#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nj6 h PHE 20 N 0.00 0.09 -0.52 -1.84 3.57 -1.99 -2.26 116.94 113.99 1nj6 h PHE 20 Ca 0.00 -0.01 0.09 0.00 3.53 0.00 0.00 57.97 61.59 1nj6 h PHE 20 Cb 0.00 -0.03 -0.10 0.00 2.79 0.00 0.00 35.95 38.61 1nj6 h PHE 20 CO 0.00 0.22 -0.35 0.77 -2.23 0.00 0.00 178.31 176.72 1nj6 h SER 21 N -0.06 -1.18 -0.80 0.41 0.02 -1.99 0.29 113.55 110.25 1nj6 h SER 21 Ca 0.02 0.22 0.01 0.00 -0.84 0.00 0.00 61.79 61.20 1nj6 h SER 21 Cb 0.16 0.56 -0.04 0.00 0.14 0.00 0.00 62.40 63.23 1nj6 h SER 21 CO -0.00 -0.32 0.52 -0.08 -1.14 0.00 0.00 176.83 175.82 1nj6 h GLU 22 N -0.21 1.03 0.25 3.45 4.81 -1.98 -0.70 114.58 121.24 1nj6 h GLU 22 Ca 0.20 -0.06 0.01 0.00 -0.13 0.00 0.00 59.36 59.38 1nj6 h GLU 22 Cb 0.55 -0.23 -0.02 0.00 0.63 0.00 0.00 28.75 29.67 1nj6 h GLU 22 CO -0.63 0.68 -0.29 2.35 -0.73 0.00 0.00 179.01 180.39 1nj6 h TRP 23 N 1.06 -0.78 0.01 0.92 7.01 -0.31 -0.44 115.95 123.42 1nj6 h TRP 23 Ca 0.30 0.01 0.01 0.00 2.11 0.00 0.00 58.89 61.31 1nj6 h TRP 23 Cb -0.10 0.31 -0.02 0.00 -2.10 0.00 0.00 29.16 27.25 1nj6 h TRP 23 CO -0.02 -0.42 -0.20 0.35 -2.79 0.00 0.00 178.44 175.36 1nj6 h PHE 24 N -0.59 -0.60 -1.06 2.65 3.57 -0.14 0.66 116.94 121.43 1nj6 h PHE 24 Ca -0.00 0.02 0.28 0.00 3.53 0.00 0.00 57.97 61.80 1nj6 h PHE 24 Cb 0.56 0.26 -0.11 0.00 2.79 0.00 0.00 35.95 39.45 1nj6 h PHE 24 CO -0.20 -0.22 0.67 0.45 -2.23 0.00 0.00 178.31 176.77 1nj6 h HIS 25 N -0.26 0.74 0.02 0.41 3.86 -1.05 -0.19 115.15 118.67 1nj6 h HIS 25 Ca 0.00 0.03 -0.26 0.00 -1.16 0.00 0.00 60.37 58.98 1nj6 h HIS 25 Cb 0.28 -0.21 0.02 0.00 1.06 0.00 0.00 27.41 28.56 1nj6 h HIS 25 CO -0.41 0.02 -1.05 -0.91 0.86 0.00 0.00 177.93 176.44 1nj6 h ASN 26 N 0.40 0.82 0.19 2.45 2.35 -0.45 -3.06 115.58 118.27 1nj6 h ASN 26 Ca 0.64 -0.67 -0.11 0.00 -0.55 0.00 0.00 56.30 55.61 1nj6 h ASN 26 Cb 1.57 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 39.67 1nj6 h ASN 26 CO -0.37 1.47 -0.41 -0.29 -1.65 0.00 0.00 177.43 176.19 1nj6 h ILE 27 N 0.34 1.31 -0.70 2.81 6.09 0.74 0.16 117.51 128.25 1nj6 h ILE 27 Ca -0.13 -1.52 -0.01 0.00 -1.37 0.00 0.00 64.86 61.83 1nj6 h ILE 27 Cb 1.71 1.66 -0.03 0.00 0.47 0.00 0.00 36.82 40.62 1nj6 h ILE 27 CO 0.20 0.46 0.38 -0.07 -3.07 0.00 0.00 178.15 176.05 1nj6 h LEU 28 N 0.24 0.86 0.00 2.19 3.38 -1.13 -0.05 115.31 120.82 1nj6 h LEU 28 Ca 0.02 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 57.92 1nj6 h LEU 28 Cb 0.82 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.36 1nj6 h LEU 28 CO 0.07 0.70 -0.00 -0.08 0.09 0.00 0.00 178.44 179.21 1nj6 h GLU 29 N 0.98 -0.00 -0.67 1.13 4.81 -1.34 0.11 114.58 119.59 1nj6 h GLU 29 Ca 0.25 0.00 0.04 0.00 -0.13 0.00 0.00 59.36 59.52 1nj6 h GLU 29 Cb 0.03 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 29.36 1nj6 h GLU 29 CO -0.04 0.79 0.40 1.49 -0.73 0.00 0.00 179.01 180.91 1nj6 h GLU 30 N -0.99 0.73 -0.00 1.92 4.81 -0.65 -0.45 114.58 119.94 1nj6 h GLU 30 Ca -0.00 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.19 1nj6 h GLU 30 Cb 0.79 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 30.01 1nj6 h GLU 30 CO 0.00 0.48 -0.01 0.00 -0.73 0.00 0.00 179.01 178.76 1nj6 n ALA 31 N -2.33 2.64 -3.57 2.92 0.00 -0.04 -4.93 120.51 115.21 1nj6 n ALA 31 Ca 0.08 -0.21 -0.22 0.00 0.00 0.00 0.00 53.44 53.08 1nj6 n ALA 31 Cb 0.13 -1.48 0.05 0.00 0.00 0.00 0.00 19.45 18.15 1nj6 n ALA 31 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1nj6 n GLU 32 N -0.98 -3.31 -0.09 0.00 1.02 -0.18 -4.64 120.64 112.47 1nj6 n GLU 32 Ca 0.21 0.64 -0.14 0.00 -0.02 0.00 0.00 57.16 57.85 1nj6 n GLU 32 Cb 0.16 -5.07 -0.08 0.00 -0.02 0.00 0.00 31.44 26.43 1nj6 n GLU 32 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 1nj6 h ILE 33 N -1.69 0.68 -3.69 -3.67 2.04 -1.03 -2.79 117.51 107.36 1nj6 h ILE 33 Ca -0.63 -1.76 -0.14 0.00 1.00 0.00 0.00 64.86 63.33 1nj6 h ILE 33 Cb 1.35 1.53 -0.20 0.00 -0.74 0.00 0.00 36.82 38.76 1nj6 h ILE 33 CO 0.51 0.23 -0.54 0.27 0.00 0.00 0.00 178.15 178.62 1nj6 s ILE 34 N -2.24 0.11 -0.19 -0.67 -4.36 -1.22 -2.01 121.20 110.61 1nj6 s ILE 34 Ca -0.21 -0.87 -0.04 0.00 -0.26 0.00 0.00 60.65 59.26 1nj6 s ILE 34 Cb 0.03 -0.57 -0.02 0.00 1.25 0.00 0.00 42.46 43.15 1nj6 s ILE 34 CO 0.45 -0.48 -0.02 -0.62 0.24 0.00 0.00 174.94 174.51 1nj6 s ASP 35 N -1.66 4.73 0.00 4.36 -1.08 -0.51 -4.50 116.67 118.00 1nj6 s ASP 35 Ca -0.12 -0.22 0.25 0.00 -0.52 0.00 0.00 52.55 51.95 1nj6 s ASP 35 Cb -0.06 -1.80 0.54 0.00 -1.46 0.00 0.00 42.92 40.14 1nj6 s ASP 35 CO -0.01 0.07 1.44 0.00 0.52 0.00 0.00 175.17 177.19 1nj6 n GLN 36 N 4.17 1.41 -0.45 4.34 6.02 -1.26 -2.38 117.38 129.23 1nj6 n GLN 36 Ca -0.17 -1.00 -0.02 0.00 -0.01 0.00 0.00 57.00 55.79 1nj6 n GLN 36 Cb 0.52 -1.48 -0.03 0.00 1.02 0.00 0.00 30.24 30.27 1nj6 n GLN 36 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1nj6 n ARG 37 N 0.08 0.90 -3.63 -1.09 1.74 -1.26 -4.87 116.66 108.54 1nj6 n ARG 37 Ca 0.13 -0.17 -0.36 0.00 -0.77 0.00 0.00 57.85 56.68 1nj6 n ARG 37 Cb 0.43 -1.31 -0.07 0.00 -1.02 0.00 0.00 32.46 30.49 1nj6 n ARG 37 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 1nj6 s TYR 38 N 0.77 3.49 -0.29 -1.55 5.04 -1.26 -4.96 117.35 118.59 1nj6 s TYR 38 Ca 0.11 0.55 0.00 0.00 -2.44 0.00 0.00 57.07 55.30 1nj6 s TYR 38 Cb 0.05 -2.24 0.01 0.00 0.35 0.00 0.00 41.96 40.14 1nj6 s TYR 38 CO 0.00 0.35 0.66 -0.35 -1.34 0.00 0.00 175.55 174.87 1nj6 n PRO 39 N 3.21 0.00 -4.02 4.97 -0.04 -1.26 -4.17 135.00 133.69 1nj6 n PRO 39 Ca -0.14 0.16 -0.31 0.00 -0.04 0.00 0.00 63.50 63.17 1nj6 n PRO 39 Cb 0.52 -1.86 -0.16 0.00 -0.04 0.00 0.00 33.50 31.97 1nj6 n PRO 39 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1nj6 s VAL 40 N -2.33 1.82 0.28 0.52 1.01 -1.26 -5.10 120.40 115.34 1nj6 s VAL 40 Ca -0.00 -1.24 -0.30 0.00 0.00 0.00 0.00 61.98 60.44 1nj6 s VAL 40 Cb 0.00 -1.92 -0.12 0.00 0.00 0.00 0.00 36.38 34.34 1nj6 s VAL 40 CO 0.00 0.09 1.48 1.17 0.00 0.00 0.00 175.10 177.84 1nj6 n LYS 41 N 4.60 2.36 -0.52 2.72 4.81 -1.26 -2.75 118.16 128.11 1nj6 n LYS 41 Ca -0.15 0.84 0.00 0.00 -0.87 0.00 0.00 58.31 58.13 1nj6 n LYS 41 Cb 0.45 -2.55 0.00 0.00 0.02 0.00 0.00 35.03 32.95 1nj6 n LYS 41 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1nj6 n GLY 42 N 1.99 0.71 2.62 3.14 0.00 -1.26 -4.76 105.19 107.63 1nj6 n GLY 42 Ca 0.09 -0.25 -0.25 0.00 0.00 0.00 0.00 46.02 45.61 1nj6 n GLY 42 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1nj6 s MET 43 N -0.73 0.05 0.36 1.61 -1.94 -1.11 0.31 119.30 117.86 1nj6 s MET 43 Ca 0.00 -0.02 0.08 0.00 -1.71 0.00 0.00 55.69 54.04 1nj6 s MET 43 Cb 0.00 -1.67 -0.04 0.00 2.01 0.00 0.00 34.83 35.12 1nj6 s MET 43 CO 0.00 -0.64 0.16 -1.01 -0.01 0.00 0.00 175.02 173.53 1nj6 s HIS 44 N 2.15 2.68 -0.13 -0.03 3.76 -1.26 -4.58 115.29 117.87 1nj6 s HIS 44 Ca 0.02 -0.44 -0.05 0.00 -0.15 0.00 0.00 55.06 54.45 1nj6 s HIS 44 Cb -0.16 -1.74 -0.04 0.00 1.11 0.00 0.00 32.58 31.75 1nj6 s HIS 44 CO -0.09 0.28 0.05 0.08 -0.85 0.00 0.00 174.74 174.21 1nj6 s VAL 45 N -2.47 4.67 -0.36 -0.90 1.01 -1.00 -4.97 120.40 116.38 1nj6 s VAL 45 Ca 0.39 -0.09 -0.21 0.00 0.00 0.00 0.00 61.98 62.06 1nj6 s VAL 45 Cb -0.01 -3.04 0.01 0.00 0.00 0.00 0.00 36.38 33.34 1nj6 s VAL 45 CO 0.23 0.54 0.69 0.26 0.00 0.00 0.00 175.10 176.82 1nj6 s TRP 46 N -0.33 3.13 0.70 5.22 0.52 -1.26 -1.43 118.94 125.49 1nj6 s TRP 46 Ca 0.08 0.40 -0.11 0.00 0.02 0.00 0.00 56.10 56.49 1nj6 s TRP 46 Cb -0.12 -3.24 0.02 0.00 -1.15 0.00 0.00 33.47 28.97 1nj6 s TRP 46 CO 0.02 -0.68 1.08 -1.64 0.02 0.00 0.00 176.95 175.74 1nj6 s MET 47 N 2.85 2.82 0.15 4.98 -1.94 -0.85 -4.71 119.30 122.60 1nj6 s MET 47 Ca 0.27 0.38 -0.28 0.00 -1.71 0.00 0.00 55.69 54.34 1nj6 s MET 47 Cb -0.14 -2.05 -0.06 0.00 2.01 0.00 0.00 34.83 34.59 1nj6 s MET 47 CO 0.16 -1.02 1.41 -2.30 -0.01 0.00 0.00 175.02 173.26 1nj6 n PRO 48 N -2.97 -0.40 0.19 2.03 -0.02 -1.26 -0.67 135.00 131.90 1nj6 n PRO 48 Ca 0.07 1.38 -0.14 0.00 -2.02 0.00 0.00 63.50 62.79 1nj6 n PRO 48 Cb 0.57 -2.04 -0.07 0.00 -0.02 0.00 0.00 33.50 31.95 1nj6 n PRO 48 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1nj6 h HIS 49 N 0.00 -0.71 -0.43 6.00 -0.00 -1.87 -1.50 115.15 116.63 1nj6 h HIS 49 Ca 0.15 0.00 0.09 0.00 -0.00 0.00 0.00 60.37 60.61 1nj6 h HIS 49 Cb 0.38 0.27 -0.09 0.00 -0.00 0.00 0.00 27.41 27.97 1nj6 h HIS 49 CO -0.94 -0.39 -0.17 0.78 -0.00 0.00 0.00 177.93 177.21 1nj6 h GLY 50 N -0.58 0.19 0.21 5.26 0.00 -1.11 -0.25 103.07 106.79 1nj6 h GLY 50 Ca -0.01 0.22 0.19 0.00 0.00 0.00 0.00 47.33 47.72 1nj6 h GLY 50 CO -0.05 -0.19 0.61 -2.75 0.00 0.00 0.00 176.54 174.16 1nj6 h PHE 51 N -0.08 0.92 -0.46 5.60 3.57 -0.35 0.02 116.94 126.17 1nj6 h PHE 51 Ca 0.21 0.03 -0.07 0.00 3.53 0.00 0.00 57.97 61.67 1nj6 h PHE 51 Cb 0.40 -0.28 -0.02 0.00 2.79 0.00 0.00 35.95 38.84 1nj6 h PHE 51 CO -0.43 0.23 -0.00 0.52 -2.23 0.00 0.00 178.31 176.40 1nj6 h MET 52 N 0.68 0.76 -0.37 1.11 2.86 -0.03 0.85 114.93 120.81 1nj6 h MET 52 Ca 0.54 -0.20 -0.11 0.00 -2.06 0.00 0.00 59.70 57.87 1nj6 h MET 52 Cb 0.94 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 32.50 1nj6 h MET 52 CO -0.31 0.77 -0.20 0.82 1.06 0.00 0.00 176.91 179.06 1nj6 h ILE 53 N 0.71 1.28 -0.85 -1.22 2.04 -0.68 -1.20 117.51 117.60 1nj6 h ILE 53 Ca 0.14 -1.33 -0.03 0.00 1.00 0.00 0.00 64.86 64.64 1nj6 h ILE 53 Cb 0.44 1.36 -0.04 0.00 -0.74 0.00 0.00 36.82 37.83 1nj6 h ILE 53 CO 0.02 0.44 0.41 -0.09 0.00 0.00 0.00 178.15 178.93 1nj6 h ARG 54 N 0.57 1.22 0.30 2.37 2.43 -0.95 0.39 114.38 120.71 1nj6 h ARG 54 Ca 0.08 -0.18 -0.01 0.00 -0.81 0.00 0.00 59.98 59.06 1nj6 h ARG 54 Cb 0.75 -0.22 0.00 0.00 -0.42 0.00 0.00 29.97 30.08 1nj6 h ARG 54 CO 0.06 0.93 -0.15 -0.22 -1.51 0.00 0.00 179.97 179.08 1nj6 h LYS 55 N 1.20 -0.39 -0.30 0.20 3.64 -0.61 -1.48 116.57 118.84 1nj6 h LYS 55 Ca 0.29 0.03 -0.08 0.00 -1.27 0.00 0.00 60.65 59.62 1nj6 h LYS 55 Cb 0.11 0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.01 1nj6 h LYS 55 CO -0.04 -0.23 -0.16 -0.91 -2.27 0.00 0.00 179.45 175.85 1nj6 h ASN 56 N -0.46 0.52 -0.76 4.20 2.35 -0.93 -1.65 115.58 118.85 1nj6 h ASN 56 Ca -0.04 -0.15 -0.04 0.00 -0.55 0.00 0.00 56.30 55.52 1nj6 h ASN 56 Cb 0.35 -0.14 -0.03 0.00 0.05 0.00 0.00 38.32 38.55 1nj6 h ASN 56 CO 0.07 0.69 0.31 0.74 -1.65 0.00 0.00 177.43 177.60 1nj6 h THR 57 N 0.48 1.25 -0.04 2.81 2.02 -0.78 -2.48 112.91 116.18 1nj6 h THR 57 Ca 0.08 -0.79 -0.13 0.00 0.77 0.00 0.00 66.41 66.35 1nj6 h THR 57 Cb 0.55 0.33 -0.01 0.00 -1.74 0.00 0.00 68.15 67.27 1nj6 h THR 57 CO 0.04 0.32 -0.56 -0.07 0.37 0.00 0.00 175.52 175.62 1nj6 h LEU 58 N 1.11 0.12 -0.30 2.58 3.38 -0.77 -2.50 115.31 118.94 1nj6 h LEU 58 Ca 0.26 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.15 1nj6 h LEU 58 Cb 0.20 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 1nj6 h LEU 58 CO -0.02 0.66 0.16 0.11 0.09 0.00 0.00 178.44 179.43 1nj6 h LYS 59 N 0.09 0.42 -0.24 1.13 1.57 -0.88 0.20 116.57 118.86 1nj6 h LYS 59 Ca -0.00 -0.05 0.04 0.00 -1.87 0.00 0.00 60.65 58.76 1nj6 h LYS 59 Cb 1.02 -0.08 -0.04 0.00 0.08 0.00 0.00 32.23 33.21 1nj6 h LYS 59 CO 0.08 0.37 0.00 0.82 -0.57 0.00 0.00 179.45 180.15 1nj6 h ILE 60 N 0.36 0.83 -0.05 1.86 2.04 -1.38 -0.03 117.51 121.14 1nj6 h ILE 60 Ca 0.10 -0.03 -0.00 0.00 1.00 0.00 0.00 64.86 65.94 1nj6 h ILE 60 Cb 0.08 0.74 -0.00 0.00 -0.74 0.00 0.00 36.82 36.90 1nj6 h ILE 60 CO -0.02 0.01 0.03 0.25 0.00 0.00 0.00 178.15 178.43 1nj6 h LEU 61 N 0.08 0.06 -1.13 1.44 5.85 -1.03 -2.92 115.31 117.65 1nj6 h LEU 61 Ca 0.12 -0.05 -0.05 0.00 0.84 0.00 0.00 57.88 58.73 1nj6 h LEU 61 Cb 0.15 -0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.14 1nj6 h LEU 61 CO -0.19 0.09 0.04 0.03 -0.34 0.00 0.00 178.44 178.08 1nj6 h ARG 62 N 0.01 0.65 -0.94 1.25 3.08 -0.36 -1.10 114.38 116.98 1nj6 h ARG 62 Ca 0.02 -0.14 0.10 0.00 0.07 0.00 0.00 59.98 60.03 1nj6 h ARG 62 Cb 0.05 -0.09 -0.07 0.00 0.08 0.00 0.00 29.97 29.93 1nj6 h ARG 62 CO -0.00 0.64 0.60 -0.09 -1.07 0.00 0.00 179.97 180.05 1nj6 h ARG 63 N 0.63 0.91 0.21 0.04 2.43 -0.81 0.25 114.38 118.04 1nj6 h ARG 63 Ca 0.13 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.24 1nj6 h ARG 63 Cb 0.33 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 29.67 1nj6 h ARG 63 CO 0.01 0.60 -0.10 0.82 -1.51 0.00 0.00 179.97 179.78 1nj6 h ILE 64 N 0.93 0.23 -0.82 1.20 2.04 -1.25 -3.35 117.51 116.50 1nj6 h ILE 64 Ca 0.44 -0.90 0.16 0.00 1.00 0.00 0.00 64.86 65.56 1nj6 h ILE 64 Cb 0.43 0.40 -0.06 0.00 -0.74 0.00 0.00 36.82 36.85 1nj6 h ILE 64 CO -0.20 0.07 0.54 -0.07 0.00 0.00 0.00 178.15 178.48 1nj6 h LEU 65 N -1.04 0.43 0.00 1.44 3.38 -0.96 -2.10 115.31 116.46 1nj6 h LEU 65 Ca -0.03 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1nj6 h LEU 65 Cb 0.33 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.02 1nj6 h LEU 65 CO 0.05 0.21 0.00 0.47 0.09 0.00 0.00 178.44 179.26 1nj6 n ASP 66 N -4.50 0.00 -0.16 -0.43 8.00 0.87 -1.02 116.55 119.31 1nj6 n ASP 66 Ca 0.16 0.08 -0.10 0.00 0.71 0.00 0.00 54.79 55.64 1nj6 n ASP 66 Cb 0.57 -0.30 -0.00 0.00 -0.02 0.00 0.00 41.12 41.36 1nj6 n ASP 66 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 1nj6 h ARG 67 N 0.00 0.81 0.00 -1.24 3.08 -1.53 -3.37 114.38 112.13 1nj6 h ARG 67 Ca 0.00 -0.25 0.00 0.00 0.07 0.00 0.00 59.98 59.80 1nj6 h ARG 67 Cb 0.16 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.14 1nj6 h ARG 67 CO 0.00 0.86 -0.00 -0.25 -1.07 0.00 0.00 179.97 179.51 1nj6 n ASP 68 N -4.38 0.47 -4.43 7.04 8.00 -1.16 -5.07 116.55 117.02 1nj6 n ASP 68 Ca 0.00 -1.24 -0.28 0.00 0.71 0.00 0.00 54.79 53.98 1nj6 n ASP 68 Cb 0.30 -0.00 -0.12 0.00 -0.02 0.00 0.00 41.12 41.28 1nj6 n ASP 68 CO 0.00 0.00 0.00 -1.00 -0.39 0.00 0.00 177.20 175.81 1nj6 s HIS 69 N -0.24 2.36 -0.26 1.24 3.76 -0.19 -4.67 115.29 117.30 1nj6 s HIS 69 Ca 0.00 -0.34 -0.04 0.00 -0.15 0.00 0.00 55.06 54.52 1nj6 s HIS 69 Cb 0.00 -1.23 0.01 0.00 1.11 0.00 0.00 32.58 32.47 1nj6 s HIS 69 CO 0.00 0.41 0.01 -1.21 -0.85 0.00 0.00 174.74 173.10 1nj6 s GLU 70 N -2.32 3.07 0.39 1.40 2.02 0.82 -4.46 118.70 119.62 1nj6 s GLU 70 Ca 0.18 -0.84 -0.25 0.00 0.02 0.00 0.00 54.97 54.07 1nj6 s GLU 70 Cb -0.09 -3.16 -0.09 0.00 0.10 0.00 0.00 34.13 30.89 1nj6 s GLU 70 CO 0.08 -0.37 1.16 -2.00 0.02 0.00 0.00 175.26 174.15 1nj6 s GLU 71 N 1.44 4.10 0.00 1.61 2.12 -1.26 -2.87 118.70 123.84 1nj6 s GLU 71 Ca 0.02 1.81 0.00 0.00 0.36 0.00 0.00 54.97 57.16 1nj6 s GLU 71 Cb -0.16 -2.69 0.00 0.00 0.26 0.00 0.00 34.13 31.54 1nj6 s GLU 71 CO -0.01 -0.28 0.00 1.33 -0.54 0.00 0.00 175.26 175.76 1nj6 n VAL 72 N 0.12 0.00 -3.15 3.70 0.24 -0.49 -4.90 118.33 113.85 1nj6 n VAL 72 Ca 0.04 0.00 0.04 0.00 -2.04 0.00 0.00 64.34 62.38 1nj6 n VAL 72 Cb 0.47 0.00 -0.00 0.00 -1.47 0.00 0.00 33.84 32.83 1nj6 n VAL 72 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 1nj6 s LEU 73 N 0.00 -1.37 0.46 1.34 2.96 -1.26 -4.57 118.68 116.25 1nj6 s LEU 73 Ca 0.00 0.42 0.05 0.00 -0.22 0.00 0.00 54.13 54.37 1nj6 s LEU 73 Cb 0.00 1.97 0.02 0.00 0.50 0.00 0.00 46.19 48.67 1nj6 s LEU 73 CO 0.00 -0.25 0.64 -0.36 -1.32 0.00 0.00 176.35 175.06 1nj6 s PHE 74 N 2.86 2.91 1.15 5.38 0.40 -1.26 -5.10 117.98 124.31 1nj6 s PHE 74 Ca 0.15 -0.17 -0.13 0.00 -0.60 0.00 0.00 56.93 56.18 1nj6 s PHE 74 Cb -0.11 -2.47 0.27 0.00 0.51 0.00 0.00 43.02 41.23 1nj6 s PHE 74 CO -0.23 -0.53 1.04 -2.14 0.70 0.00 0.00 175.22 174.05 1nj6 s PRO 75 N -4.50 -0.78 -0.17 0.24 0.02 -1.26 -5.00 135.00 123.54 1nj6 s PRO 75 Ca 0.54 0.82 -0.08 0.00 0.02 0.00 0.00 61.00 62.30 1nj6 s PRO 75 Cb -0.10 -1.57 -0.22 0.00 0.02 0.00 0.00 34.50 32.63 1nj6 s PRO 75 CO 0.35 -3.63 0.17 -0.11 -0.33 0.00 0.00 177.00 173.45 1nj6 n LEU 76 N -4.85 2.54 -4.79 -5.54 7.94 -1.26 -4.94 117.00 106.10 1nj6 n LEU 76 Ca 0.03 0.18 -0.39 0.00 -1.11 0.00 0.00 56.01 54.72 1nj6 n LEU 76 Cb 0.54 -1.03 -0.06 0.00 0.53 0.00 0.00 43.42 43.40 1nj6 n LEU 76 CO 0.57 0.76 0.37 -0.76 -1.11 0.00 0.00 177.39 177.22 1nj6 s LEU 77 N -7.10 4.53 -0.06 -1.96 1.43 -1.26 -1.09 118.68 113.16 1nj6 s LEU 77 Ca -0.27 1.40 0.04 0.00 -1.03 0.00 0.00 54.13 54.27 1nj6 s LEU 77 Cb 0.08 -3.07 0.00 0.00 0.03 0.00 0.00 46.19 43.22 1nj6 s LEU 77 CO 0.69 0.20 -0.17 -0.69 0.23 0.00 0.00 176.35 176.60 1nj6 s VAL 78 N -0.88 1.49 0.29 -1.59 1.01 0.23 -4.91 120.40 116.02 1nj6 s VAL 78 Ca 0.33 -0.72 -0.27 0.00 0.00 0.00 0.00 61.98 61.32 1nj6 s VAL 78 Cb -0.21 -1.29 -0.09 0.00 0.00 0.00 0.00 36.38 34.79 1nj6 s VAL 78 CO 0.22 0.43 0.92 -2.16 0.00 0.00 0.00 175.10 174.51 1nj6 s PRO 79 N 0.23 4.64 0.21 2.72 0.04 -1.26 0.98 135.00 142.55 1nj6 s PRO 79 Ca -0.09 1.34 -0.21 0.00 0.04 0.00 0.00 61.00 62.08 1nj6 s PRO 79 Cb -0.14 -2.96 0.15 0.00 0.04 0.00 0.00 34.50 31.59 1nj6 s PRO 79 CO 0.04 0.37 1.50 0.39 0.04 0.00 0.00 177.00 179.34 1nj6 n GLU 80 N 0.89 -0.28 -0.32 4.56 1.02 -1.00 -0.89 120.64 124.61 1nj6 n GLU 80 Ca 0.00 1.49 -0.04 0.00 -0.02 0.00 0.00 57.16 58.59 1nj6 n GLU 80 Cb 0.49 -2.20 -0.01 0.00 -0.02 0.00 0.00 31.44 29.70 1nj6 n GLU 80 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1nj6 n ASP 81 N -5.37 -0.65 -0.03 1.62 4.64 -1.26 -0.36 116.55 115.13 1nj6 n ASP 81 Ca 0.08 1.43 -0.13 0.00 -1.38 0.00 0.00 54.79 54.78 1nj6 n ASP 81 Cb 0.35 -0.28 -0.10 0.00 -1.04 0.00 0.00 41.12 40.05 1nj6 n ASP 81 CO 0.00 0.00 0.00 -0.33 -0.82 0.00 0.00 177.20 176.05 1nj6 h GLU 82 N 0.00 0.05 -0.94 -0.67 4.39 -1.37 -3.16 114.58 112.89 1nj6 h GLU 82 Ca 0.23 -0.04 0.10 0.00 0.34 0.00 0.00 59.36 59.99 1nj6 h GLU 82 Cb 0.43 0.01 -0.08 0.00 -0.10 0.00 0.00 28.75 29.01 1nj6 h GLU 82 CO -0.79 0.66 0.58 1.25 -1.16 0.00 0.00 179.01 179.54 1nj6 h LEU 83 N -0.55 0.86 -0.09 1.33 5.85 -0.46 -2.11 115.31 120.14 1nj6 h LEU 83 Ca -0.00 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.76 1nj6 h LEU 83 Cb 0.66 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.55 1nj6 h LEU 83 CO 0.01 0.50 -0.06 0.00 -0.34 0.00 0.00 178.44 178.54 1nj6 n ALA 84 N -2.36 2.63 0.17 1.25 0.00 0.51 -3.87 120.51 118.83 1nj6 n ALA 84 Ca 0.16 -0.20 0.10 0.00 0.00 0.00 0.00 53.44 53.51 1nj6 n ALA 84 Cb 0.28 -1.41 0.55 0.00 0.00 0.00 0.00 19.45 18.87 1nj6 n ALA 84 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1nj6 n LYS 85 N -1.18 0.13 -2.76 0.00 5.02 -0.79 -4.65 118.16 113.93 1nj6 n LYS 85 Ca 0.13 0.63 -0.32 0.00 -2.02 0.00 0.00 58.31 56.73 1nj6 n LYS 85 Cb 0.27 -2.01 -0.05 0.00 -0.02 0.00 0.00 35.03 33.22 1nj6 n LYS 85 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1nj6 s GLU 86 N -3.51 3.96 0.00 1.97 0.41 -1.25 -5.01 118.70 115.26 1nj6 s GLU 86 Ca -0.02 0.79 0.00 0.00 -0.41 0.00 0.00 54.97 55.32 1nj6 s GLU 86 Cb 0.06 -2.28 0.00 0.00 -1.78 0.00 0.00 34.13 30.13 1nj6 s GLU 86 CO 0.18 -0.07 0.00 0.00 -0.49 0.00 0.00 175.26 174.88 1nj6 n ALA 87 N -1.08 0.00 0.09 5.21 0.00 -1.26 -4.16 120.51 119.31 1nj6 n ALA 87 Ca 0.05 -0.09 -0.18 0.00 0.00 0.00 0.00 53.44 53.22 1nj6 n ALA 87 Cb 0.54 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.84 1nj6 n ALA 87 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1nj6 h ILE 88 N 0.00 1.26 -0.44 0.00 2.04 -1.96 -3.28 117.51 115.12 1nj6 h ILE 88 Ca 0.00 -2.84 0.04 0.00 1.00 0.00 0.00 64.86 63.06 1nj6 h ILE 88 Cb 0.00 2.86 -0.04 0.00 -0.74 0.00 0.00 36.82 38.90 1nj6 h ILE 88 CO 0.00 0.84 0.21 -0.74 0.00 0.00 0.00 178.15 178.46 1nj6 h HIS 89 N 0.08 0.38 -0.75 1.37 2.76 -1.84 0.39 115.15 117.55 1nj6 h HIS 89 Ca -0.22 0.02 -0.04 0.00 -2.20 0.00 0.00 60.37 57.93 1nj6 h HIS 89 Cb 2.03 -0.11 -0.03 0.00 1.55 0.00 0.00 27.41 30.85 1nj6 h HIS 89 CO 0.08 0.18 0.30 0.28 -1.30 0.00 0.00 177.93 177.47 1nj6 h VAL 90 N 0.42 1.25 -0.26 5.26 2.07 -1.72 -1.48 116.25 121.79 1nj6 h VAL 90 Ca 0.20 -0.78 -0.06 0.00 0.82 0.00 0.00 66.70 66.87 1nj6 h VAL 90 Cb 0.12 0.34 -0.02 0.00 -1.52 0.00 0.00 31.29 30.22 1nj6 h VAL 90 CO -0.15 0.32 -0.11 0.50 0.02 0.00 0.00 177.57 178.14 1nj6 h LYS 91 N 1.09 0.44 0.00 1.57 3.64 -1.40 0.15 116.57 122.06 1nj6 h LYS 91 Ca 0.25 -0.12 0.00 0.00 -1.27 0.00 0.00 60.65 59.52 1nj6 h LYS 91 Cb 0.20 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 31.97 1nj6 h LYS 91 CO -0.02 0.56 0.00 0.78 -2.27 0.00 0.00 179.45 178.49 1nj6 h GLY 92 N 0.88 0.00 0.00 5.01 0.00 0.83 -3.21 103.07 106.58 1nj6 h GLY 92 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.41 1nj6 h GLY 92 CO 0.03 0.00 0.00 0.69 0.00 0.00 0.00 176.54 177.26 1nj6 n PHE 93 N -2.43 0.00 0.00 5.60 3.01 -1.01 -4.93 117.46 117.70 1nj6 n PHE 93 Ca 0.02 -0.15 0.00 0.00 1.01 0.00 0.00 57.45 58.32 1nj6 n PHE 93 Cb 0.24 -0.02 0.00 0.00 -0.01 0.00 0.00 39.48 39.69 1nj6 n PHE 93 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 1nj6 n GLU 94 N -0.15 0.00 -0.46 -1.08 -0.58 0.48 -0.29 120.64 118.56 1nj6 n GLU 94 Ca 0.00 0.24 0.01 0.00 -0.42 0.00 0.00 57.16 56.99 1nj6 n GLU 94 Cb 0.33 -0.47 0.18 0.00 -0.57 0.00 0.00 31.44 30.90 1nj6 n GLU 94 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 1nj6 n ASP 95 N -0.81 3.29 -0.43 1.62 -0.08 -1.26 -3.81 116.55 115.07 1nj6 n ASP 95 Ca 0.00 -2.50 0.07 0.00 -1.51 0.00 0.00 54.79 50.85 1nj6 n ASP 95 Cb 0.00 -0.60 0.02 0.00 2.34 0.00 0.00 41.12 42.88 1nj6 n ASP 95 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 1nj6 n GLU 96 N 0.21 1.51 -3.99 -0.67 1.02 0.61 -4.83 120.64 114.50 1nj6 n GLU 96 Ca 0.16 -1.00 -0.34 0.00 -0.02 0.00 0.00 57.16 55.96 1nj6 n GLU 96 Cb 0.76 -1.24 -0.06 0.00 -0.02 0.00 0.00 31.44 30.88 1nj6 n GLU 96 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1nj6 s VAL 97 N -1.51 5.18 0.19 2.62 1.01 -1.07 -0.54 120.40 126.28 1nj6 s VAL 97 Ca 0.14 -0.12 -0.16 0.00 0.00 0.00 0.00 61.98 61.84 1nj6 s VAL 97 Cb 0.12 -3.34 -0.08 0.00 0.00 0.00 0.00 36.38 33.08 1nj6 s VAL 97 CO 0.28 0.45 0.62 -0.31 0.00 0.00 0.00 175.10 176.14 1nj6 s TYR 98 N -1.16 3.59 -0.11 5.22 1.51 -1.26 -4.89 117.35 120.24 1nj6 s TYR 98 Ca 0.21 1.17 0.02 0.00 -1.01 0.00 0.00 57.07 57.46 1nj6 s TYR 98 Cb -0.12 -2.46 0.01 0.00 -0.11 0.00 0.00 41.96 39.28 1nj6 s TYR 98 CO 0.12 0.37 -0.17 -1.58 -1.11 0.00 0.00 175.55 173.17 1nj6 s TRP 99 N -1.54 2.13 -0.14 2.71 0.52 -1.26 -2.29 118.94 119.07 1nj6 s TRP 99 Ca 0.41 -1.02 -0.19 0.00 0.02 0.00 0.00 56.10 55.32 1nj6 s TRP 99 Cb -0.15 -1.51 -0.04 0.00 -1.15 0.00 0.00 33.47 30.62 1nj6 s TRP 99 CO 0.20 -0.51 0.54 0.14 0.02 0.00 0.00 176.95 177.34 1nj6 s VAL 100 N 0.94 5.13 -0.03 4.03 -7.23 0.15 -4.91 120.40 118.47 1nj6 s VAL 100 Ca -0.07 1.06 0.04 0.00 -1.81 0.00 0.00 61.98 61.20 1nj6 s VAL 100 Cb -0.15 -3.87 -0.06 0.00 0.56 0.00 0.00 36.38 32.85 1nj6 s VAL 100 CO -0.01 0.26 0.04 0.35 -0.31 0.00 0.00 175.10 175.43 1nj6 n THR 101 N 4.00 0.21 -4.38 5.32 -2.24 -1.26 -1.67 114.28 114.27 1nj6 n THR 101 Ca -0.05 -0.17 -0.28 0.00 -2.27 0.00 0.00 64.05 61.28 1nj6 n THR 101 Cb 0.51 -0.48 -0.13 0.00 -2.10 0.00 0.00 70.33 68.13 1nj6 n THR 101 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1nj6 s HIS 102 N -2.18 2.23 -0.63 4.78 3.76 -1.26 0.29 115.29 122.28 1nj6 s HIS 102 Ca -0.02 -0.38 0.05 0.00 -0.15 0.00 0.00 55.06 54.55 1nj6 s HIS 102 Cb 0.02 -1.19 0.15 0.00 1.11 0.00 0.00 32.58 32.67 1nj6 s HIS 102 CO 0.19 0.34 0.40 0.20 -0.85 0.00 0.00 174.74 175.03 1nj6 s GLY 103 N -2.14 2.71 0.00 -2.22 0.00 0.26 -4.80 107.32 101.13 1nj6 s GLY 103 Ca 0.14 -3.59 0.00 0.00 0.00 0.00 0.00 44.72 41.27 1nj6 s GLY 103 CO 0.06 1.08 0.00 0.61 0.00 0.00 0.00 173.10 174.85 1nj6 n GLY 104 N 2.43 1.11 0.00 0.20 0.00 -1.26 -3.23 105.19 104.45 1nj6 n GLY 104 Ca 0.14 -0.74 0.02 0.00 0.00 0.00 0.00 46.02 45.44 1nj6 n GLY 104 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1nj6 n LEU 105 N 0.00 0.12 -4.76 0.99 4.77 -1.26 -5.00 117.00 111.85 1nj6 n LEU 105 Ca 0.00 -0.33 -0.40 0.00 -0.03 0.00 0.00 56.01 55.26 1nj6 n LEU 105 Cb 0.00 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.03 1nj6 n LEU 105 CO 0.00 0.03 0.56 -0.44 -1.33 0.00 0.00 177.39 176.21 1nj6 s SER 106 N -1.75 7.51 -0.22 -1.43 0.01 -1.20 -5.03 113.70 111.60 1nj6 s SER 106 Ca 0.00 1.79 -0.21 0.00 1.31 0.00 0.00 55.95 58.84 1nj6 s SER 106 Cb 0.03 -2.55 -0.02 0.00 0.21 0.00 0.00 66.02 63.69 1nj6 s SER 106 CO 0.16 0.19 0.65 -0.75 0.41 0.00 0.00 173.24 173.90 1nj6 s LYS 107 N -1.16 4.17 0.50 12.44 2.20 -1.26 0.92 119.74 137.56 1nj6 s LYS 107 Ca 0.38 0.63 -0.23 0.00 -0.36 0.00 0.00 55.97 56.40 1nj6 s LYS 107 Cb -0.24 -3.61 -0.07 0.00 -1.51 0.00 0.00 37.83 32.39 1nj6 s LYS 107 CO 0.29 -0.34 1.23 1.28 -0.36 0.00 0.00 175.35 177.45 1nj6 n LEU 108 N 5.40 4.41 -1.47 5.43 4.77 0.15 -4.85 117.00 130.84 1nj6 n LEU 108 Ca -0.00 1.00 -0.06 0.00 -0.03 0.00 0.00 56.01 56.92 1nj6 n LEU 108 Cb 0.49 -1.50 0.15 0.00 -2.33 0.00 0.00 43.42 40.23 1nj6 n LEU 108 CO 0.44 -0.91 0.77 0.00 -1.33 0.00 0.00 177.39 176.37 1nj6 n GLN 109 N -0.53 2.29 -3.15 3.23 6.02 -1.26 -4.60 117.38 119.38 1nj6 n GLN 109 Ca 0.09 -1.63 0.05 0.00 -0.01 0.00 0.00 57.00 55.51 1nj6 n GLN 109 Cb 0.43 -1.75 -0.01 0.00 1.02 0.00 0.00 30.24 29.93 1nj6 n GLN 109 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 1nj6 s ARG 110 N -1.83 0.19 0.54 -1.09 3.52 -1.26 -5.15 118.95 113.87 1nj6 s ARG 110 Ca 0.30 0.29 -0.21 0.00 -0.13 0.00 0.00 55.73 55.97 1nj6 s ARG 110 Cb 0.24 0.15 -0.06 0.00 -1.56 0.00 0.00 34.95 33.73 1nj6 s ARG 110 CO 0.07 -0.25 1.21 1.63 -0.81 0.00 0.00 175.30 177.15 1nj6 n LYS 111 N 5.37 1.44 -4.94 5.12 5.02 -1.26 -4.90 118.16 124.01 1nj6 n LYS 111 Ca -0.02 0.53 -0.30 0.00 -2.02 0.00 0.00 58.31 56.50 1nj6 n LYS 111 Cb 0.55 -2.39 -0.17 0.00 -0.02 0.00 0.00 35.03 33.00 1nj6 n LYS 111 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1nj6 s LEU 112 N -2.66 1.98 -0.12 -0.35 1.43 -0.67 -2.37 118.68 115.91 1nj6 s LEU 112 Ca 0.71 -0.51 -0.05 0.00 -1.03 0.00 0.00 54.13 53.25 1nj6 s LEU 112 Cb -0.44 -1.28 -0.04 0.00 0.03 0.00 0.00 46.19 44.46 1nj6 s LEU 112 CO 0.50 0.11 0.08 0.00 0.23 0.00 0.00 176.35 177.27 1nj6 s ALA 113 N 0.54 3.60 0.04 4.21 0.00 0.27 0.31 121.76 130.74 1nj6 s ALA 113 Ca -0.15 -0.71 -0.30 0.00 0.00 0.00 0.00 51.96 50.79 1nj6 s ALA 113 Cb -0.17 -1.81 -0.05 0.00 0.00 0.00 0.00 23.12 21.09 1nj6 s ALA 113 CO 0.05 0.53 1.24 -0.51 0.00 0.00 0.00 175.76 177.07 1nj6 s LEU 114 N -0.72 4.35 0.18 0.00 1.43 -0.97 -0.60 118.68 122.35 1nj6 s LEU 114 Ca 0.12 2.03 -0.33 0.00 -1.03 0.00 0.00 54.13 54.92 1nj6 s LEU 114 Cb -0.12 -3.57 -0.14 0.00 0.03 0.00 0.00 46.19 42.39 1nj6 s LEU 114 CO 0.03 -0.54 1.42 -2.11 0.23 0.00 0.00 176.35 175.38 1nj6 n ARG 115 N 4.30 1.83 -0.03 1.70 1.85 -0.25 -4.55 116.66 121.52 1nj6 n ARG 115 Ca 0.10 0.66 -0.01 0.00 -1.00 0.00 0.00 57.85 57.60 1nj6 n ARG 115 Cb 0.46 -2.33 -0.13 0.00 -1.05 0.00 0.00 32.46 29.40 1nj6 n ARG 115 CO 0.00 0.00 0.00 -0.35 -0.01 0.00 0.00 177.63 177.27 1nj6 n PRO 116 N 2.51 0.66 -3.53 2.89 -0.05 -1.25 -1.05 135.00 135.17 1nj6 n PRO 116 Ca 0.15 0.02 -0.07 0.00 -0.05 0.00 0.00 63.50 63.54 1nj6 n PRO 116 Cb 0.28 -1.62 -0.02 0.00 -0.05 0.00 0.00 33.50 32.09 1nj6 n PRO 116 CO 0.00 0.00 0.00 -0.08 -0.05 0.00 0.00 175.50 175.37 1nj6 s THR 117 N -2.93 0.00 -1.19 0.52 -1.32 -1.26 -4.54 115.64 104.91 1nj6 s THR 117 Ca -0.07 0.00 0.18 0.00 -1.21 0.00 0.00 61.69 60.59 1nj6 s THR 117 Cb 0.09 -1.00 0.70 0.00 -1.51 0.00 0.00 72.50 70.78 1nj6 s THR 117 CO 0.85 0.00 1.60 -1.20 -2.21 0.00 0.00 174.62 173.66 1nj6 n SER 118 N -0.18 4.61 -0.01 8.08 7.64 -1.26 -4.61 113.62 127.89 1nj6 n SER 118 Ca -0.06 -2.42 -0.09 0.00 1.01 0.00 0.00 58.87 57.31 1nj6 n SER 118 Cb 0.61 -0.57 -0.03 0.00 -1.01 0.00 0.00 64.21 63.21 1nj6 n SER 118 CO 0.00 0.00 0.00 -0.33 -3.01 0.00 0.00 175.04 171.70 1nj6 h GLU 119 N 3.99 -0.19 0.00 1.43 3.07 -1.99 0.11 114.58 121.00 1nj6 h GLU 119 Ca 0.00 0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.87 1nj6 h GLU 119 Cb 1.40 0.04 0.00 0.00 -0.84 0.00 0.00 28.75 29.36 1nj6 h GLU 119 CO 0.22 -0.13 0.00 0.25 -1.40 0.00 0.00 179.01 177.95 1nj6 n THR 120 N -5.32 0.43 -0.14 1.13 -2.24 -1.26 -1.50 114.28 105.39 1nj6 n THR 120 Ca -0.02 0.11 -0.27 0.00 -2.27 0.00 0.00 64.05 61.59 1nj6 n THR 120 Cb 0.23 -0.90 -0.10 0.00 -2.10 0.00 0.00 70.33 67.46 1nj6 n THR 120 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1nj6 n VAL 121 N -1.18 1.50 0.09 2.28 0.31 -0.11 -4.63 118.33 116.59 1nj6 n VAL 121 Ca 0.07 -0.42 -0.16 0.00 -0.01 0.00 0.00 64.34 63.82 1nj6 n VAL 121 Cb 0.08 -1.79 -0.14 0.00 -0.91 0.00 0.00 33.84 31.08 1nj6 n VAL 121 CO 0.00 0.00 0.00 0.24 -1.32 0.00 0.00 176.83 175.75 1nj6 h MET 122 N -0.81 0.27 -0.37 5.55 2.86 -1.10 -3.39 114.93 117.95 1nj6 h MET 122 Ca -0.68 -0.47 0.01 0.00 -2.06 0.00 0.00 59.70 56.50 1nj6 h MET 122 Cb 1.66 0.17 -0.02 0.00 0.06 0.00 0.00 31.60 33.48 1nj6 h MET 122 CO -0.36 1.19 0.24 1.88 1.06 0.00 0.00 176.91 180.92 1nj6 h TYR 123 N 0.07 0.45 -0.01 -0.22 0.05 -1.48 0.15 116.97 115.97 1nj6 h TYR 123 Ca -0.17 0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.62 1nj6 h TYR 123 Cb 1.99 -0.15 -0.00 0.00 1.01 0.00 0.00 36.73 39.58 1nj6 h TYR 123 CO 0.07 0.28 0.01 -1.00 -1.05 0.00 0.00 178.16 176.47 1nj6 h PRO 124 N 0.48 0.00 -0.04 4.88 0.13 -1.80 0.84 132.00 136.50 1nj6 h PRO 124 Ca 0.14 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 65.10 1nj6 h PRO 124 Cb -0.05 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.07 1nj6 h PRO 124 CO -0.04 0.00 -0.70 1.98 -0.23 0.00 0.00 178.00 179.01 1nj6 h MET 125 N 0.00 0.21 0.00 0.86 4.05 -1.44 -2.88 114.93 115.73 1nj6 h MET 125 Ca 0.01 -0.17 -0.07 0.00 -0.28 0.00 0.00 59.70 59.19 1nj6 h MET 125 Cb 0.03 0.04 -0.01 0.00 -0.80 0.00 0.00 31.60 30.85 1nj6 h MET 125 CO -0.00 0.82 -0.33 0.74 0.23 0.00 0.00 176.91 178.37 1nj6 h PHE 126 N 0.14 0.00 -0.92 1.39 0.05 0.16 -1.80 116.94 115.96 1nj6 h PHE 126 Ca -0.02 0.00 0.08 0.00 3.82 0.00 0.00 57.97 61.85 1nj6 h PHE 126 Cb 1.25 0.00 -0.06 0.00 2.00 0.00 0.00 35.95 39.13 1nj6 h PHE 126 CO 0.02 0.33 0.59 0.00 -0.18 0.00 0.00 178.31 179.08 1nj6 h ALA 127 N 1.67 1.54 0.04 2.45 0.00 -1.03 -1.06 119.26 122.87 1nj6 h ALA 127 Ca -0.00 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1nj6 h ALA 127 Cb 0.62 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1nj6 h ALA 127 CO 0.04 0.29 -0.02 -0.07 0.00 0.00 0.00 179.25 179.50 1nj6 h LEU 128 N 0.99 -0.04 -2.48 0.00 3.38 -1.46 -3.32 115.31 112.38 1nj6 h LEU 128 Ca 0.41 -0.61 0.00 0.00 0.09 0.00 0.00 57.88 57.78 1nj6 h LEU 128 Cb 0.29 0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.05 1nj6 h LEU 128 CO -0.17 0.72 0.12 -0.50 0.09 0.00 0.00 178.44 178.70 1nj6 h TRP 129 N -0.94 0.00 -3.42 1.13 4.06 -1.12 -3.41 115.95 112.25 1nj6 h TRP 129 Ca -0.00 0.00 -0.63 0.00 2.06 0.00 0.00 58.89 60.31 1nj6 h TRP 129 Cb 0.64 0.00 -0.19 0.00 -1.00 0.00 0.00 29.16 28.61 1nj6 h TRP 129 CO 0.16 0.00 -0.61 0.08 -3.56 0.00 0.00 178.44 174.52 1nj6 s VAL 130 N -4.06 4.43 0.01 1.49 1.01 -0.42 -4.94 120.40 117.92 1nj6 s VAL 130 Ca -0.04 -0.15 0.00 0.00 0.00 0.00 0.00 61.98 61.79 1nj6 s VAL 130 Cb 0.11 -3.01 0.00 0.00 0.00 0.00 0.00 36.38 33.47 1nj6 s VAL 130 CO 0.34 0.42 0.00 0.54 0.00 0.00 0.00 175.10 176.40 1nj6 n ARG 131 N 4.02 0.00 -3.55 2.72 5.12 -1.26 -4.77 116.66 118.94 1nj6 n ARG 131 Ca -0.17 0.00 -0.28 0.00 -1.93 0.00 0.00 57.85 55.48 1nj6 n ARG 131 Cb 0.52 -0.00 -0.03 0.00 -1.16 0.00 0.00 32.46 31.79 1nj6 n ARG 131 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 1nj6 s SER 132 N -4.21 6.41 0.33 0.55 0.15 -1.26 0.23 113.70 115.90 1nj6 s SER 132 Ca 0.00 0.52 0.24 0.00 0.70 0.00 0.00 55.95 57.41 1nj6 s SER 132 Cb 0.00 -2.06 1.21 0.00 -1.71 0.00 0.00 66.02 63.46 1nj6 s SER 132 CO 0.00 -0.10 1.73 1.12 1.20 0.00 0.00 173.24 177.18 1nj6 h HIS 133 N 1.87 0.00 0.00 3.44 2.07 -1.70 0.45 115.15 121.28 1nj6 h HIS 133 Ca -0.48 0.00 -0.04 0.00 -2.85 0.00 0.00 60.37 57.00 1nj6 h HIS 133 Cb 1.19 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 31.16 1nj6 h HIS 133 CO 0.56 0.00 -0.21 1.79 -3.07 0.00 0.00 177.93 177.00 1nj6 h THR 134 N 0.00 0.50 -0.27 6.12 1.35 -1.92 -3.00 112.91 115.69 1nj6 h THR 134 Ca 0.00 -1.10 -0.11 0.00 -0.55 0.00 0.00 66.41 64.65 1nj6 h THR 134 Cb 0.11 1.77 -0.00 0.00 -1.73 0.00 0.00 68.15 68.30 1nj6 h THR 134 CO 0.00 0.20 -0.26 0.44 -0.25 0.00 0.00 175.52 175.66 1nj6 h ASP 135 N 0.00 0.69 -4.12 5.36 3.32 -0.47 -3.45 116.42 117.75 1nj6 h ASP 135 Ca -0.00 -0.47 -0.47 0.00 0.02 0.00 0.00 57.03 56.11 1nj6 h ASP 135 Cb 0.76 -0.19 0.02 0.00 0.22 0.00 0.00 39.33 40.13 1nj6 h ASP 135 CO 0.03 1.01 0.37 -0.76 -1.72 0.00 0.00 179.24 178.17 1nj6 s LEU 136 N -9.01 3.74 0.27 1.55 1.43 -1.13 -4.38 118.68 111.15 1nj6 s LEU 136 Ca -0.13 1.77 -0.16 0.00 -1.03 0.00 0.00 54.13 54.58 1nj6 s LEU 136 Cb 0.08 -4.54 -0.08 0.00 0.03 0.00 0.00 46.19 41.68 1nj6 s LEU 136 CO 0.82 -0.72 0.70 -2.16 0.23 0.00 0.00 176.35 175.22 1nj6 s PRO 137 N -3.59 4.07 -0.10 1.29 0.04 -1.26 -4.97 135.00 130.47 1nj6 s PRO 137 Ca 0.63 0.69 0.02 0.00 0.04 0.00 0.00 61.00 62.38 1nj6 s PRO 137 Cb -0.13 -2.63 -0.01 0.00 0.04 0.00 0.00 34.50 31.76 1nj6 s PRO 137 CO 0.24 0.27 -0.17 -1.64 0.04 0.00 0.00 177.00 175.75 1nj6 s MET 138 N -2.56 3.09 -0.25 4.56 -1.94 -0.95 -4.97 119.30 116.28 1nj6 s MET 138 Ca 0.49 -0.75 -0.00 0.00 -1.71 0.00 0.00 55.69 53.71 1nj6 s MET 138 Cb -0.13 -2.47 0.07 0.00 2.01 0.00 0.00 34.83 34.31 1nj6 s MET 138 CO 0.19 0.29 0.01 1.03 -0.01 0.00 0.00 175.02 176.52 1nj6 s ARG 139 N 0.13 1.16 0.34 2.03 0.52 -1.26 -0.55 118.95 121.33 1nj6 s ARG 139 Ca -0.09 -0.91 0.09 0.00 -0.52 0.00 0.00 55.73 54.30 1nj6 s ARG 139 Cb -0.15 -2.38 -0.06 0.00 0.52 0.00 0.00 34.95 32.88 1nj6 s ARG 139 CO 0.05 -0.71 -0.03 -0.06 0.02 0.00 0.00 175.30 174.57 1nj6 s PHE 140 N 1.53 2.49 -0.01 -0.53 2.99 -0.33 -0.12 117.98 124.00 1nj6 s PHE 140 Ca -0.00 -0.46 -0.28 0.00 0.00 0.00 0.00 56.93 56.18 1nj6 s PHE 140 Cb -0.18 -1.45 0.10 0.00 0.00 0.00 0.00 43.02 41.48 1nj6 s PHE 140 CO -0.11 0.52 0.85 1.52 -0.00 0.00 0.00 175.22 178.00 1nj6 s TYR 141 N -2.55 -0.39 0.02 0.36 -0.85 -1.14 -0.54 117.35 112.25 1nj6 s TYR 141 Ca 0.34 0.34 -0.17 0.00 -0.52 0.00 0.00 57.07 57.06 1nj6 s TYR 141 Cb 0.01 0.52 0.03 0.00 0.38 0.00 0.00 41.96 42.90 1nj6 s TYR 141 CO 0.18 -0.56 0.39 1.14 -1.52 0.00 0.00 175.55 175.18 1nj6 s GLN 142 N -2.80 0.84 -0.37 -3.49 -2.07 -0.67 -1.39 119.66 109.70 1nj6 s GLN 142 Ca 0.03 -0.29 -0.01 0.00 -1.82 0.00 0.00 55.36 53.26 1nj6 s GLN 142 Cb -0.01 0.38 0.10 0.00 -1.09 0.00 0.00 33.01 32.39 1nj6 s GLN 142 CO -0.07 -0.27 0.13 0.08 -1.32 0.00 0.00 175.29 173.84 1nj6 s VAL 143 N -2.08 2.97 0.20 3.63 1.01 -1.26 -1.19 120.40 123.69 1nj6 s VAL 143 Ca -0.08 -2.03 0.02 0.00 0.00 0.00 0.00 61.98 59.89 1nj6 s VAL 143 Cb -0.02 -3.02 -0.01 0.00 0.00 0.00 0.00 36.38 33.33 1nj6 s VAL 143 CO 0.00 -0.58 0.08 1.33 0.00 0.00 0.00 175.10 175.93 1nj6 n VAL 144 N 4.51 0.00 -4.31 2.92 0.24 -0.68 -4.90 118.33 116.11 1nj6 n VAL 144 Ca -0.02 -1.20 -0.34 0.00 -2.04 0.00 0.00 64.34 60.74 1nj6 n VAL 144 Cb 0.42 0.44 -0.12 0.00 -1.47 0.00 0.00 33.84 33.11 1nj6 n VAL 144 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1nj6 s ASN 145 N -2.26 4.92 0.31 -1.34 4.22 -1.26 -1.64 114.94 117.89 1nj6 s ASN 145 Ca 0.11 -0.11 0.11 0.00 -2.14 0.00 0.00 52.86 50.83 1nj6 s ASN 145 Cb 0.01 -1.81 -0.06 0.00 1.28 0.00 0.00 41.25 40.67 1nj6 s ASN 145 CO 0.08 0.16 -0.14 0.42 -2.04 0.00 0.00 177.10 175.58 1nj6 s THR 146 N 0.43 2.41 0.02 0.54 -4.23 -0.69 -4.92 115.64 109.19 1nj6 s THR 146 Ca -0.03 -2.29 0.06 0.00 -1.18 0.00 0.00 61.69 58.25 1nj6 s THR 146 Cb -0.14 -2.49 -0.02 0.00 1.34 0.00 0.00 72.50 71.19 1nj6 s THR 146 CO 0.02 -0.30 -0.17 -0.36 -0.54 0.00 0.00 174.62 173.27 1nj6 s PHE 147 N -2.55 1.53 -0.17 3.99 0.40 -0.21 -0.46 117.98 120.51 1nj6 s PHE 147 Ca 0.31 -0.33 -0.05 0.00 -0.60 0.00 0.00 56.93 56.27 1nj6 s PHE 147 Cb -0.02 -0.94 0.08 0.00 0.51 0.00 0.00 43.02 42.65 1nj6 s PHE 147 CO 0.16 0.03 0.29 1.03 0.70 0.00 0.00 175.22 177.43 1nj6 s ARG 148 N -0.81 0.21 -0.66 0.44 0.52 -0.50 -3.89 118.95 114.25 1nj6 s ARG 148 Ca 0.06 0.65 -0.25 0.00 -0.52 0.00 0.00 55.73 55.67 1nj6 s ARG 148 Cb -0.07 -0.28 0.05 0.00 0.52 0.00 0.00 34.95 35.16 1nj6 s ARG 148 CO 0.01 -0.41 1.08 -0.47 0.02 0.00 0.00 175.30 175.52 1nj6 s TYR 149 N 2.45 2.56 0.00 -0.53 5.04 0.30 -4.45 117.35 122.72 1nj6 s TYR 149 Ca 0.04 -0.24 0.00 0.00 -2.44 0.00 0.00 57.07 54.43 1nj6 s TYR 149 Cb -0.13 -4.38 0.00 0.00 0.35 0.00 0.00 41.96 37.79 1nj6 s TYR 149 CO -0.11 -1.74 0.00 0.39 -1.34 0.00 0.00 175.55 172.75 1nj6 n GLU 150 N 8.27 1.10 -0.19 4.97 1.02 -1.26 -4.41 120.64 130.14 1nj6 n GLU 150 Ca 0.00 0.00 -0.07 0.00 -0.02 0.00 0.00 57.16 57.07 1nj6 n GLU 150 Cb 0.47 0.00 -0.01 0.00 -0.02 0.00 0.00 31.44 31.88 1nj6 n GLU 150 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 1nj6 n THR 151 N 0.00 0.00 0.19 2.62 -1.04 -1.26 -4.74 114.28 110.05 1nj6 n THR 151 Ca 0.00 0.00 0.18 0.00 -2.04 0.00 0.00 64.05 62.19 1nj6 n THR 151 Cb 0.00 -0.01 0.77 0.00 -1.82 0.00 0.00 70.33 69.27 1nj6 n THR 151 CO 0.00 0.00 0.00 0.11 -0.64 0.00 0.00 175.07 174.54 1nj6 h LYS 152 N 0.39 0.00 -5.89 -2.82 1.57 -2.02 -3.36 116.57 104.43 1nj6 h LYS 152 Ca -0.06 0.00 -0.60 0.00 -1.87 0.00 0.00 60.65 58.12 1nj6 h LYS 152 Cb 0.17 0.00 -0.11 0.00 0.08 0.00 0.00 32.23 32.37 1nj6 h LYS 152 CO 0.08 0.00 1.00 -1.01 -0.57 0.00 0.00 179.45 178.95 1nj6 s HIS 153 N -4.41 2.55 0.25 -1.35 3.76 -1.26 -5.01 115.29 109.81 1nj6 s HIS 153 Ca -0.04 -0.53 -0.25 0.00 -0.15 0.00 0.00 55.06 54.09 1nj6 s HIS 153 Cb 0.13 -4.51 -0.09 0.00 1.11 0.00 0.00 32.58 29.21 1nj6 s HIS 153 CO 0.44 -1.86 0.84 0.99 -0.85 0.00 0.00 174.74 174.30 1nj6 s THR 154 N 4.74 4.33 -0.15 1.30 2.01 -1.26 -4.91 115.64 121.71 1nj6 s THR 154 Ca 0.34 1.68 -0.06 0.00 0.31 0.00 0.00 61.69 63.96 1nj6 s THR 154 Cb -0.08 -4.04 0.06 0.00 0.01 0.00 0.00 72.50 68.45 1nj6 s THR 154 CO 0.05 0.30 0.32 -0.13 -0.69 0.00 0.00 174.62 174.47 1nj6 s ARG 155 N -1.69 0.24 -0.10 4.92 0.52 -0.12 -4.96 118.95 117.75 1nj6 s ARG 155 Ca 0.43 0.77 -0.39 0.00 -0.52 0.00 0.00 55.73 56.02 1nj6 s ARG 155 Cb -0.20 0.02 -0.17 0.00 0.52 0.00 0.00 34.95 35.12 1nj6 s ARG 155 CO 0.25 -0.23 1.50 -2.30 0.02 0.00 0.00 175.30 174.54 1nj6 n PRO 156 N 4.90 0.99 -0.44 3.54 -0.02 -1.26 -0.04 135.00 142.67 1nj6 n PRO 156 Ca -0.14 0.36 0.00 0.00 -2.02 0.00 0.00 63.50 61.70 1nj6 n PRO 156 Cb 0.51 -2.00 0.00 0.00 -0.02 0.00 0.00 33.50 31.99 1nj6 n PRO 156 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1nj6 n LEU 157 N 3.67 0.88 -0.02 2.45 4.77 -1.26 -4.58 117.00 122.91 1nj6 n LEU 157 Ca 0.22 0.00 -0.02 0.00 -0.03 0.00 0.00 56.01 56.18 1nj6 n LEU 157 Cb 0.14 -1.36 -0.02 0.00 -2.33 0.00 0.00 43.42 39.85 1nj6 n LEU 157 CO 0.71 -0.44 -0.61 -0.38 -1.33 0.00 0.00 177.39 175.35 1nj6 n ILE 158 N -1.92 0.19 -3.35 -0.08 5.41 -0.57 -2.36 119.36 116.69 1nj6 n ILE 158 Ca 0.00 -0.09 -0.16 0.00 1.00 0.00 0.00 62.75 63.50 1nj6 n ILE 158 Cb 0.00 -0.71 -0.07 0.00 -0.71 0.00 0.00 39.64 38.15 1nj6 n ILE 158 CO 0.00 0.00 0.00 -0.60 0.00 0.00 0.00 176.55 175.95 1nj6 s ARG 159 N -2.07 0.67 0.33 0.38 6.06 0.94 -4.94 118.95 120.33 1nj6 s ARG 159 Ca -0.04 -0.88 0.09 0.00 -2.50 0.00 0.00 55.73 52.40 1nj6 s ARG 159 Cb 0.01 -0.69 -0.06 0.00 0.06 0.00 0.00 34.95 34.27 1nj6 s ARG 159 CO 0.09 -1.21 -0.04 0.14 -2.50 0.00 0.00 175.30 171.78 1nj6 s VAL 160 N 1.38 2.55 -0.01 7.11 -7.23 -1.26 -0.95 120.40 122.00 1nj6 s VAL 160 Ca 0.18 -2.07 0.03 0.00 -1.81 0.00 0.00 61.98 58.30 1nj6 s VAL 160 Cb -0.14 -2.71 -0.25 0.00 0.56 0.00 0.00 36.38 33.84 1nj6 s VAL 160 CO -0.03 -0.23 0.78 0.03 -0.31 0.00 0.00 175.10 175.35 1nj6 h ARG 161 N 1.91 0.13 -4.54 4.82 2.47 -0.36 -3.42 114.38 115.40 1nj6 h ARG 161 Ca -0.42 -0.22 -0.69 0.00 -1.26 0.00 0.00 59.98 57.38 1nj6 h ARG 161 Cb 1.25 0.08 -0.34 0.00 -1.65 0.00 0.00 29.97 29.32 1nj6 h ARG 161 CO 0.67 0.89 -0.57 -2.00 0.56 0.00 0.00 179.97 179.52 1nj6 s GLU 162 N -2.62 2.10 -0.63 0.04 2.12 -1.00 -1.41 118.70 117.30 1nj6 s GLU 162 Ca -0.08 -1.70 -0.28 0.00 0.36 0.00 0.00 54.97 53.28 1nj6 s GLU 162 Cb 0.08 -3.52 0.03 0.00 0.26 0.00 0.00 34.13 30.98 1nj6 s GLU 162 CO 0.83 -0.98 1.22 0.42 -0.54 0.00 0.00 175.26 176.21 1nj6 s ILE 163 N 1.17 3.92 -0.51 -3.70 1.01 0.39 -4.83 121.20 118.65 1nj6 s ILE 163 Ca 0.06 0.74 0.26 0.00 0.00 0.00 0.00 60.65 61.70 1nj6 s ILE 163 Cb -0.22 -4.79 0.30 0.00 0.01 0.00 0.00 42.46 37.76 1nj6 s ILE 163 CO -0.03 -1.52 1.76 0.71 0.00 0.00 0.00 174.94 175.85 1nj6 h THR 164 N 6.12 0.00 -2.13 2.92 1.35 -1.85 -1.84 112.91 117.48 1nj6 h THR 164 Ca -0.26 -0.52 -0.54 0.00 -0.55 0.00 0.00 66.41 64.54 1nj6 h THR 164 Cb 1.05 1.45 -0.41 0.00 -1.73 0.00 0.00 68.15 68.51 1nj6 h THR 164 CO 1.22 0.00 -0.93 0.41 -0.25 0.00 0.00 175.52 175.97 1nj6 n THR 165 N -2.52 1.22 -3.11 6.82 -1.04 -1.26 -4.49 114.28 109.90 1nj6 n THR 165 Ca 0.04 -4.96 -0.44 0.00 -2.04 0.00 0.00 64.05 56.65 1nj6 n THR 165 Cb 0.38 -1.02 -0.06 0.00 -1.82 0.00 0.00 70.33 67.81 1nj6 n THR 165 CO 0.00 0.00 0.00 0.12 -0.64 0.00 0.00 175.07 174.55 1nj6 s PHE 166 N -2.70 3.00 -0.31 -1.42 5.36 -0.65 -3.35 117.98 117.91 1nj6 s PHE 166 Ca 0.43 -0.53 -0.15 0.00 -0.96 0.00 0.00 56.93 55.71 1nj6 s PHE 166 Cb 0.29 -3.68 -0.02 0.00 -0.34 0.00 0.00 43.02 39.27 1nj6 s PHE 166 CO -0.10 -1.12 0.38 0.21 -1.46 0.00 0.00 175.22 173.14 1nj6 s LYS 167 N 2.82 3.78 -0.10 10.12 2.20 -0.79 -1.69 119.74 136.09 1nj6 s LYS 167 Ca 0.17 -0.18 0.03 0.00 -0.36 0.00 0.00 55.97 55.62 1nj6 s LYS 167 Cb -0.19 -3.74 0.01 0.00 -1.51 0.00 0.00 37.83 32.40 1nj6 s LYS 167 CO 0.12 -0.42 -0.19 -1.83 -0.36 0.00 0.00 175.35 172.67 1nj6 s GLU 168 N 2.08 2.55 0.03 4.03 -1.05 -0.33 -1.92 118.70 124.09 1nj6 s GLU 168 Ca 0.14 -0.70 0.04 0.00 -0.15 0.00 0.00 54.97 54.30 1nj6 s GLU 168 Cb -0.16 -2.01 -0.04 0.00 -0.44 0.00 0.00 34.13 31.49 1nj6 s GLU 168 CO 0.11 0.07 -0.07 0.00 0.95 0.00 0.00 175.26 176.32 1nj6 s ALA 169 N 0.60 3.01 -0.03 -0.84 0.00 0.49 -1.68 121.76 123.31 1nj6 s ALA 169 Ca -0.14 -1.07 0.01 0.00 0.00 0.00 0.00 51.96 50.75 1nj6 s ALA 169 Cb -0.17 -1.08 0.02 0.00 0.00 0.00 0.00 23.12 21.90 1nj6 s ALA 169 CO 0.04 0.62 -0.01 -1.01 0.00 0.00 0.00 175.76 175.41 1nj6 s HIS 170 N -1.05 0.36 0.18 0.00 3.76 0.30 -1.45 115.29 117.39 1nj6 s HIS 170 Ca 0.18 -0.03 0.09 0.00 -0.15 0.00 0.00 55.06 55.15 1nj6 s HIS 170 Cb -0.11 -0.42 -0.04 0.00 1.11 0.00 0.00 32.58 33.12 1nj6 s HIS 170 CO 0.09 -0.12 -0.19 0.95 -0.85 0.00 0.00 174.74 174.62 1nj6 s THR 171 N 0.90 1.96 -0.03 1.30 -4.23 0.39 -1.19 115.64 114.74 1nj6 s THR 171 Ca -0.09 -2.01 0.03 0.00 -1.18 0.00 0.00 61.69 58.44 1nj6 s THR 171 Cb -0.13 -1.95 -0.00 0.00 1.34 0.00 0.00 72.50 71.76 1nj6 s THR 171 CO -0.01 -0.32 -0.12 -0.63 -0.54 0.00 0.00 174.62 173.01 1nj6 s ILE 172 N -2.11 0.97 0.14 2.99 1.01 0.29 -2.72 121.20 121.77 1nj6 s ILE 172 Ca 0.18 -0.47 0.01 0.00 0.00 0.00 0.00 60.65 60.37 1nj6 s ILE 172 Cb -0.06 -0.85 -0.04 0.00 0.01 0.00 0.00 42.46 41.52 1nj6 s ILE 172 CO 0.08 0.29 -0.00 -1.00 0.00 0.00 0.00 174.94 174.31 1nj6 s HIS 173 N 0.07 1.05 -0.06 3.97 3.76 0.14 -2.25 115.29 121.97 1nj6 s HIS 173 Ca -0.02 -1.04 -0.22 0.00 -0.15 0.00 0.00 55.06 53.63 1nj6 s HIS 173 Cb -0.09 -0.60 -0.31 0.00 1.11 0.00 0.00 32.58 32.70 1nj6 s HIS 173 CO 0.01 -0.27 0.86 0.00 -0.85 0.00 0.00 174.74 174.49 1nj6 h ALA 174 N 2.80 -0.06 -3.94 -1.40 0.00 -1.94 -0.21 119.26 114.50 1nj6 h ALA 174 Ca -0.36 -0.71 -0.69 0.00 0.00 0.00 0.00 54.91 53.15 1nj6 h ALA 174 Cb 1.19 0.12 -0.22 0.00 0.00 0.00 0.00 17.79 18.88 1nj6 h ALA 174 CO 0.63 0.37 -0.84 0.95 0.00 0.00 0.00 179.25 180.36 1nj6 s THR 175 N -2.41 2.47 0.60 0.00 -4.23 -1.26 -4.53 115.64 106.27 1nj6 s THR 175 Ca -0.15 -1.55 0.30 0.00 -1.18 0.00 0.00 61.69 59.12 1nj6 s THR 175 Cb 0.01 -2.07 0.36 0.00 1.34 0.00 0.00 72.50 72.14 1nj6 s THR 175 CO 0.81 0.18 2.14 0.00 -0.54 0.00 0.00 174.62 177.21 1nj6 h ALA 176 N 4.09 1.66 0.73 3.99 0.00 -1.93 -1.18 119.26 126.61 1nj6 h ALA 176 Ca -0.49 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.38 1nj6 h ALA 176 Cb 1.16 0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.97 1nj6 h ALA 176 CO 0.43 -0.23 -0.35 1.03 0.00 0.00 0.00 179.25 180.13 1nj6 h SER 177 N 0.00 -0.83 -0.28 0.00 0.87 -2.00 -2.67 113.55 108.64 1nj6 h SER 177 Ca 0.06 0.03 -0.00 0.00 -1.23 0.00 0.00 61.79 60.64 1nj6 h SER 177 Cb 0.39 0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 62.55 1nj6 h SER 177 CO -0.00 -0.59 0.17 -0.33 -0.53 0.00 0.00 176.83 175.56 1nj6 h GLU 178 N -0.99 0.38 -0.22 2.24 5.08 -1.64 -2.08 114.58 117.36 1nj6 h GLU 178 Ca -0.10 -0.03 0.02 0.00 -1.00 0.00 0.00 59.36 58.25 1nj6 h GLU 178 Cb 0.75 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.90 1nj6 h GLU 178 CO 0.16 0.27 0.09 0.00 -1.00 0.00 0.00 179.01 178.54 1nj6 h ALA 179 N 1.80 0.26 -0.87 3.43 0.00 -1.24 0.12 119.26 122.75 1nj6 h ALA 179 Ca 0.10 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 1nj6 h ALA 179 Cb -0.02 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.72 1nj6 h ALA 179 CO -0.02 -0.32 0.46 0.93 0.00 0.00 0.00 179.25 180.30 1nj6 h GLU 180 N 0.21 1.22 -0.50 0.00 5.08 -1.06 -0.16 114.58 119.37 1nj6 h GLU 180 Ca 0.09 -0.15 -0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1nj6 h GLU 180 Cb 0.04 -0.23 -0.02 0.00 0.50 0.00 0.00 28.75 29.03 1nj6 h GLU 180 CO -0.08 0.91 0.30 1.49 -1.00 0.00 0.00 179.01 180.62 1nj6 h GLU 181 N 1.22 0.67 -0.16 2.33 4.81 -0.82 -1.86 114.58 120.76 1nj6 h GLU 181 Ca 0.30 -0.05 -0.03 0.00 -0.13 0.00 0.00 59.36 59.45 1nj6 h GLU 181 Cb 0.05 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.28 1nj6 h GLU 181 CO -0.05 0.47 -0.01 0.37 -0.73 0.00 0.00 179.01 179.07 1nj6 h GLN 182 N 0.68 0.29 -1.00 1.92 5.75 0.91 -1.58 115.11 122.08 1nj6 h GLN 182 Ca 0.18 -0.10 0.19 0.00 -0.15 0.00 0.00 58.65 58.78 1nj6 h GLN 182 Cb -0.02 -0.02 -0.10 0.00 1.07 0.00 0.00 27.48 28.40 1nj6 h GLN 182 CO -0.03 0.52 0.61 0.28 -2.65 0.00 0.00 178.83 177.56 1nj6 h VAL 183 N 0.03 0.71 -0.19 2.39 2.07 -0.46 0.33 116.25 121.12 1nj6 h VAL 183 Ca 0.04 -0.25 -0.13 0.00 0.82 0.00 0.00 66.70 67.19 1nj6 h VAL 183 Cb 0.39 -0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 30.07 1nj6 h VAL 183 CO 0.01 0.13 -0.42 -0.33 0.02 0.00 0.00 177.57 176.98 1nj6 h GLU 184 N 0.73 0.45 -0.37 1.57 5.08 -0.86 -2.31 114.58 118.88 1nj6 h GLU 184 Ca 0.56 -0.23 -0.08 0.00 -1.00 0.00 0.00 59.36 58.62 1nj6 h GLU 184 Cb 0.93 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.17 1nj6 h GLU 184 CO -0.35 0.80 -0.06 0.00 -1.00 0.00 0.00 179.01 178.39 1nj6 h ARG 185 N 0.37 0.69 -0.26 2.33 3.08 0.48 -2.20 114.38 118.87 1nj6 h ARG 185 Ca 0.03 -0.25 0.03 0.00 0.07 0.00 0.00 59.98 59.86 1nj6 h ARG 185 Cb 0.90 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.87 1nj6 h ARG 185 CO 0.08 0.83 0.08 0.00 -1.07 0.00 0.00 179.97 179.88 1nj6 h ALA 186 N 0.84 0.28 -0.88 0.04 0.00 -0.67 0.63 119.26 119.50 1nj6 h ALA 186 Ca 0.10 0.04 0.10 0.00 0.00 0.00 0.00 54.91 55.14 1nj6 h ALA 186 Cb 0.56 0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.32 1nj6 h ALA 186 CO 0.03 -0.34 0.57 0.28 0.00 0.00 0.00 179.25 179.80 1nj6 h VAL 187 N 0.19 0.96 -0.03 0.00 2.07 -1.25 0.96 116.25 119.15 1nj6 h VAL 187 Ca 0.12 -0.30 -0.15 0.00 0.82 0.00 0.00 66.70 67.18 1nj6 h VAL 187 Cb 0.10 0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 29.87 1nj6 h VAL 187 CO -0.13 0.16 -0.68 -0.33 0.02 0.00 0.00 177.57 176.60 1nj6 h GLU 188 N 0.87 0.14 -0.39 1.57 4.39 -0.67 -1.50 114.58 118.99 1nj6 h GLU 188 Ca 0.41 -0.11 -0.09 0.00 0.34 0.00 0.00 59.36 59.91 1nj6 h GLU 188 Cb 0.42 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.08 1nj6 h GLU 188 CO -0.18 0.77 -0.09 0.82 -1.16 0.00 0.00 179.01 179.17 1nj6 h ILE 189 N 0.10 1.27 -0.38 3.13 2.04 0.13 -1.63 117.51 122.17 1nj6 h ILE 189 Ca -0.01 -1.17 -0.15 0.00 1.00 0.00 0.00 64.86 64.53 1nj6 h ILE 189 Cb 1.21 1.23 -0.01 0.00 -0.74 0.00 0.00 36.82 38.51 1nj6 h ILE 189 CO 0.10 0.39 -0.34 1.88 0.00 0.00 0.00 178.15 180.18 1nj6 h TYR 190 N 0.57 1.04 0.13 1.37 0.99 -0.85 0.11 116.97 120.32 1nj6 h TYR 190 Ca 0.10 -0.29 0.01 0.00 2.00 0.00 0.00 58.73 60.55 1nj6 h TYR 190 Cb 0.61 -0.23 -0.02 0.00 1.00 0.00 0.00 36.73 38.09 1nj6 h TYR 190 CO 0.05 1.09 -0.17 0.87 -0.00 0.00 0.00 178.16 179.99 1nj6 h LYS 191 N 0.73 -0.34 -0.59 4.88 1.57 -1.16 0.36 116.57 122.02 1nj6 h LYS 191 Ca 0.07 0.02 0.04 0.00 -1.87 0.00 0.00 60.65 58.92 1nj6 h LYS 191 Cb 0.91 0.08 -0.04 0.00 0.08 0.00 0.00 32.23 33.25 1nj6 h LYS 191 CO 0.08 -0.23 0.34 1.49 -0.57 0.00 0.00 179.45 180.56 1nj6 h GLU 192 N -0.35 0.63 0.42 3.15 4.81 -1.12 0.51 114.58 122.62 1nj6 h GLU 192 Ca 0.02 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.20 1nj6 h GLU 192 Cb 0.36 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.57 1nj6 h GLU 192 CO -0.07 0.42 -0.37 0.35 -0.73 0.00 0.00 179.01 178.60 1nj6 h PHE 193 N 0.65 -1.00 -0.63 0.92 3.57 -0.18 -1.73 116.94 118.54 1nj6 h PHE 193 Ca 0.25 0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.77 1nj6 h PHE 193 Cb 0.10 0.38 -0.03 0.00 2.79 0.00 0.00 35.95 39.19 1nj6 h PHE 193 CO -0.07 -0.53 0.41 0.74 -2.23 0.00 0.00 178.31 176.62 1nj6 h PHE 194 N -0.79 0.77 -0.90 0.41 0.05 0.16 -1.81 116.94 114.81 1nj6 h PHE 194 Ca -0.04 0.02 0.10 0.00 3.82 0.00 0.00 57.97 61.88 1nj6 h PHE 194 Cb 0.70 -0.26 -0.07 0.00 2.00 0.00 0.00 35.95 38.32 1nj6 h PHE 194 CO -0.19 0.47 0.58 -0.91 -0.18 0.00 0.00 178.31 178.08 1nj6 h ASN 195 N 0.82 0.81 -0.08 2.17 -0.26 0.19 0.33 115.58 119.55 1nj6 h ASN 195 Ca 0.24 0.03 -0.03 0.00 -0.56 0.00 0.00 56.30 55.98 1nj6 h ASN 195 Cb -0.06 -0.14 -0.01 0.00 -1.06 0.00 0.00 38.32 37.05 1nj6 h ASN 195 CO -0.07 0.46 -0.01 0.28 -1.06 0.00 0.00 177.43 177.03 1nj6 h SER 196 N 0.88 0.24 -0.05 5.81 0.02 -0.45 0.82 113.55 120.83 1nj6 h SER 196 Ca 0.42 -0.03 0.00 0.00 -0.84 0.00 0.00 61.79 61.34 1nj6 h SER 196 Cb 0.44 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 62.92 1nj6 h SER 196 CO -0.19 0.30 0.00 0.18 -1.14 0.00 0.00 176.83 175.98 1nj6 n LEU 197 N -4.37 1.42 -1.79 5.07 4.77 0.93 -4.90 117.00 118.12 1nj6 n LEU 197 Ca -0.00 -0.51 -0.17 0.00 -0.03 0.00 0.00 56.01 55.30 1nj6 n LEU 197 Cb 0.19 -0.03 -0.03 0.00 -2.33 0.00 0.00 43.42 41.22 1nj6 n LEU 197 CO 0.37 0.25 -0.21 0.61 -1.33 0.00 0.00 177.39 177.08 1nj6 n GLY 198 N 1.15 0.20 3.67 -0.72 0.00 0.28 -4.83 105.19 104.94 1nj6 n GLY 198 Ca 0.19 -0.17 -0.37 0.00 0.00 0.00 0.00 46.02 45.66 1nj6 n GLY 198 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1nj6 s ILE 199 N -2.80 5.27 0.56 -0.61 1.01 -0.53 -4.38 121.20 119.73 1nj6 s ILE 199 Ca 0.00 0.47 -0.10 0.00 0.00 0.00 0.00 60.65 61.03 1nj6 s ILE 199 Cb 0.00 -3.63 -0.04 0.00 0.01 0.00 0.00 42.46 38.80 1nj6 s ILE 199 CO 0.00 0.30 0.94 -2.16 0.00 0.00 0.00 174.94 174.02 1nj6 s PRO 200 N 1.18 3.61 0.13 2.79 0.04 -1.26 -4.30 135.00 137.19 1nj6 s PRO 200 Ca 0.14 0.59 -0.24 0.00 0.04 0.00 0.00 61.00 61.53 1nj6 s PRO 200 Cb -0.14 -2.18 0.08 0.00 0.04 0.00 0.00 34.50 32.29 1nj6 s PRO 200 CO 0.06 -0.42 0.65 1.52 0.04 0.00 0.00 177.00 178.85 1nj6 s TYR 201 N -2.99 -0.50 -0.18 0.56 -0.85 -1.26 -4.62 117.35 107.51 1nj6 s TYR 201 Ca 0.53 0.31 0.01 0.00 -0.52 0.00 0.00 57.07 57.39 1nj6 s TYR 201 Cb -0.11 0.56 0.03 0.00 0.38 0.00 0.00 41.96 42.82 1nj6 s TYR 201 CO 0.49 -0.79 -0.15 -1.17 -1.52 0.00 0.00 175.55 172.41 1nj6 s LEU 202 N -2.70 2.11 -0.21 -3.49 2.96 -0.02 -4.94 118.68 112.39 1nj6 s LEU 202 Ca 0.02 -0.71 -0.13 0.00 -0.22 0.00 0.00 54.13 53.09 1nj6 s LEU 202 Cb -0.01 -1.32 -0.04 0.00 0.50 0.00 0.00 46.19 45.32 1nj6 s LEU 202 CO -0.12 -0.07 0.28 -0.63 -1.32 0.00 0.00 176.35 174.48 1nj6 s ILE 203 N 1.37 5.29 0.30 6.68 1.01 -1.26 -1.92 121.20 132.67 1nj6 s ILE 203 Ca 0.02 0.45 0.02 0.00 0.00 0.00 0.00 60.65 61.15 1nj6 s ILE 203 Cb -0.14 -3.61 -0.02 0.00 0.01 0.00 0.00 42.46 38.69 1nj6 s ILE 203 CO -0.10 0.32 0.30 0.42 0.00 0.00 0.00 174.94 175.87 1nj6 s THR 204 N 1.02 0.00 -0.33 2.92 -4.23 -0.81 -4.95 115.64 109.27 1nj6 s THR 204 Ca 0.14 -1.88 -0.06 0.00 -1.18 0.00 0.00 61.69 58.70 1nj6 s THR 204 Cb -0.14 -2.52 0.04 0.00 1.34 0.00 0.00 72.50 71.22 1nj6 s THR 204 CO 0.05 0.00 0.09 -0.60 -0.54 0.00 0.00 174.62 173.63 1nj6 s ARG 205 N -3.56 2.67 0.61 3.99 3.52 -0.40 -1.59 118.95 124.19 1nj6 s ARG 205 Ca 0.37 -1.14 -0.18 0.00 -0.13 0.00 0.00 55.73 54.65 1nj6 s ARG 205 Cb 0.03 -3.43 -0.05 0.00 -1.56 0.00 0.00 34.95 29.94 1nj6 s ARG 205 CO 0.21 -0.63 0.95 0.54 -0.81 0.00 0.00 175.30 175.57 1nj6 n ARG 206 N 4.81 0.87 -1.96 5.12 5.12 -0.57 -1.35 116.66 128.70 1nj6 n ARG 206 Ca -0.13 0.34 -0.38 0.00 -1.93 0.00 0.00 57.85 55.76 1nj6 n ARG 206 Cb 0.45 -2.16 0.02 0.00 -1.16 0.00 0.00 32.46 29.61 1nj6 n ARG 206 CO 0.00 0.00 0.00 -2.14 -1.93 0.00 0.00 177.63 173.56 1nj6 s PRO 207 N -2.77 3.31 0.00 5.56 0.02 -1.26 -4.68 135.00 135.19 1nj6 s PRO 207 Ca 0.76 2.04 0.00 0.00 0.02 0.00 0.00 61.00 63.82 1nj6 s PRO 207 Cb -0.41 -2.26 0.00 0.00 0.02 0.00 0.00 34.50 31.84 1nj6 s PRO 207 CO 0.47 -0.99 0.65 -0.35 -0.33 0.00 0.00 177.00 176.44 1nj6 n PRO 208 N -0.93 0.00 -0.05 5.54 -0.04 -1.26 -0.40 135.00 137.87 1nj6 n PRO 208 Ca 0.10 0.20 0.08 0.00 -0.04 0.00 0.00 63.50 63.84 1nj6 n PRO 208 Cb 0.47 -1.55 0.10 0.00 -0.04 0.00 0.00 33.50 32.47 1nj6 n PRO 208 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 1nj6 n TRP 209 N -1.15 0.12 0.13 0.54 2.14 -1.26 -4.26 117.44 113.70 1nj6 n TRP 209 Ca 0.00 -0.09 0.02 0.00 2.07 0.00 0.00 57.50 59.50 1nj6 n TRP 209 Cb 0.05 -0.00 -0.03 0.00 -0.81 0.00 0.00 31.31 30.52 1nj6 n TRP 209 CO 0.00 0.00 0.00 -0.25 2.07 0.00 0.00 177.69 179.51 1nj6 n ASP 210 N 0.93 1.42 -4.62 -0.67 8.00 0.47 -5.06 116.55 117.01 1nj6 n ASP 210 Ca 0.11 -0.41 -0.34 0.00 0.71 0.00 0.00 54.79 54.87 1nj6 n ASP 210 Cb 0.42 1.06 0.12 0.00 -0.02 0.00 0.00 41.12 42.71 1nj6 n ASP 210 CO 0.00 0.00 0.00 2.29 -0.39 0.00 0.00 177.20 179.10 1nj6 n LYS 211 N -1.27 0.10 -1.64 -1.24 2.85 -1.03 -4.85 118.16 111.07 1nj6 n LYS 211 Ca 0.00 0.10 -0.48 0.00 -1.05 0.00 0.00 58.31 56.89 1nj6 n LYS 211 Cb 0.08 -2.28 -0.05 0.00 -0.65 0.00 0.00 35.03 32.14 1nj6 n LYS 211 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 177.40 177.69 1nj6 n PHE 212 N -3.27 1.96 -1.46 5.58 7.35 -1.26 -4.72 117.46 121.64 1nj6 n PHE 212 Ca 0.12 0.43 -0.44 0.00 -0.76 0.00 0.00 57.45 56.80 1nj6 n PHE 212 Cb 0.51 -2.45 -0.12 0.00 0.35 0.00 0.00 39.48 37.77 1nj6 n PHE 212 CO 0.00 0.00 0.00 -2.30 -0.76 0.00 0.00 176.76 173.70 1nj6 n PRO 213 N 2.87 0.28 0.00 -7.13 -0.02 -1.26 -0.31 135.00 129.43 1nj6 n PRO 213 Ca 0.17 0.03 0.00 0.00 -2.02 0.00 0.00 63.50 61.67 1nj6 n PRO 213 Cb 0.26 -1.92 0.00 0.00 -0.02 0.00 0.00 33.50 31.82 1nj6 n PRO 213 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1nj6 n GLY 214 N 6.58 0.21 3.84 -1.23 0.00 -1.26 -4.18 105.19 109.15 1nj6 n GLY 214 Ca 0.57 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.30 1nj6 n GLY 214 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1nj6 s SER 215 N -1.97 3.80 -0.05 1.61 1.04 0.58 -4.83 113.70 113.87 1nj6 s SER 215 Ca 0.00 0.81 -0.21 0.00 0.48 0.00 0.00 55.95 57.03 1nj6 s SER 215 Cb 0.00 -1.29 -0.31 0.00 0.10 0.00 0.00 66.02 64.52 1nj6 s SER 215 CO 0.00 -2.35 0.85 -0.33 0.98 0.00 0.00 173.24 172.39 1nj6 h GLU 216 N -1.36 0.29 -2.53 4.02 4.39 -0.34 -3.47 114.58 115.58 1nj6 h GLU 216 Ca -0.48 -0.50 0.09 0.00 0.34 0.00 0.00 59.36 58.81 1nj6 h GLU 216 Cb 1.32 0.19 -0.12 0.00 -0.10 0.00 0.00 28.75 30.03 1nj6 h GLU 216 CO 0.61 1.24 0.40 1.52 -1.16 0.00 0.00 179.01 181.62 1nj6 s TYR 217 N -2.44 -0.34 -0.05 4.33 -0.85 -1.19 -5.02 117.35 111.79 1nj6 s TYR 217 Ca -0.14 0.13 0.03 0.00 -0.52 0.00 0.00 57.07 56.57 1nj6 s TYR 217 Cb 0.01 0.58 0.00 0.00 0.38 0.00 0.00 41.96 42.93 1nj6 s TYR 217 CO 0.82 -0.72 -0.13 0.99 -1.52 0.00 0.00 175.55 174.98 1nj6 s THR 218 N -3.37 1.17 -0.10 -3.49 2.01 -1.26 -1.76 115.64 108.84 1nj6 s THR 218 Ca 0.06 -0.55 -0.01 0.00 0.31 0.00 0.00 61.69 61.50 1nj6 s THR 218 Cb -0.01 -1.04 -0.03 0.00 0.01 0.00 0.00 72.50 71.43 1nj6 s THR 218 CO -0.07 0.35 -0.05 -0.69 -0.69 0.00 0.00 174.62 173.48 1nj6 s VAL 219 N 0.33 3.83 0.09 3.82 1.01 0.17 -1.50 120.40 128.14 1nj6 s VAL 219 Ca -0.08 -0.41 0.06 0.00 0.00 0.00 0.00 61.98 61.55 1nj6 s VAL 219 Cb -0.13 -2.61 -0.03 0.00 0.00 0.00 0.00 36.38 33.61 1nj6 s VAL 219 CO 0.02 0.56 -0.16 0.00 0.00 0.00 0.00 175.10 175.53 1nj6 s ALA 220 N -0.37 1.37 -0.14 5.51 0.00 -0.62 -0.69 121.76 126.83 1nj6 s ALA 220 Ca 0.06 -1.11 -0.03 0.00 0.00 0.00 0.00 51.96 50.87 1nj6 s ALA 220 Cb -0.12 -0.12 -0.03 0.00 0.00 0.00 0.00 23.12 22.84 1nj6 s ALA 220 CO 0.02 0.19 -0.03 -0.06 0.00 0.00 0.00 175.76 175.89 1nj6 s PHE 221 N -1.43 3.05 0.01 0.00 0.40 0.01 -1.92 117.98 118.11 1nj6 s PHE 221 Ca 0.02 -0.17 0.05 0.00 -0.60 0.00 0.00 56.93 56.23 1nj6 s PHE 221 Cb -0.09 -1.93 -0.02 0.00 0.51 0.00 0.00 43.02 41.50 1nj6 s PHE 221 CO 0.03 0.08 -0.16 -0.51 0.70 0.00 0.00 175.22 175.36 1nj6 s ASP 222 N 0.10 1.88 0.23 1.36 1.01 -0.81 -1.23 116.67 119.22 1nj6 s ASP 222 Ca 0.00 -0.37 0.06 0.00 0.71 0.00 0.00 52.55 52.94 1nj6 s ASP 222 Cb -0.13 -0.17 -0.05 0.00 1.01 0.00 0.00 42.92 43.57 1nj6 s ASP 222 CO 0.02 0.14 -0.08 0.28 0.21 0.00 0.00 175.17 175.75 1nj6 s THR 223 N -0.58 1.45 -0.19 -1.27 -1.32 -0.47 -0.84 115.64 112.41 1nj6 s THR 223 Ca 0.05 -2.12 -0.08 0.00 -1.21 0.00 0.00 61.69 58.33 1nj6 s THR 223 Cb -0.07 -2.22 -0.04 0.00 -1.51 0.00 0.00 72.50 68.66 1nj6 s THR 223 CO 0.00 -0.46 0.08 -0.22 -2.21 0.00 0.00 174.62 171.82 1nj6 s LEU 224 N -3.33 3.91 0.33 9.08 2.96 -1.26 -0.26 118.68 130.11 1nj6 s LEU 224 Ca 0.25 0.11 -0.07 0.00 -0.22 0.00 0.00 54.13 54.20 1nj6 s LEU 224 Cb 0.03 -2.00 -0.06 0.00 0.50 0.00 0.00 46.19 44.66 1nj6 s LEU 224 CO 0.08 0.16 0.63 -0.04 -1.32 0.00 0.00 176.35 175.87 1nj6 s MET 225 N 0.44 3.71 0.05 1.98 -1.94 0.11 -4.90 119.30 118.75 1nj6 s MET 225 Ca 0.05 0.21 0.02 0.00 -1.71 0.00 0.00 55.69 54.26 1nj6 s MET 225 Cb -0.12 -2.55 0.14 0.00 2.01 0.00 0.00 34.83 34.30 1nj6 s MET 225 CO 0.00 0.13 0.96 -2.30 -0.01 0.00 0.00 175.02 173.80 1nj6 n PRO 226 N -0.99 0.02 -0.92 2.03 -0.02 -1.26 -0.40 135.00 133.46 1nj6 n PRO 226 Ca 0.00 0.41 0.04 0.00 -2.02 0.00 0.00 63.50 61.92 1nj6 n PRO 226 Cb 0.54 -1.69 0.37 0.00 -0.02 0.00 0.00 33.50 32.70 1nj6 n PRO 226 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1nj6 n ASP 227 N -1.49 5.44 0.00 2.55 3.85 -1.26 -4.89 116.55 120.75 1nj6 n ASP 227 Ca -0.00 -2.98 0.00 0.00 -0.71 0.00 0.00 54.79 51.10 1nj6 n ASP 227 Cb 0.14 -0.70 0.00 0.00 -1.35 0.00 0.00 41.12 39.21 1nj6 n ASP 227 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1nj6 n GLY 228 N 0.43 0.59 3.90 6.12 0.00 0.47 -4.92 105.19 111.78 1nj6 n GLY 228 Ca 0.31 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.03 1nj6 n GLY 228 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nj6 s LYS 229 N -0.44 3.66 0.19 1.61 1.02 -1.24 -1.89 119.74 122.66 1nj6 s LYS 229 Ca 0.00 0.04 -0.07 0.00 0.02 0.00 0.00 55.97 55.96 1nj6 s LYS 229 Cb 0.00 -2.69 -0.06 0.00 -0.52 0.00 0.00 37.83 34.56 1nj6 s LYS 229 CO 0.00 0.29 0.46 -0.08 -0.92 0.00 0.00 175.35 175.10 1nj6 s THR 230 N -1.94 5.06 -0.09 2.17 -1.32 -0.08 0.06 115.64 119.49 1nj6 s THR 230 Ca 0.44 0.19 -0.02 0.00 -1.21 0.00 0.00 61.69 61.10 1nj6 s THR 230 Cb -0.11 -3.64 0.03 0.00 -1.51 0.00 0.00 72.50 67.28 1nj6 s THR 230 CO 0.27 -0.05 0.01 -0.22 -2.21 0.00 0.00 174.62 172.42 1nj6 s LEU 231 N -2.83 0.69 -0.12 9.08 2.96 0.64 -1.20 118.68 127.90 1nj6 s LEU 231 Ca 0.44 -0.22 -0.29 0.00 -0.22 0.00 0.00 54.13 53.83 1nj6 s LEU 231 Cb -0.12 -0.47 -0.04 0.00 0.50 0.00 0.00 46.19 46.06 1nj6 s LEU 231 CO 0.24 -0.21 1.65 -1.58 -1.32 0.00 0.00 176.35 175.12 1nj6 s GLN 232 N 1.95 4.02 -0.19 1.98 0.74 -1.26 -1.37 119.66 125.53 1nj6 s GLN 232 Ca 0.04 1.99 0.15 0.00 0.05 0.00 0.00 55.36 57.59 1nj6 s GLN 232 Cb -0.13 -4.01 0.39 0.00 1.10 0.00 0.00 33.01 30.36 1nj6 s GLN 232 CO -0.06 -1.03 1.25 0.44 -0.55 0.00 0.00 175.29 175.33 1nj6 n ILE 233 N 5.86 2.13 0.00 -2.34 -5.35 -0.36 -4.97 119.36 114.33 1nj6 n ILE 233 Ca 0.18 -2.64 0.00 0.00 -0.27 0.00 0.00 62.75 60.02 1nj6 n ILE 233 Cb 0.44 -0.25 0.00 0.00 -1.74 0.00 0.00 39.64 38.08 1nj6 n ILE 233 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1nj6 n GLY 234 N -1.18 3.27 3.02 3.28 0.00 -1.24 -4.77 105.19 107.57 1nj6 n GLY 234 Ca 0.20 -0.24 -0.11 0.00 0.00 0.00 0.00 46.02 45.87 1nj6 n GLY 234 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1nj6 s THR 235 N -1.24 0.06 -0.07 2.61 -4.23 -1.08 -0.81 115.64 110.88 1nj6 s THR 235 Ca 0.00 -0.53 0.02 0.00 -1.18 0.00 0.00 61.69 60.00 1nj6 s THR 235 Cb 0.00 -0.28 0.01 0.00 1.34 0.00 0.00 72.50 73.57 1nj6 s THR 235 CO 0.00 -0.29 -0.12 -0.69 -0.54 0.00 0.00 174.62 172.98 1nj6 s VAL 236 N -0.94 1.15 0.02 2.29 1.01 0.14 -1.48 120.40 122.59 1nj6 s VAL 236 Ca -0.10 -0.47 0.09 0.00 0.00 0.00 0.00 61.98 61.49 1nj6 s VAL 236 Cb -0.06 -1.07 -0.03 0.00 0.00 0.00 0.00 36.38 35.23 1nj6 s VAL 236 CO 0.00 0.36 -0.26 -1.00 0.00 0.00 0.00 175.10 174.21 1nj6 s HIS 237 N 0.81 2.27 -0.33 5.22 3.76 0.14 -0.65 115.29 126.51 1nj6 s HIS 237 Ca -0.12 -0.42 -0.08 0.00 -0.15 0.00 0.00 55.06 54.30 1nj6 s HIS 237 Cb -0.15 -1.40 0.02 0.00 1.11 0.00 0.00 32.58 32.16 1nj6 s HIS 237 CO 0.02 0.06 0.12 1.21 -0.85 0.00 0.00 174.74 175.31 1nj6 s ASN 238 N -1.00 5.37 0.00 1.40 3.84 -0.72 -1.57 114.94 122.25 1nj6 s ASN 238 Ca 0.11 -0.91 0.27 0.00 0.21 0.00 0.00 52.86 52.54 1nj6 s ASN 238 Cb -0.10 -1.92 0.96 0.00 -0.55 0.00 0.00 41.25 39.64 1nj6 s ASN 238 CO 0.01 -0.28 1.69 0.18 -2.79 0.00 0.00 177.10 175.90 1nj6 n LEU 239 N 4.89 1.29 0.00 3.21 4.77 0.08 0.37 117.00 131.61 1nj6 n LEU 239 Ca -0.13 -0.40 0.00 0.00 -0.03 0.00 0.00 56.01 55.45 1nj6 n LEU 239 Cb 0.46 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.51 1nj6 n LEU 239 CO 0.33 0.22 0.00 0.61 -1.33 0.00 0.00 177.39 177.22 1nj6 n GLY 240 N 1.23 2.81 0.47 -0.72 0.00 -1.09 -1.86 105.19 106.04 1nj6 n GLY 240 Ca 0.16 -0.11 0.05 0.00 0.00 0.00 0.00 46.02 46.13 1nj6 n GLY 240 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1nj6 n GLN 241 N 14.00 2.73 0.14 1.61 6.02 -1.26 -1.08 117.38 139.54 1nj6 n GLN 241 Ca 0.00 -2.15 -0.13 0.00 -0.01 0.00 0.00 57.00 54.70 1nj6 n GLN 241 Cb 0.00 -1.36 -0.06 0.00 1.02 0.00 0.00 30.24 29.84 1nj6 n GLN 241 CO 0.00 0.00 0.00 1.15 -1.01 0.00 0.00 177.06 177.20 1nj6 h THR 242 N 1.25 0.38 -0.15 5.09 2.02 -1.69 -1.72 112.91 118.08 1nj6 h THR 242 Ca 0.00 0.00 -0.13 0.00 0.77 0.00 0.00 66.41 67.05 1nj6 h THR 242 Cb 0.86 0.38 -0.01 0.00 -1.74 0.00 0.00 68.15 67.64 1nj6 h THR 242 CO 0.05 0.00 -0.45 -0.26 0.37 0.00 0.00 175.52 175.23 1nj6 h PHE 243 N -0.54 0.45 -0.12 3.16 -1.00 -1.85 -2.64 116.94 114.41 1nj6 h PHE 243 Ca 0.02 -0.14 0.04 0.00 2.81 0.00 0.00 57.97 60.70 1nj6 h PHE 243 Cb 0.54 -0.10 -0.05 0.00 3.61 0.00 0.00 35.95 39.95 1nj6 h PHE 243 CO -0.24 0.76 -0.19 0.00 -1.61 0.00 0.00 178.31 177.04 1nj6 h ALA 244 N 1.21 -0.13 -0.69 2.45 0.00 -1.76 -0.17 119.26 120.18 1nj6 h ALA 244 Ca 0.02 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 1nj6 h ALA 244 Cb 0.92 0.37 -0.03 0.00 0.00 0.00 0.00 17.79 19.05 1nj6 h ALA 244 CO 0.08 -0.64 0.26 0.00 0.00 0.00 0.00 179.25 178.94 1nj6 h ARG 245 N -0.24 1.03 -0.73 0.00 3.08 -1.25 0.28 114.38 116.55 1nj6 h ARG 245 Ca 0.10 -0.18 -0.02 0.00 0.07 0.00 0.00 59.98 59.94 1nj6 h ARG 245 Cb 0.38 -0.17 -0.03 0.00 0.08 0.00 0.00 29.97 30.23 1nj6 h ARG 245 CO -0.26 0.85 0.38 1.15 -1.07 0.00 0.00 179.97 181.02 1nj6 h THR 246 N 1.00 1.23 -0.53 2.04 2.02 -0.94 -3.10 112.91 114.63 1nj6 h THR 246 Ca 0.23 -0.59 0.00 0.00 0.77 0.00 0.00 66.41 66.82 1nj6 h THR 246 Cb 0.22 0.29 0.00 0.00 -1.74 0.00 0.00 68.15 66.92 1nj6 h THR 246 CO -0.02 0.26 0.00 0.49 0.37 0.00 0.00 175.52 176.62 1nj6 n PHE 247 N -4.45 0.71 -3.39 3.16 3.72 -0.16 -5.00 117.46 112.05 1nj6 n PHE 247 Ca 0.06 -0.49 -0.19 0.00 -0.05 0.00 0.00 57.45 56.78 1nj6 n PHE 247 Cb 0.11 -0.01 0.06 0.00 -0.94 0.00 0.00 39.48 38.70 1nj6 n PHE 247 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 1nj6 n GLU 248 N 1.09 -2.47 -3.43 -1.08 -0.58 0.82 -4.74 120.64 110.25 1nj6 n GLU 248 Ca 0.18 0.76 -0.43 0.00 -0.42 0.00 0.00 57.16 57.24 1nj6 n GLU 248 Cb 0.52 -5.40 -0.03 0.00 -0.57 0.00 0.00 31.44 25.97 1nj6 n GLU 248 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 1nj6 s ILE 249 N -3.42 5.25 0.30 -3.67 1.01 -0.30 -4.74 121.20 115.63 1nj6 s ILE 249 Ca 0.41 -2.97 0.07 0.00 0.00 0.00 0.00 60.65 58.16 1nj6 s ILE 249 Cb -0.08 -4.24 -0.03 0.00 0.01 0.00 0.00 42.46 38.12 1nj6 s ILE 249 CO 0.77 -1.05 0.30 -0.54 0.00 0.00 0.00 174.94 174.42 1nj6 s LYS 250 N -0.42 2.92 -0.00 2.79 1.02 -1.26 -2.21 119.74 122.58 1nj6 s LYS 250 Ca 0.22 -1.12 -0.07 0.00 0.02 0.00 0.00 55.97 55.02 1nj6 s LYS 250 Cb -0.11 -2.60 0.00 0.00 -0.52 0.00 0.00 37.83 34.60 1nj6 s LYS 250 CO -0.08 0.22 0.14 -0.59 -0.92 0.00 0.00 175.35 174.11 1nj6 s PHE 251 N -2.20 0.02 -0.14 3.18 -0.12 -0.42 -4.40 117.98 113.89 1nj6 s PHE 251 Ca 0.38 -0.07 -0.25 0.00 -0.05 0.00 0.00 56.93 56.94 1nj6 s PHE 251 Cb -0.07 -0.04 -0.02 0.00 -0.63 0.00 0.00 43.02 42.26 1nj6 s PHE 251 CO 0.27 -0.26 0.83 -2.00 -0.05 0.00 0.00 175.22 174.00 1nj6 s GLU 252 N -1.21 4.34 0.60 1.99 2.12 0.13 -2.59 118.70 124.08 1nj6 s GLU 252 Ca -0.13 1.03 -0.10 0.00 0.36 0.00 0.00 54.97 56.13 1nj6 s GLU 252 Cb -0.07 -3.55 -0.04 0.00 0.26 0.00 0.00 34.13 30.73 1nj6 s GLU 252 CO 0.01 -0.25 0.99 0.95 -0.54 0.00 0.00 175.26 176.43 1nj6 s THR 253 N 1.87 4.74 -0.13 -1.70 -4.23 -0.39 -1.81 115.64 113.99 1nj6 s THR 253 Ca 0.39 0.78 0.20 0.00 -1.18 0.00 0.00 61.69 61.88 1nj6 s THR 253 Cb -0.17 -3.87 0.20 0.00 1.34 0.00 0.00 72.50 70.00 1nj6 s THR 253 CO 0.14 -1.10 1.57 -0.81 -0.54 0.00 0.00 174.62 173.88 1nj6 n PRO 254 N -2.67 0.13 0.00 3.99 -0.04 -1.26 -0.55 135.00 134.60 1nj6 n PRO 254 Ca 0.05 0.62 -0.08 0.00 -0.04 0.00 0.00 63.50 64.06 1nj6 n PRO 254 Cb 0.54 -2.00 -0.13 0.00 -0.04 0.00 0.00 33.50 31.86 1nj6 n PRO 254 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1nj6 h GLU 255 N 0.00 0.00 0.00 0.54 3.07 -2.03 -3.48 114.58 112.68 1nj6 h GLU 255 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1nj6 h GLU 255 Cb 0.17 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.08 1nj6 h GLU 255 CO 0.00 0.62 0.00 0.41 -1.40 0.00 0.00 179.01 178.64 1nj6 n GLY 256 N 1.50 1.66 3.97 -3.84 0.00 0.29 -5.13 105.19 103.63 1nj6 n GLY 256 Ca -0.12 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.67 1nj6 n GLY 256 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1nj6 s ASP 257 N -2.00 4.93 -0.37 1.61 1.01 -1.26 -4.81 116.67 115.79 1nj6 s ASP 257 Ca 0.00 -0.01 0.01 0.00 0.71 0.00 0.00 52.55 53.25 1nj6 s ASP 257 Cb 0.00 -0.69 0.12 0.00 1.01 0.00 0.00 42.92 43.36 1nj6 s ASP 257 CO 0.00 -1.43 0.16 -1.00 0.21 0.00 0.00 175.17 173.12 1nj6 s HIS 258 N -2.96 1.87 0.22 4.23 3.76 -1.26 -1.27 115.29 119.88 1nj6 s HIS 258 Ca 0.60 -2.09 0.06 0.00 -0.15 0.00 0.00 55.06 53.49 1nj6 s HIS 258 Cb -0.09 -1.80 -0.04 0.00 1.11 0.00 0.00 32.58 31.76 1nj6 s HIS 258 CO 0.41 -0.84 0.16 -1.21 -0.85 0.00 0.00 174.74 172.42 1nj6 s GLU 259 N 1.01 2.88 0.40 1.40 2.02 -1.07 -4.85 118.70 120.49 1nj6 s GLU 259 Ca 0.14 -1.01 -0.23 0.00 0.02 0.00 0.00 54.97 53.89 1nj6 s GLU 259 Cb -0.21 -2.57 -0.10 0.00 0.10 0.00 0.00 34.13 31.35 1nj6 s GLU 259 CO -0.12 0.43 0.98 0.71 0.02 0.00 0.00 175.26 177.28 1nj6 s TYR 260 N -2.00 3.38 0.69 1.61 1.51 -1.26 -1.31 117.35 119.97 1nj6 s TYR 260 Ca 0.32 1.67 -0.11 0.00 -1.01 0.00 0.00 57.07 57.93 1nj6 s TYR 260 Cb -0.09 -2.95 0.00 0.00 -0.11 0.00 0.00 41.96 38.81 1nj6 s TYR 260 CO 0.24 -0.20 1.07 0.14 -1.11 0.00 0.00 175.55 175.69 1nj6 s VAL 261 N -1.88 3.98 -0.23 0.71 -7.23 -0.94 -4.91 120.40 109.90 1nj6 s VAL 261 Ca 0.58 0.64 -0.06 0.00 -1.81 0.00 0.00 61.98 61.33 1nj6 s VAL 261 Cb -0.15 -3.55 -0.02 0.00 0.56 0.00 0.00 36.38 33.21 1nj6 s VAL 261 CO 0.20 -0.84 0.04 -1.00 -0.31 0.00 0.00 175.10 173.19 1nj6 s HIS 262 N -3.20 3.06 0.23 2.82 3.76 -0.09 -4.32 115.29 117.54 1nj6 s HIS 262 Ca 0.57 -0.50 0.09 0.00 -0.15 0.00 0.00 55.06 55.08 1nj6 s HIS 262 Cb -0.12 -2.18 -0.04 0.00 1.11 0.00 0.00 32.58 31.34 1nj6 s HIS 262 CO 0.54 -0.35 -0.06 -0.65 -0.85 0.00 0.00 174.74 173.37 1nj6 s GLN 263 N 1.44 2.16 0.04 1.40 -0.21 -0.24 0.25 119.66 124.50 1nj6 s GLN 263 Ca 0.05 -1.37 -0.10 0.00 0.02 0.00 0.00 55.36 53.97 1nj6 s GLN 263 Cb -0.15 -2.14 0.01 0.00 1.00 0.00 0.00 33.01 31.73 1nj6 s GLN 263 CO 0.02 0.40 0.21 0.95 -2.12 0.00 0.00 175.29 174.74 1nj6 s THR 264 N -2.05 0.11 -0.03 -0.19 -4.23 -1.10 -0.74 115.64 107.41 1nj6 s THR 264 Ca 0.28 -0.87 -0.18 0.00 -1.18 0.00 0.00 61.69 59.74 1nj6 s THR 264 Cb -0.07 -0.91 0.03 0.00 1.34 0.00 0.00 72.50 72.89 1nj6 s THR 264 CO 0.17 -0.48 0.39 0.00 -0.54 0.00 0.00 174.62 174.17 1nj6 s TYR 266 N -1.25 -0.05 0.11 0.00 -0.85 -0.53 0.27 117.35 115.05 1nj6 s TYR 266 Ca -0.13 -0.17 -0.25 0.00 -0.52 0.00 0.00 57.07 56.01 1nj6 s TYR 266 Cb -0.04 0.07 0.08 0.00 0.38 0.00 0.00 41.96 42.45 1nj6 s TYR 266 CO 0.05 -0.53 0.72 0.20 -1.52 0.00 0.00 175.55 174.48 1nj6 s GLY 267 N -2.31 -0.51 0.32 5.49 0.00 -0.55 -0.38 107.32 109.38 1nj6 s GLY 267 Ca -0.02 0.59 0.03 0.00 0.00 0.00 0.00 44.72 45.32 1nj6 s GLY 267 CO -0.06 0.19 0.08 1.08 0.00 0.00 0.00 173.10 174.39 1nj6 s LEU 268 N -2.68 2.02 0.00 0.66 1.43 -0.81 -2.65 118.68 116.65 1nj6 s LEU 268 Ca 0.04 -1.42 0.00 0.00 -1.03 0.00 0.00 54.13 51.71 1nj6 s LEU 268 Cb -0.01 -0.24 0.00 0.00 0.03 0.00 0.00 46.19 45.97 1nj6 s LEU 268 CO -0.10 -0.69 0.00 -1.54 0.23 0.00 0.00 176.35 174.26 1nj6 n SER 269 N -0.73 0.00 0.32 2.29 3.41 -1.26 -1.88 113.62 115.78 1nj6 n SER 269 Ca -0.02 -0.50 0.22 0.00 -0.26 0.00 0.00 58.87 58.31 1nj6 n SER 269 Cb 0.66 0.00 1.16 0.00 -0.26 0.00 0.00 64.21 65.77 1nj6 n SER 269 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1nj6 h ASP 270 N 0.00 0.00 -0.89 4.04 3.32 -1.80 -1.88 116.42 119.21 1nj6 h ASP 270 Ca 0.00 0.00 0.20 0.00 0.02 0.00 0.00 57.03 57.25 1nj6 h ASP 270 Cb 0.00 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 39.48 1nj6 h ASP 270 CO 0.00 0.00 0.59 0.03 -1.72 0.00 0.00 179.24 178.14 1nj6 h ARG 271 N 0.00 0.41 -0.96 3.56 3.08 -1.82 0.48 114.38 119.14 1nj6 h ARG 271 Ca 0.00 -0.02 0.06 0.00 0.07 0.00 0.00 59.98 60.08 1nj6 h ARG 271 Cb 0.01 -0.09 -0.06 0.00 0.08 0.00 0.00 29.97 29.91 1nj6 h ARG 271 CO 0.00 0.27 0.62 0.28 -1.07 0.00 0.00 179.97 180.08 1nj6 h VAL 272 N 0.42 1.10 -0.00 2.04 2.07 -1.64 0.90 116.25 121.14 1nj6 h VAL 272 Ca 0.46 -0.39 -0.15 0.00 0.82 0.00 0.00 66.70 67.44 1nj6 h VAL 272 Cb 1.12 -0.13 -0.02 0.00 -1.52 0.00 0.00 31.29 30.73 1nj6 h VAL 272 CO -0.18 0.21 -0.72 0.40 0.02 0.00 0.00 177.57 177.30 1nj6 h ILE 273 N 1.14 1.51 -0.01 4.57 2.04 -0.26 -2.33 117.51 124.17 1nj6 h ILE 273 Ca 0.40 -2.44 -0.00 0.00 1.00 0.00 0.00 64.86 63.83 1nj6 h ILE 273 Cb 0.13 2.31 -0.00 0.00 -0.74 0.00 0.00 36.82 38.53 1nj6 h ILE 273 CO -0.15 0.70 0.00 0.00 0.00 0.00 0.00 178.15 178.70 1nj6 h ALA 274 N 1.26 0.02 -0.35 1.87 0.00 -0.33 -2.26 119.26 119.47 1nj6 h ALA 274 Ca -0.01 -0.11 0.07 0.00 0.00 0.00 0.00 54.91 54.86 1nj6 h ALA 274 Cb 1.27 -0.01 -0.07 0.00 0.00 0.00 0.00 17.79 18.98 1nj6 h ALA 274 CO 0.10 -0.37 -0.12 0.77 0.00 0.00 0.00 179.25 179.62 1nj6 h SER 275 N -0.19 -0.43 -0.78 0.00 0.02 -0.74 0.53 113.55 111.96 1nj6 h SER 275 Ca 0.00 0.12 0.02 0.00 -0.84 0.00 0.00 61.79 61.09 1nj6 h SER 275 Cb 0.22 0.26 -0.04 0.00 0.14 0.00 0.00 62.40 62.98 1nj6 h SER 275 CO -0.00 -0.16 0.50 0.58 -1.14 0.00 0.00 176.83 176.62 1nj6 h VAL 276 N -0.05 1.15 0.42 2.27 2.07 -1.37 0.79 116.25 121.53 1nj6 h VAL 276 Ca 0.17 -0.34 -0.02 0.00 0.82 0.00 0.00 66.70 67.33 1nj6 h VAL 276 Cb 0.31 0.06 0.00 0.00 -1.52 0.00 0.00 31.29 30.15 1nj6 h VAL 276 CO -0.39 0.18 -0.20 0.40 0.02 0.00 0.00 177.57 177.58 1nj6 h ILE 277 N 1.00 0.53 0.27 4.57 2.04 -0.67 -3.12 117.51 122.12 1nj6 h ILE 277 Ca 0.30 -0.43 -0.01 0.00 1.00 0.00 0.00 64.86 65.71 1nj6 h ILE 277 Cb -0.05 0.72 0.00 0.00 -0.74 0.00 0.00 36.82 36.75 1nj6 h ILE 277 CO -0.09 0.07 -0.13 0.00 0.00 0.00 0.00 178.15 178.00 1nj6 h ALA 278 N -0.41 -0.36 -0.56 1.87 0.00 0.35 -2.07 119.26 118.09 1nj6 h ALA 278 Ca -0.06 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1nj6 h ALA 278 Cb 0.55 0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.45 1nj6 h ALA 278 CO 0.09 -0.69 0.35 0.82 0.00 0.00 0.00 179.25 179.83 1nj6 h ILE 279 N -0.38 1.16 -0.50 0.00 2.04 0.48 -1.59 117.51 118.72 1nj6 h ILE 279 Ca -0.04 -0.33 0.00 0.00 1.00 0.00 0.00 64.86 65.49 1nj6 h ILE 279 Cb 0.29 0.37 0.00 0.00 -0.74 0.00 0.00 36.82 36.74 1nj6 h ILE 279 CO 0.06 0.16 0.00 1.41 0.00 0.00 0.00 178.15 179.78 1nj6 n HIS 280 N -4.67 1.61 -0.47 1.37 8.25 -1.18 -4.95 115.22 115.18 1nj6 n HIS 280 Ca 0.03 -0.58 -0.14 0.00 -0.26 0.00 0.00 57.72 56.78 1nj6 n HIS 280 Cb 0.04 -0.38 0.14 0.00 1.12 0.00 0.00 29.99 30.90 1nj6 n HIS 280 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1nj6 n GLY 281 N 0.65 -1.90 3.61 -1.41 0.00 -0.60 -3.81 105.19 101.74 1nj6 n GLY 281 Ca 0.23 -0.61 -0.00 0.00 0.00 0.00 0.00 46.02 45.63 1nj6 n GLY 281 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1nj6 s ASP 282 N -1.98 -0.08 0.32 1.61 2.15 -1.05 -4.79 116.67 112.85 1nj6 s ASP 282 Ca 0.31 -0.08 0.16 0.00 0.43 0.00 0.00 52.55 53.37 1nj6 s ASP 282 Cb -0.05 0.14 0.44 0.00 -0.30 0.00 0.00 42.92 43.15 1nj6 s ASP 282 CO 0.26 -0.25 1.62 -0.33 -0.17 0.00 0.00 175.17 176.30 1nj6 h GLU 283 N 2.00 0.00 0.00 4.34 5.08 -1.99 -2.98 114.58 121.03 1nj6 h GLU 283 Ca -0.22 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.14 1nj6 h GLU 283 Cb 1.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.44 1nj6 h GLU 283 CO 0.26 0.48 -0.32 0.77 -1.00 0.00 0.00 179.01 179.20 1nj6 h SER 284 N 0.00 0.00 0.00 1.42 0.02 -1.95 -3.50 113.55 109.54 1nj6 h SER 284 Ca -0.00 -0.06 0.00 0.00 -0.84 0.00 0.00 61.79 60.88 1nj6 h SER 284 Cb 1.10 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.64 1nj6 h SER 284 CO 0.06 0.03 0.00 0.61 -1.14 0.00 0.00 176.83 176.39 1nj6 n GLY 285 N 1.25 0.48 3.84 -3.77 0.00 -1.13 -3.95 105.19 101.92 1nj6 n GLY 285 Ca 0.04 -1.12 -0.34 0.00 0.00 0.00 0.00 46.02 44.60 1nj6 n GLY 285 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1nj6 s LEU 286 N 0.00 4.20 -0.18 0.99 1.43 -0.45 -2.52 118.68 122.14 1nj6 s LEU 286 Ca 0.00 1.28 -0.04 0.00 -1.03 0.00 0.00 54.13 54.33 1nj6 s LEU 286 Cb 0.00 -3.79 0.07 0.00 0.03 0.00 0.00 46.19 42.50 1nj6 s LEU 286 CO 0.00 -0.08 0.15 0.00 0.23 0.00 0.00 176.35 176.65 1nj6 s LEU 288 N 2.23 2.43 0.32 0.00 1.43 -1.24 -4.61 118.68 119.24 1nj6 s LEU 288 Ca 0.04 -0.86 -0.29 0.00 -1.03 0.00 0.00 54.13 51.99 1nj6 s LEU 288 Cb -0.16 -1.10 -0.11 0.00 0.03 0.00 0.00 46.19 44.85 1nj6 s LEU 288 CO -0.10 0.09 1.57 -2.65 0.23 0.00 0.00 176.35 175.49 1nj6 n PRO 289 N 0.29 2.72 -0.33 1.29 -0.02 -1.26 -4.70 135.00 132.98 1nj6 n PRO 289 Ca -0.13 0.96 0.27 0.00 -2.02 0.00 0.00 63.50 62.58 1nj6 n PRO 289 Cb 0.56 -2.73 0.52 0.00 -0.02 0.00 0.00 33.50 31.83 1nj6 n PRO 289 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1nj6 h PRO 290 N 4.24 0.20 0.00 0.52 0.11 -1.94 0.21 132.00 135.34 1nj6 h PRO 290 Ca -0.48 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1nj6 h PRO 290 Cb 1.23 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1nj6 h PRO 290 CO 0.75 0.13 0.00 -0.25 -0.21 0.00 0.00 178.00 178.42 1nj6 n ASP 291 N -5.13 0.00 -0.02 -2.05 8.00 -1.26 -3.43 116.55 112.66 1nj6 n ASP 291 Ca 0.34 -1.56 -0.02 0.00 0.71 0.00 0.00 54.79 54.25 1nj6 n ASP 291 Cb 1.10 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 42.17 1nj6 n ASP 291 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1nj6 n VAL 292 N -0.67 0.30 -1.67 2.53 0.31 0.71 -4.63 118.33 115.21 1nj6 n VAL 292 Ca 0.08 -0.18 -0.38 0.00 -0.01 0.00 0.00 64.34 63.85 1nj6 n VAL 292 Cb 0.04 -0.85 0.05 0.00 -0.91 0.00 0.00 33.84 32.16 1nj6 n VAL 292 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1nj6 n ALA 293 N -2.24 0.70 0.24 3.52 0.00 -1.07 -4.47 120.51 117.19 1nj6 n ALA 293 Ca -0.08 0.04 0.07 0.00 0.00 0.00 0.00 53.44 53.48 1nj6 n ALA 293 Cb 0.64 -2.21 0.58 0.00 0.00 0.00 0.00 19.45 18.46 1nj6 n ALA 293 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1nj6 h ALA 294 N 0.75 1.85 -3.71 0.00 0.00 -1.89 -3.41 119.26 112.84 1nj6 h ALA 294 Ca -0.49 -0.08 -0.24 0.00 0.00 0.00 0.00 54.91 54.10 1nj6 h ALA 294 Cb 1.34 -0.01 -0.28 0.00 0.00 0.00 0.00 17.79 18.84 1nj6 h ALA 294 CO 0.53 0.11 -0.72 -1.01 0.00 0.00 0.00 179.25 178.15 1nj6 s HIS 295 N -4.86 0.06 -0.09 0.00 0.09 -1.26 -4.94 115.29 104.29 1nj6 s HIS 295 Ca -0.04 -0.03 0.09 0.00 -0.00 0.00 0.00 55.06 55.07 1nj6 s HIS 295 Cb 0.16 -0.04 -0.24 0.00 -0.00 0.00 0.00 32.58 32.47 1nj6 s HIS 295 CO 0.68 -0.01 0.48 1.04 -0.00 0.00 0.00 174.74 176.93 1nj6 n GLN 296 N 3.00 0.67 -3.73 1.40 6.02 0.11 -4.15 117.38 120.70 1nj6 n GLN 296 Ca -0.13 0.24 -0.20 0.00 -0.01 0.00 0.00 57.00 56.90 1nj6 n GLN 296 Cb 0.60 -1.73 -0.18 0.00 1.02 0.00 0.00 30.24 29.96 1nj6 n GLN 296 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1nj6 s VAL 297 N -2.57 0.06 -0.25 5.09 1.01 -1.18 -2.18 120.40 120.38 1nj6 s VAL 297 Ca -0.11 0.29 -0.04 0.00 0.00 0.00 0.00 61.98 62.12 1nj6 s VAL 297 Cb 0.07 -0.26 0.00 0.00 0.00 0.00 0.00 36.38 36.19 1nj6 s VAL 297 CO 0.80 0.19 -0.01 0.54 0.00 0.00 0.00 175.10 176.63 1nj6 s VAL 298 N 1.91 3.49 -0.25 2.92 0.11 -0.52 -1.25 120.40 126.82 1nj6 s VAL 298 Ca 0.02 -0.62 -0.21 0.00 -2.93 0.00 0.00 61.98 58.25 1nj6 s VAL 298 Cb -0.12 -2.68 -0.02 0.00 -1.53 0.00 0.00 36.38 32.03 1nj6 s VAL 298 CO -0.03 0.29 0.66 -0.63 -3.33 0.00 0.00 175.10 172.06 1nj6 s ILE 299 N 1.47 4.97 -0.31 7.04 1.01 -0.14 -1.43 121.20 133.80 1nj6 s ILE 299 Ca 0.04 1.20 -0.01 0.00 0.00 0.00 0.00 60.65 61.88 1nj6 s ILE 299 Cb -0.15 -3.96 0.06 0.00 0.01 0.00 0.00 42.46 38.42 1nj6 s ILE 299 CO -0.02 0.02 0.02 -0.69 0.00 0.00 0.00 174.94 174.27 1nj6 s VAL 300 N 2.51 2.89 0.10 2.92 1.01 0.59 -1.13 120.40 129.28 1nj6 s VAL 300 Ca 0.28 -1.58 -0.30 0.00 0.00 0.00 0.00 61.98 60.38 1nj6 s VAL 300 Cb -0.15 -2.74 -0.06 0.00 0.00 0.00 0.00 36.38 33.43 1nj6 s VAL 300 CO 0.08 -0.22 0.98 -2.16 0.00 0.00 0.00 175.10 173.78 1nj6 s PRO 301 N 1.19 4.67 -0.28 2.72 0.04 -1.26 -2.78 135.00 139.30 1nj6 s PRO 301 Ca -0.03 1.47 -0.11 0.00 0.04 0.00 0.00 61.00 62.37 1nj6 s PRO 301 Cb -0.20 -3.38 -0.05 0.00 0.04 0.00 0.00 34.50 30.91 1nj6 s PRO 301 CO -0.02 0.17 0.21 0.42 0.04 0.00 0.00 177.00 177.81 1nj6 s ILE 302 N 0.11 5.29 -0.05 0.56 -1.09 0.98 -4.92 121.20 122.09 1nj6 s ILE 302 Ca 0.48 0.19 -0.05 0.00 -2.23 0.00 0.00 60.65 59.05 1nj6 s ILE 302 Cb -0.24 -3.56 0.01 0.00 -1.58 0.00 0.00 42.46 37.10 1nj6 s ILE 302 CO 0.30 0.23 0.13 -0.63 -1.23 0.00 0.00 174.94 173.74 1nj6 s ILE 303 N 1.79 0.00 -0.12 2.92 1.01 -1.26 -4.37 121.20 121.17 1nj6 s ILE 303 Ca 0.08 -0.03 0.22 0.00 0.00 0.00 0.00 60.65 60.91 1nj6 s ILE 303 Cb -0.16 -0.20 0.45 0.00 0.01 0.00 0.00 42.46 42.56 1nj6 s ILE 303 CO 0.11 -0.02 1.16 0.49 0.00 0.00 0.00 174.94 176.68 1nj6 n PHE 304 N 2.94 0.55 -2.66 3.97 3.01 -1.26 -4.98 117.46 119.03 1nj6 n PHE 304 Ca -0.13 -1.22 -0.09 0.00 1.01 0.00 0.00 57.45 57.02 1nj6 n PHE 304 Cb 0.59 -0.20 0.05 0.00 -0.01 0.00 0.00 39.48 39.90 1nj6 n PHE 304 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 1nj6 n LYS 305 N -0.13 -2.64 -3.14 -1.08 5.02 -1.26 -5.02 118.16 109.91 1nj6 n LYS 305 Ca 0.11 0.48 -0.08 0.00 -2.02 0.00 0.00 58.31 56.80 1nj6 n LYS 305 Cb 0.97 -4.19 -0.03 0.00 -0.02 0.00 0.00 35.03 31.76 1nj6 n LYS 305 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1nj6 s LYS 306 N -4.33 0.86 -0.07 1.97 1.02 -1.26 -4.86 119.74 113.06 1nj6 s LYS 306 Ca 0.11 -0.84 0.00 0.00 0.02 0.00 0.00 55.97 55.26 1nj6 s LYS 306 Cb -0.01 -0.32 0.00 0.00 -0.52 0.00 0.00 37.83 36.98 1nj6 s LYS 306 CO 0.41 -1.25 0.00 0.00 -0.92 0.00 0.00 175.35 173.59 1nj6 n ALA 307 N 3.79 -0.01 -0.12 5.17 0.00 -1.26 -4.76 120.51 123.32 1nj6 n ALA 307 Ca 0.15 0.01 -0.13 0.00 0.00 0.00 0.00 53.44 53.48 1nj6 n ALA 307 Cb 0.53 -0.55 -0.08 0.00 0.00 0.00 0.00 19.45 19.34 1nj6 n ALA 307 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1nj6 h ALA 308 N 0.00 -0.67 -1.27 0.00 0.00 -1.96 0.32 119.26 115.68 1nj6 h ALA 308 Ca -0.01 0.02 0.37 0.00 0.00 0.00 0.00 54.91 55.28 1nj6 h ALA 308 Cb 0.05 1.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.81 1nj6 h ALA 308 CO 0.02 -0.99 0.99 0.93 0.00 0.00 0.00 179.25 180.20 1nj6 h GLU 309 N -0.40 0.00 0.07 0.00 5.08 -2.00 0.38 114.58 117.71 1nj6 h GLU 309 Ca 0.09 0.00 -0.31 0.00 -1.00 0.00 0.00 59.36 58.14 1nj6 h GLU 309 Cb 0.61 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.83 1nj6 h GLU 309 CO -0.57 0.00 -1.72 0.93 -1.00 0.00 0.00 179.01 176.65 1nj6 h GLU 310 N 0.00 0.14 0.08 2.33 5.08 -0.86 -3.16 114.58 118.19 1nj6 h GLU 310 Ca 0.60 -0.24 -0.00 0.00 -1.00 0.00 0.00 59.36 58.72 1nj6 h GLU 310 Cb 2.57 0.09 0.00 0.00 0.50 0.00 0.00 28.75 31.91 1nj6 h GLU 310 CO -0.01 0.89 -0.04 0.28 -1.00 0.00 0.00 179.01 179.13 1nj6 h VAL 311 N 0.04 1.12 0.15 3.13 2.07 0.16 -2.63 116.25 120.29 1nj6 h VAL 311 Ca -0.31 -0.71 0.01 0.00 0.82 0.00 0.00 66.70 66.51 1nj6 h VAL 311 Cb 2.01 1.58 -0.03 0.00 -1.52 0.00 0.00 31.29 33.32 1nj6 h VAL 311 CO 0.11 0.17 -0.41 0.24 0.02 0.00 0.00 177.57 177.70 1nj6 h MET 312 N -0.43 -0.60 0.00 1.57 2.86 -1.03 -0.24 114.93 117.06 1nj6 h MET 312 Ca -0.01 0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.67 1nj6 h MET 312 Cb 0.37 0.14 0.00 0.00 0.06 0.00 0.00 31.60 32.16 1nj6 h MET 312 CO 0.02 -0.40 0.18 0.93 1.06 0.00 0.00 176.91 178.70 1nj6 h GLU 313 N -0.62 0.00 0.21 1.72 5.08 -1.62 0.44 114.58 119.80 1nj6 h GLU 313 Ca -0.01 0.00 -0.32 0.00 -1.00 0.00 0.00 59.36 58.03 1nj6 h GLU 313 Cb 0.60 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.88 1nj6 h GLU 313 CO -0.19 0.00 -1.42 0.00 -1.00 0.00 0.00 179.01 176.40 1nj6 h ALA 314 N 1.54 -0.07 0.11 3.43 0.00 -0.68 -2.91 119.26 120.69 1nj6 h ALA 314 Ca 0.00 -0.88 -0.01 0.00 0.00 0.00 0.00 54.91 54.02 1nj6 h ALA 314 Cb 0.37 0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1nj6 h ALA 314 CO 0.00 0.80 -0.05 0.00 0.00 0.00 0.00 179.25 180.00 1nj6 h ARG 316 N -0.71 -0.25 -0.89 0.00 3.08 -1.25 0.29 114.38 114.65 1nj6 h ARG 316 Ca -0.02 0.02 0.16 0.00 0.07 0.00 0.00 59.98 60.21 1nj6 h ARG 316 Cb 0.54 0.06 -0.10 0.00 0.08 0.00 0.00 29.97 30.55 1nj6 h ARG 316 CO 0.02 -0.17 0.48 1.49 -1.07 0.00 0.00 179.97 180.73 1nj6 h GLU 317 N -0.26 0.64 -0.07 0.04 4.22 -1.57 -1.30 114.58 116.28 1nj6 h GLU 317 Ca 0.16 -0.04 -0.01 0.00 0.08 0.00 0.00 59.36 59.55 1nj6 h GLU 317 Cb 0.51 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.61 1nj6 h GLU 317 CO -0.47 0.42 0.02 1.25 -2.18 0.00 0.00 179.01 178.05 1nj6 h LEU 318 N 0.66 0.11 0.24 1.64 5.85 -0.20 -1.52 115.31 122.09 1nj6 h LEU 318 Ca 0.50 -0.22 0.00 0.00 0.84 0.00 0.00 57.88 58.99 1nj6 h LEU 318 Cb 0.73 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.69 1nj6 h LEU 318 CO -0.37 0.30 -0.48 -0.09 -0.34 0.00 0.00 178.44 177.46 1nj6 h ARG 319 N -0.10 -0.75 -0.62 1.25 2.43 0.43 0.12 114.38 117.14 1nj6 h ARG 319 Ca 0.02 0.05 0.12 0.00 -0.81 0.00 0.00 59.98 59.37 1nj6 h ARG 319 Cb 0.24 0.17 -0.12 0.00 -0.42 0.00 0.00 29.97 29.84 1nj6 h ARG 319 CO 0.00 -0.50 -0.19 0.77 -1.51 0.00 0.00 179.97 178.54 1nj6 h SER 320 N -0.78 -0.68 -0.75 -3.80 0.02 -1.33 0.15 113.55 106.38 1nj6 h SER 320 Ca -0.03 0.20 0.07 0.00 -0.84 0.00 0.00 61.79 61.19 1nj6 h SER 320 Cb 0.73 0.42 -0.05 0.00 0.14 0.00 0.00 62.40 63.65 1nj6 h SER 320 CO -0.19 -0.23 0.49 -0.09 -1.14 0.00 0.00 176.83 175.68 1nj6 h ARG 321 N -0.03 0.74 -0.09 3.45 2.43 -0.57 -1.90 114.38 118.41 1nj6 h ARG 321 Ca 0.29 -0.04 -0.14 0.00 -0.81 0.00 0.00 59.98 59.28 1nj6 h ARG 321 Cb 0.48 -0.17 0.01 0.00 -0.42 0.00 0.00 29.97 29.87 1nj6 h ARG 321 CO -0.66 0.49 -0.50 -0.07 -1.51 0.00 0.00 179.97 177.72 1nj6 h LEU 322 N 0.76 0.60 -0.40 3.80 3.38 0.18 -3.12 115.31 120.51 1nj6 h LEU 322 Ca 0.33 -0.65 0.06 0.00 0.09 0.00 0.00 57.88 57.72 1nj6 h LEU 322 Cb 0.31 -0.18 -0.06 0.00 0.09 0.00 0.00 40.66 40.83 1nj6 h LEU 322 CO -0.12 1.15 0.06 -0.33 0.09 0.00 0.00 178.44 179.30 1nj6 h GLU 323 N 0.08 0.18 0.00 1.13 5.08 -0.37 0.87 114.58 121.55 1nj6 h GLU 323 Ca -0.04 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 1nj6 h GLU 323 Cb 1.15 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.36 1nj6 h GLU 323 CO 0.10 0.12 0.00 0.00 -1.00 0.00 0.00 179.01 178.23 1nj6 h ALA 324 N 1.31 1.00 -0.01 3.43 0.00 -1.44 0.14 119.26 123.70 1nj6 h ALA 324 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1nj6 h ALA 324 Cb 0.24 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1nj6 h ALA 324 CO -0.27 0.00 -0.28 0.00 0.00 0.00 0.00 179.25 178.70 1nj6 n ALA 325 N -2.01 3.11 0.00 0.00 0.00 0.25 -4.93 120.51 116.94 1nj6 n ALA 325 Ca -0.02 -0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.04 1nj6 n ALA 325 Cb 0.12 -1.15 0.00 0.00 0.00 0.00 0.00 19.45 18.42 1nj6 n ALA 325 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1nj6 n GLY 326 N 1.36 1.00 3.87 0.00 0.00 0.48 -5.09 105.19 106.81 1nj6 n GLY 326 Ca 0.11 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.82 1nj6 n GLY 326 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1nj6 s PHE 327 N -2.00 3.41 -1.09 1.61 0.40 -0.89 -4.99 117.98 114.43 1nj6 s PHE 327 Ca 0.00 0.96 -0.11 0.00 -0.60 0.00 0.00 56.93 57.18 1nj6 s PHE 327 Cb 0.00 -2.34 0.24 0.00 0.51 0.00 0.00 43.02 41.43 1nj6 s PHE 327 CO 0.00 0.19 1.14 1.03 0.70 0.00 0.00 175.22 178.29 1nj6 s ARG 328 N -2.96 4.06 0.20 0.44 0.52 -1.26 -4.41 118.95 115.55 1nj6 s ARG 328 Ca 0.49 -2.89 0.05 0.00 -0.52 0.00 0.00 55.73 52.86 1nj6 s ARG 328 Cb -0.11 -4.68 -0.03 0.00 0.52 0.00 0.00 34.95 30.65 1nj6 s ARG 328 CO 0.21 -1.40 0.26 0.54 0.02 0.00 0.00 175.30 174.93 1nj6 s VAL 329 N -0.18 4.94 -0.11 3.52 0.11 -1.26 0.07 120.40 127.48 1nj6 s VAL 329 Ca 0.32 -1.03 -0.04 0.00 -2.93 0.00 0.00 61.98 58.30 1nj6 s VAL 329 Cb -0.08 -3.61 0.06 0.00 -1.53 0.00 0.00 36.38 31.21 1nj6 s VAL 329 CO -0.06 -0.23 0.22 -2.28 -3.33 0.00 0.00 175.10 169.42 1nj6 s HIS 330 N -1.91 -0.33 -0.38 1.54 5.04 -0.38 -4.97 115.29 113.90 1nj6 s HIS 330 Ca 0.33 0.83 -0.22 0.00 -1.54 0.00 0.00 55.06 54.46 1nj6 s HIS 330 Cb -0.09 -0.11 0.01 0.00 0.04 0.00 0.00 32.58 32.42 1nj6 s HIS 330 CO 0.27 -0.32 0.70 -1.17 -2.34 0.00 0.00 174.74 171.89 1nj6 s LEU 331 N 2.30 4.25 -1.00 8.88 2.96 -1.26 -0.97 118.68 133.83 1nj6 s LEU 331 Ca 0.01 0.11 -0.15 0.00 -0.22 0.00 0.00 54.13 53.88 1nj6 s LEU 331 Cb -0.12 -2.88 0.18 0.00 0.50 0.00 0.00 46.19 43.87 1nj6 s LEU 331 CO -0.07 -0.71 1.13 -0.62 -1.32 0.00 0.00 176.35 174.76 1nj6 s ASP 332 N 1.88 6.86 -0.15 3.68 -1.08 -0.29 -4.80 116.67 122.79 1nj6 s ASP 332 Ca 0.27 -2.63 0.13 0.00 -0.52 0.00 0.00 52.55 49.80 1nj6 s ASP 332 Cb -0.14 -2.34 0.62 0.00 -1.46 0.00 0.00 42.92 39.61 1nj6 s ASP 332 CO 0.17 -0.78 1.47 -0.90 0.52 0.00 0.00 175.17 175.66 1nj6 n ASP 333 N 5.29 4.39 -4.50 -0.34 5.75 -1.26 -4.45 116.55 121.43 1nj6 n ASP 333 Ca 0.25 -2.57 -0.31 0.00 -0.01 0.00 0.00 54.79 52.14 1nj6 n ASP 333 Cb 0.46 -0.59 0.17 0.00 -1.03 0.00 0.00 41.12 40.12 1nj6 n ASP 333 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1nj6 n ARG 334 N 0.65 -0.88 -3.01 0.11 1.74 -1.26 -4.88 116.66 109.13 1nj6 n ARG 334 Ca 0.21 -0.21 -0.44 0.00 -0.77 0.00 0.00 57.85 56.65 1nj6 n ARG 334 Cb 0.89 -2.09 0.00 0.00 -1.02 0.00 0.00 32.46 30.25 1nj6 n ARG 334 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1nj6 n ASP 335 N -3.07 5.77 -4.07 0.55 -0.08 -1.26 -4.95 116.55 109.43 1nj6 n ASP 335 Ca 0.07 -3.18 -0.10 0.00 -1.51 0.00 0.00 54.79 50.07 1nj6 n ASP 335 Cb 0.54 -1.38 -0.08 0.00 2.34 0.00 0.00 41.12 42.55 1nj6 n ASP 335 CO 0.00 0.00 0.00 -0.63 0.12 0.00 0.00 177.20 176.69 1nj6 s ILE 336 N -1.23 0.01 0.07 5.18 1.01 -1.26 -5.12 121.20 119.87 1nj6 s ILE 336 Ca 0.34 -1.65 -0.31 0.00 0.00 0.00 0.00 60.65 59.03 1nj6 s ILE 336 Cb -0.01 -2.25 -0.09 0.00 0.01 0.00 0.00 42.46 40.13 1nj6 s ILE 336 CO 0.01 -0.07 1.70 0.00 0.00 0.00 0.00 174.94 176.59 1nj6 s ARG 337 N -4.06 4.18 0.64 2.79 1.70 -1.26 -4.84 118.95 118.09 1nj6 s ARG 337 Ca 0.28 2.39 0.21 0.00 -0.47 0.00 0.00 55.73 58.13 1nj6 s ARG 337 Cb 0.03 -3.64 1.01 0.00 -0.57 0.00 0.00 34.95 31.78 1nj6 s ARG 337 CO 0.08 -0.77 1.54 0.00 -1.08 0.00 0.00 175.30 175.08 1nj6 h ALA 338 N 8.54 1.98 0.26 7.88 0.00 -1.97 0.16 119.26 136.10 1nj6 h ALA 338 Ca -0.43 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.45 1nj6 h ALA 338 Cb 1.20 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1nj6 h ALA 338 CO 0.93 -0.85 -0.12 0.78 0.00 0.00 0.00 179.25 179.99 1nj6 h GLY 339 N 0.00 -0.36 0.67 0.00 0.00 -2.00 -0.97 103.07 100.41 1nj6 h GLY 339 Ca 0.13 0.13 0.11 0.00 0.00 0.00 0.00 47.33 47.70 1nj6 h GLY 339 CO -0.00 -0.13 0.57 -0.09 0.00 0.00 0.00 176.54 176.89 1nj6 h ARG 340 N -0.68 0.79 0.06 4.80 9.65 -1.06 -1.18 114.38 126.76 1nj6 h ARG 340 Ca -0.04 -0.05 -0.00 0.00 -1.10 0.00 0.00 59.98 58.79 1nj6 h ARG 340 Cb 0.47 -0.18 0.00 0.00 -1.39 0.00 0.00 29.97 28.87 1nj6 h ARG 340 CO 0.06 0.53 -0.03 0.87 2.80 0.00 0.00 179.97 184.20 1nj6 h LYS 341 N 0.82 -0.08 -0.30 0.20 1.57 -1.29 -2.07 116.57 115.42 1nj6 h LYS 341 Ca 0.42 0.01 0.07 0.00 -1.87 0.00 0.00 60.65 59.28 1nj6 h LYS 341 Cb 0.50 0.02 -0.08 0.00 0.08 0.00 0.00 32.23 32.75 1nj6 h LYS 341 CO -0.19 0.08 -0.22 1.88 -0.57 0.00 0.00 179.45 180.43 1nj6 h TYR 342 N -0.22 -0.59 -0.15 -1.35 0.99 -0.03 -2.07 116.97 113.56 1nj6 h TYR 342 Ca -0.01 0.04 0.05 0.00 2.00 0.00 0.00 58.73 60.81 1nj6 h TYR 342 Cb 0.19 0.30 -0.06 0.00 1.00 0.00 0.00 36.73 38.16 1nj6 h TYR 342 CO -0.03 -0.30 -0.28 -0.92 -0.00 0.00 0.00 178.16 176.63 1nj6 h TYR 343 N -0.20 -0.77 0.17 4.88 3.20 -1.21 -0.76 116.97 122.27 1nj6 h TYR 343 Ca 0.16 0.04 0.00 0.00 3.14 0.00 0.00 58.73 62.06 1nj6 h TYR 343 Cb 0.44 0.36 -0.02 0.00 1.54 0.00 0.00 36.73 39.05 1nj6 h TYR 343 CO -0.41 -0.36 -0.32 0.93 -1.64 0.00 0.00 178.16 176.35 1nj6 h GLU 344 N -0.35 -0.51 0.00 1.82 5.08 -0.81 0.17 114.58 119.98 1nj6 h GLU 344 Ca 0.10 0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 1nj6 h GLU 344 Cb 0.51 0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.87 1nj6 h GLU 344 CO -0.35 -0.34 0.00 -1.49 -1.00 0.00 0.00 179.01 175.83 1nj6 h TRP 345 N -0.53 0.00 0.12 4.33 4.06 -1.36 -1.44 115.95 121.13 1nj6 h TRP 345 Ca -0.02 0.00 -0.24 0.00 2.06 0.00 0.00 58.89 60.69 1nj6 h TRP 345 Cb 0.50 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.66 1nj6 h TRP 345 CO -0.31 0.00 -1.19 1.49 -3.56 0.00 0.00 178.44 174.87 1nj6 h GLU 346 N 0.00 0.25 0.00 0.49 4.81 -0.36 -1.52 114.58 118.25 1nj6 h GLU 346 Ca 0.00 -0.43 0.00 0.00 -0.13 0.00 0.00 59.36 58.80 1nj6 h GLU 346 Cb 0.13 0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.67 1nj6 h GLU 346 CO 0.00 1.21 0.00 0.00 -0.73 0.00 0.00 179.01 179.49 1nj6 n MET 347 N -4.02 0.15 0.06 1.92 0.00 0.53 -2.19 117.12 113.58 1nj6 n MET 347 Ca -0.21 0.29 0.12 0.00 0.00 0.00 0.00 57.70 57.90 1nj6 n MET 347 Cb 0.86 -1.74 0.07 0.00 0.00 0.00 0.00 33.22 32.41 1nj6 n MET 347 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 175.97 176.51 1nj6 n ARG 348 N -2.02 0.40 0.00 3.17 1.74 -0.60 -1.35 116.66 118.00 1nj6 n ARG 348 Ca 0.04 0.07 0.00 0.00 -0.77 0.00 0.00 57.85 57.18 1nj6 n ARG 348 Cb 0.28 -1.70 0.00 0.00 -1.02 0.00 0.00 32.46 30.02 1nj6 n ARG 348 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1nj6 n GLY 349 N 1.29 0.90 3.69 -0.13 0.00 -0.93 -4.75 105.19 105.27 1nj6 n GLY 349 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 1nj6 n GLY 349 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1nj6 s VAL 350 N -2.00 2.58 0.12 1.61 1.01 -0.58 -3.64 120.40 119.50 1nj6 s VAL 350 Ca 0.00 0.12 -0.18 0.00 0.00 0.00 0.00 61.98 61.92 1nj6 s VAL 350 Cb 0.00 -3.08 -0.05 0.00 0.00 0.00 0.00 36.38 33.25 1nj6 s VAL 350 CO 0.00 0.00 1.71 -0.65 0.00 0.00 0.00 175.10 176.16 1nj6 h PRO 351 N 8.42 0.38 -5.80 2.72 0.11 -1.72 -3.42 132.00 132.69 1nj6 h PRO 351 Ca -0.45 -0.05 -0.59 0.00 0.11 0.00 0.00 66.00 65.02 1nj6 h PRO 351 Cb 1.21 -0.07 -0.30 0.00 0.11 0.00 0.00 31.00 31.95 1nj6 h PRO 351 CO 0.95 0.34 -0.85 -0.51 -0.21 0.00 0.00 178.00 177.72 1nj6 s LEU 352 N -9.98 2.01 -0.11 2.35 1.43 -0.92 -1.70 118.68 111.76 1nj6 s LEU 352 Ca -0.13 -0.37 0.03 0.00 -1.03 0.00 0.00 54.13 52.62 1nj6 s LEU 352 Cb 0.09 -1.04 -0.00 0.00 0.03 0.00 0.00 46.19 45.26 1nj6 s LEU 352 CO 0.71 0.22 -0.20 -0.60 0.23 0.00 0.00 176.35 176.71 1nj6 s ARG 353 N -0.33 3.16 -0.25 1.70 3.52 -0.87 -1.44 118.95 124.42 1nj6 s ARG 353 Ca 0.04 -0.82 -0.02 0.00 -0.13 0.00 0.00 55.73 54.80 1nj6 s ARG 353 Cb -0.09 -2.41 0.02 0.00 -1.56 0.00 0.00 34.95 30.91 1nj6 s ARG 353 CO 0.00 0.18 -0.04 0.08 -0.81 0.00 0.00 175.30 174.71 1nj6 s VAL 354 N 0.36 3.02 -0.14 7.11 1.01 -0.51 -1.28 120.40 129.98 1nj6 s VAL 354 Ca -0.16 -0.97 -0.06 0.00 0.00 0.00 0.00 61.98 60.79 1nj6 s VAL 354 Cb -0.17 -2.54 -0.04 0.00 0.00 0.00 0.00 36.38 33.63 1nj6 s VAL 354 CO 0.08 0.19 0.07 -1.61 0.00 0.00 0.00 175.10 173.82 1nj6 s GLU 355 N 1.35 3.55 -0.05 2.72 2.02 0.40 -0.30 118.70 128.39 1nj6 s GLU 355 Ca 0.01 -0.30 0.01 0.00 0.02 0.00 0.00 54.97 54.70 1nj6 s GLU 355 Cb -0.17 -3.09 0.02 0.00 0.10 0.00 0.00 34.13 31.00 1nj6 s GLU 355 CO -0.04 0.53 -0.05 0.42 0.02 0.00 0.00 175.26 176.15 1nj6 s ILE 356 N -0.36 0.58 0.24 -1.63 1.01 -1.12 -1.49 121.20 118.43 1nj6 s ILE 356 Ca 0.09 -0.13 0.00 0.00 0.00 0.00 0.00 60.65 60.62 1nj6 s ILE 356 Cb -0.12 -0.61 -0.05 0.00 0.01 0.00 0.00 42.46 41.70 1nj6 s ILE 356 CO 0.02 0.24 0.11 -0.83 0.00 0.00 0.00 174.94 174.48 1nj6 s GLY 357 N 1.02 1.64 0.20 6.18 0.00 -1.26 -0.01 107.32 115.08 1nj6 s GLY 357 Ca -0.09 -1.81 -0.23 0.00 0.00 0.00 0.00 44.72 42.59 1nj6 s GLY 357 CO -0.00 -1.53 1.55 -2.55 0.00 0.00 0.00 173.10 170.57 1nj6 h PRO 358 N 2.46 -0.05 0.00 2.90 0.11 -1.86 -0.28 132.00 135.29 1nj6 h PRO 358 Ca -0.37 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.74 1nj6 h PRO 358 Cb 1.25 0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1nj6 h PRO 358 CO 0.58 -0.03 0.00 0.54 -0.21 0.00 0.00 178.00 178.88 1nj6 n ARG 359 N -5.40 0.00 -0.27 1.05 1.74 -1.26 -1.04 116.66 111.49 1nj6 n ARG 359 Ca 0.06 0.10 0.09 0.00 -0.77 0.00 0.00 57.85 57.33 1nj6 n ARG 359 Cb 0.35 -0.69 0.19 0.00 -1.02 0.00 0.00 32.46 31.29 1nj6 n ARG 359 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1nj6 n ASP 360 N -0.29 -0.15 -0.01 0.55 8.00 -1.19 0.80 116.55 124.26 1nj6 n ASP 360 Ca 0.00 1.30 -0.10 0.00 0.71 0.00 0.00 54.79 56.71 1nj6 n ASP 360 Cb 0.00 -0.45 -0.03 0.00 -0.02 0.00 0.00 41.12 40.62 1nj6 n ASP 360 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 1nj6 h LEU 361 N 0.00 -0.84 -4.29 0.64 5.85 -0.91 -1.86 115.31 113.91 1nj6 h LEU 361 Ca 0.43 0.13 -0.13 0.00 0.84 0.00 0.00 57.88 59.16 1nj6 h LEU 361 Cb 0.83 0.37 -0.05 0.00 0.37 0.00 0.00 40.66 42.18 1nj6 h LEU 361 CO -0.74 -0.31 -0.10 -0.62 -0.34 0.00 0.00 178.44 176.32 1nj6 n GLU 362 N -5.38 1.34 0.00 1.25 1.02 0.24 -1.38 120.64 117.72 1nj6 n GLU 362 Ca -0.02 -0.66 0.00 0.00 -0.02 0.00 0.00 57.16 56.46 1nj6 n GLU 362 Cb 0.30 -1.82 0.00 0.00 -0.02 0.00 0.00 31.44 29.90 1nj6 n GLU 362 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 1nj6 n LYS 363 N 2.63 0.00 -2.22 3.49 3.00 -0.74 -4.99 118.16 119.33 1nj6 n LYS 363 Ca 0.28 0.00 -0.05 0.00 -0.00 0.00 0.00 58.31 58.54 1nj6 n LYS 363 Cb 0.62 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.65 1nj6 n LYS 363 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1nj6 n GLY 364 N 0.00 0.23 3.28 3.14 0.00 -0.48 -5.03 105.19 106.33 1nj6 n GLY 364 Ca 0.00 -0.62 -0.10 0.00 0.00 0.00 0.00 46.02 45.30 1nj6 n GLY 364 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nj6 s ALA 365 N -2.41 0.51 0.34 4.61 0.00 -0.97 -1.89 121.76 121.95 1nj6 s ALA 365 Ca 0.03 -1.26 0.05 0.00 0.00 0.00 0.00 51.96 50.78 1nj6 s ALA 365 Cb -0.01 1.03 -0.02 0.00 0.00 0.00 0.00 23.12 24.12 1nj6 s ALA 365 CO 0.03 -0.61 0.34 0.00 0.00 0.00 0.00 175.76 175.52 1nj6 n ALA 366 N -0.22 0.42 -3.00 0.00 0.00 -0.36 -3.52 120.51 113.83 1nj6 n ALA 366 Ca -0.04 -1.86 -0.33 0.00 0.00 0.00 0.00 53.44 51.21 1nj6 n ALA 366 Cb 0.64 1.51 -0.13 0.00 0.00 0.00 0.00 19.45 21.46 1nj6 n ALA 366 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1nj6 s VAL 367 N -3.20 3.49 -0.25 0.00 1.01 -0.55 -2.10 120.40 118.80 1nj6 s VAL 367 Ca 0.37 -0.50 0.00 0.00 0.00 0.00 0.00 61.98 61.85 1nj6 s VAL 367 Cb 0.01 -2.50 0.04 0.00 0.00 0.00 0.00 36.38 33.93 1nj6 s VAL 367 CO 0.26 0.51 -0.09 -0.63 0.00 0.00 0.00 175.10 175.15 1nj6 s ILE 368 N 0.32 2.56 -0.12 2.22 1.01 -0.27 -0.46 121.20 126.47 1nj6 s ILE 368 Ca -0.07 -1.22 -0.06 0.00 0.00 0.00 0.00 60.65 59.29 1nj6 s ILE 368 Cb -0.15 -2.34 -0.04 0.00 0.01 0.00 0.00 42.46 39.94 1nj6 s ILE 368 CO 0.04 0.15 0.11 -0.55 0.00 0.00 0.00 174.94 174.70 1nj6 s SER 369 N 1.25 6.15 0.19 3.58 0.15 -0.40 -1.01 113.70 123.61 1nj6 s SER 369 Ca -0.02 0.39 -0.05 0.00 0.70 0.00 0.00 55.95 56.98 1nj6 s SER 369 Cb -0.17 -1.95 -0.05 0.00 -1.71 0.00 0.00 66.02 62.13 1nj6 s SER 369 CO -0.06 0.39 0.43 -0.13 1.20 0.00 0.00 173.24 175.07 1nj6 s ARG 370 N -0.94 3.62 -0.10 5.44 0.52 -0.91 -2.06 118.95 124.52 1nj6 s ARG 370 Ca 0.14 -0.08 0.05 0.00 -0.52 0.00 0.00 55.73 55.32 1nj6 s ARG 370 Cb -0.12 -2.79 -0.24 0.00 0.52 0.00 0.00 34.95 32.32 1nj6 s ARG 370 CO 0.03 0.40 0.43 -2.13 0.02 0.00 0.00 175.30 174.05 1nj6 n ARG 371 N -0.24 0.69 -0.04 3.54 3.00 -0.69 -2.85 116.66 120.07 1nj6 n ARG 371 Ca -0.02 0.24 -0.14 0.00 -0.00 0.00 0.00 57.85 57.93 1nj6 n ARG 371 Cb 0.52 -1.71 -0.08 0.00 0.00 0.00 0.00 32.46 31.19 1nj6 n ARG 371 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.63 178.01 1nj6 h ASP 372 N 0.03 0.39 0.00 6.15 2.03 -1.93 -3.41 116.42 119.67 1nj6 h ASP 372 Ca -0.39 -0.56 0.00 0.00 -0.73 0.00 0.00 57.03 55.36 1nj6 h ASP 372 Cb 2.04 -0.11 0.00 0.00 -0.83 0.00 0.00 39.33 40.43 1nj6 h ASP 372 CO 0.07 0.87 -0.07 0.41 -1.03 0.00 0.00 179.24 179.49 1nj6 n THR 373 N -4.50 0.17 0.00 1.15 -1.04 -1.26 -5.02 114.28 103.78 1nj6 n THR 373 Ca -0.07 0.47 0.00 0.00 -2.04 0.00 0.00 64.05 62.40 1nj6 n THR 373 Cb 0.43 -1.60 0.00 0.00 -1.82 0.00 0.00 70.33 67.33 1nj6 n THR 373 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1nj6 n GLY 374 N 1.68 1.09 3.58 3.41 0.00 -1.13 -5.03 105.19 108.79 1nj6 n GLY 374 Ca -0.01 0.00 -0.51 0.00 0.00 0.00 0.00 46.02 45.50 1nj6 n GLY 374 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1nj6 n GLU 375 N 0.00 1.52 -3.57 1.61 1.02 -1.26 -4.43 120.64 115.53 1nj6 n GLU 375 Ca 0.00 0.50 -0.37 0.00 -0.02 0.00 0.00 57.16 57.27 1nj6 n GLU 375 Cb 0.00 -2.52 -0.09 0.00 -0.02 0.00 0.00 31.44 28.81 1nj6 n GLU 375 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1nj6 s LYS 376 N 5.07 4.08 0.47 3.49 1.02 -1.26 -2.14 119.74 130.46 1nj6 s LYS 376 Ca 1.01 -0.14 0.04 0.00 0.02 0.00 0.00 55.97 56.91 1nj6 s LYS 376 Cb -0.80 -3.56 -0.04 0.00 -0.52 0.00 0.00 37.83 32.92 1nj6 s LYS 376 CO 0.52 -0.01 0.06 0.14 -0.92 0.00 0.00 175.35 175.15 1nj6 s VAL 377 N 1.25 1.65 -0.13 3.17 -7.23 -0.18 -4.93 120.40 114.00 1nj6 s VAL 377 Ca 0.11 -1.91 0.01 0.00 -1.81 0.00 0.00 61.98 58.38 1nj6 s VAL 377 Cb -0.14 -2.57 0.02 0.00 0.56 0.00 0.00 36.38 34.25 1nj6 s VAL 377 CO 0.06 0.00 -0.16 -0.89 -0.31 0.00 0.00 175.10 173.80 1nj6 s THR 378 N -2.77 1.64 0.30 5.32 2.01 -1.26 -1.11 115.64 119.76 1nj6 s THR 378 Ca 0.23 -0.71 0.06 0.00 0.31 0.00 0.00 61.69 61.58 1nj6 s THR 378 Cb 0.05 -1.50 -0.06 0.00 0.01 0.00 0.00 72.50 70.99 1nj6 s THR 378 CO 0.12 0.47 -0.02 0.00 -0.69 0.00 0.00 174.62 174.50 1nj6 s ALA 379 N 1.14 2.37 -0.32 7.40 0.00 -0.89 -4.97 121.76 126.49 1nj6 s ALA 379 Ca -0.02 -1.96 -0.22 0.00 0.00 0.00 0.00 51.96 49.77 1nj6 s ALA 379 Cb -0.14 0.31 -0.00 0.00 0.00 0.00 0.00 23.12 23.28 1nj6 s ALA 379 CO -0.05 -0.14 0.69 -0.51 0.00 0.00 0.00 175.76 175.75 1nj6 s ASP 380 N -3.46 6.54 0.00 0.00 1.01 -1.26 -1.22 116.67 118.28 1nj6 s ASP 380 Ca 0.31 0.46 0.00 0.00 0.71 0.00 0.00 52.55 54.03 1nj6 s ASP 380 Cb 0.05 -2.36 0.00 0.00 1.01 0.00 0.00 42.92 41.62 1nj6 s ASP 380 CO 0.13 -0.56 0.74 0.18 0.21 0.00 0.00 175.17 175.87 1nj6 n LEU 381 N 6.05 0.00 -0.00 1.23 4.77 -0.79 -1.58 117.00 126.68 1nj6 n LEU 381 Ca 0.01 0.26 -0.14 0.00 -0.03 0.00 0.00 56.01 56.10 1nj6 n LEU 381 Cb 0.48 -0.26 -0.03 0.00 -2.33 0.00 0.00 43.42 41.29 1nj6 n LEU 381 CO 0.48 -0.26 0.32 1.56 -1.33 0.00 0.00 177.39 178.17 1nj6 h GLN 382 N 0.00 0.66 0.00 3.23 4.20 -1.91 -3.35 115.11 117.94 1nj6 h GLN 382 Ca 0.00 -0.52 0.00 0.00 0.06 0.00 0.00 58.65 58.19 1nj6 h GLN 382 Cb 0.44 0.10 0.00 0.00 0.30 0.00 0.00 27.48 28.32 1nj6 h GLN 382 CO 0.00 1.14 -0.09 0.41 -0.67 0.00 0.00 178.83 179.62 1nj6 n GLY 383 N 0.60 1.64 0.53 3.46 0.00 -0.61 -4.87 105.19 105.94 1nj6 n GLY 383 Ca -0.06 -0.29 0.41 0.00 0.00 0.00 0.00 46.02 46.08 1nj6 n GLY 383 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1nj6 h ILE 384 N 1.92 0.11 -0.32 -0.61 2.10 -1.56 -1.25 117.51 117.91 1nj6 h ILE 384 Ca 0.00 -0.02 0.07 0.00 1.08 0.00 0.00 64.86 65.99 1nj6 h ILE 384 Cb 0.90 0.05 -0.08 0.00 -1.09 0.00 0.00 36.82 36.60 1nj6 h ILE 384 CO 0.00 0.01 -0.23 -0.33 -1.08 0.00 0.00 178.15 176.52 1nj6 h GLU 385 N 0.06 -0.19 -0.10 2.19 3.07 -1.89 0.15 114.58 117.87 1nj6 h GLU 385 Ca 0.83 0.01 -0.08 0.00 -0.50 0.00 0.00 59.36 59.62 1nj6 h GLU 385 Cb 2.84 0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 30.79 1nj6 h GLU 385 CO -0.29 -0.13 -0.31 0.93 -1.40 0.00 0.00 179.01 177.81 1nj6 h GLU 386 N -0.20 0.19 -0.51 2.33 4.39 -1.64 -1.18 114.58 117.95 1nj6 h GLU 386 Ca 0.16 -0.07 -0.02 0.00 0.34 0.00 0.00 59.36 59.78 1nj6 h GLU 386 Cb 0.45 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 29.06 1nj6 h GLU 386 CO -0.43 0.48 0.25 1.15 -1.16 0.00 0.00 179.01 179.31 1nj6 h THR 387 N 0.16 1.19 0.03 1.13 2.02 -1.10 -1.95 112.91 114.38 1nj6 h THR 387 Ca 0.02 -0.52 -0.00 0.00 0.77 0.00 0.00 66.41 66.68 1nj6 h THR 387 Cb 0.64 0.60 0.00 0.00 -1.74 0.00 0.00 68.15 67.65 1nj6 h THR 387 CO 0.05 0.21 -0.01 -0.07 0.37 0.00 0.00 175.52 176.06 1nj6 h LEU 388 N 0.68 -0.03 -0.62 2.58 3.38 -0.35 -1.61 115.31 119.34 1nj6 h LEU 388 Ca 0.18 -0.36 0.13 0.00 0.09 0.00 0.00 57.88 57.92 1nj6 h LEU 388 Cb 0.10 0.01 -0.10 0.00 0.09 0.00 0.00 40.66 40.76 1nj6 h LEU 388 CO -0.02 0.34 0.03 0.03 0.09 0.00 0.00 178.44 178.91 1nj6 h ARG 389 N -0.41 0.14 0.00 1.13 3.08 -1.13 0.03 114.38 117.22 1nj6 h ARG 389 Ca -0.00 -0.01 -0.00 0.00 0.07 0.00 0.00 59.98 60.04 1nj6 h ARG 389 Cb 0.38 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.40 1nj6 h ARG 389 CO 0.01 0.09 -0.00 0.93 -1.07 0.00 0.00 179.97 179.93 1nj6 h GLU 390 N 0.15 -0.00 -0.92 0.04 4.39 -1.31 -2.44 114.58 114.48 1nj6 h GLU 390 Ca 0.33 0.00 0.17 0.00 0.34 0.00 0.00 59.36 60.20 1nj6 h GLU 390 Cb 0.52 0.00 -0.10 0.00 -0.10 0.00 0.00 28.75 29.07 1nj6 h GLU 390 CO -0.51 0.07 0.51 -0.07 -1.16 0.00 0.00 179.01 177.85 1nj6 h LEU 391 N -0.07 0.62 -0.20 1.33 3.38 -0.17 -0.93 115.31 119.27 1nj6 h LEU 391 Ca -0.00 0.10 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 1nj6 h LEU 391 Cb 0.07 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 1nj6 h LEU 391 CO 0.00 0.23 0.10 0.24 0.09 0.00 0.00 178.44 179.10 1nj6 h MET 392 N 0.67 0.29 -0.97 1.13 2.86 -0.72 -1.09 114.93 117.09 1nj6 h MET 392 Ca 0.52 -0.04 0.07 0.00 -2.06 0.00 0.00 59.70 58.19 1nj6 h MET 392 Cb 0.78 -0.05 -0.07 0.00 0.06 0.00 0.00 31.60 32.32 1nj6 h MET 392 CO -0.38 0.30 0.62 0.87 1.06 0.00 0.00 176.91 179.38 1nj6 h LYS 393 N 0.20 1.06 -0.09 1.72 1.57 -0.76 -2.28 116.57 117.99 1nj6 h LYS 393 Ca 0.07 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.78 1nj6 h LYS 393 Cb 0.10 -0.24 -0.00 0.00 0.08 0.00 0.00 32.23 32.17 1nj6 h LYS 393 CO -0.01 0.70 0.04 0.22 -0.57 0.00 0.00 179.45 179.83 1nj6 h ASP 394 N 1.09 0.13 -0.98 0.86 1.82 -0.73 -2.84 116.42 115.76 1nj6 h ASP 394 Ca 0.43 -0.16 0.05 0.00 -0.39 0.00 0.00 57.03 56.96 1nj6 h ASP 394 Cb 0.23 -0.03 -0.06 0.00 0.68 0.00 0.00 39.33 40.15 1nj6 h ASP 394 CO -0.18 0.26 0.64 0.40 -1.61 0.00 0.00 179.24 178.75 1nj6 h ILE 395 N -0.01 1.12 0.28 2.25 2.04 -0.66 -0.87 117.51 121.65 1nj6 h ILE 395 Ca 0.03 -0.40 -0.01 0.00 1.00 0.00 0.00 64.86 65.47 1nj6 h ILE 395 Cb 0.17 -0.17 0.00 0.00 -0.74 0.00 0.00 36.82 36.08 1nj6 h ILE 395 CO -0.00 0.22 -0.13 0.25 0.00 0.00 0.00 178.15 178.48 1nj6 h LEU 396 N 1.18 -0.32 -0.82 1.44 5.85 -1.38 -0.69 115.31 120.57 1nj6 h LEU 396 Ca 0.41 -0.12 0.12 0.00 0.84 0.00 0.00 57.88 59.13 1nj6 h LEU 396 Cb 0.11 0.08 -0.08 0.00 0.37 0.00 0.00 40.66 41.14 1nj6 h LEU 396 CO -0.15 -0.06 0.44 -0.33 -0.34 0.00 0.00 178.44 178.00 1nj6 h GLU 397 N -0.57 0.68 0.62 1.25 5.08 -1.27 0.67 114.58 121.04 1nj6 h GLU 397 Ca -0.04 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.25 1nj6 h GLU 397 Cb 0.42 -0.15 0.01 0.00 0.50 0.00 0.00 28.75 29.52 1nj6 h GLU 397 CO 0.06 0.45 -0.30 -0.97 -1.00 0.00 0.00 179.01 177.25 1nj6 h ASN 398 N 0.70 -0.71 -0.83 1.42 -0.00 -1.02 0.14 115.58 115.28 1nj6 h ASN 398 Ca 0.42 -0.02 0.11 0.00 -0.00 0.00 0.00 56.30 56.81 1nj6 h ASN 398 Cb 0.48 0.18 -0.08 0.00 -0.00 0.00 0.00 38.32 38.91 1nj6 h ASN 398 CO -0.30 -0.39 0.45 -0.07 -0.00 0.00 0.00 177.43 177.12 1nj6 h LEU 399 N -1.02 0.62 -0.30 0.34 3.38 -0.51 0.18 115.31 118.00 1nj6 h LEU 399 Ca -0.09 0.06 -0.02 0.00 0.09 0.00 0.00 57.88 57.93 1nj6 h LEU 399 Cb 0.69 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 1nj6 h LEU 399 CO 0.14 0.33 0.11 -0.09 0.09 0.00 0.00 178.44 179.01 1nj6 h ARG 400 N 0.73 0.46 0.62 1.13 2.43 0.43 -1.66 114.38 118.52 1nj6 h ARG 400 Ca 0.42 -0.09 -0.03 0.00 -0.81 0.00 0.00 59.98 59.47 1nj6 h ARG 400 Cb 0.46 -0.07 0.01 0.00 -0.42 0.00 0.00 29.97 29.95 1nj6 h ARG 400 CO -0.29 0.49 -0.30 1.15 -1.51 0.00 0.00 179.97 179.51 1nj6 h THR 401 N 0.33 0.00 -0.94 0.20 2.02 0.55 -1.11 112.91 113.95 1nj6 h THR 401 Ca 0.10 -0.05 0.14 0.00 0.77 0.00 0.00 66.41 67.37 1nj6 h THR 401 Cb 0.21 0.00 -0.15 0.00 -1.74 0.00 0.00 68.15 66.47 1nj6 h THR 401 CO -0.01 0.00 -0.38 0.54 0.37 0.00 0.00 175.52 176.05 1nj6 n ARG 402 N -4.39 -0.23 -0.15 6.66 5.12 0.52 0.12 116.66 124.32 1nj6 n ARG 402 Ca -0.10 1.44 -0.04 0.00 -1.93 0.00 0.00 57.85 57.23 1nj6 n ARG 402 Cb 0.33 -2.14 0.03 0.00 -1.16 0.00 0.00 32.46 29.52 1nj6 n ARG 402 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1nj6 h ALA 403 N 1.25 0.32 -0.64 7.54 0.00 -1.11 0.79 119.26 127.41 1nj6 h ALA 403 Ca 0.32 0.18 -0.04 0.00 0.00 0.00 0.00 54.91 55.37 1nj6 h ALA 403 Cb 0.55 0.35 -0.03 0.00 0.00 0.00 0.00 17.79 18.66 1nj6 h ALA 403 CO -0.93 -0.44 0.26 -1.49 0.00 0.00 0.00 179.25 176.65 1nj6 h TRP 404 N 0.01 0.96 0.69 0.00 4.06 1.00 -1.37 115.95 121.30 1nj6 h TRP 404 Ca 0.23 -0.07 -0.03 0.00 2.06 0.00 0.00 58.89 61.07 1nj6 h TRP 404 Cb 0.34 -0.29 -0.00 0.00 -1.00 0.00 0.00 29.16 28.21 1nj6 h TRP 404 CO -0.40 0.76 -0.42 0.93 -3.56 0.00 0.00 178.44 175.75 1nj6 h GLU 405 N 0.89 -1.01 -1.09 0.49 5.08 -0.22 -0.63 114.58 118.09 1nj6 h GLU 405 Ca 0.21 0.07 0.35 0.00 -1.00 0.00 0.00 59.36 58.99 1nj6 h GLU 405 Cb 0.20 0.23 -0.14 0.00 0.50 0.00 0.00 28.75 29.54 1nj6 h GLU 405 CO -0.02 -0.67 0.65 0.00 -1.00 0.00 0.00 179.01 177.98 1nj6 h ARG 406 N -1.04 0.25 0.09 2.33 3.08 -0.70 -1.52 114.38 116.87 1nj6 h ARG 406 Ca -0.09 -0.01 -0.00 0.00 0.07 0.00 0.00 59.98 59.94 1nj6 h ARG 406 Cb 0.83 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.83 1nj6 h ARG 406 CO 0.09 0.16 -0.04 1.98 -1.07 0.00 0.00 179.97 181.10 1nj6 h MET 407 N 0.25 -0.11 -0.59 0.04 4.05 -0.69 -3.31 114.93 114.57 1nj6 h MET 407 Ca 0.74 0.01 0.15 0.00 -0.28 0.00 0.00 59.70 60.33 1nj6 h MET 407 Cb 1.92 0.03 -0.03 0.00 -0.80 0.00 0.00 31.60 32.72 1nj6 h MET 407 CO -0.52 0.31 0.42 0.93 0.23 0.00 0.00 176.91 178.28 1nj6 h GLU 408 N -0.96 0.10 0.00 0.39 5.08 -0.63 0.38 114.58 118.94 1nj6 h GLU 408 Ca -0.01 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1nj6 h GLU 408 Cb 0.48 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.71 1nj6 h GLU 408 CO 0.02 0.07 0.00 -1.13 -1.00 0.00 0.00 179.01 176.97 1nj6 n SER 409 N -4.40 0.00 0.00 1.42 3.41 -0.62 -2.24 113.62 111.19 1nj6 n SER 409 Ca 0.11 -1.33 0.00 0.00 -0.26 0.00 0.00 58.87 57.39 1nj6 n SER 409 Cb 0.59 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.54 1nj6 n SER 409 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1nj6 n GLU 410 N -0.62 -0.03 -3.38 4.33 -0.58 0.13 -4.92 120.64 115.58 1nj6 n GLU 410 Ca 0.04 -0.64 -0.43 0.00 -0.42 0.00 0.00 57.16 55.71 1nj6 n GLU 410 Cb 0.02 -0.92 -0.09 0.00 -0.57 0.00 0.00 31.44 29.88 1nj6 n GLU 410 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 1nj6 s ILE 411 N -0.20 5.17 -0.06 -3.67 1.01 -0.95 -0.99 121.20 121.51 1nj6 s ILE 411 Ca 0.00 -0.66 0.05 0.00 0.00 0.00 0.00 60.65 60.04 1nj6 s ILE 411 Cb 0.00 -4.04 -0.02 0.00 0.01 0.00 0.00 42.46 38.41 1nj6 s ILE 411 CO 0.00 -0.45 -0.19 -0.13 0.00 0.00 0.00 174.94 174.17 1nj6 s ARG 412 N 1.87 2.57 0.47 2.79 0.52 0.20 -4.88 118.95 122.49 1nj6 s ARG 412 Ca 0.08 -0.80 -0.19 0.00 -0.52 0.00 0.00 55.73 54.29 1nj6 s ARG 412 Cb -0.20 -2.29 -0.09 0.00 0.52 0.00 0.00 34.95 32.89 1nj6 s ARG 412 CO 0.10 0.48 0.99 -1.21 0.02 0.00 0.00 175.30 175.68 1nj6 s GLU 413 N -0.38 3.99 -0.05 3.54 2.02 -1.26 -0.26 118.70 126.30 1nj6 s GLU 413 Ca 0.03 1.15 -0.03 0.00 0.02 0.00 0.00 54.97 56.14 1nj6 s GLU 413 Cb -0.12 -2.14 0.02 0.00 0.10 0.00 0.00 34.13 31.99 1nj6 s GLU 413 CO 0.02 -0.24 0.11 0.00 0.02 0.00 0.00 175.26 175.17 1nj6 s ALA 414 N -2.25 -0.24 -0.05 5.21 0.00 -0.55 -4.85 121.76 119.03 1nj6 s ALA 414 Ca 0.63 0.42 0.16 0.00 0.00 0.00 0.00 51.96 53.17 1nj6 s ALA 414 Cb -0.12 -0.27 -0.24 0.00 0.00 0.00 0.00 23.12 22.49 1nj6 s ALA 414 CO 0.20 -0.09 0.30 0.39 0.00 0.00 0.00 175.76 176.56 1nj6 n GLU 415 N 3.49 0.71 -5.17 0.00 1.02 -1.26 -4.57 120.64 114.87 1nj6 n GLU 415 Ca -0.18 -0.12 -0.29 0.00 -0.02 0.00 0.00 57.16 56.54 1nj6 n GLU 415 Cb 0.56 -1.39 -0.16 0.00 -0.02 0.00 0.00 31.44 30.43 1nj6 n GLU 415 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1nj6 s THR 416 N -2.98 1.86 0.56 2.62 2.01 -1.26 -4.67 115.64 113.78 1nj6 s THR 416 Ca -0.06 -0.99 0.26 0.00 0.31 0.00 0.00 61.69 61.20 1nj6 s THR 416 Cb 0.09 -1.56 0.37 0.00 0.01 0.00 0.00 72.50 71.42 1nj6 s THR 416 CO 0.67 0.53 2.03 0.25 -0.69 0.00 0.00 174.62 177.41 1nj6 h LEU 417 N 5.73 0.00 -0.07 4.42 5.85 -1.94 0.12 115.31 129.42 1nj6 h LEU 417 Ca -0.38 0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.23 1nj6 h LEU 417 Cb 1.14 0.00 0.01 0.00 0.37 0.00 0.00 40.66 42.18 1nj6 h LEU 417 CO 0.47 0.00 -0.38 -0.33 -0.34 0.00 0.00 178.44 177.86 1nj6 h GLU 418 N 0.00 0.39 -0.71 1.25 5.08 -1.94 -2.62 114.58 116.02 1nj6 h GLU 418 Ca 0.17 -0.32 0.03 0.00 -1.00 0.00 0.00 59.36 58.24 1nj6 h GLU 418 Cb 0.78 0.07 -0.04 0.00 0.50 0.00 0.00 28.75 30.06 1nj6 h GLU 418 CO -0.00 0.96 0.47 1.49 -1.00 0.00 0.00 179.01 180.93 1nj6 h GLU 419 N -0.09 0.86 0.91 2.33 4.81 -1.24 -1.83 114.58 120.34 1nj6 h GLU 419 Ca -0.03 -0.05 -0.04 0.00 -0.13 0.00 0.00 59.36 59.11 1nj6 h GLU 419 Cb 1.03 -0.19 0.01 0.00 0.63 0.00 0.00 28.75 30.23 1nj6 h GLU 419 CO 0.08 0.57 -0.44 0.00 -0.73 0.00 0.00 179.01 178.49 1nj6 h ALA 420 N 1.58 -1.27 -1.04 2.92 0.00 -1.10 -1.19 119.26 119.15 1nj6 h ALA 420 Ca 0.28 -0.27 0.28 0.00 0.00 0.00 0.00 54.91 55.20 1nj6 h ALA 420 Cb 0.03 0.47 -0.08 0.00 0.00 0.00 0.00 17.79 18.21 1nj6 h ALA 420 CO -0.08 -1.18 0.70 0.77 0.00 0.00 0.00 179.25 179.46 1nj6 h SER 421 N -1.27 0.32 -0.08 0.00 0.02 -1.13 0.70 113.55 112.11 1nj6 h SER 421 Ca -0.12 0.06 -0.05 0.00 -0.84 0.00 0.00 61.79 60.83 1nj6 h SER 421 Cb 0.94 0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.48 1nj6 h SER 421 CO 0.21 0.07 -0.16 -0.09 -1.14 0.00 0.00 176.83 175.71 1nj6 h ARG 422 N 0.28 0.25 -0.25 3.45 2.43 -1.02 -2.71 114.38 116.82 1nj6 h ARG 422 Ca 0.56 -0.16 -0.03 0.00 -0.81 0.00 0.00 59.98 59.55 1nj6 h ARG 422 Cb 1.64 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 31.20 1nj6 h ARG 422 CO -0.21 0.75 0.05 0.82 -1.51 0.00 0.00 179.97 179.87 1nj6 h ILE 423 N -0.23 1.22 0.56 1.20 2.04 0.20 -1.94 117.51 120.57 1nj6 h ILE 423 Ca 0.00 -0.73 -0.02 0.00 1.00 0.00 0.00 64.86 65.11 1nj6 h ILE 423 Cb 0.74 1.23 -0.01 0.00 -0.74 0.00 0.00 36.82 38.04 1nj6 h ILE 423 CO 0.04 0.23 -0.43 0.58 0.00 0.00 0.00 178.15 178.57 1nj6 h VAL 424 N 0.22 0.14 -0.00 1.67 2.07 -1.04 0.38 116.25 119.68 1nj6 h VAL 424 Ca 0.08 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.60 1nj6 h VAL 424 Cb 0.30 0.14 -0.00 0.00 -1.52 0.00 0.00 31.29 30.21 1nj6 h VAL 424 CO 0.00 0.00 0.00 0.44 0.02 0.00 0.00 177.57 178.04 1nj6 h ASP 425 N -0.97 0.00 0.00 0.57 3.32 -1.50 0.46 116.42 118.30 1nj6 h ASP 425 Ca -0.07 0.00 -0.36 0.00 0.02 0.00 0.00 57.03 56.63 1nj6 h ASP 425 Cb 0.81 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 40.30 1nj6 h ASP 425 CO 0.01 0.00 -2.35 -0.62 -1.72 0.00 0.00 179.24 174.56 1nj6 n GLU 426 N -3.91 0.71 -0.00 3.56 1.02 -0.73 -4.73 120.64 116.57 1nj6 n GLU 426 Ca -0.03 0.09 0.01 0.00 -0.02 0.00 0.00 57.16 57.21 1nj6 n GLU 426 Cb 0.08 -1.49 -0.02 0.00 -0.02 0.00 0.00 31.44 30.00 1nj6 n GLU 426 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1nj6 n LYS 427 N -3.03 5.90 0.00 3.49 5.02 0.13 -5.08 118.16 124.59 1nj6 n LYS 427 Ca -0.39 -0.00 0.00 0.00 -2.02 0.00 0.00 58.31 55.90 1nj6 n LYS 427 Cb 1.01 -0.64 0.00 0.00 -0.02 0.00 0.00 35.03 35.38 1nj6 n LYS 427 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1nj6 n ARG 428 N -1.08 0.00 0.00 1.97 1.74 0.16 -4.95 116.66 114.50 1nj6 n ARG 428 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1nj6 n ARG 428 Cb 0.04 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.48 1nj6 n ARG 428 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1nj6 n GLY 429 N 0.00 -1.49 3.90 -0.13 0.00 -0.79 -4.56 105.19 102.11 1nj6 n GLY 429 Ca 0.00 -1.30 -0.35 0.00 0.00 0.00 0.00 46.02 44.38 1nj6 n GLY 429 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1nj6 s ILE 430 N 0.00 5.45 -0.25 -0.61 -1.09 -0.16 -4.51 121.20 120.03 1nj6 s ILE 430 Ca 0.00 -0.02 -0.01 0.00 -2.23 0.00 0.00 60.65 58.39 1nj6 s ILE 430 Cb 0.00 -3.49 0.03 0.00 -1.58 0.00 0.00 42.46 37.41 1nj6 s ILE 430 CO 0.00 0.43 -0.07 -0.63 -1.23 0.00 0.00 174.94 173.44 1nj6 s ILE 431 N -1.22 2.80 0.27 2.92 -1.09 -0.40 -0.63 121.20 123.85 1nj6 s ILE 431 Ca 0.23 -1.08 -0.16 0.00 -2.23 0.00 0.00 60.65 57.41 1nj6 s ILE 431 Cb -0.12 -2.44 -0.08 0.00 -1.58 0.00 0.00 42.46 38.23 1nj6 s ILE 431 CO 0.14 0.18 0.71 -0.55 -1.23 0.00 0.00 174.94 174.19 1nj6 s SER 432 N 1.31 6.87 -0.17 3.58 0.15 0.64 -1.92 113.70 124.15 1nj6 s SER 432 Ca -0.00 1.29 -0.33 0.00 0.70 0.00 0.00 55.95 57.61 1nj6 s SER 432 Cb -0.17 -2.37 0.14 0.00 -1.71 0.00 0.00 66.02 61.91 1nj6 s SER 432 CO -0.05 -0.10 1.15 0.72 1.20 0.00 0.00 173.24 176.17 1nj6 s PHE 433 N -1.78 -0.19 0.04 3.44 -0.12 -0.07 -1.48 117.98 117.82 1nj6 s PHE 433 Ca 0.49 0.19 -0.21 0.00 -0.05 0.00 0.00 56.93 57.35 1nj6 s PHE 433 Cb -0.13 0.50 -0.06 0.00 -0.63 0.00 0.00 43.02 42.71 1nj6 s PHE 433 CO 0.19 -0.25 0.62 -1.64 -0.05 0.00 0.00 175.22 174.09 1nj6 s MET 434 N -2.08 4.32 0.01 1.99 -1.94 -1.26 0.25 119.30 120.59 1nj6 s MET 434 Ca 0.07 0.80 0.01 0.00 -1.71 0.00 0.00 55.69 54.86 1nj6 s MET 434 Cb -0.01 -3.31 -0.01 0.00 2.01 0.00 0.00 34.83 33.51 1nj6 s MET 434 CO -0.05 0.45 -0.03 -0.46 -0.01 0.00 0.00 175.02 174.92 1nj6 s TRP 435 N -0.51 0.29 0.32 -0.03 -0.00 -0.41 -1.51 118.94 117.08 1nj6 s TRP 435 Ca 0.32 -0.21 0.22 0.00 -0.00 0.00 0.00 56.10 56.42 1nj6 s TRP 435 Cb -0.19 -0.19 1.06 0.00 -0.00 0.00 0.00 33.47 34.15 1nj6 s TRP 435 CO 0.19 -0.05 1.92 0.00 -0.00 0.00 0.00 176.95 179.00 1nj6 n GLY 437 N -0.36 0.56 3.40 0.00 0.00 -1.26 -4.53 105.19 103.00 1nj6 n GLY 437 Ca -0.01 -0.50 -0.31 0.00 0.00 0.00 0.00 46.02 45.19 1nj6 n GLY 437 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1nj6 s GLU 438 N -4.47 2.17 0.00 1.61 0.41 -1.26 -5.03 118.70 112.14 1nj6 s GLU 438 Ca 0.02 -0.90 -0.01 0.00 -0.41 0.00 0.00 54.97 53.67 1nj6 s GLU 438 Cb -0.01 -2.17 -0.00 0.00 -1.78 0.00 0.00 34.13 30.18 1nj6 s GLU 438 CO 0.05 0.57 1.01 0.93 -0.49 0.00 0.00 175.26 177.33 1nj6 h GLU 439 N 5.11 -0.01 -1.00 1.61 4.39 -1.99 0.28 114.58 122.98 1nj6 h GLU 439 Ca -0.46 0.00 0.17 0.00 0.34 0.00 0.00 59.36 59.42 1nj6 h GLU 439 Cb 1.14 0.00 -0.10 0.00 -0.10 0.00 0.00 28.75 29.69 1nj6 h GLU 439 CO 0.48 -0.00 0.62 0.93 -1.16 0.00 0.00 179.01 179.87 1nj6 h GLU 440 N -0.01 0.79 -0.51 2.33 3.07 -1.99 0.21 114.58 118.47 1nj6 h GLU 440 Ca 0.00 -0.05 -0.12 0.00 -0.50 0.00 0.00 59.36 58.69 1nj6 h GLU 440 Cb 0.01 -0.18 -0.02 0.00 -0.84 0.00 0.00 28.75 27.73 1nj6 h GLU 440 CO -0.01 0.52 -0.15 0.00 -1.40 0.00 0.00 179.01 177.97 1nj6 h GLY 442 N 0.88 -0.31 0.32 0.00 0.00 0.14 0.16 103.07 104.24 1nj6 h GLY 442 Ca 0.13 0.12 0.08 0.00 0.00 0.00 0.00 47.33 47.65 1nj6 h GLY 442 CO 0.06 -0.11 0.01 -0.33 0.00 0.00 0.00 176.54 176.17 1nj6 h MET 443 N -0.49 0.12 -0.66 4.80 2.86 -1.02 0.66 114.93 121.20 1nj6 h MET 443 Ca -0.03 -0.01 0.07 0.00 -2.06 0.00 0.00 59.70 57.67 1nj6 h MET 443 Cb 0.37 -0.03 -0.06 0.00 0.06 0.00 0.00 31.60 31.94 1nj6 h MET 443 CO 0.05 0.08 0.35 0.22 1.06 0.00 0.00 176.91 178.67 1nj6 h ASP 444 N 0.12 0.49 -0.02 1.22 3.58 -1.07 0.12 116.42 120.86 1nj6 h ASP 444 Ca 0.22 0.04 0.01 0.00 0.42 0.00 0.00 57.03 57.71 1nj6 h ASP 444 Cb 0.31 -0.05 -0.01 0.00 1.72 0.00 0.00 39.33 41.30 1nj6 h ASP 444 CO -0.35 0.31 -0.01 0.58 -2.88 0.00 0.00 179.24 176.89 1nj6 h VAL 445 N 0.63 0.96 0.03 2.25 2.07 0.73 -1.04 116.25 121.88 1nj6 h VAL 445 Ca 0.31 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.85 1nj6 h VAL 445 Cb 0.25 0.96 -0.03 0.00 -1.52 0.00 0.00 31.29 30.95 1nj6 h VAL 445 CO -0.21 0.00 -0.16 -0.33 0.02 0.00 0.00 177.57 176.89 1nj6 h GLU 446 N -0.01 -0.27 0.26 1.57 5.08 -0.05 -1.68 114.58 119.48 1nj6 h GLU 446 Ca 0.01 0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.39 1nj6 h GLU 446 Cb 0.03 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 1nj6 h GLU 446 CO -0.03 -0.18 -0.18 1.49 -1.00 0.00 0.00 179.01 179.11 1nj6 h GLU 447 N -0.28 -0.43 -0.87 2.33 4.81 -0.70 0.88 114.58 120.32 1nj6 h GLU 447 Ca 0.04 0.03 0.08 0.00 -0.13 0.00 0.00 59.36 59.38 1nj6 h GLU 447 Cb 0.33 0.10 -0.06 0.00 0.63 0.00 0.00 28.75 29.75 1nj6 h GLU 447 CO -0.13 -0.29 0.57 0.87 -0.73 0.00 0.00 179.01 179.30 1nj6 h LYS 448 N -0.44 0.90 -0.01 1.92 1.57 -1.11 -2.17 116.57 117.23 1nj6 h LYS 448 Ca -0.02 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 1nj6 h LYS 448 Cb 0.38 -0.20 0.00 0.00 0.08 0.00 0.00 32.23 32.49 1nj6 h LYS 448 CO 0.01 0.60 -0.58 0.28 -0.57 0.00 0.00 179.45 179.18 1nj6 n VAL 449 N -4.50 0.00 -3.31 0.50 0.31 -0.64 -4.99 118.33 105.70 1nj6 n VAL 449 Ca 0.14 -0.12 -0.10 0.00 -0.01 0.00 0.00 64.34 64.25 1nj6 n VAL 449 Cb 0.25 0.87 0.00 0.00 -0.91 0.00 0.00 33.84 34.05 1nj6 n VAL 449 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 1nj6 n ARG 450 N -0.77 -1.45 -3.83 5.55 0.00 0.29 -4.96 116.66 111.50 1nj6 n ARG 450 Ca 0.08 1.27 -0.06 0.00 -0.00 0.00 0.00 57.85 59.13 1nj6 n ARG 450 Cb 0.39 -4.49 -0.00 0.00 0.00 0.00 0.00 32.46 28.35 1nj6 n ARG 450 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 1nj6 s VAL 451 N -2.95 0.00 -0.03 5.15 0.11 -0.58 -4.91 120.40 117.20 1nj6 s VAL 451 Ca 0.02 -0.89 0.07 0.00 -2.93 0.00 0.00 61.98 58.25 1nj6 s VAL 451 Cb -0.00 -2.29 -0.02 0.00 -1.53 0.00 0.00 36.38 32.54 1nj6 s VAL 451 CO 0.80 0.00 -0.25 -0.62 -3.33 0.00 0.00 175.10 171.70 1nj6 s ASP 452 N -3.01 2.96 -0.47 3.54 -1.08 -0.60 -4.50 116.67 113.52 1nj6 s ASP 452 Ca 0.13 -0.46 -0.27 0.00 -0.52 0.00 0.00 52.55 51.43 1nj6 s ASP 452 Cb -0.04 -0.43 0.03 0.00 -1.46 0.00 0.00 42.92 41.02 1nj6 s ASP 452 CO 0.07 0.30 1.00 -0.63 0.52 0.00 0.00 175.17 176.42 1nj6 s ILE 453 N -0.50 4.37 0.12 4.11 1.01 -1.26 -1.62 121.20 127.43 1nj6 s ILE 453 Ca 0.07 0.89 -0.19 0.00 0.00 0.00 0.00 60.65 61.41 1nj6 s ILE 453 Cb -0.10 -4.50 -0.07 0.00 0.01 0.00 0.00 42.46 37.80 1nj6 s ILE 453 CO -0.00 -0.91 1.73 -0.07 0.00 0.00 0.00 174.94 175.69 1nj6 h LEU 454 N 10.82 0.27 0.00 2.97 3.38 -1.43 -3.45 115.31 127.88 1nj6 h LEU 454 Ca -0.24 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.67 1nj6 h LEU 454 Cb 1.07 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.75 1nj6 h LEU 454 CO 1.07 0.26 0.00 0.61 0.09 0.00 0.00 178.44 180.46 1nj6 n GLY 455 N -1.00 -2.27 3.78 0.83 0.00 -1.24 -4.33 105.19 100.96 1nj6 n GLY 455 Ca -0.03 -1.25 -0.26 0.00 0.00 0.00 0.00 46.02 44.48 1nj6 n GLY 455 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1nj6 s ILE 456 N -2.32 1.97 -0.28 -0.61 -5.25 -0.46 -2.41 121.20 111.84 1nj6 s ILE 456 Ca 0.00 -1.71 0.01 0.00 -0.99 0.00 0.00 60.65 57.96 1nj6 s ILE 456 Cb 0.00 -2.68 0.15 0.00 2.95 0.00 0.00 42.46 42.88 1nj6 s ILE 456 CO 0.00 0.00 0.36 -1.10 -1.79 0.00 0.00 174.94 172.41 1nj6 s GLN 457 N -3.98 0.37 0.20 0.37 -0.21 0.13 -1.27 119.66 115.27 1nj6 s GLN 457 Ca 0.34 0.07 -0.33 0.00 0.02 0.00 0.00 55.36 55.46 1nj6 s GLN 457 Cb 0.02 -0.46 -0.14 0.00 1.00 0.00 0.00 33.01 33.43 1nj6 s GLN 457 CO 0.19 -0.99 1.36 0.39 -2.12 0.00 0.00 175.29 174.12 1nj6 n GLU 458 N 5.34 1.75 -0.73 2.91 1.02 -1.26 -1.79 120.64 127.88 1nj6 n GLU 458 Ca -0.01 0.62 0.00 0.00 -0.02 0.00 0.00 57.16 57.76 1nj6 n GLU 458 Cb 0.48 -2.26 0.00 0.00 -0.02 0.00 0.00 31.44 29.65 1nj6 n GLU 458 CO 0.00 0.00 0.00 -0.85 1.18 0.00 0.00 177.13 177.46 1nj6 n GLU 459 N 2.21 0.00 -1.60 3.49 0.28 -1.20 -4.88 120.64 118.94 1nj6 n GLU 459 Ca 0.14 0.00 -0.38 0.00 -0.16 0.00 0.00 57.16 56.76 1nj6 n GLU 459 Cb 0.28 0.00 0.05 0.00 1.43 0.00 0.00 31.44 33.20 1nj6 n GLU 459 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1nj6 n GLY 460 N 0.00 -0.43 0.00 -1.84 0.00 -1.26 -4.69 105.19 96.97 1nj6 n GLY 460 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.92 1nj6 n GLY 460 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1nj6 n SER 461 N -0.45 -0.71 0.00 1.61 7.64 -1.26 -4.73 113.62 115.72 1nj6 n SER 461 Ca 0.13 -0.27 0.00 0.00 1.01 0.00 0.00 58.87 59.74 1nj6 n SER 461 Cb 0.46 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.66 1nj6 n SER 461 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1nj6 n GLY 462 N 2.14 -0.50 3.17 0.23 0.00 -0.86 -4.91 105.19 104.45 1nj6 n GLY 462 Ca 0.00 -0.85 -0.28 0.00 0.00 0.00 0.00 46.02 44.90 1nj6 n GLY 462 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1nj6 s THR 463 N -3.71 1.60 0.01 2.61 -4.23 -1.26 0.45 115.64 111.10 1nj6 s THR 463 Ca 0.00 -0.81 -0.32 0.00 -1.18 0.00 0.00 61.69 59.38 1nj6 s THR 463 Cb 0.00 -1.37 -0.10 0.00 1.34 0.00 0.00 72.50 72.37 1nj6 s THR 463 CO 0.00 0.45 1.91 0.00 -0.54 0.00 0.00 174.62 176.44 1nj6 h ILE 465 N 5.34 0.04 0.00 0.00 2.10 -1.54 0.27 117.51 123.72 1nj6 h ILE 465 Ca -0.49 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.45 1nj6 h ILE 465 Cb 1.25 0.33 0.00 0.00 -1.09 0.00 0.00 36.82 37.31 1nj6 h ILE 465 CO 0.94 0.00 -0.25 -3.20 -1.08 0.00 0.00 178.15 174.56 1nj6 n ASN 466 N -2.86 0.52 -0.65 2.19 4.05 -1.26 -3.83 115.26 113.41 1nj6 n ASN 466 Ca 0.03 0.09 0.10 0.00 0.45 0.00 0.00 54.58 55.24 1nj6 n ASN 466 Cb 0.78 -0.52 0.31 0.00 1.23 0.00 0.00 39.78 41.58 1nj6 n ASN 466 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1nj6 n GLY 468 N 1.17 0.04 1.64 0.00 0.00 0.93 -4.89 105.19 104.08 1nj6 n GLY 468 Ca 0.16 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.03 1nj6 n GLY 468 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nj6 n ARG 469 N -2.00 -2.75 -2.07 1.61 1.74 -1.26 -4.12 116.66 107.81 1nj6 n ARG 469 Ca 0.00 -0.79 -0.42 0.00 -0.77 0.00 0.00 57.85 55.87 1nj6 n ARG 469 Cb 0.00 -0.87 -0.03 0.00 -1.02 0.00 0.00 32.46 30.54 1nj6 n ARG 469 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 1nj6 s GLU 470 N -4.12 4.25 -0.48 5.56 2.12 -1.26 -0.43 118.70 124.34 1nj6 s GLU 470 Ca 0.34 2.17 -0.12 0.00 0.36 0.00 0.00 54.97 57.73 1nj6 s GLU 470 Cb -0.05 -3.45 0.11 0.00 0.26 0.00 0.00 34.13 31.01 1nj6 s GLU 470 CO 0.27 -0.60 0.38 0.00 -0.54 0.00 0.00 175.26 174.77 1nj6 s ALA 471 N 2.00 3.46 -0.14 6.30 0.00 0.17 -4.38 121.76 129.18 1nj6 s ALA 471 Ca 0.68 -2.43 0.21 0.00 0.00 0.00 0.00 51.96 50.42 1nj6 s ALA 471 Cb -0.37 -2.94 0.45 0.00 0.00 0.00 0.00 23.12 20.26 1nj6 s ALA 471 CO 0.30 -1.87 1.62 -1.35 0.00 0.00 0.00 175.76 174.46 1nj6 h PRO 472 N 8.59 0.00 -6.55 0.00 0.11 -1.79 -2.30 132.00 130.06 1nj6 h PRO 472 Ca -0.25 0.00 -0.64 0.00 0.11 0.00 0.00 66.00 65.22 1nj6 h PRO 472 Cb 1.09 0.00 -0.17 0.00 0.11 0.00 0.00 31.00 32.03 1nj6 h PRO 472 CO 0.89 0.26 -0.79 0.71 -0.21 0.00 0.00 178.00 178.87 1nj6 s TYR 473 N -3.26 2.43 -0.24 0.65 1.51 -1.16 -3.25 117.35 114.03 1nj6 s TYR 473 Ca 0.04 -0.31 -0.12 0.00 -1.01 0.00 0.00 57.07 55.67 1nj6 s TYR 473 Cb 0.08 -1.20 -0.05 0.00 -0.11 0.00 0.00 41.96 40.68 1nj6 s TYR 473 CO 0.68 0.50 0.23 0.50 -1.11 0.00 0.00 175.55 176.36 1nj6 s ARG 474 N -2.73 4.08 0.23 -0.62 6.06 -0.74 -1.29 118.95 123.94 1nj6 s ARG 474 Ca 0.22 -0.15 0.09 0.00 -2.50 0.00 0.00 55.73 53.39 1nj6 s ARG 474 Cb -0.08 -3.56 -0.05 0.00 0.06 0.00 0.00 34.95 31.32 1nj6 s ARG 474 CO 0.12 -0.01 -0.15 0.00 -2.50 0.00 0.00 175.30 172.76 1nj6 s ALA 475 N 1.26 2.23 0.10 6.12 0.00 0.14 0.23 121.76 131.83 1nj6 s ALA 475 Ca 0.11 -1.74 0.05 0.00 0.00 0.00 0.00 51.96 50.38 1nj6 s ALA 475 Cb -0.14 -0.11 -0.03 0.00 0.00 0.00 0.00 23.12 22.84 1nj6 s ALA 475 CO 0.06 0.11 -0.14 0.71 0.00 0.00 0.00 175.76 176.50 1nj6 s TYR 476 N -2.86 1.31 0.10 0.00 1.51 -1.01 -0.89 117.35 115.52 1nj6 s TYR 476 Ca 0.25 -0.54 -0.10 0.00 -1.01 0.00 0.00 57.07 55.68 1nj6 s TYR 476 Cb -0.01 -0.71 0.00 0.00 -0.11 0.00 0.00 41.96 41.13 1nj6 s TYR 476 CO 0.09 0.10 0.23 -0.48 -1.11 0.00 0.00 175.55 174.39 1nj6 s LEU 477 N -2.22 1.22 -0.02 -1.29 0.05 -0.81 -1.02 118.68 114.59 1nj6 s LEU 477 Ca 0.05 -0.64 -0.29 0.00 0.05 0.00 0.00 54.13 53.31 1nj6 s LEU 477 Cb -0.06 1.17 0.10 0.00 -2.05 0.00 0.00 46.19 45.35 1nj6 s LEU 477 CO 0.02 -0.77 1.29 0.00 -0.55 0.00 0.00 176.35 176.34 1nj6 s ALA 478 N -3.87 -2.42 -0.25 1.48 0.00 -0.64 -1.27 121.76 114.79 1nj6 s ALA 478 Ca 0.06 0.19 -0.19 0.00 0.00 0.00 0.00 51.96 52.02 1nj6 s ALA 478 Cb 0.04 0.77 -0.02 0.00 0.00 0.00 0.00 23.12 23.90 1nj6 s ALA 478 CO -0.10 -1.13 0.56 1.03 0.00 0.00 0.00 175.76 176.12 1nj6 s ARG 479 N -2.10 4.09 0.39 0.00 1.81 -1.26 -1.56 118.95 120.33 1nj6 s ARG 479 Ca 0.26 0.41 0.08 0.00 -1.72 0.00 0.00 55.73 54.76 1nj6 s ARG 479 Cb 0.01 -3.64 -0.04 0.00 -0.45 0.00 0.00 34.95 30.82 1nj6 s ARG 479 CO -0.01 -0.36 0.20 0.95 -0.68 0.00 0.00 175.30 175.40 1nj6 s THR 480 N 2.32 2.59 -2.49 0.02 -4.23 -1.26 -0.90 115.64 111.69 1nj6 s THR 480 Ca 0.23 -1.64 0.28 0.00 -1.18 0.00 0.00 61.69 59.39 1nj6 s THR 480 Cb -0.16 -2.99 0.56 0.00 1.34 0.00 0.00 72.50 71.26 1nj6 s THR 480 CO 0.09 -0.06 1.76 -1.22 -0.54 0.00 0.00 174.62 174.65