#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d8y s GLU 2 N 0.00 4.23 0.70 1.64 2.12 -1.26 -5.00 118.70 121.13 3d8y s GLU 2 Ca 0.00 2.24 -0.14 0.00 0.36 0.00 0.00 54.97 57.44 3d8y s GLU 2 Cb 0.00 -3.43 0.02 0.00 0.26 0.00 0.00 34.13 30.98 3d8y s GLU 2 CO 0.00 -0.63 1.11 0.95 -0.54 0.00 0.00 175.26 176.15 3d8y s THR 3 N 2.00 3.17 0.23 -1.70 -4.23 -1.26 -4.83 115.64 109.01 3d8y s THR 3 Ca 0.70 0.50 -0.07 0.00 -1.18 0.00 0.00 61.69 61.64 3d8y s THR 3 Cb -0.39 -3.00 0.19 0.00 1.34 0.00 0.00 72.50 70.63 3d8y s THR 3 CO 0.31 -0.38 1.84 0.00 -0.54 0.00 0.00 174.62 175.85 3d8y h ALA 4 N -0.32 1.07 -0.74 3.99 0.00 -1.94 -0.68 119.26 120.65 3d8y h ALA 4 Ca -0.46 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.45 3d8y h ALA 4 Cb 1.25 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.80 3d8y h ALA 4 CO 0.53 0.20 0.47 0.00 0.00 0.00 0.00 179.25 180.45 3d8y h ALA 5 N 1.38 0.93 -0.53 0.00 0.00 -1.87 -1.43 119.26 117.75 3d8y h ALA 5 Ca 0.34 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 55.12 3d8y h ALA 5 Cb 0.17 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 3d8y h ALA 5 CO -0.17 0.37 0.04 0.00 0.00 0.00 0.00 179.25 179.49 3d8y h ALA 6 N 1.26 0.70 -0.70 0.00 0.00 -1.73 -1.95 119.26 116.84 3d8y h ALA 6 Ca 0.27 -0.27 0.01 0.00 0.00 0.00 0.00 54.91 54.91 3d8y h ALA 6 Cb -0.09 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.47 3d8y h ALA 6 CO -0.06 0.48 0.46 -0.22 0.00 0.00 0.00 179.25 179.92 3d8y h LYS 7 N 0.78 0.92 -0.48 0.00 3.64 -0.95 -0.39 116.57 120.09 3d8y h LYS 7 Ca 0.15 -0.06 0.03 0.00 -1.27 0.00 0.00 60.65 59.51 3d8y h LYS 7 Cb 0.47 -0.21 -0.04 0.00 -0.41 0.00 0.00 32.23 32.05 3d8y h LYS 7 CO 0.02 0.62 0.26 0.35 -2.27 0.00 0.00 179.45 178.42 3d8y h PHE 8 N 0.95 0.48 -0.75 1.91 3.57 -1.00 0.11 116.94 122.21 3d8y h PHE 8 Ca 0.26 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.71 3d8y h PHE 8 Cb -0.10 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 38.46 3d8y h PHE 8 CO -0.02 0.25 0.23 0.93 -2.23 0.00 0.00 178.31 177.47 3d8y h GLU 9 N 0.51 1.16 -0.44 1.11 5.08 -0.99 0.15 114.58 121.16 3d8y h GLU 9 Ca 0.20 -0.25 -0.07 0.00 -1.00 0.00 0.00 59.36 58.24 3d8y h GLU 9 Cb 0.08 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.15 3d8y h GLU 9 CO -0.13 0.99 -0.02 -0.09 -1.00 0.00 0.00 179.01 178.76 3d8y h ARG 10 N 1.11 0.79 0.00 2.33 2.43 -0.60 -2.71 114.38 117.74 3d8y h ARG 10 Ca 0.24 -0.26 -0.20 0.00 -0.81 0.00 0.00 59.98 58.95 3d8y h ARG 10 Cb 0.31 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.77 3d8y h ARG 10 CO -0.01 0.86 -1.10 1.96 -1.51 0.00 0.00 179.97 180.18 3d8y h GLN 11 N 0.63 0.00 0.00 0.20 4.20 -0.60 -3.42 115.11 116.12 3d8y h GLN 11 Ca 0.12 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.83 3d8y h GLN 11 Cb 0.52 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.30 3d8y h GLN 11 CO 0.03 0.71 0.00 0.72 -0.67 0.00 0.00 178.83 179.62 3d8y n HIS 12 N -3.21 0.00 -3.79 2.96 8.25 0.51 -4.66 115.22 115.28 3d8y n HIS 12 Ca -0.04 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.06 3d8y n HIS 12 Cb 0.91 0.00 -0.09 0.00 1.12 0.00 0.00 29.99 31.93 3d8y n HIS 12 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 3d8y s MET 13 N -0.50 4.04 -0.43 -0.41 -1.94 -1.02 0.20 119.30 119.23 3d8y s MET 13 Ca 0.00 -0.30 0.04 0.00 -1.71 0.00 0.00 55.69 53.72 3d8y s MET 13 Cb 0.00 -3.39 0.17 0.00 2.01 0.00 0.00 34.83 33.62 3d8y s MET 13 CO 0.00 0.17 0.35 0.34 -0.01 0.00 0.00 175.02 175.87 3d8y s ASP 14 N 0.72 1.70 0.00 3.03 2.15 -0.33 -4.85 116.67 119.10 3d8y s ASP 14 Ca 0.06 -3.13 0.25 0.00 0.43 0.00 0.00 52.55 50.17 3d8y s ASP 14 Cb -0.13 -0.53 1.47 0.00 -0.30 0.00 0.00 42.92 43.43 3d8y s ASP 14 CO 0.02 -0.16 1.87 -1.20 -0.17 0.00 0.00 175.17 175.52 3d8y n SER 15 N 2.78 0.00 0.06 -0.34 7.64 -1.26 -3.81 113.62 118.70 3d8y n SER 15 Ca 0.29 -0.67 -0.11 0.00 1.01 0.00 0.00 58.87 59.39 3d8y n SER 15 Cb 0.47 -0.05 0.00 0.00 -1.01 0.00 0.00 64.21 63.62 3d8y n SER 15 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 3d8y h SER 16 N 0.00 0.44 -4.29 6.43 4.64 -1.92 -3.46 113.55 115.39 3d8y h SER 16 Ca 0.00 -0.32 -0.50 0.00 -0.47 0.00 0.00 61.79 60.49 3d8y h SER 16 Cb 0.04 -0.13 -0.26 0.00 -0.31 0.00 0.00 62.40 61.74 3d8y h SER 16 CO 0.00 1.09 -0.82 -0.89 -0.87 0.00 0.00 176.83 175.34 3d8y s THR 17 N -3.42 1.33 0.29 2.95 2.01 -1.25 -5.04 115.64 112.51 3d8y s THR 17 Ca -0.05 -1.01 0.23 0.00 0.31 0.00 0.00 61.69 61.16 3d8y s THR 17 Cb 0.10 -1.17 0.22 0.00 0.01 0.00 0.00 72.50 71.66 3d8y s THR 17 CO 0.84 0.13 1.91 0.77 -0.69 0.00 0.00 174.62 177.59 3d8y h SER 18 N 5.05 0.00 -5.16 3.53 4.64 -1.88 -3.44 113.55 116.29 3d8y h SER 18 Ca -0.39 0.00 0.16 0.00 -0.47 0.00 0.00 61.79 61.09 3d8y h SER 18 Cb 1.17 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 63.16 3d8y h SER 18 CO 0.45 0.23 0.49 0.00 -0.87 0.00 0.00 176.83 177.13 3d8y s ALA 19 N -3.95 -1.71 -0.06 5.18 0.00 -1.26 -4.84 121.76 115.12 3d8y s ALA 19 Ca -0.01 0.37 -0.30 0.00 0.00 0.00 0.00 51.96 52.02 3d8y s ALA 19 Cb 0.12 0.58 -0.05 0.00 0.00 0.00 0.00 23.12 23.77 3d8y s ALA 19 CO 0.64 -0.95 1.59 0.00 0.00 0.00 0.00 175.76 177.04 3d8y s ALA 20 N -3.22 3.62 -0.04 0.00 0.00 -1.26 -4.90 121.76 115.95 3d8y s ALA 20 Ca 0.10 0.89 0.13 0.00 0.00 0.00 0.00 51.96 53.08 3d8y s ALA 20 Cb -0.01 -3.72 -0.13 0.00 0.00 0.00 0.00 23.12 19.26 3d8y s ALA 20 CO -0.01 -1.32 1.06 0.77 0.00 0.00 0.00 175.76 176.25 3d8y h SER 21 N 9.20 0.00 -5.55 0.00 0.02 -2.00 -3.48 113.55 111.75 3d8y h SER 21 Ca -0.38 0.00 -0.24 0.00 -0.84 0.00 0.00 61.79 60.33 3d8y h SER 21 Cb 1.17 0.00 -0.12 0.00 0.14 0.00 0.00 62.40 63.59 3d8y h SER 21 CO 0.95 0.78 -0.38 -0.94 -1.14 0.00 0.00 176.83 176.10 3d8y s SER 22 N -6.27 0.53 0.39 3.07 1.04 -1.26 -5.04 113.70 106.16 3d8y s SER 22 Ca -0.01 -1.37 0.28 0.00 0.48 0.00 0.00 55.95 55.34 3d8y s SER 22 Cb 0.09 0.52 1.16 0.00 0.10 0.00 0.00 66.02 67.89 3d8y s SER 22 CO 0.80 -1.05 1.84 0.77 0.98 0.00 0.00 173.24 176.58 3d8y h SER 23 N 2.34 0.00 0.02 7.02 4.64 -1.93 -3.12 113.55 122.52 3d8y h SER 23 Ca -0.30 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.02 3d8y h SER 23 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 3d8y h SER 23 CO 0.43 0.00 -0.07 -3.20 -0.87 0.00 0.00 176.83 173.12 3d8y n ASN 24 N -2.63 1.81 -0.14 4.97 5.15 -1.26 -4.29 115.26 118.86 3d8y n ASN 24 Ca 0.01 -1.53 -0.05 0.00 -0.60 0.00 0.00 54.58 52.42 3d8y n ASN 24 Cb 0.27 0.05 0.01 0.00 -0.53 0.00 0.00 39.78 39.58 3d8y n ASN 24 CO 0.00 0.00 0.00 0.22 1.40 0.00 0.00 177.26 178.88 3d8y h TYR 25 N 2.74 -0.60 -0.30 1.20 3.20 -1.95 -2.54 116.97 118.71 3d8y h TYR 25 Ca 0.00 0.05 -0.03 0.00 3.14 0.00 0.00 58.73 61.89 3d8y h TYR 25 Cb 0.63 0.34 -0.01 0.00 1.54 0.00 0.00 36.73 39.22 3d8y h TYR 25 CO 0.00 -0.31 0.05 0.00 -1.64 0.00 0.00 178.16 176.26 3d8y h ASN 27 N 0.32 -0.06 -0.12 0.00 2.35 -1.78 0.19 115.58 116.48 3d8y h ASN 27 Ca 0.09 0.14 -0.06 0.00 -0.55 0.00 0.00 56.30 55.92 3d8y h ASN 27 Cb 0.33 0.20 -0.00 0.00 0.05 0.00 0.00 38.32 38.91 3d8y h ASN 27 CO 0.01 -0.04 -0.15 -0.61 -1.65 0.00 0.00 177.43 174.98 3d8y h GLN 28 N 0.23 0.32 -0.27 0.81 -0.00 -1.20 -3.06 115.11 111.95 3d8y h GLN 28 Ca 0.37 -0.18 -0.18 0.00 -0.00 0.00 0.00 58.65 58.66 3d8y h GLN 28 Cb 0.61 0.01 0.00 0.00 0.00 0.00 0.00 27.48 28.10 3d8y h GLN 28 CO -0.49 0.74 -0.54 0.52 0.00 0.00 0.00 178.83 179.06 3d8y h MET 29 N -0.08 0.85 -0.41 1.69 2.86 -0.52 -1.47 114.93 117.85 3d8y h MET 29 Ca 0.02 -0.55 -0.02 0.00 -2.06 0.00 0.00 59.70 57.09 3d8y h MET 29 Cb 0.70 0.07 -0.02 0.00 0.06 0.00 0.00 31.60 32.40 3d8y h MET 29 CO 0.04 1.18 0.17 0.52 1.06 0.00 0.00 176.91 179.88 3d8y h MET 30 N 0.62 0.57 0.18 1.72 2.86 -0.74 -1.56 114.93 118.58 3d8y h MET 30 Ca 0.01 -0.07 -0.01 0.00 -2.06 0.00 0.00 59.70 57.57 3d8y h MET 30 Cb 1.15 -0.11 0.00 0.00 0.06 0.00 0.00 31.60 32.70 3d8y h MET 30 CO 0.12 0.47 -0.08 -0.22 1.06 0.00 0.00 176.91 178.25 3d8y h LYS 31 N 0.58 -0.23 0.00 1.72 3.64 -1.41 -0.34 116.57 120.53 3d8y h LYS 31 Ca 0.14 0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.54 3d8y h LYS 31 Cb 0.10 0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 31.97 3d8y h LYS 31 CO -0.02 0.14 -0.01 0.66 -2.27 0.00 0.00 179.45 177.96 3d8y h SER 32 N -0.66 0.00 -0.62 4.20 4.64 -0.98 -1.48 113.55 118.65 3d8y h SER 32 Ca -0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 3d8y h SER 32 Cb 0.48 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.57 3d8y h SER 32 CO 0.04 0.01 0.00 0.54 -0.87 0.00 0.00 176.83 176.55 3d8y n ARG 33 N -3.11 2.89 -2.49 4.77 5.12 -0.61 -4.94 116.66 118.28 3d8y n ARG 33 Ca -0.00 -2.42 -0.15 0.00 -1.93 0.00 0.00 57.85 53.35 3d8y n ARG 33 Cb 0.27 -1.64 0.01 0.00 -1.16 0.00 0.00 32.46 29.94 3d8y n ARG 33 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 3d8y n ASN 34 N 1.23 -4.62 -1.50 0.55 3.02 -0.56 -4.85 115.26 108.54 3d8y n ASN 34 Ca 0.22 -0.09 0.10 0.00 -0.03 0.00 0.00 54.58 54.78 3d8y n ASN 34 Cb 0.65 -3.65 0.35 0.00 -0.61 0.00 0.00 39.78 36.52 3d8y n ASN 34 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 3d8y n LEU 35 N -2.45 4.47 -0.08 3.41 4.77 -0.14 -3.97 117.00 123.00 3d8y n LEU 35 Ca -0.14 -2.27 0.02 0.00 -0.03 0.00 0.00 56.01 53.59 3d8y n LEU 35 Cb 0.61 -0.55 0.02 0.00 -2.33 0.00 0.00 43.42 41.18 3d8y n LEU 35 CO 0.26 0.89 0.40 0.35 -1.33 0.00 0.00 177.39 177.95 3d8y n THR 36 N 1.34 0.71 0.39 -5.08 -2.24 -1.20 -1.66 114.28 106.55 3d8y n THR 36 Ca 0.25 -0.77 -0.18 0.00 -2.27 0.00 0.00 64.05 61.08 3d8y n THR 36 Cb 0.79 0.52 -0.09 0.00 -2.10 0.00 0.00 70.33 69.45 3d8y n THR 36 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 3d8y h LYS 37 N 0.00 -0.96 0.00 -0.78 3.11 -1.89 -3.39 116.57 112.66 3d8y h LYS 37 Ca 0.00 0.07 -0.16 0.00 -2.81 0.00 0.00 60.65 57.75 3d8y h LYS 37 Cb 0.87 0.22 -0.03 0.00 -1.00 0.00 0.00 32.23 32.29 3d8y h LYS 37 CO 0.00 -0.62 -1.69 -0.25 -2.81 0.00 0.00 179.45 174.08 3d8y n ASP 38 N -5.48 2.37 -3.95 4.20 8.00 -1.26 -5.04 116.55 115.38 3d8y n ASP 38 Ca -0.14 0.00 -0.09 0.00 0.71 0.00 0.00 54.79 55.27 3d8y n ASP 38 Cb 0.41 0.91 -0.07 0.00 -0.02 0.00 0.00 41.12 42.34 3d8y n ASP 38 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3d8y s ARG 39 N -2.36 1.06 -0.35 -1.24 1.04 -1.26 -5.05 118.95 110.79 3d8y s ARG 39 Ca -0.05 -1.15 -0.27 0.00 -1.04 0.00 0.00 55.73 53.22 3d8y s ARG 39 Cb 0.04 0.36 0.02 0.00 -2.04 0.00 0.00 34.95 33.32 3d8y s ARG 39 CO 0.44 -0.37 0.98 0.00 -0.04 0.00 0.00 175.30 176.32 3d8y s LYS 41 N 3.55 4.00 0.16 0.00 2.20 -0.66 -4.91 119.74 124.07 3d8y s LYS 41 Ca 0.41 2.13 -0.13 0.00 -0.36 0.00 0.00 55.97 58.03 3d8y s LYS 41 Cb -0.12 -4.06 0.04 0.00 -1.51 0.00 0.00 37.83 32.18 3d8y s LYS 41 CO 0.17 -1.07 1.66 -1.35 -0.36 0.00 0.00 175.35 174.40 3d8y h PRO 42 N 10.45 0.84 -3.82 4.03 0.11 -1.94 -3.44 132.00 138.23 3d8y h PRO 42 Ca -0.40 -0.20 -0.33 0.00 0.11 0.00 0.00 66.00 65.18 3d8y h PRO 42 Cb 1.19 -0.11 -0.32 0.00 0.11 0.00 0.00 31.00 31.86 3d8y h PRO 42 CO 0.96 0.80 -0.75 0.08 -0.21 0.00 0.00 178.00 178.89 3d8y s VAL 43 N -5.30 0.20 -0.23 3.15 1.01 -1.26 -0.66 120.40 117.32 3d8y s VAL 43 Ca -0.13 0.02 -0.16 0.00 0.00 0.00 0.00 61.98 61.72 3d8y s VAL 43 Cb 0.12 -0.26 0.07 0.00 0.00 0.00 0.00 36.38 36.30 3d8y s VAL 43 CO 0.80 0.13 0.58 0.21 0.00 0.00 0.00 175.10 176.82 3d8y s ASN 44 N 0.72 -0.73 -0.13 3.32 2.47 -0.23 -5.03 114.94 115.34 3d8y s ASN 44 Ca -0.07 1.24 -0.04 0.00 0.42 0.00 0.00 52.86 54.42 3d8y s ASN 44 Cb -0.10 1.16 -0.03 0.00 -1.45 0.00 0.00 41.25 40.83 3d8y s ASN 44 CO -0.01 -0.22 0.00 -0.89 -3.72 0.00 0.00 177.10 172.26 3d8y s THR 45 N 1.16 4.28 -0.09 -5.21 2.01 -1.26 -1.09 115.64 115.45 3d8y s THR 45 Ca -0.07 -0.24 -0.01 0.00 0.31 0.00 0.00 61.69 61.68 3d8y s THR 45 Cb -0.06 -2.85 -0.03 0.00 0.01 0.00 0.00 72.50 69.57 3d8y s THR 45 CO -0.12 0.54 -0.02 -0.36 -0.69 0.00 0.00 174.62 173.98 3d8y s PHE 46 N -0.26 3.08 -0.21 4.92 0.08 -0.27 -4.36 117.98 120.96 3d8y s PHE 46 Ca 0.06 0.11 -0.06 0.00 0.12 0.00 0.00 56.93 57.16 3d8y s PHE 46 Cb -0.12 -1.78 -0.03 0.00 -0.57 0.00 0.00 43.02 40.52 3d8y s PHE 46 CO 0.02 0.39 0.03 0.08 -0.10 0.00 0.00 175.22 175.64 3d8y s VAL 47 N -0.76 4.22 -1.06 -0.44 1.01 0.13 -0.63 120.40 122.87 3d8y s VAL 47 Ca 0.12 -0.22 -0.02 0.00 0.00 0.00 0.00 61.98 61.86 3d8y s VAL 47 Cb -0.11 -2.93 0.31 0.00 0.00 0.00 0.00 36.38 33.65 3d8y s VAL 47 CO 0.02 0.40 1.75 1.41 0.00 0.00 0.00 175.10 178.68 3d8y n HIS 48 N 4.33 2.60 -4.27 5.22 -0.00 0.12 -1.18 115.22 122.04 3d8y n HIS 48 Ca -0.17 -2.57 -0.15 0.00 -0.00 0.00 0.00 57.72 54.83 3d8y n HIS 48 Cb 0.52 -1.24 -0.10 0.00 -0.00 0.00 0.00 29.99 29.17 3d8y n HIS 48 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.34 175.13 3d8y s GLU 49 N -3.73 1.36 0.57 -0.41 0.41 -1.26 -4.45 118.70 111.19 3d8y s GLU 49 Ca 0.37 -1.73 -0.20 0.00 -0.41 0.00 0.00 54.97 53.00 3d8y s GLU 49 Cb 0.15 0.02 -0.04 0.00 -1.78 0.00 0.00 34.13 32.47 3d8y s GLU 49 CO -0.06 -0.37 1.24 -1.54 -0.49 0.00 0.00 175.26 174.05 3d8y s SER 50 N -3.26 5.26 0.26 -0.19 1.04 -1.26 -4.23 113.70 111.32 3d8y s SER 50 Ca 0.38 2.48 -0.02 0.00 0.48 0.00 0.00 55.95 59.27 3d8y s SER 50 Cb 0.07 -2.61 0.44 0.00 0.10 0.00 0.00 66.02 64.02 3d8y s SER 50 CO 0.14 -1.56 1.83 0.25 0.98 0.00 0.00 173.24 174.88 3d8y h LEU 51 N 1.11 0.79 -0.63 2.42 5.85 -1.97 -2.16 115.31 120.71 3d8y h LEU 51 Ca -0.50 0.04 0.06 0.00 0.84 0.00 0.00 57.88 58.32 3d8y h LEU 51 Cb 1.30 -0.11 -0.06 0.00 0.37 0.00 0.00 40.66 42.16 3d8y h LEU 51 CO 0.56 0.45 0.33 0.00 -0.34 0.00 0.00 178.44 179.44 3d8y h ALA 52 N 1.48 0.83 -0.71 1.25 0.00 -1.98 0.13 119.26 120.26 3d8y h ALA 52 Ca 0.43 0.03 -0.07 0.00 0.00 0.00 0.00 54.91 55.30 3d8y h ALA 52 Cb 0.38 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 3d8y h ALA 52 CO -0.24 -0.02 0.17 -0.44 0.00 0.00 0.00 179.25 178.71 3d8y h ASP 53 N 0.61 1.08 -0.15 0.00 5.19 -1.80 -0.66 116.42 120.70 3d8y h ASP 53 Ca 0.29 -0.23 -0.08 0.00 -0.62 0.00 0.00 57.03 56.38 3d8y h ASP 53 Cb 0.21 -0.28 -0.00 0.00 0.18 0.00 0.00 39.33 39.44 3d8y h ASP 53 CO -0.20 1.03 -0.24 0.58 -3.12 0.00 0.00 179.24 177.30 3d8y h VAL 54 N 1.07 1.36 -0.50 -1.35 2.07 -1.10 -3.00 116.25 114.81 3d8y h VAL 54 Ca 0.22 -1.48 0.04 0.00 0.82 0.00 0.00 66.70 66.30 3d8y h VAL 54 Cb 0.38 1.97 -0.03 0.00 -1.52 0.00 0.00 31.29 32.09 3d8y h VAL 54 CO 0.00 0.44 0.33 1.56 0.02 0.00 0.00 177.57 179.93 3d8y h GLN 55 N 0.03 0.52 0.00 1.57 4.20 -0.67 -1.58 115.11 119.19 3d8y h GLN 55 Ca 0.01 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 58.68 3d8y h GLN 55 Cb 0.82 -0.12 -0.00 0.00 0.30 0.00 0.00 27.48 28.48 3d8y h GLN 55 CO 0.05 0.34 -0.03 0.00 -0.67 0.00 0.00 178.83 178.53 3d8y h ALA 56 N 1.72 1.13 -0.09 3.87 0.00 -0.97 -2.39 119.26 122.53 3d8y h ALA 56 Ca 0.21 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 55.12 3d8y h ALA 56 Cb 0.15 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 3d8y h ALA 56 CO -0.05 0.03 0.08 0.28 0.00 0.00 0.00 179.25 179.59 3d8y h VAL 57 N 0.00 0.69 0.00 0.00 2.07 -1.26 -0.52 116.25 117.22 3d8y h VAL 57 Ca -0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 3d8y h VAL 57 Cb 0.16 0.94 0.00 0.00 -1.52 0.00 0.00 31.29 30.87 3d8y h VAL 57 CO 0.00 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.59 3d8y n SER 59 N -1.47 3.15 0.00 0.00 3.41 -0.20 -5.00 113.62 113.50 3d8y n SER 59 Ca 0.02 -2.83 0.00 0.00 -0.26 0.00 0.00 58.87 55.80 3d8y n SER 59 Cb 0.07 -0.43 0.00 0.00 -0.26 0.00 0.00 64.21 63.59 3d8y n SER 59 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3d8y n GLN 60 N -0.66 0.86 -2.64 4.33 6.02 -0.10 -5.00 117.38 120.18 3d8y n GLN 60 Ca 0.17 0.00 -0.43 0.00 -0.01 0.00 0.00 57.00 56.73 3d8y n GLN 60 Cb 0.71 0.00 -0.02 0.00 1.02 0.00 0.00 30.24 31.94 3d8y n GLN 60 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 3d8y s LYS 61 N 4.29 3.65 0.10 -1.09 2.20 -0.95 -4.89 119.74 123.05 3d8y s LYS 61 Ca 0.00 0.43 -0.31 0.00 -0.36 0.00 0.00 55.97 55.73 3d8y s LYS 61 Cb 0.00 -3.93 -0.07 0.00 -1.51 0.00 0.00 37.83 32.32 3d8y s LYS 61 CO 0.00 -1.39 1.37 1.21 -0.36 0.00 0.00 175.35 176.18 3d8y s ASN 62 N 2.49 6.85 0.06 1.43 3.04 -1.26 -0.32 114.94 127.23 3d8y s ASN 62 Ca 0.45 2.27 -0.02 0.00 0.04 0.00 0.00 52.86 55.60 3d8y s ASN 62 Cb -0.08 -2.58 -0.03 0.00 -1.54 0.00 0.00 41.25 37.02 3d8y s ASN 62 CO 0.30 -0.64 0.01 0.68 -3.04 0.00 0.00 177.10 174.41 3d8y s VAL 63 N 1.26 0.20 0.47 -5.21 -7.23 0.15 -4.91 120.40 105.14 3d8y s VAL 63 Ca 0.64 -1.71 -0.22 0.00 -1.81 0.00 0.00 61.98 58.88 3d8y s VAL 63 Cb -0.35 -1.52 -0.07 0.00 0.56 0.00 0.00 36.38 34.99 3d8y s VAL 63 CO 0.30 -0.91 1.17 0.00 -0.31 0.00 0.00 175.10 175.35 3d8y s ALA 64 N -3.92 2.93 0.67 1.32 0.00 -1.26 -2.58 121.76 118.92 3d8y s ALA 64 Ca 0.08 0.94 -0.09 0.00 0.00 0.00 0.00 51.96 52.89 3d8y s ALA 64 Cb 0.07 -3.39 0.02 0.00 0.00 0.00 0.00 23.12 19.82 3d8y s ALA 64 CO -0.09 -0.71 1.02 0.00 0.00 0.00 0.00 175.76 175.97 3d8y h LYS 66 N -0.48 0.66 -0.07 0.00 1.57 -1.93 -0.95 116.57 115.36 3d8y h LYS 66 Ca -0.45 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.29 3d8y h LYS 66 Cb 1.26 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 33.43 3d8y h LYS 66 CO 0.62 0.43 0.00 0.27 -0.57 0.00 0.00 179.45 180.21 3d8y n ASN 67 N -4.56 0.61 0.00 0.86 0.23 -1.26 -4.90 115.26 106.24 3d8y n ASN 67 Ca 0.17 -1.63 0.00 0.00 -0.53 0.00 0.00 54.58 52.59 3d8y n ASN 67 Cb 0.48 -0.05 0.00 0.00 -2.08 0.00 0.00 39.78 38.13 3d8y n ASN 67 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3d8y n GLY 68 N 0.86 1.71 3.79 4.83 0.00 -0.36 -5.05 105.19 110.98 3d8y n GLY 68 Ca 0.12 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.83 3d8y n GLY 68 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3d8y s GLN 69 N -0.46 2.60 -0.21 1.61 -0.21 -1.26 -4.74 119.66 116.99 3d8y s GLN 69 Ca 0.00 1.06 0.13 0.00 0.02 0.00 0.00 55.36 56.57 3d8y s GLN 69 Cb 0.00 -1.94 0.43 0.00 1.00 0.00 0.00 33.01 32.50 3d8y s GLN 69 CO 0.00 -1.37 1.31 0.25 -2.12 0.00 0.00 175.29 173.36 3d8y n THR 70 N -3.33 2.26 -1.22 -0.19 -2.24 -1.26 0.53 114.28 108.83 3d8y n THR 70 Ca 0.08 -2.70 -0.18 0.00 -2.27 0.00 0.00 64.05 58.99 3d8y n THR 70 Cb 0.53 -0.27 0.21 0.00 -2.10 0.00 0.00 70.33 68.70 3d8y n THR 70 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 3d8y n ASN 71 N -1.11 3.78 -4.93 3.42 6.94 -1.26 -4.70 115.26 117.39 3d8y n ASN 71 Ca 0.23 -3.56 -0.26 0.00 -0.02 0.00 0.00 54.58 50.97 3d8y n ASN 71 Cb 0.81 -0.79 -0.03 0.00 -2.36 0.00 0.00 39.78 37.41 3d8y n ASN 71 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3d8y s TYR 73 N -1.93 -0.00 -0.17 0.00 1.51 0.29 -0.67 117.35 116.38 3d8y s TYR 73 Ca 0.38 0.15 -0.10 0.00 -1.01 0.00 0.00 57.07 56.50 3d8y s TYR 73 Cb -0.11 -0.17 -0.05 0.00 -0.11 0.00 0.00 41.96 41.53 3d8y s TYR 73 CO 0.30 -0.08 0.15 -1.14 -1.11 0.00 0.00 175.55 173.67 3d8y s GLN 74 N 0.85 4.02 0.27 -0.62 0.74 0.56 -1.54 119.66 123.93 3d8y s GLN 74 Ca -0.07 -0.16 -0.30 0.00 0.05 0.00 0.00 55.36 54.88 3d8y s GLN 74 Cb -0.10 -3.36 -0.11 0.00 1.10 0.00 0.00 33.01 30.54 3d8y s GLN 74 CO -0.03 0.41 1.50 -1.54 -0.55 0.00 0.00 175.29 175.09 3d8y s SER 75 N 0.03 6.54 0.17 6.67 1.04 0.12 -2.24 113.70 126.04 3d8y s SER 75 Ca 0.11 2.78 -0.11 0.00 0.48 0.00 0.00 55.95 59.21 3d8y s SER 75 Cb -0.12 -2.63 0.08 0.00 0.10 0.00 0.00 66.02 63.45 3d8y s SER 75 CO 0.00 -0.79 1.71 1.88 0.98 0.00 0.00 173.24 177.03 3d8y h TYR 76 N 4.95 0.95 -3.29 5.02 0.05 -1.94 -3.43 116.97 119.28 3d8y h TYR 76 Ca -0.46 -0.09 -0.51 0.00 0.05 0.00 0.00 58.73 57.72 3d8y h TYR 76 Cb 1.22 -0.28 -0.00 0.00 1.01 0.00 0.00 36.73 38.67 3d8y h TYR 76 CO 0.59 0.78 -0.09 -1.12 -1.05 0.00 0.00 178.16 177.28 3d8y s SER 77 N -6.18 6.45 0.54 3.88 0.01 -1.26 -5.04 113.70 112.10 3d8y s SER 77 Ca -0.13 0.79 -0.19 0.00 1.31 0.00 0.00 55.95 57.73 3d8y s SER 77 Cb 0.13 -2.18 -0.06 0.00 0.21 0.00 0.00 66.02 64.12 3d8y s SER 77 CO 0.81 -0.25 1.11 0.42 0.41 0.00 0.00 173.24 175.74 3d8y s THR 78 N -2.17 3.29 0.08 1.44 -4.23 -1.26 -4.42 115.64 108.37 3d8y s THR 78 Ca 0.45 0.79 0.06 0.00 -1.18 0.00 0.00 61.69 61.81 3d8y s THR 78 Cb -0.11 -3.31 -0.03 0.00 1.34 0.00 0.00 72.50 70.39 3d8y s THR 78 CO 0.31 -0.19 -0.16 -0.04 -0.54 0.00 0.00 174.62 174.00 3d8y s MET 79 N -3.34 0.91 -0.11 3.99 -1.94 0.90 -4.85 119.30 114.86 3d8y s MET 79 Ca 0.71 -0.99 -0.29 0.00 -1.71 0.00 0.00 55.69 53.40 3d8y s MET 79 Cb -0.22 -0.99 -0.04 0.00 2.01 0.00 0.00 34.83 35.59 3d8y s MET 79 CO 0.27 0.23 1.61 0.45 -0.01 0.00 0.00 175.02 177.56 3d8y s SER 80 N -1.73 6.60 0.15 3.03 0.15 -1.26 -1.50 113.70 119.14 3d8y s SER 80 Ca 0.01 2.00 0.05 0.00 0.70 0.00 0.00 55.95 58.70 3d8y s SER 80 Cb -0.10 -2.53 -0.04 0.00 -1.71 0.00 0.00 66.02 61.63 3d8y s SER 80 CO 0.03 -1.01 -0.11 0.27 1.20 0.00 0.00 173.24 173.61 3d8y s ILE 81 N 4.36 1.25 -0.15 6.45 -4.36 0.20 0.12 121.20 129.08 3d8y s ILE 81 Ca 0.71 -2.07 0.00 0.00 -0.26 0.00 0.00 60.65 59.04 3d8y s ILE 81 Cb -0.30 -1.86 0.02 0.00 1.25 0.00 0.00 42.46 41.57 3d8y s ILE 81 CO 0.28 -0.72 -0.14 -0.89 0.24 0.00 0.00 174.94 173.71 3d8y s THR 82 N -3.24 1.57 -0.16 8.37 2.01 0.20 -1.02 115.64 123.37 3d8y s THR 82 Ca 0.17 -0.63 -0.21 0.00 0.31 0.00 0.00 61.69 61.33 3d8y s THR 82 Cb 0.02 -1.48 -0.03 0.00 0.01 0.00 0.00 72.50 71.02 3d8y s THR 82 CO 0.01 0.46 0.63 -1.81 -0.69 0.00 0.00 174.62 173.22 3d8y s ASP 83 N 1.47 6.75 -0.23 3.53 1.01 0.63 -1.11 116.67 128.71 3d8y s ASP 83 Ca 0.05 0.91 -0.04 0.00 0.71 0.00 0.00 52.55 54.18 3d8y s ASP 83 Cb -0.13 -2.36 0.00 0.00 1.01 0.00 0.00 42.92 41.45 3d8y s ASP 83 CO -0.10 -0.21 -0.04 0.00 0.21 0.00 0.00 175.17 175.02 3d8y s ARG 85 N 1.45 1.34 0.36 0.00 3.52 -0.99 -1.07 118.95 123.55 3d8y s ARG 85 Ca 0.04 -0.28 -0.27 0.00 -0.13 0.00 0.00 55.73 55.10 3d8y s ARG 85 Cb -0.15 -1.20 -0.12 0.00 -1.56 0.00 0.00 34.95 31.92 3d8y s ARG 85 CO -0.03 -0.04 1.12 0.39 -0.81 0.00 0.00 175.30 175.92 3d8y n GLU 86 N 4.01 1.64 -1.45 5.12 1.02 0.17 -0.78 120.64 130.37 3d8y n GLU 86 Ca -0.23 0.58 -0.30 0.00 -0.02 0.00 0.00 57.16 57.19 3d8y n GLU 86 Cb 0.51 -2.10 0.09 0.00 -0.02 0.00 0.00 31.44 29.91 3d8y n GLU 86 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 3d8y s THR 87 N -1.15 3.36 0.49 2.62 -4.23 0.04 -4.76 115.64 112.01 3d8y s THR 87 Ca 0.59 0.44 0.22 0.00 -1.18 0.00 0.00 61.69 61.76 3d8y s THR 87 Cb -0.60 -3.10 0.27 0.00 1.34 0.00 0.00 72.50 70.42 3d8y s THR 87 CO 0.59 -0.58 2.11 1.23 -0.54 0.00 0.00 174.62 177.44 3d8y h GLY 88 N -1.05 0.00 -1.35 3.99 0.00 -1.93 -2.84 103.07 99.89 3d8y h GLY 88 Ca -0.46 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.87 3d8y h GLY 88 CO 0.56 0.00 -0.07 -1.14 0.00 0.00 0.00 176.54 175.89 3d8y n SER 89 N -4.09 2.42 -4.73 0.19 3.41 -1.26 -4.97 113.62 104.59 3d8y n SER 89 Ca -0.03 -1.76 -0.42 0.00 -0.26 0.00 0.00 58.87 56.40 3d8y n SER 89 Cb 0.17 0.07 -0.02 0.00 -0.26 0.00 0.00 64.21 64.16 3d8y n SER 89 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 3d8y s SER 90 N -2.09 6.50 -0.13 4.04 0.15 -1.07 -5.01 113.70 116.09 3d8y s SER 90 Ca 0.29 2.77 -0.04 0.00 0.70 0.00 0.00 55.95 59.67 3d8y s SER 90 Cb 0.20 -2.61 0.07 0.00 -1.71 0.00 0.00 66.02 61.96 3d8y s SER 90 CO 0.35 -0.86 0.23 -0.75 1.20 0.00 0.00 173.24 173.42 3d8y s LYS 91 N 0.41 0.12 0.25 5.44 2.20 -1.21 -4.93 119.74 122.02 3d8y s LYS 91 Ca 0.67 0.60 -0.30 0.00 -0.36 0.00 0.00 55.97 56.58 3d8y s LYS 91 Cb -0.46 -0.32 -0.14 0.00 -1.51 0.00 0.00 37.83 35.40 3d8y s LYS 91 CO 0.38 -0.36 1.15 0.98 -0.36 0.00 0.00 175.35 177.14 3d8y n TYR 92 N 5.34 1.52 1.34 4.03 9.36 -1.26 -0.50 117.16 136.99 3d8y n TYR 92 Ca -0.05 0.64 0.07 0.00 3.32 0.00 0.00 57.90 61.87 3d8y n TYR 92 Cb 0.50 -2.31 0.27 0.00 -0.63 0.00 0.00 39.34 37.17 3d8y n TYR 92 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 3d8y n PRO 93 N 1.26 1.54 -2.99 2.98 -0.04 -1.26 -4.97 135.00 131.52 3d8y n PRO 93 Ca 0.11 -0.82 -0.43 0.00 -0.04 0.00 0.00 63.50 62.32 3d8y n PRO 93 Cb 0.30 -1.28 0.01 0.00 -0.04 0.00 0.00 33.50 32.49 3d8y n PRO 93 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3d8y n ASN 94 N 0.10 6.37 -4.77 3.54 4.13 0.35 -5.03 115.26 119.94 3d8y n ASN 94 Ca 0.12 -3.40 -0.37 0.00 1.68 0.00 0.00 54.58 52.61 3d8y n ASN 94 Cb 0.23 -1.28 -0.01 0.00 -1.54 0.00 0.00 39.78 37.18 3d8y n ASN 94 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3d8y s ALA 96 N -1.51 -0.43 0.07 0.00 0.00 -1.26 -4.95 121.76 113.68 3d8y s ALA 96 Ca 0.63 0.70 0.06 0.00 0.00 0.00 0.00 51.96 53.35 3d8y s ALA 96 Cb -0.30 -0.44 -0.03 0.00 0.00 0.00 0.00 23.12 22.35 3d8y s ALA 96 CO 0.36 -0.14 -0.17 0.71 0.00 0.00 0.00 175.76 176.52 3d8y s TYR 97 N 0.74 1.46 -0.05 0.00 2.02 -1.26 -0.78 117.35 119.49 3d8y s TYR 97 Ca -0.05 -0.42 -0.11 0.00 -0.37 0.00 0.00 57.07 56.12 3d8y s TYR 97 Cb -0.07 -0.83 -0.05 0.00 -0.40 0.00 0.00 41.96 40.61 3d8y s TYR 97 CO -0.04 0.11 0.28 0.15 -1.57 0.00 0.00 175.55 174.48 3d8y s LYS 98 N -1.63 3.68 -0.23 -0.62 -0.14 0.04 -4.66 119.74 116.18 3d8y s LYS 98 Ca 0.02 0.14 -0.06 0.00 -1.36 0.00 0.00 55.97 54.71 3d8y s LYS 98 Cb -0.09 -3.19 -0.03 0.00 -1.68 0.00 0.00 37.83 32.84 3d8y s LYS 98 CO 0.03 0.72 0.04 0.99 -0.76 0.00 0.00 175.35 176.37 3d8y s THR 99 N -1.09 4.16 -0.20 2.17 2.01 -1.26 -2.36 115.64 119.08 3d8y s THR 99 Ca 0.21 -0.23 0.01 0.00 0.31 0.00 0.00 61.69 61.98 3d8y s THR 99 Cb -0.14 -2.92 0.04 0.00 0.01 0.00 0.00 72.50 69.49 3d8y s THR 99 CO 0.10 0.38 -0.10 -0.89 -0.69 0.00 0.00 174.62 173.41 3d8y s THR 100 N 1.33 1.64 0.10 -0.82 2.01 -0.49 -4.95 115.64 114.48 3d8y s THR 100 Ca 0.05 -1.00 -0.26 0.00 0.31 0.00 0.00 61.69 60.79 3d8y s THR 100 Cb -0.15 -1.71 -0.07 0.00 0.01 0.00 0.00 72.50 70.59 3d8y s THR 100 CO 0.02 0.18 0.80 -1.58 -0.69 0.00 0.00 174.62 173.35 3d8y s GLN 101 N 1.40 4.56 0.17 4.92 2.00 -1.26 -0.27 119.66 131.18 3d8y s GLN 101 Ca -0.01 1.16 -0.13 0.00 -2.00 0.00 0.00 55.36 54.38 3d8y s GLN 101 Cb -0.16 -3.32 0.01 0.00 0.80 0.00 0.00 33.01 30.34 3d8y s GLN 101 CO -0.08 0.39 0.39 0.00 -0.50 0.00 0.00 175.29 175.49 3d8y s ALA 102 N -0.50 -0.47 -0.29 1.58 0.00 -0.19 -4.97 121.76 116.93 3d8y s ALA 102 Ca 0.38 -0.54 0.03 0.00 0.00 0.00 0.00 51.96 51.83 3d8y s ALA 102 Cb -0.22 0.83 0.07 0.00 0.00 0.00 0.00 23.12 23.80 3d8y s ALA 102 CO 0.25 -0.71 -0.05 -0.80 0.00 0.00 0.00 175.76 174.45 3d8y s ASN 103 N -2.91 4.59 0.08 0.00 0.01 -1.26 -0.63 114.94 114.81 3d8y s ASN 103 Ca 0.12 -1.58 -0.04 0.00 -0.71 0.00 0.00 52.86 50.66 3d8y s ASN 103 Cb 0.01 -1.59 -0.03 0.00 0.41 0.00 0.00 41.25 40.06 3d8y s ASN 103 CO -0.02 -0.25 0.07 -0.54 -1.51 0.00 0.00 177.10 174.84 3d8y s LYS 104 N 1.07 0.75 0.32 -0.60 1.02 -0.57 -4.77 119.74 116.96 3d8y s LYS 104 Ca -0.04 -1.16 -0.27 0.00 0.02 0.00 0.00 55.97 54.52 3d8y s LYS 104 Cb -0.20 0.27 -0.09 0.00 -0.52 0.00 0.00 37.83 37.28 3d8y s LYS 104 CO -0.05 -0.19 1.06 -1.01 -0.92 0.00 0.00 175.35 174.23 3d8y s HIS 105 N -3.92 3.53 0.13 3.18 3.76 -0.15 -0.07 115.29 121.75 3d8y s HIS 105 Ca 0.09 1.71 0.03 0.00 -0.15 0.00 0.00 55.06 56.74 3d8y s HIS 105 Cb 0.07 -3.18 -0.04 0.00 1.11 0.00 0.00 32.58 30.54 3d8y s HIS 105 CO -0.09 -0.41 0.18 0.96 -0.85 0.00 0.00 174.74 174.54 3d8y s ILE 106 N -1.35 4.91 -0.15 0.60 -4.36 -1.26 -0.51 121.20 119.07 3d8y s ILE 106 Ca 0.49 -0.78 0.01 0.00 -0.26 0.00 0.00 60.65 60.10 3d8y s ILE 106 Cb -0.27 -3.47 0.02 0.00 1.25 0.00 0.00 42.46 39.99 3d8y s ILE 106 CO 0.35 -0.02 -0.15 -0.63 0.24 0.00 0.00 174.94 174.72 3d8y s ILE 107 N -1.64 1.65 0.10 8.37 1.01 0.62 -0.70 121.20 130.61 3d8y s ILE 107 Ca 0.32 -0.69 0.08 0.00 0.00 0.00 0.00 60.65 60.36 3d8y s ILE 107 Cb -0.11 -1.53 -0.03 0.00 0.01 0.00 0.00 42.46 40.80 3d8y s ILE 107 CO 0.25 0.47 -0.20 0.68 0.00 0.00 0.00 174.94 176.15 3d8y s VAL 108 N 1.36 1.64 -0.00 2.92 -7.23 -0.59 -0.36 120.40 118.14 3d8y s VAL 108 Ca 0.03 -1.54 -0.20 0.00 -1.81 0.00 0.00 61.98 58.46 3d8y s VAL 108 Cb -0.13 -1.52 -0.05 0.00 0.56 0.00 0.00 36.38 35.23 3d8y s VAL 108 CO -0.09 -0.10 0.57 0.00 -0.31 0.00 0.00 175.10 175.17 3d8y s ALA 109 N -1.24 3.51 -0.03 1.32 0.00 -0.41 -0.54 121.76 124.37 3d8y s ALA 109 Ca 0.06 0.00 0.05 0.00 0.00 0.00 0.00 51.96 52.07 3d8y s ALA 109 Cb -0.10 -2.70 -0.02 0.00 0.00 0.00 0.00 23.12 20.30 3d8y s ALA 109 CO 0.04 0.21 -0.18 0.00 0.00 0.00 0.00 175.76 175.83 3d8y s GLU 111 N -0.76 1.18 0.17 0.00 2.12 -0.66 -4.89 118.70 115.86 3d8y s GLU 111 Ca 0.11 -0.15 0.00 0.00 0.36 0.00 0.00 54.97 55.29 3d8y s GLU 111 Cb -0.10 0.55 0.00 0.00 0.26 0.00 0.00 34.13 34.83 3d8y s GLU 111 CO 0.00 -0.46 0.00 0.41 -0.54 0.00 0.00 175.26 174.68 3d8y n GLY 112 N 0.18 -2.84 2.73 -1.50 0.00 -1.26 -2.88 105.19 99.61 3d8y n GLY 112 Ca -0.18 -1.81 -0.28 0.00 0.00 0.00 0.00 46.02 43.75 3d8y n GLY 112 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3d8y s ASN 113 N -2.06 3.07 0.67 1.61 3.04 -1.26 -2.12 114.94 117.89 3d8y s ASN 113 Ca 0.00 -0.93 -0.16 0.00 0.04 0.00 0.00 52.86 51.81 3d8y s ASN 113 Cb 0.00 -0.62 0.00 0.00 -1.54 0.00 0.00 41.25 39.09 3d8y s ASN 113 CO 0.00 -0.32 1.16 -2.16 -3.04 0.00 0.00 177.10 172.74 3d8y s PRO 114 N 1.83 2.63 -0.80 0.43 0.04 -1.26 -5.08 135.00 132.79 3d8y s PRO 114 Ca 0.00 1.60 -0.24 0.00 0.04 0.00 0.00 61.00 62.40 3d8y s PRO 114 Cb -0.17 -1.91 0.05 0.00 0.04 0.00 0.00 34.50 32.51 3d8y s PRO 114 CO -0.11 -1.42 1.23 -0.47 0.04 0.00 0.00 177.00 176.27 3d8y s TYR 115 N -2.07 2.50 0.21 0.56 5.04 -0.90 -4.85 117.35 117.83 3d8y s TYR 115 Ca 0.71 -0.46 0.05 0.00 -2.44 0.00 0.00 57.07 54.93 3d8y s TYR 115 Cb -0.25 -4.54 -0.05 0.00 0.35 0.00 0.00 41.96 37.47 3d8y s TYR 115 CO 0.40 -1.90 -0.06 0.14 -1.34 0.00 0.00 175.55 172.79 3d8y s VAL 116 N 4.92 1.24 0.26 3.14 -7.23 -1.14 -4.83 120.40 116.77 3d8y s VAL 116 Ca 0.34 -2.08 -0.30 0.00 -1.81 0.00 0.00 61.98 58.14 3d8y s VAL 116 Cb -0.08 -2.16 -0.11 0.00 0.56 0.00 0.00 36.38 34.59 3d8y s VAL 116 CO 0.06 -0.49 1.51 -2.84 -0.31 0.00 0.00 175.10 173.04 3d8y s PRO 117 N -3.78 4.20 0.00 4.82 0.02 -1.26 -1.66 135.00 137.35 3d8y s PRO 117 Ca 0.24 2.42 0.00 0.00 0.02 0.00 0.00 61.00 63.68 3d8y s PRO 117 Cb 0.04 -3.08 0.00 0.00 0.02 0.00 0.00 34.50 31.48 3d8y s PRO 117 CO 0.06 -0.52 0.04 1.33 -0.33 0.00 0.00 177.00 177.58 3d8y n VAL 118 N 2.43 0.00 -3.73 3.83 0.24 0.53 -4.42 118.33 117.21 3d8y n VAL 118 Ca 0.08 -0.41 -0.13 0.00 -2.04 0.00 0.00 64.34 61.84 3d8y n VAL 118 Cb 0.39 1.02 -0.10 0.00 -1.47 0.00 0.00 33.84 33.68 3d8y n VAL 118 CO 0.00 0.00 0.00 -1.00 -2.14 0.00 0.00 176.83 173.69 3d8y s HIS 119 N -0.73 -0.42 -0.40 6.34 3.76 -1.19 -4.69 115.29 117.97 3d8y s HIS 119 Ca 0.00 0.96 -0.16 0.00 -0.15 0.00 0.00 55.06 55.71 3d8y s HIS 119 Cb 0.00 0.16 0.01 0.00 1.11 0.00 0.00 32.58 33.86 3d8y s HIS 119 CO 0.00 -0.27 0.37 0.12 -0.85 0.00 0.00 174.74 174.11 3d8y s PHE 120 N -0.12 3.20 -0.16 1.40 2.19 -1.26 -1.28 117.98 121.94 3d8y s PHE 120 Ca -0.03 -0.39 -0.26 0.00 0.33 0.00 0.00 56.93 56.58 3d8y s PHE 120 Cb -0.03 -2.74 -0.24 0.00 -1.31 0.00 0.00 43.02 38.70 3d8y s PHE 120 CO 0.02 -0.61 0.60 0.22 1.83 0.00 0.00 175.22 177.28 3d8y h ASP 121 N 8.64 0.00 -5.12 6.13 3.58 -1.05 -3.49 116.42 125.12 3d8y h ASP 121 Ca -0.27 -0.84 0.21 0.00 0.42 0.00 0.00 57.03 56.55 3d8y h ASP 121 Cb 1.12 0.00 -0.12 0.00 1.72 0.00 0.00 39.33 42.05 3d8y h ASP 121 CO 0.75 1.14 0.63 0.00 -2.88 0.00 0.00 179.24 178.87 3d8y s ALA 122 N -2.27 -1.91 0.02 -0.78 0.00 -1.04 -4.97 121.76 110.81 3d8y s ALA 122 Ca -0.22 0.70 0.06 0.00 0.00 0.00 0.00 51.96 52.51 3d8y s ALA 122 Cb -0.00 0.40 -0.03 0.00 0.00 0.00 0.00 23.12 23.49 3d8y s ALA 122 CO 0.65 -0.90 -0.17 -1.54 0.00 0.00 0.00 175.76 173.80 3d8y s SER 123 N -2.73 3.84 0.00 0.00 1.04 -1.26 -0.27 113.70 114.31 3d8y s SER 123 Ca 0.11 -0.37 0.00 0.00 0.48 0.00 0.00 55.95 56.16 3d8y s SER 123 Cb 0.00 -0.66 0.00 0.00 0.10 0.00 0.00 66.02 65.47 3d8y s SER 123 CO -0.03 0.28 0.37 1.33 0.98 0.00 0.00 173.24 176.17