#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lq8 s ARG 27 N 0.00 0.71 -0.88 -0.14 3.52 -1.26 -5.05 118.95 115.84 1lq8 s ARG 27 Ca 0.00 0.16 -0.15 0.00 -0.13 0.00 0.00 55.73 55.61 1lq8 s ARG 27 Cb 0.00 0.33 0.20 0.00 -1.56 0.00 0.00 34.95 33.91 1lq8 s ARG 27 CO 0.00 -0.18 0.91 -0.51 -0.81 0.00 0.00 175.30 174.71 1lq8 s ASP 28 N -0.81 6.77 0.16 -2.12 -0.00 -1.26 -4.33 116.67 115.09 1lq8 s ASP 28 Ca -0.09 -2.58 -0.15 0.00 -0.00 0.00 0.00 52.55 49.73 1lq8 s ASP 28 Cb -0.04 -2.27 0.09 0.00 -0.00 0.00 0.00 42.92 40.70 1lq8 s ASP 28 CO 0.04 -0.70 1.75 0.15 -0.00 0.00 0.00 175.17 176.41 1lq8 h PHE 29 N 7.99 0.23 -0.43 4.23 3.57 -1.77 0.34 116.94 131.09 1lq8 h PHE 29 Ca 0.13 0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.69 1lq8 h PHE 29 Cb 1.02 -0.04 -0.04 0.00 2.79 0.00 0.00 35.95 39.68 1lq8 h PHE 29 CO 1.06 0.08 0.21 1.15 -2.23 0.00 0.00 178.31 178.58 1lq8 h THR 30 N 0.28 0.96 0.00 4.41 2.02 -1.91 0.06 112.91 118.72 1lq8 h THR 30 Ca 0.18 -0.14 -0.02 0.00 0.77 0.00 0.00 66.41 67.20 1lq8 h THR 30 Cb 0.17 0.50 -0.00 0.00 -1.74 0.00 0.00 68.15 67.08 1lq8 h THR 30 CO -0.19 0.08 -0.66 -0.26 0.37 0.00 0.00 175.52 174.86 1lq8 h PHE 31 N 0.42 0.00 -0.26 3.16 0.04 -1.87 -1.86 116.94 116.57 1lq8 h PHE 31 Ca 0.19 0.00 -0.19 0.00 2.80 0.00 0.00 57.97 60.77 1lq8 h PHE 31 Cb 0.11 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.26 1lq8 h PHE 31 CO -0.11 0.07 -0.60 -0.44 -0.60 0.00 0.00 178.31 176.63 1lq8 h ASP 32 N 0.00 0.96 -0.41 2.17 3.45 -0.10 -2.08 116.42 120.41 1lq8 h ASP 32 Ca -0.01 -0.54 -0.14 0.00 0.43 0.00 0.00 57.03 56.76 1lq8 h ASP 32 Cb 1.07 -0.28 -0.01 0.00 -0.56 0.00 0.00 39.33 39.55 1lq8 h ASP 32 CO 0.01 1.34 -0.30 0.25 -1.57 0.00 0.00 179.24 178.96 1lq8 h LEU 33 N 0.64 0.98 0.00 1.55 5.85 -1.00 -1.75 115.31 121.58 1lq8 h LEU 33 Ca -0.00 -0.41 0.02 0.00 0.84 0.00 0.00 57.88 58.33 1lq8 h LEU 33 Cb 1.21 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.94 1lq8 h LEU 33 CO 0.13 1.20 -0.15 0.22 -0.34 0.00 0.00 178.44 179.50 1lq8 h TYR 34 N 0.79 -0.40 -0.77 1.25 3.20 -1.22 -1.28 116.97 118.54 1lq8 h TYR 34 Ca 0.08 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.97 1lq8 h TYR 34 Cb 0.88 0.18 -0.04 0.00 1.54 0.00 0.00 36.73 39.29 1lq8 h TYR 34 CO 0.06 -0.23 0.48 0.00 -1.64 0.00 0.00 178.16 176.83 1lq8 h ARG 35 N -0.26 1.03 -0.44 1.82 3.08 -1.28 -1.44 114.38 116.89 1lq8 h ARG 35 Ca 0.05 -0.08 0.06 0.00 0.07 0.00 0.00 59.98 60.08 1lq8 h ARG 35 Cb 0.32 -0.22 -0.06 0.00 0.08 0.00 0.00 29.97 30.09 1lq8 h ARG 35 CO -0.15 0.71 0.12 0.00 -1.07 0.00 0.00 179.97 179.59 1lq8 h ALA 36 N 1.26 0.50 -0.56 0.04 0.00 -0.86 0.19 119.26 119.84 1lq8 h ALA 36 Ca 0.28 0.07 -0.06 0.00 0.00 0.00 0.00 54.91 55.20 1lq8 h ALA 36 Cb -0.07 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1lq8 h ALA 36 CO -0.06 -0.28 0.10 -0.07 0.00 0.00 0.00 179.25 178.94 1lq8 h LEU 37 N 0.27 0.83 -0.10 0.00 3.38 -0.90 -2.06 115.31 116.73 1lq8 h LEU 37 Ca 0.21 -0.17 -0.04 0.00 0.09 0.00 0.00 57.88 57.97 1lq8 h LEU 37 Cb 0.24 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.77 1lq8 h LEU 37 CO -0.25 0.84 -0.09 0.00 0.09 0.00 0.00 178.44 179.02 1lq8 h ALA 38 N 1.27 0.15 -0.51 1.53 0.00 -0.42 -2.50 119.26 118.78 1lq8 h ALA 38 Ca 0.18 -0.29 0.05 0.00 0.00 0.00 0.00 54.91 54.85 1lq8 h ALA 38 Cb 0.36 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 1lq8 h ALA 38 CO 0.01 -0.02 0.34 0.77 0.00 0.00 0.00 179.25 180.34 1lq8 h SER 39 N -0.16 0.42 1.45 0.00 0.02 -0.55 -0.29 113.55 114.45 1lq8 h SER 39 Ca 0.02 -0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 60.93 1lq8 h SER 39 Cb 0.60 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 63.04 1lq8 h SER 39 CO 0.02 0.28 -0.19 0.00 -1.14 0.00 0.00 176.83 175.80 1lq8 h ALA 40 N 1.72 0.92 -2.07 3.77 0.00 -1.29 -3.34 119.26 118.97 1lq8 h ALA 40 Ca 0.22 -0.17 -0.54 0.00 0.00 0.00 0.00 54.91 54.41 1lq8 h ALA 40 Cb 0.25 -0.03 -0.40 0.00 0.00 0.00 0.00 17.79 17.61 1lq8 h ALA 40 CO -0.06 0.24 -1.00 0.00 0.00 0.00 0.00 179.25 178.43 1lq8 n ALA 41 N -2.16 2.86 0.00 0.00 0.00 -0.22 -5.06 120.51 115.92 1lq8 n ALA 41 Ca 0.02 -3.80 0.00 0.00 0.00 0.00 0.00 53.44 49.66 1lq8 n ALA 41 Cb 0.53 -0.86 0.00 0.00 0.00 0.00 0.00 19.45 19.12 1lq8 n ALA 41 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1lq8 n PRO 42 N 0.62 0.00 -2.79 0.00 -0.02 -0.58 -2.48 135.00 129.75 1lq8 n PRO 42 Ca 0.25 0.00 -0.25 0.00 -2.02 0.00 0.00 63.50 61.49 1lq8 n PRO 42 Cb 0.54 0.00 -0.02 0.00 -0.02 0.00 0.00 33.50 34.00 1lq8 n PRO 42 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1lq8 n SER 43 N -1.54 3.98 -4.33 2.55 7.64 -1.26 -4.91 113.62 115.75 1lq8 n SER 43 Ca 0.00 -3.56 -0.18 0.00 1.01 0.00 0.00 58.87 56.14 1lq8 n SER 43 Cb 0.00 -0.53 -0.10 0.00 -1.01 0.00 0.00 64.21 62.57 1lq8 n SER 43 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 1lq8 s GLN 44 N -3.37 1.31 0.54 1.43 1.11 -1.03 -5.13 119.66 114.51 1lq8 s GLN 44 Ca 0.46 -1.62 -0.20 0.00 0.01 0.00 0.00 55.36 54.01 1lq8 s GLN 44 Cb 0.34 -0.86 -0.06 0.00 -1.01 0.00 0.00 33.01 31.43 1lq8 s GLN 44 CO -0.14 0.05 1.17 -0.80 0.01 0.00 0.00 175.29 175.59 1lq8 s ASN 45 N -3.30 5.66 0.05 5.90 0.01 -1.26 -5.03 114.94 116.97 1lq8 s ASN 45 Ca 0.24 2.31 0.06 0.00 -0.71 0.00 0.00 52.86 54.75 1lq8 s ASN 45 Cb 0.03 -2.59 -0.02 0.00 0.41 0.00 0.00 41.25 39.07 1lq8 s ASN 45 CO 0.07 -1.27 -0.16 -0.63 -1.51 0.00 0.00 177.10 173.60 1lq8 s ILE 46 N -1.63 1.32 -0.29 0.60 1.09 -1.26 -4.93 121.20 116.10 1lq8 s ILE 46 Ca 0.72 -1.14 -0.17 0.00 -1.10 0.00 0.00 60.65 58.95 1lq8 s ILE 46 Cb -0.28 -1.18 0.12 0.00 -1.06 0.00 0.00 42.46 40.06 1lq8 s ILE 46 CO 0.32 0.02 0.90 0.12 -0.10 0.00 0.00 174.94 176.20 1lq8 s PHE 47 N -0.92 -0.70 0.26 3.97 5.36 -1.26 -4.93 117.98 119.76 1lq8 s PHE 47 Ca 0.03 1.42 -0.21 0.00 -0.96 0.00 0.00 56.93 57.21 1lq8 s PHE 47 Cb -0.09 0.42 0.04 0.00 -0.34 0.00 0.00 43.02 43.05 1lq8 s PHE 47 CO 0.02 -0.34 0.81 -0.59 -1.46 0.00 0.00 175.22 173.65 1lq8 s PHE 48 N 1.30 -0.12 -0.36 10.12 -0.71 -1.26 -3.95 117.98 123.00 1lq8 s PHE 48 Ca -0.08 -0.33 -0.01 0.00 -1.04 0.00 0.00 56.93 55.47 1lq8 s PHE 48 Cb -0.04 0.71 0.09 0.00 -1.21 0.00 0.00 43.02 42.57 1lq8 s PHE 48 CO -0.15 -1.16 0.10 0.45 -1.34 0.00 0.00 175.22 173.12 1lq8 s SER 49 N -2.97 5.03 0.14 1.98 0.15 -1.26 -4.99 113.70 111.77 1lq8 s SER 49 Ca 0.13 -1.79 -0.19 0.00 0.70 0.00 0.00 55.95 54.80 1lq8 s SER 49 Cb -0.04 -1.75 0.01 0.00 -1.71 0.00 0.00 66.02 62.53 1lq8 s SER 49 CO 0.06 -0.41 1.71 -0.65 1.20 0.00 0.00 173.24 175.15 1lq8 h PRO 50 N 7.95 0.07 -0.85 5.44 0.11 -1.99 -1.93 132.00 140.78 1lq8 h PRO 50 Ca -0.14 -0.00 0.18 0.00 0.11 0.00 0.00 66.00 66.14 1lq8 h PRO 50 Cb 1.05 -0.01 -0.11 0.00 0.11 0.00 0.00 31.00 32.03 1lq8 h PRO 50 CO 0.61 0.04 0.38 0.28 -0.21 0.00 0.00 178.00 179.10 1lq8 h VAL 51 N 0.07 0.59 0.06 3.15 2.07 -1.98 0.33 116.25 120.54 1lq8 h VAL 51 Ca 0.12 -0.16 -0.00 0.00 0.82 0.00 0.00 66.70 67.48 1lq8 h VAL 51 Cb 0.17 0.08 -0.00 0.00 -1.52 0.00 0.00 31.29 30.01 1lq8 h VAL 51 CO -0.22 0.09 -0.03 -1.28 0.02 0.00 0.00 177.57 176.15 1lq8 h SER 52 N 0.47 -0.07 -0.06 0.57 0.87 -1.76 -0.36 113.55 113.22 1lq8 h SER 52 Ca 0.49 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 61.04 1lq8 h SER 52 Cb 0.83 0.02 -0.00 0.00 -0.44 0.00 0.00 62.40 62.81 1lq8 h SER 52 CO -0.45 -0.05 -0.05 0.40 -0.53 0.00 0.00 176.83 176.14 1lq8 h ILE 53 N -0.08 1.36 -0.65 2.23 2.04 -0.81 -1.61 117.51 119.99 1lq8 h ILE 53 Ca -0.01 -1.18 -0.06 0.00 1.00 0.00 0.00 64.86 64.62 1lq8 h ILE 53 Cb 0.07 2.02 -0.03 0.00 -0.74 0.00 0.00 36.82 38.13 1lq8 h ILE 53 CO 0.01 0.32 0.16 0.77 0.00 0.00 0.00 178.15 179.42 1lq8 h SER 54 N -0.29 0.97 -0.65 1.72 4.64 -0.43 0.18 113.55 119.69 1lq8 h SER 54 Ca 0.01 -0.19 -0.08 0.00 -0.47 0.00 0.00 61.79 61.06 1lq8 h SER 54 Cb 0.54 -0.25 -0.03 0.00 -0.31 0.00 0.00 62.40 62.35 1lq8 h SER 54 CO 0.01 0.93 0.10 -0.03 -0.87 0.00 0.00 176.83 176.98 1lq8 h MET 55 N 0.98 1.09 -0.63 4.77 1.85 -1.08 0.23 114.93 122.14 1lq8 h MET 55 Ca 0.21 -0.29 -0.03 0.00 -0.61 0.00 0.00 59.70 58.98 1lq8 h MET 55 Cb 0.34 -0.13 -0.03 0.00 0.43 0.00 0.00 31.60 32.21 1lq8 h MET 55 CO -0.00 1.00 0.27 0.77 -0.40 0.00 0.00 176.91 178.55 1lq8 h SER 56 N 1.02 0.85 -0.36 1.39 0.02 -0.63 -0.90 113.55 114.94 1lq8 h SER 56 Ca 0.20 -0.15 -0.03 0.00 -0.84 0.00 0.00 61.79 60.97 1lq8 h SER 56 Cb 0.44 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.74 1lq8 h SER 56 CO 0.01 0.77 0.13 -0.07 -1.14 0.00 0.00 176.83 176.53 1lq8 h LEU 57 N 0.87 0.51 -1.89 5.07 3.38 -0.16 -0.74 115.31 122.35 1lq8 h LEU 57 Ca 0.21 -0.19 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 1lq8 h LEU 57 Cb 0.17 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.78 1lq8 h LEU 57 CO -0.02 0.56 -0.11 0.00 0.09 0.00 0.00 178.44 178.96 1lq8 h ALA 58 N 0.97 1.62 0.02 1.53 0.00 -0.71 -0.10 119.26 122.59 1lq8 h ALA 58 Ca 0.12 -0.10 -0.22 0.00 0.00 0.00 0.00 54.91 54.71 1lq8 h ALA 58 Cb 0.22 -0.02 0.02 0.00 0.00 0.00 0.00 17.79 18.01 1lq8 h ALA 58 CO -0.01 0.14 -0.86 0.52 0.00 0.00 0.00 179.25 179.04 1lq8 h MET 59 N 0.00 0.56 -0.63 0.00 2.86 -0.51 -3.21 114.93 114.00 1lq8 h MET 59 Ca -0.00 -0.62 0.04 0.00 -2.06 0.00 0.00 59.70 57.05 1lq8 h MET 59 Cb 0.22 0.18 -0.04 0.00 0.06 0.00 0.00 31.60 32.02 1lq8 h MET 59 CO 0.01 1.24 0.37 1.25 1.06 0.00 0.00 176.91 180.84 1lq8 h LEU 60 N 0.14 0.60 -2.51 1.22 5.85 -0.24 -1.31 115.31 119.06 1lq8 h LEU 60 Ca -0.11 0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.63 1lq8 h LEU 60 Cb 1.55 -0.12 -0.00 0.00 0.37 0.00 0.00 40.66 42.47 1lq8 h LEU 60 CO 0.17 0.41 0.04 0.77 -0.34 0.00 0.00 178.44 179.49 1lq8 h SER 61 N 0.73 0.00 -0.62 1.25 4.64 -1.09 -2.22 113.55 116.23 1lq8 h SER 61 Ca 0.26 0.00 0.09 0.00 -0.47 0.00 0.00 61.79 61.68 1lq8 h SER 61 Cb 0.06 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.12 1lq8 h SER 61 CO -0.12 0.00 0.42 0.25 -0.87 0.00 0.00 176.83 176.50 1lq8 h LEU 62 N 0.00 0.41 -3.46 5.97 5.85 -1.24 -2.06 115.31 120.79 1lq8 h LEU 62 Ca 0.01 0.01 -0.32 0.00 0.84 0.00 0.00 57.88 58.43 1lq8 h LEU 62 Cb 0.10 -0.08 -0.23 0.00 0.37 0.00 0.00 40.66 40.83 1lq8 h LEU 62 CO -0.00 0.25 -0.47 0.61 -0.34 0.00 0.00 178.44 178.49 1lq8 n GLY 63 N -1.51 5.70 3.57 3.75 0.00 -0.84 -4.84 105.19 111.03 1lq8 n GLY 63 Ca 0.10 -1.95 -0.29 0.00 0.00 0.00 0.00 46.02 43.88 1lq8 n GLY 63 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lq8 s ALA 64 N -3.44 2.93 0.33 4.61 0.00 -0.78 -1.96 121.76 123.44 1lq8 s ALA 64 Ca 0.47 -1.30 0.04 0.00 0.00 0.00 0.00 51.96 51.17 1lq8 s ALA 64 Cb 0.40 -0.84 -0.02 0.00 0.00 0.00 0.00 23.12 22.67 1lq8 s ALA 64 CO -0.01 0.60 0.15 0.41 0.00 0.00 0.00 175.76 176.91 1lq8 n GLY 65 N 0.58 3.32 7.00 0.00 0.00 -0.12 -4.66 105.19 111.31 1lq8 n GLY 65 Ca -0.13 -2.03 0.00 0.00 0.00 0.00 0.00 46.02 43.86 1lq8 n GLY 65 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1lq8 n SER 66 N -1.68 0.00 0.22 1.61 2.88 -1.26 -0.87 113.62 114.52 1lq8 n SER 66 Ca -0.02 0.00 0.09 0.00 -1.33 0.00 0.00 58.87 57.60 1lq8 n SER 66 Cb 0.51 0.00 0.50 0.00 -0.75 0.00 0.00 64.21 64.47 1lq8 n SER 66 CO 0.00 0.00 0.00 0.77 -1.23 0.00 0.00 175.04 174.58 1lq8 h SER 67 N 2.13 0.00 -0.56 -3.46 4.64 -1.99 -2.96 113.55 111.35 1lq8 h SER 67 Ca 0.00 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.26 1lq8 h SER 67 Cb 0.00 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.07 1lq8 h SER 67 CO 0.00 0.25 0.10 0.71 -0.87 0.00 0.00 176.83 177.01 1lq8 h THR 68 N 0.00 1.25 0.00 2.95 1.35 -1.79 -0.08 112.91 116.59 1lq8 h THR 68 Ca -0.00 -0.96 0.00 0.00 -0.55 0.00 0.00 66.41 64.90 1lq8 h THR 68 Cb 0.64 0.79 0.00 0.00 -1.73 0.00 0.00 68.15 67.85 1lq8 h THR 68 CO 0.03 0.35 0.00 0.50 -0.25 0.00 0.00 175.52 176.15 1lq8 h LYS 69 N 0.82 0.00 0.03 4.72 1.63 -0.84 -2.97 116.57 119.96 1lq8 h LYS 69 Ca 0.17 0.00 -0.32 0.00 -0.85 0.00 0.00 60.65 59.65 1lq8 h LYS 69 Cb 0.40 0.00 -0.05 0.00 -0.60 0.00 0.00 32.23 31.99 1lq8 h LYS 69 CO 0.01 0.00 -1.86 -0.12 -3.45 0.00 0.00 179.45 174.03 1lq8 n MET 70 N -2.92 0.67 -0.08 1.90 1.56 -0.66 -3.47 117.12 114.10 1lq8 n MET 70 Ca 0.00 0.26 -0.03 0.00 -0.27 0.00 0.00 57.70 57.66 1lq8 n MET 70 Cb 0.25 -1.74 0.20 0.00 2.15 0.00 0.00 33.22 34.07 1lq8 n MET 70 CO 0.00 0.00 0.00 1.96 -0.73 0.00 0.00 175.97 177.20 1lq8 h GLN 71 N 0.02 0.73 -0.01 2.12 4.20 -0.88 -0.38 115.11 120.90 1lq8 h GLN 71 Ca -0.35 -0.18 -0.00 0.00 0.06 0.00 0.00 58.65 58.18 1lq8 h GLN 71 Cb 2.04 -0.09 -0.00 0.00 0.30 0.00 0.00 27.48 29.72 1lq8 h GLN 71 CO 0.07 0.73 0.00 0.82 -0.67 0.00 0.00 178.83 179.78 1lq8 h ILE 72 N 0.69 1.24 -0.53 2.54 2.04 -1.69 0.43 117.51 122.23 1lq8 h ILE 72 Ca 0.14 -0.70 -0.04 0.00 1.00 0.00 0.00 64.86 65.26 1lq8 h ILE 72 Cb 0.40 1.69 -0.02 0.00 -0.74 0.00 0.00 36.82 38.15 1lq8 h ILE 72 CO 0.01 0.18 0.17 -0.07 0.00 0.00 0.00 178.15 178.45 1lq8 h LEU 73 N -0.27 0.76 0.07 1.44 4.07 -1.57 -1.37 115.31 118.44 1lq8 h LEU 73 Ca 0.00 -0.20 -0.00 0.00 0.08 0.00 0.00 57.88 57.76 1lq8 h LEU 73 Cb 0.30 -0.20 0.00 0.00 1.08 0.00 0.00 40.66 41.84 1lq8 h LEU 73 CO 0.00 0.76 -0.03 -0.33 -1.08 0.00 0.00 178.44 177.76 1lq8 h GLU 74 N 0.72 -0.09 -0.15 1.13 4.39 -1.01 -1.40 114.58 118.19 1lq8 h GLU 74 Ca 0.17 0.01 0.04 0.00 0.34 0.00 0.00 59.36 59.92 1lq8 h GLU 74 Cb 0.26 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.93 1lq8 h GLU 74 CO -0.01 0.07 0.20 0.78 -1.16 0.00 0.00 179.01 178.89 1lq8 h GLY 75 N -0.22 0.00 1.65 -3.84 0.00 0.05 0.49 103.07 101.20 1lq8 h GLY 75 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.32 1lq8 h GLY 75 CO 0.02 0.00 -0.31 1.41 0.00 0.00 0.00 176.54 177.65 1lq8 h LEU 76 N 0.00 0.00 -0.37 3.11 3.38 -0.64 -3.39 115.31 117.41 1lq8 h LEU 76 Ca 0.07 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1lq8 h LEU 76 Cb 0.46 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.21 1lq8 h LEU 76 CO -0.00 0.02 0.00 0.61 0.09 0.00 0.00 178.44 179.16 1lq8 n GLY 77 N 1.20 1.02 3.71 0.83 0.00 0.17 -4.41 105.19 107.71 1lq8 n GLY 77 Ca 0.03 -0.41 -0.42 0.00 0.00 0.00 0.00 46.02 45.22 1lq8 n GLY 77 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1lq8 s LEU 78 N -0.37 4.38 0.52 0.99 2.96 -0.58 -4.03 118.68 122.55 1lq8 s LEU 78 Ca 0.00 1.81 0.29 0.00 -0.22 0.00 0.00 54.13 56.01 1lq8 s LEU 78 Cb 0.00 -3.58 1.37 0.00 0.50 0.00 0.00 46.19 44.48 1lq8 s LEU 78 CO 0.00 -0.33 2.01 0.78 -1.32 0.00 0.00 176.35 177.49 1lq8 h ASN 79 N 6.70 0.00 0.00 3.68 -0.26 -1.90 -3.40 115.58 120.39 1lq8 h ASN 79 Ca -0.41 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.33 1lq8 h ASN 79 Cb 1.22 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.48 1lq8 h ASN 79 CO 0.77 0.12 0.00 0.18 -1.06 0.00 0.00 177.43 177.44 1lq8 n LEU 80 N -3.44 0.42 -3.15 1.61 7.99 -1.00 -4.65 117.00 114.79 1lq8 n LEU 80 Ca -0.01 0.00 0.05 0.00 -0.01 0.00 0.00 56.01 56.04 1lq8 n LEU 80 Cb 0.29 -0.90 -0.00 0.00 -0.11 0.00 0.00 43.42 42.69 1lq8 n LEU 80 CO 0.30 -0.21 0.44 -1.58 -1.51 0.00 0.00 177.39 174.83 1lq8 s GLN 81 N -0.42 0.24 0.00 3.23 2.00 -1.26 -4.88 119.66 118.57 1lq8 s GLN 81 Ca 0.00 0.29 0.00 0.00 -2.00 0.00 0.00 55.36 53.65 1lq8 s GLN 81 Cb 0.00 0.14 0.00 0.00 0.80 0.00 0.00 33.01 33.95 1lq8 s GLN 81 CO 0.00 -0.41 0.00 1.17 -0.50 0.00 0.00 175.29 175.55 1lq8 n LYS 82 N 5.25 0.00 -5.08 1.67 0.00 -1.26 -5.01 118.16 113.73 1lq8 n LYS 82 Ca 0.05 0.00 -0.32 0.00 0.00 0.00 0.00 58.31 58.04 1lq8 n LYS 82 Cb 0.56 0.00 -0.17 0.00 0.00 0.00 0.00 35.03 35.42 1lq8 n LYS 82 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.40 176.28 1lq8 s SER 83 N 0.00 3.12 -0.19 3.14 0.01 -1.26 -5.07 113.70 113.46 1lq8 s SER 83 Ca 0.00 -0.56 0.01 0.00 1.31 0.00 0.00 55.95 56.71 1lq8 s SER 83 Cb 0.00 -1.42 0.03 0.00 0.21 0.00 0.00 66.02 64.84 1lq8 s SER 83 CO 0.00 0.14 -0.15 -0.55 0.41 0.00 0.00 173.24 173.09 1lq8 s SER 84 N 0.45 3.26 0.00 2.44 0.15 -1.26 -2.39 113.70 116.36 1lq8 s SER 84 Ca -0.16 -0.77 0.00 0.00 0.70 0.00 0.00 55.95 55.72 1lq8 s SER 84 Cb -0.17 -1.36 0.00 0.00 -1.71 0.00 0.00 66.02 62.78 1lq8 s SER 84 CO 0.06 -0.07 0.00 1.21 1.20 0.00 0.00 173.24 175.64 1lq8 n GLU 85 N 4.65 0.00 0.16 5.44 2.13 -1.26 0.26 120.64 132.01 1lq8 n GLU 85 Ca -0.18 0.00 0.06 0.00 0.66 0.00 0.00 57.16 57.70 1lq8 n GLU 85 Cb 0.48 0.00 0.53 0.00 0.27 0.00 0.00 31.44 32.72 1lq8 n GLU 85 CO 0.00 0.00 0.00 0.87 -0.41 0.00 0.00 177.13 177.59 1lq8 h LYS 86 N 0.00 0.20 -0.18 5.31 1.57 -2.00 -0.86 116.57 120.62 1lq8 h LYS 86 Ca 0.00 -0.02 -0.07 0.00 -1.87 0.00 0.00 60.65 58.69 1lq8 h LYS 86 Cb 0.00 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.25 1lq8 h LYS 86 CO 0.00 0.17 -0.21 0.93 -0.57 0.00 0.00 179.45 179.78 1lq8 h GLU 87 N 0.20 0.31 -0.14 3.15 4.39 0.32 0.88 114.58 123.68 1lq8 h GLU 87 Ca 0.05 -0.09 -0.00 0.00 0.34 0.00 0.00 59.36 59.66 1lq8 h GLU 87 Cb 0.05 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.66 1lq8 h GLU 87 CO -0.01 0.51 0.07 1.25 -1.16 0.00 0.00 179.01 179.67 1lq8 h LEU 88 N 0.28 0.18 -0.36 1.33 6.46 -1.27 -1.02 115.31 120.91 1lq8 h LEU 88 Ca 0.05 -0.10 -0.11 0.00 -0.12 0.00 0.00 57.88 57.59 1lq8 h LEU 88 Cb 0.53 -0.05 -0.01 0.00 -0.73 0.00 0.00 40.66 40.40 1lq8 h LEU 88 CO 0.04 0.23 -0.22 0.45 -0.62 0.00 0.00 178.44 178.32 1lq8 h HIS 89 N 0.12 0.92 -0.61 1.25 3.86 -1.21 -2.50 115.15 116.98 1lq8 h HIS 89 Ca 0.05 -0.24 0.04 0.00 -1.16 0.00 0.00 60.37 59.06 1lq8 h HIS 89 Cb 0.09 -0.21 -0.03 0.00 1.06 0.00 0.00 27.41 28.32 1lq8 h HIS 89 CO -0.04 1.00 0.40 0.00 0.86 0.00 0.00 177.93 180.15 1lq8 h ARG 90 N 0.58 0.67 0.50 2.45 2.47 -0.70 0.17 114.38 120.53 1lq8 h ARG 90 Ca 0.08 -0.04 -0.02 0.00 -1.26 0.00 0.00 59.98 58.73 1lq8 h ARG 90 Cb 0.78 -0.15 0.00 0.00 -1.65 0.00 0.00 29.97 28.95 1lq8 h ARG 90 CO 0.06 0.44 -0.24 0.78 0.56 0.00 0.00 179.97 181.57 1lq8 h GLY 91 N 0.69 -0.71 1.41 0.04 0.00 -0.97 -0.09 103.07 103.45 1lq8 h GLY 91 Ca 0.25 0.26 0.01 0.00 0.00 0.00 0.00 47.33 47.85 1lq8 h GLY 91 CO -0.07 -0.26 0.39 0.74 0.00 0.00 0.00 176.54 177.34 1lq8 h PHE 92 N -0.92 0.73 -0.06 5.60 0.04 -1.13 -0.16 116.94 121.05 1lq8 h PHE 92 Ca -0.07 0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.72 1lq8 h PHE 92 Cb 0.60 -0.25 -0.00 0.00 2.20 0.00 0.00 35.95 38.50 1lq8 h PHE 92 CO 0.00 0.46 0.04 0.37 -0.60 0.00 0.00 178.31 178.58 1lq8 h GLN 93 N 0.79 0.08 -0.19 1.51 4.15 -0.52 0.09 115.11 121.02 1lq8 h GLN 93 Ca 0.22 -0.00 0.04 0.00 0.77 0.00 0.00 58.65 59.67 1lq8 h GLN 93 Cb -0.08 -0.02 -0.04 0.00 0.21 0.00 0.00 27.48 27.55 1lq8 h GLN 93 CO -0.05 0.06 -0.06 0.37 -1.93 0.00 0.00 178.83 177.22 1lq8 h GLN 94 N 0.08 -0.02 0.02 1.69 5.75 -0.17 -0.17 115.11 122.29 1lq8 h GLN 94 Ca 0.02 0.00 0.03 0.00 -0.15 0.00 0.00 58.65 58.55 1lq8 h GLN 94 Cb -0.01 0.00 -0.05 0.00 1.07 0.00 0.00 27.48 28.49 1lq8 h GLN 94 CO -0.00 -0.01 -0.43 1.25 -2.65 0.00 0.00 178.83 176.99 1lq8 h LEU 95 N -0.02 -1.29 -1.34 -2.39 5.85 -0.67 0.29 115.31 115.75 1lq8 h LEU 95 Ca 0.10 0.15 0.15 0.00 0.84 0.00 0.00 57.88 59.12 1lq8 h LEU 95 Cb 0.17 0.50 -0.07 0.00 0.37 0.00 0.00 40.66 41.63 1lq8 h LEU 95 CO -0.21 -0.47 0.57 -0.07 -0.34 0.00 0.00 178.44 177.92 1lq8 h LEU 96 N -0.59 0.61 -0.18 2.25 3.38 -0.58 -2.41 115.31 117.78 1lq8 h LEU 96 Ca 0.04 0.04 -0.22 0.00 0.09 0.00 0.00 57.88 57.83 1lq8 h LEU 96 Cb 0.66 -0.08 0.01 0.00 0.09 0.00 0.00 40.66 41.34 1lq8 h LEU 96 CO -0.31 0.30 -0.84 1.56 0.09 0.00 0.00 178.44 179.25 1lq8 h GLN 97 N 0.64 0.66 0.00 1.13 4.20 0.43 -3.17 115.11 119.00 1lq8 h GLN 97 Ca 0.44 -0.58 0.00 0.00 0.06 0.00 0.00 58.65 58.57 1lq8 h GLN 97 Cb 0.76 0.14 0.00 0.00 0.30 0.00 0.00 27.48 28.68 1lq8 h GLN 97 CO -0.19 1.19 0.00 0.39 -0.67 0.00 0.00 178.83 179.55 1lq8 n GLU 98 N -3.88 0.31 -2.22 1.46 1.02 0.89 -4.76 120.64 113.46 1lq8 n GLU 98 Ca -0.07 0.05 -0.41 0.00 -0.02 0.00 0.00 57.16 56.70 1lq8 n GLU 98 Cb 0.77 -1.50 -0.03 0.00 -0.02 0.00 0.00 31.44 30.66 1lq8 n GLU 98 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1lq8 s LEU 99 N -2.15 4.41 0.32 -4.62 1.43 -1.20 -5.03 118.68 111.84 1lq8 s LEU 99 Ca 0.16 2.37 0.08 0.00 -1.03 0.00 0.00 54.13 55.71 1lq8 s LEU 99 Cb 0.08 -3.61 -0.03 0.00 0.03 0.00 0.00 46.19 42.66 1lq8 s LEU 99 CO 0.14 -0.54 0.22 0.20 0.23 0.00 0.00 176.35 176.61 1lq8 s ASN 100 N 0.45 5.11 0.74 2.29 0.01 -1.26 -5.11 114.94 117.17 1lq8 s ASN 100 Ca 0.58 -0.55 -0.11 0.00 -0.71 0.00 0.00 52.86 52.07 1lq8 s ASN 100 Cb -0.36 -0.95 0.04 0.00 0.41 0.00 0.00 41.25 40.38 1lq8 s ASN 100 CO 0.37 -0.28 1.08 -1.10 -1.51 0.00 0.00 177.10 175.66 1lq8 s GLN 101 N -3.92 2.54 -0.89 -0.60 1.11 -1.26 -4.69 119.66 111.95 1lq8 s GLN 101 Ca 0.39 1.10 -0.19 0.00 0.01 0.00 0.00 55.36 56.67 1lq8 s GLN 101 Cb -0.05 -1.93 -0.24 0.00 -1.01 0.00 0.00 33.01 29.78 1lq8 s GLN 101 CO 0.25 -1.42 2.33 -2.30 0.01 0.00 0.00 175.29 174.16 1lq8 n PRO 102 N -3.32 0.27 0.00 2.91 -0.02 -1.26 -4.88 135.00 128.70 1lq8 n PRO 102 Ca 0.09 -0.29 0.00 0.00 -2.02 0.00 0.00 63.50 61.28 1lq8 n PRO 102 Cb 0.53 -2.16 0.00 0.00 -0.02 0.00 0.00 33.50 31.85 1lq8 n PRO 102 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 1lq8 n ARG 103 N 7.24 1.30 -3.43 -0.52 0.63 -0.74 -4.91 116.66 116.23 1lq8 n ARG 103 Ca 0.58 0.00 -0.43 0.00 -0.92 0.00 0.00 57.85 57.08 1lq8 n ARG 103 Cb 0.26 0.00 -0.09 0.00 0.45 0.00 0.00 32.46 33.07 1lq8 n ARG 103 CO 0.00 0.00 0.00 0.34 -2.51 0.00 0.00 177.63 175.46 1lq8 s ASP 104 N -1.85 6.13 -0.44 6.15 -1.08 -1.26 -4.23 116.67 120.08 1lq8 s ASP 104 Ca 0.00 -0.94 0.00 0.00 -0.52 0.00 0.00 52.55 51.09 1lq8 s ASP 104 Cb 0.00 -2.17 0.00 0.00 -1.46 0.00 0.00 42.92 39.29 1lq8 s ASP 104 CO 0.00 -0.50 0.00 0.61 0.52 0.00 0.00 175.17 175.80 1lq8 n GLY 105 N 5.16 0.48 3.64 2.66 0.00 -1.26 -5.00 105.19 110.87 1lq8 n GLY 105 Ca -0.11 -0.79 -0.07 0.00 0.00 0.00 0.00 46.02 45.06 1lq8 n GLY 105 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1lq8 s PHE 106 N -2.20 -0.77 -0.22 1.61 2.19 -1.26 -2.08 117.98 115.25 1lq8 s PHE 106 Ca 0.00 1.61 -0.13 0.00 0.33 0.00 0.00 56.93 58.74 1lq8 s PHE 106 Cb 0.00 0.45 0.07 0.00 -1.31 0.00 0.00 43.02 42.22 1lq8 s PHE 106 CO 0.00 -0.38 0.54 -1.14 1.83 0.00 0.00 175.22 176.08 1lq8 s GLN 107 N 1.15 0.55 -0.04 10.12 0.74 0.75 -1.80 119.66 131.14 1lq8 s GLN 107 Ca -0.06 0.97 -0.02 0.00 0.05 0.00 0.00 55.36 56.30 1lq8 s GLN 107 Cb -0.05 0.09 0.03 0.00 1.10 0.00 0.00 33.01 34.18 1lq8 s GLN 107 CO -0.13 -0.14 0.05 -1.17 -0.55 0.00 0.00 175.29 173.35 1lq8 s LEU 108 N 1.35 0.35 -0.01 3.68 2.96 -1.26 -1.48 118.68 124.27 1lq8 s LEU 108 Ca -0.09 0.07 0.03 0.00 -0.22 0.00 0.00 54.13 53.92 1lq8 s LEU 108 Cb -0.06 -0.13 -0.01 0.00 0.50 0.00 0.00 46.19 46.49 1lq8 s LEU 108 CO -0.14 -0.22 -0.09 -0.94 -1.32 0.00 0.00 176.35 173.64 1lq8 s SER 109 N 1.93 1.07 -0.06 3.68 1.04 -0.67 -4.56 113.70 116.12 1lq8 s SER 109 Ca 0.02 -0.16 0.01 0.00 0.48 0.00 0.00 55.95 56.30 1lq8 s SER 109 Cb -0.12 -0.12 0.02 0.00 0.10 0.00 0.00 66.02 65.89 1lq8 s SER 109 CO -0.03 0.11 -0.07 -0.76 0.98 0.00 0.00 173.24 173.47 1lq8 s LEU 110 N -0.20 1.38 0.05 2.42 2.01 -1.26 -1.67 118.68 121.41 1lq8 s LEU 110 Ca 0.03 -0.19 -0.01 0.00 0.01 0.00 0.00 54.13 53.98 1lq8 s LEU 110 Cb -0.04 -0.58 -0.04 0.00 0.01 0.00 0.00 46.19 45.54 1lq8 s LEU 110 CO -0.00 -0.04 -0.03 -0.83 1.01 0.00 0.00 176.35 176.46 1lq8 s GLY 111 N 0.93 0.49 0.03 -3.19 0.00 -1.13 -4.99 107.32 99.46 1lq8 s GLY 111 Ca -0.11 -1.22 0.04 0.00 0.00 0.00 0.00 44.72 43.43 1lq8 s GLY 111 CO 0.00 -1.33 -0.12 -1.31 0.00 0.00 0.00 173.10 170.35 1lq8 s ASN 112 N -2.93 1.39 -0.02 1.64 0.01 -1.26 -1.93 114.94 111.84 1lq8 s ASN 112 Ca 0.08 -0.39 -0.05 0.00 -0.71 0.00 0.00 52.86 51.79 1lq8 s ASN 112 Cb 0.08 -0.09 0.00 0.00 0.41 0.00 0.00 41.25 41.65 1lq8 s ASN 112 CO -0.10 0.02 0.11 0.00 -1.51 0.00 0.00 177.10 175.62 1lq8 s ALA 113 N -0.75 -0.25 -0.13 0.60 0.00 0.84 -0.94 121.76 121.13 1lq8 s ALA 113 Ca 0.01 0.08 0.00 0.00 0.00 0.00 0.00 51.96 52.05 1lq8 s ALA 113 Cb -0.07 -0.06 -0.01 0.00 0.00 0.00 0.00 23.12 22.98 1lq8 s ALA 113 CO 0.01 -0.12 -0.15 -0.51 0.00 0.00 0.00 175.76 174.99 1lq8 s LEU 114 N -0.57 2.57 -0.31 0.00 1.43 0.19 0.20 118.68 122.19 1lq8 s LEU 114 Ca -0.06 -0.40 0.01 0.00 -1.03 0.00 0.00 54.13 52.65 1lq8 s LEU 114 Cb -0.04 -1.57 0.07 0.00 0.03 0.00 0.00 46.19 44.68 1lq8 s LEU 114 CO 0.00 0.14 -0.00 -0.36 0.23 0.00 0.00 176.35 176.36 1lq8 s PHE 115 N 0.49 3.40 -0.13 0.29 0.40 -0.05 -0.45 117.98 121.93 1lq8 s PHE 115 Ca -0.10 -2.30 -0.04 0.00 -0.60 0.00 0.00 56.93 53.89 1lq8 s PHE 115 Cb -0.16 -2.33 -0.03 0.00 0.51 0.00 0.00 43.02 41.00 1lq8 s PHE 115 CO 0.05 -0.88 0.01 0.99 0.70 0.00 0.00 175.22 176.09 1lq8 s THR 116 N 1.12 4.35 0.78 0.64 2.01 -0.81 -1.05 115.64 122.69 1lq8 s THR 116 Ca -0.02 -0.21 -0.15 0.00 0.31 0.00 0.00 61.69 61.62 1lq8 s THR 116 Cb -0.20 -2.88 0.03 0.00 0.01 0.00 0.00 72.50 69.46 1lq8 s THR 116 CO -0.04 0.54 0.92 -0.67 -0.69 0.00 0.00 174.62 174.68 1lq8 n ASP 117 N 2.83 0.13 0.22 3.53 2.03 0.21 0.02 116.55 125.51 1lq8 n ASP 117 Ca -0.18 0.59 0.07 0.00 0.52 0.00 0.00 54.79 55.79 1lq8 n ASP 117 Cb 0.53 -1.39 0.52 0.00 -0.72 0.00 0.00 41.12 40.06 1lq8 n ASP 117 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 1lq8 h LEU 118 N -0.66 0.00 -3.82 -2.67 4.07 -1.74 -3.25 115.31 107.24 1lq8 h LEU 118 Ca -0.46 0.00 -0.58 0.00 0.08 0.00 0.00 57.88 56.91 1lq8 h LEU 118 Cb 1.32 0.00 -0.39 0.00 1.08 0.00 0.00 40.66 42.67 1lq8 h LEU 118 CO 0.44 0.23 -0.33 0.52 -1.08 0.00 0.00 178.44 178.23 1lq8 n VAL 119 N -3.93 2.85 -3.95 1.22 0.31 -1.26 -4.98 118.33 108.59 1lq8 n VAL 119 Ca -0.02 -3.84 -0.10 0.00 -0.01 0.00 0.00 64.34 60.38 1lq8 n VAL 119 Cb 0.32 -1.14 -0.12 0.00 -0.91 0.00 0.00 33.84 31.99 1lq8 n VAL 119 CO 0.00 0.00 0.00 0.68 -1.32 0.00 0.00 176.83 176.19 1lq8 s VAL 120 N -4.65 0.09 -0.05 2.52 -7.23 -1.23 -5.16 120.40 104.69 1lq8 s VAL 120 Ca 0.55 -0.71 0.04 0.00 -1.81 0.00 0.00 61.98 60.06 1lq8 s VAL 120 Cb 0.44 -0.22 -0.02 0.00 0.56 0.00 0.00 36.38 37.13 1lq8 s VAL 120 CO 0.03 -0.39 -0.16 -1.81 -0.31 0.00 0.00 175.10 172.45 1lq8 s ASP 121 N -1.15 3.85 0.08 4.85 1.01 -1.26 -4.81 116.67 119.25 1lq8 s ASP 121 Ca -0.13 -0.25 0.04 0.00 0.71 0.00 0.00 52.55 52.92 1lq8 s ASP 121 Cb -0.08 -0.77 -0.04 0.00 1.01 0.00 0.00 42.92 43.04 1lq8 s ASP 121 CO -0.01 0.34 0.05 -0.76 0.21 0.00 0.00 175.17 175.00 1lq8 s LEU 122 N -0.69 3.68 0.35 1.23 1.43 -1.26 -4.37 118.68 119.06 1lq8 s LEU 122 Ca 0.11 -0.07 -0.29 0.00 -1.03 0.00 0.00 54.13 52.85 1lq8 s LEU 122 Cb -0.11 -2.38 -0.11 0.00 0.03 0.00 0.00 46.19 43.62 1lq8 s LEU 122 CO 0.00 0.17 1.49 0.00 0.23 0.00 0.00 176.35 178.25 1lq8 n GLN 123 N 0.50 2.61 -0.28 1.70 1.13 -0.05 -4.87 117.38 118.11 1lq8 n GLN 123 Ca -0.09 0.92 0.04 0.00 -1.94 0.00 0.00 57.00 55.93 1lq8 n GLN 123 Cb 0.52 -2.65 0.18 0.00 0.11 0.00 0.00 30.24 28.40 1lq8 n GLN 123 CO 0.00 0.00 0.00 -0.44 -1.44 0.00 0.00 177.06 175.18 1lq8 h ASP 124 N 3.40 0.55 0.03 1.08 3.32 -1.92 -2.23 116.42 120.65 1lq8 h ASP 124 Ca -0.49 0.07 0.01 0.00 0.02 0.00 0.00 57.03 56.64 1lq8 h ASP 124 Cb 1.24 -0.03 -0.02 0.00 0.22 0.00 0.00 39.33 40.75 1lq8 h ASP 124 CO 0.68 0.28 -0.09 0.71 -1.72 0.00 0.00 179.24 179.11 1lq8 h THR 125 N 0.67 0.79 0.13 0.35 1.35 -1.90 0.19 112.91 114.49 1lq8 h THR 125 Ca 0.41 0.00 0.02 0.00 -0.55 0.00 0.00 66.41 66.29 1lq8 h THR 125 Cb 0.48 0.79 -0.04 0.00 -1.73 0.00 0.00 68.15 67.65 1lq8 h THR 125 CO -0.30 0.00 -0.29 0.15 -0.25 0.00 0.00 175.52 174.83 1lq8 h PHE 126 N -0.16 -0.79 -0.53 4.73 3.57 -1.59 0.10 116.94 122.27 1lq8 h PHE 126 Ca 0.02 0.02 0.06 0.00 3.53 0.00 0.00 57.97 61.60 1lq8 h PHE 126 Cb 0.19 0.33 -0.05 0.00 2.79 0.00 0.00 35.95 39.21 1lq8 h PHE 126 CO -0.14 -0.40 0.25 0.28 -2.23 0.00 0.00 178.31 176.07 1lq8 h VAL 127 N -0.52 0.91 0.35 1.41 2.07 -1.30 -0.94 116.25 118.24 1lq8 h VAL 127 Ca 0.03 -0.17 -0.02 0.00 0.82 0.00 0.00 66.70 67.37 1lq8 h VAL 127 Cb 0.54 0.39 0.00 0.00 -1.52 0.00 0.00 31.29 30.70 1lq8 h VAL 127 CO -0.16 0.09 -0.17 -1.28 0.02 0.00 0.00 177.57 176.07 1lq8 h SER 128 N 0.48 -0.40 -0.92 0.57 0.87 -0.17 -1.70 113.55 112.28 1lq8 h SER 128 Ca 0.24 -0.00 0.05 0.00 -1.23 0.00 0.00 61.79 60.85 1lq8 h SER 128 Cb 0.19 0.10 -0.06 0.00 -0.44 0.00 0.00 62.40 62.19 1lq8 h SER 128 CO -0.19 -0.26 0.59 0.00 -0.53 0.00 0.00 176.83 176.44 1lq8 h ALA 129 N 0.14 1.25 -0.74 6.23 0.00 -0.61 0.48 119.26 126.02 1lq8 h ALA 129 Ca -0.05 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1lq8 h ALA 129 Cb 0.38 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 17.84 1lq8 h ALA 129 CO 0.08 0.40 0.47 0.52 0.00 0.00 0.00 179.25 180.73 1lq8 h MET 130 N 1.11 0.98 -0.11 0.00 2.86 -0.98 0.81 114.93 119.60 1lq8 h MET 130 Ca 0.39 -0.07 -0.18 0.00 -2.06 0.00 0.00 59.70 57.78 1lq8 h MET 130 Cb 0.10 -0.22 0.01 0.00 0.06 0.00 0.00 31.60 31.55 1lq8 h MET 130 CO -0.15 0.66 -0.62 0.87 1.06 0.00 0.00 176.91 178.74 1lq8 h LYS 131 N 1.00 0.61 0.16 1.72 1.57 -0.68 -1.73 116.57 119.23 1lq8 h LYS 131 Ca 0.27 -0.51 -0.01 0.00 -1.87 0.00 0.00 60.65 58.53 1lq8 h LYS 131 Cb -0.09 0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.33 1lq8 h LYS 131 CO -0.06 1.13 -0.08 1.15 -0.57 0.00 0.00 179.45 181.03 1lq8 h THR 132 N 0.25 0.16 -0.02 -0.16 2.02 -0.79 -2.14 112.91 112.25 1lq8 h THR 132 Ca -0.05 -0.93 -0.15 0.00 0.77 0.00 0.00 66.41 66.05 1lq8 h THR 132 Cb 1.26 0.29 -0.02 0.00 -1.74 0.00 0.00 68.15 67.94 1lq8 h THR 132 CO 0.13 0.05 -0.68 -0.07 0.37 0.00 0.00 175.52 175.31 1lq8 h LEU 133 N -1.04 0.09 -1.78 2.58 -0.00 -1.04 -3.35 115.31 110.77 1lq8 h LEU 133 Ca -0.02 -0.06 0.00 0.00 -0.00 0.00 0.00 57.88 57.80 1lq8 h LEU 133 Cb 0.25 -0.03 0.00 0.00 -0.00 0.00 0.00 40.66 40.88 1lq8 h LEU 133 CO 0.04 0.75 0.00 -1.22 -0.00 0.00 0.00 178.44 178.00 1lq8 n TYR 134 N -3.76 0.08 -4.03 1.13 4.02 -1.02 -3.89 117.16 109.70 1lq8 n TYR 134 Ca -0.02 -0.16 -0.33 0.00 -0.01 0.00 0.00 57.90 57.39 1lq8 n TYR 134 Cb 0.67 -0.01 0.01 0.00 -0.02 0.00 0.00 39.34 39.99 1lq8 n TYR 134 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 1lq8 n LEU 135 N 0.27 -2.25 -4.74 7.72 4.32 -0.80 -4.43 117.00 117.09 1lq8 n LEU 135 Ca 0.05 -0.86 -0.41 0.00 -0.02 0.00 0.00 56.01 54.77 1lq8 n LEU 135 Cb 0.22 -2.39 -0.04 0.00 -1.62 0.00 0.00 43.42 39.58 1lq8 n LEU 135 CO 0.04 0.41 0.73 0.00 -1.22 0.00 0.00 177.39 177.35 1lq8 s ALA 136 N -3.29 3.32 0.50 -1.18 0.00 -0.68 -4.55 121.76 115.87 1lq8 s ALA 136 Ca 0.70 0.70 -0.17 0.00 0.00 0.00 0.00 51.96 53.19 1lq8 s ALA 136 Cb -0.36 -3.31 -0.08 0.00 0.00 0.00 0.00 23.12 19.36 1lq8 s ALA 136 CO 0.87 -0.10 0.97 -0.51 0.00 0.00 0.00 175.76 176.99 1lq8 s ASP 137 N -0.16 6.67 -0.13 0.00 1.01 -0.12 -4.59 116.67 119.35 1lq8 s ASP 137 Ca 0.48 1.57 -0.01 0.00 0.71 0.00 0.00 52.55 55.30 1lq8 s ASP 137 Cb -0.27 -2.51 0.04 0.00 1.01 0.00 0.00 42.92 41.19 1lq8 s ASP 137 CO 0.33 -0.54 -0.03 0.42 0.21 0.00 0.00 175.17 175.56 1lq8 s THR 138 N -2.54 0.78 -0.13 -1.27 -4.23 -1.26 0.54 115.64 107.55 1lq8 s THR 138 Ca 0.59 -0.33 0.03 0.00 -1.18 0.00 0.00 61.69 60.80 1lq8 s THR 138 Cb -0.10 -0.98 0.01 0.00 1.34 0.00 0.00 72.50 72.77 1lq8 s THR 138 CO 0.28 0.16 -0.22 -0.36 -0.54 0.00 0.00 174.62 173.94 1lq8 s PHE 139 N 1.78 2.57 0.27 3.99 0.08 0.40 -4.97 117.98 122.10 1lq8 s PHE 139 Ca 0.03 -1.22 -0.29 0.00 0.12 0.00 0.00 56.93 55.56 1lq8 s PHE 139 Cb -0.14 -1.75 -0.10 0.00 -0.57 0.00 0.00 43.02 40.47 1lq8 s PHE 139 CO -0.07 -0.55 1.28 -1.25 -0.10 0.00 0.00 175.22 174.53 1lq8 s PRO 140 N 0.69 4.41 -0.02 0.24 0.04 -1.26 -1.92 135.00 137.18 1lq8 s PRO 140 Ca -0.10 2.10 0.02 0.00 0.04 0.00 0.00 61.00 63.05 1lq8 s PRO 140 Cb -0.16 -3.14 0.01 0.00 0.04 0.00 0.00 34.50 31.25 1lq8 s PRO 140 CO 0.01 -0.16 -0.06 0.99 0.04 0.00 0.00 177.00 177.83 1lq8 s THR 141 N -0.63 0.51 -0.85 1.26 2.01 0.10 -4.84 115.64 113.21 1lq8 s THR 141 Ca 0.52 -0.21 -0.19 0.00 0.31 0.00 0.00 61.69 62.12 1lq8 s THR 141 Cb -0.37 -0.48 0.13 0.00 0.01 0.00 0.00 72.50 71.79 1lq8 s THR 141 CO 0.45 0.18 1.02 0.21 -0.69 0.00 0.00 174.62 175.79 1lq8 s ASN 142 N 0.28 6.54 0.00 3.53 2.47 -1.26 -2.00 114.94 124.50 1lq8 s ASN 142 Ca -0.03 -1.91 0.24 0.00 0.42 0.00 0.00 52.86 51.57 1lq8 s ASN 142 Cb -0.08 -2.37 1.22 0.00 -1.45 0.00 0.00 41.25 38.57 1lq8 s ASN 142 CO -0.00 -1.07 1.80 0.49 -3.72 0.00 0.00 177.10 174.60 1lq8 n PHE 143 N 6.40 0.00 0.28 0.43 3.72 -1.26 -2.77 117.46 124.26 1lq8 n PHE 143 Ca 0.16 0.00 0.17 0.00 -0.05 0.00 0.00 57.45 57.73 1lq8 n PHE 143 Cb 0.48 -0.28 0.67 0.00 -0.94 0.00 0.00 39.48 39.40 1lq8 n PHE 143 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1lq8 h ARG 144 N 0.00 0.00 -3.57 -1.08 -0.00 -1.87 -3.31 114.38 104.55 1lq8 h ARG 144 Ca 0.00 0.00 -0.71 0.00 -0.50 0.00 0.00 59.98 58.77 1lq8 h ARG 144 Cb 0.22 0.00 -0.34 0.00 0.00 0.00 0.00 29.97 29.85 1lq8 h ARG 144 CO 0.00 0.00 -0.26 0.34 0.00 0.00 0.00 179.97 180.05 1lq8 s ASP 145 N -5.71 5.53 0.17 7.04 2.15 -1.11 -4.97 116.67 119.77 1lq8 s ASP 145 Ca 0.01 -2.94 -0.15 0.00 0.43 0.00 0.00 52.55 49.90 1lq8 s ASP 145 Cb 0.09 -1.91 0.12 0.00 -0.30 0.00 0.00 42.92 40.91 1lq8 s ASP 145 CO 0.55 -0.38 1.71 0.28 -0.17 0.00 0.00 175.17 177.16 1lq8 h SER 146 N 7.01 -0.10 -0.34 -0.34 0.02 -1.81 -1.69 113.55 116.29 1lq8 h SER 146 Ca 0.02 0.09 0.04 0.00 -0.84 0.00 0.00 61.79 61.10 1lq8 h SER 146 Cb 0.95 0.14 -0.04 0.00 0.14 0.00 0.00 62.40 63.59 1lq8 h SER 146 CO 0.73 -0.02 0.09 0.00 -1.14 0.00 0.00 176.83 176.50 1lq8 h ALA 147 N 1.34 0.38 -0.40 3.77 0.00 -1.93 -1.81 119.26 120.61 1lq8 h ALA 147 Ca 0.20 0.05 -0.05 0.00 0.00 0.00 0.00 54.91 55.12 1lq8 h ALA 147 Cb 0.27 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 1lq8 h ALA 147 CO -0.31 -0.31 0.04 0.78 0.00 0.00 0.00 179.25 179.46 1lq8 h GLY 148 N 0.22 0.66 0.93 0.00 0.00 -1.83 -1.69 103.07 101.36 1lq8 h GLY 148 Ca 0.16 -0.38 -0.05 0.00 0.00 0.00 0.00 47.33 47.05 1lq8 h GLY 148 CO -0.19 0.36 0.04 0.00 0.00 0.00 0.00 176.54 176.75 1lq8 h ALA 149 N 1.46 0.52 -0.47 3.60 0.00 -0.86 -1.42 119.26 122.09 1lq8 h ALA 149 Ca 0.13 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 1lq8 h ALA 149 Cb 0.31 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1lq8 h ALA 149 CO 0.01 0.25 0.23 0.52 0.00 0.00 0.00 179.25 180.25 1lq8 h MET 150 N 0.49 0.67 -0.02 0.00 2.86 -1.07 -1.30 114.93 116.56 1lq8 h MET 150 Ca 0.11 -0.10 0.00 0.00 -2.06 0.00 0.00 59.70 57.66 1lq8 h MET 150 Cb 0.40 -0.12 -0.00 0.00 0.06 0.00 0.00 31.60 31.94 1lq8 h MET 150 CO 0.01 0.56 0.01 -0.22 1.06 0.00 0.00 176.91 178.33 1lq8 h LYS 151 N 0.61 0.02 -0.19 1.72 3.64 -1.20 0.34 116.57 121.52 1lq8 h LYS 151 Ca 0.16 -0.00 0.05 0.00 -1.27 0.00 0.00 60.65 59.58 1lq8 h LYS 151 Cb 0.11 -0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 31.88 1lq8 h LYS 151 CO -0.02 0.04 -0.10 0.37 -2.27 0.00 0.00 179.45 177.47 1lq8 h GLN 152 N 0.00 -0.08 0.13 1.90 4.15 -1.08 0.80 115.11 120.93 1lq8 h GLN 152 Ca 0.01 0.01 -0.01 0.00 0.77 0.00 0.00 58.65 59.43 1lq8 h GLN 152 Cb 0.02 0.02 0.00 0.00 0.21 0.00 0.00 27.48 27.73 1lq8 h GLN 152 CO -0.00 -0.05 -0.06 0.82 -1.93 0.00 0.00 178.83 177.60 1lq8 h ILE 153 N -0.08 1.05 -0.77 2.39 2.04 -1.10 -2.48 117.51 118.57 1lq8 h ILE 153 Ca 0.11 -0.95 0.04 0.00 1.00 0.00 0.00 64.86 65.05 1lq8 h ILE 153 Cb 0.24 1.63 -0.04 0.00 -0.74 0.00 0.00 36.82 37.91 1lq8 h ILE 153 CO -0.24 0.22 0.50 0.78 0.00 0.00 0.00 178.15 179.41 1lq8 h ASN 154 N -0.64 0.79 -0.43 1.72 2.35 -0.28 -0.02 115.58 119.08 1lq8 h ASN 154 Ca -0.02 -0.01 -0.06 0.00 -0.55 0.00 0.00 56.30 55.66 1lq8 h ASN 154 Cb 0.49 -0.18 -0.02 0.00 0.05 0.00 0.00 38.32 38.66 1lq8 h ASN 154 CO 0.03 0.54 0.05 0.44 -1.65 0.00 0.00 177.43 176.84 1lq8 h ASP 155 N 0.92 0.76 -0.02 5.81 3.32 -0.84 0.10 116.42 126.47 1lq8 h ASP 155 Ca 0.31 -0.16 -0.00 0.00 0.02 0.00 0.00 57.03 57.19 1lq8 h ASP 155 Cb 0.08 -0.20 -0.00 0.00 0.22 0.00 0.00 39.33 39.43 1lq8 h ASP 155 CO -0.09 0.79 -0.01 0.22 -1.72 0.00 0.00 179.24 178.44 1lq8 h TYR 156 N 0.76 0.05 -0.60 4.55 3.20 -0.70 0.13 116.97 124.35 1lq8 h TYR 156 Ca 0.16 -0.01 0.01 0.00 3.14 0.00 0.00 58.73 62.02 1lq8 h TYR 156 Cb 0.38 -0.01 -0.03 0.00 1.54 0.00 0.00 36.73 38.61 1lq8 h TYR 156 CO 0.02 0.40 0.40 0.28 -1.64 0.00 0.00 178.16 177.62 1lq8 h VAL 157 N -0.32 1.16 0.35 1.81 2.07 -0.87 0.97 116.25 121.41 1lq8 h VAL 157 Ca 0.01 -0.29 -0.01 0.00 0.82 0.00 0.00 66.70 67.23 1lq8 h VAL 157 Cb 0.39 0.27 -0.00 0.00 -1.52 0.00 0.00 31.29 30.42 1lq8 h VAL 157 CO 0.00 0.15 -0.19 0.00 0.02 0.00 0.00 177.57 177.55 1lq8 h ALA 158 N 1.22 -0.50 -0.43 1.67 0.00 -0.71 -1.55 119.26 118.96 1lq8 h ALA 158 Ca 0.22 -0.10 0.09 0.00 0.00 0.00 0.00 54.91 55.12 1lq8 h ALA 158 Cb -0.09 0.22 -0.09 0.00 0.00 0.00 0.00 17.79 17.83 1lq8 h ALA 158 CO -0.05 -0.79 -0.15 -0.22 0.00 0.00 0.00 179.25 178.05 1lq8 h LYS 159 N -0.51 -0.05 0.00 0.00 3.64 -0.29 0.83 116.57 120.20 1lq8 h LYS 159 Ca -0.04 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.32 1lq8 h LYS 159 Cb 0.40 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.23 1lq8 h LYS 159 CO 0.06 -0.03 -0.10 1.96 -2.27 0.00 0.00 179.45 179.07 1lq8 h GLN 160 N -0.05 0.00 -0.66 1.90 1.08 -0.57 -2.49 115.11 114.33 1lq8 h GLN 160 Ca 0.21 0.00 -0.33 0.00 -1.45 0.00 0.00 58.65 57.08 1lq8 h GLN 160 Cb 0.37 0.00 -0.20 0.00 -0.05 0.00 0.00 27.48 27.60 1lq8 h GLN 160 CO -0.47 0.10 0.26 0.25 -0.95 0.00 0.00 178.83 178.02 1lq8 n THR 161 N -3.55 2.86 -4.35 -0.54 -2.24 -0.61 -4.74 114.28 101.11 1lq8 n THR 161 Ca -0.02 -2.32 -0.36 0.00 -2.27 0.00 0.00 64.05 59.08 1lq8 n THR 161 Cb 0.23 -0.39 -0.07 0.00 -2.10 0.00 0.00 70.33 68.00 1lq8 n THR 161 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1lq8 n LYS 162 N -1.09 -1.51 -1.04 -0.78 4.01 -0.94 -0.25 118.16 116.57 1lq8 n LYS 162 Ca 0.45 0.19 -0.01 0.00 -0.51 0.00 0.00 58.31 58.44 1lq8 n LYS 162 Cb 1.34 -4.40 -0.01 0.00 -0.51 0.00 0.00 35.03 31.45 1lq8 n LYS 162 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1lq8 n GLY 163 N -1.72 0.48 0.08 0.72 0.00 0.20 -4.92 105.19 100.03 1lq8 n GLY 163 Ca -0.08 -0.22 -0.10 0.00 0.00 0.00 0.00 46.02 45.62 1lq8 n GLY 163 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1lq8 h LYS 164 N 0.57 0.05 -4.62 1.61 1.79 -0.83 -3.42 116.57 111.72 1lq8 h LYS 164 Ca -0.03 -0.08 -0.68 0.00 -2.18 0.00 0.00 60.65 57.68 1lq8 h LYS 164 Cb 0.25 0.03 -0.36 0.00 -1.58 0.00 0.00 32.23 30.57 1lq8 h LYS 164 CO 0.04 0.76 -0.64 0.42 -1.08 0.00 0.00 179.45 178.94 1lq8 s ILE 165 N -2.63 2.87 -0.16 1.86 1.09 -1.26 -4.90 121.20 118.07 1lq8 s ILE 165 Ca -0.04 -1.99 -0.16 0.00 -1.10 0.00 0.00 60.65 57.37 1lq8 s ILE 165 Cb 0.08 -2.93 -0.12 0.00 -1.06 0.00 0.00 42.46 38.43 1lq8 s ILE 165 CO 0.83 -0.51 0.16 -0.37 -0.10 0.00 0.00 174.94 174.94 1lq8 h VAL 166 N 6.48 0.64 -2.77 2.92 -1.51 -1.90 -3.10 116.25 117.01 1lq8 h VAL 166 Ca -0.12 -1.65 -0.64 0.00 -1.23 0.00 0.00 66.70 63.06 1lq8 h VAL 166 Cb 1.04 1.39 -0.40 0.00 -2.13 0.00 0.00 31.29 31.19 1lq8 h VAL 166 CO 0.60 0.22 -0.42 0.47 -1.23 0.00 0.00 177.57 177.21 1lq8 n ASP 167 N -4.58 3.71 0.14 4.19 10.43 -1.26 -4.69 116.55 124.48 1lq8 n ASP 167 Ca -0.15 -3.30 -0.13 0.00 2.57 0.00 0.00 54.79 53.77 1lq8 n ASP 167 Cb 0.40 -0.80 -0.06 0.00 1.84 0.00 0.00 41.12 42.50 1lq8 n ASP 167 CO 0.00 0.00 0.00 0.25 -1.07 0.00 0.00 177.20 176.38 1lq8 h LEU 168 N 5.02 -0.45 -9.62 0.64 5.85 -1.89 -3.42 115.31 111.43 1lq8 h LEU 168 Ca 0.17 0.04 -0.65 0.00 0.84 0.00 0.00 57.88 58.29 1lq8 h LEU 168 Cb 0.72 0.15 -0.07 0.00 0.37 0.00 0.00 40.66 41.83 1lq8 h LEU 168 CO 0.82 -0.26 -0.39 -0.76 -0.34 0.00 0.00 178.44 177.51 1lq8 s LEU 169 N -10.22 4.40 -0.17 2.25 2.01 -1.26 -4.96 118.68 110.73 1lq8 s LEU 169 Ca -0.15 0.60 -0.14 0.00 0.01 0.00 0.00 54.13 54.46 1lq8 s LEU 169 Cb 0.06 -2.23 -0.07 0.00 0.01 0.00 0.00 46.19 43.96 1lq8 s LEU 169 CO 0.65 0.36 -0.29 0.29 1.01 0.00 0.00 176.35 178.37 1lq8 n LYS 170 N 2.07 0.46 -3.42 1.70 4.01 -1.26 -4.87 118.16 116.85 1lq8 n LYS 170 Ca -0.18 0.19 -0.26 0.00 -0.51 0.00 0.00 58.31 57.55 1lq8 n LYS 170 Cb 0.54 -1.29 -0.09 0.00 -0.51 0.00 0.00 35.03 33.68 1lq8 n LYS 170 CO 0.00 0.00 0.00 0.09 -1.11 0.00 0.00 177.40 176.38 1lq8 n ASN 171 N -4.20 1.24 -4.69 4.39 4.13 -1.26 -5.08 115.26 109.78 1lq8 n ASN 171 Ca -0.24 -2.85 -0.51 0.00 1.68 0.00 0.00 54.58 52.65 1lq8 n ASN 171 Cb 0.58 -0.64 -0.06 0.00 -1.54 0.00 0.00 39.78 38.12 1lq8 n ASN 171 CO 0.00 0.00 0.00 -0.11 0.28 0.00 0.00 177.26 177.43 1lq8 n LEU 172 N 1.78 3.09 -4.35 3.41 7.94 -1.26 -4.91 117.00 122.69 1lq8 n LEU 172 Ca 0.25 1.00 -0.32 0.00 -1.11 0.00 0.00 56.01 55.83 1lq8 n LEU 172 Cb 0.46 -1.29 0.18 0.00 0.53 0.00 0.00 43.42 43.30 1lq8 n LEU 172 CO 0.22 -0.18 -0.20 -0.67 -1.11 0.00 0.00 177.39 175.44 1lq8 n ASP 173 N 6.32 -2.10 0.06 1.96 2.03 -1.26 -4.90 116.55 118.66 1lq8 n ASP 173 Ca 0.24 -0.05 0.03 0.00 0.52 0.00 0.00 54.79 55.54 1lq8 n ASP 173 Cb 0.24 -1.08 -0.05 0.00 -0.72 0.00 0.00 41.12 39.51 1lq8 n ASP 173 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 1lq8 h SER 174 N -2.13 0.00 -0.00 1.67 0.02 -1.91 -3.28 113.55 107.92 1lq8 h SER 174 Ca -0.54 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.41 1lq8 h SER 174 Cb 1.34 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.88 1lq8 h SER 174 CO 0.40 0.44 0.00 0.59 -1.14 0.00 0.00 176.83 177.12 1lq8 n ASN 175 N -2.88 0.15 -4.68 3.07 3.02 -1.26 -4.80 115.26 107.88 1lq8 n ASN 175 Ca -0.06 -1.10 -0.43 0.00 -0.03 0.00 0.00 54.58 52.97 1lq8 n ASN 175 Cb 0.76 -0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.90 1lq8 n ASN 175 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1lq8 n ALA 176 N -0.86 1.89 0.00 5.41 0.00 -1.24 -1.86 120.51 123.85 1lq8 n ALA 176 Ca 0.22 0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.94 1lq8 n ALA 176 Cb 0.13 -2.62 0.00 0.00 0.00 0.00 0.00 19.45 16.96 1lq8 n ALA 176 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1lq8 n VAL 177 N 5.02 0.00 -3.64 0.00 0.24 -0.75 -4.69 118.33 114.51 1lq8 n VAL 177 Ca 0.19 -0.43 -0.08 0.00 -2.04 0.00 0.00 64.34 61.99 1lq8 n VAL 177 Cb 0.38 0.98 -0.07 0.00 -1.47 0.00 0.00 33.84 33.66 1lq8 n VAL 177 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1lq8 s VAL 178 N -0.92 0.00 -0.08 3.34 0.11 -1.19 -0.62 120.40 121.03 1lq8 s VAL 178 Ca 0.00 0.00 0.01 0.00 -2.93 0.00 0.00 61.98 59.06 1lq8 s VAL 178 Cb 0.00 -1.00 0.02 0.00 -1.53 0.00 0.00 36.38 33.87 1lq8 s VAL 178 CO 0.00 0.00 -0.08 -0.63 -3.33 0.00 0.00 175.10 171.06 1lq8 s ILE 179 N 0.35 0.93 -0.25 7.04 1.01 -0.21 -0.99 121.20 129.09 1lq8 s ILE 179 Ca 0.02 -0.29 -0.11 0.00 0.00 0.00 0.00 60.65 60.27 1lq8 s ILE 179 Cb -0.05 -0.93 -0.05 0.00 0.01 0.00 0.00 42.46 41.45 1lq8 s ILE 179 CO -0.08 0.33 0.16 -0.32 0.00 0.00 0.00 174.94 175.03 1lq8 s MET 180 N 1.26 4.05 0.03 2.79 -2.45 -0.12 -0.87 119.30 123.99 1lq8 s MET 180 Ca -0.04 -0.28 0.08 0.00 -1.25 0.00 0.00 55.69 54.20 1lq8 s MET 180 Cb -0.14 -3.56 -0.03 0.00 1.25 0.00 0.00 34.83 32.36 1lq8 s MET 180 CO -0.03 0.02 -0.22 0.08 1.05 0.00 0.00 175.02 175.93 1lq8 s VAL 181 N 1.18 2.50 -0.02 10.11 1.01 0.13 -0.13 120.40 135.18 1lq8 s VAL 181 Ca 0.07 -1.20 0.02 0.00 0.00 0.00 0.00 61.98 60.87 1lq8 s VAL 181 Cb -0.14 -2.00 0.00 0.00 0.00 0.00 0.00 36.38 34.25 1lq8 s VAL 181 CO 0.06 0.40 -0.07 0.21 0.00 0.00 0.00 175.10 175.70 1lq8 s ASN 182 N -1.19 0.98 0.13 3.32 3.84 -0.26 -0.11 114.94 121.65 1lq8 s ASN 182 Ca 0.13 -0.15 0.04 0.00 0.21 0.00 0.00 52.86 53.09 1lq8 s ASN 182 Cb -0.10 -0.23 -0.04 0.00 -0.55 0.00 0.00 41.25 40.33 1lq8 s ASN 182 CO 0.03 0.06 -0.10 -0.72 -2.79 0.00 0.00 177.10 173.58 1lq8 s TYR 183 N 0.14 1.20 -0.07 0.43 -0.85 -0.81 -0.44 117.35 116.94 1lq8 s TYR 183 Ca -0.02 -0.74 -0.03 0.00 -0.52 0.00 0.00 57.07 55.76 1lq8 s TYR 183 Cb -0.07 -0.62 0.04 0.00 0.38 0.00 0.00 41.96 41.69 1lq8 s TYR 183 CO 0.00 0.05 0.16 -1.50 -1.52 0.00 0.00 175.55 172.74 1lq8 s ILE 184 N -3.14 -0.06 -0.05 -3.49 2.07 0.75 -2.84 121.20 114.45 1lq8 s ILE 184 Ca 0.14 0.19 0.04 0.00 -1.41 0.00 0.00 60.65 59.60 1lq8 s ILE 184 Cb 0.01 -0.26 0.00 0.00 0.13 0.00 0.00 42.46 42.35 1lq8 s ILE 184 CO 0.00 0.08 -0.15 0.12 -1.91 0.00 0.00 174.94 173.07 1lq8 s PHE 185 N 1.25 1.58 -0.06 3.50 5.36 -0.67 -1.38 117.98 127.55 1lq8 s PHE 185 Ca -0.09 -0.48 -0.03 0.00 -0.96 0.00 0.00 56.93 55.38 1lq8 s PHE 185 Cb -0.12 -1.08 0.04 0.00 -0.34 0.00 0.00 43.02 41.52 1lq8 s PHE 185 CO -0.06 -0.18 0.12 0.12 -1.46 0.00 0.00 175.22 173.76 1lq8 s PHE 186 N 0.17 -0.11 -0.02 10.12 2.19 0.27 -1.67 117.98 128.94 1lq8 s PHE 186 Ca -0.06 0.45 0.00 0.00 0.33 0.00 0.00 56.93 57.66 1lq8 s PHE 186 Cb -0.12 -0.24 0.02 0.00 -1.31 0.00 0.00 43.02 41.37 1lq8 s PHE 186 CO 0.02 -0.20 0.01 0.21 1.83 0.00 0.00 175.22 177.09 1lq8 s LYS 187 N 1.78 0.14 -0.19 10.12 2.20 -0.55 0.56 119.74 133.80 1lq8 s LYS 187 Ca -0.02 0.10 -0.26 0.00 -0.36 0.00 0.00 55.97 55.43 1lq8 s LYS 187 Cb -0.12 -0.33 0.07 0.00 -1.51 0.00 0.00 37.83 35.94 1lq8 s LYS 187 CO -0.05 -0.12 0.68 0.00 -0.36 0.00 0.00 175.35 175.50 1lq8 s ALA 188 N 0.86 -1.70 0.33 3.13 0.00 -0.76 -0.18 121.76 123.44 1lq8 s ALA 188 Ca -0.08 1.71 -0.10 0.00 0.00 0.00 0.00 51.96 53.49 1lq8 s ALA 188 Cb -0.11 -0.75 -0.07 0.00 0.00 0.00 0.00 23.12 22.19 1lq8 s ALA 188 CO -0.02 -0.34 0.68 0.15 0.00 0.00 0.00 175.76 176.23 1lq8 s LYS 189 N -0.16 3.81 0.80 0.00 1.02 -0.89 -0.86 119.74 123.47 1lq8 s LYS 189 Ca -0.04 0.39 -0.11 0.00 0.02 0.00 0.00 55.97 56.23 1lq8 s LYS 189 Cb -0.03 -2.50 0.08 0.00 -0.52 0.00 0.00 37.83 34.85 1lq8 s LYS 189 CO 0.04 0.13 1.11 -1.58 -0.92 0.00 0.00 175.35 174.13 1lq8 s TRP 190 N -2.11 2.28 0.22 3.18 0.52 0.12 -1.36 118.94 121.79 1lq8 s TRP 190 Ca 0.50 1.63 -0.08 0.00 0.02 0.00 0.00 56.10 58.16 1lq8 s TRP 190 Cb -0.11 -3.16 0.19 0.00 -1.15 0.00 0.00 33.47 29.25 1lq8 s TRP 190 CO 0.26 -2.12 1.89 1.49 0.02 0.00 0.00 176.95 178.49 1lq8 h GLU 191 N -1.22 1.14 -4.03 4.98 4.81 -1.47 -3.37 114.58 115.41 1lq8 h GLU 191 Ca -0.44 -0.08 -0.48 0.00 -0.13 0.00 0.00 59.36 58.23 1lq8 h GLU 191 Cb 1.25 -0.25 -0.37 0.00 0.63 0.00 0.00 28.75 30.01 1lq8 h GLU 191 CO 0.49 0.77 -0.79 0.99 -0.73 0.00 0.00 179.01 179.74 1lq8 s THR 192 N -6.06 0.73 0.46 0.32 2.01 -1.26 -4.86 115.64 106.97 1lq8 s THR 192 Ca -0.13 -0.13 -0.08 0.00 0.31 0.00 0.00 61.69 61.66 1lq8 s THR 192 Cb 0.16 -0.79 0.12 0.00 0.01 0.00 0.00 72.50 72.00 1lq8 s THR 192 CO 0.80 0.31 0.35 -1.54 -0.69 0.00 0.00 174.62 173.84 1lq8 n SER 193 N 4.80 -1.97 -4.54 3.53 3.41 -1.26 -5.04 113.62 112.54 1lq8 n SER 193 Ca -0.13 -0.55 -0.31 0.00 -0.26 0.00 0.00 58.87 57.62 1lq8 n SER 193 Cb 0.50 -0.35 -0.11 0.00 -0.26 0.00 0.00 64.21 64.00 1lq8 n SER 193 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 1lq8 s PHE 194 N -1.56 2.73 -0.31 7.33 0.08 -0.56 -5.02 117.98 120.67 1lq8 s PHE 194 Ca 0.24 -0.15 -0.29 0.00 0.12 0.00 0.00 56.93 56.85 1lq8 s PHE 194 Cb -0.03 -1.50 -0.02 0.00 -0.57 0.00 0.00 43.02 40.90 1lq8 s PHE 194 CO 0.19 0.35 1.72 1.21 -0.10 0.00 0.00 175.22 178.59 1lq8 s ASN 195 N -1.71 6.05 0.38 1.36 3.84 -1.26 -4.83 114.94 118.77 1lq8 s ASN 195 Ca 0.18 1.33 0.18 0.00 0.21 0.00 0.00 52.86 54.75 1lq8 s ASN 195 Cb -0.11 -2.53 1.10 0.00 -0.55 0.00 0.00 41.25 39.17 1lq8 s ASN 195 CO 0.09 -1.58 1.73 -0.74 -2.79 0.00 0.00 177.10 173.81 1lq8 h HIS 196 N 12.17 0.75 -0.00 0.43 -0.00 -1.94 0.71 115.15 127.26 1lq8 h HIS 196 Ca -0.33 0.03 0.00 0.00 -0.00 0.00 0.00 60.37 60.07 1lq8 h HIS 196 Cb 1.16 -0.21 0.00 0.00 -0.00 0.00 0.00 27.41 28.36 1lq8 h HIS 196 CO 0.95 -0.01 -0.01 1.63 -0.00 0.00 0.00 177.93 180.49 1lq8 n LYS 197 N -4.75 0.99 -0.11 5.26 5.02 -1.26 -3.27 118.16 120.05 1lq8 n LYS 197 Ca 0.28 -0.15 0.11 0.00 -2.02 0.00 0.00 58.31 56.54 1lq8 n LYS 197 Cb 0.95 -1.50 0.29 0.00 -0.02 0.00 0.00 35.03 34.75 1lq8 n LYS 197 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1lq8 n GLY 198 N 1.08 0.89 3.72 0.72 0.00 0.25 -4.88 105.19 106.96 1lq8 n GLY 198 Ca 0.21 -0.57 -0.38 0.00 0.00 0.00 0.00 46.02 45.28 1lq8 n GLY 198 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1lq8 s THR 199 N -1.72 5.18 0.13 2.61 2.01 -1.20 -4.32 115.64 118.32 1lq8 s THR 199 Ca 0.35 0.97 0.05 0.00 0.31 0.00 0.00 61.69 63.37 1lq8 s THR 199 Cb 0.20 -3.83 -0.04 0.00 0.01 0.00 0.00 72.50 68.85 1lq8 s THR 199 CO 0.29 0.31 -0.12 -1.10 -0.69 0.00 0.00 174.62 173.31 1lq8 s GLN 200 N 0.69 1.01 0.06 4.92 -1.52 -1.16 -4.92 119.66 118.74 1lq8 s GLN 200 Ca 0.26 -1.28 -0.31 0.00 -1.95 0.00 0.00 55.36 52.08 1lq8 s GLN 200 Cb -0.15 -0.77 -0.07 0.00 -0.22 0.00 0.00 33.01 31.80 1lq8 s GLN 200 CO 0.10 0.13 1.39 -2.00 -0.25 0.00 0.00 175.29 174.67 1lq8 s GLU 201 N -2.97 4.31 0.01 2.91 2.56 -1.26 -1.16 118.70 123.10 1lq8 s GLU 201 Ca 0.10 2.02 -0.04 0.00 0.00 0.00 0.00 54.97 57.05 1lq8 s GLU 201 Cb -0.03 -3.41 -0.01 0.00 2.00 0.00 0.00 34.13 32.69 1lq8 s GLU 201 CO 0.02 -0.49 0.06 -1.14 -0.56 0.00 0.00 175.26 173.15 1lq8 s GLN 202 N 1.70 0.38 0.28 4.30 0.74 -0.55 -4.90 119.66 121.61 1lq8 s GLN 202 Ca 0.64 -0.44 -0.29 0.00 0.05 0.00 0.00 55.36 55.32 1lq8 s GLN 202 Cb -0.34 0.15 -0.10 0.00 1.10 0.00 0.00 33.01 33.82 1lq8 s GLN 202 CO 0.29 -0.08 1.38 -0.51 -0.55 0.00 0.00 175.29 175.82 1lq8 s ASP 203 N -1.29 6.71 -0.12 6.67 1.01 -1.26 -1.56 116.67 126.84 1lq8 s ASP 203 Ca -0.14 2.66 0.01 0.00 0.71 0.00 0.00 52.55 55.79 1lq8 s ASP 203 Cb -0.08 -2.63 0.02 0.00 1.01 0.00 0.00 42.92 41.24 1lq8 s ASP 203 CO 0.00 -0.63 -0.12 0.12 0.21 0.00 0.00 175.17 174.75 1lq8 s PHE 204 N -0.42 1.81 -0.67 4.23 2.19 0.28 -4.91 117.98 120.49 1lq8 s PHE 204 Ca 0.55 -0.90 -0.19 0.00 0.33 0.00 0.00 56.93 56.72 1lq8 s PHE 204 Cb -0.41 -1.37 0.11 0.00 -1.31 0.00 0.00 43.02 40.05 1lq8 s PHE 204 CO 0.47 -0.51 0.83 0.71 1.83 0.00 0.00 175.22 178.54 1lq8 s TYR 205 N 1.30 3.00 0.11 10.12 1.51 -1.26 -0.62 117.35 131.50 1lq8 s TYR 205 Ca -0.01 -1.01 -0.18 0.00 -1.01 0.00 0.00 57.07 54.86 1lq8 s TYR 205 Cb -0.14 -4.10 -0.04 0.00 -0.11 0.00 0.00 41.96 37.57 1lq8 s TYR 205 CO -0.05 -1.38 1.64 0.28 -1.11 0.00 0.00 175.55 174.93 1lq8 h VAL 206 N 5.84 1.19 -3.76 0.71 2.07 -1.40 -3.44 116.25 117.46 1lq8 h VAL 206 Ca -0.20 -0.60 -0.41 0.00 0.82 0.00 0.00 66.70 66.31 1lq8 h VAL 206 Cb 1.07 1.01 -0.14 0.00 -1.52 0.00 0.00 31.29 31.71 1lq8 h VAL 206 CO 1.10 0.20 -0.57 0.42 0.02 0.00 0.00 177.57 178.74 1lq8 s THR 207 N -5.48 0.43 0.50 2.57 -4.23 -1.05 -4.97 115.64 103.42 1lq8 s THR 207 Ca -0.13 -2.00 0.36 0.00 -1.18 0.00 0.00 61.69 58.73 1lq8 s THR 207 Cb 0.09 -2.54 0.38 0.00 1.34 0.00 0.00 72.50 71.77 1lq8 s THR 207 CO 0.74 0.00 2.21 0.77 -0.54 0.00 0.00 174.62 177.80 1lq8 h SER 208 N 2.21 0.00 0.00 3.99 4.64 -2.00 -3.09 113.55 119.30 1lq8 h SER 208 Ca -0.35 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.96 1lq8 h SER 208 Cb 1.25 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.34 1lq8 h SER 208 CO 0.55 0.03 -1.67 -0.62 -0.87 0.00 0.00 176.83 174.25 1lq8 n GLU 209 N -3.36 0.51 -3.46 4.77 -0.58 -1.26 -4.84 120.64 112.42 1lq8 n GLU 209 Ca -0.02 -0.12 -0.43 0.00 -0.42 0.00 0.00 57.16 56.17 1lq8 n GLU 209 Cb 0.15 -1.34 -0.07 0.00 -0.57 0.00 0.00 31.44 29.61 1lq8 n GLU 209 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 1lq8 s THR 210 N -2.96 4.66 -0.05 2.62 2.01 -1.17 -5.05 115.64 115.71 1lq8 s THR 210 Ca -0.05 -1.55 0.06 0.00 0.31 0.00 0.00 61.69 60.46 1lq8 s THR 210 Cb 0.09 -3.97 -0.02 0.00 0.01 0.00 0.00 72.50 68.61 1lq8 s THR 210 CO 0.59 -0.74 -0.21 0.54 -0.69 0.00 0.00 174.62 174.11 1lq8 s VAL 211 N 1.48 2.46 0.04 3.82 0.11 -1.26 -0.91 120.40 126.15 1lq8 s VAL 211 Ca 0.04 -0.94 0.04 0.00 -2.93 0.00 0.00 61.98 58.19 1lq8 s VAL 211 Cb -0.27 -1.91 -0.02 0.00 -1.53 0.00 0.00 36.38 32.65 1lq8 s VAL 211 CO 0.02 0.58 -0.11 0.54 -3.33 0.00 0.00 175.10 172.80 1lq8 s VAL 212 N -0.48 0.81 0.20 2.04 0.11 0.20 -4.94 120.40 118.34 1lq8 s VAL 212 Ca 0.06 -1.01 -0.28 0.00 -2.93 0.00 0.00 61.98 57.82 1lq8 s VAL 212 Cb -0.11 -0.79 -0.08 0.00 -1.53 0.00 0.00 36.38 33.86 1lq8 s VAL 212 CO 0.01 -0.18 0.89 -0.13 -3.33 0.00 0.00 175.10 172.35 1lq8 s ARG 213 N -1.33 4.75 0.03 1.54 1.81 -1.26 -0.56 118.95 123.93 1lq8 s ARG 213 Ca -0.04 1.37 -0.04 0.00 -1.72 0.00 0.00 55.73 55.31 1lq8 s ARG 213 Cb -0.08 -3.28 -0.01 0.00 -0.45 0.00 0.00 34.95 31.12 1lq8 s ARG 213 CO 0.01 0.51 0.06 0.14 -0.68 0.00 0.00 175.30 175.34 1lq8 s VAL 214 N -1.06 0.13 -0.24 3.52 -7.23 -0.60 -4.93 120.40 109.98 1lq8 s VAL 214 Ca 0.40 -1.05 -0.29 0.00 -1.81 0.00 0.00 61.98 59.23 1lq8 s VAL 214 Cb -0.25 -0.72 -0.01 0.00 0.56 0.00 0.00 36.38 35.96 1lq8 s VAL 214 CO 0.30 -0.58 1.45 -2.16 -0.31 0.00 0.00 175.10 173.80 1lq8 s PRO 215 N -2.24 3.90 -0.35 4.82 0.04 -1.26 -1.48 135.00 138.42 1lq8 s PRO 215 Ca -0.08 1.50 -0.17 0.00 0.04 0.00 0.00 61.00 62.29 1lq8 s PRO 215 Cb -0.04 -3.94 -0.01 0.00 0.04 0.00 0.00 34.50 30.56 1lq8 s PRO 215 CO -0.03 -1.15 0.46 1.41 0.04 0.00 0.00 177.00 177.73 1lq8 s MET 216 N 4.33 3.61 0.56 4.56 1.75 -0.31 -0.89 119.30 132.91 1lq8 s MET 216 Ca 0.63 -0.24 -0.14 0.00 -1.25 0.00 0.00 55.69 54.69 1lq8 s MET 216 Cb -0.21 -3.80 -0.06 0.00 2.84 0.00 0.00 34.83 33.59 1lq8 s MET 216 CO 0.25 -0.60 1.01 -1.64 -0.65 0.00 0.00 175.02 173.39 1lq8 s MET 217 N 2.26 3.78 0.07 4.11 -1.94 0.56 -2.98 119.30 125.16 1lq8 s MET 217 Ca 0.16 0.88 -0.13 0.00 -1.71 0.00 0.00 55.69 54.89 1lq8 s MET 217 Cb -0.16 -2.11 0.02 0.00 2.01 0.00 0.00 34.83 34.59 1lq8 s MET 217 CO 0.13 -0.42 0.30 -1.54 -0.01 0.00 0.00 175.02 173.48 1lq8 s SER 218 N -3.51 -0.10 0.00 3.03 1.04 -1.26 0.01 113.70 112.91 1lq8 s SER 218 Ca 0.57 -0.30 0.00 0.00 0.48 0.00 0.00 55.95 56.71 1lq8 s SER 218 Cb -0.11 0.37 0.00 0.00 0.10 0.00 0.00 66.02 66.39 1lq8 s SER 218 CO 0.41 -0.68 0.00 -1.14 0.98 0.00 0.00 173.24 172.81 1lq8 n ARG 219 N 0.32 0.00 -3.34 4.02 0.63 -0.64 -4.14 116.66 113.51 1lq8 n ARG 219 Ca -0.17 0.00 -0.38 0.00 -0.92 0.00 0.00 57.85 56.38 1lq8 n ARG 219 Cb 0.61 0.00 -0.06 0.00 0.45 0.00 0.00 32.46 33.46 1lq8 n ARG 219 CO 0.00 0.00 0.00 -2.00 -2.51 0.00 0.00 177.63 173.12 1lq8 s GLU 220 N 0.00 4.28 -0.01 -0.14 2.12 -1.26 -2.14 118.70 121.55 1lq8 s GLU 220 Ca 0.00 0.46 -0.10 0.00 0.36 0.00 0.00 54.97 55.69 1lq8 s GLU 220 Cb 0.00 -3.40 0.03 0.00 0.26 0.00 0.00 34.13 31.02 1lq8 s GLU 220 CO 0.00 0.25 0.45 -3.47 -0.54 0.00 0.00 175.26 171.95 1lq8 n ASP 221 N 3.34 -0.42 -4.63 -1.70 2.03 0.54 -4.98 116.55 110.72 1lq8 n ASP 221 Ca -0.08 -1.09 -0.40 0.00 0.52 0.00 0.00 54.79 53.74 1lq8 n ASP 221 Cb 0.52 0.65 -0.07 0.00 -0.72 0.00 0.00 41.12 41.50 1lq8 n ASP 221 CO 0.00 0.00 0.00 -1.58 -1.92 0.00 0.00 177.20 173.70 1lq8 s GLN 222 N -2.00 4.13 0.17 -0.67 2.00 -1.26 -0.53 119.66 121.49 1lq8 s GLN 222 Ca 0.11 0.49 0.07 0.00 -2.00 0.00 0.00 55.36 54.03 1lq8 s GLN 222 Cb -0.00 -3.63 -0.04 0.00 0.80 0.00 0.00 33.01 30.14 1lq8 s GLN 222 CO -0.00 -0.34 -0.15 0.71 -0.50 0.00 0.00 175.29 175.00 1lq8 s TYR 223 N 2.26 1.65 -0.69 1.67 2.02 -0.70 -4.88 117.35 118.69 1lq8 s TYR 223 Ca 0.25 -0.54 -0.27 0.00 -0.37 0.00 0.00 57.07 56.14 1lq8 s TYR 223 Cb -0.16 -0.81 0.02 0.00 -0.40 0.00 0.00 41.96 40.62 1lq8 s TYR 223 CO 0.09 0.29 1.35 -1.01 -1.57 0.00 0.00 175.55 174.70 1lq8 s HIS 224 N -2.48 2.24 0.61 2.71 3.76 -1.23 -0.33 115.29 120.56 1lq8 s HIS 224 Ca 0.17 0.14 0.01 0.00 -0.15 0.00 0.00 55.06 55.22 1lq8 s HIS 224 Cb -0.03 -4.54 0.07 0.00 1.11 0.00 0.00 32.58 29.19 1lq8 s HIS 224 CO 0.06 -2.05 0.85 -0.47 -0.85 0.00 0.00 174.74 172.28 1lq8 s TYR 225 N 6.07 2.40 -0.29 1.40 5.04 -0.54 -1.22 117.35 130.21 1lq8 s TYR 225 Ca 0.41 -0.12 -0.20 0.00 -2.44 0.00 0.00 57.07 54.72 1lq8 s TYR 225 Cb -0.09 -2.81 0.17 0.00 0.35 0.00 0.00 41.96 39.58 1lq8 s TYR 225 CO 0.18 -1.16 1.16 -1.17 -1.34 0.00 0.00 175.55 173.22 1lq8 s LEU 226 N -4.89 -0.28 -0.33 6.97 1.98 -0.73 -2.78 118.68 118.62 1lq8 s LEU 226 Ca 0.60 0.48 0.04 0.00 -2.89 0.00 0.00 54.13 52.36 1lq8 s LEU 226 Cb -0.09 1.46 0.10 0.00 0.66 0.00 0.00 46.19 48.32 1lq8 s LEU 226 CO 0.40 -0.08 0.05 -0.22 -1.89 0.00 0.00 176.35 174.61 1lq8 s LEU 227 N 0.77 4.55 -0.53 -0.68 0.20 -1.26 -1.08 118.68 120.65 1lq8 s LEU 227 Ca -0.03 -2.09 -0.22 0.00 0.69 0.00 0.00 54.13 52.48 1lq8 s LEU 227 Cb -0.04 -1.58 0.05 0.00 -0.43 0.00 0.00 46.19 44.19 1lq8 s LEU 227 CO -0.12 -0.37 0.78 -0.62 -0.29 0.00 0.00 176.35 175.73 1lq8 s ASP 228 N 0.95 6.28 0.27 3.68 3.68 -0.34 -4.88 116.67 126.32 1lq8 s ASP 228 Ca 0.10 -0.63 0.26 0.00 2.13 0.00 0.00 52.55 54.41 1lq8 s ASP 228 Cb -0.19 -2.36 0.78 0.00 -1.45 0.00 0.00 42.92 39.70 1lq8 s ASP 228 CO -0.09 -1.06 1.75 0.03 0.13 0.00 0.00 175.17 175.93 1lq8 h ARG 229 N 9.15 0.00 0.00 4.34 3.08 -1.96 -0.13 114.38 128.87 1lq8 h ARG 229 Ca -0.27 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 59.78 1lq8 h ARG 229 Cb 1.08 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.13 1lq8 h ARG 229 CO 1.03 0.00 -0.11 -0.91 -1.07 0.00 0.00 179.97 178.91 1lq8 h ASN 230 N 0.00 0.00 0.80 7.04 2.35 -1.95 -3.32 115.58 120.50 1lq8 h ASN 230 Ca 0.00 -0.13 -0.05 0.00 -0.55 0.00 0.00 56.30 55.57 1lq8 h ASN 230 Cb 0.72 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.08 1lq8 h ASN 230 CO 0.00 0.62 -0.24 -0.07 -1.65 0.00 0.00 177.43 176.09 1lq8 h LEU 231 N -1.00 0.00 -2.87 1.61 4.07 -1.96 -3.48 115.31 111.69 1lq8 h LEU 231 Ca -0.01 0.00 -0.00 0.00 0.08 0.00 0.00 57.88 57.95 1lq8 h LEU 231 Cb 0.23 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.97 1lq8 h LEU 231 CO -0.01 0.24 -0.00 -0.24 -1.08 0.00 0.00 178.44 177.35 1lq8 n SER 232 N -3.47 -3.24 -3.69 -0.43 2.88 -0.34 -3.90 113.62 101.43 1lq8 n SER 232 Ca -0.00 -0.02 -0.06 0.00 -1.33 0.00 0.00 58.87 57.46 1lq8 n SER 232 Cb 0.41 -1.91 -0.02 0.00 -0.75 0.00 0.00 64.21 61.94 1lq8 n SER 232 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1lq8 s ARG 234 N -3.40 2.71 -0.08 0.00 0.52 0.25 -1.20 118.95 117.75 1lq8 s ARG 234 Ca 0.09 -0.82 0.05 0.00 -0.52 0.00 0.00 55.73 54.53 1lq8 s ARG 234 Cb -0.02 -2.30 -0.00 0.00 0.52 0.00 0.00 34.95 33.14 1lq8 s ARG 234 CO -0.01 0.40 -0.24 0.08 0.02 0.00 0.00 175.30 175.55 1lq8 s VAL 235 N -0.18 2.05 -0.04 3.52 1.01 -0.24 -0.38 120.40 126.13 1lq8 s VAL 235 Ca -0.02 -1.03 0.05 0.00 0.00 0.00 0.00 61.98 60.98 1lq8 s VAL 235 Cb -0.14 -1.76 -0.02 0.00 0.00 0.00 0.00 36.38 34.47 1lq8 s VAL 235 CO 0.03 0.56 -0.19 -0.69 0.00 0.00 0.00 175.10 174.81 1lq8 s VAL 236 N 0.16 2.62 -0.20 2.92 1.01 -0.97 -1.78 120.40 124.16 1lq8 s VAL 236 Ca -0.13 -0.89 -0.05 0.00 0.00 0.00 0.00 61.98 60.92 1lq8 s VAL 236 Cb -0.16 -1.99 -0.02 0.00 0.00 0.00 0.00 36.38 34.21 1lq8 s VAL 236 CO 0.07 0.58 -0.02 -0.83 0.00 0.00 0.00 175.10 174.91 1lq8 s GLY 237 N -0.58 1.68 -0.27 4.51 0.00 -0.36 -1.72 107.32 110.59 1lq8 s GLY 237 Ca 0.08 -1.03 0.03 0.00 0.00 0.00 0.00 44.72 43.80 1lq8 s GLY 237 CO 0.01 0.26 -0.09 0.14 0.00 0.00 0.00 173.10 173.42 1lq8 s VAL 238 N 1.09 2.11 0.65 1.40 1.01 -0.26 -3.54 120.40 122.86 1lq8 s VAL 238 Ca 0.02 -1.67 -0.13 0.00 0.00 0.00 0.00 61.98 60.19 1lq8 s VAL 238 Cb -0.14 -2.27 -0.01 0.00 0.00 0.00 0.00 36.38 33.95 1lq8 s VAL 238 CO 0.01 -0.10 1.06 -2.16 0.00 0.00 0.00 175.10 173.91 1lq8 s PRO 239 N 1.11 3.07 0.31 2.72 0.04 -1.26 -1.07 135.00 139.92 1lq8 s PRO 239 Ca -0.06 1.12 0.08 0.00 0.04 0.00 0.00 61.00 62.17 1lq8 s PRO 239 Cb -0.20 -2.00 -0.03 0.00 0.04 0.00 0.00 34.50 32.31 1lq8 s PRO 239 CO -0.06 -1.01 0.22 0.71 0.04 0.00 0.00 177.00 176.91 1lq8 s TYR 240 N -2.71 2.90 -0.99 0.56 2.02 -0.51 -1.48 117.35 117.14 1lq8 s TYR 240 Ca 0.61 -0.26 -0.24 0.00 -0.37 0.00 0.00 57.07 56.81 1lq8 s TYR 240 Cb -0.16 -1.63 -0.02 0.00 -0.40 0.00 0.00 41.96 39.76 1lq8 s TYR 240 CO 0.45 0.33 1.79 -0.65 -1.57 0.00 0.00 175.55 175.91 1lq8 s GLN 241 N -3.91 2.92 0.00 -0.62 -0.21 -0.46 -4.40 119.66 112.98 1lq8 s GLN 241 Ca 0.38 -0.72 0.00 0.00 0.02 0.00 0.00 55.36 55.04 1lq8 s GLN 241 Cb -0.06 -5.19 0.00 0.00 1.00 0.00 0.00 33.01 28.76 1lq8 s GLN 241 CO 0.25 -3.06 0.00 0.41 -2.12 0.00 0.00 175.29 170.77 1lq8 n GLY 242 N 6.67 0.82 3.25 3.09 0.00 -1.26 -4.46 105.19 113.29 1lq8 n GLY 242 Ca 0.39 -2.02 -0.43 0.00 0.00 0.00 0.00 46.02 43.97 1lq8 n GLY 242 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1lq8 s ASN 243 N -4.00 5.98 0.00 1.61 0.01 -1.26 -4.89 114.94 112.39 1lq8 s ASN 243 Ca 0.00 -2.12 0.00 0.00 -0.71 0.00 0.00 52.86 50.03 1lq8 s ASN 243 Cb 0.00 -2.09 0.00 0.00 0.41 0.00 0.00 41.25 39.57 1lq8 s ASN 243 CO 0.00 -0.69 0.00 0.00 -1.51 0.00 0.00 177.10 174.90 1lq8 n ALA 244 N 4.69 0.00 -2.42 0.60 0.00 -1.26 -5.06 120.51 117.06 1lq8 n ALA 244 Ca -0.04 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.12 1lq8 n ALA 244 Cb 0.41 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.72 1lq8 n ALA 244 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1lq8 s THR 245 N 0.00 1.85 -0.11 0.00 2.01 -1.26 -1.42 115.64 116.70 1lq8 s THR 245 Ca 0.00 -1.22 -0.13 0.00 0.31 0.00 0.00 61.69 60.65 1lq8 s THR 245 Cb 0.00 -1.58 -0.05 0.00 0.01 0.00 0.00 72.50 70.88 1lq8 s THR 245 CO 0.00 0.31 0.30 0.00 -0.69 0.00 0.00 174.62 174.54 1lq8 s ALA 246 N -0.75 3.66 -0.19 7.40 0.00 -0.23 -4.94 121.76 126.71 1lq8 s ALA 246 Ca 0.09 -0.43 -0.03 0.00 0.00 0.00 0.00 51.96 51.60 1lq8 s ALA 246 Cb -0.09 -2.32 -0.01 0.00 0.00 0.00 0.00 23.12 20.70 1lq8 s ALA 246 CO 0.01 0.27 -0.08 -0.51 0.00 0.00 0.00 175.76 175.46 1lq8 s LEU 247 N -0.16 2.80 -0.28 0.00 1.43 -1.26 -1.11 118.68 120.11 1lq8 s LEU 247 Ca 0.18 -0.39 -0.05 0.00 -1.03 0.00 0.00 54.13 52.84 1lq8 s LEU 247 Cb -0.14 -1.69 0.01 0.00 0.03 0.00 0.00 46.19 44.41 1lq8 s LEU 247 CO 0.06 0.03 0.03 -0.36 0.23 0.00 0.00 176.35 176.35 1lq8 s PHE 248 N 1.17 3.12 -0.27 0.29 0.40 -0.70 -4.98 117.98 117.01 1lq8 s PHE 248 Ca 0.02 -1.13 -0.12 0.00 -0.60 0.00 0.00 56.93 55.10 1lq8 s PHE 248 Cb -0.14 -2.19 -0.05 0.00 0.51 0.00 0.00 43.02 41.15 1lq8 s PHE 248 CO -0.02 -0.61 0.25 0.42 0.70 0.00 0.00 175.22 175.95 1lq8 s ILE 249 N 1.45 5.28 -0.43 0.64 1.09 -1.26 -2.28 121.20 125.69 1lq8 s ILE 249 Ca 0.02 0.31 -0.05 0.00 -1.10 0.00 0.00 60.65 59.83 1lq8 s ILE 249 Cb -0.17 -3.58 0.11 0.00 -1.06 0.00 0.00 42.46 37.76 1lq8 s ILE 249 CO 0.00 0.24 0.25 -0.22 -0.10 0.00 0.00 174.94 175.11 1lq8 s LEU 250 N 1.70 5.38 0.38 2.97 2.96 0.48 -4.96 118.68 127.60 1lq8 s LEU 250 Ca 0.10 -1.96 -0.26 0.00 -0.22 0.00 0.00 54.13 51.79 1lq8 s LEU 250 Cb -0.15 -1.89 -0.09 0.00 0.50 0.00 0.00 46.19 44.55 1lq8 s LEU 250 CO 0.09 -0.59 1.18 -2.16 -1.32 0.00 0.00 176.35 173.56 1lq8 s PRO 251 N 1.23 4.16 0.83 0.98 0.04 -1.26 -0.58 135.00 140.39 1lq8 s PRO 251 Ca 0.07 1.89 -0.12 0.00 0.04 0.00 0.00 61.00 62.89 1lq8 s PRO 251 Cb -0.24 -2.79 0.10 0.00 0.04 0.00 0.00 34.50 31.61 1lq8 s PRO 251 CO -0.03 -0.25 1.15 -1.54 0.04 0.00 0.00 177.00 176.38 1lq8 s SER 252 N -1.01 3.58 -0.40 6.66 1.04 -0.44 -4.77 113.70 118.36 1lq8 s SER 252 Ca 0.55 2.16 -0.42 0.00 0.48 0.00 0.00 55.95 58.72 1lq8 s SER 252 Cb -0.32 -2.56 -0.17 0.00 0.10 0.00 0.00 66.02 63.07 1lq8 s SER 252 CO 0.41 -2.66 1.92 -1.84 0.98 0.00 0.00 173.24 172.04 1lq8 n GLU 253 N -3.67 0.56 -0.74 4.02 0.00 -1.26 -0.66 120.64 118.90 1lq8 n GLU 253 Ca 0.12 0.19 0.00 0.00 0.00 0.00 0.00 57.16 57.46 1lq8 n GLU 253 Cb 0.52 -1.88 0.00 0.00 0.00 0.00 0.00 31.44 30.08 1lq8 n GLU 253 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1lq8 n GLY 254 N 5.57 0.66 0.32 -1.84 0.00 -1.26 -4.95 105.19 103.69 1lq8 n GLY 254 Ca 0.39 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.44 1lq8 n GLY 254 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1lq8 n LYS 255 N -2.64 0.56 -0.35 1.61 4.01 0.17 -4.72 118.16 116.80 1lq8 n LYS 255 Ca 0.00 -1.11 -0.02 0.00 -0.51 0.00 0.00 58.31 56.66 1lq8 n LYS 255 Cb 0.00 -1.15 0.03 0.00 -0.51 0.00 0.00 35.03 33.40 1lq8 n LYS 255 CO 0.00 0.00 0.00 1.98 -1.11 0.00 0.00 177.40 178.27 1lq8 h MET 256 N 1.45 -0.03 -0.64 1.97 1.85 -1.86 0.35 114.93 118.02 1lq8 h MET 256 Ca 0.00 0.00 0.12 0.00 -0.61 0.00 0.00 59.70 59.21 1lq8 h MET 256 Cb 0.37 0.01 -0.08 0.00 0.43 0.00 0.00 31.60 32.33 1lq8 h MET 256 CO 0.00 -0.02 0.20 1.96 -0.40 0.00 0.00 176.91 178.64 1lq8 h GLN 257 N -0.03 0.33 0.26 0.39 1.08 -1.97 -0.30 115.11 114.87 1lq8 h GLN 257 Ca 0.32 -0.02 -0.00 0.00 -1.45 0.00 0.00 58.65 57.50 1lq8 h GLN 257 Cb 0.58 -0.07 -0.01 0.00 -0.05 0.00 0.00 27.48 27.92 1lq8 h GLN 257 CO -0.93 0.22 -0.22 0.37 -0.95 0.00 0.00 178.83 177.32 1lq8 h GLN 258 N 0.34 -0.48 -0.45 1.46 4.15 -0.66 -1.58 115.11 117.89 1lq8 h GLN 258 Ca 0.34 0.03 -0.03 0.00 0.77 0.00 0.00 58.65 59.76 1lq8 h GLN 258 Cb 0.48 0.11 -0.02 0.00 0.21 0.00 0.00 27.48 28.26 1lq8 h GLN 258 CO -0.38 -0.32 0.14 -0.39 -1.93 0.00 0.00 178.83 175.96 1lq8 h VAL 259 N -0.50 1.18 -0.93 2.39 -1.51 -0.87 -1.62 116.25 114.39 1lq8 h VAL 259 Ca -0.01 -0.62 0.01 0.00 -1.23 0.00 0.00 66.70 64.85 1lq8 h VAL 259 Cb 0.45 0.69 -0.05 0.00 -2.13 0.00 0.00 31.29 30.25 1lq8 h VAL 259 CO -0.03 0.23 0.62 -0.33 -1.23 0.00 0.00 177.57 176.83 1lq8 h GLU 260 N 0.64 1.22 -0.22 5.19 5.08 -0.70 -1.17 114.58 124.62 1lq8 h GLU 260 Ca 0.15 -0.07 -0.12 0.00 -1.00 0.00 0.00 59.36 58.32 1lq8 h GLU 260 Cb 0.19 -0.28 -0.01 0.00 0.50 0.00 0.00 28.75 29.15 1lq8 h GLU 260 CO -0.01 0.81 -0.37 -0.91 -1.00 0.00 0.00 179.01 177.53 1lq8 h ASN 261 N 1.26 0.52 0.63 1.42 2.35 -0.53 -2.95 115.58 118.27 1lq8 h ASN 261 Ca 0.34 -0.22 0.00 0.00 -0.55 0.00 0.00 56.30 55.87 1lq8 h ASN 261 Cb -0.14 -0.14 0.00 0.00 0.05 0.00 0.00 38.32 38.08 1lq8 h ASN 261 CO -0.07 0.85 0.00 0.61 -1.65 0.00 0.00 177.43 177.16 1lq8 n GLY 262 N -0.12 -1.25 3.76 2.83 0.00 -0.68 -4.86 105.19 104.86 1lq8 n GLY 262 Ca -0.01 -0.12 -0.41 0.00 0.00 0.00 0.00 46.02 45.48 1lq8 n GLY 262 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1lq8 s LEU 263 N -2.69 4.34 0.02 0.99 1.43 -0.53 -4.81 118.68 117.44 1lq8 s LEU 263 Ca 0.22 2.95 -0.28 0.00 -1.03 0.00 0.00 54.13 55.99 1lq8 s LEU 263 Cb 0.18 -3.65 0.10 0.00 0.03 0.00 0.00 46.19 42.85 1lq8 s LEU 263 CO 0.44 -0.86 0.94 -0.94 0.23 0.00 0.00 176.35 176.16 1lq8 s SER 264 N 0.21 -0.29 0.23 2.29 1.04 -1.26 -4.92 113.70 111.00 1lq8 s SER 264 Ca 0.58 -0.10 -0.07 0.00 0.48 0.00 0.00 55.95 56.85 1lq8 s SER 264 Cb -0.46 0.38 0.21 0.00 0.10 0.00 0.00 66.02 66.25 1lq8 s SER 264 CO 0.53 -0.65 1.85 -0.08 0.98 0.00 0.00 173.24 175.88 1lq8 h GLU 265 N 2.00 1.26 -0.57 4.02 4.57 -1.95 -1.57 114.58 122.34 1lq8 h GLU 265 Ca -0.22 -0.15 -0.02 0.00 -1.18 0.00 0.00 59.36 57.79 1lq8 h GLU 265 Cb 1.23 -0.24 -0.03 0.00 -0.16 0.00 0.00 28.75 29.55 1lq8 h GLU 265 CO 0.29 0.92 0.27 0.87 -1.18 0.00 0.00 179.01 180.18 1lq8 h LYS 266 N 1.26 0.83 -0.22 1.92 6.56 -1.97 -2.00 116.57 122.96 1lq8 h LYS 266 Ca 0.32 -0.13 0.00 0.00 -1.06 0.00 0.00 60.65 59.78 1lq8 h LYS 266 Cb 0.03 -0.15 -0.01 0.00 -0.57 0.00 0.00 32.23 31.54 1lq8 h LYS 266 CO -0.05 0.68 0.13 1.15 -2.06 0.00 0.00 179.45 179.31 1lq8 h THR 267 N 0.78 1.04 -0.95 -0.16 2.02 -1.74 0.07 112.91 113.97 1lq8 h THR 267 Ca 0.20 -0.09 0.07 0.00 0.77 0.00 0.00 66.41 67.35 1lq8 h THR 267 Cb 0.13 0.74 -0.07 0.00 -1.74 0.00 0.00 68.15 67.22 1lq8 h THR 267 CO -0.02 0.05 0.60 0.25 0.37 0.00 0.00 175.52 176.77 1lq8 h LEU 268 N 0.28 0.96 -0.08 2.58 5.85 -1.03 0.38 115.31 124.25 1lq8 h LEU 268 Ca 0.08 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.81 1lq8 h LEU 268 Cb -0.02 -0.19 -0.00 0.00 0.37 0.00 0.00 40.66 40.82 1lq8 h LEU 268 CO -0.03 0.61 0.03 0.03 -0.34 0.00 0.00 178.44 178.74 1lq8 h ARG 269 N 1.09 0.12 -0.04 1.25 3.08 -0.87 -1.05 114.38 117.96 1lq8 h ARG 269 Ca 0.41 -0.02 0.03 0.00 0.07 0.00 0.00 59.98 60.48 1lq8 h ARG 269 Cb 0.19 -0.02 -0.05 0.00 0.08 0.00 0.00 29.97 30.17 1lq8 h ARG 269 CO -0.18 0.26 -0.23 -0.22 -1.07 0.00 0.00 179.97 178.53 1lq8 h LYS 270 N -0.05 -0.33 -0.97 0.04 3.64 -0.04 -1.96 116.57 116.90 1lq8 h LYS 270 Ca 0.03 0.02 0.12 0.00 -1.27 0.00 0.00 60.65 59.55 1lq8 h LYS 270 Cb 0.19 0.08 -0.09 0.00 -0.41 0.00 0.00 32.23 32.00 1lq8 h LYS 270 CO -0.00 -0.22 0.59 -1.49 -2.27 0.00 0.00 179.45 176.06 1lq8 h TRP 271 N -0.34 1.07 -0.92 1.91 6.55 -0.17 -2.14 115.95 121.91 1lq8 h TRP 271 Ca 0.07 0.03 0.03 0.00 0.95 0.00 0.00 58.89 59.98 1lq8 h TRP 271 Cb 0.45 -0.33 -0.05 0.00 -0.86 0.00 0.00 29.16 28.36 1lq8 h TRP 271 CO -0.29 0.40 0.59 -0.07 -1.05 0.00 0.00 178.44 178.03 1lq8 h LEU 272 N 0.92 0.99 0.00 -4.49 -0.00 -0.38 -2.46 115.31 109.89 1lq8 h LEU 272 Ca 0.49 -0.01 0.00 0.00 -0.00 0.00 0.00 57.88 58.36 1lq8 h LEU 272 Cb 0.51 -0.22 0.00 0.00 -0.00 0.00 0.00 40.66 40.94 1lq8 h LEU 272 CO -0.28 0.68 -0.96 2.29 -0.00 0.00 0.00 178.44 180.17 1lq8 n LYS 273 N -4.51 0.19 0.25 1.13 2.85 -1.12 -3.63 118.16 113.32 1lq8 n LYS 273 Ca 0.12 -0.01 0.13 0.00 -1.05 0.00 0.00 58.31 57.50 1lq8 n LYS 273 Cb 0.09 -1.55 0.60 0.00 -0.65 0.00 0.00 35.03 33.52 1lq8 n LYS 273 CO 0.00 0.00 0.00 1.98 -0.05 0.00 0.00 177.40 179.33 1lq8 h MET 274 N 0.00 0.00 -6.35 -1.58 4.05 -1.09 -3.44 114.93 106.52 1lq8 h MET 274 Ca 0.00 0.00 -0.57 0.00 -0.28 0.00 0.00 59.70 58.85 1lq8 h MET 274 Cb 0.65 0.00 0.02 0.00 -0.80 0.00 0.00 31.60 31.47 1lq8 h MET 274 CO 0.00 0.14 1.14 1.19 0.23 0.00 0.00 176.91 179.62 1lq8 n PHE 275 N -3.37 2.44 -4.29 1.39 0.99 -0.95 -4.90 117.46 108.77 1lq8 n PHE 275 Ca -0.00 -0.17 -0.20 0.00 -0.00 0.00 0.00 57.45 57.08 1lq8 n PHE 275 Cb 0.34 -2.73 -0.16 0.00 -1.00 0.00 0.00 39.48 35.94 1lq8 n PHE 275 CO 0.00 0.00 0.00 0.21 -0.00 0.00 0.00 176.76 176.97 1lq8 s LYS 276 N 3.91 0.91 0.44 -1.08 2.36 -1.12 -4.95 119.74 120.22 1lq8 s LYS 276 Ca 0.89 -0.22 -0.25 0.00 -2.55 0.00 0.00 55.97 53.85 1lq8 s LYS 276 Cb -0.56 -0.86 -0.08 0.00 -1.05 0.00 0.00 37.83 35.28 1lq8 s LYS 276 CO 0.45 0.02 1.29 0.15 1.55 0.00 0.00 175.35 178.81 1lq8 s LYS 277 N 0.50 3.79 -0.02 4.03 1.02 -1.26 -1.46 119.74 126.34 1lq8 s LYS 277 Ca -0.07 2.10 -0.12 0.00 0.02 0.00 0.00 55.97 57.90 1lq8 s LYS 277 Cb -0.11 -2.61 0.02 0.00 -0.52 0.00 0.00 37.83 34.61 1lq8 s LYS 277 CO 0.01 -0.63 0.26 0.50 -0.92 0.00 0.00 175.35 174.57 1lq8 s ARG 278 N -2.44 0.57 -0.18 1.68 3.52 0.55 -4.83 118.95 117.82 1lq8 s ARG 278 Ca 0.61 -0.17 -0.29 0.00 -0.13 0.00 0.00 55.73 55.74 1lq8 s ARG 278 Cb -0.37 0.25 -0.03 0.00 -1.56 0.00 0.00 34.95 33.24 1lq8 s ARG 278 CO 0.46 -0.14 1.60 -1.14 -0.81 0.00 0.00 175.30 175.26 1lq8 s GLN 279 N -1.14 3.90 0.01 5.12 2.00 -1.26 -1.71 119.66 126.58 1lq8 s GLN 279 Ca -0.12 1.77 0.03 0.00 -2.00 0.00 0.00 55.36 55.04 1lq8 s GLN 279 Cb -0.05 -4.01 -0.01 0.00 0.80 0.00 0.00 33.01 29.74 1lq8 s GLN 279 CO 0.03 -1.16 -0.09 -1.17 -0.50 0.00 0.00 175.29 172.40 1lq8 s LEU 280 N 4.84 2.09 -0.81 3.68 2.96 0.31 -4.99 118.68 126.77 1lq8 s LEU 280 Ca 0.71 -0.27 -0.05 0.00 -0.22 0.00 0.00 54.13 54.29 1lq8 s LEU 280 Cb -0.26 -0.39 0.21 0.00 0.50 0.00 0.00 46.19 46.25 1lq8 s LEU 280 CO 0.28 0.03 0.70 -0.70 -1.32 0.00 0.00 176.35 175.34 1lq8 s GLU 281 N -0.61 3.20 0.10 1.98 2.12 -1.26 -0.34 118.70 123.89 1lq8 s GLU 281 Ca 0.00 -2.87 -0.30 0.00 0.36 0.00 0.00 54.97 52.16 1lq8 s GLU 281 Cb -0.05 -4.03 -0.06 0.00 0.26 0.00 0.00 34.13 30.24 1lq8 s GLU 281 CO 0.00 -1.24 1.11 -1.17 -0.54 0.00 0.00 175.26 173.42 1lq8 s LEU 282 N -0.62 4.42 -0.26 2.70 2.96 -0.91 -4.91 118.68 122.06 1lq8 s LEU 282 Ca 0.22 1.97 0.02 0.00 -0.22 0.00 0.00 54.13 56.13 1lq8 s LEU 282 Cb -0.13 -3.59 0.06 0.00 0.50 0.00 0.00 46.19 43.04 1lq8 s LEU 282 CO -0.08 -0.31 -0.08 -0.31 -1.32 0.00 0.00 176.35 174.24 1lq8 s TYR 283 N 0.47 3.08 -0.08 5.38 2.02 -1.26 -1.62 117.35 125.34 1lq8 s TYR 283 Ca 0.53 -2.23 0.05 0.00 -0.37 0.00 0.00 57.07 55.05 1lq8 s TYR 283 Cb -0.28 -1.91 -0.00 0.00 -0.40 0.00 0.00 41.96 39.37 1lq8 s TYR 283 CO 0.31 -0.86 -0.23 -1.17 -1.57 0.00 0.00 175.55 172.04 1lq8 s LEU 284 N 1.16 2.02 0.29 -1.29 2.96 0.10 -4.91 118.68 119.02 1lq8 s LEU 284 Ca -0.07 -0.50 -0.28 0.00 -0.22 0.00 0.00 54.13 53.06 1lq8 s LEU 284 Cb -0.20 -1.29 -0.09 0.00 0.50 0.00 0.00 46.19 45.11 1lq8 s LEU 284 CO -0.06 0.18 0.98 -2.16 -1.32 0.00 0.00 176.35 173.98 1lq8 s PRO 285 N 0.16 4.67 0.03 0.98 0.04 -1.26 0.21 135.00 139.83 1lq8 s PRO 285 Ca -0.11 1.51 -0.30 0.00 0.04 0.00 0.00 61.00 62.13 1lq8 s PRO 285 Cb -0.16 -3.06 -0.05 0.00 0.04 0.00 0.00 34.50 31.28 1lq8 s PRO 285 CO 0.06 0.33 1.23 0.21 0.04 0.00 0.00 177.00 178.87 1lq8 s LYS 286 N -1.61 4.39 0.29 4.56 2.20 -0.07 -4.79 119.74 124.71 1lq8 s LYS 286 Ca 0.46 1.79 -0.07 0.00 -0.36 0.00 0.00 55.97 57.79 1lq8 s LYS 286 Cb -0.25 -3.41 -0.00 0.00 -1.51 0.00 0.00 37.83 32.65 1lq8 s LYS 286 CO 0.31 -0.35 0.44 -0.59 -0.36 0.00 0.00 175.35 174.80 1lq8 s PHE 287 N 1.47 0.78 -0.24 4.03 -0.12 -0.69 -4.60 117.98 118.60 1lq8 s PHE 287 Ca 0.59 -1.07 -0.12 0.00 -0.05 0.00 0.00 56.93 56.28 1lq8 s PHE 287 Cb -0.29 -0.02 0.09 0.00 -0.63 0.00 0.00 43.02 42.17 1lq8 s PHE 287 CO 0.27 -1.03 0.57 0.45 -0.05 0.00 0.00 175.22 175.44 1lq8 s SER 288 N -3.14 -0.78 0.25 1.98 0.15 -1.26 -0.52 113.70 110.39 1lq8 s SER 288 Ca 0.28 1.29 0.01 0.00 0.70 0.00 0.00 55.95 58.23 1lq8 s SER 288 Cb 0.00 1.39 -0.03 0.00 -1.71 0.00 0.00 66.02 65.67 1lq8 s SER 288 CO 0.15 -0.22 0.22 0.27 1.20 0.00 0.00 173.24 174.86 1lq8 s ILE 289 N 1.94 0.00 0.09 6.45 -4.36 -1.06 -5.02 121.20 119.25 1lq8 s ILE 289 Ca -0.08 -1.93 -0.25 0.00 -0.26 0.00 0.00 60.65 58.12 1lq8 s ILE 289 Cb -0.08 -2.49 0.08 0.00 1.25 0.00 0.00 42.46 41.22 1lq8 s ILE 289 CO -0.17 0.00 0.71 -1.83 0.24 0.00 0.00 174.94 173.89 1lq8 s GLU 290 N -3.85 1.10 0.01 0.37 -1.05 -1.26 -1.86 118.70 112.15 1lq8 s GLU 290 Ca 0.38 -0.37 -0.00 0.00 -0.15 0.00 0.00 54.97 54.82 1lq8 s GLU 290 Cb 0.05 0.51 -0.01 0.00 -0.44 0.00 0.00 34.13 34.23 1lq8 s GLU 290 CO 0.17 -0.48 -0.01 0.20 0.95 0.00 0.00 175.26 176.10 1lq8 s GLY 291 N -2.56 0.12 -0.07 -3.83 0.00 -0.29 -4.69 107.32 96.01 1lq8 s GLY 291 Ca 0.02 -0.30 0.01 0.00 0.00 0.00 0.00 44.72 44.45 1lq8 s GLY 291 CO -0.10 -0.34 -0.09 -0.56 0.00 0.00 0.00 173.10 172.01 1lq8 s SER 292 N -0.79 1.57 0.00 1.64 0.01 -1.26 -1.47 113.70 113.40 1lq8 s SER 292 Ca -0.09 -0.24 -0.02 0.00 1.31 0.00 0.00 55.95 56.92 1lq8 s SER 292 Cb -0.05 -0.70 -0.01 0.00 0.21 0.00 0.00 66.02 65.47 1lq8 s SER 292 CO -0.00 -0.02 0.02 -0.31 0.41 0.00 0.00 173.24 173.33 1lq8 s TYR 293 N 0.94 0.11 -0.65 2.43 1.51 -0.57 -5.01 117.35 116.10 1lq8 s TYR 293 Ca -0.10 -0.22 -0.14 0.00 -1.01 0.00 0.00 57.07 55.60 1lq8 s TYR 293 Cb -0.15 -0.09 0.16 0.00 -0.11 0.00 0.00 41.96 41.78 1lq8 s TYR 293 CO 0.01 -0.14 0.59 -0.65 -1.11 0.00 0.00 175.55 174.25 1lq8 s GLN 294 N -0.86 3.18 0.49 -0.62 -1.52 -1.26 -0.86 119.66 118.21 1lq8 s GLN 294 Ca -0.10 -2.03 0.19 0.00 -1.95 0.00 0.00 55.36 51.48 1lq8 s GLN 294 Cb -0.06 -4.31 1.25 0.00 -0.22 0.00 0.00 33.01 29.67 1lq8 s GLN 294 CO -0.00 -1.30 2.07 -0.07 -0.25 0.00 0.00 175.29 175.74 1lq8 h LEU 295 N 8.38 0.00 -1.51 2.90 3.38 -1.33 -1.84 115.31 125.28 1lq8 h LEU 295 Ca -0.13 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.84 1lq8 h LEU 295 Cb 1.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.82 1lq8 h LEU 295 CO 0.91 0.11 0.08 1.05 0.09 0.00 0.00 178.44 180.68 1lq8 h GLU 296 N 0.00 0.00 0.00 1.13 9.09 -1.92 -0.31 114.58 122.56 1lq8 h GLU 296 Ca -0.00 0.00 -0.25 0.00 0.05 0.00 0.00 59.36 59.16 1lq8 h GLU 296 Cb 0.22 0.00 -0.05 0.00 -1.65 0.00 0.00 28.75 27.27 1lq8 h GLU 296 CO 0.01 0.00 -1.78 1.63 0.05 0.00 0.00 179.01 178.92 1lq8 n LYS 297 N -2.33 0.64 -0.07 1.06 4.76 -0.69 -4.54 118.16 116.99 1lq8 n LYS 297 Ca -0.02 0.18 -0.04 0.00 -2.87 0.00 0.00 58.31 55.56 1lq8 n LYS 297 Cb 0.12 -1.72 -0.16 0.00 -1.84 0.00 0.00 35.03 31.42 1lq8 n LYS 297 CO 0.00 0.00 0.00 1.33 -1.37 0.00 0.00 177.40 177.36 1lq8 n VAL 298 N -2.88 0.97 0.26 -0.18 0.24 -0.26 -4.54 118.33 111.94 1lq8 n VAL 298 Ca -0.17 -0.74 0.11 0.00 -2.04 0.00 0.00 64.34 61.50 1lq8 n VAL 298 Cb 0.98 -0.34 0.71 0.00 -1.47 0.00 0.00 33.84 33.73 1lq8 n VAL 298 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 1lq8 h LEU 299 N 0.00 0.00 0.00 1.34 3.38 -1.45 -1.79 115.31 116.79 1lq8 h LEU 299 Ca -0.38 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.59 1lq8 h LEU 299 Cb 1.86 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.61 1lq8 h LEU 299 CO 0.02 0.08 0.00 -0.81 0.09 0.00 0.00 178.44 177.82 1lq8 n PRO 300 N -4.04 0.05 0.06 1.13 -0.04 -0.85 -0.39 135.00 130.91 1lq8 n PRO 300 Ca -0.03 0.26 0.13 0.00 -0.04 0.00 0.00 63.50 63.83 1lq8 n PRO 300 Cb 0.16 -1.50 0.49 0.00 -0.04 0.00 0.00 33.50 32.62 1lq8 n PRO 300 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1lq8 n SER 301 N -1.44 0.44 -0.64 3.54 7.64 -0.67 -2.03 113.62 120.46 1lq8 n SER 301 Ca 0.04 0.55 0.06 0.00 1.01 0.00 0.00 58.87 60.52 1lq8 n SER 301 Cb 0.13 -0.66 0.17 0.00 -1.01 0.00 0.00 64.21 62.84 1lq8 n SER 301 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1lq8 n LEU 302 N -1.92 3.12 0.00 -3.43 4.77 0.48 -4.95 117.00 115.07 1lq8 n LEU 302 Ca 0.06 -2.37 0.00 0.00 -0.03 0.00 0.00 56.01 53.67 1lq8 n LEU 302 Cb 0.37 -0.32 0.00 0.00 -2.33 0.00 0.00 43.42 41.15 1lq8 n LEU 302 CO 0.28 0.69 0.00 0.61 -1.33 0.00 0.00 177.39 177.64 1lq8 n GLY 303 N 0.01 0.73 3.30 -0.72 0.00 -0.86 -4.40 105.19 103.26 1lq8 n GLY 303 Ca 0.14 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.70 1lq8 n GLY 303 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1lq8 s ILE 304 N -2.64 5.38 0.00 -0.61 1.01 -0.46 -4.76 121.20 119.12 1lq8 s ILE 304 Ca 0.00 -2.44 0.00 0.00 0.00 0.00 0.00 60.65 58.21 1lq8 s ILE 304 Cb 0.00 -4.35 0.00 0.00 0.01 0.00 0.00 42.46 38.12 1lq8 s ILE 304 CO 0.00 -1.00 0.00 -1.54 0.00 0.00 0.00 174.94 172.40 1lq8 n SER 305 N 4.02 2.08 0.07 3.58 3.41 -1.26 -2.01 113.62 123.51 1lq8 n SER 305 Ca 0.11 0.00 -0.11 0.00 -0.26 0.00 0.00 58.87 58.60 1lq8 n SER 305 Cb 0.45 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.34 1lq8 n SER 305 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 1lq8 h ASN 306 N 0.00 -1.12 -1.61 4.04 4.21 -1.93 -2.41 115.58 116.76 1lq8 h ASN 306 Ca 0.00 0.12 0.47 0.00 1.21 0.00 0.00 56.30 58.10 1lq8 h ASN 306 Cb 0.91 0.42 -0.06 0.00 -1.12 0.00 0.00 38.32 38.46 1lq8 h ASN 306 CO 0.00 -0.39 1.35 1.62 -1.29 0.00 0.00 177.43 178.72 1lq8 h VAL 307 N -0.52 0.00 -0.08 2.81 3.04 -1.90 1.16 116.25 120.76 1lq8 h VAL 307 Ca -0.00 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.69 1lq8 h VAL 307 Cb 0.53 0.00 0.00 0.00 -2.01 0.00 0.00 31.29 29.81 1lq8 h VAL 307 CO -0.21 0.00 0.00 0.49 -1.01 0.00 0.00 177.57 176.84 1lq8 n PHE 308 N -3.65 0.09 -4.26 3.17 3.72 -0.91 -2.56 117.46 113.06 1lq8 n PHE 308 Ca 0.36 -0.05 -0.25 0.00 -0.05 0.00 0.00 57.45 57.47 1lq8 n PHE 308 Cb 1.83 0.00 -0.08 0.00 -0.94 0.00 0.00 39.48 40.29 1lq8 n PHE 308 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 1lq8 s THR 309 N -1.91 2.43 -1.32 4.37 2.01 0.40 -4.60 115.64 117.03 1lq8 s THR 309 Ca 0.35 -1.83 0.13 0.00 0.31 0.00 0.00 61.69 60.65 1lq8 s THR 309 Cb 0.18 -2.93 0.20 0.00 0.01 0.00 0.00 72.50 69.96 1lq8 s THR 309 CO 0.28 -0.08 1.36 -1.54 -0.69 0.00 0.00 174.62 173.95 1lq8 n SER 310 N -1.10 0.00 -0.64 3.53 3.41 -1.26 -0.89 113.62 116.67 1lq8 n SER 310 Ca -0.03 0.20 0.10 0.00 -0.26 0.00 0.00 58.87 58.89 1lq8 n SER 310 Cb 0.64 -0.34 0.33 0.00 -0.26 0.00 0.00 64.21 64.58 1lq8 n SER 310 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1lq8 n HIS 311 N -1.34 0.27 -1.36 7.33 8.25 -1.26 -4.96 115.22 122.15 1lq8 n HIS 311 Ca 0.05 -0.14 -0.33 0.00 -0.26 0.00 0.00 57.72 57.04 1lq8 n HIS 311 Cb 0.12 0.00 0.10 0.00 1.12 0.00 0.00 29.99 31.32 1lq8 n HIS 311 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1lq8 s ALA 312 N -1.73 2.09 -0.51 -1.41 0.00 -0.07 -4.90 121.76 115.23 1lq8 s ALA 312 Ca 0.32 0.74 0.04 0.00 0.00 0.00 0.00 51.96 53.06 1lq8 s ALA 312 Cb 0.17 -3.43 0.13 0.00 0.00 0.00 0.00 23.12 20.00 1lq8 s ALA 312 CO 0.26 -1.91 0.26 0.34 0.00 0.00 0.00 175.76 174.71 1lq8 s ASP 313 N -2.30 4.19 -0.31 0.00 -1.08 -1.26 -4.92 116.67 110.98 1lq8 s ASP 313 Ca 0.71 -2.96 0.08 0.00 -0.52 0.00 0.00 52.55 49.86 1lq8 s ASP 313 Cb -0.26 -1.52 0.47 0.00 -1.46 0.00 0.00 42.92 40.15 1lq8 s ASP 313 CO 0.47 -0.23 1.38 0.18 0.52 0.00 0.00 175.17 177.49 1lq8 n LEU 314 N 3.17 4.42 0.24 -1.34 4.77 -1.26 -0.94 117.00 126.06 1lq8 n LEU 314 Ca 0.06 -4.18 0.16 0.00 -0.03 0.00 0.00 56.01 52.02 1lq8 n LEU 314 Cb 0.33 -0.55 0.84 0.00 -2.33 0.00 0.00 43.42 41.71 1lq8 n LEU 314 CO 0.32 1.60 0.98 0.77 -1.33 0.00 0.00 177.39 179.73 1lq8 h SER 315 N 1.48 0.00 1.65 -1.43 4.64 -1.77 -1.60 113.55 116.51 1lq8 h SER 315 Ca 0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.58 1lq8 h SER 315 Cb 1.40 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.49 1lq8 h SER 315 CO 0.54 0.00 0.00 1.23 -0.87 0.00 0.00 176.83 177.73 1lq8 h GLY 316 N 0.27 0.00 0.61 -0.77 0.00 -1.68 -3.30 103.07 98.19 1lq8 h GLY 316 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 47.33 46.97 1lq8 h GLY 316 CO 0.00 0.00 -2.00 0.29 0.00 0.00 0.00 176.54 174.83 1lq8 n ILE 317 N -2.91 1.72 -3.82 2.60 -5.35 -0.61 -4.14 119.36 106.86 1lq8 n ILE 317 Ca 0.03 -0.68 -0.09 0.00 -0.27 0.00 0.00 62.75 61.75 1lq8 n ILE 317 Cb 0.45 -1.57 -0.07 0.00 -1.74 0.00 0.00 39.64 36.72 1lq8 n ILE 317 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 1lq8 s SER 318 N -6.81 0.05 -0.19 7.28 1.04 -1.21 -0.88 113.70 112.99 1lq8 s SER 318 Ca -0.20 -0.59 0.08 0.00 0.48 0.00 0.00 55.95 55.72 1lq8 s SER 318 Cb 0.07 0.37 -0.22 0.00 0.10 0.00 0.00 66.02 66.34 1lq8 s SER 318 CO 0.77 -0.76 0.08 -3.20 0.98 0.00 0.00 173.24 171.11 1lq8 n ASN 319 N -0.10 1.13 -1.91 7.02 2.85 -1.26 -4.24 115.26 118.76 1lq8 n ASN 319 Ca -0.15 0.03 -0.02 0.00 -0.11 0.00 0.00 54.58 54.34 1lq8 n ASN 319 Cb 0.63 0.08 -0.02 0.00 1.24 0.00 0.00 39.78 41.71 1lq8 n ASN 319 CO 0.00 0.00 0.00 1.41 -2.11 0.00 0.00 177.26 176.56 1lq8 n HIS 320 N -3.08 0.00 -0.82 1.20 -0.00 -1.26 -4.86 115.22 106.40 1lq8 n HIS 320 Ca -0.35 -0.53 -0.31 0.00 -0.00 0.00 0.00 57.72 56.52 1lq8 n HIS 320 Cb 1.07 -0.53 0.03 0.00 -0.00 0.00 0.00 29.99 30.55 1lq8 n HIS 320 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 1lq8 n SER 321 N 2.05 -2.95 0.00 0.41 2.88 -1.26 -4.61 113.62 110.14 1lq8 n SER 321 Ca 0.06 0.03 0.00 0.00 -1.33 0.00 0.00 58.87 57.63 1lq8 n SER 321 Cb 0.29 -0.45 0.00 0.00 -0.75 0.00 0.00 64.21 63.30 1lq8 n SER 321 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 1lq8 n ASN 322 N 2.85 0.00 0.00 -3.46 5.15 -1.26 -5.12 115.26 113.42 1lq8 n ASN 322 Ca -0.02 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.96 1lq8 n ASN 322 Cb 0.59 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.84 1lq8 n ASN 322 CO 0.00 0.00 0.00 2.30 1.40 0.00 0.00 177.26 180.96 1lq8 n ILE 323 N 0.00 0.00 -3.91 -1.44 -0.00 -1.23 -4.87 119.36 107.91 1lq8 n ILE 323 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 62.75 62.74 1lq8 n ILE 323 Cb 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 39.64 39.64 1lq8 n ILE 323 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1lq8 n GLN 324 N 0.00 0.02 -3.67 6.28 10.64 -1.00 -4.61 117.38 125.04 1lq8 n GLN 324 Ca 0.00 -0.15 -0.39 0.00 -1.83 0.00 0.00 57.00 54.64 1lq8 n GLN 324 Cb 0.00 0.13 -0.12 0.00 -0.86 0.00 0.00 30.24 29.39 1lq8 n GLN 324 CO 0.00 0.00 0.00 0.08 -1.83 0.00 0.00 177.06 175.31 1lq8 s VAL 325 N -2.16 4.44 0.00 -0.39 1.01 -1.06 -2.07 120.40 120.17 1lq8 s VAL 325 Ca 0.02 -0.56 -0.06 0.00 0.00 0.00 0.00 61.98 61.38 1lq8 s VAL 325 Cb 0.00 -3.30 -0.03 0.00 0.00 0.00 0.00 36.38 33.04 1lq8 s VAL 325 CO 0.01 0.02 0.75 0.77 0.00 0.00 0.00 175.10 176.65 1lq8 h SER 326 N 8.33 -0.18 -5.54 3.32 4.64 -0.87 -3.42 113.55 119.84 1lq8 h SER 326 Ca -0.31 0.01 -0.22 0.00 -0.47 0.00 0.00 61.79 60.80 1lq8 h SER 326 Cb 1.13 0.05 -0.14 0.00 -0.31 0.00 0.00 62.40 63.13 1lq8 h SER 326 CO 0.62 -0.09 -0.57 -1.83 -0.87 0.00 0.00 176.83 174.09 1lq8 s GLU 327 N -2.83 1.21 -0.42 4.77 -1.05 -1.24 -4.95 118.70 114.19 1lq8 s GLU 327 Ca -0.03 -1.57 0.02 0.00 -0.15 0.00 0.00 54.97 53.24 1lq8 s GLU 327 Cb 0.00 0.29 0.15 0.00 -0.44 0.00 0.00 34.13 34.13 1lq8 s GLU 327 CO 0.09 -0.40 0.29 1.41 0.95 0.00 0.00 175.26 177.60 1lq8 s MET 328 N -4.13 0.97 0.15 -4.83 -2.45 -1.26 -1.33 119.30 106.42 1lq8 s MET 328 Ca 0.36 -1.91 -0.30 0.00 -1.25 0.00 0.00 55.69 52.59 1lq8 s MET 328 Cb 0.06 -1.69 -0.07 0.00 1.25 0.00 0.00 34.83 34.38 1lq8 s MET 328 CO 0.11 -1.28 0.98 0.08 1.05 0.00 0.00 175.02 175.96 1lq8 s VAL 329 N 0.35 4.30 -0.01 10.11 1.01 -0.53 -0.80 120.40 134.83 1lq8 s VAL 329 Ca 0.24 2.00 0.06 0.00 0.00 0.00 0.00 61.98 64.28 1lq8 s VAL 329 Cb -0.11 -4.27 -0.02 0.00 0.00 0.00 0.00 36.38 31.98 1lq8 s VAL 329 CO -0.09 0.35 -0.20 -2.28 0.00 0.00 0.00 175.10 172.89 1lq8 s HIS 330 N -0.29 1.75 -0.05 5.22 2.46 -0.04 -0.00 115.29 124.35 1lq8 s HIS 330 Ca 0.46 -0.33 -0.02 0.00 0.47 0.00 0.00 55.06 55.64 1lq8 s HIS 330 Cb -0.25 -1.13 0.03 0.00 -0.13 0.00 0.00 32.58 31.10 1lq8 s HIS 330 CO 0.31 -0.03 0.11 0.21 -2.47 0.00 0.00 174.74 172.87 1lq8 s LYS 331 N -0.47 0.07 0.00 2.88 2.20 0.20 -1.52 119.74 123.12 1lq8 s LYS 331 Ca 0.08 0.28 -0.01 0.00 -0.36 0.00 0.00 55.97 55.95 1lq8 s LYS 331 Cb -0.08 -0.13 -0.00 0.00 -1.51 0.00 0.00 37.83 36.11 1lq8 s LYS 331 CO -0.01 -0.13 0.01 0.00 -0.36 0.00 0.00 175.35 174.86 1lq8 s ALA 332 N 0.87 -0.01 0.04 3.13 0.00 -0.54 0.01 121.76 125.26 1lq8 s ALA 332 Ca -0.07 -0.12 0.01 0.00 0.00 0.00 0.00 51.96 51.79 1lq8 s ALA 332 Cb -0.09 0.02 -0.03 0.00 0.00 0.00 0.00 23.12 23.03 1lq8 s ALA 332 CO -0.04 -0.05 -0.05 0.14 0.00 0.00 0.00 175.76 175.76 1lq8 s VAL 333 N -0.39 0.36 -0.05 0.00 -7.23 0.31 -1.13 120.40 112.27 1lq8 s VAL 333 Ca -0.04 -1.14 -0.07 0.00 -1.81 0.00 0.00 61.98 58.92 1lq8 s VAL 333 Cb -0.03 -0.63 0.01 0.00 0.56 0.00 0.00 36.38 36.30 1lq8 s VAL 333 CO -0.00 -0.52 0.17 0.54 -0.31 0.00 0.00 175.10 174.98 1lq8 s VAL 334 N -1.79 0.03 -0.07 1.32 0.11 -0.78 -1.68 120.40 117.54 1lq8 s VAL 334 Ca -0.09 -0.21 0.02 0.00 -2.93 0.00 0.00 61.98 58.77 1lq8 s VAL 334 Cb -0.07 -0.32 0.01 0.00 -1.53 0.00 0.00 36.38 34.47 1lq8 s VAL 334 CO -0.01 -0.12 -0.14 -1.61 -3.33 0.00 0.00 175.10 169.89 1lq8 s GLU 335 N -0.37 1.88 -0.20 1.54 2.02 0.15 -2.56 118.70 121.16 1lq8 s GLU 335 Ca -0.05 -0.47 -0.02 0.00 0.02 0.00 0.00 54.97 54.45 1lq8 s GLU 335 Cb -0.03 -1.52 0.06 0.00 0.10 0.00 0.00 34.13 32.73 1lq8 s GLU 335 CO 0.01 0.04 0.01 0.08 0.02 0.00 0.00 175.26 175.42 1lq8 s VAL 336 N 0.64 0.77 0.00 2.63 1.01 0.32 -0.71 120.40 125.05 1lq8 s VAL 336 Ca -0.15 -0.68 0.00 0.00 0.00 0.00 0.00 61.98 61.16 1lq8 s VAL 336 Cb -0.16 -1.19 0.00 0.00 0.00 0.00 0.00 36.38 35.03 1lq8 s VAL 336 CO 0.04 -0.14 0.00 -0.90 0.00 0.00 0.00 175.10 174.10 1lq8 n ASP 337 N 4.96 1.51 0.15 3.32 5.68 -0.96 -1.71 116.55 129.50 1lq8 n ASP 337 Ca -0.10 -0.16 0.13 0.00 -0.50 0.00 0.00 54.79 54.16 1lq8 n ASP 337 Cb 0.47 0.00 0.41 0.00 -1.14 0.00 0.00 41.12 40.85 1lq8 n ASP 337 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 1lq8 h GLU 338 N 0.00 0.00 0.15 0.11 9.09 -1.99 -3.31 114.58 118.63 1lq8 h GLU 338 Ca 0.00 0.00 -0.32 0.00 0.05 0.00 0.00 59.36 59.09 1lq8 h GLU 338 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.10 1lq8 h GLU 338 CO 0.00 0.00 -1.65 0.77 0.05 0.00 0.00 179.01 178.18 1lq8 h SER 339 N 0.00 0.49 0.00 3.06 0.02 -1.96 -1.49 113.55 113.67 1lq8 h SER 339 Ca 0.00 -0.90 0.00 0.00 -0.84 0.00 0.00 61.79 60.05 1lq8 h SER 339 Cb 0.69 -0.16 0.00 0.00 0.14 0.00 0.00 62.40 63.07 1lq8 h SER 339 CO 0.00 1.73 0.00 0.61 -1.14 0.00 0.00 176.83 178.03 1lq8 n GLY 340 N 1.83 -0.92 3.02 -3.77 0.00 -1.25 0.12 105.19 104.22 1lq8 n GLY 340 Ca -0.26 0.04 -0.10 0.00 0.00 0.00 0.00 46.02 45.70 1lq8 n GLY 340 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1lq8 s THR 341 N -3.40 0.10 -0.11 2.61 2.01 -0.04 -2.26 115.64 114.55 1lq8 s THR 341 Ca 0.00 -0.79 0.00 0.00 0.31 0.00 0.00 61.69 61.21 1lq8 s THR 341 Cb 0.00 -0.30 0.02 0.00 0.01 0.00 0.00 72.50 72.23 1lq8 s THR 341 CO 0.00 -0.44 -0.09 -0.60 -0.69 0.00 0.00 174.62 172.81 1lq8 s ARG 342 N -1.36 1.60 -0.04 4.92 3.52 0.11 -1.83 118.95 125.87 1lq8 s ARG 342 Ca -0.15 -0.30 -0.06 0.00 -0.13 0.00 0.00 55.73 55.10 1lq8 s ARG 342 Cb -0.09 -1.58 0.01 0.00 -1.56 0.00 0.00 34.95 31.73 1lq8 s ARG 342 CO -0.00 -0.21 0.14 0.00 -0.81 0.00 0.00 175.30 174.42 1lq8 s ALA 343 N 1.51 -0.35 0.17 6.12 0.00 0.19 0.30 121.76 129.70 1lq8 s ALA 343 Ca 0.01 0.23 -0.17 0.00 0.00 0.00 0.00 51.96 52.03 1lq8 s ALA 343 Cb -0.13 -0.13 0.03 0.00 0.00 0.00 0.00 23.12 22.89 1lq8 s ALA 343 CO -0.06 -0.12 0.48 0.00 0.00 0.00 0.00 175.76 176.05 1lq8 s ALA 344 N -0.42 -0.93 0.06 0.00 0.00 -0.67 0.98 121.76 120.77 1lq8 s ALA 344 Ca -0.05 -0.15 -0.26 0.00 0.00 0.00 0.00 51.96 51.50 1lq8 s ALA 344 Cb -0.03 0.80 0.09 0.00 0.00 0.00 0.00 23.12 23.98 1lq8 s ALA 344 CO 0.01 -0.74 0.79 0.00 0.00 0.00 0.00 175.76 175.81 1lq8 s ALA 345 N -3.85 -1.73 0.02 0.00 0.00 -0.48 -0.53 121.76 115.19 1lq8 s ALA 345 Ca 0.07 0.77 -0.04 0.00 0.00 0.00 0.00 51.96 52.76 1lq8 s ALA 345 Cb 0.00 0.60 -0.01 0.00 0.00 0.00 0.00 23.12 23.71 1lq8 s ALA 345 CO -0.06 -0.74 0.05 0.00 0.00 0.00 0.00 175.76 175.01 1lq8 s ALA 346 N -3.37 -0.06 -0.09 0.00 0.00 0.10 -0.18 121.76 118.16 1lq8 s ALA 346 Ca 0.04 -0.44 0.01 0.00 0.00 0.00 0.00 51.96 51.57 1lq8 s ALA 346 Cb -0.01 0.16 0.02 0.00 0.00 0.00 0.00 23.12 23.29 1lq8 s ALA 346 CO -0.10 -0.21 -0.09 0.99 0.00 0.00 0.00 175.76 176.35 1lq8 s THR 347 N -1.71 1.04 -0.26 0.00 2.01 0.42 -0.62 115.64 116.52 1lq8 s THR 347 Ca -0.13 -0.35 -0.01 0.00 0.31 0.00 0.00 61.69 61.51 1lq8 s THR 347 Cb -0.07 -1.02 0.03 0.00 0.01 0.00 0.00 72.50 71.45 1lq8 s THR 347 CO -0.01 0.36 -0.06 -0.83 -0.69 0.00 0.00 174.62 173.39 1lq8 s GLY 348 N 1.28 1.65 -0.41 4.40 0.00 0.99 -1.10 107.32 114.13 1lq8 s GLY 348 Ca -0.03 -1.54 -0.16 0.00 0.00 0.00 0.00 44.72 42.99 1lq8 s GLY 348 CO -0.03 0.55 0.36 -1.59 0.00 0.00 0.00 173.10 172.39 1lq8 s THR 349 N 1.29 5.18 -0.25 0.90 2.01 0.82 -1.46 115.64 124.13 1lq8 s THR 349 Ca -0.02 -0.48 -0.11 0.00 0.31 0.00 0.00 61.69 61.39 1lq8 s THR 349 Cb -0.17 -3.97 -0.05 0.00 0.01 0.00 0.00 72.50 68.32 1lq8 s THR 349 CO -0.04 -0.34 0.20 -0.63 -0.69 0.00 0.00 174.62 173.12 1lq8 s ILE 350 N 1.90 5.32 -0.19 1.82 1.01 -0.44 -0.94 121.20 129.68 1lq8 s ILE 350 Ca 0.08 0.25 -0.07 0.00 0.00 0.00 0.00 60.65 60.91 1lq8 s ILE 350 Cb -0.18 -3.54 -0.04 0.00 0.01 0.00 0.00 42.46 38.71 1lq8 s ILE 350 CO 0.12 0.30 0.05 -0.36 0.00 0.00 0.00 174.94 175.04 1lq8 s PHE 351 N 1.32 3.18 0.44 3.97 0.40 -0.16 -0.17 117.98 126.97 1lq8 s PHE 351 Ca 0.09 -0.06 0.06 0.00 -0.60 0.00 0.00 56.93 56.42 1lq8 s PHE 351 Cb -0.14 -2.08 -0.05 0.00 0.51 0.00 0.00 43.02 41.26 1lq8 s PHE 351 CO 0.07 0.05 0.10 0.95 0.70 0.00 0.00 175.22 177.09 1lq8 s THR 352 N 0.55 1.91 -0.22 0.64 -4.23 -0.88 -1.80 115.64 111.61 1lq8 s THR 352 Ca 0.02 -1.85 -0.18 0.00 -1.18 0.00 0.00 61.69 58.50 1lq8 s THR 352 Cb -0.13 -2.76 -0.15 0.00 1.34 0.00 0.00 72.50 70.80 1lq8 s THR 352 CO 0.01 0.00 -0.02 0.33 -0.54 0.00 0.00 174.62 174.40 1lq8 n PHE 353 N -1.19 0.67 -0.26 3.99 7.35 -0.78 -2.36 117.46 124.88 1lq8 n PHE 353 Ca -0.06 0.29 0.00 0.00 -0.76 0.00 0.00 57.45 56.92 1lq8 n PHE 353 Cb 0.66 -1.00 0.00 0.00 0.35 0.00 0.00 39.48 39.49 1lq8 n PHE 353 CO 0.00 0.00 0.00 -2.13 -0.76 0.00 0.00 176.76 173.87