1nj2 s GLN 232 Ca 0.03 0.87 0.15 0.00 0.05 0.00 0.00 55.36 56.46 1nj2 s GLN 232 Cb -0.12 -3.55 0.27 0.00 1.10 0.00 0.00 33.01 30.71 1nj2 s GLN 232 CO 0.02 -0.22 1.14 0.44 -0.55 0.00 0.00 175.29 176.12 1nj2 n ILE 233 N 4.51 1.51 0.00 -2.34 -5.35 -0.56 -4.95 119.36 112.18 1nj2 n ILE 233 Ca 0.01 -1.98 0.00 0.00 -0.27 0.00 0.00 62.75 60.51 1nj2 n ILE 233 Cb 0.50 -0.04 0.00 0.00 -1.74 0.00 0.00 39.64 38.36 1nj2 n ILE 233 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1nj2 n GLY 234 N -1.01 3.43 3.15 3.28 0.00 -1.24 -4.71 105.19 108.09 1nj2 n GLY 234 Ca 0.13 -0.07 -0.16 0.00 0.00 0.00 0.00 46.02 45.92 1nj2 n GLY 234 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1nj2 s THR 235 N -0.44 0.94 -0.08 2.61 -4.23 -1.09 -1.19 115.64 112.15 1nj2 s THR 235 Ca 0.00 -1.33 0.00 0.00 -1.18 0.00 0.00 61.69 59.18 1nj2 s THR 235 Cb 0.00 -1.03 0.02 0.00 1.34 0.00 0.00 72.50 72.84 1nj2 s THR 235 CO 0.00 -0.34 -0.07 -0.69 -0.54 0.00 0.00 174.62 172.98 1nj2 s VAL 236 N -1.57 0.87 0.00 2.29 1.01 -0.47 -2.67 120.40 119.87 1nj2 s VAL 236 Ca -0.02 -0.25 0.06 0.00 0.00 0.00 0.00 61.98 61.77 1nj2 s VAL 236 Cb -0.08 -0.89 -0.03 0.00 0.00 0.00 0.00 36.38 35.38 1nj2 s VAL 236 CO 0.01 0.32 -0.16 -1.00 0.00 0.00 0.00 175.10 174.27 1nj2 s HIS 237 N 1.35 2.62 -0.59 5.22 3.76 0.23 -0.68 115.29 127.20 1nj2 s HIS 237 Ca -0.03 -0.22 0.00 0.00 -0.15 0.00 0.00 55.06 54.66 1nj2 s HIS 237 Cb -0.14 -1.53 0.15 0.00 1.11 0.00 0.00 32.58 32.17 1nj2 s HIS 237 CO -0.03 0.22 0.37 1.21 -0.85 0.00 0.00 174.74 175.66 1nj2 s ASN 238 N -1.16 4.85 1.01 1.40 3.84 -1.08 -2.18 114.94 121.62 1nj2 s ASN 238 Ca 0.14 -2.95 -0.01 0.00 0.21 0.00 0.00 52.86 50.25 1nj2 s ASN 238 Cb -0.11 -1.77 0.01 0.00 -0.55 0.00 0.00 41.25 38.84 1nj2 s ASN 238 CO 0.04 -0.30 0.04 0.18 -2.79 0.00 0.00 177.10 174.26 1nj2 n LEU 239 N 3.29 0.00 0.00 3.21 4.77 -0.95 -0.87 117.00 126.45 1nj2 n LEU 239 Ca 0.07 -0.04 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 1nj2 n LEU 239 Cb 0.35 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.41 1nj2 n LEU 239 CO 0.34 -1.10 0.00 0.61 -1.33 0.00 0.00 177.39 175.91 1nj2 n GLY 240 N 1.97 2.03 0.00 -0.72 0.00 -1.26 -4.52 105.19 102.69 1nj2 n GLY 240 Ca 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.86 1nj2 n GLY 240 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1nj2 n GLN 241 N 0.00 0.80 -0.16 1.61 1.13 -1.26 -2.76 117.38 116.74 1nj2 n GLN 241 Ca 0.00 -0.35 -0.04 0.00 -1.94 0.00 0.00 57.00 54.67 1nj2 n GLN 241 Cb 0.00 -0.85 0.03 0.00 0.11 0.00 0.00 30.24 29.53 1nj2 n GLN 241 CO 0.00 0.00 0.00 1.15 -1.44 0.00 0.00 177.06 176.77 1nj2 h THR 242 N 0.06 0.36 0.21 5.09 2.02 -1.90 0.32 112.91 119.06 1nj2 h THR 242 Ca 0.00 0.00 -0.32 0.00 0.77 0.00 0.00 66.41 66.86 1nj2 h THR 242 Cb 0.03 0.36 0.03 0.00 -1.74 0.00 0.00 68.15 66.82 1nj2 h THR 242 CO 0.00 0.00 -1.40 -0.26 0.37 0.00 0.00 175.52 174.23 1nj2 h PHE 243 N -0.09 0.82 -0.76 3.16 -1.00 -1.92 -2.75 116.94 114.40 1nj2 h PHE 243 Ca 0.24 -0.60 0.16 0.00 2.81 0.00 0.00 57.97 60.59 1nj2 h PHE 243 Cb 0.46 -0.03 -0.11 0.00 3.61 0.00 0.00 35.95 39.88 1nj2 h PHE 243 CO -0.50 1.46 0.22 0.00 -1.61 0.00 0.00 178.31 177.89 1nj2 h ALA 244 N 0.31 1.02 -0.15 2.45 0.00 -1.67 0.04 119.26 121.26 1nj2 h ALA 244 Ca -0.21 0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 1nj2 h ALA 244 Cb 2.10 0.20 -0.00 0.00 0.00 0.00 0.00 17.79 20.08 1nj2 h ALA 244 CO 0.25 -0.31 -0.04 0.00 0.00 0.00 0.00 179.25 179.15 1nj2 h ARG 245 N 0.31 0.29 -0.45 0.00 3.08 -0.42 0.43 114.38 117.62 1nj2 h ARG 245 Ca 0.43 -0.11 0.03 0.00 0.07 0.00 0.00 59.98 60.40 1nj2 h ARG 245 Cb 0.73 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.74 1nj2 h ARG 245 CO -0.49 0.58 0.30 1.15 -1.07 0.00 0.00 179.97 180.44 1nj2 h THR 246 N -0.01 1.04 -0.14 2.04 2.02 -0.89 -2.75 112.91 114.22 1nj2 h THR 246 Ca 0.04 -0.17 0.00 0.00 0.77 0.00 0.00 66.41 67.05 1nj2 h THR 246 Cb 0.48 0.50 0.00 0.00 -1.74 0.00 0.00 68.15 67.39 1nj2 h THR 246 CO 0.02 0.09 0.00 0.49 0.37 0.00 0.00 175.52 176.49 1nj2 n PHE 247 N -4.48 0.17 -2.53 3.16 3.72 -0.13 -5.05 117.46 112.33 1nj2 n PHE 247 Ca 0.05 -0.17 -0.04 0.00 -0.05 0.00 0.00 57.45 57.24 1nj2 n PHE 247 Cb 0.15 -0.01 0.01 0.00 -0.94 0.00 0.00 39.48 38.69 1nj2 n PHE 247 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 176.76 174.80 1nj2 n GLU 248 N 0.66 -2.22 -3.74 -1.08 4.07 0.13 -4.83 120.64 113.63 1nj2 n GLU 248 Ca 0.09 1.98 -0.29 0.00 -0.06 0.00 0.00 57.16 58.89 1nj2 n GLU 248 Cb 0.35 -4.70 -0.12 0.00 -0.06 0.00 0.00 31.44 26.91 1nj2 n GLU 248 CO 0.00 0.00 0.00 0.42 -0.06 0.00 0.00 177.13 177.49 1nj2 s ILE 249 N -1.92 1.80 0.24 6.31 1.01 0.08 -4.70 121.20 124.02 1nj2 s ILE 249 Ca 0.13 -3.15 0.07 0.00 0.00 0.00 0.00 60.65 57.69 1nj2 s ILE 249 Cb -0.04 -2.23 -0.04 0.00 0.01 0.00 0.00 42.46 40.17 1nj2 s ILE 249 CO 0.61 -0.97 0.21 -0.54 0.00 0.00 0.00 174.94 174.25 1nj2 s LYS 250 N -0.28 2.97 -0.08 2.79 1.02 -1.26 -2.56 119.74 122.34 1nj2 s LYS 250 Ca 0.22 -1.01 -0.06 0.00 0.02 0.00 0.00 55.97 55.14 1nj2 s LYS 250 Cb -0.15 -2.60 0.03 0.00 -0.52 0.00 0.00 37.83 34.59 1nj2 s LYS 250 CO -0.08 0.41 0.21 -0.59 -0.92 0.00 0.00 175.35 174.38 1nj2 s PHE 251 N -2.08 -0.24 0.24 3.18 -0.12 -1.10 -4.50 117.98 113.35 1nj2 s PHE 251 Ca 0.33 0.60 -0.29 0.00 -0.05 0.00 0.00 56.93 57.52 1nj2 s PHE 251 Cb -0.08 0.05 -0.09 0.00 -0.63 0.00 0.00 43.02 42.27 1nj2 s PHE 251 CO 0.25 -0.15 0.92 -1.21 -0.05 0.00 0.00 175.22 174.98 1nj2 s GLU 252 N 0.53 4.79 0.43 1.99 2.02 -1.25 -3.19 118.70 124.02 1nj2 s GLU 252 Ca -0.03 1.43 0.04 0.00 0.02 0.00 0.00 54.97 56.42 1nj2 s GLU 252 Cb -0.05 -3.23 0.01 0.00 0.10 0.00 0.00 34.13 30.96 1nj2 s GLU 252 CO -0.03 0.50 0.62 0.99 0.02 0.00 0.00 175.26 177.36 1nj2 s THR 253 N -1.22 3.51 0.38 3.63 2.01 0.48 -1.79 115.64 122.64 1nj2 s THR 253 Ca 0.41 -0.78 0.09 0.00 0.31 0.00 0.00 61.69 61.73 1nj2 s THR 253 Cb -0.25 -3.25 0.32 0.00 0.01 0.00 0.00 72.50 69.33 1nj2 s THR 253 CO 0.30 -0.14 1.93 -0.65 -0.69 0.00 0.00 174.62 175.37 1nj2 h PRO 254 N 0.51 0.62 -0.03 4.92 0.11 -1.97 0.69 132.00 136.86 1nj2 h PRO 254 Ca -0.44 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1nj2 h PRO 254 Cb 1.27 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.24 1nj2 h PRO 254 CO 0.52 0.41 0.00 0.39 -0.21 0.00 0.00 178.00 179.12 1nj2 n GLU 255 N -4.50 1.07 -2.89 1.05 4.71 -1.26 -4.88 120.64 113.93 1nj2 n GLU 255 Ca 0.13 -0.10 -0.18 0.00 -0.01 0.00 0.00 57.16 57.00 1nj2 n GLU 255 Cb 0.37 -1.04 0.03 0.00 -1.01 0.00 0.00 31.44 29.79 1nj2 n GLU 255 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1nj2 n GLY 256 N 0.57 -0.28 2.83 0.62 0.00 0.24 -5.03 105.19 104.14 1nj2 n GLY 256 Ca 0.02 -0.05 -0.23 0.00 0.00 0.00 0.00 46.02 45.76 1nj2 n GLY 256 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1nj2 n ASP 257 N -1.67 2.76 -3.68 1.61 8.00 -1.26 -4.80 116.55 117.52 1nj2 n ASP 257 Ca -0.09 -2.59 -0.28 0.00 0.71 0.00 0.00 54.79 52.54 1nj2 n ASP 257 Cb 0.60 0.14 -0.16 0.00 -0.02 0.00 0.00 41.12 41.68 1nj2 n ASP 257 CO 0.00 0.00 0.00 -1.00 -0.39 0.00 0.00 177.20 175.81 1nj2 s HIS 258 N -2.26 0.84 0.25 1.24 3.76 -1.26 -0.38 115.29 117.48 1nj2 s HIS 258 Ca 0.10 -0.85 0.11 0.00 -0.15 0.00 0.00 55.06 54.27 1nj2 s HIS 258 Cb -0.01 -1.02 -0.05 0.00 1.11 0.00 0.00 32.58 32.61 1nj2 s HIS 258 CO 0.06 -0.65 -0.16 -1.21 -0.85 0.00 0.00 174.74 171.94 1nj2 s GLU 259 N 1.92 1.82 0.82 1.40 2.02 -1.19 -4.92 118.70 120.56 1nj2 s GLU 259 Ca 0.02 -1.61 -0.12 0.00 0.02 0.00 0.00 54.97 53.28 1nj2 s GLU 259 Cb -0.17 -1.90 0.09 0.00 0.10 0.00 0.00 34.13 32.25 1nj2 s GLU 259 CO -0.14 0.36 1.11 0.71 0.02 0.00 0.00 175.26 177.32 1nj2 s TYR 260 N -2.26 2.78 0.32 1.61 1.51 -1.26 -2.73 117.35 117.31 1nj2 s TYR 260 Ca 0.28 1.04 0.03 0.00 -1.01 0.00 0.00 57.07 57.41 1nj2 s TYR 260 Cb -0.06 -3.21 -0.03 0.00 -0.11 0.00 0.00 41.96 38.55 1nj2 s TYR 260 CO 0.15 -1.91 0.48 0.14 -1.11 0.00 0.00 175.55 173.31 1nj2 s VAL 261 N -3.22 5.01 -0.20 0.71 -7.23 -1.06 -4.91 120.40 109.51 1nj2 s VAL 261 Ca 0.62 -0.69 -0.07 0.00 -1.81 0.00 0.00 61.98 60.03 1nj2 s VAL 261 Cb -0.14 -3.80 -0.04 0.00 0.56 0.00 0.00 36.38 32.96 1nj2 s VAL 261 CO 0.54 -0.43 0.05 -1.00 -0.31 0.00 0.00 175.10 173.94 1nj2 s HIS 262 N -2.20 3.17 0.09 2.82 3.76 -0.80 -4.30 115.29 117.83 1nj2 s HIS 262 Ca 0.39 -0.10 0.03 0.00 -0.15 0.00 0.00 55.06 55.22 1nj2 s HIS 262 Cb -0.09 -2.11 -0.04 0.00 1.11 0.00 0.00 32.58 31.45 1nj2 s HIS 262 CO 0.33 -0.01 -0.08 1.14 -0.85 0.00 0.00 174.74 175.28 1nj2 s GLN 263 N 0.70 0.80 0.02 1.40 -2.07 -1.11 0.41 119.66 119.80 1nj2 s GLN 263 Ca 0.03 -1.19 0.00 0.00 -1.82 0.00 0.00 55.36 52.38 1nj2 s GLN 263 Cb -0.13 -0.34 -0.02 0.00 -1.09 0.00 0.00 33.01 31.43 1nj2 s GLN 263 CO 0.02 0.03 -0.02 0.95 -1.32 0.00 0.00 175.29 174.94 1nj2 s THR 264 N -2.86 0.10 0.19 3.63 -4.23 -0.94 -2.25 115.64 109.28 1nj2 s THR 264 Ca 0.06 -0.72 0.02 0.00 -1.18 0.00 0.00 61.69 59.87 1nj2 s THR 264 Cb -0.00 -0.21 -0.05 0.00 1.34 0.00 0.00 72.50 73.58 1nj2 s THR 264 CO -0.02 -0.39 0.01 0.00 -0.54 0.00 0.00 174.62 173.68 1nj2 s TYR 266 N -3.65 -0.26 0.21 0.00 -0.85 -0.51 -0.60 117.35 111.69 1nj2 s TYR 266 Ca 0.26 0.46 -0.23 0.00 -0.52 0.00 0.00 57.07 57.03 1nj2 s TYR 266 Cb 0.06 0.46 0.04 0.00 0.38 0.00 0.00 41.96 42.91 1nj2 s TYR 266 CO 0.05 -0.24 0.85 0.20 -1.52 0.00 0.00 175.55 174.90 1nj2 s GLY 267 N -1.03 -0.16 0.05 5.49 0.00 -1.09 -0.52 107.32 110.06 1nj2 s GLY 267 Ca 0.02 -0.08 -0.08 0.00 0.00 0.00 0.00 44.72 44.59 1nj2 s GLY 267 CO -0.02 -0.03 0.15 0.48 0.00 0.00 0.00 173.10 173.68 1nj2 s LEU 268 N -2.94 1.58 0.00 0.66 0.05 -1.05 -2.68 118.68 114.30 1nj2 s LEU 268 Ca 0.12 -0.54 0.00 0.00 0.05 0.00 0.00 54.13 53.75 1nj2 s LEU 268 Cb -0.03 0.83 0.00 0.00 -2.05 0.00 0.00 46.19 44.94 1nj2 s LEU 268 CO 0.04 -0.60 0.00 -1.54 -0.55 0.00 0.00 176.35 173.71 1nj2 n SER 269 N 0.44 0.00 0.24 1.48 3.41 -1.26 -2.36 113.62 115.57 1nj2 n SER 269 Ca -0.17 0.00 0.14 0.00 -0.26 0.00 0.00 58.87 58.58 1nj2 n SER 269 Cb 0.60 0.00 0.39 0.00 -0.26 0.00 0.00 64.21 64.94 1nj2 n SER 269 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1nj2 h ASP 270 N 0.00 0.00 -0.96 4.04 3.32 -1.82 -3.09 116.42 117.91 1nj2 h ASP 270 Ca 0.00 0.00 0.20 0.00 0.02 0.00 0.00 57.03 57.25 1nj2 h ASP 270 Cb 0.00 0.00 -0.09 0.00 0.22 0.00 0.00 39.33 39.46 1nj2 h ASP 270 CO 0.00 0.00 0.62 0.03 -1.72 0.00 0.00 179.24 178.17 1nj2 h ARG 271 N 0.00 0.54 -0.61 3.56 3.08 -1.91 0.72 114.38 119.76 1nj2 h ARG 271 Ca 0.00 -0.03 0.11 0.00 0.07 0.00 0.00 59.98 60.13 1nj2 h ARG 271 Cb 0.78 -0.12 -0.09 0.00 0.08 0.00 0.00 29.97 30.62 1nj2 h ARG 271 CO 0.00 0.36 0.15 0.28 -1.07 0.00 0.00 179.97 179.69 1nj2 h VAL 272 N 0.56 0.65 -0.55 2.04 2.07 -1.87 0.24 116.25 119.39 1nj2 h VAL 272 Ca 0.53 -0.10 -0.09 0.00 0.82 0.00 0.00 66.70 67.86 1nj2 h VAL 272 Cb 1.09 0.34 -0.02 0.00 -1.52 0.00 0.00 31.29 31.18 1nj2 h VAL 272 CO -0.27 0.05 -0.02 0.40 0.02 0.00 0.00 177.57 177.75 1nj2 h ILE 273 N 0.28 1.26 0.14 4.57 2.04 0.17 -2.34 117.51 123.63 1nj2 h ILE 273 Ca 0.32 -1.12 0.02 0.00 1.00 0.00 0.00 64.86 65.08 1nj2 h ILE 273 Cb 0.48 0.85 -0.03 0.00 -0.74 0.00 0.00 36.82 37.37 1nj2 h ILE 273 CO -0.40 0.40 -0.29 0.00 0.00 0.00 0.00 178.15 177.87 1nj2 h ALA 274 N 1.10 -0.50 -0.32 1.87 0.00 0.83 -2.84 119.26 119.40 1nj2 h ALA 274 Ca 0.16 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 55.04 1nj2 h ALA 274 Cb 0.54 0.46 -0.03 0.00 0.00 0.00 0.00 17.79 18.76 1nj2 h ALA 274 CO 0.03 -0.83 0.16 0.66 0.00 0.00 0.00 179.25 179.27 1nj2 h SER 275 N -0.52 0.25 -0.61 0.00 4.64 -0.54 -1.86 113.55 114.91 1nj2 h SER 275 Ca 0.03 0.01 0.18 0.00 -0.47 0.00 0.00 61.79 61.53 1nj2 h SER 275 Cb 0.54 -0.04 -0.02 0.00 -0.31 0.00 0.00 62.40 62.56 1nj2 h SER 275 CO -0.15 0.19 0.46 0.58 -0.87 0.00 0.00 176.83 177.04 1nj2 h VAL 276 N 0.34 0.62 0.03 0.95 2.07 -1.27 0.29 116.25 119.28 1nj2 h VAL 276 Ca 0.13 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.65 1nj2 h VAL 276 Cb 0.04 0.67 0.00 0.00 -1.52 0.00 0.00 31.29 30.48 1nj2 h VAL 276 CO -0.09 0.00 -0.01 0.40 0.02 0.00 0.00 177.57 177.89 1nj2 h ILE 277 N 0.00 1.40 0.16 4.57 2.04 -1.12 -3.30 117.51 121.26 1nj2 h ILE 277 Ca 0.29 -1.76 -0.01 0.00 1.00 0.00 0.00 64.86 64.38 1nj2 h ILE 277 Cb 1.21 2.52 0.00 0.00 -0.74 0.00 0.00 36.82 39.81 1nj2 h ILE 277 CO -0.00 0.42 -0.08 0.00 0.00 0.00 0.00 178.15 178.49 1nj2 h ALA 278 N -0.01 -0.22 -0.52 1.87 0.00 -0.79 -3.15 119.26 116.43 1nj2 h ALA 278 Ca -0.00 -0.14 0.07 0.00 0.00 0.00 0.00 54.91 54.84 1nj2 h ALA 278 Cb 0.72 0.08 -0.06 0.00 0.00 0.00 0.00 17.79 18.54 1nj2 h ALA 278 CO 0.01 -0.50 0.18 0.82 0.00 0.00 0.00 179.25 179.76 1nj2 h ILE 279 N -0.46 0.81 -0.72 0.00 2.04 -0.66 0.21 117.51 118.73 1nj2 h ILE 279 Ca -0.02 -0.12 -0.48 0.00 1.00 0.00 0.00 64.86 65.24 1nj2 h ILE 279 Cb 0.36 0.42 -0.21 0.00 -0.74 0.00 0.00 36.82 36.65 1nj2 h ILE 279 CO 0.04 0.06 0.62 1.41 0.00 0.00 0.00 178.15 180.28 1nj2 n HIS 280 N -5.01 2.33 0.00 1.37 8.25 -1.24 -4.95 115.22 115.97 1nj2 n HIS 280 Ca 0.06 -2.36 0.00 0.00 -0.26 0.00 0.00 57.72 55.16 1nj2 n HIS 280 Cb 0.22 -1.14 0.00 0.00 1.12 0.00 0.00 29.99 30.19 1nj2 n HIS 280 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1nj2 n GLY 281 N -0.30 -1.39 0.00 -1.41 0.00 0.06 -3.83 105.19 98.32 1nj2 n GLY 281 Ca 0.45 -0.46 0.00 0.00 0.00 0.00 0.00 46.02 46.01 1nj2 n GLY 281 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1nj2 n ASP 282 N 0.00 0.00 0.08 1.61 2.03 -1.25 -4.53 116.55 114.49 1nj2 n ASP 282 Ca 0.00 0.00 -0.10 0.00 0.52 0.00 0.00 54.79 55.21 1nj2 n ASP 282 Cb 0.00 0.00 -0.12 0.00 -0.72 0.00 0.00 41.12 40.28 1nj2 n ASP 282 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 1nj2 h GLU 283 N 0.00 0.11 0.00 -0.67 4.39 -2.01 -3.16 114.58 113.24 1nj2 h GLU 283 Ca 0.00 -0.18 -0.12 0.00 0.34 0.00 0.00 59.36 59.40 1nj2 h GLU 283 Cb 0.00 0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 28.70 1nj2 h GLU 283 CO 0.00 1.08 -0.58 0.77 -1.16 0.00 0.00 179.01 179.12 1nj2 h SER 284 N 0.03 0.00 0.00 1.42 0.02 -1.95 -3.49 113.55 109.58 1nj2 h SER 284 Ca -0.06 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.89 1nj2 h SER 284 Cb 1.83 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.37 1nj2 h SER 284 CO 0.16 0.58 0.00 0.61 -1.14 0.00 0.00 176.83 177.03 1nj2 n GLY 285 N 0.47 0.52 3.72 -3.77 0.00 -1.20 -4.42 105.19 100.50 1nj2 n GLY 285 Ca -0.00 -1.18 -0.42 0.00 0.00 0.00 0.00 46.02 44.42 1nj2 n GLY 285 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1nj2 s LEU 286 N 0.00 4.39 -0.09 0.99 1.43 0.15 -3.78 118.68 121.77 1nj2 s LEU 286 Ca 0.00 2.02 0.01 0.00 -1.03 0.00 0.00 54.13 55.13 1nj2 s LEU 286 Cb 0.00 -3.58 0.02 0.00 0.03 0.00 0.00 46.19 42.65 1nj2 s LEU 286 CO 0.00 -0.41 -0.10 0.00 0.23 0.00 0.00 176.35 176.07 1nj2 s LEU 288 N 1.18 2.46 0.59 0.00 1.43 -1.25 -4.74 118.68 118.36 1nj2 s LEU 288 Ca -0.05 -0.90 -0.20 0.00 -1.03 0.00 0.00 54.13 51.96 1nj2 s LEU 288 Cb -0.14 -0.30 -0.03 0.00 0.03 0.00 0.00 46.19 45.75 1nj2 s LEU 288 CO -0.03 -0.31 1.30 -2.84 0.23 0.00 0.00 176.35 174.70 1nj2 s PRO 289 N -3.23 2.88 0.38 1.29 0.02 -1.26 -4.75 135.00 130.33 1nj2 s PRO 289 Ca 0.10 2.07 0.05 0.00 0.02 0.00 0.00 61.00 63.24 1nj2 s PRO 289 Cb -0.00 -2.03 0.76 0.00 0.02 0.00 0.00 34.50 33.25 1nj2 s PRO 289 CO -0.00 -1.34 2.01 -1.35 -0.33 0.00 0.00 177.00 175.98 1nj2 h PRO 290 N 0.99 0.69 -0.47 5.54 0.11 -1.93 -2.02 132.00 134.92 1nj2 h PRO 290 Ca -0.51 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.56 1nj2 h PRO 290 Cb 1.31 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1nj2 h PRO 290 CO 0.55 0.46 0.00 -0.25 -0.21 0.00 0.00 178.00 178.55 1nj2 n ASP 291 N -4.46 1.78 0.00 -2.05 8.00 -1.26 -3.81 116.55 114.75 1nj2 n ASP 291 Ca 0.07 -2.11 0.00 0.00 0.71 0.00 0.00 54.79 53.46 1nj2 n ASP 291 Cb 0.12 -0.31 0.00 0.00 -0.02 0.00 0.00 41.12 40.91 1nj2 n ASP 291 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1nj2 n VAL 292 N 0.22 0.00 -0.82 2.53 0.31 -0.80 -4.70 118.33 115.08 1nj2 n VAL 292 Ca 0.09 0.00 -0.31 0.00 -0.01 0.00 0.00 64.34 64.11 1nj2 n VAL 292 Cb 0.34 -0.18 0.16 0.00 -0.91 0.00 0.00 33.84 33.25 1nj2 n VAL 292 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1nj2 s ALA 293 N -1.76 1.42 0.04 3.52 0.00 -0.96 -4.57 121.76 119.45 1nj2 s ALA 293 Ca 0.00 0.42 -0.25 0.00 0.00 0.00 0.00 51.96 52.13 1nj2 s ALA 293 Cb 0.00 -3.38 -0.17 0.00 0.00 0.00 0.00 23.12 19.57 1nj2 s ALA 293 CO 0.00 -2.66 1.49 0.00 0.00 0.00 0.00 175.76 174.59 1nj2 h ALA 294 N -1.79 -0.18 -4.10 0.00 0.00 -1.91 -3.43 119.26 107.86 1nj2 h ALA 294 Ca -0.45 -0.13 -0.60 0.00 0.00 0.00 0.00 54.91 53.73 1nj2 h ALA 294 Cb 1.27 0.07 -0.31 0.00 0.00 0.00 0.00 17.79 18.82 1nj2 h ALA 294 CO 0.45 -0.50 -0.85 -1.01 0.00 0.00 0.00 179.25 177.34 1nj2 s HIS 295 N -5.32 1.87 0.04 0.00 0.09 -1.26 -4.98 115.29 105.73 1nj2 s HIS 295 Ca -0.15 -0.48 -0.13 0.00 -0.00 0.00 0.00 55.06 54.30 1nj2 s HIS 295 Cb 0.04 -1.24 -0.33 0.00 -0.00 0.00 0.00 32.58 31.05 1nj2 s HIS 295 CO 0.64 -0.13 1.05 1.96 -0.00 0.00 0.00 174.74 178.25 1nj2 h GLN 296 N 6.01 0.49 -5.14 1.40 4.20 -1.37 -3.39 115.11 117.30 1nj2 h GLN 296 Ca -0.35 -0.81 -0.41 0.00 0.06 0.00 0.00 58.65 57.14 1nj2 h GLN 296 Cb 1.16 0.30 -0.25 0.00 0.30 0.00 0.00 27.48 28.99 1nj2 h GLN 296 CO 0.48 1.38 -0.78 0.08 -0.67 0.00 0.00 178.83 179.32 1nj2 s VAL 297 N -2.66 0.98 -0.07 -0.54 1.01 -1.15 -2.63 120.40 115.34 1nj2 s VAL 297 Ca -0.08 -0.94 0.00 0.00 0.00 0.00 0.00 61.98 60.97 1nj2 s VAL 297 Cb 0.05 -0.90 0.02 0.00 0.00 0.00 0.00 36.38 35.55 1nj2 s VAL 297 CO 0.93 -0.03 -0.05 0.54 0.00 0.00 0.00 175.10 176.50 1nj2 s VAL 298 N -0.85 0.65 -0.35 2.92 0.11 -0.76 -2.49 120.40 119.64 1nj2 s VAL 298 Ca 0.00 -0.12 -0.14 0.00 -2.93 0.00 0.00 61.98 58.79 1nj2 s VAL 298 Cb -0.08 -0.70 -0.01 0.00 -1.53 0.00 0.00 36.38 34.06 1nj2 s VAL 298 CO 0.01 0.28 0.28 -0.63 -3.33 0.00 0.00 175.10 171.70 1nj2 s ILE 299 N 1.34 5.25 -0.17 7.04 1.01 -0.42 -0.76 121.20 134.50 1nj2 s ILE 299 Ca -0.04 -0.19 -0.05 0.00 0.00 0.00 0.00 60.65 60.37 1nj2 s ILE 299 Cb -0.14 -3.76 -0.03 0.00 0.01 0.00 0.00 42.46 38.54 1nj2 s ILE 299 CO -0.03 -0.06 -0.01 -0.69 0.00 0.00 0.00 174.94 174.16 1nj2 s VAL 300 N 1.79 4.13 -0.13 2.92 1.01 0.16 -2.39 120.40 127.89 1nj2 s VAL 300 Ca 0.07 -0.27 -0.07 0.00 0.00 0.00 0.00 61.98 61.71 1nj2 s VAL 300 Cb -0.17 -2.83 -0.04 0.00 0.00 0.00 0.00 36.38 33.34 1nj2 s VAL 300 CO 0.11 0.48 0.14 -2.16 0.00 0.00 0.00 175.10 173.67 1nj2 s PRO 301 N 0.41 3.50 -0.30 2.72 0.04 -1.26 -2.20 135.00 137.91 1nj2 s PRO 301 Ca -0.02 -0.14 -0.09 0.00 0.04 0.00 0.00 61.00 60.79 1nj2 s PRO 301 Cb -0.14 -3.21 -0.01 0.00 0.04 0.00 0.00 34.50 31.18 1nj2 s PRO 301 CO 0.02 0.74 0.13 0.42 0.04 0.00 0.00 177.00 178.35 1nj2 s ILE 302 N -0.91 4.53 0.01 0.56 -1.09 0.42 -4.94 121.20 119.79 1nj2 s ILE 302 Ca 0.14 -0.37 -0.05 0.00 -2.23 0.00 0.00 60.65 58.14 1nj2 s ILE 302 Cb -0.12 -3.27 -0.01 0.00 -1.58 0.00 0.00 42.46 37.48 1nj2 s ILE 302 CO 0.03 0.12 0.09 -0.63 -1.23 0.00 0.00 174.94 173.32 1nj2 s ILE 303 N 1.61 0.10 -0.00 2.92 1.01 -1.26 -4.51 121.20 121.07 1nj2 s ILE 303 Ca 0.05 -0.82 0.22 0.00 0.00 0.00 0.00 60.65 60.09 1nj2 s ILE 303 Cb -0.17 -0.47 0.36 0.00 0.01 0.00 0.00 42.46 42.20 1nj2 s ILE 303 CO 0.06 -0.45 1.14 0.49 0.00 0.00 0.00 174.94 176.18 1nj2 n PHE 304 N 1.37 0.00 -0.30 3.97 3.01 -1.26 -4.97 117.46 119.27 1nj2 n PHE 304 Ca -0.22 -0.44 0.00 0.00 1.01 0.00 0.00 57.45 57.80 1nj2 n PHE 304 Cb 0.56 -0.14 0.00 0.00 -0.01 0.00 0.00 39.48 39.89 1nj2 n PHE 304 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 1nj2 n LYS 305 N 0.39 0.00 -3.83 -1.08 5.02 -1.26 -5.03 118.16 112.36 1nj2 n LYS 305 Ca 0.05 0.00 -0.36 0.00 -2.02 0.00 0.00 58.31 55.98 1nj2 n LYS 305 Cb 1.07 -0.98 -0.13 0.00 -0.02 0.00 0.00 35.03 34.98 1nj2 n LYS 305 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1nj2 s LYS 306 N -0.55 2.32 -0.34 1.97 1.02 -1.26 -4.51 119.74 118.38 1nj2 s LYS 306 Ca 0.00 -1.44 0.00 0.00 0.02 0.00 0.00 55.97 54.55 1nj2 s LYS 306 Cb 0.00 -3.37 0.00 0.00 -0.52 0.00 0.00 37.83 33.94 1nj2 s LYS 306 CO 0.00 -0.79 0.00 0.00 -0.92 0.00 0.00 175.35 173.64 1nj2 n ALA 307 N 4.65 -0.05 -0.30 5.17 0.00 -1.26 -4.94 120.51 123.78 1nj2 n ALA 307 Ca -0.09 0.05 0.05 0.00 0.00 0.00 0.00 53.44 53.45 1nj2 n ALA 307 Cb 0.43 -0.70 0.14 0.00 0.00 0.00 0.00 19.45 19.32 1nj2 n ALA 307 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1nj2 h ALA 308 N 0.00 0.68 -0.39 0.00 0.00 -1.98 0.12 119.26 117.69 1nj2 h ALA 308 Ca -0.06 0.32 0.04 0.00 0.00 0.00 0.00 54.91 55.21 1nj2 h ALA 308 Cb 0.24 0.62 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 1nj2 h ALA 308 CO 0.09 -0.42 0.26 0.93 0.00 0.00 0.00 179.25 180.11 1nj2 h GLU 309 N 0.02 0.38 0.00 0.00 4.39 -1.95 -2.59 114.58 114.81 1nj2 h GLU 309 Ca 0.44 -0.02 -0.16 0.00 0.34 0.00 0.00 59.36 59.95 1nj2 h GLU 309 Cb 0.72 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 29.26 1nj2 h GLU 309 CO -0.86 0.25 -0.85 0.93 -1.16 0.00 0.00 179.01 177.32 1nj2 h GLU 310 N 0.39 0.00 -0.00 2.33 5.08 -1.18 -3.10 114.58 118.09 1nj2 h GLU 310 Ca 0.16 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.52 1nj2 h GLU 310 Cb 0.16 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.41 1nj2 h GLU 310 CO -0.04 0.69 -0.00 0.28 -1.00 0.00 0.00 179.01 178.94 1nj2 h VAL 311 N 0.00 1.43 0.50 3.13 2.07 -1.08 -3.16 116.25 119.14 1nj2 h VAL 311 Ca -0.03 -1.28 -0.02 0.00 0.82 0.00 0.00 66.70 66.19 1nj2 h VAL 311 Cb 1.59 2.29 -0.00 0.00 -1.52 0.00 0.00 31.29 33.66 1nj2 h VAL 311 CO 0.09 0.33 -0.31 0.24 0.02 0.00 0.00 177.57 177.95 1nj2 h MET 312 N -0.53 -0.73 0.00 1.57 2.86 -1.62 -1.02 114.93 115.47 1nj2 h MET 312 Ca 0.00 0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.69 1nj2 h MET 312 Cb 0.55 0.17 0.00 0.00 0.06 0.00 0.00 31.60 32.37 1nj2 h MET 312 CO 0.00 -0.48 0.51 0.39 1.06 0.00 0.00 176.91 178.39 1nj2 n GLU 313 N -4.26 0.04 -0.09 1.72 1.02 -1.17 0.18 120.64 118.09 1nj2 n GLU 313 Ca -0.09 0.45 -0.12 0.00 -0.02 0.00 0.00 57.16 57.37 1nj2 n GLU 313 Cb 0.31 -2.14 -0.15 0.00 -0.02 0.00 0.00 31.44 29.45 1nj2 n GLU 313 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1nj2 n ALA 314 N -1.35 1.44 0.06 0.62 0.00 -0.75 -3.83 120.51 116.70 1nj2 n ALA 314 Ca -0.00 -1.14 -0.03 0.00 0.00 0.00 0.00 53.44 52.27 1nj2 n ALA 314 Cb 0.52 -0.31 0.20 0.00 0.00 0.00 0.00 19.45 19.86 1nj2 n ALA 314 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1nj2 h ARG 316 N 0.29 -0.44 0.00 0.00 3.08 -1.51 -2.13 114.38 113.67 1nj2 h ARG 316 Ca 0.03 0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.11 1nj2 h ARG 316 Cb 0.80 0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.95 1nj2 h ARG 316 CO 0.06 -0.13 0.12 0.39 -1.07 0.00 0.00 179.97 179.35 1nj2 n GLU 317 N -5.16 0.00 -0.13 0.04 1.02 -1.21 0.04 120.64 115.24 1nj2 n GLU 317 Ca -0.10 0.19 -0.22 0.00 -0.02 0.00 0.00 57.16 57.01 1nj2 n GLU 317 Cb 0.27 -1.62 -0.11 0.00 -0.02 0.00 0.00 31.44 29.95 1nj2 n GLU 317 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 1nj2 n LEU 318 N -1.11 2.61 0.30 -4.62 7.94 -0.91 -3.90 117.00 117.31 1nj2 n LEU 318 Ca 0.00 0.03 -0.16 0.00 -1.11 0.00 0.00 56.01 54.77 1nj2 n LEU 318 Cb 0.12 -0.87 -0.08 0.00 0.53 0.00 0.00 43.42 43.12 1nj2 n LEU 318 CO 0.00 0.81 0.55 -0.09 -1.11 0.00 0.00 177.39 177.55 1nj2 h ARG 319 N -0.35 -0.73 -0.00 1.96 2.43 0.24 -1.46 114.38 116.47 1nj2 h ARG 319 Ca -0.62 0.05 0.00 0.00 -0.81 0.00 0.00 59.98 58.60 1nj2 h ARG 319 Cb 1.79 0.17 -0.00 0.00 -0.42 0.00 0.00 29.97 31.51 1nj2 h ARG 319 CO -0.21 -0.42 0.01 0.66 -1.51 0.00 0.00 179.97 178.49 1nj2 h SER 320 N -0.94 0.00 0.97 -3.80 4.64 -1.60 0.19 113.55 113.01 1nj2 h SER 320 Ca -0.08 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 61.04 1nj2 h SER 320 Cb 0.64 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.70 1nj2 h SER 320 CO 0.13 0.00 -1.07 -0.09 -0.87 0.00 0.00 176.83 174.92 1nj2 h ARG 321 N 0.00 0.00 0.10 4.77 2.43 -1.62 -2.97 114.38 117.09 1nj2 h ARG 321 Ca 0.00 0.00 -0.16 0.00 -0.81 0.00 0.00 59.98 59.01 1nj2 h ARG 321 Cb 0.01 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 29.57 1nj2 h ARG 321 CO -0.00 0.78 -0.76 -0.07 -1.51 0.00 0.00 179.97 178.41 1nj2 h LEU 322 N 0.00 0.32 -0.38 3.80 3.38 0.08 -3.34 115.31 119.17 1nj2 h LEU 322 Ca -0.07 -0.92 0.07 0.00 0.09 0.00 0.00 57.88 57.05 1nj2 h LEU 322 Cb 1.74 -0.10 -0.06 0.00 0.09 0.00 0.00 40.66 42.32 1nj2 h LEU 322 CO 0.10 1.35 0.01 -0.33 0.09 0.00 0.00 178.44 179.66 1nj2 h GLU 323 N -0.54 0.11 -1.90 1.13 5.08 -0.84 -0.02 114.58 117.59 1nj2 h GLU 323 Ca -0.15 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.20 1nj2 h GLU 323 Cb 1.50 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.72 1nj2 h GLU 323 CO 0.08 0.07 0.00 0.00 -1.00 0.00 0.00 179.01 178.16 1nj2 n ALA 324 N -2.53 3.75 -1.49 3.43 0.00 -1.12 -1.69 120.51 120.86 1nj2 n ALA 324 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.46 1nj2 n ALA 324 Cb 0.20 -1.04 0.00 0.00 0.00 0.00 0.00 19.45 18.61 1nj2 n ALA 324 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1nj2 n ALA 325 N 1.42 0.01 -1.56 0.00 0.00 -0.05 -4.98 120.51 115.35 1nj2 n ALA 325 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1nj2 n ALA 325 Cb 0.48 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.93 1nj2 n ALA 325 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1nj2 n GLY 326 N 0.00 0.63 3.02 0.00 0.00 -0.68 -5.07 105.19 103.09 1nj2 n GLY 326 Ca 0.00 -0.39 -0.27 0.00 0.00 0.00 0.00 46.02 45.36 1nj2 n GLY 326 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1nj2 s PHE 327 N -2.77 1.69 -0.90 1.61 0.40 -1.08 -5.02 117.98 111.91 1nj2 s PHE 327 Ca 0.00 -0.73 -0.24 0.00 -0.60 0.00 0.00 56.93 55.35 1nj2 s PHE 327 Cb 0.00 -1.25 0.01 0.00 0.51 0.00 0.00 43.02 42.29 1nj2 s PHE 327 CO 0.00 -0.39 1.62 1.03 0.70 0.00 0.00 175.22 178.17 1nj2 s ARG 328 N 0.95 3.11 0.25 0.44 0.52 -1.26 -4.34 118.95 118.62 1nj2 s ARG 328 Ca -0.09 -0.55 0.09 0.00 -0.52 0.00 0.00 55.73 54.66 1nj2 s ARG 328 Cb -0.15 -4.98 -0.04 0.00 0.52 0.00 0.00 34.95 30.30 1nj2 s ARG 328 CO -0.00 -2.61 0.05 0.54 0.02 0.00 0.00 175.30 173.30 1nj2 s VAL 329 N 7.08 3.74 -0.01 3.52 0.11 -1.26 -1.07 120.40 132.50 1nj2 s VAL 329 Ca 0.54 -1.72 -0.07 0.00 -2.93 0.00 0.00 61.98 57.79 1nj2 s VAL 329 Cb -0.05 -2.99 0.01 0.00 -1.53 0.00 0.00 36.38 31.82 1nj2 s VAL 329 CO -0.00 -0.34 0.15 -2.28 -3.33 0.00 0.00 175.10 169.31 1nj2 s HIS 330 N -2.21 -0.02 -0.18 1.54 5.04 -1.04 -5.00 115.29 113.42 1nj2 s HIS 330 Ca 0.31 0.01 0.01 0.00 -1.54 0.00 0.00 55.06 53.85 1nj2 s HIS 330 Cb -0.07 -0.02 0.04 0.00 0.04 0.00 0.00 32.58 32.57 1nj2 s HIS 330 CO 0.21 -0.25 -0.11 -1.17 -2.34 0.00 0.00 174.74 171.07 1nj2 s LEU 331 N -1.09 2.11 -1.06 8.88 2.96 -1.26 -1.30 118.68 127.91 1nj2 s LEU 331 Ca -0.12 -0.78 -0.21 0.00 -0.22 0.00 0.00 54.13 52.80 1nj2 s LEU 331 Cb -0.06 -1.21 0.07 0.00 0.50 0.00 0.00 46.19 45.49 1nj2 s LEU 331 CO 0.01 -0.12 1.45 -0.62 -1.32 0.00 0.00 176.35 175.75 1nj2 s ASP 332 N 1.43 6.60 0.12 3.68 -1.08 -1.01 -4.79 116.67 121.62 1nj2 s ASP 332 Ca 0.00 -1.78 -0.17 0.00 -0.52 0.00 0.00 52.55 50.08 1nj2 s ASP 332 Cb -0.15 -2.54 -0.04 0.00 -1.46 0.00 0.00 42.92 38.73 1nj2 s ASP 332 CO -0.09 -1.35 1.63 -0.78 0.52 0.00 0.00 175.17 175.10 1nj2 h ASP 333 N 9.14 0.49 0.00 -0.34 -0.00 -1.97 -3.42 116.42 120.32 1nj2 h ASP 333 Ca 0.24 -0.21 0.00 0.00 -0.00 0.00 0.00 57.03 57.06 1nj2 h ASP 333 Cb 0.98 -0.13 0.00 0.00 -0.00 0.00 0.00 39.33 40.18 1nj2 h ASP 333 CO 1.38 0.57 0.00 0.54 -0.00 0.00 0.00 179.24 181.73 1nj2 n ARG 334 N -4.66 0.00 -3.73 0.28 1.74 -1.26 -4.89 116.66 104.14 1nj2 n ARG 334 Ca -0.02 0.00 -0.35 0.00 -0.77 0.00 0.00 57.85 56.71 1nj2 n ARG 334 Cb 0.17 0.00 -0.09 0.00 -1.02 0.00 0.00 32.46 31.52 1nj2 n ARG 334 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1nj2 s ASP 335 N 0.00 5.31 0.22 0.55 -1.08 -1.26 -5.04 116.67 115.36 1nj2 s ASP 335 Ca 0.00 -3.17 -0.12 0.00 -0.52 0.00 0.00 52.55 48.73 1nj2 s ASP 335 Cb 0.00 -1.83 -0.00 0.00 -1.46 0.00 0.00 42.92 39.63 1nj2 s ASP 335 CO 0.00 -0.29 0.43 -0.63 0.52 0.00 0.00 175.17 175.20 1nj2 s ILE 336 N -0.53 0.02 -0.36 4.11 1.01 -1.26 -5.10 121.20 119.10 1nj2 s ILE 336 Ca 0.20 -1.32 -0.28 0.00 0.00 0.00 0.00 60.65 59.26 1nj2 s ILE 336 Cb -0.16 -2.01 -0.07 0.00 0.01 0.00 0.00 42.46 40.22 1nj2 s ILE 336 CO -0.06 -0.10 2.31 0.54 0.00 0.00 0.00 174.94 177.63 1nj2 n ARG 337 N -0.33 1.47 -0.54 2.79 1.74 -1.26 -4.81 116.66 115.72 1nj2 n ARG 337 Ca -0.04 0.29 0.43 0.00 -0.77 0.00 0.00 57.85 57.76 1nj2 n ARG 337 Cb 0.62 -3.20 0.70 0.00 -1.02 0.00 0.00 32.46 29.56 1nj2 n ARG 337 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1nj2 n ALA 338 N 13.14 1.50 0.20 7.54 0.00 -1.26 0.14 120.51 141.77 1nj2 n ALA 338 Ca 0.35 0.75 0.07 0.00 0.00 0.00 0.00 53.44 54.60 1nj2 n ALA 338 Cb 0.45 -1.04 0.58 0.00 0.00 0.00 0.00 19.45 19.44 1nj2 n ALA 338 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1nj2 h GLY 339 N 0.00 0.13 0.91 0.00 0.00 -2.01 -1.75 103.07 100.36 1nj2 h GLY 339 Ca 0.86 -0.05 -0.15 0.00 0.00 0.00 0.00 47.33 47.99 1nj2 h GLY 339 CO -0.27 0.05 -0.51 -0.09 0.00 0.00 0.00 176.54 175.72 1nj2 h ARG 340 N 0.13 0.56 -0.93 4.80 2.43 0.80 -2.89 114.38 119.29 1nj2 h ARG 340 Ca 0.03 -0.44 0.16 0.00 -0.81 0.00 0.00 59.98 58.92 1nj2 h ARG 340 Cb 0.02 0.09 -0.10 0.00 -0.42 0.00 0.00 29.97 29.56 1nj2 h ARG 340 CO -0.00 1.06 0.53 0.87 -1.51 0.00 0.00 179.97 180.92 1nj2 h LYS 341 N 0.19 0.72 -0.58 0.20 1.57 -1.31 0.30 116.57 117.66 1nj2 h LYS 341 Ca -0.03 -0.04 0.07 0.00 -1.87 0.00 0.00 60.65 58.78 1nj2 h LYS 341 Cb 1.14 -0.16 -0.06 0.00 0.08 0.00 0.00 32.23 33.23 1nj2 h LYS 341 CO 0.11 0.48 0.27 1.88 -0.57 0.00 0.00 179.45 181.62 1nj2 h TYR 342 N 0.74 0.49 0.68 -1.35 -1.99 -1.21 -2.69 116.97 111.64 1nj2 h TYR 342 Ca 0.51 0.03 -0.03 0.00 2.00 0.00 0.00 58.73 61.23 1nj2 h TYR 342 Cb 0.70 -0.13 0.01 0.00 2.00 0.00 0.00 36.73 39.31 1nj2 h TYR 342 CO -0.04 0.20 -0.33 -0.92 -0.00 0.00 0.00 178.16 177.06 1nj2 h TYR 343 N 0.50 -0.85 0.11 4.88 3.20 -0.25 -2.89 116.97 121.67 1nj2 h TYR 343 Ca 0.28 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.13 1nj2 h TYR 343 Cb 0.25 0.28 -0.02 0.00 1.54 0.00 0.00 36.73 38.78 1nj2 h TYR 343 CO -0.12 -0.50 -0.25 0.93 -1.64 0.00 0.00 178.16 176.57 1nj2 h GLU 344 N -1.01 -0.38 -0.07 1.82 5.08 -1.13 0.52 114.58 119.41 1nj2 h GLU 344 Ca -0.09 0.03 0.02 0.00 -1.00 0.00 0.00 59.36 58.31 1nj2 h GLU 344 Cb 0.73 0.09 -0.00 0.00 0.50 0.00 0.00 28.75 30.06 1nj2 h GLU 344 CO 0.15 -0.25 0.15 -1.49 -1.00 0.00 0.00 179.01 176.57 1nj2 h TRP 345 N -0.39 0.00 0.12 4.33 -0.00 -1.62 -1.09 115.95 117.29 1nj2 h TRP 345 Ca -0.01 0.00 -0.30 0.00 -0.00 0.00 0.00 58.89 58.58 1nj2 h TRP 345 Cb 0.38 0.00 -0.01 0.00 -0.00 0.00 0.00 29.16 29.53 1nj2 h TRP 345 CO -0.31 0.00 -1.51 1.49 -0.00 0.00 0.00 178.44 178.11 1nj2 h GLU 346 N 0.00 0.24 -0.00 0.49 4.81 -1.19 -2.08 114.58 116.86 1nj2 h GLU 346 Ca 0.03 -0.42 -0.16 0.00 -0.13 0.00 0.00 59.36 58.68 1nj2 h GLU 346 Cb 0.34 0.16 -0.02 0.00 0.63 0.00 0.00 28.75 29.85 1nj2 h GLU 346 CO -0.00 1.11 -0.76 0.00 -0.73 0.00 0.00 179.01 178.63 1nj2 h MET 347 N 0.07 0.01 0.00 1.92 -0.00 0.01 -3.18 114.93 113.76 1nj2 h MET 347 Ca -0.24 -0.01 -0.12 0.00 -0.00 0.00 0.00 59.70 59.33 1nj2 h MET 347 Cb 2.01 0.00 -0.02 0.00 -0.00 0.00 0.00 31.60 33.60 1nj2 h MET 347 CO 0.16 0.76 -0.57 0.00 -0.00 0.00 0.00 176.91 177.26 1nj2 h ARG 348 N 0.01 0.00 0.00 -0.10 3.08 -1.30 0.45 114.38 116.52 1nj2 h ARG 348 Ca -0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.04 1nj2 h ARG 348 Cb 1.34 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.39 1nj2 h ARG 348 CO 0.10 0.57 0.00 0.41 -1.07 0.00 0.00 179.97 179.98 1nj2 n GLY 349 N 0.22 1.13 3.71 0.04 0.00 -1.10 -4.71 105.19 104.48 1nj2 n GLY 349 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 1nj2 n GLY 349 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1nj2 s VAL 350 N -2.00 2.42 0.04 1.61 1.01 -0.80 -3.78 120.40 118.91 1nj2 s VAL 350 Ca 0.00 0.17 -0.30 0.00 0.00 0.00 0.00 61.98 61.85 1nj2 s VAL 350 Cb 0.00 -3.11 -0.18 0.00 0.00 0.00 0.00 36.38 33.09 1nj2 s VAL 350 CO 0.00 0.01 1.42 -0.65 0.00 0.00 0.00 175.10 175.88 1nj2 h PRO 351 N 7.52 -0.82 -5.48 2.72 0.11 -1.76 -3.45 132.00 130.85 1nj2 h PRO 351 Ca -0.44 0.06 -0.68 0.00 0.11 0.00 0.00 66.00 65.05 1nj2 h PRO 351 Cb 1.21 0.19 -0.32 0.00 0.11 0.00 0.00 31.00 32.18 1nj2 h PRO 351 CO 0.94 -0.50 -0.88 -0.51 -0.21 0.00 0.00 178.00 176.84 1nj2 s LEU 352 N -9.82 2.12 -0.14 2.35 1.43 -1.08 -2.68 118.68 110.86 1nj2 s LEU 352 Ca -0.16 -0.54 -0.02 0.00 -1.03 0.00 0.00 54.13 52.38 1nj2 s LEU 352 Cb 0.03 -1.41 -0.02 0.00 0.03 0.00 0.00 46.19 44.81 1nj2 s LEU 352 CO 0.56 0.18 -0.08 -0.60 0.23 0.00 0.00 176.35 176.64 1nj2 s ARG 353 N 0.24 3.48 -0.20 1.70 3.52 -0.86 -1.82 118.95 125.00 1nj2 s ARG 353 Ca -0.16 -0.59 -0.02 0.00 -0.13 0.00 0.00 55.73 54.84 1nj2 s ARG 353 Cb -0.17 -2.77 0.01 0.00 -1.56 0.00 0.00 34.95 30.46 1nj2 s ARG 353 CO 0.08 0.26 -0.11 0.08 -0.81 0.00 0.00 175.30 174.80 1nj2 s VAL 354 N 0.27 2.78 -0.09 7.11 1.01 0.06 -1.41 120.40 130.12 1nj2 s VAL 354 Ca -0.06 -0.70 -0.04 0.00 0.00 0.00 0.00 61.98 61.18 1nj2 s VAL 354 Cb -0.15 -2.24 -0.04 0.00 0.00 0.00 0.00 36.38 33.96 1nj2 s VAL 354 CO 0.04 0.47 0.07 -1.61 0.00 0.00 0.00 175.10 174.07 1nj2 s GLU 355 N 1.39 3.21 -0.07 2.72 2.02 -0.51 -0.67 118.70 126.79 1nj2 s GLU 355 Ca 0.05 -0.28 0.01 0.00 0.02 0.00 0.00 54.97 54.77 1nj2 s GLU 355 Cb -0.14 -2.99 0.02 0.00 0.10 0.00 0.00 34.13 31.13 1nj2 s GLU 355 CO -0.08 0.73 -0.07 0.42 0.02 0.00 0.00 175.26 176.28 1nj2 s ILE 356 N -0.98 0.82 0.26 -1.63 1.01 -0.94 -2.61 121.20 117.14 1nj2 s ILE 356 Ca 0.15 -0.26 0.02 0.00 0.00 0.00 0.00 60.65 60.56 1nj2 s ILE 356 Cb -0.12 -0.82 -0.05 0.00 0.01 0.00 0.00 42.46 41.48 1nj2 s ILE 356 CO 0.04 0.30 0.06 -0.83 0.00 0.00 0.00 174.94 174.52 1nj2 s GLY 357 N 1.07 1.74 0.13 6.18 0.00 -1.26 -0.44 107.32 114.74 1nj2 s GLY 357 Ca -0.08 -1.87 -0.25 0.00 0.00 0.00 0.00 44.72 42.52 1nj2 s GLY 357 CO -0.01 -1.65 1.64 -2.55 0.00 0.00 0.00 173.10 170.53 1nj2 h PRO 358 N 2.36 -0.36 -0.14 2.90 0.11 -1.93 0.14 132.00 135.10 1nj2 h PRO 358 Ca -0.39 0.02 0.03 0.00 0.11 0.00 0.00 66.00 65.77 1nj2 h PRO 358 Cb 1.24 0.08 -0.05 0.00 0.11 0.00 0.00 31.00 32.38 1nj2 h PRO 358 CO 0.63 -0.24 -0.44 0.00 -0.21 0.00 0.00 178.00 177.74 1nj2 h ARG 359 N -0.37 -0.44 -0.09 1.05 3.08 -1.98 -1.33 114.38 114.31 1nj2 h ARG 359 Ca 0.07 0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.14 1nj2 h ARG 359 Cb 0.47 0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.61 1nj2 h ARG 359 CO -0.24 -0.29 0.02 -0.44 -1.07 0.00 0.00 179.97 177.95 1nj2 h ASP 360 N -0.45 0.11 0.24 7.04 3.32 -1.80 -3.11 116.42 121.77 1nj2 h ASP 360 Ca 0.03 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.08 1nj2 h ASP 360 Cb 0.54 -0.03 -0.04 0.00 0.22 0.00 0.00 39.33 40.03 1nj2 h ASP 360 CO -0.37 0.12 -0.51 0.25 -1.72 0.00 0.00 179.24 177.01 1nj2 h LEU 361 N 0.13 -1.49 -0.09 1.55 5.85 0.47 -2.04 115.31 119.67 1nj2 h LEU 361 Ca 0.03 0.15 0.02 0.00 0.84 0.00 0.00 57.88 58.91 1nj2 h LEU 361 Cb 0.05 0.53 -0.03 0.00 0.37 0.00 0.00 40.66 41.58 1nj2 h LEU 361 CO -0.00 -0.58 -0.26 -0.33 -0.34 0.00 0.00 178.44 176.92 1nj2 h GLU 362 N -0.82 -0.25 -1.05 1.25 5.08 -1.43 -1.26 114.58 116.10 1nj2 h GLU 362 Ca -0.02 0.02 0.36 0.00 -1.00 0.00 0.00 59.36 58.71 1nj2 h GLU 362 Cb 0.78 0.06 -0.15 0.00 0.50 0.00 0.00 28.75 29.94 1nj2 h GLU 362 CO -0.21 -0.17 0.61 -0.22 -1.00 0.00 0.00 179.01 178.02 1nj2 h LYS 363 N -0.26 0.22 -0.38 2.33 1.63 -1.63 -3.45 116.57 115.04 1nj2 h LYS 363 Ca 0.02 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.81 1nj2 h LYS 363 Cb 0.32 -0.05 0.00 0.00 -0.60 0.00 0.00 32.23 31.90 1nj2 h LYS 363 CO -0.23 0.15 0.00 0.41 -3.45 0.00 0.00 179.45 176.33 1nj2 n GLY 364 N -1.32 0.62 3.85 5.01 0.00 -0.48 -5.03 105.19 107.84 1nj2 n GLY 364 Ca 0.34 -0.28 -0.06 0.00 0.00 0.00 0.00 46.02 46.02 1nj2 n GLY 364 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nj2 s ALA 365 N -1.58 -1.21 0.30 4.61 0.00 -0.95 -1.88 121.76 121.06 1nj2 s ALA 365 Ca 0.00 -0.52 -0.04 0.00 0.00 0.00 0.00 51.96 51.40 1nj2 s ALA 365 Cb 0.00 0.72 0.02 0.00 0.00 0.00 0.00 23.12 23.86 1nj2 s ALA 365 CO 0.00 -1.03 0.47 0.00 0.00 0.00 0.00 175.76 175.20 1nj2 n ALA 366 N -0.62 -0.56 -2.70 0.00 0.00 -0.34 -4.13 120.51 112.16 1nj2 n ALA 366 Ca -0.05 -1.29 -0.35 0.00 0.00 0.00 0.00 53.44 51.74 1nj2 n ALA 366 Cb 0.60 1.04 -0.09 0.00 0.00 0.00 0.00 19.45 20.99 1nj2 n ALA 366 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1nj2 s VAL 367 N -2.64 4.36 -0.18 0.00 1.01 -1.07 -2.10 120.40 119.78 1nj2 s VAL 367 Ca 0.22 -0.23 0.00 0.00 0.00 0.00 0.00 61.98 61.98 1nj2 s VAL 367 Cb -0.02 -2.84 0.04 0.00 0.00 0.00 0.00 36.38 33.56 1nj2 s VAL 367 CO 0.16 0.60 -0.09 -0.63 0.00 0.00 0.00 175.10 175.14 1nj2 s ILE 368 N -0.84 1.43 -0.19 2.22 1.01 -0.93 -1.43 121.20 122.48 1nj2 s ILE 368 Ca 0.13 -0.79 -0.09 0.00 0.00 0.00 0.00 60.65 59.90 1nj2 s ILE 368 Cb -0.11 -1.51 -0.05 0.00 0.01 0.00 0.00 42.46 40.80 1nj2 s ILE 368 CO 0.02 0.22 0.11 -0.55 0.00 0.00 0.00 174.94 174.74 1nj2 s SER 369 N 1.50 6.06 0.99 3.58 0.15 -0.50 -2.05 113.70 123.43 1nj2 s SER 369 Ca 0.01 0.21 -0.14 0.00 0.70 0.00 0.00 55.95 56.73 1nj2 s SER 369 Cb -0.15 -2.05 0.19 0.00 -1.71 0.00 0.00 66.02 62.31 1nj2 s SER 369 CO -0.08 0.20 1.14 0.54 1.20 0.00 0.00 173.24 176.24 1nj2 n ARG 370 N 3.36 -1.08 0.00 5.44 1.74 -0.97 -2.03 116.66 123.11 1nj2 n ARG 370 Ca -0.17 -1.81 0.00 0.00 -0.77 0.00 0.00 57.85 55.10 1nj2 n ARG 370 Cb 0.52 -1.16 0.00 0.00 -1.02 0.00 0.00 32.46 30.80 1nj2 n ARG 370 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 1nj2 n ARG 371 N -3.41 1.49 0.09 5.56 3.00 -1.09 -4.43 116.66 117.86 1nj2 n ARG 371 Ca 0.14 0.00 -0.04 0.00 -0.00 0.00 0.00 57.85 57.96 1nj2 n ARG 371 Cb 0.50 -0.88 0.16 0.00 0.00 0.00 0.00 32.46 32.25 1nj2 n ARG 371 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.63 178.01 1nj2 h ASP 372 N 0.00 0.27 0.00 6.15 2.03 -1.95 -3.42 116.42 119.50 1nj2 h ASP 372 Ca 0.00 -0.14 0.00 0.00 -0.73 0.00 0.00 57.03 56.16 1nj2 h ASP 372 Cb 0.75 -0.08 0.00 0.00 -0.83 0.00 0.00 39.33 39.17 1nj2 h ASP 372 CO 0.00 0.75 0.00 0.41 -1.03 0.00 0.00 179.24 179.37 1nj2 n THR 373 N -3.93 0.00 0.00 1.15 -1.04 -1.26 -5.06 114.28 104.13 1nj2 n THR 373 Ca -0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.99 1nj2 n THR 373 Cb 0.56 -0.63 0.00 0.00 -1.82 0.00 0.00 70.33 68.44 1nj2 n THR 373 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1nj2 n GLY 374 N 3.25 0.33 3.67 3.41 0.00 -1.26 -5.05 105.19 109.54 1nj2 n GLY 374 Ca 0.00 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.53 1nj2 n GLY 374 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1nj2 n GLU 375 N 0.00 1.97 -3.82 1.61 4.07 -1.26 -4.52 120.64 118.69 1nj2 n GLU 375 Ca 0.00 0.72 -0.36 0.00 -0.06 0.00 0.00 57.16 57.46 1nj2 n GLU 375 Cb 0.00 -2.50 -0.12 0.00 -0.06 0.00 0.00 31.44 28.75 1nj2 n GLU 375 CO 0.00 0.00 0.00 0.15 -0.06 0.00 0.00 177.13 177.22 1nj2 s LYS 376 N 2.61 2.09 0.30 5.31 1.02 -1.26 -2.30 119.74 127.52 1nj2 s LYS 376 Ca 0.88 -1.67 -0.03 0.00 0.02 0.00 0.00 55.97 55.17 1nj2 s LYS 376 Cb -0.75 -3.47 0.06 0.00 -0.52 0.00 0.00 37.83 33.16 1nj2 s LYS 376 CO 0.48 -0.95 0.41 1.33 -0.92 0.00 0.00 175.35 175.71 1nj2 n VAL 377 N 4.59 0.00 -3.63 3.17 0.24 -0.87 -4.82 118.33 117.01 1nj2 n VAL 377 Ca -0.05 -0.48 -0.28 0.00 -2.04 0.00 0.00 64.34 61.49 1nj2 n VAL 377 Cb 0.42 -1.46 -0.16 0.00 -1.47 0.00 0.00 33.84 31.17 1nj2 n VAL 377 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 1nj2 s THR 378 N -1.43 0.18 0.28 3.34 2.01 -1.26 -2.19 115.64 116.57 1nj2 s THR 378 Ca 0.26 -0.59 0.10 0.00 0.31 0.00 0.00 61.69 61.76 1nj2 s THR 378 Cb -0.01 -0.94 -0.05 0.00 0.01 0.00 0.00 72.50 71.51 1nj2 s THR 378 CO 0.17 -0.45 -0.04 0.00 -0.69 0.00 0.00 174.62 173.62 1nj2 s ALA 379 N 1.99 3.10 -0.09 7.40 0.00 -0.89 -4.95 121.76 128.33 1nj2 s ALA 379 Ca 0.04 -1.73 -0.26 0.00 0.00 0.00 0.00 51.96 50.01 1nj2 s ALA 379 Cb -0.16 -0.63 -0.03 0.00 0.00 0.00 0.00 23.12 22.30 1nj2 s ALA 379 CO -0.19 0.24 0.85 -0.51 0.00 0.00 0.00 175.76 176.15 1nj2 s ASP 380 N -3.65 7.11 0.00 0.00 1.01 -1.26 -1.20 116.67 118.67 1nj2 s ASP 380 Ca 0.32 1.34 0.00 0.00 0.71 0.00 0.00 52.55 54.92 1nj2 s ASP 380 Cb -0.05 -2.48 0.00 0.00 1.01 0.00 0.00 42.92 41.39 1nj2 s ASP 380 CO 0.19 -0.28 0.62 0.18 0.21 0.00 0.00 175.17 176.09 1nj2 n LEU 381 N 4.41 0.00 0.00 1.23 4.77 -0.79 -3.14 117.00 123.48 1nj2 n LEU 381 Ca 0.04 0.19 0.00 0.00 -0.03 0.00 0.00 56.01 56.21 1nj2 n LEU 381 Cb 0.50 -0.19 0.00 0.00 -2.33 0.00 0.00 43.42 41.40 1nj2 n LEU 381 CO 0.49 -0.19 0.11 1.67 -1.33 0.00 0.00 177.39 178.14 1nj2 n GLN 382 N -1.12 0.00 -1.39 3.23 7.27 -1.26 -4.17 117.38 119.93 1nj2 n GLN 382 Ca 0.00 0.34 -0.28 0.00 0.07 0.00 0.00 57.00 57.13 1nj2 n GLN 382 Cb 0.11 -0.96 0.00 0.00 2.41 0.00 0.00 30.24 31.80 1nj2 n GLN 382 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1nj2 n GLY 383 N 1.40 4.69 0.12 1.69 0.00 -1.19 -4.53 105.19 107.38 1nj2 n GLY 383 Ca 0.00 -1.85 -0.03 0.00 0.00 0.00 0.00 46.02 44.15 1nj2 n GLY 383 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1nj2 h ILE 384 N 1.61 1.50 -0.60 -0.61 2.10 -1.72 -3.17 117.51 116.63 1nj2 h ILE 384 Ca 0.43 -2.46 0.07 0.00 1.08 0.00 0.00 64.86 63.98 1nj2 h ILE 384 Cb 0.66 2.33 -0.06 0.00 -1.09 0.00 0.00 36.82 38.66 1nj2 h ILE 384 CO 1.04 0.70 0.28 -0.33 -1.08 0.00 0.00 178.15 178.76 1nj2 h GLU 385 N 0.00 0.49 -0.01 2.19 5.08 -1.90 -1.96 114.58 118.48 1nj2 h GLU 385 Ca -0.01 -0.03 -0.21 0.00 -1.00 0.00 0.00 59.36 58.12 1nj2 h GLU 385 Cb 1.28 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 30.41 1nj2 h GLU 385 CO 0.09 0.32 -0.88 0.93 -1.00 0.00 0.00 179.01 178.47 1nj2 h GLU 386 N 0.51 0.30 -0.85 2.33 4.39 -1.94 -2.99 114.58 116.33 1nj2 h GLU 386 Ca 0.28 -0.32 -0.02 0.00 0.34 0.00 0.00 59.36 59.65 1nj2 h GLU 386 Cb 0.27 0.09 -0.04 0.00 -0.10 0.00 0.00 28.75 28.96 1nj2 h GLU 386 CO -0.23 1.01 0.46 1.15 -1.16 0.00 0.00 179.01 180.24 1nj2 h THR 387 N 0.18 1.25 -0.30 1.13 2.02 -1.45 -2.11 112.91 113.61 1nj2 h THR 387 Ca -0.06 -0.63 -0.07 0.00 0.77 0.00 0.00 66.41 66.43 1nj2 h THR 387 Cb 1.51 0.10 -0.01 0.00 -1.74 0.00 0.00 68.15 68.01 1nj2 h THR 387 CO 0.14 0.28 -0.08 -0.07 0.37 0.00 0.00 175.52 176.16 1nj2 h LEU 388 N 1.19 0.60 -0.74 2.58 3.38 -1.37 -2.01 115.31 118.94 1nj2 h LEU 388 Ca 0.30 -0.37 0.03 0.00 0.09 0.00 0.00 57.88 57.93 1nj2 h LEU 388 Cb 0.03 -0.16 -0.05 0.00 0.09 0.00 0.00 40.66 40.57 1nj2 h LEU 388 CO -0.05 0.83 0.46 0.03 0.09 0.00 0.00 178.44 179.81 1nj2 h ARG 389 N 0.36 0.87 0.03 1.13 3.08 -1.34 -1.31 114.38 117.21 1nj2 h ARG 389 Ca 0.08 -0.05 -0.00 0.00 0.07 0.00 0.00 59.98 60.07 1nj2 h ARG 389 Cb 0.57 -0.20 0.00 0.00 0.08 0.00 0.00 29.97 30.43 1nj2 h ARG 389 CO 0.03 0.58 -0.02 0.93 -1.07 0.00 0.00 179.97 180.42 1nj2 h GLU 390 N 0.90 -0.04 -0.83 0.04 4.39 -1.33 -2.34 114.58 115.37 1nj2 h GLU 390 Ca 0.30 0.00 0.15 0.00 0.34 0.00 0.00 59.36 60.15 1nj2 h GLU 390 Cb 0.03 0.01 -0.06 0.00 -0.10 0.00 0.00 28.75 28.63 1nj2 h GLU 390 CO -0.12 0.13 0.54 -0.07 -1.16 0.00 0.00 179.01 178.34 1nj2 h LEU 391 N -0.21 0.52 0.05 1.33 3.38 -1.01 -0.74 115.31 118.63 1nj2 h LEU 391 Ca -0.00 0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.00 1nj2 h LEU 391 Cb 0.19 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.87 1nj2 h LEU 391 CO 0.01 0.26 -0.02 0.24 0.09 0.00 0.00 178.44 179.01 1nj2 h MET 392 N 0.55 -0.06 -0.52 1.13 2.86 -0.93 -1.58 114.93 116.37 1nj2 h MET 392 Ca 0.41 0.00 0.10 0.00 -2.06 0.00 0.00 59.70 58.16 1nj2 h MET 392 Cb 0.81 0.01 -0.09 0.00 0.06 0.00 0.00 31.60 32.39 1nj2 h MET 392 CO -0.16 0.23 -0.01 0.87 1.06 0.00 0.00 176.91 178.89 1nj2 h LYS 393 N -0.35 0.10 0.31 1.72 1.57 -0.68 -2.55 116.57 116.69 1nj2 h LYS 393 Ca -0.01 -0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.76 1nj2 h LYS 393 Cb 0.32 -0.02 -0.03 0.00 0.08 0.00 0.00 32.23 32.57 1nj2 h LYS 393 CO 0.01 0.07 -0.49 0.22 -0.57 0.00 0.00 179.45 178.69 1nj2 h ASP 394 N 0.10 -1.40 -0.97 0.86 1.82 -1.02 -2.65 116.42 113.16 1nj2 h ASP 394 Ca 0.26 0.13 0.30 0.00 -0.39 0.00 0.00 57.03 57.34 1nj2 h ASP 394 Cb 0.41 0.49 -0.15 0.00 0.68 0.00 0.00 39.33 40.76 1nj2 h ASP 394 CO -0.45 -0.58 0.48 0.40 -1.61 0.00 0.00 179.24 177.48 1nj2 h ILE 395 N -0.84 0.29 0.61 2.25 2.04 -0.88 0.66 117.51 121.64 1nj2 h ILE 395 Ca -0.04 -0.10 -0.03 0.00 1.00 0.00 0.00 64.86 65.70 1nj2 h ILE 395 Cb 0.78 -0.02 0.01 0.00 -0.74 0.00 0.00 36.82 36.84 1nj2 h ILE 395 CO -0.16 0.05 -0.29 0.25 0.00 0.00 0.00 178.15 178.00 1nj2 h LEU 396 N 0.28 -0.69 -0.82 1.44 5.85 -1.27 -0.60 115.31 119.50 1nj2 h LEU 396 Ca 0.69 0.02 0.20 0.00 0.84 0.00 0.00 57.88 59.64 1nj2 h LEU 396 Cb 1.55 0.18 -0.14 0.00 0.37 0.00 0.00 40.66 42.62 1nj2 h LEU 396 CO -0.63 -0.35 0.06 -0.33 -0.34 0.00 0.00 178.44 176.84 1nj2 h GLU 397 N -1.11 0.11 0.45 1.25 5.08 -1.01 0.53 114.58 119.88 1nj2 h GLU 397 Ca -0.08 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.25 1nj2 h GLU 397 Cb 0.63 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.86 1nj2 h GLU 397 CO 0.14 0.07 -0.22 -0.97 -1.00 0.00 0.00 179.01 177.04 1nj2 h ASN 398 N 0.11 -0.51 -0.50 1.42 -0.73 -0.86 -1.41 115.58 113.10 1nj2 h ASN 398 Ca 0.47 0.02 0.03 0.00 1.87 0.00 0.00 56.30 58.68 1nj2 h ASN 398 Cb 0.88 0.13 -0.03 0.00 0.27 0.00 0.00 38.32 39.57 1nj2 h ASN 398 CO -0.70 -0.37 0.33 -0.07 -0.37 0.00 0.00 177.43 176.25 1nj2 h LEU 399 N -0.60 0.50 0.22 0.34 3.38 0.74 -2.41 115.31 117.48 1nj2 h LEU 399 Ca -0.06 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 1nj2 h LEU 399 Cb 0.46 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.10 1nj2 h LEU 399 CO 0.10 0.35 -0.11 -0.09 0.09 0.00 0.00 178.44 178.78 1nj2 h ARG 400 N 0.58 -0.29 0.01 1.13 2.43 0.26 -2.69 114.38 115.81 1nj2 h ARG 400 Ca 0.20 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.39 1nj2 h ARG 400 Cb 0.07 0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.68 1nj2 h ARG 400 CO -0.05 0.02 -0.07 1.15 -1.51 0.00 0.00 179.97 179.51 1nj2 h THR 401 N -0.61 0.00 -0.80 0.20 2.02 -0.95 -1.26 112.91 111.51 1nj2 h THR 401 Ca -0.03 0.00 0.22 0.00 0.77 0.00 0.00 66.41 67.37 1nj2 h THR 401 Cb 0.44 0.00 -0.15 0.00 -1.74 0.00 0.00 68.15 66.70 1nj2 h THR 401 CO 0.05 0.00 0.02 0.54 0.37 0.00 0.00 175.52 176.50 1nj2 n ARG 402 N -2.84 -0.06 -0.17 6.66 5.12 -0.94 0.45 116.66 124.88 1nj2 n ARG 402 Ca -0.01 1.20 -0.02 0.00 -1.93 0.00 0.00 57.85 57.09 1nj2 n ARG 402 Cb 0.05 -1.90 0.08 0.00 -1.16 0.00 0.00 32.46 29.53 1nj2 n ARG 402 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1nj2 h ALA 403 N 1.60 0.64 -0.11 7.54 0.00 -0.89 -1.79 119.26 126.25 1nj2 h ALA 403 Ca 0.49 0.09 -0.18 0.00 0.00 0.00 0.00 54.91 55.30 1nj2 h ALA 403 Cb 1.00 0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.88 1nj2 h ALA 403 CO -0.75 -0.25 -0.69 -1.49 0.00 0.00 0.00 179.25 176.07 1nj2 h TRP 404 N 0.32 0.64 0.11 0.00 4.06 0.50 -2.89 115.95 118.69 1nj2 h TRP 404 Ca 0.26 -0.27 0.01 0.00 2.06 0.00 0.00 58.89 60.95 1nj2 h TRP 404 Cb 0.32 -0.10 -0.02 0.00 -1.00 0.00 0.00 29.16 28.36 1nj2 h TRP 404 CO -0.19 1.03 -0.14 0.93 -3.56 0.00 0.00 178.44 176.50 1nj2 h GLU 405 N 0.34 -0.28 0.00 0.49 5.08 -0.87 0.36 114.58 119.70 1nj2 h GLU 405 Ca -0.02 0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1nj2 h GLU 405 Cb 1.26 0.06 -0.00 0.00 0.50 0.00 0.00 28.75 30.58 1nj2 h GLU 405 CO 0.12 -0.19 -0.00 0.00 -1.00 0.00 0.00 179.01 177.94 1nj2 h ARG 406 N -0.29 0.00 0.00 2.33 3.08 -1.33 -2.78 114.38 115.39 1nj2 h ARG 406 Ca 0.01 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.02 1nj2 h ARG 406 Cb 0.30 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.34 1nj2 h ARG 406 CO -0.06 0.00 -0.45 1.98 -1.07 0.00 0.00 179.97 180.37 1nj2 h MET 407 N 0.00 0.00 -1.20 0.04 4.05 -1.11 -3.37 114.93 113.34 1nj2 h MET 407 Ca -0.00 0.00 0.38 0.00 -0.28 0.00 0.00 59.70 59.80 1nj2 h MET 407 Cb 0.00 0.00 -0.12 0.00 -0.80 0.00 0.00 31.60 30.68 1nj2 h MET 407 CO 0.00 0.28 0.76 0.93 0.23 0.00 0.00 176.91 179.11 1nj2 h GLU 408 N -1.00 0.19 0.00 0.39 5.08 -0.92 0.50 114.58 118.81 1nj2 h GLU 408 Ca -0.06 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 1nj2 h GLU 408 Cb 0.56 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.76 1nj2 h GLU 408 CO -0.04 0.12 0.00 -1.13 -1.00 0.00 0.00 179.01 176.97 1nj2 n SER 409 N -4.72 0.00 -0.77 1.42 3.41 -1.05 -2.52 113.62 109.39 1nj2 n SER 409 Ca 0.33 -0.32 0.07 0.00 -0.26 0.00 0.00 58.87 58.70 1nj2 n SER 409 Cb 1.23 -0.13 0.20 0.00 -0.26 0.00 0.00 64.21 65.25 1nj2 n SER 409 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1nj2 n GLU 410 N -1.13 2.93 -3.51 4.33 -0.58 0.17 -4.84 120.64 118.02 1nj2 n GLU 410 Ca 0.12 -2.39 -0.42 0.00 -0.42 0.00 0.00 57.16 54.05 1nj2 n GLU 410 Cb 0.10 -1.51 -0.07 0.00 -0.57 0.00 0.00 31.44 29.38 1nj2 n GLU 410 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 1nj2 s ILE 411 N -1.74 4.51 0.06 -3.67 1.01 -1.05 -0.80 121.20 119.52 1nj2 s ILE 411 Ca 0.31 -2.02 0.03 0.00 0.00 0.00 0.00 60.65 58.98 1nj2 s ILE 411 Cb 0.21 -3.92 -0.04 0.00 0.01 0.00 0.00 42.46 38.73 1nj2 s ILE 411 CO 0.13 -0.84 0.04 -0.13 0.00 0.00 0.00 174.94 174.14 1nj2 s ARG 412 N 1.01 2.79 0.31 2.79 0.52 -0.76 -4.86 118.95 120.75 1nj2 s ARG 412 Ca 0.09 -0.70 -0.04 0.00 -0.52 0.00 0.00 55.73 54.56 1nj2 s ARG 412 Cb -0.23 -2.68 -0.05 0.00 0.52 0.00 0.00 34.95 32.51 1nj2 s ARG 412 CO -0.02 0.57 0.55 -1.21 0.02 0.00 0.00 175.30 175.22 1nj2 s GLU 413 N -2.18 3.59 -0.03 3.54 2.02 -1.26 0.93 118.70 125.31 1nj2 s GLU 413 Ca 0.26 -0.08 -0.11 0.00 0.02 0.00 0.00 54.97 55.07 1nj2 s GLU 413 Cb -0.12 -2.65 0.02 0.00 0.10 0.00 0.00 34.13 31.48 1nj2 s GLU 413 CO 0.18 0.19 0.24 0.00 0.02 0.00 0.00 175.26 175.90 1nj2 s ALA 414 N -2.16 -0.60 0.00 5.21 0.00 -0.62 -4.86 121.76 118.73 1nj2 s ALA 414 Ca 0.43 0.29 0.00 0.00 0.00 0.00 0.00 51.96 52.68 1nj2 s ALA 414 Cb -0.10 -0.05 0.00 0.00 0.00 0.00 0.00 23.12 22.97 1nj2 s ALA 414 CO 0.32 -0.21 0.00 0.39 0.00 0.00 0.00 175.76 176.26 1nj2 n GLU 415 N 1.77 4.27 -4.47 0.00 1.02 -1.26 -4.59 120.64 117.38 1nj2 n GLU 415 Ca -0.20 0.00 -0.23 0.00 -0.02 0.00 0.00 57.16 56.72 1nj2 n GLU 415 Cb 0.56 -0.67 -0.16 0.00 -0.02 0.00 0.00 31.44 31.15 1nj2 n GLU 415 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 1nj2 s THR 416 N -1.32 0.94 0.44 2.62 -4.23 -1.26 -4.68 115.64 108.14 1nj2 s THR 416 Ca 0.00 -0.39 0.28 0.00 -1.18 0.00 0.00 61.69 60.40 1nj2 s THR 416 Cb 0.00 -0.86 0.47 0.00 1.34 0.00 0.00 72.50 73.45 1nj2 s THR 416 CO 0.00 0.30 1.68 -0.07 -0.54 0.00 0.00 174.62 176.00 1nj2 h LEU 417 N 6.81 0.27 -0.94 4.79 4.07 -1.96 1.42 115.31 129.78 1nj2 h LEU 417 Ca -0.33 0.10 -0.02 0.00 0.08 0.00 0.00 57.88 57.71 1nj2 h LEU 417 Cb 1.17 0.07 -0.00 0.00 1.08 0.00 0.00 40.66 42.98 1nj2 h LEU 417 CO 0.48 -0.07 -0.07 -0.33 -1.08 0.00 0.00 178.44 177.36 1nj2 h GLU 418 N 0.17 0.00 0.00 1.13 5.08 -1.95 -2.51 114.58 116.50 1nj2 h GLU 418 Ca 0.73 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.94 1nj2 h GLU 418 Cb 2.26 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 31.49 1nj2 h GLU 418 CO -0.32 0.07 -0.73 1.49 -1.00 0.00 0.00 179.01 178.52 1nj2 h GLU 419 N 0.00 0.00 0.00 2.33 4.81 0.15 -3.03 114.58 118.84 1nj2 h GLU 419 Ca -0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1nj2 h GLU 419 Cb 0.73 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.11 1nj2 h GLU 419 CO 0.01 0.73 0.00 0.00 -0.73 0.00 0.00 179.01 179.02 1nj2 n ALA 420 N -2.31 -0.30 -0.29 2.92 0.00 -0.97 -2.49 120.51 117.07 1nj2 n ALA 420 Ca 0.01 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.51 1nj2 n ALA 420 Cb 0.80 0.00 0.14 0.00 0.00 0.00 0.00 19.45 20.39 1nj2 n ALA 420 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1nj2 n SER 421 N -1.85 -0.25 0.05 0.00 7.64 -1.08 0.67 113.62 118.81 1nj2 n SER 421 Ca 0.00 1.40 -0.12 0.00 1.01 0.00 0.00 58.87 61.15 1nj2 n SER 421 Cb 0.00 -0.44 -0.05 0.00 -1.01 0.00 0.00 64.21 62.71 1nj2 n SER 421 CO 0.00 0.00 0.00 -0.09 -3.01 0.00 0.00 175.04 171.94 1nj2 h ARG 422 N 0.00 -0.47 -0.41 1.43 2.43 -1.56 -0.88 114.38 114.91 1nj2 h ARG 422 Ca 0.41 0.03 -0.06 0.00 -0.81 0.00 0.00 59.98 59.56 1nj2 h ARG 422 Cb 0.69 0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 30.33 1nj2 h ARG 422 CO -0.82 -0.31 0.03 0.82 -1.51 0.00 0.00 179.97 178.17 1nj2 h ILE 423 N -0.49 1.25 -0.03 1.20 2.04 0.56 -1.70 117.51 120.34 1nj2 h ILE 423 Ca 0.06 -0.97 0.02 0.00 1.00 0.00 0.00 64.86 64.97 1nj2 h ILE 423 Cb 0.58 1.07 -0.02 0.00 -0.74 0.00 0.00 36.82 37.71 1nj2 h ILE 423 CO -0.29 0.33 -0.08 0.58 0.00 0.00 0.00 178.15 178.69 1nj2 h VAL 424 N 0.56 0.79 0.00 1.67 2.07 -0.64 0.49 116.25 121.18 1nj2 h VAL 424 Ca 0.12 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.61 1nj2 h VAL 424 Cb 0.44 0.79 -0.00 0.00 -1.52 0.00 0.00 31.29 31.00 1nj2 h VAL 424 CO 0.02 0.00 -0.13 0.44 0.02 0.00 0.00 177.57 177.91 1nj2 h ASP 425 N -0.12 0.00 0.00 0.57 3.32 -1.14 -2.35 116.42 116.69 1nj2 h ASP 425 Ca 0.04 0.00 -0.34 0.00 0.02 0.00 0.00 57.03 56.75 1nj2 h ASP 425 Cb 0.18 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 39.67 1nj2 h ASP 425 CO -0.10 0.13 -2.23 -0.62 -1.72 0.00 0.00 179.24 174.70 1nj2 n GLU 426 N -3.44 0.51 -0.24 3.56 1.02 -0.64 -4.74 120.64 116.67 1nj2 n GLU 426 Ca -0.01 0.15 0.09 0.00 -0.02 0.00 0.00 57.16 57.38 1nj2 n GLU 426 Cb 0.30 -1.38 0.19 0.00 -0.02 0.00 0.00 31.44 30.53 1nj2 n GLU 426 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1nj2 n LYS 427 N -3.43 2.04 0.00 3.49 5.02 0.17 -5.07 118.16 120.38 1nj2 n LYS 427 Ca -0.40 -2.69 0.00 0.00 -2.02 0.00 0.00 58.31 53.20 1nj2 n LYS 427 Cb 0.87 -1.65 0.00 0.00 -0.02 0.00 0.00 35.03 34.23 1nj2 n LYS 427 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1nj2 n ARG 428 N -1.00 0.00 0.00 1.97 1.74 -0.89 -4.86 116.66 113.62 1nj2 n ARG 428 Ca 0.18 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.26 1nj2 n ARG 428 Cb 0.75 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 32.19 1nj2 n ARG 428 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1nj2 n GLY 429 N 0.00 0.23 3.70 -0.13 0.00 -1.04 -4.58 105.19 103.37 1nj2 n GLY 429 Ca 0.00 -0.96 -0.33 0.00 0.00 0.00 0.00 46.02 44.73 1nj2 n GLY 429 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1nj2 s ILE 430 N 0.00 4.28 -0.17 -0.61 -1.09 0.02 -4.49 121.20 119.14 1nj2 s ILE 430 Ca 0.00 -0.55 0.01 0.00 -2.23 0.00 0.00 60.65 57.87 1nj2 s ILE 430 Cb 0.00 -2.92 0.03 0.00 -1.58 0.00 0.00 42.46 37.99 1nj2 s ILE 430 CO 0.00 0.38 -0.15 -0.63 -1.23 0.00 0.00 174.94 173.31 1nj2 s ILE 431 N -1.10 1.71 0.25 2.92 1.01 -0.41 -1.83 121.20 123.75 1nj2 s ILE 431 Ca 0.20 -0.81 -0.15 0.00 0.00 0.00 0.00 60.65 59.89 1nj2 s ILE 431 Cb -0.12 -1.63 -0.08 0.00 0.01 0.00 0.00 42.46 40.64 1nj2 s ILE 431 CO 0.11 0.40 0.67 -0.55 0.00 0.00 0.00 174.94 175.57 1nj2 s SER 432 N 1.42 6.84 0.08 3.58 0.15 0.27 -2.04 113.70 123.99 1nj2 s SER 432 Ca 0.03 1.22 -0.27 0.00 0.70 0.00 0.00 55.95 57.63 1nj2 s SER 432 Cb -0.14 -2.35 0.09 0.00 -1.71 0.00 0.00 66.02 61.91 1nj2 s SER 432 CO -0.11 -0.06 1.08 0.72 1.20 0.00 0.00 173.24 176.08 1nj2 s PHE 433 N -1.73 -0.10 -0.01 3.44 -0.12 -0.99 -1.59 117.98 116.87 1nj2 s PHE 433 Ca 0.47 -0.12 -0.03 0.00 -0.05 0.00 0.00 56.93 57.20 1nj2 s PHE 433 Cb -0.13 0.60 -0.04 0.00 -0.63 0.00 0.00 43.02 42.82 1nj2 s PHE 433 CO 0.19 -0.61 0.17 -1.64 -0.05 0.00 0.00 175.22 173.29 1nj2 s MET 434 N -2.95 3.39 -0.03 1.99 -1.94 -1.26 -1.00 119.30 117.50 1nj2 s MET 434 Ca 0.13 -0.33 -0.03 0.00 -1.71 0.00 0.00 55.69 53.74 1nj2 s MET 434 Cb 0.01 -3.07 0.01 0.00 2.01 0.00 0.00 34.83 33.78 1nj2 s MET 434 CO -0.00 0.68 0.09 -0.46 -0.01 0.00 0.00 175.02 175.31 1nj2 s TRP 435 N -1.30 -0.09 0.18 -0.03 -0.00 -0.67 -2.24 118.94 114.79 1nj2 s TRP 435 Ca 0.26 0.22 -0.12 0.00 -0.00 0.00 0.00 56.10 56.46 1nj2 s TRP 435 Cb -0.13 0.03 0.09 0.00 -0.00 0.00 0.00 33.47 33.46 1nj2 s TRP 435 CO 0.18 -0.05 1.77 0.00 -0.00 0.00 0.00 176.95 178.84 1nj2 n GLY 437 N -0.95 0.46 3.78 0.00 0.00 -1.26 -4.44 105.19 102.77 1nj2 n GLY 437 Ca 0.04 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.73 1nj2 n GLY 437 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1nj2 s GLU 438 N -0.70 2.79 0.01 1.61 0.41 -1.26 -4.93 118.70 116.62 1nj2 s GLU 438 Ca 0.00 1.31 -0.08 0.00 -0.41 0.00 0.00 54.97 55.79 1nj2 s GLU 438 Cb 0.00 -1.95 -0.05 0.00 -1.78 0.00 0.00 34.13 30.35 1nj2 s GLU 438 CO 0.00 -1.25 0.90 0.93 -0.49 0.00 0.00 175.26 175.35 1nj2 h GLU 439 N -0.13 -0.29 -0.65 1.61 5.08 -1.99 -2.58 114.58 115.63 1nj2 h GLU 439 Ca -0.46 0.02 0.06 0.00 -1.00 0.00 0.00 59.36 57.98 1nj2 h GLU 439 Cb 1.24 0.07 -0.08 0.00 0.50 0.00 0.00 28.75 30.48 1nj2 h GLU 439 CO 0.54 -0.19 -0.38 0.39 -1.00 0.00 0.00 179.01 178.36 1nj2 n GLU 440 N -2.99 -0.29 -0.28 2.33 1.02 -1.26 0.81 120.64 119.98 1nj2 n GLU 440 Ca -0.04 1.26 0.03 0.00 -0.02 0.00 0.00 57.16 58.39 1nj2 n GLU 440 Cb 0.12 -1.86 0.11 0.00 -0.02 0.00 0.00 31.44 29.79 1nj2 n GLU 440 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1nj2 h GLY 442 N 0.01 0.39 2.00 0.00 0.00 0.83 -2.47 103.07 103.83 1nj2 h GLY 442 Ca 0.39 -0.15 -0.06 0.00 0.00 0.00 0.00 47.33 47.51 1nj2 h GLY 442 CO -0.82 0.15 -0.27 -0.33 0.00 0.00 0.00 176.54 175.27 1nj2 h MET 443 N 0.37 0.00 0.00 4.80 2.07 0.75 -2.09 114.93 120.82 1nj2 h MET 443 Ca 0.10 0.00 -0.09 0.00 -2.07 0.00 0.00 59.70 57.64 1nj2 h MET 443 Cb -0.02 0.00 -0.01 0.00 -1.87 0.00 0.00 31.60 29.69 1nj2 h MET 443 CO -0.02 0.27 -0.41 -0.44 1.07 0.00 0.00 176.91 177.37 1nj2 h ASP 444 N 0.00 0.00 -0.17 1.22 3.32 -0.75 -2.34 116.42 117.69 1nj2 h ASP 444 Ca -0.00 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 1nj2 h ASP 444 Cb 0.49 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.03 1nj2 h ASP 444 CO 0.03 0.41 0.05 0.58 -1.72 0.00 0.00 179.24 178.60 1nj2 h VAL 445 N 0.00 1.20 -0.02 -1.35 2.07 -0.94 -2.46 116.25 114.74 1nj2 h VAL 445 Ca -0.00 -0.62 0.03 0.00 0.82 0.00 0.00 66.70 66.92 1nj2 h VAL 445 Cb 1.06 1.28 -0.04 0.00 -1.52 0.00 0.00 31.29 32.07 1nj2 h VAL 445 CO 0.05 0.19 -0.18 -0.33 0.02 0.00 0.00 177.57 177.33 1nj2 h GLU 446 N 0.10 -0.27 -0.19 1.57 5.08 -1.24 -1.52 114.58 118.10 1nj2 h GLU 446 Ca 0.06 0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.41 1nj2 h GLU 446 Cb 0.25 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 1nj2 h GLU 446 CO -0.00 -0.18 0.00 1.49 -1.00 0.00 0.00 179.01 179.32 1nj2 h GLU 447 N -0.28 0.27 0.21 2.33 4.81 -1.39 0.89 114.58 121.42 1nj2 h GLU 447 Ca 0.06 -0.04 -0.30 0.00 -0.13 0.00 0.00 59.36 58.96 1nj2 h GLU 447 Cb 0.36 -0.05 0.03 0.00 0.63 0.00 0.00 28.75 29.72 1nj2 h GLU 447 CO -0.18 0.29 -1.34 0.87 -0.73 0.00 0.00 179.01 177.92 1nj2 h LYS 448 N 0.27 0.44 0.00 1.92 1.57 -1.23 -3.35 116.57 116.19 1nj2 h LYS 448 Ca 0.06 -0.75 0.00 0.00 -1.87 0.00 0.00 60.65 58.09 1nj2 h LYS 448 Cb 0.18 0.28 0.00 0.00 0.08 0.00 0.00 32.23 32.77 1nj2 h LYS 448 CO 0.00 1.36 -0.83 0.28 -0.57 0.00 0.00 179.45 179.69 1nj2 n VAL 449 N -3.83 0.11 -3.24 0.50 0.31 -0.59 -5.00 118.33 106.59 1nj2 n VAL 449 Ca -0.18 -0.13 -0.10 0.00 -0.01 0.00 0.00 64.34 63.92 1nj2 n VAL 449 Cb 1.01 0.31 0.03 0.00 -0.91 0.00 0.00 33.84 34.28 1nj2 n VAL 449 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1nj2 n ARG 450 N -1.76 -1.61 -4.01 5.55 1.74 0.31 -4.95 116.66 111.92 1nj2 n ARG 450 Ca 0.03 1.14 -0.11 0.00 -0.77 0.00 0.00 57.85 58.15 1nj2 n ARG 450 Cb 0.39 -5.35 -0.04 0.00 -1.02 0.00 0.00 32.46 26.44 1nj2 n ARG 450 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1nj2 s VAL 451 N -3.16 0.00 0.01 1.55 1.01 -1.04 -4.94 120.40 113.83 1nj2 s VAL 451 Ca 0.19 -1.44 0.08 0.00 0.00 0.00 0.00 61.98 60.81 1nj2 s VAL 451 Cb -0.04 -2.42 -0.02 0.00 0.00 0.00 0.00 36.38 33.90 1nj2 s VAL 451 CO 0.77 0.00 -0.24 -0.62 0.00 0.00 0.00 175.10 175.01 1nj2 s ASP 452 N -3.10 2.90 -0.42 3.32 -1.08 -1.16 -4.54 116.67 112.60 1nj2 s ASP 452 Ca 0.25 -0.51 -0.23 0.00 -0.52 0.00 0.00 52.55 51.54 1nj2 s ASP 452 Cb -0.01 -0.29 0.02 0.00 -1.46 0.00 0.00 42.92 41.18 1nj2 s ASP 452 CO 0.13 0.26 0.79 -0.63 0.52 0.00 0.00 175.17 176.24 1nj2 s ILE 453 N -0.69 4.67 0.07 4.11 1.01 -1.26 -3.22 121.20 125.88 1nj2 s ILE 453 Ca 0.10 0.57 -0.35 0.00 0.00 0.00 0.00 60.65 60.97 1nj2 s ILE 453 Cb -0.09 -4.29 -0.18 0.00 0.01 0.00 0.00 42.46 37.90 1nj2 s ILE 453 CO 0.01 -0.63 1.53 -0.07 0.00 0.00 0.00 174.94 175.78 1nj2 h LEU 454 N 10.03 -1.22 0.00 2.97 3.38 -1.65 -3.42 115.31 125.39 1nj2 h LEU 454 Ca -0.25 0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.79 1nj2 h LEU 454 Cb 1.09 0.36 0.00 0.00 0.09 0.00 0.00 40.66 42.20 1nj2 h LEU 454 CO 0.95 -0.71 0.00 0.61 0.09 0.00 0.00 178.44 179.37 1nj2 n GLY 455 N -1.59 1.46 3.94 0.83 0.00 -1.26 -3.84 105.19 104.74 1nj2 n GLY 455 Ca -0.14 -0.90 -0.27 0.00 0.00 0.00 0.00 46.02 44.71 1nj2 n GLY 455 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1nj2 s ILE 456 N -2.00 2.09 -0.47 -0.61 -4.36 -1.10 -3.46 121.20 111.29 1nj2 s ILE 456 Ca 0.00 -0.21 0.05 0.00 -0.26 0.00 0.00 60.65 60.23 1nj2 s ILE 456 Cb 0.00 -2.88 0.19 0.00 1.25 0.00 0.00 42.46 41.02 1nj2 s ILE 456 CO 0.00 0.00 0.76 -1.58 0.24 0.00 0.00 174.94 174.36 1nj2 s GLN 457 N -5.55 0.90 -0.36 0.37 0.74 -0.29 -2.66 119.66 112.81 1nj2 s GLN 457 Ca 0.68 -0.78 -0.33 0.00 0.05 0.00 0.00 55.36 54.98 1nj2 s GLN 457 Cb -0.06 -0.01 -0.14 0.00 1.10 0.00 0.00 33.01 33.90 1nj2 s GLN 457 CO 0.49 -1.15 1.32 0.39 -0.55 0.00 0.00 175.29 175.79 1nj2 n GLU 458 N 3.21 0.00 -3.79 1.67 1.02 -1.26 -3.35 120.64 118.14 1nj2 n GLU 458 Ca 0.15 0.00 -0.08 0.00 -0.02 0.00 0.00 57.16 57.22 1nj2 n GLU 458 Cb 0.57 -1.08 -0.02 0.00 -0.02 0.00 0.00 31.44 30.90 1nj2 n GLU 458 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 1nj2 s GLU 459 N 3.08 1.68 0.44 3.49 2.12 -1.25 -4.93 118.70 123.34 1nj2 s GLU 459 Ca 0.80 -0.92 -0.10 0.00 0.36 0.00 0.00 54.97 55.11 1nj2 s GLU 459 Cb -1.08 0.60 -0.09 0.00 0.26 0.00 0.00 34.13 33.82 1nj2 s GLU 459 CO 0.54 -0.76 -0.26 0.41 -0.54 0.00 0.00 175.26 174.64 1nj2 n GLY 460 N -0.44 -2.32 0.32 -1.50 0.00 -1.26 -4.33 105.19 95.66 1nj2 n GLY 460 Ca -0.06 -0.28 -0.03 0.00 0.00 0.00 0.00 46.02 45.65 1nj2 n GLY 460 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1nj2 n SER 461 N 1.76 -0.92 0.00 1.61 7.64 -1.26 -4.61 113.62 117.85 1nj2 n SER 461 Ca 0.02 -0.64 0.00 0.00 1.01 0.00 0.00 58.87 59.26 1nj2 n SER 461 Cb 0.30 -0.09 0.00 0.00 -1.01 0.00 0.00 64.21 63.41 1nj2 n SER 461 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1nj2 n GLY 462 N 2.23 -0.51 3.10 0.23 0.00 -0.82 -4.96 105.19 104.45 1nj2 n GLY 462 Ca 0.01 -0.86 -0.25 0.00 0.00 0.00 0.00 46.02 44.92 1nj2 n GLY 462 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1nj2 s THR 463 N -3.59 1.27 0.17 2.61 -4.23 -1.26 -0.80 115.64 109.81 1nj2 s THR 463 Ca 0.00 -0.63 -0.34 0.00 -1.18 0.00 0.00 61.69 59.55 1nj2 s THR 463 Cb 0.00 -1.10 -0.14 0.00 1.34 0.00 0.00 72.50 72.60 1nj2 s THR 463 CO 0.00 0.37 1.49 0.00 -0.54 0.00 0.00 174.62 175.95 1nj2 n ILE 465 N 2.88 1.23 0.01 0.00 3.06 -0.95 -2.15 119.36 123.45 1nj2 n ILE 465 Ca 0.16 0.66 -0.01 0.00 -2.50 0.00 0.00 62.75 61.06 1nj2 n ILE 465 Cb 0.28 -1.66 -0.00 0.00 0.54 0.00 0.00 39.64 38.80 1nj2 n ILE 465 CO 0.00 0.00 0.00 -3.20 -2.50 0.00 0.00 176.55 170.85 1nj2 n ASN 466 N -1.94 0.54 -0.18 9.51 4.05 -1.26 -3.81 115.26 122.16 1nj2 n ASN 466 Ca -0.01 0.07 0.15 0.00 0.45 0.00 0.00 54.58 55.24 1nj2 n ASN 466 Cb 0.09 -0.21 0.71 0.00 1.23 0.00 0.00 39.78 41.59 1nj2 n ASN 466 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1nj2 n GLY 468 N 1.15 1.67 1.16 0.00 0.00 -0.91 -4.95 105.19 103.30 1nj2 n GLY 468 Ca 0.19 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.15 1nj2 n GLY 468 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nj2 n ARG 469 N 0.00 -0.70 -2.22 1.61 1.74 -1.26 -3.83 116.66 112.00 1nj2 n ARG 469 Ca 0.00 -0.30 -0.42 0.00 -0.77 0.00 0.00 57.85 56.36 1nj2 n ARG 469 Cb 0.00 -0.58 -0.03 0.00 -1.02 0.00 0.00 32.46 30.83 1nj2 n ARG 469 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 1nj2 s GLU 470 N -2.37 4.33 -0.37 5.56 2.12 -1.26 -1.49 118.70 125.23 1nj2 s GLU 470 Ca 0.14 2.00 -0.06 0.00 0.36 0.00 0.00 54.97 57.41 1nj2 s GLU 470 Cb -0.02 -3.32 0.06 0.00 0.26 0.00 0.00 34.13 31.10 1nj2 s GLU 470 CO 0.12 -0.43 0.15 0.00 -0.54 0.00 0.00 175.26 174.55 1nj2 s ALA 471 N 1.33 3.10 -2.28 6.30 0.00 0.02 -4.41 121.76 125.82 1nj2 s ALA 471 Ca 0.63 -1.99 0.20 0.00 0.00 0.00 0.00 51.96 50.81 1nj2 s ALA 471 Cb -0.35 -2.35 0.63 0.00 0.00 0.00 0.00 23.12 21.05 1nj2 s ALA 471 CO 0.29 -1.49 1.48 -2.30 0.00 0.00 0.00 175.76 173.75 1nj2 n PRO 472 N 4.78 1.90 -4.11 0.00 -0.02 -1.24 -1.95 135.00 134.37 1nj2 n PRO 472 Ca -0.10 -1.37 -0.14 0.00 -2.02 0.00 0.00 63.50 59.87 1nj2 n PRO 472 Cb 0.43 -1.40 -0.12 0.00 -0.02 0.00 0.00 33.50 32.39 1nj2 n PRO 472 CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 1nj2 s TYR 473 N -1.69 0.70 -0.18 6.00 1.51 -1.21 -3.87 117.35 118.62 1nj2 s TYR 473 Ca 0.33 -0.41 -0.17 0.00 -1.01 0.00 0.00 57.07 55.81 1nj2 s TYR 473 Cb 0.18 -0.42 -0.04 0.00 -0.11 0.00 0.00 41.96 41.57 1nj2 s TYR 473 CO 0.26 -0.05 0.43 0.50 -1.11 0.00 0.00 175.55 175.58 1nj2 s ARG 474 N -1.27 4.23 0.35 -0.62 6.06 -1.21 -1.67 118.95 124.81 1nj2 s ARG 474 Ca -0.06 0.30 0.05 0.00 -2.50 0.00 0.00 55.73 53.51 1nj2 s ARG 474 Cb -0.08 -3.50 -0.07 0.00 0.06 0.00 0.00 34.95 31.36 1nj2 s ARG 474 CO 0.00 0.02 0.05 0.00 -2.50 0.00 0.00 175.30 172.87 1nj2 s ALA 475 N 1.11 2.58 0.06 6.12 0.00 -0.17 -1.14 121.76 130.33 1nj2 s ALA 475 Ca 0.22 -2.11 0.02 0.00 0.00 0.00 0.00 51.96 50.09 1nj2 s ALA 475 Cb -0.15 0.54 -0.03 0.00 0.00 0.00 0.00 23.12 23.48 1nj2 s ALA 475 CO 0.08 -0.26 -0.07 0.71 0.00 0.00 0.00 175.76 176.22 1nj2 s TYR 476 N -3.14 0.75 0.07 0.00 1.51 -1.22 -2.36 117.35 112.95 1nj2 s TYR 476 Ca 0.36 -0.67 0.01 0.00 -1.01 0.00 0.00 57.07 55.75 1nj2 s TYR 476 Cb 0.09 -0.44 -0.04 0.00 -0.11 0.00 0.00 41.96 41.46 1nj2 s TYR 476 CO 0.16 -0.12 -0.05 -0.51 -1.11 0.00 0.00 175.55 173.92 1nj2 s LEU 477 N -2.17 2.44 0.00 -1.29 1.43 -0.87 -1.55 118.68 116.67 1nj2 s LEU 477 Ca -0.01 -0.88 0.00 0.00 -1.03 0.00 0.00 54.13 52.21 1nj2 s LEU 477 Cb -0.04 0.01 0.00 0.00 0.03 0.00 0.00 46.19 46.19 1nj2 s LEU 477 CO -0.02 -0.45 0.00 0.00 0.23 0.00 0.00 176.35 176.12 1nj2 n ALA 478 N 0.41 0.00 -2.69 4.21 0.00 -1.20 -1.29 120.51 119.96 1nj2 n ALA 478 Ca -0.16 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 52.91 1nj2 n ALA 478 Cb 0.59 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.97 1nj2 n ALA 478 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1nj2 s ARG 479 N -2.00 4.20 0.31 0.00 1.81 -1.26 -2.96 118.95 119.04 1nj2 s ARG 479 Ca 0.00 0.07 0.10 0.00 -1.72 0.00 0.00 55.73 54.19 1nj2 s ARG 479 Cb 0.00 -3.49 -0.05 0.00 -0.45 0.00 0.00 34.95 30.96 1nj2 s ARG 479 CO 0.00 0.10 -0.11 0.95 -0.68 0.00 0.00 175.30 175.56 1nj2 s THR 480 N 0.89 2.53 -2.03 0.02 -4.23 -1.26 -1.17 115.64 110.38 1nj2 s THR 480 Ca 0.16 -2.22 0.32 0.00 -1.18 0.00 0.00 61.69 58.77 1nj2 s THR 480 Cb -0.14 -2.55 0.89 0.00 1.34 0.00 0.00 72.50 72.04 1nj2 s THR 480 CO 0.05 -0.30 2.20 -1.22 -0.54 0.00 0.00 174.62 174.82