#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hqk n GLY 11 N 0.00 0.56 0.06 7.55 0.00 -1.26 -4.74 105.19 107.37 3hqk n GLY 11 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.97 3hqk n GLY 11 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3hqk h LEU 12 N 0.00 0.00 -1.58 0.99 5.85 -1.93 -3.35 115.31 115.29 3hqk h LEU 12 Ca 0.00 -0.18 -0.04 0.00 0.84 0.00 0.00 57.88 58.50 3hqk h LEU 12 Cb 0.00 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.02 3hqk h LEU 12 CO 0.00 0.74 -0.13 -0.29 -0.34 0.00 0.00 178.44 178.41 3hqk h ILE 13 N -1.00 1.14 -0.00 4.05 6.09 -1.99 0.65 117.51 126.44 3hqk h ILE 13 Ca -0.03 -0.62 0.00 0.00 -1.37 0.00 0.00 64.86 62.84 3hqk h ILE 13 Cb 0.41 1.24 0.00 0.00 0.47 0.00 0.00 36.82 38.94 3hqk h ILE 13 CO -0.02 0.18 -0.03 -2.65 -3.07 0.00 0.00 178.15 172.56 3hqk n PRO 14 N -4.33 0.79 -0.07 2.19 -0.02 -1.26 -3.29 135.00 129.01 3hqk n PRO 14 Ca -0.02 -0.15 -0.17 0.00 -2.02 0.00 0.00 63.50 61.15 3hqk n PRO 14 Cb 0.23 -1.50 -0.13 0.00 -0.02 0.00 0.00 33.50 32.08 3hqk n PRO 14 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 3hqk n VAL 15 N -0.98 1.58 -0.28 -1.45 0.31 0.16 -3.73 118.33 113.95 3hqk n VAL 15 Ca 0.18 -0.66 -0.06 0.00 -0.01 0.00 0.00 64.34 63.78 3hqk n VAL 15 Cb 0.22 -1.34 0.06 0.00 -0.91 0.00 0.00 33.84 31.87 3hqk n VAL 15 CO 0.00 0.00 0.00 0.71 -1.32 0.00 0.00 176.83 176.22 3hqk h THR 16 N 0.02 1.26 -0.73 2.52 1.35 -1.47 -0.55 112.91 115.31 3hqk h THR 16 Ca -0.49 -0.81 -0.04 0.00 -0.55 0.00 0.00 66.41 64.52 3hqk h THR 16 Cb 2.01 0.35 -0.03 0.00 -1.73 0.00 0.00 68.15 68.74 3hqk h THR 16 CO 0.00 0.33 0.31 -0.07 -0.25 0.00 0.00 175.52 175.84 3hqk h LEU 17 N 1.11 0.99 -0.69 3.87 3.38 -1.73 -0.44 115.31 121.79 3hqk h LEU 17 Ca 0.26 -0.16 -0.04 0.00 0.09 0.00 0.00 57.88 58.03 3hqk h LEU 17 Cb 0.21 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.68 3hqk h LEU 17 CO -0.02 0.88 0.28 0.00 0.09 0.00 0.00 178.44 179.67 3hqk h MET 18 N 1.03 1.02 -0.54 1.13 -0.00 -1.47 1.08 114.93 117.18 3hqk h MET 18 Ca 0.24 -0.18 -0.02 0.00 -0.00 0.00 0.00 59.70 59.74 3hqk h MET 18 Cb 0.18 -0.17 -0.02 0.00 -0.00 0.00 0.00 31.60 31.59 3hqk h MET 18 CO -0.02 0.84 0.24 0.28 -0.00 0.00 0.00 176.91 178.25 3hqk h VAL 19 N 0.97 1.21 -0.59 -0.10 2.07 -0.62 0.77 116.25 119.97 3hqk h VAL 19 Ca 0.23 -0.62 -0.06 0.00 0.82 0.00 0.00 66.70 67.07 3hqk h VAL 19 Cb 0.20 0.62 -0.02 0.00 -1.52 0.00 0.00 31.29 30.56 3hqk h VAL 19 CO -0.02 0.24 0.14 0.77 0.02 0.00 0.00 177.57 178.72 3hqk h SER 20 N 0.72 0.89 -0.71 0.57 4.64 -0.60 -2.76 113.55 116.30 3hqk h SER 20 Ca 0.18 -0.23 0.05 0.00 -0.47 0.00 0.00 61.79 61.32 3hqk h SER 20 Cb 0.16 -0.23 -0.05 0.00 -0.31 0.00 0.00 62.40 61.96 3hqk h SER 20 CO -0.02 0.89 0.42 1.23 -0.87 0.00 0.00 176.83 178.49 3hqk h GLY 21 N 0.85 1.05 2.00 -0.77 0.00 0.21 -2.98 103.07 103.43 3hqk h GLY 21 Ca 0.18 -0.31 0.00 0.00 0.00 0.00 0.00 47.33 47.21 3hqk h GLY 21 CO 0.00 0.21 0.00 0.70 0.00 0.00 0.00 176.54 177.46 3hqk n ASN 22 N -4.72 0.62 -0.04 0.19 5.03 0.26 -2.95 115.26 113.66 3hqk n ASN 22 Ca 0.09 0.62 -0.21 0.00 0.87 0.00 0.00 54.58 55.95 3hqk n ASN 22 Cb 0.15 -0.77 -0.13 0.00 -1.02 0.00 0.00 39.78 38.01 3hqk n ASN 22 CO 0.00 0.00 0.00 0.40 -1.83 0.00 0.00 177.26 175.83 3hqk h ILE 23 N 0.00 0.91 -0.79 2.41 5.03 -1.52 -3.35 117.51 120.20 3hqk h ILE 23 Ca 0.00 -2.30 -0.50 0.00 -0.12 0.00 0.00 64.86 61.94 3hqk h ILE 23 Cb 0.46 2.51 -0.13 0.00 -3.03 0.00 0.00 36.82 36.63 3hqk h ILE 23 CO 0.00 0.61 0.87 0.23 -0.68 0.00 0.00 178.15 179.18 3hqk n MET 24 N -4.03 2.85 0.15 2.37 2.81 -1.15 -4.34 117.12 115.78 3hqk n MET 24 Ca -0.29 -2.28 0.13 0.00 -1.81 0.00 0.00 57.70 53.45 3hqk n MET 24 Cb 0.84 -2.26 0.33 0.00 -0.71 0.00 0.00 33.22 31.42 3hqk n MET 24 CO 0.00 0.00 0.00 0.78 1.51 0.00 0.00 175.97 178.26 3hqk h GLY 25 N 4.70 0.00 -4.14 3.03 0.00 -1.75 -3.23 103.07 101.68 3hqk h GLY 25 Ca 0.45 0.00 -0.26 0.00 0.00 0.00 0.00 47.33 47.52 3hqk h GLY 25 CO 0.92 0.00 -0.99 -1.26 0.00 0.00 0.00 176.54 175.21 3hqk n SER 26 N -2.60 2.06 0.09 0.19 2.88 -1.26 -4.66 113.62 110.32 3hqk n SER 26 Ca 0.05 -2.50 0.04 0.00 -1.33 0.00 0.00 58.87 55.13 3hqk n SER 26 Cb 0.46 -0.42 0.46 0.00 -0.75 0.00 0.00 64.21 63.96 3hqk n SER 26 CO 0.00 0.00 0.00 1.23 -1.23 0.00 0.00 175.04 175.04 3hqk h GLY 27 N 2.00 0.36 0.98 0.46 0.00 -1.84 -2.41 103.07 102.63 3hqk h GLY 27 Ca -0.06 -0.16 -0.34 0.00 0.00 0.00 0.00 47.33 46.78 3hqk h GLY 27 CO 0.25 0.15 -1.71 -0.39 0.00 0.00 0.00 176.54 174.84 3hqk h VAL 28 N 0.34 0.96 0.00 4.60 -1.51 -1.91 -3.31 116.25 115.42 3hqk h VAL 28 Ca 0.09 -2.59 0.00 0.00 -1.23 0.00 0.00 66.70 62.97 3hqk h VAL 28 Cb 0.08 2.71 0.00 0.00 -2.13 0.00 0.00 31.29 31.96 3hqk h VAL 28 CO -0.01 0.83 0.00 0.33 -1.23 0.00 0.00 177.57 177.49 3hqk n PHE 29 N -3.51 0.57 0.03 5.19 7.35 -1.20 -4.23 117.46 121.67 3hqk n PHE 29 Ca -0.23 0.17 -0.04 0.00 -0.76 0.00 0.00 57.45 56.59 3hqk n PHE 29 Cb 1.06 -0.77 -0.02 0.00 0.35 0.00 0.00 39.48 40.10 3hqk n PHE 29 CO 0.00 0.00 0.00 1.25 -0.76 0.00 0.00 176.76 177.25 3hqk h LEU 30 N 0.00 -0.37 -0.62 -2.13 5.85 -1.52 -3.22 115.31 113.30 3hqk h LEU 30 Ca 0.00 0.04 0.22 0.00 0.84 0.00 0.00 57.88 58.97 3hqk h LEU 30 Cb 0.64 0.14 -0.11 0.00 0.37 0.00 0.00 40.66 41.69 3hqk h LEU 30 CO 0.00 -0.14 0.17 0.00 -0.34 0.00 0.00 178.44 178.14 3hqk n LEU 31 N -3.14 0.07 -0.15 2.25 -0.00 -1.26 -0.27 117.00 114.50 3hqk n LEU 31 Ca -0.02 1.05 -0.11 0.00 -0.00 0.00 0.00 56.01 56.92 3hqk n LEU 31 Cb 0.10 -0.45 -0.01 0.00 -0.00 0.00 0.00 43.42 43.06 3hqk n LEU 31 CO 0.04 -1.12 0.68 -0.65 -0.00 0.00 0.00 177.39 176.34 3hqk h PRO 32 N 0.00 0.90 0.00 1.47 0.11 -1.85 -2.83 132.00 129.81 3hqk h PRO 32 Ca 0.45 -0.38 -0.01 0.00 0.11 0.00 0.00 66.00 66.17 3hqk h PRO 32 Cb 1.09 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.17 3hqk h PRO 32 CO -0.53 1.03 -0.05 0.00 -0.21 0.00 0.00 178.00 178.23 3hqk h ALA 33 N 0.85 1.32 0.02 -0.75 0.00 -0.74 -3.13 119.26 116.84 3hqk h ALA 33 Ca 0.10 -0.05 -0.38 0.00 0.00 0.00 0.00 54.91 54.58 3hqk h ALA 33 Cb 0.74 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.47 3hqk h ALA 33 CO 0.06 0.07 -2.19 0.27 0.00 0.00 0.00 179.25 177.46 3hqk n ASN 34 N -3.62 1.98 0.15 0.00 0.23 -1.19 -4.10 115.26 108.71 3hqk n ASN 34 Ca -0.02 0.18 0.19 0.00 -0.53 0.00 0.00 54.58 54.40 3hqk n ASN 34 Cb 0.16 -0.73 0.78 0.00 -2.08 0.00 0.00 39.78 37.91 3hqk n ASN 34 CO 0.00 0.00 0.00 0.17 -0.93 0.00 0.00 177.26 176.50 3hqk h LEU 35 N -0.49 0.00 0.00 -4.53 -0.00 -1.57 0.92 115.31 109.64 3hqk h LEU 35 Ca -0.55 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.33 3hqk h LEU 35 Cb 1.73 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 42.39 3hqk h LEU 35 CO -0.19 0.00 0.00 0.00 -0.00 0.00 0.00 178.44 178.25 3hqk n ALA 36 N -2.27 1.81 -0.95 0.17 0.00 -1.18 -2.00 120.51 116.08 3hqk n ALA 36 Ca 0.05 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.45 3hqk n ALA 36 Cb 0.52 -1.10 0.00 0.00 0.00 0.00 0.00 19.45 18.87 3hqk n ALA 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hqk n ALA 37 N -0.86 0.75 -3.44 0.00 0.00 0.31 -5.05 120.51 112.23 3hqk n ALA 37 Ca 0.05 -0.01 -0.03 0.00 0.00 0.00 0.00 53.44 53.45 3hqk n ALA 37 Cb 0.02 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.42 3hqk n ALA 37 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 3hqk s THR 38 N -0.05 -0.84 0.57 0.00 -1.32 -0.85 -3.94 115.64 109.21 3hqk s THR 38 Ca 0.00 0.02 0.26 0.00 -1.21 0.00 0.00 61.69 60.76 3hqk s THR 38 Cb 0.00 -0.89 0.33 0.00 -1.51 0.00 0.00 72.50 70.44 3hqk s THR 38 CO 0.00 -0.01 2.21 1.23 -2.21 0.00 0.00 174.62 175.84 3hqk h GLY 39 N 8.08 0.00 0.00 6.08 0.00 -1.72 -0.86 103.07 114.65 3hqk h GLY 39 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.14 3hqk h GLY 39 CO 0.19 0.00 -0.16 -1.33 0.00 0.00 0.00 176.54 175.24 3hqk h GLY 40 N 0.00 0.00 2.00 4.60 0.00 -1.91 -3.38 103.07 104.38 3hqk h GLY 40 Ca 0.01 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.34 3hqk h GLY 40 CO -0.00 0.00 -0.01 -2.22 0.00 0.00 0.00 176.54 174.31 3hqk h ILE 41 N -0.61 0.05 -0.49 2.60 2.04 -1.96 -2.12 117.51 117.03 3hqk h ILE 41 Ca 0.00 -0.27 0.03 0.00 1.00 0.00 0.00 64.86 65.62 3hqk h ILE 41 Cb 0.16 1.25 -0.03 0.00 -0.74 0.00 0.00 36.82 37.47 3hqk h ILE 41 CO 0.00 0.01 0.33 0.00 0.00 0.00 0.00 178.15 178.49 3hqk h ALA 42 N 1.99 1.75 -0.90 1.87 0.00 -1.33 -2.09 119.26 120.55 3hqk h ALA 42 Ca -0.00 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.89 3hqk h ALA 42 Cb 0.25 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.84 3hqk h ALA 42 CO 0.00 0.20 0.59 0.82 0.00 0.00 0.00 179.25 180.86 3hqk h ILE 43 N 0.57 1.24 -0.56 0.00 5.03 -1.56 2.90 117.51 125.12 3hqk h ILE 43 Ca 0.19 -0.44 -0.01 0.00 -0.12 0.00 0.00 64.86 64.49 3hqk h ILE 43 Cb 0.08 -0.09 -0.03 0.00 -3.03 0.00 0.00 36.82 33.75 3hqk h ILE 43 CO -0.05 0.23 0.32 0.22 -0.68 0.00 0.00 178.15 178.19 3hqk h TYR 44 N 1.23 0.76 -0.58 1.37 5.03 -1.57 -1.09 116.97 122.12 3hqk h TYR 44 Ca 0.33 -0.01 -0.03 0.00 2.58 0.00 0.00 58.73 61.60 3hqk h TYR 44 Cb -0.13 -0.25 -0.03 0.00 1.55 0.00 0.00 36.73 37.87 3hqk h TYR 44 CO -0.01 0.54 0.24 0.78 -1.32 0.00 0.00 178.16 178.39 3hqk h GLY 45 N 0.76 0.90 1.36 1.82 0.00 -0.86 0.16 103.07 107.21 3hqk h GLY 45 Ca 0.20 -0.45 -0.02 0.00 0.00 0.00 0.00 47.33 47.06 3hqk h GLY 45 CO -0.03 0.43 0.29 -0.25 0.00 0.00 0.00 176.54 176.97 3hqk h TRP 46 N 0.83 0.82 -0.79 5.60 -0.00 0.59 -2.36 115.95 120.64 3hqk h TRP 46 Ca 0.20 -0.02 -0.02 0.00 -0.00 0.00 0.00 58.89 59.04 3hqk h TRP 46 Cb 0.16 -0.26 -0.04 0.00 -0.00 0.00 0.00 29.16 29.02 3hqk h TRP 46 CO 0.01 0.60 0.41 -0.07 -0.00 0.00 0.00 178.44 179.39 3hqk h LEU 47 N 0.83 1.00 -0.40 0.65 3.38 0.53 -2.89 115.31 118.42 3hqk h LEU 47 Ca 0.21 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 3hqk h LEU 47 Cb 0.08 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 3hqk h LEU 47 CO -0.03 0.83 0.23 0.58 0.09 0.00 0.00 178.44 180.14 3hqk h VAL 48 N 1.10 1.14 -0.33 1.22 2.07 -0.90 -3.09 116.25 117.46 3hqk h VAL 48 Ca 0.27 -0.35 -0.01 0.00 0.82 0.00 0.00 66.70 67.43 3hqk h VAL 48 Cb 0.07 0.65 -0.02 0.00 -1.52 0.00 0.00 31.29 30.48 3hqk h VAL 48 CO -0.04 0.15 0.17 0.00 0.02 0.00 0.00 177.57 177.86 3hqk h THR 49 N 0.52 1.11 0.04 2.57 1.03 -1.61 -3.09 112.91 113.48 3hqk h THR 49 Ca 0.14 -0.30 -0.26 0.00 -0.01 0.00 0.00 66.41 65.98 3hqk h THR 49 Cb 0.03 0.68 0.02 0.00 -1.07 0.00 0.00 68.15 67.81 3hqk h THR 49 CO -0.02 0.12 -1.08 0.40 -0.01 0.00 0.00 175.52 174.93 3hqk h ILE 50 N 0.45 1.33 0.90 0.00 2.04 -1.43 -2.62 117.51 118.20 3hqk h ILE 50 Ca 0.12 -2.43 -0.04 0.00 1.00 0.00 0.00 64.86 63.51 3hqk h ILE 50 Cb 0.04 2.51 0.00 0.00 -0.74 0.00 0.00 36.82 38.63 3hqk h ILE 50 CO -0.02 0.74 -0.49 0.40 0.00 0.00 0.00 178.15 178.78 3hqk h ILE 51 N 0.29 0.00 -0.85 -0.67 2.04 -1.54 0.08 117.51 116.85 3hqk h ILE 51 Ca -0.13 0.00 0.18 0.00 1.00 0.00 0.00 64.86 65.91 3hqk h ILE 51 Cb 1.74 0.00 -0.11 0.00 -0.74 0.00 0.00 36.82 37.71 3hqk h ILE 51 CO 0.20 0.00 0.39 1.23 0.00 0.00 0.00 178.15 179.97 3hqk h GLY 52 N -1.28 1.39 2.00 5.37 0.00 -1.65 0.30 103.07 109.20 3hqk h GLY 52 Ca -0.12 -0.19 0.00 0.00 0.00 0.00 0.00 47.33 47.02 3hqk h GLY 52 CO 0.17 -0.15 0.00 0.00 0.00 0.00 0.00 176.54 176.56 3hqk n ALA 53 N -2.48 2.31 0.06 3.60 0.00 -0.99 -1.69 120.51 121.34 3hqk n ALA 53 Ca 0.19 -0.09 -0.09 0.00 0.00 0.00 0.00 53.44 53.44 3hqk n ALA 53 Cb 0.52 -1.47 -0.13 0.00 0.00 0.00 0.00 19.45 18.38 3hqk n ALA 53 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 3hqk h LEU 54 N 0.00 0.09 -0.36 0.00 5.85 0.16 -2.95 115.31 118.10 3hqk h LEU 54 Ca 0.00 -0.10 -0.05 0.00 0.84 0.00 0.00 57.88 58.57 3hqk h LEU 54 Cb 0.53 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.51 3hqk h LEU 54 CO 0.00 1.08 0.04 0.00 -0.34 0.00 0.00 178.44 179.22 3hqk h ALA 55 N 0.90 0.48 -0.66 1.25 0.00 -0.18 -2.67 119.26 118.38 3hqk h ALA 55 Ca -0.06 -0.22 0.05 0.00 0.00 0.00 0.00 54.91 54.68 3hqk h ALA 55 Cb 1.83 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 19.43 3hqk h ALA 55 CO 0.14 0.21 0.38 -0.07 0.00 0.00 0.00 179.25 179.92 3hqk h LEU 56 N 0.45 0.59 -1.23 0.00 3.38 -1.41 -1.10 115.31 115.99 3hqk h LEU 56 Ca 0.11 0.02 0.08 0.00 0.09 0.00 0.00 57.88 58.18 3hqk h LEU 56 Cb 0.40 -0.10 -0.06 0.00 0.09 0.00 0.00 40.66 40.99 3hqk h LEU 56 CO 0.01 0.39 0.56 0.77 0.09 0.00 0.00 178.44 180.26 3hqk h SER 57 N 0.72 0.79 0.08 -0.43 4.64 -1.35 -1.67 113.55 116.34 3hqk h SER 57 Ca 0.29 0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 61.62 3hqk h SER 57 Cb 0.13 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 62.07 3hqk h SER 57 CO -0.16 0.49 -0.04 0.24 -0.87 0.00 0.00 176.83 176.49 3hqk h MET 58 N 0.89 -0.11 -0.66 4.77 2.86 -0.91 0.20 114.93 121.98 3hqk h MET 58 Ca 0.38 0.01 0.07 0.00 -2.06 0.00 0.00 59.70 58.10 3hqk h MET 58 Cb 0.32 0.02 -0.08 0.00 0.06 0.00 0.00 31.60 31.93 3hqk h MET 58 CO -0.15 -0.07 -0.37 0.28 1.06 0.00 0.00 176.91 177.66 3hqk n VAL 59 N -2.42 -0.43 -0.10 -2.22 0.31 -0.55 0.16 118.33 113.07 3hqk n VAL 59 Ca -0.01 1.59 -0.06 0.00 -0.01 0.00 0.00 64.34 65.84 3hqk n VAL 59 Cb 0.04 -1.98 0.02 0.00 -0.91 0.00 0.00 33.84 31.01 3hqk n VAL 59 CO 0.00 0.00 0.00 1.88 -1.32 0.00 0.00 176.83 177.39 3hqk h TYR 60 N 0.00 0.19 -0.52 3.52 0.05 -1.37 0.30 116.97 119.14 3hqk h TYR 60 Ca 0.12 0.02 -0.01 0.00 0.05 0.00 0.00 58.73 58.91 3hqk h TYR 60 Cb 0.29 -0.03 -0.02 0.00 1.01 0.00 0.00 36.73 37.97 3hqk h TYR 60 CO -0.66 0.07 0.29 0.00 -1.05 0.00 0.00 178.16 176.81 3hqk h ALA 61 N 1.24 0.66 -0.45 3.88 0.00 0.44 0.36 119.26 125.38 3hqk h ALA 61 Ca 0.17 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 3hqk h ALA 61 Cb 0.16 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 3hqk h ALA 61 CO -0.18 0.17 0.01 -0.22 0.00 0.00 0.00 179.25 179.03 3hqk h LYS 62 N 0.69 0.79 -0.72 0.00 1.63 0.17 -2.99 116.57 116.14 3hqk h LYS 62 Ca 0.18 -0.24 -0.06 0.00 -0.85 0.00 0.00 60.65 59.68 3hqk h LYS 62 Cb 0.03 -0.08 -0.03 0.00 -0.60 0.00 0.00 32.23 31.56 3hqk h LYS 62 CO -0.03 0.84 0.22 1.98 -3.45 0.00 0.00 179.45 179.01 3hqk h MET 63 N 0.64 1.13 -0.86 1.90 4.05 -0.14 -2.93 114.93 118.71 3hqk h MET 63 Ca 0.13 -0.24 -0.03 0.00 -0.28 0.00 0.00 59.70 59.28 3hqk h MET 63 Cb 0.48 -0.16 -0.04 0.00 -0.80 0.00 0.00 31.60 31.08 3hqk h MET 63 CO 0.02 0.96 0.42 0.66 0.23 0.00 0.00 176.91 179.20 3hqk h SER 64 N 1.08 1.11 -0.80 1.39 4.64 -0.88 -2.55 113.55 117.54 3hqk h SER 64 Ca 0.23 -0.13 -0.03 0.00 -0.47 0.00 0.00 61.79 61.39 3hqk h SER 64 Cb 0.31 -0.29 -0.04 0.00 -0.31 0.00 0.00 62.40 62.08 3hqk h SER 64 CO -0.01 0.93 0.37 0.77 -0.87 0.00 0.00 176.83 178.03 3hqk h SER 65 N 1.22 1.05 -0.00 4.97 4.64 -1.37 -2.67 113.55 121.39 3hqk h SER 65 Ca 0.30 -0.14 -0.09 0.00 -0.47 0.00 0.00 61.79 61.38 3hqk h SER 65 Cb 0.10 -0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 61.91 3hqk h SER 65 CO -0.04 0.90 -0.26 -0.07 -0.87 0.00 0.00 176.83 176.49 3hqk h LEU 66 N 1.13 0.42 -7.65 5.97 4.07 -1.40 -3.43 115.31 114.43 3hqk h LEU 66 Ca 0.27 -0.14 -0.29 0.00 0.08 0.00 0.00 57.88 57.80 3hqk h LEU 66 Cb 0.13 -0.11 -0.31 0.00 1.08 0.00 0.00 40.66 41.44 3hqk h LEU 66 CO -0.03 0.68 -0.73 -0.62 -1.08 0.00 0.00 178.44 176.66 3hqk s ASP 67 N -6.83 0.17 -0.02 -0.43 -1.08 -0.98 -5.04 116.67 102.46 3hqk s ASP 67 Ca -0.06 -0.00 0.19 0.00 -0.52 0.00 0.00 52.55 52.15 3hqk s ASP 67 Cb 0.14 -0.08 0.56 0.00 -1.46 0.00 0.00 42.92 42.08 3hqk s ASP 67 CO 0.78 -0.06 1.47 -2.65 0.52 0.00 0.00 175.17 175.23 3hqk n PRO 68 N 3.68 2.92 -1.95 4.34 -0.02 -1.18 -4.08 135.00 138.72 3hqk n PRO 68 Ca -0.21 -2.53 -0.39 0.00 -2.02 0.00 0.00 63.50 58.34 3hqk n PRO 68 Cb 0.54 -1.54 0.01 0.00 -0.02 0.00 0.00 33.50 32.49 3hqk n PRO 68 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 3hqk s SER 69 N -1.01 5.99 0.25 2.55 1.04 -1.26 -4.74 113.70 116.51 3hqk s SER 69 Ca 0.42 2.72 0.01 0.00 0.48 0.00 0.00 55.95 59.58 3hqk s SER 69 Cb 0.23 -2.64 -0.05 0.00 0.10 0.00 0.00 66.02 63.66 3hqk s SER 69 CO 0.27 -1.08 0.10 -2.16 0.98 0.00 0.00 173.24 171.35 3hqk s PRO 70 N -2.46 1.37 0.20 4.02 0.04 -1.26 -4.23 135.00 132.69 3hqk s PRO 70 Ca 0.61 -1.74 -0.07 0.00 0.04 0.00 0.00 61.00 59.84 3hqk s PRO 70 Cb -0.39 -0.18 0.14 0.00 0.04 0.00 0.00 34.50 34.10 3hqk s PRO 70 CO 0.50 -0.31 1.67 0.78 0.04 0.00 0.00 177.00 179.68 3hqk h GLY 71 N 2.43 1.10 -1.06 0.56 0.00 -1.68 -3.42 103.07 100.98 3hqk h GLY 71 Ca -0.38 -0.78 -0.48 0.00 0.00 0.00 0.00 47.33 45.69 3hqk h GLY 71 CO 0.60 0.72 0.27 -0.32 0.00 0.00 0.00 176.54 177.80 3hqk s GLY 72 N -3.61 1.61 0.00 4.60 0.00 -1.26 0.10 107.32 108.77 3hqk s GLY 72 Ca -0.11 -0.12 0.00 0.00 0.00 0.00 0.00 44.72 44.49 3hqk s GLY 72 CO 0.85 0.36 0.00 -1.26 0.00 0.00 0.00 173.10 173.05 3hqk n SER 73 N -3.81 0.00 -0.18 1.64 2.88 -1.26 -3.92 113.62 108.98 3hqk n SER 73 Ca 0.07 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.50 3hqk n SER 73 Cb 0.56 0.00 0.01 0.00 -0.75 0.00 0.00 64.21 64.02 3hqk n SER 73 CO 0.00 0.00 0.00 0.22 -1.23 0.00 0.00 175.04 174.03 3hqk h TYR 74 N 0.00 1.10 -0.67 0.66 3.20 -1.93 -2.89 116.97 116.44 3hqk h TYR 74 Ca 0.00 -0.23 -0.05 0.00 3.14 0.00 0.00 58.73 61.59 3hqk h TYR 74 Cb 0.00 -0.27 -0.03 0.00 1.54 0.00 0.00 36.73 37.97 3hqk h TYR 74 CO 0.00 1.04 0.21 0.00 -1.64 0.00 0.00 178.16 177.76 3hqk h ALA 75 N 0.91 1.11 -0.82 1.82 0.00 -1.91 0.89 119.26 121.25 3hqk h ALA 75 Ca 0.13 -0.21 0.01 0.00 0.00 0.00 0.00 54.91 54.84 3hqk h ALA 75 Cb 0.67 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 18.16 3hqk h ALA 75 CO 0.05 0.61 0.54 1.88 0.00 0.00 0.00 179.25 182.33 3hqk h TYR 76 N 0.99 1.03 -0.34 0.00 -1.99 -1.77 0.27 116.97 115.16 3hqk h TYR 76 Ca 0.22 0.02 -0.12 0.00 2.00 0.00 0.00 58.73 60.85 3hqk h TYR 76 Cb 0.28 -0.35 -0.01 0.00 2.00 0.00 0.00 36.73 38.66 3hqk h TYR 76 CO 0.02 0.65 -0.27 0.00 -0.00 0.00 0.00 178.16 178.56 3hqk h ALA 77 N 1.30 0.49 -0.43 3.88 0.00 -1.24 -1.26 119.26 122.00 3hqk h ALA 77 Ca 0.30 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.81 3hqk h ALA 77 Cb -0.13 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 3hqk h ALA 77 CO -0.06 0.50 0.28 -0.09 0.00 0.00 0.00 179.25 179.88 3hqk h ARG 78 N 0.57 0.57 -0.30 0.00 2.43 0.05 0.43 114.38 118.13 3hqk h ARG 78 Ca 0.06 -0.04 -0.06 0.00 -0.81 0.00 0.00 59.98 59.13 3hqk h ARG 78 Cb 0.84 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 30.26 3hqk h ARG 78 CO 0.07 0.39 -0.06 0.00 -1.51 0.00 0.00 179.97 178.86 3hqk h ARG 79 N 0.58 0.58 -0.42 0.20 3.08 -0.49 0.25 114.38 118.16 3hqk h ARG 79 Ca 0.16 -0.22 -0.06 0.00 0.07 0.00 0.00 59.98 59.93 3hqk h ARG 79 Cb -0.05 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 29.95 3hqk h ARG 79 CO -0.03 0.76 0.03 0.00 -1.07 0.00 0.00 179.97 179.66 3hqk n PHE 81 N -4.46 0.00 0.00 0.00 3.01 0.15 -5.02 117.46 111.14 3hqk n PHE 81 Ca -0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 3hqk n PHE 81 Cb 0.27 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.74 3hqk n PHE 81 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3hqk n GLY 82 N 0.69 0.41 0.14 1.37 0.00 0.88 -4.63 105.19 104.05 3hqk n GLY 82 Ca 0.01 -1.80 -0.30 0.00 0.00 0.00 0.00 46.02 43.93 3hqk n GLY 82 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3hqk n PRO 83 N 0.00 0.59 -0.24 1.61 -0.05 -1.26 -3.49 135.00 132.15 3hqk n PRO 83 Ca 0.00 0.27 0.04 0.00 -0.05 0.00 0.00 63.50 63.76 3hqk n PRO 83 Cb 0.00 -1.50 0.17 0.00 -0.05 0.00 0.00 33.50 32.12 3hqk n PRO 83 CO 0.00 0.00 0.00 0.35 -0.05 0.00 0.00 175.50 175.80 3hqk h PHE 84 N -1.00 0.38 -0.00 0.54 3.57 -1.96 1.02 116.94 119.49 3hqk h PHE 84 Ca -0.70 0.04 0.00 0.00 3.53 0.00 0.00 57.97 60.84 3hqk h PHE 84 Cb 1.61 -0.06 0.00 0.00 2.79 0.00 0.00 35.95 40.29 3hqk h PHE 84 CO -0.09 0.00 -0.24 1.28 -2.23 0.00 0.00 178.31 177.03 3hqk n LEU 85 N -5.07 0.42 0.06 0.59 4.77 -1.26 -2.79 117.00 113.72 3hqk n LEU 85 Ca 0.13 0.10 -0.15 0.00 -0.03 0.00 0.00 56.01 56.07 3hqk n LEU 85 Cb 0.41 -0.28 -0.06 0.00 -2.33 0.00 0.00 43.42 41.16 3hqk n LEU 85 CO 0.16 0.09 0.16 1.23 -1.33 0.00 0.00 177.39 177.70 3hqk h GLY 86 N 4.98 0.51 0.61 -0.72 0.00 0.76 -3.23 103.07 105.99 3hqk h GLY 86 Ca 0.00 -0.91 -0.01 0.00 0.00 0.00 0.00 47.33 46.41 3hqk h GLY 86 CO 0.00 0.80 -0.09 -1.82 0.00 0.00 0.00 176.54 175.43 3hqk h TYR 87 N 0.26 -0.24 -0.83 5.60 -0.00 -0.09 -3.21 116.97 118.45 3hqk h TYR 87 Ca -0.09 -0.01 0.02 0.00 -0.00 0.00 0.00 58.73 58.66 3hqk h TYR 87 Cb 1.61 0.08 -0.05 0.00 -0.00 0.00 0.00 36.73 38.37 3hqk h TYR 87 CO 0.07 0.12 0.54 0.37 -0.00 0.00 0.00 178.16 179.26 3hqk h GLN 88 N -0.66 1.04 -0.65 1.82 4.15 -1.65 -2.79 115.11 116.38 3hqk h GLN 88 Ca -0.03 -0.06 -0.02 0.00 0.77 0.00 0.00 58.65 59.31 3hqk h GLN 88 Cb 0.47 -0.23 -0.03 0.00 0.21 0.00 0.00 27.48 27.90 3hqk h GLN 88 CO 0.04 0.69 0.31 1.79 -1.93 0.00 0.00 178.83 179.73 3hqk h THR 89 N 1.07 1.22 -0.49 2.39 1.35 -1.60 -0.83 112.91 116.02 3hqk h THR 89 Ca 0.32 -0.63 -0.03 0.00 -0.55 0.00 0.00 66.41 65.52 3hqk h THR 89 Cb -0.05 0.44 -0.02 0.00 -1.73 0.00 0.00 68.15 66.79 3hqk h THR 89 CO -0.09 0.26 0.20 -1.13 -0.25 0.00 0.00 175.52 174.50 3hqk h ASN 90 N 0.89 0.68 -0.59 5.36 -1.24 -1.52 0.96 115.58 120.11 3hqk h ASN 90 Ca 0.22 -0.17 -0.04 0.00 0.71 0.00 0.00 56.30 57.02 3hqk h ASN 90 Cb 0.13 -0.18 -0.03 0.00 0.73 0.00 0.00 38.32 38.97 3hqk h ASN 90 CO -0.03 0.66 0.20 -0.37 -1.29 0.00 0.00 177.43 176.60 3hqk h VAL 91 N 0.65 1.24 -0.64 2.57 -1.51 -1.38 2.23 116.25 119.41 3hqk h VAL 91 Ca 0.16 -0.80 -0.07 0.00 -1.23 0.00 0.00 66.70 64.77 3hqk h VAL 91 Cb 0.19 0.64 -0.03 0.00 -2.13 0.00 0.00 31.29 29.97 3hqk h VAL 91 CO -0.01 0.30 0.14 -0.07 -1.23 0.00 0.00 177.57 176.70 3hqk h LEU 92 N 0.83 0.97 0.00 4.19 3.38 -0.70 0.23 115.31 124.21 3hqk h LEU 92 Ca 0.19 -0.20 -0.23 0.00 0.09 0.00 0.00 57.88 57.73 3hqk h LEU 92 Cb 0.27 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.73 3hqk h LEU 92 CO -0.01 0.94 -1.24 0.22 0.09 0.00 0.00 178.44 178.44 3hqk h TYR 93 N 0.97 0.00 0.59 1.13 3.20 0.15 -2.26 116.97 120.75 3hqk h TYR 93 Ca 0.20 0.00 -0.03 0.00 3.14 0.00 0.00 58.73 62.04 3hqk h TYR 93 Cb 0.36 0.00 0.01 0.00 1.54 0.00 0.00 36.73 38.64 3hqk h TYR 93 CO 0.03 0.97 -0.28 2.35 -1.64 0.00 0.00 178.16 179.58 3hqk h TRP 94 N 0.00 -0.74 -0.49 -3.82 7.01 0.39 -1.92 115.95 116.38 3hqk h TRP 94 Ca -0.11 -0.02 0.04 0.00 2.11 0.00 0.00 58.89 60.92 3hqk h TRP 94 Cb 1.84 0.24 -0.06 0.00 -2.10 0.00 0.00 29.16 29.08 3hqk h TRP 94 CO 0.00 -0.46 -0.29 1.28 -2.79 0.00 0.00 178.44 176.18 3hqk n LEU 95 N -4.37 -0.52 -0.47 0.65 4.77 0.06 0.12 117.00 117.25 3hqk n LEU 95 Ca -0.10 1.28 0.41 0.00 -0.03 0.00 0.00 56.01 57.57 3hqk n LEU 95 Cb 0.31 -0.31 0.77 0.00 -2.33 0.00 0.00 43.42 41.86 3hqk n LEU 95 CO 0.24 -0.91 1.38 0.00 -1.33 0.00 0.00 177.39 176.76 3hqk h ALA 96 N -0.16 3.35 -0.06 -1.18 0.00 -1.42 -1.46 119.26 118.32 3hqk h ALA 96 Ca 0.08 -0.04 -0.15 0.00 0.00 0.00 0.00 54.91 54.80 3hqk h ALA 96 Cb 0.20 0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.11 3hqk h ALA 96 CO -0.46 -1.78 -0.53 0.00 0.00 0.00 0.00 179.25 176.48 3hqk n TRP 98 N -4.24 0.61 -0.36 0.00 4.27 -0.61 -3.04 117.44 114.06 3hqk n TRP 98 Ca -0.09 0.18 0.04 0.00 -3.89 0.00 0.00 57.50 53.73 3hqk n TRP 98 Cb 0.62 -1.07 0.19 0.00 -1.36 0.00 0.00 31.31 29.68 3hqk n TRP 98 CO 0.00 0.00 0.00 0.82 -2.29 0.00 0.00 177.69 176.22 3hqk h ILE 99 N -0.40 1.04 -0.69 -1.67 2.04 -1.61 -0.01 117.51 116.21 3hqk h ILE 99 Ca -0.51 -0.38 0.01 0.00 1.00 0.00 0.00 64.86 64.98 3hqk h ILE 99 Cb 1.76 -0.17 -0.03 0.00 -0.74 0.00 0.00 36.82 37.63 3hqk h ILE 99 CO -0.13 0.20 0.45 1.23 0.00 0.00 0.00 178.15 179.91 3hqk h GLY 100 N 1.11 0.96 1.01 5.37 0.00 -1.74 -2.08 103.07 107.70 3hqk h GLY 100 Ca 0.44 -0.35 -0.01 0.00 0.00 0.00 0.00 47.33 47.41 3hqk h GLY 100 CO -0.20 0.34 0.40 3.43 0.00 0.00 0.00 176.54 180.52 3hqk h ASN 101 N 0.91 0.91 -0.61 0.19 4.21 -0.92 -0.55 115.58 119.72 3hqk h ASN 101 Ca 0.26 -0.09 -0.05 0.00 1.21 0.00 0.00 56.30 57.62 3hqk h ASN 101 Cb -0.07 -0.23 -0.03 0.00 -1.12 0.00 0.00 38.32 36.87 3hqk h ASN 101 CO -0.06 0.74 0.20 0.40 -1.29 0.00 0.00 177.43 177.42 3hqk h ILE 102 N 1.01 1.24 -0.58 2.81 2.04 -1.13 0.16 117.51 123.05 3hqk h ILE 102 Ca 0.26 -0.83 -0.00 0.00 1.00 0.00 0.00 64.86 65.29 3hqk h ILE 102 Cb 0.03 0.62 -0.03 0.00 -0.74 0.00 0.00 36.82 36.70 3hqk h ILE 102 CO -0.04 0.32 0.36 0.00 0.00 0.00 0.00 178.15 178.78 3hqk h ALA 103 N 1.07 0.74 -0.77 1.87 0.00 -0.90 -1.95 119.26 119.33 3hqk h ALA 103 Ca 0.20 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 3hqk h ALA 103 Cb 0.28 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 17.80 3hqk h ALA 103 CO -0.01 0.21 0.44 0.52 0.00 0.00 0.00 179.25 180.41 3hqk h MET 104 N 0.79 1.05 -0.66 0.00 2.86 -0.63 -2.67 114.93 115.66 3hqk h MET 104 Ca 0.21 -0.10 -0.02 0.00 -2.06 0.00 0.00 59.70 57.73 3hqk h MET 104 Cb -0.04 -0.22 -0.03 0.00 0.06 0.00 0.00 31.60 31.38 3hqk h MET 104 CO -0.04 0.75 0.35 0.28 1.06 0.00 0.00 176.91 179.31 3hqk h VAL 105 N 1.06 1.20 -0.84 -2.22 2.07 -0.34 -2.85 116.25 114.34 3hqk h VAL 105 Ca 0.27 -0.53 0.00 0.00 0.82 0.00 0.00 66.70 67.26 3hqk h VAL 105 Cb -0.01 0.32 -0.04 0.00 -1.52 0.00 0.00 31.29 30.05 3hqk h VAL 105 CO -0.05 0.23 0.52 0.58 0.02 0.00 0.00 177.57 178.88 3hqk h VAL 106 N 0.93 1.23 0.00 2.57 2.07 -1.01 -2.79 116.25 119.25 3hqk h VAL 106 Ca 0.23 -0.47 -0.12 0.00 0.82 0.00 0.00 66.70 67.17 3hqk h VAL 106 Cb 0.05 0.03 -0.02 0.00 -1.52 0.00 0.00 31.29 29.83 3hqk h VAL 106 CO -0.04 0.23 -0.57 0.40 0.02 0.00 0.00 177.57 177.62 3hqk h ILE 107 N 1.14 1.32 -0.01 4.57 5.03 -1.68 -0.63 117.51 127.25 3hqk h ILE 107 Ca 0.30 -2.00 -0.00 0.00 -0.12 0.00 0.00 64.86 63.04 3hqk h ILE 107 Cb -0.08 2.10 -0.00 0.00 -3.03 0.00 0.00 36.82 35.81 3hqk h ILE 107 CO -0.06 0.55 -0.00 1.23 -0.68 0.00 0.00 178.15 179.19 3hqk h GLY 108 N 1.92 0.03 0.67 5.37 0.00 -1.32 -1.65 103.07 108.09 3hqk h GLY 108 Ca -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 47.33 47.31 3hqk h GLY 108 CO 0.07 0.02 -0.28 -2.08 0.00 0.00 0.00 176.54 174.28 3hqk h VAL 109 N -0.28 0.41 -0.99 4.60 2.07 -1.44 -3.08 116.25 117.53 3hqk h VAL 109 Ca 0.00 0.00 0.26 0.00 0.82 0.00 0.00 66.70 67.78 3hqk h VAL 109 Cb 0.32 0.41 -0.13 0.00 -1.52 0.00 0.00 31.29 30.38 3hqk h VAL 109 CO 0.00 0.00 0.56 1.23 0.02 0.00 0.00 177.57 179.38 3hqk h GLY 110 N -0.57 1.90 1.01 2.17 0.00 -0.96 1.08 103.07 107.70 3hqk h GLY 110 Ca -0.01 -0.28 -0.02 0.00 0.00 0.00 0.00 47.33 47.03 3hqk h GLY 110 CO -0.07 -0.30 0.39 -0.97 0.00 0.00 0.00 176.54 175.58 3hqk h TYR 111 N 0.50 1.01 -0.86 5.60 -1.99 -1.21 -0.16 116.97 119.85 3hqk h TYR 111 Ca 0.66 -0.03 -0.00 0.00 2.00 0.00 0.00 58.73 61.35 3hqk h TYR 111 Cb 1.31 -0.32 -0.04 0.00 2.00 0.00 0.00 36.73 39.67 3hqk h TYR 111 CO -0.02 0.73 0.54 -0.07 -0.00 0.00 0.00 178.16 179.33 3hqk h LEU 112 N 1.01 1.02 -0.49 3.88 3.38 0.11 -0.66 115.31 123.56 3hqk h LEU 112 Ca 0.25 -0.05 -0.13 0.00 0.09 0.00 0.00 57.88 58.04 3hqk h LEU 112 Cb 0.06 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 3hqk h LEU 112 CO -0.04 0.78 -0.19 0.28 0.09 0.00 0.00 178.44 179.36 3hqk h SER 113 N 1.18 1.02 0.73 -0.43 0.02 -0.15 -2.28 113.55 113.63 3hqk h SER 113 Ca 0.31 -0.39 0.00 0.00 -0.84 0.00 0.00 61.79 60.88 3hqk h SER 113 Cb -0.07 -0.28 0.00 0.00 0.14 0.00 0.00 62.40 62.19 3hqk h SER 113 CO -0.06 1.18 0.00 0.00 -1.14 0.00 0.00 176.83 176.81 3hqk n TYR 114 N -4.13 0.74 -0.34 3.45 9.36 -0.13 -2.86 117.16 123.25 3hqk n TYR 114 Ca 0.00 0.29 -0.03 0.00 3.32 0.00 0.00 57.90 61.48 3hqk n TYR 114 Cb 0.45 -0.97 0.09 0.00 -0.63 0.00 0.00 39.34 38.28 3hqk n TYR 114 CO 0.00 0.00 0.00 0.35 0.22 0.00 0.00 176.86 177.43 3hqk h PHE 115 N 0.00 1.18 0.00 2.98 3.57 -0.51 -3.33 116.94 120.82 3hqk h PHE 115 Ca 0.00 0.02 -0.38 0.00 3.53 0.00 0.00 57.97 61.14 3hqk h PHE 115 Cb 0.36 -0.39 -0.06 0.00 2.79 0.00 0.00 35.95 38.65 3hqk h PHE 115 CO 0.00 0.76 -2.18 0.34 -2.23 0.00 0.00 178.31 174.99 3hqk n PHE 116 N -4.42 0.14 -2.26 0.41 7.35 -1.17 -4.75 117.46 112.76 3hqk n PHE 116 Ca 0.10 0.06 -0.41 0.00 -0.76 0.00 0.00 57.45 56.45 3hqk n PHE 116 Cb 0.03 -0.95 -0.03 0.00 0.35 0.00 0.00 39.48 38.88 3hqk n PHE 116 CO 0.00 0.00 0.00 -1.25 -0.76 0.00 0.00 176.76 174.75 3hqk s PRO 117 N -2.53 4.46 0.27 -7.13 0.04 -1.21 -5.04 135.00 123.85 3hqk s PRO 117 Ca -0.36 2.04 -0.03 0.00 0.04 0.00 0.00 61.00 62.69 3hqk s PRO 117 Cb 0.12 -3.14 0.36 0.00 0.04 0.00 0.00 34.50 31.88 3hqk s PRO 117 CO 0.49 -0.07 1.90 0.82 0.04 0.00 0.00 177.00 180.17 3hqk h ILE 118 N 3.23 1.23 0.00 0.56 2.04 -1.72 -3.46 117.51 119.39 3hqk h ILE 118 Ca -0.47 -0.57 0.00 0.00 1.00 0.00 0.00 64.86 64.82 3hqk h ILE 118 Cb 1.22 0.17 0.00 0.00 -0.74 0.00 0.00 36.82 37.47 3hqk h ILE 118 CO 0.69 0.26 0.00 0.18 0.00 0.00 0.00 178.15 179.27 3hqk n LEU 119 N -4.35 0.00 0.00 1.44 4.77 -1.26 -5.10 117.00 112.49 3hqk n LEU 119 Ca 0.08 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.06 3hqk n LEU 119 Cb 0.10 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.19 3hqk n LEU 119 CO 0.38 0.00 -0.20 2.29 -1.33 0.00 0.00 177.39 178.53 3hqk n LYS 120 N -0.30 0.00 -4.21 3.23 2.85 -1.26 -4.30 118.16 114.17 3hqk n LYS 120 Ca 0.00 0.00 -0.12 0.00 -1.05 0.00 0.00 58.31 57.14 3hqk n LYS 120 Cb 0.00 -0.62 -0.10 0.00 -0.65 0.00 0.00 35.03 33.66 3hqk n LYS 120 CO 0.00 0.00 0.00 0.16 -0.05 0.00 0.00 177.40 177.51 3hqk s ASP 121 N -3.67 1.22 0.10 -5.58 -4.77 -1.26 -4.12 116.67 98.60 3hqk s ASP 121 Ca 0.00 -1.09 -0.14 0.00 -3.30 0.00 0.00 52.55 48.02 3hqk s ASP 121 Cb 0.00 0.10 0.03 0.00 -1.09 0.00 0.00 42.92 41.95 3hqk s ASP 121 CO 0.00 -0.51 0.34 -2.16 0.70 0.00 0.00 175.17 173.55 3hqk s PRO 122 N -3.87 0.98 -0.06 2.11 0.04 -1.26 -4.85 135.00 128.09 3hqk s PRO 122 Ca 0.18 -0.73 0.00 0.00 0.04 0.00 0.00 61.00 60.49 3hqk s PRO 122 Cb 0.05 0.42 0.00 0.00 0.04 0.00 0.00 34.50 35.02 3hqk s PRO 122 CO -0.00 -0.36 0.00 -0.11 0.04 0.00 0.00 177.00 176.57 3hqk n LEU 123 N -0.07 0.44 0.00 -3.56 7.94 -1.26 -4.58 117.00 115.91 3hqk n LEU 123 Ca -0.16 0.01 -0.01 0.00 -1.11 0.00 0.00 56.01 54.75 3hqk n LEU 123 Cb 0.63 -1.51 -0.00 0.00 0.53 0.00 0.00 43.42 43.07 3hqk n LEU 123 CO 0.19 -0.50 -0.45 0.52 -1.11 0.00 0.00 177.39 176.03 3hqk n VAL 124 N -2.51 0.19 -0.17 1.96 0.31 -1.26 -4.53 118.33 112.32 3hqk n VAL 124 Ca -0.01 0.05 -0.09 0.00 -0.01 0.00 0.00 64.34 64.28 3hqk n VAL 124 Cb 0.25 -1.52 0.00 0.00 -0.91 0.00 0.00 33.84 31.67 3hqk n VAL 124 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 3hqk h LEU 125 N -0.02 0.74 -0.18 7.52 6.46 -1.81 -0.38 115.31 127.64 3hqk h LEU 125 Ca -0.01 -0.24 0.00 0.00 -0.12 0.00 0.00 57.88 57.51 3hqk h LEU 125 Cb 0.88 -0.20 0.00 0.00 -0.73 0.00 0.00 40.66 40.62 3hqk h LEU 125 CO -0.01 0.79 0.00 0.35 -0.62 0.00 0.00 178.44 178.95 3hqk n THR 126 N -4.46 1.13 -0.06 1.05 -2.24 -1.26 -0.14 114.28 108.30 3hqk n THR 126 Ca 0.01 0.31 -0.22 0.00 -2.27 0.00 0.00 64.05 61.88 3hqk n THR 126 Cb 0.23 -1.14 -0.13 0.00 -2.10 0.00 0.00 70.33 67.20 3hqk n THR 126 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 3hqk n LEU 127 N -1.66 2.22 0.30 3.22 4.77 -0.70 -2.62 117.00 122.53 3hqk n LEU 127 Ca 0.03 0.32 0.18 0.00 -0.03 0.00 0.00 56.01 56.50 3hqk n LEU 127 Cb 0.15 -1.03 0.93 0.00 -2.33 0.00 0.00 43.42 41.14 3hqk n LEU 127 CO 0.12 0.55 1.08 0.71 -1.33 0.00 0.00 177.39 178.52 3hqk h THR 128 N -0.51 0.23 0.00 -5.08 1.35 -0.67 0.43 112.91 108.66 3hqk h THR 128 Ca -0.40 -0.27 0.00 0.00 -0.55 0.00 0.00 66.41 65.20 3hqk h THR 128 Cb 1.65 1.21 0.00 0.00 -1.73 0.00 0.00 68.15 69.27 3hqk h THR 128 CO -0.08 0.04 0.00 0.00 -0.25 0.00 0.00 175.52 175.22 3hqk h VAL 130 N 0.00 0.10 0.00 0.00 2.07 -1.27 0.19 116.25 117.34 3hqk h VAL 130 Ca 0.00 -0.01 0.00 0.00 0.82 0.00 0.00 66.70 67.51 3hqk h VAL 130 Cb 0.00 0.07 0.00 0.00 -1.52 0.00 0.00 31.29 29.84 3hqk h VAL 130 CO 0.00 0.01 0.00 0.00 0.02 0.00 0.00 177.57 177.60 3hqk n ALA 131 N -2.74 -0.36 0.28 1.67 0.00 0.15 -3.32 120.51 116.19 3hqk n ALA 131 Ca 0.39 0.00 0.18 0.00 0.00 0.00 0.00 53.44 54.01 3hqk n ALA 131 Cb 1.69 0.00 0.96 0.00 0.00 0.00 0.00 19.45 22.10 3hqk n ALA 131 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.50 177.26 3hqk h VAL 132 N 0.00 0.28 0.00 0.00 3.04 0.32 -1.59 116.25 118.31 3hqk h VAL 132 Ca 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.69 3hqk h VAL 132 Cb 0.00 0.89 0.00 0.00 -2.01 0.00 0.00 31.29 30.17 3hqk h VAL 132 CO 0.00 0.00 0.00 0.18 -1.01 0.00 0.00 177.57 176.74 3hqk n LEU 133 N -3.48 0.00 0.24 3.16 4.77 0.24 -2.78 117.00 119.15 3hqk n LEU 133 Ca -0.01 0.97 0.17 0.00 -0.03 0.00 0.00 56.01 57.10 3hqk n LEU 133 Cb 0.21 -0.47 0.86 0.00 -2.33 0.00 0.00 43.42 41.69 3hqk n LEU 133 CO 0.23 -0.47 1.00 -0.50 -1.33 0.00 0.00 177.39 176.32 3hqk h TRP 134 N 0.00 0.00 -0.45 -1.77 4.06 -1.29 0.73 115.95 117.23 3hqk h TRP 134 Ca 0.00 0.00 0.08 0.00 2.06 0.00 0.00 58.89 61.03 3hqk h TRP 134 Cb 0.00 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.14 3hqk h TRP 134 CO -0.29 0.00 0.31 0.82 -3.56 0.00 0.00 178.44 175.72 3hqk h ILE 135 N 0.00 0.90 0.02 1.49 5.03 -1.31 -1.46 117.51 122.19 3hqk h ILE 135 Ca 0.00 -0.09 -0.38 0.00 -0.12 0.00 0.00 64.86 64.27 3hqk h ILE 135 Cb 0.07 0.63 -0.06 0.00 -3.03 0.00 0.00 36.82 34.43 3hqk h ILE 135 CO 0.00 0.05 -2.36 0.49 -0.68 0.00 0.00 178.15 175.65 3hqk n PHE 136 N -4.46 0.23 0.06 1.37 3.72 0.24 -2.77 117.46 115.85 3hqk n PHE 136 Ca 0.07 0.06 0.01 0.00 -0.05 0.00 0.00 57.45 57.53 3hqk n PHE 136 Cb 0.34 -1.03 0.03 0.00 -0.94 0.00 0.00 39.48 37.87 3hqk n PHE 136 CO 0.00 0.00 0.00 1.55 -0.05 0.00 0.00 176.76 178.26 3hqk n VAL 137 N -3.20 0.64 -0.19 -4.37 3.14 -0.46 -0.95 118.33 112.94 3hqk n VAL 137 Ca -0.40 0.16 0.00 0.00 -2.96 0.00 0.00 64.34 61.14 3hqk n VAL 137 Cb 1.03 -1.14 0.00 0.00 -1.06 0.00 0.00 33.84 32.67 3hqk n VAL 137 CO 0.00 0.00 0.00 0.18 -6.46 0.00 0.00 176.83 170.55 3hqk n LEU 138 N -1.17 1.39 -0.00 6.55 4.77 -0.56 -4.05 117.00 123.93 3hqk n LEU 138 Ca 0.01 -1.39 0.09 0.00 -0.03 0.00 0.00 56.01 54.68 3hqk n LEU 138 Cb 0.01 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 40.98 3hqk n LEU 138 CO 0.01 0.35 -0.33 0.18 -1.33 0.00 0.00 177.39 176.27 3hqk n LEU 139 N -0.29 0.47 -0.07 2.23 4.77 -0.12 -3.80 117.00 120.19 3hqk n LEU 139 Ca 0.00 -0.29 -0.10 0.00 -0.03 0.00 0.00 56.01 55.60 3hqk n LEU 139 Cb 0.22 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.23 3hqk n LEU 139 CO 0.00 0.12 0.14 0.78 -1.33 0.00 0.00 177.39 177.10 3hqk h ASN 140 N 0.00 0.00 -2.95 -1.43 4.21 -1.71 -3.29 115.58 110.41 3hqk h ASN 140 Ca 0.00 -0.58 -0.71 0.00 1.21 0.00 0.00 56.30 56.22 3hqk h ASN 140 Cb 0.58 0.00 -0.21 0.00 -1.12 0.00 0.00 38.32 37.58 3hqk h ASN 140 CO 0.00 0.87 0.10 -0.51 -1.29 0.00 0.00 177.43 176.59 3hqk s ILE 141 N -2.01 4.90 0.05 2.81 2.07 -1.26 -0.94 121.20 126.82 3hqk s ILE 141 Ca -0.13 -1.15 0.06 0.00 -1.41 0.00 0.00 60.65 58.02 3hqk s ILE 141 Cb -0.01 -4.48 -0.02 0.00 0.13 0.00 0.00 42.46 38.07 3hqk s ILE 141 CO 0.43 -1.10 -0.18 -0.69 -1.91 0.00 0.00 174.94 171.49 3hqk s VAL 142 N 2.43 1.42 0.00 4.00 1.01 -1.25 -4.26 120.40 123.75 3hqk s VAL 142 Ca 0.11 -1.15 0.00 0.00 0.00 0.00 0.00 61.98 60.94 3hqk s VAL 142 Cb -0.24 -1.26 0.00 0.00 0.00 0.00 0.00 36.38 34.88 3hqk s VAL 142 CO 0.04 0.08 0.00 0.61 0.00 0.00 0.00 175.10 175.84 3hqk n GLY 143 N 1.77 -0.02 0.46 4.51 0.00 -0.12 -4.82 105.19 106.98 3hqk n GLY 143 Ca -0.18 -0.27 0.29 0.00 0.00 0.00 0.00 46.02 45.86 3hqk n GLY 143 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3hqk h PRO 144 N 0.00 0.18 -0.40 1.61 0.11 -1.79 0.98 132.00 132.70 3hqk h PRO 144 Ca 0.00 -0.01 -0.12 0.00 0.11 0.00 0.00 66.00 65.98 3hqk h PRO 144 Cb 0.00 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 31.06 3hqk h PRO 144 CO 0.00 0.12 -0.20 0.87 -0.21 0.00 0.00 178.00 178.58 3hqk h LYS 145 N 0.19 0.84 0.00 1.05 1.79 -1.92 -3.24 116.57 115.28 3hqk h LYS 145 Ca 0.57 -0.37 0.00 0.00 -2.18 0.00 0.00 60.65 58.67 3hqk h LYS 145 Cb 1.86 -0.02 0.00 0.00 -1.58 0.00 0.00 32.23 32.49 3hqk h LYS 145 CO -0.16 1.01 0.00 -0.12 -1.08 0.00 0.00 179.45 179.10 3hqk n MET 146 N -4.23 0.00 -0.28 3.15 1.56 0.33 -1.09 117.12 116.56 3hqk n MET 146 Ca -0.02 0.69 0.04 0.00 -0.27 0.00 0.00 57.70 58.14 3hqk n MET 146 Cb 0.43 -1.46 0.18 0.00 2.15 0.00 0.00 33.22 34.51 3hqk n MET 146 CO 0.00 0.00 0.00 -0.84 -0.73 0.00 0.00 175.97 174.40 3hqk h ILE 147 N 0.00 0.83 -0.42 1.12 3.07 -1.27 0.38 117.51 121.22 3hqk h ILE 147 Ca 0.00 -0.23 -0.03 0.00 1.55 0.00 0.00 64.86 66.15 3hqk h ILE 147 Cb 0.00 0.10 -0.02 0.00 -0.27 0.00 0.00 36.82 36.63 3hqk h ILE 147 CO 0.00 0.12 0.16 0.71 -1.05 0.00 0.00 178.15 178.09 3hqk h THR 148 N 0.67 1.21 -0.46 0.16 1.35 -1.58 -1.47 112.91 112.79 3hqk h THR 148 Ca 0.40 -0.65 0.09 0.00 -0.55 0.00 0.00 66.41 65.70 3hqk h THR 148 Cb 0.46 0.84 -0.08 0.00 -1.73 0.00 0.00 68.15 67.64 3hqk h THR 148 CO -0.29 0.24 -0.01 0.03 -0.25 0.00 0.00 175.52 175.23 3hqk h ARG 149 N 0.54 0.10 -0.99 4.72 3.08 0.41 -3.07 114.38 119.16 3hqk h ARG 149 Ca 0.14 -0.01 0.18 0.00 0.07 0.00 0.00 59.98 60.36 3hqk h ARG 149 Cb 0.21 -0.02 -0.10 0.00 0.08 0.00 0.00 29.97 30.14 3hqk h ARG 149 CO -0.01 0.06 0.61 0.28 -1.07 0.00 0.00 179.97 179.85 3hqk h VAL 150 N 0.10 0.74 -3.67 2.04 2.07 0.79 -3.25 116.25 115.07 3hqk h VAL 150 Ca 0.23 -0.26 -0.69 0.00 0.82 0.00 0.00 66.70 66.80 3hqk h VAL 150 Cb 0.34 -0.09 -0.30 0.00 -1.52 0.00 0.00 31.29 29.73 3hqk h VAL 150 CO -0.39 0.14 -0.65 0.00 0.02 0.00 0.00 177.57 176.68 3hqk s GLN 151 N -5.82 2.66 0.00 1.57 -2.07 -1.16 -2.63 119.66 112.21 3hqk s GLN 151 Ca -0.11 -1.13 0.00 0.00 -1.82 0.00 0.00 55.36 52.30 3hqk s GLN 151 Cb 0.24 -3.31 0.00 0.00 -1.09 0.00 0.00 33.01 28.86 3hqk s GLN 151 CO 0.80 -0.59 0.00 0.00 -1.32 0.00 0.00 175.29 174.19 3hqk n ALA 152 N 4.75 0.00 -0.19 2.60 0.00 -1.23 -4.48 120.51 121.95 3hqk n ALA 152 Ca -0.13 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.26 3hqk n ALA 152 Cb 0.45 0.00 0.12 0.00 0.00 0.00 0.00 19.45 20.02 3hqk n ALA 152 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3hqk h VAL 153 N 0.00 1.25 0.00 0.00 2.07 -1.80 0.15 116.25 117.92 3hqk h VAL 153 Ca 0.00 -0.90 -0.07 0.00 0.82 0.00 0.00 66.70 66.55 3hqk h VAL 153 Cb 0.00 0.60 -0.01 0.00 -1.52 0.00 0.00 31.29 30.36 3hqk h VAL 153 CO 0.00 0.34 -0.34 0.00 0.02 0.00 0.00 177.57 177.59 3hqk h ALA 154 N 1.22 1.23 -0.04 1.67 0.00 -1.89 -0.08 119.26 121.37 3hqk h ALA 154 Ca 0.20 -0.31 -0.05 0.00 0.00 0.00 0.00 54.91 54.75 3hqk h ALA 154 Cb 0.34 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.07 3hqk h ALA 154 CO 0.00 0.43 -0.18 1.79 0.00 0.00 0.00 179.25 181.29 3hqk h THR 155 N 0.00 1.47 0.66 0.00 1.35 -1.50 -0.47 112.91 114.42 3hqk h THR 155 Ca -0.00 -1.64 -0.03 0.00 -0.55 0.00 0.00 66.41 64.18 3hqk h THR 155 Cb 0.69 2.43 0.01 0.00 -1.73 0.00 0.00 68.15 69.55 3hqk h THR 155 CO 0.04 0.45 -0.32 0.58 -0.25 0.00 0.00 175.52 176.03 3hqk h VAL 156 N -0.37 0.35 -0.30 6.82 2.07 -0.57 -2.94 116.25 121.31 3hqk h VAL 156 Ca -0.01 -0.01 0.05 0.00 0.82 0.00 0.00 66.70 67.55 3hqk h VAL 156 Cb 0.83 0.35 -0.04 0.00 -1.52 0.00 0.00 31.29 30.91 3hqk h VAL 156 CO 0.04 0.00 0.03 0.25 0.02 0.00 0.00 177.57 177.90 3hqk h LEU 157 N -0.89 -0.06 -1.98 2.57 5.85 -1.09 -2.24 115.31 117.46 3hqk h LEU 157 Ca -0.09 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.69 3hqk h LEU 157 Cb 0.68 0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.80 3hqk h LEU 157 CO 0.15 0.00 0.00 0.00 -0.34 0.00 0.00 178.44 178.25 3hqk h ALA 158 N 1.24 1.00 0.00 1.25 0.00 -1.05 -2.11 119.26 119.59 3hqk h ALA 158 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.05 3hqk h ALA 158 Cb 0.17 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.96 3hqk h ALA 158 CO -0.21 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.32 3hqk n LEU 159 N -2.71 0.61 -0.01 0.00 4.77 -0.84 -2.47 117.00 116.35 3hqk n LEU 159 Ca -0.01 -0.31 -0.04 0.00 -0.03 0.00 0.00 56.01 55.62 3hqk n LEU 159 Cb 0.11 -0.31 -0.01 0.00 -2.33 0.00 0.00 43.42 40.88 3hqk n LEU 159 CO 0.18 0.15 -0.31 0.52 -1.33 0.00 0.00 177.39 176.60 3hqk n VAL 160 N -0.19 1.23 0.28 4.08 0.31 -0.79 -4.17 118.33 119.08 3hqk n VAL 160 Ca 0.00 0.26 0.19 0.00 -0.01 0.00 0.00 64.34 64.78 3hqk n VAL 160 Cb 0.15 -1.83 1.01 0.00 -0.91 0.00 0.00 33.84 32.27 3hqk n VAL 160 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 3hqk h PRO 161 N -0.35 0.00 0.40 5.55 0.11 -1.71 0.84 132.00 136.84 3hqk h PRO 161 Ca -0.03 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.06 3hqk h PRO 161 Cb 0.46 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.57 3hqk h PRO 161 CO -0.02 0.00 -0.19 0.82 -0.21 0.00 0.00 178.00 178.40 3hqk h ILE 162 N 0.00 0.60 -0.93 4.15 2.04 -1.73 -2.47 117.51 119.15 3hqk h ILE 162 Ca 0.00 -0.32 0.06 0.00 1.00 0.00 0.00 64.86 65.60 3hqk h ILE 162 Cb 0.00 0.75 -0.06 0.00 -0.74 0.00 0.00 36.82 36.77 3hqk h ILE 162 CO 0.00 0.06 0.59 0.58 0.00 0.00 0.00 178.15 179.38 3hqk h VAL 163 N -0.73 1.07 0.00 1.67 2.07 -0.05 4.08 116.25 124.36 3hqk h VAL 163 Ca -0.05 -0.37 0.00 0.00 0.82 0.00 0.00 66.70 67.09 3hqk h VAL 163 Cb 0.51 -0.11 0.00 0.00 -1.52 0.00 0.00 31.29 30.17 3hqk h VAL 163 CO 0.09 0.20 0.00 0.61 0.02 0.00 0.00 177.57 178.49 3hqk n GLY 164 N -1.35 -0.63 1.99 2.17 0.00 0.23 -2.13 105.19 105.47 3hqk n GLY 164 Ca 0.14 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.13 3hqk n GLY 164 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3hqk n ILE 165 N -0.61 0.00 1.32 -0.61 5.41 0.95 -4.67 119.36 121.15 3hqk n ILE 165 Ca 0.03 0.00 0.09 0.00 1.00 0.00 0.00 62.75 63.88 3hqk n ILE 165 Cb 0.02 -0.51 0.55 0.00 -0.71 0.00 0.00 39.64 38.98 3hqk n ILE 165 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3hqk n ALA 166 N -2.58 2.27 -3.15 -1.39 0.00 1.31 -3.45 120.51 113.52 3hqk n ALA 166 Ca 0.00 -0.12 -0.19 0.00 0.00 0.00 0.00 53.44 53.13 3hqk n ALA 166 Cb 0.01 -1.30 -0.04 0.00 0.00 0.00 0.00 19.45 18.12 3hqk n ALA 166 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3hqk n VAL 167 N -0.94 -0.34 -3.88 0.00 0.31 -0.91 -4.97 118.33 107.61 3hqk n VAL 167 Ca 0.14 -4.15 -0.35 0.00 -0.01 0.00 0.00 64.34 59.97 3hqk n VAL 167 Cb 0.06 -0.69 -0.10 0.00 -0.91 0.00 0.00 33.84 32.20 3hqk n VAL 167 CO 0.00 0.00 0.00 0.72 -1.32 0.00 0.00 176.83 176.23 3hqk s PHE 168 N -1.78 3.27 0.78 3.52 -0.71 -1.22 -4.67 117.98 117.16 3hqk s PHE 168 Ca 0.37 0.09 -0.11 0.00 -1.04 0.00 0.00 56.93 56.24 3hqk s PHE 168 Cb 0.28 -2.14 0.06 0.00 -1.21 0.00 0.00 43.02 40.01 3hqk s PHE 168 CO -0.09 0.11 1.08 0.20 -1.34 0.00 0.00 175.22 175.18 3hqk s GLY 169 N 0.61 1.65 0.32 1.99 0.00 -1.26 -4.94 107.32 105.69 3hqk s GLY 169 Ca 0.05 0.04 -0.29 0.00 0.00 0.00 0.00 44.72 44.52 3hqk s GLY 169 CO 0.01 0.43 1.44 -2.67 0.00 0.00 0.00 173.10 172.31 3hqk n TRP 170 N -3.46 2.60 -3.35 1.90 2.14 -1.26 -4.73 117.44 111.27 3hqk n TRP 170 Ca 0.08 0.43 -0.38 0.00 2.07 0.00 0.00 57.50 59.70 3hqk n TRP 170 Cb 0.54 -2.50 -0.07 0.00 -0.81 0.00 0.00 31.31 28.48 3hqk n TRP 170 CO 0.00 0.00 0.00 -0.59 2.07 0.00 0.00 177.69 179.17 3hqk s PHE 171 N -0.64 3.46 0.55 -2.67 -0.71 -1.26 -4.79 117.98 111.92 3hqk s PHE 171 Ca 0.59 0.78 -0.15 0.00 -1.04 0.00 0.00 56.93 57.11 3hqk s PHE 171 Cb -0.54 -2.53 -0.07 0.00 -1.21 0.00 0.00 43.02 38.68 3hqk s PHE 171 CO 0.57 0.11 1.00 1.67 -1.34 0.00 0.00 175.22 177.23 3hqk s TRP 172 N 0.86 3.51 0.27 3.49 1.48 -1.26 -4.97 118.94 122.31 3hqk s TRP 172 Ca 0.23 1.41 -0.30 0.00 -1.06 0.00 0.00 56.10 56.37 3hqk s TRP 172 Cb -0.15 -2.77 -0.11 0.00 -1.16 0.00 0.00 33.47 29.28 3hqk s TRP 172 CO 0.09 -0.48 1.61 -0.06 -4.06 0.00 0.00 176.95 174.04 3hqk s PHE 173 N -2.81 2.82 0.36 1.66 0.40 -1.26 -4.55 117.98 114.60 3hqk s PHE 173 Ca 0.58 0.71 0.05 0.00 -0.60 0.00 0.00 56.93 57.66 3hqk s PHE 173 Cb -0.10 -4.06 0.05 0.00 0.51 0.00 0.00 43.02 39.42 3hqk s PHE 173 CO 0.39 -3.65 0.44 0.36 0.70 0.00 0.00 175.22 173.46 3hqk n LYS 174 N 2.64 0.81 0.00 0.44 2.85 -1.26 -4.97 118.16 118.67 3hqk n LYS 174 Ca 0.10 -2.04 0.00 0.00 -1.05 0.00 0.00 58.31 55.32 3hqk n LYS 174 Cb 0.37 -0.05 0.00 0.00 -0.65 0.00 0.00 35.03 34.70 3hqk n LYS 174 CO 0.00 0.00 0.00 -2.67 -0.05 0.00 0.00 177.40 174.68 3hqk n TRP 182 N -1.67 0.00 -1.95 5.58 2.14 -1.26 -4.94 117.44 115.34 3hqk n TRP 182 Ca 0.07 0.00 -0.41 0.00 2.07 0.00 0.00 57.50 59.23 3hqk n TRP 182 Cb 0.38 0.00 -0.02 0.00 -0.81 0.00 0.00 31.31 30.87 3hqk n TRP 182 CO 0.00 0.00 0.00 -0.80 2.07 0.00 0.00 177.69 178.96 3hqk s ASN 183 N 0.00 6.57 -0.39 -0.67 -0.87 -1.25 -4.85 114.94 113.48 3hqk s ASN 183 Ca 0.00 2.76 -0.03 0.00 -1.57 0.00 0.00 52.86 54.02 3hqk s ASN 183 Cb 0.00 -2.63 0.09 0.00 -0.02 0.00 0.00 41.25 38.69 3hqk s ASN 183 CO 0.00 -0.76 2.61 1.33 -2.57 0.00 0.00 177.10 177.71 3hqk n VAL 184 N 2.10 3.16 -1.97 1.60 0.24 -1.26 -4.52 118.33 117.68 3hqk n VAL 184 Ca 0.06 -2.55 -0.37 0.00 -2.04 0.00 0.00 64.34 59.44 3hqk n VAL 184 Cb 0.40 -1.54 0.03 0.00 -1.47 0.00 0.00 33.84 31.25 3hqk n VAL 184 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 3hqk s SER 185 N 0.38 5.51 1.29 -1.34 1.04 -1.26 -4.63 113.70 114.68 3hqk s SER 185 Ca 0.52 2.56 0.00 0.00 0.48 0.00 0.00 55.95 59.50 3hqk s SER 185 Cb 0.34 -2.62 0.00 0.00 0.10 0.00 0.00 66.02 63.84 3hqk s SER 185 CO -0.15 -1.39 0.00 0.61 0.98 0.00 0.00 173.24 173.29 3hqk n GLY 186 N 0.61 3.13 3.16 7.32 0.00 -1.26 -3.97 105.19 114.18 3hqk n GLY 186 Ca 0.10 -0.24 -0.38 0.00 0.00 0.00 0.00 46.02 45.50 3hqk n GLY 186 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3hqk s MET 187 N 0.00 2.40 0.34 1.61 -1.94 -1.26 -4.95 119.30 115.50 3hqk s MET 187 Ca 0.00 -2.02 0.13 0.00 -1.71 0.00 0.00 55.69 52.09 3hqk s MET 187 Cb 0.00 -3.79 1.01 0.00 2.01 0.00 0.00 34.83 34.06 3hqk s MET 187 CO 0.00 -1.15 1.70 -0.91 -0.01 0.00 0.00 175.02 174.65 3hqk h ASN 188 N 7.91 0.58 -0.14 3.03 4.21 -1.82 -0.20 115.58 129.14 3hqk h ASN 188 Ca -0.11 0.15 0.03 0.00 1.21 0.00 0.00 56.30 57.58 3hqk h ASN 188 Cb 1.03 0.08 -0.05 0.00 -1.12 0.00 0.00 38.32 38.26 3hqk h ASN 188 CO 0.76 -0.01 -0.42 0.71 -1.29 0.00 0.00 177.43 177.18 3hqk h THR 189 N 0.44 0.00 0.00 2.81 1.35 -1.94 -3.31 112.91 112.26 3hqk h THR 189 Ca 0.68 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.54 3hqk h THR 189 Cb 1.48 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 67.90 3hqk h THR 189 CO -0.51 0.00 0.00 0.49 -0.25 0.00 0.00 175.52 175.25 3hqk n PHE 190 N -4.78 0.00 0.00 4.73 3.72 -1.00 -4.70 117.46 115.43 3hqk n PHE 190 Ca -0.04 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.36 3hqk n PHE 190 Cb 0.29 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.83 3hqk n PHE 190 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3hqk n GLY 191 N 2.90 0.00 0.29 1.37 0.00 -0.46 0.46 105.19 109.75 3hqk n GLY 191 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.10 3hqk n GLY 191 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hqk h ALA 192 N 0.00 1.00 0.21 4.61 0.00 -1.17 -2.60 119.26 121.31 3hqk h ALA 192 Ca 0.00 0.22 -0.35 0.00 0.00 0.00 0.00 54.91 54.78 3hqk h ALA 192 Cb 0.00 0.34 0.02 0.00 0.00 0.00 0.00 17.79 18.15 3hqk h ALA 192 CO 0.00 -0.42 -1.66 0.82 0.00 0.00 0.00 179.25 177.99 3hqk h ILE 193 N 0.18 1.06 -0.24 0.00 2.04 0.99 -2.80 117.51 118.74 3hqk h ILE 193 Ca 0.47 -2.58 -0.02 0.00 1.00 0.00 0.00 64.86 63.73 3hqk h ILE 193 Cb 0.86 2.87 -0.01 0.00 -0.74 0.00 0.00 36.82 39.80 3hqk h ILE 193 CO -0.63 0.84 0.08 1.56 0.00 0.00 0.00 178.15 180.00 3hqk h GLN 194 N 0.12 0.34 0.00 2.37 4.20 -1.29 -1.48 115.11 119.37 3hqk h GLN 194 Ca -0.32 -0.04 -0.05 0.00 0.06 0.00 0.00 58.65 58.30 3hqk h GLN 194 Cb 2.13 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 29.83 3hqk h GLN 194 CO 0.22 0.30 -0.58 0.66 -0.67 0.00 0.00 178.83 178.75 3hqk h SER 195 N 0.34 0.00 -0.15 1.46 4.64 -1.53 -3.10 113.55 115.21 3hqk h SER 195 Ca 0.08 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.30 3hqk h SER 195 Cb 0.10 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.17 3hqk h SER 195 CO -0.01 0.22 -0.23 0.74 -0.87 0.00 0.00 176.83 176.69 3hqk h THR 196 N 0.00 1.27 -0.39 2.95 2.02 -1.01 -3.20 112.91 114.55 3hqk h THR 196 Ca -0.03 -1.27 -0.05 0.00 0.77 0.00 0.00 66.41 65.84 3hqk h THR 196 Cb 1.19 1.28 -0.02 0.00 -1.74 0.00 0.00 68.15 68.86 3hqk h THR 196 CO 0.02 0.41 0.07 -0.07 0.37 0.00 0.00 175.52 176.32 3hqk h LEU 197 N 0.52 0.61 0.00 2.58 3.38 -1.31 -2.20 115.31 118.90 3hqk h LEU 197 Ca 0.08 -0.26 0.00 0.00 0.09 0.00 0.00 57.88 57.79 3hqk h LEU 197 Cb 0.67 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.26 3hqk h LEU 197 CO 0.05 0.72 0.13 0.59 0.09 0.00 0.00 178.44 180.02 3hqk n ASN 198 N -4.54 0.00 -0.06 -0.43 4.13 -1.21 0.58 115.26 113.73 3hqk n ASN 198 Ca -0.01 0.22 -0.07 0.00 1.68 0.00 0.00 54.58 56.40 3hqk n ASN 198 Cb 0.23 -0.22 -0.07 0.00 -1.54 0.00 0.00 39.78 38.18 3hqk n ASN 198 CO 0.00 0.00 0.00 0.52 0.28 0.00 0.00 177.26 178.06 3hqk n VAL 199 N -1.16 0.71 0.00 2.41 0.31 -0.87 -4.71 118.33 115.02 3hqk n VAL 199 Ca 0.00 -0.34 0.02 0.00 -0.01 0.00 0.00 64.34 64.01 3hqk n VAL 199 Cb 0.13 -0.86 -0.11 0.00 -0.91 0.00 0.00 33.84 32.08 3hqk n VAL 199 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 3hqk n THR 200 N -2.67 0.88 0.05 2.52 -2.24 0.19 -3.42 114.28 109.59 3hqk n THR 200 Ca -0.20 -0.67 -0.13 0.00 -2.27 0.00 0.00 64.05 60.79 3hqk n THR 200 Cb 0.78 -0.46 -0.09 0.00 -2.10 0.00 0.00 70.33 68.46 3hqk n THR 200 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 3hqk h LEU 201 N 0.00 -0.09 0.00 3.22 3.38 -1.42 -3.02 115.31 117.38 3hqk h LEU 201 Ca -0.19 -0.28 0.00 0.00 0.09 0.00 0.00 57.88 57.51 3hqk h LEU 201 Cb 1.52 0.02 0.00 0.00 0.09 0.00 0.00 40.66 42.30 3hqk h LEU 201 CO 0.03 0.23 0.00 0.79 0.09 0.00 0.00 178.44 179.58 3hqk n TRP 202 N -4.99 0.00 -0.12 1.13 7.02 -1.25 -3.34 117.44 115.89 3hqk n TRP 202 Ca -0.08 0.00 -0.13 0.00 -1.02 0.00 0.00 57.50 56.27 3hqk n TRP 202 Cb 0.19 0.00 -0.02 0.00 -2.42 0.00 0.00 31.31 29.06 3hqk n TRP 202 CO 0.00 0.00 0.00 0.66 -2.02 0.00 0.00 177.69 176.33 3hqk h SER 203 N 0.00 0.91 -0.57 -0.99 4.64 -1.54 -3.30 113.55 112.69 3hqk h SER 203 Ca 0.00 -0.45 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 3hqk h SER 203 Cb 0.00 -0.25 0.00 0.00 -0.31 0.00 0.00 62.40 61.84 3hqk h SER 203 CO 0.00 1.16 0.00 0.49 -0.87 0.00 0.00 176.83 177.61 3hqk n PHE 204 N -4.16 1.18 -0.28 4.77 3.72 -1.21 -4.62 117.46 116.87 3hqk n PHE 204 Ca -0.02 -0.49 -0.03 0.00 -0.05 0.00 0.00 57.45 56.86 3hqk n PHE 204 Cb 0.49 -0.17 0.09 0.00 -0.94 0.00 0.00 39.48 38.95 3hqk n PHE 204 CO 0.00 0.00 0.00 0.82 -0.05 0.00 0.00 176.76 177.53 3hqk h ILE 205 N 3.54 1.11 -0.65 4.37 1.08 -1.74 -3.28 117.51 121.95 3hqk h ILE 205 Ca 0.00 -0.33 -0.08 0.00 -0.39 0.00 0.00 64.86 64.07 3hqk h ILE 205 Cb 1.18 0.08 -0.03 0.00 -3.07 0.00 0.00 36.82 34.99 3hqk h ILE 205 CO 0.16 0.17 0.11 1.23 -0.69 0.00 0.00 178.15 179.13 3hqk h GLY 206 N 0.95 1.15 1.02 5.37 0.00 -1.82 -3.38 103.07 106.37 3hqk h GLY 206 Ca 0.31 -0.77 -0.03 0.00 0.00 0.00 0.00 47.33 46.84 3hqk h GLY 206 CO -0.11 0.71 0.38 -0.24 0.00 0.00 0.00 176.54 177.28 3hqk h VAL 207 N 0.99 1.25 -0.82 4.60 3.04 -1.69 -3.31 116.25 120.31 3hqk h VAL 207 Ca 0.20 -0.69 -0.03 0.00 -1.01 0.00 0.00 66.70 65.17 3hqk h VAL 207 Cb 0.44 0.25 -0.04 0.00 -2.01 0.00 0.00 31.29 29.93 3hqk h VAL 207 CO 0.01 0.29 0.37 -0.33 -1.01 0.00 0.00 177.57 176.91 3hqk h GLU 208 N 1.11 1.18 -0.73 4.17 5.08 -1.74 -3.21 114.58 120.44 3hqk h GLU 208 Ca 0.27 -0.18 -0.03 0.00 -1.00 0.00 0.00 59.36 58.42 3hqk h GLU 208 Cb 0.11 -0.21 -0.03 0.00 0.50 0.00 0.00 28.75 29.12 3hqk h GLU 208 CO -0.04 0.92 0.34 0.77 -1.00 0.00 0.00 179.01 180.00 3hqk h SER 209 N 1.17 0.95 -0.80 1.42 0.02 -1.79 -3.30 113.55 111.23 3hqk h SER 209 Ca 0.28 -0.11 -0.01 0.00 -0.84 0.00 0.00 61.79 61.11 3hqk h SER 209 Cb 0.14 -0.24 -0.04 0.00 0.14 0.00 0.00 62.40 62.40 3hqk h SER 209 CO -0.03 0.81 0.47 0.00 -1.14 0.00 0.00 176.83 176.94 3hqk h ALA 210 N 1.33 1.02 -0.78 3.77 0.00 -1.69 -1.39 119.26 121.52 3hqk h ALA 210 Ca 0.25 -0.10 -0.05 0.00 0.00 0.00 0.00 54.91 55.01 3hqk h ALA 210 Cb 0.12 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.56 3hqk h ALA 210 CO -0.03 0.49 0.29 0.66 0.00 0.00 0.00 179.25 180.66 3hqk h SER 211 N 1.09 1.10 0.08 0.00 4.64 -1.71 -3.26 113.55 115.49 3hqk h SER 211 Ca 0.28 -0.19 -0.30 0.00 -0.47 0.00 0.00 61.79 61.12 3hqk h SER 211 Cb -0.03 -0.29 -0.02 0.00 -0.31 0.00 0.00 62.40 61.75 3hqk h SER 211 CO -0.05 0.99 -1.61 0.58 -0.87 0.00 0.00 176.83 175.87 3hqk h VAL 212 N 1.15 0.81 -0.98 0.95 2.07 -1.70 -3.39 116.25 115.16 3hqk h VAL 212 Ca 0.26 -2.29 0.07 0.00 0.82 0.00 0.00 66.70 65.56 3hqk h VAL 212 Cb 0.25 2.43 -0.07 0.00 -1.52 0.00 0.00 31.29 32.39 3hqk h VAL 212 CO -0.02 0.64 0.63 0.00 0.02 0.00 0.00 177.57 178.84 3hqk h ALA 213 N -0.17 1.46 -0.24 1.67 0.00 0.83 -2.17 119.26 120.63 3hqk h ALA 213 Ca -0.37 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.51 3hqk h ALA 213 Cb 1.70 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 19.20 3hqk h ALA 213 CO -0.03 0.38 0.13 0.00 0.00 0.00 0.00 179.25 179.73 3hqk h ALA 214 N 1.48 0.31 0.00 0.00 0.00 -1.64 -2.97 119.26 116.44 3hqk h ALA 214 Ca 0.43 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.27 3hqk h ALA 214 Cb 0.23 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.92 3hqk h ALA 214 CO -0.18 -0.15 0.00 0.41 0.00 0.00 0.00 179.25 179.33 3hqk n GLY 215 N -0.91 0.47 2.92 0.00 0.00 -0.82 -4.51 105.19 102.34 3hqk n GLY 215 Ca -0.03 -0.01 -0.43 0.00 0.00 0.00 0.00 46.02 45.56 3hqk n GLY 215 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3hqk n VAL 216 N 0.00 4.36 1.37 1.61 0.24 -1.26 -4.61 118.33 120.04 3hqk n VAL 216 Ca 0.00 -4.46 0.13 0.00 -2.04 0.00 0.00 64.34 57.97 3hqk n VAL 216 Cb 0.00 -2.36 0.44 0.00 -1.47 0.00 0.00 33.84 30.45 3hqk n VAL 216 CO 0.00 0.00 0.00 0.52 -2.14 0.00 0.00 176.83 175.21 3hqk n VAL 217 N 3.41 0.04 -3.11 3.34 0.31 -1.26 -4.61 118.33 116.45 3hqk n VAL 217 Ca 0.39 -0.31 -0.23 0.00 -0.01 0.00 0.00 64.34 64.19 3hqk n VAL 217 Cb 0.37 0.62 0.04 0.00 -0.91 0.00 0.00 33.84 33.96 3hqk n VAL 217 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 3hqk n LYS 218 N 0.38 -5.29 -4.15 5.55 5.02 -1.26 0.86 118.16 119.27 3hqk n LYS 218 Ca 0.18 0.89 -0.10 0.00 -2.02 0.00 0.00 58.31 57.27 3hqk n LYS 218 Cb 0.39 -5.78 -0.10 0.00 -0.02 0.00 0.00 35.03 29.51 3hqk n LYS 218 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 3hqk s ASN 219 N -2.79 0.68 0.88 4.39 0.02 -1.26 -4.64 114.94 112.22 3hqk s ASN 219 Ca 0.34 -1.10 -0.11 0.00 -1.02 0.00 0.00 52.86 50.97 3hqk s ASN 219 Cb -0.15 0.20 0.12 0.00 0.02 0.00 0.00 41.25 41.43 3hqk s ASN 219 CO 0.43 -0.61 1.09 -2.84 0.02 0.00 0.00 177.10 175.19 3hqk s PRO 220 N -3.95 1.38 0.53 -0.60 0.02 -1.26 -4.87 135.00 126.26 3hqk s PRO 220 Ca 0.17 0.97 0.21 0.00 0.02 0.00 0.00 61.00 62.36 3hqk s PRO 220 Cb 0.07 -1.81 1.38 0.00 0.02 0.00 0.00 34.50 34.16 3hqk s PRO 220 CO -0.03 -2.19 2.11 1.57 -0.33 0.00 0.00 177.00 178.13 3hqk h LYS 221 N -1.52 0.00 -0.95 5.54 2.10 -1.96 -0.21 116.57 119.58 3hqk h LYS 221 Ca -0.48 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.17 3hqk h LYS 221 Cb 1.27 0.00 -0.05 0.00 -0.90 0.00 0.00 32.23 32.56 3hqk h LYS 221 CO 0.52 0.00 0.57 0.00 -2.00 0.00 0.00 179.45 178.55 3hqk h ARG 222 N 0.00 1.29 0.17 0.07 2.47 -1.95 -3.13 114.38 113.29 3hqk h ARG 222 Ca 0.08 -0.12 0.01 0.00 -1.26 0.00 0.00 59.98 58.69 3hqk h ARG 222 Cb 0.32 -0.27 -0.04 0.00 -1.65 0.00 0.00 29.97 28.33 3hqk h ARG 222 CO -0.00 0.90 -0.36 -0.91 0.56 0.00 0.00 179.97 180.15 3hqk h ASN 223 N 1.31 -1.04 -0.80 7.04 -0.26 -1.36 -2.69 115.58 117.77 3hqk h ASN 223 Ca 0.34 0.11 0.08 0.00 -0.56 0.00 0.00 56.30 56.27 3hqk h ASN 223 Cb -0.06 0.38 -0.11 0.00 -1.06 0.00 0.00 38.32 37.47 3hqk h ASN 223 CO -0.06 -0.46 -0.57 0.58 -1.06 0.00 0.00 177.43 175.86 3hqk h VAL 224 N -0.63 0.00 0.00 2.81 2.07 -1.62 0.24 116.25 119.12 3hqk h VAL 224 Ca 0.02 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.54 3hqk h VAL 224 Cb 0.63 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.41 3hqk h VAL 224 CO -0.18 0.00 0.00 -0.65 0.02 0.00 0.00 177.57 176.76 3hqk h PRO 225 N -0.13 0.00 0.17 1.57 0.11 -1.56 0.71 132.00 132.87 3hqk h PRO 225 Ca 0.14 0.00 -0.29 0.00 0.11 0.00 0.00 66.00 65.96 3hqk h PRO 225 Cb 0.48 0.00 0.02 0.00 0.11 0.00 0.00 31.00 31.60 3hqk h PRO 225 CO -0.83 0.00 -1.39 0.82 -0.21 0.00 0.00 178.00 176.39 3hqk h ILE 226 N 0.00 1.17 -0.30 4.15 2.04 -0.33 -3.17 117.51 121.07 3hqk h ILE 226 Ca 0.00 -2.53 0.05 0.00 1.00 0.00 0.00 64.86 63.38 3hqk h ILE 226 Cb 0.30 2.91 -0.05 0.00 -0.74 0.00 0.00 36.82 39.25 3hqk h ILE 226 CO 0.00 0.77 0.02 0.00 0.00 0.00 0.00 178.15 178.94 3hqk h ALA 227 N 0.07 0.28 0.00 1.87 0.00 -0.24 1.00 119.26 122.24 3hqk h ALA 227 Ca -0.27 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.72 3hqk h ALA 227 Cb 1.92 0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.84 3hqk h ALA 227 CO 0.16 -0.39 0.00 -2.37 0.00 0.00 0.00 179.25 176.65 3hqk n THR 228 N -5.14 0.00 0.00 0.00 5.66 0.24 -1.08 114.28 113.95 3hqk n THR 228 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 3hqk n THR 228 Cb 0.15 -0.42 0.00 0.00 -1.55 0.00 0.00 70.33 68.51 3hqk n THR 228 CO 0.00 0.00 0.00 -0.38 -3.05 0.00 0.00 175.07 171.64 3hqk n ILE 229 N -0.70 0.00 0.05 1.09 2.08 -1.10 -4.67 119.36 116.11 3hqk n ILE 229 Ca 0.05 0.00 -0.10 0.00 0.56 0.00 0.00 62.75 63.26 3hqk n ILE 229 Cb 0.02 0.13 -0.07 0.00 -0.75 0.00 0.00 39.64 38.97 3hqk n ILE 229 CO 0.00 0.00 0.00 1.23 0.56 0.00 0.00 176.55 178.34 3hqk h GLY 230 N 0.00 -0.23 0.10 7.39 0.00 0.26 -1.42 103.07 109.17 3hqk h GLY 230 Ca 0.00 0.08 0.01 0.00 0.00 0.00 0.00 47.33 47.42 3hqk h GLY 230 CO 0.00 -0.08 -0.37 -1.33 0.00 0.00 0.00 176.54 174.76 3hqk h GLY 231 N -0.91 -1.18 -0.05 4.60 0.00 -1.27 0.37 103.07 104.63 3hqk h GLY 231 Ca -0.02 0.60 0.20 0.00 0.00 0.00 0.00 47.33 48.12 3hqk h GLY 231 CO 0.04 -0.33 0.47 -2.08 0.00 0.00 0.00 176.54 174.63 3hqk h VAL 232 N -0.54 0.57 -0.33 4.60 2.07 -1.77 0.35 116.25 121.21 3hqk h VAL 232 Ca -0.01 -0.18 -0.10 0.00 0.82 0.00 0.00 66.70 67.23 3hqk h VAL 232 Cb 0.53 -0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.29 3hqk h VAL 232 CO -0.19 0.10 -0.17 0.25 0.02 0.00 0.00 177.57 177.57 3hqk h LEU 233 N 0.53 0.72 0.47 2.57 5.85 -0.94 -1.97 115.31 122.55 3hqk h LEU 233 Ca 0.56 -0.41 -0.02 0.00 0.84 0.00 0.00 57.88 58.84 3hqk h LEU 233 Cb 0.98 -0.20 -0.00 0.00 0.37 0.00 0.00 40.66 41.81 3hqk h LEU 233 CO -0.46 0.97 -0.29 0.40 -0.34 0.00 0.00 178.44 178.72 3hqk h ILE 234 N 0.46 0.00 0.00 4.05 2.04 0.17 -2.89 117.51 121.35 3hqk h ILE 234 Ca 0.07 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.93 3hqk h ILE 234 Cb 0.71 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.79 3hqk h ILE 234 CO 0.05 0.00 0.00 0.00 0.00 0.00 0.00 178.15 178.20 3hqk n ALA 235 N -2.47 1.99 0.04 1.87 0.00 0.10 -1.05 120.51 120.99 3hqk n ALA 235 Ca -0.09 -0.09 -0.22 0.00 0.00 0.00 0.00 53.44 53.04 3hqk n ALA 235 Cb 0.30 -1.24 -0.14 0.00 0.00 0.00 0.00 19.45 18.37 3hqk n ALA 235 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hqk h ALA 236 N 2.86 0.24 0.75 0.00 0.00 -1.22 -3.02 119.26 118.88 3hqk h ALA 236 Ca 0.00 -1.21 -0.04 0.00 0.00 0.00 0.00 54.91 53.66 3hqk h ALA 236 Cb 0.03 0.54 0.01 0.00 0.00 0.00 0.00 17.79 18.37 3hqk h ALA 236 CO 0.00 1.07 -0.36 0.28 0.00 0.00 0.00 179.25 180.24 3hqk h VAL 237 N 0.02 0.02 -0.63 0.00 2.07 -1.08 -2.17 116.25 114.48 3hqk h VAL 237 Ca -0.36 -0.25 0.08 0.00 0.82 0.00 0.00 66.70 66.98 3hqk h VAL 237 Cb 2.02 0.03 -0.09 0.00 -1.52 0.00 0.00 31.29 31.73 3hqk h VAL 237 CO 0.13 0.00 -0.31 0.00 0.02 0.00 0.00 177.57 177.41 3hqk h TYR 239 N 0.00 -0.38 -0.54 0.00 0.99 -1.57 -1.47 116.97 114.01 3hqk h TYR 239 Ca 0.16 -0.00 0.07 0.00 2.00 0.00 0.00 58.73 60.95 3hqk h TYR 239 Cb 0.31 0.14 -0.06 0.00 1.00 0.00 0.00 36.73 38.13 3hqk h TYR 239 CO -0.60 -0.20 0.23 0.28 -0.00 0.00 0.00 178.16 177.87 3hqk h VAL 240 N -0.32 0.87 -0.13 -2.88 2.07 -0.41 0.24 116.25 115.70 3hqk h VAL 240 Ca -0.03 -0.15 -0.02 0.00 0.82 0.00 0.00 66.70 67.32 3hqk h VAL 240 Cb 0.26 0.39 -0.00 0.00 -1.52 0.00 0.00 31.29 30.42 3hqk h VAL 240 CO 0.01 0.08 -0.01 -0.07 0.02 0.00 0.00 177.57 177.60 3hqk h LEU 241 N 0.44 0.23 0.99 2.57 3.38 -1.08 -2.68 115.31 119.15 3hqk h LEU 241 Ca 0.25 -0.33 -0.05 0.00 0.09 0.00 0.00 57.88 57.84 3hqk h LEU 241 Cb 0.24 -0.06 0.01 0.00 0.09 0.00 0.00 40.66 40.93 3hqk h LEU 241 CO -0.22 0.50 -0.48 0.28 0.09 0.00 0.00 178.44 178.61 3hqk h SER 242 N -0.05 -1.13 0.00 -0.43 0.02 -0.41 -1.29 113.55 110.25 3hqk h SER 242 Ca 0.03 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 61.02 3hqk h SER 242 Cb 0.39 0.29 0.00 0.00 0.14 0.00 0.00 62.40 63.23 3hqk h SER 242 CO 0.01 -0.81 0.00 0.35 -1.14 0.00 0.00 176.83 175.24 3hqk n THR 243 N -5.66 0.00 -0.13 -2.27 -2.24 0.77 -1.74 114.28 103.01 3hqk n THR 243 Ca -0.17 0.00 -0.20 0.00 -2.27 0.00 0.00 64.05 61.41 3hqk n THR 243 Cb 0.53 -0.40 -0.12 0.00 -2.10 0.00 0.00 70.33 68.24 3hqk n THR 243 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3hqk n THR 244 N -0.79 1.51 0.71 4.28 -2.24 -1.01 -4.42 114.28 112.31 3hqk n THR 244 Ca 0.11 -0.54 0.00 0.00 -2.27 0.00 0.00 64.05 61.35 3hqk n THR 244 Cb 0.05 -1.52 0.00 0.00 -2.10 0.00 0.00 70.33 66.76 3hqk n THR 244 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3hqk n ALA 245 N -3.43 2.15 0.00 6.98 0.00 -0.49 -2.56 120.51 123.15 3hqk n ALA 245 Ca -0.47 0.00 0.00 0.00 0.00 0.00 0.00 53.44 52.97 3hqk n ALA 245 Cb 0.97 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 19.42 3hqk n ALA 245 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 3hqk n ILE 246 N 0.44 0.00 -2.80 0.00 -6.64 -1.16 -3.77 119.36 105.43 3hqk n ILE 246 Ca 0.00 0.00 -0.23 0.00 -1.77 0.00 0.00 62.75 60.75 3hqk n ILE 246 Cb 0.28 -0.84 -0.02 0.00 -1.44 0.00 0.00 39.64 37.62 3hqk n ILE 246 CO 0.00 0.00 0.00 1.15 -1.77 0.00 0.00 176.55 175.93 3hqk n MET 247 N -1.87 2.67 -1.42 6.28 0.00 -1.06 0.96 117.12 122.68 3hqk n MET 247 Ca 0.00 -4.31 -0.07 0.00 0.00 0.00 0.00 57.70 53.32 3hqk n MET 247 Cb 0.44 -2.03 0.03 0.00 0.00 0.00 0.00 33.22 31.66 3hqk n MET 247 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 3hqk n GLY 248 N -0.21 1.20 0.11 3.17 0.00 -1.24 -4.67 105.19 103.55 3hqk n GLY 248 Ca 0.30 -2.05 -0.21 0.00 0.00 0.00 0.00 46.02 44.06 3hqk n GLY 248 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hqk h MET 249 N 0.00 0.04 -0.44 1.61 -0.00 -1.64 -3.28 114.93 111.23 3hqk h MET 249 Ca -0.10 -0.07 -0.07 0.00 -0.00 0.00 0.00 59.70 59.45 3hqk h MET 249 Cb 0.41 0.03 -0.02 0.00 -0.00 0.00 0.00 31.60 32.02 3hqk h MET 249 CO 0.12 1.03 -0.03 0.82 -0.00 0.00 0.00 176.91 178.86 3hqk h ILE 250 N -0.85 1.24 -0.79 -0.10 2.04 -1.86 -3.32 117.51 113.86 3hqk h ILE 250 Ca -0.32 -1.00 0.01 0.00 1.00 0.00 0.00 64.86 64.54 3hqk h ILE 250 Cb 1.37 0.94 -0.04 0.00 -0.74 0.00 0.00 36.82 38.35 3hqk h ILE 250 CO -0.14 0.35 0.51 -0.65 0.00 0.00 0.00 178.15 178.22 3hqk h PRO 251 N 0.68 1.05 -6.73 2.37 0.11 0.29 -3.44 132.00 126.32 3hqk h PRO 251 Ca 0.13 -0.07 -0.56 0.00 0.11 0.00 0.00 66.00 65.61 3hqk h PRO 251 Cb 0.46 -0.23 0.09 0.00 0.11 0.00 0.00 31.00 31.43 3hqk h PRO 251 CO 0.02 0.70 0.70 0.27 -0.21 0.00 0.00 178.00 179.49 3hqk n ASN 252 N -4.41 3.26 -4.90 -2.05 6.94 -1.25 -4.02 115.26 108.84 3hqk n ASN 252 Ca 0.09 1.17 -0.29 0.00 -0.02 0.00 0.00 54.58 55.52 3hqk n ASN 252 Cb 0.04 -1.52 0.07 0.00 -2.36 0.00 0.00 39.78 36.00 3hqk n ASN 252 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3hqk s ALA 253 N -0.37 2.82 0.20 -2.53 0.00 -1.26 -4.93 121.76 115.69 3hqk s ALA 253 Ca 0.62 -0.53 -0.11 0.00 0.00 0.00 0.00 51.96 51.94 3hqk s ALA 253 Cb -0.56 -2.95 0.13 0.00 0.00 0.00 0.00 23.12 19.75 3hqk s ALA 253 CO 0.53 -1.37 1.85 0.00 0.00 0.00 0.00 175.76 176.78 3hqk h ALA 254 N -0.81 0.90 -0.95 0.00 0.00 -1.93 -1.13 119.26 115.35 3hqk h ALA 254 Ca -0.45 -0.07 0.24 0.00 0.00 0.00 0.00 54.91 54.63 3hqk h ALA 254 Cb 1.29 -0.29 -0.13 0.00 0.00 0.00 0.00 17.79 18.67 3hqk h ALA 254 CO 0.64 0.35 0.50 -0.07 0.00 0.00 0.00 179.25 180.67 3hqk h LEU 255 N 0.96 0.50 -0.43 0.00 3.38 -1.94 4.73 115.31 122.50 3hqk h LEU 255 Ca 0.26 0.15 -0.03 0.00 0.09 0.00 0.00 57.88 58.34 3hqk h LEU 255 Cb -0.06 0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 3hqk h LEU 255 CO -0.05 0.03 0.15 0.03 0.09 0.00 0.00 178.44 178.69 3hqk h ARG 256 N 0.47 0.67 -0.02 1.13 2.47 -1.45 -3.13 114.38 114.51 3hqk h ARG 256 Ca 0.61 -0.14 0.00 0.00 -1.26 0.00 0.00 59.98 59.20 3hqk h ARG 256 Cb 1.19 -0.10 0.00 0.00 -1.65 0.00 0.00 29.97 29.41 3hqk h ARG 256 CO -0.51 0.64 -0.12 1.33 0.56 0.00 0.00 179.97 181.87 3hqk n VAL 257 N -4.58 0.00 -0.29 2.04 0.24 -0.32 -4.41 118.33 111.01 3hqk n VAL 257 Ca 0.00 -0.44 -0.05 0.00 -2.04 0.00 0.00 64.34 61.81 3hqk n VAL 257 Cb 0.17 1.40 0.06 0.00 -1.47 0.00 0.00 33.84 34.01 3hqk n VAL 257 CO 0.00 0.00 0.00 -1.28 -2.14 0.00 0.00 176.83 173.41 3hqk h SER 258 N 3.81 1.03 -0.61 -1.34 0.87 0.94 -3.03 113.55 115.23 3hqk h SER 258 Ca 0.00 -0.14 0.00 0.00 -1.23 0.00 0.00 61.79 60.42 3hqk h SER 258 Cb 0.87 -0.27 0.00 0.00 -0.44 0.00 0.00 62.40 62.56 3hqk h SER 258 CO 0.00 0.88 0.00 0.00 -0.53 0.00 0.00 176.83 177.18 3hqk n ALA 259 N -2.40 2.39 -3.07 6.23 0.00 -1.26 -4.86 120.51 117.54 3hqk n ALA 259 Ca 0.07 -1.30 -0.29 0.00 0.00 0.00 0.00 53.44 51.92 3hqk n ALA 259 Cb 0.14 -0.78 -0.17 0.00 0.00 0.00 0.00 19.45 18.64 3hqk n ALA 259 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3hqk s SER 260 N -1.01 2.59 0.16 0.00 1.04 -1.15 -5.09 113.70 110.24 3hqk s SER 260 Ca 0.42 -0.44 -0.32 0.00 0.48 0.00 0.00 55.95 56.08 3hqk s SER 260 Cb 0.22 -0.96 -0.12 0.00 0.10 0.00 0.00 66.02 65.26 3hqk s SER 260 CO 0.27 0.15 1.72 -2.65 0.98 0.00 0.00 173.24 173.72 3hqk n PRO 261 N 3.35 2.60 -2.19 4.02 -0.02 -1.26 -4.90 135.00 136.60 3hqk n PRO 261 Ca -0.19 0.94 -0.26 0.00 -2.02 0.00 0.00 63.50 61.96 3hqk n PRO 261 Cb 0.52 -2.78 0.06 0.00 -0.02 0.00 0.00 33.50 31.29 3hqk n PRO 261 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 3hqk s PHE 262 N 1.64 3.00 0.00 6.00 5.36 -1.26 -4.69 117.98 128.02 3hqk s PHE 262 Ca 0.79 0.54 0.00 0.00 -0.96 0.00 0.00 56.93 57.29 3hqk s PHE 262 Cb -0.55 -3.14 0.00 0.00 -0.34 0.00 0.00 43.02 38.99 3hqk s PHE 262 CO 0.36 -1.33 0.00 0.41 -1.46 0.00 0.00 175.22 173.20 3hqk n GLY 263 N -2.91 1.94 0.18 13.12 0.00 -1.26 -4.79 105.19 111.48 3hqk n GLY 263 Ca 0.07 -0.51 0.06 0.00 0.00 0.00 0.00 46.02 45.65 3hqk n GLY 263 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 3hqk h ASP 264 N 0.00 0.00 0.00 1.61 2.03 -1.97 -1.43 116.42 116.65 3hqk h ASP 264 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 3hqk h ASP 264 Cb 0.00 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.50 3hqk h ASP 264 CO 0.00 0.33 0.00 0.00 -1.03 0.00 0.00 179.24 178.54 3hqk n ALA 265 N -2.20 1.92 -0.29 4.15 0.00 -1.26 -2.26 120.51 120.56 3hqk n ALA 265 Ca 0.02 -0.01 0.06 0.00 0.00 0.00 0.00 53.44 53.51 3hqk n ALA 265 Cb 0.62 -1.03 0.30 0.00 0.00 0.00 0.00 19.45 19.33 3hqk n ALA 265 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hqk n ALA 266 N -0.58 3.28 0.00 0.00 0.00 -0.54 -4.25 120.51 118.42 3hqk n ALA 266 Ca 0.01 -1.35 0.00 0.00 0.00 0.00 0.00 53.44 52.11 3hqk n ALA 266 Cb 0.01 -1.06 0.00 0.00 0.00 0.00 0.00 19.45 18.39 3hqk n ALA 266 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3hqk n ARG 267 N 0.65 0.00 0.26 0.00 1.74 -0.96 -4.64 116.66 113.71 3hqk n ARG 267 Ca 0.21 0.00 0.15 0.00 -0.77 0.00 0.00 57.85 57.44 3hqk n ARG 267 Cb 0.85 -0.48 0.63 0.00 -1.02 0.00 0.00 32.46 32.44 3hqk n ARG 267 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3hqk h MET 268 N 0.00 0.00 -6.53 5.56 -0.00 -1.74 -3.25 114.93 108.97 3hqk h MET 268 Ca 0.00 0.00 -0.70 0.00 -0.00 0.00 0.00 59.70 59.00 3hqk h MET 268 Cb 0.00 0.00 -0.30 0.00 -0.00 0.00 0.00 31.60 31.30 3hqk h MET 268 CO 0.00 0.08 -0.89 0.00 -0.00 0.00 0.00 176.91 176.10 3hqk s ALA 269 N -3.71 2.17 -1.23 -3.00 0.00 -1.26 -4.90 121.76 109.83 3hqk s ALA 269 Ca 0.01 -1.11 -0.03 0.00 0.00 0.00 0.00 51.96 50.83 3hqk s ALA 269 Cb 0.10 -0.58 -0.01 0.00 0.00 0.00 0.00 23.12 22.63 3hqk s ALA 269 CO 0.57 0.52 0.80 1.28 0.00 0.00 0.00 175.76 178.93 3hqk n LEU 270 N 2.50 -3.62 0.00 0.00 4.32 -1.26 -4.67 117.00 114.27 3hqk n LEU 270 Ca -0.16 -0.78 0.00 0.00 -0.02 0.00 0.00 56.01 55.05 3hqk n LEU 270 Cb 0.51 -2.82 0.00 0.00 -1.62 0.00 0.00 43.42 39.50 3hqk n LEU 270 CO 0.23 0.37 0.00 0.61 -1.22 0.00 0.00 177.39 177.38 3hqk n GLY 271 N -1.44 3.23 3.94 -0.72 0.00 -1.26 -4.89 105.19 104.06 3hqk n GLY 271 Ca -0.25 -0.83 -0.28 0.00 0.00 0.00 0.00 46.02 44.66 3hqk n GLY 271 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3hqk s ASP 272 N 0.00 3.68 -0.01 1.61 -1.08 -1.23 -5.09 116.67 114.55 3hqk s ASP 272 Ca 0.00 0.22 0.02 0.00 -0.52 0.00 0.00 52.55 52.27 3hqk s ASP 272 Cb 0.00 -0.44 -0.00 0.00 -1.46 0.00 0.00 42.92 41.02 3hqk s ASP 272 CO 0.00 -2.36 -0.08 -0.89 0.52 0.00 0.00 175.17 172.36 3hqk s THR 273 N -3.65 0.60 0.98 1.71 2.01 -1.26 -4.57 115.64 111.46 3hqk s THR 273 Ca 0.70 -0.32 -0.14 0.00 0.31 0.00 0.00 61.69 62.23 3hqk s THR 273 Cb -0.06 -0.51 0.00 0.00 0.01 0.00 0.00 72.50 71.95 3hqk s THR 273 CO 0.50 0.17 0.11 0.00 -0.69 0.00 0.00 174.62 174.71 3hqk n ALA 274 N 2.93 -3.35 -1.96 7.40 0.00 -1.26 -4.75 120.51 119.52 3hqk n ALA 274 Ca -0.14 -0.70 -0.26 0.00 0.00 0.00 0.00 53.44 52.34 3hqk n ALA 274 Cb 0.57 -1.63 0.11 0.00 0.00 0.00 0.00 19.45 18.50 3hqk n ALA 274 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3hqk s GLY 275 N -1.80 1.75 -1.03 0.00 0.00 -1.26 -5.05 107.32 99.94 3hqk s GLY 275 Ca 0.53 -1.36 -0.23 0.00 0.00 0.00 0.00 44.72 43.66 3hqk s GLY 275 CO 0.70 -0.80 1.78 0.00 0.00 0.00 0.00 173.10 174.78 3hqk s ALA 276 N -3.34 2.18 -0.01 3.20 0.00 -1.26 -4.69 121.76 117.83 3hqk s ALA 276 Ca 0.66 -2.00 0.14 0.00 0.00 0.00 0.00 51.96 50.76 3hqk s ALA 276 Cb -0.07 -4.58 0.16 0.00 0.00 0.00 0.00 23.12 18.63 3hqk s ALA 276 CO 0.46 -4.37 1.48 0.97 0.00 0.00 0.00 175.76 174.30 3hqk h ILE 277 N 6.74 1.06 -0.00 0.00 2.10 -1.96 -3.32 117.51 122.13 3hqk h ILE 277 Ca 0.19 -2.30 0.01 0.00 1.08 0.00 0.00 64.86 63.84 3hqk h ILE 277 Cb 0.98 2.39 -0.03 0.00 -1.09 0.00 0.00 36.82 39.07 3hqk h ILE 277 CO 1.30 0.57 -0.27 0.58 -1.08 0.00 0.00 178.15 179.25 3hqk h VAL 278 N 0.00 0.00 0.00 2.19 2.07 -1.94 -1.74 116.25 116.84 3hqk h VAL 278 Ca -0.01 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.51 3hqk h VAL 278 Cb 1.34 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 31.11 3hqk h VAL 278 CO 0.08 0.00 0.25 -0.24 0.02 0.00 0.00 177.57 177.68 3hqk n SER 279 N -3.96 0.24 0.07 0.57 2.88 -1.25 -1.31 113.62 110.87 3hqk n SER 279 Ca -0.04 0.49 -0.04 0.00 -1.33 0.00 0.00 58.87 57.96 3hqk n SER 279 Cb 0.20 -0.46 -0.07 0.00 -0.75 0.00 0.00 64.21 63.13 3hqk n SER 279 CO 0.00 0.00 0.00 0.15 -1.23 0.00 0.00 175.04 173.96 3hqk h PHE 280 N 0.00 0.00 0.00 0.66 3.57 -1.43 -3.22 116.94 116.51 3hqk h PHE 280 Ca 0.00 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 3hqk h PHE 280 Cb 0.50 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.24 3hqk h PHE 280 CO 0.00 0.80 -1.82 0.00 -2.23 0.00 0.00 178.31 175.06 3hqk n ALA 282 N -2.13 2.66 0.23 0.00 0.00 -0.90 -1.16 120.51 119.20 3hqk n ALA 282 Ca -0.04 -0.24 0.12 0.00 0.00 0.00 0.00 53.44 53.27 3hqk n ALA 282 Cb 0.48 -1.40 0.04 0.00 0.00 0.00 0.00 19.45 18.58 3hqk n ALA 282 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hqk h ALA 283 N 3.76 0.53 0.11 0.00 0.00 -1.71 -3.39 119.26 118.55 3hqk h ALA 283 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 3hqk h ALA 283 Cb 0.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.05 3hqk h ALA 283 CO 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 179.25 179.20 3hqk h ALA 284 N 2.13 -0.16 0.00 0.00 0.00 -1.30 -2.97 119.26 116.96 3hqk h ALA 284 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3hqk h ALA 284 Cb 0.94 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.78 3hqk h ALA 284 CO 0.00 -0.15 0.00 0.41 0.00 0.00 0.00 179.25 179.51 3hqk n GLY 285 N 1.41 0.32 0.00 0.00 0.00 -0.83 0.57 105.19 106.66 3hqk n GLY 285 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 3hqk n GLY 285 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hqk h LEU 287 N 0.00 0.46 -0.57 0.00 3.38 0.30 -3.15 115.31 115.73 3hqk h LEU 287 Ca 0.00 -0.58 -0.06 0.00 0.09 0.00 0.00 57.88 57.32 3hqk h LEU 287 Cb 0.69 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.29 3hqk h LEU 287 CO 0.00 0.96 0.12 1.23 0.09 0.00 0.00 178.44 180.84 3hqk h GLY 288 N -0.02 1.00 0.98 0.83 0.00 -1.60 -0.98 103.07 103.27 3hqk h GLY 288 Ca -0.00 -0.64 -0.06 0.00 0.00 0.00 0.00 47.33 46.62 3hqk h GLY 288 CO 0.06 0.60 0.06 1.48 0.00 0.00 0.00 176.54 178.75 3hqk h SER 289 N 0.83 0.78 -0.89 0.19 4.64 -1.78 -0.78 113.55 116.53 3hqk h SER 289 Ca 0.18 -0.27 -0.02 0.00 -0.47 0.00 0.00 61.79 61.21 3hqk h SER 289 Cb 0.38 -0.21 -0.04 0.00 -0.31 0.00 0.00 62.40 62.22 3hqk h SER 289 CO 0.01 0.85 0.48 0.17 -0.87 0.00 0.00 176.83 177.47 3hqk h LEU 290 N 0.67 1.11 -0.65 5.97 8.10 -1.49 -2.50 115.31 126.51 3hqk h LEU 290 Ca 0.14 -0.10 -0.04 0.00 0.11 0.00 0.00 57.88 58.00 3hqk h LEU 290 Cb 0.41 -0.28 -0.03 0.00 -0.44 0.00 0.00 40.66 40.32 3hqk h LEU 290 CO 0.01 0.89 0.27 1.23 -4.11 0.00 0.00 178.44 176.73 3hqk h GLY 291 N 1.25 1.05 1.02 0.17 0.00 -0.53 -3.10 103.07 102.92 3hqk h GLY 291 Ca 0.31 -0.57 -0.04 0.00 0.00 0.00 0.00 47.33 47.03 3hqk h GLY 291 CO -0.05 0.53 0.25 -1.33 0.00 0.00 0.00 176.54 175.95 3hqk h GLY 292 N 0.92 1.11 -0.86 4.60 0.00 -0.74 -3.11 103.07 104.99 3hqk h GLY 292 Ca 0.22 -0.63 0.41 0.00 0.00 0.00 0.00 47.33 47.33 3hqk h GLY 292 CO -0.02 0.59 0.98 1.49 0.00 0.00 0.00 176.54 179.57 3hqk h TRP 293 N 0.98 0.16 -0.04 5.60 4.06 -1.39 1.14 115.95 126.46 3hqk h TRP 293 Ca 0.23 0.01 -0.19 0.00 2.06 0.00 0.00 58.89 60.99 3hqk h TRP 293 Cb 0.24 -0.04 -0.00 0.00 -1.00 0.00 0.00 29.16 28.35 3hqk h TRP 293 CO 0.02 -0.02 -0.81 1.79 -3.56 0.00 0.00 178.44 175.86 3hqk h THR 294 N 0.06 1.41 -0.33 1.49 1.35 -1.62 -1.20 112.91 114.07 3hqk h THR 294 Ca 0.70 -2.31 0.04 0.00 -0.55 0.00 0.00 66.41 64.29 3hqk h THR 294 Cb 2.60 2.26 -0.07 0.00 -1.73 0.00 0.00 68.15 71.21 3hqk h THR 294 CO -0.10 0.69 -0.51 0.25 -0.25 0.00 0.00 175.52 175.60 3hqk h LEU 295 N 0.22 -1.67 -1.34 3.87 5.85 0.12 0.36 115.31 122.72 3hqk h LEU 295 Ca -0.04 0.22 0.03 0.00 0.84 0.00 0.00 57.88 58.93 3hqk h LEU 295 Cb 1.41 0.68 -0.04 0.00 0.37 0.00 0.00 40.66 43.08 3hqk h LEU 295 CO 0.13 -0.38 0.47 -0.07 -0.34 0.00 0.00 178.44 178.26 3hqk h LEU 296 N -0.39 0.74 -0.55 2.25 3.38 -1.35 0.26 115.31 119.65 3hqk h LEU 296 Ca 0.06 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 3hqk h LEU 296 Cb 0.55 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.11 3hqk h LEU 296 CO -0.52 0.51 0.29 0.00 0.09 0.00 0.00 178.44 178.82 3hqk h ALA 297 N 1.58 0.71 -0.43 1.53 0.00 0.13 -2.50 119.26 120.27 3hqk h ALA 297 Ca 0.28 -0.11 -0.11 0.00 0.00 0.00 0.00 54.91 54.98 3hqk h ALA 297 Cb 0.06 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 3hqk h ALA 297 CO -0.08 0.24 -0.14 0.78 0.00 0.00 0.00 179.25 180.05 3hqk h GLY 298 N 0.74 0.93 0.89 0.00 0.00 0.15 -3.07 103.07 102.72 3hqk h GLY 298 Ca 0.19 -0.80 -0.04 0.00 0.00 0.00 0.00 47.33 46.68 3hqk h GLY 298 CO -0.03 0.73 -0.43 1.46 0.00 0.00 0.00 176.54 178.27 3hqk h GLN 299 N 0.69 -1.16 0.00 4.80 1.08 -0.92 -1.69 115.11 117.91 3hqk h GLN 299 Ca 0.11 0.08 -0.00 0.00 -1.45 0.00 0.00 58.65 57.38 3hqk h GLN 299 Cb 0.69 0.26 -0.00 0.00 -0.05 0.00 0.00 27.48 28.38 3hqk h GLN 299 CO 0.05 -0.77 -0.02 0.00 -0.95 0.00 0.00 178.83 177.14 3hqk h THR 300 N -1.24 0.16 -0.07 -0.54 1.03 -1.55 0.57 112.91 111.27 3hqk h THR 300 Ca -0.12 -0.20 -0.05 0.00 -0.01 0.00 0.00 66.41 66.03 3hqk h THR 300 Cb 0.92 1.17 0.00 0.00 -1.07 0.00 0.00 68.15 69.17 3hqk h THR 300 CO 0.20 0.02 -0.14 0.00 -0.01 0.00 0.00 175.52 175.60 3hqk h ALA 301 N 1.98 0.11 -0.11 0.00 0.00 -1.45 -2.58 119.26 117.20 3hqk h ALA 301 Ca -0.00 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.57 3hqk h ALA 301 Cb 0.16 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.94 3hqk h ALA 301 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 179.25 180.42 3hqk n LYS 302 N -4.62 0.00 -0.22 0.00 4.81 -0.03 -0.13 118.16 117.97 3hqk n LYS 302 Ca -0.08 0.62 -0.02 0.00 -0.87 0.00 0.00 58.31 57.96 3hqk n LYS 302 Cb 0.37 -1.48 -0.00 0.00 0.02 0.00 0.00 35.03 33.94 3hqk n LYS 302 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3hqk n ALA 303 N -2.22 -0.16 -0.11 3.14 0.00 -0.01 0.12 120.51 121.26 3hqk n ALA 303 Ca 0.00 0.52 -0.10 0.00 0.00 0.00 0.00 53.44 53.86 3hqk n ALA 303 Cb 0.00 -0.19 0.04 0.00 0.00 0.00 0.00 19.45 19.31 3hqk n ALA 303 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hqk h ALA 304 N 0.59 0.77 -0.12 0.00 0.00 -1.28 -2.75 119.26 116.47 3hqk h ALA 304 Ca 0.15 -0.39 -0.00 0.00 0.00 0.00 0.00 54.91 54.67 3hqk h ALA 304 Cb 0.29 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 3hqk h ALA 304 CO -0.53 0.66 0.07 0.00 0.00 0.00 0.00 179.25 179.45 3hqk h ALA 305 N 0.97 0.16 -0.94 0.00 0.00 0.99 -1.67 119.26 118.77 3hqk h ALA 305 Ca 0.09 -0.03 0.26 0.00 0.00 0.00 0.00 54.91 55.23 3hqk h ALA 305 Cb 0.80 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.49 3hqk h ALA 305 CO 0.07 -0.33 0.66 -0.44 0.00 0.00 0.00 179.25 179.21 3hqk h ASP 306 N 0.13 0.10 -4.95 0.00 3.32 0.91 -3.38 116.42 112.55 3hqk h ASP 306 Ca 0.04 0.01 -0.23 0.00 0.02 0.00 0.00 57.03 56.88 3hqk h ASP 306 Cb 0.03 -0.00 0.02 0.00 0.22 0.00 0.00 39.33 39.60 3hqk h ASP 306 CO -0.01 0.03 -0.01 0.47 -1.72 0.00 0.00 179.24 178.01 3hqk n ASP 307 N -4.33 0.89 0.00 6.45 8.00 -0.70 -4.90 116.55 121.96 3hqk n ASP 307 Ca 0.20 -1.67 0.00 0.00 0.71 0.00 0.00 54.79 54.03 3hqk n ASP 307 Cb 0.94 -0.23 0.00 0.00 -0.02 0.00 0.00 41.12 41.81 3hqk n ASP 307 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3hqk n GLY 308 N 1.58 -0.20 3.50 0.44 0.00 -1.26 -4.69 105.19 104.57 3hqk n GLY 308 Ca 0.08 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.84 3hqk n GLY 308 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hqk s LEU 309 N -2.27 2.73 0.00 0.99 1.43 -0.79 -5.03 118.68 115.74 3hqk s LEU 309 Ca 0.00 -0.75 0.00 0.00 -1.03 0.00 0.00 54.13 52.35 3hqk s LEU 309 Cb 0.00 -1.40 0.00 0.00 0.03 0.00 0.00 46.19 44.82 3hqk s LEU 309 CO 0.00 0.10 0.00 0.33 0.23 0.00 0.00 176.35 177.01 3hqk n PHE 310 N -0.02 0.00 -1.91 0.29 -0.00 -1.26 0.18 117.46 114.74 3hqk n PHE 310 Ca -0.10 0.00 -0.42 0.00 -0.00 0.00 0.00 57.45 56.93 3hqk n PHE 310 Cb 0.56 -0.04 -0.02 0.00 -0.00 0.00 0.00 39.48 39.98 3hqk n PHE 310 CO 0.00 0.00 0.00 -2.14 -0.00 0.00 0.00 176.76 174.62 3hqk s PRO 311 N -3.17 4.20 0.41 -7.13 0.02 -1.26 -4.64 135.00 123.42 3hqk s PRO 311 Ca 0.00 2.41 0.17 0.00 0.02 0.00 0.00 61.00 63.60 3hqk s PRO 311 Cb 0.00 -3.10 1.05 0.00 0.02 0.00 0.00 34.50 32.47 3hqk s PRO 311 CO 0.00 -0.56 1.84 -1.35 -0.33 0.00 0.00 177.00 176.60 3hqk h PRO 312 N 5.76 0.43 -0.26 5.54 0.11 -1.89 0.44 132.00 142.12 3hqk h PRO 312 Ca -0.45 -0.03 0.08 0.00 0.11 0.00 0.00 66.00 65.71 3hqk h PRO 312 Cb 1.21 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 3hqk h PRO 312 CO 0.84 0.29 0.75 0.82 -0.21 0.00 0.00 178.00 180.49 3hqk h ILE 313 N 0.44 0.06 -0.09 4.15 5.03 -1.97 1.33 117.51 126.46 3hqk h ILE 313 Ca 0.49 0.00 0.00 0.00 -0.12 0.00 0.00 64.86 65.23 3hqk h ILE 313 Cb 1.18 0.31 0.00 0.00 -3.03 0.00 0.00 36.82 35.27 3hqk h ILE 313 CO -0.21 0.00 0.00 0.49 -0.68 0.00 0.00 178.15 177.75 3hqk n PHE 314 N -2.95 0.11 -3.79 1.37 3.72 0.14 -4.35 117.46 111.72 3hqk n PHE 314 Ca 0.05 -0.06 -0.30 0.00 -0.05 0.00 0.00 57.45 57.10 3hqk n PHE 314 Cb 0.85 0.00 -0.14 0.00 -0.94 0.00 0.00 39.48 39.25 3hqk n PHE 314 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3hqk s ALA 315 N -1.89 2.10 0.00 4.37 0.00 0.46 -3.68 121.76 123.12 3hqk s ALA 315 Ca 0.31 -2.26 0.00 0.00 0.00 0.00 0.00 51.96 50.01 3hqk s ALA 315 Cb 0.16 -1.81 0.00 0.00 0.00 0.00 0.00 23.12 21.47 3hqk s ALA 315 CO 0.25 -1.84 0.00 0.54 0.00 0.00 0.00 175.76 174.71 3hqk n ARG 316 N 4.16 0.00 0.00 0.00 1.74 -1.26 -5.03 116.66 116.27 3hqk n ARG 316 Ca 0.03 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.11 3hqk n ARG 316 Cb 0.39 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.83 3hqk n ARG 316 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3hqk n GLY 321 N 0.00 0.00 0.33 -0.13 0.00 -1.26 -4.59 105.19 99.54 3hqk n GLY 321 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.96 3hqk n GLY 321 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3hqk h THR 322 N 0.00 1.26 0.00 2.61 2.02 -2.05 -3.43 112.91 113.31 3hqk h THR 322 Ca 0.00 -0.80 0.00 0.00 0.77 0.00 0.00 66.41 66.38 3hqk h THR 322 Cb 0.00 0.35 0.00 0.00 -1.74 0.00 0.00 68.15 66.76 3hqk h THR 322 CO 0.00 0.32 0.00 -2.65 0.37 0.00 0.00 175.52 173.56 3hqk n PRO 323 N -4.32 3.10 -4.10 6.66 -0.02 -1.26 -5.09 135.00 129.98 3hqk n PRO 323 Ca 0.07 0.00 -0.14 0.00 -2.02 0.00 0.00 63.50 61.40 3hqk n PRO 323 Cb 0.18 0.00 -0.12 0.00 -0.02 0.00 0.00 33.50 33.54 3hqk n PRO 323 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3hqk s VAL 324 N 0.00 0.71 -0.23 -1.45 1.01 -1.26 -4.72 120.40 114.46 3hqk s VAL 324 Ca 0.00 -1.17 0.14 0.00 0.00 0.00 0.00 61.98 60.95 3hqk s VAL 324 Cb 0.00 -0.77 0.46 0.00 0.00 0.00 0.00 36.38 36.07 3hqk s VAL 324 CO 0.00 -0.35 1.18 0.00 0.00 0.00 0.00 175.10 175.93 3hqk n ALA 325 N 1.37 3.87 0.44 5.51 0.00 -1.26 -4.08 120.51 126.36 3hqk n ALA 325 Ca -0.22 -3.29 0.05 0.00 0.00 0.00 0.00 53.44 49.98 3hqk n ALA 325 Cb 0.55 -0.50 -0.01 0.00 0.00 0.00 0.00 19.45 19.49 3hqk n ALA 325 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hqk n GLY 326 N -0.64 -0.14 0.34 0.00 0.00 -1.26 -4.36 105.19 99.12 3hqk n GLY 326 Ca 0.26 -0.28 0.15 0.00 0.00 0.00 0.00 46.02 46.14 3hqk n GLY 326 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3hqk h LEU 327 N 1.03 0.00 -0.15 0.99 6.46 -1.93 0.31 115.31 122.01 3hqk h LEU 327 Ca 0.00 0.00 -0.23 0.00 -0.12 0.00 0.00 57.88 57.53 3hqk h LEU 327 Cb 0.33 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.26 3hqk h LEU 327 CO 0.00 0.00 -0.97 -0.07 -0.62 0.00 0.00 178.44 176.78 3hqk h LEU 328 N 0.00 0.50 -1.33 2.25 3.38 -1.86 -2.97 115.31 115.28 3hqk h LEU 328 Ca 0.00 -0.41 -0.06 0.00 0.09 0.00 0.00 57.88 57.50 3hqk h LEU 328 Cb 0.71 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 3hqk h LEU 328 CO -0.00 1.22 -0.20 0.40 0.09 0.00 0.00 178.44 179.95 3hqk h ILE 329 N 0.20 1.20 -0.58 1.22 2.04 -0.70 0.29 117.51 121.20 3hqk h ILE 329 Ca -0.08 -0.94 0.04 0.00 1.00 0.00 0.00 64.86 64.88 3hqk h ILE 329 Cb 1.61 1.34 -0.04 0.00 -0.74 0.00 0.00 36.82 38.99 3hqk h ILE 329 CO 0.17 0.28 0.33 0.58 0.00 0.00 0.00 178.15 179.51 3hqk h VAL 330 N 0.18 1.02 0.00 1.67 2.07 -1.52 0.13 116.25 119.80 3hqk h VAL 330 Ca 0.03 -0.22 -0.00 0.00 0.82 0.00 0.00 66.70 67.33 3hqk h VAL 330 Cb 0.47 0.32 0.00 0.00 -1.52 0.00 0.00 31.29 30.56 3hqk h VAL 330 CO 0.03 0.12 -0.00 1.23 0.02 0.00 0.00 177.57 178.97 3hqk h GLY 331 N 0.64 -0.01 0.54 2.17 0.00 -0.51 0.41 103.07 106.32 3hqk h GLY 331 Ca 0.24 0.00 0.05 0.00 0.00 0.00 0.00 47.33 47.62 3hqk h GLY 331 CO -0.13 -0.00 -0.05 -2.08 0.00 0.00 0.00 176.54 174.27 3hqk h VAL 332 N -0.03 0.77 0.14 4.60 2.07 -0.43 -2.27 116.25 121.10 3hqk h VAL 332 Ca -0.00 -0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 3hqk h VAL 332 Cb 0.03 0.76 0.00 0.00 -1.52 0.00 0.00 31.29 30.56 3hqk h VAL 332 CO 0.00 0.00 -0.07 -0.07 0.02 0.00 0.00 177.57 177.45 3hqk h LEU 333 N 0.01 -0.16 -1.06 2.57 3.38 -0.66 -0.96 115.31 118.42 3hqk h LEU 333 Ca 0.11 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.92 3hqk h LEU 333 Cb 0.17 0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.96 3hqk h LEU 333 CO -0.24 0.08 0.24 0.24 0.09 0.00 0.00 178.44 178.85 3hqk h MET 334 N -0.40 0.00 0.00 1.13 2.86 -0.03 -1.67 114.93 116.82 3hqk h MET 334 Ca -0.02 0.00 -0.35 0.00 -2.06 0.00 0.00 59.70 57.27 3hqk h MET 334 Cb 0.32 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 31.93 3hqk h MET 334 CO 0.03 0.00 -2.16 0.25 1.06 0.00 0.00 176.91 176.09 3hqk n THR 335 N -2.14 1.49 -0.31 2.22 -2.24 -0.87 -3.14 114.28 109.30 3hqk n THR 335 Ca -0.01 -0.26 0.27 0.00 -2.27 0.00 0.00 64.05 61.78 3hqk n THR 335 Cb 0.26 -1.98 0.49 0.00 -2.10 0.00 0.00 70.33 67.01 3hqk n THR 335 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 3hqk n ILE 336 N -4.27 -0.39 0.10 2.28 5.41 -0.40 0.17 119.36 122.26 3hqk n ILE 336 Ca -0.44 1.94 -0.16 0.00 1.00 0.00 0.00 62.75 65.08 3hqk n ILE 336 Cb 0.79 -3.07 -0.14 0.00 -0.71 0.00 0.00 39.64 36.51 3hqk n ILE 336 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 176.55 176.29 3hqk h PHE 337 N 0.00 0.49 -0.01 1.39 0.05 -1.53 -3.00 116.94 114.33 3hqk h PHE 337 Ca 0.75 -0.36 0.00 0.00 3.82 0.00 0.00 57.97 62.18 3hqk h PHE 337 Cb 1.91 -0.02 -0.00 0.00 2.00 0.00 0.00 35.95 39.84 3hqk h PHE 337 CO -0.11 1.30 0.02 0.37 -0.18 0.00 0.00 178.31 179.71 3hqk h GLN 338 N 0.07 0.00 0.12 1.51 5.75 0.18 -2.89 115.11 119.86 3hqk h GLN 338 Ca -0.15 0.00 -0.34 0.00 -0.15 0.00 0.00 58.65 58.00 3hqk h GLN 338 Cb 1.98 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 30.52 3hqk h GLN 338 CO 0.20 0.00 -1.84 0.74 -2.65 0.00 0.00 178.83 175.28 3hqk h PHE 339 N 0.00 0.46 0.00 3.99 0.04 -0.55 -3.29 116.94 117.58 3hqk h PHE 339 Ca 0.00 -0.33 0.00 0.00 2.80 0.00 0.00 57.97 60.44 3hqk h PHE 339 Cb 0.05 -0.02 0.00 0.00 2.20 0.00 0.00 35.95 38.18 3hqk h PHE 339 CO 0.00 1.73 0.00 0.43 -0.60 0.00 0.00 178.31 179.87 3hqk n SER 340 N -3.64 0.41 -0.03 2.17 7.64 -1.12 -1.88 113.62 117.17 3hqk n SER 340 Ca -0.31 -1.58 -0.04 0.00 1.01 0.00 0.00 58.87 57.95 3hqk n SER 340 Cb 1.00 -0.21 -0.04 0.00 -1.01 0.00 0.00 64.21 63.96 3hqk n SER 340 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 3hqk n SER 341 N -0.18 3.50 -0.05 6.43 3.41 -1.10 -4.61 113.62 121.01 3hqk n SER 341 Ca 0.00 -0.03 -0.11 0.00 -0.26 0.00 0.00 58.87 58.48 3hqk n SER 341 Cb 0.10 0.10 -0.04 0.00 -0.26 0.00 0.00 64.21 64.12 3hqk n SER 341 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 3hqk n MET 342 N -2.57 0.25 0.06 4.33 2.81 -1.22 -4.72 117.12 116.06 3hqk n MET 342 Ca -0.12 0.11 -0.00 0.00 -1.81 0.00 0.00 57.70 55.88 3hqk n MET 342 Cb 0.65 -0.92 0.30 0.00 -0.71 0.00 0.00 33.22 32.53 3hqk n MET 342 CO 0.00 0.00 0.00 0.77 1.51 0.00 0.00 175.97 178.25 3hqk h SER 343 N -0.43 0.36 -3.64 7.83 0.02 -1.72 -3.41 113.55 112.56 3hqk h SER 343 Ca -0.23 -0.09 -0.69 0.00 -0.84 0.00 0.00 61.79 59.94 3hqk h SER 343 Cb 1.06 -0.10 -0.21 0.00 0.14 0.00 0.00 62.40 63.30 3hqk h SER 343 CO -0.14 0.54 -0.49 -2.84 -1.14 0.00 0.00 176.83 172.76 3hqk s PRO 344 N -4.66 3.28 0.05 3.45 0.02 -0.79 -4.99 135.00 131.35 3hqk s PRO 344 Ca -0.06 -0.79 -0.14 0.00 0.02 0.00 0.00 61.00 60.03 3hqk s PRO 344 Cb 0.15 -3.77 -0.30 0.00 0.02 0.00 0.00 34.50 30.60 3hqk s PRO 344 CO 0.76 -0.52 1.08 -0.91 -0.33 0.00 0.00 177.00 177.08 3hqk h ASN 345 N 8.47 0.82 -3.08 2.53 2.35 -1.88 -3.38 115.58 121.42 3hqk h ASN 345 Ca -0.30 -0.80 -0.74 0.00 -0.55 0.00 0.00 56.30 53.91 3hqk h ASN 345 Cb 1.14 -0.26 -0.22 0.00 0.05 0.00 0.00 38.32 39.03 3hqk h ASN 345 CO 0.65 1.61 0.03 0.00 -1.65 0.00 0.00 177.43 178.07 3hqk s ALA 346 N -2.85 3.60 -0.06 -0.83 0.00 -1.26 -1.73 121.76 118.63 3hqk s ALA 346 Ca -0.09 -2.54 0.02 0.00 0.00 0.00 0.00 51.96 49.35 3hqk s ALA 346 Cb 0.05 -3.46 0.01 0.00 0.00 0.00 0.00 23.12 19.72 3hqk s ALA 346 CO 0.93 -2.25 -0.11 0.00 0.00 0.00 0.00 175.76 174.33 3hqk s ALA 347 N 1.90 1.17 0.30 0.00 0.00 -1.26 -5.13 121.76 118.74 3hqk s ALA 347 Ca 0.10 -0.38 -0.01 0.00 0.00 0.00 0.00 51.96 51.67 3hqk s ALA 347 Cb -0.23 -0.52 0.45 0.00 0.00 0.00 0.00 23.12 22.81 3hqk s ALA 347 CO 0.02 0.12 1.90 0.87 0.00 0.00 0.00 175.76 178.67 3hqk h LYS 348 N 6.88 0.93 -0.64 0.00 1.57 -1.56 -2.17 116.57 121.57 3hqk h LYS 348 Ca -0.32 -0.12 -0.02 0.00 -1.87 0.00 0.00 60.65 58.32 3hqk h LYS 348 Cb 1.18 -0.18 -0.03 0.00 0.08 0.00 0.00 32.23 33.29 3hqk h LYS 348 CO 0.48 0.71 0.30 0.93 -0.57 0.00 0.00 179.45 181.30 3hqk h GLU 349 N 0.92 0.93 -0.54 3.15 4.39 -1.98 -0.24 114.58 121.21 3hqk h GLU 349 Ca 0.23 -0.14 -0.05 0.00 0.34 0.00 0.00 59.36 59.74 3hqk h GLU 349 Cb 0.09 -0.17 -0.02 0.00 -0.10 0.00 0.00 28.75 28.55 3hqk h GLU 349 CO -0.03 0.75 0.15 0.27 -1.16 0.00 0.00 179.01 178.98 3hqk h PHE 350 N 0.89 0.89 -0.82 4.33 -5.15 -1.93 -0.96 116.94 114.19 3hqk h PHE 350 Ca 0.22 -0.10 0.03 0.00 -0.20 0.00 0.00 57.97 57.92 3hqk h PHE 350 Cb 0.13 -0.25 -0.05 0.00 0.22 0.00 0.00 35.95 35.99 3hqk h PHE 350 CO 0.00 0.77 0.53 0.78 -2.00 0.00 0.00 178.31 178.39 3hqk h GLY 351 N 0.76 1.18 1.03 6.09 0.00 -0.87 -1.62 103.07 109.63 3hqk h GLY 351 Ca 0.17 -0.40 -0.03 0.00 0.00 0.00 0.00 47.33 47.07 3hqk h GLY 351 CO -0.00 0.35 0.37 -2.00 0.00 0.00 0.00 176.54 175.26 3hqk h LEU 352 N 1.03 1.02 -0.87 3.11 7.12 -0.49 -1.03 115.31 125.20 3hqk h LEU 352 Ca 0.32 -0.14 -0.06 0.00 0.13 0.00 0.00 57.88 58.14 3hqk h LEU 352 Cb -0.02 -0.26 -0.03 0.00 -0.53 0.00 0.00 40.66 39.82 3hqk h LEU 352 CO -0.10 0.87 0.19 1.62 -0.13 0.00 0.00 178.44 180.88 3hqk h VAL 353 N 1.10 1.25 -0.42 1.05 3.04 -0.69 -0.27 116.25 121.30 3hqk h VAL 353 Ca 0.27 -0.88 -0.02 0.00 -1.01 0.00 0.00 66.70 65.05 3hqk h VAL 353 Cb 0.12 0.54 -0.02 0.00 -2.01 0.00 0.00 31.29 29.92 3hqk h VAL 353 CO -0.03 0.34 0.18 -1.28 -1.01 0.00 0.00 177.57 175.76 3hqk h SER 354 N 0.99 0.58 0.23 3.17 0.87 -0.87 -1.79 113.55 116.73 3hqk h SER 354 Ca 0.21 -0.16 -0.02 0.00 -1.23 0.00 0.00 61.79 60.60 3hqk h SER 354 Cb 0.31 -0.15 -0.00 0.00 -0.44 0.00 0.00 62.40 62.11 3hqk h SER 354 CO -0.00 0.58 -0.09 -1.28 -0.53 0.00 0.00 176.83 175.51 3hqk h SER 355 N 0.54 0.00 -0.36 6.23 0.87 -0.69 -2.90 113.55 117.25 3hqk h SER 355 Ca 0.14 0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 60.67 3hqk h SER 355 Cb 0.18 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.12 3hqk h SER 355 CO -0.01 0.09 0.04 0.52 -0.53 0.00 0.00 176.83 176.93 3hqk n VAL 356 N -3.79 1.68 -0.86 2.23 0.31 -0.16 -4.58 118.33 113.16 3hqk n VAL 356 Ca -0.02 -0.84 -0.10 0.00 -0.01 0.00 0.00 64.34 63.36 3hqk n VAL 356 Cb 0.19 -0.40 -0.15 0.00 -0.91 0.00 0.00 33.84 32.57 3hqk n VAL 356 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 3hqk n SER 357 N 0.29 4.54 0.25 4.52 3.41 -1.10 -4.19 113.62 121.34 3hqk n SER 357 Ca 0.18 -2.35 0.09 0.00 -0.26 0.00 0.00 58.87 56.53 3hqk n SER 357 Cb 0.84 -1.23 0.65 0.00 -0.26 0.00 0.00 64.21 64.21 3hqk n SER 357 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 3hqk h VAL 358 N 2.12 0.86 -0.50 -3.33 2.07 -1.91 1.41 116.25 116.97 3hqk h VAL 358 Ca 0.16 -0.43 -0.05 0.00 0.82 0.00 0.00 66.70 67.21 3hqk h VAL 358 Cb 1.31 1.25 -0.02 0.00 -1.52 0.00 0.00 31.29 32.30 3hqk h VAL 358 CO 0.26 0.11 0.11 0.40 0.02 0.00 0.00 177.57 178.48 3hqk h ILE 359 N 0.00 1.22 -0.82 4.57 1.08 -1.90 -2.26 117.51 119.40 3hqk h ILE 359 Ca -0.00 -0.79 0.01 0.00 -0.39 0.00 0.00 64.86 63.69 3hqk h ILE 359 Cb 0.24 0.71 -0.04 0.00 -3.07 0.00 0.00 36.82 34.66 3hqk h ILE 359 CO 0.01 0.29 0.54 -0.26 -0.69 0.00 0.00 178.15 178.05 3hqk h PHE 360 N 0.74 1.03 -0.68 1.37 -1.00 0.16 -3.23 116.94 115.32 3hqk h PHE 360 Ca 0.16 0.02 0.01 0.00 2.81 0.00 0.00 57.97 60.98 3hqk h PHE 360 Cb 0.29 -0.35 -0.04 0.00 3.61 0.00 0.00 35.95 39.47 3hqk h PHE 360 CO 0.02 0.64 0.44 1.15 -1.61 0.00 0.00 178.31 178.94 3hqk h THR 361 N 1.10 1.15 -0.41 -1.55 2.02 -1.02 -3.33 112.91 110.86 3hqk h THR 361 Ca 0.31 -0.31 0.08 0.00 0.77 0.00 0.00 66.41 67.26 3hqk h THR 361 Cb -0.10 0.18 -0.09 0.00 -1.74 0.00 0.00 68.15 66.39 3hqk h THR 361 CO -0.07 0.16 -0.32 -0.07 0.37 0.00 0.00 175.52 175.59 3hqk h LEU 362 N 0.89 -1.07 -0.66 2.58 3.38 -1.68 -3.26 115.31 115.49 3hqk h LEU 362 Ca 0.26 0.19 0.07 0.00 0.09 0.00 0.00 57.88 58.49 3hqk h LEU 362 Cb -0.06 0.51 -0.09 0.00 0.09 0.00 0.00 40.66 41.10 3hqk h LEU 362 CO -0.07 -0.32 -0.35 0.52 0.09 0.00 0.00 178.44 178.32 3hqk n VAL 363 N -5.42 -0.42 -0.18 1.22 0.31 -1.25 0.59 118.33 113.19 3hqk n VAL 363 Ca 0.01 1.57 -0.11 0.00 -0.01 0.00 0.00 64.34 65.80 3hqk n VAL 363 Cb 0.34 -1.98 -0.07 0.00 -0.91 0.00 0.00 33.84 31.21 3hqk n VAL 363 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 3hqk h PRO 364 N 0.00 -0.29 -0.88 5.55 0.11 -1.82 -1.12 132.00 133.55 3hqk h PRO 364 Ca 0.14 0.02 0.17 0.00 0.11 0.00 0.00 66.00 66.44 3hqk h PRO 364 Cb 0.31 0.07 -0.10 0.00 0.11 0.00 0.00 31.00 31.38 3hqk h PRO 364 CO -0.63 -0.20 0.45 1.88 -0.21 0.00 0.00 178.00 179.30 3hqk h TYR 365 N -0.30 0.79 -0.54 0.65 0.05 0.02 0.26 116.97 117.89 3hqk h TYR 365 Ca 0.12 0.04 -0.00 0.00 0.05 0.00 0.00 58.73 58.94 3hqk h TYR 365 Cb 0.57 -0.22 -0.03 0.00 1.01 0.00 0.00 36.73 38.07 3hqk h TYR 365 CO -0.73 0.14 0.33 1.25 -1.05 0.00 0.00 178.16 178.10 3hqk h LEU 366 N 0.60 0.65 -0.71 3.88 5.85 -0.78 -1.43 115.31 123.37 3hqk h LEU 366 Ca 0.50 -0.06 -0.05 0.00 0.84 0.00 0.00 57.88 59.11 3hqk h LEU 366 Cb 0.78 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.61 3hqk h LEU 366 CO -0.40 0.52 0.25 1.88 -0.34 0.00 0.00 178.44 180.35 3hqk h TYR 367 N 0.73 1.11 -0.62 1.25 0.05 0.25 -2.50 116.97 117.24 3hqk h TYR 367 Ca 0.19 -0.10 -0.05 0.00 0.05 0.00 0.00 58.73 58.83 3hqk h TYR 367 Cb -0.01 -0.33 -0.03 0.00 1.01 0.00 0.00 36.73 37.37 3hqk h TYR 367 CO -0.02 0.87 0.20 1.79 -1.05 0.00 0.00 178.16 179.95 3hqk h THR 368 N 1.03 1.23 -0.69 -2.88 1.35 -0.82 0.15 112.91 112.27 3hqk h THR 368 Ca 0.23 -0.79 -0.05 0.00 -0.55 0.00 0.00 66.41 65.26 3hqk h THR 368 Cb 0.26 0.54 -0.03 0.00 -1.73 0.00 0.00 68.15 67.19 3hqk h THR 368 CO -0.01 0.30 0.23 0.00 -0.25 0.00 0.00 175.52 175.80 3hqk h ALA 370 N 1.23 0.07 -0.57 0.00 0.00 -1.32 -3.09 119.26 115.58 3hqk h ALA 370 Ca 0.23 -1.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.09 3hqk h ALA 370 Cb 0.26 0.30 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 3hqk h ALA 370 CO -0.01 0.94 0.25 0.00 0.00 0.00 0.00 179.25 180.43 3hqk h ALA 371 N 0.24 0.73 -0.67 0.00 0.00 -0.67 -0.25 119.26 118.64 3hqk h ALA 371 Ca -0.28 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.49 3hqk h ALA 371 Cb 2.10 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 19.63 3hqk h ALA 371 CO 0.21 0.32 0.42 1.25 0.00 0.00 0.00 179.25 181.45 3hqk h LEU 372 N 0.77 0.80 -0.27 0.00 5.85 -1.21 0.24 115.31 121.49 3hqk h LEU 372 Ca 0.19 -0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.84 3hqk h LEU 372 Cb 0.16 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 40.98 3hqk h LEU 372 CO -0.02 0.60 0.08 -0.07 -0.34 0.00 0.00 178.44 178.69 3hqk h LEU 373 N 0.92 0.40 -0.33 2.25 3.38 -1.34 -2.64 115.31 117.95 3hqk h LEU 373 Ca 0.24 -0.21 -0.14 0.00 0.09 0.00 0.00 57.88 57.86 3hqk h LEU 373 Cb -0.06 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 3hqk h LEU 373 CO -0.05 0.51 -0.33 -0.07 0.09 0.00 0.00 178.44 178.59 3hqk h LEU 374 N 0.27 0.86 0.07 1.67 3.38 -0.66 -3.08 115.31 117.82 3hqk h LEU 374 Ca 0.09 -0.47 -0.11 0.00 0.09 0.00 0.00 57.88 57.48 3hqk h LEU 374 Cb 0.26 -0.24 0.01 0.00 0.09 0.00 0.00 40.66 40.77 3hqk h LEU 374 CO -0.00 1.15 -0.45 0.25 0.09 0.00 0.00 178.44 179.48 3hqk h LEU 375 N 0.59 0.28 -3.53 1.67 5.85 -0.65 -3.39 115.31 116.13 3hqk h LEU 375 Ca 0.05 -0.93 -0.14 0.00 0.84 0.00 0.00 57.88 57.70 3hqk h LEU 375 Cb 0.91 -0.09 -0.08 0.00 0.37 0.00 0.00 40.66 41.77 3hqk h LEU 375 CO 0.08 1.19 0.13 0.61 -0.34 0.00 0.00 178.44 180.11 3hqk n GLY 376 N 1.52 3.94 0.25 3.75 0.00 -0.99 -4.57 105.19 109.08 3hqk n GLY 376 Ca -0.12 -1.05 0.10 0.00 0.00 0.00 0.00 46.02 44.95 3hqk n GLY 376 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 173.32 174.44 3hqk h HIS 377 N 2.22 0.00 -0.61 1.61 2.07 -1.68 -1.80 115.15 116.96 3hqk h HIS 377 Ca 0.17 0.00 -0.09 0.00 -2.85 0.00 0.00 60.37 57.60 3hqk h HIS 377 Cb 1.96 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 31.92 3hqk h HIS 377 CO 1.01 0.15 0.05 0.78 -3.07 0.00 0.00 177.93 176.85 3hqk h GLY 378 N 0.74 1.13 1.26 6.13 0.00 -1.90 -3.35 103.07 107.09 3hqk h GLY 378 Ca -0.00 -0.80 -0.03 0.00 0.00 0.00 0.00 47.33 46.50 3hqk h GLY 378 CO 0.02 0.74 0.29 0.45 0.00 0.00 0.00 176.54 178.04 3hqk h HIS 379 N 0.95 0.96 -2.94 5.60 3.86 -1.67 -3.45 115.15 118.47 3hqk h HIS 379 Ca 0.18 -0.05 -0.52 0.00 -1.16 0.00 0.00 60.37 58.82 3hqk h HIS 379 Cb 0.50 -0.30 0.07 0.00 1.06 0.00 0.00 27.41 28.74 3hqk h HIS 379 CO 0.04 0.72 0.96 -0.06 0.86 0.00 0.00 177.93 180.45 3hqk s PHE 380 N -5.49 2.84 0.20 2.45 2.99 -1.24 -4.85 117.98 114.89 3hqk s PHE 380 Ca -0.11 0.52 -0.08 0.00 0.00 0.00 0.00 56.93 57.26 3hqk s PHE 380 Cb 0.16 -4.11 0.12 0.00 0.00 0.00 0.00 43.02 39.20 3hqk s PHE 380 CO 0.80 -4.02 1.73 0.78 -0.00 0.00 0.00 175.22 174.51 3hqk h GLY 381 N 6.00 1.23 0.00 4.36 0.00 -1.94 -3.41 103.07 109.31 3hqk h GLY 381 Ca -0.45 -0.75 -0.28 0.00 0.00 0.00 0.00 47.33 45.85 3hqk h GLY 381 CO 0.89 0.70 -1.97 0.28 0.00 0.00 0.00 176.54 176.44 3hqk n LYS 382 N -4.25 0.38 -1.74 4.80 5.02 -1.26 -4.32 118.16 116.79 3hqk n LYS 382 Ca 0.06 0.15 -0.41 0.00 -2.02 0.00 0.00 58.31 56.09 3hqk n LYS 382 Cb 0.24 -1.17 0.01 0.00 -0.02 0.00 0.00 35.03 34.10 3hqk n LYS 382 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3hqk n ALA 383 N -3.61 1.77 -0.23 7.82 0.00 -1.26 -5.02 120.51 119.97 3hqk n ALA 383 Ca -0.33 0.27 -0.00 0.00 0.00 0.00 0.00 53.44 53.38 3hqk n ALA 383 Cb 0.76 -2.34 0.22 0.00 0.00 0.00 0.00 19.45 18.08 3hqk n ALA 383 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 3hqk h ARG 384 N 2.31 1.03 -0.51 0.00 1.12 -1.80 -2.66 114.38 113.86 3hqk h ARG 384 Ca -0.49 -0.07 -0.03 0.00 -1.11 0.00 0.00 59.98 58.27 3hqk h ARG 384 Cb 1.28 -0.23 -0.02 0.00 -0.01 0.00 0.00 29.97 30.99 3hqk h ARG 384 CO 0.61 0.70 0.17 -1.35 -3.11 0.00 0.00 179.97 176.99 3hqk h PRO 385 N 1.05 0.75 -0.58 0.20 0.11 -1.97 -1.38 132.00 130.18 3hqk h PRO 385 Ca 0.28 -0.12 -0.05 0.00 0.11 0.00 0.00 66.00 66.22 3hqk h PRO 385 Cb -0.08 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 30.87 3hqk h PRO 385 CO -0.06 0.64 0.17 1.25 -0.21 0.00 0.00 178.00 179.79 3hqk h LEU 386 N 0.74 0.86 0.63 2.35 5.85 -1.87 -2.82 115.31 121.05 3hqk h LEU 386 Ca 0.17 -0.22 -0.03 0.00 0.84 0.00 0.00 57.88 58.64 3hqk h LEU 386 Cb 0.20 -0.22 0.01 0.00 0.37 0.00 0.00 40.66 41.01 3hqk h LEU 386 CO -0.01 0.85 -0.30 1.88 -0.34 0.00 0.00 178.44 180.51 3hqk h TYR 387 N 0.82 -0.79 0.00 1.25 0.05 -1.58 -1.52 116.97 115.20 3hqk h TYR 387 Ca 0.18 -0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.95 3hqk h TYR 387 Cb 0.31 0.26 0.00 0.00 1.01 0.00 0.00 36.73 38.31 3hqk h TYR 387 CO 0.02 -0.46 0.38 1.25 -1.05 0.00 0.00 178.16 178.29 3hqk h LEU 388 N -1.18 0.00 0.00 3.88 5.85 -1.25 -0.49 115.31 122.13 3hqk h LEU 388 Ca -0.09 0.00 -0.25 0.00 0.84 0.00 0.00 57.88 58.38 3hqk h LEU 388 Cb 0.68 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.67 3hqk h LEU 388 CO 0.14 0.00 -1.49 -0.11 -0.34 0.00 0.00 178.44 176.64 3hqk n LEU 389 N -2.64 1.88 -0.16 2.25 7.94 -1.07 -3.86 117.00 121.35 3hqk n LEU 389 Ca -0.02 0.42 -0.09 0.00 -1.11 0.00 0.00 56.01 55.22 3hqk n LEU 389 Cb 0.41 -0.90 -0.04 0.00 0.53 0.00 0.00 43.42 43.43 3hqk n LEU 389 CO 0.10 0.21 0.57 0.40 -1.11 0.00 0.00 177.39 177.57 3hqk h ILE 390 N -1.00 0.10 0.00 1.96 2.04 -0.16 0.60 117.51 121.05 3hqk h ILE 390 Ca -0.37 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.49 3hqk h ILE 390 Cb 1.26 0.10 0.00 0.00 -0.74 0.00 0.00 36.82 37.44 3hqk h ILE 390 CO -0.23 0.00 0.20 0.35 0.00 0.00 0.00 178.15 178.47 3hqk n THR 391 N -5.41 0.84 0.05 -0.27 -2.24 -0.31 0.44 114.28 107.38 3hqk n THR 391 Ca 0.00 0.71 -0.23 0.00 -2.27 0.00 0.00 64.05 62.27 3hqk n THR 391 Cb 0.35 -1.71 -0.15 0.00 -2.10 0.00 0.00 70.33 66.72 3hqk n THR 391 CO 0.00 0.00 0.00 0.15 -0.57 0.00 0.00 175.07 174.65 3hqk h PHE 392 N 0.00 0.64 -0.50 4.78 3.04 0.01 -2.66 116.94 122.25 3hqk h PHE 392 Ca 0.00 -0.47 -0.04 0.00 3.98 0.00 0.00 57.97 61.45 3hqk h PHE 392 Cb 0.40 -0.03 -0.02 0.00 2.56 0.00 0.00 35.95 38.86 3hqk h PHE 392 CO 0.00 1.66 0.17 0.28 -2.02 0.00 0.00 178.31 178.40 3hqk h VAL 393 N 0.00 1.22 -0.62 1.41 2.07 0.17 -1.99 116.25 118.52 3hqk h VAL 393 Ca -0.34 -0.72 -0.05 0.00 0.82 0.00 0.00 66.70 66.40 3hqk h VAL 393 Cb 2.01 0.76 -0.03 0.00 -1.52 0.00 0.00 31.29 32.51 3hqk h VAL 393 CO 0.14 0.27 0.18 0.00 0.02 0.00 0.00 177.57 178.18 3hqk h ALA 394 N 1.03 0.82 -0.85 1.67 0.00 -1.25 -0.64 119.26 120.04 3hqk h ALA 394 Ca 0.16 -0.22 0.13 0.00 0.00 0.00 0.00 54.91 54.99 3hqk h ALA 394 Cb 0.24 -0.24 -0.06 0.00 0.00 0.00 0.00 17.79 17.73 3hqk h ALA 394 CO -0.01 0.50 0.55 0.74 0.00 0.00 0.00 179.25 181.03 3hqk h PHE 395 N 0.90 0.75 0.01 0.00 0.05 -1.04 -2.15 116.94 115.47 3hqk h PHE 395 Ca 0.20 0.02 -0.09 0.00 3.82 0.00 0.00 57.97 61.92 3hqk h PHE 395 Cb 0.32 -0.24 -0.01 0.00 2.00 0.00 0.00 35.95 38.02 3hqk h PHE 395 CO 0.02 0.30 -0.46 0.28 -0.18 0.00 0.00 178.31 178.27 3hqk h VAL 396 N 0.65 1.49 -0.91 -0.55 2.07 -0.78 -3.00 116.25 115.23 3hqk h VAL 396 Ca 0.42 -2.30 0.09 0.00 0.82 0.00 0.00 66.70 65.72 3hqk h VAL 396 Cb 0.68 3.01 -0.11 0.00 -1.52 0.00 0.00 31.29 33.35 3hqk h VAL 396 CO -0.18 0.52 -0.52 0.00 0.02 0.00 0.00 177.57 177.42 3hqk n TYR 397 N -4.52 -0.36 -0.21 1.57 9.36 -0.30 0.77 117.16 123.46 3hqk n TYR 397 Ca -0.17 1.13 0.02 0.00 3.32 0.00 0.00 57.90 62.20 3hqk n TYR 397 Cb 0.56 -0.60 0.13 0.00 -0.63 0.00 0.00 39.34 38.81 3hqk n TYR 397 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 3hqk h ILE 399 N 0.24 1.10 0.36 0.00 2.04 0.50 -1.91 117.51 119.84 3hqk h ILE 399 Ca 0.35 -0.77 -0.02 0.00 1.00 0.00 0.00 64.86 65.41 3hqk h ILE 399 Cb 0.55 1.42 0.00 0.00 -0.74 0.00 0.00 36.82 38.06 3hqk h ILE 399 CO -0.45 0.22 -0.17 -0.50 0.00 0.00 0.00 178.15 177.24 3hqk h TRP 400 N 0.00 -0.44 -1.46 1.37 6.55 0.58 -1.85 115.95 120.69 3hqk h TRP 400 Ca -0.00 -0.01 0.47 0.00 0.95 0.00 0.00 58.89 60.29 3hqk h TRP 400 Cb 0.41 0.15 -0.10 0.00 -0.86 0.00 0.00 29.16 28.75 3hqk h TRP 400 CO 0.00 -0.28 0.99 0.00 -1.05 0.00 0.00 178.44 178.11 3hqk n ALA 401 N -2.59 1.42 0.03 1.49 0.00 -0.51 0.15 120.51 120.50 3hqk n ALA 401 Ca -0.06 0.71 -0.08 0.00 0.00 0.00 0.00 53.44 54.01 3hqk n ALA 401 Cb 0.19 -0.98 -0.05 0.00 0.00 0.00 0.00 19.45 18.60 3hqk n ALA 401 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3hqk h VAL 402 N 0.00 0.57 -0.43 0.00 2.07 -1.23 0.42 116.25 117.66 3hqk h VAL 402 Ca 0.82 -1.17 0.09 0.00 0.82 0.00 0.00 66.70 67.26 3hqk h VAL 402 Cb 2.90 1.02 -0.09 0.00 -1.52 0.00 0.00 31.29 33.60 3hqk h VAL 402 CO -0.26 0.17 -0.22 0.40 0.02 0.00 0.00 177.57 177.68 3hqk h ILE 403 N -0.98 0.36 -0.27 4.57 2.04 0.26 -2.34 117.51 121.16 3hqk h ILE 403 Ca -0.02 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.81 3hqk h ILE 403 Cb 0.42 0.36 -0.01 0.00 -0.74 0.00 0.00 36.82 36.85 3hqk h ILE 403 CO 0.03 0.00 0.03 1.23 0.00 0.00 0.00 178.15 179.45 3hqk h GLY 404 N -0.14 0.42 -1.05 5.37 0.00 0.12 -3.44 103.07 104.35 3hqk h GLY 404 Ca 0.20 -0.21 -0.48 0.00 0.00 0.00 0.00 47.33 46.85 3hqk h GLY 404 CO -0.52 0.20 0.23 -0.56 0.00 0.00 0.00 176.54 175.90 3hqk s SER 405 N -6.80 3.21 0.36 0.19 0.01 0.15 -4.83 113.70 106.00 3hqk s SER 405 Ca -0.07 1.44 -0.28 0.00 1.31 0.00 0.00 55.95 58.35 3hqk s SER 405 Cb 0.16 -2.12 -0.12 0.00 0.21 0.00 0.00 66.02 64.16 3hqk s SER 405 CO 0.74 -2.79 1.36 0.61 0.41 0.00 0.00 173.24 173.56 3hqk n GLY 406 N -1.04 0.81 0.33 3.44 0.00 -1.26 -4.92 105.19 102.56 3hqk n GLY 406 Ca 0.07 0.30 -0.05 0.00 0.00 0.00 0.00 46.02 46.34 3hqk n GLY 406 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hqk h ALA 407 N 2.65 1.04 -0.62 4.61 0.00 -1.90 -2.56 119.26 122.48 3hqk h ALA 407 Ca -0.48 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.28 3hqk h ALA 407 Cb 1.27 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.74 3hqk h ALA 407 CO 0.63 0.59 0.00 0.36 0.00 0.00 0.00 179.25 180.83 3hqk n LYS 408 N -4.36 4.03 -0.11 0.00 2.85 -1.26 -2.06 118.16 117.26 3hqk n LYS 408 Ca 0.08 -2.97 -0.20 0.00 -1.05 0.00 0.00 58.31 54.17 3hqk n LYS 408 Cb 0.13 -1.99 -0.12 0.00 -0.65 0.00 0.00 35.03 32.40 3hqk n LYS 408 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 3hqk n GLU 409 N 0.96 0.66 -0.21 -1.58 1.02 -1.17 -3.91 120.64 116.41 3hqk n GLU 409 Ca 0.26 0.19 -0.07 0.00 -0.02 0.00 0.00 57.16 57.52 3hqk n GLU 409 Cb 0.97 -1.55 0.08 0.00 -0.02 0.00 0.00 31.44 30.92 3hqk n GLU 409 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 3hqk h VAL 410 N -0.09 1.26 -0.65 2.62 2.07 -1.44 -1.06 116.25 118.95 3hqk h VAL 410 Ca -0.56 -1.00 -0.04 0.00 0.82 0.00 0.00 66.70 65.92 3hqk h VAL 410 Cb 1.89 0.65 -0.03 0.00 -1.52 0.00 0.00 31.29 32.28 3hqk h VAL 410 CO -0.09 0.38 0.26 -0.03 0.02 0.00 0.00 177.57 178.11 3hqk h MET 411 N 0.98 0.97 -0.56 1.57 1.85 -1.58 -1.16 114.93 116.99 3hqk h MET 411 Ca 0.20 -0.17 -0.07 0.00 -0.61 0.00 0.00 59.70 59.05 3hqk h MET 411 Cb 0.42 -0.16 -0.02 0.00 0.43 0.00 0.00 31.60 32.26 3hqk h MET 411 CO 0.01 0.81 0.08 -1.49 -0.40 0.00 0.00 176.91 175.92 3hqk h TRP 412 N 0.91 0.95 -0.92 1.39 -0.00 -1.61 0.20 115.95 116.87 3hqk h TRP 412 Ca 0.22 -0.12 0.01 0.00 -0.00 0.00 0.00 58.89 59.00 3hqk h TRP 412 Cb 0.20 -0.27 -0.05 0.00 -0.00 0.00 0.00 29.16 29.05 3hqk h TRP 412 CO 0.01 0.82 0.60 0.77 -0.00 0.00 0.00 178.44 180.64 3hqk h SER 413 N 0.86 1.08 -0.21 -3.49 0.02 -0.63 -1.09 113.55 110.08 3hqk h SER 413 Ca 0.18 -0.04 -0.15 0.00 -0.84 0.00 0.00 61.79 60.93 3hqk h SER 413 Cb 0.39 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.66 3hqk h SER 413 CO 0.01 0.79 -0.42 0.15 -1.14 0.00 0.00 176.83 176.23 3hqk h PHE 414 N 1.26 0.91 -0.23 3.45 3.04 -0.11 -2.90 116.94 122.36 3hqk h PHE 414 Ca 0.34 -0.28 -0.15 0.00 3.98 0.00 0.00 57.97 61.86 3hqk h PHE 414 Cb -0.12 -0.19 -0.01 0.00 2.56 0.00 0.00 35.95 38.19 3hqk h PHE 414 CO -0.00 1.05 -0.46 0.28 -2.02 0.00 0.00 178.31 177.15 3hqk h VAL 415 N 0.62 1.31 -0.63 1.41 2.07 -0.27 -2.91 116.25 117.83 3hqk h VAL 415 Ca 0.05 -1.67 0.11 0.00 0.82 0.00 0.00 66.70 66.01 3hqk h VAL 415 Cb 0.97 1.63 -0.12 0.00 -1.52 0.00 0.00 31.29 32.25 3hqk h VAL 415 CO 0.09 0.53 -0.34 0.74 0.02 0.00 0.00 177.57 178.61 3hqk h THR 416 N 0.48 0.15 -0.22 2.57 2.02 -1.18 -2.05 112.91 114.69 3hqk h THR 416 Ca 0.03 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.24 3hqk h THR 416 Cb 0.99 0.15 -0.03 0.00 -1.74 0.00 0.00 68.15 67.53 3hqk h THR 416 CO 0.09 0.00 0.03 -0.07 0.37 0.00 0.00 175.52 175.94 3hqk h LEU 417 N -0.14 -0.02 -0.82 2.58 3.38 -1.35 0.44 115.31 119.38 3hqk h LEU 417 Ca 0.24 0.04 0.20 0.00 0.09 0.00 0.00 57.88 58.46 3hqk h LEU 417 Cb 0.55 0.06 -0.14 0.00 0.09 0.00 0.00 40.66 41.23 3hqk h LEU 417 CO -0.71 0.02 0.12 0.24 0.09 0.00 0.00 178.44 178.20 3hqk h MET 418 N 0.10 0.15 0.45 1.13 2.86 -1.21 0.29 114.93 118.72 3hqk h MET 418 Ca 0.10 -0.01 -0.02 0.00 -2.06 0.00 0.00 59.70 57.71 3hqk h MET 418 Cb 0.11 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 31.74 3hqk h MET 418 CO -0.15 0.10 -0.22 0.28 1.06 0.00 0.00 176.91 177.99 3hqk h VAL 419 N 0.16 0.00 -0.79 -2.22 2.07 -0.66 -2.16 116.25 112.64 3hqk h VAL 419 Ca 0.48 -0.35 0.17 0.00 0.82 0.00 0.00 66.70 67.82 3hqk h VAL 419 Cb 0.92 0.00 -0.15 0.00 -1.52 0.00 0.00 31.29 30.54 3hqk h VAL 419 CO -0.66 0.00 -0.15 -0.38 0.02 0.00 0.00 177.57 176.40 3hqk n ILE 420 N -4.61 -0.33 0.20 4.57 2.08 0.03 0.96 119.36 122.25 3hqk n ILE 420 Ca -0.08 1.80 -0.14 0.00 0.56 0.00 0.00 62.75 64.89 3hqk n ILE 420 Cb 0.24 -2.52 -0.08 0.00 -0.75 0.00 0.00 39.64 36.53 3hqk n ILE 420 CO 0.00 0.00 0.00 0.71 0.56 0.00 0.00 176.55 177.82 3hqk h THR 421 N 0.00 0.64 -0.51 1.39 1.35 -0.76 0.82 112.91 115.84 3hqk h THR 421 Ca 0.40 -0.38 0.14 0.00 -0.55 0.00 0.00 66.41 66.03 3hqk h THR 421 Cb 0.68 0.83 -0.02 0.00 -1.73 0.00 0.00 68.15 67.90 3hqk h THR 421 CO -0.80 0.07 0.36 0.00 -0.25 0.00 0.00 175.52 174.91 3hqk h ALA 422 N -0.16 2.43 0.34 6.62 0.00 -0.32 0.17 119.26 128.34 3hqk h ALA 422 Ca -0.05 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 3hqk h ALA 422 Cb 0.49 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.31 3hqk h ALA 422 CO 0.08 -0.57 -0.18 1.25 0.00 0.00 0.00 179.25 179.83 3hqk h LEU 423 N 0.04 -0.44 -0.83 0.00 5.85 0.14 -2.61 115.31 117.45 3hqk h LEU 423 Ca 0.24 0.02 0.20 0.00 0.84 0.00 0.00 57.88 59.19 3hqk h LEU 423 Cb 0.92 0.12 -0.13 0.00 0.37 0.00 0.00 40.66 41.94 3hqk h LEU 423 CO -0.01 -0.29 0.24 0.22 -0.34 0.00 0.00 178.44 178.26 3hqk h TYR 424 N -0.48 0.38 0.00 1.25 5.03 -0.07 -1.47 116.97 121.62 3hqk h TYR 424 Ca -0.05 0.05 0.00 0.00 2.58 0.00 0.00 58.73 61.31 3hqk h TYR 424 Cb 0.37 -0.04 0.00 0.00 1.55 0.00 0.00 36.73 38.62 3hqk h TYR 424 CO 0.09 -0.13 0.00 0.00 -1.32 0.00 0.00 178.16 176.80 3hqk n ALA 425 N -2.66 2.32 -0.02 1.82 0.00 0.53 -1.27 120.51 121.24 3hqk n ALA 425 Ca 0.19 -0.13 0.06 0.00 0.00 0.00 0.00 53.44 53.56 3hqk n ALA 425 Cb 0.60 -1.42 -0.13 0.00 0.00 0.00 0.00 19.45 18.50 3hqk n ALA 425 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3hqk n LEU 426 N -1.24 0.00 -0.12 0.00 4.77 -0.61 -4.37 117.00 115.43 3hqk n LEU 426 Ca 0.13 0.00 -0.16 0.00 -0.03 0.00 0.00 56.01 55.95 3hqk n LEU 426 Cb 0.18 0.05 -0.13 0.00 -2.33 0.00 0.00 43.42 41.19 3hqk n LEU 426 CO 0.19 0.05 -1.28 0.59 -1.33 0.00 0.00 177.39 175.60 3hqk n ASN 427 N -2.14 1.59 -1.48 -1.43 4.13 -0.71 -4.37 115.26 110.85 3hqk n ASN 427 Ca -0.06 -0.09 0.08 0.00 1.68 0.00 0.00 54.58 56.19 3hqk n ASN 427 Cb 0.50 -0.15 0.34 0.00 -1.54 0.00 0.00 39.78 38.93 3hqk n ASN 427 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 3hqk n TYR 428 N -3.17 1.50 -0.25 3.10 0.53 -0.39 -4.72 117.16 113.75 3hqk n TYR 428 Ca -0.43 -0.69 0.20 0.00 -1.02 0.00 0.00 57.90 55.96 3hqk n TYR 428 Cb 1.03 -0.33 0.37 0.00 -1.03 0.00 0.00 39.34 39.38 3hqk n TYR 428 CO 0.00 0.00 0.00 -1.71 -1.02 0.00 0.00 176.86 174.13 3hqk n ASN 429 N 0.61 0.13 -0.00 7.72 4.05 -1.26 -2.40 115.26 124.12 3hqk n ASN 429 Ca 0.25 1.29 0.01 0.00 0.45 0.00 0.00 54.58 56.57 3hqk n ASN 429 Cb 0.96 -0.57 -0.01 0.00 1.23 0.00 0.00 39.78 41.39 3hqk n ASN 429 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 177.26 174.75 3hqk n ARG 430 N -4.87 0.31 0.00 1.20 1.74 -1.26 -4.38 116.66 109.40 3hqk n ARG 430 Ca 0.25 -0.01 0.00 0.00 -0.77 0.00 0.00 57.85 57.32 3hqk n ARG 430 Cb 0.84 -1.03 0.00 0.00 -1.02 0.00 0.00 32.46 31.26 3hqk n ARG 430 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 3hqk n ILE 431 N -1.58 0.00 -3.25 0.55 5.41 -1.05 -4.87 119.36 114.57 3hqk n ILE 431 Ca -0.00 0.00 -0.39 0.00 1.00 0.00 0.00 62.75 63.36 3hqk n ILE 431 Cb 0.07 -0.97 -0.06 0.00 -0.71 0.00 0.00 39.64 37.97 3hqk n ILE 431 CO 0.00 0.00 0.00 -2.28 0.00 0.00 0.00 176.55 174.27 3hqk s HIS 432 N -2.00 3.49 -0.43 1.39 2.46 -1.01 -5.03 115.29 114.17 3hqk s HIS 432 Ca 0.00 0.92 -0.19 0.00 0.47 0.00 0.00 55.06 56.26 3hqk s HIS 432 Cb 0.00 -2.63 0.02 0.00 -0.13 0.00 0.00 32.58 29.85 3hqk s HIS 432 CO 0.00 0.08 0.57 0.21 -2.47 0.00 0.00 174.74 173.13 3hqk s LYS 433 N 0.93 3.25 -0.56 2.88 2.20 -1.26 -5.00 119.74 122.18 3hqk s LYS 433 Ca 0.27 -0.47 0.07 0.00 -0.36 0.00 0.00 55.97 55.48 3hqk s LYS 433 Cb -0.16 -3.94 0.25 0.00 -1.51 0.00 0.00 37.83 32.47 3hqk s LYS 433 CO 0.11 -0.93 0.67 -1.71 -0.36 0.00 0.00 175.35 173.14 3hqk n ASN 434 N 6.02 2.65 -4.56 1.43 4.05 -1.26 -5.01 115.26 118.59 3hqk n ASN 434 Ca -0.04 -3.21 -0.42 0.00 0.45 0.00 0.00 54.58 51.36 3hqk n ASN 434 Cb 0.48 -0.66 -0.06 0.00 1.23 0.00 0.00 39.78 40.76 3hqk n ASN 434 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 177.26 172.05 3hqk s PRO 435 N -2.06 3.57 -0.31 1.20 0.04 -1.26 -0.59 135.00 135.59 3hqk s PRO 435 Ca 0.38 -0.01 -0.01 0.00 0.04 0.00 0.00 61.00 61.39 3hqk s PRO 435 Cb 0.15 -3.86 0.06 0.00 0.04 0.00 0.00 34.50 30.89 3hqk s PRO 435 CO -0.04 -0.87 0.01 0.71 0.04 0.00 0.00 177.00 176.85 3hqk s TYR 436 N 2.89 3.31 1.11 0.56 4.12 -1.26 -5.17 117.35 122.90 3hqk s TYR 436 Ca 0.26 -1.97 -0.18 0.00 0.02 0.00 0.00 57.07 55.20 3hqk s TYR 436 Cb -0.14 -2.22 0.13 0.00 -1.52 0.00 0.00 41.96 38.21 3hqk s TYR 436 CO 0.17 -0.83 0.06 -2.30 0.02 0.00 0.00 175.55 172.67 3hqk n PRO 437 N 4.60 -1.88 -0.11 -1.71 -0.02 0.24 -5.02 135.00 131.10 3hqk n PRO 437 Ca -0.12 -0.54 0.00 0.00 -2.02 0.00 0.00 63.50 60.82 3hqk n PRO 437 Cb 0.43 -1.63 0.00 0.00 -0.02 0.00 0.00 33.50 32.28 3hqk n PRO 437 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 3hqk n LEU 438 N -1.61 0.00 -0.83 2.45 4.77 -1.26 -5.17 117.00 115.34 3hqk n LEU 438 Ca 0.02 0.00 0.13 0.00 -0.03 0.00 0.00 56.01 56.13 3hqk n LEU 438 Cb 0.57 0.00 0.21 0.00 -2.33 0.00 0.00 43.42 41.87 3hqk n LEU 438 CO 0.45 -0.46 0.69 0.47 -1.33 0.00 0.00 177.39 177.21