#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1q0t s LEU 2 N 0.00 4.33 0.00 4.03 1.43 -1.26 -4.30 118.68 122.91 1q0t s LEU 2 Ca 0.00 2.07 -0.03 0.00 -1.03 0.00 0.00 54.13 55.15 1q0t s LEU 2 Cb 0.00 -3.57 0.07 0.00 0.03 0.00 0.00 46.19 42.72 1q0t s LEU 2 CO 0.00 -0.63 0.44 0.61 0.23 0.00 0.00 176.35 177.00 1q0t n GLY 3 N 3.48 -0.14 0.10 -3.19 0.00 -1.26 -4.73 105.19 99.45 1q0t n GLY 3 Ca 0.12 -1.86 -0.14 0.00 0.00 0.00 0.00 46.02 44.14 1q0t n GLY 3 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1q0t h ALA 4 N -1.12 0.48 -2.54 4.61 0.00 -1.72 -3.44 119.26 115.54 1q0t h ALA 4 Ca -0.14 -1.27 -0.12 0.00 0.00 0.00 0.00 54.91 53.38 1q0t h ALA 4 Cb 0.46 0.41 -0.19 0.00 0.00 0.00 0.00 17.79 18.46 1q0t h ALA 4 CO 0.13 1.33 -0.29 0.96 0.00 0.00 0.00 179.25 181.38 1q0t s ILE 5 N -2.61 0.07 0.01 0.00 -4.36 -1.21 -4.31 121.20 108.79 1q0t s ILE 5 Ca -0.10 -0.54 -0.33 0.00 -0.26 0.00 0.00 60.65 59.42 1q0t s ILE 5 Cb 0.07 -0.67 -0.12 0.00 1.25 0.00 0.00 42.46 43.00 1q0t s ILE 5 CO 0.82 -0.30 1.83 0.00 0.24 0.00 0.00 174.94 177.53 1q0t n ALA 6 N 1.15 1.26 -3.75 2.27 0.00 -1.26 -4.71 120.51 115.46 1q0t n ALA 6 Ca -0.21 0.31 -0.22 0.00 0.00 0.00 0.00 53.44 53.32 1q0t n ALA 6 Cb 0.57 -2.51 -0.17 0.00 0.00 0.00 0.00 19.45 17.34 1q0t n ALA 6 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 1q0t s TYR 7 N 3.28 0.66 -0.27 0.00 5.04 -1.26 -4.87 117.35 119.93 1q0t s TYR 7 Ca 0.88 -0.16 -0.37 0.00 -2.44 0.00 0.00 57.07 54.98 1q0t s TYR 7 Cb -0.63 -0.77 -0.13 0.00 0.35 0.00 0.00 41.96 40.79 1q0t s TYR 7 CO 0.46 -0.30 1.97 2.41 -1.34 0.00 0.00 175.55 178.74 1q0t n THR 8 N 4.98 0.32 -1.78 4.34 -1.04 -1.26 -0.28 114.28 119.56 1q0t n THR 8 Ca -0.10 -0.16 0.00 0.00 -2.04 0.00 0.00 64.05 61.75 1q0t n THR 8 Cb 0.50 -1.56 0.00 0.00 -1.82 0.00 0.00 70.33 67.45 1q0t n THR 8 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1q0t n GLY 9 N 5.28 0.65 3.37 3.41 0.00 -1.26 -5.03 105.19 111.61 1q0t n GLY 9 Ca 0.32 -0.74 -0.30 0.00 0.00 0.00 0.00 46.02 45.30 1q0t n GLY 9 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1q0t s ASN 10 N -2.86 -0.48 -0.17 1.61 2.20 0.61 -4.95 114.94 110.90 1q0t s ASN 10 Ca 0.00 0.97 0.14 0.00 -0.94 0.00 0.00 52.86 53.03 1q0t s ASN 10 Cb 0.00 -1.42 0.41 0.00 -2.00 0.00 0.00 41.25 38.25 1q0t s ASN 10 CO 0.00 -5.02 1.21 0.29 -2.94 0.00 0.00 177.10 170.63 1q0t n LYS 11 N -5.42 1.31 0.32 3.55 4.76 -1.26 -4.78 118.16 116.64 1q0t n LYS 11 Ca 0.10 -3.05 0.22 0.00 -2.87 0.00 0.00 58.31 52.71 1q0t n LYS 11 Cb 0.59 -1.34 1.15 0.00 -1.84 0.00 0.00 35.03 33.58 1q0t n LYS 11 CO 0.00 0.00 0.00 1.96 -1.37 0.00 0.00 177.40 177.99 1q0t h GLN 12 N 0.95 0.00 0.00 1.97 4.20 -1.89 -2.24 115.11 118.09 1q0t h GLN 12 Ca -0.04 0.00 -0.37 0.00 0.06 0.00 0.00 58.65 58.31 1q0t h GLN 12 Cb 1.15 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 28.87 1q0t h GLN 12 CO 0.02 0.00 -2.25 -1.13 -0.67 0.00 0.00 178.83 174.79 1q0t n SER 13 N -2.99 1.77 -0.05 1.46 3.41 -1.26 -3.79 113.62 112.17 1q0t n SER 13 Ca -0.03 0.19 -0.10 0.00 -0.26 0.00 0.00 58.87 58.67 1q0t n SER 13 Cb 0.07 -0.59 0.04 0.00 -0.26 0.00 0.00 64.21 63.47 1q0t n SER 13 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1q0t h LEU 14 N -0.63 0.78 -0.28 1.04 4.07 -1.90 -3.35 115.31 115.04 1q0t h LEU 14 Ca -0.55 -0.37 0.02 0.00 0.08 0.00 0.00 57.88 57.07 1q0t h LEU 14 Cb 1.56 -0.22 -0.03 0.00 1.08 0.00 0.00 40.66 43.04 1q0t h LEU 14 CO -0.29 1.10 -0.16 -0.11 -1.08 0.00 0.00 178.44 177.90 1q0t n LEU 15 N -4.02 -0.29 -0.30 1.67 7.94 -0.85 0.65 117.00 121.79 1q0t n LEU 15 Ca -0.02 0.57 -0.12 0.00 -1.11 0.00 0.00 56.01 55.33 1q0t n LEU 15 Cb 0.55 -0.10 -0.09 0.00 0.53 0.00 0.00 43.42 44.31 1q0t n LEU 15 CO 0.47 -0.44 0.49 -0.65 -1.11 0.00 0.00 177.39 176.16 1q0t h PRO 16 N 0.00 -0.15 -0.24 1.96 0.11 -1.86 0.50 132.00 132.31 1q0t h PRO 16 Ca 0.04 0.01 0.04 0.00 0.11 0.00 0.00 66.00 66.21 1q0t h PRO 16 Cb 0.11 0.03 -0.07 0.00 0.11 0.00 0.00 31.00 31.19 1q0t h PRO 16 CO -0.26 -0.10 -0.52 0.93 -0.21 0.00 0.00 178.00 177.84 1q0t h GLU 17 N -0.16 -0.47 -0.84 1.05 5.08 -0.02 -0.40 114.58 118.81 1q0t h GLU 17 Ca 0.14 0.03 0.20 0.00 -1.00 0.00 0.00 59.36 58.72 1q0t h GLU 17 Cb 0.49 0.11 -0.12 0.00 0.50 0.00 0.00 28.75 29.73 1q0t h GLU 17 CO -0.80 -0.32 0.31 -0.07 -1.00 0.00 0.00 179.01 177.13 1q0t h LEU 18 N -0.49 0.20 -2.32 1.33 3.38 -0.06 0.42 115.31 117.77 1q0t h LEU 18 Ca 0.06 0.15 -0.00 0.00 0.09 0.00 0.00 57.88 58.18 1q0t h LEU 18 Cb 0.64 0.16 -0.00 0.00 0.09 0.00 0.00 40.66 41.55 1q0t h LEU 18 CO -0.49 -0.02 -0.02 0.11 0.09 0.00 0.00 178.44 178.11 1q0t h LYS 19 N 0.35 0.00 0.00 1.13 1.57 0.16 0.20 116.57 119.97 1q0t h LYS 19 Ca 0.50 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.28 1q0t h LYS 19 Cb 0.92 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.23 1q0t h LYS 19 CO -0.53 0.02 0.00 -1.13 -0.57 0.00 0.00 179.45 177.24 1q0t n SER 20 N -3.19 0.15 -0.10 0.86 3.41 0.15 -2.90 113.62 112.00 1q0t n SER 20 Ca -0.02 0.53 0.06 0.00 -0.26 0.00 0.00 58.87 59.19 1q0t n SER 20 Cb 0.17 -0.56 0.10 0.00 -0.26 0.00 0.00 64.21 63.66 1q0t n SER 20 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1q0t n HIS 21 N -1.66 0.06 -3.76 7.33 8.25 0.68 -5.05 115.22 121.07 1q0t n HIS 21 Ca 0.04 -0.80 -0.28 0.00 -0.26 0.00 0.00 57.72 56.42 1q0t n HIS 21 Cb 0.24 -0.12 -0.03 0.00 1.12 0.00 0.00 29.99 31.19 1q0t n HIS 21 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 1q0t s PHE 22 N -2.15 3.49 0.00 4.41 0.08 -1.14 -5.06 117.98 117.60 1q0t s PHE 22 Ca 0.21 0.32 0.00 0.00 0.12 0.00 0.00 56.93 57.58 1q0t s PHE 22 Cb 0.18 -1.83 0.00 0.00 -0.57 0.00 0.00 43.02 40.80 1q0t s PHE 22 CO 0.03 0.43 0.00 -0.35 -0.10 0.00 0.00 175.22 175.22 1q0t n PRO 23 N -0.48 1.33 -2.47 0.24 -0.04 -1.26 -5.07 135.00 127.25 1q0t n PRO 23 Ca -0.05 0.00 -0.23 0.00 -0.04 0.00 0.00 63.50 63.18 1q0t n PRO 23 Cb 0.53 0.00 0.06 0.00 -0.04 0.00 0.00 33.50 34.05 1q0t n PRO 23 CO 0.00 0.00 0.00 -1.59 -0.04 0.00 0.00 175.50 173.87 1q0t s LYS 24 N -0.98 2.29 0.00 0.54 -2.85 -1.26 -5.07 119.74 112.40 1q0t s LYS 24 Ca 0.00 -0.64 0.00 0.00 -1.00 0.00 0.00 55.97 54.33 1q0t s LYS 24 Cb 0.00 -2.35 0.00 0.00 -2.06 0.00 0.00 37.83 33.42 1q0t s LYS 24 CO 0.00 -1.01 0.00 2.48 0.10 0.00 0.00 175.35 176.92 1q0t n TYR 25 N -2.62 0.00 0.26 1.78 0.18 -1.26 -4.73 117.16 110.77 1q0t n TYR 25 Ca 0.09 0.00 0.14 0.00 1.88 0.00 0.00 57.90 60.01 1q0t n TYR 25 Cb 0.60 0.00 0.42 0.00 -0.38 0.00 0.00 39.34 39.98 1q0t n TYR 25 CO 0.00 0.00 0.00 -0.91 -2.08 0.00 0.00 176.86 173.87 1q0t h ASN 26 N 0.00 0.00 -2.42 9.48 4.21 0.15 -3.44 115.58 123.55 1q0t h ASN 26 Ca 0.00 0.00 0.04 0.00 1.21 0.00 0.00 56.30 57.55 1q0t h ASN 26 Cb 0.00 0.00 -0.21 0.00 -1.12 0.00 0.00 38.32 36.99 1q0t h ASN 26 CO 0.00 0.00 -0.11 -0.60 -1.29 0.00 0.00 177.43 175.43 1q0t s ARG 27 N -3.42 0.59 -0.26 0.81 3.52 -1.20 -4.21 118.95 114.78 1q0t s ARG 27 Ca 0.04 1.32 -0.25 0.00 -0.13 0.00 0.00 55.73 56.71 1q0t s ARG 27 Cb 0.07 0.55 -0.00 0.00 -1.56 0.00 0.00 34.95 34.01 1q0t s ARG 27 CO 0.60 -0.19 0.86 0.12 -0.81 0.00 0.00 175.30 175.89 1q0t s PHE 28 N 2.40 3.28 -0.47 5.12 5.99 0.15 -2.16 117.98 132.29 1q0t s PHE 28 Ca -0.07 1.11 -0.03 0.00 0.00 0.00 0.00 56.93 57.93 1q0t s PHE 28 Cb -0.10 -3.14 0.13 0.00 0.00 0.00 0.00 43.02 39.91 1q0t s PHE 28 CO -0.19 -0.46 0.28 0.54 -0.00 0.00 0.00 175.22 175.39 1q0t s VAL 29 N 2.95 3.49 -0.67 3.12 0.11 0.18 0.71 120.40 130.30 1q0t s VAL 29 Ca 0.36 -2.28 -0.28 0.00 -2.93 0.00 0.00 61.98 56.86 1q0t s VAL 29 Cb -0.15 -3.35 0.03 0.00 -1.53 0.00 0.00 36.38 31.38 1q0t s VAL 29 CO 0.09 -0.75 1.25 -0.62 -3.33 0.00 0.00 175.10 171.73 1q0t s ASP 30 N 1.60 6.28 0.33 3.54 -1.08 -0.65 -3.14 116.67 123.54 1q0t s ASP 30 Ca 0.10 -0.19 0.09 0.00 -0.52 0.00 0.00 52.55 52.03 1q0t s ASP 30 Cb -0.22 -2.56 0.56 0.00 -1.46 0.00 0.00 42.92 39.24 1q0t s ASP 30 CO -0.04 -1.69 1.75 -0.07 0.52 0.00 0.00 175.17 175.65 1q0t h LEU 31 N 12.58 0.15 -7.06 -1.34 4.07 -1.68 -1.10 115.31 120.93 1q0t h LEU 31 Ca -0.27 -0.06 -0.58 0.00 0.08 0.00 0.00 57.88 57.05 1q0t h LEU 31 Cb 1.05 -0.04 -0.40 0.00 1.08 0.00 0.00 40.66 42.35 1q0t h LEU 31 CO 1.24 0.53 -0.76 -0.36 -1.08 0.00 0.00 178.44 178.00 1q0t s PHE 32 N -4.18 1.57 -0.12 1.13 0.40 -1.21 -4.13 117.98 111.43 1q0t s PHE 32 Ca -0.04 -1.76 0.05 0.00 -0.60 0.00 0.00 56.93 54.58 1q0t s PHE 32 Cb 0.14 -1.62 -0.24 0.00 0.51 0.00 0.00 43.02 41.81 1q0t s PHE 32 CO 0.75 -0.86 0.34 0.00 0.70 0.00 0.00 175.22 176.16 1q0t n GLY 34 N 1.84 1.85 0.42 0.00 0.00 -1.26 0.08 105.19 108.12 1q0t n GLY 34 Ca -0.29 0.44 0.23 0.00 0.00 0.00 0.00 46.02 46.40 1q0t n GLY 34 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1q0t h GLY 35 N 0.00 0.76 0.00 -0.02 0.00 -1.92 -3.46 103.07 98.43 1q0t h GLY 35 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 47.33 47.18 1q0t h GLY 35 CO 0.00 -0.04 0.00 1.04 0.00 0.00 0.00 176.54 177.54 1q0t n LEU 36 N -4.48 0.00 0.12 3.11 4.77 0.11 -2.36 117.00 118.28 1q0t n LEU 36 Ca 0.21 0.00 0.19 0.00 -0.03 0.00 0.00 56.01 56.38 1q0t n LEU 36 Cb 0.82 0.00 0.67 0.00 -2.33 0.00 0.00 43.42 42.59 1q0t n LEU 36 CO 0.31 0.00 1.17 0.77 -1.33 0.00 0.00 177.39 178.31 1q0t h SER 37 N 0.00 0.00 0.09 -1.43 4.64 -1.85 -1.80 113.55 113.20 1q0t h SER 37 Ca 0.00 0.00 -0.34 0.00 -0.47 0.00 0.00 61.79 60.98 1q0t h SER 37 Cb 0.00 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.07 1q0t h SER 37 CO 0.00 0.00 -1.84 0.52 -0.87 0.00 0.00 176.83 174.64 1q0t n VAL 38 N -3.36 1.71 0.29 0.95 0.31 -1.26 -4.08 118.33 112.89 1q0t n VAL 38 Ca 0.07 -0.49 -0.15 0.00 -0.01 0.00 0.00 64.34 63.76 1q0t n VAL 38 Cb 0.71 -1.81 -0.08 0.00 -0.91 0.00 0.00 33.84 31.76 1q0t n VAL 38 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 1q0t h SER 39 N -0.22 -0.64 -0.92 4.52 0.02 -1.70 -3.11 113.55 111.50 1q0t h SER 39 Ca -0.42 -0.04 0.26 0.00 -0.84 0.00 0.00 61.79 60.75 1q0t h SER 39 Cb 1.84 0.16 -0.04 0.00 0.14 0.00 0.00 62.40 64.51 1q0t h SER 39 CO -0.00 -0.30 0.66 -0.07 -1.14 0.00 0.00 176.83 175.97 1q0t h LEU 40 N -1.00 0.04 -3.68 5.07 3.38 -1.66 -2.42 115.31 115.05 1q0t h LEU 40 Ca -0.08 0.01 -0.26 0.00 0.09 0.00 0.00 57.88 57.63 1q0t h LEU 40 Cb 0.64 -0.00 -0.16 0.00 0.09 0.00 0.00 40.66 41.23 1q0t h LEU 40 CO 0.13 0.01 0.28 0.59 0.09 0.00 0.00 178.44 179.54 1q0t n ASN 41 N -4.29 4.02 -3.87 -0.43 3.02 -1.18 -4.91 115.26 107.62 1q0t n ASN 41 Ca 0.19 -3.41 -0.23 0.00 -0.03 0.00 0.00 54.58 51.11 1q0t n ASN 41 Cb 0.96 -0.73 -0.17 0.00 -0.61 0.00 0.00 39.78 39.24 1q0t n ASN 41 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 1q0t s VAL 42 N -3.11 0.64 0.02 2.41 -7.23 -0.91 -4.93 120.40 107.28 1q0t s VAL 42 Ca 0.52 -0.11 -0.32 0.00 -1.81 0.00 0.00 61.98 60.27 1q0t s VAL 42 Cb 0.43 -0.69 -0.16 0.00 0.56 0.00 0.00 36.38 36.52 1q0t s VAL 42 CO 0.10 0.28 0.82 0.59 -0.31 0.00 0.00 175.10 176.58 1q0t n ASN 43 N 4.56 -0.11 -2.05 4.85 5.03 -1.26 -4.88 115.26 121.39 1q0t n ASN 43 Ca -0.16 0.94 0.00 0.00 0.87 0.00 0.00 54.58 56.23 1q0t n ASN 43 Cb 0.50 -0.75 0.00 0.00 -1.02 0.00 0.00 39.78 38.51 1q0t n ASN 43 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1q0t n GLY 44 N 1.26 -0.72 3.77 7.41 0.00 -1.26 -4.71 105.19 110.94 1q0t n GLY 44 Ca 0.16 -1.72 -0.36 0.00 0.00 0.00 0.00 46.02 44.10 1q0t n GLY 44 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1q0t s PRO 45 N -2.60 3.51 -0.03 1.61 0.02 -1.26 -4.81 135.00 131.44 1q0t s PRO 45 Ca 0.00 1.72 0.07 0.00 0.02 0.00 0.00 61.00 62.80 1q0t s PRO 45 Cb 0.00 -2.19 -0.02 0.00 0.02 0.00 0.00 34.50 32.32 1q0t s PRO 45 CO 0.00 -0.75 -0.23 0.08 -0.33 0.00 0.00 177.00 175.77 1q0t s VAL 46 N -1.64 1.81 -0.62 3.83 1.01 -0.69 0.34 120.40 124.44 1q0t s VAL 46 Ca 0.69 -0.97 -0.05 0.00 0.00 0.00 0.00 61.98 61.65 1q0t s VAL 46 Cb -0.27 -1.52 0.16 0.00 0.00 0.00 0.00 36.38 34.76 1q0t s VAL 46 CO 0.31 0.51 0.46 -0.22 0.00 0.00 0.00 175.10 176.16 1q0t s LEU 47 N -0.42 5.49 -0.10 3.92 2.96 0.22 -0.55 118.68 130.21 1q0t s LEU 47 Ca 0.05 -2.67 -0.30 0.00 -0.22 0.00 0.00 54.13 50.99 1q0t s LEU 47 Cb -0.10 -1.92 -0.02 0.00 0.50 0.00 0.00 46.19 44.65 1q0t s LEU 47 CO 0.00 -0.44 1.15 0.00 -1.32 0.00 0.00 176.35 175.74 1q0t s ALA 48 N 0.20 3.51 0.03 5.97 0.00 -0.57 -1.64 121.76 129.25 1q0t s ALA 48 Ca 0.15 0.50 0.03 0.00 0.00 0.00 0.00 51.96 52.64 1q0t s ALA 48 Cb -0.20 -3.51 -0.02 0.00 0.00 0.00 0.00 23.12 19.40 1q0t s ALA 48 CO -0.04 -0.80 -0.08 1.21 0.00 0.00 0.00 175.76 176.05 1q0t s ASN 49 N 1.42 0.93 -0.26 0.00 3.84 -0.42 -1.62 114.94 118.83 1q0t s ASN 49 Ca 0.53 -0.39 -0.23 0.00 0.21 0.00 0.00 52.86 52.97 1q0t s ASN 49 Cb -0.22 -0.02 0.07 0.00 -0.55 0.00 0.00 41.25 40.53 1q0t s ASN 49 CO 0.19 -0.08 0.69 -0.62 -2.79 0.00 0.00 177.10 174.49 1q0t s ASP 50 N -1.06 -0.75 0.00 -4.21 -1.08 -1.03 -0.95 116.67 107.60 1q0t s ASP 50 Ca -0.04 1.41 0.00 0.00 -0.52 0.00 0.00 52.55 53.40 1q0t s ASP 50 Cb -0.07 1.41 0.00 0.00 -1.46 0.00 0.00 42.92 42.80 1q0t s ASP 50 CO 0.00 -0.24 0.57 0.00 0.52 0.00 0.00 175.17 176.02 1q0t n ILE 51 N 2.88 0.00 -3.80 4.11 3.06 -1.23 -3.82 119.36 120.56 1q0t n ILE 51 Ca -0.15 0.00 -0.35 0.00 -2.50 0.00 0.00 62.75 59.76 1q0t n ILE 51 Cb 0.56 -0.21 -0.11 0.00 0.54 0.00 0.00 39.64 40.41 1q0t n ILE 51 CO 0.00 0.00 0.00 -1.10 -2.50 0.00 0.00 176.55 172.95 1q0t s GLN 52 N -1.90 2.26 0.17 9.51 -0.21 -1.26 -4.91 119.66 123.31 1q0t s GLN 52 Ca 0.00 -2.36 -0.27 0.00 0.02 0.00 0.00 55.36 52.75 1q0t s GLN 52 Cb 0.00 -3.59 0.00 0.00 1.00 0.00 0.00 33.01 30.43 1q0t s GLN 52 CO 0.00 -1.12 1.48 0.39 -2.12 0.00 0.00 175.29 173.92 1q0t n GLU 53 N 3.69 -0.38 -0.32 2.91 -0.58 -1.26 -2.11 120.64 122.60 1q0t n GLU 53 Ca 0.05 1.46 0.03 0.00 -0.42 0.00 0.00 57.16 58.27 1q0t n GLU 53 Cb 0.38 -2.15 0.10 0.00 -0.57 0.00 0.00 31.44 29.20 1q0t n GLU 53 CO 0.00 0.00 0.00 -1.35 -0.48 0.00 0.00 177.13 175.30 1q0t h PRO 54 N 0.00 -0.01 0.00 3.49 0.11 -1.97 0.47 132.00 134.09 1q0t h PRO 54 Ca 0.20 0.00 -0.14 0.00 0.11 0.00 0.00 66.00 66.17 1q0t h PRO 54 Cb 0.44 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.53 1q0t h PRO 54 CO -0.91 -0.01 -0.65 0.82 -0.21 0.00 0.00 178.00 177.04 1q0t h ILE 55 N -0.01 1.34 -0.15 4.15 2.04 -1.85 -1.39 117.51 121.64 1q0t h ILE 55 Ca 0.40 -2.31 -0.09 0.00 1.00 0.00 0.00 64.86 63.86 1q0t h ILE 55 Cb 0.63 2.29 -0.00 0.00 -0.74 0.00 0.00 36.82 39.00 1q0t h ILE 55 CO -0.91 0.63 -0.24 0.40 0.00 0.00 0.00 178.15 178.03 1q0t h ILE 56 N 0.00 1.36 -0.08 -0.67 1.08 -0.49 -2.36 117.51 116.35 1q0t h ILE 56 Ca -0.01 -1.48 0.03 0.00 -0.39 0.00 0.00 64.86 63.01 1q0t h ILE 56 Cb 1.23 1.97 -0.04 0.00 -3.07 0.00 0.00 36.82 36.91 1q0t h ILE 56 CO 0.08 0.44 -0.14 -0.33 -0.69 0.00 0.00 178.15 177.51 1q0t h GLU 57 N 0.04 -0.19 -0.88 2.37 4.39 -0.09 0.25 114.58 120.48 1q0t h GLU 57 Ca 0.01 0.01 0.20 0.00 0.34 0.00 0.00 59.36 59.93 1q0t h GLU 57 Cb 0.82 0.04 -0.12 0.00 -0.10 0.00 0.00 28.75 29.40 1q0t h GLU 57 CO 0.06 -0.13 0.39 1.98 -1.16 0.00 0.00 179.01 180.15 1q0t h MET 58 N -0.20 0.42 -0.06 2.33 4.05 -1.21 0.56 114.93 120.82 1q0t h MET 58 Ca 0.08 -0.03 -0.01 0.00 -0.28 0.00 0.00 59.70 59.46 1q0t h MET 58 Cb 0.30 -0.09 -0.00 0.00 -0.80 0.00 0.00 31.60 31.01 1q0t h MET 58 CO -0.20 0.28 0.02 1.88 0.23 0.00 0.00 176.91 179.12 1q0t h TYR 59 N 0.43 0.10 -0.77 1.39 0.99 -0.45 0.19 116.97 118.84 1q0t h TYR 59 Ca 0.54 -0.01 0.12 0.00 2.00 0.00 0.00 58.73 61.37 1q0t h TYR 59 Cb 0.97 -0.03 -0.05 0.00 1.00 0.00 0.00 36.73 38.62 1q0t h TYR 59 CO -0.13 0.28 0.51 0.87 -0.00 0.00 0.00 178.16 179.68 1q0t h LYS 60 N -0.11 0.58 0.07 4.88 1.57 0.32 -1.65 116.57 122.23 1q0t h LYS 60 Ca 0.02 -0.03 -0.14 0.00 -1.87 0.00 0.00 60.65 58.63 1q0t h LYS 60 Cb 0.23 -0.13 0.01 0.00 0.08 0.00 0.00 32.23 32.42 1q0t h LYS 60 CO -0.00 0.38 -0.57 -0.09 -0.57 0.00 0.00 179.45 178.60 1q0t h ARG 61 N 0.59 0.26 -1.33 3.15 2.43 -0.28 -3.19 114.38 116.01 1q0t h ARG 61 Ca 0.37 -0.38 0.39 0.00 -0.81 0.00 0.00 59.98 59.55 1q0t h ARG 61 Cb 0.62 0.13 -0.08 0.00 -0.42 0.00 0.00 29.97 30.22 1q0t h ARG 61 CO -0.14 1.13 0.92 -0.07 -1.51 0.00 0.00 179.97 180.31 1q0t h LEU 62 N -0.42 0.13 -0.41 3.80 3.38 0.27 -0.54 115.31 121.51 1q0t h LEU 62 Ca -0.09 0.04 0.06 0.00 0.09 0.00 0.00 57.88 57.98 1q0t h LEU 62 Cb 1.39 0.03 -0.09 0.00 0.09 0.00 0.00 40.66 42.08 1q0t h LEU 62 CO 0.11 -0.02 -0.51 0.40 0.09 0.00 0.00 178.44 178.52 1q0t h ILE 63 N 0.09 0.04 -2.57 1.22 2.04 -1.36 -2.90 117.51 114.08 1q0t h ILE 63 Ca 0.69 0.00 -0.75 0.00 1.00 0.00 0.00 64.86 65.79 1q0t h ILE 63 Cb 2.46 0.04 -0.32 0.00 -0.74 0.00 0.00 36.82 38.26 1q0t h ILE 63 CO -0.14 0.00 0.47 -0.46 0.00 0.00 0.00 178.15 178.02 1q0t n ASN 64 N -5.40 6.00 -3.82 1.72 0.23 -0.21 -4.96 115.26 108.82 1q0t n ASN 64 Ca -0.02 -3.51 -0.12 0.00 -0.53 0.00 0.00 54.58 50.40 1q0t n ASN 64 Cb 0.35 -1.07 -0.09 0.00 -2.08 0.00 0.00 39.78 36.88 1q0t n ASN 64 CO 0.00 0.00 0.00 -0.69 -0.93 0.00 0.00 177.26 175.64 1q0t s VAL 65 N -3.25 0.07 0.33 3.53 1.01 -1.10 -5.06 120.40 115.93 1q0t s VAL 65 Ca 0.36 -0.59 0.09 0.00 0.00 0.00 0.00 61.98 61.83 1q0t s VAL 65 Cb 0.12 -0.51 -0.04 0.00 0.00 0.00 0.00 36.38 35.94 1q0t s VAL 65 CO 0.01 -0.32 0.10 -0.94 0.00 0.00 0.00 175.10 173.95 1q0t s SER 66 N -1.36 4.62 0.14 3.32 1.04 -1.26 -5.01 113.70 115.20 1q0t s SER 66 Ca -0.14 -0.77 -0.17 0.00 0.48 0.00 0.00 55.95 55.36 1q0t s SER 66 Cb -0.07 -0.74 -0.00 0.00 0.10 0.00 0.00 66.02 65.32 1q0t s SER 66 CO 0.03 -0.24 1.77 -0.25 0.98 0.00 0.00 173.24 175.53 1q0t h TRP 67 N 1.63 0.51 -1.00 5.02 -0.00 -2.00 -0.89 115.95 119.23 1q0t h TRP 67 Ca -0.44 -0.00 0.24 0.00 -0.00 0.00 0.00 58.89 58.69 1q0t h TRP 67 Cb 1.25 -0.17 -0.09 0.00 -0.00 0.00 0.00 29.16 30.16 1q0t h TRP 67 CO 0.64 0.37 0.65 -0.44 -0.00 0.00 0.00 178.44 179.66 1q0t h ASP 68 N 0.50 0.46 -0.11 2.65 3.32 -1.99 0.53 116.42 121.78 1q0t h ASP 68 Ca 0.14 0.07 0.01 0.00 0.02 0.00 0.00 57.03 57.27 1q0t h ASP 68 Cb 0.02 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 39.55 1q0t h ASP 68 CO -0.02 0.13 0.04 0.44 -1.72 0.00 0.00 179.24 178.10 1q0t h ASP 69 N 0.43 0.05 0.24 6.45 3.45 -1.56 -1.10 116.42 124.38 1q0t h ASP 69 Ca 0.55 0.01 0.00 0.00 0.43 0.00 0.00 57.03 58.03 1q0t h ASP 69 Cb 1.35 0.01 -0.02 0.00 -0.56 0.00 0.00 39.33 40.10 1q0t h ASP 69 CO -0.26 0.04 -0.27 0.58 -1.57 0.00 0.00 179.24 177.76 1q0t h VAL 70 N 0.10 0.43 -0.63 -1.35 2.07 0.30 -2.68 116.25 114.48 1q0t h VAL 70 Ca 0.05 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.68 1q0t h VAL 70 Cb 0.02 0.43 -0.08 0.00 -1.52 0.00 0.00 31.29 30.14 1q0t h VAL 70 CO -0.05 0.00 0.20 -0.07 0.02 0.00 0.00 177.57 177.67 1q0t h LEU 71 N -0.55 0.14 -1.97 2.57 3.38 -1.06 0.38 115.31 118.19 1q0t h LEU 71 Ca -0.00 0.10 0.18 0.00 0.09 0.00 0.00 57.88 58.24 1q0t h LEU 71 Cb 0.52 0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.35 1q0t h LEU 71 CO -0.07 0.07 0.52 0.11 0.09 0.00 0.00 178.44 179.16 1q0t h LYS 72 N 0.35 0.00 0.08 1.13 1.57 -0.86 0.15 116.57 118.99 1q0t h LYS 72 Ca 0.33 0.00 -0.24 0.00 -1.87 0.00 0.00 60.65 58.87 1q0t h LYS 72 Cb 0.46 0.00 0.02 0.00 0.08 0.00 0.00 32.23 32.80 1q0t h LYS 72 CO -0.37 0.00 -0.97 0.28 -0.57 0.00 0.00 179.45 177.82 1q0t h VAL 73 N 0.00 1.37 -0.54 0.50 2.07 -0.82 -1.22 116.25 117.61 1q0t h VAL 73 Ca 0.29 -2.35 -0.00 0.00 0.82 0.00 0.00 66.70 65.46 1q0t h VAL 73 Cb 1.33 2.74 -0.03 0.00 -1.52 0.00 0.00 31.29 33.82 1q0t h VAL 73 CO -0.00 0.70 0.33 0.40 0.02 0.00 0.00 177.57 179.01 1q0t h ILE 74 N 0.05 1.16 0.00 4.57 2.04 -0.43 -1.30 117.51 123.60 1q0t h ILE 74 Ca -0.15 -0.35 -0.12 0.00 1.00 0.00 0.00 64.86 65.24 1q0t h ILE 74 Cb 1.68 0.42 -0.02 0.00 -0.74 0.00 0.00 36.82 38.17 1q0t h ILE 74 CO 0.19 0.16 -0.57 0.11 0.00 0.00 0.00 178.15 178.04 1q0t h LYS 75 N 0.72 0.00 -0.70 2.37 1.79 -1.15 0.50 116.57 120.11 1q0t h LYS 75 Ca 0.19 0.00 -0.04 0.00 -2.18 0.00 0.00 60.65 58.62 1q0t h LYS 75 Cb -0.02 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 30.60 1q0t h LYS 75 CO -0.04 0.57 0.27 0.37 -1.08 0.00 0.00 179.45 179.54 1q0t h GLN 76 N 0.00 1.03 -0.02 3.15 4.15 -0.40 -2.89 115.11 120.14 1q0t h GLN 76 Ca -0.01 -0.18 0.00 0.00 0.77 0.00 0.00 58.65 59.24 1q0t h GLN 76 Cb 1.05 -0.17 0.00 0.00 0.21 0.00 0.00 27.48 28.57 1q0t h GLN 76 CO 0.07 0.84 -0.26 0.66 -1.93 0.00 0.00 178.83 178.22 1q0t n TYR 77 N -4.29 0.00 -3.41 3.99 4.02 -0.57 -4.98 117.16 111.91 1q0t n TYR 77 Ca 0.06 0.00 -0.17 0.00 -0.01 0.00 0.00 57.90 57.78 1q0t n TYR 77 Cb 0.18 0.00 0.09 0.00 -0.02 0.00 0.00 39.34 39.59 1q0t n TYR 77 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48 1q0t n LYS 78 N 0.54 -6.24 -1.92 -0.72 4.01 0.02 -4.80 118.16 109.05 1q0t n LYS 78 Ca 0.11 0.85 -0.31 0.00 -0.51 0.00 0.00 58.31 58.45 1q0t n LYS 78 Cb 0.50 -5.86 0.02 0.00 -0.51 0.00 0.00 35.03 29.18 1q0t n LYS 78 CO 0.00 0.00 0.00 -0.51 -1.11 0.00 0.00 177.40 175.78 1q0t s LEU 79 N -6.27 3.20 0.00 -0.35 1.43 -0.33 -4.83 118.68 111.53 1q0t s LEU 79 Ca 0.04 1.34 -0.22 0.00 -1.03 0.00 0.00 54.13 54.26 1q0t s LEU 79 Cb -0.01 -4.34 0.07 0.00 0.03 0.00 0.00 46.19 41.95 1q0t s LEU 79 CO 0.73 -0.93 1.00 -1.54 0.23 0.00 0.00 176.35 175.83 1q0t n SER 80 N -2.76 -0.82 0.18 2.29 3.41 -1.26 -4.91 113.62 109.75 1q0t n SER 80 Ca 0.06 -1.09 0.15 0.00 -0.26 0.00 0.00 58.87 57.72 1q0t n SER 80 Cb 0.55 1.26 0.75 0.00 -0.26 0.00 0.00 64.21 66.50 1q0t n SER 80 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 1q0t h LYS 81 N 0.00 0.00 0.00 4.33 3.64 -1.91 -3.12 116.57 119.51 1q0t h LYS 81 Ca -0.15 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.23 1q0t h LYS 81 Cb 0.88 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.70 1q0t h LYS 81 CO 0.22 0.00 -0.14 0.25 -2.27 0.00 0.00 179.45 177.51 1q0t n THR 82 N -4.16 0.00 -1.73 1.00 -2.24 -1.26 -3.20 114.28 102.69 1q0t n THR 82 Ca 0.02 -0.43 -0.29 0.00 -2.27 0.00 0.00 64.05 61.07 1q0t n THR 82 Cb 0.29 0.97 -0.04 0.00 -2.10 0.00 0.00 70.33 69.45 1q0t n THR 82 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1q0t s SER 83 N -1.24 4.55 -0.17 3.42 1.04 -1.18 -4.75 113.70 115.37 1q0t s SER 83 Ca 0.01 0.41 -0.13 0.00 0.48 0.00 0.00 55.95 56.71 1q0t s SER 83 Cb 0.01 -2.53 -0.22 0.00 0.10 0.00 0.00 66.02 63.39 1q0t s SER 83 CO 0.08 -3.03 0.25 1.17 0.98 0.00 0.00 173.24 172.68 1q0t n LYS 84 N 8.98 0.66 0.25 4.02 4.81 -1.26 -3.59 118.16 132.03 1q0t n LYS 84 Ca 0.37 0.40 -0.16 0.00 -0.87 0.00 0.00 58.31 58.05 1q0t n LYS 84 Cb 0.50 -1.71 -0.08 0.00 0.02 0.00 0.00 35.03 33.76 1q0t n LYS 84 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 1q0t h GLU 85 N -0.45 -0.57 -0.55 1.64 4.39 -2.00 -2.11 114.58 114.92 1q0t h GLU 85 Ca -0.41 0.04 0.09 0.00 0.34 0.00 0.00 59.36 59.42 1q0t h GLU 85 Cb 1.69 0.13 -0.10 0.00 -0.10 0.00 0.00 28.75 30.37 1q0t h GLU 85 CO -0.07 -0.38 -0.42 0.93 -1.16 0.00 0.00 179.01 177.91 1q0t h GLU 86 N -0.59 -0.23 -0.49 2.33 4.39 -1.87 0.28 114.58 118.40 1q0t h GLU 86 Ca -0.06 0.02 0.10 0.00 0.34 0.00 0.00 59.36 59.76 1q0t h GLU 86 Cb 0.46 0.05 -0.10 0.00 -0.10 0.00 0.00 28.75 29.06 1q0t h GLU 86 CO 0.09 -0.15 -0.22 0.35 -1.16 0.00 0.00 179.01 177.92 1q0t h PHE 87 N -0.24 -0.57 -0.02 4.33 3.57 -1.58 1.24 116.94 123.68 1q0t h PHE 87 Ca 0.18 0.05 0.03 0.00 3.53 0.00 0.00 57.97 61.77 1q0t h PHE 87 Cb 0.56 0.32 -0.05 0.00 2.79 0.00 0.00 35.95 39.58 1q0t h PHE 87 CO -0.68 -0.31 -0.34 -0.07 -2.23 0.00 0.00 178.31 174.68 1q0t h LEU 88 N -0.11 -1.04 -0.41 0.59 3.38 -0.03 0.71 115.31 118.40 1q0t h LEU 88 Ca 0.23 0.13 0.07 0.00 0.09 0.00 0.00 57.88 58.40 1q0t h LEU 88 Cb 0.47 0.42 -0.06 0.00 0.09 0.00 0.00 40.66 41.57 1q0t h LEU 88 CO -0.56 -0.40 0.04 0.50 0.09 0.00 0.00 178.44 178.10 1q0t h LYS 89 N -0.49 0.15 -0.62 1.13 3.64 0.18 1.97 116.57 122.53 1q0t h LYS 89 Ca 0.06 -0.01 0.05 0.00 -1.27 0.00 0.00 60.65 59.49 1q0t h LYS 89 Cb 0.58 -0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 32.32 1q0t h LYS 89 CO -0.29 0.10 0.34 1.25 -2.27 0.00 0.00 179.45 178.58 1q0t h LEU 90 N 0.15 0.50 -0.13 5.20 5.85 0.23 0.41 115.31 127.53 1q0t h LEU 90 Ca 0.20 0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.95 1q0t h LEU 90 Cb 0.27 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.23 1q0t h LEU 90 CO -0.31 0.33 0.06 -0.09 -0.34 0.00 0.00 178.44 178.10 1q0t h ARG 91 N 0.64 0.18 -0.66 1.25 2.43 0.28 -0.88 114.38 117.62 1q0t h ARG 91 Ca 0.27 -0.03 0.13 0.00 -0.81 0.00 0.00 59.98 59.54 1q0t h ARG 91 Cb 0.16 -0.03 -0.13 0.00 -0.42 0.00 0.00 29.97 29.55 1q0t h ARG 91 CO -0.17 0.25 -0.25 1.49 -1.51 0.00 0.00 179.97 179.78 1q0t h GLU 92 N 0.07 -0.07 -0.21 0.20 4.22 0.44 -0.23 114.58 119.00 1q0t h GLU 92 Ca 0.04 0.00 -0.01 0.00 0.08 0.00 0.00 59.36 59.48 1q0t h GLU 92 Cb 0.13 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.38 1q0t h GLU 92 CO -0.01 -0.05 0.09 -0.44 -2.18 0.00 0.00 179.01 176.43 1q0t h ASP 93 N -0.07 0.29 -0.84 1.04 3.32 0.10 -2.61 116.42 117.64 1q0t h ASP 93 Ca 0.29 -0.15 0.02 0.00 0.02 0.00 0.00 57.03 57.21 1q0t h ASP 93 Cb 0.53 -0.07 -0.05 0.00 0.22 0.00 0.00 39.33 39.96 1q0t h ASP 93 CO -0.71 0.36 0.55 0.22 -1.72 0.00 0.00 179.24 177.95 1q0t h TYR 94 N 0.20 1.03 -0.17 4.55 3.20 -0.11 0.14 116.97 125.81 1q0t h TYR 94 Ca 0.07 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 61.97 1q0t h TYR 94 Cb 0.16 -0.35 -0.01 0.00 1.54 0.00 0.00 36.73 38.08 1q0t h TYR 94 CO -0.01 0.62 0.10 -0.91 -1.64 0.00 0.00 178.16 176.32 1q0t h ASN 95 N 1.08 0.20 0.52 -2.11 2.35 -0.91 0.46 115.58 117.16 1q0t h ASN 95 Ca 0.32 -0.03 -0.03 0.00 -0.55 0.00 0.00 56.30 56.01 1q0t h ASN 95 Cb -0.03 -0.05 0.01 0.00 0.05 0.00 0.00 38.32 38.29 1q0t h ASN 95 CO -0.09 0.17 -0.25 0.11 -1.65 0.00 0.00 177.43 175.73 1q0t h LYS 96 N 0.20 -0.67 0.00 0.81 1.79 -0.95 -3.34 116.57 114.42 1q0t h LYS 96 Ca 0.06 0.05 -0.07 0.00 -2.18 0.00 0.00 60.65 58.51 1q0t h LYS 96 Cb 0.01 0.15 -0.01 0.00 -1.58 0.00 0.00 32.23 30.80 1q0t h LYS 96 CO -0.01 -0.38 -0.32 1.79 -1.08 0.00 0.00 179.45 179.45 1q0t h THR 97 N -1.08 0.56 -6.26 -0.16 1.35 -0.84 -3.48 112.91 103.01 1q0t h THR 97 Ca -0.07 -1.75 -0.46 0.00 -0.55 0.00 0.00 66.41 63.57 1q0t h THR 97 Cb 0.60 2.24 -0.02 0.00 -1.73 0.00 0.00 68.15 69.25 1q0t h THR 97 CO 0.12 0.32 -0.77 0.54 -0.25 0.00 0.00 175.52 175.47 1q0t n ARG 98 N -3.19 -5.45 -2.94 4.72 5.12 0.16 -4.94 116.66 110.14 1q0t n ARG 98 Ca 0.02 0.60 -0.41 0.00 -1.93 0.00 0.00 57.85 56.14 1q0t n ARG 98 Cb 0.65 -5.43 -0.05 0.00 -1.16 0.00 0.00 32.46 26.47 1q0t n ARG 98 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 1q0t s ASP 99 N -3.52 6.81 0.17 0.55 -1.08 -1.26 -4.96 116.67 113.37 1q0t s ASP 99 Ca 0.53 1.00 -0.25 0.00 -0.52 0.00 0.00 52.55 53.31 1q0t s ASP 99 Cb -0.27 -2.42 0.04 0.00 -1.46 0.00 0.00 42.92 38.82 1q0t s ASP 99 CO 0.83 -0.46 1.58 -0.65 0.52 0.00 0.00 175.17 176.98 1q0t h PRO 100 N 7.64 -0.25 -0.95 4.34 0.11 -1.92 -0.38 132.00 140.59 1q0t h PRO 100 Ca -0.25 0.02 0.26 0.00 0.11 0.00 0.00 66.00 66.14 1q0t h PRO 100 Cb 1.11 0.06 -0.14 0.00 0.11 0.00 0.00 31.00 32.14 1q0t h PRO 100 CO 0.85 -0.17 0.45 1.25 -0.21 0.00 0.00 178.00 180.17 1q0t h LEU 101 N -0.26 0.37 0.04 2.35 5.85 -1.93 0.64 115.31 122.37 1q0t h LEU 101 Ca 0.17 0.17 0.01 0.00 0.84 0.00 0.00 57.88 59.08 1q0t h LEU 101 Cb 0.57 0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.73 1q0t h LEU 101 CO -0.63 -0.07 -0.12 -0.07 -0.34 0.00 0.00 178.44 177.22 1q0t h LEU 102 N 0.36 -0.33 -0.69 2.25 3.38 -1.48 0.17 115.31 118.97 1q0t h LEU 102 Ca 0.63 0.04 0.09 0.00 0.09 0.00 0.00 57.88 58.74 1q0t h LEU 102 Cb 1.30 0.13 -0.07 0.00 0.09 0.00 0.00 40.66 42.11 1q0t h LEU 102 CO -0.58 -0.17 0.33 0.25 0.09 0.00 0.00 178.44 178.36 1q0t h LEU 103 N -0.22 0.42 0.36 1.67 5.85 0.43 0.66 115.31 124.49 1q0t h LEU 103 Ca 0.03 0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.81 1q0t h LEU 103 Cb 0.25 -0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.26 1q0t h LEU 103 CO -0.09 0.24 -0.29 0.22 -0.34 0.00 0.00 178.44 178.18 1q0t h TYR 104 N 0.57 -0.77 -0.79 1.25 3.20 0.66 -0.94 116.97 120.15 1q0t h TYR 104 Ca 0.34 -0.00 0.08 0.00 3.14 0.00 0.00 58.73 62.29 1q0t h TYR 104 Cb 0.37 0.29 -0.05 0.00 1.54 0.00 0.00 36.73 38.88 1q0t h TYR 104 CO -0.12 -0.43 0.52 0.28 -1.64 0.00 0.00 178.16 176.77 1q0t h VAL 105 N -0.65 1.01 0.00 1.81 2.07 0.02 -3.21 116.25 117.29 1q0t h VAL 105 Ca -0.03 -0.28 0.00 0.00 0.82 0.00 0.00 66.70 67.21 1q0t h VAL 105 Cb 0.57 0.13 0.00 0.00 -1.52 0.00 0.00 31.29 30.47 1q0t h VAL 105 CO -0.01 0.15 0.00 0.18 0.02 0.00 0.00 177.57 177.91 1q0t n LEU 106 N -4.49 0.00 -0.29 2.57 4.77 0.22 -3.29 117.00 116.49 1q0t n LEU 106 Ca 0.12 0.66 0.28 0.00 -0.03 0.00 0.00 56.01 57.04 1q0t n LEU 106 Cb 0.25 -0.16 0.50 0.00 -2.33 0.00 0.00 43.42 41.68 1q0t n LEU 106 CO 0.33 -0.16 0.89 0.00 -1.33 0.00 0.00 177.39 177.12 1q0t n HIS 107 N -1.24 0.83 0.18 -1.77 1.44 -0.78 0.11 115.22 114.00 1q0t n HIS 107 Ca 0.00 0.84 0.18 0.00 -2.01 0.00 0.00 57.72 56.73 1q0t n HIS 107 Cb 0.00 -1.26 0.73 0.00 0.12 0.00 0.00 29.99 29.58 1q0t n HIS 107 CO 0.00 0.00 0.00 0.74 -2.81 0.00 0.00 176.34 174.27 1q0t h PHE 108 N 0.00 0.00 -0.00 -1.40 0.05 -1.65 -0.09 116.94 113.84 1q0t h PHE 108 Ca 0.69 0.00 0.00 0.00 3.82 0.00 0.00 57.97 62.48 1q0t h PHE 108 Cb 1.95 0.00 0.00 0.00 2.00 0.00 0.00 35.95 39.90 1q0t h PHE 108 CO -0.01 0.00 -0.57 0.72 -0.18 0.00 0.00 178.31 178.28 1q0t n HIS 109 N -3.33 0.00 -1.49 -0.55 8.25 0.30 -3.83 115.22 114.56 1q0t n HIS 109 Ca 0.04 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 57.19 1q0t n HIS 109 Cb 0.58 0.00 0.06 0.00 1.12 0.00 0.00 29.99 31.76 1q0t n HIS 109 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 1q0t s GLY 110 N -2.19 1.67 -0.53 -1.41 0.00 -0.05 0.39 107.32 105.20 1q0t s GLY 110 Ca 0.07 0.12 -0.28 0.00 0.00 0.00 0.00 44.72 44.64 1q0t s GLY 110 CO 0.52 0.45 2.43 0.33 0.00 0.00 0.00 173.10 176.83 1q0t n PHE 111 N -3.24 1.36 -2.00 1.90 7.35 0.28 -0.67 117.46 122.44 1q0t n PHE 111 Ca 0.08 0.15 -0.05 0.00 -0.76 0.00 0.00 57.45 56.87 1q0t n PHE 111 Cb 0.53 -2.60 -0.00 0.00 0.35 0.00 0.00 39.48 37.76 1q0t n PHE 111 CO 0.00 0.00 0.00 0.43 -0.76 0.00 0.00 176.76 176.43 1q0t n SER 112 N 14.30 -2.29 -1.43 -2.13 7.64 -1.26 -3.42 113.62 125.03 1q0t n SER 112 Ca 0.41 0.01 -0.14 0.00 1.01 0.00 0.00 58.87 60.15 1q0t n SER 112 Cb 0.44 -1.53 -0.06 0.00 -1.01 0.00 0.00 64.21 62.05 1q0t n SER 112 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1q0t n ASN 113 N 1.09 -3.80 -4.66 6.43 3.02 0.16 -4.90 115.26 112.59 1q0t n ASN 113 Ca -0.06 0.36 -0.41 0.00 -0.03 0.00 0.00 54.58 54.44 1q0t n ASN 113 Cb 0.51 -3.51 -0.05 0.00 -0.61 0.00 0.00 39.78 36.11 1q0t n ASN 113 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1q0t s MET 114 N -3.24 4.22 -0.24 3.52 -1.94 -1.22 -4.81 119.30 115.59 1q0t s MET 114 Ca 0.00 0.73 -0.26 0.00 -1.71 0.00 0.00 55.69 54.45 1q0t s MET 114 Cb 0.00 -3.59 -0.00 0.00 2.01 0.00 0.00 34.83 33.25 1q0t s MET 114 CO 0.00 -0.31 0.88 0.42 -0.01 0.00 0.00 175.02 176.00 1q0t s ILE 115 N 2.13 4.80 -0.31 2.53 1.01 -1.26 -4.72 121.20 125.38 1q0t s ILE 115 Ca 0.31 1.67 0.00 0.00 0.00 0.00 0.00 60.65 62.64 1q0t s ILE 115 Cb -0.16 -4.16 0.10 0.00 0.01 0.00 0.00 42.46 38.25 1q0t s ILE 115 CO 0.10 -0.10 0.08 -0.13 0.00 0.00 0.00 174.94 174.89 1q0t s ARG 116 N 2.93 0.93 -0.33 2.79 1.81 -1.26 -5.04 118.95 120.78 1q0t s ARG 116 Ca 0.37 -1.25 -0.12 0.00 -1.72 0.00 0.00 55.73 53.01 1q0t s ARG 116 Cb -0.15 -2.31 -0.02 0.00 -0.45 0.00 0.00 34.95 32.02 1q0t s ARG 116 CO 0.07 -0.95 0.22 0.42 -0.68 0.00 0.00 175.30 174.38 1q0t s ILE 117 N 1.44 5.14 0.46 1.52 -1.09 -1.26 -1.27 121.20 126.15 1q0t s ILE 117 Ca 0.09 -0.25 -0.08 0.00 -2.23 0.00 0.00 60.65 58.19 1q0t s ILE 117 Cb -0.18 -3.63 0.11 0.00 -1.58 0.00 0.00 42.46 37.18 1q0t s ILE 117 CO -0.20 0.01 0.47 -0.46 -1.23 0.00 0.00 174.94 173.53 1q0t n ASN 118 N 5.08 -1.03 0.00 3.58 0.23 -0.25 -4.89 115.26 117.99 1q0t n ASN 118 Ca -0.13 -0.89 0.04 0.00 -0.53 0.00 0.00 54.58 53.08 1q0t n ASN 118 Cb 0.50 -0.40 0.26 0.00 -2.08 0.00 0.00 39.78 38.05 1q0t n ASN 118 CO 0.00 0.00 0.00 -0.90 -0.93 0.00 0.00 177.26 175.43 1q0t n ASP 119 N -3.64 0.00 -0.03 0.53 5.68 -1.26 -2.76 116.55 115.07 1q0t n ASP 119 Ca 0.06 -1.17 0.04 0.00 -0.50 0.00 0.00 54.79 53.22 1q0t n ASP 119 Cb 0.23 0.00 0.05 0.00 -1.14 0.00 0.00 41.12 40.27 1q0t n ASP 119 CO 0.00 0.00 0.00 1.17 -1.33 0.00 0.00 177.20 177.04 1q0t n LYS 120 N -0.69 2.28 -0.52 0.11 4.81 -1.26 -4.97 118.16 117.91 1q0t n LYS 120 Ca 0.07 -1.89 0.00 0.00 -0.87 0.00 0.00 58.31 55.62 1q0t n LYS 120 Cb 0.03 -1.18 0.00 0.00 0.02 0.00 0.00 35.03 33.90 1q0t n LYS 120 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1q0t n GLY 121 N -0.84 1.61 3.82 3.14 0.00 -1.11 -5.03 105.19 106.78 1q0t n GLY 121 Ca 0.06 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.73 1q0t n GLY 121 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1q0t s ASN 122 N -3.30 6.99 -0.28 1.61 0.01 -1.26 -4.82 114.94 113.88 1q0t s ASN 122 Ca 0.00 1.35 -0.24 0.00 -0.71 0.00 0.00 52.86 53.26 1q0t s ASN 122 Cb 0.00 -2.39 -0.00 0.00 0.41 0.00 0.00 41.25 39.26 1q0t s ASN 122 CO 0.00 0.01 0.80 0.12 -1.51 0.00 0.00 177.10 176.52 1q0t s PHE 123 N -1.57 3.24 -0.44 2.20 5.36 -1.26 -1.09 117.98 124.41 1q0t s PHE 123 Ca 0.44 0.93 0.12 0.00 -0.96 0.00 0.00 56.93 57.45 1q0t s PHE 123 Cb -0.16 -3.15 -0.15 0.00 -0.34 0.00 0.00 43.02 39.23 1q0t s PHE 123 CO 0.20 -0.50 0.46 0.25 -1.46 0.00 0.00 175.22 174.17 1q0t n THR 124 N 5.43 0.00 -1.57 0.12 -2.24 -0.40 -5.00 114.28 110.62 1q0t n THR 124 Ca 0.04 -0.23 -0.49 0.00 -2.27 0.00 0.00 64.05 61.10 1q0t n THR 124 Cb 0.48 0.82 -0.04 0.00 -2.10 0.00 0.00 70.33 69.49 1q0t n THR 124 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1q0t n THR 125 N -1.43 0.94 -1.90 4.28 -1.04 -1.26 -4.94 114.28 108.93 1q0t n THR 125 Ca 0.01 -0.24 -0.30 0.00 -2.04 0.00 0.00 64.05 61.49 1q0t n THR 125 Cb 0.22 -0.79 0.06 0.00 -1.82 0.00 0.00 70.33 67.99 1q0t n THR 125 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 1q0t s PRO 126 N -0.43 2.58 0.21 -2.82 0.02 -1.26 -4.76 135.00 128.53 1q0t s PRO 126 Ca 0.73 0.34 -0.32 0.00 0.02 0.00 0.00 61.00 61.76 1q0t s PRO 126 Cb -0.86 -2.01 -0.13 0.00 0.02 0.00 0.00 34.50 31.52 1q0t s PRO 126 CO 0.53 -1.20 1.56 0.34 -0.33 0.00 0.00 177.00 177.89 1q0t n PHE 127 N -3.09 2.43 1.16 6.54 7.35 -1.26 0.10 117.46 130.69 1q0t n PHE 127 Ca 0.07 0.27 0.11 0.00 -0.76 0.00 0.00 57.45 57.14 1q0t n PHE 127 Cb 0.58 -2.55 0.36 0.00 0.35 0.00 0.00 39.48 38.22 1q0t n PHE 127 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1q0t n GLY 128 N 2.95 0.39 3.87 7.13 0.00 0.16 -4.17 105.19 115.52 1q0t n GLY 128 Ca 0.14 -0.44 -0.24 0.00 0.00 0.00 0.00 46.02 45.47 1q0t n GLY 128 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1q0t n LYS 129 N 0.41 -3.86 -1.44 1.61 5.02 -1.26 -4.72 118.16 113.92 1q0t n LYS 129 Ca 0.16 0.48 -0.01 0.00 -2.02 0.00 0.00 58.31 56.93 1q0t n LYS 129 Cb 0.35 -4.77 -0.00 0.00 -0.02 0.00 0.00 35.03 30.60 1q0t n LYS 129 CO 0.00 0.00 0.00 2.89 -0.52 0.00 0.00 177.40 179.77 1q0t n ARG 130 N -4.36 0.05 0.00 1.97 1.85 -1.19 -4.85 116.66 110.13 1q0t n ARG 130 Ca -0.30 -0.14 0.00 0.00 -1.00 0.00 0.00 57.85 56.41 1q0t n ARG 130 Cb 0.68 0.15 0.00 0.00 -1.05 0.00 0.00 32.46 32.24 1q0t n ARG 130 CO 0.00 0.00 0.00 -2.37 -0.01 0.00 0.00 177.63 175.25 1q0t n THR 131 N -0.03 0.00 -3.20 8.89 5.66 -1.25 -3.94 114.28 120.41 1q0t n THR 131 Ca -0.00 0.00 -0.39 0.00 -3.05 0.00 0.00 64.05 60.61 1q0t n THR 131 Cb 0.03 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 68.76 1q0t n THR 131 CO 0.00 0.00 0.00 0.27 -3.05 0.00 0.00 175.07 172.29 1q0t s ILE 132 N -1.49 4.82 0.00 1.09 -4.36 -1.26 -4.74 121.20 115.26 1q0t s ILE 132 Ca 0.00 1.29 0.00 0.00 -0.26 0.00 0.00 60.65 61.68 1q0t s ILE 132 Cb 0.00 -3.95 0.00 0.00 1.25 0.00 0.00 42.46 39.76 1q0t s ILE 132 CO 0.00 0.46 0.00 -0.46 0.24 0.00 0.00 174.94 175.18 1q0t n ASN 133 N 2.39 0.20 -0.03 4.36 0.23 -1.26 -4.99 115.26 116.16 1q0t n ASN 133 Ca -0.07 0.00 -0.14 0.00 -0.53 0.00 0.00 54.58 53.84 1q0t n ASN 133 Cb 0.51 0.00 -0.10 0.00 -2.08 0.00 0.00 39.78 38.11 1q0t n ASN 133 CO 0.00 0.00 0.00 0.11 -0.93 0.00 0.00 177.26 176.44 1q0t h LYS 134 N 0.00 0.11 0.00 -3.83 1.57 -2.03 -3.23 116.57 109.17 1q0t h LYS 134 Ca 0.00 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 1q0t h LYS 134 Cb 0.00 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.32 1q0t h LYS 134 CO 0.00 0.71 0.00 -0.91 -0.57 0.00 0.00 179.45 178.68 1q0t h ASN 135 N -0.47 0.00 0.18 0.86 2.35 -1.99 -2.88 115.58 113.64 1q0t h ASN 135 Ca -0.00 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.74 1q0t h ASN 135 Cb 0.72 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.09 1q0t h ASN 135 CO 0.02 0.00 -0.09 0.28 -1.65 0.00 0.00 177.43 175.99 1q0t h SER 136 N 0.00 -0.20 -0.34 5.81 0.02 -1.94 0.13 113.55 117.03 1q0t h SER 136 Ca 0.00 -0.12 -0.17 0.00 -0.84 0.00 0.00 61.79 60.66 1q0t h SER 136 Cb 0.19 0.05 -0.00 0.00 0.14 0.00 0.00 62.40 62.78 1q0t h SER 136 CO 0.00 -0.00 -0.46 -0.08 -1.14 0.00 0.00 176.83 175.15 1q0t h GLU 137 N -0.40 0.91 0.17 3.45 4.81 -1.66 -2.21 114.58 119.65 1q0t h GLU 137 Ca -0.02 -0.52 -0.01 0.00 -0.13 0.00 0.00 59.36 58.67 1q0t h GLU 137 Cb 0.31 0.04 -0.00 0.00 0.63 0.00 0.00 28.75 29.73 1q0t h GLU 137 CO 0.04 1.17 -0.09 -0.22 -0.73 0.00 0.00 179.01 179.18 1q0t h LYS 138 N 0.71 -0.24 0.09 1.92 3.64 -1.52 0.89 116.57 122.06 1q0t h LYS 138 Ca 0.04 0.02 0.02 0.00 -1.27 0.00 0.00 60.65 59.46 1q0t h LYS 138 Cb 1.06 0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 32.90 1q0t h LYS 138 CO 0.11 -0.16 -0.26 1.96 -2.27 0.00 0.00 179.45 178.83 1q0t h GLN 139 N -0.25 -0.43 -0.50 1.90 4.20 -0.74 -2.28 115.11 117.00 1q0t h GLN 139 Ca -0.02 0.03 0.09 0.00 0.06 0.00 0.00 58.65 58.81 1q0t h GLN 139 Cb 0.20 0.10 -0.10 0.00 0.30 0.00 0.00 27.48 27.98 1q0t h GLN 139 CO 0.03 -0.29 -0.37 -0.92 -0.67 0.00 0.00 178.83 176.61 1q0t h TYR 140 N -0.45 -1.05 -0.36 2.96 3.20 -1.14 -2.06 116.97 118.07 1q0t h TYR 140 Ca 0.04 0.07 0.07 0.00 3.14 0.00 0.00 58.73 62.05 1q0t h TYR 140 Cb 0.49 0.53 -0.07 0.00 1.54 0.00 0.00 36.73 39.22 1q0t h TYR 140 CO -0.25 -0.40 -0.13 -0.91 -1.64 0.00 0.00 178.16 174.83 1q0t h ASN 141 N -0.23 -0.45 -0.36 -2.11 -0.26 -0.44 -1.98 115.58 109.75 1q0t h ASN 141 Ca 0.19 0.12 0.07 0.00 -0.56 0.00 0.00 56.30 56.12 1q0t h ASN 141 Cb 0.56 0.27 -0.09 0.00 -1.06 0.00 0.00 38.32 38.00 1q0t h ASN 141 CO -0.63 -0.16 -0.36 -0.74 -1.06 0.00 0.00 177.43 174.48 1q0t h HIS 142 N -0.05 -1.02 -0.04 1.19 2.76 -0.82 0.16 115.15 117.33 1q0t h HIS 142 Ca 0.18 0.06 0.03 0.00 -2.20 0.00 0.00 60.37 58.43 1q0t h HIS 142 Cb 0.32 0.50 -0.06 0.00 1.55 0.00 0.00 27.41 29.72 1q0t h HIS 142 CO -0.36 -0.41 -0.50 0.35 -1.30 0.00 0.00 177.93 175.71 1q0t h PHE 143 N -0.30 -1.47 -0.55 5.26 3.57 -1.08 -0.53 116.94 121.83 1q0t h PHE 143 Ca 0.15 0.05 0.07 0.00 3.53 0.00 0.00 57.97 61.77 1q0t h PHE 143 Cb 0.56 0.65 -0.10 0.00 2.79 0.00 0.00 35.95 39.85 1q0t h PHE 143 CO -0.55 -0.55 -0.50 0.87 -2.23 0.00 0.00 178.31 175.36 1q0t h LYS 144 N -0.62 -0.26 0.00 1.11 1.79 -0.45 1.15 116.57 119.28 1q0t h LYS 144 Ca 0.03 0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.52 1q0t h LYS 144 Cb 0.70 0.06 0.00 0.00 -1.58 0.00 0.00 32.23 31.41 1q0t h LYS 144 CO -0.37 -0.18 0.00 0.00 -1.08 0.00 0.00 179.45 177.82 1q0t n GLN 145 N -5.38 0.34 0.00 3.15 10.64 0.44 -3.30 117.38 123.27 1q0t n GLN 145 Ca -0.00 0.05 0.00 0.00 -1.83 0.00 0.00 57.00 55.21 1q0t n GLN 145 Cb 0.34 -1.50 0.00 0.00 -0.86 0.00 0.00 30.24 28.22 1q0t n GLN 145 CO 0.00 0.00 0.00 0.09 -1.83 0.00 0.00 177.06 175.32 1q0t n ASN 146 N -1.08 0.07 0.23 2.61 3.02 0.47 -4.85 115.26 115.72 1q0t n ASN 146 Ca 0.09 -1.01 0.11 0.00 -0.03 0.00 0.00 54.58 53.73 1q0t n ASN 146 Cb 0.06 0.00 0.45 0.00 -0.61 0.00 0.00 39.78 39.68 1q0t n ASN 146 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1q0t h ASP 148 N 0.00 -1.13 0.20 0.00 3.04 -1.82 -0.76 116.42 115.94 1q0t h ASP 148 Ca -0.00 0.19 0.00 0.00 -3.24 0.00 0.00 57.03 53.98 1q0t h ASP 148 Cb 0.76 0.52 0.00 0.00 -1.04 0.00 0.00 39.33 39.57 1q0t h ASP 148 CO 0.03 -0.33 0.00 2.29 -2.04 0.00 0.00 179.24 179.19 1q0t n LYS 149 N -5.42 0.09 -3.44 4.15 2.85 -1.25 -4.74 118.16 110.40 1q0t n LYS 149 Ca 0.01 0.51 -0.34 0.00 -1.05 0.00 0.00 58.31 57.43 1q0t n LYS 149 Cb 0.34 -1.74 -0.06 0.00 -0.65 0.00 0.00 35.03 32.92 1q0t n LYS 149 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 177.40 177.77 1q0t s ILE 150 N -3.27 4.94 -0.22 0.58 1.01 -0.29 -1.70 121.20 122.25 1q0t s ILE 150 Ca 0.01 0.64 0.00 0.00 0.00 0.00 0.00 60.65 61.31 1q0t s ILE 150 Cb 0.05 -3.69 0.06 0.00 0.01 0.00 0.00 42.46 38.89 1q0t s ILE 150 CO 0.18 0.20 -0.06 -0.63 0.00 0.00 0.00 174.94 174.64 1q0t s ILE 151 N -1.50 1.47 0.52 2.92 1.01 0.28 -4.96 121.20 120.94 1q0t s ILE 151 Ca 0.38 -1.12 -0.06 0.00 0.00 0.00 0.00 60.65 59.84 1q0t s ILE 151 Cb -0.14 -1.71 -0.03 0.00 0.01 0.00 0.00 42.46 40.58 1q0t s ILE 151 CO 0.19 -0.06 0.85 -0.36 0.00 0.00 0.00 174.94 175.56 1q0t s PHE 152 N 1.43 3.55 -0.22 3.97 0.40 -1.26 -1.52 117.98 124.34 1q0t s PHE 152 Ca -0.05 0.90 -0.22 0.00 -0.60 0.00 0.00 56.93 56.96 1q0t s PHE 152 Cb -0.18 -2.43 0.06 0.00 0.51 0.00 0.00 43.02 40.98 1q0t s PHE 152 CO -0.07 -0.41 0.63 -1.54 0.70 0.00 0.00 175.22 174.53 1q0t s SER 153 N -4.14 -0.65 -0.45 1.36 1.04 -0.64 -4.92 113.70 105.31 1q0t s SER 153 Ca 0.49 1.20 0.04 0.00 0.48 0.00 0.00 55.95 58.16 1q0t s SER 153 Cb -0.10 1.20 0.50 0.00 0.10 0.00 0.00 66.02 67.72 1q0t s SER 153 CO 0.47 -0.26 1.68 -1.54 0.98 0.00 0.00 173.24 174.57 1q0t n SER 154 N 2.55 5.05 -4.90 7.02 3.41 -1.26 -2.47 113.62 123.02 1q0t n SER 154 Ca -0.14 -3.75 -0.28 0.00 -0.26 0.00 0.00 58.87 54.43 1q0t n SER 154 Cb 0.56 -0.72 -0.02 0.00 -0.26 0.00 0.00 64.21 63.76 1q0t n SER 154 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1q0t s LEU 155 N -3.54 3.87 -0.16 1.04 1.43 -1.25 -4.59 118.68 115.48 1q0t s LEU 155 Ca 0.55 0.88 -0.23 0.00 -1.03 0.00 0.00 54.13 54.30 1q0t s LEU 155 Cb 0.46 -3.75 -0.02 0.00 0.03 0.00 0.00 46.19 42.90 1q0t s LEU 155 CO 0.02 -0.37 0.71 -2.28 0.23 0.00 0.00 176.35 174.67 1q0t s HIS 156 N -2.37 3.43 0.37 0.29 5.65 -1.26 -3.55 115.29 117.85 1q0t s HIS 156 Ca 0.47 1.11 0.32 0.00 0.25 0.00 0.00 55.06 57.21 1q0t s HIS 156 Cb -0.10 -2.87 1.16 0.00 -1.18 0.00 0.00 32.58 29.59 1q0t s HIS 156 CO 0.35 -0.14 1.08 1.97 -0.65 0.00 0.00 174.74 177.35 1q0t n PHE 157 N 4.82 0.11 -0.03 3.88 1.16 -1.26 -0.74 117.46 125.40 1q0t n PHE 157 Ca 0.01 0.11 -0.12 0.00 -1.87 0.00 0.00 57.45 55.57 1q0t n PHE 157 Cb 0.50 -0.46 -0.08 0.00 -1.61 0.00 0.00 39.48 37.83 1q0t n PHE 157 CO 0.00 0.00 0.00 -0.22 -1.87 0.00 0.00 176.76 174.67 1q0t h LYS 158 N 0.00 -0.42 -3.01 3.97 3.64 -2.00 -3.20 116.57 115.55 1q0t h LYS 158 Ca 0.64 0.03 -0.79 0.00 -1.27 0.00 0.00 60.65 59.26 1q0t h LYS 158 Cb 2.47 0.09 -0.30 0.00 -0.41 0.00 0.00 32.23 34.09 1q0t h LYS 158 CO -0.08 -0.28 0.56 -0.40 -2.27 0.00 0.00 179.45 176.99 1q0t n ASP 159 N -4.84 5.92 -3.76 4.20 5.75 0.08 -4.94 116.55 118.96 1q0t n ASP 159 Ca -0.04 -3.33 -0.29 0.00 -0.01 0.00 0.00 54.79 51.12 1q0t n ASP 159 Cb 0.29 -1.23 -0.16 0.00 -1.03 0.00 0.00 41.12 38.99 1q0t n ASP 159 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1q0t s VAL 160 N -2.39 0.74 -0.18 2.12 1.01 -1.21 -4.71 120.40 115.78 1q0t s VAL 160 Ca 0.32 -0.84 -0.31 0.00 0.00 0.00 0.00 61.98 61.15 1q0t s VAL 160 Cb 0.02 -1.28 -0.08 0.00 0.00 0.00 0.00 36.38 35.04 1q0t s VAL 160 CO 0.05 -0.30 2.13 0.29 0.00 0.00 0.00 175.10 177.27 1q0t n LYS 161 N 4.95 1.97 -3.22 2.72 5.02 -1.26 -4.90 118.16 123.44 1q0t n LYS 161 Ca -0.08 0.61 -0.45 0.00 -2.02 0.00 0.00 58.31 56.37 1q0t n LYS 161 Cb 0.45 -2.98 -0.05 0.00 -0.02 0.00 0.00 35.03 32.44 1q0t n LYS 161 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1q0t s ILE 162 N 6.93 5.04 -0.62 -0.18 -1.09 -1.26 -5.02 121.20 125.00 1q0t s ILE 162 Ca 0.99 -1.31 -0.24 0.00 -2.23 0.00 0.00 60.65 57.86 1q0t s ILE 162 Cb -0.50 -4.42 0.05 0.00 -1.58 0.00 0.00 42.46 36.01 1q0t s ILE 162 CO 0.41 -1.00 1.03 -0.76 -1.23 0.00 0.00 174.94 173.39 1q0t s LEU 163 N 2.05 3.98 0.00 2.97 1.02 -1.26 -4.98 118.68 122.46 1q0t s LEU 163 Ca 0.07 -0.55 0.00 0.00 0.02 0.00 0.00 54.13 53.68 1q0t s LEU 163 Cb -0.27 -2.67 0.00 0.00 0.02 0.00 0.00 46.19 43.27 1q0t s LEU 163 CO 0.04 -1.43 0.00 -0.90 0.02 0.00 0.00 176.35 174.08 1q0t n ASP 164 N 7.96 0.00 -0.79 2.29 5.75 -1.26 -3.70 116.55 126.80 1q0t n ASP 164 Ca 0.01 0.00 -0.09 0.00 -0.01 0.00 0.00 54.79 54.70 1q0t n ASP 164 Cb 0.47 0.00 -0.02 0.00 -1.03 0.00 0.00 41.12 40.54 1q0t n ASP 164 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1q0t n GLY 165 N 0.00 0.64 3.23 6.12 0.00 -1.26 -4.86 105.19 109.06 1q0t n GLY 165 Ca 0.00 -0.60 -0.28 0.00 0.00 0.00 0.00 46.02 45.14 1q0t n GLY 165 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1q0t s ASP 166 N -2.79 2.59 0.11 1.61 -4.77 -1.24 0.17 116.67 112.35 1q0t s ASP 166 Ca 0.00 -0.41 -0.24 0.00 -3.30 0.00 0.00 52.55 48.61 1q0t s ASP 166 Cb 0.00 -0.38 -0.07 0.00 -1.09 0.00 0.00 42.92 41.38 1q0t s ASP 166 CO 0.00 0.26 0.72 0.12 0.70 0.00 0.00 175.17 176.97 1q0t s PHE 167 N -0.42 3.84 -0.71 2.11 5.36 -0.92 -4.51 117.98 122.73 1q0t s PHE 167 Ca 0.06 1.50 0.04 0.00 -0.96 0.00 0.00 56.93 57.57 1q0t s PHE 167 Cb -0.09 -2.71 0.21 0.00 -0.34 0.00 0.00 43.02 40.08 1q0t s PHE 167 CO -0.00 0.47 0.66 0.28 -1.46 0.00 0.00 175.22 175.17 1q0t n VAL 168 N 1.97 2.20 -1.86 3.12 0.31 -1.21 -0.65 118.33 122.21 1q0t n VAL 168 Ca -0.06 -5.08 -0.42 0.00 -0.01 0.00 0.00 64.34 58.77 1q0t n VAL 168 Cb 0.50 -2.17 -0.03 0.00 -0.91 0.00 0.00 33.84 31.23 1q0t n VAL 168 CO 0.00 0.00 0.00 -0.47 -1.32 0.00 0.00 176.83 175.04 1q0t s TYR 169 N -1.93 2.96 -0.23 3.52 5.04 -1.19 -3.31 117.35 122.22 1q0t s TYR 169 Ca 0.31 0.64 -0.03 0.00 -2.44 0.00 0.00 57.07 55.55 1q0t s TYR 169 Cb 0.04 -4.00 0.07 0.00 0.35 0.00 0.00 41.96 38.42 1q0t s TYR 169 CO -0.09 -3.59 0.06 0.54 -1.34 0.00 0.00 175.55 171.13 1q0t s VAL 170 N 0.77 0.51 -0.87 3.14 0.11 -0.62 -2.18 120.40 121.26 1q0t s VAL 170 Ca 0.69 -0.74 -0.00 0.00 -2.93 0.00 0.00 61.98 58.99 1q0t s VAL 170 Cb -0.46 -1.14 0.24 0.00 -1.53 0.00 0.00 36.38 33.49 1q0t s VAL 170 CO 0.36 -0.37 0.88 -0.67 -3.33 0.00 0.00 175.10 171.98 1q0t n ASP 171 N 5.04 4.42 -4.79 3.54 4.64 -1.26 -2.85 116.55 125.29 1q0t n ASP 171 Ca -0.07 -3.25 -0.29 0.00 -1.38 0.00 0.00 54.79 49.80 1q0t n ASP 171 Cb 0.46 -1.00 0.13 0.00 -1.04 0.00 0.00 41.12 39.67 1q0t n ASP 171 CO 0.00 0.00 0.00 -2.16 -0.82 0.00 0.00 177.20 174.22 1q0t s PRO 172 N -1.85 1.19 0.19 -0.67 0.04 -1.26 -4.78 135.00 127.86 1q0t s PRO 172 Ca 0.31 0.30 -0.33 0.00 0.04 0.00 0.00 61.00 61.32 1q0t s PRO 172 Cb -0.00 -1.84 -0.13 0.00 0.04 0.00 0.00 34.50 32.56 1q0t s PRO 172 CO -0.07 -2.17 1.67 -2.30 0.04 0.00 0.00 177.00 174.17 1q0t n PRO 173 N -3.75 2.53 -2.20 0.56 -0.02 -1.26 -4.86 135.00 126.00 1q0t n PRO 173 Ca 0.07 0.91 -0.43 0.00 -2.02 0.00 0.00 63.50 62.03 1q0t n PRO 173 Cb 0.59 -2.73 -0.02 0.00 -0.02 0.00 0.00 33.50 31.32 1q0t n PRO 173 CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 1q0t s TYR 174 N 1.11 2.26 0.23 6.00 1.51 -1.26 -4.88 117.35 122.33 1q0t s TYR 174 Ca 0.77 0.63 -0.08 0.00 -1.01 0.00 0.00 57.07 57.37 1q0t s TYR 174 Cb -0.58 -3.95 0.39 0.00 -0.11 0.00 0.00 41.96 37.71 1q0t s TYR 174 CO 0.35 -2.62 1.65 1.25 -1.11 0.00 0.00 175.55 175.06 1q0t h LEU 175 N 11.40 -0.28 -3.83 -1.29 6.46 -1.92 -0.88 115.31 124.98 1q0t h LEU 175 Ca -0.32 0.17 -0.48 0.00 -0.12 0.00 0.00 57.88 57.14 1q0t h LEU 175 Cb 1.14 0.30 -0.20 0.00 -0.73 0.00 0.00 40.66 41.17 1q0t h LEU 175 CO 1.01 -0.14 0.59 2.30 -0.62 0.00 0.00 178.44 181.58 1q0t n ILE 176 N -5.30 3.15 -3.80 4.05 -5.35 -1.26 -4.91 119.36 105.94 1q0t n ILE 176 Ca 0.12 -2.33 -0.13 0.00 -0.27 0.00 0.00 62.75 60.15 1q0t n ILE 176 Cb 0.43 -1.30 -0.09 0.00 -1.74 0.00 0.00 39.64 36.93 1q0t n ILE 176 CO 0.00 0.00 0.00 -0.89 -1.76 0.00 0.00 176.55 173.90 1q0t s THR 177 N -3.23 0.06 0.32 7.28 2.01 -0.34 -4.80 115.64 116.95 1q0t s THR 177 Ca 0.46 -0.51 -0.12 0.00 0.31 0.00 0.00 61.69 61.83 1q0t s THR 177 Cb 0.35 -0.54 -0.08 0.00 0.01 0.00 0.00 72.50 72.24 1q0t s THR 177 CO -0.05 -0.28 0.69 0.68 -0.69 0.00 0.00 174.62 174.97 1q0t s VAL 178 N -1.25 4.79 0.00 3.82 -7.23 -1.26 -4.77 120.40 114.50 1q0t s VAL 178 Ca -0.13 0.69 0.00 0.00 -1.81 0.00 0.00 61.98 60.73 1q0t s VAL 178 Cb -0.06 -3.65 0.00 0.00 0.56 0.00 0.00 36.38 33.23 1q0t s VAL 178 CO 0.03 -0.26 0.00 0.00 -0.31 0.00 0.00 175.10 174.56 1q0t n ALA 179 N -0.61 0.00 -0.33 1.32 0.00 -1.26 -4.99 120.51 114.63 1q0t n ALA 179 Ca 0.02 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.53 1q0t n ALA 179 Cb 0.53 0.00 0.15 0.00 0.00 0.00 0.00 19.45 20.13 1q0t n ALA 179 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1q0t n ASP 180 N 0.00 -0.30 0.00 0.00 2.03 -1.26 0.13 116.55 117.14 1q0t n ASP 180 Ca 0.00 1.59 0.07 0.00 0.52 0.00 0.00 54.79 56.97 1q0t n ASP 180 Cb 0.00 -0.49 0.34 0.00 -0.72 0.00 0.00 41.12 40.25 1q0t n ASP 180 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1q0t n TYR 181 N -5.49 0.00 0.90 -0.67 4.11 -1.26 -2.22 117.16 112.53 1q0t n TYR 181 Ca 0.16 0.00 0.08 0.00 -0.00 0.00 0.00 57.90 58.14 1q0t n TYR 181 Cb 0.49 -0.27 0.46 0.00 -0.00 0.00 0.00 39.34 40.02 1q0t n TYR 181 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 176.86 176.95 1q0t n ASN 182 N -1.27 0.00 -0.01 9.48 3.02 0.12 -1.08 115.26 125.52 1q0t n ASN 182 Ca 0.07 -0.18 0.14 0.00 -0.03 0.00 0.00 54.58 54.58 1q0t n ASN 182 Cb 0.11 -0.17 0.64 0.00 -0.61 0.00 0.00 39.78 39.74 1q0t n ASN 182 CO 0.00 0.00 0.00 2.29 -2.62 0.00 0.00 177.26 176.93 1q0t n LYS 183 N -1.17 0.19 -0.04 3.52 2.85 -0.94 -3.07 118.16 119.50 1q0t n LYS 183 Ca 0.10 -0.02 0.00 0.00 -1.05 0.00 0.00 58.31 57.34 1q0t n LYS 183 Cb 0.10 -1.50 -0.15 0.00 -0.65 0.00 0.00 35.03 32.84 1q0t n LYS 183 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 177.40 178.54 1q0t n PHE 184 N -1.39 0.20 -2.63 5.58 0.99 -0.24 -4.99 117.46 114.99 1q0t n PHE 184 Ca 0.10 0.07 -0.31 0.00 -0.00 0.00 0.00 57.45 57.31 1q0t n PHE 184 Cb 0.30 -0.83 -0.03 0.00 -1.00 0.00 0.00 39.48 37.93 1q0t n PHE 184 CO 0.00 0.00 0.00 -0.46 -0.00 0.00 0.00 176.76 176.30 1q0t s TRP 185 N -2.98 3.49 0.05 1.38 -0.00 -1.17 -5.04 118.94 114.66 1q0t s TRP 185 Ca -0.08 1.16 -0.17 0.00 -0.00 0.00 0.00 56.10 57.01 1q0t s TRP 185 Cb 0.10 -2.55 0.03 0.00 -0.00 0.00 0.00 33.47 31.05 1q0t s TRP 185 CO 0.86 -0.24 0.39 -1.54 -0.00 0.00 0.00 176.95 176.42 1q0t s SER 186 N -3.31 -0.26 0.40 5.86 1.04 -1.26 -5.01 113.70 111.16 1q0t s SER 186 Ca 0.53 -0.06 0.11 0.00 0.48 0.00 0.00 55.95 57.02 1q0t s SER 186 Cb -0.10 0.42 0.92 0.00 0.10 0.00 0.00 66.02 67.35 1q0t s SER 186 CO 0.35 -0.67 1.94 -0.33 0.98 0.00 0.00 173.24 175.50 1q0t h GLU 187 N 2.99 0.54 -0.03 4.02 5.08 -2.00 -1.39 114.58 123.79 1q0t h GLU 187 Ca -0.31 -0.03 0.01 0.00 -1.00 0.00 0.00 59.36 58.02 1q0t h GLU 187 Cb 1.21 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 30.32 1q0t h GLU 187 CO 0.44 0.36 -0.04 -0.44 -1.00 0.00 0.00 179.01 178.33 1q0t h ASP 188 N 0.56 -0.13 -0.67 1.42 3.32 -2.00 -2.06 116.42 116.87 1q0t h ASP 188 Ca 0.34 0.02 0.14 0.00 0.02 0.00 0.00 57.03 57.55 1q0t h ASP 188 Cb 0.57 0.06 -0.10 0.00 0.22 0.00 0.00 39.33 40.08 1q0t h ASP 188 CO -0.12 -0.06 0.14 -0.33 -1.72 0.00 0.00 179.24 177.15 1q0t h GLU 189 N -0.06 0.24 -0.23 3.56 4.39 -1.67 0.13 114.58 120.95 1q0t h GLU 189 Ca 0.03 -0.01 0.05 0.00 0.34 0.00 0.00 59.36 59.77 1q0t h GLU 189 Cb 0.10 -0.06 -0.07 0.00 -0.10 0.00 0.00 28.75 28.62 1q0t h GLU 189 CO -0.07 0.16 -0.41 0.93 -1.16 0.00 0.00 179.01 178.46 1q0t h GLU 190 N 0.25 -0.41 0.09 2.33 4.39 -1.02 0.18 114.58 120.39 1q0t h GLU 190 Ca 0.36 0.03 0.00 0.00 0.34 0.00 0.00 59.36 60.10 1q0t h GLU 190 Cb 0.58 0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 29.30 1q0t h GLU 190 CO -0.47 -0.27 -0.28 -0.22 -1.16 0.00 0.00 179.01 176.61 1q0t h LYS 191 N -0.43 -0.40 -0.64 2.33 3.11 -0.33 -1.97 116.57 118.24 1q0t h LYS 191 Ca 0.10 0.03 0.06 0.00 -2.81 0.00 0.00 60.65 58.02 1q0t h LYS 191 Cb 0.60 0.09 -0.08 0.00 -1.00 0.00 0.00 32.23 31.85 1q0t h LYS 191 CO -0.45 -0.27 -0.40 -0.44 -2.81 0.00 0.00 179.45 175.08 1q0t h ASP 192 N -0.42 -1.47 -0.83 4.20 5.19 -0.54 -0.80 116.42 121.75 1q0t h ASP 192 Ca -0.01 0.22 0.08 0.00 -0.62 0.00 0.00 57.03 56.70 1q0t h ASP 192 Cb 0.41 0.64 -0.11 0.00 0.18 0.00 0.00 39.33 40.45 1q0t h ASP 192 CO -0.14 -0.17 -0.58 0.25 -3.12 0.00 0.00 179.24 175.48 1q0t h LEU 193 N -0.03 -2.08 -0.36 1.55 5.85 -0.50 0.45 115.31 120.19 1q0t h LEU 193 Ca 0.10 0.31 0.08 0.00 0.84 0.00 0.00 57.88 59.21 1q0t h LEU 193 Cb 0.30 0.90 -0.08 0.00 0.37 0.00 0.00 40.66 42.14 1q0t h LEU 193 CO -0.62 -0.28 -0.23 -0.07 -0.34 0.00 0.00 178.44 176.90 1q0t h LEU 194 N -0.11 -0.78 0.09 2.25 3.38 -0.49 0.60 115.31 120.26 1q0t h LEU 194 Ca 0.14 0.16 0.01 0.00 0.09 0.00 0.00 57.88 58.27 1q0t h LEU 194 Cb 0.46 0.39 -0.04 0.00 0.09 0.00 0.00 40.66 41.56 1q0t h LEU 194 CO -0.84 -0.26 -0.39 0.78 0.09 0.00 0.00 178.44 177.82 1q0t h ASN 195 N -0.18 -1.18 -1.10 -0.43 -0.26 0.28 0.41 115.58 113.12 1q0t h ASN 195 Ca 0.18 0.12 0.32 0.00 -0.56 0.00 0.00 56.30 56.36 1q0t h ASN 195 Cb 0.46 0.43 -0.04 0.00 -1.06 0.00 0.00 38.32 38.11 1q0t h ASN 195 CO -0.47 -0.41 1.10 0.25 -1.06 0.00 0.00 177.43 176.84 1q0t h LEU 196 N -0.56 0.00 0.00 1.61 5.85 0.14 0.37 115.31 122.73 1q0t h LEU 196 Ca -0.00 0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.63 1q0t h LEU 196 Cb 0.56 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.58 1q0t h LEU 196 CO -0.21 0.00 -0.53 -0.07 -0.34 0.00 0.00 178.44 177.28 1q0t h LEU 197 N 0.00 0.00 -0.91 2.25 3.38 0.39 -3.14 115.31 117.28 1q0t h LEU 197 Ca 0.52 -0.61 0.22 0.00 0.09 0.00 0.00 57.88 58.10 1q0t h LEU 197 Cb 2.72 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 43.34 1q0t h LEU 197 CO -0.01 1.12 0.43 0.44 0.09 0.00 0.00 178.44 180.51 1q0t h ASP 198 N -1.00 0.40 -0.98 -0.43 3.32 0.35 0.29 116.42 118.36 1q0t h ASP 198 Ca -0.14 0.15 0.05 0.00 0.02 0.00 0.00 57.03 57.12 1q0t h ASP 198 Cb 0.97 0.11 -0.06 0.00 0.22 0.00 0.00 39.33 40.57 1q0t h ASP 198 CO -0.08 0.03 0.64 -1.28 -1.72 0.00 0.00 179.24 176.82 1q0t h SER 199 N 0.44 1.04 0.76 6.45 0.87 -0.87 -0.20 113.55 122.04 1q0t h SER 199 Ca 0.57 0.00 -0.08 0.00 -1.23 0.00 0.00 61.79 61.04 1q0t h SER 199 Cb 1.07 -0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 62.80 1q0t h SER 199 CO -0.51 0.68 -0.40 -0.07 -0.53 0.00 0.00 176.83 176.00 1q0t h LEU 200 N 1.19 0.00 -0.95 2.23 3.38 -0.42 -2.13 115.31 118.61 1q0t h LEU 200 Ca 0.41 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 58.27 1q0t h LEU 200 Cb 0.10 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 1q0t h LEU 200 CO -0.15 0.40 -0.46 -1.13 0.09 0.00 0.00 178.44 177.20 1q0t h ASN 201 N 0.00 0.15 0.08 -0.43 -0.73 -0.08 -2.47 115.58 112.10 1q0t h ASN 201 Ca -0.00 -0.07 0.00 0.00 1.87 0.00 0.00 56.30 58.10 1q0t h ASN 201 Cb 0.90 -0.04 0.00 0.00 0.27 0.00 0.00 38.32 39.44 1q0t h ASN 201 CO 0.05 0.59 0.00 0.47 -0.37 0.00 0.00 177.43 178.18 1q0t n ASP 202 N -3.98 0.00 -0.07 1.15 8.00 -0.50 -2.44 116.55 118.71 1q0t n ASP 202 Ca -0.02 -0.43 0.07 0.00 0.71 0.00 0.00 54.79 55.12 1q0t n ASP 202 Cb 0.50 -0.07 0.09 0.00 -0.02 0.00 0.00 41.12 41.63 1q0t n ASP 202 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1q0t n ARG 203 N -1.07 1.68 0.00 -1.24 1.74 -0.98 -4.95 116.66 111.84 1q0t n ARG 203 Ca 0.13 -2.19 0.00 0.00 -0.77 0.00 0.00 57.85 55.02 1q0t n ARG 203 Cb 0.08 -1.31 0.00 0.00 -1.02 0.00 0.00 32.46 30.22 1q0t n ARG 203 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1q0t n GLY 204 N -1.10 3.01 3.57 -0.13 0.00 -1.02 -4.94 105.19 104.58 1q0t n GLY 204 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 1q0t n GLY 204 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1q0t n ILE 205 N -1.97 0.21 -1.81 -0.61 5.41 -0.97 -4.96 119.36 114.66 1q0t n ILE 205 Ca 0.00 -0.54 -0.31 0.00 1.00 0.00 0.00 62.75 62.91 1q0t n ILE 205 Cb 0.00 -2.54 0.03 0.00 -0.71 0.00 0.00 39.64 36.42 1q0t n ILE 205 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 176.55 176.01 1q0t s LYS 206 N 6.91 3.25 0.23 0.38 1.02 -1.26 -3.71 119.74 126.56 1q0t s LYS 206 Ca 1.01 0.71 -0.13 0.00 0.02 0.00 0.00 55.97 57.59 1q0t s LYS 206 Cb -0.34 -2.04 -0.00 0.00 -0.52 0.00 0.00 37.83 34.92 1q0t s LYS 206 CO 0.34 -0.81 0.46 -0.59 -0.92 0.00 0.00 175.35 173.83 1q0t s PHE 207 N -3.20 0.30 0.11 3.18 -0.00 -1.26 -3.36 117.98 113.75 1q0t s PHE 207 Ca 0.56 -0.66 0.10 0.00 -0.00 0.00 0.00 56.93 56.94 1q0t s PHE 207 Cb -0.12 0.19 -0.04 0.00 -0.00 0.00 0.00 43.02 43.05 1q0t s PHE 207 CO 0.54 -0.95 -0.25 0.20 -0.00 0.00 0.00 175.22 174.76 1q0t s GLY 208 N -2.99 1.45 -0.16 1.99 0.00 -1.21 -2.90 107.32 103.50 1q0t s GLY 208 Ca 0.20 -1.37 -0.06 0.00 0.00 0.00 0.00 44.72 43.49 1q0t s GLY 208 CO 0.06 -1.34 0.32 1.62 0.00 0.00 0.00 173.10 173.76 1q0t s GLN 209 N -1.90 0.22 0.04 2.90 2.00 -1.14 -1.59 119.66 120.19 1q0t s GLN 209 Ca 0.11 0.86 0.04 0.00 -2.00 0.00 0.00 55.36 54.38 1q0t s GLN 209 Cb -0.10 0.11 -0.04 0.00 0.80 0.00 0.00 33.01 33.79 1q0t s GLN 209 CO 0.05 -0.27 -0.06 0.45 -0.50 0.00 0.00 175.29 174.95 1q0t s SER 210 N 2.50 4.63 0.03 6.67 0.15 -1.13 0.13 113.70 126.67 1q0t s SER 210 Ca 0.00 -0.20 -0.16 0.00 0.70 0.00 0.00 55.95 56.29 1q0t s SER 210 Cb -0.12 -1.05 0.05 0.00 -1.71 0.00 0.00 66.02 63.20 1q0t s SER 210 CO -0.10 0.25 0.74 -3.20 1.20 0.00 0.00 173.24 172.13 1q0t n ASN 211 N 1.24 -0.85 -4.14 5.45 2.85 -0.78 -4.49 115.26 114.55 1q0t n ASN 211 Ca -0.14 -1.28 -0.29 0.00 -0.11 0.00 0.00 54.58 52.75 1q0t n ASN 211 Cb 0.52 1.34 -0.17 0.00 1.24 0.00 0.00 39.78 42.71 1q0t n ASN 211 CO 0.00 0.00 0.00 0.68 -2.11 0.00 0.00 177.26 175.83 1q0t s VAL 212 N -2.13 1.70 -0.02 3.44 -7.23 -1.26 -1.26 120.40 113.65 1q0t s VAL 212 Ca 0.17 -0.81 0.05 0.00 -1.81 0.00 0.00 61.98 59.59 1q0t s VAL 212 Cb -0.01 -1.49 -0.24 0.00 0.56 0.00 0.00 36.38 35.20 1q0t s VAL 212 CO 0.01 0.48 0.77 -0.07 -0.31 0.00 0.00 175.10 175.97 1q0t h LEU 213 N 6.83 0.15 -7.08 1.32 3.38 -1.95 -3.41 115.31 114.55 1q0t h LEU 213 Ca -0.24 -0.26 -0.03 0.00 0.09 0.00 0.00 57.88 57.44 1q0t h LEU 213 Cb 1.22 -0.05 -0.24 0.00 0.09 0.00 0.00 40.66 41.68 1q0t h LEU 213 CO 0.47 1.23 -0.18 -1.83 0.09 0.00 0.00 178.44 178.22 1q0t s GLU 214 N -2.61 0.51 -0.16 1.13 -1.05 -1.26 0.11 118.70 115.37 1q0t s GLU 214 Ca -0.07 1.13 -0.09 0.00 -0.15 0.00 0.00 54.97 55.79 1q0t s GLU 214 Cb 0.08 0.32 0.06 0.00 -0.44 0.00 0.00 34.13 34.14 1q0t s GLU 214 CO 0.82 -0.19 0.38 -1.58 0.95 0.00 0.00 175.26 175.64 1q0t s HIS 215 N 2.10 -0.54 -0.83 4.83 2.46 -0.20 -4.87 115.29 118.23 1q0t s HIS 215 Ca -0.07 1.18 -0.03 0.00 0.47 0.00 0.00 55.06 56.61 1q0t s HIS 215 Cb -0.09 0.22 -0.00 0.00 -0.13 0.00 0.00 32.58 32.58 1q0t s HIS 215 CO -0.16 -0.31 0.66 0.72 -2.47 0.00 0.00 174.74 173.17 1q0t n HIS 216 N 4.19 -2.38 0.00 3.88 8.25 -1.26 -2.95 115.22 124.94 1q0t n HIS 216 Ca -0.23 0.90 0.00 0.00 -0.26 0.00 0.00 57.72 58.13 1q0t n HIS 216 Cb 0.55 -3.36 0.00 0.00 1.12 0.00 0.00 29.99 28.30 1q0t n HIS 216 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1q0t n GLY 217 N -1.71 1.30 3.61 -1.41 0.00 -1.26 -4.91 105.19 100.81 1q0t n GLY 217 Ca -0.17 -0.02 -0.30 0.00 0.00 0.00 0.00 46.02 45.53 1q0t n GLY 217 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1q0t s LYS 218 N 0.00 0.32 0.01 1.61 -0.14 -1.15 -5.07 119.74 115.31 1q0t s LYS 218 Ca 0.00 1.07 -0.19 0.00 -1.36 0.00 0.00 55.97 55.48 1q0t s LYS 218 Cb 0.00 -1.68 0.04 0.00 -1.68 0.00 0.00 37.83 34.51 1q0t s LYS 218 CO 0.00 -2.95 0.42 -1.83 -0.76 0.00 0.00 175.35 170.23 1q0t s GLU 219 N -4.66 0.86 -1.25 1.68 -1.05 -1.26 -1.03 118.70 111.98 1q0t s GLU 219 Ca 0.66 -0.19 -0.12 0.00 -0.15 0.00 0.00 54.97 55.17 1q0t s GLU 219 Cb -0.22 0.39 0.16 0.00 -0.44 0.00 0.00 34.13 34.02 1q0t s GLU 219 CO 0.60 -0.27 1.67 -1.71 0.95 0.00 0.00 175.26 176.50 1q0t n ASN 220 N 0.85 5.13 0.00 0.83 2.85 0.31 -4.88 115.26 120.34 1q0t n ASN 220 Ca -0.20 -3.04 0.00 0.00 -0.11 0.00 0.00 54.58 51.24 1q0t n ASN 220 Cb 0.58 -1.53 0.00 0.00 1.24 0.00 0.00 39.78 40.06 1q0t n ASN 220 CO 0.00 0.00 0.00 0.41 -2.11 0.00 0.00 177.26 175.56 1q0t n THR 221 N 4.07 0.00 -0.31 -0.44 -1.04 -1.26 0.11 114.28 115.40 1q0t n THR 221 Ca 0.39 1.37 0.27 0.00 -2.04 0.00 0.00 64.05 64.04 1q0t n THR 221 Cb 0.40 -1.93 0.59 0.00 -1.82 0.00 0.00 70.33 67.57 1q0t n THR 221 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 1q0t h LEU 222 N 0.00 0.29 0.14 -4.42 3.38 -1.99 0.54 115.31 113.25 1q0t h LEU 222 Ca 0.00 0.06 -0.24 0.00 0.09 0.00 0.00 57.88 57.79 1q0t h LEU 222 Cb 0.00 0.01 0.03 0.00 0.09 0.00 0.00 40.66 40.79 1q0t h LEU 222 CO 0.00 0.05 -1.01 0.25 0.09 0.00 0.00 178.44 177.82 1q0t h LEU 223 N 0.25 0.65 -1.00 1.67 6.46 -1.69 -2.69 115.31 118.96 1q0t h LEU 223 Ca 0.58 -0.89 0.22 0.00 -0.12 0.00 0.00 57.88 57.67 1q0t h LEU 223 Cb 1.76 -0.21 -0.12 0.00 -0.73 0.00 0.00 40.66 41.36 1q0t h LEU 223 CO -0.20 1.48 0.59 0.50 -0.62 0.00 0.00 178.44 180.19 1q0t h LYS 224 N -0.08 0.64 0.26 1.25 1.63 0.31 -0.01 116.57 120.55 1q0t h LYS 224 Ca -0.17 -0.04 -0.01 0.00 -0.85 0.00 0.00 60.65 59.58 1q0t h LYS 224 Cb 1.76 -0.14 0.00 0.00 -0.60 0.00 0.00 32.23 33.25 1q0t h LYS 224 CO 0.19 0.42 -0.12 0.93 -3.45 0.00 0.00 179.45 177.42 1q0t h GLU 225 N 0.66 -0.33 -1.33 1.90 5.08 -1.51 -3.25 114.58 115.79 1q0t h GLU 225 Ca 0.61 0.02 0.39 0.00 -1.00 0.00 0.00 59.36 59.38 1q0t h GLU 225 Cb 1.07 0.08 -0.07 0.00 0.50 0.00 0.00 28.75 30.32 1q0t h GLU 225 CO -0.44 -0.01 0.93 2.35 -1.00 0.00 0.00 179.01 180.85 1q0t h TRP 226 N -0.96 0.18 -0.41 4.33 7.01 -0.99 -0.21 115.95 124.90 1q0t h TRP 226 Ca -0.04 0.01 -0.11 0.00 2.11 0.00 0.00 58.89 60.86 1q0t h TRP 226 Cb 0.48 -0.05 -0.01 0.00 -2.10 0.00 0.00 29.16 27.47 1q0t h TRP 226 CO 0.05 -0.02 -0.20 0.66 -2.79 0.00 0.00 178.44 176.14 1q0t h SER 227 N 0.08 0.80 -0.93 2.65 4.64 -1.06 -3.20 113.55 116.53 1q0t h SER 227 Ca 0.67 -0.28 0.26 0.00 -0.47 0.00 0.00 61.79 61.97 1q0t h SER 227 Cb 2.47 -0.22 -0.14 0.00 -0.31 0.00 0.00 62.40 64.20 1q0t h SER 227 CO -0.11 0.98 0.39 0.11 -0.87 0.00 0.00 176.83 177.33 1q0t h LYS 228 N 0.69 0.29 0.00 4.77 1.57 -1.13 0.49 116.57 123.26 1q0t h LYS 228 Ca 0.10 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 1q0t h LYS 228 Cb 0.71 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.96 1q0t h LYS 228 CO 0.05 0.19 0.21 0.87 -0.57 0.00 0.00 179.45 180.21 1q0t h LYS 229 N 0.30 0.00 -4.97 3.15 1.57 -1.70 -3.43 116.57 111.49 1q0t h LYS 229 Ca 0.62 0.00 -0.50 0.00 -1.87 0.00 0.00 60.65 58.90 1q0t h LYS 229 Cb 1.28 0.00 -0.13 0.00 0.08 0.00 0.00 32.23 33.46 1q0t h LYS 229 CO -0.61 0.00 -0.52 0.71 -0.57 0.00 0.00 179.45 178.46 1q0t s TYR 230 N -3.59 1.73 0.50 -1.35 1.51 0.17 -5.12 117.35 111.20 1q0t s TYR 230 Ca -0.02 -1.38 -0.20 0.00 -1.01 0.00 0.00 57.07 54.46 1q0t s TYR 230 Cb 0.06 -0.99 -0.08 0.00 -0.11 0.00 0.00 41.96 40.84 1q0t s TYR 230 CO 0.19 -0.47 1.05 -0.80 -1.11 0.00 0.00 175.55 174.41 1q0t s ASN 231 N -3.49 6.23 -0.02 2.29 -0.87 -1.12 -4.94 114.94 113.02 1q0t s ASN 231 Ca 0.31 1.97 -0.00 0.00 -1.57 0.00 0.00 52.86 53.56 1q0t s ASN 231 Cb 0.03 -2.56 0.02 0.00 -0.02 0.00 0.00 41.25 38.72 1q0t s ASN 231 CO 0.18 -0.86 0.04 0.68 -2.57 0.00 0.00 177.10 174.57 1q0t s VAL 232 N -1.95 -0.05 0.08 1.60 -7.23 -1.26 -2.34 120.40 109.25 1q0t s VAL 232 Ca 0.68 0.17 0.06 0.00 -1.81 0.00 0.00 61.98 61.07 1q0t s VAL 232 Cb -0.18 -0.09 -0.04 0.00 0.56 0.00 0.00 36.38 36.64 1q0t s VAL 232 CO 0.21 0.07 -0.06 -0.75 -0.31 0.00 0.00 175.10 174.26 1q0t s LYS 233 N 0.85 2.35 -0.18 4.82 2.20 -0.52 -4.92 119.74 124.33 1q0t s LYS 233 Ca -0.07 -0.90 0.01 0.00 -0.36 0.00 0.00 55.97 54.65 1q0t s LYS 233 Cb -0.10 -2.42 0.02 0.00 -1.51 0.00 0.00 37.83 33.82 1q0t s LYS 233 CO -0.03 0.54 -0.19 -1.01 -0.36 0.00 0.00 175.35 174.30 1q0t s HIS 234 N -1.19 2.78 0.00 4.03 3.76 -1.26 -1.70 115.29 121.71 1q0t s HIS 234 Ca 0.22 -1.57 0.00 0.00 -0.15 0.00 0.00 55.06 53.55 1q0t s HIS 234 Cb -0.11 -1.92 0.00 0.00 1.11 0.00 0.00 32.58 31.65 1q0t s HIS 234 CO 0.14 -0.77 0.00 1.28 -0.85 0.00 0.00 174.74 174.53 1q0t n LEU 235 N 4.58 0.84 -1.03 0.89 4.32 -1.26 -5.04 117.00 120.31 1q0t n LEU 235 Ca -0.21 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.78 1q0t n LEU 235 Cb 0.50 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.30 1q0t n LEU 235 CO 0.26 0.14 -0.16 -0.62 -1.22 0.00 0.00 177.39 175.79 1q0t n GLU 254 N -2.05 -1.93 -4.08 3.23 -0.58 -1.26 -5.17 120.64 108.80 1q0t n GLU 254 Ca 0.00 1.69 -0.14 0.00 -0.42 0.00 0.00 57.16 58.29 1q0t n GLU 254 Cb 0.46 -1.47 -0.12 0.00 -0.57 0.00 0.00 31.44 29.74 1q0t n GLU 254 CO 0.00 0.00 0.00 0.14 -0.48 0.00 0.00 177.13 176.79 1q0t s VAL 255 N -0.20 0.44 -0.37 2.62 -7.23 -0.39 -4.96 120.40 110.32 1q0t s VAL 255 Ca 0.00 -0.73 -0.05 0.00 -1.81 0.00 0.00 61.98 59.38 1q0t s VAL 255 Cb 0.00 -0.47 0.07 0.00 0.56 0.00 0.00 36.38 36.54 1q0t s VAL 255 CO 0.00 -0.21 0.15 -0.47 -0.31 0.00 0.00 175.10 174.27 1q0t s TYR 256 N -0.90 3.36 -0.68 2.82 5.04 -0.69 -1.86 117.35 124.44 1q0t s TYR 256 Ca -0.06 -1.78 -0.18 0.00 -2.44 0.00 0.00 57.07 52.61 1q0t s TYR 256 Cb -0.07 -2.66 0.13 0.00 0.35 0.00 0.00 41.96 39.71 1q0t s TYR 256 CO 0.00 -0.84 0.76 0.42 -1.34 0.00 0.00 175.55 174.55 1q0t s ILE 257 N 1.32 4.99 0.14 3.14 1.01 0.34 -1.44 121.20 130.69 1q0t s ILE 257 Ca 0.01 -1.40 0.07 0.00 0.00 0.00 0.00 60.65 59.33 1q0t s ILE 257 Cb -0.21 -4.52 -0.04 0.00 0.01 0.00 0.00 42.46 37.70 1q0t s ILE 257 CO 0.00 -1.14 -0.05 0.72 0.00 0.00 0.00 174.94 174.47 1q0t s PHE 258 N 2.12 2.79 -0.81 3.97 -0.12 -0.99 -2.90 117.98 122.05 1q0t s PHE 258 Ca 0.15 -0.14 0.06 0.00 -0.05 0.00 0.00 56.93 56.95 1q0t s PHE 258 Cb -0.19 -1.41 0.05 0.00 -0.63 0.00 0.00 43.02 40.84 1q0t s PHE 258 CO 0.01 0.48 0.70 0.27 -0.05 0.00 0.00 175.22 176.63