#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nyq n ASN 5 N 0.00 -0.51 -4.69 7.28 5.15 -1.26 -4.24 115.26 116.99 1nyq n ASN 5 Ca 0.00 -0.29 -0.38 0.00 -0.60 0.00 0.00 54.58 53.31 1nyq n ASN 5 Cb 0.00 -0.17 -0.07 0.00 -0.53 0.00 0.00 39.78 39.02 1nyq n ASN 5 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 1nyq s ILE 6 N 0.00 5.19 -0.33 -1.44 1.01 -0.65 -2.82 121.20 122.16 1nyq s ILE 6 Ca 0.19 0.79 -0.14 0.00 0.00 0.00 0.00 60.65 61.48 1nyq s ILE 6 Cb -0.12 -3.76 -0.02 0.00 0.01 0.00 0.00 42.46 38.57 1nyq s ILE 6 CO 0.08 0.27 0.33 -1.58 0.00 0.00 0.00 174.94 174.04 1nyq s GLN 7 N 1.14 3.64 0.90 2.79 -0.44 -0.85 -0.95 119.66 125.89 1nyq s GLN 7 Ca 0.21 -0.38 -0.12 0.00 -2.50 0.00 0.00 55.36 52.57 1nyq s GLN 7 Cb -0.15 -3.77 0.13 0.00 -1.64 0.00 0.00 33.01 27.58 1nyq s GLN 7 CO 0.08 -0.45 1.12 -0.06 0.50 0.00 0.00 175.29 176.48 1nyq s PHE 8 N 1.96 2.52 0.27 1.67 0.40 -0.66 -2.18 117.98 121.96 1nyq s PHE 8 Ca 0.11 0.94 -0.01 0.00 -0.60 0.00 0.00 56.93 57.37 1nyq s PHE 8 Cb -0.17 -3.31 0.47 0.00 0.51 0.00 0.00 43.02 40.52 1nyq s PHE 8 CO 0.11 -2.32 1.85 -1.00 0.70 0.00 0.00 175.22 174.57 1nyq h PRO 9 N -1.47 1.02 0.00 0.24 0.13 -1.87 -3.42 132.00 126.63 1nyq h PRO 9 Ca -0.50 -0.06 0.00 0.00 -0.87 0.00 0.00 66.00 64.57 1nyq h PRO 9 Cb 1.32 -0.23 0.00 0.00 0.13 0.00 0.00 31.00 32.22 1nyq h PRO 9 CO 0.61 0.67 0.00 -0.25 -0.23 0.00 0.00 178.00 178.80 1nyq n ASP 10 N -4.58 0.00 -4.14 1.44 8.00 -1.26 -4.97 116.55 111.04 1nyq n ASP 10 Ca 0.17 -0.17 -0.43 0.00 0.71 0.00 0.00 54.79 55.06 1nyq n ASP 10 Cb 0.27 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.37 1nyq n ASP 10 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1nyq n GLY 11 N 5.00 4.03 3.46 0.44 0.00 -1.26 -4.89 105.19 111.97 1nyq n GLY 11 Ca 0.00 -1.97 -0.17 0.00 0.00 0.00 0.00 46.02 43.89 1nyq n GLY 11 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nyq s ASN 12 N 2.08 -0.57 0.04 1.61 2.20 -1.26 -5.10 114.94 113.94 1nyq s ASN 12 Ca 0.43 0.53 0.03 0.00 -0.94 0.00 0.00 52.86 52.90 1nyq s ASN 12 Cb 0.05 0.51 -0.02 0.00 -2.00 0.00 0.00 41.25 39.79 1nyq s ASN 12 CO 0.00 -0.63 -0.09 -0.54 -2.94 0.00 0.00 177.10 172.90 1nyq s LYS 13 N -1.55 0.60 -0.02 3.55 1.02 -1.26 -1.65 119.74 120.43 1nyq s LYS 13 Ca -0.10 -0.69 0.01 0.00 0.02 0.00 0.00 55.97 55.21 1nyq s LYS 13 Cb -0.01 -0.47 0.02 0.00 -0.52 0.00 0.00 37.83 36.85 1nyq s LYS 13 CO 0.06 0.10 -0.01 0.15 -0.92 0.00 0.00 175.35 174.73 1nyq s LYS 14 N -1.31 0.33 -0.41 1.68 -0.14 -0.13 -4.97 119.74 114.80 1nyq s LYS 14 Ca -0.05 0.01 -0.26 0.00 -1.36 0.00 0.00 55.97 54.31 1nyq s LYS 14 Cb -0.08 -0.44 0.02 0.00 -1.68 0.00 0.00 37.83 35.64 1nyq s LYS 14 CO 0.01 -0.07 0.92 0.00 -0.76 0.00 0.00 175.35 175.45 1nyq s ALA 15 N 0.70 3.34 0.35 5.17 0.00 -1.26 -1.64 121.76 128.42 1nyq s ALA 15 Ca -0.07 -0.59 0.08 0.00 0.00 0.00 0.00 51.96 51.37 1nyq s ALA 15 Cb -0.10 -3.57 -0.03 0.00 0.00 0.00 0.00 23.12 19.41 1nyq s ALA 15 CO -0.01 -1.78 0.27 -0.06 0.00 0.00 0.00 175.76 174.17 1nyq s PHE 16 N 3.58 2.81 -0.51 0.00 0.40 -1.26 -4.85 117.98 118.15 1nyq s PHE 16 Ca 0.38 -0.37 -0.28 0.00 -0.60 0.00 0.00 56.93 56.06 1nyq s PHE 16 Cb -0.11 -1.84 -0.00 0.00 0.51 0.00 0.00 43.02 41.58 1nyq s PHE 16 CO 0.22 0.16 1.58 0.34 0.70 0.00 0.00 175.22 178.22 1nyq s ASP 17 N -3.98 5.93 0.05 1.36 2.15 -1.26 -1.50 116.67 119.42 1nyq s ASP 17 Ca 0.41 0.57 -0.32 0.00 0.43 0.00 0.00 52.55 53.64 1nyq s ASP 17 Cb -0.04 -2.54 -0.17 0.00 -0.30 0.00 0.00 42.92 39.87 1nyq s ASP 17 CO 0.26 -1.81 0.80 1.17 -0.17 0.00 0.00 175.17 175.42 1nyq n LYS 18 N 8.64 0.00 -0.58 4.34 3.00 -1.26 -2.42 118.16 129.89 1nyq n LYS 18 Ca 0.17 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.48 1nyq n LYS 18 Cb 0.49 -1.20 0.00 0.00 0.00 0.00 0.00 35.03 34.32 1nyq n LYS 18 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1nyq n GLY 19 N 1.47 0.86 3.88 3.14 0.00 -1.15 -5.06 105.19 108.33 1nyq n GLY 19 Ca 0.17 -0.48 -0.30 0.00 0.00 0.00 0.00 46.02 45.42 1nyq n GLY 19 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1nyq s THR 20 N -2.00 3.67 0.23 2.61 2.01 -1.01 -4.68 115.64 116.47 1nyq s THR 20 Ca 0.00 0.50 0.11 0.00 0.31 0.00 0.00 61.69 62.61 1nyq s THR 20 Cb 0.00 -3.53 -0.05 0.00 0.01 0.00 0.00 72.50 68.93 1nyq s THR 20 CO 0.00 -0.69 -0.17 0.42 -0.69 0.00 0.00 174.62 173.49 1nyq s THR 21 N -3.30 2.66 0.31 -0.82 -4.23 -1.26 -1.12 115.64 107.87 1nyq s THR 21 Ca 0.57 -2.12 0.05 0.00 -1.18 0.00 0.00 61.69 59.02 1nyq s THR 21 Cb -0.11 -2.35 0.30 0.00 1.34 0.00 0.00 72.50 71.68 1nyq s THR 21 CO 0.51 -0.26 1.82 0.74 -0.54 0.00 0.00 174.62 176.90 1nyq h THR 22 N 2.60 0.82 -0.29 3.99 2.02 -1.62 0.47 112.91 120.90 1nyq h THR 22 Ca -0.44 -0.29 0.06 0.00 0.77 0.00 0.00 66.41 66.52 1nyq h THR 22 Cb 1.23 -0.09 -0.06 0.00 -1.74 0.00 0.00 68.15 67.49 1nyq h THR 22 CO 0.55 0.15 -0.11 -0.08 0.37 0.00 0.00 175.52 176.40 1nyq h GLU 23 N 0.83 -0.05 -0.27 6.66 4.81 0.17 0.34 114.58 127.07 1nyq h GLU 23 Ca 0.52 0.00 0.03 0.00 -0.13 0.00 0.00 59.36 59.78 1nyq h GLU 23 Cb 0.71 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 30.07 1nyq h GLU 23 CO -0.29 -0.04 0.08 -0.44 -0.73 0.00 0.00 179.01 177.59 1nyq h ASP 24 N -0.06 0.07 -0.46 1.04 3.32 -0.41 0.14 116.42 120.06 1nyq h ASP 24 Ca 0.15 0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.23 1nyq h ASP 24 Cb 0.28 0.03 -0.02 0.00 0.22 0.00 0.00 39.33 39.84 1nyq h ASP 24 CO -0.33 0.07 0.29 0.40 -1.72 0.00 0.00 179.24 177.96 1nyq h ILE 25 N 0.19 1.13 -0.44 0.35 2.04 -0.43 0.15 117.51 120.51 1nyq h ILE 25 Ca 0.12 -0.28 -0.00 0.00 1.00 0.00 0.00 64.86 65.70 1nyq h ILE 25 Cb 0.10 0.48 -0.02 0.00 -0.74 0.00 0.00 36.82 36.64 1nyq h ILE 25 CO -0.14 0.13 0.26 0.00 0.00 0.00 0.00 178.15 178.41 1nyq h ALA 26 N 1.15 0.56 -0.79 1.87 0.00 -0.54 -1.58 119.26 119.93 1nyq h ALA 26 Ca 0.17 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 1nyq h ALA 26 Cb -0.04 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.54 1nyq h ALA 26 CO -0.03 0.06 0.48 0.37 0.00 0.00 0.00 179.25 180.13 1nyq h GLN 27 N 0.58 1.07 -0.40 0.00 5.75 -0.38 0.28 115.11 122.02 1nyq h GLN 27 Ca 0.16 -0.09 0.08 0.00 -0.15 0.00 0.00 58.65 58.64 1nyq h GLN 27 Cb 0.00 -0.23 -0.08 0.00 1.07 0.00 0.00 27.48 28.25 1nyq h GLN 27 CO -0.03 0.75 -0.11 0.66 -2.65 0.00 0.00 178.83 177.46 1nyq h SER 28 N 1.08 -0.39 -0.17 -0.69 4.64 -0.05 -1.86 113.55 116.12 1nyq h SER 28 Ca 0.28 0.12 -0.03 0.00 -0.47 0.00 0.00 61.79 61.69 1nyq h SER 28 Cb -0.05 0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 62.29 1nyq h SER 28 CO -0.05 -0.14 -0.03 0.40 -0.87 0.00 0.00 176.83 176.14 1nyq h ILE 29 N -0.01 1.28 0.00 0.95 2.04 -0.63 -3.49 117.51 117.65 1nyq h ILE 29 Ca 0.19 -0.96 0.00 0.00 1.00 0.00 0.00 64.86 65.09 1nyq h ILE 29 Cb 0.30 1.57 0.00 0.00 -0.74 0.00 0.00 36.82 37.95 1nyq h ILE 29 CO -0.41 0.29 0.00 -1.54 0.00 0.00 0.00 178.15 176.48 1nyq n SER 30 N -4.69 0.00 0.08 1.72 3.41 0.93 -5.02 113.62 110.06 1nyq n SER 30 Ca -0.05 0.00 -0.09 0.00 -0.26 0.00 0.00 58.87 58.47 1nyq n SER 30 Cb 0.25 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.16 1nyq n SER 30 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 1nyq h PRO 31 N 0.00 0.15 -0.28 4.33 0.11 -1.80 -1.87 132.00 132.65 1nyq h PRO 31 Ca 0.00 -0.19 -0.01 0.00 0.11 0.00 0.00 66.00 65.91 1nyq h PRO 31 Cb 0.00 0.06 -0.01 0.00 0.11 0.00 0.00 31.00 31.16 1nyq h PRO 31 CO 0.00 0.98 0.13 0.78 -0.21 0.00 0.00 178.00 179.69 1nyq h GLY 32 N 2.08 0.41 0.94 -0.55 0.00 -1.95 -0.29 103.07 103.70 1nyq h GLY 32 Ca -0.05 -0.17 -0.34 0.00 0.00 0.00 0.00 47.33 46.77 1nyq h GLY 32 CO 0.14 0.17 -1.68 -2.00 0.00 0.00 0.00 176.54 173.17 1nyq h LEU 33 N 0.39 0.64 -0.04 3.11 5.85 -1.83 -3.37 115.31 120.05 1nyq h LEU 33 Ca 0.10 -0.93 -0.01 0.00 0.84 0.00 0.00 57.88 57.88 1nyq h LEU 33 Cb 0.05 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 40.87 1nyq h LEU 33 CO -0.01 1.76 -0.01 0.08 -0.34 0.00 0.00 178.44 179.92 1nyq h ARG 34 N 0.08 0.07 -0.41 1.25 0.11 -1.18 -2.61 114.38 111.69 1nyq h ARG 34 Ca -0.33 -0.03 0.00 0.00 0.10 0.00 0.00 59.98 59.73 1nyq h ARG 34 Cb 2.08 -0.00 0.00 0.00 1.11 0.00 0.00 29.97 33.16 1nyq h ARG 34 CO 0.18 0.40 0.00 1.63 0.10 0.00 0.00 179.97 182.28 1nyq n LYS 35 N -4.87 0.00 0.00 0.08 5.02 -0.13 -1.81 118.16 116.45 1nyq n LYS 35 Ca -0.07 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.22 1nyq n LYS 35 Cb 0.20 -1.08 0.00 0.00 -0.02 0.00 0.00 35.03 34.13 1nyq n LYS 35 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24 1nyq n LYS 36 N 0.59 1.85 -1.61 1.97 2.85 -1.15 -5.03 118.16 117.62 1nyq n LYS 36 Ca 0.00 0.00 -0.37 0.00 -1.05 0.00 0.00 58.31 56.89 1nyq n LYS 36 Cb 0.00 -0.27 0.06 0.00 -0.65 0.00 0.00 35.03 34.16 1nyq n LYS 36 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1nyq n ALA 37 N -0.22 0.14 -0.02 0.58 0.00 -0.75 -4.38 120.51 115.87 1nyq n ALA 37 Ca 0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 53.44 53.41 1nyq n ALA 37 Cb 0.00 -2.11 -0.03 0.00 0.00 0.00 0.00 19.45 17.31 1nyq n ALA 37 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1nyq n VAL 38 N -1.83 0.24 -3.87 0.00 0.24 -0.41 -4.76 118.33 107.95 1nyq n VAL 38 Ca 0.14 -0.16 -0.02 0.00 -2.04 0.00 0.00 64.34 62.27 1nyq n VAL 38 Cb 0.48 -0.81 0.01 0.00 -1.47 0.00 0.00 33.84 32.05 1nyq n VAL 38 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1nyq s ALA 39 N -2.11 -1.81 0.10 2.33 0.00 -1.22 -3.86 121.76 115.20 1nyq s ALA 39 Ca -0.02 -0.13 0.05 0.00 0.00 0.00 0.00 51.96 51.86 1nyq s ALA 39 Cb 0.01 0.74 -0.04 0.00 0.00 0.00 0.00 23.12 23.84 1nyq s ALA 39 CO 0.16 -1.08 -0.12 0.20 0.00 0.00 0.00 175.76 174.91 1nyq s GLY 40 N -3.39 0.94 -0.63 0.00 0.00 0.87 -1.60 107.32 103.52 1nyq s GLY 40 Ca 0.21 -1.20 -0.02 0.00 0.00 0.00 0.00 44.72 43.72 1nyq s GLY 40 CO 0.03 -1.25 0.43 1.25 0.00 0.00 0.00 173.10 173.56 1nyq s LYS 41 N -2.55 2.53 -0.53 2.90 2.20 -0.98 0.22 119.74 123.53 1nyq s LYS 41 Ca 0.05 -2.59 -0.20 0.00 -0.36 0.00 0.00 55.97 52.87 1nyq s LYS 41 Cb -0.05 -3.69 0.06 0.00 -1.51 0.00 0.00 37.83 32.64 1nyq s LYS 41 CO 0.02 -1.17 0.72 0.12 -0.36 0.00 0.00 175.35 174.68 1nyq s PHE 42 N -0.17 2.96 -0.37 4.03 5.36 -0.82 -2.43 117.98 126.55 1nyq s PHE 42 Ca 0.17 -0.45 -0.01 0.00 -0.96 0.00 0.00 56.93 55.69 1nyq s PHE 42 Cb -0.21 -3.74 0.00 0.00 -0.34 0.00 0.00 43.02 38.74 1nyq s PHE 42 CO -0.03 -1.16 0.32 0.09 -1.46 0.00 0.00 175.22 172.98 1nyq n ASN 43 N 6.57 -2.54 -1.02 6.13 4.13 0.45 -2.93 115.26 126.05 1nyq n ASN 43 Ca -0.05 -0.17 -0.12 0.00 1.68 0.00 0.00 54.58 55.92 1nyq n ASN 43 Cb 0.46 -1.85 -0.05 0.00 -1.54 0.00 0.00 39.78 36.79 1nyq n ASN 43 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1nyq n GLY 44 N -1.00 1.18 2.96 7.41 0.00 -1.25 -4.93 105.19 109.56 1nyq n GLY 44 Ca -0.05 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.67 1nyq n GLY 44 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1nyq s GLN 45 N -2.97 1.75 -0.03 1.61 2.00 -1.15 -5.05 119.66 115.82 1nyq s GLN 45 Ca 0.00 -1.03 -0.38 0.00 -2.00 0.00 0.00 55.36 51.95 1nyq s GLN 45 Cb 0.00 -2.62 -0.16 0.00 0.80 0.00 0.00 33.01 31.03 1nyq s GLN 45 CO 0.00 -0.58 1.48 1.47 -0.50 0.00 0.00 175.29 177.16 1nyq n LEU 46 N 4.64 1.96 -4.22 3.68 -0.00 -1.26 -1.94 117.00 119.85 1nyq n LEU 46 Ca -0.13 1.10 -0.13 0.00 -0.00 0.00 0.00 56.01 56.86 1nyq n LEU 46 Cb 0.44 -1.19 -0.10 0.00 -0.00 0.00 0.00 43.42 42.57 1nyq n LEU 46 CO 0.19 -0.81 -0.31 0.68 -0.00 0.00 0.00 177.39 177.14 1nyq s VAL 47 N 1.50 0.48 0.48 1.47 -7.23 0.59 -4.85 120.40 112.84 1nyq s VAL 47 Ca 0.89 -1.96 -0.19 0.00 -1.81 0.00 0.00 61.98 58.90 1nyq s VAL 47 Cb -0.97 -2.18 -0.09 0.00 0.56 0.00 0.00 36.38 33.69 1nyq s VAL 47 CO 0.52 -0.39 0.99 -1.81 -0.31 0.00 0.00 175.10 174.10 1nyq s ASP 48 N -3.16 6.63 0.45 4.85 1.11 -1.26 -0.09 116.67 125.20 1nyq s ASP 48 Ca 0.26 1.74 0.23 0.00 0.18 0.00 0.00 52.55 54.96 1nyq s ASP 48 Cb 0.07 -2.54 1.22 0.00 1.07 0.00 0.00 42.92 42.74 1nyq s ASP 48 CO 0.05 -0.58 1.83 -0.07 1.18 0.00 0.00 175.17 177.58 1nyq h LEU 49 N 1.49 0.29 0.00 1.23 3.38 -1.85 -1.32 115.31 118.54 1nyq h LEU 49 Ca -0.48 0.04 -0.15 0.00 0.09 0.00 0.00 57.88 57.38 1nyq h LEU 49 Cb 1.19 -0.01 -0.03 0.00 0.09 0.00 0.00 40.66 41.91 1nyq h LEU 49 CO 0.60 0.09 -1.67 0.35 0.09 0.00 0.00 178.44 177.90 1nyq n THR 50 N -4.46 0.90 -1.33 0.22 -2.24 -1.26 0.18 114.28 106.29 1nyq n THR 50 Ca 0.21 -0.66 -0.54 0.00 -2.27 0.00 0.00 64.05 60.79 1nyq n THR 50 Cb 0.86 -0.48 -0.13 0.00 -2.10 0.00 0.00 70.33 68.48 1nyq n THR 50 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 1nyq n LYS 51 N -2.70 0.06 -1.71 -0.78 3.00 -0.50 -4.67 118.16 110.86 1nyq n LYS 51 Ca -0.12 0.01 -0.43 0.00 -0.00 0.00 0.00 58.31 57.77 1nyq n LYS 51 Cb 0.81 -1.56 -0.02 0.00 0.00 0.00 0.00 35.03 34.25 1nyq n LYS 51 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.40 175.10 1nyq n PRO 52 N 7.83 2.43 -4.11 1.64 -0.02 -1.26 -4.34 135.00 137.18 1nyq n PRO 52 Ca 0.57 0.87 -0.35 0.00 -2.02 0.00 0.00 63.50 62.58 1nyq n PRO 52 Cb -0.00 -2.62 -0.13 0.00 -0.02 0.00 0.00 33.50 30.72 1nyq n PRO 52 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1nyq s LEU 53 N 0.15 3.05 0.00 2.45 1.43 -0.28 -5.01 118.68 120.48 1nyq s LEU 53 Ca 0.69 -0.29 0.00 0.00 -1.03 0.00 0.00 54.13 53.51 1nyq s LEU 53 Cb -0.57 -1.76 0.00 0.00 0.03 0.00 0.00 46.19 43.89 1nyq s LEU 53 CO 0.45 0.05 0.00 -0.62 0.23 0.00 0.00 176.35 176.46 1nyq n GLU 54 N 4.34 0.00 -1.37 1.70 4.71 -1.26 -2.95 120.64 125.81 1nyq n GLU 54 Ca -0.18 0.00 -0.51 0.00 -0.01 0.00 0.00 57.16 56.46 1nyq n GLU 54 Cb 0.52 -0.01 -0.06 0.00 -1.01 0.00 0.00 31.44 30.88 1nyq n GLU 54 CO 0.00 0.00 0.00 -2.37 0.09 0.00 0.00 177.13 174.85 1nyq n THR 55 N -0.09 0.78 -2.00 2.62 5.66 -1.26 -4.76 114.28 115.23 1nyq n THR 55 Ca 0.00 -0.20 -0.32 0.00 -3.05 0.00 0.00 64.05 60.48 1nyq n THR 55 Cb 0.00 0.00 0.01 0.00 -1.55 0.00 0.00 70.33 68.79 1nyq n THR 55 CO 0.00 0.00 0.00 1.51 -3.05 0.00 0.00 175.07 173.53 1nyq s ASP 56 N -0.39 5.84 0.00 1.09 -4.77 -1.26 -5.02 116.67 112.15 1nyq s ASP 56 Ca 0.75 1.74 0.00 0.00 -3.30 0.00 0.00 52.55 51.73 1nyq s ASP 56 Cb -1.06 -2.52 0.00 0.00 -1.09 0.00 0.00 42.92 38.25 1nyq s ASP 56 CO 0.53 -1.13 0.00 0.61 0.70 0.00 0.00 175.17 175.88 1nyq n GLY 57 N -1.29 -0.89 3.75 2.12 0.00 -1.13 -4.96 105.19 102.79 1nyq n GLY 57 Ca 0.08 -1.08 -0.41 0.00 0.00 0.00 0.00 46.02 44.61 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 0.00 7.19 -0.03 1.61 1.04 -1.26 -2.00 113.70 120.26 1nyq s SER 58 Ca 0.00 2.29 -0.08 0.00 0.48 0.00 0.00 55.95 58.65 1nyq s SER 58 Cb 0.00 -2.62 0.01 0.00 0.10 0.00 0.00 66.02 63.51 1nyq s SER 58 CO 0.00 -0.22 0.17 -0.51 0.98 0.00 0.00 173.24 173.66 1nyq s ILE 59 N -0.92 0.05 0.12 -1.02 2.07 -0.93 0.17 121.20 120.75 1nyq s ILE 59 Ca 0.47 -0.40 0.08 0.00 -1.41 0.00 0.00 60.65 59.39 1nyq s ILE 59 Cb -0.33 -0.38 -0.04 0.00 0.13 0.00 0.00 42.46 41.85 1nyq s ILE 59 CO 0.41 -0.22 -0.20 -1.61 -1.91 0.00 0.00 174.94 171.41 1nyq s GLU 60 N -0.79 1.18 -0.53 3.50 2.02 -1.02 -3.85 118.70 119.21 1nyq s GLU 60 Ca -0.09 -1.25 -0.10 0.00 0.02 0.00 0.00 54.97 53.55 1nyq s GLU 60 Cb -0.05 -1.37 0.13 0.00 0.10 0.00 0.00 34.13 32.95 1nyq s GLU 60 CO 0.01 0.30 0.42 0.42 0.02 0.00 0.00 175.26 176.44 1nyq s ILE 61 N -1.47 4.48 -0.64 -1.63 -1.09 -1.26 -2.31 121.20 117.28 1nyq s ILE 61 Ca 0.10 -1.90 -0.28 0.00 -2.23 0.00 0.00 60.65 56.34 1nyq s ILE 61 Cb -0.09 -3.91 -0.12 0.00 -1.58 0.00 0.00 42.46 36.76 1nyq s ILE 61 CO 0.05 -0.83 2.50 0.52 -1.23 0.00 0.00 174.94 175.95 1nyq n VAL 62 N 4.77 -0.05 -4.10 2.92 0.31 -0.63 -4.94 118.33 116.61 1nyq n VAL 62 Ca -0.06 -0.53 -0.22 0.00 -0.01 0.00 0.00 64.34 63.52 1nyq n VAL 62 Cb 0.41 -2.04 -0.04 0.00 -0.91 0.00 0.00 33.84 31.25 1nyq n VAL 62 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 1nyq s THR 63 N 11.04 4.51 0.10 2.52 -1.32 -1.26 -1.29 115.64 129.94 1nyq s THR 63 Ca 1.10 -1.33 -0.31 0.00 -1.21 0.00 0.00 61.69 59.94 1nyq s THR 63 Cb -0.54 -3.42 -0.08 0.00 -1.51 0.00 0.00 72.50 66.95 1nyq s THR 63 CO 0.34 -0.32 1.42 -2.16 -2.21 0.00 0.00 174.62 171.69 1nyq s PRO 64 N -3.75 4.30 0.00 7.08 0.04 -1.26 -2.97 135.00 138.44 1nyq s PRO 64 Ca 0.33 2.09 0.00 0.00 0.04 0.00 0.00 61.00 63.46 1nyq s PRO 64 Cb -0.08 -3.31 0.00 0.00 0.04 0.00 0.00 34.50 31.15 1nyq s PRO 64 CO 0.25 -0.49 0.00 0.41 0.04 0.00 0.00 177.00 177.21 1nyq n GLY 65 N 3.56 -0.23 3.93 0.56 0.00 -1.26 -5.12 105.19 106.63 1nyq n GLY 65 Ca 0.12 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.89 1nyq n GLY 65 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1nyq s SER 66 N -0.03 6.19 0.06 1.61 0.01 -1.16 -5.01 113.70 115.38 1nyq s SER 66 Ca 0.00 0.09 -0.18 0.00 1.31 0.00 0.00 55.95 57.17 1nyq s SER 66 Cb 0.00 -1.82 -0.13 0.00 0.21 0.00 0.00 66.02 64.28 1nyq s SER 66 CO 0.00 0.02 1.34 -0.08 0.41 0.00 0.00 173.24 174.93 1nyq h GLU 67 N 1.93 0.51 -0.57 12.44 4.57 -1.99 -2.04 114.58 129.43 1nyq h GLU 67 Ca -0.49 -0.30 0.06 0.00 -1.18 0.00 0.00 59.36 57.45 1nyq h GLU 67 Cb 1.20 0.03 -0.05 0.00 -0.16 0.00 0.00 28.75 29.77 1nyq h GLU 67 CO 0.66 0.90 0.28 0.93 -1.18 0.00 0.00 179.01 180.60 1nyq h GLU 68 N 0.17 0.51 -0.96 1.92 5.08 -1.95 0.17 114.58 119.51 1nyq h GLU 68 Ca 0.02 -0.03 0.06 0.00 -1.00 0.00 0.00 59.36 58.41 1nyq h GLU 68 Cb 0.85 -0.11 -0.06 0.00 0.50 0.00 0.00 28.75 29.92 1nyq h GLU 68 CO 0.06 0.34 0.63 0.00 -1.00 0.00 0.00 179.01 179.03 1nyq h ALA 69 N 1.32 1.44 -0.12 3.43 0.00 -1.80 -1.78 119.26 121.76 1nyq h ALA 69 Ca 0.26 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.14 1nyq h ALA 69 Cb 0.20 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1nyq h ALA 69 CO -0.20 0.42 0.06 1.25 0.00 0.00 0.00 179.25 180.78 1nyq h LEU 70 N 1.13 0.16 -0.30 0.00 5.85 0.00 -1.73 115.31 120.42 1nyq h LEU 70 Ca 0.41 -0.13 0.06 0.00 0.84 0.00 0.00 57.88 59.06 1nyq h LEU 70 Cb 0.16 -0.04 -0.08 0.00 0.37 0.00 0.00 40.66 41.07 1nyq h LEU 70 CO -0.16 0.24 -0.45 -0.33 -0.34 0.00 0.00 178.44 177.40 1nyq h GLU 71 N 0.06 -0.39 0.03 1.25 4.39 -0.27 0.19 114.58 119.83 1nyq h GLU 71 Ca 0.04 0.03 0.02 0.00 0.34 0.00 0.00 59.36 59.78 1nyq h GLU 71 Cb 0.12 0.09 -0.05 0.00 -0.10 0.00 0.00 28.75 28.82 1nyq h GLU 71 CO -0.00 -0.26 -0.48 0.28 -1.16 0.00 0.00 179.01 177.38 1nyq h VAL 72 N -0.41 0.00 -0.96 3.13 2.07 -1.23 0.33 116.25 119.19 1nyq h VAL 72 Ca 0.10 0.00 0.27 0.00 0.82 0.00 0.00 66.70 67.89 1nyq h VAL 72 Cb 0.61 0.00 -0.14 0.00 -1.52 0.00 0.00 31.29 30.24 1nyq h VAL 72 CO -0.51 0.00 0.48 0.25 0.02 0.00 0.00 177.57 177.81 1nyq h LEU 73 N -0.62 0.43 -0.49 2.57 5.85 -0.44 0.77 115.31 123.38 1nyq h LEU 73 Ca 0.01 0.17 -0.16 0.00 0.84 0.00 0.00 57.88 58.73 1nyq h LEU 73 Cb 0.65 0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.81 1nyq h LEU 73 CO -0.31 -0.05 -0.52 0.03 -0.34 0.00 0.00 178.44 177.25 1nyq h ARG 74 N 0.39 0.64 -0.25 1.25 2.47 0.15 -0.35 114.38 118.68 1nyq h ARG 74 Ca 0.64 -0.39 -0.08 0.00 -1.26 0.00 0.00 59.98 58.90 1nyq h ARG 74 Cb 1.33 0.04 -0.01 0.00 -1.65 0.00 0.00 29.97 29.68 1nyq h ARG 74 CO -0.56 1.00 -0.14 1.25 0.56 0.00 0.00 179.97 182.08 1nyq h HIS 75 N 0.50 0.63 -0.10 3.04 2.76 0.14 -2.19 115.15 119.92 1nyq h HIS 75 Ca 0.02 -0.16 -0.01 0.00 -2.20 0.00 0.00 60.37 58.02 1nyq h HIS 75 Cb 1.08 -0.14 -0.01 0.00 1.55 0.00 0.00 27.41 29.89 1nyq h HIS 75 CO 0.05 0.81 0.02 0.77 -1.30 0.00 0.00 177.93 178.29 1nyq h SER 76 N 0.27 0.12 0.54 3.26 0.02 -0.83 -2.41 113.55 114.52 1nyq h SER 76 Ca 0.05 -0.01 -0.21 0.00 -0.84 0.00 0.00 61.79 60.79 1nyq h SER 76 Cb 0.66 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 63.16 1nyq h SER 76 CO 0.04 0.13 -0.91 0.74 -1.14 0.00 0.00 176.83 175.69 1nyq h THR 77 N 0.14 1.48 0.05 -2.27 2.02 -0.86 -2.23 112.91 111.23 1nyq h THR 77 Ca 0.04 -2.62 0.01 0.00 0.77 0.00 0.00 66.41 64.60 1nyq h THR 77 Cb 0.06 2.49 -0.02 0.00 -1.74 0.00 0.00 68.15 68.94 1nyq h THR 77 CO -0.00 0.77 -0.09 0.00 0.37 0.00 0.00 175.52 176.56 1nyq h ALA 78 N 0.90 -0.14 0.36 6.16 0.00 -0.92 0.50 119.26 126.12 1nyq h ALA 78 Ca -0.06 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 1nyq h ALA 78 Cb 1.55 0.15 -0.02 0.00 0.00 0.00 0.00 17.79 19.47 1nyq h ALA 78 CO 0.14 -0.60 -0.33 0.45 0.00 0.00 0.00 179.25 178.91 1nyq h HIS 79 N -0.19 -0.89 -0.76 0.00 3.86 -1.50 0.19 115.15 115.87 1nyq h HIS 79 Ca 0.02 0.00 0.17 0.00 -1.16 0.00 0.00 60.37 59.40 1nyq h HIS 79 Cb 0.21 0.34 -0.11 0.00 1.06 0.00 0.00 27.41 28.90 1nyq h HIS 79 CO -0.14 -0.47 0.19 1.25 0.86 0.00 0.00 177.93 179.62 1nyq h LEU 80 N -0.71 0.02 -0.30 2.43 5.85 -0.97 0.59 115.31 122.23 1nyq h LEU 80 Ca -0.02 0.15 0.06 0.00 0.84 0.00 0.00 57.88 58.91 1nyq h LEU 80 Cb 0.63 0.20 -0.06 0.00 0.37 0.00 0.00 40.66 41.80 1nyq h LEU 80 CO -0.05 -0.05 -0.11 -0.03 -0.34 0.00 0.00 178.44 177.87 1nyq h MET 81 N 0.27 -0.05 0.58 1.25 4.05 0.14 0.13 114.93 121.30 1nyq h MET 81 Ca 0.43 0.00 -0.02 0.00 -0.28 0.00 0.00 59.70 59.84 1nyq h MET 81 Cb 0.76 0.01 -0.02 0.00 -0.80 0.00 0.00 31.60 31.55 1nyq h MET 81 CO -0.53 -0.03 -0.49 0.00 0.23 0.00 0.00 176.91 176.09 1nyq h ALA 82 N 1.22 -1.14 -0.93 0.39 0.00 0.25 -1.73 119.26 117.32 1nyq h ALA 82 Ca 0.15 -0.20 0.27 0.00 0.00 0.00 0.00 54.91 55.13 1nyq h ALA 82 Cb 0.28 0.67 -0.16 0.00 0.00 0.00 0.00 17.79 18.59 1nyq h ALA 82 CO -0.34 -1.17 0.25 1.25 0.00 0.00 0.00 179.25 179.24 1nyq h HIS 83 N -1.04 0.36 0.00 0.00 6.17 0.62 1.01 115.15 122.27 1nyq h HIS 83 Ca -0.07 0.05 -0.03 0.00 0.71 0.00 0.00 60.37 61.03 1nyq h HIS 83 Cb 0.88 -0.01 -0.00 0.00 2.52 0.00 0.00 27.41 30.80 1nyq h HIS 83 CO -0.21 -0.29 -0.13 0.00 0.71 0.00 0.00 177.93 178.01 1nyq h ALA 84 N 1.86 1.06 0.08 5.26 0.00 -0.03 -0.77 119.26 126.72 1nyq h ALA 84 Ca 0.62 -0.12 -0.16 0.00 0.00 0.00 0.00 54.91 55.24 1nyq h ALA 84 Cb 1.33 -0.02 0.02 0.00 0.00 0.00 0.00 17.79 19.11 1nyq h ALA 84 CO -0.73 0.16 -0.69 0.82 0.00 0.00 0.00 179.25 178.81 1nyq h ILE 85 N 0.00 1.49 -0.59 0.00 1.08 0.18 -2.76 117.51 116.91 1nyq h ILE 85 Ca -0.00 -2.34 0.06 0.00 -0.39 0.00 0.00 64.86 62.20 1nyq h ILE 85 Cb 0.58 2.96 -0.05 0.00 -3.07 0.00 0.00 36.82 37.23 1nyq h ILE 85 CO 0.02 0.67 0.29 0.50 -0.69 0.00 0.00 178.15 178.94 1nyq h LYS 86 N -0.29 0.53 0.00 2.37 3.11 -0.69 -1.58 116.57 120.02 1nyq h LYS 86 Ca -0.11 -0.03 0.00 0.00 -2.81 0.00 0.00 60.65 57.70 1nyq h LYS 86 Cb 1.48 -0.12 0.00 0.00 -1.00 0.00 0.00 32.23 32.59 1nyq h LYS 86 CO 0.13 0.35 0.00 -0.09 -2.81 0.00 0.00 179.45 177.03 1nyq h ARG 87 N 0.55 0.00 0.00 1.90 2.43 -1.15 -3.33 114.38 114.78 1nyq h ARG 87 Ca 0.27 0.00 -0.28 0.00 -0.81 0.00 0.00 59.98 59.16 1nyq h ARG 87 Cb 0.22 0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 29.71 1nyq h ARG 87 CO -0.20 0.00 -2.06 1.28 -1.51 0.00 0.00 179.97 177.48 1nyq n LEU 88 N -3.01 0.86 -4.94 3.80 4.77 -0.65 -5.05 117.00 112.77 1nyq n LEU 88 Ca -0.00 -0.03 -0.24 0.00 -0.03 0.00 0.00 56.01 55.71 1nyq n LEU 88 Cb 0.23 0.07 -0.02 0.00 -2.33 0.00 0.00 43.42 41.38 1nyq n LEU 88 CO 0.24 0.51 0.14 -0.31 -1.33 0.00 0.00 177.39 176.64 1nyq s TYR 89 N -2.37 3.49 0.02 -1.77 2.02 -0.87 -5.05 117.35 112.82 1nyq s TYR 89 Ca -0.13 0.32 -0.19 0.00 -0.37 0.00 0.00 57.07 56.71 1nyq s TYR 89 Cb 0.05 -1.87 -0.23 0.00 -0.40 0.00 0.00 41.96 39.51 1nyq s TYR 89 CO 0.57 0.18 1.12 0.78 -1.57 0.00 0.00 175.55 176.63 1nyq h GLY 90 N 0.95 0.52 -6.71 0.71 0.00 -1.91 -3.42 103.07 93.20 1nyq h GLY 90 Ca -0.50 -0.90 -0.60 0.00 0.00 0.00 0.00 47.33 45.33 1nyq h GLY 90 CO 0.62 0.80 -0.79 0.21 0.00 0.00 0.00 176.54 177.38 1nyq s ASN 91 N -6.84 3.01 -0.01 0.19 2.47 -1.26 -5.11 114.94 107.39 1nyq s ASN 91 Ca -0.13 -3.31 0.03 0.00 0.42 0.00 0.00 52.86 49.87 1nyq s ASN 91 Cb 0.04 -0.96 -0.03 0.00 -1.45 0.00 0.00 41.25 38.84 1nyq s ASN 91 CO 0.84 -0.15 -0.05 -0.69 -3.72 0.00 0.00 177.10 173.33 1nyq s VAL 92 N -0.47 3.77 -0.04 -5.21 1.01 -1.26 -3.70 120.40 114.49 1nyq s VAL 92 Ca 0.28 -0.70 -0.00 0.00 0.00 0.00 0.00 61.98 61.55 1nyq s VAL 92 Cb -0.03 -2.64 0.03 0.00 0.00 0.00 0.00 36.38 33.74 1nyq s VAL 92 CO -0.16 0.41 0.00 -0.54 0.00 0.00 0.00 175.10 174.81 1nyq s LYS 93 N -1.38 0.41 0.40 2.72 1.02 -1.20 -5.00 119.74 116.71 1nyq s LYS 93 Ca 0.17 0.10 0.01 0.00 0.02 0.00 0.00 55.97 56.27 1nyq s LYS 93 Cb -0.11 -0.68 -0.02 0.00 -0.52 0.00 0.00 37.83 36.50 1nyq s LYS 93 CO 0.07 -0.20 0.60 -0.06 -0.92 0.00 0.00 175.35 174.84 1nyq s PHE 94 N 1.43 3.34 0.00 3.18 0.40 -1.26 -2.79 117.98 122.27 1nyq s PHE 94 Ca -0.04 0.25 0.00 0.00 -0.60 0.00 0.00 56.93 56.54 1nyq s PHE 94 Cb -0.13 -2.10 0.00 0.00 0.51 0.00 0.00 43.02 41.30 1nyq s PHE 94 CO -0.03 -0.12 0.00 0.41 0.70 0.00 0.00 175.22 176.18 1nyq n GLY 95 N -1.92 2.75 3.74 4.36 0.00 -0.93 -4.46 105.19 108.73 1nyq n GLY 95 Ca -0.01 -0.19 -0.33 0.00 0.00 0.00 0.00 46.02 45.49 1nyq n GLY 95 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1nyq s VAL 96 N 3.43 4.49 -0.53 1.61 -7.23 -1.26 -4.93 120.40 115.99 1nyq s VAL 96 Ca 0.00 -0.51 0.04 0.00 -1.81 0.00 0.00 61.98 59.69 1nyq s VAL 96 Cb 0.00 -3.04 0.15 0.00 0.56 0.00 0.00 36.38 34.04 1nyq s VAL 96 CO 0.00 0.34 0.32 -0.83 -0.31 0.00 0.00 175.10 174.62 1nyq s GLY 97 N -1.72 2.16 0.23 2.32 0.00 -1.26 -2.16 107.32 106.89 1nyq s GLY 97 Ca 0.22 -3.08 0.04 0.00 0.00 0.00 0.00 44.72 41.89 1nyq s GLY 97 CO 0.13 1.34 0.37 2.56 0.00 0.00 0.00 173.10 177.50 1nyq s PRO 98 N -0.32 3.45 -0.12 2.90 0.04 -1.21 -4.92 135.00 134.83 1nyq s PRO 98 Ca 0.21 -0.65 -0.22 0.00 0.04 0.00 0.00 61.00 60.37 1nyq s PRO 98 Cb -0.17 -2.88 -0.03 0.00 0.04 0.00 0.00 34.50 31.46 1nyq s PRO 98 CO -0.06 0.42 0.66 0.08 0.04 0.00 0.00 177.00 178.14 1nyq s VAL 99 N -1.96 5.05 0.42 -0.36 1.01 -1.26 -3.04 120.40 120.25 1nyq s VAL 99 Ca 0.35 1.32 0.04 0.00 0.00 0.00 0.00 61.98 63.69 1nyq s VAL 99 Cb -0.10 -3.99 -0.02 0.00 0.00 0.00 0.00 36.38 32.27 1nyq s VAL 99 CO 0.30 0.20 0.12 0.27 0.00 0.00 0.00 175.10 175.99 1nyq s ILE 100 N 1.19 0.65 0.01 2.22 -4.36 0.14 -4.99 121.20 116.07 1nyq s ILE 100 Ca 0.34 -2.00 -0.34 0.00 -0.26 0.00 0.00 60.65 58.38 1nyq s ILE 100 Cb -0.17 -2.33 -0.13 0.00 1.25 0.00 0.00 42.46 41.08 1nyq s ILE 100 CO 0.14 0.00 1.74 1.21 0.24 0.00 0.00 174.94 178.27 1nyq n GLU 101 N -0.94 2.10 -4.10 0.37 2.13 -1.26 -1.89 120.64 117.05 1nyq n GLU 101 Ca -0.07 0.77 -0.34 0.00 0.66 0.00 0.00 57.16 58.18 1nyq n GLU 101 Cb 0.65 -2.57 -0.01 0.00 0.27 0.00 0.00 31.44 29.79 1nyq n GLU 101 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1nyq n GLY 102 N 3.94 -0.46 0.00 8.31 0.00 -1.26 -4.82 105.19 110.90 1nyq n GLY 102 Ca 0.20 0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.38 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 -1.53 -0.74 3.29 -0.02 0.00 -0.79 -4.61 105.19 100.79 1nyq n GLY 103 Ca 0.05 -1.36 -0.09 0.00 0.00 0.00 0.00 46.02 44.62 1nyq n GLY 103 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1nyq s PHE 104 N -2.82 0.26 0.13 1.61 -0.71 0.25 0.28 117.98 116.97 1nyq s PHE 104 Ca 0.00 -0.65 -0.01 0.00 -1.04 0.00 0.00 56.93 55.23 1nyq s PHE 104 Cb 0.00 -0.03 -0.04 0.00 -1.21 0.00 0.00 43.02 41.74 1nyq s PHE 104 CO 0.00 -0.65 0.07 1.52 -1.34 0.00 0.00 175.22 174.81 1nyq s TYR 105 N -3.92 0.83 -0.27 3.49 -0.85 -1.17 0.43 117.35 115.90 1nyq s TYR 105 Ca 0.11 -1.21 -0.00 0.00 -0.52 0.00 0.00 57.07 55.45 1nyq s TYR 105 Cb 0.04 -0.46 0.14 0.00 0.38 0.00 0.00 41.96 42.06 1nyq s TYR 105 CO -0.05 -0.53 0.35 -0.47 -1.52 0.00 0.00 175.55 173.33 1nyq s TYR 106 N -4.04 -0.73 0.08 -3.49 6.14 -0.62 -3.28 117.35 111.40 1nyq s TYR 106 Ca 0.24 0.29 -0.31 0.00 0.64 0.00 0.00 57.07 57.93 1nyq s TYR 106 Cb 0.07 -0.22 -0.09 0.00 0.42 0.00 0.00 41.96 42.15 1nyq s TYR 106 CO 0.01 -0.86 1.68 -0.51 0.64 0.00 0.00 175.55 176.51 1nyq s ASP 107 N 2.47 6.58 0.00 4.32 1.01 -0.92 -2.90 116.67 127.23 1nyq s ASP 107 Ca 0.10 2.52 0.00 0.00 0.71 0.00 0.00 52.55 55.88 1nyq s ASP 107 Cb -0.14 -2.56 0.00 0.00 1.01 0.00 0.00 42.92 41.23 1nyq s ASP 107 CO -0.26 -0.90 0.00 0.49 0.21 0.00 0.00 175.17 174.71 1nyq n PHE 108 N 5.62 -0.09 -2.75 4.23 3.72 -0.30 -2.19 117.46 125.69 1nyq n PHE 108 Ca 0.16 0.00 -0.02 0.00 -0.05 0.00 0.00 57.45 57.54 1nyq n PHE 108 Cb 0.40 0.00 0.02 0.00 -0.94 0.00 0.00 39.48 38.96 1nyq n PHE 108 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 1nyq s ASP 109 N 0.33 -0.62 0.12 4.37 -1.08 -1.12 -3.47 116.67 115.20 1nyq s ASP 109 Ca 0.00 -0.61 0.02 0.00 -0.52 0.00 0.00 52.55 51.43 1nyq s ASP 109 Cb 0.00 0.80 -0.04 0.00 -1.46 0.00 0.00 42.92 42.23 1nyq s ASP 109 CO 0.00 -0.04 0.26 -0.63 0.52 0.00 0.00 175.17 175.28 1nyq s ILE 110 N 1.23 5.34 0.13 4.11 1.01 -1.26 -3.22 121.20 128.54 1nyq s ILE 110 Ca 0.22 -0.58 -0.20 0.00 0.00 0.00 0.00 60.65 60.10 1nyq s ILE 110 Cb 0.07 -3.70 -0.04 0.00 0.01 0.00 0.00 42.46 38.80 1nyq s ILE 110 CO -0.10 -0.01 1.73 -0.78 0.00 0.00 0.00 174.94 175.78 1nyq h ASP 111 N 2.49 -0.03 -0.90 3.58 3.58 -2.00 -3.44 116.42 119.71 1nyq h ASP 111 Ca -0.47 0.04 -0.50 0.00 0.42 0.00 0.00 57.03 56.51 1nyq h ASP 111 Cb 1.18 0.06 0.00 0.00 1.72 0.00 0.00 39.33 42.29 1nyq h ASP 111 CO 0.71 0.01 -0.20 0.00 -2.88 0.00 0.00 179.24 176.89 1nyq s GLN 112 N -6.19 2.39 0.00 0.28 -2.07 -1.26 -5.14 119.66 107.67 1nyq s GLN 112 Ca -0.13 -1.67 0.00 0.00 -1.82 0.00 0.00 55.36 51.73 1nyq s GLN 112 Cb 0.10 -2.49 0.00 0.00 -1.09 0.00 0.00 33.01 29.52 1nyq s GLN 112 CO 0.69 -0.65 0.00 0.27 -1.32 0.00 0.00 175.29 174.28 1nyq n ASN 113 N -2.00 0.00 0.00 12.60 0.23 -1.26 -5.04 115.26 119.80 1nyq n ASN 113 Ca 0.09 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.14 1nyq n ASN 113 Cb 0.62 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.32 1nyq n ASN 113 CO 0.00 0.00 0.00 2.30 -0.93 0.00 0.00 177.26 178.63 1nyq n ILE 114 N -0.86 0.00 -4.46 1.53 -5.35 -1.26 -4.92 119.36 104.03 1nyq n ILE 114 Ca 0.00 0.00 -0.22 0.00 -0.27 0.00 0.00 62.75 62.26 1nyq n ILE 114 Cb 0.00 0.00 -0.11 0.00 -1.74 0.00 0.00 39.64 37.79 1nyq n ILE 114 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 1nyq s SER 115 N 0.00 2.56 0.30 7.28 1.04 -1.26 -4.91 113.70 118.71 1nyq s SER 115 Ca 0.00 -1.36 0.04 0.00 0.48 0.00 0.00 55.95 55.12 1nyq s SER 115 Cb 0.00 -0.12 0.24 0.00 0.10 0.00 0.00 66.02 66.23 1nyq s SER 115 CO 0.00 -0.57 0.92 -0.24 0.98 0.00 0.00 173.24 174.33 1nyq n SER 116 N -0.70 0.11 0.12 7.02 2.88 -1.26 0.96 113.62 122.75 1nyq n SER 116 Ca -0.03 0.34 -0.01 0.00 -1.33 0.00 0.00 58.87 57.84 1nyq n SER 116 Cb 0.66 -0.17 0.04 0.00 -0.75 0.00 0.00 64.21 63.99 1nyq n SER 116 CO 0.00 0.00 0.00 0.44 -1.23 0.00 0.00 175.04 174.25 1nyq h ASP 117 N 0.00 0.00 0.23 -3.46 5.19 -1.99 -3.29 116.42 113.10 1nyq h ASP 117 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1nyq h ASP 117 Cb 1.15 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.66 1nyq h ASP 117 CO 0.00 0.68 -0.29 0.47 -3.12 0.00 0.00 179.24 176.98 1nyq n ASP 118 N -3.38 1.07 -0.08 6.45 8.00 0.27 -4.28 116.55 124.60 1nyq n ASP 118 Ca 0.01 -0.91 0.24 0.00 0.71 0.00 0.00 54.79 54.84 1nyq n ASP 118 Cb 0.76 0.17 0.71 0.00 -0.02 0.00 0.00 41.12 42.74 1nyq n ASP 118 CO 0.00 0.00 0.00 -0.26 -0.39 0.00 0.00 177.20 176.55 1nyq h PHE 119 N 1.24 0.00 -0.01 1.24 0.04 -1.66 0.10 116.94 117.89 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 0.52 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.67 1nyq h PHE 119 CO 0.00 0.00 0.00 -1.91 -0.60 0.00 0.00 178.31 175.80 1nyq n GLU 120 N -4.32 1.32 -0.07 1.51 2.13 -1.26 -2.15 120.64 117.80 1nyq n GLU 120 Ca 0.14 -0.47 -0.16 0.00 0.66 0.00 0.00 57.16 57.33 1nyq n GLU 120 Cb 0.78 -1.48 -0.05 0.00 0.27 0.00 0.00 31.44 30.95 1nyq n GLU 120 CO 0.00 0.00 0.00 1.04 -0.41 0.00 0.00 177.13 177.76 1nyq n GLN 121 N -0.43 0.33 -0.28 5.31 1.13 0.26 -3.50 117.38 120.21 1nyq n GLN 121 Ca 0.21 0.14 0.11 0.00 -1.94 0.00 0.00 57.00 55.53 1nyq n GLN 121 Cb 0.23 -1.06 0.37 0.00 0.11 0.00 0.00 30.24 29.88 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 -0.57 0.84 0.23 5.09 2.04 -1.40 0.16 117.51 123.91 1nyq h ILE 122 Ca -0.35 -0.25 -0.01 0.00 1.00 0.00 0.00 64.86 65.25 1nyq h ILE 122 Cb 1.26 0.06 0.00 0.00 -0.74 0.00 0.00 36.82 37.40 1nyq h ILE 122 CO -0.21 0.13 -0.11 -0.33 0.00 0.00 0.00 178.15 177.62 1nyq h GLU 123 N 0.72 -0.30 -0.92 2.37 5.08 -1.65 0.25 114.58 120.13 1nyq h GLU 123 Ca 0.45 0.02 0.22 0.00 -1.00 0.00 0.00 59.36 59.05 1nyq h GLU 123 Cb 0.69 0.07 -0.07 0.00 0.50 0.00 0.00 28.75 29.95 1nyq h GLU 123 CO -0.21 0.06 0.61 -0.22 -1.00 0.00 0.00 179.01 178.26 1nyq h LYS 124 N -0.77 0.34 0.02 2.33 3.64 -1.40 0.04 116.57 120.77 1nyq h LYS 124 Ca -0.03 -0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.28 1nyq h LYS 124 Cb 0.51 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.25 1nyq h LYS 124 CO 0.05 0.23 -0.21 1.15 -2.27 0.00 0.00 179.45 178.40 1nyq h THR 125 N 0.35 1.70 0.00 1.00 2.02 -0.60 -2.39 112.91 114.99 1nyq h THR 125 Ca 0.48 -2.37 0.00 0.00 0.77 0.00 0.00 66.41 65.29 1nyq h THR 125 Cb 1.29 3.30 0.00 0.00 -1.74 0.00 0.00 68.15 70.99 1nyq h THR 125 CO -0.17 0.61 0.05 1.15 0.37 0.00 0.00 175.52 177.53 1nyq n MET 126 N -4.52 0.07 -0.06 6.66 0.00 0.89 -0.46 117.12 119.70 1nyq n MET 126 Ca -0.12 0.55 -0.05 0.00 0.00 0.00 0.00 57.70 58.09 1nyq n MET 126 Cb 0.55 -1.80 -0.04 0.00 0.00 0.00 0.00 33.22 31.93 1nyq n MET 126 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 175.97 175.75 1nyq h LYS 127 N 0.00 0.00 -1.00 3.17 3.64 -0.91 -3.11 116.57 118.37 1nyq h LYS 127 Ca 0.00 0.00 0.34 0.00 -1.27 0.00 0.00 60.65 59.72 1nyq h LYS 127 Cb 0.11 0.00 -0.16 0.00 -0.41 0.00 0.00 32.23 31.77 1nyq h LYS 127 CO 0.00 0.32 0.54 1.96 -2.27 0.00 0.00 179.45 180.00 1nyq h GLN 128 N -1.00 0.24 0.00 1.90 4.20 -0.23 0.95 115.11 121.16 1nyq h GLN 128 Ca -0.00 -0.01 -0.08 0.00 0.06 0.00 0.00 58.65 58.62 1nyq h GLN 128 Cb 0.32 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.04 1nyq h GLN 128 CO -0.00 0.16 -0.37 -0.84 -0.67 0.00 0.00 178.83 177.11 1nyq h ILE 129 N 0.25 0.82 -0.09 2.54 -0.00 -1.36 -2.64 117.51 117.02 1nyq h ILE 129 Ca 0.75 -1.58 -0.16 0.00 -0.00 0.00 0.00 64.86 63.87 1nyq h ILE 129 Cb 1.76 1.99 -0.01 0.00 -0.00 0.00 0.00 36.82 40.56 1nyq h ILE 129 CO -0.65 0.37 -0.62 0.58 -0.00 0.00 0.00 178.15 177.83 1nyq h VAL 130 N 0.00 1.37 -0.02 0.16 2.07 0.99 -3.05 116.25 117.78 1nyq h VAL 130 Ca -0.00 -1.98 -0.14 0.00 0.82 0.00 0.00 66.70 65.40 1nyq h VAL 130 Cb 0.96 1.98 -0.02 0.00 -1.52 0.00 0.00 31.29 32.70 1nyq h VAL 130 CO 0.05 0.59 -0.64 0.78 0.02 0.00 0.00 177.57 178.37 1nyq h ASN 131 N 0.25 0.08 -0.06 0.57 2.35 -1.25 -2.28 115.58 115.24 1nyq h ASN 131 Ca -0.01 -0.05 0.00 0.00 -0.55 0.00 0.00 56.30 55.69 1nyq h ASN 131 Cb 1.15 -0.02 -0.00 0.00 0.05 0.00 0.00 38.32 39.49 1nyq h ASN 131 CO 0.10 0.70 0.04 -0.33 -1.65 0.00 0.00 177.43 176.29 1nyq h GLU 132 N 0.05 0.07 -5.49 0.81 5.08 -1.36 -3.46 114.58 110.28 1nyq h GLU 132 Ca -0.01 -0.00 -0.33 0.00 -1.00 0.00 0.00 59.36 58.02 1nyq h GLU 132 Cb 1.14 -0.02 0.16 0.00 0.50 0.00 0.00 28.75 30.53 1nyq h GLU 132 CO 0.09 0.05 -0.72 -1.71 -1.00 0.00 0.00 179.01 175.72 1nyq n ASN 133 N -4.53 -2.75 -4.61 1.42 4.05 -0.86 -4.98 115.26 103.00 1nyq n ASN 133 Ca -0.02 -0.58 -0.28 0.00 0.45 0.00 0.00 54.58 54.15 1nyq n ASN 133 Cb 0.09 -4.89 0.20 0.00 1.23 0.00 0.00 39.78 36.41 1nyq n ASN 133 CO 0.00 0.00 0.00 -0.04 -3.05 0.00 0.00 177.26 174.17 1nyq s MET 134 N -5.46 -0.01 -0.24 1.20 -1.94 -1.26 -5.00 119.30 106.60 1nyq s MET 134 Ca 0.10 0.53 -0.06 0.00 -1.71 0.00 0.00 55.69 54.54 1nyq s MET 134 Cb -0.04 -1.69 -0.02 0.00 2.01 0.00 0.00 34.83 35.09 1nyq s MET 134 CO 0.69 -3.03 0.02 0.21 -0.01 0.00 0.00 175.02 172.91 1nyq s LYS 135 N -4.88 3.53 0.08 2.03 2.47 -1.26 -4.65 119.74 117.07 1nyq s LYS 135 Ca 0.66 -0.54 -0.30 0.00 -1.56 0.00 0.00 55.97 54.23 1nyq s LYS 135 Cb -0.20 -3.18 -0.06 0.00 -1.46 0.00 0.00 37.83 32.93 1nyq s LYS 135 CO 0.59 -0.19 1.18 0.42 0.16 0.00 0.00 175.35 177.51 1nyq s ILE 136 N 1.54 4.04 0.11 5.43 1.01 -1.26 -4.46 121.20 127.61 1nyq s ILE 136 Ca 0.06 1.50 0.07 0.00 0.00 0.00 0.00 60.65 62.28 1nyq s ILE 136 Cb -0.15 -3.96 -0.04 0.00 0.01 0.00 0.00 42.46 38.33 1nyq s ILE 136 CO 0.01 0.14 -0.18 -1.61 0.00 0.00 0.00 174.94 173.29 1nyq s GLU 137 N 0.85 1.08 -0.16 2.79 2.02 0.16 -4.99 118.70 120.45 1nyq s GLU 137 Ca 0.57 -1.18 -0.05 0.00 0.02 0.00 0.00 54.97 54.33 1nyq s GLU 137 Cb -0.29 -1.22 -0.03 0.00 0.10 0.00 0.00 34.13 32.69 1nyq s GLU 137 CO 0.30 0.27 0.01 0.50 0.02 0.00 0.00 175.26 176.36 1nyq s ARG 138 N -2.13 3.78 -0.00 1.61 3.00 -1.26 -0.69 118.95 123.26 1nyq s ARG 138 Ca 0.07 -0.44 0.04 0.00 -1.00 0.00 0.00 55.73 54.40 1nyq s ARG 138 Cb -0.09 -3.04 -0.03 0.00 0.00 0.00 0.00 34.95 31.79 1nyq s ARG 138 CO 0.04 0.28 -0.10 0.15 0.00 0.00 0.00 175.30 175.66 1nyq s LYS 139 N 0.31 2.46 -0.61 5.12 1.02 -0.16 -4.95 119.74 122.94 1nyq s LYS 139 Ca -0.00 -0.75 0.06 0.00 0.02 0.00 0.00 55.97 55.29 1nyq s LYS 139 Cb -0.13 -2.42 0.26 0.00 -0.52 0.00 0.00 37.83 35.01 1nyq s LYS 139 CO 0.02 0.60 0.74 0.28 -0.92 0.00 0.00 175.35 176.06 1nyq n VAL 140 N 1.75 2.09 -2.80 3.17 0.31 -1.26 -0.34 118.33 121.24 1nyq n VAL 140 Ca -0.16 -5.12 -0.21 0.00 -0.01 0.00 0.00 64.34 58.84 1nyq n VAL 140 Cb 0.52 -2.03 0.03 0.00 -0.91 0.00 0.00 33.84 31.45 1nyq n VAL 140 CO 0.00 0.00 0.00 0.68 -1.32 0.00 0.00 176.83 176.19 1nyq s VAL 141 N -2.48 3.02 0.34 2.52 -7.23 -1.23 -5.01 120.40 110.34 1nyq s VAL 141 Ca 0.40 -0.71 0.00 0.00 -1.81 0.00 0.00 61.98 59.87 1nyq s VAL 141 Cb 0.16 -3.10 -0.03 0.00 0.56 0.00 0.00 36.38 33.96 1nyq s VAL 141 CO -0.03 -0.07 0.54 -0.44 -0.31 0.00 0.00 175.10 174.80 1nyq s SER 142 N -4.37 6.30 0.20 4.85 0.01 -1.26 -4.49 113.70 114.94 1nyq s SER 142 Ca 0.55 0.46 -0.13 0.00 1.31 0.00 0.00 55.95 58.13 1nyq s SER 142 Cb -0.10 -2.03 0.23 0.00 0.21 0.00 0.00 66.02 64.32 1nyq s SER 142 CO 0.37 -0.29 1.28 0.54 0.41 0.00 0.00 173.24 175.55 1nyq n ARG 143 N -1.73 -0.17 -0.03 12.44 1.74 -1.26 -1.10 116.66 126.55 1nyq n ARG 143 Ca -0.05 1.27 -0.12 0.00 -0.77 0.00 0.00 57.85 58.18 1nyq n ARG 143 Cb 0.56 -1.88 -0.08 0.00 -1.02 0.00 0.00 32.46 30.04 1nyq n ARG 143 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 1nyq h ASP 144 N 0.00 -1.42 -0.18 0.55 3.32 -1.99 0.48 116.42 117.19 1nyq h ASP 144 Ca 0.30 0.17 0.05 0.00 0.02 0.00 0.00 57.03 57.57 1nyq h ASP 144 Cb 0.51 0.56 -0.05 0.00 0.22 0.00 0.00 39.33 40.57 1nyq h ASP 144 CO -0.82 -0.38 -0.13 -0.33 -1.72 0.00 0.00 179.24 175.86 1nyq h GLU 145 N -0.44 -0.13 0.54 3.56 3.07 -1.50 -2.55 114.58 117.12 1nyq h GLU 145 Ca 0.03 0.01 -0.02 0.00 -0.50 0.00 0.00 59.36 58.88 1nyq h GLU 145 Cb 0.54 0.03 -0.00 0.00 -0.84 0.00 0.00 28.75 28.48 1nyq h GLU 145 CO -0.38 -0.09 -0.31 0.00 -1.40 0.00 0.00 179.01 176.83 1nyq h ALA 146 N 0.98 -1.16 -0.85 3.43 0.00 -0.90 -0.17 119.26 120.59 1nyq h ALA 146 Ca 0.11 -0.17 0.19 0.00 0.00 0.00 0.00 54.91 55.04 1nyq h ALA 146 Cb 0.29 0.41 -0.16 0.00 0.00 0.00 0.00 17.79 18.33 1nyq h ALA 146 CO -0.26 -1.13 -0.11 -0.22 0.00 0.00 0.00 179.25 177.53 1nyq h LYS 147 N -0.79 0.03 -0.15 0.00 3.11 -0.02 0.69 116.57 119.43 1nyq h LYS 147 Ca -0.07 -0.00 -0.02 0.00 -2.81 0.00 0.00 60.65 57.74 1nyq h LYS 147 Cb 0.63 -0.01 -0.01 0.00 -1.00 0.00 0.00 32.23 31.85 1nyq h LYS 147 CO 0.09 0.02 0.01 0.93 -2.81 0.00 0.00 179.45 177.68 1nyq h GLU 148 N 0.03 0.26 -0.74 1.90 3.07 -1.46 -3.12 114.58 114.53 1nyq h GLU 148 Ca 0.44 -0.08 0.15 0.00 -0.50 0.00 0.00 59.36 59.37 1nyq h GLU 148 Cb 0.76 -0.03 -0.14 0.00 -0.84 0.00 0.00 28.75 28.50 1nyq h GLU 148 CO -0.83 0.48 -0.20 1.25 -1.40 0.00 0.00 179.01 178.31 1nyq h LEU 149 N 0.01 -0.73 -6.52 1.33 5.85 0.21 -2.96 115.31 112.51 1nyq h LEU 149 Ca 0.04 0.23 -0.73 0.00 0.84 0.00 0.00 57.88 58.26 1nyq h LEU 149 Cb 0.35 0.47 -0.11 0.00 0.37 0.00 0.00 40.66 41.75 1nyq h LEU 149 CO 0.01 -0.25 2.37 0.49 -0.34 0.00 0.00 178.44 180.71 1nyq n PHE 150 N -5.49 3.47 0.00 1.25 3.01 0.97 -4.82 117.46 115.85 1nyq n PHE 150 Ca 0.10 -2.91 0.00 0.00 1.01 0.00 0.00 57.45 55.65 1nyq n PHE 150 Cb 0.38 -2.24 0.00 0.00 -0.01 0.00 0.00 39.48 37.61 1nyq n PHE 150 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 1nyq n SER 151 N 5.15 0.00 0.00 4.37 2.88 -1.12 -4.04 113.62 120.86 1nyq n SER 151 Ca 0.44 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.98 1nyq n SER 151 Cb 0.39 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.85 1nyq n SER 151 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1nyq n ASN 152 N 0.00 0.00 -4.08 -3.46 4.13 -1.26 -3.79 115.26 106.80 1nyq n ASN 152 Ca 0.00 0.04 -0.35 0.00 1.68 0.00 0.00 54.58 55.95 1nyq n ASN 152 Cb 0.00 -0.04 -0.08 0.00 -1.54 0.00 0.00 39.78 38.12 1nyq n ASN 152 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 1nyq s ASP 153 N -1.61 5.62 0.49 6.41 -1.08 -1.26 -4.87 116.67 120.36 1nyq s ASP 153 Ca 0.00 -3.47 0.23 0.00 -0.52 0.00 0.00 52.55 48.79 1nyq s ASP 153 Cb 0.00 -1.86 1.29 0.00 -1.46 0.00 0.00 42.92 40.89 1nyq s ASP 153 CO 0.00 -0.23 1.92 1.05 0.52 0.00 0.00 175.17 178.43 1nyq h GLU 154 N 6.25 0.17 -0.56 4.34 9.09 -1.83 -0.36 114.58 131.68 1nyq h GLU 154 Ca 0.10 -0.01 -0.11 0.00 0.05 0.00 0.00 59.36 59.39 1nyq h GLU 154 Cb 0.85 -0.04 -0.02 0.00 -1.65 0.00 0.00 28.75 27.89 1nyq h GLU 154 CO 0.79 0.11 -0.09 1.88 0.05 0.00 0.00 179.01 181.76 1nyq h TYR 155 N 0.17 1.16 -0.41 2.06 0.05 -1.89 -2.08 116.97 116.02 1nyq h TYR 155 Ca 0.37 -0.23 -0.08 0.00 0.05 0.00 0.00 58.73 58.84 1nyq h TYR 155 Cb 1.21 -0.29 -0.01 0.00 1.01 0.00 0.00 36.73 38.64 1nyq h TYR 155 CO -0.00 1.06 -0.04 0.87 -1.05 0.00 0.00 178.16 178.99 1nyq h LYS 156 N 0.92 0.76 0.19 4.88 1.79 -1.29 -2.27 116.57 121.55 1nyq h LYS 156 Ca 0.15 -0.26 0.01 0.00 -2.18 0.00 0.00 60.65 58.36 1nyq h LYS 156 Cb 0.65 -0.06 -0.02 0.00 -1.58 0.00 0.00 32.23 31.23 1nyq h LYS 156 CO 0.05 0.86 -0.20 -0.07 -1.08 0.00 0.00 179.45 179.01 1nyq h LEU 157 N 0.58 -0.54 -0.66 2.94 3.38 -1.38 0.19 115.31 119.82 1nyq h LEU 157 Ca 0.11 0.05 0.14 0.00 0.09 0.00 0.00 57.88 58.27 1nyq h LEU 157 Cb 0.55 0.19 -0.12 0.00 0.09 0.00 0.00 40.66 41.36 1nyq h LEU 157 CO 0.03 -0.30 -0.12 -0.33 0.09 0.00 0.00 178.44 177.82 1nyq h GLU 158 N -0.42 0.03 0.69 1.13 4.39 -1.28 0.52 114.58 119.64 1nyq h GLU 158 Ca 0.00 -0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.67 1nyq h GLU 158 Cb 0.40 -0.01 0.01 0.00 -0.10 0.00 0.00 28.75 29.06 1nyq h GLU 158 CO -0.06 0.02 -0.33 -0.07 -1.16 0.00 0.00 179.01 177.41 1nyq h LEU 159 N 0.03 -0.79 -1.77 1.33 4.07 -0.81 -2.64 115.31 114.73 1nyq h LEU 159 Ca 0.33 0.01 0.15 0.00 0.08 0.00 0.00 57.88 58.44 1nyq h LEU 159 Cb 0.52 0.20 -0.04 0.00 1.08 0.00 0.00 40.66 42.43 1nyq h LEU 159 CO -0.65 -0.51 0.44 -0.29 -1.08 0.00 0.00 178.44 176.35 1nyq h ILE 160 N -1.01 0.77 -2.18 1.22 6.09 0.08 -3.42 117.51 119.06 1nyq h ILE 160 Ca -0.10 -0.08 -0.57 0.00 -1.37 0.00 0.00 64.86 62.75 1nyq h ILE 160 Cb 0.73 0.52 0.02 0.00 0.47 0.00 0.00 36.82 38.57 1nyq h ILE 160 CO 0.16 0.04 1.22 -0.67 -3.07 0.00 0.00 178.15 175.83 1nyq n ASP 161 N -4.43 3.81 0.00 2.19 2.03 0.18 -4.90 116.55 115.43 1nyq n ASP 161 Ca 0.12 0.85 0.00 0.00 0.52 0.00 0.00 54.79 56.28 1nyq n ASP 161 Cb 0.56 -1.47 0.00 0.00 -0.72 0.00 0.00 41.12 39.48 1nyq n ASP 161 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1nyq n ALA 162 N 7.67 0.00 -1.32 -1.67 0.00 -1.26 -4.98 120.51 118.95 1nyq n ALA 162 Ca 0.22 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.62 1nyq n ALA 162 Cb 0.37 0.00 0.21 0.00 0.00 0.00 0.00 19.45 20.03 1nyq n ALA 162 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1nyq n ILE 163 N 0.00 2.60 0.00 0.00 5.41 -1.26 -4.99 119.36 121.12 1nyq n ILE 163 Ca 0.00 -2.43 0.00 0.00 1.00 0.00 0.00 62.75 61.32 1nyq n ILE 163 Cb 0.00 -0.33 0.00 0.00 -0.71 0.00 0.00 39.64 38.60 1nyq n ILE 163 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 1nyq n PRO 164 N -0.97 0.00 -0.03 0.38 -0.02 -1.26 -5.05 135.00 128.06 1nyq n PRO 164 Ca 0.35 0.00 -0.03 0.00 -2.02 0.00 0.00 63.50 61.79 1nyq n PRO 164 Cb 1.10 0.00 -0.01 0.00 -0.02 0.00 0.00 33.50 34.57 1nyq n PRO 164 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 1nyq n GLU 165 N 0.00 0.20 -3.22 -0.52 0.00 -1.26 -5.00 120.64 110.84 1nyq n GLU 165 Ca 0.00 0.08 -0.41 0.00 0.00 0.00 0.00 57.16 56.83 1nyq n GLU 165 Cb 0.00 -0.78 -0.08 0.00 0.00 0.00 0.00 31.44 30.59 1nyq n GLU 165 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 1nyq s ASP 166 N -5.13 6.37 -0.01 -1.84 1.11 -1.26 -5.05 116.67 110.86 1nyq s ASP 166 Ca -0.11 0.21 -0.29 0.00 0.18 0.00 0.00 52.55 52.54 1nyq s ASP 166 Cb 0.01 -2.28 0.08 0.00 1.07 0.00 0.00 42.92 41.81 1nyq s ASP 166 CO 0.16 -0.42 0.73 -0.70 1.18 0.00 0.00 175.17 176.12 1nyq s GLU 167 N 2.40 1.02 -0.15 8.23 2.12 -1.26 -5.14 118.70 125.92 1nyq s GLU 167 Ca 0.20 0.01 -0.04 0.00 0.36 0.00 0.00 54.97 55.51 1nyq s GLU 167 Cb -0.15 0.47 0.06 0.00 0.26 0.00 0.00 34.13 34.77 1nyq s GLU 167 CO 0.12 -0.36 0.11 -0.80 -0.54 0.00 0.00 175.26 173.79 1nyq s ASN 168 N -1.67 1.90 -0.25 -1.70 0.02 -1.26 -5.12 114.94 106.85 1nyq s ASN 168 Ca -0.05 -0.38 -0.08 0.00 -1.02 0.00 0.00 52.86 51.33 1nyq s ASN 168 Cb -0.00 -0.09 -0.03 0.00 0.02 0.00 0.00 41.25 41.15 1nyq s ASN 168 CO 0.01 -0.32 0.09 0.68 0.02 0.00 0.00 177.10 177.58 1nyq s VAL 169 N 2.19 4.50 0.34 1.60 -7.23 -1.26 -5.09 120.40 115.45 1nyq s VAL 169 Ca 0.03 -0.11 0.09 0.00 -1.81 0.00 0.00 61.98 60.19 1nyq s VAL 169 Cb -0.15 -3.11 -0.06 0.00 0.56 0.00 0.00 36.38 33.61 1nyq s VAL 169 CO -0.08 0.33 -0.09 0.42 -0.31 0.00 0.00 175.10 175.37 1nyq s THR 170 N 1.58 2.18 -0.01 5.32 -4.23 -1.26 -3.52 115.64 115.70 1nyq s THR 170 Ca 0.06 -2.19 0.03 0.00 -1.18 0.00 0.00 61.69 58.42 1nyq s THR 170 Cb -0.15 -2.65 -0.01 0.00 1.34 0.00 0.00 72.50 71.04 1nyq s THR 170 CO 0.05 -0.20 -0.11 -0.76 -0.54 0.00 0.00 174.62 173.05 1nyq s LEU 171 N -3.60 2.01 -0.30 4.79 1.43 0.54 -4.09 118.68 119.46 1nyq s LEU 171 Ca 0.32 -0.21 -0.17 0.00 -1.03 0.00 0.00 54.13 53.04 1nyq s LEU 171 Cb 0.03 -0.59 -0.02 0.00 0.03 0.00 0.00 46.19 45.64 1nyq s LEU 171 CO 0.16 0.14 0.48 -0.47 0.23 0.00 0.00 176.35 176.89 1nyq s TYR 172 N -0.24 3.23 -0.13 0.29 5.04 -0.85 -0.98 117.35 123.70 1nyq s TYR 172 Ca 0.04 0.40 0.02 0.00 -2.44 0.00 0.00 57.07 55.09 1nyq s TYR 172 Cb -0.05 -2.77 0.01 0.00 0.35 0.00 0.00 41.96 39.51 1nyq s TYR 172 CO -0.00 -0.37 -0.18 0.45 -1.34 0.00 0.00 175.55 174.10 1nyq s SER 173 N 1.65 2.80 -0.76 4.32 0.15 0.13 -2.38 113.70 119.61 1nyq s SER 173 Ca 0.19 -0.52 0.03 0.00 0.70 0.00 0.00 55.95 56.34 1nyq s SER 173 Cb -0.16 -1.28 0.30 0.00 -1.71 0.00 0.00 66.02 63.18 1nyq s SER 173 CO 0.11 0.03 1.14 1.67 1.20 0.00 0.00 173.24 177.39 1nyq n GLN 174 N 4.24 3.64 0.00 5.44 7.27 -0.98 -0.67 117.38 136.32 1nyq n GLN 174 Ca -0.19 -4.72 0.00 0.00 0.07 0.00 0.00 57.00 52.15 1nyq n GLN 174 Cb 0.51 -2.33 0.00 0.00 2.41 0.00 0.00 30.24 30.83 1nyq n GLN 174 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1nyq n GLY 175 N 0.39 0.00 0.00 1.69 0.00 -1.26 -3.64 105.19 102.36 1nyq n GLY 175 Ca 0.33 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.35 1nyq n GLY 175 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1nyq n ASP 176 N 0.00 0.00 -4.74 1.61 -0.08 -1.26 -4.95 116.55 107.13 1nyq n ASP 176 Ca 0.00 0.00 -0.41 0.00 -1.51 0.00 0.00 54.79 52.87 1nyq n ASP 176 Cb 0.00 0.00 -0.03 0.00 2.34 0.00 0.00 41.12 43.43 1nyq n ASP 176 CO 0.00 0.00 0.00 0.12 0.12 0.00 0.00 177.20 177.44 1nyq s PHE 177 N 0.00 3.20 -0.09 -0.67 5.36 -1.24 -5.02 117.98 119.52 1nyq s PHE 177 Ca 0.00 1.12 0.01 0.00 -0.96 0.00 0.00 56.93 57.10 1nyq s PHE 177 Cb 0.00 -3.67 0.02 0.00 -0.34 0.00 0.00 43.02 39.03 1nyq s PHE 177 CO 0.00 -2.17 -0.11 0.99 -1.46 0.00 0.00 175.22 172.48 1nyq s THR 178 N 0.26 1.13 0.34 0.12 2.01 -1.26 -2.31 115.64 115.92 1nyq s THR 178 Ca 0.59 -0.42 0.07 0.00 0.31 0.00 0.00 61.69 62.24 1nyq s THR 178 Cb -0.38 -1.07 -0.07 0.00 0.01 0.00 0.00 72.50 70.99 1nyq s THR 178 CO 0.38 0.37 -0.03 -0.62 -0.69 0.00 0.00 174.62 174.03 1nyq s ASP 179 N 1.11 3.18 -0.82 3.53 2.15 -1.00 -5.01 116.67 119.81 1nyq s ASP 179 Ca -0.06 -1.27 0.01 0.00 0.43 0.00 0.00 52.55 51.65 1nyq s ASP 179 Cb -0.14 -0.25 0.34 0.00 -0.30 0.00 0.00 42.92 42.57 1nyq s ASP 179 CO -0.02 -0.39 1.61 -0.11 -0.17 0.00 0.00 175.17 176.09 1nyq n LEU 180 N -0.75 6.49 -4.83 -1.34 0.00 -1.26 -2.00 117.00 113.31 1nyq n LEU 180 Ca -0.05 -5.29 -0.22 0.00 0.00 0.00 0.00 56.01 50.46 1nyq n LEU 180 Cb 0.65 -0.93 -0.04 0.00 0.00 0.00 0.00 43.42 43.10 1nyq n LEU 180 CO 0.43 2.06 -0.12 0.00 0.00 0.00 0.00 177.39 179.76 1nyq n ARG 182 N -1.28 4.19 -1.88 0.00 1.74 -1.26 -4.07 116.66 114.10 1nyq n ARG 182 Ca -0.04 0.00 -0.33 0.00 -0.77 0.00 0.00 57.85 56.71 1nyq n ARG 182 Cb 0.59 -0.32 0.03 0.00 -1.02 0.00 0.00 32.46 31.74 1nyq n ARG 182 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1nyq s GLY 183 N -0.63 2.13 0.21 -0.13 0.00 -1.26 -4.99 107.32 102.65 1nyq s GLY 183 Ca 0.00 0.47 -0.31 0.00 0.00 0.00 0.00 44.72 44.88 1nyq s GLY 183 CO 0.00 0.80 1.51 0.14 0.00 0.00 0.00 173.10 175.56 1nyq s VAL 184 N -2.40 2.60 0.38 1.40 1.01 -1.26 -5.04 120.40 117.09 1nyq s VAL 184 Ca 0.65 0.47 0.08 0.00 0.00 0.00 0.00 61.98 63.17 1nyq s VAL 184 Cb -0.18 -3.30 -0.03 0.00 0.00 0.00 0.00 36.38 32.87 1nyq s VAL 184 CO 0.40 0.06 0.29 -1.00 0.00 0.00 0.00 175.10 174.84 1nyq s HIS 185 N 0.55 2.74 0.65 5.22 3.76 -1.26 -4.72 115.29 122.23 1nyq s HIS 185 Ca 0.65 -0.44 -0.17 0.00 -0.15 0.00 0.00 55.06 54.95 1nyq s HIS 185 Cb -0.43 -1.96 -0.00 0.00 1.11 0.00 0.00 32.58 31.30 1nyq s HIS 185 CO 0.38 0.08 1.22 0.54 -0.85 0.00 0.00 174.74 176.10 1nyq s VAL 186 N -2.44 2.45 -0.45 -0.90 0.11 -1.26 -4.73 120.40 113.18 1nyq s VAL 186 Ca 0.44 0.26 0.04 0.00 -2.93 0.00 0.00 61.98 59.78 1nyq s VAL 186 Cb -0.03 -2.98 0.32 0.00 -1.53 0.00 0.00 36.38 32.16 1nyq s VAL 186 CO 0.26 -0.08 1.20 -0.81 -3.33 0.00 0.00 175.10 172.33 1nyq n PRO 187 N -2.07 2.13 0.00 1.54 -0.04 -1.25 -4.80 135.00 130.51 1nyq n PRO 187 Ca 0.14 -1.31 0.00 0.00 -0.04 0.00 0.00 63.50 62.29 1nyq n PRO 187 Cb 0.50 -1.67 0.00 0.00 -0.04 0.00 0.00 33.50 32.28 1nyq n PRO 187 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1nyq n SER 188 N 0.05 0.00 -0.14 3.54 2.88 -1.26 -5.01 113.62 113.68 1nyq n SER 188 Ca 0.18 0.00 0.12 0.00 -1.33 0.00 0.00 58.87 57.84 1nyq n SER 188 Cb 0.82 0.00 0.61 0.00 -0.75 0.00 0.00 64.21 64.89 1nyq n SER 188 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 1nyq n THR 189 N -0.55 0.04 1.16 2.46 -2.24 -1.26 -3.03 114.28 110.85 1nyq n THR 189 Ca 0.00 -0.08 0.13 0.00 -2.27 0.00 0.00 64.05 61.83 1nyq n THR 189 Cb 0.00 -0.15 0.46 0.00 -2.10 0.00 0.00 70.33 68.54 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 -0.56 2.98 1.26 6.98 0.00 -1.26 -2.95 120.51 126.95 1nyq n ALA 190 Ca 0.17 -0.28 0.11 0.00 0.00 0.00 0.00 53.44 53.44 1nyq n ALA 190 Cb 0.15 -1.26 0.39 0.00 0.00 0.00 0.00 19.45 18.72 1nyq n ALA 190 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1nyq n LYS 191 N -1.22 1.71 -3.55 0.00 5.02 -1.17 -4.60 118.16 114.34 1nyq n LYS 191 Ca 0.09 -1.06 -0.41 0.00 -2.02 0.00 0.00 58.31 54.92 1nyq n LYS 191 Cb 0.32 -1.40 -0.06 0.00 -0.02 0.00 0.00 35.03 33.87 1nyq n LYS 191 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1nyq s ILE 192 N -1.80 4.58 -0.01 -0.18 1.01 -1.15 -4.81 121.20 118.83 1nyq s ILE 192 Ca 0.32 -2.92 0.00 0.00 0.00 0.00 0.00 60.65 58.05 1nyq s ILE 192 Cb 0.17 -3.89 -0.01 0.00 0.01 0.00 0.00 42.46 38.75 1nyq s ILE 192 CO 0.26 -0.97 -0.01 0.29 0.00 0.00 0.00 174.94 174.51 1nyq n LYS 193 N 3.47 0.82 -3.39 2.79 5.02 -1.26 -4.95 118.16 120.66 1nyq n LYS 193 Ca 0.12 0.01 -0.45 0.00 -2.02 0.00 0.00 58.31 55.97 1nyq n LYS 193 Cb 0.41 -1.02 -0.04 0.00 -0.02 0.00 0.00 35.03 34.36 1nyq n LYS 193 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1nyq s GLU 194 N -2.02 3.38 0.12 1.97 0.41 -1.25 -5.01 118.70 116.30 1nyq s GLU 194 Ca -0.01 -2.41 -0.06 0.00 -0.41 0.00 0.00 54.97 52.07 1nyq s GLU 194 Cb 0.00 -4.30 -0.02 0.00 -1.78 0.00 0.00 34.13 28.04 1nyq s GLU 194 CO 0.03 -1.27 0.17 -0.59 -0.49 0.00 0.00 175.26 173.11 1nyq s PHE 195 N 0.25 0.42 -0.16 1.61 -0.12 -1.26 0.11 117.98 118.82 1nyq s PHE 195 Ca 0.16 -0.83 -0.19 0.00 -0.05 0.00 0.00 56.93 56.02 1nyq s PHE 195 Cb -0.13 -0.18 0.05 0.00 -0.63 0.00 0.00 43.02 42.13 1nyq s PHE 195 CO -0.07 -0.59 0.52 0.21 -0.05 0.00 0.00 175.22 175.24 1nyq s LYS 196 N -3.94 0.67 -0.19 1.99 2.20 -0.03 -4.98 119.74 115.46 1nyq s LYS 196 Ca 0.13 0.58 -0.19 0.00 -0.36 0.00 0.00 55.97 56.13 1nyq s LYS 196 Cb 0.05 0.32 -0.03 0.00 -1.51 0.00 0.00 37.83 36.66 1nyq s LYS 196 CO -0.04 -0.11 0.56 -0.51 -0.36 0.00 0.00 175.35 174.88 1nyq s LEU 197 N -0.06 4.16 -0.04 5.43 1.43 -1.26 -1.43 118.68 126.91 1nyq s LEU 197 Ca -0.03 0.76 -0.04 0.00 -1.03 0.00 0.00 54.13 53.79 1nyq s LEU 197 Cb -0.03 -2.78 -0.01 0.00 0.03 0.00 0.00 46.19 43.39 1nyq s LEU 197 CO 0.02 -0.19 -0.07 0.18 0.23 0.00 0.00 176.35 176.52 1nyq n LEU 198 N 4.72 0.53 -4.32 1.79 4.77 0.24 -4.97 117.00 119.76 1nyq n LEU 198 Ca -0.04 0.25 -0.17 0.00 -0.03 0.00 0.00 56.01 56.02 1nyq n LEU 198 Cb 0.50 -0.59 -0.10 0.00 -2.33 0.00 0.00 43.42 40.90 1nyq n LEU 198 CO 0.43 -0.47 -0.34 -0.94 -1.33 0.00 0.00 177.39 174.74 1nyq s SER 199 N -4.31 1.83 -0.28 -1.43 1.04 -1.12 -4.96 113.70 104.48 1nyq s SER 199 Ca -0.06 -1.18 0.02 0.00 0.48 0.00 0.00 55.95 55.21 1nyq s SER 199 Cb 0.01 0.00 0.07 0.00 0.10 0.00 0.00 66.02 66.21 1nyq s SER 199 CO 0.09 -0.48 -0.03 0.42 0.98 0.00 0.00 173.24 174.22 1nyq s THR 200 N -3.40 1.83 0.00 2.02 -4.23 -1.26 -0.97 115.64 109.63 1nyq s THR 200 Ca 0.27 -1.64 0.00 0.00 -1.18 0.00 0.00 61.69 59.14 1nyq s THR 200 Cb 0.05 -2.14 0.00 0.00 1.34 0.00 0.00 72.50 71.75 1nyq s THR 200 CO 0.07 -0.26 0.00 0.00 -0.54 0.00 0.00 174.62 173.89 1nyq n ALA 201 N 4.52 0.00 -3.46 3.99 0.00 -0.44 -4.95 120.51 120.16 1nyq n ALA 201 Ca -0.08 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.20 1nyq n ALA 201 Cb 0.43 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.81 1nyq n ALA 201 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1nyq s GLY 202 N -0.94 -0.49 -0.14 0.00 0.00 -1.26 -2.83 107.32 101.65 1nyq s GLY 202 Ca 0.00 1.12 -0.30 0.00 0.00 0.00 0.00 44.72 45.54 1nyq s GLY 202 CO 0.00 0.80 0.98 0.00 0.00 0.00 0.00 173.10 174.88 1nyq s ALA 203 N -1.18 -1.92 0.79 3.20 0.00 0.10 -4.84 121.76 117.90 1nyq s ALA 203 Ca -0.11 1.52 -0.04 0.00 0.00 0.00 0.00 51.96 53.33 1nyq s ALA 203 Cb -0.01 -0.57 0.16 0.00 0.00 0.00 0.00 23.12 22.70 1nyq s ALA 203 CO 0.09 -0.36 1.04 2.48 0.00 0.00 0.00 175.76 179.01 1nyq n TYR 204 N 0.61 -3.18 -2.50 0.00 0.18 -1.26 0.18 117.16 111.19 1nyq n TYR 204 Ca -0.10 -1.58 -0.36 0.00 1.88 0.00 0.00 57.90 57.74 1nyq n TYR 204 Cb 0.58 -0.77 -0.03 0.00 -0.38 0.00 0.00 39.34 38.74 1nyq n TYR 204 CO 0.00 0.00 0.00 -0.46 -2.08 0.00 0.00 176.86 174.32 1nyq s TRP 205 N -3.16 3.15 0.00 -3.48 -0.11 -1.25 -4.28 118.94 109.81 1nyq s TRP 205 Ca 0.66 1.61 0.00 0.00 1.22 0.00 0.00 56.10 59.59 1nyq s TRP 205 Cb -0.03 -3.15 0.00 0.00 -1.50 0.00 0.00 33.47 28.79 1nyq s TRP 205 CO 0.44 -0.79 0.00 0.54 -4.62 0.00 0.00 176.95 172.52 1nyq n ARG 206 N -0.33 0.00 0.00 5.86 1.74 -1.26 -2.53 116.66 120.13 1nyq n ARG 206 Ca 0.06 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.14 1nyq n ARG 206 Cb 0.50 -0.57 0.00 0.00 -1.02 0.00 0.00 32.46 31.37 1nyq n ARG 206 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1nyq n GLY 207 N -0.26 0.89 2.64 -0.13 0.00 -1.26 -5.11 105.19 101.96 1nyq n GLY 207 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.76 1nyq n GLY 207 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1nyq s ASP 208 N -1.64 2.46 0.00 1.61 2.15 -1.05 -5.03 116.67 115.17 1nyq s ASP 208 Ca 0.00 -0.65 0.00 0.00 0.43 0.00 0.00 52.55 52.33 1nyq s ASP 208 Cb 0.00 -0.33 0.00 0.00 -0.30 0.00 0.00 42.92 42.29 1nyq s ASP 208 CO 0.00 -0.34 0.67 -1.20 -0.17 0.00 0.00 175.17 174.13 1nyq n SER 209 N 5.22 0.00 0.09 -0.34 7.64 -1.26 -3.03 113.62 121.94 1nyq n SER 209 Ca -0.07 0.21 -0.04 0.00 1.01 0.00 0.00 58.87 59.97 1nyq n SER 209 Cb 0.49 -0.21 -0.02 0.00 -1.01 0.00 0.00 64.21 63.45 1nyq n SER 209 CO 0.00 0.00 0.00 -1.13 -3.01 0.00 0.00 175.04 170.90 1nyq h ASN 210 N 0.00 -0.24 -1.07 6.43 -0.00 -1.96 -3.48 115.58 115.27 1nyq h ASN 210 Ca 0.00 0.01 -0.05 0.00 -0.00 0.00 0.00 56.30 56.26 1nyq h ASN 210 Cb 0.41 0.06 0.03 0.00 -0.00 0.00 0.00 38.32 38.82 1nyq h ASN 210 CO 0.00 0.03 -0.21 0.59 -0.00 0.00 0.00 177.43 177.84 1nyq n ASN 211 N -3.88 -2.15 -4.74 1.15 4.13 -1.17 -4.92 115.26 103.68 1nyq n ASN 211 Ca -0.03 -0.03 -0.33 0.00 1.68 0.00 0.00 54.58 55.86 1nyq n ASN 211 Cb 0.11 -0.52 0.08 0.00 -1.54 0.00 0.00 39.78 37.91 1nyq n ASN 211 CO 0.00 0.00 0.00 -0.75 0.28 0.00 0.00 177.26 176.79 1nyq s LYS 212 N -2.11 2.29 -0.64 3.52 2.47 -1.26 -4.81 119.74 119.19 1nyq s LYS 212 Ca 0.05 1.56 -0.24 0.00 -1.56 0.00 0.00 55.97 55.78 1nyq s LYS 212 Cb 0.00 -1.87 0.05 0.00 -1.46 0.00 0.00 37.83 34.55 1nyq s LYS 212 CO 0.07 -1.68 1.05 1.41 0.16 0.00 0.00 175.35 176.36 1nyq s MET 213 N -4.12 3.22 -0.25 4.03 -2.45 -1.26 -3.93 119.30 114.54 1nyq s MET 213 Ca 0.70 -0.47 -0.24 0.00 -1.25 0.00 0.00 55.69 54.43 1nyq s MET 213 Cb -0.24 -4.15 -0.01 0.00 1.25 0.00 0.00 34.83 31.68 1nyq s MET 213 CO 0.46 -1.79 0.81 -0.51 1.05 0.00 0.00 175.02 175.03 1nyq s LEU 214 N 4.48 4.08 -0.54 4.11 1.02 0.13 -4.88 118.68 127.07 1nyq s LEU 214 Ca 0.29 0.97 -0.28 0.00 0.02 0.00 0.00 54.13 55.13 1nyq s LEU 214 Cb -0.13 -3.15 0.02 0.00 0.02 0.00 0.00 46.19 42.95 1nyq s LEU 214 CO 0.15 -0.51 1.37 -1.10 0.02 0.00 0.00 176.35 176.27 1nyq s GLN 215 N 2.83 3.38 0.14 1.70 -0.21 -1.23 -0.72 119.66 125.55 1nyq s GLN 215 Ca 0.34 0.48 -0.22 0.00 0.02 0.00 0.00 55.36 55.98 1nyq s GLN 215 Cb -0.15 -4.09 -0.08 0.00 1.00 0.00 0.00 33.01 29.69 1nyq s GLN 215 CO 0.08 -1.84 0.69 0.50 -2.12 0.00 0.00 175.29 172.60 1nyq s ARG 216 N 5.32 4.36 -0.12 2.91 3.52 -1.13 -1.15 118.95 132.66 1nyq s ARG 216 Ca 0.52 0.94 0.02 0.00 -0.13 0.00 0.00 55.73 57.07 1nyq s ARG 216 Cb -0.10 -3.17 0.01 0.00 -1.56 0.00 0.00 34.95 30.13 1nyq s ARG 216 CO 0.26 0.56 -0.17 0.42 -0.81 0.00 0.00 175.30 175.56 1nyq s ILE 217 N -1.22 1.66 -0.12 4.11 1.01 -1.14 -1.33 121.20 124.16 1nyq s ILE 217 Ca 0.35 -0.73 -0.19 0.00 0.00 0.00 0.00 60.65 60.08 1nyq s ILE 217 Cb -0.20 -1.51 -0.04 0.00 0.01 0.00 0.00 42.46 40.72 1nyq s ILE 217 CO 0.23 0.47 0.52 -0.31 0.00 0.00 0.00 174.94 175.85 1nyq s TYR 218 N 1.04 3.50 0.25 3.97 2.02 -0.14 -1.58 117.35 126.40 1nyq s TYR 218 Ca -0.04 0.93 -0.10 0.00 -0.37 0.00 0.00 57.07 57.49 1nyq s TYR 218 Cb -0.15 -2.61 -0.01 0.00 -0.40 0.00 0.00 41.96 38.79 1nyq s TYR 218 CO -0.03 0.11 0.42 0.20 -1.57 0.00 0.00 175.55 174.68 1nyq s GLY 219 N 0.73 0.75 0.15 0.71 0.00 0.17 0.80 107.32 110.63 1nyq s GLY 219 Ca 0.28 -1.06 -0.09 0.00 0.00 0.00 0.00 44.72 43.84 1nyq s GLY 219 CO 0.11 -0.78 0.28 -1.08 0.00 0.00 0.00 173.10 171.63 1nyq s THR 220 N -3.96 0.08 -0.02 0.90 -1.32 -0.51 0.85 115.64 111.66 1nyq s THR 220 Ca 0.26 -1.28 -0.19 0.00 -1.21 0.00 0.00 61.69 59.27 1nyq s THR 220 Cb 0.01 -1.69 0.04 0.00 -1.51 0.00 0.00 72.50 69.35 1nyq s THR 220 CO 0.10 -0.37 0.41 0.00 -2.21 0.00 0.00 174.62 172.55 1nyq s ALA 221 N -3.93 -1.04 0.12 11.08 0.00 -1.26 -0.86 121.76 125.87 1nyq s ALA 221 Ca 0.13 0.56 0.02 0.00 0.00 0.00 0.00 51.96 52.67 1nyq s ALA 221 Cb 0.03 0.08 -0.04 0.00 0.00 0.00 0.00 23.12 23.20 1nyq s ALA 221 CO -0.03 -0.30 -0.06 -0.06 0.00 0.00 0.00 175.76 175.30 1nyq s PHE 222 N -1.41 0.98 0.04 0.00 0.08 0.29 -4.83 117.98 113.14 1nyq s PHE 222 Ca -0.12 -0.92 -0.00 0.00 0.12 0.00 0.00 56.93 56.01 1nyq s PHE 222 Cb -0.04 -0.56 -0.26 0.00 -0.57 0.00 0.00 43.02 41.60 1nyq s PHE 222 CO 0.05 -0.14 1.00 0.74 -0.10 0.00 0.00 175.22 176.77 1nyq h PHE 223 N 2.90 0.35 -3.65 0.36 0.04 -1.95 -3.31 116.94 111.70 1nyq h PHE 223 Ca -0.36 -0.26 -0.65 0.00 2.80 0.00 0.00 57.97 59.51 1nyq h PHE 223 Cb 1.17 -0.01 -0.22 0.00 2.20 0.00 0.00 35.95 39.09 1nyq h PHE 223 CO 0.59 1.26 -0.61 0.34 -0.60 0.00 0.00 178.31 179.28 1nyq s ASP 224 N -6.91 5.21 0.45 2.17 2.15 -1.26 -4.84 116.67 113.64 1nyq s ASP 224 Ca -0.05 -0.18 0.25 0.00 0.43 0.00 0.00 52.55 53.00 1nyq s ASP 224 Cb 0.08 -1.94 1.28 0.00 -0.30 0.00 0.00 42.92 42.04 1nyq s ASP 224 CO 0.85 -0.03 1.77 0.50 -0.17 0.00 0.00 175.17 178.10 1nyq h LYS 225 N 8.17 0.23 0.00 4.34 3.64 -1.95 -2.55 116.57 128.46 1nyq h LYS 225 Ca -0.38 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 58.99 1nyq h LYS 225 Cb 1.18 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.94 1nyq h LYS 225 CO 0.58 0.15 0.00 1.63 -2.27 0.00 0.00 179.45 179.54 1nyq n LYS 226 N -4.48 0.00 0.28 1.90 5.02 -1.26 -2.53 118.16 117.09 1nyq n LYS 226 Ca 0.26 0.49 0.12 0.00 -2.02 0.00 0.00 58.31 57.17 1nyq n LYS 226 Cb 1.04 -1.49 0.56 0.00 -0.02 0.00 0.00 35.03 35.12 1nyq n LYS 226 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 1nyq h GLU 227 N 0.00 0.00 0.37 1.97 5.08 -1.89 0.59 114.58 120.70 1nyq h GLU 227 Ca 0.00 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 1nyq h GLU 227 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1nyq h GLU 227 CO 0.00 0.00 -0.18 1.25 -1.00 0.00 0.00 179.01 179.08 1nyq h LEU 228 N 0.00 -0.42 -0.68 1.33 5.85 -1.28 -0.34 115.31 119.77 1nyq h LEU 228 Ca 0.05 0.01 0.10 0.00 0.84 0.00 0.00 57.88 58.88 1nyq h LEU 228 Cb 1.22 0.11 -0.11 0.00 0.37 0.00 0.00 40.66 42.24 1nyq h LEU 228 CO -0.00 -0.07 -0.46 0.11 -0.34 0.00 0.00 178.44 177.68 1nyq h LYS 229 N -0.96 -0.17 -0.72 1.25 1.79 -0.63 0.36 116.57 117.49 1nyq h LYS 229 Ca -0.05 0.01 0.13 0.00 -2.18 0.00 0.00 60.65 58.56 1nyq h LYS 229 Cb 0.38 0.04 -0.13 0.00 -1.58 0.00 0.00 32.23 30.94 1nyq h LYS 229 CO 0.08 -0.11 -0.26 0.00 -1.08 0.00 0.00 179.45 178.08 1nyq h ALA 230 N 0.68 0.26 0.17 3.86 0.00 -1.32 0.31 119.26 123.22 1nyq h ALA 230 Ca 0.19 0.24 -0.00 0.00 0.00 0.00 0.00 54.91 55.35 1nyq h ALA 230 Cb 0.55 0.70 -0.01 0.00 0.00 0.00 0.00 17.79 19.03 1nyq h ALA 230 CO -0.76 -0.53 -0.14 1.25 0.00 0.00 0.00 179.25 179.08 1nyq h HIS 231 N -0.06 -0.35 -0.10 0.00 -0.00 0.12 -1.01 115.15 113.74 1nyq h HIS 231 Ca 0.31 -0.00 -0.03 0.00 -0.00 0.00 0.00 60.37 60.65 1nyq h HIS 231 Cb 0.56 0.13 -0.01 0.00 -0.00 0.00 0.00 27.41 28.09 1nyq h HIS 231 CO -0.64 -0.21 -0.06 -0.07 -0.00 0.00 0.00 177.93 176.94 1nyq h LEU 232 N -0.32 0.13 -0.16 0.26 3.38 0.12 -0.33 115.31 118.39 1nyq h LEU 232 Ca -0.01 -0.02 -0.05 0.00 0.09 0.00 0.00 57.88 57.90 1nyq h LEU 232 Cb 0.29 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.00 1nyq h LEU 232 CO -0.01 0.22 -0.08 1.56 0.09 0.00 0.00 178.44 180.22 1nyq h GLN 233 N 0.14 0.34 -0.99 1.13 4.20 -0.18 -2.76 115.11 116.99 1nyq h GLN 233 Ca 0.03 -0.15 0.13 0.00 0.06 0.00 0.00 58.65 58.72 1nyq h GLN 233 Cb 0.21 -0.01 -0.08 0.00 0.30 0.00 0.00 27.48 27.90 1nyq h GLN 233 CO 0.01 0.65 0.63 1.98 -0.67 0.00 0.00 178.83 181.43 1nyq h MET 234 N 0.02 0.92 0.00 1.46 4.05 -0.36 -0.45 114.93 120.58 1nyq h MET 234 Ca 0.04 -0.06 0.00 0.00 -0.28 0.00 0.00 59.70 59.40 1nyq h MET 234 Cb 0.55 -0.21 0.00 0.00 -0.80 0.00 0.00 31.60 31.14 1nyq h MET 234 CO 0.02 0.61 0.00 -0.07 0.23 0.00 0.00 176.91 177.71 1nyq h LEU 235 N 0.95 0.00 0.16 3.39 3.38 -0.89 -2.56 115.31 119.74 1nyq h LEU 235 Ca 0.50 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 58.14 1nyq h LEU 235 Cb 0.54 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.29 1nyq h LEU 235 CO -0.27 0.00 -1.65 -0.08 0.09 0.00 0.00 178.44 176.53 1nyq h GLU 236 N 0.00 0.33 -0.99 1.13 4.57 -0.85 -2.01 114.58 116.76 1nyq h GLU 236 Ca 0.00 -0.57 0.07 0.00 -1.18 0.00 0.00 59.36 57.68 1nyq h GLU 236 Cb 0.66 0.21 -0.07 0.00 -0.16 0.00 0.00 28.75 29.39 1nyq h GLU 236 CO 0.00 1.27 0.64 0.93 -1.18 0.00 0.00 179.01 180.67 1nyq h GLU 237 N -0.04 1.10 0.36 1.92 5.08 -1.20 -1.45 114.58 120.36 1nyq h GLU 237 Ca -0.34 -0.07 -0.02 0.00 -1.00 0.00 0.00 59.36 57.94 1nyq h GLU 237 Cb 1.98 -0.25 0.00 0.00 0.50 0.00 0.00 28.75 30.98 1nyq h GLU 237 CO 0.13 0.73 -0.17 0.00 -1.00 0.00 0.00 179.01 178.69 1nyq h ARG 238 N 1.14 -0.47 -0.12 2.33 3.08 -1.47 -2.17 114.38 116.69 1nyq h ARG 238 Ca 0.43 0.03 0.04 0.00 0.07 0.00 0.00 59.98 60.55 1nyq h ARG 238 Cb 0.21 0.11 -0.00 0.00 0.08 0.00 0.00 29.97 30.36 1nyq h ARG 238 CO -0.18 -0.30 0.44 0.87 -1.07 0.00 0.00 179.97 179.73 1nyq h LYS 239 N -0.51 0.00 0.10 0.04 1.57 -0.50 -2.32 116.57 114.95 1nyq h LYS 239 Ca -0.05 0.00 -0.29 0.00 -1.87 0.00 0.00 60.65 58.44 1nyq h LYS 239 Cb 0.39 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.69 1nyq h LYS 239 CO 0.08 0.00 -1.41 0.93 -0.57 0.00 0.00 179.45 178.48 1nyq h GLU 240 N 0.00 0.22 -0.04 3.15 5.08 -0.76 -3.28 114.58 118.95 1nyq h GLU 240 Ca 0.06 -0.37 0.00 0.00 -1.00 0.00 0.00 59.36 58.05 1nyq h GLU 240 Cb 0.93 0.14 0.00 0.00 0.50 0.00 0.00 28.75 30.32 1nyq h GLU 240 CO -0.00 1.10 0.00 0.54 -1.00 0.00 0.00 179.01 179.65 1nyq n ARG 241 N -3.44 1.23 -1.69 2.33 1.74 -0.88 -4.60 116.66 111.35 1nyq n ARG 241 Ca -0.13 -0.34 -0.42 0.00 -0.77 0.00 0.00 57.85 56.19 1nyq n ARG 241 Cb 1.03 -1.37 -0.03 0.00 -1.02 0.00 0.00 32.46 31.07 1nyq n ARG 241 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1nyq s ASP 242 N -1.68 6.40 0.66 0.55 -1.08 -1.20 -4.19 116.67 116.12 1nyq s ASP 242 Ca 0.33 2.80 0.31 0.00 -0.52 0.00 0.00 52.55 55.47 1nyq s ASP 242 Cb 0.16 -2.57 1.68 0.00 -1.46 0.00 0.00 42.92 40.73 1nyq s ASP 242 CO 0.26 -1.01 1.96 1.12 0.52 0.00 0.00 175.17 178.02 1nyq h HIS 243 N 8.46 0.00 0.00 -5.34 2.07 -1.90 0.16 115.15 118.60 1nyq h HIS 243 Ca -0.46 0.00 -0.11 0.00 -2.85 0.00 0.00 60.37 56.95 1nyq h HIS 243 Cb 1.22 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 31.18 1nyq h HIS 243 CO 0.78 0.00 -0.53 0.00 -3.07 0.00 0.00 177.93 175.11 1nyq h ARG 244 N 0.00 0.00 0.00 5.12 3.08 -1.92 0.41 114.38 121.07 1nyq h ARG 244 Ca 0.02 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.04 1nyq h ARG 244 Cb 0.66 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.70 1nyq h ARG 244 CO -0.00 0.53 -0.23 -0.22 -1.07 0.00 0.00 179.97 178.98 1nyq h LYS 245 N 0.00 0.00 -0.22 0.04 3.64 -1.03 -3.09 116.57 115.92 1nyq h LYS 245 Ca -0.01 0.00 0.06 0.00 -1.27 0.00 0.00 60.65 59.44 1nyq h LYS 245 Cb 1.01 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.83 1nyq h LYS 245 CO 0.07 0.54 0.18 0.82 -2.27 0.00 0.00 179.45 178.78 1nyq h ILE 246 N -1.00 0.74 0.57 2.00 2.04 -1.52 0.32 117.51 120.65 1nyq h ILE 246 Ca -0.05 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.78 1nyq h ILE 246 Cb 0.64 0.87 0.01 0.00 -0.74 0.00 0.00 36.82 37.59 1nyq h ILE 246 CO -0.03 0.00 -0.27 1.23 0.00 0.00 0.00 178.15 179.08 1nyq h GLY 247 N 0.00 -0.79 0.69 5.37 0.00 -0.23 -0.89 103.07 107.21 1nyq h GLY 247 Ca 0.10 0.29 0.01 0.00 0.00 0.00 0.00 47.33 47.74 1nyq h GLY 247 CO -0.00 -0.29 -0.18 1.70 0.00 0.00 0.00 176.54 177.77 1nyq h LYS 248 N -0.78 -0.33 -0.72 4.80 3.64 -1.33 -0.89 116.57 120.95 1nyq h LYS 248 Ca -0.08 0.02 0.07 0.00 -1.27 0.00 0.00 60.65 59.39 1nyq h LYS 248 Cb 0.58 0.07 -0.09 0.00 -0.41 0.00 0.00 32.23 32.39 1nyq h LYS 248 CO 0.13 -0.22 -0.43 -1.91 -2.27 0.00 0.00 179.45 174.75 1nyq n GLU 249 N -5.30 -0.32 -0.84 1.90 2.13 0.11 -1.20 120.64 117.12 1nyq n GLU 249 Ca -0.06 1.33 -0.17 0.00 0.66 0.00 0.00 57.16 58.92 1nyq n GLU 249 Cb 0.22 -1.96 0.08 0.00 0.27 0.00 0.00 31.44 30.05 1nyq n GLU 249 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 1nyq n LEU 250 N -4.65 5.85 -4.48 4.31 4.32 -0.34 -4.90 117.00 117.10 1nyq n LEU 250 Ca 0.01 -3.07 -0.40 0.00 -0.02 0.00 0.00 56.01 52.53 1nyq n LEU 250 Cb 0.19 -0.84 -0.08 0.00 -1.62 0.00 0.00 43.42 41.07 1nyq n LEU 250 CO -0.12 1.01 -0.22 -0.62 -1.22 0.00 0.00 177.39 176.23 1nyq n GLU 251 N -0.26 -0.89 0.11 3.23 1.02 -0.34 -4.82 120.64 118.69 1nyq n GLU 251 Ca 0.36 0.14 -0.20 0.00 -0.02 0.00 0.00 57.16 57.45 1nyq n GLU 251 Cb 0.95 -4.50 -0.15 0.00 -0.02 0.00 0.00 31.44 27.72 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 -1.09 0.58 0.00 -4.62 3.38 -1.40 -3.36 115.31 108.80 1nyq h LEU 252 Ca -0.61 -0.67 0.00 0.00 0.09 0.00 0.00 57.88 56.69 1nyq h LEU 252 Cb 1.39 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.95 1nyq h LEU 252 CO 0.85 1.53 0.00 2.22 0.09 0.00 0.00 178.44 183.14 1nyq n PHE 253 N -3.58 0.00 -3.72 1.13 -1.74 -1.25 -1.82 117.46 106.47 1nyq n PHE 253 Ca -0.14 0.00 -0.08 0.00 -0.56 0.00 0.00 57.45 56.67 1nyq n PHE 253 Cb 1.06 0.00 0.00 0.00 1.52 0.00 0.00 39.48 42.06 1nyq n PHE 253 CO 0.00 0.00 0.00 0.25 -0.56 0.00 0.00 176.76 176.45 1nyq n THR 254 N -0.03 0.00 -3.57 1.97 -2.24 -0.83 -4.26 114.28 105.32 1nyq n THR 254 Ca 0.00 -0.97 -0.25 0.00 -2.27 0.00 0.00 64.05 60.56 1nyq n THR 254 Cb 0.00 0.76 -0.16 0.00 -2.10 0.00 0.00 70.33 68.83 1nyq n THR 254 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1nyq s ASN 255 N -2.55 2.30 -0.07 3.42 6.03 -1.26 0.58 114.94 123.39 1nyq s ASN 255 Ca 0.16 -0.63 -0.30 0.00 -1.03 0.00 0.00 52.86 51.05 1nyq s ASN 255 Cb -0.02 -0.10 -0.04 0.00 -3.03 0.00 0.00 41.25 38.06 1nyq s ASN 255 CO 0.11 -0.36 1.29 -0.55 -2.03 0.00 0.00 177.10 175.57 1nyq s SER 256 N 2.18 6.95 0.00 3.54 0.15 -1.26 -4.88 113.70 120.37 1nyq s SER 256 Ca 0.04 1.89 0.17 0.00 0.70 0.00 0.00 55.95 58.75 1nyq s SER 256 Cb -0.16 -2.55 0.85 0.00 -1.71 0.00 0.00 66.02 62.45 1nyq s SER 256 CO -0.14 -0.68 1.51 0.00 1.20 0.00 0.00 173.24 175.12 1nyq n GLN 257 N 5.69 0.21 0.16 5.44 10.64 -1.26 -1.26 117.38 137.01 1nyq n GLN 257 Ca 0.13 0.13 0.12 0.00 -1.83 0.00 0.00 57.00 55.55 1nyq n GLN 257 Cb 0.45 -1.50 0.09 0.00 -0.86 0.00 0.00 30.24 28.42 1nyq n GLN 257 CO 0.00 0.00 0.00 1.25 -1.83 0.00 0.00 177.06 176.48 1nyq h LEU 258 N 0.00 0.00 0.13 2.61 6.46 -2.02 -3.33 115.31 119.16 1nyq h LEU 258 Ca 0.00 0.00 -0.26 0.00 -0.12 0.00 0.00 57.88 57.50 1nyq h LEU 258 Cb 0.18 0.00 0.01 0.00 -0.73 0.00 0.00 40.66 40.11 1nyq h LEU 258 CO 0.00 0.01 -1.26 0.58 -0.62 0.00 0.00 178.44 177.15 1nyq h VAL 259 N 0.00 1.18 0.00 1.05 2.07 -1.57 -3.50 116.25 115.47 1nyq h VAL 259 Ca -0.00 -2.46 0.00 0.00 0.82 0.00 0.00 66.70 65.06 1nyq h VAL 259 Cb 1.01 2.87 0.00 0.00 -1.52 0.00 0.00 31.29 33.65 1nyq h VAL 259 CO 0.00 0.72 0.00 0.61 0.02 0.00 0.00 177.57 178.92 1nyq n GLY 260 N 1.72 4.66 3.82 2.17 0.00 -1.10 -5.03 105.19 111.43 1nyq n GLY 260 Ca -0.21 -1.26 -0.38 0.00 0.00 0.00 0.00 46.02 44.17 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 3.68 0.00 4.61 0.00 -1.26 -3.57 121.76 123.22 1nyq s ALA 261 Ca 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 51.96 51.68 1nyq s ALA 261 Cb 0.00 -2.37 0.00 0.00 0.00 0.00 0.00 23.12 20.75 1nyq s ALA 261 CO 0.00 0.41 0.00 0.41 0.00 0.00 0.00 175.76 176.58 1nyq n GLY 262 N 2.12 0.68 2.51 0.00 0.00 -1.26 -4.80 105.19 104.45 1nyq n GLY 262 Ca -0.14 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.61 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 0.00 3.04 -4.70 0.99 4.77 -1.23 0.06 117.00 119.92 1nyq n LEU 263 Ca 0.00 -5.27 -0.34 0.00 -0.03 0.00 0.00 56.01 50.37 1nyq n LEU 263 Cb 0.00 -0.50 0.12 0.00 -2.33 0.00 0.00 43.42 40.70 1nyq n LEU 263 CO 0.00 1.98 0.79 -2.16 -1.33 0.00 0.00 177.39 176.67 1nyq s PRO 264 N -2.00 1.81 -0.31 3.23 0.04 -1.26 -4.71 135.00 131.80 1nyq s PRO 264 Ca 0.35 1.80 -0.01 0.00 0.04 0.00 0.00 61.00 63.18 1nyq s PRO 264 Cb 0.10 -1.79 0.06 0.00 0.04 0.00 0.00 34.50 32.91 1nyq s PRO 264 CO -0.07 -2.10 0.01 -0.51 0.04 0.00 0.00 177.00 174.38 1nyq s LEU 265 N -5.48 4.05 -0.17 -3.56 1.43 0.20 -4.98 118.68 110.17 1nyq s LEU 265 Ca 0.74 -1.44 -0.29 0.00 -1.03 0.00 0.00 54.13 52.12 1nyq s LEU 265 Cb -0.30 -1.70 -0.04 0.00 0.03 0.00 0.00 46.19 44.19 1nyq s LEU 265 CO 0.49 -0.29 1.65 0.26 0.23 0.00 0.00 176.35 178.68 1nyq s TRP 266 N 1.20 2.04 0.76 0.29 0.52 -1.26 -1.96 118.94 120.52 1nyq s TRP 266 Ca -0.03 0.45 -0.12 0.00 0.02 0.00 0.00 56.10 56.42 1nyq s TRP 266 Cb -0.20 -3.95 0.05 0.00 -1.15 0.00 0.00 33.47 28.22 1nyq s TRP 266 CO -0.02 -3.24 1.12 -0.51 0.02 0.00 0.00 176.95 174.32 1nyq s LEU 267 N 4.96 2.69 0.26 2.99 1.43 -0.76 -4.62 118.68 125.64 1nyq s LEU 267 Ca 0.73 1.04 -0.05 0.00 -1.03 0.00 0.00 54.13 54.82 1nyq s LEU 267 Cb -0.28 -3.69 0.52 0.00 0.03 0.00 0.00 46.19 42.77 1nyq s LEU 267 CO 0.29 -1.66 1.62 -0.65 0.23 0.00 0.00 176.35 176.18 1nyq h PRO 268 N -0.88 0.09 0.70 1.29 0.11 -1.84 0.54 132.00 132.01 1nyq h PRO 268 Ca -0.46 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.62 1nyq h PRO 268 Cb 1.28 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.36 1nyq h PRO 268 CO 0.64 0.06 -0.50 -0.91 -0.21 0.00 0.00 178.00 177.08 1nyq h ASN 269 N 0.09 -1.29 -0.91 -2.05 2.35 -1.83 0.36 115.58 112.30 1nyq h ASN 269 Ca 0.46 0.08 0.03 0.00 -0.55 0.00 0.00 56.30 56.33 1nyq h ASN 269 Cb 0.85 0.39 -0.05 0.00 0.05 0.00 0.00 38.32 39.56 1nyq h ASN 269 CO -0.73 -0.73 0.59 1.23 -1.65 0.00 0.00 177.43 176.15 1nyq h GLY 270 N -1.14 1.33 0.39 2.83 0.00 -1.17 -1.65 103.07 103.65 1nyq h GLY 270 Ca -0.09 -0.45 0.04 0.00 0.00 0.00 0.00 47.33 46.83 1nyq h GLY 270 CO 0.05 0.39 -0.19 0.00 0.00 0.00 0.00 176.54 176.79 1nyq h ALA 271 N 1.37 -0.14 -0.29 3.60 0.00 0.35 -1.99 119.26 122.16 1nyq h ALA 271 Ca 0.36 0.04 0.07 0.00 0.00 0.00 0.00 54.91 55.38 1nyq h ALA 271 Cb -0.01 0.38 -0.07 0.00 0.00 0.00 0.00 17.79 18.10 1nyq h ALA 271 CO -0.12 -0.65 -0.14 1.15 0.00 0.00 0.00 179.25 179.49 1nyq h THR 272 N -0.25 0.56 -0.76 0.00 2.02 0.62 -0.82 112.91 114.28 1nyq h THR 272 Ca 0.10 0.00 0.14 0.00 0.77 0.00 0.00 66.41 67.41 1nyq h THR 272 Cb 0.39 0.56 -0.09 0.00 -1.74 0.00 0.00 68.15 67.27 1nyq h THR 272 CO -0.27 0.00 0.33 0.40 0.37 0.00 0.00 175.52 176.35 1nyq h ILE 273 N -0.10 0.69 0.70 3.11 2.04 -1.05 -1.95 117.51 120.95 1nyq h ILE 273 Ca 0.15 -0.17 -0.03 0.00 1.00 0.00 0.00 64.86 65.81 1nyq h ILE 273 Cb 0.33 0.16 -0.00 0.00 -0.74 0.00 0.00 36.82 36.57 1nyq h ILE 273 CO -0.36 0.09 -0.42 -0.09 0.00 0.00 0.00 178.15 177.37 1nyq h ARG 274 N 0.49 -1.02 -0.90 2.37 2.43 -0.48 -2.00 114.38 115.28 1nyq h ARG 274 Ca 0.41 0.07 0.23 0.00 -0.81 0.00 0.00 59.98 59.88 1nyq h ARG 274 Cb 0.59 0.23 -0.16 0.00 -0.42 0.00 0.00 29.97 30.21 1nyq h ARG 274 CO -0.38 -0.68 0.02 -0.09 -1.51 0.00 0.00 179.97 177.34 1nyq h ARG 275 N -1.05 0.06 0.16 0.20 2.43 -0.63 1.18 114.38 116.72 1nyq h ARG 275 Ca -0.09 -0.00 0.01 0.00 -0.81 0.00 0.00 59.98 59.09 1nyq h ARG 275 Cb 0.85 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.35 1nyq h ARG 275 CO 0.10 0.04 -0.26 0.93 -1.51 0.00 0.00 179.97 179.26 1nyq h GLU 276 N 0.06 -0.48 -0.59 0.20 4.39 -1.08 0.13 114.58 117.21 1nyq h GLU 276 Ca 0.52 0.03 -0.03 0.00 0.34 0.00 0.00 59.36 60.22 1nyq h GLU 276 Cb 1.02 0.11 -0.03 0.00 -0.10 0.00 0.00 28.75 29.75 1nyq h GLU 276 CO -0.81 -0.32 0.23 0.82 -1.16 0.00 0.00 179.01 177.76 1nyq h ILE 277 N -0.50 1.21 -0.19 3.13 2.04 0.68 -1.81 117.51 122.07 1nyq h ILE 277 Ca 0.02 -0.67 -0.11 0.00 1.00 0.00 0.00 64.86 65.10 1nyq h ILE 277 Cb 0.51 0.52 -0.01 0.00 -0.74 0.00 0.00 36.82 37.09 1nyq h ILE 277 CO -0.12 0.26 -0.35 -0.33 0.00 0.00 0.00 178.15 177.61 1nyq h GLU 278 N 0.84 0.39 0.00 2.37 5.08 0.18 -2.22 114.58 121.23 1nyq h GLU 278 Ca 0.20 -0.17 -0.12 0.00 -1.00 0.00 0.00 59.36 58.27 1nyq h GLU 278 Cb 0.17 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.40 1nyq h GLU 278 CO -0.02 0.69 -0.56 0.00 -1.00 0.00 0.00 179.01 178.13 1nyq h ARG 279 N 0.34 0.00 0.56 2.33 3.08 -0.45 -2.64 114.38 117.59 1nyq h ARG 279 Ca 0.04 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.06 1nyq h ARG 279 Cb 0.78 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.83 1nyq h ARG 279 CO 0.06 0.56 -0.27 -0.92 -1.07 0.00 0.00 179.97 178.33 1nyq h TYR 280 N 0.00 -0.70 0.78 3.04 3.20 -1.07 -0.55 116.97 121.67 1nyq h TYR 280 Ca -0.01 -0.02 -0.04 0.00 3.14 0.00 0.00 58.73 61.81 1nyq h TYR 280 Cb 1.42 0.23 0.00 0.00 1.54 0.00 0.00 36.73 39.92 1nyq h TYR 280 CO 0.00 -0.37 -0.40 0.97 -1.64 0.00 0.00 178.16 176.72 1nyq h ILE 281 N -0.98 0.00 -1.00 1.81 6.09 -1.48 0.37 117.51 122.32 1nyq h ILE 281 Ca -0.08 0.00 0.17 0.00 -1.37 0.00 0.00 64.86 63.59 1nyq h ILE 281 Cb 0.64 0.00 -0.10 0.00 0.47 0.00 0.00 36.82 37.83 1nyq h ILE 281 CO 0.13 0.00 0.62 0.58 -3.07 0.00 0.00 178.15 176.40 1nyq h VAL 282 N -1.08 0.76 0.55 2.19 2.07 -1.55 0.57 116.25 119.76 1nyq h VAL 282 Ca -0.11 -0.28 -0.03 0.00 0.82 0.00 0.00 66.70 67.11 1nyq h VAL 282 Cb 0.84 -0.12 0.01 0.00 -1.52 0.00 0.00 31.29 30.50 1nyq h VAL 282 CO 0.16 0.15 -0.26 0.44 0.02 0.00 0.00 177.57 178.07 1nyq h ASP 283 N 0.80 -0.63 -0.00 0.57 5.19 -0.86 0.58 116.42 122.07 1nyq h ASP 283 Ca 0.55 0.01 0.01 0.00 -0.62 0.00 0.00 57.03 56.99 1nyq h ASP 283 Cb 0.81 0.16 -0.02 0.00 0.18 0.00 0.00 39.33 40.46 1nyq h ASP 283 CO -0.34 -0.44 -0.21 0.50 -3.12 0.00 0.00 179.24 175.63 1nyq h LYS 284 N -0.75 -0.26 -0.68 3.56 3.64 0.15 0.41 116.57 122.63 1nyq h LYS 284 Ca -0.08 0.02 0.14 0.00 -1.27 0.00 0.00 60.65 59.46 1nyq h LYS 284 Cb 0.57 0.06 -0.13 0.00 -0.41 0.00 0.00 32.23 32.32 1nyq h LYS 284 CO 0.12 -0.17 -0.18 0.93 -2.27 0.00 0.00 179.45 177.89 1nyq h GLU 285 N -0.27 -0.01 0.19 1.90 5.08 0.08 0.18 114.58 121.74 1nyq h GLU 285 Ca 0.00 0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.37 1nyq h GLU 285 Cb 0.29 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.52 1nyq h GLU 285 CO -0.14 -0.00 -0.21 0.28 -1.00 0.00 0.00 179.01 177.94 1nyq h VAL 286 N -0.01 0.54 0.00 3.13 2.07 0.88 0.02 116.25 122.88 1nyq h VAL 286 Ca 0.33 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.85 1nyq h VAL 286 Cb 0.50 0.54 0.00 0.00 -1.52 0.00 0.00 31.29 30.82 1nyq h VAL 286 CO -0.70 0.00 0.00 0.77 0.02 0.00 0.00 177.57 177.66 1nyq h SER 287 N -0.44 0.00 -0.69 0.57 4.64 0.25 -1.73 113.55 116.15 1nyq h SER 287 Ca 0.00 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 61.12 1nyq h SER 287 Cb 0.42 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 62.39 1nyq h SER 287 CO -0.06 0.00 0.26 0.23 -0.87 0.00 0.00 176.83 176.39 1nyq n MET 288 N -2.72 3.48 -2.26 4.77 2.00 0.24 -4.91 117.12 117.71 1nyq n MET 288 Ca -0.02 -2.79 -0.06 0.00 0.00 0.00 0.00 57.70 54.83 1nyq n MET 288 Cb 0.07 -2.14 0.00 0.00 0.00 0.00 0.00 33.22 31.15 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 -0.12 0.21 3.89 3.03 0.00 -0.65 -5.01 105.19 106.55 1nyq n GLY 289 Ca 0.38 -0.59 -0.30 0.00 0.00 0.00 0.00 46.02 45.51 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 -2.47 3.44 -0.36 1.61 1.51 -0.70 -4.65 117.35 115.73 1nyq s TYR 290 Ca 0.04 0.18 -0.07 0.00 -1.01 0.00 0.00 57.07 56.21 1nyq s TYR 290 Cb -0.02 -1.71 0.05 0.00 -0.11 0.00 0.00 41.96 40.18 1nyq s TYR 290 CO 0.04 0.56 0.15 -0.51 -1.11 0.00 0.00 175.55 174.69 1nyq s ASP 291 N -2.65 5.41 0.28 2.29 1.01 0.66 -4.51 116.67 119.17 1nyq s ASP 291 Ca 0.34 -1.28 -0.27 0.00 0.71 0.00 0.00 52.55 52.04 1nyq s ASP 291 Cb -0.12 -1.90 -0.09 0.00 1.01 0.00 0.00 42.92 41.81 1nyq s ASP 291 CO 0.27 -0.39 0.92 -1.00 0.21 0.00 0.00 175.17 175.18 1nyq s HIS 292 N 1.40 3.82 0.36 4.23 3.76 -1.26 -1.50 115.29 126.09 1nyq s HIS 292 Ca 0.00 1.81 0.05 0.00 -0.15 0.00 0.00 55.06 56.78 1nyq s HIS 292 Cb -0.21 -2.92 -0.03 0.00 1.11 0.00 0.00 32.58 30.53 1nyq s HIS 292 CO 0.02 0.33 0.21 0.14 -0.85 0.00 0.00 174.74 174.59 1nyq s VAL 293 N -1.42 0.25 -0.03 -0.90 -7.23 -0.66 -4.91 120.40 105.51 1nyq s VAL 293 Ca 0.45 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.63 1nyq s VAL 293 Cb -0.22 -2.43 0.03 0.00 0.56 0.00 0.00 36.38 34.32 1nyq s VAL 293 CO 0.27 0.00 0.00 -0.31 -0.31 0.00 0.00 175.10 174.75 1nyq s TYR 294 N -3.38 0.35 0.06 2.82 1.51 -1.26 -4.62 117.35 112.82 1nyq s TYR 294 Ca 0.33 -0.01 0.03 0.00 -1.01 0.00 0.00 57.07 56.42 1nyq s TYR 294 Cb 0.03 -0.46 -0.03 0.00 -0.11 0.00 0.00 41.96 41.39 1nyq s TYR 294 CO 0.21 -0.15 -0.09 0.95 -1.11 0.00 0.00 175.55 175.35 1nyq s THR 295 N 1.18 0.75 0.88 -0.71 -4.23 -1.26 -5.15 115.64 107.10 1nyq s THR 295 Ca -0.08 -1.31 -0.15 0.00 -1.18 0.00 0.00 61.69 58.97 1nyq s THR 295 Cb -0.13 -0.94 -0.06 0.00 1.34 0.00 0.00 72.50 72.70 1nyq s THR 295 CO -0.02 -0.42 -0.05 -2.65 -0.54 0.00 0.00 174.62 170.93 1nyq n PRO 296 N 1.12 -0.04 -0.48 3.99 -0.02 -1.26 -4.93 135.00 133.38 1nyq n PRO 296 Ca -0.20 0.01 0.08 0.00 -2.02 0.00 0.00 63.50 61.37 1nyq n PRO 296 Cb 0.56 -1.47 0.29 0.00 -0.02 0.00 0.00 33.50 32.86 1nyq n PRO 296 CO 0.00 0.00 0.00 1.55 1.98 0.00 0.00 175.50 179.03 1nyq n VAL 297 N -2.77 1.78 -3.54 -1.45 3.14 -1.26 -4.93 118.33 109.30 1nyq n VAL 297 Ca 0.04 -1.32 -0.12 0.00 -2.96 0.00 0.00 64.34 59.98 1nyq n VAL 297 Cb 0.53 0.11 -0.04 0.00 -1.06 0.00 0.00 33.84 33.39 1nyq n VAL 297 CO 0.00 0.00 0.00 -1.48 -6.46 0.00 0.00 176.83 168.89 1nyq s LEU 298 N -1.91 -0.09 0.06 6.55 0.05 -1.26 -2.57 118.68 119.52 1nyq s LEU 298 Ca 0.43 -0.08 -0.27 0.00 0.05 0.00 0.00 54.13 54.26 1nyq s LEU 298 Cb 0.29 2.20 0.07 0.00 -2.05 0.00 0.00 46.19 46.70 1nyq s LEU 298 CO 0.19 -0.87 0.66 0.00 -0.55 0.00 0.00 176.35 175.78 1nyq s ALA 299 N -3.47 -1.69 0.19 1.48 0.00 -0.75 -4.89 121.76 112.63 1nyq s ALA 299 Ca 0.00 0.86 -0.33 0.00 0.00 0.00 0.00 51.96 52.50 1nyq s ALA 299 Cb 0.00 0.48 -0.15 0.00 0.00 0.00 0.00 23.12 23.46 1nyq s ALA 299 CO -0.10 -0.60 1.34 -1.71 0.00 0.00 0.00 175.76 174.68 1nyq n ASN 300 N 0.14 2.17 -0.38 0.00 2.85 -1.26 -2.34 115.26 116.44 1nyq n ASN 300 Ca -0.17 1.13 0.30 0.00 -0.11 0.00 0.00 54.58 55.73 1nyq n ASN 300 Cb 0.62 -1.32 0.58 0.00 1.24 0.00 0.00 39.78 40.90 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 3.03 0.33 -0.89 3.44 2.07 -1.45 -1.25 116.25 121.53 1nyq h VAL 301 Ca -0.45 -0.08 0.26 0.00 0.82 0.00 0.00 66.70 67.25 1nyq h VAL 301 Cb 1.30 0.08 -0.04 0.00 -1.52 0.00 0.00 31.29 31.11 1nyq h VAL 301 CO 0.76 0.04 0.68 0.44 0.02 0.00 0.00 177.57 179.51 1nyq h ASP 302 N 0.23 0.00 -0.64 0.57 3.32 -1.88 0.15 116.42 118.18 1nyq h ASP 302 Ca 0.70 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.70 1nyq h ASP 302 Cb 2.03 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 41.55 1nyq h ASP 302 CO -0.34 0.00 0.22 0.25 -1.72 0.00 0.00 179.24 177.65 1nyq h LEU 303 N 0.00 0.93 0.00 1.55 5.85 -1.57 -0.24 115.31 121.83 1nyq h LEU 303 Ca 0.42 -0.15 -0.21 0.00 0.84 0.00 0.00 57.88 58.78 1nyq h LEU 303 Cb 1.78 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 42.54 1nyq h LEU 303 CO -0.00 0.86 -1.02 1.88 -0.34 0.00 0.00 178.44 179.81 1nyq h TYR 304 N 0.97 0.01 0.79 1.25 0.05 -0.89 -1.17 116.97 117.99 1nyq h TYR 304 Ca 0.22 -0.01 -0.04 0.00 0.05 0.00 0.00 58.73 58.95 1nyq h TYR 304 Cb 0.25 -0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.00 1nyq h TYR 304 CO 0.02 1.01 -0.43 0.87 -1.05 0.00 0.00 178.16 178.58 1nyq h LYS 305 N 0.00 -1.08 -0.92 4.88 1.79 -1.14 1.20 116.57 121.31 1nyq h LYS 305 Ca -0.02 0.07 0.14 0.00 -2.18 0.00 0.00 60.65 58.66 1nyq h LYS 305 Cb 1.78 0.25 -0.09 0.00 -1.58 0.00 0.00 32.23 32.59 1nyq h LYS 305 CO 0.13 -0.72 0.53 1.15 -1.08 0.00 0.00 179.45 179.46 1nyq h THR 306 N -1.12 0.80 -0.06 -0.16 2.02 -1.08 -1.75 112.91 111.56 1nyq h THR 306 Ca -0.11 -0.27 -0.18 0.00 0.77 0.00 0.00 66.41 66.63 1nyq h THR 306 Cb 0.88 -0.04 -0.01 0.00 -1.74 0.00 0.00 68.15 67.24 1nyq h THR 306 CO 0.14 0.14 -0.74 0.77 0.37 0.00 0.00 175.52 176.21 1nyq h SER 307 N 0.78 0.42 0.00 4.18 4.64 -0.65 -3.42 113.55 119.50 1nyq h SER 307 Ca 0.49 -0.28 0.00 0.00 -0.47 0.00 0.00 61.79 61.53 1nyq h SER 307 Cb 0.62 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.58 1nyq h SER 307 CO -0.32 1.02 0.00 0.61 -0.87 0.00 0.00 176.83 177.26 1nyq n GLY 308 N 0.57 0.76 0.22 -0.77 0.00 0.40 -4.76 105.19 101.61 1nyq n GLY 308 Ca -0.04 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.09 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 -1.31 -2.91 115.15 116.40 1nyq h HIS 309 Ca 0.00 0.00 -0.05 0.00 -1.16 0.00 0.00 60.37 59.16 1nyq h HIS 309 Cb 0.00 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.46 1nyq h HIS 309 CO 0.00 0.17 -0.24 2.35 0.86 0.00 0.00 177.93 181.07 1nyq h TRP 310 N 0.00 0.00 0.00 2.45 2.91 -1.81 0.85 115.95 120.36 1nyq h TRP 310 Ca -0.00 0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.02 1nyq h TRP 310 Cb 0.81 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 29.46 1nyq h TRP 310 CO 0.00 0.24 -0.61 -0.25 -1.03 0.00 0.00 178.44 176.80 1nyq n ASP 311 N -3.23 0.57 0.00 2.65 8.00 -1.12 -4.30 116.55 119.13 1nyq n ASP 311 Ca 0.02 -0.26 0.00 0.00 0.71 0.00 0.00 54.79 55.26 1nyq n ASP 311 Cb 0.55 0.35 0.00 0.00 -0.02 0.00 0.00 41.12 42.00 1nyq n ASP 311 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 1nyq n HIS 312 N -1.62 0.00 -0.15 1.24 8.25 -1.12 -4.88 115.22 116.94 1nyq n HIS 312 Ca 0.05 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.51 1nyq n HIS 312 Cb 0.36 0.02 0.00 0.00 1.12 0.00 0.00 29.99 31.49 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 0.00 0.00 -0.28 4.41 4.19 0.28 -4.86 117.16 120.90 1nyq n TYR 313 Ca 0.00 0.00 0.22 0.00 3.31 0.00 0.00 57.90 61.43 1nyq n TYR 313 Cb 0.37 0.00 0.36 0.00 0.49 0.00 0.00 39.34 40.56 1nyq n TYR 313 CO 0.00 0.00 0.00 0.94 0.91 0.00 0.00 176.86 178.71 1nyq n GLN 314 N -0.29 -0.01 -0.03 2.98 -0.06 -1.16 -0.02 117.38 118.79 1nyq n GLN 314 Ca 0.00 0.55 -0.14 0.00 -2.00 0.00 0.00 57.00 55.41 1nyq n GLN 314 Cb 0.04 -1.18 -0.11 0.00 -4.06 0.00 0.00 30.24 24.93 1nyq n GLN 314 CO 0.00 0.00 0.00 0.93 -0.20 0.00 0.00 177.06 177.79 1nyq h GLU 315 N 0.00 0.08 -0.00 3.69 5.08 -1.91 -3.32 114.58 118.20 1nyq h GLU 315 Ca 0.43 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.73 1nyq h GLU 315 Cb 1.59 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.85 1nyq h GLU 315 CO -0.11 0.75 -0.00 -0.25 -1.00 0.00 0.00 179.01 178.40 1nyq n ASP 316 N -4.68 0.01 -4.87 1.42 9.92 0.97 -4.67 116.55 114.65 1nyq n ASP 316 Ca -0.09 -0.73 -0.35 0.00 -0.53 0.00 0.00 54.79 53.10 1nyq n ASP 316 Cb 0.38 -0.09 -0.05 0.00 -0.64 0.00 0.00 41.12 40.72 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 -2.19 3.74 0.94 -1.24 -1.94 -1.10 0.18 119.30 117.70 1nyq s MET 317 Ca 0.42 0.14 -0.12 0.00 -1.71 0.00 0.00 55.69 54.42 1nyq s MET 317 Cb 0.21 -3.00 0.16 0.00 2.01 0.00 0.00 34.83 34.21 1nyq s MET 317 CO 0.40 0.57 1.09 -0.06 -0.01 0.00 0.00 175.02 177.01 1nyq s PHE 318 N -1.39 2.24 0.49 -0.03 0.40 -1.26 -4.60 117.98 113.83 1nyq s PHE 318 Ca 0.33 1.11 -0.22 0.00 -0.60 0.00 0.00 56.93 57.55 1nyq s PHE 318 Cb -0.14 -3.22 -0.07 0.00 0.51 0.00 0.00 43.02 40.11 1nyq s PHE 318 CO 0.18 -2.61 1.19 -1.25 0.70 0.00 0.00 175.22 173.42 1nyq s PRO 319 N -4.97 3.57 0.96 0.24 0.04 -1.26 -4.71 135.00 128.87 1nyq s PRO 319 Ca 0.64 1.81 -0.16 0.00 0.04 0.00 0.00 61.00 63.33 1nyq s PRO 319 Cb -0.18 -2.29 0.23 0.00 0.04 0.00 0.00 34.50 32.30 1nyq s PRO 319 CO 0.57 -0.72 1.08 -0.35 0.04 0.00 0.00 177.00 177.62 1nyq n PRO 320 N -0.76 -1.94 -3.50 0.56 -0.04 -1.26 -4.73 135.00 123.34 1nyq n PRO 320 Ca 0.09 -1.69 -0.11 0.00 -0.04 0.00 0.00 63.50 61.75 1nyq n PRO 320 Cb 0.48 -1.31 -0.02 0.00 -0.04 0.00 0.00 33.50 32.61 1nyq n PRO 320 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1nyq n MET 321 N -3.92 0.61 0.00 0.54 0.00 0.25 -4.91 117.12 109.69 1nyq n MET 321 Ca 0.14 -2.23 0.00 0.00 0.00 0.00 0.00 57.70 55.61 1nyq n MET 321 Cb 0.51 2.20 0.00 0.00 0.00 0.00 0.00 33.22 35.93 1nyq n MET 321 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 175.97 177.01 1nyq n GLN 322 N -0.47 0.00 -3.64 3.17 1.13 -1.26 -0.58 117.38 115.73 1nyq n GLN 322 Ca -0.00 0.00 -0.38 0.00 -1.94 0.00 0.00 57.00 54.68 1nyq n GLN 322 Cb 0.48 0.00 -0.08 0.00 0.11 0.00 0.00 30.24 30.75 1nyq n GLN 322 CO 0.00 0.00 0.00 -0.48 -1.44 0.00 0.00 177.06 175.14 1nyq s LEU 323 N 0.00 5.53 0.00 1.08 0.05 -1.26 -5.05 118.68 119.03 1nyq s LEU 323 Ca 0.00 -3.13 0.00 0.00 0.05 0.00 0.00 54.13 51.05 1nyq s LEU 323 Cb 0.00 -1.92 0.00 0.00 -2.05 0.00 0.00 46.19 42.22 1nyq s LEU 323 CO 0.00 -0.33 0.00 -0.90 -0.55 0.00 0.00 176.35 174.57 1nyq n ASP 324 N 3.15 0.00 0.00 1.48 5.75 -1.26 -3.22 116.55 122.45 1nyq n ASP 324 Ca 0.13 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.91 1nyq n ASP 324 Cb 0.39 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.48 1nyq n ASP 324 CO 0.00 0.00 0.00 1.21 -0.11 0.00 0.00 177.20 178.30 1nyq n GLU 325 N 0.00 0.00 0.11 0.11 2.13 -1.26 -4.53 120.64 117.20 1nyq n GLU 325 Ca 0.00 0.00 -0.05 0.00 0.66 0.00 0.00 57.16 57.77 1nyq n GLU 325 Cb 0.00 -1.27 -0.03 0.00 0.27 0.00 0.00 31.44 30.41 1nyq n GLU 325 CO 0.00 0.00 0.00 1.15 -0.41 0.00 0.00 177.13 177.87 1nyq h THR 326 N 0.00 0.00 -2.06 6.31 2.02 -1.98 -3.49 112.91 113.71 1nyq h THR 326 Ca 0.00 -0.49 0.15 0.00 0.77 0.00 0.00 66.41 66.84 1nyq h THR 326 Cb 0.00 0.00 -0.16 0.00 -1.74 0.00 0.00 68.15 66.25 1nyq h THR 326 CO 0.00 0.00 0.58 -1.61 0.37 0.00 0.00 175.52 174.86 1nyq s GLU 327 N -2.73 0.68 -0.36 6.66 2.02 -1.26 -5.09 118.70 118.61 1nyq s GLU 327 Ca -0.05 -0.24 0.02 0.00 0.02 0.00 0.00 54.97 54.71 1nyq s GLU 327 Cb 0.01 0.31 0.11 0.00 0.10 0.00 0.00 34.13 34.66 1nyq s GLU 327 CO 0.15 -0.30 0.12 -1.12 0.02 0.00 0.00 175.26 174.14 1nyq s SER 328 N -2.37 4.27 0.30 -0.19 0.01 -1.25 -4.10 113.70 110.36 1nyq s SER 328 Ca 0.06 -2.13 -0.27 0.00 1.31 0.00 0.00 55.95 54.92 1nyq s SER 328 Cb -0.01 -1.25 -0.10 0.00 0.21 0.00 0.00 66.02 64.87 1nyq s SER 328 CO -0.08 -0.36 0.95 -0.04 0.41 0.00 0.00 173.24 174.13 1nyq s MET 329 N 0.96 4.66 0.15 12.44 1.00 0.25 -1.05 119.30 137.71 1nyq s MET 329 Ca 0.12 1.41 0.05 0.00 0.00 0.00 0.00 55.69 57.27 1nyq s MET 329 Cb -0.20 -2.96 -0.04 0.00 0.00 0.00 0.00 34.83 31.63 1nyq s MET 329 CO -0.12 0.34 -0.11 0.08 0.00 0.00 0.00 175.02 175.20 1nyq s VAL 330 N -1.46 1.25 -0.37 -6.03 1.01 -0.99 0.86 120.40 114.67 1nyq s VAL 330 Ca 0.47 -2.03 -0.23 0.00 0.00 0.00 0.00 61.98 60.20 1nyq s VAL 330 Cb -0.22 -1.82 0.01 0.00 0.00 0.00 0.00 36.38 34.36 1nyq s VAL 330 CO 0.27 -0.68 0.78 -0.76 0.00 0.00 0.00 175.10 174.70 1nyq s LEU 331 N -3.08 4.14 -0.31 3.92 1.43 -1.26 -1.81 118.68 121.71 1nyq s LEU 331 Ca 0.16 0.32 -0.39 0.00 -1.03 0.00 0.00 54.13 53.19 1nyq s LEU 331 Cb 0.01 -3.01 -0.15 0.00 0.03 0.00 0.00 46.19 43.07 1nyq s LEU 331 CO 0.02 -0.74 1.88 -2.11 0.23 0.00 0.00 176.35 175.64 1nyq n ARG 332 N 6.42 1.07 -0.14 1.70 1.85 -1.06 -4.58 116.66 121.93 1nyq n ARG 332 Ca 0.03 0.37 0.10 0.00 -1.00 0.00 0.00 57.85 57.34 1nyq n ARG 332 Cb 0.48 -2.15 0.29 0.00 -1.05 0.00 0.00 32.46 30.03 1nyq n ARG 332 CO 0.00 0.00 0.00 -0.35 -0.01 0.00 0.00 177.63 177.27 1nyq n PRO 333 N 6.25 1.93 -3.59 2.89 -0.04 -1.25 -2.68 135.00 138.50 1nyq n PRO 333 Ca 0.32 -1.41 -0.15 0.00 -0.04 0.00 0.00 63.50 62.22 1nyq n PRO 333 Cb 0.14 -1.39 -0.06 0.00 -0.04 0.00 0.00 33.50 32.14 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 -1.64 0.85 0.26 0.54 -1.94 -1.26 -4.80 119.30 111.32 1nyq s MET 334 Ca 0.32 0.61 0.18 0.00 -1.71 0.00 0.00 55.69 55.09 1nyq s MET 334 Cb 0.17 0.41 0.07 0.00 2.01 0.00 0.00 34.83 37.49 1nyq s MET 334 CO 0.25 -0.18 1.30 -0.91 -0.01 0.00 0.00 175.02 175.47 1nyq h ASN 335 N 3.98 0.00 -0.00 3.03 2.35 -1.93 -3.41 115.58 119.60 1nyq h ASN 335 Ca -0.27 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.48 1nyq h ASN 335 Cb 1.16 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.52 1nyq h ASN 335 CO 0.20 0.36 -0.00 0.00 -1.65 0.00 0.00 177.43 176.34 1nyq n PRO 337 N -2.67 -0.16 -0.22 0.00 -0.04 -1.26 -0.66 135.00 129.99 1nyq n PRO 337 Ca 0.00 1.16 -0.03 0.00 -0.04 0.00 0.00 63.50 64.59 1nyq n PRO 337 Cb 0.00 -1.72 0.03 0.00 -0.04 0.00 0.00 33.50 31.77 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 -0.73 -0.66 0.54 3.86 -1.79 0.41 115.15 116.79 1nyq h HIS 338 Ca 0.06 0.07 0.17 0.00 -1.16 0.00 0.00 60.37 59.50 1nyq h HIS 338 Cb 0.15 0.42 -0.03 0.00 1.06 0.00 0.00 27.41 29.00 1nyq h HIS 338 CO -0.95 -0.35 0.46 0.45 0.86 0.00 0.00 177.93 178.40 1nyq h HIS 339 N -0.10 0.18 0.81 2.45 3.86 -0.41 0.18 115.15 122.12 1nyq h HIS 339 Ca 0.27 0.01 -0.04 0.00 -1.16 0.00 0.00 60.37 59.45 1nyq h HIS 339 Cb 0.54 -0.06 0.01 0.00 1.06 0.00 0.00 27.41 28.96 1nyq h HIS 339 CO -0.62 0.07 -0.39 0.52 0.86 0.00 0.00 177.93 178.37 1nyq h MET 340 N 0.15 -1.04 -0.96 2.45 2.86 0.22 -2.35 114.93 116.25 1nyq h MET 340 Ca 0.32 0.07 0.23 0.00 -2.06 0.00 0.00 59.70 58.26 1nyq h MET 340 Cb 1.04 0.24 -0.12 0.00 0.06 0.00 0.00 31.60 32.82 1nyq h MET 340 CO -0.05 -0.69 0.53 0.52 1.06 0.00 0.00 176.91 178.28 1nyq h MET 341 N -1.10 0.51 0.42 1.72 2.86 0.01 0.19 114.93 119.54 1nyq h MET 341 Ca -0.11 -0.03 -0.01 0.00 -2.06 0.00 0.00 59.70 57.48 1nyq h MET 341 Cb 0.83 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 32.37 1nyq h MET 341 CO 0.18 0.34 -0.27 0.82 1.06 0.00 0.00 176.91 179.04 1nyq h ILE 342 N 0.53 0.43 -0.60 -1.22 1.08 -0.89 -0.86 117.51 115.98 1nyq h ILE 342 Ca 0.61 0.00 0.11 0.00 -0.39 0.00 0.00 64.86 65.19 1nyq h ILE 342 Cb 1.15 0.43 -0.08 0.00 -3.07 0.00 0.00 36.82 35.25 1nyq h ILE 342 CO -0.49 0.00 0.15 0.22 -0.69 0.00 0.00 178.15 177.35 1nyq h TYR 343 N -0.67 0.25 -0.27 1.37 3.20 -0.23 -2.26 116.97 118.35 1nyq h TYR 343 Ca -0.04 0.03 0.06 0.00 3.14 0.00 0.00 58.73 61.92 1nyq h TYR 343 Cb 0.56 -0.02 -0.05 0.00 1.54 0.00 0.00 36.73 38.76 1nyq h TYR 343 CO -0.11 -0.00 -0.07 0.00 -1.64 0.00 0.00 178.16 176.34 1nyq h ALA 344 N 1.46 0.17 0.00 1.82 0.00 -0.44 -3.31 119.26 118.96 1nyq h ALA 344 Ca 0.31 0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.33 1nyq h ALA 344 Cb 0.45 0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.46 1nyq h ALA 344 CO -0.38 -0.47 0.00 -1.71 0.00 0.00 0.00 179.25 176.69 1nyq n ASN 345 N -5.24 0.00 -3.67 0.00 5.15 -0.36 -4.41 115.26 106.73 1nyq n ASN 345 Ca -0.01 0.00 -0.10 0.00 -0.60 0.00 0.00 54.58 53.87 1nyq n ASN 345 Cb 0.17 0.00 -0.04 0.00 -0.53 0.00 0.00 39.78 39.38 1nyq n ASN 345 CO 0.00 0.00 0.00 -1.59 1.40 0.00 0.00 177.26 177.07 1nyq s LYS 346 N -2.88 1.32 1.12 1.20 -2.85 -1.25 -5.14 119.74 111.26 1nyq s LYS 346 Ca 0.00 -0.77 -0.18 0.00 -1.00 0.00 0.00 55.97 54.02 1nyq s LYS 346 Cb 0.00 0.53 0.16 0.00 -2.06 0.00 0.00 37.83 36.45 1nyq s LYS 346 CO 0.00 -0.56 0.20 -2.30 0.10 0.00 0.00 175.35 172.79 1nyq n PRO 347 N -0.33 -2.17 -3.64 1.78 -0.02 -1.26 -5.01 135.00 124.35 1nyq n PRO 347 Ca -0.12 -0.63 -0.02 0.00 -2.02 0.00 0.00 63.50 60.71 1nyq n PRO 347 Cb 0.63 -1.65 -0.04 0.00 -0.02 0.00 0.00 33.50 32.42 1nyq n PRO 347 CO 0.00 0.00 0.00 -1.01 1.98 0.00 0.00 175.50 176.47 1nyq s HIS 348 N -2.17 -1.31 0.33 6.00 3.76 -1.26 -5.08 115.29 115.57 1nyq s HIS 348 Ca 0.51 2.26 -0.28 0.00 -0.15 0.00 0.00 55.06 57.40 1nyq s HIS 348 Cb -0.10 0.76 -0.09 0.00 1.11 0.00 0.00 32.58 34.26 1nyq s HIS 348 CO 0.54 -0.66 1.18 0.45 -0.85 0.00 0.00 174.74 175.40 1nyq s SER 349 N 2.87 6.89 0.39 1.40 0.15 -1.26 -0.03 113.70 124.11 1nyq s SER 349 Ca -0.05 2.40 0.21 0.00 0.70 0.00 0.00 55.95 59.21 1nyq s SER 349 Cb -0.12 -2.63 1.17 0.00 -1.71 0.00 0.00 66.02 62.73 1nyq s SER 349 CO -0.19 -0.42 1.62 0.10 1.20 0.00 0.00 173.24 175.55 1nyq h TYR 350 N 3.29 0.00 0.00 3.44 -0.00 -1.22 0.25 116.97 122.73 1nyq h TYR 350 Ca -0.48 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.25 1nyq h TYR 350 Cb 1.22 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.95 1nyq h TYR 350 CO 0.57 0.00 -0.16 -2.13 -0.00 0.00 0.00 178.16 176.43 1nyq n ARG 351 N -2.32 0.15 0.00 0.10 0.63 -1.26 -3.38 116.66 110.58 1nyq n ARG 351 Ca -0.01 0.10 0.06 0.00 -0.92 0.00 0.00 57.85 57.08 1nyq n ARG 351 Cb 0.18 -1.65 -0.04 0.00 0.45 0.00 0.00 32.46 31.40 1nyq n ARG 351 CO 0.00 0.00 0.00 -0.85 -2.51 0.00 0.00 177.63 174.27 1nyq n GLU 352 N -1.90 2.35 -0.58 -0.14 0.28 0.85 -4.80 120.64 116.70 1nyq n GLU 352 Ca 0.06 -0.33 0.46 0.00 -0.16 0.00 0.00 57.16 57.19 1nyq n GLU 352 Cb 0.39 -1.15 0.75 0.00 1.43 0.00 0.00 31.44 32.86 1nyq n GLU 352 CO 0.00 0.00 0.00 1.25 -0.16 0.00 0.00 177.13 178.22 1nyq h LEU 353 N 0.68 0.11 -8.47 -1.84 7.12 -1.52 -3.33 115.31 108.07 1nyq h LEU 353 Ca 0.00 0.09 -0.52 0.00 0.13 0.00 0.00 57.88 57.57 1nyq h LEU 353 Cb 0.37 0.09 -0.06 0.00 -0.53 0.00 0.00 40.66 40.54 1nyq h LEU 353 CO 0.00 -0.15 1.20 -2.84 -0.13 0.00 0.00 178.44 176.52 1nyq s PRO 354 N -5.08 2.97 -0.19 5.25 0.02 -1.26 -4.10 135.00 132.61 1nyq s PRO 354 Ca -0.06 0.29 -0.04 0.00 0.02 0.00 0.00 61.00 61.21 1nyq s PRO 354 Cb 0.29 -4.26 -0.02 0.00 0.02 0.00 0.00 34.50 30.54 1nyq s PRO 354 CO 0.86 -2.35 -0.04 0.42 -0.33 0.00 0.00 177.00 175.56 1nyq s ILE 355 N 7.24 3.57 -0.24 2.83 1.01 -0.56 -4.94 121.20 130.11 1nyq s ILE 355 Ca 0.53 -0.45 0.01 0.00 0.00 0.00 0.00 60.65 60.75 1nyq s ILE 355 Cb -0.11 -2.60 0.06 0.00 0.01 0.00 0.00 42.46 39.82 1nyq s ILE 355 CO 0.20 0.45 -0.08 0.00 0.00 0.00 0.00 174.94 175.51 1nyq s ARG 356 N 1.05 1.85 -0.35 2.79 1.70 -1.26 0.23 118.95 124.96 1nyq s ARG 356 Ca 0.01 -1.10 -0.19 0.00 -0.47 0.00 0.00 55.73 53.98 1nyq s ARG 356 Cb -0.15 -2.68 -0.00 0.00 -0.57 0.00 0.00 34.95 31.55 1nyq s ARG 356 CO 0.00 -0.58 0.54 0.42 -1.08 0.00 0.00 175.30 174.61 1nyq s ILE 357 N 1.30 4.98 0.19 4.99 -1.09 -1.11 -0.24 121.20 130.21 1nyq s ILE 357 Ca -0.07 0.38 0.07 0.00 -2.23 0.00 0.00 60.65 58.81 1nyq s ILE 357 Cb -0.19 -4.00 -0.04 0.00 -1.58 0.00 0.00 42.46 36.65 1nyq s ILE 357 CO -0.06 -0.25 0.02 0.00 -1.23 0.00 0.00 174.94 173.42 1nyq s ALA 358 N 2.47 3.25 -0.28 9.38 0.00 -0.56 -1.16 121.76 134.86 1nyq s ALA 358 Ca 0.20 -1.38 -0.25 0.00 0.00 0.00 0.00 51.96 50.52 1nyq s ALA 358 Cb -0.15 -1.02 0.13 0.00 0.00 0.00 0.00 23.12 22.08 1nyq s ALA 358 CO 0.14 0.45 1.07 -2.00 0.00 0.00 0.00 175.76 175.41 1nyq s GLU 359 N -3.08 0.47 -1.23 0.00 2.12 0.23 -1.65 118.70 115.56 1nyq s GLU 359 Ca 0.28 0.55 -0.07 0.00 0.36 0.00 0.00 54.97 56.09 1nyq s GLU 359 Cb -0.09 0.23 0.20 0.00 0.26 0.00 0.00 34.13 34.73 1nyq s GLU 359 CO 0.19 -0.06 1.86 1.28 -0.54 0.00 0.00 175.26 178.00 1nyq n LEU 360 N 2.14 6.85 -4.75 2.70 4.32 -1.25 -0.74 117.00 126.27 1nyq n LEU 360 Ca -0.12 -4.85 -0.41 0.00 -0.02 0.00 0.00 56.01 50.62 1nyq n LEU 360 Cb 0.56 -1.40 -0.05 0.00 -1.62 0.00 0.00 43.42 40.91 1nyq n LEU 360 CO 0.02 1.58 0.76 -0.83 -1.22 0.00 0.00 177.39 177.70 1nyq s GLY 361 N 0.06 2.99 -0.13 -0.72 0.00 -0.27 -4.65 107.32 104.60 1nyq s GLY 361 Ca 0.40 0.79 -0.26 0.00 0.00 0.00 0.00 44.72 45.65 1nyq s GLY 361 CO 0.01 1.50 0.84 -1.59 0.00 0.00 0.00 173.10 173.85 1nyq s THR 362 N -0.74 4.90 0.01 0.90 2.01 -1.26 -0.84 115.64 120.62 1nyq s THR 362 Ca 0.46 1.67 0.04 0.00 0.31 0.00 0.00 61.69 64.17 1nyq s THR 362 Cb -0.29 -4.15 -0.01 0.00 0.01 0.00 0.00 72.50 68.05 1nyq s THR 362 CO 0.36 0.07 -0.12 -0.04 -0.69 0.00 0.00 174.62 174.20 1nyq s MET 363 N 1.82 0.91 -0.07 4.92 -1.94 0.11 -4.85 119.30 120.20 1nyq s MET 363 Ca 0.40 -0.55 0.04 0.00 -1.71 0.00 0.00 55.69 53.88 1nyq s MET 363 Cb -0.17 -0.88 -0.01 0.00 2.01 0.00 0.00 34.83 35.77 1nyq s MET 363 CO 0.15 0.23 -0.20 -1.01 -0.01 0.00 0.00 175.02 174.18 1nyq s HIS 364 N -0.52 2.58 -0.06 -0.03 3.76 -1.09 -0.24 115.29 119.68 1nyq s HIS 364 Ca 0.03 -0.62 0.01 0.00 -0.15 0.00 0.00 55.06 54.32 1nyq s HIS 364 Cb -0.06 -1.67 0.02 0.00 1.11 0.00 0.00 32.58 31.99 1nyq s HIS 364 CO 0.00 -0.15 -0.05 1.03 -0.85 0.00 0.00 174.74 174.72 1nyq s ARG 365 N -0.13 1.02 -1.00 1.40 0.52 -0.36 -3.93 118.95 116.48 1nyq s ARG 365 Ca -0.03 -0.13 -0.24 0.00 -0.52 0.00 0.00 55.73 54.80 1nyq s ARG 365 Cb -0.14 -1.05 -0.08 0.00 0.52 0.00 0.00 34.95 34.20 1nyq s ARG 365 CO 0.04 -0.13 1.98 -0.47 0.02 0.00 0.00 175.30 176.74 1nyq s TYR 366 N 1.18 1.78 -0.03 -0.53 6.14 0.48 -4.48 117.35 121.90 1nyq s TYR 366 Ca -0.06 0.74 -0.16 0.00 0.64 0.00 0.00 57.07 58.23 1nyq s TYR 366 Cb -0.14 -3.95 -0.05 0.00 0.42 0.00 0.00 41.96 38.23 1nyq s TYR 366 CO -0.01 -1.50 0.44 -1.21 0.64 0.00 0.00 175.55 173.90 1nyq s GLU 367 N 7.02 4.08 0.23 4.97 0.41 -1.26 -4.49 118.70 129.66 1nyq s GLU 367 Ca 0.72 0.45 -0.30 0.00 -0.41 0.00 0.00 54.97 55.42 1nyq s GLU 367 Cb -0.05 -3.29 -0.15 0.00 -1.78 0.00 0.00 34.13 28.86 1nyq s GLU 367 CO 0.05 0.52 0.99 0.00 -0.49 0.00 0.00 175.26 176.34 1nyq n ALA 368 N 2.38 -0.91 -0.19 5.21 0.00 -1.26 -4.76 120.51 120.98 1nyq n ALA 368 Ca -0.12 0.43 0.26 0.00 0.00 0.00 0.00 53.44 54.02 1nyq n ALA 368 Cb 0.52 -1.95 0.68 0.00 0.00 0.00 0.00 19.45 18.69 1nyq n ALA 368 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1nyq h SER 369 N 2.36 0.09 1.43 0.00 4.64 -1.97 0.18 113.55 120.27 1nyq h SER 369 Ca -0.39 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 1nyq h SER 369 Cb 1.36 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.44 1nyq h SER 369 CO 0.64 0.03 0.00 1.23 -0.87 0.00 0.00 176.83 177.86 1nyq h GLY 370 N 0.08 0.00 1.77 -0.77 0.00 -2.02 -2.99 103.07 99.15 1nyq h GLY 370 Ca 0.43 0.00 -0.20 0.00 0.00 0.00 0.00 47.33 47.57 1nyq h GLY 370 CO -0.05 0.00 -1.03 0.00 0.00 0.00 0.00 176.54 175.47 1nyq h ALA 371 N 2.44 0.51 -1.34 3.60 0.00 -0.95 -3.44 119.26 120.07 1nyq h ALA 371 Ca 0.00 -0.89 -0.49 0.00 0.00 0.00 0.00 54.91 53.54 1nyq h ALA 371 Cb 0.71 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 1nyq h ALA 371 CO 0.00 1.14 1.64 0.28 0.00 0.00 0.00 179.25 182.30 1nyq n VAL 372 N -3.24 -0.03 -3.90 0.00 0.31 -1.12 -4.74 118.33 105.60 1nyq n VAL 372 Ca -0.03 -0.62 -0.30 0.00 -0.01 0.00 0.00 64.34 63.38 1nyq n VAL 372 Cb 0.90 -2.35 -0.15 0.00 -0.91 0.00 0.00 33.84 31.33 1nyq n VAL 372 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1nyq s SER 373 N 11.21 4.30 0.02 4.52 0.15 -0.71 -4.96 113.70 128.23 1nyq s SER 373 Ca 1.05 -1.74 -0.05 0.00 0.70 0.00 0.00 55.95 55.91 1nyq s SER 373 Cb -0.40 -1.26 -0.03 0.00 -1.71 0.00 0.00 66.02 62.63 1nyq s SER 373 CO 0.32 -0.36 0.11 0.61 1.20 0.00 0.00 173.24 175.12 1nyq n GLY 374 N 4.56 -0.19 4.33 9.45 0.00 -1.26 -0.86 105.19 121.23 1nyq n GLY 374 Ca -0.02 0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.07 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 0.28 0.00 -0.03 0.99 4.77 -1.26 -4.33 117.00 117.41 1nyq n LEU 375 Ca 0.03 0.00 -0.22 0.00 -0.03 0.00 0.00 56.01 55.79 1nyq n LEU 375 Cb 0.03 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 40.99 1nyq n LEU 375 CO 0.09 0.00 -0.63 -0.61 -1.33 0.00 0.00 177.39 174.91 1nyq h GLN 376 N 0.00 0.18 -2.76 3.23 -0.00 -1.55 -1.63 115.11 112.57 1nyq h GLN 376 Ca 0.00 -0.30 -0.45 0.00 -0.00 0.00 0.00 58.65 57.90 1nyq h GLN 376 Cb 0.00 0.11 -0.39 0.00 0.00 0.00 0.00 27.48 27.20 1nyq h GLN 376 CO 0.00 1.14 -0.73 0.50 0.00 0.00 0.00 178.83 179.75 1nyq s ARG 377 N -2.48 0.16 0.40 1.69 6.06 -0.04 -4.65 118.95 120.09 1nyq s ARG 377 Ca -0.24 -0.20 0.06 0.00 -2.50 0.00 0.00 55.73 52.85 1nyq s ARG 377 Cb 0.06 -1.35 -0.07 0.00 0.06 0.00 0.00 34.95 33.65 1nyq s ARG 377 CO 0.71 -0.84 0.02 0.14 -2.50 0.00 0.00 175.30 172.84 1nyq s VAL 378 N 2.18 1.75 -0.18 7.11 -7.23 -1.26 -1.73 120.40 121.04 1nyq s VAL 378 Ca 0.06 -2.00 -0.17 0.00 -1.81 0.00 0.00 61.98 58.07 1nyq s VAL 378 Cb -0.16 -2.90 -0.13 0.00 0.56 0.00 0.00 36.38 33.76 1nyq s VAL 378 CO -0.23 0.00 0.07 0.03 -0.31 0.00 0.00 175.10 174.67 1nyq h ARG 379 N 1.82 0.00 -5.90 4.82 3.08 -0.60 -3.44 114.38 114.16 1nyq h ARG 379 Ca -0.43 0.00 -0.57 0.00 0.07 0.00 0.00 59.98 59.05 1nyq h ARG 379 Cb 1.25 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 31.23 1nyq h ARG 379 CO 0.78 0.61 0.09 0.20 -1.07 0.00 0.00 179.97 180.59 1nyq s GLY 380 N -4.60 2.41 0.10 0.04 0.00 -1.09 -1.22 107.32 102.96 1nyq s GLY 380 Ca -0.23 -0.01 -0.12 0.00 0.00 0.00 0.00 44.72 44.36 1nyq s GLY 380 CO 0.44 1.20 0.27 -3.16 0.00 0.00 0.00 173.10 171.86 1nyq s MET 381 N 1.16 0.91 -0.17 2.90 0.23 0.67 -4.86 119.30 120.14 1nyq s MET 381 Ca 0.34 -0.83 0.00 0.00 -1.03 0.00 0.00 55.69 54.17 1nyq s MET 381 Cb -0.17 0.39 0.03 0.00 -1.53 0.00 0.00 34.83 33.55 1nyq s MET 381 CO 0.15 -0.32 -0.12 0.99 -2.03 0.00 0.00 175.02 173.69 1nyq s THR 382 N -3.71 1.56 -0.12 3.16 2.01 -1.26 0.08 115.64 117.35 1nyq s THR 382 Ca 0.03 -0.77 -0.16 0.00 0.31 0.00 0.00 61.69 61.10 1nyq s THR 382 Cb 0.03 -1.55 -0.04 0.00 0.01 0.00 0.00 72.50 70.95 1nyq s THR 382 CO -0.11 0.33 0.40 -0.22 -0.69 0.00 0.00 174.62 174.33 1nyq s LEU 383 N 1.47 4.28 -1.25 4.42 2.96 -0.02 0.27 118.68 130.80 1nyq s LEU 383 Ca 0.02 0.70 -0.17 0.00 -0.22 0.00 0.00 54.13 54.46 1nyq s LEU 383 Cb -0.14 -2.55 -0.01 0.00 0.50 0.00 0.00 46.19 43.99 1nyq s LEU 383 CO -0.10 0.07 2.04 -3.20 -1.32 0.00 0.00 176.35 173.85 1nyq n ASN 384 N 3.46 3.72 -4.94 3.68 5.15 -0.19 -1.11 115.26 125.02 1nyq n ASN 384 Ca -0.10 -2.81 -0.24 0.00 -0.60 0.00 0.00 54.58 50.83 1nyq n ASN 384 Cb 0.52 -1.56 -0.01 0.00 -0.53 0.00 0.00 39.78 38.20 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 4.05 6.19 -0.20 1.20 -1.08 0.08 -3.53 116.67 123.38 1nyq s ASP 385 Ca 0.52 0.46 -0.30 0.00 -0.52 0.00 0.00 52.55 52.72 1nyq s ASP 385 Cb 0.11 -1.94 0.15 0.00 -1.46 0.00 0.00 42.92 39.78 1nyq s ASP 385 CO 0.01 -0.42 1.11 -0.55 0.52 0.00 0.00 175.17 175.84 1nyq s SER 386 N -4.08 -0.27 -0.24 -0.34 0.15 -1.13 -0.60 113.70 107.17 1nyq s SER 386 Ca 0.43 0.32 -0.02 0.00 0.70 0.00 0.00 55.95 57.37 1nyq s SER 386 Cb -0.10 0.25 0.08 0.00 -1.71 0.00 0.00 66.02 64.54 1nyq s SER 386 CO 0.37 -0.24 0.06 -1.00 1.20 0.00 0.00 173.24 173.63 1nyq s HIS 387 N -1.00 1.35 0.02 3.44 3.76 -0.31 -2.20 115.29 120.35 1nyq s HIS 387 Ca 0.02 -1.26 -0.27 0.00 -0.15 0.00 0.00 55.06 53.40 1nyq s HIS 387 Cb -0.01 -1.31 -0.04 0.00 1.11 0.00 0.00 32.58 32.32 1nyq s HIS 387 CO -0.02 -0.73 0.87 0.42 -0.85 0.00 0.00 174.74 174.43 1nyq s ILE 388 N 1.74 4.79 -0.27 0.60 1.09 -0.06 -2.74 121.20 126.35 1nyq s ILE 388 Ca 0.03 1.83 -0.10 0.00 -1.10 0.00 0.00 60.65 61.32 1nyq s ILE 388 Cb -0.17 -4.21 -0.04 0.00 -1.06 0.00 0.00 42.46 36.98 1nyq s ILE 388 CO -0.16 0.26 0.15 -0.36 -0.10 0.00 0.00 174.94 174.73 1nyq s PHE 389 N 0.48 3.17 0.33 3.97 0.40 0.64 -0.93 117.98 126.03 1nyq s PHE 389 Ca 0.45 -0.14 0.04 0.00 -0.60 0.00 0.00 56.93 56.68 1nyq s PHE 389 Cb -0.21 -2.33 -0.06 0.00 0.51 0.00 0.00 43.02 40.93 1nyq s PHE 389 CO 0.25 -0.26 0.05 0.14 0.70 0.00 0.00 175.22 176.10 1nyq s VAL 390 N 1.70 1.27 0.15 -0.44 -7.23 0.20 -1.49 120.40 114.55 1nyq s VAL 390 Ca 0.07 -2.01 -0.04 0.00 -1.81 0.00 0.00 61.98 58.19 1nyq s VAL 390 Cb -0.16 -2.79 -0.05 0.00 0.56 0.00 0.00 36.38 33.94 1nyq s VAL 390 CO 0.08 -0.02 0.37 -0.13 -0.31 0.00 0.00 175.10 175.09 1nyq s ARG 391 N -3.87 3.60 0.28 4.82 0.52 -1.26 0.82 118.95 123.85 1nyq s ARG 391 Ca 0.36 -0.13 0.07 0.00 -0.52 0.00 0.00 55.73 55.51 1nyq s ARG 391 Cb 0.09 -2.85 0.82 0.00 0.52 0.00 0.00 34.95 33.52 1nyq s ARG 391 CO 0.15 0.46 1.34 -2.30 0.02 0.00 0.00 175.30 174.98 1nyq n PRO 392 N 0.00 -0.06 0.26 3.54 -0.02 -1.26 0.11 135.00 137.57 1nyq n PRO 392 Ca -0.03 1.25 0.15 0.00 -2.02 0.00 0.00 63.50 62.85 1nyq n PRO 392 Cb 0.52 -2.06 0.50 0.00 -0.02 0.00 0.00 33.50 32.44 1nyq n PRO 392 CO 0.00 0.00 0.00 0.38 1.98 0.00 0.00 175.50 177.86 1nyq h ASP 393 N 0.00 0.00 -0.35 2.55 2.03 -2.00 -3.31 116.42 115.34 1nyq h ASP 393 Ca 0.59 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.89 1nyq h ASP 393 Cb 1.36 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.86 1nyq h ASP 393 CO -0.75 0.01 0.00 0.00 -1.03 0.00 0.00 179.24 177.46 1nyq n GLN 394 N -3.10 2.90 0.00 4.15 10.64 0.31 -4.82 117.38 127.45 1nyq n GLN 394 Ca 0.02 -2.20 0.00 0.00 -1.83 0.00 0.00 57.00 52.98 1nyq n GLN 394 Cb 0.39 -1.38 0.00 0.00 -0.86 0.00 0.00 30.24 28.39 1nyq n GLN 394 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.06 174.34 1nyq n ILE 395 N 0.39 0.00 -0.32 -0.39 5.41 -1.15 -1.62 119.36 121.68 1nyq n ILE 395 Ca 0.14 0.99 0.20 0.00 1.00 0.00 0.00 62.75 65.08 1nyq n ILE 395 Cb 0.51 -1.85 0.40 0.00 -0.71 0.00 0.00 39.64 37.99 1nyq n ILE 395 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 176.55 176.66 1nyq h LYS 396 N 0.00 0.12 0.30 0.38 1.57 -1.88 0.72 116.57 117.79 1nyq h LYS 396 Ca 0.00 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.76 1nyq h LYS 396 Cb 0.00 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.28 1nyq h LYS 396 CO 0.00 0.08 -0.14 1.49 -0.57 0.00 0.00 179.45 180.31 1nyq h GLU 397 N 0.13 -0.39 -0.64 3.15 4.81 -1.88 0.31 114.58 120.07 1nyq h GLU 397 Ca 0.67 0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.92 1nyq h GLU 397 Cb 1.53 0.09 -0.03 0.00 0.63 0.00 0.00 28.75 30.97 1nyq h GLU 397 CO -0.74 -0.16 0.34 1.49 -0.73 0.00 0.00 179.01 179.21 1nyq h GLU 398 N -0.54 0.89 -0.71 1.92 4.57 -0.12 -2.26 114.58 118.33 1nyq h GLU 398 Ca -0.04 -0.10 -0.05 0.00 -1.18 0.00 0.00 59.36 57.99 1nyq h GLU 398 Cb 0.40 -0.18 -0.03 0.00 -0.16 0.00 0.00 28.75 28.78 1nyq h GLU 398 CO 0.07 0.66 0.24 0.35 -1.18 0.00 0.00 179.01 179.15 1nyq h PHE 399 N 0.90 1.12 0.00 0.92 3.57 0.10 -2.41 116.94 121.14 1nyq h PHE 399 Ca 0.23 -0.11 -0.05 0.00 3.53 0.00 0.00 57.97 61.57 1nyq h PHE 399 Cb 0.04 -0.33 -0.01 0.00 2.79 0.00 0.00 35.95 38.44 1nyq h PHE 399 CO 0.01 0.89 -0.25 0.87 -2.23 0.00 0.00 178.31 177.60 1nyq h LYS 400 N 1.03 0.00 0.26 1.11 1.57 -0.02 -2.37 116.57 118.15 1nyq h LYS 400 Ca 0.23 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 59.00 1nyq h LYS 400 Cb 0.28 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.59 1nyq h LYS 400 CO -0.01 0.25 -0.12 -0.09 -0.57 0.00 0.00 179.45 178.90 1nyq h ARG 401 N 0.00 -0.33 -0.50 3.15 9.65 -0.94 -2.04 114.38 123.37 1nyq h ARG 401 Ca -0.00 0.02 0.09 0.00 -1.10 0.00 0.00 59.98 58.99 1nyq h ARG 401 Cb 0.77 0.08 -0.08 0.00 -1.39 0.00 0.00 29.97 29.35 1nyq h ARG 401 CO 0.03 -0.02 0.03 0.28 2.80 0.00 0.00 179.97 183.09 1nyq h VAL 402 N -0.67 0.64 -0.24 0.20 2.07 -1.29 -0.38 116.25 116.58 1nyq h VAL 402 Ca -0.04 -0.05 -0.00 0.00 0.82 0.00 0.00 66.70 67.43 1nyq h VAL 402 Cb 0.47 0.48 -0.01 0.00 -1.52 0.00 0.00 31.29 30.71 1nyq h VAL 402 CO 0.06 0.03 0.15 0.58 0.02 0.00 0.00 177.57 178.40 1nyq h VAL 403 N 0.15 1.09 -0.71 2.57 2.07 -1.37 -1.20 116.25 118.84 1nyq h VAL 403 Ca 0.25 -0.21 0.05 0.00 0.82 0.00 0.00 66.70 67.61 1nyq h VAL 403 Cb 0.37 0.79 -0.05 0.00 -1.52 0.00 0.00 31.29 30.87 1nyq h VAL 403 CO -0.39 0.09 0.43 0.78 0.02 0.00 0.00 177.57 178.49 1nyq h ASN 404 N 0.31 0.67 -0.20 0.57 2.35 -0.64 0.15 115.58 118.80 1nyq h ASN 404 Ca 0.09 0.01 0.05 0.00 -0.55 0.00 0.00 56.30 55.90 1nyq h ASN 404 Cb 0.01 -0.13 -0.05 0.00 0.05 0.00 0.00 38.32 38.20 1nyq h ASN 404 CO -0.02 0.45 -0.13 -0.03 -1.65 0.00 0.00 177.43 176.05 1nyq h MET 405 N 0.81 -0.12 -0.97 0.81 1.85 -0.47 2.30 114.93 119.13 1nyq h MET 405 Ca 0.30 0.01 0.03 0.00 -0.61 0.00 0.00 59.70 59.43 1nyq h MET 405 Cb 0.11 0.03 -0.05 0.00 0.43 0.00 0.00 31.60 32.12 1nyq h MET 405 CO -0.15 -0.08 0.64 0.82 -0.40 0.00 0.00 176.91 177.74 1nyq h ILE 406 N -0.13 1.20 -0.32 1.77 2.04 -0.47 0.87 117.51 122.47 1nyq h ILE 406 Ca 0.12 -0.43 -0.01 0.00 1.00 0.00 0.00 64.86 65.53 1nyq h ILE 406 Cb 0.30 -0.18 -0.01 0.00 -0.74 0.00 0.00 36.82 36.19 1nyq h ILE 406 CO -0.28 0.23 0.16 0.40 0.00 0.00 0.00 178.15 178.66 1nyq h ILE 407 N 1.26 1.15 -0.57 -0.67 5.03 0.11 -2.06 117.51 121.78 1nyq h ILE 407 Ca 0.38 -0.43 -0.09 0.00 -0.12 0.00 0.00 64.86 64.60 1nyq h ILE 407 Cb -0.05 0.85 -0.02 0.00 -3.03 0.00 0.00 36.82 34.56 1nyq h ILE 407 CO -0.11 0.16 -0.01 0.44 -0.68 0.00 0.00 178.15 177.95 1nyq h ASP 408 N 0.38 0.96 -0.22 1.72 3.32 0.65 -2.69 116.42 120.54 1nyq h ASP 408 Ca 0.11 -0.26 -0.01 0.00 0.02 0.00 0.00 57.03 56.89 1nyq h ASP 408 Cb 0.10 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.39 1nyq h ASP 408 CO -0.01 1.02 0.10 0.58 -1.72 0.00 0.00 179.24 179.21 1nyq h VAL 409 N 0.90 1.14 -0.77 -1.35 2.07 0.79 -1.65 116.25 117.38 1nyq h VAL 409 Ca 0.16 -0.40 0.14 0.00 0.82 0.00 0.00 66.70 67.42 1nyq h VAL 409 Cb 0.54 1.00 -0.05 0.00 -1.52 0.00 0.00 31.29 31.25 1nyq h VAL 409 CO 0.03 0.14 0.51 1.88 0.02 0.00 0.00 177.57 180.14 1nyq h TYR 410 N 0.22 0.56 -0.53 1.57 -1.99 -1.30 0.44 116.97 115.94 1nyq h TYR 410 Ca 0.08 0.02 -0.02 0.00 2.00 0.00 0.00 58.73 60.80 1nyq h TYR 410 Cb 0.12 -0.18 -0.02 0.00 2.00 0.00 0.00 36.73 38.65 1nyq h TYR 410 CO -0.02 0.22 0.26 -0.22 -0.00 0.00 0.00 178.16 178.39 1nyq h LYS 411 N 0.49 0.77 -0.69 4.88 3.64 -0.99 0.18 116.57 124.85 1nyq h LYS 411 Ca 0.38 -0.11 0.06 0.00 -1.27 0.00 0.00 60.65 59.70 1nyq h LYS 411 Cb 0.77 -0.14 -0.05 0.00 -0.41 0.00 0.00 32.23 32.40 1nyq h LYS 411 CO -0.13 0.63 0.40 -0.44 -2.27 0.00 0.00 179.45 177.64 1nyq h ASP 412 N 0.72 0.60 -0.19 4.20 3.32 0.72 -1.62 116.42 124.16 1nyq h ASP 412 Ca 0.18 0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.26 1nyq h ASP 412 Cb 0.12 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.57 1nyq h ASP 412 CO -0.02 0.39 0.00 0.49 -1.72 0.00 0.00 179.24 178.38 1nyq n PHE 413 N -4.75 0.25 -2.12 4.55 3.01 -0.69 -4.87 117.46 112.84 1nyq n PHE 413 Ca 0.09 -0.12 -0.16 0.00 1.01 0.00 0.00 57.45 58.27 1nyq n PHE 413 Cb 0.17 0.00 -0.02 0.00 -0.01 0.00 0.00 39.48 39.62 1nyq n PHE 413 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1nyq n GLY 414 N 1.08 0.12 3.60 1.37 0.00 -0.37 -4.95 105.19 106.03 1nyq n GLY 414 Ca 0.15 -0.24 -0.43 0.00 0.00 0.00 0.00 46.02 45.49 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 -2.73 2.68 -0.15 1.61 0.08 0.50 -4.85 117.98 115.12 1nyq s PHE 415 Ca 0.00 0.66 0.14 0.00 0.12 0.00 0.00 56.93 57.85 1nyq s PHE 415 Cb 0.00 -4.43 -0.24 0.00 -0.57 0.00 0.00 43.02 37.78 1nyq s PHE 415 CO 0.00 -1.48 0.24 0.39 -0.10 0.00 0.00 175.22 174.27 1nyq n GLU 416 N 8.00 0.67 -3.60 0.44 -0.58 -1.26 -4.60 120.64 119.71 1nyq n GLU 416 Ca 0.13 0.11 -0.40 0.00 -0.42 0.00 0.00 57.16 56.57 1nyq n GLU 416 Cb 0.49 -1.61 -0.11 0.00 -0.57 0.00 0.00 31.44 29.64 1nyq n GLU 416 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1nyq s ASP 417 N -5.80 5.71 0.15 1.62 1.01 -1.26 -5.03 116.67 113.07 1nyq s ASP 417 Ca -0.11 -0.88 -0.25 0.00 0.71 0.00 0.00 52.55 52.02 1nyq s ASP 417 Cb 0.07 -2.03 0.06 0.00 1.01 0.00 0.00 42.92 42.04 1nyq s ASP 417 CO 0.81 -0.35 0.94 -0.72 0.21 0.00 0.00 175.17 176.06 1nyq s TYR 418 N 1.57 -0.15 0.08 4.23 1.13 -1.26 -4.76 117.35 118.19 1nyq s TYR 418 Ca 0.03 -0.15 -0.08 0.00 -1.41 0.00 0.00 57.07 55.46 1nyq s TYR 418 Cb -0.19 0.64 -0.00 0.00 -1.10 0.00 0.00 41.96 41.30 1nyq s TYR 418 CO 0.07 -0.83 0.17 -1.54 -2.51 0.00 0.00 175.55 170.91 1nyq s SER 419 N -2.90 0.15 0.45 -0.18 1.04 0.10 -4.98 113.70 107.38 1nyq s SER 419 Ca 0.12 -0.67 0.08 0.00 0.48 0.00 0.00 55.95 55.96 1nyq s SER 419 Cb -0.02 0.32 0.02 0.00 0.10 0.00 0.00 66.02 66.45 1nyq s SER 419 CO 0.02 -0.71 0.58 -0.36 0.98 0.00 0.00 173.24 173.74 1nyq s PHE 420 N -3.81 2.52 -0.30 5.02 0.08 -1.26 0.28 117.98 120.52 1nyq s PHE 420 Ca 0.05 -0.48 -0.12 0.00 0.12 0.00 0.00 56.93 56.49 1nyq s PHE 420 Cb 0.05 -2.31 0.17 0.00 -0.57 0.00 0.00 43.02 40.36 1nyq s PHE 420 CO -0.11 -0.51 0.96 0.50 -0.10 0.00 0.00 175.22 175.97 1nyq s ARG 421 N -4.37 0.29 -0.40 0.44 3.52 -0.85 -4.04 118.95 113.54 1nyq s ARG 421 Ca 0.55 0.60 -0.27 0.00 -0.13 0.00 0.00 55.73 56.47 1nyq s ARG 421 Cb -0.08 0.35 0.02 0.00 -1.56 0.00 0.00 34.95 33.68 1nyq s ARG 421 CO 0.33 -0.22 1.01 -0.51 -0.81 0.00 0.00 175.30 175.10 1nyq s LEU 422 N 2.72 3.89 -0.12 -0.88 1.43 -0.75 -2.00 118.68 122.97 1nyq s LEU 422 Ca 0.01 0.56 -0.17 0.00 -1.03 0.00 0.00 54.13 53.50 1nyq s LEU 422 Cb -0.09 -3.38 -0.04 0.00 0.03 0.00 0.00 46.19 42.71 1nyq s LEU 422 CO -0.15 -1.00 0.43 -0.94 0.23 0.00 0.00 176.35 174.92 1nyq s SER 423 N 2.06 6.64 0.11 2.29 1.04 -1.09 -2.17 113.70 122.58 1nyq s SER 423 Ca 0.42 0.76 0.07 0.00 0.48 0.00 0.00 55.95 57.67 1nyq s SER 423 Cb -0.10 -2.26 -0.04 0.00 0.10 0.00 0.00 66.02 63.72 1nyq s SER 423 CO 0.23 0.05 -0.07 -0.31 0.98 0.00 0.00 173.24 174.11 1nyq s TYR 424 N 0.46 2.79 0.00 5.02 2.02 0.43 -3.36 117.35 124.71 1nyq s TYR 424 Ca 0.24 -0.14 0.00 0.00 -0.37 0.00 0.00 57.07 56.80 1nyq s TYR 424 Cb -0.15 -1.44 0.00 0.00 -0.40 0.00 0.00 41.96 39.98 1nyq s TYR 424 CO 0.09 0.45 0.00 -2.13 -1.57 0.00 0.00 175.55 172.39 1nyq n ARG 425 N 0.55 0.00 -3.06 -0.62 0.63 -1.26 0.66 116.66 113.56 1nyq n ARG 425 Ca -0.12 0.00 -0.10 0.00 -0.92 0.00 0.00 57.85 56.71 1nyq n ARG 425 Cb 0.53 0.00 -0.03 0.00 0.45 0.00 0.00 32.46 33.40 1nyq n ARG 425 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 1nyq n ASP 426 N 0.16 0.20 -4.18 6.15 8.00 -1.26 -3.95 116.55 121.65 1nyq n ASP 426 Ca 0.00 -2.01 -0.11 0.00 0.71 0.00 0.00 54.79 53.39 1nyq n ASP 426 Cb 0.00 0.66 -0.06 0.00 -0.02 0.00 0.00 41.12 41.70 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 -0.34 0.04 -3.31 -0.24 -0.04 -1.26 -4.87 135.00 124.97 1nyq n PRO 427 Ca 0.01 -0.82 -0.24 0.00 -0.04 0.00 0.00 63.50 62.41 1nyq n PRO 427 Cb 0.28 -2.40 -0.01 0.00 -0.04 0.00 0.00 33.50 31.33 1nyq n PRO 427 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 1nyq s GLU 428 N 6.51 3.45 0.20 0.54 -6.30 -1.25 -4.69 118.70 117.15 1nyq s GLU 428 Ca 0.42 -0.33 0.02 0.00 -2.50 0.00 0.00 54.97 52.58 1nyq s GLU 428 Cb -0.00 -2.64 -0.05 0.00 0.00 0.00 0.00 34.13 31.44 1nyq s GLU 428 CO 0.12 0.10 0.02 0.34 0.02 0.00 0.00 175.26 175.86 1nyq s ASP 429 N -4.05 1.28 0.27 -1.70 -1.08 -1.26 -4.89 116.67 105.23 1nyq s ASP 429 Ca 0.41 -1.22 0.02 0.00 -0.52 0.00 0.00 52.55 51.25 1nyq s ASP 429 Cb -0.10 0.11 -0.04 0.00 -1.46 0.00 0.00 42.92 41.44 1nyq s ASP 429 CO 0.37 -0.59 0.17 -0.75 0.52 0.00 0.00 175.17 174.89 1nyq s LYS 430 N -3.93 1.47 0.13 4.34 2.20 -1.18 -4.74 119.74 118.03 1nyq s LYS 430 Ca 0.27 -1.82 0.04 0.00 -0.36 0.00 0.00 55.97 54.11 1nyq s LYS 430 Cb 0.06 0.13 -0.14 0.00 -1.51 0.00 0.00 37.83 36.38 1nyq s LYS 430 CO 0.06 -0.46 1.30 1.49 -0.36 0.00 0.00 175.35 177.38 1nyq h GLU 431 N 2.36 0.09 -2.30 4.03 4.81 -2.01 -3.39 114.58 118.17 1nyq h GLU 431 Ca -0.33 -0.13 -0.68 0.00 -0.13 0.00 0.00 59.36 58.09 1nyq h GLU 431 Cb 1.25 0.04 -0.36 0.00 0.63 0.00 0.00 28.75 30.31 1nyq h GLU 431 CO 0.49 1.00 0.03 1.17 -0.73 0.00 0.00 179.01 180.98 1nyq n LYS 432 N -3.48 4.06 -3.94 1.92 0.00 -1.26 -4.92 118.16 110.54 1nyq n LYS 432 Ca -0.02 -4.77 -0.31 0.00 0.00 0.00 0.00 58.31 53.21 1nyq n LYS 432 Cb 0.90 -2.34 -0.07 0.00 0.00 0.00 0.00 35.03 33.53 1nyq n LYS 432 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.40 178.38 1nyq n TYR 433 N -0.04 -0.96 -4.33 5.64 9.36 -1.26 -4.92 117.16 120.64 1nyq n TYR 433 Ca 0.37 0.53 -0.17 0.00 3.32 0.00 0.00 57.90 61.94 1nyq n TYR 433 Cb 0.34 -1.78 -0.10 0.00 -0.63 0.00 0.00 39.34 37.17 1nyq n TYR 433 CO 0.00 0.00 0.00 -0.06 0.22 0.00 0.00 176.86 177.02 1nyq s PHE 434 N -3.31 1.57 -0.62 2.98 0.08 -1.26 -5.08 117.98 112.34 1nyq s PHE 434 Ca 0.41 -1.02 0.06 0.00 0.12 0.00 0.00 56.93 56.50 1nyq s PHE 434 Cb -0.24 -0.93 0.28 0.00 -0.57 0.00 0.00 43.02 41.56 1nyq s PHE 434 CO 0.81 -0.14 0.82 -0.25 -0.10 0.00 0.00 175.22 176.36 1nyq n ASP 435 N -0.45 4.05 0.00 1.36 8.00 -1.26 -3.11 116.55 125.14 1nyq n ASP 435 Ca -0.03 -3.53 0.00 0.00 0.71 0.00 0.00 54.79 51.93 1nyq n ASP 435 Cb 0.65 -0.64 0.00 0.00 -0.02 0.00 0.00 41.12 41.11 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 0.47 0.00 -0.32 -2.24 -0.08 -1.26 -4.71 116.55 108.41 1nyq n ASP 436 Ca 0.30 0.00 0.03 0.00 -1.51 0.00 0.00 54.79 53.61 1nyq n ASP 436 Cb 0.40 0.00 0.22 0.00 2.34 0.00 0.00 41.12 44.08 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 0.00 0.95 0.40 1.67 5.19 -2.01 -2.23 116.42 120.40 1nyq h ASP 437 Ca 0.00 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.40 1nyq h ASP 437 Cb 0.00 -0.20 -0.02 0.00 0.18 0.00 0.00 39.33 39.29 1nyq h ASP 437 CO 0.00 0.62 -0.43 -0.78 -3.12 0.00 0.00 179.24 175.53 1nyq h ASP 438 N 1.09 -1.19 0.00 6.45 3.58 -2.01 -3.05 116.42 121.29 1nyq h ASP 438 Ca 0.39 0.10 0.00 0.00 0.42 0.00 0.00 57.03 57.94 1nyq h ASP 438 Cb 0.15 0.40 0.00 0.00 1.72 0.00 0.00 39.33 41.59 1nyq h ASP 438 CO -0.14 -0.56 0.00 0.80 -2.88 0.00 0.00 179.24 176.46 1nyq n MET 439 N -5.01 0.00 -0.28 0.28 1.56 -0.85 -0.96 117.12 111.85 1nyq n MET 439 Ca -0.10 0.75 0.27 0.00 -0.27 0.00 0.00 57.70 58.35 1nyq n MET 439 Cb 0.39 -1.19 0.50 0.00 2.15 0.00 0.00 33.22 35.06 1nyq n MET 439 CO 0.00 0.00 0.00 0.91 -0.73 0.00 0.00 175.97 176.15 1nyq n TRP 440 N -2.30 0.99 -0.03 1.12 7.02 -1.13 0.30 117.44 123.42 1nyq n TRP 440 Ca 0.00 1.03 -0.13 0.00 -1.02 0.00 0.00 57.50 57.37 1nyq n TRP 440 Cb 0.00 -1.42 -0.10 0.00 -2.42 0.00 0.00 31.31 27.37 1nyq n TRP 440 CO 0.00 0.00 0.00 -0.91 -2.02 0.00 0.00 177.69 174.76 1nyq h ASN 441 N 0.00 0.04 -0.71 -0.99 -0.26 -0.93 -0.50 115.58 112.23 1nyq h ASN 441 Ca 0.73 -0.58 0.14 0.00 -0.56 0.00 0.00 56.30 56.03 1nyq h ASN 441 Cb 1.90 -0.01 -0.10 0.00 -1.06 0.00 0.00 38.32 39.05 1nyq h ASN 441 CO -0.68 0.62 0.22 0.50 -1.06 0.00 0.00 177.43 177.02 1nyq h LYS 442 N -0.53 0.33 -0.30 0.81 3.64 0.64 0.23 116.57 121.39 1nyq h LYS 442 Ca 0.00 -0.02 -0.18 0.00 -1.27 0.00 0.00 60.65 59.18 1nyq h LYS 442 Cb 0.61 -0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 32.35 1nyq h LYS 442 CO 0.01 0.22 -0.51 0.00 -2.27 0.00 0.00 179.45 176.90 1nyq h ALA 443 N 1.55 0.53 0.09 5.00 0.00 -1.06 -2.75 119.26 122.62 1nyq h ALA 443 Ca 0.39 -0.50 -0.17 0.00 0.00 0.00 0.00 54.91 54.63 1nyq h ALA 443 Cb 0.62 -0.09 0.02 0.00 0.00 0.00 0.00 17.79 18.34 1nyq h ALA 443 CO -0.44 0.68 -0.72 0.93 0.00 0.00 0.00 179.25 179.70 1nyq h GLU 444 N 0.67 0.33 0.00 0.00 5.08 -0.33 0.48 114.58 120.80 1nyq h GLU 444 Ca 0.03 -0.47 0.00 0.00 -1.00 0.00 0.00 59.36 57.91 1nyq h GLU 444 Cb 1.10 0.16 0.00 0.00 0.50 0.00 0.00 28.75 30.52 1nyq h GLU 444 CO 0.11 1.19 0.00 -0.91 -1.00 0.00 0.00 179.01 178.40 1nyq h ASN 445 N -0.30 0.00 0.03 1.42 2.35 -0.67 0.89 115.58 119.30 1nyq h ASN 445 Ca -0.12 0.00 -0.22 0.00 -0.55 0.00 0.00 56.30 55.41 1nyq h ASN 445 Cb 1.51 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.86 1nyq h ASN 445 CO 0.14 0.00 -1.19 -0.03 -1.65 0.00 0.00 177.43 174.70 1nyq h MET 446 N 0.00 0.05 -0.33 0.81 4.05 -1.31 -2.70 114.93 115.49 1nyq h MET 446 Ca 0.00 -0.09 0.01 0.00 -0.28 0.00 0.00 59.70 59.34 1nyq h MET 446 Cb 0.08 0.03 -0.02 0.00 -0.80 0.00 0.00 31.60 30.89 1nyq h MET 446 CO 0.00 1.04 0.20 1.25 0.23 0.00 0.00 176.91 179.63 1nyq h LEU 447 N -0.82 0.32 -1.61 3.39 6.46 0.61 -1.27 115.31 122.39 1nyq h LEU 447 Ca -0.31 0.00 -0.02 0.00 -0.12 0.00 0.00 57.88 57.44 1nyq h LEU 447 Cb 1.39 -0.07 -0.01 0.00 -0.73 0.00 0.00 40.66 41.24 1nyq h LEU 447 CO -0.12 0.23 0.06 0.50 -0.62 0.00 0.00 178.44 178.49 1nyq h LYS 448 N 0.40 0.31 0.18 1.25 3.64 -1.00 -2.13 116.57 119.23 1nyq h LYS 448 Ca 0.13 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.47 1nyq h LYS 448 Cb -0.00 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 31.76 1nyq h LYS 448 CO -0.06 0.29 -0.09 0.93 -2.27 0.00 0.00 179.45 178.25 1nyq h GLU 449 N 0.31 -0.24 -0.51 1.90 5.08 -0.92 -2.74 114.58 117.46 1nyq h GLU 449 Ca 0.08 0.02 0.10 0.00 -1.00 0.00 0.00 59.36 58.56 1nyq h GLU 449 Cb 0.11 0.05 -0.09 0.00 0.50 0.00 0.00 28.75 29.33 1nyq h GLU 449 CO -0.00 0.13 -0.08 0.00 -1.00 0.00 0.00 179.01 178.05 1nyq h ALA 450 N 0.03 0.39 -0.54 3.43 0.00 -1.16 0.18 119.26 121.59 1nyq h ALA 450 Ca -0.03 0.18 0.09 0.00 0.00 0.00 0.00 54.91 55.15 1nyq h ALA 450 Cb 0.48 0.34 -0.10 0.00 0.00 0.00 0.00 17.79 18.50 1nyq h ALA 450 CO 0.04 -0.42 -0.42 0.00 0.00 0.00 0.00 179.25 178.44 1nyq h ALA 451 N 1.49 -0.32 -0.08 0.00 0.00 -1.36 -0.29 119.26 118.70 1nyq h ALA 451 Ca 0.25 0.10 -0.10 0.00 0.00 0.00 0.00 54.91 55.17 1nyq h ALA 451 Cb 0.38 0.93 -0.01 0.00 0.00 0.00 0.00 17.79 19.09 1nyq h ALA 451 CO -0.49 -0.82 -0.39 -0.44 0.00 0.00 0.00 179.25 177.12 1nyq h ASP 452 N -0.24 0.18 0.27 0.00 3.32 -0.91 0.72 116.42 119.76 1nyq h ASP 452 Ca 0.18 -0.07 -0.05 0.00 0.02 0.00 0.00 57.03 57.11 1nyq h ASP 452 Cb 0.57 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 40.06 1nyq h ASP 452 CO -0.66 0.55 -0.22 -0.33 -1.72 0.00 0.00 179.24 176.86 1nyq h GLU 453 N 0.15 0.00 0.23 3.56 5.08 0.51 -2.38 114.58 121.73 1nyq h GLU 453 Ca 0.01 0.00 -0.34 0.00 -1.00 0.00 0.00 59.36 58.04 1nyq h GLU 453 Cb 0.75 0.00 0.03 0.00 0.50 0.00 0.00 28.75 30.03 1nyq h GLU 453 CO 0.06 0.22 -1.55 1.25 -1.00 0.00 0.00 179.01 177.99 1nyq h LEU 454 N 0.00 0.76 0.00 1.33 5.85 -0.20 -3.49 115.31 119.56 1nyq h LEU 454 Ca -0.00 -0.93 0.00 0.00 0.84 0.00 0.00 57.88 57.79 1nyq h LEU 454 Cb 0.42 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 41.20 1nyq h LEU 454 CO 0.03 1.73 0.00 0.61 -0.34 0.00 0.00 178.44 180.47 1nyq n GLY 455 N 1.77 0.92 0.73 3.75 0.00 0.16 -5.11 105.19 107.41 1nyq n GLY 455 Ca -0.20 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.78 1nyq n GLY 455 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1nyq n LEU 456 N 0.00 0.00 -3.93 0.99 4.32 -1.15 -5.04 117.00 112.19 1nyq n LEU 456 Ca 0.00 -0.41 -0.14 0.00 -0.02 0.00 0.00 56.01 55.43 1nyq n LEU 456 Cb 0.00 -0.11 -0.14 0.00 -1.62 0.00 0.00 43.42 41.55 1nyq n LEU 456 CO 0.00 -0.58 -0.39 -0.44 -1.22 0.00 0.00 177.39 174.76 1nyq s SER 457 N -1.75 0.39 0.00 -1.43 0.01 -1.26 -4.91 113.70 104.76 1nyq s SER 457 Ca 0.12 -0.09 0.00 0.00 1.31 0.00 0.00 55.95 57.30 1nyq s SER 457 Cb -0.01 -0.04 0.00 0.00 0.21 0.00 0.00 66.02 66.19 1nyq s SER 457 CO 0.08 0.02 0.00 0.00 0.41 0.00 0.00 173.24 173.75 1nyq n TYR 458 N 2.91 0.00 -3.67 2.43 4.11 -1.26 -4.13 117.16 117.55 1nyq n TYR 458 Ca -0.13 0.00 -0.10 0.00 -0.00 0.00 0.00 57.90 57.67 1nyq n TYR 458 Cb 0.59 0.00 -0.09 0.00 -0.00 0.00 0.00 39.34 39.84 1nyq n TYR 458 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.86 175.65 1nyq s GLU 459 N 4.09 0.60 0.78 -3.48 0.41 -1.26 -4.94 118.70 114.90 1nyq s GLU 459 Ca 0.00 0.98 -0.11 0.00 -0.41 0.00 0.00 54.97 55.42 1nyq s GLU 459 Cb 0.00 0.14 0.06 0.00 -1.78 0.00 0.00 34.13 32.55 1nyq s GLU 459 CO 0.00 -0.13 1.10 -1.21 -0.49 0.00 0.00 175.26 174.52 1nyq s GLU 460 N 1.21 2.23 -0.30 1.61 0.41 -1.26 -1.82 118.70 120.79 1nyq s GLU 460 Ca -0.07 0.60 -0.09 0.00 -0.41 0.00 0.00 54.97 55.01 1nyq s GLU 460 Cb -0.06 -1.94 0.18 0.00 -1.78 0.00 0.00 34.13 30.54 1nyq s GLU 460 CO -0.12 -1.51 0.92 0.00 -0.49 0.00 0.00 175.26 174.06 1nyq s ALA 461 N -3.20 -3.27 -0.10 5.21 0.00 -0.92 -4.86 121.76 114.62 1nyq s ALA 461 Ca 0.60 1.44 -0.19 0.00 0.00 0.00 0.00 51.96 53.82 1nyq s ALA 461 Cb -0.14 -2.53 -0.04 0.00 0.00 0.00 0.00 23.12 20.41 1nyq s ALA 461 CO 0.54 -1.62 0.52 -1.50 0.00 0.00 0.00 175.76 173.69 1nyq s ILE 462 N 2.93 5.15 0.00 0.00 1.10 -1.26 0.16 121.20 129.28 1nyq s ILE 462 Ca 0.10 1.04 0.00 0.00 -0.51 0.00 0.00 60.65 61.29 1nyq s ILE 462 Cb -0.09 -3.86 0.00 0.00 0.15 0.00 0.00 42.46 38.66 1nyq s ILE 462 CO -0.17 0.32 0.00 0.61 -2.11 0.00 0.00 174.94 173.59 1nyq n GLY 463 N 3.17 1.14 0.16 1.50 0.00 0.21 -4.87 105.19 106.49 1nyq n GLY 463 Ca -0.06 0.00 0.02 0.00 0.00 0.00 0.00 46.02 45.98 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 -1.56 -0.27 -1.16 1.61 -0.58 -1.20 -4.98 120.64 112.51 1nyq n GLU 464 Ca 0.00 -0.72 -0.15 0.00 -0.42 0.00 0.00 57.16 55.87 1nyq n GLU 464 Cb 0.00 -1.07 0.10 0.00 -0.57 0.00 0.00 31.44 29.90 1nyq n GLU 464 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1nyq n ALA 465 N 0.19 -0.62 -2.62 0.62 0.00 -1.24 -4.74 120.51 112.12 1nyq n ALA 465 Ca 0.02 -0.95 -0.33 0.00 0.00 0.00 0.00 53.44 52.19 1nyq n ALA 465 Cb 0.10 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.50 1nyq n ALA 465 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1nyq s ALA 466 N -3.76 3.75 -0.91 0.00 0.00 0.09 -4.81 121.76 116.12 1nyq s ALA 466 Ca 0.39 -0.47 0.00 0.00 0.00 0.00 0.00 51.96 51.88 1nyq s ALA 466 Cb -0.01 -2.21 0.00 0.00 0.00 0.00 0.00 23.12 20.90 1nyq s ALA 466 CO 0.27 0.62 0.82 1.97 0.00 0.00 0.00 175.76 179.44 1nyq n PHE 467 N 0.33 0.00 -0.11 0.00 1.16 -1.26 -1.27 117.46 116.32 1nyq n PHE 467 Ca -0.04 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.54 1nyq n PHE 467 Cb 0.52 -0.33 0.00 0.00 -1.61 0.00 0.00 39.48 38.06 1nyq n PHE 467 CO 0.00 0.00 0.00 2.48 -1.87 0.00 0.00 176.76 177.37 1nyq n TYR 468 N -1.32 0.00 0.00 2.97 0.18 -1.26 -3.82 117.16 113.92 1nyq n TYR 468 Ca 0.00 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.78 1nyq n TYR 468 Cb 0.09 0.00 0.00 0.00 -0.38 0.00 0.00 39.34 39.05 1nyq n TYR 468 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 1nyq n GLY 469 N 0.18 0.66 3.90 -7.48 0.00 -0.39 -4.26 105.19 97.80 1nyq n GLY 469 Ca 0.00 -0.98 -0.28 0.00 0.00 0.00 0.00 46.02 44.76 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 -2.00 3.60 0.28 1.61 0.04 -1.25 -0.73 135.00 136.55 1nyq s PRO 470 Ca 0.00 0.24 0.06 0.00 0.04 0.00 0.00 61.00 61.35 1nyq s PRO 470 Cb 0.00 -2.40 -0.06 0.00 0.04 0.00 0.00 34.50 32.08 1nyq s PRO 470 CO 0.00 -0.13 -0.05 0.15 0.04 0.00 0.00 177.00 177.00 1nyq s LYS 471 N -4.45 1.55 -0.45 4.56 1.02 -1.21 -0.92 119.74 119.84 1nyq s LYS 471 Ca 0.48 -1.79 -0.01 0.00 0.02 0.00 0.00 55.97 54.66 1nyq s LYS 471 Cb -0.10 -1.13 0.12 0.00 -0.52 0.00 0.00 37.83 36.20 1nyq s LYS 471 CO 0.41 0.02 0.24 -1.17 -0.92 0.00 0.00 175.35 173.93 1nyq s LEU 472 N -3.44 5.12 -0.27 3.17 0.20 -0.24 -2.66 118.68 120.55 1nyq s LEU 472 Ca 0.30 -2.29 -0.18 0.00 0.69 0.00 0.00 54.13 52.64 1nyq s LEU 472 Cb 0.04 -1.79 -0.02 0.00 -0.43 0.00 0.00 46.19 43.98 1nyq s LEU 472 CO 0.12 -0.46 0.54 -1.81 -0.29 0.00 0.00 176.35 174.45 1nyq s ASP 473 N 1.31 6.45 -0.51 3.68 1.01 -0.85 -2.12 116.67 125.64 1nyq s ASP 473 Ca 0.11 0.51 -0.25 0.00 0.71 0.00 0.00 52.55 53.63 1nyq s ASP 473 Cb -0.22 -2.29 0.03 0.00 1.01 0.00 0.00 42.92 41.45 1nyq s ASP 473 CO -0.04 -0.33 0.96 -0.69 0.21 0.00 0.00 175.17 175.29 1nyq s VAL 474 N 2.37 4.38 0.09 -1.27 1.01 -0.62 -2.00 120.40 124.36 1nyq s VAL 474 Ca 0.22 0.57 -0.21 0.00 0.00 0.00 0.00 61.98 62.56 1nyq s VAL 474 Cb -0.16 -4.51 -0.07 0.00 0.00 0.00 0.00 36.38 31.64 1nyq s VAL 474 CO 0.09 -1.01 0.62 -1.10 0.00 0.00 0.00 175.10 173.70 1nyq s GLN 475 N 3.98 4.29 0.12 2.72 -1.52 0.81 -0.85 119.66 129.21 1nyq s GLN 475 Ca 0.35 0.83 0.04 0.00 -1.95 0.00 0.00 55.36 54.63 1nyq s GLN 475 Cb -0.11 -3.25 -0.04 0.00 -0.22 0.00 0.00 33.01 29.39 1nyq s GLN 475 CO 0.23 0.60 -0.09 0.08 -0.25 0.00 0.00 175.29 175.86 1nyq s VAL 476 N -1.03 1.01 -0.21 1.09 1.01 0.96 0.00 120.40 123.23 1nyq s VAL 476 Ca 0.31 -1.93 -0.05 0.00 0.00 0.00 0.00 61.98 60.31 1nyq s VAL 476 Cb -0.20 -1.69 -0.02 0.00 0.00 0.00 0.00 36.38 34.47 1nyq s VAL 476 CO 0.20 -0.73 -0.01 -0.75 0.00 0.00 0.00 175.10 173.82 1nyq s LYS 477 N -3.53 3.54 1.13 2.72 2.20 -1.26 0.59 119.74 125.13 1nyq s LYS 477 Ca 0.13 -0.55 -0.19 0.00 -0.36 0.00 0.00 55.97 55.00 1nyq s LYS 477 Cb 0.02 -3.08 0.12 0.00 -1.51 0.00 0.00 37.83 33.38 1nyq s LYS 477 CO -0.01 -0.07 0.05 2.41 -0.36 0.00 0.00 175.35 177.37 1nyq n THR 478 N 4.48 0.00 0.04 3.43 -1.04 0.51 -4.79 114.28 116.91 1nyq n THR 478 Ca -0.17 -0.31 -0.08 0.00 -2.04 0.00 0.00 64.05 61.45 1nyq n THR 478 Cb 0.51 -0.63 0.09 0.00 -1.82 0.00 0.00 70.33 68.48 1nyq n THR 478 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1nyq h ALA 479 N -2.13 0.77 0.00 2.41 0.00 -1.92 -1.69 119.26 116.70 1nyq h ALA 479 Ca -0.55 -0.52 0.00 0.00 0.00 0.00 0.00 54.91 53.84 1nyq h ALA 479 Cb 1.36 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1nyq h ALA 479 CO 0.39 0.70 0.00 0.00 0.00 0.00 0.00 179.25 180.34 1nyq n MET 480 N -3.93 0.76 0.00 0.00 -0.00 -1.26 -4.73 117.12 107.96 1nyq n MET 480 Ca -0.03 0.00 0.00 0.00 -0.00 0.00 0.00 57.70 57.67 1nyq n MET 480 Cb 0.60 -1.46 0.00 0.00 -0.00 0.00 0.00 33.22 32.37 1nyq n MET 480 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1nyq n GLY 481 N 0.50 3.30 3.56 3.17 0.00 -0.64 -5.06 105.19 110.03 1nyq n GLY 481 Ca 0.17 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.74 1nyq n GLY 481 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1nyq n LYS 482 N -1.30 1.13 -3.50 1.61 4.76 -1.26 -4.31 118.16 115.29 1nyq n LYS 482 Ca 0.00 0.40 -0.37 0.00 -2.87 0.00 0.00 58.31 55.46 1nyq n LYS 482 Cb 0.00 -1.71 -0.06 0.00 -1.84 0.00 0.00 35.03 31.42 1nyq n LYS 482 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 1nyq s GLU 483 N -1.48 3.90 0.04 1.97 0.41 -1.26 0.19 118.70 122.47 1nyq s GLU 483 Ca 0.60 0.38 -0.04 0.00 -0.41 0.00 0.00 54.97 55.50 1nyq s GLU 483 Cb -0.73 -3.16 -0.02 0.00 -1.78 0.00 0.00 34.13 28.44 1nyq s GLU 483 CO 0.59 0.65 0.05 -1.83 -0.49 0.00 0.00 175.26 174.24 1nyq s GLU 484 N -1.29 0.58 -0.21 1.61 -1.05 0.20 -4.89 118.70 113.65 1nyq s GLU 484 Ca 0.26 -0.87 -0.24 0.00 -0.15 0.00 0.00 54.97 53.97 1nyq s GLU 484 Cb -0.16 0.22 -0.01 0.00 -0.44 0.00 0.00 34.13 33.73 1nyq s GLU 484 CO 0.15 -0.13 0.77 0.99 0.95 0.00 0.00 175.26 177.98 1nyq s THR 485 N -2.90 4.90 -0.02 1.83 2.01 -1.26 -0.03 115.64 120.16 1nyq s THR 485 Ca -0.02 1.47 -0.02 0.00 0.31 0.00 0.00 61.69 63.43 1nyq s THR 485 Cb 0.01 -4.07 -0.01 0.00 0.01 0.00 0.00 72.50 68.44 1nyq s THR 485 CO -0.06 0.00 -0.04 -0.11 -0.69 0.00 0.00 174.62 173.72 1nyq n LEU 486 N 5.56 0.25 -4.98 4.42 7.94 -0.03 -4.95 117.00 125.22 1nyq n LEU 486 Ca 0.03 0.10 -0.19 0.00 -1.11 0.00 0.00 56.01 54.84 1nyq n LEU 486 Cb 0.48 -0.54 -0.01 0.00 0.53 0.00 0.00 43.42 43.89 1nyq n LEU 486 CO 0.46 -0.48 0.04 -0.44 -1.11 0.00 0.00 177.39 175.86 1nyq s SER 487 N -4.16 5.96 -0.28 1.96 0.01 -1.19 -3.89 113.70 112.11 1nyq s SER 487 Ca -0.03 -0.18 -0.22 0.00 1.31 0.00 0.00 55.95 56.82 1nyq s SER 487 Cb 0.00 -1.29 0.11 0.00 0.21 0.00 0.00 66.02 65.06 1nyq s SER 487 CO 0.05 -0.38 0.90 0.28 0.41 0.00 0.00 173.24 174.50 1nyq s THR 488 N -2.16 0.00 -0.29 1.44 -1.32 -1.09 -1.59 115.64 110.64 1nyq s THR 488 Ca 0.43 0.00 -0.01 0.00 -1.21 0.00 0.00 61.69 60.91 1nyq s THR 488 Cb -0.09 -1.00 0.09 0.00 -1.51 0.00 0.00 72.50 69.99 1nyq s THR 488 CO 0.30 0.00 0.07 0.00 -2.21 0.00 0.00 174.62 172.79 1nyq s ALA 489 N 0.64 1.60 0.40 11.08 0.00 -0.90 -0.16 121.76 134.42 1nyq s ALA 489 Ca -0.01 -1.56 0.08 0.00 0.00 0.00 0.00 51.96 50.46 1nyq s ALA 489 Cb -0.05 -1.57 -0.00 0.00 0.00 0.00 0.00 23.12 21.50 1nyq s ALA 489 CO -0.08 -1.55 0.49 1.14 0.00 0.00 0.00 175.76 175.76 1nyq s GLN 490 N 1.58 2.77 -0.18 0.00 -2.07 0.24 -1.08 119.66 120.93 1nyq s GLN 490 Ca 0.07 -1.30 -0.00 0.00 -1.82 0.00 0.00 55.36 52.30 1nyq s GLN 490 Cb -0.17 -2.64 0.01 0.00 -1.09 0.00 0.00 33.01 29.11 1nyq s GLN 490 CO -0.20 -0.19 -0.15 -0.51 -1.32 0.00 0.00 175.29 172.92 1nyq s LEU 491 N -4.25 2.39 -0.18 2.60 1.43 -0.09 -1.58 118.68 119.00 1nyq s LEU 491 Ca 0.51 -0.54 0.01 0.00 -1.03 0.00 0.00 54.13 53.08 1nyq s LEU 491 Cb -0.08 -1.56 0.03 0.00 0.03 0.00 0.00 46.19 44.61 1nyq s LEU 491 CO 0.31 0.02 -0.14 -0.62 0.23 0.00 0.00 176.35 176.15 1nyq s ASP 492 N 1.19 3.11 -0.02 2.29 2.15 0.67 -3.85 116.67 122.21 1nyq s ASP 492 Ca 0.02 -0.70 0.13 0.00 0.43 0.00 0.00 52.55 52.43 1nyq s ASP 492 Cb -0.14 -1.27 -0.20 0.00 -0.30 0.00 0.00 42.92 41.01 1nyq s ASP 492 CO -0.07 -0.08 0.28 0.49 -0.17 0.00 0.00 175.17 175.61 1nyq n PHE 493 N 4.70 0.00 0.00 -5.34 3.72 -1.26 -1.22 117.46 118.06 1nyq n PHE 493 Ca -0.17 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.23 1nyq n PHE 493 Cb 0.48 -0.31 0.00 0.00 -0.94 0.00 0.00 39.48 38.71 1nyq n PHE 493 CO 0.00 0.00 0.00 -0.11 -0.05 0.00 0.00 176.76 176.60 1nyq n LEU 494 N -1.98 0.22 -0.31 4.37 7.94 -1.26 -4.05 117.00 121.93 1nyq n LEU 494 Ca -0.03 0.72 0.27 0.00 -1.11 0.00 0.00 56.01 55.86 1nyq n LEU 494 Cb 0.36 -0.32 0.60 0.00 0.53 0.00 0.00 43.42 44.59 1nyq n LEU 494 CO 0.27 -0.32 1.25 -0.07 -1.11 0.00 0.00 177.39 177.41 1nyq h LEU 495 N 0.00 0.28 -2.26 -1.96 4.07 -1.87 1.07 115.31 114.63 1nyq h LEU 495 Ca 0.00 0.05 -0.01 0.00 0.08 0.00 0.00 57.88 58.01 1nyq h LEU 495 Cb 0.00 0.01 -0.00 0.00 1.08 0.00 0.00 40.66 41.75 1nyq h LEU 495 CO 0.00 0.05 -0.04 -0.65 -1.08 0.00 0.00 178.44 176.72 1nyq h PRO 496 N 0.25 0.00 0.00 1.13 0.11 -1.86 0.54 132.00 132.17 1nyq h PRO 496 Ca 0.57 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 66.62 1nyq h PRO 496 Cb 1.74 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.84 1nyq h PRO 496 CO -0.19 0.04 -0.42 0.93 -0.21 0.00 0.00 178.00 178.14 1nyq h GLU 497 N 0.00 0.00 -0.97 1.05 4.39 0.96 0.18 114.58 120.19 1nyq h GLU 497 Ca -0.00 0.00 0.25 0.00 0.34 0.00 0.00 59.36 59.95 1nyq h GLU 497 Cb 0.22 0.00 -0.07 0.00 -0.10 0.00 0.00 28.75 28.80 1nyq h GLU 497 CO 0.01 0.67 0.65 0.00 -1.16 0.00 0.00 179.01 179.17 1nyq h ARG 498 N -1.00 0.29 -0.68 2.33 2.47 -0.56 0.19 114.38 117.42 1nyq h ARG 498 Ca -0.10 -0.02 0.00 0.00 -1.26 0.00 0.00 59.98 58.60 1nyq h ARG 498 Cb 0.82 -0.06 0.00 0.00 -1.65 0.00 0.00 29.97 29.08 1nyq h ARG 498 CO -0.06 0.19 0.00 1.19 0.56 0.00 0.00 179.97 181.85 1nyq n PHE 499 N -4.48 1.05 -3.96 3.04 3.01 0.19 -4.83 117.46 111.48 1nyq n PHE 499 Ca 0.22 -0.53 -0.25 0.00 1.01 0.00 0.00 57.45 57.90 1nyq n PHE 499 Cb 0.85 -0.06 -0.02 0.00 -0.01 0.00 0.00 39.48 40.24 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 1.43 -0.33 -4.85 4.37 2.03 0.66 -4.92 116.55 114.94 1nyq n ASP 500 Ca 0.24 -1.01 -0.27 0.00 0.52 0.00 0.00 54.79 54.27 1nyq n ASP 500 Cb 0.67 -3.04 0.09 0.00 -0.72 0.00 0.00 41.12 38.11 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 -6.97 2.70 -0.23 -2.67 1.43 0.62 -5.03 118.68 108.54 1nyq s LEU 501 Ca 0.01 0.53 -0.31 0.00 -1.03 0.00 0.00 54.13 53.33 1nyq s LEU 501 Cb -0.01 -3.07 0.16 0.00 0.03 0.00 0.00 46.19 43.31 1nyq s LEU 501 CO 0.89 -1.80 1.24 0.28 0.23 0.00 0.00 176.35 177.19 1nyq s THR 502 N -3.41 0.00 0.50 5.49 -1.32 -1.26 -4.54 115.64 111.11 1nyq s THR 502 Ca 0.62 0.00 0.02 0.00 -1.21 0.00 0.00 61.69 61.12 1nyq s THR 502 Cb -0.10 -1.00 -0.01 0.00 -1.51 0.00 0.00 72.50 69.87 1nyq s THR 502 CO 0.47 0.00 0.06 -0.72 -2.21 0.00 0.00 174.62 172.21 1nyq s TYR 503 N -1.46 1.93 -0.10 9.09 -0.85 0.15 -4.70 117.35 121.40 1nyq s TYR 503 Ca 0.07 -0.90 0.03 0.00 -0.52 0.00 0.00 57.07 55.75 1nyq s TYR 503 Cb -0.01 -1.68 0.01 0.00 0.38 0.00 0.00 41.96 40.66 1nyq s TYR 503 CO -0.05 0.17 -0.19 0.42 -1.52 0.00 0.00 175.55 174.38 1nyq s ILE 504 N -2.84 1.69 1.22 -3.49 1.01 0.96 -2.34 121.20 117.42 1nyq s ILE 504 Ca 0.13 -0.79 -0.17 0.00 0.00 0.00 0.00 60.65 59.82 1nyq s ILE 504 Cb 0.02 -1.50 0.29 0.00 0.01 0.00 0.00 42.46 41.28 1nyq s ILE 504 CO 0.07 0.48 1.03 -0.83 0.00 0.00 0.00 174.94 175.69 1nyq s GLY 505 N 0.64 1.52 0.26 6.18 0.00 0.57 -0.67 107.32 115.82 1nyq s GLY 505 Ca -0.13 -0.58 -0.01 0.00 0.00 0.00 0.00 44.72 44.00 1nyq s GLY 505 CO 0.04 0.25 1.76 -1.61 0.00 0.00 0.00 173.10 173.53 1nyq h GLN 506 N -2.72 0.59 0.00 2.90 4.15 -2.00 -3.26 115.11 114.77 1nyq h GLN 506 Ca -0.52 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 58.87 1nyq h GLN 506 Cb 1.33 -0.13 0.00 0.00 0.21 0.00 0.00 27.48 28.88 1nyq h GLN 506 CO 0.42 0.39 -0.56 -0.25 -1.93 0.00 0.00 178.83 176.90 1nyq n ASP 507 N -4.88 1.42 0.00 -0.69 8.00 -1.26 -5.01 116.55 114.13 1nyq n ASP 507 Ca 0.17 0.40 0.00 0.00 0.71 0.00 0.00 54.79 56.08 1nyq n ASP 507 Cb 0.44 -0.73 0.00 0.00 -0.02 0.00 0.00 41.12 40.81 1nyq n ASP 507 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1nyq n GLY 508 N 1.56 0.07 3.58 0.44 0.00 -1.23 -5.15 105.19 104.46 1nyq n GLY 508 Ca -0.08 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.55 1nyq n GLY 508 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1nyq n GLU 509 N 0.00 0.98 -3.33 1.61 -0.00 -1.26 -4.41 120.64 114.23 1nyq n GLU 509 Ca 0.00 0.37 -0.38 0.00 -0.00 0.00 0.00 57.16 57.14 1nyq n GLU 509 Cb 0.00 -2.00 -0.06 0.00 -0.00 0.00 0.00 31.44 29.38 1nyq n GLU 509 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.13 176.12 1nyq s HIS 510 N -1.46 3.74 -0.05 -1.84 3.76 -1.26 -0.31 115.29 117.87 1nyq s HIS 510 Ca 0.69 1.15 0.03 0.00 -0.15 0.00 0.00 55.06 56.79 1nyq s HIS 510 Cb -0.48 -2.47 0.00 0.00 1.11 0.00 0.00 32.58 30.75 1nyq s HIS 510 CO 0.53 0.53 -0.14 -1.01 -0.85 0.00 0.00 174.74 173.79 1nyq s HIS 511 N -0.79 1.48 -0.10 1.40 3.76 -0.99 -4.94 115.29 115.11 1nyq s HIS 511 Ca 0.28 -0.45 -0.30 0.00 -0.15 0.00 0.00 55.06 54.44 1nyq s HIS 511 Cb -0.18 -1.03 -0.02 0.00 1.11 0.00 0.00 32.58 32.46 1nyq s HIS 511 CO 0.16 -0.18 1.07 0.50 -0.85 0.00 0.00 174.74 175.44 1nyq s ARG 512 N 0.23 4.39 0.77 1.40 3.52 -1.26 0.30 118.95 128.30 1nyq s ARG 512 Ca -0.07 1.48 -0.09 0.00 -0.13 0.00 0.00 55.73 56.93 1nyq s ARG 512 Cb -0.12 -3.56 0.10 0.00 -1.56 0.00 0.00 34.95 29.81 1nyq s ARG 512 CO 0.02 -0.38 1.10 -1.25 -0.81 0.00 0.00 175.30 173.99 1nyq s PRO 513 N 2.16 1.82 0.07 5.12 0.04 -1.26 -4.74 135.00 138.20 1nyq s PRO 513 Ca 0.50 -0.29 0.10 0.00 0.04 0.00 0.00 61.00 61.35 1nyq s PRO 513 Cb -0.20 -2.08 -0.03 0.00 0.04 0.00 0.00 34.50 32.23 1nyq s PRO 513 CO 0.18 -1.55 -0.26 0.08 0.04 0.00 0.00 177.00 175.50 1nyq s VAL 514 N -3.42 2.21 -0.13 -0.36 1.01 0.24 -4.77 120.40 115.17 1nyq s VAL 514 Ca 0.64 -1.48 -0.01 0.00 0.00 0.00 0.00 61.98 61.13 1nyq s VAL 514 Cb -0.09 -1.89 -0.02 0.00 0.00 0.00 0.00 36.38 34.38 1nyq s VAL 514 CO 0.47 0.29 -0.10 -0.69 0.00 0.00 0.00 175.10 175.07 1nyq s VAL 515 N -0.88 3.32 -0.18 2.92 1.01 -0.36 0.59 120.40 126.82 1nyq s VAL 515 Ca 0.13 -0.57 -0.06 0.00 0.00 0.00 0.00 61.98 61.48 1nyq s VAL 515 Cb -0.10 -2.41 -0.03 0.00 0.00 0.00 0.00 36.38 33.84 1nyq s VAL 515 CO 0.03 0.52 0.02 -0.63 0.00 0.00 0.00 175.10 175.04 1nyq s ILE 516 N 0.26 4.35 -0.15 2.22 1.01 -0.11 -0.24 121.20 128.54 1nyq s ILE 516 Ca -0.07 -0.19 -0.05 0.00 0.00 0.00 0.00 60.65 60.34 1nyq s ILE 516 Cb -0.15 -2.94 -0.03 0.00 0.01 0.00 0.00 42.46 39.34 1nyq s ILE 516 CO 0.05 0.46 0.01 -1.00 0.00 0.00 0.00 174.94 174.46 1nyq s HIS 517 N 0.48 3.14 -0.01 3.97 3.76 -0.62 -0.88 115.29 125.13 1nyq s HIS 517 Ca 0.00 -0.05 -0.04 0.00 -0.15 0.00 0.00 55.06 54.83 1nyq s HIS 517 Cb -0.13 -1.96 0.00 0.00 1.11 0.00 0.00 32.58 31.60 1nyq s HIS 517 CO 0.02 0.16 0.08 -0.98 -0.85 0.00 0.00 174.74 173.17 1nyq s ARG 518 N 0.04 0.26 -0.43 1.40 1.04 -0.94 0.83 118.95 121.15 1nyq s ARG 518 Ca 0.03 -0.18 0.02 0.00 -1.04 0.00 0.00 55.73 54.56 1nyq s ARG 518 Cb -0.13 0.11 0.13 0.00 -2.04 0.00 0.00 34.95 33.02 1nyq s ARG 518 CO 0.02 -0.05 0.21 0.20 -0.04 0.00 0.00 175.30 175.64 1nyq s GLY 519 N -0.69 1.77 0.06 3.88 0.00 0.78 -2.85 107.32 110.28 1nyq s GLY 519 Ca -0.08 -2.62 -0.34 0.00 0.00 0.00 0.00 44.72 41.69 1nyq s GLY 519 CO 0.00 1.40 1.52 -2.08 0.00 0.00 0.00 173.10 173.94 1nyq h VAL 520 N 5.53 0.19 -0.77 1.40 2.07 -1.83 -2.87 116.25 119.98 1nyq h VAL 520 Ca -0.04 -0.07 -0.45 0.00 0.82 0.00 0.00 66.70 66.96 1nyq h VAL 520 Cb 0.94 0.21 -0.25 0.00 -1.52 0.00 0.00 31.29 30.66 1nyq h VAL 520 CO 0.52 0.01 0.35 0.55 0.02 0.00 0.00 177.57 179.02 1nyq n VAL 521 N -5.52 3.03 -2.33 2.57 3.14 -1.26 -4.48 118.33 113.47 1nyq n VAL 521 Ca -0.14 -2.57 0.00 0.00 -2.96 0.00 0.00 64.34 58.66 1nyq n VAL 521 Cb 0.43 -0.61 0.00 0.00 -1.06 0.00 0.00 33.84 32.60 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 -1.06 -0.70 -4.78 6.55 2.88 -1.22 -4.58 113.62 110.70 1nyq n SER 522 Ca 0.51 0.00 -0.39 0.00 -1.33 0.00 0.00 58.87 57.66 1nyq n SER 522 Cb 1.22 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 64.62 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 4.34 0.17 2.46 -4.23 -1.26 -1.02 115.64 116.10 1nyq s THR 523 Ca 0.00 1.71 -0.22 0.00 -1.18 0.00 0.00 61.69 62.01 1nyq s THR 523 Cb 0.00 -4.12 0.08 0.00 1.34 0.00 0.00 72.50 69.79 1nyq s THR 523 CO 0.00 0.46 1.60 0.24 -0.54 0.00 0.00 174.62 176.38 1nyq h MET 524 N 4.11 -0.21 0.17 3.99 2.86 -0.43 1.29 114.93 126.70 1nyq h MET 524 Ca -0.47 0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.19 1nyq h MET 524 Cb 1.20 0.05 -0.03 0.00 0.06 0.00 0.00 31.60 32.88 1nyq h MET 524 CO 0.66 -0.14 -0.40 0.93 1.06 0.00 0.00 176.91 179.01 1nyq h GLU 525 N -0.22 -0.61 -0.89 1.72 3.07 -1.81 0.29 114.58 116.12 1nyq h GLU 525 Ca 0.18 0.04 0.01 0.00 -0.50 0.00 0.00 59.36 59.10 1nyq h GLU 525 Cb 0.52 0.14 -0.04 0.00 -0.84 0.00 0.00 28.75 28.52 1nyq h GLU 525 CO -0.54 -0.41 0.59 -0.09 -1.40 0.00 0.00 179.01 177.17 1nyq h ARG 526 N -0.63 1.17 -0.87 2.33 2.43 -0.63 -2.15 114.38 116.03 1nyq h ARG 526 Ca -0.02 -0.07 -0.02 0.00 -0.81 0.00 0.00 59.98 59.07 1nyq h ARG 526 Cb 0.61 -0.26 -0.04 0.00 -0.42 0.00 0.00 29.97 29.85 1nyq h ARG 526 CO -0.18 0.77 0.48 0.35 -1.51 0.00 0.00 179.97 179.89 1nyq h PHE 527 N 1.20 1.19 -0.10 2.20 3.57 0.23 -2.19 116.94 123.04 1nyq h PHE 527 Ca 0.33 -0.03 -0.18 0.00 3.53 0.00 0.00 57.97 61.62 1nyq h PHE 527 Cb -0.13 -0.38 -0.00 0.00 2.79 0.00 0.00 35.95 38.23 1nyq h PHE 527 CO -0.01 0.82 -0.71 0.28 -2.23 0.00 0.00 178.31 176.47 1nyq h VAL 528 N 1.22 1.36 -0.38 1.41 2.07 -0.19 -0.39 116.25 121.34 1nyq h VAL 528 Ca 0.31 -2.07 0.00 0.00 0.82 0.00 0.00 66.70 65.76 1nyq h VAL 528 Cb 0.02 2.05 -0.02 0.00 -1.52 0.00 0.00 31.29 31.82 1nyq h VAL 528 CO -0.05 0.63 0.25 0.00 0.02 0.00 0.00 177.57 178.42 1nyq h ALA 529 N 0.91 0.49 0.07 1.67 0.00 -1.19 1.10 119.26 122.30 1nyq h ALA 529 Ca -0.03 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 1nyq h ALA 529 Cb 1.28 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.92 1nyq h ALA 529 CO 0.12 -0.06 -0.03 0.35 0.00 0.00 0.00 179.25 179.64 1nyq h PHE 530 N 0.52 -0.08 -1.00 0.00 3.57 -1.35 -1.74 116.94 116.85 1nyq h PHE 530 Ca 0.14 -0.00 0.14 0.00 3.53 0.00 0.00 57.97 61.78 1nyq h PHE 530 Cb -0.06 0.03 -0.09 0.00 2.79 0.00 0.00 35.95 38.62 1nyq h PHE 530 CO -0.05 0.19 0.62 1.25 -2.23 0.00 0.00 178.31 178.09 1nyq h LEU 531 N -0.36 0.87 0.30 0.59 5.85 -0.41 0.40 115.31 122.55 1nyq h LEU 531 Ca -0.01 0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.76 1nyq h LEU 531 Cb 0.31 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.24 1nyq h LEU 531 CO 0.02 0.42 -0.14 0.74 -0.34 0.00 0.00 178.44 179.13 1nyq h THR 532 N 0.91 0.73 -0.42 1.05 2.02 0.15 -1.94 112.91 115.42 1nyq h THR 532 Ca 0.52 -0.26 0.04 0.00 0.77 0.00 0.00 66.41 67.48 1nyq h THR 532 Cb 0.62 0.88 -0.04 0.00 -1.74 0.00 0.00 68.15 67.87 1nyq h THR 532 CO -0.30 0.06 0.19 -0.33 0.37 0.00 0.00 175.52 175.51 1nyq h GLU 533 N -0.54 0.38 -0.02 6.66 5.08 -0.32 0.33 114.58 126.15 1nyq h GLU 533 Ca -0.04 -0.02 0.01 0.00 -1.00 0.00 0.00 59.36 58.30 1nyq h GLU 533 Cb 0.40 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.56 1nyq h GLU 533 CO 0.07 0.25 0.07 1.49 -1.00 0.00 0.00 179.01 179.89 1nyq h GLU 534 N 0.39 0.00 -0.04 2.33 4.57 -0.21 -2.80 114.58 118.83 1nyq h GLU 534 Ca 0.18 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.36 1nyq h GLU 534 Cb 0.11 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.70 1nyq h GLU 534 CO -0.14 0.00 0.00 -2.37 -1.18 0.00 0.00 179.01 175.32 1nyq n THR 535 N -3.34 0.67 -1.13 0.32 5.66 0.37 -4.99 114.28 111.85 1nyq n THR 535 Ca -0.02 -0.83 -0.02 0.00 -3.05 0.00 0.00 64.05 60.12 1nyq n THR 535 Cb 0.14 0.68 -0.01 0.00 -1.55 0.00 0.00 70.33 69.59 1nyq n THR 535 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 1nyq n LYS 536 N -0.20 -1.13 0.00 1.09 5.02 0.89 0.34 118.16 124.17 1nyq n LYS 536 Ca 0.02 0.12 0.00 0.00 -2.02 0.00 0.00 58.31 56.43 1nyq n LYS 536 Cb 0.20 -4.19 0.00 0.00 -0.02 0.00 0.00 35.03 31.02 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 -0.06 2.47 2.80 0.72 0.00 -1.20 -4.98 105.19 104.93 1nyq n GLY 537 Ca -0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.50 5.00 -1.77 4.61 0.00 0.15 -4.93 120.51 123.07 1nyq n ALA 538 Ca 0.00 -3.60 -0.40 0.00 0.00 0.00 0.00 53.44 49.44 1nyq n ALA 538 Cb 0.00 -3.53 0.01 0.00 0.00 0.00 0.00 19.45 15.93 1nyq n ALA 538 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1nyq s PHE 539 N 3.67 2.57 0.53 0.00 0.08 -1.26 -4.94 117.98 118.64 1nyq s PHE 539 Ca 0.52 1.27 -0.22 0.00 0.12 0.00 0.00 56.93 58.61 1nyq s PHE 539 Cb 0.14 -3.89 -0.05 0.00 -0.57 0.00 0.00 43.02 38.65 1nyq s PHE 539 CO -0.02 -2.76 1.37 -1.25 -0.10 0.00 0.00 175.22 172.45 1nyq s PRO 540 N -2.30 3.22 0.24 0.24 0.04 -1.26 -4.50 135.00 130.67 1nyq s PRO 540 Ca 0.58 2.26 -0.15 0.00 0.04 0.00 0.00 61.00 63.73 1nyq s PRO 540 Cb -0.43 -2.31 0.30 0.00 0.04 0.00 0.00 34.50 32.09 1nyq s PRO 540 CO 0.57 -1.14 1.56 1.15 0.04 0.00 0.00 177.00 179.17 1nyq h THR 541 N 1.57 0.01 -0.69 1.26 2.02 -1.92 0.24 112.91 115.39 1nyq h THR 541 Ca -0.51 0.00 0.14 0.00 0.77 0.00 0.00 66.41 66.81 1nyq h THR 541 Cb 1.30 0.01 -0.10 0.00 -1.74 0.00 0.00 68.15 67.61 1nyq h THR 541 CO 0.58 0.00 0.16 4.11 0.37 0.00 0.00 175.52 180.74 1nyq h TRP 542 N -0.00 0.25 0.00 3.16 5.08 -1.86 -1.75 115.95 120.83 1nyq h TRP 542 Ca 0.38 0.04 -0.04 0.00 1.08 0.00 0.00 58.89 60.35 1nyq h TRP 542 Cb 0.63 -0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.78 1nyq h TRP 542 CO -0.84 -0.06 -0.20 -0.07 -1.28 0.00 0.00 178.44 175.99 1nyq h LEU 543 N 0.27 0.00 -9.32 0.11 3.38 -1.36 -3.47 115.31 104.93 1nyq h LEU 543 Ca 0.38 0.00 -0.64 0.00 0.09 0.00 0.00 57.88 57.71 1nyq h LEU 543 Cb 0.61 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.39 1nyq h LEU 543 CO -0.47 0.20 0.88 0.00 0.09 0.00 0.00 178.44 179.14 1nyq n ALA 544 N -2.15 0.54 -0.29 1.53 0.00 -0.32 -4.34 120.51 115.47 1nyq n ALA 544 Ca 0.03 0.38 0.12 0.00 0.00 0.00 0.00 53.44 53.97 1nyq n ALA 544 Cb 0.59 -2.34 0.28 0.00 0.00 0.00 0.00 19.45 17.98 1nyq n ALA 544 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1nyq h PRO 545 N 7.19 0.34 -3.92 0.00 0.11 -1.88 -3.37 132.00 130.48 1nyq h PRO 545 Ca -0.47 -0.02 -0.41 0.00 0.11 0.00 0.00 66.00 65.21 1nyq h PRO 545 Cb 1.28 -0.08 -0.35 0.00 0.11 0.00 0.00 31.00 31.97 1nyq h PRO 545 CO 0.91 0.22 -0.77 0.21 -0.21 0.00 0.00 178.00 178.36 1nyq s LYS 546 N -5.92 0.73 -0.09 1.05 2.20 -1.26 -4.95 119.74 111.49 1nyq s LYS 546 Ca -0.12 -0.04 0.06 0.00 -0.36 0.00 0.00 55.97 55.51 1nyq s LYS 546 Cb 0.25 -0.84 -0.24 0.00 -1.51 0.00 0.00 37.83 35.49 1nyq s LYS 546 CO 0.77 -0.14 0.49 1.04 -0.36 0.00 0.00 175.35 177.15 1nyq n GLN 547 N 4.31 0.68 -3.82 4.03 6.02 0.35 -4.28 117.38 124.66 1nyq n GLN 547 Ca -0.21 0.26 -0.13 0.00 -0.01 0.00 0.00 57.00 56.91 1nyq n GLN 547 Cb 0.51 -1.74 -0.15 0.00 1.02 0.00 0.00 30.24 29.88 1nyq n GLN 547 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1nyq s VAL 548 N -2.57 -0.03 -0.26 5.09 1.01 -0.27 -1.82 120.40 121.55 1nyq s VAL 548 Ca -0.12 0.11 -0.01 0.00 0.00 0.00 0.00 61.98 61.96 1nyq s VAL 548 Cb 0.07 -0.05 0.04 0.00 0.00 0.00 0.00 36.38 36.44 1nyq s VAL 548 CO 0.80 0.04 -0.06 -1.58 0.00 0.00 0.00 175.10 174.30 1nyq s GLN 549 N 0.53 2.60 -0.24 2.72 2.00 0.22 -1.95 119.66 125.53 1nyq s GLN 549 Ca -0.04 -1.13 -0.15 0.00 -2.00 0.00 0.00 55.36 52.03 1nyq s GLN 549 Cb -0.06 -3.00 -0.04 0.00 0.80 0.00 0.00 33.01 30.71 1nyq s GLN 549 CO -0.02 -0.49 0.38 0.42 -0.50 0.00 0.00 175.29 175.08 1nyq s ILE 550 N 1.25 5.19 -0.25 -2.34 1.01 -0.28 0.31 121.20 126.09 1nyq s ILE 550 Ca -0.03 0.62 0.02 0.00 0.00 0.00 0.00 60.65 61.26 1nyq s ILE 550 Cb -0.18 -3.71 0.05 0.00 0.01 0.00 0.00 42.46 38.63 1nyq s ILE 550 CO -0.04 0.20 -0.10 -0.63 0.00 0.00 0.00 174.94 174.37 1nyq s ILE 551 N 1.74 2.35 0.73 2.92 1.01 0.56 -0.53 121.20 129.97 1nyq s ILE 551 Ca 0.16 -1.46 -0.11 0.00 0.00 0.00 0.00 60.65 59.24 1nyq s ILE 551 Cb -0.15 -2.31 0.03 0.00 0.01 0.00 0.00 42.46 40.03 1nyq s ILE 551 CO 0.09 0.05 1.10 -2.16 0.00 0.00 0.00 174.94 174.02 1nyq s PRO 552 N 1.17 2.67 -0.09 2.79 0.04 -1.26 -1.87 135.00 138.44 1nyq s PRO 552 Ca -0.06 0.46 -0.04 0.00 0.04 0.00 0.00 61.00 61.40 1nyq s PRO 552 Cb -0.19 -2.00 -0.03 0.00 0.04 0.00 0.00 34.50 32.33 1nyq s PRO 552 CO -0.05 -1.17 0.13 0.28 0.04 0.00 0.00 177.00 176.23 1nyq h VAL 553 N -0.75 0.11 -3.62 -0.36 2.07 -1.62 -3.43 116.25 108.65 1nyq h VAL 553 Ca -0.45 -1.03 -0.68 0.00 0.82 0.00 0.00 66.70 65.36 1nyq h VAL 553 Cb 1.26 0.21 -0.33 0.00 -1.52 0.00 0.00 31.29 30.91 1nyq h VAL 553 CO 0.63 0.04 -0.74 0.21 0.02 0.00 0.00 177.57 177.73 1nyq s ASN 554 N -5.51 4.46 0.00 0.57 3.04 -1.26 -4.99 114.94 111.25 1nyq s ASN 554 Ca -0.02 -1.05 0.03 0.00 0.04 0.00 0.00 52.86 51.85 1nyq s ASN 554 Cb -0.00 -1.66 0.17 0.00 -1.54 0.00 0.00 41.25 38.22 1nyq s ASN 554 CO 0.07 -0.17 0.51 0.55 -3.04 0.00 0.00 177.10 175.02 1nyq n VAL 555 N 4.62 0.00 0.00 -5.21 3.14 -1.26 -0.17 118.33 119.45 1nyq n VAL 555 Ca -0.15 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.23 1nyq n VAL 555 Cb 0.45 -0.71 0.00 0.00 -1.06 0.00 0.00 33.84 32.53 1nyq n VAL 555 CO 0.00 0.00 0.00 0.47 -6.46 0.00 0.00 176.83 170.84 1nyq n ASP 556 N -0.79 1.92 0.21 6.55 8.00 -1.26 -4.33 116.55 126.86 1nyq n ASP 556 Ca 0.02 0.00 -0.09 0.00 0.71 0.00 0.00 54.79 55.43 1nyq n ASP 556 Cb 0.01 0.00 -0.04 0.00 -0.02 0.00 0.00 41.12 41.07 1nyq n ASP 556 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 1nyq h LEU 557 N 0.00 -0.48 -0.00 0.64 5.85 -1.91 -3.35 115.31 116.05 1nyq h LEU 557 Ca 0.00 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.74 1nyq h LEU 557 Cb 0.92 0.12 0.00 0.00 0.37 0.00 0.00 40.66 42.07 1nyq h LEU 557 CO 0.00 -0.25 0.00 1.41 -0.34 0.00 0.00 178.44 179.26 1nyq n HIS 558 N -4.06 0.11 0.00 1.25 8.25 0.76 -4.59 115.22 116.94 1nyq n HIS 558 Ca -0.07 0.03 0.00 0.00 -0.26 0.00 0.00 57.72 57.42 1nyq n HIS 558 Cb 0.22 -0.55 0.00 0.00 1.12 0.00 0.00 29.99 30.78 1nyq n HIS 558 CO 0.00 0.00 0.00 0.98 0.64 0.00 0.00 176.34 177.96 1nyq n TYR 559 N -1.59 0.00 -0.32 4.41 9.36 -1.22 -2.58 117.16 125.22 1nyq n TYR 559 Ca 0.07 0.00 0.27 0.00 3.32 0.00 0.00 57.90 61.56 1nyq n TYR 559 Cb 0.34 -0.07 0.46 0.00 -0.63 0.00 0.00 39.34 39.44 1nyq n TYR 559 CO 0.00 0.00 0.00 -0.25 0.22 0.00 0.00 176.86 176.83 1nyq n ASP 560 N -0.91 0.14 -0.08 2.98 9.92 -1.26 0.32 116.55 127.66 1nyq n ASP 560 Ca 0.00 0.93 -0.11 0.00 -0.53 0.00 0.00 54.79 55.08 1nyq n ASP 560 Cb 0.00 -0.46 -0.05 0.00 -0.64 0.00 0.00 41.12 39.98 1nyq n ASP 560 CO 0.00 0.00 0.00 0.22 0.13 0.00 0.00 177.20 177.55 1nyq h TYR 561 N 0.00 0.44 -0.03 1.24 3.20 -1.83 -1.60 116.97 118.38 1nyq h TYR 561 Ca 0.59 -0.07 0.01 0.00 3.14 0.00 0.00 58.73 62.40 1nyq h TYR 561 Cb 1.91 -0.11 -0.01 0.00 1.54 0.00 0.00 36.73 40.06 1nyq h TYR 561 CO -0.00 0.57 -0.02 0.00 -1.64 0.00 0.00 178.16 177.07 1nyq h ALA 562 N 0.81 0.01 -0.86 1.82 0.00 0.53 0.69 119.26 122.25 1nyq h ALA 562 Ca 0.07 0.01 0.07 0.00 0.00 0.00 0.00 54.91 55.06 1nyq h ALA 562 Cb 0.40 0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.17 1nyq h ALA 562 CO 0.01 -0.51 0.52 -0.09 0.00 0.00 0.00 179.25 179.18 1nyq h ARG 563 N -0.03 0.91 0.55 0.00 1.12 -1.12 0.23 114.38 116.03 1nyq h ARG 563 Ca 0.02 -0.05 -0.02 0.00 -1.11 0.00 0.00 59.98 58.82 1nyq h ARG 563 Cb 0.06 -0.20 -0.02 0.00 -0.01 0.00 0.00 29.97 29.79 1nyq h ARG 563 CO -0.05 0.60 -0.47 0.37 -3.11 0.00 0.00 179.97 177.31 1nyq h GLN 564 N 0.93 -0.97 -0.47 0.20 4.15 -0.50 0.35 115.11 118.80 1nyq h GLN 564 Ca 0.38 0.07 0.09 0.00 0.77 0.00 0.00 58.65 59.96 1nyq h GLN 564 Cb 0.22 0.22 -0.10 0.00 0.21 0.00 0.00 27.48 28.03 1nyq h GLN 564 CO -0.19 -0.65 -0.26 1.25 -1.93 0.00 0.00 178.83 177.05 1nyq h LEU 565 N -1.01 -0.90 -0.11 -2.39 5.85 -0.28 0.10 115.31 116.58 1nyq h LEU 565 Ca -0.07 0.19 0.02 0.00 0.84 0.00 0.00 57.88 58.86 1nyq h LEU 565 Cb 0.86 0.46 -0.03 0.00 0.37 0.00 0.00 40.66 42.32 1nyq h LEU 565 CO -0.02 -0.28 -0.23 -0.61 -0.34 0.00 0.00 178.44 176.96 1nyq h GLN 566 N -0.16 -0.20 -1.09 1.25 4.15 0.00 0.50 115.11 119.56 1nyq h GLN 566 Ca 0.21 0.01 0.31 0.00 0.77 0.00 0.00 58.65 59.96 1nyq h GLN 566 Cb 0.50 0.05 -0.12 0.00 0.21 0.00 0.00 27.48 28.12 1nyq h GLN 566 CO -0.57 -0.13 0.68 -0.44 -1.93 0.00 0.00 178.83 176.43 1nyq h ASP 567 N -0.21 0.45 0.82 -0.69 5.19 0.72 0.38 116.42 123.08 1nyq h ASP 567 Ca 0.02 0.13 -0.04 0.00 -0.62 0.00 0.00 57.03 56.52 1nyq h ASP 567 Cb 0.27 0.07 0.01 0.00 0.18 0.00 0.00 39.33 39.85 1nyq h ASP 567 CO -0.21 -0.02 -0.39 -0.08 -3.12 0.00 0.00 179.24 175.41 1nyq h GLU 568 N 0.34 -1.06 -0.32 3.56 4.81 0.12 -2.32 114.58 119.71 1nyq h GLU 568 Ca 0.68 0.07 0.07 0.00 -0.13 0.00 0.00 59.36 60.06 1nyq h GLU 568 Cb 1.74 0.24 -0.08 0.00 0.63 0.00 0.00 28.75 31.28 1nyq h GLU 568 CO -0.42 -0.70 -0.25 -0.07 -0.73 0.00 0.00 179.01 176.84 1nyq h LEU 569 N -1.19 -0.81 -1.89 1.64 3.38 0.10 -0.70 115.31 115.85 1nyq h LEU 569 Ca -0.11 0.16 0.11 0.00 0.09 0.00 0.00 57.88 58.12 1nyq h LEU 569 Cb 0.84 0.39 -0.02 0.00 0.09 0.00 0.00 40.66 41.97 1nyq h LEU 569 CO 0.18 -0.27 0.49 0.50 0.09 0.00 0.00 178.44 179.43 1nyq h LYS 570 N -0.21 0.00 -0.01 1.13 3.64 -0.32 0.63 116.57 121.43 1nyq h LYS 570 Ca 0.16 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.54 1nyq h LYS 570 Cb 0.47 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.29 1nyq h LYS 570 CO -0.45 0.00 -0.02 -1.13 -2.27 0.00 0.00 179.45 175.58 1nyq n SER 571 N -3.53 1.00 -0.75 4.20 3.41 -0.27 -3.32 113.62 114.36 1nyq n SER 571 Ca 0.07 -1.27 0.06 0.00 -0.26 0.00 0.00 58.87 57.46 1nyq n SER 571 Cb 0.65 0.00 0.18 0.00 -0.26 0.00 0.00 64.21 64.78 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 -0.26 1.32 -1.11 4.33 6.02 0.22 -4.94 117.38 122.95 1nyq n GLN 572 Ca 0.20 -3.08 -0.04 0.00 -0.01 0.00 0.00 57.00 54.07 1nyq n GLN 572 Cb 0.28 -1.34 -0.02 0.00 1.02 0.00 0.00 30.24 30.18 1nyq n GLN 572 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1nyq n GLY 573 N -0.85 0.66 3.77 1.08 0.00 -1.20 -4.99 105.19 103.65 1nyq n GLY 573 Ca 0.17 -0.53 -0.39 0.00 0.00 0.00 0.00 46.02 45.26 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 -2.04 4.59 -0.59 1.61 1.01 -0.96 -5.00 120.40 119.01 1nyq s VAL 574 Ca 0.00 1.57 -0.18 0.00 0.00 0.00 0.00 61.98 63.37 1nyq s VAL 574 Cb 0.00 -4.08 0.12 0.00 0.00 0.00 0.00 36.38 32.42 1nyq s VAL 574 CO 0.00 0.47 0.66 -0.13 0.00 0.00 0.00 175.10 176.10 1nyq s ARG 575 N -0.70 3.06 0.03 2.72 0.52 -1.26 -4.05 118.95 119.28 1nyq s ARG 575 Ca 0.35 -1.48 -0.04 0.00 -0.52 0.00 0.00 55.73 54.04 1nyq s ARG 575 Cb -0.21 -4.30 -0.01 0.00 0.52 0.00 0.00 34.95 30.95 1nyq s ARG 575 CO 0.23 -1.48 0.06 0.54 0.02 0.00 0.00 175.30 174.67 1nyq s VAL 576 N 2.30 0.13 0.06 3.52 0.11 -1.26 0.13 120.40 125.39 1nyq s VAL 576 Ca 0.10 -1.09 -0.14 0.00 -2.93 0.00 0.00 61.98 57.92 1nyq s VAL 576 Cb -0.25 -0.78 0.02 0.00 -1.53 0.00 0.00 36.38 33.84 1nyq s VAL 576 CO 0.04 -0.60 0.30 -0.94 -3.33 0.00 0.00 175.10 170.58 1nyq s SER 577 N -2.00 -0.11 -0.30 3.54 1.04 -0.83 -4.96 113.70 110.09 1nyq s SER 577 Ca -0.07 -0.24 -0.15 0.00 0.48 0.00 0.00 55.95 55.97 1nyq s SER 577 Cb -0.03 0.37 -0.03 0.00 0.10 0.00 0.00 66.02 66.43 1nyq s SER 577 CO -0.04 -0.65 0.37 -0.63 0.98 0.00 0.00 173.24 173.27 1nyq s ILE 578 N -2.79 5.17 -1.09 -1.02 1.09 -1.26 -1.13 121.20 120.16 1nyq s ILE 578 Ca -0.03 0.39 -0.20 0.00 -1.10 0.00 0.00 60.65 59.71 1nyq s ILE 578 Cb -0.00 -3.74 0.09 0.00 -1.06 0.00 0.00 42.46 37.74 1nyq s ILE 578 CO -0.05 0.07 1.46 -0.62 -0.10 0.00 0.00 174.94 175.69 1nyq s ASP 579 N 1.68 6.68 -0.56 3.58 -1.08 0.30 -4.80 116.67 122.48 1nyq s ASP 579 Ca 0.14 -2.00 0.01 0.00 -0.52 0.00 0.00 52.55 50.18 1nyq s ASP 579 Cb -0.16 -2.52 0.51 0.00 -1.46 0.00 0.00 42.92 39.30 1nyq s ASP 579 CO 0.11 -1.24 1.91 -0.90 0.52 0.00 0.00 175.17 175.56 1nyq n ASP 580 N 7.91 6.13 -4.86 -0.34 5.75 -1.26 -4.45 116.55 125.43 1nyq n ASP 580 Ca 0.36 -3.74 -0.31 0.00 -0.01 0.00 0.00 54.79 51.08 1nyq n ASP 580 Cb 0.48 -0.87 -0.03 0.00 -1.03 0.00 0.00 41.12 39.67 1nyq n ASP 580 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 1nyq s ARG 581 N -3.64 3.85 -1.50 0.11 0.52 -1.26 -4.95 118.95 112.08 1nyq s ARG 581 Ca 0.61 0.73 -0.13 0.00 -0.52 0.00 0.00 55.73 56.42 1nyq s ARG 581 Cb 0.49 -2.24 -0.02 0.00 0.52 0.00 0.00 34.95 33.70 1nyq s ARG 581 CO 0.03 -0.19 2.50 -1.71 0.02 0.00 0.00 175.30 175.96 1nyq n ASN 582 N -1.53 5.74 -3.96 0.23 4.05 -1.26 -4.86 115.26 113.67 1nyq n ASN 582 Ca 0.05 -2.72 -0.09 0.00 0.45 0.00 0.00 54.58 52.26 1nyq n ASN 582 Cb 0.54 -1.60 -0.08 0.00 1.23 0.00 0.00 39.78 39.87 1nyq n ASN 582 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 177.26 172.60 1nyq s GLU 583 N 2.85 0.97 -0.18 1.20 2.02 -1.26 -5.13 118.70 119.17 1nyq s GLU 583 Ca 0.56 -1.14 -0.29 0.00 0.02 0.00 0.00 54.97 54.12 1nyq s GLU 583 Cb 0.15 0.33 -0.04 0.00 0.10 0.00 0.00 34.13 34.68 1nyq s GLU 583 CO -0.07 -0.32 1.84 0.15 0.02 0.00 0.00 175.26 176.88 1nyq s LYS 584 N -3.94 3.66 0.01 1.61 1.02 -1.26 -4.80 119.74 116.04 1nyq s LYS 584 Ca 0.13 1.90 -0.01 0.00 0.02 0.00 0.00 55.97 58.01 1nyq s LYS 584 Cb 0.05 -4.15 -0.00 0.00 -0.52 0.00 0.00 37.83 33.20 1nyq s LYS 584 CO -0.04 -1.48 0.08 -0.12 -0.92 0.00 0.00 175.35 172.87 1nyq n MET 585 N 7.97 -0.02 -0.31 1.68 0.00 -1.26 0.36 117.12 125.53 1nyq n MET 585 Ca 0.22 0.08 0.14 0.00 -0.00 0.00 0.00 57.70 58.13 1nyq n MET 585 Cb 0.45 -0.11 0.29 0.00 0.00 0.00 0.00 33.22 33.84 1nyq n MET 585 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 175.97 176.75 1nyq h GLY 586 N 0.00 1.27 1.00 -5.12 0.00 -1.97 0.56 103.07 98.82 1nyq h GLY 586 Ca 0.01 0.08 -0.03 0.00 0.00 0.00 0.00 47.33 47.39 1nyq h GLY 586 CO -0.04 -0.45 -0.28 -1.82 0.00 0.00 0.00 176.54 173.95 1nyq h TYR 587 N 0.08 -0.73 -0.82 5.60 3.20 0.58 -0.40 116.97 124.49 1nyq h TYR 587 Ca 0.57 -0.02 0.13 0.00 3.14 0.00 0.00 58.73 62.55 1nyq h TYR 587 Cb 1.17 0.24 -0.06 0.00 1.54 0.00 0.00 36.73 39.63 1nyq h TYR 587 CO -0.39 -0.45 0.53 0.87 -1.64 0.00 0.00 178.16 177.08 1nyq h LYS 588 N -0.78 0.60 0.00 1.82 1.57 0.07 0.39 116.57 120.23 1nyq h LYS 588 Ca -0.08 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.67 1nyq h LYS 588 Cb 0.60 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.78 1nyq h LYS 588 CO 0.12 0.39 -0.06 -0.89 -0.57 0.00 0.00 179.45 178.45 1nyq n ILE 589 N -4.52 0.29 -0.07 1.86 5.41 0.16 -3.12 119.36 119.38 1nyq n ILE 589 Ca 0.15 -0.15 -0.05 0.00 1.00 0.00 0.00 62.75 63.70 1nyq n ILE 589 Cb 0.44 -0.48 -0.13 0.00 -0.71 0.00 0.00 39.64 38.75 1nyq n ILE 589 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 176.55 175.41 1nyq n ARG 590 N -1.88 1.12 0.21 0.38 0.63 0.03 -3.64 116.66 113.50 1nyq n ARG 590 Ca 0.06 -0.04 0.04 0.00 -0.92 0.00 0.00 57.85 56.99 1nyq n ARG 590 Cb 0.39 -1.43 0.44 0.00 0.45 0.00 0.00 32.46 32.30 1nyq n ARG 590 CO 0.00 0.00 0.00 1.49 -2.51 0.00 0.00 177.63 176.61 1nyq h GLU 591 N 0.00 0.00 0.11 -0.14 4.81 -0.39 -1.76 114.58 117.20 1nyq h GLU 591 Ca -0.38 0.00 -0.28 0.00 -0.13 0.00 0.00 59.36 58.58 1nyq h GLU 591 Cb 1.83 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 31.20 1nyq h GLU 591 CO 0.02 0.27 -1.33 0.00 -0.73 0.00 0.00 179.01 177.24 1nyq h ALA 592 N 1.73 0.21 0.00 2.92 0.00 -1.70 -2.31 119.26 120.11 1nyq h ALA 592 Ca -0.00 -0.99 0.00 0.00 0.00 0.00 0.00 54.91 53.92 1nyq h ALA 592 Cb 0.48 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1nyq h ALA 592 CO 0.04 1.08 0.00 1.96 0.00 0.00 0.00 179.25 182.33 1nyq h GLN 593 N 0.06 0.00 0.05 0.00 1.08 -1.58 -1.93 115.11 112.79 1nyq h GLN 593 Ca -0.16 0.00 -0.16 0.00 -1.45 0.00 0.00 58.65 56.88 1nyq h GLN 593 Cb 1.97 0.00 0.02 0.00 -0.05 0.00 0.00 27.48 29.41 1nyq h GLN 593 CO 0.18 0.00 -0.65 1.98 -0.95 0.00 0.00 178.83 179.39 1nyq h MET 594 N 0.00 0.35 0.00 1.46 4.05 -1.30 -3.10 114.93 116.38 1nyq h MET 594 Ca 0.00 -0.44 0.00 0.00 -0.28 0.00 0.00 59.70 58.98 1nyq h MET 594 Cb 0.65 0.14 0.00 0.00 -0.80 0.00 0.00 31.60 31.59 1nyq h MET 594 CO 0.00 1.14 0.00 1.04 0.23 0.00 0.00 176.91 179.32 1nyq n GLN 595 N -4.21 0.79 -4.24 0.39 6.02 -0.87 -4.89 117.38 110.37 1nyq n GLN 595 Ca -0.11 0.00 -0.32 0.00 -0.01 0.00 0.00 57.00 56.55 1nyq n GLN 595 Cb 0.71 -1.06 -0.06 0.00 1.02 0.00 0.00 30.24 30.85 1nyq n GLN 595 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1nyq n LYS 596 N -0.56 -1.93 -2.44 -1.09 5.02 -0.76 -4.91 118.16 111.49 1nyq n LYS 596 Ca 0.02 0.23 -0.42 0.00 -2.02 0.00 0.00 58.31 56.12 1nyq n LYS 596 Cb 0.01 -4.28 -0.03 0.00 -0.02 0.00 0.00 35.03 30.71 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 -3.91 4.10 0.23 -0.18 1.01 -1.00 -4.75 121.20 116.71 1nyq s ILE 597 Ca 0.26 1.50 -0.10 0.00 0.00 0.00 0.00 60.65 62.31 1nyq s ILE 597 Cb -0.14 -3.96 0.26 0.00 0.01 0.00 0.00 42.46 38.63 1nyq s ILE 597 CO 0.96 0.09 1.63 -0.65 0.00 0.00 0.00 174.94 176.98 1nyq h PRO 598 N 6.94 0.06 -4.10 2.79 0.11 -1.75 -3.39 132.00 132.66 1nyq h PRO 598 Ca -0.40 -0.00 -0.47 0.00 0.11 0.00 0.00 66.00 65.24 1nyq h PRO 598 Cb 1.20 -0.01 -0.36 0.00 0.11 0.00 0.00 31.00 31.95 1nyq h PRO 598 CO 0.82 0.04 -0.79 0.71 -0.21 0.00 0.00 178.00 178.57 1nyq s TYR 599 N -6.17 1.06 -0.39 0.65 2.02 -0.75 -1.98 117.35 111.79 1nyq s TYR 599 Ca -0.14 -0.40 -0.04 0.00 -0.37 0.00 0.00 57.07 56.12 1nyq s TYR 599 Cb 0.21 -0.92 0.09 0.00 -0.40 0.00 0.00 41.96 40.94 1nyq s TYR 599 CO 0.75 -0.33 0.17 -1.14 -1.57 0.00 0.00 175.55 173.43 1nyq s GLN 600 N 1.32 2.22 -0.32 -0.62 0.74 -0.67 0.69 119.66 123.03 1nyq s GLN 600 Ca -0.04 -1.62 -0.15 0.00 0.05 0.00 0.00 55.36 53.60 1nyq s GLN 600 Cb -0.14 -3.54 -0.02 0.00 1.10 0.00 0.00 33.01 30.42 1nyq s GLN 600 CO -0.03 -0.95 0.36 0.42 -0.55 0.00 0.00 175.29 174.54 1nyq s ILE 601 N 1.23 5.18 -0.22 -2.34 -1.09 0.15 -1.80 121.20 122.30 1nyq s ILE 601 Ca 0.04 0.16 -0.11 0.00 -2.23 0.00 0.00 60.65 58.51 1nyq s ILE 601 Cb -0.22 -3.78 -0.05 0.00 -1.58 0.00 0.00 42.46 36.83 1nyq s ILE 601 CO -0.02 -0.02 0.19 -0.69 -1.23 0.00 0.00 174.94 173.16 1nyq s VAL 602 N 2.02 5.35 -0.26 2.92 1.01 0.77 -0.32 120.40 131.88 1nyq s VAL 602 Ca 0.12 0.26 0.03 0.00 0.00 0.00 0.00 61.98 62.39 1nyq s VAL 602 Cb -0.16 -3.53 0.06 0.00 0.00 0.00 0.00 36.38 32.75 1nyq s VAL 602 CO 0.11 0.36 -0.09 -0.69 0.00 0.00 0.00 175.10 174.79 1nyq s VAL 603 N 0.90 2.07 0.00 2.92 1.01 -0.78 -2.43 120.40 124.08 1nyq s VAL 603 Ca 0.09 -1.61 0.00 0.00 0.00 0.00 0.00 61.98 60.46 1nyq s VAL 603 Cb -0.13 -2.22 0.00 0.00 0.00 0.00 0.00 36.38 34.03 1nyq s VAL 603 CO 0.03 -0.08 0.00 0.61 0.00 0.00 0.00 175.10 175.67 1nyq n GLY 604 N 4.46 2.04 0.13 4.51 0.00 -1.26 -1.53 105.19 113.54 1nyq n GLY 604 Ca -0.13 -1.05 -0.23 0.00 0.00 0.00 0.00 46.02 44.61 1nyq n GLY 604 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1nyq n ASP 605 N 0.00 1.98 -0.34 1.61 9.92 -1.26 -2.46 116.55 126.00 1nyq n ASP 605 Ca 0.00 0.10 0.16 0.00 -0.53 0.00 0.00 54.79 54.53 1nyq n ASP 605 Cb 0.00 -0.63 0.37 0.00 -0.64 0.00 0.00 41.12 40.22 1nyq n ASP 605 CO 0.00 0.00 0.00 0.50 0.13 0.00 0.00 177.20 177.83 1nyq h LYS 606 N -0.45 0.59 0.09 -1.24 3.64 -1.99 -0.69 116.57 116.53 1nyq h LYS 606 Ca -0.61 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 58.73 1nyq h LYS 606 Cb 1.77 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 33.45 1nyq h LYS 606 CO -0.22 0.39 -0.04 0.93 -2.27 0.00 0.00 179.45 178.24 1nyq h GLU 607 N 0.61 -0.12 -1.10 1.90 3.07 -1.83 -1.24 114.58 115.88 1nyq h GLU 607 Ca 0.63 0.01 0.31 0.00 -0.50 0.00 0.00 59.36 59.81 1nyq h GLU 607 Cb 1.16 0.03 -0.11 0.00 -0.84 0.00 0.00 28.75 28.99 1nyq h GLU 607 CO -0.46 -0.08 0.69 0.28 -1.40 0.00 0.00 179.01 178.04 1nyq h VAL 608 N -0.19 0.41 0.17 3.13 2.07 -1.30 0.42 116.25 120.96 1nyq h VAL 608 Ca -0.01 -0.11 -0.01 0.00 0.82 0.00 0.00 66.70 67.39 1nyq h VAL 608 Cb 0.09 0.05 0.00 0.00 -1.52 0.00 0.00 31.29 29.92 1nyq h VAL 608 CO 0.02 0.06 -0.08 -0.08 0.02 0.00 0.00 177.57 177.51 1nyq h GLU 609 N 0.33 -0.22 0.00 1.57 4.81 -1.20 -3.30 114.58 116.57 1nyq h GLU 609 Ca 0.66 0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.91 1nyq h GLU 609 Cb 1.74 0.05 0.00 0.00 0.63 0.00 0.00 28.75 31.17 1nyq h GLU 609 CO -0.37 -0.15 0.00 0.09 -0.73 0.00 0.00 179.01 177.85 1nyq n ASN 610 N -3.21 0.00 -2.83 1.04 4.13 -0.47 -4.89 115.26 109.03 1nyq n ASN 610 Ca -0.03 0.30 -0.14 0.00 1.68 0.00 0.00 54.58 56.39 1nyq n ASN 610 Cb 0.09 -0.38 0.07 0.00 -1.54 0.00 0.00 39.78 38.02 1nyq n ASN 610 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 1nyq n ASN 611 N -1.38 -2.52 -2.22 6.41 5.03 0.15 -5.00 115.26 115.73 1nyq n ASN 611 Ca 0.04 -0.46 -0.10 0.00 0.87 0.00 0.00 54.58 54.93 1nyq n ASN 611 Cb 0.09 -3.98 -0.04 0.00 -1.02 0.00 0.00 39.78 34.83 1nyq n ASN 611 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1nyq n GLN 612 N -3.44 0.38 -3.88 3.52 10.64 -1.06 -3.36 117.38 120.18 1nyq n GLN 612 Ca -0.18 -1.57 -0.11 0.00 -1.83 0.00 0.00 57.00 53.30 1nyq n GLN 612 Cb 0.62 1.14 -0.12 0.00 -0.86 0.00 0.00 30.24 31.02 1nyq n GLN 612 CO 0.00 0.00 0.00 0.14 -1.83 0.00 0.00 177.06 175.37 1nyq s VAL 613 N -2.51 0.04 -0.43 -0.39 -7.23 -0.07 -4.49 120.40 105.33 1nyq s VAL 613 Ca 0.16 -0.35 -0.19 0.00 -1.81 0.00 0.00 61.98 59.80 1nyq s VAL 613 Cb 0.01 -0.20 0.02 0.00 0.56 0.00 0.00 36.38 36.77 1nyq s VAL 613 CO 0.11 -0.19 0.52 0.21 -0.31 0.00 0.00 175.10 175.44 1nyq s ASN 614 N -0.58 6.24 -0.03 4.85 3.84 -1.02 -1.68 114.94 126.57 1nyq s ASN 614 Ca -0.07 -0.56 -0.03 0.00 0.21 0.00 0.00 52.86 52.42 1nyq s ASN 614 Cb -0.04 -2.26 -0.04 0.00 -0.55 0.00 0.00 41.25 38.36 1nyq s ASN 614 CO 0.00 -0.66 0.16 -0.69 -2.79 0.00 0.00 177.10 173.12 1nyq s VAL 615 N 2.40 5.31 -0.09 -5.21 1.01 -1.21 -0.17 120.40 122.44 1nyq s VAL 615 Ca 0.16 -0.15 -0.03 0.00 0.00 0.00 0.00 61.98 61.96 1nyq s VAL 615 Cb -0.16 -3.45 0.05 0.00 0.00 0.00 0.00 36.38 32.82 1nyq s VAL 615 CO 0.16 0.38 0.11 -0.60 0.00 0.00 0.00 175.10 175.15 1nyq s ARG 616 N -1.76 0.00 1.02 2.72 3.52 -0.74 -2.52 118.95 121.19 1nyq s ARG 616 Ca 0.25 0.37 -0.16 0.00 -0.13 0.00 0.00 55.73 56.06 1nyq s ARG 616 Cb -0.12 -0.67 0.21 0.00 -1.56 0.00 0.00 34.95 32.80 1nyq s ARG 616 CO 0.16 -0.40 1.19 -0.65 -0.81 0.00 0.00 175.30 174.79 1nyq s GLN 617 N 2.22 0.22 0.37 5.12 -0.21 -1.26 -1.66 119.66 124.46 1nyq s GLN 617 Ca 0.04 -0.04 0.19 0.00 0.02 0.00 0.00 55.36 55.57 1nyq s GLN 617 Cb -0.13 -1.76 0.61 0.00 1.00 0.00 0.00 33.01 32.73 1nyq s GLN 617 CO -0.06 -2.76 1.69 -0.92 -2.12 0.00 0.00 175.29 171.13 1nyq h TYR 618 N -1.89 0.00 0.00 0.91 3.20 -1.59 -3.36 116.97 114.24 1nyq h TYR 618 Ca -0.47 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.40 1nyq h TYR 618 Cb 1.29 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.56 1nyq h TYR 618 CO -0.94 0.37 0.00 0.41 -1.64 0.00 0.00 178.16 176.36 1nyq n GLY 619 N 0.42 0.00 3.19 1.82 0.00 -1.26 -4.57 105.19 104.79 1nyq n GLY 619 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 1nyq n GLY 619 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1nyq n SER 620 N -0.18 -6.08 0.00 1.61 3.41 -1.26 -4.98 113.62 106.15 1nyq n SER 620 Ca 0.00 -0.38 0.00 0.00 -0.26 0.00 0.00 58.87 58.23 1nyq n SER 620 Cb 0.00 -4.82 0.00 0.00 -0.26 0.00 0.00 64.21 59.13 1nyq n SER 620 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 1nyq n GLN 621 N -4.29 0.00 -4.41 4.33 7.27 -1.26 -5.15 117.38 113.86 1nyq n GLN 621 Ca -0.06 0.00 -0.29 0.00 0.07 0.00 0.00 57.00 56.72 1nyq n GLN 621 Cb 0.59 0.00 -0.13 0.00 2.41 0.00 0.00 30.24 33.12 1nyq n GLN 621 CO 0.00 0.00 0.00 -0.51 0.07 0.00 0.00 177.06 176.62 1nyq s ASP 622 N 1.00 3.49 0.43 1.69 1.01 -1.26 -5.06 116.67 117.97 1nyq s ASP 622 Ca 0.00 -0.67 -0.22 0.00 0.71 0.00 0.00 52.55 52.36 1nyq s ASP 622 Cb 0.00 -0.33 -0.09 0.00 1.01 0.00 0.00 42.92 43.51 1nyq s ASP 622 CO 0.00 0.19 1.04 0.00 0.21 0.00 0.00 175.17 176.60 1nyq s GLN 623 N -2.00 4.04 -0.02 8.23 0.00 -1.26 -4.85 119.66 123.80 1nyq s GLN 623 Ca 0.15 1.42 0.01 0.00 -0.00 0.00 0.00 55.36 56.95 1nyq s GLN 623 Cb -0.10 -2.35 0.01 0.00 0.00 0.00 0.00 33.01 30.57 1nyq s GLN 623 CO 0.07 -0.23 -0.04 -2.00 0.00 0.00 0.00 175.29 173.08 1nyq s GLU 624 N -2.81 0.57 0.79 9.60 2.56 -1.05 -4.95 118.70 123.41 1nyq s GLU 624 Ca 0.61 -0.11 -0.14 0.00 0.00 0.00 0.00 54.97 55.34 1nyq s GLU 624 Cb -0.19 -0.60 0.08 0.00 2.00 0.00 0.00 34.13 35.42 1nyq s GLU 624 CO 0.24 -0.00 1.21 0.99 -0.56 0.00 0.00 175.26 177.13 1nyq s THR 625 N 0.47 2.07 0.01 -1.70 2.01 -1.26 -3.35 115.64 113.90 1nyq s THR 625 Ca -0.06 0.03 -0.21 0.00 0.31 0.00 0.00 61.69 61.77 1nyq s THR 625 Cb -0.09 -2.48 0.04 0.00 0.01 0.00 0.00 72.50 69.98 1nyq s THR 625 CO -0.00 -0.02 0.46 -0.69 -0.69 0.00 0.00 174.62 173.67 1nyq s VAL 626 N -2.10 0.04 0.08 3.82 1.01 -0.67 -4.90 120.40 117.67 1nyq s VAL 626 Ca 0.74 -0.33 -0.30 0.00 0.00 0.00 0.00 61.98 62.08 1nyq s VAL 626 Cb -0.29 -0.88 -0.06 0.00 0.00 0.00 0.00 36.38 35.15 1nyq s VAL 626 CO 0.50 -0.18 1.17 -0.70 0.00 0.00 0.00 175.10 175.88 1nyq s GLU 627 N -1.91 4.47 0.19 2.72 2.56 -1.26 -0.89 118.70 124.58 1nyq s GLU 627 Ca -0.09 1.74 -0.21 0.00 0.00 0.00 0.00 54.97 56.41 1nyq s GLU 627 Cb -0.02 -3.34 0.12 0.00 2.00 0.00 0.00 34.13 32.89 1nyq s GLU 627 CO 0.02 -0.18 1.58 -0.22 -0.56 0.00 0.00 175.26 175.90 1nyq h LYS 628 N 6.45 -0.15 -0.50 4.30 3.64 -1.82 0.39 116.57 128.89 1nyq h LYS 628 Ca -0.42 0.01 0.09 0.00 -1.27 0.00 0.00 60.65 59.06 1nyq h LYS 628 Cb 1.21 0.03 -0.10 0.00 -0.41 0.00 0.00 32.23 32.97 1nyq h LYS 628 CO 0.79 -0.10 -0.36 -0.44 -2.27 0.00 0.00 179.45 177.07 1nyq h ASP 629 N -0.16 -1.21 0.57 4.20 5.19 -1.91 -2.27 116.42 120.84 1nyq h ASP 629 Ca 0.23 0.22 -0.02 0.00 -0.62 0.00 0.00 57.03 56.84 1nyq h ASP 629 Cb 0.56 0.57 -0.01 0.00 0.18 0.00 0.00 39.33 40.63 1nyq h ASP 629 CO -0.72 -0.32 -0.41 -0.33 -3.12 0.00 0.00 179.24 174.34 1nyq h GLU 630 N -0.22 -0.90 -0.88 3.56 5.08 -1.36 -3.08 114.58 116.78 1nyq h GLU 630 Ca 0.19 0.06 0.19 0.00 -1.00 0.00 0.00 59.36 58.80 1nyq h GLU 630 Cb 0.55 0.20 -0.16 0.00 0.50 0.00 0.00 28.75 29.84 1nyq h GLU 630 CO -0.62 -0.60 -0.17 0.35 -1.00 0.00 0.00 179.01 176.97 1nyq h PHE 631 N -0.93 -0.37 -0.16 4.33 3.57 -0.88 0.17 116.94 122.67 1nyq h PHE 631 Ca -0.08 0.08 0.02 0.00 3.53 0.00 0.00 57.97 61.52 1nyq h PHE 631 Cb 0.77 0.30 -0.02 0.00 2.79 0.00 0.00 35.95 39.79 1nyq h PHE 631 CO -0.12 -0.37 0.05 0.82 -2.23 0.00 0.00 178.31 176.46 1nyq h ILE 632 N 0.01 0.95 -0.08 1.41 2.04 -1.43 0.32 117.51 120.74 1nyq h ILE 632 Ca 0.44 -0.04 0.02 0.00 1.00 0.00 0.00 64.86 66.28 1nyq h ILE 632 Cb 0.72 0.82 -0.05 0.00 -0.74 0.00 0.00 36.82 37.57 1nyq h ILE 632 CO -0.88 0.02 -0.41 -0.25 0.00 0.00 0.00 178.15 176.64 1nyq h TRP 633 N 0.12 -1.21 -0.40 1.37 2.91 -0.65 0.43 115.95 118.53 1nyq h TRP 633 Ca 0.07 0.04 0.08 0.00 1.13 0.00 0.00 58.89 60.22 1nyq h TRP 633 Cb 0.05 0.54 -0.08 0.00 -0.51 0.00 0.00 29.16 29.15 1nyq h TRP 633 CO -0.12 -0.41 -0.16 -0.91 -1.03 0.00 0.00 178.44 175.81 1nyq h ASN 634 N -0.45 -0.57 0.22 2.65 2.35 -0.74 0.17 115.58 119.22 1nyq h ASN 634 Ca 0.02 0.14 -0.01 0.00 -0.55 0.00 0.00 56.30 55.90 1nyq h ASN 634 Cb 0.51 0.32 0.00 0.00 0.05 0.00 0.00 38.32 39.21 1nyq h ASN 634 CO -0.32 -0.20 -0.11 0.25 -1.65 0.00 0.00 177.43 175.41 1nyq h LEU 635 N -0.09 -0.26 -1.20 1.61 5.85 0.12 0.44 115.31 121.79 1nyq h LEU 635 Ca 0.20 0.01 0.11 0.00 0.84 0.00 0.00 57.88 59.03 1nyq h LEU 635 Cb 0.39 0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.47 1nyq h LEU 635 CO -0.46 -0.18 0.78 0.58 -0.34 0.00 0.00 178.44 178.82 1nyq h VAL 636 N -0.30 0.08 0.00 1.05 2.07 0.00 -0.96 116.25 118.19 1nyq h VAL 636 Ca -0.03 0.00 -0.11 0.00 0.82 0.00 0.00 66.70 67.38 1nyq h VAL 636 Cb 0.23 0.30 -0.02 0.00 -1.52 0.00 0.00 31.29 30.29 1nyq h VAL 636 CO 0.05 0.00 -0.62 -0.78 0.02 0.00 0.00 177.57 176.24 1nyq h ASP 637 N 0.00 0.00 -0.81 0.57 1.82 0.16 -2.01 116.42 116.16 1nyq h ASP 637 Ca 0.17 -0.61 0.19 0.00 -0.39 0.00 0.00 57.03 56.40 1nyq h ASP 637 Cb 1.72 0.00 -0.05 0.00 0.68 0.00 0.00 39.33 41.68 1nyq h ASP 637 CO -0.00 1.17 0.55 -0.08 -1.61 0.00 0.00 179.24 179.27 1nyq h GLU 638 N -1.00 0.26 0.05 0.28 4.81 0.11 0.17 114.58 119.26 1nyq h GLU 638 Ca -0.16 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.05 1nyq h GLU 638 Cb 1.02 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.34 1nyq h GLU 638 CO -0.10 0.17 -0.02 0.82 -0.73 0.00 0.00 179.01 179.15 1nyq h ILE 639 N 0.27 0.00 -0.85 2.32 2.04 -1.35 -1.83 117.51 118.10 1nyq h ILE 639 Ca 0.40 -0.12 0.28 0.00 1.00 0.00 0.00 64.86 66.42 1nyq h ILE 639 Cb 1.18 0.00 -0.16 0.00 -0.74 0.00 0.00 36.82 37.10 1nyq h ILE 639 CO -0.10 0.00 0.16 -1.14 0.00 0.00 0.00 178.15 177.07 1nyq n ARG 640 N -2.50 -0.06 -0.21 2.37 0.63 -0.75 0.16 116.66 116.30 1nyq n ARG 640 Ca -0.01 1.25 0.03 0.00 -0.92 0.00 0.00 57.85 58.20 1nyq n ARG 640 Cb 0.02 -2.06 0.13 0.00 0.45 0.00 0.00 32.46 31.00 1nyq n ARG 640 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 1nyq n LEU 641 N -5.14 1.92 -3.42 6.15 4.32 0.57 -4.92 117.00 116.48 1nyq n LEU 641 Ca 0.24 -0.97 -0.23 0.00 -0.02 0.00 0.00 56.01 55.03 1nyq n LEU 641 Cb 0.80 -0.34 -0.04 0.00 -1.62 0.00 0.00 43.42 42.22 1nyq n LEU 641 CO -0.04 0.36 -0.09 0.29 -1.22 0.00 0.00 177.39 176.70 1nyq n LYS 642 N 0.25 -1.46 -2.02 3.23 4.01 0.42 -4.85 118.16 117.74 1nyq n LYS 642 Ca 0.09 0.08 -0.38 0.00 -0.51 0.00 0.00 58.31 57.58 1nyq n LYS 642 Cb 0.37 -3.97 0.01 0.00 -0.51 0.00 0.00 35.03 30.93 1nyq n LYS 642 CO 0.00 0.00 0.00 0.21 -1.11 0.00 0.00 177.40 176.50 1nyq s LYS 643 N -5.60 3.63 0.00 1.97 2.20 -0.71 -4.95 119.74 116.28 1nyq s LYS 643 Ca 0.46 2.08 0.00 0.00 -0.36 0.00 0.00 55.97 58.14 1nyq s LYS 643 Cb -0.27 -2.49 0.00 0.00 -1.51 0.00 0.00 37.83 33.57 1nyq s LYS 643 CO 0.56 -0.75 0.00 -2.39 -0.36 0.00 0.00 175.35 172.42 1nyq n HIS 644 N -0.44 0.00 -0.60 4.03 1.44 -1.26 -4.55 115.22 113.85 1nyq n HIS 644 Ca 0.07 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.78 1nyq n HIS 644 Cb 0.45 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.56 1nyq n HIS 644 CO 0.00 0.00 0.00 -2.13 -2.81 0.00 0.00 176.34 171.40