#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xkq h ARG 3 N 0.00 1.09 -0.23 0.54 3.08 -1.92 -3.02 114.38 113.92 1xkq h ARG 3 Ca 0.00 -0.07 -0.13 0.00 0.07 0.00 0.00 59.98 59.85 1xkq h ARG 3 Cb 0.00 -0.25 -0.09 0.00 0.08 0.00 0.00 29.97 29.72 1xkq h ARG 3 CO 0.00 0.72 -0.32 1.19 -1.07 0.00 0.00 179.97 180.49 1xkq n PHE 4 N -4.53 0.74 -1.98 3.04 3.72 -0.14 -5.04 117.46 113.27 1xkq n PHE 4 Ca 0.14 -1.64 -0.42 0.00 -0.05 0.00 0.00 57.45 55.48 1xkq n PHE 4 Cb 0.15 -0.38 -0.03 0.00 -0.94 0.00 0.00 39.48 38.28 1xkq n PHE 4 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 1xkq s SER 5 N -2.95 6.63 -1.02 4.37 0.01 -1.14 -2.23 113.70 117.38 1xkq s SER 5 Ca 0.42 2.61 -0.00 0.00 1.31 0.00 0.00 55.95 60.30 1xkq s SER 5 Cb 0.39 -2.60 0.00 0.00 0.21 0.00 0.00 66.02 64.02 1xkq s SER 5 CO -0.03 -0.77 0.01 0.59 0.41 0.00 0.00 173.24 173.45 1xkq n ASN 6 N 3.36 -3.82 -4.30 2.44 5.03 -1.23 -4.96 115.26 111.77 1xkq n ASN 6 Ca 0.11 -0.02 -0.31 0.00 0.87 0.00 0.00 54.58 55.23 1xkq n ASN 6 Cb 0.39 -3.03 -0.16 0.00 -1.02 0.00 0.00 39.78 35.96 1xkq n ASN 6 CO 0.00 0.00 0.00 -0.54 -1.83 0.00 0.00 177.26 174.89 1xkq s LYS 7 N -4.61 2.30 -0.22 3.52 3.01 -0.94 -5.01 119.74 117.78 1xkq s LYS 7 Ca 0.01 -0.92 -0.05 0.00 -1.01 0.00 0.00 55.97 53.99 1xkq s LYS 7 Cb -0.00 -2.10 -0.02 0.00 -1.01 0.00 0.00 37.83 34.70 1xkq s LYS 7 CO 0.01 0.49 0.01 0.95 0.51 0.00 0.00 175.35 177.32 1xkq s THR 8 N -0.43 3.93 -0.06 2.17 -4.23 -1.26 -0.80 115.64 114.95 1xkq s THR 8 Ca 0.04 -0.31 0.05 0.00 -1.18 0.00 0.00 61.69 60.29 1xkq s THR 8 Cb -0.12 -2.80 -0.01 0.00 1.34 0.00 0.00 72.50 70.92 1xkq s THR 8 CO 0.01 0.40 -0.22 -0.69 -0.54 0.00 0.00 174.62 173.58 1xkq s VAL 9 N 1.31 1.85 -0.22 2.29 1.01 -0.29 -0.92 120.40 125.43 1xkq s VAL 9 Ca 0.04 -0.94 -0.07 0.00 0.00 0.00 0.00 61.98 61.01 1xkq s VAL 9 Cb -0.15 -1.58 -0.03 0.00 0.00 0.00 0.00 36.38 34.62 1xkq s VAL 9 CO 0.01 0.52 0.06 -0.63 0.00 0.00 0.00 175.10 175.06 1xkq s ILE 10 N 0.04 4.43 -0.35 2.22 1.01 -0.41 -1.08 121.20 127.05 1xkq s ILE 10 Ca -0.07 -0.14 0.00 0.00 0.00 0.00 0.00 60.65 60.43 1xkq s ILE 10 Cb -0.14 -3.04 0.09 0.00 0.01 0.00 0.00 42.46 39.38 1xkq s ILE 10 CO 0.04 0.38 0.07 -0.63 0.00 0.00 0.00 174.94 174.81 1xkq s ILE 11 N 1.15 2.77 0.63 2.92 1.09 -0.84 -0.98 121.20 127.95 1xkq s ILE 11 Ca 0.04 -1.96 -0.15 0.00 -1.10 0.00 0.00 60.65 57.48 1xkq s ILE 11 Cb -0.14 -2.85 -0.01 0.00 -1.06 0.00 0.00 42.46 38.39 1xkq s ILE 11 CO 0.03 -0.46 1.09 0.42 -0.10 0.00 0.00 174.94 175.92 1xkq s THR 12 N 1.08 3.51 -1.35 2.92 -4.23 -0.94 -3.46 115.64 113.17 1xkq s THR 12 Ca 0.04 0.70 -0.07 0.00 -1.18 0.00 0.00 61.69 61.18 1xkq s THR 12 Cb -0.21 -3.23 0.02 0.00 1.34 0.00 0.00 72.50 70.43 1xkq s THR 12 CO -0.05 -0.44 1.08 0.61 -0.54 0.00 0.00 174.62 175.29 1xkq n GLY 13 N -0.77 -0.48 1.82 3.99 0.00 -1.13 -3.32 105.19 105.30 1xkq n GLY 13 Ca 0.10 0.21 0.07 0.00 0.00 0.00 0.00 46.02 46.39 1xkq n GLY 13 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1xkq n SER 14 N -3.01 5.47 -1.20 1.61 3.41 -0.38 -3.64 113.62 115.87 1xkq n SER 14 Ca -0.07 -2.87 0.11 0.00 -0.26 0.00 0.00 58.87 55.78 1xkq n SER 14 Cb 0.59 -0.67 0.29 0.00 -0.26 0.00 0.00 64.21 64.15 1xkq n SER 14 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1xkq n SER 15 N 0.61 3.51 -3.62 4.04 3.41 -1.24 -3.78 113.62 116.54 1xkq n SER 15 Ca 0.26 -1.99 -0.02 0.00 -0.26 0.00 0.00 58.87 56.86 1xkq n SER 15 Cb 1.14 -0.41 -0.02 0.00 -0.26 0.00 0.00 64.21 64.66 1xkq n SER 15 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 1xkq s ASN 16 N -1.08 -0.05 0.70 4.04 2.47 -1.26 -4.37 114.94 115.39 1xkq s ASN 16 Ca 0.44 -0.01 0.00 0.00 0.42 0.00 0.00 52.86 53.71 1xkq s ASN 16 Cb 0.23 0.06 0.00 0.00 -1.45 0.00 0.00 41.25 40.09 1xkq s ASN 16 CO 0.30 -0.10 0.00 0.61 -3.72 0.00 0.00 177.10 174.20 1xkq n GLY 17 N -0.12 2.47 0.26 1.21 0.00 -1.26 -2.73 105.19 105.02 1xkq n GLY 17 Ca 0.02 -0.24 0.01 0.00 0.00 0.00 0.00 46.02 45.80 1xkq n GLY 17 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1xkq h ILE 18 N 0.00 0.81 -0.80 -0.61 1.08 -1.88 -2.38 117.51 113.74 1xkq h ILE 18 Ca 0.00 -0.18 -0.01 0.00 -0.39 0.00 0.00 64.86 64.28 1xkq h ILE 18 Cb 0.00 0.24 -0.04 0.00 -3.07 0.00 0.00 36.82 33.96 1xkq h ILE 18 CO 0.00 0.10 0.44 1.23 -0.69 0.00 0.00 178.15 179.22 1xkq h GLY 19 N 0.52 1.18 0.86 5.37 0.00 -1.61 -0.49 103.07 108.90 1xkq h GLY 19 Ca 0.34 -0.52 -0.02 0.00 0.00 0.00 0.00 47.33 47.13 1xkq h GLY 19 CO -0.29 0.50 -0.15 -0.09 0.00 0.00 0.00 176.54 176.52 1xkq h ARG 20 N 1.11 -0.40 -0.57 4.80 2.43 -1.23 -1.15 114.38 119.37 1xkq h ARG 20 Ca 0.28 0.03 -0.06 0.00 -0.81 0.00 0.00 59.98 59.42 1xkq h ARG 20 Cb 0.02 0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 29.64 1xkq h ARG 20 CO -0.05 -0.17 0.12 1.79 -1.51 0.00 0.00 179.97 180.15 1xkq h THR 21 N -0.57 1.24 -0.26 0.20 1.35 -1.39 -0.78 112.91 112.70 1xkq h THR 21 Ca -0.04 -0.88 -0.01 0.00 -0.55 0.00 0.00 66.41 64.93 1xkq h THR 21 Cb 0.42 0.68 -0.01 0.00 -1.73 0.00 0.00 68.15 67.50 1xkq h THR 21 CO 0.07 0.33 0.13 0.74 -0.25 0.00 0.00 175.52 176.54 1xkq h THR 22 N 0.85 1.14 -0.72 6.82 2.02 -1.03 0.72 112.91 122.70 1xkq h THR 22 Ca 0.18 -0.38 0.01 0.00 0.77 0.00 0.00 66.41 66.99 1xkq h THR 22 Cb 0.33 0.91 -0.04 0.00 -1.74 0.00 0.00 68.15 67.62 1xkq h THR 22 CO 0.00 0.13 0.47 0.00 0.37 0.00 0.00 175.52 176.50 1xkq h ALA 23 N 1.00 0.91 -0.15 6.16 0.00 -0.85 -0.94 119.26 125.39 1xkq h ALA 23 Ca 0.09 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 1xkq h ALA 23 Cb 0.10 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1xkq h ALA 23 CO -0.01 0.32 0.08 0.82 0.00 0.00 0.00 179.25 180.46 1xkq h ILE 24 N 0.96 1.10 -0.66 0.00 2.04 -0.67 -1.66 117.51 118.62 1xkq h ILE 24 Ca 0.27 -0.26 -0.05 0.00 1.00 0.00 0.00 64.86 65.82 1xkq h ILE 24 Cb -0.10 0.99 -0.03 0.00 -0.74 0.00 0.00 36.82 36.94 1xkq h ILE 24 CO -0.06 0.09 0.22 -0.07 0.00 0.00 0.00 178.15 178.32 1xkq h LEU 25 N 0.15 0.92 -0.43 1.44 3.38 -0.56 -1.32 115.31 118.89 1xkq h LEU 25 Ca 0.05 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 57.86 1xkq h LEU 25 Cb 0.07 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 1xkq h LEU 25 CO -0.01 0.85 0.20 -0.26 0.09 0.00 0.00 178.44 179.31 1xkq h PHE 26 N 0.96 0.62 -0.44 1.13 0.04 -0.98 -1.28 116.94 116.99 1xkq h PHE 26 Ca 0.22 -0.03 -0.02 0.00 2.80 0.00 0.00 57.97 60.94 1xkq h PHE 26 Cb 0.25 -0.19 -0.02 0.00 2.20 0.00 0.00 35.95 38.19 1xkq h PHE 26 CO 0.02 0.51 0.21 0.00 -0.60 0.00 0.00 178.31 178.45 1xkq h ALA 27 N 1.05 0.56 0.00 2.45 0.00 -1.02 -1.51 119.26 120.79 1xkq h ALA 27 Ca 0.15 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1xkq h ALA 27 Cb 0.13 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.74 1xkq h ALA 27 CO -0.02 0.13 -0.05 1.96 0.00 0.00 0.00 179.25 181.27 1xkq h GLN 28 N 0.56 0.00 -0.34 0.00 4.20 -1.02 -0.20 115.11 118.32 1xkq h GLN 28 Ca 0.15 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.86 1xkq h GLN 28 Cb 0.13 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.91 1xkq h GLN 28 CO -0.02 0.05 0.00 0.39 -0.67 0.00 0.00 178.83 178.58 1xkq n GLU 29 N -3.40 1.76 -0.39 1.46 -0.58 -0.50 -4.43 120.64 114.54 1xkq n GLU 29 Ca -0.02 -1.09 0.00 0.00 -0.42 0.00 0.00 57.16 55.63 1xkq n GLU 29 Cb 0.18 -1.27 0.00 0.00 -0.57 0.00 0.00 31.44 29.78 1xkq n GLU 29 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1xkq n GLY 30 N 0.93 0.73 3.86 0.62 0.00 -0.09 -0.97 105.19 110.27 1xkq n GLY 30 Ca 0.10 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.81 1xkq n GLY 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xkq s ALA 31 N -2.51 3.17 0.02 4.61 0.00 -0.68 -3.57 121.76 122.80 1xkq s ALA 31 Ca 0.00 0.01 -0.24 0.00 0.00 0.00 0.00 51.96 51.73 1xkq s ALA 31 Cb 0.00 -2.96 -0.05 0.00 0.00 0.00 0.00 23.12 20.10 1xkq s ALA 31 CO 0.00 -0.21 0.71 -0.80 0.00 0.00 0.00 175.76 175.46 1xkq s ASN 32 N -3.25 7.13 -0.01 0.00 0.02 0.02 -4.42 114.94 114.43 1xkq s ASN 32 Ca 0.56 1.35 0.03 0.00 -1.02 0.00 0.00 52.86 53.78 1xkq s ASN 32 Cb -0.10 -2.43 -0.01 0.00 0.02 0.00 0.00 41.25 38.72 1xkq s ASN 32 CO 0.34 0.03 -0.11 -0.69 0.02 0.00 0.00 177.10 176.69 1xkq s VAL 33 N -0.01 0.88 -0.29 1.60 1.01 0.46 -1.13 120.40 122.91 1xkq s VAL 33 Ca 0.36 -0.48 -0.08 0.00 0.00 0.00 0.00 61.98 61.79 1xkq s VAL 33 Cb -0.20 -0.73 -0.00 0.00 0.00 0.00 0.00 36.38 35.45 1xkq s VAL 33 CO 0.21 0.24 0.10 -0.89 0.00 0.00 0.00 175.10 174.76 1xkq s THR 34 N -0.27 4.24 -0.05 3.92 2.01 -0.24 -0.34 115.64 124.91 1xkq s THR 34 Ca 0.04 -0.49 -0.02 0.00 0.31 0.00 0.00 61.69 61.54 1xkq s THR 34 Cb -0.04 -3.13 -0.04 0.00 0.01 0.00 0.00 72.50 69.30 1xkq s THR 34 CO -0.00 0.14 0.05 0.27 -0.69 0.00 0.00 174.62 174.39 1xkq s ILE 35 N 1.56 4.63 0.07 1.82 -4.36 0.81 -1.98 121.20 123.75 1xkq s ILE 35 Ca 0.04 -0.29 -0.17 0.00 -0.26 0.00 0.00 60.65 59.97 1xkq s ILE 35 Cb -0.17 -3.04 0.03 0.00 1.25 0.00 0.00 42.46 40.54 1xkq s ILE 35 CO 0.04 0.48 0.40 0.28 0.24 0.00 0.00 174.94 176.37 1xkq s THR 36 N -1.05 0.06 -1.24 8.37 -1.32 -1.25 -0.60 115.64 118.61 1xkq s THR 36 Ca 0.18 -0.53 0.00 0.00 -1.21 0.00 0.00 61.69 60.13 1xkq s THR 36 Cb -0.12 -1.04 0.00 0.00 -1.51 0.00 0.00 72.50 69.83 1xkq s THR 36 CO 0.08 -0.29 0.00 0.61 -2.21 0.00 0.00 174.62 172.81 1xkq n GLY 37 N 0.24 -1.44 0.13 6.08 0.00 -1.07 -1.25 105.19 107.88 1xkq n GLY 37 Ca -0.18 -1.01 -0.17 0.00 0.00 0.00 0.00 46.02 44.66 1xkq n GLY 37 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xkq n ARG 38 N -0.15 0.68 -2.33 1.61 1.74 -1.24 -0.81 116.66 116.16 1xkq n ARG 38 Ca 0.00 0.17 -0.41 0.00 -0.77 0.00 0.00 57.85 56.84 1xkq n ARG 38 Cb 0.00 -1.59 -0.03 0.00 -1.02 0.00 0.00 32.46 29.82 1xkq n ARG 38 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1xkq s SER 39 N -6.50 5.92 0.43 0.55 0.15 -1.26 -4.77 113.70 108.21 1xkq s SER 39 Ca -0.26 0.15 0.10 0.00 0.70 0.00 0.00 55.95 56.64 1xkq s SER 39 Cb 0.08 -2.54 0.95 0.00 -1.71 0.00 0.00 66.02 62.80 1xkq s SER 39 CO 0.69 -1.91 2.03 0.77 1.20 0.00 0.00 173.24 176.02 1xkq h SER 40 N 11.82 0.40 -0.11 5.45 4.64 -1.99 -0.82 113.55 132.94 1xkq h SER 40 Ca -0.27 -0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.02 1xkq h SER 40 Cb 1.10 -0.09 -0.00 0.00 -0.31 0.00 0.00 62.40 63.10 1xkq h SER 40 CO 1.21 0.27 -0.02 -0.33 -0.87 0.00 0.00 176.83 177.09 1xkq h GLU 41 N 0.46 0.21 0.00 4.77 4.39 -2.00 -2.37 114.58 120.04 1xkq h GLU 41 Ca 0.20 -0.08 -0.13 0.00 0.34 0.00 0.00 59.36 59.69 1xkq h GLU 41 Cb 0.21 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.83 1xkq h GLU 41 CO -0.05 0.50 -0.61 0.00 -1.16 0.00 0.00 179.01 177.69 1xkq h ARG 42 N -0.10 0.00 -0.57 2.33 3.08 -1.78 -2.64 114.38 114.69 1xkq h ARG 42 Ca 0.03 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 60.00 1xkq h ARG 42 Cb 0.42 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.45 1xkq h ARG 42 CO 0.01 0.61 0.05 1.25 -1.07 0.00 0.00 179.97 180.82 1xkq h LEU 43 N 0.00 0.94 -1.04 3.04 5.85 -1.12 -2.11 115.31 120.87 1xkq h LEU 43 Ca -0.01 -0.28 -0.07 0.00 0.84 0.00 0.00 57.88 58.36 1xkq h LEU 43 Cb 1.10 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.86 1xkq h LEU 43 CO 0.08 0.99 -0.04 -0.08 -0.34 0.00 0.00 178.44 179.05 1xkq h GLU 44 N 0.86 0.64 -0.55 1.25 4.57 -1.31 -2.09 114.58 117.94 1xkq h GLU 44 Ca 0.17 -0.17 0.02 0.00 -1.18 0.00 0.00 59.36 58.20 1xkq h GLU 44 Cb 0.48 -0.08 -0.03 0.00 -0.16 0.00 0.00 28.75 28.96 1xkq h GLU 44 CO 0.02 0.69 0.35 0.93 -1.18 0.00 0.00 179.01 179.82 1xkq h GLU 45 N 0.60 0.67 -0.81 1.92 5.08 -1.08 0.14 114.58 121.11 1xkq h GLU 45 Ca 0.12 -0.04 0.04 0.00 -1.00 0.00 0.00 59.36 58.47 1xkq h GLU 45 Cb 0.44 -0.15 -0.05 0.00 0.50 0.00 0.00 28.75 29.49 1xkq h GLU 45 CO 0.02 0.45 0.51 1.15 -1.00 0.00 0.00 179.01 180.14 1xkq h THR 46 N 0.69 1.11 -0.36 1.13 2.02 -0.79 -1.77 112.91 114.93 1xkq h THR 46 Ca 0.22 -0.34 -0.04 0.00 0.77 0.00 0.00 66.41 67.02 1xkq h THR 46 Cb -0.01 0.03 -0.01 0.00 -1.74 0.00 0.00 68.15 66.41 1xkq h THR 46 CO -0.08 0.18 0.08 -0.09 0.37 0.00 0.00 175.52 175.99 1xkq h ARG 47 N 0.99 0.58 -0.45 6.66 2.43 -0.61 -2.61 114.38 121.37 1xkq h ARG 47 Ca 0.33 -0.14 0.03 0.00 -0.81 0.00 0.00 59.98 59.38 1xkq h ARG 47 Cb 0.04 -0.08 -0.03 0.00 -0.42 0.00 0.00 29.97 29.48 1xkq h ARG 47 CO -0.12 0.63 0.25 1.96 -1.51 0.00 0.00 179.97 181.18 1xkq h GLN 48 N 0.44 0.49 -0.93 0.20 1.08 -0.38 0.10 115.11 116.11 1xkq h GLN 48 Ca 0.11 -0.03 0.08 0.00 -1.45 0.00 0.00 58.65 57.37 1xkq h GLN 48 Cb 0.31 -0.11 -0.07 0.00 -0.05 0.00 0.00 27.48 27.57 1xkq h GLN 48 CO 0.00 0.32 0.60 0.82 -0.95 0.00 0.00 178.83 179.63 1xkq h ILE 49 N 0.50 1.02 -0.19 2.54 2.04 -1.21 0.37 117.51 122.57 1xkq h ILE 49 Ca 0.18 -0.34 -0.10 0.00 1.00 0.00 0.00 64.86 65.60 1xkq h ILE 49 Cb 0.05 -0.07 -0.00 0.00 -0.74 0.00 0.00 36.82 36.05 1xkq h ILE 49 CO -0.10 0.18 -0.27 0.40 0.00 0.00 0.00 178.15 178.36 1xkq h ILE 50 N 1.00 1.34 -0.20 -0.67 2.04 -0.90 -3.27 117.51 116.85 1xkq h ILE 50 Ca 0.42 -1.48 -0.03 0.00 1.00 0.00 0.00 64.86 64.78 1xkq h ILE 50 Cb 0.31 1.84 -0.01 0.00 -0.74 0.00 0.00 36.82 38.21 1xkq h ILE 50 CO -0.18 0.45 0.03 -0.07 0.00 0.00 0.00 178.15 178.38 1xkq h LEU 51 N 0.19 0.32 -1.15 1.44 3.38 -0.05 -2.51 115.31 116.93 1xkq h LEU 51 Ca 0.02 -0.27 0.00 0.00 0.09 0.00 0.00 57.88 57.72 1xkq h LEU 51 Cb 0.85 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.51 1xkq h LEU 51 CO 0.06 0.51 0.00 0.29 0.09 0.00 0.00 178.44 179.39 1xkq n LYS 52 N -4.73 0.48 0.00 1.13 5.02 0.12 -0.70 118.16 119.48 1xkq n LYS 52 Ca -0.04 0.00 0.01 0.00 -2.02 0.00 0.00 58.31 56.26 1xkq n LYS 52 Cb 0.20 -1.24 0.00 0.00 -0.02 0.00 0.00 35.03 33.97 1xkq n LYS 52 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1xkq n SER 53 N 0.34 0.75 0.00 4.39 2.88 -0.95 -4.97 113.62 116.06 1xkq n SER 53 Ca 0.00 -0.88 0.00 0.00 -1.33 0.00 0.00 58.87 56.66 1xkq n SER 53 Cb 0.14 0.42 0.00 0.00 -0.75 0.00 0.00 64.21 64.01 1xkq n SER 53 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1xkq n GLY 54 N 0.52 0.75 3.68 0.46 0.00 0.12 -5.07 105.19 105.65 1xkq n GLY 54 Ca 0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.62 1xkq n GLY 54 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xkq s VAL 55 N -2.00 4.89 0.46 1.61 1.01 -1.21 -5.03 120.40 120.14 1xkq s VAL 55 Ca 0.00 1.66 -0.24 0.00 0.00 0.00 0.00 61.98 63.40 1xkq s VAL 55 Cb 0.00 -4.15 -0.07 0.00 0.00 0.00 0.00 36.38 32.16 1xkq s VAL 55 CO 0.00 0.05 1.32 -0.55 0.00 0.00 0.00 175.10 175.92 1xkq s SER 56 N 1.12 5.91 0.60 3.32 0.15 -1.26 -4.33 113.70 119.21 1xkq s SER 56 Ca 0.39 2.68 0.40 0.00 0.70 0.00 0.00 55.95 60.12 1xkq s SER 56 Cb -0.17 -2.63 2.16 0.00 -1.71 0.00 0.00 66.02 63.66 1xkq s SER 56 CO 0.14 -1.13 2.21 -0.33 1.20 0.00 0.00 173.24 175.33 1xkq h GLU 57 N 2.16 0.00 0.00 5.44 5.08 -1.95 -0.79 114.58 124.52 1xkq h GLU 57 Ca -0.50 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.86 1xkq h GLU 57 Cb 1.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.52 1xkq h GLU 57 CO 0.60 0.00 0.00 1.63 -1.00 0.00 0.00 179.01 180.24 1xkq n LYS 58 N -2.91 0.07 -0.04 2.33 4.01 -1.26 -2.62 118.16 117.74 1xkq n LYS 58 Ca -0.03 0.12 0.12 0.00 -0.51 0.00 0.00 58.31 58.02 1xkq n LYS 58 Cb 0.08 -1.59 0.33 0.00 -0.51 0.00 0.00 35.03 33.34 1xkq n LYS 58 CO 0.00 0.00 0.00 1.04 -1.11 0.00 0.00 177.40 177.33 1xkq n GLN 59 N -1.71 1.98 -4.86 1.97 1.13 -0.30 -4.88 117.38 110.71 1xkq n GLN 59 Ca 0.06 -1.44 -0.27 0.00 -1.94 0.00 0.00 57.00 53.41 1xkq n GLN 59 Cb 0.32 -1.46 -0.16 0.00 0.11 0.00 0.00 30.24 29.05 1xkq n GLN 59 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 1xkq s VAL 60 N -1.90 1.48 -0.27 5.09 1.01 -1.08 -0.40 120.40 124.33 1xkq s VAL 60 Ca 0.34 -0.73 0.01 0.00 0.00 0.00 0.00 61.98 61.60 1xkq s VAL 60 Cb 0.20 -1.28 0.08 0.00 0.00 0.00 0.00 36.38 35.37 1xkq s VAL 60 CO 0.31 0.43 -0.00 0.21 0.00 0.00 0.00 175.10 176.04 1xkq s ASN 61 N 0.16 4.09 -0.19 3.32 2.47 0.54 -4.98 114.94 120.35 1xkq s ASN 61 Ca -0.07 -1.48 -0.15 0.00 0.42 0.00 0.00 52.86 51.58 1xkq s ASN 61 Cb -0.13 -1.22 -0.04 0.00 -1.45 0.00 0.00 41.25 38.41 1xkq s ASN 61 CO 0.03 -0.30 0.35 -0.55 -3.72 0.00 0.00 177.10 172.92 1xkq s SER 62 N 1.33 6.42 -0.09 -4.21 0.15 -1.26 -0.13 113.70 115.91 1xkq s SER 62 Ca 0.01 0.50 -0.00 0.00 0.70 0.00 0.00 55.95 57.15 1xkq s SER 62 Cb -0.19 -2.21 0.02 0.00 -1.71 0.00 0.00 66.02 61.94 1xkq s SER 62 CO -0.10 -0.01 -0.06 -0.69 1.20 0.00 0.00 173.24 173.58 1xkq s VAL 63 N 1.02 0.84 -0.25 4.45 1.01 0.23 -4.96 120.40 122.74 1xkq s VAL 63 Ca 0.18 -0.20 -0.18 0.00 0.00 0.00 0.00 61.98 61.78 1xkq s VAL 63 Cb -0.14 -0.87 -0.03 0.00 0.00 0.00 0.00 36.38 35.34 1xkq s VAL 63 CO 0.07 0.33 0.53 -0.69 0.00 0.00 0.00 175.10 175.33 1xkq s VAL 64 N 1.55 5.07 0.00 2.92 1.01 -1.26 -2.60 120.40 127.10 1xkq s VAL 64 Ca 0.01 0.92 -0.29 0.00 0.00 0.00 0.00 61.98 62.62 1xkq s VAL 64 Cb -0.13 -3.84 0.10 0.00 0.00 0.00 0.00 36.38 32.51 1xkq s VAL 64 CO -0.05 0.10 0.94 0.00 0.00 0.00 0.00 175.10 176.09 1xkq s ALA 65 N 2.18 -1.83 -0.40 5.51 0.00 0.01 -4.95 121.76 122.28 1xkq s ALA 65 Ca 0.22 0.92 -0.16 0.00 0.00 0.00 0.00 51.96 52.95 1xkq s ALA 65 Cb -0.16 0.40 0.01 0.00 0.00 0.00 0.00 23.12 23.38 1xkq s ALA 65 CO 0.09 -0.74 0.35 0.34 0.00 0.00 0.00 175.76 175.79 1xkq s ASP 66 N -2.54 6.14 0.00 0.00 -1.08 -1.26 -3.72 116.67 114.21 1xkq s ASP 66 Ca 0.07 -0.69 0.14 0.00 -0.52 0.00 0.00 52.55 51.54 1xkq s ASP 66 Cb -0.01 -2.18 0.70 0.00 -1.46 0.00 0.00 42.92 39.97 1xkq s ASP 66 CO -0.07 -0.46 1.36 0.55 0.52 0.00 0.00 175.17 177.08 1xkq n VAL 67 N 5.26 0.60 1.00 1.11 3.14 -1.26 -2.37 118.33 125.80 1xkq n VAL 67 Ca -0.10 0.15 0.12 0.00 -2.96 0.00 0.00 64.34 61.55 1xkq n VAL 67 Cb 0.48 -0.92 0.23 0.00 -1.06 0.00 0.00 33.84 32.56 1xkq n VAL 67 CO 0.00 0.00 0.00 0.35 -6.46 0.00 0.00 176.83 170.72 1xkq n THR 68 N -1.28 0.00 -4.00 1.55 -2.24 -1.26 -4.64 114.28 102.41 1xkq n THR 68 Ca 0.07 -0.00 -0.29 0.00 -2.27 0.00 0.00 64.05 61.56 1xkq n THR 68 Cb 0.11 0.28 -0.05 0.00 -2.10 0.00 0.00 70.33 68.57 1xkq n THR 68 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1xkq s THR 69 N -3.00 4.91 0.21 4.28 -4.23 -1.00 -4.92 115.64 111.89 1xkq s THR 69 Ca 0.11 -0.71 -0.09 0.00 -1.18 0.00 0.00 61.69 59.82 1xkq s THR 69 Cb 0.17 -3.43 0.15 0.00 1.34 0.00 0.00 72.50 70.73 1xkq s THR 69 CO 0.71 0.04 1.84 -0.33 -0.54 0.00 0.00 174.62 176.34 1xkq h GLU 70 N 2.84 0.82 -0.45 3.99 4.39 -1.91 -1.72 114.58 122.54 1xkq h GLU 70 Ca -0.47 -0.05 -0.04 0.00 0.34 0.00 0.00 59.36 59.14 1xkq h GLU 70 Cb 1.18 -0.19 -0.02 0.00 -0.10 0.00 0.00 28.75 29.62 1xkq h GLU 70 CO 0.69 0.54 0.12 0.22 -1.16 0.00 0.00 179.01 179.42 1xkq h ASP 71 N 0.85 0.68 -0.65 1.42 3.58 -1.95 -1.64 116.42 118.70 1xkq h ASP 71 Ca 0.30 -0.23 -0.06 0.00 0.42 0.00 0.00 57.03 57.46 1xkq h ASP 71 Cb 0.07 -0.18 -0.03 0.00 1.72 0.00 0.00 39.33 40.91 1xkq h ASP 71 CO -0.13 0.73 0.18 1.23 -2.88 0.00 0.00 179.24 178.37 1xkq h GLY 72 N 0.60 1.11 0.91 -0.78 0.00 -1.61 -1.37 103.07 101.93 1xkq h GLY 72 Ca 0.14 -0.68 -0.02 0.00 0.00 0.00 0.00 47.33 46.78 1xkq h GLY 72 CO 0.00 0.63 0.10 1.46 0.00 0.00 0.00 176.54 178.74 1xkq h GLN 73 N 0.96 0.40 -0.78 4.80 4.20 -1.21 -2.08 115.11 121.40 1xkq h GLN 73 Ca 0.21 -0.07 -0.04 0.00 0.06 0.00 0.00 58.65 58.80 1xkq h GLN 73 Cb 0.33 -0.06 -0.04 0.00 0.30 0.00 0.00 27.48 28.01 1xkq h GLN 73 CO -0.00 0.44 0.33 -0.44 -0.67 0.00 0.00 178.83 178.49 1xkq h ASP 74 N 0.28 1.05 -0.53 1.46 3.32 -1.17 -2.60 116.42 118.24 1xkq h ASP 74 Ca 0.09 -0.15 -0.02 0.00 0.02 0.00 0.00 57.03 56.97 1xkq h ASP 74 Cb 0.19 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.44 1xkq h ASP 74 CO -0.01 0.92 0.26 -0.61 -1.72 0.00 0.00 179.24 178.08 1xkq h GLN 75 N 1.13 0.76 0.08 3.56 5.75 -1.07 0.24 115.11 125.56 1xkq h GLN 75 Ca 0.26 -0.11 0.00 0.00 -0.15 0.00 0.00 58.65 58.66 1xkq h GLN 75 Cb 0.18 -0.14 -0.01 0.00 1.07 0.00 0.00 27.48 28.58 1xkq h GLN 75 CO -0.03 0.62 -0.09 0.82 -2.65 0.00 0.00 178.83 177.51 1xkq h ILE 76 N 0.70 0.80 0.08 2.39 2.04 -1.14 -0.54 117.51 121.84 1xkq h ILE 76 Ca 0.18 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 66.04 1xkq h ILE 76 Cb 0.11 0.80 0.00 0.00 -0.74 0.00 0.00 36.82 36.99 1xkq h ILE 76 CO -0.02 0.00 -0.04 0.40 0.00 0.00 0.00 178.15 178.49 1xkq h ILE 77 N -0.19 1.17 -0.89 -0.67 2.04 -1.37 -2.92 117.51 114.68 1xkq h ILE 77 Ca 0.01 -0.97 -0.00 0.00 1.00 0.00 0.00 64.86 64.89 1xkq h ILE 77 Cb 0.19 1.79 -0.04 0.00 -0.74 0.00 0.00 36.82 38.01 1xkq h ILE 77 CO -0.03 0.24 0.54 0.78 0.00 0.00 0.00 178.15 179.67 1xkq h ASN 78 N -0.56 1.06 0.38 1.72 -0.26 -0.53 -1.34 115.58 116.05 1xkq h ASN 78 Ca -0.01 -0.07 -0.09 0.00 -0.56 0.00 0.00 56.30 55.57 1xkq h ASN 78 Cb 0.47 -0.27 -0.01 0.00 -1.06 0.00 0.00 38.32 37.45 1xkq h ASN 78 CO 0.02 0.81 -0.42 0.77 -1.06 0.00 0.00 177.43 177.55 1xkq h SER 79 N 1.22 0.06 -0.36 5.81 4.64 -1.19 -1.06 113.55 122.66 1xkq h SER 79 Ca 0.32 -0.02 -0.07 0.00 -0.47 0.00 0.00 61.79 61.54 1xkq h SER 79 Cb -0.05 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 62.01 1xkq h SER 79 CO -0.06 0.47 -0.05 0.74 -0.87 0.00 0.00 176.83 177.06 1xkq h THR 80 N 0.05 1.27 -0.38 2.95 2.02 -1.14 -1.51 112.91 116.17 1xkq h THR 80 Ca 0.00 -1.09 -0.08 0.00 0.77 0.00 0.00 66.41 66.01 1xkq h THR 80 Cb 0.76 1.26 -0.01 0.00 -1.74 0.00 0.00 68.15 68.41 1xkq h THR 80 CO 0.06 0.36 -0.09 -0.07 0.37 0.00 0.00 175.52 176.14 1xkq h LEU 81 N 0.47 0.74 -1.45 2.58 3.38 -1.02 0.20 115.31 120.20 1xkq h LEU 81 Ca 0.09 -0.36 -0.05 0.00 0.09 0.00 0.00 57.88 57.65 1xkq h LEU 81 Cb 0.54 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 1xkq h LEU 81 CO 0.03 0.93 -0.22 0.11 0.09 0.00 0.00 178.44 179.38 1xkq h LYS 82 N 0.53 0.00 0.07 1.13 1.57 -1.17 0.26 116.57 118.96 1xkq h LYS 82 Ca 0.10 0.00 -0.31 0.00 -1.87 0.00 0.00 60.65 58.57 1xkq h LYS 82 Cb 0.61 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.89 1xkq h LYS 82 CO 0.04 0.22 -1.68 0.94 -0.57 0.00 0.00 179.45 178.40 1xkq n GLN 83 N -3.61 0.67 -0.00 3.15 -0.06 -0.57 -4.64 117.38 112.32 1xkq n GLN 83 Ca -0.01 0.40 0.06 0.00 -2.00 0.00 0.00 57.00 55.45 1xkq n GLN 83 Cb 0.36 -1.72 -0.08 0.00 -4.06 0.00 0.00 30.24 24.73 1xkq n GLN 83 CO 0.00 0.00 0.00 1.19 -0.20 0.00 0.00 177.06 178.05 1xkq n PHE 84 N -3.92 0.00 -0.29 3.69 3.72 0.05 -5.02 117.46 115.70 1xkq n PHE 84 Ca -0.32 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.08 1xkq n PHE 84 Cb 0.88 -0.09 0.00 0.00 -0.94 0.00 0.00 39.48 39.33 1xkq n PHE 84 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1xkq n GLY 85 N 1.44 1.78 3.83 1.37 0.00 0.91 -4.97 105.19 109.56 1xkq n GLY 85 Ca 0.01 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.02 1xkq n GLY 85 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xkq s LYS 86 N -0.23 0.92 -0.05 1.61 -2.85 -1.26 -4.99 119.74 112.89 1xkq s LYS 86 Ca 0.00 -0.56 -0.01 0.00 -1.00 0.00 0.00 55.97 54.40 1xkq s LYS 86 Cb 0.00 0.27 0.03 0.00 -2.06 0.00 0.00 37.83 36.07 1xkq s LYS 86 CO 0.00 -0.43 0.01 0.42 0.10 0.00 0.00 175.35 175.45 1xkq s ILE 87 N -2.39 0.23 -0.18 3.79 1.01 -1.26 -4.64 121.20 117.76 1xkq s ILE 87 Ca 0.20 0.17 0.06 0.00 0.00 0.00 0.00 60.65 61.08 1xkq s ILE 87 Cb -0.00 -0.39 -0.15 0.00 0.01 0.00 0.00 42.46 41.93 1xkq s ILE 87 CO 0.02 0.21 -0.08 0.47 0.00 0.00 0.00 174.94 175.56 1xkq n ASP 88 N 4.86 1.97 -3.86 3.58 8.00 -0.10 -4.35 116.55 126.65 1xkq n ASP 88 Ca -0.12 -0.06 -0.13 0.00 0.71 0.00 0.00 54.79 55.19 1xkq n ASP 88 Cb 0.50 0.17 -0.14 0.00 -0.02 0.00 0.00 41.12 41.63 1xkq n ASP 88 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1xkq s VAL 89 N -2.38 0.03 -0.15 2.53 1.01 -0.46 -0.90 120.40 120.07 1xkq s VAL 89 Ca -0.19 0.01 0.01 0.00 0.00 0.00 0.00 61.98 61.81 1xkq s VAL 89 Cb 0.06 -0.05 0.02 0.00 0.00 0.00 0.00 36.38 36.41 1xkq s VAL 89 CO 0.52 0.02 -0.16 -0.22 0.00 0.00 0.00 175.10 175.27 1xkq s LEU 90 N 0.14 1.78 -0.32 3.92 2.96 -0.48 -1.29 118.68 125.39 1xkq s LEU 90 Ca -0.01 -0.51 -0.04 0.00 -0.22 0.00 0.00 54.13 53.35 1xkq s LEU 90 Cb -0.02 -1.23 0.04 0.00 0.50 0.00 0.00 46.19 45.48 1xkq s LEU 90 CO -0.00 -0.03 0.05 0.54 -1.32 0.00 0.00 176.35 175.59 1xkq s VAL 91 N 1.34 3.42 -1.02 1.68 0.11 -0.15 -1.15 120.40 124.64 1xkq s VAL 91 Ca 0.02 -1.21 -0.19 0.00 -2.93 0.00 0.00 61.98 57.68 1xkq s VAL 91 Cb -0.13 -2.93 0.11 0.00 -1.53 0.00 0.00 36.38 31.90 1xkq s VAL 91 CO -0.09 -0.12 1.29 0.20 -3.33 0.00 0.00 175.10 173.05 1xkq s ASN 92 N 1.34 6.68 -0.20 3.54 0.01 -0.21 -2.20 114.94 123.90 1xkq s ASN 92 Ca -0.03 -2.07 0.15 0.00 -0.71 0.00 0.00 52.86 50.20 1xkq s ASN 92 Cb -0.19 -2.45 -0.23 0.00 0.41 0.00 0.00 41.25 38.78 1xkq s ASN 92 CO 0.01 -1.13 0.03 -3.20 -1.51 0.00 0.00 177.10 171.30 1xkq n ASN 93 N 7.08 0.41 -4.66 -1.22 5.15 -1.25 -1.26 115.26 119.51 1xkq n ASN 93 Ca 0.30 -0.02 -0.46 0.00 -0.60 0.00 0.00 54.58 53.80 1xkq n ASN 93 Cb 0.48 0.82 -0.03 0.00 -0.53 0.00 0.00 39.78 40.52 1xkq n ASN 93 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1xkq n ALA 94 N -2.78 0.91 0.00 5.20 0.00 -1.21 -4.84 120.51 117.78 1xkq n ALA 94 Ca -0.33 0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.53 1xkq n ALA 94 Cb 1.12 -2.26 0.00 0.00 0.00 0.00 0.00 19.45 18.31 1xkq n ALA 94 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xkq n GLY 95 N 2.35 0.50 3.62 0.00 0.00 -1.26 -4.75 105.19 105.65 1xkq n GLY 95 Ca 0.13 -0.79 -0.04 0.00 0.00 0.00 0.00 46.02 45.31 1xkq n GLY 95 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xkq s ALA 96 N -2.00 -2.07 -0.97 4.61 0.00 -1.26 -5.06 121.76 115.01 1xkq s ALA 96 Ca 0.00 1.80 -0.17 0.00 0.00 0.00 0.00 51.96 53.59 1xkq s ALA 96 Cb 0.00 -1.23 0.16 0.00 0.00 0.00 0.00 23.12 22.05 1xkq s ALA 96 CO 0.00 -0.28 1.13 0.00 0.00 0.00 0.00 175.76 176.61 1xkq s ALA 97 N -1.12 3.65 0.08 0.00 0.00 -1.26 -4.88 121.76 118.23 1xkq s ALA 97 Ca 0.06 -3.00 -0.32 0.00 0.00 0.00 0.00 51.96 48.70 1xkq s ALA 97 Cb -0.01 -3.97 -0.11 0.00 0.00 0.00 0.00 23.12 19.04 1xkq s ALA 97 CO -0.05 -2.81 1.85 -0.89 0.00 0.00 0.00 175.76 173.86 1xkq n ILE 98 N 5.00 0.45 -2.23 0.00 2.08 -1.26 -4.74 119.36 118.65 1xkq n ILE 98 Ca 0.25 -0.08 -0.32 0.00 0.56 0.00 0.00 62.75 63.16 1xkq n ILE 98 Cb 0.47 -2.08 -0.02 0.00 -0.75 0.00 0.00 39.64 37.26 1xkq n ILE 98 CO 0.00 0.00 0.00 -2.16 0.56 0.00 0.00 176.55 174.95 1xkq s PRO 99 N 3.12 3.83 0.15 0.38 0.04 -1.26 -4.99 135.00 136.28 1xkq s PRO 99 Ca 0.85 0.88 -0.30 0.00 0.04 0.00 0.00 61.00 62.46 1xkq s PRO 99 Cb -0.52 -2.12 -0.07 0.00 0.04 0.00 0.00 34.50 31.83 1xkq s PRO 99 CO 0.40 -0.36 1.03 0.34 0.04 0.00 0.00 177.00 178.45 1xkq s ASP 100 N -3.44 7.39 0.60 6.66 -1.08 -1.26 -4.92 116.67 120.61 1xkq s ASP 100 Ca 0.57 1.96 0.30 0.00 -0.52 0.00 0.00 52.55 54.86 1xkq s ASP 100 Cb -0.10 -2.60 1.77 0.00 -1.46 0.00 0.00 42.92 40.53 1xkq s ASP 100 CO 0.39 -0.13 2.17 0.00 0.52 0.00 0.00 175.17 178.12 1xkq h ALA 101 N 5.23 1.64 -0.49 3.66 0.00 -1.96 0.17 119.26 127.51 1xkq h ALA 101 Ca -0.44 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1xkq h ALA 101 Cb 1.21 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1xkq h ALA 101 CO 0.72 -0.17 0.00 1.19 0.00 0.00 0.00 179.25 180.99 1xkq n PHE 102 N -3.75 1.47 -1.14 0.00 3.72 -1.26 -4.93 117.46 111.57 1xkq n PHE 102 Ca -0.01 -0.72 -0.05 0.00 -0.05 0.00 0.00 57.45 56.63 1xkq n PHE 102 Cb 0.22 -0.34 -0.02 0.00 -0.94 0.00 0.00 39.48 38.40 1xkq n PHE 102 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1xkq n GLY 103 N 0.45 0.63 3.76 1.37 0.00 0.05 -4.97 105.19 106.47 1xkq n GLY 103 Ca 0.24 -0.13 -0.40 0.00 0.00 0.00 0.00 46.02 45.73 1xkq n GLY 103 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xkq s THR 104 N -1.76 3.73 0.34 2.61 2.01 -1.26 -4.92 115.64 116.40 1xkq s THR 104 Ca 0.00 1.70 0.04 0.00 0.31 0.00 0.00 61.69 63.73 1xkq s THR 104 Cb 0.00 -4.06 -0.06 0.00 0.01 0.00 0.00 72.50 68.39 1xkq s THR 104 CO 0.00 0.37 0.07 0.42 -0.69 0.00 0.00 174.62 174.78 1xkq s THR 105 N -1.23 1.09 0.00 -0.82 -4.23 -1.26 -4.31 115.64 104.88 1xkq s THR 105 Ca 0.45 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.96 1xkq s THR 105 Cb -0.28 -2.72 0.00 0.00 1.34 0.00 0.00 72.50 70.84 1xkq s THR 105 CO 0.36 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 175.05 1xkq n GLY 106 N -0.72 -1.81 0.34 3.99 0.00 0.21 -4.05 105.19 103.15 1xkq n GLY 106 Ca -0.03 -1.50 0.16 0.00 0.00 0.00 0.00 46.02 44.65 1xkq n GLY 106 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1xkq h THR 107 N 0.00 0.72 0.00 2.61 2.02 -1.88 -1.63 112.91 114.76 1xkq h THR 107 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 1xkq h THR 107 Cb 0.00 0.83 0.00 0.00 -1.74 0.00 0.00 68.15 67.24 1xkq h THR 107 CO 0.00 0.00 0.00 0.47 0.37 0.00 0.00 175.52 176.36 1xkq n ASP 108 N -4.25 0.56 -4.60 4.18 8.00 -1.26 -4.83 116.55 114.36 1xkq n ASP 108 Ca 0.04 0.63 -0.47 0.00 0.71 0.00 0.00 54.79 55.70 1xkq n ASP 108 Cb 0.39 -0.75 -0.03 0.00 -0.02 0.00 0.00 41.12 40.71 1xkq n ASP 108 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1xkq n GLN 109 N -2.11 1.35 -1.56 -1.24 6.02 -0.61 -4.86 117.38 114.36 1xkq n GLN 109 Ca 0.03 0.48 -0.36 0.00 -0.01 0.00 0.00 57.00 57.14 1xkq n GLN 109 Cb 0.23 -1.98 0.09 0.00 1.02 0.00 0.00 30.24 29.60 1xkq n GLN 109 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 1xkq s GLY 110 N -0.06 2.65 0.46 1.08 0.00 -1.26 -4.91 107.32 105.28 1xkq s GLY 110 Ca 0.69 1.10 0.16 0.00 0.00 0.00 0.00 44.72 46.67 1xkq s GLY 110 CO 0.53 1.53 2.01 1.19 0.00 0.00 0.00 173.10 178.36 1xkq h ILE 111 N 0.12 1.08 -0.68 0.90 6.09 -1.96 -1.89 117.51 121.17 1xkq h ILE 111 Ca -0.50 -0.56 0.04 0.00 -1.37 0.00 0.00 64.86 62.47 1xkq h ILE 111 Cb 1.32 1.31 -0.04 0.00 0.47 0.00 0.00 36.82 39.88 1xkq h ILE 111 CO 0.51 0.16 0.45 -0.78 -3.07 0.00 0.00 178.15 175.42 1xkq h ASP 112 N 0.00 0.68 0.68 2.19 3.58 -2.01 0.38 116.42 121.93 1xkq h ASP 112 Ca -0.00 -0.01 -0.10 0.00 0.42 0.00 0.00 57.03 57.34 1xkq h ASP 112 Cb 0.29 -0.16 -0.01 0.00 1.72 0.00 0.00 39.33 41.17 1xkq h ASP 112 CO 0.02 0.46 -0.47 0.40 -2.88 0.00 0.00 179.24 176.78 1xkq h ILE 113 N 0.79 1.15 0.01 2.25 1.08 -1.70 -2.35 117.51 118.74 1xkq h ILE 113 Ca 0.28 -1.72 -0.00 0.00 -0.39 0.00 0.00 64.86 63.03 1xkq h ILE 113 Cb 0.11 1.98 0.00 0.00 -3.07 0.00 0.00 36.82 35.83 1xkq h ILE 113 CO -0.08 0.46 -0.01 0.22 -0.69 0.00 0.00 178.15 178.06 1xkq h TYR 114 N 0.00 -0.01 -0.50 1.37 3.20 -0.87 -1.63 116.97 118.52 1xkq h TYR 114 Ca -0.00 -0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.85 1xkq h TYR 114 Cb 0.94 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 39.19 1xkq h TYR 114 CO 0.00 0.12 0.24 0.45 -1.64 0.00 0.00 178.16 177.34 1xkq h HIS 115 N -0.15 0.71 -0.29 -3.82 3.86 -1.26 -1.99 115.15 112.22 1xkq h HIS 115 Ca -0.00 -0.03 -0.06 0.00 -1.16 0.00 0.00 60.37 59.12 1xkq h HIS 115 Cb 0.14 -0.22 -0.01 0.00 1.06 0.00 0.00 27.41 28.38 1xkq h HIS 115 CO -0.03 0.56 -0.05 0.87 0.86 0.00 0.00 177.93 180.14 1xkq h LYS 116 N 0.66 0.54 0.03 2.45 1.57 -1.43 -2.17 116.57 118.23 1xkq h LYS 116 Ca 0.17 -0.20 -0.00 0.00 -1.87 0.00 0.00 60.65 58.75 1xkq h LYS 116 Cb 0.11 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.38 1xkq h LYS 116 CO -0.02 0.73 -0.02 1.15 -0.57 0.00 0.00 179.45 180.72 1xkq h THR 117 N 0.31 0.98 -0.01 -0.16 2.02 -1.22 -2.57 112.91 112.26 1xkq h THR 117 Ca 0.08 -0.03 -0.10 0.00 0.77 0.00 0.00 66.41 67.12 1xkq h THR 117 Cb 0.52 1.00 -0.01 0.00 -1.74 0.00 0.00 68.15 67.92 1xkq h THR 117 CO 0.02 0.01 -0.46 -0.07 0.37 0.00 0.00 175.52 175.40 1xkq h LEU 118 N -0.06 0.02 -1.26 2.58 4.07 -1.42 0.29 115.31 119.52 1xkq h LEU 118 Ca -0.00 -0.01 -0.08 0.00 0.08 0.00 0.00 57.88 57.87 1xkq h LEU 118 Cb 0.05 -0.01 -0.01 0.00 1.08 0.00 0.00 40.66 41.77 1xkq h LEU 118 CO 0.01 0.48 -0.37 0.50 -1.08 0.00 0.00 178.44 177.98 1xkq h LYS 119 N 0.02 0.00 0.00 1.13 3.64 -1.16 0.22 116.57 120.42 1xkq h LYS 119 Ca -0.00 0.00 -0.10 0.00 -1.27 0.00 0.00 60.65 59.27 1xkq h LYS 119 Cb 0.82 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.62 1xkq h LYS 119 CO 0.06 0.37 -0.82 1.25 -2.27 0.00 0.00 179.45 178.03 1xkq h LEU 120 N 0.00 0.00 -0.07 5.20 5.85 -1.23 -1.79 115.31 123.28 1xkq h LEU 120 Ca -0.00 -0.25 0.00 0.00 0.84 0.00 0.00 57.88 58.47 1xkq h LEU 120 Cb 0.66 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.69 1xkq h LEU 120 CO 0.05 1.08 0.00 0.59 -0.34 0.00 0.00 178.44 179.82 1xkq n ASN 121 N -4.54 0.32 0.08 1.25 3.02 0.07 -4.07 115.26 111.40 1xkq n ASN 121 Ca -0.18 0.54 0.00 0.00 -0.03 0.00 0.00 54.58 54.91 1xkq n ASN 121 Cb 0.45 -0.62 0.00 0.00 -0.61 0.00 0.00 39.78 39.00 1xkq n ASN 121 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 1xkq n LEU 122 N -1.81 0.34 -0.20 3.41 7.94 -0.37 -4.75 117.00 121.56 1xkq n LEU 122 Ca 0.06 0.26 -0.00 0.00 -1.11 0.00 0.00 56.01 55.22 1xkq n LEU 122 Cb 0.33 0.05 0.10 0.00 0.53 0.00 0.00 43.42 44.44 1xkq n LEU 122 CO 0.25 -0.72 0.97 -0.61 -1.11 0.00 0.00 177.39 176.18 1xkq h GLN 123 N 0.00 0.37 -0.96 1.96 4.15 -0.72 -1.64 115.11 118.26 1xkq h GLN 123 Ca 0.00 -0.02 0.05 0.00 0.77 0.00 0.00 58.65 59.45 1xkq h GLN 123 Cb 0.00 -0.08 -0.06 0.00 0.21 0.00 0.00 27.48 27.55 1xkq h GLN 123 CO 0.00 0.25 0.62 0.00 -1.93 0.00 0.00 178.83 177.77 1xkq h ALA 124 N 1.42 1.31 -0.56 3.38 0.00 -1.46 0.44 119.26 123.78 1xkq h ALA 124 Ca 0.30 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.14 1xkq h ALA 124 Cb 0.38 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1xkq h ALA 124 CO -0.31 0.45 0.19 0.28 0.00 0.00 0.00 179.25 179.86 1xkq h VAL 125 N 1.17 1.23 -0.46 0.00 2.07 -1.54 -0.44 116.25 118.28 1xkq h VAL 125 Ca 0.40 -0.78 -0.08 0.00 0.82 0.00 0.00 66.70 67.06 1xkq h VAL 125 Cb 0.09 0.69 -0.02 0.00 -1.52 0.00 0.00 31.29 30.53 1xkq h VAL 125 CO -0.15 0.29 -0.03 0.40 0.02 0.00 0.00 177.57 178.10 1xkq h ILE 126 N 0.78 1.27 -0.13 4.57 2.04 -0.57 -0.89 117.51 124.58 1xkq h ILE 126 Ca 0.18 -1.11 -0.16 0.00 1.00 0.00 0.00 64.86 64.77 1xkq h ILE 126 Cb 0.26 1.05 -0.01 0.00 -0.74 0.00 0.00 36.82 37.39 1xkq h ILE 126 CO -0.01 0.38 -0.59 -0.33 0.00 0.00 0.00 178.15 177.61 1xkq h GLU 127 N 0.69 0.44 -0.23 2.37 5.08 -0.82 -1.21 114.58 120.90 1xkq h GLU 127 Ca 0.13 -0.29 -0.13 0.00 -1.00 0.00 0.00 59.36 58.07 1xkq h GLU 127 Cb 0.55 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.83 1xkq h GLU 127 CO 0.03 0.90 -0.40 0.52 -1.00 0.00 0.00 179.01 179.06 1xkq h MET 128 N 0.33 0.53 0.04 2.33 2.86 -1.01 -0.87 114.93 119.14 1xkq h MET 128 Ca -0.00 -0.26 -0.00 0.00 -2.06 0.00 0.00 59.70 57.37 1xkq h MET 128 Cb 1.12 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.78 1xkq h MET 128 CO 0.10 0.84 -0.02 1.15 1.06 0.00 0.00 176.91 180.04 1xkq h THR 129 N 0.44 1.11 -0.84 2.22 2.02 -0.95 -0.68 112.91 116.23 1xkq h THR 129 Ca 0.04 -0.46 -0.02 0.00 0.77 0.00 0.00 66.41 66.73 1xkq h THR 129 Cb 0.88 1.41 -0.04 0.00 -1.74 0.00 0.00 68.15 68.67 1xkq h THR 129 CO 0.08 0.12 0.43 0.11 0.37 0.00 0.00 175.52 176.63 1xkq h LYS 130 N -0.26 1.19 0.00 6.66 1.57 -1.15 -0.89 116.57 123.69 1xkq h LYS 130 Ca -0.01 -0.15 -0.12 0.00 -1.87 0.00 0.00 60.65 58.50 1xkq h LYS 130 Cb 0.23 -0.22 -0.02 0.00 0.08 0.00 0.00 32.23 32.30 1xkq h LYS 130 CO 0.01 0.89 -0.57 0.87 -0.57 0.00 0.00 179.45 180.08 1xkq h LYS 131 N 1.18 0.00 0.00 3.15 1.57 -1.05 -3.21 116.57 118.22 1xkq h LYS 131 Ca 0.29 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 59.01 1xkq h LYS 131 Cb 0.07 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.37 1xkq h LYS 131 CO -0.04 0.57 -1.14 -0.39 -0.57 0.00 0.00 179.45 177.87 1xkq h VAL 132 N 0.00 0.19 -0.89 0.50 -1.51 -0.97 -3.41 116.25 110.17 1xkq h VAL 132 Ca -0.01 -1.38 0.15 0.00 -1.23 0.00 0.00 66.70 64.23 1xkq h VAL 132 Cb 1.26 1.71 -0.16 0.00 -2.13 0.00 0.00 31.29 31.97 1xkq h VAL 132 CO 0.07 0.11 -0.33 0.50 -1.23 0.00 0.00 177.57 176.70 1xkq h LYS 133 N 0.00 -0.03 -0.60 5.19 3.64 -1.16 0.03 116.57 123.64 1xkq h LYS 133 Ca -0.06 0.00 0.05 0.00 -1.27 0.00 0.00 60.65 59.37 1xkq h LYS 133 Cb 1.22 0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 33.02 1xkq h LYS 133 CO 0.02 -0.02 0.40 -1.00 -2.27 0.00 0.00 179.45 176.58 1xkq h PRO 134 N -0.03 0.62 0.00 1.90 0.13 -1.79 0.46 132.00 133.29 1xkq h PRO 134 Ca 0.35 -0.04 -0.19 0.00 -0.87 0.00 0.00 66.00 65.26 1xkq h PRO 134 Cb 0.61 -0.14 -0.02 0.00 0.13 0.00 0.00 31.00 31.58 1xkq h PRO 134 CO -0.91 0.41 -0.86 0.45 -0.23 0.00 0.00 178.00 176.86 1xkq h HIS 135 N 0.64 0.18 0.00 1.56 3.86 -1.32 -2.81 115.15 117.25 1xkq h HIS 135 Ca 0.25 -0.10 -0.12 0.00 -1.16 0.00 0.00 60.37 59.24 1xkq h HIS 135 Cb 0.19 -0.02 -0.02 0.00 1.06 0.00 0.00 27.41 28.63 1xkq h HIS 135 CO -0.00 0.91 -0.59 -0.07 0.86 0.00 0.00 177.93 179.04 1xkq h LEU 136 N 0.06 0.00 -0.32 2.43 3.38 -0.59 -2.08 115.31 118.19 1xkq h LEU 136 Ca -0.03 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.90 1xkq h LEU 136 Cb 1.49 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.22 1xkq h LEU 136 CO 0.12 0.59 0.06 0.58 0.09 0.00 0.00 178.44 179.88 1xkq h VAL 137 N 0.00 1.23 -0.32 1.22 2.07 -0.83 0.97 116.25 120.60 1xkq h VAL 137 Ca -0.01 -0.80 -0.08 0.00 0.82 0.00 0.00 66.70 66.63 1xkq h VAL 137 Cb 1.24 1.14 -0.02 0.00 -1.52 0.00 0.00 31.29 32.13 1xkq h VAL 137 CO 0.08 0.27 -0.16 0.00 0.02 0.00 0.00 177.57 177.78 1xkq h ALA 138 N 0.89 1.14 -0.01 1.67 0.00 -1.37 -2.99 119.26 118.59 1xkq h ALA 138 Ca 0.10 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1xkq h ALA 138 Cb 0.34 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1xkq h ALA 138 CO 0.01 0.54 -0.45 -1.13 0.00 0.00 0.00 179.25 178.22 1xkq n SER 139 N -4.17 1.83 -3.75 0.00 3.41 -0.79 -4.96 113.62 105.18 1xkq n SER 139 Ca 0.00 -1.39 -0.29 0.00 -0.26 0.00 0.00 58.87 56.93 1xkq n SER 139 Cb 0.36 0.43 0.03 0.00 -0.26 0.00 0.00 64.21 64.76 1xkq n SER 139 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1xkq n LYS 140 N -0.17 -2.11 0.00 4.33 5.02 0.32 -4.96 118.16 120.59 1xkq n LYS 140 Ca 0.10 0.46 0.00 0.00 -2.02 0.00 0.00 58.31 56.85 1xkq n LYS 140 Cb 0.44 -4.33 0.00 0.00 -0.02 0.00 0.00 35.03 31.12 1xkq n LYS 140 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1xkq n GLY 141 N -1.75 1.26 3.34 0.72 0.00 -0.36 -4.75 105.19 103.65 1xkq n GLY 141 Ca -0.17 -1.66 -0.10 0.00 0.00 0.00 0.00 46.02 44.10 1xkq n GLY 141 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1xkq s GLU 142 N 1.56 1.10 -0.03 1.61 2.02 -0.08 -2.46 118.70 122.41 1xkq s GLU 142 Ca 0.00 -0.88 0.03 0.00 0.02 0.00 0.00 54.97 54.14 1xkq s GLU 142 Cb 0.00 0.44 0.00 0.00 0.10 0.00 0.00 34.13 34.67 1xkq s GLU 142 CO 0.00 -0.42 -0.11 0.42 0.02 0.00 0.00 175.26 175.17 1xkq s ILE 143 N -3.86 0.97 -0.17 -1.63 1.01 0.05 -1.39 121.20 116.17 1xkq s ILE 143 Ca 0.07 -0.46 -0.01 0.00 0.00 0.00 0.00 60.65 60.25 1xkq s ILE 143 Cb 0.02 -0.85 0.04 0.00 0.01 0.00 0.00 42.46 41.69 1xkq s ILE 143 CO -0.08 0.29 -0.04 -0.69 0.00 0.00 0.00 174.94 174.43 1xkq s VAL 144 N 0.16 1.04 0.27 2.92 1.01 -0.30 -0.85 120.40 124.66 1xkq s VAL 144 Ca -0.03 -0.64 0.04 0.00 0.00 0.00 0.00 61.98 61.34 1xkq s VAL 144 Cb -0.10 -1.26 -0.03 0.00 0.00 0.00 0.00 36.38 34.99 1xkq s VAL 144 CO 0.01 0.07 0.42 0.20 0.00 0.00 0.00 175.10 175.80 1xkq s ASN 145 N 1.66 6.31 -0.28 3.32 0.01 -0.34 -1.05 114.94 124.57 1xkq s ASN 145 Ca 0.00 0.19 0.00 0.00 -0.71 0.00 0.00 52.86 52.35 1xkq s ASN 145 Cb -0.16 -1.91 0.05 0.00 0.41 0.00 0.00 41.25 39.64 1xkq s ASN 145 CO -0.07 -0.14 -0.05 -0.69 -1.51 0.00 0.00 177.10 174.63 1xkq s VAL 146 N -2.09 2.60 0.00 1.60 1.01 -0.39 -1.59 120.40 121.55 1xkq s VAL 146 Ca 0.36 -1.50 0.00 0.00 0.00 0.00 0.00 61.98 60.84 1xkq s VAL 146 Cb -0.09 -2.51 0.00 0.00 0.00 0.00 0.00 36.38 33.78 1xkq s VAL 146 CO 0.31 -0.06 0.00 -0.24 0.00 0.00 0.00 175.10 175.11 1xkq n SER 147 N 4.53 0.00 -3.64 3.32 2.88 0.04 -4.89 113.62 115.87 1xkq n SER 147 Ca -0.14 0.00 -0.02 0.00 -1.33 0.00 0.00 58.87 57.38 1xkq n SER 147 Cb 0.43 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.85 1xkq n SER 147 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1xkq s SER 148 N -1.00 -0.04 0.20 -3.46 0.15 -1.26 -4.34 113.70 103.95 1xkq s SER 148 Ca 0.00 0.04 0.19 0.00 0.70 0.00 0.00 55.95 56.87 1xkq s SER 148 Cb 0.00 0.03 0.86 0.00 -1.71 0.00 0.00 66.02 65.20 1xkq s SER 148 CO 0.00 -0.04 1.57 2.30 1.20 0.00 0.00 173.24 178.27 1xkq n ILE 149 N 0.43 1.05 0.39 6.45 -5.35 -1.05 -1.77 119.36 119.51 1xkq n ILE 149 Ca 0.01 0.40 0.09 0.00 -0.27 0.00 0.00 62.75 62.98 1xkq n ILE 149 Cb 0.58 -1.33 0.38 0.00 -1.74 0.00 0.00 39.64 37.54 1xkq n ILE 149 CO 0.00 0.00 0.00 0.52 -1.76 0.00 0.00 176.55 175.31 1xkq n VAL 150 N -2.03 1.01 0.26 7.28 0.31 -1.26 -2.35 118.33 121.55 1xkq n VAL 150 Ca 0.01 0.30 0.14 0.00 -0.01 0.00 0.00 64.34 64.78 1xkq n VAL 150 Cb 0.14 -1.17 0.72 0.00 -0.91 0.00 0.00 33.84 32.63 1xkq n VAL 150 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1xkq h ALA 151 N 2.32 1.19 0.00 3.52 0.00 -1.52 -3.43 119.26 121.34 1xkq h ALA 151 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1xkq h ALA 151 Cb 0.26 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1xkq h ALA 151 CO 0.00 0.14 0.00 0.41 0.00 0.00 0.00 179.25 179.80 1xkq n GLY 152 N -0.52 1.01 0.00 0.00 0.00 -0.99 -4.40 105.19 100.29 1xkq n GLY 152 Ca -0.01 -1.94 0.11 0.00 0.00 0.00 0.00 46.02 44.18 1xkq n GLY 152 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1xkq n PRO 153 N -1.22 0.08 -2.35 1.61 -0.04 -1.26 -4.85 135.00 126.97 1xkq n PRO 153 Ca 0.00 0.09 -0.32 0.00 -0.04 0.00 0.00 63.50 63.22 1xkq n PRO 153 Cb 0.00 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 31.94 1xkq n PRO 153 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 1xkq s GLN 154 N -2.91 3.78 0.57 0.54 -0.21 -1.26 -5.02 119.66 115.16 1xkq s GLN 154 Ca 0.14 1.07 -0.17 0.00 0.02 0.00 0.00 55.36 56.42 1xkq s GLN 154 Cb 0.16 -2.11 -0.05 0.00 1.00 0.00 0.00 33.01 32.01 1xkq s GLN 154 CO 0.42 -0.41 1.08 0.00 -2.12 0.00 0.00 175.29 174.25 1xkq s ALA 155 N -2.49 2.72 -0.48 6.09 0.00 -1.26 -4.89 121.76 121.45 1xkq s ALA 155 Ca 0.61 0.55 0.04 0.00 0.00 0.00 0.00 51.96 53.16 1xkq s ALA 155 Cb -0.12 -3.28 0.17 0.00 0.00 0.00 0.00 23.12 19.89 1xkq s ALA 155 CO 0.30 -0.76 0.37 -0.65 0.00 0.00 0.00 175.76 175.02 1xkq s GLN 156 N -3.73 1.28 0.00 0.00 -1.52 -1.26 -5.00 119.66 109.42 1xkq s GLN 156 Ca 0.67 -2.39 0.19 0.00 -1.95 0.00 0.00 55.36 51.88 1xkq s GLN 156 Cb -0.18 -1.91 0.99 0.00 -0.22 0.00 0.00 33.01 31.69 1xkq s GLN 156 CO 0.32 -1.36 1.57 -0.35 -0.25 0.00 0.00 175.29 175.22 1xkq n PRO 157 N 2.67 0.34 -0.12 2.91 -0.04 -1.26 -3.73 135.00 135.78 1xkq n PRO 157 Ca 0.27 0.08 -0.23 0.00 -0.04 0.00 0.00 63.50 63.58 1xkq n PRO 157 Cb 0.44 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.32 1xkq n PRO 157 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1xkq n ASP 158 N -1.22 1.93 -3.81 3.54 8.00 -1.26 -2.87 116.55 120.86 1xkq n ASP 158 Ca 0.10 0.37 -0.30 0.00 0.71 0.00 0.00 54.79 55.67 1xkq n ASP 158 Cb 0.13 -0.83 -0.09 0.00 -0.02 0.00 0.00 41.12 40.31 1xkq n ASP 158 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1xkq n PHE 159 N -4.34 3.52 -0.26 1.24 3.01 -1.26 0.66 117.46 120.02 1xkq n PHE 159 Ca -0.41 -4.18 -0.06 0.00 1.01 0.00 0.00 57.45 53.81 1xkq n PHE 159 Cb 0.75 -0.73 0.05 0.00 -0.01 0.00 0.00 39.48 39.55 1xkq n PHE 159 CO 0.00 0.00 0.00 -0.07 1.01 0.00 0.00 176.76 177.70 1xkq h LEU 160 N 5.16 1.01 -0.77 4.37 4.07 -1.83 -2.47 115.31 124.85 1xkq h LEU 160 Ca 0.17 -0.18 -0.11 0.00 0.08 0.00 0.00 57.88 57.84 1xkq h LEU 160 Cb 0.73 -0.26 -0.01 0.00 1.08 0.00 0.00 40.66 42.19 1xkq h LEU 160 CO 0.80 0.91 -0.24 1.88 -1.08 0.00 0.00 178.44 180.71 1xkq h TYR 161 N 1.05 0.76 -0.41 1.13 0.05 -1.92 -0.31 116.97 117.32 1xkq h TYR 161 Ca 0.24 -0.17 -0.04 0.00 0.05 0.00 0.00 58.73 58.81 1xkq h TYR 161 Cb 0.22 -0.18 -0.02 0.00 1.01 0.00 0.00 36.73 37.76 1xkq h TYR 161 CO 0.02 0.85 0.11 -0.92 -1.05 0.00 0.00 178.16 177.17 1xkq h TYR 162 N 0.59 0.68 0.08 4.88 3.20 -1.91 -1.82 116.97 122.66 1xkq h TYR 162 Ca 0.08 -0.08 -0.00 0.00 3.14 0.00 0.00 58.73 61.87 1xkq h TYR 162 Cb 0.72 -0.19 0.00 0.00 1.54 0.00 0.00 36.73 38.80 1xkq h TYR 162 CO 0.03 0.64 -0.04 0.00 -1.64 0.00 0.00 178.16 177.15 1xkq h ALA 163 N 0.96 -0.10 0.00 1.82 0.00 -1.06 -2.07 119.26 118.81 1xkq h ALA 163 Ca 0.13 -0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.90 1xkq h ALA 163 Cb 0.29 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1xkq h ALA 163 CO -0.00 -0.51 -0.36 -0.84 0.00 0.00 0.00 179.25 177.54 1xkq h ILE 164 N -0.19 1.06 -0.54 0.00 3.07 -1.09 -0.40 117.51 119.43 1xkq h ILE 164 Ca -0.01 -1.33 -0.07 0.00 1.55 0.00 0.00 64.86 65.01 1xkq h ILE 164 Cb 0.16 1.76 -0.02 0.00 -0.27 0.00 0.00 36.82 38.44 1xkq h ILE 164 CO 0.02 0.35 0.08 0.00 -1.05 0.00 0.00 178.15 177.55 1xkq h ALA 165 N 1.64 0.72 -0.03 0.16 0.00 -1.10 0.20 119.26 120.84 1xkq h ALA 165 Ca -0.00 -0.25 -0.15 0.00 0.00 0.00 0.00 54.91 54.51 1xkq h ALA 165 Cb 0.73 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 1xkq h ALA 165 CO 0.05 0.47 -0.66 0.87 0.00 0.00 0.00 179.25 179.98 1xkq h LYS 166 N 0.79 0.12 -0.44 0.00 1.79 -0.98 -1.08 116.57 116.77 1xkq h LYS 166 Ca 0.16 -0.09 -0.07 0.00 -2.18 0.00 0.00 60.65 58.47 1xkq h LYS 166 Cb 0.43 0.02 -0.02 0.00 -1.58 0.00 0.00 32.23 31.08 1xkq h LYS 166 CO 0.01 0.74 0.01 0.00 -1.08 0.00 0.00 179.45 179.13 1xkq h ALA 167 N 1.24 0.59 -0.54 3.86 0.00 -0.58 -1.61 119.26 122.21 1xkq h ALA 167 Ca -0.01 -0.26 -0.08 0.00 0.00 0.00 0.00 54.91 54.56 1xkq h ALA 167 Cb 1.18 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.79 1xkq h ALA 167 CO 0.09 0.38 0.02 0.00 0.00 0.00 0.00 179.25 179.74 1xkq h ALA 168 N 0.91 1.01 -0.84 0.00 0.00 -0.47 -2.95 119.26 116.93 1xkq h ALA 168 Ca 0.13 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 1xkq h ALA 168 Cb 0.48 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 18.02 1xkq h ALA 168 CO 0.02 0.61 0.44 1.25 0.00 0.00 0.00 179.25 181.57 1xkq h LEU 169 N 0.85 1.07 -1.16 0.00 7.12 -0.84 -1.34 115.31 121.00 1xkq h LEU 169 Ca 0.16 -0.11 -0.02 0.00 0.13 0.00 0.00 57.88 58.05 1xkq h LEU 169 Cb 0.47 -0.27 -0.03 0.00 -0.53 0.00 0.00 40.66 40.30 1xkq h LEU 169 CO 0.02 0.88 0.34 0.44 -0.13 0.00 0.00 178.44 179.98 1xkq h ASP 170 N 1.19 0.83 1.03 1.25 3.32 -1.12 0.14 116.42 123.06 1xkq h ASP 170 Ca 0.29 -0.08 -0.12 0.00 0.02 0.00 0.00 57.03 57.15 1xkq h ASP 170 Cb 0.06 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.38 1xkq h ASP 170 CO -0.04 0.69 -0.56 -0.61 -1.72 0.00 0.00 179.24 176.99 1xkq h GLN 171 N 0.92 0.00 -0.30 3.56 5.75 -1.43 -1.81 115.11 121.81 1xkq h GLN 171 Ca 0.23 0.00 -0.12 0.00 -0.15 0.00 0.00 58.65 58.61 1xkq h GLN 171 Cb 0.06 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 28.61 1xkq h GLN 171 CO -0.03 0.56 -0.30 -0.92 -2.65 0.00 0.00 178.83 175.49 1xkq h TYR 172 N 0.00 0.87 0.07 3.99 3.20 -0.21 -0.57 116.97 124.33 1xkq h TYR 172 Ca -0.01 -0.26 -0.00 0.00 3.14 0.00 0.00 58.73 61.60 1xkq h TYR 172 Cb 1.23 -0.18 -0.00 0.00 1.54 0.00 0.00 36.73 39.31 1xkq h TYR 172 CO 0.00 1.02 -0.05 1.15 -1.64 0.00 0.00 178.16 178.63 1xkq h THR 173 N 0.48 0.88 -0.28 1.81 2.02 -0.64 0.27 112.91 117.45 1xkq h THR 173 Ca 0.05 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.23 1xkq h THR 173 Cb 0.87 0.88 -0.02 0.00 -1.74 0.00 0.00 68.15 68.14 1xkq h THR 173 CO 0.07 0.00 0.18 0.03 0.37 0.00 0.00 175.52 176.18 1xkq h ARG 174 N -0.13 0.36 -0.41 6.66 3.08 -1.29 -1.41 114.38 121.24 1xkq h ARG 174 Ca -0.00 -0.02 -0.14 0.00 0.07 0.00 0.00 59.98 59.88 1xkq h ARG 174 Cb 0.12 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.08 1xkq h ARG 174 CO -0.00 0.24 -0.32 0.77 -1.07 0.00 0.00 179.97 179.59 1xkq h SER 175 N 0.37 0.95 1.22 7.04 0.02 -0.91 -2.31 113.55 119.94 1xkq h SER 175 Ca 0.11 -0.40 -0.07 0.00 -0.84 0.00 0.00 61.79 60.58 1xkq h SER 175 Cb -0.03 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.23 1xkq h SER 175 CO -0.03 1.18 -0.35 0.71 -1.14 0.00 0.00 176.83 177.20 1xkq h THR 176 N 0.76 0.70 -0.38 -2.27 1.35 -0.96 -0.88 112.91 111.23 1xkq h THR 176 Ca 0.08 -1.64 -0.03 0.00 -0.55 0.00 0.00 66.41 64.27 1xkq h THR 176 Cb 0.89 2.09 -0.02 0.00 -1.73 0.00 0.00 68.15 69.38 1xkq h THR 176 CO 0.08 0.34 0.12 0.00 -0.25 0.00 0.00 175.52 175.81 1xkq h ALA 177 N 1.65 0.50 -0.13 6.62 0.00 -0.99 0.34 119.26 127.26 1xkq h ALA 177 Ca -0.00 -0.17 -0.08 0.00 0.00 0.00 0.00 54.91 54.66 1xkq h ALA 177 Cb 1.06 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.70 1xkq h ALA 177 CO 0.05 0.15 -0.23 0.82 0.00 0.00 0.00 179.25 180.04 1xkq h ILE 178 N 0.47 1.37 -0.55 0.00 1.08 -1.29 -1.65 117.51 116.94 1xkq h ILE 178 Ca 0.12 -1.48 -0.03 0.00 -0.39 0.00 0.00 64.86 63.09 1xkq h ILE 178 Cb 0.27 2.01 -0.02 0.00 -3.07 0.00 0.00 36.82 36.00 1xkq h ILE 178 CO -0.00 0.43 0.23 -0.78 -0.69 0.00 0.00 178.15 177.35 1xkq h ASP 179 N -0.01 0.74 1.53 1.72 3.58 -1.09 -3.10 116.42 119.79 1xkq h ASP 179 Ca 0.01 -0.16 0.00 0.00 0.42 0.00 0.00 57.03 57.30 1xkq h ASP 179 Cb 0.81 -0.19 0.00 0.00 1.72 0.00 0.00 39.33 41.67 1xkq h ASP 179 CO 0.05 0.69 -0.11 -0.07 -2.88 0.00 0.00 179.24 176.92 1xkq h LEU 180 N 0.74 0.00 -1.95 2.28 3.38 -0.36 -3.32 115.31 116.09 1xkq h LEU 180 Ca 0.18 -0.02 0.08 0.00 0.09 0.00 0.00 57.88 58.21 1xkq h LEU 180 Cb 0.17 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 1xkq h LEU 180 CO -0.02 0.01 0.22 0.00 0.09 0.00 0.00 178.44 178.74 1xkq h ALA 181 N 2.35 2.22 0.00 1.53 0.00 -1.21 -0.46 119.26 123.69 1xkq h ALA 181 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1xkq h ALA 181 Cb 0.82 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.62 1xkq h ALA 181 CO 0.00 -0.30 0.00 0.36 0.00 0.00 0.00 179.25 179.31 1xkq n LYS 182 N -4.46 0.16 -0.18 0.00 2.85 -1.25 -1.29 118.16 113.99 1xkq n LYS 182 Ca 0.04 0.60 0.10 0.00 -1.05 0.00 0.00 58.31 58.00 1xkq n LYS 182 Cb 0.35 -1.96 0.19 0.00 -0.65 0.00 0.00 35.03 32.96 1xkq n LYS 182 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 177.40 178.54 1xkq n PHE 183 N -2.28 0.49 -0.86 5.58 3.72 -0.19 -4.94 117.46 118.98 1xkq n PHE 183 Ca -0.01 -0.29 0.00 0.00 -0.05 0.00 0.00 57.45 57.10 1xkq n PHE 183 Cb 0.07 -0.01 0.00 0.00 -0.94 0.00 0.00 39.48 38.61 1xkq n PHE 183 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1xkq n GLY 184 N 1.23 0.55 3.87 1.37 0.00 -0.41 -4.69 105.19 107.11 1xkq n GLY 184 Ca 0.17 -0.24 -0.32 0.00 0.00 0.00 0.00 46.02 45.63 1xkq n GLY 184 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xkq s ILE 185 N -2.00 4.89 -0.19 -0.61 1.01 -1.21 -4.54 121.20 118.55 1xkq s ILE 185 Ca 0.00 0.54 0.01 0.00 0.00 0.00 0.00 60.65 61.21 1xkq s ILE 185 Cb 0.00 -3.62 0.03 0.00 0.01 0.00 0.00 42.46 38.89 1xkq s ILE 185 CO 0.00 -0.08 -0.14 -0.13 0.00 0.00 0.00 174.94 174.59 1xkq s ARG 186 N -2.82 2.44 -0.15 2.79 0.52 -1.03 -4.01 118.95 116.69 1xkq s ARG 186 Ca 0.48 -0.88 -0.03 0.00 -0.52 0.00 0.00 55.73 54.79 1xkq s ARG 186 Cb -0.11 -2.50 -0.02 0.00 0.52 0.00 0.00 34.95 32.84 1xkq s ARG 186 CO 0.21 -0.35 -0.06 0.08 0.02 0.00 0.00 175.30 175.20 1xkq s VAL 187 N 1.32 3.64 0.25 3.52 1.01 -1.26 -0.77 120.40 128.10 1xkq s VAL 187 Ca 0.01 -0.45 0.02 0.00 0.00 0.00 0.00 61.98 61.55 1xkq s VAL 187 Cb -0.15 -2.58 -0.01 0.00 0.00 0.00 0.00 36.38 33.64 1xkq s VAL 187 CO -0.10 0.50 0.29 0.59 0.00 0.00 0.00 175.10 176.38 1xkq n ASN 188 N 3.55 -0.77 -3.89 3.32 3.02 -0.03 -0.26 115.26 120.20 1xkq n ASN 188 Ca -0.18 -2.45 -0.07 0.00 -0.03 0.00 0.00 54.58 51.85 1xkq n ASN 188 Cb 0.52 1.56 -0.03 0.00 -0.61 0.00 0.00 39.78 41.22 1xkq n ASN 188 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1xkq s SER 189 N -2.61 -0.22 -0.02 6.41 0.15 0.11 -1.20 113.70 116.32 1xkq s SER 189 Ca 0.24 -0.68 0.01 0.00 0.70 0.00 0.00 55.95 56.22 1xkq s SER 189 Cb 0.00 0.70 0.01 0.00 -1.71 0.00 0.00 66.02 65.02 1xkq s SER 189 CO 0.17 -1.30 -0.03 0.54 1.20 0.00 0.00 173.24 173.82 1xkq s VAL 190 N -3.94 0.34 -0.49 4.45 0.11 -0.62 -1.25 120.40 119.00 1xkq s VAL 190 Ca 0.14 -0.09 -0.01 0.00 -2.93 0.00 0.00 61.98 59.08 1xkq s VAL 190 Cb -0.05 -0.35 0.13 0.00 -1.53 0.00 0.00 36.38 34.58 1xkq s VAL 190 CO 0.07 0.14 0.27 -0.44 -3.33 0.00 0.00 175.10 171.81 1xkq s SER 191 N 0.45 5.05 0.65 3.54 0.01 0.10 -0.78 113.70 122.73 1xkq s SER 191 Ca -0.05 -2.46 -0.12 0.00 1.31 0.00 0.00 55.95 54.63 1xkq s SER 191 Cb -0.08 -1.78 -0.01 0.00 0.21 0.00 0.00 66.02 64.35 1xkq s SER 191 CO -0.01 -0.42 1.05 -2.84 0.41 0.00 0.00 173.24 171.44 1xkq s PRO 192 N 0.51 3.16 0.00 12.44 0.02 -1.26 -1.12 135.00 148.75 1xkq s PRO 192 Ca 0.13 1.00 0.00 0.00 0.02 0.00 0.00 61.00 62.14 1xkq s PRO 192 Cb -0.22 -2.02 0.00 0.00 0.02 0.00 0.00 34.50 32.28 1xkq s PRO 192 CO -0.04 -0.92 0.00 0.41 -0.33 0.00 0.00 177.00 176.12 1xkq n GLY 193 N -1.79 1.86 3.70 0.52 0.00 0.41 -2.54 105.19 107.34 1xkq n GLY 193 Ca 0.08 -1.89 -0.42 0.00 0.00 0.00 0.00 46.02 43.79 1xkq n GLY 193 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1xkq s MET 194 N 3.75 4.27 -0.01 1.61 1.75 -1.26 -4.94 119.30 124.46 1xkq s MET 194 Ca 0.00 2.16 0.02 0.00 -1.25 0.00 0.00 55.69 56.62 1xkq s MET 194 Cb 0.00 -3.37 0.00 0.00 2.84 0.00 0.00 34.83 34.30 1xkq s MET 194 CO 0.00 -0.56 -0.06 0.54 -0.65 0.00 0.00 175.02 174.29 1xkq s VAL 195 N 1.70 0.50 -0.37 10.11 0.11 -1.26 -2.55 120.40 128.64 1xkq s VAL 195 Ca 0.67 -0.23 -0.29 0.00 -2.93 0.00 0.00 61.98 59.21 1xkq s VAL 195 Cb -0.38 -0.45 0.01 0.00 -1.53 0.00 0.00 36.38 34.03 1xkq s VAL 195 CO 0.30 0.16 1.34 -1.61 -3.33 0.00 0.00 175.10 171.96 1xkq s GLU 196 N 0.10 3.74 0.00 1.54 2.02 0.17 -4.89 118.70 121.38 1xkq s GLU 196 Ca -0.01 1.05 0.00 0.00 0.02 0.00 0.00 54.97 56.03 1xkq s GLU 196 Cb -0.05 -3.95 0.00 0.00 0.10 0.00 0.00 34.13 30.23 1xkq s GLU 196 CO -0.00 -1.35 0.00 0.25 0.02 0.00 0.00 175.26 174.18 1xkq n THR 197 N 6.66 0.00 -0.35 3.63 -2.24 -1.26 -4.24 114.28 116.49 1xkq n THR 197 Ca 0.15 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 62.05 1xkq n THR 197 Cb 0.47 0.00 0.33 0.00 -2.10 0.00 0.00 70.33 69.03 1xkq n THR 197 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xkq n GLY 198 N 0.00 2.45 0.29 3.38 0.00 -1.26 -4.59 105.19 105.46 1xkq n GLY 198 Ca 0.00 -0.80 -0.14 0.00 0.00 0.00 0.00 46.02 45.08 1xkq n GLY 198 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1xkq h PHE 199 N 4.28 -0.68 -0.57 1.61 3.57 -1.95 0.20 116.94 123.39 1xkq h PHE 199 Ca 0.00 0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.44 1xkq h PHE 199 Cb 1.01 0.26 -0.02 0.00 2.79 0.00 0.00 35.95 39.98 1xkq h PHE 199 CO 0.51 -0.38 0.10 1.79 -2.23 0.00 0.00 178.31 178.10 1xkq h THR 200 N -0.56 1.24 -0.34 4.41 1.35 -1.93 -2.44 112.91 114.65 1xkq h THR 200 Ca -0.01 -0.93 -0.01 0.00 -0.55 0.00 0.00 66.41 64.91 1xkq h THR 200 Cb 0.51 0.70 -0.02 0.00 -1.73 0.00 0.00 68.15 67.61 1xkq h THR 200 CO -0.04 0.34 0.18 -1.13 -0.25 0.00 0.00 175.52 174.62 1xkq h ASN 201 N 0.87 0.43 -0.28 5.36 -1.24 -1.69 -0.21 115.58 118.81 1xkq h ASN 201 Ca 0.18 -0.10 0.08 0.00 0.71 0.00 0.00 56.30 57.17 1xkq h ASN 201 Cb 0.38 -0.11 -0.01 0.00 0.73 0.00 0.00 38.32 39.31 1xkq h ASN 201 CO 0.01 0.41 0.27 0.00 -1.29 0.00 0.00 177.43 176.82 1xkq h ALA 202 N 1.04 2.01 -0.00 1.57 0.00 -0.62 0.49 119.26 123.75 1xkq h ALA 202 Ca 0.12 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1xkq h ALA 202 Cb 0.08 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1xkq h ALA 202 CO -0.02 -0.42 -0.04 -1.33 0.00 0.00 0.00 179.25 177.45 1xkq n MET 203 N -3.95 0.59 -0.02 0.00 2.81 -0.14 -4.86 117.12 111.56 1xkq n MET 203 Ca 0.04 -0.09 0.00 0.00 -1.81 0.00 0.00 57.70 55.84 1xkq n MET 203 Cb 0.42 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.43 1xkq n MET 203 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1xkq n GLY 204 N 1.25 0.82 3.73 3.03 0.00 0.17 -4.79 105.19 109.40 1xkq n GLY 204 Ca 0.15 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.77 1xkq n GLY 204 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1xkq s MET 205 N -0.98 4.52 0.57 1.61 -1.94 -0.92 -5.01 119.30 117.15 1xkq s MET 205 Ca 0.00 1.14 -0.19 0.00 -1.71 0.00 0.00 55.69 54.92 1xkq s MET 205 Cb 0.00 -3.40 -0.04 0.00 2.01 0.00 0.00 34.83 33.39 1xkq s MET 205 CO 0.00 0.16 1.19 -2.14 -0.01 0.00 0.00 175.02 174.22 1xkq s PRO 206 N 0.35 3.11 0.64 2.03 0.02 -1.26 -4.21 135.00 135.67 1xkq s PRO 206 Ca 0.42 1.78 0.37 0.00 0.02 0.00 0.00 61.00 63.60 1xkq s PRO 206 Cb -0.20 -1.98 2.09 0.00 0.02 0.00 0.00 34.50 34.43 1xkq s PRO 206 CO 0.24 -1.09 2.26 -0.44 -0.33 0.00 0.00 177.00 177.63 1xkq h ASP 207 N 1.03 0.00 -0.03 2.53 3.32 -1.98 -0.79 116.42 120.50 1xkq h ASP 207 Ca -0.50 0.00 -0.25 0.00 0.02 0.00 0.00 57.03 56.30 1xkq h ASP 207 Cb 1.29 0.00 0.02 0.00 0.22 0.00 0.00 39.33 40.86 1xkq h ASP 207 CO 0.56 0.00 -0.95 1.56 -1.72 0.00 0.00 179.24 178.69 1xkq h GLN 208 N 0.00 0.70 -0.34 3.56 4.20 -2.00 -2.56 115.11 118.67 1xkq h GLN 208 Ca 0.01 -0.71 -0.16 0.00 0.06 0.00 0.00 58.65 57.85 1xkq h GLN 208 Cb 0.15 0.19 -0.00 0.00 0.30 0.00 0.00 27.48 28.12 1xkq h GLN 208 CO -0.00 1.30 -0.42 0.00 -0.67 0.00 0.00 178.83 179.03 1xkq h ALA 209 N 0.42 0.51 -0.22 3.87 0.00 -1.56 -2.76 119.26 119.52 1xkq h ALA 209 Ca -0.11 -0.47 0.02 0.00 0.00 0.00 0.00 54.91 54.36 1xkq h ALA 209 Cb 1.60 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 19.27 1xkq h ALA 209 CO 0.19 0.64 0.07 0.77 0.00 0.00 0.00 179.25 180.92 1xkq h SER 210 N 0.69 0.08 -0.76 0.00 0.02 -1.23 0.17 113.55 112.52 1xkq h SER 210 Ca 0.04 0.02 0.01 0.00 -0.84 0.00 0.00 61.79 61.03 1xkq h SER 210 Cb 1.02 0.02 -0.04 0.00 0.14 0.00 0.00 62.40 63.54 1xkq h SER 210 CO 0.10 0.07 0.50 -0.61 -1.14 0.00 0.00 176.83 175.76 1xkq h GLN 211 N 0.17 1.00 -0.57 3.45 5.75 -1.46 0.16 115.11 123.60 1xkq h GLN 211 Ca 0.10 -0.06 -0.03 0.00 -0.15 0.00 0.00 58.65 58.50 1xkq h GLN 211 Cb 0.07 -0.22 -0.03 0.00 1.07 0.00 0.00 27.48 28.37 1xkq h GLN 211 CO -0.10 0.66 0.22 0.87 -2.65 0.00 0.00 178.83 177.82 1xkq h LYS 212 N 1.03 0.84 0.21 1.69 1.57 -1.15 -0.66 116.57 120.10 1xkq h LYS 212 Ca 0.28 -0.13 -0.01 0.00 -1.87 0.00 0.00 60.65 58.92 1xkq h LYS 212 Cb -0.11 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.05 1xkq h LYS 212 CO -0.06 0.70 -0.10 0.35 -0.57 0.00 0.00 179.45 179.76 1xkq h PHE 213 N 0.82 -0.26 -0.12 -1.35 3.57 0.43 -1.44 116.94 118.60 1xkq h PHE 213 Ca 0.19 -0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.72 1xkq h PHE 213 Cb 0.18 0.09 -0.04 0.00 2.79 0.00 0.00 35.95 38.97 1xkq h PHE 213 CO 0.01 -0.01 -0.12 1.88 -2.23 0.00 0.00 178.31 177.84 1xkq h TYR 214 N -0.49 -0.29 -0.81 0.41 0.05 -0.44 -0.49 116.97 114.91 1xkq h TYR 214 Ca -0.03 0.02 0.02 0.00 0.05 0.00 0.00 58.73 58.79 1xkq h TYR 214 Cb 0.37 0.15 -0.05 0.00 1.01 0.00 0.00 36.73 38.21 1xkq h TYR 214 CO -0.01 -0.18 0.52 -0.91 -1.05 0.00 0.00 178.16 176.54 1xkq h ASN 215 N -0.14 0.88 -0.22 3.88 2.35 -1.12 -0.06 115.58 121.15 1xkq h ASN 215 Ca 0.08 -0.01 -0.03 0.00 -0.55 0.00 0.00 56.30 55.79 1xkq h ASN 215 Cb 0.26 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.42 1xkq h ASN 215 CO -0.20 0.62 0.03 0.15 -1.65 0.00 0.00 177.43 176.38 1xkq h PHE 216 N 1.04 0.39 -0.65 1.19 3.04 -0.88 -1.31 116.94 119.76 1xkq h PHE 216 Ca 0.31 -0.06 -0.01 0.00 3.98 0.00 0.00 57.97 62.20 1xkq h PHE 216 Cb -0.04 -0.11 -0.03 0.00 2.56 0.00 0.00 35.95 38.33 1xkq h PHE 216 CO -0.02 0.51 0.37 0.52 -2.02 0.00 0.00 178.31 177.67 1xkq h MET 217 N 0.16 0.90 0.00 1.11 2.86 -0.80 -2.65 114.93 116.50 1xkq h MET 217 Ca 0.07 -0.10 -0.08 0.00 -2.06 0.00 0.00 59.70 57.53 1xkq h MET 217 Cb 0.33 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 31.80 1xkq h MET 217 CO 0.01 0.66 -0.38 0.00 1.06 0.00 0.00 176.91 178.26 1xkq h ALA 218 N 1.19 1.15 -0.00 6.32 0.00 -0.92 -2.91 119.26 124.09 1xkq h ALA 218 Ca 0.23 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1xkq h ALA 218 Cb 0.01 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1xkq h ALA 218 CO -0.04 0.48 -0.39 -1.13 0.00 0.00 0.00 179.25 178.17 1xkq n SER 219 N -3.77 0.82 -4.19 0.00 3.41 -0.50 -4.15 113.62 105.23 1xkq n SER 219 Ca -0.01 -0.63 -0.35 0.00 -0.26 0.00 0.00 58.87 57.62 1xkq n SER 219 Cb 0.46 0.22 -0.14 0.00 -0.26 0.00 0.00 64.21 64.49 1xkq n SER 219 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 1xkq s HIS 220 N -2.73 3.20 0.59 7.33 4.02 -1.03 -4.99 115.29 121.69 1xkq s HIS 220 Ca 0.18 -1.75 0.29 0.00 1.02 0.00 0.00 55.06 54.80 1xkq s HIS 220 Cb 0.18 -2.10 1.64 0.00 -1.02 0.00 0.00 32.58 31.28 1xkq s HIS 220 CO 0.61 -0.77 2.08 1.57 1.02 0.00 0.00 174.74 179.24 1xkq h LYS 221 N 8.01 0.00 0.00 1.40 2.10 -1.84 0.27 116.57 126.51 1xkq h LYS 221 Ca -0.25 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.40 1xkq h LYS 221 Cb 1.08 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.41 1xkq h LYS 221 CO 0.55 0.00 0.00 1.05 -2.00 0.00 0.00 179.45 179.05 1xkq h GLU 222 N 0.00 0.00 0.00 0.07 9.09 -1.92 -2.65 114.58 119.18 1xkq h GLU 222 Ca 0.10 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.51 1xkq h GLU 222 Cb 0.56 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.66 1xkq h GLU 222 CO -0.00 0.00 -0.78 0.00 0.05 0.00 0.00 179.01 178.28 1xkq s ILE 224 N -2.60 1.22 0.33 0.00 1.01 -0.65 -4.19 121.20 116.31 1xkq s ILE 224 Ca -0.23 -2.26 0.11 0.00 0.00 0.00 0.00 60.65 58.27 1xkq s ILE 224 Cb 0.03 -1.87 0.32 0.00 0.01 0.00 0.00 42.46 40.95 1xkq s ILE 224 CO 0.33 -0.86 1.68 -0.65 0.00 0.00 0.00 174.94 175.45 1xkq h PRO 225 N 7.03 0.37 0.00 2.79 0.11 -1.31 -0.76 132.00 140.23 1xkq h PRO 225 Ca -0.03 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.06 1xkq h PRO 225 Cb 0.95 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.98 1xkq h PRO 225 CO 0.46 0.25 0.00 0.97 -0.21 0.00 0.00 178.00 179.47 1xkq h ILE 226 N 0.38 0.00 0.00 4.15 2.10 -1.64 -3.47 117.51 119.03 1xkq h ILE 226 Ca 0.68 -0.17 0.00 0.00 1.08 0.00 0.00 64.86 66.45 1xkq h ILE 226 Cb 1.44 0.89 0.00 0.00 -1.09 0.00 0.00 36.82 38.06 1xkq h ILE 226 CO -0.57 0.00 0.00 0.61 -1.08 0.00 0.00 178.15 177.11 1xkq n GLY 227 N -0.56 0.66 3.23 8.18 0.00 -0.29 -5.05 105.19 111.36 1xkq n GLY 227 Ca 0.00 -0.03 -0.13 0.00 0.00 0.00 0.00 46.02 45.86 1xkq n GLY 227 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xkq s ALA 228 N -2.00 -0.78 0.49 4.61 0.00 -1.26 -4.78 121.76 118.04 1xkq s ALA 228 Ca 0.00 0.48 -0.21 0.00 0.00 0.00 0.00 51.96 52.22 1xkq s ALA 228 Cb 0.00 -0.09 -0.07 0.00 0.00 0.00 0.00 23.12 22.95 1xkq s ALA 228 CO 0.00 -0.23 1.10 0.00 0.00 0.00 0.00 175.76 176.62 1xkq s ALA 229 N -0.92 2.87 0.45 0.00 0.00 -1.26 -4.89 121.76 118.00 1xkq s ALA 229 Ca -0.10 0.76 -0.22 0.00 0.00 0.00 0.00 51.96 52.40 1xkq s ALA 229 Cb -0.05 -3.32 -0.09 0.00 0.00 0.00 0.00 23.12 19.67 1xkq s ALA 229 CO 0.03 -0.52 1.05 0.20 0.00 0.00 0.00 175.76 176.53 1xkq s GLY 230 N -1.72 2.63 0.23 0.00 0.00 -1.06 -4.91 107.32 102.49 1xkq s GLY 230 Ca 0.67 0.68 0.10 0.00 0.00 0.00 0.00 44.72 46.16 1xkq s GLY 230 CO 0.26 1.06 -0.07 0.54 0.00 0.00 0.00 173.10 174.89 1xkq s LYS 231 N -2.87 2.12 0.35 2.90 -0.14 -1.26 -0.66 119.74 120.18 1xkq s LYS 231 Ca 0.63 -1.40 0.12 0.00 -1.36 0.00 0.00 55.97 53.95 1xkq s LYS 231 Cb -0.20 -2.11 0.91 0.00 -1.68 0.00 0.00 37.83 34.75 1xkq s LYS 231 CO 0.24 0.39 1.79 -1.35 -0.76 0.00 0.00 175.35 175.66 1xkq h PRO 232 N 2.37 0.57 -0.53 -1.68 0.11 -1.92 -0.50 132.00 130.42 1xkq h PRO 232 Ca -0.45 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 65.58 1xkq h PRO 232 Cb 1.23 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 32.19 1xkq h PRO 232 CO 0.58 0.38 0.15 0.93 -0.21 0.00 0.00 178.00 179.82 1xkq h GLU 233 N 0.59 0.79 -1.00 1.05 3.07 -1.94 -1.40 114.58 115.74 1xkq h GLU 233 Ca 0.57 -0.15 0.12 0.00 -0.50 0.00 0.00 59.36 59.40 1xkq h GLU 233 Cb 1.13 -0.13 -0.08 0.00 -0.84 0.00 0.00 28.75 28.83 1xkq h GLU 233 CO -0.33 0.70 0.63 0.45 -1.40 0.00 0.00 179.01 179.06 1xkq h HIS 234 N 0.77 1.14 0.07 4.33 3.86 -1.48 -0.33 115.15 123.51 1xkq h HIS 234 Ca 0.17 0.03 -0.28 0.00 -1.16 0.00 0.00 60.37 59.13 1xkq h HIS 234 Cb 0.26 -0.36 -0.02 0.00 1.06 0.00 0.00 27.41 28.35 1xkq h HIS 234 CO 0.01 0.46 -1.45 0.82 0.86 0.00 0.00 177.93 178.64 1xkq h ILE 235 N 1.00 1.22 -0.69 2.45 5.03 -1.54 -3.31 117.51 121.67 1xkq h ILE 235 Ca 0.49 -2.91 -0.01 0.00 -0.12 0.00 0.00 64.86 62.31 1xkq h ILE 235 Cb 0.47 2.72 -0.03 0.00 -3.03 0.00 0.00 36.82 36.94 1xkq h ILE 235 CO -0.25 0.80 0.41 0.00 -0.68 0.00 0.00 178.15 178.42 1xkq h ALA 236 N 0.68 0.88 -0.84 1.87 0.00 -0.63 -1.42 119.26 119.80 1xkq h ALA 236 Ca -0.20 -0.09 0.03 0.00 0.00 0.00 0.00 54.91 54.65 1xkq h ALA 236 Cb 1.96 -0.28 -0.05 0.00 0.00 0.00 0.00 17.79 19.43 1xkq h ALA 236 CO 0.14 0.35 0.54 -0.91 0.00 0.00 0.00 179.25 179.38 1xkq h ASN 237 N 0.93 0.90 -0.51 0.00 -0.26 -1.20 -0.91 115.58 114.53 1xkq h ASN 237 Ca 0.25 -0.01 -0.12 0.00 -0.56 0.00 0.00 56.30 55.86 1xkq h ASN 237 Cb -0.02 -0.20 -0.02 0.00 -1.06 0.00 0.00 38.32 37.02 1xkq h ASN 237 CO -0.05 0.63 -0.14 0.40 -1.06 0.00 0.00 177.43 177.21 1xkq h ILE 238 N 1.06 1.27 -0.35 2.81 2.04 -1.54 -0.56 117.51 122.24 1xkq h ILE 238 Ca 0.33 -1.29 -0.02 0.00 1.00 0.00 0.00 64.86 64.87 1xkq h ILE 238 Cb -0.01 1.01 -0.02 0.00 -0.74 0.00 0.00 36.82 37.06 1xkq h ILE 238 CO -0.11 0.45 0.13 0.40 0.00 0.00 0.00 178.15 179.02 1xkq h ILE 239 N 0.89 1.20 -0.76 -0.67 2.04 -0.80 -0.25 117.51 119.16 1xkq h ILE 239 Ca 0.13 -0.62 -0.02 0.00 1.00 0.00 0.00 64.86 65.35 1xkq h ILE 239 Cb 0.70 0.95 -0.04 0.00 -0.74 0.00 0.00 36.82 37.70 1xkq h ILE 239 CO 0.05 0.22 0.40 -0.07 0.00 0.00 0.00 178.15 178.75 1xkq h LEU 240 N 0.41 0.96 -0.56 1.44 4.07 -1.07 -0.24 115.31 120.33 1xkq h LEU 240 Ca 0.11 -0.11 0.02 0.00 0.08 0.00 0.00 57.88 57.99 1xkq h LEU 240 Cb 0.21 -0.25 -0.04 0.00 1.08 0.00 0.00 40.66 41.67 1xkq h LEU 240 CO -0.01 0.79 0.34 0.15 -1.08 0.00 0.00 178.44 178.64 1xkq h PHE 241 N 1.05 0.64 0.00 1.13 3.57 -0.68 0.18 116.94 122.84 1xkq h PHE 241 Ca 0.26 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.72 1xkq h PHE 241 Cb 0.06 -0.21 -0.01 0.00 2.79 0.00 0.00 35.95 38.58 1xkq h PHE 241 CO 0.00 0.37 -0.29 -0.07 -2.23 0.00 0.00 178.31 176.09 1xkq h LEU 242 N 0.68 0.00 0.00 0.59 3.38 -0.57 -2.38 115.31 117.01 1xkq h LEU 242 Ca 0.22 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.19 1xkq h LEU 242 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1xkq h LEU 242 CO -0.09 0.29 -0.19 0.00 0.09 0.00 0.00 178.44 178.55 1xkq h ALA 243 N 1.71 0.90 -1.34 1.53 0.00 -0.22 -3.41 119.26 118.43 1xkq h ALA 243 Ca -0.00 0.00 -0.65 0.00 0.00 0.00 0.00 54.91 54.25 1xkq h ALA 243 Cb 0.70 0.00 -0.12 0.00 0.00 0.00 0.00 17.79 18.37 1xkq h ALA 243 CO 0.04 0.00 1.44 0.34 0.00 0.00 0.00 179.25 181.07 1xkq s ASP 244 N -5.68 6.66 0.28 0.00 -1.08 -0.03 -4.84 116.67 111.97 1xkq s ASP 244 Ca 0.06 -1.95 0.02 0.00 -0.52 0.00 0.00 52.55 50.16 1xkq s ASP 244 Cb 0.07 -2.51 0.58 0.00 -1.46 0.00 0.00 42.92 39.61 1xkq s ASP 244 CO 0.68 -1.25 1.81 -0.09 0.52 0.00 0.00 175.17 176.84 1xkq h ARG 245 N 8.86 0.85 -0.79 4.34 2.43 -1.82 0.04 114.38 128.28 1xkq h ARG 245 Ca 0.25 -0.05 0.11 0.00 -0.81 0.00 0.00 59.98 59.48 1xkq h ARG 245 Cb 0.97 -0.19 -0.08 0.00 -0.42 0.00 0.00 29.97 30.25 1xkq h ARG 245 CO 1.33 0.56 0.41 -0.97 -1.51 0.00 0.00 179.97 179.80 1xkq h ASN 246 N 0.87 0.54 0.00 -3.80 -1.24 -1.94 0.13 115.58 110.14 1xkq h ASN 246 Ca 0.50 0.07 -0.08 0.00 0.71 0.00 0.00 56.30 57.50 1xkq h ASN 246 Cb 0.60 -0.03 -0.01 0.00 0.73 0.00 0.00 38.32 39.61 1xkq h ASN 246 CO -0.31 0.28 -0.55 -0.07 -1.29 0.00 0.00 177.43 175.50 1xkq h LEU 247 N 0.66 0.00 -1.42 0.34 4.07 -1.60 -3.40 115.31 113.96 1xkq h LEU 247 Ca 0.40 -0.44 0.00 0.00 0.08 0.00 0.00 57.88 57.92 1xkq h LEU 247 Cb 0.47 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.21 1xkq h LEU 247 CO -0.30 1.03 0.00 -1.54 -1.08 0.00 0.00 178.44 176.56 1xkq n SER 248 N -4.58 2.15 -0.01 -0.43 3.41 -0.11 -4.77 113.62 109.28 1xkq n SER 248 Ca -0.15 -1.77 -0.00 0.00 -0.26 0.00 0.00 58.87 56.68 1xkq n SER 248 Cb 0.42 -0.12 -0.00 0.00 -0.26 0.00 0.00 64.21 64.25 1xkq n SER 248 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 1xkq n PHE 249 N 0.64 -0.01 0.49 7.33 7.35 0.44 -0.29 117.46 133.41 1xkq n PHE 249 Ca 0.17 0.02 0.06 0.00 -0.76 0.00 0.00 57.45 56.94 1xkq n PHE 249 Cb 0.41 -0.42 0.28 0.00 0.35 0.00 0.00 39.48 40.11 1xkq n PHE 249 CO 0.00 0.00 0.00 0.98 -0.76 0.00 0.00 176.76 176.98 1xkq n TYR 250 N -3.68 0.00 -2.98 -5.13 9.36 -1.26 -4.58 117.16 108.89 1xkq n TYR 250 Ca 0.00 0.00 -0.41 0.00 3.32 0.00 0.00 57.90 60.81 1xkq n TYR 250 Cb 0.00 -0.42 -0.05 0.00 -0.63 0.00 0.00 39.34 38.25 1xkq n TYR 250 CO 0.00 0.00 0.00 0.42 0.22 0.00 0.00 176.86 177.50 1xkq s ILE 251 N -2.84 4.95 -0.13 2.97 1.01 0.60 -5.03 121.20 122.75 1xkq s ILE 251 Ca 0.08 1.49 -0.06 0.00 0.00 0.00 0.00 60.65 62.16 1xkq s ILE 251 Cb 0.08 -4.07 0.05 0.00 0.01 0.00 0.00 42.46 38.54 1xkq s ILE 251 CO 0.21 0.10 0.29 -0.22 0.00 0.00 0.00 174.94 175.33 1xkq s LEU 252 N 1.75 0.15 -0.96 2.97 0.20 -1.26 -4.90 118.68 116.62 1xkq s LEU 252 Ca 0.36 0.63 -0.01 0.00 0.69 0.00 0.00 54.13 55.81 1xkq s LEU 252 Cb -0.17 0.88 0.00 0.00 -0.43 0.00 0.00 46.19 46.48 1xkq s LEU 252 CO 0.14 -0.19 0.08 0.61 -0.29 0.00 0.00 176.35 176.70 1xkq n GLY 253 N 4.47 -0.08 3.47 7.98 0.00 0.63 -5.03 105.19 116.64 1xkq n GLY 253 Ca -0.21 -0.37 -0.29 0.00 0.00 0.00 0.00 46.02 45.15 1xkq n GLY 253 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1xkq s GLN 254 N -4.72 1.71 -0.33 1.61 -1.52 -1.26 -4.51 119.66 110.64 1xkq s GLN 254 Ca 0.04 -1.24 0.03 0.00 -1.95 0.00 0.00 55.36 52.23 1xkq s GLN 254 Cb -0.02 -2.06 0.10 0.00 -0.22 0.00 0.00 33.01 30.82 1xkq s GLN 254 CO 0.05 0.46 0.06 0.45 -0.25 0.00 0.00 175.29 176.06 1xkq s SER 255 N -2.22 4.58 0.05 5.90 0.15 -1.26 0.09 113.70 121.00 1xkq s SER 255 Ca 0.18 -2.02 -0.31 0.00 0.70 0.00 0.00 55.95 54.50 1xkq s SER 255 Cb -0.10 -1.44 -0.08 0.00 -1.71 0.00 0.00 66.02 62.69 1xkq s SER 255 CO 0.10 -0.39 1.60 -0.63 1.20 0.00 0.00 173.24 175.12 1xkq s ILE 256 N 1.08 3.18 -0.10 6.45 1.01 -0.38 -4.51 121.20 127.92 1xkq s ILE 256 Ca 0.10 0.61 -0.30 0.00 0.00 0.00 0.00 60.65 61.07 1xkq s ILE 256 Cb -0.19 -3.39 -0.01 0.00 0.01 0.00 0.00 42.46 38.88 1xkq s ILE 256 CO -0.12 -0.00 1.01 -0.69 0.00 0.00 0.00 174.94 175.13 1xkq s VAL 257 N 2.61 4.78 -0.45 2.92 1.01 -1.26 0.01 120.40 130.01 1xkq s VAL 257 Ca 0.72 2.04 0.02 0.00 0.00 0.00 0.00 61.98 64.76 1xkq s VAL 257 Cb -0.38 -4.31 0.14 0.00 0.00 0.00 0.00 36.38 31.83 1xkq s VAL 257 CO 0.31 0.01 0.26 0.00 0.00 0.00 0.00 175.10 175.68 1xkq s ALA 258 N 2.00 2.19 -0.01 5.51 0.00 -0.27 -4.92 121.76 126.25 1xkq s ALA 258 Ca 0.49 -2.65 0.02 0.00 0.00 0.00 0.00 51.96 49.81 1xkq s ALA 258 Cb -0.18 -1.88 0.02 0.00 0.00 0.00 0.00 23.12 21.08 1xkq s ALA 258 CO 0.18 -2.06 0.89 -0.40 0.00 0.00 0.00 175.76 174.37 1xkq n ASP 259 N 3.39 0.26 -1.37 0.00 5.68 -1.26 -0.45 116.55 122.81 1xkq n ASP 259 Ca 0.11 -1.85 -0.18 0.00 -0.50 0.00 0.00 54.79 52.37 1xkq n ASP 259 Cb 0.36 -0.16 -0.08 0.00 -1.14 0.00 0.00 41.12 40.10 1xkq n ASP 259 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1xkq n GLY 260 N -0.14 1.72 0.89 6.12 0.00 -1.26 -2.03 105.19 110.49 1xkq n GLY 260 Ca 0.01 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.99 1xkq n GLY 260 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xkq n GLY 261 N -0.38 0.67 0.27 -0.02 0.00 -1.26 -1.66 105.19 102.80 1xkq n GLY 261 Ca -0.18 0.00 0.05 0.00 0.00 0.00 0.00 46.02 45.90 1xkq n GLY 261 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1xkq h THR 262 N 0.00 0.47 0.00 2.61 2.02 -1.58 -0.63 112.91 115.80 1xkq h THR 262 Ca 0.00 -0.08 0.00 0.00 0.77 0.00 0.00 66.41 67.10 1xkq h THR 262 Cb 0.00 0.23 0.00 0.00 -1.74 0.00 0.00 68.15 66.64 1xkq h THR 262 CO 0.00 0.04 0.00 -1.54 0.37 0.00 0.00 175.52 174.39 1xkq n SER 263 N -5.21 0.46 -0.30 4.18 3.41 -1.26 -2.69 113.62 112.21 1xkq n SER 263 Ca 0.14 0.60 0.13 0.00 -0.26 0.00 0.00 58.87 59.48 1xkq n SER 263 Cb 0.47 -0.70 0.47 0.00 -0.26 0.00 0.00 64.21 64.18 1xkq n SER 263 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1xkq n LEU 264 N -1.99 1.08 -4.63 1.04 4.77 -0.25 -4.84 117.00 112.17 1xkq n LEU 264 Ca 0.03 -0.29 -0.37 0.00 -0.03 0.00 0.00 56.01 55.34 1xkq n LEU 264 Cb 0.24 -0.09 -0.10 0.00 -2.33 0.00 0.00 43.42 41.14 1xkq n LEU 264 CO 0.19 0.19 -0.11 -0.69 -1.33 0.00 0.00 177.39 175.64 1xkq s VAL 265 N -2.33 5.30 0.35 4.08 1.01 -1.10 -5.08 120.40 122.63 1xkq s VAL 265 Ca 0.30 0.29 -0.18 0.00 0.00 0.00 0.00 61.98 62.38 1xkq s VAL 265 Cb 0.20 -3.56 -0.10 0.00 0.00 0.00 0.00 36.38 32.92 1xkq s VAL 265 CO 0.45 0.28 0.82 -0.32 0.00 0.00 0.00 175.10 176.34 1xkq s MET 266 N 1.41 4.14 0.26 2.72 1.75 -1.26 -4.97 119.30 123.36 1xkq s MET 266 Ca 0.10 0.88 -0.01 0.00 -1.25 0.00 0.00 55.69 55.41 1xkq s MET 266 Cb -0.15 -2.42 0.51 0.00 2.84 0.00 0.00 34.83 35.61 1xkq s MET 266 CO 0.07 0.13 1.79 0.78 -0.65 0.00 0.00 175.02 177.14 1xkq h GLY 267 N 2.32 1.43 2.00 2.11 0.00 -1.98 -0.19 103.07 108.77 1xkq h GLY 267 Ca -0.48 -0.31 -0.01 0.00 0.00 0.00 0.00 47.33 46.52 1xkq h GLY 267 CO 0.64 0.05 -0.06 -0.91 0.00 0.00 0.00 176.54 176.26 1xkq h THR 268 N 0.76 0.94 0.00 4.70 1.35 -1.95 -2.09 112.91 116.62 1xkq h THR 268 Ca 0.46 -0.22 0.00 0.00 -0.55 0.00 0.00 66.41 66.10 1xkq h THR 268 Cb 0.55 1.12 0.00 0.00 -1.73 0.00 0.00 68.15 68.09 1xkq h THR 268 CO -0.31 0.06 0.00 0.00 -0.25 0.00 0.00 175.52 175.02 1xkq n GLN 269 N -4.31 0.68 0.07 4.72 6.02 -0.08 -1.93 117.38 122.54 1xkq n GLN 269 Ca -0.03 0.00 0.12 0.00 -0.01 0.00 0.00 57.00 57.09 1xkq n GLN 269 Cb 0.14 -1.17 0.25 0.00 1.02 0.00 0.00 30.24 30.48 1xkq n GLN 269 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1xkq n ALA 270 N -0.67 2.77 -2.54 -1.58 0.00 -0.79 -4.80 120.51 112.91 1xkq n ALA 270 Ca 0.06 -0.19 -0.32 0.00 0.00 0.00 0.00 53.44 52.99 1xkq n ALA 270 Cb 0.03 -1.26 -0.12 0.00 0.00 0.00 0.00 19.45 18.10 1xkq n ALA 270 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 1xkq s HIS 271 N -3.13 2.78 0.28 0.00 3.76 -0.81 -5.04 115.29 113.12 1xkq s HIS 271 Ca 0.08 -0.11 -0.11 0.00 -0.15 0.00 0.00 55.06 54.77 1xkq s HIS 271 Cb 0.13 -1.59 -0.08 0.00 1.11 0.00 0.00 32.58 32.16 1xkq s HIS 271 CO 0.68 0.30 0.62 0.34 -0.85 0.00 0.00 174.74 175.83 1xkq s ASP 272 N -1.22 6.65 0.00 1.40 2.15 -1.26 -5.02 116.67 119.38 1xkq s ASP 272 Ca 0.15 1.04 0.00 0.00 0.43 0.00 0.00 52.55 54.16 1xkq s ASP 272 Cb -0.11 -2.27 0.00 0.00 -0.30 0.00 0.00 42.92 40.24 1xkq s ASP 272 CO 0.05 -0.15 0.44 0.52 -0.17 0.00 0.00 175.17 175.87