#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nyq s GLU 2 N 0.00 1.08 -0.19 3.17 -1.05 -1.26 -4.49 118.70 115.96 1nyq s GLU 2 Ca 0.00 -1.57 -0.02 0.00 -0.15 0.00 0.00 54.97 53.23 1nyq s GLU 2 Cb 0.00 -2.38 -0.01 0.00 -0.44 0.00 0.00 34.13 31.30 1nyq s GLU 2 CO 0.00 -1.03 -0.08 1.14 0.95 0.00 0.00 175.26 176.23 1nyq s GLN 3 N 1.03 3.35 0.00 -4.83 0.00 -1.26 -4.35 119.66 113.60 1nyq s GLN 3 Ca 0.13 -0.66 0.00 0.00 -0.00 0.00 0.00 55.36 54.83 1nyq s GLN 3 Cb -0.20 -2.87 0.00 0.00 0.00 0.00 0.00 33.01 29.94 1nyq s GLN 3 CO -0.13 -0.08 0.00 1.51 0.00 0.00 0.00 175.29 176.59 1nyq n ILE 4 N 4.42 0.00 -3.53 3.63 3.06 -1.26 -2.64 119.36 123.03 1nyq n ILE 4 Ca -0.18 0.00 -0.12 0.00 -2.50 0.00 0.00 62.75 59.95 1nyq n ILE 4 Cb 0.51 0.00 -0.04 0.00 0.54 0.00 0.00 39.64 40.65 1nyq n ILE 4 CO 0.00 0.00 0.00 0.21 -2.50 0.00 0.00 176.55 174.26 1nyq s ASN 5 N -4.00 -0.45 -0.29 9.51 2.47 -1.26 -4.73 114.94 116.20 1nyq s ASN 5 Ca 0.00 0.34 -0.14 0.00 0.42 0.00 0.00 52.86 53.48 1nyq s ASN 5 Cb 0.00 0.40 0.10 0.00 -1.45 0.00 0.00 41.25 40.30 1nyq s ASN 5 CO 0.00 -0.52 0.68 -0.63 -3.72 0.00 0.00 177.10 172.91 1nyq s ILE 6 N -1.85 -0.37 -0.29 -5.21 1.01 -1.18 -3.79 121.20 109.52 1nyq s ILE 6 Ca -0.02 0.00 -0.13 0.00 0.00 0.00 0.00 60.65 60.50 1nyq s ILE 6 Cb -0.01 -1.00 -0.04 0.00 0.01 0.00 0.00 42.46 41.43 1nyq s ILE 6 CO -0.00 0.00 0.28 -1.10 0.00 0.00 0.00 174.94 174.11 1nyq s GLN 7 N 2.10 3.89 0.10 2.79 1.11 0.24 -3.54 119.66 126.34 1nyq s GLN 7 Ca -0.08 -0.24 -0.18 0.00 0.01 0.00 0.00 55.36 54.87 1nyq s GLN 7 Cb -0.08 -3.69 -0.07 0.00 -1.01 0.00 0.00 33.01 28.17 1nyq s GLN 7 CO -0.20 -0.28 0.57 -0.06 0.01 0.00 0.00 175.29 175.34 1nyq s PHE 8 N 1.89 3.74 -1.35 0.91 0.08 -1.19 -0.61 117.98 121.45 1nyq s PHE 8 Ca 0.10 1.21 0.00 0.00 0.12 0.00 0.00 56.93 58.37 1nyq s PHE 8 Cb -0.16 -2.46 0.00 0.00 -0.57 0.00 0.00 43.02 39.83 1nyq s PHE 8 CO 0.11 0.53 0.00 -0.35 -0.10 0.00 0.00 175.22 175.40 1nyq n PRO 9 N 1.38 0.00 -0.00 0.24 -0.04 -1.24 -1.16 135.00 134.18 1nyq n PRO 9 Ca -0.08 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.38 1nyq n PRO 9 Cb 0.51 -0.97 -0.01 0.00 -0.04 0.00 0.00 33.50 32.99 1nyq n PRO 9 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1nyq n ASP 10 N -0.01 4.65 0.00 3.54 5.75 -1.26 -5.08 116.55 124.14 1nyq n ASP 10 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.78 1nyq n ASP 10 Cb 0.00 0.84 0.00 0.00 -1.03 0.00 0.00 41.12 40.93 1nyq n ASP 10 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1nyq n GLY 11 N 2.63 3.06 3.23 6.12 0.00 -0.31 -5.12 105.19 114.80 1nyq n GLY 11 Ca -0.01 -0.61 -0.28 0.00 0.00 0.00 0.00 46.02 45.12 1nyq n GLY 11 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1nyq n ASN 12 N 0.00 -3.46 -3.59 1.61 3.02 -1.26 -4.69 115.26 106.88 1nyq n ASN 12 Ca 0.00 -0.62 -0.07 0.00 -0.03 0.00 0.00 54.58 53.85 1nyq n ASN 12 Cb 0.00 -1.00 -0.04 0.00 -0.61 0.00 0.00 39.78 38.12 1nyq n ASN 12 CO 0.00 0.00 0.00 -1.59 -2.62 0.00 0.00 177.26 173.05 1nyq s LYS 13 N -4.56 0.43 0.26 3.52 0.00 -1.26 -3.17 119.74 114.97 1nyq s LYS 13 Ca 0.61 0.06 0.01 0.00 0.00 0.00 0.00 55.97 56.66 1nyq s LYS 13 Cb -0.14 0.20 -0.04 0.00 0.00 0.00 0.00 37.83 37.85 1nyq s LYS 13 CO 0.54 -0.14 0.13 0.15 0.00 0.00 0.00 175.35 176.03 1nyq s LYS 14 N -1.30 1.43 -0.05 1.78 1.02 -1.23 -4.99 119.74 116.40 1nyq s LYS 14 Ca 0.03 -1.79 -0.04 0.00 0.02 0.00 0.00 55.97 54.19 1nyq s LYS 14 Cb -0.01 -0.10 -0.04 0.00 -0.52 0.00 0.00 37.83 37.17 1nyq s LYS 14 CO -0.02 -0.37 0.15 0.00 -0.92 0.00 0.00 175.35 174.19 1nyq s ALA 15 N -3.78 3.87 -0.11 5.17 0.00 -1.26 -3.10 121.76 122.54 1nyq s ALA 15 Ca 0.37 -0.73 -0.03 0.00 0.00 0.00 0.00 51.96 51.57 1nyq s ALA 15 Cb 0.07 -1.87 0.04 0.00 0.00 0.00 0.00 23.12 21.36 1nyq s ALA 15 CO 0.15 0.69 0.06 -0.06 0.00 0.00 0.00 175.76 176.60 1nyq s PHE 16 N -1.18 0.29 0.24 0.00 0.40 -1.26 -4.90 117.98 111.57 1nyq s PHE 16 Ca 0.22 -0.13 -0.20 0.00 -0.60 0.00 0.00 56.93 56.22 1nyq s PHE 16 Cb -0.12 -0.66 -0.13 0.00 0.51 0.00 0.00 43.02 42.62 1nyq s PHE 16 CO 0.12 -0.37 0.24 -0.40 0.70 0.00 0.00 175.22 175.51 1nyq n ASP 17 N 5.25 -1.67 -4.49 1.36 5.68 -1.26 -4.35 116.55 117.06 1nyq n ASP 17 Ca -0.06 0.78 -0.44 0.00 -0.50 0.00 0.00 54.79 54.58 1nyq n ASP 17 Cb 0.49 -0.74 -0.01 0.00 -1.14 0.00 0.00 41.12 39.73 1nyq n ASP 17 CO 0.00 0.00 0.00 1.17 -1.33 0.00 0.00 177.20 177.04 1nyq n LYS 18 N 0.94 0.74 0.00 0.11 4.81 -1.08 -2.15 118.16 121.53 1nyq n LYS 18 Ca 0.12 0.26 0.00 0.00 -0.87 0.00 0.00 58.31 57.82 1nyq n LYS 18 Cb 0.26 -1.54 0.00 0.00 0.02 0.00 0.00 35.03 33.77 1nyq n LYS 18 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1nyq n GLY 19 N 1.63 3.09 2.10 3.14 0.00 0.04 -4.99 105.19 110.21 1nyq n GLY 19 Ca 0.12 -0.91 -0.38 0.00 0.00 0.00 0.00 46.02 44.85 1nyq n GLY 19 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1nyq n THR 20 N 0.00 0.00 -1.98 2.61 -1.04 -0.91 -2.29 114.28 110.68 1nyq n THR 20 Ca 0.00 0.00 -0.29 0.00 -2.04 0.00 0.00 64.05 61.72 1nyq n THR 20 Cb 0.00 -0.28 0.04 0.00 -1.82 0.00 0.00 70.33 68.28 1nyq n THR 20 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 1nyq s THR 21 N 1.66 3.49 0.20 12.58 -4.23 -1.26 -2.18 115.64 125.90 1nyq s THR 21 Ca 0.59 0.39 -0.10 0.00 -1.18 0.00 0.00 61.69 61.39 1nyq s THR 21 Cb -0.84 -3.46 0.13 0.00 1.34 0.00 0.00 72.50 69.67 1nyq s THR 21 CO 0.46 -0.59 1.82 0.74 -0.54 0.00 0.00 174.62 176.51 1nyq h THR 22 N -0.58 1.03 -0.61 3.99 2.02 -1.58 -2.15 112.91 115.03 1nyq h THR 22 Ca -0.45 -0.25 0.13 0.00 0.77 0.00 0.00 66.41 66.60 1nyq h THR 22 Cb 1.26 0.22 -0.11 0.00 -1.74 0.00 0.00 68.15 67.78 1nyq h THR 22 CO 0.63 0.14 -0.08 -0.08 0.37 0.00 0.00 175.52 176.49 1nyq h GLU 23 N 0.74 0.05 -0.05 6.66 4.81 -1.84 -1.03 114.58 123.91 1nyq h GLU 23 Ca 0.28 -0.00 0.03 0.00 -0.13 0.00 0.00 59.36 59.54 1nyq h GLU 23 Cb 0.10 -0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.43 1nyq h GLU 23 CO -0.14 0.03 -0.19 -0.44 -0.73 0.00 0.00 179.01 177.53 1nyq h ASP 24 N 0.05 -0.58 -0.42 1.04 3.32 -1.72 0.73 116.42 118.84 1nyq h ASP 24 Ca 0.31 0.09 0.05 0.00 0.02 0.00 0.00 57.03 57.49 1nyq h ASP 24 Cb 0.49 0.25 -0.04 0.00 0.22 0.00 0.00 39.33 40.25 1nyq h ASP 24 CO -0.59 -0.25 0.16 0.40 -1.72 0.00 0.00 179.24 177.24 1nyq h ILE 25 N -0.28 0.90 0.15 0.35 2.04 -1.14 0.40 117.51 119.92 1nyq h ILE 25 Ca 0.07 -0.12 0.01 0.00 1.00 0.00 0.00 64.86 65.83 1nyq h ILE 25 Cb 0.39 0.53 -0.04 0.00 -0.74 0.00 0.00 36.82 36.95 1nyq h ILE 25 CO -0.22 0.06 -0.46 0.00 0.00 0.00 0.00 178.15 177.53 1nyq h ALA 26 N 1.26 -0.85 -0.72 1.87 0.00 -0.73 -1.91 119.26 118.19 1nyq h ALA 26 Ca 0.19 -0.09 0.15 0.00 0.00 0.00 0.00 54.91 55.15 1nyq h ALA 26 Cb 0.16 0.76 -0.10 0.00 0.00 0.00 0.00 17.79 18.61 1nyq h ALA 26 CO -0.18 -1.04 0.21 0.37 0.00 0.00 0.00 179.25 178.61 1nyq h GLN 27 N -0.71 0.31 0.00 0.00 5.75 -0.23 0.93 115.11 121.15 1nyq h GLN 27 Ca 0.01 -0.02 -0.01 0.00 -0.15 0.00 0.00 58.65 58.48 1nyq h GLN 27 Cb 0.72 -0.07 -0.00 0.00 1.07 0.00 0.00 27.48 29.20 1nyq h GLN 27 CO -0.24 0.20 -0.07 0.66 -2.65 0.00 0.00 178.83 176.74 1nyq h SER 28 N 0.32 0.00 0.46 -0.69 4.64 0.36 -1.92 113.55 116.72 1nyq h SER 28 Ca 0.40 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.59 1nyq h SER 28 Cb 0.65 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.72 1nyq h SER 28 CO -0.46 0.07 -1.65 -0.38 -0.87 0.00 0.00 176.83 173.53 1nyq n ILE 29 N -3.40 0.81 0.00 0.95 5.41 -0.02 -5.02 119.36 118.08 1nyq n ILE 29 Ca -0.02 -0.64 0.00 0.00 1.00 0.00 0.00 62.75 63.09 1nyq n ILE 29 Cb 0.21 -0.43 0.00 0.00 -0.71 0.00 0.00 39.64 38.72 1nyq n ILE 29 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 176.55 176.31 1nyq n SER 30 N -2.66 0.00 -0.03 4.38 2.88 0.11 -4.97 113.62 113.33 1nyq n SER 30 Ca -0.10 0.00 -0.13 0.00 -1.33 0.00 0.00 58.87 57.31 1nyq n SER 30 Cb 0.77 0.00 -0.11 0.00 -0.75 0.00 0.00 64.21 64.12 1nyq n SER 30 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 1nyq h PRO 31 N 0.00 -0.02 -0.89 -1.46 0.11 -1.82 -2.51 132.00 125.41 1nyq h PRO 31 Ca 0.00 0.00 0.14 0.00 0.11 0.00 0.00 66.00 66.25 1nyq h PRO 31 Cb 0.00 0.00 -0.09 0.00 0.11 0.00 0.00 31.00 31.03 1nyq h PRO 31 CO 0.00 0.69 0.50 0.78 -0.21 0.00 0.00 178.00 179.76 1nyq h GLY 32 N -0.77 1.46 1.00 -0.55 0.00 -1.94 0.87 103.07 103.14 1nyq h GLY 32 Ca -0.00 -0.31 0.00 0.00 0.00 0.00 0.00 47.33 47.02 1nyq h GLY 32 CO 0.00 0.03 0.04 -2.00 0.00 0.00 0.00 176.54 174.61 1nyq h LEU 33 N 0.74 0.06 0.55 3.11 5.85 -1.87 -1.40 115.31 122.36 1nyq h LEU 33 Ca 0.47 -0.00 -0.03 0.00 0.84 0.00 0.00 57.88 59.16 1nyq h LEU 33 Cb 0.59 -0.01 0.01 0.00 0.37 0.00 0.00 40.66 41.61 1nyq h LEU 33 CO -0.32 0.05 -0.27 -0.09 -0.34 0.00 0.00 178.44 177.47 1nyq h ARG 34 N 0.08 -0.71 -1.02 1.25 2.43 -0.56 2.23 114.38 118.08 1nyq h ARG 34 Ca 0.02 0.05 0.29 0.00 -0.81 0.00 0.00 59.98 59.54 1nyq h ARG 34 Cb -0.01 0.16 -0.04 0.00 -0.42 0.00 0.00 29.97 29.66 1nyq h ARG 34 CO -0.01 -0.47 0.82 0.87 -1.51 0.00 0.00 179.97 179.67 1nyq h LYS 35 N -0.75 0.00 0.04 0.20 1.57 0.82 -1.06 116.57 117.38 1nyq h LYS 35 Ca -0.08 0.00 -0.37 0.00 -1.87 0.00 0.00 60.65 58.33 1nyq h LYS 35 Cb 0.57 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.83 1nyq h LYS 35 CO 0.12 0.00 -2.27 1.17 -0.57 0.00 0.00 179.45 177.90 1nyq n LYS 36 N -3.96 0.69 -1.15 3.15 4.81 -0.54 -5.00 118.16 116.16 1nyq n LYS 36 Ca 0.22 0.18 -0.37 0.00 -0.87 0.00 0.00 58.31 57.46 1nyq n LYS 36 Cb 1.16 -1.60 0.03 0.00 0.02 0.00 0.00 35.03 34.64 1nyq n LYS 36 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1nyq n ALA 37 N -3.08 -3.83 0.00 3.14 0.00 0.75 -4.58 120.51 112.91 1nyq n ALA 37 Ca -0.38 -0.32 0.00 0.00 0.00 0.00 0.00 53.44 52.74 1nyq n ALA 37 Cb 1.03 -1.36 0.00 0.00 0.00 0.00 0.00 19.45 19.12 1nyq n ALA 37 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1nyq n VAL 38 N -2.00 0.00 0.00 0.00 0.31 0.13 -4.96 118.33 111.81 1nyq n VAL 38 Ca 0.04 -0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.37 1nyq n VAL 38 Cb 0.51 0.10 0.00 0.00 -0.91 0.00 0.00 33.84 33.54 1nyq n VAL 38 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1nyq n ALA 39 N -0.27 0.00 -2.45 3.52 0.00 -1.22 -4.50 120.51 115.58 1nyq n ALA 39 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.20 1nyq n ALA 39 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.37 1nyq n ALA 39 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1nyq s GLY 40 N 0.00 2.55 -0.41 0.00 0.00 -0.45 0.62 107.32 109.63 1nyq s GLY 40 Ca 0.00 -1.43 0.06 0.00 0.00 0.00 0.00 44.72 43.35 1nyq s GLY 40 CO 0.00 -1.73 0.48 0.28 0.00 0.00 0.00 173.10 172.13 1nyq n LYS 41 N -0.84 0.52 -2.28 2.90 5.02 -0.97 -2.24 118.16 120.27 1nyq n LYS 41 Ca -0.03 -3.08 -0.42 0.00 -2.02 0.00 0.00 58.31 52.76 1nyq n LYS 41 Cb 0.64 -1.40 -0.02 0.00 -0.02 0.00 0.00 35.03 34.23 1nyq n LYS 41 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 1nyq s PHE 42 N -0.56 2.22 -1.32 2.13 5.36 -1.22 -2.99 117.98 121.60 1nyq s PHE 42 Ca 0.34 0.62 -0.00 0.00 -0.96 0.00 0.00 56.93 56.93 1nyq s PHE 42 Cb 0.12 -4.29 0.00 0.00 -0.34 0.00 0.00 43.02 38.51 1nyq s PHE 42 CO -0.15 -2.16 0.68 0.09 -1.46 0.00 0.00 175.22 172.23 1nyq n ASN 43 N 9.53 -1.14 -3.11 6.13 3.02 0.21 -3.73 115.26 126.17 1nyq n ASN 43 Ca 0.17 -0.83 -0.20 0.00 -0.03 0.00 0.00 54.58 53.68 1nyq n ASN 43 Cb 0.48 -3.98 0.02 0.00 -0.61 0.00 0.00 39.78 35.70 1nyq n ASN 43 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1nyq n GLY 44 N -1.61 -0.79 3.64 7.41 0.00 -1.16 -4.99 105.19 107.69 1nyq n GLY 44 Ca -0.30 1.19 -0.09 0.00 0.00 0.00 0.00 46.02 46.83 1nyq n GLY 44 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1nyq s GLN 45 N -2.50 0.63 -0.83 1.61 -1.52 -1.24 -5.02 119.66 110.79 1nyq s GLN 45 Ca 0.29 0.90 -0.07 0.00 -1.95 0.00 0.00 55.36 54.54 1nyq s GLN 45 Cb -0.06 0.23 -0.11 0.00 -0.22 0.00 0.00 33.01 32.85 1nyq s GLN 45 CO 0.80 -0.10 2.60 -0.11 -0.25 0.00 0.00 175.29 178.23 1nyq n LEU 46 N 3.25 5.77 -4.67 2.90 7.94 -1.26 -3.42 117.00 127.50 1nyq n LEU 46 Ca -0.16 -3.21 -0.48 0.00 -1.11 0.00 0.00 56.01 51.04 1nyq n LEU 46 Cb 0.57 -1.23 -0.05 0.00 0.53 0.00 0.00 43.42 43.25 1nyq n LEU 46 CO 0.01 1.23 1.52 1.33 -1.11 0.00 0.00 177.39 180.37 1nyq n VAL 47 N 3.51 0.56 -0.96 1.96 0.24 -0.95 -4.70 118.33 117.99 1nyq n VAL 47 Ca 0.51 -0.12 -0.34 0.00 -2.04 0.00 0.00 64.34 62.34 1nyq n VAL 47 Cb 0.34 -1.89 0.09 0.00 -1.47 0.00 0.00 33.84 30.91 1nyq n VAL 47 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 1nyq n ASP 48 N 6.98 -2.28 0.02 -1.34 -0.08 -1.26 -1.34 116.55 117.25 1nyq n ASP 48 Ca 0.24 0.40 -0.12 0.00 -1.51 0.00 0.00 54.79 53.79 1nyq n ASP 48 Cb 0.30 -1.16 -0.08 0.00 2.34 0.00 0.00 41.12 42.53 1nyq n ASP 48 CO 0.00 0.00 0.00 0.25 0.12 0.00 0.00 177.20 177.57 1nyq h LEU 49 N -1.12 0.01 -0.65 -2.67 6.46 -1.83 -3.09 115.31 112.43 1nyq h LEU 49 Ca -0.44 -0.12 0.00 0.00 -0.12 0.00 0.00 57.88 57.20 1nyq h LEU 49 Cb 1.31 -0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.23 1nyq h LEU 49 CO 0.36 0.13 0.00 0.74 -0.62 0.00 0.00 178.44 179.05 1nyq h THR 50 N -0.10 0.00 -1.91 1.05 2.02 -1.92 -2.78 112.91 109.26 1nyq h THR 50 Ca 0.00 -0.75 -0.65 0.00 0.77 0.00 0.00 66.41 65.78 1nyq h THR 50 Cb 0.12 1.75 0.04 0.00 -1.74 0.00 0.00 68.15 68.32 1nyq h THR 50 CO -0.00 0.00 0.77 1.17 0.37 0.00 0.00 175.52 177.83 1nyq n LYS 51 N -3.05 1.67 -2.45 6.66 4.81 -1.17 -4.77 118.16 119.86 1nyq n LYS 51 Ca 0.03 0.61 -0.41 0.00 -0.87 0.00 0.00 58.31 57.66 1nyq n LYS 51 Cb 0.42 -2.34 -0.03 0.00 0.02 0.00 0.00 35.03 33.10 1nyq n LYS 51 CO 0.00 0.00 0.00 -2.14 1.17 0.00 0.00 177.40 176.43 1nyq s PRO 52 N 1.91 4.50 -0.48 1.64 0.02 -1.26 -3.73 135.00 137.61 1nyq s PRO 52 Ca 0.87 1.76 -0.22 0.00 0.02 0.00 0.00 61.00 63.43 1nyq s PRO 52 Cb -0.84 -3.30 0.03 0.00 0.02 0.00 0.00 34.50 30.41 1nyq s PRO 52 CO 0.48 -0.10 0.75 -0.51 -0.33 0.00 0.00 177.00 177.29 1nyq s LEU 53 N 0.30 4.41 0.00 -5.54 1.43 -0.93 -4.90 118.68 113.46 1nyq s LEU 53 Ca 0.54 -0.36 0.16 0.00 -1.03 0.00 0.00 54.13 53.43 1nyq s LEU 53 Cb -0.30 -2.78 0.53 0.00 0.03 0.00 0.00 46.19 43.67 1nyq s LEU 53 CO 0.33 -0.94 1.40 -0.62 0.23 0.00 0.00 176.35 176.74 1nyq n GLU 54 N 6.66 1.78 0.00 1.70 -0.58 -1.26 -0.78 120.64 128.16 1nyq n GLU 54 Ca -0.00 -1.19 0.00 0.00 -0.42 0.00 0.00 57.16 55.55 1nyq n GLU 54 Cb 0.47 -1.33 0.00 0.00 -0.57 0.00 0.00 31.44 30.01 1nyq n GLU 54 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 1nyq n THR 55 N 0.44 0.00 -4.03 2.62 -2.24 -1.26 -4.73 114.28 105.07 1nyq n THR 55 Ca 0.14 0.00 -0.29 0.00 -2.27 0.00 0.00 64.05 61.63 1nyq n THR 55 Cb 0.31 0.00 -0.06 0.00 -2.10 0.00 0.00 70.33 68.49 1nyq n THR 55 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1nyq s ASP 56 N 1.10 5.70 0.00 3.42 2.15 -1.26 -4.69 116.67 123.09 1nyq s ASP 56 Ca 0.00 0.01 0.00 0.00 0.43 0.00 0.00 52.55 52.99 1nyq s ASP 56 Cb 0.00 -1.57 0.00 0.00 -0.30 0.00 0.00 42.92 41.05 1nyq s ASP 56 CO 0.00 0.14 0.00 0.61 -0.17 0.00 0.00 175.17 175.75 1nyq n GLY 57 N 0.15 -0.58 2.89 2.66 0.00 -1.25 -4.99 105.19 104.07 1nyq n GLY 57 Ca -0.08 -0.66 -0.26 0.00 0.00 0.00 0.00 46.02 45.02 1nyq n GLY 57 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1nyq s SER 58 N -4.00 2.01 0.29 1.61 1.04 -1.26 0.79 113.70 114.18 1nyq s SER 58 Ca 0.00 -0.26 0.03 0.00 0.48 0.00 0.00 55.95 56.21 1nyq s SER 58 Cb 0.00 -0.76 -0.03 0.00 0.10 0.00 0.00 66.02 65.34 1nyq s SER 58 CO 0.00 -0.12 0.45 0.27 0.98 0.00 0.00 173.24 174.81 1nyq s ILE 59 N 1.67 5.11 -0.09 -1.02 -4.36 0.21 0.67 121.20 123.39 1nyq s ILE 59 Ca 0.03 -0.78 -0.05 0.00 -0.26 0.00 0.00 60.65 59.59 1nyq s ILE 59 Cb -0.13 -3.83 0.04 0.00 1.25 0.00 0.00 42.46 39.80 1nyq s ILE 59 CO -0.07 -0.41 0.22 -0.70 0.24 0.00 0.00 174.94 174.23 1nyq s GLU 60 N -4.13 0.20 -0.29 0.37 2.12 -1.24 -3.66 118.70 112.07 1nyq s GLU 60 Ca 0.37 0.46 -0.19 0.00 0.36 0.00 0.00 54.97 55.97 1nyq s GLU 60 Cb -0.09 -0.08 -0.02 0.00 0.26 0.00 0.00 34.13 34.20 1nyq s GLU 60 CO 0.32 -0.14 0.55 0.42 -0.54 0.00 0.00 175.26 175.88 1nyq s ILE 61 N 1.01 5.02 0.03 -3.70 -1.09 -1.26 -2.29 121.20 118.92 1nyq s ILE 61 Ca -0.07 0.81 -0.30 0.00 -2.23 0.00 0.00 60.65 58.85 1nyq s ILE 61 Cb -0.09 -3.90 -0.05 0.00 -1.58 0.00 0.00 42.46 36.84 1nyq s ILE 61 CO -0.06 -0.02 1.21 -0.69 -1.23 0.00 0.00 174.94 174.14 1nyq s VAL 62 N 2.41 4.07 -0.00 2.92 1.01 0.20 -4.94 120.40 126.08 1nyq s VAL 62 Ca 0.22 1.47 0.02 0.00 0.00 0.00 0.00 61.98 63.69 1nyq s VAL 62 Cb -0.15 -3.94 -0.00 0.00 0.00 0.00 0.00 36.38 32.28 1nyq s VAL 62 CO 0.10 0.08 -0.05 0.42 0.00 0.00 0.00 175.10 175.66 1nyq s THR 63 N 1.37 0.41 0.02 3.92 -4.23 -1.26 0.19 115.64 116.07 1nyq s THR 63 Ca 0.58 -0.24 -0.18 0.00 -1.18 0.00 0.00 61.69 60.67 1nyq s THR 63 Cb -0.28 -0.35 -0.09 0.00 1.34 0.00 0.00 72.50 73.11 1nyq s THR 63 CO 0.28 0.10 0.45 -0.81 -0.54 0.00 0.00 174.62 174.10 1nyq n PRO 64 N 2.92 0.00 -1.17 3.99 -0.04 -1.26 -4.20 135.00 135.24 1nyq n PRO 64 Ca -0.13 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.33 1nyq n PRO 64 Cb 0.58 -0.67 0.00 0.00 -0.04 0.00 0.00 33.50 33.37 1nyq n PRO 64 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1nyq n GLY 65 N 0.79 -0.27 3.64 0.55 0.00 -1.26 -5.09 105.19 103.54 1nyq n GLY 65 Ca 0.09 -0.26 -0.09 0.00 0.00 0.00 0.00 46.02 45.76 1nyq n GLY 65 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1nyq s SER 66 N -1.16 -0.45 0.07 1.61 0.15 -1.26 -4.96 113.70 107.69 1nyq s SER 66 Ca 0.00 0.88 -0.18 0.00 0.70 0.00 0.00 55.95 57.35 1nyq s SER 66 Cb 0.00 0.89 -0.06 0.00 -1.71 0.00 0.00 66.02 65.14 1nyq s SER 66 CO 0.00 -0.15 1.29 -0.08 1.20 0.00 0.00 173.24 175.50 1nyq h GLU 67 N 4.22 -0.24 -0.97 5.44 4.81 -1.99 0.19 114.58 126.04 1nyq h GLU 67 Ca -0.28 0.02 0.16 0.00 -0.13 0.00 0.00 59.36 59.12 1nyq h GLU 67 Cb 1.18 0.05 -0.09 0.00 0.63 0.00 0.00 28.75 30.52 1nyq h GLU 67 CO 0.11 -0.16 0.61 1.05 -0.73 0.00 0.00 179.01 179.89 1nyq h GLU 68 N -0.25 0.77 0.00 1.92 4.11 -2.00 -1.31 114.58 117.83 1nyq h GLU 68 Ca 0.03 -0.05 -0.09 0.00 0.07 0.00 0.00 59.36 59.32 1nyq h GLU 68 Cb 0.33 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 1nyq h GLU 68 CO -0.29 0.51 -0.45 0.00 0.07 0.00 0.00 179.01 178.86 1nyq h ALA 69 N 1.60 1.13 -0.06 1.06 0.00 -1.47 -3.20 119.26 118.31 1nyq h ALA 69 Ca 0.51 -0.41 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 1nyq h ALA 69 Cb 0.74 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.46 1nyq h ALA 69 CO -0.28 0.56 -0.05 1.25 0.00 0.00 0.00 179.25 180.72 1nyq h LEU 70 N 0.00 0.15 -0.46 0.00 6.46 0.52 -2.88 115.31 119.09 1nyq h LEU 70 Ca -0.00 -0.47 0.05 0.00 -0.12 0.00 0.00 57.88 57.33 1nyq h LEU 70 Cb 0.86 -0.04 -0.09 0.00 -0.73 0.00 0.00 40.66 40.66 1nyq h LEU 70 CO 0.06 0.59 -0.56 -0.33 -0.62 0.00 0.00 178.44 177.58 1nyq h GLU 71 N -0.29 -0.35 -0.71 1.25 5.08 -1.58 0.17 114.58 118.15 1nyq h GLU 71 Ca 0.01 0.02 0.12 0.00 -1.00 0.00 0.00 59.36 58.51 1nyq h GLU 71 Cb 0.55 0.08 -0.13 0.00 0.50 0.00 0.00 28.75 29.75 1nyq h GLU 71 CO 0.01 -0.23 -0.38 0.28 -1.00 0.00 0.00 179.01 177.70 1nyq h VAL 72 N -0.36 0.10 -0.59 3.13 2.07 -1.56 2.16 116.25 121.20 1nyq h VAL 72 Ca 0.08 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.59 1nyq h VAL 72 Cb 0.58 0.10 -0.03 0.00 -1.52 0.00 0.00 31.29 30.42 1nyq h VAL 72 CO -0.63 0.00 0.32 0.25 0.02 0.00 0.00 177.57 177.53 1nyq h LEU 73 N -0.12 0.72 -0.05 2.57 5.85 -0.99 -2.05 115.31 121.24 1nyq h LEU 73 Ca 0.25 -0.05 -0.23 0.00 0.84 0.00 0.00 57.88 58.69 1nyq h LEU 73 Cb 0.56 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.40 1nyq h LEU 73 CO -0.78 0.58 -1.06 0.03 -0.34 0.00 0.00 178.44 176.88 1nyq h ARG 74 N 0.82 0.19 -0.87 1.25 3.08 0.25 -3.04 114.38 116.07 1nyq h ARG 74 Ca 0.21 -0.28 -0.03 0.00 0.07 0.00 0.00 59.98 59.95 1nyq h ARG 74 Cb 0.03 0.10 -0.04 0.00 0.08 0.00 0.00 29.97 30.13 1nyq h ARG 74 CO -0.03 1.08 0.44 1.25 -1.07 0.00 0.00 179.97 181.64 1nyq h HIS 75 N 0.08 1.22 0.00 3.04 2.76 0.37 -0.02 115.15 122.59 1nyq h HIS 75 Ca -0.07 -0.05 0.00 0.00 -2.20 0.00 0.00 60.37 58.05 1nyq h HIS 75 Cb 1.76 -0.38 0.00 0.00 1.55 0.00 0.00 27.41 30.33 1nyq h HIS 75 CO 0.04 0.87 0.00 0.43 -1.30 0.00 0.00 177.93 177.97 1nyq n SER 76 N -4.31 0.43 -0.00 3.26 7.64 -0.80 -0.84 113.62 119.00 1nyq n SER 76 Ca 0.09 -1.73 0.00 0.00 1.01 0.00 0.00 58.87 58.24 1nyq n SER 76 Cb 0.12 -0.22 -0.01 0.00 -1.01 0.00 0.00 64.21 63.10 1nyq n SER 76 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1nyq n THR 77 N -0.22 0.01 0.02 0.44 -1.04 -0.16 -3.97 114.28 109.36 1nyq n THR 77 Ca 0.00 -0.02 -0.12 0.00 -2.04 0.00 0.00 64.05 61.87 1nyq n THR 77 Cb 0.11 0.28 -0.08 0.00 -1.82 0.00 0.00 70.33 68.82 1nyq n THR 77 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1nyq h ALA 78 N 0.07 0.02 0.27 2.41 0.00 0.42 -2.57 119.26 119.88 1nyq h ALA 78 Ca -0.00 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1nyq h ALA 78 Cb 0.18 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1nyq h ALA 78 CO 0.00 -0.41 -0.13 1.25 0.00 0.00 0.00 179.25 179.96 1nyq h HIS 79 N -0.12 -0.34 -0.47 0.00 -0.00 -1.74 -3.02 115.15 109.46 1nyq h HIS 79 Ca 0.01 -0.01 0.14 0.00 -0.00 0.00 0.00 60.37 60.50 1nyq h HIS 79 Cb 0.15 0.11 -0.02 0.00 -0.00 0.00 0.00 27.41 27.65 1nyq h HIS 79 CO -0.03 -0.05 0.43 1.25 -0.00 0.00 0.00 177.93 179.53 1nyq h LEU 80 N -0.61 0.00 0.07 0.26 5.85 -1.68 0.38 115.31 119.59 1nyq h LEU 80 Ca -0.04 0.00 -0.20 0.00 0.84 0.00 0.00 57.88 58.48 1nyq h LEU 80 Cb 0.44 0.00 0.02 0.00 0.37 0.00 0.00 40.66 41.49 1nyq h LEU 80 CO 0.06 0.00 -0.83 -0.03 -0.34 0.00 0.00 178.44 177.30 1nyq h MET 81 N 0.00 0.44 0.00 1.25 4.05 -1.46 -2.10 114.93 117.10 1nyq h MET 81 Ca 0.23 -0.56 -0.07 0.00 -0.28 0.00 0.00 59.70 59.01 1nyq h MET 81 Cb 1.08 0.18 -0.01 0.00 -0.80 0.00 0.00 31.60 32.05 1nyq h MET 81 CO -0.00 1.22 -0.32 0.00 0.23 0.00 0.00 176.91 178.03 1nyq h ALA 82 N 0.24 1.36 -0.00 0.39 0.00 -0.75 -2.63 119.26 117.86 1nyq h ALA 82 Ca -0.12 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1nyq h ALA 82 Cb 1.57 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.30 1nyq h ALA 82 CO 0.16 0.40 -0.33 1.58 0.00 0.00 0.00 179.25 181.06 1nyq n HIS 83 N -3.99 0.00 0.13 0.00 -0.00 0.11 -3.36 115.22 108.11 1nyq n HIS 83 Ca -0.02 0.00 0.10 0.00 -0.00 0.00 0.00 57.72 57.81 1nyq n HIS 83 Cb 0.38 -0.24 0.04 0.00 -0.00 0.00 0.00 29.99 30.17 1nyq n HIS 83 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1nyq h ALA 84 N 3.24 0.64 0.00 1.57 0.00 -0.99 -3.32 119.26 120.41 1nyq h ALA 84 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1nyq h ALA 84 Cb 0.48 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1nyq h ALA 84 CO 0.00 0.10 -0.51 0.82 0.00 0.00 0.00 179.25 179.65 1nyq h ILE 85 N 0.00 0.00 0.00 0.00 1.08 -1.55 -3.26 117.51 113.78 1nyq h ILE 85 Ca -0.01 -0.65 0.00 0.00 -0.39 0.00 0.00 64.86 63.80 1nyq h ILE 85 Cb 1.06 1.34 0.00 0.00 -3.07 0.00 0.00 36.82 36.16 1nyq h ILE 85 CO 0.01 0.00 -0.28 1.17 -0.69 0.00 0.00 178.15 178.36 1nyq n LYS 86 N -2.38 0.09 -0.13 2.37 4.81 -1.24 -3.41 118.16 118.28 1nyq n LYS 86 Ca 0.03 0.05 -0.07 0.00 -0.87 0.00 0.00 58.31 57.45 1nyq n LYS 86 Cb 0.47 -1.58 0.02 0.00 0.02 0.00 0.00 35.03 33.96 1nyq n LYS 86 CO 0.00 0.00 0.00 -0.09 1.17 0.00 0.00 177.40 178.48 1nyq h ARG 87 N 0.00 0.46 0.00 1.64 2.43 -1.71 -3.44 114.38 113.76 1nyq h ARG 87 Ca 0.00 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 1nyq h ARG 87 Cb 0.58 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 30.03 1nyq h ARG 87 CO 0.00 0.30 0.00 -0.11 -1.51 0.00 0.00 179.97 178.65 1nyq n LEU 88 N -4.87 0.00 -3.85 3.80 7.94 -1.26 -5.05 117.00 113.72 1nyq n LEU 88 Ca 0.02 0.00 -0.42 0.00 -1.11 0.00 0.00 56.01 54.49 1nyq n LEU 88 Cb 0.07 0.00 0.01 0.00 0.53 0.00 0.00 43.42 44.03 1nyq n LEU 88 CO 0.32 0.00 1.39 0.00 -1.11 0.00 0.00 177.39 177.99 1nyq n TYR 89 N 0.00 2.47 0.00 1.96 4.19 -1.22 -4.95 117.16 119.61 1nyq n TYR 89 Ca 0.00 -2.60 0.00 0.00 3.31 0.00 0.00 57.90 58.61 1nyq n TYR 89 Cb 0.00 -1.34 0.00 0.00 0.49 0.00 0.00 39.34 38.49 1nyq n TYR 89 CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 1nyq n GLY 90 N 1.07 -1.17 3.15 2.98 0.00 -1.26 -4.79 105.19 105.17 1nyq n GLY 90 Ca 0.36 -1.46 -0.38 0.00 0.00 0.00 0.00 46.02 44.54 1nyq n GLY 90 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1nyq s ASN 91 N -2.11 5.95 0.19 1.61 0.01 -1.26 -4.56 114.94 114.78 1nyq s ASN 91 Ca 0.00 -3.33 0.02 0.00 -0.71 0.00 0.00 52.86 48.84 1nyq s ASN 91 Cb 0.00 -1.95 0.02 0.00 0.41 0.00 0.00 41.25 39.73 1nyq s ASN 91 CO 0.00 -0.29 0.19 1.33 -1.51 0.00 0.00 177.10 176.82 1nyq n VAL 92 N 2.90 0.00 -3.97 1.60 0.24 -1.26 -5.07 118.33 112.77 1nyq n VAL 92 Ca 0.17 -0.43 -0.15 0.00 -2.04 0.00 0.00 64.34 61.88 1nyq n VAL 92 Cb 0.39 -0.96 -0.15 0.00 -1.47 0.00 0.00 33.84 31.65 1nyq n VAL 92 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 1nyq s LYS 93 N -2.68 0.25 -0.44 7.34 3.01 -1.26 -4.98 119.74 120.98 1nyq s LYS 93 Ca 0.14 -0.01 -0.15 0.00 -1.01 0.00 0.00 55.97 54.94 1nyq s LYS 93 Cb -0.01 -0.33 0.05 0.00 -1.01 0.00 0.00 37.83 36.52 1nyq s LYS 93 CO 0.09 -0.03 0.35 -0.06 0.51 0.00 0.00 175.35 176.21 1nyq s PHE 94 N 0.44 3.24 -0.02 3.18 0.40 -1.26 -3.87 117.98 120.09 1nyq s PHE 94 Ca -0.04 -0.75 -0.00 0.00 -0.60 0.00 0.00 56.93 55.54 1nyq s PHE 94 Cb -0.07 -2.89 -0.00 0.00 0.51 0.00 0.00 43.02 40.57 1nyq s PHE 94 CO -0.01 -0.70 -0.01 0.78 0.70 0.00 0.00 175.22 175.99 1nyq h GLY 95 N 8.71 0.00 -3.19 4.36 0.00 -1.91 -3.39 103.07 107.63 1nyq h GLY 95 Ca -0.28 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 46.91 1nyq h GLY 95 CO 0.81 0.00 -0.68 -1.34 0.00 0.00 0.00 176.54 175.32 1nyq s VAL 96 N -1.11 0.31 0.00 4.60 -7.23 -1.26 -4.43 120.40 111.28 1nyq s VAL 96 Ca -0.01 -1.84 0.00 0.00 -1.81 0.00 0.00 61.98 58.33 1nyq s VAL 96 Cb 0.00 -1.56 0.00 0.00 0.56 0.00 0.00 36.38 35.38 1nyq s VAL 96 CO 0.01 -0.97 0.00 0.61 -0.31 0.00 0.00 175.10 174.44 1nyq n GLY 97 N 0.08 -1.87 3.98 2.32 0.00 -1.26 -0.32 105.19 108.11 1nyq n GLY 97 Ca -0.14 0.85 -0.26 0.00 0.00 0.00 0.00 46.02 46.47 1nyq n GLY 97 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1nyq s PRO 98 N 0.00 1.05 0.73 1.61 0.04 -1.24 -4.63 135.00 132.56 1nyq s PRO 98 Ca 0.00 -0.96 -0.08 0.00 0.04 0.00 0.00 61.00 60.00 1nyq s PRO 98 Cb 0.00 -2.12 0.06 0.00 0.04 0.00 0.00 34.50 32.48 1nyq s PRO 98 CO 0.00 -1.98 1.06 0.14 0.04 0.00 0.00 177.00 176.26 1nyq s VAL 99 N -3.50 2.32 0.00 -0.36 -7.23 -1.26 -3.01 120.40 107.36 1nyq s VAL 99 Ca 0.72 -0.14 0.00 0.00 -1.81 0.00 0.00 61.98 60.75 1nyq s VAL 99 Cb -0.03 -3.05 0.00 0.00 0.56 0.00 0.00 36.38 33.86 1nyq s VAL 99 CO 0.49 -0.05 0.00 2.30 -0.31 0.00 0.00 175.10 177.52 1nyq n ILE 100 N -3.03 0.00 -3.41 -0.62 -5.35 0.57 -4.89 119.36 102.64 1nyq n ILE 100 Ca 0.08 0.00 -0.19 0.00 -0.27 0.00 0.00 62.75 62.37 1nyq n ILE 100 Cb 0.60 0.00 -0.10 0.00 -1.74 0.00 0.00 39.64 38.41 1nyq n ILE 100 CO 0.00 0.00 0.00 -0.70 -1.76 0.00 0.00 176.55 174.09 1nyq s GLU 101 N 2.09 0.39 0.00 6.28 2.12 -1.26 -4.75 118.70 123.57 1nyq s GLU 101 Ca 0.00 -0.39 0.00 0.00 0.36 0.00 0.00 54.97 54.94 1nyq s GLU 101 Cb 0.00 -0.74 0.00 0.00 0.26 0.00 0.00 34.13 33.65 1nyq s GLU 101 CO 0.00 -1.07 0.00 0.41 -0.54 0.00 0.00 175.26 174.06 1nyq n GLY 102 N 5.01 1.04 0.00 -1.50 0.00 -1.26 -5.00 105.19 103.48 1nyq n GLY 102 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1nyq n GLY 102 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nyq n GLY 103 N -0.41 -0.23 0.00 -0.02 0.00 -1.26 -4.45 105.19 98.82 1nyq n GLY 103 Ca 0.00 -0.51 0.00 0.00 0.00 0.00 0.00 46.02 45.51 1nyq n GLY 103 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1nyq n PHE 104 N 0.00 -0.87 -3.60 1.61 -1.74 -0.53 -0.31 117.46 112.01 1nyq n PHE 104 Ca 0.00 0.00 -0.10 0.00 -0.56 0.00 0.00 57.45 56.79 1nyq n PHE 104 Cb 0.00 0.00 -0.06 0.00 1.52 0.00 0.00 39.48 40.94 1nyq n PHE 104 CO 0.00 0.00 0.00 1.52 -0.56 0.00 0.00 176.76 177.72 1nyq s TYR 105 N -8.20 -0.44 -0.12 2.97 -0.85 -1.16 -2.30 117.35 107.25 1nyq s TYR 105 Ca 0.00 0.91 -0.03 0.00 -0.52 0.00 0.00 57.07 57.43 1nyq s TYR 105 Cb 0.00 0.41 0.04 0.00 0.38 0.00 0.00 41.96 42.79 1nyq s TYR 105 CO 0.00 -0.31 0.04 -0.47 -1.52 0.00 0.00 175.55 173.29 1nyq s TYR 106 N -0.49 0.59 0.16 -3.49 6.14 -0.30 -3.60 117.35 116.36 1nyq s TYR 106 Ca -0.00 -0.32 -0.31 0.00 0.64 0.00 0.00 57.07 57.07 1nyq s TYR 106 Cb -0.03 -0.80 -0.10 0.00 0.42 0.00 0.00 41.96 41.45 1nyq s TYR 106 CO -0.01 -0.42 1.67 -0.51 0.64 0.00 0.00 175.55 176.92 1nyq s ASP 107 N 2.00 6.50 0.13 4.32 1.01 0.57 -3.38 116.67 127.82 1nyq s ASP 107 Ca 0.03 2.70 0.01 0.00 0.71 0.00 0.00 52.55 56.00 1nyq s ASP 107 Cb -0.14 -2.59 0.01 0.00 1.01 0.00 0.00 42.92 41.21 1nyq s ASP 107 CO -0.06 -0.91 0.09 0.49 0.21 0.00 0.00 175.17 174.99 1nyq n PHE 108 N 4.49 -1.16 -3.57 4.23 3.72 -0.42 -3.79 117.46 120.97 1nyq n PHE 108 Ca 0.15 -0.57 -0.33 0.00 -0.05 0.00 0.00 57.45 56.65 1nyq n PHE 108 Cb 0.38 -0.11 -0.07 0.00 -0.94 0.00 0.00 39.48 38.74 1nyq n PHE 108 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 1nyq n ASP 109 N -1.90 4.13 -4.60 4.37 2.03 -1.25 -4.31 116.55 115.02 1nyq n ASP 109 Ca -0.01 -3.26 -0.43 0.00 0.52 0.00 0.00 54.79 51.61 1nyq n ASP 109 Cb 0.15 -0.93 -0.02 0.00 -0.72 0.00 0.00 41.12 39.61 1nyq n ASP 109 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1nyq s ILE 110 N -1.84 4.04 -0.00 5.18 -1.09 -1.26 -4.68 121.20 121.54 1nyq s ILE 110 Ca 0.31 1.04 0.01 0.00 -2.23 0.00 0.00 60.65 59.78 1nyq s ILE 110 Cb 0.00 -4.45 -0.02 0.00 -1.58 0.00 0.00 42.46 36.42 1nyq s ILE 110 CO -0.08 -0.95 0.02 -0.90 -1.23 0.00 0.00 174.94 171.79 1nyq n ASP 111 N 8.40 4.76 -4.00 3.58 5.68 -1.26 -4.93 116.55 128.79 1nyq n ASP 111 Ca 0.14 0.00 -0.30 0.00 -0.50 0.00 0.00 54.79 54.12 1nyq n ASP 111 Cb 0.49 0.92 -0.16 0.00 -1.14 0.00 0.00 41.12 41.23 1nyq n ASP 111 CO 0.00 0.00 0.00 -1.10 -1.33 0.00 0.00 177.20 174.77 1nyq s GLN 112 N -2.06 2.06 1.14 0.11 -0.21 -1.26 -5.13 119.66 114.30 1nyq s GLN 112 Ca -0.00 -0.78 -0.16 0.00 0.02 0.00 0.00 55.36 54.44 1nyq s GLN 112 Cb 0.01 -2.34 0.18 0.00 1.00 0.00 0.00 33.01 31.85 1nyq s GLN 112 CO 0.04 -0.39 0.43 -1.71 -2.12 0.00 0.00 175.29 171.54 1nyq n ASN 113 N 4.71 -2.10 0.00 5.90 2.85 -1.26 -5.06 115.26 120.30 1nyq n ASN 113 Ca -0.15 -0.12 0.00 0.00 -0.11 0.00 0.00 54.58 54.20 1nyq n ASN 113 Cb 0.47 -1.09 0.00 0.00 1.24 0.00 0.00 39.78 40.40 1nyq n ASN 113 CO 0.00 0.00 0.00 2.30 -2.11 0.00 0.00 177.26 177.45 1nyq n ILE 114 N -4.62 0.00 0.00 -1.44 -5.35 -1.26 -5.18 119.36 101.51 1nyq n ILE 114 Ca 0.02 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.50 1nyq n ILE 114 Cb 0.59 0.00 0.00 0.00 -1.74 0.00 0.00 39.64 38.49 1nyq n ILE 114 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 1nyq n SER 115 N 0.00 0.00 -1.73 7.28 3.41 -1.26 -4.96 113.62 116.36 1nyq n SER 115 Ca 0.00 0.00 -0.14 0.00 -0.26 0.00 0.00 58.87 58.47 1nyq n SER 115 Cb 0.00 0.00 0.09 0.00 -0.26 0.00 0.00 64.21 64.04 1nyq n SER 115 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1nyq n SER 116 N 0.00 3.99 0.00 4.04 2.88 -1.26 -3.85 113.62 119.42 1nyq n SER 116 Ca 0.00 -2.95 0.00 0.00 -1.33 0.00 0.00 58.87 54.59 1nyq n SER 116 Cb 0.00 -0.75 0.00 0.00 -0.75 0.00 0.00 64.21 62.71 1nyq n SER 116 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 1nyq n ASP 117 N -0.32 2.49 -0.48 -3.46 8.00 -1.26 -4.81 116.55 116.72 1nyq n ASP 117 Ca 0.34 0.00 0.12 0.00 0.71 0.00 0.00 54.79 55.96 1nyq n ASP 117 Cb 1.06 0.13 0.46 0.00 -0.02 0.00 0.00 41.12 42.75 1nyq n ASP 117 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 1nyq n ASP 118 N -1.72 1.47 0.23 -2.24 5.75 -1.25 -3.46 116.55 115.32 1nyq n ASP 118 Ca 0.00 -1.59 0.07 0.00 -0.01 0.00 0.00 54.79 53.26 1nyq n ASP 118 Cb 0.28 -0.06 0.54 0.00 -1.03 0.00 0.00 41.12 40.85 1nyq n ASP 118 CO 0.00 0.00 0.00 -0.26 -0.11 0.00 0.00 177.20 176.83 1nyq h PHE 119 N 2.09 0.00 0.00 2.11 0.04 -1.88 -2.81 116.94 116.50 1nyq h PHE 119 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1nyq h PHE 119 Cb 0.45 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.60 1nyq h PHE 119 CO 0.06 0.21 0.05 -1.91 -0.60 0.00 0.00 178.31 176.11 1nyq n GLU 120 N -4.02 0.00 -0.10 1.51 4.07 -1.23 0.20 120.64 121.07 1nyq n GLU 120 Ca -0.02 0.22 -0.20 0.00 -0.06 0.00 0.00 57.16 57.09 1nyq n GLU 120 Cb 0.29 -1.55 -0.07 0.00 -0.06 0.00 0.00 31.44 30.05 1nyq n GLU 120 CO 0.00 0.00 0.00 1.04 -0.06 0.00 0.00 177.13 178.11 1nyq n GLN 121 N -1.18 0.44 0.25 5.31 1.13 -1.06 -4.05 117.38 118.23 1nyq n GLN 121 Ca 0.00 0.19 0.09 0.00 -1.94 0.00 0.00 57.00 55.34 1nyq n GLN 121 Cb 0.05 -1.24 0.65 0.00 0.11 0.00 0.00 30.24 29.80 1nyq n GLN 121 CO 0.00 0.00 0.00 0.82 -1.44 0.00 0.00 177.06 176.44 1nyq h ILE 122 N -0.76 0.88 0.00 5.09 2.04 -1.30 0.93 117.51 124.39 1nyq h ILE 122 Ca -0.46 -0.40 0.00 0.00 1.00 0.00 0.00 64.86 65.00 1nyq h ILE 122 Cb 1.36 1.23 0.00 0.00 -0.74 0.00 0.00 36.82 38.67 1nyq h ILE 122 CO -0.28 0.11 0.00 1.21 0.00 0.00 0.00 178.15 179.19 1nyq n GLU 123 N -4.12 0.22 0.00 2.37 2.13 0.53 -3.01 120.64 118.76 1nyq n GLU 123 Ca -0.02 0.24 0.00 0.00 0.66 0.00 0.00 57.16 58.04 1nyq n GLU 123 Cb 0.19 -1.79 0.00 0.00 0.27 0.00 0.00 31.44 30.11 1nyq n GLU 123 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 1nyq n LYS 124 N -2.18 0.94 -0.00 5.31 4.81 -0.37 -4.39 118.16 122.29 1nyq n LYS 124 Ca 0.05 -0.81 -0.11 0.00 -0.87 0.00 0.00 58.31 56.57 1nyq n LYS 124 Cb 0.37 -0.78 -0.14 0.00 0.02 0.00 0.00 35.03 34.50 1nyq n LYS 124 CO 0.00 0.00 0.00 1.15 1.17 0.00 0.00 177.40 179.72 1nyq h THR 125 N 1.01 0.90 -0.04 3.15 2.02 0.82 -3.11 112.91 117.68 1nyq h THR 125 Ca 0.00 -2.71 -0.20 0.00 0.77 0.00 0.00 66.41 64.27 1nyq h THR 125 Cb 0.55 2.50 -0.00 0.00 -1.74 0.00 0.00 68.15 69.45 1nyq h THR 125 CO 0.00 0.62 -0.82 0.24 0.37 0.00 0.00 175.52 175.93 1nyq h MET 126 N 0.02 0.37 -0.99 6.66 2.86 -1.75 0.66 114.93 122.76 1nyq h MET 126 Ca -0.28 -0.35 -0.23 0.00 -2.06 0.00 0.00 59.70 56.78 1nyq h MET 126 Cb 2.00 0.09 -0.14 0.00 0.06 0.00 0.00 31.60 33.61 1nyq h MET 126 CO 0.09 1.01 0.29 1.63 1.06 0.00 0.00 176.91 180.99 1nyq n LYS 127 N -3.78 1.67 0.00 1.72 5.02 -1.24 -2.26 118.16 119.30 1nyq n LYS 127 Ca -0.05 -1.42 0.00 0.00 -2.02 0.00 0.00 58.31 54.82 1nyq n LYS 127 Cb 0.76 -1.58 0.00 0.00 -0.02 0.00 0.00 35.03 34.20 1nyq n LYS 127 CO 0.00 0.00 0.00 0.94 -0.52 0.00 0.00 177.40 177.82 1nyq n GLN 128 N -0.23 2.35 0.00 1.97 0.00 -0.86 -4.69 117.38 115.91 1nyq n GLN 128 Ca 0.27 0.00 0.13 0.00 -0.00 0.00 0.00 57.00 57.40 1nyq n GLN 128 Cb 1.03 -0.63 0.35 0.00 0.00 0.00 0.00 30.24 30.99 1nyq n GLN 128 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.06 176.17 1nyq n ILE 129 N -0.70 0.00 -0.04 1.69 5.41 0.17 -4.20 119.36 121.69 1nyq n ILE 129 Ca 0.00 -0.34 -0.01 0.00 1.00 0.00 0.00 62.75 63.39 1nyq n ILE 129 Cb 0.08 0.89 -0.00 0.00 -0.71 0.00 0.00 39.64 39.90 1nyq n ILE 129 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 176.55 177.13 1nyq h VAL 130 N 3.22 0.00 -0.09 1.39 2.07 -1.66 -3.35 116.25 117.83 1nyq h VAL 130 Ca 0.00 -0.59 0.03 0.00 0.82 0.00 0.00 66.70 66.95 1nyq h VAL 130 Cb 0.70 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 30.46 1nyq h VAL 130 CO 0.00 0.00 0.77 0.59 0.02 0.00 0.00 177.57 178.95 1nyq n ASN 131 N -3.65 0.00 0.00 0.57 5.03 -1.26 0.12 115.26 116.07 1nyq n ASN 131 Ca -0.02 0.40 0.08 0.00 0.87 0.00 0.00 54.58 55.91 1nyq n ASN 131 Cb 0.08 -0.02 0.50 0.00 -1.02 0.00 0.00 39.78 39.32 1nyq n ASN 131 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 1nyq n GLU 132 N -2.09 0.91 -3.33 3.52 1.02 -1.26 -4.92 120.64 114.50 1nyq n GLU 132 Ca 0.02 0.00 -0.08 0.00 -0.02 0.00 0.00 57.16 57.08 1nyq n GLU 132 Cb 0.80 -1.29 0.00 0.00 -0.02 0.00 0.00 31.44 30.93 1nyq n GLU 132 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1nyq n ASN 133 N -0.79 -0.95 -4.98 1.62 3.02 0.33 -4.90 115.26 108.61 1nyq n ASN 133 Ca 0.13 -0.25 -0.19 0.00 -0.03 0.00 0.00 54.58 54.24 1nyq n ASN 133 Cb 0.06 -0.34 0.03 0.00 -0.61 0.00 0.00 39.78 38.92 1nyq n ASN 133 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1nyq s MET 134 N -4.18 2.60 0.00 3.52 -1.94 -1.26 -5.01 119.30 113.04 1nyq s MET 134 Ca 0.06 -1.15 0.00 0.00 -1.71 0.00 0.00 55.69 52.89 1nyq s MET 134 Cb -0.03 -2.64 0.00 0.00 2.01 0.00 0.00 34.83 34.17 1nyq s MET 134 CO 0.20 -0.55 0.00 1.17 -0.01 0.00 0.00 175.02 175.83 1nyq n LYS 135 N -2.11 2.35 -3.50 2.03 4.81 -1.26 -2.88 118.16 117.60 1nyq n LYS 135 Ca 0.09 0.00 -0.22 0.00 -0.87 0.00 0.00 58.31 57.31 1nyq n LYS 135 Cb 0.60 0.00 -0.13 0.00 0.02 0.00 0.00 35.03 35.52 1nyq n LYS 135 CO 0.00 0.00 0.00 -1.50 1.17 0.00 0.00 177.40 177.07 1nyq s ILE 136 N -0.13 -0.24 -0.41 3.15 1.10 -1.24 -4.38 121.20 119.04 1nyq s ILE 136 Ca 0.00 -0.42 -0.22 0.00 -0.51 0.00 0.00 60.65 59.50 1nyq s ILE 136 Cb 0.00 -0.84 0.02 0.00 0.15 0.00 0.00 42.46 41.78 1nyq s ILE 136 CO 0.00 -0.45 0.75 -1.83 -2.11 0.00 0.00 174.94 171.30 1nyq s GLU 137 N 2.24 3.54 0.06 3.50 -1.05 -0.98 -4.91 118.70 121.11 1nyq s GLU 137 Ca 0.08 0.03 -0.29 0.00 -0.15 0.00 0.00 54.97 54.63 1nyq s GLU 137 Cb -0.15 -3.88 -0.05 0.00 -0.44 0.00 0.00 34.13 29.61 1nyq s GLU 137 CO -0.25 -0.97 0.92 0.50 0.95 0.00 0.00 175.26 176.42 1nyq s ARG 138 N 3.10 4.62 -0.14 -4.83 3.52 -1.26 -3.92 118.95 120.04 1nyq s ARG 138 Ca 0.29 1.36 -0.04 0.00 -0.13 0.00 0.00 55.73 57.21 1nyq s ARG 138 Cb -0.13 -3.40 0.05 0.00 -1.56 0.00 0.00 34.95 29.91 1nyq s ARG 138 CO 0.19 0.15 0.07 0.21 -0.81 0.00 0.00 175.30 175.11 1nyq s LYS 139 N 0.30 0.12 -0.81 5.12 2.20 -1.17 -5.00 119.74 120.50 1nyq s LYS 139 Ca 0.46 -0.00 -0.25 0.00 -0.36 0.00 0.00 55.97 55.82 1nyq s LYS 139 Cb -0.22 -1.52 0.04 0.00 -1.51 0.00 0.00 37.83 34.62 1nyq s LYS 139 CO 0.28 -0.57 1.30 0.08 -0.36 0.00 0.00 175.35 176.08 1nyq s VAL 140 N 2.11 3.84 0.10 4.02 1.01 -1.26 -1.51 120.40 128.71 1nyq s VAL 140 Ca 0.03 0.00 -0.03 0.00 0.00 0.00 0.00 61.98 61.98 1nyq s VAL 140 Cb -0.15 -4.94 -0.05 0.00 0.00 0.00 0.00 36.38 31.24 1nyq s VAL 140 CO -0.07 -1.85 0.30 -0.69 0.00 0.00 0.00 175.10 172.79 1nyq s VAL 141 N 5.35 5.27 0.37 2.92 1.01 -1.18 -4.97 120.40 129.17 1nyq s VAL 141 Ca 0.37 -0.16 -0.28 0.00 0.00 0.00 0.00 61.98 61.91 1nyq s VAL 141 Cb -0.06 -3.63 -0.11 0.00 0.00 0.00 0.00 36.38 32.58 1nyq s VAL 141 CO 0.08 0.09 1.46 -0.44 0.00 0.00 0.00 175.10 176.28 1nyq s SER 142 N -2.47 6.40 0.59 3.32 0.01 -1.26 -4.16 113.70 116.14 1nyq s SER 142 Ca 0.38 3.01 0.19 0.00 1.31 0.00 0.00 55.95 60.84 1nyq s SER 142 Cb -0.13 -2.67 1.03 0.00 0.21 0.00 0.00 66.02 64.47 1nyq s SER 142 CO 0.26 -0.83 1.55 0.08 0.41 0.00 0.00 173.24 174.71 1nyq h ARG 143 N 3.05 0.00 0.07 12.44 -0.00 -1.83 -1.28 114.38 126.82 1nyq h ARG 143 Ca -0.51 0.00 -0.24 0.00 -0.00 0.00 0.00 59.98 59.23 1nyq h ARG 143 Cb 1.24 0.00 0.02 0.00 -0.00 0.00 0.00 29.97 31.23 1nyq h ARG 143 CO 0.64 0.00 -0.99 -0.44 -0.00 0.00 0.00 179.97 179.19 1nyq h ASP 144 N 0.00 0.74 -0.14 0.08 5.19 -1.96 -1.66 116.42 118.67 1nyq h ASP 144 Ca 0.00 -0.81 -0.21 0.00 -0.62 0.00 0.00 57.03 55.39 1nyq h ASP 144 Cb 1.01 -0.23 0.01 0.00 0.18 0.00 0.00 39.33 40.29 1nyq h ASP 144 CO 0.00 1.47 -0.72 -0.08 -3.12 0.00 0.00 179.24 176.79 1nyq h GLU 145 N 0.11 0.73 -0.42 3.56 4.81 -1.59 -3.29 114.58 118.49 1nyq h GLU 145 Ca -0.14 -0.60 -0.12 0.00 -0.13 0.00 0.00 59.36 58.36 1nyq h GLU 145 Cb 1.69 0.13 -0.01 0.00 0.63 0.00 0.00 28.75 31.18 1nyq h GLU 145 CO 0.19 1.21 -0.21 0.00 -0.73 0.00 0.00 179.01 179.47 1nyq h ALA 146 N 0.53 0.59 -0.23 2.92 0.00 -1.64 -2.76 119.26 118.67 1nyq h ALA 146 Ca -0.05 -0.38 0.04 0.00 0.00 0.00 0.00 54.91 54.52 1nyq h ALA 146 Cb 1.35 -0.14 -0.07 0.00 0.00 0.00 0.00 17.79 18.93 1nyq h ALA 146 CO 0.15 0.57 -0.55 -0.22 0.00 0.00 0.00 179.25 179.20 1nyq h LYS 147 N 0.71 -0.50 0.19 0.00 3.11 -1.36 -3.25 116.57 115.47 1nyq h LYS 147 Ca 0.09 0.03 -0.01 0.00 -2.81 0.00 0.00 60.65 57.96 1nyq h LYS 147 Cb 0.78 0.11 0.00 0.00 -1.00 0.00 0.00 32.23 32.13 1nyq h LYS 147 CO 0.06 -0.33 -0.09 1.49 -2.81 0.00 0.00 179.45 177.77 1nyq h GLU 148 N -0.52 -0.24 0.00 1.90 4.81 -1.64 -3.36 114.58 115.53 1nyq h GLU 148 Ca 0.05 0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.29 1nyq h GLU 148 Cb 0.65 0.05 0.00 0.00 0.63 0.00 0.00 28.75 30.09 1nyq h GLU 148 CO -0.49 0.17 0.00 -0.11 -0.73 0.00 0.00 179.01 177.84 1nyq n LEU 149 N -4.96 0.00 -3.91 1.64 7.94 -1.04 -1.83 117.00 114.83 1nyq n LEU 149 Ca -0.08 0.00 -0.31 0.00 -1.11 0.00 0.00 56.01 54.51 1nyq n LEU 149 Cb 0.26 0.00 -0.15 0.00 0.53 0.00 0.00 43.42 44.06 1nyq n LEU 149 CO 0.26 0.00 -0.35 -0.36 -1.11 0.00 0.00 177.39 175.84 1nyq s PHE 150 N -4.43 2.85 -0.42 1.96 0.40 -1.26 -4.93 117.98 112.16 1nyq s PHE 150 Ca 0.00 -2.38 0.14 0.00 -0.60 0.00 0.00 56.93 54.09 1nyq s PHE 150 Cb 0.00 -2.30 -0.17 0.00 0.51 0.00 0.00 43.02 41.06 1nyq s PHE 150 CO 0.00 -0.90 0.48 -1.13 0.70 0.00 0.00 175.22 174.37 1nyq n SER 151 N 4.52 1.06 0.12 1.36 3.41 -0.76 -4.31 113.62 119.01 1nyq n SER 151 Ca -0.01 -0.52 0.12 0.00 -0.26 0.00 0.00 58.87 58.20 1nyq n SER 151 Cb 0.42 1.24 0.17 0.00 -0.26 0.00 0.00 64.21 65.78 1nyq n SER 151 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 1nyq h ASN 152 N 0.00 0.00 -3.23 4.04 2.35 -1.92 -3.46 115.58 113.36 1nyq h ASN 152 Ca 0.00 -0.07 -0.59 0.00 -0.55 0.00 0.00 56.30 55.09 1nyq h ASN 152 Cb 0.44 0.00 -0.09 0.00 0.05 0.00 0.00 38.32 38.72 1nyq h ASN 152 CO 0.00 0.03 -0.29 -1.81 -1.65 0.00 0.00 177.43 173.72 1nyq s ASP 153 N -5.04 6.52 0.07 5.81 1.11 -1.26 -5.01 116.67 118.86 1nyq s ASP 153 Ca 0.05 0.61 -0.18 0.00 0.18 0.00 0.00 52.55 53.22 1nyq s ASP 153 Cb 0.10 -2.20 -0.06 0.00 1.07 0.00 0.00 42.92 41.83 1nyq s ASP 153 CO 0.70 0.12 1.29 -0.33 1.18 0.00 0.00 175.17 178.14 1nyq h GLU 154 N 6.36 -0.23 0.00 8.23 5.08 -1.89 -1.18 114.58 130.96 1nyq h GLU 154 Ca -0.43 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 57.95 1nyq h GLU 154 Cb 1.18 0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.48 1nyq h GLU 154 CO 0.73 -0.16 0.00 0.98 -1.00 0.00 0.00 179.01 179.57 1nyq n TYR 155 N -4.12 0.00 -0.11 4.33 9.36 -1.26 0.45 117.16 125.81 1nyq n TYR 155 Ca -0.02 0.00 0.25 0.00 3.32 0.00 0.00 57.90 61.44 1nyq n TYR 155 Cb 0.19 -0.46 0.47 0.00 -0.63 0.00 0.00 39.34 38.92 1nyq n TYR 155 CO 0.00 0.00 0.00 0.87 0.22 0.00 0.00 176.86 177.95 1nyq h LYS 156 N 0.00 0.00 0.00 2.98 1.57 -1.82 0.38 116.57 119.67 1nyq h LYS 156 Ca 0.00 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 1nyq h LYS 156 Cb 0.00 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.31 1nyq h LYS 156 CO 0.00 0.00 -0.47 1.25 -0.57 0.00 0.00 179.45 179.66 1nyq h LEU 157 N 0.00 0.00 -1.41 2.94 6.46 -0.25 -3.30 115.31 119.75 1nyq h LEU 157 Ca 0.39 -0.04 -0.00 0.00 -0.12 0.00 0.00 57.88 58.11 1nyq h LEU 157 Cb 2.48 0.00 -0.03 0.00 -0.73 0.00 0.00 40.66 42.38 1nyq h LEU 157 CO -0.00 0.76 0.31 -0.33 -0.62 0.00 0.00 178.44 178.56 1nyq h GLU 158 N -1.00 0.71 0.09 1.25 4.39 0.23 -2.61 114.58 117.64 1nyq h GLU 158 Ca -0.02 -0.06 -0.22 0.00 0.34 0.00 0.00 59.36 59.41 1nyq h GLU 158 Cb 0.48 -0.15 -0.00 0.00 -0.10 0.00 0.00 28.75 28.98 1nyq h GLU 158 CO -0.01 0.51 -1.08 1.25 -1.16 0.00 0.00 179.01 178.51 1nyq h LEU 159 N 0.73 0.30 -0.24 1.33 5.85 -0.59 -3.30 115.31 119.39 1nyq h LEU 159 Ca 0.19 -0.85 0.00 0.00 0.84 0.00 0.00 57.88 58.06 1nyq h LEU 159 Cb -0.02 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 40.91 1nyq h LEU 159 CO -0.04 1.48 0.00 -0.38 -0.34 0.00 0.00 178.44 179.16 1nyq n ILE 160 N -4.12 1.04 -2.37 4.05 5.41 -1.24 -4.40 119.36 117.74 1nyq n ILE 160 Ca -0.22 0.28 -0.40 0.00 1.00 0.00 0.00 62.75 63.41 1nyq n ILE 160 Cb 0.80 -1.11 -0.03 0.00 -0.71 0.00 0.00 39.64 38.59 1nyq n ILE 160 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 1nyq s ASP 161 N -3.37 5.89 -0.12 4.38 2.15 -0.98 -4.90 116.67 119.72 1nyq s ASP 161 Ca 0.05 -0.07 -0.31 0.00 0.43 0.00 0.00 52.55 52.65 1nyq s ASP 161 Cb 0.09 -2.55 0.12 0.00 -0.30 0.00 0.00 42.92 40.28 1nyq s ASP 161 CO 0.27 -1.97 1.05 0.00 -0.17 0.00 0.00 175.17 174.35 1nyq s ALA 162 N 6.79 -1.95 -0.13 3.66 0.00 -1.26 -4.98 121.76 123.89 1nyq s ALA 162 Ca 0.48 1.38 0.24 0.00 0.00 0.00 0.00 51.96 54.06 1nyq s ALA 162 Cb -0.10 -0.07 0.47 0.00 0.00 0.00 0.00 23.12 23.42 1nyq s ALA 162 CO 0.19 -0.57 1.14 -0.89 0.00 0.00 0.00 175.76 175.63 1nyq n ILE 163 N 0.01 0.63 -3.23 0.00 5.41 -1.26 -5.11 119.36 115.82 1nyq n ILE 163 Ca -0.05 -1.95 -0.30 0.00 1.00 0.00 0.00 62.75 61.45 1nyq n ILE 163 Cb 0.60 1.15 -0.04 0.00 -0.71 0.00 0.00 39.64 40.64 1nyq n ILE 163 CO 0.00 0.00 0.00 -2.84 0.00 0.00 0.00 176.55 173.71 1nyq s PRO 164 N -1.89 3.72 0.10 0.38 0.02 -1.26 -5.02 135.00 131.05 1nyq s PRO 164 Ca 0.30 0.21 -0.31 0.00 0.02 0.00 0.00 61.00 61.22 1nyq s PRO 164 Cb 0.35 -2.57 -0.09 0.00 0.02 0.00 0.00 34.50 32.21 1nyq s PRO 164 CO -0.10 0.17 1.60 -2.00 -0.33 0.00 0.00 177.00 176.34 1nyq s GLU 165 N -3.44 4.21 -0.14 5.54 2.12 -1.26 -3.94 118.70 121.79 1nyq s GLU 165 Ca 0.47 2.31 -0.01 0.00 0.36 0.00 0.00 54.97 58.10 1nyq s GLU 165 Cb -0.11 -3.44 -0.01 0.00 0.26 0.00 0.00 34.13 30.83 1nyq s GLU 165 CO 0.28 -0.67 0.13 -3.47 -0.54 0.00 0.00 175.26 170.98 1nyq n ASP 166 N 5.00 -2.67 -4.14 -1.70 2.03 -1.26 -5.07 116.55 108.74 1nyq n ASP 166 Ca 0.15 -0.09 -0.34 0.00 0.52 0.00 0.00 54.79 55.02 1nyq n ASP 166 Cb 0.40 -1.21 -0.14 0.00 -0.72 0.00 0.00 41.12 39.46 1nyq n ASP 166 CO 0.00 0.00 0.00 -1.83 -1.92 0.00 0.00 177.20 173.45 1nyq s GLU 167 N -3.17 2.26 -0.35 -0.67 1.03 -1.25 -5.07 118.70 111.47 1nyq s GLU 167 Ca 0.06 -1.42 0.01 0.00 0.03 0.00 0.00 54.97 53.65 1nyq s GLU 167 Cb -0.01 -3.22 0.09 0.00 -0.80 0.00 0.00 34.13 30.19 1nyq s GLU 167 CO 0.10 -0.72 0.07 -0.80 -1.33 0.00 0.00 175.26 172.59 1nyq s ASN 168 N 1.30 4.91 -0.13 0.83 -0.87 -1.26 -4.55 114.94 115.17 1nyq s ASN 168 Ca -0.02 -1.88 -0.08 0.00 -1.57 0.00 0.00 52.86 49.30 1nyq s ASN 168 Cb -0.20 -1.70 -0.04 0.00 -0.02 0.00 0.00 41.25 39.29 1nyq s ASN 168 CO -0.03 -0.39 0.15 0.68 -2.57 0.00 0.00 177.10 174.95 1nyq s VAL 169 N 1.06 5.46 0.00 1.60 -7.23 -1.26 -5.02 120.40 115.01 1nyq s VAL 169 Ca 0.05 0.24 0.00 0.00 -1.81 0.00 0.00 61.98 60.46 1nyq s VAL 169 Cb -0.20 -3.43 0.00 0.00 0.56 0.00 0.00 36.38 33.30 1nyq s VAL 169 CO -0.05 0.57 0.00 0.35 -0.31 0.00 0.00 175.10 175.66 1nyq n THR 170 N 2.35 0.00 -3.37 5.32 -2.24 -1.26 -3.11 114.28 111.97 1nyq n THR 170 Ca -0.19 0.00 0.02 0.00 -2.27 0.00 0.00 64.05 61.61 1nyq n THR 170 Cb 0.54 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.74 1nyq n THR 170 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1nyq s LEU 171 N 0.00 -0.73 0.52 3.22 1.43 -0.57 -4.69 118.68 117.86 1nyq s LEU 171 Ca 0.00 0.83 -0.18 0.00 -1.03 0.00 0.00 54.13 53.76 1nyq s LEU 171 Cb 0.00 1.76 -0.07 0.00 0.03 0.00 0.00 46.19 47.91 1nyq s LEU 171 CO 0.00 -0.14 1.01 -0.47 0.23 0.00 0.00 176.35 176.99 1nyq s TYR 172 N 2.64 3.20 -0.30 0.29 6.14 0.11 -3.04 117.35 126.39 1nyq s TYR 172 Ca -0.00 1.52 -0.13 0.00 0.64 0.00 0.00 57.07 59.10 1nyq s TYR 172 Cb -0.09 -2.92 0.13 0.00 0.42 0.00 0.00 41.96 39.51 1nyq s TYR 172 CO -0.17 -0.66 0.79 0.45 0.64 0.00 0.00 175.55 176.59 1nyq s SER 173 N -2.66 -0.89 -0.55 4.32 0.15 -1.25 -2.33 113.70 110.48 1nyq s SER 173 Ca 0.62 1.27 0.04 0.00 0.70 0.00 0.00 55.95 58.58 1nyq s SER 173 Cb -0.13 1.89 0.39 0.00 -1.71 0.00 0.00 66.02 66.46 1nyq s SER 173 CO 0.29 -0.18 1.26 1.67 1.20 0.00 0.00 173.24 177.48 1nyq n GLN 174 N 4.99 3.38 0.00 5.44 0.00 -0.94 -2.33 117.38 127.91 1nyq n GLN 174 Ca -0.13 -4.42 0.00 0.00 -0.00 0.00 0.00 57.00 52.45 1nyq n GLN 174 Cb 0.52 -2.26 0.00 0.00 0.00 0.00 0.00 30.24 28.50 1nyq n GLN 174 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1nyq n GLY 175 N -0.43 2.12 0.13 1.69 0.00 -1.26 -4.19 105.19 103.25 1nyq n GLY 175 Ca 0.40 -0.33 -0.28 0.00 0.00 0.00 0.00 46.02 45.82 1nyq n GLY 175 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1nyq n ASP 176 N 4.29 1.94 -4.73 1.61 9.92 -1.26 -4.99 116.55 123.32 1nyq n ASP 176 Ca 0.00 0.35 -0.30 0.00 -0.53 0.00 0.00 54.79 54.30 1nyq n ASP 176 Cb 0.00 -0.85 0.12 0.00 -0.64 0.00 0.00 41.12 39.75 1nyq n ASP 176 CO 0.00 0.00 0.00 0.12 0.13 0.00 0.00 177.20 177.45 1nyq s PHE 177 N -2.47 2.36 -0.30 1.24 5.36 -1.26 -5.06 117.98 117.85 1nyq s PHE 177 Ca -0.36 1.45 -0.02 0.00 -0.96 0.00 0.00 56.93 57.04 1nyq s PHE 177 Cb 0.12 -3.12 0.19 0.00 -0.34 0.00 0.00 43.02 39.88 1nyq s PHE 177 CO 0.52 -2.18 0.75 0.99 -1.46 0.00 0.00 175.22 173.84 1nyq s THR 178 N -2.88 -0.75 -0.11 0.12 2.01 -1.26 -2.22 115.64 110.54 1nyq s THR 178 Ca 0.63 0.00 -0.09 0.00 0.31 0.00 0.00 61.69 62.54 1nyq s THR 178 Cb -0.18 -0.86 -0.04 0.00 0.01 0.00 0.00 72.50 71.42 1nyq s THR 178 CO 0.57 0.00 0.19 -0.62 -0.69 0.00 0.00 174.62 174.07 1nyq s ASP 179 N 2.88 6.44 -0.01 3.53 2.15 -0.98 -4.89 116.67 125.79 1nyq s ASP 179 Ca 0.15 0.53 0.05 0.00 0.43 0.00 0.00 52.55 53.71 1nyq s ASP 179 Cb -0.10 -2.11 0.17 0.00 -0.30 0.00 0.00 42.92 40.58 1nyq s ASP 179 CO -0.22 0.36 1.07 0.18 -0.17 0.00 0.00 175.17 176.39 1nyq n LEU 180 N 2.18 1.21 0.00 -1.34 4.77 -1.26 0.06 117.00 122.62 1nyq n LEU 180 Ca -0.18 -0.61 -0.28 0.00 -0.03 0.00 0.00 56.01 54.91 1nyq n LEU 180 Cb 0.54 -0.21 0.27 0.00 -2.33 0.00 0.00 43.42 41.70 1nyq n LEU 180 CO 0.33 0.26 0.32 0.00 -1.33 0.00 0.00 177.39 176.97 1nyq n ARG 182 N -5.37 1.49 -1.39 0.00 1.74 -1.26 -4.48 116.66 107.39 1nyq n ARG 182 Ca 0.13 -2.15 -0.03 0.00 -0.77 0.00 0.00 57.85 55.03 1nyq n ARG 182 Cb 0.55 -0.40 0.01 0.00 -1.02 0.00 0.00 32.46 31.60 1nyq n ARG 182 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1nyq n GLY 183 N -1.13 2.16 3.89 -0.13 0.00 -1.26 -5.10 105.19 103.62 1nyq n GLY 183 Ca -0.08 -2.15 -0.34 0.00 0.00 0.00 0.00 46.02 43.45 1nyq n GLY 183 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1nyq s VAL 184 N 0.32 5.34 0.05 1.61 -7.23 -1.26 -5.00 120.40 114.23 1nyq s VAL 184 Ca 0.08 0.07 0.05 0.00 -1.81 0.00 0.00 61.98 60.37 1nyq s VAL 184 Cb -0.01 -3.55 -0.02 0.00 0.56 0.00 0.00 36.38 33.35 1nyq s VAL 184 CO 0.05 0.35 -0.15 -1.00 -0.31 0.00 0.00 175.10 174.04 1nyq s HIS 185 N -1.31 1.28 -0.65 2.82 3.76 -1.26 -4.76 115.29 115.17 1nyq s HIS 185 Ca 0.27 -0.38 -0.30 0.00 -0.15 0.00 0.00 55.06 54.50 1nyq s HIS 185 Cb -0.13 -0.75 -0.14 0.00 1.11 0.00 0.00 32.58 32.68 1nyq s HIS 185 CO 0.17 0.05 2.47 0.28 -0.85 0.00 0.00 174.74 176.86 1nyq n VAL 186 N 1.70 0.00 0.00 -0.90 0.31 -1.26 -4.66 118.33 113.53 1nyq n VAL 186 Ca -0.19 -0.38 0.00 0.00 -0.01 0.00 0.00 64.34 63.76 1nyq n VAL 186 Cb 0.54 -1.67 0.00 0.00 -0.91 0.00 0.00 33.84 31.80 1nyq n VAL 186 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 1nyq n PRO 187 N 8.63 0.00 -3.99 5.55 -0.04 -1.26 -4.11 135.00 139.78 1nyq n PRO 187 Ca 0.49 0.00 -0.14 0.00 -0.04 0.00 0.00 63.50 63.81 1nyq n PRO 187 Cb 0.28 0.00 -0.14 0.00 -0.04 0.00 0.00 33.50 33.60 1nyq n PRO 187 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 1nyq s SER 188 N -4.68 0.26 0.00 3.54 0.01 -1.26 -3.71 113.70 107.87 1nyq s SER 188 Ca 0.00 -0.04 0.00 0.00 1.31 0.00 0.00 55.95 57.22 1nyq s SER 188 Cb 0.00 -0.03 0.00 0.00 0.21 0.00 0.00 66.02 66.20 1nyq s SER 188 CO 0.00 0.02 0.96 0.35 0.41 0.00 0.00 173.24 174.99 1nyq n THR 189 N 3.06 0.96 -0.01 1.44 -2.24 -1.14 -1.39 114.28 114.97 1nyq n THR 189 Ca -0.13 -0.18 -0.01 0.00 -2.27 0.00 0.00 64.05 61.47 1nyq n THR 189 Cb 0.59 -1.10 -0.01 0.00 -2.10 0.00 0.00 70.33 67.71 1nyq n THR 189 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1nyq n ALA 190 N 1.29 1.97 -1.47 6.98 0.00 -1.26 -4.41 120.51 123.62 1nyq n ALA 190 Ca 0.00 -0.07 -0.32 0.00 0.00 0.00 0.00 53.44 53.05 1nyq n ALA 190 Cb 0.30 0.24 -0.06 0.00 0.00 0.00 0.00 19.45 19.94 1nyq n ALA 190 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1nyq n LYS 191 N -2.07 3.41 -3.12 0.00 4.81 -0.49 -4.48 118.16 116.23 1nyq n LYS 191 Ca -0.02 -2.35 -0.20 0.00 -0.87 0.00 0.00 58.31 54.88 1nyq n LYS 191 Cb 0.53 -2.48 -0.05 0.00 0.02 0.00 0.00 35.03 33.05 1nyq n LYS 191 CO 0.00 0.00 0.00 -0.89 1.17 0.00 0.00 177.40 177.68 1nyq n ILE 192 N 2.38 -0.64 0.17 3.15 5.41 -1.26 -4.99 119.36 123.59 1nyq n ILE 192 Ca 0.62 -3.15 -0.13 0.00 1.00 0.00 0.00 62.75 61.09 1nyq n ILE 192 Cb 0.43 -1.00 -0.08 0.00 -0.71 0.00 0.00 39.64 38.28 1nyq n ILE 192 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 176.55 176.66 1nyq h LYS 193 N 4.47 -0.44 -6.38 0.38 6.56 -1.78 -3.46 116.57 115.91 1nyq h LYS 193 Ca 0.08 0.03 -0.68 0.00 -1.06 0.00 0.00 60.65 59.02 1nyq h LYS 193 Cb 0.93 0.10 -0.18 0.00 -0.57 0.00 0.00 32.23 32.52 1nyq h LYS 193 CO 0.38 -0.12 -0.73 -1.21 -2.06 0.00 0.00 179.45 175.71 1nyq s GLU 194 N -4.49 2.41 -0.29 3.15 0.41 -1.22 -4.99 118.70 113.66 1nyq s GLU 194 Ca -0.14 -0.81 -0.26 0.00 -0.41 0.00 0.00 54.97 53.35 1nyq s GLU 194 Cb 0.02 -2.42 0.19 0.00 -1.78 0.00 0.00 34.13 30.14 1nyq s GLU 194 CO 0.51 0.58 1.40 -0.59 -0.49 0.00 0.00 175.26 176.67 1nyq s PHE 195 N -1.01 -0.07 0.04 1.61 -0.71 -1.26 -1.83 117.98 114.73 1nyq s PHE 195 Ca 0.17 0.17 0.03 0.00 -1.04 0.00 0.00 56.93 56.26 1nyq s PHE 195 Cb -0.11 0.48 -0.02 0.00 -1.21 0.00 0.00 43.02 42.16 1nyq s PHE 195 CO 0.08 -0.04 -0.09 0.21 -1.34 0.00 0.00 175.22 174.04 1nyq s LYS 196 N -0.22 0.57 -0.14 1.99 2.47 -1.07 -4.97 119.74 118.38 1nyq s LYS 196 Ca 0.07 -0.67 -0.14 0.00 -1.56 0.00 0.00 55.97 53.67 1nyq s LYS 196 Cb -0.04 -0.42 -0.05 0.00 -1.46 0.00 0.00 37.83 35.86 1nyq s LYS 196 CO -0.13 0.09 0.31 -0.51 0.16 0.00 0.00 175.35 175.27 1nyq s LEU 197 N -1.29 4.27 -0.18 5.43 1.43 -1.26 -0.61 118.68 126.47 1nyq s LEU 197 Ca -0.06 0.58 -0.09 0.00 -1.03 0.00 0.00 54.13 53.52 1nyq s LEU 197 Cb -0.08 -2.41 -0.08 0.00 0.03 0.00 0.00 46.19 43.65 1nyq s LEU 197 CO 0.01 0.13 -0.23 0.18 0.23 0.00 0.00 176.35 176.66 1nyq n LEU 198 N 3.35 1.28 0.00 1.79 4.77 -1.01 -4.95 117.00 122.23 1nyq n LEU 198 Ca -0.12 0.22 0.00 0.00 -0.03 0.00 0.00 56.01 56.08 1nyq n LEU 198 Cb 0.52 -0.53 0.00 0.00 -2.33 0.00 0.00 43.42 41.08 1nyq n LEU 198 CO 0.39 0.37 0.00 -1.54 -1.33 0.00 0.00 177.39 175.28 1nyq n SER 199 N -3.82 0.00 -4.06 -1.43 3.41 -1.24 -5.01 113.62 101.47 1nyq n SER 199 Ca -0.36 -0.33 -0.11 0.00 -0.26 0.00 0.00 58.87 57.81 1nyq n SER 199 Cb 0.75 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 64.59 1nyq n SER 199 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1nyq s THR 200 N -2.43 0.44 0.00 6.66 -4.23 -1.26 -2.33 115.64 112.49 1nyq s THR 200 Ca 0.00 -1.23 0.00 0.00 -1.18 0.00 0.00 61.69 59.28 1nyq s THR 200 Cb 0.00 -0.76 0.00 0.00 1.34 0.00 0.00 72.50 73.08 1nyq s THR 200 CO 0.00 -0.53 0.00 0.00 -0.54 0.00 0.00 174.62 173.55 1nyq n ALA 201 N 1.16 0.00 0.00 3.99 0.00 0.12 -4.99 120.51 120.79 1nyq n ALA 201 Ca -0.21 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.23 1nyq n ALA 201 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.01 1nyq n ALA 201 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1nyq n GLY 202 N 0.00 1.88 0.00 0.00 0.00 -1.26 -3.82 105.19 102.00 1nyq n GLY 202 Ca 0.00 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.27 1nyq n GLY 202 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nyq n ALA 203 N -0.49 0.00 -1.78 4.61 0.00 -0.73 -4.87 120.51 117.25 1nyq n ALA 203 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.32 1nyq n ALA 203 Cb 0.00 0.00 0.10 0.00 0.00 0.00 0.00 19.45 19.55 1nyq n ALA 203 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 1nyq n TYR 204 N -0.35 -3.74 0.00 0.00 0.18 -1.26 -2.32 117.16 109.66 1nyq n TYR 204 Ca 0.00 -0.72 0.00 0.00 1.88 0.00 0.00 57.90 59.06 1nyq n TYR 204 Cb 0.00 -0.50 0.00 0.00 -0.38 0.00 0.00 39.34 38.46 1nyq n TYR 204 CO 0.00 0.00 0.00 0.91 -2.08 0.00 0.00 176.86 175.69 1nyq n TRP 205 N -2.73 0.00 -0.91 -3.48 7.02 -1.26 -4.92 117.44 111.16 1nyq n TRP 205 Ca 0.09 0.00 -0.36 0.00 -1.02 0.00 0.00 57.50 56.20 1nyq n TRP 205 Cb 0.31 0.00 0.07 0.00 -2.42 0.00 0.00 31.31 29.27 1nyq n TRP 205 CO 0.00 0.00 0.00 2.89 -2.02 0.00 0.00 177.69 178.56 1nyq n ARG 206 N 0.00 -0.36 -1.72 -0.99 1.85 -1.26 -4.70 116.66 109.48 1nyq n ARG 206 Ca 0.00 -0.10 -0.41 0.00 -1.00 0.00 0.00 57.85 56.34 1nyq n ARG 206 Cb 0.00 -1.22 -0.02 0.00 -1.05 0.00 0.00 32.46 30.17 1nyq n ARG 206 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1nyq n GLY 207 N 3.03 3.27 1.13 2.89 0.00 -1.26 -4.85 105.19 109.39 1nyq n GLY 207 Ca -0.01 -1.39 -0.04 0.00 0.00 0.00 0.00 46.02 44.58 1nyq n GLY 207 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1nyq n ASP 208 N 7.63 -0.52 -0.01 1.61 9.92 -1.26 -5.05 116.55 128.86 1nyq n ASP 208 Ca 0.50 -1.59 -0.18 0.00 -0.53 0.00 0.00 54.79 52.99 1nyq n ASP 208 Cb 0.41 0.93 -0.14 0.00 -0.64 0.00 0.00 41.12 41.69 1nyq n ASP 208 CO 0.00 0.00 0.00 -1.20 0.13 0.00 0.00 177.20 176.13 1nyq n SER 209 N -1.76 1.78 -4.09 -2.24 7.64 -1.26 -4.75 113.62 108.94 1nyq n SER 209 Ca -0.01 0.23 -0.19 0.00 1.01 0.00 0.00 58.87 59.91 1nyq n SER 209 Cb 0.19 -0.61 -0.08 0.00 -1.01 0.00 0.00 64.21 62.70 1nyq n SER 209 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1nyq n ASN 210 N -3.35 0.37 0.00 6.43 3.02 -1.26 -4.68 115.26 115.78 1nyq n ASN 210 Ca -0.29 -2.06 0.00 0.00 -0.03 0.00 0.00 54.58 52.19 1nyq n ASN 210 Cb 1.05 -0.96 0.00 0.00 -0.61 0.00 0.00 39.78 39.26 1nyq n ASN 210 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1nyq n ASN 211 N 12.10 0.00 -4.03 6.41 3.02 -1.26 -4.95 115.26 126.56 1nyq n ASN 211 Ca 0.31 0.00 -0.22 0.00 -0.03 0.00 0.00 54.58 54.64 1nyq n ASN 211 Cb 0.43 0.00 -0.16 0.00 -0.61 0.00 0.00 39.78 39.45 1nyq n ASN 211 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 1nyq s LYS 212 N -1.56 1.16 0.29 3.52 2.47 -1.26 -5.04 119.74 119.31 1nyq s LYS 212 Ca 0.00 -0.37 -0.22 0.00 -1.56 0.00 0.00 55.97 53.82 1nyq s LYS 212 Cb 0.00 -1.05 -0.09 0.00 -1.46 0.00 0.00 37.83 35.22 1nyq s LYS 212 CO 0.00 0.14 0.84 0.00 0.16 0.00 0.00 175.35 176.48 1nyq s MET 213 N 0.18 4.37 0.47 4.03 0.23 -1.26 -4.28 119.30 123.04 1nyq s MET 213 Ca -0.04 1.07 0.04 0.00 -1.03 0.00 0.00 55.69 55.74 1nyq s MET 213 Cb -0.09 -2.76 -0.03 0.00 -1.53 0.00 0.00 34.83 30.41 1nyq s MET 213 CO 0.01 0.30 0.09 -0.48 -2.03 0.00 0.00 175.02 172.90 1nyq s LEU 214 N -2.17 2.66 -0.48 0.18 -0.00 -0.98 -4.87 118.68 113.01 1nyq s LEU 214 Ca 0.48 -1.42 -0.16 0.00 -0.00 0.00 0.00 54.13 53.04 1nyq s LEU 214 Cb -0.16 -0.97 0.08 0.00 -0.00 0.00 0.00 46.19 45.14 1nyq s LEU 214 CO 0.21 -0.72 0.41 -1.10 -0.00 0.00 0.00 176.35 175.15 1nyq s GLN 215 N -3.89 2.98 -0.02 1.48 1.11 -1.26 -1.77 119.66 118.28 1nyq s GLN 215 Ca 0.24 -1.40 -0.10 0.00 0.01 0.00 0.00 55.36 54.10 1nyq s GLN 215 Cb 0.04 -4.15 -0.05 0.00 -1.01 0.00 0.00 33.01 27.83 1nyq s GLN 215 CO 0.13 -1.07 0.30 0.50 0.01 0.00 0.00 175.29 175.16 1nyq s ARG 216 N 1.63 3.70 -0.10 2.91 3.52 -1.25 -1.30 118.95 128.07 1nyq s ARG 216 Ca 0.04 0.13 0.04 0.00 -0.13 0.00 0.00 55.73 55.81 1nyq s ARG 216 Cb -0.25 -3.16 0.00 0.00 -1.56 0.00 0.00 34.95 29.98 1nyq s ARG 216 CO 0.06 0.69 -0.22 0.42 -0.81 0.00 0.00 175.30 175.44 1nyq s ILE 217 N -1.15 1.93 0.44 4.11 1.09 -1.22 0.16 121.20 126.56 1nyq s ILE 217 Ca 0.23 -0.94 0.07 0.00 -1.10 0.00 0.00 60.65 58.91 1nyq s ILE 217 Cb -0.14 -1.68 0.01 0.00 -1.06 0.00 0.00 42.46 39.59 1nyq s ILE 217 CO 0.12 0.53 0.60 -0.31 -0.10 0.00 0.00 174.94 175.78 1nyq s TYR 218 N 0.43 2.83 0.00 3.97 1.51 -0.98 -1.15 117.35 123.95 1nyq s TYR 218 Ca -0.17 -0.33 0.00 0.00 -1.01 0.00 0.00 57.07 55.56 1nyq s TYR 218 Cb -0.17 -2.43 0.00 0.00 -0.11 0.00 0.00 41.96 39.25 1nyq s TYR 218 CO 0.07 -0.48 0.00 0.41 -1.11 0.00 0.00 175.55 174.44 1nyq n GLY 219 N -1.93 0.69 0.85 0.71 0.00 -0.97 -2.40 105.19 102.14 1nyq n GLY 219 Ca 0.08 -0.87 -0.07 0.00 0.00 0.00 0.00 46.02 45.16 1nyq n GLY 219 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1nyq n THR 220 N -0.20 0.00 -3.62 2.61 5.66 0.21 -1.46 114.28 117.49 1nyq n THR 220 Ca 0.00 -0.59 -0.10 0.00 -3.05 0.00 0.00 64.05 60.31 1nyq n THR 220 Cb 0.00 0.18 -0.06 0.00 -1.55 0.00 0.00 70.33 68.89 1nyq n THR 220 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1nyq s ALA 221 N -2.25 -1.96 0.30 1.79 0.00 -1.26 -2.58 121.76 115.80 1nyq s ALA 221 Ca 0.03 1.78 0.07 0.00 0.00 0.00 0.00 51.96 53.85 1nyq s ALA 221 Cb 0.00 -1.21 -0.03 0.00 0.00 0.00 0.00 23.12 21.89 1nyq s ALA 221 CO 0.02 -0.26 0.26 1.19 0.00 0.00 0.00 175.76 176.97 1nyq n PHE 222 N 1.77 -0.72 -1.42 0.00 3.72 -0.76 -4.83 117.46 115.22 1nyq n PHE 222 Ca -0.12 -2.56 -0.13 0.00 -0.05 0.00 0.00 57.45 54.60 1nyq n PHE 222 Cb 0.56 0.26 0.18 0.00 -0.94 0.00 0.00 39.48 39.55 1nyq n PHE 222 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 176.76 177.90 1nyq n PHE 223 N -0.58 1.85 0.00 1.38 3.72 -1.26 -3.46 117.46 119.11 1nyq n PHE 223 Ca 0.07 -1.79 0.00 0.00 -0.05 0.00 0.00 57.45 55.68 1nyq n PHE 223 Cb 0.55 -0.67 0.00 0.00 -0.94 0.00 0.00 39.48 38.42 1nyq n PHE 223 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 1nyq n ASP 224 N -1.11 0.00 -0.55 4.37 5.75 -1.26 -4.97 116.55 118.78 1nyq n ASP 224 Ca 0.43 0.00 0.45 0.00 -0.01 0.00 0.00 54.79 55.66 1nyq n ASP 224 Cb 1.20 0.00 0.76 0.00 -1.03 0.00 0.00 41.12 42.05 1nyq n ASP 224 CO 0.00 0.00 0.00 0.11 -0.11 0.00 0.00 177.20 177.20 1nyq h LYS 225 N 0.00 0.03 -0.23 0.11 1.57 -1.94 -0.40 116.57 115.71 1nyq h LYS 225 Ca 0.00 -0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 1nyq h LYS 225 Cb 0.00 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.29 1nyq h LYS 225 CO 0.00 0.02 0.12 -0.22 -0.57 0.00 0.00 179.45 178.80 1nyq h LYS 226 N 0.03 0.33 0.00 3.15 3.64 -2.00 -1.34 116.57 120.37 1nyq h LYS 226 Ca 0.83 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 60.16 1nyq h LYS 226 Cb 3.10 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 34.86 1nyq h LYS 226 CO -0.13 0.32 0.00 0.39 -2.27 0.00 0.00 179.45 177.76 1nyq n GLU 227 N -4.85 0.15 -0.03 1.90 1.02 -0.17 -3.44 120.64 115.22 1nyq n GLU 227 Ca -0.03 0.02 -0.21 0.00 -0.02 0.00 0.00 57.16 56.92 1nyq n GLU 227 Cb 0.09 -1.50 -0.13 0.00 -0.02 0.00 0.00 31.44 29.87 1nyq n GLU 227 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 1nyq n LEU 228 N -1.42 2.59 -0.22 -4.62 7.94 -1.04 -3.62 117.00 116.60 1nyq n LEU 228 Ca 0.09 0.19 -0.01 0.00 -1.11 0.00 0.00 56.01 55.17 1nyq n LEU 228 Cb 0.29 -1.07 0.20 0.00 0.53 0.00 0.00 43.42 43.37 1nyq n LEU 228 CO 0.24 0.80 1.16 0.50 -1.11 0.00 0.00 177.39 178.99 1nyq h LYS 229 N -0.07 1.01 0.00 1.96 3.64 -1.31 -1.29 116.57 120.51 1nyq h LYS 229 Ca -0.44 -0.11 0.00 0.00 -1.27 0.00 0.00 60.65 58.83 1nyq h LYS 229 Cb 1.93 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 33.55 1nyq h LYS 229 CO 0.02 0.74 0.00 0.00 -2.27 0.00 0.00 179.45 177.94 1nyq h ALA 230 N 1.43 1.00 -0.75 5.00 0.00 -1.73 -2.70 119.26 121.52 1nyq h ALA 230 Ca 0.26 0.00 -0.21 0.00 0.00 0.00 0.00 54.91 54.96 1nyq h ALA 230 Cb 0.01 0.00 -0.13 0.00 0.00 0.00 0.00 17.79 17.68 1nyq h ALA 230 CO -0.04 0.00 0.27 1.58 0.00 0.00 0.00 179.25 181.06 1nyq n HIS 231 N -2.53 2.48 0.00 0.00 -0.00 -0.49 -3.14 115.22 111.53 1nyq n HIS 231 Ca 0.03 -1.20 0.00 0.00 -0.00 0.00 0.00 57.72 56.56 1nyq n HIS 231 Cb 0.35 -0.69 0.00 0.00 -0.00 0.00 0.00 29.99 29.65 1nyq n HIS 231 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.34 177.62 1nyq n LEU 232 N -0.13 0.47 -0.09 0.27 4.77 -1.12 -4.15 117.00 117.02 1nyq n LEU 232 Ca 0.41 0.00 -0.05 0.00 -0.03 0.00 0.00 56.01 56.34 1nyq n LEU 232 Cb 1.40 0.00 0.14 0.00 -2.33 0.00 0.00 43.42 42.63 1nyq n LEU 232 CO 0.44 0.08 0.81 -0.61 -1.33 0.00 0.00 177.39 176.78 1nyq h GLN 233 N 0.00 0.75 -0.09 3.23 -0.00 -1.63 0.33 115.11 117.70 1nyq h GLN 233 Ca 0.00 -0.24 -0.02 0.00 -0.00 0.00 0.00 58.65 58.39 1nyq h GLN 233 Cb 0.31 -0.07 -0.00 0.00 0.00 0.00 0.00 27.48 27.72 1nyq h GLN 233 CO 0.00 0.82 -0.01 1.98 0.00 0.00 0.00 178.83 181.62 1nyq h MET 234 N 0.68 0.17 0.00 1.69 4.05 -1.80 -0.02 114.93 119.70 1nyq h MET 234 Ca 0.12 -0.06 0.00 0.00 -0.28 0.00 0.00 59.70 59.48 1nyq h MET 234 Cb 0.56 -0.01 0.00 0.00 -0.80 0.00 0.00 31.60 31.35 1nyq h MET 234 CO 0.03 0.46 0.00 -0.07 0.23 0.00 0.00 176.91 177.57 1nyq h LEU 235 N -0.14 0.00 0.02 3.39 3.38 -1.60 -2.15 115.31 118.22 1nyq h LEU 235 Ca 0.02 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 57.69 1nyq h LEU 235 Cb 0.39 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.10 1nyq h LEU 235 CO 0.01 0.00 -1.79 1.21 0.09 0.00 0.00 178.44 177.95 1nyq n GLU 236 N -3.04 0.66 0.20 1.13 4.07 0.06 -3.67 120.64 120.04 1nyq n GLU 236 Ca -0.02 0.28 0.05 0.00 -0.06 0.00 0.00 57.16 57.40 1nyq n GLU 236 Cb 0.10 -1.77 0.40 0.00 -0.06 0.00 0.00 31.44 30.11 1nyq n GLU 236 CO 0.00 0.00 0.00 0.93 -0.06 0.00 0.00 177.13 178.00 1nyq h GLU 237 N 0.01 0.00 -0.25 5.31 5.08 -0.35 -2.08 114.58 122.31 1nyq h GLU 237 Ca -0.32 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.04 1nyq h GLU 237 Cb 2.03 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.28 1nyq h GLU 237 CO 0.08 0.35 0.00 2.89 -1.00 0.00 0.00 179.01 181.33 1nyq n ARG 238 N -3.84 1.81 -0.12 2.33 1.85 -1.06 -3.49 116.66 114.14 1nyq n ARG 238 Ca -0.01 -1.23 -0.17 0.00 -1.00 0.00 0.00 57.85 55.43 1nyq n ARG 238 Cb 0.42 -1.36 -0.11 0.00 -1.05 0.00 0.00 32.46 30.36 1nyq n ARG 238 CO 0.00 0.00 0.00 1.17 -0.01 0.00 0.00 177.63 178.79 1nyq n LYS 239 N 0.47 0.60 -0.05 2.89 4.81 -0.80 -3.56 118.16 122.52 1nyq n LYS 239 Ca 0.15 0.14 0.01 0.00 -0.87 0.00 0.00 58.31 57.74 1nyq n LYS 239 Cb 0.34 -1.48 0.03 0.00 0.02 0.00 0.00 35.03 33.94 1nyq n LYS 239 CO 0.00 0.00 0.00 -0.85 1.17 0.00 0.00 177.40 177.72 1nyq n GLU 240 N -3.22 1.21 0.00 1.64 0.28 -1.08 -3.27 120.64 116.21 1nyq n GLU 240 Ca -0.43 -0.22 0.00 0.00 -0.16 0.00 0.00 57.16 56.35 1nyq n GLU 240 Cb 0.95 -1.29 0.00 0.00 1.43 0.00 0.00 31.44 32.53 1nyq n GLU 240 CO 0.00 0.00 0.00 -2.13 -0.16 0.00 0.00 177.13 174.84 1nyq n ARG 241 N -0.15 2.85 -1.57 3.44 0.63 -1.23 -4.94 116.66 115.70 1nyq n ARG 241 Ca 0.02 0.00 -0.45 0.00 -0.92 0.00 0.00 57.85 56.50 1nyq n ARG 241 Cb 0.18 -0.71 -0.02 0.00 0.45 0.00 0.00 32.46 32.36 1nyq n ARG 241 CO 0.00 0.00 0.00 -3.47 -2.51 0.00 0.00 177.63 171.65 1nyq n ASP 242 N -0.79 0.99 -0.09 6.15 -0.08 -1.20 -4.43 116.55 117.09 1nyq n ASP 242 Ca 0.00 1.17 0.06 0.00 -1.51 0.00 0.00 54.79 54.51 1nyq n ASP 242 Cb 0.00 -1.24 0.40 0.00 2.34 0.00 0.00 41.12 42.62 1nyq n ASP 242 CO 0.00 0.00 0.00 1.12 0.12 0.00 0.00 177.20 178.44 1nyq h HIS 243 N 1.92 0.61 -0.08 -0.67 2.07 -1.94 -2.61 115.15 114.45 1nyq h HIS 243 Ca -0.38 0.02 -0.03 0.00 -2.85 0.00 0.00 60.37 57.13 1nyq h HIS 243 Cb 1.35 -0.20 -0.01 0.00 2.57 0.00 0.00 27.41 31.12 1nyq h HIS 243 CO 0.47 0.35 -0.08 0.00 -3.07 0.00 0.00 177.93 175.60 1nyq h ARG 244 N 0.63 0.12 0.17 5.12 3.08 -1.93 0.64 114.38 122.21 1nyq h ARG 244 Ca 0.24 -0.02 -0.34 0.00 0.07 0.00 0.00 59.98 59.93 1nyq h ARG 244 Cb 0.17 -0.02 0.01 0.00 0.08 0.00 0.00 29.97 30.20 1nyq h ARG 244 CO -0.07 0.21 -1.72 0.87 -1.07 0.00 0.00 179.97 178.19 1nyq h LYS 245 N 0.12 0.36 0.49 0.04 1.79 -1.83 -3.25 116.57 114.29 1nyq h LYS 245 Ca 0.03 -0.62 -0.02 0.00 -2.18 0.00 0.00 60.65 57.85 1nyq h LYS 245 Cb 0.22 0.23 0.00 0.00 -1.58 0.00 0.00 32.23 31.10 1nyq h LYS 245 CO 0.01 1.30 -0.23 0.82 -1.08 0.00 0.00 179.45 180.26 1nyq h ILE 246 N 0.04 0.52 -0.07 1.86 1.08 -1.29 -2.68 117.51 116.96 1nyq h ILE 246 Ca -0.35 -0.07 0.02 0.00 -0.39 0.00 0.00 64.86 64.07 1nyq h ILE 246 Cb 2.04 0.55 -0.00 0.00 -3.07 0.00 0.00 36.82 36.34 1nyq h ILE 246 CO 0.15 0.01 0.11 1.23 -0.69 0.00 0.00 178.15 178.96 1nyq h GLY 247 N -0.70 0.00 0.16 5.37 0.00 -1.04 0.52 103.07 107.38 1nyq h GLY 247 Ca -0.07 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.26 1nyq h GLY 247 CO 0.11 0.00 -0.05 1.70 0.00 0.00 0.00 176.54 178.30 1nyq h LYS 248 N 0.00 -0.13 -0.95 4.80 3.64 -1.57 0.36 116.57 122.72 1nyq h LYS 248 Ca 0.04 0.01 0.23 0.00 -1.27 0.00 0.00 60.65 59.65 1nyq h LYS 248 Cb 0.25 0.03 -0.12 0.00 -0.41 0.00 0.00 32.23 31.98 1nyq h LYS 248 CO -0.00 0.23 0.50 1.49 -2.27 0.00 0.00 179.45 179.40 1nyq h GLU 249 N -0.98 0.49 -0.65 1.90 4.81 -1.00 0.35 114.58 119.50 1nyq h GLU 249 Ca -0.01 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.19 1nyq h GLU 249 Cb 0.42 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.69 1nyq h GLU 249 CO 0.02 0.32 0.00 1.28 -0.73 0.00 0.00 179.01 179.91 1nyq n LEU 250 N -4.95 4.24 -4.03 1.64 7.99 0.18 -4.95 117.00 117.12 1nyq n LEU 250 Ca 0.24 -2.14 -0.33 0.00 -0.01 0.00 0.00 56.01 53.77 1nyq n LEU 250 Cb 0.69 -0.54 -0.01 0.00 -0.11 0.00 0.00 43.42 43.45 1nyq n LEU 250 CO 0.15 0.77 -0.00 -0.62 -1.51 0.00 0.00 177.39 176.18 1nyq n GLU 251 N 1.09 -3.57 0.07 3.23 1.02 0.12 -4.81 120.64 117.79 1nyq n GLU 251 Ca 0.23 0.42 -0.21 0.00 -0.02 0.00 0.00 57.16 57.58 1nyq n GLU 251 Cb 0.78 -5.18 -0.14 0.00 -0.02 0.00 0.00 31.44 26.88 1nyq n GLU 251 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 1nyq h LEU 252 N -1.49 0.59 -8.40 -4.62 3.38 -0.56 -3.38 115.31 100.83 1nyq h LEU 252 Ca -0.56 -0.91 -0.21 0.00 0.09 0.00 0.00 57.88 56.29 1nyq h LEU 252 Cb 1.36 -0.19 -0.06 0.00 0.09 0.00 0.00 40.66 41.87 1nyq h LEU 252 CO 0.72 1.45 -0.07 0.72 0.09 0.00 0.00 178.44 181.35 1nyq s PHE 253 N -2.63 0.84 0.03 1.13 -0.12 -1.22 -2.45 117.98 113.56 1nyq s PHE 253 Ca -0.12 -1.18 -0.28 0.00 -0.05 0.00 0.00 56.93 55.30 1nyq s PHE 253 Cb 0.02 0.15 0.10 0.00 -0.63 0.00 0.00 43.02 42.65 1nyq s PHE 253 CO 0.86 -1.25 0.83 -0.08 -0.05 0.00 0.00 175.22 175.53 1nyq s THR 254 N -2.84 0.00 0.39 -4.49 -1.32 -0.20 -4.63 115.64 102.55 1nyq s THR 254 Ca 0.27 -0.00 0.08 0.00 -1.21 0.00 0.00 61.69 60.82 1nyq s THR 254 Cb -0.02 -1.00 -0.06 0.00 -1.51 0.00 0.00 72.50 69.91 1nyq s THR 254 CO 0.18 0.00 0.08 0.20 -2.21 0.00 0.00 174.62 172.87 1nyq s ASN 255 N -2.54 4.21 -0.28 8.08 0.01 -1.26 0.80 114.94 123.96 1nyq s ASN 255 Ca 0.04 -1.11 -0.15 0.00 -0.71 0.00 0.00 52.86 50.93 1nyq s ASN 255 Cb -0.01 -0.48 0.10 0.00 0.41 0.00 0.00 41.25 41.27 1nyq s ASN 255 CO -0.10 -0.41 0.73 -0.44 -1.51 0.00 0.00 177.10 175.37 1nyq s SER 256 N -3.79 -0.90 0.15 -1.22 0.01 -1.26 -4.93 113.70 101.74 1nyq s SER 256 Ca 0.37 1.41 0.26 0.00 1.31 0.00 0.00 55.95 59.30 1nyq s SER 256 Cb 0.04 1.50 0.94 0.00 0.21 0.00 0.00 66.02 68.71 1nyq s SER 256 CO 0.20 -0.22 1.78 1.67 0.41 0.00 0.00 173.24 177.09 1nyq n GLN 257 N 4.41 0.16 0.14 12.44 -0.06 -1.26 -0.20 117.38 133.00 1nyq n GLN 257 Ca -0.18 0.19 0.12 0.00 -2.00 0.00 0.00 57.00 55.13 1nyq n GLN 257 Cb 0.57 -1.71 0.16 0.00 -4.06 0.00 0.00 30.24 25.20 1nyq n GLN 257 CO 0.00 0.00 0.00 1.25 -0.20 0.00 0.00 177.06 178.11 1nyq h LEU 258 N 0.00 0.00 0.01 1.69 5.85 -2.03 -3.35 115.31 117.48 1nyq h LEU 258 Ca 0.00 -0.04 -0.42 0.00 0.84 0.00 0.00 57.88 58.26 1nyq h LEU 258 Cb 0.58 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 41.55 1nyq h LEU 258 CO 0.00 0.02 -2.34 0.52 -0.34 0.00 0.00 178.44 176.30 1nyq n VAL 259 N -2.67 1.53 0.00 1.05 0.31 -0.87 -5.11 118.33 112.58 1nyq n VAL 259 Ca 0.03 -0.38 0.00 0.00 -0.01 0.00 0.00 64.34 63.97 1nyq n VAL 259 Cb 0.50 -1.81 0.00 0.00 -0.91 0.00 0.00 33.84 31.62 1nyq n VAL 259 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1nyq n GLY 260 N 1.50 4.26 3.72 2.92 0.00 0.71 -5.02 105.19 113.28 1nyq n GLY 260 Ca -0.49 -1.23 -0.42 0.00 0.00 0.00 0.00 46.02 43.89 1nyq n GLY 260 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nyq s ALA 261 N -2.00 3.40 -1.45 4.61 0.00 -1.26 -3.48 121.76 121.58 1nyq s ALA 261 Ca 0.00 0.86 -0.05 0.00 0.00 0.00 0.00 51.96 52.77 1nyq s ALA 261 Cb 0.00 -3.43 0.01 0.00 0.00 0.00 0.00 23.12 19.70 1nyq s ALA 261 CO 0.00 -0.40 0.65 0.41 0.00 0.00 0.00 175.76 176.42 1nyq n GLY 262 N 2.94 -0.45 2.36 0.00 0.00 -1.26 -4.66 105.19 104.12 1nyq n GLY 262 Ca 0.08 0.09 -0.21 0.00 0.00 0.00 0.00 46.02 45.98 1nyq n GLY 262 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1nyq n LEU 263 N -3.93 1.67 -4.64 0.99 4.77 -1.23 0.81 117.00 115.44 1nyq n LEU 263 Ca -0.09 -5.15 -0.37 0.00 -0.03 0.00 0.00 56.01 50.36 1nyq n LEU 263 Cb 0.61 0.40 0.06 0.00 -2.33 0.00 0.00 43.42 42.16 1nyq n LEU 263 CO 0.47 2.29 0.62 -0.81 -1.33 0.00 0.00 177.39 178.63 1nyq n PRO 264 N 0.24 0.88 -4.20 3.23 -0.04 -1.26 -4.76 135.00 129.08 1nyq n PRO 264 Ca 0.26 0.35 -0.34 0.00 -0.04 0.00 0.00 63.50 63.73 1nyq n PRO 264 Cb 0.59 -2.26 -0.11 0.00 -0.04 0.00 0.00 33.50 31.68 1nyq n PRO 264 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1nyq s LEU 265 N -2.74 3.54 -0.60 1.53 1.43 0.24 -4.95 118.68 117.14 1nyq s LEU 265 Ca 0.78 -0.02 -0.22 0.00 -1.03 0.00 0.00 54.13 53.64 1nyq s LEU 265 Cb -0.40 -1.87 0.06 0.00 0.03 0.00 0.00 46.19 44.01 1nyq s LEU 265 CO 0.45 0.18 0.89 0.26 0.23 0.00 0.00 176.35 178.36 1nyq s TRP 266 N 0.33 2.78 0.84 0.29 0.52 -1.26 -1.03 118.94 121.42 1nyq s TRP 266 Ca -0.00 -0.39 -0.10 0.00 0.02 0.00 0.00 56.10 55.62 1nyq s TRP 266 Cb -0.13 -4.09 0.10 0.00 -1.15 0.00 0.00 33.47 28.19 1nyq s TRP 266 CO 0.01 -1.44 1.11 -0.51 0.02 0.00 0.00 176.95 176.14 1nyq s LEU 267 N 3.74 2.83 0.00 2.99 1.43 -1.03 -4.54 118.68 124.10 1nyq s LEU 267 Ca 0.23 1.91 0.00 0.00 -1.03 0.00 0.00 54.13 55.24 1nyq s LEU 267 Cb -0.16 -4.45 0.00 0.00 0.03 0.00 0.00 46.19 41.61 1nyq s LEU 267 CO 0.13 -2.53 0.67 -2.65 0.23 0.00 0.00 176.35 172.21 1nyq n PRO 268 N -3.85 0.00 -0.19 1.29 -0.02 -1.26 -1.45 135.00 129.52 1nyq n PRO 268 Ca 0.10 0.67 -0.05 0.00 -2.02 0.00 0.00 63.50 62.20 1nyq n PRO 268 Cb 0.53 -1.03 -0.05 0.00 -0.02 0.00 0.00 33.50 32.94 1nyq n PRO 268 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 1nyq h ASN 269 N 0.00 -1.01 -0.93 2.55 4.21 -1.85 0.10 115.58 118.66 1nyq h ASN 269 Ca 0.00 0.15 0.20 0.00 1.21 0.00 0.00 56.30 57.86 1nyq h ASN 269 Cb 0.00 0.44 -0.11 0.00 -1.12 0.00 0.00 38.32 37.53 1nyq h ASN 269 CO 0.00 -0.11 0.49 1.23 -1.29 0.00 0.00 177.43 177.75 1nyq h GLY 270 N -0.00 1.63 1.79 2.83 0.00 -1.23 0.12 103.07 108.20 1nyq h GLY 270 Ca 0.07 -0.26 -0.05 0.00 0.00 0.00 0.00 47.33 47.10 1nyq h GLY 270 CO -0.43 -0.17 -0.12 0.00 0.00 0.00 0.00 176.54 175.82 1nyq h ALA 271 N 1.66 1.49 -0.41 3.60 0.00 0.26 -0.99 119.26 124.88 1nyq h ALA 271 Ca 0.56 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 55.22 1nyq h ALA 271 Cb 0.97 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.65 1nyq h ALA 271 CO -0.45 0.36 0.10 1.15 0.00 0.00 0.00 179.25 180.42 1nyq h THR 272 N 0.25 1.23 0.71 0.00 2.02 0.14 0.26 112.91 117.52 1nyq h THR 272 Ca 0.05 -0.78 -0.03 0.00 0.77 0.00 0.00 66.41 66.41 1nyq h THR 272 Cb 0.38 0.96 0.00 0.00 -1.74 0.00 0.00 68.15 67.75 1nyq h THR 272 CO 0.02 0.27 -0.36 0.40 0.37 0.00 0.00 175.52 176.22 1nyq h ILE 273 N 0.52 0.26 -0.77 3.11 2.04 -0.95 0.27 117.51 121.98 1nyq h ILE 273 Ca 0.13 0.00 0.15 0.00 1.00 0.00 0.00 64.86 66.14 1nyq h ILE 273 Cb 0.31 0.26 -0.14 0.00 -0.74 0.00 0.00 36.82 36.50 1nyq h ILE 273 CO 0.00 0.00 -0.24 -0.09 0.00 0.00 0.00 178.15 177.82 1nyq h ARG 274 N -0.99 -0.03 -0.61 2.37 2.43 -0.90 0.51 114.38 117.17 1nyq h ARG 274 Ca -0.10 0.00 0.04 0.00 -0.81 0.00 0.00 59.98 59.12 1nyq h ARG 274 Cb 0.77 0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 30.28 1nyq h ARG 274 CO 0.14 -0.02 0.36 -0.09 -1.51 0.00 0.00 179.97 178.85 1nyq h ARG 275 N -0.03 0.67 -0.83 0.20 2.43 0.01 0.25 114.38 117.07 1nyq h ARG 275 Ca 0.35 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.47 1nyq h ARG 275 Cb 0.58 -0.15 -0.04 0.00 -0.42 0.00 0.00 29.97 29.94 1nyq h ARG 275 CO -0.81 0.44 0.50 0.93 -1.51 0.00 0.00 179.97 179.52 1nyq h GLU 276 N 0.69 1.13 0.03 0.20 4.39 0.12 -0.86 114.58 120.28 1nyq h GLU 276 Ca 0.26 -0.10 -0.00 0.00 0.34 0.00 0.00 59.36 59.85 1nyq h GLU 276 Cb 0.08 -0.24 0.00 0.00 -0.10 0.00 0.00 28.75 28.50 1nyq h GLU 276 CO -0.13 0.79 -0.02 0.82 -1.16 0.00 0.00 179.01 179.31 1nyq h ILE 277 N 1.15 1.36 -0.59 3.13 2.04 -0.68 -1.81 117.51 122.12 1nyq h ILE 277 Ca 0.30 -1.35 0.11 0.00 1.00 0.00 0.00 64.86 64.92 1nyq h ILE 277 Cb -0.04 2.24 -0.08 0.00 -0.74 0.00 0.00 36.82 38.20 1nyq h ILE 277 CO -0.06 0.34 0.12 -0.33 0.00 0.00 0.00 178.15 178.22 1nyq h GLU 278 N -0.65 0.25 -0.43 2.37 5.08 -0.39 0.19 114.58 121.00 1nyq h GLU 278 Ca -0.00 -0.01 -0.06 0.00 -1.00 0.00 0.00 59.36 58.28 1nyq h GLU 278 Cb 0.59 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.76 1nyq h GLU 278 CO 0.01 0.16 0.05 0.00 -1.00 0.00 0.00 179.01 178.23 1nyq h ARG 279 N 0.25 0.73 -0.06 2.33 3.08 -1.20 -1.72 114.38 117.79 1nyq h ARG 279 Ca 0.31 -0.21 0.02 0.00 0.07 0.00 0.00 59.98 60.17 1nyq h ARG 279 Cb 0.45 -0.08 -0.05 0.00 0.08 0.00 0.00 29.97 30.37 1nyq h ARG 279 CO -0.40 0.77 -0.45 -0.92 -1.07 0.00 0.00 179.97 177.90 1nyq h TYR 280 N 0.58 -1.34 0.12 3.04 3.20 -0.23 0.74 116.97 123.09 1nyq h TYR 280 Ca 0.13 0.05 -0.01 0.00 3.14 0.00 0.00 58.73 62.04 1nyq h TYR 280 Cb 0.41 0.59 0.00 0.00 1.54 0.00 0.00 36.73 39.27 1nyq h TYR 280 CO 0.03 -0.47 -0.06 0.97 -1.64 0.00 0.00 178.16 176.99 1nyq h ILE 281 N -0.52 0.94 -0.91 1.81 6.09 -0.68 -1.21 117.51 123.02 1nyq h ILE 281 Ca 0.02 -0.25 0.10 0.00 -1.37 0.00 0.00 64.86 63.35 1nyq h ILE 281 Cb 0.58 1.10 -0.08 0.00 0.47 0.00 0.00 36.82 38.90 1nyq h ILE 281 CO -0.33 0.06 0.56 0.58 -3.07 0.00 0.00 178.15 175.94 1nyq h VAL 282 N -0.28 0.95 0.51 2.19 2.07 -1.15 1.43 116.25 121.97 1nyq h VAL 282 Ca -0.02 -0.32 -0.03 0.00 0.82 0.00 0.00 66.70 67.16 1nyq h VAL 282 Cb 0.23 -0.06 0.01 0.00 -1.52 0.00 0.00 31.29 29.94 1nyq h VAL 282 CO 0.03 0.17 -0.25 0.44 0.02 0.00 0.00 177.57 177.98 1nyq h ASP 283 N 0.93 -0.58 -0.16 0.57 3.32 -0.75 0.59 116.42 120.34 1nyq h ASP 283 Ca 0.44 0.01 0.05 0.00 0.02 0.00 0.00 57.03 57.54 1nyq h ASP 283 Cb 0.37 0.15 -0.07 0.00 0.22 0.00 0.00 39.33 40.00 1nyq h ASP 283 CO -0.24 -0.40 -0.34 0.50 -1.72 0.00 0.00 179.24 177.05 1nyq h LYS 284 N -0.71 -0.38 -0.17 3.56 3.64 0.19 -2.21 116.57 120.48 1nyq h LYS 284 Ca -0.07 0.03 0.05 0.00 -1.27 0.00 0.00 60.65 59.39 1nyq h LYS 284 Cb 0.54 0.09 -0.06 0.00 -0.41 0.00 0.00 32.23 32.39 1nyq h LYS 284 CO 0.12 -0.25 -0.20 0.93 -2.27 0.00 0.00 179.45 177.77 1nyq h GLU 285 N -0.40 -0.22 -0.93 1.90 5.08 0.21 -0.03 114.58 120.19 1nyq h GLU 285 Ca 0.10 0.02 0.16 0.00 -1.00 0.00 0.00 59.36 58.64 1nyq h GLU 285 Cb 0.56 0.05 -0.10 0.00 0.50 0.00 0.00 28.75 29.76 1nyq h GLU 285 CO -0.38 -0.15 0.53 0.28 -1.00 0.00 0.00 179.01 178.29 1nyq h VAL 286 N -0.23 0.73 -0.21 3.13 2.07 0.72 -1.23 116.25 121.24 1nyq h VAL 286 Ca 0.11 -0.24 -0.14 0.00 0.82 0.00 0.00 66.70 67.25 1nyq h VAL 286 Cb 0.40 -0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.12 1nyq h VAL 286 CO -0.31 0.13 -0.46 0.28 0.02 0.00 0.00 177.57 177.23 1nyq h SER 287 N 0.71 0.57 0.00 0.57 0.02 -0.82 -2.21 113.55 112.39 1nyq h SER 287 Ca 0.52 -0.27 0.00 0.00 -0.84 0.00 0.00 61.79 61.20 1nyq h SER 287 Cb 0.75 -0.16 0.00 0.00 0.14 0.00 0.00 62.40 63.13 1nyq h SER 287 CO -0.37 0.94 0.00 0.23 -1.14 0.00 0.00 176.83 176.50 1nyq n MET 288 N -4.00 0.76 -3.39 3.45 2.00 -0.08 -4.78 117.12 111.08 1nyq n MET 288 Ca -0.02 0.00 -0.17 0.00 0.00 0.00 0.00 57.70 57.51 1nyq n MET 288 Cb 0.55 -1.31 0.09 0.00 0.00 0.00 0.00 33.22 32.54 1nyq n MET 288 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1nyq n GLY 289 N 0.25 -0.35 3.75 3.03 0.00 -0.84 -5.02 105.19 106.01 1nyq n GLY 289 Ca 0.00 0.09 -0.29 0.00 0.00 0.00 0.00 46.02 45.82 1nyq n GLY 289 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1nyq s TYR 290 N -3.34 3.10 -0.41 1.61 1.51 -0.79 -4.66 117.35 114.37 1nyq s TYR 290 Ca 0.05 0.02 -0.13 0.00 -1.01 0.00 0.00 57.07 56.00 1nyq s TYR 290 Cb -0.02 -1.56 0.04 0.00 -0.11 0.00 0.00 41.96 40.31 1nyq s TYR 290 CO 0.70 0.51 0.27 -0.51 -1.11 0.00 0.00 175.55 175.41 1nyq s ASP 291 N -2.54 5.89 0.36 2.29 1.01 -0.77 -4.46 116.67 118.45 1nyq s ASP 291 Ca 0.28 -1.10 -0.20 0.00 0.71 0.00 0.00 52.55 52.25 1nyq s ASP 291 Cb -0.11 -2.08 -0.10 0.00 1.01 0.00 0.00 42.92 41.64 1nyq s ASP 291 CO 0.21 -0.47 0.86 -1.00 0.21 0.00 0.00 175.17 174.99 1nyq s HIS 292 N 1.58 3.41 0.30 4.23 3.76 -1.26 -1.10 115.29 126.22 1nyq s HIS 292 Ca 0.03 1.49 0.02 0.00 -0.15 0.00 0.00 55.06 56.46 1nyq s HIS 292 Cb -0.20 -2.74 -0.02 0.00 1.11 0.00 0.00 32.58 30.72 1nyq s HIS 292 CO 0.07 0.03 0.30 0.14 -0.85 0.00 0.00 174.74 174.44 1nyq s VAL 293 N -1.99 0.00 -0.04 -0.90 -7.23 -0.54 -4.89 120.40 104.81 1nyq s VAL 293 Ca 0.56 -1.88 -0.00 0.00 -1.81 0.00 0.00 61.98 58.85 1nyq s VAL 293 Cb -0.11 -2.52 0.03 0.00 0.56 0.00 0.00 36.38 34.33 1nyq s VAL 293 CO 0.16 0.00 0.01 -0.31 -0.31 0.00 0.00 175.10 174.65 1nyq s TYR 294 N -3.53 0.40 0.16 2.82 1.51 -1.26 -4.61 117.35 112.84 1nyq s TYR 294 Ca 0.37 -0.02 0.04 0.00 -1.01 0.00 0.00 57.07 56.45 1nyq s TYR 294 Cb 0.03 -0.54 -0.05 0.00 -0.11 0.00 0.00 41.96 41.29 1nyq s TYR 294 CO 0.22 -0.20 -0.08 0.95 -1.11 0.00 0.00 175.55 175.33 1nyq s THR 295 N 1.43 1.09 0.76 -0.71 -4.23 -1.26 -5.15 115.64 107.58 1nyq s THR 295 Ca -0.04 -2.05 -0.14 0.00 -1.18 0.00 0.00 61.69 58.29 1nyq s THR 295 Cb -0.13 -1.92 0.06 0.00 1.34 0.00 0.00 72.50 71.84 1nyq s THR 295 CO -0.03 -0.68 1.17 -2.84 -0.54 0.00 0.00 174.62 171.70 1nyq s PRO 296 N -3.78 2.02 0.00 3.99 0.02 -1.26 -4.92 135.00 131.07 1nyq s PRO 296 Ca 0.18 1.62 0.27 0.00 0.02 0.00 0.00 61.00 63.09 1nyq s PRO 296 Cb 0.03 -1.83 0.93 0.00 0.02 0.00 0.00 34.50 33.65 1nyq s PRO 296 CO 0.02 -1.90 1.67 1.33 -0.33 0.00 0.00 177.00 177.79 1nyq n VAL 297 N -3.05 0.00 -4.37 3.83 0.24 -1.26 -4.89 118.33 108.84 1nyq n VAL 297 Ca 0.12 -0.18 -0.23 0.00 -2.04 0.00 0.00 64.34 62.01 1nyq n VAL 297 Cb 0.51 0.41 -0.11 0.00 -1.47 0.00 0.00 33.84 33.18 1nyq n VAL 297 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1nyq s LEU 298 N -2.26 2.45 -0.18 1.34 1.43 -1.26 -0.87 118.68 119.32 1nyq s LEU 298 Ca 0.31 -0.87 -0.29 0.00 -1.03 0.00 0.00 54.13 52.25 1nyq s LEU 298 Cb 0.20 -0.94 0.11 0.00 0.03 0.00 0.00 46.19 45.59 1nyq s LEU 298 CO 0.43 0.01 0.93 0.00 0.23 0.00 0.00 176.35 177.96 1nyq s ALA 299 N -1.96 -1.90 0.27 4.21 0.00 -1.08 -4.93 121.76 116.36 1nyq s ALA 299 Ca 0.18 1.64 -0.30 0.00 0.00 0.00 0.00 51.96 53.48 1nyq s ALA 299 Cb -0.06 -0.79 -0.14 0.00 0.00 0.00 0.00 23.12 22.13 1nyq s ALA 299 CO 0.08 -0.30 1.19 -1.71 0.00 0.00 0.00 175.76 175.02 1nyq n ASN 300 N 1.24 1.97 -0.29 0.00 2.85 -1.26 -2.48 115.26 117.28 1nyq n ASN 300 Ca -0.13 1.17 0.24 0.00 -0.11 0.00 0.00 54.58 55.76 1nyq n ASN 300 Cb 0.57 -1.35 0.57 0.00 1.24 0.00 0.00 39.78 40.81 1nyq n ASN 300 CO 0.00 0.00 0.00 0.58 -2.11 0.00 0.00 177.26 175.73 1nyq h VAL 301 N 2.49 0.54 -1.02 3.44 2.07 -1.82 -0.41 116.25 121.55 1nyq h VAL 301 Ca -0.43 -0.10 0.34 0.00 0.82 0.00 0.00 66.70 67.33 1nyq h VAL 301 Cb 1.31 0.22 -0.15 0.00 -1.52 0.00 0.00 31.29 31.15 1nyq h VAL 301 CO 0.66 0.05 0.58 0.44 0.02 0.00 0.00 177.57 179.33 1nyq h ASP 302 N 0.30 0.48 0.47 0.57 5.19 -1.87 -1.69 116.42 119.86 1nyq h ASP 302 Ca 0.54 0.20 -0.01 0.00 -0.62 0.00 0.00 57.03 57.14 1nyq h ASP 302 Cb 1.56 0.15 -0.02 0.00 0.18 0.00 0.00 39.33 41.21 1nyq h ASP 302 CO -0.20 -0.18 -0.41 0.25 -3.12 0.00 0.00 179.24 175.59 1nyq h LEU 303 N 0.27 -1.09 -1.48 1.55 5.85 -1.40 0.20 115.31 119.21 1nyq h LEU 303 Ca 0.75 0.08 0.00 0.00 0.84 0.00 0.00 57.88 59.56 1nyq h LEU 303 Cb 1.80 0.35 0.00 0.00 0.37 0.00 0.00 40.66 43.18 1nyq h LEU 303 CO -0.62 -0.58 0.00 1.88 -0.34 0.00 0.00 178.44 178.79 1nyq h TYR 304 N -0.87 0.00 0.04 1.25 0.05 -1.49 0.24 116.97 116.20 1nyq h TYR 304 Ca -0.05 0.00 -0.15 0.00 0.05 0.00 0.00 58.73 58.58 1nyq h TYR 304 Cb 0.76 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.49 1nyq h TYR 304 CO -0.19 0.00 -0.77 0.87 -1.05 0.00 0.00 178.16 177.02 1nyq h LYS 305 N 0.00 0.09 -0.23 4.88 1.57 -0.88 0.56 116.57 122.56 1nyq h LYS 305 Ca 0.00 -0.16 0.07 0.00 -1.87 0.00 0.00 60.65 58.69 1nyq h LYS 305 Cb 0.11 0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.47 1nyq h LYS 305 CO 0.00 1.08 0.21 1.15 -0.57 0.00 0.00 179.45 181.32 1nyq h THR 306 N -0.76 0.59 -0.03 -0.16 2.02 0.13 -0.55 112.91 114.15 1nyq h THR 306 Ca -0.18 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.00 1nyq h THR 306 Cb 1.34 0.84 0.00 0.00 -1.74 0.00 0.00 68.15 68.58 1nyq h THR 306 CO -0.03 0.00 -0.02 -1.54 0.37 0.00 0.00 175.52 174.30 1nyq n SER 307 N -4.01 2.55 -0.74 4.18 3.41 -0.23 -4.62 113.62 114.16 1nyq n SER 307 Ca 0.03 -1.84 -0.10 0.00 -0.26 0.00 0.00 58.87 56.70 1nyq n SER 307 Cb 0.35 0.02 -0.04 0.00 -0.26 0.00 0.00 64.21 64.28 1nyq n SER 307 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1nyq n GLY 308 N 1.31 1.12 0.13 5.00 0.00 -0.22 -4.86 105.19 107.67 1nyq n GLY 308 Ca 0.15 -0.55 0.04 0.00 0.00 0.00 0.00 46.02 45.65 1nyq n GLY 308 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 1nyq h HIS 309 N 0.00 0.00 0.00 1.61 3.86 -0.32 -2.30 115.15 118.00 1nyq h HIS 309 Ca -0.20 0.00 -0.14 0.00 -1.16 0.00 0.00 60.37 58.87 1nyq h HIS 309 Cb 0.64 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.09 1nyq h HIS 309 CO 0.28 0.42 -0.86 2.35 0.86 0.00 0.00 177.93 180.98 1nyq h TRP 310 N 0.00 0.00 0.04 2.45 2.91 -0.82 0.50 115.95 121.04 1nyq h TRP 310 Ca -0.05 0.00 -0.24 0.00 1.13 0.00 0.00 58.89 59.73 1nyq h TRP 310 Cb 1.36 0.00 -0.02 0.00 -0.51 0.00 0.00 29.16 29.99 1nyq h TRP 310 CO 0.00 0.62 -1.13 -0.44 -1.03 0.00 0.00 178.44 176.46 1nyq h ASP 311 N 0.00 0.15 0.00 2.65 3.32 -1.76 -3.37 116.42 117.40 1nyq h ASP 311 Ca -0.05 -0.16 0.00 0.00 0.02 0.00 0.00 57.03 56.83 1nyq h ASP 311 Cb 1.52 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 41.02 1nyq h ASP 311 CO 0.07 1.13 0.00 1.41 -1.72 0.00 0.00 179.24 180.13 1nyq n HIS 312 N -3.40 0.00 -0.00 4.55 8.25 -0.87 -4.86 115.22 118.89 1nyq n HIS 312 Ca -0.04 0.00 -0.00 0.00 -0.26 0.00 0.00 57.72 57.42 1nyq n HIS 312 Cb 0.98 0.00 -0.00 0.00 1.12 0.00 0.00 29.99 32.08 1nyq n HIS 312 CO 0.00 0.00 0.00 0.98 0.64 0.00 0.00 176.34 177.96 1nyq n TYR 313 N -0.20 0.00 0.00 4.41 9.36 0.08 -4.82 117.16 125.99 1nyq n TYR 313 Ca 0.00 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.22 1nyq n TYR 313 Cb 0.07 -0.01 0.00 0.00 -0.63 0.00 0.00 39.34 38.77 1nyq n TYR 313 CO 0.00 0.00 0.00 0.94 0.22 0.00 0.00 176.86 178.02 1nyq n GLN 314 N -1.87 0.00 -0.28 2.98 -0.06 -0.67 0.25 117.38 117.73 1nyq n GLN 314 Ca -0.00 0.00 0.23 0.00 -2.00 0.00 0.00 57.00 55.22 1nyq n GLN 314 Cb 0.37 0.00 0.55 0.00 -4.06 0.00 0.00 30.24 27.10 1nyq n GLN 314 CO 0.00 0.00 0.00 1.05 -0.20 0.00 0.00 177.06 177.91 1nyq h GLU 315 N 0.00 0.33 -0.74 3.69 4.11 -1.90 0.13 114.58 120.20 1nyq h GLU 315 Ca 0.00 -0.02 -0.17 0.00 0.07 0.00 0.00 59.36 59.24 1nyq h GLU 315 Cb 0.00 -0.07 -0.10 0.00 0.50 0.00 0.00 28.75 29.08 1nyq h GLU 315 CO 0.00 0.22 0.21 -0.25 0.07 0.00 0.00 179.01 179.26 1nyq n ASP 316 N -4.51 4.88 -4.42 3.06 9.92 0.68 -4.85 116.55 121.32 1nyq n ASP 316 Ca 0.22 -3.10 -0.28 0.00 -0.53 0.00 0.00 54.79 51.11 1nyq n ASP 316 Cb 0.84 -0.73 -0.12 0.00 -0.64 0.00 0.00 41.12 40.47 1nyq n ASP 316 CO 0.00 0.00 0.00 -0.04 0.13 0.00 0.00 177.20 177.29 1nyq s MET 317 N -2.82 1.50 0.18 -1.24 -1.94 0.45 -2.29 119.30 113.14 1nyq s MET 317 Ca 0.52 -1.44 -0.30 0.00 -1.71 0.00 0.00 55.69 52.76 1nyq s MET 317 Cb 0.41 -1.88 -0.08 0.00 2.01 0.00 0.00 34.83 35.29 1nyq s MET 317 CO 0.13 0.42 1.18 -0.06 -0.01 0.00 0.00 175.02 176.69 1nyq s PHE 318 N -1.42 3.46 0.26 -0.03 0.40 -1.26 -4.59 117.98 114.80 1nyq s PHE 318 Ca 0.18 1.45 -0.29 0.00 -0.60 0.00 0.00 56.93 57.67 1nyq s PHE 318 Cb -0.09 -3.40 -0.14 0.00 0.51 0.00 0.00 43.02 39.90 1nyq s PHE 318 CO 0.09 -1.10 1.13 -0.35 0.70 0.00 0.00 175.22 175.69 1nyq n PRO 319 N 2.56 1.49 -0.24 0.24 -0.04 -1.26 -4.54 135.00 133.20 1nyq n PRO 319 Ca 0.04 0.53 -0.11 0.00 -0.04 0.00 0.00 63.50 63.92 1nyq n PRO 319 Cb 0.45 -1.99 0.10 0.00 -0.04 0.00 0.00 33.50 32.02 1nyq n PRO 319 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 1nyq n PRO 320 N 1.12 -2.36 -3.21 0.54 -0.04 -1.26 -4.80 135.00 124.99 1nyq n PRO 320 Ca 0.10 -0.59 0.01 0.00 -0.04 0.00 0.00 63.50 62.99 1nyq n PRO 320 Cb 0.31 -0.63 -0.01 0.00 -0.04 0.00 0.00 33.50 33.12 1nyq n PRO 320 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1nyq s MET 321 N -3.83 0.81 0.79 0.54 0.23 0.15 -4.94 119.30 113.05 1nyq s MET 321 Ca 0.25 -0.24 -0.12 0.00 -1.03 0.00 0.00 55.69 54.54 1nyq s MET 321 Cb -0.03 0.10 0.07 0.00 -1.53 0.00 0.00 34.83 33.44 1nyq s MET 321 CO 0.20 -1.19 1.14 1.14 -2.03 0.00 0.00 175.02 174.29 1nyq s GLN 322 N 1.87 1.88 0.00 3.16 0.00 -1.26 -2.71 119.66 122.60 1nyq s GLN 322 Ca 0.16 1.49 0.00 0.00 -0.00 0.00 0.00 55.36 57.01 1nyq s GLN 322 Cb -0.04 -1.83 0.00 0.00 0.00 0.00 0.00 33.01 31.14 1nyq s GLN 322 CO -0.07 -1.97 0.00 1.47 0.00 0.00 0.00 175.29 174.71 1nyq n LEU 323 N -3.39 0.00 0.00 2.60 -0.00 -0.99 -4.87 117.00 110.35 1nyq n LEU 323 Ca 0.11 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.12 1nyq n LEU 323 Cb 0.52 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.94 1nyq n LEU 323 CO 0.50 0.00 0.00 0.47 -0.00 0.00 0.00 177.39 178.36 1nyq n ASP 324 N -1.08 0.00 -4.56 1.45 8.00 -1.24 -5.00 116.55 114.12 1nyq n ASP 324 Ca 0.00 0.00 -0.40 0.00 0.71 0.00 0.00 54.79 55.10 1nyq n ASP 324 Cb 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.07 1nyq n ASP 324 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 1nyq s GLU 325 N 4.41 3.51 -0.80 -1.24 2.12 -1.26 -4.09 118.70 121.34 1nyq s GLU 325 Ca 0.00 -1.02 -0.08 0.00 0.36 0.00 0.00 54.97 54.23 1nyq s GLU 325 Cb 0.00 -5.28 0.08 0.00 0.26 0.00 0.00 34.13 29.19 1nyq s GLU 325 CO 0.00 -2.27 0.24 2.41 -0.54 0.00 0.00 175.26 175.10 1nyq n THR 326 N 6.92 -0.22 -3.55 -1.70 -1.04 -1.26 -4.83 114.28 108.59 1nyq n THR 326 Ca 0.32 0.00 -0.40 0.00 -2.04 0.00 0.00 64.05 61.92 1nyq n THR 326 Cb 0.51 -0.59 -0.06 0.00 -1.82 0.00 0.00 70.33 68.37 1nyq n THR 326 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 1nyq s GLU 327 N -5.77 3.19 0.39 -2.82 0.41 -1.26 -5.03 118.70 107.81 1nyq s GLU 327 Ca 0.29 -2.75 -0.11 0.00 -0.41 0.00 0.00 54.97 51.99 1nyq s GLU 327 Cb -0.17 -4.06 -0.07 0.00 -1.78 0.00 0.00 34.13 28.05 1nyq s GLU 327 CO 0.36 -1.23 0.76 -1.54 -0.49 0.00 0.00 175.26 173.11 1nyq s SER 328 N 0.98 6.57 0.25 -0.19 1.04 -1.26 -2.36 113.70 118.72 1nyq s SER 328 Ca 0.21 1.15 0.04 0.00 0.48 0.00 0.00 55.95 57.83 1nyq s SER 328 Cb -0.13 -2.33 -0.05 0.00 0.10 0.00 0.00 66.02 63.60 1nyq s SER 328 CO -0.07 -0.36 -0.01 -0.04 0.98 0.00 0.00 173.24 173.74 1nyq s MET 329 N -3.68 1.42 0.05 4.02 -1.94 -1.10 -2.70 119.30 115.38 1nyq s MET 329 Ca 0.52 -1.73 -0.18 0.00 -1.71 0.00 0.00 55.69 52.59 1nyq s MET 329 Cb -0.10 -0.77 0.04 0.00 2.01 0.00 0.00 34.83 36.00 1nyq s MET 329 CO 0.29 -0.08 0.41 0.54 -0.01 0.00 0.00 175.02 176.17 1nyq s VAL 330 N -3.31 0.06 -0.15 -6.03 0.11 -1.04 0.30 120.40 110.34 1nyq s VAL 330 Ca 0.30 -0.47 -0.22 0.00 -2.93 0.00 0.00 61.98 58.65 1nyq s VAL 330 Cb 0.06 -0.98 -0.03 0.00 -1.53 0.00 0.00 36.38 33.90 1nyq s VAL 330 CO 0.10 -0.26 0.69 -0.76 -3.33 0.00 0.00 175.10 171.54 1nyq s LEU 331 N -2.09 4.20 0.20 2.54 1.43 -1.26 -2.64 118.68 121.06 1nyq s LEU 331 Ca -0.04 1.01 -0.32 0.00 -1.03 0.00 0.00 54.13 53.75 1nyq s LEU 331 Cb -0.00 -3.02 -0.11 0.00 0.03 0.00 0.00 46.19 43.09 1nyq s LEU 331 CO -0.03 -0.25 1.65 0.00 0.23 0.00 0.00 176.35 177.94 1nyq s ARG 332 N 1.61 4.16 0.01 1.70 1.70 -0.05 -4.62 118.95 123.47 1nyq s ARG 332 Ca 0.33 2.51 0.24 0.00 -0.47 0.00 0.00 55.73 58.34 1nyq s ARG 332 Cb -0.16 -3.10 0.25 0.00 -0.57 0.00 0.00 34.95 31.37 1nyq s ARG 332 CO 0.13 -0.68 1.23 -0.35 -1.08 0.00 0.00 175.30 174.55 1nyq n PRO 333 N 3.75 0.06 -3.57 3.89 -0.04 -1.26 -0.19 135.00 137.63 1nyq n PRO 333 Ca 0.14 0.00 -0.16 0.00 -0.04 0.00 0.00 63.50 63.44 1nyq n PRO 333 Cb 0.37 -1.52 -0.06 0.00 -0.04 0.00 0.00 33.50 32.24 1nyq n PRO 333 CO 0.00 0.00 0.00 -1.64 -0.04 0.00 0.00 175.50 173.82 1nyq s MET 334 N -3.04 0.98 0.00 0.54 -1.94 -1.26 -4.76 119.30 109.83 1nyq s MET 334 Ca 0.09 0.07 0.24 0.00 -1.71 0.00 0.00 55.69 54.39 1nyq s MET 334 Cb 0.16 0.46 0.35 0.00 2.01 0.00 0.00 34.83 37.81 1nyq s MET 334 CO 0.76 -0.31 1.30 0.09 -0.01 0.00 0.00 175.02 176.85 1nyq n ASN 335 N 0.88 0.60 -0.01 3.03 3.02 -1.26 -4.52 115.26 116.99 1nyq n ASN 335 Ca -0.19 -0.37 -0.05 0.00 -0.03 0.00 0.00 54.58 53.94 1nyq n ASN 335 Cb 0.57 0.40 -0.03 0.00 -0.61 0.00 0.00 39.78 40.12 1nyq n ASN 335 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1nyq n PRO 337 N -3.48 -0.05 0.18 0.00 -0.04 -1.26 -0.03 135.00 130.31 1nyq n PRO 337 Ca -0.02 1.29 -0.08 0.00 -0.04 0.00 0.00 63.50 64.65 1nyq n PRO 337 Cb 0.12 -2.36 -0.04 0.00 -0.04 0.00 0.00 33.50 31.18 1nyq n PRO 337 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1nyq h HIS 338 N 0.00 -0.49 -1.00 0.54 3.86 -1.66 -2.92 115.15 113.48 1nyq h HIS 338 Ca 0.81 -0.01 0.28 0.00 -1.16 0.00 0.00 60.37 60.29 1nyq h HIS 338 Cb 2.24 0.16 -0.05 0.00 1.06 0.00 0.00 27.41 30.82 1nyq h HIS 338 CO -0.01 -0.30 0.70 0.45 0.86 0.00 0.00 177.93 179.63 1nyq h HIS 339 N -1.02 0.16 -0.03 2.45 3.86 -0.17 0.49 115.15 120.89 1nyq h HIS 339 Ca -0.05 0.01 0.02 0.00 -1.16 0.00 0.00 60.37 59.18 1nyq h HIS 339 Cb 0.40 -0.05 -0.03 0.00 1.06 0.00 0.00 27.41 28.80 1nyq h HIS 339 CO 0.01 0.02 -0.12 0.52 0.86 0.00 0.00 177.93 179.23 1nyq h MET 340 N 0.10 -0.18 0.00 2.45 2.86 -0.39 0.11 114.93 119.88 1nyq h MET 340 Ca 0.49 0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 58.13 1nyq h MET 340 Cb 1.78 0.04 -0.00 0.00 0.06 0.00 0.00 31.60 33.48 1nyq h MET 340 CO -0.07 -0.12 -0.06 0.52 1.06 0.00 0.00 176.91 178.25 1nyq h MET 341 N -0.18 0.00 -0.03 1.72 2.86 0.13 -1.28 114.93 118.15 1nyq h MET 341 Ca 0.05 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.68 1nyq h MET 341 Cb 0.25 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.91 1nyq h MET 341 CO -0.14 0.06 -0.01 0.82 1.06 0.00 0.00 176.91 178.70 1nyq h ILE 342 N 0.00 1.33 -0.88 -1.22 1.08 -0.16 -2.36 117.51 115.30 1nyq h ILE 342 Ca -0.00 -1.01 0.03 0.00 -0.39 0.00 0.00 64.86 63.49 1nyq h ILE 342 Cb 0.12 1.96 -0.05 0.00 -3.07 0.00 0.00 36.82 35.78 1nyq h ILE 342 CO 0.01 0.27 0.58 0.22 -0.69 0.00 0.00 178.15 178.54 1nyq h TYR 343 N -0.35 1.08 0.00 1.37 3.20 0.09 -1.92 116.97 120.45 1nyq h TYR 343 Ca 0.01 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.90 1nyq h TYR 343 Cb 0.44 -0.36 0.00 0.00 1.54 0.00 0.00 36.73 38.35 1nyq h TYR 343 CO 0.07 0.64 0.00 0.00 -1.64 0.00 0.00 178.16 177.23 1nyq n ALA 344 N -2.40 2.13 0.31 1.82 0.00 -0.57 -3.89 120.51 117.90 1nyq n ALA 344 Ca 0.11 -0.09 0.17 0.00 0.00 0.00 0.00 53.44 53.63 1nyq n ALA 344 Cb 0.09 -1.39 0.89 0.00 0.00 0.00 0.00 19.45 19.03 1nyq n ALA 344 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 1nyq h ASN 345 N 0.00 0.00 -5.03 0.00 -1.24 -0.79 -3.43 115.58 105.09 1nyq h ASN 345 Ca 0.00 0.00 0.08 0.00 0.71 0.00 0.00 56.30 57.09 1nyq h ASN 345 Cb 0.40 0.00 -0.05 0.00 0.73 0.00 0.00 38.32 39.40 1nyq h ASN 345 CO 0.00 0.00 0.25 -1.59 -1.29 0.00 0.00 177.43 174.80 1nyq s LYS 346 N -3.99 1.75 0.57 6.67 -2.85 -1.25 -5.14 119.74 115.50 1nyq s LYS 346 Ca -0.04 -0.97 -0.18 0.00 -1.00 0.00 0.00 55.97 53.78 1nyq s LYS 346 Cb 0.09 0.59 -0.05 0.00 -2.06 0.00 0.00 37.83 36.41 1nyq s LYS 346 CO 0.30 -0.80 1.10 -2.14 0.10 0.00 0.00 175.35 173.90 1nyq s PRO 347 N -3.83 3.29 -0.06 1.78 0.02 -1.26 -5.02 135.00 129.92 1nyq s PRO 347 Ca 0.11 1.45 0.00 0.00 0.02 0.00 0.00 61.00 62.59 1nyq s PRO 347 Cb -0.06 -2.01 0.02 0.00 0.02 0.00 0.00 34.50 32.48 1nyq s PRO 347 CO 0.07 -0.87 -0.03 -1.01 -0.33 0.00 0.00 177.00 174.83 1nyq s HIS 348 N -2.05 0.72 0.43 6.54 3.76 -1.26 -5.08 115.29 118.36 1nyq s HIS 348 Ca 0.69 -0.20 -0.19 0.00 -0.15 0.00 0.00 55.06 55.21 1nyq s HIS 348 Cb -0.21 -0.72 -0.10 0.00 1.11 0.00 0.00 32.58 32.67 1nyq s HIS 348 CO 0.31 -0.25 0.92 0.45 -0.85 0.00 0.00 174.74 175.32 1nyq s SER 349 N 1.31 6.83 0.62 1.40 0.15 -1.26 -1.84 113.70 120.91 1nyq s SER 349 Ca -0.05 1.59 0.17 0.00 0.70 0.00 0.00 55.95 58.36 1nyq s SER 349 Cb -0.13 -2.50 0.95 0.00 -1.71 0.00 0.00 66.02 62.62 1nyq s SER 349 CO -0.02 -0.39 1.52 0.10 1.20 0.00 0.00 173.24 175.64 1nyq h TYR 350 N 1.70 0.00 0.06 3.44 -0.00 -1.45 -2.73 116.97 117.99 1nyq h TYR 350 Ca -0.48 0.00 -0.00 0.00 0.00 0.00 0.00 58.73 58.24 1nyq h TYR 350 Cb 1.18 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.91 1nyq h TYR 350 CO 0.62 0.00 -0.03 0.00 -0.00 0.00 0.00 178.16 178.75 1nyq h ARG 351 N 0.00 -0.08 -2.09 0.10 3.08 -1.91 -3.31 114.38 110.18 1nyq h ARG 351 Ca 0.00 0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.05 1nyq h ARG 351 Cb 1.14 0.02 -0.00 0.00 0.08 0.00 0.00 29.97 31.20 1nyq h ARG 351 CO 0.00 -0.05 0.03 -0.85 -1.07 0.00 0.00 179.97 178.02 1nyq n GLU 352 N -2.47 0.39 0.04 0.04 0.28 -1.03 -4.48 120.64 113.41 1nyq n GLU 352 Ca -0.01 -0.05 0.11 0.00 -0.16 0.00 0.00 57.16 57.06 1nyq n GLU 352 Cb 0.03 -1.37 0.01 0.00 1.43 0.00 0.00 31.44 31.54 1nyq n GLU 352 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 177.13 176.86 1nyq n LEU 353 N 1.96 0.60 -2.33 -1.84 -0.00 -1.25 -3.97 117.00 110.17 1nyq n LEU 353 Ca 0.02 0.05 -0.19 0.00 -0.00 0.00 0.00 56.01 55.89 1nyq n LEU 353 Cb 0.19 -0.09 -0.13 0.00 -0.00 0.00 0.00 43.42 43.39 1nyq n LEU 353 CO 0.03 -0.00 1.98 -2.65 -0.00 0.00 0.00 177.39 176.74 1nyq n PRO 354 N -2.11 2.42 -1.63 1.96 -0.02 -1.26 -4.10 135.00 130.27 1nyq n PRO 354 Ca 0.01 -1.41 -0.49 0.00 -2.02 0.00 0.00 63.50 59.59 1nyq n PRO 354 Cb 0.47 -2.18 -0.05 0.00 -0.02 0.00 0.00 33.50 31.71 1nyq n PRO 354 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 1nyq n ILE 355 N 2.54 0.44 -3.64 4.25 5.41 -1.17 -4.83 119.36 122.37 1nyq n ILE 355 Ca 0.51 -0.17 -0.36 0.00 1.00 0.00 0.00 62.75 63.73 1nyq n ILE 355 Cb 0.74 -1.82 -0.07 0.00 -0.71 0.00 0.00 39.64 37.78 1nyq n ILE 355 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 176.55 176.42 1nyq s ARG 356 N 4.74 3.25 0.12 0.38 0.52 -1.26 -1.27 118.95 125.43 1nyq s ARG 356 Ca 0.98 -3.28 -0.31 0.00 -0.52 0.00 0.00 55.73 52.60 1nyq s ARG 356 Cb -0.74 -3.94 -0.09 0.00 0.52 0.00 0.00 34.95 30.70 1nyq s ARG 356 CO 0.51 -1.26 1.58 0.42 0.02 0.00 0.00 175.30 176.57 1nyq s ILE 357 N -1.35 2.88 -0.01 1.52 -1.09 -0.85 -1.84 121.20 120.45 1nyq s ILE 357 Ca 0.27 0.52 0.01 0.00 -2.23 0.00 0.00 60.65 59.22 1nyq s ILE 357 Cb -0.07 -3.33 0.01 0.00 -1.58 0.00 0.00 42.46 37.49 1nyq s ILE 357 CO -0.13 0.02 -0.01 0.00 -1.23 0.00 0.00 174.94 173.60 1nyq s ALA 358 N 1.79 0.22 -0.06 9.38 0.00 -0.26 0.11 121.76 132.93 1nyq s ALA 358 Ca 0.71 0.02 -0.05 0.00 0.00 0.00 0.00 51.96 52.64 1nyq s ALA 358 Cb -0.41 -0.15 0.02 0.00 0.00 0.00 0.00 23.12 22.58 1nyq s ALA 358 CO 0.31 -0.00 0.17 -2.00 0.00 0.00 0.00 175.76 174.24 1nyq s GLU 359 N 0.40 0.17 -1.45 0.00 2.12 -1.06 -1.47 118.70 117.41 1nyq s GLU 359 Ca -0.04 0.27 -0.11 0.00 0.36 0.00 0.00 54.97 55.46 1nyq s GLU 359 Cb -0.06 0.03 0.04 0.00 0.26 0.00 0.00 34.13 34.40 1nyq s GLU 359 CO -0.01 -0.06 2.38 -0.11 -0.54 0.00 0.00 175.26 176.93 1nyq n LEU 360 N 3.28 7.53 -4.71 2.70 7.94 -1.26 -2.54 117.00 129.95 1nyq n LEU 360 Ca -0.16 -4.43 -0.41 0.00 -1.11 0.00 0.00 56.01 49.91 1nyq n LEU 360 Cb 0.57 -1.55 -0.04 0.00 0.53 0.00 0.00 43.42 42.94 1nyq n LEU 360 CO 0.20 1.58 0.57 -0.83 -1.11 0.00 0.00 177.39 177.80 1nyq s GLY 361 N 1.98 2.74 0.65 -3.96 0.00 -0.81 -4.72 107.32 103.20 1nyq s GLY 361 Ca 0.53 0.35 -0.14 0.00 0.00 0.00 0.00 44.72 45.46 1nyq s GLY 361 CO -0.06 1.49 1.06 -1.59 0.00 0.00 0.00 173.10 174.00 1nyq s THR 362 N 1.01 3.81 -0.25 0.90 2.01 -1.26 -1.55 115.64 120.31 1nyq s THR 362 Ca 0.45 0.74 -0.28 0.00 0.31 0.00 0.00 61.69 62.92 1nyq s THR 362 Cb -0.19 -3.33 0.15 0.00 0.01 0.00 0.00 72.50 69.14 1nyq s THR 362 CO 0.23 -0.62 1.18 0.00 -0.69 0.00 0.00 174.62 174.72 1nyq s MET 363 N -4.47 0.35 -0.10 4.92 0.23 -0.36 -4.87 119.30 115.00 1nyq s MET 363 Ca 0.62 0.22 0.03 0.00 -1.03 0.00 0.00 55.69 55.52 1nyq s MET 363 Cb -0.16 0.17 -0.01 0.00 -1.53 0.00 0.00 34.83 33.30 1nyq s MET 363 CO 0.45 -0.08 -0.18 -1.01 -2.03 0.00 0.00 175.02 172.16 1nyq s HIS 364 N -0.52 2.66 0.05 3.16 3.76 0.73 -2.48 115.29 122.65 1nyq s HIS 364 Ca 0.04 -0.70 0.08 0.00 -0.15 0.00 0.00 55.06 54.33 1nyq s HIS 364 Cb -0.03 -1.73 -0.03 0.00 1.11 0.00 0.00 32.58 31.90 1nyq s HIS 364 CO -0.06 -0.21 -0.20 1.03 -0.85 0.00 0.00 174.74 174.45 1nyq s ARG 365 N 0.10 1.99 -1.16 1.40 3.00 -0.81 -3.99 118.95 119.47 1nyq s ARG 365 Ca -0.09 -1.03 -0.04 0.00 0.00 0.00 0.00 55.73 54.57 1nyq s ARG 365 Cb -0.15 -2.14 0.24 0.00 0.00 0.00 0.00 34.95 32.89 1nyq s ARG 365 CO 0.05 0.53 1.91 0.98 0.00 0.00 0.00 175.30 178.77 1nyq n TYR 366 N 1.50 2.62 -0.55 -0.53 4.19 -0.97 -4.48 117.16 118.95 1nyq n TYR 366 Ca -0.16 -2.67 -0.29 0.00 3.31 0.00 0.00 57.90 58.08 1nyq n TYR 366 Cb 0.52 -1.51 0.23 0.00 0.49 0.00 0.00 39.34 39.07 1nyq n TYR 366 CO 0.00 0.00 0.00 0.39 0.91 0.00 0.00 176.86 178.16 1nyq n GLU 367 N 1.40 -1.82 -2.02 2.98 -0.58 -1.26 -4.75 120.64 114.58 1nyq n GLU 367 Ca 0.45 -0.49 -0.42 0.00 -0.42 0.00 0.00 57.16 56.28 1nyq n GLU 367 Cb 0.29 -2.20 -0.03 0.00 -0.57 0.00 0.00 31.44 28.93 1nyq n GLU 367 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1nyq s ALA 368 N -2.47 3.68 0.47 0.62 0.00 -1.26 -4.87 121.76 117.94 1nyq s ALA 368 Ca 0.67 1.29 0.41 0.00 0.00 0.00 0.00 51.96 54.33 1nyq s ALA 368 Cb -0.24 -3.58 1.51 0.00 0.00 0.00 0.00 23.12 20.81 1nyq s ALA 368 CO 0.63 -0.72 1.41 0.45 0.00 0.00 0.00 175.76 177.54 1nyq n SER 369 N 3.39 0.06 -0.23 0.00 2.88 -1.26 0.12 113.62 118.58 1nyq n SER 369 Ca 0.11 1.01 0.09 0.00 -1.33 0.00 0.00 58.87 58.74 1nyq n SER 369 Cb 0.40 -0.50 -0.05 0.00 -0.75 0.00 0.00 64.21 63.31 1nyq n SER 369 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1nyq n GLY 370 N -1.73 -0.32 0.15 0.46 0.00 -1.26 -4.39 105.19 98.11 1nyq n GLY 370 Ca 0.39 -0.52 0.03 0.00 0.00 0.00 0.00 46.02 45.92 1nyq n GLY 370 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nyq h ALA 371 N 2.91 0.73 -2.59 4.61 0.00 0.52 -3.46 119.26 121.99 1nyq h ALA 371 Ca 0.00 -0.42 -0.56 0.00 0.00 0.00 0.00 54.91 53.93 1nyq h ALA 371 Cb 0.54 -0.07 0.18 0.00 0.00 0.00 0.00 17.79 18.43 1nyq h ALA 371 CO 0.00 0.58 -0.09 1.33 0.00 0.00 0.00 179.25 181.07 1nyq n VAL 372 N -3.26 2.33 -3.09 0.00 0.24 -1.17 -4.78 118.33 108.59 1nyq n VAL 372 Ca 0.02 -0.37 0.02 0.00 -2.04 0.00 0.00 64.34 61.97 1nyq n VAL 372 Cb 0.69 -0.95 -0.00 0.00 -1.47 0.00 0.00 33.84 32.10 1nyq n VAL 372 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1nyq s SER 373 N -1.60 -1.14 0.14 -1.34 0.15 -0.66 -4.96 113.70 104.29 1nyq s SER 373 Ca 0.70 -0.30 0.00 0.00 0.70 0.00 0.00 55.95 57.05 1nyq s SER 373 Cb -0.34 1.54 0.00 0.00 -1.71 0.00 0.00 66.02 65.51 1nyq s SER 373 CO 0.54 -0.16 0.00 0.61 1.20 0.00 0.00 173.24 175.43 1nyq n GLY 374 N 4.59 2.01 0.02 9.45 0.00 -1.26 -1.52 105.19 118.48 1nyq n GLY 374 Ca 0.08 0.47 0.11 0.00 0.00 0.00 0.00 46.02 46.68 1nyq n GLY 374 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1nyq n LEU 375 N 0.00 0.61 -0.03 0.99 4.77 -1.26 -4.67 117.00 117.40 1nyq n LEU 375 Ca 0.00 -0.11 -0.15 0.00 -0.03 0.00 0.00 56.01 55.73 1nyq n LEU 375 Cb 0.00 -0.07 -0.10 0.00 -2.33 0.00 0.00 43.42 40.92 1nyq n LEU 375 CO 0.00 0.08 0.46 -0.61 -1.33 0.00 0.00 177.39 175.99 1nyq h GLN 376 N 0.00 0.29 -3.41 3.23 4.15 -1.50 -2.81 115.11 115.05 1nyq h GLN 376 Ca 0.00 -0.23 -0.53 0.00 0.77 0.00 0.00 58.65 58.66 1nyq h GLN 376 Cb 0.71 0.05 -0.40 0.00 0.21 0.00 0.00 27.48 28.05 1nyq h GLN 376 CO 0.00 0.87 -0.76 0.50 -1.93 0.00 0.00 178.83 177.51 1nyq s ARG 377 N -3.65 0.57 0.22 1.69 6.06 -1.22 -4.60 118.95 118.03 1nyq s ARG 377 Ca -0.15 -0.59 0.01 0.00 -2.50 0.00 0.00 55.73 52.51 1nyq s ARG 377 Cb 0.03 -1.93 -0.01 0.00 0.06 0.00 0.00 34.95 33.11 1nyq s ARG 377 CO 0.76 -0.79 0.05 1.33 -2.50 0.00 0.00 175.30 174.15 1nyq n VAL 378 N 5.04 0.00 -0.01 7.11 0.24 -1.26 -1.66 118.33 127.79 1nyq n VAL 378 Ca -0.07 -1.20 0.04 0.00 -2.04 0.00 0.00 64.34 61.07 1nyq n VAL 378 Cb 0.45 0.38 -0.07 0.00 -1.47 0.00 0.00 33.84 33.13 1nyq n VAL 378 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1nyq n ARG 379 N -0.51 0.49 -3.99 7.34 1.74 0.24 -4.76 116.66 117.21 1nyq n ARG 379 Ca -0.05 -0.07 -0.34 0.00 -0.77 0.00 0.00 57.85 56.61 1nyq n ARG 379 Cb 0.31 -1.21 -0.15 0.00 -1.02 0.00 0.00 32.46 30.39 1nyq n ARG 379 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1nyq s GLY 380 N -3.12 1.58 -0.04 -0.13 0.00 -1.09 -1.92 107.32 102.59 1nyq s GLY 380 Ca -0.03 -1.39 -0.10 0.00 0.00 0.00 0.00 44.72 43.20 1nyq s GLY 380 CO 0.37 0.47 0.23 -3.16 0.00 0.00 0.00 173.10 171.01 1nyq s MET 381 N 1.33 0.47 -0.31 2.90 0.23 -1.03 -4.84 119.30 118.05 1nyq s MET 381 Ca 0.01 -0.06 -0.02 0.00 -1.03 0.00 0.00 55.69 54.60 1nyq s MET 381 Cb -0.16 0.21 0.06 0.00 -1.53 0.00 0.00 34.83 33.41 1nyq s MET 381 CO -0.06 -0.11 0.02 0.99 -2.03 0.00 0.00 175.02 173.84 1nyq s THR 382 N -0.81 3.01 0.15 3.16 2.01 -1.26 -1.22 115.64 120.67 1nyq s THR 382 Ca -0.09 -1.48 -0.19 0.00 0.31 0.00 0.00 61.69 60.25 1nyq s THR 382 Cb -0.05 -2.78 -0.07 0.00 0.01 0.00 0.00 72.50 69.61 1nyq s THR 382 CO 0.02 -0.18 0.63 -0.22 -0.69 0.00 0.00 174.62 174.18 1nyq s LEU 383 N 1.23 4.43 -1.34 4.42 2.96 -0.60 -1.20 118.68 128.58 1nyq s LEU 383 Ca -0.03 1.30 -0.10 0.00 -0.22 0.00 0.00 54.13 55.07 1nyq s LEU 383 Cb -0.20 -3.24 0.12 0.00 0.50 0.00 0.00 46.19 43.37 1nyq s LEU 383 CO -0.02 0.15 2.04 -3.20 -1.32 0.00 0.00 176.35 174.01 1nyq n ASN 384 N 1.16 5.13 -4.64 3.68 5.15 -0.10 -1.92 115.26 123.73 1nyq n ASN 384 Ca -0.06 -3.03 -0.27 0.00 -0.60 0.00 0.00 54.58 50.62 1nyq n ASN 384 Cb 0.51 -1.52 0.11 0.00 -0.53 0.00 0.00 39.78 38.36 1nyq n ASN 384 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 1nyq s ASP 385 N 1.44 4.17 0.00 1.20 2.15 -1.05 -3.44 116.67 121.14 1nyq s ASP 385 Ca 0.44 0.29 0.00 0.00 0.43 0.00 0.00 52.55 53.70 1nyq s ASP 385 Cb 0.12 -0.69 0.00 0.00 -0.30 0.00 0.00 42.92 42.05 1nyq s ASP 385 CO -0.03 -2.03 0.00 -0.24 -0.17 0.00 0.00 175.17 172.70 1nyq n SER 386 N -3.21 0.00 -3.88 -0.34 2.88 -1.20 -2.57 113.62 105.30 1nyq n SER 386 Ca 0.11 0.00 -0.22 0.00 -1.33 0.00 0.00 58.87 57.44 1nyq n SER 386 Cb 0.60 0.00 -0.17 0.00 -0.75 0.00 0.00 64.21 63.90 1nyq n SER 386 CO 0.00 0.00 0.00 -1.00 -1.23 0.00 0.00 175.04 172.81 1nyq s HIS 387 N -2.00 0.89 -0.22 0.66 3.76 0.29 -3.15 115.29 115.53 1nyq s HIS 387 Ca 0.00 -0.30 -0.08 0.00 -0.15 0.00 0.00 55.06 54.53 1nyq s HIS 387 Cb 0.00 -0.81 -0.04 0.00 1.11 0.00 0.00 32.58 32.84 1nyq s HIS 387 CO 0.00 -0.27 0.09 0.42 -0.85 0.00 0.00 174.74 174.13 1nyq s ILE 388 N 1.23 4.82 -0.48 0.60 1.01 0.15 -2.02 121.20 126.50 1nyq s ILE 388 Ca -0.06 -0.01 -0.16 0.00 0.00 0.00 0.00 60.65 60.42 1nyq s ILE 388 Cb -0.14 -3.22 0.07 0.00 0.01 0.00 0.00 42.46 39.19 1nyq s ILE 388 CO -0.02 0.39 0.42 -0.36 0.00 0.00 0.00 174.94 175.37 1nyq s PHE 389 N 0.93 3.23 0.09 3.97 0.40 -0.40 0.27 117.98 126.48 1nyq s PHE 389 Ca 0.05 -0.91 0.05 0.00 -0.60 0.00 0.00 56.93 55.52 1nyq s PHE 389 Cb -0.14 -3.22 -0.03 0.00 0.51 0.00 0.00 43.02 40.14 1nyq s PHE 389 CO 0.03 -0.82 -0.12 0.14 0.70 0.00 0.00 175.22 175.14 1nyq s VAL 390 N 1.72 1.09 0.30 -0.44 -7.23 0.18 -3.02 120.40 113.00 1nyq s VAL 390 Ca 0.05 -1.54 -0.29 0.00 -1.81 0.00 0.00 61.98 58.39 1nyq s VAL 390 Cb -0.24 -1.29 -0.10 0.00 0.56 0.00 0.00 36.38 35.31 1nyq s VAL 390 CO 0.07 -0.41 1.22 0.00 -0.31 0.00 0.00 175.10 175.67 1nyq s ARG 391 N -2.39 4.48 0.28 4.82 1.70 -1.26 -0.21 118.95 126.37 1nyq s ARG 391 Ca 0.04 2.03 0.18 0.00 -0.47 0.00 0.00 55.73 57.50 1nyq s ARG 391 Cb -0.06 -3.13 0.98 0.00 -0.57 0.00 0.00 34.95 32.17 1nyq s ARG 391 CO 0.02 -0.02 1.10 -2.30 -1.08 0.00 0.00 175.30 173.01 1nyq n PRO 392 N 1.08 -0.04 0.06 3.89 -0.02 -1.26 -0.39 135.00 138.32 1nyq n PRO 392 Ca -0.00 0.93 0.09 0.00 -2.02 0.00 0.00 63.50 62.50 1nyq n PRO 392 Cb 0.43 -1.73 0.38 0.00 -0.02 0.00 0.00 33.50 32.56 1nyq n PRO 392 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1nyq n ASP 393 N -4.39 0.30 -0.01 2.55 5.75 -1.26 -1.95 116.55 117.54 1nyq n ASP 393 Ca 0.27 0.58 0.11 0.00 -0.01 0.00 0.00 54.79 55.74 1nyq n ASP 393 Cb 0.97 -0.64 -0.16 0.00 -1.03 0.00 0.00 41.12 40.26 1nyq n ASP 393 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1nyq n GLN 394 N -1.84 0.52 0.25 0.11 6.02 0.47 -4.50 117.38 118.41 1nyq n GLN 394 Ca 0.02 -0.16 0.07 0.00 -0.01 0.00 0.00 57.00 56.93 1nyq n GLN 394 Cb 0.18 -1.52 0.24 0.00 1.02 0.00 0.00 30.24 30.16 1nyq n GLN 394 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 177.06 176.87 1nyq h ILE 395 N 0.00 0.01 0.00 5.09 2.04 -1.44 0.55 117.51 123.77 1nyq h ILE 395 Ca 0.00 0.00 -0.24 0.00 1.00 0.00 0.00 64.86 65.62 1nyq h ILE 395 Cb 0.90 0.15 -0.04 0.00 -0.74 0.00 0.00 36.82 37.08 1nyq h ILE 395 CO 0.00 0.00 -1.89 2.29 0.00 0.00 0.00 178.15 178.55 1nyq n LYS 396 N -2.72 1.63 0.23 2.37 2.85 -1.26 -3.77 118.16 117.49 1nyq n LYS 396 Ca 0.03 0.01 -0.11 0.00 -1.05 0.00 0.00 58.31 57.19 1nyq n LYS 396 Cb 0.94 -1.33 -0.06 0.00 -0.65 0.00 0.00 35.03 33.94 1nyq n LYS 396 CO 0.00 0.00 0.00 1.49 -0.05 0.00 0.00 177.40 178.84 1nyq h GLU 397 N 0.00 -0.65 0.79 -1.58 4.22 -0.22 -2.33 114.58 114.81 1nyq h GLU 397 Ca -0.35 0.04 -0.04 0.00 0.08 0.00 0.00 59.36 59.10 1nyq h GLU 397 Cb 1.75 0.15 0.00 0.00 0.50 0.00 0.00 28.75 31.15 1nyq h GLU 397 CO 0.01 -0.43 -0.44 1.49 -2.18 0.00 0.00 179.01 177.45 1nyq h GLU 398 N -0.67 -1.10 -1.07 1.92 4.57 -1.41 -2.47 114.58 114.34 1nyq h GLU 398 Ca -0.05 0.08 0.31 0.00 -1.18 0.00 0.00 59.36 58.51 1nyq h GLU 398 Cb 0.55 0.25 -0.04 0.00 -0.16 0.00 0.00 28.75 29.35 1nyq h GLU 398 CO 0.03 -0.74 1.14 0.35 -1.18 0.00 0.00 179.01 178.61 1nyq h PHE 399 N -1.15 0.00 0.11 0.92 3.57 -1.64 0.60 116.94 119.35 1nyq h PHE 399 Ca -0.10 0.00 -0.14 0.00 3.53 0.00 0.00 57.97 61.25 1nyq h PHE 399 Cb 0.91 0.00 0.02 0.00 2.79 0.00 0.00 35.95 39.66 1nyq h PHE 399 CO -0.07 0.00 -0.63 0.87 -2.23 0.00 0.00 178.31 176.24 1nyq h LYS 400 N 0.00 0.23 -0.35 1.11 1.57 -0.93 -3.02 116.57 115.18 1nyq h LYS 400 Ca 0.51 -0.40 0.04 0.00 -1.87 0.00 0.00 60.65 58.94 1nyq h LYS 400 Cb 2.78 0.15 -0.08 0.00 0.08 0.00 0.00 32.23 35.16 1nyq h LYS 400 CO -0.01 1.19 -0.53 0.00 -0.57 0.00 0.00 179.45 179.54 1nyq h ARG 401 N -0.51 -0.39 -0.44 3.15 3.08 0.28 0.18 114.38 119.73 1nyq h ARG 401 Ca -0.11 0.03 0.09 0.00 0.07 0.00 0.00 59.98 60.06 1nyq h ARG 401 Cb 1.50 0.09 -0.09 0.00 0.08 0.00 0.00 29.97 31.54 1nyq h ARG 401 CO 0.12 -0.26 -0.21 -0.24 -1.07 0.00 0.00 179.97 178.31 1nyq h VAL 402 N -0.40 0.38 -0.40 2.04 3.04 -1.63 0.49 116.25 119.76 1nyq h VAL 402 Ca 0.06 0.00 0.06 0.00 -1.01 0.00 0.00 66.70 65.82 1nyq h VAL 402 Cb 0.58 0.38 -0.02 0.00 -2.01 0.00 0.00 31.29 30.22 1nyq h VAL 402 CO -0.54 0.00 0.27 0.58 -1.01 0.00 0.00 177.57 176.87 1nyq h VAL 403 N -0.12 0.94 0.00 1.51 2.07 -0.94 0.63 116.25 120.34 1nyq h VAL 403 Ca 0.21 -0.09 -0.18 0.00 0.82 0.00 0.00 66.70 67.46 1nyq h VAL 403 Cb 0.45 0.65 -0.03 0.00 -1.52 0.00 0.00 31.29 30.84 1nyq h VAL 403 CO -0.51 0.05 -0.85 0.78 0.02 0.00 0.00 177.57 177.05 1nyq h ASN 404 N 0.27 0.00 -0.09 0.57 4.21 0.24 -1.44 115.58 119.33 1nyq h ASN 404 Ca 0.18 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.69 1nyq h ASN 404 Cb 0.37 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 37.56 1nyq h ASN 404 CO -0.04 0.85 0.06 -0.03 -1.29 0.00 0.00 177.43 176.98 1nyq h MET 405 N 0.00 0.12 -0.33 0.81 4.05 0.14 0.93 114.93 120.64 1nyq h MET 405 Ca -0.01 -0.01 0.06 0.00 -0.28 0.00 0.00 59.70 59.46 1nyq h MET 405 Cb 1.66 -0.03 -0.05 0.00 -0.80 0.00 0.00 31.60 32.38 1nyq h MET 405 CO 0.11 0.08 0.01 0.82 0.23 0.00 0.00 176.91 178.16 1nyq h ILE 406 N 0.12 0.76 0.48 1.77 2.04 -0.90 0.44 117.51 122.22 1nyq h ILE 406 Ca 0.03 -0.04 -0.02 0.00 1.00 0.00 0.00 64.86 65.84 1nyq h ILE 406 Cb -0.01 0.65 0.00 0.00 -0.74 0.00 0.00 36.82 36.72 1nyq h ILE 406 CO -0.01 0.02 -0.26 0.40 0.00 0.00 0.00 178.15 178.30 1nyq h ILE 407 N 0.10 0.47 -0.17 -0.67 2.04 -0.39 -2.08 117.51 116.81 1nyq h ILE 407 Ca 0.16 0.00 0.05 0.00 1.00 0.00 0.00 64.86 66.07 1nyq h ILE 407 Cb 0.22 0.47 -0.01 0.00 -0.74 0.00 0.00 36.82 36.76 1nyq h ILE 407 CO -0.26 0.00 0.16 0.44 0.00 0.00 0.00 178.15 178.48 1nyq h ASP 408 N -0.68 0.00 0.22 1.72 5.19 0.15 -1.98 116.42 121.03 1nyq h ASP 408 Ca -0.06 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.34 1nyq h ASP 408 Cb 0.54 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.05 1nyq h ASP 408 CO 0.09 0.00 -0.11 0.58 -3.12 0.00 0.00 179.24 176.68 1nyq h VAL 409 N 0.00 0.76 -1.13 -1.35 2.07 0.40 -2.86 116.25 114.14 1nyq h VAL 409 Ca 0.08 -0.91 0.32 0.00 0.82 0.00 0.00 66.70 67.02 1nyq h VAL 409 Cb 0.39 1.21 -0.10 0.00 -1.52 0.00 0.00 31.29 31.27 1nyq h VAL 409 CO -0.00 0.17 0.73 1.88 0.02 0.00 0.00 177.57 180.37 1nyq h TYR 410 N -0.83 0.59 0.00 1.57 -1.99 -0.71 2.21 116.97 117.81 1nyq h TYR 410 Ca -0.03 0.02 0.00 0.00 2.00 0.00 0.00 58.73 60.72 1nyq h TYR 410 Cb 0.51 -0.16 0.00 0.00 2.00 0.00 0.00 36.73 39.08 1nyq h TYR 410 CO 0.06 -0.03 0.00 -0.22 -0.00 0.00 0.00 178.16 177.97 1nyq h LYS 411 N 0.28 0.00 0.00 4.88 3.64 -1.22 0.12 116.57 124.26 1nyq h LYS 411 Ca 0.66 0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.96 1nyq h LYS 411 Cb 1.86 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.67 1nyq h LYS 411 CO -0.33 0.00 -1.31 -0.25 -2.27 0.00 0.00 179.45 175.30 1nyq n ASP 412 N -2.92 0.76 -0.65 4.20 8.00 0.74 -3.91 116.55 122.77 1nyq n ASP 412 Ca -0.02 0.31 0.08 0.00 0.71 0.00 0.00 54.79 55.88 1nyq n ASP 412 Cb 0.11 0.47 0.07 0.00 -0.02 0.00 0.00 41.12 41.74 1nyq n ASP 412 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1nyq n PHE 413 N -2.74 0.00 -2.05 1.24 3.72 -0.85 -4.95 117.46 111.83 1nyq n PHE 413 Ca -0.06 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.22 1nyq n PHE 413 Cb 0.70 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 39.22 1nyq n PHE 413 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1nyq n GLY 414 N 0.93 0.17 3.63 1.37 0.00 0.30 -4.98 105.19 106.61 1nyq n GLY 414 Ca 0.09 -0.39 -0.43 0.00 0.00 0.00 0.00 46.02 45.29 1nyq n GLY 414 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1nyq s PHE 415 N -2.58 3.08 -0.07 1.61 0.08 -0.57 -4.85 117.98 114.69 1nyq s PHE 415 Ca 0.00 1.11 0.03 0.00 0.12 0.00 0.00 56.93 58.19 1nyq s PHE 415 Cb 0.00 -3.81 -0.06 0.00 -0.57 0.00 0.00 43.02 38.58 1nyq s PHE 415 CO 0.00 -0.88 -0.03 -1.91 -0.10 0.00 0.00 175.22 172.30 1nyq n GLU 416 N 7.03 1.34 -2.41 0.44 0.00 -1.26 -4.62 120.64 121.15 1nyq n GLU 416 Ca 0.12 0.03 -0.37 0.00 0.00 0.00 0.00 57.16 56.94 1nyq n GLU 416 Cb 0.47 -1.16 -0.04 0.00 0.00 0.00 0.00 31.44 30.71 1nyq n GLU 416 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 1nyq s ASP 417 N -4.38 6.08 -0.02 4.31 1.11 -1.26 -4.91 116.67 117.59 1nyq s ASP 417 Ca -0.08 -1.13 -0.26 0.00 0.18 0.00 0.00 52.55 51.26 1nyq s ASP 417 Cb 0.02 -2.57 0.06 0.00 1.07 0.00 0.00 42.92 41.51 1nyq s ASP 417 CO 0.22 -1.89 0.58 -0.72 1.18 0.00 0.00 175.17 174.55 1nyq s TYR 418 N 6.52 -0.53 0.46 4.23 1.13 -1.26 -4.66 117.35 123.24 1nyq s TYR 418 Ca 0.52 0.85 0.01 0.00 -1.41 0.00 0.00 57.07 57.04 1nyq s TYR 418 Cb -0.03 0.34 0.01 0.00 -1.10 0.00 0.00 41.96 41.19 1nyq s TYR 418 CO -0.05 -0.58 0.11 -1.13 -2.51 0.00 0.00 175.55 171.39 1nyq n SER 419 N 0.87 3.05 -4.73 -0.18 3.41 -0.98 -4.99 113.62 110.07 1nyq n SER 419 Ca -0.19 -2.90 -0.31 0.00 -0.26 0.00 0.00 58.87 55.20 1nyq n SER 419 Cb 0.58 0.21 -0.08 0.00 -0.26 0.00 0.00 64.21 64.65 1nyq n SER 419 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 1nyq s PHE 420 N -2.57 2.04 -0.30 7.33 0.40 -1.23 -1.93 117.98 121.71 1nyq s PHE 420 Ca 0.08 -0.87 -0.17 0.00 -0.60 0.00 0.00 56.93 55.37 1nyq s PHE 420 Cb -0.01 -1.67 0.21 0.00 0.51 0.00 0.00 43.02 42.07 1nyq s PHE 420 CO 0.05 0.27 1.31 0.50 0.70 0.00 0.00 175.22 178.05 1nyq s ARG 421 N -3.85 0.00 -0.27 0.44 3.52 -1.13 -3.69 118.95 113.98 1nyq s ARG 421 Ca 0.14 0.00 -0.10 0.00 -0.13 0.00 0.00 55.73 55.64 1nyq s ARG 421 Cb 0.04 0.00 -0.05 0.00 -1.56 0.00 0.00 34.95 33.38 1nyq s ARG 421 CO 0.08 -0.00 0.17 -0.51 -0.81 0.00 0.00 175.30 174.22 1nyq s LEU 422 N 1.32 3.98 0.06 -0.88 1.02 -1.26 -1.23 118.68 121.69 1nyq s LEU 422 Ca -0.05 -0.00 -0.19 0.00 0.02 0.00 0.00 54.13 53.91 1nyq s LEU 422 Cb -0.01 -2.09 -0.06 0.00 0.02 0.00 0.00 46.19 44.04 1nyq s LEU 422 CO -0.11 -0.02 0.55 -0.44 0.02 0.00 0.00 176.35 176.35 1nyq s SER 423 N 1.56 7.02 0.00 2.29 0.01 -0.24 -2.59 113.70 121.76 1nyq s SER 423 Ca 0.07 1.22 0.00 0.00 1.31 0.00 0.00 55.95 58.55 1nyq s SER 423 Cb -0.15 -2.35 0.00 0.00 0.21 0.00 0.00 66.02 63.73 1nyq s SER 423 CO 0.09 0.27 0.00 -1.22 0.41 0.00 0.00 173.24 172.79 1nyq n TYR 424 N 1.80 0.00 -1.50 2.43 4.01 -0.98 -3.32 117.16 119.60 1nyq n TYR 424 Ca -0.11 0.00 -0.30 0.00 -0.16 0.00 0.00 57.90 57.34 1nyq n TYR 424 Cb 0.51 0.00 0.11 0.00 -0.31 0.00 0.00 39.34 39.65 1nyq n TYR 424 CO 0.00 0.00 0.00 -0.98 -0.46 0.00 0.00 176.86 175.42 1nyq s ARG 425 N 1.26 1.73 0.00 -0.72 1.70 -1.26 -4.22 118.95 117.44 1nyq s ARG 425 Ca 0.00 0.57 0.00 0.00 -0.47 0.00 0.00 55.73 55.83 1nyq s ARG 425 Cb 0.00 -1.88 0.00 0.00 -0.57 0.00 0.00 34.95 32.50 1nyq s ARG 425 CO 0.00 -1.85 0.00 -0.25 -1.08 0.00 0.00 175.30 172.12 1nyq n ASP 426 N -3.58 0.00 -2.75 -2.89 8.00 -1.26 -3.03 116.55 111.05 1nyq n ASP 426 Ca 0.07 0.00 -0.39 0.00 0.71 0.00 0.00 54.79 55.18 1nyq n ASP 426 Cb 0.57 0.00 -0.07 0.00 -0.02 0.00 0.00 41.12 41.60 1nyq n ASP 426 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 1nyq n PRO 427 N -0.92 0.00 -4.77 -0.24 -0.04 -1.26 -4.83 135.00 122.94 1nyq n PRO 427 Ca 0.00 0.00 -0.33 0.00 -0.04 0.00 0.00 63.50 63.13 1nyq n PRO 427 Cb 0.00 -0.93 -0.07 0.00 -0.04 0.00 0.00 33.50 32.45 1nyq n PRO 427 CO 0.00 0.00 0.00 -1.83 -0.04 0.00 0.00 175.50 173.63 1nyq s GLU 428 N 3.15 2.22 0.00 0.54 4.04 -1.26 -4.51 118.70 122.88 1nyq s GLU 428 Ca 0.72 -2.44 0.00 0.00 0.04 0.00 0.00 54.97 53.29 1nyq s GLU 428 Cb -0.93 -1.43 0.00 0.00 0.02 0.00 0.00 34.13 31.78 1nyq s GLU 428 CO 0.44 -0.43 0.00 -3.47 -1.84 0.00 0.00 175.26 169.97 1nyq n ASP 429 N -1.33 0.00 0.00 0.83 -0.08 -1.26 -4.83 116.55 109.88 1nyq n ASP 429 Ca -0.21 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.07 1nyq n ASP 429 Cb 0.67 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.13 1nyq n ASP 429 CO 0.00 0.00 0.00 1.17 0.12 0.00 0.00 177.20 178.49 1nyq n LYS 430 N 0.00 -1.33 0.00 -0.67 4.81 -1.26 -4.42 118.16 115.29 1nyq n LYS 430 Ca 0.00 0.00 0.06 0.00 -0.87 0.00 0.00 58.31 57.50 1nyq n LYS 430 Cb 0.00 0.00 0.28 0.00 0.02 0.00 0.00 35.03 35.33 1nyq n LYS 430 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 1nyq n GLU 431 N -0.26 0.07 -2.93 1.64 2.13 -1.26 -4.77 120.64 115.25 1nyq n GLU 431 Ca 0.00 0.24 -0.18 0.00 0.66 0.00 0.00 57.16 57.88 1nyq n GLU 431 Cb 0.00 -1.50 0.02 0.00 0.27 0.00 0.00 31.44 30.23 1nyq n GLU 431 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 1nyq s LYS 432 N -2.84 2.76 -0.35 5.31 -0.14 -1.26 -5.01 119.74 118.21 1nyq s LYS 432 Ca 0.08 -1.16 0.06 0.00 -1.36 0.00 0.00 55.97 53.59 1nyq s LYS 432 Cb 0.08 -2.70 0.45 0.00 -1.68 0.00 0.00 37.83 33.98 1nyq s LYS 432 CO 0.21 -0.37 1.27 0.66 -0.76 0.00 0.00 175.35 176.35 1nyq n TYR 433 N -1.96 2.88 0.00 3.18 4.01 -1.26 -4.53 117.16 119.47 1nyq n TYR 433 Ca 0.08 -2.40 0.00 0.00 -0.16 0.00 0.00 57.90 55.42 1nyq n TYR 433 Cb 0.59 -0.42 0.00 0.00 -0.31 0.00 0.00 39.34 39.21 1nyq n TYR 433 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 1nyq n PHE 434 N -0.70 0.00 -1.20 -0.72 7.35 -1.26 -4.99 117.46 115.95 1nyq n PHE 434 Ca 0.45 0.00 -0.07 0.00 -0.76 0.00 0.00 57.45 57.07 1nyq n PHE 434 Cb 0.90 0.00 -0.03 0.00 0.35 0.00 0.00 39.48 40.70 1nyq n PHE 434 CO 0.00 0.00 0.00 -0.25 -0.76 0.00 0.00 176.76 175.75 1nyq n ASP 435 N -1.14 -4.49 -1.86 -2.13 8.00 -1.26 -4.06 116.55 109.60 1nyq n ASP 435 Ca 0.00 0.17 -0.03 0.00 0.71 0.00 0.00 54.79 55.64 1nyq n ASP 435 Cb 0.00 -2.60 0.00 0.00 -0.02 0.00 0.00 41.12 38.50 1nyq n ASP 435 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1nyq n ASP 436 N -0.14 -0.45 0.26 -2.24 -0.08 -1.26 -4.72 116.55 107.92 1nyq n ASP 436 Ca -0.07 -0.05 0.13 0.00 -1.51 0.00 0.00 54.79 53.29 1nyq n ASP 436 Cb 0.34 -0.14 0.69 0.00 2.34 0.00 0.00 41.12 44.35 1nyq n ASP 436 CO 0.00 0.00 0.00 0.44 0.12 0.00 0.00 177.20 177.76 1nyq h ASP 437 N 0.51 0.00 0.07 1.67 5.19 -1.97 -2.91 116.42 118.97 1nyq h ASP 437 Ca -0.05 0.00 -0.00 0.00 -0.62 0.00 0.00 57.03 56.35 1nyq h ASP 437 Cb 0.12 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.63 1nyq h ASP 437 CO 0.03 0.13 -0.03 0.44 -3.12 0.00 0.00 179.24 176.68 1nyq h ASP 438 N 0.00 -0.07 -0.01 6.45 5.19 -1.93 -2.31 116.42 123.74 1nyq h ASP 438 Ca -0.00 -0.37 0.01 0.00 -0.62 0.00 0.00 57.03 56.05 1nyq h ASP 438 Cb 0.42 0.02 -0.03 0.00 0.18 0.00 0.00 39.33 39.92 1nyq h ASP 438 CO 0.02 0.35 -0.32 -0.03 -3.12 0.00 0.00 179.24 176.13 1nyq h MET 439 N -0.51 -0.38 -0.32 3.56 4.05 -1.87 -0.70 114.93 118.75 1nyq h MET 439 Ca -0.01 0.03 0.03 0.00 -0.28 0.00 0.00 59.70 59.47 1nyq h MET 439 Cb 0.44 0.09 -0.04 0.00 -0.80 0.00 0.00 31.60 31.29 1nyq h MET 439 CO 0.01 -0.25 -0.25 -1.49 0.23 0.00 0.00 176.91 175.16 1nyq h TRP 440 N -0.40 -0.79 -0.87 1.39 4.06 -1.60 0.69 115.95 118.43 1nyq h TRP 440 Ca 0.01 0.05 0.19 0.00 2.06 0.00 0.00 58.89 61.20 1nyq h TRP 440 Cb 0.43 0.38 -0.16 0.00 -1.00 0.00 0.00 29.16 28.81 1nyq h TRP 440 CO -0.46 -0.18 -0.14 -0.97 -3.56 0.00 0.00 178.44 173.12 1nyq h ASN 441 N -0.08 -0.68 -0.24 -3.49 -1.24 -1.32 0.23 115.58 108.76 1nyq h ASN 441 Ca 0.05 0.25 -0.00 0.00 0.71 0.00 0.00 56.30 57.31 1nyq h ASN 441 Cb 0.21 0.50 -0.01 0.00 0.73 0.00 0.00 38.32 39.75 1nyq h ASN 441 CO -0.34 -0.28 0.14 0.50 -1.29 0.00 0.00 177.43 176.16 1nyq h LYS 442 N 0.02 0.33 0.41 6.67 3.64 0.64 -3.02 116.57 125.26 1nyq h LYS 442 Ca 0.45 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.77 1nyq h LYS 442 Cb 0.75 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.51 1nyq h LYS 442 CO -0.86 0.28 -0.20 0.00 -2.27 0.00 0.00 179.45 176.40 1nyq h ALA 443 N 1.03 -0.82 -0.08 5.00 0.00 0.30 -2.55 119.26 122.13 1nyq h ALA 443 Ca 0.09 -0.12 0.02 0.00 0.00 0.00 0.00 54.91 54.90 1nyq h ALA 443 Cb 0.04 0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 1nyq h ALA 443 CO -0.02 -0.78 0.47 0.93 0.00 0.00 0.00 179.25 179.85 1nyq h GLU 444 N -0.74 0.00 0.04 0.00 5.08 -0.81 0.39 114.58 118.54 1nyq h GLU 444 Ca -0.06 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.15 1nyq h GLU 444 Cb 0.42 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.66 1nyq h GLU 444 CO 0.09 0.00 -0.79 -0.97 -1.00 0.00 0.00 179.01 176.34 1nyq h ASN 445 N 0.00 0.13 -0.57 1.42 -0.00 -1.54 -1.34 115.58 113.68 1nyq h ASN 445 Ca 0.04 -0.81 0.08 0.00 -0.00 0.00 0.00 56.30 55.61 1nyq h ASN 445 Cb 0.97 -0.04 -0.03 0.00 -0.00 0.00 0.00 38.32 39.21 1nyq h ASN 445 CO -0.00 1.33 0.38 -0.03 -0.00 0.00 0.00 177.43 179.11 1nyq h MET 446 N -0.79 0.44 0.09 6.67 4.05 -0.33 0.37 114.93 125.43 1nyq h MET 446 Ca -0.19 -0.03 -0.00 0.00 -0.28 0.00 0.00 59.70 59.20 1nyq h MET 446 Cb 1.33 -0.10 0.00 0.00 -0.80 0.00 0.00 31.60 32.03 1nyq h MET 446 CO -0.04 0.29 -0.04 1.25 0.23 0.00 0.00 176.91 178.60 1nyq h LEU 447 N 0.45 -0.10 -0.97 3.39 7.12 -0.44 -2.15 115.31 122.62 1nyq h LEU 447 Ca 0.26 0.00 0.26 0.00 0.13 0.00 0.00 57.88 58.53 1nyq h LEU 447 Cb 0.43 0.03 -0.13 0.00 -0.53 0.00 0.00 40.66 40.45 1nyq h LEU 447 CO -0.07 -0.05 0.51 0.50 -0.13 0.00 0.00 178.44 179.20 1nyq h LYS 448 N -0.17 0.42 -0.04 1.25 3.64 -0.96 0.52 116.57 121.22 1nyq h LYS 448 Ca -0.01 -0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1nyq h LYS 448 Cb 0.09 -0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 31.82 1nyq h LYS 448 CO 0.02 0.28 0.03 0.93 -2.27 0.00 0.00 179.45 178.43 1nyq h GLU 449 N 0.43 0.06 -0.01 1.90 5.08 -0.32 -0.17 114.58 121.56 1nyq h GLU 449 Ca 0.64 -0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.93 1nyq h GLU 449 Cb 1.30 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.53 1nyq h GLU 449 CO -0.54 0.07 -0.30 0.00 -1.00 0.00 0.00 179.01 177.24 1nyq h ALA 450 N 0.99 1.49 -0.56 3.43 0.00 -0.28 0.66 119.26 124.99 1nyq h ALA 450 Ca 0.02 -0.28 0.02 0.00 0.00 0.00 0.00 54.91 54.67 1nyq h ALA 450 Cb 0.02 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 1nyq h ALA 450 CO -0.00 0.38 0.35 0.00 0.00 0.00 0.00 179.25 179.98 1nyq h ALA 451 N 1.69 0.72 0.02 0.00 0.00 0.88 -3.10 119.26 119.47 1nyq h ALA 451 Ca -0.00 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1nyq h ALA 451 Cb 0.54 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1nyq h ALA 451 CO 0.04 0.08 -0.01 -0.44 0.00 0.00 0.00 179.25 178.92 1nyq h ASP 452 N 0.69 -0.02 -0.37 0.00 3.32 0.16 -3.06 116.42 117.15 1nyq h ASP 452 Ca 0.22 -0.62 0.11 0.00 0.02 0.00 0.00 57.03 56.75 1nyq h ASP 452 Cb -0.00 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 1nyq h ASP 452 CO -0.09 0.63 0.64 -0.33 -1.72 0.00 0.00 179.24 178.37 1nyq h GLU 453 N -0.68 0.00 -0.14 3.56 5.08 -0.95 1.27 114.58 122.72 1nyq h GLU 453 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1nyq h GLU 453 Cb 0.64 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.89 1nyq h GLU 453 CO 0.00 0.00 0.00 1.28 -1.00 0.00 0.00 179.01 179.29 1nyq n LEU 454 N -3.22 1.57 -1.99 1.33 4.77 -1.17 -4.92 117.00 113.36 1nyq n LEU 454 Ca 0.07 -0.64 -0.20 0.00 -0.03 0.00 0.00 56.01 55.21 1nyq n LEU 454 Cb 0.79 -0.09 -0.04 0.00 -2.33 0.00 0.00 43.42 41.75 1nyq n LEU 454 CO 0.19 0.32 -0.23 0.61 -1.33 0.00 0.00 177.39 176.95 1nyq n GLY 455 N 1.12 0.57 3.83 -0.72 0.00 0.44 -4.97 105.19 105.46 1nyq n GLY 455 Ca 0.17 -0.03 -0.30 0.00 0.00 0.00 0.00 46.02 45.85 1nyq n GLY 455 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1nyq s LEU 456 N -5.31 2.64 -0.31 0.99 1.02 -1.16 -5.06 118.68 111.48 1nyq s LEU 456 Ca 0.00 1.19 0.01 0.00 0.02 0.00 0.00 54.13 55.35 1nyq s LEU 456 Cb 0.00 -3.83 0.10 0.00 0.02 0.00 0.00 46.19 42.47 1nyq s LEU 456 CO 0.00 -1.82 0.07 -0.44 0.02 0.00 0.00 176.35 174.18 1nyq s SER 457 N -4.09 4.19 0.08 2.29 0.01 -1.26 -4.86 113.70 110.05 1nyq s SER 457 Ca 0.60 -1.72 0.00 0.00 1.31 0.00 0.00 55.95 56.14 1nyq s SER 457 Cb -0.13 -1.09 0.00 0.00 0.21 0.00 0.00 66.02 65.00 1nyq s SER 457 CO 0.53 -0.39 0.00 0.00 0.41 0.00 0.00 173.24 173.79 1nyq n TYR 458 N 4.67 -2.59 -2.52 2.43 4.11 -1.26 -3.56 117.16 118.44 1nyq n TYR 458 Ca -0.01 0.00 0.01 0.00 -0.00 0.00 0.00 57.90 57.89 1nyq n TYR 458 Cb 0.42 0.00 0.02 0.00 -0.00 0.00 0.00 39.34 39.79 1nyq n TYR 458 CO 0.00 0.00 0.00 -1.91 -0.00 0.00 0.00 176.86 174.95 1nyq n GLU 459 N -0.84 0.57 0.00 -3.48 4.07 -1.24 -4.88 120.64 114.84 1nyq n GLU 459 Ca 0.00 -2.15 0.00 0.00 -0.06 0.00 0.00 57.16 54.95 1nyq n GLU 459 Cb 0.00 -0.29 0.00 0.00 -0.06 0.00 0.00 31.44 31.09 1nyq n GLU 459 CO 0.00 0.00 0.00 0.39 -0.06 0.00 0.00 177.13 177.46 1nyq n GLU 460 N -0.06 0.00 -4.15 5.31 1.02 -1.26 -4.83 120.64 116.67 1nyq n GLU 460 Ca -0.02 0.00 -0.15 0.00 -0.02 0.00 0.00 57.16 56.97 1nyq n GLU 460 Cb 0.96 0.00 -0.13 0.00 -0.02 0.00 0.00 31.44 32.25 1nyq n GLU 460 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1nyq s ALA 461 N 0.00 0.55 0.18 0.62 0.00 -1.07 -4.96 121.76 117.08 1nyq s ALA 461 Ca 0.00 -0.47 -0.04 0.00 0.00 0.00 0.00 51.96 51.45 1nyq s ALA 461 Cb 0.00 -0.06 -0.05 0.00 0.00 0.00 0.00 23.12 23.00 1nyq s ALA 461 CO 0.00 0.07 0.41 0.96 0.00 0.00 0.00 175.76 177.21 1nyq s ILE 462 N -0.62 5.14 -1.08 0.00 -4.36 -1.26 -2.32 121.20 116.69 1nyq s ILE 462 Ca -0.02 -0.00 -0.04 0.00 -0.26 0.00 0.00 60.65 60.32 1nyq s ILE 462 Cb -0.05 -3.66 0.00 0.00 1.25 0.00 0.00 42.46 40.01 1nyq s ILE 462 CO 0.00 -0.05 0.59 0.61 0.24 0.00 0.00 174.94 176.33 1nyq n GLY 463 N -0.19 -0.17 0.00 6.27 0.00 -1.17 -4.86 105.19 105.08 1nyq n GLY 463 Ca -0.02 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.92 1nyq n GLY 463 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1nyq n GLU 464 N -3.35 3.50 -1.69 1.61 -0.58 -1.23 -4.97 120.64 113.92 1nyq n GLU 464 Ca -0.05 0.00 -0.31 0.00 -0.42 0.00 0.00 57.16 56.38 1nyq n GLU 464 Cb 0.57 -0.65 0.04 0.00 -0.57 0.00 0.00 31.44 30.83 1nyq n GLU 464 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1nyq s ALA 465 N -1.20 2.75 0.92 0.62 0.00 -1.25 -4.84 121.76 118.76 1nyq s ALA 465 Ca 0.00 0.11 -0.11 0.00 0.00 0.00 0.00 51.96 51.95 1nyq s ALA 465 Cb 0.00 -3.17 0.15 0.00 0.00 0.00 0.00 23.12 20.10 1nyq s ALA 465 CO 0.00 -1.07 1.09 0.00 0.00 0.00 0.00 175.76 175.78 1nyq s ALA 466 N -2.97 1.32 0.18 0.00 0.00 -1.10 -4.72 121.76 114.48 1nyq s ALA 466 Ca 0.58 0.06 -0.05 0.00 0.00 0.00 0.00 51.96 52.56 1nyq s ALA 466 Cb -0.14 -3.25 0.09 0.00 0.00 0.00 0.00 23.12 19.82 1nyq s ALA 466 CO 0.52 -2.57 1.50 0.27 0.00 0.00 0.00 175.76 175.48 1nyq h PHE 467 N -1.71 0.79 0.00 0.00 -5.15 -1.88 -3.03 116.94 105.96 1nyq h PHE 467 Ca -0.50 -0.27 0.00 0.00 -0.20 0.00 0.00 57.97 57.01 1nyq h PHE 467 Cb 1.28 -0.15 0.00 0.00 0.22 0.00 0.00 35.95 37.30 1nyq h PHE 467 CO 0.43 1.02 0.00 2.48 -2.00 0.00 0.00 178.31 180.24 1nyq n TYR 468 N -3.98 0.81 -0.74 6.09 4.11 -1.26 -4.51 117.16 117.67 1nyq n TYR 468 Ca -0.03 0.28 0.00 0.00 -0.00 0.00 0.00 57.90 58.15 1nyq n TYR 468 Cb 0.59 -0.96 0.00 0.00 -0.00 0.00 0.00 39.34 38.97 1nyq n TYR 468 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 1nyq n GLY 469 N 0.53 -1.53 3.90 -7.48 0.00 -1.15 -4.21 105.19 95.26 1nyq n GLY 469 Ca 0.04 -1.06 -0.29 0.00 0.00 0.00 0.00 46.02 44.71 1nyq n GLY 469 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1nyq s PRO 470 N -1.67 2.35 -0.18 1.61 0.04 -1.18 -2.71 135.00 133.26 1nyq s PRO 470 Ca 0.00 0.15 -0.27 0.00 0.04 0.00 0.00 61.00 60.92 1nyq s PRO 470 Cb 0.00 -2.03 0.07 0.00 0.04 0.00 0.00 34.50 32.57 1nyq s PRO 470 CO 0.00 -1.29 0.69 -1.59 0.04 0.00 0.00 177.00 174.84 1nyq s LYS 471 N -5.41 0.90 -0.46 4.56 -2.85 -1.21 -1.32 119.74 113.95 1nyq s LYS 471 Ca 0.60 0.70 -0.20 0.00 -1.00 0.00 0.00 55.97 56.07 1nyq s LYS 471 Cb -0.11 0.43 0.03 0.00 -2.06 0.00 0.00 37.83 36.13 1nyq s LYS 471 CO 0.49 -0.18 0.64 -1.17 0.10 0.00 0.00 175.35 175.23 1nyq s LEU 472 N -0.22 4.64 -0.29 2.77 2.96 0.60 -1.08 118.68 128.07 1nyq s LEU 472 Ca -0.04 -0.54 -0.10 0.00 -0.22 0.00 0.00 54.13 53.23 1nyq s LEU 472 Cb -0.03 -2.62 -0.03 0.00 0.50 0.00 0.00 46.19 44.01 1nyq s LEU 472 CO 0.04 -0.83 0.16 -1.81 -1.32 0.00 0.00 176.35 172.59 1nyq s ASP 473 N 2.24 5.66 -0.24 3.68 1.01 -0.36 -1.02 116.67 127.64 1nyq s ASP 473 Ca 0.20 -0.30 -0.26 0.00 0.71 0.00 0.00 52.55 52.90 1nyq s ASP 473 Cb -0.16 -2.04 0.00 0.00 1.01 0.00 0.00 42.92 41.74 1nyq s ASP 473 CO 0.16 -0.12 0.90 -0.69 0.21 0.00 0.00 175.17 175.63 1nyq s VAL 474 N 1.67 4.78 0.25 -1.27 1.01 -0.84 -2.83 120.40 123.17 1nyq s VAL 474 Ca 0.06 1.73 0.05 0.00 0.00 0.00 0.00 61.98 63.82 1nyq s VAL 474 Cb -0.16 -4.18 -0.03 0.00 0.00 0.00 0.00 36.38 32.00 1nyq s VAL 474 CO 0.08 -0.11 0.35 -1.10 0.00 0.00 0.00 175.10 174.31 1nyq s GLN 475 N 2.97 3.32 0.13 2.72 -1.52 -0.81 -1.91 119.66 124.56 1nyq s GLN 475 Ca 0.38 -0.84 -0.19 0.00 -1.95 0.00 0.00 55.36 52.76 1nyq s GLN 475 Cb -0.15 -2.83 0.05 0.00 -0.22 0.00 0.00 33.01 29.86 1nyq s GLN 475 CO 0.07 0.38 0.49 0.54 -0.25 0.00 0.00 175.29 176.52 1nyq s VAL 476 N -2.03 0.04 -0.17 1.09 0.11 -0.17 -2.33 120.40 116.94 1nyq s VAL 476 Ca 0.35 -0.32 -0.08 0.00 -2.93 0.00 0.00 61.98 59.00 1nyq s VAL 476 Cb -0.09 -1.08 -0.04 0.00 -1.53 0.00 0.00 36.38 33.63 1nyq s VAL 476 CO 0.29 -0.18 0.10 -0.54 -3.33 0.00 0.00 175.10 171.44 1nyq s LYS 477 N -3.67 3.92 0.00 1.54 3.01 -1.26 0.18 119.74 123.46 1nyq s LYS 477 Ca 0.01 -0.26 0.00 0.00 -1.01 0.00 0.00 55.97 54.72 1nyq s LYS 477 Cb 0.01 -3.27 0.00 0.00 -1.01 0.00 0.00 37.83 33.55 1nyq s LYS 477 CO -0.12 0.40 0.00 2.41 0.51 0.00 0.00 175.35 178.55 1nyq n THR 478 N 3.18 0.00 -2.24 2.17 -1.04 -1.26 -4.79 114.28 110.30 1nyq n THR 478 Ca -0.17 0.00 -0.26 0.00 -2.04 0.00 0.00 64.05 61.58 1nyq n THR 478 Cb 0.53 0.00 0.01 0.00 -1.82 0.00 0.00 70.33 69.05 1nyq n THR 478 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1nyq n ALA 479 N -3.00 5.06 -1.82 2.41 0.00 -1.26 -3.98 120.51 117.92 1nyq n ALA 479 Ca 0.00 -4.05 0.00 0.00 0.00 0.00 0.00 53.44 49.39 1nyq n ALA 479 Cb 0.00 -0.44 0.00 0.00 0.00 0.00 0.00 19.45 19.01 1nyq n ALA 479 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1nyq n MET 480 N -0.60 0.00 0.00 0.00 2.81 -1.26 -4.68 117.12 113.39 1nyq n MET 480 Ca 0.42 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 56.31 1nyq n MET 480 Cb 0.81 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 33.32 1nyq n MET 480 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1nyq n GLY 481 N 0.00 0.09 3.13 3.03 0.00 -1.26 -4.79 105.19 105.40 1nyq n GLY 481 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.96 1nyq n GLY 481 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1nyq n LYS 482 N -0.26 0.01 -1.12 1.61 0.00 -1.26 -4.19 118.16 112.95 1nyq n LYS 482 Ca 0.00 -0.35 -0.42 0.00 0.00 0.00 0.00 58.31 57.54 1nyq n LYS 482 Cb 0.00 -1.59 -0.05 0.00 0.00 0.00 0.00 35.03 33.39 1nyq n LYS 482 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 1nyq n GLU 483 N 5.11 0.00 -4.29 1.64 -0.58 -1.26 -4.07 120.64 117.20 1nyq n GLU 483 Ca 0.10 0.00 -0.16 0.00 -0.42 0.00 0.00 57.16 56.68 1nyq n GLU 483 Cb 0.43 -0.99 -0.09 0.00 -0.57 0.00 0.00 31.44 30.21 1nyq n GLU 483 CO 0.00 0.00 0.00 -1.83 -0.48 0.00 0.00 177.13 174.82 1nyq s GLU 484 N -0.31 1.46 -0.29 3.49 -1.05 0.13 -4.94 118.70 117.19 1nyq s GLU 484 Ca 0.61 -1.81 -0.12 0.00 -0.15 0.00 0.00 54.97 53.51 1nyq s GLU 484 Cb -0.87 0.03 -0.04 0.00 -0.44 0.00 0.00 34.13 32.81 1nyq s GLU 484 CO 0.43 -0.43 0.21 0.99 0.95 0.00 0.00 175.26 177.42 1nyq s THR 485 N -3.78 5.30 0.00 1.83 2.01 -1.26 -1.00 115.64 118.74 1nyq s THR 485 Ca 0.38 0.13 0.00 0.00 0.31 0.00 0.00 61.69 62.51 1nyq s THR 485 Cb 0.06 -3.57 0.00 0.00 0.01 0.00 0.00 72.50 69.00 1nyq s THR 485 CO 0.16 0.20 0.00 -0.11 -0.69 0.00 0.00 174.62 174.18 1nyq n LEU 486 N 5.09 1.43 -4.96 4.42 7.94 -0.80 -4.97 117.00 125.14 1nyq n LEU 486 Ca -0.13 0.06 -0.23 0.00 -1.11 0.00 0.00 56.01 54.59 1nyq n LEU 486 Cb 0.52 -0.10 0.07 0.00 0.53 0.00 0.00 43.42 44.43 1nyq n LEU 486 CO 0.34 -0.10 0.51 -0.94 -1.11 0.00 0.00 177.39 176.08 1nyq s SER 487 N -1.50 4.84 -0.30 1.96 1.04 -1.20 -4.22 113.70 114.33 1nyq s SER 487 Ca 0.00 0.08 -0.17 0.00 0.48 0.00 0.00 55.95 56.34 1nyq s SER 487 Cb 0.00 -0.74 0.18 0.00 0.10 0.00 0.00 66.02 65.56 1nyq s SER 487 CO 0.00 -1.51 1.14 0.28 0.98 0.00 0.00 173.24 174.13 1nyq s THR 488 N -3.05 -0.17 -0.11 2.02 -1.32 -0.07 -1.99 115.64 110.95 1nyq s THR 488 Ca 0.61 0.00 -0.02 0.00 -1.21 0.00 0.00 61.69 61.06 1nyq s THR 488 Cb -0.09 -1.00 -0.03 0.00 -1.51 0.00 0.00 72.50 69.87 1nyq s THR 488 CO 0.42 0.00 -0.02 0.00 -2.21 0.00 0.00 174.62 172.82 1nyq s ALA 489 N 1.84 3.16 0.03 11.08 0.00 -0.19 -0.92 121.76 136.75 1nyq s ALA 489 Ca -0.04 -0.82 0.04 0.00 0.00 0.00 0.00 51.96 51.14 1nyq s ALA 489 Cb -0.03 -1.50 -0.02 0.00 0.00 0.00 0.00 23.12 21.57 1nyq s ALA 489 CO -0.15 0.43 -0.12 -0.65 0.00 0.00 0.00 175.76 175.27 1nyq s GLN 490 N -0.38 0.84 -0.40 0.00 -0.21 1.91 -0.29 119.66 121.14 1nyq s GLN 490 Ca 0.07 -0.64 -0.13 0.00 0.02 0.00 0.00 55.36 54.67 1nyq s GLN 490 Cb -0.12 -0.82 0.03 0.00 1.00 0.00 0.00 33.01 33.10 1nyq s GLN 490 CO 0.02 0.20 0.26 -1.17 -2.12 0.00 0.00 175.29 172.48 1nyq s LEU 491 N -0.94 4.95 -0.25 2.90 2.96 -0.43 0.32 118.68 128.19 1nyq s LEU 491 Ca 0.01 -0.99 0.01 0.00 -0.22 0.00 0.00 54.13 52.94 1nyq s LEU 491 Cb -0.07 -2.09 0.06 0.00 0.50 0.00 0.00 46.19 44.59 1nyq s LEU 491 CO 0.01 -0.43 -0.05 -0.62 -1.32 0.00 0.00 176.35 173.93 1nyq s ASP 492 N 1.67 4.02 0.00 3.68 2.15 -0.52 -3.13 116.67 124.54 1nyq s ASP 492 Ca 0.03 -1.30 0.22 0.00 0.43 0.00 0.00 52.55 51.94 1nyq s ASP 492 Cb -0.19 -1.26 -0.15 0.00 -0.30 0.00 0.00 42.92 41.02 1nyq s ASP 492 CO 0.08 -0.24 0.91 0.49 -0.17 0.00 0.00 175.17 176.23 1nyq n PHE 493 N 4.61 0.03 0.13 -5.34 3.01 -1.26 -1.94 117.46 116.71 1nyq n PHE 493 Ca -0.11 0.01 -0.06 0.00 1.01 0.00 0.00 57.45 58.30 1nyq n PHE 493 Cb 0.43 -0.14 -0.03 0.00 -0.01 0.00 0.00 39.48 39.74 1nyq n PHE 493 CO 0.00 0.00 0.00 1.25 1.01 0.00 0.00 176.76 179.02 1nyq h LEU 494 N 0.00 -0.34 -0.94 4.37 6.46 -1.93 -3.34 115.31 119.59 1nyq h LEU 494 Ca 0.00 0.01 0.16 0.00 -0.12 0.00 0.00 57.88 57.93 1nyq h LEU 494 Cb 0.59 0.09 -0.10 0.00 -0.73 0.00 0.00 40.66 40.51 1nyq h LEU 494 CO 0.00 0.01 0.54 -0.07 -0.62 0.00 0.00 178.44 178.29 1nyq h LEU 495 N -0.90 0.69 -0.27 2.25 4.07 -1.89 0.19 115.31 119.45 1nyq h LEU 495 Ca -0.04 0.09 0.02 0.00 0.08 0.00 0.00 57.88 58.03 1nyq h LEU 495 Cb 0.31 -0.03 -0.02 0.00 1.08 0.00 0.00 40.66 42.00 1nyq h LEU 495 CO 0.07 0.28 0.13 -0.65 -1.08 0.00 0.00 178.44 177.18 1nyq h PRO 496 N 0.73 0.27 0.11 1.13 0.11 -1.83 0.34 132.00 132.86 1nyq h PRO 496 Ca 0.52 -0.02 0.02 0.00 0.11 0.00 0.00 66.00 66.63 1nyq h PRO 496 Cb 0.74 -0.06 -0.05 0.00 0.11 0.00 0.00 31.00 31.75 1nyq h PRO 496 CO -0.36 0.18 -0.40 1.49 -0.21 0.00 0.00 178.00 178.70 1nyq h GLU 497 N 0.28 -0.61 -1.00 1.05 4.22 -1.21 1.01 114.58 118.32 1nyq h GLU 497 Ca 0.11 0.04 0.10 0.00 0.08 0.00 0.00 59.36 59.69 1nyq h GLU 497 Cb 0.03 0.14 -0.08 0.00 0.50 0.00 0.00 28.75 29.34 1nyq h GLU 497 CO -0.08 -0.40 0.64 0.00 -2.18 0.00 0.00 179.01 176.99 1nyq h ARG 498 N -0.63 1.01 -0.00 1.92 3.08 -0.45 -1.04 114.38 118.27 1nyq h ARG 498 Ca 0.03 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.01 1nyq h ARG 498 Cb 0.66 -0.23 0.00 0.00 0.08 0.00 0.00 29.97 30.48 1nyq h ARG 498 CO -0.24 0.67 -0.27 1.19 -1.07 0.00 0.00 179.97 180.25 1nyq n PHE 499 N -4.58 0.00 -3.26 3.04 3.01 0.12 -4.93 117.46 110.86 1nyq n PHE 499 Ca 0.18 0.00 -0.18 0.00 1.01 0.00 0.00 57.45 58.46 1nyq n PHE 499 Cb 0.30 -0.27 0.06 0.00 -0.01 0.00 0.00 39.48 39.56 1nyq n PHE 499 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 1nyq n ASP 500 N -1.25 -5.31 -4.76 4.37 2.03 0.34 -4.97 116.55 107.00 1nyq n ASP 500 Ca 0.09 -0.38 -0.40 0.00 0.52 0.00 0.00 54.79 54.61 1nyq n ASP 500 Cb 0.32 -3.95 -0.04 0.00 -0.72 0.00 0.00 41.12 36.73 1nyq n ASP 500 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1nyq s LEU 501 N -5.72 4.54 0.08 -2.67 1.43 -0.34 -5.02 118.68 110.98 1nyq s LEU 501 Ca 0.41 2.25 -0.16 0.00 -1.03 0.00 0.00 54.13 55.61 1nyq s LEU 501 Cb -0.18 -3.62 0.03 0.00 0.03 0.00 0.00 46.19 42.44 1nyq s LEU 501 CO 0.51 -0.16 0.37 0.42 0.23 0.00 0.00 176.35 177.72 1nyq s THR 502 N -1.00 0.07 -0.05 5.49 -4.23 -1.26 -4.01 115.64 110.65 1nyq s THR 502 Ca 0.45 -0.61 0.00 0.00 -1.18 0.00 0.00 61.69 60.36 1nyq s THR 502 Cb -0.32 -1.07 0.02 0.00 1.34 0.00 0.00 72.50 72.48 1nyq s THR 502 CO 0.40 -0.33 -0.02 -0.72 -0.54 0.00 0.00 174.62 173.41 1nyq s TYR 503 N -3.12 0.61 -0.46 3.99 1.13 -0.18 -4.44 117.35 114.88 1nyq s TYR 503 Ca -0.01 -0.14 -0.28 0.00 -1.41 0.00 0.00 57.07 55.23 1nyq s TYR 503 Cb 0.01 -0.62 -0.08 0.00 -1.10 0.00 0.00 41.96 40.17 1nyq s TYR 503 CO -0.07 -0.20 2.38 -0.89 -2.51 0.00 0.00 175.55 174.26 1nyq n ILE 504 N 4.30 0.04 -0.33 -3.49 5.41 -0.77 -2.56 119.36 121.96 1nyq n ILE 504 Ca -0.22 -0.61 -0.30 0.00 1.00 0.00 0.00 62.75 62.62 1nyq n ILE 504 Cb 0.51 -2.46 0.29 0.00 -0.71 0.00 0.00 39.64 37.26 1nyq n ILE 504 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1nyq n GLY 505 N 6.05 -3.81 0.04 7.39 0.00 -1.10 -1.26 105.19 112.49 1nyq n GLY 505 Ca 0.38 -1.32 -0.12 0.00 0.00 0.00 0.00 46.02 44.96 1nyq n GLY 505 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1nyq h GLN 506 N 0.00 -0.01 0.00 1.61 4.15 -1.92 -3.31 115.11 115.64 1nyq h GLN 506 Ca -0.39 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.03 1nyq h GLN 506 Cb 1.31 0.00 0.00 0.00 0.21 0.00 0.00 27.48 29.00 1nyq h GLN 506 CO 0.24 0.05 0.00 -0.40 -1.93 0.00 0.00 178.83 176.79 1nyq n ASP 507 N -5.07 0.00 0.00 -0.69 5.68 -1.26 -4.94 116.55 110.27 1nyq n ASP 507 Ca -0.07 0.97 0.00 0.00 -0.50 0.00 0.00 54.79 55.18 1nyq n ASP 507 Cb 0.06 -0.47 0.00 0.00 -1.14 0.00 0.00 41.12 39.57 1nyq n ASP 507 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1nyq n GLY 508 N -0.97 0.00 3.81 6.12 0.00 -1.25 -5.15 105.19 107.76 1nyq n GLY 508 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 1nyq n GLY 508 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1nyq s GLU 509 N 0.00 4.25 -0.70 1.61 0.41 -1.26 -4.73 118.70 118.28 1nyq s GLU 509 Ca 0.00 0.83 -0.26 0.00 -0.41 0.00 0.00 54.97 55.13 1nyq s GLU 509 Cb 0.00 -3.00 -0.07 0.00 -1.78 0.00 0.00 34.13 29.28 1nyq s GLU 509 CO 0.00 0.47 2.16 -1.01 -0.49 0.00 0.00 175.26 176.40 1nyq s HIS 510 N -1.39 1.41 0.62 1.61 3.76 -1.26 -2.72 115.29 117.31 1nyq s HIS 510 Ca 0.39 1.26 -0.09 0.00 -0.15 0.00 0.00 55.06 56.47 1nyq s HIS 510 Cb -0.18 -3.78 -0.01 0.00 1.11 0.00 0.00 32.58 29.73 1nyq s HIS 510 CO 0.21 -2.04 0.98 -1.01 -0.85 0.00 0.00 174.74 172.03 1nyq s HIS 511 N 11.60 3.40 0.02 1.40 3.76 -1.06 -4.84 115.29 129.58 1nyq s HIS 511 Ca 0.82 0.95 -0.03 0.00 -0.15 0.00 0.00 55.06 56.65 1nyq s HIS 511 Cb -0.12 -2.79 -0.04 0.00 1.11 0.00 0.00 32.58 30.74 1nyq s HIS 511 CO 0.14 -0.84 0.22 1.03 -0.85 0.00 0.00 174.74 174.44 1nyq s ARG 512 N -5.12 3.49 0.23 1.40 0.52 -1.26 -1.01 118.95 117.19 1nyq s ARG 512 Ca 0.55 -0.28 0.02 0.00 -0.52 0.00 0.00 55.73 55.50 1nyq s ARG 512 Cb -0.11 -3.06 -0.04 0.00 0.52 0.00 0.00 34.95 32.27 1nyq s ARG 512 CO 0.49 0.64 0.39 -1.25 0.02 0.00 0.00 175.30 175.59 1nyq s PRO 513 N -2.10 3.47 0.09 3.54 0.04 -1.26 -4.66 135.00 134.13 1nyq s PRO 513 Ca 0.30 -0.52 0.06 0.00 0.04 0.00 0.00 61.00 60.88 1nyq s PRO 513 Cb -0.13 -2.85 -0.04 0.00 0.04 0.00 0.00 34.50 31.53 1nyq s PRO 513 CO 0.21 0.39 -0.04 0.08 0.04 0.00 0.00 177.00 177.68 1nyq s VAL 514 N -1.96 3.76 -0.14 -0.36 1.01 0.71 -4.67 120.40 118.76 1nyq s VAL 514 Ca 0.37 -1.08 0.00 0.00 0.00 0.00 0.00 61.98 61.27 1nyq s VAL 514 Cb -0.10 -2.77 -0.01 0.00 0.00 0.00 0.00 36.38 33.50 1nyq s VAL 514 CO 0.30 0.13 -0.15 -0.69 0.00 0.00 0.00 175.10 174.70 1nyq s VAL 515 N -1.26 2.83 -0.32 2.92 1.01 -0.82 0.51 120.40 125.28 1nyq s VAL 515 Ca 0.24 -0.73 -0.11 0.00 0.00 0.00 0.00 61.98 61.38 1nyq s VAL 515 Cb -0.11 -2.19 -0.02 0.00 0.00 0.00 0.00 36.38 34.06 1nyq s VAL 515 CO 0.16 0.52 0.19 -0.63 0.00 0.00 0.00 175.10 175.34 1nyq s ILE 516 N 0.56 4.99 -0.05 2.22 1.01 0.14 -1.44 121.20 128.63 1nyq s ILE 516 Ca -0.09 -0.25 -0.14 0.00 0.00 0.00 0.00 60.65 60.17 1nyq s ILE 516 Cb -0.16 -3.52 -0.05 0.00 0.01 0.00 0.00 42.46 38.74 1nyq s ILE 516 CO 0.04 0.06 0.37 -1.00 0.00 0.00 0.00 174.94 174.41 1nyq s HIS 517 N 1.68 3.65 -0.07 3.97 3.76 0.15 -0.68 115.29 127.76 1nyq s HIS 517 Ca 0.06 0.88 -0.24 0.00 -0.15 0.00 0.00 55.06 55.61 1nyq s HIS 517 Cb -0.17 -2.29 0.05 0.00 1.11 0.00 0.00 32.58 31.28 1nyq s HIS 517 CO 0.09 0.54 0.54 -0.98 -0.85 0.00 0.00 174.74 174.07 1nyq s ARG 518 N -0.64 0.86 -0.12 1.40 1.04 -1.19 0.51 118.95 120.81 1nyq s ARG 518 Ca 0.22 0.20 -0.00 0.00 -1.04 0.00 0.00 55.73 55.10 1nyq s ARG 518 Cb -0.15 0.40 0.03 0.00 -2.04 0.00 0.00 34.95 33.18 1nyq s ARG 518 CO 0.11 -0.24 -0.08 0.20 -0.04 0.00 0.00 175.30 175.25 1nyq s GLY 519 N -0.99 0.86 0.00 3.88 0.00 -0.10 -3.23 107.32 107.75 1nyq s GLY 519 Ca -0.10 -0.59 0.00 0.00 0.00 0.00 0.00 44.72 44.03 1nyq s GLY 519 CO 0.07 0.79 0.00 -0.62 0.00 0.00 0.00 173.10 173.34 1nyq n VAL 520 N 4.93 0.00 0.19 1.40 0.31 -1.22 -0.89 118.33 123.04 1nyq n VAL 520 Ca -0.13 0.46 -0.06 0.00 -0.01 0.00 0.00 64.34 64.60 1nyq n VAL 520 Cb 0.50 -1.42 0.09 0.00 -0.91 0.00 0.00 33.84 32.10 1nyq n VAL 520 CO 0.00 0.00 0.00 0.55 -1.32 0.00 0.00 176.83 176.06 1nyq n VAL 521 N -2.14 1.65 -4.21 2.52 3.14 -1.26 -4.21 118.33 113.82 1nyq n VAL 521 Ca 0.00 -0.68 0.00 0.00 -2.96 0.00 0.00 64.34 60.70 1nyq n VAL 521 Cb 0.00 -0.71 0.00 0.00 -1.06 0.00 0.00 33.84 32.07 1nyq n VAL 521 CO 0.00 0.00 0.00 -0.24 -6.46 0.00 0.00 176.83 170.13 1nyq n SER 522 N -0.04 -0.98 -4.89 6.55 2.88 -1.26 -4.58 113.62 111.30 1nyq n SER 522 Ca 0.20 0.00 -0.30 0.00 -1.33 0.00 0.00 58.87 57.44 1nyq n SER 522 Cb 0.87 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 64.29 1nyq n SER 522 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 1nyq s THR 523 N 0.00 4.98 0.27 2.46 -4.23 -1.26 -0.92 115.64 116.94 1nyq s THR 523 Ca 0.00 0.23 -0.01 0.00 -1.18 0.00 0.00 61.69 60.73 1nyq s THR 523 Cb 0.00 -3.69 0.12 0.00 1.34 0.00 0.00 72.50 70.27 1nyq s THR 523 CO 0.00 -0.25 1.78 0.24 -0.54 0.00 0.00 174.62 175.85 1nyq h MET 524 N 1.95 0.76 0.92 3.99 2.86 -1.40 0.34 114.93 124.34 1nyq h MET 524 Ca -0.47 -0.19 -0.04 0.00 -2.06 0.00 0.00 59.70 56.93 1nyq h MET 524 Cb 1.18 -0.09 0.00 0.00 0.06 0.00 0.00 31.60 32.75 1nyq h MET 524 CO 0.67 0.76 -0.49 0.93 1.06 0.00 0.00 176.91 179.84 1nyq h GLU 525 N 0.72 -1.25 -0.22 1.72 3.07 -1.81 0.21 114.58 117.03 1nyq h GLU 525 Ca 0.14 0.09 -0.10 0.00 -0.50 0.00 0.00 59.36 58.99 1nyq h GLU 525 Cb 0.42 0.28 -0.01 0.00 -0.84 0.00 0.00 28.75 28.60 1nyq h GLU 525 CO 0.02 -0.83 -0.28 -0.09 -1.40 0.00 0.00 179.01 176.42 1nyq h ARG 526 N -1.29 0.43 -0.47 2.33 2.43 -1.33 0.11 114.38 116.58 1nyq h ARG 526 Ca -0.12 -0.17 -0.13 0.00 -0.81 0.00 0.00 59.98 58.75 1nyq h ARG 526 Cb 1.01 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.53 1nyq h ARG 526 CO 0.17 0.67 -0.22 0.35 -1.51 0.00 0.00 179.97 179.44 1nyq h PHE 527 N 0.37 1.13 0.00 2.20 3.57 -0.17 0.63 116.94 124.67 1nyq h PHE 527 Ca 0.05 -0.28 -0.07 0.00 3.53 0.00 0.00 57.97 61.20 1nyq h PHE 527 Cb 0.69 -0.26 -0.01 0.00 2.79 0.00 0.00 35.95 39.16 1nyq h PHE 527 CO 0.02 1.10 -0.35 0.28 -2.23 0.00 0.00 178.31 177.13 1nyq h VAL 528 N 0.83 0.64 0.10 1.41 2.07 -0.48 0.15 116.25 120.97 1nyq h VAL 528 Ca 0.11 -1.75 -0.01 0.00 0.82 0.00 0.00 66.70 65.87 1nyq h VAL 528 Cb 0.79 2.20 0.00 0.00 -1.52 0.00 0.00 31.29 32.76 1nyq h VAL 528 CO 0.07 0.34 -0.05 0.00 0.02 0.00 0.00 177.57 177.95 1nyq h ALA 529 N 1.65 -1.00 -0.26 1.67 0.00 -0.47 -1.82 119.26 119.02 1nyq h ALA 529 Ca -0.00 -0.03 0.06 0.00 0.00 0.00 0.00 54.91 54.94 1nyq h ALA 529 Cb 1.17 0.05 -0.07 0.00 0.00 0.00 0.00 17.79 18.94 1nyq h ALA 529 CO 0.05 -0.99 -0.29 0.35 0.00 0.00 0.00 179.25 178.36 1nyq h PHE 530 N -0.14 -0.79 -0.50 0.00 3.57 -0.91 -2.76 116.94 115.41 1nyq h PHE 530 Ca -0.01 0.04 0.10 0.00 3.53 0.00 0.00 57.97 61.63 1nyq h PHE 530 Cb 0.11 0.39 -0.10 0.00 2.79 0.00 0.00 35.95 39.13 1nyq h PHE 530 CO 0.20 -0.36 -0.14 1.25 -2.23 0.00 0.00 178.31 177.03 1nyq h LEU 531 N -0.29 -0.52 -0.48 0.59 5.85 -0.74 0.14 115.31 119.86 1nyq h LEU 531 Ca 0.14 0.16 0.09 0.00 0.84 0.00 0.00 57.88 59.10 1nyq h LEU 531 Cb 0.51 0.33 -0.10 0.00 0.37 0.00 0.00 40.66 41.77 1nyq h LEU 531 CO -0.42 -0.18 -0.35 0.74 -0.34 0.00 0.00 178.44 177.89 1nyq h THR 532 N -0.02 0.18 -0.36 1.05 2.02 -1.03 -0.54 112.91 114.22 1nyq h THR 532 Ca 0.24 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.42 1nyq h THR 532 Cb 0.39 0.18 -0.02 0.00 -1.74 0.00 0.00 68.15 66.96 1nyq h THR 532 CO -0.53 0.00 0.23 -0.33 0.37 0.00 0.00 175.52 175.26 1nyq h GLU 533 N -0.23 0.48 -0.07 6.66 5.08 -1.12 0.68 114.58 126.07 1nyq h GLU 533 Ca 0.19 -0.04 0.02 0.00 -1.00 0.00 0.00 59.36 58.53 1nyq h GLU 533 Cb 0.55 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.69 1nyq h GLU 533 CO -0.60 0.34 0.06 1.49 -1.00 0.00 0.00 179.01 179.30 1nyq h GLU 534 N 0.47 0.00 -0.14 2.33 4.57 0.16 -1.19 114.58 120.78 1nyq h GLU 534 Ca 0.13 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.31 1nyq h GLU 534 Cb -0.02 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.57 1nyq h GLU 534 CO -0.03 0.00 0.00 0.25 -1.18 0.00 0.00 179.01 178.05 1nyq n THR 535 N -4.08 0.25 -1.54 0.32 -2.24 -0.30 -4.94 114.28 101.75 1nyq n THR 535 Ca -0.01 -0.62 -0.19 0.00 -2.27 0.00 0.00 64.05 60.96 1nyq n THR 535 Cb 0.16 1.14 -0.08 0.00 -2.10 0.00 0.00 70.33 69.45 1nyq n THR 535 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1nyq n LYS 536 N 0.94 -1.47 0.00 -0.78 5.02 0.22 -0.74 118.16 121.35 1nyq n LYS 536 Ca 0.11 1.13 0.00 0.00 -2.02 0.00 0.00 58.31 57.53 1nyq n LYS 536 Cb 0.44 -5.50 0.00 0.00 -0.02 0.00 0.00 35.03 29.95 1nyq n LYS 536 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1nyq n GLY 537 N -0.28 1.13 2.76 0.72 0.00 -0.02 -4.96 105.19 104.54 1nyq n GLY 537 Ca -0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.42 1nyq n GLY 537 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nyq n ALA 538 N -1.45 5.75 -1.65 4.61 0.00 0.08 -4.86 120.51 123.00 1nyq n ALA 538 Ca 0.00 -4.26 -0.42 0.00 0.00 0.00 0.00 53.44 48.77 1nyq n ALA 538 Cb 0.00 -2.93 0.01 0.00 0.00 0.00 0.00 19.45 16.53 1nyq n ALA 538 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1nyq n PHE 539 N 3.30 1.59 -1.89 0.00 3.72 -1.26 -4.91 117.46 118.00 1nyq n PHE 539 Ca 0.46 0.55 -0.40 0.00 -0.05 0.00 0.00 57.45 58.01 1nyq n PHE 539 Cb 0.33 -2.29 0.01 0.00 -0.94 0.00 0.00 39.48 36.58 1nyq n PHE 539 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 1nyq s PRO 540 N -2.04 3.86 0.11 -1.08 0.04 -1.26 -4.35 135.00 130.29 1nyq s PRO 540 Ca 0.62 2.35 -0.19 0.00 0.04 0.00 0.00 61.00 63.81 1nyq s PRO 540 Cb -0.55 -2.75 -0.02 0.00 0.04 0.00 0.00 34.50 31.22 1nyq s PRO 540 CO 0.58 -0.65 1.00 2.41 0.04 0.00 0.00 177.00 180.37 1nyq n THR 541 N 0.03 -0.43 0.27 1.26 -1.04 -1.26 -0.68 114.28 112.44 1nyq n THR 541 Ca 0.04 1.56 0.11 0.00 -2.04 0.00 0.00 64.05 63.72 1nyq n THR 541 Cb 0.42 -1.94 0.60 0.00 -1.82 0.00 0.00 70.33 67.59 1nyq n THR 541 CO 0.00 0.00 0.00 4.11 -0.64 0.00 0.00 175.07 178.54 1nyq h TRP 542 N 0.00 0.00 0.00 -1.42 5.08 -1.84 -2.34 115.95 115.43 1nyq h TRP 542 Ca 0.12 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.09 1nyq h TRP 542 Cb 0.28 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.44 1nyq h TRP 542 CO -0.65 0.00 -0.10 1.28 -1.28 0.00 0.00 178.44 177.69 1nyq n LEU 543 N -2.55 0.19 0.00 0.11 4.77 0.14 -4.95 117.00 114.71 1nyq n LEU 543 Ca -0.01 0.03 0.00 0.00 -0.03 0.00 0.00 56.01 56.00 1nyq n LEU 543 Cb 0.39 -0.52 0.00 0.00 -2.33 0.00 0.00 43.42 40.96 1nyq n LEU 543 CO 0.10 -0.48 0.00 0.00 -1.33 0.00 0.00 177.39 175.68 1nyq n ALA 544 N -2.69 0.00 -0.20 -1.18 0.00 -0.34 -4.65 120.51 111.44 1nyq n ALA 544 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1nyq n ALA 544 Cb 0.05 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.50 1nyq n ALA 544 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1nyq n PRO 545 N 0.00 0.00 -3.65 0.00 -0.02 -1.26 -3.78 135.00 126.28 1nyq n PRO 545 Ca 0.00 0.72 -0.39 0.00 -2.02 0.00 0.00 63.50 61.80 1nyq n PRO 545 Cb 0.00 -1.12 -0.12 0.00 -0.02 0.00 0.00 33.50 32.24 1nyq n PRO 545 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 1nyq s LYS 546 N -2.51 2.88 0.28 -0.52 2.20 -1.26 -4.89 119.74 115.92 1nyq s LYS 546 Ca 0.00 -1.03 0.07 0.00 -0.36 0.00 0.00 55.97 54.65 1nyq s LYS 546 Cb 0.00 -3.62 0.39 0.00 -1.51 0.00 0.00 37.83 33.09 1nyq s LYS 546 CO 0.00 -0.63 1.65 1.96 -0.36 0.00 0.00 175.35 177.97 1nyq h GLN 547 N 8.36 0.18 -3.58 4.03 4.20 -0.48 -3.41 115.11 124.42 1nyq h GLN 547 Ca -0.27 -0.10 -0.23 0.00 0.06 0.00 0.00 58.65 58.11 1nyq h GLN 547 Cb 1.11 0.01 -0.29 0.00 0.30 0.00 0.00 27.48 28.61 1nyq h GLN 547 CO 0.64 0.65 -0.67 0.08 -0.67 0.00 0.00 178.83 178.86 1nyq s VAL 548 N -3.94 -0.01 -0.45 -0.54 1.01 -0.63 -2.64 120.40 113.20 1nyq s VAL 548 Ca -0.04 0.04 0.03 0.00 0.00 0.00 0.00 61.98 62.01 1nyq s VAL 548 Cb 0.13 -0.09 0.12 0.00 0.00 0.00 0.00 36.38 36.55 1nyq s VAL 548 CO 0.78 0.01 0.21 -1.58 0.00 0.00 0.00 175.10 174.52 1nyq s GLN 549 N 0.22 1.60 0.19 2.72 2.00 0.21 -2.87 119.66 123.73 1nyq s GLN 549 Ca -0.02 -2.21 -0.30 0.00 -2.00 0.00 0.00 55.36 50.83 1nyq s GLN 549 Cb -0.02 -2.91 -0.09 0.00 0.80 0.00 0.00 33.01 30.79 1nyq s GLN 549 CO -0.01 -1.09 1.29 0.42 -0.50 0.00 0.00 175.29 175.41 1nyq s ILE 550 N 0.23 3.29 -0.09 -2.34 1.01 -0.74 -2.73 121.20 119.83 1nyq s ILE 550 Ca 0.16 1.05 0.02 0.00 0.00 0.00 0.00 60.65 61.88 1nyq s ILE 550 Cb -0.24 -3.67 0.01 0.00 0.01 0.00 0.00 42.46 38.57 1nyq s ILE 550 CO -0.03 0.15 -0.14 -0.63 0.00 0.00 0.00 174.94 174.29 1nyq s ILE 551 N 0.14 1.35 0.11 2.92 1.01 0.52 -2.07 121.20 125.18 1nyq s ILE 551 Ca 0.56 -0.58 -0.09 0.00 0.00 0.00 0.00 60.65 60.55 1nyq s ILE 551 Cb -0.36 -1.23 -0.06 0.00 0.01 0.00 0.00 42.46 40.83 1nyq s ILE 551 CO 0.37 0.41 0.41 -2.16 0.00 0.00 0.00 174.94 173.97 1nyq s PRO 552 N 0.79 3.73 -0.09 2.79 0.04 -1.26 0.23 135.00 141.23 1nyq s PRO 552 Ca -0.11 0.12 -0.23 0.00 0.04 0.00 0.00 61.00 60.82 1nyq s PRO 552 Cb -0.16 -2.92 -0.29 0.00 0.04 0.00 0.00 34.50 31.17 1nyq s PRO 552 CO 0.02 0.51 0.80 0.28 0.04 0.00 0.00 177.00 178.65 1nyq h VAL 553 N 2.57 1.53 -3.52 -0.36 2.07 -1.54 -3.40 116.25 113.60 1nyq h VAL 553 Ca -0.48 -2.46 -0.68 0.00 0.82 0.00 0.00 66.70 63.90 1nyq h VAL 553 Cb 1.18 3.18 -0.37 0.00 -1.52 0.00 0.00 31.29 33.76 1nyq h VAL 553 CO 0.68 0.67 -0.54 0.21 0.02 0.00 0.00 177.57 178.61 1nyq s ASN 554 N -6.75 4.98 0.00 0.57 3.84 -1.26 -4.98 114.94 111.33 1nyq s ASN 554 Ca -0.16 -2.50 0.00 0.00 0.21 0.00 0.00 52.86 50.40 1nyq s ASN 554 Cb 0.00 -1.76 0.00 0.00 -0.55 0.00 0.00 41.25 38.94 1nyq s ASN 554 CO 0.77 -0.40 0.00 0.52 -2.79 0.00 0.00 177.10 175.21 1nyq n VAL 555 N 3.90 0.00 1.09 -5.21 0.31 -1.26 0.21 118.33 117.36 1nyq n VAL 555 Ca 0.03 0.00 0.12 0.00 -0.01 0.00 0.00 64.34 64.48 1nyq n VAL 555 Cb 0.39 0.00 0.13 0.00 -0.91 0.00 0.00 33.84 33.45 1nyq n VAL 555 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 1nyq n ASP 556 N -3.19 1.60 -0.33 4.52 8.00 -1.26 -2.73 116.55 123.16 1nyq n ASP 556 Ca 0.00 -1.25 0.13 0.00 0.71 0.00 0.00 54.79 54.38 1nyq n ASP 556 Cb 0.00 0.37 0.31 0.00 -0.02 0.00 0.00 41.12 41.79 1nyq n ASP 556 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 1nyq n LEU 557 N -0.34 1.30 0.00 0.64 0.00 0.56 -4.26 117.00 114.91 1nyq n LEU 557 Ca 0.10 -0.39 0.00 0.00 0.00 0.00 0.00 56.01 55.72 1nyq n LEU 557 Cb 0.42 -0.08 0.00 0.00 0.00 0.00 0.00 43.42 43.75 1nyq n LEU 557 CO 0.28 0.24 0.01 1.41 0.00 0.00 0.00 177.39 179.33 1nyq n HIS 558 N -0.41 0.00 -0.04 1.96 8.25 0.48 -4.87 115.22 120.59 1nyq n HIS 558 Ca 0.12 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.46 1nyq n HIS 558 Cb 0.38 0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.42 1nyq n HIS 558 CO 0.00 0.00 0.00 -0.92 0.64 0.00 0.00 176.34 176.06 1nyq h TYR 559 N 0.00 0.24 -0.01 4.41 3.20 -1.69 -0.39 116.97 122.74 1nyq h TYR 559 Ca 0.00 -0.05 0.00 0.00 3.14 0.00 0.00 58.73 61.82 1nyq h TYR 559 Cb 0.52 -0.06 -0.00 0.00 1.54 0.00 0.00 36.73 38.73 1nyq h TYR 559 CO 0.00 0.52 0.37 -0.44 -1.64 0.00 0.00 178.16 176.96 1nyq h ASP 560 N -0.10 0.00 0.01 -2.11 5.19 -1.87 0.47 116.42 118.00 1nyq h ASP 560 Ca 0.03 0.00 -0.33 0.00 -0.62 0.00 0.00 57.03 56.11 1nyq h ASP 560 Cb 0.44 0.00 -0.05 0.00 0.18 0.00 0.00 39.33 39.90 1nyq h ASP 560 CO 0.01 0.00 -1.79 0.00 -3.12 0.00 0.00 179.24 174.34 1nyq n TYR 561 N -2.88 0.64 0.23 4.55 9.36 -0.90 -3.82 117.16 124.34 1nyq n TYR 561 Ca -0.02 0.26 0.09 0.00 3.32 0.00 0.00 57.90 61.56 1nyq n TYR 561 Cb 0.41 -1.07 0.53 0.00 -0.63 0.00 0.00 39.34 38.59 1nyq n TYR 561 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1nyq h ALA 562 N -0.64 1.18 0.00 2.98 0.00 -0.43 -0.94 119.26 121.41 1nyq h ALA 562 Ca -0.49 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.21 1nyq h ALA 562 Cb 1.46 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.22 1nyq h ALA 562 CO -0.28 0.29 0.00 -0.09 0.00 0.00 0.00 179.25 179.17 1nyq h ARG 563 N 0.00 0.00 0.00 0.00 1.12 -0.27 0.17 114.38 115.40 1nyq h ARG 563 Ca -0.00 0.00 -0.31 0.00 -1.11 0.00 0.00 59.98 58.56 1nyq h ARG 563 Cb 0.58 0.00 -0.06 0.00 -0.01 0.00 0.00 29.97 30.49 1nyq h ARG 563 CO 0.03 0.00 -1.94 1.04 -3.11 0.00 0.00 179.97 175.99 1nyq n GLN 564 N -2.50 0.65 0.17 0.20 1.13 -0.83 -2.89 117.38 113.31 1nyq n GLN 564 Ca 0.05 0.18 -0.14 0.00 -1.94 0.00 0.00 57.00 55.15 1nyq n GLN 564 Cb 0.43 -1.69 -0.08 0.00 0.11 0.00 0.00 30.24 29.00 1nyq n GLN 564 CO 0.00 0.00 0.00 1.25 -1.44 0.00 0.00 177.06 176.87 1nyq h LEU 565 N 0.00 -0.35 -0.11 1.08 5.85 -1.04 -1.49 115.31 119.25 1nyq h LEU 565 Ca -0.37 -0.13 0.01 0.00 0.84 0.00 0.00 57.88 58.23 1nyq h LEU 565 Cb 2.06 0.09 -0.01 0.00 0.37 0.00 0.00 40.66 43.17 1nyq h LEU 565 CO 0.06 -0.06 -0.08 -0.61 -0.34 0.00 0.00 178.44 177.41 1nyq h GLN 566 N -0.66 -0.02 -0.03 1.25 4.15 -0.77 0.13 115.11 119.16 1nyq h GLN 566 Ca -0.04 0.00 0.01 0.00 0.77 0.00 0.00 58.65 59.39 1nyq h GLN 566 Cb 0.46 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.16 1nyq h GLN 566 CO 0.07 -0.01 0.06 -0.44 -1.93 0.00 0.00 178.83 176.57 1nyq h ASP 567 N -0.02 0.00 0.07 -0.69 3.32 -1.57 0.26 116.42 117.79 1nyq h ASP 567 Ca 0.02 0.00 -0.17 0.00 0.02 0.00 0.00 57.03 56.90 1nyq h ASP 567 Cb 0.07 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.61 1nyq h ASP 567 CO -0.11 0.00 -0.60 -0.33 -1.72 0.00 0.00 179.24 176.48 1nyq h GLU 568 N 0.00 0.54 -0.17 3.56 5.08 0.26 -2.81 114.58 121.04 1nyq h GLU 568 Ca 0.01 -0.36 -0.13 0.00 -1.00 0.00 0.00 59.36 57.88 1nyq h GLU 568 Cb 0.13 0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.44 1nyq h GLU 568 CO -0.00 0.97 -0.41 -0.07 -1.00 0.00 0.00 179.01 178.50 1nyq h LEU 569 N 0.40 0.65 -0.86 1.33 3.38 0.16 -3.31 115.31 117.06 1nyq h LEU 569 Ca -0.00 -0.57 -0.06 0.00 0.09 0.00 0.00 57.88 57.34 1nyq h LEU 569 Cb 1.15 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.68 1nyq h LEU 569 CO 0.11 1.11 0.16 0.11 0.09 0.00 0.00 178.44 180.02 1nyq h LYS 570 N 0.23 1.00 0.00 1.13 1.57 -1.30 -0.48 116.57 118.73 1nyq h LYS 570 Ca -0.00 -0.22 0.00 0.00 -1.87 0.00 0.00 60.65 58.55 1nyq h LYS 570 Cb 1.02 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 33.19 1nyq h LYS 570 CO 0.09 0.89 0.08 -1.13 -0.57 0.00 0.00 179.45 178.81 1nyq n SER 571 N -4.25 0.00 -0.35 0.86 3.41 -1.06 0.22 113.62 112.45 1nyq n SER 571 Ca 0.05 0.30 0.08 0.00 -0.26 0.00 0.00 58.87 59.04 1nyq n SER 571 Cb 0.24 -0.30 0.18 0.00 -0.26 0.00 0.00 64.21 64.07 1nyq n SER 571 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1nyq n GLN 572 N -1.27 1.45 -3.58 4.33 1.13 -0.21 -4.97 117.38 114.26 1nyq n GLN 572 Ca 0.00 -2.94 -0.21 0.00 -1.94 0.00 0.00 57.00 51.91 1nyq n GLN 572 Cb 0.08 -1.57 0.07 0.00 0.11 0.00 0.00 30.24 28.93 1nyq n GLN 572 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1nyq n GLY 573 N -1.27 -0.40 3.96 1.08 0.00 0.59 -4.99 105.19 104.15 1nyq n GLY 573 Ca 0.18 0.15 -0.24 0.00 0.00 0.00 0.00 46.02 46.11 1nyq n GLY 573 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1nyq s VAL 574 N -3.42 5.29 -0.65 1.61 1.01 -1.06 -4.97 120.40 118.22 1nyq s VAL 574 Ca 0.20 -0.82 -0.09 0.00 0.00 0.00 0.00 61.98 61.27 1nyq s VAL 574 Cb -0.09 -3.80 0.17 0.00 0.00 0.00 0.00 36.38 32.66 1nyq s VAL 574 CO 0.76 -0.21 0.52 -0.13 0.00 0.00 0.00 175.10 176.05 1nyq s ARG 575 N -3.59 2.89 0.08 2.72 0.52 -1.26 -4.47 118.95 115.84 1nyq s ARG 575 Ca 0.34 -2.28 0.02 0.00 -0.52 0.00 0.00 55.73 53.29 1nyq s ARG 575 Cb -0.10 -4.03 -0.04 0.00 0.52 0.00 0.00 34.95 31.30 1nyq s ARG 575 CO 0.29 -1.22 -0.07 0.54 0.02 0.00 0.00 175.30 174.86 1nyq s VAL 576 N 0.44 0.65 0.24 3.52 0.11 -1.26 0.05 120.40 124.16 1nyq s VAL 576 Ca 0.14 -1.70 -0.12 0.00 -2.93 0.00 0.00 61.98 57.37 1nyq s VAL 576 Cb -0.19 -1.38 -0.01 0.00 -1.53 0.00 0.00 36.38 33.27 1nyq s VAL 576 CO -0.04 -0.74 0.45 -0.94 -3.33 0.00 0.00 175.10 170.50 1nyq s SER 577 N -2.63 -0.07 -0.14 3.54 1.04 -1.14 -5.00 113.70 109.30 1nyq s SER 577 Ca 0.06 -0.97 0.01 0.00 0.48 0.00 0.00 55.95 55.53 1nyq s SER 577 Cb 0.01 0.57 -0.00 0.00 0.10 0.00 0.00 66.02 66.70 1nyq s SER 577 CO -0.03 -1.12 -0.17 -0.63 0.98 0.00 0.00 173.24 172.27 1nyq s ILE 578 N -4.03 2.51 -1.15 -1.02 1.01 -1.26 -1.79 121.20 115.47 1nyq s ILE 578 Ca 0.24 -0.83 -0.10 0.00 0.00 0.00 0.00 60.65 59.96 1nyq s ILE 578 Cb -0.00 -2.04 -0.07 0.00 0.01 0.00 0.00 42.46 40.36 1nyq s ILE 578 CO 0.09 0.53 2.33 -0.67 0.00 0.00 0.00 174.94 177.22 1nyq n ASP 579 N 3.97 5.50 -1.24 3.58 -0.08 -0.88 -4.71 116.55 122.70 1nyq n ASP 579 Ca -0.19 -2.51 0.00 0.00 -1.51 0.00 0.00 54.79 50.58 1nyq n ASP 579 Cb 0.52 -1.29 0.00 0.00 2.34 0.00 0.00 41.12 42.69 1nyq n ASP 579 CO 0.00 0.00 0.00 -0.67 0.12 0.00 0.00 177.20 176.65 1nyq n ASP 580 N 4.76 2.23 -4.97 1.67 2.03 -1.26 -4.78 116.55 116.23 1nyq n ASP 580 Ca 0.56 -1.40 -0.22 0.00 0.52 0.00 0.00 54.79 54.25 1nyq n ASP 580 Cb 0.23 -0.42 0.04 0.00 -0.72 0.00 0.00 41.12 40.25 1nyq n ASP 580 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 1nyq s ARG 581 N 0.55 2.56 -0.77 -0.67 0.52 -1.26 -5.04 118.95 114.84 1nyq s ARG 581 Ca 0.00 -0.69 -0.12 0.00 -0.52 0.00 0.00 55.73 54.40 1nyq s ARG 581 Cb 0.00 -2.46 0.20 0.00 0.52 0.00 0.00 34.95 33.21 1nyq s ARG 581 CO 0.00 -0.72 0.69 1.21 0.02 0.00 0.00 175.30 176.50 1nyq s ASN 582 N -4.41 6.44 0.04 0.23 3.04 -1.26 -4.96 114.94 114.06 1nyq s ASN 582 Ca 0.57 -2.68 -0.27 0.00 0.04 0.00 0.00 52.86 50.52 1nyq s ASN 582 Cb -0.10 -2.14 0.08 0.00 -1.54 0.00 0.00 41.25 37.54 1nyq s ASN 582 CO 0.39 -0.55 0.69 -1.61 -3.04 0.00 0.00 177.10 172.98 1nyq s GLU 583 N 0.19 1.10 0.34 0.43 0.41 -1.26 -5.15 118.70 114.77 1nyq s GLU 583 Ca 0.17 -0.12 -0.27 0.00 -0.41 0.00 0.00 54.97 54.33 1nyq s GLU 583 Cb -0.13 0.51 -0.09 0.00 -1.78 0.00 0.00 34.13 32.64 1nyq s GLU 583 CO -0.07 -0.42 1.16 0.15 -0.49 0.00 0.00 175.26 175.58 1nyq s LYS 584 N -2.49 4.35 0.26 1.61 -0.14 -1.26 -4.78 119.74 117.29 1nyq s LYS 584 Ca -0.04 1.87 -0.03 0.00 -1.36 0.00 0.00 55.97 56.41 1nyq s LYS 584 Cb -0.01 -2.94 0.53 0.00 -1.68 0.00 0.00 37.83 33.74 1nyq s LYS 584 CO -0.02 -0.07 1.67 1.98 -0.76 0.00 0.00 175.35 178.14 1nyq h MET 585 N 3.22 0.23 -0.96 1.68 1.85 -1.93 0.16 114.93 119.17 1nyq h MET 585 Ca -0.48 -0.01 0.31 0.00 -0.61 0.00 0.00 59.70 58.91 1nyq h MET 585 Cb 1.22 -0.05 -0.16 0.00 0.43 0.00 0.00 31.60 33.04 1nyq h MET 585 CO 0.65 0.15 0.40 0.78 -0.40 0.00 0.00 176.91 178.49 1nyq h GLY 586 N 0.24 1.80 1.50 1.39 0.00 -2.00 0.51 103.07 106.50 1nyq h GLY 586 Ca 0.46 -0.12 -0.29 0.00 0.00 0.00 0.00 47.33 47.38 1nyq h GLY 586 CO -0.57 -0.52 -1.34 -1.82 0.00 0.00 0.00 176.54 172.29 1nyq h TYR 587 N 0.19 0.52 0.00 5.60 3.20 -1.11 -2.84 116.97 122.54 1nyq h TYR 587 Ca 0.69 -0.38 0.00 0.00 3.14 0.00 0.00 58.73 62.18 1nyq h TYR 587 Cb 1.56 -0.02 0.00 0.00 1.54 0.00 0.00 36.73 39.81 1nyq h TYR 587 CO -0.14 1.33 0.00 1.63 -1.64 0.00 0.00 178.16 179.34 1nyq n LYS 588 N -3.52 0.24 0.00 1.82 5.02 0.17 -2.67 118.16 119.22 1nyq n LYS 588 Ca -0.11 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.18 1nyq n LYS 588 Cb 1.04 -1.03 0.00 0.00 -0.02 0.00 0.00 35.03 35.02 1nyq n LYS 588 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 1nyq n ILE 589 N -0.30 0.00 0.25 -0.18 5.41 -0.64 -4.44 119.36 119.46 1nyq n ILE 589 Ca 0.00 0.00 0.12 0.00 1.00 0.00 0.00 62.75 63.87 1nyq n ILE 589 Cb 0.01 -0.23 0.63 0.00 -0.71 0.00 0.00 39.64 39.35 1nyq n ILE 589 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 176.55 176.63 1nyq h ARG 590 N 0.00 0.00 0.00 0.38 0.11 -1.27 -0.71 114.38 112.89 1nyq h ARG 590 Ca 0.00 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 60.07 1nyq h ARG 590 Cb 0.39 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.47 1nyq h ARG 590 CO 0.00 0.16 -0.02 1.49 0.10 0.00 0.00 179.97 181.70 1nyq h GLU 591 N 0.00 0.02 -0.58 0.08 4.81 -1.82 -0.53 114.58 116.56 1nyq h GLU 591 Ca -0.00 -0.02 0.11 0.00 -0.13 0.00 0.00 59.36 59.32 1nyq h GLU 591 Cb 0.49 0.01 -0.11 0.00 0.63 0.00 0.00 28.75 29.76 1nyq h GLU 591 CO 0.02 0.82 -0.30 0.00 -0.73 0.00 0.00 179.01 178.83 1nyq h ALA 592 N 0.19 0.04 0.82 2.92 0.00 -1.63 -0.47 119.26 121.13 1nyq h ALA 592 Ca -0.00 0.18 -0.04 0.00 0.00 0.00 0.00 54.91 55.04 1nyq h ALA 592 Cb 0.83 0.71 0.01 0.00 0.00 0.00 0.00 17.79 19.34 1nyq h ALA 592 CO 0.00 -0.63 -0.39 1.96 0.00 0.00 0.00 179.25 180.20 1nyq h GLN 593 N -0.14 -1.06 -0.61 0.00 4.20 -1.21 -2.90 115.11 113.40 1nyq h GLN 593 Ca 0.24 0.07 0.18 0.00 0.06 0.00 0.00 58.65 59.21 1nyq h GLN 593 Cb 0.54 0.24 -0.11 0.00 0.30 0.00 0.00 27.48 28.44 1nyq h GLN 593 CO -0.66 -0.71 0.05 -1.33 -0.67 0.00 0.00 178.83 175.52 1nyq n MET 594 N -5.40 -0.05 -1.48 1.46 2.81 -0.21 0.22 117.12 114.48 1nyq n MET 594 Ca -0.14 0.91 -0.27 0.00 -1.81 0.00 0.00 57.70 56.40 1nyq n MET 594 Cb 0.43 -1.47 -0.05 0.00 -0.71 0.00 0.00 33.22 31.42 1nyq n MET 594 CO 0.00 0.00 0.00 1.04 1.51 0.00 0.00 175.97 178.52 1nyq n GLN 595 N -4.74 2.39 -1.57 0.03 3.00 -0.27 -4.90 117.38 111.32 1nyq n GLN 595 Ca 0.16 -2.35 0.00 0.00 -0.01 0.00 0.00 57.00 54.79 1nyq n GLN 595 Cb 0.51 -2.12 0.00 0.00 0.00 0.00 0.00 30.24 28.63 1nyq n GLN 595 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.06 178.69 1nyq n LYS 596 N 0.79 -0.46 -2.71 -1.09 5.02 0.59 -4.80 118.16 115.51 1nyq n LYS 596 Ca 0.48 -0.22 -0.43 0.00 -2.02 0.00 0.00 58.31 56.13 1nyq n LYS 596 Cb 0.54 0.39 -0.03 0.00 -0.02 0.00 0.00 35.03 35.91 1nyq n LYS 596 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1nyq s ILE 597 N -2.10 4.57 0.18 -0.18 1.01 -1.11 -4.79 121.20 118.79 1nyq s ILE 597 Ca 0.00 1.60 -0.10 0.00 0.00 0.00 0.00 60.65 62.15 1nyq s ILE 597 Cb 0.00 -4.36 0.24 0.00 0.01 0.00 0.00 42.46 38.36 1nyq s ILE 597 CO 0.00 -0.43 1.15 -2.65 0.00 0.00 0.00 174.94 173.01 1nyq n PRO 598 N 6.72 -0.13 -4.31 2.79 -0.01 -1.26 -4.38 135.00 134.43 1nyq n PRO 598 Ca 0.10 1.14 -0.20 0.00 -0.01 0.00 0.00 63.50 64.54 1nyq n PRO 598 Cb 0.47 -1.70 -0.16 0.00 -0.01 0.00 0.00 33.50 32.11 1nyq n PRO 598 CO 0.00 0.00 0.00 0.71 -0.01 0.00 0.00 175.50 176.20 1nyq s TYR 599 N -5.79 0.85 -0.59 6.00 1.51 -1.08 -3.55 117.35 114.70 1nyq s TYR 599 Ca -0.11 -0.22 -0.01 0.00 -1.01 0.00 0.00 57.07 55.72 1nyq s TYR 599 Cb 0.17 -0.65 0.15 0.00 -0.11 0.00 0.00 41.96 41.52 1nyq s TYR 599 CO 0.55 -0.13 0.39 -1.14 -1.11 0.00 0.00 175.55 174.11 1nyq s GLN 600 N 0.40 2.41 -0.43 -0.62 0.74 -1.05 -0.62 119.66 120.49 1nyq s GLN 600 Ca -0.06 -2.52 -0.24 0.00 0.05 0.00 0.00 55.36 52.60 1nyq s GLN 600 Cb -0.10 -3.63 0.02 0.00 1.10 0.00 0.00 33.01 30.40 1nyq s GLN 600 CO 0.01 -1.15 0.83 0.42 -0.55 0.00 0.00 175.29 174.84 1nyq s ILE 601 N -0.05 4.62 -0.23 -2.34 1.09 -1.11 -3.51 121.20 119.68 1nyq s ILE 601 Ca 0.17 0.68 -0.07 0.00 -1.10 0.00 0.00 60.65 60.33 1nyq s ILE 601 Cb -0.21 -4.32 -0.03 0.00 -1.06 0.00 0.00 42.46 36.83 1nyq s ILE 601 CO -0.03 -0.66 0.06 -0.69 -0.10 0.00 0.00 174.94 173.52 1nyq s VAL 602 N 3.38 4.39 -0.03 2.92 1.01 -1.04 0.20 120.40 131.22 1nyq s VAL 602 Ca 0.33 -0.15 0.06 0.00 0.00 0.00 0.00 61.98 62.21 1nyq s VAL 602 Cb -0.12 -3.02 -0.01 0.00 0.00 0.00 0.00 36.38 33.22 1nyq s VAL 602 CO 0.22 0.38 -0.21 0.68 0.00 0.00 0.00 175.10 176.16 1nyq s VAL 603 N 1.21 1.72 0.00 2.92 -7.23 0.13 -3.20 120.40 115.96 1nyq s VAL 603 Ca 0.04 -0.91 0.00 0.00 -1.81 0.00 0.00 61.98 59.30 1nyq s VAL 603 Cb -0.14 -1.44 0.00 0.00 0.56 0.00 0.00 36.38 35.35 1nyq s VAL 603 CO 0.03 0.49 0.00 0.61 -0.31 0.00 0.00 175.10 175.92 1nyq n GLY 604 N 2.75 5.45 0.05 2.32 0.00 -1.26 -1.23 105.19 113.27 1nyq n GLY 604 Ca -0.16 -1.17 -0.12 0.00 0.00 0.00 0.00 46.02 44.56 1nyq n GLY 604 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1nyq h ASP 605 N 0.00 -0.00 -0.12 1.61 3.32 -1.99 -2.42 116.42 116.81 1nyq h ASP 605 Ca 0.00 -0.12 -0.00 0.00 0.02 0.00 0.00 57.03 56.93 1nyq h ASP 605 Cb 0.00 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.55 1nyq h ASP 605 CO 0.00 0.12 0.07 0.11 -1.72 0.00 0.00 179.24 177.82 1nyq h LYS 606 N -0.13 0.16 -0.29 3.56 6.56 -1.99 -2.13 116.57 122.31 1nyq h LYS 606 Ca -0.00 -0.01 -0.05 0.00 -1.06 0.00 0.00 60.65 59.52 1nyq h LYS 606 Cb 0.13 -0.03 -0.01 0.00 -0.57 0.00 0.00 32.23 31.74 1nyq h LYS 606 CO 0.00 0.15 -0.02 0.93 -2.06 0.00 0.00 179.45 178.45 1nyq h GLU 607 N 0.13 0.53 0.00 3.15 3.07 -1.85 -2.01 114.58 117.60 1nyq h GLU 607 Ca 0.04 -0.18 -0.06 0.00 -0.50 0.00 0.00 59.36 58.66 1nyq h GLU 607 Cb 0.03 -0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 27.89 1nyq h GLU 607 CO -0.01 0.70 -0.30 0.28 -1.40 0.00 0.00 179.01 178.28 1nyq h VAL 608 N 0.31 0.91 0.26 3.13 2.07 -1.48 -2.03 116.25 119.42 1nyq h VAL 608 Ca 0.08 -1.15 -0.01 0.00 0.82 0.00 0.00 66.70 66.44 1nyq h VAL 608 Cb 0.47 1.68 0.00 0.00 -1.52 0.00 0.00 31.29 31.92 1nyq h VAL 608 CO 0.02 0.29 -0.12 -0.08 0.02 0.00 0.00 177.57 177.70 1nyq h GLU 609 N 0.00 -0.33 -0.77 1.57 4.81 -1.11 -3.23 114.58 115.51 1nyq h GLU 609 Ca -0.00 0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.24 1nyq h GLU 609 Cb 0.66 0.08 -0.01 0.00 0.63 0.00 0.00 28.75 30.10 1nyq h GLU 609 CO 0.04 0.02 0.02 0.09 -0.73 0.00 0.00 179.01 178.45 1nyq n ASN 610 N -5.06 3.70 -3.87 1.04 4.13 -0.78 -4.95 115.26 109.47 1nyq n ASN 610 Ca -0.09 -2.55 -0.33 0.00 1.68 0.00 0.00 54.58 53.29 1nyq n ASN 610 Cb 0.26 -0.61 0.01 0.00 -1.54 0.00 0.00 39.78 37.90 1nyq n ASN 610 CO 0.00 0.00 0.00 -3.20 0.28 0.00 0.00 177.26 174.34 1nyq n ASN 611 N 0.32 -4.02 -3.36 6.41 4.05 -0.81 -4.98 115.26 112.88 1nyq n ASN 611 Ca 0.17 -1.05 -0.13 0.00 0.45 0.00 0.00 54.58 54.02 1nyq n ASN 611 Cb 0.81 -1.44 -0.04 0.00 1.23 0.00 0.00 39.78 40.34 1nyq n ASN 611 CO 0.00 0.00 0.00 -1.10 -3.05 0.00 0.00 177.26 173.11 1nyq s GLN 612 N -5.99 1.87 0.22 1.20 -0.21 -0.94 -4.00 119.66 111.81 1nyq s GLN 612 Ca 0.22 -1.64 0.08 0.00 0.02 0.00 0.00 55.36 54.04 1nyq s GLN 612 Cb -0.13 0.46 -0.05 0.00 1.00 0.00 0.00 33.01 34.30 1nyq s GLN 612 CO 0.85 -0.78 -0.15 0.14 -2.12 0.00 0.00 175.29 173.23 1nyq s VAL 613 N -3.16 1.83 -0.66 1.09 -7.23 0.72 -4.54 120.40 108.44 1nyq s VAL 613 Ca 0.28 -2.23 -0.05 0.00 -1.81 0.00 0.00 61.98 58.16 1nyq s VAL 613 Cb -0.01 -2.10 0.17 0.00 0.56 0.00 0.00 36.38 35.00 1nyq s VAL 613 CO 0.17 -0.55 0.51 0.21 -0.31 0.00 0.00 175.10 175.13 1nyq s ASN 614 N -3.35 5.57 0.91 4.85 3.84 -1.19 0.26 114.94 125.82 1nyq s ASN 614 Ca 0.24 -2.79 -0.13 0.00 0.21 0.00 0.00 52.86 50.39 1nyq s ASN 614 Cb -0.01 -1.93 0.14 0.00 -0.55 0.00 0.00 41.25 38.89 1nyq s ASN 614 CO 0.08 -0.42 1.16 0.68 -2.79 0.00 0.00 177.10 175.81 1nyq s VAL 615 N 0.02 1.98 -0.35 -5.21 -7.23 -1.24 -2.50 120.40 105.87 1nyq s VAL 615 Ca 0.17 0.00 -0.04 0.00 -1.81 0.00 0.00 61.98 60.30 1nyq s VAL 615 Cb -0.18 -2.80 0.19 0.00 0.56 0.00 0.00 36.38 34.14 1nyq s VAL 615 CO -0.04 0.00 0.93 -0.60 -0.31 0.00 0.00 175.10 175.07 1nyq s ARG 616 N -5.38 0.37 0.22 4.82 3.52 -1.23 -2.62 118.95 118.65 1nyq s ARG 616 Ca 0.64 -0.12 -0.04 0.00 -0.13 0.00 0.00 55.73 56.09 1nyq s ARG 616 Cb -0.13 0.04 0.06 0.00 -1.56 0.00 0.00 34.95 33.36 1nyq s ARG 616 CO 0.53 -0.53 0.17 1.04 -0.81 0.00 0.00 175.30 175.69 1nyq n GLN 617 N 3.89 -1.80 -2.59 5.12 6.02 -1.26 -2.54 117.38 124.22 1nyq n GLN 617 Ca 0.07 -0.27 -0.42 0.00 -0.01 0.00 0.00 57.00 56.36 1nyq n GLN 617 Cb 0.61 -0.29 -0.01 0.00 1.02 0.00 0.00 30.24 31.57 1nyq n GLN 617 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 177.06 175.58 1nyq s TYR 618 N -1.28 2.73 0.00 1.08 5.04 -1.23 -4.76 117.35 118.93 1nyq s TYR 618 Ca 0.12 -1.38 0.00 0.00 -2.44 0.00 0.00 57.07 53.37 1nyq s TYR 618 Cb -0.01 -4.71 0.00 0.00 0.35 0.00 0.00 41.96 37.58 1nyq s TYR 618 CO 0.09 -1.83 0.00 0.41 -1.34 0.00 0.00 175.55 172.88 1nyq n GLY 619 N 5.86 3.91 0.86 8.97 0.00 -1.26 -5.12 105.19 118.40 1nyq n GLY 619 Ca 0.43 -0.72 -0.04 0.00 0.00 0.00 0.00 46.02 45.69 1nyq n GLY 619 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1nyq n SER 620 N 0.00 0.69 -4.55 1.61 2.88 -1.26 -4.95 113.62 108.05 1nyq n SER 620 Ca 0.00 0.10 -0.21 0.00 -1.33 0.00 0.00 58.87 57.44 1nyq n SER 620 Cb 0.00 -0.24 -0.08 0.00 -0.75 0.00 0.00 64.21 63.13 1nyq n SER 620 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1nyq n GLN 621 N -3.39 0.58 -1.40 -1.46 3.00 -1.26 -4.74 117.38 108.71 1nyq n GLN 621 Ca -0.07 -0.52 -0.18 0.00 -0.01 0.00 0.00 57.00 56.22 1nyq n GLN 621 Cb 0.39 -3.24 -0.19 0.00 0.00 0.00 0.00 30.24 27.20 1nyq n GLN 621 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.06 173.59 1nyq n ASP 622 N 16.26 -1.57 -2.96 1.08 -0.08 -1.26 -4.57 116.55 123.45 1nyq n ASP 622 Ca 0.48 -0.72 -0.42 0.00 -1.51 0.00 0.00 54.79 52.62 1nyq n ASP 622 Cb 0.41 -0.55 -0.07 0.00 2.34 0.00 0.00 41.12 43.25 1nyq n ASP 622 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1nyq n GLN 623 N 5.32 0.00 -1.13 -0.67 3.00 -1.08 -4.73 117.38 118.10 1nyq n GLN 623 Ca 0.55 0.00 -0.36 0.00 -0.01 0.00 0.00 57.00 57.18 1nyq n GLN 623 Cb 0.21 -0.96 0.01 0.00 0.00 0.00 0.00 30.24 29.50 1nyq n GLN 623 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.06 177.45 1nyq n GLU 624 N 3.11 0.00 -1.76 -1.09 1.02 -1.26 -3.64 120.64 117.03 1nyq n GLU 624 Ca 0.24 0.00 -0.41 0.00 -0.02 0.00 0.00 57.16 56.97 1nyq n GLU 624 Cb -0.04 -0.93 0.01 0.00 -0.02 0.00 0.00 31.44 30.46 1nyq n GLU 624 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1nyq n THR 625 N -1.56 2.42 -4.07 2.62 -2.24 -1.26 -4.04 114.28 106.15 1nyq n THR 625 Ca 0.06 -0.50 -0.09 0.00 -2.27 0.00 0.00 64.05 61.25 1nyq n THR 625 Cb 0.45 -1.86 -0.09 0.00 -2.10 0.00 0.00 70.33 66.73 1nyq n THR 625 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 1nyq s VAL 626 N -1.16 0.13 -0.06 2.28 -7.23 0.72 -4.94 120.40 110.13 1nyq s VAL 626 Ca 0.58 -1.72 -0.31 0.00 -1.81 0.00 0.00 61.98 58.72 1nyq s VAL 626 Cb -0.47 -1.82 -0.09 0.00 0.56 0.00 0.00 36.38 34.56 1nyq s VAL 626 CO 0.60 -0.58 2.02 1.21 -0.31 0.00 0.00 175.10 178.05 1nyq n GLU 627 N -0.06 2.45 -0.21 4.82 4.07 -1.26 0.26 120.64 130.70 1nyq n GLU 627 Ca -0.09 0.85 0.01 0.00 -0.06 0.00 0.00 57.16 57.87 1nyq n GLU 627 Cb 0.63 -2.96 0.09 0.00 -0.06 0.00 0.00 31.44 29.14 1nyq n GLU 627 CO 0.00 0.00 0.00 -0.22 -0.06 0.00 0.00 177.13 176.85 1nyq h LYS 628 N 11.38 0.07 0.08 5.31 3.64 -1.82 0.57 116.57 135.80 1nyq h LYS 628 Ca -0.47 -0.00 0.02 0.00 -1.27 0.00 0.00 60.65 58.93 1nyq h LYS 628 Cb 1.25 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 33.02 1nyq h LYS 628 CO 0.95 0.04 -0.24 0.22 -2.27 0.00 0.00 179.45 178.16 1nyq h ASP 629 N 0.07 -0.68 -0.21 4.20 1.82 -1.90 -0.42 116.42 119.30 1nyq h ASP 629 Ca 0.32 0.08 -0.01 0.00 -0.39 0.00 0.00 57.03 57.04 1nyq h ASP 629 Cb 0.52 0.26 -0.01 0.00 0.68 0.00 0.00 39.33 40.79 1nyq h ASP 629 CO -0.58 -0.32 0.11 -0.08 -1.61 0.00 0.00 179.24 176.76 1nyq h GLU 630 N -0.42 0.30 -0.02 0.28 4.81 -1.57 -2.78 114.58 115.18 1nyq h GLU 630 Ca 0.04 -0.04 0.01 0.00 -0.13 0.00 0.00 59.36 59.25 1nyq h GLU 630 Cb 0.46 -0.06 -0.04 0.00 0.63 0.00 0.00 28.75 29.74 1nyq h GLU 630 CO -0.16 0.29 -0.35 0.35 -0.73 0.00 0.00 179.01 178.42 1nyq h PHE 631 N 0.23 -1.02 -0.99 0.92 3.57 0.38 0.45 116.94 120.49 1nyq h PHE 631 Ca 0.07 0.03 0.32 0.00 3.53 0.00 0.00 57.97 61.93 1nyq h PHE 631 Cb 0.08 0.45 -0.18 0.00 2.79 0.00 0.00 35.95 39.09 1nyq h PHE 631 CO -0.03 -0.36 0.22 0.82 -2.23 0.00 0.00 178.31 176.72 1nyq h ILE 632 N -0.42 0.03 -0.21 1.41 5.03 -1.02 0.67 117.51 123.00 1nyq h ILE 632 Ca 0.01 -0.01 -0.06 0.00 -0.12 0.00 0.00 64.86 64.68 1nyq h ILE 632 Cb 0.46 0.01 -0.01 0.00 -3.03 0.00 0.00 36.82 34.25 1nyq h ILE 632 CO -0.24 0.00 -0.12 -0.25 -0.68 0.00 0.00 178.15 176.87 1nyq h TRP 633 N 0.02 0.52 -0.06 1.37 2.91 -1.03 -1.71 115.95 117.98 1nyq h TRP 633 Ca 0.68 -0.13 0.04 0.00 1.13 0.00 0.00 58.89 60.61 1nyq h TRP 633 Cb 1.57 -0.12 -0.05 0.00 -0.51 0.00 0.00 29.16 30.04 1nyq h TRP 633 CO -0.32 0.75 -0.28 -0.91 -1.03 0.00 0.00 178.44 176.65 1nyq h ASN 634 N 0.15 -0.84 0.00 2.65 2.35 0.24 0.32 115.58 120.45 1nyq h ASN 634 Ca 0.04 0.12 0.00 0.00 -0.55 0.00 0.00 56.30 55.92 1nyq h ASN 634 Cb 0.62 0.35 0.00 0.00 0.05 0.00 0.00 38.32 39.34 1nyq h ASN 634 CO 0.03 -0.33 0.00 -0.11 -1.65 0.00 0.00 177.43 175.37 1nyq n LEU 635 N -5.39 0.00 -0.22 1.61 7.94 0.15 -1.14 117.00 119.95 1nyq n LEU 635 Ca -0.04 0.41 0.18 0.00 -1.11 0.00 0.00 56.01 55.45 1nyq n LEU 635 Cb 0.30 0.00 0.33 0.00 0.53 0.00 0.00 43.42 44.58 1nyq n LEU 635 CO 0.19 0.00 0.66 0.52 -1.11 0.00 0.00 177.39 177.65 1nyq n VAL 636 N -0.61 -0.28 0.02 1.96 0.31 -0.64 0.15 118.33 119.23 1nyq n VAL 636 Ca 0.00 1.41 -0.07 0.00 -0.01 0.00 0.00 64.34 65.67 1nyq n VAL 636 Cb 0.00 -2.21 0.10 0.00 -0.91 0.00 0.00 33.84 30.81 1nyq n VAL 636 CO 0.00 0.00 0.00 -0.78 -1.32 0.00 0.00 176.83 174.73 1nyq h ASP 637 N 0.00 0.53 0.82 4.52 3.58 -0.10 -2.24 116.42 123.53 1nyq h ASP 637 Ca 0.52 -0.26 0.00 0.00 0.42 0.00 0.00 57.03 57.71 1nyq h ASP 637 Cb 1.30 -0.15 0.00 0.00 1.72 0.00 0.00 39.33 42.20 1nyq h ASP 637 CO -0.56 0.94 0.00 1.21 -2.88 0.00 0.00 179.24 177.95 1nyq n GLU 638 N -3.98 0.16 -0.06 0.28 2.13 0.40 -2.19 120.64 117.38 1nyq n GLU 638 Ca -0.02 0.33 -0.05 0.00 0.66 0.00 0.00 57.16 58.08 1nyq n GLU 638 Cb 0.56 -1.77 -0.03 0.00 0.27 0.00 0.00 31.44 30.48 1nyq n GLU 638 CO 0.00 0.00 0.00 0.82 -0.41 0.00 0.00 177.13 177.54 1nyq h ILE 639 N 0.00 0.21 -0.94 6.31 2.04 -1.10 -2.32 117.51 121.71 1nyq h ILE 639 Ca 0.00 -1.19 0.09 0.00 1.00 0.00 0.00 64.86 64.76 1nyq h ILE 639 Cb 0.41 0.43 -0.07 0.00 -0.74 0.00 0.00 36.82 36.85 1nyq h ILE 639 CO 0.00 0.07 0.61 0.03 0.00 0.00 0.00 178.15 178.86 1nyq h ARG 640 N -1.00 0.95 -0.39 2.37 3.08 -1.35 -0.30 114.38 117.73 1nyq h ARG 640 Ca -0.03 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 59.97 1nyq h ARG 640 Cb 0.39 -0.21 0.00 0.00 0.08 0.00 0.00 29.97 30.22 1nyq h ARG 640 CO -0.02 0.63 0.00 1.28 -1.07 0.00 0.00 179.97 180.79 1nyq n LEU 641 N -4.54 2.09 -2.46 3.04 7.99 -0.93 -4.98 117.00 117.21 1nyq n LEU 641 Ca 0.16 -1.05 -0.21 0.00 -0.01 0.00 0.00 56.01 54.90 1nyq n LEU 641 Cb 0.29 -0.26 0.02 0.00 -0.11 0.00 0.00 43.42 43.35 1nyq n LEU 641 CO 0.31 0.52 -0.15 0.29 -1.51 0.00 0.00 177.39 176.84 1nyq n LYS 642 N 0.63 -1.04 -2.64 3.23 5.02 -0.12 -4.93 118.16 118.31 1nyq n LYS 642 Ca 0.13 0.74 -0.22 0.00 -2.02 0.00 0.00 58.31 56.95 1nyq n LYS 642 Cb 0.33 -1.10 0.06 0.00 -0.02 0.00 0.00 35.03 34.29 1nyq n LYS 642 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1nyq s LYS 643 N -1.56 2.30 -0.02 1.97 1.02 -0.88 -5.00 119.74 117.57 1nyq s LYS 643 Ca 0.19 -0.91 0.03 0.00 0.02 0.00 0.00 55.97 55.30 1nyq s LYS 643 Cb -0.02 -2.45 -0.04 0.00 -0.52 0.00 0.00 37.83 34.79 1nyq s LYS 643 CO 0.48 -0.91 0.03 0.72 -0.92 0.00 0.00 175.35 174.76 1nyq n HIS 644 N -2.47 0.00 -1.97 3.18 8.25 -1.26 -4.62 115.22 116.33 1nyq n HIS 644 Ca 0.10 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.56 1nyq n HIS 644 Cb 0.60 -0.12 0.00 0.00 1.12 0.00 0.00 29.99 31.59 1nyq n HIS 644 CO 0.00 0.00 0.00 -2.13 0.64 0.00 0.00 176.34 174.85