#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a2w s GLU 2 N 0.00 4.17 0.74 1.97 2.12 -1.26 -4.98 118.70 121.47 1a2w s GLU 2 Ca 0.00 2.43 -0.11 0.00 0.36 0.00 0.00 54.97 57.65 1a2w s GLU 2 Cb 0.00 -3.64 0.04 0.00 0.26 0.00 0.00 34.13 30.79 1a2w s GLU 2 CO 0.00 -0.78 1.08 -0.08 -0.54 0.00 0.00 175.26 174.94 1a2w s THR 3 N 2.81 3.55 0.25 -1.70 -1.32 -1.26 -4.87 115.64 113.10 1a2w s THR 3 Ca 0.77 0.51 -0.06 0.00 -1.21 0.00 0.00 61.69 61.70 1a2w s THR 3 Cb -0.42 -3.08 0.25 0.00 -1.51 0.00 0.00 72.50 67.75 1a2w s THR 3 CO 0.34 -0.64 1.92 0.00 -2.21 0.00 0.00 174.62 174.03 1a2w h ALA 4 N -0.93 1.28 -0.15 11.08 0.00 -1.99 -0.95 119.26 127.60 1a2w h ALA 4 Ca -0.44 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.39 1a2w h ALA 4 Cb 1.22 -0.40 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 1a2w h ALA 4 CO 0.53 0.66 0.05 0.00 0.00 0.00 0.00 179.25 180.49 1a2w h ALA 5 N 1.37 0.19 -0.44 0.00 0.00 -2.00 -2.36 119.26 116.02 1a2w h ALA 5 Ca 0.36 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 55.11 1a2w h ALA 5 Cb -0.14 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 1a2w h ALA 5 CO -0.08 -0.21 0.07 0.00 0.00 0.00 0.00 179.25 179.04 1a2w h ALA 6 N 0.88 1.31 -0.76 0.00 0.00 -1.86 -2.40 119.26 116.42 1a2w h ALA 6 Ca 0.05 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.73 1a2w h ALA 6 Cb 0.20 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 1a2w h ALA 6 CO -0.00 0.48 0.33 -0.22 0.00 0.00 0.00 179.25 179.84 1a2w h LYS 7 N 0.64 1.12 -0.44 0.00 3.64 -1.01 -0.78 116.57 119.76 1a2w h LYS 7 Ca 0.14 -0.19 -0.00 0.00 -1.27 0.00 0.00 60.65 59.33 1a2w h LYS 7 Cb 0.30 -0.19 -0.02 0.00 -0.41 0.00 0.00 32.23 31.90 1a2w h LYS 7 CO 0.00 0.90 0.27 0.35 -2.27 0.00 0.00 179.45 178.71 1a2w h PHE 8 N 1.09 0.57 -0.65 1.91 3.57 -0.95 -1.70 116.94 120.78 1a2w h PHE 8 Ca 0.26 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.76 1a2w h PHE 8 Cb 0.17 -0.19 -0.03 0.00 2.79 0.00 0.00 35.95 38.69 1a2w h PHE 8 CO 0.02 0.39 0.40 0.93 -2.23 0.00 0.00 178.31 177.81 1a2w h GLU 9 N 0.59 0.88 -0.43 1.11 5.08 -1.03 0.89 114.58 121.66 1a2w h GLU 9 Ca 0.16 -0.07 -0.08 0.00 -1.00 0.00 0.00 59.36 58.37 1a2w h GLU 9 Cb -0.03 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.02 1a2w h GLU 9 CO -0.03 0.62 -0.04 -0.09 -1.00 0.00 0.00 179.01 178.46 1a2w h ARG 10 N 0.88 0.72 -0.02 2.33 2.43 -0.82 -1.56 114.38 118.35 1a2w h ARG 10 Ca 0.23 -0.20 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 1a2w h ARG 10 Cb -0.04 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.43 1a2w h ARG 10 CO -0.05 0.77 -0.33 0.00 -1.51 0.00 0.00 179.97 178.85 1a2w n GLN 11 N -4.21 1.53 0.00 0.20 10.64 -0.67 -4.65 117.38 120.23 1a2w n GLN 11 Ca 0.02 -1.22 0.00 0.00 -1.83 0.00 0.00 57.00 53.96 1a2w n GLN 11 Cb 0.31 -1.45 0.00 0.00 -0.86 0.00 0.00 30.24 28.25 1a2w n GLN 11 CO 0.00 0.00 0.00 0.72 -1.83 0.00 0.00 177.06 175.95 1a2w n HIS 12 N 0.34 0.00 -4.75 2.61 8.25 0.29 -5.08 115.22 116.87 1a2w n HIS 12 Ca 0.10 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.23 1a2w n HIS 12 Cb 0.49 0.00 -0.13 0.00 1.12 0.00 0.00 29.99 31.47 1a2w n HIS 12 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 1a2w s MET 13 N -0.09 2.86 -0.49 -0.41 -1.94 -0.59 -5.00 119.30 113.65 1a2w s MET 13 Ca 0.00 -0.64 0.07 0.00 -1.71 0.00 0.00 55.69 53.41 1a2w s MET 13 Cb 0.00 -2.54 0.19 0.00 2.01 0.00 0.00 34.83 34.49 1a2w s MET 13 CO 0.00 0.51 0.66 0.34 -0.01 0.00 0.00 175.02 176.52 1a2w s ASP 14 N -0.42 -0.99 -1.21 3.03 2.15 -1.26 -4.83 116.67 113.14 1a2w s ASP 14 Ca 0.05 -1.82 -0.20 0.00 0.43 0.00 0.00 52.55 51.02 1a2w s ASP 14 Cb -0.12 1.55 -0.03 0.00 -0.30 0.00 0.00 42.92 44.02 1a2w s ASP 14 CO 0.02 -0.09 1.88 -1.20 -0.17 0.00 0.00 175.17 175.62 1a2w n SER 15 N 3.12 3.79 -4.27 -0.34 7.64 -1.26 -4.91 113.62 117.39 1a2w n SER 15 Ca 0.19 -2.79 -0.32 0.00 1.01 0.00 0.00 58.87 56.95 1a2w n SER 15 Cb 0.55 -1.67 -0.16 0.00 -1.01 0.00 0.00 64.21 61.91 1a2w n SER 15 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1a2w s SER 16 N 5.21 3.33 0.09 6.43 0.15 -1.26 -5.03 113.70 122.62 1a2w s SER 16 Ca 0.60 -0.49 -0.20 0.00 0.70 0.00 0.00 55.95 56.56 1a2w s SER 16 Cb 0.04 -1.35 -0.09 0.00 -1.71 0.00 0.00 66.02 62.91 1a2w s SER 16 CO 0.10 0.18 1.64 0.71 1.20 0.00 0.00 173.24 177.06 1a2w h THR 17 N 5.50 1.16 -0.73 6.45 1.35 -1.99 -1.48 112.91 123.17 1a2w h THR 17 Ca -0.23 -0.48 -0.03 0.00 -0.55 0.00 0.00 66.41 65.12 1a2w h THR 17 Cb 1.22 1.11 -0.03 0.00 -1.73 0.00 0.00 68.15 68.71 1a2w h THR 17 CO 0.49 0.16 0.35 0.77 -0.25 0.00 0.00 175.52 177.03 1a2w h SER 18 N 0.17 0.93 -0.60 5.36 4.64 -1.99 -0.53 113.55 121.54 1a2w h SER 18 Ca 0.07 -0.10 -0.08 0.00 -0.47 0.00 0.00 61.79 61.21 1a2w h SER 18 Cb 0.17 -0.24 -0.02 0.00 -0.31 0.00 0.00 62.40 62.00 1a2w h SER 18 CO -0.01 0.79 0.07 0.00 -0.87 0.00 0.00 176.83 176.82 1a2w h ALA 19 N 1.35 0.80 -0.49 5.18 0.00 -1.91 -0.68 119.26 123.52 1a2w h ALA 19 Ca 0.25 -0.27 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 1a2w h ALA 19 Cb 0.10 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1a2w h ALA 19 CO -0.03 0.58 0.09 0.00 0.00 0.00 0.00 179.25 179.89 1a2w h ALA 20 N 1.01 0.65 -0.60 0.00 0.00 -0.69 -2.83 119.26 116.79 1a2w h ALA 20 Ca 0.18 -0.23 -0.10 0.00 0.00 0.00 0.00 54.91 54.77 1a2w h ALA 20 Cb 0.46 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 1a2w h ALA 20 CO 0.02 0.37 0.00 0.77 0.00 0.00 0.00 179.25 180.41 1a2w h SER 21 N 0.68 1.05 -0.01 0.00 0.02 -0.91 -2.89 113.55 111.48 1a2w h SER 21 Ca 0.15 -0.31 -0.03 0.00 -0.84 0.00 0.00 61.79 60.76 1a2w h SER 21 Cb 0.38 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.63 1a2w h SER 21 CO 0.01 1.10 -0.06 0.77 -1.14 0.00 0.00 176.83 177.50 1a2w h SER 22 N 0.97 0.16 0.56 3.07 4.64 -1.05 -1.77 113.55 120.12 1a2w h SER 22 Ca 0.17 -0.02 -0.01 0.00 -0.47 0.00 0.00 61.79 61.46 1a2w h SER 22 Cb 0.56 -0.04 -0.00 0.00 -0.31 0.00 0.00 62.40 62.61 1a2w h SER 22 CO 0.03 0.25 -0.03 0.28 -0.87 0.00 0.00 176.83 176.49 1a2w h SER 23 N 0.17 0.00 -0.27 4.97 0.02 -1.28 -2.44 113.55 114.72 1a2w h SER 23 Ca 0.04 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.99 1a2w h SER 23 Cb 0.22 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.76 1a2w h SER 23 CO 0.01 0.03 0.00 -3.20 -1.14 0.00 0.00 176.83 172.53 1a2w n ASN 24 N -3.19 3.13 0.00 3.07 5.15 -0.68 -4.68 115.26 118.07 1a2w n ASN 24 Ca -0.01 -1.92 -0.12 0.00 -0.60 0.00 0.00 54.58 51.93 1a2w n ASN 24 Cb 0.22 -0.17 -0.06 0.00 -0.53 0.00 0.00 39.78 39.24 1a2w n ASN 24 CO 0.00 0.00 0.00 0.22 1.40 0.00 0.00 177.26 178.88 1a2w h TYR 25 N 3.96 -1.11 -0.73 1.20 3.20 -1.34 -1.35 116.97 120.80 1a2w h TYR 25 Ca 0.00 0.04 -0.03 0.00 3.14 0.00 0.00 58.73 61.89 1a2w h TYR 25 Cb 0.89 0.50 -0.03 0.00 1.54 0.00 0.00 36.73 39.63 1a2w h TYR 25 CO 0.17 -0.46 0.35 0.00 -1.64 0.00 0.00 178.16 176.59 1a2w h ASN 27 N 1.03 0.15 -0.10 0.00 2.35 -1.77 -0.25 115.58 116.99 1a2w h ASN 27 Ca 0.25 0.04 -0.04 0.00 -0.55 0.00 0.00 56.30 56.01 1a2w h ASN 27 Cb 0.12 0.03 -0.00 0.00 0.05 0.00 0.00 38.32 38.52 1a2w h ASN 27 CO -0.03 0.12 -0.09 1.56 -1.65 0.00 0.00 177.43 177.34 1a2w h GLN 28 N 0.30 0.24 -0.56 0.81 4.20 -0.97 -3.14 115.11 115.99 1a2w h GLN 28 Ca 0.18 -0.12 -0.07 0.00 0.06 0.00 0.00 58.65 58.70 1a2w h GLN 28 Cb 0.16 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.92 1a2w h GLN 28 CO -0.19 0.65 0.09 0.52 -0.67 0.00 0.00 178.83 179.24 1a2w h MET 29 N -0.16 0.93 -0.48 1.46 2.86 -0.76 -0.43 114.93 118.35 1a2w h MET 29 Ca 0.02 -0.25 -0.01 0.00 -2.06 0.00 0.00 59.70 57.41 1a2w h MET 29 Cb 0.60 -0.11 -0.02 0.00 0.06 0.00 0.00 31.60 32.12 1a2w h MET 29 CO 0.02 0.89 0.28 0.52 1.06 0.00 0.00 176.91 179.68 1a2w h MET 30 N 0.82 0.65 0.04 1.72 2.86 -1.13 -1.30 114.93 118.59 1a2w h MET 30 Ca 0.17 -0.06 -0.13 0.00 -2.06 0.00 0.00 59.70 57.62 1a2w h MET 30 Cb 0.41 -0.14 0.01 0.00 0.06 0.00 0.00 31.60 31.94 1a2w h MET 30 CO 0.01 0.47 -0.53 0.87 1.06 0.00 0.00 176.91 178.79 1a2w h LYS 31 N 0.67 0.30 -1.00 1.72 1.57 -1.45 0.15 116.57 118.51 1a2w h LYS 31 Ca 0.17 -0.37 0.06 0.00 -1.87 0.00 0.00 60.65 58.64 1a2w h LYS 31 Cb -0.01 0.12 -0.06 0.00 0.08 0.00 0.00 32.23 32.36 1a2w h LYS 31 CO -0.03 1.09 0.65 0.77 -0.57 0.00 0.00 179.45 181.36 1a2w h SER 32 N -0.33 1.06 -0.17 0.86 0.02 -0.84 -0.90 113.55 113.25 1a2w h SER 32 Ca -0.08 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.88 1a2w h SER 32 Cb 1.31 -0.22 0.00 0.00 0.14 0.00 0.00 62.40 63.62 1a2w h SER 32 CO 0.10 0.69 0.00 0.54 -1.14 0.00 0.00 176.83 177.02 1a2w n ARG 33 N -4.48 1.65 -2.78 3.45 5.12 -0.51 -4.89 116.66 114.21 1a2w n ARG 33 Ca 0.15 -0.72 -0.21 0.00 -1.93 0.00 0.00 57.85 55.14 1a2w n ARG 33 Cb 0.15 -1.37 0.01 0.00 -1.16 0.00 0.00 32.46 30.10 1a2w n ARG 33 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 1a2w n ASN 34 N 0.09 -5.56 -0.45 0.55 3.02 -0.34 -4.88 115.26 107.69 1a2w n ASN 34 Ca 0.06 -0.15 0.14 0.00 -0.03 0.00 0.00 54.58 54.60 1a2w n ASN 34 Cb 0.29 -4.57 0.45 0.00 -0.61 0.00 0.00 39.78 35.35 1a2w n ASN 34 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1a2w n LEU 35 N -3.53 1.47 -0.05 3.41 4.77 0.50 -3.72 117.00 119.86 1a2w n LEU 35 Ca -0.15 -0.47 0.06 0.00 -0.03 0.00 0.00 56.01 55.42 1a2w n LEU 35 Cb 0.63 -0.03 0.09 0.00 -2.33 0.00 0.00 43.42 41.78 1a2w n LEU 35 CO 0.38 0.25 0.54 0.35 -1.33 0.00 0.00 177.39 177.58 1a2w n THR 36 N 0.03 1.51 0.00 -5.08 -2.24 -1.18 -3.00 114.28 104.32 1a2w n THR 36 Ca 0.17 -1.75 0.00 0.00 -2.27 0.00 0.00 64.05 60.20 1a2w n THR 36 Cb 0.37 0.05 0.00 0.00 -2.10 0.00 0.00 70.33 68.65 1a2w n THR 36 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 1a2w n LYS 37 N -1.06 0.00 -0.16 -0.78 4.81 -1.24 -3.82 118.16 115.90 1a2w n LYS 37 Ca 0.10 0.47 0.10 0.00 -0.87 0.00 0.00 58.31 58.11 1a2w n LYS 37 Cb 0.50 -1.25 0.18 0.00 0.02 0.00 0.00 35.03 34.49 1a2w n LYS 37 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1a2w n ASP 38 N -1.58 3.18 -3.61 3.14 8.00 -1.26 -5.00 116.55 119.42 1a2w n ASP 38 Ca 0.00 -1.92 0.00 0.00 0.71 0.00 0.00 54.79 53.59 1a2w n ASP 38 Cb 0.00 -0.22 -0.01 0.00 -0.02 0.00 0.00 41.12 40.88 1a2w n ASP 38 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1a2w s ARG 39 N -1.31 0.35 -0.40 -1.24 1.70 -1.25 -5.12 118.95 111.67 1a2w s ARG 39 Ca 0.33 -0.18 -0.16 0.00 -0.47 0.00 0.00 55.73 55.24 1a2w s ARG 39 Cb 0.19 0.13 0.01 0.00 -0.57 0.00 0.00 34.95 34.71 1a2w s ARG 39 CO 0.27 -0.16 0.38 0.00 -1.08 0.00 0.00 175.30 174.70 1a2w s LYS 41 N 1.96 3.91 0.22 0.00 2.20 -1.16 -4.90 119.74 121.97 1a2w s LYS 41 Ca 0.10 2.05 -0.08 0.00 -0.36 0.00 0.00 55.97 57.68 1a2w s LYS 41 Cb -0.18 -4.08 0.30 0.00 -1.51 0.00 0.00 37.83 32.36 1a2w s LYS 41 CO 0.12 -1.17 1.79 -1.00 -0.36 0.00 0.00 175.35 174.73 1a2w h PRO 42 N 10.78 0.61 -4.16 4.03 0.13 -1.94 -3.45 132.00 138.00 1a2w h PRO 42 Ca -0.39 -0.04 -0.28 0.00 -0.87 0.00 0.00 66.00 64.42 1a2w h PRO 42 Cb 1.19 -0.14 -0.27 0.00 0.13 0.00 0.00 31.00 31.91 1a2w h PRO 42 CO 0.97 0.40 -0.74 0.08 -0.23 0.00 0.00 178.00 178.48 1a2w s VAL 43 N -6.07 0.29 -0.15 1.56 1.01 -1.26 -0.63 120.40 115.14 1a2w s VAL 43 Ca -0.13 -0.31 -0.28 0.00 0.00 0.00 0.00 61.98 61.25 1a2w s VAL 43 Cb 0.17 -0.28 0.08 0.00 0.00 0.00 0.00 36.38 36.35 1a2w s VAL 43 CO 0.76 -0.02 0.74 0.21 0.00 0.00 0.00 175.10 176.79 1a2w s ASN 44 N -0.36 -0.66 -0.05 3.32 2.47 -0.55 -5.02 114.94 114.08 1a2w s ASN 44 Ca -0.01 0.97 0.06 0.00 0.42 0.00 0.00 52.86 54.30 1a2w s ASN 44 Cb -0.03 0.88 -0.01 0.00 -1.45 0.00 0.00 41.25 40.64 1a2w s ASN 44 CO -0.00 -0.43 -0.24 -0.89 -3.72 0.00 0.00 177.10 171.82 1a2w s THR 45 N -0.53 2.18 -0.10 -5.21 2.01 -1.26 -0.70 115.64 112.03 1a2w s THR 45 Ca -0.06 -1.03 0.01 0.00 0.31 0.00 0.00 61.69 60.92 1a2w s THR 45 Cb -0.02 -1.79 -0.02 0.00 0.01 0.00 0.00 72.50 70.67 1a2w s THR 45 CO 0.05 0.57 -0.11 -0.36 -0.69 0.00 0.00 174.62 174.09 1a2w s PHE 46 N -0.27 2.84 -0.19 4.92 0.08 -0.52 -4.97 117.98 119.87 1a2w s PHE 46 Ca -0.00 -0.31 -0.06 0.00 0.12 0.00 0.00 56.93 56.68 1a2w s PHE 46 Cb -0.13 -1.77 -0.03 0.00 -0.57 0.00 0.00 43.02 40.52 1a2w s PHE 46 CO 0.03 0.05 0.02 0.08 -0.10 0.00 0.00 175.22 175.30 1a2w s VAL 47 N -0.21 4.31 -1.06 -0.44 1.01 -1.26 -1.07 120.40 121.68 1a2w s VAL 47 Ca 0.01 -0.20 -0.02 0.00 0.00 0.00 0.00 61.98 61.78 1a2w s VAL 47 Cb -0.13 -2.94 0.31 0.00 0.00 0.00 0.00 36.38 33.61 1a2w s VAL 47 CO 0.03 0.44 1.77 1.41 0.00 0.00 0.00 175.10 178.75 1a2w n HIS 48 N 3.90 2.63 -4.19 5.22 -0.00 -0.11 -4.93 115.22 117.73 1a2w n HIS 48 Ca -0.17 -2.57 -0.12 0.00 -0.00 0.00 0.00 57.72 54.86 1a2w n HIS 48 Cb 0.52 -1.25 -0.10 0.00 -0.00 0.00 0.00 29.99 29.16 1a2w n HIS 48 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.34 175.13 1a2w s GLU 49 N -3.76 1.11 0.50 -0.41 0.41 -1.26 -4.56 118.70 110.73 1a2w s GLU 49 Ca 0.38 -1.57 -0.21 0.00 -0.41 0.00 0.00 54.97 53.17 1a2w s GLU 49 Cb 0.15 0.20 -0.07 0.00 -1.78 0.00 0.00 34.13 32.64 1a2w s GLU 49 CO -0.07 -0.33 1.11 -1.54 -0.49 0.00 0.00 175.26 173.95 1a2w s SER 50 N -3.13 6.01 0.22 -0.19 1.04 -1.26 -4.93 113.70 111.46 1a2w s SER 50 Ca 0.33 2.14 -0.08 0.00 0.48 0.00 0.00 55.95 58.83 1a2w s SER 50 Cb 0.07 -2.58 0.28 0.00 0.10 0.00 0.00 66.02 63.89 1a2w s SER 50 CO 0.08 -1.02 1.83 0.25 0.98 0.00 0.00 173.24 175.36 1a2w h LEU 51 N 1.53 0.71 -0.96 2.42 5.85 -1.99 -1.91 115.31 120.95 1a2w h LEU 51 Ca -0.50 0.02 0.06 0.00 0.84 0.00 0.00 57.88 58.30 1a2w h LEU 51 Cb 1.25 -0.13 -0.06 0.00 0.37 0.00 0.00 40.66 42.09 1a2w h LEU 51 CO 0.58 0.46 0.62 0.00 -0.34 0.00 0.00 178.44 179.76 1a2w h ALA 52 N 1.37 1.32 -0.25 1.25 0.00 -1.99 0.96 119.26 121.92 1a2w h ALA 52 Ca 0.33 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 55.15 1a2w h ALA 52 Cb 0.16 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1a2w h ALA 52 CO -0.17 0.42 -0.15 -0.44 0.00 0.00 0.00 179.25 178.91 1a2w h ASP 53 N 1.14 0.41 0.44 0.00 5.19 -1.73 -1.57 116.42 120.29 1a2w h ASP 53 Ca 0.41 -0.11 -0.29 0.00 -0.62 0.00 0.00 57.03 56.43 1a2w h ASP 53 Cb 0.14 -0.11 0.02 0.00 0.18 0.00 0.00 39.33 39.56 1a2w h ASP 53 CO -0.16 0.59 -1.28 0.58 -3.12 0.00 0.00 179.24 175.85 1a2w h VAL 54 N 0.39 1.40 -0.29 -1.35 2.07 -0.94 -3.26 116.25 114.27 1a2w h VAL 54 Ca 0.07 -2.82 -0.05 0.00 0.82 0.00 0.00 66.70 64.71 1a2w h VAL 54 Cb 0.50 2.88 -0.02 0.00 -1.52 0.00 0.00 31.29 33.13 1a2w h VAL 54 CO 0.03 0.84 -0.05 1.56 0.02 0.00 0.00 177.57 179.97 1a2w h GLN 55 N 0.14 0.46 0.00 1.57 4.20 -0.64 -2.26 115.11 118.57 1a2w h GLN 55 Ca -0.17 -0.11 -0.01 0.00 0.06 0.00 0.00 58.65 58.43 1a2w h GLN 55 Cb 1.98 -0.06 -0.00 0.00 0.30 0.00 0.00 27.48 29.69 1a2w h GLN 55 CO 0.22 0.53 -0.03 0.00 -0.67 0.00 0.00 178.83 178.89 1a2w h ALA 56 N 1.51 1.07 -0.10 3.87 0.00 -1.33 -2.72 119.26 121.57 1a2w h ALA 56 Ca 0.09 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 1a2w h ALA 56 Cb 0.37 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1a2w h ALA 56 CO 0.02 0.03 0.06 0.28 0.00 0.00 0.00 179.25 179.64 1a2w h VAL 57 N 0.00 1.03 0.00 0.00 2.07 -1.48 -1.68 116.25 116.19 1a2w h VAL 57 Ca -0.00 -0.07 0.00 0.00 0.82 0.00 0.00 66.70 67.45 1a2w h VAL 57 Cb 0.25 0.89 0.00 0.00 -1.52 0.00 0.00 31.29 30.90 1a2w h VAL 57 CO 0.00 0.03 0.00 0.00 0.02 0.00 0.00 177.57 177.63 1a2w n SER 59 N -2.30 2.84 0.00 0.00 3.41 -0.63 -4.98 113.62 111.97 1a2w n SER 59 Ca -0.00 -3.47 0.00 0.00 -0.26 0.00 0.00 58.87 55.14 1a2w n SER 59 Cb 0.11 -0.58 0.00 0.00 -0.26 0.00 0.00 64.21 63.48 1a2w n SER 59 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1a2w n GLN 60 N -0.97 0.14 -2.21 4.33 6.02 -0.35 -5.04 117.38 119.30 1a2w n GLN 60 Ca 0.26 0.00 -0.41 0.00 -0.01 0.00 0.00 57.00 56.84 1a2w n GLN 60 Cb 0.92 0.00 -0.03 0.00 1.02 0.00 0.00 30.24 32.15 1a2w n GLN 60 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 1a2w s LYS 61 N 4.05 3.20 -0.15 -1.09 2.20 -1.15 -4.91 119.74 121.89 1a2w s LYS 61 Ca 0.00 0.81 -0.29 0.00 -0.36 0.00 0.00 55.97 56.13 1a2w s LYS 61 Cb 0.00 -4.19 -0.02 0.00 -1.51 0.00 0.00 37.83 32.11 1a2w s LYS 61 CO 0.00 -2.04 1.36 1.21 -0.36 0.00 0.00 175.35 175.52 1a2w s ASN 62 N 5.59 6.85 0.20 1.43 2.47 -1.26 -0.06 114.94 130.16 1a2w s ASN 62 Ca 0.64 1.77 0.05 0.00 0.42 0.00 0.00 52.86 55.74 1a2w s ASN 62 Cb -0.15 -2.54 -0.05 0.00 -1.45 0.00 0.00 41.25 37.07 1a2w s ASN 62 CO 0.27 -0.83 -0.07 -0.69 -3.72 0.00 0.00 177.10 172.07 1a2w s VAL 63 N 3.71 1.27 0.42 -5.21 1.01 0.57 -4.94 120.40 117.24 1a2w s VAL 63 Ca 0.59 -2.08 -0.23 0.00 0.00 0.00 0.00 61.98 60.25 1a2w s VAL 63 Cb -0.24 -2.13 -0.09 0.00 0.00 0.00 0.00 36.38 33.93 1a2w s VAL 63 CO 0.19 -0.52 1.07 0.00 0.00 0.00 0.00 175.10 175.83 1a2w s ALA 64 N -3.26 3.03 0.36 5.51 0.00 -1.26 -3.32 121.76 122.81 1a2w s ALA 64 Ca 0.23 0.73 -0.04 0.00 0.00 0.00 0.00 51.96 52.87 1a2w s ALA 64 Cb 0.03 -3.29 -0.05 0.00 0.00 0.00 0.00 23.12 19.82 1a2w s ALA 64 CO 0.06 -0.31 0.64 0.00 0.00 0.00 0.00 175.76 176.15 1a2w h LYS 66 N 1.06 0.00 -0.74 0.00 1.57 -1.95 -2.63 116.57 113.89 1a2w h LYS 66 Ca -0.48 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.30 1a2w h LYS 66 Cb 1.20 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.51 1a2w h LYS 66 CO 0.64 0.00 0.00 0.27 -0.57 0.00 0.00 179.45 179.79 1a2w n ASN 67 N -3.08 3.97 0.00 0.86 6.94 -1.26 -4.93 115.26 117.76 1a2w n ASN 67 Ca -0.01 -2.00 0.00 0.00 -0.02 0.00 0.00 54.58 52.55 1a2w n ASN 67 Cb 0.22 -0.49 0.00 0.00 -2.36 0.00 0.00 39.78 37.14 1a2w n ASN 67 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1a2w n GLY 68 N 1.68 0.67 3.89 4.83 0.00 -0.99 -5.07 105.19 110.20 1a2w n GLY 68 Ca 0.25 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.98 1a2w n GLY 68 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1a2w s GLN 69 N -0.72 2.46 -0.06 1.61 -1.52 -1.26 -4.87 119.66 115.31 1a2w s GLN 69 Ca 0.00 0.25 0.08 0.00 -1.95 0.00 0.00 55.36 53.75 1a2w s GLN 69 Cb 0.00 -2.01 0.13 0.00 -0.22 0.00 0.00 33.01 30.90 1a2w s GLN 69 CO 0.00 -1.26 1.02 0.25 -0.25 0.00 0.00 175.29 175.05 1a2w n THR 70 N -3.11 1.17 -1.27 -0.19 -2.24 -1.26 -1.06 114.28 106.33 1a2w n THR 70 Ca 0.07 -1.33 -0.28 0.00 -2.27 0.00 0.00 64.05 60.24 1a2w n THR 70 Cb 0.59 0.23 0.14 0.00 -2.10 0.00 0.00 70.33 69.19 1a2w n THR 70 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1a2w n ASN 71 N -0.80 5.14 -4.76 3.42 6.94 -1.26 -4.78 115.26 119.16 1a2w n ASN 71 Ca 0.07 -3.67 -0.32 0.00 -0.02 0.00 0.00 54.58 50.63 1a2w n ASN 71 Cb 0.50 -0.89 -0.07 0.00 -2.36 0.00 0.00 39.78 36.95 1a2w n ASN 71 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1a2w s TYR 73 N -1.20 0.81 -0.08 0.00 1.51 0.53 -0.31 117.35 118.60 1a2w s TYR 73 Ca 0.23 -0.20 -0.02 0.00 -1.01 0.00 0.00 57.07 56.08 1a2w s TYR 73 Cb -0.12 -0.51 -0.03 0.00 -0.11 0.00 0.00 41.96 41.18 1a2w s TYR 73 CO 0.14 -0.01 0.00 -1.14 -1.11 0.00 0.00 175.55 173.43 1a2w s GLN 74 N -0.41 2.97 0.38 -0.62 0.74 0.92 -1.33 119.66 122.30 1a2w s GLN 74 Ca 0.02 -0.42 -0.26 0.00 0.05 0.00 0.00 55.36 54.75 1a2w s GLN 74 Cb -0.04 -2.79 -0.09 0.00 1.10 0.00 0.00 33.01 31.19 1a2w s GLN 74 CO -0.00 0.70 1.19 -1.54 -0.55 0.00 0.00 175.29 175.09 1a2w s SER 75 N -0.93 6.63 0.07 6.67 1.04 -0.27 -2.91 113.70 124.00 1a2w s SER 75 Ca 0.14 2.41 -0.17 0.00 0.48 0.00 0.00 55.95 58.80 1a2w s SER 75 Cb -0.11 -2.62 -0.12 0.00 0.10 0.00 0.00 66.02 63.26 1a2w s SER 75 CO 0.03 -0.60 1.37 1.88 0.98 0.00 0.00 173.24 176.89 1a2w h TYR 76 N 2.89 0.65 -1.64 5.02 0.05 -1.95 -3.44 116.97 118.55 1a2w h TYR 76 Ca -0.49 -0.21 -0.45 0.00 0.05 0.00 0.00 58.73 57.64 1a2w h TYR 76 Cb 1.23 -0.13 -0.00 0.00 1.01 0.00 0.00 36.73 38.84 1a2w h TYR 76 CO 0.55 0.91 -0.34 -1.54 -1.05 0.00 0.00 178.16 176.69 1a2w s SER 77 N -6.39 5.62 0.50 3.88 1.04 -1.26 -5.06 113.70 112.04 1a2w s SER 77 Ca -0.13 -0.40 -0.15 0.00 0.48 0.00 0.00 55.95 55.75 1a2w s SER 77 Cb 0.07 -0.90 -0.07 0.00 0.10 0.00 0.00 66.02 65.22 1a2w s SER 77 CO 0.80 -0.56 0.95 0.42 0.98 0.00 0.00 173.24 175.82 1a2w s THR 78 N -2.30 4.60 0.07 2.02 -4.23 -1.26 -4.58 115.64 109.95 1a2w s THR 78 Ca 0.48 1.08 0.03 0.00 -1.18 0.00 0.00 61.69 62.09 1a2w s THR 78 Cb -0.08 -3.74 -0.03 0.00 1.34 0.00 0.00 72.50 69.99 1a2w s THR 78 CO 0.31 -0.70 -0.08 -0.04 -0.54 0.00 0.00 174.62 173.56 1a2w s MET 79 N -4.13 0.68 0.02 3.99 -1.94 0.24 -4.89 119.30 113.27 1a2w s MET 79 Ca 0.57 -0.97 -0.30 0.00 -1.71 0.00 0.00 55.69 53.27 1a2w s MET 79 Cb -0.10 -0.36 -0.06 0.00 2.01 0.00 0.00 34.83 36.32 1a2w s MET 79 CO 0.33 0.05 1.41 0.45 -0.01 0.00 0.00 175.02 177.25 1a2w s SER 80 N -2.07 6.84 0.08 3.03 0.15 -1.26 -2.22 113.70 118.24 1a2w s SER 80 Ca -0.02 2.16 0.05 0.00 0.70 0.00 0.00 55.95 58.84 1a2w s SER 80 Cb -0.05 -2.56 -0.03 0.00 -1.71 0.00 0.00 66.02 61.66 1a2w s SER 80 CO -0.01 -0.71 -0.13 -0.63 1.20 0.00 0.00 173.24 172.96 1a2w s ILE 81 N 2.20 1.02 -0.18 6.45 1.01 0.46 -0.94 121.20 131.23 1a2w s ILE 81 Ca 0.64 -1.36 -0.02 0.00 0.00 0.00 0.00 60.65 59.91 1a2w s ILE 81 Cb -0.32 -1.09 0.05 0.00 0.01 0.00 0.00 42.46 41.11 1a2w s ILE 81 CO 0.27 -0.32 0.00 -0.89 0.00 0.00 0.00 174.94 174.01 1a2w s THR 82 N -1.55 0.74 -0.12 2.92 2.01 -0.23 -1.58 115.64 117.84 1a2w s THR 82 Ca -0.01 -0.56 -0.22 0.00 0.31 0.00 0.00 61.69 61.21 1a2w s THR 82 Cb -0.08 -1.11 -0.03 0.00 0.01 0.00 0.00 72.50 71.29 1a2w s THR 82 CO 0.02 -0.07 0.65 -1.81 -0.69 0.00 0.00 174.62 172.72 1a2w s ASP 83 N 1.77 6.85 -0.27 3.53 1.01 0.51 -1.43 116.67 128.64 1a2w s ASP 83 Ca -0.00 1.02 -0.03 0.00 0.71 0.00 0.00 52.55 54.25 1a2w s ASP 83 Cb -0.16 -2.37 0.03 0.00 1.01 0.00 0.00 42.92 41.42 1a2w s ASP 83 CO -0.07 -0.15 -0.02 0.00 0.21 0.00 0.00 175.17 175.14 1a2w s ARG 85 N 1.34 2.32 0.26 0.00 0.52 -1.03 -1.48 118.95 120.88 1a2w s ARG 85 Ca -0.01 -0.78 -0.30 0.00 -0.52 0.00 0.00 55.73 54.12 1a2w s ARG 85 Cb -0.17 -1.94 -0.11 0.00 0.52 0.00 0.00 34.95 33.25 1a2w s ARG 85 CO -0.02 0.29 1.54 -2.00 0.02 0.00 0.00 175.30 175.13 1a2w s GLU 86 N 0.01 4.18 0.46 3.54 2.12 0.19 -0.12 118.70 129.09 1a2w s GLU 86 Ca -0.06 2.46 -0.20 0.00 0.36 0.00 0.00 54.97 57.52 1a2w s GLU 86 Cb -0.14 -3.07 -0.10 0.00 0.26 0.00 0.00 34.13 31.09 1a2w s GLU 86 CO 0.04 -0.56 0.99 0.99 -0.54 0.00 0.00 175.26 176.18 1a2w s THR 87 N 0.18 4.11 0.35 -1.70 2.01 -0.29 -4.84 115.64 115.46 1a2w s THR 87 Ca 0.63 1.30 0.06 0.00 0.31 0.00 0.00 61.69 64.00 1a2w s THR 87 Cb -0.45 -3.53 0.30 0.00 0.01 0.00 0.00 72.50 68.83 1a2w s THR 87 CO 0.44 -0.30 1.91 1.23 -0.69 0.00 0.00 174.62 177.21 1a2w h GLY 88 N 1.70 1.13 -1.99 4.40 0.00 -1.94 -1.06 103.07 105.31 1a2w h GLY 88 Ca -0.49 -0.32 0.00 0.00 0.00 0.00 0.00 47.33 46.52 1a2w h GLY 88 CO 0.60 0.17 0.00 1.44 0.00 0.00 0.00 176.54 178.76 1a2w n SER 89 N -4.52 2.94 -4.74 0.19 7.64 -1.26 -4.94 113.62 108.93 1a2w n SER 89 Ca 0.14 -2.30 -0.41 0.00 1.01 0.00 0.00 58.87 57.31 1a2w n SER 89 Cb 0.34 -0.47 -0.03 0.00 -1.01 0.00 0.00 64.21 63.04 1a2w n SER 89 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1a2w s SER 90 N -0.62 6.82 -0.02 6.43 0.15 -0.40 -4.91 113.70 121.14 1a2w s SER 90 Ca 0.27 2.49 0.00 0.00 0.70 0.00 0.00 55.95 59.42 1a2w s SER 90 Cb 0.19 -2.62 0.02 0.00 -1.71 0.00 0.00 66.02 61.90 1a2w s SER 90 CO 0.12 -0.58 0.01 -0.54 1.20 0.00 0.00 173.24 173.45 1a2w s LYS 91 N -0.28 0.15 0.38 5.44 -0.14 -1.25 -4.90 119.74 119.14 1a2w s LYS 91 Ca 0.57 0.10 -0.26 0.00 -1.36 0.00 0.00 55.97 55.02 1a2w s LYS 91 Cb -0.38 -0.35 -0.09 0.00 -1.68 0.00 0.00 37.83 35.33 1a2w s LYS 91 CO 0.40 -0.13 1.20 -0.47 -0.76 0.00 0.00 175.35 175.60 1a2w s TYR 92 N 0.92 3.07 -2.30 3.18 5.04 -1.26 -0.35 117.35 125.64 1a2w s TYR 92 Ca -0.09 1.53 0.26 0.00 -2.44 0.00 0.00 57.07 56.33 1a2w s TYR 92 Cb -0.12 -3.46 1.12 0.00 0.35 0.00 0.00 41.96 39.85 1a2w s TYR 92 CO -0.02 -1.44 1.77 -0.35 -1.34 0.00 0.00 175.55 174.17 1a2w n PRO 93 N 0.26 1.51 -2.11 4.97 -0.04 -1.26 -4.94 135.00 133.39 1a2w n PRO 93 Ca 0.03 -0.74 -0.41 0.00 -0.04 0.00 0.00 63.50 62.34 1a2w n PRO 93 Cb 0.45 -1.44 -0.00 0.00 -0.04 0.00 0.00 33.50 32.47 1a2w n PRO 93 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1a2w n ASN 94 N -0.08 7.18 -4.68 3.54 4.13 0.52 -4.98 115.26 120.90 1a2w n ASN 94 Ca 0.19 -3.14 -0.46 0.00 1.68 0.00 0.00 54.58 52.85 1a2w n ASN 94 Cb 0.28 -1.39 -0.04 0.00 -1.54 0.00 0.00 39.78 37.09 1a2w n ASN 94 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1a2w s ALA 96 N 3.55 3.61 0.13 0.00 0.00 -1.26 -4.83 121.76 122.96 1a2w s ALA 96 Ca 0.89 -0.71 0.03 0.00 0.00 0.00 0.00 51.96 52.16 1a2w s ALA 96 Cb -0.60 -1.78 -0.04 0.00 0.00 0.00 0.00 23.12 20.69 1a2w s ALA 96 CO 0.46 0.57 -0.06 0.71 0.00 0.00 0.00 175.76 177.44 1a2w s TYR 97 N -0.85 1.10 -0.11 0.00 2.02 -1.26 -1.14 117.35 117.10 1a2w s TYR 97 Ca 0.13 -0.90 -0.02 0.00 -0.37 0.00 0.00 57.07 55.92 1a2w s TYR 97 Cb -0.12 -0.61 -0.03 0.00 -0.40 0.00 0.00 41.96 40.81 1a2w s TYR 97 CO 0.03 -0.10 -0.04 0.15 -1.57 0.00 0.00 175.55 174.02 1a2w s LYS 98 N -3.83 3.17 -0.20 -0.62 1.02 0.82 -4.76 119.74 115.34 1a2w s LYS 98 Ca 0.17 -0.50 -0.08 0.00 0.02 0.00 0.00 55.97 55.58 1a2w s LYS 98 Cb 0.05 -2.77 -0.04 0.00 -0.52 0.00 0.00 37.83 34.54 1a2w s LYS 98 CO -0.01 0.51 0.08 0.99 -0.92 0.00 0.00 175.35 176.01 1a2w s THR 99 N -0.38 4.82 -0.06 2.17 2.01 -1.26 -2.47 115.64 120.47 1a2w s THR 99 Ca 0.06 -0.02 0.02 0.00 0.31 0.00 0.00 61.69 62.06 1a2w s THR 99 Cb -0.12 -3.20 0.02 0.00 0.01 0.00 0.00 72.50 69.20 1a2w s THR 99 CO 0.02 0.42 -0.09 -0.89 -0.69 0.00 0.00 174.62 173.39 1a2w s THR 100 N 0.71 0.91 -0.08 -0.82 2.01 -0.81 -5.00 115.64 112.57 1a2w s THR 100 Ca 0.04 -0.34 -0.04 0.00 0.31 0.00 0.00 61.69 61.66 1a2w s THR 100 Cb -0.13 -0.87 -0.04 0.00 0.01 0.00 0.00 72.50 71.47 1a2w s THR 100 CO 0.02 0.31 0.10 -1.10 -0.69 0.00 0.00 174.62 173.26 1a2w s GLN 101 N 0.81 3.26 0.18 4.92 1.11 -1.26 -0.36 119.66 128.31 1a2w s GLN 101 Ca -0.12 -0.29 -0.23 0.00 0.01 0.00 0.00 55.36 54.73 1a2w s GLN 101 Cb -0.15 -3.02 0.06 0.00 -1.01 0.00 0.00 33.01 28.89 1a2w s GLN 101 CO 0.02 0.72 0.64 0.00 0.01 0.00 0.00 175.29 176.68 1a2w s ALA 102 N -1.06 -1.54 -0.31 6.09 0.00 -0.61 -4.99 121.76 119.34 1a2w s ALA 102 Ca 0.18 0.36 0.03 0.00 0.00 0.00 0.00 51.96 52.52 1a2w s ALA 102 Cb -0.12 0.86 0.09 0.00 0.00 0.00 0.00 23.12 23.95 1a2w s ALA 102 CO 0.07 -0.82 0.00 -0.80 0.00 0.00 0.00 175.76 174.22 1a2w s ASN 103 N -2.77 4.52 0.27 0.00 -0.87 -1.26 -0.40 114.94 114.42 1a2w s ASN 103 Ca 0.03 -1.81 0.03 0.00 -1.57 0.00 0.00 52.86 49.54 1a2w s ASN 103 Cb -0.02 -1.49 -0.04 0.00 -0.02 0.00 0.00 41.25 39.69 1a2w s ASN 103 CO -0.09 -0.32 0.19 -0.54 -2.57 0.00 0.00 177.10 173.77 1a2w s LYS 104 N 1.07 1.50 -0.04 -0.60 1.02 -0.94 -4.78 119.74 116.97 1a2w s LYS 104 Ca 0.04 -1.84 -0.23 0.00 0.02 0.00 0.00 55.97 53.96 1a2w s LYS 104 Cb -0.19 0.20 -0.04 0.00 -0.52 0.00 0.00 37.83 37.28 1a2w s LYS 104 CO -0.09 -0.50 0.69 -1.01 -0.92 0.00 0.00 175.35 173.52 1a2w s HIS 105 N -3.76 3.61 0.12 3.18 3.76 -1.26 -0.59 115.29 120.34 1a2w s HIS 105 Ca 0.39 1.27 -0.03 0.00 -0.15 0.00 0.00 55.06 56.54 1a2w s HIS 105 Cb 0.05 -2.78 -0.05 0.00 1.11 0.00 0.00 32.58 30.91 1a2w s HIS 105 CO 0.19 0.15 0.31 0.96 -0.85 0.00 0.00 174.74 175.50 1a2w s ILE 106 N 0.55 5.26 -0.14 0.60 -4.36 -1.26 -0.69 121.20 121.16 1a2w s ILE 106 Ca 0.37 -0.16 0.01 0.00 -0.26 0.00 0.00 60.65 60.60 1a2w s ILE 106 Cb -0.18 -3.63 0.02 0.00 1.25 0.00 0.00 42.46 39.91 1a2w s ILE 106 CO 0.19 0.06 -0.14 -0.63 0.24 0.00 0.00 174.94 174.65 1a2w s ILE 107 N -1.62 1.56 0.13 8.37 1.01 1.00 -1.12 121.20 130.54 1a2w s ILE 107 Ca 0.38 -0.64 0.06 0.00 0.00 0.00 0.00 60.65 60.46 1a2w s ILE 107 Cb -0.12 -1.46 -0.04 0.00 0.01 0.00 0.00 42.46 40.85 1a2w s ILE 107 CO 0.26 0.46 -0.14 0.68 0.00 0.00 0.00 174.94 176.20 1a2w s VAL 108 N 1.38 1.40 -0.13 2.92 -7.23 -0.44 0.06 120.40 118.36 1a2w s VAL 108 Ca 0.03 -1.78 -0.11 0.00 -1.81 0.00 0.00 61.98 58.31 1a2w s VAL 108 Cb -0.13 -1.61 -0.05 0.00 0.56 0.00 0.00 36.38 35.15 1a2w s VAL 108 CO -0.09 -0.43 0.23 0.00 -0.31 0.00 0.00 175.10 174.50 1a2w s ALA 109 N -2.22 3.73 0.11 1.32 0.00 0.30 -0.35 121.76 124.65 1a2w s ALA 109 Ca 0.11 -0.53 0.08 0.00 0.00 0.00 0.00 51.96 51.62 1a2w s ALA 109 Cb -0.04 -2.20 -0.04 0.00 0.00 0.00 0.00 23.12 20.83 1a2w s ALA 109 CO 0.03 0.34 -0.15 0.00 0.00 0.00 0.00 175.76 175.99 1a2w s GLU 111 N -2.11 1.44 1.24 0.00 2.02 -0.59 -4.91 118.70 115.79 1a2w s GLU 111 Ca 0.19 -0.96 0.00 0.00 0.02 0.00 0.00 54.97 54.22 1a2w s GLU 111 Cb -0.11 0.51 0.00 0.00 0.10 0.00 0.00 34.13 34.64 1a2w s GLU 111 CO 0.11 -0.61 0.00 0.41 0.02 0.00 0.00 175.26 175.19 1a2w n GLY 112 N -0.35 -1.61 2.69 -1.39 0.00 -1.26 -2.64 105.19 100.63 1a2w n GLY 112 Ca -0.08 -1.23 -0.23 0.00 0.00 0.00 0.00 46.02 44.49 1a2w n GLY 112 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1a2w s ASN 113 N -4.15 1.66 0.57 1.61 2.47 -1.26 -2.68 114.94 113.15 1a2w s ASN 113 Ca 0.00 -0.18 -0.21 0.00 0.42 0.00 0.00 52.86 52.89 1a2w s ASN 113 Cb 0.00 -0.28 -0.04 0.00 -1.45 0.00 0.00 41.25 39.47 1a2w s ASN 113 CO 0.00 -0.26 1.33 -2.16 -3.72 0.00 0.00 177.10 172.29 1a2w s PRO 114 N 2.08 3.03 -0.73 0.43 0.04 -1.26 -5.06 135.00 133.53 1a2w s PRO 114 Ca 0.04 2.16 -0.26 0.00 0.04 0.00 0.00 61.00 62.99 1a2w s PRO 114 Cb -0.13 -2.16 -0.03 0.00 0.04 0.00 0.00 34.50 32.22 1a2w s PRO 114 CO -0.05 -1.26 1.87 -0.47 0.04 0.00 0.00 177.00 177.13 1a2w s TYR 115 N -1.34 1.75 0.28 0.56 5.04 -1.09 -4.86 117.35 117.68 1a2w s TYR 115 Ca 0.74 0.67 0.09 0.00 -2.44 0.00 0.00 57.07 56.13 1a2w s TYR 115 Cb -0.39 -4.10 -0.06 0.00 0.35 0.00 0.00 41.96 37.76 1a2w s TYR 115 CO 0.45 -2.10 -0.12 0.14 -1.34 0.00 0.00 175.55 172.58 1a2w s VAL 116 N 9.25 2.02 0.17 3.14 -7.23 -1.08 -4.82 120.40 121.85 1a2w s VAL 116 Ca 0.67 -2.23 -0.31 0.00 -1.81 0.00 0.00 61.98 58.30 1a2w s VAL 116 Cb -0.10 -2.38 -0.09 0.00 0.56 0.00 0.00 36.38 34.37 1a2w s VAL 116 CO 0.12 -0.36 1.41 -2.16 -0.31 0.00 0.00 175.10 173.81 1a2w s PRO 117 N -3.63 4.31 0.00 4.82 0.04 -1.26 -1.54 135.00 137.73 1a2w s PRO 117 Ca 0.29 2.17 0.00 0.00 0.04 0.00 0.00 61.00 63.50 1a2w s PRO 117 Cb 0.00 -3.19 0.00 0.00 0.04 0.00 0.00 34.50 31.35 1a2w s PRO 117 CO 0.13 -0.42 0.00 1.55 0.04 0.00 0.00 177.00 178.30 1a2w n VAL 118 N 3.29 0.00 -3.71 -0.36 3.14 0.43 -4.93 118.33 116.20 1a2w n VAL 118 Ca 0.10 -0.29 -0.12 0.00 -2.96 0.00 0.00 64.34 61.06 1a2w n VAL 118 Cb 0.41 0.81 -0.10 0.00 -1.06 0.00 0.00 33.84 33.90 1a2w n VAL 118 CO 0.00 0.00 0.00 -2.28 -6.46 0.00 0.00 176.83 168.09 1a2w s HIS 119 N -1.22 -0.54 -0.28 1.45 5.65 -1.15 -4.99 115.29 114.21 1a2w s HIS 119 Ca 0.00 1.26 -0.19 0.00 0.25 0.00 0.00 55.06 56.38 1a2w s HIS 119 Cb 0.00 0.21 -0.02 0.00 -1.18 0.00 0.00 32.58 31.59 1a2w s HIS 119 CO 0.00 -0.27 0.58 0.12 -0.65 0.00 0.00 174.74 174.51 1a2w s PHE 120 N 0.55 3.25 -0.15 3.88 2.19 -1.26 -0.54 117.98 125.90 1a2w s PHE 120 Ca -0.03 0.63 -0.11 0.00 0.33 0.00 0.00 56.93 57.76 1a2w s PHE 120 Cb -0.04 -2.85 -0.05 0.00 -1.31 0.00 0.00 43.02 38.77 1a2w s PHE 120 CO -0.03 -0.37 -0.13 -3.47 1.83 0.00 0.00 175.22 173.04 1a2w n ASP 121 N 5.70 1.81 -3.28 6.13 2.03 0.11 -4.95 116.55 124.10 1a2w n ASP 121 Ca -0.02 0.61 -0.04 0.00 0.52 0.00 0.00 54.79 55.86 1a2w n ASP 121 Cb 0.49 -0.88 0.02 0.00 -0.72 0.00 0.00 41.12 40.03 1a2w n ASP 121 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1a2w s ALA 122 N -2.69 -1.49 0.02 -1.67 0.00 -0.98 -4.99 121.76 109.96 1a2w s ALA 122 Ca -0.17 -0.43 0.03 0.00 0.00 0.00 0.00 51.96 51.40 1a2w s ALA 122 Cb 0.03 0.77 -0.02 0.00 0.00 0.00 0.00 23.12 23.90 1a2w s ALA 122 CO 0.26 -1.06 -0.10 -1.12 0.00 0.00 0.00 175.76 173.74 1a2w s SER 123 N -3.42 1.21 0.00 0.00 0.01 -1.26 -0.00 113.70 110.24 1a2w s SER 123 Ca 0.22 -0.36 0.00 0.00 1.31 0.00 0.00 55.95 57.12 1a2w s SER 123 Cb -0.03 -0.07 0.00 0.00 0.21 0.00 0.00 66.02 66.13 1a2w s SER 123 CO 0.06 0.00 0.08 1.33 0.41 0.00 0.00 173.24 175.13