#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xbx n PRO 4 N 0.00 2.01 -2.33 3.23 -0.02 -1.25 -4.97 135.00 131.67 1xbx n PRO 4 Ca 0.00 0.71 -0.28 0.00 -2.02 0.00 0.00 63.50 61.91 1xbx n PRO 4 Cb 0.00 -2.35 0.01 0.00 -0.02 0.00 0.00 33.50 31.14 1xbx n PRO 4 CO 0.00 0.00 0.00 -1.64 1.98 0.00 0.00 175.50 175.84 1xbx s MET 5 N -0.68 3.40 -0.17 -0.52 -1.94 -0.28 -4.88 119.30 114.24 1xbx s MET 5 Ca 0.66 0.33 -0.02 0.00 -1.71 0.00 0.00 55.69 54.95 1xbx s MET 5 Cb -0.64 -2.25 -0.01 0.00 2.01 0.00 0.00 34.83 33.94 1xbx s MET 5 CO 0.52 -0.45 -0.09 -1.17 -0.01 0.00 0.00 175.02 173.82 1xbx s LEU 6 N -4.95 2.81 -0.14 -0.03 2.96 -1.26 -1.06 118.68 117.01 1xbx s LEU 6 Ca 0.51 -0.35 0.00 0.00 -0.22 0.00 0.00 54.13 54.08 1xbx s LEU 6 Cb -0.11 -1.67 -0.01 0.00 0.50 0.00 0.00 46.19 44.91 1xbx s LEU 6 CO 0.48 0.09 -0.15 -1.58 -1.32 0.00 0.00 176.35 173.87 1xbx s GLN 7 N 0.82 3.27 -0.15 1.98 0.74 -0.31 -0.86 119.66 125.13 1xbx s GLN 7 Ca -0.03 -0.74 -0.14 0.00 0.05 0.00 0.00 55.36 54.50 1xbx s GLN 7 Cb -0.15 -2.59 -0.05 0.00 1.10 0.00 0.00 33.01 31.32 1xbx s GLN 7 CO 0.01 0.11 0.30 0.54 -0.55 0.00 0.00 175.29 175.70 1xbx s VAL 8 N 0.58 5.30 -0.22 1.34 0.11 -0.43 -1.03 120.40 126.04 1xbx s VAL 8 Ca -0.09 0.57 -0.16 0.00 -2.93 0.00 0.00 61.98 59.37 1xbx s VAL 8 Cb -0.16 -3.64 -0.04 0.00 -1.53 0.00 0.00 36.38 31.02 1xbx s VAL 8 CO 0.03 0.40 0.40 0.00 -3.33 0.00 0.00 175.10 172.60 1xbx s ALA 9 N 0.39 3.56 -0.92 1.54 0.00 -0.76 -0.58 121.76 125.01 1xbx s ALA 9 Ca 0.17 -0.59 -0.15 0.00 0.00 0.00 0.00 51.96 51.39 1xbx s ALA 9 Cb -0.13 -2.66 0.19 0.00 0.00 0.00 0.00 23.12 20.51 1xbx s ALA 9 CO 0.04 -0.40 0.98 -0.51 0.00 0.00 0.00 175.76 175.87 1xbx s LEU 10 N 1.52 5.97 -0.97 0.00 1.43 0.06 -4.50 118.68 122.18 1xbx s LEU 10 Ca 0.18 -2.55 -0.03 0.00 -1.03 0.00 0.00 54.13 50.71 1xbx s LEU 10 Cb -0.15 -2.29 0.24 0.00 0.03 0.00 0.00 46.19 44.02 1xbx s LEU 10 CO 0.08 -0.75 2.15 0.47 0.23 0.00 0.00 176.35 178.54 1xbx n ASP 11 N 4.95 7.43 -4.89 2.29 8.00 -1.26 -1.00 116.55 132.07 1xbx n ASP 11 Ca 0.20 -3.53 -0.24 0.00 0.71 0.00 0.00 54.79 51.93 1xbx n ASP 11 Cb 0.47 -1.20 -0.04 0.00 -0.02 0.00 0.00 41.12 40.33 1xbx n ASP 11 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 1xbx s ASN 12 N -0.63 6.01 0.19 -2.24 0.01 -1.26 -4.80 114.94 112.22 1xbx s ASN 12 Ca 0.49 0.01 0.20 0.00 -0.71 0.00 0.00 52.86 52.85 1xbx s ASN 12 Cb 0.28 -1.71 -0.01 0.00 0.41 0.00 0.00 41.25 40.23 1xbx s ASN 12 CO -0.20 0.02 1.06 1.56 -1.51 0.00 0.00 177.10 178.02 1xbx h GLN 13 N 1.90 0.00 -4.76 -0.60 4.20 -1.93 -2.38 115.11 111.54 1xbx h GLN 13 Ca -0.49 0.00 -0.26 0.00 0.06 0.00 0.00 58.65 57.96 1xbx h GLN 13 Cb 1.21 0.00 -0.16 0.00 0.30 0.00 0.00 27.48 28.83 1xbx h GLN 13 CO 0.64 0.13 -0.71 0.95 -0.67 0.00 0.00 178.83 179.17 1xbx s THR 14 N -3.18 0.79 0.16 -0.54 -4.23 -1.26 -4.17 115.64 103.22 1xbx s THR 14 Ca -0.00 -1.81 -0.13 0.00 -1.18 0.00 0.00 61.69 58.56 1xbx s THR 14 Cb 0.09 -1.54 0.06 0.00 1.34 0.00 0.00 72.50 72.44 1xbx s THR 14 CO 0.78 -0.75 1.75 0.24 -0.54 0.00 0.00 174.62 176.10 1xbx h MET 15 N 3.20 0.78 -0.57 3.99 2.86 -1.95 -2.31 114.93 120.92 1xbx h MET 15 Ca -0.36 -0.11 -0.00 0.00 -2.06 0.00 0.00 59.70 57.17 1xbx h MET 15 Cb 1.18 -0.14 -0.03 0.00 0.06 0.00 0.00 31.60 32.67 1xbx h MET 15 CO 0.60 0.63 0.35 0.38 1.06 0.00 0.00 176.91 179.93 1xbx h ASP 16 N 0.73 0.68 -0.55 1.22 2.03 -1.99 -0.02 116.42 118.52 1xbx h ASP 16 Ca 0.19 -0.03 -0.05 0.00 -0.73 0.00 0.00 57.03 56.40 1xbx h ASP 16 Cb 0.11 -0.17 -0.02 0.00 -0.83 0.00 0.00 39.33 38.42 1xbx h ASP 16 CO -0.02 0.52 0.14 -1.28 -1.03 0.00 0.00 179.24 177.56 1xbx h SER 17 N 0.78 0.82 -0.84 4.15 0.87 -1.93 -2.80 113.55 114.60 1xbx h SER 17 Ca 0.21 -0.23 -0.03 0.00 -1.23 0.00 0.00 61.79 60.51 1xbx h SER 17 Cb -0.04 -0.22 -0.04 0.00 -0.44 0.00 0.00 62.40 61.67 1xbx h SER 17 CO -0.04 0.84 0.41 0.00 -0.53 0.00 0.00 176.83 177.51 1xbx h ALA 18 N 1.02 1.08 0.00 6.23 0.00 -0.76 -2.77 119.26 124.06 1xbx h ALA 18 Ca 0.17 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 1xbx h ALA 18 Cb 0.33 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1xbx h ALA 18 CO 0.00 0.64 -0.23 1.88 0.00 0.00 0.00 179.25 181.54 1xbx h TYR 19 N 1.19 0.00 -0.89 0.00 0.05 -0.87 -0.48 116.97 115.97 1xbx h TYR 19 Ca 0.29 0.00 0.18 0.00 0.05 0.00 0.00 58.73 59.25 1xbx h TYR 19 Cb 0.11 0.00 -0.07 0.00 1.01 0.00 0.00 36.73 37.78 1xbx h TYR 19 CO 0.01 0.23 0.58 0.93 -1.05 0.00 0.00 178.16 178.87 1xbx h GLU 20 N 0.00 0.51 0.01 4.88 5.08 -1.23 -0.46 114.58 123.37 1xbx h GLU 20 Ca -0.00 -0.03 -0.13 0.00 -1.00 0.00 0.00 59.36 58.20 1xbx h GLU 20 Cb 0.50 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.62 1xbx h GLU 20 CO 0.03 0.34 -0.69 1.15 -1.00 0.00 0.00 179.01 178.84 1xbx h THR 21 N 0.52 1.34 -0.00 1.13 2.02 -1.22 -3.37 112.91 113.32 1xbx h THR 21 Ca 0.46 -2.28 -0.06 0.00 0.77 0.00 0.00 66.41 65.30 1xbx h THR 21 Cb 0.97 2.82 -0.01 0.00 -1.74 0.00 0.00 68.15 70.20 1xbx h THR 21 CO -0.20 0.49 -0.27 0.71 0.37 0.00 0.00 175.52 176.62 1xbx h THR 22 N -0.93 1.20 0.00 3.16 1.35 -1.06 -0.75 112.91 115.88 1xbx h THR 22 Ca -0.18 -0.94 -0.00 0.00 -0.55 0.00 0.00 66.41 64.74 1xbx h THR 22 Cb 1.21 1.50 -0.00 0.00 -1.73 0.00 0.00 68.15 69.13 1xbx h THR 22 CO -0.08 0.27 -0.02 0.08 -0.25 0.00 0.00 175.52 175.51 1xbx h ARG 23 N 0.01 0.00 0.11 4.72 0.11 -1.27 -1.45 114.38 116.60 1xbx h ARG 23 Ca -0.00 0.00 -0.32 0.00 0.10 0.00 0.00 59.98 59.76 1xbx h ARG 23 Cb 0.48 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.55 1xbx h ARG 23 CO 0.04 0.02 -1.72 -0.07 0.10 0.00 0.00 179.97 178.34 1xbx h LEU 24 N 0.00 0.36 -2.18 0.08 3.38 -1.33 -3.45 115.31 112.17 1xbx h LEU 24 Ca -0.00 -0.85 0.00 0.00 0.09 0.00 0.00 57.88 57.12 1xbx h LEU 24 Cb 0.39 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.02 1xbx h LEU 24 CO 0.00 1.74 0.00 2.30 0.09 0.00 0.00 178.44 182.57 1xbx n ILE 25 N -3.76 0.61 -0.10 1.22 -6.64 -0.72 -4.75 119.36 105.23 1xbx n ILE 25 Ca -0.30 -0.67 0.08 0.00 -1.77 0.00 0.00 62.75 60.10 1xbx n ILE 25 Cb 0.95 0.74 0.43 0.00 -1.44 0.00 0.00 39.64 40.32 1xbx n ILE 25 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 1xbx h ALA 26 N 0.00 1.83 -0.02 -1.28 0.00 -1.49 0.14 119.26 118.45 1xbx h ALA 26 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1xbx h ALA 26 Cb 0.56 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1xbx h ALA 26 CO 0.00 0.07 0.00 0.39 0.00 0.00 0.00 179.25 179.71 1xbx n GLU 27 N -4.48 1.58 -0.02 0.00 -0.58 -1.26 -3.68 120.64 112.21 1xbx n GLU 27 Ca 0.08 -0.85 0.11 0.00 -0.42 0.00 0.00 57.16 56.09 1xbx n GLU 27 Cb 0.25 -1.48 0.10 0.00 -0.57 0.00 0.00 31.44 29.73 1xbx n GLU 27 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 1xbx n GLU 28 N 0.03 2.03 -4.31 3.49 -0.58 0.49 -4.97 120.64 116.82 1xbx n GLU 28 Ca 0.20 -1.82 -0.16 0.00 -0.42 0.00 0.00 57.16 54.95 1xbx n GLU 28 Cb 0.32 -1.42 -0.10 0.00 -0.57 0.00 0.00 31.44 29.67 1xbx n GLU 28 CO 0.00 0.00 0.00 0.14 -0.48 0.00 0.00 177.13 176.79 1xbx s VAL 29 N -1.77 0.70 -0.19 2.62 -7.23 -1.21 -4.78 120.40 108.55 1xbx s VAL 29 Ca 0.26 -2.00 0.09 0.00 -1.81 0.00 0.00 61.98 58.52 1xbx s VAL 29 Cb 0.18 -2.49 -0.22 0.00 0.56 0.00 0.00 36.38 34.41 1xbx s VAL 29 CO 0.27 -0.16 0.09 0.47 -0.31 0.00 0.00 175.10 175.46 1xbx n ASP 30 N -0.42 1.04 -3.97 4.85 8.00 -0.04 -4.96 116.55 121.04 1xbx n ASP 30 Ca -0.02 0.04 -0.22 0.00 0.71 0.00 0.00 54.79 55.30 1xbx n ASP 30 Cb 0.65 0.16 -0.16 0.00 -0.02 0.00 0.00 41.12 41.75 1xbx n ASP 30 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1xbx s ILE 31 N -2.52 0.82 -0.31 0.53 1.01 -0.95 -3.15 121.20 116.63 1xbx s ILE 31 Ca -0.19 -0.32 -0.09 0.00 0.00 0.00 0.00 60.65 60.04 1xbx s ILE 31 Cb 0.07 -0.77 -0.01 0.00 0.01 0.00 0.00 42.46 41.77 1xbx s ILE 31 CO 0.74 0.27 0.14 -0.63 0.00 0.00 0.00 174.94 175.47 1xbx s ILE 32 N 0.57 4.54 -0.18 2.92 1.01 0.04 -1.32 121.20 128.79 1xbx s ILE 32 Ca -0.10 -0.44 -0.16 0.00 0.00 0.00 0.00 60.65 59.95 1xbx s ILE 32 Cb -0.13 -3.31 -0.04 0.00 0.01 0.00 0.00 42.46 38.99 1xbx s ILE 32 CO 0.01 0.08 0.40 -0.70 0.00 0.00 0.00 174.94 174.73 1xbx s GLU 33 N 1.60 4.22 -0.71 2.79 2.12 0.26 -1.57 118.70 127.41 1xbx s GLU 33 Ca 0.04 0.24 -0.27 0.00 0.36 0.00 0.00 54.97 55.34 1xbx s GLU 33 Cb -0.17 -3.50 0.03 0.00 0.26 0.00 0.00 34.13 30.75 1xbx s GLU 33 CO 0.06 0.05 1.28 0.08 -0.54 0.00 0.00 175.26 176.18 1xbx s VAL 34 N 1.03 3.76 0.91 3.70 1.01 0.58 -0.76 120.40 130.62 1xbx s VAL 34 Ca 0.20 0.48 -0.10 0.00 0.00 0.00 0.00 61.98 62.56 1xbx s VAL 34 Cb -0.14 -4.88 0.14 0.00 0.00 0.00 0.00 36.38 31.50 1xbx s VAL 34 CO 0.08 -1.77 1.12 -0.83 0.00 0.00 0.00 175.10 173.70 1xbx s GLY 35 N 3.69 1.67 0.31 4.51 0.00 -0.17 -1.19 107.32 116.14 1xbx s GLY 35 Ca 0.37 0.43 0.04 0.00 0.00 0.00 0.00 44.72 45.56 1xbx s GLY 35 CO 0.17 0.86 1.83 -0.84 0.00 0.00 0.00 173.10 175.12 1xbx h THR 36 N -1.77 0.85 -0.80 0.90 2.02 -1.83 -0.01 112.91 112.27 1xbx h THR 36 Ca -0.45 -0.30 0.04 0.00 0.77 0.00 0.00 66.41 66.47 1xbx h THR 36 Cb 1.27 -0.10 -0.05 0.00 -1.74 0.00 0.00 68.15 67.53 1xbx h THR 36 CO 0.45 0.16 0.50 0.40 0.37 0.00 0.00 175.52 177.40 1xbx h ILE 37 N 0.87 1.09 -0.13 3.11 1.08 -1.86 -0.66 117.51 121.02 1xbx h ILE 37 Ca 0.50 -0.33 -0.21 0.00 -0.39 0.00 0.00 64.86 64.43 1xbx h ILE 37 Cb 0.64 0.05 0.01 0.00 -3.07 0.00 0.00 36.82 34.44 1xbx h ILE 37 CO -0.28 0.18 -0.77 0.25 -0.69 0.00 0.00 178.15 176.84 1xbx h LEU 38 N 0.96 0.79 -0.89 1.44 5.85 -0.69 0.04 115.31 122.82 1xbx h LEU 38 Ca 0.33 -0.52 0.04 0.00 0.84 0.00 0.00 57.88 58.57 1xbx h LEU 38 Cb 0.06 -0.23 -0.05 0.00 0.37 0.00 0.00 40.66 40.80 1xbx h LEU 38 CO -0.13 1.30 0.57 0.00 -0.34 0.00 0.00 178.44 179.84 1xbx h VAL 40 N 1.09 1.46 -0.11 0.00 2.07 -1.05 0.21 116.25 119.92 1xbx h VAL 40 Ca 0.36 -2.56 -0.09 0.00 0.82 0.00 0.00 66.70 65.23 1xbx h VAL 40 Cb 0.04 2.45 0.00 0.00 -1.52 0.00 0.00 31.29 32.26 1xbx h VAL 40 CO -0.13 0.75 -0.30 1.23 0.02 0.00 0.00 177.57 179.15 1xbx h GLY 41 N 1.62 0.43 0.00 2.17 0.00 -0.59 -3.38 103.07 103.32 1xbx h GLY 41 Ca -0.06 -0.55 0.00 0.00 0.00 0.00 0.00 47.33 46.72 1xbx h GLY 41 CO 0.14 0.49 -0.79 1.18 0.00 0.00 0.00 176.54 177.57 1xbx n GLU 42 N -4.42 2.39 0.00 4.80 -0.58 -0.02 -4.93 120.64 117.88 1xbx n GLU 42 Ca -0.07 -0.02 0.00 0.00 -0.42 0.00 0.00 57.16 56.64 1xbx n GLU 42 Cb 0.48 -0.94 0.00 0.00 -0.57 0.00 0.00 31.44 30.41 1xbx n GLU 42 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1xbx n GLY 43 N 1.78 -1.33 0.14 0.62 0.00 0.73 -4.35 105.19 102.78 1xbx n GLY 43 Ca -0.00 -1.19 0.12 0.00 0.00 0.00 0.00 46.02 44.95 1xbx n GLY 43 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1xbx h VAL 44 N 0.00 0.00 -0.54 1.61 3.04 -1.92 -1.07 116.25 117.37 1xbx h VAL 44 Ca 0.00 -0.25 0.16 0.00 -1.01 0.00 0.00 66.70 65.60 1xbx h VAL 44 Cb 0.00 0.99 -0.02 0.00 -2.01 0.00 0.00 31.29 30.25 1xbx h VAL 44 CO 0.00 0.00 0.48 0.08 -1.01 0.00 0.00 177.57 177.12 1xbx h ARG 45 N 0.00 0.00 -0.85 4.17 0.11 -1.96 -1.10 114.38 114.74 1xbx h ARG 45 Ca 0.00 0.00 -0.03 0.00 0.10 0.00 0.00 59.98 60.05 1xbx h ARG 45 Cb 0.37 0.00 -0.04 0.00 1.11 0.00 0.00 29.97 31.41 1xbx h ARG 45 CO 0.00 0.00 0.42 0.00 0.10 0.00 0.00 179.97 180.49 1xbx h ALA 46 N 1.56 1.10 -0.10 0.08 0.00 -1.44 -0.08 119.26 120.38 1xbx h ALA 46 Ca 0.26 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1xbx h ALA 46 Cb 1.21 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 18.66 1xbx h ALA 46 CO -0.00 0.66 0.02 0.28 0.00 0.00 0.00 179.25 180.20 1xbx h VAL 47 N 1.21 1.22 -0.66 0.00 2.07 -1.41 -1.92 116.25 116.76 1xbx h VAL 47 Ca 0.29 -0.69 -0.04 0.00 0.82 0.00 0.00 66.70 67.08 1xbx h VAL 47 Cb 0.11 1.48 -0.03 0.00 -1.52 0.00 0.00 31.29 31.33 1xbx h VAL 47 CO -0.04 0.20 0.25 -0.09 0.02 0.00 0.00 177.57 177.91 1xbx h ARG 48 N -0.06 0.99 -0.19 1.57 2.43 -1.20 -1.34 114.38 116.58 1xbx h ARG 48 Ca 0.03 -0.19 -0.05 0.00 -0.81 0.00 0.00 59.98 58.96 1xbx h ARG 48 Cb 0.29 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.68 1xbx h ARG 48 CO 0.00 0.84 -0.09 -0.44 -1.51 0.00 0.00 179.97 178.77 1xbx h ASP 49 N 0.93 0.42 -0.18 -3.80 3.32 -1.01 -2.07 116.42 114.03 1xbx h ASP 49 Ca 0.22 -0.41 -0.16 0.00 0.02 0.00 0.00 57.03 56.69 1xbx h ASP 49 Cb 0.23 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.66 1xbx h ASP 49 CO -0.01 0.74 -0.48 -0.07 -1.72 0.00 0.00 179.24 177.69 1xbx h LEU 50 N 0.10 0.82 -1.18 1.55 3.38 -1.23 -2.08 115.31 116.66 1xbx h LEU 50 Ca 0.04 -0.41 -0.05 0.00 0.09 0.00 0.00 57.88 57.55 1xbx h LEU 50 Cb 0.58 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.08 1xbx h LEU 50 CO 0.03 1.16 -0.01 0.50 0.09 0.00 0.00 178.44 180.21 1xbx h LYS 51 N 0.60 0.55 -0.71 1.13 1.63 -1.22 -0.35 116.57 118.20 1xbx h LYS 51 Ca 0.03 -0.12 -0.06 0.00 -0.85 0.00 0.00 60.65 59.65 1xbx h LYS 51 Cb 1.05 -0.08 -0.03 0.00 -0.60 0.00 0.00 32.23 32.57 1xbx h LYS 51 CO 0.10 0.58 0.22 0.00 -3.45 0.00 0.00 179.45 176.91 1xbx h ALA 52 N 1.47 1.05 -0.24 5.00 0.00 -1.12 -1.45 119.26 123.98 1xbx h ALA 52 Ca 0.11 -0.22 -0.16 0.00 0.00 0.00 0.00 54.91 54.64 1xbx h ALA 52 Cb 0.35 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 1xbx h ALA 52 CO 0.01 0.64 -0.51 -0.07 0.00 0.00 0.00 179.25 179.32 1xbx h LEU 53 N 1.05 0.75 -5.53 0.00 3.38 -0.95 -3.38 115.31 110.63 1xbx h LEU 53 Ca 0.23 -0.39 -0.52 0.00 0.09 0.00 0.00 57.88 57.29 1xbx h LEU 53 Cb 0.29 -0.21 -0.41 0.00 0.09 0.00 0.00 40.66 40.42 1xbx h LEU 53 CO -0.01 1.13 -0.96 -1.22 0.09 0.00 0.00 178.44 177.48 1xbx n TYR 54 N -3.99 1.97 0.32 1.13 4.01 -0.18 -4.94 117.16 115.48 1xbx n TYR 54 Ca -0.03 -3.74 0.16 0.00 -0.16 0.00 0.00 57.90 54.13 1xbx n TYR 54 Cb 0.59 -0.42 0.66 0.00 -0.31 0.00 0.00 39.34 39.87 1xbx n TYR 54 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 1xbx h PRO 55 N 2.96 0.00 -0.00 -0.72 0.13 -1.46 -1.96 132.00 130.95 1xbx h PRO 55 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 1xbx h PRO 55 Cb 0.81 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.94 1xbx h PRO 55 CO 0.65 0.00 -0.12 -2.39 -0.23 0.00 0.00 178.00 175.91 1xbx n HIS 56 N -2.73 0.00 -4.02 1.56 1.44 -1.26 -4.86 115.22 105.35 1xbx n HIS 56 Ca 0.01 0.00 -0.26 0.00 -2.01 0.00 0.00 57.72 55.45 1xbx n HIS 56 Cb 0.24 -0.18 -0.04 0.00 0.12 0.00 0.00 29.99 30.13 1xbx n HIS 56 CO 0.00 0.00 0.00 0.15 -2.81 0.00 0.00 176.34 173.68 1xbx s LYS 57 N -2.48 3.15 0.03 -1.40 -0.14 -0.74 -5.07 119.74 113.09 1xbx s LYS 57 Ca 0.28 -0.73 -0.30 0.00 -1.36 0.00 0.00 55.97 53.86 1xbx s LYS 57 Cb 0.20 -2.80 -0.05 0.00 -1.68 0.00 0.00 37.83 33.50 1xbx s LYS 57 CO 0.48 0.51 1.15 0.42 -0.76 0.00 0.00 175.35 177.14 1xbx s ILE 58 N -1.72 4.26 -0.21 2.17 1.01 -1.19 -4.92 121.20 120.59 1xbx s ILE 58 Ca 0.33 1.61 -0.04 0.00 0.00 0.00 0.00 60.65 62.55 1xbx s ILE 58 Cb -0.11 -4.03 -0.02 0.00 0.01 0.00 0.00 42.46 38.31 1xbx s ILE 58 CO 0.26 0.11 -0.02 -0.69 0.00 0.00 0.00 174.94 174.59 1xbx s VAL 59 N 1.21 3.62 -0.16 2.92 1.01 -1.26 -0.78 120.40 126.96 1xbx s VAL 59 Ca 0.57 -0.42 -0.06 0.00 0.00 0.00 0.00 61.98 62.07 1xbx s VAL 59 Cb -0.27 -2.64 -0.04 0.00 0.00 0.00 0.00 36.38 33.43 1xbx s VAL 59 CO 0.28 0.42 0.03 -0.22 0.00 0.00 0.00 175.10 175.61 1xbx s LEU 60 N 1.31 3.64 -0.37 3.92 1.98 -0.61 -0.79 118.68 127.76 1xbx s LEU 60 Ca 0.04 0.04 -0.12 0.00 -2.89 0.00 0.00 54.13 51.19 1xbx s LEU 60 Cb -0.14 -1.90 0.02 0.00 0.66 0.00 0.00 46.19 44.82 1xbx s LEU 60 CO -0.01 0.20 0.24 0.00 -1.89 0.00 0.00 176.35 174.89 1xbx s ALA 61 N 0.20 3.37 -1.30 5.97 0.00 0.12 -0.31 121.76 129.81 1xbx s ALA 61 Ca 0.02 -1.64 -0.08 0.00 0.00 0.00 0.00 51.96 50.26 1xbx s ALA 61 Cb -0.13 -2.68 0.15 0.00 0.00 0.00 0.00 23.12 20.47 1xbx s ALA 61 CO 0.01 -1.30 2.07 -3.47 0.00 0.00 0.00 175.76 173.07 1xbx n ASP 62 N 5.06 6.26 0.20 0.00 2.03 -0.33 -2.58 116.55 127.19 1xbx n ASP 62 Ca -0.12 -3.12 0.09 0.00 0.52 0.00 0.00 54.79 52.16 1xbx n ASP 62 Cb 0.47 -1.43 0.18 0.00 -0.72 0.00 0.00 41.12 39.63 1xbx n ASP 62 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1xbx h ALA 63 N 5.30 0.89 -6.11 -1.67 0.00 -1.84 -3.19 119.26 112.64 1xbx h ALA 63 Ca 0.51 -0.18 -0.42 0.00 0.00 0.00 0.00 54.91 54.82 1xbx h ALA 63 Cb 0.50 -0.03 0.05 0.00 0.00 0.00 0.00 17.79 18.31 1xbx h ALA 63 CO 1.57 0.25 -0.83 1.63 0.00 0.00 0.00 179.25 181.86 1xbx n LYS 64 N -3.17 -4.83 -1.68 0.00 5.02 -1.01 -4.80 118.16 107.69 1xbx n LYS 64 Ca 0.03 0.61 -0.44 0.00 -2.02 0.00 0.00 58.31 56.49 1xbx n LYS 64 Cb 0.58 -5.14 -0.04 0.00 -0.02 0.00 0.00 35.03 30.41 1xbx n LYS 64 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 1xbx n ILE 65 N -4.28 0.39 0.33 -0.18 5.41 -0.62 -4.03 119.36 116.38 1xbx n ILE 65 Ca -0.30 -0.07 0.11 0.00 1.00 0.00 0.00 62.75 63.49 1xbx n ILE 65 Cb 0.68 -2.02 -0.06 0.00 -0.71 0.00 0.00 39.64 37.53 1xbx n ILE 65 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1xbx n ALA 66 N 5.67 3.16 0.00 -1.39 0.00 -1.26 -1.13 120.51 125.57 1xbx n ALA 66 Ca 0.19 -0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.20 1xbx n ALA 66 Cb 0.35 -0.91 0.00 0.00 0.00 0.00 0.00 19.45 18.89 1xbx n ALA 66 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1xbx n ASP 67 N -2.15 0.00 -2.86 0.00 2.03 -1.26 -4.40 116.55 107.90 1xbx n ASP 67 Ca -0.00 0.00 -0.15 0.00 0.52 0.00 0.00 54.79 55.16 1xbx n ASP 67 Cb 0.49 0.00 0.07 0.00 -0.72 0.00 0.00 41.12 40.96 1xbx n ASP 67 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1xbx n ALA 68 N -0.00 -1.38 -0.19 -1.67 0.00 -1.26 -4.83 120.51 111.17 1xbx n ALA 68 Ca 0.00 0.06 -0.03 0.00 0.00 0.00 0.00 53.44 53.48 1xbx n ALA 68 Cb 0.00 -2.69 0.08 0.00 0.00 0.00 0.00 19.45 16.84 1xbx n ALA 68 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1xbx h GLY 69 N -1.64 0.81 0.93 0.00 0.00 -1.89 -1.03 103.07 100.25 1xbx h GLY 69 Ca -0.45 -0.18 -0.05 0.00 0.00 0.00 0.00 47.33 46.65 1xbx h GLY 69 CO 0.40 0.09 0.03 0.50 0.00 0.00 0.00 176.54 177.56 1xbx h LYS 70 N 0.52 0.64 0.22 4.80 1.57 -1.83 -1.87 116.57 120.63 1xbx h LYS 70 Ca 0.26 -0.19 -0.01 0.00 -1.87 0.00 0.00 60.65 58.84 1xbx h LYS 70 Cb 0.21 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.45 1xbx h LYS 70 CO -0.20 0.72 -0.11 0.82 -0.57 0.00 0.00 179.45 180.12 1xbx h ILE 71 N 0.47 0.85 -0.42 1.86 2.04 -1.82 -1.57 117.51 118.91 1xbx h ILE 71 Ca 0.11 -0.55 -0.14 0.00 1.00 0.00 0.00 64.86 65.28 1xbx h ILE 71 Cb 0.41 1.17 -0.01 0.00 -0.74 0.00 0.00 36.82 37.65 1xbx h ILE 71 CO 0.01 0.12 -0.27 -0.07 0.00 0.00 0.00 178.15 177.94 1xbx h LEU 72 N -0.59 0.94 -0.41 1.44 3.38 -1.29 -1.50 115.31 117.28 1xbx h LEU 72 Ca -0.03 -0.37 -0.06 0.00 0.09 0.00 0.00 57.88 57.51 1xbx h LEU 72 Cb 0.43 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 1xbx h LEU 72 CO 0.05 1.15 0.04 0.77 0.09 0.00 0.00 178.44 180.54 1xbx h SER 73 N 0.77 0.68 -0.78 -0.43 4.64 -1.39 -2.37 113.55 114.66 1xbx h SER 73 Ca 0.09 -0.28 0.02 0.00 -0.47 0.00 0.00 61.79 61.15 1xbx h SER 73 Cb 0.84 -0.18 -0.04 0.00 -0.31 0.00 0.00 62.40 62.70 1xbx h SER 73 CO 0.07 0.79 0.52 -0.09 -0.87 0.00 0.00 176.83 177.25 1xbx h ARG 74 N 0.54 0.98 -0.44 4.77 2.43 -1.07 0.13 114.38 121.72 1xbx h ARG 74 Ca 0.12 -0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 59.22 1xbx h ARG 74 Cb 0.42 -0.22 -0.02 0.00 -0.42 0.00 0.00 29.97 29.72 1xbx h ARG 74 CO 0.01 0.65 0.23 0.52 -1.51 0.00 0.00 179.97 179.87 1xbx h MET 75 N 1.01 0.63 -0.39 0.20 2.86 -1.08 0.85 114.93 119.00 1xbx h MET 75 Ca 0.30 -0.08 -0.05 0.00 -2.06 0.00 0.00 59.70 57.82 1xbx h MET 75 Cb -0.03 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 31.49 1xbx h MET 75 CO -0.08 0.51 0.06 0.00 1.06 0.00 0.00 176.91 178.47 1xbx h PHE 77 N 0.48 0.58 0.00 0.00 0.04 -0.59 -2.09 116.94 115.36 1xbx h PHE 77 Ca 0.12 -0.18 -0.01 0.00 2.80 0.00 0.00 57.97 60.69 1xbx h PHE 77 Cb 0.36 -0.12 -0.00 0.00 2.20 0.00 0.00 35.95 38.39 1xbx h PHE 77 CO 0.02 0.86 -0.06 0.93 -0.60 0.00 0.00 178.31 179.47 1xbx h GLU 78 N 0.38 0.00 -0.07 1.51 5.08 -0.87 -0.57 114.58 120.05 1xbx h GLU 78 Ca 0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 1xbx h GLU 78 Cb 0.98 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.23 1xbx h GLU 78 CO 0.09 0.06 0.00 0.00 -1.00 0.00 0.00 179.01 178.16 1xbx n ALA 79 N -2.51 2.53 -0.99 3.43 0.00 -0.91 -4.92 120.51 117.14 1xbx n ALA 79 Ca -0.03 -0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.24 1xbx n ALA 79 Cb 0.14 -1.09 0.00 0.00 0.00 0.00 0.00 19.45 18.50 1xbx n ALA 79 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1xbx n ASN 80 N -0.35 -2.50 -4.75 0.00 5.03 -0.22 -2.88 115.26 109.59 1xbx n ASN 80 Ca 0.07 0.00 -0.39 0.00 0.87 0.00 0.00 54.58 55.14 1xbx n ASN 80 Cb 0.09 -0.45 0.04 0.00 -1.02 0.00 0.00 39.78 38.44 1xbx n ASN 80 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1xbx s ALA 81 N -2.00 2.92 -0.13 5.41 0.00 -0.84 -4.88 121.76 122.25 1xbx s ALA 81 Ca 0.00 1.38 -0.16 0.00 0.00 0.00 0.00 51.96 53.18 1xbx s ALA 81 Cb 0.00 -3.58 -0.26 0.00 0.00 0.00 0.00 23.12 19.29 1xbx s ALA 81 CO 0.00 -1.35 0.47 -0.44 0.00 0.00 0.00 175.76 174.44 1xbx h ASP 82 N 1.66 0.31 -4.53 0.00 3.32 -1.31 -3.43 116.42 112.44 1xbx h ASP 82 Ca -0.51 -0.81 -0.35 0.00 0.02 0.00 0.00 57.03 55.38 1xbx h ASP 82 Cb 1.29 -0.10 -0.20 0.00 0.22 0.00 0.00 39.33 40.54 1xbx h ASP 82 CO 0.58 1.62 -0.75 0.26 -1.72 0.00 0.00 179.24 179.23 1xbx s TRP 83 N -2.46 1.01 0.04 4.55 0.51 -0.84 -1.57 118.94 120.18 1xbx s TRP 83 Ca -0.22 -0.53 0.02 0.00 -2.12 0.00 0.00 56.10 53.26 1xbx s TRP 83 Cb 0.05 -0.57 -0.02 0.00 -0.81 0.00 0.00 33.47 32.11 1xbx s TRP 83 CO 0.73 0.00 -0.08 0.14 -0.51 0.00 0.00 176.95 177.24 1xbx s VAL 84 N -1.63 0.53 -0.04 4.03 -7.23 -0.87 -0.71 120.40 114.48 1xbx s VAL 84 Ca -0.02 -1.05 -0.03 0.00 -1.81 0.00 0.00 61.98 59.07 1xbx s VAL 84 Cb -0.08 -0.60 -0.04 0.00 0.56 0.00 0.00 36.38 36.22 1xbx s VAL 84 CO 0.01 -0.36 0.12 0.42 -0.31 0.00 0.00 175.10 174.98 1xbx s THR 85 N -1.34 5.13 -0.09 5.32 -4.23 -1.06 -1.15 115.64 118.22 1xbx s THR 85 Ca -0.10 -0.16 0.04 0.00 -1.18 0.00 0.00 61.69 60.30 1xbx s THR 85 Cb -0.10 -3.32 -0.00 0.00 1.34 0.00 0.00 72.50 70.42 1xbx s THR 85 CO 0.00 0.43 -0.23 -0.69 -0.54 0.00 0.00 174.62 173.59 1xbx s VAL 86 N -1.17 2.14 0.40 2.29 1.01 0.04 -1.59 120.40 123.51 1xbx s VAL 86 Ca 0.22 -1.00 -0.24 0.00 0.00 0.00 0.00 61.98 60.95 1xbx s VAL 86 Cb -0.12 -1.81 -0.09 0.00 0.00 0.00 0.00 36.38 34.36 1xbx s VAL 86 CO 0.12 0.56 1.09 -0.51 0.00 0.00 0.00 175.10 176.36 1xbx s ILE 87 N 0.20 3.54 0.51 2.22 1.10 -0.28 -0.44 121.20 128.05 1xbx s ILE 87 Ca -0.14 1.21 0.18 0.00 -0.51 0.00 0.00 60.65 61.39 1xbx s ILE 87 Cb -0.17 -3.65 0.32 0.00 0.15 0.00 0.00 42.46 39.12 1xbx s ILE 87 CO 0.07 0.04 2.07 0.00 -2.11 0.00 0.00 174.94 175.02 1xbx n ALA 90 N -1.41 0.66 -1.59 0.00 0.00 -0.75 -4.92 120.51 112.50 1xbx n ALA 90 Ca 0.09 0.27 -0.42 0.00 0.00 0.00 0.00 53.44 53.38 1xbx n ALA 90 Cb 0.29 -2.16 0.01 0.00 0.00 0.00 0.00 19.45 17.58 1xbx n ALA 90 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1xbx n ASP 91 N 0.48 1.00 0.17 0.00 2.03 -1.26 -4.85 116.55 114.10 1xbx n ASP 91 Ca 0.08 1.04 0.13 0.00 0.52 0.00 0.00 54.79 56.56 1xbx n ASP 91 Cb 0.38 -1.31 0.68 0.00 -0.72 0.00 0.00 41.12 40.16 1xbx n ASP 91 CO 0.00 0.00 0.00 -0.29 -1.92 0.00 0.00 177.20 174.99 1xbx h ILE 92 N 1.51 0.84 0.00 5.18 6.09 -1.97 0.25 117.51 129.41 1xbx h ILE 92 Ca -0.43 0.00 -0.05 0.00 -1.37 0.00 0.00 64.86 63.01 1xbx h ILE 92 Cb 1.35 0.89 -0.01 0.00 0.47 0.00 0.00 36.82 39.52 1xbx h ILE 92 CO 0.57 0.00 -0.22 0.78 -3.07 0.00 0.00 178.15 176.21 1xbx h ASN 93 N 0.00 0.00 -0.14 2.19 2.35 -1.99 -0.48 115.58 117.51 1xbx h ASN 93 Ca 0.10 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.82 1xbx h ASN 93 Cb 0.40 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.76 1xbx h ASN 93 CO -0.00 0.22 -0.00 0.74 -1.65 0.00 0.00 177.43 176.73 1xbx h THR 94 N 0.00 1.26 -0.50 2.81 2.02 -1.28 -1.03 112.91 116.18 1xbx h THR 94 Ca -0.00 -0.85 -0.01 0.00 0.77 0.00 0.00 66.41 66.31 1xbx h THR 94 Cb 0.69 1.54 -0.02 0.00 -1.74 0.00 0.00 68.15 68.62 1xbx h THR 94 CO 0.03 0.25 0.27 0.00 0.37 0.00 0.00 175.52 176.44 1xbx h ALA 95 N 0.75 0.64 -0.64 6.16 0.00 -1.43 -1.65 119.26 123.09 1xbx h ALA 95 Ca 0.04 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 1xbx h ALA 95 Cb 0.38 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 1xbx h ALA 95 CO 0.01 0.17 0.29 0.87 0.00 0.00 0.00 179.25 180.59 1xbx h LYS 96 N 0.67 0.94 -0.60 0.00 1.57 -1.09 -0.88 116.57 117.17 1xbx h LYS 96 Ca 0.18 -0.15 -0.05 0.00 -1.87 0.00 0.00 60.65 58.75 1xbx h LYS 96 Cb 0.06 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.18 1xbx h LYS 96 CO -0.03 0.76 0.16 0.78 -0.57 0.00 0.00 179.45 180.56 1xbx h GLY 97 N 0.89 1.02 1.28 3.86 0.00 -1.02 -0.79 103.07 108.31 1xbx h GLY 97 Ca 0.22 -0.63 -0.10 0.00 0.00 0.00 0.00 47.33 46.82 1xbx h GLY 97 CO -0.02 0.58 -0.14 0.00 0.00 0.00 0.00 176.54 176.96 1xbx h ALA 98 N 1.05 0.91 -0.52 3.60 0.00 -1.05 -2.37 119.26 120.87 1xbx h ALA 98 Ca 0.19 -0.34 -0.12 0.00 0.00 0.00 0.00 54.91 54.64 1xbx h ALA 98 Cb 0.32 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1xbx h ALA 98 CO -0.00 0.63 -0.14 1.25 0.00 0.00 0.00 179.25 180.99 1xbx h LEU 99 N 0.75 1.00 -0.78 0.00 5.85 -0.97 0.41 115.31 121.58 1xbx h LEU 99 Ca 0.12 -0.34 0.00 0.00 0.84 0.00 0.00 57.88 58.50 1xbx h LEU 99 Cb 0.65 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 41.37 1xbx h LEU 99 CO 0.05 1.13 0.50 -0.78 -0.34 0.00 0.00 178.44 179.00 1xbx h ASP 100 N 0.88 0.91 -0.27 1.25 3.58 -0.93 -0.60 116.42 121.24 1xbx h ASP 100 Ca 0.13 -0.04 -0.07 0.00 0.42 0.00 0.00 57.03 57.47 1xbx h ASP 100 Cb 0.70 -0.23 -0.01 0.00 1.72 0.00 0.00 39.33 41.52 1xbx h ASP 100 CO 0.05 0.68 -0.10 0.58 -2.88 0.00 0.00 179.24 177.57 1xbx h VAL 101 N 1.06 1.29 -0.74 2.25 2.07 -1.20 -2.87 116.25 118.11 1xbx h VAL 101 Ca 0.28 -1.15 0.12 0.00 0.82 0.00 0.00 66.70 66.77 1xbx h VAL 101 Cb -0.09 1.48 -0.08 0.00 -1.52 0.00 0.00 31.29 31.07 1xbx h VAL 101 CO -0.06 0.36 0.34 0.00 0.02 0.00 0.00 177.57 178.23 1xbx h ALA 102 N 0.76 1.05 -0.54 1.67 0.00 -0.28 -0.90 119.26 121.01 1xbx h ALA 102 Ca 0.06 0.08 0.03 0.00 0.00 0.00 0.00 54.91 55.09 1xbx h ALA 102 Cb 0.59 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.36 1xbx h ALA 102 CO 0.03 -0.12 0.36 0.87 0.00 0.00 0.00 179.25 180.39 1xbx h LYS 103 N 0.54 0.59 0.00 0.00 1.57 -0.92 0.12 116.57 118.47 1xbx h LYS 103 Ca 0.39 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 59.13 1xbx h LYS 103 Cb 0.51 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 32.69 1xbx h LYS 103 CO -0.34 0.39 -0.03 0.93 -0.57 0.00 0.00 179.45 179.83 1xbx h GLU 104 N 0.61 0.00 -0.23 3.15 5.08 -0.98 -2.65 114.58 119.56 1xbx h GLU 104 Ca 0.22 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.58 1xbx h GLU 104 Cb 0.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.36 1xbx h GLU 104 CO -0.06 0.03 0.00 1.19 -1.00 0.00 0.00 179.01 179.18 1xbx n PHE 105 N -4.22 0.30 -3.72 4.33 3.01 -0.68 -4.98 117.46 111.50 1xbx n PHE 105 Ca -0.03 -0.22 -0.28 0.00 1.01 0.00 0.00 57.45 57.93 1xbx n PHE 105 Cb 0.12 -0.01 0.03 0.00 -0.01 0.00 0.00 39.48 39.61 1xbx n PHE 105 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 1xbx n ASN 106 N 0.94 -5.00 -0.56 4.37 3.02 -0.62 -5.00 115.26 112.41 1xbx n ASN 106 Ca 0.13 -0.65 0.00 0.00 -0.03 0.00 0.00 54.58 54.02 1xbx n ASN 106 Cb 0.45 -4.00 0.00 0.00 -0.61 0.00 0.00 39.78 35.62 1xbx n ASN 106 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1xbx n GLY 107 N -1.64 3.48 3.47 7.41 0.00 0.33 -5.00 105.19 113.23 1xbx n GLY 107 Ca 0.02 -2.07 -0.09 0.00 0.00 0.00 0.00 46.02 43.87 1xbx n GLY 107 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1xbx s ASP 108 N -0.54 -0.12 0.01 1.61 -1.08 -0.61 -4.39 116.67 111.55 1xbx s ASP 108 Ca 0.00 -0.70 0.08 0.00 -0.52 0.00 0.00 52.55 51.41 1xbx s ASP 108 Cb 0.00 0.53 -0.02 0.00 -1.46 0.00 0.00 42.92 41.97 1xbx s ASP 108 CO 0.00 -1.01 -0.24 -0.69 0.52 0.00 0.00 175.17 173.75 1xbx s VAL 109 N -3.93 1.92 0.01 1.11 1.01 -1.26 -2.05 120.40 117.20 1xbx s VAL 109 Ca 0.14 -1.17 0.08 0.00 0.00 0.00 0.00 61.98 61.04 1xbx s VAL 109 Cb 0.01 -1.62 -0.02 0.00 0.00 0.00 0.00 36.38 34.74 1xbx s VAL 109 CO 0.00 0.42 -0.26 -1.10 0.00 0.00 0.00 175.10 174.16 1xbx s GLN 110 N -0.89 1.94 -0.26 2.72 -0.21 -0.30 -4.22 119.66 118.44 1xbx s GLN 110 Ca 0.10 -0.98 -0.17 0.00 0.02 0.00 0.00 55.36 54.32 1xbx s GLN 110 Cb -0.09 -1.97 -0.03 0.00 1.00 0.00 0.00 33.01 31.92 1xbx s GLN 110 CO 0.01 0.53 0.47 0.42 -2.12 0.00 0.00 175.29 174.59 1xbx s ILE 111 N -0.68 5.11 -0.08 1.08 -1.09 -0.72 -0.78 121.20 124.04 1xbx s ILE 111 Ca 0.10 0.78 -0.23 0.00 -2.23 0.00 0.00 60.65 59.07 1xbx s ILE 111 Cb -0.10 -3.78 -0.03 0.00 -1.58 0.00 0.00 42.46 36.96 1xbx s ILE 111 CO 0.00 0.12 0.70 -0.62 -1.23 0.00 0.00 174.94 173.92 1xbx s ASP 112 N 1.52 6.97 -0.43 3.58 -1.08 0.42 -0.78 116.67 126.87 1xbx s ASP 112 Ca 0.19 1.17 0.05 0.00 -0.52 0.00 0.00 52.55 53.44 1xbx s ASP 112 Cb -0.16 -2.41 0.60 0.00 -1.46 0.00 0.00 42.92 39.50 1xbx s ASP 112 CO 0.09 -0.14 1.81 0.18 0.52 0.00 0.00 175.17 177.63 1xbx n LEU 113 N 3.91 6.18 -4.71 -1.34 4.77 0.16 -1.34 117.00 124.64 1xbx n LEU 113 Ca -0.01 -3.75 -0.42 0.00 -0.03 0.00 0.00 56.01 51.80 1xbx n LEU 113 Cb 0.51 -0.80 -0.03 0.00 -2.33 0.00 0.00 43.42 40.78 1xbx n LEU 113 CO 0.47 1.17 1.08 -0.89 -1.33 0.00 0.00 177.39 177.89 1xbx s THR 114 N -3.47 3.29 0.00 -5.08 2.01 -1.26 -4.48 115.64 106.64 1xbx s THR 114 Ca 0.55 0.91 0.00 0.00 0.31 0.00 0.00 61.69 63.46 1xbx s THR 114 Cb 0.46 -3.59 0.00 0.00 0.01 0.00 0.00 72.50 69.39 1xbx s THR 114 CO 0.07 0.07 0.00 0.61 -0.69 0.00 0.00 174.62 174.68 1xbx n GLY 115 N 3.52 0.09 3.65 4.40 0.00 -1.26 -4.74 105.19 110.84 1xbx n GLY 115 Ca 0.12 -1.07 -0.40 0.00 0.00 0.00 0.00 46.02 44.66 1xbx n GLY 115 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1xbx s TYR 116 N 0.00 3.34 0.27 1.61 5.04 -1.26 -5.02 117.35 121.33 1xbx s TYR 116 Ca 0.00 0.94 -0.11 0.00 -2.44 0.00 0.00 57.07 55.46 1xbx s TYR 116 Cb 0.00 -2.85 -0.00 0.00 0.35 0.00 0.00 41.96 39.45 1xbx s TYR 116 CO 0.00 -0.25 0.48 1.67 -1.34 0.00 0.00 175.55 176.11 1xbx s TRP 117 N 2.21 0.50 0.19 4.97 1.48 -1.26 -4.59 118.94 122.44 1xbx s TRP 117 Ca 0.29 -0.85 0.07 0.00 -1.06 0.00 0.00 56.10 54.55 1xbx s TRP 117 Cb -0.16 0.14 -0.05 0.00 -1.16 0.00 0.00 33.47 32.25 1xbx s TRP 117 CO 0.10 -1.03 -0.14 0.95 -4.06 0.00 0.00 176.95 172.76 1xbx s THR 118 N -3.78 1.67 0.37 0.66 -4.23 -1.26 -5.04 115.64 104.03 1xbx s THR 118 Ca 0.24 -2.16 0.18 0.00 -1.18 0.00 0.00 61.69 58.77 1xbx s THR 118 Cb -0.00 -1.99 0.17 0.00 1.34 0.00 0.00 72.50 72.02 1xbx s THR 118 CO 0.11 -0.58 1.91 -0.50 -0.54 0.00 0.00 174.62 175.02 1xbx h TRP 119 N 2.67 0.00 -0.56 3.99 4.06 -2.03 -1.95 115.95 122.13 1xbx h TRP 119 Ca -0.38 0.00 -0.05 0.00 2.06 0.00 0.00 58.89 60.52 1xbx h TRP 119 Cb 1.22 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 29.35 1xbx h TRP 119 CO 0.71 0.27 0.15 1.49 -3.56 0.00 0.00 178.44 177.50 1xbx h GLU 120 N 0.00 0.89 -0.91 0.49 4.81 -1.99 -1.08 114.58 116.79 1xbx h GLU 120 Ca -0.00 -0.21 -0.01 0.00 -0.13 0.00 0.00 59.36 59.01 1xbx h GLU 120 Cb 0.55 -0.12 -0.04 0.00 0.63 0.00 0.00 28.75 29.76 1xbx h GLU 120 CO 0.04 0.82 0.52 1.96 -0.73 0.00 0.00 179.01 181.61 1xbx h GLN 121 N 0.79 1.25 -0.79 1.92 4.20 -1.84 -1.52 115.11 119.13 1xbx h GLN 121 Ca 0.18 -0.13 0.01 0.00 0.06 0.00 0.00 58.65 58.77 1xbx h GLN 121 Cb 0.32 -0.25 -0.04 0.00 0.30 0.00 0.00 27.48 27.81 1xbx h GLN 121 CO -0.00 0.90 0.52 0.00 -0.67 0.00 0.00 178.83 179.58 1xbx h ALA 122 N 1.28 1.01 -0.70 3.87 0.00 -0.92 0.50 119.26 124.31 1xbx h ALA 122 Ca 0.32 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.15 1xbx h ALA 122 Cb -0.01 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.44 1xbx h ALA 122 CO -0.06 0.39 0.31 0.37 0.00 0.00 0.00 179.25 180.26 1xbx h GLN 123 N 1.05 1.01 -0.53 0.00 5.75 -0.86 -2.06 115.11 119.47 1xbx h GLN 123 Ca 0.29 -0.15 0.00 0.00 -0.15 0.00 0.00 58.65 58.65 1xbx h GLN 123 Cb -0.09 -0.18 -0.03 0.00 1.07 0.00 0.00 27.48 28.25 1xbx h GLN 123 CO -0.07 0.81 0.35 1.96 -2.65 0.00 0.00 178.83 179.22 1xbx h GLN 124 N 1.00 0.70 -0.67 1.69 4.20 -0.14 -1.09 115.11 120.80 1xbx h GLN 124 Ca 0.24 -0.04 0.01 0.00 0.06 0.00 0.00 58.65 58.91 1xbx h GLN 124 Cb 0.15 -0.16 -0.03 0.00 0.30 0.00 0.00 27.48 27.74 1xbx h GLN 124 CO -0.03 0.46 0.44 -1.49 -0.67 0.00 0.00 178.83 177.55 1xbx h TRP 125 N 0.72 0.83 -0.30 2.96 6.55 -0.63 -0.55 115.95 125.54 1xbx h TRP 125 Ca 0.19 0.02 -0.00 0.00 0.95 0.00 0.00 58.89 60.05 1xbx h TRP 125 Cb -0.08 -0.28 -0.01 0.00 -0.86 0.00 0.00 29.16 27.92 1xbx h TRP 125 CO -0.04 0.52 0.18 -0.09 -1.05 0.00 0.00 178.44 177.97 1xbx h ARG 126 N 0.90 0.41 0.00 0.49 9.65 -1.06 -1.15 114.38 123.62 1xbx h ARG 126 Ca 0.25 -0.04 -0.03 0.00 -1.10 0.00 0.00 59.98 59.06 1xbx h ARG 126 Cb -0.10 -0.09 -0.00 0.00 -1.39 0.00 0.00 29.97 28.39 1xbx h ARG 126 CO -0.06 0.32 -0.13 -0.44 2.80 0.00 0.00 179.97 182.46 1xbx h ASP 127 N 0.39 0.00 0.74 -3.80 3.32 -0.84 -0.75 116.42 115.47 1xbx h ASP 127 Ca 0.11 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.16 1xbx h ASP 127 Cb 0.01 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.56 1xbx h ASP 127 CO -0.02 0.13 0.00 0.00 -1.72 0.00 0.00 179.24 177.63 1xbx n ALA 128 N -2.46 2.36 -0.17 3.45 0.00 -0.25 -4.92 120.51 118.53 1xbx n ALA 128 Ca -0.02 -0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.30 1xbx n ALA 128 Cb 0.21 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.20 1xbx n ALA 128 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xbx n GLY 129 N 1.27 0.91 3.70 0.00 0.00 -0.29 -4.95 105.19 105.82 1xbx n GLY 129 Ca 0.10 -0.06 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 1xbx n GLY 129 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xbx s ILE 130 N -2.00 3.78 -1.05 -0.61 -1.09 -0.49 -4.94 121.20 114.81 1xbx s ILE 130 Ca 0.00 1.20 0.09 0.00 -2.23 0.00 0.00 60.65 59.71 1xbx s ILE 130 Cb 0.00 -3.77 0.10 0.00 -1.58 0.00 0.00 42.46 37.21 1xbx s ILE 130 CO 0.00 0.03 0.86 0.61 -1.23 0.00 0.00 174.94 175.20 1xbx n GLY 131 N 3.51 0.02 2.88 6.18 0.00 -1.26 -4.41 105.19 112.12 1xbx n GLY 131 Ca 0.12 -0.26 -0.14 0.00 0.00 0.00 0.00 46.02 45.74 1xbx n GLY 131 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1xbx s GLN 132 N -0.79 0.15 0.11 1.61 -0.21 -1.26 -0.83 119.66 118.43 1xbx s GLN 132 Ca 0.12 -0.03 0.03 0.00 0.02 0.00 0.00 55.36 55.50 1xbx s GLN 132 Cb 0.08 -0.18 -0.04 0.00 1.00 0.00 0.00 33.01 33.87 1xbx s GLN 132 CO 0.11 0.01 -0.09 0.14 -2.12 0.00 0.00 175.29 173.34 1xbx s VAL 133 N 0.14 0.92 -0.33 1.09 -7.23 -0.85 -1.75 120.40 112.39 1xbx s VAL 133 Ca -0.01 -1.78 -0.03 0.00 -1.81 0.00 0.00 61.98 58.35 1xbx s VAL 133 Cb -0.03 -1.51 0.06 0.00 0.56 0.00 0.00 36.38 35.46 1xbx s VAL 133 CO -0.00 -0.67 0.06 -0.69 -0.31 0.00 0.00 175.10 173.49 1xbx s VAL 134 N -2.87 3.19 -0.20 1.32 1.01 0.04 -0.74 120.40 122.14 1xbx s VAL 134 Ca 0.09 -1.48 -0.28 0.00 0.00 0.00 0.00 61.98 60.31 1xbx s VAL 134 Cb -0.00 -2.90 0.00 0.00 0.00 0.00 0.00 36.38 33.48 1xbx s VAL 134 CO -0.01 -0.24 0.98 -0.47 0.00 0.00 0.00 175.10 175.36 1xbx s TYR 135 N 1.25 3.38 -0.15 5.22 6.14 0.12 -0.66 117.35 132.64 1xbx s TYR 135 Ca -0.02 1.42 -0.04 0.00 0.64 0.00 0.00 57.07 59.07 1xbx s TYR 135 Cb -0.20 -3.20 0.06 0.00 0.42 0.00 0.00 41.96 39.04 1xbx s TYR 135 CO -0.01 -0.39 0.12 -1.58 0.64 0.00 0.00 175.55 174.33 1xbx s HIS 136 N 2.81 0.04 -0.08 4.97 2.46 -1.26 -1.50 115.29 122.72 1xbx s HIS 136 Ca 0.43 -0.04 -0.30 0.00 0.47 0.00 0.00 55.06 55.62 1xbx s HIS 136 Cb -0.16 -0.55 -0.03 0.00 -0.13 0.00 0.00 32.58 31.71 1xbx s HIS 136 CO 0.09 -0.47 1.27 0.50 -2.47 0.00 0.00 174.74 173.66 1xbx s ARG 137 N 2.20 4.29 0.21 2.88 3.52 -0.46 -4.21 118.95 127.39 1xbx s ARG 137 Ca 0.04 1.73 -0.32 0.00 -0.13 0.00 0.00 55.73 57.05 1xbx s ARG 137 Cb -0.15 -3.65 -0.13 0.00 -1.56 0.00 0.00 34.95 29.46 1xbx s ARG 137 CO -0.09 -0.57 1.59 0.45 -0.81 0.00 0.00 175.30 175.88 1xbx n SER 138 N 5.78 3.44 0.23 -2.12 2.88 -1.26 -4.42 113.62 118.15 1xbx n SER 138 Ca 0.12 1.10 0.08 0.00 -1.33 0.00 0.00 58.87 58.84 1xbx n SER 138 Cb 0.45 -1.50 0.56 0.00 -0.75 0.00 0.00 64.21 62.97 1xbx n SER 138 CO 0.00 0.00 0.00 -0.37 -1.23 0.00 0.00 175.04 173.44 1xbx h VAL 139 N 3.52 0.90 -0.07 2.46 -1.51 -1.95 0.48 116.25 120.07 1xbx h VAL 139 Ca -0.45 -0.79 -0.23 0.00 -1.23 0.00 0.00 66.70 64.01 1xbx h VAL 139 Cb 1.24 1.46 0.01 0.00 -2.13 0.00 0.00 31.29 31.86 1xbx h VAL 139 CO 0.87 0.21 -0.86 0.44 -1.23 0.00 0.00 177.57 176.99 1xbx h ASP 140 N 0.00 0.76 -0.50 4.19 3.32 -1.99 -1.76 116.42 120.44 1xbx h ASP 140 Ca -0.00 -0.54 -0.03 0.00 0.02 0.00 0.00 57.03 56.48 1xbx h ASP 140 Cb 0.44 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.74 1xbx h ASP 140 CO 0.03 1.33 0.20 0.00 -1.72 0.00 0.00 179.24 179.08 1xbx h ALA 141 N 0.64 0.66 -0.53 3.45 0.00 -1.80 -2.03 119.26 119.64 1xbx h ALA 141 Ca -0.07 -0.15 0.10 0.00 0.00 0.00 0.00 54.91 54.78 1xbx h ALA 141 Cb 1.48 -0.20 -0.08 0.00 0.00 0.00 0.00 17.79 19.00 1xbx h ALA 141 CO 0.16 0.26 0.09 0.37 0.00 0.00 0.00 179.25 180.14 1xbx h GLN 142 N 0.67 0.22 0.00 0.00 4.15 -0.87 -1.27 115.11 118.01 1xbx h GLN 142 Ca 0.17 -0.01 -0.04 0.00 0.77 0.00 0.00 58.65 59.53 1xbx h GLN 142 Cb 0.19 -0.05 -0.01 0.00 0.21 0.00 0.00 27.48 27.83 1xbx h GLN 142 CO -0.01 0.15 -0.21 0.00 -1.93 0.00 0.00 178.83 176.82 1xbx h ALA 143 N 1.43 1.38 -0.16 3.38 0.00 -0.94 -0.98 119.26 123.37 1xbx h ALA 143 Ca 0.27 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1xbx h ALA 143 Cb 0.38 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1xbx h ALA 143 CO -0.36 0.26 0.00 0.00 0.00 0.00 0.00 179.25 179.15 1xbx n ALA 144 N -2.37 2.50 -0.02 0.00 0.00 -0.58 -4.91 120.51 115.13 1xbx n ALA 144 Ca -0.02 -0.34 0.00 0.00 0.00 0.00 0.00 53.44 53.08 1xbx n ALA 144 Cb 0.30 -1.06 0.00 0.00 0.00 0.00 0.00 19.45 18.69 1xbx n ALA 144 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xbx n GLY 145 N 0.88 0.81 3.69 0.00 0.00 -0.37 -5.06 105.19 105.14 1xbx n GLY 145 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 1xbx n GLY 145 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xbx s VAL 146 N -2.01 3.99 0.23 1.61 1.01 -0.59 -4.98 120.40 119.66 1xbx s VAL 146 Ca 0.00 1.35 0.05 0.00 0.00 0.00 0.00 61.98 63.39 1xbx s VAL 146 Cb 0.00 -3.87 -0.03 0.00 0.00 0.00 0.00 36.38 32.48 1xbx s VAL 146 CO 0.00 0.01 0.29 0.00 0.00 0.00 0.00 175.10 175.40 1xbx s ALA 147 N 2.17 3.81 0.37 5.51 0.00 -1.26 -4.29 121.76 128.07 1xbx s ALA 147 Ca 0.60 -1.28 -0.28 0.00 0.00 0.00 0.00 51.96 51.00 1xbx s ALA 147 Cb -0.28 -1.58 -0.10 0.00 0.00 0.00 0.00 23.12 21.16 1xbx s ALA 147 CO 0.25 0.28 1.37 -1.58 0.00 0.00 0.00 175.76 176.07 1xbx s TRP 148 N -2.00 2.81 0.37 0.00 0.52 -1.26 -5.02 118.94 114.36 1xbx s TRP 148 Ca 0.34 1.33 -0.07 0.00 0.02 0.00 0.00 56.10 57.72 1xbx s TRP 148 Cb -0.09 -3.79 0.03 0.00 -1.15 0.00 0.00 33.47 28.46 1xbx s TRP 148 CO 0.27 -2.32 0.60 0.20 0.02 0.00 0.00 176.95 175.73 1xbx s GLY 149 N -0.45 1.14 0.35 0.98 0.00 -1.26 -5.06 107.32 103.02 1xbx s GLY 149 Ca 0.53 -1.28 0.10 0.00 0.00 0.00 0.00 44.72 44.08 1xbx s GLY 149 CO 0.55 -0.76 1.80 0.83 0.00 0.00 0.00 173.10 175.53 1xbx h GLU 150 N 2.05 0.10 -0.11 2.90 4.39 -2.00 -1.45 114.58 120.46 1xbx h GLU 150 Ca -0.30 -0.04 -0.02 0.00 0.34 0.00 0.00 59.36 59.34 1xbx h GLU 150 Cb 1.24 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.88 1xbx h GLU 150 CO 0.40 0.44 -0.01 0.00 -1.16 0.00 0.00 179.01 178.68 1xbx h ALA 151 N 1.56 1.79 -0.33 3.43 0.00 -1.99 -0.85 119.26 122.86 1xbx h ALA 151 Ca 0.01 -0.08 -0.08 0.00 0.00 0.00 0.00 54.91 54.76 1xbx h ALA 151 Cb 0.66 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 1xbx h ALA 151 CO 0.05 0.17 -0.10 -0.44 0.00 0.00 0.00 179.25 178.92 1xbx h ASP 152 N 0.15 0.67 -0.61 0.00 3.32 -1.68 -1.70 116.42 116.56 1xbx h ASP 152 Ca 0.04 -0.38 -0.03 0.00 0.02 0.00 0.00 57.03 56.69 1xbx h ASP 152 Cb 0.13 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 39.47 1xbx h ASP 152 CO 0.00 0.89 0.28 0.40 -1.72 0.00 0.00 179.24 179.09 1xbx h ILE 153 N 0.44 1.22 -0.57 0.35 1.08 -1.19 0.42 117.51 119.26 1xbx h ILE 153 Ca 0.08 -0.63 -0.00 0.00 -0.39 0.00 0.00 64.86 63.92 1xbx h ILE 153 Cb 0.61 0.51 -0.03 0.00 -3.07 0.00 0.00 36.82 34.84 1xbx h ILE 153 CO 0.04 0.25 0.34 0.74 -0.69 0.00 0.00 178.15 178.83 1xbx h THR 154 N 0.83 1.17 -0.49 -0.27 2.02 -1.16 -1.14 112.91 113.87 1xbx h THR 154 Ca 0.21 -0.38 -0.12 0.00 0.77 0.00 0.00 66.41 66.89 1xbx h THR 154 Cb 0.14 0.40 -0.02 0.00 -1.74 0.00 0.00 68.15 66.93 1xbx h THR 154 CO -0.02 0.17 -0.17 0.00 0.37 0.00 0.00 175.52 175.87 1xbx h ALA 155 N 1.17 0.76 -0.25 6.16 0.00 -0.95 -1.13 119.26 125.02 1xbx h ALA 155 Ca 0.20 -0.37 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 1xbx h ALA 155 Cb -0.02 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 1xbx h ALA 155 CO -0.04 0.67 0.13 0.82 0.00 0.00 0.00 179.25 180.83 1xbx h ILE 156 N 0.85 1.12 -0.87 0.00 2.04 -0.68 -0.91 117.51 119.06 1xbx h ILE 156 Ca 0.12 -0.33 0.02 0.00 1.00 0.00 0.00 64.86 65.66 1xbx h ILE 156 Cb 0.74 0.89 -0.05 0.00 -0.74 0.00 0.00 36.82 37.67 1xbx h ILE 156 CO 0.06 0.12 0.58 0.11 0.00 0.00 0.00 178.15 179.01 1xbx h LYS 157 N 0.28 1.13 -0.36 2.37 1.57 -1.00 -0.44 116.57 120.11 1xbx h LYS 157 Ca 0.09 -0.07 0.01 0.00 -1.87 0.00 0.00 60.65 58.81 1xbx h LYS 157 Cb 0.08 -0.25 -0.02 0.00 0.08 0.00 0.00 32.23 32.11 1xbx h LYS 157 CO -0.01 0.75 0.22 -0.09 -0.57 0.00 0.00 179.45 179.74 1xbx h ARG 158 N 1.16 0.43 -0.48 3.15 2.43 -0.88 0.56 114.38 120.76 1xbx h ARG 158 Ca 0.33 -0.03 0.01 0.00 -0.81 0.00 0.00 59.98 59.48 1xbx h ARG 158 Cb -0.10 -0.10 -0.03 0.00 -0.42 0.00 0.00 29.97 29.33 1xbx h ARG 158 CO -0.08 0.29 0.31 -0.07 -1.51 0.00 0.00 179.97 178.90 1xbx h LEU 159 N 0.45 0.52 -0.70 3.80 3.38 -0.87 -1.55 115.31 120.34 1xbx h LEU 159 Ca 0.14 -0.01 0.02 0.00 0.09 0.00 0.00 57.88 58.12 1xbx h LEU 159 Cb -0.01 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 40.58 1xbx h LEU 159 CO -0.06 0.37 0.45 -1.28 0.09 0.00 0.00 178.44 178.01 1xbx h SER 160 N 0.62 0.76 0.27 -0.43 0.87 -0.75 -1.97 113.55 112.92 1xbx h SER 160 Ca 0.18 -0.01 -0.03 0.00 -1.23 0.00 0.00 61.79 60.70 1xbx h SER 160 Cb -0.05 -0.18 -0.00 0.00 -0.44 0.00 0.00 62.40 61.74 1xbx h SER 160 CO -0.05 0.53 -0.13 0.44 -0.53 0.00 0.00 176.83 177.10 1xbx h ASP 161 N 0.90 0.00 0.70 6.23 3.32 -0.46 -0.75 116.42 126.35 1xbx h ASP 161 Ca 0.27 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.32 1xbx h ASP 161 Cb -0.04 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.51 1xbx h ASP 161 CO -0.08 0.13 0.00 0.23 -1.72 0.00 0.00 179.24 177.79 1xbx n MET 162 N -3.85 0.03 0.00 3.56 2.81 -0.62 -4.90 117.12 114.15 1xbx n MET 162 Ca -0.02 0.21 0.00 0.00 -1.81 0.00 0.00 57.70 56.07 1xbx n MET 162 Cb 0.22 -1.56 0.00 0.00 -0.71 0.00 0.00 33.22 31.18 1xbx n MET 162 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1xbx n GLY 163 N 0.43 0.72 3.76 3.03 0.00 -0.29 -5.04 105.19 107.80 1xbx n GLY 163 Ca 0.04 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.67 1xbx n GLY 163 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1xbx s PHE 164 N -2.00 3.84 -0.08 1.61 0.40 -1.10 -4.92 117.98 115.72 1xbx s PHE 164 Ca 0.00 1.85 -0.30 0.00 -0.60 0.00 0.00 56.93 57.88 1xbx s PHE 164 Cb 0.00 -3.03 -0.03 0.00 0.51 0.00 0.00 43.02 40.47 1xbx s PHE 164 CO 0.00 0.19 1.19 0.15 0.70 0.00 0.00 175.22 177.44 1xbx s LYS 165 N -1.42 4.34 -0.21 0.44 1.02 -0.01 -4.25 119.74 119.65 1xbx s LYS 165 Ca 0.44 1.63 -0.08 0.00 0.02 0.00 0.00 55.97 57.98 1xbx s LYS 165 Cb -0.26 -3.59 -0.04 0.00 -0.52 0.00 0.00 37.83 33.42 1xbx s LYS 165 CO 0.32 -0.48 0.09 0.08 -0.92 0.00 0.00 175.35 174.45 1xbx s VAL 166 N 2.42 4.86 -0.09 3.17 1.01 -1.26 -2.00 120.40 128.51 1xbx s VAL 166 Ca 0.55 0.00 -0.09 0.00 0.00 0.00 0.00 61.98 62.44 1xbx s VAL 166 Cb -0.23 -3.23 -0.04 0.00 0.00 0.00 0.00 36.38 32.87 1xbx s VAL 166 CO 0.20 0.40 0.20 -0.89 0.00 0.00 0.00 175.10 175.01 1xbx s THR 167 N 0.81 5.40 -0.12 3.92 2.01 0.08 -0.72 115.64 127.02 1xbx s THR 167 Ca 0.05 0.36 0.00 0.00 0.31 0.00 0.00 61.69 62.41 1xbx s THR 167 Cb -0.13 -3.47 -0.02 0.00 0.01 0.00 0.00 72.50 68.89 1xbx s THR 167 CO 0.02 0.61 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.75 1xbx s VAL 168 N -1.02 3.17 0.08 3.82 1.01 -0.29 0.10 120.40 127.27 1xbx s VAL 168 Ca 0.17 -0.63 -0.14 0.00 0.00 0.00 0.00 61.98 61.37 1xbx s VAL 168 Cb -0.13 -2.32 0.02 0.00 0.00 0.00 0.00 36.38 33.95 1xbx s VAL 168 CO 0.06 0.54 0.33 0.00 0.00 0.00 0.00 175.10 176.03 1xbx s ALA 169 N 0.12 -0.74 0.00 5.51 0.00 -0.56 -1.10 121.76 124.98 1xbx s ALA 169 Ca -0.06 -0.06 0.00 0.00 0.00 0.00 0.00 51.96 51.84 1xbx s ALA 169 Cb -0.15 0.47 0.00 0.00 0.00 0.00 0.00 23.12 23.44 1xbx s ALA 169 CO 0.04 -0.51 0.00 0.41 0.00 0.00 0.00 175.76 175.70 1xbx n GLY 170 N 0.20 1.77 3.12 0.00 0.00 -1.26 -1.35 105.19 107.68 1xbx n GLY 170 Ca -0.17 -0.47 -0.21 0.00 0.00 0.00 0.00 46.02 45.17 1xbx n GLY 170 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xbx n GLY 171 N 0.00 -0.49 3.73 -0.02 0.00 -1.26 -4.76 105.19 102.38 1xbx n GLY 171 Ca 0.00 0.08 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 1xbx n GLY 171 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xbx s LEU 172 N -6.31 4.38 0.34 0.99 1.43 -1.26 -4.99 118.68 113.26 1xbx s LEU 172 Ca 0.30 2.56 0.08 0.00 -1.03 0.00 0.00 54.13 56.04 1xbx s LEU 172 Cb -0.16 -3.60 -0.05 0.00 0.03 0.00 0.00 46.19 42.41 1xbx s LEU 172 CO 0.37 -0.72 0.10 0.00 0.23 0.00 0.00 176.35 176.34 1xbx s ALA 173 N 0.61 3.40 0.36 4.21 0.00 -1.26 -4.50 121.76 124.58 1xbx s ALA 173 Ca 0.64 -1.89 0.11 0.00 0.00 0.00 0.00 51.96 50.82 1xbx s ALA 173 Cb -0.41 -0.59 0.90 0.00 0.00 0.00 0.00 23.12 23.02 1xbx s ALA 173 CO 0.36 0.03 1.81 1.25 0.00 0.00 0.00 175.76 179.21 1xbx h LEU 174 N 1.63 0.62 -1.51 0.00 5.85 -1.96 -1.62 115.31 118.32 1xbx h LEU 174 Ca -0.43 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.36 1xbx h LEU 174 Cb 1.25 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 42.24 1xbx h LEU 174 CO 0.65 0.23 0.00 -0.33 -0.34 0.00 0.00 178.44 178.65 1xbx h GLU 175 N 0.61 0.00 0.00 1.25 3.07 -2.01 -2.70 114.58 114.79 1xbx h GLU 175 Ca 0.53 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.39 1xbx h GLU 175 Cb 1.03 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.94 1xbx h GLU 175 CO -0.28 0.00 0.00 -0.44 -1.40 0.00 0.00 179.01 176.89 1xbx h ASP 176 N 0.00 0.00 -0.87 1.42 3.32 -1.70 -3.38 116.42 115.21 1xbx h ASP 176 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1xbx h ASP 176 Cb 0.49 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.00 1xbx h ASP 176 CO 0.00 0.00 0.55 -0.07 -1.72 0.00 0.00 179.24 178.00 1xbx h LEU 177 N 0.00 1.03 -2.78 1.55 3.38 -1.60 -2.41 115.31 114.48 1xbx h LEU 177 Ca 0.00 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.93 1xbx h LEU 177 Cb 0.80 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 41.29 1xbx h LEU 177 CO 0.00 0.77 0.01 -0.65 0.09 0.00 0.00 178.44 178.66 1xbx h PRO 178 N 1.20 0.00 -0.35 1.13 0.11 -1.83 -2.60 132.00 129.67 1xbx h PRO 178 Ca 0.32 0.00 0.06 0.00 0.11 0.00 0.00 66.00 66.49 1xbx h PRO 178 Cb -0.09 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.00 1xbx h PRO 178 CO -0.06 0.00 0.24 -0.07 -0.21 0.00 0.00 178.00 177.90 1xbx h LEU 179 N 0.00 0.18 -2.14 2.35 3.38 -1.72 -2.37 115.31 115.00 1xbx h LEU 179 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1xbx h LEU 179 Cb 0.03 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.74 1xbx h LEU 179 CO -0.00 0.12 0.00 0.49 0.09 0.00 0.00 178.44 179.14 1xbx n PHE 180 N -4.48 0.42 -1.74 1.13 3.01 -0.98 -4.98 117.46 109.85 1xbx n PHE 180 Ca 0.04 -0.21 -0.41 0.00 1.01 0.00 0.00 57.45 57.88 1xbx n PHE 180 Cb 0.27 0.00 -0.00 0.00 -0.01 0.00 0.00 39.48 39.74 1xbx n PHE 180 CO 0.00 0.00 0.00 1.17 1.01 0.00 0.00 176.76 178.94 1xbx n LYS 181 N 1.34 2.39 -0.37 -1.08 4.81 -0.89 -2.26 118.16 122.09 1xbx n LYS 181 Ca 0.19 0.84 0.00 0.00 -0.87 0.00 0.00 58.31 58.46 1xbx n LYS 181 Cb 0.57 -2.52 0.00 0.00 0.02 0.00 0.00 35.03 33.10 1xbx n LYS 181 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1xbx n GLY 182 N 0.60 1.33 3.67 3.14 0.00 -1.26 -5.04 105.19 107.63 1xbx n GLY 182 Ca 0.03 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.70 1xbx n GLY 182 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xbx s ILE 183 N -3.03 4.63 -1.45 -0.61 1.01 -0.96 -5.01 121.20 115.78 1xbx s ILE 183 Ca 0.00 -0.11 -0.10 0.00 0.00 0.00 0.00 60.65 60.44 1xbx s ILE 183 Cb 0.00 -3.02 -0.07 0.00 0.01 0.00 0.00 42.46 39.38 1xbx s ILE 183 CO 0.00 0.54 2.67 -0.81 0.00 0.00 0.00 174.94 177.34 1xbx n PRO 184 N 2.84 3.22 -1.69 2.79 -0.04 -1.26 -4.94 135.00 135.92 1xbx n PRO 184 Ca -0.18 -2.13 -0.44 0.00 -0.04 0.00 0.00 63.50 60.71 1xbx n PRO 184 Cb 0.53 -2.82 -0.04 0.00 -0.04 0.00 0.00 33.50 31.13 1xbx n PRO 184 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 1xbx n ILE 185 N 4.01 0.02 -0.03 0.52 2.08 -1.26 -4.71 119.36 119.99 1xbx n ILE 185 Ca 0.68 -0.00 -0.14 0.00 0.56 0.00 0.00 62.75 63.84 1xbx n ILE 185 Cb 0.24 -1.75 -0.10 0.00 -0.75 0.00 0.00 39.64 37.29 1xbx n ILE 185 CO 0.00 0.00 0.00 -0.74 0.56 0.00 0.00 176.55 176.37 1xbx h HIS 186 N 6.42 0.25 -2.97 1.39 -0.00 -1.27 -3.33 115.15 115.63 1xbx h HIS 186 Ca -0.44 -0.11 -0.15 0.00 -0.00 0.00 0.00 60.37 59.67 1xbx h HIS 186 Cb 1.23 -0.04 -0.26 0.00 -0.00 0.00 0.00 27.41 28.34 1xbx h HIS 186 CO 0.64 0.80 -0.37 0.08 -0.00 0.00 0.00 177.93 179.08 1xbx s VAL 187 N -3.66 -0.01 -0.18 5.26 1.01 -1.21 -1.12 120.40 120.49 1xbx s VAL 187 Ca -0.15 0.03 -0.08 0.00 0.00 0.00 0.00 61.98 61.78 1xbx s VAL 187 Cb 0.02 -0.44 -0.04 0.00 0.00 0.00 0.00 36.38 35.92 1xbx s VAL 187 CO 0.73 0.01 0.07 -0.36 0.00 0.00 0.00 175.10 175.55 1xbx s PHE 188 N 0.41 3.28 -0.07 5.22 0.40 -0.22 -1.14 117.98 125.85 1xbx s PHE 188 Ca -0.02 0.12 -0.13 0.00 -0.60 0.00 0.00 56.93 56.30 1xbx s PHE 188 Cb -0.04 -2.07 -0.05 0.00 0.51 0.00 0.00 43.02 41.37 1xbx s PHE 188 CO -0.02 0.20 0.31 0.42 0.70 0.00 0.00 175.22 176.83 1xbx s ILE 189 N 0.28 5.23 -0.07 0.64 1.01 -0.26 -1.17 121.20 126.86 1xbx s ILE 189 Ca 0.04 0.60 0.00 0.00 0.00 0.00 0.00 60.65 61.30 1xbx s ILE 189 Cb -0.12 -3.61 0.02 0.00 0.01 0.00 0.00 42.46 38.76 1xbx s ILE 189 CO -0.00 0.54 -0.06 0.00 0.00 0.00 0.00 174.94 175.42 1xbx s ALA 190 N -0.64 0.94 0.00 9.38 0.00 -0.20 -4.55 121.76 126.70 1xbx s ALA 190 Ca 0.20 -0.25 0.00 0.00 0.00 0.00 0.00 51.96 51.90 1xbx s ALA 190 Cb -0.14 -0.62 0.00 0.00 0.00 0.00 0.00 23.12 22.35 1xbx s ALA 190 CO 0.08 -0.16 0.00 0.41 0.00 0.00 0.00 175.76 176.09 1xbx n GLY 191 N 4.41 -0.11 0.36 0.00 0.00 -1.26 -1.82 105.19 106.78 1xbx n GLY 191 Ca -0.18 0.00 0.01 0.00 0.00 0.00 0.00 46.02 45.85 1xbx n GLY 191 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1xbx h ARG 192 N 0.00 1.10 0.00 1.61 3.08 -1.91 -0.20 114.38 118.05 1xbx h ARG 192 Ca 0.00 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 59.98 1xbx h ARG 192 Cb 0.00 -0.25 0.00 0.00 0.08 0.00 0.00 29.97 29.80 1xbx h ARG 192 CO 0.00 0.73 0.00 0.66 -1.07 0.00 0.00 179.97 180.29 1xbx h SER 193 N 1.13 0.00 0.00 7.04 4.64 -1.89 -0.28 113.55 124.19 1xbx h SER 193 Ca 0.34 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 61.50 1xbx h SER 193 Cb -0.04 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.02 1xbx h SER 193 CO -0.09 0.00 -1.23 -0.38 -0.87 0.00 0.00 176.83 174.26 1xbx n ILE 194 N -2.76 1.49 -0.35 0.95 5.41 -0.59 -4.15 119.36 119.36 1xbx n ILE 194 Ca 0.01 0.01 0.03 0.00 1.00 0.00 0.00 62.75 63.80 1xbx n ILE 194 Cb 0.29 -2.18 0.17 0.00 -0.71 0.00 0.00 39.64 37.21 1xbx n ILE 194 CO 0.00 0.00 0.00 0.03 0.00 0.00 0.00 176.55 176.58 1xbx h ARG 195 N -1.00 1.04 -0.21 0.38 3.08 -1.04 -2.83 114.38 113.80 1xbx h ARG 195 Ca -0.24 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 59.75 1xbx h ARG 195 Cb 1.05 -0.23 0.00 0.00 0.08 0.00 0.00 29.97 30.87 1xbx h ARG 195 CO -0.15 0.69 0.00 -0.25 -1.07 0.00 0.00 179.97 179.19 1xbx n ASP 196 N -4.57 3.02 -4.76 7.04 8.00 -0.12 -4.89 116.55 120.26 1xbx n ASP 196 Ca 0.15 -1.94 -0.37 0.00 0.71 0.00 0.00 54.79 53.33 1xbx n ASP 196 Cb 0.21 -0.13 0.01 0.00 -0.02 0.00 0.00 41.12 41.19 1xbx n ASP 196 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1xbx s ALA 197 N -1.75 2.83 0.36 2.24 0.00 -1.07 -4.91 121.76 119.47 1xbx s ALA 197 Ca 0.34 1.04 0.09 0.00 0.00 0.00 0.00 51.96 53.42 1xbx s ALA 197 Cb 0.21 -3.44 0.82 0.00 0.00 0.00 0.00 23.12 20.71 1xbx s ALA 197 CO 0.31 -0.93 1.90 0.00 0.00 0.00 0.00 175.76 177.03 1xbx h ALA 198 N 1.62 1.82 -3.03 0.00 0.00 -1.93 -3.29 119.26 114.46 1xbx h ALA 198 Ca -0.50 0.00 -0.61 0.00 0.00 0.00 0.00 54.91 53.81 1xbx h ALA 198 Cb 1.27 -0.14 -0.40 0.00 0.00 0.00 0.00 17.79 18.52 1xbx h ALA 198 CO 0.58 -0.03 -0.74 0.45 0.00 0.00 0.00 179.25 179.51 1xbx s SER 199 N -5.91 3.73 0.31 0.00 0.15 -1.26 -5.00 113.70 105.73 1xbx s SER 199 Ca -0.10 -2.44 0.08 0.00 0.70 0.00 0.00 55.95 54.20 1xbx s SER 199 Cb 0.21 -1.01 0.82 0.00 -1.71 0.00 0.00 66.02 64.33 1xbx s SER 199 CO 0.78 -0.30 1.75 -0.65 1.20 0.00 0.00 173.24 176.02 1xbx h PRO 200 N 6.99 0.64 -0.14 5.44 0.11 -1.74 0.43 132.00 143.74 1xbx h PRO 200 Ca -0.03 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 66.03 1xbx h PRO 200 Cb 0.95 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 31.91 1xbx h PRO 200 CO 0.48 0.42 0.06 0.28 -0.21 0.00 0.00 178.00 179.03 1xbx h VAL 201 N 0.66 1.13 -0.61 3.15 2.07 -1.90 -0.90 116.25 119.85 1xbx h VAL 201 Ca 0.62 -0.39 -0.03 0.00 0.82 0.00 0.00 66.70 67.71 1xbx h VAL 201 Cb 1.08 1.14 -0.03 0.00 -1.52 0.00 0.00 31.29 31.96 1xbx h VAL 201 CO -0.44 0.12 0.26 -0.08 0.02 0.00 0.00 177.57 177.46 1xbx h GLU 202 N 0.08 0.88 -0.40 1.57 4.81 -1.78 -1.15 114.58 118.59 1xbx h GLU 202 Ca 0.05 -0.13 -0.02 0.00 -0.13 0.00 0.00 59.36 59.13 1xbx h GLU 202 Cb 0.14 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 29.34 1xbx h GLU 202 CO -0.01 0.71 0.17 0.00 -0.73 0.00 0.00 179.01 179.15 1xbx h ALA 203 N 1.41 0.52 -0.34 2.92 0.00 -0.56 0.13 119.26 123.35 1xbx h ALA 203 Ca 0.21 -0.13 -0.06 0.00 0.00 0.00 0.00 54.91 54.93 1xbx h ALA 203 Cb 0.14 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1xbx h ALA 203 CO -0.02 0.12 -0.02 0.00 0.00 0.00 0.00 179.25 179.33 1xbx h ALA 204 N 1.01 0.46 -0.33 0.00 0.00 -0.94 -2.48 119.26 116.98 1xbx h ALA 204 Ca 0.13 -0.26 -0.08 0.00 0.00 0.00 0.00 54.91 54.71 1xbx h ALA 204 Cb 0.18 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1xbx h ALA 204 CO -0.01 0.24 -0.11 0.00 0.00 0.00 0.00 179.25 179.37 1xbx h ARG 205 N 0.42 0.57 -0.62 0.00 3.08 -0.99 -2.02 114.38 114.82 1xbx h ARG 205 Ca 0.09 -0.17 -0.07 0.00 0.07 0.00 0.00 59.98 59.91 1xbx h ARG 205 Cb 0.48 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.45 1xbx h ARG 205 CO 0.02 0.67 0.11 1.96 -1.07 0.00 0.00 179.97 181.67 1xbx h GLN 206 N 0.53 1.00 -0.41 0.04 4.20 -0.87 0.53 115.11 120.13 1xbx h GLN 206 Ca 0.10 -0.24 -0.00 0.00 0.06 0.00 0.00 58.65 58.56 1xbx h GLN 206 Cb 0.51 -0.13 -0.02 0.00 0.30 0.00 0.00 27.48 28.14 1xbx h GLN 206 CO 0.03 0.91 0.24 0.74 -0.67 0.00 0.00 178.83 180.08 1xbx h PHE 207 N 0.94 0.54 -0.43 2.96 -1.00 -1.09 -0.54 116.94 118.32 1xbx h PHE 207 Ca 0.19 -0.01 -0.10 0.00 2.81 0.00 0.00 57.97 60.86 1xbx h PHE 207 Cb 0.39 -0.18 -0.01 0.00 3.61 0.00 0.00 35.95 39.76 1xbx h PHE 207 CO 0.03 0.40 -0.14 0.87 -1.61 0.00 0.00 178.31 177.86 1xbx h LYS 208 N 0.53 0.86 -0.12 1.51 1.57 -1.02 -1.27 116.57 118.63 1xbx h LYS 208 Ca 0.14 -0.34 0.03 0.00 -1.87 0.00 0.00 60.65 58.61 1xbx h LYS 208 Cb 0.02 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.26 1xbx h LYS 208 CO -0.03 0.98 -0.08 -0.09 -0.57 0.00 0.00 179.45 179.66 1xbx h ARG 209 N 0.69 -0.08 -0.49 3.15 2.43 -0.79 -0.74 114.38 118.54 1xbx h ARG 209 Ca 0.11 0.01 -0.06 0.00 -0.81 0.00 0.00 59.98 59.22 1xbx h ARG 209 Cb 0.69 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.24 1xbx h ARG 209 CO 0.05 -0.06 0.08 1.03 -1.51 0.00 0.00 179.97 179.56 1xbx h SER 210 N -0.09 0.78 -0.68 -3.80 0.87 -0.93 -1.67 113.55 108.03 1xbx h SER 210 Ca 0.08 -0.26 0.06 0.00 -1.23 0.00 0.00 61.79 60.43 1xbx h SER 210 Cb 0.20 -0.21 -0.06 0.00 -0.44 0.00 0.00 62.40 61.90 1xbx h SER 210 CO -0.18 0.85 0.38 0.40 -0.53 0.00 0.00 176.83 177.75 1xbx h ILE 211 N 0.69 0.97 -0.83 2.23 2.04 -1.13 0.10 117.51 121.59 1xbx h ILE 211 Ca 0.15 -0.24 -0.03 0.00 1.00 0.00 0.00 64.86 65.74 1xbx h ILE 211 Cb 0.40 0.21 -0.04 0.00 -0.74 0.00 0.00 36.82 36.65 1xbx h ILE 211 CO 0.01 0.13 0.38 0.00 0.00 0.00 0.00 178.15 178.67 1xbx h ALA 212 N 1.35 1.12 -0.12 1.87 0.00 -0.72 -0.23 119.26 122.53 1xbx h ALA 212 Ca 0.30 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 1xbx h ALA 212 Cb 0.19 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.65 1xbx h ALA 212 CO -0.18 0.66 -0.01 0.93 0.00 0.00 0.00 179.25 180.64 1xbx h GLU 213 N 1.18 0.22 0.00 0.00 5.08 -0.90 -3.30 114.58 116.86 1xbx h GLU 213 Ca 0.28 -0.08 -0.09 0.00 -1.00 0.00 0.00 59.36 58.47 1xbx h GLU 213 Cb 0.13 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.35 1xbx h GLU 213 CO -0.03 0.49 -0.45 -0.07 -1.00 0.00 0.00 179.01 177.95 1xbx h LEU 214 N -0.07 0.00 -1.05 1.33 3.38 -0.79 -3.51 115.31 114.60 1xbx h LEU 214 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1xbx h LEU 214 Cb 0.40 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.15 1xbx h LEU 214 CO 0.01 0.45 0.00 0.79 0.09 0.00 0.00 178.44 179.78