#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x8z n ASP 0 N 0.00 3.48 0.19 6.12 8.00 -1.26 -4.81 116.55 128.27 1x8z n ASP 0 Ca 0.00 0.87 0.17 0.00 0.71 0.00 0.00 54.79 56.53 1x8z n ASP 0 Cb 0.00 -1.40 0.80 0.00 -0.02 0.00 0.00 41.12 40.50 1x8z n ASP 0 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 1x8z h SER 1 N 10.11 0.00 0.21 -2.24 0.02 -2.01 -0.53 113.55 119.11 1x8z h SER 1 Ca -0.47 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.47 1x8z h SER 1 Cb 1.27 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.81 1x8z h SER 1 CO 0.95 0.00 -0.10 0.77 -1.14 0.00 0.00 176.83 177.31 1x8z h SER 2 N 0.00 -0.24 -0.89 3.07 4.64 -1.99 -2.52 113.55 115.62 1x8z h SER 2 Ca 0.09 0.01 0.11 0.00 -0.47 0.00 0.00 61.79 61.54 1x8z h SER 2 Cb 0.49 0.06 -0.08 0.00 -0.31 0.00 0.00 62.40 62.56 1x8z h SER 2 CO -0.00 -0.12 0.52 -0.08 -0.87 0.00 0.00 176.83 176.28 1x8z h GLU 3 N -0.37 0.81 -0.71 4.77 4.81 -1.88 0.28 114.58 122.29 1x8z h GLU 3 Ca -0.03 -0.05 0.07 0.00 -0.13 0.00 0.00 59.36 59.22 1x8z h GLU 3 Cb 0.21 -0.18 -0.06 0.00 0.63 0.00 0.00 28.75 29.35 1x8z h GLU 3 CO 0.05 0.54 0.39 1.98 -0.73 0.00 0.00 179.01 181.24 1x8z h MET 4 N 0.84 0.69 0.01 1.92 4.05 -1.17 0.16 114.93 121.43 1x8z h MET 4 Ca 0.45 -0.04 -0.20 0.00 -0.28 0.00 0.00 59.70 59.62 1x8z h MET 4 Cb 0.46 -0.16 -0.01 0.00 -0.80 0.00 0.00 31.60 31.09 1x8z h MET 4 CO -0.27 0.46 -0.91 0.77 0.23 0.00 0.00 176.91 177.18 1x8z h SER 5 N 0.71 0.25 0.19 1.39 0.02 -0.77 -1.73 113.55 113.61 1x8z h SER 5 Ca 0.32 -0.21 -0.02 0.00 -0.84 0.00 0.00 61.79 61.04 1x8z h SER 5 Cb 0.23 -0.08 -0.00 0.00 0.14 0.00 0.00 62.40 62.69 1x8z h SER 5 CO -0.20 1.03 -0.09 0.74 -1.14 0.00 0.00 176.83 177.17 1x8z h THR 6 N 0.10 0.71 0.00 -2.27 2.02 0.96 -0.95 112.91 113.47 1x8z h THR 6 Ca -0.05 -0.36 -0.17 0.00 0.77 0.00 0.00 66.41 66.60 1x8z h THR 6 Cb 1.55 1.22 -0.03 0.00 -1.74 0.00 0.00 68.15 69.15 1x8z h THR 6 CO 0.14 0.09 -1.09 -0.38 0.37 0.00 0.00 175.52 174.65 1x8z n ILE 7 N -3.91 1.50 0.22 3.11 5.41 0.42 -4.36 119.36 121.74 1x8z n ILE 7 Ca -0.02 0.03 0.05 0.00 1.00 0.00 0.00 62.75 63.81 1x8z n ILE 7 Cb 0.18 -2.14 0.48 0.00 -0.71 0.00 0.00 39.64 37.46 1x8z n ILE 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1x8z n ASP 9 N -4.29 0.92 0.00 0.00 10.43 -0.37 -1.64 116.55 121.60 1x8z n ASP 9 Ca -0.02 -1.23 0.00 0.00 2.57 0.00 0.00 54.79 56.11 1x8z n ASP 9 Cb 0.27 -0.31 0.00 0.00 1.84 0.00 0.00 41.12 42.92 1x8z n ASP 9 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 1x8z n LYS 10 N 0.32 -0.17 -3.98 -1.24 5.02 -0.97 -5.05 118.16 112.09 1x8z n LYS 10 Ca 0.00 -0.09 -0.26 0.00 -2.02 0.00 0.00 58.31 55.94 1x8z n LYS 10 Cb 0.19 -0.59 -0.04 0.00 -0.02 0.00 0.00 35.03 34.58 1x8z n LYS 10 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1x8z s THR 11 N -0.00 5.13 -1.31 -0.18 -4.23 -0.65 -4.97 115.64 109.43 1x8z s THR 11 Ca 0.00 -0.77 0.00 0.00 -1.18 0.00 0.00 61.69 59.74 1x8z s THR 11 Cb 0.00 -3.63 0.00 0.00 1.34 0.00 0.00 72.50 70.21 1x8z s THR 11 CO 0.00 -0.09 0.33 0.18 -0.54 0.00 0.00 174.62 174.50 1x8z n LEU 12 N -0.47 0.35 -2.69 4.79 4.77 -1.26 -3.79 117.00 118.69 1x8z n LEU 12 Ca -0.07 -0.17 -0.06 0.00 -0.03 0.00 0.00 56.01 55.68 1x8z n LEU 12 Cb 0.54 -0.17 0.08 0.00 -2.33 0.00 0.00 43.42 41.53 1x8z n LEU 12 CO 0.47 0.09 0.50 -3.20 -1.33 0.00 0.00 177.39 173.93 1x8z n ASN 13 N 0.02 -1.75 -0.30 -1.43 4.05 -1.26 -5.05 115.26 109.54 1x8z n ASN 13 Ca 0.00 -2.30 0.12 0.00 0.45 0.00 0.00 54.58 52.85 1x8z n ASN 13 Cb 0.09 1.14 0.26 0.00 1.23 0.00 0.00 39.78 42.50 1x8z n ASN 13 CO 0.00 0.00 0.00 -0.65 -3.05 0.00 0.00 177.26 173.56 1x8z h PRO 14 N 3.19 0.10 0.05 1.20 0.11 -1.70 -1.75 132.00 133.20 1x8z h PRO 14 Ca -0.22 -0.01 0.03 0.00 0.11 0.00 0.00 66.00 65.91 1x8z h PRO 14 Cb 1.16 -0.02 -0.05 0.00 0.11 0.00 0.00 31.00 32.19 1x8z h PRO 14 CO -0.01 0.07 -0.39 0.66 -0.21 0.00 0.00 178.00 178.11 1x8z h SER 15 N 0.11 -1.17 0.17 -2.05 4.64 -1.95 0.30 113.55 113.59 1x8z h SER 15 Ca 0.54 0.14 0.01 0.00 -0.47 0.00 0.00 61.79 62.01 1x8z h SER 15 Cb 1.07 0.45 -0.03 0.00 -0.31 0.00 0.00 62.40 63.59 1x8z h SER 15 CO -0.75 -0.45 -0.30 0.15 -0.87 0.00 0.00 176.83 174.61 1x8z h PHE 16 N -0.58 -0.81 -0.59 4.77 3.57 -1.76 0.05 116.94 121.58 1x8z h PHE 16 Ca 0.04 0.01 0.10 0.00 3.53 0.00 0.00 57.97 61.65 1x8z h PHE 16 Cb 0.64 0.34 -0.08 0.00 2.79 0.00 0.00 35.95 39.64 1x8z h PHE 16 CO -0.38 -0.41 0.18 0.00 -2.23 0.00 0.00 178.31 175.47 1x8z h LEU 18 N 0.34 0.94 -0.78 0.00 3.38 -0.07 -0.81 115.31 118.30 1x8z h LEU 18 Ca 0.30 -0.25 -0.09 0.00 0.09 0.00 0.00 57.88 57.94 1x8z h LEU 18 Cb 0.41 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 1x8z h LEU 18 CO -0.34 0.95 -0.06 0.50 0.09 0.00 0.00 178.44 179.58 1x8z h LYS 19 N 0.90 0.86 0.34 1.13 3.64 -0.32 -1.60 116.57 121.51 1x8z h LYS 19 Ca 0.19 -0.27 -0.02 0.00 -1.27 0.00 0.00 60.65 59.28 1x8z h LYS 19 Cb 0.39 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.14 1x8z h LYS 19 CO 0.01 0.90 -0.16 0.35 -2.27 0.00 0.00 179.45 178.27 1x8z h PHE 20 N 0.78 -0.42 -0.72 1.91 3.57 -0.52 -1.88 116.94 119.66 1x8z h PHE 20 Ca 0.14 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.60 1x8z h PHE 20 Cb 0.56 0.14 -0.03 0.00 2.79 0.00 0.00 35.95 39.40 1x8z h PHE 20 CO 0.03 -0.10 0.33 -0.07 -2.23 0.00 0.00 178.31 176.27 1x8z h LEU 21 N -0.75 0.94 -0.80 0.59 4.07 -1.16 0.40 115.31 118.60 1x8z h LEU 21 Ca -0.05 -0.11 -0.08 0.00 0.08 0.00 0.00 57.88 57.73 1x8z h LEU 21 Cb 0.50 -0.24 -0.02 0.00 1.08 0.00 0.00 40.66 41.98 1x8z h LEU 21 CO 0.08 0.80 0.07 0.78 -1.08 0.00 0.00 178.44 179.08 1x8z h ASN 22 N 1.02 0.93 -0.25 -0.43 -0.26 -1.32 0.28 115.58 115.55 1x8z h ASN 22 Ca 0.25 -0.22 -0.07 0.00 -0.56 0.00 0.00 56.30 55.69 1x8z h ASN 22 Cb 0.12 -0.25 -0.01 0.00 -1.06 0.00 0.00 38.32 37.13 1x8z h ASN 22 CO -0.03 0.95 -0.14 0.74 -1.06 0.00 0.00 177.43 177.89 1x8z h THR 23 N 0.91 1.30 -0.22 2.81 2.02 -0.87 -3.11 112.91 115.75 1x8z h THR 23 Ca 0.18 -1.23 -0.15 0.00 0.77 0.00 0.00 66.41 65.98 1x8z h THR 23 Cb 0.44 1.58 -0.01 0.00 -1.74 0.00 0.00 68.15 68.42 1x8z h THR 23 CO 0.01 0.38 -0.47 0.11 0.37 0.00 0.00 175.52 175.93 1x8z h LYS 24 N 0.25 0.58 -2.17 6.66 1.79 -0.65 -3.36 116.57 119.66 1x8z h LYS 24 Ca 0.05 -0.33 -0.58 0.00 -2.18 0.00 0.00 60.65 57.61 1x8z h LYS 24 Cb 0.65 0.02 -0.41 0.00 -1.58 0.00 0.00 32.23 30.92 1x8z h LYS 24 CO 0.04 0.93 -0.81 1.19 -1.08 0.00 0.00 179.45 179.72 1x8z n PHE 25 N -4.00 1.84 -3.40 -1.35 3.72 0.95 -5.08 117.46 110.15 1x8z n PHE 25 Ca -0.02 -3.89 -0.30 0.00 -0.05 0.00 0.00 57.45 53.19 1x8z n PHE 25 Cb 0.56 -0.44 -0.04 0.00 -0.94 0.00 0.00 39.48 38.62 1x8z n PHE 25 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1x8z s ALA 26 N -1.81 3.63 0.20 4.37 0.00 -1.18 -2.63 121.76 124.34 1x8z s ALA 26 Ca 0.37 -0.49 -0.32 0.00 0.00 0.00 0.00 51.96 51.52 1x8z s ALA 26 Cb 0.14 -2.31 -0.11 0.00 0.00 0.00 0.00 23.12 20.84 1x8z s ALA 26 CO -0.07 0.36 1.63 0.45 0.00 0.00 0.00 175.76 178.13 1x8z s SER 27 N -2.89 6.48 0.55 0.00 0.15 -1.26 -4.79 113.70 111.94 1x8z s SER 27 Ca 0.44 2.76 -0.21 0.00 0.70 0.00 0.00 55.95 59.65 1x8z s SER 27 Cb -0.11 -2.60 -0.06 0.00 -1.71 0.00 0.00 66.02 61.54 1x8z s SER 27 CO 0.27 -0.89 1.11 -0.81 1.20 0.00 0.00 173.24 174.12 1x8z n PRO 28 N 3.75 1.24 -3.13 5.44 -0.04 -1.26 -5.04 135.00 135.96 1x8z n PRO 28 Ca 0.14 0.46 -0.20 0.00 -0.04 0.00 0.00 63.50 63.87 1x8z n PRO 28 Cb 0.37 -2.29 0.01 0.00 -0.04 0.00 0.00 33.50 31.55 1x8z n PRO 28 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1x8z s ASN 29 N -1.05 5.76 0.19 3.54 2.20 -1.26 -4.94 114.94 119.38 1x8z s ASN 29 Ca 0.72 -0.11 -0.12 0.00 -0.94 0.00 0.00 52.86 52.41 1x8z s ASN 29 Cb -0.44 -1.11 0.20 0.00 -2.00 0.00 0.00 41.25 37.90 1x8z s ASN 29 CO 0.49 -0.67 1.73 -0.07 -2.94 0.00 0.00 177.10 175.63 1x8z h LEU 30 N 0.60 0.06 0.14 3.54 3.38 -1.98 -1.50 115.31 119.55 1x8z h LEU 30 Ca -0.44 0.08 0.02 0.00 0.09 0.00 0.00 57.88 57.63 1x8z h LEU 30 Cb 1.27 0.10 -0.04 0.00 0.09 0.00 0.00 40.66 42.08 1x8z h LEU 30 CO 0.52 0.06 -0.34 1.56 0.09 0.00 0.00 178.44 180.33 1x8z h GLN 31 N 0.28 -0.56 -0.96 1.13 1.08 -1.97 -0.78 115.11 113.32 1x8z h GLN 31 Ca 0.26 0.04 0.17 0.00 -1.45 0.00 0.00 58.65 57.66 1x8z h GLN 31 Cb 0.33 0.13 -0.10 0.00 -0.05 0.00 0.00 27.48 27.79 1x8z h GLN 31 CO -0.31 -0.38 0.57 0.00 -0.95 0.00 0.00 178.83 177.76 1x8z h ALA 32 N 0.01 1.53 -0.51 3.87 0.00 -1.86 0.55 119.26 122.86 1x8z h ALA 32 Ca 0.02 0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.91 1x8z h ALA 32 Cb 0.61 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 1x8z h ALA 32 CO -0.19 -0.01 -0.06 -0.07 0.00 0.00 0.00 179.25 178.92 1x8z h LEU 33 N 0.77 0.93 -0.23 0.00 3.38 -0.62 -1.58 115.31 117.95 1x8z h LEU 33 Ca 0.53 -0.33 -0.06 0.00 0.09 0.00 0.00 57.88 58.11 1x8z h LEU 33 Cb 0.76 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 1x8z h LEU 33 CO -0.36 1.04 -0.09 0.00 0.09 0.00 0.00 178.44 179.12 1x8z h ALA 34 N 0.92 0.32 -0.86 1.53 0.00 0.31 -2.22 119.26 119.26 1x8z h ALA 34 Ca 0.14 -0.29 0.04 0.00 0.00 0.00 0.00 54.91 54.80 1x8z h ALA 34 Cb 0.60 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.26 1x8z h ALA 34 CO 0.04 0.15 0.55 -0.22 0.00 0.00 0.00 179.25 179.77 1x8z h LYS 35 N 0.19 1.03 0.39 0.00 3.11 0.13 -0.25 116.57 121.17 1x8z h LYS 35 Ca 0.05 -0.06 -0.02 0.00 -2.81 0.00 0.00 60.65 57.81 1x8z h LYS 35 Cb 0.58 -0.23 0.00 0.00 -1.00 0.00 0.00 32.23 31.58 1x8z h LYS 35 CO 0.03 0.68 -0.19 1.15 -2.81 0.00 0.00 179.45 178.31 1x8z h THR 36 N 1.06 0.59 -0.77 1.00 2.02 -1.25 -2.15 112.91 113.40 1x8z h THR 36 Ca 0.35 -0.39 0.16 0.00 0.77 0.00 0.00 66.41 67.30 1x8z h THR 36 Cb 0.03 0.77 -0.11 0.00 -1.74 0.00 0.00 68.15 67.11 1x8z h THR 36 CO -0.13 0.07 0.27 0.74 0.37 0.00 0.00 175.52 176.84 1x8z h THR 37 N -0.76 0.57 -0.46 3.16 2.02 -0.97 0.92 112.91 117.38 1x8z h THR 37 Ca -0.05 -0.13 -0.08 0.00 0.77 0.00 0.00 66.41 66.92 1x8z h THR 37 Cb 0.52 0.17 -0.02 0.00 -1.74 0.00 0.00 68.15 67.08 1x8z h THR 37 CO 0.09 0.07 -0.05 -0.07 0.37 0.00 0.00 175.52 175.93 1x8z h LEU 38 N 0.37 0.77 -0.06 2.58 3.38 -1.02 -1.71 115.31 119.62 1x8z h LEU 38 Ca 0.44 -0.21 0.01 0.00 0.09 0.00 0.00 57.88 58.22 1x8z h LEU 38 Cb 0.73 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 1x8z h LEU 38 CO -0.47 0.87 -0.02 0.44 0.09 0.00 0.00 178.44 179.35 1x8z h ASP 39 N 0.73 -0.07 -0.54 -0.43 5.19 -0.17 0.18 116.42 121.30 1x8z h ASP 39 Ca 0.14 0.02 0.05 0.00 -0.62 0.00 0.00 57.03 56.62 1x8z h ASP 39 Cb 0.51 0.04 -0.05 0.00 0.18 0.00 0.00 39.33 40.02 1x8z h ASP 39 CO 0.03 -0.03 0.28 0.28 -3.12 0.00 0.00 179.24 176.67 1x8z h SER 40 N -0.01 0.39 -0.39 6.45 0.02 -1.00 -0.26 113.55 118.75 1x8z h SER 40 Ca 0.03 0.03 -0.06 0.00 -0.84 0.00 0.00 61.79 60.96 1x8z h SER 40 Cb 0.06 -0.04 -0.01 0.00 0.14 0.00 0.00 62.40 62.54 1x8z h SER 40 CO -0.07 0.27 0.03 0.74 -1.14 0.00 0.00 176.83 176.66 1x8z h THR 41 N 0.53 1.25 -0.68 -2.27 2.02 -0.95 -0.91 112.91 111.90 1x8z h THR 41 Ca 0.24 -0.94 -0.02 0.00 0.77 0.00 0.00 66.41 66.46 1x8z h THR 41 Cb 0.15 1.09 -0.03 0.00 -1.74 0.00 0.00 68.15 67.63 1x8z h THR 41 CO -0.17 0.32 0.35 1.56 0.37 0.00 0.00 175.52 177.95 1x8z h GLN 42 N 0.51 0.95 0.69 6.66 4.20 -0.21 -0.28 115.11 127.64 1x8z h GLN 42 Ca 0.12 -0.12 -0.03 0.00 0.06 0.00 0.00 58.65 58.67 1x8z h GLN 42 Cb 0.43 -0.18 -0.00 0.00 0.30 0.00 0.00 27.48 28.02 1x8z h GLN 42 CO 0.01 0.73 -0.43 0.00 -0.67 0.00 0.00 178.83 178.48 1x8z h ALA 43 N 1.17 -1.09 -0.67 3.87 0.00 -0.91 -1.12 119.26 120.50 1x8z h ALA 43 Ca 0.24 -0.22 0.14 0.00 0.00 0.00 0.00 54.91 55.07 1x8z h ALA 43 Cb 0.07 0.53 -0.10 0.00 0.00 0.00 0.00 17.79 18.29 1x8z h ALA 43 CO -0.03 -1.13 0.13 -0.09 0.00 0.00 0.00 179.25 178.12 1x8z h ARG 44 N -1.06 0.23 0.01 0.00 9.65 -0.92 -1.31 114.38 120.98 1x8z h ARG 44 Ca -0.09 -0.01 -0.00 0.00 -1.10 0.00 0.00 59.98 58.78 1x8z h ARG 44 Cb 0.85 -0.05 0.00 0.00 -1.39 0.00 0.00 29.97 29.38 1x8z h ARG 44 CO 0.09 0.15 -0.00 0.00 2.80 0.00 0.00 179.97 183.01 1x8z h ALA 45 N 1.56 -0.01 -0.75 2.80 0.00 -0.87 -1.56 119.26 120.43 1x8z h ALA 45 Ca 0.36 -0.03 0.11 0.00 0.00 0.00 0.00 54.91 55.35 1x8z h ALA 45 Cb 0.59 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 18.30 1x8z h ALA 45 CO -0.48 -0.48 0.38 1.15 0.00 0.00 0.00 179.25 179.83 1x8z h THR 46 N -0.08 0.82 -0.17 0.00 2.02 -0.57 0.23 112.91 115.16 1x8z h THR 46 Ca -0.00 -0.21 0.00 0.00 0.77 0.00 0.00 66.41 66.97 1x8z h THR 46 Cb 0.07 0.15 -0.01 0.00 -1.74 0.00 0.00 68.15 66.62 1x8z h THR 46 CO 0.00 0.11 0.11 1.56 0.37 0.00 0.00 175.52 177.68 1x8z h GLN 47 N 0.62 0.23 -0.93 6.66 4.20 -0.98 -1.50 115.11 123.41 1x8z h GLN 47 Ca 0.38 -0.02 0.03 0.00 0.06 0.00 0.00 58.65 59.10 1x8z h GLN 47 Cb 0.44 -0.05 -0.05 0.00 0.30 0.00 0.00 27.48 28.11 1x8z h GLN 47 CO -0.29 0.17 0.61 1.15 -0.67 0.00 0.00 178.83 179.80 1x8z h THR 48 N 0.22 1.18 -0.58 -0.54 2.02 -0.25 -0.95 112.91 114.00 1x8z h THR 48 Ca 0.06 -0.41 -0.09 0.00 0.77 0.00 0.00 66.41 66.74 1x8z h THR 48 Cb -0.00 -0.12 -0.02 0.00 -1.74 0.00 0.00 68.15 66.26 1x8z h THR 48 CO -0.01 0.22 -0.01 0.25 0.37 0.00 0.00 175.52 176.34 1x8z h LEU 49 N 1.20 1.01 -1.11 2.58 5.85 -0.70 0.10 115.31 124.24 1x8z h LEU 49 Ca 0.36 -0.31 -0.06 0.00 0.84 0.00 0.00 57.88 58.72 1x8z h LEU 49 Cb -0.04 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 40.70 1x8z h LEU 49 CO -0.11 1.07 0.01 0.11 -0.34 0.00 0.00 178.44 179.18 1x8z h LYS 50 N 0.92 0.63 0.04 1.25 1.57 -0.68 -2.23 116.57 118.08 1x8z h LYS 50 Ca 0.16 -0.15 -0.22 0.00 -1.87 0.00 0.00 60.65 58.57 1x8z h LYS 50 Cb 0.56 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.77 1x8z h LYS 50 CO 0.03 0.65 -1.03 -0.22 -0.57 0.00 0.00 179.45 178.30 1x8z h LYS 51 N 0.60 0.13 -0.20 3.15 3.64 -0.81 -2.45 116.57 120.63 1x8z h LYS 51 Ca 0.13 -0.20 -0.02 0.00 -1.27 0.00 0.00 60.65 59.29 1x8z h LYS 51 Cb 0.37 0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.25 1x8z h LYS 51 CO 0.01 1.05 0.03 -0.07 -2.27 0.00 0.00 179.45 178.20 1x8z h LEU 52 N 0.05 0.31 -0.83 5.20 3.38 -0.61 -1.44 115.31 121.38 1x8z h LEU 52 Ca -0.06 -0.26 0.09 0.00 0.09 0.00 0.00 57.88 57.74 1x8z h LEU 52 Cb 1.75 -0.08 -0.07 0.00 0.09 0.00 0.00 40.66 42.35 1x8z h LEU 52 CO 0.15 0.49 0.48 1.56 0.09 0.00 0.00 178.44 181.21 1x8z h GLN 53 N 0.12 0.80 0.77 1.13 1.08 -1.44 -2.37 115.11 115.21 1x8z h GLN 53 Ca 0.06 -0.05 -0.03 0.00 -1.45 0.00 0.00 58.65 57.18 1x8z h GLN 53 Cb 0.31 -0.18 0.00 0.00 -0.05 0.00 0.00 27.48 27.56 1x8z h GLN 53 CO 0.00 0.53 -0.43 1.03 -0.95 0.00 0.00 178.83 179.02 1x8z h SER 54 N 0.83 -1.05 -1.02 1.46 0.87 -1.12 0.21 113.55 113.73 1x8z h SER 54 Ca 0.39 0.05 0.25 0.00 -1.23 0.00 0.00 61.79 61.25 1x8z h SER 54 Cb 0.31 0.29 -0.12 0.00 -0.44 0.00 0.00 62.40 62.45 1x8z h SER 54 CO -0.23 -0.68 0.62 0.40 -0.53 0.00 0.00 176.83 176.41 1x8z h ILE 55 N -1.10 0.53 -0.08 2.23 2.04 -1.04 -0.07 117.51 120.02 1x8z h ILE 55 Ca -0.10 -0.18 -0.25 0.00 1.00 0.00 0.00 64.86 65.33 1x8z h ILE 55 Cb 0.87 -0.05 0.02 0.00 -0.74 0.00 0.00 36.82 36.92 1x8z h ILE 55 CO 0.13 0.10 -0.91 0.40 0.00 0.00 0.00 178.15 177.87 1x8z h ILE 56 N 0.53 1.28 -0.05 -0.67 2.04 -1.16 -3.26 117.51 116.21 1x8z h ILE 56 Ca 0.64 -2.11 -0.07 0.00 1.00 0.00 0.00 64.86 64.31 1x8z h ILE 56 Cb 1.32 2.18 -0.01 0.00 -0.74 0.00 0.00 36.82 39.56 1x8z h ILE 56 CO -0.43 0.66 -0.31 0.44 0.00 0.00 0.00 178.15 178.51 1x8z h ASP 57 N 0.47 0.09 0.20 1.72 3.45 0.12 -2.44 116.42 120.03 1x8z h ASP 57 Ca -0.09 -0.03 0.00 0.00 0.43 0.00 0.00 57.03 57.34 1x8z h ASP 57 Cb 1.55 -0.02 0.00 0.00 -0.56 0.00 0.00 39.33 40.30 1x8z h ASP 57 CO 0.18 0.40 -0.04 0.61 -1.57 0.00 0.00 179.24 178.82 1x8z n GLY 58 N -0.56 -0.84 0.00 2.75 0.00 -0.63 -5.01 105.19 100.90 1x8z n GLY 58 Ca -0.02 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.74 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 1.17 -0.60 3.40 -0.02 0.00 -0.92 -5.11 105.19 103.10 1x8z n GLY 59 Ca 0.18 -1.36 -0.12 0.00 0.00 0.00 0.00 46.02 44.73 1x8z n GLY 59 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1x8z s VAL 60 N -1.53 0.02 0.42 1.61 -7.23 -1.26 -4.87 120.40 107.57 1x8z s VAL 60 Ca 0.00 -0.16 -0.25 0.00 -1.81 0.00 0.00 61.98 59.76 1x8z s VAL 60 Cb 0.00 -1.04 -0.10 0.00 0.56 0.00 0.00 36.38 35.80 1x8z s VAL 60 CO 0.00 -0.09 1.15 -0.90 -0.31 0.00 0.00 175.10 174.95 1x8z n ASP 61 N -0.22 1.94 -0.29 4.85 5.68 -1.26 -4.57 116.55 122.69 1x8z n ASP 61 Ca -0.17 1.07 0.22 0.00 -0.50 0.00 0.00 54.79 55.41 1x8z n ASP 61 Cb 0.64 -1.43 0.41 0.00 -1.14 0.00 0.00 41.12 39.59 1x8z n ASP 61 CO 0.00 0.00 0.00 -2.65 -1.33 0.00 0.00 177.20 173.22 1x8z n PRO 62 N 0.06 -0.06 0.04 0.11 -0.02 -1.26 -0.96 135.00 132.91 1x8z n PRO 62 Ca 0.08 1.26 -0.12 0.00 -2.02 0.00 0.00 63.50 62.69 1x8z n PRO 62 Cb 0.39 -2.14 -0.08 0.00 -0.02 0.00 0.00 33.50 31.66 1x8z n PRO 62 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 1x8z h ARG 63 N 0.00 -0.03 -0.10 -0.52 2.43 -2.01 -2.72 114.38 111.43 1x8z h ARG 63 Ca 0.65 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.81 1x8z h ARG 63 Cb 1.59 0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 31.15 1x8z h ARG 63 CO -0.74 0.11 0.00 0.77 -1.51 0.00 0.00 179.97 178.60 1x8z h SER 64 N -0.17 0.17 -0.95 -3.80 0.02 -1.38 -2.81 113.55 104.64 1x8z h SER 64 Ca -0.00 -0.30 0.27 0.00 -0.84 0.00 0.00 61.79 60.92 1x8z h SER 64 Cb 0.16 -0.05 -0.04 0.00 0.14 0.00 0.00 62.40 62.61 1x8z h SER 64 CO 0.01 0.43 0.68 0.50 -1.14 0.00 0.00 176.83 177.30 1x8z h LYS 65 N -0.10 0.03 0.01 3.45 3.64 -1.35 0.32 116.57 122.58 1x8z h LYS 65 Ca 0.03 -0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.34 1x8z h LYS 65 Cb 0.34 -0.01 0.01 0.00 -0.41 0.00 0.00 32.23 32.16 1x8z h LYS 65 CO 0.00 0.02 -0.28 1.25 -2.27 0.00 0.00 179.45 178.17 1x8z h LEU 66 N 0.03 0.23 -0.07 5.20 6.46 -1.24 -0.68 115.31 125.24 1x8z h LEU 66 Ca 0.46 -0.81 0.02 0.00 -0.12 0.00 0.00 57.88 57.43 1x8z h LEU 66 Cb 1.77 -0.07 -0.02 0.00 -0.73 0.00 0.00 40.66 41.60 1x8z h LEU 66 CO -0.02 1.01 -0.06 0.00 -0.62 0.00 0.00 178.44 178.75 1x8z h ALA 67 N 0.22 0.01 -0.43 1.25 0.00 -0.64 -1.52 119.26 118.14 1x8z h ALA 67 Ca -0.04 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 1x8z h ALA 67 Cb 1.07 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.96 1x8z h ALA 67 CO 0.06 -0.53 0.19 1.88 0.00 0.00 0.00 179.25 180.85 1x8z h TYR 68 N -0.07 0.64 -0.67 0.00 0.05 -0.56 -1.65 116.97 114.71 1x8z h TYR 68 Ca 0.05 -0.04 0.13 0.00 0.05 0.00 0.00 58.73 58.93 1x8z h TYR 68 Cb 0.14 -0.20 -0.04 0.00 1.01 0.00 0.00 36.73 37.64 1x8z h TYR 68 CO -0.16 0.53 0.45 0.00 -1.05 0.00 0.00 178.16 177.93 1x8z h ARG 69 N 0.56 0.33 0.47 4.88 3.08 -0.89 0.16 114.38 122.97 1x8z h ARG 69 Ca 0.15 -0.02 -0.02 0.00 0.07 0.00 0.00 59.98 60.15 1x8z h ARG 69 Cb 0.15 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.13 1x8z h ARG 69 CO -0.02 0.22 -0.22 0.77 -1.07 0.00 0.00 179.97 179.65 1x8z h SER 70 N 0.34 -0.53 -0.77 7.04 0.02 -0.37 -2.41 113.55 116.87 1x8z h SER 70 Ca 0.32 -0.03 0.14 0.00 -0.84 0.00 0.00 61.79 61.38 1x8z h SER 70 Cb 0.78 0.14 -0.09 0.00 0.14 0.00 0.00 62.40 63.36 1x8z h SER 70 CO -0.09 -0.31 0.35 0.00 -1.14 0.00 0.00 176.83 175.64 1x8z h VAL 72 N 0.52 0.64 -0.68 0.00 2.07 -0.52 0.23 116.25 118.51 1x8z h VAL 72 Ca 0.42 -0.02 -0.04 0.00 0.82 0.00 0.00 66.70 67.88 1x8z h VAL 72 Cb 0.59 0.59 -0.03 0.00 -1.52 0.00 0.00 31.29 30.92 1x8z h VAL 72 CO -0.37 0.01 0.25 0.44 0.02 0.00 0.00 177.57 177.92 1x8z h ASP 73 N 0.05 0.96 -0.06 0.57 3.32 -0.73 -0.48 116.42 120.05 1x8z h ASP 73 Ca 0.20 -0.18 0.01 0.00 0.02 0.00 0.00 57.03 57.07 1x8z h ASP 73 Cb 0.29 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.58 1x8z h ASP 73 CO -0.37 0.88 -0.00 -0.08 -1.72 0.00 0.00 179.24 177.95 1x8z h GLU 74 N 0.98 0.01 -0.72 3.56 4.57 -0.22 -2.82 114.58 119.95 1x8z h GLU 74 Ca 0.22 -0.00 -0.06 0.00 -1.18 0.00 0.00 59.36 58.35 1x8z h GLU 74 Cb 0.24 -0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 28.80 1x8z h GLU 74 CO -0.01 0.01 0.22 1.88 -1.18 0.00 0.00 179.01 179.92 1x8z h TYR 75 N 0.01 1.16 -0.91 0.92 0.05 -0.27 -0.87 116.97 117.06 1x8z h TYR 75 Ca 0.03 -0.12 0.10 0.00 0.05 0.00 0.00 58.73 58.78 1x8z h TYR 75 Cb 0.03 -0.33 -0.07 0.00 1.01 0.00 0.00 36.73 37.37 1x8z h TYR 75 CO -0.11 0.92 0.59 0.93 -1.05 0.00 0.00 178.16 179.44 1x8z h GLU 76 N 1.06 0.90 -0.11 4.88 5.08 -0.97 0.38 114.58 125.80 1x8z h GLU 76 Ca 0.23 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.50 1x8z h GLU 76 Cb 0.31 -0.20 -0.00 0.00 0.50 0.00 0.00 28.75 29.36 1x8z h GLU 76 CO -0.01 0.59 -0.06 0.77 -1.00 0.00 0.00 179.01 179.31 1x8z h SER 77 N 0.92 0.24 -0.44 1.42 0.02 -1.20 -2.62 113.55 111.89 1x8z h SER 77 Ca 0.42 -0.43 0.09 0.00 -0.84 0.00 0.00 61.79 61.03 1x8z h SER 77 Cb 0.39 -0.07 -0.08 0.00 0.14 0.00 0.00 62.40 62.78 1x8z h SER 77 CO -0.18 0.62 -0.11 0.00 -1.14 0.00 0.00 176.83 176.01 1x8z h ALA 78 N 0.63 0.28 0.04 3.77 0.00 0.12 0.17 119.26 124.27 1x8z h ALA 78 Ca 0.02 0.17 0.02 0.00 0.00 0.00 0.00 54.91 55.13 1x8z h ALA 78 Cb 0.53 0.34 -0.04 0.00 0.00 0.00 0.00 17.79 18.63 1x8z h ALA 78 CO 0.02 -0.45 -0.22 0.82 0.00 0.00 0.00 179.25 179.42 1x8z h ILE 79 N -0.01 0.50 -0.48 0.00 5.03 -0.26 0.37 117.51 122.66 1x8z h ILE 79 Ca 0.21 0.00 0.08 0.00 -0.12 0.00 0.00 64.86 65.03 1x8z h ILE 79 Cb 0.33 0.50 -0.07 0.00 -3.03 0.00 0.00 36.82 34.55 1x8z h ILE 79 CO -0.46 0.00 0.09 1.23 -0.68 0.00 0.00 178.15 178.33 1x8z h GLY 80 N -0.37 0.57 0.85 5.37 0.00 -0.93 0.05 103.07 108.61 1x8z h GLY 80 Ca 0.05 -0.01 0.03 0.00 0.00 0.00 0.00 47.33 47.39 1x8z h GLY 80 CO -0.17 -0.07 0.26 3.43 0.00 0.00 0.00 176.54 179.99 1x8z h ASN 81 N 0.22 0.41 -0.93 0.19 2.35 -0.18 -1.52 115.58 116.11 1x8z h ASN 81 Ca 0.24 0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 56.00 1x8z h ASN 81 Cb 0.32 -0.07 -0.05 0.00 0.05 0.00 0.00 38.32 38.57 1x8z h ASN 81 CO -0.32 0.29 0.56 -0.07 -1.65 0.00 0.00 177.43 176.24 1x8z h LEU 82 N 0.52 1.12 -0.27 1.61 4.07 -0.08 0.37 115.31 122.66 1x8z h LEU 82 Ca 0.19 -0.07 -0.00 0.00 0.08 0.00 0.00 57.88 58.08 1x8z h LEU 82 Cb 0.05 -0.28 -0.01 0.00 1.08 0.00 0.00 40.66 41.49 1x8z h LEU 82 CO -0.10 0.86 0.16 -0.33 -1.08 0.00 0.00 178.44 177.95 1x8z h GLU 83 N 1.29 0.37 -0.63 1.13 5.08 -0.45 -0.60 114.58 120.77 1x8z h GLU 83 Ca 0.34 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.66 1x8z h GLU 83 Cb -0.06 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.09 1x8z h GLU 83 CO -0.06 0.29 0.37 0.93 -1.00 0.00 0.00 179.01 179.54 1x8z h GLU 84 N 0.34 0.86 -0.94 2.33 3.07 -0.79 -1.36 114.58 118.10 1x8z h GLU 84 Ca 0.10 -0.08 0.09 0.00 -0.50 0.00 0.00 59.36 58.96 1x8z h GLU 84 Cb 0.02 -0.18 -0.07 0.00 -0.84 0.00 0.00 28.75 27.68 1x8z h GLU 84 CO -0.02 0.63 0.60 0.00 -1.40 0.00 0.00 179.01 178.82 1x8z h ALA 85 N 1.19 1.54 -0.41 3.43 0.00 -0.51 0.07 119.26 124.57 1x8z h ALA 85 Ca 0.23 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.10 1x8z h ALA 85 Cb -0.00 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 1x8z h ALA 85 CO -0.04 0.28 0.14 0.35 0.00 0.00 0.00 179.25 179.98 1x8z h PHE 86 N 1.00 0.65 -0.34 0.00 3.57 -0.06 0.50 116.94 122.26 1x8z h PHE 86 Ca 0.43 -0.06 0.05 0.00 3.53 0.00 0.00 57.97 61.91 1x8z h PHE 86 Cb 0.33 -0.19 -0.04 0.00 2.79 0.00 0.00 35.95 38.83 1x8z h PHE 86 CO -0.00 0.59 0.08 0.93 -2.23 0.00 0.00 178.31 177.68 1x8z h GLU 87 N 0.52 0.20 -0.30 1.11 5.08 -0.24 -1.49 114.58 119.47 1x8z h GLU 87 Ca 0.13 -0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.51 1x8z h GLU 87 Cb 0.23 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.41 1x8z h GLU 87 CO -0.01 0.13 0.11 0.45 -1.00 0.00 0.00 179.01 178.70 1x8z h HIS 88 N 0.21 0.20 -0.87 4.33 3.86 -0.62 0.45 115.15 122.71 1x8z h HIS 88 Ca 0.16 0.01 0.13 0.00 -1.16 0.00 0.00 60.37 59.51 1x8z h HIS 88 Cb 0.16 -0.05 -0.09 0.00 1.06 0.00 0.00 27.41 28.49 1x8z h HIS 88 CO -0.17 0.09 0.48 1.25 0.86 0.00 0.00 177.93 180.45 1x8z h LEU 89 N 0.25 0.64 -0.53 2.43 5.85 -0.47 0.17 115.31 123.65 1x8z h LEU 89 Ca 0.13 0.07 -0.02 0.00 0.84 0.00 0.00 57.88 58.91 1x8z h LEU 89 Cb 0.09 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.06 1x8z h LEU 89 CO -0.13 0.31 0.26 0.00 -0.34 0.00 0.00 178.44 178.54 1x8z h ALA 90 N 1.53 0.68 0.00 1.25 0.00 -0.42 -0.87 119.26 121.43 1x8z h ALA 90 Ca 0.46 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.25 1x8z h ALA 90 Cb 0.56 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1x8z h ALA 90 CO -0.32 0.24 0.00 0.43 0.00 0.00 0.00 179.25 179.60 1x8z n SER 91 N -4.59 0.00 -0.54 0.00 7.64 0.33 -4.86 113.62 111.61 1x8z n SER 91 Ca 0.02 -0.52 -0.07 0.00 1.01 0.00 0.00 58.87 59.31 1x8z n SER 91 Cb 0.11 -0.10 -0.03 0.00 -1.01 0.00 0.00 64.21 63.19 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 0.58 0.82 3.29 0.23 0.00 0.30 -4.97 105.19 105.44 1x8z n GLY 92 Ca 0.16 -0.73 -0.44 0.00 0.00 0.00 0.00 46.02 45.01 1x8z n GLY 92 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1x8z n ASP 93 N 0.90 5.42 0.21 1.61 4.64 -0.21 -4.85 116.55 124.27 1x8z n ASP 93 Ca -0.07 -3.06 0.08 0.00 -1.38 0.00 0.00 54.79 50.36 1x8z n ASP 93 Cb 0.26 -1.47 0.61 0.00 -1.04 0.00 0.00 41.12 39.47 1x8z n ASP 93 CO 0.00 0.00 0.00 1.23 -0.82 0.00 0.00 177.20 177.61 1x8z h GLY 94 N 8.09 0.09 0.62 0.27 0.00 -1.83 0.73 103.07 111.04 1x8z h GLY 94 Ca 0.28 -0.03 -0.03 0.00 0.00 0.00 0.00 47.33 47.54 1x8z h GLY 94 CO 1.25 0.03 -0.30 1.98 0.00 0.00 0.00 176.54 179.50 1x8z h MET 95 N 0.09 -0.80 -0.66 4.80 1.85 -1.89 -0.57 114.93 117.75 1x8z h MET 95 Ca 0.03 0.05 0.13 0.00 -0.61 0.00 0.00 59.70 59.31 1x8z h MET 95 Cb 0.02 0.18 -0.10 0.00 0.43 0.00 0.00 31.60 32.13 1x8z h MET 95 CO -0.01 -0.53 0.15 0.78 -0.40 0.00 0.00 176.91 176.90 1x8z h GLY 96 N -0.97 0.87 0.63 1.39 0.00 -1.86 -1.21 103.07 101.92 1x8z h GLY 96 Ca -0.09 -0.03 0.05 0.00 0.00 0.00 0.00 47.33 47.26 1x8z h GLY 96 CO 0.14 -0.15 0.09 1.98 0.00 0.00 0.00 176.54 178.61 1x8z h MET 97 N 0.27 0.22 -0.47 4.80 4.05 -0.82 -2.01 114.93 120.97 1x8z h MET 97 Ca 0.36 -0.01 0.04 0.00 -0.28 0.00 0.00 59.70 59.80 1x8z h MET 97 Cb 0.56 -0.05 -0.04 0.00 -0.80 0.00 0.00 31.60 31.27 1x8z h MET 97 CO -0.45 0.14 0.23 -0.97 0.23 0.00 0.00 176.91 176.09 1x8z h ASN 98 N 0.22 0.32 0.27 1.39 -0.73 0.06 -0.14 115.58 116.97 1x8z h ASN 98 Ca 0.16 0.03 -0.00 0.00 1.87 0.00 0.00 56.30 58.36 1x8z h ASN 98 Cb 0.17 -0.03 -0.03 0.00 0.27 0.00 0.00 38.32 38.70 1x8z h ASN 98 CO -0.20 0.23 -0.45 0.24 -0.37 0.00 0.00 177.43 176.88 1x8z h MET 99 N 0.45 -0.74 -0.42 6.67 2.86 -0.75 -1.89 114.93 121.12 1x8z h MET 99 Ca 0.21 0.05 0.09 0.00 -2.06 0.00 0.00 59.70 57.98 1x8z h MET 99 Cb 0.13 0.17 -0.08 0.00 0.06 0.00 0.00 31.60 31.87 1x8z h MET 99 CO -0.15 -0.49 -0.13 0.87 1.06 0.00 0.00 176.91 178.06 1x8z h LYS 100 N -0.77 -0.04 -0.90 1.72 6.56 -1.04 -1.96 116.57 120.14 1x8z h LYS 100 Ca -0.03 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.57 1x8z h LYS 100 Cb 0.71 0.01 -0.04 0.00 -0.57 0.00 0.00 32.23 32.33 1x8z h LYS 100 CO -0.16 -0.02 0.57 0.28 -2.06 0.00 0.00 179.45 178.06 1x8z h VAL 101 N -0.04 1.24 -0.34 0.50 2.07 -0.90 -1.87 116.25 116.92 1x8z h VAL 101 Ca 0.20 -0.47 0.05 0.00 0.82 0.00 0.00 66.70 67.31 1x8z h VAL 101 Cb 0.35 -0.06 -0.05 0.00 -1.52 0.00 0.00 31.29 30.00 1x8z h VAL 101 CO -0.45 0.24 0.04 0.28 0.02 0.00 0.00 177.57 177.70 1x8z h SER 102 N 1.23 -0.04 -0.38 0.57 0.02 -0.60 0.13 113.55 114.47 1x8z h SER 102 Ca 0.33 0.06 0.08 0.00 -0.84 0.00 0.00 61.79 61.42 1x8z h SER 102 Cb -0.10 0.10 -0.08 0.00 0.14 0.00 0.00 62.40 62.46 1x8z h SER 102 CO -0.07 0.01 -0.13 0.00 -1.14 0.00 0.00 176.83 175.51 1x8z h ALA 103 N 1.27 0.20 -0.60 3.77 0.00 -0.86 -0.81 119.26 122.23 1x8z h ALA 103 Ca 0.16 0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.22 1x8z h ALA 103 Cb 0.20 0.35 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 1x8z h ALA 103 CO -0.24 -0.49 0.38 0.00 0.00 0.00 0.00 179.25 178.91 1x8z h ALA 104 N 1.30 0.77 -0.35 0.00 0.00 -0.54 -1.76 119.26 118.67 1x8z h ALA 104 Ca 0.19 -0.06 0.06 0.00 0.00 0.00 0.00 54.91 55.11 1x8z h ALA 104 Cb 0.33 -0.24 -0.06 0.00 0.00 0.00 0.00 17.79 17.82 1x8z h ALA 104 CO -0.42 0.22 -0.00 1.25 0.00 0.00 0.00 179.25 180.29 1x8z h LEU 105 N 0.82 -0.15 0.15 0.00 6.46 0.18 0.13 115.31 122.90 1x8z h LEU 105 Ca 0.22 0.08 0.02 0.00 -0.12 0.00 0.00 57.88 58.08 1x8z h LEU 105 Cb -0.06 0.15 -0.04 0.00 -0.73 0.00 0.00 40.66 39.98 1x8z h LEU 105 CO -0.04 -0.04 -0.32 0.44 -0.62 0.00 0.00 178.44 177.85 1x8z h ASP 106 N 0.09 -0.93 -0.98 1.25 3.45 -0.85 0.83 116.42 119.29 1x8z h ASP 106 Ca 0.17 0.10 0.11 0.00 0.43 0.00 0.00 57.03 57.85 1x8z h ASP 106 Cb 0.24 0.35 -0.13 0.00 -0.56 0.00 0.00 39.33 39.22 1x8z h ASP 106 CO -0.29 -0.42 -0.51 1.23 -1.57 0.00 0.00 179.24 177.68 1x8z h GLY 107 N -0.57 -0.51 0.34 2.75 0.00 -0.17 1.23 103.07 106.14 1x8z h GLY 107 Ca 0.02 0.70 0.04 0.00 0.00 0.00 0.00 47.33 48.08 1x8z h GLY 107 CO -0.17 -0.05 -0.27 0.00 0.00 0.00 0.00 176.54 176.05 1x8z h ALA 108 N 0.81 -0.34 -0.74 3.60 0.00 -0.23 -1.25 119.26 121.10 1x8z h ALA 108 Ca 0.23 0.01 0.13 0.00 0.00 0.00 0.00 54.91 55.27 1x8z h ALA 108 Cb 0.48 0.49 -0.09 0.00 0.00 0.00 0.00 17.79 18.68 1x8z h ALA 108 CO -0.95 -0.76 0.32 0.22 0.00 0.00 0.00 179.25 178.08 1x8z h ASP 109 N -0.39 0.34 -0.61 0.00 3.58 0.25 -2.20 116.42 117.40 1x8z h ASP 109 Ca 0.07 0.09 -0.01 0.00 0.42 0.00 0.00 57.03 57.61 1x8z h ASP 109 Cb 0.50 0.05 -0.03 0.00 1.72 0.00 0.00 39.33 41.57 1x8z h ASP 109 CO -0.26 0.16 0.35 0.74 -2.88 0.00 0.00 179.24 177.34 1x8z h THR 110 N 0.50 1.19 -0.90 2.25 2.02 0.22 -1.91 112.91 116.28 1x8z h THR 110 Ca 0.40 -0.45 0.06 0.00 0.77 0.00 0.00 66.41 67.19 1x8z h THR 110 Cb 0.55 0.38 -0.06 0.00 -1.74 0.00 0.00 68.15 67.28 1x8z h THR 110 CO -0.36 0.20 0.57 0.00 0.37 0.00 0.00 175.52 176.30 1x8z h LEU 112 N 1.03 -0.20 0.84 0.00 3.38 -1.03 -1.42 115.31 117.90 1x8z h LEU 112 Ca 0.39 0.06 -0.04 0.00 0.09 0.00 0.00 57.88 58.38 1x8z h LEU 112 Cb 0.17 0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.05 1x8z h LEU 112 CO -0.17 -0.08 -0.46 0.44 0.09 0.00 0.00 178.44 178.26 1x8z h ASP 113 N -0.03 -1.12 0.00 -0.43 3.32 -0.57 -0.06 116.42 117.53 1x8z h ASP 113 Ca 0.09 0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.19 1x8z h ASP 113 Cb 0.16 0.31 0.00 0.00 0.22 0.00 0.00 39.33 40.02 1x8z h ASP 113 CO -0.19 -0.74 0.28 0.47 -1.72 0.00 0.00 179.24 177.35 1x8z n ASP 114 N -5.38 0.00 0.00 6.45 8.00 0.24 -1.15 116.55 124.71 1x8z n ASP 114 Ca -0.15 0.21 0.00 0.00 0.71 0.00 0.00 54.79 55.56 1x8z n ASP 114 Cb 0.48 -0.21 0.00 0.00 -0.02 0.00 0.00 41.12 41.37 1x8z n ASP 114 CO 0.00 0.00 0.00 0.55 -0.39 0.00 0.00 177.20 177.36 1x8z n VAL 115 N -1.21 0.00 -0.09 2.53 3.14 -0.55 -4.67 118.33 117.48 1x8z n VAL 115 Ca 0.00 -0.47 -0.11 0.00 -2.96 0.00 0.00 64.34 60.80 1x8z n VAL 115 Cb 0.28 0.98 -0.04 0.00 -1.06 0.00 0.00 33.84 34.01 1x8z n VAL 115 CO 0.00 0.00 0.00 0.07 -6.46 0.00 0.00 176.83 170.44 1x8z h LYS 116 N 0.00 0.46 0.00 1.45 2.10 0.51 -3.03 116.57 118.06 1x8z h LYS 116 Ca 0.00 -0.14 0.00 0.00 -2.00 0.00 0.00 60.65 58.51 1x8z h LYS 116 Cb 0.00 -0.05 0.00 0.00 -0.90 0.00 0.00 32.23 31.28 1x8z h LYS 116 CO 0.00 0.60 0.00 0.54 -2.00 0.00 0.00 179.45 178.59 1x8z n ARG 117 N -4.63 0.22 -2.59 0.07 5.12 -1.26 -4.72 116.66 108.86 1x8z n ARG 117 Ca -0.03 0.00 -0.38 0.00 -1.93 0.00 0.00 57.85 55.50 1x8z n ARG 117 Cb 0.23 -1.50 -0.05 0.00 -1.16 0.00 0.00 32.46 29.98 1x8z n ARG 117 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 1x8z s LEU 118 N -2.00 4.39 0.50 0.55 1.43 -1.15 -4.92 118.68 117.49 1x8z s LEU 118 Ca 0.10 2.07 0.28 0.00 -1.03 0.00 0.00 54.13 55.55 1x8z s LEU 118 Cb 0.05 -3.88 1.29 0.00 0.03 0.00 0.00 46.19 43.68 1x8z s LEU 118 CO 0.08 -0.20 1.98 0.03 0.23 0.00 0.00 176.35 178.47 1x8z h ARG 119 N 3.32 0.00 -2.69 1.70 3.08 -1.91 -3.43 114.38 114.45 1x8z h ARG 119 Ca -0.47 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 59.47 1x8z h ARG 119 Cb 1.21 0.00 -0.22 0.00 0.08 0.00 0.00 29.97 31.03 1x8z h ARG 119 CO 0.65 0.14 -0.18 0.45 -1.07 0.00 0.00 179.97 179.96 1x8z s SER 120 N -6.04 -0.42 0.05 7.04 0.15 -1.26 -5.18 113.70 108.04 1x8z s SER 120 Ca -0.01 0.69 0.00 0.00 0.70 0.00 0.00 55.95 57.34 1x8z s SER 120 Cb 0.11 0.74 -0.03 0.00 -1.71 0.00 0.00 66.02 65.13 1x8z s SER 120 CO 0.59 -0.26 -0.05 -0.69 1.20 0.00 0.00 173.24 174.03 1x8z s VAL 121 N -0.24 0.35 -0.41 4.45 1.01 -1.26 -5.10 120.40 119.20 1x8z s VAL 121 Ca -0.04 -1.47 -0.29 0.00 0.00 0.00 0.00 61.98 60.18 1x8z s VAL 121 Cb -0.03 -1.06 0.02 0.00 0.00 0.00 0.00 36.38 35.30 1x8z s VAL 121 CO 0.02 -0.73 1.21 -0.62 0.00 0.00 0.00 175.10 174.98 1x8z s ASP 122 N -2.33 6.63 0.33 3.32 3.68 -1.26 -4.89 116.67 122.15 1x8z s ASP 122 Ca -0.01 0.74 0.12 0.00 2.13 0.00 0.00 52.55 55.53 1x8z s ASP 122 Cb -0.00 -2.55 0.97 0.00 -1.45 0.00 0.00 42.92 39.89 1x8z s ASP 122 CO -0.05 -1.21 1.71 0.77 0.13 0.00 0.00 175.17 176.53 1x8z h SER 123 N 9.35 0.61 -0.65 -0.34 4.64 -1.99 -0.10 113.55 125.07 1x8z h SER 123 Ca -0.24 0.15 0.14 0.00 -0.47 0.00 0.00 61.79 61.36 1x8z h SER 123 Cb 1.07 0.06 -0.11 0.00 -0.31 0.00 0.00 62.40 63.12 1x8z h SER 123 CO 1.09 0.03 0.02 -1.28 -0.87 0.00 0.00 176.83 175.82 1x8z h SER 124 N 0.49 -0.25 -0.12 4.97 0.87 -2.00 0.77 113.55 118.29 1x8z h SER 124 Ca 0.67 0.16 -0.12 0.00 -1.23 0.00 0.00 61.79 61.27 1x8z h SER 124 Cb 1.39 0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 63.61 1x8z h SER 124 CO -0.50 -0.11 -0.31 0.58 -0.53 0.00 0.00 176.83 175.96 1x8z h VAL 125 N 0.13 1.28 0.06 2.23 2.07 -1.41 -1.93 116.25 118.67 1x8z h VAL 125 Ca 0.34 -1.42 -0.00 0.00 0.82 0.00 0.00 66.70 66.44 1x8z h VAL 125 Cb 0.56 1.40 0.00 0.00 -1.52 0.00 0.00 31.29 31.73 1x8z h VAL 125 CO -0.54 0.45 -0.03 0.58 0.02 0.00 0.00 177.57 178.05 1x8z h VAL 126 N 0.52 1.24 0.04 2.57 2.07 -1.11 -2.27 116.25 119.30 1x8z h VAL 126 Ca 0.06 -1.08 0.01 0.00 0.82 0.00 0.00 66.70 66.52 1x8z h VAL 126 Cb 0.79 1.93 -0.02 0.00 -1.52 0.00 0.00 31.29 32.47 1x8z h VAL 126 CO 0.06 0.27 -0.11 0.78 0.02 0.00 0.00 177.57 178.59 1x8z h ASN 127 N -0.57 -0.30 -0.95 0.57 2.35 -0.92 -1.52 115.58 114.24 1x8z h ASN 127 Ca -0.01 0.04 0.12 0.00 -0.55 0.00 0.00 56.30 55.90 1x8z h ASN 127 Cb 0.49 0.12 -0.08 0.00 0.05 0.00 0.00 38.32 38.90 1x8z h ASN 127 CO 0.01 -0.16 0.58 0.78 -1.65 0.00 0.00 177.43 176.99 1x8z h ASN 128 N -0.21 0.83 -0.56 5.81 -0.26 -1.42 0.34 115.58 120.12 1x8z h ASN 128 Ca 0.03 0.05 -0.10 0.00 -0.56 0.00 0.00 56.30 55.72 1x8z h ASN 128 Cb 0.24 -0.11 -0.02 0.00 -1.06 0.00 0.00 38.32 37.37 1x8z h ASN 128 CO -0.08 0.44 -0.04 0.28 -1.06 0.00 0.00 177.43 176.96 1x8z h SER 129 N 0.91 1.02 -0.26 5.81 0.02 -0.86 0.16 113.55 120.35 1x8z h SER 129 Ca 0.48 -0.31 -0.17 0.00 -0.84 0.00 0.00 61.79 60.95 1x8z h SER 129 Cb 0.49 -0.27 0.00 0.00 0.14 0.00 0.00 62.40 62.76 1x8z h SER 129 CO -0.27 1.09 -0.50 0.11 -1.14 0.00 0.00 176.83 176.12 1x8z h LYS 130 N 0.93 0.80 0.08 3.45 1.57 -0.33 -2.23 116.57 120.84 1x8z h LYS 130 Ca 0.16 -0.51 0.00 0.00 -1.87 0.00 0.00 60.65 58.43 1x8z h LYS 130 Cb 0.60 0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.96 1x8z h LYS 130 CO 0.04 1.14 -0.07 1.15 -0.57 0.00 0.00 179.45 181.13 1x8z h THR 131 N 0.55 0.84 -0.59 -0.16 2.02 -0.18 -0.96 112.91 114.43 1x8z h THR 131 Ca 0.01 0.00 0.10 0.00 0.77 0.00 0.00 66.41 67.29 1x8z h THR 131 Cb 1.11 0.84 -0.04 0.00 -1.74 0.00 0.00 68.15 68.32 1x8z h THR 131 CO 0.11 0.00 0.40 0.40 0.37 0.00 0.00 175.52 176.80 1x8z h ILE 132 N -0.16 0.89 -0.30 3.11 2.04 -0.63 0.40 117.51 122.86 1x8z h ILE 132 Ca 0.00 -0.14 -0.13 0.00 1.00 0.00 0.00 64.86 65.60 1x8z h ILE 132 Cb 0.15 0.46 -0.00 0.00 -0.74 0.00 0.00 36.82 36.69 1x8z h ILE 132 CO -0.02 0.07 -0.33 0.11 0.00 0.00 0.00 178.15 177.99 1x8z h LYS 133 N 0.40 0.74 0.33 2.37 1.57 -0.72 0.61 116.57 121.88 1x8z h LYS 133 Ca 0.27 -0.40 -0.02 0.00 -1.87 0.00 0.00 60.65 58.63 1x8z h LYS 133 Cb 0.55 0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.88 1x8z h LYS 133 CO -0.07 1.03 -0.16 -0.91 -0.57 0.00 0.00 179.45 178.76 1x8z h ASN 134 N 0.50 -0.38 0.04 0.86 2.35 -0.06 -0.96 115.58 117.92 1x8z h ASN 134 Ca 0.04 -0.02 0.03 0.00 -0.55 0.00 0.00 56.30 55.80 1x8z h ASN 134 Cb 0.91 0.10 -0.05 0.00 0.05 0.00 0.00 38.32 39.33 1x8z h ASN 134 CO 0.08 -0.23 -0.32 -0.07 -1.65 0.00 0.00 177.43 175.24 1x8z h LEU 135 N -0.50 -0.95 -1.57 1.61 3.38 -0.92 -0.76 115.31 115.61 1x8z h LEU 135 Ca -0.05 0.12 0.23 0.00 0.09 0.00 0.00 57.88 58.27 1x8z h LEU 135 Cb 0.38 0.38 -0.07 0.00 0.09 0.00 0.00 40.66 41.44 1x8z h LEU 135 CO 0.07 -0.39 0.62 0.00 0.09 0.00 0.00 178.44 178.84 1x8z h GLY 137 N 0.33 0.62 0.83 0.00 0.00 0.27 -1.07 103.07 104.05 1x8z h GLY 137 Ca 0.49 -0.28 0.01 0.00 0.00 0.00 0.00 47.33 47.55 1x8z h GLY 137 CO -0.17 0.27 -0.07 -2.22 0.00 0.00 0.00 176.54 174.35 1x8z h ILE 138 N 0.54 0.83 -0.75 2.60 2.04 -0.33 -2.33 117.51 120.10 1x8z h ILE 138 Ca 0.15 0.00 0.11 0.00 1.00 0.00 0.00 64.86 66.12 1x8z h ILE 138 Cb 0.05 0.83 -0.08 0.00 -0.74 0.00 0.00 36.82 36.88 1x8z h ILE 138 CO -0.02 0.00 0.36 0.00 0.00 0.00 0.00 178.15 178.48 1x8z h ALA 139 N 0.88 1.05 -0.31 1.87 0.00 -1.00 -1.21 119.26 120.54 1x8z h ALA 139 Ca 0.03 0.07 0.03 0.00 0.00 0.00 0.00 54.91 55.04 1x8z h ALA 139 Cb 0.15 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 1x8z h ALA 139 CO -0.07 -0.09 0.12 -0.07 0.00 0.00 0.00 179.25 179.15 1x8z h LEU 140 N 0.58 0.15 0.47 0.00 3.38 -0.77 0.17 115.31 119.29 1x8z h LEU 140 Ca 0.38 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 58.36 1x8z h LEU 140 Cb 0.47 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.22 1x8z h LEU 140 CO -0.31 0.12 -0.33 0.58 0.09 0.00 0.00 178.44 178.59 1x8z h VAL 141 N 0.27 0.00 -0.57 1.22 2.07 -0.76 -2.78 116.25 115.70 1x8z h VAL 141 Ca 0.14 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.75 1x8z h VAL 141 Cb 0.09 0.00 -0.11 0.00 -1.52 0.00 0.00 31.29 29.75 1x8z h VAL 141 CO -0.13 0.00 -0.39 0.40 0.02 0.00 0.00 177.57 177.47 1x8z h ILE 142 N -0.76 0.12 -1.10 4.57 2.04 -1.08 0.18 117.51 121.48 1x8z h ILE 142 Ca -0.06 0.00 0.30 0.00 1.00 0.00 0.00 64.86 66.10 1x8z h ILE 142 Cb 0.62 0.12 -0.09 0.00 -0.74 0.00 0.00 36.82 36.73 1x8z h ILE 142 CO 0.04 0.00 0.73 0.77 0.00 0.00 0.00 178.15 179.68 1x8z h SER 143 N -0.21 0.34 0.03 1.72 4.64 -0.61 0.25 113.55 119.71 1x8z h SER 143 Ca 0.20 0.08 -0.08 0.00 -0.47 0.00 0.00 61.79 61.51 1x8z h SER 143 Cb 0.56 0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 62.66 1x8z h SER 143 CO -0.67 0.03 -0.22 0.78 -0.87 0.00 0.00 176.83 175.88 1x8z h ASN 144 N 0.28 0.34 0.80 4.97 2.35 -0.35 -2.37 115.58 121.60 1x8z h ASN 144 Ca 0.62 -0.10 0.00 0.00 -0.55 0.00 0.00 56.30 56.27 1x8z h ASN 144 Cb 1.79 -0.09 0.00 0.00 0.05 0.00 0.00 38.32 40.07 1x8z h ASN 144 CO -0.26 0.57 -0.07 0.23 -1.65 0.00 0.00 177.43 176.25 1x8z n MET 145 N -4.16 0.14 -1.90 0.81 2.81 0.86 -4.81 117.12 110.87 1x8z n MET 145 Ca -0.01 -0.02 -0.41 0.00 -1.81 0.00 0.00 57.70 55.46 1x8z n MET 145 Cb 0.36 -1.50 -0.01 0.00 -0.71 0.00 0.00 33.22 31.36 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 -2.87 4.36 0.26 4.03 2.01 -0.89 -4.87 118.68 120.70 1x8z s LEU 146 Ca 0.18 2.92 -0.31 0.00 0.01 0.00 0.00 54.13 56.93 1x8z s LEU 146 Cb 0.19 -3.66 -0.12 0.00 0.01 0.00 0.00 46.19 42.62 1x8z s LEU 146 CO 0.53 -0.77 1.67 -2.65 1.01 0.00 0.00 176.35 176.14 1x8z n PRO 147 N 0.78 2.77 -2.62 1.29 -0.02 -1.26 -4.89 135.00 131.05 1x8z n PRO 147 Ca 0.01 0.99 -0.22 0.00 -2.02 0.00 0.00 63.50 62.27 1x8z n PRO 147 Cb 0.40 -2.81 0.07 0.00 -0.02 0.00 0.00 33.50 31.13 1x8z n PRO 147 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 1x8z s ARG 148 N 0.28 2.16 0.00 -0.52 6.06 -1.26 -4.79 118.95 120.88 1x8z s ARG 148 Ca 0.69 -0.95 0.00 0.00 -2.50 0.00 0.00 55.73 52.97 1x8z s ARG 148 Cb -0.49 -2.42 0.00 0.00 0.06 0.00 0.00 34.95 32.10 1x8z s ARG 148 CO 0.41 -1.04 0.11 0.09 -2.50 0.00 0.00 175.30 172.36