#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 -4.67 117.00 115.25 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 0.95 -0.32 -1.11 0.00 0.00 177.39 176.91 2nqn s MET 8 N 0.00 4.42 0.38 1.96 1.75 -1.06 -4.66 119.30 122.09 2nqn s MET 8 Ca 0.00 2.08 -0.14 0.00 -1.25 0.00 0.00 55.69 56.39 2nqn s MET 8 Cb 0.00 -3.14 -0.08 0.00 2.84 0.00 0.00 34.83 34.45 2nqn s MET 8 CO 0.00 -0.13 0.79 -1.54 -0.65 0.00 0.00 175.02 173.49 2nqn s SER 9 N -0.27 6.67 0.22 1.11 1.04 -1.26 0.13 113.70 121.33 2nqn s SER 9 Ca 0.51 1.28 -0.09 0.00 0.48 0.00 0.00 55.95 58.13 2nqn s SER 9 Cb -0.37 -2.38 0.31 0.00 0.10 0.00 0.00 66.02 63.68 2nqn s SER 9 CO 0.46 -0.33 1.74 0.25 0.98 0.00 0.00 173.24 176.33 2nqn h LEU 10 N 1.70 0.23 -0.58 2.42 6.46 -1.95 -1.08 115.31 122.51 2nqn h LEU 10 Ca -0.48 0.08 0.06 0.00 -0.12 0.00 0.00 57.88 57.43 2nqn h LEU 10 Cb 1.18 0.07 -0.06 0.00 -0.73 0.00 0.00 40.66 41.12 2nqn h LEU 10 CO 0.64 0.13 0.28 -0.78 -0.62 0.00 0.00 178.44 178.08 2nqn h ASP 11 N 0.41 0.37 0.23 1.25 1.82 -1.99 0.11 116.42 118.63 2nqn h ASP 11 Ca 0.33 0.04 -0.01 0.00 -0.39 0.00 0.00 57.03 57.00 2nqn h ASP 11 Cb 0.42 -0.02 0.00 0.00 0.68 0.00 0.00 39.33 40.42 2nqn h ASP 11 CO -0.33 0.24 -0.11 0.74 -1.61 0.00 0.00 179.24 178.17 2nqn h THR 12 N 0.52 0.83 -0.40 2.25 2.02 -1.65 -0.28 112.91 116.21 2nqn h THR 12 Ca 0.27 -0.33 0.04 0.00 0.77 0.00 0.00 66.41 67.16 2nqn h THR 12 Cb 0.23 1.03 -0.04 0.00 -1.74 0.00 0.00 68.15 67.62 2nqn h THR 12 CO -0.21 0.07 0.15 0.00 0.37 0.00 0.00 175.52 175.91 2nqn h ALA 13 N 0.27 0.47 -0.09 6.16 0.00 -1.01 0.13 119.26 125.19 2nqn h ALA 13 Ca -0.03 0.04 0.02 0.00 0.00 0.00 0.00 54.91 54.94 2nqn h ALA 13 Cb 0.35 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 2nqn h ALA 13 CO 0.05 -0.23 -0.02 1.25 0.00 0.00 0.00 179.25 180.30 2nqn h LEU 14 N 0.32 -0.09 -1.16 0.00 5.85 -0.72 0.68 115.31 120.20 2nqn h LEU 14 Ca 0.18 0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.92 2nqn h LEU 14 Cb 0.14 0.06 -0.04 0.00 0.37 0.00 0.00 40.66 41.19 2nqn h LEU 14 CO -0.17 -0.03 0.43 -1.13 -0.34 0.00 0.00 178.44 177.20 2nqn h ASN 15 N -0.00 0.90 -0.28 1.25 -1.24 -0.59 -0.56 115.58 115.05 2nqn h ASN 15 Ca 0.04 -0.06 -0.03 0.00 0.71 0.00 0.00 56.30 56.96 2nqn h ASN 15 Cb 0.07 -0.23 -0.01 0.00 0.73 0.00 0.00 38.32 38.88 2nqn h ASN 15 CO -0.09 0.70 0.05 -0.08 -1.29 0.00 0.00 177.43 176.72 2nqn h GLU 16 N 1.03 0.46 0.31 6.67 4.57 -0.17 -1.71 114.58 125.74 2nqn h GLU 16 Ca 0.27 -0.12 -0.02 0.00 -1.18 0.00 0.00 59.36 58.31 2nqn h GLU 16 Cb -0.02 -0.05 0.00 0.00 -0.16 0.00 0.00 28.75 28.52 2nqn h GLU 16 CO -0.05 0.57 -0.15 0.52 -1.18 0.00 0.00 179.01 178.72 2nqn h MET 17 N 0.28 -0.40 -0.62 1.92 2.86 -0.40 -3.21 114.93 115.36 2nqn h MET 17 Ca 0.09 0.03 -0.05 0.00 -2.06 0.00 0.00 59.70 57.71 2nqn h MET 17 Cb 0.33 0.09 -0.03 0.00 0.06 0.00 0.00 31.60 32.05 2nqn h MET 17 CO 0.00 -0.16 0.20 -0.07 1.06 0.00 0.00 176.91 177.94 2nqn h LEU 18 N -0.58 0.86 -2.26 1.22 3.38 -1.14 -2.68 115.31 114.11 2nqn h LEU 18 Ca -0.04 -0.14 -0.00 0.00 0.09 0.00 0.00 57.88 57.79 2nqn h LEU 18 Cb 0.42 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.95 2nqn h LEU 18 CO 0.07 0.80 -0.02 0.77 0.09 0.00 0.00 178.44 180.15 2nqn h SER 19 N 0.90 0.00 0.57 -0.43 4.64 -1.34 -2.29 113.55 115.59 2nqn h SER 19 Ca 0.20 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.52 2nqn h SER 19 Cb 0.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.33 2nqn h SER 19 CO -0.01 0.02 -1.15 0.54 -0.87 0.00 0.00 176.83 175.36 2nqn n ARG 20 N -3.20 0.45 -3.03 4.77 1.74 -1.02 -4.94 116.66 111.43 2nqn n ARG 20 Ca -0.02 0.01 -0.39 0.00 -0.77 0.00 0.00 57.85 56.68 2nqn n ARG 20 Cb 0.18 -1.66 -0.06 0.00 -1.02 0.00 0.00 32.46 29.90 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 -3.30 4.52 -0.20 1.55 1.01 -0.86 -5.07 120.40 118.05 2nqn s VAL 21 Ca 0.01 1.60 -0.03 0.00 0.00 0.00 0.00 61.98 63.56 2nqn s VAL 21 Cb 0.13 -4.09 -0.01 0.00 0.00 0.00 0.00 36.38 32.41 2nqn s VAL 21 CO 0.81 0.49 -0.07 -0.89 0.00 0.00 0.00 175.10 175.44 2nqn s THR 22 N -0.86 3.20 0.44 3.92 2.01 -1.26 -5.00 115.64 118.08 2nqn s THR 22 Ca 0.35 -0.56 -0.25 0.00 0.31 0.00 0.00 61.69 61.54 2nqn s THR 22 Cb -0.22 -2.43 -0.09 0.00 0.01 0.00 0.00 72.50 69.77 2nqn s THR 22 CO 0.24 0.46 1.24 -2.65 -0.69 0.00 0.00 174.62 173.22 2nqn n PRO 23 N 4.52 1.81 -1.38 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 61.61 2nqn n PRO 23 Cb 0.51 -2.35 0.09 0.00 -0.02 0.00 0.00 33.50 31.73 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 -1.73 3.23 0.00 2.45 1.02 -0.07 -4.97 118.68 118.62 2nqn s LEU 24 Ca 0.63 2.18 0.00 0.00 0.02 0.00 0.00 54.13 56.96 2nqn s LEU 24 Cb -0.50 -4.57 0.00 0.00 0.02 0.00 0.00 46.19 41.14 2nqn s LEU 24 CO 0.57 -2.21 0.00 0.35 0.02 0.00 0.00 176.35 175.08 2nqn n THR 25 N -2.96 0.00 -1.70 5.49 -2.24 -1.26 -4.69 114.28 106.91 2nqn n THR 25 Ca 0.12 -0.09 -0.43 0.00 -2.27 0.00 0.00 64.05 61.38 2nqn n THR 25 Cb 0.51 0.58 -0.02 0.00 -2.10 0.00 0.00 70.33 69.31 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 -0.46 1.65 -2.30 6.98 0.00 -1.26 -4.89 120.51 120.22 2nqn n ALA 26 Ca 0.00 0.39 -0.16 0.00 0.00 0.00 0.00 53.44 53.67 2nqn n ALA 26 Cb 0.00 -2.34 -0.10 0.00 0.00 0.00 0.00 19.45 17.01 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 -0.77 1.29 0.03 0.00 -2.07 -1.26 -1.08 119.66 115.80 2nqn s GLN 27 Ca 0.64 -1.66 -0.08 0.00 -1.82 0.00 0.00 55.36 52.44 2nqn s GLN 27 Cb -0.58 -0.43 -0.00 0.00 -1.09 0.00 0.00 33.01 30.91 2nqn s GLN 27 CO 0.52 -0.16 0.16 -1.83 -1.32 0.00 0.00 175.29 172.67 2nqn s GLU 28 N -3.92 0.63 -0.20 9.60 -1.05 -0.28 -4.84 118.70 118.63 2nqn s GLU 28 Ca 0.29 -0.61 -0.06 0.00 -0.15 0.00 0.00 54.97 54.45 2nqn s GLU 28 Cb 0.06 0.26 -0.03 0.00 -0.44 0.00 0.00 34.13 33.98 2nqn s GLU 28 CO 0.09 -0.17 0.02 0.99 0.95 0.00 0.00 175.26 177.14 2nqn s THR 29 N -2.34 4.19 0.10 1.83 2.01 -1.26 -0.30 115.64 119.88 2nqn s THR 29 Ca -0.07 -0.23 0.05 0.00 0.31 0.00 0.00 61.69 61.75 2nqn s THR 29 Cb -0.02 -2.90 -0.03 0.00 0.01 0.00 0.00 72.50 69.55 2nqn s THR 29 CO -0.03 0.43 -0.13 -0.76 -0.69 0.00 0.00 174.62 173.44 2nqn s LEU 30 N 0.88 2.36 0.62 4.42 1.43 -0.87 -4.92 118.68 122.61 2nqn s LEU 30 Ca 0.02 -0.75 -0.18 0.00 -1.03 0.00 0.00 54.13 52.19 2nqn s LEU 30 Cb -0.14 -0.50 -0.02 0.00 0.03 0.00 0.00 46.19 45.56 2nqn s LEU 30 CO 0.02 -0.14 1.22 -2.84 0.23 0.00 0.00 176.35 174.84 2nqn s PRO 31 N -2.39 2.78 0.25 1.29 0.02 -1.26 -2.01 135.00 133.67 2nqn s PRO 31 Ca 0.05 1.85 -0.03 0.00 0.02 0.00 0.00 61.00 62.89 2nqn s PRO 31 Cb -0.06 -1.90 0.49 0.00 0.02 0.00 0.00 34.50 33.05 2nqn s PRO 31 CO 0.02 -1.36 1.74 -0.07 -0.33 0.00 0.00 177.00 177.00 2nqn h LEU 32 N 0.64 0.38 -1.80 -5.54 3.38 -1.82 -2.08 115.31 108.47 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 0.05 0.00 0.00 0.09 0.00 0.00 40.66 42.11 2nqn h LEU 32 CO 0.54 0.15 0.05 1.62 0.09 0.00 0.00 178.44 180.89 2nqn h VAL 33 N 0.52 0.00 -0.47 1.22 3.04 -1.90 -0.17 116.25 118.48 2nqn h VAL 33 Ca 0.43 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 66.12 2nqn h VAL 33 Cb 0.64 0.60 0.00 0.00 -2.01 0.00 0.00 31.29 30.52 2nqn h VAL 33 CO -0.39 0.00 0.00 0.00 -1.01 0.00 0.00 177.57 176.17 2nqn n GLN 34 N -2.47 2.56 -0.09 4.17 6.02 -0.78 -4.57 117.38 122.21 2nqn n GLN 34 Ca -0.02 -2.25 0.12 0.00 -0.01 0.00 0.00 57.00 54.84 2nqn n GLN 34 Cb 0.09 -1.42 0.25 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 n PHE 36 N 1.05 2.65 -0.19 0.00 7.35 -1.26 -1.09 117.46 125.97 2nqn n PHE 36 Ca 0.17 -0.02 0.00 0.00 -0.76 0.00 0.00 57.45 56.84 2nqn n PHE 36 Cb 0.52 -2.69 0.00 0.00 0.35 0.00 0.00 39.48 37.66 2nqn n PHE 36 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 2nqn n GLY 37 N 4.04 2.20 3.85 7.13 0.00 0.62 -5.01 105.19 118.01 2nqn n GLY 37 Ca 0.17 0.00 -0.32 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 -0.15 3.96 -0.26 1.61 1.81 -0.25 -4.71 118.95 120.96 2nqn s ARG 38 Ca 0.00 0.82 -0.15 0.00 -1.72 0.00 0.00 55.73 54.69 2nqn s ARG 38 Cb 0.00 -2.24 -0.04 0.00 -0.45 0.00 0.00 34.95 32.22 2nqn s ARG 38 CO 0.00 -0.12 0.35 0.42 -0.68 0.00 0.00 175.30 175.27 2nqn s ILE 39 N -2.41 5.20 0.12 1.52 -1.09 -1.26 -0.90 121.20 122.37 2nqn s ILE 39 Ca 0.57 0.54 -0.34 0.00 -2.23 0.00 0.00 60.65 59.19 2nqn s ILE 39 Cb -0.10 -3.68 -0.13 0.00 -1.58 0.00 0.00 42.46 36.97 2nqn s ILE 39 CO 0.27 0.18 1.64 0.18 -1.23 0.00 0.00 174.94 175.97 2nqn n LEU 40 N 5.16 3.18 0.06 2.97 4.77 -0.58 -0.87 117.00 131.68 2nqn n LEU 40 Ca -0.09 1.06 -0.01 0.00 -0.03 0.00 0.00 56.01 56.94 2nqn n LEU 40 Cb 0.51 -1.42 -0.07 0.00 -2.33 0.00 0.00 43.42 40.11 2nqn n LEU 40 CO 0.37 -0.24 -0.08 0.00 -1.33 0.00 0.00 177.39 176.11 2nqn h ALA 41 N 6.55 0.64 -2.73 -1.18 0.00 -1.17 0.70 119.26 122.07 2nqn h ALA 41 Ca -0.46 -0.83 -0.17 0.00 0.00 0.00 0.00 54.91 53.46 2nqn h ALA 41 Cb 1.26 0.17 -0.19 0.00 0.00 0.00 0.00 17.79 19.03 2nqn h ALA 41 CO 0.90 0.96 -0.70 -1.12 0.00 0.00 0.00 179.25 179.29 2nqn s SER 42 N -6.09 0.43 0.53 0.00 0.01 -1.26 -4.79 113.70 102.53 2nqn s SER 42 Ca -0.01 -0.69 -0.21 0.00 1.31 0.00 0.00 55.95 56.35 2nqn s SER 42 Cb 0.08 0.12 -0.07 0.00 0.21 0.00 0.00 66.02 66.37 2nqn s SER 42 CO 0.80 -0.39 1.12 0.47 0.41 0.00 0.00 173.24 175.64 2nqn n ASP 43 N 1.04 1.60 -4.59 2.44 8.00 -1.26 -4.32 116.55 119.45 2nqn n ASP 43 Ca -0.20 0.94 -0.38 0.00 0.71 0.00 0.00 54.79 55.85 2nqn n ASP 43 Cb 0.57 -1.44 -0.11 0.00 -0.02 0.00 0.00 41.12 40.12 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 -1.37 5.30 -0.18 2.53 1.01 0.71 -4.91 120.40 123.50 2nqn s VAL 44 Ca 0.70 0.19 -0.03 0.00 0.00 0.00 0.00 61.98 62.84 2nqn s VAL 44 Cb -0.46 -3.54 -0.02 0.00 0.00 0.00 0.00 36.38 32.36 2nqn s VAL 44 CO 0.51 0.25 -0.05 -0.69 0.00 0.00 0.00 175.10 175.12 2nqn s VAL 45 N 1.76 3.58 0.07 2.92 1.01 -1.26 -0.06 120.40 128.42 2nqn s VAL 45 Ca 0.07 -0.45 -0.31 0.00 0.00 0.00 0.00 61.98 61.30 2nqn s VAL 45 Cb -0.16 -2.59 -0.08 0.00 0.00 0.00 0.00 36.38 33.56 2nqn s VAL 45 CO 0.11 0.47 1.56 -0.55 0.00 0.00 0.00 175.10 176.69 2nqn s SER 46 N 0.81 6.68 0.00 3.32 0.15 0.51 -4.85 113.70 120.31 2nqn s SER 46 Ca -0.02 2.40 0.28 0.00 0.70 0.00 0.00 55.95 59.31 2nqn s SER 46 Cb -0.15 -2.57 1.05 0.00 -1.71 0.00 0.00 66.02 62.65 2nqn s SER 46 CO 0.02 -0.82 1.79 -0.81 1.20 0.00 0.00 173.24 174.61 2nqn n PRO 47 N 5.24 0.11 -4.10 5.44 -0.04 -1.26 0.22 135.00 140.62 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 -0.09 0.00 -0.04 0.00 0.00 33.50 32.29 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 -2.91 1.14 0.30 1.53 0.05 -1.26 -4.82 118.68 112.71 2nqn s LEU 48 Ca 0.16 -1.15 -0.20 0.00 0.05 0.00 0.00 54.13 52.99 2nqn s LEU 48 Cb 0.19 0.77 -0.09 0.00 -2.05 0.00 0.00 46.19 45.00 2nqn s LEU 48 CO 0.57 -0.87 0.81 -1.81 -0.55 0.00 0.00 176.35 174.50 2nqn s ASP 49 N -3.06 7.04 -0.05 1.48 1.01 -1.26 -3.24 116.67 118.59 2nqn s ASP 49 Ca 0.27 1.52 -0.00 0.00 0.71 0.00 0.00 52.55 55.05 2nqn s ASP 49 Cb 0.05 -2.46 0.03 0.00 1.01 0.00 0.00 42.92 41.54 2nqn s ASP 49 CO 0.06 -0.10 -0.00 -0.69 0.21 0.00 0.00 175.17 174.64 2nqn s VAL 50 N -1.75 0.29 0.98 -1.27 1.01 0.11 -2.91 120.40 116.86 2nqn s VAL 50 Ca 0.50 0.10 -0.12 0.00 0.00 0.00 0.00 61.98 62.46 2nqn s VAL 50 Cb -0.14 -0.41 0.18 0.00 0.00 0.00 0.00 36.38 36.00 2nqn s VAL 50 CO 0.20 0.21 1.09 -2.16 0.00 0.00 0.00 175.10 174.43 2nqn s PRO 51 N 1.48 0.56 0.45 2.72 0.04 -1.26 -0.30 135.00 138.70 2nqn s PRO 51 Ca -0.03 0.70 0.27 0.00 0.04 0.00 0.00 61.00 61.99 2nqn s PRO 51 Cb -0.13 -1.74 0.80 0.00 0.04 0.00 0.00 34.50 33.47 2nqn s PRO 51 CO -0.03 -2.69 1.77 0.78 0.04 0.00 0.00 177.00 176.87 2nqn h GLY 52 N -1.87 0.00 -3.61 0.56 0.00 -1.89 0.69 103.07 96.95 2nqn h GLY 52 Ca -0.53 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 46.75 2nqn h GLY 52 CO 0.55 0.00 0.13 -0.11 0.00 0.00 0.00 176.54 177.10 2nqn s PHE 53 N -3.38 -0.53 0.21 5.60 -0.12 -1.26 -4.92 117.98 113.59 2nqn s PHE 53 Ca 0.05 0.65 -0.32 0.00 -0.05 0.00 0.00 56.93 57.26 2nqn s PHE 53 Cb 0.07 0.41 -0.12 0.00 -0.63 0.00 0.00 43.02 42.76 2nqn s PHE 53 CO 0.60 -0.68 1.73 -0.25 -0.05 0.00 0.00 175.22 176.57 2nqn n ASP 54 N 0.38 4.03 -4.18 1.98 9.92 -1.26 -4.32 116.55 123.10 2nqn n ASP 54 Ca -0.18 1.06 -0.11 0.00 -0.53 0.00 0.00 54.79 55.02 2nqn n ASP 54 Cb 0.60 -1.58 -0.10 0.00 -0.64 0.00 0.00 41.12 39.40 2nqn n ASP 54 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 2nqn s ASN 55 N 1.21 0.18 0.14 -2.24 4.22 -0.58 -1.75 114.94 116.12 2nqn s ASN 55 Ca 0.75 -1.34 -0.28 0.00 -2.14 0.00 0.00 52.86 49.85 2nqn s ASN 55 Cb -0.50 0.36 -0.07 0.00 1.28 0.00 0.00 41.25 42.33 2nqn s ASN 55 CO 0.32 -0.82 0.88 -0.55 -2.04 0.00 0.00 177.10 174.89 2nqn s SER 56 N -3.13 7.46 0.48 3.54 0.15 -0.12 -0.52 113.70 121.55 2nqn s SER 56 Ca 0.35 1.73 0.31 0.00 0.70 0.00 0.00 55.95 59.05 2nqn s SER 56 Cb 0.07 -2.55 1.27 0.00 -1.71 0.00 0.00 66.02 63.10 2nqn s SER 56 CO 0.10 0.06 1.92 0.00 1.20 0.00 0.00 173.24 176.51 2nqn h ALA 57 N 4.99 1.00 -2.42 5.45 0.00 -1.36 0.23 119.26 127.15 2nqn h ALA 57 Ca -0.44 0.00 0.18 0.00 0.00 0.00 0.00 54.91 54.65 2nqn h ALA 57 Cb 1.21 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.95 2nqn h ALA 57 CO 0.70 0.00 0.60 0.00 0.00 0.00 0.00 179.25 180.54 2nqn s MET 58 N -3.58 1.19 -0.01 0.00 0.23 -1.26 -4.79 119.30 111.08 2nqn s MET 58 Ca 0.02 -0.75 -0.30 0.00 -1.03 0.00 0.00 55.69 53.63 2nqn s MET 58 Cb 0.09 0.35 -0.04 0.00 -1.53 0.00 0.00 34.83 33.69 2nqn s MET 58 CO 0.51 -0.56 1.24 -0.51 -2.03 0.00 0.00 175.02 173.67 2nqn s ASP 59 N -3.32 7.02 0.00 -1.18 1.11 -1.26 -3.52 116.67 115.51 2nqn s ASP 59 Ca 0.20 1.93 0.00 0.00 0.18 0.00 0.00 52.55 54.86 2nqn s ASP 59 Cb -0.02 -2.56 0.00 0.00 1.07 0.00 0.00 42.92 41.41 2nqn s ASP 59 CO 0.04 -0.58 0.00 0.61 1.18 0.00 0.00 175.17 176.42 2nqn n GLY 60 N 3.38 0.76 2.96 0.21 0.00 0.13 -2.00 105.19 110.64 2nqn n GLY 60 Ca 0.11 0.32 -0.13 0.00 0.00 0.00 0.00 46.02 46.32 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 1.93 -0.13 -0.13 1.61 1.51 -0.11 -1.51 117.35 120.52 2nqn s TYR 61 Ca 0.00 0.33 -0.27 0.00 -1.01 0.00 0.00 57.07 56.13 2nqn s TYR 61 Cb 0.00 0.00 -0.02 0.00 -0.11 0.00 0.00 41.96 41.84 2nqn s TYR 61 CO 0.00 -0.09 0.87 0.00 -1.11 0.00 0.00 175.55 175.23 2nqn s ALA 62 N 0.36 3.45 0.34 3.71 0.00 0.25 -1.98 121.76 127.88 2nqn s ALA 62 Ca -0.02 0.17 0.04 0.00 0.00 0.00 0.00 51.96 52.14 2nqn s ALA 62 Cb -0.04 -3.26 -0.04 0.00 0.00 0.00 0.00 23.12 19.78 2nqn s ALA 62 CO -0.01 -0.56 0.15 0.14 0.00 0.00 0.00 175.76 175.48 2nqn s VAL 63 N 1.90 0.47 -0.02 0.00 -7.23 -0.68 -1.02 120.40 113.82 2nqn s VAL 63 Ca 0.42 -2.00 0.05 0.00 -1.81 0.00 0.00 61.98 58.64 2nqn s VAL 63 Cb -0.17 -2.49 -0.01 0.00 0.56 0.00 0.00 36.38 34.27 2nqn s VAL 63 CO 0.15 0.00 -0.18 -0.13 -0.31 0.00 0.00 175.10 174.63 2nqn s ARG 64 N -3.77 1.61 0.35 4.82 0.52 -1.26 -1.99 118.95 119.23 2nqn s ARG 64 Ca 0.32 -0.66 0.12 0.00 -0.52 0.00 0.00 55.73 54.99 2nqn s ARG 64 Cb 0.04 -1.50 0.91 0.00 0.52 0.00 0.00 34.95 34.92 2nqn s ARG 64 CO 0.17 0.36 1.80 -0.07 0.02 0.00 0.00 175.30 177.57 2nqn h LEU 65 N 5.84 0.61 -0.05 2.53 3.38 -1.95 -2.06 115.31 123.62 2nqn h LEU 65 Ca -0.36 0.08 -0.00 0.00 0.09 0.00 0.00 57.88 57.68 2nqn h LEU 65 Cb 1.15 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.87 2nqn h LEU 65 CO 0.48 0.20 0.02 0.00 0.09 0.00 0.00 178.44 179.23 2nqn h ALA 66 N 1.63 0.06 -0.59 1.53 0.00 -1.99 -1.66 119.26 118.24 2nqn h ALA 66 Ca 0.55 -0.11 0.05 0.00 0.00 0.00 0.00 54.91 55.41 2nqn h ALA 66 Cb 1.10 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.83 2nqn h ALA 66 CO -0.31 -0.33 0.31 -0.44 0.00 0.00 0.00 179.25 178.48 2nqn h ASP 67 N -0.12 0.46 -0.27 0.00 3.45 -1.79 -0.96 116.42 117.19 2nqn h ASP 67 Ca 0.02 0.03 -0.00 0.00 0.43 0.00 0.00 57.03 57.50 2nqn h ASP 67 Cb 0.21 -0.06 -0.01 0.00 -0.56 0.00 0.00 39.33 38.90 2nqn h ASP 67 CO -0.00 0.31 0.17 0.40 -1.57 0.00 0.00 179.24 178.54 2nqn h ILE 68 N 0.59 1.09 -0.72 0.35 1.08 -1.40 -2.68 117.51 115.82 2nqn h ILE 68 Ca 0.26 -0.20 0.12 0.00 -0.39 0.00 0.00 64.86 64.64 2nqn h ILE 68 Cb 0.16 0.74 -0.08 0.00 -3.07 0.00 0.00 36.82 34.56 2nqn h ILE 68 CO -0.17 0.09 0.31 0.00 -0.69 0.00 0.00 178.15 177.69 2nqn h ALA 69 N 1.07 0.99 -0.94 1.87 0.00 -0.50 -2.37 119.26 119.38 2nqn h ALA 69 Ca 0.10 0.09 0.11 0.00 0.00 0.00 0.00 54.91 55.20 2nqn h ALA 69 Cb -0.00 0.03 -0.13 0.00 0.00 0.00 0.00 17.79 17.69 2nqn h ALA 69 CO -0.02 -0.14 -0.47 -1.13 0.00 0.00 0.00 179.25 177.48 2nqn n SER 70 N -4.95 -0.83 0.00 0.00 3.41 -0.44 -4.83 113.62 105.98 2nqn n SER 70 Ca 0.12 1.66 0.00 0.00 -0.26 0.00 0.00 58.87 60.39 2nqn n SER 70 Cb 0.34 -0.28 0.00 0.00 -0.26 0.00 0.00 64.21 64.00 2nqn n SER 70 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2nqn n GLY 71 N -1.32 1.95 3.85 5.00 0.00 -0.89 -5.09 105.19 108.68 2nqn n GLY 71 Ca 0.05 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.75 2nqn n GLY 71 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2nqn s GLN 72 N -0.16 3.97 0.83 1.61 -2.07 -1.26 -4.96 119.66 117.62 2nqn s GLN 72 Ca 0.00 0.68 -0.14 0.00 -1.82 0.00 0.00 55.36 54.07 2nqn s GLN 72 Cb 0.00 -2.39 0.00 0.00 -1.09 0.00 0.00 33.01 29.54 2nqn s GLN 72 CO 0.00 0.08 0.52 -2.30 -1.32 0.00 0.00 175.29 172.27 2nqn n PRO 73 N -0.64 0.03 -4.07 9.60 -0.02 -1.26 -4.96 135.00 133.69 2nqn n PRO 73 Ca 0.04 0.06 -0.32 0.00 -2.02 0.00 0.00 63.50 61.26 2nqn n PRO 73 Cb 0.53 -1.89 -0.16 0.00 -0.02 0.00 0.00 33.50 31.97 2nqn n PRO 73 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2nqn s LEU 74 N -0.99 2.22 0.72 2.45 1.43 -0.05 -4.77 118.68 119.69 2nqn s LEU 74 Ca 0.62 -0.75 -0.16 0.00 -1.03 0.00 0.00 54.13 52.81 2nqn s LEU 74 Cb -0.28 -1.37 0.03 0.00 0.03 0.00 0.00 46.19 44.60 2nqn s LEU 74 CO 0.62 -0.06 1.23 -2.84 0.23 0.00 0.00 176.35 175.53 2nqn s PRO 75 N 1.33 2.14 -0.31 1.29 0.02 -1.25 -0.53 135.00 137.69 2nqn s PRO 75 Ca 0.02 1.86 -0.25 0.00 0.02 0.00 0.00 61.00 62.64 2nqn s PRO 75 Cb -0.14 -1.82 0.01 0.00 0.02 0.00 0.00 34.50 32.56 2nqn s PRO 75 CO -0.11 -1.86 0.89 0.08 -0.33 0.00 0.00 177.00 175.68 2nqn s VAL 76 N -1.84 4.70 -1.43 3.83 1.01 -1.26 -1.80 120.40 123.61 2nqn s VAL 76 Ca 0.77 1.40 0.26 0.00 0.00 0.00 0.00 61.98 64.40 2nqn s VAL 76 Cb -0.32 -4.24 0.18 0.00 0.00 0.00 0.00 36.38 32.00 2nqn s VAL 76 CO 0.45 -0.32 1.53 0.00 0.00 0.00 0.00 175.10 176.76 2nqn n ALA 77 N 6.41 3.23 0.00 5.51 0.00 -0.63 -4.95 120.51 130.07 2nqn n ALA 77 Ca 0.07 -0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.14 2nqn n ALA 77 Cb 0.48 -1.15 0.00 0.00 0.00 0.00 0.00 19.45 18.78 2nqn n ALA 77 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2nqn n GLY 78 N 1.40 -1.96 3.12 0.00 0.00 -1.26 -4.83 105.19 101.66 2nqn n GLY 78 Ca 0.10 -1.20 -0.09 0.00 0.00 0.00 0.00 46.02 44.82 2nqn n GLY 78 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2nqn s LYS 79 N -1.80 0.69 -0.15 1.61 3.01 -1.26 -1.06 119.74 120.79 2nqn s LYS 79 Ca 0.00 -1.23 -0.00 0.00 -1.01 0.00 0.00 55.97 53.73 2nqn s LYS 79 Cb 0.00 0.01 0.03 0.00 -1.01 0.00 0.00 37.83 36.86 2nqn s LYS 79 CO 0.00 -0.06 -0.07 0.45 0.51 0.00 0.00 175.35 176.18 2nqn s SER 80 N -2.86 2.60 0.30 2.83 0.15 0.59 -4.17 113.70 113.15 2nqn s SER 80 Ca 0.08 -0.52 0.08 0.00 0.70 0.00 0.00 55.95 56.28 2nqn s SER 80 Cb 0.05 -0.92 -0.04 0.00 -1.71 0.00 0.00 66.02 63.41 2nqn s SER 80 CO -0.07 -0.15 0.15 -0.36 1.20 0.00 0.00 173.24 174.01 2nqn s PHE 81 N 1.64 2.83 0.13 3.44 0.40 -0.42 -2.22 117.98 123.78 2nqn s PHE 81 Ca 0.03 -0.27 -0.33 0.00 -0.60 0.00 0.00 56.93 55.76 2nqn s PHE 81 Cb -0.14 -1.51 -0.11 0.00 0.51 0.00 0.00 43.02 41.77 2nqn s PHE 81 CO -0.08 0.42 1.54 0.00 0.70 0.00 0.00 175.22 177.80 2nqn h ALA 82 N 1.56 -0.79 -0.50 5.36 0.00 -1.88 -2.57 119.26 120.44 2nqn h ALA 82 Ca -0.45 -0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.33 2nqn h ALA 82 Cb 1.25 1.13 -0.01 0.00 0.00 0.00 0.00 17.79 20.15 2nqn h ALA 82 CO 0.61 -1.05 -0.16 0.78 0.00 0.00 0.00 179.25 179.43 2nqn h GLY 83 N -0.40 1.08 -7.34 0.00 0.00 -1.96 -3.43 103.07 91.02 2nqn h GLY 83 Ca 0.07 -0.92 -0.67 0.00 0.00 0.00 0.00 47.33 45.81 2nqn h GLY 83 CO -0.59 0.84 -0.82 -0.86 0.00 0.00 0.00 176.54 175.11 2nqn s GLN 84 N -4.75 2.43 0.00 4.80 1.03 -0.97 -5.12 119.66 117.08 2nqn s GLN 84 Ca -0.12 -1.19 0.00 0.00 0.04 0.00 0.00 55.36 54.10 2nqn s GLN 84 Cb 0.12 -2.78 0.00 0.00 0.03 0.00 0.00 33.01 30.38 2nqn s GLN 84 CO 0.86 -0.47 0.00 -0.35 -2.54 0.00 0.00 175.29 172.80 2nqn n PRO 85 N 4.49 -0.95 -4.12 9.60 -0.04 -1.25 -1.30 135.00 141.44 2nqn n PRO 85 Ca -0.16 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 62.98 2nqn n PRO 85 Cb 0.44 0.00 -0.16 0.00 -0.04 0.00 0.00 33.50 33.74 2nqn n PRO 85 CO 0.00 0.00 0.00 -0.47 -0.04 0.00 0.00 175.50 174.99 2nqn s TYR 86 N -0.81 2.55 -0.18 0.54 6.14 -1.26 -4.64 117.35 119.70 2nqn s TYR 86 Ca 0.00 -1.48 0.14 0.00 0.64 0.00 0.00 57.07 56.37 2nqn s TYR 86 Cb 0.00 -1.80 0.38 0.00 0.42 0.00 0.00 41.96 40.96 2nqn s TYR 86 CO 0.00 -0.75 1.20 0.72 0.64 0.00 0.00 175.55 177.37 2nqn n HIS 87 N 4.64 0.05 0.00 4.97 8.25 -1.26 -4.72 115.22 127.15 2nqn n HIS 87 Ca -0.20 -1.31 0.00 0.00 -0.26 0.00 0.00 57.72 55.96 2nqn n HIS 87 Cb 0.50 -0.22 0.00 0.00 1.12 0.00 0.00 29.99 31.39 2nqn n HIS 87 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2nqn n GLY 88 N -1.23 -1.39 0.12 -1.41 0.00 -1.26 -5.01 105.19 95.02 2nqn n GLY 88 Ca 0.18 -1.25 -0.17 0.00 0.00 0.00 0.00 46.02 44.79 2nqn n GLY 88 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2nqn n GLU 89 N 0.00 0.67 -3.00 1.61 4.71 -1.26 -5.07 120.64 118.30 2nqn n GLU 89 Ca 0.00 0.14 -0.13 0.00 -0.01 0.00 0.00 57.16 57.16 2nqn n GLU 89 Cb 0.00 -1.56 0.01 0.00 -1.01 0.00 0.00 31.44 28.89 2nqn n GLU 89 CO 0.00 0.00 0.00 1.87 0.09 0.00 0.00 177.13 179.09 2nqn n TRP 90 N -3.19 -3.15 -2.06 -0.32 -0.00 -1.26 -4.99 117.44 102.47 2nqn n TRP 90 Ca -0.41 1.31 -0.29 0.00 -0.00 0.00 0.00 57.50 58.12 2nqn n TRP 90 Cb 1.03 -3.32 0.05 0.00 -0.00 0.00 0.00 31.31 29.07 2nqn n TRP 90 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 177.69 176.44 2nqn s PRO 91 N -2.27 2.73 0.69 5.87 0.04 -1.26 -5.00 135.00 135.80 2nqn s PRO 91 Ca 0.21 0.23 -0.17 0.00 0.04 0.00 0.00 61.00 61.32 2nqn s PRO 91 Cb -0.04 -2.10 -0.01 0.00 0.04 0.00 0.00 34.50 32.39 2nqn s PRO 91 CO 0.74 -1.01 1.00 0.00 0.04 0.00 0.00 177.00 177.77 2nqn n ALA 92 N -2.91 0.01 -0.93 8.56 0.00 -1.26 -2.72 120.51 121.27 2nqn n ALA 92 Ca 0.06 -0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.38 2nqn n ALA 92 Cb 0.58 -2.14 0.00 0.00 0.00 0.00 0.00 19.45 17.89 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 1.12 0.58 3.59 0.00 0.00 -1.26 -5.01 105.19 104.21 2nqn n GLY 93 Ca 0.14 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.90 2nqn n GLY 93 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2nqn s THR 94 N -2.57 2.28 0.22 2.61 -4.23 -1.10 -3.88 115.64 108.96 2nqn s THR 94 Ca 0.00 -2.08 0.05 0.00 -1.18 0.00 0.00 61.69 58.47 2nqn s THR 94 Cb 0.00 -2.77 -0.05 0.00 1.34 0.00 0.00 72.50 71.02 2nqn s THR 94 CO 0.00 -0.15 -0.06 0.00 -0.54 0.00 0.00 174.62 173.88 2nqn s ILE 96 N -3.26 2.12 0.07 0.00 1.01 -0.19 -1.61 121.20 119.35 2nqn s ILE 96 Ca 0.25 -0.96 -0.31 0.00 0.00 0.00 0.00 60.65 59.63 2nqn s ILE 96 Cb 0.04 -1.85 -0.08 0.00 0.01 0.00 0.00 42.46 40.58 2nqn s ILE 96 CO 0.07 0.55 1.56 -0.60 0.00 0.00 0.00 174.94 176.52 2nqn s ARG 97 N 0.73 4.23 -0.01 2.79 6.06 -0.22 0.84 118.95 133.37 2nqn s ARG 97 Ca -0.09 2.23 0.03 0.00 -2.50 0.00 0.00 55.73 55.40 2nqn s ARG 97 Cb -0.16 -3.49 -0.00 0.00 0.06 0.00 0.00 34.95 31.36 2nqn s ARG 97 CO 0.00 -0.65 -0.09 -1.50 -2.50 0.00 0.00 175.30 170.56 2nqn s ILE 98 N 2.21 0.70 0.10 4.11 2.07 -0.57 -0.30 121.20 129.53 2nqn s ILE 98 Ca 0.70 -0.36 -0.02 0.00 -1.41 0.00 0.00 60.65 59.56 2nqn s ILE 98 Cb -0.38 -0.60 -0.05 0.00 0.13 0.00 0.00 42.46 41.56 2nqn s ILE 98 CO 0.31 0.21 0.29 -0.04 -1.91 0.00 0.00 174.94 173.80 2nqn s MET 99 N -0.06 3.52 -0.05 3.50 -1.94 -0.94 0.21 119.30 123.53 2nqn s MET 99 Ca 0.01 -0.29 -0.39 0.00 -1.71 0.00 0.00 55.69 53.31 2nqn s MET 99 Cb -0.05 -2.95 -0.18 0.00 2.01 0.00 0.00 34.83 33.67 2nqn s MET 99 CO -0.00 0.54 1.37 1.87 -0.01 0.00 0.00 175.02 178.78 2nqn n TRP 100 N 0.13 1.41 -0.65 -0.03 -0.00 -1.23 -0.67 117.44 116.41 2nqn n TRP 100 Ca -0.04 0.77 0.00 0.00 -0.00 0.00 0.00 57.50 58.24 2nqn n TRP 100 Cb 0.51 -2.28 0.00 0.00 -0.00 0.00 0.00 31.31 29.54 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 2.70 1.68 3.83 5.87 0.00 0.07 -4.79 105.19 114.54 2nqn n GLY 101 Ca 0.21 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.91 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 -3.63 3.08 0.18 4.61 0.00 0.16 -4.62 121.76 121.54 2nqn s ALA 102 Ca 0.00 0.26 -0.31 0.00 0.00 0.00 0.00 51.96 51.91 2nqn s ALA 102 Cb 0.00 -3.09 -0.10 0.00 0.00 0.00 0.00 23.12 19.93 2nqn s ALA 102 CO 0.00 -0.02 1.50 -2.14 0.00 0.00 0.00 175.76 175.10 2nqn s PRO 103 N -3.58 4.25 0.55 0.00 0.02 -1.26 -0.95 135.00 134.03 2nqn s PRO 103 Ca 0.60 2.29 -0.20 0.00 0.02 0.00 0.00 61.00 63.71 2nqn s PRO 103 Cb -0.10 -3.15 -0.05 0.00 0.02 0.00 0.00 34.50 31.22 2nqn s PRO 103 CO 0.22 -0.52 1.16 0.14 -0.33 0.00 0.00 177.00 177.68 2nqn s VAL 104 N 0.75 2.96 0.62 3.83 -7.23 -0.72 -4.72 120.40 115.89 2nqn s VAL 104 Ca 0.66 0.62 -0.12 0.00 -1.81 0.00 0.00 61.98 61.33 2nqn s VAL 104 Cb -0.42 -3.26 -0.04 0.00 0.56 0.00 0.00 36.38 33.22 2nqn s VAL 104 CO 0.35 -0.11 1.03 -2.16 -0.31 0.00 0.00 175.10 173.90 2nqn s PRO 105 N -3.21 3.52 0.15 4.82 0.04 -1.26 -4.94 135.00 134.12 2nqn s PRO 105 Ca 0.73 0.82 -0.34 0.00 0.04 0.00 0.00 61.00 62.25 2nqn s PRO 105 Cb -0.27 -2.07 -0.14 0.00 0.04 0.00 0.00 34.50 32.06 2nqn s PRO 105 CO 0.30 -0.63 1.59 -1.91 0.04 0.00 0.00 177.00 176.39 2nqn n GLU 106 N -2.66 2.14 -0.14 4.56 2.13 -1.26 -1.36 120.64 124.04 2nqn n GLU 106 Ca 0.06 0.77 0.00 0.00 0.66 0.00 0.00 57.16 58.66 2nqn n GLU 106 Cb 0.54 -2.54 0.00 0.00 0.27 0.00 0.00 31.44 29.70 2nqn n GLU 106 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2nqn n GLY 107 N 3.46 1.00 3.71 8.31 0.00 -1.26 -5.02 105.19 115.38 2nqn n GLY 107 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 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 4.79 2.68 -3.66 0.00 1.02 -0.84 -5.01 120.64 119.62 2nqn n GLU 109 Ca 0.17 -0.01 -0.01 0.00 -0.02 0.00 0.00 57.16 57.29 2nqn n GLU 109 Cb 0.37 -1.10 -0.01 0.00 -0.02 0.00 0.00 31.44 30.67 2nqn n GLU 109 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2nqn s ALA 110 N -2.23 -2.01 -0.03 0.62 0.00 -1.12 -0.25 121.76 116.73 2nqn s ALA 110 Ca 0.04 0.58 -0.01 0.00 0.00 0.00 0.00 51.96 52.57 2nqn s ALA 110 Cb 0.09 0.42 0.03 0.00 0.00 0.00 0.00 23.12 23.66 2nqn s ALA 110 CO 0.51 -1.00 0.04 0.08 0.00 0.00 0.00 175.76 175.39 2nqn s VAL 111 N -2.75 -0.04 -0.02 0.00 1.01 -0.91 -1.69 120.40 116.00 2nqn s VAL 111 Ca 0.13 0.29 0.02 0.00 0.00 0.00 0.00 61.98 62.42 2nqn s VAL 111 Cb 0.02 -0.15 -0.03 0.00 0.00 0.00 0.00 36.38 36.22 2nqn s VAL 111 CO -0.02 0.14 -0.04 0.68 0.00 0.00 0.00 175.10 175.86 2nqn s VAL 112 N 1.58 3.89 0.54 2.92 -7.23 -0.84 -4.49 120.40 116.76 2nqn s VAL 112 Ca -0.03 -0.61 -0.19 0.00 -1.81 0.00 0.00 61.98 59.34 2nqn s VAL 112 Cb -0.13 -2.68 -0.06 0.00 0.56 0.00 0.00 36.38 34.07 2nqn s VAL 112 CO -0.03 0.45 1.09 0.00 -0.31 0.00 0.00 175.10 176.30 2nqn s MET 113 N -1.30 3.46 0.22 4.82 0.23 -1.26 -0.94 119.30 124.52 2nqn s MET 113 Ca 0.17 1.48 -0.14 0.00 -1.03 0.00 0.00 55.69 56.17 2nqn s MET 113 Cb -0.11 -2.03 0.26 0.00 -1.53 0.00 0.00 34.83 31.41 2nqn s MET 113 CO 0.07 -0.74 1.60 1.96 -2.03 0.00 0.00 175.02 175.88 2nqn h GLN 114 N 1.17 -0.04 -0.51 3.16 4.20 -1.73 -1.54 115.11 119.82 2nqn h GLN 114 Ca -0.49 0.00 0.15 0.00 0.06 0.00 0.00 58.65 58.37 2nqn h GLN 114 Cb 1.24 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 29.01 2nqn h GLN 114 CO 0.57 -0.02 0.54 1.05 -0.67 0.00 0.00 178.83 180.29 2nqn h GLU 115 N -0.04 0.00 -0.70 1.46 9.09 -1.93 -0.61 114.58 121.86 2nqn h GLU 115 Ca 0.32 0.00 -0.07 0.00 0.05 0.00 0.00 59.36 59.66 2nqn h GLU 115 Cb 0.54 0.00 -0.04 0.00 -1.65 0.00 0.00 28.75 27.60 2nqn h GLU 115 CO -0.74 0.00 0.09 1.04 0.05 0.00 0.00 179.01 179.45 2nqn n GLN 116 N -3.70 4.04 -4.53 1.06 6.02 -0.58 -4.88 117.38 114.80 2nqn n GLN 116 Ca 0.10 -2.73 -0.23 0.00 -0.01 0.00 0.00 57.00 54.13 2nqn n GLN 116 Cb 0.74 -2.15 -0.16 0.00 1.02 0.00 0.00 30.24 29.69 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 -2.59 1.02 -0.25 5.09 -4.23 -0.24 -1.18 115.64 113.26 2nqn s THR 117 Ca 0.48 -0.46 -0.10 0.00 -1.18 0.00 0.00 61.69 60.43 2nqn s THR 117 Cb 0.37 -0.91 -0.05 0.00 1.34 0.00 0.00 72.50 73.26 2nqn s THR 117 CO 0.13 0.31 0.15 -0.70 -0.54 0.00 0.00 174.62 173.98 2nqn s GLU 118 N 0.34 3.98 0.19 3.99 2.12 0.20 -4.90 118.70 124.62 2nqn s GLU 118 Ca -0.07 -0.31 -0.31 0.00 0.36 0.00 0.00 54.97 54.64 2nqn s GLU 118 Cb -0.12 -3.52 -0.09 0.00 0.26 0.00 0.00 34.13 30.66 2nqn s GLU 118 CO 0.02 -0.02 1.42 -1.14 -0.54 0.00 0.00 175.26 175.00 2nqn s GLN 119 N 1.27 4.30 0.49 4.30 2.00 -1.26 0.82 119.66 131.57 2nqn s GLN 119 Ca 0.07 2.21 0.02 0.00 -2.00 0.00 0.00 55.36 55.65 2nqn s GLN 119 Cb -0.14 -3.17 -0.02 0.00 0.80 0.00 0.00 33.01 30.48 2nqn s GLN 119 CO 0.06 -0.42 0.03 -1.64 -0.50 0.00 0.00 175.29 172.82 2nqn s MET 120 N 0.29 2.13 0.08 1.67 -1.94 -0.55 -4.83 119.30 116.15 2nqn s MET 120 Ca 0.62 -2.34 -0.04 0.00 -1.71 0.00 0.00 55.69 52.22 2nqn s MET 120 Cb -0.40 -1.35 -0.26 0.00 2.01 0.00 0.00 34.83 34.83 2nqn s MET 120 CO 0.37 -0.37 1.16 0.38 -0.01 0.00 0.00 175.02 176.56 2nqn h ASP 121 N 1.46 0.40 -1.94 3.03 2.03 -2.01 -3.36 116.42 116.04 2nqn h ASP 121 Ca -0.42 -0.42 -0.63 0.00 -0.73 0.00 0.00 57.03 54.82 2nqn h ASP 121 Cb 1.30 -0.13 -0.39 0.00 -0.83 0.00 0.00 39.33 39.28 2nqn h ASP 121 CO 0.71 1.32 -0.32 -0.46 -1.03 0.00 0.00 179.24 179.46 2nqn n ASN 122 N -3.54 5.21 0.00 4.15 6.94 -1.26 -5.06 115.26 121.70 2nqn n ASN 122 Ca -0.08 -3.72 0.00 0.00 -0.02 0.00 0.00 54.58 50.76 2nqn n ASN 122 Cb 1.00 -0.64 0.00 0.00 -2.36 0.00 0.00 39.78 37.79 2nqn n ASN 122 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2nqn n GLY 123 N -0.36 -0.92 3.76 4.83 0.00 -1.26 -4.24 105.19 107.02 2nqn n GLY 123 Ca 0.38 -2.20 -0.34 0.00 0.00 0.00 0.00 46.02 43.86 2nqn n GLY 123 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2nqn s VAL 124 N -0.27 4.72 -0.05 1.61 0.11 0.31 -1.49 120.40 125.33 2nqn s VAL 124 Ca 0.00 -0.25 -0.09 0.00 -2.93 0.00 0.00 61.98 58.71 2nqn s VAL 124 Cb 0.00 -3.08 -0.05 0.00 -1.53 0.00 0.00 36.38 31.72 2nqn s VAL 124 CO 0.00 0.48 0.24 -0.60 -3.33 0.00 0.00 175.10 171.89 2nqn s ARG 125 N -1.34 3.60 -0.35 1.54 3.52 0.24 -0.87 118.95 125.29 2nqn s ARG 125 Ca 0.18 0.01 -0.06 0.00 -0.13 0.00 0.00 55.73 55.74 2nqn s ARG 125 Cb -0.12 -3.16 0.05 0.00 -1.56 0.00 0.00 34.95 30.16 2nqn s ARG 125 CO 0.08 0.72 0.11 -0.06 -0.81 0.00 0.00 175.30 175.35 2nqn s PHE 126 N -1.13 3.29 -0.04 5.12 0.40 -1.26 0.58 117.98 124.93 2nqn s PHE 126 Ca 0.21 -1.55 -0.13 0.00 -0.60 0.00 0.00 56.93 54.87 2nqn s PHE 126 Cb -0.13 -2.39 -0.07 0.00 0.51 0.00 0.00 43.02 40.94 2nqn s PHE 126 CO 0.10 -0.76 0.53 1.79 0.70 0.00 0.00 175.22 177.58 2nqn h THR 127 N 6.21 0.00 -4.10 0.64 1.35 -1.51 -3.48 112.91 112.01 2nqn h THR 127 Ca -0.22 -0.62 -0.45 0.00 -0.55 0.00 0.00 66.41 64.56 2nqn h THR 127 Cb 1.08 0.00 0.14 0.00 -1.73 0.00 0.00 68.15 67.64 2nqn h THR 127 CO 0.62 0.00 0.27 0.00 -0.25 0.00 0.00 175.52 176.16 2nqn s ALA 128 N -3.71 1.54 0.43 6.62 0.00 -1.24 -5.03 121.76 120.37 2nqn s ALA 128 Ca -0.07 -0.56 -0.24 0.00 0.00 0.00 0.00 51.96 51.10 2nqn s ALA 128 Cb 0.01 -3.02 -0.08 0.00 0.00 0.00 0.00 23.12 20.02 2nqn s ALA 128 CO 0.20 -2.50 1.13 -2.00 0.00 0.00 0.00 175.76 172.59 2nqn s GLU 129 N -5.26 3.94 -0.19 0.00 2.12 -1.26 -5.03 118.70 113.01 2nqn s GLU 129 Ca 0.65 1.71 0.01 0.00 0.36 0.00 0.00 54.97 57.71 2nqn s GLU 129 Cb -0.15 -2.50 0.03 0.00 0.26 0.00 0.00 34.13 31.77 2nqn s GLU 129 CO 0.54 -0.39 -0.18 0.08 -0.54 0.00 0.00 175.26 174.78 2nqn s VAL 130 N -1.55 2.04 0.02 3.70 1.01 -1.26 -5.11 120.40 119.25 2nqn s VAL 130 Ca 0.60 -1.06 -0.11 0.00 0.00 0.00 0.00 61.98 61.41 2nqn s VAL 130 Cb -0.27 -1.91 -0.05 0.00 0.00 0.00 0.00 36.38 34.14 2nqn s VAL 130 CO 0.33 0.41 0.37 -0.13 0.00 0.00 0.00 175.10 176.09 2nqn s ARG 131 N 1.27 3.78 0.13 2.72 0.52 -1.26 -5.04 118.95 121.08 2nqn s ARG 131 Ca 0.02 0.23 -0.35 0.00 -0.52 0.00 0.00 55.73 55.11 2nqn s ARG 131 Cb -0.14 -3.11 -0.15 0.00 0.52 0.00 0.00 34.95 32.06 2nqn s ARG 131 CO -0.11 0.64 1.44 0.45 0.02 0.00 0.00 175.30 177.74 2nqn n SER 132 N 1.38 2.33 0.00 0.23 2.88 -1.26 -1.81 113.62 117.37 2nqn n SER 132 Ca -0.12 1.11 0.00 0.00 -1.33 0.00 0.00 58.87 58.53 2nqn n SER 132 Cb 0.53 -1.31 0.00 0.00 -0.75 0.00 0.00 64.21 62.68 2nqn n SER 132 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2nqn n GLY 133 N 2.87 0.72 3.70 0.46 0.00 0.65 -4.97 105.19 108.61 2nqn n GLY 133 Ca 0.17 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.76 2nqn n GLY 133 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nqn n GLN 134 N -2.00 2.17 -1.82 1.61 10.64 -0.75 -3.01 117.38 124.22 2nqn n GLN 134 Ca 0.00 0.77 -0.20 0.00 -1.83 0.00 0.00 57.00 55.73 2nqn n GLN 134 Cb 0.00 -2.40 -0.07 0.00 -0.86 0.00 0.00 30.24 26.91 2nqn n GLN 134 CO 0.00 0.00 0.00 0.09 -1.83 0.00 0.00 177.06 175.32 2nqn n ASN 135 N 1.42 -5.47 -4.31 2.61 5.03 -1.26 -2.14 115.26 111.14 2nqn n ASN 135 Ca 0.08 0.36 -0.37 0.00 0.87 0.00 0.00 54.58 55.51 2nqn n ASN 135 Cb 0.34 -4.76 -0.13 0.00 -1.02 0.00 0.00 39.78 34.22 2nqn n ASN 135 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 2nqn s ILE 136 N -2.80 3.80 -0.12 2.41 1.01 -1.16 -0.87 121.20 123.46 2nqn s ILE 136 Ca 0.00 -0.84 -0.29 0.00 0.00 0.00 0.00 60.65 59.51 2nqn s ILE 136 Cb 0.00 -3.01 -0.02 0.00 0.01 0.00 0.00 42.46 39.44 2nqn s ILE 136 CO 0.00 0.03 1.18 -0.13 0.00 0.00 0.00 174.94 176.01 2nqn s ARG 137 N 1.46 4.30 0.17 2.79 3.00 0.32 -4.90 118.95 126.09 2nqn s ARG 137 Ca 0.01 1.59 -0.22 0.00 0.00 0.00 0.00 55.73 57.11 2nqn s ARG 137 Cb -0.18 -3.64 -0.08 0.00 0.00 0.00 0.00 34.95 31.05 2nqn s ARG 137 CO 0.02 -0.55 0.73 1.03 0.00 0.00 0.00 175.30 176.53 2nqn s ARG 138 N 2.79 4.40 0.25 3.54 1.81 -1.26 -1.52 118.95 128.96 2nqn s ARG 138 Ca 0.53 1.00 -0.31 0.00 -1.72 0.00 0.00 55.73 55.23 2nqn s ARG 138 Cb -0.22 -3.12 -0.11 0.00 -0.45 0.00 0.00 34.95 31.05 2nqn s ARG 138 CO 0.17 0.52 1.58 -0.98 -0.68 0.00 0.00 175.30 175.90 2nqn s ARG 139 N -1.44 4.17 0.00 3.54 1.04 -1.26 -2.50 118.95 122.50 2nqn s ARG 139 Ca 0.37 2.49 0.00 0.00 -1.04 0.00 0.00 55.73 57.55 2nqn s ARG 139 Cb -0.20 -3.07 0.00 0.00 -2.04 0.00 0.00 34.95 29.64 2nqn s ARG 139 CO 0.23 -0.60 0.00 0.41 -0.04 0.00 0.00 175.30 175.30 2nqn n GLY 140 N 2.70 1.14 0.00 3.88 0.00 0.23 -4.79 105.19 108.35 2nqn n GLY 140 Ca 0.10 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.19 2nqn n GLY 140 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2nqn n GLU 141 N -2.00 0.29 -0.02 1.61 0.28 -1.04 -3.75 120.64 116.01 2nqn n GLU 141 Ca 0.00 0.10 -0.03 0.00 -0.16 0.00 0.00 57.16 57.07 2nqn n GLU 141 Cb 0.00 -1.50 -0.01 0.00 1.43 0.00 0.00 31.44 31.36 2nqn n GLU 141 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 2nqn n ASP 142 N -1.20 0.31 -3.85 -1.84 8.00 0.59 -4.97 116.55 113.59 2nqn n ASP 142 Ca 0.08 0.04 -0.17 0.00 0.71 0.00 0.00 54.79 55.45 2nqn n ASP 142 Cb 0.10 -0.09 -0.16 0.00 -0.02 0.00 0.00 41.12 40.95 2nqn n ASP 142 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2nqn s ILE 143 N -2.06 0.22 -0.10 0.53 1.01 -0.25 -4.99 121.20 115.56 2nqn s ILE 143 Ca -0.04 0.02 -0.03 0.00 0.00 0.00 0.00 60.65 60.59 2nqn s ILE 143 Cb 0.02 -0.28 -0.04 0.00 0.01 0.00 0.00 42.46 42.17 2nqn s ILE 143 CO 0.06 0.13 0.04 -0.94 0.00 0.00 0.00 174.94 174.23 2nqn s SER 144 N 0.76 5.58 0.50 3.58 1.04 -1.26 0.07 113.70 123.97 2nqn s SER 144 Ca -0.08 0.24 -0.22 0.00 0.48 0.00 0.00 55.95 56.37 2nqn s SER 144 Cb -0.11 -1.66 -0.07 0.00 0.10 0.00 0.00 66.02 64.28 2nqn s SER 144 CO -0.01 0.38 1.19 0.00 0.98 0.00 0.00 173.24 175.78 2nqn n ALA 145 N 2.12 0.96 -0.11 5.32 0.00 -1.20 -1.58 120.51 126.03 2nqn n ALA 145 Ca -0.19 0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.40 2nqn n ALA 145 Cb 0.54 -2.23 0.00 0.00 0.00 0.00 0.00 19.45 17.76 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 0.96 1.95 3.85 0.00 0.00 0.13 -4.98 105.19 107.10 2nqn n GLY 146 Ca 0.10 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.82 3.25 -0.23 4.61 0.00 -0.62 -4.79 121.76 121.15 2nqn s ALA 147 Ca 0.00 0.08 -0.24 0.00 0.00 0.00 0.00 51.96 51.80 2nqn s ALA 147 Cb 0.00 -2.87 -0.01 0.00 0.00 0.00 0.00 23.12 20.25 2nqn s ALA 147 CO 0.00 0.17 0.81 0.08 0.00 0.00 0.00 175.76 176.82 2nqn s VAL 148 N -2.16 4.86 -0.19 0.00 1.01 -1.26 -0.37 120.40 122.29 2nqn s VAL 148 Ca 0.56 1.53 -0.15 0.00 0.00 0.00 0.00 61.98 63.92 2nqn s VAL 148 Cb -0.10 -4.10 -0.21 0.00 0.00 0.00 0.00 36.38 31.98 2nqn s VAL 148 CO 0.20 -0.05 0.18 0.52 0.00 0.00 0.00 175.10 175.96 2nqn n VAL 149 N 5.18 1.61 -4.11 2.92 0.31 0.91 -4.92 118.33 120.23 2nqn n VAL 149 Ca 0.05 -0.29 -0.20 0.00 -0.01 0.00 0.00 64.34 63.89 2nqn n VAL 149 Cb 0.48 -1.90 -0.16 0.00 -0.91 0.00 0.00 33.84 31.34 2nqn n VAL 149 CO 0.00 0.00 0.00 -0.36 -1.32 0.00 0.00 176.83 175.15 2nqn s PHE 150 N -2.45 0.74 0.61 3.52 0.40 -1.19 -5.00 117.98 114.61 2nqn s PHE 150 Ca -0.28 -0.21 -0.13 0.00 -0.60 0.00 0.00 56.93 55.71 2nqn s PHE 150 Cb 0.07 -0.68 -0.04 0.00 0.51 0.00 0.00 43.02 42.88 2nqn s PHE 150 CO 0.64 -0.21 1.03 -1.25 0.70 0.00 0.00 175.22 176.13 2nqn s PRO 151 N 1.04 3.49 0.53 0.24 0.04 -1.26 -0.21 135.00 138.87 2nqn s PRO 151 Ca -0.09 0.91 -0.22 0.00 0.04 0.00 0.00 61.00 61.64 2nqn s PRO 151 Cb -0.14 -2.07 -0.05 0.00 0.04 0.00 0.00 34.50 32.28 2nqn s PRO 151 CO -0.01 -0.65 1.33 0.00 0.04 0.00 0.00 177.00 177.71 2nqn s ALA 152 N -2.91 2.87 0.00 8.56 0.00 -1.26 -2.46 121.76 126.57 2nqn s ALA 152 Ca 0.58 1.28 0.00 0.00 0.00 0.00 0.00 51.96 53.82 2nqn s ALA 152 Cb -0.12 -3.54 0.00 0.00 0.00 0.00 0.00 23.12 19.46 2nqn s ALA 152 CO 0.46 -1.25 0.00 0.41 0.00 0.00 0.00 175.76 175.38 2nqn n GLY 153 N 0.67 0.68 3.71 0.00 0.00 0.24 -4.88 105.19 105.62 2nqn n GLY 153 Ca 0.10 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 -2.37 4.70 -0.36 2.61 2.01 -1.03 -1.52 115.64 119.68 2nqn s THR 154 Ca 0.00 1.94 -0.29 0.00 0.31 0.00 0.00 61.69 63.65 2nqn s THR 154 Cb 0.00 -4.25 0.02 0.00 0.01 0.00 0.00 72.50 68.28 2nqn s THR 154 CO 0.00 0.14 1.08 -0.60 -0.69 0.00 0.00 174.62 174.55 2nqn s ARG 155 N 1.12 3.96 0.13 4.92 3.52 -1.26 -1.53 118.95 129.82 2nqn s ARG 155 Ca 0.53 0.91 -0.31 0.00 -0.13 0.00 0.00 55.73 56.74 2nqn s ARG 155 Cb -0.22 -3.79 -0.08 0.00 -1.56 0.00 0.00 34.95 29.30 2nqn s ARG 155 CO 0.27 -1.03 1.31 -0.51 -0.81 0.00 0.00 175.30 174.54 2nqn s LEU 156 N 3.85 4.39 0.00 -0.88 1.43 -0.08 -4.91 118.68 122.48 2nqn s LEU 156 Ca 0.46 2.27 0.03 0.00 -1.03 0.00 0.00 54.13 55.86 2nqn s LEU 156 Cb -0.11 -3.59 -0.01 0.00 0.03 0.00 0.00 46.19 42.51 2nqn s LEU 156 CO 0.20 -0.56 0.22 0.41 0.23 0.00 0.00 176.35 176.85 2nqn n THR 157 N 3.49 0.00 0.33 5.49 -1.04 -1.26 -0.28 114.28 121.00 2nqn n THR 157 Ca 0.09 -1.42 0.21 0.00 -2.04 0.00 0.00 64.05 60.90 2nqn n THR 157 Cb 0.43 0.75 1.11 0.00 -1.82 0.00 0.00 70.33 70.80 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 1.67 0.05 -0.00 12.58 2.02 -1.99 -1.45 112.91 125.78 2nqn h THR 158 Ca -0.16 -0.10 -0.17 0.00 0.77 0.00 0.00 66.41 66.76 2nqn h THR 158 Cb 0.76 1.09 -0.02 0.00 -1.74 0.00 0.00 68.15 68.24 2nqn h THR 158 CO 0.22 0.00 -0.79 0.00 0.37 0.00 0.00 175.52 175.33 2nqn h ALA 159 N 2.00 0.69 0.00 6.16 0.00 -1.97 -3.38 119.26 122.75 2nqn h ALA 159 Ca -0.00 -0.70 -0.35 0.00 0.00 0.00 0.00 54.91 53.86 2nqn h ALA 159 Cb 0.09 -0.11 -0.06 0.00 0.00 0.00 0.00 17.79 17.71 2nqn h ALA 159 CO 0.00 0.95 -2.24 0.39 0.00 0.00 0.00 179.25 178.35 2nqn n GLU 160 N -3.63 0.51 -0.35 0.00 4.71 -0.72 -4.55 120.64 116.62 2nqn n GLU 160 Ca -0.01 0.16 0.07 0.00 -0.01 0.00 0.00 57.16 57.37 2nqn n GLU 160 Cb 0.76 -1.38 0.25 0.00 -1.01 0.00 0.00 31.44 30.06 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 -0.33 0.91 -1.28 -4.62 3.38 -1.51 -0.46 115.31 111.40 2nqn h LEU 161 Ca -0.52 0.04 -0.05 0.00 0.09 0.00 0.00 57.88 57.44 2nqn h LEU 161 Cb 1.65 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 42.25 2nqn h LEU 161 CO -0.18 0.50 -0.25 -0.65 0.09 0.00 0.00 178.44 177.94 2nqn h PRO 162 N 0.98 0.00 -0.22 1.13 0.11 -1.81 -1.53 132.00 130.65 2nqn h PRO 162 Ca 0.48 0.00 -0.16 0.00 0.11 0.00 0.00 66.00 66.43 2nqn h PRO 162 Cb 0.46 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.57 2nqn h PRO 162 CO -0.24 0.25 -0.49 0.28 -0.21 0.00 0.00 178.00 177.59 2nqn h VAL 163 N 0.00 1.30 -0.83 3.15 2.07 -1.36 -1.64 116.25 118.94 2nqn h VAL 163 Ca -0.00 -1.70 -0.03 0.00 0.82 0.00 0.00 66.70 65.79 2nqn h VAL 163 Cb 0.68 1.80 -0.04 0.00 -1.52 0.00 0.00 31.29 32.21 2nqn h VAL 163 CO 0.03 0.54 0.40 0.40 0.02 0.00 0.00 177.57 178.96 2nqn h ILE 164 N 0.45 1.26 -0.32 4.57 2.04 -1.07 -2.09 117.51 122.34 2nqn h ILE 164 Ca 0.00 -0.72 -0.09 0.00 1.00 0.00 0.00 64.86 65.05 2nqn h ILE 164 Cb 1.10 0.19 -0.02 0.00 -0.74 0.00 0.00 36.82 37.35 2nqn h ILE 164 CO 0.11 0.31 -0.19 0.00 0.00 0.00 0.00 178.15 178.38 2nqn h ALA 165 N 1.25 1.07 0.00 1.87 0.00 -1.18 -2.33 119.26 119.94 2nqn h ALA 165 Ca 0.29 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2nqn h ALA 165 Cb 0.12 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.77 2nqn h ALA 165 CO -0.04 0.57 0.00 -1.13 0.00 0.00 0.00 179.25 178.65 2nqn n SER 166 N -4.15 0.26 -1.02 0.00 3.41 -0.63 -0.91 113.62 110.59 2nqn n SER 166 Ca 0.00 0.59 0.11 0.00 -0.26 0.00 0.00 58.87 59.31 2nqn n SER 166 Cb 0.38 -0.63 0.25 0.00 -0.26 0.00 0.00 64.21 63.95 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 -1.82 3.05 0.00 1.04 4.77 -0.89 -4.94 117.00 118.22 2nqn n LEU 167 Ca 0.01 -1.32 0.00 0.00 -0.03 0.00 0.00 56.01 54.67 2nqn n LEU 167 Cb 0.12 -0.23 0.00 0.00 -2.33 0.00 0.00 43.42 40.98 2nqn n LEU 167 CO 0.11 0.66 0.00 0.61 -1.33 0.00 0.00 177.39 177.44 2nqn n GLY 168 N 1.42 0.82 3.65 -0.72 0.00 -0.09 -4.71 105.19 105.56 2nqn n GLY 168 Ca 0.19 0.00 -0.41 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 -3.20 4.87 -0.38 -0.61 1.01 -1.18 -4.95 121.20 116.76 2nqn s ILE 169 Ca 0.00 1.51 0.23 0.00 0.00 0.00 0.00 60.65 62.39 2nqn s ILE 169 Cb 0.00 -4.09 0.00 0.00 0.01 0.00 0.00 42.46 38.38 2nqn s ILE 169 CO 0.00 -0.04 1.12 0.00 0.00 0.00 0.00 174.94 176.02 2nqn h ALA 170 N 7.64 0.50 -2.59 9.38 0.00 -1.93 -3.37 119.26 128.90 2nqn h ALA 170 Ca -0.25 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.59 2nqn h ALA 170 Cb 1.10 0.00 -0.15 0.00 0.00 0.00 0.00 17.79 18.74 2nqn h ALA 170 CO 0.85 0.00 -0.13 -1.83 0.00 0.00 0.00 179.25 178.14 2nqn s GLU 171 N -3.30 0.94 0.02 0.00 -1.05 -1.26 -2.33 118.70 111.72 2nqn s GLU 171 Ca 0.02 -0.50 -0.02 0.00 -0.15 0.00 0.00 54.97 54.32 2nqn s GLU 171 Cb 0.11 0.42 -0.02 0.00 -0.44 0.00 0.00 34.13 34.20 2nqn s GLU 171 CO 0.77 -0.33 0.01 0.14 0.95 0.00 0.00 175.26 176.80 2nqn s VAL 172 N -2.91 0.11 0.15 1.83 -7.23 -0.85 -4.93 120.40 106.57 2nqn s VAL 172 Ca -0.03 -0.88 -0.30 0.00 -1.81 0.00 0.00 61.98 58.96 2nqn s VAL 172 Cb 0.00 -0.33 -0.07 0.00 0.56 0.00 0.00 36.38 36.54 2nqn s VAL 172 CO -0.06 -0.48 1.00 -2.16 -0.31 0.00 0.00 175.10 173.09 2nqn s PRO 173 N -1.51 4.70 0.08 4.82 0.04 -1.26 -2.04 135.00 139.82 2nqn s PRO 173 Ca -0.15 1.54 0.04 0.00 0.04 0.00 0.00 61.00 62.47 2nqn s PRO 173 Cb -0.09 -3.33 -0.03 0.00 0.04 0.00 0.00 34.50 31.09 2nqn s PRO 173 CO -0.01 0.23 -0.11 0.14 0.04 0.00 0.00 177.00 177.29 2nqn s VAL 174 N -0.29 0.92 0.41 -0.36 -7.23 0.59 -0.65 120.40 113.79 2nqn s VAL 174 Ca 0.47 -1.40 -0.26 0.00 -1.81 0.00 0.00 61.98 58.97 2nqn s VAL 174 Cb -0.26 -1.10 -0.09 0.00 0.56 0.00 0.00 36.38 35.50 2nqn s VAL 174 CO 0.32 -0.40 1.32 -0.63 -0.31 0.00 0.00 175.10 175.39 2nqn s ILE 175 N -1.80 2.55 0.78 -0.62 -1.09 -0.05 -1.13 121.20 119.83 2nqn s ILE 175 Ca -0.00 0.49 -0.12 0.00 -2.23 0.00 0.00 60.65 58.78 2nqn s ILE 175 Cb -0.07 -3.29 0.07 0.00 -1.58 0.00 0.00 42.46 37.59 2nqn s ILE 175 CO 0.01 0.07 1.14 0.00 -1.23 0.00 0.00 174.94 174.93 2nqn s ARG 176 N -2.28 1.98 0.55 2.79 1.70 -0.24 -4.63 118.95 118.82 2nqn s ARG 176 Ca 0.58 1.45 -0.20 0.00 -0.47 0.00 0.00 55.73 57.08 2nqn s ARG 176 Cb -0.39 -1.85 -0.05 0.00 -0.57 0.00 0.00 34.95 32.10 2nqn s ARG 176 CO 0.50 -1.89 1.22 0.15 -1.08 0.00 0.00 175.30 174.19 2nqn s LYS 177 N -4.46 3.24 0.18 3.89 1.02 -1.26 -4.97 119.74 117.38 2nqn s LYS 177 Ca 0.67 1.88 -0.30 0.00 0.02 0.00 0.00 55.97 58.23 2nqn s LYS 177 Cb -0.22 -2.12 -0.08 0.00 -0.52 0.00 0.00 37.83 34.89 2nqn s LYS 177 CO 0.51 -1.00 1.14 0.08 -0.92 0.00 0.00 175.35 175.16 2nqn s VAL 178 N -1.54 3.75 -0.20 3.17 1.01 -1.26 -4.82 120.40 120.50 2nqn s VAL 178 Ca 0.72 1.49 -0.11 0.00 0.00 0.00 0.00 61.98 64.07 2nqn s VAL 178 Cb -0.31 -3.95 -0.05 0.00 0.00 0.00 0.00 36.38 32.07 2nqn s VAL 178 CO 0.36 0.24 0.20 -0.13 0.00 0.00 0.00 175.10 175.77 2nqn s ARG 179 N -0.28 4.17 -0.10 2.72 0.52 -1.26 -1.24 118.95 123.47 2nqn s ARG 179 Ca 0.51 -0.13 0.01 0.00 -0.52 0.00 0.00 55.73 55.60 2nqn s ARG 179 Cb -0.31 -3.47 0.02 0.00 0.52 0.00 0.00 34.95 31.72 2nqn s ARG 179 CO 0.36 0.19 -0.12 0.08 0.02 0.00 0.00 175.30 175.83 2nqn s VAL 180 N 0.67 1.23 0.05 3.52 1.01 -0.10 -0.18 120.40 126.60 2nqn s VAL 180 Ca 0.11 -0.47 -0.16 0.00 0.00 0.00 0.00 61.98 61.46 2nqn s VAL 180 Cb -0.12 -1.17 -0.06 0.00 0.00 0.00 0.00 36.38 35.03 2nqn s VAL 180 CO 0.02 0.39 0.47 0.00 0.00 0.00 0.00 175.10 175.99 2nqn s ALA 181 N 1.16 3.65 -0.01 5.51 0.00 0.74 -1.12 121.76 131.69 2nqn s ALA 181 Ca -0.04 -0.14 0.00 0.00 0.00 0.00 0.00 51.96 51.78 2nqn s ALA 181 Cb -0.14 -2.47 0.01 0.00 0.00 0.00 0.00 23.12 20.52 2nqn s ALA 181 CO -0.03 0.46 -0.00 -1.17 0.00 0.00 0.00 175.76 175.02 2nqn s LEU 182 N -1.26 1.59 0.13 0.00 0.20 0.38 0.07 118.68 119.79 2nqn s LEU 182 Ca 0.28 -0.01 -0.25 0.00 0.69 0.00 0.00 54.13 54.84 2nqn s LEU 182 Cb -0.17 -0.11 0.07 0.00 -0.43 0.00 0.00 46.19 45.55 2nqn s LEU 182 CO 0.16 -0.04 0.76 0.72 -0.29 0.00 0.00 176.35 177.66 2nqn s PHE 183 N 0.47 -0.36 0.26 5.38 -0.12 -0.93 -0.30 117.98 122.38 2nqn s PHE 183 Ca -0.04 0.11 0.02 0.00 -0.05 0.00 0.00 56.93 56.97 2nqn s PHE 183 Cb -0.07 0.59 -0.05 0.00 -0.63 0.00 0.00 43.02 42.86 2nqn s PHE 183 CO -0.01 -0.82 0.09 -1.54 -0.05 0.00 0.00 175.22 172.89 2nqn s SER 184 N -2.73 1.33 -0.00 1.98 1.04 -1.03 -0.85 113.70 113.44 2nqn s SER 184 Ca 0.06 -1.37 -0.17 0.00 0.48 0.00 0.00 55.95 54.95 2nqn s SER 184 Cb -0.02 0.13 0.03 0.00 0.10 0.00 0.00 66.02 66.26 2nqn s SER 184 CO -0.06 -0.71 0.36 0.28 0.98 0.00 0.00 173.24 174.09 2nqn s THR 185 N -3.70 0.06 0.00 2.02 -1.32 -0.59 0.23 115.64 112.34 2nqn s THR 185 Ca 0.37 -0.46 0.00 0.00 -1.21 0.00 0.00 61.69 60.39 2nqn s THR 185 Cb 0.08 -0.74 0.00 0.00 -1.51 0.00 0.00 72.50 70.33 2nqn s THR 185 CO 0.13 -0.25 0.00 0.61 -2.21 0.00 0.00 174.62 172.90 2nqn n GLY 186 N 1.04 3.61 0.02 6.08 0.00 -1.23 -4.02 105.19 110.69 2nqn n GLY 186 Ca -0.21 -0.47 0.04 0.00 0.00 0.00 0.00 46.02 45.39 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 0.07 0.19 1.61 10.43 -1.26 -1.32 116.55 126.27 2nqn n ASP 187 Ca 0.00 0.52 0.13 0.00 2.57 0.00 0.00 54.79 58.01 2nqn n ASP 187 Cb 0.00 -0.54 0.31 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 -6.10 -1.24 4.11 -1.93 -3.45 114.58 105.96 2nqn h GLU 188 Ca 0.00 0.00 -0.56 0.00 0.07 0.00 0.00 59.36 58.87 2nqn h GLU 188 Cb 0.13 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.34 2nqn h GLU 188 CO 0.00 0.00 0.10 -0.51 0.07 0.00 0.00 179.01 178.67 2nqn s LEU 189 N -5.68 4.35 0.18 3.06 1.43 -0.44 -0.71 118.68 120.87 2nqn s LEU 189 Ca 0.07 1.26 0.10 0.00 -1.03 0.00 0.00 54.13 54.53 2nqn s LEU 189 Cb 0.08 -3.12 -0.04 0.00 0.03 0.00 0.00 46.19 43.14 2nqn s LEU 189 CO 0.62 -0.08 -0.22 -1.58 0.23 0.00 0.00 176.35 175.32 2nqn s GLN 190 N 0.56 1.44 -0.05 1.70 2.00 0.25 -4.90 119.66 120.66 2nqn s GLN 190 Ca 0.38 -1.48 -0.21 0.00 -2.00 0.00 0.00 55.36 52.05 2nqn s GLN 190 Cb -0.18 -1.68 -0.05 0.00 0.80 0.00 0.00 33.01 31.90 2nqn s GLN 190 CO 0.19 0.36 0.59 -0.51 -0.50 0.00 0.00 175.29 175.42 2nqn s LEU 191 N -2.65 4.36 0.19 3.68 1.43 -1.26 -1.49 118.68 122.94 2nqn s LEU 191 Ca 0.19 1.08 -0.32 0.00 -1.03 0.00 0.00 54.13 54.05 2nqn s LEU 191 Cb -0.07 -2.90 -0.15 0.00 0.03 0.00 0.00 46.19 43.09 2nqn s LEU 191 CO 0.09 0.03 1.22 -2.65 0.23 0.00 0.00 176.35 175.27 2nqn n PRO 192 N 3.19 1.36 0.00 1.29 -0.02 -1.26 -0.18 135.00 139.38 2nqn n PRO 192 Ca -0.06 0.48 0.00 0.00 -2.02 0.00 0.00 63.50 61.91 2nqn n PRO 192 Cb 0.51 -2.02 0.00 0.00 -0.02 0.00 0.00 33.50 31.97 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 2.06 2.36 3.92 -1.23 0.00 -1.26 -5.07 105.19 105.97 2nqn n GLY 193 Ca 0.14 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.90 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 -0.28 3.56 0.39 1.61 -0.21 0.74 -5.07 119.66 120.41 2nqn s GLN 194 Ca 0.00 -0.12 -0.23 0.00 0.02 0.00 0.00 55.36 55.03 2nqn s GLN 194 Cb 0.00 -2.62 -0.10 0.00 1.00 0.00 0.00 33.01 31.29 2nqn s GLN 194 CO 0.00 0.14 1.00 -1.25 -2.12 0.00 0.00 175.29 173.06 2nqn s PRO 195 N -4.00 4.26 -0.14 2.91 0.04 -1.26 -4.86 135.00 131.94 2nqn s PRO 195 Ca 0.43 1.35 -0.19 0.00 0.04 0.00 0.00 61.00 62.63 2nqn s PRO 195 Cb -0.10 -2.48 -0.04 0.00 0.04 0.00 0.00 34.50 31.92 2nqn s PRO 195 CO 0.34 -0.03 0.54 -1.17 0.04 0.00 0.00 177.00 176.72 2nqn s LEU 196 N -2.69 4.23 -0.14 -3.56 2.96 -1.26 -4.99 118.68 113.23 2nqn s LEU 196 Ca 0.58 0.83 -0.01 0.00 -0.22 0.00 0.00 54.13 55.31 2nqn s LEU 196 Cb -0.17 -2.78 0.04 0.00 0.50 0.00 0.00 46.19 43.77 2nqn s LEU 196 CO 0.22 -0.10 -0.04 -0.83 -1.32 0.00 0.00 176.35 174.28 2nqn s GLY 197 N 0.86 0.80 -0.19 7.98 0.00 -1.26 -4.95 107.32 110.55 2nqn s GLY 197 Ca 0.27 -0.60 -0.05 0.00 0.00 0.00 0.00 44.72 44.34 2nqn s GLY 197 CO 0.11 1.00 0.11 1.22 0.00 0.00 0.00 173.10 175.54 2nqn n ASP 198 N 4.97 -4.56 -1.16 1.64 8.00 -1.26 -3.70 116.55 120.48 2nqn n ASP 198 Ca -0.11 1.25 -0.09 0.00 0.71 0.00 0.00 54.79 56.55 2nqn n ASP 198 Cb 0.49 -4.54 -0.04 0.00 -0.02 0.00 0.00 41.12 37.01 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 1.40 0.90 3.89 0.44 0.00 -1.26 -4.93 105.19 105.64 2nqn n GLY 199 Ca -0.18 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.55 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 -2.69 3.49 0.05 1.61 -0.21 -1.24 -4.99 119.66 115.67 2nqn s GLN 200 Ca 0.00 0.40 -0.02 0.00 0.02 0.00 0.00 55.36 55.76 2nqn s GLN 200 Cb 0.00 -2.24 -0.04 0.00 1.00 0.00 0.00 33.01 31.73 2nqn s GLN 200 CO 0.00 -0.41 -0.01 0.96 -2.12 0.00 0.00 175.29 173.71 2nqn s ILE 201 N -2.95 0.21 -0.01 1.08 -4.36 0.11 -4.80 121.20 110.48 2nqn s ILE 201 Ca 0.51 -1.74 -0.26 0.00 -0.26 0.00 0.00 60.65 58.91 2nqn s ILE 201 Cb -0.11 -1.48 -0.04 0.00 1.25 0.00 0.00 42.46 42.09 2nqn s ILE 201 CO 0.49 -0.96 0.80 -0.31 0.24 0.00 0.00 174.94 175.20 2nqn s TYR 202 N -3.86 3.65 0.10 1.37 1.51 -1.26 -0.58 117.35 118.27 2nqn s TYR 202 Ca 0.06 1.45 -0.31 0.00 -1.01 0.00 0.00 57.07 57.26 2nqn s TYR 202 Cb 0.07 -2.90 -0.09 0.00 -0.11 0.00 0.00 41.96 38.93 2nqn s TYR 202 CO -0.10 0.11 1.61 0.34 -1.11 0.00 0.00 175.55 176.40 2nqn s ASP 203 N 0.62 6.61 0.00 2.29 2.15 -0.55 -4.85 116.67 122.94 2nqn s ASP 203 Ca 0.42 2.51 0.00 0.00 0.43 0.00 0.00 52.55 55.91 2nqn s ASP 203 Cb -0.19 -2.57 0.00 0.00 -0.30 0.00 0.00 42.92 39.85 2nqn s ASP 203 CO 0.22 -0.85 0.00 0.35 -0.17 0.00 0.00 175.17 174.72 2nqn n THR 204 N 4.45 0.00 -0.34 1.71 -2.24 -1.26 -4.78 114.28 111.82 2nqn n THR 204 Ca 0.15 0.00 -0.03 0.00 -2.27 0.00 0.00 64.05 61.90 2nqn n THR 204 Cb 0.40 -0.49 0.09 0.00 -2.10 0.00 0.00 70.33 68.23 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 1.06 -0.90 3.42 4.21 -1.89 -1.99 115.58 119.49 2nqn h ASN 205 Ca 0.00 -0.03 -0.01 0.00 1.21 0.00 0.00 56.30 57.47 2nqn h ASN 205 Cb 0.50 -0.26 -0.04 0.00 -1.12 0.00 0.00 38.32 37.40 2nqn h ASN 205 CO 0.00 0.77 0.53 -0.09 -1.29 0.00 0.00 177.43 177.35 2nqn h ARG 206 N 1.24 1.23 -0.31 0.81 2.43 -1.88 0.51 114.38 118.40 2nqn h ARG 206 Ca 0.33 -0.12 -0.03 0.00 -0.81 0.00 0.00 59.98 59.36 2nqn h ARG 206 Cb -0.13 -0.25 -0.01 0.00 -0.42 0.00 0.00 29.97 29.15 2nqn h ARG 206 CO -0.07 0.87 0.08 1.25 -1.51 0.00 0.00 179.97 180.59 2nqn h LEU 207 N 1.24 0.46 -0.20 3.80 6.46 -1.78 -0.69 115.31 124.61 2nqn h LEU 207 Ca 0.32 -0.22 0.03 0.00 -0.12 0.00 0.00 57.88 57.89 2nqn h LEU 207 Cb -0.03 -0.12 -0.03 0.00 -0.73 0.00 0.00 40.66 39.75 2nqn h LEU 207 CO -0.06 0.56 0.02 0.00 -0.62 0.00 0.00 178.44 178.34 2nqn h ALA 208 N 0.92 0.19 -0.62 1.25 0.00 -0.64 -0.30 119.26 120.06 2nqn h ALA 208 Ca 0.10 0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.99 2nqn h ALA 208 Cb 0.27 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 2nqn h ALA 208 CO -0.00 -0.41 0.14 0.28 0.00 0.00 0.00 179.25 179.26 2nqn h VAL 209 N 0.09 1.25 0.05 0.00 2.07 -0.81 -2.02 116.25 116.89 2nqn h VAL 209 Ca 0.09 -0.94 0.01 0.00 0.82 0.00 0.00 66.70 66.69 2nqn h VAL 209 Cb 0.10 0.68 -0.02 0.00 -1.52 0.00 0.00 31.29 30.53 2nqn h VAL 209 CO -0.14 0.35 -0.13 -0.74 0.02 0.00 0.00 177.57 176.94 2nqn h HIS 210 N 0.91 -0.32 -0.36 1.57 6.17 -0.74 0.15 115.15 122.52 2nqn h HIS 210 Ca 0.19 0.01 0.06 0.00 0.71 0.00 0.00 60.37 61.34 2nqn h HIS 210 Cb 0.37 0.14 -0.06 0.00 2.52 0.00 0.00 27.41 30.38 2nqn h HIS 210 CO 0.03 -0.19 0.02 -0.07 0.71 0.00 0.00 177.93 178.42 2nqn h LEU 211 N -0.24 -0.11 -0.51 0.26 3.38 -0.94 -1.37 115.31 115.78 2nqn h LEU 211 Ca 0.03 0.08 -0.04 0.00 0.09 0.00 0.00 57.88 58.03 2nqn h LEU 211 Cb 0.27 0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 2nqn h LEU 211 CO -0.09 -0.02 0.16 0.24 0.09 0.00 0.00 178.44 178.82 2nqn h MET 212 N 0.12 0.80 -0.76 1.13 2.86 -1.00 -1.92 114.93 116.17 2nqn h MET 212 Ca 0.18 -0.17 0.02 0.00 -2.06 0.00 0.00 59.70 57.66 2nqn h MET 212 Cb 0.24 -0.11 -0.04 0.00 0.06 0.00 0.00 31.60 31.74 2nqn h MET 212 CO -0.28 0.75 0.49 -0.07 1.06 0.00 0.00 176.91 178.86 2nqn h LEU 213 N 0.70 0.83 -0.49 1.22 3.38 -0.33 -0.66 115.31 119.97 2nqn h LEU 213 Ca 0.17 -0.01 -0.11 0.00 0.09 0.00 0.00 57.88 58.01 2nqn h LEU 213 Cb 0.28 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 2nqn h LEU 213 CO -0.00 0.59 -0.13 -0.33 0.09 0.00 0.00 178.44 178.66 2nqn h GLU 214 N 0.99 0.95 0.00 1.13 5.08 -1.08 -1.18 114.58 120.46 2nqn h GLU 214 Ca 0.29 -0.37 -0.05 0.00 -1.00 0.00 0.00 59.36 58.23 2nqn h GLU 214 Cb -0.06 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.13 2nqn h GLU 214 CO -0.08 1.03 -0.25 1.96 -1.00 0.00 0.00 179.01 180.66 2nqn h GLN 215 N 0.80 0.00 -0.00 2.33 1.08 -0.97 -1.39 115.11 116.96 2nqn h GLN 215 Ca 0.12 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.32 2nqn h GLN 215 Cb 0.69 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.12 2nqn h GLN 215 CO 0.05 0.25 -0.00 1.28 -0.95 0.00 0.00 178.83 179.46 2nqn n LEU 216 N -3.77 0.09 0.00 1.46 4.77 -0.29 -4.89 117.00 114.37 2nqn n LEU 216 Ca -0.01 0.04 0.00 0.00 -0.03 0.00 0.00 56.01 56.00 2nqn n LEU 216 Cb 0.35 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.38 2nqn n LEU 216 CO 0.34 0.02 0.00 0.61 -1.33 0.00 0.00 177.39 177.03 2nqn n GLY 217 N 1.08 0.66 3.88 -0.72 0.00 -0.52 -5.06 105.19 104.50 2nqn n GLY 217 Ca 0.21 -0.11 -0.30 0.00 0.00 0.00 0.00 46.02 45.83 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 -4.77 4.08 -0.17 0.00 2.12 -0.37 -4.49 118.70 115.10 2nqn s GLU 219 Ca 0.52 0.28 -0.08 0.00 0.36 0.00 0.00 54.97 56.05 2nqn s GLU 219 Cb -0.11 -3.63 -0.04 0.00 0.26 0.00 0.00 34.13 30.61 2nqn s GLU 219 CO 0.46 -0.29 0.11 0.08 -0.54 0.00 0.00 175.26 175.08 2nqn s VAL 220 N 2.11 5.20 -0.45 3.70 1.01 -1.26 -0.93 120.40 129.78 2nqn s VAL 220 Ca 0.20 0.11 0.02 0.00 0.00 0.00 0.00 61.98 62.31 2nqn s VAL 220 Cb -0.16 -3.34 0.12 0.00 0.00 0.00 0.00 36.38 33.01 2nqn s VAL 220 CO 0.09 0.49 0.20 -0.63 0.00 0.00 0.00 175.10 175.25 2nqn s ILE 221 N 0.01 2.77 -0.57 2.22 1.09 -0.28 -4.97 121.20 121.47 2nqn s ILE 221 Ca 0.08 -2.67 -0.22 0.00 -1.10 0.00 0.00 60.65 56.74 2nqn s ILE 221 Cb -0.12 -2.94 0.06 0.00 -1.06 0.00 0.00 42.46 38.41 2nqn s ILE 221 CO 0.00 -0.72 0.85 0.21 -0.10 0.00 0.00 174.94 175.18 2nqn s ASN 222 N 0.69 6.25 0.00 3.58 3.04 -1.26 -0.47 114.94 126.77 2nqn s ASN 222 Ca 0.13 -0.75 0.14 0.00 0.04 0.00 0.00 52.86 52.42 2nqn s ASN 222 Cb -0.22 -2.38 0.77 0.00 -1.54 0.00 0.00 41.25 37.88 2nqn s ASN 222 CO -0.04 -1.19 1.51 0.18 -3.04 0.00 0.00 177.10 174.51 2nqn n LEU 223 N 7.11 0.29 0.00 3.21 4.32 0.59 -4.97 117.00 127.55 2nqn n LEU 223 Ca -0.03 -0.13 0.00 0.00 -0.02 0.00 0.00 56.01 55.83 2nqn n LEU 223 Cb 0.46 -0.02 0.00 0.00 -1.62 0.00 0.00 43.42 42.24 2nqn n LEU 223 CO 0.61 0.07 0.00 0.61 -1.22 0.00 0.00 177.39 177.45 2nqn n GLY 224 N 0.78 0.10 3.63 -0.72 0.00 -1.26 -4.66 105.19 103.06 2nqn n GLY 224 Ca 0.11 -0.99 -0.41 0.00 0.00 0.00 0.00 46.02 44.73 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 0.11 -0.61 1.01 -1.26 -2.47 121.20 122.90 2nqn s ILE 225 Ca 0.00 1.22 -0.25 0.00 0.00 0.00 0.00 60.65 61.62 2nqn s ILE 225 Cb 0.00 -4.01 -0.07 0.00 0.01 0.00 0.00 42.46 38.40 2nqn s ILE 225 CO 0.00 -0.04 0.77 -0.63 0.00 0.00 0.00 174.94 175.04 2nqn s ILE 226 N 2.65 4.55 0.58 2.92 -1.09 0.14 -4.96 121.20 125.98 2nqn s ILE 226 Ca 0.29 1.67 -0.18 0.00 -2.23 0.00 0.00 60.65 60.20 2nqn s ILE 226 Cb -0.15 -4.13 -0.04 0.00 -1.58 0.00 0.00 42.46 36.56 2nqn s ILE 226 CO 0.09 0.44 1.13 0.00 -1.23 0.00 0.00 174.94 175.37 2nqn s ARG 227 N -0.60 3.15 -1.06 2.79 1.70 -1.26 -3.53 118.95 120.13 2nqn s ARG 227 Ca 0.37 1.54 -0.22 0.00 -0.47 0.00 0.00 55.73 56.95 2nqn s ARG 227 Cb -0.22 -1.98 -0.11 0.00 -0.57 0.00 0.00 34.95 32.07 2nqn s ARG 227 CO 0.25 -1.00 1.92 -0.25 -1.08 0.00 0.00 175.30 175.14 2nqn n ASP 228 N -1.69 2.96 -3.69 -2.89 8.00 -1.26 -4.51 116.55 113.46 2nqn n ASP 228 Ca 0.11 -2.70 -0.10 0.00 0.71 0.00 0.00 54.79 52.81 2nqn n ASP 228 Cb 0.51 -1.55 -0.11 0.00 -0.02 0.00 0.00 41.12 39.95 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 5.98 -0.51 0.32 -2.24 2.15 -1.26 -5.05 116.67 116.06 2nqn s ASP 229 Ca 0.65 0.90 0.09 0.00 0.43 0.00 0.00 52.55 54.62 2nqn s ASP 229 Cb 0.04 0.79 0.84 0.00 -0.30 0.00 0.00 42.92 44.29 2nqn s ASP 229 CO 0.13 -0.19 1.77 -0.65 -0.17 0.00 0.00 175.17 176.06 2nqn h PRO 230 N 7.16 0.64 -0.11 4.34 0.11 -1.96 -0.87 132.00 141.30 2nqn h PRO 230 Ca -0.36 -0.04 -0.23 0.00 0.11 0.00 0.00 66.00 65.48 2nqn h PRO 230 Cb 1.18 -0.14 0.01 0.00 0.11 0.00 0.00 31.00 32.16 2nqn h PRO 230 CO 0.29 0.42 -0.83 0.45 -0.21 0.00 0.00 178.00 178.13 2nqn h HIS 231 N 0.66 1.04 -0.68 0.65 3.86 -1.97 -2.11 115.15 116.60 2nqn h HIS 231 Ca 0.59 -0.49 -0.08 0.00 -1.16 0.00 0.00 60.37 59.23 2nqn h HIS 231 Cb 1.06 -0.15 -0.03 0.00 1.06 0.00 0.00 27.41 29.36 2nqn h HIS 231 CO -0.00 1.32 0.11 0.00 0.86 0.00 0.00 177.93 180.22 2nqn h ALA 232 N 0.50 0.90 -0.19 2.45 0.00 -1.67 -1.91 119.26 119.34 2nqn h ALA 232 Ca -0.07 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.54 2nqn h ALA 232 Cb 1.47 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 2nqn h ALA 232 CO 0.17 0.67 0.04 1.25 0.00 0.00 0.00 179.25 181.39 2nqn h LEU 233 N 1.05 0.29 -1.25 0.00 6.46 -1.20 -1.92 115.31 118.74 2nqn h LEU 233 Ca 0.21 -0.24 -0.02 0.00 -0.12 0.00 0.00 57.88 57.71 2nqn h LEU 233 Cb 0.45 -0.08 -0.03 0.00 -0.73 0.00 0.00 40.66 40.27 2nqn h LEU 233 CO 0.01 0.45 0.28 0.03 -0.62 0.00 0.00 178.44 178.59 2nqn h ARG 234 N 0.12 0.79 -0.56 1.25 3.08 -1.29 -1.64 114.38 116.13 2nqn h ARG 234 Ca 0.06 -0.10 -0.08 0.00 0.07 0.00 0.00 59.98 59.94 2nqn h ARG 234 Cb 0.28 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 30.15 2nqn h ARG 234 CO 0.00 0.61 0.04 0.00 -1.07 0.00 0.00 179.97 179.55 2nqn h ALA 235 N 1.51 1.02 -0.25 0.04 0.00 -1.09 -0.62 119.26 119.86 2nqn h ALA 235 Ca 0.20 -0.27 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 2nqn h ALA 235 Cb 0.08 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 2nqn h ALA 235 CO -0.03 0.61 -0.03 0.00 0.00 0.00 0.00 179.25 179.81 2nqn h ALA 236 N 1.17 0.34 -0.30 0.00 0.00 -0.72 -2.09 119.26 117.65 2nqn h ALA 236 Ca 0.17 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 2nqn h ALA 236 Cb 0.46 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 2nqn h ALA 236 CO 0.02 0.11 0.17 0.74 0.00 0.00 0.00 179.25 180.29 2nqn h PHE 237 N 0.22 0.41 -0.47 0.00 -1.00 -1.11 0.12 116.94 115.11 2nqn h PHE 237 Ca 0.07 -0.01 0.04 0.00 2.81 0.00 0.00 57.97 60.89 2nqn h PHE 237 Cb 0.48 -0.13 -0.04 0.00 3.61 0.00 0.00 35.95 39.86 2nqn h PHE 237 CO 0.04 0.32 0.22 0.82 -1.61 0.00 0.00 178.31 178.10 2nqn h ILE 238 N 0.38 0.94 -0.18 -0.55 2.04 -1.05 0.14 117.51 119.23 2nqn h ILE 238 Ca 0.11 -0.15 -0.18 0.00 1.00 0.00 0.00 64.86 65.64 2nqn h ILE 238 Cb 0.04 0.46 -0.00 0.00 -0.74 0.00 0.00 36.82 36.57 2nqn h ILE 238 CO -0.02 0.08 -0.62 1.05 0.00 0.00 0.00 178.15 178.64 2nqn h GLU 239 N 0.44 0.62 -0.04 2.37 4.11 -1.20 -2.47 114.58 118.40 2nqn h GLU 239 Ca 0.21 -0.43 -0.00 0.00 0.07 0.00 0.00 59.36 59.21 2nqn h GLU 239 Cb 0.14 0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.45 2nqn h GLU 239 CO -0.16 1.05 0.01 0.00 0.07 0.00 0.00 179.01 179.98 2nqn h ALA 240 N 0.85 0.05 0.00 1.06 0.00 -0.36 -2.67 119.26 118.19 2nqn h ALA 240 Ca -0.01 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 2nqn h ALA 240 Cb 1.19 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.96 2nqn h ALA 240 CO 0.12 -0.33 -0.10 0.22 0.00 0.00 0.00 179.25 179.16 2nqn h ASP 241 N -0.14 0.00 1.35 0.00 1.82 -0.77 -0.92 116.42 117.76 2nqn h ASP 241 Ca 0.01 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.65 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 0.10 -0.20 0.77 -1.61 0.00 0.00 179.24 178.30 2nqn h SER 242 N 0.00 0.00 0.00 2.28 4.64 -1.23 -3.36 113.55 115.88 2nqn h SER 242 Ca -0.00 -0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.26 2nqn h SER 242 Cb 0.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.29 2nqn h SER 242 CO 0.01 0.03 -0.64 0.00 -0.87 0.00 0.00 176.83 175.36 2nqn n GLN 243 N -2.32 3.26 -4.55 4.77 1.13 -0.88 -5.07 117.38 113.72 2nqn n GLN 243 Ca 0.05 -0.02 -0.25 0.00 -1.94 0.00 0.00 57.00 54.83 2nqn n GLN 243 Cb 0.45 -0.90 -0.11 0.00 0.11 0.00 0.00 30.24 29.78 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 -1.86 2.85 -0.10 -1.58 0.00 -0.41 -4.88 121.76 115.79 2nqn s ALA 244 Ca 0.00 -2.18 0.22 0.00 0.00 0.00 0.00 51.96 50.00 2nqn s ALA 244 Cb 0.04 0.27 -0.24 0.00 0.00 0.00 0.00 23.12 23.19 2nqn s ALA 244 CO 0.23 -0.14 0.60 -0.25 0.00 0.00 0.00 175.76 176.20 2nqn n ASP 245 N -0.83 0.24 -3.80 0.00 9.92 0.75 -4.56 116.55 118.27 2nqn n ASP 245 Ca -0.04 0.10 -0.13 0.00 -0.53 0.00 0.00 54.79 54.18 2nqn n ASP 245 Cb 0.66 1.47 -0.14 0.00 -0.64 0.00 0.00 41.12 42.47 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 -3.38 -0.02 -0.16 2.53 1.01 -1.02 -1.33 120.40 118.03 2nqn s VAL 246 Ca -0.06 0.08 -0.01 0.00 0.00 0.00 0.00 61.98 61.99 2nqn s VAL 246 Cb 0.12 -0.17 -0.01 0.00 0.00 0.00 0.00 36.38 36.32 2nqn s VAL 246 CO 0.87 0.03 -0.13 -0.69 0.00 0.00 0.00 175.10 175.19 2nqn s VAL 247 N 0.53 2.88 -0.11 2.92 1.01 0.13 -0.18 120.40 127.57 2nqn s VAL 247 Ca -0.04 -0.69 0.03 0.00 0.00 0.00 0.00 61.98 61.28 2nqn s VAL 247 Cb -0.06 -2.24 0.00 0.00 0.00 0.00 0.00 36.38 34.09 2nqn s VAL 247 CO -0.02 0.50 -0.22 -0.63 0.00 0.00 0.00 175.10 174.72 2nqn s ILE 248 N 0.84 2.15 -0.31 2.22 1.01 0.11 -1.16 121.20 126.06 2nqn s ILE 248 Ca -0.04 -0.98 -0.16 0.00 0.00 0.00 0.00 60.65 59.48 2nqn s ILE 248 Cb -0.15 -1.84 -0.02 0.00 0.01 0.00 0.00 42.46 40.46 2nqn s ILE 248 CO 0.00 0.55 0.40 -0.55 0.00 0.00 0.00 174.94 175.35 2nqn s SER 249 N 0.48 6.25 0.32 3.58 0.15 -0.67 -2.20 113.70 121.60 2nqn s SER 249 Ca -0.15 0.08 0.26 0.00 0.70 0.00 0.00 55.95 56.84 2nqn s SER 249 Cb -0.17 -2.22 0.83 0.00 -1.71 0.00 0.00 66.02 62.74 2nqn s SER 249 CO 0.06 -0.29 1.75 -1.28 1.20 0.00 0.00 173.24 174.68 2nqn h SER 250 N 8.31 0.00 -0.52 5.45 0.87 -1.31 -1.59 113.55 124.76 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 0.69 0.00 0.00 0.61 -0.53 0.00 0.00 176.83 177.60 2nqn n GLY 251 N 0.79 3.84 0.00 5.77 0.00 -1.26 -4.68 105.19 109.65 2nqn n GLY 251 Ca 0.04 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.47 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 -1.17 2.05 3.81 -0.02 0.00 -1.26 -1.54 105.19 107.07 2nqn n GLY 252 Ca 0.00 -0.33 -0.38 0.00 0.00 0.00 0.00 46.02 45.31 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 -1.44 4.67 0.32 1.61 1.01 -1.26 -4.82 120.40 120.48 2nqn s VAL 253 Ca 0.00 1.27 -0.29 0.00 0.00 0.00 0.00 61.98 62.96 2nqn s VAL 253 Cb 0.00 -3.92 -0.13 0.00 0.00 0.00 0.00 36.38 32.33 2nqn s VAL 253 CO 0.00 0.49 1.30 -0.24 0.00 0.00 0.00 175.10 176.65 2nqn n SER 254 N 1.52 2.71 -0.19 3.32 2.88 -1.26 -4.88 113.62 117.72 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 -1.47 0.16 0.00 -0.75 0.00 0.00 64.21 62.65 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 0.67 1.96 0.00 2.46 0.24 -1.26 -4.87 118.33 117.54 2nqn n VAL 255 Ca 0.06 -2.43 0.00 0.00 -2.04 0.00 0.00 64.34 59.93 2nqn n VAL 255 Cb 0.35 -0.24 0.00 0.00 -1.47 0.00 0.00 33.84 32.48 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 -1.36 2.18 3.69 7.63 0.00 -1.26 -4.34 105.19 111.72 2nqn n GLY 256 Ca 0.17 -0.23 -0.41 0.00 0.00 0.00 0.00 46.02 45.55 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 1.87 -2.44 1.61 4.07 -1.26 -4.93 120.64 119.56 2nqn n GLU 257 Ca 0.00 0.66 -0.42 0.00 -0.06 0.00 0.00 57.16 57.34 2nqn n GLU 257 Cb 0.00 -2.31 -0.03 0.00 -0.06 0.00 0.00 31.44 29.04 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 -1.19 3.44 0.03 4.31 0.00 -1.26 -4.74 121.76 122.35 2nqn s ALA 258 Ca 0.60 0.74 -0.28 0.00 0.00 0.00 0.00 51.96 53.02 2nqn s ALA 258 Cb -0.53 -3.48 0.10 0.00 0.00 0.00 0.00 23.12 19.20 2nqn s ALA 258 CO 0.59 -0.60 1.23 0.16 0.00 0.00 0.00 175.76 177.13 2nqn s ASP 259 N 1.30 -0.02 0.54 0.00 -4.77 -1.26 -5.01 116.67 107.44 2nqn s ASP 259 Ca 0.57 -0.28 0.25 0.00 -3.30 0.00 0.00 52.55 49.79 2nqn s ASP 259 Cb -0.27 0.23 1.51 0.00 -1.09 0.00 0.00 42.92 43.30 2nqn s ASP 259 CO 0.26 -0.45 2.14 0.10 0.70 0.00 0.00 175.17 177.91 2nqn h TYR 260 N 2.00 0.00 -0.29 2.11 -0.00 -2.00 -2.07 116.97 116.72 2nqn h TYR 260 Ca -0.26 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 1.06 0.07 -0.43 1.79 -0.00 0.00 0.00 178.16 180.66 2nqn h THR 261 N 0.00 1.29 -0.66 -0.90 1.35 -1.95 -2.29 112.91 109.75 2nqn h THR 261 Ca -0.00 -1.61 -0.02 0.00 -0.55 0.00 0.00 66.41 64.23 2nqn h THR 261 Cb 0.17 1.53 -0.03 0.00 -1.73 0.00 0.00 68.15 68.09 2nqn h THR 261 CO 0.01 0.52 0.33 0.50 -0.25 0.00 0.00 175.52 176.63 2nqn h LYS 262 N 0.58 0.94 -0.50 4.72 3.64 -1.67 -0.45 116.57 123.83 2nqn h LYS 262 Ca 0.04 -0.13 -0.01 0.00 -1.27 0.00 0.00 60.65 59.28 2nqn h LYS 262 Cb 0.97 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 32.60 2nqn h LYS 262 CO 0.09 0.74 0.26 1.15 -2.27 0.00 0.00 179.45 179.41 2nqn h THR 263 N 0.91 1.18 -0.62 1.00 2.02 -1.39 -0.19 112.91 115.82 2nqn h THR 263 Ca 0.23 -0.49 -0.02 0.00 0.77 0.00 0.00 66.41 66.89 2nqn h THR 263 Cb 0.10 0.59 -0.03 0.00 -1.74 0.00 0.00 68.15 67.07 2nqn h THR 263 CO -0.03 0.20 0.29 0.40 0.37 0.00 0.00 175.52 176.75 2nqn h ILE 264 N 0.66 1.22 0.17 3.11 2.04 -1.10 -1.73 117.51 121.88 2nqn h ILE 264 Ca 0.17 -0.63 0.00 0.00 1.00 0.00 0.00 64.86 65.41 2nqn h ILE 264 Cb 0.08 0.48 -0.01 0.00 -0.74 0.00 0.00 36.82 36.63 2nqn h ILE 264 CO -0.03 0.25 -0.15 -0.07 0.00 0.00 0.00 178.15 178.15 2nqn h LEU 265 N 0.86 -0.41 -1.99 1.44 3.38 -0.58 -0.46 115.31 117.54 2nqn h LEU 265 Ca 0.21 0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.20 2nqn h LEU 265 Cb 0.13 0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.02 2nqn h LEU 265 CO -0.03 -0.24 -0.10 -0.33 0.09 0.00 0.00 178.44 177.84 2nqn h GLU 266 N -0.35 0.00 0.00 1.13 5.08 -0.94 -1.87 114.58 117.63 2nqn h GLU 266 Ca 0.00 0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 58.14 2nqn h GLU 266 Cb 0.32 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.54 2nqn h GLU 266 CO -0.03 0.10 -1.18 1.49 -1.00 0.00 0.00 179.01 178.39 2nqn h GLU 267 N 0.00 0.00 0.00 2.33 4.81 -0.91 -3.34 114.58 117.47 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 0.25 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.63 2nqn h GLU 267 CO 0.01 0.79 -0.61 1.28 -0.73 0.00 0.00 179.01 179.75 2nqn n LEU 268 N -3.23 0.58 0.00 1.64 4.77 -0.22 -5.02 117.00 115.52 2nqn n LEU 268 Ca -0.05 0.08 0.01 0.00 -0.03 0.00 0.00 56.01 56.02 2nqn n LEU 268 Cb 0.95 -0.21 0.02 0.00 -2.33 0.00 0.00 43.42 41.85 2nqn n LEU 268 CO 0.46 0.05 0.97 0.61 -1.33 0.00 0.00 177.39 178.15 2nqn n GLY 269 N 1.43 0.36 3.38 -0.72 0.00 -0.76 -4.20 105.19 104.67 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 -2.02 3.37 -0.08 1.61 0.41 -0.63 -4.45 118.70 116.89 2nqn s GLU 270 Ca 0.27 -1.81 0.02 0.00 -0.41 0.00 0.00 54.97 53.03 2nqn s GLU 270 Cb -0.01 -4.49 -0.02 0.00 -1.78 0.00 0.00 34.13 27.82 2nqn s GLU 270 CO 0.01 -1.52 -0.13 0.42 -0.49 0.00 0.00 175.26 173.56 2nqn s ILE 271 N 1.85 3.15 -0.02 -1.63 1.09 -1.26 -1.96 121.20 122.43 2nqn s ILE 271 Ca 0.19 -0.66 -0.02 0.00 -1.10 0.00 0.00 60.65 59.06 2nqn s ILE 271 Cb -0.15 -2.28 -0.04 0.00 -1.06 0.00 0.00 42.46 38.93 2nqn s ILE 271 CO -0.03 0.56 0.11 0.00 -0.10 0.00 0.00 174.94 175.48 2nqn s ALA 272 N -0.30 3.68 -0.50 9.38 0.00 0.11 -4.95 121.76 129.18 2nqn s ALA 272 Ca 0.03 -0.82 -0.02 0.00 0.00 0.00 0.00 51.96 51.15 2nqn s ALA 272 Cb -0.13 -1.68 0.13 0.00 0.00 0.00 0.00 23.12 21.44 2nqn s ALA 272 CO 0.03 0.69 0.29 -0.06 0.00 0.00 0.00 175.76 176.71 2nqn s PHE 273 N -1.20 3.49 0.50 0.00 0.40 -1.26 -1.59 117.98 118.32 2nqn s PHE 273 Ca 0.23 -2.67 -0.08 0.00 -0.60 0.00 0.00 56.93 53.81 2nqn s PHE 273 Cb -0.12 -3.15 -0.04 0.00 0.51 0.00 0.00 43.02 40.22 2nqn s PHE 273 CO 0.14 -0.89 0.84 -1.58 0.70 0.00 0.00 175.22 174.42 2nqn s TRP 274 N 0.49 3.56 -0.35 0.36 0.51 -0.31 -4.95 118.94 118.25 2nqn s TRP 274 Ca 0.13 0.98 0.00 0.00 -2.12 0.00 0.00 56.10 55.09 2nqn s TRP 274 Cb -0.22 -2.43 0.11 0.00 -0.81 0.00 0.00 33.47 30.12 2nqn s TRP 274 CO -0.04 -0.33 0.13 0.15 -0.51 0.00 0.00 176.95 176.35 2nqn s LYS 275 N -4.63 0.91 0.32 4.98 1.02 -1.26 -2.53 119.74 118.55 2nqn s LYS 275 Ca 0.50 -1.38 -0.23 0.00 0.02 0.00 0.00 55.97 54.88 2nqn s LYS 275 Cb -0.10 -2.15 -0.10 0.00 -0.52 0.00 0.00 37.83 34.96 2nqn s LYS 275 CO 0.44 -1.04 0.89 -0.51 -0.92 0.00 0.00 175.35 174.21 2nqn s LEU 276 N 1.22 4.25 -1.36 3.17 1.02 0.20 -2.56 118.68 124.63 2nqn s LEU 276 Ca 0.12 1.69 -0.10 0.00 0.02 0.00 0.00 54.13 55.86 2nqn s LEU 276 Cb -0.19 -4.02 0.11 0.00 0.02 0.00 0.00 46.19 42.10 2nqn s LEU 276 CO -0.17 -0.11 2.13 0.00 0.02 0.00 0.00 176.35 178.22 2nqn n ALA 277 N 0.32 5.80 -2.27 4.21 0.00 0.12 -4.49 120.51 124.20 2nqn n ALA 277 Ca 0.02 -4.11 -0.15 0.00 0.00 0.00 0.00 53.44 49.20 2nqn n ALA 277 Cb 0.51 -3.13 -0.10 0.00 0.00 0.00 0.00 19.45 16.73 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 1.04 0.43 -0.27 0.00 -4.36 -1.26 -1.70 121.20 115.07 2nqn s ILE 278 Ca 0.46 -1.99 -0.16 0.00 -0.26 0.00 0.00 60.65 58.70 2nqn s ILE 278 Cb 0.13 -2.49 0.08 0.00 1.25 0.00 0.00 42.46 41.43 2nqn s ILE 278 CO -0.04 -0.11 0.67 -0.75 0.24 0.00 0.00 174.94 174.96 2nqn s LYS 279 N -4.04 0.69 1.02 0.37 2.20 -0.65 -4.44 119.74 114.89 2nqn s LYS 279 Ca 0.35 1.20 -0.14 0.00 -0.36 0.00 0.00 55.97 57.02 2nqn s LYS 279 Cb 0.07 0.13 0.20 0.00 -1.51 0.00 0.00 37.83 36.72 2nqn s LYS 279 CO 0.11 -0.15 1.13 -1.25 -0.36 0.00 0.00 175.35 174.83 2nqn s PRO 280 N 1.61 0.25 0.17 4.03 0.04 -1.26 0.15 135.00 139.99 2nqn s PRO 280 Ca -0.10 0.22 0.00 0.00 0.04 0.00 0.00 61.00 61.16 2nqn s PRO 280 Cb -0.05 -1.74 0.00 0.00 0.04 0.00 0.00 34.50 32.75 2nqn s PRO 280 CO -0.19 -2.79 0.00 0.41 0.04 0.00 0.00 177.00 174.47 2nqn n GLY 281 N -1.63 -1.75 0.00 0.56 0.00 -1.26 -4.86 105.19 96.25 2nqn n GLY 281 Ca 0.08 -1.96 0.00 0.00 0.00 0.00 0.00 46.02 44.14 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 -2.72 1.61 4.81 -1.26 -4.72 118.16 115.88 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 -0.06 0.00 0.02 0.00 0.00 35.03 34.99 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 4.15 -0.29 1.64 0.05 -1.26 0.60 135.00 139.89 2nqn s PRO 283 Ca 0.00 1.06 -0.19 0.00 0.05 0.00 0.00 61.00 61.92 2nqn s PRO 283 Cb 0.00 -2.18 0.13 0.00 0.05 0.00 0.00 34.50 32.50 2nqn s PRO 283 CO 0.00 -0.09 0.95 0.12 0.05 0.00 0.00 177.00 178.03 2nqn s PHE 284 N -2.29 -0.61 -0.14 0.56 5.36 -1.05 -4.46 117.98 115.35 2nqn s PHE 284 Ca 0.61 1.28 -0.03 0.00 -0.96 0.00 0.00 56.93 57.83 2nqn s PHE 284 Cb -0.09 0.38 -0.03 0.00 -0.34 0.00 0.00 43.02 42.94 2nqn s PHE 284 CO 0.18 -0.30 -0.04 0.00 -1.46 0.00 0.00 175.22 173.60 2nqn s ALA 285 N 1.05 3.00 -0.02 11.12 0.00 -0.79 -1.16 121.76 134.97 2nqn s ALA 285 Ca -0.06 -0.83 -0.05 0.00 0.00 0.00 0.00 51.96 51.03 2nqn s ALA 285 Cb -0.04 -1.51 0.00 0.00 0.00 0.00 0.00 23.12 21.58 2nqn s ALA 285 CO -0.13 0.28 0.11 0.12 0.00 0.00 0.00 175.76 176.14 2nqn s PHE 286 N 0.16 -0.01 -2.47 0.00 5.36 -0.62 0.55 117.98 120.95 2nqn s PHE 286 Ca -0.02 0.01 0.00 0.00 -0.96 0.00 0.00 56.93 55.97 2nqn s PHE 286 Cb -0.14 -0.03 0.00 0.00 -0.34 0.00 0.00 43.02 42.52 2nqn s PHE 286 CO 0.03 -0.18 0.00 0.41 -1.46 0.00 0.00 175.22 174.02 2nqn n GLY 287 N 2.12 -1.80 3.68 13.12 0.00 -1.03 0.05 105.19 121.33 2nqn n GLY 287 Ca -0.19 -1.12 -0.35 0.00 0.00 0.00 0.00 46.02 44.36 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 -1.69 3.71 0.25 1.61 2.20 -0.83 -0.75 119.74 124.23 2nqn s LYS 288 Ca 0.00 -0.32 0.04 0.00 -0.36 0.00 0.00 55.97 55.33 2nqn s LYS 288 Cb 0.00 -3.13 0.04 0.00 -1.51 0.00 0.00 37.83 33.23 2nqn s LYS 288 CO 0.00 0.44 0.34 1.28 -0.36 0.00 0.00 175.35 177.05 2nqn n LEU 289 N 3.02 0.00 -0.02 5.43 4.77 0.33 -1.61 117.00 128.93 2nqn n LEU 289 Ca -0.17 -1.03 -0.09 0.00 -0.03 0.00 0.00 56.01 54.68 2nqn n LEU 289 Cb 0.53 -0.18 -0.04 0.00 -2.33 0.00 0.00 43.42 41.40 2nqn n LEU 289 CO 0.33 -0.60 0.84 0.28 -1.33 0.00 0.00 177.39 176.91 2nqn h SER 290 N 0.02 -0.15 0.00 -1.43 0.02 -1.94 -3.32 113.55 106.75 2nqn h SER 290 Ca -0.11 0.05 -0.02 0.00 -0.84 0.00 0.00 61.79 60.86 2nqn h SER 290 Cb 0.52 0.10 -0.05 0.00 0.14 0.00 0.00 62.40 63.11 2nqn h SER 290 CO 0.16 -0.06 -0.37 0.59 -1.14 0.00 0.00 176.83 176.01 2nqn n ASN 291 N -5.18 1.44 -3.64 3.07 3.02 -1.26 -5.08 115.26 107.62 2nqn n ASN 291 Ca -0.03 -2.84 -0.06 0.00 -0.03 0.00 0.00 54.58 51.61 2nqn n ASN 291 Cb 0.11 -0.37 -0.01 0.00 -0.61 0.00 0.00 39.78 38.89 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 -2.36 -0.18 -0.02 6.41 1.04 -1.25 -4.71 113.70 112.64 2nqn s SER 292 Ca 0.25 -0.67 -0.02 0.00 0.48 0.00 0.00 55.95 55.99 2nqn s SER 292 Cb 0.24 0.69 -0.04 0.00 0.10 0.00 0.00 66.02 67.02 2nqn s SER 292 CO -0.03 -1.31 0.16 0.26 0.98 0.00 0.00 173.24 173.31 2nqn s TRP 293 N -3.41 3.49 -0.07 5.02 0.52 -0.44 -0.51 118.94 123.54 2nqn s TRP 293 Ca 0.13 0.33 0.04 0.00 0.02 0.00 0.00 56.10 56.62 2nqn s TRP 293 Cb -0.05 -1.82 -0.02 0.00 -1.15 0.00 0.00 33.47 30.44 2nqn s TRP 293 CO 0.07 0.63 -0.19 0.12 0.02 0.00 0.00 176.95 177.60 2nqn s PHE 294 N -1.28 2.61 -0.13 -1.98 5.36 0.07 0.17 117.98 122.79 2nqn s PHE 294 Ca 0.25 -0.54 -0.00 0.00 -0.96 0.00 0.00 56.93 55.68 2nqn s PHE 294 Cb -0.12 -1.67 0.03 0.00 -0.34 0.00 0.00 43.02 40.91 2nqn s PHE 294 CO 0.17 -0.10 -0.10 0.00 -1.46 0.00 0.00 175.22 173.72 2nqn s GLY 296 N 1.60 1.74 0.11 0.00 0.00 0.19 -1.67 107.32 109.29 2nqn s GLY 296 Ca 0.05 -1.04 -0.00 0.00 0.00 0.00 0.00 44.72 43.72 2nqn s GLY 296 CO -0.09 0.36 0.28 1.08 0.00 0.00 0.00 173.10 174.72 2nqn s LEU 297 N 1.25 4.32 0.68 0.66 1.02 -0.60 -1.88 118.68 124.14 2nqn s LEU 297 Ca 0.04 0.33 -0.12 0.00 0.02 0.00 0.00 54.13 54.39 2nqn s LEU 297 Cb -0.15 -3.04 0.01 0.00 0.02 0.00 0.00 46.19 43.03 2nqn s LEU 297 CO 0.02 0.10 1.07 -2.16 0.02 0.00 0.00 176.35 175.40 2nqn s PRO 298 N -2.77 2.87 0.27 1.29 0.04 -1.26 -4.28 135.00 131.17 2nqn s PRO 298 Ca 0.36 1.10 0.03 0.00 0.04 0.00 0.00 61.00 62.53 2nqn s PRO 298 Cb -0.12 -1.98 0.39 0.00 0.04 0.00 0.00 34.50 32.83 2nqn s PRO 298 CO 0.28 -1.16 1.70 0.78 0.04 0.00 0.00 177.00 178.64 2nqn h GLY 299 N -0.46 0.48 -4.70 0.56 0.00 -1.94 -3.36 103.07 93.66 2nqn h GLY 299 Ca -0.45 -0.42 -0.52 0.00 0.00 0.00 0.00 47.33 45.94 2nqn h GLY 299 CO 0.56 0.38 0.99 0.21 0.00 0.00 0.00 176.54 178.67 2nqn s ASN 300 N -6.83 6.45 0.18 0.19 2.47 -1.26 -4.87 114.94 111.27 2nqn s ASN 300 Ca -0.06 2.77 -0.14 0.00 0.42 0.00 0.00 52.86 55.85 2nqn s ASN 300 Cb 0.13 -2.59 0.16 0.00 -1.45 0.00 0.00 41.25 37.50 2nqn s ASN 300 CO 0.79 -0.93 1.72 -0.65 -3.72 0.00 0.00 177.10 174.31 2nqn h PRO 301 N 7.09 0.24 -0.37 0.43 0.11 -1.86 0.11 132.00 137.75 2nqn h PRO 301 Ca -0.43 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.64 2nqn h PRO 301 Cb 1.20 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 32.24 2nqn h PRO 301 CO 0.94 0.16 0.14 0.28 -0.21 0.00 0.00 178.00 179.31 2nqn h VAL 302 N 0.25 1.20 -0.37 3.15 2.07 -1.87 -1.81 116.25 118.86 2nqn h VAL 302 Ca 0.23 -0.61 -0.00 0.00 0.82 0.00 0.00 66.70 67.13 2nqn h VAL 302 Cb 0.29 0.91 -0.02 0.00 -1.52 0.00 0.00 31.29 30.95 2nqn h VAL 302 CO -0.29 0.22 0.21 0.28 0.02 0.00 0.00 177.57 178.01 2nqn h SER 303 N 0.44 0.45 -0.56 0.57 0.02 -1.76 -1.56 113.55 111.16 2nqn h SER 303 Ca 0.12 -0.07 -0.04 0.00 -0.84 0.00 0.00 61.79 60.96 2nqn h SER 303 Cb 0.21 -0.11 -0.02 0.00 0.14 0.00 0.00 62.40 62.61 2nqn h SER 303 CO -0.01 0.39 0.20 0.00 -1.14 0.00 0.00 176.83 176.27 2nqn h ALA 304 N 1.08 0.72 -0.03 3.77 0.00 -0.72 -0.86 119.26 123.22 2nqn h ALA 304 Ca 0.13 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 2nqn h ALA 304 Cb 0.03 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 2nqn h ALA 304 CO -0.02 0.36 0.01 1.15 0.00 0.00 0.00 179.25 180.75 2nqn h THR 305 N 0.77 1.12 -0.61 0.00 2.02 -1.16 0.04 112.91 115.09 2nqn h THR 305 Ca 0.18 -0.36 -0.04 0.00 0.77 0.00 0.00 66.41 66.96 2nqn h THR 305 Cb 0.24 1.31 -0.03 0.00 -1.74 0.00 0.00 68.15 67.94 2nqn h THR 305 CO -0.01 0.10 0.22 0.25 0.37 0.00 0.00 175.52 176.45 2nqn h LEU 306 N -0.10 0.87 -0.50 2.58 7.12 -1.25 0.59 115.31 124.61 2nqn h LEU 306 Ca 0.01 -0.19 -0.04 0.00 0.13 0.00 0.00 57.88 57.79 2nqn h LEU 306 Cb 0.15 -0.23 -0.02 0.00 -0.53 0.00 0.00 40.66 40.03 2nqn h LEU 306 CO -0.00 0.83 0.16 0.74 -0.13 0.00 0.00 178.44 180.03 2nqn h THR 307 N 0.86 1.23 -0.38 1.05 2.02 -1.03 0.59 112.91 117.25 2nqn h THR 307 Ca 0.20 -0.77 -0.02 0.00 0.77 0.00 0.00 66.41 66.59 2nqn h THR 307 Cb 0.25 0.78 -0.02 0.00 -1.74 0.00 0.00 68.15 67.42 2nqn h THR 307 CO -0.01 0.28 0.15 0.15 0.37 0.00 0.00 175.52 176.46 2nqn h PHE 308 N 0.68 0.58 -0.66 3.16 3.57 -0.75 0.69 116.94 124.22 2nqn h PHE 308 Ca 0.16 -0.04 -0.07 0.00 3.53 0.00 0.00 57.97 61.55 2nqn h PHE 308 Cb 0.27 -0.17 -0.03 0.00 2.79 0.00 0.00 35.95 38.81 2nqn h PHE 308 CO 0.01 0.52 0.13 -0.92 -2.23 0.00 0.00 178.31 175.83 2nqn h TYR 309 N 0.47 1.12 0.00 0.41 3.20 -0.61 -0.06 116.97 121.50 2nqn h TYR 309 Ca 0.13 -0.14 0.00 0.00 3.14 0.00 0.00 58.73 61.86 2nqn h TYR 309 Cb 0.19 -0.31 0.00 0.00 1.54 0.00 0.00 36.73 38.14 2nqn h TYR 309 CO -0.00 0.93 -1.31 1.04 -1.64 0.00 0.00 178.16 177.17 2nqn n GLN 310 N -4.23 0.61 -0.04 1.82 1.13 0.18 -4.34 117.38 112.51 2nqn n GLN 310 Ca 0.05 0.02 -0.08 0.00 -1.94 0.00 0.00 57.00 55.05 2nqn n GLN 310 Cb 0.27 -1.72 -0.03 0.00 0.11 0.00 0.00 30.24 28.87 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 -2.51 0.53 -0.07 1.08 4.77 0.23 -4.65 117.00 116.38 2nqn n LEU 311 Ca -0.01 0.09 -0.14 0.00 -0.03 0.00 0.00 56.01 55.91 2nqn n LEU 311 Cb 0.55 -0.22 -0.06 0.00 -2.33 0.00 0.00 43.42 41.36 2nqn n LEU 311 CO 0.42 0.14 0.48 0.58 -1.33 0.00 0.00 177.39 177.67 2nqn h VAL 312 N -0.26 1.32 -0.48 4.08 2.07 -1.29 -3.11 116.25 118.57 2nqn h VAL 312 Ca -0.18 -1.62 0.09 0.00 0.82 0.00 0.00 66.70 65.81 2nqn h VAL 312 Cb 1.14 1.80 -0.08 0.00 -1.52 0.00 0.00 31.29 32.63 2nqn h VAL 312 CO -0.11 0.51 -0.03 -0.61 0.02 0.00 0.00 177.57 177.35 2nqn h GLN 313 N 0.37 0.08 -0.12 1.57 4.15 -1.24 -0.11 115.11 119.81 2nqn h GLN 313 Ca 0.01 -0.01 -0.08 0.00 0.77 0.00 0.00 58.65 59.35 2nqn h GLN 313 Cb 1.01 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 28.66 2nqn h GLN 313 CO 0.09 0.06 -0.28 -1.35 -1.93 0.00 0.00 178.83 175.42 2nqn h PRO 314 N 0.09 0.22 -0.58 -2.39 0.11 -1.82 -1.86 132.00 125.77 2nqn h PRO 314 Ca 0.24 -0.08 -0.10 0.00 0.11 0.00 0.00 66.00 66.17 2nqn h PRO 314 Cb 0.37 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 31.44 2nqn h PRO 314 CO -0.43 0.49 -0.04 1.25 -0.21 0.00 0.00 178.00 179.06 2nqn h LEU 315 N 0.20 1.04 -0.85 2.35 6.46 -1.14 -2.37 115.31 121.00 2nqn h LEU 315 Ca 0.03 -0.32 -0.08 0.00 -0.12 0.00 0.00 57.88 57.39 2nqn h LEU 315 Cb 0.60 -0.28 -0.02 0.00 -0.73 0.00 0.00 40.66 40.23 2nqn h LEU 315 CO 0.04 1.12 -0.01 -0.07 -0.62 0.00 0.00 178.44 178.90 2nqn h LEU 316 N 0.94 0.82 -0.69 2.25 3.38 -0.77 -1.55 115.31 119.70 2nqn h LEU 316 Ca 0.16 -0.21 -0.04 0.00 0.09 0.00 0.00 57.88 57.88 2nqn h LEU 316 Cb 0.61 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.11 2nqn h LEU 316 CO 0.04 0.89 0.28 0.00 0.09 0.00 0.00 178.44 179.74 2nqn h ALA 317 N 1.20 0.89 -0.21 1.53 0.00 -1.08 -1.46 119.26 120.13 2nqn h ALA 317 Ca 0.15 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 2nqn h ALA 317 Cb 0.48 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 2nqn h ALA 317 CO 0.02 0.50 -0.07 -0.22 0.00 0.00 0.00 179.25 179.48 2nqn h LYS 318 N 0.97 0.42 -0.52 0.00 3.64 -1.18 -3.01 116.57 116.89 2nqn h LYS 318 Ca 0.23 -0.17 0.04 0.00 -1.27 0.00 0.00 60.65 59.48 2nqn h LYS 318 Cb 0.20 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 31.97 2nqn h LYS 318 CO -0.02 0.69 0.35 -0.07 -2.27 0.00 0.00 179.45 178.12 2nqn h LEU 319 N 0.14 0.48 -1.84 5.20 3.38 -1.17 -2.27 115.31 119.21 2nqn h LEU 319 Ca 0.05 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2nqn h LEU 319 Cb 0.55 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.19 2nqn h LEU 319 CO 0.03 0.33 0.00 0.77 0.09 0.00 0.00 178.44 179.65 2nqn h SER 320 N 0.55 0.00 0.00 -0.43 4.64 -1.14 -0.16 113.55 117.02 2nqn h SER 320 Ca 0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.53 2nqn h SER 320 Cb 0.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.25 2nqn h SER 320 CO -0.06 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.51 2nqn n GLY 321 N -0.28 0.31 3.70 -0.77 0.00 -0.86 -4.77 105.19 102.53 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 -2.31 6.57 -0.10 1.61 3.84 -1.17 -4.35 114.94 119.03 2nqn s ASN 322 Ca 0.00 2.59 0.10 0.00 0.21 0.00 0.00 52.86 55.76 2nqn s ASN 322 Cb 0.00 -2.58 0.46 0.00 -0.55 0.00 0.00 41.25 38.58 2nqn s ASN 322 CO 0.00 -0.87 1.26 0.35 -2.79 0.00 0.00 177.10 175.05 2nqn n THR 323 N 4.32 1.32 -4.43 -5.21 -2.24 -0.58 -4.63 114.28 102.84 2nqn n THR 323 Ca 0.15 -0.75 -0.21 0.00 -2.27 0.00 0.00 64.05 60.96 2nqn n THR 323 Cb 0.39 -0.18 -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 -1.86 2.33 0.62 6.98 0.00 -1.26 -5.09 121.76 123.49 2nqn s ALA 324 Ca 0.31 -1.91 -0.17 0.00 0.00 0.00 0.00 51.96 50.20 2nqn s ALA 324 Cb 0.22 0.23 -0.02 0.00 0.00 0.00 0.00 23.12 23.55 2nqn s ALA 324 CO 0.12 -0.09 1.13 -1.12 0.00 0.00 0.00 175.76 175.80 2nqn s SER 325 N -3.44 5.24 -0.07 0.00 0.01 -1.26 -4.88 113.70 109.30 2nqn s SER 325 Ca 0.30 2.10 0.18 0.00 1.31 0.00 0.00 55.95 59.83 2nqn s SER 325 Cb 0.04 -2.57 0.62 0.00 0.21 0.00 0.00 66.02 64.33 2nqn s SER 325 CO 0.12 -1.54 1.53 0.61 0.41 0.00 0.00 173.24 174.37 2nqn n GLY 326 N -0.20 2.81 3.21 3.44 0.00 -1.26 -4.94 105.19 108.24 2nqn n GLY 326 Ca 0.11 -0.78 -0.22 0.00 0.00 0.00 0.00 46.02 45.14 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 -1.58 2.23 0.83 0.99 1.02 -1.26 -4.82 118.68 116.08 2nqn s LEU 327 Ca 0.45 -0.57 -0.10 0.00 0.02 0.00 0.00 54.13 53.92 2nqn s LEU 327 Cb 0.28 -0.73 0.09 0.00 0.02 0.00 0.00 46.19 45.85 2nqn s LEU 327 CO 0.24 0.04 1.12 -2.84 0.02 0.00 0.00 176.35 174.92 2nqn s PRO 328 N -1.52 1.77 0.64 1.29 0.02 -1.26 -5.02 135.00 130.92 2nqn s PRO 328 Ca 0.03 1.33 -0.10 0.00 0.02 0.00 0.00 61.00 62.29 2nqn s PRO 328 Cb -0.09 -1.83 -0.01 0.00 0.02 0.00 0.00 34.50 32.59 2nqn s PRO 328 CO 0.02 -2.03 1.01 0.00 -0.33 0.00 0.00 177.00 175.67 2nqn s ALA 329 N -2.78 3.08 0.37 -1.55 0.00 -1.26 -4.95 121.76 114.67 2nqn s ALA 329 Ca 0.64 -0.35 0.08 0.00 0.00 0.00 0.00 51.96 52.33 2nqn s ALA 329 Cb -0.20 -2.92 -0.03 0.00 0.00 0.00 0.00 23.12 19.97 2nqn s ALA 329 CO 0.56 -0.87 0.29 1.03 0.00 0.00 0.00 175.76 176.77 2nqn s ARG 330 N -5.18 2.54 0.03 0.00 0.52 -1.26 -4.39 118.95 111.21 2nqn s ARG 330 Ca 0.55 -1.48 -0.15 0.00 -0.52 0.00 0.00 55.73 54.13 2nqn s ARG 330 Cb -0.11 -2.34 0.02 0.00 0.52 0.00 0.00 34.95 33.05 2nqn s ARG 330 CO 0.51 -0.03 0.32 1.14 0.02 0.00 0.00 175.30 177.25 2nqn s GLN 331 N -4.01 0.79 -0.04 3.54 -2.07 -0.54 -4.95 119.66 112.38 2nqn s GLN 331 Ca 0.43 -0.40 -0.27 0.00 -1.82 0.00 0.00 55.36 53.29 2nqn s GLN 331 Cb -0.03 0.34 -0.03 0.00 -1.09 0.00 0.00 33.01 32.20 2nqn s GLN 331 CO 0.26 -0.25 0.88 0.50 -1.32 0.00 0.00 175.29 175.36 2nqn s ARG 332 N -2.22 4.49 0.06 9.60 3.52 -1.26 -0.85 118.95 132.29 2nqn s ARG 332 Ca -0.07 1.20 -0.06 0.00 -0.13 0.00 0.00 55.73 56.67 2nqn s ARG 332 Cb -0.02 -3.47 -0.01 0.00 -1.56 0.00 0.00 34.95 29.89 2nqn s ARG 332 CO -0.01 -0.05 0.12 0.08 -0.81 0.00 0.00 175.30 174.63 2nqn s VAL 333 N 1.10 0.15 0.13 7.11 1.01 0.83 -4.94 120.40 125.79 2nqn s VAL 333 Ca 0.46 -1.26 -0.16 0.00 0.00 0.00 0.00 61.98 61.01 2nqn s VAL 333 Cb -0.19 -1.21 -0.07 0.00 0.00 0.00 0.00 36.38 34.90 2nqn s VAL 333 CO 0.23 -0.70 0.57 -0.13 0.00 0.00 0.00 175.10 175.07 2nqn s ARG 334 N -3.40 4.08 0.12 2.72 0.52 -1.26 0.89 118.95 122.61 2nqn s ARG 334 Ca 0.02 0.61 -0.17 0.00 -0.52 0.00 0.00 55.73 55.67 2nqn s ARG 334 Cb 0.03 -3.03 -0.07 0.00 0.52 0.00 0.00 34.95 32.41 2nqn s ARG 334 CO -0.08 0.52 0.56 0.99 0.02 0.00 0.00 175.30 177.31 2nqn s THR 335 N -1.35 4.80 -1.29 0.02 2.01 -0.76 -1.51 115.64 117.56 2nqn s THR 335 Ca 0.35 1.00 0.12 0.00 0.31 0.00 0.00 61.69 63.48 2nqn s THR 335 Cb -0.17 -3.80 0.24 0.00 0.01 0.00 0.00 72.50 68.79 2nqn s THR 335 CO 0.19 0.37 1.13 0.00 -0.69 0.00 0.00 174.62 175.62 2nqn n ALA 336 N 1.17 2.32 -2.63 7.40 0.00 0.18 -0.79 120.51 128.16 2nqn n ALA 336 Ca -0.07 -0.93 -0.21 0.00 0.00 0.00 0.00 53.44 52.24 2nqn n ALA 336 Cb 0.51 -0.47 -0.13 0.00 0.00 0.00 0.00 19.45 19.36 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 -1.03 1.80 0.04 0.00 0.01 -1.25 -4.93 113.70 108.34 2nqn s SER 337 Ca 0.22 -0.50 -0.30 0.00 1.31 0.00 0.00 55.95 56.68 2nqn s SER 337 Cb 0.12 -0.11 -0.04 0.00 0.21 0.00 0.00 66.02 66.20 2nqn s SER 337 CO 0.17 0.03 0.96 -0.60 0.41 0.00 0.00 173.24 174.21 2nqn s ARG 338 N -1.28 4.60 -0.14 12.44 3.52 -1.26 -4.19 118.95 132.63 2nqn s ARG 338 Ca 0.02 1.40 -0.01 0.00 -0.13 0.00 0.00 55.73 57.01 2nqn s ARG 338 Cb -0.08 -3.43 -0.02 0.00 -1.56 0.00 0.00 34.95 29.86 2nqn s ARG 338 CO 0.02 0.05 -0.11 -0.51 -0.81 0.00 0.00 175.30 173.94 2nqn s LEU 339 N 0.63 2.80 -0.22 -0.88 1.43 0.34 -4.97 118.68 117.81 2nqn s LEU 339 Ca 0.49 -0.30 -0.26 0.00 -1.03 0.00 0.00 54.13 53.03 2nqn s LEU 339 Cb -0.22 -1.64 -0.00 0.00 0.03 0.00 0.00 46.19 44.36 2nqn s LEU 339 CO 0.28 0.16 0.89 -0.54 0.23 0.00 0.00 176.35 177.37 2nqn s LYS 340 N 0.40 4.24 -0.06 1.70 -0.14 -1.26 -1.03 119.74 123.59 2nqn s LYS 340 Ca -0.09 1.09 -0.03 0.00 -1.36 0.00 0.00 55.97 55.58 2nqn s LYS 340 Cb -0.16 -3.62 0.03 0.00 -1.68 0.00 0.00 37.83 32.41 2nqn s LYS 340 CO 0.05 -0.50 0.14 0.21 -0.76 0.00 0.00 175.35 174.50 2nqn s LYS 341 N 2.74 0.10 -0.24 1.68 2.47 -1.26 -4.96 119.74 120.27 2nqn s LYS 341 Ca 0.39 0.34 -0.09 0.00 -1.56 0.00 0.00 55.97 55.04 2nqn s LYS 341 Cb -0.16 -0.13 -0.04 0.00 -1.46 0.00 0.00 37.83 36.04 2nqn s LYS 341 CO 0.09 -0.14 0.12 0.99 0.16 0.00 0.00 175.35 176.57 2nqn s THR 342 N 0.97 4.89 0.56 3.43 2.01 -1.26 -2.53 115.64 123.71 2nqn s THR 342 Ca -0.07 0.02 -0.21 0.00 0.31 0.00 0.00 61.69 61.74 2nqn s THR 342 Cb -0.10 -3.28 -0.05 0.00 0.01 0.00 0.00 72.50 69.08 2nqn s THR 342 CO -0.05 0.34 1.24 -2.65 -0.69 0.00 0.00 174.62 172.82 2nqn n PRO 343 N 4.53 1.44 0.00 4.92 -0.02 -1.17 -3.73 135.00 140.97 2nqn n PRO 343 Ca -0.15 0.54 0.00 0.00 -2.02 0.00 0.00 63.50 61.86 2nqn n PRO 343 Cb 0.52 -2.44 0.00 0.00 -0.02 0.00 0.00 33.50 31.56 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 0.92 0.57 3.03 -1.23 0.00 0.51 -5.00 105.19 104.00 2nqn n GLY 344 Ca 0.12 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.96 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 0.67 -0.30 1.61 0.52 -1.17 -3.90 118.95 116.37 2nqn s ARG 345 Ca 0.00 -0.43 -0.29 0.00 -0.52 0.00 0.00 55.73 54.49 2nqn s ARG 345 Cb 0.00 -0.62 -0.01 0.00 0.52 0.00 0.00 34.95 34.85 2nqn s ARG 345 CO 0.00 0.16 1.44 -1.17 0.02 0.00 0.00 175.30 175.75 2nqn s LEU 346 N -0.56 3.80 -0.36 2.53 2.96 -0.69 -4.18 118.68 122.18 2nqn s LEU 346 Ca 0.01 1.25 -0.14 0.00 -0.22 0.00 0.00 54.13 55.03 2nqn s LEU 346 Cb -0.05 -3.54 -0.00 0.00 0.50 0.00 0.00 46.19 43.10 2nqn s LEU 346 CO 0.00 -1.24 0.28 -0.62 -1.32 0.00 0.00 176.35 173.45 2nqn s ASP 347 N 3.64 6.09 -1.25 3.68 -1.08 -0.61 -1.64 116.67 125.51 2nqn s ASP 347 Ca 0.63 -0.54 -0.11 0.00 -0.52 0.00 0.00 52.55 52.01 2nqn s ASP 347 Cb -0.19 -2.15 0.17 0.00 -1.46 0.00 0.00 42.92 39.29 2nqn s ASP 347 CO 0.27 -0.32 1.68 0.49 0.52 0.00 0.00 175.17 177.82 2nqn n PHE 348 N 5.18 3.80 -1.34 -5.34 3.01 0.12 -1.24 117.46 121.64 2nqn n PHE 348 Ca -0.12 -3.03 -0.30 0.00 1.01 0.00 0.00 57.45 55.01 2nqn n PHE 348 Cb 0.49 -2.04 0.12 0.00 -0.01 0.00 0.00 39.48 38.04 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 0.82 1.65 -0.11 -1.08 -0.21 -0.87 -4.58 119.66 115.28 2nqn s GLN 349 Ca 0.41 0.77 -0.03 0.00 0.02 0.00 0.00 55.36 56.53 2nqn s GLN 349 Cb 0.04 -1.86 -0.03 0.00 1.00 0.00 0.00 33.01 32.16 2nqn s GLN 349 CO 0.01 -1.96 0.00 1.03 -2.12 0.00 0.00 175.29 172.25 2nqn s ARG 350 N -5.02 3.20 0.31 2.91 3.00 -1.26 0.16 118.95 122.25 2nqn s ARG 350 Ca 0.62 -0.42 0.06 0.00 0.00 0.00 0.00 55.73 56.00 2nqn s ARG 350 Cb -0.17 -2.86 -0.03 0.00 0.00 0.00 0.00 34.95 31.90 2nqn s ARG 350 CO 0.56 0.59 0.26 0.20 0.00 0.00 0.00 175.30 176.91 2nqn s GLY 351 N -0.56 2.20 -0.26 -3.53 0.00 0.17 -2.88 107.32 102.46 2nqn s GLY 351 Ca 0.09 -2.02 0.03 0.00 0.00 0.00 0.00 44.72 42.82 2nqn s GLY 351 CO 0.02 -1.45 -0.08 0.14 0.00 0.00 0.00 173.10 171.73 2nqn s VAL 352 N -3.54 2.04 -0.00 1.40 1.01 0.94 -0.90 120.40 121.34 2nqn s VAL 352 Ca 0.40 -1.62 -0.29 0.00 0.00 0.00 0.00 61.98 60.48 2nqn s VAL 352 Cb 0.03 -2.21 -0.03 0.00 0.00 0.00 0.00 36.38 34.16 2nqn s VAL 352 CO 0.25 -0.10 0.92 -0.22 0.00 0.00 0.00 175.10 175.95 2nqn s LEU 353 N 1.15 4.37 0.11 3.92 2.96 -1.26 -1.67 118.68 128.25 2nqn s LEU 353 Ca -0.06 1.57 -0.20 0.00 -0.22 0.00 0.00 54.13 55.22 2nqn s LEU 353 Cb -0.20 -3.47 0.05 0.00 0.50 0.00 0.00 46.19 43.07 2nqn s LEU 353 CO -0.06 -0.21 0.49 0.00 -1.32 0.00 0.00 176.35 175.25 2nqn s GLN 354 N 0.87 1.11 0.05 1.98 -2.07 -0.30 -4.99 119.66 116.31 2nqn s GLN 354 Ca 0.49 -0.49 -0.22 0.00 -1.82 0.00 0.00 55.36 53.31 2nqn s GLN 354 Cb -0.21 0.50 -0.06 0.00 -1.09 0.00 0.00 33.01 32.16 2nqn s GLN 354 CO 0.26 -0.44 0.67 1.03 -1.32 0.00 0.00 175.29 175.49 2nqn s ARG 355 N -3.35 4.39 0.00 9.60 0.52 -1.26 -0.72 118.95 128.13 2nqn s ARG 355 Ca -0.00 0.89 0.00 0.00 -0.52 0.00 0.00 55.73 56.10 2nqn s ARG 355 Cb 0.00 -3.32 0.00 0.00 0.52 0.00 0.00 34.95 32.15 2nqn s ARG 355 CO -0.09 0.41 0.00 0.27 0.02 0.00 0.00 175.30 175.91 2nqn n ASN 356 N 2.44 0.00 -0.13 0.23 0.23 0.15 -4.88 115.26 113.30 2nqn n ASN 356 Ca -0.06 0.00 -0.10 0.00 -0.53 0.00 0.00 54.58 53.89 2nqn n ASN 356 Cb 0.50 0.00 -0.02 0.00 -2.08 0.00 0.00 39.78 38.19 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 -1.38 0.50 0.00 -2.53 0.00 -1.98 -2.81 119.26 111.06 2nqn h ALA 357 Ca 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.70 2nqn h ALA 357 Cb 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.65 2nqn h ALA 357 CO 0.00 0.21 0.00 -0.25 0.00 0.00 0.00 179.25 179.21 2nqn n ASP 358 N -4.55 0.28 -0.57 0.00 9.92 -1.26 -4.77 116.55 115.60 2nqn n ASP 358 Ca -0.01 -1.99 -0.07 0.00 -0.53 0.00 0.00 54.79 52.19 2nqn n ASP 358 Cb 0.23 -0.14 -0.03 0.00 -0.64 0.00 0.00 41.12 40.54 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 0.35 0.94 3.78 0.44 0.00 -1.06 -4.98 105.19 104.66 2nqn n GLY 359 Ca 0.00 -0.55 -0.39 0.00 0.00 0.00 0.00 46.02 45.08 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 -2.46 4.44 -0.08 1.61 2.56 -1.26 -4.73 118.70 118.77 2nqn s GLU 360 Ca 0.00 1.00 -0.25 0.00 0.00 0.00 0.00 54.97 55.72 2nqn s GLU 360 Cb 0.00 -3.28 -0.03 0.00 2.00 0.00 0.00 34.13 32.82 2nqn s GLU 360 CO 0.00 0.52 0.79 -1.17 -0.56 0.00 0.00 175.26 174.83 2nqn s LEU 361 N -0.84 4.29 0.05 2.70 2.96 -1.26 0.31 118.68 126.88 2nqn s LEU 361 Ca 0.34 1.27 0.00 0.00 -0.22 0.00 0.00 54.13 55.52 2nqn s LEU 361 Cb -0.21 -3.21 -0.03 0.00 0.50 0.00 0.00 46.19 43.23 2nqn s LEU 361 CO 0.23 -0.22 -0.04 -1.83 -1.32 0.00 0.00 176.35 173.17 2nqn s GLU 362 N 1.20 0.54 0.03 1.98 -1.05 0.10 -4.16 118.70 117.34 2nqn s GLU 362 Ca 0.40 -0.98 0.04 0.00 -0.15 0.00 0.00 54.97 54.28 2nqn s GLU 362 Cb -0.18 0.06 -0.04 0.00 -0.44 0.00 0.00 34.13 33.53 2nqn s GLU 362 CO 0.18 -0.06 -0.07 0.14 0.95 0.00 0.00 175.26 176.41 2nqn s VAL 363 N -2.78 3.64 0.12 1.83 -7.23 -0.57 -1.15 120.40 114.27 2nqn s VAL 363 Ca -0.02 -0.88 0.08 0.00 -1.81 0.00 0.00 61.98 59.36 2nqn s VAL 363 Cb -0.00 -2.62 -0.04 0.00 0.56 0.00 0.00 36.38 34.28 2nqn s VAL 363 CO -0.05 0.32 -0.20 -0.89 -0.31 0.00 0.00 175.10 173.97 2nqn s THR 364 N -1.07 1.71 0.58 5.32 2.01 -0.67 -0.65 115.64 122.88 2nqn s THR 364 Ca 0.19 -1.65 -0.16 0.00 0.31 0.00 0.00 61.69 60.38 2nqn s THR 364 Cb -0.11 -1.62 -0.04 0.00 0.01 0.00 0.00 72.50 70.73 2nqn s THR 364 CO 0.10 -0.15 1.05 0.28 -0.69 0.00 0.00 174.62 175.21 2nqn s THR 365 N -1.45 3.87 -0.20 -0.82 -1.32 -1.26 -0.04 115.64 114.42 2nqn s THR 365 Ca 0.09 0.89 0.16 0.00 -1.21 0.00 0.00 61.69 61.62 2nqn s THR 365 Cb -0.09 -3.41 0.11 0.00 -1.51 0.00 0.00 72.50 67.59 2nqn s THR 365 CO 0.05 -0.52 1.47 0.71 -2.21 0.00 0.00 174.62 174.12 2nqn h THR 366 N 0.50 0.73 0.00 5.08 1.35 -1.85 -3.43 112.91 115.30 2nqn h THR 366 Ca -0.47 -2.04 0.00 0.00 -0.55 0.00 0.00 66.41 63.35 2nqn h THR 366 Cb 1.22 2.36 0.00 0.00 -1.73 0.00 0.00 68.15 70.00 2nqn h THR 366 CO 0.58 0.42 0.00 0.61 -0.25 0.00 0.00 175.52 176.88 2nqn n GLY 367 N 1.21 0.48 3.70 5.82 0.00 -1.26 -5.01 105.19 110.12 2nqn n GLY 367 Ca 0.02 -1.35 -0.42 0.00 0.00 0.00 0.00 46.02 44.27 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 -3.83 2.50 -2.06 1.61 2.46 -1.26 -4.88 115.29 109.84 2nqn s HIS 368 Ca 0.00 0.20 0.15 0.00 0.47 0.00 0.00 55.06 55.88 2nqn s HIS 368 Cb 0.00 -4.11 0.44 0.00 -0.13 0.00 0.00 32.58 28.78 2nqn s HIS 368 CO 0.00 -4.41 1.36 1.04 -2.47 0.00 0.00 174.74 170.26 2nqn n GLN 369 N 5.00 1.99 -1.69 2.88 1.13 -1.26 -4.91 117.38 120.53 2nqn n GLN 369 Ca 0.16 -1.53 -0.36 0.00 -1.94 0.00 0.00 57.00 53.33 2nqn n GLN 369 Cb 0.38 -1.36 0.07 0.00 0.11 0.00 0.00 30.24 29.44 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 -1.11 2.71 -0.05 1.08 0.00 -1.26 -4.90 107.32 103.79 2nqn s GLY 370 Ca 0.30 1.10 0.07 0.00 0.00 0.00 0.00 44.72 46.19 2nqn s GLY 370 CO 0.21 1.52 1.07 -1.14 0.00 0.00 0.00 173.10 174.77 2nqn n SER 371 N -2.10 2.14 -0.14 1.64 3.41 -1.26 -3.73 113.62 113.57 2nqn n SER 371 Ca 0.15 -2.18 0.13 0.00 -0.26 0.00 0.00 58.87 56.71 2nqn n SER 371 Cb 0.49 -0.39 0.40 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 0.26 0.00 -4.20 7.33 1.44 -1.26 -4.54 115.22 114.25 2nqn n HIS 372 Ca 0.10 0.00 -0.14 0.00 -2.01 0.00 0.00 57.72 55.66 2nqn n HIS 372 Cb 0.43 -0.19 -0.11 0.00 0.12 0.00 0.00 29.99 30.24 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 -2.66 1.01 -0.50 0.61 -4.36 -1.24 -5.05 121.20 109.01 2nqn s ILE 373 Ca 0.21 -1.80 0.09 0.00 -0.26 0.00 0.00 60.65 58.89 2nqn s ILE 373 Cb 0.19 -1.55 -0.08 0.00 1.25 0.00 0.00 42.46 42.27 2nqn s ILE 373 CO 0.56 -0.64 0.42 0.33 0.24 0.00 0.00 174.94 175.85 2nqn n PHE 374 N 0.27 0.00 0.34 1.37 7.35 -1.26 -4.69 117.46 120.83 2nqn n PHE 374 Ca -0.14 0.00 0.22 0.00 -0.76 0.00 0.00 57.45 56.77 2nqn n PHE 374 Cb 0.59 0.00 1.18 0.00 0.35 0.00 0.00 39.48 41.60 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 0.19 0.00 0.20 -2.13 4.64 -1.97 -2.62 113.55 111.85 2nqn h SER 375 Ca 0.00 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.29 2nqn h SER 375 Cb 0.23 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.31 2nqn h SER 375 CO 0.00 0.00 -0.14 0.77 -0.87 0.00 0.00 176.83 176.59 2nqn h SER 376 N 0.00 0.00 0.31 4.97 4.64 -1.91 0.02 113.55 121.58 2nqn h SER 376 Ca 0.00 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.21 2nqn h SER 376 Cb 0.05 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.13 2nqn h SER 376 CO -0.00 0.14 -0.45 -0.26 -0.87 0.00 0.00 176.83 175.40 2nqn h PHE 377 N 0.00 0.21 0.16 4.77 -1.00 -1.81 -0.34 116.94 118.93 2nqn h PHE 377 Ca -0.00 -0.06 -0.27 0.00 2.81 0.00 0.00 57.97 60.45 2nqn h PHE 377 Cb 0.28 -0.05 0.01 0.00 3.61 0.00 0.00 35.95 39.81 2nqn h PHE 377 CO 0.00 0.60 -1.27 1.03 -1.61 0.00 0.00 178.31 177.06 2nqn h SER 378 N 0.15 0.53 0.51 2.17 0.87 -1.57 -3.35 113.55 112.86 2nqn h SER 378 Ca 0.01 -0.91 -0.09 0.00 -1.23 0.00 0.00 61.79 59.57 2nqn h SER 378 Cb 0.85 -0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 62.63 2nqn h SER 378 CO 0.07 1.59 -0.42 -0.07 -0.53 0.00 0.00 176.83 177.46 2nqn h LEU 379 N -0.19 0.00-10.68 2.23 3.38 -0.98 -3.45 115.31 105.61 2nqn h LEU 379 Ca -0.25 0.00 -0.49 0.00 0.09 0.00 0.00 57.88 57.23 2nqn h LEU 379 Cb 1.84 0.00 0.04 0.00 0.09 0.00 0.00 40.66 42.63 2nqn h LEU 379 CO 0.14 0.42 -0.04 -0.83 0.09 0.00 0.00 178.44 178.23 2nqn s GLY 380 N -4.35 1.71 0.00 0.83 0.00 -0.14 -4.83 107.32 100.54 2nqn s GLY 380 Ca -0.02 -2.12 0.00 0.00 0.00 0.00 0.00 44.72 42.58 2nqn s GLY 380 CO 0.72 -1.60 0.48 1.16 0.00 0.00 0.00 173.10 173.86 2nqn n ASN 381 N -2.42 0.01 -3.73 1.64 0.23 -0.08 -4.90 115.26 106.00 2nqn n ASN 381 Ca 0.16 -1.01 -0.05 0.00 -0.53 0.00 0.00 54.58 53.16 2nqn n ASN 381 Cb 0.62 0.00 -0.02 0.00 -2.08 0.00 0.00 39.78 38.30 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 -3.42 3.27 -0.50 0.00 0.40 0.51 -0.66 117.98 117.58 2nqn s PHE 383 Ca 0.11 0.22 -0.14 0.00 -0.60 0.00 0.00 56.93 56.51 2nqn s PHE 383 Cb -0.02 -1.89 0.11 0.00 0.51 0.00 0.00 43.02 41.73 2nqn s PHE 383 CO 0.01 0.44 0.43 0.42 0.70 0.00 0.00 175.22 177.23 2nqn s ILE 384 N -0.61 5.02 -0.90 0.64 1.01 0.12 -0.62 121.20 125.87 2nqn s ILE 384 Ca 0.11 -1.40 -0.23 0.00 0.00 0.00 0.00 60.65 59.12 2nqn s ILE 384 Cb -0.12 -4.15 0.06 0.00 0.01 0.00 0.00 42.46 38.26 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 1.57 4.08 -0.12 2.92 1.01 -0.74 -2.05 120.40 127.07 2nqn s VAL 385 Ca 0.04 -0.60 -0.26 0.00 0.00 0.00 0.00 61.98 61.15 2nqn s VAL 385 Cb -0.27 -4.93 -0.02 0.00 0.00 0.00 0.00 36.38 31.16 2nqn s VAL 385 CO 0.03 -1.78 0.84 -0.76 0.00 0.00 0.00 175.10 173.43 2nqn s LEU 386 N 4.60 4.24 0.49 3.92 1.43 -0.37 -4.37 118.68 128.62 2nqn s LEU 386 Ca 0.38 1.28 -0.22 0.00 -1.03 0.00 0.00 54.13 54.54 2nqn s LEU 386 Cb -0.05 -3.28 -0.09 0.00 0.03 0.00 0.00 46.19 42.80 2nqn s LEU 386 CO -0.02 -0.32 0.83 -0.62 0.23 0.00 0.00 176.35 176.45 2nqn n GLU 387 N 4.70 0.97 -0.18 1.70 4.71 -1.26 -1.57 120.64 129.71 2nqn n GLU 387 Ca 0.04 0.36 -0.01 0.00 -0.01 0.00 0.00 57.16 57.54 2nqn n GLU 387 Cb 0.50 -1.91 0.07 0.00 -1.01 0.00 0.00 31.44 29.08 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 0.95 0.08 0.00 3.49 2.43 -1.93 -2.31 114.38 117.08 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 1.37 -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 -0.16 -0.25 -1.51 0.00 0.00 179.97 178.63 2nqn n ASP 389 N -5.30 0.34 -4.75 -3.80 8.00 -1.26 -0.36 116.55 109.43 2nqn n ASP 389 Ca 0.07 0.33 -0.34 0.00 0.71 0.00 0.00 54.79 55.56 2nqn n ASP 389 Cb 0.31 -0.35 0.06 0.00 -0.02 0.00 0.00 41.12 41.12 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 -3.04 2.61 0.00 -1.24 3.52 -0.87 -4.65 118.95 115.28 2nqn s ARG 390 Ca 0.12 1.67 0.00 0.00 -0.13 0.00 0.00 55.73 57.38 2nqn s ARG 390 Cb 0.17 -1.90 0.00 0.00 -1.56 0.00 0.00 34.95 31.66 2nqn s ARG 390 CO 0.60 -1.45 0.00 0.41 -0.81 0.00 0.00 175.30 174.04 2nqn n GLY 391 N 0.16 4.88 3.52 8.12 0.00 -1.26 -3.03 105.19 117.58 2nqn n GLY 391 Ca 0.12 -1.93 -0.38 0.00 0.00 0.00 0.00 46.02 43.83 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 -0.35 -4.20 1.61 3.02 -1.05 -4.44 115.26 109.85 2nqn n ASN 392 Ca 0.00 0.77 -0.32 0.00 -0.03 0.00 0.00 54.58 55.00 2nqn n ASN 392 Cb 0.00 -1.25 -0.17 0.00 -0.61 0.00 0.00 39.78 37.75 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 -1.63 2.11 0.27 2.41 1.01 -0.19 -4.93 120.40 119.45 2nqn s VAL 393 Ca 0.71 -0.98 -0.06 0.00 0.00 0.00 0.00 61.98 61.66 2nqn s VAL 393 Cb -0.44 -1.83 -0.05 0.00 0.00 0.00 0.00 36.38 34.05 2nqn s VAL 393 CO 0.52 0.55 0.54 -1.61 0.00 0.00 0.00 175.10 175.10 2nqn s GLU 394 N 0.64 3.65 0.28 2.72 0.41 -1.26 -0.50 118.70 124.65 2nqn s GLU 394 Ca -0.11 0.03 -0.29 0.00 -0.41 0.00 0.00 54.97 54.20 2nqn s GLU 394 Cb -0.16 -2.66 -0.14 0.00 -1.78 0.00 0.00 34.13 29.39 2nqn s GLU 394 CO 0.02 0.25 1.09 0.28 -0.49 0.00 0.00 175.26 176.41 2nqn n VAL 395 N -0.75 1.82 0.00 2.63 0.31 -1.26 -1.74 118.33 119.34 2nqn n VAL 395 Ca -0.01 -0.45 0.00 0.00 -0.01 0.00 0.00 64.34 63.86 2nqn n VAL 395 Cb 0.54 -1.10 0.00 0.00 -0.91 0.00 0.00 33.84 32.36 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 1.29 1.62 3.84 2.92 0.00 0.03 -5.00 105.19 109.89 2nqn n GLY 396 Ca 0.09 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 -0.69 3.54 0.20 1.61 2.02 -0.71 -4.72 118.70 119.95 2nqn s GLU 397 Ca 0.00 0.96 -0.26 0.00 0.02 0.00 0.00 54.97 55.69 2nqn s GLU 397 Cb 0.00 -2.07 -0.08 0.00 0.10 0.00 0.00 34.13 32.07 2nqn s GLU 397 CO 0.00 -0.61 0.82 -1.58 0.02 0.00 0.00 175.26 173.91 2nqn s TRP 398 N -2.80 3.89 0.01 1.61 0.52 -1.26 -1.82 118.94 119.09 2nqn s TRP 398 Ca 0.59 1.69 -0.08 0.00 0.02 0.00 0.00 56.10 58.32 2nqn s TRP 398 Cb -0.12 -2.81 0.00 0.00 -1.15 0.00 0.00 33.47 29.38 2nqn s TRP 398 CO 0.42 0.47 0.14 0.54 0.02 0.00 0.00 176.95 178.55 2nqn s VAL 399 N -1.22 0.09 0.06 4.03 0.11 0.26 -4.94 120.40 118.79 2nqn s VAL 399 Ca 0.39 -0.78 -0.23 0.00 -2.93 0.00 0.00 61.98 58.42 2nqn s VAL 399 Cb -0.23 -0.59 -0.06 0.00 -1.53 0.00 0.00 36.38 33.97 2nqn s VAL 399 CO 0.27 -0.43 0.70 -1.61 -3.33 0.00 0.00 175.10 170.70 2nqn s GLU 400 N -1.77 4.43 -0.02 1.54 0.41 -1.26 -0.12 118.70 121.91 2nqn s GLU 400 Ca -0.12 0.96 0.04 0.00 -0.41 0.00 0.00 54.97 55.45 2nqn s GLU 400 Cb -0.05 -3.32 -0.01 0.00 -1.78 0.00 0.00 34.13 28.97 2nqn s GLU 400 CO -0.00 0.41 -0.13 0.08 -0.49 0.00 0.00 175.26 175.13 2nqn s VAL 401 N -0.46 1.08 -0.27 2.63 1.01 -0.03 -1.79 120.40 122.57 2nqn s VAL 401 Ca 0.35 -0.57 0.02 0.00 0.00 0.00 0.00 61.98 61.79 2nqn s VAL 401 Cb -0.20 -0.91 0.07 0.00 0.00 0.00 0.00 36.38 35.33 2nqn s VAL 401 CO 0.22 0.31 -0.06 -0.70 0.00 0.00 0.00 175.10 174.87 2nqn s GLU 402 N -0.19 1.90 0.43 2.72 2.12 0.21 -1.46 118.70 124.42 2nqn s GLU 402 Ca 0.03 -1.32 -0.26 0.00 0.36 0.00 0.00 54.97 53.78 2nqn s GLU 402 Cb -0.07 -2.83 -0.09 0.00 0.26 0.00 0.00 34.13 31.41 2nqn s GLU 402 CO -0.00 -0.65 1.41 -2.14 -0.54 0.00 0.00 175.26 173.34 2nqn s PRO 403 N 1.17 3.80 0.37 4.30 0.02 -1.26 -0.36 135.00 143.04 2nqn s PRO 403 Ca -0.04 2.38 -0.27 0.00 0.02 0.00 0.00 61.00 63.08 2nqn s PRO 403 Cb -0.19 -2.72 -0.10 0.00 0.02 0.00 0.00 34.50 31.51 2nqn s PRO 403 CO -0.06 -0.71 1.34 -0.06 -0.33 0.00 0.00 177.00 177.17 2nqn s PHE 404 N -1.20 2.86 0.00 6.54 0.08 -0.10 -4.77 117.98 121.39 2nqn s PHE 404 Ca 0.59 1.37 0.00 0.00 0.12 0.00 0.00 56.93 59.01 2nqn s PHE 404 Cb -0.43 -3.74 0.00 0.00 -0.57 0.00 0.00 43.02 38.28 2nqn s PHE 404 CO 0.56 -2.17 0.00 0.27 -0.10 0.00 0.00 175.22 173.78 2nqn n ASN 405 N 0.45 0.00 0.18 1.36 0.23 -1.26 -4.92 115.26 111.29 2nqn n ASN 405 Ca 0.02 -1.00 0.12 0.00 -0.53 0.00 0.00 54.58 53.18 2nqn n ASN 405 Cb 0.42 0.00 0.62 0.00 -2.08 0.00 0.00 39.78 38.74 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 -1.15 1.03 0.00 -2.53 0.00 -1.96 -2.59 119.26 112.05 2nqn h ALA 406 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 2nqn h ALA 406 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 2nqn h ALA 406 CO 0.00 -0.03 -0.09 -0.07 0.00 0.00 0.00 179.25 179.06 2nqn h LEU 407 N 0.00 0.00 -3.00 0.00 3.38 -1.98 0.92 115.31 114.63 2nqn h LEU 407 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2nqn h LEU 407 Cb 0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.83 2nqn h LEU 407 CO 0.00 0.09 0.00 0.49 0.09 0.00 0.00 178.44 179.11 2nqn n PHE 408 N -4.17 0.60 -4.88 1.13 3.01 -0.98 -5.00 117.46 107.16 2nqn n PHE 408 Ca -0.03 -0.62 0.00 0.00 1.01 0.00 0.00 57.45 57.82 2nqn n PHE 408 Cb 0.17 -0.12 0.00 0.00 -0.01 0.00 0.00 39.48 39.53 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 0.16 2.26 0.00 1.37 0.00 0.31 -5.02 105.19 104.27 2nqn n GLY 409 Ca 0.14 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.68 2nqn n GLY 409 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93