#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pq2 s LEU 29 N 0.00 3.17 0.51 3.14 1.43 -1.26 -1.65 118.68 124.03 1pq2 s LEU 29 Ca 0.00 2.35 -0.23 0.00 -1.03 0.00 0.00 54.13 55.22 1pq2 s LEU 29 Cb 0.00 -4.59 -0.06 0.00 0.03 0.00 0.00 46.19 41.57 1pq2 s LEU 29 CO 0.00 -2.57 1.39 -2.65 0.23 0.00 0.00 176.35 172.74 1pq2 n PRO 30 N -3.20 1.89 -1.65 1.29 -0.02 -1.26 -4.87 135.00 127.19 1pq2 n PRO 30 Ca 0.13 0.69 -0.39 0.00 -2.02 0.00 0.00 63.50 61.91 1pq2 n PRO 30 Cb 0.50 -2.60 0.04 0.00 -0.02 0.00 0.00 33.50 31.43 1pq2 n PRO 30 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1pq2 n PRO 31 N -0.73 1.25 -3.79 0.52 -0.02 -1.26 -3.50 135.00 127.46 1pq2 n PRO 31 Ca 0.09 0.47 -0.01 0.00 -2.02 0.00 0.00 63.50 62.02 1pq2 n PRO 31 Cb 0.43 -2.27 0.00 0.00 -0.02 0.00 0.00 33.50 31.65 1pq2 n PRO 31 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1pq2 s GLY 32 N -1.03 -0.15 0.19 -1.23 0.00 -1.26 -2.25 107.32 101.59 1pq2 s GLY 32 Ca 0.72 0.10 -0.33 0.00 0.00 0.00 0.00 44.72 45.21 1pq2 s GLY 32 CO 0.50 1.51 1.31 -1.05 0.00 0.00 0.00 173.10 175.37 1pq2 n PRO 33 N -0.60 1.57 -2.13 2.90 -0.02 -1.25 -4.88 135.00 130.58 1pq2 n PRO 33 Ca -0.04 0.56 -0.43 0.00 -2.02 0.00 0.00 63.50 61.57 1pq2 n PRO 33 Cb 0.61 -2.15 -0.03 0.00 -0.02 0.00 0.00 33.50 31.91 1pq2 n PRO 33 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1pq2 s THR 34 N 0.02 3.74 0.21 3.45 2.01 -1.26 -4.86 115.64 118.96 1pq2 s THR 34 Ca 0.73 0.86 -0.30 0.00 0.31 0.00 0.00 61.69 63.29 1pq2 s THR 34 Cb -0.77 -3.68 -0.08 0.00 0.01 0.00 0.00 72.50 67.97 1pq2 s THR 34 CO 0.49 -0.22 1.00 -2.16 -0.69 0.00 0.00 174.62 173.04 1pq2 s PRO 35 N 4.38 4.75 -0.07 4.92 0.04 -1.26 -4.88 135.00 142.87 1pq2 s PRO 35 Ca 0.70 1.58 -0.30 0.00 0.04 0.00 0.00 61.00 63.02 1pq2 s PRO 35 Cb -0.26 -3.28 -0.02 0.00 0.04 0.00 0.00 34.50 30.98 1pq2 s PRO 35 CO 0.27 0.34 1.00 -0.51 0.04 0.00 0.00 177.00 178.14 1pq2 s LEU 36 N -0.88 4.29 0.48 -3.56 1.02 -0.13 -4.87 118.68 115.02 1pq2 s LEU 36 Ca 0.44 1.57 0.40 0.00 0.02 0.00 0.00 54.13 56.56 1pq2 s LEU 36 Cb -0.27 -3.56 1.57 0.00 0.02 0.00 0.00 46.19 43.95 1pq2 s LEU 36 CO 0.34 -0.39 1.53 -2.65 0.02 0.00 0.00 176.35 175.20 1pq2 n PRO 37 N 4.66 -0.02 -0.06 1.29 -0.02 -1.26 -0.00 135.00 139.59 1pq2 n PRO 37 Ca 0.08 1.15 -0.08 0.00 -2.02 0.00 0.00 63.50 62.63 1pq2 n PRO 37 Cb 0.49 -2.44 -0.07 0.00 -0.02 0.00 0.00 33.50 31.47 1pq2 n PRO 37 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 1pq2 n ILE 38 N -4.31 0.74 -0.10 4.25 -0.00 -1.26 -4.54 119.36 114.14 1pq2 n ILE 38 Ca 0.42 -0.35 0.12 0.00 -0.00 0.00 0.00 62.75 62.93 1pq2 n ILE 38 Cb 1.74 -0.87 0.28 0.00 -0.00 0.00 0.00 39.64 40.80 1pq2 n ILE 38 CO 0.00 0.00 0.00 2.30 -0.00 0.00 0.00 176.55 178.85 1pq2 n ILE 39 N -2.69 0.80 0.00 1.39 -0.00 -1.13 -4.12 119.36 113.61 1pq2 n ILE 39 Ca -0.21 -0.90 0.00 0.00 -0.00 0.00 0.00 62.75 61.64 1pq2 n ILE 39 Cb 0.79 0.70 0.00 0.00 -0.00 0.00 0.00 39.64 41.13 1pq2 n ILE 39 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 1pq2 n GLY 40 N 1.61 2.81 1.51 3.28 0.00 0.99 -0.06 105.19 115.32 1pq2 n GLY 40 Ca 0.23 0.15 -0.01 0.00 0.00 0.00 0.00 46.02 46.39 1pq2 n GLY 40 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1pq2 n ASN 41 N 3.20 4.13 -0.29 1.61 4.13 -0.75 -0.96 115.26 126.32 1pq2 n ASN 41 Ca 0.00 -3.26 0.11 0.00 1.68 0.00 0.00 54.58 53.11 1pq2 n ASN 41 Cb 0.00 -0.66 0.26 0.00 -1.54 0.00 0.00 39.78 37.84 1pq2 n ASN 41 CO 0.00 0.00 0.00 -0.03 0.28 0.00 0.00 177.26 177.51 1pq2 h MET 42 N 2.11 0.21 -0.00 3.52 4.05 -0.58 0.35 114.93 124.60 1pq2 h MET 42 Ca 0.17 -0.01 0.00 0.00 -0.28 0.00 0.00 59.70 59.58 1pq2 h MET 42 Cb 1.94 -0.05 0.00 0.00 -0.80 0.00 0.00 31.60 32.69 1pq2 h MET 42 CO 0.52 0.14 -0.27 1.28 0.23 0.00 0.00 176.91 178.80 1pq2 n LEU 43 N -5.22 0.36 -0.30 3.39 4.32 -1.26 -3.23 117.00 115.07 1pq2 n LEU 43 Ca 0.20 0.15 0.12 0.00 -0.02 0.00 0.00 56.01 56.45 1pq2 n LEU 43 Cb 0.63 -0.31 0.54 0.00 -1.62 0.00 0.00 43.42 42.66 1pq2 n LEU 43 CO 0.07 0.08 0.87 0.00 -1.22 0.00 0.00 177.39 177.19 1pq2 n GLN 44 N -1.38 1.39 -4.87 3.23 3.00 0.11 -4.82 117.38 114.03 1pq2 n GLN 44 Ca 0.08 -0.59 -0.25 0.00 -0.01 0.00 0.00 57.00 56.22 1pq2 n GLN 44 Cb 0.33 -1.40 -0.16 0.00 0.00 0.00 0.00 30.24 29.02 1pq2 n GLN 44 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.06 177.48 1pq2 s ILE 45 N -1.92 1.44 -0.43 5.09 1.01 -1.18 -5.03 121.20 120.17 1pq2 s ILE 45 Ca 0.34 -0.77 -0.21 0.00 0.00 0.00 0.00 60.65 60.02 1pq2 s ILE 45 Cb 0.17 -1.20 0.02 0.00 0.01 0.00 0.00 42.46 41.47 1pq2 s ILE 45 CO 0.28 0.41 0.65 -0.62 0.00 0.00 0.00 174.94 175.65 1pq2 s ASP 46 N -0.35 6.33 0.63 3.58 3.68 -1.26 -4.93 116.67 124.34 1pq2 s ASP 46 Ca 0.05 -0.30 0.34 0.00 2.13 0.00 0.00 52.55 54.77 1pq2 s ASP 46 Cb -0.08 -2.32 1.91 0.00 -1.45 0.00 0.00 42.92 40.99 1pq2 s ASP 46 CO -0.00 -0.77 2.18 -0.37 0.13 0.00 0.00 175.17 176.34 1pq2 h VAL 47 N 5.87 0.27 0.00 1.11 -1.51 -1.96 -2.65 116.25 117.38 1pq2 h VAL 47 Ca -0.25 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.22 1pq2 h VAL 47 Cb 1.10 0.89 0.00 0.00 -2.13 0.00 0.00 31.29 31.14 1pq2 h VAL 47 CO 0.89 0.00 0.00 0.29 -1.23 0.00 0.00 177.57 177.52 1pq2 n LYS 48 N -3.46 0.00 -0.86 5.19 5.02 -1.26 -3.87 118.16 118.92 1pq2 n LYS 48 Ca -0.01 0.00 -0.20 0.00 -2.02 0.00 0.00 58.31 56.08 1pq2 n LYS 48 Cb 0.22 -0.14 -0.07 0.00 -0.02 0.00 0.00 35.03 35.02 1pq2 n LYS 48 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1pq2 n ASP 49 N 0.00 5.29 0.25 4.39 -0.08 -1.25 -4.24 116.55 120.91 1pq2 n ASP 49 Ca 0.00 -2.33 0.10 0.00 -1.51 0.00 0.00 54.79 51.05 1pq2 n ASP 49 Cb 0.00 -1.17 0.51 0.00 2.34 0.00 0.00 41.12 42.80 1pq2 n ASP 49 CO 0.00 0.00 0.00 -0.29 0.12 0.00 0.00 177.20 177.03 1pq2 h ILE 50 N 2.82 0.00 -0.01 5.18 -0.00 -1.58 0.18 117.51 124.10 1pq2 h ILE 50 Ca 0.42 0.00 -0.22 0.00 -0.00 0.00 0.00 64.86 65.07 1pq2 h ILE 50 Cb 0.61 0.41 0.02 0.00 -0.00 0.00 0.00 36.82 37.86 1pq2 h ILE 50 CO 1.01 0.00 -0.84 0.00 -0.00 0.00 0.00 178.15 178.33 1pq2 h LYS 52 N 0.19 0.57 -0.90 0.00 1.63 -1.02 -0.44 116.57 116.59 1pq2 h LYS 52 Ca -0.10 -0.14 0.02 0.00 -0.85 0.00 0.00 60.65 59.58 1pq2 h LYS 52 Cb 1.51 -0.07 -0.05 0.00 -0.60 0.00 0.00 32.23 33.02 1pq2 h LYS 52 CO 0.17 0.61 0.59 0.77 -3.45 0.00 0.00 179.45 178.14 1pq2 h SER 53 N 0.54 1.00 -0.14 4.20 0.02 -1.56 0.19 113.55 117.80 1pq2 h SER 53 Ca 0.11 -0.02 -0.13 0.00 -0.84 0.00 0.00 61.79 60.92 1pq2 h SER 53 Cb 0.39 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.69 1pq2 h SER 53 CO 0.02 0.70 -0.34 -0.26 -1.14 0.00 0.00 176.83 175.81 1pq2 h PHE 54 N 1.17 0.75 -0.06 3.45 0.04 -1.25 -1.95 116.94 119.09 1pq2 h PHE 54 Ca 0.35 -0.20 -0.01 0.00 2.80 0.00 0.00 57.97 60.90 1pq2 h PHE 54 Cb -0.06 -0.17 -0.00 0.00 2.20 0.00 0.00 35.95 37.92 1pq2 h PHE 54 CO -0.01 0.90 -0.01 1.15 -0.60 0.00 0.00 178.31 179.74 1pq2 h THR 55 N 0.54 1.27 -0.35 -1.55 2.02 -0.28 -3.06 112.91 111.51 1pq2 h THR 55 Ca 0.06 -0.85 0.06 0.00 0.77 0.00 0.00 66.41 66.45 1pq2 h THR 55 Cb 0.85 1.73 -0.05 0.00 -1.74 0.00 0.00 68.15 68.93 1pq2 h THR 55 CO 0.07 0.23 0.01 0.78 0.37 0.00 0.00 175.52 176.99 1pq2 h ASN 56 N -0.21 -0.11 -0.06 4.18 -0.26 -0.61 0.13 115.58 118.64 1pq2 h ASN 56 Ca 0.02 0.08 0.02 0.00 -0.56 0.00 0.00 56.30 55.85 1pq2 h ASN 56 Cb 0.38 0.13 -0.00 0.00 -1.06 0.00 0.00 38.32 37.76 1pq2 h ASN 56 CO 0.00 -0.02 0.24 -0.26 -1.06 0.00 0.00 177.43 176.34 1pq2 h PHE 57 N 0.11 0.00 0.04 1.19 0.05 -1.30 -0.58 116.94 116.46 1pq2 h PHE 57 Ca 0.17 0.00 -0.22 0.00 3.82 0.00 0.00 57.97 61.74 1pq2 h PHE 57 Cb 0.23 0.00 -0.01 0.00 2.00 0.00 0.00 35.95 38.17 1pq2 h PHE 57 CO -0.23 0.00 -1.02 0.66 -0.18 0.00 0.00 178.31 177.54 1pq2 h SER 58 N 0.00 0.25 0.60 2.17 4.64 -0.86 -1.43 113.55 118.92 1pq2 h SER 58 Ca 0.03 -0.23 0.00 0.00 -0.47 0.00 0.00 61.79 61.12 1pq2 h SER 58 Cb 0.52 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.53 1pq2 h SER 58 CO -0.00 1.11 0.00 0.11 -0.87 0.00 0.00 176.83 177.18 1pq2 h LYS 59 N 0.07 0.00 0.00 4.77 1.57 -1.04 0.78 116.57 122.73 1pq2 h LYS 59 Ca -0.06 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 1pq2 h LYS 59 Cb 1.71 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.02 1pq2 h LYS 59 CO 0.15 0.00 -0.31 0.28 -0.57 0.00 0.00 179.45 179.01 1pq2 n VAL 60 N -2.84 0.66 0.72 0.50 0.31 -1.14 -4.74 118.33 111.80 1pq2 n VAL 60 Ca -0.00 0.36 0.12 0.00 -0.01 0.00 0.00 64.34 64.80 1pq2 n VAL 60 Cb 0.20 -1.90 0.14 0.00 -0.91 0.00 0.00 33.84 31.37 1pq2 n VAL 60 CO 0.00 0.00 0.00 -1.22 -1.32 0.00 0.00 176.83 174.29 1pq2 n TYR 61 N -3.36 0.28 0.00 3.52 4.01 -0.55 -5.10 117.16 115.96 1pq2 n TYR 61 Ca -0.04 0.08 0.00 0.00 -0.16 0.00 0.00 57.90 57.78 1pq2 n TYR 61 Cb 0.16 -0.44 0.00 0.00 -0.31 0.00 0.00 39.34 38.75 1pq2 n TYR 61 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1pq2 n GLY 62 N 1.40 -1.19 0.13 2.72 0.00 0.27 -4.77 105.19 103.74 1pq2 n GLY 62 Ca 0.04 -2.10 -0.13 0.00 0.00 0.00 0.00 46.02 43.82 1pq2 n GLY 62 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1pq2 h PRO 63 N 0.59 -0.22 -5.23 1.61 0.11 -1.80 -3.39 132.00 123.67 1pq2 h PRO 63 Ca 0.00 0.01 -0.62 0.00 0.11 0.00 0.00 66.00 65.51 1pq2 h PRO 63 Cb 0.00 0.05 -0.15 0.00 0.11 0.00 0.00 31.00 31.01 1pq2 h PRO 63 CO 0.00 -0.03 -0.54 0.08 -0.21 0.00 0.00 178.00 177.30 1pq2 s VAL 64 N -5.58 4.96 0.18 3.15 1.01 -1.26 0.16 120.40 123.02 1pq2 s VAL 64 Ca -0.14 0.03 -0.16 0.00 0.00 0.00 0.00 61.98 61.70 1pq2 s VAL 64 Cb 0.04 -3.26 0.03 0.00 0.00 0.00 0.00 36.38 33.19 1pq2 s VAL 64 CO 0.64 0.43 0.47 0.72 0.00 0.00 0.00 175.10 177.36 1pq2 s PHE 65 N 0.55 -0.08 -0.17 5.22 -0.12 -0.40 -4.60 117.98 118.38 1pq2 s PHE 65 Ca 0.05 -0.26 0.01 0.00 -0.05 0.00 0.00 56.93 56.68 1pq2 s PHE 65 Cb -0.12 0.32 0.01 0.00 -0.63 0.00 0.00 43.02 42.60 1pq2 s PHE 65 CO 0.01 -0.85 -0.20 0.99 -0.05 0.00 0.00 175.22 175.11 1pq2 s THR 66 N -3.87 2.14 0.00 -4.49 2.01 -0.96 0.52 115.64 111.00 1pq2 s THR 66 Ca 0.09 -0.93 0.08 0.00 0.31 0.00 0.00 61.69 61.24 1pq2 s THR 66 Cb 0.00 -1.88 -0.02 0.00 0.01 0.00 0.00 72.50 70.61 1pq2 s THR 66 CO -0.04 0.54 -0.23 0.54 -0.69 0.00 0.00 174.62 174.73 1pq2 s VAL 67 N 1.10 1.86 0.08 3.82 0.11 -1.00 -3.86 120.40 122.52 1pq2 s VAL 67 Ca 0.00 -1.09 0.03 0.00 -2.93 0.00 0.00 61.98 57.99 1pq2 s VAL 67 Cb -0.14 -1.56 -0.04 0.00 -1.53 0.00 0.00 36.38 33.11 1pq2 s VAL 67 CO -0.08 0.45 0.09 -0.31 -3.33 0.00 0.00 175.10 171.92 1pq2 s TYR 68 N -0.63 3.22 0.00 1.54 1.51 -1.26 -0.97 117.35 120.76 1pq2 s TYR 68 Ca 0.09 0.09 0.00 0.00 -1.01 0.00 0.00 57.07 56.24 1pq2 s TYR 68 Cb -0.09 -1.63 0.00 0.00 -0.11 0.00 0.00 41.96 40.13 1pq2 s TYR 68 CO 0.00 0.53 0.00 1.19 -1.11 0.00 0.00 175.55 176.16 1pq2 n PHE 69 N 0.40 0.00 0.00 2.71 3.72 -0.90 -1.82 117.46 121.58 1pq2 n PHE 69 Ca -0.08 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.32 1pq2 n PHE 69 Cb 0.52 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.06 1pq2 n PHE 69 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1pq2 n GLY 70 N 3.43 1.23 0.89 1.37 0.00 -1.26 -3.30 105.19 107.55 1pq2 n GLY 70 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 1pq2 n GLY 70 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1pq2 n MET 71 N 0.00 2.21 -2.77 1.61 1.56 -1.26 -3.41 117.12 115.05 1pq2 n MET 71 Ca 0.00 -1.78 -0.43 0.00 -0.27 0.00 0.00 57.70 55.22 1pq2 n MET 71 Cb 0.00 -1.47 -0.03 0.00 2.15 0.00 0.00 33.22 33.86 1pq2 n MET 71 CO 0.00 0.00 0.00 -0.80 -0.73 0.00 0.00 175.97 174.44 1pq2 s ASN 72 N -1.79 6.63 0.37 6.12 0.02 -1.26 -5.05 114.94 119.98 1pq2 s ASN 72 Ca 0.33 0.45 -0.26 0.00 -1.02 0.00 0.00 52.86 52.36 1pq2 s ASN 72 Cb 0.21 -2.48 -0.09 0.00 0.02 0.00 0.00 41.25 38.91 1pq2 s ASN 72 CO 0.31 -0.97 1.14 -2.16 0.02 0.00 0.00 177.10 175.44 1pq2 s PRO 73 N 3.71 4.20 -0.31 -0.60 0.04 -1.26 -2.11 135.00 138.66 1pq2 s PRO 73 Ca 0.40 1.80 -0.02 0.00 0.04 0.00 0.00 61.00 63.21 1pq2 s PRO 73 Cb -0.11 -2.77 0.11 0.00 0.04 0.00 0.00 34.50 31.78 1pq2 s PRO 73 CO 0.23 -0.19 0.16 0.42 0.04 0.00 0.00 177.00 177.66 1pq2 s ILE 74 N -1.39 0.09 -0.04 0.56 1.01 -0.15 -3.64 121.20 117.64 1pq2 s ILE 74 Ca 0.54 -1.15 -0.30 0.00 0.00 0.00 0.00 60.65 59.74 1pq2 s ILE 74 Cb -0.30 -1.09 -0.03 0.00 0.01 0.00 0.00 42.46 41.06 1pq2 s ILE 74 CO 0.38 -0.82 1.06 0.54 0.00 0.00 0.00 174.94 176.10 1pq2 s VAL 75 N 1.69 4.63 -0.02 2.92 0.11 -1.09 -2.36 120.40 126.27 1pq2 s VAL 75 Ca 0.12 1.90 -0.01 0.00 -2.93 0.00 0.00 61.98 61.06 1pq2 s VAL 75 Cb -0.19 -4.22 -0.04 0.00 -1.53 0.00 0.00 36.38 30.41 1pq2 s VAL 75 CO -0.23 0.06 0.07 -0.69 -3.33 0.00 0.00 175.10 170.99 1pq2 s VAL 76 N 1.63 4.68 -0.11 2.04 1.01 0.19 -2.79 120.40 127.04 1pq2 s VAL 76 Ca 0.52 -0.36 0.03 0.00 0.00 0.00 0.00 61.98 62.17 1pq2 s VAL 76 Cb -0.22 -3.11 0.00 0.00 0.00 0.00 0.00 36.38 33.06 1pq2 s VAL 76 CO 0.23 0.40 -0.23 -0.36 0.00 0.00 0.00 175.10 175.15 1pq2 s PHE 77 N -1.13 2.55 -0.01 5.22 0.08 -0.58 -1.27 117.98 122.84 1pq2 s PHE 77 Ca 0.21 -1.13 0.06 0.00 0.12 0.00 0.00 56.93 56.18 1pq2 s PHE 77 Cb -0.12 -1.72 -0.01 0.00 -0.57 0.00 0.00 43.02 40.60 1pq2 s PHE 77 CO 0.11 -0.48 -0.18 -1.58 -0.10 0.00 0.00 175.22 172.99 1pq2 s HIS 78 N 0.52 1.63 0.00 0.36 5.65 0.12 -2.29 115.29 121.27 1pq2 s HIS 78 Ca -0.15 -0.31 0.00 0.00 0.25 0.00 0.00 55.06 54.85 1pq2 s HIS 78 Cb -0.17 -1.05 0.00 0.00 -1.18 0.00 0.00 32.58 30.18 1pq2 s HIS 78 CO 0.05 -0.03 0.00 0.41 -0.65 0.00 0.00 174.74 174.52 1pq2 n GLY 79 N 2.65 -1.33 0.40 1.59 0.00 -1.26 -4.28 105.19 102.96 1pq2 n GLY 79 Ca -0.15 -1.34 -0.07 0.00 0.00 0.00 0.00 46.02 44.45 1pq2 n GLY 79 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1pq2 h TYR 80 N 0.00 -1.39 -1.00 1.61 3.20 -1.92 0.15 116.97 117.61 1pq2 h TYR 80 Ca 0.00 0.10 0.17 0.00 3.14 0.00 0.00 58.73 62.13 1pq2 h TYR 80 Cb 0.00 0.72 -0.10 0.00 1.54 0.00 0.00 36.73 38.89 1pq2 h TYR 80 CO 0.00 -0.41 0.62 1.49 -1.64 0.00 0.00 178.16 178.22 1pq2 h GLU 81 N -0.13 0.81 0.10 1.82 4.81 -1.99 0.51 114.58 120.51 1pq2 h GLU 81 Ca 0.21 -0.05 -0.30 0.00 -0.13 0.00 0.00 59.36 59.09 1pq2 h GLU 81 Cb 0.54 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 29.72 1pq2 h GLU 81 CO -0.81 0.54 -1.53 0.00 -0.73 0.00 0.00 179.01 176.47 1pq2 h ALA 82 N 1.61 0.31 -0.27 2.92 0.00 -1.47 -2.71 119.26 119.65 1pq2 h ALA 82 Ca 0.55 -1.13 -0.10 0.00 0.00 0.00 0.00 54.91 54.23 1pq2 h ALA 82 Cb 0.76 0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 1pq2 h ALA 82 CO -0.33 1.18 -0.26 0.28 0.00 0.00 0.00 179.25 180.12 1pq2 h VAL 83 N 0.06 1.27 -0.01 0.00 2.07 0.08 -2.93 116.25 116.79 1pq2 h VAL 83 Ca -0.24 -1.30 -0.14 0.00 0.82 0.00 0.00 66.70 65.84 1pq2 h VAL 83 Cb 2.00 1.34 0.01 0.00 -1.52 0.00 0.00 31.29 33.13 1pq2 h VAL 83 CO 0.15 0.42 -0.53 0.50 0.02 0.00 0.00 177.57 178.13 1pq2 h LYS 84 N 0.47 0.38 -0.05 1.57 3.64 -0.12 -2.73 116.57 119.73 1pq2 h LYS 84 Ca 0.07 -0.39 0.01 0.00 -1.27 0.00 0.00 60.65 59.07 1pq2 h LYS 84 Cb 0.70 0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 32.62 1pq2 h LYS 84 CO 0.05 1.07 0.05 1.49 -2.27 0.00 0.00 179.45 179.84 1pq2 h GLU 85 N -0.15 0.00 0.00 1.90 4.81 -1.45 -0.23 114.58 119.46 1pq2 h GLU 85 Ca -0.06 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.12 1pq2 h GLU 85 Cb 1.24 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.62 1pq2 h GLU 85 CO 0.11 0.00 -0.51 0.00 -0.73 0.00 0.00 179.01 177.87 1pq2 h ALA 86 N 1.95 0.05 -0.38 2.92 0.00 -1.56 -2.79 119.26 119.45 1pq2 h ALA 86 Ca 0.02 -0.54 -0.02 0.00 0.00 0.00 0.00 54.91 54.37 1pq2 h ALA 86 Cb 0.13 0.41 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 1pq2 h ALA 86 CO -0.00 0.40 0.15 -0.07 0.00 0.00 0.00 179.25 179.73 1pq2 h LEU 87 N -1.00 0.52 0.00 0.00 4.07 -1.43 -2.87 115.31 114.60 1pq2 h LEU 87 Ca -0.07 -0.17 0.00 0.00 0.08 0.00 0.00 57.88 57.72 1pq2 h LEU 87 Cb 0.60 -0.14 0.00 0.00 1.08 0.00 0.00 40.66 42.20 1pq2 h LEU 87 CO -0.04 0.54 0.00 -0.38 -1.08 0.00 0.00 178.44 177.48 1pq2 n ILE 88 N -4.67 0.00 0.22 1.22 2.08 -0.11 -2.88 119.36 115.22 1pq2 n ILE 88 Ca -0.01 0.00 0.11 0.00 0.56 0.00 0.00 62.75 63.42 1pq2 n ILE 88 Cb 0.14 -0.36 0.38 0.00 -0.75 0.00 0.00 39.64 39.05 1pq2 n ILE 88 CO 0.00 0.00 0.00 0.44 0.56 0.00 0.00 176.55 177.55 1pq2 h ASP 89 N 0.00 0.00 0.00 4.38 3.32 -1.60 0.29 116.42 122.81 1pq2 h ASP 89 Ca 0.00 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 56.94 1pq2 h ASP 89 Cb 0.00 0.00 -0.25 0.00 0.22 0.00 0.00 39.33 39.30 1pq2 h ASP 89 CO 0.00 0.00 -0.82 0.59 -1.72 0.00 0.00 179.24 177.29 1pq2 n ASN 90 N -2.86 0.97 -0.32 6.45 3.02 -1.05 -4.95 115.26 116.51 1pq2 n ASN 90 Ca 0.04 -2.31 0.31 0.00 -0.03 0.00 0.00 54.58 52.60 1pq2 n ASN 90 Cb 0.88 -0.32 0.67 0.00 -0.61 0.00 0.00 39.78 40.40 1pq2 n ASN 90 CO 0.00 0.00 0.00 1.23 -2.62 0.00 0.00 177.26 175.87 1pq2 h GLY 91 N 0.77 0.42 1.54 7.41 0.00 -0.18 -2.01 103.07 111.02 1pq2 h GLY 91 Ca -0.15 -0.07 -0.21 0.00 0.00 0.00 0.00 47.33 46.91 1pq2 h GLY 91 CO 0.06 -0.06 -0.84 -2.09 0.00 0.00 0.00 176.54 173.61 1pq2 h GLU 92 N 0.12 0.43 0.00 4.80 4.22 -1.85 -2.00 114.58 120.31 1pq2 h GLU 92 Ca 0.58 -0.41 -0.13 0.00 0.08 0.00 0.00 59.36 59.48 1pq2 h GLU 92 Cb 2.02 0.10 -0.02 0.00 0.50 0.00 0.00 28.75 31.35 1pq2 h GLU 92 CO -0.11 1.06 -0.63 0.93 -2.18 0.00 0.00 179.01 178.08 1pq2 h GLU 93 N 0.27 0.00 -0.63 1.92 3.07 -1.75 -3.10 114.58 114.36 1pq2 h GLU 93 Ca -0.06 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.80 1pq2 h GLU 93 Cb 1.46 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.37 1pq2 h GLU 93 CO 0.15 0.63 0.00 1.19 -1.40 0.00 0.00 179.01 179.58 1pq2 n PHE 94 N -3.29 1.77 0.95 4.33 3.01 -0.94 -1.15 117.46 122.15 1pq2 n PHE 94 Ca 0.01 -0.65 0.13 0.00 1.01 0.00 0.00 57.45 57.95 1pq2 n PHE 94 Cb 0.77 -0.38 0.39 0.00 -0.01 0.00 0.00 39.48 40.25 1pq2 n PHE 94 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 1pq2 n SER 95 N 0.87 0.34 -4.46 4.37 3.41 -0.75 -4.61 113.62 112.79 1pq2 n SER 95 Ca 0.26 0.09 -0.29 0.00 -0.26 0.00 0.00 58.87 58.67 1pq2 n SER 95 Cb 1.04 -0.08 0.23 0.00 -0.26 0.00 0.00 64.21 65.14 1pq2 n SER 95 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1pq2 n GLY 96 N 1.48 -1.91 3.35 5.00 0.00 -0.97 -4.87 105.19 107.26 1pq2 n GLY 96 Ca 0.06 -1.04 -0.32 0.00 0.00 0.00 0.00 46.02 44.71 1pq2 n GLY 96 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1pq2 s ARG 97 N -4.23 3.01 -0.40 1.61 6.06 -1.26 -2.97 118.95 120.76 1pq2 s ARG 97 Ca 0.66 -0.76 -0.31 0.00 -2.50 0.00 0.00 55.73 52.82 1pq2 s ARG 97 Cb -0.23 -2.44 -0.10 0.00 0.06 0.00 0.00 34.95 32.25 1pq2 s ARG 97 CO 0.65 0.32 2.30 0.41 -2.50 0.00 0.00 175.30 176.47 1pq2 n GLY 98 N 3.18 0.47 3.69 8.12 0.00 -0.54 -4.37 105.19 115.75 1pq2 n GLY 98 Ca -0.18 0.85 -0.42 0.00 0.00 0.00 0.00 46.02 46.27 1pq2 n GLY 98 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1pq2 s ASN 99 N 8.90 6.47 -0.11 1.61 3.04 -1.26 -4.92 114.94 128.67 1pq2 s ASN 99 Ca 1.07 2.68 -0.01 0.00 0.04 0.00 0.00 52.86 56.64 1pq2 s ASN 99 Cb -0.59 -2.56 0.03 0.00 -1.54 0.00 0.00 41.25 36.58 1pq2 s ASN 99 CO 0.40 -0.98 -0.03 -0.55 -3.04 0.00 0.00 177.10 172.90 1pq2 s SER 100 N 2.72 2.10 0.46 -4.21 0.15 -1.26 -5.02 113.70 108.63 1pq2 s SER 100 Ca 0.79 -0.31 0.21 0.00 0.70 0.00 0.00 55.95 57.35 1pq2 s SER 100 Cb -0.44 -0.68 1.20 0.00 -1.71 0.00 0.00 66.02 64.39 1pq2 s SER 100 CO 0.35 -0.17 1.88 1.55 1.20 0.00 0.00 173.24 178.06 1pq2 h PRO 101 N 8.23 0.27 0.24 5.44 0.13 -1.94 -0.10 132.00 144.28 1pq2 h PRO 101 Ca -0.24 -0.02 -0.01 0.00 -0.87 0.00 0.00 66.00 64.86 1pq2 h PRO 101 Cb 1.12 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.20 1pq2 h PRO 101 CO 0.34 0.18 -0.11 0.82 -0.23 0.00 0.00 178.00 179.00 1pq2 h ILE 102 N 0.28 0.82 0.00 -3.56 2.04 -1.94 -2.54 117.51 112.60 1pq2 h ILE 102 Ca 0.43 -0.69 -0.02 0.00 1.00 0.00 0.00 64.86 65.57 1pq2 h ILE 102 Cb 1.24 1.20 -0.00 0.00 -0.74 0.00 0.00 36.82 38.52 1pq2 h ILE 102 CO -0.12 0.14 -0.10 0.77 0.00 0.00 0.00 178.15 178.84 1pq2 h SER 103 N -0.69 0.00 0.95 1.72 4.64 -1.71 -0.34 113.55 118.11 1pq2 h SER 103 Ca -0.03 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.16 1pq2 h SER 103 Cb 0.48 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.55 1pq2 h SER 103 CO 0.05 0.10 -0.63 -0.61 -0.87 0.00 0.00 176.83 174.88 1pq2 h GLN 104 N 0.00 0.00 -0.13 4.77 -0.00 -1.02 -1.94 115.11 116.79 1pq2 h GLN 104 Ca -0.00 0.00 -0.21 0.00 -0.00 0.00 0.00 58.65 58.44 1pq2 h GLN 104 Cb 0.28 0.00 0.00 0.00 0.00 0.00 0.00 27.48 27.76 1pq2 h GLN 104 CO 0.01 0.63 -0.74 -0.09 0.00 0.00 0.00 178.83 178.64 1pq2 h ARG 105 N 0.00 0.65 0.00 1.69 2.43 -0.64 -1.35 114.38 117.16 1pq2 h ARG 105 Ca -0.01 -0.52 0.00 0.00 -0.81 0.00 0.00 59.98 58.64 1pq2 h ARG 105 Cb 1.27 0.11 0.00 0.00 -0.42 0.00 0.00 29.97 30.93 1pq2 h ARG 105 CO 0.08 1.14 0.00 -0.89 -1.51 0.00 0.00 179.97 178.79 1pq2 n ILE 106 N -3.90 0.00 0.31 1.20 5.41 -0.78 -4.30 119.36 117.29 1pq2 n ILE 106 Ca -0.06 0.48 0.19 0.00 1.00 0.00 0.00 62.75 64.36 1pq2 n ILE 106 Cb 0.72 -1.06 0.90 0.00 -0.71 0.00 0.00 39.64 39.50 1pq2 n ILE 106 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 176.55 177.26 1pq2 h THR 107 N 0.00 0.00 -0.27 1.39 1.35 -1.53 -3.46 112.91 110.39 1pq2 h THR 107 Ca 0.00 -0.26 -0.12 0.00 -0.55 0.00 0.00 66.41 65.48 1pq2 h THR 107 Cb 0.00 1.23 -0.05 0.00 -1.73 0.00 0.00 68.15 67.61 1pq2 h THR 107 CO 0.00 0.00 -0.11 0.29 -0.25 0.00 0.00 175.52 175.45 1pq2 n LYS 108 N -3.01 -1.65 -0.57 4.72 5.02 -0.51 -1.65 118.16 120.51 1pq2 n LYS 108 Ca -0.01 0.67 0.00 0.00 -2.02 0.00 0.00 58.31 56.95 1pq2 n LYS 108 Cb 0.19 -5.00 0.00 0.00 -0.02 0.00 0.00 35.03 30.20 1pq2 n LYS 108 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1pq2 n GLY 109 N 0.22 0.76 3.95 0.72 0.00 -1.26 -5.04 105.19 104.53 1pq2 n GLY 109 Ca -0.06 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.73 1pq2 n GLY 109 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1pq2 s LEU 110 N 0.00 3.53 0.00 0.99 1.43 -0.66 -4.38 118.68 119.59 1pq2 s LEU 110 Ca 0.00 0.32 0.00 0.00 -1.03 0.00 0.00 54.13 53.42 1pq2 s LEU 110 Cb 0.00 -3.19 0.00 0.00 0.03 0.00 0.00 46.19 43.03 1pq2 s LEU 110 CO 0.00 -0.82 0.00 0.61 0.23 0.00 0.00 176.35 176.37 1pq2 n GLY 111 N -2.20 -1.81 0.08 -3.19 0.00 -1.26 -4.52 105.19 92.29 1pq2 n GLY 111 Ca 0.03 -1.83 -0.08 0.00 0.00 0.00 0.00 46.02 44.14 1pq2 n GLY 111 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1pq2 n ILE 112 N 0.00 1.36 -0.35 -0.61 5.41 -1.26 -4.44 119.36 119.47 1pq2 n ILE 112 Ca 0.00 0.18 -0.05 0.00 1.00 0.00 0.00 62.75 63.88 1pq2 n ILE 112 Cb 0.00 -2.28 -0.01 0.00 -0.71 0.00 0.00 39.64 36.64 1pq2 n ILE 112 CO 0.00 0.00 0.00 0.40 0.00 0.00 0.00 176.55 176.95 1pq2 h ILE 113 N -0.91 0.03 -0.61 1.39 2.04 -1.92 -2.74 117.51 114.79 1pq2 h ILE 113 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 1pq2 h ILE 113 Cb 0.85 0.03 0.00 0.00 -0.74 0.00 0.00 36.82 36.95 1pq2 h ILE 113 CO 0.00 0.00 0.00 -1.20 0.00 0.00 0.00 178.15 176.95 1pq2 n SER 114 N -5.41 5.28 -4.94 1.72 7.64 -1.26 -4.96 113.62 111.69 1pq2 n SER 114 Ca 0.06 -2.71 -0.24 0.00 1.01 0.00 0.00 58.87 57.00 1pq2 n SER 114 Cb 0.36 -0.64 -0.03 0.00 -1.01 0.00 0.00 64.21 62.89 1pq2 n SER 114 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1pq2 s SER 115 N -0.87 6.24 0.22 6.43 1.04 -1.03 -4.68 113.70 121.05 1pq2 s SER 115 Ca 0.53 0.10 0.00 0.00 0.48 0.00 0.00 55.95 57.06 1pq2 s SER 115 Cb 0.38 -1.84 -0.05 0.00 0.10 0.00 0.00 66.02 64.61 1pq2 s SER 115 CO 0.20 0.01 0.10 0.20 0.98 0.00 0.00 173.24 174.73 1pq2 s ASN 116 N -3.51 0.68 0.90 7.02 0.01 -1.26 -4.59 114.94 114.18 1pq2 s ASN 116 Ca 0.34 -1.36 0.00 0.00 -0.71 0.00 0.00 52.86 51.13 1pq2 s ASN 116 Cb -0.10 0.26 0.00 0.00 0.41 0.00 0.00 41.25 41.82 1pq2 s ASN 116 CO 0.28 -0.76 0.00 0.61 -1.51 0.00 0.00 177.10 175.72 1pq2 n GLY 117 N -0.34 1.70 0.28 0.66 0.00 -1.26 -3.32 105.19 102.91 1pq2 n GLY 117 Ca -0.00 -0.51 -0.02 0.00 0.00 0.00 0.00 46.02 45.49 1pq2 n GLY 117 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1pq2 h LYS 118 N 0.00 -0.05 0.45 1.61 1.57 -2.00 -2.45 116.57 115.69 1pq2 h LYS 118 Ca 0.00 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 1pq2 h LYS 118 Cb 0.00 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.30 1pq2 h LYS 118 CO 0.00 -0.04 -0.47 -0.09 -0.57 0.00 0.00 179.45 178.28 1pq2 h ARG 119 N -0.06 -0.89 -0.62 3.15 2.43 -1.97 -2.25 114.38 114.17 1pq2 h ARG 119 Ca 0.29 0.06 0.13 0.00 -0.81 0.00 0.00 59.98 59.64 1pq2 h ARG 119 Cb 0.50 0.20 -0.11 0.00 -0.42 0.00 0.00 29.97 30.14 1pq2 h ARG 119 CO -0.66 -0.59 -0.11 2.35 -1.51 0.00 0.00 179.97 179.45 1pq2 h TRP 120 N -0.92 -0.24 -0.73 2.20 7.01 -1.47 -1.07 115.95 120.73 1pq2 h TRP 120 Ca -0.06 0.05 0.05 0.00 2.11 0.00 0.00 58.89 61.04 1pq2 h TRP 120 Cb 0.81 0.20 -0.05 0.00 -2.10 0.00 0.00 29.16 28.02 1pq2 h TRP 120 CO -0.26 -0.24 0.44 0.87 -2.79 0.00 0.00 178.44 176.46 1pq2 h LYS 121 N 0.03 0.80 -0.05 2.65 1.57 -1.28 -0.17 116.57 120.12 1pq2 h LYS 121 Ca 0.31 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 59.02 1pq2 h LYS 121 Cb 0.49 -0.18 -0.00 0.00 0.08 0.00 0.00 32.23 32.61 1pq2 h LYS 121 CO -0.61 0.53 -0.04 0.93 -0.57 0.00 0.00 179.45 179.69 1pq2 h GLU 122 N 0.83 0.12 -0.10 3.15 5.08 -0.64 -0.76 114.58 122.26 1pq2 h GLU 122 Ca 0.31 -0.06 -0.05 0.00 -1.00 0.00 0.00 59.36 58.55 1pq2 h GLU 122 Cb 0.11 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.35 1pq2 h GLU 122 CO -0.15 0.56 -0.19 0.82 -1.00 0.00 0.00 179.01 179.05 1pq2 h ILE 123 N -0.32 1.19 0.08 3.13 1.08 -1.13 -1.30 117.51 120.24 1pq2 h ILE 123 Ca 0.01 -0.86 -0.23 0.00 -0.39 0.00 0.00 64.86 63.39 1pq2 h ILE 123 Cb 0.53 1.33 0.02 0.00 -3.07 0.00 0.00 36.82 35.63 1pq2 h ILE 123 CO 0.01 0.26 -0.96 -0.09 -0.69 0.00 0.00 178.15 176.68 1pq2 h ARG 124 N 0.15 0.51 -0.17 2.37 2.43 -0.97 -1.24 114.38 117.46 1pq2 h ARG 124 Ca 0.03 -0.65 -0.00 0.00 -0.81 0.00 0.00 59.98 58.54 1pq2 h ARG 124 Cb 0.43 0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 30.18 1pq2 h ARG 124 CO 0.03 1.27 0.10 -0.09 -1.51 0.00 0.00 179.97 179.77 1pq2 h ARG 125 N 0.06 0.23 -0.16 0.20 2.43 -0.98 -0.74 114.38 115.42 1pq2 h ARG 125 Ca -0.14 -0.02 0.02 0.00 -0.81 0.00 0.00 59.98 59.03 1pq2 h ARG 125 Cb 1.67 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 31.15 1pq2 h ARG 125 CO 0.18 0.22 0.03 0.35 -1.51 0.00 0.00 179.97 179.24 1pq2 h PHE 126 N 0.19 0.06 -0.85 2.20 3.04 -1.28 -1.65 116.94 118.65 1pq2 h PHE 126 Ca 0.06 0.01 -0.02 0.00 3.98 0.00 0.00 57.97 62.00 1pq2 h PHE 126 Cb 0.04 -0.00 -0.04 0.00 2.56 0.00 0.00 35.95 38.51 1pq2 h PHE 126 CO -0.05 0.02 0.45 0.77 -2.02 0.00 0.00 178.31 177.48 1pq2 h SER 127 N 0.10 1.07 -0.17 0.41 0.02 -1.08 0.11 113.55 114.01 1pq2 h SER 127 Ca 0.07 -0.10 -0.03 0.00 -0.84 0.00 0.00 61.79 60.89 1pq2 h SER 127 Cb 0.06 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.32 1pq2 h SER 127 CO -0.10 0.87 0.01 -0.07 -1.14 0.00 0.00 176.83 176.40 1pq2 h LEU 128 N 1.19 0.29 -0.26 5.07 3.38 -0.92 0.39 115.31 124.44 1pq2 h LEU 128 Ca 0.30 -0.30 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 1pq2 h LEU 128 Cb 0.05 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 1pq2 h LEU 128 CO -0.04 0.51 0.02 0.71 0.09 0.00 0.00 178.44 179.73 1pq2 h THR 129 N 0.05 1.24 -0.16 0.22 1.35 -1.14 -2.12 112.91 112.36 1pq2 h THR 129 Ca 0.05 -0.84 0.01 0.00 -0.55 0.00 0.00 66.41 65.07 1pq2 h THR 129 Cb 0.36 1.29 -0.01 0.00 -1.73 0.00 0.00 68.15 68.07 1pq2 h THR 129 CO 0.01 0.27 0.11 0.74 -0.25 0.00 0.00 175.52 176.39 1pq2 h THR 130 N 0.24 1.02 -0.04 6.82 2.02 -0.71 -1.69 112.91 120.57 1pq2 h THR 130 Ca 0.08 -0.06 0.00 0.00 0.77 0.00 0.00 66.41 67.20 1pq2 h THR 130 Cb 0.37 0.83 0.00 0.00 -1.74 0.00 0.00 68.15 67.61 1pq2 h THR 130 CO 0.01 0.03 0.00 0.18 0.37 0.00 0.00 175.52 176.11 1pq2 n LEU 131 N -4.51 0.49 -4.72 2.58 4.77 0.14 -3.71 117.00 112.03 1pq2 n LEU 131 Ca -0.00 -0.19 -0.34 0.00 -0.03 0.00 0.00 56.01 55.45 1pq2 n LEU 131 Cb 0.11 -0.02 0.10 0.00 -2.33 0.00 0.00 43.42 41.28 1pq2 n LEU 131 CO 0.34 0.10 0.77 -0.13 -1.33 0.00 0.00 177.39 177.14 1pq2 s ARG 132 N -1.96 1.97 0.38 3.23 0.52 -0.63 -4.87 118.95 117.59 1pq2 s ARG 132 Ca 0.34 1.69 0.18 0.00 -0.52 0.00 0.00 55.73 57.42 1pq2 s ARG 132 Cb 0.16 -1.82 1.10 0.00 0.52 0.00 0.00 34.95 34.92 1pq2 s ARG 132 CO 0.27 -1.95 1.72 -0.97 0.02 0.00 0.00 175.30 174.39 1pq2 h ASN 133 N -0.59 0.48 0.00 0.23 -1.24 -1.90 -0.64 115.58 111.92 1pq2 h ASN 133 Ca -0.47 0.12 -0.01 0.00 0.71 0.00 0.00 56.30 56.65 1pq2 h ASN 133 Cb 1.29 0.05 -0.03 0.00 0.73 0.00 0.00 38.32 40.36 1pq2 h ASN 133 CO 0.48 0.02 -0.40 0.49 -1.29 0.00 0.00 177.43 176.73 1pq2 n PHE 134 N -4.76 0.00 1.71 0.67 3.72 -1.26 -1.07 117.46 116.47 1pq2 n PHE 134 Ca 0.28 -1.21 0.14 0.00 -0.05 0.00 0.00 57.45 56.61 1pq2 n PHE 134 Cb 0.95 -0.21 0.66 0.00 -0.94 0.00 0.00 39.48 39.94 1pq2 n PHE 134 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1pq2 n GLY 135 N -1.03 -0.45 0.12 1.37 0.00 -0.25 -4.14 105.19 100.81 1pq2 n GLY 135 Ca 0.16 -0.31 -0.11 0.00 0.00 0.00 0.00 46.02 45.76 1pq2 n GLY 135 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1pq2 n MET 136 N -0.35 0.38 0.00 1.61 2.81 -1.24 -4.55 117.12 115.78 1pq2 n MET 136 Ca 0.20 0.09 0.00 0.00 -1.81 0.00 0.00 57.70 56.18 1pq2 n MET 136 Cb 0.23 -1.28 0.00 0.00 -0.71 0.00 0.00 33.22 31.45 1pq2 n MET 136 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1pq2 n GLY 137 N 2.69 1.63 0.12 3.03 0.00 -1.26 -4.26 105.19 107.14 1pq2 n GLY 137 Ca -0.28 -0.33 -0.12 0.00 0.00 0.00 0.00 46.02 45.29 1pq2 n GLY 137 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1pq2 h LYS 138 N 0.00 0.28 -6.03 1.61 6.56 -1.91 -3.43 116.57 113.64 1pq2 h LYS 138 Ca 0.00 -0.36 -0.58 0.00 -1.06 0.00 0.00 60.65 58.65 1pq2 h LYS 138 Cb 0.00 0.12 -0.07 0.00 -0.57 0.00 0.00 32.23 31.71 1pq2 h LYS 138 CO 0.00 1.09 0.70 0.50 -2.06 0.00 0.00 179.45 179.68 1pq2 s ARG 139 N -3.01 4.18 0.61 3.15 3.52 -1.26 -5.03 118.95 121.10 1pq2 s ARG 139 Ca -0.04 1.14 -0.17 0.00 -0.13 0.00 0.00 55.73 56.53 1pq2 s ARG 139 Cb 0.09 -3.67 -0.03 0.00 -1.56 0.00 0.00 34.95 29.78 1pq2 s ARG 139 CO 0.86 -0.66 1.12 -1.54 -0.81 0.00 0.00 175.30 174.26 1pq2 s SER 140 N 1.36 5.38 0.24 -2.12 1.04 -1.26 -4.86 113.70 113.48 1pq2 s SER 140 Ca 0.41 2.06 -0.05 0.00 0.48 0.00 0.00 55.95 58.86 1pq2 s SER 140 Cb -0.14 -2.56 0.25 0.00 0.10 0.00 0.00 66.02 63.67 1pq2 s SER 140 CO 0.09 -1.45 1.79 0.40 0.98 0.00 0.00 173.24 175.05 1pq2 h ILE 141 N 0.52 1.25 -0.76 -1.02 2.04 -1.40 -1.23 117.51 116.90 1pq2 h ILE 141 Ca -0.48 -0.86 0.15 0.00 1.00 0.00 0.00 64.86 64.67 1pq2 h ILE 141 Cb 1.25 0.51 -0.05 0.00 -0.74 0.00 0.00 36.82 37.79 1pq2 h ILE 141 CO 0.55 0.33 0.51 -0.08 0.00 0.00 0.00 178.15 179.46 1pq2 h GLU 142 N 0.99 0.42 -0.31 2.37 4.81 -1.92 0.44 114.58 121.39 1pq2 h GLU 142 Ca 0.22 -0.03 -0.06 0.00 -0.13 0.00 0.00 59.36 59.36 1pq2 h GLU 142 Cb 0.29 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.56 1pq2 h GLU 142 CO -0.01 0.28 -0.04 0.22 -0.73 0.00 0.00 179.01 178.73 1pq2 h ASP 143 N 0.43 0.57 -0.75 1.04 1.82 -1.59 -1.66 116.42 116.29 1pq2 h ASP 143 Ca 0.37 -0.34 -0.01 0.00 -0.39 0.00 0.00 57.03 56.66 1pq2 h ASP 143 Cb 0.83 -0.15 -0.04 0.00 0.68 0.00 0.00 39.33 40.65 1pq2 h ASP 143 CO -0.12 0.77 0.43 0.03 -1.61 0.00 0.00 179.24 178.74 1pq2 h ARG 144 N 0.35 1.04 0.37 0.28 3.08 -0.74 -1.66 114.38 117.11 1pq2 h ARG 144 Ca 0.08 -0.11 -0.02 0.00 0.07 0.00 0.00 59.98 60.01 1pq2 h ARG 144 Cb 0.51 -0.21 0.00 0.00 0.08 0.00 0.00 29.97 30.35 1pq2 h ARG 144 CO 0.02 0.75 -0.18 0.28 -1.07 0.00 0.00 179.97 179.78 1pq2 h VAL 145 N 1.05 0.62 -0.99 2.04 2.07 -1.13 -2.30 116.25 117.62 1pq2 h VAL 145 Ca 0.27 -0.40 0.12 0.00 0.82 0.00 0.00 66.70 67.51 1pq2 h VAL 145 Cb 0.00 0.82 -0.09 0.00 -1.52 0.00 0.00 31.29 30.51 1pq2 h VAL 145 CO -0.05 0.08 0.62 1.56 0.02 0.00 0.00 177.57 179.79 1pq2 h GLN 146 N -0.73 0.93 -0.47 1.57 4.20 -1.13 0.63 115.11 120.11 1pq2 h GLN 146 Ca -0.05 -0.06 0.02 0.00 0.06 0.00 0.00 58.65 58.63 1pq2 h GLN 146 Cb 0.51 -0.21 -0.03 0.00 0.30 0.00 0.00 27.48 28.04 1pq2 h GLN 146 CO 0.08 0.62 0.27 1.49 -0.67 0.00 0.00 178.83 180.62 1pq2 h GLU 147 N 0.96 0.53 -0.24 1.46 4.81 -1.22 -1.65 114.58 119.23 1pq2 h GLU 147 Ca 0.49 -0.03 -0.09 0.00 -0.13 0.00 0.00 59.36 59.60 1pq2 h GLU 147 Cb 0.50 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.75 1pq2 h GLU 147 CO -0.27 0.35 -0.26 1.49 -0.73 0.00 0.00 179.01 179.59 1pq2 h GLU 148 N 0.55 0.47 0.00 1.92 4.57 -0.25 -0.81 114.58 121.02 1pq2 h GLU 148 Ca 0.19 -0.18 0.00 0.00 -1.18 0.00 0.00 59.36 58.19 1pq2 h GLU 148 Cb 0.03 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 28.59 1pq2 h GLU 148 CO -0.09 0.69 0.00 0.00 -1.18 0.00 0.00 179.01 178.42 1pq2 h ALA 149 N 1.32 1.00 0.08 2.92 0.00 0.87 -1.59 119.26 123.86 1pq2 h ALA 149 Ca 0.06 0.00 -0.37 0.00 0.00 0.00 0.00 54.91 54.60 1pq2 h ALA 149 Cb 0.67 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.42 1pq2 h ALA 149 CO 0.05 0.00 -2.16 1.58 0.00 0.00 0.00 179.25 178.72 1pq2 n HIS 150 N -2.53 0.82 0.29 0.00 -0.00 -0.43 -3.69 115.22 109.67 1pq2 n HIS 150 Ca -0.00 0.18 0.15 0.00 -0.00 0.00 0.00 57.72 58.05 1pq2 n HIS 150 Cb 0.16 -1.11 0.87 0.00 -0.00 0.00 0.00 29.99 29.91 1pq2 n HIS 150 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1pq2 h LEU 152 N 0.00 -0.31 -2.02 0.00 5.85 -1.46 -3.07 115.31 114.30 1pq2 h LEU 152 Ca -0.00 0.01 0.07 0.00 0.84 0.00 0.00 57.88 58.80 1pq2 h LEU 152 Cb 0.16 0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.26 1pq2 h LEU 152 CO 0.01 0.12 0.38 0.58 -0.34 0.00 0.00 178.44 179.18 1pq2 h VAL 153 N -1.06 0.26 -0.14 1.05 2.07 -1.60 0.24 116.25 117.07 1pq2 h VAL 153 Ca -0.04 0.00 -0.18 0.00 0.82 0.00 0.00 66.70 67.30 1pq2 h VAL 153 Cb 0.28 0.68 0.01 0.00 -1.52 0.00 0.00 31.29 30.74 1pq2 h VAL 153 CO 0.06 0.00 -0.60 -0.08 0.02 0.00 0.00 177.57 176.97 1pq2 h GLU 154 N 0.00 0.66 -0.24 1.57 4.81 -1.47 -3.10 114.58 116.81 1pq2 h GLU 154 Ca 0.12 -0.52 -0.11 0.00 -0.13 0.00 0.00 59.36 58.72 1pq2 h GLU 154 Cb 0.88 0.10 -0.01 0.00 0.63 0.00 0.00 28.75 30.34 1pq2 h GLU 154 CO -0.00 1.14 -0.31 0.93 -0.73 0.00 0.00 179.01 180.03 1pq2 h GLU 155 N 0.34 0.49 0.00 1.92 4.39 -0.46 -2.61 114.58 118.64 1pq2 h GLU 155 Ca -0.03 -0.21 0.00 0.00 0.34 0.00 0.00 59.36 59.45 1pq2 h GLU 155 Cb 1.23 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.87 1pq2 h GLU 155 CO 0.13 0.75 0.00 1.28 -1.16 0.00 0.00 179.01 180.01 1pq2 n LEU 156 N -4.08 0.43 0.01 1.33 4.77 -0.57 -2.16 117.00 116.73 1pq2 n LEU 156 Ca -0.01 0.61 -0.13 0.00 -0.03 0.00 0.00 56.01 56.46 1pq2 n LEU 156 Cb 0.45 -0.56 -0.14 0.00 -2.33 0.00 0.00 43.42 40.84 1pq2 n LEU 156 CO 0.43 -0.48 -0.49 0.03 -1.33 0.00 0.00 177.39 175.55 1pq2 h ARG 157 N 0.00 0.10 0.00 3.23 3.08 -1.39 -3.33 114.38 116.07 1pq2 h ARG 157 Ca 0.00 -0.17 0.00 0.00 0.07 0.00 0.00 59.98 59.88 1pq2 h ARG 157 Cb 0.30 0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.41 1pq2 h ARG 157 CO 0.00 0.80 0.00 1.63 -1.07 0.00 0.00 179.97 181.33 1pq2 n LYS 158 N -3.24 0.04 0.08 0.04 5.02 -0.92 -0.66 118.16 118.53 1pq2 n LYS 158 Ca -0.18 0.45 -0.12 0.00 -2.02 0.00 0.00 58.31 56.43 1pq2 n LYS 158 Cb 1.04 -1.61 -0.06 0.00 -0.02 0.00 0.00 35.03 34.38 1pq2 n LYS 158 CO 0.00 0.00 0.00 1.79 -0.52 0.00 0.00 177.40 178.67 1pq2 h THR 159 N 0.00 1.47 -2.37 -0.18 1.35 -1.67 -3.48 112.91 108.03 1pq2 h THR 159 Ca 0.00 -2.69 -0.06 0.00 -0.55 0.00 0.00 66.41 63.11 1pq2 h THR 159 Cb 0.10 2.58 0.03 0.00 -1.73 0.00 0.00 68.15 69.13 1pq2 h THR 159 CO 0.00 0.79 -0.13 0.29 -0.25 0.00 0.00 175.52 176.22 1pq2 n LYS 160 N -3.65 -1.28 -0.84 4.72 5.02 0.17 -3.33 118.16 118.98 1pq2 n LYS 160 Ca -0.06 0.15 0.00 0.00 -2.02 0.00 0.00 58.31 56.38 1pq2 n LYS 160 Cb 0.88 -3.10 0.00 0.00 -0.02 0.00 0.00 35.03 32.78 1pq2 n LYS 160 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1pq2 n ALA 161 N -2.06 0.00 -1.80 7.82 0.00 -1.24 -4.95 120.51 118.28 1pq2 n ALA 161 Ca -0.03 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.06 1pq2 n ALA 161 Cb 0.52 -1.15 -0.05 0.00 0.00 0.00 0.00 19.45 18.77 1pq2 n ALA 161 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1pq2 s SER 162 N -2.05 6.81 0.50 0.00 0.15 -1.21 -4.39 113.70 113.51 1pq2 s SER 162 Ca 0.00 1.89 -0.22 0.00 0.70 0.00 0.00 55.95 58.32 1pq2 s SER 162 Cb 0.00 -2.57 -0.07 0.00 -1.71 0.00 0.00 66.02 61.68 1pq2 s SER 162 CO 0.00 -0.45 1.17 -2.16 1.20 0.00 0.00 173.24 173.00 1pq2 s PRO 163 N -2.77 3.56 0.08 5.44 0.04 -1.26 -4.52 135.00 135.57 1pq2 s PRO 163 Ca 0.60 1.78 -0.27 0.00 0.04 0.00 0.00 61.00 63.14 1pq2 s PRO 163 Cb -0.17 -2.27 0.08 0.00 0.04 0.00 0.00 34.50 32.19 1pq2 s PRO 163 CO 0.21 -0.72 0.99 0.00 0.04 0.00 0.00 177.00 177.52 1pq2 s ASP 165 N -2.80 6.29 0.13 0.00 3.68 -1.26 -1.73 116.67 120.98 1pq2 s ASP 165 Ca 0.10 -1.82 0.09 0.00 2.13 0.00 0.00 52.55 53.05 1pq2 s ASP 165 Cb -0.01 -2.25 0.46 0.00 -1.45 0.00 0.00 42.92 39.68 1pq2 s ASP 165 CO -0.02 -0.91 1.24 -0.81 0.13 0.00 0.00 175.17 174.81 1pq2 n PRO 166 N 5.45 0.06 -0.34 4.34 -0.04 -1.26 -3.72 135.00 139.48 1pq2 n PRO 166 Ca -0.07 0.54 0.20 0.00 -0.04 0.00 0.00 63.50 64.13 1pq2 n PRO 166 Cb 0.42 -1.71 0.38 0.00 -0.04 0.00 0.00 33.50 32.55 1pq2 n PRO 166 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 1pq2 h THR 167 N 0.00 0.01 0.16 0.52 2.02 -1.92 0.36 112.91 114.05 1pq2 h THR 167 Ca 0.00 -0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.17 1pq2 h THR 167 Cb 0.05 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 66.46 1pq2 h THR 167 CO 0.00 0.00 -0.08 0.15 0.37 0.00 0.00 175.52 175.96 1pq2 h PHE 168 N 0.00 -0.20 -0.98 3.16 3.57 -2.00 -2.97 116.94 117.53 1pq2 h PHE 168 Ca 0.67 -0.00 0.08 0.00 3.53 0.00 0.00 57.97 62.25 1pq2 h PHE 168 Cb 1.52 0.07 -0.07 0.00 2.79 0.00 0.00 35.95 40.26 1pq2 h PHE 168 CO -0.37 -0.12 0.62 0.97 -2.23 0.00 0.00 178.31 177.18 1pq2 h ILE 169 N -0.33 1.03 0.00 1.41 6.09 -1.72 0.31 117.51 124.29 1pq2 h ILE 169 Ca -0.02 -0.37 0.00 0.00 -1.37 0.00 0.00 64.86 63.10 1pq2 h ILE 169 Cb 0.16 -0.15 0.00 0.00 0.47 0.00 0.00 36.82 37.30 1pq2 h ILE 169 CO 0.04 0.20 0.00 -0.11 -3.07 0.00 0.00 178.15 175.20 1pq2 n LEU 170 N -4.56 0.00 -0.05 2.19 7.94 0.12 -1.28 117.00 121.36 1pq2 n LEU 170 Ca 0.16 0.39 -0.00 0.00 -1.11 0.00 0.00 56.01 55.44 1pq2 n LEU 170 Cb 0.23 -0.39 -0.15 0.00 0.53 0.00 0.00 43.42 43.65 1pq2 n LEU 170 CO 0.30 -0.28 -0.93 0.61 -1.11 0.00 0.00 177.39 175.99 1pq2 n GLY 171 N -0.62 -0.90 0.15 -3.96 0.00 0.10 -4.35 105.19 95.61 1pq2 n GLY 171 Ca 0.03 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.67 1pq2 n GLY 171 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pq2 h ALA 173 N 1.46 -1.11 -0.66 0.00 0.00 -1.72 -0.79 119.26 116.45 1pq2 h ALA 173 Ca -0.01 -0.22 0.05 0.00 0.00 0.00 0.00 54.91 54.74 1pq2 h ALA 173 Cb 0.99 0.39 -0.04 0.00 0.00 0.00 0.00 17.79 19.12 1pq2 h ALA 173 CO 0.07 -1.03 0.44 -1.35 0.00 0.00 0.00 179.25 177.37 1pq2 h PRO 174 N -1.14 0.68 -0.16 0.00 0.11 -1.78 -0.12 132.00 129.60 1pq2 h PRO 174 Ca -0.10 -0.04 -0.10 0.00 0.11 0.00 0.00 66.00 65.87 1pq2 h PRO 174 Cb 0.76 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 31.71 1pq2 h PRO 174 CO 0.17 0.45 -0.34 0.00 -0.21 0.00 0.00 178.00 178.08 1pq2 h ASN 176 N 0.29 0.19 -0.64 0.00 2.35 0.48 -2.51 115.58 115.74 1pq2 h ASN 176 Ca 0.04 -0.53 0.13 0.00 -0.55 0.00 0.00 56.30 55.39 1pq2 h ASN 176 Cb 0.73 -0.05 -0.12 0.00 0.05 0.00 0.00 38.32 38.93 1pq2 h ASN 176 CO 0.06 0.68 -0.11 0.58 -1.65 0.00 0.00 177.43 176.99 1pq2 h VAL 177 N -0.29 0.39 -0.32 2.81 2.07 -1.12 0.45 116.25 120.23 1pq2 h VAL 177 Ca 0.01 -0.01 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 1pq2 h VAL 177 Cb 0.64 0.36 -0.01 0.00 -1.52 0.00 0.00 31.29 30.75 1pq2 h VAL 177 CO 0.02 0.01 0.17 0.40 0.02 0.00 0.00 177.57 178.19 1pq2 h ILE 178 N 0.03 1.14 -0.47 4.57 5.03 -1.49 -1.61 117.51 124.71 1pq2 h ILE 178 Ca 0.32 -0.36 0.09 0.00 -0.12 0.00 0.00 64.86 64.78 1pq2 h ILE 178 Cb 0.50 0.80 -0.07 0.00 -3.03 0.00 0.00 36.82 35.01 1pq2 h ILE 178 CO -0.63 0.14 0.02 0.00 -0.68 0.00 0.00 178.15 177.00 1pq2 h SER 180 N 0.14 0.00 0.04 0.00 0.87 0.05 0.61 113.55 115.26 1pq2 h SER 180 Ca 0.23 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.79 1pq2 h SER 180 Cb 0.34 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.30 1pq2 h SER 180 CO -0.37 0.00 -0.74 0.52 -0.53 0.00 0.00 176.83 175.71 1pq2 n VAL 181 N -2.65 0.00 0.00 2.23 0.31 0.60 -3.24 118.33 115.57 1pq2 n VAL 181 Ca -0.00 -0.10 0.00 0.00 -0.01 0.00 0.00 64.34 64.23 1pq2 n VAL 181 Cb 0.18 1.01 0.00 0.00 -0.91 0.00 0.00 33.84 34.12 1pq2 n VAL 181 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 1pq2 n VAL 182 N -0.92 0.00 -0.07 2.52 0.31 -0.38 -1.33 118.33 118.47 1pq2 n VAL 182 Ca 0.06 0.00 -0.08 0.00 -0.01 0.00 0.00 64.34 64.32 1pq2 n VAL 182 Cb 0.38 -0.66 -0.10 0.00 -0.91 0.00 0.00 33.84 32.56 1pq2 n VAL 182 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 1pq2 n PHE 183 N -1.76 0.00 -0.16 3.52 3.72 0.21 -3.42 117.46 119.57 1pq2 n PHE 183 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 1pq2 n PHE 183 Cb 0.37 -0.65 0.00 0.00 -0.94 0.00 0.00 39.48 38.26 1pq2 n PHE 183 CO 0.00 0.00 0.00 0.94 -0.05 0.00 0.00 176.76 177.65 1pq2 n GLN 184 N -2.60 0.00 -4.08 -1.08 7.27 -1.18 -4.77 117.38 110.93 1pq2 n GLN 184 Ca -0.23 0.00 -0.20 0.00 0.07 0.00 0.00 57.00 56.64 1pq2 n GLN 184 Cb 0.91 -0.53 -0.16 0.00 2.41 0.00 0.00 30.24 32.86 1pq2 n GLN 184 CO 0.00 0.00 0.00 -1.59 0.07 0.00 0.00 177.06 175.54 1pq2 s LYS 185 N -0.75 0.72 0.85 3.69 0.00 -1.26 -4.92 119.74 118.06 1pq2 s LYS 185 Ca 0.00 -0.05 -0.13 0.00 0.00 0.00 0.00 55.97 55.79 1pq2 s LYS 185 Cb 0.00 -0.80 0.11 0.00 0.00 0.00 0.00 37.83 37.14 1pq2 s LYS 185 CO 0.00 -0.11 1.21 -0.98 0.00 0.00 0.00 175.35 175.47 1pq2 s ARG 186 N 1.04 1.65 0.41 1.78 1.70 -1.26 -4.40 118.95 119.88 1pq2 s ARG 186 Ca -0.09 0.00 0.08 0.00 -0.47 0.00 0.00 55.73 55.25 1pq2 s ARG 186 Cb -0.14 -1.92 -0.02 0.00 -0.57 0.00 0.00 34.95 32.30 1pq2 s ARG 186 CO -0.01 -1.79 0.41 -0.06 -1.08 0.00 0.00 175.30 172.77 1pq2 s PHE 187 N -3.64 2.75 0.17 5.89 0.40 -1.26 -5.03 117.98 117.25 1pq2 s PHE 187 Ca 0.65 -0.46 -0.05 0.00 -0.60 0.00 0.00 56.93 56.46 1pq2 s PHE 187 Cb -0.10 -2.18 -0.06 0.00 0.51 0.00 0.00 43.02 41.19 1pq2 s PHE 187 CO 0.50 -0.15 0.42 0.34 0.70 0.00 0.00 175.22 177.02 1pq2 s ASP 188 N -4.16 6.51 0.00 1.36 -1.08 -1.26 -4.94 116.67 113.10 1pq2 s ASP 188 Ca 0.49 0.64 0.00 0.00 -0.52 0.00 0.00 52.55 53.16 1pq2 s ASP 188 Cb -0.05 -2.11 0.00 0.00 -1.46 0.00 0.00 42.92 39.30 1pq2 s ASP 188 CO 0.29 0.01 0.90 -1.22 0.52 0.00 0.00 175.17 175.67 1pq2 n TYR 189 N -0.06 0.00 0.00 -5.34 0.53 -1.26 -0.95 117.16 110.09 1pq2 n TYR 189 Ca -0.02 -0.45 0.00 0.00 -1.02 0.00 0.00 57.90 56.41 1pq2 n TYR 189 Cb 0.52 -0.33 0.00 0.00 -1.03 0.00 0.00 39.34 38.50 1pq2 n TYR 189 CO 0.00 0.00 0.00 1.63 -1.02 0.00 0.00 176.86 177.47 1pq2 n LYS 190 N 1.53 0.15 -1.30 -0.72 4.76 -1.26 -5.07 118.16 116.25 1pq2 n LYS 190 Ca 0.00 0.00 -0.57 0.00 -2.87 0.00 0.00 58.31 54.87 1pq2 n LYS 190 Cb 0.25 -0.20 -0.12 0.00 -1.84 0.00 0.00 35.03 33.13 1pq2 n LYS 190 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 1pq2 n ASP 191 N -0.47 0.85 -0.36 4.39 2.03 -0.12 -4.75 116.55 118.12 1pq2 n ASP 191 Ca 0.00 0.58 0.27 0.00 0.52 0.00 0.00 54.79 56.16 1pq2 n ASP 191 Cb 0.00 -0.95 0.55 0.00 -0.72 0.00 0.00 41.12 40.00 1pq2 n ASP 191 CO 0.00 0.00 0.00 -0.61 -1.92 0.00 0.00 177.20 174.67 1pq2 h GLN 192 N 9.80 0.29 0.00 -0.67 5.75 -1.99 0.63 115.11 128.93 1pq2 h GLN 192 Ca -0.11 -0.02 0.00 0.00 -0.15 0.00 0.00 58.65 58.37 1pq2 h GLN 192 Cb 1.40 -0.07 0.00 0.00 1.07 0.00 0.00 27.48 29.88 1pq2 h GLN 192 CO 1.12 0.19 0.00 -1.71 -2.65 0.00 0.00 178.83 175.78 1pq2 n ASN 193 N -4.68 0.65 -0.06 -0.69 4.05 -1.26 -2.62 115.26 110.65 1pq2 n ASN 193 Ca 0.29 0.60 -0.06 0.00 0.45 0.00 0.00 54.58 55.87 1pq2 n ASN 193 Cb 1.04 -0.76 -0.04 0.00 1.23 0.00 0.00 39.78 41.25 1pq2 n ASN 193 CO 0.00 0.00 0.00 0.15 -3.05 0.00 0.00 177.26 174.36 1pq2 h PHE 194 N 0.00 0.00 -0.53 1.20 3.57 -0.05 -2.95 116.94 118.18 1pq2 h PHE 194 Ca 0.00 0.00 0.08 0.00 3.53 0.00 0.00 57.97 61.58 1pq2 h PHE 194 Cb 0.54 0.00 -0.07 0.00 2.79 0.00 0.00 35.95 39.21 1pq2 h PHE 194 CO 0.00 0.34 0.16 -0.07 -2.23 0.00 0.00 178.31 176.51 1pq2 h LEU 195 N -1.00 0.12 0.31 0.59 -0.00 -1.56 0.25 115.31 114.03 1pq2 h LEU 195 Ca -0.03 0.08 -0.02 0.00 -0.00 0.00 0.00 57.88 57.91 1pq2 h LEU 195 Cb 0.43 0.08 0.00 0.00 -0.00 0.00 0.00 40.66 41.18 1pq2 h LEU 195 CO -0.02 0.09 -0.15 0.00 -0.00 0.00 0.00 178.44 178.36 1pq2 h THR 196 N 0.32 0.71 -0.41 0.22 1.03 -1.67 -1.42 112.91 111.69 1pq2 h THR 196 Ca 0.27 -0.13 -0.04 0.00 -0.01 0.00 0.00 66.41 66.49 1pq2 h THR 196 Cb 0.33 0.78 -0.02 0.00 -1.07 0.00 0.00 68.15 68.17 1pq2 h THR 196 CO -0.30 0.03 0.07 0.25 -0.01 0.00 0.00 175.52 175.56 1pq2 h LEU 197 N -0.49 0.58 -0.24 0.00 7.12 -1.29 -2.78 115.31 118.22 1pq2 h LEU 197 Ca -0.04 -0.10 -0.07 0.00 0.13 0.00 0.00 57.88 57.80 1pq2 h LEU 197 Cb 0.37 -0.15 -0.01 0.00 -0.53 0.00 0.00 40.66 40.34 1pq2 h LEU 197 CO 0.07 0.60 -0.12 -0.03 -0.13 0.00 0.00 178.44 178.83 1pq2 h MET 198 N 0.60 0.51 0.00 1.25 4.05 -0.39 -2.78 114.93 118.17 1pq2 h MET 198 Ca 0.13 -0.23 0.00 0.00 -0.28 0.00 0.00 59.70 59.33 1pq2 h MET 198 Cb 0.28 -0.01 0.00 0.00 -0.80 0.00 0.00 31.60 31.06 1pq2 h MET 198 CO 0.00 0.78 0.00 1.63 0.23 0.00 0.00 176.91 179.55 1pq2 n LYS 199 N -4.49 0.47 0.05 0.39 5.02 -0.54 -2.01 118.16 117.05 1pq2 n LYS 199 Ca -0.04 0.04 0.11 0.00 -2.02 0.00 0.00 58.31 56.40 1pq2 n LYS 199 Cb 0.35 -1.50 -0.04 0.00 -0.02 0.00 0.00 35.03 33.82 1pq2 n LYS 199 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 1pq2 n ARG 200 N -1.11 0.54 -0.00 1.97 0.63 -1.05 -3.38 116.66 114.25 1pq2 n ARG 200 Ca 0.12 -0.00 -0.21 0.00 -0.92 0.00 0.00 57.85 56.84 1pq2 n ARG 200 Cb 0.10 -1.68 -0.14 0.00 0.45 0.00 0.00 32.46 31.19 1pq2 n ARG 200 CO 0.00 0.00 0.00 1.19 -2.51 0.00 0.00 177.63 176.31 1pq2 n PHE 201 N -2.38 1.26 0.30 -0.14 0.99 -0.85 -3.79 117.46 112.85 1pq2 n PHE 201 Ca -0.01 0.28 0.18 0.00 -0.00 0.00 0.00 57.45 57.90 1pq2 n PHE 201 Cb 0.53 -1.16 0.95 0.00 -1.00 0.00 0.00 39.48 38.79 1pq2 n PHE 201 CO 0.00 0.00 0.00 -0.97 -0.00 0.00 0.00 176.76 175.79 1pq2 h ASN 202 N -0.02 0.00 0.01 4.37 -1.24 -1.61 -1.23 115.58 115.87 1pq2 h ASN 202 Ca -0.42 0.00 -0.06 0.00 0.71 0.00 0.00 56.30 56.53 1pq2 h ASN 202 Cb 1.98 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 41.02 1pq2 h ASN 202 CO 0.07 0.03 -0.30 -0.33 -1.29 0.00 0.00 177.43 175.61 1pq2 h GLU 203 N 0.00 0.03 0.00 6.67 5.08 -1.70 -2.47 114.58 122.19 1pq2 h GLU 203 Ca -0.00 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 1pq2 h GLU 203 Cb 0.17 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.44 1pq2 h GLU 203 CO 0.00 1.03 0.00 -0.91 -1.00 0.00 0.00 179.01 178.13 1pq2 h ASN 204 N -0.93 0.00 0.00 1.42 4.21 -1.58 -0.11 115.58 118.58 1pq2 h ASN 204 Ca -0.07 0.00 -0.00 0.00 1.21 0.00 0.00 56.30 57.43 1pq2 h ASN 204 Cb 1.12 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 38.32 1pq2 h ASN 204 CO -0.02 0.00 -0.03 0.15 -1.29 0.00 0.00 177.43 176.24 1pq2 h PHE 205 N 0.00 0.00 -1.04 1.19 3.04 -1.31 -2.08 116.94 116.74 1pq2 h PHE 205 Ca 0.00 0.00 0.27 0.00 3.98 0.00 0.00 57.97 62.22 1pq2 h PHE 205 Cb 0.30 0.00 -0.11 0.00 2.56 0.00 0.00 35.95 38.69 1pq2 h PHE 205 CO 0.00 0.30 0.64 -0.09 -2.02 0.00 0.00 178.31 177.14 1pq2 h ARG 206 N -1.00 0.44 0.02 1.11 9.65 -1.09 -0.04 114.38 123.47 1pq2 h ARG 206 Ca -0.00 -0.03 -0.10 0.00 -1.10 0.00 0.00 59.98 58.75 1pq2 h ARG 206 Cb 0.31 -0.10 0.01 0.00 -1.39 0.00 0.00 29.97 28.80 1pq2 h ARG 206 CO -0.00 0.29 -0.41 0.82 2.80 0.00 0.00 179.97 183.47 1pq2 h ILE 207 N 0.46 1.52 0.00 1.20 2.04 -1.13 -3.29 117.51 118.31 1pq2 h ILE 207 Ca 0.64 -2.08 0.00 0.00 1.00 0.00 0.00 64.86 64.42 1pq2 h ILE 207 Cb 1.45 2.81 0.00 0.00 -0.74 0.00 0.00 36.82 40.34 1pq2 h ILE 207 CO -0.41 0.58 0.00 0.18 0.00 0.00 0.00 178.15 178.51 1pq2 n LEU 208 N -4.38 0.00 0.06 1.44 4.77 -0.55 -2.86 117.00 115.48 1pq2 n LEU 208 Ca -0.10 0.33 -0.21 0.00 -0.03 0.00 0.00 56.01 55.99 1pq2 n LEU 208 Cb 0.59 -0.33 -0.15 0.00 -2.33 0.00 0.00 43.42 41.21 1pq2 n LEU 208 CO 0.42 -0.09 -0.13 -1.13 -1.33 0.00 0.00 177.39 175.13 1pq2 h ASN 209 N 0.00 0.54 -0.90 -1.43 -0.00 -1.12 -3.47 115.58 109.19 1pq2 h ASN 209 Ca 0.00 -0.93 -0.65 0.00 -0.00 0.00 0.00 56.30 54.73 1pq2 h ASN 209 Cb 0.23 -0.17 0.08 0.00 -0.00 0.00 0.00 38.32 38.46 1pq2 h ASN 209 CO 0.00 1.52 -0.28 -0.24 -0.00 0.00 0.00 177.43 178.44 1pq2 n SER 210 N -3.98 -0.70 0.32 1.15 2.88 -1.13 -3.93 113.62 108.22 1pq2 n SER 210 Ca -0.17 1.03 0.19 0.00 -1.33 0.00 0.00 58.87 58.59 1pq2 n SER 210 Cb 0.91 -0.85 1.07 0.00 -0.75 0.00 0.00 64.21 64.60 1pq2 n SER 210 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 1pq2 h PRO 211 N 1.59 0.00 -0.57 -1.46 0.11 -1.87 -2.64 132.00 127.16 1pq2 h PRO 211 Ca -0.33 0.00 0.08 0.00 0.11 0.00 0.00 66.00 65.86 1pq2 h PRO 211 Cb 1.30 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.37 1pq2 h PRO 211 CO 0.54 0.00 0.38 -1.49 -0.21 0.00 0.00 178.00 177.22 1pq2 h TRP 212 N 0.00 0.45 0.00 0.65 4.06 -1.93 -0.80 115.95 118.39 1pq2 h TRP 212 Ca -0.00 0.01 -0.07 0.00 2.06 0.00 0.00 58.89 60.89 1pq2 h TRP 212 Cb 0.01 -0.15 -0.01 0.00 -1.00 0.00 0.00 29.16 28.01 1pq2 h TRP 212 CO 0.00 0.23 -0.36 -0.84 -3.56 0.00 0.00 178.44 173.91 1pq2 h ILE 213 N 0.44 1.24 -0.24 1.49 3.07 -1.79 0.78 117.51 122.50 1pq2 h ILE 213 Ca 0.26 -1.23 -0.03 0.00 1.55 0.00 0.00 64.86 65.41 1pq2 h ILE 213 Cb 0.44 1.67 -0.01 0.00 -0.27 0.00 0.00 36.82 38.65 1pq2 h ILE 213 CO -0.07 0.35 0.04 1.56 -1.05 0.00 0.00 178.15 178.98 1pq2 h GLN 214 N 0.00 0.40 -0.12 0.16 1.08 -1.33 0.11 115.11 115.41 1pq2 h GLN 214 Ca -0.00 -0.11 -0.10 0.00 -1.45 0.00 0.00 58.65 56.99 1pq2 h GLN 214 Cb 0.64 -0.05 0.00 0.00 -0.05 0.00 0.00 27.48 28.02 1pq2 h GLN 214 CO 0.05 0.53 -0.31 -0.24 -0.95 0.00 0.00 178.83 177.91 1pq2 h VAL 215 N 0.21 1.38 -0.83 -0.54 3.04 -1.31 -3.13 116.25 115.06 1pq2 h VAL 215 Ca 0.07 -1.60 0.03 0.00 -1.01 0.00 0.00 66.70 64.19 1pq2 h VAL 215 Cb 0.32 2.08 -0.05 0.00 -2.01 0.00 0.00 31.29 31.64 1pq2 h VAL 215 CO 0.00 0.47 0.54 0.00 -1.01 0.00 0.00 177.57 177.58 1pq2 h ASN 217 N 1.04 1.10 0.36 0.00 2.35 -0.77 -2.54 115.58 117.12 1pq2 h ASN 217 Ca 0.32 -0.07 0.00 0.00 -0.55 0.00 0.00 56.30 56.00 1pq2 h ASN 217 Cb 0.00 -0.28 0.00 0.00 0.05 0.00 0.00 38.32 38.10 1pq2 h ASN 217 CO -0.09 0.85 -0.37 0.59 -1.65 0.00 0.00 177.43 176.77 1pq2 n ASN 218 N -4.35 0.77 -3.27 5.81 4.13 -0.80 -4.32 115.26 113.22 1pq2 n ASN 218 Ca 0.10 -0.58 -0.25 0.00 1.68 0.00 0.00 54.58 55.52 1pq2 n ASN 218 Cb 0.07 0.18 -0.08 0.00 -1.54 0.00 0.00 39.78 38.41 1pq2 n ASN 218 CO 0.00 0.00 0.00 0.49 0.28 0.00 0.00 177.26 178.03 1pq2 n PHE 219 N -1.05 -0.22 -0.35 3.10 3.01 -0.28 -4.20 117.46 117.46 1pq2 n PHE 219 Ca 0.09 -3.54 0.10 0.00 1.01 0.00 0.00 57.45 55.11 1pq2 n PHE 219 Cb 0.34 -0.20 0.22 0.00 -0.01 0.00 0.00 39.48 39.82 1pq2 n PHE 219 CO 0.00 0.00 0.00 -1.35 1.01 0.00 0.00 176.76 176.42 1pq2 h PRO 220 N 4.47 0.01 -0.03 -1.08 0.11 -1.66 0.73 132.00 134.55 1pq2 h PRO 220 Ca 0.13 -0.00 0.01 0.00 0.11 0.00 0.00 66.00 66.25 1pq2 h PRO 220 Cb 0.87 -0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.98 1pq2 h PRO 220 CO 0.46 0.00 0.35 -0.07 -0.21 0.00 0.00 178.00 178.54 1pq2 h LEU 221 N 0.01 0.00 -0.16 2.35 4.07 -1.96 0.15 115.31 119.77 1pq2 h LEU 221 Ca 0.54 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.50 1pq2 h LEU 221 Cb 0.98 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.72 1pq2 h LEU 221 CO -0.96 0.00 0.00 0.18 -1.08 0.00 0.00 178.44 176.58 1pq2 n LEU 222 N -2.95 0.47 -0.03 1.67 4.32 0.25 -3.06 117.00 117.67 1pq2 n LEU 222 Ca -0.01 0.57 -0.01 0.00 -0.02 0.00 0.00 56.01 56.53 1pq2 n LEU 222 Cb 0.41 -0.45 0.26 0.00 -1.62 0.00 0.00 43.42 42.02 1pq2 n LEU 222 CO 0.14 -0.23 0.92 0.40 -1.22 0.00 0.00 177.39 177.40 1pq2 h ILE 223 N 0.00 1.21 -0.26 -0.08 1.08 -0.86 -2.14 117.51 116.47 1pq2 h ILE 223 Ca 0.00 -0.84 0.07 0.00 -0.39 0.00 0.00 64.86 63.70 1pq2 h ILE 223 Cb 0.53 0.92 -0.01 0.00 -3.07 0.00 0.00 36.82 35.18 1pq2 h ILE 223 CO 0.00 0.29 0.21 -0.78 -0.69 0.00 0.00 178.15 177.18 1pq2 h ASP 224 N 0.57 0.00 0.00 1.72 1.82 -1.73 0.75 116.42 119.56 1pq2 h ASP 224 Ca 0.12 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.76 1pq2 h ASP 224 Cb 0.36 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.37 1pq2 h ASP 224 CO 0.01 0.00 0.00 0.00 -1.61 0.00 0.00 179.24 177.64 1pq2 n PHE 226 N -0.98 0.36 -0.05 0.00 3.72 0.26 -4.96 117.46 115.81 1pq2 n PHE 226 Ca 0.16 -3.63 -0.15 0.00 -0.05 0.00 0.00 57.45 53.79 1pq2 n PHE 226 Cb 0.07 -0.15 -0.12 0.00 -0.94 0.00 0.00 39.48 38.34 1pq2 n PHE 226 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 176.76 175.36 1pq2 h PRO 227 N 4.92 0.06 -0.91 -1.08 0.11 -1.75 -2.53 132.00 130.81 1pq2 h PRO 227 Ca 0.18 -0.08 0.08 0.00 0.11 0.00 0.00 66.00 66.30 1pq2 h PRO 227 Cb 0.85 0.03 -0.06 0.00 0.11 0.00 0.00 31.00 31.92 1pq2 h PRO 227 CO 0.50 0.95 0.59 0.78 -0.21 0.00 0.00 178.00 180.60 1pq2 h GLY 228 N -0.80 1.33 1.02 -0.55 0.00 -1.95 0.41 103.07 102.54 1pq2 h GLY 228 Ca -0.02 -0.40 -0.27 0.00 0.00 0.00 0.00 47.33 46.64 1pq2 h GLY 228 CO 0.02 0.26 -1.17 -0.84 0.00 0.00 0.00 176.54 174.81 1pq2 h THR 229 N 0.97 1.37 -0.55 4.70 2.02 -1.98 -1.49 112.91 117.96 1pq2 h THR 229 Ca 0.41 -2.58 0.08 0.00 0.77 0.00 0.00 66.41 65.08 1pq2 h THR 229 Cb 0.30 3.04 -0.06 0.00 -1.74 0.00 0.00 68.15 69.69 1pq2 h THR 229 CO -0.17 0.76 0.20 -0.74 0.37 0.00 0.00 175.52 175.94 1pq2 h HIS 230 N -0.04 0.35 -0.15 3.16 6.17 -1.05 -0.67 115.15 122.92 1pq2 h HIS 230 Ca -0.20 0.03 -0.01 0.00 0.71 0.00 0.00 60.37 60.90 1pq2 h HIS 230 Cb 1.91 -0.07 -0.01 0.00 2.52 0.00 0.00 27.41 31.76 1pq2 h HIS 230 CO 0.15 0.10 0.07 -0.91 0.71 0.00 0.00 177.93 178.05 1pq2 h ASN 231 N 0.38 0.20 -0.31 3.26 -0.26 -0.95 -1.50 115.58 116.40 1pq2 h ASN 231 Ca 0.27 -0.13 0.06 0.00 -0.56 0.00 0.00 56.30 55.94 1pq2 h ASN 231 Cb 0.31 -0.05 -0.02 0.00 -1.06 0.00 0.00 38.32 37.51 1pq2 h ASN 231 CO -0.28 0.27 0.21 0.50 -1.06 0.00 0.00 177.43 177.08 1pq2 h LYS 232 N 0.11 0.16 -0.00 0.81 1.63 -0.54 -1.50 116.57 117.25 1pq2 h LYS 232 Ca 0.05 -0.01 -0.02 0.00 -0.85 0.00 0.00 60.65 59.82 1pq2 h LYS 232 Cb 0.13 -0.04 0.00 0.00 -0.60 0.00 0.00 32.23 31.72 1pq2 h LYS 232 CO -0.01 0.11 -0.09 0.28 -3.45 0.00 0.00 179.45 176.30 1pq2 h VAL 233 N 0.17 1.60 -0.80 2.00 2.07 -0.70 -2.98 116.25 117.60 1pq2 h VAL 233 Ca 0.14 -1.88 0.03 0.00 0.82 0.00 0.00 66.70 65.81 1pq2 h VAL 233 Cb 0.33 2.85 -0.05 0.00 -1.52 0.00 0.00 31.29 32.90 1pq2 h VAL 233 CO -0.02 0.50 0.51 -0.07 0.02 0.00 0.00 177.57 178.51 1pq2 h LEU 234 N -0.69 0.85 -0.10 2.57 3.38 -0.86 -2.10 115.31 118.37 1pq2 h LEU 234 Ca -0.01 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 1pq2 h LEU 234 Cb 0.86 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.42 1pq2 h LEU 234 CO 0.02 0.58 0.02 0.11 0.09 0.00 0.00 178.44 179.27 1pq2 h LYS 235 N 1.00 0.15 -0.39 1.13 1.57 -1.40 -0.07 116.57 118.56 1pq2 h LYS 235 Ca 0.32 -0.04 0.10 0.00 -1.87 0.00 0.00 60.65 59.17 1pq2 h LYS 235 Cb 0.01 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.29 1pq2 h LYS 235 CO -0.11 0.33 0.28 -0.91 -0.57 0.00 0.00 179.45 178.46 1pq2 h ASN 236 N -0.05 0.06 0.15 0.86 -0.26 -1.33 0.15 115.58 115.16 1pq2 h ASN 236 Ca 0.03 0.00 -0.01 0.00 -0.56 0.00 0.00 56.30 55.76 1pq2 h ASN 236 Cb 0.24 -0.01 0.00 0.00 -1.06 0.00 0.00 38.32 37.49 1pq2 h ASN 236 CO 0.00 0.04 -0.07 0.58 -1.06 0.00 0.00 177.43 176.92 1pq2 h VAL 237 N 0.07 0.00 -1.21 2.81 2.07 -1.00 -2.56 116.25 116.44 1pq2 h VAL 237 Ca 0.18 -0.39 0.35 0.00 0.82 0.00 0.00 66.70 67.66 1pq2 h VAL 237 Cb 0.64 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 30.35 1pq2 h VAL 237 CO -0.01 0.00 0.85 0.00 0.02 0.00 0.00 177.57 178.42 1pq2 h ALA 238 N -1.52 2.95 -0.03 1.67 0.00 -0.64 0.19 119.26 121.88 1pq2 h ALA 238 Ca -0.02 -0.01 -0.26 0.00 0.00 0.00 0.00 54.91 54.62 1pq2 h ALA 238 Cb 0.15 0.09 0.02 0.00 0.00 0.00 0.00 17.79 18.05 1pq2 h ALA 238 CO 0.03 -1.34 -0.99 -0.07 0.00 0.00 0.00 179.25 176.89 1pq2 h LEU 239 N 0.09 0.90 -0.30 0.00 -0.00 -0.78 -2.15 115.31 113.08 1pq2 h LEU 239 Ca 0.61 -0.69 -0.20 0.00 -0.00 0.00 0.00 57.88 57.59 1pq2 h LEU 239 Cb 2.20 -0.27 -0.01 0.00 -0.00 0.00 0.00 40.66 42.58 1pq2 h LEU 239 CO -0.09 1.50 -0.86 0.74 -0.00 0.00 0.00 178.44 179.72 1pq2 h THR 240 N 0.42 1.47 -0.34 0.22 2.02 -0.26 -2.13 112.91 114.31 1pq2 h THR 240 Ca -0.11 -2.54 -0.07 0.00 0.77 0.00 0.00 66.41 64.46 1pq2 h THR 240 Cb 1.63 2.42 -0.01 0.00 -1.74 0.00 0.00 68.15 70.45 1pq2 h THR 240 CO 0.19 0.74 -0.05 0.03 0.37 0.00 0.00 175.52 176.81 1pq2 h ARG 241 N 0.13 0.63 -0.81 6.66 3.08 -1.13 -0.74 114.38 122.20 1pq2 h ARG 241 Ca -0.04 -0.23 0.10 0.00 0.07 0.00 0.00 59.98 59.88 1pq2 h ARG 241 Cb 1.48 -0.04 -0.06 0.00 0.08 0.00 0.00 29.97 31.43 1pq2 h ARG 241 CO 0.13 0.78 0.53 1.03 -1.07 0.00 0.00 179.97 181.38 1pq2 h SER 242 N 0.42 0.66 0.12 7.04 0.87 -1.34 0.46 113.55 121.78 1pq2 h SER 242 Ca 0.09 0.02 -0.18 0.00 -1.23 0.00 0.00 61.79 60.49 1pq2 h SER 242 Cb 0.53 -0.12 -0.00 0.00 -0.44 0.00 0.00 62.40 62.37 1pq2 h SER 242 CO 0.03 0.38 -0.67 0.22 -0.53 0.00 0.00 176.83 176.26 1pq2 h TYR 243 N 0.72 0.67 0.07 2.24 3.20 -0.74 -2.95 116.97 120.18 1pq2 h TYR 243 Ca 0.38 -0.27 -0.28 0.00 3.14 0.00 0.00 58.73 61.69 1pq2 h TYR 243 Cb 0.49 -0.11 0.02 0.00 1.54 0.00 0.00 36.73 38.67 1pq2 h TYR 243 CO -0.00 1.03 -1.15 0.82 -1.64 0.00 0.00 178.16 177.22 1pq2 h ILE 244 N 0.37 1.29 -0.51 1.81 2.04 -0.35 -2.33 117.51 119.83 1pq2 h ILE 244 Ca -0.02 -2.40 0.10 0.00 1.00 0.00 0.00 64.86 63.54 1pq2 h ILE 244 Cb 1.24 2.56 -0.08 0.00 -0.74 0.00 0.00 36.82 39.79 1pq2 h ILE 244 CO 0.12 0.73 -0.00 0.03 0.00 0.00 0.00 178.15 179.03 1pq2 h ARG 245 N 0.32 0.11 -0.25 2.37 2.47 -0.12 0.58 114.38 119.85 1pq2 h ARG 245 Ca -0.16 -0.01 -0.15 0.00 -1.26 0.00 0.00 59.98 58.41 1pq2 h ARG 245 Cb 1.81 -0.02 -0.00 0.00 -1.65 0.00 0.00 29.97 30.11 1pq2 h ARG 245 CO 0.22 0.07 -0.43 1.05 0.56 0.00 0.00 179.97 181.44 1pq2 h GLU 246 N 0.11 0.74 0.00 0.04 4.11 -1.57 -2.02 114.58 115.99 1pq2 h GLU 246 Ca 0.26 -0.46 -0.00 0.00 0.07 0.00 0.00 59.36 59.23 1pq2 h GLU 246 Cb 0.39 0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.69 1pq2 h GLU 246 CO -0.43 1.08 -0.02 -0.22 0.07 0.00 0.00 179.01 179.49 1pq2 h LYS 247 N 0.47 0.00 0.06 1.06 1.63 -0.77 0.01 116.57 119.04 1pq2 h LYS 247 Ca 0.02 0.00 -0.17 0.00 -0.85 0.00 0.00 60.65 59.65 1pq2 h LYS 247 Cb 1.03 0.00 0.02 0.00 -0.60 0.00 0.00 32.23 32.67 1pq2 h LYS 247 CO 0.10 0.02 -0.69 0.28 -3.45 0.00 0.00 179.45 175.70 1pq2 h VAL 248 N 0.00 1.47 -0.93 2.00 2.07 -0.72 -2.95 116.25 117.19 1pq2 h VAL 248 Ca -0.00 -2.28 0.00 0.00 0.82 0.00 0.00 66.70 65.25 1pq2 h VAL 248 Cb 0.04 2.86 -0.05 0.00 -1.52 0.00 0.00 31.29 32.62 1pq2 h VAL 248 CO 0.00 0.65 0.60 0.11 0.02 0.00 0.00 177.57 178.95 1pq2 h LYS 249 N -0.22 1.23 0.00 1.57 1.57 -0.43 0.16 116.57 120.45 1pq2 h LYS 249 Ca -0.10 -0.09 -0.05 0.00 -1.87 0.00 0.00 60.65 58.54 1pq2 h LYS 249 Cb 1.45 -0.27 -0.01 0.00 0.08 0.00 0.00 32.23 33.49 1pq2 h LYS 249 CO 0.13 0.83 -0.25 1.05 -0.57 0.00 0.00 179.45 180.64 1pq2 h GLU 250 N 1.26 0.00 -0.05 3.15 4.11 -1.13 -2.62 114.58 119.31 1pq2 h GLU 250 Ca 0.34 0.00 -0.09 0.00 0.07 0.00 0.00 59.36 59.68 1pq2 h GLU 250 Cb -0.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.14 1pq2 h GLU 250 CO -0.07 0.25 -0.30 0.45 0.07 0.00 0.00 179.01 179.41 1pq2 h HIS 251 N 0.00 0.39 -0.43 2.06 3.86 -0.85 -3.20 115.15 116.99 1pq2 h HIS 251 Ca -0.00 -0.18 0.12 0.00 -1.16 0.00 0.00 60.37 59.15 1pq2 h HIS 251 Cb 0.68 -0.06 -0.02 0.00 1.06 0.00 0.00 27.41 29.07 1pq2 h HIS 251 CO 0.00 0.93 0.44 1.96 0.86 0.00 0.00 177.93 182.12 1pq2 h GLN 252 N -0.26 0.00 0.00 2.45 4.20 -0.42 -0.39 115.11 120.70 1pq2 h GLN 252 Ca -0.03 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.68 1pq2 h GLN 252 Cb 0.98 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.76 1pq2 h GLN 252 CO 0.06 0.00 -0.79 0.00 -0.67 0.00 0.00 178.83 177.43 1pq2 h ALA 253 N 1.52 0.58 -0.08 3.87 0.00 -1.50 -3.35 119.26 120.29 1pq2 h ALA 253 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1pq2 h ALA 253 Cb 1.08 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.87 1pq2 h ALA 253 CO -0.00 0.00 0.00 -1.13 0.00 0.00 0.00 179.25 178.12 1pq2 n SER 254 N -2.58 2.53 -4.69 0.00 3.41 -0.24 -5.06 113.62 106.99 1pq2 n SER 254 Ca 0.01 -2.57 -0.42 0.00 -0.26 0.00 0.00 58.87 55.63 1pq2 n SER 254 Cb 0.52 -0.28 -0.03 0.00 -0.26 0.00 0.00 64.21 64.16 1pq2 n SER 254 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 1pq2 s LEU 255 N -2.00 4.36 -0.44 1.04 2.96 -0.68 -4.99 118.68 118.93 1pq2 s LEU 255 Ca 0.21 2.47 0.03 0.00 -0.22 0.00 0.00 54.13 56.62 1pq2 s LEU 255 Cb 0.17 -3.57 0.12 0.00 0.50 0.00 0.00 46.19 43.42 1pq2 s LEU 255 CO 0.04 -0.86 0.20 -0.62 -1.32 0.00 0.00 176.35 173.79 1pq2 s ASP 256 N 2.18 4.17 0.63 3.68 2.15 -1.26 -4.98 116.67 123.24 1pq2 s ASP 256 Ca 0.72 -2.59 0.28 0.00 0.43 0.00 0.00 52.55 51.39 1pq2 s ASP 256 Cb -0.40 -1.37 1.45 0.00 -0.30 0.00 0.00 42.92 42.30 1pq2 s ASP 256 CO 0.32 -0.29 1.84 -0.37 -0.17 0.00 0.00 175.17 176.50 1pq2 h VAL 257 N 5.73 0.16 0.00 1.11 -1.51 -1.97 0.48 116.25 120.25 1pq2 h VAL 257 Ca -0.06 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.41 1pq2 h VAL 257 Cb 0.94 0.59 0.00 0.00 -2.13 0.00 0.00 31.29 30.69 1pq2 h VAL 257 CO 0.57 0.00 -0.02 0.78 -1.23 0.00 0.00 177.57 177.67 1pq2 h ASN 258 N 0.00 0.00 -2.07 4.19 2.35 -2.03 -3.39 115.58 114.63 1pq2 h ASN 258 Ca 0.10 -0.00 -0.48 0.00 -0.55 0.00 0.00 56.30 55.37 1pq2 h ASN 258 Cb 1.02 0.00 -0.33 0.00 0.05 0.00 0.00 38.32 39.06 1pq2 h ASN 258 CO -0.00 0.00 -0.84 0.20 -1.65 0.00 0.00 177.43 175.14 1pq2 s ASN 259 N -5.70 0.96 0.61 5.81 0.01 0.16 -5.09 114.94 111.70 1pq2 s ASN 259 Ca 0.08 -2.58 -0.18 0.00 -0.71 0.00 0.00 52.86 49.47 1pq2 s ASN 259 Cb 0.07 0.13 -0.03 0.00 0.41 0.00 0.00 41.25 41.83 1pq2 s ASN 259 CO 0.65 -0.17 1.20 -2.84 -1.51 0.00 0.00 177.10 174.43 1pq2 s PRO 260 N 0.45 2.88 -0.20 -0.60 0.02 -1.23 -4.70 135.00 131.62 1pq2 s PRO 260 Ca 0.29 1.78 0.03 0.00 0.02 0.00 0.00 61.00 63.13 1pq2 s PRO 260 Cb -0.01 -1.92 -0.14 0.00 0.02 0.00 0.00 34.50 32.44 1pq2 s PRO 260 CO -0.13 -1.27 -0.15 0.54 -0.33 0.00 0.00 177.00 175.66 1pq2 n ARG 261 N -1.77 0.64 -1.47 5.54 1.74 -1.26 -4.34 116.66 115.75 1pq2 n ARG 261 Ca 0.13 0.10 0.00 0.00 -0.77 0.00 0.00 57.85 57.31 1pq2 n ARG 261 Cb 0.50 -1.41 0.00 0.00 -1.02 0.00 0.00 32.46 30.52 1pq2 n ARG 261 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 1pq2 n ASP 262 N -3.03 0.00 -0.28 0.55 3.85 -1.26 -4.73 116.55 111.64 1pq2 n ASP 262 Ca -0.35 -0.92 0.02 0.00 -0.71 0.00 0.00 54.79 52.82 1pq2 n ASP 262 Cb 0.91 0.00 0.22 0.00 -1.35 0.00 0.00 41.12 40.90 1pq2 n ASP 262 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.20 176.34 1pq2 h PHE 263 N 0.92 1.04 -0.35 2.11 3.57 -1.38 -2.31 116.94 120.54 1pq2 h PHE 263 Ca 0.00 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.52 1pq2 h PHE 263 Cb 0.00 -0.35 -0.02 0.00 2.79 0.00 0.00 35.95 38.38 1pq2 h PHE 263 CO 0.00 0.61 0.20 0.82 -2.23 0.00 0.00 178.31 177.71 1pq2 h ILE 264 N 1.08 1.13 -0.20 1.41 1.08 -1.81 -2.83 117.51 117.36 1pq2 h ILE 264 Ca 0.34 -0.32 -0.00 0.00 -0.39 0.00 0.00 64.86 64.49 1pq2 h ILE 264 Cb 0.01 0.71 -0.01 0.00 -3.07 0.00 0.00 36.82 34.45 1pq2 h ILE 264 CO -0.10 0.13 0.12 0.44 -0.69 0.00 0.00 178.15 178.05 1pq2 h ASP 265 N 0.45 0.25 -0.72 1.72 3.32 -1.74 -0.55 116.42 119.15 1pq2 h ASP 265 Ca 0.12 -0.05 0.14 0.00 0.02 0.00 0.00 57.03 57.26 1pq2 h ASP 265 Cb 0.03 -0.06 -0.05 0.00 0.22 0.00 0.00 39.33 39.47 1pq2 h ASP 265 CO -0.02 0.23 0.49 0.00 -1.72 0.00 0.00 179.24 178.21 1pq2 h PHE 267 N 0.38 0.25 -0.66 0.00 3.57 -1.15 -1.81 116.94 117.52 1pq2 h PHE 267 Ca 0.35 -0.15 0.05 0.00 3.53 0.00 0.00 57.97 61.75 1pq2 h PHE 267 Cb 0.83 -0.02 -0.04 0.00 2.79 0.00 0.00 35.95 39.51 1pq2 h PHE 267 CO -0.00 1.00 0.44 -0.07 -2.23 0.00 0.00 178.31 177.45 1pq2 h LEU 268 N -0.58 0.64 0.16 0.59 3.38 -0.26 0.25 115.31 119.49 1pq2 h LEU 268 Ca -0.04 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 1pq2 h LEU 268 Cb 1.09 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.70 1pq2 h LEU 268 CO 0.05 0.43 -0.08 0.40 0.09 0.00 0.00 178.44 179.33 1pq2 h ILE 269 N 0.73 0.96 -0.35 1.22 2.04 -1.00 -2.59 117.51 118.53 1pq2 h ILE 269 Ca 0.28 -0.61 0.09 0.00 1.00 0.00 0.00 64.86 65.61 1pq2 h ILE 269 Cb 0.17 1.33 -0.02 0.00 -0.74 0.00 0.00 36.82 37.56 1pq2 h ILE 269 CO -0.08 0.14 0.25 0.50 0.00 0.00 0.00 178.15 178.95 1pq2 h LYS 270 N -0.52 0.06 -0.12 2.37 1.63 -0.35 0.26 116.57 119.90 1pq2 h LYS 270 Ca -0.02 -0.00 -0.01 0.00 -0.85 0.00 0.00 60.65 59.76 1pq2 h LYS 270 Cb 0.40 -0.01 -0.00 0.00 -0.60 0.00 0.00 32.23 32.01 1pq2 h LYS 270 CO 0.04 0.04 0.02 0.52 -3.45 0.00 0.00 179.45 176.61 1pq2 h MET 271 N 0.06 0.20 -0.35 1.90 2.86 -0.30 -2.88 114.93 116.42 1pq2 h MET 271 Ca 0.16 -0.06 0.03 0.00 -2.06 0.00 0.00 59.70 57.78 1pq2 h MET 271 Cb 0.58 -0.02 -0.03 0.00 0.06 0.00 0.00 31.60 32.18 1pq2 h MET 271 CO -0.01 0.40 0.17 1.49 1.06 0.00 0.00 176.91 180.02 1pq2 h GLU 272 N -0.04 0.34 -0.77 1.72 4.57 -0.61 0.14 114.58 119.92 1pq2 h GLU 272 Ca 0.04 -0.02 0.22 0.00 -1.18 0.00 0.00 59.36 58.42 1pq2 h GLU 272 Cb 0.30 -0.08 -0.03 0.00 -0.16 0.00 0.00 28.75 28.79 1pq2 h GLU 272 CO 0.00 0.22 0.73 0.37 -1.18 0.00 0.00 179.01 179.15 1pq2 h GLN 273 N 0.35 0.00 -0.40 1.92 4.15 -1.15 0.21 115.11 120.18 1pq2 h GLN 273 Ca 0.15 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.57 1pq2 h GLN 273 Cb 0.07 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.76 1pq2 h GLN 273 CO -0.11 0.00 0.00 0.39 -1.93 0.00 0.00 178.83 177.18 1pq2 n GLU 274 N -3.76 2.59 0.00 1.69 -0.58 0.40 -4.90 120.64 116.07 1pq2 n GLU 274 Ca 0.16 -2.12 0.00 0.00 -0.42 0.00 0.00 57.16 54.78 1pq2 n GLU 274 Cb 1.00 -1.35 0.00 0.00 -0.57 0.00 0.00 31.44 30.52 1pq2 n GLU 274 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 1pq2 n LYS 275 N 0.86 0.00 -3.11 3.49 5.02 0.75 -0.47 118.16 124.70 1pq2 n LYS 275 Ca 0.15 0.00 -0.37 0.00 -2.02 0.00 0.00 58.31 56.07 1pq2 n LYS 275 Cb 0.47 0.00 -0.02 0.00 -0.02 0.00 0.00 35.03 35.46 1pq2 n LYS 275 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1pq2 n ASP 276 N -0.39 5.54 0.00 4.39 5.75 -1.26 -4.32 116.55 126.26 1pq2 n ASP 276 Ca 0.00 -3.46 0.00 0.00 -0.01 0.00 0.00 54.79 51.32 1pq2 n ASP 276 Cb 0.00 -1.03 0.00 0.00 -1.03 0.00 0.00 41.12 39.06 1pq2 n ASP 276 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 1pq2 n ASN 277 N 0.97 3.86 0.00 -1.12 2.85 0.38 -5.02 115.26 117.19 1pq2 n ASN 277 Ca 0.29 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.76 1pq2 n ASN 277 Cb 0.35 0.39 0.00 0.00 1.24 0.00 0.00 39.78 41.77 1pq2 n ASN 277 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1pq2 n GLN 278 N -1.65 0.00 0.26 1.20 0.00 -1.26 -3.51 117.38 112.42 1pq2 n GLN 278 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 57.00 57.03 1pq2 n GLN 278 Cb 0.38 0.00 0.14 0.00 0.00 0.00 0.00 30.24 30.76 1pq2 n GLN 278 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.06 178.63 1pq2 h LYS 279 N 0.00 0.00 -6.64 2.61 2.10 -1.96 -3.40 116.57 109.28 1pq2 h LYS 279 Ca 0.00 0.00 -0.52 0.00 -2.00 0.00 0.00 60.65 58.13 1pq2 h LYS 279 Cb 0.00 0.00 0.05 0.00 -0.90 0.00 0.00 32.23 31.38 1pq2 h LYS 279 CO 0.00 0.00 0.98 -1.54 -2.00 0.00 0.00 179.45 176.89 1pq2 s SER 280 N -3.04 6.44 0.13 7.07 1.04 -1.23 -4.79 113.70 119.32 1pq2 s SER 280 Ca -0.01 2.79 0.08 0.00 0.48 0.00 0.00 55.95 59.30 1pq2 s SER 280 Cb 0.01 -2.60 0.44 0.00 0.10 0.00 0.00 66.02 63.98 1pq2 s SER 280 CO 0.05 -0.93 1.22 -0.62 0.98 0.00 0.00 173.24 173.94 1pq2 n GLU 281 N 4.03 0.05 -2.60 4.02 -0.58 -1.26 -4.41 120.64 119.90 1pq2 n GLU 281 Ca 0.15 0.53 -0.41 0.00 -0.42 0.00 0.00 57.16 57.01 1pq2 n GLU 281 Cb 0.36 -1.71 -0.03 0.00 -0.57 0.00 0.00 31.44 29.49 1pq2 n GLU 281 CO 0.00 0.00 0.00 -0.06 -0.48 0.00 0.00 177.13 176.59 1pq2 s PHE 282 N -3.17 2.45 0.33 -0.32 0.08 -1.26 -4.55 117.98 111.53 1pq2 s PHE 282 Ca -0.01 -0.46 -0.03 0.00 0.12 0.00 0.00 56.93 56.56 1pq2 s PHE 282 Cb 0.02 -4.61 -0.00 0.00 -0.57 0.00 0.00 43.02 37.86 1pq2 s PHE 282 CO 0.07 -1.97 0.45 0.54 -0.10 0.00 0.00 175.22 174.22 1pq2 s ASN 283 N 4.21 0.82 0.11 1.36 2.20 -1.26 -4.78 114.94 117.59 1pq2 s ASN 283 Ca 0.38 -1.44 -0.18 0.00 -0.94 0.00 0.00 52.86 50.68 1pq2 s ASN 283 Cb -0.05 0.64 -0.05 0.00 -2.00 0.00 0.00 41.25 39.78 1pq2 s ASN 283 CO 0.04 -1.25 1.63 0.40 -2.94 0.00 0.00 177.10 174.97 1pq2 h ILE 284 N 2.15 1.20 -0.34 0.54 1.08 -1.99 -1.72 117.51 118.43 1pq2 h ILE 284 Ca -0.28 -0.62 0.07 0.00 -0.39 0.00 0.00 64.86 63.63 1pq2 h ILE 284 Cb 1.24 1.07 -0.08 0.00 -3.07 0.00 0.00 36.82 35.97 1pq2 h ILE 284 CO 0.39 0.21 -0.34 -0.08 -0.69 0.00 0.00 178.15 177.64 1pq2 h GLU 285 N 0.31 -0.29 0.00 2.37 4.57 -1.97 0.16 114.58 119.72 1pq2 h GLU 285 Ca 0.09 0.02 -0.05 0.00 -1.18 0.00 0.00 59.36 58.25 1pq2 h GLU 285 Cb 0.23 0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 28.88 1pq2 h GLU 285 CO -0.00 -0.19 -0.23 -0.97 -1.18 0.00 0.00 179.01 176.44 1pq2 h ASN 286 N -0.30 0.00 0.03 1.04 -0.73 -1.78 -2.62 115.58 111.21 1pq2 h ASN 286 Ca 0.15 0.00 -0.26 0.00 1.87 0.00 0.00 56.30 58.06 1pq2 h ASN 286 Cb 0.55 0.00 0.02 0.00 0.27 0.00 0.00 38.32 39.16 1pq2 h ASN 286 CO -0.50 0.23 -1.02 0.25 -0.37 0.00 0.00 177.43 176.02 1pq2 h LEU 287 N 0.00 0.85 0.11 0.34 5.85 -0.14 -2.33 115.31 120.01 1pq2 h LEU 287 Ca -0.00 -0.76 -0.01 0.00 0.84 0.00 0.00 57.88 57.95 1pq2 h LEU 287 Cb 0.59 -0.26 0.00 0.00 0.37 0.00 0.00 40.66 41.36 1pq2 h LEU 287 CO 0.03 1.51 -0.05 0.58 -0.34 0.00 0.00 178.44 180.16 1pq2 h VAL 288 N 0.29 1.02 -0.75 1.05 2.07 -0.93 -2.67 116.25 116.34 1pq2 h VAL 288 Ca -0.13 -0.53 0.09 0.00 0.82 0.00 0.00 66.70 66.94 1pq2 h VAL 288 Cb 1.69 1.36 -0.07 0.00 -1.52 0.00 0.00 31.29 32.75 1pq2 h VAL 288 CO 0.20 0.13 0.40 1.23 0.02 0.00 0.00 177.57 179.55 1pq2 h GLY 289 N -0.40 1.13 1.64 2.17 0.00 -1.56 -1.19 103.07 104.87 1pq2 h GLY 289 Ca -0.02 -0.26 -0.08 0.00 0.00 0.00 0.00 47.33 46.98 1pq2 h GLY 289 CO 0.03 0.09 -0.19 0.00 0.00 0.00 0.00 176.54 176.47 1pq2 h THR 290 N 0.68 1.24 -0.18 4.70 1.03 -1.38 0.93 112.91 119.92 1pq2 h THR 290 Ca 0.36 -1.10 -0.04 0.00 -0.01 0.00 0.00 66.41 65.62 1pq2 h THR 290 Cb 0.35 1.26 -0.01 0.00 -1.07 0.00 0.00 68.15 68.68 1pq2 h THR 290 CO -0.25 0.35 -0.06 0.58 -0.01 0.00 0.00 175.52 176.13 1pq2 h VAL 291 N 0.39 1.29 -0.20 0.00 2.07 -0.96 -2.15 116.25 116.68 1pq2 h VAL 291 Ca 0.07 -1.05 0.06 0.00 0.82 0.00 0.00 66.70 66.59 1pq2 h VAL 291 Cb 0.55 1.61 -0.07 0.00 -1.52 0.00 0.00 31.29 31.87 1pq2 h VAL 291 CO 0.04 0.31 -0.28 0.00 0.02 0.00 0.00 177.57 177.66 1pq2 h ALA 292 N 0.71 -0.23 -0.04 1.67 0.00 -0.90 0.16 119.26 120.63 1pq2 h ALA 292 Ca 0.04 0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.02 1pq2 h ALA 292 Cb 0.51 0.56 -0.00 0.00 0.00 0.00 0.00 17.79 18.85 1pq2 h ALA 292 CO 0.02 -0.72 0.23 -0.44 0.00 0.00 0.00 179.25 178.34 1pq2 h ASP 293 N -0.31 0.00 0.67 0.00 3.45 -0.51 0.18 116.42 119.89 1pq2 h ASP 293 Ca 0.12 0.00 -0.27 0.00 0.43 0.00 0.00 57.03 57.31 1pq2 h ASP 293 Cb 0.50 0.00 -0.02 0.00 -0.56 0.00 0.00 39.33 39.25 1pq2 h ASP 293 CO -0.38 0.00 -1.32 -0.07 -1.57 0.00 0.00 179.24 175.90 1pq2 h LEU 294 N 0.00 0.23 -0.07 1.55 3.38 -0.05 -2.65 115.31 117.69 1pq2 h LEU 294 Ca 0.02 -0.28 -0.07 0.00 0.09 0.00 0.00 57.88 57.64 1pq2 h LEU 294 Cb 0.49 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.17 1pq2 h LEU 294 CO -0.00 1.23 -0.21 -0.26 0.09 0.00 0.00 178.44 179.29 1pq2 h PHE 295 N 0.04 0.34 0.26 1.13 -1.00 -0.24 -0.74 116.94 116.74 1pq2 h PHE 295 Ca -0.15 -0.14 0.01 0.00 2.81 0.00 0.00 57.97 60.49 1pq2 h PHE 295 Cb 1.93 -0.06 -0.04 0.00 3.61 0.00 0.00 35.95 41.39 1pq2 h PHE 295 CO 0.04 0.83 -0.47 0.28 -1.61 0.00 0.00 178.31 177.37 1pq2 h VAL 296 N -0.24 0.08 0.00 -0.55 2.07 -1.31 -1.33 116.25 114.97 1pq2 h VAL 296 Ca -0.01 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.51 1pq2 h VAL 296 Cb 0.84 0.08 0.00 0.00 -1.52 0.00 0.00 31.29 30.69 1pq2 h VAL 296 CO 0.05 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.64 1pq2 h ALA 297 N -0.50 1.00 -0.00 1.67 0.00 -1.55 -3.35 119.26 116.53 1pq2 h ALA 297 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1pq2 h ALA 297 Cb 0.77 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.56 1pq2 h ALA 297 CO -0.18 0.00 -0.15 0.41 0.00 0.00 0.00 179.25 179.33 1pq2 n GLY 298 N 0.61 -0.09 0.00 0.00 0.00 -0.28 -4.60 105.19 100.82 1pq2 n GLY 298 Ca 0.03 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.88 1pq2 n GLY 298 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1pq2 n THR 299 N -0.49 0.00 -0.32 2.61 -1.04 -0.51 -4.15 114.28 110.38 1pq2 n THR 299 Ca 0.02 0.22 -0.04 0.00 -2.04 0.00 0.00 64.05 62.20 1pq2 n THR 299 Cb 0.11 -0.82 0.08 0.00 -1.82 0.00 0.00 70.33 67.88 1pq2 n THR 299 CO 0.00 0.00 0.00 -0.08 -0.64 0.00 0.00 175.07 174.35 1pq2 h GLU 300 N 0.00 1.20 -0.55 -2.82 4.57 -1.77 -0.05 114.58 115.16 1pq2 h GLU 300 Ca 0.00 -0.15 0.06 0.00 -1.18 0.00 0.00 59.36 58.09 1pq2 h GLU 300 Cb 0.00 -0.23 -0.05 0.00 -0.16 0.00 0.00 28.75 28.31 1pq2 h GLU 300 CO 0.00 0.89 0.26 1.79 -1.18 0.00 0.00 179.01 180.77 1pq2 h THR 301 N 1.20 0.91 -0.12 0.32 1.35 -1.83 0.49 112.91 115.23 1pq2 h THR 301 Ca 0.30 -0.17 -0.15 0.00 -0.55 0.00 0.00 66.41 65.84 1pq2 h THR 301 Cb 0.05 0.37 0.01 0.00 -1.73 0.00 0.00 68.15 66.85 1pq2 h THR 301 CO -0.05 0.09 -0.53 0.74 -0.25 0.00 0.00 175.52 175.53 1pq2 h THR 302 N 0.49 1.35 0.19 6.82 2.02 -1.68 -2.51 112.91 119.60 1pq2 h THR 302 Ca 0.25 -1.83 0.01 0.00 0.77 0.00 0.00 66.41 65.61 1pq2 h THR 302 Cb 0.20 2.15 -0.03 0.00 -1.74 0.00 0.00 68.15 68.73 1pq2 h THR 302 CO -0.20 0.55 -0.29 -1.28 0.37 0.00 0.00 175.52 174.67 1pq2 h SER 303 N 0.18 -0.82 -0.79 4.18 0.87 -0.50 -1.65 113.55 115.02 1pq2 h SER 303 Ca -0.03 0.09 0.10 0.00 -1.23 0.00 0.00 61.79 60.71 1pq2 h SER 303 Cb 1.17 0.30 -0.07 0.00 -0.44 0.00 0.00 62.40 63.35 1pq2 h SER 303 CO 0.11 -0.40 0.44 0.74 -0.53 0.00 0.00 176.83 177.19 1pq2 h THR 304 N -0.55 0.89 -0.14 2.23 2.02 -0.08 -1.17 112.91 116.11 1pq2 h THR 304 Ca 0.01 -0.25 -0.06 0.00 0.77 0.00 0.00 66.41 66.88 1pq2 h THR 304 Cb 0.55 0.09 -0.01 0.00 -1.74 0.00 0.00 68.15 67.03 1pq2 h THR 304 CO -0.13 0.13 -0.20 0.74 0.37 0.00 0.00 175.52 176.44 1pq2 h THR 305 N 0.73 1.21 -0.40 3.16 2.02 -1.02 -2.43 112.91 116.20 1pq2 h THR 305 Ca 0.39 -0.98 -0.02 0.00 0.77 0.00 0.00 66.41 66.56 1pq2 h THR 305 Cb 0.37 1.33 -0.02 0.00 -1.74 0.00 0.00 68.15 68.10 1pq2 h THR 305 CO -0.26 0.30 0.16 -0.07 0.37 0.00 0.00 175.52 176.02 1pq2 h LEU 306 N 0.23 0.54 0.09 2.58 3.38 -0.27 -0.28 115.31 121.58 1pq2 h LEU 306 Ca 0.04 -0.17 0.02 0.00 0.09 0.00 0.00 57.88 57.86 1pq2 h LEU 306 Cb 0.49 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.07 1pq2 h LEU 306 CO 0.03 0.56 -0.19 0.03 0.09 0.00 0.00 178.44 178.96 1pq2 h ARG 307 N 0.49 -0.35 -0.63 1.13 3.08 -1.09 -0.61 114.38 116.41 1pq2 h ARG 307 Ca 0.13 0.02 0.03 0.00 0.07 0.00 0.00 59.98 60.24 1pq2 h ARG 307 Cb 0.19 0.08 -0.03 0.00 0.08 0.00 0.00 29.97 30.28 1pq2 h ARG 307 CO -0.01 -0.23 0.42 -0.92 -1.07 0.00 0.00 179.97 178.15 1pq2 h TYR 308 N -0.36 0.72 -0.35 3.04 -0.00 -1.28 -0.71 116.97 118.02 1pq2 h TYR 308 Ca 0.03 0.02 -0.15 0.00 -0.00 0.00 0.00 58.73 58.63 1pq2 h TYR 308 Cb 0.39 -0.24 -0.01 0.00 -0.00 0.00 0.00 36.73 36.87 1pq2 h TYR 308 CO -0.20 0.42 -0.36 0.78 -0.00 0.00 0.00 178.16 178.81 1pq2 h GLY 309 N 0.75 0.89 0.70 1.82 0.00 -0.47 -0.48 103.07 106.28 1pq2 h GLY 309 Ca 0.25 -0.87 -0.01 0.00 0.00 0.00 0.00 47.33 46.70 1pq2 h GLY 309 CO -0.07 0.79 -0.08 1.41 0.00 0.00 0.00 176.54 178.60 1pq2 h LEU 310 N 0.68 -0.18 -0.35 3.11 3.38 -0.37 -1.70 115.31 119.88 1pq2 h LEU 310 Ca 0.06 -0.23 0.08 0.00 0.09 0.00 0.00 57.88 57.88 1pq2 h LEU 310 Cb 0.92 0.05 -0.08 0.00 0.09 0.00 0.00 40.66 41.63 1pq2 h LEU 310 CO 0.08 0.13 -0.26 0.25 0.09 0.00 0.00 178.44 178.74 1pq2 h LEU 311 N -0.52 -0.85 -1.30 1.67 5.85 -1.12 0.28 115.31 119.31 1pq2 h LEU 311 Ca -0.02 0.16 0.06 0.00 0.84 0.00 0.00 57.88 58.92 1pq2 h LEU 311 Cb 0.40 0.42 -0.05 0.00 0.37 0.00 0.00 40.66 41.80 1pq2 h LEU 311 CO 0.04 -0.28 0.51 -0.07 -0.34 0.00 0.00 178.44 178.30 1pq2 h LEU 312 N -0.21 0.75 -0.68 2.25 3.38 -1.05 -0.55 115.31 119.21 1pq2 h LEU 312 Ca 0.17 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 58.01 1pq2 h LEU 312 Cb 0.48 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.06 1pq2 h LEU 312 CO -0.47 0.49 -0.61 -0.07 0.09 0.00 0.00 178.44 177.86 1pq2 h LEU 313 N 0.86 0.00 0.05 1.67 3.38 -0.04 -2.45 115.31 118.77 1pq2 h LEU 313 Ca 0.33 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.30 1pq2 h LEU 313 Cb 0.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.97 1pq2 h LEU 313 CO -0.11 0.61 -0.02 0.25 0.09 0.00 0.00 178.44 179.26 1pq2 h LEU 314 N 0.00 -0.05 -1.99 1.67 6.46 0.84 -3.24 115.31 119.00 1pq2 h LEU 314 Ca -0.01 -0.47 -0.01 0.00 -0.12 0.00 0.00 57.88 57.28 1pq2 h LEU 314 Cb 1.15 0.01 -0.00 0.00 -0.73 0.00 0.00 40.66 41.09 1pq2 h LEU 314 CO 0.08 0.46 -0.03 0.50 -0.62 0.00 0.00 178.44 178.83 1pq2 h LYS 315 N -0.58 0.00 -2.44 1.25 1.63 -1.14 -3.30 116.57 111.98 1pq2 h LYS 315 Ca -0.01 0.00 -0.61 0.00 -0.85 0.00 0.00 60.65 59.19 1pq2 h LYS 315 Cb 0.52 0.00 -0.42 0.00 -0.60 0.00 0.00 32.23 31.73 1pq2 h LYS 315 CO 0.01 0.03 -0.59 0.72 -3.45 0.00 0.00 179.45 176.17 1pq2 n HIS 316 N -4.42 3.49 0.33 1.91 8.25 -0.93 -4.92 115.22 118.93 1pq2 n HIS 316 Ca -0.03 -4.19 0.22 0.00 -0.26 0.00 0.00 57.72 53.46 1pq2 n HIS 316 Cb 0.11 -0.57 1.17 0.00 1.12 0.00 0.00 29.99 31.82 1pq2 n HIS 316 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 1pq2 h PRO 317 N 4.52 0.00 -0.00 -0.41 0.11 -1.65 -1.18 132.00 133.39 1pq2 h PRO 317 Ca 0.18 0.00 -0.15 0.00 0.11 0.00 0.00 66.00 66.15 1pq2 h PRO 317 Cb 0.69 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.78 1pq2 h PRO 317 CO 0.80 0.00 -0.69 0.93 -0.21 0.00 0.00 178.00 178.83 1pq2 h GLU 318 N 0.00 0.02 0.15 1.05 5.08 -1.91 0.72 114.58 119.70 1pq2 h GLU 318 Ca 0.00 -0.01 -0.31 0.00 -1.00 0.00 0.00 59.36 58.04 1pq2 h GLU 318 Cb 0.03 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.29 1pq2 h GLU 318 CO 0.00 0.70 -1.45 0.28 -1.00 0.00 0.00 179.01 177.55 1pq2 h VAL 319 N 0.01 1.27 -0.41 3.13 2.07 -1.60 -3.07 116.25 117.65 1pq2 h VAL 319 Ca -0.01 -2.84 -0.04 0.00 0.82 0.00 0.00 66.70 64.63 1pq2 h VAL 319 Cb 1.23 2.88 -0.02 0.00 -1.52 0.00 0.00 31.29 33.86 1pq2 h VAL 319 CO 0.09 0.85 0.12 0.74 0.02 0.00 0.00 177.57 179.38 1pq2 h THR 320 N 0.09 1.22 -0.75 2.57 2.02 -1.30 -2.13 112.91 114.63 1pq2 h THR 320 Ca -0.22 -0.74 0.03 0.00 0.77 0.00 0.00 66.41 66.25 1pq2 h THR 320 Cb 2.04 0.93 -0.04 0.00 -1.74 0.00 0.00 68.15 69.34 1pq2 h THR 320 CO 0.20 0.26 0.50 0.00 0.37 0.00 0.00 175.52 176.85 1pq2 h ALA 321 N 0.97 1.55 0.00 6.16 0.00 -0.93 0.08 119.26 127.09 1pq2 h ALA 321 Ca 0.13 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.92 1pq2 h ALA 321 Cb 0.28 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1pq2 h ALA 321 CO -0.00 0.38 -0.39 -0.22 0.00 0.00 0.00 179.25 179.02 1pq2 h LYS 322 N 0.93 0.00 0.04 0.00 3.64 -1.38 -0.64 116.57 119.16 1pq2 h LYS 322 Ca 0.30 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.68 1pq2 h LYS 322 Cb 0.04 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.86 1pq2 h LYS 322 CO -0.08 0.39 -0.02 0.28 -2.27 0.00 0.00 179.45 177.74 1pq2 h VAL 323 N 0.00 1.34 -0.05 2.00 2.07 -0.49 -2.78 116.25 118.34 1pq2 h VAL 323 Ca -0.00 -1.55 -0.01 0.00 0.82 0.00 0.00 66.70 65.95 1pq2 h VAL 323 Cb 0.97 2.32 -0.00 0.00 -1.52 0.00 0.00 31.29 33.06 1pq2 h VAL 323 CO 0.05 0.37 -0.03 1.56 0.02 0.00 0.00 177.57 179.55 1pq2 h GLN 324 N -0.78 0.07 0.00 1.57 4.20 -1.00 0.51 115.11 119.68 1pq2 h GLN 324 Ca -0.01 -0.01 -0.06 0.00 0.06 0.00 0.00 58.65 58.63 1pq2 h GLN 324 Cb 0.66 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.42 1pq2 h GLN 324 CO 0.01 0.10 -0.30 1.49 -0.67 0.00 0.00 178.83 179.46 1pq2 h GLU 325 N 0.07 0.00 0.01 1.46 4.81 -1.13 -1.68 114.58 118.12 1pq2 h GLU 325 Ca 0.02 0.00 -0.32 0.00 -0.13 0.00 0.00 59.36 58.93 1pq2 h GLU 325 Cb 0.09 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 29.42 1pq2 h GLU 325 CO 0.00 0.30 -1.94 -1.91 -0.73 0.00 0.00 179.01 174.74 1pq2 n GLU 326 N -3.59 0.66 -0.10 1.92 2.13 0.02 -3.73 120.64 117.94 1pq2 n GLU 326 Ca -0.01 0.21 -0.12 0.00 0.66 0.00 0.00 57.16 57.90 1pq2 n GLU 326 Cb 0.43 -1.71 -0.04 0.00 0.27 0.00 0.00 31.44 30.40 1pq2 n GLU 326 CO 0.00 0.00 0.00 0.82 -0.41 0.00 0.00 177.13 177.54 1pq2 h ILE 327 N 0.00 1.29 0.00 6.31 2.04 0.09 -2.52 117.51 124.72 1pq2 h ILE 327 Ca -0.38 -1.20 -0.07 0.00 1.00 0.00 0.00 64.86 64.21 1pq2 h ILE 327 Cb 2.08 1.43 -0.01 0.00 -0.74 0.00 0.00 36.82 39.58 1pq2 h ILE 327 CO 0.06 0.39 -0.35 -0.78 0.00 0.00 0.00 178.15 177.47 1pq2 h ASP 328 N 0.38 0.00 0.61 1.72 1.82 -1.49 0.58 116.42 120.03 1pq2 h ASP 328 Ca 0.07 0.00 -0.26 0.00 -0.39 0.00 0.00 57.03 56.45 1pq2 h ASP 328 Cb 0.63 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.65 1pq2 h ASP 328 CO 0.04 0.35 -1.15 -0.74 -1.61 0.00 0.00 179.24 176.13 1pq2 h HIS 329 N 0.00 0.46 0.00 0.28 2.76 -1.62 -2.92 115.15 114.12 1pq2 h HIS 329 Ca -0.00 -0.32 -0.31 0.00 -2.20 0.00 0.00 60.37 57.54 1pq2 h HIS 329 Cb 0.73 -0.03 -0.06 0.00 1.55 0.00 0.00 27.41 29.60 1pq2 h HIS 329 CO 0.00 1.22 -2.26 0.28 -1.30 0.00 0.00 177.93 175.87 1pq2 n VAL 330 N -3.57 1.16 -0.04 5.26 0.31 -0.96 -4.74 118.33 115.76 1pq2 n VAL 330 Ca -0.07 -0.77 -0.04 0.00 -0.01 0.00 0.00 64.34 63.45 1pq2 n VAL 330 Cb 0.97 -0.44 -0.06 0.00 -0.91 0.00 0.00 33.84 33.40 1pq2 n VAL 330 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 1pq2 n ILE 331 N -2.65 0.55 -2.88 2.52 5.41 0.14 -5.06 119.36 117.39 1pq2 n ILE 331 Ca -0.28 -0.33 0.00 0.00 1.00 0.00 0.00 62.75 63.14 1pq2 n ILE 331 Cb 1.05 -0.79 0.00 0.00 -0.71 0.00 0.00 39.64 39.19 1pq2 n ILE 331 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1pq2 n GLY 332 N 2.55 -0.03 1.22 7.39 0.00 -0.88 -4.56 105.19 110.87 1pq2 n GLY 332 Ca -0.13 -1.26 0.01 0.00 0.00 0.00 0.00 46.02 44.64 1pq2 n GLY 332 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1pq2 n ARG 333 N 2.80 0.00 0.01 1.61 1.85 -1.26 -4.35 116.66 117.32 1pq2 n ARG 333 Ca 0.00 -1.59 -0.00 0.00 -1.00 0.00 0.00 57.85 55.26 1pq2 n ARG 333 Cb 0.00 0.01 -0.00 0.00 -1.05 0.00 0.00 32.46 31.41 1pq2 n ARG 333 CO 0.00 0.00 0.00 0.72 -0.01 0.00 0.00 177.63 178.34 1pq2 n HIS 334 N 0.32 0.00 -2.41 2.89 8.25 -1.26 -5.06 115.22 117.94 1pq2 n HIS 334 Ca -0.01 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 57.08 1pq2 n HIS 334 Cb 0.98 -0.02 -0.03 0.00 1.12 0.00 0.00 29.99 32.04 1pq2 n HIS 334 CO 0.00 0.00 0.00 -0.98 0.64 0.00 0.00 176.34 176.00 1pq2 s ARG 335 N -1.47 3.97 0.33 -0.41 1.70 -1.26 -5.00 118.95 116.81 1pq2 s ARG 335 Ca -0.01 1.64 -0.29 0.00 -0.47 0.00 0.00 55.73 56.59 1pq2 s ARG 335 Cb 0.00 -2.48 -0.10 0.00 -0.57 0.00 0.00 34.95 31.80 1pq2 s ARG 335 CO 0.02 -0.34 1.33 -1.12 -1.08 0.00 0.00 175.30 174.12 1pq2 s SER 336 N -1.47 6.72 0.76 -2.89 0.01 -1.26 -4.95 113.70 110.62 1pq2 s SER 336 Ca 0.60 2.72 -0.13 0.00 1.31 0.00 0.00 55.95 60.46 1pq2 s SER 336 Cb -0.25 -2.65 0.05 0.00 0.21 0.00 0.00 66.02 63.38 1pq2 s SER 336 CO 0.31 -0.58 1.14 -2.16 0.41 0.00 0.00 173.24 172.36 1pq2 s PRO 337 N -1.76 2.14 0.08 12.44 0.04 -1.26 -5.06 135.00 141.63 1pq2 s PRO 337 Ca 0.50 1.46 -0.03 0.00 0.04 0.00 0.00 61.00 62.96 1pq2 s PRO 337 Cb -0.41 -1.86 -0.03 0.00 0.04 0.00 0.00 34.50 32.24 1pq2 s PRO 337 CO 0.54 -1.77 0.04 0.00 0.04 0.00 0.00 177.00 175.85 1pq2 n MET 339 N 0.03 0.02 0.08 0.00 2.81 -1.26 -1.42 117.12 117.38 1pq2 n MET 339 Ca -0.13 0.50 -0.15 0.00 -1.81 0.00 0.00 57.70 56.11 1pq2 n MET 339 Cb 0.62 -1.60 -0.14 0.00 -0.71 0.00 0.00 33.22 31.38 1pq2 n MET 339 CO 0.00 0.00 0.00 0.37 1.51 0.00 0.00 175.97 177.85 1pq2 h GLN 340 N 0.00 0.23 -0.07 0.03 -0.00 -2.02 -3.29 115.11 109.99 1pq2 h GLN 340 Ca 0.00 -0.39 -0.02 0.00 -0.00 0.00 0.00 58.65 58.24 1pq2 h GLN 340 Cb 0.06 0.15 -0.01 0.00 0.00 0.00 0.00 27.48 27.68 1pq2 h GLN 340 CO 0.00 1.13 -0.05 -0.44 0.00 0.00 0.00 178.83 179.47 1pq2 h ASP 341 N 0.06 0.09 -0.82 -0.69 3.32 -1.65 -2.95 116.42 113.78 1pq2 h ASP 341 Ca -0.17 -0.01 0.18 0.00 0.02 0.00 0.00 57.03 57.05 1pq2 h ASP 341 Cb 1.98 -0.02 -0.11 0.00 0.22 0.00 0.00 39.33 41.39 1pq2 h ASP 341 CO 0.18 0.16 0.31 -0.09 -1.72 0.00 0.00 179.24 178.08 1pq2 h ARG 342 N 0.10 0.38 0.00 3.56 2.43 -1.66 0.21 114.38 119.40 1pq2 h ARG 342 Ca 0.02 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1pq2 h ARG 342 Cb 0.16 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.63 1pq2 h ARG 342 CO 0.01 0.25 0.00 0.43 -1.51 0.00 0.00 179.97 179.15 1pq2 n SER 343 N -5.05 0.00 -0.16 -3.80 7.64 -1.11 -1.24 113.62 109.90 1pq2 n SER 343 Ca 0.18 0.27 0.02 0.00 1.01 0.00 0.00 58.87 60.35 1pq2 n SER 343 Cb 0.53 -0.33 0.03 0.00 -1.01 0.00 0.00 64.21 63.43 1pq2 n SER 343 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 1pq2 n HIS 344 N -1.33 0.05 -3.28 1.43 8.25 0.72 -4.76 115.22 116.31 1pq2 n HIS 344 Ca 0.02 -0.18 -0.26 0.00 -0.26 0.00 0.00 57.72 57.04 1pq2 n HIS 344 Cb 0.04 -0.02 -0.07 0.00 1.12 0.00 0.00 29.99 31.07 1pq2 n HIS 344 CO 0.00 0.00 0.00 -1.33 0.64 0.00 0.00 176.34 175.65 1pq2 n MET 345 N 0.06 2.42 0.08 -0.41 2.00 -0.37 -4.93 117.12 115.96 1pq2 n MET 345 Ca 0.03 -4.50 0.17 0.00 0.00 0.00 0.00 57.70 53.39 1pq2 n MET 345 Cb 0.16 -2.11 0.68 0.00 0.00 0.00 0.00 33.22 31.95 1pq2 n MET 345 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 175.97 174.97 1pq2 h PRO 346 N 3.86 0.00 -0.03 0.03 0.13 -1.86 -1.64 132.00 132.50 1pq2 h PRO 346 Ca 0.17 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 65.21 1pq2 h PRO 346 Cb 0.66 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.80 1pq2 h PRO 346 CO 0.78 0.00 -0.34 -0.92 -0.23 0.00 0.00 178.00 177.29 1pq2 h TYR 347 N 0.00 0.39 -0.01 1.56 3.20 -1.92 -0.31 116.97 119.88 1pq2 h TYR 347 Ca 0.18 -0.19 -0.06 0.00 3.14 0.00 0.00 58.73 61.80 1pq2 h TYR 347 Cb 0.71 -0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.92 1pq2 h TYR 347 CO 0.00 0.97 -0.26 1.15 -1.64 0.00 0.00 178.16 178.38 1pq2 h THR 348 N -0.30 1.19 -0.13 1.81 2.02 -1.80 0.20 112.91 115.91 1pq2 h THR 348 Ca -0.03 -0.91 -0.16 0.00 0.77 0.00 0.00 66.41 66.07 1pq2 h THR 348 Cb 1.04 1.48 0.01 0.00 -1.74 0.00 0.00 68.15 68.93 1pq2 h THR 348 CO 0.07 0.26 -0.55 -0.78 0.37 0.00 0.00 175.52 174.89 1pq2 h ASP 349 N 0.02 0.71 -0.80 4.18 3.58 -1.30 -1.86 116.42 120.95 1pq2 h ASP 349 Ca 0.00 -0.62 0.01 0.00 0.42 0.00 0.00 57.03 56.83 1pq2 h ASP 349 Cb 0.47 -0.21 -0.04 0.00 1.72 0.00 0.00 39.33 41.27 1pq2 h ASP 349 CO 0.03 1.22 0.53 0.00 -2.88 0.00 0.00 179.24 178.15 1pq2 h ALA 350 N 0.51 1.02 -0.37 -0.78 0.00 -0.27 -0.68 119.26 118.69 1pq2 h ALA 350 Ca -0.03 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 1pq2 h ALA 350 Cb 1.19 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 1pq2 h ALA 350 CO 0.12 0.43 0.20 0.28 0.00 0.00 0.00 179.25 180.28 1pq2 h VAL 351 N 1.09 1.15 -0.62 0.00 2.07 -0.48 0.35 116.25 119.82 1pq2 h VAL 351 Ca 0.29 -0.38 -0.09 0.00 0.82 0.00 0.00 66.70 67.34 1pq2 h VAL 351 Cb -0.13 0.72 -0.02 0.00 -1.52 0.00 0.00 31.29 30.34 1pq2 h VAL 351 CO -0.06 0.15 0.04 0.58 0.02 0.00 0.00 177.57 178.29 1pq2 h VAL 352 N 0.47 1.26 -0.78 2.57 2.07 -1.02 0.82 116.25 121.64 1pq2 h VAL 352 Ca 0.13 -1.10 -0.04 0.00 0.82 0.00 0.00 66.70 66.50 1pq2 h VAL 352 Cb 0.06 0.75 -0.03 0.00 -1.52 0.00 0.00 31.29 30.54 1pq2 h VAL 352 CO -0.02 0.40 0.32 0.45 0.02 0.00 0.00 177.57 178.74 1pq2 h HIS 353 N 0.97 1.19 -0.14 1.57 3.86 -0.76 -2.18 115.15 119.66 1pq2 h HIS 353 Ca 0.18 -0.09 -0.14 0.00 -1.16 0.00 0.00 60.37 59.17 1pq2 h HIS 353 Cb 0.51 -0.36 -0.01 0.00 1.06 0.00 0.00 27.41 28.61 1pq2 h HIS 353 CO 0.04 0.90 -0.50 1.49 0.86 0.00 0.00 177.93 180.71 1pq2 h GLU 354 N 1.14 0.37 -0.52 2.45 4.57 -0.53 -2.13 114.58 119.93 1pq2 h GLU 354 Ca 0.26 -0.22 -0.04 0.00 -1.18 0.00 0.00 59.36 58.19 1pq2 h GLU 354 Cb 0.21 0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 28.79 1pq2 h GLU 354 CO -0.02 0.79 0.16 0.82 -1.18 0.00 0.00 179.01 179.58 1pq2 h ILE 355 N 0.30 1.21 -0.00 2.32 2.04 -0.45 -1.03 117.51 121.89 1pq2 h ILE 355 Ca 0.01 -0.71 -0.21 0.00 1.00 0.00 0.00 64.86 64.96 1pq2 h ILE 355 Cb 0.99 0.64 -0.01 0.00 -0.74 0.00 0.00 36.82 37.71 1pq2 h ILE 355 CO 0.09 0.27 -0.89 1.56 0.00 0.00 0.00 178.15 179.18 1pq2 h GLN 356 N 0.75 0.28 0.35 2.37 4.20 -1.19 -2.08 115.11 119.79 1pq2 h GLN 356 Ca 0.17 -0.30 -0.02 0.00 0.06 0.00 0.00 58.65 58.57 1pq2 h GLN 356 Cb 0.23 0.08 0.00 0.00 0.30 0.00 0.00 27.48 28.09 1pq2 h GLN 356 CO -0.01 1.00 -0.17 -0.09 -0.67 0.00 0.00 178.83 178.90 1pq2 h ARG 357 N 0.16 -0.45 -0.57 1.46 2.43 -1.10 -2.70 114.38 113.60 1pq2 h ARG 357 Ca -0.05 0.03 0.01 0.00 -0.81 0.00 0.00 59.98 59.15 1pq2 h ARG 357 Cb 1.51 0.10 -0.03 0.00 -0.42 0.00 0.00 29.97 31.14 1pq2 h ARG 357 CO 0.14 -0.14 0.38 -0.92 -1.51 0.00 0.00 179.97 177.92 1pq2 h TYR 358 N -0.97 0.72 -0.09 2.20 3.20 -1.32 -2.12 116.97 118.59 1pq2 h TYR 358 Ca -0.05 0.02 0.03 0.00 3.14 0.00 0.00 58.73 61.87 1pq2 h TYR 358 Cb 0.52 -0.24 -0.00 0.00 1.54 0.00 0.00 36.73 38.54 1pq2 h TYR 358 CO 0.03 0.45 0.07 1.03 -1.64 0.00 0.00 178.16 178.10 1pq2 h SER 359 N 0.78 0.00 -6.62 -2.11 0.87 -1.46 -3.46 113.55 101.55 1pq2 h SER 359 Ca 0.21 -0.00 -0.52 0.00 -1.23 0.00 0.00 61.79 60.25 1pq2 h SER 359 Cb -0.09 -0.00 -0.24 0.00 -0.44 0.00 0.00 62.40 61.63 1pq2 h SER 359 CO -0.05 0.00 -0.78 -0.67 -0.53 0.00 0.00 176.83 174.81 1pq2 n ASP 360 N -4.51 -0.27 -0.31 6.23 2.03 -0.80 -4.80 116.55 114.12 1pq2 n ASP 360 Ca -0.01 -1.05 0.14 0.00 0.52 0.00 0.00 54.79 54.40 1pq2 n ASP 360 Cb 0.18 -1.32 0.28 0.00 -0.72 0.00 0.00 41.12 39.54 1pq2 n ASP 360 CO 0.00 0.00 0.00 -0.11 -1.92 0.00 0.00 177.20 175.17 1pq2 n LEU 361 N -3.73 -0.08 -3.94 -2.67 7.94 -1.26 -3.17 117.00 110.09 1pq2 n LEU 361 Ca -0.10 1.53 -0.30 0.00 -1.11 0.00 0.00 56.01 56.03 1pq2 n LEU 361 Cb 0.48 -0.57 -0.14 0.00 0.53 0.00 0.00 43.42 43.72 1pq2 n LEU 361 CO 0.75 -1.56 -0.27 -0.69 -1.11 0.00 0.00 177.39 174.51 1pq2 s VAL 362 N -5.85 2.17 0.01 1.96 1.01 -1.26 -2.22 120.40 116.22 1pq2 s VAL 362 Ca -0.11 -2.62 -0.24 0.00 0.00 0.00 0.00 61.98 59.01 1pq2 s VAL 362 Cb 0.27 -2.56 -0.18 0.00 0.00 0.00 0.00 36.38 33.91 1pq2 s VAL 362 CO 0.71 -0.71 1.37 -0.65 0.00 0.00 0.00 175.10 175.82 1pq2 h PRO 363 N 7.18 0.09 -0.01 2.72 0.11 -1.70 -3.28 132.00 137.11 1pq2 h PRO 363 Ca -0.06 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.01 1pq2 h PRO 363 Cb 0.97 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.07 1pq2 h PRO 363 CO 0.57 0.46 -0.17 0.25 -0.21 0.00 0.00 178.00 178.90 1pq2 n THR 364 N -4.83 0.00 -4.21 -1.15 -2.24 -1.26 -1.84 114.28 98.75 1pq2 n THR 364 Ca -0.07 -0.16 0.00 0.00 -2.27 0.00 0.00 64.05 61.55 1pq2 n THR 364 Cb 0.23 0.40 0.00 0.00 -2.10 0.00 0.00 70.33 68.86 1pq2 n THR 364 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1pq2 n GLY 365 N 1.29 -1.35 3.44 3.38 0.00 -1.24 -3.81 105.19 106.90 1pq2 n GLY 365 Ca 0.14 -1.26 -0.32 0.00 0.00 0.00 0.00 46.02 44.58 1pq2 n GLY 365 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1pq2 s VAL 366 N 0.00 2.84 0.26 1.61 1.01 -1.26 -5.00 120.40 119.86 1pq2 s VAL 366 Ca 0.00 -0.86 -0.31 0.00 0.00 0.00 0.00 61.98 60.81 1pq2 s VAL 366 Cb 0.00 -2.10 -0.12 0.00 0.00 0.00 0.00 36.38 34.16 1pq2 s VAL 366 CO 0.00 0.55 1.59 -0.81 0.00 0.00 0.00 175.10 176.43 1pq2 n PRO 367 N 2.22 2.58 -2.54 2.72 -0.04 -1.26 -4.75 135.00 133.93 1pq2 n PRO 367 Ca -0.17 0.92 -0.10 0.00 -0.04 0.00 0.00 63.50 64.12 1pq2 n PRO 367 Cb 0.52 -2.70 -0.01 0.00 -0.04 0.00 0.00 33.50 31.27 1pq2 n PRO 367 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1pq2 n HIS 368 N 2.48 -0.59 -3.65 0.54 8.25 -1.07 -1.47 115.22 119.72 1pq2 n HIS 368 Ca 0.11 -0.83 -0.11 0.00 -0.26 0.00 0.00 57.72 56.63 1pq2 n HIS 368 Cb 0.35 -0.14 -0.05 0.00 1.12 0.00 0.00 29.99 31.27 1pq2 n HIS 368 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1pq2 s ALA 369 N -2.29 -0.90 -0.15 -1.41 0.00 -1.16 -1.04 121.76 114.82 1pq2 s ALA 369 Ca 0.07 -0.05 -0.09 0.00 0.00 0.00 0.00 51.96 51.89 1pq2 s ALA 369 Cb -0.01 0.66 -0.04 0.00 0.00 0.00 0.00 23.12 23.73 1pq2 s ALA 369 CO 0.04 -0.62 0.15 0.14 0.00 0.00 0.00 175.76 175.47 1pq2 s VAL 370 N -3.71 5.45 0.07 0.00 -7.23 -1.06 -2.28 120.40 111.64 1pq2 s VAL 370 Ca 0.02 0.23 -0.17 0.00 -1.81 0.00 0.00 61.98 60.26 1pq2 s VAL 370 Cb 0.02 -3.44 -0.13 0.00 0.56 0.00 0.00 36.38 33.38 1pq2 s VAL 370 CO -0.11 0.55 1.33 0.71 -0.31 0.00 0.00 175.10 177.27 1pq2 h THR 371 N 4.25 1.33 -4.58 5.32 1.35 -1.42 0.40 112.91 119.57 1pq2 h THR 371 Ca -0.49 -1.57 -0.46 0.00 -0.55 0.00 0.00 66.41 63.34 1pq2 h THR 371 Cb 1.20 1.87 -0.10 0.00 -1.73 0.00 0.00 68.15 69.39 1pq2 h THR 371 CO 0.65 0.48 -0.37 0.35 -0.25 0.00 0.00 175.52 176.38 1pq2 n THR 372 N -4.31 0.00 -2.10 6.82 -2.24 -1.26 -4.68 114.28 106.51 1pq2 n THR 372 Ca -0.06 -1.88 -0.40 0.00 -2.27 0.00 0.00 64.05 59.44 1pq2 n THR 372 Cb 0.50 0.60 -0.03 0.00 -2.10 0.00 0.00 70.33 69.30 1pq2 n THR 372 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1pq2 s ASP 373 N -3.03 5.62 -0.13 3.42 1.01 -1.26 -3.67 116.67 118.62 1pq2 s ASP 373 Ca 0.12 0.61 -0.14 0.00 0.71 0.00 0.00 52.55 53.85 1pq2 s ASP 373 Cb 0.01 -2.53 -0.05 0.00 1.01 0.00 0.00 42.92 41.36 1pq2 s ASP 373 CO 0.09 -2.05 0.32 -0.89 0.21 0.00 0.00 175.17 172.85 1pq2 s THR 374 N 7.86 5.27 -0.40 -1.27 2.01 -0.59 -4.92 115.64 123.60 1pq2 s THR 374 Ca 0.68 0.62 -0.15 0.00 0.31 0.00 0.00 61.69 63.16 1pq2 s THR 374 Cb -0.15 -3.66 0.02 0.00 0.01 0.00 0.00 72.50 68.72 1pq2 s THR 374 CO 0.25 0.41 0.29 -0.54 -0.69 0.00 0.00 174.62 174.34 1pq2 s LYS 375 N 0.24 3.02 -0.29 4.92 1.02 -1.26 -0.65 119.74 126.73 1pq2 s LYS 375 Ca 0.19 -0.98 -0.03 0.00 0.02 0.00 0.00 55.97 55.16 1pq2 s LYS 375 Cb -0.14 -3.95 0.03 0.00 -0.52 0.00 0.00 37.83 33.26 1pq2 s LYS 375 CO 0.06 -0.72 0.00 0.12 -0.92 0.00 0.00 175.35 173.90 1pq2 s PHE 376 N 1.68 3.17 -0.00 3.18 5.36 -0.40 -4.93 117.98 126.04 1pq2 s PHE 376 Ca 0.05 -1.55 -0.00 0.00 -0.96 0.00 0.00 56.93 54.47 1pq2 s PHE 376 Cb -0.19 -2.14 0.00 0.00 -0.34 0.00 0.00 43.02 40.36 1pq2 s PHE 376 CO 0.10 -0.73 0.01 2.89 -1.46 0.00 0.00 175.22 176.03 1pq2 n ARG 377 N 4.70 -0.02 -0.25 10.12 1.85 -1.26 -2.03 116.66 129.77 1pq2 n ARG 377 Ca -0.14 0.01 0.00 0.00 -1.00 0.00 0.00 57.85 56.72 1pq2 n ARG 377 Cb 0.46 -0.02 0.00 0.00 -1.05 0.00 0.00 32.46 31.85 1pq2 n ARG 377 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 1pq2 n ASN 378 N 0.95 0.00 -4.26 2.89 5.03 -1.26 -5.03 115.26 113.58 1pq2 n ASN 378 Ca -0.00 0.00 -0.14 0.00 0.87 0.00 0.00 54.58 55.31 1pq2 n ASN 378 Cb 0.01 0.00 -0.10 0.00 -1.02 0.00 0.00 39.78 38.67 1pq2 n ASN 378 CO 0.00 0.00 0.00 -0.31 -1.83 0.00 0.00 177.26 175.12 1pq2 s TYR 379 N -2.84 1.29 -0.28 3.10 1.51 -0.86 -4.81 117.35 114.45 1pq2 s TYR 379 Ca 0.00 -0.83 0.02 0.00 -1.01 0.00 0.00 57.07 55.25 1pq2 s TYR 379 Cb 0.00 -0.69 0.08 0.00 -0.11 0.00 0.00 41.96 41.24 1pq2 s TYR 379 CO 0.00 0.01 -0.02 -1.17 -1.11 0.00 0.00 175.55 173.26 1pq2 s LEU 380 N -3.18 3.44 -0.59 -1.29 0.20 -0.66 -1.27 118.68 115.32 1pq2 s LEU 380 Ca 0.19 -1.58 -0.25 0.00 0.69 0.00 0.00 54.13 53.18 1pq2 s LEU 380 Cb 0.04 -1.38 0.04 0.00 -0.43 0.00 0.00 46.19 44.46 1pq2 s LEU 380 CO 0.02 -0.29 1.05 -0.63 -0.29 0.00 0.00 176.35 176.22 1pq2 s ILE 381 N 1.19 4.20 0.72 6.68 1.01 0.17 -4.08 121.20 131.09 1pq2 s ILE 381 Ca 0.00 0.41 -0.16 0.00 0.00 0.00 0.00 60.65 60.90 1pq2 s ILE 381 Cb -0.19 -4.65 0.03 0.00 0.01 0.00 0.00 42.46 37.66 1pq2 s ILE 381 CO -0.08 -1.30 1.24 -2.16 0.00 0.00 0.00 174.94 172.63 1pq2 s PRO 382 N 4.46 2.18 0.46 2.79 0.04 -1.26 -1.54 135.00 142.12 1pq2 s PRO 382 Ca 0.34 1.87 -0.24 0.00 0.04 0.00 0.00 61.00 63.01 1pq2 s PRO 382 Cb -0.11 -1.83 -0.09 0.00 0.04 0.00 0.00 34.50 32.51 1pq2 s PRO 382 CO 0.20 -1.83 1.12 1.17 0.04 0.00 0.00 177.00 177.69 1pq2 n LYS 383 N -2.55 1.51 0.00 4.56 4.81 -1.24 -3.05 118.16 122.19 1pq2 n LYS 383 Ca 0.14 0.54 0.00 0.00 -0.87 0.00 0.00 58.31 58.13 1pq2 n LYS 383 Cb 0.50 -2.22 0.00 0.00 0.02 0.00 0.00 35.03 33.33 1pq2 n LYS 383 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1pq2 n GLY 384 N 1.04 3.11 3.70 3.14 0.00 0.13 -4.96 105.19 111.36 1pq2 n GLY 384 Ca 0.09 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.68 1pq2 n GLY 384 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1pq2 n THR 385 N -2.00 0.43 -2.30 2.61 -1.04 -1.17 -4.62 114.28 106.19 1pq2 n THR 385 Ca 0.00 -0.11 -0.40 0.00 -2.04 0.00 0.00 64.05 61.51 1pq2 n THR 385 Cb 0.00 -1.77 -0.03 0.00 -1.82 0.00 0.00 70.33 66.71 1pq2 n THR 385 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1pq2 s THR 386 N 0.58 3.12 0.33 12.58 2.01 -1.24 -2.58 115.64 130.45 1pq2 s THR 386 Ca 0.72 1.06 0.10 0.00 0.31 0.00 0.00 61.69 63.88 1pq2 s THR 386 Cb -0.58 -3.65 -0.06 0.00 0.01 0.00 0.00 72.50 68.23 1pq2 s THR 386 CO 0.41 0.20 -0.11 -0.63 -0.69 0.00 0.00 174.62 173.80 1pq2 s ILE 387 N -1.25 2.36 -0.23 1.82 -1.09 -0.21 -2.67 121.20 119.93 1pq2 s ILE 387 Ca 0.50 -2.22 -0.05 0.00 -2.23 0.00 0.00 60.65 56.65 1pq2 s ILE 387 Cb -0.34 -2.59 0.12 0.00 -1.58 0.00 0.00 42.46 38.07 1pq2 s ILE 387 CO 0.44 -0.25 0.44 -0.32 -1.23 0.00 0.00 174.94 174.02 1pq2 s MET 388 N -3.60 0.38 -0.37 2.79 1.75 -1.12 -2.59 119.30 116.55 1pq2 s MET 388 Ca 0.32 0.90 -0.11 0.00 -1.25 0.00 0.00 55.69 55.55 1pq2 s MET 388 Cb 0.00 0.12 0.03 0.00 2.84 0.00 0.00 34.83 37.82 1pq2 s MET 388 CO 0.17 -0.42 0.20 0.00 -0.65 0.00 0.00 175.02 174.31 1pq2 s ALA 389 N 2.64 3.26 -0.94 4.11 0.00 -1.25 -1.52 121.76 128.06 1pq2 s ALA 389 Ca 0.05 -1.70 -0.24 0.00 0.00 0.00 0.00 51.96 50.08 1pq2 s ALA 389 Cb -0.14 -2.56 -0.01 0.00 0.00 0.00 0.00 23.12 20.42 1pq2 s ALA 389 CO -0.15 -1.35 1.75 -0.51 0.00 0.00 0.00 175.76 175.50 1pq2 s LEU 390 N 1.55 3.30 0.60 0.00 1.43 -0.97 -3.65 118.68 120.94 1pq2 s LEU 390 Ca 0.02 -0.95 0.30 0.00 -1.03 0.00 0.00 54.13 52.47 1pq2 s LEU 390 Cb -0.19 -2.56 1.72 0.00 0.03 0.00 0.00 46.19 45.19 1pq2 s LEU 390 CO 0.06 -2.26 2.10 -0.07 0.23 0.00 0.00 176.35 176.41 1pq2 h LEU 391 N 15.86 0.00 -0.23 1.79 3.38 -1.60 -1.90 115.31 132.61 1pq2 h LEU 391 Ca 0.13 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.10 1pq2 h LEU 391 Cb 1.01 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.75 1pq2 h LEU 391 CO 1.29 0.00 0.15 0.74 0.09 0.00 0.00 178.44 180.71 1pq2 h THR 392 N 0.00 1.07 -0.04 0.22 2.02 -1.66 -0.29 112.91 114.23 1pq2 h THR 392 Ca 0.08 -0.14 0.01 0.00 0.77 0.00 0.00 66.41 67.13 1pq2 h THR 392 Cb 0.50 0.75 -0.00 0.00 -1.74 0.00 0.00 68.15 67.66 1pq2 h THR 392 CO -0.00 0.07 0.03 0.77 0.37 0.00 0.00 175.52 176.75 1pq2 h SER 393 N 0.31 0.00 0.17 4.18 4.64 -1.64 0.11 113.55 121.33 1pq2 h SER 393 Ca 0.08 0.00 -0.26 0.00 -0.47 0.00 0.00 61.79 61.14 1pq2 h SER 393 Cb -0.02 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.09 1pq2 h SER 393 CO -0.02 0.00 -1.20 0.58 -0.87 0.00 0.00 176.83 175.33 1pq2 h VAL 394 N 0.00 1.31 0.00 0.95 2.07 -1.49 -2.84 116.25 116.25 1pq2 h VAL 394 Ca 0.02 -2.55 -0.03 0.00 0.82 0.00 0.00 66.70 64.95 1pq2 h VAL 394 Cb 0.07 3.03 -0.00 0.00 -1.52 0.00 0.00 31.29 32.87 1pq2 h VAL 394 CO -0.00 0.75 -0.14 -0.07 0.02 0.00 0.00 177.57 178.14 1pq2 h LEU 395 N -0.18 0.00 -3.06 2.57 3.38 -0.36 -3.06 115.31 114.60 1pq2 h LEU 395 Ca -0.22 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.75 1pq2 h LEU 395 Cb 1.85 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.60 1pq2 h LEU 395 CO 0.17 0.14 0.00 1.41 0.09 0.00 0.00 178.44 180.25 1pq2 n HIS 396 N -3.38 0.57 -1.60 1.13 8.25 0.33 -4.90 115.22 115.62 1pq2 n HIS 396 Ca -0.00 -0.71 -0.46 0.00 -0.26 0.00 0.00 57.72 56.29 1pq2 n HIS 396 Cb 0.33 -0.16 -0.02 0.00 1.12 0.00 0.00 29.99 31.26 1pq2 n HIS 396 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 1pq2 n ASP 397 N -0.21 1.47 0.14 0.41 2.03 -1.07 -4.70 116.55 114.62 1pq2 n ASP 397 Ca 0.15 1.16 -0.13 0.00 0.52 0.00 0.00 54.79 56.50 1pq2 n ASP 397 Cb 0.62 -1.28 -0.08 0.00 -0.72 0.00 0.00 41.12 39.66 1pq2 n ASP 397 CO 0.00 0.00 0.00 0.44 -1.92 0.00 0.00 177.20 175.72 1pq2 h ASP 398 N 2.63 -0.32 -0.48 1.67 3.32 -1.90 -1.61 116.42 119.72 1pq2 h ASP 398 Ca -0.41 -0.21 -0.00 0.00 0.02 0.00 0.00 57.03 56.43 1pq2 h ASP 398 Cb 1.33 0.08 -0.02 0.00 0.22 0.00 0.00 39.33 40.94 1pq2 h ASP 398 CO 0.65 0.08 0.29 0.11 -1.72 0.00 0.00 179.24 178.65 1pq2 h LYS 399 N -0.80 0.65 -0.31 3.56 1.57 -2.00 -2.63 116.57 116.61 1pq2 h LYS 399 Ca -0.04 -0.06 -0.13 0.00 -1.87 0.00 0.00 60.65 58.55 1pq2 h LYS 399 Cb 0.51 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 32.68 1pq2 h LYS 399 CO 0.06 0.48 -0.33 1.49 -0.57 0.00 0.00 179.45 180.58 1pq2 h GLU 400 N 0.64 0.77 -2.93 3.15 4.57 -1.97 -3.39 114.58 115.43 1pq2 h GLU 400 Ca 0.17 -0.42 -0.61 0.00 -1.18 0.00 0.00 59.36 57.32 1pq2 h GLU 400 Cb -0.01 0.02 -0.40 0.00 -0.16 0.00 0.00 28.75 28.20 1pq2 h GLU 400 CO -0.03 1.04 -0.71 -0.06 -1.18 0.00 0.00 179.01 178.07 1pq2 s PHE 401 N -4.34 2.54 0.12 0.92 0.40 -0.61 -5.06 117.98 111.96 1pq2 s PHE 401 Ca -0.12 -2.85 -0.35 0.00 -0.60 0.00 0.00 56.93 53.02 1pq2 s PHE 401 Cb 0.09 -2.10 -0.14 0.00 0.51 0.00 0.00 43.02 41.38 1pq2 s PHE 401 CO 0.85 -0.69 1.54 -2.30 0.70 0.00 0.00 175.22 175.31 1pq2 n PRO 402 N 2.72 1.88 -3.29 0.24 -0.02 -1.00 -1.86 135.00 133.66 1pq2 n PRO 402 Ca 0.17 0.68 -0.16 0.00 -2.02 0.00 0.00 63.50 62.18 1pq2 n PRO 402 Cb 0.37 -2.42 0.08 0.00 -0.02 0.00 0.00 33.50 31.51 1pq2 n PRO 402 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1pq2 n ASN 403 N 3.39 -4.47 -0.01 2.55 3.02 -1.26 -4.85 115.26 113.63 1pq2 n ASN 403 Ca 0.18 -0.65 0.00 0.00 -0.03 0.00 0.00 54.58 54.08 1pq2 n ASN 403 Cb 0.26 -5.07 0.00 0.00 -0.61 0.00 0.00 39.78 34.36 1pq2 n ASN 403 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 1pq2 n PRO 404 N -3.59 0.10 0.00 3.52 -0.04 -0.78 -2.46 135.00 131.75 1pq2 n PRO 404 Ca -0.17 0.00 0.01 0.00 -0.04 0.00 0.00 63.50 63.30 1pq2 n PRO 404 Cb 0.64 -1.00 -0.01 0.00 -0.04 0.00 0.00 33.50 33.09 1pq2 n PRO 404 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1pq2 n ASN 405 N -0.49 0.27 -4.70 3.54 5.03 -1.26 -4.83 115.26 112.81 1pq2 n ASN 405 Ca 0.00 -0.63 -0.33 0.00 0.87 0.00 0.00 54.58 54.48 1pq2 n ASN 405 Cb 0.00 0.86 -0.09 0.00 -1.02 0.00 0.00 39.78 39.53 1pq2 n ASN 405 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.26 174.92 1pq2 s ILE 406 N -1.07 4.33 0.14 2.41 1.10 -1.03 -5.08 121.20 122.00 1pq2 s ILE 406 Ca 0.01 -0.44 -0.31 0.00 -0.51 0.00 0.00 60.65 59.40 1pq2 s ILE 406 Cb 0.02 -2.90 -0.08 0.00 0.15 0.00 0.00 42.46 39.64 1pq2 s ILE 406 CO 0.08 0.45 1.40 0.12 -2.11 0.00 0.00 174.94 174.89 1pq2 s PHE 407 N -1.04 3.21 -0.30 3.50 5.36 -1.26 -5.01 117.98 122.45 1pq2 s PHE 407 Ca 0.18 0.96 -0.09 0.00 -0.96 0.00 0.00 56.93 57.02 1pq2 s PHE 407 Cb -0.12 -3.71 0.18 0.00 -0.34 0.00 0.00 43.02 39.04 1pq2 s PHE 407 CO 0.08 -2.44 0.91 0.34 -1.46 0.00 0.00 175.22 172.65 1pq2 s ASP 408 N 0.94 -0.76 0.60 6.13 3.68 -1.26 -5.03 116.67 120.98 1pq2 s ASP 408 Ca 0.64 0.45 0.30 0.00 2.13 0.00 0.00 52.55 56.06 1pq2 s ASP 408 Cb -0.38 1.63 1.64 0.00 -1.45 0.00 0.00 42.92 44.36 1pq2 s ASP 408 CO 0.32 -0.14 2.03 -0.65 0.13 0.00 0.00 175.17 176.87 1pq2 h PRO 409 N 7.97 0.00 0.00 4.34 0.11 -1.93 -2.00 132.00 140.49 1pq2 h PRO 409 Ca -0.16 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.95 1pq2 h PRO 409 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1pq2 h PRO 409 CO 0.01 0.00 0.06 0.41 -0.21 0.00 0.00 178.00 178.28 1pq2 n GLY 410 N -1.39 -0.55 0.19 -0.55 0.00 -1.26 -1.24 105.19 100.39 1pq2 n GLY 410 Ca 0.03 0.06 0.14 0.00 0.00 0.00 0.00 46.02 46.24 1pq2 n GLY 410 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 1pq2 h HIS 411 N 0.00 0.00 0.00 1.61 3.86 -1.74 -2.83 115.15 116.04 1pq2 h HIS 411 Ca 0.00 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.20 1pq2 h HIS 411 Cb 0.12 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.58 1pq2 h HIS 411 CO 0.00 0.00 -0.18 1.19 0.86 0.00 0.00 177.93 179.80 1pq2 n PHE 412 N -2.56 0.00 -4.54 2.45 3.72 -0.37 -4.97 117.46 111.18 1pq2 n PHE 412 Ca 0.01 -0.89 -0.26 0.00 -0.05 0.00 0.00 57.45 56.27 1pq2 n PHE 412 Cb 0.23 -0.15 -0.11 0.00 -0.94 0.00 0.00 39.48 38.52 1pq2 n PHE 412 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 1pq2 s LEU 413 N -2.37 2.73 0.00 4.37 1.02 -1.07 0.15 118.68 123.50 1pq2 s LEU 413 Ca 0.28 -1.20 0.00 0.00 0.02 0.00 0.00 54.13 53.22 1pq2 s LEU 413 Cb 0.25 -0.98 0.00 0.00 0.02 0.00 0.00 46.19 45.47 1pq2 s LEU 413 CO 0.01 -0.21 0.00 -0.90 0.02 0.00 0.00 176.35 175.27 1pq2 n ASP 414 N -0.79 2.99 -0.38 2.29 5.68 -0.98 -4.69 116.55 120.68 1pq2 n ASP 414 Ca -0.05 -2.58 -0.05 0.00 -0.50 0.00 0.00 54.79 51.61 1pq2 n ASP 414 Cb 0.64 0.25 -0.01 0.00 -1.14 0.00 0.00 41.12 40.85 1pq2 n ASP 414 CO 0.00 0.00 0.00 0.07 -1.33 0.00 0.00 177.20 175.94 1pq2 h LYS 415 N 0.00 -0.02 -0.03 0.11 -0.00 -1.99 -2.45 116.57 112.19 1pq2 h LYS 415 Ca -0.30 0.00 -0.02 0.00 -0.00 0.00 0.00 60.65 60.33 1pq2 h LYS 415 Cb 0.91 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.14 1pq2 h LYS 415 CO 0.50 -0.01 -0.07 -0.91 -0.00 0.00 0.00 179.45 178.95 1pq2 h ASN 416 N -0.02 0.11 0.00 7.07 -0.26 -2.05 -3.48 115.58 116.94 1pq2 h ASN 416 Ca 0.27 -0.61 0.00 0.00 -0.56 0.00 0.00 56.30 55.40 1pq2 h ASN 416 Cb 0.53 -0.03 0.00 0.00 -1.06 0.00 0.00 38.32 37.76 1pq2 h ASN 416 CO -0.95 0.69 0.00 0.61 -1.06 0.00 0.00 177.43 176.73 1pq2 n GLY 417 N 0.55 -0.67 3.83 2.83 0.00 -0.92 -5.14 105.19 105.66 1pq2 n GLY 417 Ca -0.08 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.61 1pq2 n GLY 417 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1pq2 s ASN 418 N -0.20 6.89 0.20 1.61 0.01 -1.26 -4.66 114.94 117.54 1pq2 s ASN 418 Ca 0.00 1.58 -0.32 0.00 -0.71 0.00 0.00 52.86 53.41 1pq2 s ASN 418 Cb 0.00 -2.49 -0.11 0.00 0.41 0.00 0.00 41.25 39.05 1pq2 s ASN 418 CO 0.00 -0.32 1.66 0.12 -1.51 0.00 0.00 177.10 177.05 1pq2 s PHE 419 N -2.13 2.94 -0.32 2.20 2.19 -1.26 -2.31 117.98 119.29 1pq2 s PHE 419 Ca 0.60 0.47 -0.04 0.00 0.33 0.00 0.00 56.93 58.29 1pq2 s PHE 419 Cb -0.09 -4.07 0.05 0.00 -1.31 0.00 0.00 43.02 37.59 1pq2 s PHE 419 CO 0.14 -3.98 0.05 0.21 1.83 0.00 0.00 175.22 173.47 1pq2 s LYS 420 N 1.00 2.50 0.59 10.12 2.20 0.39 -4.90 119.74 131.64 1pq2 s LYS 420 Ca 0.72 -1.24 -0.15 0.00 -0.36 0.00 0.00 55.97 54.94 1pq2 s LYS 420 Cb -0.48 -3.31 -0.04 0.00 -1.51 0.00 0.00 37.83 32.49 1pq2 s LYS 420 CO 0.33 -0.65 1.05 0.21 -0.36 0.00 0.00 175.35 175.93 1pq2 s LYS 421 N 1.31 3.37 -0.02 4.03 2.47 -1.26 -4.53 119.74 125.11 1pq2 s LYS 421 Ca -0.03 1.13 0.00 0.00 -1.56 0.00 0.00 55.97 55.51 1pq2 s LYS 421 Cb -0.20 -2.04 0.02 0.00 -1.46 0.00 0.00 37.83 34.15 1pq2 s LYS 421 CO 0.01 -0.76 0.01 0.45 0.16 0.00 0.00 175.35 175.21 1pq2 s SER 422 N -2.96 0.24 0.00 1.43 0.15 -1.26 -4.99 113.70 106.31 1pq2 s SER 422 Ca 0.62 -0.00 0.14 0.00 0.70 0.00 0.00 55.95 57.41 1pq2 s SER 422 Cb -0.15 -0.12 0.70 0.00 -1.71 0.00 0.00 66.02 64.74 1pq2 s SER 422 CO 0.38 -0.08 1.39 0.47 1.20 0.00 0.00 173.24 176.60 1pq2 n ASP 423 N 3.88 0.00 -0.56 5.45 10.43 -1.26 -1.45 116.55 133.03 1pq2 n ASP 423 Ca -0.24 0.14 0.14 0.00 2.57 0.00 0.00 54.79 57.40 1pq2 n ASP 423 Cb 0.52 -0.32 0.43 0.00 1.84 0.00 0.00 41.12 43.60 1pq2 n ASP 423 CO 0.00 0.00 0.00 -1.22 -1.07 0.00 0.00 177.20 174.91 1pq2 n TYR 424 N -1.32 0.00 -2.61 1.24 4.02 -1.26 -4.79 117.16 112.44 1pq2 n TYR 424 Ca 0.06 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.53 1pq2 n TYR 424 Cb 0.12 -0.01 -0.03 0.00 -0.02 0.00 0.00 39.34 39.41 1pq2 n TYR 424 CO 0.00 0.00 0.00 0.12 -1.01 0.00 0.00 176.86 175.97 1pq2 s PHE 425 N -2.03 2.59 -0.04 -0.72 5.36 -0.53 -4.13 117.98 118.49 1pq2 s PHE 425 Ca 0.35 0.29 0.23 0.00 -0.96 0.00 0.00 56.93 56.84 1pq2 s PHE 425 Cb 0.21 -4.48 0.42 0.00 -0.34 0.00 0.00 43.02 38.83 1pq2 s PHE 425 CO 0.34 -1.63 1.18 -1.33 -1.46 0.00 0.00 175.22 172.32 1pq2 n MET 426 N 8.44 0.27 0.00 10.12 2.81 -1.26 -4.85 117.12 132.66 1pq2 n MET 426 Ca 0.07 -2.21 0.05 0.00 -1.81 0.00 0.00 57.70 53.79 1pq2 n MET 426 Cb 0.49 -0.28 0.26 0.00 -0.71 0.00 0.00 33.22 32.97 1pq2 n MET 426 CO 0.00 0.00 0.00 -0.35 1.51 0.00 0.00 175.97 177.13 1pq2 n PRO 427 N 0.22 0.18 -0.26 0.03 -0.04 -1.26 0.04 135.00 133.89 1pq2 n PRO 427 Ca 0.08 0.15 0.06 0.00 -0.04 0.00 0.00 63.50 63.76 1pq2 n PRO 427 Cb 1.07 -1.50 0.18 0.00 -0.04 0.00 0.00 33.50 33.21 1pq2 n PRO 427 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1pq2 n PHE 428 N -1.22 0.61 -4.42 0.54 3.72 -1.26 -4.80 117.46 110.63 1pq2 n PHE 428 Ca 0.05 -0.64 0.00 0.00 -0.05 0.00 0.00 57.45 56.81 1pq2 n PHE 428 Cb 0.07 -0.13 0.00 0.00 -0.94 0.00 0.00 39.48 38.48 1pq2 n PHE 428 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1pq2 n SER 429 N 0.09 -1.07 -3.77 4.37 2.88 0.11 -2.18 113.62 114.04 1pq2 n SER 429 Ca 0.15 0.00 -0.06 0.00 -1.33 0.00 0.00 58.87 57.62 1pq2 n SER 429 Cb 0.59 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 64.03 1pq2 n SER 429 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1pq2 s ALA 430 N -1.42 -1.27 0.00 -1.46 0.00 -1.26 -4.75 121.76 111.60 1pq2 s ALA 430 Ca 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 51.96 51.70 1pq2 s ALA 430 Cb 0.00 0.80 0.00 0.00 0.00 0.00 0.00 23.12 23.92 1pq2 s ALA 430 CO 0.00 -1.04 0.00 0.41 0.00 0.00 0.00 175.76 175.13 1pq2 n GLY 431 N -0.47 -0.16 0.33 0.00 0.00 -1.26 -3.97 105.19 99.65 1pq2 n GLY 431 Ca -0.05 -1.04 0.29 0.00 0.00 0.00 0.00 46.02 45.22 1pq2 n GLY 431 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1pq2 h LYS 432 N 0.00 0.12 -0.56 1.61 6.56 -1.81 -1.34 116.57 121.16 1pq2 h LYS 432 Ca 0.00 -0.01 -0.01 0.00 -1.06 0.00 0.00 60.65 59.57 1pq2 h LYS 432 Cb 0.00 -0.03 -0.01 0.00 -0.57 0.00 0.00 32.23 31.63 1pq2 h LYS 432 CO 0.00 0.08 0.01 0.54 -2.06 0.00 0.00 179.45 178.02 1pq2 n ARG 433 N -5.18 4.71 -1.50 3.15 1.74 -1.26 -5.02 116.66 113.30 1pq2 n ARG 433 Ca 0.35 -3.15 -0.38 0.00 -0.77 0.00 0.00 57.85 53.91 1pq2 n ARG 433 Cb 1.17 -2.24 0.04 0.00 -1.02 0.00 0.00 32.46 30.41 1pq2 n ARG 433 CO 0.00 0.00 0.00 1.51 -1.52 0.00 0.00 177.63 177.62 1pq2 n ILE 434 N 0.49 2.59 -1.28 0.55 3.06 -0.51 -4.66 119.36 119.59 1pq2 n ILE 434 Ca 0.28 -0.50 -0.54 0.00 -2.50 0.00 0.00 62.75 59.49 1pq2 n ILE 434 Cb 1.19 -0.78 -0.09 0.00 0.54 0.00 0.00 39.64 40.50 1pq2 n ILE 434 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1pq2 h ALA 436 N 5.59 1.14 -0.48 0.00 0.00 -1.94 -1.56 119.26 122.01 1pq2 h ALA 436 Ca -0.25 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.56 1pq2 h ALA 436 Cb 1.16 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.90 1pq2 h ALA 436 CO 0.86 0.02 0.08 0.41 0.00 0.00 0.00 179.25 180.62 1pq2 n GLY 437 N -0.90 3.83 0.26 0.00 0.00 -1.26 -4.75 105.19 102.36 1pq2 n GLY 437 Ca -0.02 -1.03 -0.08 0.00 0.00 0.00 0.00 46.02 44.88 1pq2 n GLY 437 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1pq2 h GLU 438 N 2.39 -0.34 -0.77 1.61 4.81 -1.64 -0.60 114.58 120.04 1pq2 h GLU 438 Ca 0.11 0.02 0.17 0.00 -0.13 0.00 0.00 59.36 59.53 1pq2 h GLU 438 Cb 1.86 0.08 -0.11 0.00 0.63 0.00 0.00 28.75 31.20 1pq2 h GLU 438 CO 0.46 -0.23 0.24 0.78 -0.73 0.00 0.00 179.01 179.53 1pq2 h GLY 439 N -0.36 1.14 0.97 1.92 0.00 -1.85 -0.10 103.07 104.80 1pq2 h GLY 439 Ca 0.01 -0.08 -0.00 0.00 0.00 0.00 0.00 47.33 47.26 1pq2 h GLY 439 CO -0.20 -0.20 0.15 -2.00 0.00 0.00 0.00 176.54 174.30 1pq2 h LEU 440 N 0.33 0.30 0.16 3.11 5.85 -1.81 -1.91 115.31 121.33 1pq2 h LEU 440 Ca 0.44 -0.05 0.01 0.00 0.84 0.00 0.00 57.88 59.13 1pq2 h LEU 440 Cb 0.76 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.69 1pq2 h LEU 440 CO -0.50 0.26 -0.30 0.00 -0.34 0.00 0.00 178.44 177.56 1pq2 h ALA 441 N 1.05 -0.54 -0.32 1.25 0.00 0.53 0.23 119.26 121.46 1pq2 h ALA 441 Ca 0.09 -0.06 0.09 0.00 0.00 0.00 0.00 54.91 55.03 1pq2 h ALA 441 Cb 0.02 0.47 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1pq2 h ALA 441 CO -0.02 -0.85 0.24 0.00 0.00 0.00 0.00 179.25 178.62 1pq2 h ARG 442 N -0.54 0.00 0.22 0.00 2.47 -1.13 0.11 114.38 115.52 1pq2 h ARG 442 Ca 0.02 0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 58.73 1pq2 h ARG 442 Cb 0.55 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.88 1pq2 h ARG 442 CO -0.15 0.00 -0.11 1.98 0.56 0.00 0.00 179.97 182.26 1pq2 h MET 443 N 0.00 -0.29 -0.55 0.04 4.05 -0.21 -0.02 114.93 117.96 1pq2 h MET 443 Ca 0.15 0.02 0.08 0.00 -0.28 0.00 0.00 59.70 59.67 1pq2 h MET 443 Cb 0.62 0.06 -0.06 0.00 -0.80 0.00 0.00 31.60 31.42 1pq2 h MET 443 CO -0.00 0.09 0.19 0.93 0.23 0.00 0.00 176.91 178.35 1pq2 h GLU 444 N -0.78 0.36 0.19 0.39 5.08 0.75 0.16 114.58 120.73 1pq2 h GLU 444 Ca -0.03 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 1pq2 h GLU 444 Cb 0.51 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.68 1pq2 h GLU 444 CO 0.05 0.24 -0.09 -0.07 -1.00 0.00 0.00 179.01 178.13 1pq2 h LEU 445 N 0.37 -0.22 -0.61 1.33 3.38 -0.86 -1.06 115.31 117.64 1pq2 h LEU 445 Ca 0.27 -0.26 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1pq2 h LEU 445 Cb 0.31 0.06 -0.03 0.00 0.09 0.00 0.00 40.66 41.09 1pq2 h LEU 445 CO -0.28 0.17 0.39 0.15 0.09 0.00 0.00 178.44 178.96 1pq2 h PHE 446 N -0.65 0.78 0.16 1.13 3.04 -0.78 -2.20 116.94 118.41 1pq2 h PHE 446 Ca -0.03 0.01 -0.01 0.00 3.98 0.00 0.00 57.97 61.92 1pq2 h PHE 446 Cb 0.47 -0.26 0.00 0.00 2.56 0.00 0.00 35.95 38.72 1pq2 h PHE 446 CO 0.04 0.51 -0.07 -0.07 -2.02 0.00 0.00 178.31 176.70 1pq2 h LEU 447 N 0.82 -0.18 -0.22 0.59 3.38 -0.73 -2.86 115.31 116.12 1pq2 h LEU 447 Ca 0.22 -0.35 0.05 0.00 0.09 0.00 0.00 57.88 57.89 1pq2 h LEU 447 Cb -0.06 0.05 -0.05 0.00 0.09 0.00 0.00 40.66 40.69 1pq2 h LEU 447 CO -0.04 0.31 -0.09 -0.26 0.09 0.00 0.00 178.44 178.45 1pq2 h PHE 448 N -0.73 -0.20 0.58 1.13 0.04 -1.20 0.61 116.94 117.17 1pq2 h PHE 448 Ca -0.02 0.02 -0.03 0.00 2.80 0.00 0.00 57.97 60.75 1pq2 h PHE 448 Cb 0.51 0.12 -0.00 0.00 2.20 0.00 0.00 35.95 38.78 1pq2 h PHE 448 CO 0.07 -0.14 -0.35 -0.07 -0.60 0.00 0.00 178.31 177.22 1pq2 h LEU 449 N -0.05 -0.89 -1.43 1.54 3.38 -1.50 0.14 115.31 116.50 1pq2 h LEU 449 Ca 0.11 0.05 0.16 0.00 0.09 0.00 0.00 57.88 58.29 1pq2 h LEU 449 Cb 0.22 0.26 -0.06 0.00 0.09 0.00 0.00 40.66 41.16 1pq2 h LEU 449 CO -0.25 -0.54 0.56 0.71 0.09 0.00 0.00 178.44 179.00 1pq2 h THR 450 N -0.87 0.78 -0.33 0.22 1.35 -1.45 0.25 112.91 112.85 1pq2 h THR 450 Ca -0.08 -0.18 -0.14 0.00 -0.55 0.00 0.00 66.41 65.46 1pq2 h THR 450 Cb 0.70 0.20 -0.01 0.00 -1.73 0.00 0.00 68.15 67.30 1pq2 h THR 450 CO 0.08 0.10 -0.36 0.74 -0.25 0.00 0.00 175.52 175.83 1pq2 h THR 451 N 0.54 1.28 -0.22 6.82 2.02 -0.56 -1.45 112.91 121.33 1pq2 h THR 451 Ca 0.43 -1.52 -0.12 0.00 0.77 0.00 0.00 66.41 65.96 1pq2 h THR 451 Cb 0.86 1.41 -0.00 0.00 -1.74 0.00 0.00 68.15 68.69 1pq2 h THR 451 CO -0.17 0.50 -0.33 0.40 0.37 0.00 0.00 175.52 176.28 1pq2 h ILE 452 N 0.63 1.32 0.00 3.11 2.04 0.18 -3.15 117.51 121.64 1pq2 h ILE 452 Ca 0.06 -1.54 0.00 0.00 1.00 0.00 0.00 64.86 64.38 1pq2 h ILE 452 Cb 0.91 1.78 0.00 0.00 -0.74 0.00 0.00 36.82 38.76 1pq2 h ILE 452 CO 0.08 0.48 0.00 0.18 0.00 0.00 0.00 178.15 178.89 1pq2 n LEU 453 N -4.28 0.00 0.01 1.44 4.77 0.61 -0.88 117.00 118.66 1pq2 n LEU 453 Ca -0.05 0.13 -0.03 0.00 -0.03 0.00 0.00 56.01 56.03 1pq2 n LEU 453 Cb 0.50 -0.13 -0.10 0.00 -2.33 0.00 0.00 43.42 41.35 1pq2 n LEU 453 CO 0.45 -0.00 -0.38 1.67 -1.33 0.00 0.00 177.39 177.80 1pq2 n GLN 454 N -1.13 0.62 -0.13 3.23 7.27 -0.55 -4.48 117.38 122.21 1pq2 n GLN 454 Ca 0.19 0.25 -0.25 0.00 0.07 0.00 0.00 57.00 57.27 1pq2 n GLN 454 Cb 0.17 -1.80 -0.10 0.00 2.41 0.00 0.00 30.24 30.92 1pq2 n GLN 454 CO 0.00 0.00 0.00 0.09 0.07 0.00 0.00 177.06 177.22 1pq2 n ASN 455 N -2.94 1.94 -4.86 1.69 4.13 -1.15 -4.99 115.26 109.08 1pq2 n ASN 455 Ca -0.12 0.17 -0.22 0.00 1.68 0.00 0.00 54.58 56.09 1pq2 n ASN 455 Cb 0.92 -0.65 0.04 0.00 -1.54 0.00 0.00 39.78 38.55 1pq2 n ASN 455 CO 0.00 0.00 0.00 0.49 0.28 0.00 0.00 177.26 178.03 1pq2 n PHE 456 N -3.86 -1.64 -4.08 3.10 3.72 -0.06 -3.45 117.46 111.19 1pq2 n PHE 456 Ca -0.49 -2.17 -0.11 0.00 -0.05 0.00 0.00 57.45 54.62 1pq2 n PHE 456 Cb 0.90 -0.51 -0.11 0.00 -0.94 0.00 0.00 39.48 38.83 1pq2 n PHE 456 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 176.76 175.91 1pq2 s ASN 457 N -4.41 0.80 -0.22 4.37 0.02 0.12 -4.60 114.94 111.01 1pq2 s ASN 457 Ca 0.49 -0.69 -0.08 0.00 -1.02 0.00 0.00 52.86 51.56 1pq2 s ASN 457 Cb -0.04 0.07 -0.04 0.00 0.02 0.00 0.00 41.25 41.27 1pq2 s ASN 457 CO 0.31 -0.32 0.08 -0.76 0.02 0.00 0.00 177.10 176.43 1pq2 s LEU 458 N -2.03 3.68 0.06 0.60 1.43 -1.26 -1.75 118.68 119.41 1pq2 s LEU 458 Ca -0.04 -0.04 0.03 0.00 -1.03 0.00 0.00 54.13 53.04 1pq2 s LEU 458 Cb -0.05 -1.96 -0.03 0.00 0.03 0.00 0.00 46.19 44.18 1pq2 s LEU 458 CO -0.02 0.07 -0.08 -0.75 0.23 0.00 0.00 176.35 175.80 1pq2 s LYS 459 N 0.98 0.66 0.24 1.70 2.20 -0.89 -4.96 119.74 119.67 1pq2 s LYS 459 Ca 0.04 -0.96 0.07 0.00 -0.36 0.00 0.00 55.97 54.76 1pq2 s LYS 459 Cb -0.14 -0.34 -0.05 0.00 -1.51 0.00 0.00 37.83 35.78 1pq2 s LYS 459 CO 0.03 0.05 -0.09 0.45 -0.36 0.00 0.00 175.35 175.43 1pq2 s SER 460 N -2.03 2.54 -0.34 1.43 0.15 -1.26 -0.69 113.70 113.50 1pq2 s SER 460 Ca -0.02 -1.12 -0.00 0.00 0.70 0.00 0.00 55.95 55.50 1pq2 s SER 460 Cb -0.06 -0.13 0.29 0.00 -1.71 0.00 0.00 66.02 64.42 1pq2 s SER 460 CO -0.01 -0.29 1.86 0.52 1.20 0.00 0.00 173.24 176.51 1pq2 n VAL 461 N -0.47 2.70 -3.64 4.45 0.31 -1.26 -4.84 118.33 115.57 1pq2 n VAL 461 Ca -0.07 -1.60 -0.02 0.00 -0.01 0.00 0.00 64.34 62.64 1pq2 n VAL 461 Cb 0.62 -1.11 -0.04 0.00 -0.91 0.00 0.00 33.84 32.40 1pq2 n VAL 461 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1pq2 s ASP 462 N -0.19 -0.03 0.64 4.52 3.68 -1.26 -5.15 116.67 118.87 1pq2 s ASP 462 Ca 0.35 0.03 -0.18 0.00 2.13 0.00 0.00 52.55 54.88 1pq2 s ASP 462 Cb 0.28 0.03 -0.02 0.00 -1.45 0.00 0.00 42.92 41.76 1pq2 s ASP 462 CO 0.02 -0.04 1.17 0.47 0.13 0.00 0.00 175.17 176.92 1pq2 n ASP 463 N 0.39 1.57 0.00 -0.34 8.00 -1.26 -4.84 116.55 120.07 1pq2 n ASP 463 Ca 0.01 0.81 0.00 0.00 0.71 0.00 0.00 54.79 56.32 1pq2 n ASP 463 Cb 0.58 -1.50 0.02 0.00 -0.02 0.00 0.00 41.12 40.21 1pq2 n ASP 463 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1pq2 n LEU 464 N -1.58 0.00 0.17 0.64 4.77 -1.26 -1.46 117.00 118.29 1pq2 n LEU 464 Ca 0.15 0.39 0.11 0.00 -0.03 0.00 0.00 56.01 56.64 1pq2 n LEU 464 Cb 0.48 -0.39 0.09 0.00 -2.33 0.00 0.00 43.42 41.27 1pq2 n LEU 464 CO 0.48 -0.38 0.45 0.50 -1.33 0.00 0.00 177.39 177.11 1pq2 h LYS 465 N 0.00 0.00 -0.60 3.23 1.63 -1.98 -3.19 116.57 115.65 1pq2 h LYS 465 Ca 0.00 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 1pq2 h LYS 465 Cb 0.01 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.64 1pq2 h LYS 465 CO 0.00 0.02 0.00 0.09 -3.45 0.00 0.00 179.45 176.11 1pq2 n ASN 466 N -2.92 3.27 -4.04 4.20 4.13 -0.53 -4.75 115.26 114.61 1pq2 n ASN 466 Ca 0.02 -2.29 -0.32 0.00 1.68 0.00 0.00 54.58 53.67 1pq2 n ASN 466 Cb 0.55 -0.46 -0.14 0.00 -1.54 0.00 0.00 39.78 38.18 1pq2 n ASN 466 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 1pq2 s LEU 467 N -1.37 4.87 0.41 3.41 2.96 -1.21 -5.01 118.68 122.74 1pq2 s LEU 467 Ca 0.33 -2.17 -0.13 0.00 -0.22 0.00 0.00 54.13 51.94 1pq2 s LEU 467 Cb 0.21 -1.68 -0.08 0.00 0.50 0.00 0.00 46.19 45.15 1pq2 s LEU 467 CO 0.16 -0.41 0.81 0.54 -1.32 0.00 0.00 176.35 176.13 1pq2 s ASN 468 N 1.07 6.63 -0.33 3.68 6.03 -1.26 -5.00 114.94 125.76 1pq2 s ASN 468 Ca 0.11 1.28 0.13 0.00 -1.03 0.00 0.00 52.86 53.35 1pq2 s ASN 468 Cb -0.20 -2.38 0.46 0.00 -3.03 0.00 0.00 41.25 36.10 1pq2 s ASN 468 CO -0.07 -0.38 1.09 0.35 -2.03 0.00 0.00 177.10 176.06 1pq2 n THR 469 N -1.08 1.78 -3.83 0.54 -2.24 -1.26 -4.92 114.28 103.26 1pq2 n THR 469 Ca 0.04 -3.77 -0.37 0.00 -2.27 0.00 0.00 64.05 57.68 1pq2 n THR 469 Cb 0.54 -0.09 -0.06 0.00 -2.10 0.00 0.00 70.33 68.62 1pq2 n THR 469 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1pq2 s THR 470 N -4.25 5.46 0.41 4.28 2.01 -1.26 -5.02 115.64 117.27 1pq2 s THR 470 Ca 0.38 0.25 -0.23 0.00 0.31 0.00 0.00 61.69 62.41 1pq2 s THR 470 Cb 0.40 -3.43 -0.10 0.00 0.01 0.00 0.00 72.50 69.38 1pq2 s THR 470 CO -0.04 0.59 0.99 0.00 -0.69 0.00 0.00 174.62 175.47 1pq2 s ALA 471 N -0.82 3.06 -0.74 7.40 0.00 -1.26 -4.07 121.76 125.32 1pq2 s ALA 471 Ca 0.15 0.53 0.01 0.00 0.00 0.00 0.00 51.96 52.65 1pq2 s ALA 471 Cb -0.12 -3.20 0.18 0.00 0.00 0.00 0.00 23.12 19.98 1pq2 s ALA 471 CO 0.04 -0.01 0.56 0.54 0.00 0.00 0.00 175.76 176.89 1pq2 s VAL 472 N -1.91 3.52 0.00 0.00 0.11 -1.06 -5.00 120.40 116.06 1pq2 s VAL 472 Ca 0.59 -3.84 -0.04 0.00 -2.93 0.00 0.00 61.98 55.77 1pq2 s VAL 472 Cb -0.15 -3.26 -0.17 0.00 -1.53 0.00 0.00 36.38 31.27 1pq2 s VAL 472 CO 0.20 -0.99 2.55 0.41 -3.33 0.00 0.00 175.10 173.94 1pq2 n THR 473 N 2.45 2.04 0.35 5.04 -1.04 -1.26 -3.78 114.28 118.08 1pq2 n THR 473 Ca 0.17 -0.97 -0.04 0.00 -2.04 0.00 0.00 64.05 61.17 1pq2 n THR 473 Cb 0.36 -1.79 0.02 0.00 -1.82 0.00 0.00 70.33 67.10 1pq2 n THR 473 CO 0.00 0.00 0.00 1.17 -0.64 0.00 0.00 175.07 175.60 1pq2 n LYS 474 N 2.50 1.21 -3.91 -2.82 0.00 -1.26 -3.87 118.16 110.01 1pq2 n LYS 474 Ca 0.26 -0.48 0.01 0.00 0.00 0.00 0.00 58.31 58.11 1pq2 n LYS 474 Cb 0.62 -1.19 0.01 0.00 0.00 0.00 0.00 35.03 34.47 1pq2 n LYS 474 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1pq2 n GLY 475 N 0.45 0.32 0.23 3.14 0.00 -1.26 -4.42 105.19 103.66 1pq2 n GLY 475 Ca 0.09 -1.07 0.09 0.00 0.00 0.00 0.00 46.02 45.14 1pq2 n GLY 475 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 1pq2 h ILE 476 N 1.96 0.77 -3.45 -0.61 -2.65 -1.89 -3.38 117.51 108.26 1pq2 h ILE 476 Ca -0.22 -0.82 -0.67 0.00 1.03 0.00 0.00 64.86 64.18 1pq2 h ILE 476 Cb 1.15 1.50 -0.34 0.00 -2.05 0.00 0.00 36.82 37.07 1pq2 h ILE 476 CO 0.31 0.20 -0.80 -0.69 0.03 0.00 0.00 178.15 177.20 1pq2 s VAL 477 N -4.12 2.37 0.06 0.16 1.01 -1.26 -4.14 120.40 114.48 1pq2 s VAL 477 Ca -0.02 -1.17 -0.28 0.00 0.00 0.00 0.00 61.98 60.51 1pq2 s VAL 477 Cb 0.13 -2.19 -0.05 0.00 0.00 0.00 0.00 36.38 34.27 1pq2 s VAL 477 CO 0.63 0.26 0.89 -0.94 0.00 0.00 0.00 175.10 175.95 1pq2 s SER 478 N 1.25 7.36 0.29 3.32 1.04 -0.94 -4.80 113.70 121.21 1pq2 s SER 478 Ca -0.01 1.63 0.06 0.00 0.48 0.00 0.00 55.95 58.11 1pq2 s SER 478 Cb -0.16 -2.54 -0.02 0.00 0.10 0.00 0.00 66.02 63.39 1pq2 s SER 478 CO -0.08 -0.08 0.34 -0.76 0.98 0.00 0.00 173.24 173.64 1pq2 s LEU 479 N 0.23 3.97 0.47 2.42 1.43 -1.25 -4.72 118.68 121.23 1pq2 s LEU 479 Ca 0.45 -0.19 -0.02 0.00 -1.03 0.00 0.00 54.13 53.34 1pq2 s LEU 479 Cb -0.22 -2.59 -0.01 0.00 0.03 0.00 0.00 46.19 43.40 1pq2 s LEU 479 CO 0.27 -0.22 0.72 -2.16 0.23 0.00 0.00 176.35 175.19 1pq2 s PRO 480 N -4.01 3.22 0.21 1.29 0.04 -1.26 -2.57 135.00 131.92 1pq2 s PRO 480 Ca 0.38 -0.20 -0.30 0.00 0.04 0.00 0.00 61.00 60.93 1pq2 s PRO 480 Cb -0.08 -2.47 -0.08 0.00 0.04 0.00 0.00 34.50 31.90 1pq2 s PRO 480 CO 0.28 -0.27 1.21 -1.25 0.04 0.00 0.00 177.00 177.01 1pq2 s PRO 481 N -4.65 4.48 0.58 0.56 0.04 -1.26 -4.90 135.00 129.86 1pq2 s PRO 481 Ca 0.48 1.92 -0.18 0.00 0.04 0.00 0.00 61.00 63.26 1pq2 s PRO 481 Cb -0.10 -3.22 -0.08 0.00 0.04 0.00 0.00 34.50 31.15 1pq2 s PRO 481 CO 0.41 -0.08 0.64 0.45 0.04 0.00 0.00 177.00 178.45 1pq2 n SER 482 N 2.25 -0.59 -2.37 6.66 2.88 -1.26 -4.99 113.62 116.20 1pq2 n SER 482 Ca 0.04 0.75 -0.03 0.00 -1.33 0.00 0.00 58.87 58.30 1pq2 n SER 482 Cb 0.44 -1.23 0.01 0.00 -0.75 0.00 0.00 64.21 62.69 1pq2 n SER 482 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1pq2 n TYR 483 N -1.72 -1.23 -4.17 0.66 0.18 -1.26 -5.10 117.16 104.51 1pq2 n TYR 483 Ca 0.12 -0.87 -0.16 0.00 1.88 0.00 0.00 57.90 58.87 1pq2 n TYR 483 Cb 0.48 0.43 -0.11 0.00 -0.38 0.00 0.00 39.34 39.75 1pq2 n TYR 483 CO 0.00 0.00 0.00 -0.65 -2.08 0.00 0.00 176.86 174.13 1pq2 s GLN 484 N -2.04 0.82 0.00 -3.48 -0.21 -1.26 -4.46 119.66 109.03 1pq2 s GLN 484 Ca 0.13 -1.05 -0.17 0.00 0.02 0.00 0.00 55.36 54.29 1pq2 s GLN 484 Cb -0.02 -0.65 0.03 0.00 1.00 0.00 0.00 33.01 33.37 1pq2 s GLN 484 CO 0.04 0.12 0.37 -1.50 -2.12 0.00 0.00 175.29 172.20 1pq2 s ILE 485 N -1.89 0.05 -0.18 1.08 2.07 -0.71 -4.79 121.20 116.83 1pq2 s ILE 485 Ca 0.02 -0.45 0.00 0.00 -1.41 0.00 0.00 60.65 58.80 1pq2 s ILE 485 Cb -0.06 -0.77 0.01 0.00 0.13 0.00 0.00 42.46 41.77 1pq2 s ILE 485 CO 0.01 -0.25 -0.16 0.00 -1.91 0.00 0.00 174.94 172.63 1pq2 s PHE 487 N 1.24 2.96 -0.26 0.00 0.40 -1.26 -2.09 117.98 118.98 1pq2 s PHE 487 Ca 0.03 -0.32 -0.09 0.00 -0.60 0.00 0.00 56.93 55.95 1pq2 s PHE 487 Cb -0.14 -3.70 -0.04 0.00 0.51 0.00 0.00 43.02 39.65 1pq2 s PHE 487 CO -0.09 -1.13 0.14 0.42 0.70 0.00 0.00 175.22 175.26 1pq2 s ILE 488 N 3.09 4.92 0.40 0.64 -1.09 -0.72 -3.73 121.20 124.71 1pq2 s ILE 488 Ca 0.21 0.03 -0.20 0.00 -2.23 0.00 0.00 60.65 58.47 1pq2 s ILE 488 Cb -0.17 -3.32 -0.11 0.00 -1.58 0.00 0.00 42.46 37.29 1pq2 s ILE 488 CO 0.15 0.30 0.90 -2.84 -1.23 0.00 0.00 174.94 172.22 1pq2 s PRO 489 N 1.58 4.18 0.00 2.79 0.02 -1.26 0.12 135.00 142.42 1pq2 s PRO 489 Ca 0.07 1.01 0.00 0.00 0.02 0.00 0.00 61.00 62.10 1pq2 s PRO 489 Cb -0.15 -2.24 0.00 0.00 0.02 0.00 0.00 34.50 32.13 1pq2 s PRO 489 CO 0.07 0.01 0.00 0.28 -0.33 0.00 0.00 177.00 177.04