#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uyi s VAL 17 N 0.00 4.90 -0.05 0.61 1.01 -1.26 -4.58 120.40 121.03 1uyi s VAL 17 Ca 0.00 0.02 -0.17 0.00 0.00 0.00 0.00 61.98 61.84 1uyi s VAL 17 Cb 0.00 -3.28 -0.05 0.00 0.00 0.00 0.00 36.38 33.05 1uyi s VAL 17 CO 0.00 0.35 0.45 -1.61 0.00 0.00 0.00 175.10 174.29 1uyi s GLU 18 N 1.22 4.15 -0.20 2.72 2.02 -0.77 -4.98 118.70 122.86 1uyi s GLU 18 Ca 0.06 0.45 -0.06 0.00 0.02 0.00 0.00 54.97 55.43 1uyi s GLU 18 Cb -0.14 -3.33 -0.03 0.00 0.10 0.00 0.00 34.13 30.73 1uyi s GLU 18 CO 0.05 0.43 0.04 0.99 0.02 0.00 0.00 175.26 176.78 1uyi s THR 19 N -0.25 4.35 0.01 3.63 2.01 -1.26 -1.60 115.64 122.53 1uyi s THR 19 Ca 0.25 -0.18 0.08 0.00 0.31 0.00 0.00 61.69 62.16 1uyi s THR 19 Cb -0.16 -2.98 -0.02 0.00 0.01 0.00 0.00 72.50 69.35 1uyi s THR 19 CO 0.12 0.42 -0.26 -0.36 -0.69 0.00 0.00 174.62 173.86 1uyi s PHE 20 N 0.86 2.27 0.17 4.92 0.40 0.41 -4.99 117.98 122.02 1uyi s PHE 20 Ca 0.02 -0.42 -0.30 0.00 -0.60 0.00 0.00 56.93 55.64 1uyi s PHE 20 Cb -0.14 -1.41 -0.07 0.00 0.51 0.00 0.00 43.02 41.91 1uyi s PHE 20 CO 0.02 0.04 0.98 0.00 0.70 0.00 0.00 175.22 176.96 1uyi s ALA 21 N -0.69 3.30 0.47 5.36 0.00 -1.26 -1.02 121.76 127.92 1uyi s ALA 21 Ca 0.10 0.64 -0.22 0.00 0.00 0.00 0.00 51.96 52.48 1uyi s ALA 21 Cb -0.10 -3.27 -0.07 0.00 0.00 0.00 0.00 23.12 19.68 1uyi s ALA 21 CO 0.00 0.01 1.14 -0.06 0.00 0.00 0.00 175.76 176.86 1uyi s PHE 22 N -0.45 2.89 0.69 0.00 0.08 -0.14 -4.91 117.98 116.15 1uyi s PHE 22 Ca 0.45 1.55 -0.17 0.00 0.12 0.00 0.00 56.93 58.89 1uyi s PHE 22 Cb -0.25 -3.32 -0.01 0.00 -0.57 0.00 0.00 43.02 38.86 1uyi s PHE 22 CO 0.32 -1.38 0.92 1.04 -0.10 0.00 0.00 175.22 176.02 1uyi n GLN 23 N -0.59 0.59 -0.25 0.44 6.02 -1.26 -4.77 117.38 117.56 1uyi n GLN 23 Ca 0.08 0.25 0.08 0.00 -0.01 0.00 0.00 57.00 57.40 1uyi n GLN 23 Cb 0.49 -2.17 0.33 0.00 1.02 0.00 0.00 30.24 29.91 1uyi n GLN 23 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1uyi h ALA 24 N -0.07 1.71 -0.67 -1.58 0.00 -1.98 -1.70 119.26 114.98 1uyi h ALA 24 Ca -0.48 -0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.35 1uyi h ALA 24 Cb 1.34 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.93 1uyi h ALA 24 CO 0.47 0.11 0.11 0.93 0.00 0.00 0.00 179.25 180.88 1uyi h GLU 25 N 0.80 1.10 -0.19 0.00 3.07 -1.97 -0.87 114.58 116.52 1uyi h GLU 25 Ca 0.40 -0.29 -0.08 0.00 -0.50 0.00 0.00 59.36 58.88 1uyi h GLU 25 Cb 0.46 -0.13 -0.00 0.00 -0.84 0.00 0.00 28.75 28.23 1uyi h GLU 25 CO -0.16 1.01 -0.20 0.82 -1.40 0.00 0.00 179.01 179.08 1uyi h ILE 26 N 1.02 1.33 -0.92 3.13 1.08 -1.66 -0.20 117.51 121.29 1uyi h ILE 26 Ca 0.20 -1.36 0.05 0.00 -0.39 0.00 0.00 64.86 63.36 1uyi h ILE 26 Cb 0.44 1.79 -0.06 0.00 -3.07 0.00 0.00 36.82 35.92 1uyi h ILE 26 CO 0.01 0.41 0.59 0.00 -0.69 0.00 0.00 178.15 178.48 1uyi h ALA 27 N 0.64 1.26 -0.28 1.87 0.00 -1.25 0.29 119.26 121.79 1uyi h ALA 27 Ca 0.03 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.87 1uyi h ALA 27 Cb 0.74 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1uyi h ALA 27 CO 0.05 0.39 -0.02 0.37 0.00 0.00 0.00 179.25 180.04 1uyi h GLN 28 N 1.10 0.51 -0.64 0.00 4.15 -0.94 -0.72 115.11 118.56 1uyi h GLN 28 Ca 0.39 -0.17 -0.04 0.00 0.77 0.00 0.00 58.65 59.60 1uyi h GLN 28 Cb 0.11 -0.04 -0.03 0.00 0.21 0.00 0.00 27.48 27.73 1uyi h GLN 28 CO -0.16 0.67 0.24 1.25 -1.93 0.00 0.00 178.83 178.91 1uyi h LEU 29 N 0.29 0.90 -0.67 -2.39 5.85 -0.11 -1.17 115.31 118.01 1uyi h LEU 29 Ca 0.08 -0.18 0.08 0.00 0.84 0.00 0.00 57.88 58.70 1uyi h LEU 29 Cb 0.45 -0.23 -0.07 0.00 0.37 0.00 0.00 40.66 41.18 1uyi h LEU 29 CO 0.02 0.83 0.33 0.24 -0.34 0.00 0.00 178.44 179.52 1uyi h MET 30 N 0.91 0.56 -0.55 1.25 2.86 -0.31 -1.29 114.93 118.35 1uyi h MET 30 Ca 0.21 -0.03 -0.05 0.00 -2.06 0.00 0.00 59.70 57.77 1uyi h MET 30 Cb 0.23 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 31.74 1uyi h MET 30 CO -0.01 0.37 0.14 0.77 1.06 0.00 0.00 176.91 179.23 1uyi h SER 31 N 0.57 0.83 -0.27 1.22 0.02 -0.76 -1.28 113.55 113.89 1uyi h SER 31 Ca 0.32 -0.23 0.04 0.00 -0.84 0.00 0.00 61.79 61.09 1uyi h SER 31 Cb 0.32 -0.22 -0.04 0.00 0.14 0.00 0.00 62.40 62.61 1uyi h SER 31 CO -0.25 0.84 0.03 0.25 -1.14 0.00 0.00 176.83 176.55 1uyi h LEU 32 N 0.77 -0.05 -0.59 5.07 5.85 -0.93 0.38 115.31 125.81 1uyi h LEU 32 Ca 0.17 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.94 1uyi h LEU 32 Cb 0.33 0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.41 1uyi h LEU 32 CO 0.00 0.01 0.37 0.40 -0.34 0.00 0.00 178.44 178.88 1uyi h ILE 33 N 0.11 1.17 -0.47 4.05 2.04 -1.00 0.14 117.51 123.55 1uyi h ILE 33 Ca 0.12 -0.35 -0.13 0.00 1.00 0.00 0.00 64.86 65.50 1uyi h ILE 33 Cb 0.15 0.34 -0.01 0.00 -0.74 0.00 0.00 36.82 36.55 1uyi h ILE 33 CO -0.19 0.17 -0.21 0.40 0.00 0.00 0.00 178.15 178.32 1uyi h ILE 34 N 0.80 1.27 0.05 -0.67 2.04 -1.02 -3.38 117.51 116.61 1uyi h ILE 34 Ca 0.21 -1.37 -0.30 0.00 1.00 0.00 0.00 64.86 64.40 1uyi h ILE 34 Cb -0.05 1.12 -0.03 0.00 -0.74 0.00 0.00 36.82 37.13 1uyi h ILE 34 CO -0.04 0.47 -1.65 0.78 0.00 0.00 0.00 178.15 177.71 1uyi h ASN 35 N 0.84 0.18 -3.49 1.72 2.35 0.28 -3.47 115.58 113.99 1uyi h ASN 35 Ca 0.11 -0.32 -0.52 0.00 -0.55 0.00 0.00 56.30 55.02 1uyi h ASN 35 Cb 0.78 -0.06 0.05 0.00 0.05 0.00 0.00 38.32 39.15 1uyi h ASN 35 CO 0.06 1.28 0.70 -0.89 -1.65 0.00 0.00 177.43 176.94 1uyi s THR 36 N -2.61 2.82 -0.14 2.81 2.01 0.45 -4.95 115.64 116.03 1uyi s THR 36 Ca -0.09 0.71 -0.29 0.00 0.31 0.00 0.00 61.69 62.33 1uyi s THR 36 Cb 0.08 -3.45 -0.03 0.00 0.01 0.00 0.00 72.50 69.10 1uyi s THR 36 CO 0.82 0.12 1.49 0.12 -0.69 0.00 0.00 174.62 176.48 1uyi s PHE 37 N -0.21 2.35 -0.29 4.92 5.36 -1.26 -4.97 117.98 123.88 1uyi s PHE 37 Ca 0.56 0.59 0.01 0.00 -0.96 0.00 0.00 56.93 57.13 1uyi s PHE 37 Cb -0.40 -3.78 0.18 0.00 -0.34 0.00 0.00 43.02 38.68 1uyi s PHE 37 CO 0.44 -2.80 0.55 -0.47 -1.46 0.00 0.00 175.22 171.48 1uyi s TYR 38 N 4.08 -1.50 -0.23 10.12 5.04 -1.26 -5.06 117.35 128.55 1uyi s TYR 38 Ca 0.65 1.32 0.17 0.00 -2.44 0.00 0.00 57.07 56.77 1uyi s TYR 38 Cb -0.27 0.37 0.13 0.00 0.35 0.00 0.00 41.96 42.54 1uyi s TYR 38 CO 0.24 -0.91 1.49 0.77 -1.34 0.00 0.00 175.55 175.79 1uyi h SER 39 N 8.04 0.00 -0.11 4.32 0.02 -2.04 -3.36 113.55 120.43 1uyi h SER 39 Ca -0.16 0.00 -0.28 0.00 -0.84 0.00 0.00 61.79 60.50 1uyi h SER 39 Cb 1.16 0.00 -0.07 0.00 0.14 0.00 0.00 62.40 63.63 1uyi h SER 39 CO 0.24 0.38 0.24 -3.20 -1.14 0.00 0.00 176.83 173.35 1uyi n ASN 40 N -3.19 5.83 0.24 3.07 4.05 -1.26 -4.67 115.26 119.32 1uyi n ASN 40 Ca 0.02 -2.57 0.12 0.00 0.45 0.00 0.00 54.58 52.61 1uyi n ASN 40 Cb 0.68 -1.42 0.74 0.00 1.23 0.00 0.00 39.78 41.02 1uyi n ASN 40 CO 0.00 0.00 0.00 0.11 -3.05 0.00 0.00 177.26 174.32 1uyi h LYS 41 N 3.27 0.00 0.00 1.20 1.57 -1.96 -3.21 116.57 117.43 1uyi h LYS 41 Ca 0.30 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.08 1uyi h LYS 41 Cb 1.28 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.59 1uyi h LYS 41 CO 0.50 0.00 0.37 1.05 -0.57 0.00 0.00 179.45 180.80 1uyi h GLU 42 N 0.00 0.00 0.00 3.15 4.11 -1.97 -2.30 114.58 117.57 1uyi h GLU 42 Ca 0.04 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.47 1uyi h GLU 42 Cb 0.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.42 1uyi h GLU 42 CO -0.00 0.00 0.00 0.44 0.07 0.00 0.00 179.01 179.52 1uyi n ILE 43 N -2.63 1.22 -0.17 -1.06 -6.64 -1.22 -2.42 119.36 106.44 1uyi n ILE 43 Ca -0.02 0.49 0.03 0.00 -1.77 0.00 0.00 62.75 61.48 1uyi n ILE 43 Cb 0.41 -1.43 0.31 0.00 -1.44 0.00 0.00 39.64 37.49 1uyi n ILE 43 CO 0.00 0.00 0.00 2.19 -1.77 0.00 0.00 176.55 176.97 1uyi h PHE 44 N 0.00 0.81 -0.19 4.28 -0.00 -1.68 -2.88 116.94 117.28 1uyi h PHE 44 Ca 0.00 0.02 -0.05 0.00 -0.00 0.00 0.00 57.97 57.94 1uyi h PHE 44 Cb 0.12 -0.27 -0.00 0.00 -0.00 0.00 0.00 35.95 35.80 1uyi h PHE 44 CO 0.00 0.48 -0.09 1.25 -0.00 0.00 0.00 178.31 179.95 1uyi h LEU 45 N 0.85 0.41 -1.35 2.10 5.85 -1.75 -2.34 115.31 119.09 1uyi h LEU 45 Ca 0.26 -0.41 -0.05 0.00 0.84 0.00 0.00 57.88 58.52 1uyi h LEU 45 Cb 0.01 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 40.92 1uyi h LEU 45 CO -0.07 0.73 -0.24 0.08 -0.34 0.00 0.00 178.44 178.60 1uyi h ARG 46 N 0.09 0.00 -0.40 1.25 0.11 -1.71 -1.06 114.38 112.66 1uyi h ARG 46 Ca 0.04 0.00 -0.09 0.00 0.10 0.00 0.00 59.98 60.04 1uyi h ARG 46 Cb 0.58 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.65 1uyi h ARG 46 CO 0.03 0.24 -0.08 0.93 0.10 0.00 0.00 179.97 181.19 1uyi h GLU 47 N 0.00 0.77 -0.12 0.08 4.39 -1.27 -0.04 114.58 118.39 1uyi h GLU 47 Ca -0.00 -0.29 -0.03 0.00 0.34 0.00 0.00 59.36 59.38 1uyi h GLU 47 Cb 0.64 -0.05 -0.00 0.00 -0.10 0.00 0.00 28.75 29.24 1uyi h GLU 47 CO 0.03 0.89 -0.05 -0.07 -1.16 0.00 0.00 179.01 178.65 1uyi h LEU 48 N 0.59 0.26 -0.77 1.33 3.38 -0.99 -0.84 115.31 118.26 1uyi h LEU 48 Ca 0.10 -0.40 0.07 0.00 0.09 0.00 0.00 57.88 57.75 1uyi h LEU 48 Cb 0.60 -0.07 -0.06 0.00 0.09 0.00 0.00 40.66 41.21 1uyi h LEU 48 CO 0.04 0.60 0.44 0.40 0.09 0.00 0.00 178.44 180.01 1uyi h ILE 49 N -0.09 0.96 -0.61 1.22 2.04 -1.22 -1.04 117.51 118.78 1uyi h ILE 49 Ca 0.03 -0.27 -0.06 0.00 1.00 0.00 0.00 64.86 65.55 1uyi h ILE 49 Cb 0.50 0.10 -0.02 0.00 -0.74 0.00 0.00 36.82 36.66 1uyi h ILE 49 CO 0.02 0.14 0.13 -1.28 0.00 0.00 0.00 178.15 177.16 1uyi h SER 50 N 0.79 0.94 -0.89 1.72 0.87 -0.90 0.75 113.55 116.82 1uyi h SER 50 Ca 0.35 -0.25 0.02 0.00 -1.23 0.00 0.00 61.79 60.69 1uyi h SER 50 Cb 0.24 -0.25 -0.05 0.00 -0.44 0.00 0.00 62.40 61.91 1uyi h SER 50 CO -0.20 0.94 0.59 0.78 -0.53 0.00 0.00 176.83 178.41 1uyi h ASN 51 N 0.89 1.00 -0.40 6.23 2.35 -0.60 -0.59 115.58 124.46 1uyi h ASN 51 Ca 0.19 -0.02 -0.05 0.00 -0.55 0.00 0.00 56.30 55.87 1uyi h ASN 51 Cb 0.38 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 38.50 1uyi h ASN 51 CO 0.01 0.71 0.05 0.28 -1.65 0.00 0.00 177.43 176.82 1uyi h SER 52 N 1.17 0.65 -0.91 5.81 0.02 -0.70 -1.96 113.55 117.63 1uyi h SER 52 Ca 0.34 -0.28 -0.00 0.00 -0.84 0.00 0.00 61.79 61.01 1uyi h SER 52 Cb -0.08 -0.17 -0.04 0.00 0.14 0.00 0.00 62.40 62.24 1uyi h SER 52 CO -0.09 0.76 0.56 -1.28 -1.14 0.00 0.00 176.83 175.64 1uyi h SER 53 N 0.51 1.09 -0.39 3.07 0.87 -0.57 0.19 113.55 118.33 1uyi h SER 53 Ca 0.12 -0.06 -0.00 0.00 -1.23 0.00 0.00 61.79 60.62 1uyi h SER 53 Cb 0.40 -0.28 -0.02 0.00 -0.44 0.00 0.00 62.40 62.07 1uyi h SER 53 CO 0.01 0.83 0.24 0.44 -0.53 0.00 0.00 176.83 177.82 1uyi h ASP 54 N 1.26 0.46 -0.47 6.23 3.32 -0.85 -0.59 116.42 125.78 1uyi h ASP 54 Ca 0.33 -0.04 -0.08 0.00 0.02 0.00 0.00 57.03 57.25 1uyi h ASP 54 Cb -0.06 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.35 1uyi h ASP 54 CO -0.06 0.37 -0.00 0.00 -1.72 0.00 0.00 179.24 177.83 1uyi h ALA 55 N 1.11 1.01 -0.43 3.45 0.00 -1.03 -0.21 119.26 123.17 1uyi h ALA 55 Ca 0.14 -0.28 -0.06 0.00 0.00 0.00 0.00 54.91 54.71 1uyi h ALA 55 Cb -0.01 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 1uyi h ALA 55 CO -0.03 0.61 0.04 -0.07 0.00 0.00 0.00 179.25 179.80 1uyi h LEU 56 N 0.83 0.71 -0.77 0.00 3.38 -0.86 -1.55 115.31 117.04 1uyi h LEU 56 Ca 0.16 -0.28 0.11 0.00 0.09 0.00 0.00 57.88 57.95 1uyi h LEU 56 Cb 0.49 -0.19 -0.08 0.00 0.09 0.00 0.00 40.66 40.97 1uyi h LEU 56 CO 0.02 0.82 0.39 0.44 0.09 0.00 0.00 178.44 180.20 1uyi h ASP 57 N 0.58 0.50 -0.12 -0.43 3.32 -0.59 -0.61 116.42 119.07 1uyi h ASP 57 Ca 0.13 0.07 -0.01 0.00 0.02 0.00 0.00 57.03 57.24 1uyi h ASP 57 Cb 0.43 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 39.96 1uyi h ASP 57 CO 0.01 0.26 0.04 0.50 -1.72 0.00 0.00 179.24 178.33 1uyi h LYS 58 N 0.63 0.19 -0.45 3.56 3.64 -0.81 -0.32 116.57 123.01 1uyi h LYS 58 Ca 0.40 -0.04 -0.08 0.00 -1.27 0.00 0.00 60.65 59.66 1uyi h LYS 58 Cb 0.47 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.24 1uyi h LYS 58 CO -0.30 0.34 -0.02 0.97 -2.27 0.00 0.00 179.45 178.17 1uyi h ILE 59 N 0.01 1.26 -0.07 2.00 6.09 -1.26 -2.05 117.51 123.50 1uyi h ILE 59 Ca 0.04 -1.08 0.04 0.00 -1.37 0.00 0.00 64.86 62.49 1uyi h ILE 59 Cb 0.22 1.06 -0.06 0.00 0.47 0.00 0.00 36.82 38.51 1uyi h ILE 59 CO -0.00 0.37 -0.39 -0.09 -3.07 0.00 0.00 178.15 174.97 1uyi h ARG 60 N 0.65 -0.49 -0.82 2.19 2.43 -1.03 -0.03 114.38 117.28 1uyi h ARG 60 Ca 0.13 0.03 0.19 0.00 -0.81 0.00 0.00 59.98 59.52 1uyi h ARG 60 Cb 0.52 0.11 -0.12 0.00 -0.42 0.00 0.00 29.97 30.07 1uyi h ARG 60 CO 0.03 -0.32 0.30 -0.92 -1.51 0.00 0.00 179.97 177.54 1uyi h TYR 61 N -0.50 0.48 -0.21 2.20 3.20 -1.03 -2.23 116.97 118.88 1uyi h TYR 61 Ca 0.07 0.04 -0.13 0.00 3.14 0.00 0.00 58.73 61.85 1uyi h TYR 61 Cb 0.62 -0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.79 1uyi h TYR 61 CO -0.43 -0.05 -0.42 0.93 -1.64 0.00 0.00 178.16 176.55 1uyi h GLU 62 N 0.35 0.50 0.00 1.82 5.08 -0.79 -2.69 114.58 118.85 1uyi h GLU 62 Ca 0.49 -0.26 -0.03 0.00 -1.00 0.00 0.00 59.36 58.56 1uyi h GLU 62 Cb 0.87 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 30.12 1uyi h GLU 62 CO -0.51 0.84 -0.14 0.66 -1.00 0.00 0.00 179.01 178.85 1uyi h SER 63 N 0.41 0.00 -0.78 1.42 4.64 -0.43 -2.60 113.55 116.21 1uyi h SER 63 Ca 0.03 0.00 0.07 0.00 -0.47 0.00 0.00 61.79 61.42 1uyi h SER 63 Cb 0.91 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.95 1uyi h SER 63 CO 0.08 0.14 0.51 -0.07 -0.87 0.00 0.00 176.83 176.62 1uyi h LEU 64 N 0.00 0.73 0.00 5.97 3.38 -1.10 -2.59 115.31 121.69 1uyi h LEU 64 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1uyi h LEU 64 Cb 0.47 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.06 1uyi h LEU 64 CO 0.02 0.47 -1.79 0.35 0.09 0.00 0.00 178.44 177.58 1uyi n THR 65 N -4.48 0.00 -3.50 0.22 -2.24 -1.18 -4.76 114.28 98.34 1uyi n THR 65 Ca 0.12 -0.40 -0.29 0.00 -2.27 0.00 0.00 64.05 61.21 1uyi n THR 65 Cb 0.22 0.20 -0.12 0.00 -2.10 0.00 0.00 70.33 68.54 1uyi n THR 65 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1uyi s ASP 66 N -4.19 2.75 0.56 3.42 2.15 -0.99 -5.00 116.67 115.38 1uyi s ASP 66 Ca -0.05 -2.53 0.31 0.00 0.43 0.00 0.00 52.55 50.71 1uyi s ASP 66 Cb 0.14 -0.55 1.47 0.00 -0.30 0.00 0.00 42.92 43.68 1uyi s ASP 66 CO 0.89 -0.26 1.87 -0.65 -0.17 0.00 0.00 175.17 176.85 1uyi h PRO 67 N 6.57 0.00 0.00 4.34 0.11 -1.76 -1.62 132.00 139.64 1uyi h PRO 67 Ca 0.10 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.21 1uyi h PRO 67 Cb 0.94 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.05 1uyi h PRO 67 CO 0.34 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.00 1uyi n SER 68 N -4.06 0.02 0.19 -2.05 3.41 -1.26 -2.04 113.62 107.83 1uyi n SER 68 Ca 0.16 0.51 0.14 0.00 -0.26 0.00 0.00 58.87 59.42 1uyi n SER 68 Cb 0.90 -0.51 0.61 0.00 -0.26 0.00 0.00 64.21 64.95 1uyi n SER 68 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 1uyi h LYS 69 N 0.00 0.00 -0.23 4.33 1.79 -1.65 -2.10 116.57 118.71 1uyi h LYS 69 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1uyi h LYS 69 Cb 0.21 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.86 1uyi h LYS 69 CO 0.00 0.00 0.00 1.28 -1.08 0.00 0.00 179.45 179.65 1uyi n LEU 70 N -2.54 2.50 0.09 2.94 4.77 -0.86 -4.35 117.00 119.55 1uyi n LEU 70 Ca 0.01 -1.03 0.14 0.00 -0.03 0.00 0.00 56.01 55.11 1uyi n LEU 70 Cb 0.22 -0.14 0.65 0.00 -2.33 0.00 0.00 43.42 41.81 1uyi n LEU 70 CO 0.21 0.51 1.14 0.44 -1.33 0.00 0.00 177.39 178.36 1uyi h ASP 71 N 3.39 0.04 -0.01 -1.43 3.32 -1.55 -1.29 116.42 118.89 1uyi h ASP 71 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1uyi h ASP 71 Cb 0.74 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.28 1uyi h ASP 71 CO 0.00 0.03 0.00 -1.54 -1.72 0.00 0.00 179.24 176.01 1uyi n SER 72 N -4.45 0.07 0.00 6.45 3.41 -1.26 -4.89 113.62 112.94 1uyi n SER 72 Ca 0.05 -1.98 0.00 0.00 -0.26 0.00 0.00 58.87 56.67 1uyi n SER 72 Cb 0.37 -0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.32 1uyi n SER 72 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1uyi n GLY 73 N 0.53 4.10 0.09 5.00 0.00 -0.49 -3.70 105.19 110.72 1uyi n GLY 73 Ca 0.01 -0.95 -0.06 0.00 0.00 0.00 0.00 46.02 45.02 1uyi n GLY 73 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1uyi n LYS 74 N 0.00 0.65 -2.04 1.61 4.76 -1.23 -4.72 118.16 117.18 1uyi n LYS 74 Ca 0.00 0.18 -0.42 0.00 -2.87 0.00 0.00 58.31 55.19 1uyi n LYS 74 Cb 0.00 -1.71 -0.03 0.00 -1.84 0.00 0.00 35.03 31.45 1uyi n LYS 74 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 1uyi s GLU 75 N -2.68 4.26 -0.32 1.97 8.01 -1.26 -4.99 118.70 123.68 1uyi s GLU 75 Ca -0.06 2.22 -0.00 0.00 0.01 0.00 0.00 54.97 57.14 1uyi s GLU 75 Cb 0.08 -3.31 0.07 0.00 -4.31 0.00 0.00 34.13 26.66 1uyi s GLU 75 CO 0.83 -0.57 0.02 -0.51 0.01 0.00 0.00 175.26 175.04 1uyi s LEU 76 N 1.51 4.19 0.30 1.80 1.43 -1.26 -4.74 118.68 121.90 1uyi s LEU 76 Ca 0.68 -1.58 -0.20 0.00 -1.03 0.00 0.00 54.13 52.01 1uyi s LEU 76 Cb -0.39 -1.69 0.05 0.00 0.03 0.00 0.00 46.19 44.18 1uyi s LEU 76 CO 0.31 -0.32 0.81 -1.38 0.23 0.00 0.00 176.35 176.00 1uyi s HIS 77 N 1.15 -0.03 -0.03 0.29 -3.43 -1.26 -4.39 115.29 107.57 1uyi s HIS 77 Ca -0.01 -0.49 0.01 0.00 -0.80 0.00 0.00 55.06 53.77 1uyi s HIS 77 Cb -0.20 0.75 0.03 0.00 -1.43 0.00 0.00 32.58 31.73 1uyi s HIS 77 CO -0.04 -1.28 -0.01 0.42 -2.00 0.00 0.00 174.74 171.83 1uyi s ILE 78 N -3.02 0.25 -0.04 -5.38 1.01 -0.68 -2.66 121.20 110.68 1uyi s ILE 78 Ca 0.14 0.04 0.03 0.00 0.00 0.00 0.00 60.65 60.86 1uyi s ILE 78 Cb -0.05 -0.33 -0.03 0.00 0.01 0.00 0.00 42.46 42.06 1uyi s ILE 78 CO 0.08 0.16 -0.13 0.20 0.00 0.00 0.00 174.94 175.25 1uyi s ASN 79 N 0.98 4.14 -0.26 3.58 0.02 -0.35 -1.15 114.94 121.90 1uyi s ASN 79 Ca -0.10 -0.18 -0.03 0.00 -1.02 0.00 0.00 52.86 51.52 1uyi s ASN 79 Cb -0.14 -0.89 0.02 0.00 0.02 0.00 0.00 41.25 40.26 1uyi s ASN 79 CO -0.01 0.34 -0.02 -0.76 0.02 0.00 0.00 177.10 176.66 1uyi s LEU 80 N -0.83 3.32 -0.28 0.60 1.43 0.64 -1.17 118.68 122.39 1uyi s LEU 80 Ca 0.12 -0.76 0.02 0.00 -1.03 0.00 0.00 54.13 52.48 1uyi s LEU 80 Cb -0.11 -1.73 0.08 0.00 0.03 0.00 0.00 46.19 44.46 1uyi s LEU 80 CO 0.01 -0.13 -0.02 -0.63 0.23 0.00 0.00 176.35 175.82 1uyi s ILE 81 N 1.39 1.85 0.15 -0.59 1.01 -0.09 -0.65 121.20 124.28 1uyi s ILE 81 Ca 0.02 -1.70 -0.15 0.00 0.00 0.00 0.00 60.65 58.81 1uyi s ILE 81 Cb -0.16 -2.18 -0.07 0.00 0.01 0.00 0.00 42.46 40.05 1uyi s ILE 81 CO -0.03 -0.30 0.57 -2.16 0.00 0.00 0.00 174.94 173.03 1uyi s PRO 82 N 1.19 4.03 -0.29 2.79 0.04 -1.26 -0.77 135.00 140.73 1uyi s PRO 82 Ca 0.00 0.56 -0.01 0.00 0.04 0.00 0.00 61.00 61.60 1uyi s PRO 82 Cb -0.19 -2.95 0.13 0.00 0.04 0.00 0.00 34.50 31.53 1uyi s PRO 82 CO -0.09 0.48 0.27 1.21 0.04 0.00 0.00 177.00 178.91 1uyi s ASN 83 N -1.65 1.99 0.26 6.66 3.84 -0.61 -4.78 114.94 120.65 1uyi s ASN 83 Ca 0.38 -0.86 -0.02 0.00 0.21 0.00 0.00 52.86 52.56 1uyi s ASN 83 Cb -0.16 0.36 0.33 0.00 -0.55 0.00 0.00 41.25 41.23 1uyi s ASN 83 CO 0.19 -0.40 1.77 0.11 -2.79 0.00 0.00 177.10 175.99 1uyi h LYS 84 N 8.27 0.84 -0.29 0.43 1.57 -1.93 0.61 116.57 126.06 1uyi h LYS 84 Ca -0.14 -0.21 0.06 0.00 -1.87 0.00 0.00 60.65 58.49 1uyi h LYS 84 Cb 1.06 -0.11 -0.05 0.00 0.08 0.00 0.00 32.23 33.21 1uyi h LYS 84 CO 0.35 0.81 -0.06 1.96 -0.57 0.00 0.00 179.45 181.94 1uyi h GLN 85 N 0.79 0.01 0.00 3.15 4.20 -1.96 -2.63 115.11 118.66 1uyi h GLN 85 Ca 0.16 -0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.87 1uyi h GLN 85 Cb 0.40 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.18 1uyi h GLN 85 CO 0.01 0.01 -0.32 -0.25 -0.67 0.00 0.00 178.83 177.62 1uyi n ASP 86 N -5.23 0.70 -3.68 1.46 8.00 -1.10 -4.97 116.55 111.72 1uyi n ASP 86 Ca -0.00 0.32 -0.23 0.00 0.71 0.00 0.00 54.79 55.59 1uyi n ASP 86 Cb 0.17 -0.28 0.05 0.00 -0.02 0.00 0.00 41.12 41.03 1uyi n ASP 86 CO 0.00 0.00 0.00 -1.14 -0.39 0.00 0.00 177.20 175.67 1uyi n ARG 87 N -2.11 -5.82 -4.36 -1.24 0.63 0.16 -4.92 116.66 98.99 1uyi n ARG 87 Ca 0.05 0.69 -0.26 0.00 -0.92 0.00 0.00 57.85 57.40 1uyi n ARG 87 Cb 0.42 -5.48 -0.13 0.00 0.45 0.00 0.00 32.46 27.72 1uyi n ARG 87 CO 0.00 0.00 0.00 0.95 -2.51 0.00 0.00 177.63 176.07 1uyi s THR 88 N -3.48 1.93 -0.17 5.15 -4.23 -0.90 -1.80 115.64 112.13 1uyi s THR 88 Ca 0.24 -1.60 0.01 0.00 -1.18 0.00 0.00 61.69 59.16 1uyi s THR 88 Cb -0.11 -1.73 0.02 0.00 1.34 0.00 0.00 72.50 72.02 1uyi s THR 88 CO 0.79 0.02 -0.20 -0.22 -0.54 0.00 0.00 174.62 174.47 1uyi s LEU 89 N -1.91 2.09 -0.14 4.79 2.96 -0.74 -1.58 118.68 124.15 1uyi s LEU 89 Ca 0.09 -0.63 -0.03 0.00 -0.22 0.00 0.00 54.13 53.35 1uyi s LEU 89 Cb -0.10 -1.45 -0.03 0.00 0.50 0.00 0.00 46.19 45.12 1uyi s LEU 89 CO 0.05 0.01 -0.05 -0.89 -1.32 0.00 0.00 176.35 174.14 1uyi s THR 90 N 1.22 3.76 -0.28 3.68 2.01 0.05 -0.60 115.64 125.47 1uyi s THR 90 Ca 0.03 -0.41 -0.07 0.00 0.31 0.00 0.00 61.69 61.55 1uyi s THR 90 Cb -0.13 -2.63 -0.00 0.00 0.01 0.00 0.00 72.50 69.74 1uyi s THR 90 CO -0.11 0.51 0.07 -0.63 -0.69 0.00 0.00 174.62 173.77 1uyi s ILE 91 N 0.24 4.05 -0.13 1.82 1.09 -0.19 -0.91 121.20 127.17 1uyi s ILE 91 Ca -0.04 -0.51 -0.00 0.00 -1.10 0.00 0.00 60.65 59.00 1uyi s ILE 91 Cb -0.14 -3.01 -0.02 0.00 -1.06 0.00 0.00 42.46 38.23 1uyi s ILE 91 CO 0.03 0.18 -0.11 -0.69 -0.10 0.00 0.00 174.94 174.26 1uyi s VAL 92 N 1.54 3.25 0.25 2.92 1.01 -0.31 -0.72 120.40 128.33 1uyi s VAL 92 Ca 0.04 -0.60 0.06 0.00 0.00 0.00 0.00 61.98 61.48 1uyi s VAL 92 Cb -0.16 -2.37 -0.05 0.00 0.00 0.00 0.00 36.38 33.80 1uyi s VAL 92 CO 0.02 0.53 -0.07 1.51 0.00 0.00 0.00 175.10 177.09 1uyi s ASP 93 N 0.21 2.53 -0.52 3.32 1.47 0.20 -1.21 116.67 122.65 1uyi s ASP 93 Ca -0.07 -1.15 0.03 0.00 1.18 0.00 0.00 52.55 52.54 1uyi s ASP 93 Cb -0.15 -0.12 0.43 0.00 -0.34 0.00 0.00 42.92 42.74 1uyi s ASP 93 CO 0.05 -0.33 1.55 0.35 0.68 0.00 0.00 175.17 177.47 1uyi n THR 94 N -0.50 2.99 -0.18 2.11 -2.24 -1.09 -2.33 114.28 113.05 1uyi n THR 94 Ca -0.06 -4.03 0.00 0.00 -2.27 0.00 0.00 64.05 57.68 1uyi n THR 94 Cb 0.63 -1.19 0.00 0.00 -2.10 0.00 0.00 70.33 67.67 1uyi n THR 94 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1uyi n GLY 95 N -0.69 -0.94 0.23 3.38 0.00 -1.26 -4.74 105.19 101.17 1uyi n GLY 95 Ca 0.50 -1.62 0.01 0.00 0.00 0.00 0.00 46.02 44.91 1uyi n GLY 95 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1uyi h ILE 96 N -0.23 1.22 0.00 -0.61 2.10 -1.63 -3.18 117.51 115.17 1uyi h ILE 96 Ca 0.00 -0.99 0.00 0.00 1.08 0.00 0.00 64.86 64.95 1uyi h ILE 96 Cb 0.00 1.33 0.00 0.00 -1.09 0.00 0.00 36.82 37.06 1uyi h ILE 96 CO 0.00 0.30 0.00 0.61 -1.08 0.00 0.00 178.15 177.98 1uyi n GLY 97 N -0.69 -1.00 3.43 8.18 0.00 -1.26 -4.25 105.19 109.60 1uyi n GLY 97 Ca -0.01 -1.63 -0.33 0.00 0.00 0.00 0.00 46.02 44.06 1uyi n GLY 97 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1uyi s MET 98 N -2.39 2.73 0.80 1.61 1.00 -1.26 -4.70 119.30 117.09 1uyi s MET 98 Ca 0.00 -0.72 -0.11 0.00 0.00 0.00 0.00 55.69 54.86 1uyi s MET 98 Cb 0.00 -2.42 0.08 0.00 0.00 0.00 0.00 34.83 32.50 1uyi s MET 98 CO 0.00 0.49 1.16 0.95 0.00 0.00 0.00 175.02 177.63 1uyi s THR 99 N -0.39 2.04 0.27 2.05 -4.23 -1.26 -3.84 115.64 110.28 1uyi s THR 99 Ca 0.04 -0.04 -0.01 0.00 -1.18 0.00 0.00 61.69 60.50 1uyi s THR 99 Cb -0.12 -3.00 0.27 0.00 1.34 0.00 0.00 72.50 70.99 1uyi s THR 99 CO 0.02 0.00 1.84 0.50 -0.54 0.00 0.00 174.62 176.45 1uyi h LYS 100 N -1.03 0.98 -0.99 3.99 3.64 -1.98 -2.21 116.57 118.98 1uyi h LYS 100 Ca -0.46 -0.06 0.05 0.00 -1.27 0.00 0.00 60.65 58.92 1uyi h LYS 100 Cb 1.32 -0.22 -0.06 0.00 -0.41 0.00 0.00 32.23 32.86 1uyi h LYS 100 CO 0.64 0.65 0.65 0.00 -2.27 0.00 0.00 179.45 179.11 1uyi h ALA 101 N 1.50 1.39 0.44 5.00 0.00 -1.98 -1.89 119.26 123.71 1uyi h ALA 101 Ca 0.46 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.33 1uyi h ALA 101 Cb 0.37 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 1uyi h ALA 101 CO -0.23 0.49 -0.37 -0.44 0.00 0.00 0.00 179.25 178.70 1uyi h ASP 102 N 1.21 -0.98 -0.86 0.00 3.32 -1.78 -1.31 116.42 116.02 1uyi h ASP 102 Ca 0.41 0.08 0.05 0.00 0.02 0.00 0.00 57.03 57.59 1uyi h ASP 102 Cb 0.09 0.32 -0.06 0.00 0.22 0.00 0.00 39.33 39.90 1uyi h ASP 102 CO -0.15 -0.53 0.54 -0.07 -1.72 0.00 0.00 179.24 177.32 1uyi h LEU 103 N -0.81 0.87 0.00 1.55 3.38 -1.06 -0.87 115.31 118.37 1uyi h LEU 103 Ca -0.04 0.01 -0.07 0.00 0.09 0.00 0.00 57.88 57.86 1uyi h LEU 103 Cb 0.70 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 1uyi h LEU 103 CO -0.02 0.58 -1.76 -0.38 0.09 0.00 0.00 178.44 176.95 1uyi n ILE 104 N -4.59 0.48 0.09 1.22 5.41 -0.75 -4.72 119.36 116.50 1uyi n ILE 104 Ca 0.12 -0.58 0.00 0.00 1.00 0.00 0.00 62.75 63.28 1uyi n ILE 104 Cb 0.14 -0.23 0.00 0.00 -0.71 0.00 0.00 39.64 38.84 1uyi n ILE 104 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 1uyi n ASN 105 N -2.50 0.21 -0.13 4.38 3.02 -0.62 -4.83 115.26 114.79 1uyi n ASN 105 Ca -0.08 0.30 -0.11 0.00 -0.03 0.00 0.00 54.58 54.66 1uyi n ASN 105 Cb 0.68 0.13 -0.02 0.00 -0.61 0.00 0.00 39.78 39.96 1uyi n ASN 105 CO 0.00 0.00 0.00 0.78 -2.62 0.00 0.00 177.26 175.42 1uyi h ASN 106 N 0.00 0.77 -0.26 6.41 2.35 -1.13 -1.82 115.58 121.90 1uyi h ASN 106 Ca 0.00 -0.37 0.04 0.00 -0.55 0.00 0.00 56.30 55.42 1uyi h ASN 106 Cb 0.07 -0.21 -0.04 0.00 0.05 0.00 0.00 38.32 38.19 1uyi h ASN 106 CO 0.00 0.96 0.01 -0.07 -1.65 0.00 0.00 177.43 176.68 1uyi h LEU 107 N 0.57 -0.08 -0.46 1.61 3.38 -1.42 0.48 115.31 119.40 1uyi h LEU 107 Ca 0.10 0.06 0.06 0.00 0.09 0.00 0.00 57.88 58.19 1uyi h LEU 107 Cb 0.63 0.10 -0.05 0.00 0.09 0.00 0.00 40.66 41.42 1uyi h LEU 107 CO 0.04 -0.01 0.16 1.23 0.09 0.00 0.00 178.44 179.95 1uyi h GLY 108 N 0.09 0.60 0.85 0.83 0.00 -1.75 0.49 103.07 104.18 1uyi h GLY 108 Ca 0.12 -0.08 0.00 0.00 0.00 0.00 0.00 47.33 47.37 1uyi h GLY 108 CO -0.20 0.01 -0.15 -0.84 0.00 0.00 0.00 176.54 175.36 1uyi h THR 109 N 0.32 0.68 -0.13 4.70 2.02 -0.92 -0.47 112.91 119.11 1uyi h THR 109 Ca 0.22 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.41 1uyi h THR 109 Cb 0.23 0.68 -0.01 0.00 -1.74 0.00 0.00 68.15 67.30 1uyi h THR 109 CO -0.23 0.00 0.04 0.40 0.37 0.00 0.00 175.52 176.10 1uyi h ILE 110 N -0.34 0.96 0.00 3.11 2.04 -0.59 -3.03 117.51 119.66 1uyi h ILE 110 Ca -0.00 -0.04 -0.03 0.00 1.00 0.00 0.00 64.86 65.79 1uyi h ILE 110 Cb 0.31 0.85 -0.00 0.00 -0.74 0.00 0.00 36.82 37.23 1uyi h ILE 110 CO -0.02 0.02 -0.13 0.00 0.00 0.00 0.00 178.15 178.01 1uyi h ALA 111 N 1.08 1.07 0.92 1.87 0.00 0.18 -2.72 119.26 121.66 1uyi h ALA 111 Ca 0.06 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.80 1uyi h ALA 111 Cb 0.04 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 17.81 1uyi h ALA 111 CO -0.06 0.17 -0.44 -0.22 0.00 0.00 0.00 179.25 178.69 1uyi h LYS 112 N 0.00 -1.19 -0.85 0.00 3.64 -0.95 -0.48 116.57 116.73 1uyi h LYS 112 Ca -0.00 0.08 0.04 0.00 -1.27 0.00 0.00 60.65 59.50 1uyi h LYS 112 Cb 0.57 0.27 -0.05 0.00 -0.41 0.00 0.00 32.23 32.61 1uyi h LYS 112 CO 0.02 -0.79 0.56 0.66 -2.27 0.00 0.00 179.45 177.62 1uyi h SER 113 N -1.33 0.89 -0.17 4.20 4.64 -1.63 -2.50 113.55 117.64 1uyi h SER 113 Ca -0.13 -0.01 -0.17 0.00 -0.47 0.00 0.00 61.79 61.02 1uyi h SER 113 Cb 0.95 -0.20 -0.00 0.00 -0.31 0.00 0.00 62.40 62.83 1uyi h SER 113 CO 0.21 0.60 -0.50 1.23 -0.87 0.00 0.00 176.83 177.49 1uyi h GLY 114 N 1.02 0.82 0.90 -0.77 0.00 -1.43 -2.46 103.07 101.15 1uyi h GLY 114 Ca 0.35 -0.92 -0.00 0.00 0.00 0.00 0.00 47.33 46.76 1uyi h GLY 114 CO -0.11 0.82 0.06 -0.84 0.00 0.00 0.00 176.54 176.47 1uyi h THR 115 N 0.59 1.12 -0.03 4.70 2.02 -0.94 -0.90 112.91 119.47 1uyi h THR 115 Ca 0.02 -0.35 0.03 0.00 0.77 0.00 0.00 66.41 66.89 1uyi h THR 115 Cb 1.08 1.14 -0.04 0.00 -1.74 0.00 0.00 68.15 68.58 1uyi h THR 115 CO 0.11 0.11 -0.23 0.50 0.37 0.00 0.00 175.52 176.38 1uyi h LYS 116 N 0.06 -0.33 -0.99 6.66 3.64 -1.37 0.27 116.57 124.51 1uyi h LYS 116 Ca 0.04 0.02 0.02 0.00 -1.27 0.00 0.00 60.65 59.46 1uyi h LYS 116 Cb 0.12 0.07 -0.05 0.00 -0.41 0.00 0.00 32.23 31.96 1uyi h LYS 116 CO -0.01 -0.22 0.66 0.00 -2.27 0.00 0.00 179.45 177.61 1uyi h ALA 117 N 0.55 1.28 -0.36 5.00 0.00 -1.40 -0.74 119.26 123.59 1uyi h ALA 117 Ca 0.07 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.87 1uyi h ALA 117 Cb 0.44 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1uyi h ALA 117 CO -0.23 0.61 0.02 0.35 0.00 0.00 0.00 179.25 180.00 1uyi h PHE 118 N 1.31 0.68 -0.33 0.00 3.57 -0.46 -0.26 116.94 121.46 1uyi h PHE 118 Ca 0.38 -0.11 -0.12 0.00 3.53 0.00 0.00 57.97 61.65 1uyi h PHE 118 Cb -0.09 -0.18 -0.01 0.00 2.79 0.00 0.00 35.95 38.46 1uyi h PHE 118 CO -0.00 0.71 -0.29 0.52 -2.23 0.00 0.00 178.31 177.02 1uyi h MET 119 N 0.45 0.68 0.04 1.11 2.86 -0.21 -1.15 114.93 118.71 1uyi h MET 119 Ca 0.11 -0.29 0.02 0.00 -2.06 0.00 0.00 59.70 57.47 1uyi h MET 119 Cb 0.42 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.04 1uyi h MET 119 CO 0.01 0.89 -0.14 0.93 1.06 0.00 0.00 176.91 179.66 1uyi h GLU 120 N 0.58 -0.24 -0.77 1.72 5.08 -1.01 -3.06 114.58 116.88 1uyi h GLU 120 Ca 0.07 0.02 0.10 0.00 -1.00 0.00 0.00 59.36 58.54 1uyi h GLU 120 Cb 0.78 0.06 -0.05 0.00 0.50 0.00 0.00 28.75 30.04 1uyi h GLU 120 CO 0.06 -0.16 0.50 0.00 -1.00 0.00 0.00 179.01 178.42 1uyi h ALA 121 N 0.66 1.79 -0.03 3.43 0.00 -0.35 -0.41 119.26 124.36 1uyi h ALA 121 Ca 0.03 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.94 1uyi h ALA 121 Cb 0.29 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 1uyi h ALA 121 CO -0.10 0.05 0.11 -0.07 0.00 0.00 0.00 179.25 179.23 1uyi h LEU 122 N 0.69 0.00 -7.95 0.00 3.38 -1.13 -2.46 115.31 107.85 1uyi h LEU 122 Ca 0.35 0.00 -0.74 0.00 0.09 0.00 0.00 57.88 57.58 1uyi h LEU 122 Cb 0.46 0.00 -0.28 0.00 0.09 0.00 0.00 40.66 40.93 1uyi h LEU 122 CO -0.13 0.00 -0.26 -1.10 0.09 0.00 0.00 178.44 177.04 1uyi s GLN 123 N -4.25 2.83 0.00 1.13 -0.21 -0.16 -2.39 119.66 116.61 1uyi s GLN 123 Ca -0.05 -1.92 0.00 0.00 0.02 0.00 0.00 55.36 53.42 1uyi s GLN 123 Cb 0.12 -4.11 0.00 0.00 1.00 0.00 0.00 33.01 30.02 1uyi s GLN 123 CO 0.41 -1.25 0.00 0.00 -2.12 0.00 0.00 175.29 172.33 1uyi n ALA 124 N 4.76 0.00 -3.91 6.09 0.00 -1.24 -4.88 120.51 121.33 1uyi n ALA 124 Ca -0.05 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.09 1uyi n ALA 124 Cb 0.41 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.88 1uyi n ALA 124 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1uyi n GLY 125 N 0.00 -0.46 3.84 0.00 0.00 -1.00 -5.00 105.19 102.57 1uyi n GLY 125 Ca 0.00 0.18 -0.29 0.00 0.00 0.00 0.00 46.02 45.91 1uyi n GLY 125 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uyi s ALA 126 N -3.37 2.37 0.36 4.61 0.00 -0.93 -5.01 121.76 119.80 1uyi s ALA 126 Ca 0.57 -0.40 0.03 0.00 0.00 0.00 0.00 51.96 52.16 1uyi s ALA 126 Cb -0.29 -3.04 -0.04 0.00 0.00 0.00 0.00 23.12 19.75 1uyi s ALA 126 CO 0.84 -1.71 0.11 0.16 0.00 0.00 0.00 175.76 175.15 1uyi s ASP 127 N -4.18 2.39 0.40 0.00 -4.77 -1.26 -4.52 116.67 104.73 1uyi s ASP 127 Ca 0.61 -1.55 0.19 0.00 -3.30 0.00 0.00 52.55 48.51 1uyi s ASP 127 Cb -0.13 0.29 1.13 0.00 -1.09 0.00 0.00 42.92 43.12 1uyi s ASP 127 CO 0.52 -0.81 1.77 0.40 0.70 0.00 0.00 175.17 177.75 1uyi h ILE 128 N 1.98 0.51 0.00 2.11 2.04 -1.99 -2.35 117.51 119.81 1uyi h ILE 128 Ca -0.37 -0.13 0.00 0.00 1.00 0.00 0.00 64.86 65.36 1uyi h ILE 128 Cb 1.26 0.11 0.00 0.00 -0.74 0.00 0.00 36.82 37.45 1uyi h ILE 128 CO 0.60 0.07 0.00 0.77 0.00 0.00 0.00 178.15 179.59 1uyi h SER 129 N 0.37 0.00 -0.17 1.72 4.64 -1.96 -1.49 113.55 116.66 1uyi h SER 129 Ca 0.60 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.92 1uyi h SER 129 Cb 1.55 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.64 1uyi h SER 129 CO -0.29 0.00 0.00 0.23 -0.87 0.00 0.00 176.83 175.90 1uyi n MET 130 N -2.95 1.70 -0.34 4.77 2.81 -0.88 -4.52 117.12 117.71 1uyi n MET 130 Ca -0.02 -1.05 0.20 0.00 -1.81 0.00 0.00 57.70 55.01 1uyi n MET 130 Cb 0.12 -1.38 0.42 0.00 -0.71 0.00 0.00 33.22 31.67 1uyi n MET 130 CO 0.00 0.00 0.00 0.97 1.51 0.00 0.00 175.97 178.45 1uyi h ILE 131 N 2.09 0.47 -0.15 2.02 2.10 -1.44 -2.13 117.51 120.46 1uyi h ILE 131 Ca 0.00 -0.17 0.03 0.00 1.08 0.00 0.00 64.86 65.79 1uyi h ILE 131 Cb 0.46 -0.08 -0.01 0.00 -1.09 0.00 0.00 36.82 36.10 1uyi h ILE 131 CO 0.00 0.09 0.10 1.23 -1.08 0.00 0.00 178.15 178.50 1uyi h GLY 132 N 0.51 0.09 1.96 8.18 0.00 -1.85 -0.98 103.07 110.97 1uyi h GLY 132 Ca 0.67 -0.03 0.00 0.00 0.00 0.00 0.00 47.33 47.97 1uyi h GLY 132 CO -0.50 0.03 0.00 -1.06 0.00 0.00 0.00 176.54 175.01 1uyi n GLN 133 N -4.51 0.01 -0.11 4.80 6.02 -0.80 -2.64 117.38 120.16 1uyi n GLN 133 Ca 0.00 0.30 0.03 0.00 -0.01 0.00 0.00 57.00 57.33 1uyi n GLN 133 Cb 0.18 -1.50 0.09 0.00 1.02 0.00 0.00 30.24 30.02 1uyi n GLN 133 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 1uyi n PHE 134 N -1.48 0.25 -1.48 1.08 3.72 -0.37 -4.99 117.46 114.20 1uyi n PHE 134 Ca 0.03 -0.55 -0.12 0.00 -0.05 0.00 0.00 57.45 56.75 1uyi n PHE 134 Cb 0.12 -0.06 -0.05 0.00 -0.94 0.00 0.00 39.48 38.55 1uyi n PHE 134 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1uyi n GLY 135 N -0.13 1.12 0.20 1.37 0.00 -1.08 -4.36 105.19 102.32 1uyi n GLY 135 Ca 0.07 -0.45 0.06 0.00 0.00 0.00 0.00 46.02 45.71 1uyi n GLY 135 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1uyi n VAL 136 N -2.84 1.19 -0.08 1.61 0.24 -1.25 -4.83 118.33 112.38 1uyi n VAL 136 Ca -0.13 -1.42 0.23 0.00 -2.04 0.00 0.00 64.34 60.99 1uyi n VAL 136 Cb 0.43 0.07 0.69 0.00 -1.47 0.00 0.00 33.84 33.56 1uyi n VAL 136 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 1uyi h GLY 137 N 0.00 0.05 -0.50 7.63 0.00 -1.84 -2.19 103.07 106.21 1uyi h GLY 137 Ca 0.00 -0.01 0.22 0.00 0.00 0.00 0.00 47.33 47.54 1uyi h GLY 137 CO 0.00 0.00 0.15 -2.75 0.00 0.00 0.00 176.54 173.94 1uyi h PHE 138 N 0.02 0.20 0.00 5.60 3.57 -1.88 0.11 116.94 124.56 1uyi h PHE 138 Ca 0.33 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.88 1uyi h PHE 138 Cb 1.28 0.05 0.00 0.00 2.79 0.00 0.00 35.95 40.07 1uyi h PHE 138 CO -0.00 -0.25 0.00 1.88 -2.23 0.00 0.00 178.31 177.71 1uyi h TYR 139 N 0.15 0.00 0.00 0.41 0.05 -1.81 -0.24 116.97 115.54 1uyi h TYR 139 Ca 0.52 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.30 1uyi h TYR 139 Cb 1.03 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.77 1uyi h TYR 139 CO -0.34 0.00 0.00 -1.13 -1.05 0.00 0.00 178.16 175.64 1uyi n SER 140 N -2.39 0.47 -0.26 3.88 3.41 0.39 -1.30 113.62 117.82 1uyi n SER 140 Ca -0.00 0.71 0.24 0.00 -0.26 0.00 0.00 58.87 59.55 1uyi n SER 140 Cb 0.12 -0.77 0.58 0.00 -0.26 0.00 0.00 64.21 63.88 1uyi n SER 140 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1uyi h ALA 141 N 2.04 2.44 0.00 7.33 0.00 -1.20 -1.91 119.26 127.96 1uyi h ALA 141 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1uyi h ALA 141 Cb 0.04 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1uyi h ALA 141 CO 0.00 -0.76 0.00 0.66 0.00 0.00 0.00 179.25 179.15 1uyi n TYR 142 N -4.46 0.00 0.09 0.00 4.01 -0.42 -1.28 117.16 115.10 1uyi n TYR 142 Ca 0.22 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.96 1uyi n TYR 142 Cb 0.86 -0.04 0.30 0.00 -0.31 0.00 0.00 39.34 40.16 1uyi n TYR 142 CO 0.00 0.00 0.00 -0.07 -0.46 0.00 0.00 176.86 176.33 1uyi h LEU 143 N 0.00 0.27 0.00 7.72 3.38 -1.54 -3.38 115.31 121.77 1uyi h LEU 143 Ca 0.00 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1uyi h LEU 143 Cb 0.03 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.71 1uyi h LEU 143 CO 0.00 0.52 -0.23 1.33 0.09 0.00 0.00 178.44 180.15 1uyi n VAL 144 N -4.17 0.00 -4.85 1.22 0.24 -0.91 -5.02 118.33 104.84 1uyi n VAL 144 Ca -0.01 -0.28 -0.33 0.00 -2.04 0.00 0.00 64.34 61.69 1uyi n VAL 144 Cb 0.36 0.82 -0.14 0.00 -1.47 0.00 0.00 33.84 33.40 1uyi n VAL 144 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1uyi s ALA 145 N -1.02 2.57 0.01 2.33 0.00 -0.40 -0.78 121.76 124.48 1uyi s ALA 145 Ca 0.00 -0.91 0.17 0.00 0.00 0.00 0.00 51.96 51.22 1uyi s ALA 145 Cb 0.00 -1.13 0.37 0.00 0.00 0.00 0.00 23.12 22.36 1uyi s ALA 145 CO 0.00 0.30 1.58 1.05 0.00 0.00 0.00 175.76 178.69 1uyi h GLU 146 N 6.52 0.00 -3.07 0.00 4.11 -1.17 -3.41 114.58 117.56 1uyi h GLU 146 Ca -0.28 0.00 -0.14 0.00 0.07 0.00 0.00 59.36 59.01 1uyi h GLU 146 Cb 1.21 0.00 -0.24 0.00 0.50 0.00 0.00 28.75 30.22 1uyi h GLU 146 CO 0.54 0.46 -0.36 0.21 0.07 0.00 0.00 179.01 179.92 1uyi s LYS 147 N -3.27 0.43 -0.08 1.06 2.20 -1.20 -4.51 119.74 114.37 1uyi s LYS 147 Ca 0.02 0.21 0.03 0.00 -0.36 0.00 0.00 55.97 55.86 1uyi s LYS 147 Cb 0.09 0.20 0.01 0.00 -1.51 0.00 0.00 37.83 36.62 1uyi s LYS 147 CO 0.72 -0.08 -0.17 0.08 -0.36 0.00 0.00 175.35 175.54 1uyi s VAL 148 N -0.30 1.49 -0.13 4.02 1.01 -0.63 -0.90 120.40 124.95 1uyi s VAL 148 Ca -0.04 -0.69 -0.00 0.00 0.00 0.00 0.00 61.98 61.25 1uyi s VAL 148 Cb -0.03 -1.32 -0.02 0.00 0.00 0.00 0.00 36.38 35.01 1uyi s VAL 148 CO 0.01 0.43 -0.13 -0.89 0.00 0.00 0.00 175.10 174.53 1uyi s THR 149 N 0.53 3.06 -0.17 3.92 2.01 -0.51 -1.83 115.64 122.63 1uyi s THR 149 Ca -0.16 -0.66 0.01 0.00 0.31 0.00 0.00 61.69 61.19 1uyi s THR 149 Cb -0.17 -2.28 0.01 0.00 0.01 0.00 0.00 72.50 70.08 1uyi s THR 149 CO 0.06 0.53 -0.19 -0.69 -0.69 0.00 0.00 174.62 173.64 1uyi s VAL 150 N 0.32 2.22 -0.11 3.82 1.01 0.11 -0.35 120.40 127.42 1uyi s VAL 150 Ca -0.10 -0.90 0.00 0.00 0.00 0.00 0.00 61.98 60.98 1uyi s VAL 150 Cb -0.16 -1.93 -0.02 0.00 0.00 0.00 0.00 36.38 34.27 1uyi s VAL 150 CO 0.06 0.53 -0.11 -0.63 0.00 0.00 0.00 175.10 174.95 1uyi s ILE 151 N 1.19 3.30 -0.08 2.22 -1.09 0.63 -0.51 121.20 126.86 1uyi s ILE 151 Ca 0.02 -0.59 -0.14 0.00 -2.23 0.00 0.00 60.65 57.70 1uyi s ILE 151 Cb -0.14 -2.37 0.03 0.00 -1.58 0.00 0.00 42.46 38.40 1uyi s ILE 151 CO -0.09 0.54 0.36 0.28 -1.23 0.00 0.00 174.94 174.80 1uyi s THR 152 N -0.03 0.03 -0.14 2.92 -1.32 -0.70 0.12 115.64 116.52 1uyi s THR 152 Ca -0.02 -0.21 -0.04 0.00 -1.21 0.00 0.00 61.69 60.21 1uyi s THR 152 Cb -0.14 -0.58 0.06 0.00 -1.51 0.00 0.00 72.50 70.33 1uyi s THR 152 CO 0.04 -0.12 0.10 -0.75 -2.21 0.00 0.00 174.62 171.68 1uyi s LYS 153 N -0.53 0.04 0.04 7.08 2.47 0.15 -1.50 119.74 127.49 1uyi s LYS 153 Ca -0.06 0.07 -0.08 0.00 -1.56 0.00 0.00 55.97 54.34 1uyi s LYS 153 Cb -0.04 -1.42 -0.05 0.00 -1.46 0.00 0.00 37.83 34.86 1uyi s LYS 153 CO 0.03 -0.58 0.33 -1.58 0.16 0.00 0.00 175.35 173.71 1uyi s HIS 154 N 2.17 3.58 0.33 4.03 5.65 -1.25 -0.68 115.29 129.12 1uyi s HIS 154 Ca 0.03 0.68 0.13 0.00 0.25 0.00 0.00 55.06 56.14 1uyi s HIS 154 Cb -0.15 -2.07 1.04 0.00 -1.18 0.00 0.00 32.58 30.22 1uyi s HIS 154 CO -0.08 0.57 1.65 -0.91 -0.65 0.00 0.00 174.74 175.32 1uyi h ASN 155 N 3.84 0.41 -0.39 9.88 2.35 -1.90 -2.16 115.58 127.61 1uyi h ASN 155 Ca -0.49 0.20 0.00 0.00 -0.55 0.00 0.00 56.30 55.45 1uyi h ASN 155 Cb 1.19 0.17 0.00 0.00 0.05 0.00 0.00 38.32 39.73 1uyi h ASN 155 CO 0.66 -0.16 0.00 0.47 -1.65 0.00 0.00 177.43 176.76 1uyi n ASP 156 N -5.10 2.47 -3.25 5.81 8.00 -1.26 -4.95 116.55 118.27 1uyi n ASP 156 Ca 0.30 -2.10 -0.14 0.00 0.71 0.00 0.00 54.79 53.56 1uyi n ASP 156 Cb 0.95 -0.34 -0.03 0.00 -0.02 0.00 0.00 41.12 41.68 1uyi n ASP 156 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1uyi s ASP 157 N -0.89 0.75 0.75 -2.24 -1.08 -0.81 -5.09 116.67 108.06 1uyi s ASP 157 Ca 0.28 -1.41 -0.12 0.00 -0.52 0.00 0.00 52.55 50.78 1uyi s ASP 157 Cb 0.16 0.68 0.04 0.00 -1.46 0.00 0.00 42.92 42.34 1uyi s ASP 157 CO 0.17 -1.34 1.11 -1.61 0.52 0.00 0.00 175.17 174.02 1uyi s GLU 158 N -3.02 2.48 -0.04 4.34 0.41 -1.26 -4.57 118.70 117.04 1uyi s GLU 158 Ca 0.28 0.45 -0.30 0.00 -0.41 0.00 0.00 54.97 54.99 1uyi s GLU 158 Cb -0.01 -1.98 -0.03 0.00 -1.78 0.00 0.00 34.13 30.33 1uyi s GLU 158 CO 0.19 -1.30 1.10 -1.14 -0.49 0.00 0.00 175.26 173.61 1uyi s GLN 159 N -5.34 4.43 0.25 1.61 0.74 -1.26 -4.43 119.66 115.66 1uyi s GLN 159 Ca 0.60 1.55 0.11 0.00 0.05 0.00 0.00 55.36 57.67 1uyi s GLN 159 Cb -0.12 -3.50 -0.05 0.00 1.10 0.00 0.00 33.01 30.44 1uyi s GLN 159 CO 0.52 -0.30 -0.20 0.71 -0.55 0.00 0.00 175.29 175.48 1uyi s TYR 160 N 1.72 2.17 -0.14 1.67 2.02 -0.56 -0.91 117.35 123.31 1uyi s TYR 160 Ca 0.53 -0.38 0.02 0.00 -0.37 0.00 0.00 57.07 56.87 1uyi s TYR 160 Cb -0.23 -0.98 0.01 0.00 -0.40 0.00 0.00 41.96 40.37 1uyi s TYR 160 CO 0.23 0.60 -0.20 0.00 -1.57 0.00 0.00 175.55 174.61 1uyi s ALA 161 N -2.41 2.18 0.04 3.71 0.00 0.08 -1.72 121.76 123.64 1uyi s ALA 161 Ca 0.26 -1.07 0.00 0.00 0.00 0.00 0.00 51.96 51.16 1uyi s ALA 161 Cb -0.05 -1.02 -0.04 0.00 0.00 0.00 0.00 23.12 22.02 1uyi s ALA 161 CO 0.12 -0.12 0.13 -0.46 0.00 0.00 0.00 175.76 175.44 1uyi s TRP 162 N 0.96 3.37 -0.06 0.00 -0.00 0.33 -1.42 118.94 122.13 1uyi s TRP 162 Ca -0.04 0.21 -0.22 0.00 -0.00 0.00 0.00 56.10 56.05 1uyi s TRP 162 Cb -0.15 -1.73 0.05 0.00 -0.00 0.00 0.00 33.47 31.64 1uyi s TRP 162 CO -0.05 0.57 0.50 -1.21 -0.00 0.00 0.00 176.95 176.77 1uyi s GLU 163 N -2.16 0.82 -0.20 5.86 8.01 -0.30 0.05 118.70 130.77 1uyi s GLU 163 Ca 0.29 0.15 -0.20 0.00 0.01 0.00 0.00 54.97 55.22 1uyi s GLU 163 Cb -0.12 0.38 0.05 0.00 -4.31 0.00 0.00 34.13 30.13 1uyi s GLU 163 CO 0.21 -0.23 0.56 0.45 0.01 0.00 0.00 175.26 176.26 1uyi s SER 164 N -1.00 -0.58 -0.32 -0.19 0.15 -0.76 -0.67 113.70 110.32 1uyi s SER 164 Ca -0.10 1.11 0.10 0.00 0.70 0.00 0.00 55.95 57.75 1uyi s SER 164 Cb -0.03 1.12 0.64 0.00 -1.71 0.00 0.00 66.02 66.04 1uyi s SER 164 CO 0.06 -0.20 1.68 -1.20 1.20 0.00 0.00 173.24 174.78 1uyi n SER 165 N 2.73 3.88 0.00 5.45 7.64 -1.26 -1.61 113.62 130.45 1uyi n SER 165 Ca -0.14 -3.41 0.00 0.00 1.01 0.00 0.00 58.87 56.33 1uyi n SER 165 Cb 0.56 -0.71 0.00 0.00 -1.01 0.00 0.00 64.21 63.06 1uyi n SER 165 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1uyi n ALA 166 N -0.66 0.00 -1.18 -0.43 0.00 -1.26 -4.91 120.51 112.08 1uyi n ALA 166 Ca 0.40 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.78 1uyi n ALA 166 Cb 1.28 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.70 1uyi n ALA 166 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1uyi n GLY 167 N 0.00 0.79 0.14 0.00 0.00 -1.26 -3.85 105.19 101.01 1uyi n GLY 167 Ca 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.72 1uyi n GLY 167 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1uyi n GLY 168 N -1.33 0.24 3.13 -0.02 0.00 -1.26 -5.06 105.19 100.90 1uyi n GLY 168 Ca -0.06 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.87 1uyi n GLY 168 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1uyi s SER 169 N -2.34 0.22 0.07 1.61 1.04 -1.25 -0.96 113.70 112.08 1uyi s SER 169 Ca 0.00 -0.66 0.01 0.00 0.48 0.00 0.00 55.95 55.78 1uyi s SER 169 Cb 0.00 0.25 -0.04 0.00 0.10 0.00 0.00 66.02 66.33 1uyi s SER 169 CO 0.00 -0.59 -0.05 0.72 0.98 0.00 0.00 173.24 174.30 1uyi s PHE 170 N -3.20 0.68 0.23 5.02 -0.12 -0.19 -4.38 117.98 116.02 1uyi s PHE 170 Ca 0.00 -0.89 0.12 0.00 -0.05 0.00 0.00 56.93 56.11 1uyi s PHE 170 Cb 0.02 -0.43 -0.05 0.00 -0.63 0.00 0.00 43.02 41.94 1uyi s PHE 170 CO -0.07 -0.23 -0.22 0.95 -0.05 0.00 0.00 175.22 175.60 1uyi s THR 171 N -3.28 2.41 -0.01 -4.49 -4.23 0.15 -0.45 115.64 105.75 1uyi s THR 171 Ca 0.05 -2.18 0.04 0.00 -1.18 0.00 0.00 61.69 58.42 1uyi s THR 171 Cb 0.03 -2.20 -0.01 0.00 1.34 0.00 0.00 72.50 71.66 1uyi s THR 171 CO -0.06 -0.23 -0.13 -0.69 -0.54 0.00 0.00 174.62 172.97 1uyi s VAL 172 N -2.01 1.06 0.06 2.29 1.01 -0.63 -1.15 120.40 121.03 1uyi s VAL 172 Ca 0.25 -0.57 -0.08 0.00 0.00 0.00 0.00 61.98 61.58 1uyi s VAL 172 Cb -0.07 -0.89 -0.01 0.00 0.00 0.00 0.00 36.38 35.42 1uyi s VAL 172 CO 0.12 0.30 0.15 0.00 0.00 0.00 0.00 175.10 175.67 1uyi s ARG 173 N -0.29 0.72 0.32 2.72 1.70 -0.51 -1.84 118.95 121.77 1uyi s ARG 173 Ca 0.05 -0.83 -0.28 0.00 -0.47 0.00 0.00 55.73 54.19 1uyi s ARG 173 Cb -0.05 0.29 -0.10 0.00 -0.57 0.00 0.00 34.95 34.52 1uyi s ARG 173 CO -0.00 -0.21 1.18 0.95 -1.08 0.00 0.00 175.30 176.14 1uyi s THR 174 N -3.17 3.19 -0.11 4.99 -4.23 -1.26 -0.74 115.64 114.30 1uyi s THR 174 Ca -0.00 1.17 -0.13 0.00 -1.18 0.00 0.00 61.69 61.54 1uyi s THR 174 Cb 0.02 -3.73 -0.05 0.00 1.34 0.00 0.00 72.50 70.08 1uyi s THR 174 CO -0.07 0.25 0.30 -0.62 -0.54 0.00 0.00 174.62 173.94 1uyi s ASP 175 N -0.80 6.53 0.00 3.99 2.15 -0.09 -4.75 116.67 123.70 1uyi s ASP 175 Ca 0.48 0.62 0.12 0.00 0.43 0.00 0.00 52.55 54.20 1uyi s ASP 175 Cb -0.34 -2.18 0.07 0.00 -0.30 0.00 0.00 42.92 40.17 1uyi s ASP 175 CO 0.44 0.20 0.83 0.35 -0.17 0.00 0.00 175.17 176.83 1uyi n THR 176 N 2.88 0.00 -0.09 1.71 -2.24 -1.26 -4.83 114.28 110.44 1uyi n THR 176 Ca -0.14 -0.48 -0.09 0.00 -2.27 0.00 0.00 64.05 61.07 1uyi n THR 176 Cb 0.52 1.22 0.09 0.00 -2.10 0.00 0.00 70.33 70.07 1uyi n THR 176 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1uyi n GLY 177 N 0.72 -3.38 3.68 3.38 0.00 -1.26 -4.86 105.19 103.46 1uyi n GLY 177 Ca 0.06 -1.11 -0.45 0.00 0.00 0.00 0.00 46.02 44.52 1uyi n GLY 177 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1uyi n GLU 178 N -2.81 2.27 -1.86 1.61 4.07 -1.26 -4.92 120.64 117.73 1uyi n GLU 178 Ca 0.04 0.82 -0.41 0.00 -0.06 0.00 0.00 57.16 57.55 1uyi n GLU 178 Cb 0.18 -2.61 -0.01 0.00 -0.06 0.00 0.00 31.44 28.94 1uyi n GLU 178 CO 0.00 0.00 0.00 -2.14 -0.06 0.00 0.00 177.13 174.93 1uyi s PRO 179 N 1.15 4.17 0.00 5.31 0.02 -1.26 -4.94 135.00 139.45 1uyi s PRO 179 Ca 0.79 2.49 0.20 0.00 0.02 0.00 0.00 61.00 64.50 1uyi s PRO 179 Cb -0.65 -3.02 0.01 0.00 0.02 0.00 0.00 34.50 30.86 1uyi s PRO 179 CO 0.38 -0.50 1.02 0.00 -0.33 0.00 0.00 177.00 177.56 1uyi n MET 180 N 1.30 1.44 0.00 5.54 0.00 -1.26 -5.02 117.12 119.12 1uyi n MET 180 Ca 0.04 -1.01 0.00 0.00 0.00 0.00 0.00 57.70 56.73 1uyi n MET 180 Cb 0.39 -1.41 0.00 0.00 0.00 0.00 0.00 33.22 32.21 1uyi n MET 180 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1uyi n GLY 181 N 1.31 1.98 3.64 3.17 0.00 -1.26 -4.75 105.19 109.28 1uyi n GLY 181 Ca 0.09 -0.53 -0.07 0.00 0.00 0.00 0.00 46.02 45.51 1uyi n GLY 181 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1uyi s ARG 182 N 0.00 0.42 0.00 1.61 3.52 -1.24 -4.85 118.95 118.41 1uyi s ARG 182 Ca 0.00 0.56 0.00 0.00 -0.13 0.00 0.00 55.73 56.16 1uyi s ARG 182 Cb 0.00 0.18 0.00 0.00 -1.56 0.00 0.00 34.95 33.57 1uyi s ARG 182 CO 0.00 -0.06 0.00 0.41 -0.81 0.00 0.00 175.30 174.84 1uyi n GLY 183 N 2.55 0.78 2.95 8.12 0.00 0.15 -4.40 105.19 115.33 1uyi n GLY 183 Ca -0.14 -2.06 -0.13 0.00 0.00 0.00 0.00 46.02 43.69 1uyi n GLY 183 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1uyi s THR 184 N -1.66 -0.03 -0.08 2.61 2.01 -0.98 0.34 115.64 117.84 1uyi s THR 184 Ca 0.00 0.11 0.04 0.00 0.31 0.00 0.00 61.69 62.14 1uyi s THR 184 Cb 0.00 -0.21 -0.01 0.00 0.01 0.00 0.00 72.50 72.29 1uyi s THR 184 CO 0.00 0.04 -0.20 -0.54 -0.69 0.00 0.00 174.62 173.23 1uyi s LYS 185 N 0.70 2.86 -0.31 4.92 1.02 0.33 -0.63 119.74 128.63 1uyi s LYS 185 Ca -0.05 -0.82 -0.03 0.00 0.02 0.00 0.00 55.97 55.09 1uyi s LYS 185 Cb -0.07 -2.34 0.05 0.00 -0.52 0.00 0.00 37.83 34.95 1uyi s LYS 185 CO -0.03 0.33 0.02 0.08 -0.92 0.00 0.00 175.35 174.83 1uyi s VAL 186 N -0.01 3.14 -0.34 3.17 1.01 0.10 -0.27 120.40 127.21 1uyi s VAL 186 Ca -0.07 -1.35 -0.14 0.00 0.00 0.00 0.00 61.98 60.43 1uyi s VAL 186 Cb -0.15 -2.80 -0.02 0.00 0.00 0.00 0.00 36.38 33.41 1uyi s VAL 186 CO 0.05 -0.13 0.30 -0.63 0.00 0.00 0.00 175.10 174.69 1uyi s ILE 187 N 1.28 5.23 -0.45 2.22 1.01 0.53 -1.02 121.20 129.99 1uyi s ILE 187 Ca -0.04 -0.06 -0.16 0.00 0.00 0.00 0.00 60.65 60.38 1uyi s ILE 187 Cb -0.20 -3.77 0.04 0.00 0.01 0.00 0.00 42.46 38.55 1uyi s ILE 187 CO -0.00 -0.04 0.40 -0.76 0.00 0.00 0.00 174.94 174.54 1uyi s LEU 188 N 1.88 5.24 -0.72 2.97 1.43 0.23 -1.43 118.68 128.27 1uyi s LEU 188 Ca 0.09 -1.02 -0.27 0.00 -1.03 0.00 0.00 54.13 51.91 1uyi s LEU 188 Cb -0.17 -2.25 0.02 0.00 0.03 0.00 0.00 46.19 43.82 1uyi s LEU 188 CO 0.11 -0.61 1.36 -1.00 0.23 0.00 0.00 176.35 176.45 1uyi s HIS 189 N 1.88 2.19 0.44 0.29 3.76 -0.08 -1.80 115.29 121.97 1uyi s HIS 189 Ca 0.07 0.06 -0.24 0.00 -0.15 0.00 0.00 55.06 54.81 1uyi s HIS 189 Cb -0.21 -4.55 -0.08 0.00 1.11 0.00 0.00 32.58 28.85 1uyi s HIS 189 CO 0.10 -2.11 1.18 -0.51 -0.85 0.00 0.00 174.74 172.54 1uyi s LEU 190 N 6.21 4.07 0.85 0.89 1.43 -0.75 -0.74 118.68 130.65 1uyi s LEU 190 Ca 0.40 2.34 -0.12 0.00 -1.03 0.00 0.00 54.13 55.72 1uyi s LEU 190 Cb -0.09 -4.16 0.11 0.00 0.03 0.00 0.00 46.19 42.08 1uyi s LEU 190 CO 0.16 -0.86 1.19 0.29 0.23 0.00 0.00 176.35 177.35 1uyi n LYS 191 N -0.31 -0.06 0.10 1.70 5.02 0.04 -4.54 118.16 120.12 1uyi n LYS 191 Ca 0.06 0.06 0.02 0.00 -2.02 0.00 0.00 58.31 56.43 1uyi n LYS 191 Cb 0.47 -2.42 0.36 0.00 -0.02 0.00 0.00 35.03 33.43 1uyi n LYS 191 CO 0.00 0.00 0.00 1.49 -0.52 0.00 0.00 177.40 178.37 1uyi h GLU 192 N -1.28 0.26 -0.62 1.97 4.81 -1.95 -1.65 114.58 116.13 1uyi h GLU 192 Ca -0.45 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 58.71 1uyi h GLU 192 Cb 1.29 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.63 1uyi h GLU 192 CO 0.44 0.42 0.00 -0.40 -0.73 0.00 0.00 179.01 178.74 1uyi n ASP 193 N -4.25 3.14 -0.52 1.04 5.75 -1.26 -4.12 116.55 116.33 1uyi n ASP 193 Ca -0.01 -2.32 0.07 0.00 -0.01 0.00 0.00 54.79 52.52 1uyi n ASP 193 Cb 0.29 -0.48 0.18 0.00 -1.03 0.00 0.00 41.12 40.09 1uyi n ASP 193 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1uyi n GLN 194 N 0.52 1.43 0.00 0.11 1.13 -0.62 -4.79 117.38 115.16 1uyi n GLN 194 Ca 0.15 -3.06 0.11 0.00 -1.94 0.00 0.00 57.00 52.27 1uyi n GLN 194 Cb 0.62 -1.51 0.53 0.00 0.11 0.00 0.00 30.24 29.99 1uyi n GLN 194 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 1uyi n THR 195 N -1.11 0.36 0.18 5.09 -2.24 -1.26 -2.78 114.28 112.53 1uyi n THR 195 Ca 0.17 0.09 0.17 0.00 -2.27 0.00 0.00 64.05 62.21 1uyi n THR 195 Cb 0.70 -0.72 0.80 0.00 -2.10 0.00 0.00 70.33 69.00 1uyi n THR 195 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 1uyi h GLU 196 N 0.00 0.00 -0.00 -0.78 4.11 -1.94 0.16 114.58 116.13 1uyi h GLU 196 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1uyi h GLU 196 Cb 0.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.50 1uyi h GLU 196 CO 0.00 0.00 -0.00 0.66 0.07 0.00 0.00 179.01 179.74 1uyi n TYR 197 N -3.92 0.00 1.12 2.06 4.01 -1.12 -1.35 117.16 117.96 1uyi n TYR 197 Ca 0.02 0.00 0.13 0.00 -0.16 0.00 0.00 57.90 57.89 1uyi n TYR 197 Cb 0.35 -0.01 0.37 0.00 -0.31 0.00 0.00 39.34 39.73 1uyi n TYR 197 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 1uyi n LEU 198 N -0.89 0.59 -4.72 7.72 4.77 0.55 -4.82 117.00 120.20 1uyi n LEU 198 Ca 0.23 -0.02 -0.39 0.00 -0.03 0.00 0.00 56.01 55.80 1uyi n LEU 198 Cb 0.14 -0.23 -0.05 0.00 -2.33 0.00 0.00 43.42 40.95 1uyi n LEU 198 CO 0.18 0.13 0.31 -1.61 -1.33 0.00 0.00 177.39 175.07 1uyi s GLU 199 N -2.80 4.40 0.16 3.23 2.02 -0.46 -4.88 118.70 120.37 1uyi s GLU 199 Ca 0.17 0.71 -0.20 0.00 0.02 0.00 0.00 54.97 55.67 1uyi s GLU 199 Cb 0.18 -3.45 0.06 0.00 0.10 0.00 0.00 34.13 31.03 1uyi s GLU 199 CO 0.61 0.09 1.64 1.49 0.02 0.00 0.00 175.26 179.11 1uyi h GLU 200 N 6.76 -0.15 -0.24 1.61 4.81 -1.92 -1.29 114.58 124.16 1uyi h GLU 200 Ca -0.41 0.01 -0.08 0.00 -0.13 0.00 0.00 59.36 58.75 1uyi h GLU 200 Cb 1.19 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.59 1uyi h GLU 200 CO 0.75 -0.10 -0.19 0.07 -0.73 0.00 0.00 179.01 178.81 1uyi h ARG 201 N -0.15 0.43 -0.07 1.92 0.11 -1.94 -0.36 114.38 114.32 1uyi h ARG 201 Ca 0.16 -0.14 -0.01 0.00 0.10 0.00 0.00 59.98 60.09 1uyi h ARG 201 Cb 0.40 -0.04 -0.00 0.00 1.11 0.00 0.00 29.97 31.44 1uyi h ARG 201 CO -0.40 0.61 0.00 -0.09 0.10 0.00 0.00 179.97 180.19 1uyi h ARG 202 N 0.39 0.13 -0.15 0.08 9.65 -1.74 -1.14 114.38 121.59 1uyi h ARG 202 Ca 0.07 -0.04 -0.00 0.00 -1.10 0.00 0.00 59.98 58.90 1uyi h ARG 202 Cb 0.57 -0.01 -0.01 0.00 -1.39 0.00 0.00 29.97 29.13 1uyi h ARG 202 CO 0.04 0.38 0.08 0.82 2.80 0.00 0.00 179.97 184.08 1uyi h ILE 203 N -0.14 1.11 -0.52 1.20 1.08 -0.87 -1.59 117.51 117.77 1uyi h ILE 203 Ca 0.02 -0.31 0.08 0.00 -0.39 0.00 0.00 64.86 64.26 1uyi h ILE 203 Cb 0.32 1.04 -0.06 0.00 -3.07 0.00 0.00 36.82 35.05 1uyi h ILE 203 CO 0.00 0.10 0.18 0.11 -0.69 0.00 0.00 178.15 177.85 1uyi h LYS 204 N 0.13 0.34 -0.43 2.37 1.57 -1.08 0.23 116.57 119.69 1uyi h LYS 204 Ca 0.05 -0.02 0.07 0.00 -1.87 0.00 0.00 60.65 58.88 1uyi h LYS 204 Cb 0.09 -0.08 -0.06 0.00 0.08 0.00 0.00 32.23 32.27 1uyi h LYS 204 CO -0.01 0.22 0.10 1.49 -0.57 0.00 0.00 179.45 180.68 1uyi h GLU 205 N 0.35 0.23 0.04 3.15 4.81 -0.95 -0.81 114.58 121.39 1uyi h GLU 205 Ca 0.26 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.47 1uyi h GLU 205 Cb 0.29 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.62 1uyi h GLU 205 CO -0.27 0.15 -0.02 0.82 -0.73 0.00 0.00 179.01 178.96 1uyi h ILE 206 N 0.23 1.21 -0.24 2.32 2.04 -0.60 -2.22 117.51 120.26 1uyi h ILE 206 Ca 0.21 -0.84 0.05 0.00 1.00 0.00 0.00 64.86 65.29 1uyi h ILE 206 Cb 0.25 1.77 -0.06 0.00 -0.74 0.00 0.00 36.82 38.05 1uyi h ILE 206 CO -0.27 0.21 -0.12 0.58 0.00 0.00 0.00 178.15 178.56 1uyi h VAL 207 N -0.42 0.63 -0.93 1.67 2.07 -0.94 -0.89 116.25 117.44 1uyi h VAL 207 Ca -0.01 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.67 1uyi h VAL 207 Cb 0.39 0.63 -0.10 0.00 -1.52 0.00 0.00 31.29 30.69 1uyi h VAL 207 CO 0.01 0.00 0.52 0.50 0.02 0.00 0.00 177.57 178.62 1uyi h LYS 208 N -0.09 0.70 0.10 1.57 3.64 -1.15 0.18 116.57 121.52 1uyi h LYS 208 Ca 0.13 -0.04 -0.27 0.00 -1.27 0.00 0.00 60.65 59.19 1uyi h LYS 208 Cb 0.28 -0.16 0.01 0.00 -0.41 0.00 0.00 32.23 31.96 1uyi h LYS 208 CO -0.30 0.46 -1.17 -0.22 -2.27 0.00 0.00 179.45 175.95 1uyi h LYS 209 N 0.72 0.45 0.00 1.90 3.64 -0.82 -3.37 116.57 119.08 1uyi h LYS 209 Ca 0.51 -0.61 0.00 0.00 -1.27 0.00 0.00 60.65 59.28 1uyi h LYS 209 Cb 0.73 0.21 0.00 0.00 -0.41 0.00 0.00 32.23 32.75 1uyi h LYS 209 CO -0.36 1.25 -0.43 0.72 -2.27 0.00 0.00 179.45 178.36 1uyi n HIS 210 N -3.69 0.00 -2.05 1.91 8.25 -0.39 -4.81 115.22 114.44 1uyi n HIS 210 Ca -0.10 0.00 0.02 0.00 -0.26 0.00 0.00 57.72 57.38 1uyi n HIS 210 Cb 0.96 -0.02 0.03 0.00 1.12 0.00 0.00 29.99 32.08 1uyi n HIS 210 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 1uyi n SER 211 N -1.23 0.56 0.30 0.41 7.64 0.62 -4.90 113.62 117.02 1uyi n SER 211 Ca 0.00 -2.17 0.19 0.00 1.01 0.00 0.00 58.87 57.90 1uyi n SER 211 Cb 0.07 -0.26 0.84 0.00 -1.01 0.00 0.00 64.21 63.85 1uyi n SER 211 CO 0.00 0.00 0.00 0.06 -3.01 0.00 0.00 175.04 172.09 1uyi h GLN 212 N 0.33 0.00 -0.30 1.43 -0.00 -1.67 -3.20 115.11 111.70 1uyi h GLN 212 Ca -0.07 0.00 -0.06 0.00 -0.00 0.00 0.00 58.65 58.52 1uyi h GLN 212 Cb 1.49 0.00 -0.04 0.00 -0.00 0.00 0.00 27.48 28.93 1uyi h GLN 212 CO 0.03 0.01 0.00 1.19 -0.00 0.00 0.00 178.83 180.06 1uyi n PHE 213 N -3.11 1.03 -1.98 0.06 3.72 -1.26 -5.01 117.46 110.91 1uyi n PHE 213 Ca -0.01 -1.10 -0.41 0.00 -0.05 0.00 0.00 57.45 55.88 1uyi n PHE 213 Cb 0.24 -0.38 -0.02 0.00 -0.94 0.00 0.00 39.48 38.37 1uyi n PHE 213 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 1uyi s ILE 214 N -2.96 2.59 0.00 4.37 -1.09 -1.21 -4.91 121.20 117.99 1uyi s ILE 214 Ca 0.43 0.49 0.00 0.00 -2.23 0.00 0.00 60.65 59.34 1uyi s ILE 214 Cb 0.36 -3.31 0.00 0.00 -1.58 0.00 0.00 42.46 37.93 1uyi s ILE 214 CO 0.06 0.07 1.29 0.61 -1.23 0.00 0.00 174.94 175.75 1uyi n GLY 215 N 2.31 2.06 3.30 6.18 0.00 -1.26 -4.77 105.19 113.02 1uyi n GLY 215 Ca 0.07 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.95 1uyi n GLY 215 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1uyi s TYR 216 N 0.08 -0.29 0.20 1.61 2.02 -1.26 -5.08 117.35 114.63 1uyi s TYR 216 Ca 0.00 0.49 -0.31 0.00 -0.37 0.00 0.00 57.07 56.88 1uyi s TYR 216 Cb 0.00 0.16 -0.10 0.00 -0.40 0.00 0.00 41.96 41.63 1uyi s TYR 216 CO 0.00 -0.42 1.47 -2.14 -1.57 0.00 0.00 175.55 172.89 1uyi s PRO 217 N -1.21 4.26 -0.27 -1.71 0.02 -1.26 -4.88 135.00 129.95 1uyi s PRO 217 Ca -0.12 2.28 -0.05 0.00 0.02 0.00 0.00 61.00 63.13 1uyi s PRO 217 Cb -0.04 -3.14 0.01 0.00 0.02 0.00 0.00 34.50 31.34 1uyi s PRO 217 CO 0.05 -0.48 0.03 0.42 -0.33 0.00 0.00 177.00 176.70 1uyi s ILE 218 N 0.52 3.70 -0.27 2.83 1.01 -1.26 -1.69 121.20 126.04 1uyi s ILE 218 Ca 0.63 -0.68 -0.10 0.00 0.00 0.00 0.00 60.65 60.51 1uyi s ILE 218 Cb -0.42 -2.85 -0.04 0.00 0.01 0.00 0.00 42.46 39.16 1uyi s ILE 218 CO 0.37 0.18 0.16 -0.89 0.00 0.00 0.00 174.94 174.76 1uyi s THR 219 N 1.47 5.02 -0.46 2.92 2.01 -0.30 -4.99 115.64 121.30 1uyi s THR 219 Ca 0.03 0.05 -0.25 0.00 0.31 0.00 0.00 61.69 61.83 1uyi s THR 219 Cb -0.16 -3.39 0.03 0.00 0.01 0.00 0.00 72.50 68.98 1uyi s THR 219 CO 0.00 0.26 0.88 -0.22 -0.69 0.00 0.00 174.62 174.85 1uyi s LEU 220 N 1.72 4.09 0.55 4.42 2.96 -1.26 -0.26 118.68 130.89 1uyi s LEU 220 Ca 0.07 0.01 -0.19 0.00 -0.22 0.00 0.00 54.13 53.80 1uyi s LEU 220 Cb -0.16 -3.10 -0.05 0.00 0.50 0.00 0.00 46.19 43.38 1uyi s LEU 220 CO 0.09 -1.02 1.10 -0.36 -1.32 0.00 0.00 176.35 174.84 1uyi s PHE 221 N 3.62 2.75 0.25 5.38 0.40 0.18 -4.96 117.98 125.61 1uyi s PHE 221 Ca 0.34 1.55 0.08 0.00 -0.60 0.00 0.00 56.93 58.30 1uyi s PHE 221 Cb -0.11 -3.21 -0.04 0.00 0.51 0.00 0.00 43.02 40.18 1uyi s PHE 221 CO 0.25 -1.40 0.16 0.14 0.70 0.00 0.00 175.22 175.06 1uyi s VAL 222 N -1.94 4.25 0.10 -0.44 -7.23 -1.26 -4.58 120.40 109.30 1uyi s VAL 222 Ca 0.70 -1.50 0.02 0.00 -1.81 0.00 0.00 61.98 59.39 1uyi s VAL 222 Cb -0.21 -3.29 -0.04 0.00 0.56 0.00 0.00 36.38 33.40 1uyi s VAL 222 CO 0.28 -0.35 0.21 -1.61 -0.31 0.00 0.00 175.10 173.32 1uyi s GLU 223 N -3.80 3.33 0.00 4.82 2.02 -1.26 -5.00 118.70 118.81 1uyi s GLU 223 Ca 0.33 -0.56 0.00 0.00 0.02 0.00 0.00 54.97 54.75 1uyi s GLU 223 Cb -0.08 -2.94 0.00 0.00 0.10 0.00 0.00 34.13 31.21 1uyi s GLU 223 CO 0.24 0.56 0.00 1.17 0.02 0.00 0.00 175.26 177.25