#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uyg s VAL 17 N 0.00 4.91 -0.06 3.84 1.01 -1.26 -4.58 120.40 124.25 1uyg s VAL 17 Ca 0.00 0.03 -0.16 0.00 0.00 0.00 0.00 61.98 61.85 1uyg s VAL 17 Cb 0.00 -3.31 -0.05 0.00 0.00 0.00 0.00 36.38 33.02 1uyg s VAL 17 CO 0.00 0.31 0.42 -1.61 0.00 0.00 0.00 175.10 174.22 1uyg s GLU 18 N 1.53 4.13 -0.15 2.72 2.02 -0.78 -4.97 118.70 123.20 1uyg s GLU 18 Ca 0.06 0.40 -0.04 0.00 0.02 0.00 0.00 54.97 55.42 1uyg s GLU 18 Cb -0.15 -3.33 -0.03 0.00 0.10 0.00 0.00 34.13 30.72 1uyg s GLU 18 CO 0.07 0.44 -0.03 0.99 0.02 0.00 0.00 175.26 176.75 1uyg s THR 19 N -0.26 3.96 0.15 3.63 2.01 -1.26 -1.10 115.64 122.76 1uyg s THR 19 Ca 0.24 -0.34 0.09 0.00 0.31 0.00 0.00 61.69 61.99 1uyg s THR 19 Cb -0.16 -2.73 -0.04 0.00 0.01 0.00 0.00 72.50 69.58 1uyg s THR 19 CO 0.11 0.50 -0.20 -0.36 -0.69 0.00 0.00 174.62 173.99 1uyg s PHE 20 N 0.23 1.85 -0.03 4.92 0.40 0.11 -4.98 117.98 120.47 1uyg s PHE 20 Ca -0.02 -0.45 -0.20 0.00 -0.60 0.00 0.00 56.93 55.67 1uyg s PHE 20 Cb -0.14 -0.95 -0.05 0.00 0.51 0.00 0.00 43.02 42.39 1uyg s PHE 20 CO 0.03 0.31 0.57 0.00 0.70 0.00 0.00 175.22 176.82 1uyg s ALA 21 N -1.75 3.48 0.58 5.36 0.00 -1.26 -1.11 121.76 127.07 1uyg s ALA 21 Ca 0.13 -0.03 -0.20 0.00 0.00 0.00 0.00 51.96 51.86 1uyg s ALA 21 Cb -0.07 -2.72 -0.03 0.00 0.00 0.00 0.00 23.12 20.30 1uyg s ALA 21 CO 0.06 0.13 1.33 -0.06 0.00 0.00 0.00 175.76 177.22 1uyg s PHE 22 N 0.01 2.21 0.28 0.00 0.08 -0.87 -4.92 117.98 114.78 1uyg s PHE 22 Ca 0.30 1.42 -0.29 0.00 0.12 0.00 0.00 56.93 58.47 1uyg s PHE 22 Cb -0.17 -3.76 -0.13 0.00 -0.57 0.00 0.00 43.02 38.39 1uyg s PHE 22 CO 0.15 -2.90 1.22 1.04 -0.10 0.00 0.00 175.22 174.64 1uyg n GLN 23 N -1.36 1.77 -0.31 0.44 1.13 -1.26 -4.75 117.38 113.03 1uyg n GLN 23 Ca 0.12 0.62 0.16 0.00 -1.94 0.00 0.00 57.00 55.96 1uyg n GLN 23 Cb 0.46 -2.15 0.34 0.00 0.11 0.00 0.00 30.24 29.00 1uyg n GLN 23 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1uyg h ALA 24 N 2.91 1.51 -0.92 -1.58 0.00 -1.98 -0.70 119.26 118.50 1uyg h ALA 24 Ca -0.43 0.18 0.01 0.00 0.00 0.00 0.00 54.91 54.67 1uyg h ALA 24 Cb 1.30 0.19 -0.05 0.00 0.00 0.00 0.00 17.79 19.24 1uyg h ALA 24 CO 0.66 -0.42 0.61 0.93 0.00 0.00 0.00 179.25 181.03 1uyg h GLU 25 N 0.34 1.19 -0.31 0.00 3.07 -1.96 -1.04 114.58 115.87 1uyg h GLU 25 Ca 0.60 -0.07 -0.17 0.00 -0.50 0.00 0.00 59.36 59.22 1uyg h GLU 25 Cb 1.21 -0.27 -0.00 0.00 -0.84 0.00 0.00 28.75 28.85 1uyg h GLU 25 CO -0.58 0.79 -0.46 0.82 -1.40 0.00 0.00 179.01 178.18 1uyg h ILE 26 N 1.23 1.28 -0.61 3.13 1.08 -1.51 -0.66 117.51 121.45 1uyg h ILE 26 Ca 0.34 -1.64 -0.03 0.00 -0.39 0.00 0.00 64.86 63.14 1uyg h ILE 26 Cb -0.12 1.57 -0.03 0.00 -3.07 0.00 0.00 36.82 35.18 1uyg h ILE 26 CO -0.08 0.54 0.26 0.00 -0.69 0.00 0.00 178.15 178.18 1uyg h ALA 27 N 0.70 0.79 -0.05 1.87 0.00 -1.20 0.90 119.26 122.27 1uyg h ALA 27 Ca 0.03 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 54.80 1uyg h ALA 27 Cb 1.06 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 1uyg h ALA 27 CO 0.11 0.39 -0.03 0.37 0.00 0.00 0.00 179.25 180.09 1uyg h GLN 28 N 0.85 -0.03 -0.20 0.00 4.15 -1.04 -1.52 115.11 117.33 1uyg h GLN 28 Ca 0.21 0.00 0.04 0.00 0.77 0.00 0.00 58.65 59.67 1uyg h GLN 28 Cb 0.17 0.01 -0.04 0.00 0.21 0.00 0.00 27.48 27.83 1uyg h GLN 28 CO -0.02 -0.02 -0.07 1.25 -1.93 0.00 0.00 178.83 178.04 1uyg h LEU 29 N -0.03 -0.25 -0.76 -2.39 5.85 -0.84 -0.55 115.31 116.35 1uyg h LEU 29 Ca 0.03 0.07 0.11 0.00 0.84 0.00 0.00 57.88 58.93 1uyg h LEU 29 Cb 0.07 0.15 -0.08 0.00 0.37 0.00 0.00 40.66 41.17 1uyg h LEU 29 CO -0.07 -0.10 0.38 0.24 -0.34 0.00 0.00 178.44 178.56 1uyg h MET 30 N -0.04 0.60 -0.37 1.25 2.86 -0.67 -0.50 114.93 118.05 1uyg h MET 30 Ca 0.10 -0.04 -0.13 0.00 -2.06 0.00 0.00 59.70 57.58 1uyg h MET 30 Cb 0.19 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 31.70 1uyg h MET 30 CO -0.22 0.40 -0.28 0.77 1.06 0.00 0.00 176.91 178.63 1uyg h SER 31 N 0.62 0.80 -0.40 1.22 0.02 -0.88 -1.27 113.55 113.66 1uyg h SER 31 Ca 0.39 -0.31 0.04 0.00 -0.84 0.00 0.00 61.79 61.06 1uyg h SER 31 Cb 0.45 -0.22 -0.04 0.00 0.14 0.00 0.00 62.40 62.73 1uyg h SER 31 CO -0.30 1.03 0.18 0.25 -1.14 0.00 0.00 176.83 176.86 1uyg h LEU 32 N 0.67 0.25 -0.47 5.07 5.85 -0.34 0.19 115.31 126.52 1uyg h LEU 32 Ca 0.08 0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.82 1uyg h LEU 32 Cb 0.81 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.80 1uyg h LEU 32 CO 0.07 0.18 0.28 0.40 -0.34 0.00 0.00 178.44 179.03 1uyg h ILE 33 N 0.37 1.15 -0.55 4.05 2.04 -0.71 -0.56 117.51 123.30 1uyg h ILE 33 Ca 0.17 -0.34 -0.08 0.00 1.00 0.00 0.00 64.86 65.60 1uyg h ILE 33 Cb 0.10 0.53 -0.02 0.00 -0.74 0.00 0.00 36.82 36.69 1uyg h ILE 33 CO -0.14 0.15 0.01 0.40 0.00 0.00 0.00 178.15 178.58 1uyg h ILE 34 N 0.63 1.26 0.09 -0.67 2.04 -1.10 -3.38 117.51 116.38 1uyg h ILE 34 Ca 0.17 -1.10 -0.33 0.00 1.00 0.00 0.00 64.86 64.61 1uyg h ILE 34 Cb 0.00 0.88 -0.02 0.00 -0.74 0.00 0.00 36.82 36.94 1uyg h ILE 34 CO -0.03 0.39 -1.77 0.78 0.00 0.00 0.00 178.15 177.52 1uyg h ASN 35 N 0.84 0.30 -3.06 1.72 2.35 -0.40 -3.47 115.58 113.87 1uyg h ASN 35 Ca 0.16 -0.57 -0.53 0.00 -0.55 0.00 0.00 56.30 54.81 1uyg h ASN 35 Cb 0.52 -0.10 0.06 0.00 0.05 0.00 0.00 38.32 38.85 1uyg h ASN 35 CO 0.03 1.50 0.87 -0.89 -1.65 0.00 0.00 177.43 177.29 1uyg s THR 36 N -2.59 2.41 -0.08 2.81 2.01 -0.24 -4.97 115.64 115.00 1uyg s THR 36 Ca -0.13 0.32 -0.30 0.00 0.31 0.00 0.00 61.69 61.89 1uyg s THR 36 Cb 0.07 -3.20 -0.05 0.00 0.01 0.00 0.00 72.50 69.33 1uyg s THR 36 CO 0.81 0.04 1.65 0.12 -0.69 0.00 0.00 174.62 176.55 1uyg s PHE 37 N 0.60 2.01 -0.30 4.92 5.36 -1.26 -4.97 117.98 124.34 1uyg s PHE 37 Ca 0.66 0.27 0.01 0.00 -0.96 0.00 0.00 56.93 56.92 1uyg s PHE 37 Cb -0.45 -3.91 0.19 0.00 -0.34 0.00 0.00 43.02 38.51 1uyg s PHE 37 CO 0.38 -3.66 0.61 -0.47 -1.46 0.00 0.00 175.22 170.62 1uyg s TYR 38 N 4.27 -1.65 -0.21 10.12 5.04 -1.26 -5.06 117.35 128.59 1uyg s TYR 38 Ca 0.73 1.49 0.19 0.00 -2.44 0.00 0.00 57.07 57.03 1uyg s TYR 38 Cb -0.32 0.48 0.27 0.00 0.35 0.00 0.00 41.96 42.74 1uyg s TYR 38 CO 0.29 -0.93 1.55 0.77 -1.34 0.00 0.00 175.55 175.90 1uyg h SER 39 N 7.99 0.00 -0.21 4.32 0.02 -2.03 -3.37 113.55 120.27 1uyg h SER 39 Ca -0.16 0.00 -0.50 0.00 -0.84 0.00 0.00 61.79 60.29 1uyg h SER 39 Cb 1.17 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 63.67 1uyg h SER 39 CO 0.21 0.30 1.99 -3.20 -1.14 0.00 0.00 176.83 175.00 1uyg n ASN 40 N -3.20 7.32 0.26 3.07 4.05 -1.26 -4.64 115.26 120.87 1uyg n ASN 40 Ca 0.02 -2.65 0.13 0.00 0.45 0.00 0.00 54.58 52.53 1uyg n ASN 40 Cb 0.63 -1.47 0.72 0.00 1.23 0.00 0.00 39.78 40.89 1uyg n ASN 40 CO 0.00 0.00 0.00 0.11 -3.05 0.00 0.00 177.26 174.32 1uyg h LYS 41 N 4.12 0.00 0.00 1.20 1.57 -1.96 -3.27 116.57 118.23 1uyg h LYS 41 Ca 0.59 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.37 1uyg h LYS 41 Cb 0.74 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.05 1uyg h LYS 41 CO 1.15 0.12 0.00 1.05 -0.57 0.00 0.00 179.45 181.20 1uyg h GLU 42 N 0.00 0.00 0.00 3.15 4.11 -1.97 -2.04 114.58 117.83 1uyg h GLU 42 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1uyg h GLU 42 Cb 0.35 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.60 1uyg h GLU 42 CO 0.02 0.00 0.00 0.44 0.07 0.00 0.00 179.01 179.54 1uyg n ILE 43 N -2.57 1.12 -0.35 -1.06 -6.64 -1.24 -2.36 119.36 106.26 1uyg n ILE 43 Ca -0.02 0.38 0.11 0.00 -1.77 0.00 0.00 62.75 61.45 1uyg n ILE 43 Cb 0.06 -1.29 0.29 0.00 -1.44 0.00 0.00 39.64 37.26 1uyg n ILE 43 CO 0.00 0.00 0.00 2.19 -1.77 0.00 0.00 176.55 176.97 1uyg h PHE 44 N 0.00 1.09 -0.21 4.28 -0.00 -1.63 -2.65 116.94 117.82 1uyg h PHE 44 Ca 0.00 0.03 -0.08 0.00 -0.00 0.00 0.00 57.97 57.93 1uyg h PHE 44 Cb 0.20 -0.34 -0.00 0.00 -0.00 0.00 0.00 35.95 35.81 1uyg h PHE 44 CO 0.00 0.33 -0.16 1.25 -0.00 0.00 0.00 178.31 179.73 1uyg h LEU 45 N 0.85 0.51 -1.52 2.10 5.85 -1.74 -2.11 115.31 119.26 1uyg h LEU 45 Ca 0.54 -0.45 -0.05 0.00 0.84 0.00 0.00 57.88 58.76 1uyg h LEU 45 Cb 0.73 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.61 1uyg h LEU 45 CO -0.33 0.85 -0.24 0.08 -0.34 0.00 0.00 178.44 178.46 1uyg h ARG 46 N 0.17 0.00 -0.41 1.25 0.11 -1.68 -1.67 114.38 112.15 1uyg h ARG 46 Ca 0.04 0.00 -0.02 0.00 0.10 0.00 0.00 59.98 60.10 1uyg h ARG 46 Cb 0.69 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.75 1uyg h ARG 46 CO 0.04 0.24 0.17 0.93 0.10 0.00 0.00 179.97 181.46 1uyg h GLU 47 N 0.00 0.61 -0.03 0.08 4.39 -1.10 -1.08 114.58 117.45 1uyg h GLU 47 Ca -0.00 -0.11 -0.20 0.00 0.34 0.00 0.00 59.36 59.39 1uyg h GLU 47 Cb 0.44 -0.10 -0.00 0.00 -0.10 0.00 0.00 28.75 28.99 1uyg h GLU 47 CO 0.03 0.56 -0.84 -0.07 -1.16 0.00 0.00 179.01 177.53 1uyg h LEU 48 N 0.52 0.48 -0.82 1.33 3.38 -1.08 -1.93 115.31 117.19 1uyg h LEU 48 Ca 0.14 -0.36 -0.08 0.00 0.09 0.00 0.00 57.88 57.67 1uyg h LEU 48 Cb 0.18 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 1uyg h LEU 48 CO -0.01 1.13 0.01 0.40 0.09 0.00 0.00 178.44 180.06 1uyg h ILE 49 N 0.24 1.25 -0.53 1.22 2.04 -1.28 -1.31 117.51 119.14 1uyg h ILE 49 Ca -0.05 -1.05 -0.09 0.00 1.00 0.00 0.00 64.86 64.66 1uyg h ILE 49 Cb 1.45 0.84 -0.02 0.00 -0.74 0.00 0.00 36.82 38.35 1uyg h ILE 49 CO 0.14 0.38 -0.03 -1.28 0.00 0.00 0.00 178.15 177.36 1uyg h SER 50 N 0.83 0.94 -0.89 1.72 0.87 -1.10 0.26 113.55 116.18 1uyg h SER 50 Ca 0.16 -0.32 0.02 0.00 -1.23 0.00 0.00 61.79 60.41 1uyg h SER 50 Cb 0.48 -0.25 -0.05 0.00 -0.44 0.00 0.00 62.40 62.14 1uyg h SER 50 CO 0.02 1.04 0.59 0.78 -0.53 0.00 0.00 176.83 178.73 1uyg h ASN 51 N 0.82 1.01 -0.36 6.23 2.35 -1.16 -0.72 115.58 123.75 1uyg h ASN 51 Ca 0.15 -0.02 -0.03 0.00 -0.55 0.00 0.00 56.30 55.84 1uyg h ASN 51 Cb 0.57 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.68 1uyg h ASN 51 CO 0.03 0.72 0.10 0.28 -1.65 0.00 0.00 177.43 176.91 1uyg h SER 52 N 1.19 0.54 -0.35 5.81 0.02 -0.88 -2.26 113.55 117.63 1uyg h SER 52 Ca 0.34 -0.22 0.02 0.00 -0.84 0.00 0.00 61.79 61.08 1uyg h SER 52 Cb -0.10 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 62.28 1uyg h SER 52 CO -0.08 0.62 0.20 -1.28 -1.14 0.00 0.00 176.83 175.14 1uyg h SER 53 N 0.44 0.32 -0.67 3.07 0.87 -0.63 0.12 113.55 117.06 1uyg h SER 53 Ca 0.12 0.01 0.06 0.00 -1.23 0.00 0.00 61.79 60.74 1uyg h SER 53 Cb 0.28 -0.06 -0.06 0.00 -0.44 0.00 0.00 62.40 62.13 1uyg h SER 53 CO -0.00 0.23 0.38 0.44 -0.53 0.00 0.00 176.83 177.35 1uyg h ASP 54 N 0.40 0.56 -0.43 6.23 3.32 -1.07 0.56 116.42 125.99 1uyg h ASP 54 Ca 0.14 0.03 -0.07 0.00 0.02 0.00 0.00 57.03 57.15 1uyg h ASP 54 Cb 0.01 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 39.46 1uyg h ASP 54 CO -0.07 0.36 0.04 0.00 -1.72 0.00 0.00 179.24 177.85 1uyg h ALA 55 N 1.35 1.12 -0.19 3.45 0.00 -1.00 -0.77 119.26 123.23 1uyg h ALA 55 Ca 0.30 -0.25 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 1uyg h ALA 55 Cb 0.18 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 1uyg h ALA 55 CO -0.18 0.57 -0.16 -0.07 0.00 0.00 0.00 179.25 179.41 1uyg h LEU 56 N 0.76 0.47 -0.74 0.00 3.38 -0.40 -1.07 115.31 117.72 1uyg h LEU 56 Ca 0.15 -0.46 0.14 0.00 0.09 0.00 0.00 57.88 57.81 1uyg h LEU 56 Cb 0.41 -0.13 -0.10 0.00 0.09 0.00 0.00 40.66 40.93 1uyg h LEU 56 CO 0.01 0.83 0.26 0.44 0.09 0.00 0.00 178.44 180.07 1uyg h ASP 57 N 0.12 0.19 -0.06 -0.43 3.32 -0.76 -1.28 116.42 117.52 1uyg h ASP 57 Ca 0.03 0.12 0.00 0.00 0.02 0.00 0.00 57.03 57.21 1uyg h ASP 57 Cb 0.68 0.12 -0.00 0.00 0.22 0.00 0.00 39.33 40.35 1uyg h ASP 57 CO 0.04 0.06 0.03 0.50 -1.72 0.00 0.00 179.24 178.15 1uyg h LYS 58 N 0.38 0.07 -0.03 3.56 3.64 -1.10 -0.26 116.57 122.83 1uyg h LYS 58 Ca 0.41 -0.00 -0.12 0.00 -1.27 0.00 0.00 60.65 59.67 1uyg h LYS 58 Cb 0.64 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.43 1uyg h LYS 58 CO -0.43 0.04 -0.54 0.97 -2.27 0.00 0.00 179.45 177.23 1uyg h ILE 59 N 0.07 1.38 0.52 2.00 6.09 -1.32 -0.73 117.51 125.52 1uyg h ILE 59 Ca 0.02 -1.84 -0.03 0.00 -1.37 0.00 0.00 64.86 61.65 1uyg h ILE 59 Cb -0.00 1.96 0.01 0.00 0.47 0.00 0.00 36.82 39.26 1uyg h ILE 59 CO -0.01 0.53 -0.25 -0.09 -3.07 0.00 0.00 178.15 175.26 1uyg h ARG 60 N 0.06 -0.68 -0.60 2.19 2.43 -1.14 -1.10 114.38 115.54 1uyg h ARG 60 Ca -0.00 0.05 0.10 0.00 -0.81 0.00 0.00 59.98 59.31 1uyg h ARG 60 Cb 0.97 0.15 -0.08 0.00 -0.42 0.00 0.00 29.97 30.59 1uyg h ARG 60 CO 0.07 -0.41 0.18 -0.92 -1.51 0.00 0.00 179.97 177.38 1uyg h TYR 61 N -0.80 0.31 -0.26 2.20 3.20 -0.97 -2.24 116.97 118.41 1uyg h TYR 61 Ca -0.07 0.03 -0.05 0.00 3.14 0.00 0.00 58.73 61.78 1uyg h TYR 61 Cb 0.58 -0.05 -0.02 0.00 1.54 0.00 0.00 36.73 38.79 1uyg h TYR 61 CO -0.02 0.04 -0.07 0.93 -1.64 0.00 0.00 178.16 177.40 1uyg h GLU 62 N 0.34 0.42 0.00 1.82 5.08 -1.01 -2.84 114.58 118.38 1uyg h GLU 62 Ca 0.31 -0.10 -0.02 0.00 -1.00 0.00 0.00 59.36 58.55 1uyg h GLU 62 Cb 0.42 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.61 1uyg h GLU 62 CO -0.35 0.50 -0.12 0.66 -1.00 0.00 0.00 179.01 178.71 1uyg h SER 63 N 0.40 0.00 -0.99 1.42 4.64 -0.58 -2.73 113.55 115.71 1uyg h SER 63 Ca 0.08 0.00 0.16 0.00 -0.47 0.00 0.00 61.79 61.57 1uyg h SER 63 Cb 0.37 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 62.37 1uyg h SER 63 CO 0.02 0.12 0.62 -0.07 -0.87 0.00 0.00 176.83 176.64 1uyg h LEU 64 N 0.00 0.79 -2.11 5.97 3.38 -1.32 -2.17 115.31 119.85 1uyg h LEU 64 Ca -0.00 0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.04 1uyg h LEU 64 Cb 0.80 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.47 1uyg h LEU 64 CO 0.02 0.34 0.00 0.35 0.09 0.00 0.00 178.44 179.24 1uyg n THR 65 N -4.68 0.36 -2.79 0.22 -2.24 -1.11 -4.71 114.28 99.34 1uyg n THR 65 Ca 0.21 -0.68 -0.05 0.00 -2.27 0.00 0.00 64.05 61.26 1uyg n THR 65 Cb 0.50 1.06 0.01 0.00 -2.10 0.00 0.00 70.33 69.80 1uyg n THR 65 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1uyg s ASP 66 N -1.33 -1.36 0.39 3.42 2.15 -0.94 -5.01 116.67 114.00 1uyg s ASP 66 Ca 0.27 -1.77 0.25 0.00 0.43 0.00 0.00 52.55 51.74 1uyg s ASP 66 Cb 0.17 1.82 1.39 0.00 -0.30 0.00 0.00 42.92 46.00 1uyg s ASP 66 CO 0.24 -0.06 1.78 -0.65 -0.17 0.00 0.00 175.17 176.31 1uyg h PRO 67 N 5.05 0.00 0.00 4.34 0.11 -1.69 0.02 132.00 139.82 1uyg h PRO 67 Ca 0.07 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.18 1uyg h PRO 67 Cb 1.10 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.21 1uyg h PRO 67 CO 0.02 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 178.47 1uyg h SER 68 N 0.00 0.00 0.27 -2.05 4.64 -1.95 -2.60 113.55 111.86 1uyg h SER 68 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1uyg h SER 68 Cb 0.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.12 1uyg h SER 68 CO 0.00 0.00 0.00 0.11 -0.87 0.00 0.00 176.83 176.07 1uyg h LYS 69 N 0.00 0.00 -0.59 4.77 1.57 -1.34 -1.38 116.57 119.59 1uyg h LYS 69 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1uyg h LYS 69 Cb 0.45 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.76 1uyg h LYS 69 CO 0.00 0.00 0.00 1.28 -0.57 0.00 0.00 179.45 180.16 1uyg n LEU 70 N -2.33 3.74 0.24 2.94 4.77 -0.98 -4.31 117.00 121.07 1uyg n LEU 70 Ca -0.00 -1.82 0.07 0.00 -0.03 0.00 0.00 56.01 54.22 1uyg n LEU 70 Cb 0.11 -0.39 0.57 0.00 -2.33 0.00 0.00 43.42 41.37 1uyg n LEU 70 CO 0.14 0.89 0.98 0.44 -1.33 0.00 0.00 177.39 178.51 1uyg h ASP 71 N 4.25 0.00 -0.12 -1.43 3.32 -1.41 -1.81 116.42 119.23 1uyg h ASP 71 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1uyg h ASP 71 Cb 0.98 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.53 1uyg h ASP 71 CO 0.00 0.10 0.00 -1.54 -1.72 0.00 0.00 179.24 176.08 1uyg n SER 72 N -4.42 0.75 0.00 6.45 3.41 -1.26 -4.86 113.62 113.69 1uyg n SER 72 Ca -0.03 -1.80 0.00 0.00 -0.26 0.00 0.00 58.87 56.78 1uyg n SER 72 Cb 0.17 -0.08 0.00 0.00 -0.26 0.00 0.00 64.21 64.05 1uyg n SER 72 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1uyg n GLY 73 N 0.82 3.46 0.11 5.00 0.00 -0.68 -3.85 105.19 110.04 1uyg n GLY 73 Ca 0.09 -0.32 0.01 0.00 0.00 0.00 0.00 46.02 45.80 1uyg n GLY 73 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1uyg h LYS 74 N 0.00 0.00 -6.37 1.61 1.57 -1.88 -3.44 116.57 108.06 1uyg h LYS 74 Ca 0.00 0.00 -0.54 0.00 -1.87 0.00 0.00 60.65 58.24 1uyg h LYS 74 Cb 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 1uyg h LYS 74 CO 0.00 0.37 0.79 -1.21 -0.57 0.00 0.00 179.45 178.83 1uyg s GLU 75 N -2.93 4.30 -0.40 3.15 2.02 -1.26 -4.99 118.70 118.59 1uyg s GLU 75 Ca -0.01 1.90 -0.07 0.00 0.02 0.00 0.00 54.97 56.81 1uyg s GLU 75 Cb 0.08 -3.55 0.08 0.00 0.10 0.00 0.00 34.13 30.84 1uyg s GLU 75 CO 0.79 -0.53 0.22 -0.51 0.02 0.00 0.00 175.26 175.25 1uyg s LEU 76 N 2.27 5.01 0.29 1.80 1.43 -1.26 -4.76 118.68 123.46 1uyg s LEU 76 Ca 0.62 -1.57 -0.19 0.00 -1.03 0.00 0.00 54.13 51.95 1uyg s LEU 76 Cb -0.30 -1.92 0.05 0.00 0.03 0.00 0.00 46.19 44.05 1uyg s LEU 76 CO 0.26 -0.50 0.82 -1.38 0.23 0.00 0.00 176.35 175.78 1uyg s HIS 77 N 1.35 -0.02 -0.07 0.29 -3.43 -1.26 -4.35 115.29 107.80 1uyg s HIS 77 Ca 0.03 -0.50 0.02 0.00 -0.80 0.00 0.00 55.06 53.81 1uyg s HIS 77 Cb -0.22 0.75 0.01 0.00 -1.43 0.00 0.00 32.58 31.69 1uyg s HIS 77 CO 0.01 -1.28 -0.13 0.42 -2.00 0.00 0.00 174.74 171.76 1uyg s ILE 78 N -2.93 1.18 -0.07 -5.38 1.01 -0.41 -2.54 121.20 112.05 1uyg s ILE 78 Ca 0.14 -0.50 0.03 0.00 0.00 0.00 0.00 60.65 60.33 1uyg s ILE 78 Cb -0.05 -1.08 -0.02 0.00 0.01 0.00 0.00 42.46 41.33 1uyg s ILE 78 CO 0.08 0.37 -0.18 0.20 0.00 0.00 0.00 174.94 175.41 1uyg s ASN 79 N 0.69 3.69 -0.27 3.58 0.02 -0.01 -0.92 114.94 121.73 1uyg s ASN 79 Ca -0.14 -0.34 -0.05 0.00 -1.02 0.00 0.00 52.86 51.31 1uyg s ASN 79 Cb -0.16 -1.05 0.01 0.00 0.02 0.00 0.00 41.25 40.07 1uyg s ASN 79 CO 0.03 0.26 0.02 -0.76 0.02 0.00 0.00 177.10 176.68 1uyg s LEU 80 N -0.24 3.48 -0.30 0.60 1.43 0.48 -0.72 118.68 123.41 1uyg s LEU 80 Ca 0.00 -0.65 0.02 0.00 -1.03 0.00 0.00 54.13 52.47 1uyg s LEU 80 Cb -0.13 -1.80 0.08 0.00 0.03 0.00 0.00 46.19 44.37 1uyg s LEU 80 CO 0.03 -0.13 0.00 -0.63 0.23 0.00 0.00 176.35 175.85 1uyg s ILE 81 N 1.46 1.88 0.28 -0.59 1.01 0.01 -1.03 121.20 124.22 1uyg s ILE 81 Ca 0.03 -1.82 -0.19 0.00 0.00 0.00 0.00 60.65 58.67 1uyg s ILE 81 Cb -0.16 -2.26 -0.09 0.00 0.01 0.00 0.00 42.46 39.96 1uyg s ILE 81 CO -0.00 -0.39 0.77 -2.16 0.00 0.00 0.00 174.94 173.15 1uyg s PRO 82 N 1.15 4.21 -0.24 2.79 0.04 -1.26 -0.96 135.00 140.72 1uyg s PRO 82 Ca 0.03 0.87 -0.04 0.00 0.04 0.00 0.00 61.00 61.91 1uyg s PRO 82 Cb -0.19 -2.69 0.09 0.00 0.04 0.00 0.00 34.50 31.76 1uyg s PRO 82 CO -0.10 0.28 0.15 1.21 0.04 0.00 0.00 177.00 178.58 1uyg s ASN 83 N -1.87 2.73 0.15 6.66 3.84 -0.02 -4.80 114.94 121.62 1uyg s ASN 83 Ca 0.48 -0.91 -0.10 0.00 0.21 0.00 0.00 52.86 52.55 1uyg s ASN 83 Cb -0.14 -0.14 -0.03 0.00 -0.55 0.00 0.00 41.25 40.38 1uyg s ASN 83 CO 0.20 -0.39 1.46 0.11 -2.79 0.00 0.00 177.10 175.68 1uyg h LYS 84 N 8.39 0.87 -0.60 0.43 1.57 -1.92 0.24 116.57 125.55 1uyg h LYS 84 Ca -0.17 -0.50 0.12 0.00 -1.87 0.00 0.00 60.65 58.23 1uyg h LYS 84 Cb 1.08 0.04 -0.09 0.00 0.08 0.00 0.00 32.23 33.33 1uyg h LYS 84 CO 0.36 1.14 0.08 -0.56 -0.57 0.00 0.00 179.45 179.90 1uyg h GLN 85 N 0.69 0.19 0.00 3.15 3.07 -1.97 -2.26 115.11 117.98 1uyg h GLN 85 Ca 0.04 -0.01 0.00 0.00 0.09 0.00 0.00 58.65 58.77 1uyg h GLN 85 Cb 1.05 -0.04 0.00 0.00 0.08 0.00 0.00 27.48 28.57 1uyg h GLN 85 CO 0.11 0.12 -0.63 -0.25 0.09 0.00 0.00 178.83 178.27 1uyg n ASP 86 N -5.19 0.59 -3.70 0.06 8.00 -1.13 -4.98 116.55 110.20 1uyg n ASP 86 Ca 0.09 -0.31 -0.24 0.00 0.71 0.00 0.00 54.79 55.04 1uyg n ASP 86 Cb 0.34 0.40 0.05 0.00 -0.02 0.00 0.00 41.12 41.89 1uyg n ASP 86 CO 0.00 0.00 0.00 -1.14 -0.39 0.00 0.00 177.20 175.67 1uyg n ARG 87 N -1.60 -5.97 -4.37 -1.24 0.63 0.79 -4.89 116.66 99.99 1uyg n ARG 87 Ca 0.05 0.69 -0.28 0.00 -0.92 0.00 0.00 57.85 57.39 1uyg n ARG 87 Cb 0.35 -5.52 -0.13 0.00 0.45 0.00 0.00 32.46 27.61 1uyg n ARG 87 CO 0.00 0.00 0.00 0.95 -2.51 0.00 0.00 177.63 176.07 1uyg s THR 88 N -3.44 2.18 -0.13 5.15 -4.23 -0.84 -1.66 115.64 112.66 1uyg s THR 88 Ca 0.32 -1.73 0.01 0.00 -1.18 0.00 0.00 61.69 59.10 1uyg s THR 88 Cb -0.15 -1.94 0.02 0.00 1.34 0.00 0.00 72.50 71.77 1uyg s THR 88 CO 0.79 0.06 -0.16 -0.22 -0.54 0.00 0.00 174.62 174.55 1uyg s LEU 89 N -2.05 1.77 -0.16 4.79 2.96 -0.63 -0.84 118.68 124.52 1uyg s LEU 89 Ca 0.13 -0.49 -0.02 0.00 -0.22 0.00 0.00 54.13 53.54 1uyg s LEU 89 Cb -0.10 -1.19 -0.02 0.00 0.50 0.00 0.00 46.19 45.38 1uyg s LEU 89 CO 0.06 -0.01 -0.09 -0.89 -1.32 0.00 0.00 176.35 174.10 1uyg s THR 90 N 1.20 3.32 -0.34 3.68 2.01 -0.14 -0.61 115.64 124.76 1uyg s THR 90 Ca -0.01 -0.55 -0.11 0.00 0.31 0.00 0.00 61.69 61.33 1uyg s THR 90 Cb -0.14 -2.44 0.00 0.00 0.01 0.00 0.00 72.50 69.94 1uyg s THR 90 CO -0.06 0.49 0.20 -0.63 -0.69 0.00 0.00 174.62 173.93 1uyg s ILE 91 N 0.62 4.77 -0.14 1.82 1.09 -0.16 -0.81 121.20 128.38 1uyg s ILE 91 Ca -0.05 -0.53 -0.03 0.00 -1.10 0.00 0.00 60.65 58.94 1uyg s ILE 91 Cb -0.15 -3.52 -0.03 0.00 -1.06 0.00 0.00 42.46 37.71 1uyg s ILE 91 CO 0.03 -0.06 -0.05 -0.69 -0.10 0.00 0.00 174.94 174.07 1uyg s VAL 92 N 1.62 3.83 0.22 2.92 1.01 0.11 -0.66 120.40 129.45 1uyg s VAL 92 Ca 0.04 -0.39 0.05 0.00 0.00 0.00 0.00 61.98 61.69 1uyg s VAL 92 Cb -0.18 -2.66 -0.05 0.00 0.00 0.00 0.00 36.38 33.49 1uyg s VAL 92 CO 0.07 0.51 -0.07 1.51 0.00 0.00 0.00 175.10 177.13 1uyg s ASP 93 N 0.19 2.18 -0.45 3.32 1.47 0.25 -0.83 116.67 122.80 1uyg s ASP 93 Ca -0.02 -1.12 0.03 0.00 1.18 0.00 0.00 52.55 52.62 1uyg s ASP 93 Cb -0.14 -0.06 0.45 0.00 -0.34 0.00 0.00 42.92 42.83 1uyg s ASP 93 CO 0.03 -0.36 1.52 0.35 0.68 0.00 0.00 175.17 177.39 1uyg n THR 94 N -0.39 2.95 -0.06 2.11 -2.24 -1.05 -2.38 114.28 113.22 1uyg n THR 94 Ca -0.07 -3.79 0.00 0.00 -2.27 0.00 0.00 64.05 57.92 1uyg n THR 94 Cb 0.62 -1.16 0.00 0.00 -2.10 0.00 0.00 70.33 67.70 1uyg n THR 94 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1uyg n GLY 95 N -0.77 -1.25 0.24 3.38 0.00 -1.26 -4.75 105.19 100.78 1uyg n GLY 95 Ca 0.51 -1.55 0.11 0.00 0.00 0.00 0.00 46.02 45.08 1uyg n GLY 95 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1uyg h ILE 96 N -0.24 0.62 0.00 -0.61 2.10 -1.53 -3.26 117.51 114.58 1uyg h ILE 96 Ca 0.00 -0.80 0.00 0.00 1.08 0.00 0.00 64.86 65.14 1uyg h ILE 96 Cb 0.00 1.52 0.00 0.00 -1.09 0.00 0.00 36.82 37.25 1uyg h ILE 96 CO 0.00 0.17 0.00 0.61 -1.08 0.00 0.00 178.15 177.85 1uyg n GLY 97 N -0.39 -2.04 3.32 8.18 0.00 -1.26 -4.34 105.19 108.67 1uyg n GLY 97 Ca -0.01 -1.49 -0.31 0.00 0.00 0.00 0.00 46.02 44.20 1uyg n GLY 97 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1uyg s MET 98 N -2.17 2.25 0.80 1.61 -1.94 -1.26 -4.69 119.30 113.90 1uyg s MET 98 Ca 0.00 -0.89 -0.11 0.00 -1.71 0.00 0.00 55.69 52.97 1uyg s MET 98 Cb 0.00 -2.11 0.08 0.00 2.01 0.00 0.00 34.83 34.81 1uyg s MET 98 CO 0.00 0.53 1.17 0.95 -0.01 0.00 0.00 175.02 177.66 1uyg s THR 99 N -0.54 2.03 0.27 2.05 -4.23 -1.26 -3.81 115.64 110.16 1uyg s THR 99 Ca 0.08 -0.04 -0.01 0.00 -1.18 0.00 0.00 61.69 60.54 1uyg s THR 99 Cb -0.11 -3.00 0.27 0.00 1.34 0.00 0.00 72.50 71.01 1uyg s THR 99 CO 0.00 0.00 1.88 0.50 -0.54 0.00 0.00 174.62 176.46 1uyg h LYS 100 N -1.03 1.11 -0.50 3.99 3.64 -1.98 -2.62 116.57 119.17 1uyg h LYS 100 Ca -0.46 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 58.86 1uyg h LYS 100 Cb 1.32 -0.25 -0.02 0.00 -0.41 0.00 0.00 32.23 32.87 1uyg h LYS 100 CO 0.64 0.73 0.33 0.00 -2.27 0.00 0.00 179.45 178.88 1uyg h ALA 101 N 1.47 0.63 -0.45 5.00 0.00 -1.99 -1.61 119.26 122.31 1uyg h ALA 101 Ca 0.43 -0.04 0.09 0.00 0.00 0.00 0.00 54.91 55.40 1uyg h ALA 101 Cb 0.21 -0.20 -0.09 0.00 0.00 0.00 0.00 17.79 17.71 1uyg h ALA 101 CO -0.18 0.08 -0.15 -0.44 0.00 0.00 0.00 179.25 178.57 1uyg h ASP 102 N 0.67 -0.52 -0.40 0.00 3.32 -1.86 0.08 116.42 117.72 1uyg h ASP 102 Ca 0.18 0.15 -0.04 0.00 0.02 0.00 0.00 57.03 57.34 1uyg h ASP 102 Cb -0.07 0.32 -0.02 0.00 0.22 0.00 0.00 39.33 39.78 1uyg h ASP 102 CO -0.04 -0.18 0.08 -0.07 -1.72 0.00 0.00 179.24 177.31 1uyg h LEU 103 N -0.04 0.61 0.00 1.55 3.38 -0.98 -1.34 115.31 118.49 1uyg h LEU 103 Ca 0.22 -0.24 -0.29 0.00 0.09 0.00 0.00 57.88 57.66 1uyg h LEU 103 Cb 0.38 -0.16 -0.05 0.00 0.09 0.00 0.00 40.66 40.91 1uyg h LEU 103 CO -0.49 0.70 -1.65 0.40 0.09 0.00 0.00 178.44 177.49 1uyg h ILE 104 N 0.50 0.91 0.00 1.22 2.04 -1.33 -3.45 117.51 117.40 1uyg h ILE 104 Ca 0.12 -2.76 0.00 0.00 1.00 0.00 0.00 64.86 63.23 1uyg h ILE 104 Cb 0.33 2.45 0.00 0.00 -0.74 0.00 0.00 36.82 38.87 1uyg h ILE 104 CO 0.00 0.53 -0.15 0.59 0.00 0.00 0.00 178.15 179.12 1uyg n ASN 105 N -3.07 0.41 -0.07 1.72 3.02 -0.22 -4.87 115.26 112.18 1uyg n ASN 105 Ca -0.16 0.22 -0.13 0.00 -0.03 0.00 0.00 54.58 54.49 1uyg n ASN 105 Cb 1.04 -0.01 -0.06 0.00 -0.61 0.00 0.00 39.78 40.15 1uyg n ASN 105 CO 0.00 0.00 0.00 0.78 -2.62 0.00 0.00 177.26 175.42 1uyg h ASN 106 N 0.00 0.47 -0.55 6.41 2.35 -0.86 -1.43 115.58 121.97 1uyg h ASN 106 Ca 0.00 -0.47 0.04 0.00 -0.55 0.00 0.00 56.30 55.33 1uyg h ASN 106 Cb 0.15 -0.13 -0.04 0.00 0.05 0.00 0.00 38.32 38.34 1uyg h ASN 106 CO 0.00 0.84 0.30 -0.07 -1.65 0.00 0.00 177.43 176.85 1uyg h LEU 107 N 0.11 0.44 -0.55 1.61 3.38 -1.50 -1.70 115.31 117.10 1uyg h LEU 107 Ca 0.03 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 1uyg h LEU 107 Cb 0.70 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 41.36 1uyg h LEU 107 CO 0.04 0.30 0.28 1.23 0.09 0.00 0.00 178.44 180.38 1uyg h GLY 108 N 0.57 0.83 0.72 0.83 0.00 -1.74 0.56 103.07 104.84 1uyg h GLY 108 Ca 0.24 -0.39 0.04 0.00 0.00 0.00 0.00 47.33 47.22 1uyg h GLY 108 CO -0.15 0.38 0.18 -0.84 0.00 0.00 0.00 176.54 176.10 1uyg h THR 109 N 0.74 0.93 -0.31 4.70 2.02 -0.97 -1.99 112.91 118.02 1uyg h THR 109 Ca 0.19 -0.12 -0.15 0.00 0.77 0.00 0.00 66.41 67.10 1uyg h THR 109 Cb 0.08 0.53 -0.01 0.00 -1.74 0.00 0.00 68.15 67.02 1uyg h THR 109 CO -0.03 0.07 -0.40 0.40 0.37 0.00 0.00 175.52 175.93 1uyg h ILE 110 N 0.36 1.29 0.00 3.11 1.08 -1.20 -3.25 117.51 118.90 1uyg h ILE 110 Ca 0.18 -1.57 -0.05 0.00 -0.39 0.00 0.00 64.86 63.03 1uyg h ILE 110 Cb 0.13 1.47 -0.01 0.00 -3.07 0.00 0.00 36.82 35.34 1uyg h ILE 110 CO -0.16 0.51 -0.25 0.00 -0.69 0.00 0.00 178.15 177.57 1uyg h ALA 111 N 0.94 1.31 -0.37 1.87 0.00 -0.59 -3.17 119.26 119.24 1uyg h ALA 111 Ca 0.05 -0.22 0.08 0.00 0.00 0.00 0.00 54.91 54.81 1uyg h ALA 111 Cb 0.95 -0.04 -0.09 0.00 0.00 0.00 0.00 17.79 18.61 1uyg h ALA 111 CO 0.09 0.31 -0.26 -0.22 0.00 0.00 0.00 179.25 179.16 1uyg h LYS 112 N 0.00 -0.20 -0.47 0.00 3.64 -1.40 0.39 116.57 118.53 1uyg h LYS 112 Ca -0.00 0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.36 1uyg h LYS 112 Cb 0.54 0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.38 1uyg h LYS 112 CO 0.03 -0.13 0.15 0.66 -2.27 0.00 0.00 179.45 177.89 1uyg h SER 113 N -0.21 0.68 -0.55 4.20 4.64 -1.76 -2.80 113.55 117.74 1uyg h SER 113 Ca 0.18 -0.20 -0.02 0.00 -0.47 0.00 0.00 61.79 61.28 1uyg h SER 113 Cb 0.49 -0.18 -0.03 0.00 -0.31 0.00 0.00 62.40 62.38 1uyg h SER 113 CO -0.49 0.70 0.27 1.23 -0.87 0.00 0.00 176.83 177.66 1uyg h GLY 114 N 0.62 0.86 0.61 -0.77 0.00 -1.56 -1.38 103.07 101.45 1uyg h GLY 114 Ca 0.15 -0.42 0.02 0.00 0.00 0.00 0.00 47.33 47.08 1uyg h GLY 114 CO -0.01 0.40 -0.18 -0.84 0.00 0.00 0.00 176.54 175.92 1uyg h THR 115 N 0.75 0.58 0.12 4.70 2.02 -0.91 0.90 112.91 121.07 1uyg h THR 115 Ca 0.19 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.39 1uyg h THR 115 Cb 0.12 0.58 -0.03 0.00 -1.74 0.00 0.00 68.15 67.08 1uyg h THR 115 CO -0.02 0.00 -0.25 0.50 0.37 0.00 0.00 175.52 176.12 1uyg h LYS 116 N -0.31 -0.44 -0.87 6.66 3.64 -1.34 0.82 116.57 124.74 1uyg h LYS 116 Ca 0.05 0.03 0.12 0.00 -1.27 0.00 0.00 60.65 59.58 1uyg h LYS 116 Cb 0.36 0.10 -0.08 0.00 -0.41 0.00 0.00 32.23 32.20 1uyg h LYS 116 CO -0.14 -0.29 0.49 0.00 -2.27 0.00 0.00 179.45 177.23 1uyg h ALA 117 N 0.30 1.29 -0.28 5.00 0.00 -1.15 0.69 119.26 125.11 1uyg h ALA 117 Ca 0.03 0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 1uyg h ALA 117 Cb 0.47 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1uyg h ALA 117 CO -0.14 0.04 -0.00 0.35 0.00 0.00 0.00 179.25 179.50 1uyg h PHE 118 N 0.76 0.54 -0.44 0.00 3.57 -0.38 -0.20 116.94 120.78 1uyg h PHE 118 Ca 0.45 -0.09 -0.07 0.00 3.53 0.00 0.00 57.97 61.78 1uyg h PHE 118 Cb 0.51 -0.14 -0.02 0.00 2.79 0.00 0.00 35.95 39.09 1uyg h PHE 118 CO -0.06 0.64 -0.02 0.52 -2.23 0.00 0.00 178.31 177.16 1uyg h MET 119 N 0.28 0.74 0.25 1.11 2.86 -0.33 -0.88 114.93 118.95 1uyg h MET 119 Ca 0.08 -0.20 -0.01 0.00 -2.06 0.00 0.00 59.70 57.51 1uyg h MET 119 Cb 0.43 -0.09 0.00 0.00 0.06 0.00 0.00 31.60 32.01 1uyg h MET 119 CO 0.01 0.76 -0.12 0.93 1.06 0.00 0.00 176.91 179.56 1uyg h GLU 120 N 0.69 -0.32 -0.87 1.72 5.08 -0.69 -3.10 114.58 117.09 1uyg h GLU 120 Ca 0.13 0.02 0.21 0.00 -1.00 0.00 0.00 59.36 58.73 1uyg h GLU 120 Cb 0.46 0.07 -0.12 0.00 0.50 0.00 0.00 28.75 29.66 1uyg h GLU 120 CO 0.02 -0.06 0.35 0.00 -1.00 0.00 0.00 179.01 178.32 1uyg h ALA 121 N 0.14 1.36 0.00 3.43 0.00 -0.65 -1.25 119.26 122.28 1uyg h ALA 121 Ca -0.03 0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1uyg h ALA 121 Cb 0.40 0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1uyg h ALA 121 CO 0.06 -0.34 0.14 1.28 0.00 0.00 0.00 179.25 180.38 1uyg n LEU 122 N -5.07 0.08 -3.95 0.00 4.77 -0.37 -1.92 117.00 110.54 1uyg n LEU 122 Ca 0.21 0.42 -0.28 0.00 -0.03 0.00 0.00 56.01 56.33 1uyg n LEU 122 Cb 0.63 -0.42 -0.17 0.00 -2.33 0.00 0.00 43.42 41.13 1uyg n LEU 122 CO 0.12 -0.45 -0.46 -1.10 -1.33 0.00 0.00 177.39 174.18 1uyg s GLN 123 N -2.87 1.78 0.00 3.23 -0.21 -0.47 -3.99 119.66 117.13 1uyg s GLN 123 Ca -0.00 -0.36 0.00 0.00 0.02 0.00 0.00 55.36 55.02 1uyg s GLN 123 Cb 0.01 -1.74 0.00 0.00 1.00 0.00 0.00 33.01 32.28 1uyg s GLN 123 CO 0.03 -0.24 0.00 0.00 -2.12 0.00 0.00 175.29 172.96 1uyg n ALA 124 N 4.82 0.00 -0.93 6.09 0.00 -1.24 -4.85 120.51 124.39 1uyg n ALA 124 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.30 1uyg n ALA 124 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.95 1uyg n ALA 124 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1uyg n GLY 125 N 0.00 0.92 3.65 0.00 0.00 -1.16 -5.07 105.19 103.53 1uyg n GLY 125 Ca 0.00 -0.55 -0.30 0.00 0.00 0.00 0.00 46.02 45.17 1uyg n GLY 125 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uyg s ALA 126 N -2.00 1.01 0.37 4.61 0.00 -0.81 -5.00 121.76 119.94 1uyg s ALA 126 Ca 0.00 0.08 0.04 0.00 0.00 0.00 0.00 51.96 52.08 1uyg s ALA 126 Cb 0.00 -3.27 -0.04 0.00 0.00 0.00 0.00 23.12 19.81 1uyg s ALA 126 CO 0.00 -2.83 0.08 0.16 0.00 0.00 0.00 175.76 173.17 1uyg s ASP 127 N -3.01 2.65 0.47 0.00 -4.77 -1.26 -4.55 116.67 106.21 1uyg s ASP 127 Ca 0.65 -1.52 0.12 0.00 -3.30 0.00 0.00 52.55 48.51 1uyg s ASP 127 Cb -0.21 0.20 1.10 0.00 -1.09 0.00 0.00 42.92 42.92 1uyg s ASP 127 CO 0.59 -0.76 2.11 0.40 0.70 0.00 0.00 175.17 178.21 1uyg h ILE 128 N 1.93 1.04 0.00 2.11 2.04 -1.98 -1.71 117.51 120.94 1uyg h ILE 128 Ca -0.39 -0.08 0.00 0.00 1.00 0.00 0.00 64.86 65.39 1uyg h ILE 128 Cb 1.26 0.78 0.00 0.00 -0.74 0.00 0.00 36.82 38.13 1uyg h ILE 128 CO 0.65 0.04 0.00 0.77 0.00 0.00 0.00 178.15 179.61 1uyg h SER 129 N 0.24 0.00 -0.20 1.72 4.64 -1.96 -1.85 113.55 116.13 1uyg h SER 129 Ca 0.07 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 1uyg h SER 129 Cb -0.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.07 1uyg h SER 129 CO -0.01 0.00 0.00 0.23 -0.87 0.00 0.00 176.83 176.18 1uyg n MET 130 N -2.33 1.70 -0.21 4.77 2.81 -0.64 -4.47 117.12 118.74 1uyg n MET 130 Ca -0.01 -1.07 0.15 0.00 -1.81 0.00 0.00 57.70 54.96 1uyg n MET 130 Cb 0.05 -1.35 0.46 0.00 -0.71 0.00 0.00 33.22 31.66 1uyg n MET 130 CO 0.00 0.00 0.00 0.97 1.51 0.00 0.00 175.97 178.45 1uyg h ILE 131 N 2.02 0.80 0.00 2.02 2.10 -1.53 -1.52 117.51 121.40 1uyg h ILE 131 Ca 0.00 -0.18 -0.06 0.00 1.08 0.00 0.00 64.86 65.70 1uyg h ILE 131 Cb 0.45 0.23 -0.01 0.00 -1.09 0.00 0.00 36.82 36.40 1uyg h ILE 131 CO 0.00 0.09 -0.28 1.23 -1.08 0.00 0.00 178.15 178.11 1uyg h GLY 132 N 0.52 0.00 1.73 8.18 0.00 -1.86 -1.88 103.07 109.75 1uyg h GLY 132 Ca 0.41 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.74 1uyg h GLY 132 CO -0.16 0.00 0.00 -1.06 0.00 0.00 0.00 176.54 175.32 1uyg n GLN 133 N -4.11 0.05 -0.08 4.80 6.02 -0.57 -1.95 117.38 121.54 1uyg n GLN 133 Ca -0.02 0.30 0.04 0.00 -0.01 0.00 0.00 57.00 57.31 1uyg n GLN 133 Cb 0.34 -1.50 0.08 0.00 1.02 0.00 0.00 30.24 30.18 1uyg n GLN 133 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 1uyg n PHE 134 N -1.36 0.21 -1.66 1.08 3.72 -0.71 -4.99 117.46 113.75 1uyg n PHE 134 Ca 0.02 -0.30 -0.09 0.00 -0.05 0.00 0.00 57.45 57.02 1uyg n PHE 134 Cb 0.05 -0.02 -0.03 0.00 -0.94 0.00 0.00 39.48 38.54 1uyg n PHE 134 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1uyg n GLY 135 N 0.35 0.63 0.67 1.37 0.00 -0.82 -4.33 105.19 103.06 1uyg n GLY 135 Ca 0.07 -0.56 0.06 0.00 0.00 0.00 0.00 46.02 45.59 1uyg n GLY 135 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1uyg n VAL 136 N -3.27 1.45 0.11 1.61 0.24 -1.22 -4.81 118.33 112.44 1uyg n VAL 136 Ca -0.10 -2.24 0.16 0.00 -2.04 0.00 0.00 64.34 60.12 1uyg n VAL 136 Cb 0.43 0.10 0.69 0.00 -1.47 0.00 0.00 33.84 33.59 1uyg n VAL 136 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 1uyg h GLY 137 N 0.69 0.00 -0.21 7.63 0.00 -1.86 -2.26 103.07 107.07 1uyg h GLY 137 Ca -0.05 0.00 0.23 0.00 0.00 0.00 0.00 47.33 47.51 1uyg h GLY 137 CO 0.02 0.00 0.44 -2.75 0.00 0.00 0.00 176.54 174.25 1uyg h PHE 138 N 0.00 0.73 0.00 5.60 3.57 -1.87 -0.56 116.94 124.42 1uyg h PHE 138 Ca 0.15 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.69 1uyg h PHE 138 Cb 0.64 -0.18 0.00 0.00 2.79 0.00 0.00 35.95 39.20 1uyg h PHE 138 CO 0.00 -0.04 0.00 0.66 -2.23 0.00 0.00 178.31 176.70 1uyg n TYR 139 N -5.02 0.09 0.24 0.41 4.01 -0.85 -1.32 117.16 114.72 1uyg n TYR 139 Ca 0.24 0.03 0.09 0.00 -0.16 0.00 0.00 57.90 58.10 1uyg n TYR 139 Cb 0.69 -0.55 0.43 0.00 -0.31 0.00 0.00 39.34 39.60 1uyg n TYR 139 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 1uyg n SER 140 N -1.58 0.43 0.05 7.72 3.41 -0.22 -1.38 113.62 122.05 1uyg n SER 140 Ca 0.04 0.66 0.19 0.00 -0.26 0.00 0.00 58.87 59.50 1uyg n SER 140 Cb 0.21 -0.73 0.70 0.00 -0.26 0.00 0.00 64.21 64.13 1uyg n SER 140 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1uyg h ALA 141 N 2.13 2.38 0.00 7.33 0.00 -1.37 -1.49 119.26 128.23 1uyg h ALA 141 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1uyg h ALA 141 Cb 0.13 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1uyg h ALA 141 CO 0.00 -0.57 0.00 0.66 0.00 0.00 0.00 179.25 179.34 1uyg n TYR 142 N -4.30 0.00 0.06 0.00 4.01 -0.48 -1.38 117.16 115.07 1uyg n TYR 142 Ca 0.08 0.00 -0.08 0.00 -0.16 0.00 0.00 57.90 57.74 1uyg n TYR 142 Cb 0.54 0.00 0.07 0.00 -0.31 0.00 0.00 39.34 39.64 1uyg n TYR 142 CO 0.00 0.00 0.00 -0.07 -0.46 0.00 0.00 176.86 176.33 1uyg h LEU 143 N 0.00 0.39 0.00 7.72 3.38 -1.47 -3.38 115.31 121.95 1uyg h LEU 143 Ca 0.00 -0.24 0.00 0.00 0.09 0.00 0.00 57.88 57.73 1uyg h LEU 143 Cb 0.00 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.64 1uyg h LEU 143 CO 0.00 0.94 -0.34 1.33 0.09 0.00 0.00 178.44 180.46 1uyg n VAL 144 N -3.86 0.00 -4.87 1.22 0.24 -0.97 -5.01 118.33 105.08 1uyg n VAL 144 Ca -0.03 -0.30 -0.33 0.00 -2.04 0.00 0.00 64.34 61.64 1uyg n VAL 144 Cb 0.66 0.81 -0.14 0.00 -1.47 0.00 0.00 33.84 33.70 1uyg n VAL 144 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1uyg s ALA 145 N -1.29 2.62 -0.10 2.33 0.00 -0.48 -0.60 121.76 124.23 1uyg s ALA 145 Ca 0.00 -0.95 0.14 0.00 0.00 0.00 0.00 51.96 51.15 1uyg s ALA 145 Cb 0.00 -1.04 0.04 0.00 0.00 0.00 0.00 23.12 22.12 1uyg s ALA 145 CO 0.00 0.43 1.43 1.05 0.00 0.00 0.00 175.76 178.67 1uyg h GLU 146 N 5.90 0.00 -3.20 0.00 4.11 -1.13 -3.41 114.58 116.84 1uyg h GLU 146 Ca -0.38 0.00 -0.19 0.00 0.07 0.00 0.00 59.36 58.86 1uyg h GLU 146 Cb 1.18 0.00 -0.28 0.00 0.50 0.00 0.00 28.75 30.15 1uyg h GLU 146 CO 0.52 0.58 -0.51 0.21 0.07 0.00 0.00 179.01 179.88 1uyg s LYS 147 N -2.94 0.20 -0.08 1.06 2.20 -1.22 -4.47 119.74 114.49 1uyg s LYS 147 Ca 0.03 0.35 0.05 0.00 -0.36 0.00 0.00 55.97 56.04 1uyg s LYS 147 Cb 0.08 0.01 -0.01 0.00 -1.51 0.00 0.00 37.83 36.40 1uyg s LYS 147 CO 0.76 -0.08 -0.24 0.08 -0.36 0.00 0.00 175.35 175.51 1uyg s VAL 148 N 0.57 2.14 -0.09 4.02 1.01 -0.36 -0.90 120.40 126.79 1uyg s VAL 148 Ca -0.04 -1.01 0.03 0.00 0.00 0.00 0.00 61.98 60.96 1uyg s VAL 148 Cb -0.05 -1.80 -0.01 0.00 0.00 0.00 0.00 36.38 34.51 1uyg s VAL 148 CO -0.03 0.56 -0.20 -0.89 0.00 0.00 0.00 175.10 174.55 1uyg s THR 149 N 0.09 2.48 -0.16 3.92 2.01 -0.54 -1.59 115.64 121.86 1uyg s THR 149 Ca -0.11 -0.89 0.01 0.00 0.31 0.00 0.00 61.69 61.00 1uyg s THR 149 Cb -0.16 -1.97 0.02 0.00 0.01 0.00 0.00 72.50 70.41 1uyg s THR 149 CO 0.06 0.56 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.71 1uyg s VAL 150 N 0.03 1.70 -0.18 3.82 1.01 0.84 0.22 120.40 127.85 1uyg s VAL 150 Ca -0.08 -0.75 -0.06 0.00 0.00 0.00 0.00 61.98 61.10 1uyg s VAL 150 Cb -0.15 -1.60 -0.03 0.00 0.00 0.00 0.00 36.38 34.60 1uyg s VAL 150 CO 0.05 0.45 0.03 -0.63 0.00 0.00 0.00 175.10 175.00 1uyg s ILE 151 N 1.43 4.43 -0.02 2.22 -1.09 -0.17 -0.28 121.20 127.72 1uyg s ILE 151 Ca 0.04 -0.16 -0.12 0.00 -2.23 0.00 0.00 60.65 58.19 1uyg s ILE 151 Cb -0.13 -2.99 0.02 0.00 -1.58 0.00 0.00 42.46 37.77 1uyg s ILE 151 CO -0.11 0.45 0.25 0.28 -1.23 0.00 0.00 174.94 174.58 1uyg s THR 152 N 0.54 0.06 -0.09 2.92 -1.32 -0.76 -0.08 115.64 116.91 1uyg s THR 152 Ca 0.01 -0.50 -0.03 0.00 -1.21 0.00 0.00 61.69 59.96 1uyg s THR 152 Cb -0.13 -0.53 0.05 0.00 -1.51 0.00 0.00 72.50 70.37 1uyg s THR 152 CO 0.02 -0.27 0.14 -0.75 -2.21 0.00 0.00 174.62 171.54 1uyg s LYS 153 N -1.20 0.02 0.02 7.08 2.47 0.82 -1.62 119.74 127.33 1uyg s LYS 153 Ca -0.13 0.44 -0.01 0.00 -1.56 0.00 0.00 55.97 54.72 1uyg s LYS 153 Cb -0.06 -0.53 -0.04 0.00 -1.46 0.00 0.00 37.83 35.74 1uyg s LYS 153 CO 0.03 -0.37 0.14 -1.58 0.16 0.00 0.00 175.35 173.73 1uyg s HIS 154 N 2.26 3.41 0.38 4.03 5.65 -1.25 -1.07 115.29 128.70 1uyg s HIS 154 Ca 0.04 0.25 0.17 0.00 0.25 0.00 0.00 55.06 55.77 1uyg s HIS 154 Cb -0.13 -1.75 1.08 0.00 -1.18 0.00 0.00 32.58 30.60 1uyg s HIS 154 CO -0.06 0.59 1.75 -0.91 -0.65 0.00 0.00 174.74 175.45 1uyg h ASN 155 N 3.67 0.48 0.03 9.88 2.35 -1.90 -2.18 115.58 127.91 1uyg h ASN 155 Ca -0.48 0.10 0.00 0.00 -0.55 0.00 0.00 56.30 55.37 1uyg h ASN 155 Cb 1.18 0.03 0.00 0.00 0.05 0.00 0.00 38.32 39.58 1uyg h ASN 155 CO 0.68 0.06 -0.02 0.47 -1.65 0.00 0.00 177.43 176.97 1uyg n ASP 156 N -4.70 0.88 -3.40 5.81 8.00 -1.26 -4.93 116.55 116.94 1uyg n ASP 156 Ca 0.27 -1.22 -0.18 0.00 0.71 0.00 0.00 54.79 54.37 1uyg n ASP 156 Cb 0.90 -0.00 -0.08 0.00 -0.02 0.00 0.00 41.12 41.92 1uyg n ASP 156 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1uyg s ASP 157 N -2.06 1.42 0.78 -2.24 -1.08 -0.82 -5.12 116.67 107.55 1uyg s ASP 157 Ca 0.40 -1.68 -0.10 0.00 -0.52 0.00 0.00 52.55 50.65 1uyg s ASP 157 Cb 0.21 0.56 0.09 0.00 -1.46 0.00 0.00 42.92 42.32 1uyg s ASP 157 CO 0.37 -1.09 1.12 -1.61 0.52 0.00 0.00 175.17 174.47 1uyg s GLU 158 N -3.43 1.88 0.10 4.34 0.41 -1.26 -4.56 118.70 116.17 1uyg s GLU 158 Ca 0.39 -0.18 -0.28 0.00 -0.41 0.00 0.00 54.97 54.49 1uyg s GLU 158 Cb 0.02 -2.05 -0.06 0.00 -1.78 0.00 0.00 34.13 30.26 1uyg s GLU 158 CO 0.25 -1.54 0.89 -1.14 -0.49 0.00 0.00 175.26 173.23 1uyg s GLN 159 N -5.45 4.63 0.16 1.61 0.74 -1.26 -4.49 119.66 115.60 1uyg s GLN 159 Ca 0.63 1.32 0.09 0.00 0.05 0.00 0.00 55.36 57.44 1uyg s GLN 159 Cb -0.10 -3.37 -0.04 0.00 1.10 0.00 0.00 33.01 30.61 1uyg s GLN 159 CO 0.47 0.26 -0.19 0.71 -0.55 0.00 0.00 175.29 175.99 1uyg s TYR 160 N -0.10 1.87 -0.18 1.67 2.02 -0.64 -0.59 117.35 121.40 1uyg s TYR 160 Ca 0.44 -0.45 0.01 0.00 -0.37 0.00 0.00 57.07 56.70 1uyg s TYR 160 Cb -0.22 -0.94 0.02 0.00 -0.40 0.00 0.00 41.96 40.41 1uyg s TYR 160 CO 0.28 0.33 -0.20 0.00 -1.57 0.00 0.00 175.55 174.39 1uyg s ALA 161 N -1.89 2.30 -0.02 3.71 0.00 0.51 -1.82 121.76 124.55 1uyg s ALA 161 Ca 0.15 -1.20 -0.01 0.00 0.00 0.00 0.00 51.96 50.90 1uyg s ALA 161 Cb -0.07 -1.16 -0.04 0.00 0.00 0.00 0.00 23.12 21.85 1uyg s ALA 161 CO 0.07 -0.33 0.08 -0.46 0.00 0.00 0.00 175.76 175.12 1uyg s TRP 162 N 1.27 3.31 -0.10 0.00 -0.00 0.62 -0.99 118.94 123.06 1uyg s TRP 162 Ca 0.04 0.24 -0.16 0.00 -0.00 0.00 0.00 56.10 56.22 1uyg s TRP 162 Cb -0.13 -1.76 0.04 0.00 -0.00 0.00 0.00 33.47 31.61 1uyg s TRP 162 CO -0.12 0.56 0.39 -2.00 -0.00 0.00 0.00 176.95 175.78 1uyg s GLU 163 N -1.60 0.59 -0.24 5.86 2.12 -0.15 -0.11 118.70 125.17 1uyg s GLU 163 Ca 0.21 0.28 -0.18 0.00 0.36 0.00 0.00 54.97 55.64 1uyg s GLU 163 Cb -0.12 0.27 0.07 0.00 0.26 0.00 0.00 34.13 34.61 1uyg s GLU 163 CO 0.12 -0.12 0.61 0.45 -0.54 0.00 0.00 175.26 175.78 1uyg s SER 164 N -0.44 -0.71 -0.36 -1.70 0.15 -0.62 -0.52 113.70 109.51 1uyg s SER 164 Ca -0.06 1.27 0.08 0.00 0.70 0.00 0.00 55.95 57.94 1uyg s SER 164 Cb -0.03 1.22 0.66 0.00 -1.71 0.00 0.00 66.02 66.16 1uyg s SER 164 CO 0.03 -0.22 1.77 -1.20 1.20 0.00 0.00 173.24 174.82 1uyg n SER 165 N 3.45 3.96 0.00 5.45 7.64 -1.26 -1.22 113.62 131.64 1uyg n SER 165 Ca -0.17 -3.45 0.00 0.00 1.01 0.00 0.00 58.87 56.25 1uyg n SER 165 Cb 0.57 -0.75 0.00 0.00 -1.01 0.00 0.00 64.21 63.02 1uyg n SER 165 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1uyg n ALA 166 N -0.72 0.00 -1.05 -0.43 0.00 -1.26 -4.89 120.51 112.15 1uyg n ALA 166 Ca 0.46 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.88 1uyg n ALA 166 Cb 1.41 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 20.85 1uyg n ALA 166 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1uyg n GLY 167 N 0.00 0.37 0.00 0.00 0.00 -1.26 -3.75 105.19 100.55 1uyg n GLY 167 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.95 1uyg n GLY 167 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1uyg n GLY 168 N -0.76 0.50 3.10 -0.02 0.00 -1.26 -5.07 105.19 101.67 1uyg n GLY 168 Ca -0.02 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.91 1uyg n GLY 168 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1uyg s SER 169 N -2.23 0.75 0.10 1.61 1.04 -1.25 -2.04 113.70 111.68 1uyg s SER 169 Ca 0.00 -0.88 0.00 0.00 0.48 0.00 0.00 55.95 55.55 1uyg s SER 169 Cb 0.00 0.13 -0.04 0.00 0.10 0.00 0.00 66.02 66.21 1uyg s SER 169 CO 0.00 -0.46 -0.02 0.72 0.98 0.00 0.00 173.24 174.46 1uyg s PHE 170 N -3.18 0.82 0.24 5.02 -0.12 -0.26 -4.37 117.98 116.12 1uyg s PHE 170 Ca 0.04 -1.04 0.12 0.00 -0.05 0.00 0.00 56.93 55.99 1uyg s PHE 170 Cb 0.02 -0.50 -0.05 0.00 -0.63 0.00 0.00 43.02 41.87 1uyg s PHE 170 CO -0.06 -0.30 -0.22 0.95 -0.05 0.00 0.00 175.22 175.54 1uyg s THR 171 N -3.80 2.42 -0.02 -4.49 -4.23 0.32 0.05 115.64 105.89 1uyg s THR 171 Ca 0.15 -2.22 0.02 0.00 -1.18 0.00 0.00 61.69 58.46 1uyg s THR 171 Cb 0.07 -2.21 0.00 0.00 1.34 0.00 0.00 72.50 71.69 1uyg s THR 171 CO -0.04 -0.26 -0.08 -0.69 -0.54 0.00 0.00 174.62 173.02 1uyg s VAL 172 N -2.09 0.67 0.03 2.29 1.01 -0.26 -0.98 120.40 121.07 1uyg s VAL 172 Ca 0.25 -0.32 -0.03 0.00 0.00 0.00 0.00 61.98 61.88 1uyg s VAL 172 Cb -0.06 -0.59 -0.02 0.00 0.00 0.00 0.00 36.38 35.71 1uyg s VAL 172 CO 0.12 0.21 0.05 0.00 0.00 0.00 0.00 175.10 175.48 1uyg s ARG 173 N 0.07 0.47 0.30 2.72 1.70 -0.16 -1.87 118.95 122.19 1uyg s ARG 173 Ca -0.01 -0.69 -0.29 0.00 -0.47 0.00 0.00 55.73 54.27 1uyg s ARG 173 Cb -0.06 0.18 -0.10 0.00 -0.57 0.00 0.00 34.95 34.39 1uyg s ARG 173 CO 0.00 -0.10 1.39 0.95 -1.08 0.00 0.00 175.30 176.46 1uyg s THR 174 N -2.12 2.59 -0.20 4.99 -4.23 -1.26 -0.36 115.64 115.04 1uyg s THR 174 Ca -0.09 0.55 -0.20 0.00 -1.18 0.00 0.00 61.69 60.77 1uyg s THR 174 Cb -0.04 -3.35 -0.03 0.00 1.34 0.00 0.00 72.50 70.42 1uyg s THR 174 CO -0.03 0.11 0.61 -0.62 -0.54 0.00 0.00 174.62 174.15 1uyg s ASP 175 N -0.09 6.65 0.00 3.99 2.15 0.24 -4.73 116.67 124.88 1uyg s ASP 175 Ca 0.54 0.79 0.25 0.00 0.43 0.00 0.00 52.55 54.56 1uyg s ASP 175 Cb -0.42 -2.34 0.77 0.00 -0.30 0.00 0.00 42.92 40.64 1uyg s ASP 175 CO 0.51 -0.26 1.58 0.35 -0.17 0.00 0.00 175.17 177.18 1uyg n THR 176 N 4.71 0.09 -0.24 1.71 -2.24 -1.26 -4.79 114.28 112.25 1uyg n THR 176 Ca -0.02 -0.36 -0.06 0.00 -2.27 0.00 0.00 64.05 61.34 1uyg n THR 176 Cb 0.50 0.70 0.06 0.00 -2.10 0.00 0.00 70.33 69.48 1uyg n THR 176 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1uyg n GLY 177 N 1.22 -3.33 3.68 3.38 0.00 -1.26 -4.90 105.19 103.99 1uyg n GLY 177 Ca 0.17 -1.32 -0.45 0.00 0.00 0.00 0.00 46.02 44.42 1uyg n GLY 177 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1uyg n GLU 178 N -2.55 2.34 -1.81 1.61 4.07 -1.26 -4.94 120.64 118.10 1uyg n GLU 178 Ca 0.03 0.85 -0.41 0.00 -0.06 0.00 0.00 57.16 57.56 1uyg n GLU 178 Cb 0.12 -2.66 -0.01 0.00 -0.06 0.00 0.00 31.44 28.83 1uyg n GLU 178 CO 0.00 0.00 0.00 -2.14 -0.06 0.00 0.00 177.13 174.93 1uyg s PRO 179 N 1.75 4.12 0.00 5.31 0.02 -1.26 -4.96 135.00 139.99 1uyg s PRO 179 Ca 0.81 2.56 0.11 0.00 0.02 0.00 0.00 61.00 64.50 1uyg s PRO 179 Cb -0.63 -2.99 0.16 0.00 0.02 0.00 0.00 34.50 31.07 1uyg s PRO 179 CO 0.39 -0.55 0.99 0.00 -0.33 0.00 0.00 177.00 177.50 1uyg n MET 180 N 0.95 1.34 0.00 5.54 0.00 -1.26 -5.03 117.12 118.66 1uyg n MET 180 Ca 0.03 -1.47 0.00 0.00 0.00 0.00 0.00 57.70 56.26 1uyg n MET 180 Cb 0.39 -1.23 0.00 0.00 0.00 0.00 0.00 33.22 32.38 1uyg n MET 180 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1uyg n GLY 181 N 0.59 2.15 3.64 3.17 0.00 -1.26 -4.69 105.19 108.79 1uyg n GLY 181 Ca 0.08 -0.22 -0.06 0.00 0.00 0.00 0.00 46.02 45.82 1uyg n GLY 181 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1uyg s ARG 182 N 0.00 0.43 0.00 1.61 3.52 -1.25 -4.86 118.95 118.40 1uyg s ARG 182 Ca 0.00 0.58 0.00 0.00 -0.13 0.00 0.00 55.73 56.18 1uyg s ARG 182 Cb 0.00 0.17 0.00 0.00 -1.56 0.00 0.00 34.95 33.56 1uyg s ARG 182 CO 0.00 -0.06 0.00 0.41 -0.81 0.00 0.00 175.30 174.84 1uyg n GLY 183 N 2.66 0.90 2.92 8.12 0.00 -0.23 -4.49 105.19 115.07 1uyg n GLY 183 Ca -0.14 -1.93 -0.13 0.00 0.00 0.00 0.00 46.02 43.81 1uyg n GLY 183 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1uyg s THR 184 N -2.55 -0.02 -0.10 2.61 2.01 -1.00 -0.13 115.64 116.47 1uyg s THR 184 Ca 0.00 0.09 0.04 0.00 0.31 0.00 0.00 61.69 62.12 1uyg s THR 184 Cb 0.00 -0.15 0.00 0.00 0.01 0.00 0.00 72.50 72.36 1uyg s THR 184 CO 0.00 0.03 -0.22 -0.54 -0.69 0.00 0.00 174.62 173.20 1uyg s LYS 185 N 0.52 2.88 -0.30 4.92 1.02 0.88 -0.59 119.74 129.08 1uyg s LYS 185 Ca -0.04 -0.82 -0.06 0.00 0.02 0.00 0.00 55.97 55.08 1uyg s LYS 185 Cb -0.06 -2.20 0.02 0.00 -0.52 0.00 0.00 37.83 35.08 1uyg s LYS 185 CO -0.02 0.14 0.06 0.08 -0.92 0.00 0.00 175.35 174.69 1uyg s VAL 186 N 0.42 3.70 -0.34 3.17 1.01 0.17 -1.00 120.40 127.53 1uyg s VAL 186 Ca -0.17 -0.87 -0.14 0.00 0.00 0.00 0.00 61.98 60.80 1uyg s VAL 186 Cb -0.18 -2.96 -0.02 0.00 0.00 0.00 0.00 36.38 33.23 1uyg s VAL 186 CO 0.07 0.03 0.28 -0.63 0.00 0.00 0.00 175.10 174.85 1uyg s ILE 187 N 1.44 5.25 -0.40 2.22 1.01 0.13 -0.99 121.20 129.87 1uyg s ILE 187 Ca 0.01 -0.14 -0.16 0.00 0.00 0.00 0.00 60.65 60.36 1uyg s ILE 187 Cb -0.18 -3.75 0.01 0.00 0.01 0.00 0.00 42.46 38.56 1uyg s ILE 187 CO 0.01 -0.03 0.39 -0.76 0.00 0.00 0.00 174.94 174.55 1uyg s LEU 188 N 1.81 4.81 -0.66 2.97 1.43 0.22 -1.46 118.68 127.79 1uyg s LEU 188 Ca 0.08 -0.61 -0.25 0.00 -1.03 0.00 0.00 54.13 52.31 1uyg s LEU 188 Cb -0.17 -2.33 0.04 0.00 0.03 0.00 0.00 46.19 43.77 1uyg s LEU 188 CO 0.11 -0.49 1.12 -1.00 0.23 0.00 0.00 176.35 176.31 1uyg s HIS 189 N 2.01 2.53 0.43 0.29 3.76 -0.08 -1.61 115.29 122.62 1uyg s HIS 189 Ca 0.10 -0.11 -0.24 0.00 -0.15 0.00 0.00 55.06 54.66 1uyg s HIS 189 Cb -0.17 -4.42 -0.08 0.00 1.11 0.00 0.00 32.58 29.02 1uyg s HIS 189 CO 0.12 -1.75 1.18 -0.51 -0.85 0.00 0.00 174.74 172.93 1uyg s LEU 190 N 4.82 4.11 0.67 0.89 1.43 -0.66 -0.66 118.68 129.27 1uyg s LEU 190 Ca 0.32 2.36 -0.17 0.00 -1.03 0.00 0.00 54.13 55.60 1uyg s LEU 190 Cb -0.11 -4.11 0.00 0.00 0.03 0.00 0.00 46.19 42.00 1uyg s LEU 190 CO 0.16 -0.81 1.27 -0.54 0.23 0.00 0.00 176.35 176.66 1uyg s LYS 191 N -2.48 2.44 0.31 1.70 1.02 0.23 -4.56 119.74 118.40 1uyg s LYS 191 Ca 0.60 1.99 0.08 0.00 0.02 0.00 0.00 55.97 58.66 1uyg s LYS 191 Cb -0.30 -1.84 0.81 0.00 -0.52 0.00 0.00 37.83 35.97 1uyg s LYS 191 CO 0.38 -1.66 1.76 1.49 -0.92 0.00 0.00 175.35 176.40 1uyg h GLU 192 N 0.34 0.67 -0.66 1.68 4.81 -1.94 -0.75 114.58 118.73 1uyg h GLU 192 Ca -0.50 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 58.69 1uyg h GLU 192 Cb 1.33 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 30.56 1uyg h GLU 192 CO 0.52 0.44 0.00 -0.40 -0.73 0.00 0.00 179.01 178.84 1uyg n ASP 193 N -4.79 3.74 -0.59 1.04 5.75 -1.26 -4.27 116.55 116.17 1uyg n ASP 193 Ca 0.24 -2.45 0.05 0.00 -0.01 0.00 0.00 54.79 52.63 1uyg n ASP 193 Cb 0.64 -0.54 0.19 0.00 -1.03 0.00 0.00 41.12 40.38 1uyg n ASP 193 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1uyg n GLN 194 N 0.57 1.68 0.00 0.11 1.13 -0.29 -4.76 117.38 115.83 1uyg n GLN 194 Ca 0.18 -3.03 0.13 0.00 -1.94 0.00 0.00 57.00 52.34 1uyg n GLN 194 Cb 0.75 -1.65 0.71 0.00 0.11 0.00 0.00 30.24 30.17 1uyg n GLN 194 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 1uyg n THR 195 N -1.15 0.10 0.27 5.09 -2.24 -1.26 -2.97 114.28 112.12 1uyg n THR 195 Ca 0.21 0.02 0.15 0.00 -2.27 0.00 0.00 64.05 62.16 1uyg n THR 195 Cb 0.77 -0.58 0.86 0.00 -2.10 0.00 0.00 70.33 69.28 1uyg n THR 195 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 1uyg h GLU 196 N 0.00 0.00 0.00 -0.78 4.11 -1.95 -1.25 114.58 114.71 1uyg h GLU 196 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1uyg h GLU 196 Cb 0.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.45 1uyg h GLU 196 CO 0.00 0.00 0.00 0.66 0.07 0.00 0.00 179.01 179.74 1uyg n TYR 197 N -3.94 0.00 1.03 2.06 4.01 -1.16 -1.94 117.16 117.22 1uyg n TYR 197 Ca -0.02 0.00 0.11 0.00 -0.16 0.00 0.00 57.90 57.83 1uyg n TYR 197 Cb 0.13 0.00 0.10 0.00 -0.31 0.00 0.00 39.34 39.27 1uyg n TYR 197 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 1uyg n LEU 198 N -0.89 0.87 -4.75 7.72 4.77 -0.47 -4.81 117.00 119.44 1uyg n LEU 198 Ca 0.17 -0.28 -0.39 0.00 -0.03 0.00 0.00 56.01 55.48 1uyg n LEU 198 Cb 0.08 -0.12 -0.05 0.00 -2.33 0.00 0.00 43.42 40.99 1uyg n LEU 198 CO 0.13 0.20 0.30 -1.61 -1.33 0.00 0.00 177.39 175.08 1uyg s GLU 199 N -2.90 4.34 0.12 3.23 2.02 -0.82 -4.86 118.70 119.82 1uyg s GLU 199 Ca 0.12 0.74 -0.20 0.00 0.02 0.00 0.00 54.97 55.65 1uyg s GLU 199 Cb 0.17 -3.36 -0.05 0.00 0.10 0.00 0.00 34.13 30.98 1uyg s GLU 199 CO 0.73 0.31 1.73 1.49 0.02 0.00 0.00 175.26 179.54 1uyg h GLU 200 N 5.88 0.07 0.00 1.61 4.81 -1.93 -1.82 114.58 123.21 1uyg h GLU 200 Ca -0.44 -0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 58.72 1uyg h GLU 200 Cb 1.20 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.55 1uyg h GLU 200 CO 0.71 0.05 -0.31 0.07 -0.73 0.00 0.00 179.01 178.80 1uyg h ARG 201 N 0.08 0.00 -0.16 1.92 0.11 -1.94 -1.78 114.38 112.60 1uyg h ARG 201 Ca 0.08 0.00 -0.15 0.00 0.10 0.00 0.00 59.98 60.01 1uyg h ARG 201 Cb 0.08 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.17 1uyg h ARG 201 CO -0.12 0.31 -0.47 -0.09 0.10 0.00 0.00 179.97 179.71 1uyg h ARG 202 N 0.00 0.60 -0.31 0.08 9.65 -1.70 -2.06 114.38 120.65 1uyg h ARG 202 Ca -0.00 -0.43 -0.01 0.00 -1.10 0.00 0.00 59.98 58.44 1uyg h ARG 202 Cb 0.67 0.07 -0.01 0.00 -1.39 0.00 0.00 29.97 29.31 1uyg h ARG 202 CO 0.04 1.05 0.16 0.82 2.80 0.00 0.00 179.97 184.85 1uyg h ILE 203 N 0.26 1.13 -0.12 1.20 1.08 -1.08 -1.68 117.51 118.31 1uyg h ILE 203 Ca -0.01 -0.35 0.03 0.00 -0.39 0.00 0.00 64.86 64.13 1uyg h ILE 203 Cb 1.08 0.81 -0.03 0.00 -3.07 0.00 0.00 36.82 35.62 1uyg h ILE 203 CO 0.10 0.13 -0.06 0.11 -0.69 0.00 0.00 178.15 177.75 1uyg h LYS 204 N 0.37 -0.05 -0.57 2.37 1.57 -1.34 -0.55 116.57 118.37 1uyg h LYS 204 Ca 0.11 0.00 0.08 0.00 -1.87 0.00 0.00 60.65 58.97 1uyg h LYS 204 Cb 0.07 0.01 -0.07 0.00 0.08 0.00 0.00 32.23 32.32 1uyg h LYS 204 CO -0.02 -0.03 0.22 1.49 -0.57 0.00 0.00 179.45 180.54 1uyg h GLU 205 N -0.05 0.40 -0.56 3.15 4.81 -1.23 -0.75 114.58 120.35 1uyg h GLU 205 Ca 0.07 -0.02 -0.09 0.00 -0.13 0.00 0.00 59.36 59.19 1uyg h GLU 205 Cb 0.15 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.42 1uyg h GLU 205 CO -0.16 0.26 0.00 0.82 -0.73 0.00 0.00 179.01 179.21 1uyg h ILE 206 N 0.41 1.26 -0.29 2.32 2.04 -0.52 -1.57 117.51 121.16 1uyg h ILE 206 Ca 0.28 -1.12 -0.03 0.00 1.00 0.00 0.00 64.86 64.99 1uyg h ILE 206 Cb 0.32 0.87 -0.01 0.00 -0.74 0.00 0.00 36.82 37.26 1uyg h ILE 206 CO -0.27 0.40 0.04 0.58 0.00 0.00 0.00 178.15 178.90 1uyg h VAL 207 N 0.87 1.23 -0.92 1.67 2.07 -0.79 -1.41 116.25 118.97 1uyg h VAL 207 Ca 0.16 -0.80 0.05 0.00 0.82 0.00 0.00 66.70 66.92 1uyg h VAL 207 Cb 0.54 1.21 -0.06 0.00 -1.52 0.00 0.00 31.29 31.46 1uyg h VAL 207 CO 0.03 0.26 0.59 0.50 0.02 0.00 0.00 177.57 178.97 1uyg h LYS 208 N 0.29 1.08 -0.10 1.57 3.64 -1.04 0.93 116.57 122.95 1uyg h LYS 208 Ca 0.09 -0.06 -0.22 0.00 -1.27 0.00 0.00 60.65 59.18 1uyg h LYS 208 Cb 0.34 -0.24 0.01 0.00 -0.41 0.00 0.00 32.23 31.94 1uyg h LYS 208 CO 0.01 0.71 -0.81 -0.22 -2.27 0.00 0.00 179.45 176.87 1uyg h LYS 209 N 1.11 0.72 0.00 1.90 3.64 -1.04 -3.38 116.57 119.52 1uyg h LYS 209 Ca 0.39 -0.64 0.00 0.00 -1.27 0.00 0.00 60.65 59.12 1uyg h LYS 209 Cb 0.09 0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.07 1uyg h LYS 209 CO -0.15 1.25 -0.96 0.72 -2.27 0.00 0.00 179.45 178.03 1uyg n HIS 210 N -3.97 0.00 -2.16 1.91 8.25 -0.55 -4.78 115.22 113.92 1uyg n HIS 210 Ca -0.09 0.00 0.05 0.00 -0.26 0.00 0.00 57.72 57.42 1uyg n HIS 210 Cb 0.76 -0.05 0.08 0.00 1.12 0.00 0.00 29.99 31.91 1uyg n HIS 210 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 1uyg n SER 211 N -1.50 1.22 0.20 0.41 7.64 0.29 -4.90 113.62 116.99 1uyg n SER 211 Ca -0.00 -2.65 0.06 0.00 1.01 0.00 0.00 58.87 57.29 1uyg n SER 211 Cb 0.06 -0.37 0.43 0.00 -1.01 0.00 0.00 64.21 63.32 1uyg n SER 211 CO 0.00 0.00 0.00 0.06 -3.01 0.00 0.00 175.04 172.09 1uyg h GLN 212 N 0.94 0.00 -0.28 1.43 -0.00 -1.66 -3.18 115.11 112.36 1uyg h GLN 212 Ca -0.14 0.00 -0.03 0.00 -0.00 0.00 0.00 58.65 58.48 1uyg h GLN 212 Cb 1.57 0.00 -0.02 0.00 -0.00 0.00 0.00 27.48 29.03 1uyg h GLN 212 CO 0.06 0.32 0.00 1.19 -0.00 0.00 0.00 178.83 180.40 1uyg n PHE 213 N -3.78 1.00 -1.75 0.06 3.72 -1.26 -5.00 117.46 110.44 1uyg n PHE 213 Ca -0.01 -0.98 -0.42 0.00 -0.05 0.00 0.00 57.45 55.99 1uyg n PHE 213 Cb 0.41 -0.35 -0.02 0.00 -0.94 0.00 0.00 39.48 38.58 1uyg n PHE 213 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 1uyg s ILE 214 N -2.89 2.02 -0.20 4.37 -1.09 -1.20 -4.88 121.20 117.32 1uyg s ILE 214 Ca 0.43 0.01 -0.00 0.00 -2.23 0.00 0.00 60.65 58.86 1uyg s ILE 214 Cb 0.35 -3.01 0.16 0.00 -1.58 0.00 0.00 42.46 38.39 1uyg s ILE 214 CO 0.08 0.00 1.85 0.61 -1.23 0.00 0.00 174.94 176.25 1uyg n GLY 215 N 2.61 3.42 3.22 6.18 0.00 -1.26 -4.79 105.19 114.56 1uyg n GLY 215 Ca 0.10 -0.66 -0.13 0.00 0.00 0.00 0.00 46.02 45.33 1uyg n GLY 215 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1uyg s TYR 216 N -1.20 -0.24 0.26 1.61 2.02 -1.26 -5.11 117.35 113.43 1uyg s TYR 216 Ca 0.20 0.50 -0.31 0.00 -0.37 0.00 0.00 57.07 57.10 1uyg s TYR 216 Cb 0.16 0.10 -0.12 0.00 -0.40 0.00 0.00 41.96 41.70 1uyg s TYR 216 CO 0.01 -0.29 1.59 -2.30 -1.57 0.00 0.00 175.55 172.98 1uyg n PRO 217 N 1.98 2.56 -3.94 -1.71 -0.02 -1.26 -4.84 135.00 127.76 1uyg n PRO 217 Ca -0.18 0.91 -0.35 0.00 -2.02 0.00 0.00 63.50 61.87 1uyg n PRO 217 Cb 0.57 -2.69 -0.14 0.00 -0.02 0.00 0.00 33.50 31.22 1uyg n PRO 217 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1uyg s ILE 218 N 0.28 2.97 -0.28 4.25 1.01 -1.26 -1.29 121.20 126.89 1uyg s ILE 218 Ca 0.68 -0.98 -0.08 0.00 0.00 0.00 0.00 60.65 60.27 1uyg s ILE 218 Cb -0.54 -2.50 -0.02 0.00 0.01 0.00 0.00 42.46 39.41 1uyg s ILE 218 CO 0.45 0.20 0.10 -0.89 0.00 0.00 0.00 174.94 174.80 1uyg s THR 219 N 1.34 4.37 -0.48 2.92 2.01 -0.10 -4.99 115.64 120.71 1uyg s THR 219 Ca 0.01 -0.32 -0.23 0.00 0.31 0.00 0.00 61.69 61.46 1uyg s THR 219 Cb -0.17 -3.14 0.03 0.00 0.01 0.00 0.00 72.50 69.24 1uyg s THR 219 CO -0.04 0.21 0.79 -0.22 -0.69 0.00 0.00 174.62 174.67 1uyg s LEU 220 N 1.60 4.33 0.51 4.42 2.96 -1.26 -0.39 118.68 130.85 1uyg s LEU 220 Ca 0.05 -0.29 -0.21 0.00 -0.22 0.00 0.00 54.13 53.46 1uyg s LEU 220 Cb -0.16 -2.84 -0.06 0.00 0.50 0.00 0.00 46.19 43.62 1uyg s LEU 220 CO 0.04 -0.97 1.15 -0.36 -1.32 0.00 0.00 176.35 174.89 1uyg s PHE 221 N 3.31 2.75 0.45 5.38 0.40 -0.19 -4.98 117.98 125.10 1uyg s PHE 221 Ca 0.27 1.54 0.07 0.00 -0.60 0.00 0.00 56.93 58.21 1uyg s PHE 221 Cb -0.13 -3.34 -0.02 0.00 0.51 0.00 0.00 43.02 40.03 1uyg s PHE 221 CO 0.20 -1.57 0.27 0.14 0.70 0.00 0.00 175.22 174.96 1uyg s VAL 222 N -1.66 2.21 0.11 -0.44 -7.23 -1.26 -4.51 120.40 107.63 1uyg s VAL 222 Ca 0.69 -1.57 0.05 0.00 -1.81 0.00 0.00 61.98 59.33 1uyg s VAL 222 Cb -0.26 -2.79 -0.04 0.00 0.56 0.00 0.00 36.38 33.85 1uyg s VAL 222 CO 0.31 0.00 0.05 -1.61 -0.31 0.00 0.00 175.10 173.54 1uyg s GLU 223 N -4.04 2.70 0.00 4.82 2.02 -1.26 -4.98 118.70 117.96 1uyg s GLU 223 Ca 0.40 -0.83 0.00 0.00 0.02 0.00 0.00 54.97 54.56 1uyg s GLU 223 Cb 0.01 -2.60 0.00 0.00 0.10 0.00 0.00 34.13 31.64 1uyg s GLU 223 CO 0.23 0.53 0.00 1.17 0.02 0.00 0.00 175.26 177.20