#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d0b s VAL 17 N 0.00 3.97 -0.15 3.84 1.01 -1.26 -4.47 120.40 123.33 3d0b s VAL 17 Ca 0.00 -0.31 -0.07 0.00 0.00 0.00 0.00 61.98 61.60 3d0b s VAL 17 Cb 0.00 -2.79 -0.04 0.00 0.00 0.00 0.00 36.38 33.55 3d0b s VAL 17 CO 0.00 0.43 0.11 -1.61 0.00 0.00 0.00 175.10 174.03 3d0b s GLU 18 N 0.94 3.68 -0.10 2.72 2.02 -0.65 -4.98 118.70 122.33 3d0b s GLU 18 Ca 0.01 -0.22 0.01 0.00 0.02 0.00 0.00 54.97 54.79 3d0b s GLU 18 Cb -0.14 -3.22 -0.02 0.00 0.10 0.00 0.00 34.13 30.85 3d0b s GLU 18 CO 0.02 0.56 -0.12 0.99 0.02 0.00 0.00 175.26 176.73 3d0b s THR 19 N -0.41 3.19 0.09 3.63 2.01 -1.26 -1.14 115.64 121.74 3d0b s THR 19 Ca 0.11 -0.64 0.07 0.00 0.31 0.00 0.00 61.69 61.54 3d0b s THR 19 Cb -0.12 -2.31 -0.03 0.00 0.01 0.00 0.00 72.50 70.05 3d0b s THR 19 CO 0.02 0.55 -0.18 -0.36 -0.69 0.00 0.00 174.62 173.96 3d0b s PHE 20 N -0.13 1.56 -0.07 4.92 0.40 0.47 -4.99 117.98 120.14 3d0b s PHE 20 Ca -0.01 -0.43 -0.20 0.00 -0.60 0.00 0.00 56.93 55.70 3d0b s PHE 20 Cb -0.13 -0.87 -0.04 0.00 0.51 0.00 0.00 43.02 42.49 3d0b s PHE 20 CO 0.03 0.14 0.56 0.00 0.70 0.00 0.00 175.22 176.65 3d0b s ALA 21 N -1.18 3.45 0.52 5.36 0.00 -1.26 -1.21 121.76 127.43 3d0b s ALA 21 Ca 0.03 -0.06 -0.22 0.00 0.00 0.00 0.00 51.96 51.71 3d0b s ALA 21 Cb -0.10 -2.73 -0.06 0.00 0.00 0.00 0.00 23.12 20.23 3d0b s ALA 21 CO 0.03 0.03 1.32 -0.06 0.00 0.00 0.00 175.76 177.08 3d0b s PHE 22 N 0.41 2.44 0.71 0.00 0.08 -0.32 -4.95 117.98 116.36 3d0b s PHE 22 Ca 0.30 1.40 -0.16 0.00 0.12 0.00 0.00 56.93 58.60 3d0b s PHE 22 Cb -0.16 -3.71 0.03 0.00 -0.57 0.00 0.00 43.02 38.60 3d0b s PHE 22 CO 0.14 -2.57 1.22 1.14 -0.10 0.00 0.00 175.22 175.04 3d0b s GLN 23 N -2.81 2.24 0.26 0.44 -2.07 -1.26 -4.74 119.66 111.71 3d0b s GLN 23 Ca 0.69 1.81 -0.01 0.00 -1.82 0.00 0.00 55.36 56.02 3d0b s GLN 23 Cb -0.38 -1.84 0.52 0.00 -1.09 0.00 0.00 33.01 30.22 3d0b s GLN 23 CO 0.45 -1.77 1.77 0.00 -1.32 0.00 0.00 175.29 174.42 3d0b h ALA 24 N -0.12 1.28 -0.59 2.60 0.00 -1.99 -1.80 119.26 118.65 3d0b h ALA 24 Ca -0.48 0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.45 3d0b h ALA 24 Cb 1.30 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 19.03 3d0b h ALA 24 CO 0.50 -0.05 0.16 0.93 0.00 0.00 0.00 179.25 180.79 3d0b h GLU 25 N 0.66 0.93 -0.21 0.00 3.07 -1.96 -0.32 114.58 116.75 3d0b h GLU 25 Ca 0.46 -0.22 -0.04 0.00 -0.50 0.00 0.00 59.36 59.06 3d0b h GLU 25 Cb 0.61 -0.13 -0.01 0.00 -0.84 0.00 0.00 28.75 28.38 3d0b h GLU 25 CO -0.34 0.85 -0.01 0.82 -1.40 0.00 0.00 179.01 178.93 3d0b h ILE 26 N 0.84 1.26 -0.87 3.13 1.08 -1.72 -0.14 117.51 121.08 3d0b h ILE 26 Ca 0.19 -0.90 0.10 0.00 -0.39 0.00 0.00 64.86 63.85 3d0b h ILE 26 Cb 0.33 1.44 -0.07 0.00 -3.07 0.00 0.00 36.82 35.44 3d0b h ILE 26 CO -0.00 0.28 0.51 0.00 -0.69 0.00 0.00 178.15 178.25 3d0b h ALA 27 N 0.78 1.25 -0.40 1.87 0.00 -1.20 0.39 119.26 121.96 3d0b h ALA 27 Ca 0.06 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 3d0b h ALA 27 Cb 0.41 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 3d0b h ALA 27 CO 0.01 0.14 0.18 0.37 0.00 0.00 0.00 179.25 179.96 3d0b h GLN 28 N 0.85 0.59 -0.45 0.00 4.15 -0.74 -0.58 115.11 118.94 3d0b h GLN 28 Ca 0.42 -0.10 -0.03 0.00 0.77 0.00 0.00 58.65 59.71 3d0b h GLN 28 Cb 0.38 -0.10 -0.02 0.00 0.21 0.00 0.00 27.48 27.94 3d0b h GLN 28 CO -0.25 0.54 0.15 1.25 -1.93 0.00 0.00 178.83 178.59 3d0b h LEU 29 N 0.51 0.65 -0.86 -2.39 5.85 -0.41 -1.20 115.31 117.46 3d0b h LEU 29 Ca 0.14 -0.20 0.00 0.00 0.84 0.00 0.00 57.88 58.66 3d0b h LEU 29 Cb 0.15 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 40.97 3d0b h LEU 29 CO -0.01 0.67 0.55 0.24 -0.34 0.00 0.00 178.44 179.55 3d0b h MET 30 N 0.59 1.14 -0.60 1.25 2.86 -0.69 -0.76 114.93 118.71 3d0b h MET 30 Ca 0.15 -0.08 -0.01 0.00 -2.06 0.00 0.00 59.70 57.70 3d0b h MET 30 Cb 0.25 -0.25 -0.03 0.00 0.06 0.00 0.00 31.60 31.63 3d0b h MET 30 CO -0.01 0.77 0.35 0.77 1.06 0.00 0.00 176.91 179.85 3d0b h SER 31 N 1.17 0.74 -0.58 1.22 0.02 -0.86 -1.66 113.55 113.59 3d0b h SER 31 Ca 0.31 -0.08 0.02 0.00 -0.84 0.00 0.00 61.79 61.21 3d0b h SER 31 Cb -0.11 -0.19 -0.04 0.00 0.14 0.00 0.00 62.40 62.21 3d0b h SER 31 CO -0.06 0.60 0.36 0.25 -1.14 0.00 0.00 176.83 176.83 3d0b h LEU 32 N 0.82 0.58 -0.89 5.07 6.46 -0.60 0.26 115.31 127.02 3d0b h LEU 32 Ca 0.21 0.00 -0.05 0.00 -0.12 0.00 0.00 57.88 57.92 3d0b h LEU 32 Cb 0.01 -0.12 -0.03 0.00 -0.73 0.00 0.00 40.66 39.79 3d0b h LEU 32 CO -0.04 0.41 0.20 0.40 -0.62 0.00 0.00 178.44 178.80 3d0b h ILE 33 N 0.71 1.25 -0.08 4.05 2.04 -0.88 0.50 117.51 125.10 3d0b h ILE 33 Ca 0.23 -0.85 -0.21 0.00 1.00 0.00 0.00 64.86 65.02 3d0b h ILE 33 Cb 0.01 0.52 0.00 0.00 -0.74 0.00 0.00 36.82 36.61 3d0b h ILE 33 CO -0.09 0.33 -0.82 0.40 0.00 0.00 0.00 178.15 177.97 3d0b h ILE 34 N 0.98 1.34 0.00 -0.67 2.04 -0.87 -3.38 117.51 116.95 3d0b h ILE 34 Ca 0.22 -2.17 -0.30 0.00 1.00 0.00 0.00 64.86 63.61 3d0b h ILE 34 Cb 0.29 2.16 -0.05 0.00 -0.74 0.00 0.00 36.82 38.48 3d0b h ILE 34 CO -0.01 0.66 -1.93 0.59 0.00 0.00 0.00 178.15 177.47 3d0b n ASN 35 N -3.85 0.53 -4.73 1.72 3.02 0.89 -4.94 115.26 107.91 3d0b n ASN 35 Ca -0.06 0.25 -0.42 0.00 -0.03 0.00 0.00 54.58 54.32 3d0b n ASN 35 Cb 0.76 0.40 -0.03 0.00 -0.61 0.00 0.00 39.78 40.31 3d0b n ASN 35 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3d0b s THR 36 N -2.62 3.10 -0.16 3.41 2.01 0.14 -4.96 115.64 116.56 3d0b s THR 36 Ca -0.06 0.87 -0.29 0.00 0.31 0.00 0.00 61.69 62.51 3d0b s THR 36 Cb 0.08 -3.56 -0.02 0.00 0.01 0.00 0.00 72.50 69.01 3d0b s THR 36 CO 0.83 0.11 1.38 0.12 -0.69 0.00 0.00 174.62 176.37 3d0b s PHE 37 N 0.39 2.59 -0.29 4.92 5.36 -1.26 -4.96 117.98 124.72 3d0b s PHE 37 Ca 0.60 0.78 0.00 0.00 -0.96 0.00 0.00 56.93 57.35 3d0b s PHE 37 Cb -0.38 -3.68 0.19 0.00 -0.34 0.00 0.00 43.02 38.81 3d0b s PHE 37 CO 0.37 -2.25 0.58 -0.47 -1.46 0.00 0.00 175.22 171.99 3d0b s TYR 38 N 3.86 -1.58 -0.09 10.12 5.04 -1.26 -5.06 117.35 128.38 3d0b s TYR 38 Ca 0.60 1.52 0.19 0.00 -2.44 0.00 0.00 57.07 56.94 3d0b s TYR 38 Cb -0.24 0.47 0.39 0.00 0.35 0.00 0.00 41.96 42.94 3d0b s TYR 38 CO 0.20 -0.90 1.60 0.77 -1.34 0.00 0.00 175.55 175.87 3d0b h SER 39 N 8.02 0.00 -0.28 4.32 0.02 -2.03 -3.38 113.55 120.21 3d0b h SER 39 Ca -0.19 0.00 -0.55 0.00 -0.84 0.00 0.00 61.79 60.22 3d0b h SER 39 Cb 1.16 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 63.67 3d0b h SER 39 CO 0.24 0.35 2.25 -3.20 -1.14 0.00 0.00 176.83 175.33 3d0b n ASN 40 N -3.28 7.57 0.27 3.07 4.05 -1.26 -4.64 115.26 121.03 3d0b n ASN 40 Ca 0.02 -2.70 0.15 0.00 0.45 0.00 0.00 54.58 52.50 3d0b n ASN 40 Cb 0.61 -1.46 0.70 0.00 1.23 0.00 0.00 39.78 40.85 3d0b n ASN 40 CO 0.00 0.00 0.00 0.11 -3.05 0.00 0.00 177.26 174.32 3d0b h LYS 41 N 4.25 0.00 0.00 1.20 1.57 -1.96 -3.26 116.57 118.37 3d0b h LYS 41 Ca 0.63 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.41 3d0b h LYS 41 Cb 0.64 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.95 3d0b h LYS 41 CO 1.26 0.08 0.00 1.05 -0.57 0.00 0.00 179.45 181.27 3d0b h GLU 42 N 0.00 0.00 0.00 3.15 4.11 -1.97 -2.20 114.58 117.67 3d0b h GLU 42 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 3d0b h GLU 42 Cb 0.48 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.73 3d0b h GLU 42 CO 0.01 0.00 0.00 0.44 0.07 0.00 0.00 179.01 179.53 3d0b n ILE 43 N -2.74 1.01 -0.31 -1.06 -6.64 -1.23 -2.33 119.36 106.06 3d0b n ILE 43 Ca -0.02 0.38 0.08 0.00 -1.77 0.00 0.00 62.75 61.42 3d0b n ILE 43 Cb 0.06 -1.30 0.29 0.00 -1.44 0.00 0.00 39.64 37.24 3d0b n ILE 43 CO 0.00 0.00 0.00 2.19 -1.77 0.00 0.00 176.55 176.97 3d0b h PHE 44 N 0.00 1.00 -0.21 4.28 -0.00 -1.66 -2.57 116.94 117.78 3d0b h PHE 44 Ca 0.00 0.03 -0.09 0.00 -0.00 0.00 0.00 57.97 57.91 3d0b h PHE 44 Cb 0.23 -0.32 -0.00 0.00 -0.00 0.00 0.00 35.95 35.85 3d0b h PHE 44 CO 0.00 0.42 -0.20 1.25 -0.00 0.00 0.00 178.31 179.77 3d0b h LEU 45 N 0.89 0.55 -1.61 2.10 5.85 -1.73 -1.76 115.31 119.61 3d0b h LEU 45 Ca 0.46 -0.47 -0.01 0.00 0.84 0.00 0.00 57.88 58.69 3d0b h LEU 45 Cb 0.51 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.37 3d0b h LEU 45 CO -0.22 0.91 0.09 0.08 -0.34 0.00 0.00 178.44 178.96 3d0b h ARG 46 N 0.20 0.35 -0.37 1.25 0.11 -1.68 -0.24 114.38 114.00 3d0b h ARG 46 Ca 0.04 -0.04 -0.09 0.00 0.10 0.00 0.00 59.98 59.99 3d0b h ARG 46 Cb 0.75 -0.07 -0.01 0.00 1.11 0.00 0.00 29.97 31.75 3d0b h ARG 46 CO 0.05 0.30 -0.13 0.93 0.10 0.00 0.00 179.97 181.22 3d0b h GLU 47 N 0.35 0.74 -0.35 0.08 4.39 -1.04 0.05 114.58 118.81 3d0b h GLU 47 Ca 0.09 -0.30 -0.15 0.00 0.34 0.00 0.00 59.36 59.33 3d0b h GLU 47 Cb 0.09 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.70 3d0b h GLU 47 CO -0.01 0.91 -0.39 -0.07 -1.16 0.00 0.00 179.01 178.28 3d0b h LEU 48 N 0.53 0.90 -0.89 1.33 3.38 -0.94 -1.51 115.31 118.12 3d0b h LEU 48 Ca 0.09 -0.41 -0.07 0.00 0.09 0.00 0.00 57.88 57.58 3d0b h LEU 48 Cb 0.66 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 3d0b h LEU 48 CO 0.04 1.18 0.08 0.40 0.09 0.00 0.00 178.44 180.24 3d0b h ILE 49 N 0.69 1.24 -0.50 1.22 2.04 -1.00 -1.30 117.51 119.91 3d0b h ILE 49 Ca 0.06 -0.95 0.01 0.00 1.00 0.00 0.00 64.86 64.98 3d0b h ILE 49 Cb 0.97 0.72 -0.03 0.00 -0.74 0.00 0.00 36.82 37.74 3d0b h ILE 49 CO 0.09 0.35 0.33 -1.28 0.00 0.00 0.00 178.15 177.64 3d0b h SER 50 N 0.86 0.56 -0.50 1.72 0.87 -0.83 0.23 113.55 116.46 3d0b h SER 50 Ca 0.18 -0.01 0.04 0.00 -1.23 0.00 0.00 61.79 60.76 3d0b h SER 50 Cb 0.39 -0.14 -0.04 0.00 -0.44 0.00 0.00 62.40 62.17 3d0b h SER 50 CO 0.01 0.40 0.26 0.78 -0.53 0.00 0.00 176.83 177.75 3d0b h ASN 51 N 0.67 0.38 -0.09 6.23 2.35 -0.93 0.32 115.58 124.52 3d0b h ASN 51 Ca 0.19 0.02 -0.00 0.00 -0.55 0.00 0.00 56.30 55.96 3d0b h ASN 51 Cb -0.06 -0.05 -0.00 0.00 0.05 0.00 0.00 38.32 38.25 3d0b h ASN 51 CO -0.05 0.27 0.05 0.28 -1.65 0.00 0.00 177.43 176.33 3d0b h SER 52 N 0.51 0.10 -0.46 5.81 0.02 -0.78 -1.25 113.55 117.50 3d0b h SER 52 Ca 0.22 -0.04 0.06 0.00 -0.84 0.00 0.00 61.79 61.18 3d0b h SER 52 Cb 0.11 -0.03 -0.05 0.00 0.14 0.00 0.00 62.40 62.57 3d0b h SER 52 CO -0.14 0.12 0.16 -1.28 -1.14 0.00 0.00 176.83 174.55 3d0b h SER 53 N 0.08 0.16 -0.85 3.07 0.87 -0.21 0.59 113.55 117.26 3d0b h SER 53 Ca 0.03 0.05 0.01 0.00 -1.23 0.00 0.00 61.79 60.66 3d0b h SER 53 Cb 0.03 0.04 -0.04 0.00 -0.44 0.00 0.00 62.40 61.99 3d0b h SER 53 CO -0.01 0.13 0.56 0.44 -0.53 0.00 0.00 176.83 177.42 3d0b h ASP 54 N 0.33 0.97 -0.30 6.23 3.32 -0.77 0.12 116.42 126.32 3d0b h ASP 54 Ca 0.22 -0.02 -0.10 0.00 0.02 0.00 0.00 57.03 57.14 3d0b h ASP 54 Cb 0.22 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.51 3d0b h ASP 54 CO -0.22 0.70 -0.17 0.00 -1.72 0.00 0.00 179.24 177.83 3d0b h ALA 55 N 1.32 0.95 -0.28 3.45 0.00 -0.60 -1.23 119.26 122.88 3d0b h ALA 55 Ca 0.32 -0.34 -0.08 0.00 0.00 0.00 0.00 54.91 54.80 3d0b h ALA 55 Cb -0.12 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 3d0b h ALA 55 CO -0.07 0.61 -0.15 -0.07 0.00 0.00 0.00 179.25 179.56 3d0b h LEU 56 N 0.67 0.62 -0.82 0.00 3.38 -0.48 -1.55 115.31 117.13 3d0b h LEU 56 Ca 0.10 -0.42 0.10 0.00 0.09 0.00 0.00 57.88 57.76 3d0b h LEU 56 Cb 0.65 -0.17 -0.08 0.00 0.09 0.00 0.00 40.66 41.16 3d0b h LEU 56 CO 0.05 0.90 0.46 0.44 0.09 0.00 0.00 178.44 180.37 3d0b h ASP 57 N 0.34 0.63 0.08 -0.43 3.32 -0.59 -1.23 116.42 118.53 3d0b h ASP 57 Ca 0.06 0.06 -0.00 0.00 0.02 0.00 0.00 57.03 57.16 3d0b h ASP 57 Cb 0.68 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.17 3d0b h ASP 57 CO 0.04 0.35 -0.04 0.50 -1.72 0.00 0.00 179.24 178.37 3d0b h LYS 58 N 0.75 -0.11 -0.61 3.56 3.64 -1.07 0.11 116.57 122.83 3d0b h LYS 58 Ca 0.40 0.01 -0.06 0.00 -1.27 0.00 0.00 60.65 59.73 3d0b h LYS 58 Cb 0.41 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.23 3d0b h LYS 58 CO -0.27 0.14 0.13 0.97 -2.27 0.00 0.00 179.45 178.15 3d0b h ILE 59 N -0.35 1.25 -0.26 2.00 6.09 -1.37 -1.19 117.51 123.69 3d0b h ILE 59 Ca -0.01 -0.93 0.02 0.00 -1.37 0.00 0.00 64.86 62.57 3d0b h ILE 59 Cb 0.30 0.64 -0.02 0.00 0.47 0.00 0.00 36.82 38.21 3d0b h ILE 59 CO 0.02 0.35 0.12 -0.09 -3.07 0.00 0.00 178.15 175.48 3d0b h ARG 60 N 0.92 0.26 -0.34 2.19 2.43 -1.06 0.54 114.38 119.32 3d0b h ARG 60 Ca 0.19 -0.02 -0.03 0.00 -0.81 0.00 0.00 59.98 59.32 3d0b h ARG 60 Cb 0.36 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.84 3d0b h ARG 60 CO 0.00 0.17 0.10 -0.92 -1.51 0.00 0.00 179.97 177.81 3d0b h TYR 61 N 0.26 0.56 -0.76 2.20 3.20 -0.80 -2.80 116.97 118.83 3d0b h TYR 61 Ca 0.11 -0.06 0.00 0.00 3.14 0.00 0.00 58.73 61.92 3d0b h TYR 61 Cb 0.04 -0.16 -0.04 0.00 1.54 0.00 0.00 36.73 38.11 3d0b h TYR 61 CO -0.10 0.56 0.49 0.93 -1.64 0.00 0.00 178.16 178.40 3d0b h GLU 62 N 0.40 1.02 0.00 1.82 5.08 -0.98 -2.42 114.58 119.50 3d0b h GLU 62 Ca 0.11 -0.07 -0.00 0.00 -1.00 0.00 0.00 59.36 58.39 3d0b h GLU 62 Cb 0.27 -0.22 -0.00 0.00 0.50 0.00 0.00 28.75 29.29 3d0b h GLU 62 CO -0.00 0.69 -0.02 0.66 -1.00 0.00 0.00 179.01 179.33 3d0b h SER 63 N 1.04 0.00 0.28 1.42 4.64 -0.62 -1.92 113.55 118.39 3d0b h SER 63 Ca 0.28 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.55 3d0b h SER 63 Cb -0.09 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 61.99 3d0b h SER 63 CO -0.06 0.02 -0.25 -0.07 -0.87 0.00 0.00 176.83 175.60 3d0b h LEU 64 N 0.00 0.00 0.00 5.97 3.38 -1.35 -2.13 115.31 121.18 3d0b h LEU 64 Ca -0.00 0.00 -0.32 0.00 0.09 0.00 0.00 57.88 57.65 3d0b h LEU 64 Cb 0.31 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.00 3d0b h LEU 64 CO 0.00 0.25 -2.30 0.35 0.09 0.00 0.00 178.44 176.83 3d0b n THR 65 N -4.16 1.19 -3.63 0.22 -2.24 -0.92 -4.73 114.28 100.00 3d0b n THR 65 Ca -0.02 -0.79 -0.29 0.00 -2.27 0.00 0.00 64.05 60.68 3d0b n THR 65 Cb 0.31 -0.42 -0.12 0.00 -2.10 0.00 0.00 70.33 68.00 3d0b n THR 65 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3d0b s ASP 66 N -5.30 3.25 0.56 3.42 -1.08 -0.77 -4.99 116.67 111.77 3d0b s ASP 66 Ca -0.09 -2.81 0.27 0.00 -0.52 0.00 0.00 52.55 49.39 3d0b s ASP 66 Cb 0.07 -0.89 1.49 0.00 -1.46 0.00 0.00 42.92 42.12 3d0b s ASP 66 CO 0.81 -0.23 2.01 -0.65 0.52 0.00 0.00 175.17 177.63 3d0b h PRO 67 N 6.38 0.00 0.00 4.34 0.11 -1.66 -1.72 132.00 139.45 3d0b h PRO 67 Ca 0.08 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.19 3d0b h PRO 67 Cb 0.91 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.02 3d0b h PRO 67 CO 0.46 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.12 3d0b n SER 68 N -4.06 0.33 0.10 -2.05 3.41 -1.26 -2.09 113.62 107.99 3d0b n SER 68 Ca 0.07 0.60 0.10 0.00 -0.26 0.00 0.00 58.87 59.37 3d0b n SER 68 Cb 0.52 -0.66 0.43 0.00 -0.26 0.00 0.00 64.21 64.24 3d0b n SER 68 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3d0b n LYS 69 N -1.88 0.12 -0.16 4.33 5.02 -0.65 -1.66 118.16 123.28 3d0b n LYS 69 Ca 0.02 0.44 0.12 0.00 -2.02 0.00 0.00 58.31 56.87 3d0b n LYS 69 Cb 0.15 -1.78 0.20 0.00 -0.02 0.00 0.00 35.03 33.58 3d0b n LYS 69 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3d0b n LEU 70 N -2.02 3.42 -0.03 -0.35 4.77 -0.89 -4.30 117.00 117.61 3d0b n LEU 70 Ca 0.01 -1.42 0.16 0.00 -0.03 0.00 0.00 56.01 54.74 3d0b n LEU 70 Cb 0.16 -0.21 0.61 0.00 -2.33 0.00 0.00 43.42 41.64 3d0b n LEU 70 CO 0.14 0.71 1.18 0.44 -1.33 0.00 0.00 177.39 178.54 3d0b h ASP 71 N 4.56 0.15 0.00 -1.43 3.32 -1.49 0.19 116.42 121.73 3d0b h ASP 71 Ca 0.00 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.06 3d0b h ASP 71 Cb 1.00 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.52 3d0b h ASP 71 CO 0.00 0.09 0.00 -1.54 -1.72 0.00 0.00 179.24 176.07 3d0b n SER 72 N -4.43 0.00 0.00 6.45 3.41 -1.26 -4.87 113.62 112.92 3d0b n SER 72 Ca 0.10 -1.37 0.00 0.00 -0.26 0.00 0.00 58.87 57.33 3d0b n SER 72 Cb 0.50 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.45 3d0b n SER 72 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3d0b n GLY 73 N 0.75 3.91 0.09 5.00 0.00 0.67 -3.84 105.19 111.77 3d0b n GLY 73 Ca 0.14 -0.57 -0.05 0.00 0.00 0.00 0.00 46.02 45.54 3d0b n GLY 73 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3d0b h LYS 74 N 0.00 0.00 -6.53 1.61 1.79 -1.88 -3.43 116.57 108.12 3d0b h LYS 74 Ca 0.00 0.00 -0.53 0.00 -2.18 0.00 0.00 60.65 57.94 3d0b h LYS 74 Cb 0.00 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 30.66 3d0b h LYS 74 CO 0.00 0.61 0.63 -2.00 -1.08 0.00 0.00 179.45 177.62 3d0b s GLU 75 N -2.75 4.39 -0.34 3.15 2.12 -1.26 -4.99 118.70 119.01 3d0b s GLU 75 Ca -0.01 1.92 -0.02 0.00 0.36 0.00 0.00 54.97 57.22 3d0b s GLU 75 Cb 0.09 -3.29 0.08 0.00 0.26 0.00 0.00 34.13 31.26 3d0b s GLU 75 CO 0.81 -0.32 0.08 -0.51 -0.54 0.00 0.00 175.26 174.77 3d0b s LEU 76 N 0.93 4.45 0.26 2.70 1.43 -1.26 -4.75 118.68 122.44 3d0b s LEU 76 Ca 0.61 -1.62 -0.14 0.00 -1.03 0.00 0.00 54.13 51.95 3d0b s LEU 76 Cb -0.33 -1.75 0.00 0.00 0.03 0.00 0.00 46.19 44.14 3d0b s LEU 76 CO 0.31 -0.37 0.52 -1.38 0.23 0.00 0.00 176.35 175.66 3d0b s HIS 77 N 1.18 0.29 -0.06 0.29 -3.43 -1.26 -4.38 115.29 107.92 3d0b s HIS 77 Ca 0.01 -0.67 0.03 0.00 -0.80 0.00 0.00 55.06 53.64 3d0b s HIS 77 Cb -0.21 0.27 0.01 0.00 -1.43 0.00 0.00 32.58 31.22 3d0b s HIS 77 CO -0.03 -1.04 -0.15 0.42 -2.00 0.00 0.00 174.74 171.94 3d0b s ILE 78 N -3.96 1.28 -0.06 -5.38 1.01 -0.21 -2.73 121.20 111.15 3d0b s ILE 78 Ca 0.21 -0.60 0.04 0.00 0.00 0.00 0.00 60.65 60.30 3d0b s ILE 78 Cb -0.02 -1.13 -0.02 0.00 0.01 0.00 0.00 42.46 41.30 3d0b s ILE 78 CO 0.09 0.38 -0.17 0.20 0.00 0.00 0.00 174.94 175.44 3d0b s ASN 79 N 0.36 3.77 -0.20 3.58 0.02 0.67 -0.85 114.94 122.29 3d0b s ASN 79 Ca -0.10 -0.29 -0.02 0.00 -1.02 0.00 0.00 52.86 51.43 3d0b s ASN 79 Cb -0.14 -0.86 -0.00 0.00 0.02 0.00 0.00 41.25 40.27 3d0b s ASN 79 CO 0.03 0.31 -0.10 -0.76 0.02 0.00 0.00 177.10 176.60 3d0b s LEU 80 N -0.51 2.67 -0.28 0.60 1.43 0.21 -0.32 118.68 122.47 3d0b s LEU 80 Ca 0.07 -0.45 0.00 0.00 -1.03 0.00 0.00 54.13 52.72 3d0b s LEU 80 Cb -0.12 -1.65 0.08 0.00 0.03 0.00 0.00 46.19 44.54 3d0b s LEU 80 CO 0.01 0.01 0.04 -0.63 0.23 0.00 0.00 176.35 176.01 3d0b s ILE 81 N 1.29 1.24 0.25 -0.59 1.01 0.64 -0.86 121.20 124.17 3d0b s ILE 81 Ca 0.03 -1.41 -0.16 0.00 0.00 0.00 0.00 60.65 59.11 3d0b s ILE 81 Cb -0.14 -1.80 -0.08 0.00 0.01 0.00 0.00 42.46 40.45 3d0b s ILE 81 CO -0.05 -0.46 0.68 -2.16 0.00 0.00 0.00 174.94 172.95 3d0b s PRO 82 N 1.47 4.06 -0.28 2.79 0.04 -1.26 -0.88 135.00 140.94 3d0b s PRO 82 Ca 0.05 0.66 -0.02 0.00 0.04 0.00 0.00 61.00 61.73 3d0b s PRO 82 Cb -0.18 -2.68 0.12 0.00 0.04 0.00 0.00 34.50 31.80 3d0b s PRO 82 CO -0.15 0.30 0.23 1.21 0.04 0.00 0.00 177.00 178.63 3d0b s ASN 83 N -1.99 2.22 0.32 6.66 3.84 0.04 -4.76 114.94 121.26 3d0b s ASN 83 Ca 0.47 -0.85 0.05 0.00 0.21 0.00 0.00 52.86 52.74 3d0b s ASN 83 Cb -0.13 0.22 0.54 0.00 -0.55 0.00 0.00 41.25 41.32 3d0b s ASN 83 CO 0.19 -0.40 1.79 0.11 -2.79 0.00 0.00 177.10 176.01 3d0b h LYS 84 N 8.32 0.41 -0.63 0.43 1.57 -1.93 0.92 116.57 125.66 3d0b h LYS 84 Ca -0.16 -0.13 0.01 0.00 -1.87 0.00 0.00 60.65 58.50 3d0b h LYS 84 Cb 1.07 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 33.31 3d0b h LYS 84 CO 0.36 0.59 0.42 -0.56 -0.57 0.00 0.00 179.45 179.68 3d0b h GLN 85 N 0.37 0.82 -0.01 3.15 3.07 -1.96 -2.67 115.11 117.89 3d0b h GLN 85 Ca 0.06 -0.05 0.00 0.00 0.09 0.00 0.00 58.65 58.75 3d0b h GLN 85 Cb 0.55 -0.19 0.00 0.00 0.08 0.00 0.00 27.48 27.93 3d0b h GLN 85 CO 0.04 0.55 -0.43 -0.25 0.09 0.00 0.00 178.83 178.83 3d0b n ASP 86 N -4.65 1.00 -3.87 0.06 8.00 -1.14 -4.97 116.55 110.99 3d0b n ASP 86 Ca 0.05 -0.80 -0.24 0.00 0.71 0.00 0.00 54.79 54.51 3d0b n ASP 86 Cb 0.02 0.30 -0.00 0.00 -0.02 0.00 0.00 41.12 41.41 3d0b n ASP 86 CO 0.00 0.00 0.00 -1.14 -0.39 0.00 0.00 177.20 175.67 3d0b n ARG 87 N -0.89 -3.65 -4.53 -1.24 0.63 0.24 -4.87 116.66 102.34 3d0b n ARG 87 Ca 0.09 0.47 -0.25 0.00 -0.92 0.00 0.00 57.85 57.24 3d0b n ARG 87 Cb 0.36 -4.69 -0.14 0.00 0.45 0.00 0.00 32.46 28.44 3d0b n ARG 87 CO 0.00 0.00 0.00 0.95 -2.51 0.00 0.00 177.63 176.07 3d0b s THR 88 N -3.86 1.63 -0.17 5.15 -4.23 -0.69 -1.68 115.64 111.80 3d0b s THR 88 Ca 0.02 -1.27 0.00 0.00 -1.18 0.00 0.00 61.69 59.27 3d0b s THR 88 Cb -0.01 -1.44 0.00 0.00 1.34 0.00 0.00 72.50 72.40 3d0b s THR 88 CO 0.87 0.12 -0.16 -0.22 -0.54 0.00 0.00 174.62 174.68 3d0b s LEU 89 N -1.36 2.38 -0.14 4.79 2.96 -0.59 -0.78 118.68 125.93 3d0b s LEU 89 Ca 0.07 -0.53 -0.01 0.00 -0.22 0.00 0.00 54.13 53.44 3d0b s LEU 89 Cb -0.09 -1.54 -0.02 0.00 0.50 0.00 0.00 46.19 45.04 3d0b s LEU 89 CO 0.02 0.05 -0.10 -0.89 -1.32 0.00 0.00 176.35 174.11 3d0b s THR 90 N 1.00 3.28 -0.30 3.68 2.01 -0.06 -0.64 115.64 124.61 3d0b s THR 90 Ca -0.02 -0.58 -0.07 0.00 0.31 0.00 0.00 61.69 61.33 3d0b s THR 90 Cb -0.15 -2.40 0.01 0.00 0.01 0.00 0.00 72.50 69.98 3d0b s THR 90 CO -0.04 0.51 0.09 -0.63 -0.69 0.00 0.00 174.62 173.87 3d0b s ILE 91 N 0.39 4.00 -0.09 1.82 1.09 -0.34 -0.26 121.20 127.80 3d0b s ILE 91 Ca -0.09 -0.73 0.01 0.00 -1.10 0.00 0.00 60.65 58.75 3d0b s ILE 91 Cb -0.15 -3.09 -0.02 0.00 -1.06 0.00 0.00 42.46 38.14 3d0b s ILE 91 CO 0.05 0.04 -0.12 -0.69 -0.10 0.00 0.00 174.94 174.12 3d0b s VAL 92 N 1.50 3.21 0.11 2.92 1.01 0.56 -0.95 120.40 128.75 3d0b s VAL 92 Ca 0.02 -0.64 0.01 0.00 0.00 0.00 0.00 61.98 61.37 3d0b s VAL 92 Cb -0.17 -2.31 -0.04 0.00 0.00 0.00 0.00 36.38 33.86 3d0b s VAL 92 CO 0.03 0.56 -0.04 1.51 0.00 0.00 0.00 175.10 177.16 3d0b s ASP 93 N -0.30 1.03 -0.49 3.32 1.47 0.23 -0.24 116.67 121.69 3d0b s ASP 93 Ca 0.03 -1.04 0.03 0.00 1.18 0.00 0.00 52.55 52.74 3d0b s ASP 93 Cb -0.13 0.12 0.48 0.00 -0.34 0.00 0.00 42.92 43.05 3d0b s ASP 93 CO 0.03 -0.51 1.69 0.35 0.68 0.00 0.00 175.17 177.41 3d0b n THR 94 N -0.06 3.13 -0.41 2.11 -2.24 -1.11 -1.56 114.28 114.14 3d0b n THR 94 Ca -0.11 -3.26 0.00 0.00 -2.27 0.00 0.00 64.05 58.41 3d0b n THR 94 Cb 0.61 -1.01 0.00 0.00 -2.10 0.00 0.00 70.33 67.83 3d0b n THR 94 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3d0b n GLY 95 N -0.89 -1.86 0.27 3.38 0.00 -1.26 -4.70 105.19 100.12 3d0b n GLY 95 Ca 0.53 -1.51 0.11 0.00 0.00 0.00 0.00 46.02 45.16 3d0b n GLY 95 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3d0b h ILE 96 N -0.95 0.71 -0.70 -0.61 2.10 -1.63 -3.16 117.51 113.27 3d0b h ILE 96 Ca 0.00 -0.33 0.07 0.00 1.08 0.00 0.00 64.86 65.67 3d0b h ILE 96 Cb 0.00 1.20 -0.02 0.00 -1.09 0.00 0.00 36.82 36.91 3d0b h ILE 96 CO 0.00 0.08 -0.09 0.61 -1.08 0.00 0.00 178.15 177.68 3d0b n GLY 97 N -1.04 -2.06 2.97 8.18 0.00 -1.26 -4.31 105.19 107.68 3d0b n GLY 97 Ca -0.02 -1.40 -0.17 0.00 0.00 0.00 0.00 46.02 44.42 3d0b n GLY 97 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3d0b s MET 98 N -0.87 0.58 0.78 1.61 1.00 -1.26 -4.77 119.30 116.37 3d0b s MET 98 Ca 0.00 -0.23 -0.11 0.00 0.00 0.00 0.00 55.69 55.36 3d0b s MET 98 Cb 0.00 -0.56 0.07 0.00 0.00 0.00 0.00 34.83 34.34 3d0b s MET 98 CO 0.00 0.12 1.14 0.95 0.00 0.00 0.00 175.02 177.23 3d0b s THR 99 N -0.04 2.12 0.25 2.05 -4.23 -1.26 -3.98 115.64 110.55 3d0b s THR 99 Ca 0.01 -0.05 -0.04 0.00 -1.18 0.00 0.00 61.69 60.43 3d0b s THR 99 Cb -0.04 -3.02 0.23 0.00 1.34 0.00 0.00 72.50 71.01 3d0b s THR 99 CO -0.00 -0.02 1.85 0.50 -0.54 0.00 0.00 174.62 176.40 3d0b h LYS 100 N -0.93 0.95 -0.47 3.99 3.64 -1.97 -1.98 116.57 119.79 3d0b h LYS 100 Ca -0.46 -0.06 -0.07 0.00 -1.27 0.00 0.00 60.65 58.79 3d0b h LYS 100 Cb 1.32 -0.21 -0.02 0.00 -0.41 0.00 0.00 32.23 32.91 3d0b h LYS 100 CO 0.65 0.63 -0.00 0.00 -2.27 0.00 0.00 179.45 178.45 3d0b h ALA 101 N 1.44 1.11 0.02 5.00 0.00 -1.98 -0.64 119.26 124.21 3d0b h ALA 101 Ca 0.40 -0.26 0.02 0.00 0.00 0.00 0.00 54.91 55.07 3d0b h ALA 101 Cb 0.24 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 3d0b h ALA 101 CO -0.20 0.57 -0.16 -0.44 0.00 0.00 0.00 179.25 179.03 3d0b h ASP 102 N 0.73 -0.45 -0.73 0.00 3.32 -1.80 0.13 116.42 117.62 3d0b h ASP 102 Ca 0.14 0.06 -0.03 0.00 0.02 0.00 0.00 57.03 57.23 3d0b h ASP 102 Cb 0.45 0.18 -0.03 0.00 0.22 0.00 0.00 39.33 40.15 3d0b h ASP 102 CO 0.02 -0.22 0.36 -0.07 -1.72 0.00 0.00 179.24 177.61 3d0b h LEU 103 N -0.27 0.96 0.11 1.55 3.38 -0.86 -2.03 115.31 118.14 3d0b h LEU 103 Ca 0.04 -0.13 -0.33 0.00 0.09 0.00 0.00 57.88 57.56 3d0b h LEU 103 Cb 0.32 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 3d0b h LEU 103 CO -0.13 0.82 -1.75 0.40 0.09 0.00 0.00 178.44 177.86 3d0b h ILE 104 N 1.03 0.77 0.00 1.22 2.04 -1.10 -3.46 117.51 118.01 3d0b h ILE 104 Ca 0.25 -2.34 -0.04 0.00 1.00 0.00 0.00 64.86 63.74 3d0b h ILE 104 Cb 0.11 2.51 -0.01 0.00 -0.74 0.00 0.00 36.82 38.70 3d0b h ILE 104 CO -0.03 0.76 -0.71 0.59 0.00 0.00 0.00 178.15 178.76 3d0b n ASN 105 N -3.74 0.77 0.03 1.72 3.02 0.27 -4.76 115.26 112.57 3d0b n ASN 105 Ca -0.30 0.11 -0.13 0.00 -0.03 0.00 0.00 54.58 54.23 3d0b n ASN 105 Cb 0.96 -0.26 -0.08 0.00 -0.61 0.00 0.00 39.78 39.79 3d0b n ASN 105 CO 0.00 0.00 0.00 0.78 -2.62 0.00 0.00 177.26 175.42 3d0b h ASN 106 N -0.16 -0.04 -0.65 6.41 2.35 -0.96 -0.93 115.58 121.60 3d0b h ASN 106 Ca -0.06 -0.22 0.00 0.00 -0.55 0.00 0.00 56.30 55.48 3d0b h ASN 106 Cb 0.63 0.01 -0.03 0.00 0.05 0.00 0.00 38.32 38.98 3d0b h ASN 106 CO -0.03 0.20 0.41 -0.07 -1.65 0.00 0.00 177.43 176.29 3d0b h LEU 107 N -0.27 0.76 -0.67 1.61 3.38 -1.61 -2.05 115.31 116.46 3d0b h LEU 107 Ca -0.00 -0.04 -0.10 0.00 0.09 0.00 0.00 57.88 57.83 3d0b h LEU 107 Cb 0.25 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 3d0b h LEU 107 CO 0.01 0.57 -0.09 1.23 0.09 0.00 0.00 178.44 180.25 3d0b h GLY 108 N 0.88 1.02 0.97 0.83 0.00 -1.75 -0.18 103.07 104.83 3d0b h GLY 108 Ca 0.24 -0.79 0.01 0.00 0.00 0.00 0.00 47.33 46.78 3d0b h GLY 108 CO -0.05 0.72 0.07 -0.84 0.00 0.00 0.00 176.54 176.44 3d0b h THR 109 N 0.85 1.01 -0.46 4.70 2.02 -0.93 -1.59 112.91 118.51 3d0b h THR 109 Ca 0.14 -0.05 -0.07 0.00 0.77 0.00 0.00 66.41 67.20 3d0b h THR 109 Cb 0.62 0.85 -0.02 0.00 -1.74 0.00 0.00 68.15 67.86 3d0b h THR 109 CO 0.04 0.03 0.00 0.40 0.37 0.00 0.00 175.52 176.36 3d0b h ILE 110 N 0.15 1.26 0.00 3.11 1.08 -1.24 -3.12 117.51 118.75 3d0b h ILE 110 Ca 0.05 -1.05 -0.02 0.00 -0.39 0.00 0.00 64.86 63.45 3d0b h ILE 110 Cb -0.00 1.03 -0.00 0.00 -3.07 0.00 0.00 36.82 34.78 3d0b h ILE 110 CO -0.03 0.36 -0.10 0.00 -0.69 0.00 0.00 178.15 177.70 3d0b h ALA 111 N 0.92 1.77 -0.47 1.87 0.00 -0.85 -3.09 119.26 119.42 3d0b h ALA 111 Ca 0.13 -0.09 0.08 0.00 0.00 0.00 0.00 54.91 55.03 3d0b h ALA 111 Cb 0.50 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.21 3d0b h ALA 111 CO 0.02 0.12 0.09 -0.22 0.00 0.00 0.00 179.25 179.26 3d0b h LYS 112 N 0.00 0.21 -0.21 0.00 3.64 -1.22 0.34 116.57 119.33 3d0b h LYS 112 Ca -0.00 -0.01 -0.19 0.00 -1.27 0.00 0.00 60.65 59.17 3d0b h LYS 112 Cb 0.18 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 31.95 3d0b h LYS 112 CO 0.01 0.14 -0.64 0.66 -2.27 0.00 0.00 179.45 177.36 3d0b h SER 113 N 0.22 0.87 -0.76 4.20 4.64 -1.71 -1.93 113.55 119.07 3d0b h SER 113 Ca 0.23 -0.51 0.02 0.00 -0.47 0.00 0.00 61.79 61.07 3d0b h SER 113 Cb 0.31 -0.25 -0.04 0.00 -0.31 0.00 0.00 62.40 62.11 3d0b h SER 113 CO -0.31 1.29 0.50 1.23 -0.87 0.00 0.00 176.83 178.66 3d0b h GLY 114 N 0.77 1.09 0.95 -0.77 0.00 -1.46 -1.36 103.07 102.29 3d0b h GLY 114 Ca -0.01 -0.39 -0.01 0.00 0.00 0.00 0.00 47.33 46.92 3d0b h GLY 114 CO 0.13 0.36 0.15 -0.84 0.00 0.00 0.00 176.54 176.34 3d0b h THR 115 N 1.00 1.13 -0.01 4.70 2.02 -0.25 0.14 112.91 121.64 3d0b h THR 115 Ca 0.29 -0.35 0.02 0.00 0.77 0.00 0.00 66.41 67.15 3d0b h THR 115 Cb -0.07 0.86 -0.03 0.00 -1.74 0.00 0.00 68.15 67.17 3d0b h THR 115 CO -0.08 0.13 -0.14 0.50 0.37 0.00 0.00 175.52 176.29 3d0b h LYS 116 N 0.32 -0.23 -0.80 6.66 3.64 -1.02 0.10 116.57 125.25 3d0b h LYS 116 Ca 0.10 0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.45 3d0b h LYS 116 Cb 0.08 0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 31.91 3d0b h LYS 116 CO -0.01 -0.15 0.33 0.00 -2.27 0.00 0.00 179.45 177.35 3d0b h ALA 117 N 0.72 1.08 -0.09 5.00 0.00 -1.14 -1.77 119.26 123.07 3d0b h ALA 117 Ca 0.05 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 3d0b h ALA 117 Cb 0.30 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 3d0b h ALA 117 CO -0.15 0.66 0.02 0.35 0.00 0.00 0.00 179.25 180.13 3d0b h PHE 118 N 1.15 0.16 -0.41 0.00 3.57 -0.62 -0.91 116.94 119.88 3d0b h PHE 118 Ca 0.27 -0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.72 3d0b h PHE 118 Cb 0.19 -0.04 -0.02 0.00 2.79 0.00 0.00 35.95 38.87 3d0b h PHE 118 CO 0.02 0.34 0.12 0.52 -2.23 0.00 0.00 178.31 177.07 3d0b h MET 119 N -0.07 0.59 -0.19 1.11 2.86 -0.80 0.49 114.93 118.92 3d0b h MET 119 Ca 0.03 -0.09 -0.02 0.00 -2.06 0.00 0.00 59.70 57.55 3d0b h MET 119 Cb 0.26 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 31.81 3d0b h MET 119 CO 0.00 0.53 0.04 0.93 1.06 0.00 0.00 176.91 179.47 3d0b h GLU 120 N 0.59 0.31 -0.83 1.72 5.08 -1.18 -1.73 114.58 118.54 3d0b h GLU 120 Ca 0.14 -0.08 0.05 0.00 -1.00 0.00 0.00 59.36 58.47 3d0b h GLU 120 Cb 0.19 -0.04 -0.06 0.00 0.50 0.00 0.00 28.75 29.35 3d0b h GLU 120 CO -0.01 0.46 0.52 0.00 -1.00 0.00 0.00 179.01 178.99 3d0b h ALA 121 N 0.84 1.12 -0.48 3.43 0.00 -0.48 -1.96 119.26 121.73 3d0b h ALA 121 Ca 0.06 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3d0b h ALA 121 Cb 0.30 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 3d0b h ALA 121 CO 0.00 0.29 0.32 -0.07 0.00 0.00 0.00 179.25 179.79 3d0b h LEU 122 N 0.97 0.55 -1.84 0.00 3.38 -0.79 -0.38 115.31 117.19 3d0b h LEU 122 Ca 0.35 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.30 3d0b h LEU 122 Cb 0.11 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 40.72 3d0b h LEU 122 CO -0.15 0.40 -0.03 1.56 0.09 0.00 0.00 178.44 180.31 3d0b h GLN 123 N 0.65 0.06 0.00 1.13 4.20 -0.75 -2.76 115.11 117.64 3d0b h GLN 123 Ca 0.17 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.88 3d0b h GLN 123 Cb -0.08 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 27.69 3d0b h GLN 123 CO -0.04 0.10 0.00 0.00 -0.67 0.00 0.00 178.83 178.22 3d0b h ALA 124 N 1.91 1.00 0.00 3.87 0.00 -0.85 -3.47 119.26 121.72 3d0b h ALA 124 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3d0b h ALA 124 Cb 0.09 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.88 3d0b h ALA 124 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 3d0b n GLY 125 N 0.56 0.94 3.66 0.00 0.00 -0.67 -5.07 105.19 104.62 3d0b n GLY 125 Ca 0.03 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.75 3d0b n GLY 125 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d0b s ALA 126 N -2.00 1.06 0.36 4.61 0.00 -0.24 -4.98 121.76 120.57 3d0b s ALA 126 Ca 0.00 -0.04 0.07 0.00 0.00 0.00 0.00 51.96 51.99 3d0b s ALA 126 Cb 0.00 -3.22 -0.07 0.00 0.00 0.00 0.00 23.12 19.83 3d0b s ALA 126 CO 0.00 -2.76 -0.02 0.16 0.00 0.00 0.00 175.76 173.14 3d0b s ASP 127 N -3.17 3.46 0.51 0.00 -4.77 -1.26 -4.52 116.67 106.92 3d0b s ASP 127 Ca 0.65 -1.30 0.20 0.00 -3.30 0.00 0.00 52.55 48.79 3d0b s ASP 127 Cb -0.20 -0.31 1.28 0.00 -1.09 0.00 0.00 42.92 42.61 3d0b s ASP 127 CO 0.59 -0.39 2.06 0.40 0.70 0.00 0.00 175.17 178.52 3d0b h ILE 128 N 1.96 0.87 0.00 2.11 2.04 -1.99 -1.19 117.51 121.30 3d0b h ILE 128 Ca -0.42 -0.02 0.00 0.00 1.00 0.00 0.00 64.86 65.41 3d0b h ILE 128 Cb 1.24 0.80 0.00 0.00 -0.74 0.00 0.00 36.82 38.12 3d0b h ILE 128 CO 0.75 0.01 0.00 0.77 0.00 0.00 0.00 178.15 179.68 3d0b h SER 129 N 0.07 0.00 -0.10 1.72 4.64 -1.96 -1.65 113.55 116.27 3d0b h SER 129 Ca 0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 3d0b h SER 129 Cb 0.51 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.60 3d0b h SER 129 CO -0.01 0.00 0.00 0.23 -0.87 0.00 0.00 176.83 176.18 3d0b n MET 130 N -2.64 1.45 -0.31 4.77 2.81 -0.45 -4.40 117.12 118.35 3d0b n MET 130 Ca -0.01 -0.68 0.20 0.00 -1.81 0.00 0.00 57.70 55.40 3d0b n MET 130 Cb 0.11 -1.36 0.48 0.00 -0.71 0.00 0.00 33.22 31.74 3d0b n MET 130 CO 0.00 0.00 0.00 0.97 1.51 0.00 0.00 175.97 178.45 3d0b h ILE 131 N 1.39 0.59 0.00 2.02 2.10 -1.48 -1.29 117.51 120.83 3d0b h ILE 131 Ca 0.00 -0.16 -0.05 0.00 1.08 0.00 0.00 64.86 65.74 3d0b h ILE 131 Cb 0.30 0.09 -0.01 0.00 -1.09 0.00 0.00 36.82 36.11 3d0b h ILE 131 CO 0.00 0.08 -0.23 1.23 -1.08 0.00 0.00 178.15 178.15 3d0b h GLY 132 N 0.46 0.00 2.00 8.18 0.00 -1.86 -1.71 103.07 110.14 3d0b h GLY 132 Ca 0.57 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.90 3d0b h GLY 132 CO -0.29 0.00 0.00 -1.06 0.00 0.00 0.00 176.54 175.19 3d0b n GLN 133 N -4.02 0.12 -0.09 4.80 6.02 -0.49 -2.05 117.38 121.67 3d0b n GLN 133 Ca -0.02 0.49 0.07 0.00 -0.01 0.00 0.00 57.00 57.53 3d0b n GLN 133 Cb 0.30 -1.79 0.12 0.00 1.02 0.00 0.00 30.24 29.89 3d0b n GLN 133 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 3d0b n PHE 134 N -2.02 0.24 -1.12 1.08 3.72 -0.64 -4.98 117.46 113.74 3d0b n PHE 134 Ca 0.01 -0.20 -0.04 0.00 -0.05 0.00 0.00 57.45 57.16 3d0b n PHE 134 Cb 0.11 -0.01 -0.02 0.00 -0.94 0.00 0.00 39.48 38.62 3d0b n PHE 134 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3d0b n GLY 135 N 0.81 0.67 0.52 1.37 0.00 -0.87 -4.38 105.19 103.31 3d0b n GLY 135 Ca 0.11 -0.37 0.07 0.00 0.00 0.00 0.00 46.02 45.83 3d0b n GLY 135 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3d0b n VAL 136 N -2.70 1.93 0.11 1.61 0.24 -1.24 -4.80 118.33 113.47 3d0b n VAL 136 Ca -0.04 -2.78 0.17 0.00 -2.04 0.00 0.00 64.34 59.64 3d0b n VAL 136 Cb 0.23 -0.14 0.71 0.00 -1.47 0.00 0.00 33.84 33.16 3d0b n VAL 136 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 3d0b h GLY 137 N 0.73 0.00 -0.08 7.63 0.00 -1.86 -2.47 103.07 107.03 3d0b h GLY 137 Ca -0.01 0.00 0.22 0.00 0.00 0.00 0.00 47.33 47.54 3d0b h GLY 137 CO 0.01 0.00 0.54 -2.75 0.00 0.00 0.00 176.54 174.34 3d0b h PHE 138 N 0.00 0.93 0.00 5.60 3.57 -1.87 -0.98 116.94 124.20 3d0b h PHE 138 Ca 0.16 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.69 3d0b h PHE 138 Cb 0.67 -0.26 0.00 0.00 2.79 0.00 0.00 35.95 39.15 3d0b h PHE 138 CO 0.00 0.08 0.00 1.88 -2.23 0.00 0.00 178.31 178.04 3d0b h TYR 139 N 0.58 0.00 0.00 0.41 0.05 -1.86 -1.48 116.97 114.68 3d0b h TYR 139 Ca 0.60 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.38 3d0b h TYR 139 Cb 1.08 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.82 3d0b h TYR 139 CO -0.04 0.00 0.02 0.66 -1.05 0.00 0.00 178.16 177.75 3d0b h SER 140 N 0.00 0.00 -0.86 3.88 4.64 -1.35 -1.59 113.55 118.27 3d0b h SER 140 Ca 0.00 0.00 0.20 0.00 -0.47 0.00 0.00 61.79 61.52 3d0b h SER 140 Cb 0.38 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.41 3d0b h SER 140 CO 0.00 0.00 0.58 0.00 -0.87 0.00 0.00 176.83 176.54 3d0b h ALA 141 N 1.95 2.32 0.00 5.18 0.00 -1.44 -1.05 119.26 126.24 3d0b h ALA 141 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3d0b h ALA 141 Cb 0.04 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.82 3d0b h ALA 141 CO 0.00 -0.59 0.00 0.66 0.00 0.00 0.00 179.25 179.32 3d0b n TYR 142 N -4.46 0.00 0.01 0.00 4.01 -0.60 -1.48 117.16 114.65 3d0b n TYR 142 Ca 0.18 0.00 -0.00 0.00 -0.16 0.00 0.00 57.90 57.91 3d0b n TYR 142 Cb 0.72 -0.21 0.29 0.00 -0.31 0.00 0.00 39.34 39.83 3d0b n TYR 142 CO 0.00 0.00 0.00 -0.07 -0.46 0.00 0.00 176.86 176.33 3d0b h LEU 143 N 0.00 0.46 0.00 7.72 3.38 -1.39 -3.36 115.31 122.13 3d0b h LEU 143 Ca 0.00 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.87 3d0b h LEU 143 Cb 0.14 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.77 3d0b h LEU 143 CO 0.00 0.58 -0.58 1.33 0.09 0.00 0.00 178.44 179.86 3d0b n VAL 144 N -4.25 0.00 -4.67 1.22 0.24 -0.97 -5.02 118.33 104.88 3d0b n VAL 144 Ca 0.01 -0.20 -0.33 0.00 -2.04 0.00 0.00 64.34 61.78 3d0b n VAL 144 Cb 0.28 0.70 -0.13 0.00 -1.47 0.00 0.00 33.84 33.22 3d0b n VAL 144 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3d0b s ALA 145 N -1.55 2.81 -0.08 2.33 0.00 -0.55 -0.53 121.76 124.18 3d0b s ALA 145 Ca 0.00 -0.89 0.16 0.00 0.00 0.00 0.00 51.96 51.23 3d0b s ALA 145 Cb 0.00 -1.25 0.23 0.00 0.00 0.00 0.00 23.12 22.10 3d0b s ALA 145 CO 0.00 0.38 1.52 1.05 0.00 0.00 0.00 175.76 178.71 3d0b h GLU 146 N 6.07 0.00 -3.03 0.00 4.11 -1.30 -3.41 114.58 117.02 3d0b h GLU 146 Ca -0.37 0.00 -0.15 0.00 0.07 0.00 0.00 59.36 58.91 3d0b h GLU 146 Cb 1.19 0.00 -0.25 0.00 0.50 0.00 0.00 28.75 30.19 3d0b h GLU 146 CO 0.55 0.46 -0.37 0.21 0.07 0.00 0.00 179.01 179.94 3d0b s LYS 147 N -3.12 0.37 -0.08 1.06 2.20 -1.21 -4.46 119.74 114.50 3d0b s LYS 147 Ca 0.03 0.36 0.03 0.00 -0.36 0.00 0.00 55.97 56.04 3d0b s LYS 147 Cb 0.08 0.18 0.00 0.00 -1.51 0.00 0.00 37.83 36.58 3d0b s LYS 147 CO 0.73 -0.05 -0.19 0.08 -0.36 0.00 0.00 175.35 175.55 3d0b s VAL 148 N 0.04 1.66 -0.12 4.02 1.01 -0.63 -1.23 120.40 125.15 3d0b s VAL 148 Ca -0.01 -0.80 0.02 0.00 0.00 0.00 0.00 61.98 61.19 3d0b s VAL 148 Cb -0.02 -1.45 -0.01 0.00 0.00 0.00 0.00 36.38 34.90 3d0b s VAL 148 CO 0.01 0.47 -0.19 -0.89 0.00 0.00 0.00 175.10 174.50 3d0b s THR 149 N 0.41 2.53 -0.24 3.92 2.01 -0.18 -1.68 115.64 122.41 3d0b s THR 149 Ca -0.15 -0.85 0.03 0.00 0.31 0.00 0.00 61.69 61.03 3d0b s THR 149 Cb -0.16 -2.02 0.05 0.00 0.01 0.00 0.00 72.50 70.38 3d0b s THR 149 CO 0.06 0.54 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.72 3d0b s VAL 150 N 0.38 2.14 -0.19 3.82 1.01 0.96 0.70 120.40 129.23 3d0b s VAL 150 Ca -0.14 -1.50 -0.10 0.00 0.00 0.00 0.00 61.98 60.23 3d0b s VAL 150 Cb -0.17 -2.19 -0.05 0.00 0.00 0.00 0.00 36.38 33.97 3d0b s VAL 150 CO 0.07 0.08 0.15 -0.63 0.00 0.00 0.00 175.10 174.77 3d0b s ILE 151 N 1.14 5.41 -0.04 2.22 -1.09 0.57 -0.29 121.20 129.12 3d0b s ILE 151 Ca -0.06 0.23 -0.13 0.00 -2.23 0.00 0.00 60.65 58.46 3d0b s ILE 151 Cb -0.19 -3.48 0.02 0.00 -1.58 0.00 0.00 42.46 37.23 3d0b s ILE 151 CO -0.07 0.45 0.28 0.28 -1.23 0.00 0.00 174.94 174.66 3d0b s THR 152 N 0.22 0.05 -0.10 2.92 -1.32 -0.26 0.25 115.64 117.40 3d0b s THR 152 Ca 0.10 -0.39 -0.03 0.00 -1.21 0.00 0.00 61.69 60.16 3d0b s THR 152 Cb -0.11 -0.54 0.05 0.00 -1.51 0.00 0.00 72.50 70.38 3d0b s THR 152 CO -0.01 -0.21 0.09 -0.75 -2.21 0.00 0.00 174.62 171.53 3d0b s LYS 153 N -0.96 0.00 0.08 7.08 2.47 0.12 -1.23 119.74 127.30 3d0b s LYS 153 Ca -0.10 0.21 0.02 0.00 -1.56 0.00 0.00 55.97 54.53 3d0b s LYS 153 Cb -0.05 -1.04 -0.04 0.00 -1.46 0.00 0.00 37.83 35.24 3d0b s LYS 153 CO 0.03 -0.48 0.17 -1.58 0.16 0.00 0.00 175.35 173.65 3d0b s HIS 154 N 2.18 3.38 0.41 4.03 5.65 -1.26 -0.95 115.29 128.74 3d0b s HIS 154 Ca 0.04 0.17 0.13 0.00 0.25 0.00 0.00 55.06 55.64 3d0b s HIS 154 Cb -0.14 -1.69 0.97 0.00 -1.18 0.00 0.00 32.58 30.54 3d0b s HIS 154 CO -0.06 0.56 1.95 -0.91 -0.65 0.00 0.00 174.74 175.63 3d0b h ASN 155 N 3.04 0.44 -0.40 9.88 2.35 -1.90 -2.56 115.58 126.42 3d0b h ASN 155 Ca -0.46 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.30 3d0b h ASN 155 Cb 1.17 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 39.46 3d0b h ASN 155 CO 0.71 0.26 0.00 0.47 -1.65 0.00 0.00 177.43 177.22 3d0b n ASP 156 N -4.48 2.82 -3.06 5.81 8.00 -1.26 -4.95 116.55 119.43 3d0b n ASP 156 Ca 0.11 -2.18 -0.10 0.00 0.71 0.00 0.00 54.79 53.33 3d0b n ASP 156 Cb 0.39 -0.40 0.01 0.00 -0.02 0.00 0.00 41.12 41.10 3d0b n ASP 156 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3d0b s ASP 157 N -0.82 0.16 0.75 -2.24 -1.08 -0.97 -5.06 116.67 107.42 3d0b s ASP 157 Ca 0.30 -1.18 -0.05 0.00 -0.52 0.00 0.00 52.55 51.10 3d0b s ASP 157 Cb 0.18 0.81 0.12 0.00 -1.46 0.00 0.00 42.92 42.57 3d0b s ASP 157 CO 0.16 -1.59 1.05 -1.61 0.52 0.00 0.00 175.17 173.70 3d0b s GLU 158 N -2.57 1.66 -0.15 4.34 0.41 -1.26 -4.47 118.70 116.65 3d0b s GLU 158 Ca 0.18 -0.74 -0.27 0.00 -0.41 0.00 0.00 54.97 53.73 3d0b s GLU 158 Cb -0.04 -2.21 -0.01 0.00 -1.78 0.00 0.00 34.13 30.09 3d0b s GLU 158 CO 0.13 -1.54 0.92 -1.14 -0.49 0.00 0.00 175.26 173.14 3d0b s GLN 159 N -5.29 4.34 0.18 1.61 0.74 -1.26 -4.47 119.66 115.52 3d0b s GLN 159 Ca 0.66 1.20 0.10 0.00 0.05 0.00 0.00 55.36 57.36 3d0b s GLN 159 Cb -0.07 -3.57 -0.04 0.00 1.10 0.00 0.00 33.01 30.43 3d0b s GLN 159 CO 0.46 -0.35 -0.17 0.71 -0.55 0.00 0.00 175.29 175.39 3d0b s TYR 160 N 2.19 2.48 -0.21 1.67 2.02 -0.37 -0.40 117.35 124.73 3d0b s TYR 160 Ca 0.43 -0.29 -0.01 0.00 -0.37 0.00 0.00 57.07 56.83 3d0b s TYR 160 Cb -0.17 -1.23 0.01 0.00 -0.40 0.00 0.00 41.96 40.18 3d0b s TYR 160 CO 0.14 0.50 -0.12 0.00 -1.57 0.00 0.00 175.55 174.50 3d0b s ALA 161 N -1.64 2.57 -0.00 3.71 0.00 0.16 -1.10 121.76 125.45 3d0b s ALA 161 Ca 0.22 -1.26 -0.02 0.00 0.00 0.00 0.00 51.96 50.91 3d0b s ALA 161 Cb -0.09 -1.46 -0.04 0.00 0.00 0.00 0.00 23.12 21.53 3d0b s ALA 161 CO 0.12 -0.48 0.15 -0.46 0.00 0.00 0.00 175.76 175.09 3d0b s TRP 162 N 1.36 3.46 -0.17 0.00 -0.00 0.60 -1.50 118.94 122.68 3d0b s TRP 162 Ca 0.04 0.30 -0.18 0.00 -0.00 0.00 0.00 56.10 56.26 3d0b s TRP 162 Cb -0.14 -1.79 0.05 0.00 -0.00 0.00 0.00 33.47 31.58 3d0b s TRP 162 CO -0.08 0.61 0.50 -2.00 -0.00 0.00 0.00 176.95 175.99 3d0b s GLU 163 N -1.90 0.62 -0.21 5.86 2.12 -0.40 -0.03 118.70 124.76 3d0b s GLU 163 Ca 0.26 0.63 -0.15 0.00 0.36 0.00 0.00 54.97 56.07 3d0b s GLU 163 Cb -0.12 0.30 0.06 0.00 0.26 0.00 0.00 34.13 34.62 3d0b s GLU 163 CO 0.17 -0.09 0.53 0.45 -0.54 0.00 0.00 175.26 175.79 3d0b s SER 164 N 0.11 -0.64 -0.32 -1.70 0.15 -0.68 -0.64 113.70 109.99 3d0b s SER 164 Ca -0.01 1.12 0.10 0.00 0.70 0.00 0.00 55.95 57.86 3d0b s SER 164 Cb -0.03 1.06 0.67 0.00 -1.71 0.00 0.00 66.02 66.01 3d0b s SER 164 CO 0.01 -0.20 1.72 -1.20 1.20 0.00 0.00 173.24 174.78 3d0b n SER 165 N 3.60 4.17 0.00 5.45 7.64 -1.26 -1.61 113.62 131.61 3d0b n SER 165 Ca -0.18 -3.35 0.00 0.00 1.01 0.00 0.00 58.87 56.35 3d0b n SER 165 Cb 0.57 -0.72 0.00 0.00 -1.01 0.00 0.00 64.21 63.05 3d0b n SER 165 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3d0b n ALA 166 N -0.52 0.00 -1.12 -0.43 0.00 -1.26 -4.89 120.51 112.29 3d0b n ALA 166 Ca 0.40 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.80 3d0b n ALA 166 Cb 1.32 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 20.75 3d0b n ALA 166 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3d0b n GLY 167 N 0.00 0.57 0.62 0.00 0.00 -1.26 -3.55 105.19 101.57 3d0b n GLY 167 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.88 3d0b n GLY 167 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d0b n GLY 168 N -0.84 0.60 3.04 -0.02 0.00 -1.26 -5.05 105.19 101.66 3d0b n GLY 168 Ca -0.04 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.88 3d0b n GLY 168 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3d0b s SER 169 N -2.99 0.53 0.08 1.61 1.04 -1.23 -1.17 113.70 111.57 3d0b s SER 169 Ca 0.00 -0.68 0.01 0.00 0.48 0.00 0.00 55.95 55.76 3d0b s SER 169 Cb 0.00 0.11 -0.04 0.00 0.10 0.00 0.00 66.02 66.19 3d0b s SER 169 CO 0.00 -0.37 -0.06 0.72 0.98 0.00 0.00 173.24 174.51 3d0b s PHE 170 N -2.26 0.79 0.14 5.02 -0.12 -0.35 -4.38 117.98 116.83 3d0b s PHE 170 Ca -0.06 -0.86 0.10 0.00 -0.05 0.00 0.00 56.93 56.06 3d0b s PHE 170 Cb -0.04 -0.47 -0.04 0.00 -0.63 0.00 0.00 43.02 41.83 3d0b s PHE 170 CO -0.03 -0.17 -0.22 0.95 -0.05 0.00 0.00 175.22 175.70 3d0b s THR 171 N -3.27 2.58 -0.03 -4.49 -4.23 0.19 -0.39 115.64 105.99 3d0b s THR 171 Ca 0.07 -1.71 0.03 0.00 -1.18 0.00 0.00 61.69 58.90 3d0b s THR 171 Cb 0.03 -2.19 0.00 0.00 1.34 0.00 0.00 72.50 71.68 3d0b s THR 171 CO -0.05 0.04 -0.11 -0.69 -0.54 0.00 0.00 174.62 173.27 3d0b s VAL 172 N -1.27 0.95 0.09 2.29 1.01 -0.29 -1.27 120.40 121.90 3d0b s VAL 172 Ca 0.18 -0.45 -0.05 0.00 0.00 0.00 0.00 61.98 61.66 3d0b s VAL 172 Cb -0.10 -0.84 -0.02 0.00 0.00 0.00 0.00 36.38 35.42 3d0b s VAL 172 CO 0.09 0.29 0.10 0.00 0.00 0.00 0.00 175.10 175.58 3d0b s ARG 173 N 0.18 0.80 0.23 2.72 1.70 -0.56 -1.63 118.95 122.38 3d0b s ARG 173 Ca -0.04 -1.14 -0.30 0.00 -0.47 0.00 0.00 55.73 53.78 3d0b s ARG 173 Cb -0.10 0.28 -0.09 0.00 -0.57 0.00 0.00 34.95 34.48 3d0b s ARG 173 CO 0.01 -0.22 1.24 0.95 -1.08 0.00 0.00 175.30 176.20 3d0b s THR 174 N -3.92 3.29 -0.14 4.99 -4.23 -1.26 -0.67 115.64 113.70 3d0b s THR 174 Ca 0.09 1.13 -0.14 0.00 -1.18 0.00 0.00 61.69 61.60 3d0b s THR 174 Cb 0.06 -3.72 -0.05 0.00 1.34 0.00 0.00 72.50 70.13 3d0b s THR 174 CO -0.08 0.20 0.32 -0.62 -0.54 0.00 0.00 174.62 173.90 3d0b s ASP 175 N -0.04 6.50 -0.12 3.99 2.15 0.46 -4.75 116.67 124.85 3d0b s ASP 175 Ca 0.52 0.58 0.15 0.00 0.43 0.00 0.00 52.55 54.23 3d0b s ASP 175 Cb -0.35 -2.19 0.47 0.00 -0.30 0.00 0.00 42.92 40.55 3d0b s ASP 175 CO 0.40 0.13 1.39 0.35 -0.17 0.00 0.00 175.17 177.27 3d0b n THR 176 N 3.32 1.88 -0.52 1.71 -2.24 -1.26 -4.80 114.28 112.37 3d0b n THR 176 Ca -0.12 -1.57 0.00 0.00 -2.27 0.00 0.00 64.05 60.09 3d0b n THR 176 Cb 0.52 -0.01 0.00 0.00 -2.10 0.00 0.00 70.33 68.74 3d0b n THR 176 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3d0b n GLY 177 N -0.10 -1.22 3.68 3.38 0.00 -1.26 -4.94 105.19 104.74 3d0b n GLY 177 Ca 0.19 -1.61 -0.45 0.00 0.00 0.00 0.00 46.02 44.15 3d0b n GLY 177 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3d0b n GLU 178 N -0.63 2.52 -1.82 1.61 4.07 -1.26 -4.91 120.64 120.22 3d0b n GLU 178 Ca 0.00 0.92 -0.41 0.00 -0.06 0.00 0.00 57.16 57.61 3d0b n GLU 178 Cb 0.00 -2.79 -0.01 0.00 -0.06 0.00 0.00 31.44 28.58 3d0b n GLU 178 CO 0.00 0.00 0.00 -2.14 -0.06 0.00 0.00 177.13 174.93 3d0b s PRO 179 N 3.06 4.13 -0.00 5.31 0.02 -1.26 -4.95 135.00 141.31 3d0b s PRO 179 Ca 0.86 2.55 0.21 0.00 0.02 0.00 0.00 61.00 64.63 3d0b s PRO 179 Cb -0.57 -3.00 -0.24 0.00 0.02 0.00 0.00 34.50 30.71 3d0b s PRO 179 CO 0.42 -0.55 0.82 -1.33 -0.33 0.00 0.00 177.00 176.04 3d0b n MET 180 N 1.19 0.19 0.00 5.54 2.81 -1.26 -5.01 117.12 120.57 3d0b n MET 180 Ca 0.04 -0.03 0.00 0.00 -1.81 0.00 0.00 57.70 55.90 3d0b n MET 180 Cb 0.39 -1.49 0.00 0.00 -0.71 0.00 0.00 33.22 31.41 3d0b n MET 180 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3d0b n GLY 181 N 1.46 2.12 3.64 3.03 0.00 -1.26 -4.68 105.19 109.49 3d0b n GLY 181 Ca 0.03 -0.05 -0.08 0.00 0.00 0.00 0.00 46.02 45.91 3d0b n GLY 181 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3d0b s ARG 182 N 0.00 0.45 0.00 1.61 3.52 -1.25 -4.84 118.95 118.44 3d0b s ARG 182 Ca 0.00 0.55 0.00 0.00 -0.13 0.00 0.00 55.73 56.15 3d0b s ARG 182 Cb 0.00 0.22 0.00 0.00 -1.56 0.00 0.00 34.95 33.61 3d0b s ARG 182 CO 0.00 -0.06 0.00 0.41 -0.81 0.00 0.00 175.30 174.84 3d0b n GLY 183 N 2.22 0.80 2.92 8.12 0.00 -0.12 -4.45 105.19 114.68 3d0b n GLY 183 Ca -0.12 -2.04 -0.12 0.00 0.00 0.00 0.00 46.02 43.73 3d0b n GLY 183 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3d0b s THR 184 N -1.79 0.00 -0.19 2.61 2.01 -0.60 -0.70 115.64 116.98 3d0b s THR 184 Ca 0.00 -0.02 0.00 0.00 0.31 0.00 0.00 61.69 61.98 3d0b s THR 184 Cb 0.00 -0.08 0.02 0.00 0.01 0.00 0.00 72.50 72.44 3d0b s THR 184 CO 0.00 -0.01 -0.17 -0.54 -0.69 0.00 0.00 174.62 173.21 3d0b s LYS 185 N -0.01 3.04 -0.37 4.92 1.02 0.14 -0.60 119.74 127.87 3d0b s LYS 185 Ca -0.00 -0.81 -0.13 0.00 0.02 0.00 0.00 55.97 55.05 3d0b s LYS 185 Cb -0.01 -2.65 0.01 0.00 -0.52 0.00 0.00 37.83 34.66 3d0b s LYS 185 CO 0.00 -0.22 0.24 0.08 -0.92 0.00 0.00 175.35 174.54 3d0b s VAL 186 N 1.32 4.98 -0.37 3.17 1.01 -0.13 -0.32 120.40 130.07 3d0b s VAL 186 Ca 0.05 -0.60 -0.13 0.00 0.00 0.00 0.00 61.98 61.29 3d0b s VAL 186 Cb -0.13 -3.71 0.00 0.00 0.00 0.00 0.00 36.38 32.54 3d0b s VAL 186 CO -0.11 -0.19 0.26 -0.63 0.00 0.00 0.00 175.10 174.43 3d0b s ILE 187 N 1.64 5.16 -0.43 2.22 1.01 0.22 -1.20 121.20 129.82 3d0b s ILE 187 Ca 0.04 -0.47 -0.19 0.00 0.00 0.00 0.00 60.65 60.04 3d0b s ILE 187 Cb -0.18 -3.76 0.03 0.00 0.01 0.00 0.00 42.46 38.55 3d0b s ILE 187 CO 0.09 -0.15 0.53 -0.76 0.00 0.00 0.00 174.94 174.65 3d0b s LEU 188 N 1.68 4.74 -0.74 2.97 1.43 0.19 -1.01 118.68 127.94 3d0b s LEU 188 Ca 0.05 -0.57 -0.25 0.00 -1.03 0.00 0.00 54.13 52.33 3d0b s LEU 188 Cb -0.18 -2.52 0.05 0.00 0.03 0.00 0.00 46.19 43.57 3d0b s LEU 188 CO 0.10 -0.68 1.17 -1.00 0.23 0.00 0.00 176.35 176.17 3d0b s HIS 189 N 2.43 2.48 0.51 0.29 3.76 -0.37 -1.55 115.29 122.84 3d0b s HIS 189 Ca 0.16 -0.35 -0.22 0.00 -0.15 0.00 0.00 55.06 54.50 3d0b s HIS 189 Cb -0.16 -4.50 -0.06 0.00 1.11 0.00 0.00 32.58 28.97 3d0b s HIS 189 CO 0.15 -1.89 1.22 -0.51 -0.85 0.00 0.00 174.74 172.87 3d0b s LEU 190 N 4.93 3.90 0.59 0.89 1.43 -0.67 -0.98 118.68 128.77 3d0b s LEU 190 Ca 0.31 2.44 -0.20 0.00 -1.03 0.00 0.00 54.13 55.65 3d0b s LEU 190 Cb -0.10 -4.33 -0.03 0.00 0.03 0.00 0.00 46.19 41.75 3d0b s LEU 190 CO 0.10 -1.23 1.27 -0.54 0.23 0.00 0.00 176.35 176.19 3d0b s LYS 191 N -2.89 2.92 0.34 1.70 1.02 0.31 -4.56 119.74 118.57 3d0b s LYS 191 Ca 0.69 2.01 0.11 0.00 0.02 0.00 0.00 55.97 58.79 3d0b s LYS 191 Cb -0.32 -2.01 0.89 0.00 -0.52 0.00 0.00 37.83 35.86 3d0b s LYS 191 CO 0.38 -1.30 1.77 1.49 -0.92 0.00 0.00 175.35 176.77 3d0b h GLU 192 N 0.99 0.59 -0.45 1.68 4.81 -1.94 -0.69 114.58 119.57 3d0b h GLU 192 Ca -0.51 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 58.69 3d0b h GLU 192 Cb 1.31 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 30.56 3d0b h GLU 192 CO 0.55 0.39 0.00 -0.40 -0.73 0.00 0.00 179.01 178.82 3d0b n ASP 193 N -4.75 2.39 -0.60 1.04 5.75 -1.26 -4.13 116.55 114.99 3d0b n ASP 193 Ca 0.24 -2.01 0.05 0.00 -0.01 0.00 0.00 54.79 53.07 3d0b n ASP 193 Cb 0.70 -0.30 0.19 0.00 -1.03 0.00 0.00 41.12 40.68 3d0b n ASP 193 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3d0b n GLN 194 N 0.79 1.72 0.00 0.11 1.13 -0.27 -4.73 117.38 116.13 3d0b n GLN 194 Ca 0.15 -3.00 0.11 0.00 -1.94 0.00 0.00 57.00 52.31 3d0b n GLN 194 Cb 0.38 -1.66 0.60 0.00 0.11 0.00 0.00 30.24 29.68 3d0b n GLN 194 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 3d0b n THR 195 N -1.14 0.20 0.29 5.09 -2.24 -1.26 -2.80 114.28 112.42 3d0b n THR 195 Ca 0.21 0.05 0.14 0.00 -2.27 0.00 0.00 64.05 62.18 3d0b n THR 195 Cb 0.78 -0.69 0.85 0.00 -2.10 0.00 0.00 70.33 69.17 3d0b n THR 195 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 3d0b h GLU 196 N 0.00 0.00 0.00 -0.78 4.11 -1.94 -2.07 114.58 113.90 3d0b h GLU 196 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 3d0b h GLU 196 Cb 0.13 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.38 3d0b h GLU 196 CO 0.00 0.01 0.00 0.66 0.07 0.00 0.00 179.01 179.75 3d0b n TYR 197 N -3.98 0.00 0.79 2.06 4.01 -1.12 -1.72 117.16 117.20 3d0b n TYR 197 Ca -0.03 0.00 0.10 0.00 -0.16 0.00 0.00 57.90 57.81 3d0b n TYR 197 Cb 0.09 0.00 -0.11 0.00 -0.31 0.00 0.00 39.34 39.01 3d0b n TYR 197 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 3d0b n LEU 198 N -0.65 0.77 -4.72 7.72 4.77 -0.78 -4.84 117.00 119.29 3d0b n LEU 198 Ca 0.06 -0.36 -0.42 0.00 -0.03 0.00 0.00 56.01 55.27 3d0b n LEU 198 Cb 0.03 -0.02 -0.03 0.00 -2.33 0.00 0.00 43.42 41.07 3d0b n LEU 198 CO 0.05 0.19 0.70 -1.61 -1.33 0.00 0.00 177.39 175.39 3d0b s GLU 199 N -3.11 4.58 0.17 3.23 2.02 -0.70 -4.86 118.70 120.03 3d0b s GLU 199 Ca 0.05 1.48 -0.15 0.00 0.02 0.00 0.00 54.97 56.36 3d0b s GLU 199 Cb 0.16 -3.42 0.11 0.00 0.10 0.00 0.00 34.13 31.08 3d0b s GLU 199 CO 0.87 0.00 1.71 1.49 0.02 0.00 0.00 175.26 179.35 3d0b h GLU 200 N 6.42 0.15 -0.13 1.61 4.81 -1.93 -1.85 114.58 123.66 3d0b h GLU 200 Ca -0.42 -0.01 -0.08 0.00 -0.13 0.00 0.00 59.36 58.72 3d0b h GLU 200 Cb 1.22 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.55 3d0b h GLU 200 CO 0.75 0.10 -0.28 0.07 -0.73 0.00 0.00 179.01 178.92 3d0b h ARG 201 N 0.16 0.24 -0.16 1.92 0.11 -1.94 -0.95 114.38 113.75 3d0b h ARG 201 Ca 0.20 -0.08 -0.06 0.00 0.10 0.00 0.00 59.98 60.13 3d0b h ARG 201 Cb 0.26 -0.02 -0.00 0.00 1.11 0.00 0.00 29.97 31.32 3d0b h ARG 201 CO -0.29 0.50 -0.13 -0.09 0.10 0.00 0.00 179.97 180.06 3d0b h ARG 202 N 0.21 0.37 -0.44 0.08 9.65 -1.74 -1.78 114.38 120.74 3d0b h ARG 202 Ca 0.03 -0.19 -0.03 0.00 -1.10 0.00 0.00 59.98 58.70 3d0b h ARG 202 Cb 0.60 0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 29.17 3d0b h ARG 202 CO 0.04 0.73 0.16 0.82 2.80 0.00 0.00 179.97 184.53 3d0b h ILE 203 N 0.02 1.21 -0.37 1.20 1.08 -1.15 -1.89 117.51 117.61 3d0b h ILE 203 Ca 0.03 -0.65 0.06 0.00 -0.39 0.00 0.00 64.86 63.90 3d0b h ILE 203 Cb 0.65 0.82 -0.05 0.00 -3.07 0.00 0.00 36.82 35.17 3d0b h ILE 203 CO 0.03 0.24 0.07 0.11 -0.69 0.00 0.00 178.15 177.91 3d0b h LYS 204 N 0.56 0.19 -0.46 2.37 1.57 -1.18 -0.30 116.57 119.31 3d0b h LYS 204 Ca 0.14 -0.01 0.08 0.00 -1.87 0.00 0.00 60.65 59.00 3d0b h LYS 204 Cb 0.21 -0.04 -0.07 0.00 0.08 0.00 0.00 32.23 32.41 3d0b h LYS 204 CO -0.01 0.12 0.03 1.49 -0.57 0.00 0.00 179.45 180.52 3d0b h GLU 205 N 0.19 0.15 -0.25 3.15 4.81 -1.13 -1.11 114.58 120.39 3d0b h GLU 205 Ca 0.18 -0.01 -0.10 0.00 -0.13 0.00 0.00 59.36 59.30 3d0b h GLU 205 Cb 0.21 -0.03 -0.00 0.00 0.63 0.00 0.00 28.75 29.55 3d0b h GLU 205 CO -0.24 0.10 -0.24 0.82 -0.73 0.00 0.00 179.01 178.72 3d0b h ILE 206 N 0.15 1.31 -0.34 2.32 2.04 -0.58 -1.52 117.51 120.89 3d0b h ILE 206 Ca 0.23 -1.40 -0.00 0.00 1.00 0.00 0.00 64.86 64.69 3d0b h ILE 206 Cb 0.33 1.66 -0.02 0.00 -0.74 0.00 0.00 36.82 38.05 3d0b h ILE 206 CO -0.36 0.44 0.20 0.58 0.00 0.00 0.00 178.15 179.01 3d0b h VAL 207 N 0.31 1.12 -0.90 1.67 2.07 -0.99 -1.31 116.25 118.21 3d0b h VAL 207 Ca 0.04 -0.28 0.01 0.00 0.82 0.00 0.00 66.70 67.29 3d0b h VAL 207 Cb 0.79 0.69 -0.05 0.00 -1.52 0.00 0.00 31.29 31.20 3d0b h VAL 207 CO 0.06 0.12 0.60 0.50 0.02 0.00 0.00 177.57 178.87 3d0b h LYS 208 N 0.44 1.19 -0.25 1.57 3.64 -1.12 0.13 116.57 122.16 3d0b h LYS 208 Ca 0.12 -0.07 -0.08 0.00 -1.27 0.00 0.00 60.65 59.35 3d0b h LYS 208 Cb 0.01 -0.27 -0.01 0.00 -0.41 0.00 0.00 32.23 31.56 3d0b h LYS 208 CO -0.02 0.78 -0.16 -0.22 -2.27 0.00 0.00 179.45 177.56 3d0b h LYS 209 N 1.22 0.55 0.00 1.90 3.64 -1.04 -3.37 116.57 119.47 3d0b h LYS 209 Ca 0.33 -0.26 0.00 0.00 -1.27 0.00 0.00 60.65 59.45 3d0b h LYS 209 Cb -0.14 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 31.68 3d0b h LYS 209 CO -0.07 0.83 -1.01 0.72 -2.27 0.00 0.00 179.45 177.65 3d0b n HIS 210 N -4.44 0.00 -2.23 1.91 8.25 -0.51 -4.76 115.22 113.44 3d0b n HIS 210 Ca -0.04 0.00 0.04 0.00 -0.26 0.00 0.00 57.72 57.46 3d0b n HIS 210 Cb 0.38 -0.09 0.07 0.00 1.12 0.00 0.00 29.99 31.47 3d0b n HIS 210 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 3d0b n SER 211 N -1.55 1.14 0.24 0.41 7.64 0.41 -4.88 113.62 117.03 3d0b n SER 211 Ca -0.01 -2.48 0.13 0.00 1.01 0.00 0.00 58.87 57.52 3d0b n SER 211 Cb 0.12 -0.35 0.52 0.00 -1.01 0.00 0.00 64.21 63.49 3d0b n SER 211 CO 0.00 0.00 0.00 0.06 -3.01 0.00 0.00 175.04 172.09 3d0b h GLN 212 N 0.92 0.00 -0.36 1.43 -0.00 -1.64 -3.20 115.11 112.26 3d0b h GLN 212 Ca -0.16 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.49 3d0b h GLN 212 Cb 1.64 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 29.12 3d0b h GLN 212 CO 0.07 0.13 0.00 1.19 -0.00 0.00 0.00 178.83 180.22 3d0b n PHE 213 N -3.27 0.65 -1.68 0.06 3.72 -1.26 -5.00 117.46 110.69 3d0b n PHE 213 Ca 0.01 -0.59 -0.45 0.00 -0.05 0.00 0.00 57.45 56.37 3d0b n PHE 213 Cb 0.39 -0.10 -0.03 0.00 -0.94 0.00 0.00 39.48 38.80 3d0b n PHE 213 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 176.76 175.82 3d0b n ILE 214 N 0.38 0.46 0.36 4.37 2.08 -1.21 -4.85 119.36 120.95 3d0b n ILE 214 Ca 0.15 -0.11 -0.06 0.00 0.56 0.00 0.00 62.75 63.29 3d0b n ILE 214 Cb 0.56 -1.60 0.04 0.00 -0.75 0.00 0.00 39.64 37.89 3d0b n ILE 214 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 3d0b n GLY 215 N 2.87 2.66 3.11 7.39 0.00 -1.26 -4.78 105.19 115.18 3d0b n GLY 215 Ca 0.14 -0.29 -0.12 0.00 0.00 0.00 0.00 46.02 45.76 3d0b n GLY 215 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3d0b s TYR 216 N -0.79 -0.01 0.20 1.61 2.02 -1.26 -5.10 117.35 114.01 3d0b s TYR 216 Ca 0.14 -0.00 -0.31 0.00 -0.37 0.00 0.00 57.07 56.52 3d0b s TYR 216 Cb 0.11 -0.02 -0.10 0.00 -0.40 0.00 0.00 41.96 41.55 3d0b s TYR 216 CO 0.02 -0.27 1.53 -2.14 -1.57 0.00 0.00 175.55 173.13 3d0b s PRO 217 N -1.15 4.22 -0.28 -1.71 0.02 -1.26 -4.82 135.00 130.03 3d0b s PRO 217 Ca -0.12 2.36 -0.04 0.00 0.02 0.00 0.00 61.00 63.21 3d0b s PRO 217 Cb -0.06 -3.13 0.02 0.00 0.02 0.00 0.00 34.50 31.34 3d0b s PRO 217 CO 0.02 -0.56 0.02 0.42 -0.33 0.00 0.00 177.00 176.57 3d0b s ILE 218 N 0.74 3.44 -0.29 2.83 1.01 -1.26 -1.04 121.20 126.63 3d0b s ILE 218 Ca 0.67 -0.88 -0.09 0.00 0.00 0.00 0.00 60.65 60.34 3d0b s ILE 218 Cb -0.43 -2.78 -0.01 0.00 0.01 0.00 0.00 42.46 39.24 3d0b s ILE 218 CO 0.36 0.11 0.13 -0.89 0.00 0.00 0.00 174.94 174.65 3d0b s THR 219 N 1.41 4.52 -0.52 2.92 2.01 -0.03 -4.99 115.64 120.96 3d0b s THR 219 Ca 0.01 -0.36 -0.22 0.00 0.31 0.00 0.00 61.69 61.43 3d0b s THR 219 Cb -0.17 -3.25 0.04 0.00 0.01 0.00 0.00 72.50 69.13 3d0b s THR 219 CO -0.01 0.14 0.80 -0.22 -0.69 0.00 0.00 174.62 174.64 3d0b s LEU 220 N 1.61 4.43 0.58 4.42 2.96 -1.26 -0.61 118.68 130.80 3d0b s LEU 220 Ca 0.05 -0.51 -0.19 0.00 -0.22 0.00 0.00 54.13 53.27 3d0b s LEU 220 Cb -0.17 -2.71 -0.04 0.00 0.50 0.00 0.00 46.19 43.77 3d0b s LEU 220 CO 0.06 -1.05 1.15 -0.36 -1.32 0.00 0.00 176.35 174.82 3d0b s PHE 221 N 3.37 2.57 0.23 5.38 0.40 -0.04 -4.98 117.98 124.91 3d0b s PHE 221 Ca 0.25 1.54 0.09 0.00 -0.60 0.00 0.00 56.93 58.21 3d0b s PHE 221 Cb -0.15 -3.33 -0.04 0.00 0.51 0.00 0.00 43.02 40.01 3d0b s PHE 221 CO 0.17 -1.80 -0.05 0.14 0.70 0.00 0.00 175.22 174.38 3d0b s VAL 222 N -1.80 3.29 -2.35 -0.44 -7.23 -1.26 -4.54 120.40 106.07 3d0b s VAL 222 Ca 0.73 -1.84 0.29 0.00 -1.81 0.00 0.00 61.98 59.36 3d0b s VAL 222 Cb -0.25 -2.71 0.66 0.00 0.56 0.00 0.00 36.38 34.64 3d0b s VAL 222 CO 0.31 -0.27 1.89 -0.62 -0.31 0.00 0.00 175.10 176.10