#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xx2 n VAL 3 N 0.00 0.00 -2.45 -1.45 0.31 -1.26 -4.84 118.33 108.63 1xx2 n VAL 3 Ca 0.00 0.00 -0.34 0.00 -0.01 0.00 0.00 64.34 63.99 1xx2 n VAL 3 Cb 0.00 -0.09 -0.02 0.00 -0.91 0.00 0.00 33.84 32.82 1xx2 n VAL 3 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1xx2 s SER 4 N 0.53 6.15 0.23 4.52 0.15 -1.26 -4.90 113.70 119.12 1xx2 s SER 4 Ca 0.67 2.01 -0.08 0.00 0.70 0.00 0.00 55.95 59.26 1xx2 s SER 4 Cb -0.94 -2.57 0.21 0.00 -1.71 0.00 0.00 66.02 61.01 1xx2 s SER 4 CO 0.45 -0.92 1.89 -0.08 1.20 0.00 0.00 173.24 175.79 1xx2 h GLU 5 N 1.47 1.20 -0.00 5.44 4.57 -2.00 0.14 114.58 125.40 1xx2 h GLU 5 Ca -0.50 -0.09 0.00 0.00 -1.18 0.00 0.00 59.36 57.59 1xx2 h GLU 5 Cb 1.23 -0.26 0.00 0.00 -0.16 0.00 0.00 28.75 29.56 1xx2 h GLU 5 CO 0.58 0.82 -0.05 1.17 -1.18 0.00 0.00 179.01 180.35 1xx2 n LYS 6 N -4.43 0.17 -0.01 1.92 3.00 -1.26 -2.14 118.16 115.42 1xx2 n LYS 6 Ca 0.10 -0.02 -0.10 0.00 -0.00 0.00 0.00 58.31 58.29 1xx2 n LYS 6 Cb 0.03 -1.50 -0.14 0.00 0.00 0.00 0.00 35.03 33.43 1xx2 n LYS 6 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.40 179.36 1xx2 h GLN 7 N 0.04 0.03 -0.26 1.64 4.20 -1.58 -3.01 115.11 116.18 1xx2 h GLN 7 Ca 0.00 -0.05 -0.15 0.00 0.06 0.00 0.00 58.65 58.51 1xx2 h GLN 7 Cb 0.43 0.02 -0.00 0.00 0.30 0.00 0.00 27.48 28.23 1xx2 h GLN 7 CO 0.00 0.62 -0.41 1.25 -0.67 0.00 0.00 178.83 179.62 1xx2 h LEU 8 N 0.01 0.82 -1.51 1.46 5.85 -0.83 -1.81 115.31 119.29 1xx2 h LEU 8 Ca -0.27 -0.52 -0.04 0.00 0.84 0.00 0.00 57.88 57.89 1xx2 h LEU 8 Cb 1.99 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 42.78 1xx2 h LEU 8 CO 0.09 1.18 -0.09 0.00 -0.34 0.00 0.00 178.44 179.27 1xx2 h ALA 9 N 0.66 1.60 -0.03 1.25 0.00 -1.53 -2.09 119.26 119.12 1xx2 h ALA 9 Ca 0.02 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 1xx2 h ALA 9 Cb 1.01 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.73 1xx2 h ALA 9 CO 0.10 0.29 -0.05 1.49 0.00 0.00 0.00 179.25 181.08 1xx2 h GLU 10 N 0.20 0.09 -0.08 0.00 4.81 -1.35 -2.78 114.58 115.47 1xx2 h GLU 10 Ca 0.04 -0.05 0.04 0.00 -0.13 0.00 0.00 59.36 59.25 1xx2 h GLU 10 Cb 0.30 0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.64 1xx2 h GLU 10 CO 0.02 0.63 -0.18 0.28 -0.73 0.00 0.00 179.01 179.03 1xx2 h VAL 11 N -0.45 0.55 -0.27 0.32 2.07 -1.07 -1.42 116.25 115.98 1xx2 h VAL 11 Ca 0.00 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.57 1xx2 h VAL 11 Cb 0.63 0.55 -0.04 0.00 -1.52 0.00 0.00 31.29 30.90 1xx2 h VAL 11 CO 0.01 0.00 -0.01 0.58 0.02 0.00 0.00 177.57 178.17 1xx2 h VAL 12 N -0.25 0.80 -0.64 2.57 2.07 -1.45 -2.44 116.25 116.90 1xx2 h VAL 12 Ca 0.08 -0.02 -0.01 0.00 0.82 0.00 0.00 66.70 67.57 1xx2 h VAL 12 Cb 0.37 0.72 -0.03 0.00 -1.52 0.00 0.00 31.29 30.83 1xx2 h VAL 12 CO -0.23 0.01 0.37 0.00 0.02 0.00 0.00 177.57 177.75 1xx2 h ALA 13 N 1.23 0.82 0.00 1.67 0.00 -1.24 -0.36 119.26 121.38 1xx2 h ALA 13 Ca 0.13 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1xx2 h ALA 13 Cb 0.17 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.70 1xx2 h ALA 13 CO -0.22 0.31 0.00 -0.91 0.00 0.00 0.00 179.25 178.43 1xx2 h ASN 14 N 0.87 0.00 0.02 0.00 2.35 -0.97 -1.31 115.58 116.54 1xx2 h ASN 14 Ca 0.23 0.00 -0.39 0.00 -0.55 0.00 0.00 56.30 55.59 1xx2 h ASN 14 Cb 0.01 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 38.32 1xx2 h ASN 14 CO -0.04 0.00 -2.22 0.41 -1.65 0.00 0.00 177.43 173.93 1xx2 n THR 15 N -2.90 1.56 -0.09 2.81 -1.04 -0.95 -4.51 114.28 109.16 1xx2 n THR 15 Ca -0.00 -0.41 -0.13 0.00 -2.04 0.00 0.00 64.05 61.46 1xx2 n THR 15 Cb 0.21 -1.76 -0.05 0.00 -1.82 0.00 0.00 70.33 66.92 1xx2 n THR 15 CO 0.00 0.00 0.00 0.40 -0.64 0.00 0.00 175.07 174.83 1xx2 h ILE 16 N -0.56 1.31 -0.58 12.58 1.08 -1.04 -3.14 117.51 127.17 1xx2 h ILE 16 Ca -0.57 -1.41 -0.02 0.00 -0.39 0.00 0.00 64.86 62.47 1xx2 h ILE 16 Cb 1.70 1.63 -0.03 0.00 -3.07 0.00 0.00 36.82 37.06 1xx2 h ILE 16 CO -0.22 0.44 0.28 0.71 -0.69 0.00 0.00 178.15 178.68 1xx2 h THR 17 N 0.35 1.21 0.00 -0.27 1.35 -1.46 -1.01 112.91 113.08 1xx2 h THR 17 Ca 0.04 -0.59 -0.00 0.00 -0.55 0.00 0.00 66.41 65.31 1xx2 h THR 17 Cb 0.81 0.52 -0.00 0.00 -1.73 0.00 0.00 68.15 67.75 1xx2 h THR 17 CO 0.06 0.24 -0.02 1.55 -0.25 0.00 0.00 175.52 177.10 1xx2 h PRO 18 N 0.79 0.00 -0.06 4.72 0.13 -1.79 -2.51 132.00 133.29 1xx2 h PRO 18 Ca 0.20 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 65.26 1xx2 h PRO 18 Cb 0.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.25 1xx2 h PRO 18 CO -0.03 0.02 -0.26 1.25 -0.23 0.00 0.00 178.00 178.76 1xx2 h LEU 19 N 0.00 0.32 -1.59 1.56 7.12 -1.33 -2.26 115.31 119.13 1xx2 h LEU 19 Ca -0.00 -0.65 -0.05 0.00 0.13 0.00 0.00 57.88 57.31 1xx2 h LEU 19 Cb 0.54 -0.09 -0.01 0.00 -0.53 0.00 0.00 40.66 40.57 1xx2 h LEU 19 CO 0.00 0.92 -0.22 0.24 -0.13 0.00 0.00 178.44 179.25 1xx2 h MET 20 N -0.26 0.00 0.18 1.25 2.86 -1.02 -0.26 114.93 117.68 1xx2 h MET 20 Ca -0.02 0.00 -0.30 0.00 -2.06 0.00 0.00 59.70 57.32 1xx2 h MET 20 Cb 0.91 0.00 0.02 0.00 0.06 0.00 0.00 31.60 32.58 1xx2 h MET 20 CO 0.05 0.22 -1.37 -0.22 1.06 0.00 0.00 176.91 176.65 1xx2 h LYS 21 N 0.00 0.37 0.01 1.72 3.64 -1.45 -1.28 116.57 119.58 1xx2 h LYS 21 Ca -0.00 -0.63 -0.19 0.00 -1.27 0.00 0.00 60.65 58.55 1xx2 h LYS 21 Cb 0.41 0.24 -0.02 0.00 -0.41 0.00 0.00 32.23 32.45 1xx2 h LYS 21 CO 0.03 1.30 -0.87 0.00 -2.27 0.00 0.00 179.45 177.63 1xx2 h ALA 22 N 0.41 0.55 -0.50 5.00 0.00 -1.17 -3.28 119.26 120.26 1xx2 h ALA 22 Ca -0.19 -0.74 0.00 0.00 0.00 0.00 0.00 54.91 53.97 1xx2 h ALA 22 Cb 2.05 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.75 1xx2 h ALA 22 CO 0.23 0.97 0.00 1.04 0.00 0.00 0.00 179.25 181.48 1xx2 n GLN 23 N -3.61 2.55 -3.78 0.00 1.13 -0.13 -4.98 117.38 108.56 1xx2 n GLN 23 Ca -0.02 -2.36 -0.23 0.00 -1.94 0.00 0.00 57.00 52.45 1xx2 n GLN 23 Cb 0.81 -1.49 0.01 0.00 0.11 0.00 0.00 30.24 29.68 1xx2 n GLN 23 CO 0.00 0.00 0.00 0.43 -1.44 0.00 0.00 177.06 176.05 1xx2 n SER 24 N 1.40 -0.85 -4.57 1.08 7.64 -0.79 -4.94 113.62 112.58 1xx2 n SER 24 Ca 0.20 -0.88 -0.41 0.00 1.01 0.00 0.00 58.87 58.79 1xx2 n SER 24 Cb 0.58 -3.72 -0.08 0.00 -1.01 0.00 0.00 64.21 59.98 1xx2 n SER 24 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1xx2 s VAL 25 N -3.77 5.05 0.14 0.44 1.01 -0.55 -4.99 120.40 117.74 1xx2 s VAL 25 Ca 0.00 0.44 -0.18 0.00 0.00 0.00 0.00 61.98 62.24 1xx2 s VAL 25 Cb -0.00 -3.90 0.00 0.00 0.00 0.00 0.00 36.38 32.48 1xx2 s VAL 25 CO 0.84 -0.12 1.72 -0.65 0.00 0.00 0.00 175.10 176.89 1xx2 h PRO 26 N 8.35 0.11 -3.49 2.72 0.11 -1.87 -3.46 132.00 134.48 1xx2 h PRO 26 Ca -0.29 -0.01 -0.06 0.00 0.11 0.00 0.00 66.00 65.76 1xx2 h PRO 26 Cb 1.13 -0.03 -0.13 0.00 0.11 0.00 0.00 31.00 32.09 1xx2 h PRO 26 CO 0.74 0.08 -0.14 0.20 -0.21 0.00 0.00 178.00 178.67 1xx2 s GLY 27 N -2.68 -0.18 -0.28 -0.55 0.00 -1.16 -0.55 107.32 101.92 1xx2 s GLY 27 Ca -0.13 -0.18 -0.21 0.00 0.00 0.00 0.00 44.72 44.20 1xx2 s GLY 27 CO 0.70 -0.42 0.75 -0.29 0.00 0.00 0.00 173.10 173.83 1xx2 s MET 28 N -3.82 0.73 -0.11 2.90 1.75 0.09 -2.88 119.30 117.95 1xx2 s MET 28 Ca 0.04 1.05 -0.01 0.00 -1.25 0.00 0.00 55.69 55.51 1xx2 s MET 28 Cb 0.02 0.26 -0.03 0.00 2.84 0.00 0.00 34.83 37.93 1xx2 s MET 28 CO -0.12 -0.12 -0.07 0.00 -0.65 0.00 0.00 175.02 174.07 1xx2 s ALA 29 N 0.98 2.93 -0.01 4.11 0.00 -0.38 0.30 121.76 129.68 1xx2 s ALA 29 Ca -0.05 -0.86 0.03 0.00 0.00 0.00 0.00 51.96 51.08 1xx2 s ALA 29 Cb -0.05 -1.35 -0.01 0.00 0.00 0.00 0.00 23.12 21.72 1xx2 s ALA 29 CO -0.10 0.39 -0.10 0.08 0.00 0.00 0.00 175.76 176.03 1xx2 s VAL 30 N -0.18 0.79 -0.05 0.00 1.01 0.14 -1.34 120.40 120.76 1xx2 s VAL 30 Ca 0.02 -0.42 0.01 0.00 0.00 0.00 0.00 61.98 61.60 1xx2 s VAL 30 Cb -0.13 -0.66 0.02 0.00 0.00 0.00 0.00 36.38 35.61 1xx2 s VAL 30 CO 0.03 0.23 -0.06 0.00 0.00 0.00 0.00 175.10 175.29 1xx2 s ALA 31 N -0.17 0.76 -0.14 5.51 0.00 -0.40 -0.25 121.76 127.07 1xx2 s ALA 31 Ca 0.03 -0.11 0.01 0.00 0.00 0.00 0.00 51.96 51.89 1xx2 s ALA 31 Cb -0.05 -0.43 0.00 0.00 0.00 0.00 0.00 23.12 22.64 1xx2 s ALA 31 CO -0.00 0.02 -0.18 0.08 0.00 0.00 0.00 175.76 175.68 1xx2 s VAL 32 N 0.83 2.47 -0.25 0.00 1.01 -0.14 -0.23 120.40 124.09 1xx2 s VAL 32 Ca -0.12 -0.85 -0.12 0.00 0.00 0.00 0.00 61.98 60.89 1xx2 s VAL 32 Cb -0.15 -2.02 -0.05 0.00 0.00 0.00 0.00 36.38 34.17 1xx2 s VAL 32 CO 0.01 0.53 0.25 -0.63 0.00 0.00 0.00 175.10 175.26 1xx2 s ILE 33 N 0.71 5.28 -0.08 2.22 1.09 0.72 -0.88 121.20 130.27 1xx2 s ILE 33 Ca -0.08 0.34 -0.03 0.00 -1.10 0.00 0.00 60.65 59.78 1xx2 s ILE 33 Cb -0.16 -3.58 0.05 0.00 -1.06 0.00 0.00 42.46 37.70 1xx2 s ILE 33 CO 0.01 0.27 0.16 -0.47 -0.10 0.00 0.00 174.94 174.81 1xx2 s TYR 34 N 1.48 -0.18 -1.13 3.97 6.14 0.03 -1.66 117.35 125.99 1xx2 s TYR 34 Ca 0.11 0.59 -0.22 0.00 0.64 0.00 0.00 57.07 58.20 1xx2 s TYR 34 Cb -0.15 -0.23 -0.01 0.00 0.42 0.00 0.00 41.96 42.00 1xx2 s TYR 34 CO 0.08 -0.25 0.79 1.04 0.64 0.00 0.00 175.55 177.84 1xx2 n GLN 35 N 5.14 -1.15 -1.28 4.97 6.02 -1.25 -1.67 117.38 128.16 1xx2 n GLN 35 Ca -0.08 0.44 -0.10 0.00 -0.01 0.00 0.00 57.00 57.26 1xx2 n GLN 35 Cb 0.50 -4.02 -0.04 0.00 1.02 0.00 0.00 30.24 27.70 1xx2 n GLN 35 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1xx2 n GLY 36 N -1.70 1.01 2.87 1.08 0.00 -1.26 -4.98 105.19 102.20 1xx2 n GLY 36 Ca -0.09 -0.14 -0.17 0.00 0.00 0.00 0.00 46.02 45.61 1xx2 n GLY 36 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1xx2 s LYS 37 N -2.63 0.46 -0.14 1.61 2.36 -0.67 -5.12 119.74 115.60 1xx2 s LYS 37 Ca 0.00 -0.03 -0.25 0.00 -2.55 0.00 0.00 55.97 53.15 1xx2 s LYS 37 Cb 0.00 -0.55 -0.02 0.00 -1.05 0.00 0.00 37.83 36.21 1xx2 s LYS 37 CO 0.00 -0.07 0.79 -1.25 1.55 0.00 0.00 175.35 176.38 1xx2 s PRO 38 N 0.73 4.33 -0.19 4.03 0.04 -1.26 -0.79 135.00 141.89 1xx2 s PRO 38 Ca -0.08 0.97 0.00 0.00 0.04 0.00 0.00 61.00 61.93 1xx2 s PRO 38 Cb -0.11 -3.54 0.01 0.00 0.04 0.00 0.00 34.50 30.90 1xx2 s PRO 38 CO -0.01 -0.23 -0.17 -1.01 0.04 0.00 0.00 177.00 175.62 1xx2 s HIS 39 N 1.81 2.81 -0.11 0.56 3.76 -0.06 -4.98 115.29 119.09 1xx2 s HIS 39 Ca 0.38 -1.49 -0.06 0.00 -0.15 0.00 0.00 55.06 53.74 1xx2 s HIS 39 Cb -0.17 -1.95 -0.04 0.00 1.11 0.00 0.00 32.58 31.53 1xx2 s HIS 39 CO 0.14 -0.75 0.13 0.71 -0.85 0.00 0.00 174.74 174.12 1xx2 s TYR 40 N 1.31 3.55 -0.03 1.40 1.51 -1.26 -0.97 117.35 122.86 1xx2 s TYR 40 Ca 0.05 0.48 -0.01 0.00 -1.01 0.00 0.00 57.07 56.58 1xx2 s TYR 40 Cb -0.13 -1.92 0.03 0.00 -0.11 0.00 0.00 41.96 39.83 1xx2 s TYR 40 CO -0.11 0.70 0.04 0.71 -1.11 0.00 0.00 175.55 175.79 1xx2 s TYR 41 N -1.03 0.05 0.02 2.71 2.02 0.66 -5.01 117.35 116.77 1xx2 s TYR 41 Ca 0.15 0.17 0.08 0.00 -0.37 0.00 0.00 57.07 57.11 1xx2 s TYR 41 Cb -0.12 -0.33 -0.02 0.00 -0.40 0.00 0.00 41.96 41.09 1xx2 s TYR 41 CO 0.05 -0.13 -0.26 0.95 -1.57 0.00 0.00 175.55 174.59 1xx2 s THR 42 N 1.45 2.04 0.03 -0.71 -4.23 -1.26 0.24 115.64 113.20 1xx2 s THR 42 Ca -0.04 -1.23 0.01 0.00 -1.18 0.00 0.00 61.69 59.25 1xx2 s THR 42 Cb -0.13 -1.72 -0.02 0.00 1.34 0.00 0.00 72.50 71.97 1xx2 s THR 42 CO -0.03 0.45 -0.06 -0.36 -0.54 0.00 0.00 174.62 174.08 1xx2 s PHE 43 N -0.71 0.49 0.00 3.99 0.40 0.15 -5.00 117.98 117.30 1xx2 s PHE 43 Ca 0.11 -0.48 0.00 0.00 -0.60 0.00 0.00 56.93 55.95 1xx2 s PHE 43 Cb -0.10 -0.31 0.00 0.00 0.51 0.00 0.00 43.02 43.12 1xx2 s PHE 43 CO 0.01 -0.12 0.00 0.41 0.70 0.00 0.00 175.22 176.22 1xx2 n GLY 44 N 1.61 0.17 3.63 4.36 0.00 -1.26 -0.74 105.19 112.96 1xx2 n GLY 44 Ca -0.23 -0.93 -0.33 0.00 0.00 0.00 0.00 46.02 44.53 1xx2 n GLY 44 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xx2 s LYS 45 N 0.00 2.76 -0.12 1.61 -0.14 0.29 -2.33 119.74 121.81 1xx2 s LYS 45 Ca 0.00 -0.57 0.06 0.00 -1.36 0.00 0.00 55.97 54.10 1xx2 s LYS 45 Cb 0.00 -2.63 -0.24 0.00 -1.68 0.00 0.00 37.83 33.28 1xx2 s LYS 45 CO 0.00 0.65 0.36 0.00 -0.76 0.00 0.00 175.35 175.60 1xx2 n ALA 46 N 1.88 1.29 -3.67 5.17 0.00 0.15 -3.01 120.51 122.31 1xx2 n ALA 46 Ca -0.17 -0.84 -0.27 0.00 0.00 0.00 0.00 53.44 52.16 1xx2 n ALA 46 Cb 0.53 -0.59 -0.16 0.00 0.00 0.00 0.00 19.45 19.22 1xx2 n ALA 46 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1xx2 s ASP 47 N -6.37 2.91 0.08 0.00 -1.08 -0.96 -1.93 116.67 109.32 1xx2 s ASP 47 Ca -0.15 -0.88 -0.20 0.00 -0.52 0.00 0.00 52.55 50.79 1xx2 s ASP 47 Cb 0.07 -0.48 -0.10 0.00 -1.46 0.00 0.00 42.92 40.95 1xx2 s ASP 47 CO 0.78 -0.34 1.58 0.40 0.52 0.00 0.00 175.17 178.10 1xx2 h ILE 48 N 6.47 1.19 -0.10 4.11 2.04 -1.87 0.34 117.51 129.70 1xx2 h ILE 48 Ca -0.16 -0.61 -0.01 0.00 1.00 0.00 0.00 64.86 65.08 1xx2 h ILE 48 Cb 1.11 1.26 -0.00 0.00 -0.74 0.00 0.00 36.82 38.45 1xx2 h ILE 48 CO 0.35 0.19 0.03 0.00 0.00 0.00 0.00 178.15 178.71 1xx2 h ALA 49 N 0.86 0.13 -0.00 1.87 0.00 -1.98 -2.77 119.26 117.38 1xx2 h ALA 49 Ca 0.06 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1xx2 h ALA 49 Cb 0.25 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1xx2 h ALA 49 CO -0.00 -0.24 -0.03 0.00 0.00 0.00 0.00 179.25 178.98 1xx2 n ALA 50 N -2.24 2.62 -3.87 0.00 0.00 -1.22 -4.92 120.51 110.87 1xx2 n ALA 50 Ca -0.06 -0.21 -0.27 0.00 0.00 0.00 0.00 53.44 52.91 1xx2 n ALA 50 Cb 0.15 -1.44 0.02 0.00 0.00 0.00 0.00 19.45 18.18 1xx2 n ALA 50 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1xx2 n ASN 51 N -1.05 -2.94 -4.68 0.00 4.05 0.11 -4.95 115.26 105.79 1xx2 n ASN 51 Ca 0.17 -0.84 -0.38 0.00 0.45 0.00 0.00 54.58 53.99 1xx2 n ASN 51 Cb 0.22 -3.76 -0.07 0.00 1.23 0.00 0.00 39.78 37.39 1xx2 n ASN 51 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 177.26 173.67 1xx2 s LYS 52 N -6.42 4.19 0.66 1.20 -0.14 -0.47 -4.96 119.74 113.81 1xx2 s LYS 52 Ca 0.37 0.21 -0.12 0.00 -1.36 0.00 0.00 55.97 55.07 1xx2 s LYS 52 Cb -0.19 -3.52 -0.01 0.00 -1.68 0.00 0.00 37.83 32.43 1xx2 s LYS 52 CO 0.84 0.00 1.05 -1.25 -0.76 0.00 0.00 175.35 175.23 1xx2 s PRO 53 N 1.17 3.15 0.09 -1.68 0.04 -1.26 0.35 135.00 136.86 1xx2 s PRO 53 Ca 0.19 0.96 -0.30 0.00 0.04 0.00 0.00 61.00 61.89 1xx2 s PRO 53 Cb -0.15 -2.02 -0.05 0.00 0.04 0.00 0.00 34.50 32.32 1xx2 s PRO 53 CO 0.08 -0.93 0.97 0.08 0.04 0.00 0.00 177.00 177.23 1xx2 s VAL 54 N -2.96 4.55 0.28 -0.36 1.01 -0.98 -4.38 120.40 117.56 1xx2 s VAL 54 Ca 0.58 2.06 0.02 0.00 0.00 0.00 0.00 61.98 64.64 1xx2 s VAL 54 Cb -0.14 -4.31 -0.05 0.00 0.00 0.00 0.00 36.38 31.88 1xx2 s VAL 54 CO 0.51 0.29 0.09 0.42 0.00 0.00 0.00 175.10 176.41 1xx2 s THR 55 N 0.18 0.71 -0.79 3.92 -4.23 -1.26 -4.68 115.64 109.49 1xx2 s THR 55 Ca 0.48 -2.00 0.09 0.00 -1.18 0.00 0.00 61.69 59.08 1xx2 s THR 55 Cb -0.23 -2.67 0.09 0.00 1.34 0.00 0.00 72.50 71.03 1xx2 s THR 55 CO 0.30 0.00 1.28 -2.65 -0.54 0.00 0.00 174.62 173.00 1xx2 n PRO 56 N -0.53 0.04 0.00 3.99 -0.02 -1.26 -1.13 135.00 136.10 1xx2 n PRO 56 Ca -0.01 0.48 0.09 0.00 -2.02 0.00 0.00 63.50 62.04 1xx2 n PRO 56 Cb 0.66 -1.63 0.07 0.00 -0.02 0.00 0.00 33.50 32.58 1xx2 n PRO 56 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1xx2 n GLN 57 N -1.72 1.47 -1.95 -0.52 3.00 -1.26 -4.00 117.38 112.40 1xx2 n GLN 57 Ca 0.00 -1.47 -0.42 0.00 -0.01 0.00 0.00 57.00 55.10 1xx2 n GLN 57 Cb 0.05 -1.33 -0.03 0.00 0.00 0.00 0.00 30.24 28.93 1xx2 n GLN 57 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.06 178.05 1xx2 s THR 58 N -1.52 2.65 -0.09 5.09 2.01 -0.28 -4.83 115.64 118.67 1xx2 s THR 58 Ca 0.20 0.47 -0.16 0.00 0.31 0.00 0.00 61.69 62.51 1xx2 s THR 58 Cb 0.15 -3.30 -0.05 0.00 0.01 0.00 0.00 72.50 69.31 1xx2 s THR 58 CO 0.24 0.04 0.42 -0.76 -0.69 0.00 0.00 174.62 173.88 1xx2 s LEU 59 N 0.96 4.34 0.20 4.42 1.43 0.16 -4.07 118.68 126.12 1xx2 s LEU 59 Ca 0.69 0.81 0.11 0.00 -1.03 0.00 0.00 54.13 54.71 1xx2 s LEU 59 Cb -0.43 -2.61 -0.04 0.00 0.03 0.00 0.00 46.19 43.14 1xx2 s LEU 59 CO 0.33 0.13 -0.22 -0.36 0.23 0.00 0.00 176.35 176.45 1xx2 s PHE 60 N 0.03 2.17 -0.10 0.29 0.40 0.58 -2.09 117.98 119.27 1xx2 s PHE 60 Ca 0.24 -0.39 -0.22 0.00 -0.60 0.00 0.00 56.93 55.96 1xx2 s PHE 60 Cb -0.15 -1.06 -0.04 0.00 0.51 0.00 0.00 43.02 42.28 1xx2 s PHE 60 CO 0.10 0.48 0.64 -1.21 0.70 0.00 0.00 175.22 175.93 1xx2 s GLU 61 N -2.81 4.39 0.30 0.44 2.02 -1.26 -1.62 118.70 120.15 1xx2 s GLU 61 Ca 0.21 0.75 0.24 0.00 0.02 0.00 0.00 54.97 56.18 1xx2 s GLU 61 Cb -0.07 -3.46 0.34 0.00 0.10 0.00 0.00 34.13 31.04 1xx2 s GLU 61 CO 0.10 0.05 1.46 -0.07 0.02 0.00 0.00 175.26 176.81 1xx2 h LEU 62 N 6.94 0.00 0.00 1.80 3.38 -1.48 -3.44 115.31 122.52 1xx2 h LEU 62 Ca -0.40 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.54 1xx2 h LEU 62 Cb 1.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.93 1xx2 h LEU 62 CO 0.76 0.01 0.00 0.61 0.09 0.00 0.00 178.44 179.91 1xx2 n GLY 63 N 1.19 3.21 0.16 0.83 0.00 -1.21 -2.46 105.19 106.90 1xx2 n GLY 63 Ca 0.03 -0.23 0.11 0.00 0.00 0.00 0.00 46.02 45.93 1xx2 n GLY 63 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1xx2 n SER 64 N 2.65 0.58 0.16 1.61 7.64 -1.26 -1.46 113.62 123.55 1xx2 n SER 64 Ca 0.00 0.76 0.13 0.00 1.01 0.00 0.00 58.87 60.76 1xx2 n SER 64 Cb 0.00 -0.84 0.56 0.00 -1.01 0.00 0.00 64.21 62.92 1xx2 n SER 64 CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 1xx2 h ILE 65 N 0.00 0.00 -0.19 0.44 2.04 -1.60 -0.82 117.51 117.38 1xx2 h ILE 65 Ca 0.00 -0.20 0.06 0.00 1.00 0.00 0.00 64.86 65.72 1xx2 h ILE 65 Cb 0.04 0.91 -0.01 0.00 -0.74 0.00 0.00 36.82 37.02 1xx2 h ILE 65 CO 0.00 0.00 0.17 0.28 0.00 0.00 0.00 178.15 178.60 1xx2 h SER 66 N 0.00 0.00 0.22 1.72 0.02 -1.46 -1.31 113.55 112.74 1xx2 h SER 66 Ca 0.00 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.94 1xx2 h SER 66 Cb 0.28 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.82 1xx2 h SER 66 CO 0.00 0.00 -0.06 0.11 -1.14 0.00 0.00 176.83 175.74 1xx2 h LYS 67 N 0.00 0.00 -0.01 3.45 1.57 -1.32 -1.75 116.57 118.52 1xx2 h LYS 67 Ca 0.09 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.76 1xx2 h LYS 67 Cb 0.44 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.73 1xx2 h LYS 67 CO -0.00 0.06 -0.50 1.79 -0.57 0.00 0.00 179.45 180.23 1xx2 h THR 68 N 0.00 1.36 -0.09 -0.16 1.35 -1.44 -0.75 112.91 113.17 1xx2 h THR 68 Ca -0.00 -1.73 -0.20 0.00 -0.55 0.00 0.00 66.41 63.94 1xx2 h THR 68 Cb 0.19 1.92 0.01 0.00 -1.73 0.00 0.00 68.15 68.54 1xx2 h THR 68 CO 0.01 0.50 -0.71 -0.26 -0.25 0.00 0.00 175.52 174.81 1xx2 h PHE 69 N 0.02 0.89 -0.70 4.73 0.04 -1.47 -2.32 116.94 118.14 1xx2 h PHE 69 Ca -0.00 -0.42 0.03 0.00 2.80 0.00 0.00 57.97 60.38 1xx2 h PHE 69 Cb 0.90 -0.13 -0.04 0.00 2.20 0.00 0.00 35.95 38.88 1xx2 h PHE 69 CO 0.00 1.23 0.44 1.15 -0.60 0.00 0.00 178.31 180.53 1xx2 h THR 70 N 0.30 1.10 -0.69 -1.55 2.02 -1.20 -0.65 112.91 112.24 1xx2 h THR 70 Ca -0.06 -0.30 -0.05 0.00 0.77 0.00 0.00 66.41 66.77 1xx2 h THR 70 Cb 1.35 0.16 -0.03 0.00 -1.74 0.00 0.00 68.15 67.90 1xx2 h THR 70 CO 0.14 0.16 0.22 1.23 0.37 0.00 0.00 175.52 177.65 1xx2 h GLY 71 N 0.86 1.15 1.29 2.16 0.00 -1.11 -0.29 103.07 107.14 1xx2 h GLY 71 Ca 0.28 -0.67 -0.17 0.00 0.00 0.00 0.00 47.33 46.77 1xx2 h GLY 71 CO -0.10 0.63 -0.51 -2.08 0.00 0.00 0.00 176.54 174.48 1xx2 h VAL 72 N 1.01 1.29 -0.67 4.60 2.07 -1.13 0.18 116.25 123.60 1xx2 h VAL 72 Ca 0.22 -1.71 -0.06 0.00 0.82 0.00 0.00 66.70 65.97 1xx2 h VAL 72 Cb 0.29 1.63 -0.03 0.00 -1.52 0.00 0.00 31.29 31.66 1xx2 h VAL 72 CO -0.01 0.55 0.19 0.25 0.02 0.00 0.00 177.57 178.57 1xx2 h LEU 73 N 0.58 1.00 -0.52 2.57 5.85 -0.97 0.27 115.31 124.11 1xx2 h LEU 73 Ca 0.02 -0.22 -0.08 0.00 0.84 0.00 0.00 57.88 58.44 1xx2 h LEU 73 Cb 1.08 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.83 1xx2 h LEU 73 CO 0.11 0.96 0.01 1.23 -0.34 0.00 0.00 178.44 180.41 1xx2 h GLY 74 N 1.00 0.98 1.01 3.75 0.00 -0.91 -1.88 103.07 107.02 1xx2 h GLY 74 Ca 0.21 -0.71 0.01 0.00 0.00 0.00 0.00 47.33 46.84 1xx2 h GLY 74 CO -0.00 0.66 0.49 -1.33 0.00 0.00 0.00 176.54 176.35 1xx2 h GLY 75 N 0.78 1.04 1.13 4.60 0.00 0.24 -1.65 103.07 109.20 1xx2 h GLY 75 Ca 0.15 -0.39 -0.04 0.00 0.00 0.00 0.00 47.33 47.05 1xx2 h GLY 75 CO 0.02 0.38 0.32 -1.80 0.00 0.00 0.00 176.54 175.47 1xx2 h ASP 76 N 1.00 1.02 -0.59 0.19 3.58 -0.34 -0.65 116.42 120.63 1xx2 h ASP 76 Ca 0.27 -0.14 -0.07 0.00 0.42 0.00 0.00 57.03 57.50 1xx2 h ASP 76 Cb -0.11 -0.26 -0.03 0.00 1.72 0.00 0.00 39.33 40.65 1xx2 h ASP 76 CO -0.06 0.89 0.09 0.00 -2.88 0.00 0.00 179.24 177.29 1xx2 h ALA 77 N 1.25 0.99 -0.20 -0.78 0.00 -0.78 -1.82 119.26 117.93 1xx2 h ALA 77 Ca 0.25 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 1xx2 h ALA 77 Cb 0.18 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1xx2 h ALA 77 CO -0.02 0.64 0.03 0.82 0.00 0.00 0.00 179.25 180.71 1xx2 h ILE 78 N 0.95 1.22 -0.09 0.00 2.04 -0.95 -2.46 117.51 118.23 1xx2 h ILE 78 Ca 0.19 -0.73 0.03 0.00 1.00 0.00 0.00 64.86 65.35 1xx2 h ILE 78 Cb 0.42 1.33 -0.00 0.00 -0.74 0.00 0.00 36.82 37.82 1xx2 h ILE 78 CO 0.01 0.23 0.11 0.00 0.00 0.00 0.00 178.15 178.49 1xx2 h ALA 79 N 0.83 1.65 0.00 1.87 0.00 -0.77 -0.28 119.26 122.56 1xx2 h ALA 79 Ca 0.06 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1xx2 h ALA 79 Cb 0.31 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1xx2 h ALA 79 CO 0.00 -0.15 -0.38 0.54 0.00 0.00 0.00 179.25 179.26 1xx2 n ARG 80 N -3.79 0.11 -0.06 0.00 1.74 -0.72 -4.93 116.66 109.02 1xx2 n ARG 80 Ca -0.01 0.05 0.00 0.00 -0.77 0.00 0.00 57.85 57.12 1xx2 n ARG 80 Cb 0.21 -1.59 0.00 0.00 -1.02 0.00 0.00 32.46 30.06 1xx2 n ARG 80 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1xx2 n GLY 81 N 1.43 0.95 0.24 -0.13 0.00 -0.12 -4.93 105.19 102.63 1xx2 n GLY 81 Ca 0.05 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.13 1xx2 n GLY 81 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1xx2 h GLU 82 N 3.50 0.02 -4.44 1.61 5.08 -1.66 -3.45 114.58 115.24 1xx2 h GLU 82 Ca 0.00 -0.00 -0.19 0.00 -1.00 0.00 0.00 59.36 58.16 1xx2 h GLU 82 Cb 0.00 -0.00 -0.16 0.00 0.50 0.00 0.00 28.75 29.08 1xx2 h GLU 82 CO 0.00 0.15 -0.70 0.42 -1.00 0.00 0.00 179.01 177.88 1xx2 s ILE 83 N -4.77 0.46 -0.03 3.13 1.09 -1.19 -4.89 121.20 115.00 1xx2 s ILE 83 Ca -0.04 -1.67 0.01 0.00 -1.10 0.00 0.00 60.65 57.85 1xx2 s ILE 83 Cb 0.16 -1.34 0.01 0.00 -1.06 0.00 0.00 42.46 40.23 1xx2 s ILE 83 CO 0.69 -0.81 -0.05 -0.55 -0.10 0.00 0.00 174.94 174.13 1xx2 s SER 84 N -2.64 0.78 0.49 3.58 0.15 -1.26 -4.34 113.70 110.45 1xx2 s SER 84 Ca 0.04 -0.11 0.16 0.00 0.70 0.00 0.00 55.95 56.75 1xx2 s SER 84 Cb 0.03 -0.28 1.18 0.00 -1.71 0.00 0.00 66.02 65.24 1xx2 s SER 84 CO -0.05 -0.01 2.07 -0.07 1.20 0.00 0.00 173.24 176.38 1xx2 h LEU 85 N 6.72 0.15 -0.26 3.45 4.07 -1.98 -1.26 115.31 126.19 1xx2 h LEU 85 Ca -0.35 -0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.61 1xx2 h LEU 85 Cb 1.16 -0.03 0.00 0.00 1.08 0.00 0.00 40.66 42.87 1xx2 h LEU 85 CO 0.49 0.10 -0.03 0.47 -1.08 0.00 0.00 178.44 178.39 1xx2 n ASP 86 N -4.48 0.43 -4.76 -0.43 9.92 -1.26 -1.14 116.55 114.84 1xx2 n ASP 86 Ca 0.03 -0.92 -0.37 0.00 -0.53 0.00 0.00 54.79 53.00 1xx2 n ASP 86 Cb 0.25 -0.04 0.03 0.00 -0.64 0.00 0.00 41.12 40.71 1xx2 n ASP 86 CO 0.00 0.00 0.00 -1.81 0.13 0.00 0.00 177.20 175.52 1xx2 s ASP 87 N -2.17 5.46 0.39 -2.24 -0.00 -0.48 -4.76 116.67 112.87 1xx2 s ASP 87 Ca 0.39 2.50 -0.24 0.00 -0.00 0.00 0.00 52.55 55.20 1xx2 s ASP 87 Cb 0.21 -2.61 -0.09 0.00 -0.00 0.00 0.00 42.92 40.43 1xx2 s ASP 87 CO 0.40 -1.42 1.03 0.00 -0.00 0.00 0.00 175.17 175.18 1xx2 s ALA 88 N -1.48 3.10 0.36 5.23 0.00 -1.26 -0.92 121.76 126.80 1xx2 s ALA 88 Ca 0.72 0.65 0.03 0.00 0.00 0.00 0.00 51.96 53.37 1xx2 s ALA 88 Cb -0.33 -3.25 0.69 0.00 0.00 0.00 0.00 23.12 20.22 1xx2 s ALA 88 CO 0.38 -0.13 2.01 0.28 0.00 0.00 0.00 175.76 178.31 1xx2 h VAL 89 N 2.23 1.14 0.00 0.00 2.07 -1.76 -1.99 116.25 117.93 1xx2 h VAL 89 Ca -0.48 -0.27 0.00 0.00 0.82 0.00 0.00 66.70 66.77 1xx2 h VAL 89 Cb 1.21 0.27 0.00 0.00 -1.52 0.00 0.00 31.29 31.25 1xx2 h VAL 89 CO 0.63 0.14 0.00 0.35 0.02 0.00 0.00 177.57 178.71 1xx2 n THR 90 N -4.45 1.19 0.06 2.57 -2.24 -1.26 -1.70 114.28 108.45 1xx2 n THR 90 Ca 0.06 0.38 -0.04 0.00 -2.27 0.00 0.00 64.05 62.19 1xx2 n THR 90 Cb 0.06 -1.28 0.18 0.00 -2.10 0.00 0.00 70.33 67.19 1xx2 n THR 90 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 1xx2 h ARG 91 N 0.00 0.34 0.00 -0.78 2.43 -1.74 -2.80 114.38 111.83 1xx2 h ARG 91 Ca 0.00 -0.17 0.00 0.00 -0.81 0.00 0.00 59.98 59.00 1xx2 h ARG 91 Cb 0.18 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.73 1xx2 h ARG 91 CO 0.00 0.71 -1.82 0.66 -1.51 0.00 0.00 179.97 178.00 1xx2 n TYR 92 N -4.02 0.01 -3.42 2.20 4.01 -0.69 -4.64 117.16 110.61 1xx2 n TYR 92 Ca -0.02 0.00 -0.27 0.00 -0.16 0.00 0.00 57.90 57.46 1xx2 n TYR 92 Cb 0.50 -0.42 -0.10 0.00 -0.31 0.00 0.00 39.34 39.01 1xx2 n TYR 92 CO 0.00 0.00 0.00 1.87 -0.46 0.00 0.00 176.86 178.27 1xx2 n TRP 93 N -2.13 -0.40 0.31 -0.72 -0.00 -0.89 -4.99 117.44 108.61 1xx2 n TRP 93 Ca -0.03 -3.44 0.19 0.00 -0.00 0.00 0.00 57.50 54.22 1xx2 n TRP 93 Cb 0.53 0.10 1.05 0.00 -0.00 0.00 0.00 31.31 32.99 1xx2 n TRP 93 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 177.69 176.69 1xx2 h PRO 94 N 5.41 0.00 0.00 5.87 0.13 -1.76 -2.37 132.00 139.28 1xx2 h PRO 94 Ca 0.24 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.37 1xx2 h PRO 94 Cb 0.89 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.02 1xx2 h PRO 94 CO 0.42 0.00 0.00 1.04 -0.23 0.00 0.00 178.00 179.23 1xx2 n GLN 95 N -3.45 0.20 -2.33 0.86 3.00 -1.26 -4.25 117.38 110.16 1xx2 n GLN 95 Ca -0.03 0.38 -0.41 0.00 -0.01 0.00 0.00 57.00 56.94 1xx2 n GLN 95 Cb 0.11 -1.86 -0.01 0.00 0.00 0.00 0.00 30.24 28.48 1xx2 n GLN 95 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.06 176.95 1xx2 n LEU 96 N -2.23 4.91 0.01 1.08 7.94 -0.89 -4.76 117.00 123.06 1xx2 n LEU 96 Ca 0.03 -3.81 0.13 0.00 -1.11 0.00 0.00 56.01 51.25 1xx2 n LEU 96 Cb 0.26 -1.71 0.37 0.00 0.53 0.00 0.00 43.42 42.87 1xx2 n LEU 96 CO 0.21 -0.02 0.63 0.35 -1.11 0.00 0.00 177.39 177.45 1xx2 n THR 97 N 6.41 0.09 -1.65 1.96 -2.24 -1.26 -4.88 114.28 112.70 1xx2 n THR 97 Ca 0.49 -0.06 -0.44 0.00 -2.27 0.00 0.00 64.05 61.77 1xx2 n THR 97 Cb 0.45 -0.09 -0.01 0.00 -2.10 0.00 0.00 70.33 68.57 1xx2 n THR 97 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xx2 n GLY 98 N 1.47 0.29 0.32 3.38 0.00 -1.26 -4.85 105.19 104.52 1xx2 n GLY 98 Ca 0.06 0.35 0.20 0.00 0.00 0.00 0.00 46.02 46.63 1xx2 n GLY 98 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xx2 h LYS 99 N 2.62 0.00 0.00 1.61 1.57 -1.94 -1.34 116.57 119.09 1xx2 h LYS 99 Ca -0.43 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.35 1xx2 h LYS 99 Cb 1.31 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.62 1xx2 h LYS 99 CO 0.64 0.01 0.00 0.00 -0.57 0.00 0.00 179.45 179.53 1xx2 n GLN 100 N -3.26 0.04 0.00 3.15 0.00 -1.26 -2.24 117.38 113.81 1xx2 n GLN 100 Ca -0.02 0.20 0.12 0.00 0.00 0.00 0.00 57.00 57.30 1xx2 n GLN 100 Cb 0.12 -1.56 0.31 0.00 0.00 0.00 0.00 30.24 29.11 1xx2 n GLN 100 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.06 177.97 1xx2 n TRP 101 N -1.63 0.00 -2.38 2.61 7.02 -0.50 -4.80 117.44 117.75 1xx2 n TRP 101 Ca 0.04 0.00 -0.42 0.00 -1.02 0.00 0.00 57.50 56.10 1xx2 n TRP 101 Cb 0.24 -0.18 -0.03 0.00 -2.42 0.00 0.00 31.31 28.92 1xx2 n TRP 101 CO 0.00 0.00 0.00 -0.65 -2.02 0.00 0.00 177.69 175.02 1xx2 s GLN 102 N -2.75 4.35 0.00 -0.99 -0.21 -0.95 -2.54 119.66 116.58 1xx2 s GLN 102 Ca 0.18 1.78 0.00 0.00 0.02 0.00 0.00 55.36 57.34 1xx2 s GLN 102 Cb 0.18 -3.50 0.00 0.00 1.00 0.00 0.00 33.01 30.70 1xx2 s GLN 102 CO 0.61 -0.43 0.00 0.41 -2.12 0.00 0.00 175.29 173.76 1xx2 n GLY 103 N 3.40 0.26 3.72 3.09 0.00 -1.26 -5.05 105.19 109.35 1xx2 n GLY 103 Ca 0.11 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.74 1xx2 n GLY 103 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xx2 s ILE 104 N -2.09 5.07 0.43 -0.61 1.01 -1.05 -4.99 121.20 118.98 1xx2 s ILE 104 Ca 0.00 1.35 0.08 0.00 0.00 0.00 0.00 60.65 62.07 1xx2 s ILE 104 Cb 0.00 -4.00 -0.00 0.00 0.01 0.00 0.00 42.46 38.47 1xx2 s ILE 104 CO 0.00 0.26 0.45 -0.13 0.00 0.00 0.00 174.94 175.53 1xx2 s ARG 105 N 0.78 2.59 0.28 2.79 0.52 -1.26 -2.52 118.95 122.13 1xx2 s ARG 105 Ca 0.35 -1.49 -0.00 0.00 -0.52 0.00 0.00 55.73 54.07 1xx2 s ARG 105 Cb -0.17 -2.48 0.41 0.00 0.52 0.00 0.00 34.95 33.23 1xx2 s ARG 105 CO 0.16 -0.27 1.80 0.52 0.02 0.00 0.00 175.30 177.54 1xx2 h MET 106 N 0.87 0.74 -0.79 3.54 2.86 -0.88 -2.68 114.93 118.59 1xx2 h MET 106 Ca -0.40 -0.18 0.08 0.00 -2.06 0.00 0.00 59.70 57.14 1xx2 h MET 106 Cb 1.27 -0.10 -0.07 0.00 0.06 0.00 0.00 31.60 32.77 1xx2 h MET 106 CO 0.53 0.73 0.46 1.25 1.06 0.00 0.00 176.91 180.94 1xx2 h LEU 107 N 0.70 0.68 -0.66 1.22 5.85 -1.40 -1.58 115.31 120.12 1xx2 h LEU 107 Ca 0.15 0.04 -0.04 0.00 0.84 0.00 0.00 57.88 58.86 1xx2 h LEU 107 Cb 0.38 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 41.28 1xx2 h LEU 107 CO 0.01 0.41 0.25 0.44 -0.34 0.00 0.00 178.44 179.22 1xx2 h ASP 108 N 0.80 0.92 -0.34 1.25 3.32 -1.77 0.47 116.42 121.06 1xx2 h ASP 108 Ca 0.37 -0.18 -0.02 0.00 0.02 0.00 0.00 57.03 57.22 1xx2 h ASP 108 Cb 0.27 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.57 1xx2 h ASP 108 CO -0.21 0.85 0.15 -0.07 -1.72 0.00 0.00 179.24 178.23 1xx2 h LEU 109 N 0.93 0.46 -1.16 1.55 3.38 -1.29 -1.56 115.31 117.62 1xx2 h LEU 109 Ca 0.22 -0.15 -0.08 0.00 0.09 0.00 0.00 57.88 57.95 1xx2 h LEU 109 Cb 0.22 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 1xx2 h LEU 109 CO -0.02 0.49 -0.36 0.00 0.09 0.00 0.00 178.44 178.64 1xx2 h ALA 110 N 0.99 1.30 -0.34 1.53 0.00 -0.93 -2.90 119.26 118.92 1xx2 h ALA 110 Ca 0.11 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1xx2 h ALA 110 Cb 0.16 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1xx2 h ALA 110 CO -0.01 0.50 0.00 0.25 0.00 0.00 0.00 179.25 179.99 1xx2 n THR 111 N -4.09 1.82 -1.80 0.00 -2.24 0.12 -4.56 114.28 103.52 1xx2 n THR 111 Ca -0.02 -1.49 -0.13 0.00 -2.27 0.00 0.00 64.05 60.14 1xx2 n THR 111 Cb 0.42 0.04 -0.03 0.00 -2.10 0.00 0.00 70.33 68.66 1xx2 n THR 111 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1xx2 n TYR 112 N 0.06 -0.30 -0.59 4.78 0.53 -0.79 -4.84 117.16 116.00 1xx2 n TYR 112 Ca 0.19 0.00 0.07 0.00 -1.02 0.00 0.00 57.90 57.14 1xx2 n TYR 112 Cb 0.74 -2.63 0.23 0.00 -1.03 0.00 0.00 39.34 36.65 1xx2 n TYR 112 CO 0.00 0.00 0.00 0.25 -1.02 0.00 0.00 176.86 176.09 1xx2 n THR 113 N -3.29 1.69 0.28 -0.72 -2.24 -0.66 -1.72 114.28 107.62 1xx2 n THR 113 Ca -0.14 -1.41 0.13 0.00 -2.27 0.00 0.00 64.05 60.36 1xx2 n THR 113 Cb 0.52 0.12 0.81 0.00 -2.10 0.00 0.00 70.33 69.68 1xx2 n THR 113 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1xx2 h ALA 114 N 2.24 1.42 0.00 6.98 0.00 -1.80 -0.96 119.26 127.13 1xx2 h ALA 114 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1xx2 h ALA 114 Cb 1.15 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.93 1xx2 h ALA 114 CO 0.13 0.08 0.00 0.41 0.00 0.00 0.00 179.25 179.88 1xx2 n GLY 115 N -1.00 1.64 0.00 0.00 0.00 -1.26 -4.11 105.19 100.46 1xx2 n GLY 115 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1xx2 n GLY 115 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xx2 n GLY 116 N 0.00 1.35 3.73 -0.02 0.00 -1.26 -1.50 105.19 107.50 1xx2 n GLY 116 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1xx2 n GLY 116 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1xx2 n LEU 117 N 0.00 4.11 -4.71 0.99 4.77 -1.26 -4.80 117.00 116.10 1xx2 n LEU 117 Ca 0.00 1.17 -0.35 0.00 -0.03 0.00 0.00 56.01 56.81 1xx2 n LEU 117 Cb 0.00 -1.55 0.10 0.00 -2.33 0.00 0.00 43.42 39.64 1xx2 n LEU 117 CO 0.00 -0.05 0.81 -2.16 -1.33 0.00 0.00 177.39 174.66 1xx2 s PRO 118 N -1.04 2.02 0.14 3.23 0.04 -1.26 -4.73 135.00 133.40 1xx2 s PRO 118 Ca 0.61 1.84 -0.19 0.00 0.04 0.00 0.00 61.00 63.30 1xx2 s PRO 118 Cb -0.53 -1.81 0.01 0.00 0.04 0.00 0.00 34.50 32.21 1xx2 s PRO 118 CO 0.54 -1.95 1.70 1.25 0.04 0.00 0.00 177.00 178.58 1xx2 h LEU 119 N -0.35 -0.20 -9.33 -3.56 5.85 -1.91 -3.17 115.31 102.63 1xx2 h LEU 119 Ca -0.48 0.07 -0.62 0.00 0.84 0.00 0.00 57.88 57.69 1xx2 h LEU 119 Cb 1.31 0.14 -0.14 0.00 0.37 0.00 0.00 40.66 42.34 1xx2 h LEU 119 CO 0.49 -0.07 -0.72 -1.10 -0.34 0.00 0.00 178.44 176.70 1xx2 s GLN 120 N -6.20 2.06 -0.00 1.25 -1.52 -1.26 -0.41 119.66 113.58 1xx2 s GLN 120 Ca -0.13 -1.30 -0.26 0.00 -1.95 0.00 0.00 55.36 51.72 1xx2 s GLN 120 Cb 0.11 -2.15 -0.04 0.00 -0.22 0.00 0.00 33.01 30.72 1xx2 s GLN 120 CO 0.69 0.43 0.82 0.08 -0.25 0.00 0.00 175.29 177.06 1xx2 s VAL 121 N -1.77 4.87 0.26 1.09 1.01 -1.26 -4.74 120.40 119.85 1xx2 s VAL 121 Ca 0.25 1.72 -0.31 0.00 0.00 0.00 0.00 61.98 63.65 1xx2 s VAL 121 Cb -0.08 -4.16 -0.13 0.00 0.00 0.00 0.00 36.38 32.00 1xx2 s VAL 121 CO 0.15 0.26 1.46 -2.65 0.00 0.00 0.00 175.10 174.32 1xx2 n PRO 122 N 3.48 2.25 0.12 2.72 -0.02 -1.26 -4.84 135.00 137.45 1xx2 n PRO 122 Ca 0.01 0.80 0.10 0.00 -2.02 0.00 0.00 63.50 62.39 1xx2 n PRO 122 Cb 0.51 -2.49 0.46 0.00 -0.02 0.00 0.00 33.50 31.96 1xx2 n PRO 122 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1xx2 n ASP 123 N 2.09 0.49 0.23 2.55 5.68 -1.26 -0.66 116.55 125.67 1xx2 n ASP 123 Ca 0.10 0.67 0.16 0.00 -0.50 0.00 0.00 54.79 55.23 1xx2 n ASP 123 Cb 0.33 -0.76 0.75 0.00 -1.14 0.00 0.00 41.12 40.31 1xx2 n ASP 123 CO 0.00 0.00 0.00 -0.08 -1.33 0.00 0.00 177.20 175.79 1xx2 h GLU 124 N 0.00 0.00 -5.41 0.11 4.81 -2.03 -3.40 114.58 108.66 1xx2 h GLU 124 Ca 0.00 0.00 -0.63 0.00 -0.13 0.00 0.00 59.36 58.60 1xx2 h GLU 124 Cb 0.17 0.00 -0.13 0.00 0.63 0.00 0.00 28.75 29.42 1xx2 h GLU 124 CO 0.00 0.00 0.08 0.08 -0.73 0.00 0.00 179.01 178.44 1xx2 s VAL 125 N -3.67 4.95 0.00 0.32 1.01 0.16 -4.91 120.40 118.26 1xx2 s VAL 125 Ca -0.00 0.63 0.00 0.00 0.00 0.00 0.00 61.98 62.61 1xx2 s VAL 125 Cb 0.09 -4.00 0.00 0.00 0.00 0.00 0.00 36.38 32.47 1xx2 s VAL 125 CO 0.41 -0.20 0.16 0.35 0.00 0.00 0.00 175.10 175.82 1xx2 n THR 126 N 5.45 0.00 -3.98 3.92 -2.24 -1.26 -4.63 114.28 111.54 1xx2 n THR 126 Ca -0.02 -0.26 -0.11 0.00 -2.27 0.00 0.00 64.05 61.39 1xx2 n THR 126 Cb 0.49 1.30 -0.03 0.00 -2.10 0.00 0.00 70.33 69.99 1xx2 n THR 126 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 1xx2 s ASP 127 N -0.19 0.28 0.24 3.42 1.47 -1.26 -5.01 116.67 115.61 1xx2 s ASP 127 Ca 0.00 -1.15 -0.05 0.00 1.18 0.00 0.00 52.55 52.52 1xx2 s ASP 127 Cb 0.00 0.68 0.38 0.00 -0.34 0.00 0.00 42.92 43.64 1xx2 s ASP 127 CO 0.00 -1.33 1.79 -1.13 0.68 0.00 0.00 175.17 175.19 1xx2 h ASN 128 N 2.13 0.58 -0.08 2.11 -1.24 -1.99 0.26 115.58 117.35 1xx2 h ASN 128 Ca -0.28 0.06 -0.00 0.00 0.71 0.00 0.00 56.30 56.79 1xx2 h ASN 128 Cb 1.25 -0.05 -0.00 0.00 0.73 0.00 0.00 38.32 40.24 1xx2 h ASN 128 CO 0.37 0.32 0.05 0.00 -1.29 0.00 0.00 177.43 176.88 1xx2 h ALA 129 N 1.45 0.10 -0.10 1.57 0.00 -1.99 0.52 119.26 120.80 1xx2 h ALA 129 Ca 0.38 -0.02 -0.13 0.00 0.00 0.00 0.00 54.91 55.14 1xx2 h ALA 129 Cb 0.38 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1xx2 h ALA 129 CO -0.26 -0.39 -0.51 0.66 0.00 0.00 0.00 179.25 178.75 1xx2 h SER 130 N 0.07 0.31 -0.30 0.00 4.64 -1.84 -1.62 113.55 114.81 1xx2 h SER 130 Ca 0.03 -0.15 -0.05 0.00 -0.47 0.00 0.00 61.79 61.15 1xx2 h SER 130 Cb 0.03 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 62.02 1xx2 h SER 130 CO -0.01 0.77 0.01 0.25 -0.87 0.00 0.00 176.83 176.98 1xx2 h LEU 131 N 0.22 0.51 -0.67 5.97 5.85 -0.29 -0.63 115.31 126.27 1xx2 h LEU 131 Ca 0.01 -0.30 -0.03 0.00 0.84 0.00 0.00 57.88 58.40 1xx2 h LEU 131 Cb 0.98 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.84 1xx2 h LEU 131 CO 0.08 0.69 0.30 0.25 -0.34 0.00 0.00 178.44 179.42 1xx2 h LEU 132 N 0.32 0.90 -0.60 2.25 5.85 -0.79 -2.64 115.31 120.60 1xx2 h LEU 132 Ca 0.09 -0.15 0.03 0.00 0.84 0.00 0.00 57.88 58.69 1xx2 h LEU 132 Cb 0.42 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 41.18 1xx2 h LEU 132 CO 0.01 0.80 0.37 -0.09 -0.34 0.00 0.00 178.44 179.19 1xx2 h ARG 133 N 0.94 0.70 -0.44 1.25 2.43 -1.05 -0.93 114.38 117.28 1xx2 h ARG 133 Ca 0.23 -0.04 0.06 0.00 -0.81 0.00 0.00 59.98 59.41 1xx2 h ARG 133 Cb 0.15 -0.16 -0.05 0.00 -0.42 0.00 0.00 29.97 29.49 1xx2 h ARG 133 CO -0.03 0.47 0.15 0.35 -1.51 0.00 0.00 179.97 179.40 1xx2 h PHE 134 N 0.72 0.26 -0.07 2.20 3.57 -0.76 -1.80 116.94 121.06 1xx2 h PHE 134 Ca 0.24 0.02 -0.18 0.00 3.53 0.00 0.00 57.97 61.59 1xx2 h PHE 134 Cb 0.03 -0.05 -0.01 0.00 2.79 0.00 0.00 35.95 38.71 1xx2 h PHE 134 CO -0.06 0.09 -0.72 1.88 -2.23 0.00 0.00 178.31 177.28 1xx2 h TYR 135 N 0.31 0.49 -0.35 0.41 0.05 -1.25 -2.33 116.97 114.30 1xx2 h TYR 135 Ca 0.21 -0.21 -0.07 0.00 0.05 0.00 0.00 58.73 58.70 1xx2 h TYR 135 Cb 0.21 -0.08 -0.02 0.00 1.01 0.00 0.00 36.73 37.85 1xx2 h TYR 135 CO -0.16 0.96 -0.07 1.96 -1.05 0.00 0.00 178.16 179.79 1xx2 h GLN 136 N 0.25 0.59 -0.00 4.88 1.08 -0.94 -3.08 115.11 117.89 1xx2 h GLN 136 Ca -0.03 -0.16 0.00 0.00 -1.45 0.00 0.00 58.65 57.01 1xx2 h GLN 136 Cb 1.28 -0.07 0.00 0.00 -0.05 0.00 0.00 27.48 28.65 1xx2 h GLN 136 CO 0.12 0.67 -0.57 0.09 -0.95 0.00 0.00 178.83 178.19 1xx2 n ASN 137 N -4.21 0.60 -4.72 1.46 5.03 -0.70 -4.78 115.26 107.94 1xx2 n ASN 137 Ca 0.01 -0.39 -0.42 0.00 0.87 0.00 0.00 54.58 54.65 1xx2 n ASN 137 Cb 0.31 0.36 -0.03 0.00 -1.02 0.00 0.00 39.78 39.40 1xx2 n ASN 137 CO 0.00 0.00 0.00 1.87 -1.83 0.00 0.00 177.26 177.30 1xx2 n TRP 138 N -1.47 2.72 -3.85 3.10 -0.00 -0.88 -4.98 117.44 112.08 1xx2 n TRP 138 Ca 0.05 0.08 -0.36 0.00 -0.00 0.00 0.00 57.50 57.28 1xx2 n TRP 138 Cb 0.34 -2.66 -0.13 0.00 -0.00 0.00 0.00 31.31 28.86 1xx2 n TRP 138 CO 0.00 0.00 0.00 -0.65 -0.00 0.00 0.00 177.69 177.04 1xx2 s GLN 139 N 0.96 2.90 0.29 5.87 -1.52 -1.26 -4.98 119.66 121.91 1xx2 s GLN 139 Ca 0.74 -0.96 -0.29 0.00 -1.95 0.00 0.00 55.36 52.90 1xx2 s GLN 139 Cb -0.52 -3.21 -0.10 0.00 -0.22 0.00 0.00 33.01 28.97 1xx2 s GLN 139 CO 0.35 -0.46 1.29 -1.25 -0.25 0.00 0.00 175.29 174.97 1xx2 s PRO 140 N 1.40 4.39 0.08 2.91 0.04 -1.26 -4.95 135.00 137.61 1xx2 s PRO 140 Ca 0.01 2.14 0.11 0.00 0.04 0.00 0.00 61.00 63.30 1xx2 s PRO 140 Cb -0.17 -3.11 -0.18 0.00 0.04 0.00 0.00 34.50 31.08 1xx2 s PRO 140 CO -0.01 -0.17 1.06 1.96 0.04 0.00 0.00 177.00 179.88 1xx2 h GLN 141 N 3.97 0.00 -4.90 4.56 4.20 -1.58 -3.47 115.11 117.89 1xx2 h GLN 141 Ca -0.48 0.00 -0.33 0.00 0.06 0.00 0.00 58.65 57.91 1xx2 h GLN 141 Cb 1.22 0.00 -0.15 0.00 0.30 0.00 0.00 27.48 28.86 1xx2 h GLN 141 CO 0.69 0.70 -0.65 -1.58 -0.67 0.00 0.00 178.83 177.32 1xx2 s TRP 142 N -2.73 1.37 0.50 2.96 0.51 -1.09 -5.06 118.94 115.40 1xx2 s TRP 142 Ca -0.01 -1.02 -0.19 0.00 -2.12 0.00 0.00 56.10 52.76 1xx2 s TRP 142 Cb 0.09 -0.79 -0.08 0.00 -0.81 0.00 0.00 33.47 31.88 1xx2 s TRP 142 CO 0.81 -0.18 1.01 0.15 -0.51 0.00 0.00 176.95 178.23 1xx2 s LYS 143 N -3.92 3.85 0.53 4.98 1.02 -1.26 -4.47 119.74 120.47 1xx2 s LYS 143 Ca 0.28 1.20 -0.22 0.00 0.02 0.00 0.00 55.97 57.25 1xx2 s LYS 143 Cb 0.06 -2.11 -0.06 0.00 -0.52 0.00 0.00 37.83 35.20 1xx2 s LYS 143 CO 0.07 -0.37 1.28 -0.35 -0.92 0.00 0.00 175.35 175.06 1xx2 n PRO 144 N -1.18 1.61 -2.07 -1.68 -0.04 -1.26 -3.18 135.00 127.20 1xx2 n PRO 144 Ca 0.08 0.59 -0.14 0.00 -0.04 0.00 0.00 63.50 63.99 1xx2 n PRO 144 Cb 0.53 -2.48 -0.02 0.00 -0.04 0.00 0.00 33.50 31.50 1xx2 n PRO 144 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1xx2 n GLY 145 N 0.85 0.17 0.00 0.55 0.00 -0.36 -4.87 105.19 101.52 1xx2 n GLY 145 Ca 0.10 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.80 1xx2 n GLY 145 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1xx2 n THR 146 N -3.69 0.00 -4.06 2.61 -2.24 -1.19 -4.91 114.28 100.80 1xx2 n THR 146 Ca -0.16 0.00 -0.17 0.00 -2.27 0.00 0.00 64.05 61.46 1xx2 n THR 146 Cb 0.59 -0.65 -0.15 0.00 -2.10 0.00 0.00 70.33 68.01 1xx2 n THR 146 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1xx2 s THR 147 N -1.69 0.32 -0.19 4.28 2.01 -1.26 -2.50 115.64 116.61 1xx2 s THR 147 Ca 0.00 -0.08 -0.13 0.00 0.31 0.00 0.00 61.69 61.79 1xx2 s THR 147 Cb 0.00 -0.33 -0.05 0.00 0.01 0.00 0.00 72.50 72.13 1xx2 s THR 147 CO 0.00 0.13 0.26 -0.60 -0.69 0.00 0.00 174.62 173.72 1xx2 s ARG 148 N 0.45 4.20 -0.29 4.92 3.52 0.69 -4.30 118.95 128.14 1xx2 s ARG 148 Ca -0.05 -0.01 -0.04 0.00 -0.13 0.00 0.00 55.73 55.51 1xx2 s ARG 148 Cb -0.08 -3.46 0.10 0.00 -1.56 0.00 0.00 34.95 29.95 1xx2 s ARG 148 CO -0.01 0.18 0.13 -1.17 -0.81 0.00 0.00 175.30 173.62 1xx2 s LEU 149 N 0.68 0.78 0.05 -0.88 2.96 -0.70 -1.81 118.68 119.76 1xx2 s LEU 149 Ca 0.14 -1.34 -0.37 0.00 -0.22 0.00 0.00 54.13 52.34 1xx2 s LEU 149 Cb -0.13 -0.42 -0.16 0.00 0.50 0.00 0.00 46.19 45.98 1xx2 s LEU 149 CO 0.03 -0.44 1.40 0.00 -1.32 0.00 0.00 176.35 176.03 1xx2 n TYR 150 N 5.19 1.63 -3.64 5.38 4.19 -1.26 -4.80 117.16 123.86 1xx2 n TYR 150 Ca -0.05 0.59 -0.10 0.00 3.31 0.00 0.00 57.90 61.64 1xx2 n TYR 150 Cb 0.42 -2.36 -0.07 0.00 0.49 0.00 0.00 39.34 37.82 1xx2 n TYR 150 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 1xx2 s ALA 151 N 0.85 -1.84 0.21 2.98 0.00 -1.26 -4.45 121.76 118.26 1xx2 s ALA 151 Ca 0.85 2.22 -0.00 0.00 0.00 0.00 0.00 51.96 55.03 1xx2 s ALA 151 Cb -0.94 -1.31 0.19 0.00 0.00 0.00 0.00 23.12 21.06 1xx2 s ALA 151 CO 0.48 -0.36 1.55 -0.91 0.00 0.00 0.00 175.76 176.52 1xx2 h ASN 152 N 5.96 0.51 0.37 0.00 2.35 -0.84 -2.80 115.58 121.12 1xx2 h ASN 152 Ca -0.29 -0.26 0.00 0.00 -0.55 0.00 0.00 56.30 55.19 1xx2 h ASN 152 Cb 1.19 -0.15 0.00 0.00 0.05 0.00 0.00 38.32 39.42 1xx2 h ASN 152 CO 0.11 0.94 0.00 0.00 -1.65 0.00 0.00 177.43 176.83 1xx2 h ALA 153 N 1.07 1.00 0.00 -0.83 0.00 -1.62 0.69 119.26 119.58 1xx2 h ALA 153 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1xx2 h ALA 153 Cb 1.04 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.83 1xx2 h ALA 153 CO 0.09 0.00 -0.18 0.45 0.00 0.00 0.00 179.25 179.61 1xx2 n SER 154 N -2.62 0.61 0.29 0.00 2.88 -1.07 -3.83 113.62 109.88 1xx2 n SER 154 Ca -0.01 0.37 0.18 0.00 -1.33 0.00 0.00 58.87 58.08 1xx2 n SER 154 Cb 0.14 -0.62 0.77 0.00 -0.75 0.00 0.00 64.21 63.75 1xx2 n SER 154 CO 0.00 0.00 0.00 -0.29 -1.23 0.00 0.00 175.04 173.52 1xx2 h ILE 155 N -0.34 0.01 -0.11 2.46 2.10 -1.39 -2.44 117.51 117.80 1xx2 h ILE 155 Ca 0.00 -0.44 -0.00 0.00 1.08 0.00 0.00 64.86 65.50 1xx2 h ILE 155 Cb 0.18 1.43 -0.01 0.00 -1.09 0.00 0.00 36.82 37.33 1xx2 h ILE 155 CO 0.00 0.00 0.05 1.23 -1.08 0.00 0.00 178.15 178.35 1xx2 h GLY 156 N 1.70 0.18 1.26 8.18 0.00 -1.06 -1.78 103.07 111.55 1xx2 h GLY 156 Ca -0.00 -0.09 -0.10 0.00 0.00 0.00 0.00 47.33 47.14 1xx2 h GLY 156 CO 0.00 0.09 -0.08 -2.00 0.00 0.00 0.00 176.54 174.54 1xx2 h LEU 157 N 0.04 0.86 -0.24 3.11 5.85 -1.55 -2.58 115.31 120.80 1xx2 h LEU 157 Ca 0.04 -0.26 0.06 0.00 0.84 0.00 0.00 57.88 58.56 1xx2 h LEU 157 Cb 0.14 -0.23 -0.06 0.00 0.37 0.00 0.00 40.66 40.88 1xx2 h LEU 157 CO -0.00 0.97 -0.12 0.15 -0.34 0.00 0.00 178.44 179.09 1xx2 h PHE 158 N 0.79 -0.30 -0.72 1.25 3.57 -1.15 -0.75 116.94 119.64 1xx2 h PHE 158 Ca 0.13 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.64 1xx2 h PHE 158 Cb 0.59 0.17 -0.03 0.00 2.79 0.00 0.00 35.95 39.46 1xx2 h PHE 158 CO 0.03 -0.19 0.36 0.78 -2.23 0.00 0.00 178.31 177.07 1xx2 h GLY 159 N -0.09 1.10 1.09 2.40 0.00 -1.20 0.16 103.07 106.52 1xx2 h GLY 159 Ca 0.13 -0.53 -0.02 0.00 0.00 0.00 0.00 47.33 46.91 1xx2 h GLY 159 CO -0.30 0.50 0.44 0.00 0.00 0.00 0.00 176.54 177.18 1xx2 h ALA 160 N 1.18 1.19 0.11 3.60 0.00 -1.03 -3.05 119.26 121.25 1xx2 h ALA 160 Ca 0.25 -0.14 -0.27 0.00 0.00 0.00 0.00 54.91 54.75 1xx2 h ALA 160 Cb 0.09 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.54 1xx2 h ALA 160 CO -0.03 0.64 -1.25 -0.07 0.00 0.00 0.00 179.25 178.53 1xx2 h LEU 161 N 1.18 0.35 -2.13 0.00 3.38 -0.87 -3.34 115.31 113.88 1xx2 h LEU 161 Ca 0.29 -0.39 0.06 0.00 0.09 0.00 0.00 57.88 57.94 1xx2 h LEU 161 Cb 0.06 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1xx2 h LEU 161 CO -0.04 1.31 0.18 0.00 0.09 0.00 0.00 178.44 179.98 1xx2 h ALA 162 N 0.64 2.01 -0.01 1.53 0.00 -0.58 -2.22 119.26 120.63 1xx2 h ALA 162 Ca -0.13 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1xx2 h ALA 162 Cb 1.95 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.75 1xx2 h ALA 162 CO 0.18 -0.29 -0.25 1.33 0.00 0.00 0.00 179.25 180.22 1xx2 n VAL 163 N -4.14 0.00 -0.37 0.00 0.24 -1.22 -4.42 118.33 108.43 1xx2 n VAL 163 Ca 0.02 -0.21 -0.01 0.00 -2.04 0.00 0.00 64.34 62.11 1xx2 n VAL 163 Cb 0.32 0.71 0.13 0.00 -1.47 0.00 0.00 33.84 33.53 1xx2 n VAL 163 CO 0.00 0.00 0.00 0.11 -2.14 0.00 0.00 176.83 174.80 1xx2 h LYS 164 N 1.94 1.27 0.00 7.34 1.57 -1.56 -1.90 116.57 125.23 1xx2 h LYS 164 Ca 0.00 -0.08 -0.03 0.00 -1.87 0.00 0.00 60.65 58.67 1xx2 h LYS 164 Cb 0.60 -0.29 -0.00 0.00 0.08 0.00 0.00 32.23 32.62 1xx2 h LYS 164 CO 0.00 0.84 -0.16 -1.35 -0.57 0.00 0.00 179.45 178.20 1xx2 h PRO 165 N 1.30 0.00 -0.04 3.15 0.11 -1.79 -2.16 132.00 132.57 1xx2 h PRO 165 Ca 0.38 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 66.41 1xx2 h PRO 165 Cb -0.09 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.01 1xx2 h PRO 165 CO -0.10 0.16 -0.33 0.66 -0.21 0.00 0.00 178.00 178.19 1xx2 h SER 166 N 0.00 0.08 0.00 -2.05 4.64 -1.63 -3.46 113.55 111.13 1xx2 h SER 166 Ca -0.00 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 1xx2 h SER 166 Cb 0.41 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.48 1xx2 h SER 166 CO 0.02 0.41 0.00 0.61 -0.87 0.00 0.00 176.83 177.00 1xx2 n GLY 167 N -0.51 1.46 3.95 -0.77 0.00 -0.81 -5.04 105.19 103.46 1xx2 n GLY 167 Ca -0.02 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.75 1xx2 n GLY 167 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1xx2 s MET 168 N -0.43 3.46 0.55 1.61 -1.94 -1.26 -5.09 119.30 116.21 1xx2 s MET 168 Ca 0.00 -0.56 -0.19 0.00 -1.71 0.00 0.00 55.69 53.23 1xx2 s MET 168 Cb 0.00 -2.91 -0.06 0.00 2.01 0.00 0.00 34.83 33.87 1xx2 s MET 168 CO 0.00 0.46 1.10 -2.14 -0.01 0.00 0.00 175.02 174.44 1xx2 s PRO 169 N -3.45 3.37 0.19 2.03 0.02 -1.26 -4.72 135.00 131.18 1xx2 s PRO 169 Ca 0.35 1.51 -0.23 0.00 0.02 0.00 0.00 61.00 62.66 1xx2 s PRO 169 Cb -0.11 -2.02 0.10 0.00 0.02 0.00 0.00 34.50 32.50 1xx2 s PRO 169 CO 0.29 -0.81 1.57 -0.92 -0.33 0.00 0.00 177.00 176.80 1xx2 h TYR 170 N 1.08 -1.19 -0.76 6.54 3.20 -1.94 0.07 116.97 123.97 1xx2 h TYR 170 Ca -0.49 0.09 0.10 0.00 3.14 0.00 0.00 58.73 61.56 1xx2 h TYR 170 Cb 1.25 0.62 -0.05 0.00 1.54 0.00 0.00 36.73 40.09 1xx2 h TYR 170 CO 0.53 -0.40 0.50 1.49 -1.64 0.00 0.00 178.16 178.64 1xx2 h GLU 171 N -0.14 0.65 -0.01 1.82 4.81 -1.99 0.40 114.58 120.12 1xx2 h GLU 171 Ca 0.23 -0.04 -0.26 0.00 -0.13 0.00 0.00 59.36 59.16 1xx2 h GLU 171 Cb 0.56 -0.15 0.02 0.00 0.63 0.00 0.00 28.75 29.81 1xx2 h GLU 171 CO -0.78 0.43 -1.02 0.37 -0.73 0.00 0.00 179.01 177.29 1xx2 h GLN 172 N 0.67 0.69 -0.57 1.92 4.15 -1.45 -2.24 115.11 118.28 1xx2 h GLN 172 Ca 0.35 -0.72 -0.03 0.00 0.77 0.00 0.00 58.65 59.01 1xx2 h GLN 172 Cb 0.47 0.20 -0.03 0.00 0.21 0.00 0.00 27.48 28.34 1xx2 h GLN 172 CO -0.13 1.31 0.23 0.00 -1.93 0.00 0.00 178.83 178.30 1xx2 h ALA 173 N 0.45 0.74 -0.72 3.38 0.00 -0.40 -0.55 119.26 122.15 1xx2 h ALA 173 Ca -0.12 -0.16 -0.07 0.00 0.00 0.00 0.00 54.91 54.56 1xx2 h ALA 173 Cb 1.67 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 19.20 1xx2 h ALA 173 CO 0.20 0.36 0.19 1.98 0.00 0.00 0.00 179.25 181.98 1xx2 h MET 174 N 0.78 1.14 -0.09 0.00 1.85 -0.94 -1.72 114.93 115.96 1xx2 h MET 174 Ca 0.19 -0.26 -0.07 0.00 -0.61 0.00 0.00 59.70 58.95 1xx2 h MET 174 Cb 0.20 -0.16 0.00 0.00 0.43 0.00 0.00 31.60 32.08 1xx2 h MET 174 CO -0.02 0.99 -0.21 1.15 -0.40 0.00 0.00 176.91 178.43 1xx2 h THR 175 N 1.09 1.41 0.00 -0.77 2.02 -1.15 -2.22 112.91 113.29 1xx2 h THR 175 Ca 0.23 -1.53 -0.11 0.00 0.77 0.00 0.00 66.41 65.77 1xx2 h THR 175 Cb 0.35 2.19 -0.02 0.00 -1.74 0.00 0.00 68.15 68.93 1xx2 h THR 175 CO -0.00 0.44 -0.52 0.71 0.37 0.00 0.00 175.52 176.52 1xx2 h THR 176 N -0.18 1.07 0.00 3.16 1.35 -1.10 -0.94 112.91 116.27 1xx2 h THR 176 Ca -0.00 -2.00 -0.09 0.00 -0.55 0.00 0.00 66.41 63.77 1xx2 h THR 176 Cb 0.81 2.18 -0.02 0.00 -1.73 0.00 0.00 68.15 69.39 1xx2 h THR 176 CO 0.05 0.51 -1.96 0.54 -0.25 0.00 0.00 175.52 174.40 1xx2 n ARG 177 N -3.49 0.74 0.01 4.72 5.12 -0.65 -4.62 116.66 118.49 1xx2 n ARG 177 Ca 0.00 -0.12 0.00 0.00 -1.93 0.00 0.00 57.85 55.80 1xx2 n ARG 177 Cb 0.63 -1.45 0.00 0.00 -1.16 0.00 0.00 32.46 30.48 1xx2 n ARG 177 CO 0.00 0.00 0.00 0.28 -1.93 0.00 0.00 177.63 175.98 1xx2 n VAL 178 N -2.30 0.19 0.05 1.55 0.31 -0.98 -4.73 118.33 112.42 1xx2 n VAL 178 Ca -0.11 0.06 -0.13 0.00 -0.01 0.00 0.00 64.34 64.16 1xx2 n VAL 178 Cb 0.66 -1.51 -0.09 0.00 -0.91 0.00 0.00 33.84 31.99 1xx2 n VAL 178 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1xx2 h LEU 179 N 0.00 -0.12 -0.68 7.52 3.38 -1.39 -3.09 115.31 120.94 1xx2 h LEU 179 Ca 0.00 -0.34 -0.04 0.00 0.09 0.00 0.00 57.88 57.59 1xx2 h LEU 179 Cb 0.84 0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.60 1xx2 h LEU 179 CO 0.00 0.29 0.27 0.11 0.09 0.00 0.00 178.44 179.20 1xx2 h LYS 180 N -0.56 1.02 -0.51 1.13 1.57 -1.43 -0.04 116.57 117.75 1xx2 h LYS 180 Ca -0.01 -0.19 -0.01 0.00 -1.87 0.00 0.00 60.65 58.57 1xx2 h LYS 180 Cb 0.45 -0.16 -0.03 0.00 0.08 0.00 0.00 32.23 32.57 1xx2 h LYS 180 CO 0.02 0.85 0.29 -1.35 -0.57 0.00 0.00 179.45 178.70 1xx2 h PRO 181 N 0.97 0.70 -0.19 3.15 0.11 -1.81 -1.88 132.00 133.05 1xx2 h PRO 181 Ca 0.23 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 66.27 1xx2 h PRO 181 Cb 0.21 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 31.18 1xx2 h PRO 181 CO -0.02 0.51 0.00 1.28 -0.21 0.00 0.00 178.00 179.56 1xx2 n LEU 182 N -4.41 2.14 -3.59 2.35 4.77 -1.09 -4.94 117.00 112.22 1xx2 n LEU 182 Ca 0.04 -0.87 -0.22 0.00 -0.03 0.00 0.00 56.01 54.94 1xx2 n LEU 182 Cb 0.09 -0.12 0.07 0.00 -2.33 0.00 0.00 43.42 41.13 1xx2 n LEU 182 CO 0.36 0.44 0.14 0.29 -1.33 0.00 0.00 177.39 177.29 1xx2 n LYS 183 N 0.64 -6.84 -3.07 3.23 4.01 -0.71 -4.91 118.16 110.51 1xx2 n LYS 183 Ca 0.17 0.79 -0.44 0.00 -0.51 0.00 0.00 58.31 58.32 1xx2 n LYS 183 Cb 0.41 -5.75 0.00 0.00 -0.51 0.00 0.00 35.03 29.19 1xx2 n LYS 183 CO 0.00 0.00 0.00 1.28 -1.11 0.00 0.00 177.40 177.57 1xx2 n LEU 184 N -4.56 5.90 0.00 -0.35 4.77 -0.10 -4.82 117.00 117.83 1xx2 n LEU 184 Ca -0.13 -4.97 0.14 0.00 -0.03 0.00 0.00 56.01 51.02 1xx2 n LEU 184 Cb 0.61 -1.43 0.71 0.00 -2.33 0.00 0.00 43.42 40.98 1xx2 n LEU 184 CO 0.65 1.37 0.98 0.47 -1.33 0.00 0.00 177.39 179.53 1xx2 n ASP 185 N 2.81 0.00 -2.50 -1.43 10.43 -1.26 -3.80 116.55 120.80 1xx2 n ASP 185 Ca 0.28 -0.12 -0.14 0.00 2.57 0.00 0.00 54.79 57.38 1xx2 n ASP 185 Cb 0.37 -0.28 0.03 0.00 1.84 0.00 0.00 41.12 43.08 1xx2 n ASP 185 CO 0.00 0.00 0.00 1.41 -1.07 0.00 0.00 177.20 177.54 1xx2 n HIS 186 N -1.28 2.09 -4.24 1.24 8.25 -1.26 -5.00 115.22 115.01 1xx2 n HIS 186 Ca 0.13 -2.50 -0.27 0.00 -0.26 0.00 0.00 57.72 54.82 1xx2 n HIS 186 Cb 0.22 -0.26 -0.17 0.00 1.12 0.00 0.00 29.99 30.90 1xx2 n HIS 186 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 1xx2 s THR 187 N -4.23 1.25 0.07 1.59 2.01 -1.25 -3.83 115.64 111.26 1xx2 s THR 187 Ca 0.38 -0.48 0.02 0.00 0.31 0.00 0.00 61.69 61.92 1xx2 s THR 187 Cb 0.39 -1.19 -0.03 0.00 0.01 0.00 0.00 72.50 71.68 1xx2 s THR 187 CO -0.03 0.40 -0.07 0.26 -0.69 0.00 0.00 174.62 174.49 1xx2 s TRP 188 N 1.22 0.75 -0.25 4.92 0.52 0.09 -4.99 118.94 121.20 1xx2 s TRP 188 Ca -0.03 -0.72 0.05 0.00 0.02 0.00 0.00 56.10 55.42 1xx2 s TRP 188 Cb -0.14 -0.45 -0.19 0.00 -1.15 0.00 0.00 33.47 31.55 1xx2 s TRP 188 CO -0.04 -0.13 -0.17 -0.89 0.02 0.00 0.00 176.95 175.74 1xx2 n ILE 189 N 0.71 1.47 -3.93 2.03 5.41 -1.26 -0.51 119.36 123.28 1xx2 n ILE 189 Ca -0.18 -0.62 -0.30 0.00 1.00 0.00 0.00 62.75 62.65 1xx2 n ILE 189 Cb 0.58 -1.24 -0.15 0.00 -0.71 0.00 0.00 39.64 38.11 1xx2 n ILE 189 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 176.55 176.75 1xx2 s ASN 190 N -6.33 3.99 -0.08 4.38 0.02 -1.26 -4.84 114.94 110.83 1xx2 s ASN 190 Ca -0.30 -1.33 -0.29 0.00 -1.02 0.00 0.00 52.86 49.91 1xx2 s ASN 190 Cb 0.08 -1.21 -0.06 0.00 0.02 0.00 0.00 41.25 40.09 1xx2 s ASN 190 CO 0.64 -0.27 1.77 -0.69 0.02 0.00 0.00 177.10 178.58 1xx2 s VAL 191 N 1.35 3.41 0.70 1.60 1.01 -1.26 -4.98 120.40 122.24 1xx2 s VAL 191 Ca -0.03 0.49 -0.15 0.00 0.00 0.00 0.00 61.98 62.29 1xx2 s VAL 191 Cb -0.19 -3.36 0.02 0.00 0.00 0.00 0.00 36.38 32.86 1xx2 s VAL 191 CO -0.08 -0.09 1.16 -2.16 0.00 0.00 0.00 175.10 173.94 1xx2 s PRO 192 N 4.46 2.40 0.21 2.72 0.04 -1.26 -4.87 135.00 138.71 1xx2 s PRO 192 Ca 0.79 1.60 -0.09 0.00 0.04 0.00 0.00 61.00 63.34 1xx2 s PRO 192 Cb -0.34 -1.88 0.31 0.00 0.04 0.00 0.00 34.50 32.63 1xx2 s PRO 192 CO 0.33 -1.60 1.72 0.87 0.04 0.00 0.00 177.00 178.37 1xx2 h LYS 193 N -0.17 0.33 0.00 4.56 1.79 -2.02 -0.93 116.57 120.13 1xx2 h LYS 193 Ca -0.47 -0.02 0.00 0.00 -2.18 0.00 0.00 60.65 57.98 1xx2 h LYS 193 Cb 1.27 -0.07 0.00 0.00 -1.58 0.00 0.00 32.23 31.85 1xx2 h LYS 193 CO 0.51 0.22 0.00 0.00 -1.08 0.00 0.00 179.45 179.10 1xx2 h ALA 194 N 1.46 1.00 -0.01 3.86 0.00 -2.03 -2.70 119.26 120.84 1xx2 h ALA 194 Ca 0.33 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.24 1xx2 h ALA 194 Cb 0.46 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1xx2 h ALA 194 CO -0.37 0.00 -0.11 -1.91 0.00 0.00 0.00 179.25 176.86 1xx2 n GLU 195 N -2.39 1.29 -0.05 0.00 4.07 -0.37 -4.65 120.64 118.53 1xx2 n GLU 195 Ca -0.01 -0.95 0.17 0.00 -0.06 0.00 0.00 57.16 56.31 1xx2 n GLU 195 Cb 0.07 -1.18 0.61 0.00 -0.06 0.00 0.00 31.44 30.88 1xx2 n GLU 195 CO 0.00 0.00 0.00 0.93 -0.06 0.00 0.00 177.13 178.00 1xx2 h GLU 196 N 1.84 0.16 -0.03 5.31 5.08 -1.28 -1.11 114.58 124.55 1xx2 h GLU 196 Ca 0.00 -0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.36 1xx2 h GLU 196 Cb 0.45 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.66 1xx2 h GLU 196 CO 0.00 0.11 0.09 0.00 -1.00 0.00 0.00 179.01 178.21 1xx2 h ALA 197 N 1.71 1.30 0.00 3.43 0.00 -1.83 -1.42 119.26 122.46 1xx2 h ALA 197 Ca 0.28 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.19 1xx2 h ALA 197 Cb 0.87 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1xx2 h ALA 197 CO -0.04 -0.11 -1.00 0.72 0.00 0.00 0.00 179.25 178.82 1xx2 n HIS 198 N -3.33 0.26 -2.22 0.00 8.25 -0.42 -4.89 115.22 112.87 1xx2 n HIS 198 Ca -0.02 0.08 -0.43 0.00 -0.26 0.00 0.00 57.72 57.09 1xx2 n HIS 198 Cb 0.17 -0.43 -0.02 0.00 1.12 0.00 0.00 29.99 30.82 1xx2 n HIS 198 CO 0.00 0.00 0.00 -0.47 0.64 0.00 0.00 176.34 176.51 1xx2 s TYR 199 N -3.19 2.29 1.00 4.41 6.14 -0.54 -0.67 117.35 126.80 1xx2 s TYR 199 Ca 0.04 0.66 -0.14 0.00 0.64 0.00 0.00 57.07 58.27 1xx2 s TYR 199 Cb 0.14 -4.01 0.19 0.00 0.42 0.00 0.00 41.96 38.71 1xx2 s TYR 199 CO 0.80 -2.46 1.14 0.00 0.64 0.00 0.00 175.55 175.67 1xx2 s ALA 200 N 5.10 1.39 -0.08 3.97 0.00 -0.89 -4.92 121.76 126.34 1xx2 s ALA 200 Ca 0.66 -0.67 -0.01 0.00 0.00 0.00 0.00 51.96 51.94 1xx2 s ALA 200 Cb -0.21 -2.99 -0.03 0.00 0.00 0.00 0.00 23.12 19.89 1xx2 s ALA 200 CO 0.28 -2.71 -0.01 -1.58 0.00 0.00 0.00 175.76 171.74 1xx2 s TRP 201 N -3.23 3.12 0.23 0.00 0.52 -0.81 -5.00 118.94 113.77 1xx2 s TRP 201 Ca 0.67 0.16 -0.03 0.00 0.02 0.00 0.00 56.10 56.91 1xx2 s TRP 201 Cb -0.13 -1.77 -0.05 0.00 -1.15 0.00 0.00 33.47 30.37 1xx2 s TRP 201 CO 0.55 0.45 0.47 0.20 0.02 0.00 0.00 176.95 178.63 1xx2 s GLY 202 N -0.93 1.89 -0.04 0.98 0.00 -0.72 -4.83 107.32 103.67 1xx2 s GLY 202 Ca 0.14 -0.66 0.04 0.00 0.00 0.00 0.00 44.72 44.24 1xx2 s GLY 202 CO 0.03 -0.58 -0.18 -0.19 0.00 0.00 0.00 173.10 172.18 1xx2 s TYR 203 N -1.94 1.79 -0.14 1.90 1.51 -0.45 -0.36 117.35 119.65 1xx2 s TYR 203 Ca 0.41 -0.51 -0.04 0.00 -1.01 0.00 0.00 57.07 55.92 1xx2 s TYR 203 Cb -0.11 -1.20 0.07 0.00 -0.11 0.00 0.00 41.96 40.61 1xx2 s TYR 203 CO 0.29 -0.17 0.24 0.50 -1.11 0.00 0.00 175.55 175.30 1xx2 s ARG 204 N 0.01 0.14 -1.26 -0.62 3.52 -0.19 -4.37 118.95 116.18 1xx2 s ARG 204 Ca -0.04 0.58 -0.00 0.00 -0.13 0.00 0.00 55.73 56.14 1xx2 s ARG 204 Cb -0.12 -0.37 0.00 0.00 -1.56 0.00 0.00 34.95 32.91 1xx2 s ARG 204 CO 0.02 -0.39 0.83 -0.25 -0.81 0.00 0.00 175.30 174.71 1xx2 n ASP 205 N 5.34 -1.58 0.00 -2.12 10.43 -1.26 -1.41 116.55 125.95 1xx2 n ASP 205 Ca -0.06 -0.73 0.00 0.00 2.57 0.00 0.00 54.79 56.57 1xx2 n ASP 205 Cb 0.50 -4.52 0.00 0.00 1.84 0.00 0.00 41.12 38.94 1xx2 n ASP 205 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1xx2 n GLY 206 N -1.39 1.17 3.87 0.44 0.00 -1.26 -4.97 105.19 103.05 1xx2 n GLY 206 Ca -0.29 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.37 1xx2 n GLY 206 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1xx2 s LYS 207 N -0.10 3.62 -0.22 1.61 2.20 -0.50 -5.07 119.74 121.28 1xx2 s LYS 207 Ca 0.00 0.02 -0.22 0.00 -0.36 0.00 0.00 55.97 55.41 1xx2 s LYS 207 Cb 0.00 -3.12 -0.02 0.00 -1.51 0.00 0.00 37.83 33.19 1xx2 s LYS 207 CO 0.00 0.67 0.70 0.00 -0.36 0.00 0.00 175.35 176.36 1xx2 s ALA 208 N -1.22 3.58 0.07 3.13 0.00 -1.26 -1.02 121.76 125.05 1xx2 s ALA 208 Ca 0.25 -0.25 0.00 0.00 0.00 0.00 0.00 51.96 51.96 1xx2 s ALA 208 Cb -0.14 -3.09 -0.04 0.00 0.00 0.00 0.00 23.12 19.85 1xx2 s ALA 208 CO 0.13 -0.73 -0.05 0.14 0.00 0.00 0.00 175.76 175.26 1xx2 s VAL 209 N 2.32 0.40 0.16 0.00 -7.23 0.51 -4.95 120.40 111.61 1xx2 s VAL 209 Ca 0.31 -1.77 0.03 0.00 -1.81 0.00 0.00 61.98 58.73 1xx2 s VAL 209 Cb -0.16 -1.46 -0.05 0.00 0.56 0.00 0.00 36.38 35.27 1xx2 s VAL 209 CO 0.09 -0.90 -0.03 -0.13 -0.31 0.00 0.00 175.10 173.83 1xx2 s ARG 210 N -3.64 1.09 0.42 4.82 0.52 -1.26 -1.75 118.95 119.15 1xx2 s ARG 210 Ca 0.07 -1.51 -0.26 0.00 -0.52 0.00 0.00 55.73 53.51 1xx2 s ARG 210 Cb 0.05 -0.38 -0.09 0.00 0.52 0.00 0.00 34.95 35.05 1xx2 s ARG 210 CO -0.07 -0.07 1.37 0.54 0.02 0.00 0.00 175.30 177.09 1xx2 s VAL 211 N -3.55 2.35 0.10 3.52 0.11 -1.26 -4.97 120.40 116.70 1xx2 s VAL 211 Ca 0.21 0.32 -0.03 0.00 -2.93 0.00 0.00 61.98 59.54 1xx2 s VAL 211 Cb 0.05 -3.19 -0.05 0.00 -1.53 0.00 0.00 36.38 31.66 1xx2 s VAL 211 CO 0.03 0.05 0.31 -0.44 -3.33 0.00 0.00 175.10 171.72 1xx2 s SER 212 N -0.59 6.45 0.44 3.54 0.01 -1.26 -5.07 113.70 117.22 1xx2 s SER 212 Ca 0.58 0.48 -0.26 0.00 1.31 0.00 0.00 55.95 58.07 1xx2 s SER 212 Cb -0.41 -2.05 -0.09 0.00 0.21 0.00 0.00 66.02 63.69 1xx2 s SER 212 CO 0.53 0.11 1.44 -2.84 0.41 0.00 0.00 173.24 172.88 1xx2 s PRO 213 N -2.53 3.73 0.11 12.44 0.02 -1.26 -5.01 135.00 142.50 1xx2 s PRO 213 Ca 0.38 2.44 -0.23 0.00 0.02 0.00 0.00 61.00 63.61 1xx2 s PRO 213 Cb -0.13 -2.69 0.06 0.00 0.02 0.00 0.00 34.50 31.77 1xx2 s PRO 213 CO 0.25 -0.79 0.57 0.20 -0.33 0.00 0.00 177.00 176.90 1xx2 s GLY 214 N -0.46 -0.54 0.22 0.52 0.00 -1.26 -5.07 107.32 100.73 1xx2 s GLY 214 Ca 0.60 0.55 -0.30 0.00 0.00 0.00 0.00 44.72 45.57 1xx2 s GLY 214 CO 0.57 0.23 1.39 1.06 0.00 0.00 0.00 173.10 176.36 1xx2 s MET 215 N -3.21 4.31 -1.64 2.90 -1.94 -1.26 -1.98 119.30 116.49 1xx2 s MET 215 Ca -0.01 2.20 0.00 0.00 -1.71 0.00 0.00 55.69 56.17 1xx2 s MET 215 Cb -0.00 -3.15 0.00 0.00 2.01 0.00 0.00 34.83 33.69 1xx2 s MET 215 CO -0.08 -0.37 0.00 1.28 -0.01 0.00 0.00 175.02 175.84 1xx2 n LEU 216 N 2.60 -1.26 -0.20 -0.03 4.77 -1.26 -4.90 117.00 116.72 1xx2 n LEU 216 Ca 0.07 0.32 -0.08 0.00 -0.03 0.00 0.00 56.01 56.29 1xx2 n LEU 216 Cb 0.41 -2.32 0.02 0.00 -2.33 0.00 0.00 43.42 39.20 1xx2 n LEU 216 CO 0.59 -0.72 0.92 -2.24 -1.33 0.00 0.00 177.39 174.61 1xx2 h ASP 217 N 0.00 0.84 -1.00 -1.43 3.04 -1.81 -2.76 116.42 113.31 1xx2 h ASP 217 Ca -0.34 -0.22 0.05 0.00 -3.24 0.00 0.00 57.03 53.28 1xx2 h ASP 217 Cb 1.08 -0.22 -0.06 0.00 -1.04 0.00 0.00 39.33 39.09 1xx2 h ASP 217 CO 0.47 0.85 0.65 0.00 -2.04 0.00 0.00 179.24 179.17 1xx2 h ALA 218 N 1.03 1.39 0.00 4.15 0.00 -1.90 0.17 119.26 124.09 1xx2 h ALA 218 Ca 0.18 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 1xx2 h ALA 218 Cb 0.32 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1xx2 h ALA 218 CO -0.00 0.49 -0.26 1.96 0.00 0.00 0.00 179.25 181.44 1xx2 h GLN 219 N 1.21 0.00 0.00 0.00 7.50 -1.88 -3.37 115.11 118.57 1xx2 h GLN 219 Ca 0.41 0.00 -0.12 0.00 0.50 0.00 0.00 58.65 59.45 1xx2 h GLN 219 Cb 0.10 0.00 -0.02 0.00 0.05 0.00 0.00 27.48 27.60 1xx2 h GLN 219 CO -0.15 0.26 -1.45 0.00 -1.50 0.00 0.00 178.83 175.99 1xx2 n ALA 220 N -2.18 1.84 -1.85 3.87 0.00 -1.01 -4.55 120.51 116.64 1xx2 n ALA 220 Ca 0.02 -0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.05 1xx2 n ALA 220 Cb 0.59 0.16 0.00 0.00 0.00 0.00 0.00 19.45 20.19 1xx2 n ALA 220 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 1xx2 n TYR 221 N -2.34 0.00 -0.25 0.00 0.18 -0.07 -4.24 117.16 110.44 1xx2 n TYR 221 Ca -0.11 0.00 0.08 0.00 1.88 0.00 0.00 57.90 59.74 1xx2 n TYR 221 Cb 0.70 0.12 0.30 0.00 -0.38 0.00 0.00 39.34 40.08 1xx2 n TYR 221 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 1xx2 n GLY 222 N 0.00 2.29 3.79 -7.48 0.00 0.40 -3.35 105.19 100.84 1xx2 n GLY 222 Ca 0.00 -0.71 -0.38 0.00 0.00 0.00 0.00 46.02 44.93 1xx2 n GLY 222 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xx2 s VAL 223 N -1.84 4.50 0.01 1.61 1.01 -1.26 -4.55 120.40 119.87 1xx2 s VAL 223 Ca 0.43 1.49 0.07 0.00 0.00 0.00 0.00 61.98 63.96 1xx2 s VAL 223 Cb 0.28 -4.01 -0.02 0.00 0.00 0.00 0.00 36.38 32.62 1xx2 s VAL 223 CO 0.20 0.45 -0.21 -0.54 0.00 0.00 0.00 175.10 175.00 1xx2 s LYS 224 N -1.35 1.57 0.27 2.72 3.01 0.34 -1.30 119.74 124.99 1xx2 s LYS 224 Ca 0.36 -0.85 -0.20 0.00 -1.01 0.00 0.00 55.97 54.27 1xx2 s LYS 224 Cb -0.21 -1.60 0.05 0.00 -1.01 0.00 0.00 37.83 35.07 1xx2 s LYS 224 CO 0.23 0.42 0.87 -0.08 0.51 0.00 0.00 175.35 177.30 1xx2 s THR 225 N -0.64 0.00 0.41 2.17 -1.32 -0.64 -0.73 115.64 114.89 1xx2 s THR 225 Ca 0.08 -0.84 0.07 0.00 -1.21 0.00 0.00 61.69 59.80 1xx2 s THR 225 Cb -0.08 -2.47 -0.04 0.00 -1.51 0.00 0.00 72.50 68.40 1xx2 s THR 225 CO 0.00 0.00 0.27 0.54 -2.21 0.00 0.00 174.62 173.22 1xx2 s ASN 226 N -3.08 4.71 0.61 8.08 2.20 -1.25 -0.31 114.94 125.90 1xx2 s ASN 226 Ca 0.15 -0.92 0.34 0.00 -0.94 0.00 0.00 52.86 51.48 1xx2 s ASN 226 Cb -0.04 -0.52 1.95 0.00 -2.00 0.00 0.00 41.25 40.64 1xx2 s ASN 226 CO 0.07 -0.59 2.27 1.62 -2.94 0.00 0.00 177.10 177.53 1xx2 h VAL 227 N 1.25 0.39 0.04 3.54 3.04 -1.74 -2.31 116.25 120.45 1xx2 h VAL 227 Ca -0.42 -0.05 -0.00 0.00 -1.01 0.00 0.00 66.70 65.22 1xx2 h VAL 227 Cb 1.26 1.03 0.00 0.00 -2.01 0.00 0.00 31.29 31.57 1xx2 h VAL 227 CO 0.64 0.01 -0.02 1.56 -1.01 0.00 0.00 177.57 178.75 1xx2 h GLN 228 N 0.00 -0.05 -0.35 4.17 4.20 -1.95 -1.74 115.11 119.40 1xx2 h GLN 228 Ca -0.00 0.00 -0.04 0.00 0.06 0.00 0.00 58.65 58.68 1xx2 h GLN 228 Cb 0.03 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 27.81 1xx2 h GLN 228 CO 0.00 0.61 0.06 -0.44 -0.67 0.00 0.00 178.83 178.39 1xx2 h ASP 229 N -0.81 0.48 -0.16 1.46 3.45 -1.87 -1.73 116.42 117.23 1xx2 h ASP 229 Ca -0.01 -0.07 -0.14 0.00 0.43 0.00 0.00 57.03 57.25 1xx2 h ASP 229 Cb 0.68 -0.12 -0.01 0.00 -0.56 0.00 0.00 39.33 39.32 1xx2 h ASP 229 CO 0.01 0.50 -0.37 -0.03 -1.57 0.00 0.00 179.24 177.78 1xx2 h MET 230 N 0.51 0.68 -0.51 3.56 4.05 -1.46 -0.00 114.93 121.76 1xx2 h MET 230 Ca 0.12 -0.34 -0.02 0.00 -0.28 0.00 0.00 59.70 59.18 1xx2 h MET 230 Cb 0.24 0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 31.01 1xx2 h MET 230 CO 0.00 0.94 0.24 0.00 0.23 0.00 0.00 176.91 178.33 1xx2 h ALA 231 N 1.02 0.66 0.00 0.39 0.00 -0.72 -1.01 119.26 119.60 1xx2 h ALA 231 Ca 0.05 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 1xx2 h ALA 231 Cb 0.89 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.48 1xx2 h ALA 231 CO 0.08 0.22 -0.07 -0.91 0.00 0.00 0.00 179.25 178.57 1xx2 h ASN 232 N 0.68 0.00 -0.15 0.00 2.35 -1.08 -1.78 115.58 115.60 1xx2 h ASN 232 Ca 0.17 0.00 -0.12 0.00 -0.55 0.00 0.00 56.30 55.81 1xx2 h ASN 232 Cb 0.12 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.50 1xx2 h ASN 232 CO -0.02 0.07 -0.36 -0.25 -1.65 0.00 0.00 177.43 175.22 1xx2 h TRP 233 N 0.00 0.66 -0.62 1.19 -0.00 -0.04 -2.28 115.95 114.86 1xx2 h TRP 233 Ca -0.00 -0.25 -0.07 0.00 -0.00 0.00 0.00 58.89 58.57 1xx2 h TRP 233 Cb 0.58 -0.12 -0.02 0.00 -0.00 0.00 0.00 29.16 29.60 1xx2 h TRP 233 CO 0.00 0.99 0.13 0.28 -0.00 0.00 0.00 178.44 179.84 1xx2 h VAL 234 N 0.15 1.26 -0.41 2.65 2.07 -0.89 -2.47 116.25 118.61 1xx2 h VAL 234 Ca -0.00 -0.95 -0.07 0.00 0.82 0.00 0.00 66.70 66.49 1xx2 h VAL 234 Cb 0.97 0.68 -0.02 0.00 -1.52 0.00 0.00 31.29 31.41 1xx2 h VAL 234 CO 0.08 0.36 -0.05 0.24 0.02 0.00 0.00 177.57 178.21 1xx2 h MET 235 N 0.92 0.69 -0.24 1.57 2.86 -1.34 0.67 114.93 120.06 1xx2 h MET 235 Ca 0.19 -0.20 -0.09 0.00 -2.06 0.00 0.00 59.70 57.54 1xx2 h MET 235 Cb 0.38 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 31.96 1xx2 h MET 235 CO 0.01 0.75 -0.26 0.00 1.06 0.00 0.00 176.91 178.47 1xx2 h ALA 236 N 1.30 1.11 0.00 6.32 0.00 -1.20 -2.02 119.26 124.77 1xx2 h ALA 236 Ca 0.12 -0.34 -0.16 0.00 0.00 0.00 0.00 54.91 54.53 1xx2 h ALA 236 Cb 0.48 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 1xx2 h ALA 236 CO 0.02 0.55 -0.92 -0.91 0.00 0.00 0.00 179.25 178.00 1xx2 h ASN 237 N 0.41 0.00 1.04 0.00 2.35 -1.11 -3.00 115.58 115.28 1xx2 h ASN 237 Ca 0.06 0.00 -0.20 0.00 -0.55 0.00 0.00 56.30 55.61 1xx2 h ASN 237 Cb 0.67 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 39.01 1xx2 h ASN 237 CO 0.05 0.69 -0.97 -0.03 -1.65 0.00 0.00 177.43 175.52 1xx2 h MET 238 N 0.00 0.00 -2.15 0.81 4.05 -0.76 -3.39 114.93 113.49 1xx2 h MET 238 Ca -0.06 0.00 -0.57 0.00 -0.28 0.00 0.00 59.70 58.79 1xx2 h MET 238 Cb 1.58 0.00 -0.39 0.00 -0.80 0.00 0.00 31.60 32.00 1xx2 h MET 238 CO 0.08 0.89 -1.05 0.00 0.23 0.00 0.00 176.91 177.05 1xx2 n ALA 239 N -2.34 2.61 0.28 0.39 0.00 -0.77 -4.77 120.51 115.91 1xx2 n ALA 239 Ca -0.01 -3.29 0.13 0.00 0.00 0.00 0.00 53.44 50.27 1xx2 n ALA 239 Cb 0.91 -0.79 0.62 0.00 0.00 0.00 0.00 19.45 20.20 1xx2 n ALA 239 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1xx2 h PRO 240 N 4.65 0.00 0.00 0.00 0.13 -1.74 -2.81 132.00 132.23 1xx2 h PRO 240 Ca 0.15 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.26 1xx2 h PRO 240 Cb 0.89 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.02 1xx2 h PRO 240 CO 0.43 0.00 -0.12 1.05 -0.23 0.00 0.00 178.00 179.13 1xx2 h GLU 241 N 0.00 0.00 0.00 0.86 9.09 -1.94 -1.57 114.58 121.02 1xx2 h GLU 241 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 1xx2 h GLU 241 Cb 0.18 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.28 1xx2 h GLU 241 CO 0.00 0.12 0.00 0.09 0.05 0.00 0.00 179.01 179.27 1xx2 n ASN 242 N -3.58 0.00 -4.70 3.06 5.03 -1.06 -4.79 115.26 109.22 1xx2 n ASN 242 Ca -0.02 0.36 -0.42 0.00 0.87 0.00 0.00 54.58 55.38 1xx2 n ASN 242 Cb 0.25 -0.45 -0.03 0.00 -1.02 0.00 0.00 39.78 38.53 1xx2 n ASN 242 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1xx2 s VAL 243 N -2.90 4.86 -0.02 2.41 1.01 -0.59 -4.98 120.40 120.19 1xx2 s VAL 243 Ca 0.15 1.91 -0.23 0.00 0.00 0.00 0.00 61.98 63.81 1xx2 s VAL 243 Cb 0.17 -4.25 -0.20 0.00 0.00 0.00 0.00 36.38 32.09 1xx2 s VAL 243 CO 0.45 0.10 1.16 0.00 0.00 0.00 0.00 175.10 176.81 1xx2 h ALA 244 N 6.98 0.08 -2.40 5.51 0.00 -1.88 -3.44 119.26 124.11 1xx2 h ALA 244 Ca -0.36 -0.39 -0.54 0.00 0.00 0.00 0.00 54.91 53.63 1xx2 h ALA 244 Cb 1.18 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1xx2 h ALA 244 CO 0.80 0.03 0.84 -0.51 0.00 0.00 0.00 179.25 180.42 1xx2 s ASP 245 N -6.16 6.81 0.14 0.00 -0.00 -1.26 -4.92 116.67 111.28 1xx2 s ASP 245 Ca -0.15 2.19 -0.17 0.00 -0.00 0.00 0.00 52.55 54.41 1xx2 s ASP 245 Cb 0.02 -2.56 -0.01 0.00 -0.00 0.00 0.00 42.92 40.37 1xx2 s ASP 245 CO 0.73 -0.73 1.77 0.00 -0.00 0.00 0.00 175.17 176.94 1xx2 h ALA 246 N 7.79 0.44 -0.43 5.23 0.00 -1.99 -0.45 119.26 129.85 1xx2 h ALA 246 Ca -0.39 -0.05 -0.13 0.00 0.00 0.00 0.00 54.91 54.33 1xx2 h ALA 246 Cb 1.19 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 1xx2 h ALA 246 CO 0.90 -0.06 -0.26 0.66 0.00 0.00 0.00 179.25 180.49 1xx2 h SER 247 N 0.45 0.95 -0.43 0.00 4.64 -1.91 -2.16 113.55 115.09 1xx2 h SER 247 Ca 0.13 -0.38 -0.03 0.00 -0.47 0.00 0.00 61.79 61.04 1xx2 h SER 247 Cb 0.00 -0.26 -0.02 0.00 -0.31 0.00 0.00 62.40 61.81 1xx2 h SER 247 CO -0.02 1.15 0.16 0.25 -0.87 0.00 0.00 176.83 177.49 1xx2 h LEU 248 N 0.78 0.60 -0.67 5.97 5.85 -1.86 0.19 115.31 126.17 1xx2 h LEU 248 Ca 0.09 -0.18 0.07 0.00 0.84 0.00 0.00 57.88 58.70 1xx2 h LEU 248 Cb 0.83 -0.16 -0.06 0.00 0.37 0.00 0.00 40.66 41.64 1xx2 h LEU 248 CO 0.07 0.62 0.36 0.50 -0.34 0.00 0.00 178.44 179.65 1xx2 h LYS 249 N 0.54 0.63 -0.03 1.25 3.64 -0.92 -0.51 116.57 121.17 1xx2 h LYS 249 Ca 0.14 -0.04 -0.17 0.00 -1.27 0.00 0.00 60.65 59.31 1xx2 h LYS 249 Cb 0.22 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 31.89 1xx2 h LYS 249 CO -0.01 0.42 -0.75 0.37 -2.27 0.00 0.00 179.45 177.21 1xx2 h GLN 250 N 0.65 0.23 -0.89 1.90 5.75 -1.12 -2.86 115.11 118.76 1xx2 h GLN 250 Ca 0.31 -0.21 0.04 0.00 -0.15 0.00 0.00 58.65 58.64 1xx2 h GLN 250 Cb 0.24 0.05 -0.05 0.00 1.07 0.00 0.00 27.48 28.78 1xx2 h GLN 250 CO -0.21 0.88 0.57 0.78 -2.65 0.00 0.00 178.83 178.21 1xx2 h GLY 251 N 1.63 1.31 1.40 2.39 0.00 0.55 0.78 103.07 111.13 1xx2 h GLY 251 Ca -0.03 -0.43 -0.10 0.00 0.00 0.00 0.00 47.33 46.77 1xx2 h GLY 251 CO 0.12 0.36 -0.17 -2.22 0.00 0.00 0.00 176.54 174.63 1xx2 h ILE 252 N 1.10 1.26 -0.46 2.60 2.04 -1.07 -2.04 117.51 120.94 1xx2 h ILE 252 Ca 0.36 -1.23 -0.13 0.00 1.00 0.00 0.00 64.86 64.86 1xx2 h ILE 252 Cb 0.03 1.16 -0.01 0.00 -0.74 0.00 0.00 36.82 37.26 1xx2 h ILE 252 CO -0.13 0.41 -0.23 0.00 0.00 0.00 0.00 178.15 178.20 1xx2 h ALA 253 N 1.18 0.65 -0.07 1.87 0.00 -0.98 -2.84 119.26 119.07 1xx2 h ALA 253 Ca 0.10 -0.40 -0.06 0.00 0.00 0.00 0.00 54.91 54.55 1xx2 h ALA 253 Cb 0.64 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1xx2 h ALA 253 CO 0.05 0.65 -0.24 -0.07 0.00 0.00 0.00 179.25 179.63 1xx2 h LEU 254 N 0.82 0.12 -0.68 0.00 3.38 -0.71 -2.32 115.31 115.92 1xx2 h LEU 254 Ca 0.10 -0.03 -0.05 0.00 0.09 0.00 0.00 57.88 57.99 1xx2 h LEU 254 Cb 0.81 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.52 1xx2 h LEU 254 CO 0.07 0.37 -0.22 0.00 0.09 0.00 0.00 178.44 178.75 1xx2 h ALA 255 N 1.64 0.93 -0.66 1.53 0.00 -1.19 -2.96 119.26 118.55 1xx2 h ALA 255 Ca 0.02 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1xx2 h ALA 255 Cb 0.50 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1xx2 h ALA 255 CO 0.03 0.28 0.00 1.04 0.00 0.00 0.00 179.25 180.60 1xx2 n GLN 256 N -3.26 3.12 -1.80 0.00 6.02 -0.91 -1.19 117.38 119.36 1xx2 n GLN 256 Ca 0.01 -2.70 -0.30 0.00 -0.01 0.00 0.00 57.00 54.00 1xx2 n GLN 256 Cb 0.51 -1.67 0.06 0.00 1.02 0.00 0.00 30.24 30.15 1xx2 n GLN 256 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 1xx2 s SER 257 N -0.99 5.23 -0.33 1.08 0.01 -0.97 -4.07 113.70 113.67 1xx2 s SER 257 Ca 0.48 1.18 -0.08 0.00 1.31 0.00 0.00 55.95 58.84 1xx2 s SER 257 Cb 0.27 -1.97 0.03 0.00 0.21 0.00 0.00 66.02 64.56 1xx2 s SER 257 CO 0.28 -1.48 0.12 -0.13 0.41 0.00 0.00 173.24 172.44 1xx2 s ARG 258 N -5.31 2.84 -0.16 12.44 0.52 0.39 -4.04 118.95 125.63 1xx2 s ARG 258 Ca 0.59 -1.03 0.17 0.00 -0.52 0.00 0.00 55.73 54.93 1xx2 s ARG 258 Cb -0.12 -3.49 -0.25 0.00 0.52 0.00 0.00 34.95 31.62 1xx2 s ARG 258 CO 0.52 -0.59 0.21 0.66 0.02 0.00 0.00 175.30 176.12 1xx2 n TYR 259 N 4.87 0.22 -3.91 -0.53 4.01 -0.87 -1.92 117.16 119.04 1xx2 n TYR 259 Ca -0.13 0.08 -0.10 0.00 -0.16 0.00 0.00 57.90 57.59 1xx2 n TYR 259 Cb 0.46 -1.04 -0.10 0.00 -0.31 0.00 0.00 39.34 38.36 1xx2 n TYR 259 CO 0.00 0.00 0.00 -1.58 -0.46 0.00 0.00 176.86 174.82 1xx2 s TRP 260 N -2.53 0.14 -0.12 -0.72 0.52 -1.25 -1.80 118.94 113.19 1xx2 s TRP 260 Ca -0.09 -0.36 0.00 0.00 0.02 0.00 0.00 56.10 55.68 1xx2 s TRP 260 Cb 0.07 -0.11 -0.01 0.00 -1.15 0.00 0.00 33.47 32.26 1xx2 s TRP 260 CO 0.83 -0.33 -0.14 0.50 0.02 0.00 0.00 176.95 177.83 1xx2 s ARG 261 N -2.07 3.31 -0.49 4.98 3.52 -0.35 -1.68 118.95 126.17 1xx2 s ARG 261 Ca -0.09 -0.71 0.03 0.00 -0.13 0.00 0.00 55.73 54.83 1xx2 s ARG 261 Cb -0.04 -2.58 0.15 0.00 -1.56 0.00 0.00 34.95 30.91 1xx2 s ARG 261 CO -0.02 0.23 0.31 0.42 -0.81 0.00 0.00 175.30 175.44 1xx2 s ILE 262 N 0.29 1.50 0.00 4.11 1.09 0.46 -1.56 121.20 127.09 1xx2 s ILE 262 Ca -0.11 -2.94 0.00 0.00 -1.10 0.00 0.00 60.65 56.51 1xx2 s ILE 262 Cb -0.16 -2.03 0.00 0.00 -1.06 0.00 0.00 42.46 39.21 1xx2 s ILE 262 CO 0.06 -0.99 0.00 0.61 -0.10 0.00 0.00 174.94 174.52 1xx2 n GLY 263 N 3.07 2.49 0.75 6.18 0.00 -1.26 -2.39 105.19 114.03 1xx2 n GLY 263 Ca 0.15 -0.10 0.12 0.00 0.00 0.00 0.00 46.02 46.19 1xx2 n GLY 263 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1xx2 n SER 264 N 9.79 2.46 -4.65 1.61 3.41 -1.26 -4.95 113.62 120.04 1xx2 n SER 264 Ca 0.00 -1.76 -0.27 0.00 -0.26 0.00 0.00 58.87 56.57 1xx2 n SER 264 Cb 0.00 0.11 -0.08 0.00 -0.26 0.00 0.00 64.21 63.97 1xx2 n SER 264 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1xx2 s MET 265 N -2.13 2.36 -0.03 4.33 0.00 -1.01 -4.38 119.30 118.45 1xx2 s MET 265 Ca 0.27 -1.08 0.08 0.00 0.00 0.00 0.00 55.69 54.96 1xx2 s MET 265 Cb 0.20 -2.36 -0.02 0.00 0.00 0.00 0.00 34.83 32.65 1xx2 s MET 265 CO 0.37 0.47 -0.25 0.71 0.00 0.00 0.00 175.02 176.32 1xx2 s TYR 266 N -1.62 2.37 -0.23 3.16 1.51 0.21 -0.41 117.35 122.35 1xx2 s TYR 266 Ca 0.26 -0.45 -0.14 0.00 -1.01 0.00 0.00 57.07 55.74 1xx2 s TYR 266 Cb -0.10 -1.52 -0.04 0.00 -0.11 0.00 0.00 41.96 40.19 1xx2 s TYR 266 CO 0.18 -0.04 0.30 -1.14 -1.11 0.00 0.00 175.55 173.74 1xx2 s GLN 267 N -0.57 4.10 0.00 -0.62 2.00 -0.68 -1.14 119.66 122.75 1xx2 s GLN 267 Ca 0.09 -0.01 0.00 0.00 -2.00 0.00 0.00 55.36 53.43 1xx2 s GLN 267 Cb -0.10 -3.57 0.00 0.00 0.80 0.00 0.00 33.01 30.14 1xx2 s GLN 267 CO -0.00 -0.06 0.00 0.41 -0.50 0.00 0.00 175.29 175.14 1xx2 n GLY 268 N 4.24 3.75 3.41 2.59 0.00 -0.43 -2.05 105.19 116.70 1xx2 n GLY 268 Ca -0.11 -1.98 -0.44 0.00 0.00 0.00 0.00 46.02 43.49 1xx2 n GLY 268 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xx2 s LEU 269 N 0.00 5.19 0.00 0.99 1.43 -0.33 -4.51 118.68 121.44 1xx2 s LEU 269 Ca 0.00 -1.19 0.00 0.00 -1.03 0.00 0.00 54.13 51.91 1xx2 s LEU 269 Cb 0.00 -2.37 0.00 0.00 0.03 0.00 0.00 46.19 43.85 1xx2 s LEU 269 CO 0.00 -1.01 0.00 0.61 0.23 0.00 0.00 176.35 176.18 1xx2 n GLY 270 N 5.23 1.62 3.77 -3.19 0.00 -1.26 -4.43 105.19 106.93 1xx2 n GLY 270 Ca -0.08 -0.07 -0.36 0.00 0.00 0.00 0.00 46.02 45.51 1xx2 n GLY 270 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1xx2 s TRP 271 N 0.00 2.70 -0.01 1.61 0.52 -1.26 -4.69 118.94 117.80 1xx2 s TRP 271 Ca 0.00 1.53 0.08 0.00 0.02 0.00 0.00 56.10 57.72 1xx2 s TRP 271 Cb 0.00 -3.39 -0.02 0.00 -1.15 0.00 0.00 33.47 28.91 1xx2 s TRP 271 CO 0.00 -1.71 -0.24 -1.21 0.02 0.00 0.00 176.95 173.81 1xx2 s GLU 272 N -3.01 1.93 0.05 4.98 2.02 -1.11 -1.31 118.70 122.24 1xx2 s GLU 272 Ca 0.69 -0.90 0.03 0.00 0.02 0.00 0.00 54.97 54.82 1xx2 s GLU 272 Cb -0.28 -1.89 -0.02 0.00 0.10 0.00 0.00 34.13 32.03 1xx2 s GLU 272 CO 0.32 0.52 -0.09 -1.64 0.02 0.00 0.00 175.26 174.38 1xx2 s MET 273 N -0.66 0.60 0.07 1.61 -1.94 -0.29 -1.28 119.30 117.40 1xx2 s MET 273 Ca 0.10 -0.79 0.05 0.00 -1.71 0.00 0.00 55.69 53.34 1xx2 s MET 273 Cb -0.09 -0.44 -0.03 0.00 2.01 0.00 0.00 34.83 36.28 1xx2 s MET 273 CO -0.01 0.09 -0.14 -0.51 -0.01 0.00 0.00 175.02 174.44 1xx2 s LEU 274 N -1.57 2.27 0.41 -0.03 1.02 -0.74 0.68 118.68 120.72 1xx2 s LEU 274 Ca -0.08 -0.61 -0.25 0.00 0.02 0.00 0.00 54.13 53.22 1xx2 s LEU 274 Cb -0.10 -0.50 -0.08 0.00 0.02 0.00 0.00 46.19 45.52 1xx2 s LEU 274 CO 0.01 -0.08 1.17 0.20 0.02 0.00 0.00 176.35 177.67 1xx2 s ASN 275 N -1.70 6.49 -0.08 2.29 0.02 -1.26 -0.03 114.94 120.67 1xx2 s ASN 275 Ca -0.02 2.34 0.01 0.00 -1.02 0.00 0.00 52.86 54.16 1xx2 s ASN 275 Cb -0.10 -2.61 -0.03 0.00 0.02 0.00 0.00 41.25 38.53 1xx2 s ASN 275 CO 0.02 -0.70 -0.09 0.86 0.02 0.00 0.00 177.10 177.22 1xx2 s TRP 276 N -1.43 2.88 0.52 2.20 -0.11 0.23 -3.92 118.94 119.31 1xx2 s TRP 276 Ca 0.58 -0.13 -0.21 0.00 1.22 0.00 0.00 56.10 57.56 1xx2 s TRP 276 Cb -0.30 -1.74 -0.06 0.00 -1.50 0.00 0.00 33.47 29.87 1xx2 s TRP 276 CO 0.38 0.19 1.16 -2.14 -4.62 0.00 0.00 176.95 171.93 1xx2 s PRO 277 N -0.52 3.46 -0.01 5.86 0.02 -1.26 -4.67 135.00 137.88 1xx2 s PRO 277 Ca 0.07 1.73 -0.01 0.00 0.02 0.00 0.00 61.00 62.81 1xx2 s PRO 277 Cb -0.12 -2.16 0.00 0.00 0.02 0.00 0.00 34.50 32.24 1xx2 s PRO 277 CO 0.02 -0.79 0.03 0.54 -0.33 0.00 0.00 177.00 176.48 1xx2 s VAL 278 N -1.64 0.02 0.45 3.83 0.11 -1.25 -5.12 120.40 116.79 1xx2 s VAL 278 Ca 0.70 -0.13 -0.22 0.00 -2.93 0.00 0.00 61.98 59.39 1xx2 s VAL 278 Cb -0.27 -0.10 -0.09 0.00 -1.53 0.00 0.00 36.38 34.39 1xx2 s VAL 278 CO 0.31 -0.07 1.05 -1.61 -3.33 0.00 0.00 175.10 171.45 1xx2 s GLU 279 N -0.21 3.93 0.14 1.54 8.01 -1.26 -4.97 118.70 125.88 1xx2 s GLU 279 Ca -0.02 1.44 -0.18 0.00 0.01 0.00 0.00 54.97 56.22 1xx2 s GLU 279 Cb -0.02 -2.28 0.00 0.00 -4.31 0.00 0.00 34.13 27.53 1xx2 s GLU 279 CO -0.00 -0.34 1.76 0.00 0.01 0.00 0.00 175.26 176.70 1xx2 h ALA 280 N 1.93 0.34 -0.91 5.21 0.00 -2.01 -2.61 119.26 121.22 1xx2 h ALA 280 Ca -0.49 0.02 0.19 0.00 0.00 0.00 0.00 54.91 54.62 1xx2 h ALA 280 Cb 1.22 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.91 1xx2 h ALA 280 CO 0.60 -0.26 0.59 -0.97 0.00 0.00 0.00 179.25 179.21 1xx2 h ASN 281 N 0.28 0.53 -0.29 0.00 -1.24 -1.98 -0.02 115.58 112.84 1xx2 h ASN 281 Ca 0.12 0.05 -0.09 0.00 0.71 0.00 0.00 56.30 57.10 1xx2 h ASN 281 Cb 0.06 -0.05 -0.01 0.00 0.73 0.00 0.00 38.32 39.05 1xx2 h ASN 281 CO -0.10 0.22 -0.15 0.74 -1.29 0.00 0.00 177.43 176.85 1xx2 h THR 282 N 0.53 1.30 -0.17 -3.57 2.02 -1.86 -1.88 112.91 109.27 1xx2 h THR 282 Ca 0.48 -1.26 -0.17 0.00 0.77 0.00 0.00 66.41 66.24 1xx2 h THR 282 Cb 1.02 1.48 0.00 0.00 -1.74 0.00 0.00 68.15 68.91 1xx2 h THR 282 CO -0.22 0.40 -0.54 0.58 0.37 0.00 0.00 175.52 176.12 1xx2 h VAL 283 N 0.37 1.32 0.04 3.16 2.07 -1.34 -2.92 116.25 118.95 1xx2 h VAL 283 Ca 0.06 -1.78 -0.00 0.00 0.82 0.00 0.00 66.70 65.80 1xx2 h VAL 283 Cb 0.68 1.96 0.00 0.00 -1.52 0.00 0.00 31.29 32.41 1xx2 h VAL 283 CO 0.05 0.55 -0.02 0.58 0.02 0.00 0.00 177.57 178.75 1xx2 h VAL 284 N 0.35 1.05 0.00 2.57 2.07 -1.05 -2.84 116.25 118.40 1xx2 h VAL 284 Ca -0.02 -0.27 -0.04 0.00 0.82 0.00 0.00 66.70 67.20 1xx2 h VAL 284 Cb 1.16 1.23 -0.01 0.00 -1.52 0.00 0.00 31.29 32.15 1xx2 h VAL 284 CO 0.11 0.07 -0.18 1.05 0.02 0.00 0.00 177.57 178.64 1xx2 h GLU 285 N -0.17 0.00 0.00 1.57 4.11 -1.45 -2.35 114.58 116.30 1xx2 h GLU 285 Ca -0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.42 1xx2 h GLU 285 Cb 0.15 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.40 1xx2 h GLU 285 CO 0.01 0.18 0.00 0.78 0.07 0.00 0.00 179.01 180.05 1xx2 h GLY 286 N 2.05 0.00 1.51 1.06 0.00 -1.36 -3.00 103.07 103.33 1xx2 h GLY 286 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1xx2 h GLY 286 CO 0.02 0.00 -0.36 -1.14 0.00 0.00 0.00 176.54 175.06 1xx2 n SER 287 N -2.98 0.74 -4.73 0.19 3.41 -0.89 -3.52 113.62 105.84 1xx2 n SER 287 Ca 0.02 0.31 -0.42 0.00 -0.26 0.00 0.00 58.87 58.52 1xx2 n SER 287 Cb 0.38 -0.24 -0.03 0.00 -0.26 0.00 0.00 64.21 64.06 1xx2 n SER 287 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1xx2 s ASP 288 N -4.32 6.79 0.49 4.04 3.68 -1.13 -4.59 116.67 121.62 1xx2 s ASP 288 Ca 0.08 2.48 0.37 0.00 2.13 0.00 0.00 52.55 57.61 1xx2 s ASP 288 Cb 0.13 -2.61 1.53 0.00 -1.45 0.00 0.00 42.92 40.52 1xx2 s ASP 288 CO 0.67 -0.62 1.65 0.28 0.13 0.00 0.00 175.17 177.28 1xx2 h SER 289 N 5.63 0.14 -0.51 -0.34 0.02 -1.90 0.45 113.55 117.03 1xx2 h SER 289 Ca -0.44 0.07 -0.00 0.00 -0.84 0.00 0.00 61.79 60.57 1xx2 h SER 289 Cb 1.21 0.06 -0.03 0.00 0.14 0.00 0.00 62.40 63.78 1xx2 h SER 289 CO 0.80 -0.08 0.32 0.11 -1.14 0.00 0.00 176.83 176.84 1xx2 h LYS 290 N 0.06 0.71 0.01 3.45 1.57 -1.92 -2.01 116.57 118.43 1xx2 h LYS 290 Ca 0.80 -0.06 -0.39 0.00 -1.87 0.00 0.00 60.65 59.14 1xx2 h LYS 290 Cb 2.84 -0.15 -0.06 0.00 0.08 0.00 0.00 32.23 34.95 1xx2 h LYS 290 CO -0.21 0.50 -2.15 0.28 -0.57 0.00 0.00 179.45 177.30 1xx2 n VAL 291 N -4.43 1.54 -0.18 0.50 0.31 0.14 -4.11 118.33 112.11 1xx2 n VAL 291 Ca 0.05 -0.32 0.10 0.00 -0.01 0.00 0.00 64.34 64.15 1xx2 n VAL 291 Cb 0.07 -1.87 0.41 0.00 -0.91 0.00 0.00 33.84 31.54 1xx2 n VAL 291 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1xx2 h ALA 292 N -0.68 1.84 -0.13 3.52 0.00 -1.07 -2.24 119.26 120.50 1xx2 h ALA 292 Ca -0.58 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.33 1xx2 h ALA 292 Cb 1.59 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 19.24 1xx2 h ALA 292 CO -0.30 0.01 0.00 1.28 0.00 0.00 0.00 179.25 180.24 1xx2 n LEU 293 N -4.49 3.06 -4.83 0.00 4.77 -0.76 -4.63 117.00 110.13 1xx2 n LEU 293 Ca 0.12 -1.12 -0.33 0.00 -0.03 0.00 0.00 56.01 54.65 1xx2 n LEU 293 Cb 0.34 -0.07 -0.07 0.00 -2.33 0.00 0.00 43.42 41.29 1xx2 n LEU 293 CO 0.33 0.56 0.56 0.00 -1.33 0.00 0.00 177.39 177.51 1xx2 s ALA 294 N -1.86 3.17 0.00 -1.18 0.00 -0.84 -4.74 121.76 116.31 1xx2 s ALA 294 Ca 0.31 0.28 -0.30 0.00 0.00 0.00 0.00 51.96 52.26 1xx2 s ALA 294 Cb 0.21 -3.01 -0.03 0.00 0.00 0.00 0.00 23.12 20.29 1xx2 s ALA 294 CO 0.31 0.21 0.96 -1.25 0.00 0.00 0.00 175.76 175.99 1xx2 s PRO 295 N -2.96 4.56 0.05 0.00 0.04 -1.26 -4.71 135.00 130.72 1xx2 s PRO 295 Ca 0.57 1.39 0.02 0.00 0.04 0.00 0.00 61.00 63.02 1xx2 s PRO 295 Cb -0.11 -3.45 -0.03 0.00 0.04 0.00 0.00 34.50 30.95 1xx2 s PRO 295 CO 0.16 -0.03 -0.07 -0.51 0.04 0.00 0.00 177.00 176.59 1xx2 s LEU 296 N 0.94 2.30 0.47 -3.56 1.43 -0.75 -4.96 118.68 114.56 1xx2 s LEU 296 Ca 0.51 -0.64 -0.21 0.00 -1.03 0.00 0.00 54.13 52.76 1xx2 s LEU 296 Cb -0.21 -0.13 -0.08 0.00 0.03 0.00 0.00 46.19 45.80 1xx2 s LEU 296 CO 0.28 -0.26 1.06 -2.16 0.23 0.00 0.00 176.35 175.50 1xx2 s PRO 297 N -2.01 3.82 0.29 1.29 0.04 -1.26 -0.22 135.00 136.94 1xx2 s PRO 297 Ca -0.06 1.46 0.11 0.00 0.04 0.00 0.00 61.00 62.55 1xx2 s PRO 297 Cb -0.07 -2.20 -0.05 0.00 0.04 0.00 0.00 34.50 32.22 1xx2 s PRO 297 CO -0.01 -0.44 -0.14 0.14 0.04 0.00 0.00 177.00 176.60 1xx2 s VAL 298 N -1.85 2.64 -0.13 -0.36 -7.23 -1.04 -4.70 120.40 107.73 1xx2 s VAL 298 Ca 0.66 -2.27 0.01 0.00 -1.81 0.00 0.00 61.98 58.57 1xx2 s VAL 298 Cb -0.20 -2.46 0.02 0.00 0.56 0.00 0.00 36.38 34.30 1xx2 s VAL 298 CO 0.24 -0.36 -0.17 0.00 -0.31 0.00 0.00 175.10 174.50 1xx2 s ALA 299 N -2.49 1.92 0.22 1.32 0.00 -0.60 -4.91 121.76 117.22 1xx2 s ALA 299 Ca 0.31 -0.91 -0.30 0.00 0.00 0.00 0.00 51.96 51.06 1xx2 s ALA 299 Cb -0.04 -0.97 -0.09 0.00 0.00 0.00 0.00 23.12 22.02 1xx2 s ALA 299 CO 0.16 -0.19 1.32 -2.00 0.00 0.00 0.00 175.76 175.06 1xx2 s GLU 300 N 1.13 4.38 -0.57 0.00 2.12 -1.26 -1.21 118.70 123.29 1xx2 s GLU 300 Ca -0.02 2.09 -0.07 0.00 0.36 0.00 0.00 54.97 57.34 1xx2 s GLU 300 Cb -0.14 -3.17 0.15 0.00 0.26 0.00 0.00 34.13 31.23 1xx2 s GLU 300 CO -0.06 -0.25 0.43 0.08 -0.54 0.00 0.00 175.26 174.92 1xx2 s VAL 301 N -0.07 4.11 -0.13 3.70 1.01 -0.74 -4.90 120.40 123.38 1xx2 s VAL 301 Ca 0.56 -2.36 -0.01 0.00 0.00 0.00 0.00 61.98 60.17 1xx2 s VAL 301 Cb -0.37 -3.68 0.03 0.00 0.00 0.00 0.00 36.38 32.36 1xx2 s VAL 301 CO 0.40 -0.84 -0.06 0.21 0.00 0.00 0.00 175.10 174.81 1xx2 s ASN 302 N 1.74 2.33 0.62 3.32 3.84 -1.26 -2.51 114.94 123.02 1xx2 s ASN 302 Ca 0.12 -0.40 -0.18 0.00 0.21 0.00 0.00 52.86 52.61 1xx2 s ASN 302 Cb -0.21 -0.82 -0.02 0.00 -0.55 0.00 0.00 41.25 39.65 1xx2 s ASN 302 CO -0.03 -0.15 1.18 -2.84 -2.79 0.00 0.00 177.10 172.46 1xx2 s PRO 303 N 1.72 2.89 0.31 0.43 0.02 -1.26 -5.09 135.00 134.01 1xx2 s PRO 303 Ca 0.04 1.71 -0.30 0.00 0.02 0.00 0.00 61.00 62.47 1xx2 s PRO 303 Cb -0.13 -1.93 -0.12 0.00 0.02 0.00 0.00 34.50 32.34 1xx2 s PRO 303 CO -0.08 -1.24 1.53 -2.30 -0.33 0.00 0.00 177.00 174.58 1xx2 n PRO 304 N -1.84 2.59 -2.71 5.54 -0.02 -1.05 -4.92 135.00 132.59 1xx2 n PRO 304 Ca 0.13 0.92 -0.42 0.00 -2.02 0.00 0.00 63.50 62.10 1xx2 n PRO 304 Cb 0.50 -2.66 -0.03 0.00 -0.02 0.00 0.00 33.50 31.29 1xx2 n PRO 304 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1xx2 s ALA 305 N -0.35 3.23 0.83 3.55 0.00 -0.81 -4.83 121.76 123.38 1xx2 s ALA 305 Ca 0.61 0.49 -0.11 0.00 0.00 0.00 0.00 51.96 52.95 1xx2 s ALA 305 Cb -0.51 -3.36 0.09 0.00 0.00 0.00 0.00 23.12 19.34 1xx2 s ALA 305 CO 0.53 -0.34 1.13 -1.25 0.00 0.00 0.00 175.76 175.84 1xx2 s PRO 306 N 1.30 1.69 0.03 0.00 0.04 -1.26 -0.47 135.00 136.33 1xx2 s PRO 306 Ca 0.51 1.41 -0.39 0.00 0.04 0.00 0.00 61.00 62.57 1xx2 s PRO 306 Cb -0.20 -1.81 -0.19 0.00 0.04 0.00 0.00 34.50 32.34 1xx2 s PRO 306 CO 0.25 -2.11 1.13 -2.30 0.04 0.00 0.00 177.00 174.01 1xx2 n PRO 307 N -3.73 0.36 -3.73 0.56 -0.02 -1.26 -4.73 135.00 122.45 1xx2 n PRO 307 Ca 0.11 0.13 -0.37 0.00 -2.02 0.00 0.00 63.50 61.35 1xx2 n PRO 307 Cb 0.52 -1.65 -0.12 0.00 -0.02 0.00 0.00 33.50 32.23 1xx2 n PRO 307 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1xx2 s VAL 308 N 0.10 4.48 0.31 -1.45 1.01 -1.26 -4.99 120.40 118.60 1xx2 s VAL 308 Ca 0.88 -0.11 0.02 0.00 0.00 0.00 0.00 61.98 62.77 1xx2 s VAL 308 Cb -1.16 -3.10 0.16 0.00 0.00 0.00 0.00 36.38 32.27 1xx2 s VAL 308 CO 0.54 0.33 1.85 0.11 0.00 0.00 0.00 175.10 177.93 1xx2 h LYS 309 N 8.23 0.65 -3.34 2.72 6.56 -1.96 -3.23 116.57 126.20 1xx2 h LYS 309 Ca -0.38 -0.14 -0.68 0.00 -1.06 0.00 0.00 60.65 58.40 1xx2 h LYS 309 Cb 1.18 -0.10 0.01 0.00 -0.57 0.00 0.00 32.23 32.75 1xx2 h LYS 309 CO 0.58 0.64 3.60 0.00 -2.06 0.00 0.00 179.45 182.20 1xx2 n ALA 310 N -2.47 6.85 -2.38 3.86 0.00 -1.26 -1.06 120.51 124.05 1xx2 n ALA 310 Ca 0.02 -3.61 -0.13 0.00 0.00 0.00 0.00 53.44 49.72 1xx2 n ALA 310 Cb 0.24 -3.43 -0.10 0.00 0.00 0.00 0.00 19.45 16.16 1xx2 n ALA 310 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1xx2 s SER 311 N 2.55 1.40 -0.41 0.00 0.01 -1.22 -0.60 113.70 115.43 1xx2 s SER 311 Ca 0.62 -0.89 -0.08 0.00 1.31 0.00 0.00 55.95 56.91 1xx2 s SER 311 Cb 0.17 0.03 0.08 0.00 0.21 0.00 0.00 66.02 66.50 1xx2 s SER 311 CO -0.07 -0.32 0.23 0.86 0.41 0.00 0.00 173.24 174.35 1xx2 s TRP 312 N -2.86 3.36 -0.24 2.43 -0.11 0.96 -4.06 118.94 118.43 1xx2 s TRP 312 Ca 0.08 -1.64 -0.10 0.00 1.22 0.00 0.00 56.10 55.66 1xx2 s TRP 312 Cb -0.00 -2.90 -0.05 0.00 -1.50 0.00 0.00 33.47 29.02 1xx2 s TRP 312 CO -0.01 -0.85 0.16 0.08 -4.62 0.00 0.00 176.95 171.70 1xx2 s VAL 313 N 1.38 5.33 0.28 5.86 1.01 -0.21 -1.79 120.40 132.25 1xx2 s VAL 313 Ca 0.03 0.17 -0.12 0.00 0.00 0.00 0.00 61.98 62.06 1xx2 s VAL 313 Cb -0.23 -3.48 0.00 0.00 0.00 0.00 0.00 36.38 32.67 1xx2 s VAL 313 CO 0.01 0.35 0.52 -1.38 0.00 0.00 0.00 175.10 174.60 1xx2 s HIS 314 N 1.06 0.44 -0.28 5.22 -3.43 -0.41 -1.06 115.29 116.82 1xx2 s HIS 314 Ca 0.07 -0.81 -0.16 0.00 -0.80 0.00 0.00 55.06 53.36 1xx2 s HIS 314 Cb -0.14 0.23 0.11 0.00 -1.43 0.00 0.00 32.58 31.35 1xx2 s HIS 314 CO 0.04 -1.08 0.79 0.21 -2.00 0.00 0.00 174.74 172.70 1xx2 s LYS 315 N -3.68 0.58 0.26 -0.38 2.47 -0.56 -2.74 119.74 115.69 1xx2 s LYS 315 Ca 0.23 1.03 -0.03 0.00 -1.56 0.00 0.00 55.97 55.64 1xx2 s LYS 315 Cb -0.01 0.15 -0.05 0.00 -1.46 0.00 0.00 37.83 36.46 1xx2 s LYS 315 CO 0.11 -0.13 0.49 0.95 0.16 0.00 0.00 175.35 176.94 1xx2 s THR 316 N 1.60 5.10 -0.26 3.43 -4.23 -1.26 -2.16 115.64 117.85 1xx2 s THR 316 Ca -0.09 -0.15 -0.20 0.00 -1.18 0.00 0.00 61.69 60.06 1xx2 s THR 316 Cb -0.05 -3.75 0.07 0.00 1.34 0.00 0.00 72.50 70.12 1xx2 s THR 316 CO -0.18 -0.29 0.67 -0.83 -0.54 0.00 0.00 174.62 173.45 1xx2 s GLY 317 N -3.26 -0.56 0.05 3.99 0.00 -0.61 -3.91 107.32 103.03 1xx2 s GLY 317 Ca 0.41 2.12 -0.07 0.00 0.00 0.00 0.00 44.72 47.19 1xx2 s GLY 317 CO 0.30 1.99 0.14 -0.56 0.00 0.00 0.00 173.10 174.97 1xx2 s SER 318 N 0.97 0.15 0.33 1.64 0.01 -1.25 -0.19 113.70 115.36 1xx2 s SER 318 Ca -0.05 -0.57 0.05 0.00 1.31 0.00 0.00 55.95 56.69 1xx2 s SER 318 Cb -0.05 0.27 -0.02 0.00 0.21 0.00 0.00 66.02 66.43 1xx2 s SER 318 CO -0.09 -0.59 0.18 0.35 0.41 0.00 0.00 173.24 173.50 1xx2 n THR 319 N 0.44 0.00 -0.28 1.44 -2.24 -0.50 -4.01 114.28 109.13 1xx2 n THR 319 Ca -0.17 -2.13 0.10 0.00 -2.27 0.00 0.00 64.05 59.57 1xx2 n THR 319 Cb 0.60 0.90 0.25 0.00 -2.10 0.00 0.00 70.33 69.98 1xx2 n THR 319 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1xx2 h GLY 320 N 1.61 1.28 -0.11 3.38 0.00 -1.97 -3.05 103.07 104.20 1xx2 h GLY 320 Ca -0.25 -0.09 0.00 0.00 0.00 0.00 0.00 47.33 46.99 1xx2 h GLY 320 CO 0.38 -0.24 0.00 0.61 0.00 0.00 0.00 176.54 177.29 1xx2 n GLY 321 N -1.35 2.62 3.26 4.60 0.00 -1.26 -4.60 105.19 108.46 1xx2 n GLY 321 Ca 0.18 -0.03 -0.24 0.00 0.00 0.00 0.00 46.02 45.93 1xx2 n GLY 321 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1xx2 s PHE 322 N -0.93 1.72 -0.04 1.61 0.40 -1.15 -1.04 117.98 118.54 1xx2 s PHE 322 Ca 0.02 -0.41 -0.02 0.00 -0.60 0.00 0.00 56.93 55.92 1xx2 s PHE 322 Cb 0.01 -0.97 0.03 0.00 0.51 0.00 0.00 43.02 42.61 1xx2 s PHE 322 CO 0.01 0.16 0.06 0.20 0.70 0.00 0.00 175.22 176.35 1xx2 s GLY 323 N -1.67 0.21 0.16 4.36 0.00 -0.75 -1.41 107.32 108.22 1xx2 s GLY 323 Ca 0.06 0.20 0.04 0.00 0.00 0.00 0.00 44.72 45.01 1xx2 s GLY 323 CO 0.03 1.40 -0.07 -0.56 0.00 0.00 0.00 173.10 173.90 1xx2 s SER 324 N 2.17 1.70 -0.18 1.64 0.01 0.73 -1.55 113.70 118.23 1xx2 s SER 324 Ca 0.05 -1.07 -0.19 0.00 1.31 0.00 0.00 55.95 56.05 1xx2 s SER 324 Cb -0.12 0.01 0.05 0.00 0.21 0.00 0.00 66.02 66.17 1xx2 s SER 324 CO -0.03 -0.40 0.53 -0.47 0.41 0.00 0.00 173.24 173.28 1xx2 s TYR 325 N -3.40 -0.57 -0.01 2.43 5.04 -0.32 -1.58 117.35 118.95 1xx2 s TYR 325 Ca 0.19 1.36 0.01 0.00 -2.44 0.00 0.00 57.07 56.20 1xx2 s TYR 325 Cb 0.04 0.21 0.00 0.00 0.35 0.00 0.00 41.96 42.56 1xx2 s TYR 325 CO 0.02 -0.31 -0.03 0.14 -1.34 0.00 0.00 175.55 174.04 1xx2 s VAL 326 N 0.12 0.27 -0.16 3.14 -7.23 -0.92 -1.25 120.40 114.38 1xx2 s VAL 326 Ca -0.01 -0.10 -0.17 0.00 -1.81 0.00 0.00 61.98 59.88 1xx2 s VAL 326 Cb -0.04 -0.26 0.05 0.00 0.56 0.00 0.00 36.38 36.69 1xx2 s VAL 326 CO 0.01 0.10 0.47 0.00 -0.31 0.00 0.00 175.10 175.38 1xx2 s ALA 327 N 0.18 -1.18 0.04 1.32 0.00 -0.89 -1.49 121.76 119.74 1xx2 s ALA 327 Ca -0.01 1.24 -0.19 0.00 0.00 0.00 0.00 51.96 53.00 1xx2 s ALA 327 Cb -0.04 -0.65 0.04 0.00 0.00 0.00 0.00 23.12 22.46 1xx2 s ALA 327 CO -0.00 -0.24 0.43 -0.59 0.00 0.00 0.00 175.76 175.36 1xx2 s PHE 328 N 0.01 -0.29 -0.34 0.00 -0.12 -0.23 -0.47 117.98 116.54 1xx2 s PHE 328 Ca -0.02 0.28 0.03 0.00 -0.05 0.00 0.00 56.93 57.17 1xx2 s PHE 328 Cb -0.03 0.24 0.10 0.00 -0.63 0.00 0.00 43.02 42.70 1xx2 s PHE 328 CO 0.02 -0.58 0.07 0.42 -0.05 0.00 0.00 175.22 175.09 1xx2 s ILE 329 N -2.44 2.00 0.30 -4.49 1.01 -0.57 -1.04 121.20 115.97 1xx2 s ILE 329 Ca -0.05 -2.20 0.05 0.00 0.00 0.00 0.00 60.65 58.45 1xx2 s ILE 329 Cb -0.01 -2.48 0.29 0.00 0.01 0.00 0.00 42.46 40.27 1xx2 s ILE 329 CO -0.02 -0.63 1.78 -0.65 0.00 0.00 0.00 174.94 175.42 1xx2 h PRO 330 N 7.66 0.75 -0.24 2.79 0.11 -1.70 -1.15 132.00 140.21 1xx2 h PRO 330 Ca -0.06 -0.04 -0.03 0.00 0.11 0.00 0.00 66.00 65.98 1xx2 h PRO 330 Cb 1.01 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 31.94 1xx2 h PRO 330 CO 0.52 0.49 0.02 1.49 -0.21 0.00 0.00 178.00 180.31 1xx2 h GLU 331 N 0.77 0.35 -0.02 1.05 4.81 -1.40 -2.72 114.58 117.43 1xx2 h GLU 331 Ca 0.56 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.74 1xx2 h GLU 331 Cb 0.84 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.16 1xx2 h GLU 331 CO -0.37 0.37 -0.45 1.63 -0.73 0.00 0.00 179.01 179.45 1xx2 n LYS 332 N -4.36 1.27 -3.44 1.92 5.02 -0.79 -4.99 118.16 112.80 1xx2 n LYS 332 Ca 0.01 -1.05 -0.25 0.00 -2.02 0.00 0.00 58.31 54.99 1xx2 n LYS 332 Cb 0.19 -1.48 0.04 0.00 -0.02 0.00 0.00 35.03 33.76 1xx2 n LYS 332 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1xx2 n GLN 333 N 0.06 -5.66 -4.42 1.97 1.13 -0.50 -4.83 117.38 105.13 1xx2 n GLN 333 Ca 0.09 0.75 -0.27 0.00 -1.94 0.00 0.00 57.00 55.64 1xx2 n GLN 333 Cb 0.48 -5.65 -0.13 0.00 0.11 0.00 0.00 30.24 25.04 1xx2 n GLN 333 CO 0.00 0.00 0.00 0.96 -1.44 0.00 0.00 177.06 176.58 1xx2 s ILE 334 N -3.21 2.00 0.22 5.09 -4.36 -1.21 -3.96 121.20 115.78 1xx2 s ILE 334 Ca 0.48 -1.60 -0.18 0.00 -0.26 0.00 0.00 60.65 59.09 1xx2 s ILE 334 Cb -0.23 -1.77 0.03 0.00 1.25 0.00 0.00 42.46 41.73 1xx2 s ILE 334 CO 0.59 0.07 0.58 -0.83 0.24 0.00 0.00 174.94 175.59 1xx2 s GLY 335 N -1.85 -0.05 -0.06 6.27 0.00 -0.67 -1.51 107.32 109.44 1xx2 s GLY 335 Ca 0.10 -0.27 -0.10 0.00 0.00 0.00 0.00 44.72 44.45 1xx2 s GLY 335 CO 0.05 -0.23 0.25 -1.50 0.00 0.00 0.00 173.10 171.67 1xx2 s ILE 336 N -3.89 0.03 -0.07 0.90 2.07 0.38 -0.20 121.20 120.41 1xx2 s ILE 336 Ca 0.11 -0.22 0.02 0.00 -1.41 0.00 0.00 60.65 59.16 1xx2 s ILE 336 Cb -0.02 -0.44 0.01 0.00 0.13 0.00 0.00 42.46 42.14 1xx2 s ILE 336 CO 0.01 -0.12 -0.14 -0.69 -1.91 0.00 0.00 174.94 172.09 1xx2 s VAL 337 N -0.43 1.29 -0.19 4.00 1.01 0.68 -2.10 120.40 124.67 1xx2 s VAL 337 Ca -0.05 -0.56 -0.01 0.00 0.00 0.00 0.00 61.98 61.35 1xx2 s VAL 337 Cb -0.04 -1.17 0.05 0.00 0.00 0.00 0.00 36.38 35.23 1xx2 s VAL 337 CO 0.01 0.39 -0.02 -0.04 0.00 0.00 0.00 175.10 175.45 1xx2 s MET 338 N 0.67 1.17 -0.15 2.72 -1.94 -0.38 -1.27 119.30 120.12 1xx2 s MET 338 Ca -0.14 -0.57 0.00 0.00 -1.71 0.00 0.00 55.69 53.27 1xx2 s MET 338 Cb -0.16 -2.13 -0.00 0.00 2.01 0.00 0.00 34.83 34.55 1xx2 s MET 338 CO 0.04 -0.54 -0.15 -0.51 -0.01 0.00 0.00 175.02 173.85 1xx2 s LEU 339 N 1.67 2.47 0.09 -0.03 1.43 -0.45 -1.17 118.68 122.69 1xx2 s LEU 339 Ca -0.01 -0.47 0.05 0.00 -1.03 0.00 0.00 54.13 52.67 1xx2 s LEU 339 Cb -0.17 -1.56 -0.03 0.00 0.03 0.00 0.00 46.19 44.46 1xx2 s LEU 339 CO -0.07 0.09 -0.13 0.00 0.23 0.00 0.00 176.35 176.46 1xx2 s ALA 340 N 0.81 1.23 -0.68 4.21 0.00 -0.59 -1.25 121.76 125.48 1xx2 s ALA 340 Ca -0.05 -1.10 -0.02 0.00 0.00 0.00 0.00 51.96 50.79 1xx2 s ALA 340 Cb -0.15 -0.07 0.42 0.00 0.00 0.00 0.00 23.12 23.32 1xx2 s ALA 340 CO -0.00 0.11 2.04 0.27 0.00 0.00 0.00 175.76 178.19 1xx2 n ASN 341 N 0.98 7.63 -3.64 0.00 6.94 -1.14 -1.81 115.26 124.22 1xx2 n ASN 341 Ca -0.19 -3.76 -0.11 0.00 -0.02 0.00 0.00 54.58 50.50 1xx2 n ASN 341 Cb 0.55 -1.00 -0.07 0.00 -2.36 0.00 0.00 39.78 36.90 1xx2 n ASN 341 CO 0.00 0.00 0.00 0.28 -1.03 0.00 0.00 177.26 176.51 1xx2 s THR 342 N -4.74 0.00 -0.73 5.53 -1.32 -0.21 -1.34 115.64 112.83 1xx2 s THR 342 Ca 0.62 0.00 -0.22 0.00 -1.21 0.00 0.00 61.69 60.88 1xx2 s THR 342 Cb 0.49 -1.00 0.08 0.00 -1.51 0.00 0.00 72.50 70.56 1xx2 s THR 342 CO -0.08 0.00 1.02 -0.55 -2.21 0.00 0.00 174.62 172.81 1xx2 s SER 343 N 0.49 6.28 0.23 8.08 0.15 -1.25 -2.96 113.70 124.72 1xx2 s SER 343 Ca -0.00 -1.22 0.06 0.00 0.70 0.00 0.00 55.95 55.49 1xx2 s SER 343 Cb -0.05 -2.42 -0.04 0.00 -1.71 0.00 0.00 66.02 61.80 1xx2 s SER 343 CO -0.05 -1.37 0.20 -0.72 1.20 0.00 0.00 173.24 172.50 1xx2 s TYR 344 N 3.85 3.15 -0.01 3.44 1.13 -1.26 -4.96 117.35 122.68 1xx2 s TYR 344 Ca 0.26 -0.08 -0.40 0.00 -1.41 0.00 0.00 57.07 55.44 1xx2 s TYR 344 Cb -0.13 -1.44 -0.20 0.00 -1.10 0.00 0.00 41.96 39.09 1xx2 s TYR 344 CO 0.05 0.51 1.12 -2.30 -2.51 0.00 0.00 175.55 172.43 1xx2 n PRO 345 N -1.01 0.12 -0.16 -3.49 -0.02 -1.26 -4.88 135.00 124.29 1xx2 n PRO 345 Ca -0.08 0.04 -0.02 0.00 -2.02 0.00 0.00 63.50 61.42 1xx2 n PRO 345 Cb 0.57 -1.56 0.07 0.00 -0.02 0.00 0.00 33.50 32.56 1xx2 n PRO 345 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 1xx2 h ASN 346 N 3.25 0.05 -0.81 2.55 2.35 -1.97 -2.26 115.58 118.74 1xx2 h ASN 346 Ca -0.50 0.08 0.16 0.00 -0.55 0.00 0.00 56.30 55.49 1xx2 h ASN 346 Cb 1.42 0.10 -0.10 0.00 0.05 0.00 0.00 38.32 39.79 1xx2 h ASN 346 CO 0.68 0.05 0.36 -0.65 -1.65 0.00 0.00 177.43 176.23 1xx2 h PRO 347 N 0.27 0.48 0.00 0.81 0.11 -1.81 0.57 132.00 132.43 1xx2 h PRO 347 Ca 0.25 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 66.29 1xx2 h PRO 347 Cb 0.32 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 31.32 1xx2 h PRO 347 CO -0.31 0.32 -0.20 0.00 -0.21 0.00 0.00 178.00 177.60 1xx2 h ALA 348 N 1.58 1.58 -0.10 -0.75 0.00 -1.78 -1.67 119.26 118.11 1xx2 h ALA 348 Ca 0.46 -0.18 -0.10 0.00 0.00 0.00 0.00 54.91 55.08 1xx2 h ALA 348 Cb 0.71 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.47 1xx2 h ALA 348 CO -0.41 0.25 -0.33 0.00 0.00 0.00 0.00 179.25 178.76 1xx2 h ARG 349 N 0.00 0.40 -0.54 0.00 3.08 -0.77 -3.01 114.38 113.53 1xx2 h ARG 349 Ca -0.00 -0.30 -0.09 0.00 0.07 0.00 0.00 59.98 59.66 1xx2 h ARG 349 Cb 0.38 0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.46 1xx2 h ARG 349 CO 0.03 0.92 -0.00 0.28 -1.07 0.00 0.00 179.97 180.13 1xx2 h VAL 350 N -0.04 1.26 -0.57 2.04 2.07 -1.09 -2.58 116.25 117.34 1xx2 h VAL 350 Ca -0.01 -1.09 -0.06 0.00 0.82 0.00 0.00 66.70 66.36 1xx2 h VAL 350 Cb 0.96 0.84 -0.02 0.00 -1.52 0.00 0.00 31.29 31.55 1xx2 h VAL 350 CO 0.07 0.39 0.11 -0.08 0.02 0.00 0.00 177.57 178.08 1xx2 h GLU 351 N 0.86 0.93 -0.60 1.57 4.81 -1.38 -1.41 114.58 119.36 1xx2 h GLU 351 Ca 0.16 -0.24 -0.04 0.00 -0.13 0.00 0.00 59.36 59.11 1xx2 h GLU 351 Cb 0.51 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.75 1xx2 h GLU 351 CO 0.03 0.88 0.21 0.00 -0.73 0.00 0.00 179.01 179.40 1xx2 h ALA 352 N 1.01 0.78 -0.39 2.92 0.00 -1.40 -2.03 119.26 120.14 1xx2 h ALA 352 Ca 0.17 -0.19 -0.11 0.00 0.00 0.00 0.00 54.91 54.78 1xx2 h ALA 352 Cb 0.39 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1xx2 h ALA 352 CO 0.01 0.43 -0.21 0.00 0.00 0.00 0.00 179.25 179.47 1xx2 h ALA 353 N 1.07 0.89 -0.33 0.00 0.00 -1.28 -2.28 119.26 117.34 1xx2 h ALA 353 Ca 0.20 -0.37 -0.08 0.00 0.00 0.00 0.00 54.91 54.66 1xx2 h ALA 353 Cb 0.25 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1xx2 h ALA 353 CO -0.01 0.63 -0.11 -0.92 0.00 0.00 0.00 179.25 178.84 1xx2 h TYR 354 N 0.67 0.74 -0.01 0.00 5.03 -1.10 -1.29 116.97 121.01 1xx2 h TYR 354 Ca 0.09 -0.17 0.02 0.00 2.58 0.00 0.00 58.73 61.26 1xx2 h TYR 354 Cb 0.72 -0.18 -0.02 0.00 1.55 0.00 0.00 36.73 38.80 1xx2 h TYR 354 CO 0.04 0.84 -0.10 0.45 -1.32 0.00 0.00 178.16 178.07 1xx2 h HIS 355 N 0.43 -0.24 -0.47 -3.82 3.86 -1.28 0.01 115.15 113.64 1xx2 h HIS 355 Ca 0.08 0.01 -0.00 0.00 -1.16 0.00 0.00 60.37 59.30 1xx2 h HIS 355 Cb 0.61 0.11 -0.02 0.00 1.06 0.00 0.00 27.41 29.17 1xx2 h HIS 355 CO 0.05 -0.15 0.28 0.82 0.86 0.00 0.00 177.93 179.80 1xx2 h ILE 356 N -0.16 1.15 0.00 2.45 2.04 -1.36 -1.84 117.51 119.78 1xx2 h ILE 356 Ca 0.04 -0.33 -0.02 0.00 1.00 0.00 0.00 64.86 65.55 1xx2 h ILE 356 Cb 0.21 0.52 -0.00 0.00 -0.74 0.00 0.00 36.82 36.81 1xx2 h ILE 356 CO -0.10 0.15 -0.09 -0.07 0.00 0.00 0.00 178.15 178.04 1xx2 h LEU 357 N 0.62 0.00 -1.12 1.44 3.38 -0.98 -2.41 115.31 116.24 1xx2 h LEU 357 Ca 0.17 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.07 1xx2 h LEU 357 Cb -0.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 1xx2 h LEU 357 CO -0.03 0.09 -0.17 -0.08 0.09 0.00 0.00 178.44 178.34 1xx2 h GLU 358 N 0.00 0.42 0.00 1.13 4.81 -0.12 -2.35 114.58 118.47 1xx2 h GLU 358 Ca -0.00 -0.12 0.00 0.00 -0.13 0.00 0.00 59.36 59.10 1xx2 h GLU 358 Cb 0.40 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.74 1xx2 h GLU 358 CO 0.01 0.58 0.00 0.00 -0.73 0.00 0.00 179.01 178.87 1xx2 n ALA 359 N -2.48 2.62 0.34 2.92 0.00 -0.91 -5.11 120.51 117.89 1xx2 n ALA 359 Ca 0.00 -0.19 0.04 0.00 0.00 0.00 0.00 53.44 53.29 1xx2 n ALA 359 Cb 0.33 -1.48 0.03 0.00 0.00 0.00 0.00 19.45 18.34 1xx2 n ALA 359 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78