#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xcp s MET 2 N 0.00 3.99 -0.16 0.00 1.75 -1.25 -4.52 119.30 119.12 1xcp s MET 2 Ca 0.00 0.51 -0.01 0.00 -1.25 0.00 0.00 55.69 54.95 1xcp s MET 2 Cb 0.00 -2.89 0.04 0.00 2.84 0.00 0.00 34.83 34.81 1xcp s MET 2 CO 0.00 0.45 -0.06 1.03 -0.65 0.00 0.00 175.02 175.80 1xcp s ARG 3 N -2.05 1.44 -0.30 4.11 0.52 -0.58 -4.99 118.95 117.10 1xcp s ARG 3 Ca 0.39 -0.47 -0.22 0.00 -0.52 0.00 0.00 55.73 54.92 1xcp s ARG 3 Cb -0.15 -1.93 -0.00 0.00 0.52 0.00 0.00 34.95 33.39 1xcp s ARG 3 CO 0.19 -0.40 0.72 -0.65 0.02 0.00 0.00 175.30 175.18 1xcp s GLN 4 N 1.65 3.95 0.01 3.54 -0.21 -1.26 -1.94 119.66 125.39 1xcp s GLN 4 Ca 0.01 0.49 0.07 0.00 0.02 0.00 0.00 55.36 55.95 1xcp s GLN 4 Cb -0.15 -3.72 -0.02 0.00 1.00 0.00 0.00 33.01 30.12 1xcp s GLN 4 CO -0.08 -0.63 -0.20 0.00 -2.12 0.00 0.00 175.29 172.27 1xcp s ALA 6 N -0.59 2.06 -0.87 0.00 0.00 -0.38 -1.42 121.76 120.56 1xcp s ALA 6 Ca 0.07 -0.93 -0.14 0.00 0.00 0.00 0.00 51.96 50.97 1xcp s ALA 6 Cb -0.08 -0.84 0.23 0.00 0.00 0.00 0.00 23.12 22.42 1xcp s ALA 6 CO 0.00 0.14 0.82 0.42 0.00 0.00 0.00 175.76 177.14 1xcp s ILE 7 N 0.58 5.65 0.43 0.00 -1.09 0.25 -0.57 121.20 126.45 1xcp s ILE 7 Ca -0.14 -2.58 -0.04 0.00 -2.23 0.00 0.00 60.65 55.66 1xcp s ILE 7 Cb -0.17 -4.49 -0.04 0.00 -1.58 0.00 0.00 42.46 36.18 1xcp s ILE 7 CO 0.04 -1.06 0.71 -0.31 -1.23 0.00 0.00 174.94 173.09 1xcp s TYR 8 N 0.03 3.53 0.00 3.97 1.51 -0.58 -2.09 117.35 123.72 1xcp s TYR 8 Ca 0.20 0.71 0.00 0.00 -1.01 0.00 0.00 57.07 56.97 1xcp s TYR 8 Cb -0.10 -2.20 0.00 0.00 -0.11 0.00 0.00 41.96 39.55 1xcp s TYR 8 CO -0.09 -0.13 0.00 0.41 -1.11 0.00 0.00 175.55 174.63 1xcp n GLY 9 N -1.93 2.86 3.43 0.71 0.00 -1.19 -1.93 105.19 107.13 1xcp n GLY 9 Ca -0.01 -1.31 -0.33 0.00 0.00 0.00 0.00 46.02 44.38 1xcp n GLY 9 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1xcp n LYS 10 N -1.42 -0.37 -2.14 1.61 4.81 -0.96 -0.90 118.16 118.78 1xcp n LYS 10 Ca 0.00 -0.07 -0.41 0.00 -0.87 0.00 0.00 58.31 56.97 1xcp n LYS 10 Cb 0.00 -1.89 -0.02 0.00 0.02 0.00 0.00 35.03 33.14 1xcp n LYS 10 CO 0.00 0.00 0.00 0.20 1.17 0.00 0.00 177.40 178.77 1xcp s GLY 11 N -2.06 2.97 0.00 3.14 0.00 -1.26 -3.72 107.32 106.39 1xcp s GLY 11 Ca 0.58 1.23 0.00 0.00 0.00 0.00 0.00 44.72 46.53 1xcp s GLY 11 CO 0.67 1.89 0.00 0.61 0.00 0.00 0.00 173.10 176.27 1xcp n GLY 12 N 0.92 0.18 0.01 0.20 0.00 -1.26 -4.87 105.19 100.37 1xcp n GLY 12 Ca 0.00 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.16 1xcp n GLY 12 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1xcp n ILE 13 N -2.33 0.08 0.00 -0.61 -5.35 -1.24 -4.89 119.36 105.02 1xcp n ILE 13 Ca 0.00 -0.02 0.00 0.00 -0.27 0.00 0.00 62.75 62.46 1xcp n ILE 13 Cb 0.31 -0.52 0.00 0.00 -1.74 0.00 0.00 39.64 37.69 1xcp n ILE 13 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1xcp n GLY 14 N 1.44 1.91 0.07 3.28 0.00 -1.26 -4.81 105.19 105.81 1xcp n GLY 14 Ca 0.07 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.96 1xcp n GLY 14 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xcp h LYS 15 N 0.00 -0.06 -0.39 1.61 1.57 -1.90 -1.23 116.57 116.17 1xcp h LYS 15 Ca 0.00 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.75 1xcp h LYS 15 Cb 0.00 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.30 1xcp h LYS 15 CO 0.00 0.02 0.11 0.77 -0.57 0.00 0.00 179.45 179.78 1xcp h SER 16 N -0.14 0.52 0.23 0.86 0.02 -1.94 0.16 113.55 113.27 1xcp h SER 16 Ca -0.01 -0.07 -0.32 0.00 -0.84 0.00 0.00 61.79 60.56 1xcp h SER 16 Cb 0.12 -0.13 0.04 0.00 0.14 0.00 0.00 62.40 62.56 1xcp h SER 16 CO 0.01 0.51 -1.38 0.74 -1.14 0.00 0.00 176.83 175.57 1xcp h THR 17 N 0.56 1.31 -0.33 -2.27 2.02 -1.90 -2.44 112.91 109.85 1xcp h THR 17 Ca 0.13 -2.66 -0.09 0.00 0.77 0.00 0.00 66.41 64.56 1xcp h THR 17 Cb 0.19 3.05 -0.01 0.00 -1.74 0.00 0.00 68.15 69.63 1xcp h THR 17 CO -0.01 0.79 -0.13 0.74 0.37 0.00 0.00 175.52 177.28 1xcp h THR 18 N 0.09 1.29 -0.42 3.16 2.02 -1.03 -1.75 112.91 116.26 1xcp h THR 18 Ca -0.24 -1.23 -0.10 0.00 0.77 0.00 0.00 66.41 65.61 1xcp h THR 18 Cb 2.09 1.38 -0.01 0.00 -1.74 0.00 0.00 68.15 69.87 1xcp h THR 18 CO 0.26 0.40 -0.11 0.00 0.37 0.00 0.00 175.52 176.44 1xcp h THR 19 N 0.45 1.27 -0.52 3.16 1.03 -0.76 0.66 112.91 118.21 1xcp h THR 19 Ca 0.08 -1.22 -0.10 0.00 -0.01 0.00 0.00 66.41 65.16 1xcp h THR 19 Cb 0.66 1.20 -0.02 0.00 -1.07 0.00 0.00 68.15 68.92 1xcp h THR 19 CO 0.04 0.41 -0.05 1.56 -0.01 0.00 0.00 175.52 177.47 1xcp h GLN 20 N 0.64 0.96 -0.44 0.00 4.20 -1.43 -1.54 115.11 117.50 1xcp h GLN 20 Ca 0.10 -0.33 -0.12 0.00 0.06 0.00 0.00 58.65 58.36 1xcp h GLN 20 Cb 0.65 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.34 1xcp h GLN 20 CO 0.04 1.00 -0.21 -0.91 -0.67 0.00 0.00 178.83 178.08 1xcp h ASN 21 N 0.83 0.89 -0.11 1.46 4.21 -1.11 -0.25 115.58 121.48 1xcp h ASN 21 Ca 0.14 -0.32 -0.01 0.00 1.21 0.00 0.00 56.30 57.32 1xcp h ASN 21 Cb 0.60 -0.24 -0.00 0.00 -1.12 0.00 0.00 38.32 37.55 1xcp h ASN 21 CO 0.04 1.07 0.03 0.25 -1.29 0.00 0.00 177.43 177.53 1xcp h LEU 22 N 0.76 0.17 -0.39 1.61 5.85 -0.82 -1.30 115.31 121.19 1xcp h LEU 22 Ca 0.10 -0.21 -0.00 0.00 0.84 0.00 0.00 57.88 58.62 1xcp h LEU 22 Cb 0.75 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.71 1xcp h LEU 22 CO 0.06 0.33 0.23 0.58 -0.34 0.00 0.00 178.44 179.30 1xcp h VAL 23 N -0.00 1.13 0.00 1.05 2.07 -1.21 -1.43 116.25 117.85 1xcp h VAL 23 Ca 0.04 -0.30 -0.03 0.00 0.82 0.00 0.00 66.70 67.23 1xcp h VAL 23 Cb 0.22 0.63 -0.00 0.00 -1.52 0.00 0.00 31.29 30.62 1xcp h VAL 23 CO -0.00 0.13 -0.14 0.00 0.02 0.00 0.00 177.57 177.58 1xcp h ALA 24 N 1.10 1.48 0.00 1.67 0.00 -0.83 0.12 119.26 122.79 1xcp h ALA 24 Ca 0.14 -0.13 -0.19 0.00 0.00 0.00 0.00 54.91 54.73 1xcp h ALA 24 Cb 0.01 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 1xcp h ALA 24 CO -0.03 0.18 -0.95 0.00 0.00 0.00 0.00 179.25 178.45 1xcp h ALA 25 N 1.86 0.45 -0.05 0.00 0.00 -0.85 -2.30 119.26 118.38 1xcp h ALA 25 Ca -0.00 -0.85 -0.22 0.00 0.00 0.00 0.00 54.91 53.84 1xcp h ALA 25 Cb 0.31 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1xcp h ALA 25 CO 0.02 1.13 -0.86 -0.07 0.00 0.00 0.00 179.25 179.47 1xcp h LEU 26 N 0.00 0.60 -0.48 0.00 -0.00 -0.25 -2.03 115.31 113.15 1xcp h LEU 26 Ca -0.03 -0.44 -0.14 0.00 -0.00 0.00 0.00 57.88 57.27 1xcp h LEU 26 Cb 1.70 -0.18 -0.01 0.00 -0.00 0.00 0.00 40.66 42.17 1xcp h LEU 26 CO 0.11 1.22 -0.30 0.00 -0.00 0.00 0.00 178.44 179.47 1xcp h ALA 27 N 0.75 0.67 -0.80 1.53 0.00 -0.81 -1.67 119.26 118.92 1xcp h ALA 27 Ca -0.06 -0.42 -0.02 0.00 0.00 0.00 0.00 54.91 54.41 1xcp h ALA 27 Cb 1.48 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 19.09 1xcp h ALA 27 CO 0.15 0.67 0.43 1.49 0.00 0.00 0.00 179.25 181.99 1xcp h GLU 28 N 0.78 1.12 -0.38 0.00 4.81 -1.44 -2.53 114.58 116.94 1xcp h GLU 28 Ca 0.08 -0.13 0.01 0.00 -0.13 0.00 0.00 59.36 59.19 1xcp h GLU 28 Cb 0.88 -0.22 -0.02 0.00 0.63 0.00 0.00 28.75 30.02 1xcp h GLU 28 CO 0.08 0.83 0.23 0.52 -0.73 0.00 0.00 179.01 179.94 1xcp h MET 29 N 1.13 0.46 0.00 1.92 2.86 -0.87 -3.47 114.93 116.95 1xcp h MET 29 Ca 0.28 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.89 1xcp h MET 29 Cb 0.05 -0.10 0.00 0.00 0.06 0.00 0.00 31.60 31.60 1xcp h MET 29 CO -0.04 0.30 0.00 0.41 1.06 0.00 0.00 176.91 178.64 1xcp n GLY 30 N -1.20 1.98 3.51 8.32 0.00 -0.70 -5.10 105.19 112.00 1xcp n GLY 30 Ca 0.01 -0.20 -0.46 0.00 0.00 0.00 0.00 46.02 45.37 1xcp n GLY 30 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1xcp n LYS 31 N 0.00 0.81 -3.41 1.61 4.76 -0.79 -4.86 118.16 116.28 1xcp n LYS 31 Ca 0.00 0.28 -0.41 0.00 -2.87 0.00 0.00 58.31 55.32 1xcp n LYS 31 Cb 0.00 -1.51 -0.09 0.00 -1.84 0.00 0.00 35.03 31.58 1xcp n LYS 31 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 1xcp s LYS 32 N -1.35 3.59 0.24 1.97 1.02 -1.26 -4.05 119.74 119.91 1xcp s LYS 32 Ca 0.61 -0.40 0.08 0.00 0.02 0.00 0.00 55.97 56.28 1xcp s LYS 32 Cb -0.78 -3.79 -0.05 0.00 -0.52 0.00 0.00 37.83 32.69 1xcp s LYS 32 CO 0.58 -0.50 -0.13 0.14 -0.92 0.00 0.00 175.35 174.53 1xcp s VAL 33 N 1.99 1.85 -0.02 3.17 -7.23 -1.26 -0.83 120.40 118.07 1xcp s VAL 33 Ca 0.11 -2.22 0.01 0.00 -1.81 0.00 0.00 61.98 58.07 1xcp s VAL 33 Cb -0.17 -2.23 0.01 0.00 0.56 0.00 0.00 36.38 34.55 1xcp s VAL 33 CO 0.11 -0.46 -0.02 -0.32 -0.31 0.00 0.00 175.10 174.10 1xcp s MET 34 N -3.65 0.35 0.03 4.82 1.75 -0.47 -1.91 119.30 120.23 1xcp s MET 34 Ca 0.26 -0.05 0.05 0.00 -1.25 0.00 0.00 55.69 54.70 1xcp s MET 34 Cb 0.00 -0.42 -0.03 0.00 2.84 0.00 0.00 34.83 37.22 1xcp s MET 34 CO 0.10 -0.02 -0.11 0.42 -0.65 0.00 0.00 175.02 174.76 1xcp s ILE 35 N 0.42 3.31 -0.03 10.11 1.01 -0.53 -0.17 121.20 135.31 1xcp s ILE 35 Ca -0.04 -0.97 0.05 0.00 0.00 0.00 0.00 60.65 59.69 1xcp s ILE 35 Cb -0.07 -2.44 -0.01 0.00 0.01 0.00 0.00 42.46 39.95 1xcp s ILE 35 CO -0.01 0.34 -0.19 -0.69 0.00 0.00 0.00 174.94 174.40 1xcp s VAL 36 N -0.99 1.52 0.07 2.92 1.01 0.74 -1.97 120.40 123.70 1xcp s VAL 36 Ca 0.17 -0.79 0.06 0.00 0.00 0.00 0.00 61.98 61.41 1xcp s VAL 36 Cb -0.11 -1.28 -0.04 0.00 0.00 0.00 0.00 36.38 34.95 1xcp s VAL 36 CO 0.07 0.43 -0.07 -0.83 0.00 0.00 0.00 175.10 174.70 1xcp s GLY 37 N -0.18 1.81 0.00 4.51 0.00 0.53 -1.95 107.32 112.03 1xcp s GLY 37 Ca 0.01 -1.16 0.00 0.00 0.00 0.00 0.00 44.72 43.57 1xcp s GLY 37 CO 0.01 -1.11 0.00 0.00 0.00 0.00 0.00 173.10 172.00 1xcp s ASP 39 N -0.01 6.56 0.29 0.00 1.11 -1.26 -4.45 116.67 118.91 1xcp s ASP 39 Ca 0.00 2.40 -0.03 0.00 0.18 0.00 0.00 52.55 55.10 1xcp s ASP 39 Cb 0.00 -2.62 0.61 0.00 1.07 0.00 0.00 42.92 41.98 1xcp s ASP 39 CO 0.00 -0.66 1.57 -0.65 1.18 0.00 0.00 175.17 176.61 1xcp h PRO 40 N 2.76 0.00 -7.39 8.23 0.11 -1.90 -3.40 132.00 130.42 1xcp h PRO 40 Ca -0.49 -0.00 -0.46 0.00 0.11 0.00 0.00 66.00 65.17 1xcp h PRO 40 Cb 1.23 -0.00 0.09 0.00 0.11 0.00 0.00 31.00 32.44 1xcp h PRO 40 CO 0.63 0.00 0.26 -1.59 -0.21 0.00 0.00 178.00 177.09 1xcp s LYS 41 N -6.13 1.92 0.00 1.05 0.00 -1.26 -4.13 119.74 111.19 1xcp s LYS 41 Ca -0.14 -0.31 0.30 0.00 0.00 0.00 0.00 55.97 55.82 1xcp s LYS 41 Cb 0.28 -2.12 1.52 0.00 0.00 0.00 0.00 37.83 37.52 1xcp s LYS 41 CO 0.78 -1.45 2.01 0.00 0.00 0.00 0.00 175.35 176.69 1xcp n ALA 42 N -3.07 2.66 0.29 0.59 0.00 -1.26 -4.64 120.51 115.08 1xcp n ALA 42 Ca 0.10 -0.29 0.11 0.00 0.00 0.00 0.00 53.44 53.36 1xcp n ALA 42 Cb 0.60 -1.38 0.53 0.00 0.00 0.00 0.00 19.45 19.21 1xcp n ALA 42 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.50 177.88 1xcp h ASP 43 N 0.86 0.00 1.03 0.00 -0.00 -1.91 -2.95 116.42 113.44 1xcp h ASP 43 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 57.03 57.02 1xcp h ASP 43 Cb 0.22 0.00 -0.00 0.00 -0.00 0.00 0.00 39.33 39.55 1xcp h ASP 43 CO 0.00 0.00 -0.04 0.28 -0.00 0.00 0.00 179.24 179.48 1xcp h SER 44 N 0.00 0.00 0.00 4.15 0.02 -1.91 -3.31 113.55 112.50 1xcp h SER 44 Ca 0.04 0.00 -0.19 0.00 -0.84 0.00 0.00 61.79 60.80 1xcp h SER 44 Cb 1.24 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 63.74 1xcp h SER 44 CO -0.00 0.04 -1.81 0.35 -1.14 0.00 0.00 176.83 174.26 1xcp n THR 45 N -3.15 0.70 -0.33 -2.27 -2.24 -1.11 -4.75 114.28 101.14 1xcp n THR 45 Ca 0.01 -0.49 0.27 0.00 -2.27 0.00 0.00 64.05 61.56 1xcp n THR 45 Cb 0.33 -0.52 0.51 0.00 -2.10 0.00 0.00 70.33 68.55 1xcp n THR 45 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 1xcp h ARG 46 N 0.00 0.10 0.00 -0.78 2.43 -1.66 -2.25 114.38 112.22 1xcp h ARG 46 Ca -0.28 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.89 1xcp h ARG 46 Cb 1.56 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 31.09 1xcp h ARG 46 CO 0.02 0.07 0.00 -0.07 -1.51 0.00 0.00 179.97 178.47 1xcp h LEU 47 N 0.11 0.00 0.16 3.80 3.38 -1.81 -0.09 115.31 120.86 1xcp h LEU 47 Ca 0.77 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 58.40 1xcp h LEU 47 Cb 1.92 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.67 1xcp h LEU 47 CO -0.73 0.00 -1.74 0.40 0.09 0.00 0.00 178.44 176.45 1xcp h ILE 48 N 0.00 0.89 0.00 1.22 1.08 -1.68 -2.99 117.51 116.03 1xcp h ILE 48 Ca 0.00 -2.45 0.00 0.00 -0.39 0.00 0.00 64.86 62.02 1xcp h ILE 48 Cb 0.69 2.70 0.00 0.00 -3.07 0.00 0.00 36.82 37.14 1xcp h ILE 48 CO 0.00 0.84 -0.61 0.18 -0.69 0.00 0.00 178.15 177.87 1xcp n LEU 49 N -3.64 0.58 0.00 1.44 4.77 -1.07 -2.35 117.00 116.73 1xcp n LEU 49 Ca -0.26 0.08 0.00 0.00 -0.03 0.00 0.00 56.01 55.79 1xcp n LEU 49 Cb 1.04 -0.21 0.00 0.00 -2.33 0.00 0.00 43.42 41.92 1xcp n LEU 49 CO 0.48 0.05 0.00 1.41 -1.33 0.00 0.00 177.39 178.00 1xcp n HIS 50 N -1.76 0.00 -3.45 -1.77 8.25 -0.05 -4.99 115.22 111.44 1xcp n HIS 50 Ca 0.04 0.00 -0.32 0.00 -0.26 0.00 0.00 57.72 57.18 1xcp n HIS 50 Cb 0.38 -1.76 -0.05 0.00 1.12 0.00 0.00 29.99 29.68 1xcp n HIS 50 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1xcp s SER 51 N -2.01 6.62 0.33 0.41 1.04 -1.22 -4.91 113.70 113.95 1xcp s SER 51 Ca 0.00 0.88 0.05 0.00 0.48 0.00 0.00 55.95 57.36 1xcp s SER 51 Cb 0.00 -2.21 0.59 0.00 0.10 0.00 0.00 66.02 64.50 1xcp s SER 51 CO 0.00 -0.04 1.84 0.50 0.98 0.00 0.00 173.24 176.52 1xcp h LYS 52 N 2.65 0.45 -4.09 4.02 1.63 -1.94 -3.44 116.57 115.86 1xcp h LYS 52 Ca -0.47 -0.11 -0.13 0.00 -0.85 0.00 0.00 60.65 59.09 1xcp h LYS 52 Cb 1.17 -0.05 -0.14 0.00 -0.60 0.00 0.00 32.23 32.61 1xcp h LYS 52 CO 0.69 0.55 -0.49 0.00 -3.45 0.00 0.00 179.45 176.76 1xcp s ALA 53 N -4.79 0.29 0.07 5.00 0.00 -1.26 -4.81 121.76 116.26 1xcp s ALA 53 Ca -0.07 -1.05 0.06 0.00 0.00 0.00 0.00 51.96 50.90 1xcp s ALA 53 Cb 0.15 0.68 -0.03 0.00 0.00 0.00 0.00 23.12 23.92 1xcp s ALA 53 CO 0.76 -0.52 -0.16 -1.14 0.00 0.00 0.00 175.76 174.70 1xcp s GLN 54 N -3.96 0.96 -0.23 0.00 0.74 -1.26 -5.02 119.66 110.88 1xcp s GLN 54 Ca 0.15 -0.97 -0.29 0.00 0.05 0.00 0.00 55.36 54.30 1xcp s GLN 54 Cb 0.06 -1.04 -0.01 0.00 1.10 0.00 0.00 33.01 33.11 1xcp s GLN 54 CO -0.04 0.24 1.43 -0.80 -0.55 0.00 0.00 175.29 175.58 1xcp s ASN 55 N -1.63 6.60 0.93 6.67 0.01 -1.26 -4.85 114.94 121.42 1xcp s ASN 55 Ca 0.02 1.50 0.00 0.00 -0.71 0.00 0.00 52.86 53.66 1xcp s ASN 55 Cb -0.09 -2.54 0.00 0.00 0.41 0.00 0.00 41.25 39.03 1xcp s ASN 55 CO 0.03 -1.09 0.00 0.35 -1.51 0.00 0.00 177.10 174.88 1xcp n THR 56 N 6.11 0.00 0.05 1.60 -2.24 -1.26 -4.54 114.28 113.99 1xcp n THR 56 Ca 0.16 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 62.03 1xcp n THR 56 Cb 0.46 -1.95 -0.07 0.00 -2.10 0.00 0.00 70.33 66.66 1xcp n THR 56 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 1xcp n ILE 57 N -1.90 0.56 0.07 2.28 5.41 -1.08 -3.18 119.36 121.52 1xcp n ILE 57 Ca 0.00 -0.57 -0.13 0.00 1.00 0.00 0.00 62.75 63.05 1xcp n ILE 57 Cb 0.00 -0.31 -0.09 0.00 -0.71 0.00 0.00 39.64 38.54 1xcp n ILE 57 CO 0.00 0.00 0.00 0.24 0.00 0.00 0.00 176.55 176.79 1xcp h MET 58 N 0.00 -0.17 -0.01 0.38 2.86 -1.86 -1.59 114.93 114.54 1xcp h MET 58 Ca -0.05 0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.60 1xcp h MET 58 Cb 1.16 0.04 0.00 0.00 0.06 0.00 0.00 31.60 32.86 1xcp h MET 58 CO 0.01 0.15 0.00 -0.85 1.06 0.00 0.00 176.91 177.28 1xcp n GLU 59 N -5.02 1.04 -0.13 1.72 0.28 -1.26 -1.97 120.64 115.31 1xcp n GLU 59 Ca -0.09 -0.06 -0.26 0.00 -0.16 0.00 0.00 57.16 56.59 1xcp n GLU 59 Cb 0.22 -1.20 -0.11 0.00 1.43 0.00 0.00 31.44 31.78 1xcp n GLU 59 CO 0.00 0.00 0.00 -1.33 -0.16 0.00 0.00 177.13 175.64 1xcp n MET 60 N -0.63 0.61 -0.03 3.44 2.81 -1.19 -4.52 117.12 117.62 1xcp n MET 60 Ca 0.09 0.23 -0.13 0.00 -1.81 0.00 0.00 57.70 56.08 1xcp n MET 60 Cb 0.06 -1.51 -0.09 0.00 -0.71 0.00 0.00 33.22 30.97 1xcp n MET 60 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1xcp h ALA 61 N -0.63 0.09 0.00 3.04 0.00 -1.00 -2.92 119.26 117.85 1xcp h ALA 61 Ca -0.65 -0.28 -0.07 0.00 0.00 0.00 0.00 54.91 53.91 1xcp h ALA 61 Cb 1.71 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.47 1xcp h ALA 61 CO -0.30 -0.11 -0.34 0.00 0.00 0.00 0.00 179.25 178.51 1xcp h ALA 62 N 0.56 1.05 -0.61 0.00 0.00 -1.61 -1.17 119.26 117.49 1xcp h ALA 62 Ca 0.01 -0.30 -0.27 0.00 0.00 0.00 0.00 54.91 54.34 1xcp h ALA 62 Cb 0.56 -0.05 -0.16 0.00 0.00 0.00 0.00 17.79 18.14 1xcp h ALA 62 CO 0.02 0.42 0.35 0.39 0.00 0.00 0.00 179.25 180.42 1xcp n GLU 63 N -3.57 2.21 0.00 0.00 4.71 -1.22 -3.74 120.64 119.03 1xcp n GLU 63 Ca -0.00 -2.03 0.00 0.00 -0.01 0.00 0.00 57.16 55.12 1xcp n GLU 63 Cb 0.47 -1.83 0.00 0.00 -1.01 0.00 0.00 31.44 29.06 1xcp n GLU 63 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1xcp n ALA 64 N -0.39 0.56 0.00 0.62 0.00 -1.10 -4.96 120.51 115.25 1xcp n ALA 64 Ca 0.35 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.79 1xcp n ALA 64 Cb 1.20 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.65 1xcp n ALA 64 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xcp n GLY 65 N 0.00 0.73 0.91 0.00 0.00 -0.45 -4.93 105.19 101.45 1xcp n GLY 65 Ca 0.00 -0.72 -0.08 0.00 0.00 0.00 0.00 46.02 45.22 1xcp n GLY 65 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1xcp n THR 66 N 0.00 0.00 0.04 2.61 5.66 -1.23 -4.43 114.28 116.92 1xcp n THR 66 Ca 0.00 -0.59 -0.05 0.00 -3.05 0.00 0.00 64.05 60.36 1xcp n THR 66 Cb 0.00 0.06 -0.10 0.00 -1.55 0.00 0.00 70.33 68.74 1xcp n THR 66 CO 0.00 0.00 0.00 1.62 -3.05 0.00 0.00 175.07 173.64 1xcp h VAL 67 N 1.00 1.10 0.00 1.08 3.04 -1.93 -3.39 116.25 117.15 1xcp h VAL 67 Ca -0.10 -2.77 -0.00 0.00 -1.01 0.00 0.00 66.70 62.81 1xcp h VAL 67 Cb 0.32 2.51 -0.00 0.00 -2.01 0.00 0.00 31.29 32.10 1xcp h VAL 67 CO 0.17 0.62 -0.02 -0.33 -1.01 0.00 0.00 177.57 177.01 1xcp h GLU 68 N 0.00 0.00 0.00 4.17 3.07 -1.97 -1.85 114.58 118.00 1xcp h GLU 68 Ca -0.13 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.73 1xcp h GLU 68 Cb 1.77 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.68 1xcp h GLU 68 CO 0.09 0.02 -0.68 -0.40 -1.40 0.00 0.00 179.01 176.64 1xcp n ASP 69 N -3.89 0.68 -4.75 1.42 5.75 -1.26 -4.89 116.55 109.61 1xcp n ASP 69 Ca -0.03 0.07 -0.41 0.00 -0.01 0.00 0.00 54.79 54.41 1xcp n ASP 69 Cb 0.10 0.25 -0.03 0.00 -1.03 0.00 0.00 41.12 40.42 1xcp n ASP 69 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1xcp s LEU 70 N -4.16 4.45 0.31 -2.12 1.43 -0.70 -5.04 118.68 112.86 1xcp s LEU 70 Ca 0.06 2.45 0.09 0.00 -1.03 0.00 0.00 54.13 55.70 1xcp s LEU 70 Cb 0.14 -3.63 -0.04 0.00 0.03 0.00 0.00 46.19 42.69 1xcp s LEU 70 CO 0.73 -0.43 0.07 -1.83 0.23 0.00 0.00 176.35 175.12 1xcp s GLU 71 N -0.99 2.31 0.30 1.70 1.03 -1.26 -5.06 118.70 116.73 1xcp s GLU 71 Ca 0.51 -1.52 0.04 0.00 0.03 0.00 0.00 54.97 54.03 1xcp s GLU 71 Cb -0.36 -2.14 0.64 0.00 -0.80 0.00 0.00 34.13 31.47 1xcp s GLU 71 CO 0.44 0.22 1.84 1.25 -1.33 0.00 0.00 175.26 177.68 1xcp h LEU 72 N 1.72 0.84 -0.87 1.83 5.85 -1.96 -3.20 115.31 119.53 1xcp h LEU 72 Ca -0.44 0.05 0.11 0.00 0.84 0.00 0.00 57.88 58.44 1xcp h LEU 72 Cb 1.25 -0.12 -0.08 0.00 0.37 0.00 0.00 40.66 42.09 1xcp h LEU 72 CO 0.63 0.43 0.50 -0.33 -0.34 0.00 0.00 178.44 179.32 1xcp h GLU 73 N 0.89 0.78 -0.09 1.25 3.07 -1.97 0.18 114.58 118.69 1xcp h GLU 73 Ca 0.49 -0.05 0.00 0.00 -0.50 0.00 0.00 59.36 59.31 1xcp h GLU 73 Cb 0.59 -0.18 0.00 0.00 -0.84 0.00 0.00 28.75 28.33 1xcp h GLU 73 CO -0.26 0.52 0.00 -0.40 -1.40 0.00 0.00 179.01 177.47 1xcp n ASP 74 N -4.74 1.66 -0.03 1.42 5.75 -1.21 -3.89 116.55 115.52 1xcp n ASP 74 Ca 0.15 -1.62 -0.04 0.00 -0.01 0.00 0.00 54.79 53.28 1xcp n ASP 74 Cb 0.32 -0.05 -0.04 0.00 -1.03 0.00 0.00 41.12 40.32 1xcp n ASP 74 CO 0.00 0.00 0.00 0.52 -0.11 0.00 0.00 177.20 177.61 1xcp n VAL 75 N 0.31 0.42 -3.77 2.12 0.31 -0.90 -4.92 118.33 111.90 1xcp n VAL 75 Ca 0.18 -0.22 -0.37 0.00 -0.01 0.00 0.00 64.34 63.91 1xcp n VAL 75 Cb 0.36 -0.81 -0.13 0.00 -0.91 0.00 0.00 33.84 32.35 1xcp n VAL 75 CO 0.00 0.00 0.00 -0.22 -1.32 0.00 0.00 176.83 175.29 1xcp s LEU 76 N -4.88 4.10 0.16 7.52 1.98 0.00 -4.52 118.68 123.04 1xcp s LEU 76 Ca -0.06 -0.98 0.08 0.00 -2.89 0.00 0.00 54.13 50.28 1xcp s LEU 76 Cb 0.02 -1.86 -0.04 0.00 0.66 0.00 0.00 46.19 44.97 1xcp s LEU 76 CO 0.22 -0.27 -0.18 -0.54 -1.89 0.00 0.00 176.35 173.68 1xcp s LYS 77 N 1.43 1.24 -0.02 1.98 3.01 -1.06 -4.65 119.74 121.68 1xcp s LYS 77 Ca -0.00 -1.37 0.01 0.00 -1.01 0.00 0.00 55.97 53.60 1xcp s LYS 77 Cb -0.19 -1.30 -0.03 0.00 -1.01 0.00 0.00 37.83 35.30 1xcp s LYS 77 CO 0.02 0.27 -0.02 0.00 0.51 0.00 0.00 175.35 176.12 1xcp s ALA 78 N -1.98 3.18 0.00 5.17 0.00 -1.26 -1.16 121.76 125.71 1xcp s ALA 78 Ca 0.14 -0.94 0.00 0.00 0.00 0.00 0.00 51.96 51.16 1xcp s ALA 78 Cb -0.06 -1.29 0.00 0.00 0.00 0.00 0.00 23.12 21.77 1xcp s ALA 78 CO 0.06 0.62 0.00 0.41 0.00 0.00 0.00 175.76 176.85 1xcp n GLY 79 N 1.64 4.08 3.62 0.00 0.00 -1.03 -4.92 105.19 108.59 1xcp n GLY 79 Ca -0.16 -0.88 -0.49 0.00 0.00 0.00 0.00 46.02 44.50 1xcp n GLY 79 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1xcp n TYR 80 N 0.00 1.76 0.00 1.61 4.19 -0.99 -2.29 117.16 121.43 1xcp n TYR 80 Ca 0.00 0.52 0.00 0.00 3.31 0.00 0.00 57.90 61.73 1xcp n TYR 80 Cb 0.00 -2.39 0.00 0.00 0.49 0.00 0.00 39.34 37.44 1xcp n TYR 80 CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 1xcp n GLY 81 N 2.55 1.88 0.00 2.98 0.00 -1.26 -2.50 105.19 108.84 1xcp n GLY 81 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 1xcp n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xcp n GLY 82 N -0.71 1.55 3.58 -0.02 0.00 -0.97 -4.99 105.19 103.63 1xcp n GLY 82 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 1xcp n GLY 82 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xcp s VAL 83 N -2.00 4.56 0.10 1.61 1.01 -1.04 -4.65 120.40 119.99 1xcp s VAL 83 Ca 0.00 0.89 -0.30 0.00 0.00 0.00 0.00 61.98 62.57 1xcp s VAL 83 Cb 0.00 -4.36 -0.06 0.00 0.00 0.00 0.00 36.38 31.96 1xcp s VAL 83 CO 0.00 -0.67 1.11 -0.54 0.00 0.00 0.00 175.10 175.00 1xcp s LYS 84 N 3.53 4.53 -0.06 2.72 1.02 -0.80 -2.46 119.74 128.22 1xcp s LYS 84 Ca 0.36 1.67 -0.18 0.00 0.02 0.00 0.00 55.97 57.84 1xcp s LYS 84 Cb -0.11 -3.34 0.04 0.00 -0.52 0.00 0.00 37.83 33.89 1xcp s LYS 84 CO 0.22 -0.07 0.42 0.00 -0.92 0.00 0.00 175.35 175.00 1xcp s VAL 86 N -0.91 0.08 0.01 0.00 0.11 -0.83 -2.56 120.40 116.30 1xcp s VAL 86 Ca -0.10 -0.62 0.07 0.00 -2.93 0.00 0.00 61.98 58.40 1xcp s VAL 86 Cb -0.04 -0.45 -0.03 0.00 -1.53 0.00 0.00 36.38 34.34 1xcp s VAL 86 CO 0.05 -0.34 -0.20 -1.61 -3.33 0.00 0.00 175.10 169.66 1xcp s GLU 87 N -1.29 2.11 -0.17 1.54 0.41 -1.26 -0.35 118.70 119.69 1xcp s GLU 87 Ca -0.14 -0.94 -0.15 0.00 -0.41 0.00 0.00 54.97 53.33 1xcp s GLU 87 Cb -0.07 -2.16 -0.10 0.00 -1.78 0.00 0.00 34.13 30.02 1xcp s GLU 87 CO 0.02 0.55 0.01 1.03 -0.49 0.00 0.00 175.26 176.38 1xcp h SER 88 N 4.93 0.00 0.00 -0.19 0.87 -1.37 -2.85 113.55 114.94 1xcp h SER 88 Ca -0.46 -0.24 0.00 0.00 -1.23 0.00 0.00 61.79 59.86 1xcp h SER 88 Cb 1.15 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.11 1xcp h SER 88 CO 0.47 1.08 0.00 0.61 -0.53 0.00 0.00 176.83 178.46 1xcp n GLY 89 N 1.54 2.40 3.37 5.77 0.00 -1.26 -2.68 105.19 114.33 1xcp n GLY 89 Ca -0.18 -1.51 -0.46 0.00 0.00 0.00 0.00 46.02 43.87 1xcp n GLY 89 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1xcp s GLY 90 N 0.00 2.25 0.02 -0.02 0.00 -1.26 -4.71 107.32 103.60 1xcp s GLY 90 Ca 0.00 -2.90 -0.04 0.00 0.00 0.00 0.00 44.72 41.78 1xcp s GLY 90 CO 0.00 1.53 0.58 -1.05 0.00 0.00 0.00 173.10 174.17 1xcp n PRO 91 N 5.25 -0.05 -3.69 2.90 -0.02 -1.26 -4.29 135.00 133.83 1xcp n PRO 91 Ca 0.10 0.58 -0.11 0.00 -2.02 0.00 0.00 63.50 62.06 1xcp n PRO 91 Cb 0.46 -0.86 -0.11 0.00 -0.02 0.00 0.00 33.50 32.97 1xcp n PRO 91 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 1xcp s GLU 92 N -3.49 0.30 -0.60 -0.52 2.56 -1.21 -4.99 118.70 110.75 1xcp s GLU 92 Ca -0.01 0.79 -0.26 0.00 0.00 0.00 0.00 54.97 55.48 1xcp s GLU 92 Cb 0.01 0.04 -0.10 0.00 2.00 0.00 0.00 34.13 36.08 1xcp s GLU 92 CO 0.07 -0.20 2.45 -0.35 -0.56 0.00 0.00 175.26 176.67 1xcp n PRO 93 N 4.70 0.84 0.00 4.30 -0.04 -1.26 -0.94 135.00 142.59 1xcp n PRO 93 Ca -0.18 -0.09 0.00 0.00 -0.04 0.00 0.00 63.50 63.19 1xcp n PRO 93 Cb 0.53 -3.18 0.00 0.00 -0.04 0.00 0.00 33.50 30.80 1xcp n PRO 93 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1xcp n GLY 94 N 6.15 1.66 3.53 0.55 0.00 -1.26 -5.08 105.19 110.73 1xcp n GLY 94 Ca 0.42 -0.34 -0.34 0.00 0.00 0.00 0.00 46.02 45.77 1xcp n GLY 94 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xcp s VAL 95 N -1.08 3.68 0.25 1.61 1.01 -0.12 -5.05 120.40 120.71 1xcp s VAL 95 Ca 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 61.98 61.52 1xcp s VAL 95 Cb 0.00 -2.55 0.00 0.00 0.00 0.00 0.00 36.38 33.83 1xcp s VAL 95 CO 0.00 0.55 0.00 0.61 0.00 0.00 0.00 175.10 176.26 1xcp n GLY 96 N 2.82 -3.43 3.72 4.51 0.00 -1.26 -3.31 105.19 108.24 1xcp n GLY 96 Ca -0.18 -1.07 -0.42 0.00 0.00 0.00 0.00 46.02 44.35 1xcp n GLY 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xcp h ALA 98 N 6.74 0.86 -0.21 0.00 0.00 -1.94 -3.10 119.26 121.62 1xcp h ALA 98 Ca -0.42 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.32 1xcp h ALA 98 Cb 1.21 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 1xcp h ALA 98 CO 0.87 0.44 0.07 0.78 0.00 0.00 0.00 179.25 181.41 1xcp h GLY 99 N 0.93 0.34 2.00 0.00 0.00 -1.92 -3.11 103.07 101.30 1xcp h GLY 99 Ca 0.23 -0.19 -0.01 0.00 0.00 0.00 0.00 47.33 47.36 1xcp h GLY 99 CO -0.03 0.18 -0.03 3.21 0.00 0.00 0.00 176.54 179.87 1xcp h ARG 100 N 0.17 0.00 -0.70 4.80 3.08 -1.78 -2.60 114.38 117.36 1xcp h ARG 100 Ca 0.07 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 60.06 1xcp h ARG 100 Cb 0.21 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.23 1xcp h ARG 100 CO -0.00 0.03 0.21 0.78 -1.07 0.00 0.00 179.97 179.92 1xcp h GLY 101 N 0.14 1.16 1.77 0.04 0.00 -1.47 -0.91 103.07 103.81 1xcp h GLY 101 Ca -0.00 -0.68 -0.07 0.00 0.00 0.00 0.00 47.33 46.58 1xcp h GLY 101 CO 0.00 0.64 -0.53 -0.24 0.00 0.00 0.00 176.54 176.41 1xcp h VAL 102 N 1.04 0.49 -0.06 4.60 3.04 -1.56 -2.03 116.25 121.76 1xcp h VAL 102 Ca 0.23 -1.73 -0.19 0.00 -1.01 0.00 0.00 66.70 64.00 1xcp h VAL 102 Cb 0.30 2.16 -0.00 0.00 -2.01 0.00 0.00 31.29 31.74 1xcp h VAL 102 CO -0.01 0.28 -0.78 0.40 -1.01 0.00 0.00 177.57 176.46 1xcp h ILE 103 N 0.00 1.38 -0.79 3.17 1.08 -1.43 -2.05 117.51 118.88 1xcp h ILE 103 Ca -0.02 -2.21 0.02 0.00 -0.39 0.00 0.00 64.86 62.26 1xcp h ILE 103 Cb 1.26 2.18 -0.04 0.00 -3.07 0.00 0.00 36.82 37.15 1xcp h ILE 103 CO 0.04 0.66 0.52 0.74 -0.69 0.00 0.00 178.15 179.42 1xcp h THR 104 N 0.27 1.17 -0.42 -0.27 2.02 -1.08 -2.40 112.91 112.21 1xcp h THR 104 Ca -0.04 -0.36 -0.03 0.00 0.77 0.00 0.00 66.41 66.75 1xcp h THR 104 Cb 1.37 0.04 -0.02 0.00 -1.74 0.00 0.00 68.15 67.80 1xcp h THR 104 CO 0.13 0.19 0.15 0.00 0.37 0.00 0.00 175.52 176.36 1xcp h ALA 105 N 1.30 0.55 -0.02 6.16 0.00 -1.18 -2.68 119.26 123.39 1xcp h ALA 105 Ca 0.30 -0.16 -0.15 0.00 0.00 0.00 0.00 54.91 54.91 1xcp h ALA 105 Cb -0.07 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1xcp h ALA 105 CO -0.08 0.18 -0.65 0.97 0.00 0.00 0.00 179.25 179.66 1xcp h ILE 106 N 0.54 1.44 -0.86 0.00 2.10 -1.22 -1.96 117.51 117.56 1xcp h ILE 106 Ca 0.14 -2.16 -0.03 0.00 1.08 0.00 0.00 64.86 63.89 1xcp h ILE 106 Cb 0.23 2.15 -0.04 0.00 -1.09 0.00 0.00 36.82 38.06 1xcp h ILE 106 CO -0.01 0.63 0.43 0.78 -1.08 0.00 0.00 178.15 178.90 1xcp h ASN 107 N 0.07 1.10 -0.21 2.19 -0.26 -1.37 -0.20 115.58 116.91 1xcp h ASN 107 Ca -0.01 -0.12 -0.00 0.00 -0.56 0.00 0.00 56.30 55.60 1xcp h ASN 107 Cb 1.16 -0.28 -0.01 0.00 -1.06 0.00 0.00 38.32 38.13 1xcp h ASN 107 CO 0.09 0.92 0.12 0.15 -1.06 0.00 0.00 177.43 177.65 1xcp h PHE 108 N 1.21 0.29 -0.56 1.19 3.04 -1.27 -1.84 116.94 119.00 1xcp h PHE 108 Ca 0.30 -0.01 0.04 0.00 3.98 0.00 0.00 57.97 62.28 1xcp h PHE 108 Cb 0.09 -0.09 -0.04 0.00 2.56 0.00 0.00 35.95 38.46 1xcp h PHE 108 CO 0.01 0.25 0.31 -0.07 -2.02 0.00 0.00 178.31 176.80 1xcp h LEU 109 N 0.24 0.47 0.00 0.59 3.38 -0.45 -1.40 115.31 118.13 1xcp h LEU 109 Ca 0.07 0.02 -0.18 0.00 0.09 0.00 0.00 57.88 57.89 1xcp h LEU 109 Cb 0.06 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 40.71 1xcp h LEU 109 CO -0.01 0.32 -0.90 1.05 0.09 0.00 0.00 178.44 178.99 1xcp h GLU 110 N 0.60 0.00 0.00 1.13 4.11 -1.10 -2.37 114.58 116.95 1xcp h GLU 110 Ca 0.24 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 59.64 1xcp h GLU 110 Cb 0.12 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.36 1xcp h GLU 110 CO -0.15 0.79 -0.14 1.05 0.07 0.00 0.00 179.01 180.62 1xcp h GLU 111 N 0.00 0.00 -0.23 1.06 4.11 -1.11 -2.40 114.58 116.01 1xcp h GLU 111 Ca -0.03 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.40 1xcp h GLU 111 Cb 1.65 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.90 1xcp h GLU 111 CO 0.10 0.14 0.00 -1.91 0.07 0.00 0.00 179.01 177.42 1xcp n GLU 112 N -3.19 1.97 -2.49 1.06 4.07 -0.55 -5.00 120.64 116.51 1xcp n GLU 112 Ca 0.02 -1.46 -0.08 0.00 -0.06 0.00 0.00 57.16 55.58 1xcp n GLU 112 Cb 0.49 -1.43 0.04 0.00 -0.06 0.00 0.00 31.44 30.48 1xcp n GLU 112 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1xcp n GLY 113 N 1.24 -0.32 0.11 8.31 0.00 -0.90 -4.95 105.19 108.67 1xcp n GLY 113 Ca 0.17 0.22 -0.13 0.00 0.00 0.00 0.00 46.02 46.28 1xcp n GLY 113 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xcp n ALA 114 N -2.41 1.43 -0.06 4.61 0.00 -0.91 -4.30 120.51 118.87 1xcp n ALA 114 Ca -0.04 -1.10 -0.06 0.00 0.00 0.00 0.00 53.44 52.24 1xcp n ALA 114 Cb 0.56 -0.35 0.12 0.00 0.00 0.00 0.00 19.45 19.78 1xcp n ALA 114 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 1xcp h TYR 115 N 0.01 0.77 -0.82 0.00 0.05 -1.88 -3.26 116.97 111.84 1xcp h TYR 115 Ca -0.49 -0.17 0.23 0.00 0.05 0.00 0.00 58.73 58.35 1xcp h TYR 115 Cb 2.10 -0.19 -0.04 0.00 1.01 0.00 0.00 36.73 39.62 1xcp h TYR 115 CO 0.01 0.86 0.59 0.93 -1.05 0.00 0.00 178.16 179.50 1xcp h GLU 116 N 0.60 0.04 -7.26 4.88 5.08 -1.92 -3.43 114.58 112.57 1xcp h GLU 116 Ca 0.08 -0.00 -0.46 0.00 -1.00 0.00 0.00 59.36 57.98 1xcp h GLU 116 Cb 0.72 -0.01 0.18 0.00 0.50 0.00 0.00 28.75 30.14 1xcp h GLU 116 CO 0.06 0.03 0.13 -0.51 -1.00 0.00 0.00 179.01 177.72 1xcp s ASP 117 N -5.75 2.13 0.00 1.42 1.01 -1.23 -4.87 116.67 109.38 1xcp s ASP 117 Ca -0.05 1.45 0.00 0.00 0.71 0.00 0.00 52.55 54.65 1xcp s ASP 117 Cb 0.21 -2.14 0.00 0.00 1.01 0.00 0.00 42.92 42.00 1xcp s ASP 117 CO 0.77 -3.48 0.00 -0.90 0.21 0.00 0.00 175.17 171.77 1xcp n ASP 118 N -4.43 0.00 -4.71 0.27 5.75 -1.26 -4.87 116.55 107.30 1xcp n ASP 118 Ca 0.05 0.00 -0.42 0.00 -0.01 0.00 0.00 54.79 54.41 1xcp n ASP 118 Cb 0.55 0.00 -0.03 0.00 -1.03 0.00 0.00 41.12 40.61 1xcp n ASP 118 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1xcp s LEU 119 N 0.00 4.37 -0.00 -2.12 1.02 -1.26 -4.76 118.68 115.92 1xcp s LEU 119 Ca 0.00 2.60 -0.03 0.00 0.02 0.00 0.00 54.13 56.72 1xcp s LEU 119 Cb 0.00 -3.58 -0.28 0.00 0.02 0.00 0.00 46.19 42.35 1xcp s LEU 119 CO 0.00 -0.86 0.83 0.44 0.02 0.00 0.00 176.35 176.79 1xcp h ASP 120 N 7.30 0.38 -4.65 2.29 3.32 -1.22 -3.32 116.42 120.53 1xcp h ASP 120 Ca -0.43 -0.54 -0.16 0.00 0.02 0.00 0.00 57.03 55.92 1xcp h ASP 120 Cb 1.20 -0.12 -0.22 0.00 0.22 0.00 0.00 39.33 40.41 1xcp h ASP 120 CO 0.92 1.46 -0.55 -0.36 -1.72 0.00 0.00 179.24 178.99 1xcp s PHE 121 N -2.61 0.03 -0.02 4.55 0.40 -1.01 -1.52 117.98 117.78 1xcp s PHE 121 Ca -0.09 -0.07 0.05 0.00 -0.60 0.00 0.00 56.93 56.22 1xcp s PHE 121 Cb 0.07 -0.04 -0.01 0.00 0.51 0.00 0.00 43.02 43.55 1xcp s PHE 121 CO 0.85 -0.21 -0.16 0.08 0.70 0.00 0.00 175.22 176.48 1xcp s VAL 122 N -1.00 1.27 -0.05 -0.44 1.01 -0.82 -1.37 120.40 119.00 1xcp s VAL 122 Ca -0.11 -0.66 0.04 0.00 0.00 0.00 0.00 61.98 61.24 1xcp s VAL 122 Cb -0.06 -1.07 0.00 0.00 0.00 0.00 0.00 36.38 35.25 1xcp s VAL 122 CO 0.01 0.36 -0.16 -0.36 0.00 0.00 0.00 175.10 174.95 1xcp s PHE 123 N -0.21 1.66 -0.22 5.22 0.08 0.76 -0.68 117.98 124.59 1xcp s PHE 123 Ca 0.02 -0.53 -0.00 0.00 0.12 0.00 0.00 56.93 56.55 1xcp s PHE 123 Cb -0.08 -1.14 0.02 0.00 -0.57 0.00 0.00 43.02 41.25 1xcp s PHE 123 CO 0.00 -0.21 -0.13 0.71 -0.10 0.00 0.00 175.22 175.50 1xcp s TYR 124 N 0.23 2.96 -0.59 0.36 2.02 -0.51 -0.19 117.35 121.63 1xcp s TYR 124 Ca -0.08 -1.62 -0.25 0.00 -0.37 0.00 0.00 57.07 54.75 1xcp s TYR 124 Cb -0.13 -1.99 0.04 0.00 -0.40 0.00 0.00 41.96 39.49 1xcp s TYR 124 CO 0.03 -0.76 1.03 0.34 -1.57 0.00 0.00 175.55 174.62 1xcp s ASP 125 N 1.30 6.33 -0.03 2.29 -1.08 -0.82 -0.58 116.67 124.07 1xcp s ASP 125 Ca 0.02 -0.32 0.05 0.00 -0.52 0.00 0.00 52.55 51.77 1xcp s ASP 125 Cb -0.15 -2.47 -0.01 0.00 -1.46 0.00 0.00 42.92 38.83 1xcp s ASP 125 CO -0.08 -1.36 -0.17 -0.69 0.52 0.00 0.00 175.17 173.39 1xcp s VAL 126 N 4.35 1.39 -0.07 1.11 1.01 -0.89 -3.27 120.40 124.03 1xcp s VAL 126 Ca 0.33 -0.71 -0.30 0.00 0.00 0.00 0.00 61.98 61.30 1xcp s VAL 126 Cb -0.11 -1.18 -0.04 0.00 0.00 0.00 0.00 36.38 35.05 1xcp s VAL 126 CO 0.19 0.40 1.39 -0.22 0.00 0.00 0.00 175.10 176.86 1xcp s LEU 127 N -0.12 4.27 -0.38 3.92 2.96 -1.26 -3.20 118.68 124.87 1xcp s LEU 127 Ca 0.00 1.96 0.01 0.00 -0.22 0.00 0.00 54.13 55.89 1xcp s LEU 127 Cb -0.10 -3.55 0.15 0.00 0.50 0.00 0.00 46.19 43.20 1xcp s LEU 127 CO 0.01 -0.77 0.25 -0.83 -1.32 0.00 0.00 176.35 173.70 1xcp s GLY 128 N 2.20 1.01 0.00 7.98 0.00 -0.08 -4.84 107.32 113.59 1xcp s GLY 128 Ca 0.62 -2.09 0.00 0.00 0.00 0.00 0.00 44.72 43.25 1xcp s GLY 128 CO 0.23 2.07 0.00 1.34 0.00 0.00 0.00 173.10 176.74 1xcp n ASP 129 N 3.63 0.00 -4.56 1.64 4.64 -1.26 -2.26 116.55 118.39 1xcp n ASP 129 Ca 0.17 0.00 -0.42 0.00 -1.38 0.00 0.00 54.79 53.16 1xcp n ASP 129 Cb 0.40 0.00 -0.03 0.00 -1.04 0.00 0.00 41.12 40.45 1xcp n ASP 129 CO 0.00 0.00 0.00 -0.69 -0.82 0.00 0.00 177.20 175.69 1xcp s VAL 130 N -0.25 4.13 -0.93 5.18 1.01 -1.26 -4.72 120.40 123.56 1xcp s VAL 130 Ca 0.00 0.66 -0.13 0.00 0.00 0.00 0.00 61.98 62.50 1xcp s VAL 130 Cb 0.00 -4.67 0.22 0.00 0.00 0.00 0.00 36.38 31.93 1xcp s VAL 130 CO 0.00 -1.29 0.93 -0.69 0.00 0.00 0.00 175.10 174.05 1xcp s VAL 131 N 4.65 5.57 0.54 2.92 1.01 -1.26 -4.82 120.40 129.01 1xcp s VAL 131 Ca 0.38 -2.60 -0.02 0.00 0.00 0.00 0.00 61.98 59.73 1xcp s VAL 131 Cb -0.09 -4.56 0.11 0.00 0.00 0.00 0.00 36.38 31.84 1xcp s VAL 131 CO 0.23 -1.16 0.74 0.00 0.00 0.00 0.00 175.10 174.91 1xcp h GLY 133 N -0.57 0.87 0.27 0.00 0.00 -1.94 -0.75 103.07 100.95 1xcp h GLY 133 Ca -0.24 -0.23 -0.01 0.00 0.00 0.00 0.00 47.33 46.85 1xcp h GLY 133 CO 0.24 0.09 -0.04 -1.33 0.00 0.00 0.00 176.54 175.49 1xcp h GLY 134 N 0.53 0.03 1.41 4.60 0.00 -1.97 -3.35 103.07 104.32 1xcp h GLY 134 Ca 0.38 -0.06 -0.16 0.00 0.00 0.00 0.00 47.33 47.50 1xcp h GLY 134 CO -0.14 0.05 -0.53 1.49 0.00 0.00 0.00 176.54 177.40 1xcp h TRP 135 N -0.72 0.78 -0.93 5.60 4.06 -1.82 -3.32 115.95 119.59 1xcp h TRP 135 Ca -0.00 -0.27 -0.69 0.00 2.06 0.00 0.00 58.89 59.98 1xcp h TRP 135 Cb 0.81 -0.15 -0.09 0.00 -1.00 0.00 0.00 29.16 28.73 1xcp h TRP 135 CO 0.19 1.02 2.22 0.00 -3.56 0.00 0.00 178.44 178.32 1xcp n ALA 136 N -2.53 3.94 0.00 1.49 0.00 -0.31 -4.41 120.51 118.70 1xcp n ALA 136 Ca -0.03 -3.92 0.00 0.00 0.00 0.00 0.00 53.44 49.48 1xcp n ALA 136 Cb 0.60 -3.50 0.00 0.00 0.00 0.00 0.00 19.45 16.55 1xcp n ALA 136 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1xcp n MET 137 N 7.54 5.06 0.31 0.00 2.81 -1.25 -4.06 117.12 127.53 1xcp n MET 137 Ca 0.47 0.00 0.20 0.00 -1.81 0.00 0.00 57.70 56.56 1xcp n MET 137 Cb 0.44 -0.51 1.00 0.00 -0.71 0.00 0.00 33.22 33.45 1xcp n MET 137 CO 0.00 0.00 0.00 -1.35 1.51 0.00 0.00 175.97 176.13 1xcp h PRO 138 N 0.00 0.00 0.06 0.03 0.11 -1.89 0.52 132.00 130.82 1xcp h PRO 138 Ca 0.00 0.00 -0.18 0.00 0.11 0.00 0.00 66.00 65.93 1xcp h PRO 138 Cb 0.00 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.10 1xcp h PRO 138 CO 0.00 0.01 -0.93 0.82 -0.21 0.00 0.00 178.00 177.69 1xcp h ILE 139 N 0.00 1.25 0.06 4.15 2.04 -1.85 0.24 117.51 123.40 1xcp h ILE 139 Ca -0.00 -2.34 -0.00 0.00 1.00 0.00 0.00 64.86 63.52 1xcp h ILE 139 Cb 0.19 2.81 0.00 0.00 -0.74 0.00 0.00 36.82 39.08 1xcp h ILE 139 CO 0.00 0.57 -0.03 -0.09 0.00 0.00 0.00 178.15 178.61 1xcp h ARG 140 N -0.69 -0.08 -0.08 2.37 2.43 -1.69 -2.89 114.38 113.75 1xcp h ARG 140 Ca -0.22 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.96 1xcp h ARG 140 Cb 1.42 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.99 1xcp h ARG 140 CO -0.02 0.29 0.00 0.39 -1.51 0.00 0.00 179.97 179.12 1xcp n GLU 141 N -4.95 1.18 -4.07 0.20 -0.58 0.17 -4.90 120.64 107.69 1xcp n GLU 141 Ca -0.08 -0.28 -0.31 0.00 -0.42 0.00 0.00 57.16 56.06 1xcp n GLU 141 Cb 0.21 -1.08 -0.02 0.00 -0.57 0.00 0.00 31.44 29.99 1xcp n GLU 141 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 1xcp n ASN 142 N -0.29 -2.37 -0.45 1.62 5.15 -0.87 -4.85 115.26 113.20 1xcp n ASN 142 Ca 0.04 -0.97 0.14 0.00 -0.60 0.00 0.00 54.58 53.18 1xcp n ASN 142 Cb 0.07 -3.05 0.45 0.00 -0.53 0.00 0.00 39.78 36.72 1xcp n ASN 142 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 1xcp n LYS 143 N -4.44 1.48 -3.50 1.20 4.01 0.02 -4.82 118.16 112.12 1xcp n LYS 143 Ca -0.08 -0.91 -0.08 0.00 -0.51 0.00 0.00 58.31 56.74 1xcp n LYS 143 Cb 0.57 -1.48 -0.08 0.00 -0.51 0.00 0.00 35.03 33.53 1xcp n LYS 143 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1xcp s ALA 144 N -2.14 -1.22 -0.09 7.82 0.00 -1.08 -4.81 121.76 120.23 1xcp s ALA 144 Ca 0.33 1.30 -0.01 0.00 0.00 0.00 0.00 51.96 53.58 1xcp s ALA 144 Cb 0.20 -1.53 -0.00 0.00 0.00 0.00 0.00 23.12 21.79 1xcp s ALA 144 CO 0.39 -1.01 -0.02 1.96 0.00 0.00 0.00 175.76 177.08 1xcp h GLN 145 N 8.16 0.00 -5.47 0.00 7.50 -1.49 -3.41 115.11 120.40 1xcp h GLN 145 Ca -0.18 0.00 -0.61 0.00 0.50 0.00 0.00 58.65 58.36 1xcp h GLN 145 Cb 1.13 0.00 -0.12 0.00 0.05 0.00 0.00 27.48 28.54 1xcp h GLN 145 CO 0.19 0.00 0.12 -1.83 -1.50 0.00 0.00 178.83 175.81 1xcp s GLU 146 N -1.54 4.09 0.08 1.46 -1.05 -0.96 -0.49 118.70 120.29 1xcp s GLU 146 Ca -0.02 0.48 0.03 0.00 -0.15 0.00 0.00 54.97 55.31 1xcp s GLU 146 Cb 0.00 -3.65 -0.04 0.00 -0.44 0.00 0.00 34.13 30.00 1xcp s GLU 146 CO 0.03 -0.41 0.09 0.42 0.95 0.00 0.00 175.26 176.34 1xcp s ILE 147 N 2.47 4.62 -0.04 1.83 1.01 -0.45 -1.25 121.20 129.39 1xcp s ILE 147 Ca 0.25 -0.73 -0.00 0.00 0.00 0.00 0.00 60.65 60.16 1xcp s ILE 147 Cb -0.15 -3.23 0.03 0.00 0.01 0.00 0.00 42.46 39.11 1xcp s ILE 147 CO 0.09 0.12 0.02 -0.31 0.00 0.00 0.00 174.94 174.86 1xcp s TYR 148 N -1.41 0.26 -0.29 3.97 2.02 0.27 -0.11 117.35 122.07 1xcp s TYR 148 Ca 0.30 0.05 -0.09 0.00 -0.37 0.00 0.00 57.07 56.96 1xcp s TYR 148 Cb -0.12 -0.45 -0.02 0.00 -0.40 0.00 0.00 41.96 40.97 1xcp s TYR 148 CO 0.23 -0.16 0.14 0.42 -1.57 0.00 0.00 175.55 174.60 1xcp s ILE 149 N 1.38 4.63 0.24 2.71 1.01 -0.77 -1.53 121.20 128.87 1xcp s ILE 149 Ca -0.05 -0.29 -0.24 0.00 0.00 0.00 0.00 60.65 60.07 1xcp s ILE 149 Cb -0.13 -3.30 -0.09 0.00 0.01 0.00 0.00 42.46 38.95 1xcp s ILE 149 CO -0.03 0.15 0.81 -0.69 0.00 0.00 0.00 174.94 175.18 1xcp s VAL 150 N 1.63 4.39 0.09 2.92 1.01 -0.81 -0.52 120.40 129.11 1xcp s VAL 150 Ca 0.05 1.59 -0.14 0.00 0.00 0.00 0.00 61.98 63.49 1xcp s VAL 150 Cb -0.16 -4.00 0.05 0.00 0.00 0.00 0.00 36.38 32.26 1xcp s VAL 150 CO 0.06 0.29 0.66 0.00 0.00 0.00 0.00 175.10 176.12 1xcp s SER 152 N -2.55 0.35 -1.59 0.00 1.04 -1.26 -0.77 113.70 108.92 1xcp s SER 152 Ca 0.15 -1.24 -0.10 0.00 0.48 0.00 0.00 55.95 55.23 1xcp s SER 152 Cb -0.02 0.57 -0.07 0.00 0.10 0.00 0.00 66.02 66.60 1xcp s SER 152 CO 0.03 -1.13 2.85 0.61 0.98 0.00 0.00 173.24 176.57 1xcp n GLY 153 N -0.43 4.24 3.08 7.32 0.00 -1.26 -4.04 105.19 114.11 1xcp n GLY 153 Ca 0.00 -1.49 -0.13 0.00 0.00 0.00 0.00 46.02 44.40 1xcp n GLY 153 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1xcp s GLU 154 N 2.35 0.24 0.05 1.61 -6.30 -1.26 -5.00 118.70 110.38 1xcp s GLU 154 Ca 0.66 0.43 -0.09 0.00 -2.50 0.00 0.00 54.97 53.47 1xcp s GLU 154 Cb 0.17 0.01 -0.02 0.00 0.00 0.00 0.00 34.13 34.29 1xcp s GLU 154 CO -0.06 -0.10 0.95 -0.12 0.02 0.00 0.00 175.26 175.95 1xcp n MET 155 N 3.59 -0.13 -0.35 4.30 0.00 -1.26 -1.65 117.12 121.62 1xcp n MET 155 Ca -0.19 0.94 0.00 0.00 -0.00 0.00 0.00 57.70 58.45 1xcp n MET 155 Cb 0.56 -1.40 0.16 0.00 0.00 0.00 0.00 33.22 32.54 1xcp n MET 155 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 175.97 176.49 1xcp h MET 156 N 0.00 1.21 -0.60 2.12 2.86 -1.97 0.41 114.93 118.95 1xcp h MET 156 Ca 0.05 -0.07 -0.05 0.00 -2.06 0.00 0.00 59.70 57.57 1xcp h MET 156 Cb 0.12 -0.27 -0.03 0.00 0.06 0.00 0.00 31.60 31.48 1xcp h MET 156 CO -0.28 0.80 0.20 0.00 1.06 0.00 0.00 176.91 178.69 1xcp h ALA 157 N 1.43 0.79 -0.06 6.32 0.00 -1.67 0.80 119.26 126.86 1xcp h ALA 157 Ca 0.38 -0.20 -0.15 0.00 0.00 0.00 0.00 54.91 54.94 1xcp h ALA 157 Cb -0.03 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 1xcp h ALA 157 CO -0.11 0.45 -0.64 0.52 0.00 0.00 0.00 179.25 179.47 1xcp h MET 158 N 0.85 0.23 0.01 0.00 2.86 -0.93 -1.31 114.93 116.64 1xcp h MET 158 Ca 0.20 -0.17 -0.23 0.00 -2.06 0.00 0.00 59.70 57.43 1xcp h MET 158 Cb 0.27 0.03 0.00 0.00 0.06 0.00 0.00 31.60 31.96 1xcp h MET 158 CO -0.01 0.80 -0.97 -0.92 1.06 0.00 0.00 176.91 176.87 1xcp h TYR 159 N 0.17 0.59 -0.72 -0.22 -0.00 0.05 -2.01 116.97 114.84 1xcp h TYR 159 Ca -0.01 -0.33 -0.01 0.00 -0.00 0.00 0.00 58.73 58.38 1xcp h TYR 159 Cb 1.16 -0.06 -0.03 0.00 -0.00 0.00 0.00 36.73 37.79 1xcp h TYR 159 CO 0.02 1.16 0.40 0.00 -0.00 0.00 0.00 178.16 179.75 1xcp h ALA 160 N 0.73 0.92 -0.26 1.82 0.00 -0.76 -1.12 119.26 120.58 1xcp h ALA 160 Ca -0.08 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 54.74 1xcp h ALA 160 Cb 1.61 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 19.09 1xcp h ALA 160 CO 0.17 0.42 0.13 0.00 0.00 0.00 0.00 179.25 179.97 1xcp h ALA 161 N 1.21 0.32 -0.78 0.00 0.00 -1.05 -1.25 119.26 117.70 1xcp h ALA 161 Ca 0.25 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.12 1xcp h ALA 161 Cb 0.02 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 1xcp h ALA 161 CO -0.04 -0.26 0.29 -0.97 0.00 0.00 0.00 179.25 178.27 1xcp h ASN 162 N 0.28 1.10 0.09 0.00 -0.00 -0.98 -1.62 115.58 114.44 1xcp h ASN 162 Ca 0.11 -0.18 -0.11 0.00 -0.00 0.00 0.00 56.30 56.11 1xcp h ASN 162 Cb 0.03 -0.29 -0.01 0.00 -0.00 0.00 0.00 38.32 38.05 1xcp h ASN 162 CO -0.07 0.99 -0.38 0.78 -0.00 0.00 0.00 177.43 178.75 1xcp h ASN 163 N 1.15 0.41 -0.17 1.15 -0.26 -0.90 -2.57 115.58 114.38 1xcp h ASN 163 Ca 0.26 -0.17 -0.10 0.00 -0.56 0.00 0.00 56.30 55.73 1xcp h ASN 163 Cb 0.25 -0.11 -0.01 0.00 -1.06 0.00 0.00 38.32 37.38 1xcp h ASN 163 CO -0.02 0.75 -0.21 0.40 -1.06 0.00 0.00 177.43 177.30 1xcp h ILE 164 N 0.33 1.26 -0.49 2.81 2.04 -0.63 -2.28 117.51 120.55 1xcp h ILE 164 Ca 0.03 -1.25 0.06 0.00 1.00 0.00 0.00 64.86 64.71 1xcp h ILE 164 Cb 0.82 1.24 -0.05 0.00 -0.74 0.00 0.00 36.82 38.09 1xcp h ILE 164 CO 0.07 0.41 0.21 0.28 0.00 0.00 0.00 178.15 179.11 1xcp h SER 165 N 0.54 0.25 -0.50 1.72 0.02 -1.04 -1.58 113.55 112.97 1xcp h SER 165 Ca 0.08 0.05 0.02 0.00 -0.84 0.00 0.00 61.79 61.10 1xcp h SER 165 Cb 0.65 0.01 -0.03 0.00 0.14 0.00 0.00 62.40 63.18 1xcp h SER 165 CO 0.05 0.18 0.33 0.11 -1.14 0.00 0.00 176.83 176.35 1xcp h LYS 166 N 0.40 0.58 -0.11 3.45 1.57 -1.03 -1.22 116.57 120.21 1xcp h LYS 166 Ca 0.23 -0.03 -0.14 0.00 -1.87 0.00 0.00 60.65 58.83 1xcp h LYS 166 Cb 0.20 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.37 1xcp h LYS 166 CO -0.21 0.38 -0.54 0.78 -0.57 0.00 0.00 179.45 179.30 1xcp h GLY 167 N 0.60 0.35 1.14 3.86 0.00 -0.90 -0.91 103.07 107.21 1xcp h GLY 167 Ca 0.20 -0.40 -0.17 0.00 0.00 0.00 0.00 47.33 46.95 1xcp h GLY 167 CO -0.05 0.36 -0.46 -2.22 0.00 0.00 0.00 176.54 174.17 1xcp h ILE 168 N 0.25 1.27 -0.77 2.60 2.04 -0.63 -3.13 117.51 119.14 1xcp h ILE 168 Ca 0.00 -1.64 -0.01 0.00 1.00 0.00 0.00 64.86 64.21 1xcp h ILE 168 Cb 1.03 1.50 -0.04 0.00 -0.74 0.00 0.00 36.82 38.58 1xcp h ILE 168 CO 0.09 0.54 0.44 0.58 0.00 0.00 0.00 178.15 179.80 1xcp h VAL 169 N 0.72 1.23 -0.53 1.67 2.07 -1.03 -2.37 116.25 118.00 1xcp h VAL 169 Ca 0.04 -0.54 -0.05 0.00 0.82 0.00 0.00 66.70 66.97 1xcp h VAL 169 Cb 1.07 0.18 -0.02 0.00 -1.52 0.00 0.00 31.29 31.00 1xcp h VAL 169 CO 0.11 0.25 0.13 0.50 0.02 0.00 0.00 177.57 178.58 1xcp h LYS 170 N 1.06 0.81 -0.89 1.57 1.63 -1.13 -3.14 116.57 116.48 1xcp h LYS 170 Ca 0.27 -0.16 -0.59 0.00 -0.85 0.00 0.00 60.65 59.33 1xcp h LYS 170 Cb 0.01 -0.12 -0.39 0.00 -0.60 0.00 0.00 32.23 31.12 1xcp h LYS 170 CO -0.05 0.73 -0.40 0.66 -3.45 0.00 0.00 179.45 176.94 1xcp n TYR 171 N -4.28 2.91 -0.04 1.91 4.01 -1.07 -4.53 117.16 116.08 1xcp n TYR 171 Ca 0.04 -2.47 -0.08 0.00 -0.16 0.00 0.00 57.90 55.24 1xcp n TYR 171 Cb 0.22 -0.59 -0.14 0.00 -0.31 0.00 0.00 39.34 38.52 1xcp n TYR 171 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1xcp n ALA 172 N -0.74 1.57 0.32 -0.72 0.00 -0.92 -2.85 120.51 117.18 1xcp n ALA 172 Ca 0.48 -0.90 0.20 0.00 0.00 0.00 0.00 53.44 53.23 1xcp n ALA 172 Cb 0.86 -0.67 1.11 0.00 0.00 0.00 0.00 19.45 20.75 1xcp n ALA 172 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 1xcp h ASN 173 N 0.00 0.00 0.00 0.00 2.35 -1.81 -3.31 115.58 112.81 1xcp h ASN 173 Ca -0.34 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.41 1xcp h ASN 173 Cb 2.01 0.00 0.00 0.00 0.05 0.00 0.00 38.32 40.38 1xcp h ASN 173 CO 0.06 0.01 -0.62 -1.54 -1.65 0.00 0.00 177.43 173.68 1xcp n SER 174 N -3.29 1.57 -3.91 5.81 3.41 -1.26 -5.10 113.62 110.84 1xcp n SER 174 Ca -0.03 0.00 -0.30 0.00 -0.26 0.00 0.00 58.87 58.28 1xcp n SER 174 Cb 0.09 0.00 0.22 0.00 -0.26 0.00 0.00 64.21 64.26 1xcp n SER 174 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1xcp s GLY 175 N -4.13 1.67 -0.03 5.00 0.00 -1.13 -5.00 107.32 103.70 1xcp s GLY 175 Ca 0.00 -1.08 0.09 0.00 0.00 0.00 0.00 44.72 43.73 1xcp s GLY 175 CO 0.00 -0.24 1.21 1.44 0.00 0.00 0.00 173.10 175.52 1xcp n SER 176 N -4.35 2.81 -4.57 1.64 7.64 -1.26 -4.77 113.62 110.75 1xcp n SER 176 Ca 0.14 -2.19 -0.41 0.00 1.01 0.00 0.00 58.87 57.43 1xcp n SER 176 Cb 0.59 -0.23 -0.03 0.00 -1.01 0.00 0.00 64.21 63.54 1xcp n SER 176 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 1xcp s VAL 177 N -1.34 3.44 0.04 0.44 -7.23 -1.26 -4.58 120.40 109.91 1xcp s VAL 177 Ca 0.21 0.37 0.08 0.00 -1.81 0.00 0.00 61.98 60.83 1xcp s VAL 177 Cb 0.13 -3.83 -0.03 0.00 0.56 0.00 0.00 36.38 33.21 1xcp s VAL 177 CO 0.10 -0.68 -0.24 -0.13 -0.31 0.00 0.00 175.10 173.84 1xcp s ARG 178 N 6.33 1.62 -0.38 4.82 1.81 0.36 -4.80 118.95 128.72 1xcp s ARG 178 Ca 0.72 -1.02 -0.26 0.00 -1.72 0.00 0.00 55.73 53.45 1xcp s ARG 178 Cb -0.17 -1.76 0.02 0.00 -0.45 0.00 0.00 34.95 32.59 1xcp s ARG 178 CO 0.27 0.45 0.95 -1.17 -0.68 0.00 0.00 175.30 175.12 1xcp s LEU 179 N -1.16 3.97 0.01 2.53 2.96 -0.25 -1.34 118.68 125.41 1xcp s LEU 179 Ca 0.10 0.58 -0.25 0.00 -0.22 0.00 0.00 54.13 54.34 1xcp s LEU 179 Cb -0.09 -3.29 -0.17 0.00 0.50 0.00 0.00 46.19 43.13 1xcp s LEU 179 CO 0.02 -0.89 1.30 1.23 -1.32 0.00 0.00 176.35 176.69 1xcp h GLY 180 N 10.16 -0.33 -0.06 7.98 0.00 -0.69 -2.23 103.07 117.89 1xcp h GLY 180 Ca -0.23 0.12 0.01 0.00 0.00 0.00 0.00 47.33 47.23 1xcp h GLY 180 CO 0.99 -0.12 0.03 0.61 0.00 0.00 0.00 176.54 178.05 1xcp n GLY 181 N -0.33 0.48 3.43 4.60 0.00 -1.21 -4.66 105.19 107.51 1xcp n GLY 181 Ca -0.09 -0.82 -0.33 0.00 0.00 0.00 0.00 46.02 44.78 1xcp n GLY 181 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xcp s LEU 182 N 0.00 2.81 -0.24 0.99 1.43 -0.07 -1.84 118.68 121.75 1xcp s LEU 182 Ca 0.01 -0.24 -0.07 0.00 -1.03 0.00 0.00 54.13 52.79 1xcp s LEU 182 Cb -0.00 -1.61 -0.03 0.00 0.03 0.00 0.00 46.19 44.58 1xcp s LEU 182 CO -0.00 0.24 0.08 -0.63 0.23 0.00 0.00 176.35 176.27 1xcp s ILE 183 N -0.10 4.42 -0.43 -0.59 1.01 0.33 -1.15 121.20 124.69 1xcp s ILE 183 Ca -0.01 -0.14 -0.18 0.00 0.00 0.00 0.00 60.65 60.32 1xcp s ILE 183 Cb -0.14 -3.06 0.02 0.00 0.01 0.00 0.00 42.46 39.30 1xcp s ILE 183 CO 0.03 0.35 0.48 0.00 0.00 0.00 0.00 174.94 175.80 1xcp s ASN 185 N 1.87 6.49 0.25 0.00 3.04 0.05 -1.30 114.94 125.33 1xcp s ASN 185 Ca 0.14 0.11 -0.31 0.00 0.04 0.00 0.00 52.86 52.84 1xcp s ASN 185 Cb -0.17 -2.45 -0.11 0.00 -1.54 0.00 0.00 41.25 36.98 1xcp s ASN 185 CO 0.15 -1.06 1.63 -0.55 -3.04 0.00 0.00 177.10 174.22 1xcp s SER 186 N 2.29 6.41 -0.11 -4.21 0.15 0.03 -4.48 113.70 113.78 1xcp s SER 186 Ca 0.37 2.87 0.15 0.00 0.70 0.00 0.00 55.95 60.04 1xcp s SER 186 Cb -0.10 -2.62 0.54 0.00 -1.71 0.00 0.00 66.02 62.13 1xcp s SER 186 CO 0.26 -0.91 1.46 0.54 1.20 0.00 0.00 173.24 175.79 1xcp n ARG 187 N 3.00 3.28 -3.62 5.44 1.74 -1.26 -3.97 116.66 121.27 1xcp n ARG 187 Ca 0.11 -2.66 -0.21 0.00 -0.77 0.00 0.00 57.85 54.32 1xcp n ARG 187 Cb 0.37 -1.72 0.05 0.00 -1.02 0.00 0.00 32.46 30.13 1xcp n ARG 187 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 1xcp n ASN 188 N 0.33 -2.26 -4.54 0.55 5.15 -1.26 -5.02 115.26 108.21 1xcp n ASN 188 Ca 0.20 -0.80 -0.27 0.00 -0.60 0.00 0.00 54.58 53.11 1xcp n ASN 188 Cb 0.78 -4.25 -0.10 0.00 -0.53 0.00 0.00 39.78 35.69 1xcp n ASN 188 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 1xcp s THR 189 N -3.58 3.06 0.03 -0.44 2.01 -1.26 -5.10 115.64 110.35 1xcp s THR 189 Ca 0.10 -1.65 -0.21 0.00 0.31 0.00 0.00 61.69 60.24 1xcp s THR 189 Cb -0.02 -2.49 -0.12 0.00 0.01 0.00 0.00 72.50 69.88 1xcp s THR 189 CO 0.80 -0.06 1.20 -0.78 -0.69 0.00 0.00 174.62 175.09 1xcp h ASP 190 N 3.12 -0.64 -1.09 3.53 1.82 -2.02 -3.31 116.42 117.84 1xcp h ASP 190 Ca -0.47 0.02 -0.67 0.00 -0.39 0.00 0.00 57.03 55.52 1xcp h ASP 190 Cb 1.20 0.17 -0.31 0.00 0.68 0.00 0.00 39.33 41.06 1xcp h ASP 190 CO 0.52 -0.42 0.64 0.54 -1.61 0.00 0.00 179.24 178.91 1xcp n ARG 191 N -4.24 2.83 0.08 0.28 1.74 -1.26 -4.57 116.66 111.52 1xcp n ARG 191 Ca -0.09 -3.45 -0.13 0.00 -0.77 0.00 0.00 57.85 53.40 1xcp n ARG 191 Cb 0.30 -2.29 -0.08 0.00 -1.02 0.00 0.00 32.46 29.37 1xcp n ARG 191 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 1xcp h GLU 192 N 2.14 -0.22 -0.96 5.56 5.08 -1.95 -1.63 114.58 122.59 1xcp h GLU 192 Ca 0.57 0.02 0.13 0.00 -1.00 0.00 0.00 59.36 59.07 1xcp h GLU 192 Cb 0.82 0.05 -0.08 0.00 0.50 0.00 0.00 28.75 30.04 1xcp h GLU 192 CO 1.46 0.15 0.61 0.38 -1.00 0.00 0.00 179.01 180.61 1xcp h ASP 193 N -0.66 0.84 -0.27 1.42 3.04 -1.87 0.96 116.42 119.88 1xcp h ASP 193 Ca -0.02 0.05 -0.04 0.00 -3.24 0.00 0.00 57.03 53.77 1xcp h ASP 193 Cb 0.48 -0.12 -0.01 0.00 -1.04 0.00 0.00 39.33 38.64 1xcp h ASP 193 CO 0.04 0.44 -0.01 -0.33 -2.04 0.00 0.00 179.24 177.34 1xcp h GLU 194 N 0.89 0.48 -0.55 4.15 5.08 -1.89 -0.08 114.58 122.66 1xcp h GLU 194 Ca 0.48 -0.16 -0.00 0.00 -1.00 0.00 0.00 59.36 58.68 1xcp h GLU 194 Cb 0.57 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.75 1xcp h GLU 194 CO -0.25 0.65 0.32 1.25 -1.00 0.00 0.00 179.01 179.98 1xcp h LEU 195 N 0.25 0.66 -0.46 1.33 5.85 -0.27 0.35 115.31 123.02 1xcp h LEU 195 Ca 0.07 -0.07 -0.17 0.00 0.84 0.00 0.00 57.88 58.55 1xcp h LEU 195 Cb 0.44 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.29 1xcp h LEU 195 CO 0.02 0.53 -0.67 0.40 -0.34 0.00 0.00 178.44 178.38 1xcp h ILE 196 N 0.74 1.37 -0.50 4.05 1.08 -0.84 -0.51 117.51 122.89 1xcp h ILE 196 Ca 0.20 -2.04 -0.10 0.00 -0.39 0.00 0.00 64.86 62.53 1xcp h ILE 196 Cb -0.00 2.02 -0.02 0.00 -3.07 0.00 0.00 36.82 35.75 1xcp h ILE 196 CO -0.04 0.62 -0.09 0.40 -0.69 0.00 0.00 178.15 178.35 1xcp h ILE 197 N 0.30 1.26 -0.45 -0.67 2.04 -0.69 0.54 117.51 119.84 1xcp h ILE 197 Ca -0.02 -1.20 -0.02 0.00 1.00 0.00 0.00 64.86 64.62 1xcp h ILE 197 Cb 1.23 0.97 -0.02 0.00 -0.74 0.00 0.00 36.82 38.26 1xcp h ILE 197 CO 0.12 0.42 0.19 0.00 0.00 0.00 0.00 178.15 178.88 1xcp h ALA 198 N 1.07 0.58 -0.08 1.87 0.00 -0.02 -1.09 119.26 121.59 1xcp h ALA 198 Ca 0.14 -0.14 -0.11 0.00 0.00 0.00 0.00 54.91 54.80 1xcp h ALA 198 Cb 0.61 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 1xcp h ALA 198 CO 0.04 0.17 -0.44 1.25 0.00 0.00 0.00 179.25 180.27 1xcp h LEU 199 N 0.58 0.19 0.87 0.00 5.85 -0.95 -1.87 115.31 119.98 1xcp h LEU 199 Ca 0.15 -0.08 -0.04 0.00 0.84 0.00 0.00 57.88 58.75 1xcp h LEU 199 Cb 0.17 -0.05 0.01 0.00 0.37 0.00 0.00 40.66 41.16 1xcp h LEU 199 CO -0.01 0.61 -0.42 0.00 -0.34 0.00 0.00 178.44 178.28 1xcp h ALA 200 N 1.40 -1.17 -0.00 1.25 0.00 0.13 -2.27 119.26 118.60 1xcp h ALA 200 Ca 0.01 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1xcp h ALA 200 Cb 0.85 0.45 0.00 0.00 0.00 0.00 0.00 17.79 19.09 1xcp h ALA 200 CO 0.07 -1.11 -0.01 0.27 0.00 0.00 0.00 179.25 178.47 1xcp n ASN 201 N -5.56 0.09 0.08 0.00 0.23 -0.83 -1.37 115.26 107.90 1xcp n ASN 201 Ca -0.15 -0.51 -0.03 0.00 -0.53 0.00 0.00 54.58 53.36 1xcp n ASN 201 Cb 0.47 -0.16 0.19 0.00 -2.08 0.00 0.00 39.78 38.19 1xcp n ASN 201 CO 0.00 0.00 0.00 0.11 -0.93 0.00 0.00 177.26 176.44 1xcp h LYS 202 N 0.12 0.27 0.00 -3.83 1.79 -0.90 -2.88 116.57 111.13 1xcp h LYS 202 Ca 0.00 -0.14 0.00 0.00 -2.18 0.00 0.00 60.65 58.33 1xcp h LYS 202 Cb 0.20 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.86 1xcp h LYS 202 CO 0.00 0.68 -0.24 1.28 -1.08 0.00 0.00 179.45 180.09 1xcp n LEU 203 N -3.99 0.31 -0.09 2.94 4.32 -0.78 -4.71 117.00 115.00 1xcp n LEU 203 Ca -0.02 0.30 0.00 0.00 -0.02 0.00 0.00 56.01 56.27 1xcp n LEU 203 Cb 0.52 -0.37 0.00 0.00 -1.62 0.00 0.00 43.42 41.95 1xcp n LEU 203 CO 0.43 0.03 0.00 0.61 -1.22 0.00 0.00 177.39 177.23 1xcp n GLY 204 N 1.47 0.57 0.00 -0.72 0.00 -0.97 -0.81 105.19 104.73 1xcp n GLY 204 Ca 0.06 -0.79 0.00 0.00 0.00 0.00 0.00 46.02 45.29 1xcp n GLY 204 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1xcp n THR 205 N -3.51 0.00 -3.94 2.61 5.66 -0.47 -4.88 114.28 109.75 1xcp n THR 205 Ca 0.00 0.00 -0.09 0.00 -3.05 0.00 0.00 64.05 60.91 1xcp n THR 205 Cb 0.46 0.00 -0.07 0.00 -1.55 0.00 0.00 70.33 69.17 1xcp n THR 205 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1xcp s GLN 206 N 2.93 1.01 -0.79 1.09 0.00 -1.26 -3.57 119.66 119.07 1xcp s GLN 206 Ca 0.00 -1.11 -0.19 0.00 -0.00 0.00 0.00 55.36 54.05 1xcp s GLN 206 Cb 0.00 0.35 0.12 0.00 0.00 0.00 0.00 33.01 33.48 1xcp s GLN 206 CO 0.00 -0.34 0.97 1.41 0.00 0.00 0.00 175.29 177.33 1xcp s MET 207 N -3.93 3.36 0.45 9.60 -2.45 -1.26 -0.90 119.30 124.18 1xcp s MET 207 Ca 0.13 -1.50 0.11 0.00 -1.25 0.00 0.00 55.69 53.17 1xcp s MET 207 Cb 0.04 -4.57 1.01 0.00 1.25 0.00 0.00 34.83 32.56 1xcp s MET 207 CO -0.04 -1.70 2.09 0.97 1.05 0.00 0.00 175.02 177.39 1xcp h ILE 208 N 5.80 1.06 -3.14 10.11 2.10 -1.47 -3.45 117.51 128.52 1xcp h ILE 208 Ca -0.05 -0.12 -0.00 0.00 1.08 0.00 0.00 64.86 65.76 1xcp h ILE 208 Cb 1.05 0.67 -0.10 0.00 -1.09 0.00 0.00 36.82 37.35 1xcp h ILE 208 CO 1.10 0.06 0.13 -2.28 -1.08 0.00 0.00 178.15 176.08 1xcp s HIS 209 N -5.34 -0.29 -0.26 2.19 2.46 -1.17 -5.01 115.29 107.86 1xcp s HIS 209 Ca -0.07 -0.02 0.01 0.00 0.47 0.00 0.00 55.06 55.45 1xcp s HIS 209 Cb 0.17 0.51 0.07 0.00 -0.13 0.00 0.00 32.58 33.21 1xcp s HIS 209 CO 0.71 -0.94 -0.01 0.12 -2.47 0.00 0.00 174.74 172.15 1xcp s PHE 210 N -3.83 2.42 -0.40 3.88 5.36 -1.26 -1.55 117.98 122.59 1xcp s PHE 210 Ca 0.06 -1.89 -0.17 0.00 -0.96 0.00 0.00 56.93 53.97 1xcp s PHE 210 Cb -0.02 -1.77 0.01 0.00 -0.34 0.00 0.00 43.02 40.90 1xcp s PHE 210 CO -0.05 -0.81 0.44 0.14 -1.46 0.00 0.00 175.22 173.48 1xcp s VAL 211 N 1.38 5.08 1.04 3.12 -7.23 -0.42 -4.97 120.40 118.40 1xcp s VAL 211 Ca -0.01 -0.19 -0.12 0.00 -1.81 0.00 0.00 61.98 59.85 1xcp s VAL 211 Cb -0.19 -4.00 0.21 0.00 0.56 0.00 0.00 36.38 32.96 1xcp s VAL 211 CO -0.10 -0.36 1.08 -2.16 -0.31 0.00 0.00 175.10 173.25 1xcp s PRO 212 N 2.18 0.11 -0.49 4.82 0.04 -1.26 -0.79 135.00 139.61 1xcp s PRO 212 Ca 0.13 0.58 -0.26 0.00 0.04 0.00 0.00 61.00 61.50 1xcp s PRO 212 Cb -0.17 -1.69 0.03 0.00 0.04 0.00 0.00 34.50 32.71 1xcp s PRO 212 CO 0.14 -2.96 0.97 1.03 0.04 0.00 0.00 177.00 176.22 1xcp s ARG 213 N -4.86 3.50 -0.02 4.56 0.52 -1.25 -4.67 118.95 116.72 1xcp s ARG 213 Ca 0.66 0.10 0.06 0.00 -0.52 0.00 0.00 55.73 56.03 1xcp s ARG 213 Cb -0.20 -3.96 -0.01 0.00 0.52 0.00 0.00 34.95 31.29 1xcp s ARG 213 CO 0.59 -1.34 -0.21 0.34 0.02 0.00 0.00 175.30 174.70 1xcp s ASP 214 N 2.48 2.47 0.00 0.23 -1.08 -1.26 -5.00 116.67 114.51 1xcp s ASP 214 Ca 0.37 -0.39 0.22 0.00 -0.52 0.00 0.00 52.55 52.23 1xcp s ASP 214 Cb -0.10 -0.37 1.25 0.00 -1.46 0.00 0.00 42.92 42.23 1xcp s ASP 214 CO 0.25 0.24 1.71 0.59 0.52 0.00 0.00 175.17 178.48 1xcp n ASN 215 N 2.68 0.00 0.23 -0.34 3.02 -1.26 -2.46 115.26 117.14 1xcp n ASN 215 Ca -0.16 -0.45 0.11 0.00 -0.03 0.00 0.00 54.58 54.05 1xcp n ASN 215 Cb 0.53 -0.11 0.54 0.00 -0.61 0.00 0.00 39.78 40.13 1xcp n ASN 215 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 1xcp h VAL 216 N 0.00 0.58 -0.12 2.41 2.07 -2.00 -2.65 116.25 116.54 1xcp h VAL 216 Ca 0.00 -0.96 -0.01 0.00 0.82 0.00 0.00 66.70 66.56 1xcp h VAL 216 Cb 0.08 1.64 -0.01 0.00 -1.52 0.00 0.00 31.29 31.48 1xcp h VAL 216 CO 0.00 0.20 0.05 0.58 0.02 0.00 0.00 177.57 178.42 1xcp h VAL 217 N 0.00 1.14 -0.63 2.57 2.07 -1.92 -2.08 116.25 117.40 1xcp h VAL 217 Ca -0.00 -0.42 0.02 0.00 0.82 0.00 0.00 66.70 67.12 1xcp h VAL 217 Cb 0.62 1.19 -0.04 0.00 -1.52 0.00 0.00 31.29 31.54 1xcp h VAL 217 CO 0.03 0.13 0.40 1.56 0.02 0.00 0.00 177.57 179.70 1xcp h GLN 218 N 0.05 0.77 -0.40 1.57 7.50 -1.68 -0.86 115.11 122.06 1xcp h GLN 218 Ca 0.04 -0.05 -0.07 0.00 0.50 0.00 0.00 58.65 59.07 1xcp h GLN 218 Cb 0.15 -0.17 -0.02 0.00 0.05 0.00 0.00 27.48 27.49 1xcp h GLN 218 CO -0.00 0.51 -0.06 0.00 -1.50 0.00 0.00 178.83 177.77 1xcp h ARG 219 N 0.79 0.67 0.11 1.46 -0.00 -1.51 -2.50 114.38 113.41 1xcp h ARG 219 Ca 0.25 -0.19 -0.01 0.00 -0.50 0.00 0.00 59.98 59.53 1xcp h ARG 219 Cb -0.02 -0.07 0.00 0.00 0.00 0.00 0.00 29.97 29.88 1xcp h ARG 219 CO -0.09 0.73 -0.05 0.00 0.00 0.00 0.00 179.97 180.56 1xcp h ALA 220 N 1.32 -0.15 0.00 0.04 0.00 -0.59 -2.64 119.26 117.23 1xcp h ALA 220 Ca 0.12 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 1xcp h ALA 220 Cb 0.48 0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 1xcp h ALA 220 CO 0.03 -0.45 -0.07 0.93 0.00 0.00 0.00 179.25 179.69 1xcp h GLU 221 N -0.43 0.00 0.28 0.00 4.39 -1.19 -0.48 114.58 117.15 1xcp h GLU 221 Ca -0.02 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.67 1xcp h GLU 221 Cb 0.35 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.01 1xcp h GLU 221 CO 0.03 0.07 -0.13 0.82 -1.16 0.00 0.00 179.01 178.64 1xcp h ILE 222 N 0.00 0.74 0.00 3.13 2.04 -1.25 -0.74 117.51 121.43 1xcp h ILE 222 Ca -0.00 -0.10 0.00 0.00 1.00 0.00 0.00 64.86 65.76 1xcp h ILE 222 Cb 0.14 0.80 0.00 0.00 -0.74 0.00 0.00 36.82 37.02 1xcp h ILE 222 CO 0.01 0.02 0.00 0.54 0.00 0.00 0.00 178.15 178.72 1xcp n ARG 223 N -5.23 0.75 -3.53 2.37 3.00 -0.72 -4.84 116.66 108.46 1xcp n ARG 223 Ca -0.10 0.00 -0.19 0.00 -0.01 0.00 0.00 57.85 57.55 1xcp n ARG 223 Cb 0.18 -1.14 0.07 0.00 0.00 0.00 0.00 32.46 31.58 1xcp n ARG 223 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.63 175.50 1xcp n ARG 224 N -0.64 -6.33 -4.26 5.56 0.63 -0.29 -4.99 116.66 106.35 1xcp n ARG 224 Ca 0.05 0.79 -0.14 0.00 -0.92 0.00 0.00 57.85 57.62 1xcp n ARG 224 Cb 0.02 -5.70 -0.10 0.00 0.45 0.00 0.00 32.46 27.14 1xcp n ARG 224 CO 0.00 0.00 0.00 -1.64 -2.51 0.00 0.00 177.63 173.48 1xcp s MET 225 N -5.64 1.32 0.32 -0.14 -1.94 -0.28 -3.75 119.30 109.19 1xcp s MET 225 Ca 0.08 -1.71 -0.11 0.00 -1.71 0.00 0.00 55.69 52.25 1xcp s MET 225 Cb -0.04 -0.00 -0.07 0.00 2.01 0.00 0.00 34.83 36.73 1xcp s MET 225 CO 0.75 -0.35 0.67 0.99 -0.01 0.00 0.00 175.02 177.08 1xcp s THR 226 N -3.94 4.83 0.32 2.05 2.01 -1.13 -3.58 115.64 116.21 1xcp s THR 226 Ca 0.38 0.58 0.04 0.00 0.31 0.00 0.00 61.69 63.01 1xcp s THR 226 Cb 0.07 -3.67 0.12 0.00 0.01 0.00 0.00 72.50 69.04 1xcp s THR 226 CO 0.13 -0.29 1.82 0.58 -0.69 0.00 0.00 174.62 176.17 1xcp h VAL 227 N 1.58 1.22 -0.77 3.82 2.07 -1.93 0.15 116.25 122.39 1xcp h VAL 227 Ca -0.47 -0.97 0.07 0.00 0.82 0.00 0.00 66.70 66.15 1xcp h VAL 227 Cb 1.18 1.13 -0.06 0.00 -1.52 0.00 0.00 31.29 32.02 1xcp h VAL 227 CO 0.66 0.32 0.45 0.40 0.02 0.00 0.00 177.57 179.42 1xcp h ILE 228 N 0.43 0.98 0.19 4.57 1.08 -1.88 -1.66 117.51 121.21 1xcp h ILE 228 Ca 0.08 -0.28 -0.33 0.00 -0.39 0.00 0.00 64.86 63.95 1xcp h ILE 228 Cb 0.46 0.10 0.01 0.00 -3.07 0.00 0.00 36.82 34.32 1xcp h ILE 228 CO 0.03 0.15 -1.57 -0.08 -0.69 0.00 0.00 178.15 175.99 1xcp h GLU 229 N 0.81 0.39 0.29 2.37 4.81 -1.86 -3.17 114.58 118.23 1xcp h GLU 229 Ca 0.35 -0.67 -0.01 0.00 -0.13 0.00 0.00 59.36 58.89 1xcp h GLU 229 Cb 0.23 0.25 0.00 0.00 0.63 0.00 0.00 28.75 29.86 1xcp h GLU 229 CO -0.20 1.30 -0.14 -0.92 -0.73 0.00 0.00 179.01 178.32 1xcp h TYR 230 N 0.11 -0.37 -2.98 0.92 3.20 -0.83 -3.41 116.97 113.61 1xcp h TYR 230 Ca -0.27 -0.01 -0.61 0.00 3.14 0.00 0.00 58.73 60.98 1xcp h TYR 230 Cb 2.09 0.12 -0.40 0.00 1.54 0.00 0.00 36.73 40.08 1xcp h TYR 230 CO 0.10 -0.23 -0.74 0.34 -1.64 0.00 0.00 178.16 175.99 1xcp s ASP 231 N -3.42 3.64 0.61 -2.11 3.68 -0.64 -4.95 116.67 113.49 1xcp s ASP 231 Ca -0.06 -2.65 0.33 0.00 2.13 0.00 0.00 52.55 52.30 1xcp s ASP 231 Cb 0.01 -1.04 1.80 0.00 -1.45 0.00 0.00 42.92 42.23 1xcp s ASP 231 CO 0.17 -0.26 2.00 1.55 0.13 0.00 0.00 175.17 178.76 1xcp h PRO 232 N 6.70 0.00 -0.05 4.34 0.13 -1.63 -1.53 132.00 139.96 1xcp h PRO 232 Ca -0.00 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 65.02 1xcp h PRO 232 Cb 0.92 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.06 1xcp h PRO 232 CO 0.49 0.00 -0.39 0.87 -0.23 0.00 0.00 178.00 178.73 1xcp h LYS 233 N 0.00 0.35 -4.87 0.86 1.79 -1.90 -3.44 116.57 109.36 1xcp h LYS 233 Ca 0.00 -0.31 -0.51 0.00 -2.18 0.00 0.00 60.65 57.65 1xcp h LYS 233 Cb 0.38 0.07 0.13 0.00 -1.58 0.00 0.00 32.23 31.23 1xcp h LYS 233 CO 0.00 0.97 -0.76 0.00 -1.08 0.00 0.00 179.45 178.58 1xcp n ALA 234 N -2.53 -2.69 -0.14 3.86 0.00 -0.58 -4.73 120.51 113.70 1xcp n ALA 234 Ca -0.09 0.10 -0.04 0.00 0.00 0.00 0.00 53.44 53.41 1xcp n ALA 234 Cb 0.55 -1.20 0.05 0.00 0.00 0.00 0.00 19.45 18.85 1xcp n ALA 234 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1xcp h LYS 235 N 0.27 0.25 -0.18 0.00 1.79 -1.92 -1.31 116.57 115.47 1xcp h LYS 235 Ca -0.30 -0.02 -0.10 0.00 -2.18 0.00 0.00 60.65 58.06 1xcp h LYS 235 Cb 1.17 -0.06 -0.01 0.00 -1.58 0.00 0.00 32.23 31.76 1xcp h LYS 235 CO 0.38 0.17 -0.33 0.37 -1.08 0.00 0.00 179.45 178.96 1xcp h GLN 236 N 0.26 0.38 -0.61 3.15 5.75 -1.94 -2.89 115.11 119.21 1xcp h GLN 236 Ca 0.22 -0.16 -0.00 0.00 -0.15 0.00 0.00 58.65 58.56 1xcp h GLN 236 Cb 0.26 -0.01 -0.03 0.00 1.07 0.00 0.00 27.48 28.77 1xcp h GLN 236 CO -0.27 0.67 0.37 0.00 -2.65 0.00 0.00 178.83 176.95 1xcp h ALA 237 N 1.33 1.50 0.00 3.38 0.00 -1.50 -1.18 119.26 122.79 1xcp h ALA 237 Ca 0.04 -0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 1xcp h ALA 237 Cb 0.74 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 1xcp h ALA 237 CO 0.06 0.44 -0.26 -0.44 0.00 0.00 0.00 179.25 179.05 1xcp h ASP 238 N 0.84 0.00 -0.42 0.00 3.32 -1.28 -2.74 116.42 116.13 1xcp h ASP 238 Ca 0.22 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.24 1xcp h ASP 238 Cb -0.04 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.50 1xcp h ASP 238 CO -0.04 0.26 0.16 -0.33 -1.72 0.00 0.00 179.24 177.56 1xcp h GLU 239 N 0.00 0.64 -0.20 3.56 4.39 -1.07 -1.42 114.58 120.49 1xcp h GLU 239 Ca -0.00 -0.12 -0.18 0.00 0.34 0.00 0.00 59.36 59.39 1xcp h GLU 239 Cb 0.99 -0.10 -0.00 0.00 -0.10 0.00 0.00 28.75 29.54 1xcp h GLU 239 CO 0.03 0.61 -0.61 1.88 -1.16 0.00 0.00 179.01 179.76 1xcp h TYR 240 N 0.54 0.86 0.00 4.33 0.05 -1.39 -2.42 116.97 118.94 1xcp h TYR 240 Ca 0.14 -0.33 -0.06 0.00 0.05 0.00 0.00 58.73 58.53 1xcp h TYR 240 Cb 0.22 -0.15 -0.01 0.00 1.01 0.00 0.00 36.73 37.79 1xcp h TYR 240 CO 0.00 1.11 -0.30 0.07 -1.05 0.00 0.00 178.16 178.00 1xcp h ARG 241 N 0.50 0.00 -0.28 4.88 0.11 -1.47 -2.27 114.38 115.85 1xcp h ARG 241 Ca -0.00 0.00 -0.09 0.00 0.10 0.00 0.00 59.98 59.99 1xcp h ARG 241 Cb 1.19 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.26 1xcp h ARG 241 CO 0.12 0.30 -0.20 0.00 0.10 0.00 0.00 179.97 180.29 1xcp h ALA 242 N 1.70 1.13 -0.22 0.08 0.00 -1.16 -2.09 119.26 118.70 1xcp h ALA 242 Ca -0.00 -0.32 -0.03 0.00 0.00 0.00 0.00 54.91 54.55 1xcp h ALA 242 Cb 1.14 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 1xcp h ALA 242 CO 0.04 0.54 0.00 1.25 0.00 0.00 0.00 179.25 181.08 1xcp h LEU 243 N 0.46 0.37 -0.86 0.00 5.85 -1.21 -2.67 115.31 117.26 1xcp h LEU 243 Ca 0.07 -0.31 0.11 0.00 0.84 0.00 0.00 57.88 58.59 1xcp h LEU 243 Cb 0.61 -0.10 -0.08 0.00 0.37 0.00 0.00 40.66 41.46 1xcp h LEU 243 CO 0.04 0.59 0.50 0.00 -0.34 0.00 0.00 178.44 179.23 1xcp h ALA 244 N 0.80 1.25 -0.44 1.25 0.00 -1.10 -1.26 119.26 119.77 1xcp h ALA 244 Ca 0.06 0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.91 1xcp h ALA 244 Cb 0.40 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1xcp h ALA 244 CO 0.01 0.10 -0.12 -0.09 0.00 0.00 0.00 179.25 179.15 1xcp h ARG 245 N 0.81 0.86 -0.13 0.00 9.65 -1.36 -1.92 114.38 122.29 1xcp h ARG 245 Ca 0.43 -0.33 -0.04 0.00 -1.10 0.00 0.00 59.98 58.93 1xcp h ARG 245 Cb 0.42 -0.05 -0.01 0.00 -1.39 0.00 0.00 29.97 28.95 1xcp h ARG 245 CO -0.27 0.97 -0.10 0.87 2.80 0.00 0.00 179.97 184.25 1xcp h LYS 246 N 0.69 0.20 -0.17 0.20 1.57 -0.93 -1.64 116.57 116.49 1xcp h LYS 246 Ca 0.11 -0.04 -0.21 0.00 -1.87 0.00 0.00 60.65 58.64 1xcp h LYS 246 Cb 0.66 -0.03 0.01 0.00 0.08 0.00 0.00 32.23 32.95 1xcp h LYS 246 CO 0.05 0.31 -0.73 0.28 -0.57 0.00 0.00 179.45 178.79 1xcp h VAL 247 N 0.19 1.29 0.08 0.50 2.07 -1.05 -0.09 116.25 119.24 1xcp h VAL 247 Ca 0.04 -1.94 -0.00 0.00 0.82 0.00 0.00 66.70 65.61 1xcp h VAL 247 Cb 0.30 1.93 0.00 0.00 -1.52 0.00 0.00 31.29 32.00 1xcp h VAL 247 CO 0.02 0.62 -0.04 0.58 0.02 0.00 0.00 177.57 178.76 1xcp h VAL 248 N 0.53 1.14 0.00 2.57 2.07 -1.02 -3.02 116.25 118.52 1xcp h VAL 248 Ca -0.04 -0.85 0.00 0.00 0.82 0.00 0.00 66.70 66.63 1xcp h VAL 248 Cb 1.34 1.69 0.00 0.00 -1.52 0.00 0.00 31.29 32.80 1xcp h VAL 248 CO 0.15 0.21 0.00 0.47 0.02 0.00 0.00 177.57 178.42 1xcp n ASP 249 N -4.96 0.00 -4.67 0.57 10.43 -0.65 -4.79 116.55 112.48 1xcp n ASP 249 Ca -0.08 0.08 -0.42 0.00 2.57 0.00 0.00 54.79 56.93 1xcp n ASP 249 Cb 0.22 -0.32 -0.03 0.00 1.84 0.00 0.00 41.12 42.83 1xcp n ASP 249 CO 0.00 0.00 0.00 0.21 -1.07 0.00 0.00 177.20 176.34 1xcp s ASN 250 N -2.65 6.55 0.00 -2.24 2.47 -0.05 -4.87 114.94 114.16 1xcp s ASN 250 Ca 0.18 2.49 0.03 0.00 0.42 0.00 0.00 52.86 55.98 1xcp s ASN 250 Cb 0.14 -2.54 -0.01 0.00 -1.45 0.00 0.00 41.25 37.38 1xcp s ASN 250 CO 0.33 -0.97 0.27 0.29 -3.72 0.00 0.00 177.10 173.30 1xcp n LYS 251 N 6.85 4.01 -2.95 0.43 4.01 -1.26 -4.95 118.16 124.30 1xcp n LYS 251 Ca 0.18 -0.21 -0.44 0.00 -0.51 0.00 0.00 58.31 57.33 1xcp n LYS 251 Cb 0.41 -0.77 -0.04 0.00 -0.51 0.00 0.00 35.03 34.13 1xcp n LYS 251 CO 0.00 0.00 0.00 -1.17 -1.11 0.00 0.00 177.40 175.12 1xcp s LEU 252 N -1.57 4.85 -0.28 -0.35 0.20 -1.26 -4.98 118.68 115.29 1xcp s LEU 252 Ca 0.02 -1.37 -0.01 0.00 0.69 0.00 0.00 54.13 53.46 1xcp s LEU 252 Cb 0.02 -2.38 0.09 0.00 -0.43 0.00 0.00 46.19 43.49 1xcp s LEU 252 CO 0.10 -1.26 0.07 -0.76 -0.29 0.00 0.00 176.35 174.21 1xcp s LEU 253 N 3.32 2.14 0.48 -0.68 1.02 -1.26 -4.27 118.68 119.43 1xcp s LEU 253 Ca 0.21 -1.44 0.06 0.00 0.02 0.00 0.00 54.13 52.99 1xcp s LEU 253 Cb -0.16 -0.87 0.00 0.00 0.02 0.00 0.00 46.19 45.18 1xcp s LEU 253 CO 0.04 -0.37 0.35 0.68 0.02 0.00 0.00 176.35 177.08 1xcp s VAL 254 N 1.62 2.06 -0.46 -1.59 -7.23 -0.84 -4.77 120.40 109.19 1xcp s VAL 254 Ca 0.06 -1.49 -0.16 0.00 -1.81 0.00 0.00 61.98 58.58 1xcp s VAL 254 Cb -0.17 -2.55 0.06 0.00 0.56 0.00 0.00 36.38 34.28 1xcp s VAL 254 CO -0.19 0.00 0.39 -0.63 -0.31 0.00 0.00 175.10 174.36 1xcp s ILE 255 N -2.66 5.22 0.85 -0.62 1.01 -1.26 -1.09 121.20 122.66 1xcp s ILE 255 Ca 0.39 -0.94 -0.12 0.00 0.00 0.00 0.00 60.65 59.99 1xcp s ILE 255 Cb -0.01 -4.09 0.11 0.00 0.01 0.00 0.00 42.46 38.47 1xcp s ILE 255 CO 0.23 -0.53 1.18 -2.16 0.00 0.00 0.00 174.94 173.67 1xcp s PRO 256 N 1.71 1.36 -0.45 2.79 0.04 -1.26 -4.98 135.00 134.21 1xcp s PRO 256 Ca 0.05 1.68 0.02 0.00 0.04 0.00 0.00 61.00 62.79 1xcp s PRO 256 Cb -0.23 -1.75 0.12 0.00 0.04 0.00 0.00 34.50 32.68 1xcp s PRO 256 CO 0.08 -2.40 0.20 -0.80 0.04 0.00 0.00 177.00 174.11 1xcp s ASN 257 N -2.36 4.73 0.54 6.66 0.01 0.01 -4.86 114.94 119.66 1xcp s ASN 257 Ca 0.71 -2.54 -0.21 0.00 -0.71 0.00 0.00 52.86 50.10 1xcp s ASN 257 Cb -0.26 -1.69 -0.06 0.00 0.41 0.00 0.00 41.25 39.65 1xcp s ASN 257 CO 0.54 -0.35 1.20 -2.65 -1.51 0.00 0.00 177.10 174.33 1xcp n PRO 258 N 3.79 1.45 -4.15 -0.60 -0.02 -1.26 -4.27 135.00 129.94 1xcp n PRO 258 Ca 0.04 0.54 -0.22 0.00 -2.02 0.00 0.00 63.50 61.83 1xcp n PRO 258 Cb 0.38 -2.38 -0.05 0.00 -0.02 0.00 0.00 33.50 31.42 1xcp n PRO 258 CO 0.00 0.00 0.00 0.96 1.98 0.00 0.00 175.50 178.44 1xcp s ILE 259 N -1.34 3.89 0.84 4.25 -4.36 -1.26 -5.07 121.20 118.15 1xcp s ILE 259 Ca 0.71 -1.61 -0.11 0.00 -0.26 0.00 0.00 60.65 59.38 1xcp s ILE 259 Cb -0.44 -3.15 0.09 0.00 1.25 0.00 0.00 42.46 40.21 1xcp s ILE 259 CO 0.50 -0.33 1.09 0.42 0.24 0.00 0.00 174.94 176.87 1xcp s THR 260 N -2.24 2.92 0.29 8.37 -4.23 -1.26 -4.87 115.64 114.62 1xcp s THR 260 Ca 0.33 0.30 0.01 0.00 -1.18 0.00 0.00 61.69 61.16 1xcp s THR 260 Cb -0.07 -2.92 0.13 0.00 1.34 0.00 0.00 72.50 70.98 1xcp s THR 260 CO 0.23 -0.39 1.80 -0.03 -0.54 0.00 0.00 174.62 175.69 1xcp h MET 261 N -1.28 0.65 -0.61 3.99 4.05 -2.00 -1.44 114.93 118.29 1xcp h MET 261 Ca -0.48 -0.17 0.07 0.00 -0.28 0.00 0.00 59.70 58.84 1xcp h MET 261 Cb 1.27 -0.08 -0.04 0.00 -0.80 0.00 0.00 31.60 31.95 1xcp h MET 261 CO 0.57 0.69 0.41 -0.44 0.23 0.00 0.00 176.91 178.36 1xcp h ASP 262 N 0.61 0.50 -0.16 1.39 5.19 -1.99 0.19 116.42 122.17 1xcp h ASP 262 Ca 0.12 0.00 -0.16 0.00 -0.62 0.00 0.00 57.03 56.38 1xcp h ASP 262 Cb 0.42 -0.11 0.01 0.00 0.18 0.00 0.00 39.33 39.83 1xcp h ASP 262 CO 0.02 0.33 -0.52 -0.33 -3.12 0.00 0.00 179.24 175.62 1xcp h GLU 263 N 0.57 0.62 -0.49 3.56 5.08 -1.72 -1.40 114.58 120.80 1xcp h GLU 263 Ca 0.27 -0.46 -0.10 0.00 -1.00 0.00 0.00 59.36 58.06 1xcp h GLU 263 Cb 0.31 0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.63 1xcp h GLU 263 CO -0.08 1.08 -0.09 1.25 -1.00 0.00 0.00 179.01 180.17 1xcp h LEU 264 N 0.28 0.93 -0.50 1.33 6.46 -0.41 -0.18 115.31 123.23 1xcp h LEU 264 Ca -0.02 -0.35 -0.01 0.00 -0.12 0.00 0.00 57.88 57.38 1xcp h LEU 264 Cb 1.14 -0.25 -0.02 0.00 -0.73 0.00 0.00 40.66 40.79 1xcp h LEU 264 CO 0.11 1.07 0.26 -0.33 -0.62 0.00 0.00 178.44 178.93 1xcp h GLU 265 N 0.79 0.70 0.00 1.25 5.08 -0.68 -1.70 114.58 120.01 1xcp h GLU 265 Ca 0.13 -0.09 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 1xcp h GLU 265 Cb 0.64 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.76 1xcp h GLU 265 CO 0.04 0.56 0.00 1.05 -1.00 0.00 0.00 179.01 179.66 1xcp h GLU 266 N 0.66 0.00 -0.23 2.33 -0.00 -1.18 -1.41 114.58 114.75 1xcp h GLU 266 Ca 0.17 0.00 -0.14 0.00 -0.00 0.00 0.00 59.36 59.39 1xcp h GLU 266 Cb 0.07 0.00 -0.00 0.00 -0.00 0.00 0.00 28.75 28.82 1xcp h GLU 266 CO -0.03 0.00 -0.40 1.25 -0.00 0.00 0.00 179.01 179.84 1xcp h LEU 267 N 0.00 0.75 -0.95 3.06 5.85 -0.42 -1.41 115.31 122.20 1xcp h LEU 267 Ca 0.00 -0.53 -0.10 0.00 0.84 0.00 0.00 57.88 58.09 1xcp h LEU 267 Cb 0.97 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.78 1xcp h LEU 267 CO 0.00 1.14 -0.29 -0.07 -0.34 0.00 0.00 178.44 178.88 1xcp h LEU 268 N 0.39 0.42 -1.21 2.25 3.38 -1.28 -2.51 115.31 116.75 1xcp h LEU 268 Ca 0.02 -0.15 -0.07 0.00 0.09 0.00 0.00 57.88 57.76 1xcp h LEU 268 Cb 0.99 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.62 1xcp h LEU 268 CO 0.09 0.70 -0.35 0.24 0.09 0.00 0.00 178.44 179.21 1xcp h MET 269 N 0.36 0.00 -0.57 1.13 2.86 -1.08 -0.49 114.93 117.14 1xcp h MET 269 Ca 0.05 0.00 -0.08 0.00 -2.06 0.00 0.00 59.70 57.61 1xcp h MET 269 Cb 0.70 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.34 1xcp h MET 269 CO 0.05 0.35 0.03 1.49 1.06 0.00 0.00 176.91 179.89 1xcp h GLU 270 N 0.00 0.98 -0.08 1.72 4.81 -0.83 -2.67 114.58 118.51 1xcp h GLU 270 Ca -0.00 -0.30 0.00 0.00 -0.13 0.00 0.00 59.36 58.93 1xcp h GLU 270 Cb 0.73 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 30.01 1xcp h GLU 270 CO 0.05 0.97 0.00 1.19 -0.73 0.00 0.00 179.01 180.49 1xcp n PHE 271 N -4.26 0.10 -1.05 0.92 3.01 -1.06 -4.95 117.46 110.17 1xcp n PHE 271 Ca 0.02 -0.05 -0.02 0.00 1.01 0.00 0.00 57.45 58.42 1xcp n PHE 271 Cb 0.32 0.00 -0.01 0.00 -0.01 0.00 0.00 39.48 39.78 1xcp n PHE 271 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1xcp n GLY 272 N 1.08 0.46 0.14 1.37 0.00 -0.69 -4.93 105.19 102.62 1xcp n GLY 272 Ca 0.17 -0.15 -0.09 0.00 0.00 0.00 0.00 46.02 45.95 1xcp n GLY 272 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1xcp h ILE 273 N 0.00 0.58 -3.67 -0.61 5.03 -1.40 -3.44 117.51 114.01 1xcp h ILE 273 Ca -0.03 -1.06 -0.50 0.00 -0.12 0.00 0.00 64.86 63.14 1xcp h ILE 273 Cb 0.38 1.01 -0.03 0.00 -3.03 0.00 0.00 36.82 35.15 1xcp h ILE 273 CO 0.05 0.16 0.20 -0.32 -0.68 0.00 0.00 178.15 177.56 1xcp s MET 274 N -3.05 4.42 0.15 2.37 1.75 -1.16 -4.97 119.30 118.82 1xcp s MET 274 Ca -0.10 1.07 -0.30 0.00 -1.25 0.00 0.00 55.69 55.11 1xcp s MET 274 Cb 0.00 -2.91 -0.07 0.00 2.84 0.00 0.00 34.83 34.69 1xcp s MET 274 CO 0.36 0.38 1.13 -2.00 -0.65 0.00 0.00 175.02 174.25 1xcp s GLU 275 N -1.87 4.54 -0.10 4.11 2.56 -1.26 -4.17 118.70 122.51 1xcp s GLU 275 Ca 0.44 1.75 -0.29 0.00 0.00 0.00 0.00 54.97 56.87 1xcp s GLU 275 Cb -0.18 -3.29 -0.06 0.00 2.00 0.00 0.00 34.13 32.60 1xcp s GLU 275 CO 0.23 -0.02 1.96 0.08 -0.56 0.00 0.00 175.26 176.95 1xcp s VAL 276 N 0.05 3.18 0.18 3.70 1.01 -1.26 -4.98 120.40 122.28 1xcp s VAL 276 Ca 0.52 0.20 0.05 0.00 0.00 0.00 0.00 61.98 62.75 1xcp s VAL 276 Cb -0.30 -3.17 -0.04 0.00 0.00 0.00 0.00 36.38 32.88 1xcp s VAL 276 CO 0.34 -0.06 0.16 -1.61 0.00 0.00 0.00 175.10 173.93 1xcp s GLU 277 N 5.06 2.95 -0.15 2.72 0.41 -1.26 -5.10 118.70 123.33 1xcp s GLU 277 Ca 0.88 -0.88 0.01 0.00 -0.41 0.00 0.00 54.97 54.57 1xcp s GLU 277 Cb -0.36 -2.66 0.02 0.00 -1.78 0.00 0.00 34.13 29.35 1xcp s GLU 277 CO 0.37 0.47 -0.18 0.34 -0.49 0.00 0.00 175.26 175.77 1xcp s ASP 278 N -3.27 2.91 0.00 -0.19 3.68 -1.26 -5.02 116.67 113.52 1xcp s ASP 278 Ca 0.32 -0.56 0.28 0.00 2.13 0.00 0.00 52.55 54.72 1xcp s ASP 278 Cb -0.10 -1.33 1.16 0.00 -1.45 0.00 0.00 42.92 41.20 1xcp s ASP 278 CO 0.24 0.00 1.84 -1.84 0.13 0.00 0.00 175.17 175.54 1xcp n GLU 279 N 4.51 0.30 0.11 4.34 -0.00 -1.26 -4.04 120.64 124.60 1xcp n GLU 279 Ca -0.19 -0.08 -0.02 0.00 -0.00 0.00 0.00 57.16 56.87 1xcp n GLU 279 Cb 0.50 -1.50 -0.03 0.00 -0.00 0.00 0.00 31.44 30.42 1xcp n GLU 279 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 1xcp h SER 280 N 0.19 0.00 1.01 -1.84 4.64 -2.02 -3.28 113.55 112.24 1xcp h SER 280 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1xcp h SER 280 Cb 0.42 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.51 1xcp h SER 280 CO 0.00 0.73 -0.30 2.30 -0.87 0.00 0.00 176.83 178.69 1xcp n ILE 281 N -3.30 0.29 -1.80 0.95 -5.35 -1.26 -4.86 119.36 104.03 1xcp n ILE 281 Ca 0.01 -0.18 -0.39 0.00 -0.27 0.00 0.00 62.75 61.92 1xcp n ILE 281 Cb 0.82 -0.27 -0.03 0.00 -1.74 0.00 0.00 39.64 38.42 1xcp n ILE 281 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 1xcp s VAL 282 N -3.09 3.20 0.00 7.28 1.01 -1.24 -1.35 120.40 126.22 1xcp s VAL 282 Ca 0.10 0.16 0.00 0.00 0.00 0.00 0.00 61.98 62.24 1xcp s VAL 282 Cb 0.15 -3.42 0.00 0.00 0.00 0.00 0.00 36.38 33.11 1xcp s VAL 282 CO 0.64 -0.37 0.00 0.61 0.00 0.00 0.00 175.10 175.99 1xcp n GLY 283 N 5.76 1.00 3.24 4.51 0.00 -1.26 -5.11 105.19 113.34 1xcp n GLY 283 Ca 0.28 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.98 1xcp n GLY 283 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1xcp s LYS 284 N -0.63 3.10 1.28 1.61 2.47 -0.46 -5.12 119.74 122.00 1xcp s LYS 284 Ca 0.00 -0.84 -0.19 0.00 -1.56 0.00 0.00 55.97 53.37 1xcp s LYS 284 Cb 0.00 -2.38 0.30 0.00 -1.46 0.00 0.00 37.83 34.29 1xcp s LYS 284 CO 0.00 0.15 0.68 2.41 0.16 0.00 0.00 175.35 178.75 1xcp n THR 285 N 3.63 0.00 -0.36 3.43 -1.04 -1.26 -4.69 114.28 113.99 1xcp n THR 285 Ca -0.19 -0.03 0.09 0.00 -2.04 0.00 0.00 64.05 61.88 1xcp n THR 285 Cb 0.53 -0.79 0.26 0.00 -1.82 0.00 0.00 70.33 68.51 1xcp n THR 285 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1xcp h ALA 286 N -3.27 1.57 0.00 2.41 0.00 -2.00 -2.89 119.26 115.08 1xcp h ALA 286 Ca -0.33 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1xcp h ALA 286 Cb 1.08 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.69 1xcp h ALA 286 CO 0.21 0.16 0.00 0.39 0.00 0.00 0.00 179.25 180.01 1xcp n GLU 287 N -4.64 0.01 -0.09 0.00 4.71 -1.26 -2.09 120.64 117.27 1xcp n GLU 287 Ca 0.20 0.05 0.04 0.00 -0.01 0.00 0.00 57.16 57.44 1xcp n GLU 287 Cb 0.40 -1.50 0.06 0.00 -1.01 0.00 0.00 31.44 29.39 1xcp n GLU 287 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 1xcp n GLU 288 N -1.49 1.57 0.00 3.49 4.71 -1.24 -5.30 120.64 122.38 1xcp n GLU 288 Ca 0.06 -1.80 0.00 0.00 -0.01 0.00 0.00 57.16 55.42 1xcp n GLU 288 Cb 0.30 -1.10 0.00 0.00 -1.01 0.00 0.00 31.44 29.63 1xcp n GLU 288 CO 0.00 0.00 0.00 1.33 0.09 0.00 0.00 177.13 178.55