#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u9y s ILE 2 N 0.00 4.56 -0.25 2.02 -4.36 -0.79 -4.93 121.20 117.45 1u9y s ILE 2 Ca 0.00 1.25 -0.12 0.00 -0.26 0.00 0.00 60.65 61.52 1u9y s ILE 2 Cb 0.00 -3.81 -0.05 0.00 1.25 0.00 0.00 42.46 39.86 1u9y s ILE 2 CO 0.00 0.10 0.23 -0.69 0.24 0.00 0.00 174.94 174.82 1u9y s VAL 3 N -1.65 5.29 -0.31 8.37 1.01 -1.26 -1.29 120.40 130.57 1u9y s VAL 3 Ca 0.47 0.31 -0.09 0.00 0.00 0.00 0.00 61.98 62.67 1u9y s VAL 3 Cb -0.15 -3.57 -0.00 0.00 0.00 0.00 0.00 36.38 32.66 1u9y s VAL 3 CO 0.20 0.27 0.13 -0.69 0.00 0.00 0.00 175.10 175.01 1u9y s VAL 4 N 1.47 4.36 0.07 2.92 1.01 0.73 -3.10 120.40 127.86 1u9y s VAL 4 Ca 0.10 -0.53 -0.30 0.00 0.00 0.00 0.00 61.98 61.25 1u9y s VAL 4 Cb -0.15 -3.23 -0.06 0.00 0.00 0.00 0.00 36.38 32.94 1u9y s VAL 4 CO 0.08 0.07 1.16 -0.44 0.00 0.00 0.00 175.10 175.97 1u9y s SER 5 N 1.57 7.14 0.41 3.32 0.01 -1.26 -1.79 113.70 123.09 1u9y s SER 5 Ca 0.04 1.99 -0.02 0.00 1.31 0.00 0.00 55.95 59.27 1u9y s SER 5 Cb -0.17 -2.58 -0.03 0.00 0.21 0.00 0.00 66.02 63.45 1u9y s SER 5 CO 0.05 -0.41 0.66 -0.83 0.41 0.00 0.00 173.24 173.12 1u9y s GLY 6 N 0.87 1.42 0.55 3.44 0.00 -0.80 -4.88 107.32 107.93 1u9y s GLY 6 Ca 0.57 -0.75 0.36 0.00 0.00 0.00 0.00 44.72 44.89 1u9y s GLY 6 CO 0.30 -0.63 2.06 1.48 0.00 0.00 0.00 173.10 176.31 1u9y h SER 7 N 0.49 0.00 0.05 1.64 4.64 -1.96 -3.00 113.55 115.41 1u9y h SER 7 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 1u9y h SER 7 Cb 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 1u9y h SER 7 CO 0.61 0.00 -0.42 0.00 -0.87 0.00 0.00 176.83 176.15 1u9y n GLN 8 N -2.96 1.10 -2.60 4.77 6.02 -1.26 -4.42 117.38 118.03 1u9y n GLN 8 Ca -0.00 -0.86 -0.10 0.00 -0.01 0.00 0.00 57.00 56.03 1u9y n GLN 8 Cb 0.21 -1.48 0.03 0.00 1.02 0.00 0.00 30.24 30.02 1u9y n GLN 8 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 1u9y n SER 9 N -0.20 2.50 -0.12 1.08 7.64 -1.13 -4.60 113.62 118.79 1u9y n SER 9 Ca 0.10 -2.73 -0.02 0.00 1.01 0.00 0.00 58.87 57.23 1u9y n SER 9 Cb 0.44 -0.47 0.22 0.00 -1.01 0.00 0.00 64.21 63.39 1u9y n SER 9 CO 0.00 0.00 0.00 1.56 -3.01 0.00 0.00 175.04 173.59 1u9y h GLN 10 N 2.64 0.80 0.14 1.43 4.20 -1.77 -0.54 115.11 122.01 1u9y h GLN 10 Ca 0.01 -0.14 -0.28 0.00 0.06 0.00 0.00 58.65 58.30 1u9y h GLN 10 Cb 1.25 -0.13 0.03 0.00 0.30 0.00 0.00 27.48 28.93 1u9y h GLN 10 CO 0.45 0.69 -1.19 -0.97 -0.67 0.00 0.00 178.83 177.15 1u9y h ASN 11 N 0.78 0.80 -0.68 1.46 -0.73 -1.93 -2.97 115.58 112.31 1u9y h ASN 11 Ca 0.18 -0.85 -0.06 0.00 1.87 0.00 0.00 56.30 57.43 1u9y h ASN 11 Cb 0.23 -0.26 -0.03 0.00 0.27 0.00 0.00 38.32 38.54 1u9y h ASN 11 CO -0.01 1.58 0.18 0.25 -0.37 0.00 0.00 177.43 179.06 1u9y h LEU 12 N 0.14 1.02 -0.94 0.34 5.85 -1.90 -0.94 115.31 118.89 1u9y h LEU 12 Ca -0.19 -0.23 -0.04 0.00 0.84 0.00 0.00 57.88 58.27 1u9y h LEU 12 Cb 1.89 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 42.61 1u9y h LEU 12 CO 0.23 0.98 0.32 0.00 -0.34 0.00 0.00 178.44 179.63 1u9y h ALA 13 N 1.08 1.16 -0.08 1.25 0.00 -1.18 -0.81 119.26 120.67 1u9y h ALA 13 Ca 0.22 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1u9y h ALA 13 Cb 0.35 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 1u9y h ALA 13 CO -0.00 0.61 0.03 0.35 0.00 0.00 0.00 179.25 180.24 1u9y h PHE 14 N 1.07 0.13 -0.85 0.00 3.57 -1.30 -0.52 116.94 119.04 1u9y h PHE 14 Ca 0.25 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.74 1u9y h PHE 14 Cb 0.17 -0.04 -0.04 0.00 2.79 0.00 0.00 35.95 38.83 1u9y h PHE 14 CO 0.02 0.29 0.52 0.87 -2.23 0.00 0.00 178.31 177.77 1u9y h LYS 15 N -0.06 1.15 -0.11 1.11 1.57 -0.90 -1.05 116.57 118.28 1u9y h LYS 15 Ca 0.03 -0.10 -0.03 0.00 -1.87 0.00 0.00 60.65 58.68 1u9y h LYS 15 Cb 0.22 -0.24 -0.00 0.00 0.08 0.00 0.00 32.23 32.28 1u9y h LYS 15 CO -0.00 0.80 -0.05 0.28 -0.57 0.00 0.00 179.45 179.90 1u9y h VAL 16 N 1.17 1.32 -0.93 0.50 2.07 -1.01 -2.05 116.25 117.32 1u9y h VAL 16 Ca 0.31 -1.07 0.07 0.00 0.82 0.00 0.00 66.70 66.82 1u9y h VAL 16 Cb -0.06 1.80 -0.07 0.00 -1.52 0.00 0.00 31.29 31.44 1u9y h VAL 16 CO -0.06 0.31 0.59 0.00 0.02 0.00 0.00 177.57 178.43 1u9y h ALA 17 N 0.65 1.30 -0.55 1.67 0.00 -0.87 0.12 119.26 121.59 1u9y h ALA 17 Ca 0.02 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 1u9y h ALA 17 Cb 0.51 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 1u9y h ALA 17 CO 0.02 0.35 0.27 -0.22 0.00 0.00 0.00 179.25 179.66 1u9y h LYS 18 N 1.06 0.79 -0.60 0.00 3.64 -1.09 0.20 116.57 120.57 1u9y h LYS 18 Ca 0.41 -0.11 -0.09 0.00 -1.27 0.00 0.00 60.65 59.58 1u9y h LYS 18 Cb 0.19 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.85 1u9y h LYS 18 CO -0.18 0.64 0.01 -0.07 -2.27 0.00 0.00 179.45 177.58 1u9y h LEU 19 N 0.74 1.02 0.00 5.20 3.38 -0.55 -1.40 115.31 123.70 1u9y h LEU 19 Ca 0.19 -0.28 0.00 0.00 0.09 0.00 0.00 57.88 57.87 1u9y h LEU 19 Cb 0.11 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.59 1u9y h LEU 19 CO -0.02 1.07 0.00 0.18 0.09 0.00 0.00 178.44 179.75 1u9y n LEU 20 N -4.18 0.00 -3.99 1.67 4.77 0.33 -4.88 117.00 110.72 1u9y n LEU 20 Ca 0.03 0.00 -0.29 0.00 -0.03 0.00 0.00 56.01 55.72 1u9y n LEU 20 Cb 0.34 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.43 1u9y n LEU 20 CO 0.44 0.00 -0.07 -3.20 -1.33 0.00 0.00 177.39 173.23 1u9y n ASN 21 N -0.95 -2.33 -4.52 -1.43 5.15 0.41 -4.97 115.26 106.63 1u9y n ASN 21 Ca 0.21 -0.93 -0.30 0.00 -0.60 0.00 0.00 54.58 52.96 1u9y n ASN 21 Cb 0.09 -3.29 -0.11 0.00 -0.53 0.00 0.00 39.78 35.94 1u9y n ASN 21 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 1u9y s THR 22 N -3.58 3.01 0.05 -0.44 2.01 0.41 -5.02 115.64 112.09 1u9y s THR 22 Ca 0.37 -1.39 -0.31 0.00 0.31 0.00 0.00 61.69 60.67 1u9y s THR 22 Cb -0.19 -2.38 -0.06 0.00 0.01 0.00 0.00 72.50 69.87 1u9y s THR 22 CO 0.88 0.13 1.34 -0.75 -0.69 0.00 0.00 174.62 175.52 1u9y s LYS 23 N -2.09 4.33 -0.26 4.92 2.20 -1.26 -4.45 119.74 123.13 1u9y s LYS 23 Ca 0.19 1.94 -0.29 0.00 -0.36 0.00 0.00 55.97 57.44 1u9y s LYS 23 Cb -0.11 -3.42 0.00 0.00 -1.51 0.00 0.00 37.83 32.80 1u9y s LYS 23 CO 0.11 -0.45 1.18 -1.17 -0.36 0.00 0.00 175.35 174.65 1u9y s LEU 24 N 1.68 4.01 0.23 5.43 2.96 -1.26 -4.46 118.68 127.27 1u9y s LEU 24 Ca 0.62 1.32 -0.31 0.00 -0.22 0.00 0.00 54.13 55.55 1u9y s LEU 24 Cb -0.32 -3.54 -0.10 0.00 0.50 0.00 0.00 46.19 42.72 1u9y s LEU 24 CO 0.28 -0.86 1.52 -0.89 -1.32 0.00 0.00 176.35 175.08 1u9y s THR 25 N 3.71 2.49 -0.26 3.68 2.01 -1.18 -4.96 115.64 121.14 1u9y s THR 25 Ca 0.50 0.39 -0.29 0.00 0.31 0.00 0.00 61.69 62.60 1u9y s THR 25 Cb -0.16 -3.25 0.00 0.00 0.01 0.00 0.00 72.50 69.10 1u9y s THR 25 CO 0.15 0.05 1.16 -0.60 -0.69 0.00 0.00 174.62 174.69 1u9y s ARG 26 N 0.13 4.12 -0.21 4.92 6.06 -1.26 -4.57 118.95 128.15 1u9y s ARG 26 Ca 0.64 1.32 0.00 0.00 -2.50 0.00 0.00 55.73 55.19 1u9y s ARG 26 Cb -0.44 -3.75 0.02 0.00 0.06 0.00 0.00 34.95 30.84 1u9y s ARG 26 CO 0.40 -0.84 -0.14 0.08 -2.50 0.00 0.00 175.30 172.30 1u9y s VAL 27 N 3.66 2.40 0.05 7.11 1.01 -1.26 -1.01 120.40 132.35 1u9y s VAL 27 Ca 0.50 -0.98 -0.30 0.00 0.00 0.00 0.00 61.98 61.19 1u9y s VAL 27 Cb -0.16 -2.11 -0.05 0.00 0.00 0.00 0.00 36.38 34.06 1u9y s VAL 27 CO 0.15 0.39 1.07 -0.70 0.00 0.00 0.00 175.10 176.01 1u9y s GLU 28 N 1.30 4.53 -0.03 2.72 2.12 0.24 -4.88 118.70 124.69 1u9y s GLU 28 Ca 0.02 1.58 0.00 0.00 0.36 0.00 0.00 54.97 56.94 1u9y s GLU 28 Cb -0.15 -3.39 0.03 0.00 0.26 0.00 0.00 34.13 30.88 1u9y s GLU 28 CO -0.09 -0.10 0.01 -0.47 -0.54 0.00 0.00 175.26 174.07 1u9y s TYR 29 N 0.83 0.22 0.34 5.30 5.04 -1.26 -0.89 117.35 126.93 1u9y s TYR 29 Ca 0.54 0.04 -0.17 0.00 -2.44 0.00 0.00 57.07 55.04 1u9y s TYR 29 Cb -0.25 -0.35 0.05 0.00 0.35 0.00 0.00 41.96 41.76 1u9y s TYR 29 CO 0.29 -0.11 0.81 -1.59 -1.34 0.00 0.00 175.55 173.61 1u9y s LYS 30 N 1.02 2.04 -0.04 4.97 -2.85 -0.76 -5.02 119.74 119.12 1u9y s LYS 30 Ca -0.10 -1.29 0.06 0.00 -1.00 0.00 0.00 55.97 53.65 1u9y s LYS 30 Cb -0.13 0.59 -0.01 0.00 -2.06 0.00 0.00 37.83 36.21 1u9y s LYS 30 CO -0.02 -0.95 -0.23 1.03 0.10 0.00 0.00 175.35 175.27 1u9y s ARG 31 N -2.55 2.13 0.93 1.78 1.81 -1.26 -0.89 118.95 120.89 1u9y s ARG 31 Ca 0.15 -0.83 -0.13 0.00 -1.72 0.00 0.00 55.73 53.20 1u9y s ARG 31 Cb -0.05 -1.92 0.15 0.00 -0.45 0.00 0.00 34.95 32.69 1u9y s ARG 31 CO 0.10 0.42 1.16 -0.06 -0.68 0.00 0.00 175.30 176.24 1u9y s PHE 32 N -0.32 2.28 0.50 -0.53 0.40 -0.47 -4.81 117.98 115.03 1u9y s PHE 32 Ca 0.02 0.74 0.20 0.00 -0.60 0.00 0.00 56.93 57.30 1u9y s PHE 32 Cb -0.11 -3.50 1.27 0.00 0.51 0.00 0.00 43.02 41.19 1u9y s PHE 32 CO 0.01 -2.45 2.02 -1.35 0.70 0.00 0.00 175.22 174.15 1u9y h PRO 33 N -1.55 0.11 -0.96 0.24 0.11 -2.01 0.23 132.00 128.17 1u9y h PRO 33 Ca -0.49 -0.01 0.12 0.00 0.11 0.00 0.00 66.00 65.74 1u9y h PRO 33 Cb 1.32 -0.02 -0.08 0.00 0.11 0.00 0.00 31.00 32.32 1u9y h PRO 33 CO 0.57 0.07 0.59 -0.44 -0.21 0.00 0.00 178.00 178.58 1u9y h ASP 34 N 0.11 0.85 0.00 -2.05 3.32 -2.04 -3.45 116.42 113.16 1u9y h ASP 34 Ca 0.21 0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.31 1u9y h ASP 34 Cb 0.70 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 40.13 1u9y h ASP 34 CO -0.02 0.45 0.00 -3.20 -1.72 0.00 0.00 179.24 174.75 1u9y n ASN 35 N -4.66 0.00 -4.79 6.45 5.15 0.80 -5.08 115.26 113.13 1u9y n ASN 35 Ca 0.18 0.00 -0.35 0.00 -0.60 0.00 0.00 54.58 53.81 1u9y n ASN 35 Cb 0.35 0.00 -0.04 0.00 -0.53 0.00 0.00 39.78 39.56 1u9y n ASN 35 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 1u9y s GLU 36 N -0.66 3.95 0.25 1.20 2.02 -1.26 -4.72 118.70 119.49 1u9y s GLU 36 Ca 0.00 1.44 -0.30 0.00 0.02 0.00 0.00 54.97 56.13 1u9y s GLU 36 Cb 0.00 -2.30 -0.09 0.00 0.10 0.00 0.00 34.13 31.84 1u9y s GLU 36 CO 0.00 -0.31 1.04 0.42 0.02 0.00 0.00 175.26 176.43 1u9y s ILE 37 N -1.83 3.75 -0.13 -1.63 1.01 -1.26 -1.37 121.20 119.74 1u9y s ILE 37 Ca 0.63 1.73 0.01 0.00 0.00 0.00 0.00 60.65 63.02 1u9y s ILE 37 Cb -0.19 -4.10 0.02 0.00 0.01 0.00 0.00 42.46 38.20 1u9y s ILE 37 CO 0.24 0.40 -0.13 -0.47 0.00 0.00 0.00 174.94 174.98 1u9y s TYR 38 N -1.07 1.94 0.21 3.97 5.04 -0.07 -4.91 117.35 122.47 1u9y s TYR 38 Ca 0.44 -1.02 0.10 0.00 -2.44 0.00 0.00 57.07 54.15 1u9y s TYR 38 Cb -0.29 -1.45 -0.05 0.00 0.35 0.00 0.00 41.96 40.52 1u9y s TYR 38 CO 0.37 -0.57 -0.20 0.14 -1.34 0.00 0.00 175.55 173.94 1u9y s VAL 39 N 1.38 2.18 -0.30 3.14 -7.23 -1.26 -1.82 120.40 116.49 1u9y s VAL 39 Ca 0.01 -2.13 -0.12 0.00 -1.81 0.00 0.00 61.98 57.93 1u9y s VAL 39 Cb -0.13 -2.09 0.14 0.00 0.56 0.00 0.00 36.38 34.86 1u9y s VAL 39 CO -0.07 -0.30 0.80 -0.60 -0.31 0.00 0.00 175.10 174.62 1u9y s ARG 40 N -3.05 0.45 -0.60 4.82 3.52 -0.07 -4.95 118.95 119.08 1u9y s ARG 40 Ca 0.22 1.12 -0.28 0.00 -0.13 0.00 0.00 55.73 56.67 1u9y s ARG 40 Cb -0.06 0.65 0.01 0.00 -1.56 0.00 0.00 34.95 34.00 1u9y s ARG 40 CO 0.10 -0.15 1.43 0.42 -0.81 0.00 0.00 175.30 176.29 1u9y s ILE 41 N 2.63 3.73 -0.06 4.11 -1.09 -1.26 0.80 121.20 130.07 1u9y s ILE 41 Ca -0.05 0.58 -0.16 0.00 -2.23 0.00 0.00 60.65 58.79 1u9y s ILE 41 Cb -0.09 -4.48 -0.12 0.00 -1.58 0.00 0.00 42.46 36.19 1u9y s ILE 41 CO -0.18 -1.27 0.66 0.58 -1.23 0.00 0.00 174.94 173.49 1u9y h VAL 42 N 6.36 0.50 -4.13 2.92 2.07 -1.45 -3.46 116.25 119.06 1u9y h VAL 42 Ca -0.27 -1.01 -0.54 0.00 0.82 0.00 0.00 66.70 65.70 1u9y h VAL 42 Cb 1.09 0.86 0.18 0.00 -1.52 0.00 0.00 31.29 31.90 1u9y h VAL 42 CO 1.20 0.14 0.32 0.47 0.02 0.00 0.00 177.57 179.72 1u9y n ASP 43 N -4.95 1.07 -4.74 0.57 8.00 -1.22 -4.95 116.55 110.32 1u9y n ASP 43 Ca -0.06 0.62 -0.40 0.00 0.71 0.00 0.00 54.79 55.65 1u9y n ASP 43 Cb 0.22 -1.50 -0.05 0.00 -0.02 0.00 0.00 41.12 39.76 1u9y n ASP 43 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1u9y s GLU 44 N -3.94 4.76 -0.32 -1.24 2.02 -1.26 -4.96 118.70 113.76 1u9y s GLU 44 Ca 0.74 1.43 -0.09 0.00 0.02 0.00 0.00 54.97 57.07 1u9y s GLU 44 Cb -0.31 -3.32 0.00 0.00 0.10 0.00 0.00 34.13 30.61 1u9y s GLU 44 CO 0.50 0.40 0.14 0.42 0.02 0.00 0.00 175.26 176.73 1u9y s ILE 45 N -0.68 4.40 -0.19 -1.63 1.01 -1.26 -4.93 121.20 117.93 1u9y s ILE 45 Ca 0.43 -0.57 -0.16 0.00 0.00 0.00 0.00 60.65 60.35 1u9y s ILE 45 Cb -0.24 -3.28 -0.07 0.00 0.01 0.00 0.00 42.46 38.87 1u9y s ILE 45 CO 0.30 0.02 -0.28 0.59 0.00 0.00 0.00 174.94 175.58 1u9y n ASN 46 N 4.95 1.91 -4.36 3.58 3.02 -1.26 -4.96 115.26 118.12 1u9y n ASN 46 Ca -0.14 0.41 -0.37 0.00 -0.03 0.00 0.00 54.58 54.46 1u9y n ASN 46 Cb 0.48 -0.80 0.06 0.00 -0.61 0.00 0.00 39.78 38.91 1u9y n ASN 46 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1u9y n ASP 47 N -4.47 -2.31 -0.41 6.41 -0.08 -1.26 -4.93 116.55 109.50 1u9y n ASP 47 Ca -0.19 0.54 0.07 0.00 -1.51 0.00 0.00 54.79 53.70 1u9y n ASP 47 Cb 0.52 -1.09 0.18 0.00 2.34 0.00 0.00 41.12 43.07 1u9y n ASP 47 CO 0.00 0.00 0.00 -0.90 0.12 0.00 0.00 177.20 176.42 1u9y n ASP 48 N 0.69 2.21 -3.71 1.67 3.85 -1.26 -4.68 116.55 115.31 1u9y n ASP 48 Ca 0.08 -3.46 -0.24 0.00 -0.71 0.00 0.00 54.79 50.46 1u9y n ASP 48 Cb 0.50 -0.49 -0.17 0.00 -1.35 0.00 0.00 41.12 39.61 1u9y n ASP 48 CO 0.00 0.00 0.00 -1.61 -1.01 0.00 0.00 177.20 174.58 1u9y s GLU 49 N -3.05 0.40 0.23 0.11 2.02 -1.26 0.10 118.70 117.25 1u9y s GLU 49 Ca 0.36 -0.03 0.11 0.00 0.02 0.00 0.00 54.97 55.43 1u9y s GLU 49 Cb 0.33 -1.38 -0.05 0.00 0.10 0.00 0.00 34.13 33.13 1u9y s GLU 49 CO -0.01 -0.47 -0.22 0.00 0.02 0.00 0.00 175.26 174.58 1u9y s ALA 50 N 2.01 2.57 -0.19 5.21 0.00 -0.59 -1.89 121.76 128.87 1u9y s ALA 50 Ca 0.03 -1.73 0.00 0.00 0.00 0.00 0.00 51.96 50.27 1u9y s ALA 50 Cb -0.14 -0.28 0.04 0.00 0.00 0.00 0.00 23.12 22.73 1u9y s ALA 50 CO -0.06 0.35 -0.10 0.08 0.00 0.00 0.00 175.76 176.03 1u9y s VAL 51 N -2.07 1.51 -0.15 0.00 1.01 -0.41 -1.50 120.40 118.79 1u9y s VAL 51 Ca 0.24 -0.88 -0.19 0.00 0.00 0.00 0.00 61.98 61.15 1u9y s VAL 51 Cb -0.06 -1.59 -0.04 0.00 0.00 0.00 0.00 36.38 34.69 1u9y s VAL 51 CO 0.12 0.19 0.54 -0.63 0.00 0.00 0.00 175.10 175.32 1u9y s ILE 52 N 1.46 5.12 -0.35 2.22 1.01 0.31 -0.19 121.20 130.78 1u9y s ILE 52 Ca -0.00 1.04 0.02 0.00 0.00 0.00 0.00 60.65 61.72 1u9y s ILE 52 Cb -0.16 -3.87 0.10 0.00 0.01 0.00 0.00 42.46 38.54 1u9y s ILE 52 CO -0.08 0.23 0.07 -0.63 0.00 0.00 0.00 174.94 174.53 1u9y s ILE 53 N 1.21 2.51 -0.24 2.92 1.01 -0.74 0.69 121.20 128.55 1u9y s ILE 53 Ca 0.27 -2.22 -0.03 0.00 0.00 0.00 0.00 60.65 58.67 1u9y s ILE 53 Cb -0.16 -2.79 0.11 0.00 0.01 0.00 0.00 42.46 39.64 1u9y s ILE 53 CO 0.11 -0.57 0.24 0.21 0.00 0.00 0.00 174.94 174.93 1u9y s ASN 54 N 1.12 1.67 0.81 3.58 2.47 -0.33 -1.90 114.94 122.36 1u9y s ASN 54 Ca 0.09 -0.50 -0.11 0.00 0.42 0.00 0.00 52.86 52.75 1u9y s ASN 54 Cb -0.20 0.37 0.08 0.00 -1.45 0.00 0.00 41.25 40.05 1u9y s ASN 54 CO -0.07 -0.36 1.10 0.28 -3.72 0.00 0.00 177.10 174.33 1u9y s THR 55 N 2.32 2.98 -0.55 -5.21 -1.32 -1.26 -4.38 115.64 108.23 1u9y s THR 55 Ca 0.08 0.32 0.04 0.00 -1.21 0.00 0.00 61.69 60.92 1u9y s THR 55 Cb -0.15 -3.03 0.39 0.00 -1.51 0.00 0.00 72.50 68.20 1u9y s THR 55 CO -0.22 -0.42 1.27 0.00 -2.21 0.00 0.00 174.62 173.04 1u9y n GLN 56 N -3.50 3.36 -0.09 7.08 6.02 -0.80 -4.74 117.38 124.72 1u9y n GLN 56 Ca 0.07 -4.40 -0.10 0.00 -0.01 0.00 0.00 57.00 52.56 1u9y n GLN 56 Cb 0.56 -2.26 -0.02 0.00 1.02 0.00 0.00 30.24 29.54 1u9y n GLN 56 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 177.06 175.83 1u9y h LYS 57 N 2.76 0.43 -4.14 -1.09 3.64 -1.87 -3.04 116.57 113.25 1u9y h LYS 57 Ca 0.33 -0.07 -0.76 0.00 -1.27 0.00 0.00 60.65 58.88 1u9y h LYS 57 Cb 0.69 -0.07 -0.24 0.00 -0.41 0.00 0.00 32.23 32.20 1u9y h LYS 57 CO 0.96 0.42 0.37 -0.80 -2.27 0.00 0.00 179.45 178.13 1u9y s ASN 58 N -5.67 6.80 0.03 4.20 0.01 -1.26 -4.95 114.94 114.10 1u9y s ASN 58 Ca -0.13 -2.64 -0.06 0.00 -0.71 0.00 0.00 52.86 49.31 1u9y s ASN 58 Cb 0.09 -2.27 -0.02 0.00 0.41 0.00 0.00 41.25 39.46 1u9y s ASN 58 CO 0.72 -0.67 1.11 1.56 -1.51 0.00 0.00 177.10 178.31 1u9y h GLN 59 N 7.90 -0.04 0.00 -0.60 7.50 -1.92 -2.00 115.11 125.96 1u9y h GLN 59 Ca 0.14 0.00 -0.02 0.00 0.50 0.00 0.00 58.65 59.27 1u9y h GLN 59 Cb 1.01 0.01 -0.00 0.00 0.05 0.00 0.00 27.48 28.55 1u9y h GLN 59 CO 0.89 -0.03 -0.11 -0.91 -1.50 0.00 0.00 178.83 177.17 1u9y h ASN 60 N -0.04 0.00 -0.31 1.46 2.35 -1.92 -2.24 115.58 114.87 1u9y h ASN 60 Ca 0.02 0.00 -0.16 0.00 -0.55 0.00 0.00 56.30 55.61 1u9y h ASN 60 Cb 0.10 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.47 1u9y h ASN 60 CO -0.16 0.11 -0.43 0.44 -1.65 0.00 0.00 177.43 175.74 1u9y h ASP 61 N 0.00 0.93 -0.65 5.81 3.32 -1.92 -2.51 116.42 121.39 1u9y h ASP 61 Ca -0.00 -0.50 -0.07 0.00 0.02 0.00 0.00 57.03 56.48 1u9y h ASP 61 Cb 0.22 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.48 1u9y h ASP 61 CO 0.01 1.25 0.15 0.00 -1.72 0.00 0.00 179.24 178.93 1u9y h ALA 62 N 0.71 1.00 -0.05 3.45 0.00 -0.85 0.09 119.26 123.61 1u9y h ALA 62 Ca 0.03 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 1u9y h ALA 62 Cb 1.03 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.56 1u9y h ALA 62 CO 0.10 0.65 0.01 0.82 0.00 0.00 0.00 179.25 180.82 1u9y h ILE 63 N 1.01 1.22 -0.38 0.00 2.04 -1.39 -1.32 117.51 118.71 1u9y h ILE 63 Ca 0.21 -0.68 -0.10 0.00 1.00 0.00 0.00 64.86 65.29 1u9y h ILE 63 Cb 0.37 1.59 -0.01 0.00 -0.74 0.00 0.00 36.82 38.03 1u9y h ILE 63 CO 0.00 0.19 -0.14 0.58 0.00 0.00 0.00 178.15 178.78 1u9y h VAL 64 N -0.18 1.28 -0.75 1.67 2.07 -1.34 -1.95 116.25 117.05 1u9y h VAL 64 Ca 0.01 -1.25 -0.00 0.00 0.82 0.00 0.00 66.70 66.28 1u9y h VAL 64 Cb 0.29 1.29 -0.04 0.00 -1.52 0.00 0.00 31.29 31.32 1u9y h VAL 64 CO 0.00 0.42 0.45 -0.08 0.02 0.00 0.00 177.57 178.38 1u9y h GLU 65 N 0.57 1.01 -0.36 1.57 4.81 -0.98 -1.33 114.58 119.87 1u9y h GLU 65 Ca 0.09 -0.09 -0.06 0.00 -0.13 0.00 0.00 59.36 59.17 1u9y h GLU 65 Cb 0.68 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 29.83 1u9y h GLU 65 CO 0.05 0.71 -0.03 1.15 -0.73 0.00 0.00 179.01 180.16 1u9y h THR 66 N 1.03 1.27 -0.36 0.32 2.02 -1.08 -0.91 112.91 115.20 1u9y h THR 66 Ca 0.27 -1.04 0.03 0.00 0.77 0.00 0.00 66.41 66.44 1u9y h THR 66 Cb -0.04 1.22 -0.03 0.00 -1.74 0.00 0.00 68.15 67.56 1u9y h THR 66 CO -0.05 0.34 0.16 0.40 0.37 0.00 0.00 175.52 176.74 1u9y h ILE 67 N 0.46 0.95 -0.61 3.11 2.04 -0.86 -1.31 117.51 121.28 1u9y h ILE 67 Ca 0.10 -0.11 -0.06 0.00 1.00 0.00 0.00 64.86 65.79 1u9y h ILE 67 Cb 0.51 0.59 -0.03 0.00 -0.74 0.00 0.00 36.82 37.15 1u9y h ILE 67 CO 0.02 0.06 0.16 -0.07 0.00 0.00 0.00 178.15 178.33 1u9y h LEU 68 N 0.33 0.91 -0.90 1.44 3.38 -1.14 -2.69 115.31 116.65 1u9y h LEU 68 Ca 0.16 -0.23 -0.05 0.00 0.09 0.00 0.00 57.88 57.85 1u9y h LEU 68 Cb 0.09 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 1u9y h LEU 68 CO -0.13 0.90 0.23 -0.07 0.09 0.00 0.00 178.44 179.46 1u9y h LEU 69 N 0.88 0.97 -0.57 1.67 3.38 -0.82 -1.74 115.31 119.08 1u9y h LEU 69 Ca 0.19 -0.16 -0.05 0.00 0.09 0.00 0.00 57.88 57.95 1u9y h LEU 69 Cb 0.33 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 1u9y h LEU 69 CO -0.00 0.89 0.15 0.00 0.09 0.00 0.00 178.44 179.57 1u9y h ASP 71 N 0.82 0.59 -0.86 0.00 3.58 -1.24 -0.69 116.42 118.60 1u9y h ASP 71 Ca 0.18 -0.06 -0.03 0.00 0.42 0.00 0.00 57.03 57.54 1u9y h ASP 71 Cb 0.33 -0.15 -0.04 0.00 1.72 0.00 0.00 39.33 41.19 1u9y h ASP 71 CO -0.00 0.48 0.42 0.00 -2.88 0.00 0.00 179.24 177.26 1u9y h ALA 72 N 1.13 1.11 -0.15 -0.78 0.00 -0.90 -1.56 119.26 118.12 1u9y h ALA 72 Ca 0.17 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 1u9y h ALA 72 Cb 0.00 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 17.45 1u9y h ALA 72 CO -0.03 0.67 -0.16 -0.07 0.00 0.00 0.00 179.25 179.66 1u9y h LEU 73 N 1.23 0.40 -0.52 0.00 3.38 -0.71 -3.18 115.31 115.90 1u9y h LEU 73 Ca 0.30 -0.48 0.01 0.00 0.09 0.00 0.00 57.88 57.80 1u9y h LEU 73 Cb 0.11 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.71 1u9y h LEU 73 CO -0.04 0.80 0.33 0.03 0.09 0.00 0.00 178.44 179.66 1u9y h ARG 74 N 0.01 0.65 0.00 1.13 2.47 -1.03 -0.31 114.38 117.31 1u9y h ARG 74 Ca 0.02 -0.04 0.00 0.00 -1.26 0.00 0.00 59.98 58.70 1u9y h ARG 74 Cb 0.69 -0.15 0.00 0.00 -1.65 0.00 0.00 29.97 28.86 1u9y h ARG 74 CO 0.04 0.43 0.00 -3.47 0.56 0.00 0.00 179.97 177.53 1u9y n ASP 75 N -4.75 0.00 -0.17 7.04 2.03 -0.60 -1.62 116.55 118.49 1u9y n ASP 75 Ca 0.03 -0.79 0.03 0.00 0.52 0.00 0.00 54.79 54.58 1u9y n ASP 75 Cb 0.04 0.00 0.04 0.00 -0.72 0.00 0.00 41.12 40.48 1u9y n ASP 75 CO 0.00 0.00 0.00 1.21 -1.92 0.00 0.00 177.20 176.49 1u9y n GLU 76 N -0.58 0.96 0.00 -0.67 2.13 -0.15 -5.02 120.64 117.32 1u9y n GLU 76 Ca 0.02 -1.45 0.00 0.00 0.66 0.00 0.00 57.16 56.39 1u9y n GLU 76 Cb 0.01 -0.89 0.00 0.00 0.27 0.00 0.00 31.44 30.83 1u9y n GLU 76 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1u9y n GLY 77 N -0.51 3.47 3.68 8.31 0.00 -0.64 -4.91 105.19 114.59 1u9y n GLY 77 Ca 0.05 0.00 -0.50 0.00 0.00 0.00 0.00 46.02 45.57 1u9y n GLY 77 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1u9y n VAL 78 N -1.90 0.49 0.02 1.61 0.31 -1.04 -4.84 118.33 112.97 1u9y n VAL 78 Ca 0.00 -0.09 -0.14 0.00 -0.01 0.00 0.00 64.34 64.10 1u9y n VAL 78 Cb 0.00 -1.73 -0.14 0.00 -0.91 0.00 0.00 33.84 31.06 1u9y n VAL 78 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 1u9y h LYS 79 N 8.59 0.15 -4.55 5.55 6.56 -0.69 -3.41 116.57 128.77 1u9y h LYS 79 Ca -0.48 -0.26 -0.54 0.00 -1.06 0.00 0.00 60.65 58.31 1u9y h LYS 79 Cb 1.28 0.10 -0.35 0.00 -0.57 0.00 0.00 32.23 32.69 1u9y h LYS 79 CO 0.94 0.92 -0.82 0.21 -2.06 0.00 0.00 179.45 178.64 1u9y s LYS 80 N -2.60 1.85 -0.15 3.15 2.20 -0.71 -5.02 119.74 118.45 1u9y s LYS 80 Ca -0.10 -0.43 0.02 0.00 -0.36 0.00 0.00 55.97 55.09 1u9y s LYS 80 Cb 0.07 -1.62 0.02 0.00 -1.51 0.00 0.00 37.83 34.79 1u9y s LYS 80 CO 0.82 -0.07 -0.20 0.42 -0.36 0.00 0.00 175.35 175.97 1u9y s ILE 81 N 1.00 1.93 -0.18 5.43 1.01 -1.26 -1.55 121.20 127.59 1u9y s ILE 81 Ca -0.08 -0.88 -0.05 0.00 0.00 0.00 0.00 60.65 59.64 1u9y s ILE 81 Cb -0.15 -1.74 -0.03 0.00 0.01 0.00 0.00 42.46 40.55 1u9y s ILE 81 CO -0.01 0.52 0.00 -0.89 0.00 0.00 0.00 174.94 174.57 1u9y s THR 82 N 1.09 4.16 -0.25 2.92 2.01 -0.56 -1.14 115.64 123.86 1u9y s THR 82 Ca -0.01 -0.25 -0.09 0.00 0.31 0.00 0.00 61.69 61.64 1u9y s THR 82 Cb -0.14 -2.86 -0.04 0.00 0.01 0.00 0.00 72.50 69.47 1u9y s THR 82 CO -0.07 0.46 0.14 -0.22 -0.69 0.00 0.00 174.62 174.24 1u9y s LEU 83 N 0.57 3.87 -0.35 4.42 2.96 0.51 -0.53 118.68 130.13 1u9y s LEU 83 Ca -0.01 -0.02 -0.07 0.00 -0.22 0.00 0.00 54.13 53.81 1u9y s LEU 83 Cb -0.14 -2.05 0.04 0.00 0.50 0.00 0.00 46.19 44.55 1u9y s LEU 83 CO 0.02 0.01 0.13 -0.69 -1.32 0.00 0.00 176.35 174.51 1u9y s VAL 84 N 1.36 3.95 -0.68 1.68 1.01 0.22 -0.18 120.40 127.76 1u9y s VAL 84 Ca 0.06 -1.11 0.01 0.00 0.00 0.00 0.00 61.98 60.95 1u9y s VAL 84 Cb -0.15 -3.25 0.17 0.00 0.00 0.00 0.00 36.38 33.15 1u9y s VAL 84 CO 0.06 -0.21 0.48 0.00 0.00 0.00 0.00 175.10 175.43 1u9y s ALA 85 N 1.43 3.72 0.20 5.51 0.00 -0.16 -1.19 121.76 131.27 1u9y s ALA 85 Ca -0.01 -3.54 -0.23 0.00 0.00 0.00 0.00 51.96 48.19 1u9y s ALA 85 Cb -0.20 -2.46 0.11 0.00 0.00 0.00 0.00 23.12 20.58 1u9y s ALA 85 CO 0.03 -2.10 1.52 -2.30 0.00 0.00 0.00 175.76 172.92 1u9y n PRO 86 N 2.76 -0.31 -3.80 0.00 -0.02 -1.26 -3.54 135.00 128.83 1u9y n PRO 86 Ca 0.13 1.50 -0.36 0.00 -2.02 0.00 0.00 63.50 62.75 1u9y n PRO 86 Cb 0.35 -2.22 -0.13 0.00 -0.02 0.00 0.00 33.50 31.49 1u9y n PRO 86 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1u9y s TYR 87 N -5.75 3.07 -0.24 6.00 5.04 -1.25 -1.85 117.35 122.36 1u9y s TYR 87 Ca -0.13 -0.48 -0.09 0.00 -2.44 0.00 0.00 57.07 53.93 1u9y s TYR 87 Cb 0.16 -2.21 -0.04 0.00 0.35 0.00 0.00 41.96 40.22 1u9y s TYR 87 CO 0.66 -0.37 0.11 -1.17 -1.34 0.00 0.00 175.55 173.45 1u9y s LEU 88 N 1.53 3.77 0.64 6.97 2.96 -1.23 -1.90 118.68 131.42 1u9y s LEU 88 Ca 0.06 -0.05 -0.08 0.00 -0.22 0.00 0.00 54.13 53.85 1u9y s LEU 88 Cb -0.15 -2.01 0.02 0.00 0.50 0.00 0.00 46.19 44.55 1u9y s LEU 88 CO 0.03 0.02 0.97 0.00 -1.32 0.00 0.00 176.35 176.04 1u9y s ALA 89 N 1.31 3.17 -1.75 5.97 0.00 -1.26 -4.20 121.76 124.99 1u9y s ALA 89 Ca 0.06 -0.62 0.00 0.00 0.00 0.00 0.00 51.96 51.39 1u9y s ALA 89 Cb -0.15 -2.72 0.00 0.00 0.00 0.00 0.00 23.12 20.25 1u9y s ALA 89 CO 0.05 -0.95 0.00 0.66 0.00 0.00 0.00 175.76 175.52 1u9y n TYR 90 N -2.74 -0.37 -0.61 0.00 4.01 -1.26 -4.82 117.16 111.37 1u9y n TYR 90 Ca 0.06 0.00 0.06 0.00 -0.16 0.00 0.00 57.90 57.86 1u9y n TYR 90 Cb 0.58 -3.10 0.15 0.00 -0.31 0.00 0.00 39.34 36.66 1u9y n TYR 90 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1u9y n ALA 91 N 0.40 2.41 -0.05 -0.72 0.00 -1.26 -2.37 120.51 118.92 1u9y n ALA 91 Ca -0.18 -1.84 -0.08 0.00 0.00 0.00 0.00 53.44 51.34 1u9y n ALA 91 Cb 0.58 -0.42 0.08 0.00 0.00 0.00 0.00 19.45 19.69 1u9y n ALA 91 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 1u9y h ARG 92 N 1.04 0.70 -6.23 0.00 2.43 -1.87 -3.39 114.38 107.05 1u9y h ARG 92 Ca 0.00 -0.32 -0.60 0.00 -0.81 0.00 0.00 59.98 58.24 1u9y h ARG 92 Cb 0.97 -0.01 -0.09 0.00 -0.42 0.00 0.00 29.97 30.42 1u9y h ARG 92 CO 0.07 0.93 -0.60 -0.65 -1.51 0.00 0.00 179.97 178.21 1u9y s GLN 93 N -4.41 2.79 -0.08 0.20 -0.21 -1.26 -4.55 119.66 112.13 1u9y s GLN 93 Ca -0.09 -0.85 0.14 0.00 0.02 0.00 0.00 55.36 54.58 1u9y s GLN 93 Cb 0.12 -2.61 -0.23 0.00 1.00 0.00 0.00 33.01 31.29 1u9y s GLN 93 CO 0.84 0.51 0.54 -3.47 -2.12 0.00 0.00 175.29 171.59 1u9y n ASP 94 N -0.01 0.70 -0.86 5.90 -0.08 -1.26 -4.75 116.55 116.19 1u9y n ASP 94 Ca -0.09 0.33 0.00 0.00 -1.51 0.00 0.00 54.79 53.52 1u9y n ASP 94 Cb 0.54 0.15 0.00 0.00 2.34 0.00 0.00 41.12 44.15 1u9y n ASP 94 CO 0.00 0.00 0.00 2.29 0.12 0.00 0.00 177.20 179.61 1u9y n LYS 95 N -2.99 0.00 -3.07 -0.67 2.85 -1.26 -5.02 118.16 108.00 1u9y n LYS 95 Ca -0.20 0.00 -0.36 0.00 -1.05 0.00 0.00 58.31 56.70 1u9y n LYS 95 Cb 1.07 0.00 -0.06 0.00 -0.65 0.00 0.00 35.03 35.39 1u9y n LYS 95 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 1u9y s LYS 96 N -1.58 4.29 0.00 -1.58 1.02 -1.26 -4.91 119.74 115.72 1u9y s LYS 96 Ca 0.00 0.92 0.09 0.00 0.02 0.00 0.00 55.97 57.00 1u9y s LYS 96 Cb 0.00 -2.87 0.19 0.00 -0.52 0.00 0.00 37.83 34.63 1u9y s LYS 96 CO 0.00 0.38 1.07 1.19 -0.92 0.00 0.00 175.35 177.07 1u9y n PHE 97 N 0.70 0.25 -3.59 3.18 3.01 -1.26 -4.99 117.46 114.77 1u9y n PHE 97 Ca -0.02 -0.33 -0.12 0.00 1.01 0.00 0.00 57.45 58.00 1u9y n PHE 97 Cb 0.51 -0.02 -0.06 0.00 -0.01 0.00 0.00 39.48 39.90 1u9y n PHE 97 CO 0.00 0.00 0.00 -0.80 1.01 0.00 0.00 176.76 176.97 1u9y s ASN 98 N -0.92 -0.46 0.62 4.37 0.01 -1.26 -5.13 114.94 112.17 1u9y s ASN 98 Ca 0.16 0.63 -0.17 0.00 -0.71 0.00 0.00 52.86 52.77 1u9y s ASN 98 Cb 0.09 0.55 -0.02 0.00 0.41 0.00 0.00 41.25 42.28 1u9y s ASN 98 CO 0.13 -0.33 1.16 -2.16 -1.51 0.00 0.00 177.10 174.38 1u9y s PRO 99 N -0.71 2.91 0.00 -0.60 0.04 -1.26 -2.78 135.00 132.60 1u9y s PRO 99 Ca -0.02 1.65 0.00 0.00 0.04 0.00 0.00 61.00 62.67 1u9y s PRO 99 Cb -0.02 -1.94 0.00 0.00 0.04 0.00 0.00 34.50 32.58 1u9y s PRO 99 CO 0.01 -1.21 0.00 0.41 0.04 0.00 0.00 177.00 176.25 1u9y n GLY 100 N 0.14 1.61 3.94 0.56 0.00 -1.26 -5.03 105.19 105.15 1u9y n GLY 100 Ca 0.12 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.88 1u9y n GLY 100 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1u9y s GLU 101 N -0.28 1.96 0.33 1.61 2.02 -1.12 -5.11 118.70 118.12 1u9y s GLU 101 Ca 0.00 -0.36 0.09 0.00 0.02 0.00 0.00 54.97 54.72 1u9y s GLU 101 Cb 0.00 -2.15 -0.05 0.00 0.10 0.00 0.00 34.13 32.03 1u9y s GLU 101 CO 0.00 -1.40 0.00 0.00 0.02 0.00 0.00 175.26 173.89 1u9y s ALA 102 N -3.31 3.18 -0.60 5.21 0.00 -1.26 -5.01 121.76 119.96 1u9y s ALA 102 Ca 0.62 -1.93 -0.02 0.00 0.00 0.00 0.00 51.96 50.63 1u9y s ALA 102 Cb -0.09 -0.41 0.16 0.00 0.00 0.00 0.00 23.12 22.77 1u9y s ALA 102 CO 0.46 0.10 0.41 0.42 0.00 0.00 0.00 175.76 177.14 1u9y s ILE 103 N -2.50 3.59 0.25 0.00 1.01 -1.26 -4.73 121.20 117.55 1u9y s ILE 103 Ca 0.34 -2.94 -0.05 0.00 0.00 0.00 0.00 60.65 58.00 1u9y s ILE 103 Cb -0.01 -3.36 0.24 0.00 0.01 0.00 0.00 42.46 39.34 1u9y s ILE 103 CO 0.19 -0.86 1.68 0.77 0.00 0.00 0.00 174.94 176.73 1u9y h SER 104 N 7.04 0.02 0.39 3.58 4.64 -1.91 -0.70 113.55 126.60 1u9y h SER 104 Ca -0.03 0.15 -0.07 0.00 -0.47 0.00 0.00 61.79 61.37 1u9y h SER 104 Cb 0.95 0.20 -0.01 0.00 -0.31 0.00 0.00 62.40 63.23 1u9y h SER 104 CO 0.71 -0.04 -0.33 -0.29 -0.87 0.00 0.00 176.83 176.01 1u9y h ILE 105 N 0.27 1.15 -0.13 0.95 6.09 -1.76 -1.72 117.51 122.37 1u9y h ILE 105 Ca 0.42 -1.16 -0.02 0.00 -1.37 0.00 0.00 64.86 62.74 1u9y h ILE 105 Cb 0.73 1.64 -0.00 0.00 0.47 0.00 0.00 36.82 39.65 1u9y h ILE 105 CO -0.52 0.32 0.02 -0.09 -3.07 0.00 0.00 178.15 174.81 1u9y h ARG 106 N 0.00 0.21 -0.75 2.19 2.43 -1.47 0.11 114.38 117.10 1u9y h ARG 106 Ca -0.00 -0.06 -0.04 0.00 -0.81 0.00 0.00 59.98 59.07 1u9y h ARG 106 Cb 0.61 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 30.11 1u9y h ARG 106 CO 0.04 0.42 0.31 0.00 -1.51 0.00 0.00 179.97 179.23 1u9y h ALA 107 N 0.79 0.98 -0.00 2.80 0.00 -1.15 -2.91 119.26 119.76 1u9y h ALA 107 Ca 0.04 -0.18 -0.20 0.00 0.00 0.00 0.00 54.91 54.56 1u9y h ALA 107 Cb 0.31 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1u9y h ALA 107 CO 0.00 0.59 -0.87 -0.07 0.00 0.00 0.00 179.25 178.90 1u9y h LEU 108 N 1.08 0.30 -1.33 0.00 3.38 -1.26 -3.13 115.31 114.36 1u9y h LEU 108 Ca 0.25 -0.24 0.04 0.00 0.09 0.00 0.00 57.88 58.02 1u9y h LEU 108 Cb 0.20 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 40.82 1u9y h LEU 108 CO -0.02 1.03 0.48 0.00 0.09 0.00 0.00 178.44 180.02 1u9y h ALA 109 N 0.95 1.60 -0.75 1.53 0.00 -0.64 0.99 119.26 122.94 1u9y h ALA 109 Ca -0.05 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1u9y h ALA 109 Cb 1.49 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 19.01 1u9y h ALA 109 CO 0.14 0.32 0.43 0.87 0.00 0.00 0.00 179.25 181.01 1u9y h LYS 110 N 0.86 1.02 -0.23 0.00 1.57 -1.46 0.81 116.57 119.15 1u9y h LYS 110 Ca 0.29 -0.10 -0.11 0.00 -1.87 0.00 0.00 60.65 58.86 1u9y h LYS 110 Cb 0.10 -0.21 -0.00 0.00 0.08 0.00 0.00 32.23 32.19 1u9y h LYS 110 CO -0.09 0.74 -0.29 0.82 -0.57 0.00 0.00 179.45 180.06 1u9y h ILE 111 N 1.02 1.32 -0.62 1.86 2.04 -1.25 -3.08 117.51 118.81 1u9y h ILE 111 Ca 0.27 -1.48 -0.00 0.00 1.00 0.00 0.00 64.86 64.64 1u9y h ILE 111 Cb -0.01 1.73 -0.03 0.00 -0.74 0.00 0.00 36.82 37.77 1u9y h ILE 111 CO -0.05 0.46 0.39 1.88 0.00 0.00 0.00 178.15 180.83 1u9y h TYR 112 N 0.31 0.80 0.00 1.37 0.99 -0.53 -1.08 116.97 118.83 1u9y h TYR 112 Ca 0.03 0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.76 1u9y h TYR 112 Cb 0.87 -0.27 0.00 0.00 1.00 0.00 0.00 36.73 38.33 1u9y h TYR 112 CO 0.08 0.53 0.00 0.77 -0.00 0.00 0.00 178.16 179.54 1u9y h SER 113 N 0.84 0.00 0.13 3.88 0.02 -0.86 -0.93 113.55 116.62 1u9y h SER 113 Ca 0.22 0.00 -0.36 0.00 -0.84 0.00 0.00 61.79 60.82 1u9y h SER 113 Cb -0.05 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 62.43 1u9y h SER 113 CO -0.04 0.00 -2.21 -3.20 -1.14 0.00 0.00 176.83 170.23 1u9y n ASN 114 N -2.86 0.83 0.02 3.07 4.05 -0.71 -4.58 115.26 115.07 1u9y n ASN 114 Ca -0.02 0.09 0.11 0.00 0.45 0.00 0.00 54.58 55.21 1u9y n ASN 114 Cb 0.13 0.27 -0.12 0.00 1.23 0.00 0.00 39.78 41.29 1u9y n ASN 114 CO 0.00 0.00 0.00 2.30 -3.05 0.00 0.00 177.26 176.51 1u9y n ILE 115 N -3.00 0.16 -4.26 -1.44 -5.35 -0.49 -4.97 119.36 100.01 1u9y n ILE 115 Ca -0.32 -0.48 -0.16 0.00 -0.27 0.00 0.00 62.75 61.52 1u9y n ILE 115 Cb 1.09 -0.03 -0.10 0.00 -1.74 0.00 0.00 39.64 38.85 1u9y n ILE 115 CO 0.00 0.00 0.00 0.68 -1.76 0.00 0.00 176.55 175.47 1u9y s VAL 116 N -3.44 1.34 -0.56 7.28 -7.23 -0.38 -4.90 120.40 112.50 1u9y s VAL 116 Ca -0.05 -1.96 0.23 0.00 -1.81 0.00 0.00 61.98 58.39 1u9y s VAL 116 Cb 0.13 -1.76 -0.12 0.00 0.56 0.00 0.00 36.38 35.18 1u9y s VAL 116 CO 0.87 -0.60 0.99 0.47 -0.31 0.00 0.00 175.10 176.53 1u9y n ASP 117 N 0.04 0.60 -3.65 4.85 8.00 -0.29 -4.54 116.55 121.55 1u9y n ASP 117 Ca -0.12 -0.18 -0.14 0.00 0.71 0.00 0.00 54.79 55.06 1u9y n ASP 117 Cb 0.59 0.85 -0.08 0.00 -0.02 0.00 0.00 41.12 42.47 1u9y n ASP 117 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 1u9y s LYS 118 N -3.22 0.77 -0.09 -1.24 2.20 -1.20 -4.00 119.74 112.95 1u9y s LYS 118 Ca 0.03 0.78 0.02 0.00 -0.36 0.00 0.00 55.97 56.44 1u9y s LYS 118 Cb 0.14 0.37 0.01 0.00 -1.51 0.00 0.00 37.83 36.85 1u9y s LYS 118 CO 0.81 -0.12 -0.13 -1.17 -0.36 0.00 0.00 175.35 174.38 1u9y s LEU 119 N 0.12 1.63 -0.04 5.43 2.96 -0.59 -0.37 118.68 127.82 1u9y s LEU 119 Ca -0.02 -0.36 0.06 0.00 -0.22 0.00 0.00 54.13 53.59 1u9y s LEU 119 Cb -0.04 -0.96 -0.02 0.00 0.50 0.00 0.00 46.19 45.67 1u9y s LEU 119 CO 0.02 0.01 -0.22 -0.63 -1.32 0.00 0.00 176.35 174.21 1u9y s ILE 120 N 0.94 2.40 0.06 6.68 1.01 0.75 -0.74 121.20 132.31 1u9y s ILE 120 Ca -0.08 -0.96 -0.08 0.00 0.00 0.00 0.00 60.65 59.52 1u9y s ILE 120 Cb -0.15 -1.88 -0.00 0.00 0.01 0.00 0.00 42.46 40.43 1u9y s ILE 120 CO -0.00 0.58 0.16 0.28 0.00 0.00 0.00 174.94 175.95 1u9y s THR 121 N -0.48 0.14 -0.17 2.92 -1.32 -0.40 -0.99 115.64 115.34 1u9y s THR 121 Ca 0.06 -1.14 -0.07 0.00 -1.21 0.00 0.00 61.69 59.33 1u9y s THR 121 Cb -0.11 -1.16 -0.04 0.00 -1.51 0.00 0.00 72.50 69.67 1u9y s THR 121 CO 0.01 -0.63 0.04 -0.63 -2.21 0.00 0.00 174.62 171.20 1u9y s ILE 122 N -3.30 4.60 -0.81 5.08 -1.09 -0.77 -1.33 121.20 123.57 1u9y s ILE 122 Ca 0.01 -0.10 -0.02 0.00 -2.23 0.00 0.00 60.65 58.31 1u9y s ILE 122 Cb 0.03 -3.06 0.00 0.00 -1.58 0.00 0.00 42.46 37.85 1u9y s ILE 122 CO -0.08 0.47 0.61 0.59 -1.23 0.00 0.00 174.94 175.30 1u9y n ASN 123 N 3.49 -4.90 -4.76 3.58 4.13 -0.14 -4.78 115.26 111.88 1u9y n ASN 123 Ca -0.17 -0.92 -0.34 0.00 1.68 0.00 0.00 54.58 54.82 1u9y n ASN 123 Cb 0.52 -1.70 0.04 0.00 -1.54 0.00 0.00 39.78 37.10 1u9y n ASN 123 CO 0.00 0.00 0.00 -2.84 0.28 0.00 0.00 177.26 174.70 1u9y s PRO 124 N -4.82 2.87 0.07 3.52 0.02 -1.26 -4.94 135.00 130.46 1u9y s PRO 124 Ca 0.02 1.59 -0.16 0.00 0.02 0.00 0.00 61.00 62.47 1u9y s PRO 124 Cb -0.00 -1.94 -0.15 0.00 0.02 0.00 0.00 34.50 32.43 1u9y s PRO 124 CO 0.89 -1.23 1.30 1.25 -0.33 0.00 0.00 177.00 178.89 1u9y h HIS 125 N 0.45 0.79 -3.63 6.54 2.76 -1.91 -3.41 115.15 116.73 1u9y h HIS 125 Ca -0.48 -0.31 -0.68 0.00 -2.20 0.00 0.00 60.37 56.70 1u9y h HIS 125 Cb 1.27 -0.14 -0.32 0.00 1.55 0.00 0.00 27.41 29.77 1u9y h HIS 125 CO 0.51 1.08 -0.72 -2.00 -1.30 0.00 0.00 177.93 175.51 1u9y s GLU 126 N -3.91 2.67 0.49 5.26 -6.30 -1.26 -4.99 118.70 110.66 1u9y s GLU 126 Ca -0.12 -1.10 0.27 0.00 -2.50 0.00 0.00 54.97 51.52 1u9y s GLU 126 Cb 0.07 -3.10 1.18 0.00 0.00 0.00 0.00 34.13 32.28 1u9y s GLU 126 CO 0.84 -0.50 1.94 1.79 0.02 0.00 0.00 175.26 179.34 1u9y h THR 127 N 6.26 0.47 0.00 -1.70 1.35 -1.96 -3.10 112.91 114.24 1u9y h THR 127 Ca -0.27 -0.84 0.00 0.00 -0.55 0.00 0.00 66.41 64.75 1u9y h THR 127 Cb 1.09 1.59 0.00 0.00 -1.73 0.00 0.00 68.15 69.09 1u9y h THR 127 CO 0.56 0.16 0.00 1.41 -0.25 0.00 0.00 175.52 177.40 1u9y n HIS 128 N -3.42 0.55 0.33 4.73 8.25 -1.26 -3.30 115.22 121.10 1u9y n HIS 128 Ca -0.00 0.19 0.18 0.00 -0.26 0.00 0.00 57.72 57.83 1u9y n HIS 128 Cb 0.35 -0.81 0.98 0.00 1.12 0.00 0.00 29.99 31.63 1u9y n HIS 128 CO 0.00 0.00 0.00 -0.84 0.64 0.00 0.00 176.34 176.14 1u9y h ILE 129 N 0.00 0.00 0.00 1.59 3.07 -1.91 -0.16 117.51 120.10 1u9y h ILE 129 Ca 0.00 0.00 -0.01 0.00 1.55 0.00 0.00 64.86 66.40 1u9y h ILE 129 Cb 0.47 0.79 -0.00 0.00 -0.27 0.00 0.00 36.82 37.82 1u9y h ILE 129 CO 0.00 0.00 -0.03 0.07 -1.05 0.00 0.00 178.15 177.14 1u9y h LYS 130 N 0.00 0.00 0.00 0.16 2.10 -1.82 -2.24 116.57 114.76 1u9y h LYS 130 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1u9y h LYS 130 Cb 0.35 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.68 1u9y h LYS 130 CO 0.00 0.03 0.00 -0.44 -2.00 0.00 0.00 179.45 177.04 1u9y h ASP 131 N 0.00 0.00 1.09 7.07 3.32 -1.31 -1.40 116.42 125.20 1u9y h ASP 131 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1u9y h ASP 131 Cb 0.16 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.71 1u9y h ASP 131 CO 0.00 0.00 -0.35 0.49 -1.72 0.00 0.00 179.24 177.66 1u9y n PHE 132 N -3.04 0.66 -3.38 4.55 3.72 -0.84 -4.88 117.46 114.25 1u9y n PHE 132 Ca -0.02 0.19 -0.35 0.00 -0.05 0.00 0.00 57.45 57.22 1u9y n PHE 132 Cb 0.15 -0.75 -0.06 0.00 -0.94 0.00 0.00 39.48 37.88 1u9y n PHE 132 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 176.76 176.65 1u9y s PHE 133 N -3.13 3.61 -0.19 1.38 0.40 -0.53 -4.60 117.98 114.93 1u9y s PHE 133 Ca 0.08 1.03 0.16 0.00 -0.60 0.00 0.00 56.93 57.61 1u9y s PHE 133 Cb 0.13 -2.35 0.48 0.00 0.51 0.00 0.00 43.02 41.80 1u9y s PHE 133 CO 0.66 0.44 1.38 0.25 0.70 0.00 0.00 175.22 178.66 1u9y n THR 134 N 0.84 2.26 -4.23 0.64 -2.24 -1.26 -4.95 114.28 105.33 1u9y n THR 134 Ca -0.06 -2.09 -0.13 0.00 -2.27 0.00 0.00 64.05 59.50 1u9y n THR 134 Cb 0.52 -0.26 -0.10 0.00 -2.10 0.00 0.00 70.33 68.38 1u9y n THR 134 CO 0.00 0.00 0.00 0.27 -0.57 0.00 0.00 175.07 174.77 1u9y s ILE 135 N -2.91 0.69 0.15 2.28 -4.36 -1.26 -5.04 121.20 110.75 1u9y s ILE 135 Ca 0.41 -1.98 -0.32 0.00 -0.26 0.00 0.00 60.65 58.50 1u9y s ILE 135 Cb 0.34 -2.07 -0.12 0.00 1.25 0.00 0.00 42.46 41.86 1u9y s ILE 135 CO 0.06 -0.52 1.73 -2.65 0.24 0.00 0.00 174.94 173.81 1u9y n PRO 136 N -0.22 2.57 -3.95 0.37 -0.02 -1.26 -4.90 135.00 127.60 1u9y n PRO 136 Ca -0.07 0.93 -0.32 0.00 -2.02 0.00 0.00 63.50 62.02 1u9y n PRO 136 Cb 0.63 -2.77 -0.14 0.00 -0.02 0.00 0.00 33.50 31.20 1u9y n PRO 136 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 1u9y s PHE 137 N 1.80 3.71 -0.12 6.00 5.36 -1.26 -1.55 117.98 131.92 1u9y s PHE 137 Ca 0.80 -2.84 -0.06 0.00 -0.96 0.00 0.00 56.93 53.86 1u9y s PHE 137 Cb -0.56 -3.02 -0.04 0.00 -0.34 0.00 0.00 43.02 39.07 1u9y s PHE 137 CO 0.37 -0.95 0.10 0.42 -1.46 0.00 0.00 175.22 173.70 1u9y s ILE 138 N 0.94 5.17 -0.04 3.12 -1.09 0.08 -5.02 121.20 124.36 1u9y s ILE 138 Ca 0.10 0.08 0.02 0.00 -2.23 0.00 0.00 60.65 58.63 1u9y s ILE 138 Cb -0.20 -3.24 0.01 0.00 -1.58 0.00 0.00 42.46 37.44 1u9y s ILE 138 CO -0.07 0.60 -0.10 -0.72 -1.23 0.00 0.00 174.94 173.43 1u9y s TYR 139 N -0.87 1.13 0.33 3.97 -0.85 -1.26 -1.28 117.35 118.51 1u9y s TYR 139 Ca 0.14 -0.35 0.07 0.00 -0.52 0.00 0.00 57.07 56.41 1u9y s TYR 139 Cb -0.12 -0.84 -0.02 0.00 0.38 0.00 0.00 41.96 41.36 1u9y s TYR 139 CO 0.03 -0.18 0.36 0.20 -1.52 0.00 0.00 175.55 174.44 1u9y s GLY 140 N 0.51 1.65 -0.15 5.49 0.00 -0.44 -4.92 107.32 109.46 1u9y s GLY 140 Ca -0.09 -1.54 0.01 0.00 0.00 0.00 0.00 44.72 43.10 1u9y s GLY 140 CO 0.02 -1.47 -0.16 -0.35 0.00 0.00 0.00 173.10 171.13 1u9y s ASP 141 N -4.06 3.58 0.00 1.64 2.15 -1.26 -0.97 116.67 117.75 1u9y s ASP 141 Ca 0.42 -0.48 0.21 0.00 0.43 0.00 0.00 52.55 53.12 1u9y s ASP 141 Cb -0.08 -1.54 0.05 0.00 -0.30 0.00 0.00 42.92 41.05 1u9y s ASP 141 CO 0.28 0.09 1.07 0.00 -0.17 0.00 0.00 175.17 176.45 1u9y n ALA 142 N 4.01 3.14 -0.30 3.66 0.00 -1.26 -4.48 120.51 125.28 1u9y n ALA 142 Ca -0.19 -0.63 0.03 0.00 0.00 0.00 0.00 53.44 52.65 1u9y n ALA 142 Cb 0.52 -0.73 0.17 0.00 0.00 0.00 0.00 19.45 19.41 1u9y n ALA 142 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1u9y h VAL 143 N 2.90 0.92 -0.76 0.00 2.07 -1.97 -1.39 116.25 118.02 1u9y h VAL 143 Ca 0.00 -0.28 0.09 0.00 0.82 0.00 0.00 66.70 67.33 1u9y h VAL 143 Cb 0.77 0.02 -0.05 0.00 -1.52 0.00 0.00 31.29 30.51 1u9y h VAL 143 CO 0.00 0.15 0.50 -0.65 0.02 0.00 0.00 177.57 177.59 1u9y h PRO 144 N 0.83 0.69 -0.08 1.57 0.11 -1.92 -0.38 132.00 132.81 1u9y h PRO 144 Ca 0.41 -0.04 -0.12 0.00 0.11 0.00 0.00 66.00 66.36 1u9y h PRO 144 Cb 0.36 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.30 1u9y h PRO 144 CO -0.24 0.45 -0.49 0.87 -0.21 0.00 0.00 178.00 178.38 1u9y h LYS 145 N 0.71 0.20 -0.16 1.05 6.56 -1.57 -1.56 116.57 121.80 1u9y h LYS 145 Ca 0.35 -0.11 -0.10 0.00 -1.06 0.00 0.00 60.65 59.73 1u9y h LYS 145 Cb 0.41 0.01 0.00 0.00 -0.57 0.00 0.00 32.23 32.08 1u9y h LYS 145 CO -0.13 0.65 -0.30 -0.07 -2.06 0.00 0.00 179.45 177.54 1u9y h LEU 146 N 0.16 0.54 -0.44 2.94 3.38 -0.76 -2.72 115.31 118.41 1u9y h LEU 146 Ca 0.01 -0.55 0.05 0.00 0.09 0.00 0.00 57.88 57.48 1u9y h LEU 146 Cb 0.92 -0.16 -0.05 0.00 0.09 0.00 0.00 40.66 41.47 1u9y h LEU 146 CO 0.07 0.99 0.18 0.00 0.09 0.00 0.00 178.44 179.77 1u9y h ALA 147 N 0.57 0.54 0.00 1.53 0.00 -1.00 -0.92 119.26 119.98 1u9y h ALA 147 Ca 0.01 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1u9y h ALA 147 Cb 0.89 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.68 1u9y h ALA 147 CO 0.07 -0.20 -0.03 0.93 0.00 0.00 0.00 179.25 180.03 1u9y h GLU 148 N 0.37 0.00 0.00 0.00 5.08 -1.24 -1.94 114.58 116.85 1u9y h GLU 148 Ca 0.20 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.40 1u9y h GLU 148 Cb 0.16 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 1u9y h GLU 148 CO -0.18 0.03 -0.75 -0.92 -1.00 0.00 0.00 179.01 176.18 1u9y h TYR 149 N 0.00 0.00 0.00 4.33 3.20 -0.84 -3.36 116.97 120.29 1u9y h TYR 149 Ca -0.00 0.00 -0.12 0.00 3.14 0.00 0.00 58.73 61.75 1u9y h TYR 149 Cb 0.07 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.31 1u9y h TYR 149 CO 0.00 0.75 -2.11 1.33 -1.64 0.00 0.00 178.16 176.49 1u9y n VAL 150 N -3.52 0.46 0.22 1.81 0.24 -0.85 -4.28 118.33 112.40 1u9y n VAL 150 Ca -0.00 -0.62 0.18 0.00 -2.04 0.00 0.00 64.34 61.86 1u9y n VAL 150 Cb 0.76 -0.16 0.83 0.00 -1.47 0.00 0.00 33.84 33.81 1u9y n VAL 150 CO 0.00 0.00 0.00 0.07 -2.14 0.00 0.00 176.83 174.76 1u9y h LYS 151 N 0.00 0.00 0.00 7.34 2.10 -1.53 0.72 116.57 125.21 1u9y h LYS 151 Ca -0.18 0.00 -0.13 0.00 -2.00 0.00 0.00 60.65 58.34 1u9y h LYS 151 Cb 1.40 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 32.71 1u9y h LYS 151 CO 0.01 0.00 -0.62 0.22 -2.00 0.00 0.00 179.45 177.06 1u9y h ASP 152 N 0.00 0.00 0.00 7.07 3.58 -1.77 -3.36 116.42 121.94 1u9y h ASP 152 Ca 0.09 0.00 -0.02 0.00 0.42 0.00 0.00 57.03 57.52 1u9y h ASP 152 Cb 0.68 0.00 -0.05 0.00 1.72 0.00 0.00 39.33 41.68 1u9y h ASP 152 CO -0.00 0.62 -0.43 2.29 -2.88 0.00 0.00 179.24 178.84 1u9y n LYS 153 N -3.76 1.18 -4.22 0.28 0.00 0.25 -5.03 118.16 106.86 1u9y n LYS 153 Ca -0.01 -2.77 -0.17 0.00 -0.00 0.00 0.00 58.31 55.37 1u9y n LYS 153 Cb 0.63 -1.29 -0.14 0.00 -0.00 0.00 0.00 35.03 34.22 1u9y n LYS 153 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 1u9y s LEU 154 N -2.48 2.05 -0.47 -5.58 1.43 -0.89 -5.07 118.68 107.67 1u9y s LEU 154 Ca 0.33 -0.18 -0.15 0.00 -1.03 0.00 0.00 54.13 53.10 1u9y s LEU 154 Cb 0.32 -0.33 0.07 0.00 0.03 0.00 0.00 46.19 46.28 1u9y s LEU 154 CO -0.05 0.05 0.38 0.21 0.23 0.00 0.00 176.35 177.17 1u9y s ASN 155 N -0.35 6.13 -1.02 2.29 2.47 -1.26 -4.64 114.94 118.56 1u9y s ASN 155 Ca 0.01 -1.29 -0.17 0.00 0.42 0.00 0.00 52.86 51.83 1u9y s ASN 155 Cb -0.04 -2.18 0.02 0.00 -1.45 0.00 0.00 41.25 37.61 1u9y s ASN 155 CO -0.00 -0.63 0.66 -0.67 -3.72 0.00 0.00 177.10 172.74 1u9y n ASP 156 N 5.19 -4.69 -4.89 -4.21 4.64 -1.26 -4.27 116.55 107.06 1u9y n ASP 156 Ca -0.12 -1.09 -0.30 0.00 -1.38 0.00 0.00 54.79 51.90 1u9y n ASP 156 Cb 0.44 -1.94 0.05 0.00 -1.04 0.00 0.00 41.12 38.62 1u9y n ASP 156 CO 0.00 0.00 0.00 -2.16 -0.82 0.00 0.00 177.20 174.22 1u9y s PRO 157 N -6.06 2.80 -0.18 -0.67 0.04 -1.26 -4.41 135.00 125.27 1u9y s PRO 157 Ca 0.26 0.37 -0.06 0.00 0.04 0.00 0.00 61.00 61.60 1u9y s PRO 157 Cb -0.13 -2.05 -0.03 0.00 0.04 0.00 0.00 34.50 32.32 1u9y s PRO 157 CO 0.92 -1.03 0.03 0.42 0.04 0.00 0.00 177.00 177.38 1u9y s ILE 158 N -3.32 4.43 -0.29 0.56 1.01 -0.20 -4.26 121.20 119.12 1u9y s ILE 158 Ca 0.58 -0.16 -0.16 0.00 0.00 0.00 0.00 60.65 60.91 1u9y s ILE 158 Cb -0.11 -2.99 -0.03 0.00 0.01 0.00 0.00 42.46 39.35 1u9y s ILE 158 CO 0.51 0.46 0.43 -0.69 0.00 0.00 0.00 174.94 175.64 1u9y s VAL 159 N 0.51 5.12 0.00 2.92 1.01 -0.54 -1.04 120.40 128.38 1u9y s VAL 159 Ca 0.01 0.56 0.05 0.00 0.00 0.00 0.00 61.98 62.60 1u9y s VAL 159 Cb -0.13 -3.78 -0.03 0.00 0.00 0.00 0.00 36.38 32.43 1u9y s VAL 159 CO 0.02 0.06 -0.13 -0.76 0.00 0.00 0.00 175.10 174.29 1u9y s LEU 160 N 2.17 2.86 -0.19 3.92 1.43 0.08 -1.97 118.68 126.99 1u9y s LEU 160 Ca 0.17 -0.25 -0.09 0.00 -1.03 0.00 0.00 54.13 52.93 1u9y s LEU 160 Cb -0.16 -1.64 -0.05 0.00 0.03 0.00 0.00 46.19 44.37 1u9y s LEU 160 CO 0.10 0.29 0.11 0.00 0.23 0.00 0.00 176.35 177.08 1u9y s ALA 161 N -0.90 3.60 0.62 4.21 0.00 -0.79 -1.45 121.76 127.05 1u9y s ALA 161 Ca 0.15 -0.71 0.28 0.00 0.00 0.00 0.00 51.96 51.68 1u9y s ALA 161 Cb -0.11 -2.07 1.45 0.00 0.00 0.00 0.00 23.12 22.39 1u9y s ALA 161 CO 0.05 0.19 1.85 -1.35 0.00 0.00 0.00 175.76 176.49 1u9y h PRO 162 N 6.61 0.00 -2.92 0.00 0.11 -1.90 -2.27 132.00 131.63 1u9y h PRO 162 Ca -0.40 0.00 0.08 0.00 0.11 0.00 0.00 66.00 65.79 1u9y h PRO 162 Cb 1.16 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.22 1u9y h PRO 162 CO 0.73 0.00 0.26 0.16 -0.21 0.00 0.00 178.00 178.95 1u9y s ASP 163 N -4.83 -0.23 0.27 -2.05 1.47 -1.26 -4.39 116.67 105.66 1u9y s ASP 163 Ca -0.04 -0.63 -0.00 0.00 1.18 0.00 0.00 52.55 53.06 1u9y s ASP 163 Cb 0.13 0.71 0.50 0.00 -0.34 0.00 0.00 42.92 43.92 1u9y s ASP 163 CO 0.44 -1.32 1.83 0.50 0.68 0.00 0.00 175.17 177.30 1u9y h LYS 164 N 2.00 0.94 -1.05 2.11 3.64 -1.84 -2.39 116.57 119.97 1u9y h LYS 164 Ca -0.21 -0.06 0.27 0.00 -1.27 0.00 0.00 60.65 59.39 1u9y h LYS 164 Cb 1.25 -0.21 -0.09 0.00 -0.41 0.00 0.00 32.23 32.77 1u9y h LYS 164 CO 0.25 0.62 0.68 0.78 -2.27 0.00 0.00 179.45 179.51 1u9y h GLY 165 N 0.97 1.10 -2.97 5.01 0.00 -1.96 0.02 103.07 105.23 1u9y h GLY 165 Ca 0.47 -0.18 0.00 0.00 0.00 0.00 0.00 47.33 47.61 1u9y h GLY 165 CO -0.25 -0.13 0.00 0.00 0.00 0.00 0.00 176.54 176.16 1u9y n ALA 166 N -2.50 3.34 -0.17 3.60 0.00 -0.90 -4.55 120.51 119.33 1u9y n ALA 166 Ca 0.25 -1.50 0.10 0.00 0.00 0.00 0.00 53.44 52.29 1u9y n ALA 166 Cb 0.91 -1.07 0.41 0.00 0.00 0.00 0.00 19.45 19.71 1u9y n ALA 166 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1u9y h LEU 167 N 3.53 0.55 -1.14 0.00 5.85 -1.05 -2.27 115.31 120.78 1u9y h LEU 167 Ca 0.00 0.01 -0.06 0.00 0.84 0.00 0.00 57.88 58.67 1u9y h LEU 167 Cb 1.53 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 42.44 1u9y h LEU 167 CO 0.31 0.33 -0.06 -0.33 -0.34 0.00 0.00 178.44 178.35 1u9y h GLU 168 N 0.61 0.53 -0.30 1.25 4.39 -1.82 -0.21 114.58 119.02 1u9y h GLU 168 Ca 0.33 -0.13 -0.04 0.00 0.34 0.00 0.00 59.36 59.86 1u9y h GLU 168 Cb 0.48 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 29.05 1u9y h GLU 168 CO -0.12 0.60 0.02 0.74 -1.16 0.00 0.00 179.01 179.09 1u9y h PHE 169 N 0.50 0.56 -0.67 4.33 0.05 -1.76 0.60 116.94 120.54 1u9y h PHE 169 Ca 0.10 -0.09 -0.00 0.00 3.82 0.00 0.00 57.97 61.80 1u9y h PHE 169 Cb 0.42 -0.15 -0.03 0.00 2.00 0.00 0.00 35.95 38.19 1u9y h PHE 169 CO 0.01 0.64 0.41 0.00 -0.18 0.00 0.00 178.31 179.20 1u9y h ALA 170 N 0.85 0.85 -0.20 2.45 0.00 -1.29 -0.79 119.26 121.13 1u9y h ALA 170 Ca 0.09 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1u9y h ALA 170 Cb 0.40 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1u9y h ALA 170 CO 0.01 0.32 0.08 -0.22 0.00 0.00 0.00 179.25 179.44 1u9y h LYS 171 N 0.91 0.29 0.13 0.00 3.64 -0.77 0.29 116.57 121.06 1u9y h LYS 171 Ca 0.24 -0.05 0.02 0.00 -1.27 0.00 0.00 60.65 59.59 1u9y h LYS 171 Cb -0.04 -0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 31.69 1u9y h LYS 171 CO -0.05 0.34 -0.31 1.15 -2.27 0.00 0.00 179.45 178.32 1u9y h THR 172 N 0.18 0.34 -0.95 1.00 2.02 -0.53 -0.48 112.91 114.49 1u9y h THR 172 Ca 0.07 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.25 1u9y h THR 172 Cb 0.16 0.34 -0.05 0.00 -1.74 0.00 0.00 68.15 66.86 1u9y h THR 172 CO -0.01 0.00 0.61 0.00 0.37 0.00 0.00 175.52 176.49 1u9y h ALA 173 N 0.13 1.21 -0.64 6.16 0.00 -1.10 -2.63 119.26 122.38 1u9y h ALA 173 Ca 0.03 -0.08 0.11 0.00 0.00 0.00 0.00 54.91 54.97 1u9y h ALA 173 Cb 0.56 -0.38 -0.08 0.00 0.00 0.00 0.00 17.79 17.88 1u9y h ALA 173 CO -0.17 0.62 0.22 1.03 0.00 0.00 0.00 179.25 180.95 1u9y h SER 174 N 1.30 0.18 -0.31 0.00 0.87 0.40 -1.17 113.55 114.81 1u9y h SER 174 Ca 0.35 0.10 -0.01 0.00 -1.23 0.00 0.00 61.79 60.99 1u9y h SER 174 Cb -0.12 0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 61.92 1u9y h SER 174 CO -0.07 0.09 0.17 0.50 -0.53 0.00 0.00 176.83 176.99 1u9y h LYS 175 N 0.38 0.44 -0.04 2.24 3.64 -0.74 -0.14 116.57 122.34 1u9y h LYS 175 Ca 0.34 -0.05 -0.04 0.00 -1.27 0.00 0.00 60.65 59.62 1u9y h LYS 175 Cb 0.47 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.19 1u9y h LYS 175 CO -0.36 0.37 -0.18 0.82 -2.27 0.00 0.00 179.45 177.83 1u9y h ILE 176 N 0.39 1.16 -0.01 2.00 2.04 -1.24 -2.64 117.51 119.21 1u9y h ILE 176 Ca 0.11 -0.72 0.00 0.00 1.00 0.00 0.00 64.86 65.25 1u9y h ILE 176 Cb 0.06 1.33 0.00 0.00 -0.74 0.00 0.00 36.82 37.47 1u9y h ILE 176 CO -0.02 0.21 -0.40 0.18 0.00 0.00 0.00 178.15 178.12 1u9y n LEU 177 N -4.29 1.38 -3.69 1.44 4.77 -0.52 -4.96 117.00 111.13 1u9y n LEU 177 Ca -0.02 -0.45 -0.27 0.00 -0.03 0.00 0.00 56.01 55.25 1u9y n LEU 177 Cb 0.26 -0.08 0.05 0.00 -2.33 0.00 0.00 43.42 41.33 1u9y n LEU 177 CO 0.37 0.26 0.17 0.59 -1.33 0.00 0.00 177.39 177.46 1u9y n ASN 178 N -0.52 -5.70 -4.70 -1.43 3.02 -0.13 -4.98 115.26 100.83 1u9y n ASN 178 Ca 0.10 -0.62 -0.29 0.00 -0.03 0.00 0.00 54.58 53.74 1u9y n ASN 178 Cb 0.39 -4.52 -0.09 0.00 -0.61 0.00 0.00 39.78 34.96 1u9y n ASN 178 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1u9y s ALA 179 N -3.29 3.59 0.59 5.41 0.00 -0.80 -5.06 121.76 122.19 1u9y s ALA 179 Ca 0.60 -1.66 -0.06 0.00 0.00 0.00 0.00 51.96 50.84 1u9y s ALA 179 Cb -0.28 -0.02 0.00 0.00 0.00 0.00 0.00 23.12 22.82 1u9y s ALA 179 CO 0.75 -0.12 0.91 -1.21 0.00 0.00 0.00 175.76 176.09 1u9y s GLU 180 N -3.83 2.97 0.05 0.00 2.02 -1.26 -4.66 118.70 114.01 1u9y s GLU 180 Ca 0.28 0.06 -0.10 0.00 0.02 0.00 0.00 54.97 55.22 1u9y s GLU 180 Cb 0.06 -2.26 0.01 0.00 0.10 0.00 0.00 34.13 32.04 1u9y s GLU 180 CO 0.15 -0.69 0.22 1.52 0.02 0.00 0.00 175.26 176.48 1u9y s TYR 181 N -3.00 0.04 0.00 1.61 -0.85 -1.26 -1.47 117.35 112.42 1u9y s TYR 181 Ca 0.54 -0.30 0.00 0.00 -0.52 0.00 0.00 57.07 56.78 1u9y s TYR 181 Cb -0.11 -0.01 0.00 0.00 0.38 0.00 0.00 41.96 42.23 1u9y s TYR 181 CO 0.46 -0.48 0.00 -3.47 -1.52 0.00 0.00 175.55 170.54 1u9y n ASP 182 N 0.47 0.00 -3.67 -0.18 4.64 -0.83 -4.94 116.55 112.03 1u9y n ASP 182 Ca -0.18 -0.65 -0.14 0.00 -1.38 0.00 0.00 54.79 52.44 1u9y n ASP 182 Cb 0.60 0.00 -0.08 0.00 -1.04 0.00 0.00 41.12 40.60 1u9y n ASP 182 CO 0.00 0.00 0.00 -0.72 -0.82 0.00 0.00 177.20 175.66 1u9y s TYR 183 N -6.78 -0.53 0.24 -0.67 1.13 -1.26 -1.89 117.35 107.59 1u9y s TYR 183 Ca 0.00 1.18 -0.30 0.00 -1.41 0.00 0.00 57.07 56.54 1u9y s TYR 183 Cb 0.00 0.22 -0.09 0.00 -1.10 0.00 0.00 41.96 40.99 1u9y s TYR 183 CO 0.00 -0.36 1.32 -0.51 -2.51 0.00 0.00 175.55 173.50 1u9y s LEU 184 N -0.25 4.42 -0.25 -3.49 1.43 -0.85 -1.30 118.68 118.39 1u9y s LEU 184 Ca -0.04 2.49 -0.16 0.00 -1.03 0.00 0.00 54.13 55.39 1u9y s LEU 184 Cb -0.03 -3.62 -0.14 0.00 0.03 0.00 0.00 46.19 42.43 1u9y s LEU 184 CO 0.03 -0.54 -0.20 1.21 0.23 0.00 0.00 176.35 177.08 1u9y n GLU 185 N 2.18 0.58 -4.87 1.70 4.07 -1.26 -3.91 120.64 119.12 1u9y n GLU 185 Ca 0.05 0.35 -0.30 0.00 -0.06 0.00 0.00 57.16 57.20 1u9y n GLU 185 Cb 0.42 -1.56 -0.17 0.00 -0.06 0.00 0.00 31.44 30.07 1u9y n GLU 185 CO 0.00 0.00 0.00 0.42 -0.06 0.00 0.00 177.13 177.49 1u9y s ILE 196 N -2.48 1.81 0.00 6.31 1.01 -1.26 -4.98 121.20 121.62 1u9y s ILE 196 Ca -0.35 -0.86 0.00 0.00 0.00 0.00 0.00 60.65 59.44 1u9y s ILE 196 Cb 0.12 -1.60 0.00 0.00 0.01 0.00 0.00 42.46 40.99 1u9y s ILE 196 CO 0.51 0.50 0.00 0.00 0.00 0.00 0.00 174.94 175.96 1u9y n ALA 197 N 3.80 0.00 -1.76 9.38 0.00 -1.26 -5.10 120.51 125.57 1u9y n ALA 197 Ca -0.20 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 52.84 1u9y n ALA 197 Cb 0.52 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.98 1u9y n ALA 197 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1u9y n PRO 198 N -0.33 2.32 -0.35 0.00 -0.04 -1.26 -4.31 135.00 131.04 1u9y n PRO 198 Ca 0.00 0.82 0.01 0.00 -0.04 0.00 0.00 63.50 64.29 1u9y n PRO 198 Cb 0.00 -2.61 0.17 0.00 -0.04 0.00 0.00 33.50 31.01 1u9y n PRO 198 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 1u9y h LYS 199 N 2.43 1.18 0.00 0.54 3.11 -1.53 -3.41 116.57 118.89 1u9y h LYS 199 Ca -0.50 -0.07 0.00 0.00 -2.81 0.00 0.00 60.65 57.26 1u9y h LYS 199 Cb 1.27 -0.27 0.00 0.00 -1.00 0.00 0.00 32.23 32.23 1u9y h LYS 199 CO 0.62 0.78 -0.47 2.41 -2.81 0.00 0.00 179.45 179.97 1u9y n THR 200 N -4.45 0.00 -1.18 1.00 -1.04 -1.26 -5.07 114.28 102.28 1u9y n THR 200 Ca 0.13 0.00 -0.29 0.00 -2.04 0.00 0.00 64.05 61.85 1u9y n THR 200 Cb 0.11 -0.88 0.20 0.00 -1.82 0.00 0.00 70.33 67.94 1u9y n THR 200 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1u9y s LEU 201 N -5.27 1.29 -0.05 -4.42 1.43 -1.26 -5.07 118.68 105.33 1u9y s LEU 201 Ca 0.00 0.93 0.00 0.00 -1.03 0.00 0.00 54.13 54.03 1u9y s LEU 201 Cb 0.00 -2.94 0.03 0.00 0.03 0.00 0.00 46.19 43.30 1u9y s LEU 201 CO 0.00 -3.47 -0.02 -0.62 0.23 0.00 0.00 176.35 172.47 1u9y s ASP 202 N -3.69 0.94 0.00 2.29 3.68 -1.26 -4.63 116.67 113.99 1u9y s ASP 202 Ca 0.68 -0.08 0.30 0.00 2.13 0.00 0.00 52.55 55.57 1u9y s ASP 202 Cb -0.15 -0.37 1.40 0.00 -1.45 0.00 0.00 42.92 42.36 1u9y s ASP 202 CO 0.57 -0.11 1.95 0.00 0.13 0.00 0.00 175.17 177.71 1u9y n ALA 203 N 4.38 2.67 -1.67 3.66 0.00 -1.26 -4.90 120.51 123.39 1u9y n ALA 203 Ca -0.20 -0.31 -0.54 0.00 0.00 0.00 0.00 53.44 52.39 1u9y n ALA 203 Cb 0.50 -1.34 -0.06 0.00 0.00 0.00 0.00 19.45 18.55 1u9y n ALA 203 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1u9y n LYS 204 N -0.55 1.35 -3.98 0.00 3.00 -0.90 -1.71 118.16 115.37 1u9y n LYS 204 Ca 0.20 0.49 -0.31 0.00 -0.00 0.00 0.00 58.31 58.68 1u9y n LYS 204 Cb 0.25 -2.19 0.01 0.00 0.00 0.00 0.00 35.03 33.10 1u9y n LYS 204 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1u9y n ASP 205 N 4.53 -4.40 -4.10 3.14 9.92 0.26 -4.93 116.55 120.98 1u9y n ASP 205 Ca 0.23 -0.83 -0.15 0.00 -0.53 0.00 0.00 54.79 53.51 1u9y n ASP 205 Cb 0.18 -3.64 -0.12 0.00 -0.64 0.00 0.00 41.12 36.91 1u9y n ASP 205 CO 0.00 0.00 0.00 -0.13 0.13 0.00 0.00 177.20 177.20 1u9y s ARG 206 N -6.68 0.62 0.38 -1.24 0.52 -0.70 -4.84 118.95 107.01 1u9y s ARG 206 Ca 0.67 -0.82 -0.24 0.00 -0.52 0.00 0.00 55.73 54.82 1u9y s ARG 206 Cb -0.34 -0.45 -0.09 0.00 0.52 0.00 0.00 34.95 34.58 1u9y s ARG 206 CO 0.85 0.09 1.00 -0.51 0.02 0.00 0.00 175.30 176.76 1u9y s ASP 207 N -1.63 6.95 -0.02 0.23 1.11 -1.26 -0.09 116.67 121.94 1u9y s ASP 207 Ca -0.08 1.93 0.03 0.00 0.18 0.00 0.00 52.55 54.61 1u9y s ASP 207 Cb -0.10 -2.58 -0.00 0.00 1.07 0.00 0.00 42.92 41.31 1u9y s ASP 207 CO 0.01 -0.35 -0.11 -0.69 1.18 0.00 0.00 175.17 175.20 1u9y s VAL 208 N -1.73 0.94 -0.37 -1.27 1.01 0.62 -1.04 120.40 118.57 1u9y s VAL 208 Ca 0.56 -0.46 0.01 0.00 0.00 0.00 0.00 61.98 62.08 1u9y s VAL 208 Cb -0.19 -0.82 0.10 0.00 0.00 0.00 0.00 36.38 35.47 1u9y s VAL 208 CO 0.24 0.28 0.12 0.12 0.00 0.00 0.00 175.10 175.86 1u9y s PHE 209 N 0.05 3.66 -0.16 5.22 5.36 -0.21 -0.77 117.98 131.13 1u9y s PHE 209 Ca -0.01 -2.68 -0.20 0.00 -0.96 0.00 0.00 56.93 53.08 1u9y s PHE 209 Cb -0.08 -3.03 -0.03 0.00 -0.34 0.00 0.00 43.02 39.54 1u9y s PHE 209 CO 0.01 -0.96 0.57 0.42 -1.46 0.00 0.00 175.22 173.80 1u9y s ILE 210 N 1.03 5.09 -0.02 3.12 1.01 -0.23 -0.74 121.20 130.47 1u9y s ILE 210 Ca 0.09 1.09 0.02 0.00 0.00 0.00 0.00 60.65 61.85 1u9y s ILE 210 Cb -0.21 -3.89 -0.00 0.00 0.01 0.00 0.00 42.46 38.37 1u9y s ILE 210 CO -0.06 0.21 -0.08 0.54 0.00 0.00 0.00 174.94 175.54 1u9y s VAL 211 N 1.34 0.69 0.30 2.92 0.11 -0.53 -0.81 120.40 124.42 1u9y s VAL 211 Ca 0.28 -0.34 -0.03 0.00 -2.93 0.00 0.00 61.98 58.97 1u9y s VAL 211 Cb -0.16 -0.60 -0.01 0.00 -1.53 0.00 0.00 36.38 34.08 1u9y s VAL 211 CO 0.11 0.21 0.40 -0.62 -3.33 0.00 0.00 175.10 171.87 1u9y s ASP 212 N 0.04 0.74 -0.04 3.54 3.68 -0.82 -4.28 116.67 119.52 1u9y s ASP 212 Ca -0.00 -1.42 0.01 0.00 2.13 0.00 0.00 52.55 53.27 1u9y s ASP 212 Cb -0.06 0.59 -0.26 0.00 -1.45 0.00 0.00 42.92 41.75 1u9y s ASP 212 CO -0.00 -1.17 0.68 -2.24 0.13 0.00 0.00 175.17 172.57 1u9y h ASP 213 N 2.21 0.27 -4.72 -0.34 2.03 -1.95 -3.15 116.42 110.77 1u9y h ASP 213 Ca -0.29 -0.48 -0.24 0.00 -0.73 0.00 0.00 57.03 55.30 1u9y h ASP 213 Cb 1.24 -0.09 -0.22 0.00 -0.83 0.00 0.00 39.33 39.43 1u9y h ASP 213 CO 0.40 1.42 -0.72 -0.63 -1.03 0.00 0.00 179.24 178.67 1u9y s ILE 214 N -2.60 0.34 -0.29 4.15 1.01 -1.26 -0.86 121.20 121.70 1u9y s ILE 214 Ca -0.11 -0.89 -0.03 0.00 0.00 0.00 0.00 60.65 59.62 1u9y s ILE 214 Cb 0.07 -0.43 0.10 0.00 0.01 0.00 0.00 42.46 42.21 1u9y s ILE 214 CO 0.82 -0.37 0.11 -0.63 0.00 0.00 0.00 174.94 174.88 1u9y s ILE 215 N -1.24 0.29 0.00 2.92 1.01 -1.22 -5.01 121.20 117.96 1u9y s ILE 215 Ca -0.11 -0.96 0.00 0.00 0.00 0.00 0.00 60.65 59.58 1u9y s ILE 215 Cb -0.09 -1.21 0.00 0.00 0.01 0.00 0.00 42.46 41.17 1u9y s ILE 215 CO -0.00 -0.67 0.00 -1.20 0.00 0.00 0.00 174.94 173.06 1u9y n SER 216 N 5.10 0.00 -0.09 3.58 7.64 -1.26 -0.63 113.62 127.95 1u9y n SER 216 Ca -0.05 0.00 -0.13 0.00 1.01 0.00 0.00 58.87 59.70 1u9y n SER 216 Cb 0.42 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.61 1u9y n SER 216 CO 0.00 0.00 0.00 0.74 -3.01 0.00 0.00 175.04 172.77 1u9y h THR 217 N 0.00 1.28 0.00 0.44 2.02 -1.96 0.15 112.91 114.84 1u9y h THR 217 Ca 0.00 -1.62 0.00 0.00 0.77 0.00 0.00 66.41 65.56 1u9y h THR 217 Cb 0.00 1.48 0.00 0.00 -1.74 0.00 0.00 68.15 67.89 1u9y h THR 217 CO 0.00 0.54 0.00 0.61 0.37 0.00 0.00 175.52 177.04 1u9y n GLY 218 N 0.20 0.82 0.40 2.16 0.00 -1.26 -4.41 105.19 103.09 1u9y n GLY 218 Ca -0.03 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.84 1u9y n GLY 218 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1u9y h GLY 219 N 0.00 -0.86 -0.01 -0.02 0.00 -1.95 0.83 103.07 101.06 1u9y h GLY 219 Ca 0.00 0.44 0.12 0.00 0.00 0.00 0.00 47.33 47.89 1u9y h GLY 219 CO 0.00 -0.30 -0.02 -0.84 0.00 0.00 0.00 176.54 175.39 1u9y h THR 220 N -0.73 0.51 0.65 4.70 2.02 -1.99 0.63 112.91 118.70 1u9y h THR 220 Ca -0.01 -0.04 -0.03 0.00 0.77 0.00 0.00 66.41 67.10 1u9y h THR 220 Cb 0.68 0.40 0.01 0.00 -1.74 0.00 0.00 68.15 67.50 1u9y h THR 220 CO -0.11 0.02 -0.31 0.24 0.37 0.00 0.00 175.52 175.72 1u9y h MET 221 N 0.10 -0.84 -1.02 6.66 2.07 -1.88 -2.45 114.93 117.57 1u9y h MET 221 Ca 0.30 0.06 0.25 0.00 -2.07 0.00 0.00 59.70 58.24 1u9y h MET 221 Cb 0.47 0.19 -0.10 0.00 -1.87 0.00 0.00 31.60 30.29 1u9y h MET 221 CO -0.51 -0.56 0.64 0.00 1.07 0.00 0.00 176.91 177.56 1u9y h ALA 222 N -1.41 2.08 0.31 6.32 0.00 0.89 -0.01 119.26 127.44 1u9y h ALA 222 Ca -0.09 0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 1u9y h ALA 222 Cb 0.67 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.48 1u9y h ALA 222 CO 0.15 -0.49 -0.15 1.15 0.00 0.00 0.00 179.25 179.90 1u9y h THR 223 N 0.47 0.72 -0.73 0.00 2.02 -0.89 -1.90 112.91 112.61 1u9y h THR 223 Ca 0.60 -0.37 0.10 0.00 0.77 0.00 0.00 66.41 67.52 1u9y h THR 223 Cb 1.37 0.91 -0.08 0.00 -1.74 0.00 0.00 68.15 68.62 1u9y h THR 223 CO -0.34 0.08 0.35 0.00 0.37 0.00 0.00 175.52 175.98 1u9y h ALA 224 N -0.00 1.01 -0.16 6.16 0.00 -0.55 -2.19 119.26 123.54 1u9y h ALA 224 Ca -0.04 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1u9y h ALA 224 Cb 0.44 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 1u9y h ALA 224 CO 0.07 -0.07 0.06 0.28 0.00 0.00 0.00 179.25 179.58 1u9y h VAL 225 N 0.58 1.17 -0.22 0.00 2.07 -1.11 -0.43 116.25 118.30 1u9y h VAL 225 Ca 0.37 -0.50 0.03 0.00 0.82 0.00 0.00 66.70 67.41 1u9y h VAL 225 Cb 0.43 1.21 -0.03 0.00 -1.52 0.00 0.00 31.29 31.38 1u9y h VAL 225 CO -0.30 0.16 0.04 0.11 0.02 0.00 0.00 177.57 177.60 1u9y h LYS 226 N 0.09 0.13 0.78 1.57 1.57 -1.05 0.03 116.57 119.68 1u9y h LYS 226 Ca 0.05 -0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 58.79 1u9y h LYS 226 Cb 0.19 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.47 1u9y h LYS 226 CO -0.00 0.08 -0.46 -0.07 -0.57 0.00 0.00 179.45 178.43 1u9y h LEU 227 N 0.13 -1.15 -0.96 2.94 4.07 -1.34 -1.81 115.31 117.20 1u9y h LEU 227 Ca 0.10 0.06 0.24 0.00 0.08 0.00 0.00 57.88 58.36 1u9y h LEU 227 Cb 0.09 0.33 -0.13 0.00 1.08 0.00 0.00 40.66 42.04 1u9y h LEU 227 CO -0.13 -0.72 0.50 -0.07 -1.08 0.00 0.00 178.44 176.94 1u9y h LEU 228 N -1.15 0.50 -0.89 1.67 3.38 -0.94 0.76 115.31 118.64 1u9y h LEU 228 Ca -0.10 0.15 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 1u9y h LEU 228 Cb 0.92 0.09 -0.04 0.00 0.09 0.00 0.00 40.66 41.72 1u9y h LEU 228 CO 0.12 0.03 0.49 0.11 0.09 0.00 0.00 178.44 179.27 1u9y h LYS 229 N 0.47 1.24 0.00 1.13 1.79 -0.65 0.33 116.57 120.88 1u9y h LYS 229 Ca 0.62 -0.14 -0.07 0.00 -2.18 0.00 0.00 60.65 58.88 1u9y h LYS 229 Cb 1.21 -0.24 -0.01 0.00 -1.58 0.00 0.00 32.23 31.61 1u9y h LYS 229 CO -0.52 0.90 -0.32 0.93 -1.08 0.00 0.00 179.45 179.36 1u9y h GLU 230 N 1.24 0.00 -0.64 3.15 5.08 0.13 -1.32 114.58 122.22 1u9y h GLU 230 Ca 0.31 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.67 1u9y h GLU 230 Cb 0.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.27 1u9y h GLU 230 CO -0.05 0.32 0.00 1.04 -1.00 0.00 0.00 179.01 179.32 1u9y n GLN 231 N -3.86 1.89 -2.53 2.33 6.02 -0.15 -4.86 117.38 116.22 1u9y n GLN 231 Ca -0.01 -0.85 -0.08 0.00 -0.01 0.00 0.00 57.00 56.05 1u9y n GLN 231 Cb 0.40 -1.52 0.01 0.00 1.02 0.00 0.00 30.24 30.15 1u9y n GLN 231 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1u9y n GLY 232 N 0.41 0.23 3.79 1.08 0.00 -0.50 -2.11 105.19 108.10 1u9y n GLY 232 Ca 0.08 -0.45 -0.34 0.00 0.00 0.00 0.00 46.02 45.31 1u9y n GLY 232 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u9y s ALA 233 N -2.76 2.84 0.00 4.61 0.00 0.03 0.93 121.76 127.41 1u9y s ALA 233 Ca 0.11 0.63 0.00 0.00 0.00 0.00 0.00 51.96 52.70 1u9y s ALA 233 Cb -0.05 -3.27 0.00 0.00 0.00 0.00 0.00 23.12 19.80 1u9y s ALA 233 CO 0.14 -0.41 0.00 1.63 0.00 0.00 0.00 175.76 177.11 1u9y n LYS 234 N -1.07 0.00 -2.44 0.00 5.02 0.87 -4.75 118.16 115.78 1u9y n LYS 234 Ca 0.10 0.00 -0.42 0.00 -2.02 0.00 0.00 58.31 55.96 1u9y n LYS 234 Cb 0.52 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 35.51 1u9y n LYS 234 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 1u9y s LYS 235 N 1.86 4.33 -0.14 1.97 2.20 -1.26 -4.85 119.74 123.84 1u9y s LYS 235 Ca 0.00 1.69 0.01 0.00 -0.36 0.00 0.00 55.97 57.31 1u9y s LYS 235 Cb 0.00 -3.59 -0.00 0.00 -1.51 0.00 0.00 37.83 32.73 1u9y s LYS 235 CO 0.00 -0.50 -0.17 0.42 -0.36 0.00 0.00 175.35 174.74 1u9y s ILE 236 N 2.43 2.54 -0.10 5.43 1.01 -1.26 -0.28 121.20 130.97 1u9y s ILE 236 Ca 0.56 -0.82 0.03 0.00 0.00 0.00 0.00 60.65 60.42 1u9y s ILE 236 Cb -0.25 -2.05 -0.01 0.00 0.01 0.00 0.00 42.46 40.17 1u9y s ILE 236 CO 0.21 0.53 -0.21 -0.63 0.00 0.00 0.00 174.94 174.84 1u9y s ILE 237 N 0.72 2.36 -0.20 2.92 1.01 0.05 0.93 121.20 128.99 1u9y s ILE 237 Ca -0.08 -0.92 -0.04 0.00 0.00 0.00 0.00 60.65 59.61 1u9y s ILE 237 Cb -0.16 -1.93 -0.02 0.00 0.01 0.00 0.00 42.46 40.37 1u9y s ILE 237 CO 0.01 0.55 -0.03 0.00 0.00 0.00 0.00 174.94 175.48 1u9y s ALA 238 N 0.27 2.92 0.10 9.38 0.00 -0.25 -1.07 121.76 133.11 1u9y s ALA 238 Ca -0.14 -1.05 0.09 0.00 0.00 0.00 0.00 51.96 50.86 1u9y s ALA 238 Cb -0.17 -1.70 -0.04 0.00 0.00 0.00 0.00 23.12 21.22 1u9y s ALA 238 CO 0.07 -0.22 -0.22 0.00 0.00 0.00 0.00 175.76 175.40 1u9y s ALA 239 N 1.12 1.88 0.09 0.00 0.00 0.01 -1.25 121.76 123.61 1u9y s ALA 239 Ca 0.02 -1.27 -0.12 0.00 0.00 0.00 0.00 51.96 50.60 1u9y s ALA 239 Cb -0.15 -0.27 0.01 0.00 0.00 0.00 0.00 23.12 22.72 1u9y s ALA 239 CO 0.00 0.39 0.27 0.00 0.00 0.00 0.00 175.76 176.42 1u9y h VAL 241 N 2.76 1.63 -3.49 0.00 2.07 -1.32 -3.30 116.25 114.58 1u9y h VAL 241 Ca -0.34 -2.40 -0.74 0.00 0.82 0.00 0.00 66.70 64.05 1u9y h VAL 241 Cb 1.21 3.24 -0.30 0.00 -1.52 0.00 0.00 31.29 33.93 1u9y h VAL 241 CO 0.52 0.63 -0.25 -1.00 0.02 0.00 0.00 177.57 177.49 1u9y s HIS 242 N -2.31 3.50 -1.26 1.57 3.76 -0.04 -2.82 115.29 117.71 1u9y s HIS 242 Ca -0.18 -2.12 -0.15 0.00 -0.15 0.00 0.00 55.06 52.46 1u9y s HIS 242 Cb -0.01 -3.51 -0.04 0.00 1.11 0.00 0.00 32.58 30.13 1u9y s HIS 242 CO 0.73 -0.95 2.25 -0.35 -0.85 0.00 0.00 174.74 175.57 1u9y n PRO 243 N 4.28 2.56 -0.22 8.40 -0.04 -1.26 -3.37 135.00 145.36 1u9y n PRO 243 Ca 0.02 -2.24 -0.00 0.00 -0.04 0.00 0.00 63.50 61.23 1u9y n PRO 243 Cb 0.41 -3.04 0.22 0.00 -0.04 0.00 0.00 33.50 31.05 1u9y n PRO 243 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1u9y h VAL 244 N 3.92 1.21 -4.96 0.52 2.07 -1.86 -3.42 116.25 113.73 1u9y h VAL 244 Ca 0.57 -0.45 -0.16 0.00 0.82 0.00 0.00 66.70 67.48 1u9y h VAL 244 Cb 0.55 0.16 0.00 0.00 -1.52 0.00 0.00 31.29 30.48 1u9y h VAL 244 CO 1.85 0.22 -0.39 0.18 0.02 0.00 0.00 177.57 179.45 1u9y n LEU 245 N -4.39 -0.67 -4.77 2.57 4.77 0.19 -4.87 117.00 109.84 1u9y n LEU 245 Ca 0.08 -0.25 -0.38 0.00 -0.03 0.00 0.00 56.01 55.43 1u9y n LEU 245 Cb 0.07 -0.54 -0.04 0.00 -2.33 0.00 0.00 43.42 40.58 1u9y n LEU 245 CO 0.37 0.10 0.79 -0.63 -1.33 0.00 0.00 177.39 176.69 1u9y s ILE 246 N -1.76 3.46 0.00 -0.08 1.01 0.53 -4.65 121.20 119.71 1u9y s ILE 246 Ca 0.04 1.28 0.00 0.00 0.00 0.00 0.00 60.65 61.97 1u9y s ILE 246 Cb -0.00 -3.74 0.00 0.00 0.01 0.00 0.00 42.46 38.73 1u9y s ILE 246 CO 0.30 0.16 0.00 0.61 0.00 0.00 0.00 174.94 176.01 1u9y n GLY 247 N 0.74 3.54 1.73 6.18 0.00 -1.26 -1.52 105.19 114.59 1u9y n GLY 247 Ca 0.02 0.18 -0.03 0.00 0.00 0.00 0.00 46.02 46.19 1u9y n GLY 247 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1u9y n ASP 248 N 6.06 4.33 -0.18 1.61 3.85 -1.26 -4.62 116.55 126.34 1u9y n ASP 248 Ca 0.00 -2.92 -0.02 0.00 -0.71 0.00 0.00 54.79 51.14 1u9y n ASP 248 Cb 0.00 -0.69 0.04 0.00 -1.35 0.00 0.00 41.12 39.12 1u9y n ASP 248 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1u9y h ALA 249 N 2.75 0.31 -0.55 2.12 0.00 -1.48 -1.37 119.26 121.03 1u9y h ALA 249 Ca 0.18 0.21 0.01 0.00 0.00 0.00 0.00 54.91 55.31 1u9y h ALA 249 Cb 1.95 0.48 -0.03 0.00 0.00 0.00 0.00 17.79 20.19 1u9y h ALA 249 CO 0.56 -0.47 0.35 -0.07 0.00 0.00 0.00 179.25 179.62 1u9y h LEU 250 N -0.04 0.60 -1.26 0.00 3.38 -1.85 -1.76 115.31 114.39 1u9y h LEU 250 Ca 0.27 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.19 1u9y h LEU 250 Cb 0.44 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 1u9y h LEU 250 CO -0.59 0.43 0.12 -1.13 0.09 0.00 0.00 178.44 177.35 1u9y h ASN 251 N 0.71 0.58 -0.22 -0.43 -0.73 -1.73 -1.06 115.58 112.70 1u9y h ASN 251 Ca 0.21 -0.08 -0.01 0.00 1.87 0.00 0.00 56.30 58.29 1u9y h ASN 251 Cb -0.04 -0.15 -0.01 0.00 0.27 0.00 0.00 38.32 38.39 1u9y h ASN 251 CO -0.07 0.57 0.11 0.50 -0.37 0.00 0.00 177.43 178.18 1u9y h LYS 252 N 0.62 0.32 -0.22 6.67 3.64 -0.60 -1.15 116.57 125.85 1u9y h LYS 252 Ca 0.14 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 59.44 1u9y h LYS 252 Cb 0.21 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 31.96 1u9y h LYS 252 CO -0.01 0.32 -0.03 -0.07 -2.27 0.00 0.00 179.45 177.39 1u9y h LEU 253 N 0.24 0.42 -1.00 5.20 3.38 -0.93 -1.93 115.31 120.67 1u9y h LEU 253 Ca 0.08 -0.35 0.03 0.00 0.09 0.00 0.00 57.88 57.73 1u9y h LEU 253 Cb 0.10 -0.11 -0.06 0.00 0.09 0.00 0.00 40.66 40.68 1u9y h LEU 253 CO -0.01 0.66 0.66 1.88 0.09 0.00 0.00 178.44 181.72 1u9y h TYR 254 N 0.16 1.24 -0.47 1.13 0.99 -1.13 -2.14 116.97 116.75 1u9y h TYR 254 Ca 0.06 0.03 -0.14 0.00 2.00 0.00 0.00 58.73 60.68 1u9y h TYR 254 Cb 0.47 -0.42 -0.01 0.00 1.00 0.00 0.00 36.73 37.77 1u9y h TYR 254 CO 0.05 0.73 -0.24 0.77 -0.00 0.00 0.00 178.16 179.47 1u9y h SER 255 N 1.30 1.02 -0.00 3.88 0.02 -1.15 -1.69 113.55 116.93 1u9y h SER 255 Ca 0.39 -0.41 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 1u9y h SER 255 Cb -0.04 -0.28 -0.00 0.00 0.14 0.00 0.00 62.40 62.22 1u9y h SER 255 CO -0.11 1.20 0.05 0.00 -1.14 0.00 0.00 176.83 176.83 1u9y h ALA 256 N 0.85 1.06 0.00 3.77 0.00 -0.72 -3.45 119.26 120.78 1u9y h ALA 256 Ca 0.10 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1u9y h ALA 256 Cb 0.82 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.61 1u9y h ALA 256 CO 0.07 -0.05 0.00 0.41 0.00 0.00 0.00 179.25 179.68 1u9y n GLY 257 N -1.11 1.44 3.77 0.00 0.00 -0.63 -4.26 105.19 104.41 1u9y n GLY 257 Ca -0.03 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.63 1u9y n GLY 257 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1u9y s VAL 258 N -2.00 3.16 0.17 1.61 -7.23 -1.03 -4.74 120.40 110.34 1u9y s VAL 258 Ca 0.00 0.82 0.03 0.00 -1.81 0.00 0.00 61.98 61.02 1u9y s VAL 258 Cb 0.00 -3.39 -0.14 0.00 0.56 0.00 0.00 36.38 33.41 1u9y s VAL 258 CO 0.00 -0.06 1.39 -0.08 -0.31 0.00 0.00 175.10 176.04 1u9y h GLU 259 N 1.79 0.19 -1.42 4.82 4.57 0.19 -3.44 114.58 121.28 1u9y h GLU 259 Ca -0.50 -0.20 0.12 0.00 -1.18 0.00 0.00 59.36 57.61 1u9y h GLU 259 Cb 1.25 0.06 -0.24 0.00 -0.16 0.00 0.00 28.75 29.65 1u9y h GLU 259 CO 0.59 0.93 0.66 -2.00 -1.18 0.00 0.00 179.01 178.01 1u9y s GLU 260 N -3.25 0.45 -0.08 1.92 2.12 -1.21 -5.03 118.70 113.62 1u9y s GLU 260 Ca -0.03 0.12 0.05 0.00 0.36 0.00 0.00 54.97 55.47 1u9y s GLU 260 Cb 0.10 0.21 -0.01 0.00 0.26 0.00 0.00 34.13 34.70 1u9y s GLU 260 CO 0.82 -0.14 -0.23 0.08 -0.54 0.00 0.00 175.26 175.25 1u9y s VAL 261 N -1.05 2.16 -0.00 3.70 1.01 -1.26 -1.09 120.40 123.87 1u9y s VAL 261 Ca 0.01 -1.01 0.01 0.00 0.00 0.00 0.00 61.98 61.00 1u9y s VAL 261 Cb -0.01 -1.81 -0.00 0.00 0.00 0.00 0.00 36.38 34.56 1u9y s VAL 261 CO -0.01 0.56 -0.04 0.54 0.00 0.00 0.00 175.10 176.15 1u9y s VAL 262 N 0.07 0.33 0.24 2.92 0.11 -0.38 -4.86 120.40 118.83 1u9y s VAL 262 Ca -0.10 -0.23 0.04 0.00 -2.93 0.00 0.00 61.98 58.76 1u9y s VAL 262 Cb -0.16 -0.29 -0.01 0.00 -1.53 0.00 0.00 36.38 34.39 1u9y s VAL 262 CO 0.06 0.06 0.14 0.61 -3.33 0.00 0.00 175.10 172.64 1u9y n GLY 263 N 2.89 3.43 3.64 6.54 0.00 -0.23 -2.06 105.19 119.40 1u9y n GLY 263 Ca -0.13 -1.92 -0.24 0.00 0.00 0.00 0.00 46.02 43.73 1u9y n GLY 263 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1u9y n THR 264 N -0.49 0.00 -0.52 2.61 -2.24 -1.13 -1.85 114.28 110.66 1u9y n THR 264 Ca 0.01 -2.04 -0.14 0.00 -2.27 0.00 0.00 64.05 59.61 1u9y n THR 264 Cb 0.39 -0.13 0.14 0.00 -2.10 0.00 0.00 70.33 68.63 1u9y n THR 264 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1u9y n ASP 265 N -1.93 3.60 0.08 3.42 5.75 -0.35 -4.00 116.55 123.12 1u9y n ASP 265 Ca 0.01 -3.07 -0.04 0.00 -0.01 0.00 0.00 54.79 51.69 1u9y n ASP 265 Cb 0.59 -0.72 -0.07 0.00 -1.03 0.00 0.00 41.12 39.88 1u9y n ASP 265 CO 0.00 0.00 0.00 0.71 -0.11 0.00 0.00 177.20 177.80 1u9y h THR 266 N 0.92 1.29 -3.27 2.12 1.35 -1.87 -3.44 112.91 110.01 1u9y h THR 266 Ca 0.40 -2.89 -0.39 0.00 -0.55 0.00 0.00 66.41 62.98 1u9y h THR 266 Cb 2.22 2.62 -0.39 0.00 -1.73 0.00 0.00 68.15 70.88 1u9y h THR 266 CO 0.72 0.74 -0.74 -0.47 -0.25 0.00 0.00 175.52 175.52 1u9y s TYR 267 N -2.79 0.12 0.03 4.73 5.04 -1.26 -3.95 117.35 119.27 1u9y s TYR 267 Ca 0.01 0.16 -0.30 0.00 -2.44 0.00 0.00 57.07 54.50 1u9y s TYR 267 Cb 0.09 -0.53 -0.08 0.00 0.35 0.00 0.00 41.96 41.79 1u9y s TYR 267 CO 0.80 -0.24 1.82 -1.17 -1.34 0.00 0.00 175.55 175.41 1u9y s LEU 268 N 2.15 4.39 0.26 6.97 2.96 -1.26 -4.48 118.68 129.67 1u9y s LEU 268 Ca 0.05 2.53 -0.04 0.00 -0.22 0.00 0.00 54.13 56.45 1u9y s LEU 268 Cb -0.13 -3.54 -0.02 0.00 0.50 0.00 0.00 46.19 43.01 1u9y s LEU 268 CO -0.04 -0.99 0.33 -0.94 -1.32 0.00 0.00 176.35 173.40 1u9y s SER 269 N 3.63 0.45 0.00 3.68 1.04 -1.26 -4.97 113.70 116.26 1u9y s SER 269 Ca 0.81 -1.32 0.17 0.00 0.48 0.00 0.00 55.95 56.09 1u9y s SER 269 Cb -0.40 0.53 0.85 0.00 0.10 0.00 0.00 66.02 67.10 1u9y s SER 269 CO 0.36 -1.07 1.53 -0.62 0.98 0.00 0.00 173.24 174.42 1u9y n GLU 270 N -0.42 0.19 -0.36 4.02 1.02 -1.26 -2.98 120.64 120.85 1u9y n GLU 270 Ca 0.01 0.14 0.07 0.00 -0.02 0.00 0.00 57.16 57.36 1u9y n GLU 270 Cb 0.63 -1.50 0.11 0.00 -0.02 0.00 0.00 31.44 30.67 1u9y n GLU 270 CO 0.00 0.00 0.00 1.33 1.18 0.00 0.00 177.13 179.64 1u9y n VAL 271 N -1.33 1.39 -1.62 2.62 0.24 -1.26 -4.93 118.33 113.44 1u9y n VAL 271 Ca 0.07 -1.85 -0.42 0.00 -2.04 0.00 0.00 64.34 60.11 1u9y n VAL 271 Cb 0.15 0.02 -0.03 0.00 -1.47 0.00 0.00 33.84 32.51 1u9y n VAL 271 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 1u9y n SER 272 N -0.92 3.41 0.06 -1.34 7.64 -1.16 -1.07 113.62 120.25 1u9y n SER 272 Ca 0.12 -2.78 -0.16 0.00 1.01 0.00 0.00 58.87 57.06 1u9y n SER 272 Cb 0.70 -1.47 -0.14 0.00 -1.01 0.00 0.00 64.21 62.29 1u9y n SER 272 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 1u9y h LYS 273 N 7.13 0.24 -6.03 1.43 1.79 -1.69 -3.41 116.57 116.04 1u9y h LYS 273 Ca 0.48 -0.41 -0.59 0.00 -2.18 0.00 0.00 60.65 57.94 1u9y h LYS 273 Cb 0.70 0.15 -0.05 0.00 -1.58 0.00 0.00 32.23 31.44 1u9y h LYS 273 CO 1.83 1.10 -0.15 0.08 -1.08 0.00 0.00 179.45 181.23 1u9y s VAL 274 N -2.62 4.98 0.07 0.50 1.01 -0.77 -4.96 120.40 118.61 1u9y s VAL 274 Ca -0.08 0.96 -0.03 0.00 0.00 0.00 0.00 61.98 62.83 1u9y s VAL 274 Cb 0.07 -3.78 -0.05 0.00 0.00 0.00 0.00 36.38 32.62 1u9y s VAL 274 CO 0.85 0.53 0.27 -0.55 0.00 0.00 0.00 175.10 176.20 1u9y s SER 275 N -0.81 6.42 -0.02 3.32 0.15 -1.26 -1.21 113.70 120.30 1u9y s SER 275 Ca 0.25 0.42 0.13 0.00 0.70 0.00 0.00 55.95 57.45 1u9y s SER 275 Cb -0.17 -2.02 0.38 0.00 -1.71 0.00 0.00 66.02 62.50 1u9y s SER 275 CO 0.14 0.16 1.32 1.33 1.20 0.00 0.00 173.24 177.39 1u9y n VAL 276 N 0.42 1.11 -0.04 4.45 0.24 -1.26 -4.66 118.33 118.59 1u9y n VAL 276 Ca -0.06 -1.07 -0.08 0.00 -2.04 0.00 0.00 64.34 61.10 1u9y n VAL 276 Cb 0.52 0.44 -0.02 0.00 -1.47 0.00 0.00 33.84 33.31 1u9y n VAL 276 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1u9y h ALA 277 N 2.39 -0.06 -0.88 2.33 0.00 -1.94 0.02 119.26 121.12 1u9y h ALA 277 Ca 0.00 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 1u9y h ALA 277 Cb 0.84 0.42 -0.04 0.00 0.00 0.00 0.00 17.79 19.00 1u9y h ALA 277 CO 0.02 -0.62 0.47 0.93 0.00 0.00 0.00 179.25 180.05 1u9y h GLU 278 N -0.20 1.25 -0.89 0.00 3.07 -1.94 0.21 114.58 116.08 1u9y h GLU 278 Ca 0.13 -0.16 -0.00 0.00 -0.50 0.00 0.00 59.36 58.83 1u9y h GLU 278 Cb 0.40 -0.24 -0.04 0.00 -0.84 0.00 0.00 28.75 28.03 1u9y h GLU 278 CO -0.35 0.92 0.55 0.28 -1.40 0.00 0.00 179.01 179.02 1u9y h VAL 279 N 1.24 1.24 -0.15 3.13 2.07 -1.64 -2.04 116.25 120.11 1u9y h VAL 279 Ca 0.31 -0.50 -0.11 0.00 0.82 0.00 0.00 66.70 67.22 1u9y h VAL 279 Cb 0.06 -0.03 0.00 0.00 -1.52 0.00 0.00 31.29 29.80 1u9y h VAL 279 CO -0.05 0.25 -0.33 0.40 0.02 0.00 0.00 177.57 177.86 1u9y h ILE 280 N 1.22 1.36 -0.73 4.57 2.04 -0.42 -3.19 117.51 122.35 1u9y h ILE 280 Ca 0.32 -1.60 0.11 0.00 1.00 0.00 0.00 64.86 64.69 1u9y h ILE 280 Cb -0.08 2.01 -0.05 0.00 -0.74 0.00 0.00 36.82 37.96 1u9y h ILE 280 CO -0.06 0.48 0.48 0.58 0.00 0.00 0.00 178.15 179.63 1u9y h VAL 281 N 0.10 0.90 0.00 1.67 2.07 -0.55 -0.76 116.25 119.69 1u9y h VAL 281 Ca 0.00 -0.20 -0.00 0.00 0.82 0.00 0.00 66.70 67.32 1u9y h VAL 281 Cb 0.93 0.27 -0.00 0.00 -1.52 0.00 0.00 31.29 30.97 1u9y h VAL 281 CO 0.07 0.11 -0.02 0.44 0.02 0.00 0.00 177.57 178.19 1u9y h ASP 282 N 0.58 0.00 0.20 0.57 3.32 -1.37 -2.85 116.42 116.88 1u9y h ASP 282 Ca 0.34 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.39 1u9y h ASP 282 Cb 0.55 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.10 1u9y h ASP 282 CO -0.12 0.02 -0.32 0.18 -1.72 0.00 0.00 179.24 177.28 1u9y n LEU 283 N -3.11 1.17 -0.26 1.55 4.77 -0.31 -5.13 117.00 115.68 1u9y n LEU 283 Ca 0.01 -0.34 0.15 0.00 -0.03 0.00 0.00 56.01 55.80 1u9y n LEU 283 Cb 0.38 -0.10 0.72 0.00 -2.33 0.00 0.00 43.42 42.08 1u9y n LEU 283 CO 0.30 0.22 0.98 0.18 -1.33 0.00 0.00 177.39 177.74