#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nqn n LEU 7 N 0.00 0.00 -4.76 0.99 7.94 -1.26 -4.54 117.00 115.38 2nqn n LEU 7 Ca 0.00 0.00 -0.41 0.00 -1.11 0.00 0.00 56.01 54.49 2nqn n LEU 7 Cb 0.00 0.00 -0.03 0.00 0.53 0.00 0.00 43.42 43.92 2nqn n LEU 7 CO 0.00 0.00 0.94 -0.32 -1.11 0.00 0.00 177.39 176.90 2nqn s MET 8 N 0.00 4.43 0.35 1.96 1.75 -1.04 -4.66 119.30 122.10 2nqn s MET 8 Ca 0.00 2.08 -0.13 0.00 -1.25 0.00 0.00 55.69 56.39 2nqn s MET 8 Cb 0.00 -3.13 -0.08 0.00 2.84 0.00 0.00 34.83 34.46 2nqn s MET 8 CO 0.00 -0.12 0.75 -1.54 -0.65 0.00 0.00 175.02 173.46 2nqn s SER 9 N -0.31 6.68 0.21 1.11 1.04 -1.26 0.24 113.70 121.42 2nqn s SER 9 Ca 0.50 1.23 -0.09 0.00 0.48 0.00 0.00 55.95 58.08 2nqn s SER 9 Cb -0.37 -2.36 0.31 0.00 0.10 0.00 0.00 66.02 63.71 2nqn s SER 9 CO 0.46 -0.28 1.73 0.25 0.98 0.00 0.00 173.24 176.37 2nqn h LEU 10 N 1.88 0.15 -0.54 2.42 6.46 -1.95 -1.09 115.31 122.65 2nqn h LEU 10 Ca -0.48 0.10 0.07 0.00 -0.12 0.00 0.00 57.88 57.45 2nqn h LEU 10 Cb 1.18 0.10 -0.06 0.00 -0.73 0.00 0.00 40.66 41.15 2nqn h LEU 10 CO 0.65 0.08 0.21 -0.78 -0.62 0.00 0.00 178.44 177.99 2nqn h ASP 11 N 0.36 0.24 0.11 1.25 1.82 -1.98 0.16 116.42 118.38 2nqn h ASP 11 Ca 0.33 0.06 -0.01 0.00 -0.39 0.00 0.00 57.03 57.02 2nqn h ASP 11 Cb 0.45 0.03 0.00 0.00 0.68 0.00 0.00 39.33 40.49 2nqn h ASP 11 CO -0.36 0.16 -0.05 0.74 -1.61 0.00 0.00 179.24 178.12 2nqn h THR 12 N 0.41 0.97 -0.34 2.25 2.02 -1.63 0.07 112.91 116.65 2nqn h THR 12 Ca 0.26 -0.33 0.03 0.00 0.77 0.00 0.00 66.41 67.13 2nqn h THR 12 Cb 0.27 1.19 -0.03 0.00 -1.74 0.00 0.00 68.15 67.84 2nqn h THR 12 CO -0.24 0.08 0.17 0.00 0.37 0.00 0.00 175.52 175.89 2nqn h ALA 13 N 0.56 0.42 -0.02 6.16 0.00 -0.96 0.15 119.26 125.57 2nqn h ALA 13 Ca -0.02 0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.92 2nqn h ALA 13 Cb 0.25 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 2nqn h ALA 13 CO 0.03 -0.21 -0.07 1.25 0.00 0.00 0.00 179.25 180.25 2nqn h LEU 14 N 0.35 -0.21 -1.14 0.00 5.85 -0.59 0.72 115.31 120.29 2nqn h LEU 14 Ca 0.15 0.04 0.01 0.00 0.84 0.00 0.00 57.88 58.91 2nqn h LEU 14 Cb 0.06 0.09 -0.04 0.00 0.37 0.00 0.00 40.66 41.14 2nqn h LEU 14 CO -0.10 -0.10 0.56 -1.13 -0.34 0.00 0.00 178.44 177.32 2nqn h ASN 15 N -0.12 0.99 -0.30 1.25 -1.24 -0.59 -0.52 115.58 115.05 2nqn h ASN 15 Ca 0.04 -0.03 -0.02 0.00 0.71 0.00 0.00 56.30 56.99 2nqn h ASN 15 Cb 0.16 -0.25 -0.01 0.00 0.73 0.00 0.00 38.32 38.95 2nqn h ASN 15 CO -0.09 0.73 0.09 -0.08 -1.29 0.00 0.00 177.43 176.79 2nqn h GLU 16 N 1.17 0.47 0.36 6.67 4.57 -0.11 -1.77 114.58 125.93 2nqn h GLU 16 Ca 0.31 -0.10 -0.02 0.00 -1.18 0.00 0.00 59.36 58.37 2nqn h GLU 16 Cb -0.12 -0.07 0.00 0.00 -0.16 0.00 0.00 28.75 28.40 2nqn h GLU 16 CO -0.07 0.52 -0.17 0.52 -1.18 0.00 0.00 179.01 178.63 2nqn h MET 17 N 0.33 -0.46 -0.67 1.92 2.86 -0.30 -3.22 114.93 115.39 2nqn h MET 17 Ca 0.10 0.03 -0.04 0.00 -2.06 0.00 0.00 59.70 57.73 2nqn h MET 17 Cb 0.25 0.10 -0.03 0.00 0.06 0.00 0.00 31.60 31.98 2nqn h MET 17 CO -0.00 -0.22 0.25 -0.07 1.06 0.00 0.00 176.91 177.93 2nqn h LEU 18 N -0.63 0.92 -2.44 1.22 3.38 -1.14 -2.69 115.31 113.92 2nqn h LEU 18 Ca -0.05 -0.14 -0.00 0.00 0.09 0.00 0.00 57.88 57.78 2nqn h LEU 18 Cb 0.46 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.97 2nqn h LEU 18 CO 0.08 0.83 -0.01 0.77 0.09 0.00 0.00 178.44 180.21 2nqn h SER 19 N 0.98 0.00 0.44 -0.43 4.64 -1.36 -2.24 113.55 115.58 2nqn h SER 19 Ca 0.23 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.55 2nqn h SER 19 Cb 0.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.30 2nqn h SER 19 CO -0.02 0.01 -1.21 0.54 -0.87 0.00 0.00 176.83 175.28 2nqn n ARG 20 N -3.12 0.41 -3.06 4.77 1.74 -1.02 -4.94 116.66 111.44 2nqn n ARG 20 Ca -0.02 -0.02 -0.39 0.00 -0.77 0.00 0.00 57.85 56.65 2nqn n ARG 20 Cb 0.15 -1.62 -0.06 0.00 -1.02 0.00 0.00 32.46 29.92 2nqn n ARG 20 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2nqn s VAL 21 N -3.29 4.55 -0.19 1.55 1.01 -0.84 -5.07 120.40 118.13 2nqn s VAL 21 Ca 0.01 1.56 -0.03 0.00 0.00 0.00 0.00 61.98 63.52 2nqn s VAL 21 Cb 0.13 -4.07 -0.01 0.00 0.00 0.00 0.00 36.38 32.44 2nqn s VAL 21 CO 0.82 0.49 -0.08 -0.89 0.00 0.00 0.00 175.10 175.44 2nqn s THR 22 N -0.85 3.18 0.45 3.92 2.01 -1.26 -5.00 115.64 118.09 2nqn s THR 22 Ca 0.35 -0.57 -0.24 0.00 0.31 0.00 0.00 61.69 61.53 2nqn s THR 22 Cb -0.22 -2.41 -0.09 0.00 0.01 0.00 0.00 72.50 69.79 2nqn s THR 22 CO 0.23 0.46 1.26 -2.65 -0.69 0.00 0.00 174.62 173.23 2nqn n PRO 23 N 4.45 1.82 -1.32 4.92 -0.02 -1.26 -4.81 135.00 138.77 2nqn n PRO 23 Ca -0.18 0.65 -0.33 0.00 -2.02 0.00 0.00 63.50 61.62 2nqn n PRO 23 Cb 0.51 -2.39 0.10 0.00 -0.02 0.00 0.00 33.50 31.70 2nqn n PRO 23 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2nqn s LEU 24 N -1.94 3.18 0.00 2.45 1.02 -0.04 -4.96 118.68 118.38 2nqn s LEU 24 Ca 0.63 2.12 0.00 0.00 0.02 0.00 0.00 54.13 56.90 2nqn s LEU 24 Cb -0.49 -4.56 0.00 0.00 0.02 0.00 0.00 46.19 41.16 2nqn s LEU 24 CO 0.56 -2.23 0.00 0.35 0.02 0.00 0.00 176.35 175.05 2nqn n THR 25 N -3.13 0.00 -1.73 5.49 -2.24 -1.26 -4.69 114.28 106.72 2nqn n THR 25 Ca 0.11 -0.10 -0.42 0.00 -2.27 0.00 0.00 64.05 61.37 2nqn n THR 25 Cb 0.52 0.63 -0.01 0.00 -2.10 0.00 0.00 70.33 69.36 2nqn n THR 25 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2nqn n ALA 26 N -0.44 1.98 -2.25 6.98 0.00 -1.26 -4.89 120.51 120.64 2nqn n ALA 26 Ca 0.00 0.37 -0.14 0.00 0.00 0.00 0.00 53.44 53.67 2nqn n ALA 26 Cb 0.00 -2.37 -0.10 0.00 0.00 0.00 0.00 19.45 16.97 2nqn n ALA 26 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.50 178.64 2nqn s GLN 27 N -1.17 1.15 0.04 0.00 -2.07 -1.26 -1.01 119.66 115.34 2nqn s GLN 27 Ca 0.60 -1.56 -0.07 0.00 -1.82 0.00 0.00 55.36 52.51 2nqn s GLN 27 Cb -0.53 -0.27 -0.01 0.00 -1.09 0.00 0.00 33.01 31.11 2nqn s GLN 27 CO 0.55 -0.15 0.13 -1.83 -1.32 0.00 0.00 175.29 172.67 2nqn s GLU 28 N -3.93 0.62 -0.20 9.60 -1.05 -0.21 -4.85 118.70 118.68 2nqn s GLU 28 Ca 0.26 -0.70 -0.06 0.00 -0.15 0.00 0.00 54.97 54.32 2nqn s GLU 28 Cb 0.06 0.25 -0.03 0.00 -0.44 0.00 0.00 34.13 33.97 2nqn s GLU 28 CO 0.05 -0.16 0.01 0.99 0.95 0.00 0.00 175.26 177.10 2nqn s THR 29 N -2.56 4.09 0.12 1.83 2.01 -1.26 -0.11 115.64 119.75 2nqn s THR 29 Ca -0.05 -0.27 0.06 0.00 0.31 0.00 0.00 61.69 61.74 2nqn s THR 29 Cb -0.01 -2.85 -0.04 0.00 0.01 0.00 0.00 72.50 69.61 2nqn s THR 29 CO -0.04 0.42 -0.14 -0.76 -0.69 0.00 0.00 174.62 173.41 2nqn s LEU 30 N 0.98 2.39 0.63 4.42 1.43 -0.88 -4.92 118.68 122.73 2nqn s LEU 30 Ca 0.02 -0.79 -0.18 0.00 -1.03 0.00 0.00 54.13 52.16 2nqn s LEU 30 Cb -0.14 -0.55 -0.01 0.00 0.03 0.00 0.00 46.19 45.51 2nqn s LEU 30 CO 0.02 -0.13 1.21 -2.84 0.23 0.00 0.00 176.35 174.83 2nqn s PRO 31 N -2.55 2.74 0.24 1.29 0.02 -1.26 -1.96 135.00 133.52 2nqn s PRO 31 Ca 0.08 1.81 -0.04 0.00 0.02 0.00 0.00 61.00 62.86 2nqn s PRO 31 Cb -0.06 -1.90 0.44 0.00 0.02 0.00 0.00 34.50 33.01 2nqn s PRO 31 CO 0.03 -1.39 1.74 -0.07 -0.33 0.00 0.00 177.00 176.99 2nqn h LEU 32 N 0.53 0.35 -1.50 -5.54 3.38 -1.80 -1.99 115.31 108.74 2nqn h LEU 32 Ca -0.50 0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.57 2nqn h LEU 32 Cb 1.30 0.06 0.00 0.00 0.09 0.00 0.00 40.66 42.10 2nqn h LEU 32 CO 0.54 0.15 0.05 1.62 0.09 0.00 0.00 178.44 180.88 2nqn h VAL 33 N 0.50 0.00 -0.42 1.22 3.04 -1.91 -0.33 116.25 118.36 2nqn h VAL 33 Ca 0.41 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 66.10 2nqn h VAL 33 Cb 0.58 0.50 0.00 0.00 -2.01 0.00 0.00 31.29 30.36 2nqn h VAL 33 CO -0.37 0.00 0.00 0.00 -1.01 0.00 0.00 177.57 176.19 2nqn n GLN 34 N -2.31 2.45 -0.15 4.17 6.02 -0.75 -4.58 117.38 122.23 2nqn n GLN 34 Ca -0.01 -2.17 0.12 0.00 -0.01 0.00 0.00 57.00 54.92 2nqn n GLN 34 Cb 0.08 -1.41 0.24 0.00 1.02 0.00 0.00 30.24 30.18 2nqn n GLN 34 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2nqn s PHE 36 N -1.61 2.56 0.00 0.00 5.36 -1.26 -1.32 117.98 121.71 2nqn s PHE 36 Ca 0.36 0.19 0.00 0.00 -0.96 0.00 0.00 56.93 56.52 2nqn s PHE 36 Cb 0.21 -4.14 0.00 0.00 -0.34 0.00 0.00 43.02 38.75 2nqn s PHE 36 CO 0.30 -4.51 0.00 0.41 -1.46 0.00 0.00 175.22 169.96 2nqn n GLY 37 N 4.08 2.17 3.85 13.12 0.00 0.74 -5.01 105.19 124.15 2nqn n GLY 37 Ca 0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.87 2nqn n GLY 37 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2nqn s ARG 38 N -0.11 3.87 -0.26 1.61 1.81 -0.43 -4.70 118.95 120.74 2nqn s ARG 38 Ca 0.00 0.80 -0.13 0.00 -1.72 0.00 0.00 55.73 54.68 2nqn s ARG 38 Cb 0.00 -2.20 -0.04 0.00 -0.45 0.00 0.00 34.95 32.25 2nqn s ARG 38 CO 0.00 -0.23 0.27 0.42 -0.68 0.00 0.00 175.30 175.08 2nqn s ILE 39 N -2.60 5.26 0.13 1.52 -1.09 -1.26 -0.78 121.20 122.38 2nqn s ILE 39 Ca 0.56 0.37 -0.33 0.00 -2.23 0.00 0.00 60.65 59.03 2nqn s ILE 39 Cb -0.10 -3.60 -0.13 0.00 -1.58 0.00 0.00 42.46 37.05 2nqn s ILE 39 CO 0.33 0.24 1.70 0.18 -1.23 0.00 0.00 174.94 176.16 2nqn n LEU 40 N 4.92 3.51 0.05 2.97 4.77 -0.61 -1.02 117.00 131.59 2nqn n LEU 40 Ca -0.12 1.04 -0.03 0.00 -0.03 0.00 0.00 56.01 56.87 2nqn n LEU 40 Cb 0.51 -1.47 -0.09 0.00 -2.33 0.00 0.00 43.42 40.05 2nqn n LEU 40 CO 0.36 -0.07 -0.09 0.00 -1.33 0.00 0.00 177.39 176.26 2nqn h ALA 41 N 7.06 0.61 -2.64 -1.18 0.00 -1.17 0.14 119.26 122.09 2nqn h ALA 41 Ca -0.45 -0.95 -0.19 0.00 0.00 0.00 0.00 54.91 53.32 2nqn h ALA 41 Cb 1.24 0.15 -0.18 0.00 0.00 0.00 0.00 17.79 19.00 2nqn h ALA 41 CO 0.92 1.12 -0.70 -1.12 0.00 0.00 0.00 179.25 179.47 2nqn s SER 42 N -6.23 0.64 0.54 0.00 0.01 -1.26 -4.79 113.70 102.62 2nqn s SER 42 Ca -0.01 -0.77 -0.21 0.00 1.31 0.00 0.00 55.95 56.27 2nqn s SER 42 Cb 0.09 0.12 -0.06 0.00 0.21 0.00 0.00 66.02 66.37 2nqn s SER 42 CO 0.80 -0.41 1.17 0.47 0.41 0.00 0.00 173.24 175.69 2nqn n ASP 43 N 0.77 1.83 -4.60 2.44 8.00 -1.26 -4.30 116.55 119.43 2nqn n ASP 43 Ca -0.18 0.93 -0.38 0.00 0.71 0.00 0.00 54.79 55.87 2nqn n ASP 43 Cb 0.58 -1.48 -0.11 0.00 -0.02 0.00 0.00 41.12 40.09 2nqn n ASP 43 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2nqn s VAL 44 N -1.36 5.29 -0.18 2.53 1.01 0.79 -4.91 120.40 123.58 2nqn s VAL 44 Ca 0.72 0.16 -0.03 0.00 0.00 0.00 0.00 61.98 62.83 2nqn s VAL 44 Cb -0.44 -3.51 -0.01 0.00 0.00 0.00 0.00 36.38 32.41 2nqn s VAL 44 CO 0.50 0.27 -0.07 -0.69 0.00 0.00 0.00 175.10 175.11 2nqn s VAL 45 N 1.63 3.40 0.07 2.92 1.01 -1.26 -0.00 120.40 128.16 2nqn s VAL 45 Ca 0.07 -0.51 -0.31 0.00 0.00 0.00 0.00 61.98 61.24 2nqn s VAL 45 Cb -0.16 -2.50 -0.08 0.00 0.00 0.00 0.00 36.38 33.64 2nqn s VAL 45 CO 0.10 0.47 1.61 -0.55 0.00 0.00 0.00 175.10 176.72 2nqn s SER 46 N 0.90 6.64 0.00 3.32 0.15 0.43 -4.85 113.70 120.29 2nqn s SER 46 Ca -0.01 2.44 0.28 0.00 0.70 0.00 0.00 55.95 59.36 2nqn s SER 46 Cb -0.15 -2.56 1.05 0.00 -1.71 0.00 0.00 66.02 62.65 2nqn s SER 46 CO 0.01 -0.86 1.78 -0.81 1.20 0.00 0.00 173.24 174.57 2nqn n PRO 47 N 5.43 0.13 -4.09 5.44 -0.04 -1.26 0.42 135.00 141.02 2nqn n PRO 47 Ca 0.15 -0.03 -0.10 0.00 -0.04 0.00 0.00 63.50 63.47 2nqn n PRO 47 Cb 0.41 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.28 2nqn n PRO 47 CO 0.00 0.00 0.00 -0.48 -0.04 0.00 0.00 175.50 174.98 2nqn s LEU 48 N -2.90 1.13 0.31 1.53 0.05 -1.26 -4.82 118.68 112.72 2nqn s LEU 48 Ca 0.16 -1.13 -0.18 0.00 0.05 0.00 0.00 54.13 53.03 2nqn s LEU 48 Cb 0.19 0.79 -0.09 0.00 -2.05 0.00 0.00 46.19 45.03 2nqn s LEU 48 CO 0.56 -0.87 0.77 -1.81 -0.55 0.00 0.00 176.35 174.46 2nqn s ASP 49 N -3.06 6.91 -0.23 1.48 1.01 -1.26 -3.21 116.67 118.31 2nqn s ASP 49 Ca 0.27 1.41 -0.03 0.00 0.71 0.00 0.00 52.55 54.90 2nqn s ASP 49 Cb 0.05 -2.42 0.10 0.00 1.01 0.00 0.00 42.92 41.66 2nqn s ASP 49 CO 0.06 -0.15 0.20 -0.69 0.21 0.00 0.00 175.17 174.79 2nqn s VAL 50 N -1.86 -0.26 0.62 -1.27 1.01 0.98 -3.69 120.40 115.94 2nqn s VAL 50 Ca 0.52 -0.31 -0.13 0.00 0.00 0.00 0.00 61.98 62.06 2nqn s VAL 50 Cb -0.12 -0.77 -0.03 0.00 0.00 0.00 0.00 36.38 35.45 2nqn s VAL 50 CO 0.18 -0.36 1.03 -2.16 0.00 0.00 0.00 175.10 173.79 2nqn s PRO 51 N 2.26 3.44 0.00 2.72 0.04 -1.26 0.43 135.00 142.63 2nqn s PRO 51 Ca 0.07 0.92 0.16 0.00 0.04 0.00 0.00 61.00 62.19 2nqn s PRO 51 Cb -0.15 -2.06 0.98 0.00 0.04 0.00 0.00 34.50 33.31 2nqn s PRO 51 CO -0.20 -0.70 1.58 0.41 0.04 0.00 0.00 177.00 178.13 2nqn n GLY 52 N -2.02 -0.93 3.60 0.56 0.00 -1.24 -1.34 105.19 103.81 2nqn n GLY 52 Ca 0.07 -0.10 -0.07 0.00 0.00 0.00 0.00 46.02 45.92 2nqn n GLY 52 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2nqn s PHE 53 N -2.00 -0.27 0.24 1.61 -0.12 -1.26 -4.88 117.98 111.30 2nqn s PHE 53 Ca 0.25 0.07 -0.30 0.00 -0.05 0.00 0.00 56.93 56.89 2nqn s PHE 53 Cb 0.11 0.58 -0.10 0.00 -0.63 0.00 0.00 43.02 42.98 2nqn s PHE 53 CO 0.19 -0.66 1.43 -0.51 -0.05 0.00 0.00 175.22 175.61 2nqn s ASP 54 N -2.67 6.68 0.12 1.98 -0.00 -1.25 -3.69 116.67 117.83 2nqn s ASP 54 Ca 0.08 2.63 -0.04 0.00 -0.00 0.00 0.00 52.55 55.21 2nqn s ASP 54 Cb -0.01 -2.62 -0.03 0.00 -0.00 0.00 0.00 42.92 40.26 2nqn s ASP 54 CO -0.05 -0.68 0.12 0.54 -0.00 0.00 0.00 175.17 175.10 2nqn s ASN 55 N 0.39 0.24 0.23 0.27 4.22 0.71 -2.37 114.94 118.63 2nqn s ASN 55 Ca 0.59 -0.99 -0.30 0.00 -2.14 0.00 0.00 52.86 50.03 2nqn s ASN 55 Cb -0.41 0.32 -0.09 0.00 1.28 0.00 0.00 41.25 42.35 2nqn s ASN 55 CO 0.42 -0.75 1.21 -0.55 -2.04 0.00 0.00 177.10 175.40 2nqn s SER 56 N -2.97 7.05 0.00 3.54 0.15 0.86 0.31 113.70 122.64 2nqn s SER 56 Ca 0.16 2.33 0.27 0.00 0.70 0.00 0.00 55.95 59.41 2nqn s SER 56 Cb 0.06 -2.62 1.61 0.00 -1.71 0.00 0.00 66.02 63.36 2nqn s SER 56 CO -0.03 -0.38 2.03 0.00 1.20 0.00 0.00 173.24 176.06 2nqn n ALA 57 N 2.05 2.65 0.00 5.45 0.00 0.17 -0.16 120.51 130.66 2nqn n ALA 57 Ca 0.03 -0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.30 2nqn n ALA 57 Cb 0.44 -1.44 0.00 0.00 0.00 0.00 0.00 19.45 18.45 2nqn n ALA 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2nqn n MET 58 N -0.93 -0.06 -2.19 0.00 0.00 -1.26 -4.91 117.12 107.77 2nqn n MET 58 Ca 0.20 0.00 -0.40 0.00 0.00 0.00 0.00 57.70 57.51 2nqn n MET 58 Cb 0.09 0.00 -0.02 0.00 0.00 0.00 0.00 33.22 33.29 2nqn n MET 58 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 175.97 175.46 2nqn s ASP 59 N 0.00 6.62 0.00 3.17 -0.00 -1.26 -3.31 116.67 121.89 2nqn s ASP 59 Ca 0.00 2.53 0.00 0.00 -0.00 0.00 0.00 52.55 55.08 2nqn s ASP 59 Cb 0.00 -2.63 0.00 0.00 -0.00 0.00 0.00 42.92 40.29 2nqn s ASP 59 CO 0.00 -0.62 0.00 0.61 -0.00 0.00 0.00 175.17 175.16 2nqn n GLY 60 N 0.76 -0.66 2.92 0.21 0.00 -0.10 -2.42 105.19 105.90 2nqn n GLY 60 Ca 0.02 -0.20 -0.12 0.00 0.00 0.00 0.00 46.02 45.73 2nqn n GLY 60 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2nqn s TYR 61 N -3.11 0.16 -0.02 1.61 1.51 0.47 -1.47 117.35 116.49 2nqn s TYR 61 Ca 0.00 -0.17 -0.19 0.00 -1.01 0.00 0.00 57.07 55.70 2nqn s TYR 61 Cb 0.00 -0.10 -0.05 0.00 -0.11 0.00 0.00 41.96 41.69 2nqn s TYR 61 CO 0.00 -0.05 0.53 0.00 -1.11 0.00 0.00 175.55 174.92 2nqn s ALA 62 N -0.45 3.53 0.22 3.71 0.00 0.22 0.00 121.76 128.99 2nqn s ALA 62 Ca -0.04 -0.06 -0.01 0.00 0.00 0.00 0.00 51.96 51.85 2nqn s ALA 62 Cb -0.03 -2.65 0.00 0.00 0.00 0.00 0.00 23.12 20.44 2nqn s ALA 62 CO -0.00 0.22 0.30 1.33 0.00 0.00 0.00 175.76 177.60 2nqn n VAL 63 N 2.63 0.00 -4.00 0.00 0.24 -0.47 -1.21 118.33 115.52 2nqn n VAL 63 Ca -0.09 -1.16 -0.14 0.00 -2.04 0.00 0.00 64.34 60.91 2nqn n VAL 63 Cb 0.51 0.70 -0.14 0.00 -1.47 0.00 0.00 33.84 33.44 2nqn n VAL 63 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 2nqn s ARG 64 N -2.53 0.20 0.29 7.34 0.52 -1.26 -1.29 118.95 122.20 2nqn s ARG 64 Ca 0.19 -0.11 -0.05 0.00 -0.52 0.00 0.00 55.73 55.25 2nqn s ARG 64 Cb -0.00 -0.18 0.55 0.00 0.52 0.00 0.00 34.95 35.84 2nqn s ARG 64 CO 0.14 0.05 1.57 1.25 0.02 0.00 0.00 175.30 178.32 2nqn h LEU 65 N 6.03 -0.73 0.00 2.53 7.12 -1.95 -2.69 115.31 125.62 2nqn h LEU 65 Ca -0.26 0.28 0.00 0.00 0.13 0.00 0.00 57.88 58.03 2nqn h LEU 65 Cb 1.20 0.55 0.00 0.00 -0.53 0.00 0.00 40.66 41.88 2nqn h LEU 65 CO 0.50 -0.33 0.00 0.00 -0.13 0.00 0.00 178.44 178.49 2nqn n ALA 66 N -3.40 0.00 0.29 1.25 0.00 -1.26 0.12 120.51 117.52 2nqn n ALA 66 Ca 0.18 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.74 2nqn n ALA 66 Cb 0.58 0.22 0.65 0.00 0.00 0.00 0.00 19.45 20.90 2nqn n ALA 66 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2nqn h ASP 67 N 0.00 0.00 0.44 0.00 5.19 -1.78 0.18 116.42 120.44 2nqn h ASP 67 Ca 0.00 0.00 -0.20 0.00 -0.62 0.00 0.00 57.03 56.21 2nqn h ASP 67 Cb 0.00 0.00 -0.04 0.00 0.18 0.00 0.00 39.33 39.47 2nqn h ASP 67 CO 0.00 0.00 -1.73 0.00 -3.12 0.00 0.00 179.24 174.39 2nqn n ILE 68 N -2.65 1.12 0.20 0.35 0.13 0.83 -4.02 119.36 115.31 2nqn n ILE 68 Ca -0.02 -0.71 0.05 0.00 -1.10 0.00 0.00 62.75 60.97 2nqn n ILE 68 Cb 0.40 -0.61 0.43 0.00 -0.84 0.00 0.00 39.64 39.02 2nqn n ILE 68 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 2nqn h ALA 69 N 1.37 1.36 -0.42 1.51 0.00 0.41 -2.83 119.26 120.66 2nqn h ALA 69 Ca -0.24 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 54.38 2nqn h ALA 69 Cb 1.69 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 19.41 2nqn h ALA 69 CO 0.04 0.39 0.24 0.66 0.00 0.00 0.00 179.25 180.58 2nqn h SER 70 N 0.00 0.51 0.00 0.00 4.64 -1.66 -3.47 113.55 113.58 2nqn h SER 70 Ca -0.00 -0.07 0.00 0.00 -0.47 0.00 0.00 61.79 61.25 2nqn h SER 70 Cb 0.60 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 62.56 2nqn h SER 70 CO 0.04 0.43 0.00 0.61 -0.87 0.00 0.00 176.83 177.04 2nqn n GLY 71 N -1.05 0.74 3.67 -0.77 0.00 -1.07 -5.08 105.19 101.64 2nqn n GLY 71 Ca 0.01 -0.56 -0.24 0.00 0.00 0.00 0.00 46.02 45.22 2nqn n GLY 71 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2nqn s GLN 72 N -1.29 2.40 -0.15 1.61 -0.44 -1.26 -5.04 119.66 115.49 2nqn s GLN 72 Ca 0.00 -1.29 -0.29 0.00 -2.50 0.00 0.00 55.36 51.28 2nqn s GLN 72 Cb 0.00 -2.26 -0.02 0.00 -1.64 0.00 0.00 33.01 29.09 2nqn s GLN 72 CO 0.00 0.39 1.27 -1.25 0.50 0.00 0.00 175.29 176.20 2nqn s PRO 73 N -3.51 4.24 -0.11 1.67 0.04 -1.26 -4.81 135.00 131.26 2nqn s PRO 73 Ca 0.30 1.68 -0.17 0.00 0.04 0.00 0.00 61.00 62.86 2nqn s PRO 73 Cb -0.07 -3.75 -0.04 0.00 0.04 0.00 0.00 34.50 30.67 2nqn s PRO 73 CO 0.20 -0.68 0.45 -0.51 0.04 0.00 0.00 177.00 176.49 2nqn s LEU 74 N 3.38 4.29 0.24 -3.56 1.43 0.01 -4.25 118.68 120.23 2nqn s LEU 74 Ca 0.56 0.79 -0.24 0.00 -1.03 0.00 0.00 54.13 54.20 2nqn s LEU 74 Cb -0.22 -2.64 -0.09 0.00 0.03 0.00 0.00 46.19 43.26 2nqn s LEU 74 CO 0.16 0.05 0.84 -2.16 0.23 0.00 0.00 176.35 175.46 2nqn s PRO 75 N 0.43 4.51 -0.38 1.29 0.04 -1.26 0.98 135.00 140.61 2nqn s PRO 75 Ca 0.24 1.17 -0.27 0.00 0.04 0.00 0.00 61.00 62.18 2nqn s PRO 75 Cb -0.15 -3.00 -0.04 0.00 0.04 0.00 0.00 34.50 31.36 2nqn s PRO 75 CO 0.10 0.42 2.04 0.08 0.04 0.00 0.00 177.00 179.67 2nqn s VAL 76 N -1.42 3.24 0.01 -0.36 1.01 -1.26 -2.99 120.40 118.63 2nqn s VAL 76 Ca 0.43 0.22 0.04 0.00 0.00 0.00 0.00 61.98 62.67 2nqn s VAL 76 Cb -0.20 -3.41 -0.25 0.00 0.00 0.00 0.00 36.38 32.52 2nqn s VAL 76 CO 0.24 -0.32 0.85 0.00 0.00 0.00 0.00 175.10 175.88 2nqn h ALA 77 N 15.15 0.47 -3.11 5.51 0.00 -1.66 -3.49 119.26 132.13 2nqn h ALA 77 Ca -0.32 -1.20 -0.10 0.00 0.00 0.00 0.00 54.91 53.29 2nqn h ALA 77 Cb 1.20 0.28 -0.02 0.00 0.00 0.00 0.00 17.79 19.26 2nqn h ALA 77 CO 1.07 1.33 0.08 0.41 0.00 0.00 0.00 179.25 182.14 2nqn n GLY 78 N 1.58 1.69 3.03 0.00 0.00 -1.26 -5.04 105.19 105.19 2nqn n GLY 78 Ca -0.14 -1.34 -0.13 0.00 0.00 0.00 0.00 46.02 44.42 2nqn n GLY 78 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2nqn s LYS 79 N -2.28 0.18 -0.16 1.61 -2.85 -1.25 0.12 119.74 115.11 2nqn s LYS 79 Ca 0.16 0.31 -0.01 0.00 -1.00 0.00 0.00 55.97 55.43 2nqn s LYS 79 Cb -0.02 0.01 -0.00 0.00 -2.06 0.00 0.00 37.83 35.75 2nqn s LYS 79 CO 0.12 -0.07 -0.13 0.45 0.10 0.00 0.00 175.35 175.82 2nqn s SER 80 N 0.47 3.85 0.50 0.03 0.15 -0.17 -4.10 113.70 114.42 2nqn s SER 80 Ca -0.03 -0.43 0.04 0.00 0.70 0.00 0.00 55.95 56.23 2nqn s SER 80 Cb -0.05 -1.61 -0.01 0.00 -1.71 0.00 0.00 66.02 62.65 2nqn s SER 80 CO -0.02 0.08 0.19 -0.36 1.20 0.00 0.00 173.24 174.33 2nqn s PHE 81 N 0.86 1.98 0.00 3.44 2.99 0.21 -1.56 117.98 125.90 2nqn s PHE 81 Ca -0.04 -0.82 0.00 0.00 0.00 0.00 0.00 56.93 56.08 2nqn s PHE 81 Cb -0.15 -1.81 0.00 0.00 0.00 0.00 0.00 43.02 41.06 2nqn s PHE 81 CO -0.00 -0.04 0.39 0.00 -0.00 0.00 0.00 175.22 175.58 2nqn n ALA 82 N -1.43 0.00 -1.05 5.36 0.00 -1.26 -2.20 120.51 119.92 2nqn n ALA 82 Ca -0.08 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.46 2nqn n ALA 82 Cb 0.65 0.20 0.15 0.00 0.00 0.00 0.00 19.45 20.45 2nqn n ALA 82 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2nqn n GLY 83 N -0.94 4.82 2.87 0.00 0.00 -1.26 -4.45 105.19 106.23 2nqn n GLY 83 Ca 0.00 -1.12 -0.28 0.00 0.00 0.00 0.00 46.02 44.62 2nqn n GLY 83 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2nqn s GLN 84 N -2.86 2.33 1.09 1.61 -0.21 -0.93 -5.11 119.66 115.59 2nqn s GLN 84 Ca 0.32 -3.21 -0.12 0.00 0.02 0.00 0.00 55.36 52.37 2nqn s GLN 84 Cb 0.28 -3.30 0.24 0.00 1.00 0.00 0.00 33.01 31.24 2nqn s GLN 84 CO 0.03 -1.28 1.06 -1.25 -2.12 0.00 0.00 175.29 171.73 2nqn s PRO 85 N -1.27 -0.35 -0.17 2.91 0.04 -1.26 -0.62 135.00 134.28 2nqn s PRO 85 Ca 0.25 0.83 0.01 0.00 0.04 0.00 0.00 61.00 62.12 2nqn s PRO 85 Cb -0.06 -1.62 0.01 0.00 0.04 0.00 0.00 34.50 32.87 2nqn s PRO 85 CO -0.15 -3.34 -0.19 -0.47 0.04 0.00 0.00 177.00 172.89 2nqn s TYR 86 N -2.61 2.77 0.11 0.56 5.04 -1.26 -4.78 117.35 117.18 2nqn s TYR 86 Ca 0.67 -1.48 0.03 0.00 -2.44 0.00 0.00 57.07 53.85 2nqn s TYR 86 Cb -0.23 -1.91 -0.04 0.00 0.35 0.00 0.00 41.96 40.13 2nqn s TYR 86 CO 0.62 -0.72 -0.09 -3.38 -1.34 0.00 0.00 175.55 170.64 2nqn s HIS 87 N 1.17 1.06 0.00 4.97 -3.43 -1.26 -4.75 115.29 113.05 2nqn s HIS 87 Ca 0.02 -0.77 0.00 0.00 -0.80 0.00 0.00 55.06 53.51 2nqn s HIS 87 Cb -0.14 -0.57 0.00 0.00 -1.43 0.00 0.00 32.58 30.44 2nqn s HIS 87 CO -0.09 -0.03 0.00 0.41 -2.00 0.00 0.00 174.74 173.03 2nqn n GLY 88 N 0.15 0.23 3.82 -1.38 0.00 -1.26 -5.04 105.19 101.71 2nqn n GLY 88 Ca -0.13 -1.37 -0.36 0.00 0.00 0.00 0.00 46.02 44.15 2nqn n GLY 88 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2nqn s GLU 89 N 0.00 3.60 -0.56 1.61 -1.05 -1.26 -5.06 118.70 115.98 2nqn s GLU 89 Ca 0.00 -0.18 0.04 0.00 -0.15 0.00 0.00 54.97 54.68 2nqn s GLU 89 Cb 0.00 -3.21 0.15 0.00 -0.44 0.00 0.00 34.13 30.63 2nqn s GLU 89 CO 0.00 0.64 0.36 -0.46 0.95 0.00 0.00 175.26 176.76 2nqn s TRP 90 N -0.65 2.78 -0.12 4.83 -0.00 -1.26 -4.98 118.94 119.54 2nqn s TRP 90 Ca 0.13 -2.96 -0.21 0.00 -0.00 0.00 0.00 56.10 53.06 2nqn s TRP 90 Cb -0.12 -2.30 -0.10 0.00 -0.00 0.00 0.00 33.47 30.96 2nqn s TRP 90 CO 0.02 -0.68 0.64 -2.30 -0.00 0.00 0.00 176.95 174.63 2nqn n PRO 91 N 2.69 0.00 0.00 5.86 -0.02 -1.26 -4.63 135.00 137.63 2nqn n PRO 91 Ca 0.15 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.63 2nqn n PRO 91 Cb 0.36 -0.71 0.00 0.00 -0.02 0.00 0.00 33.50 33.13 2nqn n PRO 91 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2nqn n ALA 92 N 1.33 1.08 -0.87 3.55 0.00 -1.26 -1.40 120.51 122.94 2nqn n ALA 92 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.56 2nqn n ALA 92 Cb 0.00 -0.73 0.00 0.00 0.00 0.00 0.00 19.45 18.72 2nqn n ALA 92 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2nqn n GLY 93 N -0.33 -1.48 0.80 0.00 0.00 -1.26 -4.77 105.19 98.16 2nqn n GLY 93 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.96 2nqn n GLY 93 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2nqn n THR 94 N -0.05 0.00 -4.18 2.61 -2.24 -0.49 -4.44 114.28 105.49 2nqn n THR 94 Ca 0.00 -0.48 -0.11 0.00 -2.27 0.00 0.00 64.05 61.19 2nqn n THR 94 Cb 0.40 -0.26 -0.10 0.00 -2.10 0.00 0.00 70.33 68.27 2nqn n THR 94 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2nqn s ILE 96 N -3.76 2.87 0.40 0.00 -1.09 -0.35 -1.52 121.20 117.75 2nqn s ILE 96 Ca 0.17 -0.76 -0.25 0.00 -2.23 0.00 0.00 60.65 57.59 2nqn s ILE 96 Cb 0.06 -2.15 -0.08 0.00 -1.58 0.00 0.00 42.46 38.71 2nqn s ILE 96 CO -0.02 0.56 1.14 -0.60 -1.23 0.00 0.00 174.94 174.79 2nqn s ARG 97 N -0.15 4.06 -0.06 2.79 6.06 0.33 0.69 118.95 132.67 2nqn s ARG 97 Ca -0.01 1.76 -0.17 0.00 -2.50 0.00 0.00 55.73 54.80 2nqn s ARG 97 Cb -0.14 -2.63 0.03 0.00 0.06 0.00 0.00 34.95 32.28 2nqn s ARG 97 CO 0.03 -0.29 0.39 -1.50 -2.50 0.00 0.00 175.30 171.44 2nqn s ILE 98 N -1.47 0.03 0.01 4.11 2.07 -0.54 -1.00 121.20 124.41 2nqn s ILE 98 Ca 0.57 -0.28 0.05 0.00 -1.41 0.00 0.00 60.65 59.58 2nqn s ILE 98 Cb -0.29 -0.66 -0.03 0.00 0.13 0.00 0.00 42.46 41.61 2nqn s ILE 98 CO 0.36 -0.15 -0.11 -0.04 -1.91 0.00 0.00 174.94 173.08 2nqn s MET 99 N -0.90 2.39 -0.46 3.50 -1.94 -0.60 -0.93 119.30 120.37 2nqn s MET 99 Ca -0.10 -0.80 -0.44 0.00 -1.71 0.00 0.00 55.69 52.64 2nqn s MET 99 Cb -0.04 -2.38 -0.18 0.00 2.01 0.00 0.00 34.83 34.24 2nqn s MET 99 CO 0.04 0.58 1.89 1.87 -0.01 0.00 0.00 175.02 179.40 2nqn n TRP 100 N 1.65 1.55 0.00 -0.03 -0.00 -1.21 0.54 117.44 119.94 2nqn n TRP 100 Ca -0.16 0.83 0.00 0.00 -0.00 0.00 0.00 57.50 58.17 2nqn n TRP 100 Cb 0.52 -2.32 0.00 0.00 -0.00 0.00 0.00 31.31 29.52 2nqn n TRP 100 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 2nqn n GLY 101 N 5.68 0.23 3.79 5.87 0.00 0.77 -4.81 105.19 116.72 2nqn n GLY 101 Ca 0.41 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 46.08 2nqn n GLY 101 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2nqn s ALA 102 N -2.07 3.13 -0.09 4.61 0.00 0.19 -4.60 121.76 122.93 2nqn s ALA 102 Ca 0.00 0.50 -0.29 0.00 0.00 0.00 0.00 51.96 52.17 2nqn s ALA 102 Cb 0.00 -3.18 -0.05 0.00 0.00 0.00 0.00 23.12 19.88 2nqn s ALA 102 CO 0.00 0.11 1.74 -1.25 0.00 0.00 0.00 175.76 176.36 2nqn s PRO 103 N -2.51 4.00 0.57 0.00 0.04 -1.26 -0.10 135.00 135.74 2nqn s PRO 103 Ca 0.55 2.13 -0.21 0.00 0.04 0.00 0.00 61.00 63.51 2nqn s PRO 103 Cb -0.16 -4.06 -0.04 0.00 0.04 0.00 0.00 34.50 30.29 2nqn s PRO 103 CO 0.20 -1.07 1.32 0.14 0.04 0.00 0.00 177.00 177.64 2nqn s VAL 104 N 4.71 2.16 0.54 -0.36 -7.23 -1.00 -4.63 120.40 114.59 2nqn s VAL 104 Ca 0.78 0.11 -0.15 0.00 -1.81 0.00 0.00 61.98 60.91 2nqn s VAL 104 Cb -0.33 -3.05 -0.07 0.00 0.56 0.00 0.00 36.38 33.49 2nqn s VAL 104 CO 0.32 -0.01 0.99 -2.16 -0.31 0.00 0.00 175.10 173.93 2nqn s PRO 105 N -3.03 3.84 0.26 4.82 0.04 -1.26 -4.96 135.00 134.72 2nqn s PRO 105 Ca 0.74 0.88 -0.30 0.00 0.04 0.00 0.00 61.00 62.36 2nqn s PRO 105 Cb -0.38 -2.13 -0.14 0.00 0.04 0.00 0.00 34.50 31.89 2nqn s PRO 105 CO 0.44 -0.34 1.26 -1.91 0.04 0.00 0.00 177.00 176.49 2nqn n GLU 106 N -1.90 1.76 -1.04 4.56 0.00 -1.26 -1.39 120.64 121.38 2nqn n GLU 106 Ca 0.06 0.62 -0.01 0.00 0.00 0.00 0.00 57.16 57.83 2nqn n GLU 106 Cb 0.54 -2.18 -0.01 0.00 0.00 0.00 0.00 31.44 29.80 2nqn n GLU 106 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2nqn n GLY 107 N 1.65 0.50 3.69 8.31 0.00 -1.26 -5.00 105.19 113.09 2nqn n GLY 107 Ca 0.10 -0.34 -0.42 0.00 0.00 0.00 0.00 46.02 45.36 2nqn n GLY 107 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2nqn n GLU 109 N 4.94 0.66 -3.46 0.00 4.71 -0.41 -4.98 120.64 122.10 2nqn n GLU 109 Ca 0.09 0.11 -0.12 0.00 -0.01 0.00 0.00 57.16 57.22 2nqn n GLU 109 Cb 0.49 -1.64 -0.03 0.00 -1.01 0.00 0.00 31.44 29.26 2nqn n GLU 109 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2nqn s ALA 110 N -2.60 -1.68 -0.02 0.62 0.00 -1.10 0.68 121.76 117.66 2nqn s ALA 110 Ca -0.08 0.74 0.04 0.00 0.00 0.00 0.00 51.96 52.67 2nqn s ALA 110 Cb 0.07 0.63 -0.03 0.00 0.00 0.00 0.00 23.12 23.79 2nqn s ALA 110 CO 0.83 -0.69 -0.13 0.08 0.00 0.00 0.00 175.76 175.84 2nqn s VAL 111 N -3.24 3.13 -0.13 0.00 1.01 0.11 -1.37 120.40 119.92 2nqn s VAL 111 Ca 0.01 -0.84 0.02 0.00 0.00 0.00 0.00 61.98 61.17 2nqn s VAL 111 Cb -0.01 -2.28 0.01 0.00 0.00 0.00 0.00 36.38 34.11 2nqn s VAL 111 CO -0.09 0.49 -0.19 -0.69 0.00 0.00 0.00 175.10 174.62 2nqn s VAL 112 N -0.83 1.81 0.19 2.92 1.01 0.10 -4.45 120.40 121.14 2nqn s VAL 112 Ca 0.13 -0.82 -0.33 0.00 0.00 0.00 0.00 61.98 60.96 2nqn s VAL 112 Cb -0.11 -1.62 -0.13 0.00 0.00 0.00 0.00 36.38 34.51 2nqn s VAL 112 CO 0.03 0.50 1.58 1.15 0.00 0.00 0.00 175.10 178.36 2nqn n MET 113 N 4.22 2.27 0.24 2.72 0.00 -1.26 -0.40 117.12 124.92 2nqn n MET 113 Ca -0.19 0.82 0.09 0.00 0.00 0.00 0.00 57.70 58.42 2nqn n MET 113 Cb 0.51 -2.58 0.50 0.00 0.00 0.00 0.00 33.22 31.65 2nqn n MET 113 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 175.97 176.34 2nqn h GLN 114 N 5.75 0.00 0.00 3.17 -0.00 -1.78 0.86 115.11 123.11 2nqn h GLN 114 Ca -0.45 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.20 2nqn h GLN 114 Cb 1.25 0.00 0.00 0.00 0.00 0.00 0.00 27.48 28.73 2nqn h GLN 114 CO 0.87 0.00 0.00 0.39 0.00 0.00 0.00 178.83 180.09 2nqn n GLU 115 N -2.40 0.26 -1.06 1.69 4.71 -1.26 -3.15 120.64 119.42 2nqn n GLU 115 Ca -0.01 0.23 -0.16 0.00 -0.01 0.00 0.00 57.16 57.22 2nqn n GLU 115 Cb 0.41 -1.81 0.18 0.00 -1.01 0.00 0.00 31.44 29.21 2nqn n GLU 115 CO 0.00 0.00 0.00 1.04 0.09 0.00 0.00 177.13 178.26 2nqn n GLN 116 N -2.27 2.10 -3.80 3.49 6.02 0.30 -4.91 117.38 118.31 2nqn n GLN 116 Ca 0.05 -3.14 -0.13 0.00 -0.01 0.00 0.00 57.00 53.78 2nqn n GLN 116 Cb 0.41 -2.02 -0.13 0.00 1.02 0.00 0.00 30.24 29.53 2nqn n GLN 116 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 2nqn s THR 117 N -3.37 -0.01 -0.19 5.09 -4.23 -1.19 0.13 115.64 111.88 2nqn s THR 117 Ca 0.52 0.04 0.00 0.00 -1.18 0.00 0.00 61.69 61.07 2nqn s THR 117 Cb 0.45 -0.25 0.02 0.00 1.34 0.00 0.00 72.50 74.05 2nqn s THR 117 CO 0.05 0.02 -0.18 -0.70 -0.54 0.00 0.00 174.62 173.27 2nqn s GLU 118 N 0.33 3.04 0.08 3.99 2.56 -0.03 -4.94 118.70 123.73 2nqn s GLU 118 Ca -0.02 -0.80 -0.31 0.00 0.00 0.00 0.00 54.97 53.84 2nqn s GLU 118 Cb -0.03 -2.63 -0.09 0.00 2.00 0.00 0.00 34.13 33.37 2nqn s GLU 118 CO -0.01 -0.21 1.81 -0.65 -0.56 0.00 0.00 175.26 175.64 2nqn s GLN 119 N 1.31 4.15 -0.75 4.30 1.11 -1.26 -2.16 119.66 126.37 2nqn s GLN 119 Ca 0.05 2.52 0.03 0.00 0.01 0.00 0.00 55.36 57.97 2nqn s GLN 119 Cb -0.13 -3.73 0.29 0.00 -1.01 0.00 0.00 33.01 28.43 2nqn s GLN 119 CO -0.12 -0.84 1.05 -0.12 0.01 0.00 0.00 175.29 175.27 2nqn n MET 120 N 6.12 3.38 -1.42 2.91 1.56 -0.18 -4.95 117.12 124.54 2nqn n MET 120 Ca 0.18 -4.70 0.00 0.00 -0.27 0.00 0.00 57.70 52.90 2nqn n MET 120 Cb 0.39 -2.32 0.00 0.00 2.15 0.00 0.00 33.22 33.44 2nqn n MET 120 CO 0.00 0.00 0.00 -0.40 -0.73 0.00 0.00 175.97 174.84 2nqn n ASP 121 N 0.57 0.00 0.00 6.12 5.75 -1.26 -2.92 116.55 124.81 2nqn n ASP 121 Ca 0.31 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 55.09 2nqn n ASP 121 Cb 0.37 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.46 2nqn n ASP 121 CO 0.00 0.00 0.00 -0.46 -0.11 0.00 0.00 177.20 176.63 2nqn n ASN 122 N 0.20 0.00 0.00 -1.12 2.04 -1.26 -5.15 115.26 109.96 2nqn n ASN 122 Ca 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 54.58 54.14 2nqn n ASN 122 Cb 0.00 0.00 0.00 0.00 -2.53 0.00 0.00 39.78 37.25 2nqn n ASN 122 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 2nqn n GLY 123 N 0.00 -1.94 3.22 4.83 0.00 -1.15 -4.60 105.19 105.56 2nqn n GLY 123 Ca 0.00 -1.16 -0.32 0.00 0.00 0.00 0.00 46.02 44.53 2nqn n GLY 123 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2nqn s VAL 124 N -2.34 2.26 -0.16 1.61 1.01 0.28 -1.01 120.40 122.03 2nqn s VAL 124 Ca 0.00 -0.93 -0.12 0.00 0.00 0.00 0.00 61.98 60.94 2nqn s VAL 124 Cb 0.00 -1.90 -0.05 0.00 0.00 0.00 0.00 36.38 34.43 2nqn s VAL 124 CO 0.00 0.54 0.22 -0.60 0.00 0.00 0.00 175.10 175.26 2nqn s ARG 125 N 0.61 4.11 -0.49 2.72 3.52 -0.92 -0.81 118.95 127.70 2nqn s ARG 125 Ca -0.11 -0.03 -0.14 0.00 -0.13 0.00 0.00 55.73 55.31 2nqn s ARG 125 Cb -0.16 -3.38 0.09 0.00 -1.56 0.00 0.00 34.95 29.94 2nqn s ARG 125 CO 0.03 0.35 0.41 -0.06 -0.81 0.00 0.00 175.30 175.22 2nqn s PHE 126 N 0.15 3.27 0.00 5.12 0.40 -1.26 -0.86 117.98 124.81 2nqn s PHE 126 Ca 0.14 -1.17 0.00 0.00 -0.60 0.00 0.00 56.93 55.30 2nqn s PHE 126 Cb -0.12 -3.36 0.00 0.00 0.51 0.00 0.00 43.02 40.05 2nqn s PHE 126 CO 0.02 -0.88 0.00 2.41 0.70 0.00 0.00 175.22 177.47 2nqn n THR 127 N 5.16 0.00 -1.02 0.64 -1.04 0.12 -4.75 114.28 113.40 2nqn n THR 127 Ca -0.12 0.00 -0.35 0.00 -2.04 0.00 0.00 64.05 61.54 2nqn n THR 127 Cb 0.42 -0.57 0.08 0.00 -1.82 0.00 0.00 70.33 68.45 2nqn n THR 127 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2nqn n ALA 128 N -3.00 -3.01 -1.24 2.41 0.00 -1.26 -4.92 120.51 109.48 2nqn n ALA 128 Ca 0.00 -0.48 -0.31 0.00 0.00 0.00 0.00 53.44 52.66 2nqn n ALA 128 Cb 0.00 -1.63 0.10 0.00 0.00 0.00 0.00 19.45 17.93 2nqn n ALA 128 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 2nqn s GLU 129 N -2.79 2.02 -0.07 0.00 2.56 -1.26 -5.03 118.70 114.13 2nqn s GLU 129 Ca 0.55 1.09 0.02 0.00 0.00 0.00 0.00 54.97 56.63 2nqn s GLU 129 Cb -0.27 -1.88 -0.03 0.00 2.00 0.00 0.00 34.13 33.96 2nqn s GLU 129 CO 0.68 -1.79 -0.10 0.08 -0.56 0.00 0.00 175.26 173.57 2nqn s VAL 130 N -2.91 3.39 -0.35 3.70 1.01 -1.26 -5.09 120.40 118.89 2nqn s VAL 130 Ca 0.62 -0.59 -0.06 0.00 0.00 0.00 0.00 61.98 61.94 2nqn s VAL 130 Cb -0.17 -2.37 0.05 0.00 0.00 0.00 0.00 36.38 33.88 2nqn s VAL 130 CO 0.56 0.58 0.11 -0.60 0.00 0.00 0.00 175.10 175.76 2nqn s ARG 131 N -0.61 2.58 0.21 2.72 6.06 -1.26 -5.08 118.95 123.57 2nqn s ARG 131 Ca 0.09 -1.23 -0.20 0.00 -2.50 0.00 0.00 55.73 51.89 2nqn s ARG 131 Cb -0.11 -3.47 -0.13 0.00 0.06 0.00 0.00 34.95 31.29 2nqn s ARG 131 CO 0.01 -0.70 0.30 -1.13 -2.50 0.00 0.00 175.30 171.29 2nqn n SER 132 N 4.80 -1.39 0.00 -2.12 3.41 -1.26 -1.59 113.62 115.46 2nqn n SER 132 Ca -0.12 0.81 0.00 0.00 -0.26 0.00 0.00 58.87 59.30 2nqn n SER 132 Cb 0.44 -0.73 0.00 0.00 -0.26 0.00 0.00 64.21 63.66 2nqn n SER 132 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2nqn n GLY 133 N 1.66 2.94 3.74 5.00 0.00 0.21 -4.99 105.19 113.76 2nqn n GLY 133 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 2nqn n GLY 133 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2nqn s GLN 134 N -0.02 4.13 -1.62 1.61 -2.07 -0.62 -2.80 119.66 118.27 2nqn s GLN 134 Ca 0.00 2.58 0.00 0.00 -1.82 0.00 0.00 55.36 56.12 2nqn s GLN 134 Cb 0.00 -3.05 0.00 0.00 -1.09 0.00 0.00 33.01 28.87 2nqn s GLN 134 CO 0.00 -0.68 0.00 0.09 -1.32 0.00 0.00 175.29 173.38 2nqn n ASN 135 N 3.02 -4.91 -4.36 12.60 3.02 -1.26 -0.71 115.26 122.65 2nqn n ASN 135 Ca 0.12 0.27 -0.35 0.00 -0.03 0.00 0.00 54.58 54.59 2nqn n ASN 135 Cb 0.36 -3.90 -0.13 0.00 -0.61 0.00 0.00 39.78 35.50 2nqn n ASN 135 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2nqn s ILE 136 N -2.67 3.66 -0.38 2.41 1.01 -1.12 0.42 121.20 124.53 2nqn s ILE 136 Ca 0.00 -0.40 -0.15 0.00 0.00 0.00 0.00 60.65 60.10 2nqn s ILE 136 Cb 0.00 -2.67 0.00 0.00 0.01 0.00 0.00 42.46 39.80 2nqn s ILE 136 CO 0.00 0.40 0.36 -0.13 0.00 0.00 0.00 174.94 175.57 2nqn s ARG 137 N 1.45 3.29 0.35 2.79 0.52 0.15 -4.92 118.95 122.58 2nqn s ARG 137 Ca 0.05 -0.68 -0.25 0.00 -0.52 0.00 0.00 55.73 54.33 2nqn s ARG 137 Cb -0.14 -3.89 -0.09 0.00 0.52 0.00 0.00 34.95 31.34 2nqn s ARG 137 CO -0.01 -0.66 1.01 1.03 0.02 0.00 0.00 175.30 176.69 2nqn s ARG 138 N 1.94 4.39 0.57 3.54 1.81 -1.26 -0.20 118.95 129.74 2nqn s ARG 138 Ca 0.10 1.47 -0.19 0.00 -1.72 0.00 0.00 55.73 55.38 2nqn s ARG 138 Cb -0.17 -2.72 -0.06 0.00 -0.45 0.00 0.00 34.95 31.55 2nqn s ARG 138 CO 0.12 0.08 0.96 2.89 -0.68 0.00 0.00 175.30 178.66 2nqn n ARG 139 N 0.33 0.97 -0.73 3.54 1.85 -1.24 -0.42 116.66 120.95 2nqn n ARG 139 Ca 0.03 0.37 0.00 0.00 -1.00 0.00 0.00 57.85 57.25 2nqn n ARG 139 Cb 0.49 -2.13 0.00 0.00 -1.05 0.00 0.00 32.46 29.77 2nqn n ARG 139 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2nqn n GLY 140 N 1.28 0.38 0.14 2.89 0.00 -0.45 -4.80 105.19 104.63 2nqn n GLY 140 Ca 0.13 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.04 2nqn n GLY 140 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2nqn h GLU 141 N 1.13 0.38 0.23 1.61 4.81 -0.89 -3.27 114.58 118.58 2nqn h GLU 141 Ca 0.00 -0.08 -0.01 0.00 -0.13 0.00 0.00 59.36 59.14 2nqn h GLU 141 Cb 0.06 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.39 2nqn h GLU 141 CO 0.00 0.44 -0.11 -0.44 -0.73 0.00 0.00 179.01 178.17 2nqn h ASP 142 N 0.25 -0.26 -3.58 1.04 3.32 -1.51 -3.46 116.42 112.21 2nqn h ASP 142 Ca 0.08 0.01 -0.30 0.00 0.02 0.00 0.00 57.03 56.84 2nqn h ASP 142 Cb 0.21 0.07 -0.32 0.00 0.22 0.00 0.00 39.33 39.50 2nqn h ASP 142 CO -0.00 0.13 -0.73 -0.63 -1.72 0.00 0.00 179.24 176.28 2nqn s ILE 143 N -2.53 0.04 -0.11 0.35 1.01 0.17 -4.99 121.20 115.13 2nqn s ILE 143 Ca -0.04 0.11 -0.04 0.00 0.00 0.00 0.00 60.65 60.68 2nqn s ILE 143 Cb 0.00 -0.13 -0.04 0.00 0.01 0.00 0.00 42.46 42.31 2nqn s ILE 143 CO 0.13 0.08 0.05 -0.94 0.00 0.00 0.00 174.94 174.27 2nqn s SER 144 N 0.76 5.65 0.52 3.58 1.04 -1.23 -0.01 113.70 124.00 2nqn s SER 144 Ca -0.07 0.24 -0.21 0.00 0.48 0.00 0.00 55.95 56.39 2nqn s SER 144 Cb -0.10 -1.72 -0.07 0.00 0.10 0.00 0.00 66.02 64.24 2nqn s SER 144 CO -0.02 0.37 1.11 0.00 0.98 0.00 0.00 173.24 175.68 2nqn n ALA 145 N 2.23 0.65 -0.06 5.32 0.00 -1.20 -1.49 120.51 125.98 2nqn n ALA 145 Ca -0.19 0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.37 2nqn n ALA 145 Cb 0.54 -2.18 0.00 0.00 0.00 0.00 0.00 19.45 17.81 2nqn n ALA 145 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2nqn n GLY 146 N 1.08 2.29 3.86 0.00 0.00 0.17 -4.98 105.19 107.60 2nqn n GLY 146 Ca 0.11 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.81 2nqn n GLY 146 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2nqn s ALA 147 N -2.85 3.26 -0.27 4.61 0.00 -0.55 -4.79 121.76 121.16 2nqn s ALA 147 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 51.96 51.73 2nqn s ALA 147 Cb 0.00 -2.84 -0.00 0.00 0.00 0.00 0.00 23.12 20.28 2nqn s ALA 147 CO 0.00 0.08 0.80 0.08 0.00 0.00 0.00 175.76 176.72 2nqn s VAL 148 N -2.27 4.82 -0.18 0.00 1.01 -1.26 -0.43 120.40 122.09 2nqn s VAL 148 Ca 0.55 1.37 -0.18 0.00 0.00 0.00 0.00 61.98 63.71 2nqn s VAL 148 Cb -0.10 -4.12 -0.22 0.00 0.00 0.00 0.00 36.38 31.94 2nqn s VAL 148 CO 0.25 -0.15 0.29 0.58 0.00 0.00 0.00 175.10 176.07 2nqn h VAL 149 N 5.51 0.89 -3.42 2.92 2.07 -0.79 -3.47 116.25 119.95 2nqn h VAL 149 Ca -0.24 -2.24 -0.42 0.00 0.82 0.00 0.00 66.70 64.63 2nqn h VAL 149 Cb 1.10 2.36 -0.35 0.00 -1.52 0.00 0.00 31.29 32.88 2nqn h VAL 149 CO 0.87 0.48 -0.77 -0.36 0.02 0.00 0.00 177.57 177.81 2nqn s PHE 150 N -2.41 0.77 0.62 1.57 0.40 -1.19 -5.00 117.98 112.74 2nqn s PHE 150 Ca -0.26 -0.22 -0.13 0.00 -0.60 0.00 0.00 56.93 55.71 2nqn s PHE 150 Cb 0.06 -0.70 -0.03 0.00 0.51 0.00 0.00 43.02 42.85 2nqn s PHE 150 CO 0.65 -0.22 1.04 -1.25 0.70 0.00 0.00 175.22 176.14 2nqn s PRO 151 N 1.08 3.36 0.51 0.24 0.04 -1.26 -0.15 135.00 138.82 2nqn s PRO 151 Ca -0.09 0.97 -0.23 0.00 0.04 0.00 0.00 61.00 61.69 2nqn s PRO 151 Cb -0.14 -2.05 -0.06 0.00 0.04 0.00 0.00 34.50 32.29 2nqn s PRO 151 CO -0.01 -0.76 1.34 0.00 0.04 0.00 0.00 177.00 177.61 2nqn s ALA 152 N -2.86 2.94 0.00 8.56 0.00 -1.26 -2.50 121.76 126.65 2nqn s ALA 152 Ca 0.59 1.29 0.00 0.00 0.00 0.00 0.00 51.96 53.84 2nqn s ALA 152 Cb -0.13 -3.54 0.00 0.00 0.00 0.00 0.00 23.12 19.45 2nqn s ALA 152 CO 0.46 -1.21 0.00 0.41 0.00 0.00 0.00 175.76 175.42 2nqn n GLY 153 N 0.66 0.63 3.71 0.00 0.00 0.49 -4.87 105.19 105.81 2nqn n GLY 153 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 2nqn n GLY 153 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2nqn s THR 154 N -2.34 4.78 -0.36 2.61 2.01 -1.04 -1.47 115.64 119.83 2nqn s THR 154 Ca 0.00 2.00 -0.29 0.00 0.31 0.00 0.00 61.69 63.71 2nqn s THR 154 Cb 0.00 -4.28 0.02 0.00 0.01 0.00 0.00 72.50 68.25 2nqn s THR 154 CO 0.00 0.14 1.11 -0.60 -0.69 0.00 0.00 174.62 174.58 2nqn s ARG 155 N 1.15 3.96 0.14 4.92 3.52 -1.26 -1.57 118.95 129.81 2nqn s ARG 155 Ca 0.52 0.95 -0.31 0.00 -0.13 0.00 0.00 55.73 56.76 2nqn s ARG 155 Cb -0.21 -3.80 -0.08 0.00 -1.56 0.00 0.00 34.95 29.30 2nqn s ARG 155 CO 0.27 -1.05 1.31 -0.51 -0.81 0.00 0.00 175.30 174.51 2nqn s LEU 156 N 3.94 4.39 0.00 -0.88 1.43 0.04 -4.90 118.68 122.70 2nqn s LEU 156 Ca 0.47 2.29 0.03 0.00 -1.03 0.00 0.00 54.13 55.89 2nqn s LEU 156 Cb -0.11 -3.59 -0.01 0.00 0.03 0.00 0.00 46.19 42.50 2nqn s LEU 156 CO 0.20 -0.56 0.26 0.41 0.23 0.00 0.00 176.35 176.90 2nqn n THR 157 N 3.41 0.00 0.32 5.49 -1.04 -1.26 -0.19 114.28 121.01 2nqn n THR 157 Ca 0.09 -1.64 0.21 0.00 -2.04 0.00 0.00 64.05 60.67 2nqn n THR 157 Cb 0.43 0.87 1.11 0.00 -1.82 0.00 0.00 70.33 70.93 2nqn n THR 157 CO 0.00 0.00 0.00 0.74 -0.64 0.00 0.00 175.07 175.17 2nqn h THR 158 N 1.78 0.12 -0.01 12.58 2.02 -1.99 -1.45 112.91 125.97 2nqn h THR 158 Ca -0.18 -0.06 -0.17 0.00 0.77 0.00 0.00 66.41 66.77 2nqn h THR 158 Cb 0.89 1.05 -0.02 0.00 -1.74 0.00 0.00 68.15 68.33 2nqn h THR 158 CO 0.26 0.01 -0.77 0.00 0.37 0.00 0.00 175.52 175.39 2nqn h ALA 159 N 1.99 0.70 0.00 6.16 0.00 -1.97 -3.38 119.26 122.76 2nqn h ALA 159 Ca -0.00 -0.68 -0.38 0.00 0.00 0.00 0.00 54.91 53.85 2nqn h ALA 159 Cb 0.05 -0.10 -0.06 0.00 0.00 0.00 0.00 17.79 17.68 2nqn h ALA 159 CO 0.00 0.90 -2.35 0.39 0.00 0.00 0.00 179.25 178.19 2nqn n GLU 160 N -3.68 0.55 -0.35 0.00 4.71 -0.64 -4.55 120.64 116.67 2nqn n GLU 160 Ca -0.02 0.18 0.09 0.00 -0.01 0.00 0.00 57.16 57.40 2nqn n GLU 160 Cb 0.74 -1.42 0.26 0.00 -1.01 0.00 0.00 31.44 30.01 2nqn n GLU 160 CO 0.00 0.00 0.00 -0.07 0.09 0.00 0.00 177.13 177.15 2nqn h LEU 161 N -0.44 0.83 -1.28 -4.62 3.38 -1.52 -0.40 115.31 111.25 2nqn h LEU 161 Ca -0.57 0.07 -0.05 0.00 0.09 0.00 0.00 57.88 57.42 2nqn h LEU 161 Cb 1.67 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 42.33 2nqn h LEU 161 CO -0.23 0.38 -0.24 -0.65 0.09 0.00 0.00 178.44 177.79 2nqn h PRO 162 N 0.87 0.00 -0.19 1.13 0.11 -1.82 -1.55 132.00 130.56 2nqn h PRO 162 Ca 0.52 0.00 -0.17 0.00 0.11 0.00 0.00 66.00 66.46 2nqn h PRO 162 Cb 0.64 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.76 2nqn h PRO 162 CO -0.32 0.24 -0.55 0.28 -0.21 0.00 0.00 178.00 177.45 2nqn h VAL 163 N 0.00 1.31 -0.84 3.15 2.07 -1.34 -1.84 116.25 118.76 2nqn h VAL 163 Ca -0.00 -1.78 -0.03 0.00 0.82 0.00 0.00 66.70 65.71 2nqn h VAL 163 Cb 0.68 1.91 -0.04 0.00 -1.52 0.00 0.00 31.29 32.32 2nqn h VAL 163 CO 0.03 0.56 0.41 0.40 0.02 0.00 0.00 177.57 178.98 2nqn h ILE 164 N 0.40 1.26 -0.37 4.57 2.04 -1.08 -2.30 117.51 122.04 2nqn h ILE 164 Ca -0.02 -0.72 -0.09 0.00 1.00 0.00 0.00 64.86 65.04 2nqn h ILE 164 Cb 1.17 0.18 -0.02 0.00 -0.74 0.00 0.00 36.82 37.41 2nqn h ILE 164 CO 0.12 0.31 -0.13 0.00 0.00 0.00 0.00 178.15 178.45 2nqn h ALA 165 N 1.25 1.09 0.00 1.87 0.00 -1.22 -2.26 119.26 119.99 2nqn h ALA 165 Ca 0.29 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2nqn h ALA 165 Cb 0.11 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.75 2nqn h ALA 165 CO -0.04 0.56 0.00 -1.13 0.00 0.00 0.00 179.25 178.65 2nqn n SER 166 N -4.17 0.24 -1.01 0.00 3.41 -0.70 -1.11 113.62 110.28 2nqn n SER 166 Ca 0.01 0.58 0.11 0.00 -0.26 0.00 0.00 58.87 59.31 2nqn n SER 166 Cb 0.35 -0.62 0.25 0.00 -0.26 0.00 0.00 64.21 63.93 2nqn n SER 166 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2nqn n LEU 167 N -1.78 3.02 0.00 1.04 4.77 -0.86 -4.94 117.00 118.25 2nqn n LEU 167 Ca 0.02 -1.29 0.00 0.00 -0.03 0.00 0.00 56.01 54.70 2nqn n LEU 167 Cb 0.13 -0.22 0.00 0.00 -2.33 0.00 0.00 43.42 41.00 2nqn n LEU 167 CO 0.12 0.65 0.00 0.61 -1.33 0.00 0.00 177.39 177.43 2nqn n GLY 168 N 1.41 0.85 3.65 -0.72 0.00 -0.27 -4.71 105.19 105.40 2nqn n GLY 168 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 2nqn n GLY 168 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2nqn s ILE 169 N -3.32 4.82 -0.35 -0.61 1.01 -1.18 -4.95 121.20 116.62 2nqn s ILE 169 Ca 0.00 1.64 0.23 0.00 0.00 0.00 0.00 60.65 62.52 2nqn s ILE 169 Cb 0.00 -4.15 0.02 0.00 0.01 0.00 0.00 42.46 38.34 2nqn s ILE 169 CO 0.00 -0.08 1.13 0.00 0.00 0.00 0.00 174.94 175.99 2nqn h ALA 170 N 7.62 0.53 -2.56 9.38 0.00 -1.93 -3.37 119.26 128.93 2nqn h ALA 170 Ca -0.23 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.60 2nqn h ALA 170 Cb 1.09 0.00 -0.16 0.00 0.00 0.00 0.00 17.79 18.72 2nqn h ALA 170 CO 0.89 0.00 -0.14 -1.83 0.00 0.00 0.00 179.25 178.16 2nqn s GLU 171 N -3.31 0.91 0.02 0.00 -1.05 -1.26 -2.24 118.70 111.78 2nqn s GLU 171 Ca 0.02 -0.46 -0.01 0.00 -0.15 0.00 0.00 54.97 54.36 2nqn s GLU 171 Cb 0.10 0.40 -0.02 0.00 -0.44 0.00 0.00 34.13 34.18 2nqn s GLU 171 CO 0.77 -0.32 -0.00 0.14 0.95 0.00 0.00 175.26 176.80 2nqn s VAL 172 N -2.72 0.11 0.13 1.83 -7.23 -0.83 -4.93 120.40 106.76 2nqn s VAL 172 Ca -0.04 -0.93 -0.30 0.00 -1.81 0.00 0.00 61.98 58.91 2nqn s VAL 172 Cb -0.00 -0.37 -0.06 0.00 0.56 0.00 0.00 36.38 36.51 2nqn s VAL 172 CO -0.04 -0.51 1.01 -2.16 -0.31 0.00 0.00 175.10 173.09 2nqn s PRO 173 N -1.60 4.65 0.08 4.82 0.04 -1.26 -2.07 135.00 139.66 2nqn s PRO 173 Ca -0.14 1.54 0.05 0.00 0.04 0.00 0.00 61.00 62.49 2nqn s PRO 173 Cb -0.09 -3.35 -0.03 0.00 0.04 0.00 0.00 34.50 31.07 2nqn s PRO 173 CO -0.01 0.15 -0.13 0.14 0.04 0.00 0.00 177.00 177.19 2nqn s VAL 174 N 0.01 1.06 0.42 -0.36 -7.23 0.84 -0.65 120.40 114.50 2nqn s VAL 174 Ca 0.48 -1.44 -0.26 0.00 -1.81 0.00 0.00 61.98 58.96 2nqn s VAL 174 Cb -0.25 -1.18 -0.08 0.00 0.56 0.00 0.00 36.38 35.42 2nqn s VAL 174 CO 0.31 -0.35 1.33 -0.63 -0.31 0.00 0.00 175.10 175.45 2nqn s ILE 175 N -1.71 2.49 0.81 -0.62 -1.09 -0.19 -1.04 121.20 119.85 2nqn s ILE 175 Ca 0.01 0.43 -0.12 0.00 -2.23 0.00 0.00 60.65 58.75 2nqn s ILE 175 Cb -0.07 -3.25 0.08 0.00 -1.58 0.00 0.00 42.46 37.63 2nqn s ILE 175 CO 0.02 0.06 1.14 0.00 -1.23 0.00 0.00 174.94 174.92 2nqn s ARG 176 N -2.33 1.81 0.53 2.79 1.70 -0.18 -4.64 118.95 118.64 2nqn s ARG 176 Ca 0.59 1.46 -0.21 0.00 -0.47 0.00 0.00 55.73 57.09 2nqn s ARG 176 Cb -0.39 -1.82 -0.05 0.00 -0.57 0.00 0.00 34.95 32.11 2nqn s ARG 176 CO 0.50 -2.02 1.20 0.15 -1.08 0.00 0.00 175.30 174.05 2nqn s LYS 177 N -4.53 3.33 0.16 3.89 1.02 -1.26 -4.97 119.74 117.39 2nqn s LYS 177 Ca 0.66 1.83 -0.30 0.00 0.02 0.00 0.00 55.97 58.19 2nqn s LYS 177 Cb -0.22 -2.15 -0.08 0.00 -0.52 0.00 0.00 37.83 34.86 2nqn s LYS 177 CO 0.53 -0.92 1.16 0.08 -0.92 0.00 0.00 175.35 175.28 2nqn s VAL 178 N -1.56 3.76 -0.18 3.17 1.01 -1.26 -4.82 120.40 120.51 2nqn s VAL 178 Ca 0.71 1.46 -0.13 0.00 0.00 0.00 0.00 61.98 64.03 2nqn s VAL 178 Cb -0.30 -3.93 -0.05 0.00 0.00 0.00 0.00 36.38 32.10 2nqn s VAL 178 CO 0.35 0.22 0.24 -0.13 0.00 0.00 0.00 175.10 175.78 2nqn s ARG 179 N -0.12 4.23 -0.08 2.72 0.52 -1.26 -1.16 118.95 123.80 2nqn s ARG 179 Ca 0.52 -0.02 0.01 0.00 -0.52 0.00 0.00 55.73 55.72 2nqn s ARG 179 Cb -0.31 -3.43 0.02 0.00 0.52 0.00 0.00 34.95 31.75 2nqn s ARG 179 CO 0.35 0.24 -0.11 0.08 0.02 0.00 0.00 175.30 175.88 2nqn s VAL 180 N 0.50 1.11 0.00 3.52 1.01 0.02 -0.30 120.40 126.26 2nqn s VAL 180 Ca 0.13 -0.42 -0.12 0.00 0.00 0.00 0.00 61.98 61.57 2nqn s VAL 180 Cb -0.12 -1.05 -0.05 0.00 0.00 0.00 0.00 36.38 35.15 2nqn s VAL 180 CO 0.02 0.36 0.36 0.00 0.00 0.00 0.00 175.10 175.85 2nqn s ALA 181 N 1.05 3.74 -0.02 5.51 0.00 0.80 -1.02 121.76 131.82 2nqn s ALA 181 Ca -0.07 -0.33 -0.00 0.00 0.00 0.00 0.00 51.96 51.55 2nqn s ALA 181 Cb -0.15 -2.29 0.02 0.00 0.00 0.00 0.00 23.12 20.70 2nqn s ALA 181 CO -0.01 0.53 0.03 -1.17 0.00 0.00 0.00 175.76 175.14 2nqn s LEU 182 N -1.30 1.45 0.16 0.00 0.20 0.37 0.13 118.68 119.69 2nqn s LEU 182 Ca 0.25 0.05 -0.24 0.00 0.69 0.00 0.00 54.13 54.88 2nqn s LEU 182 Cb -0.15 0.01 0.06 0.00 -0.43 0.00 0.00 46.19 45.68 2nqn s LEU 182 CO 0.13 -0.07 0.73 0.72 -0.29 0.00 0.00 176.35 177.57 2nqn s PHE 183 N 0.59 -0.35 0.26 5.38 -0.12 -0.93 -0.08 117.98 122.73 2nqn s PHE 183 Ca -0.05 0.07 0.01 0.00 -0.05 0.00 0.00 56.93 56.92 2nqn s PHE 183 Cb -0.07 0.61 -0.05 0.00 -0.63 0.00 0.00 43.02 42.88 2nqn s PHE 183 CO -0.02 -0.91 0.10 -1.54 -0.05 0.00 0.00 175.22 172.80 2nqn s SER 184 N -2.78 1.17 0.00 1.98 1.04 -1.00 -0.78 113.70 113.34 2nqn s SER 184 Ca 0.06 -1.39 -0.17 0.00 0.48 0.00 0.00 55.95 54.93 2nqn s SER 184 Cb -0.02 0.17 0.03 0.00 0.10 0.00 0.00 66.02 66.30 2nqn s SER 184 CO -0.05 -0.74 0.37 0.28 0.98 0.00 0.00 173.24 174.09 2nqn s THR 185 N -3.76 0.05 0.00 2.02 -1.32 -0.49 0.19 115.64 112.34 2nqn s THR 185 Ca 0.38 -0.45 0.00 0.00 -1.21 0.00 0.00 61.69 60.41 2nqn s THR 185 Cb 0.08 -0.78 0.00 0.00 -1.51 0.00 0.00 72.50 70.29 2nqn s THR 185 CO 0.14 -0.25 0.00 0.61 -2.21 0.00 0.00 174.62 172.91 2nqn n GLY 186 N 0.97 3.54 0.00 6.08 0.00 -1.24 -4.03 105.19 110.51 2nqn n GLY 186 Ca -0.20 -0.44 0.03 0.00 0.00 0.00 0.00 46.02 45.41 2nqn n GLY 186 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2nqn n ASP 187 N 0.00 0.00 0.20 1.61 10.43 -1.26 -1.11 116.55 126.42 2nqn n ASP 187 Ca 0.00 0.44 0.12 0.00 2.57 0.00 0.00 54.79 57.92 2nqn n ASP 187 Cb 0.00 -0.46 0.24 0.00 1.84 0.00 0.00 41.12 42.74 2nqn n ASP 187 CO 0.00 0.00 0.00 1.05 -1.07 0.00 0.00 177.20 177.18 2nqn h GLU 188 N 0.00 0.00 -6.20 -1.24 4.11 -1.94 -3.46 114.58 105.85 2nqn h GLU 188 Ca 0.00 0.00 -0.55 0.00 0.07 0.00 0.00 59.36 58.88 2nqn h GLU 188 Cb 0.11 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.32 2nqn h GLU 188 CO 0.00 0.00 0.14 -0.51 0.07 0.00 0.00 179.01 178.71 2nqn s LEU 189 N -5.89 4.40 0.20 3.06 1.43 -0.26 -0.83 118.68 120.78 2nqn s LEU 189 Ca 0.07 1.36 0.11 0.00 -1.03 0.00 0.00 54.13 54.64 2nqn s LEU 189 Cb 0.06 -3.19 -0.04 0.00 0.03 0.00 0.00 46.19 43.05 2nqn s LEU 189 CO 0.65 -0.05 -0.21 -1.58 0.23 0.00 0.00 176.35 175.39 2nqn s GLN 190 N 0.32 1.48 -0.08 1.70 2.00 0.31 -4.90 119.66 120.48 2nqn s GLN 190 Ca 0.39 -1.55 -0.19 0.00 -2.00 0.00 0.00 55.36 52.01 2nqn s GLN 190 Cb -0.19 -1.66 -0.04 0.00 0.80 0.00 0.00 33.01 31.91 2nqn s GLN 190 CO 0.21 0.34 0.51 -0.51 -0.50 0.00 0.00 175.29 175.34 2nqn s LEU 191 N -2.87 4.32 0.16 3.68 1.43 -1.26 -1.48 118.68 122.66 2nqn s LEU 191 Ca 0.21 0.91 -0.34 0.00 -1.03 0.00 0.00 54.13 53.89 2nqn s LEU 191 Cb -0.06 -2.75 -0.16 0.00 0.03 0.00 0.00 46.19 43.25 2nqn s LEU 191 CO 0.10 0.04 1.22 -2.65 0.23 0.00 0.00 176.35 175.29 2nqn n PRO 192 N 3.35 1.23 0.00 1.29 -0.02 -1.26 -0.03 135.00 139.56 2nqn n PRO 192 Ca -0.07 0.44 0.00 0.00 -2.02 0.00 0.00 63.50 61.85 2nqn n PRO 192 Cb 0.52 -1.98 0.00 0.00 -0.02 0.00 0.00 33.50 32.01 2nqn n PRO 192 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2nqn n GLY 193 N 2.16 2.30 3.92 -1.23 0.00 -1.26 -5.07 105.19 106.02 2nqn n GLY 193 Ca 0.16 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.91 2nqn n GLY 193 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2nqn s GLN 194 N -0.26 3.55 0.40 1.61 -0.21 0.96 -5.07 119.66 120.64 2nqn s GLN 194 Ca 0.00 -0.15 -0.23 0.00 0.02 0.00 0.00 55.36 55.00 2nqn s GLN 194 Cb 0.00 -2.65 -0.10 0.00 1.00 0.00 0.00 33.01 31.27 2nqn s GLN 194 CO 0.00 0.17 1.00 -1.25 -2.12 0.00 0.00 175.29 173.09 2nqn s PRO 195 N -3.94 4.22 -0.15 2.91 0.04 -1.26 -4.85 135.00 131.97 2nqn s PRO 195 Ca 0.42 1.36 -0.19 0.00 0.04 0.00 0.00 61.00 62.63 2nqn s PRO 195 Cb -0.10 -2.45 -0.04 0.00 0.04 0.00 0.00 34.50 31.95 2nqn s PRO 195 CO 0.34 -0.06 0.54 -1.17 0.04 0.00 0.00 177.00 176.68 2nqn s LEU 196 N -2.76 4.22 -0.13 -3.56 2.96 -1.26 -4.99 118.68 113.16 2nqn s LEU 196 Ca 0.58 0.81 -0.01 0.00 -0.22 0.00 0.00 54.13 55.30 2nqn s LEU 196 Cb -0.17 -2.77 0.04 0.00 0.50 0.00 0.00 46.19 43.78 2nqn s LEU 196 CO 0.22 -0.11 -0.03 -0.83 -1.32 0.00 0.00 176.35 174.28 2nqn s GLY 197 N 0.90 0.77 -0.21 7.98 0.00 -1.26 -4.95 107.32 110.55 2nqn s GLY 197 Ca 0.27 -0.57 -0.05 0.00 0.00 0.00 0.00 44.72 44.37 2nqn s GLY 197 CO 0.11 1.02 0.10 1.22 0.00 0.00 0.00 173.10 175.55 2nqn n ASP 198 N 4.98 -4.76 -1.22 1.64 8.00 -1.26 -3.74 116.55 120.18 2nqn n ASP 198 Ca -0.10 1.27 -0.11 0.00 0.71 0.00 0.00 54.79 56.56 2nqn n ASP 198 Cb 0.49 -4.66 -0.05 0.00 -0.02 0.00 0.00 41.12 36.88 2nqn n ASP 198 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2nqn n GLY 199 N 1.33 1.01 3.90 0.44 0.00 -1.26 -4.93 105.19 105.68 2nqn n GLY 199 Ca -0.17 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.56 2nqn n GLY 199 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2nqn s GLN 200 N -2.83 3.39 0.05 1.61 -0.21 -1.25 -4.99 119.66 115.45 2nqn s GLN 200 Ca 0.00 0.28 -0.02 0.00 0.02 0.00 0.00 55.36 55.64 2nqn s GLN 200 Cb 0.00 -2.28 -0.03 0.00 1.00 0.00 0.00 33.01 31.70 2nqn s GLN 200 CO 0.00 -0.42 -0.00 0.96 -2.12 0.00 0.00 175.29 173.71 2nqn s ILE 201 N -2.91 0.21 0.01 1.08 -4.36 -0.01 -4.81 121.20 110.41 2nqn s ILE 201 Ca 0.51 -1.71 -0.27 0.00 -0.26 0.00 0.00 60.65 58.92 2nqn s ILE 201 Cb -0.11 -1.47 -0.04 0.00 1.25 0.00 0.00 42.46 42.09 2nqn s ILE 201 CO 0.47 -0.95 0.84 -0.31 0.24 0.00 0.00 174.94 175.23 2nqn s TYR 202 N -3.87 3.68 0.10 1.37 1.51 -1.26 -0.53 117.35 118.34 2nqn s TYR 202 Ca 0.06 1.52 -0.31 0.00 -1.01 0.00 0.00 57.07 57.33 2nqn s TYR 202 Cb 0.07 -2.94 -0.09 0.00 -0.11 0.00 0.00 41.96 38.90 2nqn s TYR 202 CO -0.10 0.12 1.62 0.34 -1.11 0.00 0.00 175.55 176.42 2nqn s ASP 203 N 0.53 6.61 0.00 2.29 2.15 -0.55 -4.84 116.67 122.86 2nqn s ASP 203 Ca 0.43 2.51 0.00 0.00 0.43 0.00 0.00 52.55 55.93 2nqn s ASP 203 Cb -0.20 -2.57 0.00 0.00 -0.30 0.00 0.00 42.92 39.85 2nqn s ASP 203 CO 0.24 -0.86 0.00 0.35 -0.17 0.00 0.00 175.17 174.73 2nqn n THR 204 N 4.50 0.00 -0.32 1.71 -2.24 -1.26 -4.78 114.28 111.89 2nqn n THR 204 Ca 0.15 0.00 -0.04 0.00 -2.27 0.00 0.00 64.05 61.89 2nqn n THR 204 Cb 0.40 -0.41 0.08 0.00 -2.10 0.00 0.00 70.33 68.31 2nqn n THR 204 CO 0.00 0.00 0.00 0.78 -0.57 0.00 0.00 175.07 175.28 2nqn h ASN 205 N 0.00 1.04 -0.92 3.42 4.21 -1.89 -2.11 115.58 119.33 2nqn h ASN 205 Ca 0.00 -0.08 -0.01 0.00 1.21 0.00 0.00 56.30 57.42 2nqn h ASN 205 Cb 0.45 -0.26 -0.04 0.00 -1.12 0.00 0.00 38.32 37.34 2nqn h ASN 205 CO 0.00 0.82 0.54 -0.09 -1.29 0.00 0.00 177.43 177.41 2nqn h ARG 206 N 1.18 1.26 -0.42 0.81 2.43 -1.88 0.16 114.38 117.93 2nqn h ARG 206 Ca 0.31 -0.12 -0.05 0.00 -0.81 0.00 0.00 59.98 59.30 2nqn h ARG 206 Cb -0.02 -0.26 -0.02 0.00 -0.42 0.00 0.00 29.97 29.25 2nqn h ARG 206 CO -0.05 0.89 0.06 1.25 -1.51 0.00 0.00 179.97 180.61 2nqn h LEU 207 N 1.28 0.67 -0.09 3.80 6.46 -1.80 -0.92 115.31 124.72 2nqn h LEU 207 Ca 0.33 -0.26 0.02 0.00 -0.12 0.00 0.00 57.88 57.84 2nqn h LEU 207 Cb -0.03 -0.18 -0.01 0.00 -0.73 0.00 0.00 40.66 39.71 2nqn h LEU 207 CO -0.06 0.77 -0.01 0.00 -0.62 0.00 0.00 178.44 178.52 2nqn h ALA 208 N 0.93 0.07 -0.59 1.25 0.00 -0.68 -0.62 119.26 119.61 2nqn h ALA 208 Ca 0.13 0.03 -0.05 0.00 0.00 0.00 0.00 54.91 55.02 2nqn h ALA 208 Cb 0.38 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.20 2nqn h ALA 208 CO 0.01 -0.48 0.19 0.28 0.00 0.00 0.00 179.25 179.25 2nqn h VAL 209 N 0.02 1.24 -0.05 0.00 2.07 -0.90 -2.04 116.25 116.59 2nqn h VAL 209 Ca 0.04 -0.82 0.02 0.00 0.82 0.00 0.00 66.70 66.77 2nqn h VAL 209 Cb 0.05 0.65 -0.02 0.00 -1.52 0.00 0.00 31.29 30.45 2nqn h VAL 209 CO -0.08 0.31 -0.08 -0.74 0.02 0.00 0.00 177.57 177.00 2nqn h HIS 210 N 0.84 -0.19 -0.41 1.57 6.17 -0.86 0.16 115.15 122.42 2nqn h HIS 210 Ca 0.19 0.01 0.05 0.00 0.71 0.00 0.00 60.37 61.33 2nqn h HIS 210 Cb 0.28 0.09 -0.05 0.00 2.52 0.00 0.00 27.41 30.26 2nqn h HIS 210 CO 0.02 -0.12 0.13 -0.07 0.71 0.00 0.00 177.93 178.60 2nqn h LEU 211 N -0.11 0.12 -0.58 0.26 3.38 -0.98 -1.32 115.31 116.09 2nqn h LEU 211 Ca 0.05 0.05 -0.06 0.00 0.09 0.00 0.00 57.88 58.01 2nqn h LEU 211 Cb 0.18 0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.95 2nqn h LEU 211 CO -0.12 0.10 0.11 0.24 0.09 0.00 0.00 178.44 178.86 2nqn h MET 212 N 0.28 0.94 -0.68 1.13 2.86 -0.95 -1.81 114.93 116.70 2nqn h MET 212 Ca 0.19 -0.24 -0.01 0.00 -2.06 0.00 0.00 59.70 57.58 2nqn h MET 212 Cb 0.19 -0.11 -0.03 0.00 0.06 0.00 0.00 31.60 31.70 2nqn h MET 212 CO -0.21 0.89 0.39 -0.07 1.06 0.00 0.00 176.91 178.97 2nqn h LEU 213 N 0.84 0.84 -0.52 1.22 3.38 -0.33 -0.80 115.31 119.94 2nqn h LEU 213 Ca 0.18 -0.08 -0.11 0.00 0.09 0.00 0.00 57.88 57.96 2nqn h LEU 213 Cb 0.39 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 2nqn h LEU 213 CO 0.01 0.67 -0.09 -0.33 0.09 0.00 0.00 178.44 178.79 2nqn h GLU 214 N 0.93 0.98 0.00 1.13 5.08 -1.10 -1.16 114.58 120.45 2nqn h GLU 214 Ca 0.24 -0.36 -0.05 0.00 -1.00 0.00 0.00 59.36 58.19 2nqn h GLU 214 Cb 0.01 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.19 2nqn h GLU 214 CO -0.04 1.03 -0.23 1.96 -1.00 0.00 0.00 179.01 180.73 2nqn h GLN 215 N 0.84 0.00 -0.00 2.33 1.08 -1.01 -1.38 115.11 116.97 2nqn h GLN 215 Ca 0.13 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.33 2nqn h GLN 215 Cb 0.65 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.08 2nqn h GLN 215 CO 0.05 0.23 -0.01 1.28 -0.95 0.00 0.00 178.83 179.42 2nqn n LEU 216 N -3.69 0.24 0.00 1.46 4.77 -0.34 -4.90 117.00 114.54 2nqn n LEU 216 Ca -0.01 -0.02 0.00 0.00 -0.03 0.00 0.00 56.01 55.95 2nqn n LEU 216 Cb 0.35 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.38 2nqn n LEU 216 CO 0.34 0.04 0.00 0.61 -1.33 0.00 0.00 177.39 177.05 2nqn n GLY 217 N 1.09 0.67 3.88 -0.72 0.00 -0.52 -5.07 105.19 104.53 2nqn n GLY 217 Ca 0.21 -0.13 -0.29 0.00 0.00 0.00 0.00 46.02 45.81 2nqn n GLY 217 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2nqn s GLU 219 N -4.67 4.08 -0.17 0.00 2.12 -0.30 -4.48 118.70 115.27 2nqn s GLU 219 Ca 0.52 0.27 -0.08 0.00 0.36 0.00 0.00 54.97 56.03 2nqn s GLU 219 Cb -0.10 -3.63 -0.04 0.00 0.26 0.00 0.00 34.13 30.61 2nqn s GLU 219 CO 0.44 -0.29 0.10 0.08 -0.54 0.00 0.00 175.26 175.05 2nqn s VAL 220 N 2.10 5.10 -0.43 3.70 1.01 -1.26 -0.80 120.40 129.83 2nqn s VAL 220 Ca 0.20 0.07 0.01 0.00 0.00 0.00 0.00 61.98 62.27 2nqn s VAL 220 Cb -0.16 -3.29 0.12 0.00 0.00 0.00 0.00 36.38 33.05 2nqn s VAL 220 CO 0.09 0.49 0.18 -0.63 0.00 0.00 0.00 175.10 175.23 2nqn s ILE 221 N 0.07 2.79 -0.56 2.22 1.09 -0.19 -4.98 121.20 121.63 2nqn s ILE 221 Ca 0.07 -2.54 -0.21 0.00 -1.10 0.00 0.00 60.65 56.87 2nqn s ILE 221 Cb -0.12 -2.95 0.06 0.00 -1.06 0.00 0.00 42.46 38.39 2nqn s ILE 221 CO 0.00 -0.70 0.80 0.21 -0.10 0.00 0.00 174.94 175.16 2nqn s ASN 222 N 0.88 6.24 0.00 3.58 3.04 -1.26 -0.48 114.94 126.94 2nqn s ASN 222 Ca 0.12 -0.83 0.11 0.00 0.04 0.00 0.00 52.86 52.30 2nqn s ASN 222 Cb -0.22 -2.36 0.56 0.00 -1.54 0.00 0.00 41.25 37.69 2nqn s ASN 222 CO -0.05 -1.14 1.38 0.18 -3.04 0.00 0.00 177.10 174.43 2nqn n LEU 223 N 6.91 0.54 0.00 3.21 4.32 0.89 -4.97 117.00 127.89 2nqn n LEU 223 Ca -0.04 -0.25 0.00 0.00 -0.02 0.00 0.00 56.01 55.70 2nqn n LEU 223 Cb 0.46 -0.05 0.00 0.00 -1.62 0.00 0.00 43.42 42.20 2nqn n LEU 223 CO 0.60 0.12 0.00 0.61 -1.22 0.00 0.00 177.39 177.50 2nqn n GLY 224 N 0.78 0.35 3.62 -0.72 0.00 -1.25 -4.65 105.19 103.32 2nqn n GLY 224 Ca 0.09 -0.91 -0.41 0.00 0.00 0.00 0.00 46.02 44.79 2nqn n GLY 224 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2nqn s ILE 225 N 0.00 4.92 0.08 -0.61 1.01 -1.26 -2.37 121.20 122.97 2nqn s ILE 225 Ca 0.00 1.14 -0.26 0.00 0.00 0.00 0.00 60.65 61.53 2nqn s ILE 225 Cb 0.00 -4.01 -0.06 0.00 0.01 0.00 0.00 42.46 38.40 2nqn s ILE 225 CO 0.00 -0.07 0.80 -0.63 0.00 0.00 0.00 174.94 175.04 2nqn s ILE 226 N 2.65 4.62 0.59 2.92 -1.09 0.13 -4.96 121.20 126.05 2nqn s ILE 226 Ca 0.28 1.71 -0.18 0.00 -2.23 0.00 0.00 60.65 60.23 2nqn s ILE 226 Cb -0.15 -4.15 -0.03 0.00 -1.58 0.00 0.00 42.46 36.54 2nqn s ILE 226 CO 0.10 0.39 1.16 0.00 -1.23 0.00 0.00 174.94 175.36 2nqn s ARG 227 N -0.28 3.04 -1.07 2.79 1.70 -1.26 -3.61 118.95 120.26 2nqn s ARG 227 Ca 0.39 1.67 -0.22 0.00 -0.47 0.00 0.00 55.73 57.10 2nqn s ARG 227 Cb -0.21 -1.96 -0.10 0.00 -0.57 0.00 0.00 34.95 32.11 2nqn s ARG 227 CO 0.25 -1.11 1.92 -0.25 -1.08 0.00 0.00 175.30 175.03 2nqn n ASP 228 N -1.67 3.02 -3.69 -2.89 8.00 -1.26 -4.51 116.55 113.54 2nqn n ASP 228 Ca 0.12 -2.71 -0.10 0.00 0.71 0.00 0.00 54.79 52.81 2nqn n ASP 228 Cb 0.51 -1.56 -0.11 0.00 -0.02 0.00 0.00 41.12 39.94 2nqn n ASP 228 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2nqn s ASP 229 N 5.90 -0.53 0.31 -2.24 2.15 -1.26 -5.05 116.67 115.95 2nqn s ASP 229 Ca 0.64 0.91 0.07 0.00 0.43 0.00 0.00 52.55 54.61 2nqn s ASP 229 Cb 0.04 0.80 0.77 0.00 -0.30 0.00 0.00 42.92 44.23 2nqn s ASP 229 CO 0.13 -0.19 1.79 -0.65 -0.17 0.00 0.00 175.17 176.07 2nqn h PRO 230 N 7.08 0.72 -0.14 4.34 0.11 -1.95 -0.76 132.00 141.40 2nqn h PRO 230 Ca -0.36 -0.04 -0.13 0.00 0.11 0.00 0.00 66.00 65.57 2nqn h PRO 230 Cb 1.18 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.14 2nqn h PRO 230 CO 0.29 0.47 -0.42 0.45 -0.21 0.00 0.00 178.00 178.58 2nqn h HIS 231 N 0.74 0.69 -0.77 0.65 3.86 -1.97 -1.88 115.15 116.47 2nqn h HIS 231 Ca 0.57 -0.28 -0.00 0.00 -1.16 0.00 0.00 60.37 59.50 2nqn h HIS 231 Cb 0.92 -0.12 -0.04 0.00 1.06 0.00 0.00 27.41 29.23 2nqn h HIS 231 CO -0.00 1.04 0.47 0.00 0.86 0.00 0.00 177.93 180.29 2nqn h ALA 232 N 0.52 0.98 -0.15 2.45 0.00 -1.71 -1.30 119.26 120.06 2nqn h ALA 232 Ca -0.01 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 2nqn h ALA 232 Cb 1.05 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 2nqn h ALA 232 CO 0.09 0.45 0.05 1.25 0.00 0.00 0.00 179.25 181.09 2nqn h LEU 233 N 1.05 0.22 -1.29 0.00 6.46 -1.15 -1.70 115.31 118.91 2nqn h LEU 233 Ca 0.28 -0.20 0.01 0.00 -0.12 0.00 0.00 57.88 57.85 2nqn h LEU 233 Cb -0.04 -0.06 -0.04 0.00 -0.73 0.00 0.00 40.66 39.79 2nqn h LEU 233 CO -0.05 0.35 0.47 0.03 -0.62 0.00 0.00 178.44 178.62 2nqn h ARG 234 N 0.07 0.95 -0.45 1.25 3.08 -1.12 -1.61 114.38 116.55 2nqn h ARG 234 Ca 0.05 -0.06 -0.08 0.00 0.07 0.00 0.00 59.98 59.96 2nqn h ARG 234 Cb 0.21 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 30.03 2nqn h ARG 234 CO -0.00 0.63 -0.06 0.00 -1.07 0.00 0.00 179.97 179.47 2nqn h ALA 235 N 1.55 1.05 -0.32 0.04 0.00 -0.89 -0.71 119.26 119.98 2nqn h ALA 235 Ca 0.26 -0.29 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 2nqn h ALA 235 Cb -0.10 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 2nqn h ALA 235 CO -0.06 0.58 -0.04 0.00 0.00 0.00 0.00 179.25 179.73 2nqn h ALA 236 N 1.22 0.43 -0.39 0.00 0.00 -0.66 -2.19 119.26 117.67 2nqn h ALA 236 Ca 0.13 -0.27 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 2nqn h ALA 236 Cb 0.52 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 2nqn h ALA 236 CO 0.03 0.23 0.17 0.74 0.00 0.00 0.00 179.25 180.42 2nqn h PHE 237 N 0.37 0.57 -0.42 0.00 -1.00 -1.07 0.80 116.94 116.19 2nqn h PHE 237 Ca 0.08 -0.03 0.03 0.00 2.81 0.00 0.00 57.97 60.86 2nqn h PHE 237 Cb 0.52 -0.18 -0.04 0.00 3.61 0.00 0.00 35.95 39.87 2nqn h PHE 237 CO 0.05 0.49 0.21 0.82 -1.61 0.00 0.00 178.31 178.27 2nqn h ILE 238 N 0.49 0.98 -0.24 -0.55 2.04 -1.06 0.12 117.51 119.27 2nqn h ILE 238 Ca 0.13 -0.15 -0.17 0.00 1.00 0.00 0.00 64.86 65.68 2nqn h ILE 238 Cb 0.15 0.51 -0.00 0.00 -0.74 0.00 0.00 36.82 36.73 2nqn h ILE 238 CO -0.01 0.08 -0.53 -0.08 0.00 0.00 0.00 178.15 177.60 2nqn h GLU 239 N 0.43 0.71 -0.08 2.37 4.81 -1.27 -2.55 114.58 119.00 2nqn h GLU 239 Ca 0.18 -0.44 -0.01 0.00 -0.13 0.00 0.00 59.36 58.97 2nqn h GLU 239 Cb 0.08 0.05 -0.00 0.00 0.63 0.00 0.00 28.75 29.51 2nqn h GLU 239 CO -0.12 1.06 0.02 0.00 -0.73 0.00 0.00 179.01 179.24 2nqn h ALA 240 N 0.86 0.10 0.00 2.92 0.00 -0.48 -2.76 119.26 119.90 2nqn h ALA 240 Ca 0.02 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 2nqn h ALA 240 Cb 1.10 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.86 2nqn h ALA 240 CO 0.11 -0.28 -0.12 0.22 0.00 0.00 0.00 179.25 179.18 2nqn h ASP 241 N -0.07 0.00 1.15 0.00 1.82 -0.80 -1.20 116.42 117.32 2nqn h ASP 241 Ca 0.03 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.67 2nqn h ASP 241 Cb 0.22 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.23 2nqn h ASP 241 CO -0.00 0.12 -0.27 -1.54 -1.61 0.00 0.00 179.24 175.94 2nqn n SER 242 N -4.12 0.69 -0.00 2.28 3.41 -0.96 -4.05 113.62 110.86 2nqn n SER 242 Ca -0.02 0.35 0.02 0.00 -0.26 0.00 0.00 58.87 58.96 2nqn n SER 242 Cb 0.20 -0.35 -0.03 0.00 -0.26 0.00 0.00 64.21 63.77 2nqn n SER 242 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2nqn n GLN 243 N -2.10 4.45 -4.49 4.33 1.13 -0.85 -5.07 117.38 114.78 2nqn n GLN 243 Ca 0.05 -0.01 -0.23 0.00 -1.94 0.00 0.00 57.00 54.87 2nqn n GLN 243 Cb 0.42 -0.81 -0.11 0.00 0.11 0.00 0.00 30.24 29.86 2nqn n GLN 243 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2nqn s ALA 244 N -1.63 2.60 -0.12 -1.58 0.00 -0.51 -4.87 121.76 115.65 2nqn s ALA 244 Ca 0.01 -2.10 0.21 0.00 0.00 0.00 0.00 51.96 50.09 2nqn s ALA 244 Cb 0.04 0.40 -0.21 0.00 0.00 0.00 0.00 23.12 23.35 2nqn s ALA 244 CO 0.21 -0.19 0.65 -0.25 0.00 0.00 0.00 175.76 176.19 2nqn n ASP 245 N -0.74 0.35 -3.82 0.00 9.92 0.59 -4.56 116.55 118.28 2nqn n ASP 245 Ca -0.04 0.14 -0.13 0.00 -0.53 0.00 0.00 54.79 54.24 2nqn n ASP 245 Cb 0.66 1.24 -0.14 0.00 -0.64 0.00 0.00 41.12 42.24 2nqn n ASP 245 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 2nqn s VAL 246 N -3.32 -0.02 -0.15 2.53 1.01 -1.01 -1.16 120.40 118.30 2nqn s VAL 246 Ca -0.05 0.06 0.01 0.00 0.00 0.00 0.00 61.98 61.99 2nqn s VAL 246 Cb 0.11 -0.12 -0.00 0.00 0.00 0.00 0.00 36.38 36.37 2nqn s VAL 246 CO 0.86 0.02 -0.16 -0.69 0.00 0.00 0.00 175.10 175.13 2nqn s VAL 247 N 0.36 2.63 -0.10 2.92 1.01 0.13 -0.14 120.40 127.21 2nqn s VAL 247 Ca -0.03 -0.79 0.04 0.00 0.00 0.00 0.00 61.98 61.20 2nqn s VAL 247 Cb -0.04 -2.10 -0.00 0.00 0.00 0.00 0.00 36.38 34.24 2nqn s VAL 247 CO -0.01 0.52 -0.24 -0.63 0.00 0.00 0.00 175.10 174.74 2nqn s ILE 248 N 0.72 2.07 -0.31 2.22 1.01 0.12 -1.10 121.20 125.93 2nqn s ILE 248 Ca -0.07 -1.02 -0.15 0.00 0.00 0.00 0.00 60.65 59.41 2nqn s ILE 248 Cb -0.16 -1.79 -0.02 0.00 0.01 0.00 0.00 42.46 40.51 2nqn s ILE 248 CO 0.01 0.56 0.38 -0.55 0.00 0.00 0.00 174.94 175.34 2nqn s SER 249 N 0.35 6.22 0.32 3.58 0.15 -0.68 -2.20 113.70 121.43 2nqn s SER 249 Ca -0.19 -0.00 0.26 0.00 0.70 0.00 0.00 55.95 56.72 2nqn s SER 249 Cb -0.18 -2.21 0.82 0.00 -1.71 0.00 0.00 66.02 62.74 2nqn s SER 249 CO 0.09 -0.29 1.75 -1.28 1.20 0.00 0.00 173.24 174.71 2nqn h SER 250 N 8.35 0.00 -0.58 5.45 0.87 -1.27 -1.66 113.55 124.71 2nqn h SER 250 Ca -0.30 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.26 2nqn h SER 250 Cb 1.15 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.11 2nqn h SER 250 CO 0.68 0.00 0.00 0.61 -0.53 0.00 0.00 176.83 177.59 2nqn n GLY 251 N 0.80 3.85 0.00 5.77 0.00 -1.26 -4.69 105.19 109.66 2nqn n GLY 251 Ca 0.04 -0.61 0.00 0.00 0.00 0.00 0.00 46.02 45.45 2nqn n GLY 251 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nqn n GLY 252 N -1.18 2.30 3.79 -0.02 0.00 -1.26 -1.39 105.19 107.44 2nqn n GLY 252 Ca 0.00 -0.45 -0.39 0.00 0.00 0.00 0.00 46.02 45.18 2nqn n GLY 252 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2nqn s VAL 253 N -1.32 4.53 0.31 1.61 1.01 -1.26 -4.84 120.40 120.43 2nqn s VAL 253 Ca 0.00 1.48 -0.29 0.00 0.00 0.00 0.00 61.98 63.17 2nqn s VAL 253 Cb 0.00 -4.03 -0.13 0.00 0.00 0.00 0.00 36.38 32.22 2nqn s VAL 253 CO 0.00 0.54 1.28 -0.24 0.00 0.00 0.00 175.10 176.68 2nqn n SER 254 N 1.64 2.56 -0.19 3.32 2.88 -1.26 -4.88 113.62 117.69 2nqn n SER 254 Ca -0.08 1.19 0.09 0.00 -1.33 0.00 0.00 58.87 58.74 2nqn n SER 254 Cb 0.50 -1.44 0.16 0.00 -0.75 0.00 0.00 64.21 62.67 2nqn n SER 254 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 2nqn n VAL 255 N 0.73 1.95 0.00 2.46 0.24 -1.26 -4.87 118.33 117.59 2nqn n VAL 255 Ca 0.07 -2.35 0.00 0.00 -2.04 0.00 0.00 64.34 60.02 2nqn n VAL 255 Cb 0.34 -0.24 0.00 0.00 -1.47 0.00 0.00 33.84 32.47 2nqn n VAL 255 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2nqn n GLY 256 N -1.35 2.31 3.72 7.63 0.00 -1.26 -4.33 105.19 111.91 2nqn n GLY 256 Ca 0.17 -0.25 -0.41 0.00 0.00 0.00 0.00 46.02 45.52 2nqn n GLY 256 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2nqn n GLU 257 N 0.00 2.13 -2.42 1.61 4.07 -1.26 -4.93 120.64 119.84 2nqn n GLU 257 Ca 0.00 0.75 -0.42 0.00 -0.06 0.00 0.00 57.16 57.43 2nqn n GLU 257 Cb 0.00 -2.43 -0.03 0.00 -0.06 0.00 0.00 31.44 28.93 2nqn n GLU 257 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2nqn s ALA 258 N -1.15 3.44 0.02 4.31 0.00 -1.26 -4.73 121.76 122.39 2nqn s ALA 258 Ca 0.58 0.77 -0.28 0.00 0.00 0.00 0.00 51.96 53.04 2nqn s ALA 258 Cb -0.52 -3.48 0.10 0.00 0.00 0.00 0.00 23.12 19.22 2nqn s ALA 258 CO 0.60 -0.58 1.23 0.16 0.00 0.00 0.00 175.76 177.18 2nqn s ASP 259 N 1.27 -0.01 0.53 0.00 -4.77 -1.26 -5.01 116.67 107.41 2nqn s ASP 259 Ca 0.58 -0.28 0.25 0.00 -3.30 0.00 0.00 52.55 49.80 2nqn s ASP 259 Cb -0.28 0.22 1.46 0.00 -1.09 0.00 0.00 42.92 43.23 2nqn s ASP 259 CO 0.27 -0.43 2.12 0.10 0.70 0.00 0.00 175.17 177.92 2nqn h TYR 260 N 2.00 0.00 -0.27 2.11 -0.00 -2.00 -2.11 116.97 116.70 2nqn h TYR 260 Ca -0.25 0.00 -0.15 0.00 0.00 0.00 0.00 58.73 58.33 2nqn h TYR 260 Cb 1.20 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.92 2nqn h TYR 260 CO 1.13 0.09 -0.45 1.79 -0.00 0.00 0.00 178.16 180.71 2nqn h THR 261 N 0.00 1.30 -0.68 -0.90 1.35 -1.95 -2.28 112.91 109.76 2nqn h THR 261 Ca -0.00 -1.65 -0.02 0.00 -0.55 0.00 0.00 66.41 64.19 2nqn h THR 261 Cb 0.21 1.58 -0.03 0.00 -1.73 0.00 0.00 68.15 68.17 2nqn h THR 261 CO 0.01 0.53 0.33 0.50 -0.25 0.00 0.00 175.52 176.64 2nqn h LYS 262 N 0.55 0.97 -0.58 4.72 3.64 -1.68 -0.54 116.57 123.66 2nqn h LYS 262 Ca 0.03 -0.14 -0.02 0.00 -1.27 0.00 0.00 60.65 59.25 2nqn h LYS 262 Cb 1.00 -0.18 -0.03 0.00 -0.41 0.00 0.00 32.23 32.62 2nqn h LYS 262 CO 0.09 0.76 0.27 1.15 -2.27 0.00 0.00 179.45 179.46 2nqn h THR 263 N 0.94 1.21 -0.71 1.00 2.02 -1.36 -0.29 112.91 115.71 2nqn h THR 263 Ca 0.23 -0.61 -0.07 0.00 0.77 0.00 0.00 66.41 66.74 2nqn h THR 263 Cb 0.11 0.53 -0.03 0.00 -1.74 0.00 0.00 68.15 67.02 2nqn h THR 263 CO -0.03 0.24 0.17 0.40 0.37 0.00 0.00 175.52 176.67 2nqn h ILE 264 N 0.80 1.26 0.29 3.11 2.04 -1.11 -1.66 117.51 122.23 2nqn h ILE 264 Ca 0.20 -0.98 -0.01 0.00 1.00 0.00 0.00 64.86 65.07 2nqn h ILE 264 Cb 0.13 0.54 0.00 0.00 -0.74 0.00 0.00 36.82 36.75 2nqn h ILE 264 CO -0.02 0.38 -0.14 -0.07 0.00 0.00 0.00 178.15 178.29 2nqn h LEU 265 N 1.07 -0.33 -2.01 1.44 3.38 -0.60 -0.82 115.31 117.44 2nqn h LEU 265 Ca 0.22 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.15 2nqn h LEU 265 Cb 0.38 0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.21 2nqn h LEU 265 CO 0.00 -0.19 -0.10 -0.33 0.09 0.00 0.00 178.44 177.91 2nqn h GLU 266 N -0.43 0.00 0.00 1.13 5.08 -0.97 -1.90 114.58 117.49 2nqn h GLU 266 Ca -0.04 0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 58.10 2nqn h GLU 266 Cb 0.33 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.54 2nqn h GLU 266 CO 0.06 0.10 -1.14 1.49 -1.00 0.00 0.00 179.01 178.52 2nqn h GLU 267 N 0.00 0.00 0.00 2.33 4.81 -1.03 -3.34 114.58 117.35 2nqn h GLU 267 Ca -0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2nqn h GLU 267 Cb 0.23 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.61 2nqn h GLU 267 CO 0.01 0.83 -0.64 1.28 -0.73 0.00 0.00 179.01 179.76 2nqn n LEU 268 N -3.26 0.60 0.00 1.64 4.77 -0.34 -5.02 117.00 115.39 2nqn n LEU 268 Ca -0.04 0.09 0.01 0.00 -0.03 0.00 0.00 56.01 56.04 2nqn n LEU 268 Cb 0.95 -0.20 0.02 0.00 -2.33 0.00 0.00 43.42 41.86 2nqn n LEU 268 CO 0.46 0.04 0.96 0.61 -1.33 0.00 0.00 177.39 178.13 2nqn n GLY 269 N 1.41 0.36 3.38 -0.72 0.00 -0.77 -4.22 105.19 104.63 2nqn n GLY 269 Ca 0.04 -1.07 -0.45 0.00 0.00 0.00 0.00 46.02 44.54 2nqn n GLY 269 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2nqn s GLU 270 N -2.03 3.38 -0.08 1.61 0.41 -0.62 -4.45 118.70 116.92 2nqn s GLU 270 Ca 0.26 -1.84 0.01 0.00 -0.41 0.00 0.00 54.97 53.00 2nqn s GLU 270 Cb -0.01 -4.50 -0.02 0.00 -1.78 0.00 0.00 34.13 27.81 2nqn s GLU 270 CO 0.01 -1.51 -0.11 0.42 -0.49 0.00 0.00 175.26 173.58 2nqn s ILE 271 N 1.80 3.34 -0.03 -1.63 1.09 -1.26 -1.99 121.20 122.51 2nqn s ILE 271 Ca 0.19 -0.60 -0.01 0.00 -1.10 0.00 0.00 60.65 59.13 2nqn s ILE 271 Cb -0.15 -2.36 -0.04 0.00 -1.06 0.00 0.00 42.46 38.85 2nqn s ILE 271 CO -0.03 0.57 0.08 0.00 -0.10 0.00 0.00 174.94 175.46 2nqn s ALA 272 N -0.41 3.59 -0.48 9.38 0.00 0.87 -4.95 121.76 129.76 2nqn s ALA 272 Ca 0.05 -0.83 -0.02 0.00 0.00 0.00 0.00 51.96 51.16 2nqn s ALA 272 Cb -0.12 -1.62 0.13 0.00 0.00 0.00 0.00 23.12 21.50 2nqn s ALA 272 CO 0.02 0.67 0.27 -0.06 0.00 0.00 0.00 175.76 176.66 2nqn s PHE 273 N -1.13 3.52 0.49 0.00 0.40 -1.26 -1.67 117.98 118.33 2nqn s PHE 273 Ca 0.21 -2.59 -0.07 0.00 -0.60 0.00 0.00 56.93 53.87 2nqn s PHE 273 Cb -0.12 -3.18 -0.04 0.00 0.51 0.00 0.00 43.02 40.19 2nqn s PHE 273 CO 0.11 -0.92 0.82 -1.58 0.70 0.00 0.00 175.22 174.36 2nqn s TRP 274 N 0.66 3.56 -0.36 0.36 0.51 -0.34 -4.95 118.94 118.38 2nqn s TRP 274 Ca 0.12 0.93 0.00 0.00 -2.12 0.00 0.00 56.10 55.03 2nqn s TRP 274 Cb -0.22 -2.39 0.11 0.00 -0.81 0.00 0.00 33.47 30.16 2nqn s TRP 274 CO -0.04 -0.32 0.15 0.15 -0.51 0.00 0.00 176.95 176.38 2nqn s LYS 275 N -4.66 0.92 0.34 4.98 1.02 -1.26 -2.45 119.74 118.63 2nqn s LYS 275 Ca 0.49 -1.42 -0.23 0.00 0.02 0.00 0.00 55.97 54.83 2nqn s LYS 275 Cb -0.10 -2.10 -0.10 0.00 -0.52 0.00 0.00 37.83 35.00 2nqn s LYS 275 CO 0.44 -1.06 0.91 -0.51 -0.92 0.00 0.00 175.35 174.21 2nqn s LEU 276 N 1.14 4.20 -1.36 3.17 1.02 0.19 -2.48 118.68 124.56 2nqn s LEU 276 Ca 0.13 1.71 -0.10 0.00 0.02 0.00 0.00 54.13 55.89 2nqn s LEU 276 Cb -0.20 -4.14 0.11 0.00 0.02 0.00 0.00 46.19 41.98 2nqn s LEU 276 CO -0.15 -0.16 2.14 0.00 0.02 0.00 0.00 176.35 178.20 2nqn n ALA 277 N 0.14 5.84 -2.25 4.21 0.00 0.14 -4.47 120.51 124.12 2nqn n ALA 277 Ca 0.03 -4.11 -0.14 0.00 0.00 0.00 0.00 53.44 49.22 2nqn n ALA 277 Cb 0.52 -3.11 -0.10 0.00 0.00 0.00 0.00 19.45 16.75 2nqn n ALA 277 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 2nqn s ILE 278 N 0.94 0.46 -0.25 0.00 -4.36 -1.26 -1.65 121.20 115.08 2nqn s ILE 278 Ca 0.46 -1.98 -0.14 0.00 -0.26 0.00 0.00 60.65 58.73 2nqn s ILE 278 Cb 0.13 -2.33 0.07 0.00 1.25 0.00 0.00 42.46 41.59 2nqn s ILE 278 CO -0.04 -0.26 0.62 -0.75 0.24 0.00 0.00 174.94 174.75 2nqn s LYS 279 N -4.01 0.63 1.06 0.37 2.20 -0.67 -4.41 119.74 114.91 2nqn s LYS 279 Ca 0.30 1.11 -0.15 0.00 -0.36 0.00 0.00 55.97 56.87 2nqn s LYS 279 Cb 0.07 0.10 0.22 0.00 -1.51 0.00 0.00 37.83 36.71 2nqn s LYS 279 CO 0.08 -0.15 1.13 -1.25 -0.36 0.00 0.00 175.35 174.80 2nqn s PRO 280 N 1.57 -0.08 0.28 4.03 0.04 -1.26 0.07 135.00 139.64 2nqn s PRO 280 Ca -0.10 0.14 0.00 0.00 0.04 0.00 0.00 61.00 61.09 2nqn s PRO 280 Cb -0.06 -1.71 0.00 0.00 0.04 0.00 0.00 34.50 32.77 2nqn s PRO 280 CO -0.18 -2.99 0.00 0.41 0.04 0.00 0.00 177.00 174.28 2nqn n GLY 281 N -1.52 -1.79 0.00 0.56 0.00 -1.26 -4.86 105.19 96.32 2nqn n GLY 281 Ca 0.09 -1.89 0.00 0.00 0.00 0.00 0.00 46.02 44.22 2nqn n GLY 281 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2nqn n LYS 282 N 0.00 0.00 -2.58 1.61 4.81 -1.26 -4.70 118.16 116.04 2nqn n LYS 282 Ca 0.00 0.00 -0.33 0.00 -0.87 0.00 0.00 58.31 57.11 2nqn n LYS 282 Cb 0.00 0.00 -0.05 0.00 0.02 0.00 0.00 35.03 35.00 2nqn n LYS 282 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 2nqn s PRO 283 N 0.00 4.03 -0.29 1.64 0.05 -1.26 0.57 135.00 139.75 2nqn s PRO 283 Ca 0.00 1.07 -0.17 0.00 0.05 0.00 0.00 61.00 61.95 2nqn s PRO 283 Cb 0.00 -2.15 0.14 0.00 0.05 0.00 0.00 34.50 32.54 2nqn s PRO 283 CO 0.00 -0.20 0.97 0.12 0.05 0.00 0.00 177.00 177.93 2nqn s PHE 284 N -2.37 -0.59 -0.15 0.56 5.36 -1.02 -4.47 117.98 115.30 2nqn s PHE 284 Ca 0.61 1.21 -0.04 0.00 -0.96 0.00 0.00 56.93 57.75 2nqn s PHE 284 Cb -0.10 0.37 -0.03 0.00 -0.34 0.00 0.00 43.02 42.91 2nqn s PHE 284 CO 0.23 -0.29 -0.02 0.00 -1.46 0.00 0.00 175.22 173.67 2nqn s ALA 285 N 1.20 3.09 -0.02 11.12 0.00 -0.73 -1.20 121.76 135.22 2nqn s ALA 285 Ca -0.07 -0.81 -0.06 0.00 0.00 0.00 0.00 51.96 51.02 2nqn s ALA 285 Cb -0.04 -1.58 0.01 0.00 0.00 0.00 0.00 23.12 21.50 2nqn s ALA 285 CO -0.14 0.27 0.14 0.12 0.00 0.00 0.00 175.76 176.15 2nqn s PHE 286 N 0.16 -0.04 -2.54 0.00 5.36 -0.67 0.44 117.98 120.69 2nqn s PHE 286 Ca -0.00 0.08 0.00 0.00 -0.96 0.00 0.00 56.93 56.04 2nqn s PHE 286 Cb -0.13 -0.01 0.00 0.00 -0.34 0.00 0.00 43.02 42.54 2nqn s PHE 286 CO 0.02 -0.20 0.00 0.41 -1.46 0.00 0.00 175.22 174.00 2nqn n GLY 287 N 2.10 -1.76 3.68 13.12 0.00 -1.01 -0.09 105.19 121.22 2nqn n GLY 287 Ca -0.19 -1.11 -0.35 0.00 0.00 0.00 0.00 46.02 44.37 2nqn n GLY 287 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2nqn s LYS 288 N -1.62 3.68 0.24 1.61 2.20 -0.84 -0.72 119.74 124.28 2nqn s LYS 288 Ca 0.00 -0.33 0.04 0.00 -0.36 0.00 0.00 55.97 55.32 2nqn s LYS 288 Cb 0.00 -3.11 0.04 0.00 -1.51 0.00 0.00 37.83 33.25 2nqn s LYS 288 CO 0.00 0.45 0.33 1.28 -0.36 0.00 0.00 175.35 177.04 2nqn n LEU 289 N 2.99 0.00 -0.01 5.43 4.77 0.31 -1.58 117.00 128.90 2nqn n LEU 289 Ca -0.18 -1.05 -0.10 0.00 -0.03 0.00 0.00 56.01 54.66 2nqn n LEU 289 Cb 0.53 -0.17 -0.04 0.00 -2.33 0.00 0.00 43.42 41.41 2nqn n LEU 289 CO 0.33 -0.58 0.84 0.28 -1.33 0.00 0.00 177.39 176.93 2nqn h SER 290 N 0.05 -0.11 0.00 -1.43 0.02 -1.94 -3.32 113.55 106.81 2nqn h SER 290 Ca -0.11 0.04 -0.04 0.00 -0.84 0.00 0.00 61.79 60.83 2nqn h SER 290 Cb 0.52 0.08 -0.08 0.00 0.14 0.00 0.00 62.40 63.05 2nqn h SER 290 CO 0.16 -0.04 -0.48 0.59 -1.14 0.00 0.00 176.83 175.93 2nqn n ASN 291 N -5.16 1.37 -3.70 3.07 3.02 -1.26 -5.09 115.26 107.52 2nqn n ASN 291 Ca -0.04 -2.86 -0.06 0.00 -0.03 0.00 0.00 54.58 51.59 2nqn n ASN 291 Cb 0.09 -0.38 -0.01 0.00 -0.61 0.00 0.00 39.78 38.87 2nqn n ASN 291 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2nqn s SER 292 N -2.40 -0.19 -0.05 6.41 1.04 -1.25 -4.69 113.70 112.57 2nqn s SER 292 Ca 0.27 -0.61 -0.04 0.00 0.48 0.00 0.00 55.95 56.05 2nqn s SER 292 Cb 0.27 0.65 -0.04 0.00 0.10 0.00 0.00 66.02 67.01 2nqn s SER 292 CO -0.05 -1.23 0.15 0.26 0.98 0.00 0.00 173.24 173.36 2nqn s TRP 293 N -3.45 3.53 -0.08 5.02 0.52 -0.31 -0.53 118.94 123.65 2nqn s TRP 293 Ca 0.12 0.40 0.03 0.00 0.02 0.00 0.00 56.10 56.67 2nqn s TRP 293 Cb -0.04 -1.86 -0.02 0.00 -1.15 0.00 0.00 33.47 30.40 2nqn s TRP 293 CO 0.06 0.67 -0.15 0.12 0.02 0.00 0.00 176.95 177.66 2nqn s PHE 294 N -1.19 2.70 -0.14 -1.98 5.36 0.10 0.19 117.98 123.02 2nqn s PHE 294 Ca 0.22 -0.41 -0.00 0.00 -0.96 0.00 0.00 56.93 55.78 2nqn s PHE 294 Cb -0.12 -1.70 0.03 0.00 -0.34 0.00 0.00 43.02 40.89 2nqn s PHE 294 CO 0.12 -0.01 -0.10 0.00 -1.46 0.00 0.00 175.22 173.78 2nqn s GLY 296 N 1.60 1.74 0.12 0.00 0.00 0.17 -1.69 107.32 109.26 2nqn s GLY 296 Ca 0.04 -1.07 -0.02 0.00 0.00 0.00 0.00 44.72 43.67 2nqn s GLY 296 CO -0.09 0.40 0.31 1.08 0.00 0.00 0.00 173.10 174.80 2nqn s LEU 297 N 1.33 4.30 0.66 0.66 1.02 -0.63 -1.77 118.68 124.26 2nqn s LEU 297 Ca 0.05 0.41 -0.13 0.00 0.02 0.00 0.00 54.13 54.47 2nqn s LEU 297 Cb -0.15 -3.13 -0.00 0.00 0.02 0.00 0.00 46.19 42.94 2nqn s LEU 297 CO 0.02 0.08 1.07 -2.16 0.02 0.00 0.00 176.35 175.38 2nqn s PRO 298 N -2.73 2.97 0.29 1.29 0.04 -1.26 -4.27 135.00 131.32 2nqn s PRO 298 Ca 0.38 1.13 0.03 0.00 0.04 0.00 0.00 61.00 62.58 2nqn s PRO 298 Cb -0.12 -1.99 0.44 0.00 0.04 0.00 0.00 34.50 32.87 2nqn s PRO 298 CO 0.27 -1.08 1.73 0.78 0.04 0.00 0.00 177.00 178.74 2nqn h GLY 299 N -0.26 0.48 -4.75 0.56 0.00 -1.94 -3.36 103.07 93.80 2nqn h GLY 299 Ca -0.45 -0.39 -0.52 0.00 0.00 0.00 0.00 47.33 45.96 2nqn h GLY 299 CO 0.56 0.36 1.00 0.21 0.00 0.00 0.00 176.54 178.67 2nqn s ASN 300 N -6.82 6.46 0.17 0.19 2.47 -1.26 -4.87 114.94 111.29 2nqn s ASN 300 Ca -0.07 2.75 -0.15 0.00 0.42 0.00 0.00 52.86 55.82 2nqn s ASN 300 Cb 0.14 -2.59 0.14 0.00 -1.45 0.00 0.00 41.25 37.49 2nqn s ASN 300 CO 0.78 -0.94 1.70 -0.65 -3.72 0.00 0.00 177.10 174.27 2nqn h PRO 301 N 7.35 0.12 -0.43 0.43 0.11 -1.86 0.13 132.00 137.85 2nqn h PRO 301 Ca -0.44 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.64 2nqn h PRO 301 Cb 1.21 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 32.27 2nqn h PRO 301 CO 0.94 0.08 0.14 0.28 -0.21 0.00 0.00 178.00 179.23 2nqn h VAL 302 N 0.12 1.21 -0.58 3.15 2.07 -1.87 -1.66 116.25 118.70 2nqn h VAL 302 Ca 0.22 -0.70 -0.01 0.00 0.82 0.00 0.00 66.70 67.03 2nqn h VAL 302 Cb 0.31 0.87 -0.03 0.00 -1.52 0.00 0.00 31.29 30.92 2nqn h VAL 302 CO -0.35 0.25 0.33 0.28 0.02 0.00 0.00 177.57 178.10 2nqn h SER 303 N 0.55 0.71 -0.41 0.57 0.02 -1.73 -1.48 113.55 111.78 2nqn h SER 303 Ca 0.14 -0.08 -0.06 0.00 -0.84 0.00 0.00 61.79 60.95 2nqn h SER 303 Cb 0.24 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 62.59 2nqn h SER 303 CO -0.01 0.58 0.02 0.00 -1.14 0.00 0.00 176.83 176.29 2nqn h ALA 304 N 1.16 0.55 -0.14 3.77 0.00 -0.66 -0.94 119.26 123.00 2nqn h ALA 304 Ca 0.20 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 2nqn h ALA 304 Cb 0.02 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 2nqn h ALA 304 CO -0.04 0.30 0.06 1.15 0.00 0.00 0.00 179.25 180.73 2nqn h THR 305 N 0.54 1.13 -0.41 0.00 2.02 -1.15 0.74 112.91 115.78 2nqn h THR 305 Ca 0.12 -0.38 -0.04 0.00 0.77 0.00 0.00 66.41 66.88 2nqn h THR 305 Cb 0.44 1.13 -0.02 0.00 -1.74 0.00 0.00 68.15 67.96 2nqn h THR 305 CO 0.02 0.12 0.11 0.25 0.37 0.00 0.00 175.52 176.38 2nqn h LEU 306 N 0.09 0.61 -0.50 2.58 7.12 -1.25 0.70 115.31 124.66 2nqn h LEU 306 Ca 0.05 -0.22 -0.01 0.00 0.13 0.00 0.00 57.88 57.83 2nqn h LEU 306 Cb 0.13 -0.16 -0.02 0.00 -0.53 0.00 0.00 40.66 40.08 2nqn h LEU 306 CO -0.01 0.68 0.29 0.74 -0.13 0.00 0.00 178.44 180.02 2nqn h THR 307 N 0.52 1.16 -0.36 1.05 2.02 -1.04 0.18 112.91 116.44 2nqn h THR 307 Ca 0.13 -0.38 -0.02 0.00 0.77 0.00 0.00 66.41 66.91 2nqn h THR 307 Cb 0.30 0.50 -0.02 0.00 -1.74 0.00 0.00 68.15 67.19 2nqn h THR 307 CO -0.00 0.17 0.16 0.15 0.37 0.00 0.00 175.52 176.37 2nqn h PHE 308 N 0.67 0.53 -0.77 3.16 3.57 -0.64 0.33 116.94 123.79 2nqn h PHE 308 Ca 0.18 -0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.60 2nqn h PHE 308 Cb 0.01 -0.16 -0.03 0.00 2.79 0.00 0.00 35.95 38.56 2nqn h PHE 308 CO -0.02 0.46 0.28 -0.92 -2.23 0.00 0.00 178.31 175.88 2nqn h TYR 309 N 0.44 1.19 0.00 0.41 3.20 -0.54 -0.38 116.97 121.28 2nqn h TYR 309 Ca 0.12 -0.10 -0.06 0.00 3.14 0.00 0.00 58.73 61.83 2nqn h TYR 309 Cb 0.15 -0.35 -0.01 0.00 1.54 0.00 0.00 36.73 38.05 2nqn h TYR 309 CO -0.01 0.92 -1.38 1.04 -1.64 0.00 0.00 178.16 177.09 2nqn n GLN 310 N -4.27 0.62 -0.04 1.82 1.13 0.02 -4.32 117.38 112.35 2nqn n GLN 310 Ca 0.07 0.07 -0.10 0.00 -1.94 0.00 0.00 57.00 55.10 2nqn n GLN 310 Cb 0.20 -1.74 -0.03 0.00 0.11 0.00 0.00 30.24 28.78 2nqn n GLN 310 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 2nqn n LEU 311 N -2.64 0.80 -0.09 1.08 4.77 0.10 -4.65 117.00 116.37 2nqn n LEU 311 Ca -0.05 0.13 -0.14 0.00 -0.03 0.00 0.00 56.01 55.93 2nqn n LEU 311 Cb 0.65 -0.32 -0.04 0.00 -2.33 0.00 0.00 43.42 41.38 2nqn n LEU 311 CO 0.42 0.11 0.50 0.58 -1.33 0.00 0.00 177.39 177.67 2nqn h VAL 312 N -0.36 1.29 -0.40 4.08 2.07 -1.34 -3.09 116.25 118.50 2nqn h VAL 312 Ca -0.22 -1.61 0.08 0.00 0.82 0.00 0.00 66.70 65.76 2nqn h VAL 312 Cb 1.12 1.62 -0.07 0.00 -1.52 0.00 0.00 31.29 32.44 2nqn h VAL 312 CO -0.14 0.52 -0.03 -0.61 0.02 0.00 0.00 177.57 177.34 2nqn h GLN 313 N 0.56 0.08 -0.09 1.57 4.15 -1.29 -0.43 115.11 119.65 2nqn h GLN 313 Ca 0.03 -0.00 -0.07 0.00 0.77 0.00 0.00 58.65 59.37 2nqn h GLN 313 Cb 1.02 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 28.68 2nqn h GLN 313 CO 0.10 0.05 -0.27 -1.35 -1.93 0.00 0.00 178.83 175.43 2nqn h PRO 314 N 0.08 0.17 -0.54 -2.39 0.11 -1.81 -1.84 132.00 125.77 2nqn h PRO 314 Ca 0.20 -0.05 -0.11 0.00 0.11 0.00 0.00 66.00 66.15 2nqn h PRO 314 Cb 0.29 -0.01 -0.02 0.00 0.11 0.00 0.00 31.00 31.37 2nqn h PRO 314 CO -0.35 0.43 -0.08 1.25 -0.21 0.00 0.00 178.00 179.04 2nqn h LEU 315 N 0.15 1.00 -0.84 2.35 6.46 -1.17 -2.45 115.31 120.82 2nqn h LEU 315 Ca 0.02 -0.34 -0.08 0.00 -0.12 0.00 0.00 57.88 57.37 2nqn h LEU 315 Cb 0.56 -0.27 -0.02 0.00 -0.73 0.00 0.00 40.66 40.19 2nqn h LEU 315 CO 0.04 1.11 0.04 -0.07 -0.62 0.00 0.00 178.44 178.93 2nqn h LEU 316 N 0.88 0.86 -0.68 2.25 3.38 -0.82 -1.52 115.31 119.67 2nqn h LEU 316 Ca 0.14 -0.21 -0.02 0.00 0.09 0.00 0.00 57.88 57.88 2nqn h LEU 316 Cb 0.64 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.13 2nqn h LEU 316 CO 0.04 0.90 0.34 0.00 0.09 0.00 0.00 178.44 179.82 2nqn h ALA 317 N 1.19 0.88 -0.21 1.53 0.00 -1.11 -1.38 119.26 120.16 2nqn h ALA 317 Ca 0.16 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 2nqn h ALA 317 Cb 0.45 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 2nqn h ALA 317 CO 0.02 0.43 -0.05 -0.22 0.00 0.00 0.00 179.25 179.43 2nqn h LYS 318 N 0.94 0.41 -0.41 0.00 3.64 -1.17 -2.99 116.57 117.00 2nqn h LYS 318 Ca 0.24 -0.16 0.03 0.00 -1.27 0.00 0.00 60.65 59.49 2nqn h LYS 318 Cb 0.10 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 31.88 2nqn h LYS 318 CO -0.03 0.65 0.27 -0.07 -2.27 0.00 0.00 179.45 178.00 2nqn h LEU 319 N 0.14 0.39 -1.56 5.20 3.38 -1.15 -2.22 115.31 119.49 2nqn h LEU 319 Ca 0.05 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2nqn h LEU 319 Cb 0.50 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.16 2nqn h LEU 319 CO 0.02 0.27 0.00 0.77 0.09 0.00 0.00 178.44 179.59 2nqn h SER 320 N 0.45 0.00 0.00 -0.43 4.64 -1.11 -0.08 113.55 117.03 2nqn h SER 320 Ca 0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 2nqn h SER 320 Cb 0.09 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.18 2nqn h SER 320 CO -0.04 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.53 2nqn n GLY 321 N -0.15 0.33 3.70 -0.77 0.00 -0.83 -4.76 105.19 102.70 2nqn n GLY 321 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2nqn n GLY 321 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2nqn s ASN 322 N -2.40 6.60 -0.09 1.61 3.84 -1.17 -4.33 114.94 119.00 2nqn s ASN 322 Ca 0.00 2.54 0.09 0.00 0.21 0.00 0.00 52.86 55.70 2nqn s ASN 322 Cb 0.00 -2.58 0.41 0.00 -0.55 0.00 0.00 41.25 38.53 2nqn s ASN 322 CO 0.00 -0.85 1.20 0.35 -2.79 0.00 0.00 177.10 175.01 2nqn n THR 323 N 4.37 1.18 -4.42 -5.21 -2.24 -0.54 -4.63 114.28 102.80 2nqn n THR 323 Ca 0.15 -0.68 -0.21 0.00 -2.27 0.00 0.00 64.05 61.05 2nqn n THR 323 Cb 0.40 -0.19 -0.10 0.00 -2.10 0.00 0.00 70.33 68.34 2nqn n THR 323 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2nqn s ALA 324 N -1.80 2.27 0.62 6.98 0.00 -1.26 -5.09 121.76 123.47 2nqn s ALA 324 Ca 0.28 -1.90 -0.17 0.00 0.00 0.00 0.00 51.96 50.17 2nqn s ALA 324 Cb 0.20 0.28 -0.02 0.00 0.00 0.00 0.00 23.12 23.57 2nqn s ALA 324 CO 0.11 -0.12 1.13 -1.12 0.00 0.00 0.00 175.76 175.76 2nqn s SER 325 N -3.43 5.27 -0.07 0.00 0.01 -1.26 -4.88 113.70 109.35 2nqn s SER 325 Ca 0.30 2.13 0.18 0.00 1.31 0.00 0.00 55.95 59.87 2nqn s SER 325 Cb 0.05 -2.57 0.64 0.00 0.21 0.00 0.00 66.02 64.34 2nqn s SER 325 CO 0.12 -1.52 1.54 0.61 0.41 0.00 0.00 173.24 174.40 2nqn n GLY 326 N -0.10 2.77 3.21 3.44 0.00 -1.26 -4.94 105.19 108.30 2nqn n GLY 326 Ca 0.11 -0.79 -0.22 0.00 0.00 0.00 0.00 46.02 45.13 2nqn n GLY 326 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2nqn s LEU 327 N -1.55 2.24 0.81 0.99 1.02 -1.26 -4.83 118.68 116.10 2nqn s LEU 327 Ca 0.46 -0.58 -0.11 0.00 0.02 0.00 0.00 54.13 53.93 2nqn s LEU 327 Cb 0.28 -0.72 0.08 0.00 0.02 0.00 0.00 46.19 45.85 2nqn s LEU 327 CO 0.25 0.03 1.12 -2.84 0.02 0.00 0.00 176.35 174.93 2nqn s PRO 328 N -1.52 1.87 0.65 1.29 0.02 -1.26 -5.02 135.00 131.02 2nqn s PRO 328 Ca 0.03 1.34 -0.11 0.00 0.02 0.00 0.00 61.00 62.29 2nqn s PRO 328 Cb -0.09 -1.84 -0.01 0.00 0.02 0.00 0.00 34.50 32.57 2nqn s PRO 328 CO 0.02 -1.96 1.04 0.00 -0.33 0.00 0.00 177.00 175.77 2nqn s ALA 329 N -2.73 3.04 0.36 -1.55 0.00 -1.26 -4.95 121.76 114.67 2nqn s ALA 329 Ca 0.64 -0.25 0.08 0.00 0.00 0.00 0.00 51.96 52.43 2nqn s ALA 329 Cb -0.20 -3.01 -0.03 0.00 0.00 0.00 0.00 23.12 19.89 2nqn s ALA 329 CO 0.55 -0.87 0.28 1.03 0.00 0.00 0.00 175.76 176.75 2nqn s ARG 330 N -5.22 2.58 0.01 0.00 0.52 -1.26 -4.37 118.95 111.21 2nqn s ARG 330 Ca 0.56 -1.43 -0.14 0.00 -0.52 0.00 0.00 55.73 54.20 2nqn s ARG 330 Cb -0.11 -2.37 0.02 0.00 0.52 0.00 0.00 34.95 33.01 2nqn s ARG 330 CO 0.52 0.02 0.31 1.14 0.02 0.00 0.00 175.30 177.31 2nqn s GLN 331 N -4.00 0.74 -0.03 3.54 -2.07 -0.61 -4.95 119.66 112.28 2nqn s GLN 331 Ca 0.42 -0.35 -0.28 0.00 -1.82 0.00 0.00 55.36 53.33 2nqn s GLN 331 Cb -0.04 0.32 -0.03 0.00 -1.09 0.00 0.00 33.01 32.18 2nqn s GLN 331 CO 0.26 -0.22 0.91 0.50 -1.32 0.00 0.00 175.29 175.41 2nqn s ARG 332 N -1.94 4.50 0.07 9.60 3.52 -1.26 -0.82 118.95 132.63 2nqn s ARG 332 Ca -0.09 1.26 -0.07 0.00 -0.13 0.00 0.00 55.73 56.70 2nqn s ARG 332 Cb -0.03 -3.47 -0.01 0.00 -1.56 0.00 0.00 34.95 29.88 2nqn s ARG 332 CO 0.01 -0.06 0.14 0.08 -0.81 0.00 0.00 175.30 174.66 2nqn s VAL 333 N 1.11 0.16 0.08 7.11 1.01 0.56 -4.95 120.40 125.48 2nqn s VAL 333 Ca 0.47 -1.28 -0.14 0.00 0.00 0.00 0.00 61.98 61.03 2nqn s VAL 333 Cb -0.20 -1.32 -0.06 0.00 0.00 0.00 0.00 36.38 34.80 2nqn s VAL 333 CO 0.24 -0.71 0.48 -0.13 0.00 0.00 0.00 175.10 174.98 2nqn s ARG 334 N -3.72 3.94 0.16 2.72 0.52 -1.26 0.90 118.95 122.21 2nqn s ARG 334 Ca 0.04 0.43 -0.17 0.00 -0.52 0.00 0.00 55.73 55.51 2nqn s ARG 334 Cb 0.05 -3.07 -0.07 0.00 0.52 0.00 0.00 34.95 32.38 2nqn s ARG 334 CO -0.10 0.58 0.61 0.99 0.02 0.00 0.00 175.30 177.40 2nqn s THR 335 N -1.30 4.74 -1.28 0.02 2.01 -0.77 -1.46 115.64 117.60 2nqn s THR 335 Ca 0.32 1.05 0.12 0.00 0.31 0.00 0.00 61.69 63.49 2nqn s THR 335 Cb -0.16 -3.81 0.23 0.00 0.01 0.00 0.00 72.50 68.78 2nqn s THR 335 CO 0.17 0.29 1.11 0.00 -0.69 0.00 0.00 174.62 175.51 2nqn n ALA 336 N 0.95 2.32 -2.65 7.40 0.00 0.36 -0.84 120.51 128.05 2nqn n ALA 336 Ca -0.05 -0.91 -0.20 0.00 0.00 0.00 0.00 53.44 52.28 2nqn n ALA 336 Cb 0.51 -0.46 -0.13 0.00 0.00 0.00 0.00 19.45 19.38 2nqn n ALA 336 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2nqn s SER 337 N -1.02 1.76 0.06 0.00 0.01 -1.25 -4.93 113.70 108.34 2nqn s SER 337 Ca 0.21 -0.53 -0.29 0.00 1.31 0.00 0.00 55.95 56.65 2nqn s SER 337 Cb 0.12 -0.09 -0.05 0.00 0.21 0.00 0.00 66.02 66.21 2nqn s SER 337 CO 0.17 0.00 0.93 -0.60 0.41 0.00 0.00 173.24 174.15 2nqn s ARG 338 N -1.40 4.62 -0.12 12.44 3.52 -1.26 -4.18 118.95 132.57 2nqn s ARG 338 Ca 0.01 1.36 0.01 0.00 -0.13 0.00 0.00 55.73 56.98 2nqn s ARG 338 Cb -0.09 -3.40 -0.01 0.00 -1.56 0.00 0.00 34.95 29.89 2nqn s ARG 338 CO 0.02 0.15 -0.15 -0.51 -0.81 0.00 0.00 175.30 174.00 2nqn s LEU 339 N 0.29 2.63 -0.22 -0.88 1.43 0.36 -4.97 118.68 117.32 2nqn s LEU 339 Ca 0.47 -0.34 -0.25 0.00 -1.03 0.00 0.00 54.13 52.98 2nqn s LEU 339 Cb -0.22 -1.58 -0.01 0.00 0.03 0.00 0.00 46.19 44.41 2nqn s LEU 339 CO 0.28 0.18 0.82 -0.54 0.23 0.00 0.00 176.35 177.32 2nqn s LYS 340 N 0.23 4.22 -0.06 1.70 -0.14 -1.26 -1.01 119.74 123.42 2nqn s LYS 340 Ca -0.10 0.95 -0.03 0.00 -1.36 0.00 0.00 55.97 55.44 2nqn s LYS 340 Cb -0.16 -3.62 0.03 0.00 -1.68 0.00 0.00 37.83 32.40 2nqn s LYS 340 CO 0.06 -0.45 0.13 0.21 -0.76 0.00 0.00 175.35 174.53 2nqn s LYS 341 N 2.60 0.09 -0.22 1.68 2.47 -1.26 -4.97 119.74 120.12 2nqn s LYS 341 Ca 0.36 0.31 -0.08 0.00 -1.56 0.00 0.00 55.97 54.99 2nqn s LYS 341 Cb -0.16 -0.14 -0.04 0.00 -1.46 0.00 0.00 37.83 36.04 2nqn s LYS 341 CO 0.09 -0.14 0.09 0.99 0.16 0.00 0.00 175.35 176.55 2nqn s THR 342 N 0.94 4.78 0.58 3.43 2.01 -1.26 -2.54 115.64 123.57 2nqn s THR 342 Ca -0.07 -0.03 -0.20 0.00 0.31 0.00 0.00 61.69 61.70 2nqn s THR 342 Cb -0.09 -3.20 -0.04 0.00 0.01 0.00 0.00 72.50 69.17 2nqn s THR 342 CO -0.04 0.38 1.29 -2.65 -0.69 0.00 0.00 174.62 172.90 2nqn n PRO 343 N 4.26 1.44 0.00 4.92 -0.02 -1.16 -3.76 135.00 140.67 2nqn n PRO 343 Ca -0.16 0.54 0.00 0.00 -2.02 0.00 0.00 63.50 61.86 2nqn n PRO 343 Cb 0.52 -2.50 0.00 0.00 -0.02 0.00 0.00 33.50 31.49 2nqn n PRO 343 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2nqn n GLY 344 N 0.87 0.62 3.03 -1.23 0.00 0.53 -5.00 105.19 104.02 2nqn n GLY 344 Ca 0.12 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.97 2nqn n GLY 344 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2nqn s ARG 345 N 0.00 0.64 -0.32 1.61 0.52 -1.17 -4.60 118.95 115.64 2nqn s ARG 345 Ca 0.00 -0.42 -0.29 0.00 -0.52 0.00 0.00 55.73 54.50 2nqn s ARG 345 Cb 0.00 -0.59 -0.00 0.00 0.52 0.00 0.00 34.95 34.88 2nqn s ARG 345 CO 0.00 0.15 1.39 -1.17 0.02 0.00 0.00 175.30 175.69 2nqn s LEU 346 N -0.54 3.79 -0.36 2.53 2.96 -0.66 -4.14 118.68 122.27 2nqn s LEU 346 Ca 0.01 1.17 -0.14 0.00 -0.22 0.00 0.00 54.13 54.95 2nqn s LEU 346 Cb -0.05 -3.54 -0.01 0.00 0.50 0.00 0.00 46.19 43.10 2nqn s LEU 346 CO 0.00 -1.22 0.27 -0.62 -1.32 0.00 0.00 176.35 173.46 2nqn s ASP 347 N 3.38 6.08 -1.23 3.68 -1.08 -0.64 -1.67 116.67 125.19 2nqn s ASP 347 Ca 0.60 -0.50 -0.11 0.00 -0.52 0.00 0.00 52.55 52.02 2nqn s ASP 347 Cb -0.17 -2.15 0.18 0.00 -1.46 0.00 0.00 42.92 39.32 2nqn s ASP 347 CO 0.27 -0.29 1.63 0.49 0.52 0.00 0.00 175.17 177.79 2nqn n PHE 348 N 5.15 3.85 -1.38 -5.34 3.01 0.11 -1.14 117.46 121.72 2nqn n PHE 348 Ca -0.12 -3.07 -0.30 0.00 1.01 0.00 0.00 57.45 54.98 2nqn n PHE 348 Cb 0.49 -1.99 0.12 0.00 -0.01 0.00 0.00 39.48 38.09 2nqn n PHE 348 CO 0.00 0.00 0.00 -0.65 1.01 0.00 0.00 176.76 177.12 2nqn s GLN 349 N 0.58 1.64 -0.11 -1.08 -0.21 -0.84 -4.58 119.66 115.06 2nqn s GLN 349 Ca 0.40 0.71 -0.03 0.00 0.02 0.00 0.00 55.36 56.46 2nqn s GLN 349 Cb 0.03 -1.86 -0.03 0.00 1.00 0.00 0.00 33.01 32.15 2nqn s GLN 349 CO 0.01 -1.95 -0.00 1.03 -2.12 0.00 0.00 175.29 172.26 2nqn s ARG 350 N -5.05 3.18 0.31 2.91 3.00 -1.26 0.03 118.95 122.07 2nqn s ARG 350 Ca 0.62 -0.42 0.06 0.00 0.00 0.00 0.00 55.73 55.98 2nqn s ARG 350 Cb -0.16 -2.85 -0.03 0.00 0.00 0.00 0.00 34.95 31.91 2nqn s ARG 350 CO 0.55 0.59 0.27 0.20 0.00 0.00 0.00 175.30 176.92 2nqn s GLY 351 N -0.56 2.16 -0.27 -3.53 0.00 0.06 -2.84 107.32 102.35 2nqn s GLY 351 Ca 0.09 -1.99 0.03 0.00 0.00 0.00 0.00 44.72 42.85 2nqn s GLY 351 CO 0.02 -1.43 -0.08 0.14 0.00 0.00 0.00 173.10 171.76 2nqn s VAL 352 N -3.51 2.04 -0.01 1.40 1.01 0.10 -0.93 120.40 120.51 2nqn s VAL 352 Ca 0.40 -1.65 -0.29 0.00 0.00 0.00 0.00 61.98 60.44 2nqn s VAL 352 Cb 0.03 -2.23 -0.03 0.00 0.00 0.00 0.00 36.38 34.14 2nqn s VAL 352 CO 0.25 -0.13 0.93 -0.22 0.00 0.00 0.00 175.10 175.94 2nqn s LEU 353 N 1.14 4.36 0.11 3.92 2.96 -1.26 -1.75 118.68 128.16 2nqn s LEU 353 Ca -0.06 1.58 -0.18 0.00 -0.22 0.00 0.00 54.13 55.25 2nqn s LEU 353 Cb -0.20 -3.49 0.04 0.00 0.50 0.00 0.00 46.19 43.05 2nqn s LEU 353 CO -0.06 -0.24 0.45 0.00 -1.32 0.00 0.00 176.35 175.19 2nqn s GLN 354 N 0.97 1.09 0.04 1.98 -2.07 -0.31 -4.99 119.66 116.37 2nqn s GLN 354 Ca 0.50 -0.58 -0.23 0.00 -1.82 0.00 0.00 55.36 53.23 2nqn s GLN 354 Cb -0.20 0.49 -0.06 0.00 -1.09 0.00 0.00 33.01 32.14 2nqn s GLN 354 CO 0.26 -0.43 0.69 1.03 -1.32 0.00 0.00 175.29 175.53 2nqn s ARG 355 N -3.51 4.42 0.00 9.60 0.52 -1.26 -0.60 118.95 128.12 2nqn s ARG 355 Ca 0.01 0.93 0.00 0.00 -0.52 0.00 0.00 55.73 56.15 2nqn s ARG 355 Cb 0.01 -3.34 0.00 0.00 0.52 0.00 0.00 34.95 32.14 2nqn s ARG 355 CO -0.10 0.36 0.00 0.27 0.02 0.00 0.00 175.30 175.85 2nqn n ASN 356 N 2.60 0.00 -0.10 0.23 0.23 0.19 -4.88 115.26 113.54 2nqn n ASN 356 Ca -0.05 0.00 -0.11 0.00 -0.53 0.00 0.00 54.58 53.90 2nqn n ASN 356 Cb 0.50 0.00 -0.03 0.00 -2.08 0.00 0.00 39.78 38.17 2nqn n ASN 356 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2nqn h ALA 357 N -1.41 0.38 0.00 -2.53 0.00 -1.98 -2.76 119.26 110.97 2nqn h ALA 357 Ca 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.72 2nqn h ALA 357 Cb 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.68 2nqn h ALA 357 CO 0.00 0.07 0.00 -0.25 0.00 0.00 0.00 179.25 179.07 2nqn n ASP 358 N -4.65 0.19 -0.62 0.00 9.92 -1.26 -4.77 116.55 115.36 2nqn n ASP 358 Ca -0.03 -1.82 -0.08 0.00 -0.53 0.00 0.00 54.79 52.33 2nqn n ASP 358 Cb 0.21 -0.09 -0.03 0.00 -0.64 0.00 0.00 41.12 40.56 2nqn n ASP 358 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2nqn n GLY 359 N 0.34 1.00 3.79 0.44 0.00 -1.04 -4.98 105.19 104.73 2nqn n GLY 359 Ca 0.00 -0.58 -0.39 0.00 0.00 0.00 0.00 46.02 45.06 2nqn n GLY 359 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2nqn s GLU 360 N -2.59 4.40 -0.11 1.61 2.56 -1.26 -4.73 118.70 118.59 2nqn s GLU 360 Ca 0.00 0.98 -0.24 0.00 0.00 0.00 0.00 54.97 55.72 2nqn s GLU 360 Cb 0.00 -3.18 -0.03 0.00 2.00 0.00 0.00 34.13 32.92 2nqn s GLU 360 CO 0.00 0.56 0.73 -1.17 -0.56 0.00 0.00 175.26 174.82 2nqn s LEU 361 N -1.30 4.25 0.06 2.70 2.96 -1.26 0.54 118.68 126.63 2nqn s LEU 361 Ca 0.35 1.14 0.00 0.00 -0.22 0.00 0.00 54.13 55.40 2nqn s LEU 361 Cb -0.21 -3.10 -0.03 0.00 0.50 0.00 0.00 46.19 43.35 2nqn s LEU 361 CO 0.23 -0.22 -0.05 -1.83 -1.32 0.00 0.00 176.35 173.17 2nqn s GLU 362 N 1.32 0.60 0.02 1.98 -1.05 0.23 -4.14 118.70 117.65 2nqn s GLU 362 Ca 0.37 -1.05 0.04 0.00 -0.15 0.00 0.00 54.97 54.17 2nqn s GLU 362 Cb -0.17 -0.00 -0.03 0.00 -0.44 0.00 0.00 34.13 33.48 2nqn s GLU 362 CO 0.16 -0.05 -0.07 0.14 0.95 0.00 0.00 175.26 176.39 2nqn s VAL 363 N -2.92 3.64 0.13 1.83 -7.23 -0.54 -1.16 120.40 114.15 2nqn s VAL 363 Ca 0.01 -0.83 0.09 0.00 -1.81 0.00 0.00 61.98 59.44 2nqn s VAL 363 Cb 0.01 -2.60 -0.04 0.00 0.56 0.00 0.00 36.38 34.31 2nqn s VAL 363 CO -0.05 0.35 -0.21 -0.89 -0.31 0.00 0.00 175.10 173.99 2nqn s THR 364 N -1.03 1.89 0.59 5.32 2.01 -0.72 -0.48 115.64 123.22 2nqn s THR 364 Ca 0.18 -1.73 -0.15 0.00 0.31 0.00 0.00 61.69 60.29 2nqn s THR 364 Cb -0.11 -1.76 -0.04 0.00 0.01 0.00 0.00 72.50 70.59 2nqn s THR 364 CO 0.09 -0.12 1.04 0.28 -0.69 0.00 0.00 174.62 175.22 2nqn s THR 365 N -1.46 3.99 -0.27 -0.82 -1.32 -1.26 0.02 115.64 114.51 2nqn s THR 365 Ca 0.12 0.91 0.19 0.00 -1.21 0.00 0.00 61.69 61.70 2nqn s THR 365 Cb -0.09 -3.46 0.15 0.00 -1.51 0.00 0.00 72.50 67.60 2nqn s THR 365 CO 0.06 -0.58 1.43 0.71 -2.21 0.00 0.00 174.62 174.02 2nqn h THR 366 N 0.41 0.43 0.00 5.08 1.35 -1.85 -3.43 112.91 114.91 2nqn h THR 366 Ca -0.46 -1.62 0.00 0.00 -0.55 0.00 0.00 66.41 63.77 2nqn h THR 366 Cb 1.21 2.15 0.00 0.00 -1.73 0.00 0.00 68.15 69.78 2nqn h THR 366 CO 0.58 0.24 0.00 0.61 -0.25 0.00 0.00 175.52 176.70 2nqn n GLY 367 N 1.18 0.47 3.71 5.82 0.00 -1.26 -5.01 105.19 110.10 2nqn n GLY 367 Ca 0.02 -1.43 -0.42 0.00 0.00 0.00 0.00 46.02 44.19 2nqn n GLY 367 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2nqn s HIS 368 N -3.47 2.53 -2.08 1.61 2.46 -1.26 -4.87 115.29 110.21 2nqn s HIS 368 Ca 0.00 0.16 0.16 0.00 0.47 0.00 0.00 55.06 55.85 2nqn s HIS 368 Cb 0.00 -4.16 0.47 0.00 -0.13 0.00 0.00 32.58 28.76 2nqn s HIS 368 CO 0.00 -4.58 1.38 1.04 -2.47 0.00 0.00 174.74 170.11 2nqn n GLN 369 N 4.82 2.05 -1.49 2.88 1.13 -1.26 -4.91 117.38 120.60 2nqn n GLN 369 Ca 0.17 -1.62 -0.35 0.00 -1.94 0.00 0.00 57.00 53.26 2nqn n GLN 369 Cb 0.37 -1.38 0.09 0.00 0.11 0.00 0.00 30.24 29.43 2nqn n GLN 369 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 2nqn s GLY 370 N -1.13 2.49 -0.05 1.08 0.00 -1.26 -4.89 107.32 103.55 2nqn s GLY 370 Ca 0.32 0.99 0.08 0.00 0.00 0.00 0.00 44.72 46.10 2nqn s GLY 370 CO 0.23 1.41 1.12 -1.14 0.00 0.00 0.00 173.10 174.72 2nqn n SER 371 N -2.54 2.37 -0.13 1.64 3.41 -1.26 -3.74 113.62 113.37 2nqn n SER 371 Ca 0.14 -2.21 0.13 0.00 -0.26 0.00 0.00 58.87 56.68 2nqn n SER 371 Cb 0.50 -0.40 0.41 0.00 -0.26 0.00 0.00 64.21 64.45 2nqn n SER 371 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2nqn n HIS 372 N 0.34 0.00 -4.20 7.33 1.44 -1.26 -4.54 115.22 114.33 2nqn n HIS 372 Ca 0.11 0.00 -0.14 0.00 -2.01 0.00 0.00 57.72 55.68 2nqn n HIS 372 Cb 0.47 -0.20 -0.11 0.00 0.12 0.00 0.00 29.99 30.27 2nqn n HIS 372 CO 0.00 0.00 0.00 0.96 -2.81 0.00 0.00 176.34 174.49 2nqn s ILE 373 N -2.68 1.00 -0.40 0.61 -4.36 -1.25 -5.05 121.20 109.07 2nqn s ILE 373 Ca 0.21 -1.78 0.09 0.00 -0.26 0.00 0.00 60.65 58.90 2nqn s ILE 373 Cb 0.19 -1.53 -0.09 0.00 1.25 0.00 0.00 42.46 42.28 2nqn s ILE 373 CO 0.56 -0.63 0.36 0.33 0.24 0.00 0.00 174.94 175.81 2nqn n PHE 374 N 0.30 0.00 0.33 1.37 7.35 -1.26 -4.69 117.46 120.86 2nqn n PHE 374 Ca -0.14 0.00 0.20 0.00 -0.76 0.00 0.00 57.45 56.75 2nqn n PHE 374 Cb 0.59 -0.00 1.07 0.00 0.35 0.00 0.00 39.48 41.48 2nqn n PHE 374 CO 0.00 0.00 0.00 0.66 -0.76 0.00 0.00 176.76 176.66 2nqn h SER 375 N 0.00 0.00 0.27 -2.13 4.64 -1.97 -2.57 113.55 111.79 2nqn h SER 375 Ca 0.00 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.28 2nqn h SER 375 Cb 0.20 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.29 2nqn h SER 375 CO 0.00 0.00 -0.18 0.77 -0.87 0.00 0.00 176.83 176.55 2nqn h SER 376 N 0.00 0.00 0.29 4.97 4.64 -1.91 0.14 113.55 121.67 2nqn h SER 376 Ca 0.00 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.20 2nqn h SER 376 Cb 0.22 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.30 2nqn h SER 376 CO 0.00 0.18 -0.48 -0.26 -0.87 0.00 0.00 176.83 175.40 2nqn h PHE 377 N 0.00 0.28 0.18 4.77 -1.00 -1.81 -0.19 116.94 119.18 2nqn h PHE 377 Ca -0.00 -0.09 -0.28 0.00 2.81 0.00 0.00 57.97 60.41 2nqn h PHE 377 Cb 0.36 -0.06 0.02 0.00 3.61 0.00 0.00 35.95 39.88 2nqn h PHE 377 CO 0.00 0.67 -1.31 1.03 -1.61 0.00 0.00 178.31 177.09 2nqn h SER 378 N 0.19 0.59 0.51 2.17 0.87 -1.59 -3.34 113.55 112.95 2nqn h SER 378 Ca 0.01 -0.92 -0.09 0.00 -1.23 0.00 0.00 61.79 59.56 2nqn h SER 378 Cb 0.92 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 62.68 2nqn h SER 378 CO 0.07 1.61 -0.45 -0.07 -0.53 0.00 0.00 176.83 177.46 2nqn h LEU 379 N -0.12 0.00-10.69 2.23 3.38 -0.95 -3.45 115.31 105.71 2nqn h LEU 379 Ca -0.25 0.00 -0.48 0.00 0.09 0.00 0.00 57.88 57.24 2nqn h LEU 379 Cb 1.91 0.00 0.05 0.00 0.09 0.00 0.00 40.66 42.71 2nqn h LEU 379 CO 0.17 0.45 -0.01 -0.83 0.09 0.00 0.00 178.44 178.31 2nqn s GLY 380 N -4.36 1.73 0.00 0.83 0.00 -0.09 -4.83 107.32 100.60 2nqn s GLY 380 Ca -0.02 -2.04 0.00 0.00 0.00 0.00 0.00 44.72 42.66 2nqn s GLY 380 CO 0.73 -1.51 0.55 1.16 0.00 0.00 0.00 173.10 174.03 2nqn n ASN 381 N -2.51 0.00 -3.71 1.64 0.23 -0.11 -4.91 115.26 105.90 2nqn n ASN 381 Ca 0.16 -1.10 -0.04 0.00 -0.53 0.00 0.00 54.58 53.08 2nqn n ASN 381 Cb 0.61 -0.02 -0.01 0.00 -2.08 0.00 0.00 39.78 38.28 2nqn n ASN 381 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2nqn s PHE 383 N -3.20 3.22 -0.51 0.00 0.40 0.40 -0.76 117.98 117.53 2nqn s PHE 383 Ca 0.11 0.18 -0.15 0.00 -0.60 0.00 0.00 56.93 56.47 2nqn s PHE 383 Cb -0.01 -1.87 0.11 0.00 0.51 0.00 0.00 43.02 41.76 2nqn s PHE 383 CO 0.00 0.41 0.45 0.42 0.70 0.00 0.00 175.22 177.20 2nqn s ILE 384 N -0.60 5.13 -0.89 0.64 1.01 0.10 -0.54 121.20 126.05 2nqn s ILE 384 Ca 0.10 -1.36 -0.23 0.00 0.00 0.00 0.00 60.65 59.16 2nqn s ILE 384 Cb -0.12 -4.21 0.06 0.00 0.01 0.00 0.00 42.46 38.20 2nqn s ILE 384 CO 0.02 -0.75 1.29 -0.69 0.00 0.00 0.00 174.94 174.81 2nqn s VAL 385 N 1.60 4.07 -0.13 2.92 1.01 -0.68 -1.99 120.40 127.19 2nqn s VAL 385 Ca 0.04 -0.57 -0.26 0.00 0.00 0.00 0.00 61.98 61.19 2nqn s VAL 385 Cb -0.28 -4.93 -0.02 0.00 0.00 0.00 0.00 36.38 31.16 2nqn s VAL 385 CO 0.04 -1.78 0.84 -0.76 0.00 0.00 0.00 175.10 173.43 2nqn s LEU 386 N 4.64 4.23 0.48 3.92 1.43 -0.29 -4.36 118.68 128.73 2nqn s LEU 386 Ca 0.38 1.26 -0.22 0.00 -1.03 0.00 0.00 54.13 54.52 2nqn s LEU 386 Cb -0.05 -3.27 -0.10 0.00 0.03 0.00 0.00 46.19 42.81 2nqn s LEU 386 CO -0.01 -0.33 0.84 -0.62 0.23 0.00 0.00 176.35 176.45 2nqn n GLU 387 N 4.79 0.99 -0.20 1.70 4.71 -1.26 -1.63 120.64 129.74 2nqn n GLU 387 Ca 0.04 0.36 0.00 0.00 -0.01 0.00 0.00 57.16 57.55 2nqn n GLU 387 Cb 0.49 -1.91 0.08 0.00 -1.01 0.00 0.00 31.44 29.10 2nqn n GLU 387 CO 0.00 0.00 0.00 -0.09 0.09 0.00 0.00 177.13 177.13 2nqn h ARG 388 N 1.01 0.08 0.00 3.49 2.43 -1.93 -2.16 114.38 117.29 2nqn h ARG 388 Ca -0.45 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.72 2nqn h ARG 388 Cb 1.36 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.90 2nqn h ARG 388 CO 0.53 0.05 -0.18 -0.25 -1.51 0.00 0.00 179.97 178.61 2nqn n ASP 389 N -5.32 0.23 -4.75 -3.80 8.00 -1.26 -0.35 116.55 109.31 2nqn n ASP 389 Ca 0.08 0.26 -0.34 0.00 0.71 0.00 0.00 54.79 55.50 2nqn n ASP 389 Cb 0.34 -0.26 0.07 0.00 -0.02 0.00 0.00 41.12 41.25 2nqn n ASP 389 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 2nqn s ARG 390 N -3.01 2.51 0.00 -1.24 3.52 -0.81 -4.65 118.95 115.26 2nqn s ARG 390 Ca 0.13 1.58 0.00 0.00 -0.13 0.00 0.00 55.73 57.30 2nqn s ARG 390 Cb 0.18 -1.90 0.00 0.00 -1.56 0.00 0.00 34.95 31.67 2nqn s ARG 390 CO 0.59 -1.51 0.00 0.41 -0.81 0.00 0.00 175.30 173.98 2nqn n GLY 391 N -0.05 5.41 3.50 8.12 0.00 -1.26 -2.98 105.19 117.93 2nqn n GLY 391 Ca 0.12 -1.93 -0.38 0.00 0.00 0.00 0.00 46.02 43.82 2nqn n GLY 391 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2nqn n ASN 392 N 0.00 -0.66 -4.20 1.61 3.02 -1.05 -4.44 115.26 109.53 2nqn n ASN 392 Ca 0.00 0.75 -0.32 0.00 -0.03 0.00 0.00 54.58 54.98 2nqn n ASN 392 Cb 0.00 -1.22 -0.17 0.00 -0.61 0.00 0.00 39.78 37.78 2nqn n ASN 392 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2nqn s VAL 393 N -1.68 2.05 0.26 2.41 1.01 -0.18 -4.93 120.40 119.34 2nqn s VAL 393 Ca 0.70 -1.00 -0.03 0.00 0.00 0.00 0.00 61.98 61.65 2nqn s VAL 393 Cb -0.44 -1.78 -0.05 0.00 0.00 0.00 0.00 36.38 34.11 2nqn s VAL 393 CO 0.53 0.55 0.49 -1.61 0.00 0.00 0.00 175.10 175.06 2nqn s GLU 394 N 0.50 3.59 0.27 2.72 0.41 -1.26 -0.49 118.70 124.43 2nqn s GLU 394 Ca -0.15 -0.13 -0.29 0.00 -0.41 0.00 0.00 54.97 53.99 2nqn s GLU 394 Cb -0.17 -2.72 -0.14 0.00 -1.78 0.00 0.00 34.13 29.32 2nqn s GLU 394 CO 0.05 0.28 1.14 0.28 -0.49 0.00 0.00 175.26 176.52 2nqn n VAL 395 N -0.84 1.68 0.00 2.63 0.31 -1.26 -1.75 118.33 119.10 2nqn n VAL 395 Ca -0.03 -0.42 0.00 0.00 -0.01 0.00 0.00 64.34 63.88 2nqn n VAL 395 Cb 0.54 -1.13 0.00 0.00 -0.91 0.00 0.00 33.84 32.34 2nqn n VAL 395 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2nqn n GLY 396 N 1.40 1.24 3.83 2.92 0.00 -0.02 -5.00 105.19 109.56 2nqn n GLY 396 Ca 0.10 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.80 2nqn n GLY 396 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2nqn s GLU 397 N -0.65 3.41 0.18 1.61 2.02 -0.72 -4.72 118.70 119.82 2nqn s GLU 397 Ca 0.00 0.96 -0.23 0.00 0.02 0.00 0.00 54.97 55.71 2nqn s GLU 397 Cb 0.00 -2.05 -0.08 0.00 0.10 0.00 0.00 34.13 32.10 2nqn s GLU 397 CO 0.00 -0.72 0.75 -1.58 0.02 0.00 0.00 175.26 173.73 2nqn s TRP 398 N -2.86 3.83 0.00 1.61 0.52 -1.26 -1.85 118.94 118.93 2nqn s TRP 398 Ca 0.59 1.55 -0.08 0.00 0.02 0.00 0.00 56.10 58.17 2nqn s TRP 398 Cb -0.13 -2.71 0.00 0.00 -1.15 0.00 0.00 33.47 29.48 2nqn s TRP 398 CO 0.46 0.47 0.16 0.54 0.02 0.00 0.00 176.95 178.60 2nqn s VAL 399 N -1.25 0.08 0.08 4.03 0.11 0.26 -4.94 120.40 118.78 2nqn s VAL 399 Ca 0.37 -0.67 -0.25 0.00 -2.93 0.00 0.00 61.98 58.50 2nqn s VAL 399 Cb -0.21 -0.47 -0.06 0.00 -1.53 0.00 0.00 36.38 34.11 2nqn s VAL 399 CO 0.24 -0.37 0.77 -1.61 -3.33 0.00 0.00 175.10 170.80 2nqn s GLU 400 N -1.41 4.52 -0.03 1.54 0.41 -1.26 -0.33 118.70 122.14 2nqn s GLU 400 Ca -0.14 1.10 0.04 0.00 -0.41 0.00 0.00 54.97 55.55 2nqn s GLU 400 Cb -0.07 -3.33 -0.00 0.00 -1.78 0.00 0.00 34.13 28.95 2nqn s GLU 400 CO 0.02 0.38 -0.13 0.08 -0.49 0.00 0.00 175.26 175.12 2nqn s VAL 401 N -0.41 1.08 -0.27 2.63 1.01 0.00 -1.69 120.40 122.74 2nqn s VAL 401 Ca 0.38 -0.54 0.03 0.00 0.00 0.00 0.00 61.98 61.85 2nqn s VAL 401 Cb -0.21 -0.93 0.07 0.00 0.00 0.00 0.00 36.38 35.30 2nqn s VAL 401 CO 0.24 0.32 -0.08 -0.70 0.00 0.00 0.00 175.10 174.88 2nqn s GLU 402 N 0.00 2.05 0.36 2.72 2.12 0.30 -1.58 118.70 124.68 2nqn s GLU 402 Ca -0.01 -1.40 -0.28 0.00 0.36 0.00 0.00 54.97 53.63 2nqn s GLU 402 Cb -0.09 -2.91 -0.11 0.00 0.26 0.00 0.00 34.13 31.29 2nqn s GLU 402 CO 0.01 -0.64 1.44 -2.14 -0.54 0.00 0.00 175.26 173.40 2nqn s PRO 403 N 1.10 4.17 0.43 4.30 0.02 -1.26 -0.45 135.00 143.29 2nqn s PRO 403 Ca -0.05 2.49 -0.26 0.00 0.02 0.00 0.00 61.00 63.20 2nqn s PRO 403 Cb -0.20 -2.99 -0.09 0.00 0.02 0.00 0.00 34.50 31.24 2nqn s PRO 403 CO -0.06 -0.45 1.40 -0.06 -0.33 0.00 0.00 177.00 177.50 2nqn s PHE 404 N -1.11 2.58 0.09 6.54 0.08 -0.06 -4.77 117.98 121.33 2nqn s PHE 404 Ca 0.52 1.29 -0.01 0.00 0.12 0.00 0.00 56.93 58.86 2nqn s PHE 404 Cb -0.45 -3.86 0.02 0.00 -0.57 0.00 0.00 43.02 38.16 2nqn s PHE 404 CO 0.61 -2.70 0.12 0.27 -0.10 0.00 0.00 175.22 173.42 2nqn n ASN 405 N -0.00 0.10 0.33 1.36 0.23 -1.26 -4.21 115.26 111.81 2nqn n ASN 405 Ca 0.04 -1.10 0.20 0.00 -0.53 0.00 0.00 54.58 53.18 2nqn n ASN 405 Cb 0.42 -0.08 1.04 0.00 -2.08 0.00 0.00 39.78 39.08 2nqn n ASN 405 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2nqn h ALA 406 N -0.95 1.20 -0.02 -2.53 0.00 -1.90 -2.08 119.26 112.98 2nqn h ALA 406 Ca -0.04 -0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.88 2nqn h ALA 406 Cb 0.13 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 2nqn h ALA 406 CO 0.04 -0.15 0.04 -0.07 0.00 0.00 0.00 179.25 179.11 2nqn h LEU 407 N 0.00 0.00 -1.24 0.00 3.38 -1.92 -2.71 115.31 112.82 2nqn h LEU 407 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2nqn h LEU 407 Cb 0.29 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.04 2nqn h LEU 407 CO -0.00 0.00 0.00 0.49 0.09 0.00 0.00 178.44 179.02 2nqn n PHE 408 N -3.45 0.01 0.00 1.13 3.01 -0.79 -5.00 117.46 112.37 2nqn n PHE 408 Ca -0.02 -0.03 0.00 0.00 1.01 0.00 0.00 57.45 58.40 2nqn n PHE 408 Cb 0.12 -0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.58 2nqn n PHE 408 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2nqn n GLY 409 N 0.15 2.25 0.90 1.37 0.00 -1.02 -4.97 105.19 103.87 2nqn n GLY 409 Ca 0.02 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.15 2nqn n GLY 409 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93