#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x8z h GLU 3 N 0.00 0.62 0.00 -1.46 4.81 -2.06 -2.98 114.58 113.51 1x8z h GLU 3 Ca 0.00 -0.50 0.00 0.00 -0.13 0.00 0.00 59.36 58.73 1x8z h GLU 3 Cb 0.00 0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.48 1x8z h GLU 3 CO 0.00 1.12 0.00 0.52 -0.73 0.00 0.00 179.01 179.92 1x8z h MET 4 N 0.43 0.00 0.10 1.92 2.86 -2.03 -2.40 114.93 115.80 1x8z h MET 4 Ca -0.04 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.59 1x8z h MET 4 Cb 1.35 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.01 1x8z h MET 4 CO 0.14 0.00 -0.05 0.77 1.06 0.00 0.00 176.91 178.83 1x8z h SER 5 N 0.00 -0.11 0.08 1.22 0.02 -1.96 -0.34 113.55 112.46 1x8z h SER 5 Ca 0.00 -0.39 -0.00 0.00 -0.84 0.00 0.00 61.79 60.56 1x8z h SER 5 Cb 0.08 0.03 -0.00 0.00 0.14 0.00 0.00 62.40 62.65 1x8z h SER 5 CO 0.00 0.36 -0.01 0.71 -1.14 0.00 0.00 176.83 176.75 1x8z h THR 6 N -0.62 0.20 0.01 -2.27 1.35 -1.56 -2.49 112.91 107.54 1x8z h THR 6 Ca -0.01 -0.07 -0.00 0.00 -0.55 0.00 0.00 66.41 65.78 1x8z h THR 6 Cb 0.50 1.05 0.00 0.00 -1.73 0.00 0.00 68.15 67.97 1x8z h THR 6 CO 0.02 0.01 -0.01 0.40 -0.25 0.00 0.00 175.52 175.70 1x8z h ILE 7 N 0.00 0.00 0.00 6.82 2.04 -1.36 -3.36 117.51 121.65 1x8z h ILE 7 Ca -0.00 -0.80 0.00 0.00 1.00 0.00 0.00 64.86 65.06 1x8z h ILE 7 Cb 0.05 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.13 1x8z h ILE 7 CO 0.00 0.00 0.18 0.00 0.00 0.00 0.00 178.15 178.33 1x8z n ASP 9 N -2.69 0.25 -1.43 0.00 8.00 -0.95 -2.41 116.55 117.32 1x8z n ASP 9 Ca -0.02 0.54 0.08 0.00 0.71 0.00 0.00 54.79 56.10 1x8z n ASP 9 Cb 0.22 -0.60 0.34 0.00 -0.02 0.00 0.00 41.12 41.06 1x8z n ASP 9 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1x8z n LYS 10 N -1.76 3.99 -4.07 -1.24 5.02 -0.64 -4.97 118.16 114.49 1x8z n LYS 10 Ca 0.05 -3.02 -0.25 0.00 -2.02 0.00 0.00 58.31 53.07 1x8z n LYS 10 Cb 0.28 -2.07 -0.05 0.00 -0.02 0.00 0.00 35.03 33.17 1x8z n LYS 10 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1x8z s THR 11 N -2.79 4.59 0.23 -0.18 2.01 -1.01 -5.00 115.64 113.49 1x8z s THR 11 Ca 0.49 -1.10 -0.05 0.00 0.31 0.00 0.00 61.69 61.35 1x8z s THR 11 Cb 0.38 -3.37 0.11 0.00 0.01 0.00 0.00 72.50 69.63 1x8z s THR 11 CO 0.13 -0.16 1.73 0.25 -0.69 0.00 0.00 174.62 175.88 1x8z h LEU 12 N 2.18 0.89 -6.80 4.42 5.85 -1.93 -3.34 115.31 116.57 1x8z h LEU 12 Ca -0.48 -0.21 -0.61 0.00 0.84 0.00 0.00 57.88 57.42 1x8z h LEU 12 Cb 1.21 -0.24 -0.40 0.00 0.37 0.00 0.00 40.66 41.60 1x8z h LEU 12 CO 0.63 0.92 -0.74 0.21 -0.34 0.00 0.00 178.44 179.12 1x8z s ASN 13 N -6.59 3.42 0.46 1.25 3.04 -1.26 -4.97 114.94 110.30 1x8z s ASN 13 Ca -0.10 -3.45 0.12 0.00 0.04 0.00 0.00 52.86 49.47 1x8z s ASN 13 Cb 0.15 -1.12 1.06 0.00 -1.54 0.00 0.00 41.25 39.79 1x8z s ASN 13 CO 0.83 -0.13 2.10 1.55 -3.04 0.00 0.00 177.10 178.41 1x8z h PRO 14 N 5.61 0.27 0.00 0.43 0.13 -1.70 -1.54 132.00 135.20 1x8z h PRO 14 Ca 0.18 -0.02 -0.02 0.00 -0.87 0.00 0.00 66.00 65.27 1x8z h PRO 14 Cb 0.83 -0.06 -0.00 0.00 0.13 0.00 0.00 31.00 31.89 1x8z h PRO 14 CO 0.56 0.18 -0.08 0.77 -0.23 0.00 0.00 178.00 179.21 1x8z h SER 15 N 0.28 0.00 0.00 1.44 0.02 -1.93 -0.61 113.55 112.75 1x8z h SER 15 Ca 0.08 0.00 -0.10 0.00 -0.84 0.00 0.00 61.79 60.93 1x8z h SER 15 Cb -0.02 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.51 1x8z h SER 15 CO -0.02 0.08 -0.65 0.15 -1.14 0.00 0.00 176.83 175.25 1x8z h PHE 16 N 0.00 0.00 -0.16 3.45 3.57 -1.73 -3.29 116.94 118.78 1x8z h PHE 16 Ca -0.00 0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.53 1x8z h PHE 16 Cb 0.54 0.00 -0.07 0.00 2.79 0.00 0.00 35.95 39.22 1x8z h PHE 16 CO 0.00 0.89 -0.53 0.00 -2.23 0.00 0.00 178.31 176.44 1x8z h LEU 18 N -0.56 -1.90 -1.38 0.00 5.85 -1.29 0.50 115.31 116.52 1x8z h LEU 18 Ca 0.04 0.29 0.00 0.00 0.84 0.00 0.00 57.88 59.05 1x8z h LEU 18 Cb 0.67 0.84 0.00 0.00 0.37 0.00 0.00 40.66 42.54 1x8z h LEU 18 CO -0.45 -0.21 0.00 0.11 -0.34 0.00 0.00 178.44 177.54 1x8z h LYS 19 N -0.03 0.00 -0.04 1.25 1.57 -1.55 -2.15 116.57 115.62 1x8z h LYS 19 Ca 0.14 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.81 1x8z h LYS 19 Cb 0.38 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.69 1x8z h LYS 19 CO -0.81 0.00 -0.39 0.35 -0.57 0.00 0.00 179.45 178.03 1x8z h PHE 20 N 0.00 0.47 0.07 -1.35 3.57 0.14 -3.33 116.94 116.52 1x8z h PHE 20 Ca 0.00 -0.23 -0.26 0.00 3.53 0.00 0.00 57.97 61.02 1x8z h PHE 20 Cb 0.28 -0.07 0.01 0.00 2.79 0.00 0.00 35.95 38.96 1x8z h PHE 20 CO 0.00 1.00 -1.10 -0.07 -2.23 0.00 0.00 178.31 175.91 1x8z h LEU 21 N -0.18 0.57 -0.19 0.59 3.38 -1.23 -3.09 115.31 115.16 1x8z h LEU 21 Ca -0.04 -0.52 0.00 0.00 0.09 0.00 0.00 57.88 57.42 1x8z h LEU 21 Cb 1.07 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.65 1x8z h LEU 21 CO 0.08 1.35 0.00 0.59 0.09 0.00 0.00 178.44 180.55 1x8z n ASN 22 N -3.69 0.06 0.00 -0.43 3.02 -0.82 -1.68 115.26 111.73 1x8z n ASN 22 Ca -0.09 -0.65 0.00 0.00 -0.03 0.00 0.00 54.58 53.81 1x8z n ASN 22 Cb 0.93 -0.03 0.00 0.00 -0.61 0.00 0.00 39.78 40.07 1x8z n ASN 22 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1x8z n THR 23 N -0.34 0.00 1.80 3.41 -2.24 -1.23 -4.17 114.28 111.50 1x8z n THR 23 Ca 0.00 0.00 0.01 0.00 -2.27 0.00 0.00 64.05 61.79 1x8z n THR 23 Cb 0.02 -0.39 0.07 0.00 -2.10 0.00 0.00 70.33 67.92 1x8z n THR 23 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1x8z n LYS 24 N -2.19 0.90 0.00 -0.78 4.76 -0.68 -2.78 118.16 117.39 1x8z n LYS 24 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 1x8z n LYS 24 Cb 0.32 -1.04 0.00 0.00 -1.84 0.00 0.00 35.03 32.47 1x8z n LYS 24 CO 0.00 0.00 0.00 1.19 -1.37 0.00 0.00 177.40 177.22 1x8z n PHE 25 N -0.54 0.00 0.31 2.13 3.01 -0.67 -4.92 117.46 116.79 1x8z n PHE 25 Ca 0.02 0.00 -0.17 0.00 1.01 0.00 0.00 57.45 58.31 1x8z n PHE 25 Cb 0.01 0.07 -0.09 0.00 -0.01 0.00 0.00 39.48 39.46 1x8z n PHE 25 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1x8z h ALA 26 N 0.00 -0.77 -3.21 4.37 0.00 -1.68 -3.40 119.26 114.57 1x8z h ALA 26 Ca 0.00 -0.18 -0.68 0.00 0.00 0.00 0.00 54.91 54.05 1x8z h ALA 26 Cb 0.91 0.30 -0.30 0.00 0.00 0.00 0.00 17.79 18.70 1x8z h ALA 26 CO 0.00 -0.90 -0.69 0.45 0.00 0.00 0.00 179.25 178.11 1x8z s SER 27 N -4.56 4.74 0.65 0.00 0.15 -1.26 -5.07 113.70 108.35 1x8z s SER 27 Ca -0.17 -0.89 -0.16 0.00 0.70 0.00 0.00 55.95 55.44 1x8z s SER 27 Cb 0.03 -1.76 -0.00 0.00 -1.71 0.00 0.00 66.02 62.58 1x8z s SER 27 CO 0.60 -0.18 1.15 -2.84 1.20 0.00 0.00 173.24 173.17 1x8z s PRO 28 N 1.38 2.73 0.07 5.44 0.02 -1.26 -4.94 135.00 138.44 1x8z s PRO 28 Ca 0.00 1.57 -0.31 0.00 0.02 0.00 0.00 61.00 62.28 1x8z s PRO 28 Cb -0.17 -1.93 -0.08 0.00 0.02 0.00 0.00 34.50 32.34 1x8z s PRO 28 CO -0.01 -1.34 1.57 1.21 -0.33 0.00 0.00 177.00 178.10 1x8z s ASN 29 N -2.21 6.67 0.22 2.53 3.04 -1.26 -4.90 114.94 119.03 1x8z s ASN 29 Ca 0.71 2.40 -0.08 0.00 0.04 0.00 0.00 52.86 55.94 1x8z s ASN 29 Cb -0.24 -2.57 0.29 0.00 -1.54 0.00 0.00 41.25 37.19 1x8z s ASN 29 CO 0.39 -0.83 1.81 -0.07 -3.04 0.00 0.00 177.10 175.36 1x8z h LEU 30 N 8.21 0.60 -0.83 3.21 3.38 -1.99 -0.38 115.31 127.51 1x8z h LEU 30 Ca -0.41 0.04 0.06 0.00 0.09 0.00 0.00 57.88 57.65 1x8z h LEU 30 Cb 1.20 -0.08 -0.06 0.00 0.09 0.00 0.00 40.66 41.81 1x8z h LEU 30 CO 0.92 0.37 0.51 1.56 0.09 0.00 0.00 178.44 181.88 1x8z h GLN 31 N 0.73 0.90 -0.58 1.13 1.08 -1.97 -1.06 115.11 115.33 1x8z h GLN 31 Ca 0.33 -0.05 -0.06 0.00 -1.45 0.00 0.00 58.65 57.42 1x8z h GLN 31 Cb 0.24 -0.20 -0.03 0.00 -0.05 0.00 0.00 27.48 27.44 1x8z h GLN 31 CO -0.21 0.59 0.11 0.00 -0.95 0.00 0.00 178.83 178.37 1x8z h ALA 32 N 1.40 1.09 -0.42 3.87 0.00 -1.56 -1.00 119.26 122.63 1x8z h ALA 32 Ca 0.36 -0.24 -0.15 0.00 0.00 0.00 0.00 54.91 54.89 1x8z h ALA 32 Cb 0.17 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1x8z h ALA 32 CO -0.17 0.60 -0.31 -0.07 0.00 0.00 0.00 179.25 179.29 1x8z h LEU 33 N 0.88 1.00 -0.52 0.00 3.38 -0.30 -2.36 115.31 117.38 1x8z h LEU 33 Ca 0.18 -0.44 -0.11 0.00 0.09 0.00 0.00 57.88 57.61 1x8z h LEU 33 Cb 0.37 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 1x8z h LEU 33 CO 0.01 1.22 -0.10 0.00 0.09 0.00 0.00 178.44 179.66 1x8z h ALA 34 N 0.80 0.72 -0.40 1.53 0.00 -1.05 -2.33 119.26 118.53 1x8z h ALA 34 Ca 0.08 -0.35 0.02 0.00 0.00 0.00 0.00 54.91 54.67 1x8z h ALA 34 Cb 0.90 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.47 1x8z h ALA 34 CO 0.08 0.62 0.22 -0.22 0.00 0.00 0.00 179.25 179.96 1x8z h LYS 35 N 0.86 0.43 -0.20 0.00 3.11 -1.05 0.16 116.57 119.89 1x8z h LYS 35 Ca 0.14 -0.03 -0.03 0.00 -2.81 0.00 0.00 60.65 57.91 1x8z h LYS 35 Cb 0.67 -0.10 -0.01 0.00 -1.00 0.00 0.00 32.23 31.79 1x8z h LYS 35 CO 0.05 0.29 -0.01 1.15 -2.81 0.00 0.00 179.45 178.11 1x8z h THR 36 N 0.45 1.26 0.15 1.00 2.02 -1.41 -0.82 112.91 115.56 1x8z h THR 36 Ca 0.16 -0.92 0.01 0.00 0.77 0.00 0.00 66.41 66.44 1x8z h THR 36 Cb 0.03 1.48 -0.03 0.00 -1.74 0.00 0.00 68.15 67.89 1x8z h THR 36 CO -0.09 0.28 -0.27 0.74 0.37 0.00 0.00 175.52 176.55 1x8z h THR 37 N 0.10 0.42 -0.94 3.16 2.02 -1.07 -0.61 112.91 115.99 1x8z h THR 37 Ca 0.05 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.27 1x8z h THR 37 Cb 0.42 0.42 -0.06 0.00 -1.74 0.00 0.00 68.15 67.19 1x8z h THR 37 CO 0.01 0.00 0.61 -0.07 0.37 0.00 0.00 175.52 176.44 1x8z h LEU 38 N -0.50 1.01 -0.49 2.58 3.38 -0.68 0.73 115.31 121.34 1x8z h LEU 38 Ca 0.02 -0.01 0.10 0.00 0.09 0.00 0.00 57.88 58.08 1x8z h LEU 38 Cb 0.51 -0.23 -0.10 0.00 0.09 0.00 0.00 40.66 40.93 1x8z h LEU 38 CO -0.13 0.69 -0.28 0.44 0.09 0.00 0.00 178.44 179.25 1x8z h ASP 39 N 1.18 -0.95 -0.22 -0.43 5.19 -0.16 0.65 116.42 121.67 1x8z h ASP 39 Ca 0.38 0.20 -0.16 0.00 -0.62 0.00 0.00 57.03 56.83 1x8z h ASP 39 Cb 0.02 0.48 -0.01 0.00 0.18 0.00 0.00 39.33 40.01 1x8z h ASP 39 CO -0.13 -0.28 -0.45 0.28 -3.12 0.00 0.00 179.24 175.54 1x8z h SER 40 N -0.17 0.85 -0.63 6.45 0.02 -0.41 -2.43 113.55 117.23 1x8z h SER 40 Ca 0.22 -0.41 -0.08 0.00 -0.84 0.00 0.00 61.79 60.67 1x8z h SER 40 Cb 0.51 -0.24 -0.03 0.00 0.14 0.00 0.00 62.40 62.79 1x8z h SER 40 CO -0.59 1.17 0.08 0.74 -1.14 0.00 0.00 176.83 177.09 1x8z h THR 41 N 0.63 1.26 -0.54 -2.27 2.02 0.06 -1.78 112.91 112.28 1x8z h THR 41 Ca 0.04 -1.06 -0.08 0.00 0.77 0.00 0.00 66.41 66.08 1x8z h THR 41 Cb 1.02 0.68 -0.02 0.00 -1.74 0.00 0.00 68.15 68.09 1x8z h THR 41 CO 0.10 0.39 0.01 1.56 0.37 0.00 0.00 175.52 177.95 1x8z h GLN 42 N 1.00 0.93 0.33 6.66 4.20 0.34 -2.24 115.11 126.33 1x8z h GLN 42 Ca 0.19 -0.27 -0.02 0.00 0.06 0.00 0.00 58.65 58.62 1x8z h GLN 42 Cb 0.47 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 28.15 1x8z h GLN 42 CO 0.02 0.91 -0.16 0.00 -0.67 0.00 0.00 178.83 178.93 1x8z h ALA 43 N 1.14 -0.45 -0.73 3.87 0.00 -1.21 -2.22 119.26 119.66 1x8z h ALA 43 Ca 0.16 -0.18 0.04 0.00 0.00 0.00 0.00 54.91 54.93 1x8z h ALA 43 Cb 0.50 0.17 -0.05 0.00 0.00 0.00 0.00 17.79 18.41 1x8z h ALA 43 CO 0.02 -0.58 0.45 -0.09 0.00 0.00 0.00 179.25 179.06 1x8z h ARG 44 N -0.79 0.84 0.12 0.00 2.43 -1.36 -0.20 114.38 115.41 1x8z h ARG 44 Ca -0.05 -0.05 0.02 0.00 -0.81 0.00 0.00 59.98 59.09 1x8z h ARG 44 Cb 0.52 -0.19 -0.04 0.00 -0.42 0.00 0.00 29.97 29.84 1x8z h ARG 44 CO 0.07 0.55 -0.28 0.00 -1.51 0.00 0.00 179.97 178.81 1x8z h ALA 45 N 1.33 -0.47 -0.58 2.80 0.00 -1.41 0.42 119.26 121.35 1x8z h ALA 45 Ca 0.30 -0.04 0.12 0.00 0.00 0.00 0.00 54.91 55.29 1x8z h ALA 45 Cb 0.07 0.45 -0.10 0.00 0.00 0.00 0.00 17.79 18.21 1x8z h ALA 45 CO -0.13 -0.82 -0.01 1.15 0.00 0.00 0.00 179.25 179.44 1x8z h THR 46 N -0.49 0.52 -0.26 0.00 2.02 -0.70 -0.24 112.91 113.76 1x8z h THR 46 Ca 0.03 -0.04 -0.00 0.00 0.77 0.00 0.00 66.41 67.17 1x8z h THR 46 Cb 0.52 0.40 -0.01 0.00 -1.74 0.00 0.00 68.15 67.32 1x8z h THR 46 CO -0.16 0.02 0.15 1.56 0.37 0.00 0.00 175.52 177.46 1x8z h GLN 47 N 0.10 0.36 -0.68 6.66 1.08 -0.15 -1.59 115.11 120.89 1x8z h GLN 47 Ca 0.30 -0.04 0.10 0.00 -1.45 0.00 0.00 58.65 57.56 1x8z h GLN 47 Cb 0.47 -0.07 -0.04 0.00 -0.05 0.00 0.00 27.48 27.78 1x8z h GLN 47 CO -0.50 0.30 0.45 1.15 -0.95 0.00 0.00 178.83 179.28 1x8z h THR 48 N 0.32 0.90 0.81 -0.54 2.02 0.90 -1.95 112.91 115.37 1x8z h THR 48 Ca 0.09 -0.18 -0.04 0.00 0.77 0.00 0.00 66.41 67.06 1x8z h THR 48 Cb 0.04 0.34 0.01 0.00 -1.74 0.00 0.00 68.15 66.80 1x8z h THR 48 CO -0.02 0.09 -0.39 0.25 0.37 0.00 0.00 175.52 175.83 1x8z h LEU 49 N 0.52 -0.92 -0.98 2.58 5.85 -0.22 -2.36 115.31 119.77 1x8z h LEU 49 Ca 0.32 0.02 0.31 0.00 0.84 0.00 0.00 57.88 59.37 1x8z h LEU 49 Cb 0.55 0.24 -0.15 0.00 0.37 0.00 0.00 40.66 41.66 1x8z h LEU 49 CO -0.10 -0.58 0.49 0.11 -0.34 0.00 0.00 178.44 178.01 1x8z h LYS 50 N -1.22 0.26 0.47 1.25 1.57 -0.60 -2.12 116.57 116.17 1x8z h LYS 50 Ca -0.11 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.63 1x8z h LYS 50 Cb 0.84 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 33.10 1x8z h LYS 50 CO 0.18 0.17 -0.23 -0.22 -0.57 0.00 0.00 179.45 178.79 1x8z h LYS 51 N 0.26 -0.61 -1.26 3.15 3.64 -1.26 -1.72 116.57 118.78 1x8z h LYS 51 Ca 0.71 0.04 0.37 0.00 -1.27 0.00 0.00 60.65 60.49 1x8z h LYS 51 Cb 1.61 0.14 -0.08 0.00 -0.41 0.00 0.00 32.23 33.48 1x8z h LYS 51 CO -0.64 -0.31 0.85 -0.07 -2.27 0.00 0.00 179.45 177.01 1x8z h LEU 52 N -1.01 0.20 -0.17 5.20 3.38 -0.85 1.04 115.31 123.10 1x8z h LEU 52 Ca -0.06 0.06 -0.21 0.00 0.09 0.00 0.00 57.88 57.76 1x8z h LEU 52 Cb 0.58 0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.35 1x8z h LEU 52 CO 0.11 -0.02 -0.95 1.56 0.09 0.00 0.00 178.44 179.23 1x8z h GLN 53 N 0.14 0.12 -0.33 1.13 4.20 -1.33 -2.18 115.11 116.86 1x8z h GLN 53 Ca 0.67 -0.15 -0.12 0.00 0.06 0.00 0.00 58.65 59.11 1x8z h GLN 53 Cb 2.26 0.05 -0.01 0.00 0.30 0.00 0.00 27.48 30.08 1x8z h GLN 53 CO -0.20 0.98 -0.27 0.77 -0.67 0.00 0.00 178.83 179.44 1x8z h SER 54 N 0.05 0.80 0.00 1.46 0.02 0.19 0.18 113.55 116.25 1x8z h SER 54 Ca -0.04 -0.45 0.00 0.00 -0.84 0.00 0.00 61.79 60.46 1x8z h SER 54 Cb 1.63 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 63.94 1x8z h SER 54 CO 0.14 1.09 0.00 -0.38 -1.14 0.00 0.00 176.83 176.53 1x8z n ILE 55 N -4.24 0.00 -0.17 3.27 2.08 0.94 -0.43 119.36 120.81 1x8z n ILE 55 Ca -0.03 1.48 -0.11 0.00 0.56 0.00 0.00 62.75 64.65 1x8z n ILE 55 Cb 0.46 -2.31 -0.07 0.00 -0.75 0.00 0.00 39.64 36.97 1x8z n ILE 55 CO 0.00 0.00 0.00 0.40 0.56 0.00 0.00 176.55 177.51 1x8z h ILE 56 N 0.00 0.05 -0.67 1.39 1.08 -1.41 -0.38 117.51 117.57 1x8z h ILE 56 Ca 0.00 0.00 0.12 0.00 -0.39 0.00 0.00 64.86 64.59 1x8z h ILE 56 Cb 0.00 0.05 -0.13 0.00 -3.07 0.00 0.00 36.82 33.67 1x8z h ILE 56 CO 0.00 0.00 -0.29 -0.78 -0.69 0.00 0.00 178.15 176.39 1x8z h ASP 57 N -0.31 -1.02 0.11 1.72 1.82 -0.56 1.60 116.42 119.78 1x8z h ASP 57 Ca 0.13 0.23 0.00 0.00 -0.39 0.00 0.00 57.03 57.00 1x8z h ASP 57 Cb 0.58 0.55 0.00 0.00 0.68 0.00 0.00 39.33 41.13 1x8z h ASP 57 CO -0.64 -0.28 0.00 0.61 -1.61 0.00 0.00 179.24 177.32 1x8z n GLY 58 N -1.46 -0.51 1.15 -0.78 0.00 0.43 -4.95 105.19 99.07 1x8z n GLY 58 Ca 0.07 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1x8z n GLY 58 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1x8z n GLY 59 N -0.35 -4.31 0.01 -0.02 0.00 0.55 -5.06 105.19 96.01 1x8z n GLY 59 Ca 0.06 -0.71 -0.00 0.00 0.00 0.00 0.00 46.02 45.38 1x8z n GLY 59 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1x8z n VAL 60 N -0.24 0.00 -1.62 1.61 0.24 -1.26 -4.91 118.33 112.15 1x8z n VAL 60 Ca 0.00 -0.01 -0.46 0.00 -2.04 0.00 0.00 64.34 61.83 1x8z n VAL 60 Cb 0.00 0.00 -0.04 0.00 -1.47 0.00 0.00 33.84 32.33 1x8z n VAL 60 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 1x8z n ASP 61 N -2.51 3.39 -0.09 -1.34 8.00 -1.26 -4.74 116.55 118.00 1x8z n ASP 61 Ca 0.00 0.68 0.26 0.00 0.71 0.00 0.00 54.79 56.43 1x8z n ASP 61 Cb 0.00 -1.44 0.72 0.00 -0.02 0.00 0.00 41.12 40.38 1x8z n ASP 61 CO 0.00 0.00 0.00 1.55 -0.39 0.00 0.00 177.20 178.36 1x8z h PRO 62 N 11.54 0.00 0.00 -0.24 0.13 -1.99 1.19 132.00 142.63 1x8z h PRO 62 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 1x8z h PRO 62 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 1x8z h PRO 62 CO 0.96 0.00 0.00 -0.09 -0.23 0.00 0.00 178.00 178.64 1x8z h ARG 63 N 0.00 0.00 0.08 0.86 1.12 -2.02 -2.95 114.38 111.47 1x8z h ARG 63 Ca 0.35 0.00 -0.37 0.00 -1.11 0.00 0.00 59.98 58.85 1x8z h ARG 63 Cb 1.59 0.00 -0.04 0.00 -0.01 0.00 0.00 29.97 31.51 1x8z h ARG 63 CO -0.00 0.00 -2.16 0.43 -3.11 0.00 0.00 179.97 175.12 1x8z n SER 64 N -2.88 2.08 0.33 -3.80 7.64 0.35 -3.95 113.62 113.39 1x8z n SER 64 Ca 0.03 0.09 0.08 0.00 1.01 0.00 0.00 58.87 60.08 1x8z n SER 64 Cb 0.39 -0.71 0.43 0.00 -1.01 0.00 0.00 64.21 63.31 1x8z n SER 64 CO 0.00 0.00 0.00 0.50 -3.01 0.00 0.00 175.04 172.53 1x8z h LYS 65 N 0.03 0.00 0.00 1.43 3.64 0.24 0.53 116.57 122.44 1x8z h LYS 65 Ca -0.48 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.90 1x8z h LYS 65 Cb 1.98 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.80 1x8z h LYS 65 CO 0.02 0.00 0.00 -0.11 -2.27 0.00 0.00 179.45 177.09 1x8z n LEU 66 N -2.67 0.06 -0.27 5.20 0.00 -1.18 -3.33 117.00 114.81 1x8z n LEU 66 Ca -0.01 0.83 0.05 0.00 0.00 0.00 0.00 56.01 56.88 1x8z n LEU 66 Cb 0.66 -0.46 0.15 0.00 0.00 0.00 0.00 43.42 43.76 1x8z n LEU 66 CO 0.07 -0.46 0.79 0.00 0.00 0.00 0.00 177.39 177.79 1x8z h ALA 67 N -2.00 0.74 0.00 1.96 0.00 -0.21 0.17 119.26 119.92 1x8z h ALA 67 Ca 0.00 0.27 0.00 0.00 0.00 0.00 0.00 54.91 55.18 1x8z h ALA 67 Cb 0.00 0.48 0.00 0.00 0.00 0.00 0.00 17.79 18.27 1x8z h ALA 67 CO 0.00 -0.43 0.00 0.66 0.00 0.00 0.00 179.25 179.48 1x8z n TYR 68 N -5.40 0.00 -1.43 0.00 0.53 -0.44 -1.52 117.16 108.90 1x8z n TYR 68 Ca 0.13 -0.72 0.00 0.00 -1.02 0.00 0.00 57.90 56.29 1x8z n TYR 68 Cb 0.47 -0.38 0.00 0.00 -1.03 0.00 0.00 39.34 38.40 1x8z n TYR 68 CO 0.00 0.00 0.00 0.54 -1.02 0.00 0.00 176.86 176.38 1x8z n ARG 69 N 1.14 0.00 -0.00 -0.72 1.74 0.50 -4.60 116.66 114.72 1x8z n ARG 69 Ca 0.00 0.00 0.10 0.00 -0.77 0.00 0.00 57.85 57.18 1x8z n ARG 69 Cb 0.45 -0.02 -0.13 0.00 -1.02 0.00 0.00 32.46 31.74 1x8z n ARG 69 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 1x8z n SER 70 N 0.00 0.66 -0.03 0.55 3.41 -0.55 -3.62 113.62 114.04 1x8z n SER 70 Ca 0.00 -0.44 -0.18 0.00 -0.26 0.00 0.00 58.87 57.98 1x8z n SER 70 Cb 0.13 1.49 -0.14 0.00 -0.26 0.00 0.00 64.21 65.43 1x8z n SER 70 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1x8z h VAL 72 N 0.04 0.90 0.00 0.00 2.07 -1.79 0.19 116.25 117.66 1x8z h VAL 72 Ca -0.44 -0.14 -0.13 0.00 0.82 0.00 0.00 66.70 66.81 1x8z h VAL 72 Cb 2.02 0.45 -0.02 0.00 -1.52 0.00 0.00 31.29 32.22 1x8z h VAL 72 CO 0.05 0.08 -0.60 -2.24 0.02 0.00 0.00 177.57 174.88 1x8z h ASP 73 N 0.41 0.00 0.51 0.57 2.03 -1.74 -2.51 116.42 115.69 1x8z h ASP 73 Ca 0.22 0.00 -0.11 0.00 -0.73 0.00 0.00 57.03 56.41 1x8z h ASP 73 Cb 0.18 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 38.67 1x8z h ASP 73 CO -0.19 0.60 -0.51 -0.33 -1.03 0.00 0.00 179.24 177.78 1x8z h GLU 74 N 0.00 0.00 0.00 4.15 4.39 -1.39 -2.71 114.58 119.03 1x8z h GLU 74 Ca -0.01 0.00 -0.12 0.00 0.34 0.00 0.00 59.36 59.57 1x8z h GLU 74 Cb 1.41 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 30.04 1x8z h GLU 74 CO 0.08 0.51 -0.86 1.88 -1.16 0.00 0.00 179.01 179.45 1x8z h TYR 75 N 0.00 0.00 -0.04 4.33 0.05 -0.59 -2.27 116.97 118.45 1x8z h TYR 75 Ca -0.01 0.00 -0.08 0.00 0.05 0.00 0.00 58.73 58.69 1x8z h TYR 75 Cb 0.90 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.63 1x8z h TYR 75 CO 0.00 0.50 -0.37 0.93 -1.05 0.00 0.00 178.16 178.17 1x8z h GLU 76 N 0.00 0.08 0.22 4.88 5.08 -1.19 -1.53 114.58 122.12 1x8z h GLU 76 Ca -0.06 -0.03 -0.34 0.00 -1.00 0.00 0.00 59.36 57.93 1x8z h GLU 76 Cb 1.44 -0.00 0.02 0.00 0.50 0.00 0.00 28.75 30.71 1x8z h GLU 76 CO 0.05 0.44 -1.56 0.66 -1.00 0.00 0.00 179.01 177.60 1x8z h SER 77 N 0.07 0.71 -0.64 1.42 4.64 -1.47 -3.24 113.55 115.04 1x8z h SER 77 Ca 0.01 -0.86 0.00 0.00 -0.47 0.00 0.00 61.79 60.47 1x8z h SER 77 Cb 0.69 -0.23 -0.03 0.00 -0.31 0.00 0.00 62.40 62.52 1x8z h SER 77 CO 0.05 1.69 0.41 0.00 -0.87 0.00 0.00 176.83 178.11 1x8z h ALA 78 N 0.20 0.82 0.00 5.18 0.00 -1.15 -1.28 119.26 123.03 1x8z h ALA 78 Ca -0.28 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.53 1x8z h ALA 78 Cb 2.13 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 19.65 1x8z h ALA 78 CO 0.23 0.27 -0.18 0.82 0.00 0.00 0.00 179.25 180.40 1x8z h ILE 79 N 0.87 1.01 0.27 0.00 2.04 -1.41 0.75 117.51 121.04 1x8z h ILE 79 Ca 0.23 -0.62 -0.01 0.00 1.00 0.00 0.00 64.86 65.46 1x8z h ILE 79 Cb -0.06 1.35 0.00 0.00 -0.74 0.00 0.00 36.82 37.37 1x8z h ILE 79 CO -0.05 0.17 -0.13 1.23 0.00 0.00 0.00 178.15 179.37 1x8z h GLY 80 N 0.62 -0.38 0.26 5.37 0.00 -1.37 -1.61 103.07 105.96 1x8z h GLY 80 Ca -0.00 0.14 0.10 0.00 0.00 0.00 0.00 47.33 47.57 1x8z h GLY 80 CO 0.02 -0.14 0.12 3.43 0.00 0.00 0.00 176.54 179.98 1x8z h ASN 81 N -0.92 0.02 -0.81 0.19 4.21 -0.96 0.41 115.58 117.72 1x8z h ASN 81 Ca -0.04 0.10 0.04 0.00 1.21 0.00 0.00 56.30 57.62 1x8z h ASN 81 Cb 0.50 0.14 -0.05 0.00 -1.12 0.00 0.00 38.32 37.79 1x8z h ASN 81 CO 0.06 0.03 0.51 -0.07 -1.29 0.00 0.00 177.43 176.66 1x8z h LEU 82 N 0.26 0.82 -1.46 1.61 4.07 -0.91 0.56 115.31 120.27 1x8z h LEU 82 Ca 0.29 0.00 -0.04 0.00 0.08 0.00 0.00 57.88 58.22 1x8z h LEU 82 Cb 0.41 -0.17 -0.01 0.00 1.08 0.00 0.00 40.66 41.97 1x8z h LEU 82 CO -0.37 0.55 -0.03 -0.08 -1.08 0.00 0.00 178.44 177.43 1x8z h GLU 83 N 0.97 0.31 0.00 1.13 4.81 -0.02 -0.81 114.58 120.96 1x8z h GLU 83 Ca 0.34 -0.05 -0.12 0.00 -0.13 0.00 0.00 59.36 59.39 1x8z h GLU 83 Cb 0.07 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.38 1x8z h GLU 83 CO -0.14 0.36 -0.63 0.93 -0.73 0.00 0.00 179.01 178.80 1x8z h GLU 84 N 0.30 0.00 -0.43 1.92 5.08 0.11 -2.94 114.58 118.62 1x8z h GLU 84 Ca 0.07 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.37 1x8z h GLU 84 Cb 0.26 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.49 1x8z h GLU 84 CO 0.01 0.55 0.03 0.00 -1.00 0.00 0.00 179.01 178.60 1x8z h ALA 85 N 1.42 0.58 -0.86 3.43 0.00 0.13 -1.75 119.26 122.21 1x8z h ALA 85 Ca -0.02 -0.25 0.04 0.00 0.00 0.00 0.00 54.91 54.68 1x8z h ALA 85 Cb 1.45 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 19.03 1x8z h ALA 85 CO 0.07 0.34 0.57 0.35 0.00 0.00 0.00 179.25 180.58 1x8z h PHE 86 N 0.59 1.04 -0.10 0.00 3.57 -1.14 0.96 116.94 121.86 1x8z h PHE 86 Ca 0.13 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.63 1x8z h PHE 86 Cb 0.44 -0.35 -0.00 0.00 2.79 0.00 0.00 35.95 38.83 1x8z h PHE 86 CO 0.03 0.60 -0.01 0.93 -2.23 0.00 0.00 178.31 177.63 1x8z h GLU 87 N 1.07 0.18 -0.45 1.11 5.08 -1.29 -1.55 114.58 118.74 1x8z h GLU 87 Ca 0.34 -0.07 0.04 0.00 -1.00 0.00 0.00 59.36 58.68 1x8z h GLU 87 Cb 0.03 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.23 1x8z h GLU 87 CO -0.10 0.47 0.20 0.45 -1.00 0.00 0.00 179.01 179.03 1x8z h HIS 88 N -0.12 0.37 -0.39 4.33 3.86 -0.81 -1.23 115.15 121.15 1x8z h HIS 88 Ca 0.03 0.02 0.08 0.00 -1.16 0.00 0.00 60.37 59.33 1x8z h HIS 88 Cb 0.40 -0.10 -0.07 0.00 1.06 0.00 0.00 27.41 28.70 1x8z h HIS 88 CO 0.05 0.17 -0.10 1.25 0.86 0.00 0.00 177.93 180.15 1x8z h LEU 89 N 0.40 -0.38 -2.04 2.43 5.85 -0.73 0.25 115.31 121.10 1x8z h LEU 89 Ca 0.20 0.12 0.13 0.00 0.84 0.00 0.00 57.88 59.16 1x8z h LEU 89 Cb 0.14 0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.40 1x8z h LEU 89 CO -0.16 -0.13 0.37 0.00 -0.34 0.00 0.00 178.44 178.17 1x8z h ALA 90 N 1.37 2.26 -0.55 1.25 0.00 -0.19 0.27 119.26 123.67 1x8z h ALA 90 Ca 0.19 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1x8z h ALA 90 Cb 0.29 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1x8z h ALA 90 CO -0.40 -0.59 0.00 0.43 0.00 0.00 0.00 179.25 178.68 1x8z n SER 91 N -4.06 3.64 -2.19 0.00 7.64 0.77 -4.90 113.62 114.52 1x8z n SER 91 Ca 0.08 -2.23 -0.20 0.00 1.01 0.00 0.00 58.87 57.53 1x8z n SER 91 Cb 0.56 -0.47 -0.03 0.00 -1.01 0.00 0.00 64.21 63.26 1x8z n SER 91 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x8z n GLY 92 N 1.15 0.12 3.40 0.23 0.00 0.93 -4.90 105.19 106.12 1x8z n GLY 92 Ca 0.20 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.78 1x8z n GLY 92 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1x8z s ASP 93 N -2.21 7.09 0.15 1.61 2.15 -0.61 -4.88 116.67 119.98 1x8z s ASP 93 Ca 0.00 -3.11 -0.21 0.00 0.43 0.00 0.00 52.55 49.66 1x8z s ASP 93 Cb 0.00 -2.30 0.05 0.00 -0.30 0.00 0.00 42.92 40.36 1x8z s ASP 93 CO 0.00 -0.57 1.64 1.23 -0.17 0.00 0.00 175.17 177.30 1x8z h GLY 94 N 8.33 -0.03 1.00 2.66 0.00 -1.85 -1.10 103.07 112.09 1x8z h GLY 94 Ca 0.22 0.25 -0.00 0.00 0.00 0.00 0.00 47.33 47.79 1x8z h GLY 94 CO 1.08 -0.18 -0.03 -0.33 0.00 0.00 0.00 176.54 177.07 1x8z h MET 95 N -0.18 -0.09 -0.71 4.80 2.86 -1.91 0.52 114.93 120.22 1x8z h MET 95 Ca 0.15 0.01 0.05 0.00 -2.06 0.00 0.00 59.70 57.84 1x8z h MET 95 Cb 0.41 0.02 -0.05 0.00 0.06 0.00 0.00 31.60 32.04 1x8z h MET 95 CO -0.39 -0.06 0.43 0.78 1.06 0.00 0.00 176.91 178.74 1x8z h GLY 96 N -0.09 1.04 1.00 8.32 0.00 -1.93 -0.42 103.07 111.00 1x8z h GLY 96 Ca -0.01 -0.31 -0.04 0.00 0.00 0.00 0.00 47.33 46.97 1x8z h GLY 96 CO 0.01 0.23 -0.39 1.98 0.00 0.00 0.00 176.54 178.37 1x8z h MET 97 N 0.81 -1.04 -0.79 4.80 -1.53 -0.86 -2.43 114.93 113.88 1x8z h MET 97 Ca 0.30 0.07 0.18 0.00 -3.44 0.00 0.00 59.70 56.81 1x8z h MET 97 Cb 0.11 0.24 -0.14 0.00 -0.55 0.00 0.00 31.60 31.25 1x8z h MET 97 CO -0.15 -0.70 -0.06 -0.97 0.14 0.00 0.00 176.91 175.18 1x8z h ASN 98 N -1.08 -0.49 0.07 1.39 -0.73 0.61 0.68 115.58 116.02 1x8z h ASN 98 Ca -0.11 0.22 -0.00 0.00 1.87 0.00 0.00 56.30 58.28 1x8z h ASN 98 Cb 0.83 0.41 -0.00 0.00 0.27 0.00 0.00 38.32 39.83 1x8z h ASN 98 CO 0.17 -0.23 -0.06 -0.03 -0.37 0.00 0.00 177.43 176.92 1x8z h MET 99 N 0.06 -0.12 -0.85 6.67 4.05 -0.92 0.11 114.93 123.93 1x8z h MET 99 Ca 0.42 0.01 0.19 0.00 -0.28 0.00 0.00 59.70 60.04 1x8z h MET 99 Cb 0.73 0.03 -0.11 0.00 -0.80 0.00 0.00 31.60 31.45 1x8z h MET 99 CO -0.74 -0.08 0.36 0.87 0.23 0.00 0.00 176.91 177.54 1x8z h LYS 100 N -0.13 0.42 0.33 0.39 6.56 -0.94 0.19 116.57 123.39 1x8z h LYS 100 Ca -0.01 -0.03 -0.02 0.00 -1.06 0.00 0.00 60.65 59.54 1x8z h LYS 100 Cb 0.11 -0.10 0.00 0.00 -0.57 0.00 0.00 32.23 31.68 1x8z h LYS 100 CO 0.00 0.28 -0.16 0.28 -2.06 0.00 0.00 179.45 177.79 1x8z h VAL 101 N 0.44 0.69 0.00 0.50 2.07 -0.79 -1.81 116.25 117.34 1x8z h VAL 101 Ca 0.50 -0.11 0.00 0.00 0.82 0.00 0.00 66.70 67.91 1x8z h VAL 101 Cb 0.87 0.75 0.00 0.00 -1.52 0.00 0.00 31.29 31.39 1x8z h VAL 101 CO -0.47 0.02 0.25 -0.24 0.02 0.00 0.00 177.57 177.15 1x8z n SER 102 N -5.25 0.06 -0.12 0.57 2.88 0.38 -1.14 113.62 110.99 1x8z n SER 102 Ca -0.10 0.32 -0.26 0.00 -1.33 0.00 0.00 58.87 57.50 1x8z n SER 102 Cb 0.21 -0.31 -0.11 0.00 -0.75 0.00 0.00 64.21 63.25 1x8z n SER 102 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1x8z n ALA 103 N -1.33 1.11 -0.07 -1.46 0.00 -0.73 -4.00 120.51 114.03 1x8z n ALA 103 Ca -0.00 -0.93 0.14 0.00 0.00 0.00 0.00 53.44 52.65 1x8z n ALA 103 Cb 0.25 -0.09 0.55 0.00 0.00 0.00 0.00 19.45 20.15 1x8z n ALA 103 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1x8z h ALA 104 N -0.73 2.14 0.69 0.00 0.00 -0.61 -1.36 119.26 119.38 1x8z h ALA 104 Ca -0.60 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.28 1x8z h ALA 104 Cb 1.59 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.32 1x8z h ALA 104 CO -0.32 -0.29 -0.50 1.25 0.00 0.00 0.00 179.25 179.39 1x8z h LEU 105 N 0.31 -1.30 0.00 0.00 6.46 -1.54 -0.19 115.31 119.05 1x8z h LEU 105 Ca 0.28 0.08 0.00 0.00 -0.12 0.00 0.00 57.88 58.13 1x8z h LEU 105 Cb 0.69 0.40 0.00 0.00 -0.73 0.00 0.00 40.66 41.02 1x8z h LEU 105 CO -0.07 -0.73 0.00 0.47 -0.62 0.00 0.00 178.44 177.50 1x8z n ASP 106 N -5.61 0.00 0.04 1.25 9.92 -0.69 -0.32 116.55 121.14 1x8z n ASP 106 Ca -0.14 -0.04 -0.03 0.00 -0.53 0.00 0.00 54.79 54.05 1x8z n ASP 106 Cb 0.49 -0.17 -0.02 0.00 -0.64 0.00 0.00 41.12 40.79 1x8z n ASP 106 CO 0.00 0.00 0.00 1.23 0.13 0.00 0.00 177.20 178.56 1x8z h GLY 107 N 1.58 -0.21 1.02 0.44 0.00 -0.00 -2.26 103.07 103.63 1x8z h GLY 107 Ca 0.00 0.08 -0.01 0.00 0.00 0.00 0.00 47.33 47.40 1x8z h GLY 107 CO 0.00 -0.08 0.48 0.00 0.00 0.00 0.00 176.54 176.95 1x8z h ALA 108 N -1.05 1.08 -0.55 3.60 0.00 -0.72 -1.03 119.26 120.59 1x8z h ALA 108 Ca -0.02 -0.11 0.09 0.00 0.00 0.00 0.00 54.91 54.87 1x8z h ALA 108 Cb 0.16 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.58 1x8z h ALA 108 CO 0.03 0.57 0.37 0.22 0.00 0.00 0.00 179.25 180.44 1x8z h ASP 109 N 1.17 0.33 0.33 0.00 -0.00 -0.77 -2.18 116.42 115.30 1x8z h ASP 109 Ca 0.30 0.01 -0.02 0.00 -0.00 0.00 0.00 57.03 57.32 1x8z h ASP 109 Cb -0.00 -0.06 0.00 0.00 -0.00 0.00 0.00 39.33 39.27 1x8z h ASP 109 CO -0.05 0.20 -0.16 0.74 -0.00 0.00 0.00 179.24 179.98 1x8z h THR 110 N 0.37 0.39 -0.95 2.25 2.02 -0.59 -3.17 112.91 113.24 1x8z h THR 110 Ca 0.25 -0.77 0.27 0.00 0.77 0.00 0.00 66.41 66.94 1x8z h THR 110 Cb 0.49 0.63 -0.04 0.00 -1.74 0.00 0.00 68.15 67.50 1x8z h THR 110 CO -0.06 0.09 1.16 0.00 0.37 0.00 0.00 175.52 177.08 1x8z h LEU 112 N 0.00 -0.38 -3.03 0.00 3.38 -1.46 -3.25 115.31 110.57 1x8z h LEU 112 Ca 0.45 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.32 1x8z h LEU 112 Cb 2.77 0.10 0.00 0.00 0.09 0.00 0.00 40.66 43.62 1x8z h LEU 112 CO -0.00 0.08 0.00 0.47 0.09 0.00 0.00 178.44 179.08 1x8z n ASP 113 N -5.08 4.54 0.00 -0.43 8.00 0.21 -1.32 116.55 122.47 1x8z n ASP 113 Ca -0.07 -2.20 0.00 0.00 0.71 0.00 0.00 54.79 53.23 1x8z n ASP 113 Cb 0.23 -0.95 0.00 0.00 -0.02 0.00 0.00 41.12 40.39 1x8z n ASP 113 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1x8z n ASP 114 N 1.48 0.14 -0.89 -2.24 9.92 -1.14 -4.60 116.55 119.22 1x8z n ASP 114 Ca 0.00 -0.97 0.03 0.00 -0.53 0.00 0.00 54.79 53.33 1x8z n ASP 114 Cb 0.44 0.01 0.04 0.00 -0.64 0.00 0.00 41.12 40.97 1x8z n ASP 114 CO 0.00 0.00 0.00 1.33 0.13 0.00 0.00 177.20 178.66 1x8z n VAL 115 N -0.01 0.41 -0.09 2.53 0.24 -0.43 -4.40 118.33 116.58 1x8z n VAL 115 Ca 0.00 -0.98 0.08 0.00 -2.04 0.00 0.00 64.34 61.40 1x8z n VAL 115 Cb 0.21 0.56 0.14 0.00 -1.47 0.00 0.00 33.84 33.28 1x8z n VAL 115 CO 0.00 0.00 0.00 2.29 -2.14 0.00 0.00 176.83 176.98 1x8z n LYS 116 N -0.04 -0.02 0.11 7.34 -0.00 -1.15 -4.03 118.16 120.36 1x8z n LYS 116 Ca 0.06 0.38 0.00 0.00 -0.00 0.00 0.00 58.31 58.75 1x8z n LYS 116 Cb 0.88 -0.66 0.00 0.00 -0.00 0.00 0.00 35.03 35.25 1x8z n LYS 116 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 1x8z n ARG 117 N -3.71 0.00 -0.71 -1.58 1.74 -1.26 -5.02 116.66 106.12 1x8z n ARG 117 Ca 0.09 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.17 1x8z n ARG 117 Cb 0.32 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.76 1x8z n ARG 117 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1x8z n LEU 118 N -3.07 0.00 0.00 0.55 4.77 -1.26 -4.05 117.00 113.94 1x8z n LEU 118 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1x8z n LEU 118 Cb 0.00 -0.42 0.00 0.00 -2.33 0.00 0.00 43.42 40.67 1x8z n LEU 118 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.39 176.60 1x8z n ARG 119 N -0.71 0.00 -3.84 3.23 3.00 -1.26 -4.33 116.66 112.75 1x8z n ARG 119 Ca 0.00 0.00 -0.33 0.00 -0.01 0.00 0.00 57.85 57.51 1x8z n ARG 119 Cb 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 32.46 32.34 1x8z n ARG 119 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.63 176.09 1x8z s SER 120 N -2.61 4.80 -0.15 0.55 1.04 -1.26 -5.07 113.70 111.01 1x8z s SER 120 Ca 0.00 -2.88 -0.24 0.00 0.48 0.00 0.00 55.95 53.32 1x8z s SER 120 Cb 0.00 -1.75 -0.02 0.00 0.10 0.00 0.00 66.02 64.35 1x8z s SER 120 CO 0.00 -0.31 0.75 0.68 0.98 0.00 0.00 173.24 175.34 1x8z s VAL 121 N -0.09 4.96 -0.71 5.02 -7.23 -1.26 -4.94 120.40 116.15 1x8z s VAL 121 Ca 0.16 1.48 -0.31 0.00 -1.81 0.00 0.00 61.98 61.50 1x8z s VAL 121 Cb -0.23 -4.07 -0.16 0.00 0.56 0.00 0.00 36.38 32.49 1x8z s VAL 121 CO -0.02 0.11 2.49 -0.67 -0.31 0.00 0.00 175.10 176.70 1x8z n ASP 122 N 4.77 1.21 -0.27 4.85 -0.08 -1.26 -4.78 116.55 120.98 1x8z n ASP 122 Ca 0.01 0.06 0.16 0.00 -1.51 0.00 0.00 54.79 53.51 1x8z n ASP 122 Cb 0.50 -1.16 0.30 0.00 2.34 0.00 0.00 41.12 43.09 1x8z n ASP 122 CO 0.00 0.00 0.00 -0.24 0.12 0.00 0.00 177.20 177.08 1x8z n SER 123 N 11.71 0.01 0.14 1.67 2.88 -1.26 -1.00 113.62 127.76 1x8z n SER 123 Ca 0.53 1.36 -0.16 0.00 -1.33 0.00 0.00 58.87 59.27 1x8z n SER 123 Cb 0.20 -0.54 -0.09 0.00 -0.75 0.00 0.00 64.21 63.03 1x8z n SER 123 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1x8z h SER 124 N 0.00 -1.48 -0.61 -3.46 0.02 -2.00 -1.90 113.55 104.13 1x8z h SER 124 Ca 0.54 0.15 0.12 0.00 -0.84 0.00 0.00 61.79 61.77 1x8z h SER 124 Cb 1.23 0.54 -0.10 0.00 0.14 0.00 0.00 62.40 64.21 1x8z h SER 124 CO -0.72 -0.56 0.06 0.58 -1.14 0.00 0.00 176.83 175.05 1x8z h VAL 125 N -0.76 0.55 0.29 2.27 2.07 -1.44 0.29 116.25 119.51 1x8z h VAL 125 Ca -0.00 -0.06 -0.01 0.00 0.82 0.00 0.00 66.70 67.45 1x8z h VAL 125 Cb 0.76 0.36 -0.01 0.00 -1.52 0.00 0.00 31.29 30.88 1x8z h VAL 125 CO -0.25 0.03 -0.19 0.58 0.02 0.00 0.00 177.57 177.76 1x8z h VAL 126 N 0.18 0.60 -0.58 2.57 2.07 -1.40 -1.62 116.25 118.06 1x8z h VAL 126 Ca 0.32 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.81 1x8z h VAL 126 Cb 0.51 0.60 -0.03 0.00 -1.52 0.00 0.00 31.29 30.86 1x8z h VAL 126 CO -0.48 0.00 0.24 0.78 0.02 0.00 0.00 177.57 178.14 1x8z h ASN 127 N -0.47 0.79 -0.73 0.57 2.35 -0.75 0.39 115.58 117.73 1x8z h ASN 127 Ca -0.03 -0.16 0.03 0.00 -0.55 0.00 0.00 56.30 55.60 1x8z h ASN 127 Cb 0.40 -0.20 -0.05 0.00 0.05 0.00 0.00 38.32 38.52 1x8z h ASN 127 CO 0.02 0.73 0.46 0.78 -1.65 0.00 0.00 177.43 177.77 1x8z h ASN 128 N 0.79 0.75 -0.31 5.81 4.21 -0.38 0.64 115.58 127.09 1x8z h ASN 128 Ca 0.19 0.00 -0.07 0.00 1.21 0.00 0.00 56.30 57.63 1x8z h ASN 128 Cb 0.18 -0.16 -0.01 0.00 -1.12 0.00 0.00 38.32 37.21 1x8z h ASN 128 CO -0.02 0.51 -0.09 0.28 -1.29 0.00 0.00 177.43 176.83 1x8z h SER 129 N 0.89 0.62 -0.74 5.81 0.02 -1.09 0.64 113.55 119.71 1x8z h SER 129 Ca 0.29 -0.37 -0.00 0.00 -0.84 0.00 0.00 61.79 60.87 1x8z h SER 129 Cb 0.03 -0.17 -0.04 0.00 0.14 0.00 0.00 62.40 62.36 1x8z h SER 129 CO -0.11 0.85 0.45 0.11 -1.14 0.00 0.00 176.83 176.98 1x8z h LYS 130 N 0.38 1.00 0.05 3.45 1.57 -0.28 0.56 116.57 123.31 1x8z h LYS 130 Ca 0.08 -0.09 -0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1x8z h LYS 130 Cb 0.59 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 32.68 1x8z h LYS 130 CO 0.03 0.70 -0.03 1.15 -0.57 0.00 0.00 179.45 180.74 1x8z h THR 131 N 1.02 1.24 -0.93 -0.16 2.02 0.64 -2.04 112.91 114.71 1x8z h THR 131 Ca 0.27 -1.07 0.13 0.00 0.77 0.00 0.00 66.41 66.51 1x8z h THR 131 Cb -0.05 1.94 -0.09 0.00 -1.74 0.00 0.00 68.15 68.21 1x8z h THR 131 CO -0.05 0.26 0.55 0.40 0.37 0.00 0.00 175.52 177.05 1x8z h ILE 132 N -0.56 0.83 -0.95 3.11 2.04 0.99 0.34 117.51 123.32 1x8z h ILE 132 Ca -0.01 -0.28 -0.01 0.00 1.00 0.00 0.00 64.86 65.57 1x8z h ILE 132 Cb 0.49 -0.06 -0.05 0.00 -0.74 0.00 0.00 36.82 36.46 1x8z h ILE 132 CO 0.01 0.15 0.57 0.11 0.00 0.00 0.00 178.15 178.99 1x8z h LYS 133 N 0.82 1.29 0.09 2.37 1.57 0.16 -1.33 116.57 121.55 1x8z h LYS 133 Ca 0.48 -0.12 -0.00 0.00 -1.87 0.00 0.00 60.65 59.14 1x8z h LYS 133 Cb 0.57 -0.27 0.00 0.00 0.08 0.00 0.00 32.23 32.61 1x8z h LYS 133 CO -0.31 0.91 -0.04 -0.91 -0.57 0.00 0.00 179.45 178.53 1x8z h ASN 134 N 1.31 -0.10 0.06 0.86 -0.26 0.25 -2.67 115.58 115.04 1x8z h ASN 134 Ca 0.34 -0.15 0.02 0.00 -0.56 0.00 0.00 56.30 55.95 1x8z h ASN 134 Cb -0.05 0.03 -0.03 0.00 -1.06 0.00 0.00 38.32 37.21 1x8z h ASN 134 CO -0.06 0.09 -0.16 -0.07 -1.06 0.00 0.00 177.43 176.17 1x8z h LEU 135 N -0.30 -0.45 -1.50 1.61 3.38 -0.30 -1.72 115.31 116.04 1x8z h LEU 135 Ca -0.01 0.06 0.23 0.00 0.09 0.00 0.00 57.88 58.25 1x8z h LEU 135 Cb 0.25 0.18 -0.07 0.00 0.09 0.00 0.00 40.66 41.10 1x8z h LEU 135 CO 0.02 -0.23 0.64 0.00 0.09 0.00 0.00 178.44 178.96 1x8z h GLY 137 N 0.37 1.13 0.88 0.00 0.00 -0.95 -0.22 103.07 104.29 1x8z h GLY 137 Ca 0.51 -0.41 -0.00 0.00 0.00 0.00 0.00 47.33 47.43 1x8z h GLY 137 CO -0.20 0.40 0.00 -2.22 0.00 0.00 0.00 176.54 174.52 1x8z h ILE 138 N 1.07 1.10 -0.75 2.60 2.04 -0.49 -2.71 117.51 120.36 1x8z h ILE 138 Ca 0.30 -0.28 0.16 0.00 1.00 0.00 0.00 64.86 66.03 1x8z h ILE 138 Cb -0.10 1.28 -0.10 0.00 -0.74 0.00 0.00 36.82 37.15 1x8z h ILE 138 CO -0.07 0.07 0.25 0.00 0.00 0.00 0.00 178.15 178.40 1x8z h ALA 139 N 0.88 1.03 0.40 1.87 0.00 -0.89 -1.92 119.26 120.63 1x8z h ALA 139 Ca 0.00 0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 1x8z h ALA 139 Cb 0.12 0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1x8z h ALA 139 CO -0.00 -0.28 -0.31 -0.07 0.00 0.00 0.00 179.25 178.59 1x8z h LEU 140 N 0.36 -0.81 -0.67 0.00 3.38 -0.80 -0.00 115.31 116.76 1x8z h LEU 140 Ca 0.42 0.06 0.14 0.00 0.09 0.00 0.00 57.88 58.60 1x8z h LEU 140 Cb 0.70 0.26 -0.12 0.00 0.09 0.00 0.00 40.66 41.59 1x8z h LEU 140 CO -0.46 -0.46 -0.03 0.58 0.09 0.00 0.00 178.44 178.15 1x8z h VAL 141 N -0.71 0.41 -0.23 1.22 2.07 -1.07 -1.98 116.25 115.96 1x8z h VAL 141 Ca -0.04 -0.03 -0.04 0.00 0.82 0.00 0.00 66.70 67.42 1x8z h VAL 141 Cb 0.61 0.32 -0.01 0.00 -1.52 0.00 0.00 31.29 30.69 1x8z h VAL 141 CO -0.01 0.02 -0.01 0.40 0.02 0.00 0.00 177.57 177.99 1x8z h ILE 142 N 0.09 1.26 -0.76 4.57 2.04 -1.01 -2.78 117.51 120.91 1x8z h ILE 142 Ca 0.35 -0.93 0.15 0.00 1.00 0.00 0.00 64.86 65.44 1x8z h ILE 142 Cb 0.58 1.41 -0.05 0.00 -0.74 0.00 0.00 36.82 38.01 1x8z h ILE 142 CO -0.60 0.29 0.51 0.77 0.00 0.00 0.00 178.15 179.11 1x8z h SER 143 N 0.18 0.38 0.87 1.72 4.64 -0.28 0.69 113.55 121.76 1x8z h SER 143 Ca 0.07 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 1x8z h SER 143 Cb 0.43 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.47 1x8z h SER 143 CO 0.01 0.20 0.00 0.59 -0.87 0.00 0.00 176.83 176.76 1x8z n ASN 144 N -4.48 0.00 -0.00 4.97 5.03 -0.90 -2.87 115.26 117.01 1x8z n ASN 144 Ca 0.15 0.40 0.09 0.00 0.87 0.00 0.00 54.58 56.09 1x8z n ASN 144 Cb 0.54 -0.47 -0.11 0.00 -1.02 0.00 0.00 39.78 38.73 1x8z n ASN 144 CO 0.00 0.00 0.00 0.23 -1.83 0.00 0.00 177.26 175.66 1x8z n MET 145 N -1.47 0.64 -1.97 3.52 2.81 0.23 -4.96 117.12 115.92 1x8z n MET 145 Ca 0.08 -0.01 -0.41 0.00 -1.81 0.00 0.00 57.70 55.54 1x8z n MET 145 Cb 0.30 -1.41 -0.01 0.00 -0.71 0.00 0.00 33.22 31.39 1x8z n MET 145 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 1x8z s LEU 146 N -3.01 4.38 -0.16 4.03 1.43 -0.46 -4.88 118.68 120.01 1x8z s LEU 146 Ca 0.06 2.83 -0.38 0.00 -1.03 0.00 0.00 54.13 55.62 1x8z s LEU 146 Cb 0.14 -3.65 -0.15 0.00 0.03 0.00 0.00 46.19 42.56 1x8z s LEU 146 CO 0.79 -0.70 1.71 -2.65 0.23 0.00 0.00 176.35 175.73 1x8z n PRO 147 N 0.95 1.46 0.00 1.29 -0.02 -1.26 -4.84 135.00 132.58 1x8z n PRO 147 Ca 0.02 0.53 0.15 0.00 -2.02 0.00 0.00 63.50 62.18 1x8z n PRO 147 Cb 0.40 -2.26 0.78 0.00 -0.02 0.00 0.00 33.50 32.41 1x8z n PRO 147 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35