#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jb4 s VAL 4 N 0.00 5.23 0.64 -3.33 1.01 -1.26 -5.08 120.40 117.61 2jb4 s VAL 4 Ca 0.00 0.61 -0.16 0.00 0.00 0.00 0.00 61.98 62.43 2jb4 s VAL 4 Cb 0.00 -3.62 -0.01 0.00 0.00 0.00 0.00 36.38 32.75 2jb4 s VAL 4 CO 0.00 0.51 1.11 -0.44 0.00 0.00 0.00 175.10 176.29 2jb4 s SER 5 N -0.47 5.22 -0.01 3.32 0.01 -1.26 -4.76 113.70 115.74 2jb4 s SER 5 Ca 0.20 2.04 -0.29 0.00 1.31 0.00 0.00 55.95 59.20 2jb4 s SER 5 Cb -0.14 -2.56 -0.03 0.00 0.21 0.00 0.00 66.02 63.50 2jb4 s SER 5 CO 0.08 -1.55 0.95 -0.75 0.41 0.00 0.00 173.24 172.38 2jb4 s LYS 6 N -3.94 4.54 0.40 12.44 2.20 -1.26 -1.03 119.74 133.09 2jb4 s LYS 6 Ca 0.68 1.37 -0.25 0.00 -0.36 0.00 0.00 55.97 57.41 2jb4 s LYS 6 Cb -0.21 -3.46 -0.08 0.00 -1.51 0.00 0.00 37.83 32.56 2jb4 s LYS 6 CO 0.39 -0.05 1.17 0.00 -0.36 0.00 0.00 175.35 176.50 2jb4 s ALA 7 N 1.04 3.15 -0.52 3.13 0.00 0.39 -4.82 121.76 124.13 2jb4 s ALA 7 Ca 0.50 0.97 -0.28 0.00 0.00 0.00 0.00 51.96 53.15 2jb4 s ALA 7 Cb -0.21 -3.38 0.01 0.00 0.00 0.00 0.00 23.12 19.54 2jb4 s ALA 7 CO 0.27 -0.54 1.51 -0.80 0.00 0.00 0.00 175.76 176.20 2jb4 s ASN 8 N -1.14 6.02 -0.38 0.00 0.01 -1.26 -4.79 114.94 113.40 2jb4 s ASN 8 Ca 0.57 0.48 0.02 0.00 -0.71 0.00 0.00 52.86 53.22 2jb4 s ASN 8 Cb -0.31 -2.54 0.12 0.00 0.41 0.00 0.00 41.25 38.93 2jb4 s ASN 8 CO 0.38 -1.76 0.16 -0.69 -1.51 0.00 0.00 177.10 173.69 2jb4 s VAL 9 N 6.44 1.46 0.61 1.60 1.01 -1.26 -4.57 120.40 125.69 2jb4 s VAL 9 Ca 0.58 -2.17 -0.16 0.00 0.00 0.00 0.00 61.98 60.24 2jb4 s VAL 9 Cb -0.13 -2.05 -0.03 0.00 0.00 0.00 0.00 36.38 34.17 2jb4 s VAL 9 CO 0.26 -0.76 1.07 -2.16 0.00 0.00 0.00 175.10 173.52 2jb4 s PRO 10 N 0.84 3.17 -0.25 2.72 0.04 -1.26 -4.61 135.00 135.65 2jb4 s PRO 10 Ca 0.14 1.27 -0.16 0.00 0.04 0.00 0.00 61.00 62.28 2jb4 s PRO 10 Cb -0.21 -2.01 -0.03 0.00 0.04 0.00 0.00 34.50 32.29 2jb4 s PRO 10 CO -0.10 -0.94 0.44 0.15 0.04 0.00 0.00 177.00 176.59 2jb4 s LYS 11 N -4.06 4.08 -0.18 4.56 1.02 -1.26 -0.97 119.74 122.93 2jb4 s LYS 11 Ca 0.65 0.21 -0.00 0.00 0.02 0.00 0.00 55.97 56.84 2jb4 s LYS 11 Cb -0.18 -3.62 0.01 0.00 -0.52 0.00 0.00 37.83 33.52 2jb4 s LYS 11 CO 0.38 -0.24 -0.15 0.42 -0.92 0.00 0.00 175.35 174.84 2jb4 s ILE 12 N 1.95 2.51 -0.44 2.17 1.01 0.16 -4.96 121.20 123.60 2jb4 s ILE 12 Ca 0.19 -0.79 -0.28 0.00 0.00 0.00 0.00 60.65 59.76 2jb4 s ILE 12 Cb -0.15 -2.08 0.00 0.00 0.01 0.00 0.00 42.46 40.24 2jb4 s ILE 12 CO 0.09 0.51 1.54 -0.62 0.00 0.00 0.00 174.94 176.45 2jb4 s ASP 13 N 1.23 6.10 0.00 3.58 -1.08 -1.26 -1.10 116.67 124.15 2jb4 s ASP 13 Ca 0.03 0.78 0.27 0.00 -0.52 0.00 0.00 52.55 53.10 2jb4 s ASP 13 Cb -0.14 -2.54 0.77 0.00 -1.46 0.00 0.00 42.92 39.55 2jb4 s ASP 13 CO -0.08 -1.63 1.58 1.33 0.52 0.00 0.00 175.17 176.89 2jb4 n VAL 14 N 7.13 0.00 -0.05 1.11 0.24 -0.74 -4.46 118.33 121.56 2jb4 n VAL 14 Ca 0.17 -0.27 0.17 0.00 -2.04 0.00 0.00 64.34 62.38 2jb4 n VAL 14 Cb 0.48 0.70 0.61 0.00 -1.47 0.00 0.00 33.84 34.17 2jb4 n VAL 14 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 2jb4 h SER 15 N 2.54 0.16 0.24 -1.34 4.64 -1.75 -0.81 113.55 117.23 2jb4 h SER 15 Ca 0.00 0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2jb4 h SER 15 Cb 0.61 -0.02 -0.00 0.00 -0.31 0.00 0.00 62.40 62.67 2jb4 h SER 15 CO 0.00 0.09 -0.02 -0.65 -0.87 0.00 0.00 176.83 175.37 2jb4 h PRO 16 N 0.17 0.00 0.00 4.77 0.11 -1.92 -2.00 132.00 133.13 2jb4 h PRO 16 Ca 0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.39 2jb4 h PRO 16 Cb 0.88 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.99 2jb4 h PRO 16 CO -0.04 0.02 0.00 1.28 -0.21 0.00 0.00 178.00 179.05 2jb4 n LEU 17 N -3.32 0.31 -0.09 2.35 4.77 -0.31 -1.82 117.00 118.89 2jb4 n LEU 17 Ca -0.02 0.58 0.12 0.00 -0.03 0.00 0.00 56.01 56.66 2jb4 n LEU 17 Cb 0.14 -0.54 0.32 0.00 -2.33 0.00 0.00 43.42 41.02 2jb4 n LEU 17 CO 0.24 -0.40 0.56 0.49 -1.33 0.00 0.00 177.39 176.95 2jb4 n PHE 18 N -1.84 0.00 -2.70 -1.77 3.72 -0.75 -4.79 117.46 109.33 2jb4 n PHE 18 Ca 0.03 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.43 2jb4 n PHE 18 Cb 0.19 -0.21 0.00 0.00 -0.94 0.00 0.00 39.48 38.53 2jb4 n PHE 18 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2jb4 n GLY 19 N 1.43 5.86 0.14 1.37 0.00 -0.75 -5.08 105.19 108.15 2jb4 n GLY 19 Ca 0.08 -2.04 0.07 0.00 0.00 0.00 0.00 46.02 44.14 2jb4 n GLY 19 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2jb4 n ASP 20 N -0.04 2.40 -4.36 1.61 10.43 -1.26 -4.94 116.55 120.39 2jb4 n ASP 20 Ca 0.00 -2.78 -0.45 0.00 2.57 0.00 0.00 54.79 54.13 2jb4 n ASP 20 Cb 0.00 -0.32 -0.04 0.00 1.84 0.00 0.00 41.12 42.59 2jb4 n ASP 20 CO 0.00 0.00 0.00 -0.62 -1.07 0.00 0.00 177.20 175.51 2jb4 s ASP 21 N -2.27 6.24 0.17 -2.24 -1.08 -1.26 -4.94 116.67 111.29 2jb4 s ASP 21 Ca 0.24 -1.62 -0.09 0.00 -0.52 0.00 0.00 52.55 50.57 2jb4 s ASP 21 Cb 0.21 -2.28 0.05 0.00 -1.46 0.00 0.00 42.92 39.44 2jb4 s ASP 21 CO 0.03 -1.02 1.56 1.56 0.52 0.00 0.00 175.17 177.82 2jb4 h GLN 22 N 9.02 0.93 -0.69 4.34 1.08 -1.94 -1.35 115.11 126.51 2jb4 h GLN 22 Ca -0.25 -0.41 -0.02 0.00 -1.45 0.00 0.00 58.65 56.52 2jb4 h GLN 22 Cb 1.08 -0.03 -0.03 0.00 -0.05 0.00 0.00 27.48 28.46 2jb4 h GLN 22 CO 1.07 1.07 0.34 0.00 -0.95 0.00 0.00 178.83 180.36 2jb4 h ALA 23 N 0.91 0.88 -0.81 3.87 0.00 -1.99 -1.10 119.26 121.02 2jb4 h ALA 23 Ca 0.10 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 2jb4 h ALA 23 Cb 0.81 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 18.29 2jb4 h ALA 23 CO 0.07 0.43 0.46 0.00 0.00 0.00 0.00 179.25 180.21 2jb4 h ALA 24 N 1.16 1.03 -0.70 0.00 0.00 -1.89 -1.20 119.26 117.66 2jb4 h ALA 24 Ca 0.24 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 2jb4 h ALA 24 Cb 0.10 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.53 2jb4 h ALA 24 CO -0.03 0.52 0.27 0.87 0.00 0.00 0.00 179.25 180.88 2jb4 h LYS 25 N 1.11 1.04 -0.51 0.00 1.57 -0.77 -2.10 116.57 116.92 2jb4 h LYS 25 Ca 0.29 -0.18 -0.03 0.00 -1.87 0.00 0.00 60.65 58.85 2jb4 h LYS 25 Cb 0.00 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.12 2jb4 h LYS 25 CO -0.05 0.85 0.18 0.52 -0.57 0.00 0.00 179.45 180.38 2jb4 h MET 26 N 1.01 0.74 -0.01 3.15 2.86 -0.44 -0.32 114.93 121.94 2jb4 h MET 26 Ca 0.23 -0.12 -0.10 0.00 -2.06 0.00 0.00 59.70 57.66 2jb4 h MET 26 Cb 0.21 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 31.73 2jb4 h MET 26 CO -0.02 0.64 -0.46 0.00 1.06 0.00 0.00 176.91 178.13 2jb4 h ARG 27 N 0.73 0.01 -0.33 1.72 3.08 -0.86 -0.33 114.38 118.40 2jb4 h ARG 27 Ca 0.17 -0.01 -0.08 0.00 0.07 0.00 0.00 59.98 60.14 2jb4 h ARG 27 Cb 0.19 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.23 2jb4 h ARG 27 CO -0.01 0.47 -0.09 0.28 -1.07 0.00 0.00 179.97 179.55 2jb4 h VAL 28 N 0.01 1.28 -0.98 2.04 2.07 -0.94 -3.06 116.25 116.66 2jb4 h VAL 28 Ca -0.00 -1.15 0.07 0.00 0.82 0.00 0.00 66.70 66.44 2jb4 h VAL 28 Cb 0.82 1.35 -0.07 0.00 -1.52 0.00 0.00 31.29 31.87 2jb4 h VAL 28 CO 0.06 0.37 0.64 0.00 0.02 0.00 0.00 177.57 178.66 2jb4 h ALA 29 N 0.80 1.45 -0.73 1.67 0.00 -0.53 -0.63 119.26 121.29 2jb4 h ALA 29 Ca 0.08 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 2jb4 h ALA 29 Cb 0.59 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 2jb4 h ALA 29 CO 0.03 0.40 0.38 0.37 0.00 0.00 0.00 179.25 180.43 2jb4 h GLN 30 N 1.12 1.03 -0.42 0.00 -0.00 -1.06 0.47 115.11 116.25 2jb4 h GLN 30 Ca 0.43 -0.13 -0.12 0.00 -0.00 0.00 0.00 58.65 58.84 2jb4 h GLN 30 Cb 0.22 -0.20 -0.01 0.00 0.00 0.00 0.00 27.48 27.48 2jb4 h GLN 30 CO -0.18 0.77 -0.21 1.96 0.00 0.00 0.00 178.83 181.17 2jb4 h GLN 31 N 1.03 0.83 -0.40 1.69 4.20 -1.06 -0.59 115.11 120.80 2jb4 h GLN 31 Ca 0.26 -0.34 -0.02 0.00 0.06 0.00 0.00 58.65 58.61 2jb4 h GLN 31 Cb 0.06 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 27.79 2jb4 h GLN 31 CO -0.04 0.97 0.18 0.82 -0.67 0.00 0.00 178.83 180.08 2jb4 h ILE 32 N 0.72 1.19 -0.14 2.54 2.04 -0.73 -1.51 117.51 121.61 2jb4 h ILE 32 Ca 0.10 -0.55 0.04 0.00 1.00 0.00 0.00 64.86 65.45 2jb4 h ILE 32 Cb 0.74 0.81 -0.05 0.00 -0.74 0.00 0.00 36.82 37.58 2jb4 h ILE 32 CO 0.06 0.20 -0.15 -0.78 0.00 0.00 0.00 178.15 177.48 2jb4 h ASP 33 N 0.50 -0.46 -0.67 1.72 3.58 -0.70 -0.15 116.42 120.24 2jb4 h ASP 33 Ca 0.13 0.09 -0.01 0.00 0.42 0.00 0.00 57.03 57.66 2jb4 h ASP 33 Cb 0.16 0.22 -0.03 0.00 1.72 0.00 0.00 39.33 41.40 2jb4 h ASP 33 CO -0.01 -0.19 0.36 0.00 -2.88 0.00 0.00 179.24 176.52 2jb4 h ALA 34 N 0.89 0.86 -0.41 -0.78 0.00 -0.92 -1.32 119.26 117.57 2jb4 h ALA 34 Ca 0.10 -0.11 -0.10 0.00 0.00 0.00 0.00 54.91 54.79 2jb4 h ALA 34 Cb 0.32 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 2jb4 h ALA 34 CO -0.24 0.38 -0.17 0.00 0.00 0.00 0.00 179.25 179.21 2jb4 h ALA 35 N 1.18 0.93 0.00 0.00 0.00 -1.05 -2.21 119.26 118.11 2jb4 h ALA 35 Ca 0.23 -0.35 -0.08 0.00 0.00 0.00 0.00 54.91 54.72 2jb4 h ALA 35 Cb 0.05 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 2jb4 h ALA 35 CO -0.04 0.62 -0.39 0.77 0.00 0.00 0.00 179.25 180.21 2jb4 h SER 36 N 0.69 0.00 0.83 0.00 0.02 -0.67 -0.34 113.55 114.08 2jb4 h SER 36 Ca 0.11 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.06 2jb4 h SER 36 Cb 0.67 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.21 2jb4 h SER 36 CO 0.05 0.39 -0.51 0.54 -1.14 0.00 0.00 176.83 176.15 2jb4 n ARG 37 N -3.69 0.20 0.00 3.45 1.74 -0.53 -4.33 116.66 113.50 2jb4 n ARG 37 Ca -0.01 0.07 0.00 0.00 -0.77 0.00 0.00 57.85 57.14 2jb4 n ARG 37 Cb 0.48 -1.64 0.00 0.00 -1.02 0.00 0.00 32.46 30.28 2jb4 n ARG 37 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 2jb4 n ASP 38 N -1.94 0.00 0.19 0.55 2.03 -0.85 -4.90 116.55 111.62 2jb4 n ASP 38 Ca 0.04 0.00 0.12 0.00 0.52 0.00 0.00 54.79 55.47 2jb4 n ASP 38 Cb 0.41 0.00 0.15 0.00 -0.72 0.00 0.00 41.12 40.96 2jb4 n ASP 38 CO 0.00 0.00 0.00 0.71 -1.92 0.00 0.00 177.20 175.99 2jb4 h THR 39 N 0.00 0.00 0.00 5.18 1.35 -1.79 -3.47 112.91 114.18 2jb4 h THR 39 Ca 0.00 -0.96 0.00 0.00 -0.55 0.00 0.00 66.41 64.90 2jb4 h THR 39 Cb 0.00 1.85 0.00 0.00 -1.73 0.00 0.00 68.15 68.27 2jb4 h THR 39 CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 2jb4 n GLY 40 N 1.13 0.64 3.28 5.82 0.00 -0.19 -4.80 105.19 111.08 2jb4 n GLY 40 Ca 0.03 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.80 2jb4 n GLY 40 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2jb4 s PHE 41 N -2.45 1.86 0.09 1.61 0.40 -1.26 -4.09 117.98 114.14 2jb4 s PHE 41 Ca 0.00 -0.40 -0.12 0.00 -0.60 0.00 0.00 56.93 55.81 2jb4 s PHE 41 Cb 0.00 -1.05 0.01 0.00 0.51 0.00 0.00 43.02 42.49 2jb4 s PHE 41 CO 0.00 0.17 0.27 -0.59 0.70 0.00 0.00 175.22 175.78 2jb4 s PHE 42 N -1.01 -0.01 -0.18 0.36 -0.71 -0.88 -4.25 117.98 111.29 2jb4 s PHE 42 Ca 0.08 -0.31 -0.15 0.00 -1.04 0.00 0.00 56.93 55.50 2jb4 s PHE 42 Cb -0.10 0.06 -0.04 0.00 -1.21 0.00 0.00 43.02 41.74 2jb4 s PHE 42 CO 0.03 -0.57 0.36 0.71 -1.34 0.00 0.00 175.22 174.42 2jb4 s TYR 43 N -3.48 3.41 -0.20 3.49 2.02 -0.15 -0.55 117.35 121.89 2jb4 s TYR 43 Ca 0.02 0.62 -0.25 0.00 -0.37 0.00 0.00 57.07 57.09 2jb4 s TYR 43 Cb 0.02 -2.46 -0.01 0.00 -0.40 0.00 0.00 41.96 39.11 2jb4 s TYR 43 CO -0.09 0.08 0.82 0.00 -1.57 0.00 0.00 175.55 174.79 2jb4 s ALA 44 N 0.98 3.58 0.32 3.71 0.00 0.75 -0.67 121.76 130.42 2jb4 s ALA 44 Ca 0.18 -0.05 0.10 0.00 0.00 0.00 0.00 51.96 52.19 2jb4 s ALA 44 Cb -0.14 -3.24 -0.06 0.00 0.00 0.00 0.00 23.12 19.68 2jb4 s ALA 44 CO 0.07 -0.76 -0.12 0.14 0.00 0.00 0.00 175.76 175.09 2jb4 s VAL 45 N 2.43 2.21 -1.37 0.00 -7.23 -0.25 -1.72 120.40 114.47 2jb4 s VAL 45 Ca 0.36 -2.25 -0.09 0.00 -1.81 0.00 0.00 61.98 58.20 2jb4 s VAL 45 Cb -0.16 -2.52 0.02 0.00 0.56 0.00 0.00 36.38 34.28 2jb4 s VAL 45 CO 0.10 -0.28 1.16 0.59 -0.31 0.00 0.00 175.10 176.37 2jb4 n ASN 46 N -0.71 -6.07 0.04 4.85 3.02 -1.26 -1.79 115.26 113.33 2jb4 n ASN 46 Ca -0.05 -0.57 0.12 0.00 -0.03 0.00 0.00 54.58 54.06 2jb4 n ASN 46 Cb 0.63 -4.94 0.30 0.00 -0.61 0.00 0.00 39.78 35.15 2jb4 n ASN 46 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2jb4 n HIS 47 N -4.95 0.36 -0.77 3.10 1.44 -1.26 -3.75 115.22 109.38 2jb4 n HIS 47 Ca -0.00 0.11 0.00 0.00 -2.01 0.00 0.00 57.72 55.81 2jb4 n HIS 47 Cb 0.56 -0.56 0.00 0.00 0.12 0.00 0.00 29.99 30.12 2jb4 n HIS 47 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2jb4 n GLY 48 N 1.41 1.27 3.83 -1.39 0.00 -1.26 -4.90 105.19 104.15 2jb4 n GLY 48 Ca 0.05 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.69 2jb4 n GLY 48 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jb4 s ILE 49 N -3.71 5.06 -1.11 -0.61 1.01 -1.26 -5.01 121.20 115.58 2jb4 s ILE 49 Ca 0.00 0.81 -0.21 0.00 0.00 0.00 0.00 60.65 61.26 2jb4 s ILE 49 Cb 0.00 -3.70 0.07 0.00 0.01 0.00 0.00 42.46 38.84 2jb4 s ILE 49 CO 0.00 0.56 1.52 0.21 0.00 0.00 0.00 174.94 177.23 2jb4 s ASN 50 N -0.94 6.65 0.30 3.58 3.84 -1.26 -4.81 114.94 122.30 2jb4 s ASN 50 Ca 0.23 -1.90 0.16 0.00 0.21 0.00 0.00 52.86 51.56 2jb4 s ASN 50 Cb -0.16 -2.55 0.31 0.00 -0.55 0.00 0.00 41.25 38.30 2jb4 s ASN 50 CO 0.13 -1.33 1.56 -0.37 -2.79 0.00 0.00 177.10 174.30 2jb4 h VAL 51 N 6.22 1.00 -0.68 -5.21 -1.51 -1.94 -2.27 116.25 111.86 2jb4 h VAL 51 Ca 0.28 -2.06 -0.07 0.00 -1.23 0.00 0.00 66.70 63.62 2jb4 h VAL 51 Cb 0.96 2.25 -0.03 0.00 -2.13 0.00 0.00 31.29 32.34 2jb4 h VAL 51 CO 1.40 0.50 0.14 -0.61 -1.23 0.00 0.00 177.57 177.77 2jb4 h GLN 52 N 0.00 1.09 -0.18 5.19 -0.00 -1.88 -0.81 115.11 118.53 2jb4 h GLN 52 Ca -0.01 -0.27 -0.20 0.00 -0.00 0.00 0.00 58.65 58.18 2jb4 h GLN 52 Cb 1.21 -0.14 0.00 0.00 0.00 0.00 0.00 27.48 28.55 2jb4 h GLN 52 CO 0.07 0.98 -0.68 -0.09 0.00 0.00 0.00 178.83 179.11 2jb4 h ARG 53 N 1.03 0.70 -0.42 1.69 2.43 -1.94 -0.73 114.38 117.14 2jb4 h ARG 53 Ca 0.21 -0.51 0.09 0.00 -0.81 0.00 0.00 59.98 58.95 2jb4 h ARG 53 Cb 0.40 0.09 -0.08 0.00 -0.42 0.00 0.00 29.97 29.96 2jb4 h ARG 53 CO 0.01 1.13 -0.11 1.25 -1.51 0.00 0.00 179.97 180.74 2jb4 h LEU 54 N 0.50 -0.41 -0.73 3.80 5.85 -1.23 -0.12 115.31 122.98 2jb4 h LEU 54 Ca -0.02 0.13 -0.09 0.00 0.84 0.00 0.00 57.88 58.74 2jb4 h LEU 54 Cb 1.27 0.27 -0.02 0.00 0.37 0.00 0.00 40.66 42.55 2jb4 h LEU 54 CO 0.13 -0.15 -0.02 -1.28 -0.34 0.00 0.00 178.44 176.79 2jb4 h SER 55 N -0.01 0.93 -0.25 1.25 0.87 -0.84 -1.16 113.55 114.35 2jb4 h SER 55 Ca 0.20 -0.26 -0.03 0.00 -1.23 0.00 0.00 61.79 60.48 2jb4 h SER 55 Cb 0.32 -0.25 -0.01 0.00 -0.44 0.00 0.00 62.40 62.02 2jb4 h SER 55 CO -0.44 1.00 0.05 -0.61 -0.53 0.00 0.00 176.83 176.29 2jb4 h GLN 56 N 0.87 0.41 -0.46 2.24 5.75 -0.70 -0.66 115.11 122.57 2jb4 h GLN 56 Ca 0.16 -0.11 -0.11 0.00 -0.15 0.00 0.00 58.65 58.44 2jb4 h GLN 56 Cb 0.54 -0.05 -0.02 0.00 1.07 0.00 0.00 27.48 29.02 2jb4 h GLN 56 CO 0.03 0.53 -0.15 0.87 -2.65 0.00 0.00 178.83 177.46 2jb4 h LYS 57 N 0.23 0.87 -0.58 1.69 1.79 -0.95 -1.16 116.57 118.45 2jb4 h LYS 57 Ca 0.08 -0.32 -0.08 0.00 -2.18 0.00 0.00 60.65 58.15 2jb4 h LYS 57 Cb 0.32 -0.05 -0.02 0.00 -1.58 0.00 0.00 32.23 30.89 2jb4 h LYS 57 CO 0.00 0.96 0.06 1.15 -1.08 0.00 0.00 179.45 180.55 2jb4 h THR 58 N 0.77 1.26 -0.56 -0.16 2.02 -1.12 -2.22 112.91 112.90 2jb4 h THR 58 Ca 0.12 -1.04 -0.00 0.00 0.77 0.00 0.00 66.41 66.26 2jb4 h THR 58 Cb 0.68 0.79 -0.03 0.00 -1.74 0.00 0.00 68.15 67.85 2jb4 h THR 58 CO 0.05 0.38 0.34 0.50 0.37 0.00 0.00 175.52 177.16 2jb4 h LYS 59 N 0.88 0.76 -0.98 6.66 3.64 -0.86 -0.49 116.57 126.18 2jb4 h LYS 59 Ca 0.17 -0.07 0.03 0.00 -1.27 0.00 0.00 60.65 59.51 2jb4 h LYS 59 Cb 0.46 -0.16 -0.05 0.00 -0.41 0.00 0.00 32.23 32.07 2jb4 h LYS 59 CO 0.02 0.55 0.64 0.93 -2.27 0.00 0.00 179.45 179.32 2jb4 h GLU 60 N 0.76 1.23 0.28 1.90 5.08 -1.04 -0.42 114.58 122.38 2jb4 h GLU 60 Ca 0.20 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.47 2jb4 h GLU 60 Cb -0.02 -0.28 0.00 0.00 0.50 0.00 0.00 28.75 28.95 2jb4 h GLU 60 CO -0.04 0.82 -0.14 0.35 -1.00 0.00 0.00 179.01 179.00 2jb4 h PHE 61 N 1.27 -0.35 -0.66 4.33 3.57 -1.05 -2.70 116.94 121.35 2jb4 h PHE 61 Ca 0.38 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.86 2jb4 h PHE 61 Cb -0.06 0.12 -0.03 0.00 2.79 0.00 0.00 35.95 38.76 2jb4 h PHE 61 CO -0.00 -0.07 0.36 0.45 -2.23 0.00 0.00 178.31 176.82 2jb4 h HIS 62 N -0.62 0.88 0.00 0.41 3.86 -0.76 -1.53 115.15 117.39 2jb4 h HIS 62 Ca -0.04 -0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.16 2jb4 h HIS 62 Cb 0.44 -0.29 0.00 0.00 1.06 0.00 0.00 27.41 28.63 2jb4 h HIS 62 CO 0.00 0.61 -0.31 -1.33 0.86 0.00 0.00 177.93 177.76 2jb4 n MET 63 N -4.38 0.27 -0.00 2.45 2.81 -0.20 -4.04 117.12 114.04 2jb4 n MET 63 Ca 0.06 0.15 0.07 0.00 -1.81 0.00 0.00 57.70 56.17 2jb4 n MET 63 Cb 0.09 -1.74 -0.10 0.00 -0.71 0.00 0.00 33.22 30.77 2jb4 n MET 63 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 2jb4 n SER 64 N -2.18 1.50 -4.77 7.83 3.41 -0.97 -4.99 113.62 113.45 2jb4 n SER 64 Ca 0.04 -0.24 -0.40 0.00 -0.26 0.00 0.00 58.87 58.02 2jb4 n SER 64 Cb 0.43 1.44 -0.01 0.00 -0.26 0.00 0.00 64.21 65.81 2jb4 n SER 64 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 175.04 174.37 2jb4 s ILE 65 N -2.75 2.70 0.29 -1.33 2.07 -0.61 -5.00 121.20 116.56 2jb4 s ILE 65 Ca -0.02 0.67 0.07 0.00 -1.41 0.00 0.00 60.65 59.96 2jb4 s ILE 65 Cb 0.09 -3.41 -0.03 0.00 0.13 0.00 0.00 42.46 39.24 2jb4 s ILE 65 CO 0.56 0.13 0.21 0.42 -1.91 0.00 0.00 174.94 174.35 2jb4 s THR 66 N -1.21 3.98 0.33 4.00 -4.23 -1.26 -4.97 115.64 112.27 2jb4 s THR 66 Ca 0.53 -1.45 0.07 0.00 -1.18 0.00 0.00 61.69 59.66 2jb4 s THR 66 Cb -0.38 -3.26 0.31 0.00 1.34 0.00 0.00 72.50 70.50 2jb4 s THR 66 CO 0.50 -0.28 1.84 -0.65 -0.54 0.00 0.00 174.62 175.49 2jb4 h PRO 67 N 1.44 0.75 -0.21 3.99 0.11 -2.00 -1.46 132.00 134.63 2jb4 h PRO 67 Ca -0.47 -0.05 0.01 0.00 0.11 0.00 0.00 66.00 65.60 2jb4 h PRO 67 Cb 1.25 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 2jb4 h PRO 67 CO 0.60 0.50 0.13 1.49 -0.21 0.00 0.00 178.00 180.51 2jb4 h GLU 68 N 0.78 0.26 -0.45 1.05 4.81 -2.00 -2.30 114.58 116.73 2jb4 h GLU 68 Ca 0.50 -0.02 -0.07 0.00 -0.13 0.00 0.00 59.36 59.64 2jb4 h GLU 68 Cb 0.73 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 30.03 2jb4 h GLU 68 CO -0.26 0.17 0.00 0.93 -0.73 0.00 0.00 179.01 179.13 2jb4 h GLU 69 N 0.27 0.72 -0.50 1.92 5.08 -1.73 -2.29 114.58 118.05 2jb4 h GLU 69 Ca 0.08 -0.18 -0.01 0.00 -1.00 0.00 0.00 59.36 58.25 2jb4 h GLU 69 Cb -0.02 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.12 2jb4 h GLU 69 CO -0.03 0.74 0.28 0.87 -1.00 0.00 0.00 179.01 179.86 2jb4 h LYS 70 N 0.68 0.69 -0.76 2.33 1.57 -0.93 -1.38 116.57 118.77 2jb4 h LYS 70 Ca 0.14 -0.08 -0.02 0.00 -1.87 0.00 0.00 60.65 58.82 2jb4 h LYS 70 Cb 0.42 -0.14 -0.04 0.00 0.08 0.00 0.00 32.23 32.55 2jb4 h LYS 70 CO 0.02 0.53 0.39 -1.49 -0.57 0.00 0.00 179.45 178.33 2jb4 h TRP 71 N 0.66 1.07 0.00 -1.35 -0.00 -1.22 -1.17 115.95 113.94 2jb4 h TRP 71 Ca 0.18 -0.04 -0.01 0.00 -0.00 0.00 0.00 58.89 59.01 2jb4 h TRP 71 Cb 0.03 -0.34 -0.00 0.00 -0.00 0.00 0.00 29.16 28.86 2jb4 h TRP 71 CO -0.02 0.77 -0.07 -0.44 -0.00 0.00 0.00 178.44 178.67 2jb4 h ASP 72 N 1.06 0.00 -0.02 -3.49 3.32 -0.93 -2.68 116.42 113.68 2jb4 h ASP 72 Ca 0.26 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.31 2jb4 h ASP 72 Cb 0.07 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.62 2jb4 h ASP 72 CO -0.04 0.07 -0.20 0.18 -1.72 0.00 0.00 179.24 177.53 2jb4 n LEU 73 N -3.26 2.08 -4.77 1.55 4.77 -0.56 -5.05 117.00 111.76 2jb4 n LEU 73 Ca -0.00 -0.87 -0.40 0.00 -0.03 0.00 0.00 56.01 54.71 2jb4 n LEU 73 Cb 0.29 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.37 2jb4 n LEU 73 CO 0.28 0.38 0.98 0.00 -1.33 0.00 0.00 177.39 177.70 2jb4 s ALA 74 N -1.81 3.30 0.98 -1.18 0.00 -0.47 -0.89 121.76 121.69 2jb4 s ALA 74 Ca 0.18 1.27 -0.12 0.00 0.00 0.00 0.00 51.96 53.29 2jb4 s ALA 74 Cb 0.15 -3.50 0.18 0.00 0.00 0.00 0.00 23.12 19.95 2jb4 s ALA 74 CO 0.35 -0.83 1.09 0.96 0.00 0.00 0.00 175.76 177.32 2jb4 s ILE 75 N -1.24 2.34 0.53 0.00 -4.36 -0.60 -4.67 121.20 113.21 2jb4 s ILE 75 Ca 0.56 0.11 0.28 0.00 -0.26 0.00 0.00 60.65 61.34 2jb4 s ILE 75 Cb -0.39 -2.37 0.33 0.00 1.25 0.00 0.00 42.46 41.29 2jb4 s ILE 75 CO 0.51 -0.14 2.19 0.08 0.24 0.00 0.00 174.94 177.82 2jb4 h ARG 76 N -1.94 0.00 0.00 0.37 0.11 -0.96 -0.55 114.38 111.42 2jb4 h ARG 76 Ca -0.52 0.00 -0.02 0.00 0.10 0.00 0.00 59.98 59.54 2jb4 h ARG 76 Cb 1.29 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.37 2jb4 h ARG 76 CO 0.50 0.04 -0.10 0.00 0.10 0.00 0.00 179.97 180.51 2jb4 h ALA 77 N 1.96 1.34 0.00 0.08 0.00 -1.91 -3.03 119.26 117.70 2jb4 h ALA 77 Ca -0.00 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2jb4 h ALA 77 Cb 0.11 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.89 2jb4 h ALA 77 CO 0.01 0.13 -1.51 0.66 0.00 0.00 0.00 179.25 178.53 2jb4 n TYR 78 N -3.70 0.00 -3.57 0.00 4.01 -0.31 -4.93 117.16 108.65 2jb4 n TYR 78 Ca -0.02 0.00 -0.27 0.00 -0.16 0.00 0.00 57.90 57.45 2jb4 n TYR 78 Cb 0.21 -0.27 -0.16 0.00 -0.31 0.00 0.00 39.34 38.81 2jb4 n TYR 78 CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 2jb4 s ASN 79 N -3.37 2.85 0.47 7.72 3.84 -0.60 -5.01 114.94 120.83 2jb4 s ASN 79 Ca -0.04 -0.92 0.32 0.00 0.21 0.00 0.00 52.86 52.43 2jb4 s ASN 79 Cb 0.08 -0.25 1.63 0.00 -0.55 0.00 0.00 41.25 42.17 2jb4 s ASN 79 CO 0.53 -0.39 1.97 0.11 -2.79 0.00 0.00 177.10 176.52 2jb4 h LYS 80 N 8.41 0.00 0.00 0.43 1.57 -1.86 -1.64 116.57 123.48 2jb4 h LYS 80 Ca -0.17 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.61 2jb4 h LYS 80 Cb 1.08 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.39 2jb4 h LYS 80 CO 0.36 0.00 0.00 0.93 -0.57 0.00 0.00 179.45 180.17 2jb4 h GLU 81 N 0.00 0.00 -2.33 3.15 5.08 -1.95 -3.36 114.58 115.18 2jb4 h GLU 81 Ca 0.00 0.00 -0.75 0.00 -1.00 0.00 0.00 59.36 57.61 2jb4 h GLU 81 Cb 0.11 0.00 -0.31 0.00 0.50 0.00 0.00 28.75 29.05 2jb4 h GLU 81 CO 0.00 0.00 0.57 0.72 -1.00 0.00 0.00 179.01 179.30 2jb4 n HIS 82 N -2.80 3.04 0.29 4.33 8.25 -0.61 -4.83 115.22 122.88 2jb4 n HIS 82 Ca 0.02 -2.94 0.18 0.00 -0.26 0.00 0.00 57.72 54.71 2jb4 n HIS 82 Cb 0.33 -1.02 0.87 0.00 1.12 0.00 0.00 29.99 31.29 2jb4 n HIS 82 CO 0.00 0.00 0.00 1.96 0.64 0.00 0.00 176.34 178.94 2jb4 h GLN 83 N 4.06 0.00 -0.00 -0.41 1.08 -1.81 -1.51 115.11 116.52 2jb4 h GLN 83 Ca 0.40 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.60 2jb4 h GLN 83 Cb 0.40 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.83 2jb4 h GLN 83 CO 1.10 0.04 -0.11 -0.25 -0.95 0.00 0.00 178.83 178.66 2jb4 n ASP 84 N -3.24 0.14 -4.35 1.46 8.00 -1.26 -4.58 116.55 112.72 2jb4 n ASP 84 Ca -0.01 0.21 -0.46 0.00 0.71 0.00 0.00 54.79 55.24 2jb4 n ASP 84 Cb 0.21 -0.30 -0.01 0.00 -0.02 0.00 0.00 41.12 41.00 2jb4 n ASP 84 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 2jb4 s GLN 85 N -2.92 3.86 -0.16 -1.24 -0.21 -0.57 -4.78 119.66 113.64 2jb4 s GLN 85 Ca 0.16 -2.69 -0.15 0.00 0.02 0.00 0.00 55.36 52.69 2jb4 s GLN 85 Cb 0.19 -4.56 -0.23 0.00 1.00 0.00 0.00 33.01 29.41 2jb4 s GLN 85 CO 0.55 -1.35 0.30 0.28 -2.12 0.00 0.00 175.29 172.95 2jb4 h VAL 86 N 4.45 0.80 0.00 1.09 2.07 -1.83 0.64 116.25 123.46 2jb4 h VAL 86 Ca 0.15 -2.26 -0.28 0.00 0.82 0.00 0.00 66.70 65.13 2jb4 h VAL 86 Cb 0.97 2.37 -0.04 0.00 -1.52 0.00 0.00 31.29 33.06 2jb4 h VAL 86 CO 0.91 0.58 -1.89 0.54 0.02 0.00 0.00 177.57 177.73 2jb4 n ARG 87 N -4.00 0.49 -3.24 1.57 1.74 -1.26 -4.76 116.66 107.19 2jb4 n ARG 87 Ca -0.32 0.21 -0.38 0.00 -0.77 0.00 0.00 57.85 56.59 2jb4 n ARG 87 Cb 0.85 -1.34 -0.06 0.00 -1.02 0.00 0.00 32.46 30.90 2jb4 n ARG 87 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2jb4 s ALA 88 N -2.54 3.47 0.00 7.54 0.00 -1.26 -4.67 121.76 124.29 2jb4 s ALA 88 Ca -0.31 -0.07 0.00 0.00 0.00 0.00 0.00 51.96 51.58 2jb4 s ALA 88 Cb 0.10 -2.71 0.00 0.00 0.00 0.00 0.00 23.12 20.51 2jb4 s ALA 88 CO 0.41 0.06 0.00 0.41 0.00 0.00 0.00 175.76 176.64 2jb4 n GLY 89 N 2.90 0.78 3.80 0.00 0.00 -0.22 -4.64 105.19 107.80 2jb4 n GLY 89 Ca -0.06 -2.05 -0.39 0.00 0.00 0.00 0.00 46.02 43.52 2jb4 n GLY 89 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2jb4 s TYR 90 N -1.65 3.75 -0.34 1.61 6.14 -0.07 -1.04 117.35 125.75 2jb4 s TYR 90 Ca 0.00 1.19 -0.01 0.00 0.64 0.00 0.00 57.07 58.89 2jb4 s TYR 90 Cb 0.00 -2.49 0.08 0.00 0.42 0.00 0.00 41.96 39.97 2jb4 s TYR 90 CO 0.00 0.52 0.07 0.71 0.64 0.00 0.00 175.55 177.49 2jb4 s TYR 91 N -0.80 3.46 0.49 4.97 1.51 0.84 -1.56 117.35 126.27 2jb4 s TYR 91 Ca 0.28 -2.29 -0.19 0.00 -1.01 0.00 0.00 57.07 53.86 2jb4 s TYR 91 Cb -0.18 -2.61 -0.08 0.00 -0.11 0.00 0.00 41.96 38.97 2jb4 s TYR 91 CO 0.17 -0.89 1.01 -0.51 -1.11 0.00 0.00 175.55 174.22 2jb4 s LEU 92 N 1.14 3.79 0.80 -1.29 1.02 -1.26 -1.45 118.68 121.44 2jb4 s LEU 92 Ca 0.02 1.79 -0.12 0.00 0.02 0.00 0.00 54.13 55.84 2jb4 s LEU 92 Cb -0.21 -4.54 0.07 0.00 0.02 0.00 0.00 46.19 41.54 2jb4 s LEU 92 CO -0.04 -0.69 1.14 -0.94 0.02 0.00 0.00 176.35 175.85 2jb4 s SER 93 N -2.30 4.53 -0.36 2.29 1.04 -1.24 -4.79 113.70 112.85 2jb4 s SER 93 Ca 0.64 0.96 0.00 0.00 0.48 0.00 0.00 55.95 58.04 2jb4 s SER 93 Cb -0.13 -1.57 0.12 0.00 0.10 0.00 0.00 66.02 64.53 2jb4 s SER 93 CO 0.22 -1.91 0.16 -0.63 0.98 0.00 0.00 173.24 172.05 2jb4 s ILE 94 N -3.42 1.06 0.23 -1.02 1.01 -0.25 -4.97 121.20 113.85 2jb4 s ILE 94 Ca 0.61 -1.88 -0.31 0.00 0.00 0.00 0.00 60.65 59.08 2jb4 s ILE 94 Cb -0.12 -1.78 -0.14 0.00 0.01 0.00 0.00 42.46 40.43 2jb4 s ILE 94 CO 0.51 -0.78 1.24 -2.65 0.00 0.00 0.00 174.94 173.27 2jb4 n PRO 95 N 4.29 1.62 0.00 2.79 -0.02 -1.26 -0.34 135.00 142.08 2jb4 n PRO 95 Ca 0.03 0.57 0.00 0.00 -2.02 0.00 0.00 63.50 62.08 2jb4 n PRO 95 Cb 0.39 -2.12 0.00 0.00 -0.02 0.00 0.00 33.50 31.75 2jb4 n PRO 95 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2jb4 n GLY 96 N 1.83 1.90 0.66 -1.23 0.00 -1.26 -4.77 105.19 102.32 2jb4 n GLY 96 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 2jb4 n GLY 96 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2jb4 n LYS 97 N -2.00 0.00 -3.68 1.61 4.76 0.54 -4.58 118.16 114.81 2jb4 n LYS 97 Ca 0.00 0.00 -0.25 0.00 -2.87 0.00 0.00 58.31 55.19 2jb4 n LYS 97 Cb 0.00 -0.42 -0.17 0.00 -1.84 0.00 0.00 35.03 32.60 2jb4 n LYS 97 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 2jb4 s LYS 98 N -1.49 0.30 -0.03 1.97 2.20 0.24 -2.80 119.74 120.13 2jb4 s LYS 98 Ca 0.00 -0.11 -0.05 0.00 -0.36 0.00 0.00 55.97 55.45 2jb4 s LYS 98 Cb 0.00 -1.66 -0.28 0.00 -1.51 0.00 0.00 37.83 34.38 2jb4 s LYS 98 CO 0.00 -0.58 0.74 0.00 -0.36 0.00 0.00 175.35 175.15 2jb4 h ALA 99 N 8.35 0.29 -2.67 3.13 0.00 -1.85 -0.64 119.26 125.87 2jb4 h ALA 99 Ca -0.16 -1.17 -0.50 0.00 0.00 0.00 0.00 54.91 53.08 2jb4 h ALA 99 Cb 1.13 0.39 0.05 0.00 0.00 0.00 0.00 17.79 19.36 2jb4 h ALA 99 CO 0.28 1.15 0.48 0.14 0.00 0.00 0.00 179.25 181.31 2jb4 s VAL 100 N -2.60 3.24 0.05 0.00 -7.23 -1.26 -4.56 120.40 108.04 2jb4 s VAL 100 Ca -0.12 0.98 -0.01 0.00 -1.81 0.00 0.00 61.98 61.02 2jb4 s VAL 100 Cb 0.06 -3.52 -0.04 0.00 0.56 0.00 0.00 36.38 33.45 2jb4 s VAL 100 CO 0.84 0.03 -0.03 -1.83 -0.31 0.00 0.00 175.10 173.80 2jb4 s GLU 101 N -2.49 0.59 0.22 4.82 -1.05 -1.00 -3.71 118.70 116.08 2jb4 s GLU 101 Ca 0.60 -1.15 -0.21 0.00 -0.15 0.00 0.00 54.97 54.06 2jb4 s GLU 101 Cb -0.28 0.15 0.04 0.00 -0.44 0.00 0.00 34.13 33.60 2jb4 s GLU 101 CO 0.35 -0.09 0.63 -1.12 0.95 0.00 0.00 175.26 175.98 2jb4 s SER 102 N -2.73 -0.35 -0.10 0.83 0.01 -0.53 -0.83 113.70 109.99 2jb4 s SER 102 Ca 0.04 -0.39 -0.00 0.00 1.31 0.00 0.00 55.95 56.91 2jb4 s SER 102 Cb 0.05 0.65 0.02 0.00 0.21 0.00 0.00 66.02 66.96 2jb4 s SER 102 CO -0.08 -1.15 -0.07 0.12 0.41 0.00 0.00 173.24 172.47 2jb4 s PHE 103 N -3.86 1.34 -0.09 2.43 5.36 -0.71 -0.11 117.98 122.35 2jb4 s PHE 103 Ca 0.08 -0.63 -0.02 0.00 -0.96 0.00 0.00 56.93 55.40 2jb4 s PHE 103 Cb -0.03 -1.14 -0.03 0.00 -0.34 0.00 0.00 43.02 41.47 2jb4 s PHE 103 CO -0.02 -0.46 -0.01 0.00 -1.46 0.00 0.00 175.22 173.27 2jb4 s TYR 105 N -0.70 0.61 0.08 0.00 1.13 -0.52 -1.06 117.35 116.89 2jb4 s TYR 105 Ca 0.11 -0.81 0.01 0.00 -1.41 0.00 0.00 57.07 54.97 2jb4 s TYR 105 Cb -0.12 -0.39 0.01 0.00 -1.10 0.00 0.00 41.96 40.36 2jb4 s TYR 105 CO 0.02 -0.22 0.05 1.28 -2.51 0.00 0.00 175.55 174.18 2jb4 n LEU 106 N 0.61 0.00 -4.70 -3.49 4.77 -1.26 -1.34 117.00 111.58 2jb4 n LEU 106 Ca -0.17 -0.42 -0.55 0.00 -0.03 0.00 0.00 56.01 54.84 2jb4 n LEU 106 Cb 0.59 -0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.61 2jb4 n LEU 106 CO 0.26 -0.28 1.38 -3.20 -1.33 0.00 0.00 177.39 174.21 2jb4 n ASN 107 N -1.91 2.70 0.29 -1.43 2.85 -1.25 -4.83 115.26 111.68 2jb4 n ASN 107 Ca -0.01 1.04 0.20 0.00 -0.11 0.00 0.00 54.58 55.71 2jb4 n ASN 107 Cb 0.09 -1.21 1.05 0.00 1.24 0.00 0.00 39.78 40.95 2jb4 n ASN 107 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 2jb4 h PRO 108 N 7.80 0.00 0.00 1.20 0.11 -1.94 -1.25 132.00 137.92 2jb4 h PRO 108 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2jb4 h PRO 108 Cb 1.30 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.41 2jb4 h PRO 108 CO 0.96 0.00 0.00 0.09 -0.21 0.00 0.00 178.00 178.84 2jb4 n ASN 109 N -2.87 0.00 -4.57 -2.05 3.02 -1.26 -4.35 115.26 103.17 2jb4 n ASN 109 Ca -0.02 -0.17 -0.41 0.00 -0.03 0.00 0.00 54.58 53.95 2jb4 n ASN 109 Cb 0.07 -0.26 -0.02 0.00 -0.61 0.00 0.00 39.78 38.97 2jb4 n ASN 109 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 2jb4 s PHE 110 N -2.52 2.60 0.39 3.10 0.08 -0.47 -4.75 117.98 116.40 2jb4 s PHE 110 Ca 0.27 -1.12 0.08 0.00 0.12 0.00 0.00 56.93 56.27 2jb4 s PHE 110 Cb 0.18 -4.65 -0.00 0.00 -0.57 0.00 0.00 43.02 37.98 2jb4 s PHE 110 CO 0.40 -1.80 0.50 0.95 -0.10 0.00 0.00 175.22 175.17 2jb4 s THR 111 N 5.26 3.29 0.51 0.64 -4.23 -1.26 -4.22 115.64 115.62 2jb4 s THR 111 Ca 0.53 -1.07 0.24 0.00 -1.18 0.00 0.00 61.69 60.22 2jb4 s THR 111 Cb 0.02 -3.12 0.40 0.00 1.34 0.00 0.00 72.50 71.14 2jb4 s THR 111 CO 0.03 -0.06 1.96 -0.65 -0.54 0.00 0.00 174.62 175.36 2jb4 h PRO 112 N 0.80 0.09 -0.01 3.99 0.11 -1.98 -0.78 132.00 134.23 2jb4 h PRO 112 Ca -0.42 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.68 2jb4 h PRO 112 Cb 1.27 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.36 2jb4 h PRO 112 CO 0.50 0.06 -0.04 -0.40 -0.21 0.00 0.00 178.00 177.90 2jb4 n ASP 113 N -4.38 1.04 -4.75 -2.05 5.68 -1.26 -4.28 116.55 106.54 2jb4 n ASP 113 Ca 0.12 -1.22 -0.41 0.00 -0.50 0.00 0.00 54.79 52.78 2jb4 n ASP 113 Cb 0.65 0.01 -0.02 0.00 -1.14 0.00 0.00 41.12 40.62 2jb4 n ASP 113 CO 0.00 0.00 0.00 -2.28 -1.33 0.00 0.00 177.20 173.59 2jb4 s HIS 114 N -2.12 3.04 0.42 2.11 2.46 -0.30 -4.83 115.29 116.08 2jb4 s HIS 114 Ca 0.37 1.11 0.16 0.00 0.47 0.00 0.00 55.06 57.17 2jb4 s HIS 114 Cb 0.21 -3.78 1.05 0.00 -0.13 0.00 0.00 32.58 29.93 2jb4 s HIS 114 CO 0.38 -2.47 1.91 -1.35 -2.47 0.00 0.00 174.74 170.74 2jb4 h PRO 115 N 4.77 0.41 0.00 2.88 0.11 -1.91 0.03 132.00 138.30 2jb4 h PRO 115 Ca -0.46 -0.02 -0.11 0.00 0.11 0.00 0.00 66.00 65.51 2jb4 h PRO 115 Cb 1.22 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 32.22 2jb4 h PRO 115 CO 0.75 0.27 -0.52 0.00 -0.21 0.00 0.00 178.00 178.29 2jb4 h ARG 116 N 0.42 0.00 -0.10 1.05 2.47 -1.95 -1.57 114.38 114.69 2jb4 h ARG 116 Ca 0.39 0.00 -0.16 0.00 -1.26 0.00 0.00 59.98 58.95 2jb4 h ARG 116 Cb 0.91 0.00 0.01 0.00 -1.65 0.00 0.00 29.97 29.24 2jb4 h ARG 116 CO -0.13 0.52 -0.55 0.82 0.56 0.00 0.00 179.97 181.20 2jb4 h ILE 117 N 0.00 1.36 -0.93 2.04 1.08 -1.53 -1.73 117.51 117.79 2jb4 h ILE 117 Ca -0.01 -1.86 -0.01 0.00 -0.39 0.00 0.00 64.86 62.60 2jb4 h ILE 117 Cb 1.24 2.18 -0.04 0.00 -3.07 0.00 0.00 36.82 37.13 2jb4 h ILE 117 CO 0.07 0.56 0.54 1.56 -0.69 0.00 0.00 178.15 180.19 2jb4 h GLN 118 N 0.17 1.28 0.00 2.37 1.08 -1.02 -1.93 115.11 117.06 2jb4 h GLN 118 Ca -0.04 -0.13 0.00 0.00 -1.45 0.00 0.00 58.65 57.03 2jb4 h GLN 118 Cb 1.19 -0.26 0.00 0.00 -0.05 0.00 0.00 27.48 28.36 2jb4 h GLN 118 CO 0.11 0.91 0.00 0.00 -0.95 0.00 0.00 178.83 178.90 2jb4 n ALA 119 N -2.40 2.11 -3.52 3.87 0.00 -0.60 -4.91 120.51 115.07 2jb4 n ALA 119 Ca 0.10 -0.07 -0.22 0.00 0.00 0.00 0.00 53.44 53.25 2jb4 n ALA 119 Cb 0.08 -1.40 0.08 0.00 0.00 0.00 0.00 19.45 18.20 2jb4 n ALA 119 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2jb4 n LYS 120 N -1.59 -7.42 -2.18 0.00 5.02 -0.73 -4.94 118.16 106.32 2jb4 n LYS 120 Ca 0.06 0.78 -0.42 0.00 -2.02 0.00 0.00 58.31 56.71 2jb4 n LYS 120 Cb 0.29 -5.67 -0.03 0.00 -0.02 0.00 0.00 35.03 29.61 2jb4 n LYS 120 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 2jb4 s THR 121 N -3.30 3.22 0.50 -0.18 2.01 -0.70 -4.94 115.64 112.25 2jb4 s THR 121 Ca 0.52 0.94 -0.21 0.00 0.31 0.00 0.00 61.69 63.25 2jb4 s THR 121 Cb -0.23 -3.60 -0.09 0.00 0.01 0.00 0.00 72.50 68.59 2jb4 s THR 121 CO 0.68 0.11 0.84 -2.65 -0.69 0.00 0.00 174.62 172.91 2jb4 n PRO 122 N 3.22 0.96 -0.13 4.92 -0.02 -1.26 -2.68 135.00 140.00 2jb4 n PRO 122 Ca 0.09 0.35 0.00 0.00 -2.02 0.00 0.00 63.50 61.92 2jb4 n PRO 122 Cb 0.42 -1.94 0.00 0.00 -0.02 0.00 0.00 33.50 31.96 2jb4 n PRO 122 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2jb4 n THR 123 N -1.13 0.00 -3.79 3.45 -2.24 -1.26 -5.01 114.28 104.30 2jb4 n THR 123 Ca 0.11 0.00 -0.35 0.00 -2.27 0.00 0.00 64.05 61.54 2jb4 n THR 123 Cb 0.43 0.00 -0.08 0.00 -2.10 0.00 0.00 70.33 68.58 2jb4 n THR 123 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 2jb4 s HIS 124 N -3.12 3.40 0.04 4.78 3.76 -1.09 -5.02 115.29 118.04 2jb4 s HIS 124 Ca 0.00 0.31 -0.09 0.00 -0.15 0.00 0.00 55.06 55.13 2jb4 s HIS 124 Cb 0.00 -2.13 0.00 0.00 1.11 0.00 0.00 32.58 31.57 2jb4 s HIS 124 CO 0.00 0.31 0.19 -1.21 -0.85 0.00 0.00 174.74 173.18 2jb4 s GLU 125 N 0.24 0.70 -0.11 1.40 2.02 -1.26 -4.81 118.70 116.87 2jb4 s GLU 125 Ca 0.08 -0.66 -0.25 0.00 0.02 0.00 0.00 54.97 54.15 2jb4 s GLU 125 Cb -0.11 0.29 -0.02 0.00 0.10 0.00 0.00 34.13 34.38 2jb4 s GLU 125 CO -0.01 -0.21 0.81 0.08 0.02 0.00 0.00 175.26 175.95 2jb4 s VAL 126 N -2.69 4.93 0.65 2.63 1.01 -1.26 -4.81 120.40 120.86 2jb4 s VAL 126 Ca -0.04 1.63 -0.17 0.00 0.00 0.00 0.00 61.98 63.39 2jb4 s VAL 126 Cb -0.01 -4.13 -0.03 0.00 0.00 0.00 0.00 36.38 32.22 2jb4 s VAL 126 CO -0.05 0.12 0.97 0.59 0.00 0.00 0.00 175.10 176.73 2jb4 n ASN 127 N 4.59 0.69 -4.51 3.32 3.02 -1.26 -4.99 115.26 116.12 2jb4 n ASN 127 Ca 0.03 0.75 -0.32 0.00 -0.03 0.00 0.00 54.58 55.01 2jb4 n ASN 127 Cb 0.50 -1.40 -0.12 0.00 -0.61 0.00 0.00 39.78 38.15 2jb4 n ASN 127 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 2jb4 s VAL 128 N -1.61 3.20 0.04 2.41 -7.23 -1.26 -5.11 120.40 110.84 2jb4 s VAL 128 Ca 0.76 -0.84 0.03 0.00 -1.81 0.00 0.00 61.98 60.12 2jb4 s VAL 128 Cb -0.39 -2.32 -0.02 0.00 0.56 0.00 0.00 36.38 34.21 2jb4 s VAL 128 CO 0.47 0.48 -0.09 0.26 -0.31 0.00 0.00 175.10 175.90 2jb4 s TRP 129 N -0.86 0.80 0.96 2.82 0.52 -1.26 -4.82 118.94 117.10 2jb4 s TRP 129 Ca 0.14 -0.45 -0.12 0.00 0.02 0.00 0.00 56.10 55.69 2jb4 s TRP 129 Cb -0.11 -0.47 0.17 0.00 -1.15 0.00 0.00 33.47 31.90 2jb4 s TRP 129 CO 0.04 -0.04 1.09 -1.25 0.02 0.00 0.00 176.95 176.81 2jb4 s PRO 130 N -1.45 0.75 0.20 4.98 0.04 -1.26 -4.94 135.00 133.31 2jb4 s PRO 130 Ca -0.07 0.64 -0.33 0.00 0.04 0.00 0.00 61.00 61.29 2jb4 s PRO 130 Cb -0.09 -1.76 -0.13 0.00 0.04 0.00 0.00 34.50 32.55 2jb4 s PRO 130 CO 0.01 -2.54 1.63 -3.47 0.04 0.00 0.00 177.00 172.66 2jb4 n ASP 131 N -4.06 3.50 -0.28 6.66 -0.08 -1.26 -4.91 116.55 116.12 2jb4 n ASP 131 Ca 0.06 1.08 0.01 0.00 -1.51 0.00 0.00 54.79 54.44 2jb4 n ASP 131 Cb 0.56 -1.50 0.22 0.00 2.34 0.00 0.00 41.12 42.74 2jb4 n ASP 131 CO 0.00 0.00 0.00 -0.08 0.12 0.00 0.00 177.20 177.24 2jb4 h GLU 132 N 6.08 1.06 -0.05 -0.67 4.57 -1.92 -1.74 114.58 121.91 2jb4 h GLU 132 Ca -0.44 -0.06 -0.07 0.00 -1.18 0.00 0.00 59.36 57.61 2jb4 h GLU 132 Cb 1.23 -0.24 -0.01 0.00 -0.16 0.00 0.00 28.75 29.57 2jb4 h GLU 132 CO 0.90 0.70 -0.29 1.79 -1.18 0.00 0.00 179.01 180.94 2jb4 h THR 133 N 1.09 1.23 0.00 0.32 1.35 -1.99 -1.79 112.91 113.12 2jb4 h THR 133 Ca 0.34 -1.07 -0.22 0.00 -0.55 0.00 0.00 66.41 64.90 2jb4 h THR 133 Cb -0.00 1.51 -0.03 0.00 -1.73 0.00 0.00 68.15 67.90 2jb4 h THR 133 CO -0.10 0.31 -1.11 0.11 -0.25 0.00 0.00 175.52 174.49 2jb4 h LYS 134 N 0.08 0.00 -2.12 4.72 1.57 -1.82 -3.39 116.57 115.61 2jb4 h LYS 134 Ca 0.01 -0.00 -0.55 0.00 -1.87 0.00 0.00 60.65 58.24 2jb4 h LYS 134 Cb 0.55 0.00 -0.41 0.00 0.08 0.00 0.00 32.23 32.45 2jb4 h LYS 134 CO 0.04 0.92 -0.91 0.72 -0.57 0.00 0.00 179.45 179.66 2jb4 n HIS 135 N -3.30 1.87 -1.71 -1.35 8.25 -0.70 -5.03 115.22 113.25 2jb4 n HIS 135 Ca -0.03 -3.89 -0.43 0.00 -0.26 0.00 0.00 57.72 53.12 2jb4 n HIS 135 Cb 0.96 -0.45 -0.03 0.00 1.12 0.00 0.00 29.99 31.58 2jb4 n HIS 135 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 2jb4 n PRO 136 N 0.43 2.66 -0.17 -0.41 -0.04 -0.70 -1.91 135.00 134.86 2jb4 n PRO 136 Ca 0.27 0.96 0.00 0.00 -0.04 0.00 0.00 63.50 64.69 2jb4 n PRO 136 Cb 0.51 -2.80 0.00 0.00 -0.04 0.00 0.00 33.50 31.17 2jb4 n PRO 136 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2jb4 n GLY 137 N 3.89 2.48 0.16 0.55 0.00 -1.26 -4.92 105.19 106.09 2jb4 n GLY 137 Ca 0.16 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.05 2jb4 n GLY 137 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2jb4 h PHE 138 N 0.00 -0.28 -0.51 1.61 3.57 -1.74 -1.01 116.94 118.57 2jb4 h PHE 138 Ca 0.00 -0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.55 2jb4 h PHE 138 Cb 0.00 0.09 -0.05 0.00 2.79 0.00 0.00 35.95 38.78 2jb4 h PHE 138 CO 0.00 -0.02 0.24 0.37 -2.23 0.00 0.00 178.31 176.67 2jb4 h GLN 139 N -0.52 0.44 -0.54 1.11 4.15 -1.91 0.55 115.11 118.39 2jb4 h GLN 139 Ca -0.03 -0.03 -0.07 0.00 0.77 0.00 0.00 58.65 59.30 2jb4 h GLN 139 Cb 0.39 -0.10 -0.02 0.00 0.21 0.00 0.00 27.48 27.96 2jb4 h GLN 139 CO 0.05 0.29 0.08 -0.44 -1.93 0.00 0.00 178.83 176.89 2jb4 h ASP 140 N 0.46 0.87 -0.33 -0.69 3.32 -1.93 -0.38 116.42 117.74 2jb4 h ASP 140 Ca 0.23 -0.26 0.00 0.00 0.02 0.00 0.00 57.03 57.03 2jb4 h ASP 140 Cb 0.18 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.49 2jb4 h ASP 140 CO -0.19 0.91 0.21 0.15 -1.72 0.00 0.00 179.24 178.60 2jb4 h PHE 141 N 0.79 0.40 -0.62 4.55 3.57 -0.74 -1.86 116.94 123.03 2jb4 h PHE 141 Ca 0.16 0.01 -0.09 0.00 3.53 0.00 0.00 57.97 61.58 2jb4 h PHE 141 Cb 0.41 -0.14 -0.02 0.00 2.79 0.00 0.00 35.95 39.00 2jb4 h PHE 141 CO 0.03 0.25 0.02 0.00 -2.23 0.00 0.00 178.31 176.38 2jb4 h ALA 142 N 1.12 0.86 -0.49 2.41 0.00 -0.55 0.47 119.26 123.08 2jb4 h ALA 142 Ca 0.12 -0.31 -0.10 0.00 0.00 0.00 0.00 54.91 54.62 2jb4 h ALA 142 Cb -0.04 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 2jb4 h ALA 142 CO -0.03 0.67 -0.10 0.93 0.00 0.00 0.00 179.25 180.72 2jb4 h GLU 143 N 0.99 0.93 -0.81 0.00 5.08 -1.00 -1.46 114.58 118.32 2jb4 h GLU 143 Ca 0.18 -0.35 -0.02 0.00 -1.00 0.00 0.00 59.36 58.17 2jb4 h GLU 143 Cb 0.54 -0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.70 2jb4 h GLU 143 CO 0.03 1.00 0.42 0.37 -1.00 0.00 0.00 179.01 179.83 2jb4 h GLN 144 N 0.78 1.13 -0.73 2.33 5.75 -1.05 -2.44 115.11 120.88 2jb4 h GLN 144 Ca 0.13 -0.14 -0.01 0.00 -0.15 0.00 0.00 58.65 58.48 2jb4 h GLN 144 Cb 0.65 -0.22 -0.03 0.00 1.07 0.00 0.00 27.48 28.94 2jb4 h GLN 144 CO 0.04 0.85 0.42 -0.92 -2.65 0.00 0.00 178.83 176.57 2jb4 h TYR 145 N 1.13 0.99 -0.51 3.99 3.20 -0.61 -0.41 116.97 124.75 2jb4 h TYR 145 Ca 0.28 -0.01 0.10 0.00 3.14 0.00 0.00 58.73 62.24 2jb4 h TYR 145 Cb 0.06 -0.32 -0.08 0.00 1.54 0.00 0.00 36.73 37.93 2jb4 h TYR 145 CO 0.01 0.68 0.02 -0.92 -1.64 0.00 0.00 178.16 176.32 2jb4 h TYR 146 N 1.01 0.01 0.00 -3.82 5.03 -0.80 -0.10 116.97 118.30 2jb4 h TYR 146 Ca 0.26 0.04 -0.13 0.00 2.58 0.00 0.00 58.73 61.48 2jb4 h TYR 146 Cb 0.01 0.07 -0.02 0.00 1.55 0.00 0.00 36.73 38.34 2jb4 h TYR 146 CO -0.01 -0.10 -0.60 -1.49 -1.32 0.00 0.00 178.16 174.64 2jb4 h TRP 147 N 0.14 0.00 -0.17 -3.82 -0.00 -1.10 0.60 115.95 111.60 2jb4 h TRP 147 Ca 0.26 0.00 -0.02 0.00 -0.00 0.00 0.00 58.89 59.13 2jb4 h TRP 147 Cb 0.39 0.00 -0.01 0.00 -0.00 0.00 0.00 29.16 29.54 2jb4 h TRP 147 CO -0.30 0.60 0.02 -0.44 -0.00 0.00 0.00 178.44 178.33 2jb4 h ASP 148 N 0.00 0.27 0.58 -3.49 3.32 -0.27 -1.34 116.42 115.49 2jb4 h ASP 148 Ca -0.01 -0.26 -0.13 0.00 0.02 0.00 0.00 57.03 56.65 2jb4 h ASP 148 Cb 1.07 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 40.53 2jb4 h ASP 148 CO 0.08 0.47 -0.62 1.62 -1.72 0.00 0.00 179.24 179.07 2jb4 h VAL 149 N 0.06 1.44 -0.53 -1.35 3.04 -0.99 -2.15 116.25 115.77 2jb4 h VAL 149 Ca 0.05 -2.10 0.03 0.00 -1.01 0.00 0.00 66.70 63.68 2jb4 h VAL 149 Cb 0.31 2.12 -0.04 0.00 -2.01 0.00 0.00 31.29 31.68 2jb4 h VAL 149 CO 0.00 0.60 0.30 0.15 -1.01 0.00 0.00 177.57 177.62 2jb4 h PHE 150 N 0.03 0.56 -0.33 3.17 3.04 -0.77 -0.02 116.94 122.61 2jb4 h PHE 150 Ca -0.01 0.02 -0.01 0.00 3.98 0.00 0.00 57.97 61.95 2jb4 h PHE 150 Cb 1.10 -0.17 -0.02 0.00 2.56 0.00 0.00 35.95 39.42 2jb4 h PHE 150 CO 0.00 0.30 0.16 0.78 -2.02 0.00 0.00 178.31 177.54 2jb4 h GLY 151 N 0.59 0.51 0.76 2.40 0.00 -0.89 0.09 103.07 106.53 2jb4 h GLY 151 Ca 0.22 -0.25 0.05 0.00 0.00 0.00 0.00 47.33 47.35 2jb4 h GLY 151 CO -0.12 0.24 0.41 -2.00 0.00 0.00 0.00 176.54 175.06 2jb4 h LEU 152 N 0.41 0.64 -0.89 3.11 5.85 -1.23 -2.52 115.31 120.67 2jb4 h LEU 152 Ca 0.12 0.02 -0.08 0.00 0.84 0.00 0.00 57.88 58.77 2jb4 h LEU 152 Cb 0.11 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.01 2jb4 h LEU 152 CO -0.02 0.42 -0.08 0.28 -0.34 0.00 0.00 178.44 178.71 2jb4 h SER 153 N 0.77 0.71 -0.55 1.25 0.02 -0.56 -0.14 113.55 115.06 2jb4 h SER 153 Ca 0.29 -0.19 -0.04 0.00 -0.84 0.00 0.00 61.79 61.01 2jb4 h SER 153 Cb 0.12 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.44 2jb4 h SER 153 CO -0.15 0.83 0.18 -1.28 -1.14 0.00 0.00 176.83 175.27 2jb4 h SER 154 N 0.67 0.80 -0.46 3.07 0.87 -0.83 0.61 113.55 118.28 2jb4 h SER 154 Ca 0.12 -0.20 -0.01 0.00 -1.23 0.00 0.00 61.79 60.47 2jb4 h SER 154 Cb 0.53 -0.21 -0.02 0.00 -0.44 0.00 0.00 62.40 62.26 2jb4 h SER 154 CO 0.03 0.79 0.23 0.00 -0.53 0.00 0.00 176.83 177.35 2jb4 h ALA 155 N 1.04 0.59 -0.85 6.23 0.00 -0.97 -2.35 119.26 122.96 2jb4 h ALA 155 Ca 0.18 -0.11 0.04 0.00 0.00 0.00 0.00 54.91 55.03 2jb4 h ALA 155 Cb 0.27 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 17.82 2jb4 h ALA 155 CO -0.01 0.14 0.54 -0.07 0.00 0.00 0.00 179.25 179.85 2jb4 h LEU 156 N 0.60 0.87 -1.68 0.00 3.38 -0.66 -1.84 115.31 115.99 2jb4 h LEU 156 Ca 0.16 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.10 2jb4 h LEU 156 Cb 0.09 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 2jb4 h LEU 156 CO -0.02 0.58 -0.18 -0.07 0.09 0.00 0.00 178.44 178.84 2jb4 h LEU 157 N 1.01 0.00 -0.59 1.67 3.38 -0.63 -0.42 115.31 119.74 2jb4 h LEU 157 Ca 0.35 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 58.21 2jb4 h LEU 157 Cb 0.07 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 2jb4 h LEU 157 CO -0.14 0.18 -0.09 0.11 0.09 0.00 0.00 178.44 178.59 2jb4 h LYS 158 N 0.00 1.03 -0.60 1.13 1.57 -0.81 -1.85 116.57 117.05 2jb4 h LYS 158 Ca -0.00 -0.37 -0.04 0.00 -1.87 0.00 0.00 60.65 58.36 2jb4 h LYS 158 Cb 0.33 -0.07 -0.03 0.00 0.08 0.00 0.00 32.23 32.54 2jb4 h LYS 158 CO 0.02 1.06 0.20 0.78 -0.57 0.00 0.00 179.45 180.94 2jb4 h GLY 159 N 0.95 0.99 1.00 3.86 0.00 -0.80 -1.67 103.07 107.39 2jb4 h GLY 159 Ca 0.15 -0.57 -0.01 0.00 0.00 0.00 0.00 47.33 46.89 2jb4 h GLY 159 CO 0.05 0.54 0.37 -0.97 0.00 0.00 0.00 176.54 176.52 2jb4 h TYR 160 N 0.85 0.90 0.11 5.60 0.05 -1.02 -0.39 116.97 123.07 2jb4 h TYR 160 Ca 0.20 -0.02 -0.01 0.00 0.05 0.00 0.00 58.73 58.95 2jb4 h TYR 160 Cb 0.26 -0.29 0.00 0.00 1.01 0.00 0.00 36.73 37.72 2jb4 h TYR 160 CO 0.02 0.64 -0.06 0.00 -1.05 0.00 0.00 178.16 177.71 2jb4 h ALA 161 N 1.18 -0.15 -0.97 3.88 0.00 -1.18 -2.08 119.26 119.94 2jb4 h ALA 161 Ca 0.23 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 55.13 2jb4 h ALA 161 Cb 0.03 0.06 -0.05 0.00 0.00 0.00 0.00 17.79 17.82 2jb4 h ALA 161 CO -0.04 -0.58 0.64 -0.07 0.00 0.00 0.00 179.25 179.19 2jb4 h LEU 162 N -0.16 1.08 -1.49 0.00 3.38 -1.16 -0.56 115.31 116.41 2jb4 h LEU 162 Ca -0.02 -0.02 0.06 0.00 0.09 0.00 0.00 57.88 58.00 2jb4 h LEU 162 Cb 0.12 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.57 2jb4 h LEU 162 CO 0.03 0.77 0.42 0.00 0.09 0.00 0.00 178.44 179.74 2jb4 h ALA 163 N 1.37 1.79 -0.29 1.53 0.00 -0.72 -2.12 119.26 120.82 2jb4 h ALA 163 Ca 0.37 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.26 2jb4 h ALA 163 Cb -0.08 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.55 2jb4 h ALA 163 CO -0.10 0.11 0.00 1.28 0.00 0.00 0.00 179.25 180.54 2jb4 n LEU 164 N -4.48 2.03 0.00 0.00 4.77 -0.81 -4.89 117.00 113.62 2jb4 n LEU 164 Ca 0.09 -0.93 0.00 0.00 -0.03 0.00 0.00 56.01 55.14 2jb4 n LEU 164 Cb 0.24 -0.19 0.00 0.00 -2.33 0.00 0.00 43.42 41.13 2jb4 n LEU 164 CO 0.34 0.47 0.00 0.61 -1.33 0.00 0.00 177.39 177.48 2jb4 n GLY 165 N 1.16 0.52 3.85 -0.72 0.00 -0.80 -4.94 105.19 104.27 2jb4 n GLY 165 Ca 0.15 -0.77 -0.21 0.00 0.00 0.00 0.00 46.02 45.19 2jb4 n GLY 165 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jb4 s LYS 166 N -1.42 2.53 0.68 1.61 -0.14 -0.26 -5.01 119.74 117.72 2jb4 s LYS 166 Ca 0.00 -1.53 -0.15 0.00 -1.36 0.00 0.00 55.97 52.93 2jb4 s LYS 166 Cb 0.00 -2.34 0.01 0.00 -1.68 0.00 0.00 37.83 33.81 2jb4 s LYS 166 CO 0.00 -0.12 1.12 -1.83 -0.76 0.00 0.00 175.35 173.76 2jb4 s GLU 167 N -4.07 2.66 0.56 1.68 4.04 -1.26 -3.93 118.70 118.37 2jb4 s GLU 167 Ca 0.46 1.44 0.35 0.00 0.04 0.00 0.00 54.97 57.26 2jb4 s GLU 167 Cb -0.03 -1.93 1.49 0.00 0.02 0.00 0.00 34.13 33.69 2jb4 s GLU 167 CO 0.27 -1.37 2.03 1.05 -1.84 0.00 0.00 175.26 175.40 2jb4 h GLU 168 N -0.07 0.00 -0.47 -4.83 4.11 -1.90 -2.01 114.58 109.41 2jb4 h GLU 168 Ca -0.47 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.96 2jb4 h GLU 168 Cb 1.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.50 2jb4 h GLU 168 CO 0.53 0.00 0.00 0.09 0.07 0.00 0.00 179.01 179.70 2jb4 n ASN 169 N -3.06 2.33 -0.22 3.06 3.02 -1.26 -4.11 115.26 115.02 2jb4 n ASN 169 Ca 0.00 -2.11 -0.01 0.00 -0.03 0.00 0.00 54.58 52.43 2jb4 n ASN 169 Cb 0.27 -0.33 0.10 0.00 -0.61 0.00 0.00 39.78 39.22 2jb4 n ASN 169 CO 0.00 0.00 0.00 0.15 -2.62 0.00 0.00 177.26 174.79 2jb4 h PHE 170 N 2.16 0.61 0.06 3.10 3.57 -1.70 -0.99 116.94 123.73 2jb4 h PHE 170 Ca 0.00 0.03 -0.37 0.00 3.53 0.00 0.00 57.97 61.15 2jb4 h PHE 170 Cb 0.67 -0.18 -0.04 0.00 2.79 0.00 0.00 35.95 39.19 2jb4 h PHE 170 CO 0.32 0.26 -2.17 1.19 -2.23 0.00 0.00 178.31 175.68 2jb4 n PHE 171 N -4.85 0.66 0.27 0.41 3.72 -1.26 -4.51 117.46 111.89 2jb4 n PHE 171 Ca 0.09 0.16 0.10 0.00 -0.05 0.00 0.00 57.45 57.75 2jb4 n PHE 171 Cb 0.21 -1.08 0.71 0.00 -0.94 0.00 0.00 39.48 38.38 2jb4 n PHE 171 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2jb4 h ALA 172 N -0.08 1.71 0.00 4.37 0.00 -1.75 -0.66 119.26 122.84 2jb4 h ALA 172 Ca -0.50 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.36 2jb4 h ALA 172 Cb 1.89 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.68 2jb4 h ALA 172 CO -0.04 0.06 0.00 0.07 0.00 0.00 0.00 179.25 179.34 2jb4 h ARG 173 N 0.00 0.00 -0.23 0.00 0.11 -1.41 -1.36 114.38 111.48 2jb4 h ARG 173 Ca -0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2jb4 h ARG 173 Cb 0.10 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.18 2jb4 h ARG 173 CO 0.01 0.00 0.00 0.72 0.10 0.00 0.00 179.97 180.80 2jb4 n HIS 174 N -2.66 0.29 -3.90 4.08 8.25 -0.26 -4.78 115.22 116.24 2jb4 n HIS 174 Ca -0.00 -0.15 -0.32 0.00 -0.26 0.00 0.00 57.72 56.98 2jb4 n HIS 174 Cb 0.16 -0.00 -0.13 0.00 1.12 0.00 0.00 29.99 31.14 2jb4 n HIS 174 CO 0.00 0.00 0.00 0.12 0.64 0.00 0.00 176.34 177.10 2jb4 s PHE 175 N -1.62 3.40 0.00 4.41 5.36 -0.51 -3.25 117.98 125.78 2jb4 s PHE 175 Ca 0.33 -2.96 0.05 0.00 -0.96 0.00 0.00 56.93 53.38 2jb4 s PHE 175 Cb 0.21 -2.97 -0.01 0.00 -0.34 0.00 0.00 43.02 39.90 2jb4 s PHE 175 CO 0.29 -0.83 -0.14 0.15 -1.46 0.00 0.00 175.22 173.23 2jb4 s LYS 176 N 0.17 1.08 0.52 10.12 1.02 -1.26 -4.93 119.74 126.45 2jb4 s LYS 176 Ca 0.15 -0.58 0.18 0.00 0.02 0.00 0.00 55.97 55.73 2jb4 s LYS 176 Cb -0.23 -1.06 1.28 0.00 -0.52 0.00 0.00 37.83 37.30 2jb4 s LYS 176 CO -0.03 0.28 2.11 -1.35 -0.92 0.00 0.00 175.35 175.45 2jb4 h PRO 177 N 5.54 0.03 0.00 -1.68 0.11 -1.97 -0.90 132.00 133.12 2jb4 h PRO 177 Ca -0.35 -0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.73 2jb4 h PRO 177 Cb 1.17 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.27 2jb4 h PRO 177 CO 0.47 0.02 -0.13 -0.44 -0.21 0.00 0.00 178.00 177.71 2jb4 h ASP 178 N 0.03 0.00 0.00 -2.05 3.32 -1.98 -3.39 116.42 112.35 2jb4 h ASP 178 Ca 0.06 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.11 2jb4 h ASP 178 Cb 0.21 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.76 2jb4 h ASP 178 CO -0.00 0.13 0.00 -0.90 -1.72 0.00 0.00 179.24 176.74 2jb4 n ASP 179 N -3.18 0.05 -4.72 6.45 5.68 -0.90 -4.89 116.55 115.04 2jb4 n ASP 179 Ca 0.02 -0.54 -0.43 0.00 -0.50 0.00 0.00 54.79 53.34 2jb4 n ASP 179 Cb 0.48 0.04 -0.02 0.00 -1.14 0.00 0.00 41.12 40.49 2jb4 n ASP 179 CO 0.00 0.00 0.00 1.07 -1.33 0.00 0.00 177.20 176.94 2jb4 n THR 180 N -0.04 1.31 1.25 2.12 5.66 -0.39 -4.43 114.28 119.76 2jb4 n THR 180 Ca 0.00 -0.33 0.04 0.00 -3.05 0.00 0.00 64.05 60.71 2jb4 n THR 180 Cb 0.12 -1.74 0.10 0.00 -1.55 0.00 0.00 70.33 67.26 2jb4 n THR 180 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 175.07 172.20 2jb4 n LEU 181 N 1.68 1.26 -4.74 1.09 4.77 -0.55 -4.54 117.00 115.96 2jb4 n LEU 181 Ca 0.08 -0.63 -0.38 0.00 -0.03 0.00 0.00 56.01 55.05 2jb4 n LEU 181 Cb 0.35 -0.16 0.05 0.00 -2.33 0.00 0.00 43.42 41.33 2jb4 n LEU 181 CO 0.63 0.31 0.96 0.00 -1.33 0.00 0.00 177.39 177.96 2jb4 s ALA 182 N -1.69 2.66 0.05 -1.18 0.00 -1.25 -4.70 121.76 115.65 2jb4 s ALA 182 Ca 0.16 1.29 0.06 0.00 0.00 0.00 0.00 51.96 53.46 2jb4 s ALA 182 Cb 0.08 -3.56 -0.02 0.00 0.00 0.00 0.00 23.12 19.61 2jb4 s ALA 182 CO 0.10 -1.45 -0.16 -1.54 0.00 0.00 0.00 175.76 172.71 2jb4 s SER 183 N -1.12 1.87 -0.15 0.00 1.04 -1.02 -3.76 113.70 110.57 2jb4 s SER 183 Ca 0.76 -0.52 -0.05 0.00 0.48 0.00 0.00 55.95 56.62 2jb4 s SER 183 Cb -0.39 -0.11 -0.04 0.00 0.10 0.00 0.00 66.02 65.58 2jb4 s SER 183 CO 0.45 0.04 0.04 -0.69 0.98 0.00 0.00 173.24 174.05 2jb4 s VAL 184 N -0.95 4.57 -0.14 5.02 1.01 -0.45 -1.13 120.40 128.33 2jb4 s VAL 184 Ca 0.02 -0.12 0.02 0.00 0.00 0.00 0.00 61.98 61.90 2jb4 s VAL 184 Cb -0.09 -3.01 0.01 0.00 0.00 0.00 0.00 36.38 33.30 2jb4 s VAL 184 CO 0.02 0.52 -0.20 -0.69 0.00 0.00 0.00 175.10 174.74 2jb4 s VAL 185 N -0.10 1.94 -0.68 2.92 1.01 -0.76 -1.44 120.40 123.29 2jb4 s VAL 185 Ca 0.06 -0.91 -0.15 0.00 0.00 0.00 0.00 61.98 60.98 2jb4 s VAL 185 Cb -0.12 -1.73 0.17 0.00 0.00 0.00 0.00 36.38 34.69 2jb4 s VAL 185 CO 0.01 0.53 0.65 -0.76 0.00 0.00 0.00 175.10 175.53 2jb4 s LEU 186 N 0.91 6.37 -0.19 3.92 1.43 0.37 -3.11 118.68 128.38 2jb4 s LEU 186 Ca -0.05 -2.17 -0.13 0.00 -1.03 0.00 0.00 54.13 50.74 2jb4 s LEU 186 Cb -0.15 -2.22 -0.05 0.00 0.03 0.00 0.00 46.19 43.80 2jb4 s LEU 186 CO -0.03 -0.75 0.27 -0.63 0.23 0.00 0.00 176.35 175.44 2jb4 s ILE 187 N 1.06 5.30 -0.29 -0.59 1.01 -0.45 -1.73 121.20 125.51 2jb4 s ILE 187 Ca 0.11 0.47 -0.10 0.00 0.00 0.00 0.00 60.65 61.13 2jb4 s ILE 187 Cb -0.20 -3.61 -0.03 0.00 0.01 0.00 0.00 42.46 38.62 2jb4 s ILE 187 CO -0.02 0.35 0.16 -0.60 0.00 0.00 0.00 174.94 174.83 2jb4 s ARG 188 N 0.77 3.73 -0.30 2.79 3.52 -0.01 -1.85 118.95 127.60 2jb4 s ARG 188 Ca 0.14 -0.46 -0.10 0.00 -0.13 0.00 0.00 55.73 55.18 2jb4 s ARG 188 Cb -0.13 -3.59 -0.02 0.00 -1.56 0.00 0.00 34.95 29.65 2jb4 s ARG 188 CO 0.04 -0.25 0.17 0.71 -0.81 0.00 0.00 175.30 175.16 2jb4 s TYR 189 N 1.70 3.18 0.46 5.12 2.02 -0.57 -2.38 117.35 126.89 2jb4 s TYR 189 Ca 0.06 -0.36 -0.10 0.00 -0.37 0.00 0.00 57.07 56.31 2jb4 s TYR 189 Cb -0.16 -2.37 -0.06 0.00 -0.40 0.00 0.00 41.96 38.97 2jb4 s TYR 189 CO 0.09 -0.37 0.83 -1.25 -1.57 0.00 0.00 175.55 173.27 2jb4 s PRO 190 N 1.66 3.72 -0.01 -1.71 0.04 -1.26 -0.85 135.00 136.59 2jb4 s PRO 190 Ca 0.06 0.49 -0.27 0.00 0.04 0.00 0.00 61.00 61.31 2jb4 s PRO 190 Cb -0.17 -2.32 -0.04 0.00 0.04 0.00 0.00 34.50 32.01 2jb4 s PRO 190 CO 0.08 -0.16 0.85 -0.47 0.04 0.00 0.00 177.00 177.33 2jb4 s TYR 191 N -2.58 3.65 -0.03 0.56 5.04 -1.24 -4.10 117.35 118.64 2jb4 s TYR 191 Ca 0.52 1.51 0.02 0.00 -2.44 0.00 0.00 57.07 56.67 2jb4 s TYR 191 Cb -0.10 -2.96 0.01 0.00 0.35 0.00 0.00 41.96 39.25 2jb4 s TYR 191 CO 0.37 0.07 -0.07 -0.51 -1.34 0.00 0.00 175.55 174.08 2jb4 s LEU 192 N 0.75 1.71 -0.25 6.97 1.43 -1.26 -4.92 118.68 123.10 2jb4 s LEU 192 Ca 0.45 -0.15 -0.03 0.00 -1.03 0.00 0.00 54.13 53.37 2jb4 s LEU 192 Cb -0.20 -0.46 0.08 0.00 0.03 0.00 0.00 46.19 45.65 2jb4 s LEU 192 CO 0.24 0.03 0.08 -0.62 0.23 0.00 0.00 176.35 176.31 2jb4 s ASP 193 N 0.32 3.37 0.50 2.29 2.15 -1.26 -2.92 116.67 121.12 2jb4 s ASP 193 Ca -0.04 -1.18 -0.17 0.00 0.43 0.00 0.00 52.55 51.59 2jb4 s ASP 193 Cb -0.09 -0.59 -0.08 0.00 -0.30 0.00 0.00 42.92 41.86 2jb4 s ASP 193 CO 0.00 -0.38 0.98 -2.16 -0.17 0.00 0.00 175.17 173.45 2jb4 s PRO 194 N 1.87 3.99 -0.22 4.34 0.04 -1.26 -5.13 135.00 138.63 2jb4 s PRO 194 Ca 0.05 0.99 -0.20 0.00 0.04 0.00 0.00 61.00 61.88 2jb4 s PRO 194 Cb -0.17 -2.14 -0.02 0.00 0.04 0.00 0.00 34.50 32.21 2jb4 s PRO 194 CO -0.21 -0.24 0.62 -0.47 0.04 0.00 0.00 177.00 176.75 2jb4 s TYR 195 N -2.54 3.35 0.16 0.56 6.14 -1.15 -5.02 117.35 118.85 2jb4 s TYR 195 Ca 0.60 0.88 -0.30 0.00 0.64 0.00 0.00 57.07 58.88 2jb4 s TYR 195 Cb -0.10 -2.80 -0.08 0.00 0.42 0.00 0.00 41.96 39.40 2jb4 s TYR 195 CO 0.28 -0.22 1.31 -1.25 0.64 0.00 0.00 175.55 176.31 2jb4 s PRO 196 N 2.08 4.38 0.47 4.97 0.04 -1.26 -4.89 135.00 140.79 2jb4 s PRO 196 Ca 0.28 2.01 0.13 0.00 0.04 0.00 0.00 61.00 63.46 2jb4 s PRO 196 Cb -0.16 -3.23 1.10 0.00 0.04 0.00 0.00 34.50 32.26 2jb4 s PRO 196 CO 0.10 -0.29 2.08 0.93 0.04 0.00 0.00 177.00 179.85 2jb4 h GLU 197 N 5.90 0.25 0.00 4.56 4.39 -1.93 -0.49 114.58 127.26 2jb4 h GLU 197 Ca -0.44 -0.02 -0.01 0.00 0.34 0.00 0.00 59.36 59.24 2jb4 h GLU 197 Cb 1.21 -0.06 -0.00 0.00 -0.10 0.00 0.00 28.75 29.80 2jb4 h GLU 197 CO 0.80 0.17 -0.04 0.00 -1.16 0.00 0.00 179.01 178.78 2jb4 h ALA 198 N 1.83 1.07 -0.26 3.43 0.00 -1.85 -0.91 119.26 122.58 2jb4 h ALA 198 Ca 0.12 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2jb4 h ALA 198 Cb 0.17 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.95 2jb4 h ALA 198 CO -0.02 0.05 0.00 0.00 0.00 0.00 0.00 179.25 179.28 2jb4 n ALA 199 N -2.14 2.48 -3.66 0.00 0.00 -0.19 -4.79 120.51 112.22 2jb4 n ALA 199 Ca -0.01 -0.59 -0.33 0.00 0.00 0.00 0.00 53.44 52.50 2jb4 n ALA 199 Cb 0.22 -1.03 -0.15 0.00 0.00 0.00 0.00 19.45 18.48 2jb4 n ALA 199 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2jb4 s ILE 200 N -1.66 2.58 0.29 0.00 1.01 -0.35 -4.73 121.20 118.35 2jb4 s ILE 200 Ca 0.30 -0.78 0.00 0.00 0.00 0.00 0.00 60.65 60.16 2jb4 s ILE 200 Cb 0.16 -2.10 -0.04 0.00 0.01 0.00 0.00 42.46 40.49 2jb4 s ILE 200 CO 0.23 0.51 0.49 -0.54 0.00 0.00 0.00 174.94 175.62 2jb4 s LYS 201 N 1.06 3.50 -0.12 2.79 1.02 0.00 -4.91 119.74 123.08 2jb4 s LYS 201 Ca -0.01 -0.35 0.02 0.00 0.02 0.00 0.00 55.97 55.65 2jb4 s LYS 201 Cb -0.15 -2.73 0.01 0.00 -0.52 0.00 0.00 37.83 34.45 2jb4 s LYS 201 CO -0.04 0.25 -0.18 0.99 -0.92 0.00 0.00 175.35 175.45 2jb4 s THR 202 N -2.15 1.70 0.75 2.17 2.01 -1.26 -0.27 115.64 118.60 2jb4 s THR 202 Ca 0.39 -0.76 -0.11 0.00 0.31 0.00 0.00 61.69 61.52 2jb4 s THR 202 Cb -0.10 -1.54 0.04 0.00 0.01 0.00 0.00 72.50 70.92 2jb4 s THR 202 CO 0.33 0.48 1.08 0.00 -0.69 0.00 0.00 174.62 175.82 2jb4 s ALA 203 N 0.95 2.46 0.48 7.40 0.00 0.06 -4.90 121.76 128.21 2jb4 s ALA 203 Ca -0.06 -0.12 0.14 0.00 0.00 0.00 0.00 51.96 51.92 2jb4 s ALA 203 Cb -0.15 -3.12 1.15 0.00 0.00 0.00 0.00 23.12 21.00 2jb4 s ALA 203 CO -0.02 -1.50 2.09 0.00 0.00 0.00 0.00 175.76 176.33 2jb4 h ALA 204 N -0.92 1.98 -0.07 0.00 0.00 -2.01 -0.07 119.26 118.18 2jb4 h ALA 204 Ca -0.46 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.44 2jb4 h ALA 204 Cb 1.25 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.99 2jb4 h ALA 204 CO 0.59 -0.02 0.00 -0.40 0.00 0.00 0.00 179.25 179.42 2jb4 n ASP 205 N -4.50 0.54 0.00 0.00 5.68 -1.26 -4.90 116.55 112.11 2jb4 n ASP 205 Ca 0.01 -1.63 0.00 0.00 -0.50 0.00 0.00 54.79 52.68 2jb4 n ASP 205 Cb 0.17 -0.04 0.00 0.00 -1.14 0.00 0.00 41.12 40.11 2jb4 n ASP 205 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2jb4 n GLY 206 N 0.84 0.92 3.73 6.12 0.00 -0.04 -5.04 105.19 111.72 2jb4 n GLY 206 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 2jb4 n GLY 206 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jb4 s THR 207 N -2.35 3.08 0.04 2.61 2.01 -1.26 -4.67 115.64 115.09 2jb4 s THR 207 Ca 0.00 0.83 -0.30 0.00 0.31 0.00 0.00 61.69 62.53 2jb4 s THR 207 Cb 0.00 -3.53 -0.04 0.00 0.01 0.00 0.00 72.50 68.93 2jb4 s THR 207 CO 0.00 0.10 1.06 -0.54 -0.69 0.00 0.00 174.62 174.55 2jb4 s LYS 208 N 0.44 4.53 0.09 4.92 1.02 -1.26 -0.76 119.74 128.71 2jb4 s LYS 208 Ca 0.62 1.56 0.07 0.00 0.02 0.00 0.00 55.97 58.24 2jb4 s LYS 208 Cb -0.38 -3.40 -0.03 0.00 -0.52 0.00 0.00 37.83 33.49 2jb4 s LYS 208 CO 0.35 -0.09 -0.19 -0.51 -0.92 0.00 0.00 175.35 173.99 2jb4 s LEU 209 N 0.83 2.28 -0.01 3.17 1.43 0.63 -1.02 118.68 125.99 2jb4 s LEU 209 Ca 0.54 -0.65 0.19 0.00 -1.03 0.00 0.00 54.13 53.18 2jb4 s LEU 209 Cb -0.25 -0.80 -0.20 0.00 0.03 0.00 0.00 46.19 44.97 2jb4 s LEU 209 CO 0.29 0.04 0.59 -1.20 0.23 0.00 0.00 176.35 176.30 2jb4 n SER 210 N 1.22 0.45 -3.70 2.29 7.64 0.34 -0.82 113.62 121.04 2jb4 n SER 210 Ca -0.20 0.19 -0.11 0.00 1.01 0.00 0.00 58.87 59.77 2jb4 n SER 210 Cb 0.54 0.84 -0.11 0.00 -1.01 0.00 0.00 64.21 64.46 2jb4 n SER 210 CO 0.00 0.00 0.00 0.12 -3.01 0.00 0.00 175.04 172.15 2jb4 s PHE 211 N -3.02 -0.54 0.96 1.43 5.36 -1.06 -4.88 117.98 116.23 2jb4 s PHE 211 Ca -0.06 1.18 -0.14 0.00 -0.96 0.00 0.00 56.93 56.95 2jb4 s PHE 211 Cb 0.09 0.21 0.17 0.00 -0.34 0.00 0.00 43.02 43.16 2jb4 s PHE 211 CO 0.84 -0.32 1.17 -1.21 -1.46 0.00 0.00 175.22 174.23 2jb4 s GLU 212 N 1.45 0.70 0.44 10.12 0.41 -1.26 -1.41 118.70 129.15 2jb4 s GLU 212 Ca -0.09 0.10 -0.25 0.00 -0.41 0.00 0.00 54.97 54.33 2jb4 s GLU 212 Cb -0.09 -1.81 -0.09 0.00 -1.78 0.00 0.00 34.13 30.36 2jb4 s GLU 212 CO -0.12 -2.46 1.24 -2.67 -0.49 0.00 0.00 175.26 170.77 2jb4 n TRP 213 N -3.91 2.00 -3.61 1.61 4.27 -1.26 -4.60 117.44 111.95 2jb4 n TRP 213 Ca 0.09 0.50 -0.07 0.00 -3.89 0.00 0.00 57.50 54.13 2jb4 n TRP 213 Cb 0.59 -2.35 -0.02 0.00 -1.36 0.00 0.00 31.31 28.17 2jb4 n TRP 213 CO 0.00 0.00 0.00 -3.38 -2.29 0.00 0.00 177.69 172.02 2jb4 s HIS 214 N -1.22 -0.27 -0.04 -2.67 -3.43 -0.48 -4.95 115.29 102.22 2jb4 s HIS 214 Ca 0.63 0.05 -0.03 0.00 -0.80 0.00 0.00 55.06 54.91 2jb4 s HIS 214 Cb -0.50 0.59 -0.04 0.00 -1.43 0.00 0.00 32.58 31.20 2jb4 s HIS 214 CO 0.57 -0.71 0.13 -1.21 -2.00 0.00 0.00 174.74 171.52 2jb4 s GLU 215 N -3.27 3.31 0.46 -0.38 2.02 -1.26 -1.67 118.70 117.90 2jb4 s GLU 215 Ca 0.08 -0.32 -0.23 0.00 0.02 0.00 0.00 54.97 54.52 2jb4 s GLU 215 Cb -0.01 -3.04 -0.08 0.00 0.10 0.00 0.00 34.13 31.10 2jb4 s GLU 215 CO -0.04 0.70 1.14 -0.51 0.02 0.00 0.00 175.26 176.57 2jb4 s ASP 216 N -1.57 6.24 -0.74 -0.19 1.01 -1.26 -4.88 116.67 115.28 2jb4 s ASP 216 Ca 0.22 2.25 -0.19 0.00 0.71 0.00 0.00 52.55 55.54 2jb4 s ASP 216 Cb -0.12 -2.60 0.12 0.00 1.01 0.00 0.00 42.92 41.33 2jb4 s ASP 216 CO 0.12 -0.87 0.90 -0.69 0.21 0.00 0.00 175.17 174.85 2jb4 s VAL 217 N -1.58 4.77 -0.08 -1.27 1.01 -1.26 -1.03 120.40 120.95 2jb4 s VAL 217 Ca 0.63 -1.19 -0.32 0.00 0.00 0.00 0.00 61.98 61.10 2jb4 s VAL 217 Cb -0.27 -4.62 0.13 0.00 0.00 0.00 0.00 36.38 31.62 2jb4 s VAL 217 CO 0.33 -1.31 1.31 -0.94 0.00 0.00 0.00 175.10 174.49 2jb4 s SER 218 N 3.49 -0.06 -0.06 3.32 1.04 -1.26 -4.91 113.70 115.26 2jb4 s SER 218 Ca 0.21 -0.08 -0.08 0.00 0.48 0.00 0.00 55.95 56.48 2jb4 s SER 218 Cb -0.15 0.12 -0.05 0.00 0.10 0.00 0.00 66.02 66.04 2jb4 s SER 218 CO 0.01 -0.21 0.35 0.25 0.98 0.00 0.00 173.24 174.61 2jb4 h LEU 219 N 2.00 -0.25 -8.57 2.42 5.85 -1.34 -2.61 115.31 112.82 2jb4 h LEU 219 Ca -0.26 0.01 -0.27 0.00 0.84 0.00 0.00 57.88 58.20 2jb4 h LEU 219 Cb 1.19 0.06 -0.15 0.00 0.37 0.00 0.00 40.66 42.14 2jb4 h LEU 219 CO 0.27 0.19 -0.69 0.27 -0.34 0.00 0.00 178.44 178.14 2jb4 s ILE 220 N -2.50 0.81 -0.07 4.05 -4.36 -1.24 -1.21 121.20 116.68 2jb4 s ILE 220 Ca -0.04 -1.98 0.05 0.00 -0.26 0.00 0.00 60.65 58.42 2jb4 s ILE 220 Cb 0.00 -1.87 -0.01 0.00 1.25 0.00 0.00 42.46 41.84 2jb4 s ILE 220 CO 0.13 -0.71 -0.24 -0.89 0.24 0.00 0.00 174.94 173.47 2jb4 s THR 221 N -3.56 2.12 -0.34 8.37 2.01 0.06 -0.94 115.64 123.35 2jb4 s THR 221 Ca 0.17 -1.03 0.03 0.00 0.31 0.00 0.00 61.69 61.16 2jb4 s THR 221 Cb 0.05 -1.78 0.10 0.00 0.01 0.00 0.00 72.50 70.88 2jb4 s THR 221 CO -0.01 0.57 0.07 -0.69 -0.69 0.00 0.00 174.62 173.87 2jb4 s VAL 222 N -0.04 1.85 -0.15 3.82 1.01 -0.28 -2.48 120.40 124.13 2jb4 s VAL 222 Ca -0.07 -2.09 -0.00 0.00 0.00 0.00 0.00 61.98 59.82 2jb4 s VAL 222 Cb -0.15 -2.38 -0.00 0.00 0.00 0.00 0.00 36.38 33.85 2jb4 s VAL 222 CO 0.05 -0.63 -0.14 -0.22 0.00 0.00 0.00 175.10 174.16 2jb4 s LEU 223 N 1.09 2.55 -0.16 3.92 2.96 -0.09 -1.01 118.68 127.94 2jb4 s LEU 223 Ca 0.11 -0.44 -0.09 0.00 -0.22 0.00 0.00 54.13 53.49 2jb4 s LEU 223 Cb -0.19 -1.58 -0.05 0.00 0.50 0.00 0.00 46.19 44.87 2jb4 s LEU 223 CO -0.13 0.09 0.14 -0.47 -1.32 0.00 0.00 176.35 174.67 2jb4 s TYR 224 N 0.76 3.51 0.07 5.38 5.04 -1.04 -0.55 117.35 130.51 2jb4 s TYR 224 Ca -0.06 0.44 0.02 0.00 -2.44 0.00 0.00 57.07 55.04 2jb4 s TYR 224 Cb -0.15 -2.06 -0.03 0.00 0.35 0.00 0.00 41.96 40.06 2jb4 s TYR 224 CO 0.01 0.51 -0.08 -0.65 -1.34 0.00 0.00 175.55 173.99 2jb4 s GLN 225 N -0.31 0.66 1.07 4.97 -0.21 -1.26 -0.35 119.66 124.22 2jb4 s GLN 225 Ca 0.12 -0.98 -0.16 0.00 0.02 0.00 0.00 55.36 54.36 2jb4 s GLN 225 Cb -0.12 -0.32 0.11 0.00 1.00 0.00 0.00 33.01 33.68 2jb4 s GLN 225 CO 0.01 0.04 0.28 0.43 -2.12 0.00 0.00 175.29 173.94 2jb4 n SER 226 N 0.93 -2.11 -3.13 5.90 7.64 -0.86 -4.21 113.62 117.78 2jb4 n SER 226 Ca -0.19 0.04 -0.35 0.00 1.01 0.00 0.00 58.87 59.38 2jb4 n SER 226 Cb 0.57 -1.09 -0.04 0.00 -1.01 0.00 0.00 64.21 62.64 2jb4 n SER 226 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 2jb4 n ASN 227 N -2.01 7.91 -3.82 6.43 5.15 -1.26 -4.73 115.26 122.93 2jb4 n ASN 227 Ca 0.03 -2.80 -0.26 0.00 -0.60 0.00 0.00 54.58 50.96 2jb4 n ASN 227 Cb 0.58 -1.45 -0.17 0.00 -0.53 0.00 0.00 39.78 38.21 2jb4 n ASN 227 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 2jb4 s VAL 228 N 0.58 0.70 0.24 3.44 1.01 -1.26 -5.04 120.40 120.08 2jb4 s VAL 228 Ca 0.64 -0.23 -0.30 0.00 0.00 0.00 0.00 61.98 62.08 2jb4 s VAL 228 Cb 0.22 -0.88 -0.10 0.00 0.00 0.00 0.00 36.38 35.61 2jb4 s VAL 228 CO -0.08 0.18 1.51 -1.58 0.00 0.00 0.00 175.10 175.14 2jb4 s GLN 229 N 1.83 4.21 0.00 2.72 -0.44 -1.26 -4.82 119.66 121.90 2jb4 s GLN 229 Ca 0.03 2.40 0.00 0.00 -2.50 0.00 0.00 55.36 55.29 2jb4 s GLN 229 Cb -0.14 -3.09 0.00 0.00 -1.64 0.00 0.00 33.01 28.14 2jb4 s GLN 229 CO -0.07 -0.52 0.00 0.27 0.50 0.00 0.00 175.29 175.47 2jb4 n ASN 230 N 2.63 0.00 -4.80 6.67 0.23 -1.26 -4.96 115.26 113.76 2jb4 n ASN 230 Ca 0.09 0.00 -0.36 0.00 -0.53 0.00 0.00 54.58 53.77 2jb4 n ASN 230 Cb 0.39 0.00 -0.06 0.00 -2.08 0.00 0.00 39.78 38.03 2jb4 n ASN 230 CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 2jb4 s LEU 231 N -0.89 4.31 0.02 -4.53 1.43 -1.26 -0.60 118.68 117.16 2jb4 s LEU 231 Ca 0.00 1.63 0.04 0.00 -1.03 0.00 0.00 54.13 54.77 2jb4 s LEU 231 Cb 0.00 -3.87 -0.02 0.00 0.03 0.00 0.00 46.19 42.33 2jb4 s LEU 231 CO 0.00 -0.05 -0.13 -1.10 0.23 0.00 0.00 176.35 175.31 2jb4 s GLN 232 N -2.13 0.88 -0.07 1.70 -0.21 -0.41 -1.06 119.66 118.37 2jb4 s GLN 232 Ca 0.48 -0.63 0.04 0.00 0.02 0.00 0.00 55.36 55.27 2jb4 s GLN 232 Cb -0.17 -0.86 -0.02 0.00 1.00 0.00 0.00 33.01 32.96 2jb4 s GLN 232 CO 0.22 0.22 -0.18 0.54 -2.12 0.00 0.00 175.29 173.96 2jb4 s VAL 233 N -0.69 2.66 -0.13 1.09 0.11 -0.19 -1.32 120.40 121.94 2jb4 s VAL 233 Ca 0.02 -0.85 -0.29 0.00 -2.93 0.00 0.00 61.98 57.93 2jb4 s VAL 233 Cb -0.07 -2.03 -0.01 0.00 -1.53 0.00 0.00 36.38 32.74 2jb4 s VAL 233 CO 0.01 0.57 0.98 -0.70 -3.33 0.00 0.00 175.10 172.62 2jb4 s GLU 234 N -0.33 4.39 0.45 1.54 2.12 -0.35 -0.87 118.70 125.65 2jb4 s GLU 234 Ca 0.02 1.32 0.01 0.00 0.36 0.00 0.00 54.97 56.68 2jb4 s GLU 234 Cb -0.13 -3.55 -0.00 0.00 0.26 0.00 0.00 34.13 30.71 2jb4 s GLU 234 CO 0.02 -0.34 0.04 0.25 -0.54 0.00 0.00 175.26 174.69 2jb4 n THR 235 N 4.63 0.00 0.25 -1.70 -2.24 -0.41 -4.64 114.28 110.17 2jb4 n THR 235 Ca 0.08 -2.22 0.09 0.00 -2.27 0.00 0.00 64.05 59.74 2jb4 n THR 235 Cb 0.49 0.54 0.65 0.00 -2.10 0.00 0.00 70.33 69.90 2jb4 n THR 235 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2jb4 h ALA 236 N 1.34 1.57 -0.26 6.98 0.00 -1.98 -1.26 119.26 125.66 2jb4 h ALA 236 Ca -0.37 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.43 2jb4 h ALA 236 Cb 1.17 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.94 2jb4 h ALA 236 CO 0.60 0.15 0.00 0.00 0.00 0.00 0.00 179.25 180.00 2jb4 n ALA 237 N -2.41 2.47 0.00 0.00 0.00 -1.26 -5.04 120.51 114.27 2jb4 n ALA 237 Ca -0.02 -0.49 0.00 0.00 0.00 0.00 0.00 53.44 52.92 2jb4 n ALA 237 Cb 0.20 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 18.65 2jb4 n ALA 237 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jb4 n GLY 238 N 0.98 -1.58 3.73 0.00 0.00 -0.48 -4.94 105.19 102.91 2jb4 n GLY 238 Ca 0.11 -2.10 -0.41 0.00 0.00 0.00 0.00 46.02 43.61 2jb4 n GLY 238 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2jb4 s TYR 239 N -0.09 3.41 0.07 1.61 2.02 -1.26 -1.29 117.35 121.82 2jb4 s TYR 239 Ca 0.00 1.38 0.07 0.00 -0.37 0.00 0.00 57.07 58.14 2jb4 s TYR 239 Cb 0.00 -3.45 -0.03 0.00 -0.40 0.00 0.00 41.96 38.08 2jb4 s TYR 239 CO 0.00 -1.30 -0.18 -0.65 -1.57 0.00 0.00 175.55 171.85 2jb4 s GLN 240 N -0.03 1.10 0.03 -0.62 -0.21 -0.05 -4.54 119.66 115.34 2jb4 s GLN 240 Ca 0.54 -0.97 -0.30 0.00 0.02 0.00 0.00 55.36 54.65 2jb4 s GLN 240 Cb -0.33 -1.22 -0.04 0.00 1.00 0.00 0.00 33.01 32.43 2jb4 s GLN 240 CO 0.36 0.29 1.02 -0.51 -2.12 0.00 0.00 175.29 174.33 2jb4 s ASP 241 N -1.50 7.33 -0.25 5.90 1.01 -0.20 -1.02 116.67 127.93 2jb4 s ASP 241 Ca 0.04 1.76 -0.20 0.00 0.71 0.00 0.00 52.55 54.86 2jb4 s ASP 241 Cb -0.09 -2.58 -0.02 0.00 1.01 0.00 0.00 42.92 41.24 2jb4 s ASP 241 CO 0.03 -0.27 0.62 -0.63 0.21 0.00 0.00 175.17 175.12 2jb4 s ILE 242 N 0.84 4.99 0.49 0.77 1.01 -0.23 -0.46 121.20 128.62 2jb4 s ILE 242 Ca 0.53 1.11 -0.24 0.00 0.00 0.00 0.00 60.65 62.05 2jb4 s ILE 242 Cb -0.23 -3.92 -0.07 0.00 0.01 0.00 0.00 42.46 38.25 2jb4 s ILE 242 CO 0.29 0.03 1.40 -1.83 0.00 0.00 0.00 174.94 174.83 2jb4 s GLU 243 N 2.48 3.45 0.48 2.79 -1.05 -1.26 -4.40 118.70 121.19 2jb4 s GLU 243 Ca 0.26 2.34 -0.19 0.00 -0.15 0.00 0.00 54.97 57.23 2jb4 s GLU 243 Cb -0.15 -2.48 -0.09 0.00 -0.44 0.00 0.00 34.13 30.96 2jb4 s GLU 243 CO 0.09 -0.98 0.98 0.00 0.95 0.00 0.00 175.26 176.30 2jb4 s ALA 244 N -1.25 3.02 -0.29 -0.84 0.00 -1.26 -5.02 121.76 116.13 2jb4 s ALA 244 Ca 0.66 0.32 0.03 0.00 0.00 0.00 0.00 51.96 52.96 2jb4 s ALA 244 Cb -0.42 -3.15 0.17 0.00 0.00 0.00 0.00 23.12 19.72 2jb4 s ALA 244 CO 0.53 -0.12 0.46 0.34 0.00 0.00 0.00 175.76 176.96 2jb4 s ASP 245 N -2.61 -0.23 -0.02 0.00 -1.08 -1.26 -5.02 116.67 106.46 2jb4 s ASP 245 Ca 0.61 -0.18 0.04 0.00 -0.52 0.00 0.00 52.55 52.50 2jb4 s ASP 245 Cb -0.10 1.39 0.14 0.00 -1.46 0.00 0.00 42.92 42.89 2jb4 s ASP 245 CO 0.23 -0.34 0.97 -0.90 0.52 0.00 0.00 175.17 175.65 2jb4 n ASP 246 N 5.37 1.20 -0.01 -0.34 5.75 -1.26 -2.78 116.55 124.49 2jb4 n ASP 246 Ca 0.02 -2.07 0.10 0.00 -0.01 0.00 0.00 54.79 52.83 2jb4 n ASP 246 Cb 0.51 -0.26 -0.15 0.00 -1.03 0.00 0.00 41.12 40.18 2jb4 n ASP 246 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 2jb4 n THR 247 N -0.00 0.00 -3.98 2.12 -2.24 -1.26 -4.85 114.28 104.07 2jb4 n THR 247 Ca 0.05 -0.41 -0.24 0.00 -2.27 0.00 0.00 64.05 61.18 2jb4 n THR 247 Cb 0.24 0.15 -0.05 0.00 -2.10 0.00 0.00 70.33 68.56 2jb4 n THR 247 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2jb4 s GLY 248 N -4.13 2.32 -0.17 3.38 0.00 -1.12 -4.89 107.32 102.72 2jb4 s GLY 248 Ca -0.06 -1.88 -0.06 0.00 0.00 0.00 0.00 44.72 42.73 2jb4 s GLY 248 CO 0.82 -1.88 0.02 -0.19 0.00 0.00 0.00 173.10 171.88 2jb4 s TYR 249 N -2.60 3.17 -0.11 1.90 2.02 -0.70 -4.73 117.35 116.30 2jb4 s TYR 249 Ca 0.41 -0.05 -0.25 0.00 -0.37 0.00 0.00 57.07 56.81 2jb4 s TYR 249 Cb 0.01 -2.02 -0.02 0.00 -0.40 0.00 0.00 41.96 39.53 2jb4 s TYR 249 CO 0.23 0.11 0.81 -1.17 -1.57 0.00 0.00 175.55 173.97 2jb4 s LEU 250 N 0.28 4.25 -0.07 -1.29 2.96 0.28 -0.18 118.68 124.91 2jb4 s LEU 250 Ca 0.01 1.25 0.04 0.00 -0.22 0.00 0.00 54.13 55.21 2jb4 s LEU 250 Cb -0.13 -3.24 -0.02 0.00 0.50 0.00 0.00 46.19 43.31 2jb4 s LEU 250 CO 0.01 -0.29 -0.19 -0.63 -1.32 0.00 0.00 176.35 173.94 2jb4 s ILE 251 N 1.55 2.60 0.11 6.68 -1.09 0.29 -0.92 121.20 130.43 2jb4 s ILE 251 Ca 0.40 -0.86 -0.08 0.00 -2.23 0.00 0.00 60.65 57.87 2jb4 s ILE 251 Cb -0.18 -2.01 -0.00 0.00 -1.58 0.00 0.00 42.46 38.69 2jb4 s ILE 251 CO 0.17 0.56 0.21 0.54 -1.23 0.00 0.00 174.94 175.19 2jb4 s ASN 252 N -0.19 0.11 0.33 3.58 4.22 -1.04 -2.08 114.94 119.87 2jb4 s ASN 252 Ca -0.01 -0.73 -0.20 0.00 -2.14 0.00 0.00 52.86 49.77 2jb4 s ASN 252 Cb -0.13 0.36 -0.10 0.00 1.28 0.00 0.00 41.25 42.66 2jb4 s ASN 252 CO 0.03 -0.77 0.85 0.00 -2.04 0.00 0.00 177.10 175.17 2jb4 s GLY 254 N -1.95 1.86 0.56 0.00 0.00 -0.35 -4.02 107.32 103.43 2jb4 s GLY 254 Ca 0.53 -1.96 0.35 0.00 0.00 0.00 0.00 44.72 43.64 2jb4 s GLY 254 CO 0.18 -1.75 2.03 1.48 0.00 0.00 0.00 173.10 175.04 2jb4 h SER 255 N 0.29 0.00 -0.58 1.64 4.64 -0.98 -1.75 113.55 116.81 2jb4 h SER 255 Ca -0.31 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 60.93 2jb4 h SER 255 Cb 1.29 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.36 2jb4 h SER 255 CO 0.44 0.00 0.04 0.22 -0.87 0.00 0.00 176.83 176.66 2jb4 h TYR 256 N 0.00 1.09 -0.78 4.77 3.20 -1.74 -1.09 116.97 122.42 2jb4 h TYR 256 Ca 0.00 -0.16 -0.05 0.00 3.14 0.00 0.00 58.73 61.66 2jb4 h TYR 256 Cb 0.45 -0.29 -0.03 0.00 1.54 0.00 0.00 36.73 38.40 2jb4 h TYR 256 CO 0.00 0.95 0.29 1.98 -1.64 0.00 0.00 178.16 179.74 2jb4 h MET 257 N 0.94 1.18 -0.76 1.82 4.05 -1.46 -1.30 114.93 119.39 2jb4 h MET 257 Ca 0.18 -0.22 -0.02 0.00 -0.28 0.00 0.00 59.70 59.36 2jb4 h MET 257 Cb 0.49 -0.19 -0.04 0.00 -0.80 0.00 0.00 31.60 31.07 2jb4 h MET 257 CO 0.02 0.97 0.41 0.00 0.23 0.00 0.00 176.91 178.54 2jb4 h ALA 258 N 1.17 0.98 -0.28 0.39 0.00 -1.32 -1.59 119.26 118.62 2jb4 h ALA 258 Ca 0.26 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 2jb4 h ALA 258 Cb 0.24 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 2jb4 h ALA 258 CO -0.02 0.50 0.10 1.25 0.00 0.00 0.00 179.25 181.08 2jb4 h HIS 259 N 1.06 0.43 0.00 0.00 6.17 -0.81 0.12 115.15 122.13 2jb4 h HIS 259 Ca 0.27 -0.04 -0.07 0.00 0.71 0.00 0.00 60.37 61.24 2jb4 h HIS 259 Cb 0.05 -0.13 -0.01 0.00 2.52 0.00 0.00 27.41 29.84 2jb4 h HIS 259 CO 0.00 0.45 -0.35 -0.07 0.71 0.00 0.00 177.93 178.67 2jb4 h LEU 260 N 0.29 0.00 -2.58 0.26 3.38 -0.98 -2.77 115.31 112.91 2jb4 h LEU 260 Ca 0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.06 2jb4 h LEU 260 Cb 0.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.96 2jb4 h LEU 260 CO -0.01 0.35 0.00 0.35 0.09 0.00 0.00 178.44 179.23 2jb4 n THR 261 N -4.06 0.80 -3.71 0.22 -2.24 -0.62 -0.95 114.28 103.72 2jb4 n THR 261 Ca -0.02 -0.90 -0.25 0.00 -2.27 0.00 0.00 64.05 60.61 2jb4 n THR 261 Cb 0.39 0.69 0.06 0.00 -2.10 0.00 0.00 70.33 69.38 2jb4 n THR 261 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2jb4 n ASN 262 N 1.42 -5.06 -0.49 3.42 5.15 -0.79 -1.71 115.26 117.19 2jb4 n ASN 262 Ca 0.20 -0.65 -0.06 0.00 -0.60 0.00 0.00 54.58 53.47 2jb4 n ASN 262 Cb 0.58 -4.56 -0.03 0.00 -0.53 0.00 0.00 39.78 35.25 2jb4 n ASN 262 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 2jb4 n ASN 263 N -2.97 -4.60 -0.15 1.20 5.15 0.37 -4.89 115.26 109.37 2jb4 n ASN 263 Ca -0.03 0.16 -0.09 0.00 -0.60 0.00 0.00 54.58 54.02 2jb4 n ASN 263 Cb 0.57 -2.66 -0.00 0.00 -0.53 0.00 0.00 39.78 37.15 2jb4 n ASN 263 CO 0.00 0.00 0.00 0.22 1.40 0.00 0.00 177.26 178.88 2jb4 h TYR 264 N 0.00 0.68 -3.22 1.20 3.20 -1.58 -3.28 116.97 113.97 2jb4 h TYR 264 Ca -0.13 -0.06 -0.74 0.00 3.14 0.00 0.00 58.73 60.94 2jb4 h TYR 264 Cb 0.69 -0.20 -0.27 0.00 1.54 0.00 0.00 36.73 38.49 2jb4 h TYR 264 CO 0.35 0.61 -0.33 0.71 -1.64 0.00 0.00 178.16 177.87 2jb4 s TYR 265 N -5.44 3.36 0.56 -3.82 2.02 -1.26 -4.69 117.35 108.07 2jb4 s TYR 265 Ca -0.13 -1.65 -0.19 0.00 -0.37 0.00 0.00 57.07 54.73 2jb4 s TYR 265 Cb 0.10 -3.61 -0.05 0.00 -0.40 0.00 0.00 41.96 38.01 2jb4 s TYR 265 CO 0.77 -1.00 1.13 0.15 -1.57 0.00 0.00 175.55 175.02 2jb4 s LYS 266 N 1.45 3.29 -0.48 -0.62 1.02 -1.24 -3.33 119.74 119.83 2jb4 s LYS 266 Ca 0.05 1.60 -0.28 0.00 0.02 0.00 0.00 55.97 57.36 2jb4 s LYS 266 Cb -0.28 -2.00 0.03 0.00 -0.52 0.00 0.00 37.83 35.07 2jb4 s LYS 266 CO 0.01 -0.90 1.06 0.00 -0.92 0.00 0.00 175.35 174.60 2jb4 s ALA 267 N -1.81 3.17 0.34 5.17 0.00 -1.26 -4.64 121.76 122.73 2jb4 s ALA 267 Ca 0.72 -0.63 -0.28 0.00 0.00 0.00 0.00 51.96 51.77 2jb4 s ALA 267 Cb -0.24 -3.81 -0.10 0.00 0.00 0.00 0.00 23.12 18.97 2jb4 s ALA 267 CO 0.29 -2.23 1.26 -1.25 0.00 0.00 0.00 175.76 173.83 2jb4 s PRO 268 N 4.24 4.31 0.01 0.00 0.04 -1.26 -4.88 135.00 137.46 2jb4 s PRO 268 Ca 0.43 2.10 -0.30 0.00 0.04 0.00 0.00 61.00 63.27 2jb4 s PRO 268 Cb -0.08 -3.00 -0.04 0.00 0.04 0.00 0.00 34.50 31.42 2jb4 s PRO 268 CO 0.29 -0.18 1.13 0.42 0.04 0.00 0.00 177.00 178.69 2jb4 s ILE 269 N -1.19 4.35 0.19 0.56 1.01 -1.26 -4.52 121.20 120.34 2jb4 s ILE 269 Ca 0.50 1.68 -0.09 0.00 0.00 0.00 0.00 60.65 62.75 2jb4 s ILE 269 Cb -0.37 -4.08 -0.01 0.00 0.01 0.00 0.00 42.46 38.01 2jb4 s ILE 269 CO 0.49 0.10 0.31 -1.38 0.00 0.00 0.00 174.94 174.46 2jb4 s HIS 270 N 1.31 0.48 0.21 3.97 -3.43 -0.67 -1.21 115.29 115.95 2jb4 s HIS 270 Ca 0.56 -0.82 -0.10 0.00 -0.80 0.00 0.00 55.06 53.89 2jb4 s HIS 270 Cb -0.26 -0.06 -0.01 0.00 -1.43 0.00 0.00 32.58 30.83 2jb4 s HIS 270 CO 0.27 -0.77 0.37 -0.98 -2.00 0.00 0.00 174.74 171.63 2jb4 s ARG 271 N -4.00 1.35 -0.24 -0.38 1.70 -0.43 -1.38 118.95 115.56 2jb4 s ARG 271 Ca 0.21 -1.23 0.01 0.00 -0.47 0.00 0.00 55.73 54.24 2jb4 s ARG 271 Cb 0.03 0.42 0.04 0.00 -0.57 0.00 0.00 34.95 34.87 2jb4 s ARG 271 CO 0.03 -0.53 -0.10 0.08 -1.08 0.00 0.00 175.30 173.70 2jb4 s VAL 272 N -4.00 2.48 0.53 4.99 1.01 -0.50 -1.28 120.40 123.62 2jb4 s VAL 272 Ca 0.21 -1.26 -0.22 0.00 0.00 0.00 0.00 61.98 60.71 2jb4 s VAL 272 Cb 0.02 -2.30 -0.05 0.00 0.00 0.00 0.00 36.38 34.04 2jb4 s VAL 272 CO 0.05 0.15 1.30 -0.54 0.00 0.00 0.00 175.10 176.06 2jb4 s LYS 273 N 1.23 3.25 -0.02 2.72 1.02 0.23 -0.51 119.74 127.67 2jb4 s LYS 273 Ca -0.03 2.08 -0.30 0.00 0.02 0.00 0.00 55.97 57.74 2jb4 s LYS 273 Cb -0.17 -2.25 -0.04 0.00 -0.52 0.00 0.00 37.83 34.85 2jb4 s LYS 273 CO -0.06 -1.06 1.26 -0.46 -0.92 0.00 0.00 175.35 174.12 2jb4 s TRP 274 N -1.39 3.14 -0.03 3.18 -0.00 -0.19 -4.10 118.94 119.55 2jb4 s TRP 274 Ca 0.71 1.11 0.00 0.00 -0.00 0.00 0.00 56.10 57.92 2jb4 s TRP 274 Cb -0.37 -3.50 0.03 0.00 -0.00 0.00 0.00 33.47 29.64 2jb4 s TRP 274 CO 0.43 -1.65 0.01 0.08 -0.00 0.00 0.00 176.95 175.82 2jb4 s VAL 275 N 2.04 0.15 -1.16 5.86 1.01 -1.26 -4.86 120.40 122.18 2jb4 s VAL 275 Ca 0.59 0.13 -0.15 0.00 0.00 0.00 0.00 61.98 62.54 2jb4 s VAL 275 Cb -0.28 -0.27 0.15 0.00 0.00 0.00 0.00 36.38 35.98 2jb4 s VAL 275 CO 0.25 0.15 1.41 0.21 0.00 0.00 0.00 175.10 177.12 2jb4 s ASN 276 N 1.20 6.95 -0.12 3.32 3.84 -1.26 -4.89 114.94 123.98 2jb4 s ASN 276 Ca -0.07 -2.71 -0.14 0.00 0.21 0.00 0.00 52.86 50.14 2jb4 s ASN 276 Cb -0.13 -2.42 0.04 0.00 -0.55 0.00 0.00 41.25 38.18 2jb4 s ASN 276 CO -0.02 -0.87 0.39 0.00 -2.79 0.00 0.00 177.10 173.80 2jb4 s ALA 277 N 2.17 -0.96 -0.35 1.71 0.00 -1.26 -4.86 121.76 118.21 2jb4 s ALA 277 Ca 0.42 0.97 -0.29 0.00 0.00 0.00 0.00 51.96 53.06 2jb4 s ALA 277 Cb -0.02 -0.49 0.01 0.00 0.00 0.00 0.00 23.12 22.62 2jb4 s ALA 277 CO -0.01 -0.20 1.26 -2.00 0.00 0.00 0.00 175.76 174.81 2jb4 s GLU 278 N -0.12 3.85 0.28 0.00 2.56 -1.26 -3.72 118.70 120.28 2jb4 s GLU 278 Ca -0.03 1.07 -0.11 0.00 0.00 0.00 0.00 54.97 55.90 2jb4 s GLU 278 Cb -0.03 -3.89 0.00 0.00 2.00 0.00 0.00 34.13 32.21 2jb4 s GLU 278 CO 0.02 -1.21 0.49 -0.98 -0.56 0.00 0.00 175.26 173.02 2jb4 s ARG 279 N 4.27 1.67 0.01 4.30 1.70 -0.03 -4.91 118.95 125.96 2jb4 s ARG 279 Ca 0.54 -1.38 0.07 0.00 -0.47 0.00 0.00 55.73 54.49 2jb4 s ARG 279 Cb -0.14 0.47 -0.02 0.00 -0.57 0.00 0.00 34.95 34.69 2jb4 s ARG 279 CO 0.25 -0.70 -0.20 -0.65 -1.08 0.00 0.00 175.30 172.92 2jb4 s GLN 280 N -3.68 1.54 -0.20 3.89 -0.21 -1.26 -1.51 119.66 118.23 2jb4 s GLN 280 Ca 0.24 -0.79 -0.02 0.00 0.02 0.00 0.00 55.36 54.81 2jb4 s GLN 280 Cb -0.01 -1.54 0.06 0.00 1.00 0.00 0.00 33.01 32.52 2jb4 s GLN 280 CO 0.12 0.41 0.00 0.45 -2.12 0.00 0.00 175.29 174.15 2jb4 s SER 281 N -0.72 3.10 -0.68 5.90 0.15 -0.77 -2.03 113.70 118.65 2jb4 s SER 281 Ca 0.08 -0.87 0.05 0.00 0.70 0.00 0.00 55.95 55.91 2jb4 s SER 281 Cb -0.08 -0.78 0.20 0.00 -1.71 0.00 0.00 66.02 63.66 2jb4 s SER 281 CO 0.00 -0.27 0.60 0.18 1.20 0.00 0.00 173.24 174.95 2jb4 n LEU 282 N 4.93 3.31 -4.79 3.45 4.77 0.53 -1.34 117.00 127.86 2jb4 n LEU 282 Ca -0.10 -5.31 -0.36 0.00 -0.03 0.00 0.00 56.01 50.22 2jb4 n LEU 282 Cb 0.46 -0.70 -0.05 0.00 -2.33 0.00 0.00 43.42 40.80 2jb4 n LEU 282 CO 0.15 1.89 0.69 -2.16 -1.33 0.00 0.00 177.39 176.63 2jb4 s PRO 283 N -1.89 4.28 -0.24 3.23 0.04 -1.18 -2.50 135.00 136.74 2jb4 s PRO 283 Ca 0.31 1.38 -0.03 0.00 0.04 0.00 0.00 61.00 62.70 2jb4 s PRO 283 Cb 0.04 -2.54 0.01 0.00 0.04 0.00 0.00 34.50 32.05 2jb4 s PRO 283 CO -0.10 -0.01 -0.03 0.12 0.04 0.00 0.00 177.00 177.01 2jb4 s PHE 284 N -1.75 3.02 -0.35 0.56 5.36 -0.18 -1.84 117.98 122.81 2jb4 s PHE 284 Ca 0.57 -1.17 -0.17 0.00 -0.96 0.00 0.00 56.93 55.19 2jb4 s PHE 284 Cb -0.18 -2.11 -0.01 0.00 -0.34 0.00 0.00 43.02 40.38 2jb4 s PHE 284 CO 0.24 -0.62 0.46 -0.06 -1.46 0.00 0.00 175.22 173.78 2jb4 s PHE 285 N 1.42 3.19 -0.62 10.12 0.08 -0.29 -1.12 117.98 130.77 2jb4 s PHE 285 Ca 0.03 0.11 -0.26 0.00 0.12 0.00 0.00 56.93 56.93 2jb4 s PHE 285 Cb -0.15 -2.84 0.04 0.00 -0.57 0.00 0.00 43.02 39.49 2jb4 s PHE 285 CO -0.03 -0.50 1.12 0.08 -0.10 0.00 0.00 175.22 175.79 2jb4 s VAL 286 N 2.26 4.08 0.08 -0.44 1.01 -0.12 -2.42 120.40 124.85 2jb4 s VAL 286 Ca 0.16 0.48 0.07 0.00 0.00 0.00 0.00 61.98 62.69 2jb4 s VAL 286 Cb -0.16 -4.72 -0.04 0.00 0.00 0.00 0.00 36.38 31.46 2jb4 s VAL 286 CO 0.13 -1.42 -0.12 0.20 0.00 0.00 0.00 175.10 173.88 2jb4 s ASN 287 N 3.20 4.26 0.24 3.32 0.01 -1.26 -0.92 114.94 123.78 2jb4 s ASN 287 Ca 0.35 -0.38 0.00 0.00 -0.71 0.00 0.00 52.86 52.12 2jb4 s ASN 287 Cb -0.10 -0.79 0.00 0.00 0.41 0.00 0.00 41.25 40.77 2jb4 s ASN 287 CO 0.20 0.21 0.00 0.18 -1.51 0.00 0.00 177.10 176.17 2jb4 n LEU 288 N 0.97 0.00 -4.90 0.60 4.77 -1.26 -3.80 117.00 113.37 2jb4 n LEU 288 Ca -0.14 0.00 -0.28 0.00 -0.03 0.00 0.00 56.01 55.55 2jb4 n LEU 288 Cb 0.52 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.65 2jb4 n LEU 288 CO 0.31 -0.16 0.63 -0.83 -1.33 0.00 0.00 177.39 176.01 2jb4 s GLY 289 N -1.56 1.61 0.25 -0.72 0.00 -1.20 -1.49 107.32 104.21 2jb4 s GLY 289 Ca 0.00 -0.53 -0.04 0.00 0.00 0.00 0.00 44.72 44.15 2jb4 s GLY 289 CO 0.00 -0.21 1.87 -1.82 0.00 0.00 0.00 173.10 172.93 2jb4 h TYR 290 N -0.37 1.07 -0.26 1.90 3.20 -1.94 -2.17 116.97 118.41 2jb4 h TYR 290 Ca -0.45 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.45 2jb4 h TYR 290 Cb 1.25 -0.35 0.00 0.00 1.54 0.00 0.00 36.73 39.17 2jb4 h TYR 290 CO 0.49 0.56 0.00 -0.25 -1.64 0.00 0.00 178.16 177.32 2jb4 n ASP 291 N -4.57 2.71 -4.73 -2.11 8.00 -1.26 -0.74 116.55 113.85 2jb4 n ASP 291 Ca 0.13 -1.88 -0.42 0.00 0.71 0.00 0.00 54.79 53.34 2jb4 n ASP 291 Cb 0.17 -0.17 -0.03 0.00 -0.02 0.00 0.00 41.12 41.08 2jb4 n ASP 291 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 2jb4 s SER 292 N -1.58 6.63 -0.05 -2.24 0.01 -0.82 -4.78 113.70 110.87 2jb4 s SER 292 Ca 0.35 2.62 0.00 0.00 1.31 0.00 0.00 55.95 60.23 2jb4 s SER 292 Cb 0.21 -2.61 0.03 0.00 0.21 0.00 0.00 66.02 63.85 2jb4 s SER 292 CO 0.30 -0.76 -0.01 -0.69 0.41 0.00 0.00 173.24 172.48 2jb4 s VAL 293 N 0.64 0.35 -0.11 3.43 1.01 -1.26 -0.71 120.40 123.76 2jb4 s VAL 293 Ca 0.65 0.03 0.01 0.00 0.00 0.00 0.00 61.98 62.66 2jb4 s VAL 293 Cb -0.42 -0.44 -0.02 0.00 0.00 0.00 0.00 36.38 35.49 2jb4 s VAL 293 CO 0.36 0.20 -0.13 -0.63 0.00 0.00 0.00 175.10 174.91 2jb4 s ILE 294 N 1.24 3.14 0.07 2.22 1.01 -1.26 -5.08 121.20 122.53 2jb4 s ILE 294 Ca -0.06 -0.65 -0.31 0.00 0.00 0.00 0.00 60.65 59.63 2jb4 s ILE 294 Cb -0.13 -2.29 -0.07 0.00 0.01 0.00 0.00 42.46 39.98 2jb4 s ILE 294 CO -0.02 0.54 1.33 -1.81 0.00 0.00 0.00 174.94 174.99 2jb4 s ASP 295 N 0.01 6.91 0.64 3.58 1.01 -1.26 -4.64 116.67 122.92 2jb4 s ASP 295 Ca -0.04 2.17 -0.18 0.00 0.71 0.00 0.00 52.55 55.22 2jb4 s ASP 295 Cb -0.14 -2.58 -0.01 0.00 1.01 0.00 0.00 42.92 41.20 2jb4 s ASP 295 CO 0.04 -0.61 1.21 -2.84 0.21 0.00 0.00 175.17 173.18 2jb4 s PRO 296 N 1.43 2.70 0.27 8.23 0.02 -1.26 -5.01 135.00 141.38 2jb4 s PRO 296 Ca 0.62 1.81 -0.02 0.00 0.02 0.00 0.00 61.00 63.44 2jb4 s PRO 296 Cb -0.33 -1.90 -0.02 0.00 0.02 0.00 0.00 34.50 32.27 2jb4 s PRO 296 CO 0.29 -1.41 0.31 -0.59 -0.33 0.00 0.00 177.00 175.27 2jb4 s PHE 297 N -1.71 1.10 -0.25 6.54 -0.71 -0.12 -4.44 117.98 118.40 2jb4 s PHE 297 Ca 0.77 -1.29 -0.04 0.00 -1.04 0.00 0.00 56.93 55.32 2jb4 s PHE 297 Cb -0.30 -0.33 0.09 0.00 -1.21 0.00 0.00 43.02 41.26 2jb4 s PHE 297 CO 0.37 -0.88 0.12 0.34 -1.34 0.00 0.00 175.22 173.83 2jb4 s ASP 298 N -3.20 3.14 0.00 1.98 -1.08 -0.44 -3.29 116.67 113.79 2jb4 s ASP 298 Ca 0.34 -1.07 0.13 0.00 -0.52 0.00 0.00 52.55 51.43 2jb4 s ASP 298 Cb 0.03 -0.32 0.73 0.00 -1.46 0.00 0.00 42.92 41.90 2jb4 s ASP 298 CO 0.17 -0.41 1.23 -2.65 0.52 0.00 0.00 175.17 174.03 2jb4 n PRO 299 N 5.26 0.34 0.02 4.34 -0.02 -1.26 -1.69 135.00 141.98 2jb4 n PRO 299 Ca -0.06 0.05 0.12 0.00 -2.02 0.00 0.00 63.50 61.58 2jb4 n PRO 299 Cb 0.44 -1.50 0.16 0.00 -0.02 0.00 0.00 33.50 32.59 2jb4 n PRO 299 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2jb4 n ARG 300 N -1.08 0.12 -3.97 -0.52 1.74 -1.26 -4.93 116.66 106.76 2jb4 n ARG 300 Ca 0.09 0.02 -0.36 0.00 -0.77 0.00 0.00 57.85 56.83 2jb4 n ARG 300 Cb 0.06 -1.56 -0.08 0.00 -1.02 0.00 0.00 32.46 29.86 2jb4 n ARG 300 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 2jb4 s GLU 301 N -3.08 3.59 0.27 5.56 0.41 -0.68 -5.00 118.70 119.77 2jb4 s GLU 301 Ca 0.08 -0.24 -0.00 0.00 -0.41 0.00 0.00 54.97 54.40 2jb4 s GLU 301 Cb 0.16 -3.16 0.61 0.00 -1.78 0.00 0.00 34.13 29.96 2jb4 s GLU 301 CO 0.74 0.59 1.69 -1.35 -0.49 0.00 0.00 175.26 176.43 2jb4 h PRO 302 N 5.63 0.33 -0.07 0.39 0.11 -1.92 -0.78 132.00 135.70 2jb4 h PRO 302 Ca -0.48 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2jb4 h PRO 302 Cb 1.20 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.23 2jb4 h PRO 302 CO 0.63 0.22 0.00 0.27 -0.21 0.00 0.00 178.00 178.91 2jb4 n ASN 303 N -5.10 1.23 0.00 -2.05 0.23 -1.26 -4.92 115.26 103.39 2jb4 n ASN 303 Ca 0.19 -1.52 0.00 0.00 -0.53 0.00 0.00 54.58 52.72 2jb4 n ASN 303 Cb 0.57 -0.04 0.00 0.00 -2.08 0.00 0.00 39.78 38.23 2jb4 n ASN 303 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2jb4 n GLY 304 N 1.09 0.25 3.82 4.83 0.00 -0.30 -4.98 105.19 109.91 2jb4 n GLY 304 Ca 0.18 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.86 2jb4 n GLY 304 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jb4 s LYS 305 N -1.05 4.19 0.08 1.61 3.01 -1.26 -1.33 119.74 124.99 2jb4 s LYS 305 Ca 0.00 0.97 0.06 0.00 -1.01 0.00 0.00 55.97 56.00 2jb4 s LYS 305 Cb 0.00 -2.38 -0.03 0.00 -1.01 0.00 0.00 37.83 34.41 2jb4 s LYS 305 CO 0.00 0.10 -0.17 0.45 0.51 0.00 0.00 175.35 176.23 2jb4 s SER 306 N -2.11 2.07 -0.25 2.83 0.15 -1.26 -4.30 113.70 110.83 2jb4 s SER 306 Ca 0.57 -0.61 0.06 0.00 0.70 0.00 0.00 55.95 56.67 2jb4 s SER 306 Cb -0.11 -0.10 0.54 0.00 -1.71 0.00 0.00 66.02 64.63 2jb4 s SER 306 CO 0.16 0.01 1.53 0.47 1.20 0.00 0.00 173.24 176.61 2jb4 n ASP 307 N 1.35 3.98 -4.88 5.45 8.00 -1.26 -4.89 116.55 124.29 2jb4 n ASP 307 Ca -0.20 -2.91 -0.33 0.00 0.71 0.00 0.00 54.79 52.06 2jb4 n ASP 307 Cb 0.54 -0.69 -0.05 0.00 -0.02 0.00 0.00 41.12 40.90 2jb4 n ASP 307 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 2jb4 s ARG 308 N -2.32 3.70 0.14 -1.24 0.52 -1.26 -5.11 118.95 113.39 2jb4 s ARG 308 Ca 0.40 0.07 -0.06 0.00 -0.52 0.00 0.00 55.73 55.62 2jb4 s ARG 308 Cb 0.32 -2.86 -0.06 0.00 0.52 0.00 0.00 34.95 32.87 2jb4 s ARG 308 CO 0.10 0.47 0.40 -1.21 0.02 0.00 0.00 175.30 175.08 2jb4 s GLU 309 N -2.43 3.66 0.40 3.54 0.41 -1.26 -4.78 118.70 118.24 2jb4 s GLU 309 Ca 0.40 -0.01 -0.27 0.00 -0.41 0.00 0.00 54.97 54.68 2jb4 s GLU 309 Cb -0.13 -2.84 -0.10 0.00 -1.78 0.00 0.00 34.13 29.28 2jb4 s GLU 309 CO 0.22 0.46 1.40 -2.30 -0.49 0.00 0.00 175.26 174.55 2jb4 n PRO 310 N 0.18 2.34 -3.82 0.39 -0.02 -1.26 -4.84 135.00 127.97 2jb4 n PRO 310 Ca -0.03 0.82 -0.23 0.00 -2.02 0.00 0.00 63.50 62.05 2jb4 n PRO 310 Cb 0.52 -2.56 -0.17 0.00 -0.02 0.00 0.00 33.50 31.27 2jb4 n PRO 310 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 2jb4 s LEU 311 N -2.01 0.71 0.54 2.45 2.96 -1.26 -5.09 118.68 116.98 2jb4 s LEU 311 Ca 0.57 -0.11 -0.19 0.00 -0.22 0.00 0.00 54.13 54.18 2jb4 s LEU 311 Cb -0.49 -0.48 -0.06 0.00 0.50 0.00 0.00 46.19 45.67 2jb4 s LEU 311 CO 0.61 -0.17 1.11 -0.94 -1.32 0.00 0.00 176.35 175.64 2jb4 s SER 312 N 1.84 5.77 0.25 3.68 1.04 -1.26 -4.56 113.70 120.46 2jb4 s SER 312 Ca 0.03 2.12 -0.04 0.00 0.48 0.00 0.00 55.95 58.55 2jb4 s SER 312 Cb -0.12 -2.58 0.30 0.00 0.10 0.00 0.00 66.02 63.72 2jb4 s SER 312 CO -0.05 -1.18 1.81 0.22 0.98 0.00 0.00 173.24 175.01 2jb4 h TYR 313 N 1.16 1.01 -0.88 5.02 5.03 -1.03 -1.61 116.97 125.67 2jb4 h TYR 313 Ca -0.50 -0.09 -0.00 0.00 2.58 0.00 0.00 58.73 60.73 2jb4 h TYR 313 Cb 1.25 -0.30 -0.04 0.00 1.55 0.00 0.00 36.73 39.19 2jb4 h TYR 313 CO 0.52 0.80 0.54 0.78 -1.32 0.00 0.00 178.16 179.49 2jb4 h GLY 314 N 1.05 1.27 0.89 1.82 0.00 -1.08 0.11 103.07 107.13 2jb4 h GLY 314 Ca 0.21 -0.51 -0.01 0.00 0.00 0.00 0.00 47.33 47.02 2jb4 h GLY 314 CO -0.01 0.50 0.08 -0.55 0.00 0.00 0.00 176.54 176.56 2jb4 h ASP 315 N 1.21 0.27 -0.18 0.19 3.32 -1.68 -1.73 116.42 117.83 2jb4 h ASP 315 Ca 0.32 -0.16 0.04 0.00 0.02 0.00 0.00 57.03 57.25 2jb4 h ASP 315 Cb -0.07 -0.07 -0.05 0.00 0.22 0.00 0.00 39.33 39.36 2jb4 h ASP 315 CO -0.06 0.36 -0.11 0.22 -1.72 0.00 0.00 179.24 177.92 2jb4 h TYR 316 N 0.17 -0.28 -0.07 4.55 3.20 -0.95 -2.69 116.97 120.90 2jb4 h TYR 316 Ca 0.07 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.93 2jb4 h TYR 316 Cb 0.17 0.15 -0.00 0.00 1.54 0.00 0.00 36.73 38.59 2jb4 h TYR 316 CO -0.01 -0.17 -0.05 1.25 -1.64 0.00 0.00 178.16 177.53 2jb4 h LEU 317 N -0.11 0.17 -0.45 2.82 5.85 -0.65 -0.49 115.31 122.44 2jb4 h LEU 317 Ca 0.10 -0.45 0.03 0.00 0.84 0.00 0.00 57.88 58.40 2jb4 h LEU 317 Cb 0.26 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.21 2jb4 h LEU 317 CO -0.25 0.58 0.25 -0.61 -0.34 0.00 0.00 178.44 178.07 2jb4 h GLN 318 N -0.25 0.48 -0.64 1.25 4.15 -1.33 -1.66 115.11 117.11 2jb4 h GLN 318 Ca 0.01 -0.03 -0.07 0.00 0.77 0.00 0.00 58.65 59.34 2jb4 h GLN 318 Cb 0.53 -0.11 -0.03 0.00 0.21 0.00 0.00 27.48 28.08 2jb4 h GLN 318 CO 0.01 0.32 0.13 -0.91 -1.93 0.00 0.00 178.83 176.45 2jb4 h ASN 319 N 0.49 0.99 -0.42 -0.69 2.35 -1.46 -3.11 115.58 113.73 2jb4 h ASN 319 Ca 0.19 -0.25 -0.15 0.00 -0.55 0.00 0.00 56.30 55.55 2jb4 h ASN 319 Cb 0.06 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.16 2jb4 h ASN 319 CO -0.11 0.98 -0.31 1.23 -1.65 0.00 0.00 177.43 177.57 2jb4 h GLY 320 N 0.95 1.04 1.06 2.83 0.00 -0.67 -1.87 103.07 106.41 2jb4 h GLY 320 Ca 0.20 -1.00 -0.11 0.00 0.00 0.00 0.00 47.33 46.41 2jb4 h GLY 320 CO 0.01 0.91 -0.14 1.41 0.00 0.00 0.00 176.54 178.72 2jb4 h LEU 321 N 0.79 0.94 -0.14 3.11 3.38 -1.35 -1.38 115.31 120.67 2jb4 h LEU 321 Ca 0.08 -0.37 0.00 0.00 0.09 0.00 0.00 57.88 57.68 2jb4 h LEU 321 Cb 0.90 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 2jb4 h LEU 321 CO 0.08 1.10 0.08 0.58 0.09 0.00 0.00 178.44 180.38 2jb4 h VAL 322 N 0.78 1.02 -0.80 1.22 2.07 -1.52 -2.44 116.25 116.59 2jb4 h VAL 322 Ca 0.12 -0.06 -0.03 0.00 0.82 0.00 0.00 66.70 67.55 2jb4 h VAL 322 Cb 0.70 0.83 -0.04 0.00 -1.52 0.00 0.00 31.29 31.27 2jb4 h VAL 322 CO 0.05 0.03 0.39 0.28 0.02 0.00 0.00 177.57 178.35 2jb4 h SER 323 N 0.18 1.03 -0.16 0.57 0.02 -1.10 -1.27 113.55 112.82 2jb4 h SER 323 Ca 0.05 -0.11 -0.12 0.00 -0.84 0.00 0.00 61.79 60.77 2jb4 h SER 323 Cb -0.01 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.25 2jb4 h SER 323 CO -0.02 0.86 -0.32 0.25 -1.14 0.00 0.00 176.83 176.46 2jb4 h LEU 324 N 1.13 0.68 -0.31 5.07 5.85 -1.18 0.05 115.31 126.59 2jb4 h LEU 324 Ca 0.28 -0.27 -0.02 0.00 0.84 0.00 0.00 57.88 58.71 2jb4 h LEU 324 Cb 0.09 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 40.92 2jb4 h LEU 324 CO -0.04 0.95 0.14 0.40 -0.34 0.00 0.00 178.44 179.55 2jb4 h ILE 325 N 0.56 1.17 -0.86 4.05 2.04 -1.07 0.12 117.51 123.52 2jb4 h ILE 325 Ca 0.06 -0.51 -0.01 0.00 1.00 0.00 0.00 64.86 65.40 2jb4 h ILE 325 Cb 0.82 0.93 -0.04 0.00 -0.74 0.00 0.00 36.82 37.78 2jb4 h ILE 325 CO 0.07 0.18 0.50 0.78 0.00 0.00 0.00 178.15 179.68 2jb4 h ASN 326 N 0.36 1.05 0.03 1.72 2.35 -0.98 0.13 115.58 120.24 2jb4 h ASN 326 Ca 0.11 -0.07 -0.00 0.00 -0.55 0.00 0.00 56.30 55.78 2jb4 h ASN 326 Cb 0.16 -0.26 0.00 0.00 0.05 0.00 0.00 38.32 38.26 2jb4 h ASN 326 CO -0.01 0.82 -0.01 0.50 -1.65 0.00 0.00 177.43 177.08 2jb4 h LYS 327 N 1.19 -0.04 -0.06 0.81 3.64 -0.80 -3.39 116.57 117.92 2jb4 h LYS 327 Ca 0.31 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.69 2jb4 h LYS 327 Cb -0.02 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 31.81 2jb4 h LYS 327 CO -0.05 0.63 0.00 0.09 -2.27 0.00 0.00 179.45 177.85 2jb4 n ASN 328 N -4.77 1.98 0.00 4.20 4.13 0.01 -5.10 115.26 115.71 2jb4 n ASN 328 Ca -0.09 -1.51 0.00 0.00 1.68 0.00 0.00 54.58 54.67 2jb4 n ASN 328 Cb 0.34 -0.04 0.00 0.00 -1.54 0.00 0.00 39.78 38.54 2jb4 n ASN 328 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2jb4 n GLY 329 N 0.50 2.24 3.66 7.41 0.00 0.44 -4.86 105.19 114.58 2jb4 n GLY 329 Ca 0.06 -1.82 -0.42 0.00 0.00 0.00 0.00 46.02 43.84 2jb4 n GLY 329 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2jb4 s GLN 330 N -3.49 4.19 0.00 1.61 2.00 -1.26 -4.57 119.66 118.15 2jb4 s GLN 330 Ca 0.00 2.11 0.31 0.00 -2.00 0.00 0.00 55.36 55.78 2jb4 s GLN 330 Cb 0.00 -3.94 1.67 0.00 0.80 0.00 0.00 33.01 31.54 2jb4 s GLN 330 CO 0.00 -0.82 2.09 0.25 -0.50 0.00 0.00 175.29 176.31