#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 0.57 0.07 7.63 0.00 -1.26 -4.76 105.19 107.44 3hqk n GLY 11 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.95 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 -1.30 0.99 5.85 -1.96 -3.35 115.31 115.54 3hqk h LEU 12 Ca 0.00 -0.32 -0.06 0.00 0.84 0.00 0.00 57.88 58.34 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 0.81 -0.15 -0.29 -0.34 0.00 0.00 178.44 178.47 3hqk h ILE 13 N -1.00 1.20 -0.00 4.05 6.09 -1.99 0.37 117.51 126.23 3hqk h ILE 13 Ca -0.04 -0.89 0.00 0.00 -1.37 0.00 0.00 64.86 62.55 3hqk h ILE 13 Cb 0.52 1.23 0.00 0.00 0.47 0.00 0.00 36.82 39.05 3hqk h ILE 13 CO -0.03 0.28 -0.00 -2.65 -3.07 0.00 0.00 178.15 172.68 3hqk n PRO 14 N -4.24 0.95 -0.06 2.19 -0.02 -1.26 -3.28 135.00 129.28 3hqk n PRO 14 Ca -0.00 -0.07 -0.06 0.00 -2.02 0.00 0.00 63.50 61.35 3hqk n PRO 14 Cb 0.30 -1.50 -0.09 0.00 -0.02 0.00 0.00 33.50 32.18 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 -0.97 0.81 -0.01 -1.45 0.31 -0.03 -3.73 118.33 113.26 3hqk n VAL 15 Ca 0.22 -0.51 0.02 0.00 -0.01 0.00 0.00 64.34 64.06 3hqk n VAL 15 Cb 0.15 -0.67 0.36 0.00 -0.91 0.00 0.00 33.84 32.77 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 0.00 1.15 -0.70 2.52 1.35 -1.24 -2.21 112.91 113.77 3hqk h THR 16 Ca -0.32 -0.45 -0.08 0.00 -0.55 0.00 0.00 66.41 65.01 3hqk h THR 16 Cb 1.72 0.66 -0.03 0.00 -1.73 0.00 0.00 68.15 68.78 3hqk h THR 16 CO 0.02 0.18 0.14 -0.07 -0.25 0.00 0.00 175.52 175.53 3hqk h LEU 17 N 0.56 1.09 -0.69 3.87 3.38 -1.73 -2.22 115.31 119.57 3hqk h LEU 17 Ca 0.14 -0.25 -0.02 0.00 0.09 0.00 0.00 57.88 57.85 3hqk h LEU 17 Cb 0.10 -0.29 -0.03 0.00 0.09 0.00 0.00 40.66 40.53 3hqk h LEU 17 CO -0.02 1.06 0.37 -0.03 0.09 0.00 0.00 178.44 179.91 3hqk h MET 18 N 1.07 0.97 -0.46 1.13 4.05 -1.50 0.80 114.93 120.99 3hqk h MET 18 Ca 0.21 -0.12 -0.04 0.00 -0.28 0.00 0.00 59.70 59.47 3hqk h MET 18 Cb 0.42 -0.19 -0.02 0.00 -0.80 0.00 0.00 31.60 31.01 3hqk h MET 18 CO 0.01 0.73 0.12 0.28 0.23 0.00 0.00 176.91 178.29 3hqk h VAL 19 N 0.95 1.23 -0.43 -5.77 2.07 -1.30 0.43 116.25 113.43 3hqk h VAL 19 Ca 0.24 -0.80 -0.04 0.00 0.82 0.00 0.00 66.70 66.92 3hqk h VAL 19 Cb 0.05 0.87 -0.02 0.00 -1.52 0.00 0.00 31.29 30.68 3hqk h VAL 19 CO -0.04 0.29 0.11 0.77 0.02 0.00 0.00 177.57 178.71 3hqk h SER 20 N 0.62 0.65 -0.65 0.57 4.64 -0.95 -2.86 113.55 115.57 3hqk h SER 20 Ca 0.15 -0.23 0.02 0.00 -0.47 0.00 0.00 61.79 61.26 3hqk h SER 20 Cb 0.30 -0.17 -0.04 0.00 -0.31 0.00 0.00 62.40 62.18 3hqk h SER 20 CO -0.00 0.71 0.41 1.23 -0.87 0.00 0.00 176.83 178.32 3hqk h GLY 21 N 0.56 0.93 2.00 -0.77 0.00 0.90 -3.06 103.07 103.63 3hqk h GLY 21 Ca 0.14 -0.32 0.00 0.00 0.00 0.00 0.00 47.33 47.15 3hqk h GLY 21 CO 0.00 0.28 0.00 0.70 0.00 0.00 0.00 176.54 177.52 3hqk n ASN 22 N -4.68 0.45 -0.01 0.19 5.03 0.15 -2.83 115.26 113.56 3hqk n ASN 22 Ca 0.06 0.58 -0.21 0.00 0.87 0.00 0.00 54.58 55.88 3hqk n ASN 22 Cb 0.07 -0.69 -0.13 0.00 -1.02 0.00 0.00 39.78 38.00 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 1.00 -1.02 2.41 5.03 -1.45 -3.36 117.51 120.12 3hqk h ILE 23 Ca 0.00 -2.35 -0.57 0.00 -0.12 0.00 0.00 64.86 61.81 3hqk h ILE 23 Cb 0.46 2.64 -0.15 0.00 -3.03 0.00 0.00 36.82 36.74 3hqk h ILE 23 CO 0.00 0.66 1.16 0.23 -0.68 0.00 0.00 178.15 179.52 3hqk n MET 24 N -3.99 3.22 0.15 2.37 2.81 -1.13 -4.31 117.12 116.23 3hqk n MET 24 Ca -0.26 -2.68 0.13 0.00 -1.81 0.00 0.00 57.70 53.08 3hqk n MET 24 Cb 0.86 -2.33 0.32 0.00 -0.71 0.00 0.00 33.22 31.37 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 4.66 0.00 -4.03 3.03 0.00 -1.76 -3.23 103.07 101.74 3hqk h GLY 25 Ca 0.51 0.00 -0.26 0.00 0.00 0.00 0.00 47.33 47.58 3hqk h GLY 25 CO 1.08 0.00 -0.98 -1.26 0.00 0.00 0.00 176.54 175.38 3hqk n SER 26 N -2.56 2.04 0.08 0.19 2.88 -1.26 -4.66 113.62 110.33 3hqk n SER 26 Ca 0.05 -2.52 0.03 0.00 -1.33 0.00 0.00 58.87 55.10 3hqk n SER 26 Cb 0.46 -0.41 0.43 0.00 -0.75 0.00 0.00 64.21 63.94 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 1.94 0.38 1.24 0.46 0.00 -1.84 -2.99 103.07 102.26 3hqk h GLY 27 Ca -0.06 -0.18 -0.30 0.00 0.00 0.00 0.00 47.33 46.79 3hqk h GLY 27 CO 0.25 0.17 -1.53 -0.39 0.00 0.00 0.00 176.54 175.04 3hqk h VAL 28 N 0.35 1.14 -0.00 4.60 -1.51 -1.91 -3.30 116.25 115.63 3hqk h VAL 28 Ca 0.09 -2.81 0.00 0.00 -1.23 0.00 0.00 66.70 62.75 3hqk h VAL 28 Cb 0.15 2.73 0.00 0.00 -2.13 0.00 0.00 31.29 32.04 3hqk h VAL 28 CO -0.00 0.80 -0.04 0.33 -1.23 0.00 0.00 177.57 177.43 3hqk n PHE 29 N -3.42 0.00 -0.29 5.19 7.35 -1.19 -3.91 117.46 121.19 3hqk n PHE 29 Ca -0.16 0.00 -0.03 0.00 -0.76 0.00 0.00 57.45 56.50 3hqk n PHE 29 Cb 1.04 -0.46 0.13 0.00 0.35 0.00 0.00 39.48 40.53 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 0.01 1.04 -0.67 -2.13 5.85 -1.60 -1.29 115.31 116.51 3hqk h LEU 30 Ca 0.00 -0.10 -0.01 0.00 0.84 0.00 0.00 57.88 58.61 3hqk h LEU 30 Cb 0.48 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.22 3hqk h LEU 30 CO 0.00 0.85 0.38 0.17 -0.34 0.00 0.00 178.44 179.50 3hqk h LEU 31 N 1.16 0.84 -0.58 2.25 8.10 -1.79 0.63 115.31 125.92 3hqk h LEU 31 Ca 0.29 -0.09 -0.06 0.00 0.11 0.00 0.00 57.88 58.12 3hqk h LEU 31 Cb 0.06 -0.21 -0.02 0.00 -0.44 0.00 0.00 40.66 40.04 3hqk h LEU 31 CO -0.04 0.69 0.11 1.55 -4.11 0.00 0.00 178.44 176.63 3hqk h PRO 32 N 0.92 0.95 -0.71 0.17 0.13 -1.71 -1.75 132.00 130.00 3hqk h PRO 32 Ca 0.24 -0.25 -0.04 0.00 -0.87 0.00 0.00 66.00 65.08 3hqk h PRO 32 Cb 0.03 -0.12 -0.03 0.00 0.13 0.00 0.00 31.00 31.01 3hqk h PRO 32 CO -0.04 0.90 0.28 0.00 -0.23 0.00 0.00 178.00 178.91 3hqk h ALA 33 N 1.02 1.16 0.00 -0.56 0.00 -0.74 -1.66 119.26 118.47 3hqk h ALA 33 Ca 0.18 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 3hqk h ALA 33 Cb 0.39 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 3hqk h ALA 33 CO 0.01 0.61 -0.03 -0.91 0.00 0.00 0.00 179.25 178.92 3hqk h ASN 34 N 1.03 0.00 -0.18 0.00 2.35 -0.58 -3.06 115.58 115.14 3hqk h ASN 34 Ca 0.24 0.00 0.02 0.00 -0.55 0.00 0.00 56.30 56.01 3hqk h ASN 34 Cb 0.19 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.56 3hqk h ASN 34 CO -0.02 0.03 0.12 -0.07 -1.65 0.00 0.00 177.43 175.84 3hqk h LEU 35 N 0.00 0.14 -0.58 1.61 -0.00 -0.39 -3.13 115.31 112.96 3hqk h LEU 35 Ca -0.00 -0.00 -0.13 0.00 -0.00 0.00 0.00 57.88 57.75 3hqk h LEU 35 Cb 0.35 -0.03 -0.01 0.00 -0.00 0.00 0.00 40.66 40.97 3hqk h LEU 35 CO 0.00 0.10 -0.29 0.00 -0.00 0.00 0.00 178.44 178.25 3hqk h ALA 36 N 1.90 0.77 -0.25 1.53 0.00 -1.67 -3.39 119.26 118.14 3hqk h ALA 36 Ca 0.07 -0.41 -0.00 0.00 0.00 0.00 0.00 54.91 54.57 3hqk h ALA 36 Cb 0.09 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 3hqk h ALA 36 CO -0.01 0.65 0.14 0.00 0.00 0.00 0.00 179.25 180.03 3hqk h ALA 37 N 0.97 0.32 -3.00 0.00 0.00 -1.77 -3.46 119.26 112.33 3hqk h ALA 37 Ca 0.08 -0.06 0.04 0.00 0.00 0.00 0.00 54.91 54.96 3hqk h ALA 37 Cb 0.83 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.49 3hqk h ALA 37 CO 0.07 -0.15 0.24 -0.08 0.00 0.00 0.00 179.25 179.33 3hqk s THR 38 N -5.89 0.00 0.00 0.00 -1.32 -1.26 -3.89 115.64 103.28 3hqk s THR 38 Ca -0.13 -1.01 0.00 0.00 -1.21 0.00 0.00 61.69 59.34 3hqk s THR 38 Cb 0.09 -2.32 0.00 0.00 -1.51 0.00 0.00 72.50 68.75 3hqk s THR 38 CO 0.71 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.73 3hqk n GLY 39 N -0.48 2.74 0.18 6.08 0.00 -1.24 -3.81 105.19 108.66 3hqk n GLY 39 Ca -0.06 -0.26 -0.07 0.00 0.00 0.00 0.00 46.02 45.64 3hqk n GLY 39 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3hqk h GLY 40 N 0.00 0.60 -4.59 -0.02 0.00 -1.94 -2.83 103.07 94.29 3hqk h GLY 40 Ca 0.00 -0.18 -0.52 0.00 0.00 0.00 0.00 47.33 46.62 3hqk h GLY 40 CO 0.00 0.15 0.48 4.51 0.00 0.00 0.00 176.54 181.69 3hqk n ILE 41 N -4.86 3.39 0.00 2.60 3.06 -1.26 -3.41 119.36 118.88 3hqk n ILE 41 Ca 0.02 -3.11 0.00 0.00 -2.50 0.00 0.00 62.75 57.16 3hqk n ILE 41 Cb 0.07 -1.59 0.00 0.00 0.54 0.00 0.00 39.64 38.67 3hqk n ILE 41 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 3hqk n ALA 42 N 0.82 2.70 -0.21 1.51 0.00 -1.07 -4.68 120.51 119.59 3hqk n ALA 42 Ca 0.50 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.88 3hqk n ALA 42 Cb 0.53 0.45 0.11 0.00 0.00 0.00 0.00 19.45 20.53 3hqk n ALA 42 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 3hqk h ILE 43 N 0.00 1.25 -0.96 0.00 5.03 -1.65 -2.41 117.51 118.76 3hqk h ILE 43 Ca 0.00 -0.90 0.00 0.00 -0.12 0.00 0.00 64.86 63.84 3hqk h ILE 43 Cb 0.90 0.57 -0.05 0.00 -3.03 0.00 0.00 36.82 35.21 3hqk h ILE 43 CO 0.00 0.34 0.62 0.22 -0.68 0.00 0.00 178.15 178.65 3hqk h TYR 44 N 0.97 1.23 -0.55 1.37 5.03 -1.86 -0.57 116.97 122.59 3hqk h TYR 44 Ca 0.21 0.02 -0.04 0.00 2.58 0.00 0.00 58.73 61.49 3hqk h TYR 44 Cb 0.33 -0.41 -0.03 0.00 1.55 0.00 0.00 36.73 38.17 3hqk h TYR 44 CO 0.02 0.79 0.16 0.78 -1.32 0.00 0.00 178.16 178.59 3hqk h GLY 45 N 1.31 0.88 -0.62 1.82 0.00 -1.74 -3.03 103.07 101.70 3hqk h GLY 45 Ca 0.35 -0.49 0.35 0.00 0.00 0.00 0.00 47.33 47.54 3hqk h GLY 45 CO -0.07 0.46 0.75 1.49 0.00 0.00 0.00 176.54 179.16 3hqk h TRP 46 N 0.80 0.60 -0.90 5.60 4.06 -0.62 0.26 115.95 125.75 3hqk h TRP 46 Ca 0.18 0.02 0.02 0.00 2.06 0.00 0.00 58.89 61.17 3hqk h TRP 46 Cb 0.25 -0.16 -0.05 0.00 -1.00 0.00 0.00 29.16 28.20 3hqk h TRP 46 CO 0.01 -0.08 0.59 -0.07 -3.56 0.00 0.00 178.44 175.34 3hqk h LEU 47 N 0.24 1.02 -0.60 -4.49 3.38 -1.59 0.42 115.31 113.69 3hqk h LEU 47 Ca 0.71 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.63 3hqk h LEU 47 Cb 2.03 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 42.50 3hqk h LEU 47 CO -0.37 0.73 0.27 0.58 0.09 0.00 0.00 178.44 179.74 3hqk h VAL 48 N 1.20 1.22 -0.48 1.22 2.07 -0.67 -0.03 116.25 120.77 3hqk h VAL 48 Ca 0.34 -0.63 -0.05 0.00 0.82 0.00 0.00 66.70 67.17 3hqk h VAL 48 Cb -0.10 0.53 -0.02 0.00 -1.52 0.00 0.00 31.29 30.18 3hqk h VAL 48 CO -0.08 0.25 0.09 0.71 0.02 0.00 0.00 177.57 178.56 3hqk h THR 49 N 0.82 1.25 -0.60 2.57 1.35 -1.09 -2.70 112.91 114.51 3hqk h THR 49 Ca 0.20 -0.89 -0.08 0.00 -0.55 0.00 0.00 66.41 65.09 3hqk h THR 49 Cb 0.15 0.89 -0.02 0.00 -1.73 0.00 0.00 68.15 67.44 3hqk h THR 49 CO -0.02 0.32 0.05 0.40 -0.25 0.00 0.00 175.52 176.02 3hqk h ILE 50 N 0.67 1.26 -0.76 6.82 2.04 0.07 -0.79 117.51 126.82 3hqk h ILE 50 Ca 0.15 -1.06 -0.01 0.00 1.00 0.00 0.00 64.86 64.94 3hqk h ILE 50 Cb 0.37 0.74 -0.04 0.00 -0.74 0.00 0.00 36.82 37.16 3hqk h ILE 50 CO 0.01 0.39 0.42 0.40 0.00 0.00 0.00 178.15 179.36 3hqk h ILE 51 N 0.93 1.23 -0.06 -0.67 2.04 -0.92 0.40 117.51 120.45 3hqk h ILE 51 Ca 0.18 -0.57 -0.05 0.00 1.00 0.00 0.00 64.86 65.42 3hqk h ILE 51 Cb 0.47 0.22 0.00 0.00 -0.74 0.00 0.00 36.82 36.77 3hqk h ILE 51 CO 0.02 0.25 -0.14 1.23 0.00 0.00 0.00 178.15 179.51 3hqk h GLY 52 N 1.05 0.23 2.00 5.37 0.00 -1.22 -2.63 103.07 107.87 3hqk h GLY 52 Ca 0.27 -0.28 0.00 0.00 0.00 0.00 0.00 47.33 47.32 3hqk h GLY 52 CO -0.04 0.25 0.00 0.00 0.00 0.00 0.00 176.54 176.75 3hqk n ALA 53 N -2.44 2.21 0.09 3.60 0.00 -0.32 -1.48 120.51 122.17 3hqk n ALA 53 Ca -0.08 -0.06 -0.11 0.00 0.00 0.00 0.00 53.44 53.20 3hqk n ALA 53 Cb 0.38 -1.44 -0.07 0.00 0.00 0.00 0.00 19.45 18.32 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 0.27 -0.38 0.00 5.85 -0.23 -2.99 115.31 117.83 3hqk h LEU 54 Ca 0.00 -0.25 -0.05 0.00 0.84 0.00 0.00 57.88 58.42 3hqk h LEU 54 Cb 0.55 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.48 3hqk h LEU 54 CO 0.00 1.12 0.06 0.00 -0.34 0.00 0.00 178.44 179.27 3hqk h ALA 55 N 0.85 0.51 -0.82 1.25 0.00 -0.87 -2.23 119.26 117.94 3hqk h ALA 55 Ca -0.07 -0.21 0.06 0.00 0.00 0.00 0.00 54.91 54.69 3hqk h ALA 55 Cb 1.70 -0.14 -0.06 0.00 0.00 0.00 0.00 17.79 19.28 3hqk h ALA 55 CO 0.16 0.22 0.51 -0.07 0.00 0.00 0.00 179.25 180.06 3hqk h LEU 56 N 0.47 0.80 -1.20 0.00 3.38 -1.47 -1.21 115.31 116.09 3hqk h LEU 56 Ca 0.11 0.02 0.03 0.00 0.09 0.00 0.00 57.88 58.14 3hqk h LEU 56 Cb 0.37 -0.15 -0.05 0.00 0.09 0.00 0.00 40.66 40.93 3hqk h LEU 56 CO 0.01 0.51 0.55 0.77 0.09 0.00 0.00 178.44 180.38 3hqk h SER 57 N 0.93 0.90 -0.25 -0.43 4.64 -1.33 -1.64 113.55 116.37 3hqk h SER 57 Ca 0.36 -0.01 -0.08 0.00 -0.47 0.00 0.00 61.79 61.59 3hqk h SER 57 Cb 0.16 -0.21 -0.01 0.00 -0.31 0.00 0.00 62.40 62.03 3hqk h SER 57 CO -0.17 0.62 -0.14 0.24 -0.87 0.00 0.00 176.83 176.51 3hqk h MET 58 N 1.04 0.54 -0.35 4.77 2.86 -0.71 0.11 114.93 123.19 3hqk h MET 58 Ca 0.33 -0.24 -0.02 0.00 -2.06 0.00 0.00 59.70 57.71 3hqk h MET 58 Cb 0.03 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.67 3hqk h MET 58 CO -0.10 0.80 0.13 0.28 1.06 0.00 0.00 176.91 179.08 3hqk h VAL 59 N 0.26 1.20 -0.44 -2.22 2.07 -0.94 0.15 116.25 116.32 3hqk h VAL 59 Ca 0.05 -0.62 -0.09 0.00 0.82 0.00 0.00 66.70 66.87 3hqk h VAL 59 Cb 0.65 0.94 -0.02 0.00 -1.52 0.00 0.00 31.29 31.35 3hqk h VAL 59 CO 0.04 0.22 -0.09 1.88 0.02 0.00 0.00 177.57 179.64 3hqk h TYR 60 N 0.42 0.84 -0.42 1.57 0.05 -1.35 -0.91 116.97 117.18 3hqk h TYR 60 Ca 0.12 -0.15 -0.03 0.00 0.05 0.00 0.00 58.73 58.72 3hqk h TYR 60 Cb 0.21 -0.22 -0.02 0.00 1.01 0.00 0.00 36.73 37.71 3hqk h TYR 60 CO 0.00 0.83 0.15 0.00 -1.05 0.00 0.00 178.16 178.09 3hqk h ALA 61 N 1.19 0.54 -0.32 3.88 0.00 -0.42 -2.63 119.26 121.50 3hqk h ALA 61 Ca 0.12 -0.15 -0.09 0.00 0.00 0.00 0.00 54.91 54.79 3hqk h ALA 61 Cb 0.56 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 3hqk h ALA 61 CO 0.03 0.16 -0.14 -0.22 0.00 0.00 0.00 179.25 179.09 3hqk h LYS 62 N 0.53 0.66 -0.76 0.00 1.63 -0.44 -3.02 116.57 115.17 3hqk h LYS 62 Ca 0.14 -0.28 -0.05 0.00 -0.85 0.00 0.00 60.65 59.61 3hqk h LYS 62 Cb 0.22 -0.02 -0.03 0.00 -0.60 0.00 0.00 32.23 31.79 3hqk h LYS 62 CO -0.01 0.87 0.28 1.98 -3.45 0.00 0.00 179.45 179.12 3hqk h MET 63 N 0.43 1.15 -0.78 1.90 4.05 -1.18 -2.12 114.93 118.37 3hqk h MET 63 Ca 0.07 -0.22 -0.04 0.00 -0.28 0.00 0.00 59.70 59.24 3hqk h MET 63 Cb 0.66 -0.18 -0.04 0.00 -0.80 0.00 0.00 31.60 31.25 3hqk h MET 63 CO 0.04 0.95 0.35 0.66 0.23 0.00 0.00 176.91 179.14 3hqk h SER 64 N 1.11 1.04 -0.65 1.39 4.64 -1.51 -0.51 113.55 119.07 3hqk h SER 64 Ca 0.25 -0.14 -0.05 0.00 -0.47 0.00 0.00 61.79 61.39 3hqk h SER 64 Cb 0.24 -0.27 -0.03 0.00 -0.31 0.00 0.00 62.40 62.04 3hqk h SER 64 CO -0.02 0.90 0.22 0.77 -0.87 0.00 0.00 176.83 177.83 3hqk h SER 65 N 1.12 0.93 0.34 4.97 4.64 -1.29 -2.38 113.55 121.87 3hqk h SER 65 Ca 0.27 -0.20 -0.15 0.00 -0.47 0.00 0.00 61.79 61.24 3hqk h SER 65 Cb 0.15 -0.24 -0.01 0.00 -0.31 0.00 0.00 62.40 61.99 3hqk h SER 65 CO -0.03 0.87 -0.62 -0.07 -0.87 0.00 0.00 176.83 176.12 3hqk h LEU 66 N 0.93 0.31 -6.09 5.97 3.38 -1.00 -3.43 115.31 115.39 3hqk h LEU 66 Ca 0.21 -0.18 0.02 0.00 0.09 0.00 0.00 57.88 58.02 3hqk h LEU 66 Cb 0.26 -0.09 -0.23 0.00 0.09 0.00 0.00 40.66 40.70 3hqk h LEU 66 CO -0.01 0.85 -0.34 -0.62 0.09 0.00 0.00 178.44 178.41 3hqk s ASP 67 N -6.91 -1.10 -0.60 -0.43 2.15 -0.23 -5.10 116.67 104.44 3hqk s ASP 67 Ca -0.04 0.54 -0.20 0.00 0.43 0.00 0.00 52.55 53.28 3hqk s ASP 67 Cb 0.12 1.92 0.09 0.00 -0.30 0.00 0.00 42.92 44.75 3hqk s ASP 67 CO 0.81 -0.28 0.76 -2.16 -0.17 0.00 0.00 175.17 174.13 3hqk s PRO 68 N 2.79 3.06 0.78 4.34 0.04 -0.92 -4.21 135.00 140.89 3hqk s PRO 68 Ca 0.16 -1.19 -0.10 0.00 0.04 0.00 0.00 61.00 59.92 3hqk s PRO 68 Cb -0.14 -4.25 0.09 0.00 0.04 0.00 0.00 34.50 30.25 3hqk s PRO 68 CO -0.22 -1.59 1.12 -1.12 0.04 0.00 0.00 177.00 175.23 3hqk s SER 69 N 3.60 4.41 0.26 6.66 0.01 -1.26 -5.02 113.70 122.35 3hqk s SER 69 Ca 0.14 0.50 -0.04 0.00 1.31 0.00 0.00 55.95 57.86 3hqk s SER 69 Cb -0.22 -0.99 0.32 0.00 0.21 0.00 0.00 66.02 65.34 3hqk s SER 69 CO 0.07 -1.91 1.90 -0.65 0.41 0.00 0.00 173.24 173.07 3hqk h PRO 70 N -0.93 1.17 0.00 12.44 0.11 -1.88 -3.31 132.00 139.59 3hqk h PRO 70 Ca -0.45 -0.11 0.00 0.00 0.11 0.00 0.00 66.00 65.55 3hqk h PRO 70 Cb 1.31 -0.24 0.00 0.00 0.11 0.00 0.00 31.00 32.18 3hqk h PRO 70 CO 0.58 0.83 0.00 0.41 -0.21 0.00 0.00 178.00 179.61 3hqk n GLY 71 N -1.23 3.45 0.00 -0.55 0.00 -1.15 0.96 105.19 106.67 3hqk n GLY 71 Ca 0.09 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.81 3hqk n GLY 71 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hqk n GLY 72 N 0.00 -0.50 5.00 -0.02 0.00 -1.26 -3.89 105.19 104.52 3hqk n GLY 72 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.92 3hqk n GLY 72 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3hqk n SER 73 N 0.00 0.00 -0.22 1.61 2.88 -1.26 -4.17 113.62 112.47 3hqk n SER 73 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 3hqk n SER 73 Cb 0.00 0.00 0.11 0.00 -0.75 0.00 0.00 64.21 63.57 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 0.49 0.79 0.66 3.20 -1.88 -2.21 116.97 118.03 3hqk h TYR 74 Ca 0.00 0.03 -0.04 0.00 3.14 0.00 0.00 58.73 61.86 3hqk h TYR 74 Cb 0.00 -0.13 0.01 0.00 1.54 0.00 0.00 36.73 38.15 3hqk h TYR 74 CO 0.00 0.16 -0.38 0.00 -1.64 0.00 0.00 178.16 176.30 3hqk h ALA 75 N 1.41 -1.22 -0.98 1.82 0.00 -1.82 -0.03 119.26 118.44 3hqk h ALA 75 Ca 0.32 -0.23 0.10 0.00 0.00 0.00 0.00 54.91 55.09 3hqk h ALA 75 Cb 0.35 0.41 -0.08 0.00 0.00 0.00 0.00 17.79 18.47 3hqk h ALA 75 CO -0.28 -1.14 0.62 1.88 0.00 0.00 0.00 179.25 180.33 3hqk h TYR 76 N -1.12 1.13 -0.56 0.00 0.99 -1.84 0.20 116.97 115.78 3hqk h TYR 76 Ca -0.11 0.03 -0.07 0.00 2.00 0.00 0.00 58.73 60.58 3hqk h TYR 76 Cb 0.81 -0.36 -0.02 0.00 1.00 0.00 0.00 36.73 38.16 3hqk h TYR 76 CO 0.04 0.50 0.06 0.00 -0.00 0.00 0.00 178.16 178.76 3hqk h ALA 77 N 1.50 0.74 -0.47 3.88 0.00 -1.09 0.29 119.26 124.11 3hqk h ALA 77 Ca 0.46 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 3hqk h ALA 77 Cb 0.35 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 3hqk h ALA 77 CO -0.23 0.51 0.28 -0.09 0.00 0.00 0.00 179.25 179.73 3hqk h ARG 78 N 0.83 0.63 -0.18 0.00 1.12 0.99 0.31 114.38 118.07 3hqk h ARG 78 Ca 0.17 -0.05 -0.04 0.00 -1.11 0.00 0.00 59.98 58.94 3hqk h ARG 78 Cb 0.45 -0.13 -0.01 0.00 -0.01 0.00 0.00 29.97 30.27 3hqk h ARG 78 CO 0.02 0.46 -0.03 0.00 -3.11 0.00 0.00 179.97 177.30 3hqk h ARG 79 N 0.62 0.34 -0.21 0.20 3.08 -0.76 0.10 114.38 117.75 3hqk h ARG 79 Ca 0.17 -0.13 -0.05 0.00 0.07 0.00 0.00 59.98 60.04 3hqk h ARG 79 Cb -0.01 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.01 3hqk h ARG 79 CO -0.03 0.59 -0.05 0.00 -1.07 0.00 0.00 179.97 179.41 3hqk n PHE 81 N -4.61 0.20 -0.89 0.00 3.01 0.11 -5.01 117.46 110.27 3hqk n PHE 81 Ca -0.04 -0.31 0.00 0.00 1.01 0.00 0.00 57.45 58.11 3hqk n PHE 81 Cb 0.28 -0.02 0.00 0.00 -0.01 0.00 0.00 39.48 39.73 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 0.29 -2.65 0.32 1.37 0.00 0.35 -4.51 105.19 100.37 3hqk n GLY 82 Ca 0.07 -1.70 -0.06 0.00 0.00 0.00 0.00 46.02 44.32 3hqk n GLY 82 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3hqk h PRO 83 N 0.00 1.08 -0.42 1.61 0.13 -1.89 -2.31 132.00 130.21 3hqk h PRO 83 Ca 0.00 -0.25 -0.00 0.00 -0.87 0.00 0.00 66.00 64.88 3hqk h PRO 83 Cb 0.00 -0.15 -0.02 0.00 0.13 0.00 0.00 31.00 30.96 3hqk h PRO 83 CO 0.00 0.95 0.26 0.35 -0.23 0.00 0.00 178.00 179.33 3hqk h PHE 84 N 1.03 0.55 0.00 1.56 3.57 -1.96 -1.46 116.94 120.23 3hqk h PHE 84 Ca 0.22 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.72 3hqk h PHE 84 Cb 0.35 -0.18 0.00 0.00 2.79 0.00 0.00 35.95 38.91 3hqk h PHE 84 CO 0.03 0.38 -0.06 1.28 -2.23 0.00 0.00 178.31 177.70 3hqk n LEU 85 N -4.76 0.42 0.08 0.59 4.77 -1.24 -2.22 117.00 114.62 3hqk n LEU 85 Ca 0.01 0.49 -0.10 0.00 -0.03 0.00 0.00 56.01 56.38 3hqk n LEU 85 Cb 0.05 -0.39 -0.01 0.00 -2.33 0.00 0.00 43.42 40.74 3hqk n LEU 85 CO 0.35 -0.07 0.25 1.23 -1.33 0.00 0.00 177.39 177.82 3hqk h GLY 86 N 4.77 0.31 0.41 -0.72 0.00 -0.85 -2.69 103.07 104.30 3hqk h GLY 86 Ca 0.00 -0.53 -0.00 0.00 0.00 0.00 0.00 47.33 46.79 3hqk h GLY 86 CO 0.00 0.47 -0.03 -1.82 0.00 0.00 0.00 176.54 175.16 3hqk h TYR 87 N 0.16 -0.08 0.31 5.60 -0.00 -1.05 -2.61 116.97 119.30 3hqk h TYR 87 Ca -0.05 -0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.68 3hqk h TYR 87 Cb 1.49 0.03 -0.03 0.00 -0.00 0.00 0.00 36.73 38.21 3hqk h TYR 87 CO 0.04 0.45 -0.41 0.37 -0.00 0.00 0.00 178.16 178.61 3hqk h GLN 88 N -0.68 -0.74 0.00 1.82 4.15 -1.57 -1.19 115.11 116.90 3hqk h GLN 88 Ca -0.01 0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.46 3hqk h GLN 88 Cb 0.57 0.17 0.00 0.00 0.21 0.00 0.00 27.48 28.43 3hqk h GLN 88 CO 0.01 -0.50 0.00 0.00 -1.93 0.00 0.00 178.83 176.42 3hqk h THR 89 N -0.77 0.00 0.00 2.39 1.03 -1.50 -2.66 112.91 111.40 3hqk h THR 89 Ca -0.02 -0.01 0.00 0.00 -0.01 0.00 0.00 66.41 66.37 3hqk h THR 89 Cb 0.72 0.95 0.00 0.00 -1.07 0.00 0.00 68.15 68.75 3hqk h THR 89 CO -0.13 0.00 0.00 -3.20 -0.01 0.00 0.00 175.52 172.18 3hqk n ASN 90 N -2.98 0.00 -0.28 0.00 5.15 -0.51 -2.80 115.26 113.84 3hqk n ASN 90 Ca -0.03 0.76 -0.03 0.00 -0.60 0.00 0.00 54.58 54.68 3hqk n ASN 90 Cb 0.07 -0.48 0.03 0.00 -0.53 0.00 0.00 39.78 38.87 3hqk n ASN 90 CO 0.00 0.00 0.00 -0.37 1.40 0.00 0.00 177.26 178.29 3hqk h VAL 91 N 0.00 0.10 -0.36 3.44 -1.51 -1.08 0.44 116.25 117.27 3hqk h VAL 91 Ca 0.00 0.00 0.06 0.00 -1.23 0.00 0.00 66.70 65.53 3hqk h VAL 91 Cb 0.00 0.10 -0.09 0.00 -2.13 0.00 0.00 31.29 29.18 3hqk h VAL 91 CO 0.00 0.00 -0.45 -0.07 -1.23 0.00 0.00 177.57 175.82 3hqk h LEU 92 N -0.08 -1.47 -1.09 4.19 3.38 -1.63 0.76 115.31 119.35 3hqk h LEU 92 Ca 0.29 0.21 -0.09 0.00 0.09 0.00 0.00 57.88 58.38 3hqk h LEU 92 Cb 0.57 0.63 -0.01 0.00 0.09 0.00 0.00 40.66 41.94 3hqk h LEU 92 CO -0.82 -0.38 -0.44 0.22 0.09 0.00 0.00 178.44 177.11 3hqk h TYR 93 N -0.36 0.03 0.74 1.13 3.20 -0.63 0.98 116.97 122.05 3hqk h TYR 93 Ca 0.12 -0.01 -0.04 0.00 3.14 0.00 0.00 58.73 61.94 3hqk h TYR 93 Cb 0.59 -0.01 0.01 0.00 1.54 0.00 0.00 36.73 38.86 3hqk h TYR 93 CO -0.62 0.46 -0.35 2.35 -1.64 0.00 0.00 178.16 178.36 3hqk h TRP 94 N 0.02 -0.92 -0.64 -3.82 7.01 0.26 -2.24 115.95 115.63 3hqk h TRP 94 Ca -0.00 -0.02 0.06 0.00 2.11 0.00 0.00 58.89 61.04 3hqk h TRP 94 Cb 0.79 0.30 -0.08 0.00 -2.10 0.00 0.00 29.16 28.07 3hqk h TRP 94 CO 0.00 -0.57 -0.44 -0.07 -2.79 0.00 0.00 178.44 174.57 3hqk h LEU 95 N -1.21 -1.57 -1.92 0.65 3.38 0.58 0.41 115.31 115.63 3hqk h LEU 95 Ca -0.10 0.23 0.42 0.00 0.09 0.00 0.00 57.88 58.52 3hqk h LEU 95 Cb 0.76 0.68 -0.07 0.00 0.09 0.00 0.00 40.66 42.12 3hqk h LEU 95 CO 0.17 -0.21 1.02 0.00 0.09 0.00 0.00 178.44 179.51 3hqk h ALA 96 N -0.00 3.28 -0.07 1.53 0.00 -0.87 -0.72 119.26 122.41 3hqk h ALA 96 Ca 0.10 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.93 3hqk h ALA 96 Cb 0.34 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.25 3hqk h ALA 96 CO -0.64 -1.71 -0.14 0.00 0.00 0.00 0.00 179.25 176.75 3hqk n TRP 98 N -4.61 0.82 -0.26 0.00 4.27 -0.69 -3.20 117.44 113.77 3hqk n TRP 98 Ca -0.08 0.30 0.07 0.00 -3.89 0.00 0.00 57.50 53.91 3hqk n TRP 98 Cb 0.38 -1.09 0.20 0.00 -1.36 0.00 0.00 31.31 29.44 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 -0.76 0.40 -0.04 -1.67 2.04 -1.38 0.24 117.51 116.35 3hqk h ILE 99 Ca -0.44 -0.07 0.01 0.00 1.00 0.00 0.00 64.86 65.36 3hqk h ILE 99 Cb 1.53 0.19 -0.00 0.00 -0.74 0.00 0.00 36.82 37.80 3hqk h ILE 99 CO -0.19 0.04 0.03 1.23 0.00 0.00 0.00 178.15 179.25 3hqk h GLY 100 N 0.20 0.00 1.29 5.37 0.00 -1.62 -3.17 103.07 105.13 3hqk h GLY 100 Ca 0.45 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.72 3hqk h GLY 100 CO -0.60 0.00 0.12 3.43 0.00 0.00 0.00 176.54 179.49 3hqk h ASN 101 N 0.00 0.83 -0.65 0.19 4.21 -0.48 -3.30 115.58 116.38 3hqk h ASN 101 Ca 0.02 -0.16 -0.01 0.00 1.21 0.00 0.00 56.30 57.35 3hqk h ASN 101 Cb 0.07 -0.22 -0.03 0.00 -1.12 0.00 0.00 38.32 37.02 3hqk h ASN 101 CO -0.00 0.83 0.36 0.40 -1.29 0.00 0.00 177.43 177.72 3hqk h ILE 102 N 0.84 1.20 -0.74 2.81 2.04 -1.50 -2.06 117.51 120.11 3hqk h ILE 102 Ca 0.18 -0.51 -0.03 0.00 1.00 0.00 0.00 64.86 65.50 3hqk h ILE 102 Cb 0.34 0.36 -0.03 0.00 -0.74 0.00 0.00 36.82 36.74 3hqk h ILE 102 CO 0.00 0.22 0.35 0.00 0.00 0.00 0.00 178.15 178.72 3hqk h ALA 103 N 1.17 0.95 -0.78 1.87 0.00 -1.75 -0.83 119.26 119.90 3hqk h ALA 103 Ca 0.23 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.93 3hqk h ALA 103 Cb 0.04 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.50 3hqk h ALA 103 CO -0.04 0.52 0.28 1.98 0.00 0.00 0.00 179.25 182.00 3hqk h MET 104 N 1.04 1.18 -0.65 0.00 1.85 -1.60 -0.90 114.93 115.84 3hqk h MET 104 Ca 0.25 -0.23 -0.01 0.00 -0.61 0.00 0.00 59.70 59.10 3hqk h MET 104 Cb 0.13 -0.18 -0.03 0.00 0.43 0.00 0.00 31.60 31.95 3hqk h MET 104 CO -0.03 0.97 0.36 0.28 -0.40 0.00 0.00 176.91 178.09 3hqk h VAL 105 N 1.14 1.20 -0.55 -5.77 2.07 -0.80 -0.79 116.25 112.75 3hqk h VAL 105 Ca 0.26 -0.51 -0.04 0.00 0.82 0.00 0.00 66.70 67.23 3hqk h VAL 105 Cb 0.26 0.35 -0.02 0.00 -1.52 0.00 0.00 31.29 30.35 3hqk h VAL 105 CO -0.02 0.22 0.20 0.58 0.02 0.00 0.00 177.57 178.58 3hqk h VAL 106 N 0.89 1.23 -0.70 2.57 2.07 -0.61 -2.30 116.25 119.40 3hqk h VAL 106 Ca 0.23 -0.72 -0.07 0.00 0.82 0.00 0.00 66.70 66.96 3hqk h VAL 106 Cb 0.04 0.67 -0.03 0.00 -1.52 0.00 0.00 31.29 30.45 3hqk h VAL 106 CO -0.04 0.27 0.17 0.40 0.02 0.00 0.00 177.57 178.39 3hqk h ILE 107 N 0.75 1.26 -0.19 4.57 5.03 -0.75 -1.07 117.51 127.11 3hqk h ILE 107 Ca 0.18 -0.97 0.01 0.00 -0.12 0.00 0.00 64.86 63.96 3hqk h ILE 107 Cb 0.23 0.56 -0.01 0.00 -3.03 0.00 0.00 36.82 34.56 3hqk h ILE 107 CO -0.01 0.37 0.11 1.23 -0.68 0.00 0.00 178.15 179.17 3hqk h GLY 108 N 1.05 0.26 0.89 5.37 0.00 -1.07 -1.22 103.07 108.36 3hqk h GLY 108 Ca 0.22 -0.09 -0.00 0.00 0.00 0.00 0.00 47.33 47.46 3hqk h GLY 108 CO 0.00 0.08 -0.15 -2.08 0.00 0.00 0.00 176.54 174.40 3hqk h VAL 109 N 0.24 0.68 -1.04 4.60 2.07 -1.33 -2.98 116.25 118.49 3hqk h VAL 109 Ca 0.07 0.00 0.32 0.00 0.82 0.00 0.00 66.70 67.91 3hqk h VAL 109 Cb -0.01 0.68 -0.14 0.00 -1.52 0.00 0.00 31.29 30.30 3hqk h VAL 109 CO -0.03 0.00 0.61 1.23 0.02 0.00 0.00 177.57 179.40 3hqk h GLY 110 N -0.36 1.90 0.57 2.17 0.00 -0.20 1.10 103.07 108.25 3hqk h GLY 110 Ca -0.02 -0.23 0.00 0.00 0.00 0.00 0.00 47.33 47.08 3hqk h GLY 110 CO 0.00 -0.42 0.00 -1.72 0.00 0.00 0.00 176.54 174.40 3hqk n TYR 111 N -4.96 0.00 -0.06 5.60 4.02 -0.56 -1.30 117.16 119.90 3hqk n TYR 111 Ca 0.31 0.00 -0.12 0.00 -0.01 0.00 0.00 57.90 58.08 3hqk n TYR 111 Cb 0.99 0.00 -0.04 0.00 -0.02 0.00 0.00 39.34 40.27 3hqk n TYR 111 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 3hqk n LEU 112 N -0.78 1.39 -1.23 7.72 4.77 0.38 -4.43 117.00 124.80 3hqk n LEU 112 Ca 0.10 0.23 0.05 0.00 -0.03 0.00 0.00 56.01 56.36 3hqk n LEU 112 Cb 0.05 -0.54 0.24 0.00 -2.33 0.00 0.00 43.42 40.84 3hqk n LEU 112 CO 0.08 -0.03 0.65 -1.54 -1.33 0.00 0.00 177.39 175.22 3hqk n SER 113 N -3.91 3.57 -0.11 -1.43 3.41 -1.06 -1.97 113.62 112.13 3hqk n SER 113 Ca -0.22 -2.42 -0.18 0.00 -0.26 0.00 0.00 58.87 55.79 3hqk n SER 113 Cb 0.54 -0.53 -0.06 0.00 -0.26 0.00 0.00 64.21 63.90 3hqk n SER 113 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 3hqk n TYR 114 N 0.54 0.00 -1.92 7.33 4.01 -0.42 -3.03 117.16 123.67 3hqk n TYR 114 Ca 0.17 0.00 -0.36 0.00 -0.16 0.00 0.00 57.90 57.55 3hqk n TYR 114 Cb 0.72 -0.71 -0.01 0.00 -0.31 0.00 0.00 39.34 39.04 3hqk n TYR 114 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 3hqk n PHE 115 N -4.27 2.37 0.00 -0.72 -0.00 -1.25 -3.28 117.46 110.30 3hqk n PHE 115 Ca -0.33 -2.35 0.00 0.00 -0.00 0.00 0.00 57.45 54.78 3hqk n PHE 115 Cb 0.68 -1.41 0.00 0.00 -0.00 0.00 0.00 39.48 38.75 3hqk n PHE 115 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.76 177.10 3hqk n PHE 116 N 0.57 0.00 -2.81 -5.13 -0.00 -0.83 -4.70 117.46 104.55 3hqk n PHE 116 Ca 0.53 0.00 -0.43 0.00 -0.00 0.00 0.00 57.45 57.55 3hqk n PHE 116 Cb 0.35 0.00 -0.04 0.00 -0.00 0.00 0.00 39.48 39.79 3hqk n PHE 116 CO 0.00 0.00 0.00 -2.14 -0.00 0.00 0.00 176.76 174.62 3hqk s PRO 117 N -1.99 3.42 0.16 -7.13 0.02 -1.21 -5.03 135.00 123.25 3hqk s PRO 117 Ca 0.00 -0.05 -0.15 0.00 0.02 0.00 0.00 61.00 60.82 3hqk s PRO 117 Cb 0.00 -4.00 0.04 0.00 0.02 0.00 0.00 34.50 30.56 3hqk s PRO 117 CO 0.00 -1.40 1.79 0.82 -0.33 0.00 0.00 177.00 177.88 3hqk h ILE 118 N 6.06 1.16 -3.48 2.83 2.04 -1.59 -3.44 117.51 121.07 3hqk h ILE 118 Ca -0.25 -0.38 -0.42 0.00 1.00 0.00 0.00 64.86 64.81 3hqk h ILE 118 Cb 1.07 0.52 -0.34 0.00 -0.74 0.00 0.00 36.82 37.33 3hqk h ILE 118 CO 1.07 0.16 -0.78 -0.76 0.00 0.00 0.00 178.15 177.85 3hqk s LEU 119 N -10.02 1.41 -0.00 1.44 1.02 -1.20 -4.97 118.68 106.35 3hqk s LEU 119 Ca -0.13 -0.15 0.01 0.00 0.02 0.00 0.00 54.13 53.88 3hqk s LEU 119 Cb 0.12 -0.48 -0.01 0.00 0.02 0.00 0.00 46.19 45.83 3hqk s LEU 119 CO 0.75 -0.04 0.01 0.29 0.02 0.00 0.00 176.35 177.39 3hqk n LYS 120 N 3.95 0.76 -2.14 1.70 5.02 -1.26 -4.62 118.16 121.56 3hqk n LYS 120 Ca -0.25 -0.01 -0.39 0.00 -2.02 0.00 0.00 58.31 55.65 3hqk n LYS 120 Cb 0.51 -1.02 -0.01 0.00 -0.02 0.00 0.00 35.03 34.50 3hqk n LYS 120 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3hqk s ASP 121 N -2.28 6.29 0.06 4.39 1.11 -1.26 -4.89 116.67 120.10 3hqk s ASP 121 Ca -0.00 2.51 -0.31 0.00 0.18 0.00 0.00 52.55 54.93 3hqk s ASP 121 Cb 0.00 -2.63 -0.18 0.00 1.07 0.00 0.00 42.92 41.19 3hqk s ASP 121 CO 0.03 -0.85 1.58 -0.65 1.18 0.00 0.00 175.17 176.46 3hqk h PRO 122 N 2.50 -0.73 -0.77 8.23 0.11 -1.98 0.22 132.00 139.57 3hqk h PRO 122 Ca -0.49 0.05 0.08 0.00 0.11 0.00 0.00 66.00 65.75 3hqk h PRO 122 Cb 1.25 0.17 -0.10 0.00 0.11 0.00 0.00 31.00 32.42 3hqk h PRO 122 CO 0.62 -0.47 -0.42 1.28 -0.21 0.00 0.00 178.00 178.80 3hqk n LEU 123 N -5.40 -0.74 -0.13 2.35 4.77 -1.26 0.84 117.00 117.42 3hqk n LEU 123 Ca -0.12 1.36 -0.04 0.00 -0.03 0.00 0.00 56.01 57.18 3hqk n LEU 123 Cb 0.32 -0.21 0.03 0.00 -2.33 0.00 0.00 43.42 41.24 3hqk n LEU 123 CO 0.37 -1.13 0.82 0.58 -1.33 0.00 0.00 177.39 176.69 3hqk h VAL 124 N 0.00 0.62 0.00 4.08 2.07 -1.86 -2.42 116.25 118.74 3hqk h VAL 124 Ca 0.16 -0.02 -0.00 0.00 0.82 0.00 0.00 66.70 67.65 3hqk h VAL 124 Cb 0.35 0.56 0.00 0.00 -1.52 0.00 0.00 31.29 30.68 3hqk h VAL 124 CO -0.73 0.01 -0.00 0.25 0.02 0.00 0.00 177.57 177.12 3hqk h LEU 125 N 0.06 -0.00 -0.47 2.57 6.46 0.24 -1.74 115.31 122.43 3hqk h LEU 125 Ca 0.21 -0.94 0.00 0.00 -0.12 0.00 0.00 57.88 57.03 3hqk h LEU 125 Cb 0.32 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.25 3hqk h LEU 125 CO -0.40 0.95 0.00 0.41 -0.62 0.00 0.00 178.44 178.78 3hqk n THR 126 N -4.63 1.11 -0.05 1.05 -1.04 0.25 -0.19 114.28 110.77 3hqk n THR 126 Ca -0.10 0.36 -0.22 0.00 -2.04 0.00 0.00 64.05 62.05 3hqk n THR 126 Cb 0.45 -1.25 -0.13 0.00 -1.82 0.00 0.00 70.33 67.59 3hqk n THR 126 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 3hqk n LEU 127 N -1.87 2.31 0.30 -4.42 4.77 -0.91 -2.58 117.00 114.60 3hqk n LEU 127 Ca 0.02 0.28 0.19 0.00 -0.03 0.00 0.00 56.01 56.47 3hqk n LEU 127 Cb 0.14 -1.03 0.93 0.00 -2.33 0.00 0.00 43.42 41.13 3hqk n LEU 127 CO 0.13 0.61 1.08 0.71 -1.33 0.00 0.00 177.39 178.59 3hqk h THR 128 N -0.42 0.11 0.00 -5.08 1.35 -0.80 0.37 112.91 108.44 3hqk h THR 128 Ca -0.42 -0.29 0.00 0.00 -0.55 0.00 0.00 66.41 65.15 3hqk h THR 128 Cb 1.72 1.25 0.00 0.00 -1.73 0.00 0.00 68.15 69.39 3hqk h THR 128 CO -0.07 0.02 0.00 0.00 -0.25 0.00 0.00 175.52 175.22 3hqk h VAL 130 N 0.00 0.06 0.00 0.00 2.07 -1.39 0.17 116.25 117.16 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 0.03 0.00 0.00 -1.52 0.00 0.00 31.29 29.80 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 -2.66 -0.34 0.29 1.67 0.00 0.13 -3.24 120.51 116.36 3hqk n ALA 131 Ca 0.40 0.00 0.18 0.00 0.00 0.00 0.00 53.44 54.03 3hqk n ALA 131 Cb 1.66 0.00 0.96 0.00 0.00 0.00 0.00 19.45 22.07 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 0.19 0.03 0.00 3.04 0.12 -1.47 116.25 118.16 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 0.85 -0.01 0.00 -2.01 0.00 0.00 31.29 30.12 3hqk h VAL 132 CO 0.00 0.00 -0.07 -0.07 -1.01 0.00 0.00 177.57 176.42 3hqk h LEU 133 N 0.00 -0.20 -2.20 3.16 3.38 -0.78 -2.94 115.31 115.73 3hqk h LEU 133 Ca 0.03 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.02 3hqk h LEU 133 Cb 0.37 0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.19 3hqk h LEU 133 CO -0.00 -0.08 0.00 -0.50 0.09 0.00 0.00 178.44 177.95 3hqk h TRP 134 N -0.11 0.00 -0.40 1.13 4.06 -1.25 0.61 115.95 119.99 3hqk h TRP 134 Ca -0.00 0.00 0.09 0.00 2.06 0.00 0.00 58.89 61.04 3hqk h TRP 134 Cb 0.10 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.24 3hqk h TRP 134 CO -0.26 0.00 0.28 0.82 -3.56 0.00 0.00 178.44 175.72 3hqk h ILE 135 N 0.00 0.87 0.01 1.49 5.03 -1.32 -1.30 117.51 122.29 3hqk h ILE 135 Ca 0.00 -0.05 -0.38 0.00 -0.12 0.00 0.00 64.86 64.31 3hqk h ILE 135 Cb 0.11 0.71 -0.06 0.00 -3.03 0.00 0.00 36.82 34.54 3hqk h ILE 135 CO 0.00 0.03 -2.41 0.49 -0.68 0.00 0.00 178.15 175.58 3hqk n PHE 136 N -4.45 0.13 0.06 1.37 3.72 0.20 -2.90 117.46 115.59 3hqk n PHE 136 Ca 0.06 0.03 0.01 0.00 -0.05 0.00 0.00 57.45 57.50 3hqk n PHE 136 Cb 0.37 -1.02 0.03 0.00 -0.94 0.00 0.00 39.48 37.92 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 0.89 -0.10 -4.37 3.14 -0.29 -0.78 118.33 113.62 3hqk n VAL 137 Ca -0.42 0.22 0.00 0.00 -2.96 0.00 0.00 64.34 61.18 3hqk n VAL 137 Cb 1.02 -1.20 0.00 0.00 -1.06 0.00 0.00 33.84 32.60 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 -1.23 1.56 -0.00 6.55 4.77 -0.50 -4.02 117.00 124.13 3hqk n LEU 138 Ca 0.01 -1.56 0.08 0.00 -0.03 0.00 0.00 56.01 54.50 3hqk n LEU 138 Cb 0.01 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 40.99 3hqk n LEU 138 CO 0.01 0.39 -0.35 0.18 -1.33 0.00 0.00 177.39 176.29 3hqk n LEU 139 N -0.33 0.41 -0.07 2.23 4.77 0.04 -3.78 117.00 120.27 3hqk n LEU 139 Ca 0.00 -0.26 -0.10 0.00 -0.03 0.00 0.00 56.01 55.61 3hqk n LEU 139 Cb 0.21 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.21 3hqk n LEU 139 CO 0.00 0.10 0.15 0.78 -1.33 0.00 0.00 177.39 177.09 3hqk h ASN 140 N 0.00 0.00 -2.96 -1.43 4.21 -1.70 -3.29 115.58 110.41 3hqk h ASN 140 Ca 0.00 -0.62 -0.71 0.00 1.21 0.00 0.00 56.30 56.18 3hqk h ASN 140 Cb 0.57 0.00 -0.21 0.00 -1.12 0.00 0.00 38.32 37.56 3hqk h ASN 140 CO 0.00 0.89 0.10 -0.51 -1.29 0.00 0.00 177.43 176.62 3hqk s ILE 141 N -2.04 4.92 0.04 2.81 2.07 -1.26 -0.65 121.20 127.08 3hqk s ILE 141 Ca -0.14 -1.18 0.06 0.00 -1.41 0.00 0.00 60.65 57.98 3hqk s ILE 141 Cb -0.01 -4.48 -0.02 0.00 0.13 0.00 0.00 42.46 38.08 3hqk s ILE 141 CO 0.46 -1.10 -0.18 -0.69 -1.91 0.00 0.00 174.94 171.52 3hqk s VAL 142 N 2.39 1.42 0.00 4.00 1.01 -1.25 -4.26 120.40 123.71 3hqk s VAL 142 Ca 0.11 -1.09 0.00 0.00 0.00 0.00 0.00 61.98 61.01 3hqk s VAL 142 Cb -0.23 -1.25 0.00 0.00 0.00 0.00 0.00 36.38 34.90 3hqk s VAL 142 CO 0.04 0.13 0.00 0.61 0.00 0.00 0.00 175.10 175.88 3hqk n GLY 143 N 1.91 -0.02 0.46 4.51 0.00 0.18 -4.83 105.19 107.40 3hqk n GLY 143 Ca -0.17 -0.22 0.28 0.00 0.00 0.00 0.00 46.02 45.90 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 0.00 -0.29 1.61 0.11 -1.80 1.01 132.00 132.65 3hqk h PRO 144 Ca 0.00 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 65.99 3hqk h PRO 144 Cb 0.00 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.11 3hqk h PRO 144 CO 0.00 0.00 -0.30 0.87 -0.21 0.00 0.00 178.00 178.36 3hqk h LYS 145 N 0.00 0.71 0.00 1.05 1.79 -1.92 -3.27 116.57 114.93 3hqk h LYS 145 Ca 0.40 -0.38 0.00 0.00 -2.18 0.00 0.00 60.65 58.49 3hqk h LYS 145 Cb 1.65 0.02 0.00 0.00 -1.58 0.00 0.00 32.23 32.32 3hqk h LYS 145 CO -0.00 1.00 0.00 -0.12 -1.08 0.00 0.00 179.45 179.24 3hqk n MET 146 N -4.25 0.00 -0.29 3.15 1.56 0.34 -0.99 117.12 116.64 3hqk n MET 146 Ca -0.04 0.70 0.05 0.00 -0.27 0.00 0.00 57.70 58.14 3hqk n MET 146 Cb 0.48 -1.46 0.19 0.00 2.15 0.00 0.00 33.22 34.58 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 0.81 -0.53 1.12 3.07 -1.28 0.65 117.51 121.34 3hqk h ILE 147 Ca 0.00 -0.24 -0.06 0.00 1.55 0.00 0.00 64.86 66.12 3hqk h ILE 147 Cb 0.00 0.07 -0.02 0.00 -0.27 0.00 0.00 36.82 36.59 3hqk h ILE 147 CO 0.00 0.13 0.10 0.71 -1.05 0.00 0.00 178.15 178.04 3hqk h THR 148 N 0.69 1.25 -0.22 0.16 1.35 -1.60 0.85 112.91 115.39 3hqk h THR 148 Ca 0.43 -0.92 0.05 0.00 -0.55 0.00 0.00 66.41 65.42 3hqk h THR 148 Cb 0.51 0.82 -0.06 0.00 -1.73 0.00 0.00 68.15 67.69 3hqk h THR 148 CO -0.31 0.33 -0.15 0.03 -0.25 0.00 0.00 175.52 175.18 3hqk h ARG 149 N 0.76 -0.13 -0.63 4.72 3.08 0.57 -2.61 114.38 120.14 3hqk h ARG 149 Ca 0.16 0.01 0.02 0.00 0.07 0.00 0.00 59.98 60.24 3hqk h ARG 149 Cb 0.38 0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.43 3hqk h ARG 149 CO 0.01 -0.09 0.42 0.28 -1.07 0.00 0.00 179.97 179.52 3hqk h VAL 150 N -0.14 1.13 0.00 2.04 2.07 0.12 -2.23 116.25 119.24 3hqk h VAL 150 Ca 0.12 -0.28 -0.27 0.00 0.82 0.00 0.00 66.70 67.09 3hqk h VAL 150 Cb 0.32 0.25 -0.04 0.00 -1.52 0.00 0.00 31.29 30.30 3hqk h VAL 150 CO -0.30 0.15 0.73 0.00 0.02 0.00 0.00 177.57 178.17 3hqk n GLN 151 N -4.45 2.10 0.00 1.57 6.02 0.29 -2.72 117.38 120.18 3hqk n GLN 151 Ca 0.07 -1.15 0.12 0.00 -0.01 0.00 0.00 57.00 56.03 3hqk n GLN 151 Cb 0.08 -2.13 0.27 0.00 1.02 0.00 0.00 30.24 29.47 3hqk n GLN 151 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3hqk n ALA 152 N 2.90 3.24 -0.26 -1.58 0.00 -0.84 -3.64 120.51 120.33 3hqk n ALA 152 Ca 0.45 -0.47 -0.04 0.00 0.00 0.00 0.00 53.44 53.38 3hqk n ALA 152 Cb 0.63 -1.04 0.12 0.00 0.00 0.00 0.00 19.45 19.16 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 1.52 1.25 -0.43 0.00 2.07 -1.80 0.14 116.25 119.00 3hqk h VAL 153 Ca 0.00 -0.74 0.13 0.00 0.82 0.00 0.00 66.70 66.91 3hqk h VAL 153 Cb 0.58 0.30 -0.02 0.00 -1.52 0.00 0.00 31.29 30.63 3hqk h VAL 153 CO 0.00 0.31 0.35 0.00 0.02 0.00 0.00 177.57 178.25 3hqk h ALA 154 N 1.27 2.29 -0.04 1.67 0.00 -1.87 0.37 119.26 122.96 3hqk h ALA 154 Ca 0.26 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.11 3hqk h ALA 154 Cb 0.16 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.98 3hqk h ALA 154 CO -0.03 -0.58 -0.16 1.79 0.00 0.00 0.00 179.25 180.27 3hqk h THR 155 N 0.00 1.47 0.70 0.00 1.35 -0.97 0.07 112.91 115.53 3hqk h THR 155 Ca 0.21 -1.63 -0.03 0.00 -0.55 0.00 0.00 66.41 64.41 3hqk h THR 155 Cb 0.91 2.44 0.00 0.00 -1.73 0.00 0.00 68.15 69.77 3hqk h THR 155 CO -0.00 0.45 -0.36 0.58 -0.25 0.00 0.00 175.52 175.93 3hqk h VAL 156 N -0.39 0.26 -0.30 6.82 2.07 -0.53 -2.92 116.25 121.25 3hqk h VAL 156 Ca -0.01 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.56 3hqk h VAL 156 Cb 0.81 0.26 -0.05 0.00 -1.52 0.00 0.00 31.29 30.79 3hqk h VAL 156 CO 0.03 0.00 0.01 0.25 0.02 0.00 0.00 177.57 177.88 3hqk h LEU 157 N -0.98 -0.11 -2.37 2.57 5.85 -0.42 -2.22 115.31 117.63 3hqk h LEU 157 Ca -0.09 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.69 3hqk h LEU 157 Cb 0.76 0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.91 3hqk h LEU 157 CO 0.14 -0.02 0.00 0.00 -0.34 0.00 0.00 178.44 178.22 3hqk h ALA 158 N 1.25 1.00 0.00 1.25 0.00 -0.94 -2.03 119.26 119.79 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 0.19 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.98 3hqk h ALA 158 CO -0.24 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.29 3hqk n LEU 159 N -2.85 0.58 -0.01 0.00 4.77 -0.84 -2.42 117.00 116.24 3hqk n LEU 159 Ca -0.02 -0.29 -0.05 0.00 -0.03 0.00 0.00 56.01 55.62 3hqk n LEU 159 Cb 0.09 -0.29 -0.02 0.00 -2.33 0.00 0.00 43.42 40.88 3hqk n LEU 159 CO 0.18 0.15 -0.37 0.52 -1.33 0.00 0.00 177.39 176.54 3hqk n VAL 160 N -0.20 1.11 0.27 4.08 0.31 -0.76 -4.15 118.33 118.99 3hqk n VAL 160 Ca 0.00 0.21 0.18 0.00 -0.01 0.00 0.00 64.34 64.72 3hqk n VAL 160 Cb 0.15 -1.78 0.96 0.00 -0.91 0.00 0.00 33.84 32.25 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 -0.32 0.00 0.42 5.55 0.11 -1.71 0.84 132.00 136.89 3hqk h PRO 161 Ca -0.06 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.03 3hqk h PRO 161 Cb 0.55 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.66 3hqk h PRO 161 CO -0.04 0.00 -0.20 0.82 -0.21 0.00 0.00 178.00 178.37 3hqk h ILE 162 N 0.00 0.55 -0.94 4.15 2.04 -1.73 -2.56 117.51 119.03 3hqk h ILE 162 Ca 0.00 -0.37 0.07 0.00 1.00 0.00 0.00 64.86 65.56 3hqk h ILE 162 Cb 0.02 0.72 -0.07 0.00 -0.74 0.00 0.00 36.82 36.76 3hqk h ILE 162 CO 0.00 0.06 0.59 0.58 0.00 0.00 0.00 178.15 179.39 3hqk h VAL 163 N -0.79 1.05 0.00 1.67 2.07 -0.29 3.91 116.25 123.88 3hqk h VAL 163 Ca -0.06 -0.37 0.00 0.00 0.82 0.00 0.00 66.70 67.10 3hqk h VAL 163 Cb 0.54 -0.11 0.00 0.00 -1.52 0.00 0.00 31.29 30.20 3hqk h VAL 163 CO 0.09 0.19 0.00 0.61 0.02 0.00 0.00 177.57 178.49 3hqk n GLY 164 N -1.35 -0.64 1.88 2.17 0.00 0.24 -1.99 105.19 105.51 3hqk n GLY 164 Ca 0.14 -0.04 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 -0.64 0.00 1.41 -0.61 5.41 0.90 -4.63 119.36 121.20 3hqk n ILE 165 Ca 0.04 0.00 0.12 0.00 1.00 0.00 0.00 62.75 63.91 3hqk n ILE 165 Cb 0.02 -0.51 0.68 0.00 -0.71 0.00 0.00 39.64 39.12 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 -2.47 2.34 -3.09 -1.39 0.00 1.26 -3.75 120.51 113.41 3hqk n ALA 166 Ca 0.00 -0.14 -0.19 0.00 0.00 0.00 0.00 53.44 53.11 3hqk n ALA 166 Cb 0.02 -1.38 -0.03 0.00 0.00 0.00 0.00 19.45 18.05 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 -1.05 -0.45 -4.07 0.00 0.31 -0.84 -4.97 118.33 107.25 3hqk n VAL 167 Ca 0.16 -3.51 -0.27 0.00 -0.01 0.00 0.00 64.34 60.71 3hqk n VAL 167 Cb 0.10 -0.88 -0.17 0.00 -0.91 0.00 0.00 33.84 31.98 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 -0.95 1.63 -0.02 3.52 -0.71 -1.25 -4.61 117.98 115.59 3hqk s PHE 168 Ca 0.35 -0.80 0.00 0.00 -1.04 0.00 0.00 56.93 55.44 3hqk s PHE 168 Cb 0.21 -1.28 0.03 0.00 -1.21 0.00 0.00 43.02 40.77 3hqk s PHE 168 CO -0.13 -0.50 0.01 0.20 -1.34 0.00 0.00 175.22 173.47 3hqk s GLY 169 N 1.45 0.17 0.00 1.99 0.00 -1.26 -4.94 107.32 104.73 3hqk s GLY 169 Ca 0.01 0.23 0.00 0.00 0.00 0.00 0.00 44.72 44.96 3hqk s GLY 169 CO -0.06 0.64 0.00 1.87 0.00 0.00 0.00 173.10 175.55 3hqk n TRP 170 N 4.15 0.00 -3.94 1.90 -0.00 -1.26 -4.06 117.44 114.22 3hqk n TRP 170 Ca -0.27 0.00 -0.09 0.00 -0.00 0.00 0.00 57.50 57.13 3hqk n TRP 170 Cb 0.50 0.00 -0.09 0.00 -0.00 0.00 0.00 31.31 31.72 3hqk n TRP 170 CO 0.00 0.00 0.00 0.12 -0.00 0.00 0.00 177.69 177.81 3hqk s PHE 171 N -0.65 0.23 0.04 5.87 5.36 -1.26 -4.92 117.98 122.65 3hqk s PHE 171 Ca 0.00 -0.56 -0.07 0.00 -0.96 0.00 0.00 56.93 55.34 3hqk s PHE 171 Cb 0.00 -0.16 -0.01 0.00 -0.34 0.00 0.00 43.02 42.51 3hqk s PHE 171 CO 0.00 -0.37 0.13 -1.58 -1.46 0.00 0.00 175.22 171.94 3hqk s TRP 172 N -2.78 0.16 0.24 10.12 0.52 -1.26 -5.08 118.94 120.86 3hqk s TRP 172 Ca -0.04 -0.45 -0.30 0.00 0.02 0.00 0.00 56.10 55.34 3hqk s TRP 172 Cb -0.00 -0.11 -0.15 0.00 -1.15 0.00 0.00 33.47 32.06 3hqk s TRP 172 CO -0.05 -0.39 1.06 1.19 0.02 0.00 0.00 176.95 178.77 3hqk n PHE 173 N 0.69 1.21 0.00 -1.98 3.01 -1.26 -4.96 117.46 114.17 3hqk n PHE 173 Ca -0.19 0.70 0.00 0.00 1.01 0.00 0.00 57.45 58.98 3hqk n PHE 173 Cb 0.59 -2.25 0.00 0.00 -0.01 0.00 0.00 39.48 37.81 3hqk n PHE 173 CO 0.00 0.00 0.00 0.36 1.01 0.00 0.00 176.76 178.13 3hqk n LYS 174 N 1.19 0.00 -3.51 -1.08 2.85 -1.26 -5.09 118.16 111.27 3hqk n LYS 174 Ca 0.12 0.00 -0.09 0.00 -1.05 0.00 0.00 58.31 57.29 3hqk n LYS 174 Cb 0.29 0.00 -0.02 0.00 -0.65 0.00 0.00 35.03 34.65 3hqk n LYS 174 CO 0.00 0.00 0.00 1.67 -0.05 0.00 0.00 177.40 179.02 3hqk s TRP 182 N 3.96 -0.37 -1.43 5.58 -2.14 -1.26 -4.87 118.94 118.41 3hqk s TRP 182 Ca 0.00 0.21 -0.07 0.00 2.66 0.00 0.00 56.10 58.89 3hqk s TRP 182 Cb 0.00 0.55 0.04 0.00 -3.10 0.00 0.00 33.47 30.96 3hqk s TRP 182 CO 0.00 -0.63 0.83 -1.71 -2.66 0.00 0.00 176.95 172.78 3hqk n ASN 183 N -0.29 -2.98 -2.98 -2.66 5.15 -1.25 -4.78 115.26 105.47 3hqk n ASN 183 Ca -0.10 -0.81 -0.32 0.00 -0.60 0.00 0.00 54.58 52.75 3hqk n ASN 183 Cb 0.62 -3.92 -0.06 0.00 -0.53 0.00 0.00 39.78 35.89 3hqk n ASN 183 CO 0.00 0.00 0.00 0.55 1.40 0.00 0.00 177.26 179.21 3hqk n VAL 184 N -4.49 4.06 -3.44 3.44 3.14 -1.25 -4.70 118.33 115.09 3hqk n VAL 184 Ca -0.13 -2.50 -0.12 0.00 -2.96 0.00 0.00 64.34 58.64 3hqk n VAL 184 Cb 0.60 -2.38 -0.02 0.00 -1.06 0.00 0.00 33.84 30.98 3hqk n VAL 184 CO 0.00 0.00 0.00 -0.94 -6.46 0.00 0.00 176.83 169.43 3hqk s SER 185 N 1.90 -0.55 0.97 6.55 1.04 -1.26 -4.68 113.70 117.67 3hqk s SER 185 Ca 0.67 0.05 -0.17 0.00 0.48 0.00 0.00 55.95 56.98 3hqk s SER 185 Cb 0.22 0.57 -0.15 0.00 0.10 0.00 0.00 66.02 66.76 3hqk s SER 185 CO -0.05 -0.90 -0.75 0.61 0.98 0.00 0.00 173.24 173.12 3hqk n GLY 186 N -0.28 -4.56 3.92 7.32 0.00 -1.26 -5.01 105.19 105.31 3hqk n GLY 186 Ca -0.16 -0.77 -0.26 0.00 0.00 0.00 0.00 46.02 44.83 3hqk n GLY 186 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3hqk s MET 187 N -1.98 3.16 0.87 1.61 1.75 -1.26 -4.55 119.30 118.89 3hqk s MET 187 Ca 0.41 0.02 -0.12 0.00 -1.25 0.00 0.00 55.69 54.75 3hqk s MET 187 Cb -0.20 -2.34 0.11 0.00 2.84 0.00 0.00 34.83 35.25 3hqk s MET 187 CO 0.82 -0.48 1.11 -0.80 -0.65 0.00 0.00 175.02 175.02 3hqk s ASN 188 N -4.23 3.86 0.37 1.11 0.01 -1.26 -4.95 114.94 109.85 3hqk s ASN 188 Ca 0.51 1.18 0.09 0.00 -0.71 0.00 0.00 52.86 53.93 3hqk s ASN 188 Cb -0.10 -1.84 0.82 0.00 0.41 0.00 0.00 41.25 40.54 3hqk s ASN 188 CO 0.44 -2.36 1.92 0.71 -1.51 0.00 0.00 177.10 176.31 3hqk h THR 189 N -1.36 0.92 0.36 1.60 1.35 -1.98 -2.07 112.91 111.72 3hqk h THR 189 Ca -0.49 -0.23 -0.02 0.00 -0.55 0.00 0.00 66.41 65.12 3hqk h THR 189 Cb 1.30 0.19 0.00 0.00 -1.73 0.00 0.00 68.15 67.92 3hqk h THR 189 CO 0.60 0.12 -0.17 -0.26 -0.25 0.00 0.00 175.52 175.56 3hqk h PHE 190 N 0.67 -0.45 -0.40 4.73 0.04 -1.97 -3.05 116.94 116.51 3hqk h PHE 190 Ca 0.36 -0.01 0.12 0.00 2.80 0.00 0.00 57.97 61.24 3hqk h PHE 190 Cb 0.51 0.15 -0.02 0.00 2.20 0.00 0.00 35.95 38.79 3hqk h PHE 190 CO -0.00 -0.28 0.95 0.78 -0.60 0.00 0.00 178.31 179.16 3hqk h GLY 191 N -0.82 0.00 0.73 -1.45 0.00 -1.91 3.15 103.07 102.77 3hqk h GLY 191 Ca -0.05 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.27 3hqk h GLY 191 CO 0.08 0.00 -0.00 0.00 0.00 0.00 0.00 176.54 176.62 3hqk h ALA 192 N 0.47 0.11 -0.05 3.60 0.00 -1.27 -2.72 119.26 119.40 3hqk h ALA 192 Ca 0.19 -0.18 -0.15 0.00 0.00 0.00 0.00 54.91 54.77 3hqk h ALA 192 Cb 2.09 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.84 3hqk h ALA 192 CO -0.00 -0.20 -0.63 0.82 0.00 0.00 0.00 179.25 179.24 3hqk h ILE 193 N -0.15 1.40 -0.22 0.00 2.04 0.56 -2.95 117.51 118.21 3hqk h ILE 193 Ca 0.02 -2.05 -0.06 0.00 1.00 0.00 0.00 64.86 63.77 3hqk h ILE 193 Cb 0.36 2.06 -0.01 0.00 -0.74 0.00 0.00 36.82 38.49 3hqk h ILE 193 CO 0.00 0.60 -0.15 1.56 0.00 0.00 0.00 178.15 180.17 3hqk h GLN 194 N 0.15 0.36 0.00 2.37 4.20 -0.85 -1.86 115.11 119.48 3hqk h GLN 194 Ca -0.01 -0.10 -0.05 0.00 0.06 0.00 0.00 58.65 58.56 3hqk h GLN 194 Cb 1.14 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.87 3hqk h GLN 194 CO 0.10 0.51 -0.37 0.66 -0.67 0.00 0.00 178.83 179.06 3hqk h SER 195 N 0.34 0.00 -0.03 1.46 4.64 -1.44 -3.04 113.55 115.48 3hqk h SER 195 Ca 0.06 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.27 3hqk h SER 195 Cb 0.47 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.54 3hqk h SER 195 CO 0.03 0.21 -0.32 0.74 -0.87 0.00 0.00 176.83 176.61 3hqk h THR 196 N 0.00 1.28 -0.49 2.95 2.02 -1.18 -3.13 112.91 114.37 3hqk h THR 196 Ca -0.01 -1.41 -0.06 0.00 0.77 0.00 0.00 66.41 65.69 3hqk h THR 196 Cb 1.17 1.46 -0.02 0.00 -1.74 0.00 0.00 68.15 69.02 3hqk h THR 196 CO 0.03 0.45 0.07 -0.07 0.37 0.00 0.00 175.52 176.36 3hqk h LEU 197 N 0.43 0.78 0.00 2.58 3.38 -1.31 -2.21 115.31 118.96 3hqk h LEU 197 Ca 0.05 -0.27 0.00 0.00 0.09 0.00 0.00 57.88 57.75 3hqk h LEU 197 Cb 0.78 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.32 3hqk h LEU 197 CO 0.06 0.85 0.07 0.59 0.09 0.00 0.00 178.44 180.10 3hqk n ASN 198 N -4.41 0.00 -0.04 -0.43 4.13 -1.18 0.57 115.26 113.90 3hqk n ASN 198 Ca 0.01 0.15 -0.05 0.00 1.68 0.00 0.00 54.58 56.37 3hqk n ASN 198 Cb 0.26 -0.15 -0.05 0.00 -1.54 0.00 0.00 39.78 38.30 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 -1.07 0.50 -0.03 2.41 0.31 -0.86 -4.75 118.33 114.83 3hqk n VAL 199 Ca 0.00 -0.25 -0.00 0.00 -0.01 0.00 0.00 64.34 64.08 3hqk n VAL 199 Cb 0.07 -0.82 -0.14 0.00 -0.91 0.00 0.00 33.84 32.04 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 -2.52 0.90 0.19 2.52 -2.24 0.19 -3.61 114.28 109.72 3hqk n THR 200 Ca -0.14 -0.70 -0.14 0.00 -2.27 0.00 0.00 64.05 60.80 3hqk n THR 200 Cb 0.70 -0.41 -0.08 0.00 -2.10 0.00 0.00 70.33 68.44 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 -0.40 0.00 3.22 3.38 -1.41 -3.03 115.31 117.07 3hqk h LEU 201 Ca -0.26 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.62 3hqk h LEU 201 Cb 1.65 0.10 0.00 0.00 0.09 0.00 0.00 40.66 42.50 3hqk h LEU 201 CO 0.03 -0.14 0.00 0.79 0.09 0.00 0.00 178.44 179.21 3hqk n TRP 202 N -5.22 0.00 0.48 1.13 7.02 -1.26 -2.56 117.44 117.04 3hqk n TRP 202 Ca -0.10 0.00 0.12 0.00 -1.02 0.00 0.00 57.50 56.50 3hqk n TRP 202 Cb 0.25 0.00 0.26 0.00 -2.42 0.00 0.00 31.31 29.40 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 0.00 -0.38 -0.99 4.64 -1.59 -3.32 113.55 111.91 3hqk h SER 203 Ca 0.00 -0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.27 3hqk h SER 203 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3hqk h SER 203 CO 0.00 0.03 0.00 0.49 -0.87 0.00 0.00 176.83 176.48 3hqk n PHE 204 N -2.44 1.32 -0.13 4.77 3.72 -1.06 -4.72 117.46 118.93 3hqk n PHE 204 Ca 0.04 -0.81 -0.09 0.00 -0.05 0.00 0.00 57.45 56.54 3hqk n PHE 204 Cb 0.46 -0.37 -0.01 0.00 -0.94 0.00 0.00 39.48 38.62 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 2.61 1.21 -0.45 4.37 1.08 -1.77 -3.36 117.51 121.19 3hqk h ILE 205 Ca 0.00 -0.68 -0.08 0.00 -0.39 0.00 0.00 64.86 63.71 3hqk h ILE 205 Cb 1.60 0.91 -0.02 0.00 -3.07 0.00 0.00 36.82 36.25 3hqk h ILE 205 CO 0.31 0.24 -0.03 1.23 -0.69 0.00 0.00 178.15 179.21 3hqk h GLY 206 N 0.49 0.87 0.98 5.37 0.00 -1.85 -3.39 103.07 105.54 3hqk h GLY 206 Ca 0.13 -0.66 -0.04 0.00 0.00 0.00 0.00 47.33 46.76 3hqk h GLY 206 CO -0.01 0.61 0.19 -0.24 0.00 0.00 0.00 176.54 177.09 3hqk h VAL 207 N 0.65 1.22 -0.46 4.60 3.04 -1.71 -3.22 116.25 120.36 3hqk h VAL 207 Ca 0.12 -0.72 -0.04 0.00 -1.01 0.00 0.00 66.70 65.06 3hqk h VAL 207 Cb 0.54 0.72 -0.02 0.00 -2.01 0.00 0.00 31.29 30.51 3hqk h VAL 207 CO 0.03 0.27 0.14 -0.33 -1.01 0.00 0.00 177.57 176.67 3hqk h GLU 208 N 0.70 0.72 -0.50 4.17 5.08 -1.76 -3.20 114.58 119.80 3hqk h GLU 208 Ca 0.17 -0.16 -0.06 0.00 -1.00 0.00 0.00 59.36 58.31 3hqk h GLU 208 Cb 0.23 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.36 3hqk h GLU 208 CO -0.01 0.69 0.06 0.66 -1.00 0.00 0.00 179.01 179.41 3hqk h SER 209 N 0.62 0.76 -0.73 1.42 4.64 -1.76 -3.29 113.55 115.20 3hqk h SER 209 Ca 0.15 -0.16 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 3hqk h SER 209 Cb 0.27 -0.20 -0.04 0.00 -0.31 0.00 0.00 62.40 62.13 3hqk h SER 209 CO -0.00 0.78 0.46 0.00 -0.87 0.00 0.00 176.83 177.20 3hqk h ALA 210 N 1.31 0.92 -0.24 5.18 0.00 -1.56 -1.82 119.26 123.05 3hqk h ALA 210 Ca 0.16 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 3hqk h ALA 210 Cb 0.37 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3hqk h ALA 210 CO 0.01 0.36 0.07 0.66 0.00 0.00 0.00 179.25 180.35 3hqk h SER 211 N 0.99 0.36 -0.28 0.00 4.64 -1.66 -2.97 113.55 114.63 3hqk h SER 211 Ca 0.26 -0.21 -0.09 0.00 -0.47 0.00 0.00 61.79 61.28 3hqk h SER 211 Cb -0.08 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 61.91 3hqk h SER 211 CO -0.05 0.48 -0.16 0.58 -0.87 0.00 0.00 176.83 176.80 3hqk h VAL 212 N 0.22 1.30 0.00 0.95 2.07 -1.68 -3.17 116.25 115.94 3hqk h VAL 212 Ca 0.08 -1.28 0.00 0.00 0.82 0.00 0.00 66.70 66.32 3hqk h VAL 212 Cb 0.25 1.53 0.00 0.00 -1.52 0.00 0.00 31.29 31.55 3hqk h VAL 212 CO -0.00 0.40 0.00 0.00 0.02 0.00 0.00 177.57 177.99 3hqk h ALA 213 N 0.73 1.00 -0.81 1.67 0.00 -1.40 -3.34 119.26 117.10 3hqk h ALA 213 Ca 0.06 0.00 -0.72 0.00 0.00 0.00 0.00 54.91 54.25 3hqk h ALA 213 Cb 0.69 0.00 -0.11 0.00 0.00 0.00 0.00 17.79 18.37 3hqk h ALA 213 CO 0.05 0.00 2.23 0.00 0.00 0.00 0.00 179.25 181.53 3hqk n ALA 214 N -1.98 4.68 -0.23 0.00 0.00 -1.12 -2.92 120.51 118.94 3hqk n ALA 214 Ca 0.00 -4.07 -0.07 0.00 0.00 0.00 0.00 53.44 49.30 3hqk n ALA 214 Cb 0.23 -3.30 0.04 0.00 0.00 0.00 0.00 19.45 16.42 3hqk n ALA 214 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3hqk h GLY 215 N 9.94 0.98 -5.47 0.00 0.00 0.50 -3.09 103.07 105.93 3hqk h GLY 215 Ca 0.44 -0.49 -0.72 0.00 0.00 0.00 0.00 47.33 46.56 3hqk h GLY 215 CO 1.58 0.46 2.90 3.33 0.00 0.00 0.00 176.54 184.81 3hqk n VAL 216 N -4.49 4.86 1.44 4.60 0.24 -1.25 -4.20 118.33 119.53 3hqk n VAL 216 Ca 0.04 -3.72 0.14 0.00 -2.04 0.00 0.00 64.34 58.76 3hqk n VAL 216 Cb 0.13 -2.28 0.50 0.00 -1.47 0.00 0.00 33.84 30.72 3hqk n VAL 216 CO 0.00 0.00 0.00 1.33 -2.14 0.00 0.00 176.83 176.02 3hqk n VAL 217 N 2.49 0.00 -2.95 3.34 0.24 -1.17 -4.48 118.33 115.81 3hqk n VAL 217 Ca 0.67 -0.19 -0.20 0.00 -2.04 0.00 0.00 64.34 62.57 3hqk n VAL 217 Cb 0.25 0.40 0.01 0.00 -1.47 0.00 0.00 33.84 33.02 3hqk n VAL 217 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 3hqk n LYS 218 N -0.18 -3.36 -3.98 7.34 5.02 -1.26 0.34 118.16 122.08 3hqk n LYS 218 Ca 0.17 0.67 -0.09 0.00 -2.02 0.00 0.00 58.31 57.04 3hqk n LYS 218 Cb 0.34 -5.38 -0.10 0.00 -0.02 0.00 0.00 35.03 29.86 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 -2.48 0.26 0.00 4.39 0.02 -1.26 -4.72 114.94 111.15 3hqk s ASN 219 Ca 0.24 -0.58 0.00 0.00 -1.02 0.00 0.00 52.86 51.50 3hqk s ASN 219 Cb -0.12 0.15 0.00 0.00 0.02 0.00 0.00 41.25 41.31 3hqk s ASN 219 CO 0.29 -0.40 0.00 -2.65 0.02 0.00 0.00 177.10 174.36 3hqk n PRO 220 N 1.14 2.70 -1.32 -0.60 -0.02 -1.26 -4.88 135.00 130.76 3hqk n PRO 220 Ca -0.21 0.00 -0.08 0.00 -2.02 0.00 0.00 63.50 61.19 3hqk n PRO 220 Cb 0.57 0.00 0.11 0.00 -0.02 0.00 0.00 33.50 34.16 3hqk n PRO 220 CO 0.00 0.00 0.00 0.36 1.98 0.00 0.00 175.50 177.84 3hqk n LYS 221 N 0.00 2.52 -0.11 -0.52 2.85 -1.26 -4.44 118.16 117.20 3hqk n LYS 221 Ca 0.00 -3.69 -0.22 0.00 -1.05 0.00 0.00 58.31 53.35 3hqk n LYS 221 Cb 0.00 -1.90 -0.07 0.00 -0.65 0.00 0.00 35.03 32.41 3hqk n LYS 221 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 3hqk n ARG 222 N -0.89 0.49 0.26 -1.58 1.74 -1.26 -4.54 116.66 110.88 3hqk n ARG 222 Ca 0.30 0.21 -0.16 0.00 -0.77 0.00 0.00 57.85 57.43 3hqk n ARG 222 Cb 0.83 -1.32 -0.08 0.00 -1.02 0.00 0.00 32.46 30.87 3hqk n ARG 222 CO 0.00 0.00 0.00 -0.91 -1.52 0.00 0.00 177.63 175.20 3hqk h ASN 223 N -0.84 -0.86 -0.64 0.55 2.35 -1.91 -2.99 115.58 111.24 3hqk h ASN 223 Ca -0.50 0.06 0.07 0.00 -0.55 0.00 0.00 56.30 55.39 3hqk h ASN 223 Cb 1.41 0.27 -0.10 0.00 0.05 0.00 0.00 38.32 39.95 3hqk h ASN 223 CO -0.30 -0.50 -0.54 0.58 -1.65 0.00 0.00 177.43 175.02 3hqk h VAL 224 N -0.76 0.02 0.00 2.81 2.07 -1.87 0.78 116.25 119.30 3hqk h VAL 224 Ca -0.04 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.48 3hqk h VAL 224 Cb 0.65 0.02 0.00 0.00 -1.52 0.00 0.00 31.29 30.44 3hqk h VAL 224 CO 0.01 0.00 0.00 -0.65 0.02 0.00 0.00 177.57 176.95 3hqk h PRO 225 N -0.23 0.00 0.14 1.57 0.11 -1.77 1.13 132.00 132.94 3hqk h PRO 225 Ca 0.13 0.00 -0.24 0.00 0.11 0.00 0.00 66.00 66.00 3hqk h PRO 225 Cb 0.53 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.65 3hqk h PRO 225 CO -0.73 0.00 -1.15 0.82 -0.21 0.00 0.00 178.00 176.72 3hqk h ILE 226 N 0.00 1.26 -0.31 4.15 2.04 -0.83 -3.15 117.51 120.67 3hqk h ILE 226 Ca 0.00 -2.48 0.05 0.00 1.00 0.00 0.00 64.86 63.43 3hqk h ILE 226 Cb 0.18 2.95 -0.05 0.00 -0.74 0.00 0.00 36.82 39.17 3hqk h ILE 226 CO 0.00 0.72 0.03 0.00 0.00 0.00 0.00 178.15 178.90 3hqk h ALA 227 N 0.02 0.31 0.00 1.87 0.00 -0.44 1.46 119.26 122.48 3hqk h ALA 227 Ca -0.23 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.75 3hqk h ALA 227 Cb 1.73 0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.64 3hqk h ALA 227 CO 0.11 -0.38 0.00 -2.37 0.00 0.00 0.00 179.25 176.62 3hqk n THR 228 N -5.13 0.00 0.00 0.00 5.66 0.38 -1.40 114.28 113.80 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 -0.36 0.00 0.00 -1.55 0.00 0.00 70.33 68.57 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 -0.66 0.00 0.26 1.09 2.08 -1.09 -4.67 119.36 116.37 3hqk n ILE 229 Ca 0.04 0.00 -0.11 0.00 0.56 0.00 0.00 62.75 63.24 3hqk n ILE 229 Cb 0.02 0.09 -0.05 0.00 -0.75 0.00 0.00 39.64 38.94 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 -0.75 -0.10 7.39 0.00 0.33 -1.27 103.07 108.67 3hqk h GLY 230 Ca 0.00 0.28 0.02 0.00 0.00 0.00 0.00 47.33 47.63 3hqk h GLY 230 CO 0.00 -0.27 -0.44 -1.33 0.00 0.00 0.00 176.54 174.49 3hqk h GLY 231 N -1.19 -1.18 0.19 4.60 0.00 -1.39 0.44 103.07 104.54 3hqk h GLY 231 Ca -0.07 0.68 0.15 0.00 0.00 0.00 0.00 47.33 48.08 3hqk h GLY 231 CO 0.12 -0.27 0.39 -2.08 0.00 0.00 0.00 176.54 174.70 3hqk h VAL 232 N -0.48 0.70 -0.41 4.60 2.07 -1.78 0.40 116.25 121.35 3hqk h VAL 232 Ca 0.02 -0.19 -0.07 0.00 0.82 0.00 0.00 66.70 67.28 3hqk h VAL 232 Cb 0.56 0.09 -0.01 0.00 -1.52 0.00 0.00 31.29 30.41 3hqk h VAL 232 CO -0.35 0.10 -0.02 -0.07 0.02 0.00 0.00 177.57 177.25 3hqk h LEU 233 N 0.56 0.73 0.29 2.57 3.38 -0.73 -1.56 115.31 120.54 3hqk h LEU 233 Ca 0.45 -0.32 -0.01 0.00 0.09 0.00 0.00 57.88 58.09 3hqk h LEU 233 Cb 0.66 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.21 3hqk h LEU 233 CO -0.38 0.87 -0.20 0.40 0.09 0.00 0.00 178.44 179.22 3hqk h ILE 234 N 0.56 0.00 0.00 1.22 2.04 0.16 -2.86 117.51 118.64 3hqk h ILE 234 Ca 0.11 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.97 3hqk h ILE 234 Cb 0.51 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.59 3hqk h ILE 234 CO 0.02 0.00 0.00 0.00 0.00 0.00 0.00 178.15 178.17 3hqk n ALA 235 N -2.38 2.07 0.03 1.87 0.00 0.13 -1.14 120.51 121.09 3hqk n ALA 235 Ca -0.06 -0.08 -0.21 0.00 0.00 0.00 0.00 53.44 53.09 3hqk n ALA 235 Cb 0.20 -1.21 -0.14 0.00 0.00 0.00 0.00 19.45 18.30 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 2.79 0.35 0.57 0.00 0.00 -1.12 -3.13 119.26 118.72 3hqk h ALA 236 Ca 0.00 -1.30 -0.03 0.00 0.00 0.00 0.00 54.91 53.58 3hqk h ALA 236 Cb 0.00 0.59 0.01 0.00 0.00 0.00 0.00 17.79 18.38 3hqk h ALA 236 CO 0.00 1.22 -0.28 0.28 0.00 0.00 0.00 179.25 180.48 3hqk h VAL 237 N 0.08 0.19 -0.68 0.00 2.07 -0.98 -2.29 116.25 114.64 3hqk h VAL 237 Ca -0.38 -0.41 0.10 0.00 0.82 0.00 0.00 66.70 66.83 3hqk h VAL 237 Cb 2.06 0.27 -0.10 0.00 -1.52 0.00 0.00 31.29 31.99 3hqk h VAL 237 CO 0.12 0.03 -0.30 0.00 0.02 0.00 0.00 177.57 177.45 3hqk n TYR 239 N -4.97 0.00 -0.16 0.00 0.53 -1.18 -1.44 117.16 109.93 3hqk n TYR 239 Ca 0.06 0.00 -0.02 0.00 -1.02 0.00 0.00 57.90 56.92 3hqk n TYR 239 Cb 0.25 -0.49 0.07 0.00 -1.03 0.00 0.00 39.34 38.14 3hqk n TYR 239 CO 0.00 0.00 0.00 0.28 -1.02 0.00 0.00 176.86 176.12 3hqk h VAL 240 N 0.00 0.72 -0.13 -0.72 2.07 -0.63 0.22 116.25 117.79 3hqk h VAL 240 Ca 0.00 -0.09 -0.02 0.00 0.82 0.00 0.00 66.70 67.42 3hqk h VAL 240 Cb 0.00 0.45 -0.00 0.00 -1.52 0.00 0.00 31.29 30.21 3hqk h VAL 240 CO 0.00 0.05 0.01 -0.07 0.02 0.00 0.00 177.57 177.58 3hqk h LEU 241 N 0.25 0.21 0.89 2.57 3.38 -1.09 -2.54 115.31 118.98 3hqk h LEU 241 Ca 0.26 -0.28 -0.04 0.00 0.09 0.00 0.00 57.88 57.90 3hqk h LEU 241 Cb 0.34 -0.06 0.01 0.00 0.09 0.00 0.00 40.66 41.04 3hqk h LEU 241 CO -0.33 0.44 -0.46 -1.28 0.09 0.00 0.00 178.44 176.90 3hqk h SER 242 N -0.03 -1.12 0.00 -0.43 0.87 -0.20 -1.10 113.55 111.54 3hqk h SER 242 Ca 0.04 0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.64 3hqk h SER 242 Cb 0.33 0.30 0.00 0.00 -0.44 0.00 0.00 62.40 62.59 3hqk h SER 242 CO 0.00 -0.76 0.00 0.35 -0.53 0.00 0.00 176.83 175.89 3hqk n THR 243 N -5.63 0.00 -0.10 2.23 -2.24 0.68 -1.79 114.28 107.43 3hqk n THR 243 Ca -0.16 0.00 -0.20 0.00 -2.27 0.00 0.00 64.05 61.42 3hqk n THR 243 Cb 0.50 -0.38 -0.12 0.00 -2.10 0.00 0.00 70.33 68.23 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 -0.81 1.56 0.77 4.28 -2.24 -0.96 -4.37 114.28 112.51 3hqk n THR 244 Ca 0.13 -0.56 0.00 0.00 -2.27 0.00 0.00 64.05 61.35 3hqk n THR 244 Cb 0.06 -1.55 0.00 0.00 -2.10 0.00 0.00 70.33 66.74 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 -3.30 2.19 -0.04 6.98 0.00 -0.42 -3.47 120.51 122.45 3hqk n ALA 245 Ca -0.43 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 52.92 3hqk n ALA 245 Cb 0.98 -1.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.41 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 0.26 0.47 -0.29 0.00 -6.64 -1.10 -4.22 119.36 107.83 3hqk n ILE 246 Ca 0.00 -0.10 -0.05 0.00 -1.77 0.00 0.00 62.75 60.82 3hqk n ILE 246 Cb 0.25 -1.62 0.07 0.00 -1.44 0.00 0.00 39.64 36.90 3hqk n ILE 246 CO 0.00 0.00 0.00 -0.03 -1.77 0.00 0.00 176.55 174.75 3hqk h MET 247 N -0.29 1.16 -5.15 6.28 4.05 -1.80 -2.46 114.93 116.72 3hqk h MET 247 Ca -0.20 -0.18 -0.64 0.00 -0.28 0.00 0.00 59.70 58.39 3hqk h MET 247 Cb 1.16 -0.20 -0.33 0.00 -0.80 0.00 0.00 31.60 31.43 3hqk h MET 247 CO -0.12 0.91 -0.86 0.20 0.23 0.00 0.00 176.91 177.27 3hqk s GLY 248 N -3.27 1.20 -0.07 1.39 0.00 -1.23 -2.48 107.32 102.86 3hqk s GLY 248 Ca -0.13 -0.83 0.13 0.00 0.00 0.00 0.00 44.72 43.89 3hqk s GLY 248 CO 0.83 -0.22 1.31 -0.13 0.00 0.00 0.00 173.10 174.88 3hqk n MET 249 N 3.58 2.89 -0.02 2.90 1.56 -1.26 -3.89 117.12 122.88 3hqk n MET 249 Ca -0.20 -2.34 -0.22 0.00 -0.27 0.00 0.00 57.70 54.68 3hqk n MET 249 Cb 0.53 -1.48 -0.13 0.00 2.15 0.00 0.00 33.22 34.29 3hqk n MET 249 CO 0.00 0.00 0.00 0.82 -0.73 0.00 0.00 175.97 176.06 3hqk h ILE 250 N 1.88 0.84 -0.47 1.12 2.04 -1.70 -3.41 117.51 117.80 3hqk h ILE 250 Ca 0.00 -2.32 0.00 0.00 1.00 0.00 0.00 64.86 63.54 3hqk h ILE 250 Cb 0.99 2.50 0.00 0.00 -0.74 0.00 0.00 36.82 39.57 3hqk h ILE 250 CO 0.08 0.68 0.00 -2.65 0.00 0.00 0.00 178.15 176.26 3hqk n PRO 251 N -3.88 2.57 -1.28 2.37 -0.02 -0.93 -4.47 135.00 129.36 3hqk n PRO 251 Ca -0.30 -2.38 -0.37 0.00 -2.02 0.00 0.00 63.50 58.44 3hqk n PRO 251 Cb 0.90 -1.53 0.06 0.00 -0.02 0.00 0.00 33.50 32.91 3hqk n PRO 251 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 3hqk n ASN 252 N 1.54 -1.43 -2.32 2.55 6.94 -1.03 -3.13 115.26 118.38 3hqk n ASN 252 Ca 0.21 0.60 0.00 0.00 -0.02 0.00 0.00 54.58 55.37 3hqk n ASN 252 Cb 0.61 -1.18 0.00 0.00 -2.36 0.00 0.00 39.78 36.85 3hqk n ASN 252 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3hqk n ALA 253 N -2.27 0.00 -0.13 -2.53 0.00 -1.26 -4.74 120.51 109.58 3hqk n ALA 253 Ca 0.10 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.50 3hqk n ALA 253 Cb 0.50 0.00 0.04 0.00 0.00 0.00 0.00 19.45 19.98 3hqk n ALA 253 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hqk h ALA 254 N -1.98 0.39 0.00 0.00 0.00 -1.92 -2.16 119.26 113.60 3hqk h ALA 254 Ca 0.00 0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.03 3hqk h ALA 254 Cb 0.00 0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.00 3hqk h ALA 254 CO 0.00 -0.39 0.00 -0.07 0.00 0.00 0.00 179.25 178.79 3hqk h LEU 255 N 0.11 0.00 0.27 0.00 3.38 -1.90 -1.27 115.31 115.90 3hqk h LEU 255 Ca 0.21 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.17 3hqk h LEU 255 Cb 0.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.05 3hqk h LEU 255 CO -0.35 0.00 -0.13 0.03 0.09 0.00 0.00 178.44 178.08 3hqk h ARG 256 N 0.00 -0.35 -0.87 1.13 2.47 -1.56 -2.96 114.38 112.25 3hqk h ARG 256 Ca 0.00 0.02 -0.03 0.00 -1.26 0.00 0.00 59.98 58.72 3hqk h ARG 256 Cb 0.22 0.08 -0.04 0.00 -1.65 0.00 0.00 29.97 28.57 3hqk h ARG 256 CO 0.00 -0.23 0.44 -0.39 0.56 0.00 0.00 179.97 180.34 3hqk h VAL 257 N -0.66 1.26 -0.77 2.04 -1.51 -1.44 -2.72 116.25 112.44 3hqk h VAL 257 Ca -0.04 -0.70 -0.01 0.00 -1.23 0.00 0.00 66.70 64.72 3hqk h VAL 257 Cb 0.28 0.13 -0.04 0.00 -2.13 0.00 0.00 31.29 29.53 3hqk h VAL 257 CO 0.06 0.31 0.46 -1.28 -1.23 0.00 0.00 177.57 175.89 3hqk h SER 258 N 1.23 0.94 -0.67 4.19 0.87 -1.39 -2.84 113.55 115.87 3hqk h SER 258 Ca 0.30 -0.07 -0.06 0.00 -1.23 0.00 0.00 61.79 60.73 3hqk h SER 258 Cb 0.09 -0.24 -0.03 0.00 -0.44 0.00 0.00 62.40 61.78 3hqk h SER 258 CO -0.04 0.73 0.19 0.00 -0.53 0.00 0.00 176.83 177.19 3hqk h ALA 259 N 1.24 1.04 -2.21 6.23 0.00 -1.32 -3.46 119.26 120.78 3hqk h ALA 259 Ca 0.28 -0.23 -0.36 0.00 0.00 0.00 0.00 54.91 54.59 3hqk h ALA 259 Cb -0.02 -0.27 -0.14 0.00 0.00 0.00 0.00 17.79 17.35 3hqk h ALA 259 CO -0.05 0.64 -0.70 -1.54 0.00 0.00 0.00 179.25 177.60 3hqk s SER 260 N -6.47 1.97 0.58 0.00 1.04 -1.05 -5.11 113.70 104.66 3hqk s SER 260 Ca -0.12 -1.06 -0.20 0.00 0.48 0.00 0.00 55.95 55.05 3hqk s SER 260 Cb 0.15 -0.03 -0.04 0.00 0.10 0.00 0.00 66.02 66.20 3hqk s SER 260 CO 0.84 -0.34 1.26 -2.84 0.98 0.00 0.00 173.24 173.13 3hqk s PRO 261 N -3.75 3.02 0.38 4.02 0.02 -1.26 -4.62 135.00 132.80 3hqk s PRO 261 Ca 0.21 1.97 0.08 0.00 0.02 0.00 0.00 61.00 63.28 3hqk s PRO 261 Cb 0.03 -2.05 -0.02 0.00 0.02 0.00 0.00 34.50 32.47 3hqk s PRO 261 CO 0.04 -1.20 0.32 0.12 -0.33 0.00 0.00 177.00 175.95 3hqk s PHE 262 N -1.47 2.80 0.00 6.54 5.36 -1.26 -4.72 117.98 125.22 3hqk s PHE 262 Ca 0.75 -0.40 0.00 0.00 -0.96 0.00 0.00 56.93 56.32 3hqk s PHE 262 Cb -0.34 -1.97 0.00 0.00 -0.34 0.00 0.00 43.02 40.37 3hqk s PHE 262 CO 0.38 0.05 0.00 0.41 -1.46 0.00 0.00 175.22 174.60 3hqk n GLY 263 N -1.44 2.67 0.13 13.12 0.00 -1.26 -4.78 105.19 113.63 3hqk n GLY 263 Ca 0.01 -0.50 0.04 0.00 0.00 0.00 0.00 46.02 45.57 3hqk n GLY 263 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 3hqk h ASP 264 N 0.00 0.00 0.00 1.61 3.58 -1.96 -3.01 116.42 116.64 3hqk h ASP 264 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 3hqk h ASP 264 Cb 0.00 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.05 3hqk h ASP 264 CO 0.00 0.41 0.00 0.00 -2.88 0.00 0.00 179.24 176.77 3hqk n ALA 265 N -2.27 1.90 -0.57 -0.78 0.00 -1.26 -2.23 120.51 115.30 3hqk n ALA 265 Ca -0.02 -0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.48 3hqk n ALA 265 Cb 0.73 -1.01 0.34 0.00 0.00 0.00 0.00 19.45 19.51 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 -0.53 3.58 -0.56 0.00 0.00 -1.14 -4.02 120.51 117.84 3hqk n ALA 266 Ca 0.01 -1.59 0.00 0.00 0.00 0.00 0.00 53.44 51.86 3hqk n ALA 266 Cb 0.00 -1.10 0.00 0.00 0.00 0.00 0.00 19.45 18.36 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 0.61 0.84 -0.12 0.00 1.74 -0.95 -4.32 116.66 114.46 3hqk n ARG 267 Ca 0.24 -0.74 0.08 0.00 -0.77 0.00 0.00 57.85 56.65 3hqk n ARG 267 Cb 1.02 -0.72 0.14 0.00 -1.02 0.00 0.00 32.46 31.87 3hqk n ARG 267 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3hqk n MET 268 N -0.16 1.96 -3.25 5.56 0.00 -1.26 -3.53 117.12 116.45 3hqk n MET 268 Ca 0.00 -1.84 -0.25 0.00 0.00 0.00 0.00 57.70 55.61 3hqk n MET 268 Cb 0.32 -1.34 -0.07 0.00 0.00 0.00 0.00 33.22 32.13 3hqk n MET 268 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 3hqk n ALA 269 N 0.92 2.89 -0.87 3.17 0.00 -1.26 -4.79 120.51 120.56 3hqk n ALA 269 Ca 0.13 -3.79 0.00 0.00 0.00 0.00 0.00 53.44 49.78 3hqk n ALA 269 Cb 0.45 -0.84 0.00 0.00 0.00 0.00 0.00 19.45 19.06 3hqk n ALA 269 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3hqk n LEU 270 N 1.21 0.00 -4.78 0.00 4.77 -1.26 -4.69 117.00 112.25 3hqk n LEU 270 Ca 0.24 0.00 -0.34 0.00 -0.03 0.00 0.00 56.01 55.87 3hqk n LEU 270 Cb 0.50 -0.07 -0.00 0.00 -2.33 0.00 0.00 43.42 41.51 3hqk n LEU 270 CO 0.24 0.00 0.76 -0.83 -1.33 0.00 0.00 177.39 176.23 3hqk s GLY 271 N -1.89 2.52 0.50 -0.72 0.00 -1.23 -4.99 107.32 101.51 3hqk s GLY 271 Ca 0.00 0.72 -0.23 0.00 0.00 0.00 0.00 44.72 45.21 3hqk s GLY 271 CO 0.00 1.07 1.32 0.51 0.00 0.00 0.00 173.10 176.00 3hqk s ASP 272 N -1.97 5.64 0.36 1.64 -4.77 -1.26 -4.63 116.67 111.69 3hqk s ASP 272 Ca 0.70 2.69 -0.28 0.00 -3.30 0.00 0.00 52.55 52.36 3hqk s ASP 272 Cb -0.21 -2.63 -0.10 0.00 -1.09 0.00 0.00 42.92 38.88 3hqk s ASP 272 CO 0.28 -1.31 1.38 -0.89 0.70 0.00 0.00 175.17 175.32 3hqk s THR 273 N -1.33 2.43 0.06 2.11 2.01 -1.26 -4.70 115.64 114.96 3hqk s THR 273 Ca 0.67 0.43 0.03 0.00 0.31 0.00 0.00 61.69 63.13 3hqk s THR 273 Cb -0.38 -3.27 -0.03 0.00 0.01 0.00 0.00 72.50 68.83 3hqk s THR 273 CO 0.47 0.10 -0.10 0.00 -0.69 0.00 0.00 174.62 174.39 3hqk s ALA 274 N -1.15 0.83 -1.16 7.40 0.00 -1.26 -4.88 121.76 121.54 3hqk s ALA 274 Ca 0.51 -0.88 -0.02 0.00 0.00 0.00 0.00 51.96 51.57 3hqk s ALA 274 Cb -0.42 -0.01 -0.02 0.00 0.00 0.00 0.00 23.12 22.67 3hqk s ALA 274 CO 0.57 0.05 0.94 0.41 0.00 0.00 0.00 175.76 177.72 3hqk n GLY 275 N 1.33 -0.61 2.25 0.00 0.00 -1.26 -5.07 105.19 101.83 3hqk n GLY 275 Ca -0.22 0.26 -0.13 0.00 0.00 0.00 0.00 46.02 45.93 3hqk n GLY 275 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hqk n ALA 276 N -3.88 4.92 -0.16 4.61 0.00 -1.26 -4.20 120.51 120.55 3hqk n ALA 276 Ca -0.22 -1.56 -0.04 0.00 0.00 0.00 0.00 53.44 51.62 3hqk n ALA 276 Cb 0.65 -2.51 0.16 0.00 0.00 0.00 0.00 19.45 17.75 3hqk n ALA 276 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.50 178.47 3hqk h ILE 277 N 2.57 1.24 -0.51 0.00 2.10 -1.97 0.12 117.51 121.05 3hqk h ILE 277 Ca 0.25 -0.85 -0.06 0.00 1.08 0.00 0.00 64.86 65.28 3hqk h ILE 277 Cb 0.83 0.63 -0.02 0.00 -1.09 0.00 0.00 36.82 37.17 3hqk h ILE 277 CO 0.63 0.32 0.09 0.58 -1.08 0.00 0.00 178.15 178.69 3hqk h VAL 278 N 0.87 1.23 -0.52 2.19 2.07 -2.01 -2.33 116.25 117.76 3hqk h VAL 278 Ca 0.19 -0.86 -0.00 0.00 0.82 0.00 0.00 66.70 66.84 3hqk h VAL 278 Cb 0.31 0.75 -0.03 0.00 -1.52 0.00 0.00 31.29 30.80 3hqk h VAL 278 CO -0.00 0.31 0.30 -1.28 0.02 0.00 0.00 177.57 176.93 3hqk h SER 279 N 0.76 0.61 -0.80 0.57 0.87 -1.12 -3.10 113.55 111.34 3hqk h SER 279 Ca 0.16 -0.03 0.02 0.00 -1.23 0.00 0.00 61.79 60.71 3hqk h SER 279 Cb 0.34 -0.15 -0.05 0.00 -0.44 0.00 0.00 62.40 62.10 3hqk h SER 279 CO 0.00 0.48 0.52 -0.26 -0.53 0.00 0.00 176.83 177.04 3hqk h PHE 280 N 0.71 0.98 0.00 2.24 0.04 -0.74 -2.63 116.94 117.54 3hqk h PHE 280 Ca 0.19 0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.98 3hqk h PHE 280 Cb -0.02 -0.33 0.00 0.00 2.20 0.00 0.00 35.95 37.81 3hqk h PHE 280 CO 0.00 0.58 0.27 0.00 -0.60 0.00 0.00 178.31 178.56 3hqk n ALA 282 N -1.84 2.62 0.21 0.00 0.00 -0.99 -1.50 120.51 119.01 3hqk n ALA 282 Ca -0.02 -0.32 0.11 0.00 0.00 0.00 0.00 53.44 53.21 3hqk n ALA 282 Cb 0.31 -1.32 -0.01 0.00 0.00 0.00 0.00 19.45 18.43 3hqk n ALA 282 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hqk n ALA 283 N -0.39 2.76 0.02 0.00 0.00 0.45 -4.36 120.51 119.00 3hqk n ALA 283 Ca 0.21 -0.31 -0.02 0.00 0.00 0.00 0.00 53.44 53.31 3hqk n ALA 283 Cb 0.23 -1.03 -0.01 0.00 0.00 0.00 0.00 19.45 18.64 3hqk n ALA 283 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hqk h ALA 284 N 2.14 -0.16 0.00 0.00 0.00 -1.19 -2.96 119.26 117.09 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 0.93 0.06 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 1.39 0.37 0.00 0.00 0.00 -0.91 0.10 105.19 106.15 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 0.19 -1.02 0.00 3.38 0.84 -3.34 115.31 115.35 3hqk h LEU 287 Ca 0.00 -0.22 -0.02 0.00 0.09 0.00 0.00 57.88 57.72 3hqk h LEU 287 Cb 0.65 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 41.30 3hqk h LEU 287 CO 0.00 1.18 0.40 1.23 0.09 0.00 0.00 178.44 181.34 3hqk h GLY 288 N 2.44 1.16 2.00 0.83 0.00 -0.66 -2.56 103.07 106.28 3hqk h GLY 288 Ca -0.12 -0.54 -0.01 0.00 0.00 0.00 0.00 47.33 46.66 3hqk h GLY 288 CO 0.15 0.52 -0.06 1.48 0.00 0.00 0.00 176.54 178.63 3hqk h SER 289 N 1.09 0.00 -0.95 0.19 4.64 -1.81 -3.17 113.55 113.54 3hqk h SER 289 Ca 0.27 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 61.60 3hqk h SER 289 Cb 0.07 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.11 3hqk h SER 289 CO -0.04 0.06 0.63 -0.07 -0.87 0.00 0.00 176.83 176.53 3hqk h LEU 290 N 0.00 1.08 -0.02 5.97 3.38 -1.61 0.15 115.31 124.26 3hqk h LEU 290 Ca -0.00 -0.03 -0.18 0.00 0.09 0.00 0.00 57.88 57.76 3hqk h LEU 290 Cb 0.26 -0.27 0.01 0.00 0.09 0.00 0.00 40.66 40.75 3hqk h LEU 290 CO 0.01 0.78 -0.70 1.23 0.09 0.00 0.00 178.44 179.85 3hqk h GLY 291 N 1.28 0.57 -0.21 0.83 0.00 -1.72 -2.45 103.07 101.37 3hqk h GLY 291 Ca 0.35 -0.96 0.13 0.00 0.00 0.00 0.00 47.33 46.85 3hqk h GLY 291 CO -0.08 0.85 -0.08 -1.33 0.00 0.00 0.00 176.54 175.91 3hqk h GLY 292 N 0.07 0.59 1.79 4.60 0.00 -1.53 0.78 103.07 109.37 3hqk h GLY 292 Ca -0.08 0.15 -0.17 0.00 0.00 0.00 0.00 47.33 47.23 3hqk h GLY 292 CO 0.14 -0.23 -0.72 1.49 0.00 0.00 0.00 176.54 177.22 3hqk h TRP 293 N 0.06 0.28 -0.04 5.60 4.06 -0.62 -2.68 115.95 122.61 3hqk h TRP 293 Ca 0.33 -0.12 -0.18 0.00 2.06 0.00 0.00 58.89 60.97 3hqk h TRP 293 Cb 0.53 -0.04 -0.01 0.00 -1.00 0.00 0.00 29.16 28.64 3hqk h TRP 293 CO -0.45 0.85 -0.76 1.79 -3.56 0.00 0.00 178.44 176.31 3hqk h THR 294 N 0.14 1.43 -0.25 1.49 1.35 -1.06 -1.17 112.91 114.83 3hqk h THR 294 Ca -0.02 -2.31 0.05 0.00 -0.55 0.00 0.00 66.41 63.58 3hqk h THR 294 Cb 1.27 2.24 -0.08 0.00 -1.73 0.00 0.00 68.15 69.86 3hqk h THR 294 CO 0.11 0.68 -0.46 0.25 -0.25 0.00 0.00 175.52 175.85 3hqk h LEU 295 N 0.17 -1.47 -1.20 3.87 5.85 -0.60 0.25 115.31 122.17 3hqk h LEU 295 Ca -0.03 0.20 -0.03 0.00 0.84 0.00 0.00 57.88 58.86 3hqk h LEU 295 Cb 1.34 0.61 -0.03 0.00 0.37 0.00 0.00 40.66 42.95 3hqk h LEU 295 CO 0.12 -0.42 0.24 -0.07 -0.34 0.00 0.00 178.44 177.98 3hqk h LEU 296 N -0.44 0.72 -0.76 2.25 3.38 -1.31 0.33 115.31 119.48 3hqk h LEU 296 Ca 0.09 -0.08 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 3hqk h LEU 296 Cb 0.62 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 41.15 3hqk h LEU 296 CO -0.48 0.64 0.41 0.00 0.09 0.00 0.00 178.44 179.09 3hqk h ALA 297 N 1.48 0.97 -0.14 1.53 0.00 0.11 -1.88 119.26 121.33 3hqk h ALA 297 Ca 0.19 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 3hqk h ALA 297 Cb 0.13 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 3hqk h ALA 297 CO -0.02 0.49 -0.08 0.78 0.00 0.00 0.00 179.25 180.41 3hqk h GLY 298 N 1.05 0.32 0.95 0.00 0.00 0.78 -3.09 103.07 103.08 3hqk h GLY 298 Ca 0.26 -0.30 -0.01 0.00 0.00 0.00 0.00 47.33 47.28 3hqk h GLY 298 CO -0.04 0.27 0.19 1.46 0.00 0.00 0.00 176.54 178.42 3hqk h GLN 299 N -0.06 0.53 -0.47 4.80 1.08 -0.85 0.24 115.11 120.39 3hqk h GLN 299 Ca 0.03 -0.07 -0.04 0.00 -1.45 0.00 0.00 58.65 57.12 3hqk h GLN 299 Cb 0.57 -0.10 -0.02 0.00 -0.05 0.00 0.00 27.48 27.88 3hqk h GLN 299 CO 0.02 0.46 0.14 0.00 -0.95 0.00 0.00 178.83 178.50 3hqk h THR 300 N 0.46 1.23 -0.59 -0.54 1.03 -1.44 -0.33 112.91 112.73 3hqk h THR 300 Ca 0.13 -0.76 -0.03 0.00 -0.01 0.00 0.00 66.41 65.74 3hqk h THR 300 Cb 0.10 0.84 -0.03 0.00 -1.07 0.00 0.00 68.15 67.99 3hqk h THR 300 CO -0.02 0.28 0.27 0.00 -0.01 0.00 0.00 175.52 176.04 3hqk h ALA 301 N 1.00 0.76 -0.71 0.00 0.00 -1.47 -0.73 119.26 118.12 3hqk h ALA 301 Ca 0.15 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 3hqk h ALA 301 Cb 0.28 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 3hqk h ALA 301 CO -0.00 0.34 0.31 -0.22 0.00 0.00 0.00 179.25 179.68 3hqk h LYS 302 N 0.81 1.04 -0.62 0.00 3.64 -0.64 0.14 116.57 120.93 3hqk h LYS 302 Ca 0.20 -0.17 -0.03 0.00 -1.27 0.00 0.00 60.65 59.38 3hqk h LYS 302 Cb 0.15 -0.18 -0.03 0.00 -0.41 0.00 0.00 32.23 31.76 3hqk h LYS 302 CO -0.02 0.84 0.27 0.00 -2.27 0.00 0.00 179.45 178.26 3hqk h ALA 303 N 1.15 0.81 -0.76 5.00 0.00 -0.63 -0.27 119.26 124.56 3hqk h ALA 303 Ca 0.24 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 3hqk h ALA 303 Cb 0.16 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 3hqk h ALA 303 CO -0.03 0.40 0.26 0.00 0.00 0.00 0.00 179.25 179.89 3hqk h ALA 304 N 1.11 0.99 -0.72 0.00 0.00 -0.68 -2.43 119.26 117.54 3hqk h ALA 304 Ca 0.21 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 3hqk h ALA 304 Cb 0.17 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 3hqk h ALA 304 CO -0.02 0.66 0.27 0.00 0.00 0.00 0.00 179.25 180.16 3hqk h ALA 305 N 1.14 1.13 -0.83 0.00 0.00 0.23 -2.24 119.26 118.69 3hqk h ALA 305 Ca 0.25 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 3hqk h ALA 305 Cb 0.27 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 17.74 3hqk h ALA 305 CO -0.01 0.62 0.50 -0.44 0.00 0.00 0.00 179.25 179.91 3hqk h ASP 306 N 1.04 1.00 -4.21 0.00 3.32 -0.59 -3.42 116.42 113.56 3hqk h ASP 306 Ca 0.24 -0.07 -0.30 0.00 0.02 0.00 0.00 57.03 56.92 3hqk h ASP 306 Cb 0.22 -0.25 0.08 0.00 0.22 0.00 0.00 39.33 39.59 3hqk h ASP 306 CO -0.02 0.77 0.15 0.47 -1.72 0.00 0.00 179.24 178.89 3hqk n ASP 307 N -4.44 0.60 0.21 6.45 8.00 -0.91 -4.87 116.55 121.58 3hqk n ASP 307 Ca 0.08 -1.60 0.06 0.00 0.71 0.00 0.00 54.79 54.05 3hqk n ASP 307 Cb 0.06 -0.52 0.33 0.00 -0.02 0.00 0.00 41.12 40.98 3hqk n ASP 307 CO 0.00 0.00 0.00 1.23 -0.39 0.00 0.00 177.20 178.04 3hqk h GLY 308 N -0.67 0.00 -5.38 0.44 0.00 -1.82 -3.43 103.07 92.21 3hqk h GLY 308 Ca -0.24 0.00 -0.67 0.00 0.00 0.00 0.00 47.33 46.42 3hqk h GLY 308 CO 0.22 0.00 -0.55 1.08 0.00 0.00 0.00 176.54 177.29 3hqk s LEU 309 N -4.34 4.00 0.00 3.11 1.43 -0.89 -5.01 118.68 116.98 3hqk s LEU 309 Ca -0.01 0.29 0.00 0.00 -1.03 0.00 0.00 54.13 53.38 3hqk s LEU 309 Cb 0.04 -2.03 0.00 0.00 0.03 0.00 0.00 46.19 44.22 3hqk s LEU 309 CO 0.11 0.37 0.00 0.33 0.23 0.00 0.00 176.35 177.39 3hqk n PHE 310 N 1.86 0.00 -1.90 0.29 -0.00 -1.25 0.68 117.46 117.13 3hqk n PHE 310 Ca -0.18 0.00 -0.41 0.00 -0.00 0.00 0.00 57.45 56.86 3hqk n PHE 310 Cb 0.54 -0.03 -0.01 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 -3.14 4.19 0.28 -7.13 0.02 -1.26 -4.55 135.00 123.41 3hqk s PRO 311 Ca 0.00 2.45 -0.02 0.00 0.02 0.00 0.00 61.00 63.44 3hqk s PRO 311 Cb 0.00 -3.03 0.38 0.00 0.02 0.00 0.00 34.50 31.88 3hqk s PRO 311 CO 0.00 -0.46 1.87 -1.35 -0.33 0.00 0.00 177.00 176.73 3hqk h PRO 312 N 3.79 0.97 -1.04 5.54 0.11 -1.91 -2.40 132.00 137.05 3hqk h PRO 312 Ca -0.49 -0.14 0.30 0.00 0.11 0.00 0.00 66.00 65.78 3hqk h PRO 312 Cb 1.23 -0.18 -0.04 0.00 0.11 0.00 0.00 31.00 32.12 3hqk h PRO 312 CO 0.70 0.77 1.19 -0.89 -0.21 0.00 0.00 178.00 179.56 3hqk n ILE 313 N -4.32 0.00 1.78 4.15 -0.00 -1.26 0.27 119.36 119.98 3hqk n ILE 313 Ca 0.06 1.22 0.08 0.00 -0.00 0.00 0.00 62.75 64.12 3hqk n ILE 313 Cb 0.15 -2.19 0.43 0.00 -0.00 0.00 0.00 39.64 38.03 3hqk n ILE 313 CO 0.00 0.00 0.00 0.49 -0.00 0.00 0.00 176.55 177.04 3hqk n PHE 314 N -3.20 0.07 -3.76 1.39 3.72 -0.90 -4.36 117.46 110.41 3hqk n PHE 314 Ca 0.24 -0.03 -0.30 0.00 -0.05 0.00 0.00 57.45 57.30 3hqk n PHE 314 Cb 1.51 0.00 -0.14 0.00 -0.94 0.00 0.00 39.48 39.91 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 -1.93 1.98 0.19 4.37 0.00 0.77 -3.70 121.76 123.44 3hqk s ALA 315 Ca 0.25 -2.21 -0.07 0.00 0.00 0.00 0.00 51.96 49.94 3hqk s ALA 315 Cb 0.12 -1.79 -0.02 0.00 0.00 0.00 0.00 23.12 21.44 3hqk s ALA 315 CO 0.20 -1.86 0.27 1.03 0.00 0.00 0.00 175.76 175.40 3hqk s ARG 316 N 0.94 1.25 0.07 0.00 0.52 -1.26 -5.02 118.95 115.44 3hqk s ARG 316 Ca 0.14 -1.34 0.06 0.00 -0.52 0.00 0.00 55.73 54.07 3hqk s ARG 316 Cb -0.21 0.36 -0.23 0.00 0.52 0.00 0.00 34.95 35.39 3hqk s ARG 316 CO -0.11 -0.46 1.09 0.28 0.02 0.00 0.00 175.30 176.12 3hqk h VAL 317 N 2.52 1.45 -2.60 3.52 2.07 -1.92 -3.41 116.25 117.87 3hqk h VAL 317 Ca -0.32 -3.18 -0.55 0.00 0.82 0.00 0.00 66.70 63.47 3hqk h VAL 317 Cb 1.24 2.75 0.21 0.00 -1.52 0.00 0.00 31.29 33.97 3hqk h VAL 317 CO 0.47 0.85 -1.14 0.59 0.02 0.00 0.00 177.57 178.35 3hqk n ASN 318 N -3.31 -3.73 0.25 0.57 3.02 -1.26 -4.81 115.26 105.99 3hqk n ASN 318 Ca -0.06 0.37 0.09 0.00 -0.03 0.00 0.00 54.58 54.95 3hqk n ASN 318 Cb 0.98 -0.98 0.63 0.00 -0.61 0.00 0.00 39.78 39.80 3hqk n ASN 318 CO 0.00 0.00 0.00 0.11 -2.62 0.00 0.00 177.26 174.75 3hqk h LYS 319 N -0.87 0.00 -5.20 3.52 1.57 -2.04 -3.40 116.57 110.15 3hqk h LYS 319 Ca -0.44 0.00 -0.64 0.00 -1.87 0.00 0.00 60.65 57.70 3hqk h LYS 319 Cb 1.33 0.00 -0.23 0.00 0.08 0.00 0.00 32.23 33.41 3hqk h LYS 319 CO 0.33 0.12 -0.67 0.00 -0.57 0.00 0.00 179.45 178.66 3hqk s ALA 320 N -4.60 3.00 0.00 3.86 0.00 -1.26 -5.11 121.76 117.65 3hqk s ALA 320 Ca -0.04 -0.92 0.00 0.00 0.00 0.00 0.00 51.96 51.00 3hqk s ALA 320 Cb 0.15 -1.67 0.00 0.00 0.00 0.00 0.00 23.12 21.60 3hqk s ALA 320 CO 0.65 0.00 0.00 0.41 0.00 0.00 0.00 175.76 176.82 3hqk n GLY 321 N 3.95 0.00 3.57 0.00 0.00 -1.26 -4.91 105.19 106.54 3hqk n GLY 321 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.85 3hqk n GLY 321 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hqk n GLY 326 N 0.00 1.48 0.32 -0.02 0.00 -1.26 -4.80 105.19 100.91 3hqk n GLY 326 Ca 0.00 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.16 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 0.00 0.00 -0.13 0.99 6.46 -1.93 0.11 115.31 120.81 3hqk h LEU 327 Ca 0.00 0.00 -0.24 0.00 -0.12 0.00 0.00 57.88 57.52 3hqk h LEU 327 Cb 0.00 0.00 0.01 0.00 -0.73 0.00 0.00 40.66 39.94 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 0.63 -1.22 2.25 3.38 -1.91 -3.20 115.31 115.24 3hqk h LEU 328 Ca 0.00 -0.50 0.00 0.00 0.09 0.00 0.00 57.88 57.47 3hqk h LEU 328 Cb 0.68 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 41.20 3hqk h LEU 328 CO 0.00 1.30 0.48 0.40 0.09 0.00 0.00 178.44 180.71 3hqk h ILE 329 N 0.27 1.20 -0.61 1.22 2.04 -1.21 0.19 117.51 120.61 3hqk h ILE 329 Ca -0.09 -0.40 -0.02 0.00 1.00 0.00 0.00 64.86 65.34 3hqk h ILE 329 Cb 1.61 0.11 -0.03 0.00 -0.74 0.00 0.00 36.82 37.77 3hqk h ILE 329 CO 0.17 0.20 0.30 0.58 0.00 0.00 0.00 178.15 179.41 3hqk h VAL 330 N 1.03 1.21 -0.66 1.67 2.07 -1.58 -0.22 116.25 119.77 3hqk h VAL 330 Ca 0.27 -0.57 -0.03 0.00 0.82 0.00 0.00 66.70 67.20 3hqk h VAL 330 Cb -0.08 0.47 -0.03 0.00 -1.52 0.00 0.00 31.29 30.12 3hqk h VAL 330 CO -0.06 0.24 0.31 1.23 0.02 0.00 0.00 177.57 179.31 3hqk h GLY 331 N 0.83 1.02 1.03 2.17 0.00 -0.93 -0.29 103.07 106.90 3hqk h GLY 331 Ca 0.21 -0.51 -0.05 0.00 0.00 0.00 0.00 47.33 46.98 3hqk h GLY 331 CO -0.03 0.49 0.25 -2.08 0.00 0.00 0.00 176.54 175.17 3hqk h VAL 332 N 0.91 1.25 -0.74 4.60 2.07 -0.31 -0.59 116.25 123.44 3hqk h VAL 332 Ca 0.23 -0.82 -0.05 0.00 0.82 0.00 0.00 66.70 66.88 3hqk h VAL 332 Cb 0.13 0.48 -0.03 0.00 -1.52 0.00 0.00 31.29 30.34 3hqk h VAL 332 CO -0.03 0.32 0.29 -0.07 0.02 0.00 0.00 177.57 178.10 3hqk h LEU 333 N 1.00 1.03 -0.64 2.57 3.38 -0.65 -0.47 115.31 121.53 3hqk h LEU 333 Ca 0.23 -0.18 -0.04 0.00 0.09 0.00 0.00 57.88 57.98 3hqk h LEU 333 Cb 0.25 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 3hqk h LEU 333 CO -0.01 0.93 0.26 0.24 0.09 0.00 0.00 178.44 179.95 3hqk h MET 334 N 1.07 0.96 -0.62 1.13 2.86 -0.56 0.82 114.93 120.59 3hqk h MET 334 Ca 0.25 -0.17 -0.05 0.00 -2.06 0.00 0.00 59.70 57.67 3hqk h MET 334 Cb 0.23 -0.16 -0.03 0.00 0.06 0.00 0.00 31.60 31.71 3hqk h MET 334 CO -0.02 0.81 0.20 1.79 1.06 0.00 0.00 176.91 180.75 3hqk h THR 335 N 0.91 1.24 -0.65 2.22 1.35 -0.66 1.18 112.91 118.50 3hqk h THR 335 Ca 0.22 -0.83 -0.05 0.00 -0.55 0.00 0.00 66.41 65.20 3hqk h THR 335 Cb 0.20 0.61 -0.03 0.00 -1.73 0.00 0.00 68.15 67.20 3hqk h THR 335 CO -0.02 0.32 0.22 0.40 -0.25 0.00 0.00 175.52 176.19 3hqk h ILE 336 N 0.89 1.25 0.11 6.82 2.04 -0.61 -2.14 117.51 125.87 3hqk h ILE 336 Ca 0.20 -0.82 -0.28 0.00 1.00 0.00 0.00 64.86 64.96 3hqk h ILE 336 Cb 0.28 0.55 -0.01 0.00 -0.74 0.00 0.00 36.82 36.91 3hqk h ILE 336 CO -0.01 0.32 -1.36 -0.26 0.00 0.00 0.00 178.15 176.84 3hqk h PHE 337 N 0.93 0.42 -0.01 1.37 0.05 -0.63 -3.07 116.94 116.00 3hqk h PHE 337 Ca 0.21 -0.30 0.00 0.00 3.82 0.00 0.00 57.97 61.70 3hqk h PHE 337 Cb 0.27 -0.02 -0.00 0.00 2.00 0.00 0.00 35.95 38.20 3hqk h PHE 337 CO 0.02 1.29 0.03 0.37 -0.18 0.00 0.00 178.31 179.84 3hqk h GLN 338 N 0.06 0.00 0.13 1.51 5.75 0.15 -2.90 115.11 119.81 3hqk h GLN 338 Ca -0.17 0.00 -0.36 0.00 -0.15 0.00 0.00 58.65 57.97 3hqk h GLN 338 Cb 1.98 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 30.51 3hqk h GLN 338 CO 0.18 0.00 -1.92 0.74 -2.65 0.00 0.00 178.83 175.18 3hqk h PHE 339 N 0.00 0.49 0.00 3.99 0.04 -1.37 -3.30 116.94 116.79 3hqk h PHE 339 Ca 0.01 -0.36 0.00 0.00 2.80 0.00 0.00 57.97 60.42 3hqk h PHE 339 Cb 0.06 -0.02 0.00 0.00 2.20 0.00 0.00 35.95 38.19 3hqk h PHE 339 CO 0.00 1.76 0.00 0.43 -0.60 0.00 0.00 178.31 179.90 3hqk n SER 340 N -3.56 0.35 -0.04 2.17 7.64 -1.13 -2.11 113.62 116.94 3hqk n SER 340 Ca -0.31 -1.68 -0.05 0.00 1.01 0.00 0.00 58.87 57.84 3hqk n SER 340 Cb 1.03 -0.18 -0.04 0.00 -1.01 0.00 0.00 64.21 64.01 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 -0.26 3.35 -0.12 6.43 3.41 -1.11 -4.35 113.62 120.97 3hqk n SER 341 Ca 0.00 -0.03 -0.21 0.00 -0.26 0.00 0.00 58.87 58.36 3hqk n SER 341 Cb 0.09 0.06 -0.10 0.00 -0.26 0.00 0.00 64.21 64.01 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 -2.62 0.54 0.49 4.33 2.81 -1.22 -4.85 117.12 116.61 3hqk n MET 342 Ca -0.14 0.18 -0.19 0.00 -1.81 0.00 0.00 57.70 55.74 3hqk n MET 342 Cb 0.67 -1.41 -0.09 0.00 -0.71 0.00 0.00 33.22 31.68 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 -0.46 -1.06 -2.13 7.83 0.02 -1.69 -3.44 113.55 112.62 3hqk h SER 343 Ca -0.57 0.04 -0.56 0.00 -0.84 0.00 0.00 61.79 59.86 3hqk h SER 343 Cb 1.66 0.28 -0.09 0.00 0.14 0.00 0.00 62.40 64.39 3hqk h SER 343 CO -0.24 -0.74 -0.62 -2.16 -1.14 0.00 0.00 176.83 171.93 3hqk s PRO 344 N -5.69 2.31 0.03 3.45 0.05 -1.26 -5.12 135.00 128.77 3hqk s PRO 344 Ca -0.18 -1.45 0.05 0.00 0.05 0.00 0.00 61.00 59.47 3hqk s PRO 344 Cb 0.02 -2.16 -0.02 0.00 0.05 0.00 0.00 34.50 32.39 3hqk s PRO 344 CO 0.55 0.30 -0.16 -0.80 0.05 0.00 0.00 177.00 176.95 3hqk s ASN 345 N -3.71 1.86 0.09 6.66 -0.87 -1.26 -4.56 114.94 113.14 3hqk s ASN 345 Ca 0.33 -0.42 0.10 0.00 -1.57 0.00 0.00 52.86 51.29 3hqk s ASN 345 Cb -0.05 -0.15 -0.04 0.00 -0.02 0.00 0.00 41.25 40.99 3hqk s ASN 345 CO 0.20 0.10 -0.25 0.00 -2.57 0.00 0.00 177.10 174.59 3hqk s ALA 346 N -0.71 2.40 0.00 0.60 0.00 -1.26 -5.00 121.76 117.79 3hqk s ALA 346 Ca 0.04 -1.37 0.00 0.00 0.00 0.00 0.00 51.96 50.63 3hqk s ALA 346 Cb -0.07 -0.48 0.00 0.00 0.00 0.00 0.00 23.12 22.57 3hqk s ALA 346 CO 0.01 0.55 0.00 0.00 0.00 0.00 0.00 175.76 176.32 3hqk n ALA 347 N 1.22 0.00 -0.04 0.00 0.00 -1.26 -4.62 120.51 115.81 3hqk n ALA 347 Ca -0.17 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.23 3hqk n ALA 347 Cb 0.53 -0.13 -0.14 0.00 0.00 0.00 0.00 19.45 19.71 3hqk n ALA 347 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3hqk n LYS 348 N -2.00 0.66 -0.03 0.00 4.01 -1.26 -4.11 118.16 115.43 3hqk n LYS 348 Ca 0.00 0.08 -0.10 0.00 -0.51 0.00 0.00 58.31 57.78 3hqk n LYS 348 Cb 0.00 -1.64 -0.03 0.00 -0.51 0.00 0.00 35.03 32.84 3hqk n LYS 348 CO 0.00 0.00 0.00 1.05 -1.11 0.00 0.00 177.40 177.34 3hqk h GLU 349 N 0.00 0.12 -0.84 1.97 4.11 -1.98 -1.57 114.58 116.40 3hqk h GLU 349 Ca -0.32 -0.01 0.00 0.00 0.07 0.00 0.00 59.36 59.10 3hqk h GLU 349 Cb 1.86 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 31.08 3hqk h GLU 349 CO 0.04 0.08 0.00 1.97 0.07 0.00 0.00 179.01 181.17 3hqk n PHE 350 N -5.06 0.00 0.00 2.06 -0.00 -1.26 -2.26 117.46 110.93 3hqk n PHE 350 Ca -0.03 -0.06 0.00 0.00 -0.00 0.00 0.00 57.45 57.35 3hqk n PHE 350 Cb 0.07 -0.10 0.00 0.00 -0.00 0.00 0.00 39.48 39.45 3hqk n PHE 350 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 3hqk n GLY 351 N 0.21 0.50 0.15 4.97 0.00 -0.64 -4.42 105.19 105.96 3hqk n GLY 351 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.82 3hqk n GLY 351 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3hqk h LEU 352 N 0.00 0.63 -0.79 0.99 5.85 -0.98 -3.12 115.31 117.89 3hqk h LEU 352 Ca 0.00 -0.82 0.16 0.00 0.84 0.00 0.00 57.88 58.05 3hqk h LEU 352 Cb 0.00 -0.20 -0.15 0.00 0.37 0.00 0.00 40.66 40.68 3hqk h LEU 352 CO 0.00 1.39 -0.22 0.58 -0.34 0.00 0.00 178.44 179.85 3hqk h VAL 353 N -0.04 0.19 -0.73 1.05 2.07 -1.79 0.57 116.25 117.56 3hqk h VAL 353 Ca -0.13 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.41 3hqk h VAL 353 Cb 1.58 0.19 -0.04 0.00 -1.52 0.00 0.00 31.29 31.50 3hqk h VAL 353 CO 0.16 0.00 0.48 -1.28 0.02 0.00 0.00 177.57 176.95 3hqk h SER 354 N -0.02 0.81 -0.58 0.57 0.87 -1.76 -2.47 113.55 110.98 3hqk h SER 354 Ca 0.37 -0.01 -0.10 0.00 -1.23 0.00 0.00 61.79 60.81 3hqk h SER 354 Cb 0.58 -0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 62.33 3hqk h SER 354 CO -0.82 0.58 -0.04 0.77 -0.53 0.00 0.00 176.83 176.79 3hqk h SER 355 N 0.96 1.05 -0.72 6.23 4.64 -1.15 -3.28 113.55 121.28 3hqk h SER 355 Ca 0.28 -0.32 -0.03 0.00 -0.47 0.00 0.00 61.79 61.25 3hqk h SER 355 Cb -0.07 -0.28 -0.03 0.00 -0.31 0.00 0.00 62.40 61.70 3hqk h SER 355 CO -0.08 1.12 0.34 0.58 -0.87 0.00 0.00 176.83 177.92 3hqk h VAL 356 N 0.96 1.24 -0.69 0.95 2.07 0.46 -3.21 116.25 118.03 3hqk h VAL 356 Ca 0.16 -0.69 -0.01 0.00 0.82 0.00 0.00 66.70 66.98 3hqk h VAL 356 Cb 0.61 0.31 -0.03 0.00 -1.52 0.00 0.00 31.29 30.65 3hqk h VAL 356 CO 0.04 0.29 0.38 0.77 0.02 0.00 0.00 177.57 179.07 3hqk h SER 357 N 1.05 0.85 -0.60 0.57 4.64 -1.51 -2.69 113.55 115.86 3hqk h SER 357 Ca 0.25 -0.07 0.17 0.00 -0.47 0.00 0.00 61.79 61.68 3hqk h SER 357 Cb 0.13 -0.22 -0.02 0.00 -0.31 0.00 0.00 62.40 61.98 3hqk h SER 357 CO -0.03 0.68 0.60 0.58 -0.87 0.00 0.00 176.83 177.80 3hqk h VAL 358 N 0.96 0.34 -0.36 0.95 2.07 -1.70 1.10 116.25 119.61 3hqk h VAL 358 Ca 0.25 0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.69 3hqk h VAL 358 Cb 0.02 0.53 -0.01 0.00 -1.52 0.00 0.00 31.29 30.31 3hqk h VAL 358 CO -0.04 0.00 -0.07 0.40 0.02 0.00 0.00 177.57 177.88 3hqk h ILE 359 N 0.00 1.27 -0.96 4.57 2.04 -1.68 -3.12 117.51 119.64 3hqk h ILE 359 Ca 0.29 -1.12 0.21 0.00 1.00 0.00 0.00 64.86 65.24 3hqk h ILE 359 Cb 1.49 1.26 -0.18 0.00 -0.74 0.00 0.00 36.82 38.65 3hqk h ILE 359 CO -0.00 0.37 -0.16 -0.26 0.00 0.00 0.00 178.15 178.10 3hqk h PHE 360 N 0.49 -0.36 -0.78 1.37 0.05 0.11 0.45 116.94 118.27 3hqk h PHE 360 Ca 0.09 0.08 0.23 0.00 3.82 0.00 0.00 57.97 62.19 3hqk h PHE 360 Cb 0.57 0.31 -0.03 0.00 2.00 0.00 0.00 35.95 38.80 3hqk h PHE 360 CO 0.05 -0.41 0.69 0.00 -0.18 0.00 0.00 178.31 178.46 3hqk h THR 361 N 0.01 0.36 0.03 -1.55 1.03 -1.46 -1.88 112.91 109.45 3hqk h THR 361 Ca 0.50 0.00 -0.00 0.00 -0.01 0.00 0.00 66.41 66.89 3hqk h THR 361 Cb 0.85 0.48 0.00 0.00 -1.07 0.00 0.00 68.15 68.41 3hqk h THR 361 CO -0.95 0.00 -0.01 -0.07 -0.01 0.00 0.00 175.52 174.47 3hqk h LEU 362 N 0.00 -0.03 -1.11 0.00 3.38 -0.22 -3.32 115.31 114.01 3hqk h LEU 362 Ca 0.37 -0.46 0.26 0.00 0.09 0.00 0.00 57.88 58.14 3hqk h LEU 362 Cb 1.75 0.01 -0.12 0.00 0.09 0.00 0.00 40.66 42.39 3hqk h LEU 362 CO -0.00 0.45 0.62 0.58 0.09 0.00 0.00 178.44 180.18 3hqk h VAL 363 N -0.53 0.52 -0.79 1.22 2.07 -1.40 0.08 116.25 117.42 3hqk h VAL 363 Ca -0.00 -0.18 -0.01 0.00 0.82 0.00 0.00 66.70 67.33 3hqk h VAL 363 Cb 0.49 -0.04 -0.04 0.00 -1.52 0.00 0.00 31.29 30.18 3hqk h VAL 363 CO 0.01 0.09 0.44 -0.65 0.02 0.00 0.00 177.57 177.48 3hqk h PRO 364 N 0.52 1.09 -0.82 1.57 0.11 -1.66 -0.71 132.00 132.09 3hqk h PRO 364 Ca 0.64 -0.12 -0.03 0.00 0.11 0.00 0.00 66.00 66.60 3hqk h PRO 364 Cb 1.34 -0.22 -0.04 0.00 0.11 0.00 0.00 31.00 32.20 3hqk h PRO 364 CO -0.43 0.79 0.39 1.88 -0.21 0.00 0.00 178.00 180.42 3hqk h TYR 365 N 1.09 1.19 -0.54 0.65 0.05 -1.12 -0.92 116.97 117.36 3hqk h TYR 365 Ca 0.28 -0.06 -0.02 0.00 0.05 0.00 0.00 58.73 58.98 3hqk h TYR 365 Cb 0.01 -0.37 -0.02 0.00 1.01 0.00 0.00 36.73 37.36 3hqk h TYR 365 CO -0.00 0.86 0.26 1.25 -1.05 0.00 0.00 178.16 179.48 3hqk h LEU 366 N 1.17 0.71 -0.84 3.88 5.85 -0.71 -1.01 115.31 124.36 3hqk h LEU 366 Ca 0.28 -0.13 -0.05 0.00 0.84 0.00 0.00 57.88 58.82 3hqk h LEU 366 Cb 0.13 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 40.94 3hqk h LEU 366 CO -0.03 0.64 0.27 1.88 -0.34 0.00 0.00 178.44 180.86 3hqk h TYR 367 N 0.73 1.15 -0.65 1.25 0.05 -0.68 -2.50 116.97 116.32 3hqk h TYR 367 Ca 0.19 -0.09 -0.04 0.00 0.05 0.00 0.00 58.73 58.84 3hqk h TYR 367 Cb 0.12 -0.34 -0.03 0.00 1.01 0.00 0.00 36.73 37.49 3hqk h TYR 367 CO -0.00 0.89 0.26 1.15 -1.05 0.00 0.00 178.16 179.41 3hqk h THR 368 N 1.09 1.23 -0.47 -2.88 2.02 -0.61 0.57 112.91 113.86 3hqk h THR 368 Ca 0.25 -0.70 -0.02 0.00 0.77 0.00 0.00 66.41 66.71 3hqk h THR 368 Cb 0.25 0.44 -0.02 0.00 -1.74 0.00 0.00 68.15 67.08 3hqk h THR 368 CO -0.02 0.28 0.23 0.00 0.37 0.00 0.00 175.52 176.38 3hqk h ALA 370 N 1.07 -0.01 -0.42 0.00 0.00 -1.39 -2.96 119.26 115.55 3hqk h ALA 370 Ca 0.16 -0.85 -0.01 0.00 0.00 0.00 0.00 54.91 54.21 3hqk h ALA 370 Cb 0.12 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 3hqk h ALA 370 CO -0.02 0.81 0.23 0.00 0.00 0.00 0.00 179.25 180.28 3hqk h ALA 371 N 0.38 0.54 -0.53 0.00 0.00 0.18 -0.14 119.26 119.69 3hqk h ALA 371 Ca -0.19 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.64 3hqk h ALA 371 Cb 2.03 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 19.63 3hqk h ALA 371 CO 0.24 0.05 0.31 1.25 0.00 0.00 0.00 179.25 181.10 3hqk h LEU 372 N 0.54 0.63 -0.40 0.00 5.85 -1.43 1.48 115.31 122.00 3hqk h LEU 372 Ca 0.15 -0.06 -0.05 0.00 0.84 0.00 0.00 57.88 58.76 3hqk h LEU 372 Cb 0.04 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 40.90 3hqk h LEU 372 CO -0.02 0.51 0.06 -0.07 -0.34 0.00 0.00 178.44 178.58 3hqk h LEU 373 N 0.70 0.64 -0.59 2.25 3.38 -1.34 0.31 115.31 120.66 3hqk h LEU 373 Ca 0.19 -0.26 -0.11 0.00 0.09 0.00 0.00 57.88 57.78 3hqk h LEU 373 Cb -0.00 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 3hqk h LEU 373 CO -0.03 0.74 -0.13 -0.07 0.09 0.00 0.00 178.44 179.03 3hqk h LEU 374 N 0.51 0.99 0.12 1.67 3.38 -0.67 -3.13 115.31 118.18 3hqk h LEU 374 Ca 0.12 -0.33 -0.25 0.00 0.09 0.00 0.00 57.88 57.51 3hqk h LEU 374 Cb 0.37 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.85 3hqk h LEU 374 CO 0.01 1.11 -1.26 -0.07 0.09 0.00 0.00 178.44 178.32 3hqk h LEU 375 N 0.87 0.39 -3.40 1.67 3.38 0.22 -3.41 115.31 115.03 3hqk h LEU 375 Ca 0.13 -0.87 0.00 0.00 0.09 0.00 0.00 57.88 57.23 3hqk h LEU 375 Cb 0.69 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.31 3hqk h LEU 375 CO 0.05 1.56 0.00 0.61 0.09 0.00 0.00 178.44 180.75 3hqk n GLY 376 N 1.71 3.53 0.28 0.83 0.00 0.11 -4.57 105.19 107.09 3hqk n GLY 376 Ca -0.22 -0.98 0.13 0.00 0.00 0.00 0.00 46.02 44.94 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 2.86 0.00 -0.44 1.61 2.07 -1.66 0.52 115.15 120.12 3hqk h HIS 377 Ca 0.00 0.00 -0.02 0.00 -2.85 0.00 0.00 60.37 57.50 3hqk h HIS 377 Cb 1.69 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 31.65 3hqk h HIS 377 CO 0.78 0.05 0.19 0.78 -3.07 0.00 0.00 177.93 176.66 3hqk h GLY 378 N 0.28 0.69 -2.19 6.13 0.00 -1.89 -3.35 103.07 102.73 3hqk h GLY 378 Ca -0.00 -0.36 -0.08 0.00 0.00 0.00 0.00 47.33 46.89 3hqk h GLY 378 CO 0.01 0.34 0.10 1.42 0.00 0.00 0.00 176.54 178.41 3hqk n HIS 379 N -4.64 0.70 -0.04 5.60 8.25 0.17 -4.41 115.22 120.86 3hqk n HIS 379 Ca 0.01 -0.59 -0.14 0.00 -0.26 0.00 0.00 57.72 56.74 3hqk n HIS 379 Cb 0.13 -0.35 -0.12 0.00 1.12 0.00 0.00 29.99 30.78 3hqk n HIS 379 CO 0.00 0.00 0.00 0.74 0.64 0.00 0.00 176.34 177.72 3hqk h PHE 380 N 0.57 -0.00 0.00 4.41 0.05 -1.71 -3.49 116.94 116.78 3hqk h PHE 380 Ca 0.10 -0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.89 3hqk h PHE 380 Cb 1.26 0.00 0.00 0.00 2.00 0.00 0.00 35.95 39.21 3hqk h PHE 380 CO 0.37 0.77 0.00 0.41 -0.18 0.00 0.00 178.31 179.68 3hqk n GLY 381 N 1.00 0.75 2.67 -1.45 0.00 -1.26 -4.08 105.19 102.82 3hqk n GLY 381 Ca -0.09 -0.10 -0.09 0.00 0.00 0.00 0.00 46.02 45.74 3hqk n GLY 381 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3hqk n LYS 382 N -2.48 1.12 -0.73 1.61 4.81 -1.26 -5.06 118.16 116.17 3hqk n LYS 382 Ca 0.00 -2.09 -0.08 0.00 -0.87 0.00 0.00 58.31 55.28 3hqk n LYS 382 Cb 0.00 -0.61 -0.11 0.00 0.02 0.00 0.00 35.03 34.33 3hqk n LYS 382 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3hqk n ALA 383 N -0.15 4.97 -0.03 3.14 0.00 -1.26 -4.69 120.51 122.49 3hqk n ALA 383 Ca 0.03 -1.19 -0.08 0.00 0.00 0.00 0.00 53.44 52.19 3hqk n ALA 383 Cb 0.78 -2.10 -0.02 0.00 0.00 0.00 0.00 19.45 18.11 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 3.24 -0.15 0.00 0.00 2.43 -1.97 -2.68 114.38 115.24 3hqk h ARG 384 Ca 0.12 0.01 -0.04 0.00 -0.81 0.00 0.00 59.98 59.27 3hqk h ARG 384 Cb 1.14 0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.72 3hqk h ARG 384 CO 0.23 -0.10 -0.17 -1.35 -1.51 0.00 0.00 179.97 177.07 3hqk h PRO 385 N -0.16 0.00 0.44 0.20 0.11 -1.97 0.71 132.00 131.33 3hqk h PRO 385 Ca 0.11 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.21 3hqk h PRO 385 Cb 0.33 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.44 3hqk h PRO 385 CO -0.28 0.17 -0.24 1.25 -0.21 0.00 0.00 178.00 178.68 3hqk h LEU 386 N 0.00 -0.59 0.63 2.35 6.46 -1.88 0.85 115.31 123.13 3hqk h LEU 386 Ca -0.00 0.03 -0.02 0.00 -0.12 0.00 0.00 57.88 57.77 3hqk h LEU 386 Cb 0.36 0.17 -0.01 0.00 -0.73 0.00 0.00 40.66 40.45 3hqk h LEU 386 CO 0.02 -0.39 -0.45 1.88 -0.62 0.00 0.00 178.44 178.88 3hqk h TYR 387 N -0.63 -1.21 -0.05 1.25 0.05 -1.07 0.10 116.97 115.41 3hqk h TYR 387 Ca -0.05 -0.00 0.01 0.00 0.05 0.00 0.00 58.73 58.74 3hqk h TYR 387 Cb 0.51 0.44 -0.00 0.00 1.01 0.00 0.00 36.73 38.69 3hqk h TYR 387 CO -0.07 -0.65 0.41 1.25 -1.05 0.00 0.00 178.16 178.04 3hqk h LEU 388 N -1.03 0.00 0.00 3.88 5.85 0.43 -0.95 115.31 123.49 3hqk h LEU 388 Ca -0.08 0.00 -0.19 0.00 0.84 0.00 0.00 57.88 58.45 3hqk h LEU 388 Cb 0.86 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.86 3hqk h LEU 388 CO 0.04 0.00 -1.20 -0.11 -0.34 0.00 0.00 178.44 176.83 3hqk n LEU 389 N -2.95 1.86 -0.38 2.25 7.94 0.29 -3.91 117.00 122.10 3hqk n LEU 389 Ca -0.01 0.46 -0.10 0.00 -1.11 0.00 0.00 56.01 55.26 3hqk n LEU 389 Cb 0.46 -0.92 -0.08 0.00 0.53 0.00 0.00 43.42 43.41 3hqk n LEU 389 CO 0.14 0.10 0.50 0.40 -1.11 0.00 0.00 177.39 177.42 3hqk h ILE 390 N -1.00 0.00 0.00 1.96 2.04 -0.35 0.70 117.51 120.86 3hqk h ILE 390 Ca -0.29 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.57 3hqk h ILE 390 Cb 1.13 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.21 3hqk h ILE 390 CO -0.17 0.00 0.16 0.35 0.00 0.00 0.00 178.15 178.49 3hqk n THR 391 N -5.29 0.87 -0.02 -0.27 -2.24 -0.42 -0.62 114.28 106.28 3hqk n THR 391 Ca 0.02 0.72 -0.22 0.00 -2.27 0.00 0.00 64.05 62.31 3hqk n THR 391 Cb 0.29 -1.72 -0.13 0.00 -2.10 0.00 0.00 70.33 66.66 3hqk n THR 391 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 3hqk n PHE 392 N -2.08 1.16 -0.33 4.78 -0.00 0.22 -2.80 117.46 118.40 3hqk n PHE 392 Ca -0.01 0.29 -0.04 0.00 -0.00 0.00 0.00 57.45 57.69 3hqk n PHE 392 Cb 0.18 -1.15 0.09 0.00 -0.00 0.00 0.00 39.48 38.61 3hqk n PHE 392 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.76 177.04 3hqk h VAL 393 N -0.15 1.25 -0.75 -2.13 2.07 0.13 -1.46 116.25 115.22 3hqk h VAL 393 Ca -0.42 -0.60 -0.05 0.00 0.82 0.00 0.00 66.70 66.46 3hqk h VAL 393 Cb 1.88 0.01 -0.03 0.00 -1.52 0.00 0.00 31.29 31.63 3hqk h VAL 393 CO 0.02 0.28 0.28 0.00 0.02 0.00 0.00 177.57 178.17 3hqk h ALA 394 N 1.28 1.09 -0.69 1.67 0.00 -0.99 -1.68 119.26 119.94 3hqk h ALA 394 Ca 0.32 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 3hqk h ALA 394 Cb -0.01 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.45 3hqk h ALA 394 CO -0.06 0.64 0.33 0.74 0.00 0.00 0.00 179.25 180.90 3hqk h PHE 395 N 1.09 1.00 -0.74 0.00 0.04 -1.12 -2.06 116.94 115.15 3hqk h PHE 395 Ca 0.25 -0.05 -0.05 0.00 2.80 0.00 0.00 57.97 60.91 3hqk h PHE 395 Cb 0.23 -0.31 -0.03 0.00 2.20 0.00 0.00 35.95 38.04 3hqk h PHE 395 CO 0.02 0.75 0.26 -0.24 -0.60 0.00 0.00 178.31 178.50 3hqk h VAL 396 N 0.97 1.26 0.53 -0.55 3.04 -1.02 -1.27 116.25 119.20 3hqk h VAL 396 Ca 0.24 -0.87 -0.02 0.00 -1.01 0.00 0.00 66.70 65.04 3hqk h VAL 396 Cb 0.13 0.42 -0.02 0.00 -2.01 0.00 0.00 31.29 29.81 3hqk h VAL 396 CO -0.03 0.34 -0.48 0.22 -1.01 0.00 0.00 177.57 176.62 3hqk h TYR 397 N 1.09 -1.32 -0.74 3.17 5.03 -0.78 0.12 116.97 123.53 3hqk h TYR 397 Ca 0.24 0.01 0.12 0.00 2.58 0.00 0.00 58.73 61.67 3hqk h TYR 397 Cb 0.27 0.51 -0.08 0.00 1.55 0.00 0.00 36.73 38.98 3hqk h TYR 397 CO 0.02 -0.65 0.35 0.00 -1.32 0.00 0.00 178.16 176.56 3hqk h ILE 399 N 0.55 1.07 0.16 0.00 2.04 -0.84 -2.11 117.51 118.38 3hqk h ILE 399 Ca 0.39 -0.80 -0.01 0.00 1.00 0.00 0.00 64.86 65.44 3hqk h ILE 399 Cb 0.49 1.44 0.00 0.00 -0.74 0.00 0.00 36.82 38.02 3hqk h ILE 399 CO -0.33 0.22 -0.08 -0.50 0.00 0.00 0.00 178.15 177.47 3hqk h TRP 400 N 0.00 -0.20 -0.91 1.37 6.55 0.99 -2.16 115.95 121.58 3hqk h TRP 400 Ca -0.00 -0.00 0.31 0.00 0.95 0.00 0.00 58.89 60.14 3hqk h TRP 400 Cb 0.42 0.07 -0.09 0.00 -0.86 0.00 0.00 29.16 28.71 3hqk h TRP 400 CO 0.00 -0.13 0.59 0.00 -1.05 0.00 0.00 178.44 177.86 3hqk n ALA 401 N -2.22 0.90 0.02 1.49 0.00 -0.60 0.13 120.51 120.23 3hqk n ALA 401 Ca -0.03 0.54 -0.10 0.00 0.00 0.00 0.00 53.44 53.86 3hqk n ALA 401 Cb 0.09 -0.68 -0.07 0.00 0.00 0.00 0.00 19.45 18.78 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 0.87 -0.55 0.00 2.07 -1.28 -2.68 116.25 114.68 3hqk h VAL 402 Ca 0.56 -1.33 0.11 0.00 0.82 0.00 0.00 66.70 66.87 3hqk h VAL 402 Cb 1.86 1.53 -0.09 0.00 -1.52 0.00 0.00 31.29 33.07 3hqk h VAL 402 CO -0.27 0.25 -0.01 0.40 0.02 0.00 0.00 177.57 177.96 3hqk h ILE 403 N -0.92 0.55 0.00 4.57 2.04 0.80 -0.03 117.51 124.52 3hqk h ILE 403 Ca -0.01 -0.04 0.00 0.00 1.00 0.00 0.00 64.86 65.81 3hqk h ILE 403 Cb 0.53 0.43 0.00 0.00 -0.74 0.00 0.00 36.82 37.04 3hqk h ILE 403 CO 0.02 0.02 0.01 0.61 0.00 0.00 0.00 178.15 178.81 3hqk n GLY 404 N -1.34 -0.17 3.37 5.37 0.00 0.34 -4.38 105.19 108.39 3hqk n GLY 404 Ca 0.07 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.76 3hqk n GLY 404 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3hqk s SER 405 N -2.31 3.87 -0.20 1.61 0.01 -0.03 -4.74 113.70 111.92 3hqk s SER 405 Ca 0.00 -0.34 -0.06 0.00 1.31 0.00 0.00 55.95 56.86 3hqk s SER 405 Cb 0.00 -1.44 -0.03 0.00 0.21 0.00 0.00 66.02 64.76 3hqk s SER 405 CO 0.00 0.20 0.02 -0.83 0.41 0.00 0.00 173.24 173.04 3hqk s GLY 406 N 0.16 1.76 -0.09 3.44 0.00 -1.26 -4.80 107.32 106.53 3hqk s GLY 406 Ca -0.08 -0.96 0.02 0.00 0.00 0.00 0.00 44.72 43.70 3hqk s GLY 406 CO 0.05 0.24 -0.15 0.00 0.00 0.00 0.00 173.10 173.24 3hqk s ALA 407 N 0.96 1.56 0.00 3.20 0.00 -1.26 -2.69 121.76 123.53 3hqk s ALA 407 Ca 0.02 -0.61 0.00 0.00 0.00 0.00 0.00 51.96 51.37 3hqk s ALA 407 Cb -0.14 -0.70 0.00 0.00 0.00 0.00 0.00 23.12 22.28 3hqk s ALA 407 CO 0.02 0.08 0.00 1.17 0.00 0.00 0.00 175.76 177.03 3hqk n LYS 408 N 3.89 0.00 -0.25 0.00 3.00 -1.26 -3.83 118.16 119.72 3hqk n LYS 408 Ca -0.21 0.00 -0.06 0.00 -0.00 0.00 0.00 58.31 58.04 3hqk n LYS 408 Cb 0.52 0.00 0.05 0.00 0.00 0.00 0.00 35.03 35.59 3hqk n LYS 408 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.40 178.45 3hqk h GLU 409 N 0.00 0.96 -0.56 1.64 4.11 -1.87 -3.03 114.58 115.82 3hqk h GLU 409 Ca 0.00 -0.12 -0.04 0.00 0.07 0.00 0.00 59.36 59.28 3hqk h GLU 409 Cb 0.00 -0.18 -0.03 0.00 0.50 0.00 0.00 28.75 29.04 3hqk h GLU 409 CO 0.00 0.73 0.20 0.28 0.07 0.00 0.00 179.01 180.28 3hqk h VAL 410 N 0.94 1.21 -0.87 -1.06 2.07 -1.80 -3.15 116.25 113.59 3hqk h VAL 410 Ca 0.24 -0.69 -0.02 0.00 0.82 0.00 0.00 66.70 67.05 3hqk h VAL 410 Cb 0.06 0.57 -0.04 0.00 -1.52 0.00 0.00 31.29 30.36 3hqk h VAL 410 CO -0.04 0.27 0.48 -0.03 0.02 0.00 0.00 177.57 178.28 3hqk h MET 411 N 0.81 1.21 -0.79 1.57 1.85 -1.63 -2.51 114.93 115.43 3hqk h MET 411 Ca 0.19 -0.14 -0.01 0.00 -0.61 0.00 0.00 59.70 59.13 3hqk h MET 411 Cb 0.20 -0.24 -0.04 0.00 0.43 0.00 0.00 31.60 31.95 3hqk h MET 411 CO -0.01 0.88 0.44 -1.49 -0.40 0.00 0.00 176.91 176.33 3hqk h TRP 412 N 1.21 1.08 -0.91 1.39 4.06 -1.59 -0.00 115.95 121.19 3hqk h TRP 412 Ca 0.31 -0.02 0.20 0.00 2.06 0.00 0.00 58.89 61.44 3hqk h TRP 412 Cb 0.02 -0.35 -0.17 0.00 -1.00 0.00 0.00 29.16 27.66 3hqk h TRP 412 CO 0.01 0.75 -0.14 0.77 -3.56 0.00 0.00 178.44 176.27 3hqk h SER 413 N 1.10 -0.70 -0.43 -3.49 0.02 -1.49 0.97 113.55 109.53 3hqk h SER 413 Ca 0.28 0.27 -0.05 0.00 -0.84 0.00 0.00 61.79 61.45 3hqk h SER 413 Cb 0.02 0.52 -0.02 0.00 0.14 0.00 0.00 62.40 63.07 3hqk h SER 413 CO -0.05 -0.30 0.07 0.15 -1.14 0.00 0.00 176.83 175.56 3hqk h PHE 414 N 0.01 0.75 -0.45 3.45 3.04 -1.01 -0.68 116.94 122.07 3hqk h PHE 414 Ca 0.47 -0.10 -0.06 0.00 3.98 0.00 0.00 57.97 62.26 3hqk h PHE 414 Cb 0.81 -0.21 -0.02 0.00 2.56 0.00 0.00 35.95 39.09 3hqk h PHE 414 CO -0.63 0.72 0.02 0.28 -2.02 0.00 0.00 178.31 176.68 3hqk h VAL 415 N 0.56 1.23 -0.80 1.41 2.07 0.16 -2.45 116.25 118.43 3hqk h VAL 415 Ca 0.13 -0.92 -0.03 0.00 0.82 0.00 0.00 66.70 66.69 3hqk h VAL 415 Cb 0.38 0.87 -0.04 0.00 -1.52 0.00 0.00 31.29 30.98 3hqk h VAL 415 CO 0.01 0.32 0.36 0.74 0.02 0.00 0.00 177.57 179.03 3hqk h THR 416 N 0.68 1.25 -0.77 2.57 2.02 0.68 -0.22 112.91 119.13 3hqk h THR 416 Ca 0.14 -0.74 -0.05 0.00 0.77 0.00 0.00 66.41 66.53 3hqk h THR 416 Cb 0.40 0.26 -0.03 0.00 -1.74 0.00 0.00 68.15 67.03 3hqk h THR 416 CO 0.01 0.31 0.30 -0.07 0.37 0.00 0.00 175.52 176.45 3hqk h LEU 417 N 1.14 1.06 -0.75 2.58 3.38 -0.79 0.06 115.31 121.99 3hqk h LEU 417 Ca 0.27 -0.16 -0.03 0.00 0.09 0.00 0.00 57.88 58.05 3hqk h LEU 417 Cb 0.15 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.59 3hqk h LEU 417 CO -0.03 0.94 0.36 -0.03 0.09 0.00 0.00 178.44 179.77 3hqk h MET 418 N 1.12 1.08 -0.72 1.13 4.05 -0.95 -2.09 114.93 118.55 3hqk h MET 418 Ca 0.26 -0.16 -0.06 0.00 -0.28 0.00 0.00 59.70 59.45 3hqk h MET 418 Cb 0.22 -0.20 -0.03 0.00 -0.80 0.00 0.00 31.60 30.79 3hqk h MET 418 CO -0.02 0.84 0.19 0.28 0.23 0.00 0.00 176.91 178.44 3hqk h VAL 419 N 1.06 1.26 -0.68 -5.77 2.07 -0.14 -2.68 116.25 111.37 3hqk h VAL 419 Ca 0.26 -0.94 -0.02 0.00 0.82 0.00 0.00 66.70 66.82 3hqk h VAL 419 Cb 0.12 0.50 -0.03 0.00 -1.52 0.00 0.00 31.29 30.35 3hqk h VAL 419 CO -0.03 0.36 0.35 0.40 0.02 0.00 0.00 177.57 178.67 3hqk h ILE 420 N 1.07 1.22 0.59 4.57 1.08 -0.51 -0.76 117.51 124.78 3hqk h ILE 420 Ca 0.23 -0.60 -0.03 0.00 -0.39 0.00 0.00 64.86 64.07 3hqk h ILE 420 Cb 0.34 0.36 0.01 0.00 -3.07 0.00 0.00 36.82 34.46 3hqk h ILE 420 CO -0.00 0.25 -0.28 0.74 -0.69 0.00 0.00 178.15 178.17 3hqk h THR 421 N 0.94 0.28 -0.37 -0.27 2.02 -1.15 -0.05 112.91 114.32 3hqk h THR 421 Ca 0.24 -0.32 0.11 0.00 0.77 0.00 0.00 66.41 67.21 3hqk h THR 421 Cb 0.09 0.37 -0.01 0.00 -1.74 0.00 0.00 68.15 66.86 3hqk h THR 421 CO -0.03 0.03 0.33 0.00 0.37 0.00 0.00 175.52 176.22 3hqk h ALA 422 N -0.80 2.16 0.83 6.16 0.00 -1.45 0.15 119.26 126.30 3hqk h ALA 422 Ca -0.08 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.78 3hqk h ALA 422 Cb 0.67 0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.49 3hqk h ALA 422 CO 0.13 -0.52 -0.40 1.25 0.00 0.00 0.00 179.25 179.72 3hqk h LEU 423 N 0.00 -0.94 -0.48 0.00 5.85 -0.67 -2.72 115.31 116.35 3hqk h LEU 423 Ca 0.17 0.02 0.08 0.00 0.84 0.00 0.00 57.88 59.00 3hqk h LEU 423 Cb 0.83 0.24 -0.07 0.00 0.37 0.00 0.00 40.66 42.04 3hqk h LEU 423 CO -0.00 -0.60 0.10 0.22 -0.34 0.00 0.00 178.44 177.82 3hqk h TYR 424 N -1.25 0.16 0.00 1.25 5.03 0.53 -2.37 116.97 120.32 3hqk h TYR 424 Ca -0.11 0.03 0.00 0.00 2.58 0.00 0.00 58.73 61.22 3hqk h TYR 424 Cb 0.86 -0.00 0.00 0.00 1.55 0.00 0.00 36.73 39.14 3hqk h TYR 424 CO -0.00 0.01 0.00 0.00 -1.32 0.00 0.00 178.16 176.84 3hqk n ALA 425 N -2.50 1.88 0.31 1.82 0.00 0.36 -0.96 120.51 121.41 3hqk n ALA 425 Ca 0.05 -0.07 0.09 0.00 0.00 0.00 0.00 53.44 53.51 3hqk n ALA 425 Cb 0.23 -1.29 -0.13 0.00 0.00 0.00 0.00 19.45 18.26 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 -1.41 0.32 -0.10 0.00 4.77 -0.95 -4.35 117.00 115.28 3hqk n LEU 426 Ca 0.06 -0.19 -0.12 0.00 -0.03 0.00 0.00 56.01 55.73 3hqk n LEU 426 Cb 0.18 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.16 3hqk n LEU 426 CO 0.15 0.08 -1.13 0.59 -1.33 0.00 0.00 177.39 175.75 3hqk n ASN 427 N -1.86 1.76 -1.09 -1.43 4.13 -0.14 -4.47 115.26 112.15 3hqk n ASN 427 Ca -0.01 -0.07 0.08 0.00 1.68 0.00 0.00 54.58 56.26 3hqk n ASN 427 Cb 0.40 0.18 0.27 0.00 -1.54 0.00 0.00 39.78 39.08 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 -2.91 1.06 -0.20 3.10 0.53 -0.22 -4.75 117.16 113.76 3hqk n TYR 428 Ca -0.33 -0.70 0.17 0.00 -1.02 0.00 0.00 57.90 56.02 3hqk n TYR 428 Cb 0.96 -0.24 0.32 0.00 -1.03 0.00 0.00 39.34 39.35 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 0.28 0.16 0.00 7.72 4.05 -1.26 -1.71 115.26 124.49 3hqk n ASN 429 Ca 0.21 1.01 0.00 0.00 0.45 0.00 0.00 54.58 56.24 3hqk n ASN 429 Cb 0.80 -0.47 0.00 0.00 1.23 0.00 0.00 39.78 41.34 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 -4.45 3.09 0.00 1.20 1.74 -1.26 -4.43 116.66 112.55 3hqk n ARG 430 Ca 0.21 0.00 0.06 0.00 -0.77 0.00 0.00 57.85 57.35 3hqk n ARG 430 Cb 0.72 -0.76 0.32 0.00 -1.02 0.00 0.00 32.46 31.72 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 -1.23 0.11 -3.29 0.55 5.41 -0.70 -4.88 119.36 115.33 3hqk n ILE 431 Ca 0.00 0.03 -0.38 0.00 1.00 0.00 0.00 62.75 63.40 3hqk n ILE 431 Cb 0.00 -0.85 -0.06 0.00 -0.71 0.00 0.00 39.64 38.02 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 -2.09 3.52 -0.38 1.39 2.46 -0.92 -5.03 115.29 114.24 3hqk s HIS 432 Ca 0.16 0.92 -0.16 0.00 0.47 0.00 0.00 55.06 56.45 3hqk s HIS 432 Cb 0.08 -2.58 0.01 0.00 -0.13 0.00 0.00 32.58 29.95 3hqk s HIS 432 CO 0.14 0.16 0.40 0.21 -2.47 0.00 0.00 174.74 173.17 3hqk s LYS 433 N 0.66 3.32 -0.52 2.88 2.20 -1.26 -4.99 119.74 122.02 3hqk s LYS 433 Ca 0.27 -0.59 0.07 0.00 -0.36 0.00 0.00 55.97 55.36 3hqk s LYS 433 Cb -0.15 -3.89 0.28 0.00 -1.51 0.00 0.00 37.83 32.55 3hqk s LYS 433 CO 0.11 -0.70 0.71 -1.71 -0.36 0.00 0.00 175.35 173.40 3hqk n ASN 434 N 5.50 2.44 -4.62 1.43 4.05 -1.26 -4.98 115.26 117.82 3hqk n ASN 434 Ca -0.08 -3.20 -0.42 0.00 0.45 0.00 0.00 54.58 51.33 3hqk n ASN 434 Cb 0.48 -0.64 -0.05 0.00 1.23 0.00 0.00 39.78 40.80 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 -2.24 3.99 -0.30 1.20 0.04 -1.26 -1.10 135.00 135.32 3hqk s PRO 435 Ca 0.40 0.59 -0.04 0.00 0.04 0.00 0.00 61.00 61.99 3hqk s PRO 435 Cb 0.20 -3.71 0.04 0.00 0.04 0.00 0.00 34.50 31.06 3hqk s PRO 435 CO -0.07 -0.64 0.04 0.71 0.04 0.00 0.00 177.00 177.08 3hqk s TYR 436 N 2.88 3.21 1.16 0.56 4.12 -1.26 -5.17 117.35 122.86 3hqk s TYR 436 Ca 0.31 -1.52 -0.17 0.00 0.02 0.00 0.00 57.07 55.71 3hqk s TYR 436 Cb -0.14 -2.18 0.20 0.00 -1.52 0.00 0.00 41.96 38.32 3hqk s TYR 436 CO 0.12 -0.73 0.38 -2.30 0.02 0.00 0.00 175.55 173.03 3hqk n PRO 437 N 4.74 -2.58 -0.01 -1.71 -0.02 -0.26 -5.02 135.00 130.14 3hqk n PRO 437 Ca -0.14 -0.75 0.00 0.00 -2.02 0.00 0.00 63.50 60.59 3hqk n PRO 437 Cb 0.45 -1.70 0.00 0.00 -0.02 0.00 0.00 33.50 32.23 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 -2.64 0.00 -0.09 2.45 4.77 -1.26 -5.10 117.00 115.13 3hqk n LEU 438 Ca 0.05 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.93 3hqk n LEU 438 Cb 0.51 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.57 3hqk n LEU 438 CO 0.40 -0.29 -0.69 0.47 -1.33 0.00 0.00 177.39 175.95 3hqk n ASP 439 N -1.72 1.93 0.00 -1.43 9.92 -1.26 -5.24 116.55 118.75 3hqk n ASP 439 Ca 0.00 0.36 0.00 0.00 -0.53 0.00 0.00 54.79 54.62 3hqk n ASP 439 Cb 0.00 -0.76 0.00 0.00 -0.64 0.00 0.00 41.12 39.72 3hqk n ASP 439 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33