#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dy5 s GLU 2 N 0.00 1.83 1.08 -1.58 2.02 -1.26 -5.06 118.70 115.73 1dy5 s GLU 2 Ca 0.00 -0.47 -0.12 0.00 0.02 0.00 0.00 54.97 54.40 1dy5 s GLU 2 Cb 0.00 -1.94 0.24 0.00 0.10 0.00 0.00 34.13 32.53 1dy5 s GLU 2 CO 0.00 -0.31 1.07 0.95 0.02 0.00 0.00 175.26 176.99 1dy5 s THR 3 N 1.58 2.05 0.22 3.63 -4.23 -1.26 -4.70 115.64 112.94 1dy5 s THR 3 Ca 0.03 0.02 -0.09 0.00 -1.18 0.00 0.00 61.69 60.47 1dy5 s THR 3 Cb -0.14 -2.07 0.18 0.00 1.34 0.00 0.00 72.50 71.82 1dy5 s THR 3 CO -0.09 -0.02 1.88 0.00 -0.54 0.00 0.00 174.62 175.85 1dy5 h ALA 4 N -2.36 1.04 -0.59 3.99 0.00 -1.96 0.24 119.26 119.61 1dy5 h ALA 4 Ca -0.55 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.30 1dy5 h ALA 4 Cb 1.31 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 18.77 1dy5 h ALA 4 CO 0.47 0.38 0.32 0.00 0.00 0.00 0.00 179.25 180.43 1dy5 h ALA 5 N 1.31 0.76 -0.56 0.00 0.00 -1.89 -1.36 119.26 117.52 1dy5 h ALA 5 Ca 0.31 -0.10 -0.08 0.00 0.00 0.00 0.00 54.91 55.04 1dy5 h ALA 5 Cb -0.06 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.47 1dy5 h ALA 5 CO -0.09 0.28 0.03 0.00 0.00 0.00 0.00 179.25 179.48 1dy5 h ALA 6 N 1.15 0.99 -0.48 0.00 0.00 -1.72 -2.25 119.26 116.96 1dy5 h ALA 6 Ca 0.21 -0.28 -0.08 0.00 0.00 0.00 0.00 54.91 54.76 1dy5 h ALA 6 Cb 0.05 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 1dy5 h ALA 6 CO -0.03 0.62 -0.04 -0.22 0.00 0.00 0.00 179.25 179.58 1dy5 h LYS 7 N 0.88 0.83 -0.73 0.00 3.64 -0.77 -1.56 116.57 118.86 1dy5 h LYS 7 Ca 0.17 -0.25 0.03 0.00 -1.27 0.00 0.00 60.65 59.33 1dy5 h LYS 7 Cb 0.47 -0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 32.16 1dy5 h LYS 7 CO 0.02 0.86 0.46 0.35 -2.27 0.00 0.00 179.45 178.87 1dy5 h PHE 8 N 0.76 0.86 -0.47 1.91 3.04 -0.98 0.41 116.94 122.48 1dy5 h PHE 8 Ca 0.14 0.02 -0.01 0.00 3.98 0.00 0.00 57.97 62.10 1dy5 h PHE 8 Cb 0.52 -0.28 -0.02 0.00 2.56 0.00 0.00 35.95 38.73 1dy5 h PHE 8 CO 0.03 0.49 0.26 1.49 -2.02 0.00 0.00 178.31 178.56 1dy5 h GLU 9 N 0.90 0.65 -0.28 1.11 4.81 -0.92 0.73 114.58 121.57 1dy5 h GLU 9 Ca 0.29 -0.07 -0.01 0.00 -0.13 0.00 0.00 59.36 59.44 1dy5 h GLU 9 Cb 0.01 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.25 1dy5 h GLU 9 CO -0.11 0.50 0.15 -0.09 -0.73 0.00 0.00 179.01 178.73 1dy5 h ARG 10 N 0.62 0.40 0.00 1.92 2.43 -0.87 -1.88 114.38 117.00 1dy5 h ARG 10 Ca 0.16 -0.05 -0.13 0.00 -0.81 0.00 0.00 59.98 59.15 1dy5 h ARG 10 Cb 0.04 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.49 1dy5 h ARG 10 CO -0.03 0.37 -0.61 1.96 -1.51 0.00 0.00 179.97 180.14 1dy5 h GLN 11 N 0.34 0.00 0.00 0.20 4.20 -0.78 -3.42 115.11 115.65 1dy5 h GLN 11 Ca 0.10 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.81 1dy5 h GLN 11 Cb 0.09 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.87 1dy5 h GLN 11 CO -0.01 0.61 0.00 0.72 -0.67 0.00 0.00 178.83 179.48 1dy5 n HIS 12 N -3.25 0.00 -4.34 2.96 8.25 0.24 -4.74 115.22 114.34 1dy5 n HIS 12 Ca 0.02 0.00 -0.34 0.00 -0.26 0.00 0.00 57.72 57.14 1dy5 n HIS 12 Cb 0.78 0.00 -0.11 0.00 1.12 0.00 0.00 29.99 31.78 1dy5 n HIS 12 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 1dy5 s MET 13 N -0.34 3.60 -0.40 -0.41 -1.94 -0.71 -0.11 119.30 118.99 1dy5 s MET 13 Ca 0.00 -0.47 0.03 0.00 -1.71 0.00 0.00 55.69 53.54 1dy5 s MET 13 Cb 0.00 -2.94 0.16 0.00 2.01 0.00 0.00 34.83 34.06 1dy5 s MET 13 CO 0.00 0.33 0.38 0.34 -0.01 0.00 0.00 175.02 176.06 1dy5 s ASP 14 N 0.14 1.25 0.00 3.03 2.15 0.01 -4.82 116.67 118.44 1dy5 s ASP 14 Ca 0.00 -2.35 0.25 0.00 0.43 0.00 0.00 52.55 50.88 1dy5 s ASP 14 Cb -0.13 0.14 1.44 0.00 -0.30 0.00 0.00 42.92 44.06 1dy5 s ASP 14 CO 0.02 -0.20 1.86 -1.54 -0.17 0.00 0.00 175.17 175.14 1dy5 n SER 15 N 3.44 0.00 -0.22 -0.34 3.41 -1.26 -3.78 113.62 114.87 1dy5 n SER 15 Ca 0.20 -0.59 0.15 0.00 -0.26 0.00 0.00 58.87 58.37 1dy5 n SER 15 Cb 0.46 -0.08 0.66 0.00 -0.26 0.00 0.00 64.21 64.99 1dy5 n SER 15 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1dy5 n SER 16 N -1.08 0.74 -3.97 4.04 3.41 -1.26 -4.79 113.62 110.71 1dy5 n SER 16 Ca 0.17 -1.03 -0.09 0.00 -0.26 0.00 0.00 58.87 57.66 1dy5 n SER 16 Cb 0.12 -0.01 -0.10 0.00 -0.26 0.00 0.00 64.21 63.95 1dy5 n SER 16 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1dy5 s THR 17 N -2.18 0.13 -0.82 6.66 -1.32 -1.25 -5.05 115.64 111.81 1dy5 s THR 17 Ca 0.37 -1.11 0.26 0.00 -1.21 0.00 0.00 61.69 60.00 1dy5 s THR 17 Cb 0.21 -0.73 0.19 0.00 -1.51 0.00 0.00 72.50 70.67 1dy5 s THR 17 CO 0.40 -0.61 1.69 -1.54 -2.21 0.00 0.00 174.62 172.34 1dy5 n SER 18 N 1.02 0.53 -3.67 8.08 3.41 -1.26 -4.76 113.62 116.98 1dy5 n SER 18 Ca -0.20 0.37 -0.02 0.00 -0.26 0.00 0.00 58.87 58.76 1dy5 n SER 18 Cb 0.57 -0.40 -0.01 0.00 -0.26 0.00 0.00 64.21 64.11 1dy5 n SER 18 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1dy5 s ALA 19 N -3.07 -1.95 0.20 7.33 0.00 -1.26 -4.86 121.76 118.15 1dy5 s ALA 19 Ca 0.11 0.54 -0.32 0.00 0.00 0.00 0.00 51.96 52.28 1dy5 s ALA 19 Cb 0.15 0.45 -0.14 0.00 0.00 0.00 0.00 23.12 23.57 1dy5 s ALA 19 CO 0.61 -0.99 1.34 0.00 0.00 0.00 0.00 175.76 176.73 1dy5 n ALA 20 N -0.44 0.37 0.15 0.00 0.00 -1.26 -4.83 120.51 114.50 1dy5 n ALA 20 Ca -0.07 0.44 0.01 0.00 0.00 0.00 0.00 53.44 53.82 1dy5 n ALA 20 Cb 0.62 -2.19 0.17 0.00 0.00 0.00 0.00 19.45 18.05 1dy5 n ALA 20 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1dy5 h SER 21 N 4.18 0.00 -2.50 0.00 0.02 -1.98 -3.47 113.55 109.80 1dy5 h SER 21 Ca -0.45 0.00 0.12 0.00 -0.84 0.00 0.00 61.79 60.62 1dy5 h SER 21 Cb 1.30 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.82 1dy5 h SER 21 CO 0.76 0.56 0.50 -1.54 -1.14 0.00 0.00 176.83 175.97 1dy5 n SER 22 N -3.54 -1.73 0.08 3.07 3.41 -1.26 -5.01 113.62 108.64 1dy5 n SER 22 Ca -0.00 -1.98 0.09 0.00 -0.26 0.00 0.00 58.87 56.72 1dy5 n SER 22 Cb 0.64 2.83 0.38 0.00 -0.26 0.00 0.00 64.21 67.80 1dy5 n SER 22 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1dy5 n SER 23 N -1.30 0.35 -0.40 4.04 3.41 -1.26 -1.73 113.62 116.73 1dy5 n SER 23 Ca -0.03 0.61 0.14 0.00 -0.26 0.00 0.00 58.87 59.32 1dy5 n SER 23 Cb 0.55 -0.67 0.50 0.00 -0.26 0.00 0.00 64.21 64.33 1dy5 n SER 23 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1dy5 n ASN 24 N -1.90 1.31 0.09 4.04 0.23 -1.26 -4.47 115.26 113.30 1dy5 n ASN 24 Ca 0.02 -1.31 -0.12 0.00 -0.53 0.00 0.00 54.58 52.64 1dy5 n ASN 24 Cb 0.15 0.03 -0.05 0.00 -2.08 0.00 0.00 39.78 37.83 1dy5 n ASN 24 CO 0.00 0.00 0.00 0.22 -0.93 0.00 0.00 177.26 176.55 1dy5 h TYR 25 N 1.96 -0.48 -0.55 -2.53 3.20 -1.73 -1.64 116.97 115.19 1dy5 h TYR 25 Ca 0.00 0.01 -0.07 0.00 3.14 0.00 0.00 58.73 61.81 1dy5 h TYR 25 Cb 0.48 0.20 -0.02 0.00 1.54 0.00 0.00 36.73 38.93 1dy5 h TYR 25 CO 0.00 -0.27 0.05 0.00 -1.64 0.00 0.00 178.16 176.30 1dy5 h ASN 27 N 0.86 0.79 -0.06 0.00 2.35 -1.61 0.14 115.58 118.04 1dy5 h ASN 27 Ca 0.17 0.03 -0.09 0.00 -0.55 0.00 0.00 56.30 55.86 1dy5 h ASN 27 Cb 0.44 -0.13 0.00 0.00 0.05 0.00 0.00 38.32 38.69 1dy5 h ASN 27 CO 0.02 0.48 -0.30 1.56 -1.65 0.00 0.00 177.43 177.54 1dy5 h GLN 28 N 0.91 0.31 0.00 0.81 4.20 -0.88 -3.34 115.11 117.13 1dy5 h GLN 28 Ca 0.39 -0.25 -0.20 0.00 0.06 0.00 0.00 58.65 58.65 1dy5 h GLN 28 Cb 0.26 0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.09 1dy5 h GLN 28 CO -0.21 0.90 -0.89 1.98 -0.67 0.00 0.00 178.83 179.94 1dy5 h MET 29 N -0.20 0.25 -0.61 1.46 4.05 -0.48 -0.55 114.93 118.86 1dy5 h MET 29 Ca -0.02 -0.27 -0.01 0.00 -0.28 0.00 0.00 59.70 59.11 1dy5 h MET 29 Cb 0.95 0.08 -0.03 0.00 -0.80 0.00 0.00 31.60 31.80 1dy5 h MET 29 CO 0.06 0.99 0.32 0.52 0.23 0.00 0.00 176.91 179.03 1dy5 h MET 30 N 0.14 0.84 0.17 0.39 2.86 -1.15 -0.14 114.93 118.04 1dy5 h MET 30 Ca -0.05 -0.09 -0.01 0.00 -2.06 0.00 0.00 59.70 57.49 1dy5 h MET 30 Cb 1.52 -0.17 0.00 0.00 0.06 0.00 0.00 31.60 33.01 1dy5 h MET 30 CO 0.14 0.63 -0.08 -0.22 1.06 0.00 0.00 176.91 178.44 1dy5 h LYS 31 N 0.85 -0.21 -0.00 1.72 1.63 -1.65 -1.50 116.57 117.40 1dy5 h LYS 31 Ca 0.22 0.01 -0.05 0.00 -0.85 0.00 0.00 60.65 59.98 1dy5 h LYS 31 Cb 0.04 0.05 -0.01 0.00 -0.60 0.00 0.00 32.23 31.71 1dy5 h LYS 31 CO -0.03 0.20 -0.26 1.03 -3.45 0.00 0.00 179.45 176.94 1dy5 h SER 32 N -0.75 0.01 -0.32 4.20 0.87 -0.86 -1.53 113.55 115.17 1dy5 h SER 32 Ca -0.02 -0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.54 1dy5 h SER 32 Cb 0.52 -0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.47 1dy5 h SER 32 CO 0.04 0.26 0.00 0.54 -0.53 0.00 0.00 176.83 177.14 1dy5 n ARG 33 N -4.23 2.34 -2.98 2.24 5.12 -0.09 -4.92 116.66 114.15 1dy5 n ARG 33 Ca -0.02 -1.41 -0.16 0.00 -1.93 0.00 0.00 57.85 54.33 1dy5 n ARG 33 Cb 0.31 -1.56 0.04 0.00 -1.16 0.00 0.00 32.46 30.08 1dy5 n ARG 33 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 1dy5 n ASN 34 N 0.44 -4.92 -0.98 0.55 5.15 -0.58 -4.79 115.26 110.13 1dy5 n ASN 34 Ca 0.13 -0.27 0.11 0.00 -0.60 0.00 0.00 54.58 53.94 1dy5 n ASN 34 Cb 0.50 -3.68 0.16 0.00 -0.53 0.00 0.00 39.78 36.24 1dy5 n ASN 34 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 1dy5 n LEU 35 N -3.21 3.13 -0.32 1.20 4.77 -0.57 -4.34 117.00 117.66 1dy5 n LEU 35 Ca -0.05 -1.37 0.05 0.00 -0.03 0.00 0.00 56.01 54.61 1dy5 n LEU 35 Cb 0.57 -0.16 0.08 0.00 -2.33 0.00 0.00 43.42 41.57 1dy5 n LEU 35 CO 0.38 0.64 0.41 0.35 -1.33 0.00 0.00 177.39 177.84 1dy5 n THR 36 N 1.27 1.03 -0.04 -5.08 -2.24 -1.22 -3.00 114.28 105.00 1dy5 n THR 36 Ca 0.16 -1.28 -0.13 0.00 -2.27 0.00 0.00 64.05 60.53 1dy5 n THR 36 Cb 0.55 0.12 -0.07 0.00 -2.10 0.00 0.00 70.33 68.82 1dy5 n THR 36 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 1dy5 h LYS 37 N 0.06 0.24 -0.00 -0.78 1.57 -1.91 -3.36 116.57 112.40 1dy5 h LYS 37 Ca -0.01 -0.10 0.00 0.00 -1.87 0.00 0.00 60.65 58.67 1dy5 h LYS 37 Cb 1.20 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.50 1dy5 h LYS 37 CO 0.00 0.58 -0.32 -0.40 -0.57 0.00 0.00 179.45 178.74 1dy5 n ASP 38 N -4.71 0.39 -3.61 0.86 5.75 -1.26 -5.04 116.55 108.93 1dy5 n ASP 38 Ca -0.06 -0.69 -0.05 0.00 -0.01 0.00 0.00 54.79 53.98 1dy5 n ASP 38 Cb 0.27 0.96 -0.02 0.00 -1.03 0.00 0.00 41.12 41.31 1dy5 n ASP 38 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1dy5 s ARG 39 N -1.63 0.76 -0.42 0.11 1.70 -1.26 -5.10 118.95 113.11 1dy5 s ARG 39 Ca 0.03 -0.35 -0.25 0.00 -0.47 0.00 0.00 55.73 54.69 1dy5 s ARG 39 Cb 0.05 0.30 0.02 0.00 -0.57 0.00 0.00 34.95 34.76 1dy5 s ARG 39 CO 0.29 -0.34 0.87 0.00 -1.08 0.00 0.00 175.30 175.03 1dy5 s LYS 41 N 3.47 4.22 0.22 0.00 2.20 -1.16 -4.91 119.74 123.78 1dy5 s LYS 41 Ca 0.35 2.30 0.03 0.00 -0.36 0.00 0.00 55.97 58.29 1dy5 s LYS 41 Cb -0.11 -3.32 0.19 0.00 -1.51 0.00 0.00 37.83 33.07 1dy5 s LYS 41 CO 0.22 -0.63 1.52 -1.00 -0.36 0.00 0.00 175.35 175.11 1dy5 h PRO 42 N 7.33 0.29 -3.64 4.03 0.13 -1.94 -3.44 132.00 134.76 1dy5 h PRO 42 Ca -0.42 -0.21 -0.20 0.00 -0.87 0.00 0.00 66.00 64.29 1dy5 h PRO 42 Cb 1.20 0.04 -0.26 0.00 0.13 0.00 0.00 31.00 32.11 1dy5 h PRO 42 CO 0.91 0.83 -0.65 0.08 -0.23 0.00 0.00 178.00 178.95 1dy5 s VAL 43 N -3.72 0.02 -0.27 1.56 1.01 -1.26 -0.62 120.40 117.12 1dy5 s VAL 43 Ca -0.04 -0.17 -0.24 0.00 0.00 0.00 0.00 61.98 61.52 1dy5 s VAL 43 Cb 0.12 -0.14 0.09 0.00 0.00 0.00 0.00 36.38 36.45 1dy5 s VAL 43 CO 0.81 -0.09 0.81 0.21 0.00 0.00 0.00 175.10 176.84 1dy5 s ASN 44 N -0.26 -0.67 -0.09 3.32 2.47 -0.50 -5.02 114.94 114.19 1dy5 s ASN 44 Ca -0.03 1.28 0.00 0.00 0.42 0.00 0.00 52.86 54.54 1dy5 s ASN 44 Cb -0.02 1.30 -0.03 0.00 -1.45 0.00 0.00 41.25 41.05 1dy5 s ASN 44 CO 0.00 -0.22 -0.08 -0.89 -3.72 0.00 0.00 177.10 172.19 1dy5 s THR 45 N 0.41 3.57 0.02 -5.21 2.01 -1.26 -1.15 115.64 114.02 1dy5 s THR 45 Ca 0.00 -0.51 0.03 0.00 0.31 0.00 0.00 61.69 61.52 1dy5 s THR 45 Cb -0.05 -2.48 -0.04 0.00 0.01 0.00 0.00 72.50 69.95 1dy5 s THR 45 CO -0.02 0.57 -0.02 -0.36 -0.69 0.00 0.00 174.62 174.10 1dy5 s PHE 46 N -0.46 3.00 -0.17 4.92 0.08 -0.25 -4.43 117.98 120.67 1dy5 s PHE 46 Ca 0.07 0.02 -0.01 0.00 0.12 0.00 0.00 56.93 57.13 1dy5 s PHE 46 Cb -0.12 -1.62 -0.01 0.00 -0.57 0.00 0.00 43.02 40.70 1dy5 s PHE 46 CO 0.02 0.44 -0.12 0.08 -0.10 0.00 0.00 175.22 175.54 1dy5 s VAL 47 N -1.10 2.93 -1.00 -0.44 1.01 0.84 -0.55 120.40 122.09 1dy5 s VAL 47 Ca 0.20 -0.67 -0.02 0.00 0.00 0.00 0.00 61.98 61.49 1dy5 s VAL 47 Cb -0.11 -2.26 0.31 0.00 0.00 0.00 0.00 36.38 34.31 1dy5 s VAL 47 CO 0.11 0.50 1.47 1.41 0.00 0.00 0.00 175.10 178.59 1dy5 n HIS 48 N 4.12 2.60 -3.99 5.22 -0.00 0.61 -0.81 115.22 122.97 1dy5 n HIS 48 Ca -0.19 -2.80 -0.09 0.00 -0.00 0.00 0.00 57.72 54.65 1dy5 n HIS 48 Cb 0.52 -1.13 -0.08 0.00 -0.00 0.00 0.00 29.99 29.30 1dy5 n HIS 48 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.34 175.13 1dy5 s GLU 49 N -3.21 0.95 0.46 -0.41 0.41 -1.26 -4.50 118.70 111.14 1dy5 s GLU 49 Ca 0.35 -1.18 -0.25 0.00 -0.41 0.00 0.00 54.97 53.49 1dy5 s GLU 49 Cb 0.11 0.32 -0.08 0.00 -1.78 0.00 0.00 34.13 32.69 1dy5 s GLU 49 CO 0.02 -0.30 1.39 -1.13 -0.49 0.00 0.00 175.26 174.75 1dy5 n SER 50 N -0.10 3.05 0.05 -0.19 3.41 -1.26 -4.25 113.62 114.33 1dy5 n SER 50 Ca -0.10 1.09 0.08 0.00 -0.26 0.00 0.00 58.87 59.68 1dy5 n SER 50 Cb 0.63 -1.58 0.52 0.00 -0.26 0.00 0.00 64.21 63.51 1dy5 n SER 50 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 1dy5 h LEU 51 N 2.09 0.29 -0.88 1.04 5.85 -1.99 -1.99 115.31 119.72 1dy5 h LEU 51 Ca -0.50 -0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.13 1dy5 h LEU 51 Cb 1.28 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 42.23 1dy5 h LEU 51 CO 0.60 0.20 -0.11 0.00 -0.34 0.00 0.00 178.44 178.79 1dy5 h ALA 52 N 1.80 1.06 -0.47 1.25 0.00 -1.99 0.17 119.26 121.07 1dy5 h ALA 52 Ca 0.15 -0.30 -0.12 0.00 0.00 0.00 0.00 54.91 54.63 1dy5 h ALA 52 Cb 0.18 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1dy5 h ALA 52 CO -0.03 0.58 -0.19 -0.44 0.00 0.00 0.00 179.25 179.16 1dy5 h ASP 53 N 0.64 0.96 -0.34 0.00 3.32 -1.76 -2.55 116.42 116.70 1dy5 h ASP 53 Ca 0.11 -0.35 -0.11 0.00 0.02 0.00 0.00 57.03 56.70 1dy5 h ASP 53 Cb 0.56 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.84 1dy5 h ASP 53 CO 0.03 1.12 -0.22 0.58 -1.72 0.00 0.00 179.24 179.04 1dy5 h VAL 54 N 0.82 1.29 -0.96 -1.35 2.07 -0.93 -3.04 116.25 114.16 1dy5 h VAL 54 Ca 0.11 -1.36 0.10 0.00 0.82 0.00 0.00 66.70 66.37 1dy5 h VAL 54 Cb 0.75 1.42 -0.07 0.00 -1.52 0.00 0.00 31.29 31.86 1dy5 h VAL 54 CO 0.06 0.45 0.61 1.56 0.02 0.00 0.00 177.57 180.27 1dy5 h GLN 55 N 0.54 0.95 0.00 1.57 4.20 -0.66 -1.46 115.11 120.26 1dy5 h GLN 55 Ca 0.07 -0.06 -0.01 0.00 0.06 0.00 0.00 58.65 58.72 1dy5 h GLN 55 Cb 0.78 -0.22 -0.00 0.00 0.30 0.00 0.00 27.48 28.34 1dy5 h GLN 55 CO 0.06 0.63 -0.03 0.00 -0.67 0.00 0.00 178.83 178.83 1dy5 h ALA 56 N 1.53 1.08 -0.12 3.87 0.00 -1.33 -2.26 119.26 122.02 1dy5 h ALA 56 Ca 0.45 -0.02 0.04 0.00 0.00 0.00 0.00 54.91 55.37 1dy5 h ALA 56 Cb 0.40 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 1dy5 h ALA 56 CO -0.21 0.03 0.10 0.28 0.00 0.00 0.00 179.25 179.46 1dy5 h VAL 57 N 0.00 0.76 0.00 0.00 2.07 -1.26 -1.18 116.25 116.64 1dy5 h VAL 57 Ca -0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1dy5 h VAL 57 Cb 0.24 0.92 0.00 0.00 -1.52 0.00 0.00 31.29 30.93 1dy5 h VAL 57 CO 0.00 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.59 1dy5 n SER 59 N -1.39 2.93 0.00 0.00 7.64 -0.44 -4.98 113.62 117.38 1dy5 n SER 59 Ca 0.02 -2.29 0.00 0.00 1.01 0.00 0.00 58.87 57.61 1dy5 n SER 59 Cb 0.04 -0.27 0.00 0.00 -1.01 0.00 0.00 64.21 62.97 1dy5 n SER 59 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1dy5 n GLN 60 N -0.00 1.00 -2.79 1.43 6.02 -0.29 -4.99 117.38 117.76 1dy5 n GLN 60 Ca 0.12 0.00 -0.42 0.00 -0.01 0.00 0.00 57.00 56.69 1dy5 n GLN 60 Cb 0.51 0.00 -0.03 0.00 1.02 0.00 0.00 30.24 31.74 1dy5 n GLN 60 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 1dy5 s LYS 61 N 4.33 4.18 0.08 -1.09 2.20 -0.87 -4.86 119.74 123.72 1dy5 s LYS 61 Ca 0.00 1.07 -0.30 0.00 -0.36 0.00 0.00 55.97 56.38 1dy5 s LYS 61 Cb 0.00 -3.66 -0.05 0.00 -1.51 0.00 0.00 37.83 32.61 1dy5 s LYS 61 CO 0.00 -0.61 1.05 1.21 -0.36 0.00 0.00 175.35 176.64 1dy5 s ASN 62 N 1.35 7.31 0.06 1.43 3.04 -1.26 -0.20 114.94 126.66 1dy5 s ASN 62 Ca 0.39 1.86 -0.01 0.00 0.04 0.00 0.00 52.86 55.15 1dy5 s ASN 62 Cb -0.15 -2.58 -0.04 0.00 -1.54 0.00 0.00 41.25 36.94 1dy5 s ASN 62 CO 0.08 -0.26 -0.04 0.68 -3.04 0.00 0.00 177.10 174.53 1dy5 s VAL 63 N 0.54 0.30 0.38 -5.21 -7.23 -0.10 -4.93 120.40 104.15 1dy5 s VAL 63 Ca 0.52 -1.82 -0.26 0.00 -1.81 0.00 0.00 61.98 58.61 1dy5 s VAL 63 Cb -0.25 -1.53 -0.09 0.00 0.56 0.00 0.00 36.38 35.07 1dy5 s VAL 63 CO 0.30 -0.97 1.19 0.00 -0.31 0.00 0.00 175.10 175.31 1dy5 s ALA 64 N -3.83 3.23 0.22 1.32 0.00 -1.26 -3.18 121.76 118.26 1dy5 s ALA 64 Ca 0.08 1.02 -0.28 0.00 0.00 0.00 0.00 51.96 52.78 1dy5 s ALA 64 Cb 0.07 -3.40 -0.09 0.00 0.00 0.00 0.00 23.12 19.71 1dy5 s ALA 64 CO -0.09 -0.54 0.89 0.00 0.00 0.00 0.00 175.76 176.02 1dy5 h LYS 66 N 4.10 0.50 0.00 0.00 1.57 -1.88 -3.37 116.57 117.48 1dy5 h LYS 66 Ca -0.46 -0.50 0.00 0.00 -1.87 0.00 0.00 60.65 57.82 1dy5 h LYS 66 Cb 1.20 0.13 0.00 0.00 0.08 0.00 0.00 32.23 33.64 1dy5 h LYS 66 CO 0.67 1.14 0.00 -0.25 -0.57 0.00 0.00 179.45 180.44 1dy5 n ASP 67 N -3.80 0.00 0.00 0.86 8.00 -1.26 -5.10 116.55 115.25 1dy5 n ASP 67 Ca -0.07 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.43 1dy5 n ASP 67 Cb 0.81 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.91 1dy5 n ASP 67 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1dy5 n GLY 68 N 0.00 -0.05 0.00 0.44 0.00 -1.26 -5.21 105.19 99.12 1dy5 n GLY 68 Ca 0.00 -1.31 0.00 0.00 0.00 0.00 0.00 46.02 44.71 1dy5 n GLY 68 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1dy5 n GLN 69 N 0.00 0.83 -0.50 1.61 3.00 -1.26 -4.76 117.38 116.30 1dy5 n GLN 69 Ca 0.00 0.00 0.04 0.00 -0.01 0.00 0.00 57.00 57.03 1dy5 n GLN 69 Cb 0.00 0.00 0.20 0.00 0.00 0.00 0.00 30.24 30.44 1dy5 n GLN 69 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.06 177.31 1dy5 n THR 70 N 0.00 2.27 -0.76 5.09 -2.24 -1.26 -1.57 114.28 115.81 1dy5 n THR 70 Ca 0.00 -2.51 -0.12 0.00 -2.27 0.00 0.00 64.05 59.16 1dy5 n THR 70 Cb 0.00 -0.27 0.03 0.00 -2.10 0.00 0.00 70.33 67.99 1dy5 n THR 70 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1dy5 n ASN 71 N -1.05 6.09 -4.63 3.42 6.94 -1.26 -4.54 115.26 120.23 1dy5 n ASN 71 Ca 0.24 -2.86 -0.28 0.00 -0.02 0.00 0.00 54.58 51.65 1dy5 n ASN 71 Cb 0.84 -1.07 -0.09 0.00 -2.36 0.00 0.00 39.78 37.11 1dy5 n ASN 71 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1dy5 s TYR 73 N -1.47 -0.10 -0.15 0.00 1.51 0.08 -0.92 117.35 116.29 1dy5 s TYR 73 Ca 0.25 0.29 -0.05 0.00 -1.01 0.00 0.00 57.07 56.54 1dy5 s TYR 73 Cb -0.10 -0.01 -0.04 0.00 -0.11 0.00 0.00 41.96 41.70 1dy5 s TYR 73 CO 0.17 -0.08 0.04 -1.14 -1.11 0.00 0.00 175.55 173.43 1dy5 s GLN 74 N 0.36 3.63 0.36 -0.62 0.74 0.71 -1.36 119.66 123.48 1dy5 s GLN 74 Ca -0.03 -0.37 -0.27 0.00 0.05 0.00 0.00 55.36 54.74 1dy5 s GLN 74 Cb -0.04 -3.05 -0.09 0.00 1.10 0.00 0.00 33.01 30.93 1dy5 s GLN 74 CO -0.01 0.42 1.21 -1.54 -0.55 0.00 0.00 175.29 174.82 1dy5 s SER 75 N -0.07 6.72 0.07 6.67 1.04 0.04 -2.04 113.70 126.12 1dy5 s SER 75 Ca 0.05 2.46 -0.17 0.00 0.48 0.00 0.00 55.95 58.77 1dy5 s SER 75 Cb -0.12 -2.63 -0.12 0.00 0.10 0.00 0.00 66.02 63.24 1dy5 s SER 75 CO 0.01 -0.55 1.36 1.88 0.98 0.00 0.00 173.24 176.92 1dy5 h TYR 76 N 3.07 0.68 -3.75 5.02 0.05 -1.95 -3.43 116.97 116.67 1dy5 h TYR 76 Ca -0.48 -0.22 -0.50 0.00 0.05 0.00 0.00 58.73 57.58 1dy5 h TYR 76 Cb 1.23 -0.14 0.04 0.00 1.01 0.00 0.00 36.73 38.87 1dy5 h TYR 76 CO 0.56 0.94 0.17 -1.12 -1.05 0.00 0.00 178.16 177.66 1dy5 s SER 77 N -6.44 6.29 0.57 3.88 0.01 -1.26 -5.03 113.70 111.73 1dy5 s SER 77 Ca -0.13 1.06 -0.10 0.00 1.31 0.00 0.00 55.95 58.09 1dy5 s SER 77 Cb 0.07 -2.30 -0.04 0.00 0.21 0.00 0.00 66.02 63.95 1dy5 s SER 77 CO 0.80 -0.61 0.96 0.42 0.41 0.00 0.00 173.24 175.22 1dy5 s THR 78 N -2.78 4.75 0.09 1.44 -4.23 -1.26 -4.50 115.64 109.15 1dy5 s THR 78 Ca 0.49 0.73 0.06 0.00 -1.18 0.00 0.00 61.69 61.79 1dy5 s THR 78 Cb -0.10 -3.86 -0.03 0.00 1.34 0.00 0.00 72.50 69.85 1dy5 s THR 78 CO 0.45 -1.03 -0.15 -0.04 -0.54 0.00 0.00 174.62 173.31 1dy5 s MET 79 N -4.97 0.91 -0.15 3.99 -1.94 0.41 -4.87 119.30 112.68 1dy5 s MET 79 Ca 0.53 -1.06 -0.29 0.00 -1.71 0.00 0.00 55.69 53.16 1dy5 s MET 79 Cb -0.11 -0.90 -0.01 0.00 2.01 0.00 0.00 34.83 35.82 1dy5 s MET 79 CO 0.50 0.19 1.21 0.45 -0.01 0.00 0.00 175.02 177.36 1dy5 s SER 80 N -1.98 7.00 0.12 3.03 0.15 -1.26 -1.74 113.70 119.02 1dy5 s SER 80 Ca 0.02 1.66 0.02 0.00 0.70 0.00 0.00 55.95 58.35 1dy5 s SER 80 Cb -0.08 -2.54 -0.04 0.00 -1.71 0.00 0.00 66.02 61.64 1dy5 s SER 80 CO 0.03 -0.71 -0.04 0.27 1.20 0.00 0.00 173.24 173.99 1dy5 s ILE 81 N 3.17 0.64 -0.10 6.45 -4.36 -0.48 -0.29 121.20 126.23 1dy5 s ILE 81 Ca 0.53 -1.94 0.02 0.00 -0.26 0.00 0.00 60.65 58.99 1dy5 s ILE 81 Cb -0.21 -1.83 0.02 0.00 1.25 0.00 0.00 42.46 41.68 1dy5 s ILE 81 CO 0.15 -0.73 -0.14 -0.89 0.24 0.00 0.00 174.94 173.56 1dy5 s THR 82 N -3.67 1.40 -0.16 8.37 2.01 0.29 -1.05 115.64 122.83 1dy5 s THR 82 Ca 0.16 -0.59 -0.19 0.00 0.31 0.00 0.00 61.69 61.39 1dy5 s THR 82 Cb 0.06 -1.28 -0.04 0.00 0.01 0.00 0.00 72.50 71.25 1dy5 s THR 82 CO -0.02 0.42 0.53 -1.81 -0.69 0.00 0.00 174.62 173.05 1dy5 s ASP 83 N 0.98 6.65 -0.20 3.53 1.01 -0.09 -1.09 116.67 127.46 1dy5 s ASP 83 Ca -0.07 0.78 -0.04 0.00 0.71 0.00 0.00 52.55 53.93 1dy5 s ASP 83 Cb -0.15 -2.30 -0.01 0.00 1.01 0.00 0.00 42.92 41.46 1dy5 s ASP 83 CO -0.01 -0.11 -0.04 0.00 0.21 0.00 0.00 175.17 175.21 1dy5 s ARG 85 N 1.17 0.42 0.34 0.00 3.52 -0.91 -1.42 118.95 122.07 1dy5 s ARG 85 Ca 0.02 0.06 -0.29 0.00 -0.13 0.00 0.00 55.73 55.40 1dy5 s ARG 85 Cb -0.14 -0.61 -0.11 0.00 -1.56 0.00 0.00 34.95 32.52 1dy5 s ARG 85 CO -0.01 -0.16 1.52 -2.00 -0.81 0.00 0.00 175.30 173.84 1dy5 s GLU 86 N 1.19 4.13 0.46 5.12 2.12 0.21 -0.43 118.70 131.51 1dy5 s GLU 86 Ca -0.07 2.55 -0.05 0.00 0.36 0.00 0.00 54.97 57.76 1dy5 s GLU 86 Cb -0.13 -3.00 -0.04 0.00 0.26 0.00 0.00 34.13 31.22 1dy5 s GLU 86 CO -0.02 -0.55 0.76 0.95 -0.54 0.00 0.00 175.26 175.86 1dy5 s THR 87 N -0.67 4.92 0.45 -1.70 -4.23 -0.44 -4.81 115.64 109.16 1dy5 s THR 87 Ca 0.57 0.16 0.16 0.00 -1.18 0.00 0.00 61.69 61.40 1dy5 s THR 87 Cb -0.46 -3.86 0.19 0.00 1.34 0.00 0.00 72.50 69.71 1dy5 s THR 87 CO 0.56 -0.80 2.00 1.23 -0.54 0.00 0.00 174.62 177.08 1dy5 h GLY 88 N 0.35 0.00 0.53 3.99 0.00 -1.94 -2.10 103.07 103.90 1dy5 h GLY 88 Ca -0.47 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.86 1dy5 h GLY 88 CO 0.62 0.00 -0.20 -1.14 0.00 0.00 0.00 176.54 175.82 1dy5 n SER 89 N -4.25 0.79 -4.75 0.19 3.41 -1.26 -4.91 113.62 102.83 1dy5 n SER 89 Ca -0.02 -0.74 -0.38 0.00 -0.26 0.00 0.00 58.87 57.47 1dy5 n SER 89 Cb 0.24 0.05 0.03 0.00 -0.26 0.00 0.00 64.21 64.27 1dy5 n SER 89 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1dy5 s SER 90 N -2.50 5.44 -0.29 4.04 0.01 -0.79 -5.02 113.70 114.59 1dy5 s SER 90 Ca 0.26 2.66 -0.14 0.00 1.31 0.00 0.00 55.95 60.03 1dy5 s SER 90 Cb 0.20 -2.63 0.10 0.00 0.21 0.00 0.00 66.02 63.90 1dy5 s SER 90 CO 0.50 -1.45 0.70 -0.75 0.41 0.00 0.00 173.24 172.66 1dy5 s LYS 91 N -2.89 0.64 0.16 12.44 2.47 -0.77 -4.98 119.74 126.82 1dy5 s LYS 91 Ca 0.70 1.27 -0.33 0.00 -1.56 0.00 0.00 55.97 56.05 1dy5 s LYS 91 Cb -0.38 0.39 -0.16 0.00 -1.46 0.00 0.00 37.83 36.23 1dy5 s LYS 91 CO 0.44 -0.16 1.25 0.98 0.16 0.00 0.00 175.35 178.02 1dy5 n TYR 92 N 4.68 1.50 0.17 4.03 9.36 -1.26 -0.41 117.16 135.23 1dy5 n TYR 92 Ca -0.17 0.62 0.08 0.00 3.32 0.00 0.00 57.90 61.75 1dy5 n TYR 92 Cb 0.56 -2.33 0.25 0.00 -0.63 0.00 0.00 39.34 37.19 1dy5 n TYR 92 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 1dy5 n PRO 93 N 2.02 2.47 -3.36 2.98 -0.04 -1.26 -5.01 135.00 132.80 1dy5 n PRO 93 Ca 0.15 -2.02 -0.45 0.00 -0.04 0.00 0.00 63.50 61.14 1dy5 n PRO 93 Cb 0.25 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.19 1dy5 n PRO 93 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 1dy5 s ASN 94 N -0.95 7.00 -0.26 3.54 0.01 0.45 -5.02 114.94 119.72 1dy5 s ASN 94 Ca 0.37 -3.24 -0.17 0.00 -0.71 0.00 0.00 52.86 49.11 1dy5 s ASN 94 Cb 0.21 -2.19 -0.03 0.00 0.41 0.00 0.00 41.25 39.65 1dy5 s ASN 94 CO 0.23 -0.39 0.49 0.00 -1.51 0.00 0.00 177.10 175.92 1dy5 s ALA 96 N 2.18 1.36 -0.00 0.00 0.00 -1.26 -4.93 121.76 119.10 1dy5 s ALA 96 Ca 0.20 -0.95 -0.01 0.00 0.00 0.00 0.00 51.96 51.20 1dy5 s ALA 96 Cb -0.16 -0.20 -0.00 0.00 0.00 0.00 0.00 23.12 22.76 1dy5 s ALA 96 CO 0.09 0.26 0.02 0.71 0.00 0.00 0.00 175.76 176.84 1dy5 s TYR 97 N -0.95 0.02 -0.03 0.00 2.02 -1.26 -1.33 117.35 115.82 1dy5 s TYR 97 Ca 0.03 -0.03 -0.28 0.00 -0.37 0.00 0.00 57.07 56.41 1dy5 s TYR 97 Cb -0.09 -0.02 -0.03 0.00 -0.40 0.00 0.00 41.96 41.42 1dy5 s TYR 97 CO 0.02 -0.04 0.91 0.21 -1.57 0.00 0.00 175.55 175.08 1dy5 s LYS 98 N -0.22 4.52 -0.24 -0.62 2.47 0.43 -4.55 119.74 121.52 1dy5 s LYS 98 Ca -0.03 1.28 -0.16 0.00 -1.56 0.00 0.00 55.97 55.51 1dy5 s LYS 98 Cb -0.02 -3.47 -0.04 0.00 -1.46 0.00 0.00 37.83 32.85 1dy5 s LYS 98 CO -0.00 -0.05 0.40 0.99 0.16 0.00 0.00 175.35 176.85 1dy5 s THR 99 N 1.06 5.17 -0.14 3.43 2.01 -1.26 -2.13 115.64 123.77 1dy5 s THR 99 Ca 0.48 0.67 0.00 0.00 0.31 0.00 0.00 61.69 63.16 1dy5 s THR 99 Cb -0.20 -3.73 0.02 0.00 0.01 0.00 0.00 72.50 68.60 1dy5 s THR 99 CO 0.25 0.19 -0.14 -0.89 -0.69 0.00 0.00 174.62 173.33 1dy5 s THR 100 N 1.76 1.56 0.33 -0.82 2.01 -0.45 -4.96 115.64 115.07 1dy5 s THR 100 Ca 0.18 -0.63 -0.26 0.00 0.31 0.00 0.00 61.69 61.28 1dy5 s THR 100 Cb -0.15 -1.46 -0.09 0.00 0.01 0.00 0.00 72.50 70.80 1dy5 s THR 100 CO 0.09 0.46 1.01 -1.10 -0.69 0.00 0.00 174.62 174.39 1dy5 s GLN 101 N 1.44 4.47 0.17 4.92 -0.21 -1.26 -0.91 119.66 128.28 1dy5 s GLN 101 Ca 0.04 1.51 -0.12 0.00 0.02 0.00 0.00 55.36 56.81 1dy5 s GLN 101 Cb -0.13 -2.83 0.00 0.00 1.00 0.00 0.00 33.01 31.05 1dy5 s GLN 101 CO -0.10 0.13 0.36 0.00 -2.12 0.00 0.00 175.29 173.56 1dy5 s ALA 102 N -1.50 -0.30 -0.31 6.09 0.00 -0.21 -4.93 121.76 120.60 1dy5 s ALA 102 Ca 0.51 -0.67 -0.02 0.00 0.00 0.00 0.00 51.96 51.77 1dy5 s ALA 102 Cb -0.23 0.84 0.10 0.00 0.00 0.00 0.00 23.12 23.84 1dy5 s ALA 102 CO 0.29 -0.69 0.13 1.21 0.00 0.00 0.00 175.76 176.70 1dy5 s ASN 103 N -2.93 3.67 0.08 0.00 2.47 -1.26 -1.39 114.94 115.58 1dy5 s ASN 103 Ca 0.14 -1.52 -0.01 0.00 0.42 0.00 0.00 52.86 51.90 1dy5 s ASN 103 Cb 0.02 -0.55 -0.04 0.00 -1.45 0.00 0.00 41.25 39.23 1dy5 s ASN 103 CO -0.01 -0.42 -0.02 -0.54 -3.72 0.00 0.00 177.10 172.40 1dy5 s LYS 104 N 1.80 0.72 0.17 0.43 1.02 -0.71 -4.79 119.74 118.38 1dy5 s LYS 104 Ca 0.10 -1.29 -0.30 0.00 0.02 0.00 0.00 55.97 54.50 1dy5 s LYS 104 Cb -0.17 0.15 -0.08 0.00 -0.52 0.00 0.00 37.83 37.21 1dy5 s LYS 104 CO -0.29 -0.13 1.25 -1.01 -0.92 0.00 0.00 175.35 174.25 1dy5 s HIS 105 N -3.90 3.36 0.14 3.18 3.76 -1.26 -0.44 115.29 120.13 1dy5 s HIS 105 Ca 0.12 1.31 0.01 0.00 -0.15 0.00 0.00 55.06 56.35 1dy5 s HIS 105 Cb 0.08 -3.50 -0.04 0.00 1.11 0.00 0.00 32.58 30.23 1dy5 s HIS 105 CO -0.06 -1.51 0.30 0.96 -0.85 0.00 0.00 174.74 173.58 1dy5 s ILE 106 N 0.21 5.30 -0.15 0.60 -4.36 -1.26 -1.04 121.20 120.50 1dy5 s ILE 106 Ca 0.55 -0.53 0.00 0.00 -0.26 0.00 0.00 60.65 60.41 1dy5 s ILE 106 Cb -0.34 -3.72 0.03 0.00 1.25 0.00 0.00 42.46 39.68 1dy5 s ILE 106 CO 0.36 -0.06 -0.10 -0.63 0.24 0.00 0.00 174.94 174.74 1dy5 s ILE 107 N -1.73 1.34 0.12 8.37 1.09 0.33 -0.78 121.20 129.94 1dy5 s ILE 107 Ca 0.36 -0.57 0.11 0.00 -1.10 0.00 0.00 60.65 59.44 1dy5 s ILE 107 Cb -0.11 -1.34 -0.04 0.00 -1.06 0.00 0.00 42.46 39.90 1dy5 s ILE 107 CO 0.28 0.34 -0.27 0.68 -0.10 0.00 0.00 174.94 175.88 1dy5 s VAL 108 N 1.57 2.27 0.05 2.92 -7.23 -0.46 -0.46 120.40 119.06 1dy5 s VAL 108 Ca 0.04 -1.70 -0.22 0.00 -1.81 0.00 0.00 61.98 58.28 1dy5 s VAL 108 Cb -0.14 -1.99 -0.06 0.00 0.56 0.00 0.00 36.38 34.75 1dy5 s VAL 108 CO -0.09 0.13 0.67 0.00 -0.31 0.00 0.00 175.10 175.49 1dy5 s ALA 109 N -1.03 3.47 0.08 1.32 0.00 -0.30 -0.74 121.76 124.56 1dy5 s ALA 109 Ca 0.14 0.15 0.08 0.00 0.00 0.00 0.00 51.96 52.34 1dy5 s ALA 109 Cb -0.10 -2.82 -0.03 0.00 0.00 0.00 0.00 23.12 20.16 1dy5 s ALA 109 CO 0.06 0.21 -0.22 0.00 0.00 0.00 0.00 175.76 175.80 1dy5 s GLU 111 N -1.62 1.13 0.00 0.00 0.41 -0.58 -4.88 118.70 113.15 1dy5 s GLU 111 Ca 0.08 -0.59 0.00 0.00 -0.41 0.00 0.00 54.97 54.05 1dy5 s GLU 111 Cb -0.10 0.51 0.00 0.00 -1.78 0.00 0.00 34.13 32.76 1dy5 s GLU 111 CO 0.03 -0.46 0.00 0.41 -0.49 0.00 0.00 175.26 174.75 1dy5 n GLY 112 N -0.22 0.46 2.69 -1.39 0.00 -1.26 -2.10 105.19 103.36 1dy5 n GLY 112 Ca -0.17 -2.12 -0.29 0.00 0.00 0.00 0.00 46.02 43.45 1dy5 n GLY 112 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1dy5 s ASN 113 N 0.00 3.47 0.69 1.61 2.47 -1.26 -2.64 114.94 119.28 1dy5 s ASN 113 Ca 0.00 -1.24 -0.13 0.00 0.42 0.00 0.00 52.86 51.92 1dy5 s ASN 113 Cb 0.00 -0.64 0.01 0.00 -1.45 0.00 0.00 41.25 39.17 1dy5 s ASN 113 CO 0.00 -0.38 1.08 -2.16 -3.72 0.00 0.00 177.10 171.92 1dy5 s PRO 114 N 1.82 2.81 -0.52 0.43 0.04 -1.26 -5.10 135.00 133.22 1dy5 s PRO 114 Ca 0.05 1.15 -0.22 0.00 0.04 0.00 0.00 61.00 62.03 1dy5 s PRO 114 Cb -0.17 -1.97 0.05 0.00 0.04 0.00 0.00 34.50 32.45 1dy5 s PRO 114 CO -0.21 -1.21 0.78 -0.47 0.04 0.00 0.00 177.00 175.92 1dy5 s TYR 115 N -2.74 2.93 0.16 0.56 5.04 -1.08 -4.87 117.35 117.36 1dy5 s TYR 115 Ca 0.62 -0.21 0.01 0.00 -2.44 0.00 0.00 57.07 55.05 1dy5 s TYR 115 Cb -0.17 -3.76 -0.04 0.00 0.35 0.00 0.00 41.96 38.34 1dy5 s TYR 115 CO 0.49 -1.15 0.01 0.14 -1.34 0.00 0.00 175.55 173.70 1dy5 s VAL 116 N 3.27 0.55 0.24 3.14 -7.23 -0.89 -4.85 120.40 114.63 1dy5 s VAL 116 Ca 0.24 -1.96 -0.30 0.00 -1.81 0.00 0.00 61.98 58.14 1dy5 s VAL 116 Cb -0.15 -2.10 -0.10 0.00 0.56 0.00 0.00 36.38 34.59 1dy5 s VAL 116 CO 0.17 -0.48 1.38 -2.84 -0.31 0.00 0.00 175.10 173.02 1dy5 s PRO 117 N -3.94 4.32 0.00 4.82 0.02 -1.26 -1.53 135.00 137.42 1dy5 s PRO 117 Ca 0.24 2.21 0.00 0.00 0.02 0.00 0.00 61.00 63.47 1dy5 s PRO 117 Cb 0.06 -3.13 0.00 0.00 0.02 0.00 0.00 34.50 31.45 1dy5 s PRO 117 CO 0.03 -0.34 0.00 1.33 -0.33 0.00 0.00 177.00 177.69 1dy5 n VAL 118 N 2.27 0.00 -3.91 3.83 0.24 0.56 -4.39 118.33 116.92 1dy5 n VAL 118 Ca 0.06 -0.03 -0.11 0.00 -2.04 0.00 0.00 64.34 62.22 1dy5 n VAL 118 Cb 0.41 0.39 -0.12 0.00 -1.47 0.00 0.00 33.84 33.05 1dy5 n VAL 118 CO 0.00 0.00 0.00 -1.00 -2.14 0.00 0.00 176.83 173.69 1dy5 s HIS 119 N -1.21 0.10 -0.43 6.34 3.76 -1.08 -4.58 115.29 118.20 1dy5 s HIS 119 Ca 0.00 -0.21 -0.21 0.00 -0.15 0.00 0.00 55.06 54.49 1dy5 s HIS 119 Cb 0.00 -0.09 0.02 0.00 1.11 0.00 0.00 32.58 33.62 1dy5 s HIS 119 CO 0.00 -0.14 0.67 0.12 -0.85 0.00 0.00 174.74 174.54 1dy5 s PHE 120 N -0.86 3.06 -0.19 1.40 2.19 -1.26 -1.16 117.98 121.17 1dy5 s PHE 120 Ca -0.09 0.06 -0.20 0.00 0.33 0.00 0.00 56.93 57.03 1dy5 s PHE 120 Cb -0.06 -3.38 -0.20 0.00 -1.31 0.00 0.00 43.02 38.07 1dy5 s PHE 120 CO -0.00 -0.85 0.27 0.22 1.83 0.00 0.00 175.22 176.69 1dy5 h ASP 121 N 8.82 0.06 -5.53 6.13 3.58 -1.11 -3.48 116.42 124.89 1dy5 h ASP 121 Ca -0.25 -0.59 0.24 0.00 0.42 0.00 0.00 57.03 56.84 1dy5 h ASP 121 Cb 1.10 -0.02 -0.08 0.00 1.72 0.00 0.00 39.33 42.05 1dy5 h ASP 121 CO 0.90 1.51 0.65 0.00 -2.88 0.00 0.00 179.24 179.42 1dy5 s ALA 122 N -2.38 -1.89 0.09 -0.78 0.00 -1.00 -4.82 121.76 110.97 1dy5 s ALA 122 Ca -0.27 0.17 0.02 0.00 0.00 0.00 0.00 51.96 51.88 1dy5 s ALA 122 Cb 0.05 0.61 -0.04 0.00 0.00 0.00 0.00 23.12 23.75 1dy5 s ALA 122 CO 0.62 -1.06 -0.07 -1.54 0.00 0.00 0.00 175.76 173.71 1dy5 s SER 123 N -3.15 1.10 0.00 0.00 1.04 -1.26 -0.52 113.70 110.92 1dy5 s SER 123 Ca 0.17 -0.92 0.00 0.00 0.48 0.00 0.00 55.95 55.68 1dy5 s SER 123 Cb 0.00 0.08 0.00 0.00 0.10 0.00 0.00 66.02 66.20 1dy5 s SER 123 CO 0.01 -0.41 0.00 1.33 0.98 0.00 0.00 173.24 175.15