#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bs2 s THR 2 N 0.00 1.19 0.20 3.17 -4.23 -1.26 -5.04 115.64 109.67 2bs2 s THR 2 Ca 0.00 -2.06 -0.10 0.00 -1.18 0.00 0.00 61.69 58.35 2bs2 s THR 2 Cb 0.00 -2.25 0.13 0.00 1.34 0.00 0.00 72.50 71.72 2bs2 s THR 2 CO 0.00 -0.41 1.81 0.78 -0.54 0.00 0.00 174.62 176.26 2bs2 h ASN 3 N 2.50 0.54 -0.56 3.99 2.35 -2.05 -1.60 115.58 120.75 2bs2 h ASN 3 Ca -0.38 0.03 0.00 0.00 -0.55 0.00 0.00 56.30 55.40 2bs2 h ASN 3 Cb 1.22 -0.08 -0.03 0.00 0.05 0.00 0.00 38.32 39.48 2bs2 h ASN 3 CO 0.65 0.35 0.36 1.05 -1.65 0.00 0.00 177.43 178.19 2bs2 h GLU 4 N 0.67 0.75 -0.23 0.81 9.09 -1.99 -0.53 114.58 123.15 2bs2 h GLU 4 Ca 0.28 -0.05 -0.08 0.00 0.05 0.00 0.00 59.36 59.56 2bs2 h GLU 4 Cb 0.16 -0.16 -0.01 0.00 -1.65 0.00 0.00 28.75 27.08 2bs2 h GLU 4 CO -0.17 0.51 -0.20 0.66 0.05 0.00 0.00 179.01 179.85 2bs2 h SER 5 N 0.76 0.40 -0.19 3.06 4.64 -1.87 -0.65 113.55 119.70 2bs2 h SER 5 Ca 0.20 -0.12 -0.04 0.00 -0.47 0.00 0.00 61.79 61.36 2bs2 h SER 5 Cb -0.07 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 61.91 2bs2 h SER 5 CO -0.04 0.62 -0.05 0.40 -0.87 0.00 0.00 176.83 176.88 2bs2 h ILE 6 N 0.37 1.29 -0.87 0.95 2.04 -0.81 -0.44 117.51 120.03 2bs2 h ILE 6 Ca 0.06 -1.04 0.00 0.00 1.00 0.00 0.00 64.86 64.89 2bs2 h ILE 6 Cb 0.57 1.58 -0.04 0.00 -0.74 0.00 0.00 36.82 38.18 2bs2 h ILE 6 CO 0.04 0.31 0.54 -0.07 0.00 0.00 0.00 178.15 178.97 2bs2 h LEU 7 N 0.09 1.02 -0.27 1.44 3.38 -0.83 -0.87 115.31 119.28 2bs2 h LEU 7 Ca 0.05 -0.05 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 2bs2 h LEU 7 Cb 0.50 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 2bs2 h LEU 7 CO 0.02 0.77 -0.07 -0.08 0.09 0.00 0.00 178.44 179.17 2bs2 h GLU 8 N 1.19 0.52 -0.61 1.13 4.81 -1.02 0.50 114.58 121.10 2bs2 h GLU 8 Ca 0.31 -0.20 0.01 0.00 -0.13 0.00 0.00 59.36 59.35 2bs2 h GLU 8 Cb -0.08 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.24 2bs2 h GLU 8 CO -0.06 0.73 0.40 0.77 -0.73 0.00 0.00 179.01 180.12 2bs2 h SER 9 N 0.27 0.68 1.03 1.04 0.02 -0.77 0.24 113.55 116.07 2bs2 h SER 9 Ca 0.07 -0.01 -0.19 0.00 -0.84 0.00 0.00 61.79 60.81 2bs2 h SER 9 Cb 0.55 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 62.89 2bs2 h SER 9 CO 0.03 0.49 -1.00 1.88 -1.14 0.00 0.00 176.83 177.09 2bs2 h TYR 10 N 0.80 0.00 0.00 3.45 -1.99 -1.14 -3.36 116.97 114.73 2bs2 h TYR 10 Ca 0.23 0.00 -0.21 0.00 2.00 0.00 0.00 58.73 60.75 2bs2 h TYR 10 Cb -0.07 0.00 -0.04 0.00 2.00 0.00 0.00 36.73 38.62 2bs2 h TYR 10 CO -0.04 0.85 -2.03 -1.13 -0.00 0.00 0.00 178.16 175.81 2bs2 n SER 11 N -3.25 0.21 0.00 3.88 3.41 0.16 -4.98 113.62 113.06 2bs2 n SER 11 Ca -0.02 0.09 0.00 0.00 -0.26 0.00 0.00 58.87 58.68 2bs2 n SER 11 Cb 0.90 1.09 0.00 0.00 -0.26 0.00 0.00 64.21 65.94 2bs2 n SER 11 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2bs2 n GLY 12 N 1.52 0.86 3.20 5.00 0.00 0.85 -5.02 105.19 111.60 2bs2 n GLY 12 Ca -0.19 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.73 2bs2 n GLY 12 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2bs2 s VAL 13 N -2.91 0.06 0.89 1.61 -7.23 -1.24 -4.77 120.40 106.81 2bs2 s VAL 13 Ca 0.00 -1.88 -0.12 0.00 -1.81 0.00 0.00 61.98 58.17 2bs2 s VAL 13 Cb 0.00 -2.20 0.13 0.00 0.56 0.00 0.00 36.38 34.87 2bs2 s VAL 13 CO 0.00 -0.26 1.13 0.42 -0.31 0.00 0.00 175.10 176.08 2bs2 s THR 14 N -4.08 2.16 0.63 5.32 -4.23 0.18 -3.65 115.64 111.97 2bs2 s THR 14 Ca 0.29 0.05 0.33 0.00 -1.18 0.00 0.00 61.69 61.18 2bs2 s THR 14 Cb 0.07 -2.80 0.37 0.00 1.34 0.00 0.00 72.50 71.47 2bs2 s THR 14 CO 0.06 -0.07 2.13 -0.65 -0.54 0.00 0.00 174.62 175.54 2bs2 h PRO 15 N -1.43 0.00 -0.18 3.99 0.11 -1.89 0.54 132.00 133.14 2bs2 h PRO 15 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2bs2 h PRO 15 Cb 1.32 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.43 2bs2 h PRO 15 CO 0.62 0.00 0.00 0.39 -0.21 0.00 0.00 178.00 178.80 2bs2 n GLU 16 N -3.40 1.71 -3.13 1.05 -0.58 -1.26 -4.92 120.64 110.11 2bs2 n GLU 16 Ca -0.00 -1.07 -0.14 0.00 -0.42 0.00 0.00 57.16 55.53 2bs2 n GLU 16 Cb 0.28 -1.38 0.07 0.00 -0.57 0.00 0.00 31.44 29.83 2bs2 n GLU 16 CO 0.00 0.00 0.00 -2.13 -0.48 0.00 0.00 177.13 174.52 2bs2 n ARG 17 N 0.30 -5.19 -4.32 3.49 0.63 0.19 -5.04 116.66 106.71 2bs2 n ARG 17 Ca 0.16 0.63 -0.17 0.00 -0.92 0.00 0.00 57.85 57.55 2bs2 n ARG 17 Cb 0.31 -5.02 -0.10 0.00 0.45 0.00 0.00 32.46 28.11 2bs2 n ARG 17 CO 0.00 0.00 0.00 0.15 -2.51 0.00 0.00 177.63 175.27 2bs2 s LYS 18 N -5.25 1.27 0.33 -0.14 1.02 -1.25 -4.87 119.74 110.85 2bs2 s LYS 18 Ca 0.11 -1.59 -0.26 0.00 0.02 0.00 0.00 55.97 54.25 2bs2 s LYS 18 Cb -0.05 -0.83 -0.09 0.00 -0.52 0.00 0.00 37.83 36.34 2bs2 s LYS 18 CO 0.54 0.06 1.01 0.15 -0.92 0.00 0.00 175.35 176.19 2bs2 s LYS 19 N -3.74 4.47 0.52 1.68 1.02 -1.26 -0.64 119.74 121.78 2bs2 s LYS 19 Ca 0.23 1.50 -0.22 0.00 0.02 0.00 0.00 55.97 57.49 2bs2 s LYS 19 Cb 0.03 -2.82 -0.07 0.00 -0.52 0.00 0.00 37.83 34.45 2bs2 s LYS 19 CO 0.06 0.14 1.18 0.45 -0.92 0.00 0.00 175.35 176.25 2bs2 n SER 20 N 0.53 1.91 -0.70 2.83 2.88 -1.26 -4.86 113.62 114.95 2bs2 n SER 20 Ca 0.02 0.96 0.12 0.00 -1.33 0.00 0.00 58.87 58.65 2bs2 n SER 20 Cb 0.49 -1.48 0.35 0.00 -0.75 0.00 0.00 64.21 62.82 2bs2 n SER 20 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2bs2 n ARG 21 N -0.65 1.94 -0.24 -1.46 3.00 -1.26 -4.37 116.66 113.62 2bs2 n ARG 21 Ca 0.10 -1.39 -0.07 0.00 -0.01 0.00 0.00 57.85 56.49 2bs2 n ARG 21 Cb 0.44 -1.46 0.04 0.00 0.00 0.00 0.00 32.46 31.48 2bs2 n ARG 21 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.63 178.15 2bs2 h MET 22 N 3.10 0.98 -0.64 5.56 2.86 -2.00 -2.34 114.93 122.46 2bs2 h MET 22 Ca 0.00 -0.17 0.08 0.00 -2.06 0.00 0.00 59.70 57.55 2bs2 h MET 22 Cb 0.67 -0.16 -0.04 0.00 0.06 0.00 0.00 31.60 32.12 2bs2 h MET 22 CO 0.00 0.81 0.42 -1.35 1.06 0.00 0.00 176.91 177.85 2bs2 h PRO 23 N 0.93 0.54 -0.22 -0.22 0.11 -2.00 0.19 132.00 131.34 2bs2 h PRO 23 Ca 0.22 -0.03 -0.08 0.00 0.11 0.00 0.00 66.00 66.22 2bs2 h PRO 23 Cb 0.18 -0.12 -0.00 0.00 0.11 0.00 0.00 31.00 31.17 2bs2 h PRO 23 CO -0.02 0.36 -0.17 0.00 -0.21 0.00 0.00 178.00 177.96 2bs2 h ALA 24 N 1.67 0.31 -0.36 -0.75 0.00 -1.77 -1.98 119.26 116.38 2bs2 h ALA 24 Ca 0.28 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 2bs2 h ALA 24 Cb 0.38 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 2bs2 h ALA 24 CO -0.09 0.22 0.20 0.87 0.00 0.00 0.00 179.25 180.46 2bs2 h LYS 25 N 0.19 0.49 -0.78 0.00 1.57 -0.81 -1.10 116.57 116.13 2bs2 h LYS 25 Ca 0.04 -0.05 -0.03 0.00 -1.87 0.00 0.00 60.65 58.74 2bs2 h LYS 25 Cb 0.70 -0.10 -0.04 0.00 0.08 0.00 0.00 32.23 32.88 2bs2 h LYS 25 CO 0.05 0.40 0.37 -0.07 -0.57 0.00 0.00 179.45 179.62 2bs2 h LEU 26 N 0.46 1.01 -0.51 2.94 3.38 -1.00 0.34 115.31 121.93 2bs2 h LEU 26 Ca 0.13 -0.12 -0.05 0.00 0.09 0.00 0.00 57.88 57.93 2bs2 h LEU 26 Cb 0.04 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.51 2bs2 h LEU 26 CO -0.02 0.86 0.14 -0.78 0.09 0.00 0.00 178.44 178.73 2bs2 h ASP 27 N 1.11 0.76 0.42 -0.43 3.58 -1.08 -0.11 116.42 120.67 2bs2 h ASP 27 Ca 0.27 -0.22 -0.02 0.00 0.42 0.00 0.00 57.03 57.48 2bs2 h ASP 27 Cb 0.11 -0.20 0.00 0.00 1.72 0.00 0.00 39.33 40.97 2bs2 h ASP 27 CO -0.03 0.78 -0.20 -0.25 -2.88 0.00 0.00 179.24 176.65 2bs2 h TRP 28 N 0.70 -0.52 -0.22 0.28 7.01 -0.64 -2.58 115.95 119.97 2bs2 h TRP 28 Ca 0.16 -0.01 -0.02 0.00 2.11 0.00 0.00 58.89 61.13 2bs2 h TRP 28 Cb 0.30 0.17 -0.01 0.00 -2.10 0.00 0.00 29.16 27.52 2bs2 h TRP 28 CO 0.02 -0.28 0.06 -1.49 -2.79 0.00 0.00 178.44 173.96 2bs2 h TRP 29 N -0.64 0.31 -0.22 2.65 4.06 -0.86 0.98 115.95 122.22 2bs2 h TRP 29 Ca -0.06 -0.01 -0.01 0.00 2.06 0.00 0.00 58.89 60.87 2bs2 h TRP 29 Cb 0.47 -0.10 -0.01 0.00 -1.00 0.00 0.00 29.16 28.53 2bs2 h TRP 29 CO -0.03 0.27 0.09 0.37 -3.56 0.00 0.00 178.44 175.58 2bs2 h GLN 30 N 0.31 0.33 -0.45 0.49 4.15 -0.86 -0.49 115.11 118.61 2bs2 h GLN 30 Ca 0.08 -0.06 -0.12 0.00 0.77 0.00 0.00 58.65 59.32 2bs2 h GLN 30 Cb 0.11 -0.05 -0.02 0.00 0.21 0.00 0.00 27.48 27.73 2bs2 h GLN 30 CO -0.00 0.39 -0.18 0.77 -1.93 0.00 0.00 178.83 177.87 2bs2 h SER 31 N 0.21 0.88 -0.34 -0.69 0.02 -1.02 -1.59 113.55 111.03 2bs2 h SER 31 Ca 0.07 -0.31 -0.03 0.00 -0.84 0.00 0.00 61.79 60.68 2bs2 h SER 31 Cb 0.18 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.47 2bs2 h SER 31 CO -0.01 1.05 0.09 0.00 -1.14 0.00 0.00 176.83 176.83 2bs2 h ALA 32 N 1.02 0.45 -0.30 3.77 0.00 -0.65 0.18 119.26 123.72 2bs2 h ALA 32 Ca 0.11 -0.17 -0.08 0.00 0.00 0.00 0.00 54.91 54.77 2bs2 h ALA 32 Cb 0.72 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 2bs2 h ALA 32 CO 0.06 0.10 -0.16 1.79 0.00 0.00 0.00 179.25 181.03 2bs2 h THR 33 N 0.39 1.25 -0.33 0.00 1.35 -1.05 -1.44 112.91 113.07 2bs2 h THR 33 Ca 0.11 -1.12 -0.06 0.00 -0.55 0.00 0.00 66.41 64.79 2bs2 h THR 33 Cb 0.28 1.19 -0.01 0.00 -1.73 0.00 0.00 68.15 67.87 2bs2 h THR 33 CO -0.00 0.36 -0.03 1.23 -0.25 0.00 0.00 175.52 176.83 2bs2 h GLY 34 N 0.96 0.66 0.99 5.82 0.00 -0.83 -2.32 103.07 108.35 2bs2 h GLY 34 Ca 0.08 -0.51 -0.00 0.00 0.00 0.00 0.00 47.33 46.90 2bs2 h GLY 34 CO 0.04 0.47 0.30 -2.00 0.00 0.00 0.00 176.54 175.35 2bs2 h LEU 35 N 0.41 0.62 0.03 3.11 5.85 -0.34 -1.18 115.31 123.80 2bs2 h LEU 35 Ca 0.09 -0.07 0.01 0.00 0.84 0.00 0.00 57.88 58.76 2bs2 h LEU 35 Cb 0.50 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.36 2bs2 h LEU 35 CO 0.02 0.51 -0.09 0.15 -0.34 0.00 0.00 178.44 178.69 2bs2 h PHE 36 N 0.69 -0.22 -0.78 1.25 3.57 -1.19 -1.40 116.94 118.86 2bs2 h PHE 36 Ca 0.18 0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.65 2bs2 h PHE 36 Cb 0.00 0.10 -0.04 0.00 2.79 0.00 0.00 35.95 38.81 2bs2 h PHE 36 CO -0.02 -0.14 0.34 -0.07 -2.23 0.00 0.00 178.31 176.19 2bs2 h LEU 37 N -0.17 1.04 -0.21 0.59 3.38 -1.27 0.11 115.31 118.77 2bs2 h LEU 37 Ca 0.03 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 2bs2 h LEU 37 Cb 0.19 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 2bs2 h LEU 37 CO -0.07 0.90 0.11 1.23 0.09 0.00 0.00 178.44 180.69 2bs2 h GLY 38 N 1.15 0.33 1.17 0.83 0.00 -0.93 -1.08 103.07 104.54 2bs2 h GLY 38 Ca 0.26 -0.16 -0.17 0.00 0.00 0.00 0.00 47.33 47.27 2bs2 h GLY 38 CO -0.03 0.15 -0.45 1.41 0.00 0.00 0.00 176.54 177.62 2bs2 h LEU 39 N 0.22 0.97 -0.58 3.11 3.38 -1.12 -3.00 115.31 118.29 2bs2 h LEU 39 Ca 0.07 -0.47 0.07 0.00 0.09 0.00 0.00 57.88 57.64 2bs2 h LEU 39 Cb 0.10 -0.27 -0.06 0.00 0.09 0.00 0.00 40.66 40.52 2bs2 h LEU 39 CO -0.01 1.27 0.27 0.15 0.09 0.00 0.00 178.44 180.20 2bs2 h PHE 40 N 0.71 0.48 -0.41 1.13 3.57 -0.61 -2.23 116.94 119.58 2bs2 h PHE 40 Ca 0.04 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.54 2bs2 h PHE 40 Cb 1.05 -0.13 -0.02 0.00 2.79 0.00 0.00 35.95 39.64 2bs2 h PHE 40 CO 0.06 0.19 0.14 0.52 -2.23 0.00 0.00 178.31 177.00 2bs2 h MET 41 N 0.50 0.59 -0.27 1.11 2.86 -1.12 0.29 114.93 118.89 2bs2 h MET 41 Ca 0.27 -0.09 -0.03 0.00 -2.06 0.00 0.00 59.70 57.80 2bs2 h MET 41 Cb 0.25 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 31.79 2bs2 h MET 41 CO -0.22 0.51 0.06 0.82 1.06 0.00 0.00 176.91 179.14 2bs2 h ILE 42 N 0.58 1.22 -0.31 -1.22 2.04 -1.27 -0.71 117.51 117.83 2bs2 h ILE 42 Ca 0.14 -0.72 -0.08 0.00 1.00 0.00 0.00 64.86 65.19 2bs2 h ILE 42 Cb 0.16 1.17 -0.02 0.00 -0.74 0.00 0.00 36.82 37.40 2bs2 h ILE 42 CO -0.01 0.24 -0.16 1.23 0.00 0.00 0.00 178.15 179.45 2bs2 h GLY 43 N 0.27 0.60 1.00 5.37 0.00 -1.19 -2.80 103.07 106.33 2bs2 h GLY 43 Ca 0.09 -0.45 -0.00 0.00 0.00 0.00 0.00 47.33 46.96 2bs2 h GLY 43 CO 0.00 0.41 0.43 0.84 0.00 0.00 0.00 176.54 178.22 2bs2 h HIS 44 N 0.51 0.93 0.00 5.60 -0.00 -0.57 -1.84 115.15 119.78 2bs2 h HIS 44 Ca 0.09 -0.00 -0.07 0.00 -0.00 0.00 0.00 60.37 60.39 2bs2 h HIS 44 Cb 0.57 -0.31 -0.01 0.00 -0.00 0.00 0.00 27.41 27.66 2bs2 h HIS 44 CO 0.02 0.63 -0.32 0.52 -0.00 0.00 0.00 177.93 178.78 2bs2 h MET 45 N 0.96 0.00 -0.00 5.26 2.86 -0.88 -1.67 114.93 121.47 2bs2 h MET 45 Ca 0.25 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.85 2bs2 h MET 45 Cb -0.03 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.63 2bs2 h MET 45 CO -0.05 0.32 -0.18 0.74 1.06 0.00 0.00 176.91 178.80 2bs2 h PHE 46 N 0.00 0.18 -0.38 -0.22 0.04 -1.31 -2.55 116.94 112.71 2bs2 h PHE 46 Ca -0.00 -0.10 -0.06 0.00 2.80 0.00 0.00 57.97 60.61 2bs2 h PHE 46 Cb 0.57 -0.02 -0.02 0.00 2.20 0.00 0.00 35.95 38.68 2bs2 h PHE 46 CO 0.00 0.90 0.00 0.74 -0.60 0.00 0.00 178.31 179.35 2bs2 h PHE 47 N -0.59 0.63 0.00 -0.55 -1.00 -1.29 -2.36 116.94 111.78 2bs2 h PHE 47 Ca -0.02 -0.07 0.00 0.00 2.81 0.00 0.00 57.97 60.69 2bs2 h PHE 47 Cb 0.95 -0.18 0.00 0.00 3.61 0.00 0.00 35.95 40.33 2bs2 h PHE 47 CO 0.19 0.60 0.00 0.28 -1.61 0.00 0.00 178.31 177.77 2bs2 h VAL 48 N 0.57 0.00 -0.00 -0.55 2.07 -1.40 -3.15 116.25 113.79 2bs2 h VAL 48 Ca 0.12 -0.93 0.00 0.00 0.82 0.00 0.00 66.70 66.71 2bs2 h VAL 48 Cb 0.36 1.93 0.00 0.00 -1.52 0.00 0.00 31.29 32.06 2bs2 h VAL 48 CO 0.01 0.00 -0.13 -1.54 0.02 0.00 0.00 177.57 175.93 2bs2 n SER 49 N -3.09 0.46 0.09 0.57 3.41 -0.90 -3.82 113.62 110.35 2bs2 n SER 49 Ca 0.04 -0.49 0.07 0.00 -0.26 0.00 0.00 58.87 58.22 2bs2 n SER 49 Cb 0.50 -0.07 0.34 0.00 -0.26 0.00 0.00 64.21 64.72 2bs2 n SER 49 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2bs2 n THR 50 N -1.01 1.38 0.29 6.66 -2.24 -1.15 -1.03 114.28 117.19 2bs2 n THR 50 Ca 0.13 0.58 0.17 0.00 -2.27 0.00 0.00 64.05 62.66 2bs2 n THR 50 Cb 0.29 -1.56 0.91 0.00 -2.10 0.00 0.00 70.33 67.86 2bs2 n THR 50 CO 0.00 0.00 0.00 -0.29 -0.57 0.00 0.00 175.07 174.21 2bs2 h ILE 51 N 0.00 0.31 0.00 2.28 6.09 -1.83 0.05 117.51 124.40 2bs2 h ILE 51 Ca 0.00 -0.27 -0.04 0.00 -1.37 0.00 0.00 64.86 63.17 2bs2 h ILE 51 Cb 0.04 1.20 -0.01 0.00 0.47 0.00 0.00 36.82 38.53 2bs2 h ILE 51 CO 0.00 0.04 -0.19 -0.07 -3.07 0.00 0.00 178.15 174.86 2bs2 h LEU 52 N 0.00 0.00 0.00 2.19 3.38 -1.40 -2.95 115.31 116.53 2bs2 h LEU 52 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2bs2 h LEU 52 Cb 0.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.95 2bs2 h LEU 52 CO 0.01 0.19 -0.47 0.18 0.09 0.00 0.00 178.44 178.44 2bs2 n LEU 53 N -3.28 0.58 0.00 1.67 4.77 -0.00 -5.02 117.00 115.71 2bs2 n LEU 53 Ca 0.01 0.22 0.00 0.00 -0.03 0.00 0.00 56.01 56.21 2bs2 n LEU 53 Cb 0.46 -0.25 0.00 0.00 -2.33 0.00 0.00 43.42 41.30 2bs2 n LEU 53 CO 0.33 -0.01 0.00 0.61 -1.33 0.00 0.00 177.39 177.00 2bs2 n GLY 54 N 1.40 3.98 0.28 -0.72 0.00 -1.12 -4.72 105.19 104.30 2bs2 n GLY 54 Ca 0.04 -1.45 0.06 0.00 0.00 0.00 0.00 46.02 44.67 2bs2 n GLY 54 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2bs2 h ASP 55 N 0.00 0.32 0.08 1.61 3.45 -1.86 0.91 116.42 120.93 2bs2 h ASP 55 Ca 0.00 0.11 -0.03 0.00 0.43 0.00 0.00 57.03 57.53 2bs2 h ASP 55 Cb 0.00 0.08 -0.01 0.00 -0.56 0.00 0.00 39.33 38.84 2bs2 h ASP 55 CO 0.00 0.12 -0.12 0.78 -1.57 0.00 0.00 179.24 178.45 2bs2 h ASN 56 N 0.47 0.08 0.52 6.45 2.35 -1.95 -1.40 115.58 122.10 2bs2 h ASN 56 Ca 0.43 -0.01 -0.03 0.00 -0.55 0.00 0.00 56.30 56.14 2bs2 h ASN 56 Cb 0.64 -0.02 0.01 0.00 0.05 0.00 0.00 38.32 39.00 2bs2 h ASN 56 CO -0.40 0.21 -0.25 0.58 -1.65 0.00 0.00 177.43 175.92 2bs2 h VAL 57 N 0.08 0.00 -0.25 2.81 2.07 -1.11 -2.13 116.25 117.72 2bs2 h VAL 57 Ca 0.02 -0.25 -0.04 0.00 0.82 0.00 0.00 66.70 67.25 2bs2 h VAL 57 Cb 0.26 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.02 2bs2 h VAL 57 CO 0.02 0.00 -0.03 0.00 0.02 0.00 0.00 177.57 177.57 2bs2 h MET 58 N -0.94 0.38 -0.74 1.57 -0.00 -1.51 -1.29 114.93 112.40 2bs2 h MET 58 Ca -0.07 -0.08 0.02 0.00 -0.00 0.00 0.00 59.70 59.57 2bs2 h MET 58 Cb 0.54 -0.06 -0.04 0.00 -0.00 0.00 0.00 31.60 32.04 2bs2 h MET 58 CO 0.12 0.44 0.49 1.25 -0.00 0.00 0.00 176.91 179.20 2bs2 h LEU 59 N 0.37 0.81 -0.39 -0.10 5.85 -1.29 0.38 115.31 120.94 2bs2 h LEU 59 Ca 0.08 -0.02 -0.10 0.00 0.84 0.00 0.00 57.88 58.69 2bs2 h LEU 59 Cb 0.30 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.12 2bs2 h LEU 59 CO 0.01 0.58 -0.13 -0.25 -0.34 0.00 0.00 178.44 178.30 2bs2 h TRP 60 N 0.95 0.88 -0.29 1.25 7.01 -0.54 -2.68 115.95 122.54 2bs2 h TRP 60 Ca 0.28 -0.20 -0.08 0.00 2.11 0.00 0.00 58.89 61.00 2bs2 h TRP 60 Cb -0.04 -0.21 -0.01 0.00 -2.10 0.00 0.00 29.16 26.80 2bs2 h TRP 60 CO -0.00 0.93 -0.12 0.28 -2.79 0.00 0.00 178.44 176.74 2bs2 h VAL 61 N 0.58 1.29 -0.98 2.65 2.07 -0.83 -2.79 116.25 118.25 2bs2 h VAL 61 Ca 0.09 -1.20 0.13 0.00 0.82 0.00 0.00 66.70 66.54 2bs2 h VAL 61 Cb 0.67 1.46 -0.08 0.00 -1.52 0.00 0.00 31.29 31.82 2bs2 h VAL 61 CO 0.05 0.38 0.62 0.74 0.02 0.00 0.00 177.57 179.38 2bs2 h THR 62 N 0.35 0.88 0.00 2.57 2.02 -0.26 -0.40 112.91 118.06 2bs2 h THR 62 Ca 0.07 -0.31 -0.12 0.00 0.77 0.00 0.00 66.41 66.82 2bs2 h THR 62 Cb 0.63 -0.10 -0.02 0.00 -1.74 0.00 0.00 68.15 66.92 2bs2 h THR 62 CO 0.04 0.16 -0.55 0.11 0.37 0.00 0.00 175.52 175.65 2bs2 h LYS 63 N 0.90 0.00 -0.28 6.66 1.57 -1.36 -3.11 116.57 120.95 2bs2 h LYS 63 Ca 0.50 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 59.20 2bs2 h LYS 63 Cb 0.59 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.89 2bs2 h LYS 63 CO -0.26 0.55 -0.13 0.87 -0.57 0.00 0.00 179.45 179.90 2bs2 h LYS 64 N 0.00 0.58 0.00 3.15 1.57 -0.82 -2.38 116.57 118.67 2bs2 h LYS 64 Ca -0.01 -0.25 0.00 0.00 -1.87 0.00 0.00 60.65 58.52 2bs2 h LYS 64 Cb 1.02 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.31 2bs2 h LYS 64 CO 0.07 0.82 0.00 0.74 -0.57 0.00 0.00 179.45 180.52 2bs2 h PHE 65 N 0.33 0.00 -0.65 -1.35 0.05 -1.37 0.82 116.94 114.76 2bs2 h PHE 65 Ca 0.06 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.85 2bs2 h PHE 65 Cb 0.65 0.00 0.00 0.00 2.00 0.00 0.00 35.95 38.60 2bs2 h PHE 65 CO 0.06 0.00 0.00 0.39 -0.18 0.00 0.00 178.31 178.58 2bs2 n GLU 66 N -2.31 3.97 -3.12 1.51 1.02 -0.93 -4.52 120.64 116.27 2bs2 n GLU 66 Ca -0.00 -2.95 -0.03 0.00 -0.02 0.00 0.00 57.16 54.16 2bs2 n GLU 66 Cb 0.11 -1.97 0.00 0.00 -0.02 0.00 0.00 31.44 29.56 2bs2 n GLU 66 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2bs2 n LEU 67 N 1.09 -6.40 -0.03 -4.62 4.77 0.28 -1.66 117.00 110.44 2bs2 n LEU 67 Ca 0.27 -0.13 -0.16 0.00 -0.03 0.00 0.00 56.01 55.96 2bs2 n LEU 67 Cb 0.95 -3.17 -0.09 0.00 -2.33 0.00 0.00 43.42 38.79 2bs2 n LEU 67 CO 0.26 -1.04 0.35 -0.78 -1.33 0.00 0.00 177.39 174.85 2bs2 h ASP 68 N 0.46 0.65 0.00 -1.43 1.82 -1.60 -1.06 116.42 115.25 2bs2 h ASP 68 Ca -0.06 -0.65 0.00 0.00 -0.39 0.00 0.00 57.03 55.93 2bs2 h ASP 68 Cb 1.04 -0.19 0.00 0.00 0.68 0.00 0.00 39.33 40.85 2bs2 h ASP 68 CO 0.30 1.19 0.00 2.22 -1.61 0.00 0.00 179.24 181.34 2bs2 n PHE 69 N -4.20 0.00 0.00 0.28 1.16 -1.26 -2.91 117.46 110.53 2bs2 n PHE 69 Ca -0.08 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.50 2bs2 n PHE 69 Cb 0.62 -0.01 0.00 0.00 -1.61 0.00 0.00 39.48 38.48 2bs2 n PHE 69 CO 0.00 0.00 0.00 -0.89 -1.87 0.00 0.00 176.76 174.00 2bs2 n ILE 70 N -0.36 0.00 -4.37 1.97 5.41 -1.18 -5.10 119.36 115.73 2bs2 n ILE 70 Ca 0.00 0.00 -0.22 0.00 1.00 0.00 0.00 62.75 63.53 2bs2 n ILE 70 Cb 0.03 -0.28 -0.11 0.00 -0.71 0.00 0.00 39.64 38.57 2bs2 n ILE 70 CO 0.00 0.00 0.00 -0.36 0.00 0.00 0.00 176.55 176.19 2bs2 s PHE 71 N -1.30 1.93 0.00 1.39 0.40 -0.41 -5.08 117.98 114.91 2bs2 s PHE 71 Ca 0.00 -0.46 0.00 0.00 -0.60 0.00 0.00 56.93 55.87 2bs2 s PHE 71 Cb 0.00 -0.92 0.00 0.00 0.51 0.00 0.00 43.02 42.61 2bs2 s PHE 71 CO 0.00 0.43 0.00 -1.91 0.70 0.00 0.00 175.22 174.44 2bs2 n GLU 72 N -0.03 0.00 -0.27 0.44 2.13 -1.26 -3.39 120.64 118.25 2bs2 n GLU 72 Ca -0.10 0.00 0.07 0.00 0.66 0.00 0.00 57.16 57.78 2bs2 n GLU 72 Cb 0.58 -0.25 0.20 0.00 0.27 0.00 0.00 31.44 32.24 2bs2 n GLU 72 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2bs2 n GLY 73 N 0.00 1.28 0.04 8.31 0.00 -1.26 -4.89 105.19 108.68 2bs2 n GLY 73 Ca 0.00 -0.49 0.00 0.00 0.00 0.00 0.00 46.02 45.53 2bs2 n GLY 73 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bs2 n GLY 74 N 1.08 -2.78 3.52 -0.02 0.00 -1.22 -4.63 105.19 101.15 2bs2 n GLY 74 Ca 0.15 -1.00 -0.43 0.00 0.00 0.00 0.00 46.02 44.74 2bs2 n GLY 74 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bs2 s LYS 75 N -4.01 3.31 0.65 1.61 1.02 -0.66 -4.62 119.74 117.04 2bs2 s LYS 75 Ca 0.00 -0.38 0.32 0.00 0.02 0.00 0.00 55.97 55.93 2bs2 s LYS 75 Cb 0.00 -3.93 1.76 0.00 -0.52 0.00 0.00 37.83 35.14 2bs2 s LYS 75 CO 0.00 -0.93 1.99 -1.35 -0.92 0.00 0.00 175.35 174.13 2bs2 h PRO 76 N 8.79 0.00 0.00 -1.68 0.11 -1.92 -1.08 132.00 136.22 2bs2 h PRO 76 Ca -0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.85 2bs2 h PRO 76 Cb 1.10 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.21 2bs2 h PRO 76 CO 0.86 0.00 0.00 0.97 -0.21 0.00 0.00 178.00 179.62 2bs2 h ILE 77 N 0.00 0.00 -0.61 4.15 2.10 -1.94 0.23 117.51 121.44 2bs2 h ILE 77 Ca 0.00 -0.02 -0.10 0.00 1.08 0.00 0.00 64.86 65.82 2bs2 h ILE 77 Cb 0.53 0.94 -0.02 0.00 -1.09 0.00 0.00 36.82 37.18 2bs2 h ILE 77 CO 0.00 0.00 -0.00 0.58 -1.08 0.00 0.00 178.15 177.65 2bs2 h VAL 78 N 0.00 1.27 0.00 2.19 2.07 -1.52 -2.15 116.25 118.11 2bs2 h VAL 78 Ca 0.00 -1.16 -0.07 0.00 0.82 0.00 0.00 66.70 66.29 2bs2 h VAL 78 Cb 0.02 0.79 -0.01 0.00 -1.52 0.00 0.00 31.29 30.57 2bs2 h VAL 78 CO 0.00 0.42 -0.31 0.58 0.02 0.00 0.00 177.57 178.28 2bs2 h VAL 79 N 0.99 1.10 -0.25 2.57 2.07 -1.16 -2.33 116.25 119.24 2bs2 h VAL 79 Ca 0.17 -1.11 -0.03 0.00 0.82 0.00 0.00 66.70 66.56 2bs2 h VAL 79 Cb 0.57 1.62 -0.01 0.00 -1.52 0.00 0.00 31.29 31.95 2bs2 h VAL 79 CO 0.03 0.30 0.04 0.28 0.02 0.00 0.00 177.57 178.25 2bs2 h SER 80 N 0.00 0.39 -0.63 0.57 0.02 -1.26 0.37 113.55 113.01 2bs2 h SER 80 Ca -0.00 -0.25 -0.07 0.00 -0.84 0.00 0.00 61.79 60.62 2bs2 h SER 80 Cb 0.59 -0.10 -0.03 0.00 0.14 0.00 0.00 62.40 63.00 2bs2 h SER 80 CO 0.04 0.54 0.12 -0.26 -1.14 0.00 0.00 176.83 176.13 2bs2 h PHE 81 N 0.22 1.12 -0.73 3.45 -1.00 -1.23 0.55 116.94 119.32 2bs2 h PHE 81 Ca 0.08 -0.14 -0.06 0.00 2.81 0.00 0.00 57.97 60.65 2bs2 h PHE 81 Cb 0.32 -0.31 -0.03 0.00 3.61 0.00 0.00 35.95 39.54 2bs2 h PHE 81 CO 0.02 0.93 0.21 1.25 -1.61 0.00 0.00 178.31 179.12 2bs2 h LEU 82 N 1.00 1.08 -0.39 1.54 7.12 -1.27 -0.66 115.31 123.73 2bs2 h LEU 82 Ca 0.20 -0.22 -0.08 0.00 0.13 0.00 0.00 57.88 57.92 2bs2 h LEU 82 Cb 0.41 -0.28 -0.01 0.00 -0.53 0.00 0.00 40.66 40.24 2bs2 h LEU 82 CO 0.01 1.01 -0.06 0.00 -0.13 0.00 0.00 178.44 179.28 2bs2 h ALA 83 N 1.11 0.53 -0.77 1.25 0.00 -0.49 -1.69 119.26 119.20 2bs2 h ALA 83 Ca 0.24 -0.29 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 2bs2 h ALA 83 Cb 0.33 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.94 2bs2 h ALA 83 CO -0.00 0.36 0.36 0.00 0.00 0.00 0.00 179.25 179.96 2bs2 h ALA 84 N 0.85 1.18 0.04 0.00 0.00 -0.65 0.70 119.26 121.38 2bs2 h ALA 84 Ca 0.10 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 2bs2 h ALA 84 Cb 0.56 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.04 2bs2 h ALA 84 CO 0.03 0.62 -0.02 0.35 0.00 0.00 0.00 179.25 180.23 2bs2 h PHE 85 N 1.10 -0.05 -0.52 0.00 3.57 -0.91 -1.11 116.94 119.03 2bs2 h PHE 85 Ca 0.26 -0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.73 2bs2 h PHE 85 Cb 0.13 0.02 -0.02 0.00 2.79 0.00 0.00 35.95 38.86 2bs2 h PHE 85 CO 0.01 0.18 0.17 0.28 -2.23 0.00 0.00 178.31 176.72 2bs2 h VAL 86 N -0.26 1.20 -0.60 1.41 2.07 -1.12 -1.92 116.25 117.04 2bs2 h VAL 86 Ca -0.01 -0.69 -0.00 0.00 0.82 0.00 0.00 66.70 66.82 2bs2 h VAL 86 Cb 0.24 0.63 -0.03 0.00 -1.52 0.00 0.00 31.29 30.61 2bs2 h VAL 86 CO 0.01 0.26 0.36 0.15 0.02 0.00 0.00 177.57 178.37 2bs2 h PHE 87 N 0.75 0.79 -0.59 1.57 3.04 -0.64 0.19 116.94 122.05 2bs2 h PHE 87 Ca 0.18 -0.00 -0.02 0.00 3.98 0.00 0.00 57.97 62.10 2bs2 h PHE 87 Cb 0.21 -0.26 -0.03 0.00 2.56 0.00 0.00 35.95 38.43 2bs2 h PHE 87 CO 0.01 0.54 0.29 0.00 -2.02 0.00 0.00 178.31 177.14 2bs2 h ALA 88 N 1.18 0.76 -0.48 2.41 0.00 -0.56 0.00 119.26 122.57 2bs2 h ALA 88 Ca 0.21 -0.12 -0.11 0.00 0.00 0.00 0.00 54.91 54.89 2bs2 h ALA 88 Cb -0.01 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 2bs2 h ALA 88 CO -0.04 0.31 -0.15 0.28 0.00 0.00 0.00 179.25 179.65 2bs2 h VAL 89 N 0.80 1.27 -0.21 0.00 2.07 -0.99 -0.53 116.25 118.66 2bs2 h VAL 89 Ca 0.20 -1.28 0.03 0.00 0.82 0.00 0.00 66.70 66.47 2bs2 h VAL 89 Cb 0.10 1.05 -0.03 0.00 -1.52 0.00 0.00 31.29 30.89 2bs2 h VAL 89 CO -0.03 0.44 0.01 0.15 0.02 0.00 0.00 177.57 178.17 2bs2 h PHE 90 N 0.81 0.02 -0.31 1.57 3.57 -0.15 0.13 116.94 122.58 2bs2 h PHE 90 Ca 0.12 0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.60 2bs2 h PHE 90 Cb 0.69 0.02 -0.01 0.00 2.79 0.00 0.00 35.95 39.44 2bs2 h PHE 90 CO 0.04 -0.01 0.04 0.82 -2.23 0.00 0.00 178.31 176.96 2bs2 h ILE 91 N 0.09 1.24 -0.46 1.41 2.04 -0.79 -1.69 117.51 119.35 2bs2 h ILE 91 Ca 0.10 -0.85 -0.00 0.00 1.00 0.00 0.00 64.86 65.10 2bs2 h ILE 91 Cb 0.11 1.19 -0.02 0.00 -0.74 0.00 0.00 36.82 37.36 2bs2 h ILE 91 CO -0.15 0.28 0.28 0.00 0.00 0.00 0.00 178.15 178.55 2bs2 h ALA 92 N 0.87 0.58 -0.16 1.87 0.00 -0.83 -1.01 119.26 120.58 2bs2 h ALA 92 Ca 0.09 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.95 2bs2 h ALA 92 Cb 0.37 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 2bs2 h ALA 92 CO 0.01 0.07 0.09 1.25 0.00 0.00 0.00 179.25 180.66 2bs2 h HIS 93 N 0.61 0.16 -0.84 0.00 -0.00 -0.64 -1.39 115.15 113.05 2bs2 h HIS 93 Ca 0.16 0.01 0.02 0.00 -0.00 0.00 0.00 60.37 60.56 2bs2 h HIS 93 Cb -0.01 -0.05 -0.05 0.00 -0.00 0.00 0.00 27.41 27.30 2bs2 h HIS 93 CO -0.03 0.10 0.54 0.00 -0.00 0.00 0.00 177.93 178.54 2bs2 h ALA 94 N 1.07 1.09 -0.20 5.26 0.00 -1.10 0.16 119.26 125.54 2bs2 h ALA 94 Ca 0.06 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 54.95 2bs2 h ALA 94 Cb 0.00 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.46 2bs2 h ALA 94 CO -0.03 0.41 0.04 0.35 0.00 0.00 0.00 179.25 180.01 2bs2 h PHE 95 N 1.08 0.07 -0.11 0.00 3.57 -0.81 -0.29 116.94 120.45 2bs2 h PHE 95 Ca 0.32 0.01 -0.10 0.00 3.53 0.00 0.00 57.97 61.73 2bs2 h PHE 95 Cb -0.04 -0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.70 2bs2 h PHE 95 CO -0.02 0.03 -0.34 -0.07 -2.23 0.00 0.00 178.31 175.68 2bs2 h LEU 96 N 0.12 0.49 -1.10 0.59 3.38 -0.78 -3.30 115.31 114.71 2bs2 h LEU 96 Ca 0.09 -0.61 -0.08 0.00 0.09 0.00 0.00 57.88 57.37 2bs2 h LEU 96 Cb 0.08 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 2bs2 h LEU 96 CO -0.11 1.01 -0.39 0.00 0.09 0.00 0.00 178.44 179.03 2bs2 h ALA 97 N 0.49 1.13 -0.19 1.53 0.00 -0.68 -2.89 119.26 118.66 2bs2 h ALA 97 Ca -0.01 -0.36 0.05 0.00 0.00 0.00 0.00 54.91 54.60 2bs2 h ALA 97 Cb 0.96 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 2bs2 h ALA 97 CO 0.07 0.49 0.22 1.98 0.00 0.00 0.00 179.25 182.01 2bs2 h MET 98 N 0.00 0.00 0.00 0.00 1.85 -1.12 -0.24 114.93 115.42 2bs2 h MET 98 Ca -0.00 0.00 -0.00 0.00 -0.61 0.00 0.00 59.70 59.09 2bs2 h MET 98 Cb 0.81 0.00 -0.00 0.00 0.43 0.00 0.00 31.60 32.84 2bs2 h MET 98 CO 0.05 0.00 -0.00 0.00 -0.40 0.00 0.00 176.91 176.56 2bs2 h ARG 99 N 0.00 0.00 0.00 0.39 3.08 -1.66 -2.71 114.38 113.48 2bs2 h ARG 99 Ca 0.09 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.14 2bs2 h ARG 99 Cb 0.52 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.57 2bs2 h ARG 99 CO -0.00 0.00 -0.45 1.63 -1.07 0.00 0.00 179.97 180.08 2bs2 n LYS 100 N -3.64 0.04 -1.73 0.04 4.01 -0.10 -4.95 118.16 111.83 2bs2 n LYS 100 Ca -0.03 0.01 -0.35 0.00 -0.51 0.00 0.00 58.31 57.43 2bs2 n LYS 100 Cb 0.08 -1.53 0.06 0.00 -0.51 0.00 0.00 35.03 33.14 2bs2 n LYS 100 CO 0.00 0.00 0.00 -0.06 -1.11 0.00 0.00 177.40 176.23 2bs2 s PHE 101 N -3.02 2.24 0.31 2.13 0.08 -1.02 -4.94 117.98 113.76 2bs2 s PHE 101 Ca 0.11 1.55 -0.29 0.00 0.12 0.00 0.00 56.93 58.42 2bs2 s PHE 101 Cb 0.17 -3.47 -0.10 0.00 -0.57 0.00 0.00 43.02 39.05 2bs2 s PHE 101 CO 0.68 -2.39 1.29 -2.14 -0.10 0.00 0.00 175.22 172.56 2bs2 s PRO 102 N -3.64 4.39 0.00 0.24 0.02 -1.26 -4.91 135.00 129.83 2bs2 s PRO 102 Ca 0.76 2.16 0.06 0.00 0.02 0.00 0.00 61.00 64.00 2bs2 s PRO 102 Cb -0.30 -3.09 0.05 0.00 0.02 0.00 0.00 34.50 31.18 2bs2 s PRO 102 CO 0.39 -0.15 0.69 1.51 -0.33 0.00 0.00 177.00 179.11 2bs2 n ILE 103 N 1.04 0.00 -4.09 2.83 0.13 -1.26 -4.87 119.36 113.15 2bs2 n ILE 103 Ca 0.01 -0.50 -0.10 0.00 -1.10 0.00 0.00 62.75 61.05 2bs2 n ILE 103 Cb 0.42 1.13 -0.07 0.00 -0.84 0.00 0.00 39.64 40.27 2bs2 n ILE 103 CO 0.00 0.00 0.00 0.54 2.80 0.00 0.00 176.55 179.89 2bs2 s ASN 104 N -0.52 0.02 0.16 9.51 2.20 -1.26 -5.04 114.94 120.00 2bs2 s ASN 104 Ca 0.07 -1.13 -0.20 0.00 -0.94 0.00 0.00 52.86 50.66 2bs2 s ASN 104 Cb 0.05 0.49 0.07 0.00 -2.00 0.00 0.00 41.25 39.86 2bs2 s ASN 104 CO 0.08 -1.01 1.64 0.22 -2.94 0.00 0.00 177.10 175.09 2bs2 h TYR 105 N 2.42 -0.49 -0.23 1.54 3.20 -1.99 -0.39 116.97 121.04 2bs2 h TYR 105 Ca -0.30 0.04 0.05 0.00 3.14 0.00 0.00 58.73 61.66 2bs2 h TYR 105 Cb 1.25 0.27 -0.05 0.00 1.54 0.00 0.00 36.73 39.73 2bs2 h TYR 105 CO 0.38 -0.27 -0.12 0.00 -1.64 0.00 0.00 178.16 176.50 2bs2 h ARG 106 N -0.15 -0.10 -0.59 1.82 2.47 -1.99 0.21 114.38 116.06 2bs2 h ARG 106 Ca 0.17 0.01 -0.00 0.00 -1.26 0.00 0.00 59.98 58.90 2bs2 h ARG 106 Cb 0.41 0.02 -0.03 0.00 -1.65 0.00 0.00 29.97 28.72 2bs2 h ARG 106 CO -0.43 -0.07 0.36 1.96 0.56 0.00 0.00 179.97 182.36 2bs2 h GLN 107 N -0.10 0.79 -0.15 0.04 4.20 -1.85 -0.80 115.11 117.24 2bs2 h GLN 107 Ca 0.12 -0.07 -0.01 0.00 0.06 0.00 0.00 58.65 58.75 2bs2 h GLN 107 Cb 0.29 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 27.90 2bs2 h GLN 107 CO -0.29 0.57 0.04 -0.92 -0.67 0.00 0.00 178.83 177.56 2bs2 h TYR 108 N 0.79 0.25 0.17 2.96 5.03 -0.65 -1.08 116.97 124.44 2bs2 h TYR 108 Ca 0.21 -0.03 -0.01 0.00 2.58 0.00 0.00 58.73 61.49 2bs2 h TYR 108 Cb -0.02 -0.07 0.00 0.00 1.55 0.00 0.00 36.73 38.19 2bs2 h TYR 108 CO -0.02 0.37 -0.08 1.25 -1.32 0.00 0.00 178.16 178.35 2bs2 h LEU 109 N 0.06 -0.20 -1.04 2.82 5.85 -0.45 -1.36 115.31 121.00 2bs2 h LEU 109 Ca 0.05 -0.07 -0.08 0.00 0.84 0.00 0.00 57.88 58.62 2bs2 h LEU 109 Cb 0.24 0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.30 2bs2 h LEU 109 CO -0.00 -0.06 -0.14 0.71 -0.34 0.00 0.00 178.44 178.61 2bs2 h THR 110 N -0.32 1.24 -0.07 1.05 1.35 -1.17 -1.34 112.91 113.66 2bs2 h THR 110 Ca -0.02 -1.07 -0.17 0.00 -0.55 0.00 0.00 66.41 64.60 2bs2 h THR 110 Cb 0.25 1.16 0.01 0.00 -1.73 0.00 0.00 68.15 67.85 2bs2 h THR 110 CO 0.04 0.35 -0.61 0.15 -0.25 0.00 0.00 175.52 175.20 2bs2 h PHE 111 N 0.48 0.74 -0.64 4.73 3.04 -1.16 -1.44 116.94 122.70 2bs2 h PHE 111 Ca 0.09 -0.36 -0.01 0.00 3.98 0.00 0.00 57.97 61.67 2bs2 h PHE 111 Cb 0.53 -0.10 -0.03 0.00 2.56 0.00 0.00 35.95 38.91 2bs2 h PHE 111 CO 0.02 1.16 0.36 -0.22 -2.02 0.00 0.00 178.31 177.60 2bs2 h LYS 112 N 0.12 0.89 -0.38 1.11 3.64 -1.19 0.15 116.57 120.91 2bs2 h LYS 112 Ca -0.06 -0.10 -0.02 0.00 -1.27 0.00 0.00 60.65 59.20 2bs2 h LYS 112 Cb 1.27 -0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 32.90 2bs2 h LYS 112 CO 0.12 0.67 0.16 1.15 -2.27 0.00 0.00 179.45 179.29 2bs2 h THR 113 N 0.87 1.19 -0.43 1.00 2.02 -1.27 -1.97 112.91 114.32 2bs2 h THR 113 Ca 0.23 -0.56 0.01 0.00 0.77 0.00 0.00 66.41 66.86 2bs2 h THR 113 Cb 0.03 0.85 -0.03 0.00 -1.74 0.00 0.00 68.15 67.27 2bs2 h THR 113 CO -0.04 0.20 0.26 -0.74 0.37 0.00 0.00 175.52 175.58 2bs2 h HIS 114 N 0.47 0.50 -0.63 3.16 -0.00 -0.76 -1.07 115.15 116.81 2bs2 h HIS 114 Ca 0.13 0.01 0.05 0.00 -0.00 0.00 0.00 60.37 60.56 2bs2 h HIS 114 Cb 0.17 -0.16 -0.05 0.00 -0.00 0.00 0.00 27.41 27.37 2bs2 h HIS 114 CO -0.00 0.30 0.36 -0.22 -0.00 0.00 0.00 177.93 178.36 2bs2 h LYS 115 N 0.53 0.67 -0.04 5.26 3.64 -0.50 0.13 116.57 126.26 2bs2 h LYS 115 Ca 0.17 -0.04 -0.12 0.00 -1.27 0.00 0.00 60.65 59.39 2bs2 h LYS 115 Cb -0.02 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 31.64 2bs2 h LYS 115 CO -0.06 0.44 -0.52 -0.44 -2.27 0.00 0.00 179.45 176.60 2bs2 h ASP 116 N 0.69 0.13 0.03 4.20 3.32 -0.95 -2.31 116.42 121.52 2bs2 h ASP 116 Ca 0.27 -0.06 -0.16 0.00 0.02 0.00 0.00 57.03 57.10 2bs2 h ASP 116 Cb 0.12 -0.04 0.01 0.00 0.22 0.00 0.00 39.33 39.65 2bs2 h ASP 116 CO -0.15 0.62 -0.66 -0.07 -1.72 0.00 0.00 179.24 177.26 2bs2 h LEU 117 N 0.09 0.53 -0.42 1.55 3.38 -0.80 -3.36 115.31 116.28 2bs2 h LEU 117 Ca 0.00 -0.80 -0.06 0.00 0.09 0.00 0.00 57.88 57.11 2bs2 h LEU 117 Cb 0.95 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.52 2bs2 h LEU 117 CO 0.07 1.26 0.02 0.24 0.09 0.00 0.00 178.44 180.13 2bs2 h MET 118 N -0.14 0.72 -6.21 1.13 2.86 -0.97 -3.47 114.93 108.86 2bs2 h MET 118 Ca -0.09 -0.22 -0.45 0.00 -2.06 0.00 0.00 59.70 56.88 2bs2 h MET 118 Cb 1.39 -0.07 0.00 0.00 0.06 0.00 0.00 31.60 32.98 2bs2 h MET 118 CO 0.13 0.79 -0.78 0.54 1.06 0.00 0.00 176.91 178.65 2bs2 n ARG 119 N -4.45 -5.49 -3.53 1.72 1.74 -0.87 -4.93 116.66 100.85 2bs2 n ARG 119 Ca -0.00 0.62 -0.38 0.00 -0.77 0.00 0.00 57.85 57.31 2bs2 n ARG 119 Cb 0.27 -5.41 -0.10 0.00 -1.02 0.00 0.00 32.46 26.20 2bs2 n ARG 119 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 2bs2 s HIS 120 N -3.42 3.23 0.10 -1.55 2.46 -1.26 -5.02 115.29 109.83 2bs2 s HIS 120 Ca 0.45 0.21 -0.28 0.00 0.47 0.00 0.00 55.06 55.90 2bs2 s HIS 120 Cb -0.22 -2.44 -0.10 0.00 -0.13 0.00 0.00 32.58 29.69 2bs2 s HIS 120 CO 0.82 -0.18 1.46 0.78 -2.47 0.00 0.00 174.74 175.15 2bs2 h GLY 121 N 8.44 -1.17 2.00 1.59 0.00 -1.98 -0.78 103.07 111.17 2bs2 h GLY 121 Ca -0.34 0.72 -0.01 0.00 0.00 0.00 0.00 47.33 47.69 2bs2 h GLY 121 CO 0.58 -0.23 -0.07 -0.55 0.00 0.00 0.00 176.54 176.27 2bs2 h ASP 122 N -0.40 0.00 0.02 0.19 3.32 -1.99 -0.10 116.42 117.46 2bs2 h ASP 122 Ca 0.05 0.00 -0.17 0.00 0.02 0.00 0.00 57.03 56.93 2bs2 h ASP 122 Cb 0.53 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.09 2bs2 h ASP 122 CO -0.45 0.07 -0.67 0.74 -1.72 0.00 0.00 179.24 177.21 2bs2 h THR 123 N 0.00 1.42 -0.73 0.35 2.02 -1.85 -3.02 112.91 111.10 2bs2 h THR 123 Ca -0.00 -2.15 -0.05 0.00 0.77 0.00 0.00 66.41 64.99 2bs2 h THR 123 Cb 0.19 2.65 -0.03 0.00 -1.74 0.00 0.00 68.15 69.22 2bs2 h THR 123 CO 0.01 0.63 0.27 0.74 0.37 0.00 0.00 175.52 177.54 2bs2 h THR 124 N -0.09 1.25 0.00 3.16 2.02 -0.56 -2.25 112.91 116.44 2bs2 h THR 124 Ca -0.09 -0.81 -0.03 0.00 0.77 0.00 0.00 66.41 66.25 2bs2 h THR 124 Cb 1.39 0.39 -0.00 0.00 -1.74 0.00 0.00 68.15 68.19 2bs2 h THR 124 CO 0.13 0.33 -0.14 -0.07 0.37 0.00 0.00 175.52 176.14 2bs2 h LEU 125 N 1.07 0.00 -0.31 2.58 3.38 -1.08 -1.92 115.31 119.04 2bs2 h LEU 125 Ca 0.24 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 58.06 2bs2 h LEU 125 Cb 0.23 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.98 2bs2 h LEU 125 CO -0.02 0.14 -0.41 -0.25 0.09 0.00 0.00 178.44 177.99 2bs2 h TRP 126 N 0.00 1.00 -0.94 1.13 7.01 -1.27 -0.87 115.95 122.02 2bs2 h TRP 126 Ca -0.00 -0.33 0.06 0.00 2.11 0.00 0.00 58.89 60.74 2bs2 h TRP 126 Cb 0.27 -0.20 -0.06 0.00 -2.10 0.00 0.00 29.16 27.06 2bs2 h TRP 126 CO 0.00 1.13 0.60 2.35 -2.79 0.00 0.00 178.44 179.73 2bs2 h TRP 127 N 0.59 1.11 -0.54 2.65 2.91 -1.19 0.58 115.95 122.06 2bs2 h TRP 127 Ca 0.04 0.03 -0.04 0.00 1.13 0.00 0.00 58.89 60.05 2bs2 h TRP 127 Cb 1.00 -0.36 -0.02 0.00 -0.51 0.00 0.00 29.16 29.27 2bs2 h TRP 127 CO 0.07 0.57 0.20 0.82 -1.03 0.00 0.00 178.44 179.07 2bs2 h ILE 128 N 1.09 1.22 -0.30 2.65 2.04 -1.12 0.63 117.51 123.73 2bs2 h ILE 128 Ca 0.41 -0.72 0.06 0.00 1.00 0.00 0.00 64.86 65.61 2bs2 h ILE 128 Cb 0.17 0.68 -0.05 0.00 -0.74 0.00 0.00 36.82 36.88 2bs2 h ILE 128 CO -0.17 0.27 -0.05 1.56 0.00 0.00 0.00 178.15 179.76 2bs2 h GLN 129 N 0.74 0.03 -0.19 2.37 4.20 0.38 0.99 115.11 123.63 2bs2 h GLN 129 Ca 0.18 -0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.88 2bs2 h GLN 129 Cb 0.23 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.99 2bs2 h GLN 129 CO -0.01 0.02 0.08 0.00 -0.67 0.00 0.00 178.83 178.25 2bs2 h ALA 130 N 1.29 0.25 0.20 3.87 0.00 -0.61 -0.37 119.26 123.88 2bs2 h ALA 130 Ca 0.15 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 2bs2 h ALA 130 Cb 0.21 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 2bs2 h ALA 130 CO -0.28 -0.17 -0.11 0.52 0.00 0.00 0.00 179.25 179.21 2bs2 h MET 131 N 0.16 -0.28 -0.36 0.00 2.86 -0.54 -0.93 114.93 115.84 2bs2 h MET 131 Ca 0.06 0.02 -0.03 0.00 -2.06 0.00 0.00 59.70 57.70 2bs2 h MET 131 Cb 0.16 0.06 -0.02 0.00 0.06 0.00 0.00 31.60 31.87 2bs2 h MET 131 CO -0.01 -0.18 0.11 1.79 1.06 0.00 0.00 176.91 179.68 2bs2 h THR 132 N -0.29 1.16 -0.21 2.22 1.35 -0.80 -1.65 112.91 114.70 2bs2 h THR 132 Ca -0.02 -0.53 -0.02 0.00 -0.55 0.00 0.00 66.41 65.28 2bs2 h THR 132 Cb 0.23 0.77 -0.01 0.00 -1.73 0.00 0.00 68.15 67.41 2bs2 h THR 132 CO 0.03 0.20 0.03 1.23 -0.25 0.00 0.00 175.52 176.76 2bs2 h GLY 133 N 0.72 0.37 1.01 5.82 0.00 -0.70 -1.83 103.07 108.45 2bs2 h GLY 133 Ca 0.12 -0.24 0.01 0.00 0.00 0.00 0.00 47.33 47.22 2bs2 h GLY 133 CO -0.01 0.23 0.47 -2.75 0.00 0.00 0.00 176.54 174.48 2bs2 h PHE 134 N 0.14 0.89 -0.67 5.60 3.57 -0.75 -2.44 116.94 123.28 2bs2 h PHE 134 Ca 0.06 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.56 2bs2 h PHE 134 Cb 0.32 -0.30 -0.03 0.00 2.79 0.00 0.00 35.95 38.72 2bs2 h PHE 134 CO 0.02 0.56 0.33 0.00 -2.23 0.00 0.00 178.31 177.00 2bs2 h ALA 135 N 1.26 1.32 0.00 2.41 0.00 -1.18 -2.46 119.26 120.61 2bs2 h ALA 135 Ca 0.26 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2bs2 h ALA 135 Cb -0.11 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.41 2bs2 h ALA 135 CO -0.06 0.53 0.00 -1.33 0.00 0.00 0.00 179.25 178.40 2bs2 n MET 136 N -4.35 0.02 -0.23 0.00 2.81 -0.70 -1.93 117.12 112.74 2bs2 n MET 136 Ca 0.06 0.27 -0.06 0.00 -1.81 0.00 0.00 57.70 56.17 2bs2 n MET 136 Cb 0.12 -1.54 0.04 0.00 -0.71 0.00 0.00 33.22 31.14 2bs2 n MET 136 CO 0.00 0.00 0.00 0.74 1.51 0.00 0.00 175.97 178.22 2bs2 h PHE 137 N 0.00 0.85 0.14 2.03 0.04 -1.39 -0.54 116.94 118.08 2bs2 h PHE 137 Ca 0.00 0.00 -0.35 0.00 2.80 0.00 0.00 57.97 60.42 2bs2 h PHE 137 Cb 0.26 -0.28 -0.01 0.00 2.20 0.00 0.00 35.95 38.12 2bs2 h PHE 137 CO 0.00 0.57 -1.84 0.74 -0.60 0.00 0.00 178.31 177.18 2bs2 h PHE 138 N 0.88 0.56 -0.03 -0.55 -1.00 -1.60 -3.33 116.94 111.87 2bs2 h PHE 138 Ca 0.23 -0.41 -0.15 0.00 2.81 0.00 0.00 57.97 60.46 2bs2 h PHE 138 Cb -0.04 -0.02 0.01 0.00 3.61 0.00 0.00 35.95 39.51 2bs2 h PHE 138 CO -0.02 1.72 -0.57 -0.07 -1.61 0.00 0.00 178.31 177.77 2bs2 h LEU 139 N 0.02 0.56 -0.48 1.54 3.38 -1.41 -3.33 115.31 115.60 2bs2 h LEU 139 Ca -0.38 -0.72 -0.13 0.00 0.09 0.00 0.00 57.88 56.73 2bs2 h LEU 139 Cb 2.02 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 42.59 2bs2 h LEU 139 CO 0.11 1.20 -0.21 1.23 0.09 0.00 0.00 178.44 180.87 2bs2 h GLY 140 N -0.04 1.07 0.74 0.83 0.00 -1.32 -3.25 103.07 101.10 2bs2 h GLY 140 Ca -0.06 -0.94 0.06 0.00 0.00 0.00 0.00 47.33 46.38 2bs2 h GLY 140 CO 0.11 0.86 0.54 1.76 0.00 0.00 0.00 176.54 179.81 2bs2 h SER 141 N 0.84 0.85 -0.09 0.19 0.02 -1.67 -1.30 113.55 112.39 2bs2 h SER 141 Ca 0.11 0.01 0.01 0.00 -0.84 0.00 0.00 61.79 61.09 2bs2 h SER 141 Cb 0.78 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 63.15 2bs2 h SER 141 CO 0.07 0.55 0.01 0.58 -1.14 0.00 0.00 176.83 176.89 2bs2 h VAL 142 N 0.99 0.95 -0.22 2.27 2.07 -1.66 -1.81 116.25 118.84 2bs2 h VAL 142 Ca 0.37 -0.01 -0.04 0.00 0.82 0.00 0.00 66.70 67.84 2bs2 h VAL 142 Cb 0.16 0.91 -0.01 0.00 -1.52 0.00 0.00 31.29 30.82 2bs2 h VAL 142 CO -0.17 0.01 -0.01 -0.74 0.02 0.00 0.00 177.57 176.68 2bs2 h HIS 143 N 0.04 0.44 -0.69 1.57 6.17 -1.57 -2.89 115.15 118.22 2bs2 h HIS 143 Ca 0.04 -0.08 0.02 0.00 0.71 0.00 0.00 60.37 61.06 2bs2 h HIS 143 Cb 0.04 -0.11 -0.04 0.00 2.52 0.00 0.00 27.41 29.81 2bs2 h HIS 143 CO -0.11 0.59 0.44 -0.07 0.71 0.00 0.00 177.93 179.49 2bs2 h LEU 144 N 0.16 0.74 -0.59 0.26 3.38 -1.17 -1.38 115.31 116.71 2bs2 h LEU 144 Ca 0.06 -0.01 -0.06 0.00 0.09 0.00 0.00 57.88 57.97 2bs2 h LEU 144 Cb 0.42 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 2bs2 h LEU 144 CO 0.01 0.52 0.14 0.22 0.09 0.00 0.00 178.44 179.42 2bs2 h TYR 145 N 0.87 0.99 -0.27 1.13 3.20 -1.34 -2.00 116.97 119.56 2bs2 h TYR 145 Ca 0.27 -0.12 -0.02 0.00 3.14 0.00 0.00 58.73 62.01 2bs2 h TYR 145 Cb -0.02 -0.28 -0.01 0.00 1.54 0.00 0.00 36.73 37.96 2bs2 h TYR 145 CO -0.04 0.84 0.10 0.82 -1.64 0.00 0.00 178.16 178.24 2bs2 h ILE 146 N 0.85 1.18 -0.44 1.81 2.04 -1.26 -0.79 117.51 120.90 2bs2 h ILE 146 Ca 0.19 -0.56 -0.03 0.00 1.00 0.00 0.00 64.86 65.46 2bs2 h ILE 146 Cb 0.35 1.05 -0.02 0.00 -0.74 0.00 0.00 36.82 37.46 2bs2 h ILE 146 CO 0.00 0.19 0.15 0.24 0.00 0.00 0.00 178.15 178.73 2bs2 h MET 147 N 0.28 0.64 0.00 2.37 2.86 -1.19 0.29 114.93 120.19 2bs2 h MET 147 Ca 0.09 -0.09 -0.16 0.00 -2.06 0.00 0.00 59.70 57.48 2bs2 h MET 147 Cb 0.20 -0.11 -0.02 0.00 0.06 0.00 0.00 31.60 31.72 2bs2 h MET 147 CO -0.01 0.55 -0.74 1.98 1.06 0.00 0.00 176.91 179.75 2bs2 h MET 148 N 0.63 0.00 0.00 1.72 1.85 -1.11 -3.22 114.93 114.81 2bs2 h MET 148 Ca 0.15 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 59.24 2bs2 h MET 148 Cb 0.17 0.00 0.00 0.00 0.43 0.00 0.00 31.60 32.20 2bs2 h MET 148 CO -0.01 0.74 -1.35 0.25 -0.40 0.00 0.00 176.91 176.14 2bs2 n THR 149 N -3.60 0.00 -2.56 -0.77 -2.24 -0.32 -4.56 114.28 100.22 2bs2 n THR 149 Ca -0.01 -0.26 -0.15 0.00 -2.27 0.00 0.00 64.05 61.36 2bs2 n THR 149 Cb 0.73 0.51 0.02 0.00 -2.10 0.00 0.00 70.33 69.50 2bs2 n THR 149 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2bs2 n GLN 150 N -1.79 2.22 0.29 -0.78 6.02 1.00 -4.91 117.38 119.43 2bs2 n GLN 150 Ca -0.00 -3.79 0.14 0.00 -0.01 0.00 0.00 57.00 53.34 2bs2 n GLN 150 Cb 0.37 -1.72 0.87 0.00 1.02 0.00 0.00 30.24 30.77 2bs2 n GLN 150 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.06 175.05 2bs2 h PRO 151 N 2.73 0.00 0.00 -1.09 0.13 -1.74 -1.61 132.00 130.43 2bs2 h PRO 151 Ca 0.07 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.20 2bs2 h PRO 151 Cb 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 2bs2 h PRO 151 CO 0.60 0.03 0.00 0.00 -0.23 0.00 0.00 178.00 178.40 2bs2 n GLN 152 N -3.83 0.75 -0.67 0.86 0.00 -1.26 -2.84 117.38 110.40 2bs2 n GLN 152 Ca -0.03 0.00 0.04 0.00 0.00 0.00 0.00 57.00 57.02 2bs2 n GLN 152 Cb 0.12 -1.50 0.29 0.00 0.00 0.00 0.00 30.24 29.15 2bs2 n GLN 152 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.06 177.31 2bs2 n THR 153 N -1.02 2.53 -3.68 -0.39 -2.24 -0.61 -4.18 114.28 104.70 2bs2 n THR 153 Ca 0.18 -1.84 -0.36 0.00 -2.27 0.00 0.00 64.05 59.76 2bs2 n THR 153 Cb 0.09 -0.29 -0.09 0.00 -2.10 0.00 0.00 70.33 67.94 2bs2 n THR 153 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 2bs2 s ILE 154 N -2.90 5.34 0.00 2.28 1.01 -1.13 -3.52 121.20 122.29 2bs2 s ILE 154 Ca 0.47 0.17 0.00 0.00 0.00 0.00 0.00 60.65 61.30 2bs2 s ILE 154 Cb 0.38 -3.48 0.00 0.00 0.01 0.00 0.00 42.46 39.37 2bs2 s ILE 154 CO 0.10 0.36 0.00 0.61 0.00 0.00 0.00 174.94 176.01 2bs2 n GLY 155 N 4.18 0.28 0.32 6.18 0.00 -1.26 -4.85 105.19 110.04 2bs2 n GLY 155 Ca -0.15 -1.06 0.07 0.00 0.00 0.00 0.00 46.02 44.88 2bs2 n GLY 155 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2bs2 h PRO 156 N 0.00 0.43 0.00 1.61 0.13 -1.93 -0.40 132.00 131.83 2bs2 h PRO 156 Ca 0.00 -0.03 -0.17 0.00 -0.87 0.00 0.00 66.00 64.94 2bs2 h PRO 156 Cb 0.00 -0.10 -0.02 0.00 0.13 0.00 0.00 31.00 31.01 2bs2 h PRO 156 CO 0.00 0.28 -1.21 0.28 -0.23 0.00 0.00 178.00 177.12 2bs2 n VAL 157 N -4.48 1.49 -0.23 1.56 0.31 -1.26 -3.99 118.33 111.73 2bs2 n VAL 157 Ca 0.04 0.01 -0.05 0.00 -0.01 0.00 0.00 64.34 64.34 2bs2 n VAL 157 Cb 0.16 -2.17 0.06 0.00 -0.91 0.00 0.00 33.84 30.98 2bs2 n VAL 157 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 2bs2 h SER 158 N -1.00 0.72 -0.23 4.52 0.02 -1.64 -1.74 113.55 114.20 2bs2 h SER 158 Ca -0.25 -0.01 -0.08 0.00 -0.84 0.00 0.00 61.79 60.61 2bs2 h SER 158 Cb 1.06 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 63.42 2bs2 h SER 158 CO -0.15 0.51 -0.11 0.28 -1.14 0.00 0.00 176.83 176.22 2bs2 h SER 159 N 0.85 0.60 0.36 3.07 0.02 -1.10 -2.00 113.55 115.35 2bs2 h SER 159 Ca 0.25 -0.16 -0.08 0.00 -0.84 0.00 0.00 61.79 60.96 2bs2 h SER 159 Cb -0.04 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.33 2bs2 h SER 159 CO -0.08 0.74 -0.38 0.28 -1.14 0.00 0.00 176.83 176.25 2bs2 h SER 160 N 0.57 0.04 0.62 3.07 0.02 -1.59 -1.75 113.55 114.53 2bs2 h SER 160 Ca 0.10 -0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 61.01 2bs2 h SER 160 Cb 0.52 -0.01 0.01 0.00 0.14 0.00 0.00 62.40 63.06 2bs2 h SER 160 CO 0.03 0.42 -0.30 0.15 -1.14 0.00 0.00 176.83 176.00 2bs2 h PHE 161 N 0.03 -0.77 -0.91 3.45 3.57 -0.59 -2.40 116.94 119.32 2bs2 h PHE 161 Ca 0.00 -0.02 0.10 0.00 3.53 0.00 0.00 57.97 61.58 2bs2 h PHE 161 Cb 0.70 0.25 -0.07 0.00 2.79 0.00 0.00 35.95 39.62 2bs2 h PHE 161 CO 0.00 -0.43 0.55 -0.09 -2.23 0.00 0.00 178.31 176.12 2bs2 h ARG 162 N -1.04 0.90 -0.87 1.11 2.43 -1.40 0.45 114.38 115.96 2bs2 h ARG 162 Ca -0.08 -0.05 0.08 0.00 -0.81 0.00 0.00 59.98 59.11 2bs2 h ARG 162 Cb 0.69 -0.20 -0.07 0.00 -0.42 0.00 0.00 29.97 29.97 2bs2 h ARG 162 CO 0.14 0.60 0.53 1.98 -1.51 0.00 0.00 179.97 181.71 2bs2 h MET 163 N 0.93 0.91 0.00 0.20 4.05 -1.23 -2.79 114.93 116.99 2bs2 h MET 163 Ca 0.43 -0.05 -0.07 0.00 -0.28 0.00 0.00 59.70 59.73 2bs2 h MET 163 Cb 0.36 -0.20 -0.01 0.00 -0.80 0.00 0.00 31.60 30.94 2bs2 h MET 163 CO -0.24 0.60 -0.96 0.28 0.23 0.00 0.00 176.91 176.82 2bs2 n VAL 164 N -4.65 1.34 -0.34 -5.77 0.31 -0.80 -1.55 118.33 106.86 2bs2 n VAL 164 Ca 0.13 0.12 -0.03 0.00 -0.01 0.00 0.00 64.34 64.56 2bs2 n VAL 164 Cb 0.22 -2.03 0.09 0.00 -0.91 0.00 0.00 33.84 31.21 2bs2 n VAL 164 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 2bs2 h SER 165 N -0.68 1.13 -0.43 4.52 0.02 -0.30 -2.21 113.55 115.60 2bs2 h SER 165 Ca -0.10 -0.08 0.00 0.00 -0.84 0.00 0.00 61.79 60.77 2bs2 h SER 165 Cb 0.83 -0.29 0.00 0.00 0.14 0.00 0.00 62.40 63.09 2bs2 h SER 165 CO -0.06 0.88 0.00 -0.62 -1.14 0.00 0.00 176.83 175.89 2bs2 n GLU 166 N -4.35 2.38 -3.86 3.45 1.02 -1.15 -4.96 120.64 113.18 2bs2 n GLU 166 Ca 0.10 -1.71 -0.30 0.00 -0.02 0.00 0.00 57.16 55.24 2bs2 n GLU 166 Cb 0.07 -1.51 0.01 0.00 -0.02 0.00 0.00 31.44 29.99 2bs2 n GLU 166 CO 0.00 0.00 0.00 0.91 1.18 0.00 0.00 177.13 179.22 2bs2 n TRP 167 N 0.72 -1.72 0.96 -0.32 7.02 -0.83 -4.90 117.44 118.36 2bs2 n TRP 167 Ca 0.16 0.57 0.10 0.00 -1.02 0.00 0.00 57.50 57.31 2bs2 n TRP 167 Cb 0.49 -3.54 -0.09 0.00 -2.42 0.00 0.00 31.31 25.75 2bs2 n TRP 167 CO 0.00 0.00 0.00 -1.33 -2.02 0.00 0.00 177.69 174.34 2bs2 n MET 168 N -4.38 0.02 -0.04 -0.99 2.81 -1.07 -4.45 117.12 109.03 2bs2 n MET 168 Ca -0.21 -0.01 -0.02 0.00 -1.81 0.00 0.00 57.70 55.66 2bs2 n MET 168 Cb 0.64 -1.50 0.25 0.00 -0.71 0.00 0.00 33.22 31.89 2bs2 n MET 168 CO 0.00 0.00 0.00 0.11 1.51 0.00 0.00 175.97 177.59 2bs2 h TRP 169 N 0.00 0.65 -0.67 2.03 5.08 -1.53 -1.25 115.95 120.25 2bs2 h TRP 169 Ca 0.00 -0.07 -0.05 0.00 1.08 0.00 0.00 58.89 59.84 2bs2 h TRP 169 Cb 0.52 -0.19 -0.03 0.00 -3.00 0.00 0.00 29.16 26.46 2bs2 h TRP 169 CO 0.00 0.62 0.21 -1.00 -1.28 0.00 0.00 178.44 176.99 2bs2 h PRO 170 N 0.59 1.03 -0.30 0.12 0.13 -1.87 0.10 132.00 131.81 2bs2 h PRO 170 Ca 0.12 -0.21 -0.07 0.00 -0.87 0.00 0.00 66.00 64.98 2bs2 h PRO 170 Cb 0.36 -0.16 -0.01 0.00 0.13 0.00 0.00 31.00 31.33 2bs2 h PRO 170 CO 0.01 0.88 -0.07 1.25 -0.23 0.00 0.00 178.00 179.85 2bs2 h LEU 171 N 0.99 0.59 -1.00 1.56 6.46 -1.77 -2.86 115.31 119.28 2bs2 h LEU 171 Ca 0.22 -0.36 -0.05 0.00 -0.12 0.00 0.00 57.88 57.57 2bs2 h LEU 171 Cb 0.28 -0.16 -0.03 0.00 -0.73 0.00 0.00 40.66 40.02 2bs2 h LEU 171 CO -0.01 0.81 0.20 1.88 -0.62 0.00 0.00 178.44 180.70 2bs2 h TYR 172 N 0.35 0.94 -0.05 1.25 0.05 -0.96 -0.35 116.97 118.22 2bs2 h TYR 172 Ca 0.08 -0.08 -0.00 0.00 0.05 0.00 0.00 58.73 58.78 2bs2 h TYR 172 Cb 0.55 -0.28 -0.00 0.00 1.01 0.00 0.00 36.73 38.01 2bs2 h TYR 172 CO 0.05 0.76 0.02 1.25 -1.05 0.00 0.00 178.16 179.19 2bs2 h LEU 173 N 0.90 0.06 -0.06 3.88 5.85 -0.90 0.64 115.31 125.68 2bs2 h LEU 173 Ca 0.20 -0.11 -0.01 0.00 0.84 0.00 0.00 57.88 58.80 2bs2 h LEU 173 Cb 0.25 -0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.26 2bs2 h LEU 173 CO -0.01 0.15 -0.01 0.58 -0.34 0.00 0.00 178.44 178.81 2bs2 h VAL 174 N -0.04 1.28 -0.49 1.05 2.07 -1.42 -3.07 116.25 115.62 2bs2 h VAL 174 Ca 0.02 -0.86 0.07 0.00 0.82 0.00 0.00 66.70 66.74 2bs2 h VAL 174 Cb 0.11 1.73 -0.03 0.00 -1.52 0.00 0.00 31.29 31.58 2bs2 h VAL 174 CO -0.00 0.23 0.33 0.25 0.02 0.00 0.00 177.57 178.40 2bs2 h LEU 175 N -0.21 0.35 0.11 2.57 5.85 -1.00 -0.94 115.31 122.02 2bs2 h LEU 175 Ca 0.02 0.00 0.01 0.00 0.84 0.00 0.00 57.88 58.74 2bs2 h LEU 175 Cb 0.38 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.32 2bs2 h LEU 175 CO 0.00 0.23 -0.12 0.25 -0.34 0.00 0.00 178.44 178.46 2bs2 h LEU 176 N 0.40 -0.31 -0.58 2.25 5.85 -0.77 0.10 115.31 122.24 2bs2 h LEU 176 Ca 0.22 0.03 -0.15 0.00 0.84 0.00 0.00 57.88 58.82 2bs2 h LEU 176 Cb 0.34 0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.48 2bs2 h LEU 176 CO -0.05 -0.18 -0.49 -0.26 -0.34 0.00 0.00 178.44 177.12 2bs2 h PHE 177 N -0.25 0.68 0.16 1.25 -1.00 -1.46 -2.13 116.94 114.19 2bs2 h PHE 177 Ca 0.01 -0.22 -0.01 0.00 2.81 0.00 0.00 57.97 60.56 2bs2 h PHE 177 Cb 0.25 -0.14 0.00 0.00 3.61 0.00 0.00 35.95 39.67 2bs2 h PHE 177 CO -0.13 0.93 -0.08 0.00 -1.61 0.00 0.00 178.31 177.43 2bs2 h ALA 178 N 1.03 -0.22 0.00 2.45 0.00 -0.94 -1.81 119.26 119.78 2bs2 h ALA 178 Ca 0.02 -0.12 -0.14 0.00 0.00 0.00 0.00 54.91 54.68 2bs2 h ALA 178 Cb 1.01 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.87 2bs2 h ALA 178 CO 0.09 -0.54 -0.66 -0.24 0.00 0.00 0.00 179.25 177.91 2bs2 h VAL 179 N -0.39 1.45 -0.11 0.00 3.04 -0.85 -2.07 116.25 117.32 2bs2 h VAL 179 Ca -0.02 -2.28 -0.11 0.00 -1.01 0.00 0.00 66.70 63.27 2bs2 h VAL 179 Cb 0.30 2.24 0.00 0.00 -2.01 0.00 0.00 31.29 31.83 2bs2 h VAL 179 CO 0.04 0.65 -0.37 -0.33 -1.01 0.00 0.00 177.57 176.55 2bs2 h GLU 180 N 0.00 0.44 -0.33 4.17 4.39 -1.38 0.12 114.58 121.99 2bs2 h GLU 180 Ca -0.01 -0.33 -0.05 0.00 0.34 0.00 0.00 59.36 59.31 2bs2 h GLU 180 Cb 1.19 0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 29.88 2bs2 h GLU 180 CO 0.09 0.95 -0.01 -0.07 -1.16 0.00 0.00 179.01 178.81 2bs2 h LEU 181 N 0.01 0.57 -0.24 1.33 3.38 -1.37 -1.39 115.31 117.60 2bs2 h LEU 181 Ca -0.02 -0.32 -0.01 0.00 0.09 0.00 0.00 57.88 57.63 2bs2 h LEU 181 Cb 0.99 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.58 2bs2 h LEU 181 CO 0.08 0.75 0.12 -0.74 0.09 0.00 0.00 178.44 178.74 2bs2 h HIS 182 N 0.38 0.34 -0.18 1.13 2.76 -1.42 -2.35 115.15 115.82 2bs2 h HIS 182 Ca 0.09 -0.02 -0.03 0.00 -2.20 0.00 0.00 60.37 58.22 2bs2 h HIS 182 Cb 0.46 -0.11 -0.01 0.00 1.55 0.00 0.00 27.41 29.31 2bs2 h HIS 182 CO 0.04 0.33 0.01 0.78 -1.30 0.00 0.00 177.93 177.79 2bs2 h GLY 183 N 0.26 0.33 0.90 5.26 0.00 -0.91 -0.45 103.07 108.46 2bs2 h GLY 183 Ca 0.08 -0.24 -0.05 0.00 0.00 0.00 0.00 47.33 47.12 2bs2 h GLY 183 CO -0.01 0.22 0.02 1.48 0.00 0.00 0.00 176.54 178.25 2bs2 h SER 184 N 0.07 0.55 -0.58 0.19 4.64 -1.29 -0.04 113.55 117.09 2bs2 h SER 184 Ca 0.05 -0.29 -0.08 0.00 -0.47 0.00 0.00 61.79 61.00 2bs2 h SER 184 Cb 0.36 -0.15 -0.02 0.00 -0.31 0.00 0.00 62.40 62.28 2bs2 h SER 184 CO 0.01 0.71 0.07 0.58 -0.87 0.00 0.00 176.83 177.33 2bs2 h VAL 185 N 0.38 1.26 -0.74 0.95 2.07 -1.48 -1.83 116.25 116.86 2bs2 h VAL 185 Ca 0.09 -1.03 -0.01 0.00 0.82 0.00 0.00 66.70 66.58 2bs2 h VAL 185 Cb 0.42 0.71 -0.04 0.00 -1.52 0.00 0.00 31.29 30.86 2bs2 h VAL 185 CO 0.01 0.38 0.42 1.23 0.02 0.00 0.00 177.57 179.64 2bs2 h GLY 186 N 1.03 1.10 1.29 2.17 0.00 -0.78 0.20 103.07 108.07 2bs2 h GLY 186 Ca 0.19 -0.48 -0.14 0.00 0.00 0.00 0.00 47.33 46.89 2bs2 h GLY 186 CO 0.02 0.46 -0.37 1.41 0.00 0.00 0.00 176.54 178.06 2bs2 h LEU 187 N 1.02 0.83 0.54 3.11 3.38 -0.82 -1.67 115.31 121.70 2bs2 h LEU 187 Ca 0.26 -0.36 -0.03 0.00 0.09 0.00 0.00 57.88 57.84 2bs2 h LEU 187 Cb 0.01 -0.23 0.01 0.00 0.09 0.00 0.00 40.66 40.53 2bs2 h LEU 187 CO -0.05 1.11 -0.26 0.22 0.09 0.00 0.00 178.44 179.55 2bs2 h TYR 188 N 0.65 -0.67 -0.25 1.13 3.20 -0.93 -2.36 116.97 117.74 2bs2 h TYR 188 Ca 0.06 -0.02 -0.00 0.00 3.14 0.00 0.00 58.73 61.91 2bs2 h TYR 188 Cb 0.92 0.22 -0.01 0.00 1.54 0.00 0.00 36.73 39.39 2bs2 h TYR 188 CO 0.05 -0.39 0.14 -0.09 -1.64 0.00 0.00 178.16 176.23 2bs2 h ARG 189 N -0.79 0.34 -0.74 1.82 2.43 -0.96 -1.21 114.38 115.28 2bs2 h ARG 189 Ca -0.07 -0.03 0.01 0.00 -0.81 0.00 0.00 59.98 59.08 2bs2 h ARG 189 Cb 0.58 -0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 30.02 2bs2 h ARG 189 CO 0.12 0.25 0.49 1.25 -1.51 0.00 0.00 179.97 180.57 2bs2 h LEU 190 N 0.35 0.84 -0.37 3.80 5.85 -1.09 0.44 115.31 125.13 2bs2 h LEU 190 Ca 0.09 -0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.75 2bs2 h LEU 190 Cb 0.01 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 40.81 2bs2 h LEU 190 CO -0.02 0.60 0.06 0.00 -0.34 0.00 0.00 178.44 178.75 2bs2 h ALA 191 N 1.28 0.49 0.00 1.25 0.00 -0.69 -2.14 119.26 119.45 2bs2 h ALA 191 Ca 0.27 -0.21 -0.08 0.00 0.00 0.00 0.00 54.91 54.90 2bs2 h ALA 191 Cb -0.10 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 2bs2 h ALA 191 CO -0.07 0.20 -0.36 -0.39 0.00 0.00 0.00 179.25 178.64 2bs2 h VAL 192 N 0.46 0.67 -0.16 0.00 -1.51 -1.19 0.26 116.25 114.79 2bs2 h VAL 192 Ca 0.11 -1.76 -0.06 0.00 -1.23 0.00 0.00 66.70 63.76 2bs2 h VAL 192 Cb 0.37 2.19 -0.00 0.00 -2.13 0.00 0.00 31.29 31.72 2bs2 h VAL 192 CO 0.01 0.35 -0.15 0.50 -1.23 0.00 0.00 177.57 177.05 2bs2 h LYS 193 N 0.00 0.37 0.00 5.19 3.64 0.04 -3.27 116.57 122.54 2bs2 h LYS 193 Ca -0.00 -0.20 0.00 0.00 -1.27 0.00 0.00 60.65 59.18 2bs2 h LYS 193 Cb 1.16 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.99 2bs2 h LYS 193 CO 0.05 0.75 -0.89 0.91 -2.27 0.00 0.00 179.45 177.99 2bs2 n TRP 194 N -4.54 0.04 -3.67 1.91 7.02 -0.82 -5.00 117.44 112.38 2bs2 n TRP 194 Ca -0.06 0.01 -0.28 0.00 -1.02 0.00 0.00 57.50 56.16 2bs2 n TRP 194 Cb 0.36 -0.17 0.02 0.00 -2.42 0.00 0.00 31.31 29.11 2bs2 n TRP 194 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2bs2 n GLY 195 N 1.47 -0.50 0.33 6.99 0.00 0.92 -4.88 105.19 109.52 2bs2 n GLY 195 Ca 0.04 0.17 0.10 0.00 0.00 0.00 0.00 46.02 46.32 2bs2 n GLY 195 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 2bs2 h TRP 196 N -1.77 0.32 -0.31 1.61 6.55 -1.88 -2.89 115.95 117.59 2bs2 h TRP 196 Ca -0.54 0.01 0.00 0.00 0.95 0.00 0.00 58.89 59.31 2bs2 h TRP 196 Cb 1.36 -0.11 0.00 0.00 -0.86 0.00 0.00 29.16 29.55 2bs2 h TRP 196 CO 0.59 0.18 0.00 1.19 -1.05 0.00 0.00 178.44 179.34 2bs2 n PHE 197 N -4.48 0.70 0.00 0.49 3.72 -1.26 -4.78 117.46 111.86 2bs2 n PHE 197 Ca 0.05 -0.67 -0.10 0.00 -0.05 0.00 0.00 57.45 56.68 2bs2 n PHE 197 Cb 0.25 -0.16 -0.04 0.00 -0.94 0.00 0.00 39.48 38.59 2bs2 n PHE 197 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 2bs2 h ASP 198 N 1.95 -0.88 0.00 4.37 3.32 -1.85 -3.47 116.42 119.86 2bs2 h ASP 198 Ca 0.00 0.13 0.00 0.00 0.02 0.00 0.00 57.03 57.18 2bs2 h ASP 198 Cb 1.07 0.38 0.00 0.00 0.22 0.00 0.00 39.33 41.00 2bs2 h ASP 198 CO 0.11 -0.33 0.00 0.61 -1.72 0.00 0.00 179.24 177.91 2bs2 n GLY 199 N -1.39 1.89 0.08 2.75 0.00 -1.26 -3.30 105.19 103.95 2bs2 n GLY 199 Ca -0.03 -0.59 0.07 0.00 0.00 0.00 0.00 46.02 45.47 2bs2 n GLY 199 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2bs2 n GLU 200 N 11.72 0.63 -3.29 1.61 1.02 -1.26 -4.55 120.64 126.53 2bs2 n GLU 200 Ca 0.00 0.05 -0.26 0.00 -0.02 0.00 0.00 57.16 56.93 2bs2 n GLU 200 Cb 0.00 -1.71 -0.07 0.00 -0.02 0.00 0.00 31.44 29.64 2bs2 n GLU 200 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 2bs2 n THR 201 N -2.62 2.10 -0.31 2.62 -2.24 -1.25 -4.97 114.28 107.61 2bs2 n THR 201 Ca -0.06 -5.15 0.12 0.00 -2.27 0.00 0.00 64.05 56.69 2bs2 n THR 201 Cb 0.68 -1.88 0.26 0.00 -2.10 0.00 0.00 70.33 67.29 2bs2 n THR 201 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 2bs2 h PRO 202 N 3.87 0.07 -0.47 -0.78 0.11 -1.79 0.37 132.00 133.38 2bs2 h PRO 202 Ca 0.17 -0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.24 2bs2 h PRO 202 Cb 0.66 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 31.73 2bs2 h PRO 202 CO 0.78 0.05 0.17 -0.44 -0.21 0.00 0.00 178.00 178.35 2bs2 h ASP 203 N 0.08 0.61 -0.25 -2.05 3.32 -1.93 -0.93 116.42 115.27 2bs2 h ASP 203 Ca 0.54 -0.08 -0.15 0.00 0.02 0.00 0.00 57.03 57.36 2bs2 h ASP 203 Cb 1.07 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 40.47 2bs2 h ASP 203 CO -0.80 0.57 -0.44 0.11 -1.72 0.00 0.00 179.24 176.97 2bs2 h LYS 204 N 0.67 0.74 -0.74 3.56 1.57 -1.34 -1.58 116.57 119.45 2bs2 h LYS 204 Ca 0.16 -0.46 -0.01 0.00 -1.87 0.00 0.00 60.65 58.47 2bs2 h LYS 204 Cb 0.17 0.05 -0.04 0.00 0.08 0.00 0.00 32.23 32.49 2bs2 h LYS 204 CO -0.01 1.08 0.44 1.15 -0.57 0.00 0.00 179.45 181.54 2bs2 h THR 205 N 0.47 1.21 -0.51 -0.16 2.02 -1.01 -1.25 112.91 113.68 2bs2 h THR 205 Ca 0.02 -0.48 -0.11 0.00 0.77 0.00 0.00 66.41 66.60 2bs2 h THR 205 Cb 1.04 0.20 -0.02 0.00 -1.74 0.00 0.00 68.15 67.64 2bs2 h THR 205 CO 0.10 0.22 -0.10 -0.09 0.37 0.00 0.00 175.52 176.02 2bs2 h ARG 206 N 1.01 0.97 -0.86 6.66 2.43 -1.13 -0.19 114.38 123.27 2bs2 h ARG 206 Ca 0.26 -0.36 0.02 0.00 -0.81 0.00 0.00 59.98 59.09 2bs2 h ARG 206 Cb -0.02 -0.06 -0.05 0.00 -0.42 0.00 0.00 29.97 29.43 2bs2 h ARG 206 CO -0.05 1.03 0.56 0.00 -1.51 0.00 0.00 179.97 180.01 2bs2 h ALA 207 N 0.91 1.10 -0.25 2.80 0.00 -0.88 -0.67 119.26 122.27 2bs2 h ALA 207 Ca 0.13 -0.05 -0.20 0.00 0.00 0.00 0.00 54.91 54.79 2bs2 h ALA 207 Cb 0.66 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.13 2bs2 h ALA 207 CO 0.05 0.46 -0.61 -0.91 0.00 0.00 0.00 179.25 178.24 2bs2 h ASN 208 N 1.13 0.97 -0.49 0.00 2.35 -1.02 -2.71 115.58 115.82 2bs2 h ASN 208 Ca 0.32 -0.56 -0.01 0.00 -0.55 0.00 0.00 56.30 55.50 2bs2 h ASN 208 Cb -0.09 -0.28 -0.03 0.00 0.05 0.00 0.00 38.32 37.97 2bs2 h ASN 208 CO -0.08 1.36 0.27 -0.07 -1.65 0.00 0.00 177.43 177.25 2bs2 h LEU 209 N 0.63 0.64 -0.48 1.61 3.38 -0.62 0.12 115.31 120.58 2bs2 h LEU 209 Ca -0.01 -0.05 -0.11 0.00 0.09 0.00 0.00 57.88 57.80 2bs2 h LEU 209 Cb 1.23 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.80 2bs2 h LEU 209 CO 0.13 0.53 -0.13 0.11 0.09 0.00 0.00 178.44 179.18 2bs2 h LYS 210 N 0.72 0.93 -0.22 1.13 1.57 -1.05 -0.05 116.57 119.61 2bs2 h LYS 210 Ca 0.18 -0.36 -0.04 0.00 -1.87 0.00 0.00 60.65 58.56 2bs2 h LYS 210 Cb 0.05 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 2bs2 h LYS 210 CO -0.03 1.02 -0.02 0.87 -0.57 0.00 0.00 179.45 180.73 2bs2 h LYS 211 N 0.78 0.40 -0.33 3.15 1.57 -1.07 -2.36 116.57 118.72 2bs2 h LYS 211 Ca 0.12 -0.14 0.04 0.00 -1.87 0.00 0.00 60.65 58.81 2bs2 h LYS 211 Cb 0.69 -0.03 -0.04 0.00 0.08 0.00 0.00 32.23 32.92 2bs2 h LYS 211 CO 0.05 0.61 0.08 1.25 -0.57 0.00 0.00 179.45 180.87 2bs2 h LEU 212 N 0.15 0.05 -0.53 2.94 5.85 -0.68 -1.76 115.31 121.33 2bs2 h LEU 212 Ca 0.06 0.05 0.10 0.00 0.84 0.00 0.00 57.88 58.93 2bs2 h LEU 212 Cb 0.44 0.05 -0.08 0.00 0.37 0.00 0.00 40.66 41.45 2bs2 h LEU 212 CO 0.02 0.06 0.05 0.50 -0.34 0.00 0.00 178.44 178.73 2bs2 h LYS 213 N 0.21 0.16 -0.56 1.25 3.64 -0.86 0.49 116.57 120.90 2bs2 h LYS 213 Ca 0.15 -0.01 -0.05 0.00 -1.27 0.00 0.00 60.65 59.48 2bs2 h LYS 213 Cb 0.15 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 31.91 2bs2 h LYS 213 CO -0.18 0.11 0.18 1.15 -2.27 0.00 0.00 179.45 178.43 2bs2 h THR 214 N 0.17 1.24 -0.07 1.00 2.02 -0.90 -2.22 112.91 114.14 2bs2 h THR 214 Ca 0.27 -0.81 -0.01 0.00 0.77 0.00 0.00 66.41 66.63 2bs2 h THR 214 Cb 0.40 0.70 -0.00 0.00 -1.74 0.00 0.00 68.15 67.50 2bs2 h THR 214 CO -0.40 0.30 -0.00 -0.07 0.37 0.00 0.00 175.52 175.72 2bs2 h LEU 215 N 0.79 0.13 -0.70 2.58 -0.00 -0.75 -1.32 115.31 116.04 2bs2 h LEU 215 Ca 0.18 -0.31 0.13 0.00 -0.00 0.00 0.00 57.88 57.88 2bs2 h LEU 215 Cb 0.28 -0.03 -0.09 0.00 -0.00 0.00 0.00 40.66 40.82 2bs2 h LEU 215 CO -0.01 0.41 0.25 -0.03 -0.00 0.00 0.00 178.44 179.06 2bs2 h MET 216 N -0.16 0.38 -0.15 1.13 4.05 -0.88 0.11 114.93 119.41 2bs2 h MET 216 Ca 0.02 -0.02 -0.01 0.00 -0.28 0.00 0.00 59.70 59.41 2bs2 h MET 216 Cb 0.34 -0.09 -0.01 0.00 -0.80 0.00 0.00 31.60 31.05 2bs2 h MET 216 CO 0.00 0.25 0.06 0.77 0.23 0.00 0.00 176.91 178.23 2bs2 h SER 217 N 0.40 0.21 0.35 1.39 0.02 -1.28 -1.70 113.55 112.94 2bs2 h SER 217 Ca 0.38 -0.17 -0.01 0.00 -0.84 0.00 0.00 61.79 61.15 2bs2 h SER 217 Cb 0.55 -0.05 -0.02 0.00 0.14 0.00 0.00 62.40 63.02 2bs2 h SER 217 CO -0.39 0.32 -0.29 0.00 -1.14 0.00 0.00 176.83 175.33 2bs2 h ALA 218 N 0.90 -0.65 -0.28 3.77 0.00 -0.19 0.08 119.26 122.88 2bs2 h ALA 218 Ca 0.05 -0.11 0.06 0.00 0.00 0.00 0.00 54.91 54.91 2bs2 h ALA 218 Cb 0.18 0.40 -0.06 0.00 0.00 0.00 0.00 17.79 18.31 2bs2 h ALA 218 CO -0.00 -0.90 -0.08 0.35 0.00 0.00 0.00 179.25 178.62 2bs2 h PHE 219 N -0.65 -0.18 -0.30 0.00 3.57 -0.82 -1.67 116.94 116.89 2bs2 h PHE 219 Ca -0.03 0.03 -0.09 0.00 3.53 0.00 0.00 57.97 61.41 2bs2 h PHE 219 Cb 0.58 0.12 -0.02 0.00 2.79 0.00 0.00 35.95 39.42 2bs2 h PHE 219 CO -0.15 -0.14 -0.19 -0.07 -2.23 0.00 0.00 178.31 175.53 2bs2 h LEU 220 N -0.02 0.54 0.01 0.59 3.38 -1.18 -0.63 115.31 118.00 2bs2 h LEU 220 Ca 0.14 -0.17 -0.00 0.00 0.09 0.00 0.00 57.88 57.94 2bs2 h LEU 220 Cb 0.23 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.83 2bs2 h LEU 220 CO -0.30 0.74 -0.01 0.40 0.09 0.00 0.00 178.44 179.36 2bs2 h ILE 221 N 0.49 1.23 0.02 1.22 1.08 -0.62 0.15 117.51 121.08 2bs2 h ILE 221 Ca 0.08 -0.74 -0.00 0.00 -0.39 0.00 0.00 64.86 63.81 2bs2 h ILE 221 Cb 0.61 1.73 0.00 0.00 -3.07 0.00 0.00 36.82 36.09 2bs2 h ILE 221 CO 0.04 0.19 -0.01 0.58 -0.69 0.00 0.00 178.15 178.26 2bs2 h VAL 222 N -0.34 1.00 -0.57 1.67 2.07 -1.26 0.15 116.25 118.98 2bs2 h VAL 222 Ca -0.00 -0.06 0.05 0.00 0.82 0.00 0.00 66.70 67.51 2bs2 h VAL 222 Cb 0.33 1.04 -0.03 0.00 -1.52 0.00 0.00 31.29 31.10 2bs2 h VAL 222 CO 0.00 0.02 0.38 0.25 0.02 0.00 0.00 177.57 178.24 2bs2 h LEU 223 N -0.05 0.51 -0.57 2.57 5.85 -1.11 0.11 115.31 122.61 2bs2 h LEU 223 Ca -0.00 -0.00 -0.15 0.00 0.84 0.00 0.00 57.88 58.57 2bs2 h LEU 223 Cb 0.04 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 40.95 2bs2 h LEU 223 CO 0.00 0.34 -0.43 1.23 -0.34 0.00 0.00 178.44 179.25 2bs2 h GLY 224 N 0.58 0.71 1.30 3.75 0.00 0.25 -0.99 103.07 108.68 2bs2 h GLY 224 Ca 0.24 -0.74 -0.18 0.00 0.00 0.00 0.00 47.33 46.65 2bs2 h GLY 224 CO -0.07 0.67 -0.58 1.41 0.00 0.00 0.00 176.54 177.97 2bs2 h LEU 225 N 0.53 0.81 0.10 3.11 3.38 0.66 0.14 115.31 124.05 2bs2 h LEU 225 Ca 0.04 -0.45 -0.00 0.00 0.09 0.00 0.00 57.88 57.56 2bs2 h LEU 225 Cb 0.96 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.48 2bs2 h LEU 225 CO 0.09 1.21 -0.05 -0.07 0.09 0.00 0.00 178.44 179.71 2bs2 h LEU 226 N 0.55 -0.11 -1.16 1.67 3.38 -0.74 0.43 115.31 119.33 2bs2 h LEU 226 Ca 0.00 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.86 2bs2 h LEU 226 Cb 1.16 0.03 -0.04 0.00 0.09 0.00 0.00 40.66 41.90 2bs2 h LEU 226 CO 0.12 0.04 0.51 0.74 0.09 0.00 0.00 178.44 179.94 2bs2 h THR 227 N -0.26 1.22 0.10 0.22 2.02 -1.16 -1.69 112.91 113.35 2bs2 h THR 227 Ca -0.01 -0.44 -0.00 0.00 0.77 0.00 0.00 66.41 66.73 2bs2 h THR 227 Cb 0.22 0.06 0.00 0.00 -1.74 0.00 0.00 68.15 66.69 2bs2 h THR 227 CO 0.02 0.22 -0.05 0.15 0.37 0.00 0.00 175.52 176.23 2bs2 h PHE 228 N 1.10 -0.12 -0.91 3.16 3.57 -0.59 -2.46 116.94 120.68 2bs2 h PHE 228 Ca 0.29 -0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.81 2bs2 h PHE 228 Cb -0.08 0.04 -0.05 0.00 2.79 0.00 0.00 35.95 38.65 2bs2 h PHE 228 CO 0.00 -0.07 0.60 0.78 -2.23 0.00 0.00 178.31 177.39 2bs2 h GLY 229 N -0.14 1.29 0.89 2.40 0.00 -0.44 -1.87 103.07 105.20 2bs2 h GLY 229 Ca -0.01 -0.46 0.01 0.00 0.00 0.00 0.00 47.33 46.87 2bs2 h GLY 229 CO 0.02 0.43 0.04 0.00 0.00 0.00 0.00 176.54 177.03 2bs2 h ALA 230 N 1.45 0.14 -0.73 3.60 0.00 -1.04 0.12 119.26 122.79 2bs2 h ALA 230 Ca 0.35 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.25 2bs2 h ALA 230 Cb -0.07 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 2bs2 h ALA 230 CO -0.09 -0.41 0.37 1.88 0.00 0.00 0.00 179.25 181.00 2bs2 h TYR 231 N 0.10 1.04 0.29 0.00 0.05 -1.11 -2.39 116.97 114.95 2bs2 h TYR 231 Ca 0.06 -0.04 -0.01 0.00 0.05 0.00 0.00 58.73 58.78 2bs2 h TYR 231 Cb 0.03 -0.32 0.00 0.00 1.01 0.00 0.00 36.73 37.45 2bs2 h TYR 231 CO -0.11 0.75 -0.14 0.28 -1.05 0.00 0.00 178.16 177.89 2bs2 h VAL 232 N 1.02 0.74 -0.38 -2.88 2.07 -1.01 -0.94 116.25 114.87 2bs2 h VAL 232 Ca 0.25 -0.41 0.08 0.00 0.82 0.00 0.00 66.70 67.44 2bs2 h VAL 232 Cb 0.09 0.97 -0.09 0.00 -1.52 0.00 0.00 31.29 30.73 2bs2 h VAL 232 CO -0.04 0.08 -0.33 0.50 0.02 0.00 0.00 177.57 177.81 2bs2 h LYS 233 N -0.61 -0.25 -0.68 1.57 3.64 -0.70 0.20 116.57 119.74 2bs2 h LYS 233 Ca -0.04 0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.36 2bs2 h LYS 233 Cb 0.44 0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 32.28 2bs2 h LYS 233 CO 0.07 -0.17 0.45 0.87 -2.27 0.00 0.00 179.45 178.40 2bs2 h LYS 234 N -0.26 0.89 0.00 1.90 1.57 -1.44 -1.90 116.57 117.33 2bs2 h LYS 234 Ca 0.17 -0.05 -0.03 0.00 -1.87 0.00 0.00 60.65 58.87 2bs2 h LYS 234 Cb 0.54 -0.20 -0.00 0.00 0.08 0.00 0.00 32.23 32.65 2bs2 h LYS 234 CO -0.53 0.59 -0.13 0.78 -0.57 0.00 0.00 179.45 179.60 2bs2 h GLY 235 N 0.92 0.00 1.19 3.86 0.00 0.20 -1.22 103.07 108.02 2bs2 h GLY 235 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.58 2bs2 h GLY 235 CO -0.05 0.00 -0.04 1.04 0.00 0.00 0.00 176.54 177.48 2bs2 n LEU 236 N -4.16 0.21 -0.10 3.11 4.77 0.58 -3.14 117.00 118.27 2bs2 n LEU 236 Ca -0.02 0.12 0.09 0.00 -0.03 0.00 0.00 56.01 56.17 2bs2 n LEU 236 Cb 0.21 -0.20 -0.09 0.00 -2.33 0.00 0.00 43.42 41.01 2bs2 n LEU 236 CO 0.34 0.04 0.03 -0.62 -1.33 0.00 0.00 177.39 175.85 2bs2 n GLU 237 N -1.09 0.76 -2.67 3.23 1.02 -0.47 -4.76 120.64 116.66 2bs2 n GLU 237 Ca 0.16 -0.21 -0.42 0.00 -0.02 0.00 0.00 57.16 56.67 2bs2 n GLU 237 Cb 0.24 -1.42 -0.03 0.00 -0.02 0.00 0.00 31.44 30.21 2bs2 n GLU 237 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 2bs2 s GLN 238 N -2.72 3.62 -0.01 3.49 -0.21 -1.17 -4.69 119.66 117.97 2bs2 s GLN 238 Ca 0.09 -1.36 0.07 0.00 0.02 0.00 0.00 55.36 54.19 2bs2 s GLN 238 Cb 0.15 -5.24 -0.10 0.00 1.00 0.00 0.00 33.01 28.83 2bs2 s GLN 238 CO 0.74 -2.08 0.23 0.25 -2.12 0.00 0.00 175.29 172.31 2bs2 n THR 239 N 6.44 0.00 -1.96 -0.19 -2.24 -1.26 -4.99 114.28 110.08 2bs2 n THR 239 Ca 0.31 -0.25 -0.42 0.00 -2.27 0.00 0.00 64.05 61.42 2bs2 n THR 239 Cb 0.50 0.65 -0.03 0.00 -2.10 0.00 0.00 70.33 69.35 2bs2 n THR 239 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2bs2 s ASP 240 N -2.30 6.43 0.00 3.42 -1.08 -1.26 -4.87 116.67 117.01 2bs2 s ASP 240 Ca -0.00 2.06 0.20 0.00 -0.52 0.00 0.00 52.55 54.30 2bs2 s ASP 240 Cb 0.05 -2.53 1.05 0.00 -1.46 0.00 0.00 42.92 40.03 2bs2 s ASP 240 CO 0.31 -1.15 1.64 -0.81 0.52 0.00 0.00 175.17 175.68 2bs2 n PRO 241 N 7.51 0.33 -0.19 4.34 -0.04 -1.26 -2.91 135.00 142.78 2bs2 n PRO 241 Ca 0.19 0.08 0.09 0.00 -0.04 0.00 0.00 63.50 63.82 2bs2 n PRO 241 Cb 0.44 -1.50 0.19 0.00 -0.04 0.00 0.00 33.50 32.58 2bs2 n PRO 241 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2bs2 n ASN 242 N -1.26 3.15 -4.54 3.54 3.02 -1.26 -4.95 115.26 112.96 2bs2 n ASN 242 Ca 0.10 -1.92 -0.34 0.00 -0.03 0.00 0.00 54.58 52.40 2bs2 n ASN 242 Cb 0.15 -0.25 -0.11 0.00 -0.61 0.00 0.00 39.78 38.96 2bs2 n ASN 242 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2bs2 s ILE 243 N -1.14 4.01 -1.10 2.41 -1.09 -1.14 -5.04 121.20 118.10 2bs2 s ILE 243 Ca 0.31 -0.33 -0.13 0.00 -2.23 0.00 0.00 60.65 58.27 2bs2 s ILE 243 Cb 0.18 -2.74 0.20 0.00 -1.58 0.00 0.00 42.46 38.51 2bs2 s ILE 243 CO 0.24 0.52 1.24 -0.62 -1.23 0.00 0.00 174.94 175.09 2bs2 s ASP 244 N 0.07 7.04 0.20 3.58 2.15 -1.26 -4.85 116.67 123.60 2bs2 s ASP 244 Ca 0.00 -2.97 -0.07 0.00 0.43 0.00 0.00 52.55 49.94 2bs2 s ASP 244 Cb -0.13 -2.33 0.14 0.00 -0.30 0.00 0.00 42.92 40.29 2bs2 s ASP 244 CO 0.02 -0.66 1.69 1.88 -0.17 0.00 0.00 175.17 177.93 2bs2 h TYR 245 N 7.36 1.13 -0.69 -5.34 -1.99 -1.95 -2.46 116.97 113.03 2bs2 h TYR 245 Ca 0.24 -0.17 0.14 0.00 2.00 0.00 0.00 58.73 60.94 2bs2 h TYR 245 Cb 0.91 -0.30 -0.13 0.00 2.00 0.00 0.00 36.73 39.21 2bs2 h TYR 245 CO 1.02 0.97 -0.19 -0.22 -0.00 0.00 0.00 178.16 179.74 2bs2 h LYS 246 N 0.98 -0.01 -0.38 4.88 1.63 -1.88 -1.30 116.57 120.48 2bs2 h LYS 246 Ca 0.19 0.00 -0.05 0.00 -0.85 0.00 0.00 60.65 59.94 2bs2 h LYS 246 Cb 0.48 0.00 -0.03 0.00 -0.60 0.00 0.00 32.23 32.08 2bs2 h LYS 246 CO 0.02 -0.01 0.03 0.66 -3.45 0.00 0.00 179.45 176.70 2bs2 n TYR 247 N -5.47 1.32 0.40 1.91 4.02 -1.22 -4.60 117.16 113.52 2bs2 n TYR 247 Ca 0.09 -0.98 -0.18 0.00 -0.01 0.00 0.00 57.90 56.81 2bs2 n TYR 247 Cb 0.36 -0.41 -0.09 0.00 -0.02 0.00 0.00 39.34 39.18 2bs2 n TYR 247 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 176.86 176.20 2bs2 h PHE 248 N 2.13 -0.92 -0.46 -0.72 3.57 -0.73 -0.44 116.94 119.37 2bs2 h PHE 248 Ca 0.06 -0.02 0.10 0.00 3.53 0.00 0.00 57.97 61.64 2bs2 h PHE 248 Cb 1.66 0.31 -0.02 0.00 2.79 0.00 0.00 35.95 40.69 2bs2 h PHE 248 CO 0.74 -0.57 0.32 -0.44 -2.23 0.00 0.00 178.31 176.13 2bs2 h ASP 249 N -1.02 0.15 -0.04 0.41 3.32 -1.84 -0.36 116.42 117.03 2bs2 h ASP 249 Ca -0.10 0.00 -0.20 0.00 0.02 0.00 0.00 57.03 56.75 2bs2 h ASP 249 Cb 0.77 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.30 2bs2 h ASP 249 CO 0.17 0.09 -0.71 0.22 -1.72 0.00 0.00 179.24 177.29 2bs2 h TYR 250 N 0.16 0.90 0.00 4.55 3.20 -1.66 -3.32 116.97 120.80 2bs2 h TYR 250 Ca 0.22 -0.37 -0.66 0.00 3.14 0.00 0.00 58.73 61.05 2bs2 h TYR 250 Cb 0.64 -0.15 0.02 0.00 1.54 0.00 0.00 36.73 38.78 2bs2 h TYR 250 CO -0.00 1.18 3.65 1.63 -1.64 0.00 0.00 178.16 182.97 2bs2 n LYS 251 N -3.92 3.43 0.00 1.82 5.02 -0.14 -2.34 118.16 122.03 2bs2 n LYS 251 Ca -0.06 -2.22 0.00 0.00 -2.02 0.00 0.00 58.31 54.02 2bs2 n LYS 251 Cb 0.70 -2.86 0.00 0.00 -0.02 0.00 0.00 35.03 32.85 2bs2 n LYS 251 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2bs2 n ARG 252 N 4.10 0.00 -2.73 1.97 1.74 -1.25 -4.95 116.66 115.54 2bs2 n ARG 252 Ca 0.72 0.00 -0.03 0.00 -0.77 0.00 0.00 57.85 57.77 2bs2 n ARG 252 Cb 0.25 -0.40 0.09 0.00 -1.02 0.00 0.00 32.46 31.39 2bs2 n ARG 252 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 2bs2 n THR 253 N -1.07 0.49 -4.04 0.55 -1.04 -1.22 -4.99 114.28 102.97 2bs2 n THR 253 Ca 0.00 -1.86 -0.28 0.00 -2.04 0.00 0.00 64.05 59.88 2bs2 n THR 253 Cb 0.00 1.07 -0.03 0.00 -1.82 0.00 0.00 70.33 69.55 2bs2 n THR 253 CO 0.00 0.00 0.00 1.41 -0.64 0.00 0.00 175.07 175.84 2bs2 n HIS 254 N -1.00 -1.62 0.00 -1.42 8.25 -1.21 -4.07 115.22 114.15 2bs2 n HIS 254 Ca -0.06 0.74 0.00 0.00 -0.26 0.00 0.00 57.72 58.14 2bs2 n HIS 254 Cb 0.85 -3.52 0.00 0.00 1.12 0.00 0.00 29.99 28.44 2bs2 n HIS 254 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37