#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sqc h TYR 11 N 0.00 0.00 -0.61 0.00 -0.00 -2.00 -3.30 116.97 111.05 1sqc h TYR 11 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 58.73 58.82 1sqc h TYR 11 Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 36.73 36.62 1sqc h TYR 11 CO 0.00 0.00 -0.44 0.00 -0.00 0.00 0.00 178.16 177.72 1sqc h ALA 12 N 2.01 -0.31 -0.37 0.10 0.00 -2.00 0.19 119.26 118.88 1sqc h ALA 12 Ca 0.00 0.12 -0.06 0.00 0.00 0.00 0.00 54.91 54.97 1sqc h ALA 12 Cb 0.05 0.98 -0.02 0.00 0.00 0.00 0.00 17.79 18.80 1sqc h ALA 12 CO 0.00 -0.82 -0.02 -0.09 0.00 0.00 0.00 179.25 178.32 1sqc h ARG 13 N -0.21 0.59 -0.63 0.00 2.43 -2.00 -1.63 114.38 112.93 1sqc h ARG 13 Ca 0.19 -0.14 0.01 0.00 -0.81 0.00 0.00 59.98 59.23 1sqc h ARG 13 Cb 0.56 -0.08 -0.03 0.00 -0.42 0.00 0.00 29.97 30.00 1sqc h ARG 13 CO -0.71 0.63 0.41 1.15 -1.51 0.00 0.00 179.97 179.94 1sqc h THR 14 N 0.56 1.13 0.56 0.20 2.02 -1.25 -1.48 112.91 114.66 1sqc h THR 14 Ca 0.12 -0.28 -0.03 0.00 0.77 0.00 0.00 66.41 66.98 1sqc h THR 14 Cb 0.39 0.23 0.01 0.00 -1.74 0.00 0.00 68.15 67.04 1sqc h THR 14 CO 0.02 0.15 -0.27 -0.07 0.37 0.00 0.00 175.52 175.72 1sqc h LEU 15 N 0.82 -0.64 -0.55 2.58 3.38 -0.13 -0.96 115.31 119.81 1sqc h LEU 15 Ca 0.24 -0.04 0.11 0.00 0.09 0.00 0.00 57.88 58.28 1sqc h LEU 15 Cb -0.05 0.17 -0.11 0.00 0.09 0.00 0.00 40.66 40.76 1sqc h LEU 15 CO -0.07 -0.33 -0.17 0.44 0.09 0.00 0.00 178.44 178.40 1sqc h ASP 16 N -0.96 -0.61 -0.63 -0.43 3.32 -1.18 0.38 116.42 116.32 1sqc h ASP 16 Ca -0.08 0.18 -0.03 0.00 0.02 0.00 0.00 57.03 57.12 1sqc h ASP 16 Cb 0.64 0.38 -0.03 0.00 0.22 0.00 0.00 39.33 40.54 1sqc h ASP 16 CO 0.13 -0.21 0.27 0.03 -1.72 0.00 0.00 179.24 177.74 1sqc h ARG 17 N -0.04 0.92 -0.28 3.56 3.08 -1.29 -0.16 114.38 120.17 1sqc h ARG 17 Ca 0.26 -0.16 0.02 0.00 0.07 0.00 0.00 59.98 60.18 1sqc h ARG 17 Cb 0.44 -0.16 -0.03 0.00 0.08 0.00 0.00 29.97 30.30 1sqc h ARG 17 CO -0.58 0.76 0.12 0.00 -1.07 0.00 0.00 179.97 179.20 1sqc h ALA 18 N 1.11 0.33 0.09 0.04 0.00 0.36 -0.93 119.26 120.26 1sqc h ALA 18 Ca 0.21 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.14 1sqc h ALA 18 Cb 0.17 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1sqc h ALA 18 CO -0.02 -0.28 -0.04 0.28 0.00 0.00 0.00 179.25 179.19 1sqc h VAL 19 N 0.26 0.99 0.00 0.00 2.07 0.02 -1.60 116.25 117.98 1sqc h VAL 19 Ca 0.12 -0.28 -0.00 0.00 0.82 0.00 0.00 66.70 67.36 1sqc h VAL 19 Cb 0.07 1.17 -0.00 0.00 -1.52 0.00 0.00 31.29 31.01 1sqc h VAL 19 CO -0.11 0.07 -0.01 1.05 0.02 0.00 0.00 177.57 178.60 1sqc h GLU 20 N -0.24 0.00 0.12 1.57 4.11 -0.88 -1.81 114.58 117.44 1sqc h GLU 20 Ca -0.01 0.00 -0.25 0.00 0.07 0.00 0.00 59.36 59.16 1sqc h GLU 20 Cb 0.20 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.48 1sqc h GLU 20 CO 0.02 0.01 -1.06 -0.92 0.07 0.00 0.00 179.01 177.12 1sqc h TYR 21 N 0.00 0.84 -0.73 2.06 3.20 -0.59 -2.87 116.97 118.88 1sqc h TYR 21 Ca -0.00 -0.54 -0.06 0.00 3.14 0.00 0.00 58.73 61.27 1sqc h TYR 21 Cb 0.20 -0.06 -0.03 0.00 1.54 0.00 0.00 36.73 38.37 1sqc h TYR 21 CO 0.00 1.39 0.24 -0.07 -1.64 0.00 0.00 178.16 178.08 1sqc h LEU 22 N 0.05 1.05 -1.63 2.82 3.38 -0.62 -2.56 115.31 117.81 1sqc h LEU 22 Ca -0.17 -0.20 -0.03 0.00 0.09 0.00 0.00 57.88 57.57 1sqc h LEU 22 Cb 1.78 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 42.25 1sqc h LEU 22 CO 0.20 0.97 -0.09 -0.07 0.09 0.00 0.00 178.44 179.55 1sqc h LEU 23 N 1.07 0.12 -0.42 1.67 3.38 -1.41 -1.92 115.31 117.81 1sqc h LEU 23 Ca 0.24 -0.02 -0.07 0.00 0.09 0.00 0.00 57.88 58.12 1sqc h LEU 23 Cb 0.29 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 1sqc h LEU 23 CO -0.01 0.23 -0.35 0.77 0.09 0.00 0.00 178.44 179.16 1sqc h SER 24 N 0.13 0.00 1.82 -0.43 4.64 -1.23 -3.15 113.55 115.32 1sqc h SER 24 Ca 0.03 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.34 1sqc h SER 24 Cb 0.24 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.33 1sqc h SER 24 CO 0.01 0.35 -0.18 0.00 -0.87 0.00 0.00 176.83 176.14 1sqc s GLN 26 N -3.22 3.28 0.76 0.00 0.74 -1.03 -4.74 119.66 115.45 1sqc s GLN 26 Ca 0.06 1.93 -0.08 0.00 0.05 0.00 0.00 55.36 57.32 1sqc s GLN 26 Cb 0.06 -2.18 0.10 0.00 1.10 0.00 0.00 33.01 32.09 1sqc s GLN 26 CO 0.69 -0.99 1.07 0.15 -0.55 0.00 0.00 175.29 175.67 1sqc s LYS 27 N -3.01 1.83 0.18 1.67 3.01 -0.45 -4.95 119.74 118.01 1sqc s LYS 27 Ca 0.71 -0.40 -0.05 0.00 -1.01 0.00 0.00 55.97 55.22 1sqc s LYS 27 Cb -0.33 -2.13 0.08 0.00 -1.01 0.00 0.00 37.83 34.45 1sqc s LYS 27 CO 0.38 -1.49 1.50 -0.44 0.51 0.00 0.00 175.35 175.81 1sqc h ASP 28 N -0.79 0.73 0.37 2.83 3.32 -1.96 -2.49 116.42 118.42 1sqc h ASP 28 Ca -0.43 -0.37 0.00 0.00 0.02 0.00 0.00 57.03 56.25 1sqc h ASP 28 Cb 1.29 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 40.64 1sqc h ASP 28 CO 0.53 1.10 0.00 -0.33 -1.72 0.00 0.00 179.24 178.82 1sqc h GLU 29 N 0.52 0.00 0.00 3.56 3.07 -1.97 -3.46 114.58 116.30 1sqc h GLU 29 Ca 0.02 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.88 1sqc h GLU 29 Cb 1.05 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.96 1sqc h GLU 29 CO 0.10 0.00 0.00 0.41 -1.40 0.00 0.00 179.01 178.12 1sqc n GLY 30 N -0.66 1.20 3.35 -3.84 0.00 -0.94 -4.76 105.19 99.54 1sqc n GLY 30 Ca 0.00 -0.10 -0.19 0.00 0.00 0.00 0.00 46.02 45.74 1sqc n GLY 30 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1sqc s TYR 31 N -2.00 1.74 -0.03 1.61 -0.85 -1.26 -3.62 117.35 112.94 1sqc s TYR 31 Ca 0.00 -0.57 -0.00 0.00 -0.52 0.00 0.00 57.07 55.98 1sqc s TYR 31 Cb 0.00 -0.81 -0.04 0.00 0.38 0.00 0.00 41.96 41.50 1sqc s TYR 31 CO 0.00 0.37 0.03 -1.58 -1.52 0.00 0.00 175.55 172.85 1sqc s TRP 32 N -2.96 3.17 -0.48 -3.49 0.51 -1.26 -1.35 118.94 113.09 1sqc s TRP 32 Ca 0.23 0.16 0.06 0.00 -2.12 0.00 0.00 56.10 54.43 1sqc s TRP 32 Cb -0.01 -1.73 0.18 0.00 -0.81 0.00 0.00 33.47 31.11 1sqc s TRP 32 CO 0.07 0.50 0.58 -0.46 -0.51 0.00 0.00 176.95 177.13 1sqc s TRP 33 N -1.06 -0.59 0.36 -1.98 -0.00 -1.26 -3.60 118.94 110.81 1sqc s TRP 33 Ca 0.19 -1.23 -0.24 0.00 -0.00 0.00 0.00 56.10 54.81 1sqc s TRP 33 Cb -0.12 -0.15 -0.10 0.00 -0.00 0.00 0.00 33.47 33.10 1sqc s TRP 33 CO 0.09 -1.11 0.95 0.20 -0.00 0.00 0.00 176.95 177.09 1sqc s GLY 34 N 0.57 2.67 0.57 5.86 0.00 -1.26 -4.98 107.32 110.75 1sqc s GLY 34 Ca 0.31 0.50 -0.20 0.00 0.00 0.00 0.00 44.72 45.33 1sqc s GLY 34 CO -0.11 0.89 1.22 -4.14 0.00 0.00 0.00 173.10 170.96 1sqc s PRO 35 N -2.45 3.06 -0.29 2.90 0.02 -1.26 -4.59 135.00 132.40 1sqc s PRO 35 Ca 0.55 1.87 -0.10 0.00 0.02 0.00 0.00 61.00 63.34 1sqc s PRO 35 Cb -0.16 -2.01 -0.03 0.00 0.02 0.00 0.00 34.50 32.32 1sqc s PRO 35 CO 0.21 -1.15 0.15 -1.17 -0.33 0.00 0.00 177.00 174.71 1sqc s LEU 36 N -3.91 3.97 -0.13 -5.54 2.96 -1.26 -2.86 118.68 111.91 1sqc s LEU 36 Ca 0.76 -0.28 -0.17 0.00 -0.22 0.00 0.00 54.13 54.21 1sqc s LEU 36 Cb -0.32 -2.03 -0.04 0.00 0.50 0.00 0.00 46.19 44.30 1sqc s LEU 36 CO 0.35 -0.12 0.42 -0.76 -1.32 0.00 0.00 176.35 174.92 1sqc s LEU 37 N 1.67 4.27 0.00 -0.68 1.02 0.47 -4.52 118.68 120.91 1sqc s LEU 37 Ca 0.06 0.73 0.00 0.00 0.02 0.00 0.00 54.13 54.94 1sqc s LEU 37 Cb -0.16 -2.60 0.00 0.00 0.02 0.00 0.00 46.19 43.45 1sqc s LEU 37 CO 0.07 0.04 0.00 -1.54 0.02 0.00 0.00 176.35 174.94 1sqc n SER 38 N 3.60 0.00 -3.59 2.29 3.41 -1.26 0.13 113.62 118.20 1sqc n SER 38 Ca -0.09 0.00 -0.11 0.00 -0.26 0.00 0.00 58.87 58.42 1sqc n SER 38 Cb 0.52 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.43 1sqc n SER 38 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1sqc s ASN 39 N 1.00 -0.37 0.55 4.04 2.20 -1.26 -4.79 114.94 116.31 1sqc s ASN 39 Ca 0.00 -0.25 0.33 0.00 -0.94 0.00 0.00 52.86 52.00 1sqc s ASN 39 Cb 0.00 0.56 1.12 0.00 -2.00 0.00 0.00 41.25 40.94 1sqc s ASN 39 CO 0.00 -0.97 1.29 0.52 -2.94 0.00 0.00 177.10 175.00 1sqc n VAL 40 N -0.33 0.00 0.25 3.54 0.31 -1.26 -1.98 118.33 118.86 1sqc n VAL 40 Ca -0.14 1.25 0.08 0.00 -0.01 0.00 0.00 64.34 65.51 1sqc n VAL 40 Cb 0.64 -2.17 0.62 0.00 -0.91 0.00 0.00 33.84 32.02 1sqc n VAL 40 CO 0.00 0.00 0.00 0.71 -1.32 0.00 0.00 176.83 176.22 1sqc h THR 41 N 0.00 0.96 0.30 2.52 1.35 -1.97 -0.67 112.91 115.41 1sqc h THR 41 Ca 0.61 -0.34 0.00 0.00 -0.55 0.00 0.00 66.41 66.14 1sqc h THR 41 Cb 3.02 1.19 -0.02 0.00 -1.73 0.00 0.00 68.15 70.60 1sqc h THR 41 CO -0.01 0.09 -0.32 0.24 -0.25 0.00 0.00 175.52 175.28 1sqc h MET 42 N 0.00 -0.63 0.00 4.72 2.86 -1.76 -0.59 114.93 119.53 1sqc h MET 42 Ca -0.00 0.04 -0.07 0.00 -2.06 0.00 0.00 59.70 57.62 1sqc h MET 42 Cb 0.18 0.14 -0.01 0.00 0.06 0.00 0.00 31.60 31.97 1sqc h MET 42 CO 0.01 -0.42 -0.32 1.05 1.06 0.00 0.00 176.91 178.29 1sqc h GLU 43 N -0.66 0.00 -0.20 1.72 9.09 -1.74 -1.76 114.58 121.05 1sqc h GLU 43 Ca -0.01 0.00 -0.06 0.00 0.05 0.00 0.00 59.36 59.34 1sqc h GLU 43 Cb 0.60 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.70 1sqc h GLU 43 CO -0.07 0.32 -0.12 0.00 0.05 0.00 0.00 179.01 179.19 1sqc h ALA 44 N 1.68 0.28 0.00 1.06 0.00 -0.93 -1.36 119.26 119.99 1sqc h ALA 44 Ca -0.00 -0.30 -0.10 0.00 0.00 0.00 0.00 54.91 54.51 1sqc h ALA 44 Cb 1.16 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 1sqc h ALA 44 CO 0.04 0.13 -0.47 0.93 0.00 0.00 0.00 179.25 179.88 1sqc h GLU 45 N 0.11 0.00 -0.14 0.00 5.08 -1.12 -2.03 114.58 116.48 1sqc h GLU 45 Ca 0.04 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.39 1sqc h GLU 45 Cb 0.62 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.86 1sqc h GLU 45 CO 0.03 0.47 0.05 -0.92 -1.00 0.00 0.00 179.01 177.64 1sqc h TYR 46 N 0.00 0.22 -0.10 4.33 5.03 -1.08 0.63 116.97 126.01 1sqc h TYR 46 Ca -0.00 -0.02 0.04 0.00 2.58 0.00 0.00 58.73 61.33 1sqc h TYR 46 Cb 0.88 -0.06 -0.06 0.00 1.55 0.00 0.00 36.73 39.04 1sqc h TYR 46 CO 0.00 0.33 -0.33 0.28 -1.32 0.00 0.00 178.16 177.12 1sqc h VAL 47 N 0.05 0.28 -0.48 1.81 2.07 -0.97 0.50 116.25 119.50 1sqc h VAL 47 Ca 0.05 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.64 1sqc h VAL 47 Cb 0.21 0.28 -0.06 0.00 -1.52 0.00 0.00 31.29 30.20 1sqc h VAL 47 CO -0.00 0.00 0.15 -0.07 0.02 0.00 0.00 177.57 177.67 1sqc h LEU 48 N -0.42 0.12 -0.41 2.57 3.38 -1.02 -2.01 115.31 117.53 1sqc h LEU 48 Ca 0.09 0.07 0.08 0.00 0.09 0.00 0.00 57.88 58.20 1sqc h LEU 48 Cb 0.55 0.07 -0.07 0.00 0.09 0.00 0.00 40.66 41.30 1sqc h LEU 48 CO -0.33 0.10 -0.06 0.25 0.09 0.00 0.00 178.44 178.49 1sqc h LEU 49 N 0.31 -0.29 -1.69 1.67 5.85 0.14 -0.73 115.31 120.57 1sqc h LEU 49 Ca 0.24 0.11 0.05 0.00 0.84 0.00 0.00 57.88 59.12 1sqc h LEU 49 Cb 0.27 0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.49 1sqc h LEU 49 CO -0.26 -0.10 0.29 0.00 -0.34 0.00 0.00 178.44 178.03 1sqc h HIS 51 N 0.38 0.15 -0.52 0.00 -0.00 -0.73 -1.26 115.15 113.17 1sqc h HIS 51 Ca 0.18 -0.02 -0.02 0.00 -0.00 0.00 0.00 60.37 60.52 1sqc h HIS 51 Cb 0.25 -0.04 -0.02 0.00 -0.00 0.00 0.00 27.41 27.60 1sqc h HIS 51 CO -0.00 0.35 0.26 0.82 -0.00 0.00 0.00 177.93 179.37 1sqc h ILE 52 N -0.11 1.19 0.00 6.26 2.04 -0.97 -2.49 117.51 123.44 1sqc h ILE 52 Ca 0.02 -0.52 0.00 0.00 1.00 0.00 0.00 64.86 65.37 1sqc h ILE 52 Cb 0.29 0.58 0.00 0.00 -0.74 0.00 0.00 36.82 36.94 1sqc h ILE 52 CO 0.00 0.21 0.00 0.18 0.00 0.00 0.00 178.15 178.54 1sqc n LEU 53 N -4.61 0.15 -2.76 1.44 4.77 -0.34 -4.90 117.00 110.76 1sqc n LEU 53 Ca 0.02 0.53 -0.19 0.00 -0.03 0.00 0.00 56.01 56.34 1sqc n LEU 53 Cb 0.11 -0.50 0.05 0.00 -2.33 0.00 0.00 43.42 40.74 1sqc n LEU 53 CO 0.37 -0.21 0.09 -0.67 -1.33 0.00 0.00 177.39 175.64 1sqc n ASP 54 N -1.65 -5.48 -3.15 -1.43 2.03 -0.64 -4.97 116.55 101.27 1sqc n ASP 54 Ca 0.04 -0.33 -0.23 0.00 0.52 0.00 0.00 54.79 54.80 1sqc n ASP 54 Cb 0.25 -4.21 -0.05 0.00 -0.72 0.00 0.00 41.12 36.38 1sqc n ASP 54 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1sqc n ARG 55 N -3.79 1.81 -3.16 -0.67 1.74 -0.57 -5.05 116.66 106.97 1sqc n ARG 55 Ca -0.05 -3.97 -0.40 0.00 -0.77 0.00 0.00 57.85 52.66 1sqc n ARG 55 Cb 0.58 -1.85 -0.06 0.00 -1.02 0.00 0.00 32.46 30.11 1sqc n ARG 55 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1sqc s VAL 56 N -2.80 5.04 -0.48 1.55 1.01 -1.26 -4.86 120.40 118.60 1sqc s VAL 56 Ca 0.42 1.09 -0.13 0.00 0.00 0.00 0.00 61.98 63.36 1sqc s VAL 56 Cb 0.27 -3.91 0.11 0.00 0.00 0.00 0.00 36.38 32.85 1sqc s VAL 56 CO -0.09 0.11 0.39 -0.62 0.00 0.00 0.00 175.10 174.89 1sqc s ASP 57 N 1.26 5.93 0.38 3.32 2.15 -1.26 -4.97 116.67 123.49 1sqc s ASP 57 Ca 0.26 -1.70 0.19 0.00 0.43 0.00 0.00 52.55 51.74 1sqc s ASP 57 Cb -0.16 -2.10 1.17 0.00 -0.30 0.00 0.00 42.92 41.53 1sqc s ASP 57 CO 0.10 -0.71 1.69 0.03 -0.17 0.00 0.00 175.17 176.11 1sqc h ARG 58 N 8.64 0.30 -0.36 4.34 2.47 -2.00 0.39 114.38 128.17 1sqc h ARG 58 Ca -0.26 -0.02 -0.03 0.00 -1.26 0.00 0.00 59.98 58.42 1sqc h ARG 58 Cb 1.09 -0.07 -0.02 0.00 -1.65 0.00 0.00 29.97 29.33 1sqc h ARG 58 CO 0.91 0.20 0.12 0.22 0.56 0.00 0.00 179.97 181.97 1sqc h ASP 59 N 0.31 0.52 -0.29 7.04 1.82 -2.01 -2.52 116.42 121.29 1sqc h ASP 59 Ca 0.71 -0.20 -0.01 0.00 -0.39 0.00 0.00 57.03 57.14 1sqc h ASP 59 Cb 1.82 -0.14 -0.01 0.00 0.68 0.00 0.00 39.33 41.68 1sqc h ASP 59 CO -0.45 0.58 0.15 -0.09 -1.61 0.00 0.00 179.24 177.82 1sqc h ARG 60 N 0.43 0.41 -0.77 0.28 9.65 -1.38 -2.86 114.38 120.14 1sqc h ARG 60 Ca 0.12 -0.05 0.14 0.00 -1.10 0.00 0.00 59.98 59.08 1sqc h ARG 60 Cb 0.24 -0.08 -0.09 0.00 -1.39 0.00 0.00 29.97 28.65 1sqc h ARG 60 CO -0.00 0.37 0.33 0.52 2.80 0.00 0.00 179.97 183.99 1sqc h MET 61 N 0.34 0.48 -0.41 0.20 2.86 -1.15 -1.73 114.93 115.52 1sqc h MET 61 Ca 0.10 -0.03 0.02 0.00 -2.06 0.00 0.00 59.70 57.73 1sqc h MET 61 Cb 0.09 -0.11 -0.03 0.00 0.06 0.00 0.00 31.60 31.61 1sqc h MET 61 CO -0.01 0.32 0.24 0.93 1.06 0.00 0.00 176.91 179.44 1sqc h GLU 62 N 0.50 0.47 0.00 1.72 4.39 -1.24 0.31 114.58 120.73 1sqc h GLU 62 Ca 0.42 -0.03 -0.05 0.00 0.34 0.00 0.00 59.36 60.04 1sqc h GLU 62 Cb 0.61 -0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 29.15 1sqc h GLU 62 CO -0.38 0.31 -0.22 0.87 -1.16 0.00 0.00 179.01 178.43 1sqc h LYS 63 N 0.48 0.00 0.13 2.33 1.57 -1.19 -1.22 116.57 118.68 1sqc h LYS 63 Ca 0.17 0.00 -0.26 0.00 -1.87 0.00 0.00 60.65 58.69 1sqc h LYS 63 Cb 0.02 0.00 0.03 0.00 0.08 0.00 0.00 32.23 32.36 1sqc h LYS 63 CO -0.08 0.22 -1.09 0.82 -0.57 0.00 0.00 179.45 178.74 1sqc h ILE 64 N 0.00 1.36 -0.81 1.86 2.04 -0.68 -1.78 117.51 119.50 1sqc h ILE 64 Ca -0.00 -2.47 0.07 0.00 1.00 0.00 0.00 64.86 63.46 1sqc h ILE 64 Cb 0.49 2.88 -0.06 0.00 -0.74 0.00 0.00 36.82 39.39 1sqc h ILE 64 CO 0.03 0.73 0.48 -0.09 0.00 0.00 0.00 178.15 179.30 1sqc h ARG 65 N 0.03 0.84 -0.16 2.37 2.43 0.15 0.21 114.38 120.24 1sqc h ARG 65 Ca -0.17 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 58.94 1sqc h ARG 65 Cb 1.81 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 31.17 1sqc h ARG 65 CO 0.21 0.55 0.08 0.00 -1.51 0.00 0.00 179.97 179.30 1sqc h ARG 66 N 0.86 0.24 -0.14 0.20 3.08 -1.28 -2.59 114.38 114.74 1sqc h ARG 66 Ca 0.37 -0.04 -0.00 0.00 0.07 0.00 0.00 59.98 60.38 1sqc h ARG 66 Cb 0.24 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.24 1sqc h ARG 66 CO -0.20 0.28 0.08 -0.92 -1.07 0.00 0.00 179.97 178.14 1sqc h TYR 67 N 0.14 0.19 -0.70 3.04 3.20 -1.00 0.33 116.97 122.17 1sqc h TYR 67 Ca 0.06 -0.00 0.08 0.00 3.14 0.00 0.00 58.73 62.00 1sqc h TYR 67 Cb 0.12 -0.06 -0.07 0.00 1.54 0.00 0.00 36.73 38.26 1sqc h TYR 67 CO -0.03 0.19 0.37 -0.07 -1.64 0.00 0.00 178.16 176.98 1sqc h LEU 68 N 0.15 0.51 -0.34 2.82 3.38 -0.94 -1.36 115.31 119.53 1sqc h LEU 68 Ca 0.05 0.05 -0.08 0.00 0.09 0.00 0.00 57.88 57.99 1sqc h LEU 68 Cb 0.05 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 1sqc h LEU 68 CO -0.01 0.31 -0.09 -0.07 0.09 0.00 0.00 178.44 178.67 1sqc h LEU 69 N 0.64 0.66 -1.60 1.67 4.07 -1.25 -1.52 115.31 117.98 1sqc h LEU 69 Ca 0.33 -0.37 0.00 0.00 0.08 0.00 0.00 57.88 57.93 1sqc h LEU 69 Cb 0.30 -0.18 0.00 0.00 1.08 0.00 0.00 40.66 41.86 1sqc h LEU 69 CO -0.23 0.87 0.00 -0.74 -1.08 0.00 0.00 178.44 177.26 1sqc h HIS 70 N 0.44 0.00 0.00 1.13 2.76 -0.40 -2.44 115.15 116.64 1sqc h HIS 70 Ca 0.08 0.00 -0.25 0.00 -2.20 0.00 0.00 60.37 58.01 1sqc h HIS 70 Cb 0.59 0.00 -0.05 0.00 1.55 0.00 0.00 27.41 29.50 1sqc h HIS 70 CO 0.05 0.00 -2.09 0.39 -1.30 0.00 0.00 177.93 174.98 1sqc n GLU 71 N -2.48 0.67 -1.98 5.26 -0.58 -0.56 -4.93 120.64 116.03 1sqc n GLU 71 Ca -0.01 0.01 -0.41 0.00 -0.42 0.00 0.00 57.16 56.32 1sqc n GLU 71 Cb 0.10 -1.59 -0.02 0.00 -0.57 0.00 0.00 31.44 29.36 1sqc n GLU 71 CO 0.00 0.00 0.00 -1.14 -0.48 0.00 0.00 177.13 175.51 1sqc s GLN 72 N -2.81 4.25 0.76 3.49 0.74 -0.63 -4.87 119.66 120.59 1sqc s GLN 72 Ca -0.08 2.34 -0.09 0.00 0.05 0.00 0.00 55.36 57.58 1sqc s GLN 72 Cb 0.08 -3.09 0.09 0.00 1.10 0.00 0.00 33.01 31.19 1sqc s GLN 72 CO 0.84 -0.44 1.09 1.03 -0.55 0.00 0.00 175.29 177.26 1sqc s ARG 73 N -0.47 1.90 0.24 1.67 3.00 -0.32 -4.93 118.95 120.03 1sqc s ARG 73 Ca 0.59 -0.26 -0.06 0.00 0.00 0.00 0.00 55.73 56.00 1sqc s ARG 73 Cb -0.43 -2.09 0.42 0.00 0.00 0.00 0.00 34.95 32.85 1sqc s ARG 73 CO 0.45 -1.49 1.70 0.93 0.00 0.00 0.00 175.30 176.89 1sqc h GLU 74 N -0.83 0.29 0.00 3.54 5.08 -1.95 -0.35 114.58 120.36 1sqc h GLU 74 Ca -0.44 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 57.90 1sqc h GLU 74 Cb 1.30 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.49 1sqc h GLU 74 CO 0.57 0.19 0.00 -0.40 -1.00 0.00 0.00 179.01 178.37 1sqc n ASP 75 N -5.12 0.00 0.00 1.42 5.68 -1.26 -4.80 116.55 112.48 1sqc n ASP 75 Ca 0.13 0.37 0.00 0.00 -0.50 0.00 0.00 54.79 54.79 1sqc n ASP 75 Cb 0.42 -0.39 0.00 0.00 -1.14 0.00 0.00 41.12 40.01 1sqc n ASP 75 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1sqc n GLY 76 N -1.18 0.69 3.59 6.12 0.00 -0.14 -4.58 105.19 109.69 1sqc n GLY 76 Ca 0.01 -0.40 -0.27 0.00 0.00 0.00 0.00 46.02 45.36 1sqc n GLY 76 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1sqc s THR 77 N -2.00 1.63 0.03 2.61 -4.23 -1.25 -3.58 115.64 108.85 1sqc s THR 77 Ca 0.00 -2.00 0.07 0.00 -1.18 0.00 0.00 61.69 58.58 1sqc s THR 77 Cb 0.00 -2.81 -0.02 0.00 1.34 0.00 0.00 72.50 71.00 1sqc s THR 77 CO 0.00 0.00 -0.20 0.26 -0.54 0.00 0.00 174.62 174.14 1sqc s TRP 78 N -2.90 1.77 0.49 3.99 0.51 -1.26 -1.18 118.94 120.36 1sqc s TRP 78 Ca 0.31 -0.36 0.05 0.00 -2.12 0.00 0.00 56.10 53.98 1sqc s TRP 78 Cb 0.08 -1.07 -0.00 0.00 -0.81 0.00 0.00 33.47 31.67 1sqc s TRP 78 CO 0.15 0.06 0.26 0.00 -0.51 0.00 0.00 176.95 176.92 1sqc s ALA 79 N -0.73 4.11 0.04 0.98 0.00 -1.26 -0.85 121.76 124.05 1sqc s ALA 79 Ca 0.07 -1.37 0.10 0.00 0.00 0.00 0.00 51.96 50.76 1sqc s ALA 79 Cb -0.08 -0.50 -0.18 0.00 0.00 0.00 0.00 23.12 22.35 1sqc s ALA 79 CO 0.01 -0.27 1.12 -0.07 0.00 0.00 0.00 175.76 176.55 1sqc h LEU 80 N 1.07 0.00 -8.18 0.00 3.38 -1.91 -3.45 115.31 106.23 1sqc h LEU 80 Ca -0.40 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.40 1sqc h LEU 80 Cb 1.29 0.00 -0.18 0.00 0.09 0.00 0.00 40.66 41.86 1sqc h LEU 80 CO 0.64 0.93 -0.69 -0.72 0.09 0.00 0.00 178.44 178.68 1sqc s TYR 81 N -2.72 0.50 0.25 1.13 1.13 -1.26 -4.47 117.35 111.90 1sqc s TYR 81 Ca -0.00 -0.82 -0.31 0.00 -1.41 0.00 0.00 57.07 54.53 1sqc s TYR 81 Cb 0.09 -0.34 -0.11 0.00 -1.10 0.00 0.00 41.96 40.50 1sqc s TYR 81 CO 0.81 -0.26 1.57 -1.25 -2.51 0.00 0.00 175.55 173.92 1sqc s PRO 82 N -2.89 4.17 0.00 -3.49 0.04 -1.26 -1.85 135.00 129.73 1sqc s PRO 82 Ca -0.01 2.48 0.00 0.00 0.04 0.00 0.00 61.00 63.51 1sqc s PRO 82 Cb 0.00 -3.07 0.00 0.00 0.04 0.00 0.00 34.50 31.47 1sqc s PRO 82 CO -0.05 -0.60 0.00 0.41 0.04 0.00 0.00 177.00 176.80 1sqc n GLY 83 N 2.72 1.30 3.90 0.56 0.00 -1.26 -4.82 105.19 107.59 1sqc n GLY 83 Ca 0.10 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.84 1sqc n GLY 83 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1sqc s GLY 84 N -1.86 1.62 0.76 -0.02 0.00 -0.77 -5.05 107.32 102.01 1sqc s GLY 84 Ca 0.00 -0.63 -0.13 0.00 0.00 0.00 0.00 44.72 43.96 1sqc s GLY 84 CO 0.00 -0.22 1.13 2.56 0.00 0.00 0.00 173.10 176.57 1sqc s PRO 85 N -5.36 2.10 0.34 2.90 0.04 -1.26 -4.77 135.00 128.99 1sqc s PRO 85 Ca 0.59 1.43 -0.29 0.00 0.04 0.00 0.00 61.00 62.78 1sqc s PRO 85 Cb -0.11 -1.86 -0.11 0.00 0.04 0.00 0.00 34.50 32.46 1sqc s PRO 85 CO 0.48 -1.80 1.42 -1.25 0.04 0.00 0.00 177.00 175.90 1sqc s PRO 86 N -4.43 4.22 -0.19 0.56 0.04 -1.26 -4.48 135.00 129.46 1sqc s PRO 86 Ca 0.67 2.41 -0.06 0.00 0.04 0.00 0.00 61.00 64.05 1sqc s PRO 86 Cb -0.22 -3.03 -0.03 0.00 0.04 0.00 0.00 34.50 31.26 1sqc s PRO 86 CO 0.50 -0.40 0.04 0.34 0.04 0.00 0.00 177.00 177.52 1sqc s ASP 87 N -0.14 5.31 0.03 6.66 -1.08 -0.03 -4.97 116.67 122.44 1sqc s ASP 87 Ca 0.53 -0.03 -0.31 0.00 -0.52 0.00 0.00 52.55 52.21 1sqc s ASP 87 Cb -0.44 -1.91 -0.17 0.00 -1.46 0.00 0.00 42.92 38.94 1sqc s ASP 87 CO 0.55 0.13 1.29 0.25 0.52 0.00 0.00 175.17 177.91 1sqc h LEU 88 N 7.02 -0.95 -0.53 -1.34 5.85 -1.94 -1.79 115.31 121.63 1sqc h LEU 88 Ca -0.36 0.03 0.10 0.00 0.84 0.00 0.00 57.88 58.50 1sqc h LEU 88 Cb 1.18 0.25 -0.11 0.00 0.37 0.00 0.00 40.66 42.34 1sqc h LEU 88 CO 0.66 -0.59 -0.25 0.44 -0.34 0.00 0.00 178.44 178.35 1sqc h ASP 89 N -1.30 -0.88 -0.57 1.25 3.32 -1.95 0.24 116.42 116.52 1sqc h ASP 89 Ca -0.11 0.20 0.00 0.00 0.02 0.00 0.00 57.03 57.13 1sqc h ASP 89 Cb 0.86 0.47 -0.03 0.00 0.22 0.00 0.00 39.33 40.85 1sqc h ASP 89 CO 0.19 -0.27 0.35 0.74 -1.72 0.00 0.00 179.24 178.53 1sqc h THR 90 N -0.13 1.16 -0.44 0.35 2.02 -1.89 -2.52 112.91 111.46 1sqc h THR 90 Ca 0.24 -0.33 -0.10 0.00 0.77 0.00 0.00 66.41 66.99 1sqc h THR 90 Cb 0.50 0.37 -0.02 0.00 -1.74 0.00 0.00 68.15 67.26 1sqc h THR 90 CO -0.61 0.16 -0.13 0.74 0.37 0.00 0.00 175.52 176.05 1sqc h THR 91 N 0.76 1.26 -0.52 3.16 2.02 -0.28 -2.11 112.91 117.20 1sqc h THR 91 Ca 0.20 -1.21 -0.02 0.00 0.77 0.00 0.00 66.41 66.15 1sqc h THR 91 Cb -0.04 1.06 -0.02 0.00 -1.74 0.00 0.00 68.15 67.40 1sqc h THR 91 CO -0.04 0.41 0.24 0.40 0.37 0.00 0.00 175.52 176.90 1sqc h ILE 92 N 0.73 1.20 -0.29 3.11 2.04 -0.30 -0.29 117.51 123.72 1sqc h ILE 92 Ca 0.12 -0.59 -0.14 0.00 1.00 0.00 0.00 64.86 65.25 1sqc h ILE 92 Cb 0.62 0.63 -0.00 0.00 -0.74 0.00 0.00 36.82 37.33 1sqc h ILE 92 CO 0.04 0.23 -0.35 -0.33 0.00 0.00 0.00 178.15 177.74 1sqc h GLU 93 N 0.70 0.74 -0.80 2.37 5.08 -1.39 -2.28 114.58 119.00 1sqc h GLU 93 Ca 0.18 -0.42 -0.02 0.00 -1.00 0.00 0.00 59.36 58.10 1sqc h GLU 93 Cb 0.14 0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.38 1sqc h GLU 93 CO -0.02 1.04 0.42 0.00 -1.00 0.00 0.00 179.01 179.45 1sqc h ALA 94 N 0.69 1.22 -0.39 3.43 0.00 -1.26 -0.89 119.26 122.08 1sqc h ALA 94 Ca 0.04 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 1sqc h ALA 94 Cb 0.94 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 1sqc h ALA 94 CO 0.08 0.61 0.23 -0.92 0.00 0.00 0.00 179.25 179.26 1sqc h TYR 95 N 1.13 0.51 -0.42 0.00 3.20 -0.90 -1.09 116.97 119.40 1sqc h TYR 95 Ca 0.28 -0.00 -0.08 0.00 3.14 0.00 0.00 58.73 62.07 1sqc h TYR 95 Cb 0.06 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.15 1sqc h TYR 95 CO 0.01 0.36 -0.04 0.28 -1.64 0.00 0.00 178.16 177.13 1sqc h VAL 96 N 0.51 1.27 0.07 1.81 2.07 -0.83 -0.72 116.25 120.43 1sqc h VAL 96 Ca 0.14 -1.10 -0.00 0.00 0.82 0.00 0.00 66.70 66.56 1sqc h VAL 96 Cb -0.00 1.13 0.00 0.00 -1.52 0.00 0.00 31.29 30.90 1sqc h VAL 96 CO -0.03 0.37 -0.03 0.00 0.02 0.00 0.00 177.57 177.90 1sqc h ALA 97 N 0.88 -0.10 -0.76 1.67 0.00 -1.07 -0.75 119.26 119.14 1sqc h ALA 97 Ca 0.11 -0.03 0.08 0.00 0.00 0.00 0.00 54.91 55.07 1sqc h ALA 97 Cb 0.54 0.04 -0.07 0.00 0.00 0.00 0.00 17.79 18.31 1sqc h ALA 97 CO 0.03 -0.54 0.42 -0.07 0.00 0.00 0.00 179.25 179.09 1sqc h LEU 98 N -0.12 0.61 -0.84 0.00 3.38 -1.06 -1.21 115.31 116.06 1sqc h LEU 98 Ca -0.01 0.04 -0.09 0.00 0.09 0.00 0.00 57.88 57.91 1sqc h LEU 98 Cb 0.10 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 1sqc h LEU 98 CO 0.02 0.37 -0.11 0.50 0.09 0.00 0.00 178.44 179.30 1sqc h LYS 99 N 0.74 0.74 -0.01 1.13 3.64 -0.81 -2.33 116.57 119.67 1sqc h LYS 99 Ca 0.35 -0.24 -0.06 0.00 -1.27 0.00 0.00 60.65 59.43 1sqc h LYS 99 Cb 0.29 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.03 1sqc h LYS 99 CO -0.22 0.83 -0.26 -0.92 -2.27 0.00 0.00 179.45 176.61 1sqc h TYR 100 N 0.68 0.02 -0.02 1.91 3.20 -0.04 -3.08 116.97 119.64 1sqc h TYR 100 Ca 0.12 -0.00 -0.18 0.00 3.14 0.00 0.00 58.73 61.81 1sqc h TYR 100 Cb 0.58 -0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.83 1sqc h TYR 100 CO 0.03 0.27 -0.77 0.82 -1.64 0.00 0.00 178.16 176.87 1sqc h ILE 101 N 0.01 1.47 0.00 1.81 2.04 -0.71 -3.48 117.51 118.65 1sqc h ILE 101 Ca 0.00 -2.41 0.00 0.00 1.00 0.00 0.00 64.86 63.45 1sqc h ILE 101 Cb 0.47 2.31 0.00 0.00 -0.74 0.00 0.00 36.82 38.86 1sqc h ILE 101 CO 0.03 0.70 0.00 0.61 0.00 0.00 0.00 178.15 179.50 1sqc n GLY 102 N 0.65 0.40 3.72 5.37 0.00 -1.11 -5.07 105.19 109.14 1sqc n GLY 102 Ca -0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.56 1sqc n GLY 102 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1sqc n MET 103 N 0.00 2.39 -3.84 1.61 2.81 -1.16 -5.00 117.12 113.93 1sqc n MET 103 Ca 0.00 0.85 -0.31 0.00 -1.81 0.00 0.00 57.70 56.43 1sqc n MET 103 Cb 0.00 -2.56 -0.04 0.00 -0.71 0.00 0.00 33.22 29.91 1sqc n MET 103 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 1sqc s SER 104 N 0.27 6.40 0.58 7.83 1.04 -1.26 -4.52 113.70 124.04 1sqc s SER 104 Ca 0.63 0.36 0.28 0.00 0.48 0.00 0.00 55.95 57.71 1sqc s SER 104 Cb -0.56 -2.00 1.55 0.00 0.10 0.00 0.00 66.02 65.12 1sqc s SER 104 CO 0.52 0.12 1.86 0.08 0.98 0.00 0.00 173.24 176.80 1sqc h ARG 105 N 2.92 0.00 0.09 4.02 0.11 -1.97 -2.79 114.38 116.76 1sqc h ARG 105 Ca -0.46 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 59.62 1sqc h ARG 105 Cb 1.16 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.25 1sqc h ARG 105 CO 0.74 0.00 -0.04 -0.44 0.10 0.00 0.00 179.97 180.33 1sqc h ASP 106 N 0.00 -0.10 -1.65 0.08 3.32 -1.96 -3.27 116.42 112.84 1sqc h ASP 106 Ca 0.00 -0.27 -0.64 0.00 0.02 0.00 0.00 57.03 56.13 1sqc h ASP 106 Cb 0.51 0.03 0.11 0.00 0.22 0.00 0.00 39.33 40.19 1sqc h ASP 106 CO 0.00 0.22 -0.21 -0.62 -1.72 0.00 0.00 179.24 176.91 1sqc n GLU 107 N -5.00 0.61 -0.36 3.56 1.02 -1.05 -4.48 120.64 114.94 1sqc n GLU 107 Ca -0.08 0.21 -0.05 0.00 -0.02 0.00 0.00 57.16 57.22 1sqc n GLU 107 Cb 0.20 -1.40 -0.03 0.00 -0.02 0.00 0.00 31.44 30.19 1sqc n GLU 107 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1sqc n GLU 108 N 0.93 -0.30 -0.26 3.49 -0.58 -1.26 -1.00 120.64 121.65 1sqc n GLU 108 Ca 0.14 1.37 0.00 0.00 -0.42 0.00 0.00 57.16 58.26 1sqc n GLU 108 Cb 0.27 -2.03 0.13 0.00 -0.57 0.00 0.00 31.44 29.25 1sqc n GLU 108 CO 0.00 0.00 0.00 -1.35 -0.48 0.00 0.00 177.13 175.30 1sqc h PRO 109 N 0.00 0.71 0.29 3.49 0.11 -1.96 -2.41 132.00 132.23 1sqc h PRO 109 Ca 0.23 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 66.28 1sqc h PRO 109 Cb 0.46 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 31.41 1sqc h PRO 109 CO -0.87 0.47 -0.14 0.52 -0.21 0.00 0.00 178.00 177.77 1sqc h MET 110 N 0.73 -0.38 -0.06 1.05 2.86 -1.36 -2.79 114.93 114.98 1sqc h MET 110 Ca 0.34 0.03 0.04 0.00 -2.06 0.00 0.00 59.70 58.05 1sqc h MET 110 Cb 0.26 0.09 -0.06 0.00 0.06 0.00 0.00 31.60 31.95 1sqc h MET 110 CO -0.21 -0.15 -0.39 1.96 1.06 0.00 0.00 176.91 179.17 1sqc h GLN 111 N -0.55 -0.49 -0.98 1.72 1.08 -1.07 0.46 115.11 115.27 1sqc h GLN 111 Ca -0.04 0.03 0.07 0.00 -1.45 0.00 0.00 58.65 57.27 1sqc h GLN 111 Cb 0.41 0.11 -0.07 0.00 -0.05 0.00 0.00 27.48 27.88 1sqc h GLN 111 CO 0.07 -0.33 0.63 0.87 -0.95 0.00 0.00 178.83 179.12 1sqc h LYS 112 N -0.51 1.08 0.56 1.46 1.57 -1.51 -1.01 116.57 118.20 1sqc h LYS 112 Ca 0.07 -0.06 -0.03 0.00 -1.87 0.00 0.00 60.65 58.75 1sqc h LYS 112 Cb 0.62 -0.24 0.01 0.00 0.08 0.00 0.00 32.23 32.69 1sqc h LYS 112 CO -0.34 0.71 -0.27 0.00 -0.57 0.00 0.00 179.45 178.98 1sqc h ALA 113 N 1.48 -0.75 -0.71 3.86 0.00 -1.13 -2.93 119.26 119.07 1sqc h ALA 113 Ca 0.43 -0.19 0.16 0.00 0.00 0.00 0.00 54.91 55.30 1sqc h ALA 113 Cb 0.23 0.29 -0.13 0.00 0.00 0.00 0.00 17.79 18.18 1sqc h ALA 113 CO -0.18 -0.84 -0.05 1.25 0.00 0.00 0.00 179.25 179.43 1sqc h LEU 114 N -0.91 -0.43 -0.14 0.00 6.46 -0.27 -0.35 115.31 119.68 1sqc h LEU 114 Ca -0.08 0.19 0.05 0.00 -0.12 0.00 0.00 57.88 57.92 1sqc h LEU 114 Cb 0.63 0.36 -0.06 0.00 -0.73 0.00 0.00 40.66 40.86 1sqc h LEU 114 CO 0.13 -0.19 -0.27 0.03 -0.62 0.00 0.00 178.44 177.52 1sqc h ARG 115 N 0.07 -0.32 -0.39 1.25 -0.00 -1.16 0.65 114.38 114.47 1sqc h ARG 115 Ca 0.37 0.02 0.06 0.00 -0.50 0.00 0.00 59.98 59.94 1sqc h ARG 115 Cb 0.63 0.07 -0.05 0.00 0.00 0.00 0.00 29.97 30.62 1sqc h ARG 115 CO -0.66 -0.21 0.07 0.35 0.00 0.00 0.00 179.97 179.52 1sqc h PHE 116 N -0.33 0.12 -0.67 3.04 3.57 -0.93 -0.66 116.94 121.08 1sqc h PHE 116 Ca 0.10 0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.67 1sqc h PHE 116 Cb 0.49 0.01 -0.05 0.00 2.79 0.00 0.00 35.95 39.18 1sqc h PHE 116 CO -0.37 0.01 0.38 0.82 -2.23 0.00 0.00 178.31 176.93 1sqc h ILE 117 N 0.20 1.01 -0.22 1.41 2.04 -0.37 -2.23 117.51 119.35 1sqc h ILE 117 Ca 0.19 -0.25 -0.13 0.00 1.00 0.00 0.00 64.86 65.67 1sqc h ILE 117 Cb 0.23 0.22 -0.01 0.00 -0.74 0.00 0.00 36.82 36.52 1sqc h ILE 117 CO -0.25 0.13 -0.42 1.56 0.00 0.00 0.00 178.15 179.17 1sqc h GLN 118 N 0.72 0.51 0.00 2.37 4.20 -0.28 -2.12 115.11 120.52 1sqc h GLN 118 Ca 0.29 -0.27 0.00 0.00 0.06 0.00 0.00 58.65 58.73 1sqc h GLN 118 Cb 0.13 0.01 0.00 0.00 0.30 0.00 0.00 27.48 27.92 1sqc h GLN 118 CO -0.16 0.84 0.00 0.66 -0.67 0.00 0.00 178.83 179.51 1sqc h SER 119 N 0.42 0.00 -0.19 1.46 4.64 -0.60 -2.74 113.55 116.54 1sqc h SER 119 Ca 0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 1sqc h SER 119 Cb 0.91 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.00 1sqc h SER 119 CO 0.08 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.04 1sqc n GLN 120 N -2.51 2.17 0.00 4.77 1.13 -0.89 -4.92 117.38 117.12 1sqc n GLN 120 Ca 0.02 -1.73 0.00 0.00 -1.94 0.00 0.00 57.00 53.34 1sqc n GLN 120 Cb 0.25 -1.47 0.00 0.00 0.11 0.00 0.00 30.24 29.13 1sqc n GLN 120 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1sqc n GLY 121 N 1.33 1.14 7.00 1.08 0.00 -1.03 -4.54 105.19 110.17 1sqc n GLY 121 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 1sqc n GLY 121 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sqc n GLY 122 N -1.45 -1.17 0.36 -0.02 0.00 -0.82 -3.97 105.19 98.13 1sqc n GLY 122 Ca 0.00 -1.17 0.18 0.00 0.00 0.00 0.00 46.02 45.04 1sqc n GLY 122 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1sqc h ILE 123 N 0.00 0.77 0.00 -0.61 -0.00 -1.42 -2.06 117.51 114.19 1sqc h ILE 123 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 64.86 64.86 1sqc h ILE 123 Cb 0.00 0.78 0.00 0.00 -0.00 0.00 0.00 36.82 37.60 1sqc h ILE 123 CO 0.00 0.00 0.00 -0.62 -0.00 0.00 0.00 178.15 177.53 1sqc n GLU 124 N -4.38 0.03 0.00 2.19 -0.58 -1.25 -1.88 120.64 114.77 1sqc n GLU 124 Ca 0.07 0.29 0.11 0.00 -0.42 0.00 0.00 57.16 57.21 1sqc n GLU 124 Cb 0.52 -1.50 0.06 0.00 -0.57 0.00 0.00 31.44 29.95 1sqc n GLU 124 CO 0.00 0.00 0.00 0.43 -0.48 0.00 0.00 177.13 177.08 1sqc n SER 125 N -1.45 2.52 -4.87 1.62 7.64 -0.77 -4.67 113.62 113.64 1sqc n SER 125 Ca 0.03 -1.76 -0.30 0.00 1.01 0.00 0.00 58.87 57.85 1sqc n SER 125 Cb 0.12 0.17 -0.00 0.00 -1.01 0.00 0.00 64.21 63.48 1sqc n SER 125 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1sqc s SER 126 N -2.01 6.31 1.23 6.43 1.04 -0.79 -4.78 113.70 121.13 1sqc s SER 126 Ca 0.23 1.33 -0.14 0.00 0.48 0.00 0.00 55.95 57.84 1sqc s SER 126 Cb 0.18 -2.42 0.31 0.00 0.10 0.00 0.00 66.02 64.18 1sqc s SER 126 CO 0.36 -0.75 1.00 0.00 0.98 0.00 0.00 173.24 174.84 1sqc s ARG 127 N -4.87 -1.43 0.16 4.02 1.70 -1.26 -4.81 118.95 112.46 1sqc s ARG 127 Ca 0.54 0.71 -0.14 0.00 -0.47 0.00 0.00 55.73 56.37 1sqc s ARG 127 Cb -0.11 -1.50 0.04 0.00 -0.57 0.00 0.00 34.95 32.81 1sqc s ARG 127 CO 0.48 -4.03 1.76 0.28 -1.08 0.00 0.00 175.30 172.70 1sqc h VAL 128 N -2.84 1.18 -0.25 4.99 2.07 -1.93 -2.78 116.25 116.70 1sqc h VAL 128 Ca -0.61 -0.47 0.06 0.00 0.82 0.00 0.00 66.70 66.50 1sqc h VAL 128 Cb 1.34 0.58 -0.06 0.00 -1.52 0.00 0.00 31.29 31.64 1sqc h VAL 128 CO 0.47 0.19 -0.12 -0.26 0.02 0.00 0.00 177.57 177.88 1sqc h PHE 129 N 0.66 -0.29 -0.81 1.57 0.04 -1.92 0.30 116.94 116.49 1sqc h PHE 129 Ca 0.17 0.03 0.01 0.00 2.80 0.00 0.00 57.97 60.98 1sqc h PHE 129 Cb 0.07 0.17 -0.04 0.00 2.20 0.00 0.00 35.95 38.35 1sqc h PHE 129 CO -0.01 -0.19 0.54 1.15 -0.60 0.00 0.00 178.31 179.20 1sqc h THR 130 N -0.09 1.21 -0.51 -1.55 2.02 -1.91 0.36 112.91 112.44 1sqc h THR 130 Ca 0.13 -0.38 -0.11 0.00 0.77 0.00 0.00 66.41 66.82 1sqc h THR 130 Cb 0.29 0.01 -0.02 0.00 -1.74 0.00 0.00 68.15 66.69 1sqc h THR 130 CO -0.31 0.20 -0.13 0.03 0.37 0.00 0.00 175.52 175.69 1sqc h ARG 131 N 1.10 0.97 -0.08 6.66 3.08 -1.09 -1.52 114.38 123.50 1sqc h ARG 131 Ca 0.30 -0.36 -0.01 0.00 0.07 0.00 0.00 59.98 59.97 1sqc h ARG 131 Cb -0.13 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 29.86 1sqc h ARG 131 CO -0.06 1.03 0.00 1.98 -1.07 0.00 0.00 179.97 181.85 1sqc h MET 132 N 0.86 0.14 -0.43 0.04 4.05 0.52 0.36 114.93 120.48 1sqc h MET 132 Ca 0.13 -0.04 0.06 0.00 -0.28 0.00 0.00 59.70 59.57 1sqc h MET 132 Cb 0.68 -0.01 -0.05 0.00 -0.80 0.00 0.00 31.60 31.41 1sqc h MET 132 CO 0.05 0.40 0.11 -1.49 0.23 0.00 0.00 176.91 176.22 1sqc h TRP 133 N -0.14 0.20 -0.57 1.39 4.06 -0.28 0.20 115.95 120.81 1sqc h TRP 133 Ca 0.02 0.02 -0.03 0.00 2.06 0.00 0.00 58.89 60.97 1sqc h TRP 133 Cb 0.34 -0.02 -0.03 0.00 -1.00 0.00 0.00 29.16 28.45 1sqc h TRP 133 CO 0.03 0.05 0.24 -0.07 -3.56 0.00 0.00 178.44 175.13 1sqc h LEU 134 N 0.26 0.74 -0.49 -4.49 3.38 -1.05 -2.13 115.31 111.53 1sqc h LEU 134 Ca 0.21 -0.09 -0.03 0.00 0.09 0.00 0.00 57.88 58.06 1sqc h LEU 134 Cb 0.23 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 1sqc h LEU 134 CO -0.24 0.66 0.20 0.00 0.09 0.00 0.00 178.44 179.15 1sqc h ALA 135 N 1.45 0.64 -0.91 1.53 0.00 0.13 -0.63 119.26 121.47 1sqc h ALA 135 Ca 0.20 -0.15 0.17 0.00 0.00 0.00 0.00 54.91 55.13 1sqc h ALA 135 Cb 0.14 -0.19 -0.07 0.00 0.00 0.00 0.00 17.79 17.66 1sqc h ALA 135 CO -0.02 0.24 0.59 -0.07 0.00 0.00 0.00 179.25 179.99 1sqc h LEU 136 N 0.65 0.60 -1.82 0.00 3.38 0.01 0.41 115.31 118.54 1sqc h LEU 136 Ca 0.16 0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.18 1sqc h LEU 136 Cb 0.19 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.87 1sqc h LEU 136 CO -0.01 0.28 0.00 0.55 0.09 0.00 0.00 178.44 179.34 1sqc n VAL 137 N -4.58 0.73 -3.01 1.22 3.14 -0.99 -1.04 118.33 113.81 1sqc n VAL 137 Ca 0.19 -0.66 -0.12 0.00 -2.96 0.00 0.00 64.34 60.79 1sqc n VAL 137 Cb 0.55 0.26 0.05 0.00 -1.06 0.00 0.00 33.84 33.64 1sqc n VAL 137 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1sqc n GLY 138 N 1.19 0.03 0.02 7.55 0.00 0.14 -3.33 105.19 110.79 1sqc n GLY 138 Ca 0.16 -0.14 0.01 0.00 0.00 0.00 0.00 46.02 46.05 1sqc n GLY 138 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1sqc n GLU 139 N -3.00 2.31 -3.64 1.61 -0.58 -0.28 -4.89 120.64 112.18 1sqc n GLU 139 Ca -0.07 -1.42 -0.10 0.00 -0.42 0.00 0.00 57.16 55.14 1sqc n GLU 139 Cb 0.56 -0.95 -0.07 0.00 -0.57 0.00 0.00 31.44 30.41 1sqc n GLU 139 CO 0.00 0.00 0.00 -0.47 -0.48 0.00 0.00 177.13 176.18 1sqc s TYR 140 N -0.98 -0.84 0.10 -0.32 5.04 -1.25 -4.86 117.35 114.24 1sqc s TYR 140 Ca 0.03 1.87 -0.32 0.00 -2.44 0.00 0.00 57.07 56.21 1sqc s TYR 140 Cb 0.02 0.41 -0.11 0.00 0.35 0.00 0.00 41.96 42.63 1sqc s TYR 140 CO 0.00 -0.41 1.84 -0.35 -1.34 0.00 0.00 175.55 175.30 1sqc n PRO 141 N 3.24 2.71 -0.25 4.97 -0.04 -1.26 -4.35 135.00 140.02 1sqc n PRO 141 Ca -0.16 0.99 0.09 0.00 -0.04 0.00 0.00 63.50 64.37 1sqc n PRO 141 Cb 0.57 -2.88 0.35 0.00 -0.04 0.00 0.00 33.50 31.50 1sqc n PRO 141 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 1sqc h TRP 142 N 8.66 0.84 0.00 0.54 4.06 -1.96 -1.63 115.95 126.47 1sqc h TRP 142 Ca -0.47 0.02 0.00 0.00 2.06 0.00 0.00 58.89 60.50 1sqc h TRP 142 Cb 1.23 -0.27 0.00 0.00 -1.00 0.00 0.00 29.16 29.12 1sqc h TRP 142 CO 0.80 0.37 0.00 1.05 -3.56 0.00 0.00 178.44 177.11 1sqc h GLU 143 N 0.77 0.00 -0.46 0.49 9.09 -2.00 -0.93 114.58 121.53 1sqc h GLU 143 Ca 0.40 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.81 1sqc h GLU 143 Cb 0.49 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.59 1sqc h GLU 143 CO -0.16 0.00 0.00 1.63 0.05 0.00 0.00 179.01 180.53 1sqc n LYS 144 N -2.75 2.29 -4.53 1.06 5.02 -0.61 -4.86 118.16 113.78 1sqc n LYS 144 Ca -0.02 -1.99 -0.33 0.00 -2.02 0.00 0.00 58.31 53.95 1sqc n LYS 144 Cb 0.06 -1.46 -0.13 0.00 -0.02 0.00 0.00 35.03 33.49 1sqc n LYS 144 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1sqc s VAL 145 N -1.39 3.64 0.18 -0.18 1.01 -0.36 -5.08 120.40 118.23 1sqc s VAL 145 Ca 0.38 -0.45 -0.33 0.00 0.00 0.00 0.00 61.98 61.58 1sqc s VAL 145 Cb 0.20 -2.57 -0.15 0.00 0.00 0.00 0.00 36.38 33.87 1sqc s VAL 145 CO 0.28 0.51 1.31 -2.65 0.00 0.00 0.00 175.10 174.55 1sqc n PRO 146 N 3.41 1.55 -3.39 2.72 -0.02 -1.26 -4.95 135.00 133.06 1sqc n PRO 146 Ca -0.18 0.55 -0.38 0.00 -2.02 0.00 0.00 63.50 61.47 1sqc n PRO 146 Cb 0.53 -2.15 -0.06 0.00 -0.02 0.00 0.00 33.50 31.80 1sqc n PRO 146 CO 0.00 0.00 0.00 -1.64 1.98 0.00 0.00 175.50 175.84 1sqc s MET 147 N -0.14 4.06 -0.31 -0.52 -1.94 -1.26 -4.94 119.30 114.25 1sqc s MET 147 Ca 0.74 0.57 0.01 0.00 -1.71 0.00 0.00 55.69 55.30 1sqc s MET 147 Cb -0.78 -3.23 0.09 0.00 2.01 0.00 0.00 34.83 32.92 1sqc s MET 147 CO 0.49 0.66 0.05 0.08 -0.01 0.00 0.00 175.02 176.29 1sqc s VAL 148 N -1.07 1.51 0.39 -6.03 1.01 -1.26 -5.00 120.40 109.95 1sqc s VAL 148 Ca 0.26 -1.71 -0.25 0.00 0.00 0.00 0.00 61.98 60.29 1sqc s VAL 148 Cb -0.18 -2.06 -0.09 0.00 0.00 0.00 0.00 36.38 34.05 1sqc s VAL 148 CO 0.16 -0.54 1.10 -2.16 0.00 0.00 0.00 175.10 173.67 1sqc s PRO 149 N 1.31 4.14 0.32 2.72 0.04 -1.26 -4.22 135.00 138.04 1sqc s PRO 149 Ca 0.07 1.67 0.25 0.00 0.04 0.00 0.00 61.00 63.03 1sqc s PRO 149 Cb -0.18 -2.64 1.12 0.00 0.04 0.00 0.00 34.50 32.84 1sqc s PRO 149 CO -0.15 -0.20 1.76 -1.00 0.04 0.00 0.00 177.00 177.44 1sqc h PRO 150 N 2.64 0.00 0.00 0.56 0.13 -1.93 -2.40 132.00 131.00 1sqc h PRO 150 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1sqc h PRO 150 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1sqc h PRO 150 CO 0.63 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 178.79 1sqc n GLU 151 N -2.37 0.15 0.32 0.86 4.71 -1.26 -1.63 120.64 121.41 1sqc n GLU 151 Ca 0.01 0.47 0.19 0.00 -0.01 0.00 0.00 57.16 57.82 1sqc n GLU 151 Cb 0.19 -1.83 1.07 0.00 -1.01 0.00 0.00 31.44 29.86 1sqc n GLU 151 CO 0.00 0.00 0.00 0.97 0.09 0.00 0.00 177.13 178.19 1sqc h ILE 152 N 0.00 0.23 0.00 -3.67 2.10 -1.83 0.89 117.51 115.23 1sqc h ILE 152 Ca 0.00 0.00 -0.00 0.00 1.08 0.00 0.00 64.86 65.94 1sqc h ILE 152 Cb 0.23 0.98 -0.00 0.00 -1.09 0.00 0.00 36.82 36.94 1sqc h ILE 152 CO 0.00 0.00 -0.00 0.24 -1.08 0.00 0.00 178.15 177.31 1sqc h MET 153 N 0.00 0.00 0.00 2.19 2.86 -1.56 -2.67 114.93 115.76 1sqc h MET 153 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1sqc h MET 153 Cb 0.05 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.71 1sqc h MET 153 CO -0.00 0.00 -0.19 0.74 1.06 0.00 0.00 176.91 178.52 1sqc h PHE 154 N 0.00 0.00 -2.89 -0.22 0.04 -1.04 -3.46 116.94 109.36 1sqc h PHE 154 Ca -0.00 0.00 -0.53 0.00 2.80 0.00 0.00 57.97 60.24 1sqc h PHE 154 Cb 0.16 0.00 0.02 0.00 2.20 0.00 0.00 35.95 38.33 1sqc h PHE 154 CO 0.00 0.00 0.83 -0.51 -0.60 0.00 0.00 178.31 178.03 1sqc s LEU 155 N -5.37 4.36 0.71 1.54 1.43 -1.01 -5.01 118.68 115.33 1sqc s LEU 155 Ca 0.07 2.36 -0.11 0.00 -1.03 0.00 0.00 54.13 55.42 1sqc s LEU 155 Cb 0.09 -3.58 0.01 0.00 0.03 0.00 0.00 46.19 42.74 1sqc s LEU 155 CO 0.67 -0.74 1.07 -0.83 0.23 0.00 0.00 176.35 176.75 1sqc s GLY 156 N 1.52 1.64 0.28 -3.19 0.00 -1.26 -4.69 107.32 101.62 1sqc s GLY 156 Ca 0.67 -0.15 -0.07 0.00 0.00 0.00 0.00 44.72 45.17 1sqc s GLY 156 CO 0.30 0.19 1.54 0.28 0.00 0.00 0.00 173.10 175.41 1sqc n LYS 157 N -3.08 -0.09 0.11 2.90 5.02 -1.26 -0.87 118.16 120.89 1sqc n LYS 157 Ca 0.07 1.53 0.12 0.00 -2.02 0.00 0.00 58.31 58.01 1sqc n LYS 157 Cb 0.55 -2.31 0.05 0.00 -0.02 0.00 0.00 35.03 33.30 1sqc n LYS 157 CO 0.00 0.00 0.00 0.07 -0.52 0.00 0.00 177.40 176.95 1sqc h ARG 158 N 0.00 0.00 -7.06 1.97 -0.00 -2.01 -3.47 114.38 103.80 1sqc h ARG 158 Ca 0.49 0.00 -0.53 0.00 -0.00 0.00 0.00 59.98 59.94 1sqc h ARG 158 Cb 0.79 0.00 0.11 0.00 -0.00 0.00 0.00 29.97 30.87 1sqc h ARG 158 CO -1.01 0.00 0.53 -1.64 -0.00 0.00 0.00 179.97 177.85 1sqc s MET 159 N -3.31 3.19 0.65 0.08 -1.94 -0.05 -4.98 119.30 112.93 1sqc s MET 159 Ca 0.01 1.97 -0.16 0.00 -1.71 0.00 0.00 55.69 55.80 1sqc s MET 159 Cb 0.10 -2.15 -0.00 0.00 2.01 0.00 0.00 34.83 34.79 1sqc s MET 159 CO 0.77 -1.07 1.16 -1.25 -0.01 0.00 0.00 175.02 174.61 1sqc s PRO 160 N -3.04 2.73 0.00 2.03 0.04 -1.26 -3.51 135.00 131.99 1sqc s PRO 160 Ca 0.73 1.61 0.00 0.00 0.04 0.00 0.00 61.00 63.37 1sqc s PRO 160 Cb -0.34 -1.92 0.00 0.00 0.04 0.00 0.00 34.50 32.28 1sqc s PRO 160 CO 0.39 -1.34 0.00 1.28 0.04 0.00 0.00 177.00 177.36 1sqc n LEU 161 N -2.18 0.82 -4.77 -3.56 4.77 -1.26 -4.94 117.00 105.88 1sqc n LEU 161 Ca 0.12 0.00 -0.35 0.00 -0.03 0.00 0.00 56.01 55.75 1sqc n LEU 161 Cb 0.51 -1.81 0.02 0.00 -2.33 0.00 0.00 43.42 39.80 1sqc n LEU 161 CO 0.46 -0.67 0.79 0.54 -1.33 0.00 0.00 177.39 177.18 1sqc s ASN 162 N -2.06 5.43 0.56 -1.43 2.20 -1.23 -4.89 114.94 113.52 1sqc s ASN 162 Ca 0.00 2.21 0.33 0.00 -0.94 0.00 0.00 52.86 54.46 1sqc s ASN 162 Cb 0.00 -2.58 1.46 0.00 -2.00 0.00 0.00 41.25 38.13 1sqc s ASN 162 CO 0.00 -1.42 1.79 0.16 -2.94 0.00 0.00 177.10 174.69 1sqc h ILE 163 N 0.88 0.37 0.00 0.54 3.07 -1.84 -0.33 117.51 120.20 1sqc h ILE 163 Ca -0.50 0.00 0.00 0.00 1.55 0.00 0.00 64.86 65.91 1sqc h ILE 163 Cb 1.27 0.45 0.00 0.00 -0.27 0.00 0.00 36.82 38.27 1sqc h ILE 163 CO 0.56 0.00 0.00 -1.22 -1.05 0.00 0.00 178.15 176.44 1sqc n TYR 164 N -3.95 0.00 1.00 0.16 4.01 -1.26 -2.44 117.16 114.68 1sqc n TYR 164 Ca 0.19 0.00 0.11 0.00 -0.16 0.00 0.00 57.90 58.05 1sqc n TYR 164 Cb 1.07 0.00 0.04 0.00 -0.31 0.00 0.00 39.34 40.14 1sqc n TYR 164 CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 1sqc n GLU 165 N -0.60 1.63 -3.96 -0.72 1.02 -0.13 -4.93 120.64 112.94 1sqc n GLU 165 Ca 0.05 -1.35 -0.24 0.00 -0.02 0.00 0.00 57.16 55.60 1sqc n GLU 165 Cb 0.02 -1.47 -0.03 0.00 -0.02 0.00 0.00 31.44 29.94 1sqc n GLU 165 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 1sqc s PHE 166 N -2.30 3.45 0.61 -0.32 0.40 -1.02 -4.68 117.98 114.12 1sqc s PHE 166 Ca 0.22 0.06 -0.15 0.00 -0.60 0.00 0.00 56.93 56.45 1sqc s PHE 166 Cb 0.19 -1.62 -0.03 0.00 0.51 0.00 0.00 43.02 42.07 1sqc s PHE 166 CO 0.47 0.49 1.07 0.20 0.70 0.00 0.00 175.22 178.15 1sqc s GLY 167 N -3.51 2.13 0.07 4.36 0.00 0.14 -4.68 107.32 105.82 1sqc s GLY 167 Ca 0.34 0.43 -0.14 0.00 0.00 0.00 0.00 44.72 45.35 1sqc s GLY 167 CO 0.28 0.75 1.09 1.44 0.00 0.00 0.00 173.10 176.67 1sqc n SER 168 N -2.14 -0.47 -0.24 1.64 7.64 -1.26 -0.58 113.62 118.20 1sqc n SER 168 Ca 0.09 1.20 0.03 0.00 1.01 0.00 0.00 58.87 61.20 1sqc n SER 168 Cb 0.53 -0.30 0.13 0.00 -1.01 0.00 0.00 64.21 63.55 1sqc n SER 168 CO 0.00 0.00 0.00 4.11 -3.01 0.00 0.00 175.04 176.14 1sqc h TRP 169 N 0.00 -0.06 -0.26 1.43 0.09 -1.96 -1.36 115.95 113.84 1sqc h TRP 169 Ca 0.07 0.05 -0.16 0.00 0.09 0.00 0.00 58.89 58.95 1sqc h TRP 169 Cb 0.18 0.14 -0.01 0.00 0.08 0.00 0.00 29.16 29.55 1sqc h TRP 169 CO -0.84 -0.21 -0.48 0.00 0.09 0.00 0.00 178.44 176.99 1sqc h ALA 170 N 1.65 0.67 0.22 0.11 0.00 -1.53 -3.22 119.26 117.17 1sqc h ALA 170 Ca 0.38 -0.48 0.01 0.00 0.00 0.00 0.00 54.91 54.81 1sqc h ALA 170 Cb 0.64 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.30 1sqc h ALA 170 CO -0.62 0.67 -0.36 -0.09 0.00 0.00 0.00 179.25 178.85 1sqc h ARG 171 N 0.54 -0.64 -0.60 0.00 2.43 0.33 -0.12 114.38 116.33 1sqc h ARG 171 Ca 0.03 0.04 -0.06 0.00 -0.81 0.00 0.00 59.98 59.18 1sqc h ARG 171 Cb 1.04 0.14 -0.03 0.00 -0.42 0.00 0.00 29.97 30.71 1sqc h ARG 171 CO 0.10 -0.42 0.12 0.00 -1.51 0.00 0.00 179.97 178.26 1sqc h ALA 172 N -0.14 1.09 -0.87 2.80 0.00 -1.65 -2.57 119.26 117.92 1sqc h ALA 172 Ca 0.01 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.68 1sqc h ALA 172 Cb 0.65 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 18.16 1sqc h ALA 172 CO -0.15 0.60 0.53 1.15 0.00 0.00 0.00 179.25 181.38 1sqc h THR 173 N 0.90 1.24 0.38 0.00 2.02 -1.47 -1.16 112.91 114.82 1sqc h THR 173 Ca 0.19 -0.52 -0.02 0.00 0.77 0.00 0.00 66.41 66.83 1sqc h THR 173 Cb 0.36 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 66.77 1sqc h THR 173 CO 0.00 0.25 -0.18 0.58 0.37 0.00 0.00 175.52 176.54 1sqc h VAL 174 N 1.20 0.62 -0.38 3.16 2.07 -0.68 -0.07 116.25 122.17 1sqc h VAL 174 Ca 0.31 -0.38 0.08 0.00 0.82 0.00 0.00 66.70 67.54 1sqc h VAL 174 Cb -0.06 0.81 -0.07 0.00 -1.52 0.00 0.00 31.29 30.44 1sqc h VAL 174 CO -0.06 0.07 -0.11 0.58 0.02 0.00 0.00 177.57 178.07 1sqc h VAL 175 N -0.72 0.59 -0.57 2.57 2.07 -1.28 0.17 116.25 119.08 1sqc h VAL 175 Ca -0.05 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.42 1sqc h VAL 175 Cb 0.50 0.59 -0.02 0.00 -1.52 0.00 0.00 31.29 30.84 1sqc h VAL 175 CO 0.08 0.00 0.19 0.00 0.02 0.00 0.00 177.57 177.86 1sqc h ALA 176 N 1.35 0.75 -0.10 1.67 0.00 -1.22 -2.96 119.26 118.75 1sqc h ALA 176 Ca 0.19 -0.19 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 1sqc h ALA 176 Cb 0.30 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1sqc h ALA 176 CO -0.40 0.40 -0.32 -0.07 0.00 0.00 0.00 179.25 178.86 1sqc h LEU 177 N 0.80 0.20 -1.69 0.00 3.38 -0.11 -2.84 115.31 115.05 1sqc h LEU 177 Ca 0.18 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 1sqc h LEU 177 Cb 0.27 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 1sqc h LEU 177 CO -0.01 0.51 0.05 0.77 0.09 0.00 0.00 178.44 179.86 1sqc h SER 178 N 0.17 0.22 -0.14 -0.43 4.64 -0.52 0.15 113.55 117.65 1sqc h SER 178 Ca 0.02 -0.02 -0.15 0.00 -0.47 0.00 0.00 61.79 61.18 1sqc h SER 178 Cb 0.65 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.69 1sqc h SER 178 CO 0.05 0.23 -0.48 0.40 -0.87 0.00 0.00 176.83 176.16 1sqc h ILE 179 N 0.25 1.34 -0.07 0.95 2.04 -1.51 -1.92 117.51 118.60 1sqc h ILE 179 Ca 0.06 -1.76 -0.00 0.00 1.00 0.00 0.00 64.86 64.16 1sqc h ILE 179 Cb 0.09 2.05 -0.00 0.00 -0.74 0.00 0.00 36.82 38.21 1sqc h ILE 179 CO -0.00 0.54 0.03 0.58 0.00 0.00 0.00 178.15 179.29 1sqc h VAL 180 N 0.22 1.15 0.00 1.67 2.07 -1.30 -2.84 116.25 117.22 1sqc h VAL 180 Ca -0.02 -0.46 -0.03 0.00 0.82 0.00 0.00 66.70 67.01 1sqc h VAL 180 Cb 1.10 1.33 -0.00 0.00 -1.52 0.00 0.00 31.29 32.20 1sqc h VAL 180 CO 0.10 0.13 -0.15 0.24 0.02 0.00 0.00 177.57 177.92 1sqc h MET 181 N -0.06 0.00 0.00 1.57 2.86 -0.80 -1.56 114.93 116.94 1sqc h MET 181 Ca 0.02 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.66 1sqc h MET 181 Cb 0.19 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.85 1sqc h MET 181 CO -0.00 0.15 0.00 1.03 1.06 0.00 0.00 176.91 179.15 1sqc h SER 182 N 0.00 0.00 0.00 1.22 0.87 -1.10 -3.22 113.55 111.32 1sqc h SER 182 Ca -0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1sqc h SER 182 Cb 0.55 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.51 1sqc h SER 182 CO 0.02 0.00 -0.99 0.54 -0.53 0.00 0.00 176.83 175.87 1sqc n ARG 183 N -2.97 1.77 -4.09 2.24 5.12 -0.79 -5.05 116.66 112.90 1sqc n ARG 183 Ca 0.01 -0.05 -0.46 0.00 -1.93 0.00 0.00 57.85 55.42 1sqc n ARG 183 Cb 0.28 -1.06 0.02 0.00 -1.16 0.00 0.00 32.46 30.54 1sqc n ARG 183 CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 1sqc n GLN 184 N -1.56 -0.22 -1.70 5.56 6.02 -0.66 -4.92 117.38 119.91 1sqc n GLN 184 Ca -0.00 0.04 -0.31 0.00 -0.01 0.00 0.00 57.00 56.72 1sqc n GLN 184 Cb 0.17 -2.33 0.05 0.00 1.02 0.00 0.00 30.24 29.15 1sqc n GLN 184 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 1sqc s PRO 185 N -7.43 2.91 -0.05 -1.09 0.04 -1.26 -5.08 135.00 123.03 1sqc s PRO 185 Ca 0.48 0.74 -0.02 0.00 0.04 0.00 0.00 61.00 62.24 1sqc s PRO 185 Cb -0.27 -2.00 0.04 0.00 0.04 0.00 0.00 34.50 32.30 1sqc s PRO 185 CO 0.95 -1.07 0.10 0.08 0.04 0.00 0.00 177.00 177.10 1sqc s VAL 186 N -3.16 -0.13 -0.67 -0.36 1.01 -1.26 -4.58 120.40 111.25 1sqc s VAL 186 Ca 0.58 0.31 0.03 0.00 0.00 0.00 0.00 61.98 62.89 1sqc s VAL 186 Cb -0.13 -0.19 0.17 0.00 0.00 0.00 0.00 36.38 36.23 1sqc s VAL 186 CO 0.54 0.13 0.47 -0.36 0.00 0.00 0.00 175.10 175.88 1sqc s PHE 187 N 1.74 3.49 0.13 5.22 0.40 -0.21 -4.95 117.98 123.80 1sqc s PHE 187 Ca -0.02 -3.16 -0.35 0.00 -0.60 0.00 0.00 56.93 52.81 1sqc s PHE 187 Cb -0.12 -2.90 -0.16 0.00 0.51 0.00 0.00 43.02 40.35 1sqc s PHE 187 CO -0.04 -0.67 1.28 -2.30 0.70 0.00 0.00 175.22 174.19 1sqc n PRO 188 N 2.56 1.26 -2.04 0.24 -0.02 -1.26 -4.42 135.00 131.33 1sqc n PRO 188 Ca 0.14 0.45 -0.32 0.00 -2.02 0.00 0.00 63.50 61.75 1sqc n PRO 188 Cb 0.35 -2.04 0.00 0.00 -0.02 0.00 0.00 33.50 31.79 1sqc n PRO 188 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1sqc s LEU 189 N 0.57 3.43 0.56 2.45 1.43 -1.21 -5.00 118.68 120.90 1sqc s LEU 189 Ca 0.78 1.66 -0.19 0.00 -1.03 0.00 0.00 54.13 55.35 1sqc s LEU 189 Cb -0.88 -4.51 -0.05 0.00 0.03 0.00 0.00 46.19 40.78 1sqc s LEU 189 CO 0.49 -1.01 1.16 -2.16 0.23 0.00 0.00 176.35 175.05 1sqc s PRO 190 N -4.40 3.22 0.52 1.29 0.04 -1.26 -4.84 135.00 129.57 1sqc s PRO 190 Ca 0.60 1.68 0.37 0.00 0.04 0.00 0.00 61.00 63.70 1sqc s PRO 190 Cb -0.13 -1.98 1.54 0.00 0.04 0.00 0.00 34.50 33.97 1sqc s PRO 190 CO 0.41 -0.97 1.73 0.93 0.04 0.00 0.00 177.00 179.13 1sqc h GLU 191 N 1.08 0.05 0.00 4.56 5.08 -2.00 0.18 114.58 123.53 1sqc h GLU 191 Ca -0.50 -0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 57.81 1sqc h GLU 191 Cb 1.27 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.51 1sqc h GLU 191 CO 0.56 0.03 -0.23 -0.09 -1.00 0.00 0.00 179.01 178.29 1sqc h ARG 192 N 0.05 0.00 -0.38 2.33 2.43 -1.99 -3.21 114.38 113.60 1sqc h ARG 192 Ca 0.68 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.85 1sqc h ARG 192 Cb 2.58 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 32.13 1sqc h ARG 192 CO -0.08 0.23 0.00 0.00 -1.51 0.00 0.00 179.97 178.61 1sqc n ALA 193 N -2.22 2.39 -1.33 2.80 0.00 0.63 -4.96 120.51 117.82 1sqc n ALA 193 Ca 0.00 -1.01 -0.34 0.00 0.00 0.00 0.00 53.44 52.09 1sqc n ALA 193 Cb 0.43 -0.78 0.10 0.00 0.00 0.00 0.00 19.45 19.20 1sqc n ALA 193 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1sqc s ARG 194 N -1.34 2.09 -0.37 0.00 1.81 -1.20 -4.67 118.95 115.28 1sqc s ARG 194 Ca 0.36 1.74 0.14 0.00 -1.72 0.00 0.00 55.73 56.24 1sqc s ARG 194 Cb 0.21 -1.83 0.41 0.00 -0.45 0.00 0.00 34.95 33.29 1sqc s ARG 194 CO 0.29 -1.87 0.89 1.33 -0.68 0.00 0.00 175.30 175.26 1sqc n VAL 195 N -2.81 0.90 0.32 3.52 0.24 -1.26 -4.89 118.33 114.36 1sqc n VAL 195 Ca 0.13 -3.94 0.20 0.00 -2.04 0.00 0.00 64.34 58.69 1sqc n VAL 195 Cb 0.50 0.01 1.10 0.00 -1.47 0.00 0.00 33.84 33.99 1sqc n VAL 195 CO 0.00 0.00 0.00 1.55 -2.14 0.00 0.00 176.83 176.24 1sqc h PRO 196 N 2.95 0.00 0.00 7.34 0.13 -1.95 -2.08 132.00 138.39 1sqc h PRO 196 Ca 0.03 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.16 1sqc h PRO 196 Cb 1.03 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.16 1sqc h PRO 196 CO 0.56 0.00 0.00 1.05 -0.23 0.00 0.00 178.00 179.38 1sqc h GLU 197 N 0.00 0.00 0.00 0.86 9.09 -1.97 -0.59 114.58 121.96 1sqc h GLU 197 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 1sqc h GLU 197 Cb 0.03 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.13 1sqc h GLU 197 CO 0.00 0.00 0.00 1.28 0.05 0.00 0.00 179.01 180.34 1sqc n LEU 198 N -2.35 0.00 -0.07 3.06 4.77 -0.78 -2.97 117.00 118.66 1sqc n LEU 198 Ca -0.02 0.37 -0.13 0.00 -0.03 0.00 0.00 56.01 56.21 1sqc n LEU 198 Cb 0.04 -0.37 -0.14 0.00 -2.33 0.00 0.00 43.42 40.62 1sqc n LEU 198 CO 0.11 -0.08 -1.01 -1.22 -1.33 0.00 0.00 177.39 173.86 1sqc n TYR 199 N -1.37 0.40 -1.55 -1.77 4.01 -0.23 -1.13 117.16 115.52 1sqc n TYR 199 Ca 0.09 0.12 -0.25 0.00 -0.16 0.00 0.00 57.90 57.70 1sqc n TYR 199 Cb 0.22 -1.07 -0.06 0.00 -0.31 0.00 0.00 39.34 38.13 1sqc n TYR 199 CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 1sqc n GLU 200 N -3.03 0.75 -3.65 -0.72 1.02 -1.16 -4.87 120.64 108.99 1sqc n GLU 200 Ca -0.32 -0.40 -0.15 0.00 -0.02 0.00 0.00 57.16 56.27 1sqc n GLU 200 Cb 1.08 -3.44 -0.08 0.00 -0.02 0.00 0.00 31.44 28.99 1sqc n GLU 200 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1sqc s THR 201 N 13.03 0.01 -0.13 2.62 2.01 -1.26 -4.83 115.64 127.09 1sqc s THR 201 Ca 0.98 -0.10 0.17 0.00 0.31 0.00 0.00 61.69 63.05 1sqc s THR 201 Cb -0.21 -0.81 -0.25 0.00 0.01 0.00 0.00 72.50 71.24 1sqc s THR 201 CO 0.19 -0.05 0.17 -0.90 -0.69 0.00 0.00 174.62 173.34 1sqc n ASP 202 N 1.92 0.52 -4.71 3.53 5.75 -1.26 -4.95 116.55 117.35 1sqc n ASP 202 Ca -0.17 0.00 -0.42 0.00 -0.01 0.00 0.00 54.79 54.19 1sqc n ASP 202 Cb 0.56 1.22 -0.03 0.00 -1.03 0.00 0.00 41.12 41.85 1sqc n ASP 202 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1sqc s VAL 203 N -2.71 2.76 0.14 2.12 1.01 -1.26 -4.96 120.40 117.51 1sqc s VAL 203 Ca -0.08 0.51 -0.31 0.00 0.00 0.00 0.00 61.98 62.10 1sqc s VAL 203 Cb 0.07 -3.33 -0.09 0.00 0.00 0.00 0.00 36.38 33.04 1sqc s VAL 203 CO 0.76 0.03 1.44 -2.16 0.00 0.00 0.00 175.10 175.18 1sqc s PRO 204 N 1.36 4.29 -0.10 2.72 0.04 -1.26 -4.53 135.00 137.51 1sqc s PRO 204 Ca 0.70 2.17 -0.29 0.00 0.04 0.00 0.00 61.00 63.62 1sqc s PRO 204 Cb -0.42 -3.21 -0.06 0.00 0.04 0.00 0.00 34.50 30.85 1sqc s PRO 204 CO 0.31 -0.48 1.96 -1.25 0.04 0.00 0.00 177.00 177.59 1sqc s PRO 205 N 0.97 3.75 -0.64 0.56 0.04 -1.26 -4.69 135.00 133.72 1sqc s PRO 205 Ca 0.65 2.21 -0.23 0.00 0.04 0.00 0.00 61.00 63.67 1sqc s PRO 205 Cb -0.39 -4.20 0.06 0.00 0.04 0.00 0.00 34.50 30.02 1sqc s PRO 205 CO 0.32 -1.39 0.98 -0.98 0.04 0.00 0.00 177.00 175.96 1sqc s ARG 206 N 5.09 3.15 0.27 4.56 1.70 -1.26 -4.92 118.95 127.54 1sqc s ARG 206 Ca 0.88 -0.69 -0.29 0.00 -0.47 0.00 0.00 55.73 55.16 1sqc s ARG 206 Cb -0.35 -4.19 -0.09 0.00 -0.57 0.00 0.00 34.95 29.74 1sqc s ARG 206 CO 0.36 -1.77 0.99 1.03 -1.08 0.00 0.00 175.30 174.83 1sqc s ARG 207 N 4.13 4.74 -0.19 3.89 0.52 -1.26 -4.68 118.95 126.10 1sqc s ARG 207 Ca 0.24 1.56 -0.08 0.00 -0.52 0.00 0.00 55.73 56.93 1sqc s ARG 207 Cb -0.16 -3.17 -0.04 0.00 0.52 0.00 0.00 34.95 32.10 1sqc s ARG 207 CO 0.12 0.38 0.09 0.50 0.02 0.00 0.00 175.30 176.41 1sqc s ARG 208 N -1.40 4.05 0.00 3.54 3.52 -1.26 -5.10 118.95 122.29 1sqc s ARG 208 Ca 0.44 -0.30 0.00 0.00 -0.13 0.00 0.00 55.73 55.74 1sqc s ARG 208 Cb -0.27 -3.31 0.00 0.00 -1.56 0.00 0.00 34.95 29.82 1sqc s ARG 208 CO 0.33 0.26 0.00 0.41 -0.81 0.00 0.00 175.30 175.49 1sqc n GLY 209 N 3.60 0.03 3.50 8.12 0.00 -1.26 -4.96 105.19 114.22 1sqc n GLY 209 Ca -0.16 -1.77 -0.29 0.00 0.00 0.00 0.00 46.02 43.80 1sqc n GLY 209 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sqc s ALA 210 N -3.37 -0.22 -1.54 4.61 0.00 -1.26 -4.50 121.76 115.48 1sqc s ALA 210 Ca 0.00 -0.38 0.05 0.00 0.00 0.00 0.00 51.96 51.64 1sqc s ALA 210 Cb 0.00 -3.14 0.28 0.00 0.00 0.00 0.00 23.12 20.27 1sqc s ALA 210 CO 0.00 -3.79 0.97 1.63 0.00 0.00 0.00 175.76 174.57 1sqc n LYS 211 N -4.90 0.10 -2.69 0.00 4.76 -0.96 -3.43 118.16 111.03 1sqc n LYS 211 Ca 0.05 0.19 -0.06 0.00 -2.87 0.00 0.00 58.31 55.62 1sqc n LYS 211 Cb 0.56 -1.50 0.08 0.00 -1.84 0.00 0.00 35.03 32.33 1sqc n LYS 211 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1sqc n GLY 212 N -0.80 0.58 0.00 0.72 0.00 -1.16 -5.06 105.19 99.47 1sqc n GLY 212 Ca 0.03 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.01 1sqc n GLY 212 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sqc n GLY 213 N -0.43 -2.73 3.30 -0.02 0.00 -1.22 -4.88 105.19 99.21 1sqc n GLY 213 Ca -0.09 -1.30 -0.32 0.00 0.00 0.00 0.00 46.02 44.32 1sqc n GLY 213 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1sqc s GLY 214 N -2.89 1.33 0.21 -0.02 0.00 -1.26 -4.52 107.32 100.17 1sqc s GLY 214 Ca 0.00 -1.04 -0.19 0.00 0.00 0.00 0.00 44.72 43.49 1sqc s GLY 214 CO 0.00 -0.65 0.70 -0.32 0.00 0.00 0.00 173.10 172.83 1sqc s GLY 215 N -0.22 2.60 0.33 0.20 0.00 -1.26 -4.96 107.32 104.01 1sqc s GLY 215 Ca -0.02 0.13 0.25 0.00 0.00 0.00 0.00 44.72 45.08 1sqc s GLY 215 CO 0.03 0.48 1.74 0.11 0.00 0.00 0.00 173.10 175.46 1sqc h TRP 216 N 3.45 0.00 0.24 1.90 5.08 -1.99 -3.04 115.95 121.58 1sqc h TRP 216 Ca -0.48 0.00 -0.01 0.00 1.08 0.00 0.00 58.89 59.48 1sqc h TRP 216 Cb 1.19 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.36 1sqc h TRP 216 CO 0.64 0.00 -0.11 0.82 -1.28 0.00 0.00 178.44 178.51 1sqc h ILE 217 N 0.00 0.82 -0.83 0.12 2.04 -1.99 -0.19 117.51 117.47 1sqc h ILE 217 Ca 0.00 -0.71 0.03 0.00 1.00 0.00 0.00 64.86 65.18 1sqc h ILE 217 Cb 0.19 1.20 -0.05 0.00 -0.74 0.00 0.00 36.82 37.42 1sqc h ILE 217 CO 0.00 0.15 0.55 -0.26 0.00 0.00 0.00 178.15 178.58 1sqc h PHE 218 N -0.70 1.01 -0.34 1.37 0.04 -1.93 0.55 116.94 116.94 1sqc h PHE 218 Ca -0.03 0.02 0.04 0.00 2.80 0.00 0.00 57.97 60.80 1sqc h PHE 218 Cb 0.48 -0.34 -0.04 0.00 2.20 0.00 0.00 35.95 38.26 1sqc h PHE 218 CO 0.04 0.60 0.11 0.22 -0.60 0.00 0.00 178.31 178.67 1sqc h ASP 219 N 1.05 0.11 -0.05 2.17 3.58 -1.45 0.17 116.42 122.01 1sqc h ASP 219 Ca 0.32 0.04 -0.01 0.00 0.42 0.00 0.00 57.03 57.81 1sqc h ASP 219 Cb -0.00 0.03 -0.00 0.00 1.72 0.00 0.00 39.33 41.08 1sqc h ASP 219 CO -0.09 0.10 -0.00 0.00 -2.88 0.00 0.00 179.24 176.36 1sqc h ALA 220 N 1.23 0.06 -0.80 -0.78 0.00 0.36 -3.14 119.26 116.19 1sqc h ALA 220 Ca 0.16 -0.18 0.17 0.00 0.00 0.00 0.00 54.91 55.06 1sqc h ALA 220 Cb 0.14 -0.02 -0.11 0.00 0.00 0.00 0.00 17.79 17.81 1sqc h ALA 220 CO -0.17 -0.26 0.30 1.25 0.00 0.00 0.00 179.25 180.37 1sqc h LEU 221 N -0.23 0.24 -0.79 0.00 5.85 0.53 -1.20 115.31 119.72 1sqc h LEU 221 Ca 0.01 0.13 0.01 0.00 0.84 0.00 0.00 57.88 58.87 1sqc h LEU 221 Cb 0.35 0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.46 1sqc h LEU 221 CO 0.00 0.05 0.52 -0.78 -0.34 0.00 0.00 178.44 177.89 1sqc h ASP 222 N 0.40 0.89 -0.49 1.25 1.82 -0.63 0.53 116.42 120.20 1sqc h ASP 222 Ca 0.46 -0.02 -0.06 0.00 -0.39 0.00 0.00 57.03 57.01 1sqc h ASP 222 Cb 0.76 -0.22 -0.02 0.00 0.68 0.00 0.00 39.33 40.53 1sqc h ASP 222 CO -0.46 0.64 0.06 0.03 -1.61 0.00 0.00 179.24 177.90 1sqc h ARG 223 N 1.05 0.83 -0.59 0.28 3.08 -1.23 -1.29 114.38 116.51 1sqc h ARG 223 Ca 0.29 -0.24 0.00 0.00 0.07 0.00 0.00 59.98 60.11 1sqc h ARG 223 Cb -0.11 -0.09 -0.03 0.00 0.08 0.00 0.00 29.97 29.82 1sqc h ARG 223 CO -0.07 0.84 0.39 0.00 -1.07 0.00 0.00 179.97 180.06 1sqc h ALA 224 N 0.96 0.75 -0.56 0.04 0.00 -0.77 -1.21 119.26 118.47 1sqc h ALA 224 Ca 0.15 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.02 1sqc h ALA 224 Cb 0.43 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 1sqc h ALA 224 CO 0.01 0.20 0.37 -0.07 0.00 0.00 0.00 179.25 179.76 1sqc h LEU 225 N 0.80 0.63 -1.52 0.00 3.38 -0.54 0.77 115.31 118.83 1sqc h LEU 225 Ca 0.22 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 58.12 1sqc h LEU 225 Cb -0.08 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.51 1sqc h LEU 225 CO -0.05 0.45 -0.25 0.45 0.09 0.00 0.00 178.44 179.13 1sqc h HIS 226 N 0.74 0.00 -0.03 1.13 3.86 -0.84 -0.41 115.15 119.60 1sqc h HIS 226 Ca 0.21 0.00 -0.22 0.00 -1.16 0.00 0.00 60.37 59.19 1sqc h HIS 226 Cb -0.07 0.00 0.02 0.00 1.06 0.00 0.00 27.41 28.42 1sqc h HIS 226 CO -0.04 0.25 -0.86 0.78 0.86 0.00 0.00 177.93 178.92 1sqc h GLY 227 N 0.90 0.71 1.98 2.45 0.00 -0.29 -3.12 103.07 105.70 1sqc h GLY 227 Ca -0.00 -1.18 -0.04 0.00 0.00 0.00 0.00 47.33 46.11 1sqc h GLY 227 CO 0.03 1.05 -0.16 -1.82 0.00 0.00 0.00 176.54 175.64 1sqc h TYR 228 N 0.28 0.03 -0.10 5.60 3.20 -0.42 -1.63 116.97 123.92 1sqc h TYR 228 Ca -0.10 -0.00 -0.06 0.00 3.14 0.00 0.00 58.73 61.71 1sqc h TYR 228 Cb 1.52 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 39.77 1sqc h TYR 228 CO 0.11 0.18 -0.19 1.96 -1.64 0.00 0.00 178.16 178.59 1sqc h GLN 229 N 0.02 0.17 -0.01 1.82 1.08 -1.03 -2.85 115.11 114.32 1sqc h GLN 229 Ca 0.00 -0.04 0.00 0.00 -1.45 0.00 0.00 58.65 57.16 1sqc h GLN 229 Cb 0.30 -0.02 0.00 0.00 -0.05 0.00 0.00 27.48 27.71 1sqc h GLN 229 CO 0.02 0.36 -0.12 1.63 -0.95 0.00 0.00 178.83 179.77 1sqc n LYS 230 N -4.24 1.22 -1.92 1.46 5.02 -0.62 -4.91 118.16 114.17 1sqc n LYS 230 Ca -0.01 -0.68 -0.34 0.00 -2.02 0.00 0.00 58.31 55.26 1sqc n LYS 230 Cb 0.30 -1.49 0.03 0.00 -0.02 0.00 0.00 35.03 33.85 1sqc n LYS 230 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1sqc s LEU 231 N -2.25 3.51 0.44 -0.35 1.43 -1.08 -4.92 118.68 115.46 1sqc s LEU 231 Ca 0.32 2.08 0.20 0.00 -1.03 0.00 0.00 54.13 55.69 1sqc s LEU 231 Cb 0.20 -4.56 1.04 0.00 0.03 0.00 0.00 46.19 42.90 1sqc s LEU 231 CO 0.43 -1.51 1.93 -1.28 0.23 0.00 0.00 176.35 176.15 1sqc h SER 232 N 0.43 0.00 -4.89 2.29 0.87 -1.91 -3.44 113.55 106.90 1sqc h SER 232 Ca -0.48 0.00 -0.21 0.00 -1.23 0.00 0.00 61.79 59.88 1sqc h SER 232 Cb 1.25 0.00 -0.21 0.00 -0.44 0.00 0.00 62.40 63.00 1sqc h SER 232 CO 0.55 0.24 -0.71 0.68 -0.53 0.00 0.00 176.83 177.06 1sqc s VAL 233 N -4.14 0.25 -0.24 2.23 -7.23 -1.26 -5.13 120.40 104.89 1sqc s VAL 233 Ca -0.02 -0.95 -0.04 0.00 -1.81 0.00 0.00 61.98 59.16 1sqc s VAL 233 Cb 0.13 -0.37 0.09 0.00 0.56 0.00 0.00 36.38 36.79 1sqc s VAL 233 CO 0.66 -0.45 0.14 -1.00 -0.31 0.00 0.00 175.10 174.14 1sqc s HIS 234 N -1.40 0.13 0.37 2.82 0.09 -1.26 -5.07 115.29 110.97 1sqc s HIS 234 Ca -0.14 -0.48 -0.27 0.00 -0.00 0.00 0.00 55.06 54.17 1sqc s HIS 234 Cb -0.10 -0.72 -0.09 0.00 -0.00 0.00 0.00 32.58 31.67 1sqc s HIS 234 CO -0.01 -0.70 1.25 -1.25 -0.00 0.00 0.00 174.74 174.04 1sqc s PRO 235 N 2.16 4.16 0.00 8.40 0.04 -1.26 -3.13 135.00 145.37 1sqc s PRO 235 Ca 0.06 2.06 0.00 0.00 0.04 0.00 0.00 61.00 63.16 1sqc s PRO 235 Cb -0.16 -2.86 0.00 0.00 0.04 0.00 0.00 34.50 31.52 1sqc s PRO 235 CO -0.24 -0.30 0.00 1.19 0.04 0.00 0.00 177.00 177.69 1sqc n PHE 236 N 0.40 0.00 0.24 0.56 3.72 -1.26 -4.88 117.46 116.24 1sqc n PHE 236 Ca 0.02 0.00 -0.15 0.00 -0.05 0.00 0.00 57.45 57.28 1sqc n PHE 236 Cb 0.44 -1.19 -0.08 0.00 -0.94 0.00 0.00 39.48 37.70 1sqc n PHE 236 CO 0.00 0.00 0.00 -0.09 -0.05 0.00 0.00 176.76 176.62 1sqc h ARG 237 N 0.57 -0.59 -0.05 -1.08 9.65 -1.99 -1.95 114.38 118.94 1sqc h ARG 237 Ca 0.00 0.04 0.01 0.00 -1.10 0.00 0.00 59.98 58.93 1sqc h ARG 237 Cb 0.45 0.13 -0.00 0.00 -1.39 0.00 0.00 29.97 29.16 1sqc h ARG 237 CO 0.00 -0.30 0.05 -0.09 2.80 0.00 0.00 179.97 182.43 1sqc h ARG 238 N -0.84 0.00 -0.22 0.20 2.43 -1.90 -0.85 114.38 113.20 1sqc h ARG 238 Ca -0.06 0.00 -0.10 0.00 -0.81 0.00 0.00 59.98 59.01 1sqc h ARG 238 Cb 0.57 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.11 1sqc h ARG 238 CO 0.10 0.00 -0.25 0.00 -1.51 0.00 0.00 179.97 178.32 1sqc h ALA 239 N 1.94 0.33 -0.09 2.80 0.00 -1.89 -2.44 119.26 119.92 1sqc h ALA 239 Ca 0.02 -0.38 -0.08 0.00 0.00 0.00 0.00 54.91 54.47 1sqc h ALA 239 Cb 0.13 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1sqc h ALA 239 CO -0.00 0.30 -0.32 0.00 0.00 0.00 0.00 179.25 179.23 1sqc h ALA 240 N 0.65 1.30 -0.16 0.00 0.00 -0.41 -1.88 119.26 118.77 1sqc h ALA 240 Ca 0.03 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.60 1sqc h ALA 240 Cb 0.81 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 1sqc h ALA 240 CO 0.06 0.49 0.05 0.93 0.00 0.00 0.00 179.25 180.78 1sqc h GLU 241 N 0.14 0.24 -0.40 0.00 5.08 -1.18 -1.48 114.58 116.98 1sqc h GLU 241 Ca 0.02 -0.05 -0.05 0.00 -1.00 0.00 0.00 59.36 58.28 1sqc h GLU 241 Cb 0.65 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.84 1sqc h GLU 241 CO 0.05 0.36 0.06 0.82 -1.00 0.00 0.00 179.01 179.30 1sqc h ILE 242 N 0.07 1.20 -0.05 3.13 2.04 -1.21 0.17 117.51 122.86 1sqc h ILE 242 Ca 0.05 -0.75 0.01 0.00 1.00 0.00 0.00 64.86 65.17 1sqc h ILE 242 Cb 0.22 0.83 -0.01 0.00 -0.74 0.00 0.00 36.82 37.12 1sqc h ILE 242 CO -0.00 0.27 -0.03 0.03 0.00 0.00 0.00 178.15 178.42 1sqc h ARG 243 N 0.59 -0.02 -0.45 2.37 2.47 -1.00 0.27 114.38 118.61 1sqc h ARG 243 Ca 0.13 0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 58.85 1sqc h ARG 243 Cb 0.29 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 28.59 1sqc h ARG 243 CO 0.00 -0.01 0.25 0.00 0.56 0.00 0.00 179.97 180.77 1sqc h ALA 244 N 1.03 0.57 0.24 0.04 0.00 -0.71 -0.80 119.26 119.63 1sqc h ALA 244 Ca 0.03 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 1sqc h ALA 244 Cb 0.07 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1sqc h ALA 244 CO -0.07 0.09 -0.15 1.25 0.00 0.00 0.00 179.25 180.37 1sqc h LEU 245 N 0.59 -0.39 -0.44 0.00 5.85 -0.23 -2.21 115.31 118.47 1sqc h LEU 245 Ca 0.16 0.03 0.08 0.00 0.84 0.00 0.00 57.88 58.99 1sqc h LEU 245 Cb 0.04 0.12 -0.07 0.00 0.37 0.00 0.00 40.66 41.12 1sqc h LEU 245 CO -0.03 -0.25 0.02 0.44 -0.34 0.00 0.00 178.44 178.28 1sqc h ASP 246 N -0.39 -0.15 -0.75 1.25 3.32 -0.29 0.52 116.42 119.93 1sqc h ASP 246 Ca -0.02 0.10 0.13 0.00 0.02 0.00 0.00 57.03 57.26 1sqc h ASP 246 Cb 0.33 0.17 -0.09 0.00 0.22 0.00 0.00 39.33 39.96 1sqc h ASP 246 CO 0.02 -0.04 0.32 -0.25 -1.72 0.00 0.00 179.24 177.57 1sqc h TRP 247 N 0.13 0.56 -0.24 4.55 7.01 -0.96 0.13 115.95 127.12 1sqc h TRP 247 Ca 0.22 0.03 -0.13 0.00 2.11 0.00 0.00 58.89 61.13 1sqc h TRP 247 Cb 0.31 -0.13 -0.00 0.00 -2.10 0.00 0.00 29.16 27.24 1sqc h TRP 247 CO -0.27 0.10 -0.35 -0.07 -2.79 0.00 0.00 178.44 175.06 1sqc h LEU 248 N 0.49 0.73 -0.49 0.65 3.38 -0.64 -2.48 115.31 116.95 1sqc h LEU 248 Ca 0.41 -0.51 0.02 0.00 0.09 0.00 0.00 57.88 57.88 1sqc h LEU 248 Cb 0.58 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.10 1sqc h LEU 248 CO -0.37 1.10 0.31 -0.07 0.09 0.00 0.00 178.44 179.49 1sqc h LEU 249 N 0.39 0.51 -1.40 1.67 3.38 0.27 -2.32 115.31 117.81 1sqc h LEU 249 Ca 0.03 -0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.94 1sqc h LEU 249 Cb 0.94 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.56 1sqc h LEU 249 CO 0.08 0.36 -0.16 -0.33 0.09 0.00 0.00 178.44 178.49 1sqc h GLU 250 N 0.62 0.20 -0.73 1.13 5.08 -0.78 -3.17 114.58 116.92 1sqc h GLU 250 Ca 0.19 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 1sqc h GLU 250 Cb -0.02 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.20 1sqc h GLU 250 CO -0.07 0.37 0.00 0.54 -1.00 0.00 0.00 179.01 178.85 1sqc n ARG 251 N -4.26 2.88 -1.99 2.33 1.74 -0.92 -4.99 116.66 111.45 1sqc n ARG 251 Ca -0.01 -2.72 -0.41 0.00 -0.77 0.00 0.00 57.85 53.95 1sqc n ARG 251 Cb 0.28 -1.62 -0.01 0.00 -1.02 0.00 0.00 32.46 30.08 1sqc n ARG 251 CO 0.00 0.00 0.00 -1.14 -1.52 0.00 0.00 177.63 174.97 1sqc s GLN 252 N -1.12 4.26 0.58 5.56 0.74 -0.94 -4.71 119.66 124.03 1sqc s GLN 252 Ca 0.50 2.36 -0.11 0.00 0.05 0.00 0.00 55.36 58.15 1sqc s GLN 252 Cb 0.27 -3.03 -0.05 0.00 1.10 0.00 0.00 33.01 31.30 1sqc s GLN 252 CO 0.33 -0.33 0.99 0.00 -0.55 0.00 0.00 175.29 175.73 1sqc s ALA 253 N -1.10 3.13 0.41 1.58 0.00 -0.12 -4.96 121.76 120.70 1sqc s ALA 253 Ca 0.51 -0.09 0.13 0.00 0.00 0.00 0.00 51.96 52.51 1sqc s ALA 253 Cb -0.42 -3.03 0.97 0.00 0.00 0.00 0.00 23.12 20.64 1sqc s ALA 253 CO 0.57 -0.56 1.92 0.78 0.00 0.00 0.00 175.76 178.46 1sqc h GLY 254 N -0.01 0.83 1.15 0.00 0.00 -1.86 0.77 103.07 103.95 1sqc h GLY 254 Ca -0.45 -0.22 0.00 0.00 0.00 0.00 0.00 47.33 46.67 1sqc h GLY 254 CO 0.62 0.08 0.00 2.09 0.00 0.00 0.00 176.54 179.33 1sqc n ASP 255 N -4.50 0.00 0.00 0.19 5.68 -1.26 -4.87 116.55 111.79 1sqc n ASP 255 Ca 0.14 -0.68 0.00 0.00 -0.50 0.00 0.00 54.79 53.75 1sqc n ASP 255 Cb 0.48 -0.07 0.00 0.00 -1.14 0.00 0.00 41.12 40.38 1sqc n ASP 255 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1sqc n GLY 256 N 0.83 2.10 3.00 6.12 0.00 0.26 -4.33 105.19 113.17 1sqc n GLY 256 Ca 0.19 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.98 1sqc n GLY 256 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1sqc n SER 257 N 0.00 -0.31 -3.83 1.61 3.41 -1.26 -3.93 113.62 109.31 1sqc n SER 257 Ca 0.00 -1.31 -0.30 0.00 -0.26 0.00 0.00 58.87 57.00 1sqc n SER 257 Cb 0.00 -0.81 -0.15 0.00 -0.26 0.00 0.00 64.21 62.99 1sqc n SER 257 CO 0.00 0.00 0.00 0.26 -0.16 0.00 0.00 175.04 175.14 1sqc s TRP 258 N -3.16 2.29 0.00 7.33 0.51 -1.26 -0.94 118.94 123.70 1sqc s TRP 258 Ca 0.59 -2.03 0.00 0.00 -2.12 0.00 0.00 56.10 52.55 1sqc s TRP 258 Cb -0.02 -1.98 0.00 0.00 -0.81 0.00 0.00 33.47 30.66 1sqc s TRP 258 CO 0.42 -0.87 0.00 0.41 -0.51 0.00 0.00 176.95 176.40 1sqc n GLY 259 N 4.68 1.01 2.45 0.98 0.00 -1.26 -3.73 105.19 109.33 1sqc n GLY 259 Ca -0.02 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.88 1sqc n GLY 259 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sqc n GLY 260 N -2.00 1.24 3.23 -0.02 0.00 -1.26 -4.98 105.19 101.39 1sqc n GLY 260 Ca 0.00 -0.30 -0.20 0.00 0.00 0.00 0.00 46.02 45.52 1sqc n GLY 260 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1sqc s ILE 261 N -2.32 1.35 0.14 -0.61 -4.36 -1.24 -4.19 121.20 109.97 1sqc s ILE 261 Ca 0.00 -1.52 -0.13 0.00 -0.26 0.00 0.00 60.65 58.74 1sqc s ILE 261 Cb 0.00 -1.36 -0.01 0.00 1.25 0.00 0.00 42.46 42.34 1sqc s ILE 261 CO 0.00 -0.25 1.57 0.06 0.24 0.00 0.00 174.94 176.56 1sqc h GLN 262 N 3.94 0.79 0.01 0.37 -0.00 -1.62 -3.31 115.11 115.29 1sqc h GLN 262 Ca -0.42 -0.26 0.01 0.00 -0.00 0.00 0.00 58.65 57.98 1sqc h GLN 262 Cb 1.19 -0.07 -0.03 0.00 -0.00 0.00 0.00 27.48 28.58 1sqc h GLN 262 CO 0.44 0.87 -0.25 -1.35 -0.00 0.00 0.00 178.83 178.54 1sqc h PRO 263 N 0.63 -0.31 -0.31 0.06 0.11 -1.92 0.11 132.00 130.38 1sqc h PRO 263 Ca 0.12 0.02 -0.00 0.00 0.11 0.00 0.00 66.00 66.25 1sqc h PRO 263 Cb 0.53 0.07 -0.02 0.00 0.11 0.00 0.00 31.00 31.69 1sqc h PRO 263 CO 0.03 -0.20 0.19 -1.00 -0.21 0.00 0.00 178.00 176.80 1sqc h PRO 264 N -0.32 0.41 0.15 1.05 0.13 -1.83 -1.27 132.00 130.33 1sqc h PRO 264 Ca 0.00 -0.03 -0.01 0.00 -0.87 0.00 0.00 66.00 65.10 1sqc h PRO 264 Cb 0.34 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 31.38 1sqc h PRO 264 CO -0.16 0.28 -0.07 2.35 -0.23 0.00 0.00 178.00 180.16 1sqc h TRP 265 N 0.42 -0.19 -0.45 1.56 2.91 -1.52 0.19 115.95 118.86 1sqc h TRP 265 Ca 0.11 -0.00 -0.00 0.00 1.13 0.00 0.00 58.89 60.12 1sqc h TRP 265 Cb -0.02 0.06 -0.02 0.00 -0.51 0.00 0.00 29.16 28.67 1sqc h TRP 265 CO 0.00 -0.08 0.27 0.74 -1.03 0.00 0.00 178.44 178.34 1sqc h PHE 266 N -0.25 0.59 -0.21 2.65 -1.00 -0.25 -1.94 116.94 116.54 1sqc h PHE 266 Ca -0.02 -0.00 -0.13 0.00 2.81 0.00 0.00 57.97 60.63 1sqc h PHE 266 Cb 0.19 -0.19 -0.01 0.00 3.61 0.00 0.00 35.95 39.55 1sqc h PHE 266 CO -0.05 0.42 -0.40 1.88 -1.61 0.00 0.00 178.31 178.54 1sqc h TYR 267 N 0.60 0.59 -0.77 -0.55 0.05 -1.11 -2.53 116.97 113.25 1sqc h TYR 267 Ca 0.16 -0.17 -0.05 0.00 0.05 0.00 0.00 58.73 58.72 1sqc h TYR 267 Cb -0.01 -0.13 -0.03 0.00 1.01 0.00 0.00 36.73 37.57 1sqc h TYR 267 CO -0.03 0.83 0.28 0.00 -1.05 0.00 0.00 178.16 178.18 1sqc h ALA 268 N 1.15 1.03 -0.70 3.88 0.00 -0.36 0.13 119.26 124.40 1sqc h ALA 268 Ca 0.04 -0.21 -0.07 0.00 0.00 0.00 0.00 54.91 54.66 1sqc h ALA 268 Cb 0.88 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 18.35 1sqc h ALA 268 CO 0.08 0.67 0.15 -0.07 0.00 0.00 0.00 179.25 180.07 1sqc h LEU 269 N 1.13 1.08 -0.47 0.00 3.38 -1.19 -1.26 115.31 117.98 1sqc h LEU 269 Ca 0.25 -0.24 -0.07 0.00 0.09 0.00 0.00 57.88 57.91 1sqc h LEU 269 Cb 0.26 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 1sqc h LEU 269 CO -0.02 1.04 0.01 0.40 0.09 0.00 0.00 178.44 179.96 1sqc h ILE 270 N 1.07 1.26 -0.49 1.22 2.04 -0.99 -2.20 117.51 119.42 1sqc h ILE 270 Ca 0.22 -1.05 0.04 0.00 1.00 0.00 0.00 64.86 65.07 1sqc h ILE 270 Cb 0.40 1.01 -0.04 0.00 -0.74 0.00 0.00 36.82 37.45 1sqc h ILE 270 CO 0.01 0.37 0.25 0.00 0.00 0.00 0.00 178.15 178.78 1sqc h ALA 271 N 0.92 0.63 -0.19 1.87 0.00 -0.39 -1.90 119.26 120.20 1sqc h ALA 271 Ca 0.13 0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.98 1sqc h ALA 271 Cb 0.50 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 1sqc h ALA 271 CO 0.02 -0.09 -0.25 -0.07 0.00 0.00 0.00 179.25 178.87 1sqc h LEU 272 N 0.50 0.36 -0.25 0.00 3.38 -1.07 -2.72 115.31 115.50 1sqc h LEU 272 Ca 0.21 -0.11 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 1sqc h LEU 272 Cb 0.11 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 1sqc h LEU 272 CO -0.14 0.61 0.13 0.50 0.09 0.00 0.00 178.44 179.62 1sqc h LYS 273 N 0.32 0.36 -0.62 1.13 1.63 -0.79 -0.85 116.57 117.74 1sqc h LYS 273 Ca 0.05 -0.05 0.06 0.00 -0.85 0.00 0.00 60.65 59.86 1sqc h LYS 273 Cb 0.61 -0.07 -0.04 0.00 -0.60 0.00 0.00 32.23 32.14 1sqc h LYS 273 CO 0.04 0.35 0.41 0.82 -3.45 0.00 0.00 179.45 177.63 1sqc h ILE 274 N 0.28 1.01 -0.65 2.00 2.04 -1.13 -2.05 117.51 119.01 1sqc h ILE 274 Ca 0.09 -0.21 -0.36 0.00 1.00 0.00 0.00 64.86 65.37 1sqc h ILE 274 Cb 0.10 0.33 -0.20 0.00 -0.74 0.00 0.00 36.82 36.32 1sqc h ILE 274 CO -0.01 0.11 0.46 0.18 0.00 0.00 0.00 178.15 178.89 1sqc n LEU 275 N -4.47 5.76 -2.08 1.44 4.77 -0.97 -4.90 117.00 116.54 1sqc n LEU 275 Ca 0.09 -3.04 -0.06 0.00 -0.03 0.00 0.00 56.01 52.97 1sqc n LEU 275 Cb 0.23 -0.79 -0.01 0.00 -2.33 0.00 0.00 43.42 40.52 1sqc n LEU 275 CO 0.34 0.96 -0.07 0.47 -1.33 0.00 0.00 177.39 177.76 1sqc n ASP 276 N -0.47 -2.09 -2.61 -1.43 8.00 -0.77 -4.83 116.55 112.36 1sqc n ASP 276 Ca 0.40 0.29 -0.36 0.00 0.71 0.00 0.00 54.79 55.83 1sqc n ASP 276 Cb 1.12 -1.95 0.05 0.00 -0.02 0.00 0.00 41.12 40.32 1sqc n ASP 276 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 1sqc n MET 277 N -2.27 2.80 0.22 -1.24 2.81 -0.36 -4.54 117.12 114.54 1sqc n MET 277 Ca -0.06 -3.51 0.12 0.00 -1.81 0.00 0.00 57.70 52.43 1sqc n MET 277 Cb 0.44 -2.28 0.19 0.00 -0.71 0.00 0.00 33.22 30.86 1sqc n MET 277 CO 0.00 0.00 0.00 1.79 1.51 0.00 0.00 175.97 179.27 1sqc h THR 278 N 1.62 0.05 -0.62 2.03 1.35 -1.88 -3.00 112.91 112.45 1sqc h THR 278 Ca 0.56 -1.05 0.00 0.00 -0.55 0.00 0.00 66.41 65.38 1sqc h THR 278 Cb 0.47 2.00 0.00 0.00 -1.73 0.00 0.00 68.15 68.89 1sqc h THR 278 CO 1.44 0.03 0.00 0.00 -0.25 0.00 0.00 175.52 176.74 1sqc n GLN 279 N -3.11 2.61 -3.28 4.72 3.00 -1.26 -4.56 117.38 115.50 1sqc n GLN 279 Ca 0.04 -2.49 -0.38 0.00 -0.01 0.00 0.00 57.00 54.15 1sqc n GLN 279 Cb 0.53 -1.55 -0.06 0.00 0.00 0.00 0.00 30.24 29.17 1sqc n GLN 279 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.06 175.48 1sqc s HIS 280 N -1.17 3.66 0.26 1.08 2.46 -1.13 -4.98 115.29 115.47 1sqc s HIS 280 Ca 0.45 1.11 0.02 0.00 0.47 0.00 0.00 55.06 57.11 1sqc s HIS 280 Cb 0.24 -2.54 0.65 0.00 -0.13 0.00 0.00 32.58 30.80 1sqc s HIS 280 CO 0.32 0.37 1.29 -2.30 -2.47 0.00 0.00 174.74 171.96 1sqc n PRO 281 N 2.73 -0.07 -0.03 2.88 -0.02 -1.26 -0.89 135.00 138.34 1sqc n PRO 281 Ca -0.08 1.23 -0.11 0.00 -2.02 0.00 0.00 63.50 62.52 1sqc n PRO 281 Cb 0.51 -1.97 -0.05 0.00 -0.02 0.00 0.00 33.50 31.97 1sqc n PRO 281 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1sqc h ALA 282 N 1.65 0.19 0.16 3.55 0.00 -1.94 -0.91 119.26 121.97 1sqc h ALA 282 Ca 0.51 -0.07 0.01 0.00 0.00 0.00 0.00 54.91 55.35 1sqc h ALA 282 Cb 1.06 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.77 1sqc h ALA 282 CO -0.77 -0.25 -0.18 0.35 0.00 0.00 0.00 179.25 178.39 1sqc h PHE 283 N 0.12 -0.48 -0.11 0.00 3.04 -1.25 0.18 116.94 118.44 1sqc h PHE 283 Ca 0.05 0.00 0.05 0.00 3.98 0.00 0.00 57.97 62.05 1sqc h PHE 283 Cb 0.10 0.19 -0.06 0.00 2.56 0.00 0.00 35.95 38.75 1sqc h PHE 283 CO -0.03 -0.28 -0.31 0.82 -2.02 0.00 0.00 178.31 176.49 1sqc h ILE 284 N -0.39 0.31 -0.69 1.41 1.08 -1.31 0.30 117.51 118.21 1sqc h ILE 284 Ca 0.01 0.00 -0.03 0.00 -0.39 0.00 0.00 64.86 64.45 1sqc h ILE 284 Cb 0.38 0.31 -0.03 0.00 -3.07 0.00 0.00 36.82 34.40 1sqc h ILE 284 CO -0.06 0.00 0.32 0.50 -0.69 0.00 0.00 178.15 178.22 1sqc h LYS 285 N -0.39 0.99 -0.09 2.37 1.63 -1.06 -0.87 116.57 119.15 1sqc h LYS 285 Ca 0.09 -0.14 -0.00 0.00 -0.85 0.00 0.00 60.65 59.75 1sqc h LYS 285 Cb 0.53 -0.18 -0.00 0.00 -0.60 0.00 0.00 32.23 31.98 1sqc h LYS 285 CO -0.34 0.78 0.05 0.78 -3.45 0.00 0.00 179.45 177.27 1sqc h GLY 286 N 1.05 0.13 0.87 5.01 0.00 0.48 0.77 103.07 111.38 1sqc h GLY 286 Ca 0.24 -0.06 -0.01 0.00 0.00 0.00 0.00 47.33 47.51 1sqc h GLY 286 CO -0.03 0.05 -0.06 -0.25 0.00 0.00 0.00 176.54 176.26 1sqc h TRP 287 N 0.06 -0.15 0.00 5.60 2.91 -0.14 -3.05 115.95 121.18 1sqc h TRP 287 Ca 0.03 -0.00 -0.06 0.00 1.13 0.00 0.00 58.89 59.99 1sqc h TRP 287 Cb 0.06 0.05 -0.01 0.00 -0.51 0.00 0.00 29.16 28.75 1sqc h TRP 287 CO -0.05 0.02 -0.28 1.05 -1.03 0.00 0.00 178.44 178.15 1sqc h GLU 288 N -0.29 0.00 0.00 2.65 4.11 -1.14 -2.83 114.58 117.08 1sqc h GLU 288 Ca -0.02 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.40 1sqc h GLU 288 Cb 0.24 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.48 1sqc h GLU 288 CO 0.03 0.28 -0.06 0.78 0.07 0.00 0.00 179.01 180.11 1sqc h GLY 289 N 1.48 0.00 0.43 1.06 0.00 -0.73 -3.16 103.07 102.15 1sqc h GLY 289 Ca -0.00 0.00 0.14 0.00 0.00 0.00 0.00 47.33 47.47 1sqc h GLY 289 CO 0.04 0.00 0.61 1.41 0.00 0.00 0.00 176.54 178.60 1sqc h LEU 290 N 0.00 0.82 -1.02 3.11 3.38 -1.48 -2.71 115.31 117.41 1sqc h LEU 290 Ca -0.00 0.05 0.16 0.00 0.09 0.00 0.00 57.88 58.18 1sqc h LEU 290 Cb 0.36 -0.11 -0.10 0.00 0.09 0.00 0.00 40.66 40.91 1sqc h LEU 290 CO 0.01 0.41 0.62 -0.33 0.09 0.00 0.00 178.44 179.24 1sqc h GLU 291 N 0.86 0.85 -0.14 1.13 4.39 -1.77 -0.92 114.58 118.98 1sqc h GLU 291 Ca 0.50 -0.05 0.04 0.00 0.34 0.00 0.00 59.36 60.19 1sqc h GLU 291 Cb 0.63 -0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 29.08 1sqc h GLU 291 CO -0.26 0.56 0.14 1.25 -1.16 0.00 0.00 179.01 179.54 1sqc h LEU 292 N 0.87 0.00 0.00 1.33 5.85 -1.72 -1.54 115.31 120.11 1sqc h LEU 292 Ca 0.54 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.26 1sqc h LEU 292 Cb 0.70 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.73 1sqc h LEU 292 CO -0.32 0.00 -0.91 -1.22 -0.34 0.00 0.00 178.44 175.64 1sqc n TYR 293 N -3.98 0.55 -2.50 1.25 4.02 -0.36 -4.94 117.16 111.21 1sqc n TYR 293 Ca 0.01 0.16 -0.34 0.00 -0.01 0.00 0.00 57.90 57.72 1sqc n TYR 293 Cb 0.26 -0.66 -0.03 0.00 -0.02 0.00 0.00 39.34 38.89 1sqc n TYR 293 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 176.86 176.05 1sqc s GLY 294 N -3.88 2.40 -0.06 2.72 0.00 -0.58 -1.74 107.32 106.18 1sqc s GLY 294 Ca 0.03 0.51 0.01 0.00 0.00 0.00 0.00 44.72 45.27 1sqc s GLY 294 CO 0.77 0.82 -0.06 0.14 0.00 0.00 0.00 173.10 174.77 1sqc s VAL 295 N -2.13 0.71 -0.29 1.40 1.01 0.78 -4.96 120.40 116.92 1sqc s VAL 295 Ca 0.65 -0.19 -0.24 0.00 0.00 0.00 0.00 61.98 62.21 1sqc s VAL 295 Cb -0.15 -0.72 -0.00 0.00 0.00 0.00 0.00 36.38 35.51 1sqc s VAL 295 CO 0.22 0.27 0.79 -0.70 0.00 0.00 0.00 175.10 175.69 1sqc s GLU 296 N 1.08 4.03 0.15 2.72 2.56 -1.26 -1.09 118.70 126.88 1sqc s GLU 296 Ca -0.08 0.67 -0.24 0.00 0.00 0.00 0.00 54.97 55.32 1sqc s GLU 296 Cb -0.14 -3.70 -0.08 0.00 2.00 0.00 0.00 34.13 32.21 1sqc s GLU 296 CO -0.01 -0.63 0.74 -0.51 -0.56 0.00 0.00 175.26 174.29 1sqc s LEU 297 N 2.91 4.58 0.42 2.70 1.43 0.19 -4.97 118.68 125.94 1sqc s LEU 297 Ca 0.33 1.57 0.15 0.00 -1.03 0.00 0.00 54.13 55.15 1sqc s LEU 297 Cb -0.14 -3.22 1.03 0.00 0.03 0.00 0.00 46.19 43.89 1sqc s LEU 297 CO 0.11 0.22 1.90 -2.24 0.23 0.00 0.00 176.35 176.58 1sqc h ASP 298 N 4.37 0.42 0.00 2.29 2.03 -1.96 -0.49 116.42 123.08 1sqc h ASP 298 Ca -0.48 0.03 0.00 0.00 -0.73 0.00 0.00 57.03 55.85 1sqc h ASP 298 Cb 1.21 -0.06 0.00 0.00 -0.83 0.00 0.00 39.33 39.65 1sqc h ASP 298 CO 0.65 0.21 0.00 0.00 -1.03 0.00 0.00 179.24 179.08 1sqc n TYR 299 N -4.49 0.00 -0.30 4.15 0.18 -1.26 -4.80 117.16 110.64 1sqc n TYR 299 Ca 0.15 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.93 1sqc n TYR 299 Cb 0.55 0.00 0.00 0.00 -0.38 0.00 0.00 39.34 39.51 1sqc n TYR 299 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 1sqc n GLY 300 N 0.43 0.82 3.93 -7.48 0.00 -0.21 -5.05 105.19 97.63 1sqc n GLY 300 Ca 0.04 -0.25 -0.21 0.00 0.00 0.00 0.00 46.02 45.60 1sqc n GLY 300 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1sqc s GLY 301 N -2.23 2.09 -0.01 -0.02 0.00 -1.13 -4.42 107.32 101.59 1sqc s GLY 301 Ca 0.00 -1.79 0.01 0.00 0.00 0.00 0.00 44.72 42.94 1sqc s GLY 301 CO 0.00 -1.70 -0.03 0.86 0.00 0.00 0.00 173.10 172.23 1sqc s TRP 302 N -2.53 0.32 0.13 1.90 -0.00 -0.70 0.56 118.94 118.61 1sqc s TRP 302 Ca 0.49 -0.05 0.04 0.00 -0.00 0.00 0.00 56.10 56.58 1sqc s TRP 302 Cb -0.05 -0.25 -0.04 0.00 -0.00 0.00 0.00 33.47 33.13 1sqc s TRP 302 CO 0.29 -0.04 -0.09 0.00 -0.00 0.00 0.00 176.95 177.11 1sqc s MET 303 N 0.19 0.99 -0.08 5.86 0.23 -0.25 -4.56 119.30 121.69 1sqc s MET 303 Ca -0.02 -1.41 0.03 0.00 -1.03 0.00 0.00 55.69 53.27 1sqc s MET 303 Cb -0.04 -0.49 -0.02 0.00 -1.53 0.00 0.00 34.83 32.74 1sqc s MET 303 CO -0.00 0.05 -0.18 0.12 -2.03 0.00 0.00 175.02 172.98 1sqc s PHE 304 N -3.40 2.64 -0.35 3.16 2.19 -1.26 -0.15 117.98 120.81 1sqc s PHE 304 Ca 0.15 -0.50 -0.23 0.00 0.33 0.00 0.00 56.93 56.69 1sqc s PHE 304 Cb 0.03 -1.68 0.01 0.00 -1.31 0.00 0.00 43.02 40.07 1sqc s PHE 304 CO -0.01 -0.07 0.76 -0.65 1.83 0.00 0.00 175.22 177.08 1sqc s GLN 305 N -0.22 3.81 0.61 10.12 -0.21 -0.71 -4.82 119.66 128.24 1sqc s GLN 305 Ca -0.00 0.36 0.26 0.00 0.02 0.00 0.00 55.36 56.00 1sqc s GLN 305 Cb -0.13 -3.78 1.18 0.00 1.00 0.00 0.00 33.01 31.28 1sqc s GLN 305 CO 0.03 -0.78 1.61 0.00 -2.12 0.00 0.00 175.29 174.03 1sqc h ALA 306 N 8.37 2.37 -1.64 6.09 0.00 -1.92 -3.43 119.26 129.10 1sqc h ALA 306 Ca -0.25 -0.02 0.33 0.00 0.00 0.00 0.00 54.91 54.97 1sqc h ALA 306 Cb 1.10 0.04 -0.10 0.00 0.00 0.00 0.00 17.79 18.83 1sqc h ALA 306 CO 0.89 -1.08 0.85 0.45 0.00 0.00 0.00 179.25 180.36 1sqc s SER 307 N -4.30 -0.04 -0.02 0.00 0.15 -1.26 -1.79 113.70 106.43 1sqc s SER 307 Ca -0.03 -0.16 0.05 0.00 0.70 0.00 0.00 55.95 56.50 1sqc s SER 307 Cb 0.13 0.16 -0.01 0.00 -1.71 0.00 0.00 66.02 64.59 1sqc s SER 307 CO 0.45 -0.30 -0.17 0.27 1.20 0.00 0.00 173.24 174.69 1sqc s ILE 308 N -2.29 1.34 -0.42 6.45 -4.36 -1.26 -4.54 121.20 116.12 1sqc s ILE 308 Ca 0.18 -0.71 0.05 0.00 -0.26 0.00 0.00 60.65 59.91 1sqc s ILE 308 Cb 0.03 -1.13 0.49 0.00 1.25 0.00 0.00 42.46 43.11 1sqc s ILE 308 CO -0.03 0.38 1.60 -1.54 0.24 0.00 0.00 174.94 175.59 1sqc n SER 309 N 2.83 4.77 0.09 4.36 3.41 -1.26 -3.22 113.62 124.59 1sqc n SER 309 Ca -0.16 -3.77 -0.12 0.00 -0.26 0.00 0.00 58.87 54.56 1sqc n SER 309 Cb 0.54 -0.67 -0.05 0.00 -0.26 0.00 0.00 64.21 63.76 1sqc n SER 309 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 1sqc h PRO 310 N 1.62 -0.44 -1.00 4.33 0.13 -1.78 0.11 132.00 134.96 1sqc h PRO 310 Ca 0.42 0.03 0.06 0.00 -0.87 0.00 0.00 66.00 65.64 1sqc h PRO 310 Cb 1.51 0.10 -0.07 0.00 0.13 0.00 0.00 31.00 32.67 1sqc h PRO 310 CO 0.91 -0.29 0.65 0.28 -0.23 0.00 0.00 178.00 179.32 1sqc h VAL 311 N -0.46 1.11 0.43 1.56 2.07 -1.71 0.11 116.25 119.36 1sqc h VAL 311 Ca 0.04 -0.41 -0.02 0.00 0.82 0.00 0.00 66.70 67.13 1sqc h VAL 311 Cb 0.51 -0.19 0.00 0.00 -1.52 0.00 0.00 31.29 30.09 1sqc h VAL 311 CO -0.19 0.22 -0.21 -0.25 0.02 0.00 0.00 177.57 177.16 1sqc h TRP 312 N 1.20 -0.54 -0.20 1.57 2.91 -1.57 -1.12 115.95 118.20 1sqc h TRP 312 Ca 0.43 -0.01 0.06 0.00 1.13 0.00 0.00 58.89 60.49 1sqc h TRP 312 Cb 0.13 0.18 -0.06 0.00 -0.51 0.00 0.00 29.16 28.90 1sqc h TRP 312 CO -0.00 -0.23 -0.23 -0.44 -1.03 0.00 0.00 178.44 176.51 1sqc h ASP 313 N -0.84 -0.73 -0.65 2.65 3.32 -0.40 -1.38 116.42 118.40 1sqc h ASP 313 Ca -0.06 0.13 0.06 0.00 0.02 0.00 0.00 57.03 57.18 1sqc h ASP 313 Cb 0.56 0.34 -0.06 0.00 0.22 0.00 0.00 39.33 40.39 1sqc h ASP 313 CO 0.10 -0.27 0.34 0.74 -1.72 0.00 0.00 179.24 178.43 1sqc h THR 314 N -0.26 0.94 0.23 0.35 2.02 -0.82 -0.86 112.91 114.51 1sqc h THR 314 Ca 0.12 -0.22 0.00 0.00 0.77 0.00 0.00 66.41 67.09 1sqc h THR 314 Cb 0.44 0.25 -0.02 0.00 -1.74 0.00 0.00 68.15 67.08 1sqc h THR 314 CO -0.35 0.11 -0.25 1.23 0.37 0.00 0.00 175.52 176.64 1sqc h GLY 315 N 0.63 -0.54 0.98 2.16 0.00 -0.21 -2.75 103.07 103.34 1sqc h GLY 315 Ca 0.30 0.29 -0.00 0.00 0.00 0.00 0.00 47.33 47.91 1sqc h GLY 315 CO -0.20 -0.23 0.25 1.41 0.00 0.00 0.00 176.54 177.78 1sqc h LEU 316 N -0.52 0.50 -0.87 3.11 3.38 -0.97 -2.84 115.31 117.09 1sqc h LEU 316 Ca -0.00 -0.05 0.16 0.00 0.09 0.00 0.00 57.88 58.07 1sqc h LEU 316 Cb 0.49 -0.13 -0.10 0.00 0.09 0.00 0.00 40.66 41.02 1sqc h LEU 316 CO -0.07 0.41 0.45 0.00 0.09 0.00 0.00 178.44 179.32 1sqc h ALA 317 N 1.11 1.34 0.03 1.53 0.00 -1.07 0.14 119.26 122.33 1sqc h ALA 317 Ca 0.15 0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.15 1sqc h ALA 317 Cb -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1sqc h ALA 317 CO -0.03 -0.11 -0.01 0.28 0.00 0.00 0.00 179.25 179.38 1sqc h VAL 318 N 0.62 1.06 -0.56 0.00 2.07 -1.26 0.12 116.25 118.29 1sqc h VAL 318 Ca 0.48 -0.28 0.04 0.00 0.82 0.00 0.00 66.70 67.77 1sqc h VAL 318 Cb 0.72 1.24 -0.04 0.00 -1.52 0.00 0.00 31.29 31.69 1sqc h VAL 318 CO -0.38 0.07 0.31 -0.07 0.02 0.00 0.00 177.57 177.52 1sqc h LEU 319 N -0.16 0.47 0.44 2.57 3.38 -0.99 0.15 115.31 121.17 1sqc h LEU 319 Ca -0.00 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 1sqc h LEU 319 Cb 0.15 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.83 1sqc h LEU 319 CO 0.01 0.32 -0.21 0.00 0.09 0.00 0.00 178.44 178.65 1sqc h ALA 320 N 1.28 -0.59 -0.07 1.53 0.00 -0.65 -1.05 119.26 119.71 1sqc h ALA 320 Ca 0.24 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1sqc h ALA 320 Cb 0.11 0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 1sqc h ALA 320 CO -0.14 -0.80 0.01 -0.07 0.00 0.00 0.00 179.25 178.24 1sqc h LEU 321 N -0.64 0.08 -0.01 0.00 3.38 -0.32 0.27 115.31 118.07 1sqc h LEU 321 Ca -0.06 -0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.64 1sqc h LEU 321 Cb 0.48 -0.02 0.01 0.00 0.09 0.00 0.00 40.66 41.22 1sqc h LEU 321 CO 0.10 0.10 -1.10 0.03 0.09 0.00 0.00 178.44 177.66 1sqc h ARG 322 N 0.10 0.51 0.00 1.13 2.47 -0.56 -2.65 114.38 115.38 1sqc h ARG 322 Ca 0.02 -0.62 -0.12 0.00 -1.26 0.00 0.00 59.98 58.00 1sqc h ARG 322 Cb 0.06 0.20 -0.02 0.00 -1.65 0.00 0.00 29.97 28.56 1sqc h ARG 322 CO -0.00 1.25 -0.56 0.00 0.56 0.00 0.00 179.97 181.22 1sqc h ALA 323 N 0.52 1.01 -0.58 0.04 0.00 -0.61 -2.79 119.26 116.85 1sqc h ALA 323 Ca -0.13 -0.51 0.02 0.00 0.00 0.00 0.00 54.91 54.29 1sqc h ALA 323 Cb 1.77 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 19.44 1sqc h ALA 323 CO 0.20 0.70 0.38 0.00 0.00 0.00 0.00 179.25 180.53 1sqc h ALA 324 N 1.44 1.64 0.00 0.00 0.00 -0.41 -3.37 119.26 118.56 1sqc h ALA 324 Ca -0.01 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1sqc h ALA 324 Cb 1.03 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.60 1sqc h ALA 324 CO 0.07 0.31 0.00 0.41 0.00 0.00 0.00 179.25 180.05 1sqc n GLY 325 N -1.46 0.59 3.76 0.00 0.00 -1.05 -4.82 105.19 102.22 1sqc n GLY 325 Ca 0.06 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.70 1sqc n GLY 325 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1sqc s LEU 326 N 0.00 4.02 0.55 0.99 1.43 -1.01 -5.00 118.68 119.67 1sqc s LEU 326 Ca 0.00 2.70 -0.17 0.00 -1.03 0.00 0.00 54.13 55.63 1sqc s LEU 326 Cb 0.00 -4.10 -0.06 0.00 0.03 0.00 0.00 46.19 42.06 1sqc s LEU 326 CO 0.00 -1.20 1.05 -2.16 0.23 0.00 0.00 176.35 174.26 1sqc s PRO 327 N -2.61 3.53 0.43 1.29 0.04 -1.26 -4.62 135.00 131.80 1sqc s PRO 327 Ca 0.64 1.25 0.13 0.00 0.04 0.00 0.00 61.00 63.07 1sqc s PRO 327 Cb -0.39 -2.06 1.01 0.00 0.04 0.00 0.00 34.50 33.11 1sqc s PRO 327 CO 0.48 -0.64 1.98 0.00 0.04 0.00 0.00 177.00 178.86 1sqc h ALA 328 N 0.89 2.00 -0.33 8.56 0.00 -1.95 -2.23 119.26 126.20 1sqc h ALA 328 Ca -0.48 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1sqc h ALA 328 Cb 1.22 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.92 1sqc h ALA 328 CO 0.58 -0.13 0.00 -0.40 0.00 0.00 0.00 179.25 179.30 1sqc n ASP 329 N -4.47 2.24 -4.64 0.00 5.68 -1.26 -2.65 116.55 111.45 1sqc n ASP 329 Ca 0.10 -2.11 -0.45 0.00 -0.50 0.00 0.00 54.79 51.83 1sqc n ASP 329 Cb 0.36 -0.33 -0.04 0.00 -1.14 0.00 0.00 41.12 39.98 1sqc n ASP 329 CO 0.00 0.00 0.00 1.57 -1.33 0.00 0.00 177.20 177.44 1sqc n HIS 330 N 0.48 2.29 -0.61 2.11 -0.00 -0.84 -4.81 115.22 113.83 1sqc n HIS 330 Ca 0.12 -0.18 0.48 0.00 0.46 0.00 0.00 57.72 58.60 1sqc n HIS 330 Cb 0.40 -2.73 0.78 0.00 -0.12 0.00 0.00 29.99 28.32 1sqc n HIS 330 CO 0.00 0.00 0.00 0.38 0.46 0.00 0.00 176.34 177.18 1sqc h ASP 331 N 11.23 0.06 0.06 0.26 3.04 -1.91 0.33 116.42 129.48 1sqc h ASP 331 Ca -0.46 0.04 -0.22 0.00 -3.24 0.00 0.00 57.03 53.15 1sqc h ASP 331 Cb 1.25 0.04 0.02 0.00 -1.04 0.00 0.00 39.33 39.60 1sqc h ASP 331 CO 0.95 -0.06 -0.87 -0.09 -2.04 0.00 0.00 179.24 177.13 1sqc h ARG 332 N 0.01 0.49 0.00 4.15 9.65 -1.99 -2.64 114.38 124.06 1sqc h ARG 332 Ca 0.88 -0.61 -0.07 0.00 -1.10 0.00 0.00 59.98 59.09 1sqc h ARG 332 Cb 3.36 0.19 -0.01 0.00 -1.39 0.00 0.00 29.97 32.12 1sqc h ARG 332 CO -0.12 1.24 -0.34 -0.07 2.80 0.00 0.00 179.97 183.47 1sqc h LEU 333 N 0.03 0.00 -0.33 3.80 3.38 -0.80 -2.25 115.31 119.14 1sqc h LEU 333 Ca -0.13 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.79 1sqc h LEU 333 Cb 1.59 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.33 1sqc h LEU 333 CO 0.17 0.34 0.01 0.58 0.09 0.00 0.00 178.44 179.63 1sqc h VAL 334 N 0.00 1.25 -0.99 1.22 2.07 -1.02 0.97 116.25 119.74 1sqc h VAL 334 Ca -0.00 -0.94 0.12 0.00 0.82 0.00 0.00 66.70 66.70 1sqc h VAL 334 Cb 0.74 1.22 -0.08 0.00 -1.52 0.00 0.00 31.29 31.64 1sqc h VAL 334 CO 0.04 0.31 0.63 0.11 0.02 0.00 0.00 177.57 178.68 1sqc h LYS 335 N 0.38 0.94 -0.06 1.57 1.79 -1.04 -1.14 116.57 119.01 1sqc h LYS 335 Ca 0.09 -0.06 -0.04 0.00 -2.18 0.00 0.00 60.65 58.46 1sqc h LYS 335 Cb 0.43 -0.21 0.00 0.00 -1.58 0.00 0.00 32.23 30.87 1sqc h LYS 335 CO 0.02 0.62 -0.13 0.00 -1.08 0.00 0.00 179.45 178.87 1sqc h ALA 336 N 1.55 0.09 -0.74 3.86 0.00 -1.01 -2.78 119.26 120.23 1sqc h ALA 336 Ca 0.49 -0.35 0.02 0.00 0.00 0.00 0.00 54.91 55.08 1sqc h ALA 336 Cb 0.52 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.25 1sqc h ALA 336 CO -0.26 -0.01 0.49 0.78 0.00 0.00 0.00 179.25 180.25 1sqc h GLY 337 N -0.31 1.03 0.92 0.00 0.00 -0.32 0.03 103.07 104.42 1sqc h GLY 337 Ca -0.00 -0.37 -0.00 0.00 0.00 0.00 0.00 47.33 46.96 1sqc h GLY 337 CO 0.03 0.34 0.01 0.83 0.00 0.00 0.00 176.54 177.75 1sqc h GLU 338 N 0.95 0.02 0.09 4.80 4.39 -1.25 -1.95 114.58 121.63 1sqc h GLU 338 Ca 0.28 -0.00 0.01 0.00 0.34 0.00 0.00 59.36 59.99 1sqc h GLU 338 Cb -0.02 -0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.60 1sqc h GLU 338 CO -0.07 0.10 -0.13 2.35 -1.16 0.00 0.00 179.01 180.09 1sqc h TRP 339 N -0.06 -0.35 -0.74 4.33 7.01 -1.15 -2.84 115.95 122.15 1sqc h TRP 339 Ca 0.01 0.01 0.13 0.00 2.11 0.00 0.00 58.89 61.14 1sqc h TRP 339 Cb 0.08 0.14 -0.09 0.00 -2.10 0.00 0.00 29.16 27.20 1sqc h TRP 339 CO -0.05 -0.20 0.32 -0.07 -2.79 0.00 0.00 178.44 175.65 1sqc h LEU 340 N -0.27 0.34 -0.70 0.65 3.38 -0.88 -2.02 115.31 115.82 1sqc h LEU 340 Ca 0.02 0.09 0.06 0.00 0.09 0.00 0.00 57.88 58.14 1sqc h LEU 340 Cb 0.28 0.05 -0.05 0.00 0.09 0.00 0.00 40.66 41.03 1sqc h LEU 340 CO -0.07 0.15 0.40 -0.07 0.09 0.00 0.00 178.44 178.95 1sqc h LEU 341 N 0.49 0.61 -2.13 1.67 3.38 -1.11 -1.66 115.31 116.57 1sqc h LEU 341 Ca 0.40 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.38 1sqc h LEU 341 Cb 0.56 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.20 1sqc h LEU 341 CO -0.36 0.40 -0.06 0.44 0.09 0.00 0.00 178.44 178.95 1sqc h ASP 342 N 0.74 0.00 0.71 -0.43 3.32 -1.26 -2.51 116.42 117.00 1sqc h ASP 342 Ca 0.31 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.36 1sqc h ASP 342 Cb 0.16 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.71 1sqc h ASP 342 CO -0.17 0.06 0.00 0.54 -1.72 0.00 0.00 179.24 177.95 1sqc n ARG 343 N -3.41 0.26 -2.07 3.56 3.00 -0.62 -4.89 116.66 112.49 1sqc n ARG 343 Ca -0.02 0.01 -0.42 0.00 -0.01 0.00 0.00 57.85 57.41 1sqc n ARG 343 Cb 0.20 -1.50 -0.03 0.00 0.00 0.00 0.00 32.46 31.13 1sqc n ARG 343 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.63 176.49 1sqc s GLN 344 N -2.73 4.25 0.09 5.56 0.74 -0.95 -4.68 119.66 121.93 1sqc s GLN 344 Ca 0.23 2.16 -0.30 0.00 0.05 0.00 0.00 55.36 57.50 1sqc s GLN 344 Cb 0.19 -3.49 -0.06 0.00 1.10 0.00 0.00 33.01 30.75 1sqc s GLN 344 CO 0.47 -0.62 1.10 0.42 -0.55 0.00 0.00 175.29 176.11 1sqc s ILE 345 N 2.17 4.22 -0.11 -2.34 1.09 -0.72 -4.96 121.20 120.55 1sqc s ILE 345 Ca 0.68 1.70 0.14 0.00 -1.10 0.00 0.00 60.65 62.08 1sqc s ILE 345 Cb -0.37 -4.09 0.31 0.00 -1.06 0.00 0.00 42.46 37.25 1sqc s ILE 345 CO 0.30 0.20 1.15 0.35 -0.10 0.00 0.00 174.94 176.83 1sqc n THR 346 N 3.33 1.36 -4.16 2.92 -2.24 -1.26 -2.89 114.28 111.33 1sqc n THR 346 Ca 0.06 -2.01 -0.13 0.00 -2.27 0.00 0.00 64.05 59.70 1sqc n THR 346 Cb 0.48 0.10 -0.11 0.00 -2.10 0.00 0.00 70.33 68.69 1sqc n THR 346 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 1sqc s VAL 347 N -2.03 0.82 0.56 2.28 -7.23 -1.26 -4.87 120.40 108.66 1sqc s VAL 347 Ca 0.29 -1.65 -0.19 0.00 -1.81 0.00 0.00 61.98 58.61 1sqc s VAL 347 Cb 0.28 -1.35 -0.05 0.00 0.56 0.00 0.00 36.38 35.82 1sqc s VAL 347 CO -0.04 -0.62 1.15 -2.84 -0.31 0.00 0.00 175.10 172.44 1sqc s PRO 348 N -2.93 3.25 0.00 4.82 0.02 -1.26 -4.83 135.00 134.07 1sqc s PRO 348 Ca 0.05 1.68 0.00 0.00 0.02 0.00 0.00 61.00 62.75 1sqc s PRO 348 Cb -0.02 -1.99 0.00 0.00 0.02 0.00 0.00 34.50 32.51 1sqc s PRO 348 CO -0.01 -0.94 0.00 0.41 -0.33 0.00 0.00 177.00 176.12 1sqc n GLY 349 N 0.27 4.84 0.19 0.52 0.00 -1.26 -4.83 105.19 104.92 1sqc n GLY 349 Ca 0.12 -1.89 0.13 0.00 0.00 0.00 0.00 46.02 44.39 1sqc n GLY 349 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1sqc h ASP 350 N 0.00 0.00 0.74 1.61 5.19 -1.93 -0.51 116.42 121.52 1sqc h ASP 350 Ca 0.00 0.00 -0.14 0.00 -0.62 0.00 0.00 57.03 56.27 1sqc h ASP 350 Cb 0.00 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 39.49 1sqc h ASP 350 CO 0.00 0.00 -0.66 4.11 -3.12 0.00 0.00 179.24 179.57 1sqc h TRP 351 N 0.00 0.00 0.00 4.55 5.08 -1.84 -3.01 115.95 120.73 1sqc h TRP 351 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.97 1sqc h TRP 351 Cb 0.12 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.28 1sqc h TRP 351 CO 0.00 0.66 0.00 0.00 -1.28 0.00 0.00 178.44 177.82 1sqc h ALA 352 N 1.34 1.00 0.00 0.11 0.00 -1.33 -0.56 119.26 119.82 1sqc h ALA 352 Ca -0.01 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1sqc h ALA 352 Cb 1.21 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.00 1sqc h ALA 352 CO 0.09 0.00 -0.07 0.28 0.00 0.00 0.00 179.25 179.55 1sqc h VAL 353 N 0.00 0.45 0.00 0.00 2.07 -1.67 -1.52 116.25 115.58 1sqc h VAL 353 Ca 0.00 -0.34 0.00 0.00 0.82 0.00 0.00 66.70 67.18 1sqc h VAL 353 Cb 0.07 1.23 0.00 0.00 -1.52 0.00 0.00 31.29 31.07 1sqc h VAL 353 CO 0.00 0.07 -1.57 0.29 0.02 0.00 0.00 177.57 176.37 1sqc n LYS 354 N -3.58 0.67 -3.24 1.57 4.01 -0.25 -4.76 118.16 112.59 1sqc n LYS 354 Ca -0.02 -0.12 -0.25 0.00 -0.51 0.00 0.00 58.31 57.41 1sqc n LYS 354 Cb 0.18 -1.35 -0.07 0.00 -0.51 0.00 0.00 35.03 33.28 1sqc n LYS 354 CO 0.00 0.00 0.00 0.54 -1.11 0.00 0.00 177.40 176.83 1sqc n ARG 355 N -1.95 0.84 0.26 1.97 5.12 -0.88 -4.98 116.66 117.05 1sqc n ARG 355 Ca -0.02 -3.37 0.10 0.00 -1.93 0.00 0.00 57.85 52.63 1sqc n ARG 355 Cb 0.38 -1.37 0.69 0.00 -1.16 0.00 0.00 32.46 31.01 1sqc n ARG 355 CO 0.00 0.00 0.00 -1.35 -1.93 0.00 0.00 177.63 174.35 1sqc h PRO 356 N 4.20 0.00 0.00 5.56 0.11 -1.59 -2.57 132.00 137.70 1sqc h PRO 356 Ca 0.10 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.21 1sqc h PRO 356 Cb 0.86 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.97 1sqc h PRO 356 CO 0.49 0.07 -0.73 0.09 -0.21 0.00 0.00 178.00 177.71 1sqc n ASN 357 N -4.15 0.70 -4.66 -2.05 4.13 -1.26 -4.89 115.26 103.07 1sqc n ASN 357 Ca -0.03 -0.54 -0.43 0.00 1.68 0.00 0.00 54.58 55.27 1sqc n ASN 357 Cb 0.15 0.58 -0.02 0.00 -1.54 0.00 0.00 39.78 38.95 1sqc n ASN 357 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 1sqc s LEU 358 N -3.06 4.22 0.00 3.41 2.96 -0.97 -4.99 118.68 120.25 1sqc s LEU 358 Ca 0.09 1.80 -0.30 0.00 -0.22 0.00 0.00 54.13 55.50 1sqc s LEU 358 Cb 0.17 -3.54 -0.05 0.00 0.50 0.00 0.00 46.19 43.27 1sqc s LEU 358 CO 0.77 -0.76 1.26 -0.54 -1.32 0.00 0.00 176.35 175.77 1sqc s LYS 359 N 3.36 4.35 0.77 1.98 -0.14 -1.26 -5.00 119.74 123.80 1sqc s LYS 359 Ca 0.58 1.80 -0.14 0.00 -1.36 0.00 0.00 55.97 56.85 1sqc s LYS 359 Cb -0.24 -3.49 0.06 0.00 -1.68 0.00 0.00 37.83 32.48 1sqc s LYS 359 CO 0.18 -0.43 1.22 -1.25 -0.76 0.00 0.00 175.35 174.31 1sqc s PRO 360 N 1.89 1.85 0.00 -1.68 0.04 -1.26 -4.61 135.00 131.22 1sqc s PRO 360 Ca 0.59 1.80 0.00 0.00 0.04 0.00 0.00 61.00 63.44 1sqc s PRO 360 Cb -0.28 -1.79 0.00 0.00 0.04 0.00 0.00 34.50 32.46 1sqc s PRO 360 CO 0.26 -2.07 0.00 0.41 0.04 0.00 0.00 177.00 175.64 1sqc n GLY 361 N 0.53 0.00 1.30 0.56 0.00 -1.14 -4.81 105.19 101.63 1sqc n GLY 361 Ca 0.14 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.06 1sqc n GLY 361 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sqc n GLY 362 N 0.00 -0.87 2.98 -0.02 0.00 -1.24 -3.74 105.19 102.31 1sqc n GLY 362 Ca 0.00 -1.74 -0.15 0.00 0.00 0.00 0.00 46.02 44.13 1sqc n GLY 362 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1sqc s PHE 363 N -1.76 0.50 0.26 1.61 0.08 -1.26 -1.76 117.98 115.65 1sqc s PHE 363 Ca 0.25 -0.20 0.07 0.00 0.12 0.00 0.00 56.93 57.17 1sqc s PHE 363 Cb -0.01 -0.32 -0.03 0.00 -0.57 0.00 0.00 43.02 42.09 1sqc s PHE 363 CO 0.17 -0.03 0.26 0.00 -0.10 0.00 0.00 175.22 175.52 1sqc s ALA 364 N -0.46 3.73 0.03 5.36 0.00 -1.26 -2.02 121.76 127.13 1sqc s ALA 364 Ca -0.01 -1.41 -0.26 0.00 0.00 0.00 0.00 51.96 50.28 1sqc s ALA 364 Cb -0.04 -1.40 -0.17 0.00 0.00 0.00 0.00 23.12 21.51 1sqc s ALA 364 CO -0.00 0.20 1.40 0.35 0.00 0.00 0.00 175.76 177.72 1sqc h PHE 365 N 1.36 -0.29 -1.96 0.00 3.57 -1.89 -3.43 116.94 114.31 1sqc h PHE 365 Ca -0.49 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.01 1sqc h PHE 365 Cb 1.24 0.09 0.00 0.00 2.79 0.00 0.00 35.95 40.07 1sqc h PHE 365 CO 0.52 -0.00 0.00 0.00 -2.23 0.00 0.00 178.31 176.60 1sqc n GLN 366 N -5.12 0.60 -0.02 1.11 0.00 -1.20 -2.45 117.38 110.31 1sqc n GLN 366 Ca -0.09 0.00 -0.13 0.00 0.00 0.00 0.00 57.00 56.78 1sqc n GLN 366 Cb 0.22 0.00 -0.10 0.00 0.00 0.00 0.00 30.24 30.36 1sqc n GLN 366 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.06 177.80 1sqc h PHE 367 N -0.52 -0.03 -2.64 2.61 0.04 -1.89 -3.41 116.94 111.10 1sqc h PHE 367 Ca 0.00 -0.00 -0.58 0.00 2.80 0.00 0.00 57.97 60.19 1sqc h PHE 367 Cb 0.00 0.01 -0.39 0.00 2.20 0.00 0.00 35.95 37.77 1sqc h PHE 367 CO 0.00 0.59 -0.83 0.34 -0.60 0.00 0.00 178.31 177.80 1sqc s ASP 368 N -5.80 3.07 -0.39 2.17 2.15 -1.26 -5.00 116.67 111.60 1sqc s ASP 368 Ca -0.16 -2.13 0.08 0.00 0.43 0.00 0.00 52.55 50.77 1sqc s ASP 368 Cb 0.00 -0.44 0.25 0.00 -0.30 0.00 0.00 42.92 42.43 1sqc s ASP 368 CO 0.65 -0.32 0.53 -3.20 -0.17 0.00 0.00 175.17 172.66 1sqc n ASN 369 N 4.12 0.24 0.24 -0.34 5.15 -1.26 -3.28 115.26 120.13 1sqc n ASN 369 Ca 0.10 -2.71 0.14 0.00 -0.60 0.00 0.00 54.58 51.51 1sqc n ASN 369 Cb 0.37 -0.64 0.78 0.00 -0.53 0.00 0.00 39.78 39.77 1sqc n ASN 369 CO 0.00 0.00 0.00 -0.37 1.40 0.00 0.00 177.26 178.29 1sqc h VAL 370 N 1.99 0.69 -0.00 3.44 -1.51 -1.95 -2.86 116.25 116.05 1sqc h VAL 370 Ca 0.07 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.54 1sqc h VAL 370 Cb 0.88 0.94 0.00 0.00 -2.13 0.00 0.00 31.29 30.98 1sqc h VAL 370 CO 0.47 0.00 -0.39 -1.22 -1.23 0.00 0.00 177.57 175.19 1sqc n TYR 371 N -4.12 0.00 -3.17 5.19 4.01 -1.26 -4.55 117.16 113.26 1sqc n TYR 371 Ca -0.01 0.00 -0.24 0.00 -0.16 0.00 0.00 57.90 57.50 1sqc n TYR 371 Cb 0.19 -0.25 -0.05 0.00 -0.31 0.00 0.00 39.34 38.92 1sqc n TYR 371 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 1sqc n TYR 372 N -1.33 1.85 -2.67 -0.72 4.01 -1.08 -3.21 117.16 114.01 1sqc n TYR 372 Ca 0.07 -3.88 -0.34 0.00 -0.16 0.00 0.00 57.90 53.59 1sqc n TYR 372 Cb 0.33 -0.45 -0.05 0.00 -0.31 0.00 0.00 39.34 38.86 1sqc n TYR 372 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 1sqc s PRO 373 N -2.45 4.01 0.08 -0.72 0.04 -1.26 -4.71 135.00 129.99 1sqc s PRO 373 Ca 0.41 1.26 0.10 0.00 0.04 0.00 0.00 61.00 62.82 1sqc s PRO 373 Cb 0.25 -2.16 -0.03 0.00 0.04 0.00 0.00 34.50 32.60 1sqc s PRO 373 CO -0.09 -0.24 -0.26 0.16 0.04 0.00 0.00 177.00 176.61 1sqc s ASP 374 N -2.04 3.28 0.25 6.66 -4.77 -0.86 -4.63 116.67 114.55 1sqc s ASP 374 Ca 0.64 -0.65 -0.06 0.00 -3.30 0.00 0.00 52.55 49.18 1sqc s ASP 374 Cb -0.13 -0.28 0.25 0.00 -1.09 0.00 0.00 42.92 41.66 1sqc s ASP 374 CO 0.17 0.22 1.92 0.58 0.70 0.00 0.00 175.17 178.77 1sqc h VAL 375 N 4.05 1.26 -0.48 2.11 2.07 -1.04 -2.58 116.25 121.63 1sqc h VAL 375 Ca -0.49 -0.47 0.07 0.00 0.82 0.00 0.00 66.70 66.63 1sqc h VAL 375 Cb 1.16 -0.19 -0.06 0.00 -1.52 0.00 0.00 31.29 30.68 1sqc h VAL 375 CO 0.42 0.25 0.15 -0.78 0.02 0.00 0.00 177.57 177.63 1sqc h ASP 376 N 1.34 0.14 0.61 0.57 3.58 -1.84 0.33 116.42 121.15 1sqc h ASP 376 Ca 0.36 0.06 -0.03 0.00 0.42 0.00 0.00 57.03 57.84 1sqc h ASP 376 Cb -0.14 0.06 0.01 0.00 1.72 0.00 0.00 39.33 40.97 1sqc h ASP 376 CO -0.08 0.11 -0.29 0.44 -2.88 0.00 0.00 179.24 176.54 1sqc h ASP 377 N 0.32 -0.69 -0.54 2.28 3.32 -1.79 -2.79 116.42 116.53 1sqc h ASP 377 Ca 0.23 -0.03 0.11 0.00 0.02 0.00 0.00 57.03 57.37 1sqc h ASP 377 Cb 0.26 0.18 -0.10 0.00 0.22 0.00 0.00 39.33 39.89 1sqc h ASP 377 CO -0.25 -0.37 -0.07 0.74 -1.72 0.00 0.00 179.24 177.57 1sqc h THR 378 N -1.02 0.50 -0.79 0.35 2.02 -1.13 0.14 112.91 112.98 1sqc h THR 378 Ca -0.08 -0.02 0.06 0.00 0.77 0.00 0.00 66.41 67.14 1sqc h THR 378 Cb 0.68 0.45 -0.06 0.00 -1.74 0.00 0.00 68.15 67.48 1sqc h THR 378 CO 0.14 0.01 0.48 0.00 0.37 0.00 0.00 175.52 176.51 1sqc h ALA 379 N 1.52 1.08 -0.05 6.16 0.00 -0.39 0.29 119.26 127.87 1sqc h ALA 379 Ca 0.27 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.16 1sqc h ALA 379 Cb 0.42 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 1sqc h ALA 379 CO -0.52 0.20 -0.04 0.28 0.00 0.00 0.00 179.25 179.17 1sqc h VAL 380 N 0.87 1.36 -0.83 0.00 2.07 -0.85 -2.49 116.25 116.39 1sqc h VAL 380 Ca 0.35 -1.14 -0.03 0.00 0.82 0.00 0.00 66.70 66.70 1sqc h VAL 380 Cb 0.18 2.01 -0.04 0.00 -1.52 0.00 0.00 31.29 31.93 1sqc h VAL 380 CO -0.18 0.31 0.39 0.58 0.02 0.00 0.00 177.57 178.70 1sqc h VAL 381 N -0.32 1.26 0.15 2.57 2.07 -0.44 0.31 116.25 121.85 1sqc h VAL 381 Ca 0.01 -0.72 -0.01 0.00 0.82 0.00 0.00 66.70 66.80 1sqc h VAL 381 Cb 0.52 0.20 0.00 0.00 -1.52 0.00 0.00 31.29 30.49 1sqc h VAL 381 CO 0.01 0.31 -0.07 0.58 0.02 0.00 0.00 177.57 178.41 1sqc h VAL 382 N 1.18 0.98 -0.15 2.57 2.07 -0.49 -0.67 116.25 121.73 1sqc h VAL 382 Ca 0.28 -0.61 0.05 0.00 0.82 0.00 0.00 66.70 67.24 1sqc h VAL 382 Cb 0.12 1.35 -0.06 0.00 -1.52 0.00 0.00 31.29 31.17 1sqc h VAL 382 CO -0.04 0.14 -0.30 -0.25 0.02 0.00 0.00 177.57 177.14 1sqc h TRP 383 N -0.50 -0.83 -0.61 1.57 7.01 -1.13 0.08 115.95 121.54 1sqc h TRP 383 Ca -0.02 0.04 0.10 0.00 2.11 0.00 0.00 58.89 61.12 1sqc h TRP 383 Cb 0.39 0.39 -0.08 0.00 -2.10 0.00 0.00 29.16 27.76 1sqc h TRP 383 CO 0.02 -0.38 0.21 0.00 -2.79 0.00 0.00 178.44 175.50 1sqc h ALA 384 N 0.49 0.78 -0.89 2.65 0.00 -0.37 -0.19 119.26 121.73 1sqc h ALA 384 Ca 0.10 0.09 0.02 0.00 0.00 0.00 0.00 54.91 55.12 1sqc h ALA 384 Cb 0.53 0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.35 1sqc h ALA 384 CO -0.36 -0.21 0.59 -0.07 0.00 0.00 0.00 179.25 179.20 1sqc h LEU 385 N 0.38 1.01 -2.21 0.00 3.38 0.15 -2.14 115.31 115.90 1sqc h LEU 385 Ca 0.31 -0.02 0.03 0.00 0.09 0.00 0.00 57.88 58.29 1sqc h LEU 385 Cb 0.40 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.90 1sqc h LEU 385 CO -0.33 0.72 0.10 -1.13 0.09 0.00 0.00 178.44 177.90 1sqc h ASN 386 N 1.19 0.00 0.51 -0.43 -1.24 0.85 -2.09 115.58 114.37 1sqc h ASN 386 Ca 0.33 0.00 -0.22 0.00 0.71 0.00 0.00 56.30 57.13 1sqc h ASN 386 Cb -0.10 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 38.95 1sqc h ASN 386 CO -0.08 0.00 -0.95 0.71 -1.29 0.00 0.00 177.43 175.82 1sqc h THR 387 N 0.00 1.47 -4.29 -3.57 1.35 -1.20 -3.47 112.91 103.20 1sqc h THR 387 Ca 0.05 -2.64 -0.50 0.00 -0.55 0.00 0.00 66.41 62.77 1sqc h THR 387 Cb 0.25 2.52 0.11 0.00 -1.73 0.00 0.00 68.15 69.30 1sqc h THR 387 CO -0.00 0.77 0.34 -0.76 -0.25 0.00 0.00 175.52 175.62 1sqc s LEU 388 N -7.48 2.85 -0.41 3.87 1.43 -0.79 -4.65 118.68 113.50 1sqc s LEU 388 Ca -0.04 1.53 0.02 0.00 -1.03 0.00 0.00 54.13 54.61 1sqc s LEU 388 Cb 0.09 -4.25 0.12 0.00 0.03 0.00 0.00 46.19 42.18 1sqc s LEU 388 CO 0.85 -1.83 0.19 -0.60 0.23 0.00 0.00 176.35 175.20 1sqc s ARG 389 N -5.05 1.29 0.21 1.70 6.06 -1.08 -4.99 118.95 117.09 1sqc s ARG 389 Ca 0.60 -1.90 -0.01 0.00 -2.50 0.00 0.00 55.73 51.93 1sqc s ARG 389 Cb -0.15 -2.50 -0.04 0.00 0.06 0.00 0.00 34.95 32.32 1sqc s ARG 389 CO 0.55 -1.10 0.40 -0.51 -2.50 0.00 0.00 175.30 172.14 1sqc s LEU 390 N 0.57 4.22 0.13 -0.88 1.43 -1.26 -4.37 118.68 118.51 1sqc s LEU 390 Ca 0.15 0.40 -0.31 0.00 -1.03 0.00 0.00 54.13 53.34 1sqc s LEU 390 Cb -0.23 -3.17 -0.09 0.00 0.03 0.00 0.00 46.19 42.73 1sqc s LEU 390 CO -0.05 -0.06 1.57 -0.65 0.23 0.00 0.00 176.35 177.38 1sqc h PRO 391 N 1.92 -0.51 -3.73 1.29 0.11 -2.00 -3.23 132.00 125.86 1sqc h PRO 391 Ca -0.48 0.04 -0.78 0.00 0.11 0.00 0.00 66.00 64.89 1sqc h PRO 391 Cb 1.19 0.12 -0.23 0.00 0.11 0.00 0.00 31.00 32.19 1sqc h PRO 391 CO 0.67 -0.34 1.09 -0.40 -0.21 0.00 0.00 178.00 178.82 1sqc n ASP 392 N -5.44 5.57 0.00 -2.05 5.75 -1.26 -4.79 116.55 114.32 1sqc n ASP 392 Ca -0.05 -3.12 0.03 0.00 -0.01 0.00 0.00 54.79 51.64 1sqc n ASP 392 Cb 0.37 -1.43 0.17 0.00 -1.03 0.00 0.00 41.12 39.20 1sqc n ASP 392 CO 0.00 0.00 0.00 -1.84 -0.11 0.00 0.00 177.20 175.25 1sqc n GLU 393 N 3.41 0.16 -0.02 0.11 -0.00 -1.22 -1.15 120.64 121.93 1sqc n GLU 393 Ca 0.31 0.06 -0.13 0.00 -0.00 0.00 0.00 57.16 57.40 1sqc n GLU 393 Cb 0.38 -1.50 -0.10 0.00 -0.00 0.00 0.00 31.44 30.22 1sqc n GLU 393 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.13 177.04 1sqc h ARG 394 N 0.00 0.02 -0.00 3.44 9.65 -1.92 -1.16 114.38 124.41 1sqc h ARG 394 Ca 0.00 -0.01 -0.19 0.00 -1.10 0.00 0.00 59.98 58.68 1sqc h ARG 394 Cb 0.01 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 28.58 1sqc h ARG 394 CO 0.00 0.52 -0.84 -0.09 2.80 0.00 0.00 179.97 182.36 1sqc h ARG 395 N -0.47 0.18 0.35 0.20 2.43 -1.55 -2.68 114.38 112.83 1sqc h ARG 395 Ca 0.00 -0.18 -0.02 0.00 -0.81 0.00 0.00 59.98 58.97 1sqc h ARG 395 Cb 0.51 0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.12 1sqc h ARG 395 CO 0.00 0.91 -0.17 -0.09 -1.51 0.00 0.00 179.97 179.12 1sqc h ARG 396 N 0.10 -0.46 -0.70 0.20 2.43 -1.46 0.15 114.38 114.64 1sqc h ARG 396 Ca -0.04 0.03 0.02 0.00 -0.81 0.00 0.00 59.98 59.18 1sqc h ARG 396 Cb 1.45 0.10 -0.04 0.00 -0.42 0.00 0.00 29.97 31.07 1sqc h ARG 396 CO 0.13 -0.18 0.45 -0.09 -1.51 0.00 0.00 179.97 178.77 1sqc h ARG 397 N -0.71 0.89 0.04 0.20 2.43 -1.30 -1.07 114.38 114.85 1sqc h ARG 397 Ca -0.05 -0.05 -0.00 0.00 -0.81 0.00 0.00 59.98 59.07 1sqc h ARG 397 Cb 0.49 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 29.84 1sqc h ARG 397 CO 0.08 0.59 -0.02 0.22 -1.51 0.00 0.00 179.97 179.33 1sqc h ASP 398 N 0.91 -0.04 -0.49 -3.80 1.82 -1.41 0.33 116.42 113.74 1sqc h ASP 398 Ca 0.27 -0.01 -0.00 0.00 -0.39 0.00 0.00 57.03 56.89 1sqc h ASP 398 Cb -0.06 0.01 -0.02 0.00 0.68 0.00 0.00 39.33 39.94 1sqc h ASP 398 CO -0.08 -0.02 0.29 0.00 -1.61 0.00 0.00 179.24 177.83 1sqc h ALA 399 N 0.90 0.62 -0.14 -0.78 0.00 -0.47 -0.35 119.26 119.04 1sqc h ALA 399 Ca -0.01 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1sqc h ALA 399 Cb 0.05 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1sqc h ALA 399 CO 0.01 0.11 0.09 0.52 0.00 0.00 0.00 179.25 179.98 1sqc h MET 400 N 0.65 0.19 -0.14 0.00 2.86 -1.02 0.22 114.93 117.68 1sqc h MET 400 Ca 0.17 -0.01 0.04 0.00 -2.06 0.00 0.00 59.70 57.84 1sqc h MET 400 Cb -0.01 -0.04 -0.04 0.00 0.06 0.00 0.00 31.60 31.57 1sqc h MET 400 CO -0.03 0.13 -0.12 1.15 1.06 0.00 0.00 176.91 179.10 1sqc h THR 401 N 0.19 0.65 -0.45 2.22 2.02 -0.63 0.38 112.91 117.29 1sqc h THR 401 Ca 0.05 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.26 1sqc h THR 401 Cb -0.01 0.65 -0.03 0.00 -1.74 0.00 0.00 68.15 67.02 1sqc h THR 401 CO -0.01 0.00 0.25 0.11 0.37 0.00 0.00 175.52 176.24 1sqc h LYS 402 N -0.14 0.48 -0.21 6.66 1.57 -0.84 -1.90 116.57 122.20 1sqc h LYS 402 Ca 0.09 -0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 58.82 1sqc h LYS 402 Cb 0.27 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.47 1sqc h LYS 402 CO -0.23 0.32 0.04 0.78 -0.57 0.00 0.00 179.45 179.79 1sqc h GLY 403 N 0.50 0.37 0.13 3.86 0.00 -0.40 -2.32 103.07 105.20 1sqc h GLY 403 Ca 0.19 -0.24 0.03 0.00 0.00 0.00 0.00 47.33 47.31 1sqc h GLY 403 CO -0.11 0.22 -0.43 -2.75 0.00 0.00 0.00 176.54 173.47 1sqc h PHE 404 N 0.15 -1.22 -0.14 5.60 3.04 -0.01 -0.64 116.94 123.72 1sqc h PHE 404 Ca 0.06 0.04 -0.02 0.00 3.98 0.00 0.00 57.97 62.04 1sqc h PHE 404 Cb 0.29 0.54 -0.01 0.00 2.56 0.00 0.00 35.95 39.33 1sqc h PHE 404 CO 0.02 -0.50 0.01 0.00 -2.02 0.00 0.00 178.31 175.82 1sqc h ARG 405 N -0.58 0.19 -0.17 1.11 3.08 -1.38 -1.73 114.38 114.91 1sqc h ARG 405 Ca 0.05 -0.02 -0.03 0.00 0.07 0.00 0.00 59.98 60.05 1sqc h ARG 405 Cb 0.66 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.66 1sqc h ARG 405 CO -0.33 0.20 0.01 2.35 -1.07 0.00 0.00 179.97 181.13 1sqc h TRP 406 N 0.19 0.33 -0.04 3.04 7.01 -0.69 -1.37 115.95 124.42 1sqc h TRP 406 Ca 0.05 -0.05 0.02 0.00 2.11 0.00 0.00 58.89 61.01 1sqc h TRP 406 Cb 0.11 -0.09 -0.02 0.00 -2.10 0.00 0.00 29.16 27.06 1sqc h TRP 406 CO 0.00 0.50 -0.07 0.82 -2.79 0.00 0.00 178.44 176.90 1sqc h ILE 407 N 0.06 0.82 -0.63 2.65 2.04 -0.64 -1.96 117.51 119.85 1sqc h ILE 407 Ca 0.05 0.00 0.10 0.00 1.00 0.00 0.00 64.86 66.01 1sqc h ILE 407 Cb 0.36 0.82 -0.07 0.00 -0.74 0.00 0.00 36.82 37.18 1sqc h ILE 407 CO 0.01 0.00 0.25 0.58 0.00 0.00 0.00 178.15 178.99 1sqc h VAL 408 N -0.09 0.77 0.00 1.67 2.07 -1.28 -0.02 116.25 119.37 1sqc h VAL 408 Ca 0.04 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 67.41 1sqc h VAL 408 Cb 0.15 0.30 0.00 0.00 -1.52 0.00 0.00 31.29 30.22 1sqc h VAL 408 CO -0.10 0.08 0.00 1.23 0.02 0.00 0.00 177.57 178.80 1sqc h GLY 409 N 0.44 0.00 0.80 2.17 0.00 -0.74 -2.70 103.07 103.04 1sqc h GLY 409 Ca 0.32 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.65 1sqc h GLY 409 CO -0.31 0.00 -0.45 1.03 0.00 0.00 0.00 176.54 176.81 1sqc n MET 410 N -2.30 0.20 -1.61 4.80 2.00 -0.03 -4.95 117.12 115.23 1sqc n MET 410 Ca 0.02 -0.12 -0.43 0.00 0.00 0.00 0.00 57.70 57.17 1sqc n MET 410 Cb 0.21 -1.50 -0.00 0.00 0.00 0.00 0.00 33.22 31.94 1sqc n MET 410 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 175.97 176.91 1sqc n GLN 411 N -1.30 1.43 -2.81 0.03 7.27 -1.02 -4.65 117.38 116.33 1sqc n GLN 411 Ca 0.07 0.51 -0.21 0.00 0.07 0.00 0.00 57.00 57.44 1sqc n GLN 411 Cb 0.34 -1.98 0.03 0.00 2.41 0.00 0.00 30.24 31.03 1sqc n GLN 411 CO 0.00 0.00 0.00 -1.12 0.07 0.00 0.00 177.06 176.01 1sqc s SER 412 N -0.62 5.50 0.32 1.69 0.01 -0.59 -4.88 113.70 115.14 1sqc s SER 412 Ca 0.60 0.02 0.09 0.00 1.31 0.00 0.00 55.95 57.98 1sqc s SER 412 Cb -0.62 -1.05 0.87 0.00 0.21 0.00 0.00 66.02 65.43 1sqc s SER 412 CO 0.59 -0.95 1.75 0.28 0.41 0.00 0.00 173.24 175.31 1sqc h SER 413 N 0.25 0.69 -0.02 2.44 0.02 -1.94 -1.93 113.55 113.07 1sqc h SER 413 Ca -0.43 0.12 0.00 0.00 -0.84 0.00 0.00 61.79 60.64 1sqc h SER 413 Cb 1.28 0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.83 1sqc h SER 413 CO 0.53 0.15 0.00 -0.46 -1.14 0.00 0.00 176.83 175.91 1sqc n ASN 414 N -4.83 0.43 0.00 3.07 0.23 -1.26 -4.90 115.26 108.00 1sqc n ASN 414 Ca 0.26 -1.23 0.00 0.00 -0.53 0.00 0.00 54.58 53.07 1sqc n ASN 414 Cb 0.71 -0.01 0.00 0.00 -2.08 0.00 0.00 39.78 38.40 1sqc n ASN 414 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1sqc n GLY 415 N 1.00 0.70 3.60 4.83 0.00 -0.72 -4.50 105.19 110.10 1sqc n GLY 415 Ca 0.20 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.95 1sqc n GLY 415 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1sqc s GLY 416 N -1.47 2.44 -0.02 -0.02 0.00 -1.26 -3.20 107.32 103.79 1sqc s GLY 416 Ca 0.00 -2.27 0.03 0.00 0.00 0.00 0.00 44.72 42.48 1sqc s GLY 416 CO 0.00 -2.08 -0.08 -0.98 0.00 0.00 0.00 173.10 169.97 1sqc s TRP 417 N -2.73 2.87 0.00 1.90 0.51 -1.26 -1.54 118.94 118.70 1sqc s TRP 417 Ca 0.35 -0.04 0.00 0.00 -2.12 0.00 0.00 56.10 54.29 1sqc s TRP 417 Cb 0.09 -1.63 0.00 0.00 -0.81 0.00 0.00 33.47 31.12 1sqc s TRP 417 CO 0.18 0.34 0.00 0.41 -0.51 0.00 0.00 176.95 177.37 1sqc n GLY 418 N 1.78 1.14 0.11 0.98 0.00 -1.26 -1.25 105.19 106.69 1sqc n GLY 418 Ca -0.16 -1.97 -0.22 0.00 0.00 0.00 0.00 46.02 43.66 1sqc n GLY 418 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sqc n ALA 419 N -3.00 0.82 -0.01 4.61 0.00 -1.26 -4.49 120.51 117.18 1sqc n ALA 419 Ca 0.00 -0.55 -0.02 0.00 0.00 0.00 0.00 53.44 52.88 1sqc n ALA 419 Cb 0.00 -0.49 -0.01 0.00 0.00 0.00 0.00 19.45 18.95 1sqc n ALA 419 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1sqc n TYR 420 N -4.42 0.00 -4.10 0.00 4.01 -1.26 -0.54 117.16 110.85 1sqc n TYR 420 Ca -0.34 0.00 -0.22 0.00 -0.16 0.00 0.00 57.90 57.18 1sqc n TYR 420 Cb 0.70 -0.07 -0.05 0.00 -0.31 0.00 0.00 39.34 39.61 1sqc n TYR 420 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1sqc s ASP 421 N -4.83 5.16 -0.09 7.72 1.01 -1.26 -4.72 116.67 119.65 1sqc s ASP 421 Ca -0.03 -0.45 -0.18 0.00 0.71 0.00 0.00 52.55 52.61 1sqc s ASP 421 Cb 0.01 -1.12 -0.04 0.00 1.01 0.00 0.00 42.92 42.77 1sqc s ASP 421 CO 0.04 -0.11 0.48 -0.69 0.21 0.00 0.00 175.17 175.09 1sqc s VAL 422 N -2.24 5.14 -1.41 -1.27 1.01 -1.26 -4.41 120.40 115.96 1sqc s VAL 422 Ca 0.34 0.97 -0.01 0.00 0.00 0.00 0.00 61.98 63.29 1sqc s VAL 422 Cb -0.07 -3.82 0.00 0.00 0.00 0.00 0.00 36.38 32.50 1sqc s VAL 422 CO 0.24 0.36 0.44 0.47 0.00 0.00 0.00 175.10 176.61 1sqc n ASP 423 N 3.38 -0.42 -2.47 3.32 8.00 -1.26 -4.84 116.55 122.26 1sqc n ASP 423 Ca -0.08 -1.00 -0.24 0.00 0.71 0.00 0.00 54.79 54.18 1sqc n ASP 423 Cb 0.52 -3.09 -0.08 0.00 -0.02 0.00 0.00 41.12 38.45 1sqc n ASP 423 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1sqc n ASN 424 N -2.98 6.34 -0.82 -2.24 2.85 -1.25 -4.44 115.26 112.71 1sqc n ASN 424 Ca -0.30 -2.98 0.11 0.00 -0.11 0.00 0.00 54.58 51.30 1sqc n ASN 424 Cb 0.68 -1.31 0.29 0.00 1.24 0.00 0.00 39.78 40.68 1sqc n ASN 424 CO 0.00 0.00 0.00 0.35 -2.11 0.00 0.00 177.26 175.50 1sqc n THR 425 N 1.50 0.36 -1.60 -0.44 -2.24 -1.26 -2.78 114.28 107.81 1sqc n THR 425 Ca 0.49 -0.53 -0.46 0.00 -2.27 0.00 0.00 64.05 61.28 1sqc n THR 425 Cb 0.62 0.61 -0.03 0.00 -2.10 0.00 0.00 70.33 69.43 1sqc n THR 425 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1sqc n SER 426 N 0.84 1.60 -0.02 3.42 2.88 -1.26 -4.91 113.62 116.16 1sqc n SER 426 Ca 0.17 1.16 -0.04 0.00 -1.33 0.00 0.00 58.87 58.83 1sqc n SER 426 Cb 0.45 -1.29 -0.13 0.00 -0.75 0.00 0.00 64.21 62.48 1sqc n SER 426 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1sqc n ASP 427 N 1.63 0.53 -0.16 -3.46 2.03 -1.26 -4.59 116.55 111.28 1sqc n ASP 427 Ca 0.12 0.24 -0.05 0.00 0.52 0.00 0.00 54.79 55.62 1sqc n ASP 427 Cb 0.29 0.51 0.01 0.00 -0.72 0.00 0.00 41.12 41.22 1sqc n ASP 427 CO 0.00 0.00 0.00 0.25 -1.92 0.00 0.00 177.20 175.53 1sqc h LEU 428 N 0.00 -0.95 -2.15 -2.67 7.12 -1.97 -2.77 115.31 111.92 1sqc h LEU 428 Ca -0.29 0.19 0.07 0.00 0.13 0.00 0.00 57.88 57.98 1sqc h LEU 428 Cb 1.84 0.48 -0.01 0.00 -0.53 0.00 0.00 40.66 42.44 1sqc h LEU 428 CO 0.05 -0.28 0.29 1.55 -0.13 0.00 0.00 178.44 179.91 1sqc h PRO 429 N -0.17 0.00 -0.35 5.25 0.13 -1.90 -2.56 132.00 132.40 1sqc h PRO 429 Ca 0.21 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.34 1sqc h PRO 429 Cb 0.51 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.64 1sqc h PRO 429 CO -0.59 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 177.27 1sqc n ASN 430 N -3.68 0.35 -0.00 1.44 3.02 -1.04 -3.25 115.26 112.10 1sqc n ASN 430 Ca 0.03 -1.87 0.01 0.00 -0.03 0.00 0.00 54.58 52.72 1sqc n ASN 430 Cb 0.42 -0.18 -0.01 0.00 -0.61 0.00 0.00 39.78 39.40 1sqc n ASN 430 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1sqc n HIS 431 N -0.30 0.00 -1.85 3.10 8.25 -0.96 -2.96 115.22 120.49 1sqc n HIS 431 Ca 0.00 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 57.06 1sqc n HIS 431 Cb 0.09 -0.02 0.01 0.00 1.12 0.00 0.00 29.99 31.19 1sqc n HIS 431 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1sqc s ILE 432 N -1.58 2.18 0.13 1.59 1.01 -1.20 -4.34 121.20 118.99 1sqc s ILE 432 Ca 0.00 0.17 -0.20 0.00 0.00 0.00 0.00 60.65 60.62 1sqc s ILE 432 Cb 0.01 -3.10 -0.01 0.00 0.01 0.00 0.00 42.46 39.37 1sqc s ILE 432 CO 0.08 0.03 1.70 -0.65 0.00 0.00 0.00 174.94 176.09 1sqc h PRO 433 N 2.47 -0.00 -1.02 2.79 0.11 -1.93 -2.63 132.00 131.78 1sqc h PRO 433 Ca -0.51 0.00 0.25 0.00 0.11 0.00 0.00 66.00 65.86 1sqc h PRO 433 Cb 1.26 0.00 -0.11 0.00 0.11 0.00 0.00 31.00 32.26 1sqc h PRO 433 CO 0.62 -0.00 0.63 0.35 -0.21 0.00 0.00 178.00 179.39 1sqc h PHE 434 N -0.00 0.84 -1.30 0.65 3.04 -1.92 -3.32 116.94 114.92 1sqc h PHE 434 Ca 0.11 0.03 -0.72 0.00 3.98 0.00 0.00 57.97 61.37 1sqc h PHE 434 Cb 0.17 -0.24 -0.12 0.00 2.56 0.00 0.00 35.95 38.31 1sqc h PHE 434 CO -0.23 0.07 2.00 0.00 -2.02 0.00 0.00 178.31 178.13 1sqc n ASP 436 N 6.26 2.73 -3.70 0.00 5.75 -1.25 -2.26 116.55 124.09 1sqc n ASP 436 Ca 0.43 -2.19 -0.27 0.00 -0.01 0.00 0.00 54.79 52.76 1sqc n ASP 436 Cb 0.42 -0.21 -0.17 0.00 -1.03 0.00 0.00 41.12 40.13 1sqc n ASP 436 CO 0.00 0.00 0.00 0.12 -0.11 0.00 0.00 177.20 177.21 1sqc s PHE 437 N -1.34 0.74 0.06 2.11 5.36 -1.26 -4.85 117.98 118.80 1sqc s PHE 437 Ca 0.19 -0.62 0.00 0.00 -0.96 0.00 0.00 56.93 55.54 1sqc s PHE 437 Cb 0.12 -0.90 0.00 0.00 -0.34 0.00 0.00 43.02 41.90 1sqc s PHE 437 CO 0.09 -0.55 0.00 0.41 -1.46 0.00 0.00 175.22 173.71 1sqc n GLY 438 N 5.13 -1.79 3.77 13.12 0.00 -1.26 -4.88 105.19 119.28 1sqc n GLY 438 Ca -0.08 -1.28 -0.39 0.00 0.00 0.00 0.00 46.02 44.26 1sqc n GLY 438 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1sqc s GLU 439 N -0.63 4.41 -0.01 1.61 0.41 -1.26 -4.90 118.70 118.33 1sqc s GLU 439 Ca 0.00 1.84 0.06 0.00 -0.41 0.00 0.00 54.97 56.46 1sqc s GLU 439 Cb 0.00 -2.98 -0.09 0.00 -1.78 0.00 0.00 34.13 29.29 1sqc s GLU 439 CO 0.00 -0.01 0.13 0.28 -0.49 0.00 0.00 175.26 175.17 1sqc n VAL 440 N 0.72 0.00 -4.34 2.63 0.31 -1.26 -4.85 118.33 111.54 1sqc n VAL 440 Ca 0.01 -0.14 -0.23 0.00 -0.01 0.00 0.00 64.34 63.97 1sqc n VAL 440 Cb 0.45 0.39 -0.08 0.00 -0.91 0.00 0.00 33.84 33.69 1sqc n VAL 440 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 1sqc s THR 441 N -2.37 3.18 -0.68 2.52 -4.23 -1.26 0.23 115.64 113.02 1sqc s THR 441 Ca -0.02 -2.03 0.05 0.00 -1.18 0.00 0.00 61.69 58.51 1sqc s THR 441 Cb 0.04 -2.71 0.24 0.00 1.34 0.00 0.00 72.50 71.40 1sqc s THR 441 CO 0.24 -0.37 0.74 -0.67 -0.54 0.00 0.00 174.62 174.02 1sqc n ASP 442 N -0.84 3.79 -4.86 3.99 2.03 -1.12 -4.73 116.55 114.82 1sqc n ASP 442 Ca -0.06 -3.39 -0.30 0.00 0.52 0.00 0.00 54.79 51.56 1sqc n ASP 442 Cb 0.59 -0.73 0.08 0.00 -0.72 0.00 0.00 41.12 40.34 1sqc n ASP 442 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 1sqc s PRO 443 N -2.28 2.29 0.64 -0.67 0.04 -1.19 -3.93 135.00 129.90 1sqc s PRO 443 Ca 0.36 0.37 -0.18 0.00 0.04 0.00 0.00 61.00 61.60 1sqc s PRO 443 Cb 0.10 -1.96 -0.01 0.00 0.04 0.00 0.00 34.50 32.67 1sqc s PRO 443 CO -0.04 -1.42 1.26 -2.14 0.04 0.00 0.00 177.00 174.70 1sqc s PRO 444 N -5.38 2.61 0.13 0.56 0.02 -1.26 -4.56 135.00 127.12 1sqc s PRO 444 Ca 0.60 1.96 0.04 0.00 0.02 0.00 0.00 61.00 63.62 1sqc s PRO 444 Cb -0.12 -1.87 -0.04 0.00 0.02 0.00 0.00 34.50 32.49 1sqc s PRO 444 CO 0.52 -1.52 -0.10 -1.54 -0.33 0.00 0.00 177.00 174.03 1sqc s SER 445 N -1.54 1.63 0.04 2.53 1.04 -0.38 -4.88 113.70 112.14 1sqc s SER 445 Ca 0.80 -0.97 -0.29 0.00 0.48 0.00 0.00 55.95 55.97 1sqc s SER 445 Cb -0.34 0.01 -0.17 0.00 0.10 0.00 0.00 66.02 65.61 1sqc s SER 445 CO 0.38 -0.33 1.41 -0.33 0.98 0.00 0.00 173.24 175.35 1sqc h GLU 446 N 2.98 -0.72 -0.27 4.02 3.07 -1.87 -2.77 114.58 119.03 1sqc h GLU 446 Ca -0.37 0.05 0.05 0.00 -0.50 0.00 0.00 59.36 58.60 1sqc h GLU 446 Cb 1.19 0.16 -0.05 0.00 -0.84 0.00 0.00 28.75 29.21 1sqc h GLU 446 CO 0.61 -0.42 -0.06 0.38 -1.40 0.00 0.00 179.01 178.12 1sqc h ASP 447 N -0.90 -0.24 -0.61 1.42 3.04 -1.89 0.47 116.42 117.72 1sqc h ASP 447 Ca -0.08 0.08 0.04 0.00 -3.24 0.00 0.00 57.03 53.83 1sqc h ASP 447 Cb 0.63 0.16 -0.04 0.00 -1.04 0.00 0.00 39.33 39.04 1sqc h ASP 447 CO 0.12 -0.08 0.36 0.58 -2.04 0.00 0.00 179.24 178.18 1sqc h VAL 448 N 0.01 1.04 -0.68 4.15 2.07 -1.87 0.15 116.25 121.11 1sqc h VAL 448 Ca 0.13 -0.24 -0.03 0.00 0.82 0.00 0.00 66.70 67.38 1sqc h VAL 448 Cb 0.20 0.28 -0.03 0.00 -1.52 0.00 0.00 31.29 30.22 1sqc h VAL 448 CO -0.27 0.13 0.30 0.74 0.02 0.00 0.00 177.57 178.49 1sqc h THR 449 N 0.69 1.24 -0.78 2.57 2.02 -1.06 -0.45 112.91 117.13 1sqc h THR 449 Ca 0.25 -0.70 0.02 0.00 0.77 0.00 0.00 66.41 66.75 1sqc h THR 449 Cb 0.07 0.42 -0.04 0.00 -1.74 0.00 0.00 68.15 66.86 1sqc h THR 449 CO -0.12 0.28 0.51 0.00 0.37 0.00 0.00 175.52 176.56 1sqc h ALA 450 N 1.14 1.00 -0.28 6.16 0.00 0.11 -0.22 119.26 127.16 1sqc h ALA 450 Ca 0.23 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.99 1sqc h ALA 450 Cb 0.16 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1sqc h ALA 450 CO -0.02 0.37 -0.23 0.45 0.00 0.00 0.00 179.25 179.81 1sqc h HIS 451 N 1.03 0.77 -0.94 0.00 3.86 -0.52 -2.02 115.15 117.34 1sqc h HIS 451 Ca 0.29 -0.22 0.05 0.00 -1.16 0.00 0.00 60.37 59.33 1sqc h HIS 451 Cb -0.08 -0.17 -0.06 0.00 1.06 0.00 0.00 27.41 28.17 1sqc h HIS 451 CO -0.02 0.94 0.62 0.28 0.86 0.00 0.00 177.93 180.60 1sqc h VAL 452 N 0.39 1.12 -0.28 2.45 2.07 -0.75 -1.20 116.25 120.04 1sqc h VAL 452 Ca 0.05 -0.39 -0.04 0.00 0.82 0.00 0.00 66.70 67.14 1sqc h VAL 452 Cb 0.79 -0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 30.43 1sqc h VAL 452 CO 0.06 0.21 0.01 -0.07 0.02 0.00 0.00 177.57 177.80 1sqc h LEU 453 N 1.14 0.48 -1.33 2.57 4.07 -0.84 -2.27 115.31 119.13 1sqc h LEU 453 Ca 0.39 -0.30 -0.06 0.00 0.08 0.00 0.00 57.88 57.99 1sqc h LEU 453 Cb 0.09 -0.13 -0.01 0.00 1.08 0.00 0.00 40.66 41.70 1sqc h LEU 453 CO -0.13 0.66 -0.23 -0.08 -1.08 0.00 0.00 178.44 177.58 1sqc h GLU 454 N 0.29 0.16 0.77 1.13 4.81 -0.97 -0.48 114.58 120.29 1sqc h GLU 454 Ca 0.08 -0.05 -0.04 0.00 -0.13 0.00 0.00 59.36 59.23 1sqc h GLU 454 Cb 0.41 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.77 1sqc h GLU 454 CO 0.01 0.39 -0.42 0.00 -0.73 0.00 0.00 179.01 178.26 1sqc h PHE 456 N -1.10 0.09 -0.86 0.00 0.04 -1.15 -1.61 116.94 112.35 1sqc h PHE 456 Ca -0.10 0.03 0.18 0.00 2.80 0.00 0.00 57.97 60.88 1sqc h PHE 456 Cb 0.87 0.02 -0.11 0.00 2.20 0.00 0.00 35.95 38.93 1sqc h PHE 456 CO -0.06 -0.02 0.38 0.78 -0.60 0.00 0.00 178.31 178.79 1sqc h GLY 457 N 0.19 1.41 1.83 -1.45 0.00 -0.67 0.39 103.07 104.78 1sqc h GLY 457 Ca 0.21 -0.18 0.01 0.00 0.00 0.00 0.00 47.33 47.37 1sqc h GLY 457 CO -0.30 -0.17 0.07 1.48 0.00 0.00 0.00 176.54 177.62 1sqc h SER 458 N 0.47 0.00 0.55 0.19 4.64 0.02 0.71 113.55 120.13 1sqc h SER 458 Ca 0.50 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.82 1sqc h SER 458 Cb 0.86 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.95 1sqc h SER 458 CO -0.46 0.00 -0.35 0.49 -0.87 0.00 0.00 176.83 175.64 1sqc n PHE 459 N -3.53 0.00 0.00 4.77 3.72 0.14 -4.96 117.46 117.60 1sqc n PHE 459 Ca -0.02 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.38 1sqc n PHE 459 Cb 0.16 -0.28 0.00 0.00 -0.94 0.00 0.00 39.48 38.42 1sqc n PHE 459 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1sqc n GLY 460 N 1.46 0.54 3.74 1.37 0.00 0.24 -5.08 105.19 107.46 1sqc n GLY 460 Ca 0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 1sqc n GLY 460 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1sqc s TYR 461 N -2.00 3.32 0.00 1.61 1.51 -1.24 -5.01 117.35 115.54 1sqc s TYR 461 Ca 0.00 1.29 0.00 0.00 -1.01 0.00 0.00 57.07 57.35 1sqc s TYR 461 Cb 0.00 -3.54 0.00 0.00 -0.11 0.00 0.00 41.96 38.31 1sqc s TYR 461 CO 0.00 -1.64 0.00 -0.40 -1.11 0.00 0.00 175.55 172.40 1sqc n ASP 462 N 2.61 1.40 0.29 2.29 5.68 -1.26 -4.28 116.55 123.28 1sqc n ASP 462 Ca 0.06 -0.67 0.16 0.00 -0.50 0.00 0.00 54.79 53.83 1sqc n ASP 462 Cb 0.43 0.00 0.93 0.00 -1.14 0.00 0.00 41.12 41.35 1sqc n ASP 462 CO 0.00 0.00 0.00 -0.78 -1.33 0.00 0.00 177.20 175.09 1sqc h ASP 463 N 0.00 0.00 -0.84 -1.12 3.58 -1.78 -2.81 116.42 113.45 1sqc h ASP 463 Ca 0.00 0.00 0.11 0.00 0.42 0.00 0.00 57.03 57.56 1sqc h ASP 463 Cb 0.00 0.00 -0.06 0.00 1.72 0.00 0.00 39.33 40.99 1sqc h ASP 463 CO 0.00 0.00 0.55 0.00 -2.88 0.00 0.00 179.24 176.91 1sqc h ALA 464 N 1.97 1.76 -2.42 -0.78 0.00 -1.95 -3.36 119.26 114.48 1sqc h ALA 464 Ca 0.01 0.00 -0.54 0.00 0.00 0.00 0.00 54.91 54.38 1sqc h ALA 464 Cb 0.06 -0.16 0.01 0.00 0.00 0.00 0.00 17.79 17.70 1sqc h ALA 464 CO -0.00 0.05 0.89 -0.46 0.00 0.00 0.00 179.25 179.73 1sqc s TRP 465 N -5.70 2.72 0.46 0.00 -0.00 -1.06 -4.92 118.94 110.44 1sqc s TRP 465 Ca -0.10 0.64 0.19 0.00 -0.00 0.00 0.00 56.10 56.83 1sqc s TRP 465 Cb 0.21 -3.78 1.17 0.00 -0.00 0.00 0.00 33.47 31.07 1sqc s TRP 465 CO 0.78 -2.98 1.93 0.87 -0.00 0.00 0.00 176.95 177.55 1sqc h LYS 466 N 7.93 0.28 0.55 5.86 1.57 -1.91 -0.81 116.57 130.04 1sqc h LYS 466 Ca -0.40 -0.02 -0.03 0.00 -1.87 0.00 0.00 60.65 58.34 1sqc h LYS 466 Cb 1.19 -0.06 0.01 0.00 0.08 0.00 0.00 32.23 33.44 1sqc h LYS 466 CO 0.91 0.18 -0.26 0.28 -0.57 0.00 0.00 179.45 179.99 1sqc h VAL 467 N 0.29 0.45 -0.87 0.50 2.07 -1.93 -2.37 116.25 114.39 1sqc h VAL 467 Ca 0.36 -0.07 -0.01 0.00 0.82 0.00 0.00 66.70 67.79 1sqc h VAL 467 Cb 0.98 0.48 -0.04 0.00 -1.52 0.00 0.00 31.29 31.19 1sqc h VAL 467 CO -0.09 0.01 0.49 0.40 0.02 0.00 0.00 177.57 178.40 1sqc h ILE 468 N -0.78 1.25 -0.23 4.57 2.04 -1.67 -2.60 117.51 120.09 1sqc h ILE 468 Ca -0.08 -0.61 0.04 0.00 1.00 0.00 0.00 64.86 65.22 1sqc h ILE 468 Cb 0.59 0.06 -0.04 0.00 -0.74 0.00 0.00 36.82 36.69 1sqc h ILE 468 CO 0.12 0.28 -0.02 -0.09 0.00 0.00 0.00 178.15 178.44 1sqc h ARG 469 N 1.22 0.05 -0.86 2.37 2.43 -1.10 -0.36 114.38 118.13 1sqc h ARG 469 Ca 0.31 -0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.48 1sqc h ARG 469 Cb 0.01 -0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 29.51 1sqc h ARG 469 CO -0.05 0.03 0.53 0.00 -1.51 0.00 0.00 179.97 178.97 1sqc h ARG 470 N 0.05 1.15 -0.20 0.20 3.08 -1.27 -1.71 114.38 115.67 1sqc h ARG 470 Ca 0.11 -0.09 -0.01 0.00 0.07 0.00 0.00 59.98 60.07 1sqc h ARG 470 Cb 0.15 -0.25 -0.01 0.00 0.08 0.00 0.00 29.97 29.94 1sqc h ARG 470 CO -0.20 0.79 0.11 0.00 -1.07 0.00 0.00 179.97 179.59 1sqc h ALA 471 N 1.42 0.26 -0.63 0.04 0.00 -0.99 -2.03 119.26 117.33 1sqc h ALA 471 Ca 0.31 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.14 1sqc h ALA 471 Cb -0.08 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 1sqc h ALA 471 CO -0.06 -0.20 0.35 0.28 0.00 0.00 0.00 179.25 179.62 1sqc h VAL 472 N 0.21 1.20 -0.94 0.00 2.07 -0.68 -1.86 116.25 116.26 1sqc h VAL 472 Ca 0.07 -0.49 0.11 0.00 0.82 0.00 0.00 66.70 67.21 1sqc h VAL 472 Cb 0.08 0.38 -0.08 0.00 -1.52 0.00 0.00 31.29 30.15 1sqc h VAL 472 CO -0.01 0.21 0.57 -0.33 0.02 0.00 0.00 177.57 178.04 1sqc h GLU 473 N 0.86 0.90 0.16 1.57 4.39 -1.11 0.48 114.58 121.83 1sqc h GLU 473 Ca 0.22 -0.05 -0.01 0.00 0.34 0.00 0.00 59.36 59.86 1sqc h GLU 473 Cb 0.03 -0.20 0.00 0.00 -0.10 0.00 0.00 28.75 28.48 1sqc h GLU 473 CO -0.04 0.60 -0.08 -0.92 -1.16 0.00 0.00 179.01 177.41 1sqc h TYR 474 N 0.93 -0.20 -0.10 4.33 3.20 -0.70 -2.23 116.97 122.20 1sqc h TYR 474 Ca 0.46 -0.00 0.02 0.00 3.14 0.00 0.00 58.73 62.34 1sqc h TYR 474 Cb 0.43 0.07 -0.02 0.00 1.54 0.00 0.00 36.73 38.74 1sqc h TYR 474 CO -0.03 -0.05 -0.01 -0.07 -1.64 0.00 0.00 178.16 176.37 1sqc h LEU 475 N -0.31 -0.05 -0.78 2.82 3.38 -0.49 -1.55 115.31 118.33 1sqc h LEU 475 Ca -0.02 0.02 0.12 0.00 0.09 0.00 0.00 57.88 58.10 1sqc h LEU 475 Cb 0.24 0.05 -0.09 0.00 0.09 0.00 0.00 40.66 40.95 1sqc h LEU 475 CO 0.04 -0.01 0.37 0.11 0.09 0.00 0.00 178.44 179.04 1sqc h LYS 476 N 0.02 0.56 0.00 1.13 1.57 -0.91 -0.04 116.57 118.91 1sqc h LYS 476 Ca 0.05 -0.03 -0.09 0.00 -1.87 0.00 0.00 60.65 58.71 1sqc h LYS 476 Cb 0.06 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.23 1sqc h LYS 476 CO -0.09 0.37 -0.42 0.00 -0.57 0.00 0.00 179.45 178.75 1sqc h ARG 477 N 0.57 0.00 0.00 3.15 3.08 -0.98 -3.06 114.38 117.15 1sqc h ARG 477 Ca 0.41 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.46 1sqc h ARG 477 Cb 0.54 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.59 1sqc h ARG 477 CO -0.34 0.42 -0.32 0.39 -1.07 0.00 0.00 179.97 179.05 1sqc n GLU 478 N -3.75 0.22 -1.70 0.04 -0.58 -0.14 -4.91 120.64 109.83 1sqc n GLU 478 Ca -0.01 0.12 -0.44 0.00 -0.42 0.00 0.00 57.16 56.41 1sqc n GLU 478 Cb 0.49 -1.69 -0.03 0.00 -0.57 0.00 0.00 31.44 29.64 1sqc n GLU 478 CO 0.00 0.00 0.00 0.94 -0.48 0.00 0.00 177.13 177.59 1sqc n GLN 479 N -2.05 2.47 -1.29 3.49 7.27 -0.54 -4.84 117.38 121.90 1sqc n GLN 479 Ca 0.05 0.89 -0.32 0.00 0.07 0.00 0.00 57.00 57.69 1sqc n GLN 479 Cb 0.42 -2.68 0.09 0.00 2.41 0.00 0.00 30.24 30.48 1sqc n GLN 479 CO 0.00 0.00 0.00 0.15 0.07 0.00 0.00 177.06 177.28 1sqc s LYS 480 N 0.70 2.16 0.26 3.69 3.01 0.06 -4.89 119.74 124.73 1sqc s LYS 480 Ca 0.74 1.34 -0.03 0.00 -1.01 0.00 0.00 55.97 57.01 1sqc s LYS 480 Cb -0.58 -1.87 0.52 0.00 -1.01 0.00 0.00 37.83 34.89 1sqc s LYS 480 CO 0.38 -1.74 1.69 -1.35 0.51 0.00 0.00 175.35 174.84 1sqc h PRO 481 N -0.92 0.30 -0.10 -1.68 0.11 -1.93 0.12 132.00 127.89 1sqc h PRO 481 Ca -0.45 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1sqc h PRO 481 Cb 1.25 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1sqc h PRO 481 CO 0.50 0.20 0.00 -0.40 -0.21 0.00 0.00 178.00 178.09 1sqc n ASP 482 N -5.13 0.10 -0.49 -2.05 5.75 -1.26 -4.86 116.55 108.62 1sqc n ASP 482 Ca 0.16 -1.79 -0.06 0.00 -0.01 0.00 0.00 54.79 53.10 1sqc n ASP 482 Cb 0.50 -0.05 -0.02 0.00 -1.03 0.00 0.00 41.12 40.52 1sqc n ASP 482 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1sqc n GLY 483 N 0.35 0.68 3.86 6.12 0.00 0.42 -4.74 105.19 111.88 1sqc n GLY 483 Ca 0.00 -0.77 -0.21 0.00 0.00 0.00 0.00 46.02 45.04 1sqc n GLY 483 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1sqc s SER 484 N -2.90 5.20 -0.09 1.61 1.04 -1.25 -3.84 113.70 113.47 1sqc s SER 484 Ca 0.00 -0.58 0.03 0.00 0.48 0.00 0.00 55.95 55.88 1sqc s SER 484 Cb 0.00 -0.85 0.01 0.00 0.10 0.00 0.00 66.02 65.28 1sqc s SER 484 CO 0.00 -0.44 -0.17 0.26 0.98 0.00 0.00 173.24 173.87 1sqc s TRP 485 N -2.36 1.98 0.14 5.02 0.51 -1.26 -0.76 118.94 122.22 1sqc s TRP 485 Ca 0.43 -0.81 -0.31 0.00 -2.12 0.00 0.00 56.10 53.28 1sqc s TRP 485 Cb -0.05 -1.39 -0.10 0.00 -0.81 0.00 0.00 33.47 31.12 1sqc s TRP 485 CO 0.27 -0.37 1.74 0.12 -0.51 0.00 0.00 176.95 178.19 1sqc s PHE 486 N 0.60 2.52 -0.47 -1.98 5.36 -1.26 -2.96 117.98 119.80 1sqc s PHE 486 Ca -0.15 0.22 -0.21 0.00 -0.96 0.00 0.00 56.93 55.83 1sqc s PHE 486 Cb -0.16 -4.10 0.03 0.00 -0.34 0.00 0.00 43.02 38.45 1sqc s PHE 486 CO 0.05 -4.36 0.69 0.20 -1.46 0.00 0.00 175.22 170.33 1sqc s GLY 487 N 2.03 1.68 -0.03 13.12 0.00 -1.26 -4.45 107.32 118.41 1sqc s GLY 487 Ca 0.77 -1.30 -0.21 0.00 0.00 0.00 0.00 44.72 43.98 1sqc s GLY 487 CO 0.34 1.61 0.94 -0.09 0.00 0.00 0.00 173.10 175.89 1sqc h ARG 488 N 8.96 0.35 0.00 2.90 9.65 -1.93 -3.34 114.38 130.97 1sqc h ARG 488 Ca -0.26 -0.55 -0.20 0.00 -1.10 0.00 0.00 59.98 57.87 1sqc h ARG 488 Cb 1.09 0.20 -0.04 0.00 -1.39 0.00 0.00 29.97 29.83 1sqc h ARG 488 CO 0.94 1.25 -1.97 0.91 2.80 0.00 0.00 179.97 183.90 1sqc n TRP 489 N -4.09 0.00 -4.09 2.20 7.02 -1.26 -4.73 117.44 112.49 1sqc n TRP 489 Ca -0.14 0.00 -0.25 0.00 -1.02 0.00 0.00 57.50 56.09 1sqc n TRP 489 Cb 0.83 -0.65 -0.05 0.00 -2.42 0.00 0.00 31.31 29.02 1sqc n TRP 489 CO 0.00 0.00 0.00 0.20 -2.02 0.00 0.00 177.69 175.87 1sqc s GLY 490 N -4.60 1.66 -0.50 6.99 0.00 -1.26 0.14 107.32 109.75 1sqc s GLY 490 Ca -0.07 -1.25 -0.26 0.00 0.00 0.00 0.00 44.72 43.13 1sqc s GLY 490 CO 0.65 -1.27 2.20 0.14 0.00 0.00 0.00 173.10 174.82 1sqc s VAL 491 N -1.82 3.14 0.00 1.40 1.01 -0.45 -4.57 120.40 119.10 1sqc s VAL 491 Ca 0.31 0.09 0.00 0.00 0.00 0.00 0.00 61.98 62.38 1sqc s VAL 491 Cb -0.10 -3.33 0.00 0.00 0.00 0.00 0.00 36.38 32.95 1sqc s VAL 491 CO 0.24 -0.31 0.00 0.59 0.00 0.00 0.00 175.10 175.62 1sqc n ASN 492 N 14.34 0.00 0.00 3.32 3.02 -1.25 -3.98 115.26 130.71 1sqc n ASN 492 Ca 0.30 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.85 1sqc n ASN 492 Cb 0.53 -0.10 0.00 0.00 -0.61 0.00 0.00 39.78 39.60 1sqc n ASN 492 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1sqc n TYR 493 N -0.10 0.00 -0.18 3.10 4.01 -1.24 0.16 117.16 122.92 1sqc n TYR 493 Ca 0.00 0.00 -0.07 0.00 -0.16 0.00 0.00 57.90 57.67 1sqc n TYR 493 Cb 0.00 -0.38 0.02 0.00 -0.31 0.00 0.00 39.34 38.66 1sqc n TYR 493 CO 0.00 0.00 0.00 -0.07 -0.46 0.00 0.00 176.86 176.33 1sqc h LEU 494 N 0.00 0.62 0.50 7.72 3.38 -1.82 0.22 115.31 125.93 1sqc h LEU 494 Ca 0.00 -0.06 -0.02 0.00 0.09 0.00 0.00 57.88 57.88 1sqc h LEU 494 Cb 0.00 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.60 1sqc h LEU 494 CO 0.00 0.50 -0.24 0.22 0.09 0.00 0.00 178.44 179.01 1sqc h TYR 495 N 0.69 -0.62 0.03 1.13 3.20 0.14 -1.46 116.97 120.08 1sqc h TYR 495 Ca 0.18 -0.01 0.03 0.00 3.14 0.00 0.00 58.73 62.07 1sqc h TYR 495 Cb -0.00 0.21 -0.05 0.00 1.54 0.00 0.00 36.73 38.42 1sqc h TYR 495 CO -0.03 -0.30 -0.42 0.78 -1.64 0.00 0.00 178.16 176.56 1sqc h GLY 496 N -0.93 -0.79 0.44 1.82 0.00 -1.41 -1.04 103.07 101.16 1sqc h GLY 496 Ca -0.07 0.50 0.05 0.00 0.00 0.00 0.00 47.33 47.81 1sqc h GLY 496 CO 0.11 -0.25 -0.12 -0.84 0.00 0.00 0.00 176.54 175.44 1sqc h THR 497 N -0.59 0.63 -0.68 4.70 2.02 -0.46 -0.62 112.91 117.91 1sqc h THR 497 Ca 0.04 0.00 0.08 0.00 0.77 0.00 0.00 66.41 67.30 1sqc h THR 497 Cb 0.66 0.63 -0.06 0.00 -1.74 0.00 0.00 68.15 67.64 1sqc h THR 497 CO -0.30 0.00 0.35 1.23 0.37 0.00 0.00 175.52 177.17 1sqc h GLY 498 N -0.12 1.01 0.93 2.16 0.00 -1.07 -0.85 103.07 105.13 1sqc h GLY 498 Ca 0.11 -0.23 -0.01 0.00 0.00 0.00 0.00 47.33 47.20 1sqc h GLY 498 CO -0.26 0.09 -0.12 0.00 0.00 0.00 0.00 176.54 176.24 1sqc h ALA 499 N 1.40 -0.34 0.46 3.60 0.00 -0.48 -2.87 119.26 121.03 1sqc h ALA 499 Ca 0.33 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.11 1sqc h ALA 499 Cb 0.30 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1sqc h ALA 499 CO -0.24 -0.65 -0.22 0.28 0.00 0.00 0.00 179.25 178.42 1sqc h VAL 500 N -0.42 0.54 -0.22 0.00 2.07 -0.83 -2.78 116.25 114.61 1sqc h VAL 500 Ca -0.04 -0.09 0.06 0.00 0.82 0.00 0.00 66.70 67.46 1sqc h VAL 500 Cb 0.32 0.59 -0.06 0.00 -1.52 0.00 0.00 31.29 30.62 1sqc h VAL 500 CO 0.06 0.02 -0.18 0.58 0.02 0.00 0.00 177.57 178.07 1sqc h VAL 501 N -0.67 0.52 -0.27 2.57 2.07 -1.24 0.14 116.25 119.36 1sqc h VAL 501 Ca -0.06 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.49 1sqc h VAL 501 Cb 0.50 0.52 -0.01 0.00 -1.52 0.00 0.00 31.29 30.78 1sqc h VAL 501 CO 0.10 0.00 0.18 0.77 0.02 0.00 0.00 177.57 178.65 1sqc h SER 502 N -0.18 0.18 -0.07 0.57 4.64 -1.55 -2.06 113.55 115.09 1sqc h SER 502 Ca 0.13 -0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.40 1sqc h SER 502 Cb 0.37 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.42 1sqc h SER 502 CO -0.33 0.12 -0.12 0.00 -0.87 0.00 0.00 176.83 175.63 1sqc h ALA 503 N 1.85 0.10 -0.98 5.18 0.00 -0.95 -2.22 119.26 122.24 1sqc h ALA 503 Ca 0.12 -0.33 0.12 0.00 0.00 0.00 0.00 54.91 54.81 1sqc h ALA 503 Cb 0.20 -0.02 -0.08 0.00 0.00 0.00 0.00 17.79 17.90 1sqc h ALA 503 CO -0.02 -0.02 0.62 -0.07 0.00 0.00 0.00 179.25 179.76 1sqc h LEU 504 N -0.28 0.87 -0.49 0.00 3.38 -0.37 0.07 115.31 118.49 1sqc h LEU 504 Ca 0.00 0.04 -0.13 0.00 0.09 0.00 0.00 57.88 57.88 1sqc h LEU 504 Cb 0.69 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 1sqc h LEU 504 CO 0.03 0.47 -0.22 0.50 0.09 0.00 0.00 178.44 179.31 1sqc h LYS 505 N 0.94 1.00 0.00 1.13 3.11 -1.38 -1.93 116.57 119.44 1sqc h LYS 505 Ca 0.48 -0.43 -0.01 0.00 -2.81 0.00 0.00 60.65 57.88 1sqc h LYS 505 Cb 0.52 -0.03 -0.00 0.00 -1.00 0.00 0.00 32.23 31.71 1sqc h LYS 505 CO -0.25 1.11 -0.05 0.00 -2.81 0.00 0.00 179.45 177.45 1sqc h ALA 506 N 0.88 1.08 -0.60 5.00 0.00 -0.37 -2.86 119.26 122.39 1sqc h ALA 506 Ca 0.11 -0.05 -0.16 0.00 0.00 0.00 0.00 54.91 54.81 1sqc h ALA 506 Cb 0.80 -0.01 -0.09 0.00 0.00 0.00 0.00 17.79 18.48 1sqc h ALA 506 CO 0.07 0.07 0.17 1.33 0.00 0.00 0.00 179.25 180.88 1sqc n VAL 507 N -3.27 2.78 -2.87 0.00 0.24 -0.70 -4.51 118.33 110.00 1sqc n VAL 507 Ca -0.01 -1.78 -0.14 0.00 -2.04 0.00 0.00 64.34 60.37 1sqc n VAL 507 Cb 0.24 -0.33 0.03 0.00 -1.47 0.00 0.00 33.84 32.31 1sqc n VAL 507 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1sqc n GLY 508 N -0.26 -0.01 3.85 7.63 0.00 -1.08 -2.49 105.19 112.83 1sqc n GLY 508 Ca 0.36 -0.19 -0.37 0.00 0.00 0.00 0.00 46.02 45.82 1sqc n GLY 508 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1sqc s ILE 509 N -3.01 5.11 -0.56 -0.61 -1.09 -0.74 -4.75 121.20 115.54 1sqc s ILE 509 Ca 0.24 0.64 -0.28 0.00 -2.23 0.00 0.00 60.65 59.02 1sqc s ILE 509 Cb -0.11 -3.65 0.01 0.00 -1.58 0.00 0.00 42.46 37.13 1sqc s ILE 509 CO 0.30 0.50 1.45 -0.62 -1.23 0.00 0.00 174.94 175.35 1sqc s ASP 510 N -1.27 6.07 0.17 3.58 2.15 -1.26 -4.62 116.67 121.49 1sqc s ASP 510 Ca 0.25 0.31 0.10 0.00 0.43 0.00 0.00 52.55 53.64 1sqc s ASP 510 Cb -0.15 -2.54 0.55 0.00 -0.30 0.00 0.00 42.92 40.48 1sqc s ASP 510 CO 0.13 -1.75 1.27 0.35 -0.17 0.00 0.00 175.17 175.01 1sqc n THR 511 N 6.89 1.34 0.33 1.71 -2.24 -1.26 -1.73 114.28 119.33 1sqc n THR 511 Ca 0.13 0.63 0.14 0.00 -2.27 0.00 0.00 64.05 62.68 1sqc n THR 511 Cb 0.49 -1.63 0.61 0.00 -2.10 0.00 0.00 70.33 67.71 1sqc n THR 511 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 1sqc h ARG 512 N 0.00 0.00 -6.47 -0.78 2.43 -1.92 -3.36 114.38 104.28 1sqc h ARG 512 Ca 0.00 0.00 -0.58 0.00 -0.81 0.00 0.00 59.98 58.59 1sqc h ARG 512 Cb 0.13 0.00 0.17 0.00 -0.42 0.00 0.00 29.97 29.85 1sqc h ARG 512 CO 0.00 0.00 -0.46 0.39 -1.51 0.00 0.00 179.97 178.39 1sqc n GLU 513 N -2.54 0.46 -0.03 0.20 -0.58 -0.71 -4.75 120.64 112.69 1sqc n GLU 513 Ca 0.01 0.18 -0.09 0.00 -0.42 0.00 0.00 57.16 56.84 1sqc n GLU 513 Cb 0.22 -1.64 -0.03 0.00 -0.57 0.00 0.00 31.44 29.41 1sqc n GLU 513 CO 0.00 0.00 0.00 -1.35 -0.48 0.00 0.00 177.13 175.30 1sqc h PRO 514 N 0.20 0.15 0.00 3.49 0.11 -1.92 -1.21 132.00 132.83 1sqc h PRO 514 Ca -0.45 -0.01 -0.10 0.00 0.11 0.00 0.00 66.00 65.55 1sqc h PRO 514 Cb 1.40 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.46 1sqc h PRO 514 CO 0.46 0.10 -0.48 0.10 -0.21 0.00 0.00 178.00 177.98 1sqc h TYR 515 N 0.15 0.00 0.07 0.65 -0.00 -1.96 -2.17 116.97 113.72 1sqc h TYR 515 Ca 0.08 0.00 -0.26 0.00 -0.00 0.00 0.00 58.73 58.54 1sqc h TYR 515 Cb 0.04 0.00 0.01 0.00 -0.00 0.00 0.00 36.73 36.78 1sqc h TYR 515 CO -0.11 0.48 -1.11 0.82 -0.00 0.00 0.00 178.16 178.23 1sqc h ILE 516 N 0.00 1.38 -0.41 -0.90 2.04 -1.80 -3.02 117.51 114.80 1sqc h ILE 516 Ca -0.00 -2.58 -0.13 0.00 1.00 0.00 0.00 64.86 63.15 1sqc h ILE 516 Cb 0.91 2.63 -0.01 0.00 -0.74 0.00 0.00 36.82 39.60 1sqc h ILE 516 CO 0.06 0.77 -0.25 1.56 0.00 0.00 0.00 178.15 180.30 1sqc h GLN 517 N 0.22 0.84 -0.25 2.37 1.08 -1.17 -2.54 115.11 115.65 1sqc h GLN 517 Ca -0.13 -0.36 0.01 0.00 -1.45 0.00 0.00 58.65 56.72 1sqc h GLN 517 Cb 1.78 -0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 29.17 1sqc h GLN 517 CO 0.20 1.00 0.17 -0.22 -0.95 0.00 0.00 178.83 179.03 1sqc h LYS 518 N 0.73 0.29 -0.08 1.46 3.64 -1.42 -1.04 116.57 120.16 1sqc h LYS 518 Ca 0.09 -0.02 -0.05 0.00 -1.27 0.00 0.00 60.65 59.40 1sqc h LYS 518 Cb 0.79 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.54 1sqc h LYS 518 CO 0.06 0.19 -0.15 0.00 -2.27 0.00 0.00 179.45 177.29 1sqc h ALA 519 N 1.85 0.12 -0.82 5.00 0.00 -1.34 -2.56 119.26 121.51 1sqc h ALA 519 Ca 0.10 -0.35 0.01 0.00 0.00 0.00 0.00 54.91 54.67 1sqc h ALA 519 Cb 0.03 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.76 1sqc h ALA 519 CO -0.02 0.02 0.55 -0.07 0.00 0.00 0.00 179.25 179.73 1sqc h LEU 520 N -0.24 0.94 -0.22 0.00 4.07 -0.98 -2.07 115.31 116.81 1sqc h LEU 520 Ca 0.00 -0.02 -0.01 0.00 0.08 0.00 0.00 57.88 57.92 1sqc h LEU 520 Cb 0.73 -0.24 -0.01 0.00 1.08 0.00 0.00 40.66 42.23 1sqc h LEU 520 CO 0.03 0.68 0.08 0.44 -1.08 0.00 0.00 178.44 178.60 1sqc h ASP 521 N 1.11 0.30 -0.97 -0.43 3.32 -1.21 -2.23 116.42 116.31 1sqc h ASP 521 Ca 0.30 -0.18 0.13 0.00 0.02 0.00 0.00 57.03 57.31 1sqc h ASP 521 Cb -0.13 -0.08 -0.09 0.00 0.22 0.00 0.00 39.33 39.26 1sqc h ASP 521 CO -0.07 0.40 0.59 -0.25 -1.72 0.00 0.00 179.24 178.20 1sqc h TRP 522 N 0.19 1.07 0.53 4.55 7.01 -1.00 -1.21 115.95 127.08 1sqc h TRP 522 Ca 0.07 0.03 -0.03 0.00 2.11 0.00 0.00 58.89 61.08 1sqc h TRP 522 Cb 0.20 -0.33 0.01 0.00 -2.10 0.00 0.00 29.16 26.93 1sqc h TRP 522 CO -0.01 0.37 -0.25 0.28 -2.79 0.00 0.00 178.44 176.05 1sqc h VAL 523 N 0.89 0.47 -0.82 2.65 2.07 -0.92 -3.12 116.25 117.48 1sqc h VAL 523 Ca 0.50 -0.12 0.09 0.00 0.82 0.00 0.00 66.70 68.00 1sqc h VAL 523 Cb 0.57 0.52 -0.07 0.00 -1.52 0.00 0.00 31.29 30.79 1sqc h VAL 523 CO -0.30 0.02 0.46 -0.33 0.02 0.00 0.00 177.57 177.45 1sqc h GLU 524 N -0.78 0.76 0.00 1.57 5.08 -0.88 -1.85 114.58 118.48 1sqc h GLU 524 Ca -0.07 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.24 1sqc h GLU 524 Cb 0.57 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.65 1sqc h GLU 524 CO 0.12 0.50 0.00 1.04 -1.00 0.00 0.00 179.01 179.67 1sqc n GLN 525 N -4.75 0.41 0.00 2.33 6.02 -0.51 -2.45 117.38 118.43 1sqc n GLN 525 Ca 0.13 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.12 1sqc n GLN 525 Cb 0.27 -1.12 0.00 0.00 1.02 0.00 0.00 30.24 30.41 1sqc n GLN 525 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 1sqc n HIS 526 N -0.62 0.00 -1.72 1.08 8.25 -0.70 -5.07 115.22 116.45 1sqc n HIS 526 Ca 0.02 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 57.09 1sqc n HIS 526 Cb 0.01 0.00 0.03 0.00 1.12 0.00 0.00 29.99 31.15 1sqc n HIS 526 CO 0.00 0.00 0.00 0.94 0.64 0.00 0.00 176.34 177.92 1sqc n GLN 527 N -0.11 1.85 -2.73 -0.41 7.27 -1.03 -4.73 117.38 117.49 1sqc n GLN 527 Ca 0.00 0.67 -0.27 0.00 0.07 0.00 0.00 57.00 57.47 1sqc n GLN 527 Cb 0.07 -2.48 0.00 0.00 2.41 0.00 0.00 30.24 30.23 1sqc n GLN 527 CO 0.00 0.00 0.00 -0.80 0.07 0.00 0.00 177.06 176.33 1sqc s ASN 528 N -0.69 6.21 0.25 1.69 0.01 0.42 -4.97 114.94 117.86 1sqc s ASN 528 Ca 0.65 0.83 -0.03 0.00 -0.71 0.00 0.00 52.86 53.60 1sqc s ASN 528 Cb -0.46 -2.16 0.50 0.00 0.41 0.00 0.00 41.25 39.54 1sqc s ASN 528 CO 0.54 -0.57 1.72 1.55 -1.51 0.00 0.00 177.10 178.83 1sqc h PRO 529 N 0.27 0.41 0.00 -0.60 0.13 -1.94 0.39 132.00 130.66 1sqc h PRO 529 Ca -0.47 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 1sqc h PRO 529 Cb 1.21 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 32.25 1sqc h PRO 529 CO 0.61 0.27 0.00 -0.40 -0.23 0.00 0.00 178.00 178.25 1sqc n ASP 530 N -5.02 0.00 0.00 1.44 5.68 -1.26 -4.79 116.55 112.60 1sqc n ASP 530 Ca 0.16 0.32 0.00 0.00 -0.50 0.00 0.00 54.79 54.77 1sqc n ASP 530 Cb 0.46 -0.36 0.00 0.00 -1.14 0.00 0.00 41.12 40.08 1sqc n ASP 530 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1sqc n GLY 531 N -1.01 0.66 0.00 6.12 0.00 0.13 -4.62 105.19 106.47 1sqc n GLY 531 Ca 0.02 -0.37 0.00 0.00 0.00 0.00 0.00 46.02 45.67 1sqc n GLY 531 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sqc n GLY 532 N -2.59 3.95 2.85 -0.02 0.00 -1.25 -2.80 105.19 105.34 1sqc n GLY 532 Ca 0.00 -2.18 -0.17 0.00 0.00 0.00 0.00 46.02 43.67 1sqc n GLY 532 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1sqc s TRP 533 N -0.45 0.41 0.11 1.61 0.51 -1.26 -0.44 118.94 119.44 1sqc s TRP 533 Ca 0.00 -0.05 0.05 0.00 -2.12 0.00 0.00 56.10 53.97 1sqc s TRP 533 Cb 0.00 -0.44 -0.04 0.00 -0.81 0.00 0.00 33.47 32.18 1sqc s TRP 533 CO 0.00 -0.13 -0.12 0.20 -0.51 0.00 0.00 176.95 176.40 1sqc s GLY 534 N 0.84 0.97 -0.28 0.98 0.00 -1.24 -1.86 107.32 106.73 1sqc s GLY 534 Ca -0.09 -1.26 0.00 0.00 0.00 0.00 0.00 44.72 43.37 1sqc s GLY 534 CO -0.01 -1.33 0.53 1.85 0.00 0.00 0.00 173.10 174.13 1sqc s GLU 535 N -2.81 0.50 0.64 2.90 2.12 -1.26 -2.45 118.70 118.34 1sqc s GLU 535 Ca 0.08 0.73 -0.15 0.00 0.36 0.00 0.00 54.97 55.99 1sqc s GLU 535 Cb -0.03 0.17 -0.01 0.00 0.26 0.00 0.00 34.13 34.51 1sqc s GLU 535 CO 0.02 -0.74 1.10 0.34 -0.54 0.00 0.00 175.26 175.44 1sqc s ASP 536 N 2.75 5.28 0.00 -1.70 2.15 -0.86 -4.85 116.67 119.43 1sqc s ASP 536 Ca 0.16 1.97 0.09 0.00 0.43 0.00 0.00 52.55 55.20 1sqc s ASP 536 Cb -0.14 -2.55 0.42 0.00 -0.30 0.00 0.00 42.92 40.35 1sqc s ASP 536 CO -0.21 -1.51 1.29 0.00 -0.17 0.00 0.00 175.17 174.56 1sqc n ARG 538 N -1.47 0.18 0.00 0.00 1.74 -1.26 -2.84 116.66 113.01 1sqc n ARG 538 Ca 0.03 0.44 0.03 0.00 -0.77 0.00 0.00 57.85 57.58 1sqc n ARG 538 Cb 0.11 -1.86 0.16 0.00 -1.02 0.00 0.00 32.46 29.85 1sqc n ARG 538 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 1sqc n SER 539 N -2.20 0.00 -0.03 0.55 3.41 -0.88 -1.09 113.62 113.38 1sqc n SER 539 Ca 0.02 0.12 -0.14 0.00 -0.26 0.00 0.00 58.87 58.62 1sqc n SER 539 Cb 0.20 -0.23 -0.14 0.00 -0.26 0.00 0.00 64.21 63.78 1sqc n SER 539 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1sqc n TYR 540 N -1.23 0.95 -0.10 7.33 4.02 -1.13 -4.55 117.16 122.45 1sqc n TYR 540 Ca 0.03 0.28 -0.22 0.00 -0.01 0.00 0.00 57.90 57.98 1sqc n TYR 540 Cb 0.04 -1.15 -0.12 0.00 -0.02 0.00 0.00 39.34 38.10 1sqc n TYR 540 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 176.86 176.24 1sqc n GLU 541 N -3.18 0.57 -4.19 -0.72 -0.58 -0.42 -4.88 120.64 107.24 1sqc n GLU 541 Ca -0.25 0.55 -0.34 0.00 -0.42 0.00 0.00 57.16 56.70 1sqc n GLU 541 Cb 1.06 -1.74 -0.15 0.00 -0.57 0.00 0.00 31.44 30.04 1sqc n GLU 541 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 1sqc s ASP 542 N -6.89 3.78 0.33 1.62 2.15 -0.25 -5.01 116.67 112.40 1sqc s ASP 542 Ca -0.29 -0.48 0.24 0.00 0.43 0.00 0.00 52.55 52.45 1sqc s ASP 542 Cb 0.06 -1.61 1.19 0.00 -0.30 0.00 0.00 42.92 42.26 1sqc s ASP 542 CO 0.59 0.03 1.74 1.55 -0.17 0.00 0.00 175.17 178.91 1sqc h PRO 543 N 7.76 0.00 0.00 4.34 0.13 -1.84 -2.27 132.00 140.12 1sqc h PRO 543 Ca -0.39 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.73 1sqc h PRO 543 Cb 1.17 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.29 1sqc h PRO 543 CO 0.60 0.00 -0.03 0.00 -0.23 0.00 0.00 178.00 178.35 1sqc h ALA 544 N 2.10 1.00 -0.24 -0.56 0.00 -1.93 -2.95 119.26 116.67 1sqc h ALA 544 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1sqc h ALA 544 Cb 0.16 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1sqc h ALA 544 CO 0.00 0.03 0.00 0.66 0.00 0.00 0.00 179.25 179.94 1sqc n TYR 545 N -3.12 0.32 -1.71 0.00 4.01 -0.85 -4.82 117.16 110.98 1sqc n TYR 545 Ca 0.01 -0.16 -0.43 0.00 -0.16 0.00 0.00 57.90 57.16 1sqc n TYR 545 Cb 0.36 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.36 1sqc n TYR 545 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1sqc s ALA 546 N -1.68 2.95 -1.34 -0.72 0.00 -1.12 -1.74 121.76 118.11 1sqc s ALA 546 Ca 0.23 0.79 -0.01 0.00 0.00 0.00 0.00 51.96 52.98 1sqc s ALA 546 Cb 0.12 -4.01 0.00 0.00 0.00 0.00 0.00 23.12 19.23 1sqc s ALA 546 CO 0.17 -2.48 0.07 0.41 0.00 0.00 0.00 175.76 173.93 1sqc n GLY 547 N 5.40 -0.28 2.85 0.00 0.00 -1.26 -5.00 105.19 106.90 1sqc n GLY 547 Ca 0.26 -0.19 -0.26 0.00 0.00 0.00 0.00 46.02 45.82 1sqc n GLY 547 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1sqc s LYS 548 N -4.89 1.17 0.00 1.61 2.20 -0.71 -4.76 119.74 114.36 1sqc s LYS 548 Ca 0.04 -0.26 0.00 0.00 -0.36 0.00 0.00 55.97 55.38 1sqc s LYS 548 Cb -0.02 -1.62 0.00 0.00 -1.51 0.00 0.00 37.83 34.68 1sqc s LYS 548 CO 0.04 -0.37 0.00 0.41 -0.36 0.00 0.00 175.35 175.08 1sqc n GLY 549 N 4.98 -1.45 3.77 5.54 0.00 -1.03 -2.04 105.19 114.97 1sqc n GLY 549 Ca -0.11 -1.05 -0.38 0.00 0.00 0.00 0.00 46.02 44.48 1sqc n GLY 549 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sqc s ALA 550 N -1.83 3.16 0.28 4.61 0.00 -1.26 -3.90 121.76 122.81 1sqc s ALA 550 Ca 0.00 1.02 -0.30 0.00 0.00 0.00 0.00 51.96 52.68 1sqc s ALA 550 Cb 0.00 -3.40 -0.10 0.00 0.00 0.00 0.00 23.12 19.61 1sqc s ALA 550 CO 0.00 -0.61 1.47 -1.12 0.00 0.00 0.00 175.76 175.51 1sqc s SER 551 N -1.07 6.56 0.06 0.00 0.01 -1.26 -3.73 113.70 114.27 1sqc s SER 551 Ca 0.58 2.77 0.05 0.00 1.31 0.00 0.00 55.95 60.66 1sqc s SER 551 Cb -0.32 -2.63 -0.03 0.00 0.21 0.00 0.00 66.02 63.25 1sqc s SER 551 CO 0.40 -0.76 -0.14 0.42 0.41 0.00 0.00 173.24 173.58 1sqc s THR 552 N -0.19 1.09 0.13 1.44 -4.23 -0.78 -4.88 115.64 108.22 1sqc s THR 552 Ca 0.59 -1.22 -0.24 0.00 -1.18 0.00 0.00 61.69 59.63 1sqc s THR 552 Cb -0.44 -1.04 -0.04 0.00 1.34 0.00 0.00 72.50 72.32 1sqc s THR 552 CO 0.47 -0.18 1.65 -0.65 -0.54 0.00 0.00 174.62 175.37 1sqc h PRO 553 N 4.45 -0.32 0.29 3.99 0.11 -1.88 -0.57 132.00 138.08 1sqc h PRO 553 Ca -0.40 0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.72 1sqc h PRO 553 Cb 1.19 0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.36 1sqc h PRO 553 CO 0.41 -0.21 -0.20 0.66 -0.21 0.00 0.00 178.00 178.45 1sqc h SER 554 N -0.33 -0.51 -0.70 -2.05 4.64 -1.83 -1.35 113.55 111.42 1sqc h SER 554 Ca 0.07 0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 1sqc h SER 554 Cb 0.43 0.16 -0.03 0.00 -0.31 0.00 0.00 62.40 62.64 1sqc h SER 554 CO -0.23 -0.32 0.44 1.56 -0.87 0.00 0.00 176.83 177.41 1sqc h GLN 555 N -0.49 0.93 -0.35 4.77 4.20 -1.79 -0.59 115.11 121.79 1sqc h GLN 555 Ca -0.02 -0.07 0.05 0.00 0.06 0.00 0.00 58.65 58.66 1sqc h GLN 555 Cb 0.42 -0.20 -0.05 0.00 0.30 0.00 0.00 27.48 27.95 1sqc h GLN 555 CO 0.01 0.65 0.08 1.15 -0.67 0.00 0.00 178.83 180.04 1sqc h THR 556 N 0.95 0.83 -0.90 -0.54 2.02 -0.99 -1.77 112.91 112.51 1sqc h THR 556 Ca 0.25 -0.07 0.01 0.00 0.77 0.00 0.00 66.41 67.37 1sqc h THR 556 Cb -0.06 0.62 -0.04 0.00 -1.74 0.00 0.00 68.15 66.92 1sqc h THR 556 CO -0.05 0.04 0.59 0.00 0.37 0.00 0.00 175.52 176.46 1sqc h ALA 557 N 1.26 1.34 0.25 6.16 0.00 -0.68 -0.23 119.26 127.35 1sqc h ALA 557 Ca 0.16 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1sqc h ALA 557 Cb 0.18 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 17.61 1sqc h ALA 557 CO -0.21 0.61 -0.12 -1.49 0.00 0.00 0.00 179.25 178.04 1sqc h TRP 558 N 1.23 -0.31 -0.66 0.00 6.55 -0.42 -1.55 115.95 120.78 1sqc h TRP 558 Ca 0.33 -0.01 0.05 0.00 0.95 0.00 0.00 58.89 60.21 1sqc h TRP 558 Cb -0.12 0.10 -0.04 0.00 -0.86 0.00 0.00 29.16 28.24 1sqc h TRP 558 CO 0.00 -0.07 0.44 0.00 -1.05 0.00 0.00 178.44 177.76 1sqc h ALA 559 N 0.20 1.70 -0.83 1.49 0.00 -1.11 -0.90 119.26 119.81 1sqc h ALA 559 Ca -0.03 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 1sqc h ALA 559 Cb 0.38 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.94 1sqc h ALA 559 CO 0.06 0.21 0.37 1.25 0.00 0.00 0.00 179.25 181.13 1sqc h LEU 560 N 0.72 1.11 -0.80 0.00 5.85 -0.77 -2.23 115.31 119.19 1sqc h LEU 560 Ca 0.28 -0.15 -0.06 0.00 0.84 0.00 0.00 57.88 58.78 1sqc h LEU 560 Cb 0.18 -0.29 -0.03 0.00 0.37 0.00 0.00 40.66 40.90 1sqc h LEU 560 CO -0.08 0.96 0.21 0.24 -0.34 0.00 0.00 178.44 179.43 1sqc h MET 561 N 1.19 1.11 -0.97 1.25 2.86 -0.15 -0.70 114.93 119.53 1sqc h MET 561 Ca 0.28 -0.24 0.07 0.00 -2.06 0.00 0.00 59.70 57.75 1sqc h MET 561 Cb 0.17 -0.16 -0.07 0.00 0.06 0.00 0.00 31.60 31.60 1sqc h MET 561 CO -0.03 0.95 0.62 0.00 1.06 0.00 0.00 176.91 179.51 1sqc h ALA 562 N 1.16 1.35 -0.05 6.32 0.00 -0.83 0.36 119.26 127.56 1sqc h ALA 562 Ca 0.23 -0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.97 1sqc h ALA 562 Cb 0.31 -0.29 0.01 0.00 0.00 0.00 0.00 17.79 17.83 1sqc h ALA 562 CO -0.01 0.40 -0.57 -0.07 0.00 0.00 0.00 179.25 179.00 1sqc h LEU 563 N 1.13 0.59 -0.74 0.00 3.38 -0.95 -2.00 115.31 116.71 1sqc h LEU 563 Ca 0.42 -0.70 -0.03 0.00 0.09 0.00 0.00 57.88 57.67 1sqc h LEU 563 Cb 0.18 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 1sqc h LEU 563 CO -0.18 1.20 0.36 0.40 0.09 0.00 0.00 178.44 180.32 1sqc h ILE 564 N 0.03 1.24 -0.04 1.22 2.04 -0.79 0.52 117.51 121.73 1sqc h ILE 564 Ca -0.06 -0.67 -0.12 0.00 1.00 0.00 0.00 64.86 65.02 1sqc h ILE 564 Cb 1.25 0.31 -0.01 0.00 -0.74 0.00 0.00 36.82 37.62 1sqc h ILE 564 CO 0.12 0.28 -0.51 0.00 0.00 0.00 0.00 178.15 178.04 1sqc h ALA 565 N 1.18 1.07 -0.04 1.87 0.00 -1.00 -2.84 119.26 119.50 1sqc h ALA 565 Ca 0.26 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1sqc h ALA 565 Cb 0.11 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1sqc h ALA 565 CO -0.03 0.65 0.00 0.41 0.00 0.00 0.00 179.25 180.28 1sqc n GLY 566 N -0.01 -0.81 2.15 0.00 0.00 -0.75 -4.86 105.19 100.91 1sqc n GLY 566 Ca -0.02 -0.08 -0.01 0.00 0.00 0.00 0.00 46.02 45.91 1sqc n GLY 566 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sqc n GLY 567 N 0.66 0.47 2.30 -0.02 0.00 -1.05 -4.94 105.19 102.60 1sqc n GLY 567 Ca 0.06 -0.20 -0.33 0.00 0.00 0.00 0.00 46.02 45.55 1sqc n GLY 567 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1sqc n ARG 568 N -2.46 2.91 0.21 1.61 1.74 0.11 -4.57 116.66 116.20 1sqc n ARG 568 Ca -0.01 -3.52 0.09 0.00 -0.77 0.00 0.00 57.85 53.65 1sqc n ARG 568 Cb 0.09 -2.29 0.33 0.00 -1.02 0.00 0.00 32.46 29.58 1sqc n ARG 568 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1sqc h ALA 569 N 2.10 0.93 -0.00 7.54 0.00 -1.83 -2.93 119.26 125.07 1sqc h ALA 569 Ca 0.55 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 55.23 1sqc h ALA 569 Cb 0.93 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.68 1sqc h ALA 569 CO 1.40 0.31 -0.14 -1.91 0.00 0.00 0.00 179.25 178.91 1sqc n GLU 570 N -3.29 0.19 -0.76 0.00 4.07 -1.26 -4.64 120.64 114.94 1sqc n GLU 570 Ca 0.01 -0.05 -0.30 0.00 -0.06 0.00 0.00 57.16 56.76 1sqc n GLU 570 Cb 0.51 -1.50 0.18 0.00 -0.06 0.00 0.00 31.44 30.57 1sqc n GLU 570 CO 0.00 0.00 0.00 0.45 -0.06 0.00 0.00 177.13 177.52 1sqc s SER 571 N -2.84 2.59 0.06 4.31 0.15 -1.11 -4.92 113.70 111.94 1sqc s SER 571 Ca 0.18 1.90 -0.17 0.00 0.70 0.00 0.00 55.95 58.56 1sqc s SER 571 Cb 0.19 -2.45 -0.15 0.00 -1.71 0.00 0.00 66.02 61.90 1sqc s SER 571 CO 0.55 -3.26 1.29 -0.33 1.20 0.00 0.00 173.24 172.69 1sqc h GLU 572 N -1.98 0.58 -0.75 5.44 4.39 -1.91 -2.96 114.58 117.39 1sqc h GLU 572 Ca -0.49 -0.42 0.14 0.00 0.34 0.00 0.00 59.36 58.94 1sqc h GLU 572 Cb 1.28 0.07 -0.10 0.00 -0.10 0.00 0.00 28.75 29.91 1sqc h GLU 572 CO 0.46 1.04 0.29 0.00 -1.16 0.00 0.00 179.01 179.64 1sqc h ALA 573 N 0.55 1.05 -0.56 3.43 0.00 -1.92 -0.02 119.26 121.78 1sqc h ALA 573 Ca -0.01 0.12 -0.06 0.00 0.00 0.00 0.00 54.91 54.95 1sqc h ALA 573 Cb 1.07 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.92 1sqc h ALA 573 CO 0.10 -0.21 0.10 0.00 0.00 0.00 0.00 179.25 179.23 1sqc h ALA 574 N 1.55 1.13 -0.50 0.00 0.00 -1.79 -2.46 119.26 117.18 1sqc h ALA 574 Ca 0.41 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 1sqc h ALA 574 Cb 0.63 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 1sqc h ALA 574 CO -0.41 0.58 0.26 -0.09 0.00 0.00 0.00 179.25 179.59 1sqc h ARG 575 N 0.84 0.71 -0.12 0.00 9.65 -0.84 -2.05 114.38 122.56 1sqc h ARG 575 Ca 0.18 -0.09 -0.14 0.00 -1.10 0.00 0.00 59.98 58.83 1sqc h ARG 575 Cb 0.36 -0.13 -0.01 0.00 -1.39 0.00 0.00 29.97 28.79 1sqc h ARG 575 CO 0.01 0.57 -0.51 0.00 2.80 0.00 0.00 179.97 182.83 1sqc h ARG 576 N 0.66 0.34 0.02 0.20 3.08 -1.38 -2.51 114.38 114.79 1sqc h ARG 576 Ca 0.17 -0.20 0.01 0.00 0.07 0.00 0.00 59.98 60.03 1sqc h ARG 576 Cb 0.08 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.13 1sqc h ARG 576 CO -0.03 0.77 -0.06 0.78 -1.07 0.00 0.00 179.97 180.37 1sqc h GLY 577 N 1.27 -0.08 0.94 0.04 0.00 -1.07 0.40 103.07 104.56 1sqc h GLY 577 Ca 0.01 0.07 -0.00 0.00 0.00 0.00 0.00 47.33 47.41 1sqc h GLY 577 CO 0.09 -0.07 0.03 -2.08 0.00 0.00 0.00 176.54 174.51 1sqc h VAL 578 N -0.11 1.07 -0.76 4.60 2.07 -1.37 -2.83 116.25 118.92 1sqc h VAL 578 Ca 0.02 -0.20 0.15 0.00 0.82 0.00 0.00 66.70 67.50 1sqc h VAL 578 Cb 0.13 1.09 -0.10 0.00 -1.52 0.00 0.00 31.29 30.89 1sqc h VAL 578 CO -0.05 0.06 0.28 1.56 0.02 0.00 0.00 177.57 179.44 1sqc h GLN 579 N 0.02 0.38 0.08 1.57 1.08 -1.19 -0.28 115.11 116.76 1sqc h GLN 579 Ca 0.02 -0.02 0.02 0.00 -1.45 0.00 0.00 58.65 57.22 1sqc h GLN 579 Cb 0.07 -0.09 -0.05 0.00 -0.05 0.00 0.00 27.48 27.36 1sqc h GLN 579 CO -0.00 0.25 -0.46 -0.92 -0.95 0.00 0.00 178.83 176.75 1sqc h TYR 580 N 0.39 -1.31 -0.52 2.96 5.03 -0.67 0.17 116.97 123.02 1sqc h TYR 580 Ca 0.43 0.04 0.07 0.00 2.58 0.00 0.00 58.73 61.85 1sqc h TYR 580 Cb 0.69 0.56 -0.06 0.00 1.55 0.00 0.00 36.73 39.48 1sqc h TYR 580 CO -0.19 -0.54 0.20 -0.07 -1.32 0.00 0.00 178.16 176.24 1sqc h LEU 581 N -0.66 0.22 -0.93 2.82 3.38 -1.13 0.15 115.31 119.16 1sqc h LEU 581 Ca 0.02 0.06 0.04 0.00 0.09 0.00 0.00 57.88 58.09 1sqc h LEU 581 Cb 0.70 0.03 -0.06 0.00 0.09 0.00 0.00 40.66 41.43 1sqc h LEU 581 CO -0.29 0.15 0.61 0.58 0.09 0.00 0.00 178.44 179.58 1sqc h VAL 582 N 0.39 1.15 -0.03 1.22 2.07 -0.44 -1.30 116.25 119.31 1sqc h VAL 582 Ca 0.25 -0.40 -0.11 0.00 0.82 0.00 0.00 66.70 67.26 1sqc h VAL 582 Cb 0.26 -0.12 0.01 0.00 -1.52 0.00 0.00 31.29 29.91 1sqc h VAL 582 CO -0.24 0.21 -0.42 -0.33 0.02 0.00 0.00 177.57 176.82 1sqc h GLU 583 N 1.17 0.33 0.00 1.57 5.08 0.27 -3.30 114.58 119.71 1sqc h GLU 583 Ca 0.37 -0.32 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1sqc h GLU 583 Cb 0.01 0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.35 1sqc h GLU 583 CO -0.12 0.99 0.00 0.25 -1.00 0.00 0.00 179.01 179.13 1sqc n THR 584 N -4.36 0.05 -2.24 1.13 -2.24 0.45 -4.86 114.28 102.22 1sqc n THR 584 Ca -0.09 0.01 -0.38 0.00 -2.27 0.00 0.00 64.05 61.32 1sqc n THR 584 Cb 0.57 -0.54 -0.02 0.00 -2.10 0.00 0.00 70.33 68.24 1sqc n THR 584 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 1sqc s GLN 585 N -2.42 4.01 0.76 -0.78 0.74 -0.50 -4.62 119.66 116.85 1sqc s GLN 585 Ca 0.32 1.90 -0.11 0.00 0.05 0.00 0.00 55.36 57.51 1sqc s GLN 585 Cb 0.19 -2.68 0.05 0.00 1.10 0.00 0.00 33.01 31.68 1sqc s GLN 585 CO 0.41 -0.37 1.13 1.03 -0.55 0.00 0.00 175.29 176.94 1sqc s ARG 586 N -2.31 2.38 0.35 1.67 0.52 0.76 -4.98 118.95 117.35 1sqc s ARG 586 Ca 0.57 0.25 0.15 0.00 -0.52 0.00 0.00 55.73 56.19 1sqc s ARG 586 Cb -0.32 -1.99 0.65 0.00 0.52 0.00 0.00 34.95 33.81 1sqc s ARG 586 CO 0.40 -1.32 1.75 -1.35 0.02 0.00 0.00 175.30 174.80 1sqc h PRO 587 N -0.85 0.00 0.00 3.54 0.11 -1.96 -2.92 132.00 129.92 1sqc h PRO 587 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1sqc h PRO 587 Cb 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 1sqc h PRO 587 CO 0.65 0.43 0.00 0.38 -0.21 0.00 0.00 178.00 179.24 1sqc h ASP 588 N 0.00 0.00 0.00 -2.05 3.04 -1.97 -3.47 116.42 111.98 1sqc h ASP 588 Ca -0.00 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.79 1sqc h ASP 588 Cb 0.84 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.13 1sqc h ASP 588 CO 0.06 0.00 0.00 0.61 -2.04 0.00 0.00 179.24 177.87 1sqc n GLY 589 N 0.34 1.73 3.86 7.15 0.00 -1.10 -4.61 105.19 112.56 1sqc n GLY 589 Ca 0.02 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.82 1sqc n GLY 589 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sqc n GLY 590 N 0.00 0.75 3.31 -0.02 0.00 -1.26 -3.83 105.19 104.14 1sqc n GLY 590 Ca 0.00 -2.05 -0.22 0.00 0.00 0.00 0.00 46.02 43.75 1sqc n GLY 590 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1sqc s TRP 591 N -3.03 1.76 0.43 1.61 0.51 -1.26 -0.17 118.94 118.79 1sqc s TRP 591 Ca 0.65 -0.46 0.03 0.00 -2.12 0.00 0.00 56.10 54.20 1sqc s TRP 591 Cb -0.04 -0.91 0.00 0.00 -0.81 0.00 0.00 33.47 31.72 1sqc s TRP 591 CO 0.43 0.27 0.63 -0.51 -0.51 0.00 0.00 176.95 177.26 1sqc s ASP 592 N -2.39 5.76 -0.33 2.95 1.01 -1.26 -4.73 116.67 117.68 1sqc s ASP 592 Ca 0.12 0.06 -0.05 0.00 0.71 0.00 0.00 52.55 53.39 1sqc s ASP 592 Cb -0.07 -1.28 0.19 0.00 1.01 0.00 0.00 42.92 42.76 1sqc s ASP 592 CO 0.05 -0.71 0.91 -0.70 0.21 0.00 0.00 175.17 174.94 1sqc s GLU 593 N -4.48 0.34 -0.06 8.23 2.12 -1.26 -4.53 118.70 119.06 1sqc s GLU 593 Ca 0.49 0.01 0.03 0.00 0.36 0.00 0.00 54.97 55.86 1sqc s GLU 593 Cb -0.10 0.07 0.17 0.00 0.26 0.00 0.00 34.13 34.53 1sqc s GLU 593 CO 0.36 -0.53 0.82 -0.35 -0.54 0.00 0.00 175.26 175.01 1sqc n PRO 594 N 4.37 1.73 -4.25 4.30 -0.04 -1.26 -4.86 135.00 135.00 1sqc n PRO 594 Ca 0.08 -0.65 -0.16 0.00 -0.04 0.00 0.00 63.50 62.73 1sqc n PRO 594 Cb 0.60 -1.60 -0.10 0.00 -0.04 0.00 0.00 33.50 32.35 1sqc n PRO 594 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1sqc s TYR 595 N -1.27 1.35 -0.10 0.54 2.02 -1.26 -4.76 117.35 113.87 1sqc s TYR 595 Ca 0.11 -0.65 -0.20 0.00 -0.37 0.00 0.00 57.07 55.96 1sqc s TYR 595 Cb 0.09 -0.69 -0.04 0.00 -0.40 0.00 0.00 41.96 40.92 1sqc s TYR 595 CO 0.03 0.13 0.56 0.71 -1.57 0.00 0.00 175.55 175.42 1sqc s TYR 596 N -2.77 3.53 -0.13 2.71 2.02 -1.26 -4.91 117.35 116.53 1sqc s TYR 596 Ca 0.14 1.01 0.16 0.00 -0.37 0.00 0.00 57.07 58.01 1sqc s TYR 596 Cb -0.01 -2.65 0.30 0.00 -0.40 0.00 0.00 41.96 39.20 1sqc s TYR 596 CO 0.02 0.12 1.15 0.25 -1.57 0.00 0.00 175.55 175.53 1sqc n THR 597 N 3.76 1.79 -4.67 -0.71 -2.24 -1.23 -4.75 114.28 106.23 1sqc n THR 597 Ca -0.05 -2.27 -0.31 0.00 -2.27 0.00 0.00 64.05 59.14 1sqc n THR 597 Cb 0.51 -0.17 -0.12 0.00 -2.10 0.00 0.00 70.33 68.45 1sqc n THR 597 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1sqc s GLY 598 N -2.81 1.59 -0.10 3.38 0.00 -0.26 -1.35 107.32 107.77 1sqc s GLY 598 Ca 0.31 -1.13 0.00 0.00 0.00 0.00 0.00 44.72 43.90 1sqc s GLY 598 CO 0.01 -1.00 -0.09 -1.59 0.00 0.00 0.00 173.10 170.43 1sqc s THR 599 N -0.90 1.05 -0.08 0.90 2.01 0.12 -0.86 115.64 117.88 1sqc s THR 599 Ca 0.15 -0.33 -0.06 0.00 0.31 0.00 0.00 61.69 61.76 1sqc s THR 599 Cb -0.11 -1.04 -0.02 0.00 0.01 0.00 0.00 72.50 71.34 1sqc s THR 599 CO 0.05 0.37 -0.11 0.61 -0.69 0.00 0.00 174.62 174.84 1sqc n GLY 600 N 4.72 -0.72 2.88 4.40 0.00 -0.06 -4.48 105.19 111.92 1sqc n GLY 600 Ca -0.15 -0.10 -0.27 0.00 0.00 0.00 0.00 46.02 45.50 1sqc n GLY 600 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1sqc s PHE 601 N -1.72 1.40 -0.41 1.61 0.08 -0.53 -4.97 117.98 113.43 1sqc s PHE 601 Ca -0.09 -0.73 -0.37 0.00 0.12 0.00 0.00 56.93 55.86 1sqc s PHE 601 Cb 0.01 -1.19 -0.14 0.00 -0.57 0.00 0.00 43.02 41.14 1sqc s PHE 601 CO 0.14 -0.51 2.20 -2.30 -0.10 0.00 0.00 175.22 174.65 1sqc n PRO 602 N 4.96 0.77 0.00 0.24 -0.02 -1.26 -1.07 135.00 138.61 1sqc n PRO 602 Ca -0.12 0.20 0.00 0.00 -2.02 0.00 0.00 63.50 61.56 1sqc n PRO 602 Cb 0.50 -2.21 0.00 0.00 -0.02 0.00 0.00 33.50 31.76 1sqc n PRO 602 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1sqc n GLY 603 N 6.77 2.66 0.00 -1.23 0.00 -1.26 -4.84 105.19 107.29 1sqc n GLY 603 Ca 0.46 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.48 1sqc n GLY 603 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1sqc n ASP 604 N 0.00 4.93 -3.67 1.61 8.00 -0.24 -5.04 116.55 122.14 1sqc n ASP 604 Ca 0.00 0.00 -0.09 0.00 0.71 0.00 0.00 54.79 55.41 1sqc n ASP 604 Cb 0.00 0.93 -0.10 0.00 -0.02 0.00 0.00 41.12 41.94 1sqc n ASP 604 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 1sqc s PHE 605 N -1.97 -0.75 0.26 1.24 2.19 -0.51 -4.94 117.98 113.50 1sqc s PHE 605 Ca 0.00 1.47 0.11 0.00 0.33 0.00 0.00 56.93 58.84 1sqc s PHE 605 Cb 0.00 0.29 -0.05 0.00 -1.31 0.00 0.00 43.02 41.96 1sqc s PHE 605 CO 0.00 -0.45 -0.16 0.71 1.83 0.00 0.00 175.22 177.15 1sqc s TYR 606 N 2.32 2.40 0.07 10.12 2.02 -1.26 -0.89 117.35 132.12 1sqc s TYR 606 Ca -0.04 -0.30 0.06 0.00 -0.37 0.00 0.00 57.07 56.42 1sqc s TYR 606 Cb -0.11 -1.07 -0.03 0.00 -0.40 0.00 0.00 41.96 40.35 1sqc s TYR 606 CO -0.13 0.66 -0.15 -0.51 -1.57 0.00 0.00 175.55 173.85 1sqc s LEU 607 N -3.40 2.26 -0.44 -1.29 1.43 -0.04 -4.42 118.68 112.77 1sqc s LEU 607 Ca 0.29 -0.59 -0.01 0.00 -1.03 0.00 0.00 54.13 52.78 1sqc s LEU 607 Cb -0.06 -0.60 0.12 0.00 0.03 0.00 0.00 46.19 45.68 1sqc s LEU 607 CO 0.15 -0.03 0.22 -0.83 0.23 0.00 0.00 176.35 176.10 1sqc s GLY 608 N -1.63 2.09 -1.00 -3.19 0.00 0.34 -1.11 107.32 102.82 1sqc s GLY 608 Ca 0.00 -2.69 -0.22 0.00 0.00 0.00 0.00 44.72 41.81 1sqc s GLY 608 CO 0.02 1.03 1.36 -0.19 0.00 0.00 0.00 173.10 175.32 1sqc s TYR 609 N 0.84 2.69 0.37 1.90 1.51 -1.26 -0.40 117.35 122.99 1sqc s TYR 609 Ca 0.10 -0.99 0.25 0.00 -1.01 0.00 0.00 57.07 55.43 1sqc s TYR 609 Cb -0.22 -4.59 1.28 0.00 -0.11 0.00 0.00 41.96 38.32 1sqc s TYR 609 CO -0.04 -1.82 1.40 2.41 -1.11 0.00 0.00 175.55 176.39 1sqc n THR 610 N 6.52 -0.28 0.13 -0.71 -1.04 -1.14 -0.71 114.28 117.05 1sqc n THR 610 Ca 0.31 1.69 0.01 0.00 -2.04 0.00 0.00 64.05 64.02 1sqc n THR 610 Cb 0.50 -2.76 0.00 0.00 -1.82 0.00 0.00 70.33 66.26 1sqc n THR 610 CO 0.00 0.00 0.00 0.24 -0.64 0.00 0.00 175.07 174.67 1sqc h MET 611 N 0.00 0.00 -0.73 -2.82 2.86 -1.89 -3.38 114.93 108.98 1sqc h MET 611 Ca 0.78 0.00 0.16 0.00 -2.06 0.00 0.00 59.70 58.58 1sqc h MET 611 Cb 2.33 0.00 -0.12 0.00 0.06 0.00 0.00 31.60 33.86 1sqc h MET 611 CO -0.52 0.55 0.04 1.88 1.06 0.00 0.00 176.91 179.92 1sqc h TYR 612 N 0.00 0.01 -0.09 -0.22 -1.99 -1.34 0.00 116.97 113.35 1sqc h TYR 612 Ca -0.01 0.05 0.03 0.00 2.00 0.00 0.00 58.73 60.80 1sqc h TYR 612 Cb 1.44 0.11 -0.00 0.00 2.00 0.00 0.00 36.73 40.27 1sqc h TYR 612 CO 0.00 -0.20 0.15 0.07 -0.00 0.00 0.00 178.16 178.18 1sqc h ARG 613 N 0.13 0.00 0.00 4.88 0.11 -1.75 -2.44 114.38 115.31 1sqc h ARG 613 Ca 0.40 0.00 -0.44 0.00 0.10 0.00 0.00 59.98 60.04 1sqc h ARG 613 Cb 0.70 0.00 -0.07 0.00 1.11 0.00 0.00 29.97 31.72 1sqc h ARG 613 CO -0.62 0.00 -2.46 0.72 0.10 0.00 0.00 179.97 177.71 1sqc n HIS 614 N -3.51 0.00 0.18 4.08 8.25 -0.17 -4.31 115.22 119.74 1sqc n HIS 614 Ca -0.01 0.00 -0.14 0.00 -0.26 0.00 0.00 57.72 57.31 1sqc n HIS 614 Cb 0.25 -0.97 -0.08 0.00 1.12 0.00 0.00 29.99 30.31 1sqc n HIS 614 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 1sqc h VAL 615 N -1.00 0.73 -0.38 1.59 2.07 -1.09 -3.07 116.25 115.10 1sqc h VAL 615 Ca -0.66 -0.10 -0.00 0.00 0.82 0.00 0.00 66.70 66.75 1sqc h VAL 615 Cb 1.58 0.79 -0.02 0.00 -1.52 0.00 0.00 31.29 32.12 1sqc h VAL 615 CO -0.40 0.02 0.23 -0.26 0.02 0.00 0.00 177.57 177.18 1sqc h PHE 616 N -0.44 0.50 -0.82 1.57 0.04 -1.67 -0.63 116.94 115.49 1sqc h PHE 616 Ca -0.04 0.00 0.02 0.00 2.80 0.00 0.00 57.97 60.75 1sqc h PHE 616 Cb 0.34 -0.16 -0.04 0.00 2.20 0.00 0.00 35.95 38.28 1sqc h PHE 616 CO -0.04 0.35 0.53 -1.35 -0.60 0.00 0.00 178.31 177.20 1sqc h PRO 617 N 0.50 1.03 -0.73 1.51 0.11 -1.76 0.52 132.00 133.18 1sqc h PRO 617 Ca 0.14 -0.06 -0.00 0.00 0.11 0.00 0.00 66.00 66.18 1sqc h PRO 617 Cb -0.01 -0.23 -0.04 0.00 0.11 0.00 0.00 31.00 30.84 1sqc h PRO 617 CO -0.03 0.68 0.44 1.15 -0.21 0.00 0.00 178.00 180.04 1sqc h THR 618 N 1.06 1.21 -0.10 -1.15 2.02 -1.37 0.50 112.91 115.07 1sqc h THR 618 Ca 0.31 -0.45 -0.03 0.00 0.77 0.00 0.00 66.41 67.01 1sqc h THR 618 Cb -0.06 0.19 -0.00 0.00 -1.74 0.00 0.00 68.15 66.54 1sqc h THR 618 CO -0.09 0.21 -0.05 0.25 0.37 0.00 0.00 175.52 176.21 1sqc h LEU 619 N 0.99 0.23 -0.37 2.58 5.85 -0.60 -1.23 115.31 122.76 1sqc h LEU 619 Ca 0.26 -0.42 0.02 0.00 0.84 0.00 0.00 57.88 58.58 1sqc h LEU 619 Cb -0.04 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 40.90 1sqc h LEU 619 CO -0.05 0.60 0.21 0.00 -0.34 0.00 0.00 178.44 178.85 1sqc h ALA 620 N 0.64 0.47 -0.14 1.25 0.00 0.43 -1.39 119.26 120.51 1sqc h ALA 620 Ca 0.02 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1sqc h ALA 620 Cb 0.51 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 1sqc h ALA 620 CO 0.02 -0.15 0.05 -0.07 0.00 0.00 0.00 179.25 179.09 1sqc h LEU 621 N 0.42 0.20 -0.77 0.00 3.38 -0.03 -2.50 115.31 116.01 1sqc h LEU 621 Ca 0.15 -0.19 0.11 0.00 0.09 0.00 0.00 57.88 58.04 1sqc h LEU 621 Cb 0.03 -0.05 -0.08 0.00 0.09 0.00 0.00 40.66 40.65 1sqc h LEU 621 CO -0.09 0.34 0.40 1.23 0.09 0.00 0.00 178.44 180.41 1sqc h GLY 622 N 0.05 1.19 1.89 0.83 0.00 -1.01 -0.49 103.07 105.53 1sqc h GLY 622 Ca 0.04 -0.25 -0.04 0.00 0.00 0.00 0.00 47.33 47.09 1sqc h GLY 622 CO -0.00 0.04 -0.12 3.21 0.00 0.00 0.00 176.54 179.67 1sqc h ARG 623 N 0.64 0.13 -0.07 4.80 3.08 -1.01 -2.80 114.38 119.15 1sqc h ARG 623 Ca 0.39 -0.03 -0.03 0.00 0.07 0.00 0.00 59.98 60.39 1sqc h ARG 623 Cb 0.45 -0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.48 1sqc h ARG 623 CO -0.29 0.26 -0.06 -0.92 -1.07 0.00 0.00 179.97 177.89 1sqc h TYR 624 N 0.13 0.20 -0.67 3.04 3.20 -0.67 -2.63 116.97 119.57 1sqc h TYR 624 Ca 0.03 -0.06 0.06 0.00 3.14 0.00 0.00 58.73 61.90 1sqc h TYR 624 Cb 0.30 -0.04 -0.06 0.00 1.54 0.00 0.00 36.73 38.47 1sqc h TYR 624 CO 0.00 0.59 0.37 -0.22 -1.64 0.00 0.00 178.16 177.26 1sqc h LYS 625 N -0.24 0.66 0.00 1.82 3.64 -1.19 -0.89 116.57 120.37 1sqc h LYS 625 Ca 0.01 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1sqc h LYS 625 Cb 0.55 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.22 1sqc h LYS 625 CO 0.02 0.44 0.00 1.96 -2.27 0.00 0.00 179.45 179.59 1sqc h GLN 626 N 0.68 0.00 -0.54 1.90 4.20 -1.53 -2.72 115.11 117.10 1sqc h GLN 626 Ca 0.30 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.01 1sqc h GLN 626 Cb 0.20 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.98 1sqc h GLN 626 CO -0.19 0.00 0.00 0.00 -0.67 0.00 0.00 178.83 177.97 1sqc n ALA 627 N -2.02 2.41 -0.35 3.87 0.00 -0.34 -5.11 120.51 118.97 1sqc n ALA 627 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 1sqc n ALA 627 Cb 0.29 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.74 1sqc n ALA 627 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61