#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uen n SER 2 N 0.00 0.00 -0.63 1.61 7.64 -1.26 -5.19 113.62 115.80 1uen n SER 2 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1uen n SER 2 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1uen n SER 2 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1uen n SER 3 N 0.00 -3.45 0.00 6.43 7.64 -1.26 -5.14 113.62 117.85 1uen n SER 3 Ca 0.00 0.71 0.00 0.00 1.01 0.00 0.00 58.87 60.59 1uen n SER 3 Cb 0.00 -1.40 0.00 0.00 -1.01 0.00 0.00 64.21 61.80 1uen n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1uen n GLY 4 N -1.82 -0.29 0.84 0.23 0.00 -1.26 -5.16 105.19 97.73 1uen n GLY 4 Ca 0.00 -1.27 0.10 0.00 0.00 0.00 0.00 46.02 44.85 1uen n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1uen n SER 5 N 0.30 -4.71 0.00 1.61 7.64 -1.26 -5.15 113.62 112.04 1uen n SER 5 Ca 0.00 0.77 0.00 0.00 1.01 0.00 0.00 58.87 60.65 1uen n SER 5 Cb 0.00 -2.83 0.00 0.00 -1.01 0.00 0.00 64.21 60.37 1uen n SER 5 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1uen n SER 6 N -3.43 0.00 0.00 6.43 7.64 -1.26 -5.19 113.62 117.81 1uen n SER 6 Ca -0.05 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.83 1uen n SER 6 Cb 0.40 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.60 1uen n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1uen n GLY 7 N -0.03 2.20 0.00 0.23 0.00 -1.26 -5.18 105.19 101.15 1uen n GLY 7 Ca 0.00 -2.06 0.00 0.00 0.00 0.00 0.00 46.02 43.96 1uen n GLY 7 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1uen n HIS 8 N -1.36 0.00 -4.05 1.61 -0.00 -1.26 -5.18 115.22 104.99 1uen n HIS 8 Ca 0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 57.72 57.61 1uen n HIS 8 Cb 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 29.99 29.94 1uen n HIS 8 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.34 174.80 1uen s SER 9 N -2.75 0.26 -1.14 0.26 1.04 -1.26 -5.00 113.70 105.11 1uen s SER 9 Ca 0.00 -1.17 -0.02 0.00 0.48 0.00 0.00 55.95 55.23 1uen s SER 9 Cb 0.00 0.59 -0.03 0.00 0.10 0.00 0.00 66.02 66.69 1uen s SER 9 CO 0.00 -1.17 0.97 0.61 0.98 0.00 0.00 173.24 174.62 1uen n GLY 10 N -0.43 -0.69 2.54 7.32 0.00 -1.26 -5.00 105.19 107.68 1uen n GLY 10 Ca -0.01 0.30 -0.29 0.00 0.00 0.00 0.00 46.02 46.02 1uen n GLY 10 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1uen s GLU 11 N -4.98 0.32 -0.06 1.61 -1.05 -1.26 -5.05 118.70 108.24 1uen s GLU 11 Ca 0.19 -0.77 -0.25 0.00 -0.15 0.00 0.00 54.97 53.98 1uen s GLU 11 Cb -0.02 -1.27 -0.24 0.00 -0.44 0.00 0.00 34.13 32.15 1uen s GLU 11 CO 0.73 -1.06 0.99 0.22 0.95 0.00 0.00 175.26 177.09 1uen h ASP 12 N 8.05 0.18 -3.02 0.83 3.58 -1.93 -3.50 116.42 120.61 1uen h ASP 12 Ca -0.13 -0.81 0.00 0.00 0.42 0.00 0.00 57.03 56.51 1uen h ASP 12 Cb 1.00 -0.06 0.00 0.00 1.72 0.00 0.00 39.33 41.99 1uen h ASP 12 CO 0.40 0.97 -0.24 0.18 -2.88 0.00 0.00 179.24 177.67 1uen n LEU 13 N -4.52 -1.22 -4.79 2.28 4.77 -1.24 -4.79 117.00 107.48 1uen n LEU 13 Ca -0.10 1.30 -0.33 0.00 -0.03 0.00 0.00 56.01 56.86 1uen n LEU 13 Cb 0.50 -1.94 0.03 0.00 -2.33 0.00 0.00 43.42 39.68 1uen n LEU 13 CO 0.38 -0.06 0.73 -2.16 -1.33 0.00 0.00 177.39 174.95 1uen s PRO 14 N -1.91 3.06 -0.09 3.23 0.04 -1.22 -4.59 135.00 133.52 1uen s PRO 14 Ca 0.00 1.26 0.05 0.00 0.04 0.00 0.00 61.00 62.35 1uen s PRO 14 Cb 0.00 -1.99 -0.09 0.00 0.04 0.00 0.00 34.50 32.46 1uen s PRO 14 CO 0.00 -1.03 -0.02 -1.33 0.04 0.00 0.00 177.00 174.66 1uen n MET 15 N -2.30 1.71 -4.27 4.56 2.81 0.16 -4.53 117.12 115.25 1uen n MET 15 Ca 0.09 0.02 -0.19 0.00 -1.81 0.00 0.00 57.70 55.82 1uen n MET 15 Cb 0.53 -1.21 -0.08 0.00 -0.71 0.00 0.00 33.22 31.74 1uen n MET 15 CO 0.00 0.00 0.00 0.14 1.51 0.00 0.00 175.97 177.62 1uen s VAL 16 N -2.20 0.00 0.07 2.03 -7.23 -1.26 -4.71 120.40 107.10 1uen s VAL 16 Ca -0.08 -1.98 0.10 0.00 -1.81 0.00 0.00 61.98 58.21 1uen s VAL 16 Cb 0.03 -2.51 -0.03 0.00 0.56 0.00 0.00 36.38 34.43 1uen s VAL 16 CO 0.30 0.00 -0.27 0.00 -0.31 0.00 0.00 175.10 174.82 1uen s ALA 17 N -3.47 2.29 -0.00 1.32 0.00 -1.25 -4.26 121.76 116.38 1uen s ALA 17 Ca 0.40 -1.33 -0.30 0.00 0.00 0.00 0.00 51.96 50.73 1uen s ALA 17 Cb 0.03 -0.45 -0.05 0.00 0.00 0.00 0.00 23.12 22.65 1uen s ALA 17 CO 0.26 0.53 1.33 -1.25 0.00 0.00 0.00 175.76 176.63 1uen s PRO 18 N -1.47 4.32 0.16 0.00 0.04 -1.26 -4.89 135.00 131.90 1uen s PRO 18 Ca 0.12 1.87 -0.00 0.00 0.04 0.00 0.00 61.00 63.03 1uen s PRO 18 Cb -0.10 -3.53 0.03 0.00 0.04 0.00 0.00 34.50 30.94 1uen s PRO 18 CO 0.03 -0.51 0.22 0.41 0.04 0.00 0.00 177.00 177.20 1uen n GLY 19 N 3.52 0.54 4.12 0.56 0.00 -1.26 -4.53 105.19 108.14 1uen n GLY 19 Ca 0.12 -1.94 -0.45 0.00 0.00 0.00 0.00 46.02 43.75 1uen n GLY 19 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1uen n ASN 20 N -3.00 -3.37 -4.77 1.61 5.15 -1.26 -1.55 115.26 108.07 1uen n ASN 20 Ca 0.04 -1.30 -0.38 0.00 -0.60 0.00 0.00 54.58 52.33 1uen n ASN 20 Cb 0.13 -1.64 -0.04 0.00 -0.53 0.00 0.00 39.78 37.70 1uen n ASN 20 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 1uen s VAL 21 N -3.66 3.59 -0.29 3.44 1.01 -1.26 -4.07 120.40 119.16 1uen s VAL 21 Ca 0.42 1.40 0.01 0.00 0.00 0.00 0.00 61.98 63.82 1uen s VAL 21 Cb -0.23 -3.82 0.15 0.00 0.00 0.00 0.00 36.38 32.48 1uen s VAL 21 CO 0.98 0.19 0.37 0.00 0.00 0.00 0.00 175.10 176.63 1uen s ARG 22 N -1.97 0.38 -0.12 2.72 3.03 0.04 -4.95 118.95 118.07 1uen s ARG 22 Ca 0.51 0.05 -0.03 0.00 2.03 0.00 0.00 55.73 58.29 1uen s ARG 22 Cb -0.27 -0.44 -0.03 0.00 -1.03 0.00 0.00 34.95 33.18 1uen s ARG 22 CO 0.34 -1.02 -0.00 0.54 -1.13 0.00 0.00 175.30 174.03 1uen s VAL 23 N 2.48 4.23 -0.05 4.99 0.11 -1.26 -0.67 120.40 130.22 1uen s VAL 23 Ca 0.10 -0.26 0.05 0.00 -2.93 0.00 0.00 61.98 58.94 1uen s VAL 23 Cb -0.13 -2.82 -0.01 0.00 -1.53 0.00 0.00 36.38 31.89 1uen s VAL 23 CO -0.31 0.54 -0.19 0.21 -3.33 0.00 0.00 175.10 172.02 1uen s ASN 24 N -0.25 2.42 -0.58 3.54 2.47 0.18 -4.95 114.94 117.77 1uen s ASN 24 Ca 0.06 -0.40 -0.21 0.00 0.42 0.00 0.00 52.86 52.73 1uen s ASN 24 Cb -0.12 -0.67 0.07 0.00 -1.45 0.00 0.00 41.25 39.07 1uen s ASN 24 CO 0.02 0.18 0.80 -0.69 -3.72 0.00 0.00 177.10 173.69 1uen s VAL 25 N -0.02 4.61 -0.01 -5.21 1.01 -1.26 -0.23 120.40 119.30 1uen s VAL 25 Ca -0.04 -0.47 -0.23 0.00 0.00 0.00 0.00 61.98 61.25 1uen s VAL 25 Cb -0.12 -4.51 -0.15 0.00 0.00 0.00 0.00 36.38 31.60 1uen s VAL 25 CO 0.03 -1.15 1.04 0.58 0.00 0.00 0.00 175.10 175.60 1uen h VAL 26 N 5.94 0.43 -2.23 2.92 2.07 -1.66 -3.47 116.25 120.25 1uen h VAL 26 Ca -0.28 -0.61 -0.55 0.00 0.82 0.00 0.00 66.70 66.07 1uen h VAL 26 Cb 1.08 0.66 -0.13 0.00 -1.52 0.00 0.00 31.29 31.37 1uen h VAL 26 CO 1.09 0.08 -0.56 0.20 0.02 0.00 0.00 177.57 178.40 1uen s ASN 27 N -4.97 2.98 0.51 0.57 0.01 -0.04 -5.01 114.94 108.98 1uen s ASN 27 Ca -0.13 -1.51 0.15 0.00 -0.71 0.00 0.00 52.86 50.66 1uen s ASN 27 Cb 0.01 0.15 1.22 0.00 0.41 0.00 0.00 41.25 43.05 1uen s ASN 27 CO 0.45 -0.73 2.13 0.77 -1.51 0.00 0.00 177.10 178.21 1uen h SER 28 N 1.85 0.02 0.00 -1.22 4.64 -1.97 -2.87 113.55 113.99 1uen h SER 28 Ca -0.40 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.92 1uen h SER 28 Cb 1.26 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 1uen h SER 28 CO 0.68 0.04 -0.00 0.35 -0.87 0.00 0.00 176.83 177.02 1uen n THR 29 N -4.51 1.00 -3.80 2.95 -2.24 -1.26 -3.32 114.28 103.09 1uen n THR 29 Ca -0.03 -1.02 -0.25 0.00 -2.27 0.00 0.00 64.05 60.48 1uen n THR 29 Cb 0.11 0.49 -0.17 0.00 -2.10 0.00 0.00 70.33 68.66 1uen n THR 29 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1uen s LEU 30 N -1.04 0.96 0.35 3.22 2.96 -1.08 -2.46 118.68 121.58 1uen s LEU 30 Ca 0.01 -0.36 0.08 0.00 -0.22 0.00 0.00 54.13 53.64 1uen s LEU 30 Cb 0.01 -0.61 -0.04 0.00 0.50 0.00 0.00 46.19 46.06 1uen s LEU 30 CO 0.00 -0.20 0.22 0.00 -1.32 0.00 0.00 176.35 175.05 1uen s ALA 31 N 1.85 3.68 0.08 5.97 0.00 -0.65 -0.86 121.76 131.83 1uen s ALA 31 Ca 0.03 -1.80 0.06 0.00 0.00 0.00 0.00 51.96 50.25 1uen s ALA 31 Cb -0.14 -0.87 -0.04 0.00 0.00 0.00 0.00 23.12 22.08 1uen s ALA 31 CO -0.07 -0.02 -0.11 -2.00 0.00 0.00 0.00 175.76 173.56 1uen s GLU 32 N -3.93 2.17 -0.18 0.00 -6.30 0.68 -0.11 118.70 111.04 1uen s GLU 32 Ca 0.40 -0.97 -0.00 0.00 -2.50 0.00 0.00 54.97 51.90 1uen s GLU 32 Cb -0.03 -2.31 0.04 0.00 0.00 0.00 0.00 34.13 31.83 1uen s GLU 32 CO 0.24 0.53 -0.07 0.08 0.02 0.00 0.00 175.26 176.07 1uen s VAL 33 N -1.12 1.26 0.33 3.70 1.01 0.07 -0.64 120.40 125.01 1uen s VAL 33 Ca 0.19 -0.74 -0.02 0.00 0.00 0.00 0.00 61.98 61.41 1uen s VAL 33 Cb -0.11 -1.41 -0.04 0.00 0.00 0.00 0.00 36.38 34.82 1uen s VAL 33 CO 0.11 0.13 0.57 -1.00 0.00 0.00 0.00 175.10 174.91 1uen s HIS 34 N 1.57 3.50 0.34 5.22 3.76 0.15 -0.52 115.29 129.30 1uen s HIS 34 Ca 0.00 0.52 -0.05 0.00 -0.15 0.00 0.00 55.06 55.38 1uen s HIS 34 Cb -0.16 -2.03 0.01 0.00 1.11 0.00 0.00 32.58 31.52 1uen s HIS 34 CO -0.08 0.11 0.51 1.67 -0.85 0.00 0.00 174.74 176.10 1uen s TRP 35 N -2.25 0.88 -0.15 1.40 -2.14 0.40 -0.78 118.94 116.29 1uen s TRP 35 Ca 0.42 -1.17 -0.06 0.00 2.66 0.00 0.00 56.10 57.95 1uen s TRP 35 Cb -0.10 0.05 -0.04 0.00 -3.10 0.00 0.00 33.47 30.28 1uen s TRP 35 CO 0.34 -1.17 0.05 -0.51 -2.66 0.00 0.00 176.95 173.01 1uen s ASP 36 N -3.19 5.56 -0.41 -2.66 1.11 -0.59 -4.70 116.67 111.78 1uen s ASP 36 Ca 0.28 0.13 -0.28 0.00 0.18 0.00 0.00 52.55 52.86 1uen s ASP 36 Cb -0.01 -1.84 -0.01 0.00 1.07 0.00 0.00 42.92 42.13 1uen s ASP 36 CO 0.18 0.26 1.70 -2.16 1.18 0.00 0.00 175.17 176.33 1uen s PRO 37 N -0.14 3.27 0.79 8.23 0.04 -1.26 -4.07 135.00 141.86 1uen s PRO 37 Ca 0.07 1.13 -0.14 0.00 0.04 0.00 0.00 61.00 62.09 1uen s PRO 37 Cb -0.12 -4.19 0.05 0.00 0.04 0.00 0.00 34.50 30.28 1uen s PRO 37 CO 0.01 -1.94 1.00 1.33 0.04 0.00 0.00 177.00 177.45 1uen n VAL 38 N 7.28 1.98 -1.72 -0.36 0.24 -1.26 -4.89 118.33 119.60 1uen n VAL 38 Ca 0.20 -0.26 -0.42 0.00 -2.04 0.00 0.00 64.34 61.82 1uen n VAL 38 Cb 0.48 -1.07 -0.03 0.00 -1.47 0.00 0.00 33.84 31.75 1uen n VAL 38 CO 0.00 0.00 0.00 -2.65 -2.14 0.00 0.00 176.83 172.04 1uen n PRO 39 N -2.55 2.70 -0.09 7.34 -0.02 -1.26 -4.87 135.00 136.24 1uen n PRO 39 Ca 0.12 0.97 0.16 0.00 -2.02 0.00 0.00 63.50 62.73 1uen n PRO 39 Cb 0.50 -2.79 0.55 0.00 -0.02 0.00 0.00 33.50 31.75 1uen n PRO 39 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1uen h LEU 40 N 6.09 0.27 -0.92 2.45 6.46 -2.03 0.65 115.31 128.29 1uen h LEU 40 Ca -0.44 0.01 0.20 0.00 -0.12 0.00 0.00 57.88 57.53 1uen h LEU 40 Cb 1.21 -0.04 -0.11 0.00 -0.73 0.00 0.00 40.66 40.99 1uen h LEU 40 CO 0.90 0.15 0.47 0.50 -0.62 0.00 0.00 178.44 179.84 1uen h LYS 41 N 0.30 0.52 0.00 1.25 1.63 -1.99 -1.87 116.57 116.41 1uen h LYS 41 Ca 0.31 -0.03 0.00 0.00 -0.85 0.00 0.00 60.65 60.07 1uen h LYS 41 Cb 0.79 -0.12 0.00 0.00 -0.60 0.00 0.00 32.23 32.30 1uen h LYS 41 CO -0.07 0.35 0.00 0.66 -3.45 0.00 0.00 179.45 176.93 1uen h SER 42 N 0.54 0.00 0.02 4.20 4.64 -1.22 -2.10 113.55 119.63 1uen h SER 42 Ca 0.55 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.77 1uen h SER 42 Cb 0.97 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.04 1uen h SER 42 CO -0.46 0.00 -0.30 0.40 -0.87 0.00 0.00 176.83 175.60 1uen h ILE 43 N 0.00 1.27 -6.81 0.95 2.04 -1.47 0.48 117.51 113.98 1uen h ILE 43 Ca 0.00 -1.33 -0.57 0.00 1.00 0.00 0.00 64.86 63.96 1uen h ILE 43 Cb 0.29 1.45 -0.03 0.00 -0.74 0.00 0.00 36.82 37.79 1uen h ILE 43 CO 0.00 0.41 -0.99 0.54 0.00 0.00 0.00 178.15 178.12 1uen n ARG 44 N -4.10 -0.70 -1.62 2.37 1.74 -0.79 -3.42 116.66 110.14 1uen n ARG 44 Ca -0.01 0.16 0.00 0.00 -0.77 0.00 0.00 57.85 57.23 1uen n ARG 44 Cb 0.43 -3.08 0.00 0.00 -1.02 0.00 0.00 32.46 28.79 1uen n ARG 44 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1uen n GLY 45 N -2.09 0.08 3.70 -0.13 0.00 -1.26 -3.63 105.19 101.86 1uen n GLY 45 Ca -0.15 -1.63 -0.42 0.00 0.00 0.00 0.00 46.02 43.82 1uen n GLY 45 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1uen s HIS 46 N -2.48 3.47 -0.27 1.61 3.76 -1.26 -4.90 115.29 115.21 1uen s HIS 46 Ca 0.00 1.47 -0.28 0.00 -0.15 0.00 0.00 55.06 56.10 1uen s HIS 46 Cb 0.00 -3.28 -0.05 0.00 1.11 0.00 0.00 32.58 30.36 1uen s HIS 46 CO 0.00 -0.69 2.20 -1.17 -0.85 0.00 0.00 174.74 174.24 1uen s LEU 47 N 1.44 3.43 0.28 0.89 0.20 -1.26 -1.62 118.68 122.05 1uen s LEU 47 Ca 0.54 1.70 0.21 0.00 0.69 0.00 0.00 54.13 57.27 1uen s LEU 47 Cb -0.24 -3.36 0.12 0.00 -0.43 0.00 0.00 46.19 42.28 1uen s LEU 47 CO 0.25 -2.08 1.27 1.56 -0.29 0.00 0.00 176.35 177.07 1uen h GLN 48 N 15.54 0.00 0.00 1.98 1.08 -1.43 -3.45 115.11 128.83 1uen h GLN 48 Ca -0.38 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.82 1uen h GLN 48 Cb 1.24 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.67 1uen h GLN 48 CO 1.00 0.09 0.00 0.41 -0.95 0.00 0.00 178.83 179.38 1uen n GLY 49 N 1.18 -0.18 3.02 3.46 0.00 -1.22 -4.48 105.19 106.96 1uen n GLY 49 Ca 0.01 -1.55 -0.30 0.00 0.00 0.00 0.00 46.02 44.17 1uen n GLY 49 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1uen s TYR 50 N -2.57 2.29 -0.15 1.61 2.02 -0.63 -3.12 117.35 116.79 1uen s TYR 50 Ca 0.00 -1.37 -0.14 0.00 -0.37 0.00 0.00 57.07 55.20 1uen s TYR 50 Cb 0.00 -1.63 -0.05 0.00 -0.40 0.00 0.00 41.96 39.88 1uen s TYR 50 CO 0.00 -0.70 0.30 0.50 -1.57 0.00 0.00 175.55 174.08 1uen s ARG 51 N 1.45 4.21 -0.26 -0.62 3.52 -0.84 -2.08 118.95 124.33 1uen s ARG 51 Ca 0.03 0.11 -0.08 0.00 -0.13 0.00 0.00 55.73 55.66 1uen s ARG 51 Cb -0.14 -3.41 -0.03 0.00 -1.56 0.00 0.00 34.95 29.81 1uen s ARG 51 CO -0.10 0.28 0.11 0.42 -0.81 0.00 0.00 175.30 175.19 1uen s ILE 52 N 0.35 4.60 0.14 4.11 1.01 -0.73 -1.33 121.20 129.35 1uen s ILE 52 Ca 0.17 -0.09 -0.13 0.00 0.00 0.00 0.00 60.65 60.60 1uen s ILE 52 Cb -0.13 -3.18 -0.07 0.00 0.01 0.00 0.00 42.46 39.10 1uen s ILE 52 CO 0.04 0.30 0.52 -0.31 0.00 0.00 0.00 174.94 175.49 1uen s TYR 53 N 1.66 3.59 0.22 3.97 1.51 -0.05 -0.25 117.35 127.99 1uen s TYR 53 Ca 0.06 0.99 -0.18 0.00 -1.01 0.00 0.00 57.07 56.93 1uen s TYR 53 Cb -0.15 -2.32 0.03 0.00 -0.11 0.00 0.00 41.96 39.41 1uen s TYR 53 CO 0.06 0.44 0.57 1.52 -1.11 0.00 0.00 175.55 177.03 1uen s TYR 54 N -1.48 -0.12 0.03 2.71 1.13 -1.02 -0.36 117.35 118.24 1uen s TYR 54 Ca 0.37 -0.23 -0.12 0.00 -1.41 0.00 0.00 57.07 55.68 1uen s TYR 54 Cb -0.14 0.46 0.01 0.00 -1.10 0.00 0.00 41.96 41.19 1uen s TYR 54 CO 0.19 -0.99 0.26 1.67 -2.51 0.00 0.00 175.55 174.16 1uen s TRP 55 N -3.89 -0.06 0.09 -3.49 -2.14 0.44 -0.55 118.94 109.34 1uen s TRP 55 Ca 0.10 -0.06 -0.31 0.00 2.66 0.00 0.00 56.10 58.50 1uen s TRP 55 Cb -0.02 0.04 -0.08 0.00 -3.10 0.00 0.00 33.47 30.32 1uen s TRP 55 CO -0.00 -0.44 1.43 0.21 -2.66 0.00 0.00 176.95 175.49 1uen s LYS 56 N -2.22 4.29 -0.17 3.25 2.47 -1.12 -2.01 119.74 124.24 1uen s LYS 56 Ca -0.08 2.09 -0.04 0.00 -1.56 0.00 0.00 55.97 56.39 1uen s LYS 56 Cb -0.02 -3.36 -0.03 0.00 -1.46 0.00 0.00 37.83 32.97 1uen s LYS 56 CO -0.02 -0.51 -0.03 0.99 0.16 0.00 0.00 175.35 175.94 1uen s THR 57 N 1.57 3.89 -0.16 3.43 2.01 -0.97 -4.66 115.64 120.75 1uen s THR 57 Ca 0.66 -0.35 -0.00 0.00 0.31 0.00 0.00 61.69 62.30 1uen s THR 57 Cb -0.36 -2.72 0.04 0.00 0.01 0.00 0.00 72.50 69.47 1uen s THR 57 CO 0.30 0.48 -0.06 0.00 -0.69 0.00 0.00 174.62 174.64 1uen s GLN 58 N 0.52 1.51 0.30 4.92 -2.07 -1.26 -4.01 119.66 119.57 1uen s GLN 58 Ca -0.03 -0.51 -0.29 0.00 -1.82 0.00 0.00 55.36 52.71 1uen s GLN 58 Cb -0.14 -1.99 -0.11 0.00 -1.09 0.00 0.00 33.01 29.68 1uen s GLN 58 CO 0.03 -0.41 1.45 0.45 -1.32 0.00 0.00 175.29 175.49 1uen s SER 59 N 1.62 6.55 0.03 12.60 0.15 -1.26 -3.93 113.70 129.46 1uen s SER 59 Ca 0.01 2.81 0.00 0.00 0.70 0.00 0.00 55.95 59.48 1uen s SER 59 Cb -0.15 -2.64 0.00 0.00 -1.71 0.00 0.00 66.02 61.52 1uen s SER 59 CO -0.08 -0.75 0.00 -1.20 1.20 0.00 0.00 173.24 172.41 1uen n SER 60 N 1.56 -6.96 -2.93 5.45 7.64 -1.26 -5.08 113.62 112.05 1uen n SER 60 Ca 0.04 1.19 -0.14 0.00 1.01 0.00 0.00 58.87 60.97 1uen n SER 60 Cb 0.40 -3.77 0.01 0.00 -1.01 0.00 0.00 64.21 59.84 1uen n SER 60 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1uen n SER 61 N 1.21 -1.51 -4.77 6.43 7.64 -1.25 -5.14 113.62 116.23 1uen n SER 61 Ca 0.00 -3.12 -0.39 0.00 1.01 0.00 0.00 58.87 56.36 1uen n SER 61 Cb 0.00 0.82 0.00 0.00 -1.01 0.00 0.00 64.21 64.02 1uen n SER 61 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 1uen s LYS 62 N -0.24 3.87 -1.22 1.43 1.02 -1.26 -4.89 119.74 118.45 1uen s LYS 62 Ca 0.33 2.21 -0.21 0.00 0.02 0.00 0.00 55.97 58.31 1uen s LYS 62 Cb 0.23 -2.70 -0.01 0.00 -0.52 0.00 0.00 37.83 34.82 1uen s LYS 62 CO -0.17 -0.59 1.83 1.03 -0.92 0.00 0.00 175.35 176.53 1uen s ARG 63 N -2.33 3.19 -0.30 1.68 3.00 -1.26 -4.72 118.95 118.21 1uen s ARG 63 Ca 0.59 -1.52 -0.11 0.00 0.00 0.00 0.00 55.73 54.69 1uen s ARG 63 Cb -0.39 -5.37 0.15 0.00 0.00 0.00 0.00 34.95 29.34 1uen s ARG 63 CO 0.50 -3.16 0.78 1.21 0.00 0.00 0.00 175.30 174.63 1uen s ASN 64 N 5.48 -0.96 -1.18 0.23 2.47 -1.26 -5.04 114.94 114.69 1uen s ASN 64 Ca 0.61 1.14 -0.07 0.00 0.42 0.00 0.00 52.86 54.96 1uen s ASN 64 Cb 0.01 2.02 -0.02 0.00 -1.45 0.00 0.00 41.25 41.81 1uen s ASN 64 CO 0.10 -0.18 0.81 -1.14 -3.72 0.00 0.00 177.10 172.97 1uen n ARG 65 N 5.30 -3.31 -3.76 0.43 0.63 -1.26 -5.00 116.66 109.69 1uen n ARG 65 Ca -0.09 0.67 -0.17 0.00 -0.92 0.00 0.00 57.85 57.34 1uen n ARG 65 Cb 0.51 -5.14 -0.17 0.00 0.45 0.00 0.00 32.46 28.11 1uen n ARG 65 CO 0.00 0.00 0.00 0.50 -2.51 0.00 0.00 177.63 175.62 1uen s ARG 66 N -5.47 -0.00 -0.29 -0.14 6.06 -1.26 -5.13 118.95 112.71 1uen s ARG 66 Ca 0.26 0.23 0.02 0.00 -2.50 0.00 0.00 55.73 53.74 1uen s ARG 66 Cb -0.06 -0.37 0.08 0.00 0.06 0.00 0.00 34.95 34.66 1uen s ARG 66 CO 0.80 -0.22 0.00 -3.38 -2.50 0.00 0.00 175.30 170.00 1uen s HIS 67 N 1.41 2.95 0.94 5.12 -3.43 -1.26 -5.11 115.29 115.91 1uen s HIS 67 Ca -0.05 -2.32 -0.12 0.00 -0.80 0.00 0.00 55.06 51.78 1uen s HIS 67 Cb -0.13 -2.17 0.16 0.00 -1.43 0.00 0.00 32.58 29.01 1uen s HIS 67 CO -0.03 -0.88 1.09 0.42 -2.00 0.00 0.00 174.74 173.34 1uen s ILE 68 N 1.20 2.46 -0.38 -5.38 1.01 -1.26 -5.04 121.20 113.81 1uen s ILE 68 Ca 0.03 0.15 0.01 0.00 0.00 0.00 0.00 60.65 60.84 1uen s ILE 68 Cb -0.19 -2.56 0.12 0.00 0.01 0.00 0.00 42.46 39.84 1uen s ILE 68 CO -0.10 -0.20 0.17 -1.61 0.00 0.00 0.00 174.94 173.20 1uen s GLU 69 N -4.87 1.08 -0.32 2.79 2.02 -1.26 -5.09 118.70 113.05 1uen s GLU 69 Ca 0.64 -1.63 -0.18 0.00 0.02 0.00 0.00 54.97 53.82 1uen s GLU 69 Cb -0.19 -2.29 -0.01 0.00 0.10 0.00 0.00 34.13 31.74 1uen s GLU 69 CO 0.58 -1.07 0.54 0.15 0.02 0.00 0.00 175.26 175.48 1uen s LYS 70 N 0.90 3.77 0.63 1.61 1.02 -1.26 -2.78 119.74 123.62 1uen s LYS 70 Ca 0.14 0.03 0.08 0.00 0.02 0.00 0.00 55.97 56.24 1uen s LYS 70 Cb -0.21 -3.76 0.11 0.00 -0.52 0.00 0.00 37.83 33.45 1uen s LYS 70 CO -0.10 -0.57 0.87 0.15 -0.92 0.00 0.00 175.35 174.77 1uen s LYS 71 N 2.44 2.09 0.15 1.68 1.02 0.29 -4.97 119.74 122.43 1uen s LYS 71 Ca 0.21 -1.61 0.02 0.00 0.02 0.00 0.00 55.97 54.60 1uen s LYS 71 Cb -0.15 -2.57 -0.04 0.00 -0.52 0.00 0.00 37.83 34.54 1uen s LYS 71 CO 0.12 -1.07 -0.02 0.42 -0.92 0.00 0.00 175.35 173.88 1uen s ILE 72 N -2.81 0.68 0.04 2.17 -1.09 -1.26 -2.42 121.20 116.51 1uen s ILE 72 Ca 0.64 -1.97 -0.01 0.00 -2.23 0.00 0.00 60.65 57.08 1uen s ILE 72 Cb -0.05 -1.99 -0.03 0.00 -1.58 0.00 0.00 42.46 38.81 1uen s ILE 72 CO 0.41 -0.59 -0.01 -0.76 -1.23 0.00 0.00 174.94 172.76 1uen s LEU 73 N -3.13 2.28 -0.19 2.97 1.43 0.65 -4.94 118.68 117.74 1uen s LEU 73 Ca 0.20 -0.74 -0.01 0.00 -1.03 0.00 0.00 54.13 52.56 1uen s LEU 73 Cb 0.06 0.24 0.01 0.00 0.03 0.00 0.00 46.19 46.52 1uen s LEU 73 CO 0.01 -0.48 -0.14 -0.89 0.23 0.00 0.00 176.35 175.09 1uen s THR 74 N -2.79 2.62 0.07 5.49 2.01 -1.26 -1.77 115.64 120.01 1uen s THR 74 Ca -0.03 -0.75 0.05 0.00 0.31 0.00 0.00 61.69 61.27 1uen s THR 74 Cb -0.00 -2.14 -0.03 0.00 0.01 0.00 0.00 72.50 70.34 1uen s THR 74 CO -0.06 0.49 -0.15 -0.36 -0.69 0.00 0.00 174.62 173.86 1uen s PHE 75 N 1.30 1.25 0.60 4.92 0.08 -0.89 -5.01 117.98 120.23 1uen s PHE 75 Ca 0.04 -0.46 -0.10 0.00 0.12 0.00 0.00 56.93 56.53 1uen s PHE 75 Cb -0.14 -0.70 0.14 0.00 -0.57 0.00 0.00 43.02 41.75 1uen s PHE 75 CO -0.08 0.07 0.70 1.04 -0.10 0.00 0.00 175.22 176.85 1uen n GLN 76 N 1.25 -1.26 -1.44 0.44 1.13 -1.26 -1.61 117.38 114.64 1uen n GLN 76 Ca -0.21 -1.09 -0.29 0.00 -1.94 0.00 0.00 57.00 53.47 1uen n GLN 76 Cb 0.54 -0.82 0.14 0.00 0.11 0.00 0.00 30.24 30.21 1uen n GLN 76 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1uen s GLY 77 N -4.26 1.58 0.00 1.08 0.00 -1.26 -2.72 107.32 101.74 1uen s GLY 77 Ca 0.41 -0.41 0.00 0.00 0.00 0.00 0.00 44.72 44.73 1uen s GLY 77 CO 0.30 0.14 0.00 -1.14 0.00 0.00 0.00 173.10 172.40 1uen n SER 78 N -3.81 0.00 -4.62 1.64 3.41 -1.26 -4.94 113.62 104.05 1uen n SER 78 Ca 0.06 0.00 -0.37 0.00 -0.26 0.00 0.00 58.87 58.30 1uen n SER 78 Cb 0.58 -0.32 0.06 0.00 -0.26 0.00 0.00 64.21 64.27 1uen n SER 78 CO 0.00 0.00 0.00 2.29 -0.16 0.00 0.00 175.04 177.17 1uen n LYS 79 N -0.64 0.84 -0.29 4.33 0.00 -1.26 -4.92 118.16 116.22 1uen n LYS 79 Ca 0.00 0.33 0.07 0.00 -0.00 0.00 0.00 58.31 58.71 1uen n LYS 79 Cb 0.00 -2.19 0.20 0.00 -0.00 0.00 0.00 35.03 33.04 1uen n LYS 79 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.40 177.65 1uen n THR 80 N -1.87 1.55 -3.65 0.58 -2.24 -1.26 -4.95 114.28 102.44 1uen n THR 80 Ca 0.14 -1.37 -0.10 0.00 -2.27 0.00 0.00 64.05 60.44 1uen n THR 80 Cb 0.48 0.18 -0.04 0.00 -2.10 0.00 0.00 70.33 68.85 1uen n THR 80 CO 0.00 0.00 0.00 -1.38 -0.57 0.00 0.00 175.07 173.12 1uen s HIS 81 N -1.78 -0.21 0.18 4.78 0.00 -1.26 -0.45 115.29 116.55 1uen s HIS 81 Ca 0.31 -0.11 -0.05 0.00 -3.00 0.00 0.00 55.06 52.21 1uen s HIS 81 Cb 0.21 0.36 0.02 0.00 -4.00 0.00 0.00 32.58 29.18 1uen s HIS 81 CO 0.13 -0.82 0.33 0.41 -1.00 0.00 0.00 174.74 173.79 1uen n GLY 82 N -0.30 1.85 3.33 -1.38 0.00 0.32 -4.98 105.19 104.03 1uen n GLY 82 Ca -0.13 -1.24 -0.17 0.00 0.00 0.00 0.00 46.02 44.48 1uen n GLY 82 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1uen s MET 83 N -2.15 1.34 -0.58 1.61 -1.94 -1.26 -0.75 119.30 115.58 1uen s MET 83 Ca 0.09 -1.69 0.04 0.00 -1.71 0.00 0.00 55.69 52.43 1uen s MET 83 Cb -0.02 -0.53 0.15 0.00 2.01 0.00 0.00 34.83 36.44 1uen s MET 83 CO 0.07 -0.14 0.36 -0.51 -0.01 0.00 0.00 175.02 174.79 1uen s LEU 84 N -3.30 4.14 0.20 -0.03 2.01 0.84 -4.84 118.68 117.69 1uen s LEU 84 Ca 0.30 -3.32 -0.15 0.00 0.01 0.00 0.00 54.13 50.97 1uen s LEU 84 Cb 0.06 -1.49 -0.08 0.00 0.01 0.00 0.00 46.19 44.70 1uen s LEU 84 CO 0.09 -0.17 0.63 -2.16 1.01 0.00 0.00 176.35 175.75 1uen s PRO 85 N -0.67 4.04 0.00 1.29 0.04 -1.26 -1.63 135.00 136.81 1uen s PRO 85 Ca 0.21 0.60 0.00 0.00 0.04 0.00 0.00 61.00 61.85 1uen s PRO 85 Cb -0.15 -2.81 0.00 0.00 0.04 0.00 0.00 34.50 31.58 1uen s PRO 85 CO -0.08 0.39 0.00 0.41 0.04 0.00 0.00 177.00 177.76 1uen n GLY 86 N 0.50 1.22 3.99 0.56 0.00 -1.09 -5.03 105.19 105.34 1uen n GLY 86 Ca -0.02 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.76 1uen n GLY 86 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1uen s LEU 87 N 0.00 2.99 0.09 0.99 2.01 -1.03 -5.09 118.68 118.64 1uen s LEU 87 Ca 0.00 -0.39 0.10 0.00 0.01 0.00 0.00 54.13 53.85 1uen s LEU 87 Cb 0.00 -1.98 -0.04 0.00 0.01 0.00 0.00 46.19 44.19 1uen s LEU 87 CO 0.00 -1.81 -0.23 -1.61 1.01 0.00 0.00 176.35 173.70 1uen s GLU 88 N -5.10 1.69 0.81 1.70 0.41 -1.26 -4.62 118.70 112.32 1uen s GLU 88 Ca 0.66 -1.20 -0.11 0.00 -0.41 0.00 0.00 54.97 53.91 1uen s GLU 88 Cb -0.05 -2.01 0.08 0.00 -1.78 0.00 0.00 34.13 30.36 1uen s GLU 88 CO 0.44 0.49 1.09 -1.25 -0.49 0.00 0.00 175.26 175.54 1uen s PRO 89 N -1.79 2.00 -1.98 0.39 0.05 -1.21 -4.28 135.00 128.17 1uen s PRO 89 Ca 0.14 0.69 0.00 0.00 0.05 0.00 0.00 61.00 61.89 1uen s PRO 89 Cb -0.10 -1.90 0.00 0.00 0.05 0.00 0.00 34.50 32.54 1uen s PRO 89 CO 0.06 -1.69 0.00 0.34 0.05 0.00 0.00 177.00 175.76 1uen n PHE 90 N -3.49 -0.26 -4.50 0.56 7.35 -1.16 -4.90 117.46 111.06 1uen n PHE 90 Ca 0.07 0.00 -0.25 0.00 -0.76 0.00 0.00 57.45 56.51 1uen n PHE 90 Cb 0.56 -3.46 -0.10 0.00 0.35 0.00 0.00 39.48 36.83 1uen n PHE 90 CO 0.00 0.00 0.00 -1.12 -0.76 0.00 0.00 176.76 174.88 1uen s SER 91 N -2.60 3.63 0.29 -2.13 0.01 -1.26 -4.94 113.70 106.70 1uen s SER 91 Ca 0.00 -1.11 -0.12 0.00 1.31 0.00 0.00 55.95 56.03 1uen s SER 91 Cb 0.00 -0.32 -0.08 0.00 0.21 0.00 0.00 66.02 65.83 1uen s SER 91 CO 0.00 -0.09 0.66 -2.28 0.41 0.00 0.00 173.24 171.94 1uen s HIS 92 N -2.58 3.41 0.06 2.43 2.46 -1.26 -1.29 115.29 118.53 1uen s HIS 92 Ca 0.31 1.04 0.01 0.00 0.47 0.00 0.00 55.06 56.89 1uen s HIS 92 Cb -0.01 -2.40 -0.03 0.00 -0.13 0.00 0.00 32.58 30.01 1uen s HIS 92 CO 0.16 0.14 -0.06 0.71 -2.47 0.00 0.00 174.74 173.22 1uen s TYR 93 N -1.96 0.68 -0.04 3.88 1.51 -0.98 -2.29 117.35 118.14 1uen s TYR 93 Ca 0.51 -0.80 0.04 0.00 -1.01 0.00 0.00 57.07 55.81 1uen s TYR 93 Cb -0.11 -0.42 -0.00 0.00 -0.11 0.00 0.00 41.96 41.32 1uen s TYR 93 CO 0.21 -0.19 -0.17 0.99 -1.11 0.00 0.00 175.55 175.28 1uen s THR 94 N -2.86 1.44 0.04 -0.71 2.01 -0.85 -2.70 115.64 112.01 1uen s THR 94 Ca 0.02 -0.72 -0.00 0.00 0.31 0.00 0.00 61.69 61.29 1uen s THR 94 Cb 0.00 -1.24 -0.03 0.00 0.01 0.00 0.00 72.50 71.25 1uen s THR 94 CO -0.04 0.41 -0.04 -1.48 -0.69 0.00 0.00 174.62 172.79 1uen s LEU 95 N 0.02 2.35 0.06 4.42 -0.00 -0.55 -0.42 118.68 124.56 1uen s LEU 95 Ca -0.03 -0.72 0.00 0.00 -0.00 0.00 0.00 54.13 53.37 1uen s LEU 95 Cb -0.11 0.10 -0.04 0.00 -0.00 0.00 0.00 46.19 46.14 1uen s LEU 95 CO 0.02 -0.41 -0.04 0.54 -0.00 0.00 0.00 176.35 176.45 1uen s ASN 96 N -2.12 0.63 0.14 1.48 4.22 0.51 -0.35 114.94 119.46 1uen s ASN 96 Ca -0.05 -0.87 0.07 0.00 -2.14 0.00 0.00 52.86 49.87 1uen s ASN 96 Cb -0.02 0.14 -0.04 0.00 1.28 0.00 0.00 41.25 42.61 1uen s ASN 96 CO -0.04 -0.48 -0.02 -0.69 -2.04 0.00 0.00 177.10 173.83 1uen s VAL 97 N -3.17 3.70 -0.05 3.54 1.01 -1.26 -0.87 120.40 123.30 1uen s VAL 97 Ca 0.02 -1.31 -0.11 0.00 0.00 0.00 0.00 61.98 60.58 1uen s VAL 97 Cb 0.02 -2.82 0.02 0.00 0.00 0.00 0.00 36.38 33.61 1uen s VAL 97 CO -0.06 -0.02 0.27 -0.60 0.00 0.00 0.00 175.10 174.68 1uen s ARG 98 N -2.68 0.48 0.11 2.72 3.52 -0.44 -0.86 118.95 121.80 1uen s ARG 98 Ca 0.26 0.05 -0.07 0.00 -0.13 0.00 0.00 55.73 55.84 1uen s ARG 98 Cb -0.10 0.22 -0.06 0.00 -1.56 0.00 0.00 34.95 33.45 1uen s ARG 98 CO 0.18 -0.10 0.38 0.14 -0.81 0.00 0.00 175.30 175.08 1uen s VAL 99 N -0.64 5.14 0.02 7.11 -7.23 -1.26 -1.98 120.40 121.56 1uen s VAL 99 Ca -0.07 0.22 0.01 0.00 -1.81 0.00 0.00 61.98 60.33 1uen s VAL 99 Cb -0.04 -3.62 -0.02 0.00 0.56 0.00 0.00 36.38 33.26 1uen s VAL 99 CO 0.02 0.16 -0.04 -0.69 -0.31 0.00 0.00 175.10 174.23 1uen s VAL 100 N -1.53 0.28 0.33 1.32 1.01 -1.18 -1.57 120.40 119.05 1uen s VAL 100 Ca 0.37 -0.71 0.04 0.00 0.00 0.00 0.00 61.98 61.68 1uen s VAL 100 Cb -0.13 -0.35 -0.02 0.00 0.00 0.00 0.00 36.38 35.89 1uen s VAL 100 CO 0.21 -0.29 0.15 -0.46 0.00 0.00 0.00 175.10 174.72 1uen n ASN 101 N 2.00 0.74 -2.18 3.32 6.94 -0.37 -1.20 115.26 124.51 1uen n ASN 101 Ca -0.20 -2.86 -0.10 0.00 -0.02 0.00 0.00 54.58 51.40 1uen n ASN 101 Cb 0.56 1.02 -0.12 0.00 -2.36 0.00 0.00 39.78 38.88 1uen n ASN 101 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1uen n GLY 102 N -0.41 2.50 2.06 4.83 0.00 -0.64 -3.07 105.19 110.46 1uen n GLY 102 Ca -0.02 -0.89 0.00 0.00 0.00 0.00 0.00 46.02 45.11 1uen n GLY 102 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1uen n LYS 103 N 2.69 0.00 -2.05 1.61 3.00 -1.26 -4.87 118.16 117.28 1uen n LYS 103 Ca 0.32 0.00 -0.00 0.00 -0.00 0.00 0.00 58.31 58.63 1uen n LYS 103 Cb 0.65 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.68 1uen n LYS 103 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1uen n GLY 104 N -1.20 0.97 3.96 3.14 0.00 -1.17 -5.03 105.19 105.86 1uen n GLY 104 Ca 0.00 -0.94 -0.22 0.00 0.00 0.00 0.00 46.02 44.86 1uen n GLY 104 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1uen s GLU 105 N -2.01 3.34 0.03 1.61 -1.05 -1.26 -1.23 118.70 118.13 1uen s GLU 105 Ca 0.05 -0.65 0.00 0.00 -0.15 0.00 0.00 54.97 54.23 1uen s GLU 105 Cb -0.00 -2.77 0.00 0.00 -0.44 0.00 0.00 34.13 30.92 1uen s GLU 105 CO 0.01 0.18 0.00 0.41 0.95 0.00 0.00 175.26 176.82 1uen n GLY 106 N -1.65 3.98 3.77 -3.83 0.00 -0.61 -4.64 105.19 102.21 1uen n GLY 106 Ca -0.05 -2.21 -0.40 0.00 0.00 0.00 0.00 46.02 43.36 1uen n GLY 106 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1uen s PRO 107 N -2.11 4.31 0.60 1.61 0.04 -1.26 -4.71 135.00 133.47 1uen s PRO 107 Ca 0.00 2.01 -0.16 0.00 0.04 0.00 0.00 61.00 62.89 1uen s PRO 107 Cb -0.00 -2.97 -0.03 0.00 0.04 0.00 0.00 34.50 31.54 1uen s PRO 107 CO 0.00 -0.15 1.08 0.00 0.04 0.00 0.00 177.00 177.97 1uen s ALA 108 N -1.23 2.67 1.20 8.56 0.00 -1.26 -3.96 121.76 127.74 1uen s ALA 108 Ca 0.51 0.50 -0.13 0.00 0.00 0.00 0.00 51.96 52.84 1uen s ALA 108 Cb -0.35 -3.27 0.30 0.00 0.00 0.00 0.00 23.12 19.80 1uen s ALA 108 CO 0.46 -0.90 1.01 -1.54 0.00 0.00 0.00 175.76 174.80 1uen s SER 109 N -2.54 0.67 0.49 0.00 1.04 -0.04 -4.77 113.70 108.54 1uen s SER 109 Ca 0.66 1.49 -0.22 0.00 0.48 0.00 0.00 55.95 58.36 1uen s SER 109 Cb -0.18 -2.31 -0.08 0.00 0.10 0.00 0.00 66.02 63.54 1uen s SER 109 CO 0.36 -4.39 1.03 -0.81 0.98 0.00 0.00 173.24 170.41 1uen n PRO 110 N -5.04 1.28 -2.54 4.02 -0.04 -1.26 -4.72 135.00 126.70 1uen n PRO 110 Ca 0.02 0.47 -0.42 0.00 -0.04 0.00 0.00 63.50 63.53 1uen n PRO 110 Cb 0.54 -2.15 -0.03 0.00 -0.04 0.00 0.00 33.50 31.83 1uen n PRO 110 CO 0.00 0.00 0.00 0.16 -0.04 0.00 0.00 175.50 175.62 1uen s ASP 111 N -0.89 6.32 0.76 3.54 1.47 -1.26 -4.64 116.67 121.96 1uen s ASP 111 Ca 0.67 0.01 -0.11 0.00 1.18 0.00 0.00 52.55 54.31 1uen s ASP 111 Cb -0.49 -2.55 0.05 0.00 -0.34 0.00 0.00 42.92 39.59 1uen s ASP 111 CO 0.53 -1.61 1.12 -0.60 0.68 0.00 0.00 175.17 175.30 1uen s ARG 112 N 5.24 2.30 0.08 2.11 6.06 0.52 -4.84 118.95 130.42 1uen s ARG 112 Ca 0.43 0.17 -0.00 0.00 -2.50 0.00 0.00 55.73 53.82 1uen s ARG 112 Cb -0.08 -2.01 -0.04 0.00 0.06 0.00 0.00 34.95 32.88 1uen s ARG 112 CO 0.23 -1.35 -0.02 0.14 -2.50 0.00 0.00 175.30 171.81 1uen s VAL 113 N -3.45 0.28 -0.27 7.11 -7.23 -1.26 -1.48 120.40 114.11 1uen s VAL 113 Ca 0.60 -1.86 -0.15 0.00 -1.81 0.00 0.00 61.98 58.77 1uen s VAL 113 Cb -0.11 -1.67 0.08 0.00 0.56 0.00 0.00 36.38 35.24 1uen s VAL 113 CO 0.49 -0.85 0.66 0.72 -0.31 0.00 0.00 175.10 175.80 1uen s PHE 114 N -3.89 -1.03 0.12 2.82 -0.71 -1.10 -4.84 117.98 109.35 1uen s PHE 114 Ca 0.12 2.05 -0.23 0.00 -1.04 0.00 0.00 56.93 57.83 1uen s PHE 114 Cb 0.07 0.61 -0.07 0.00 -1.21 0.00 0.00 43.02 42.42 1uen s PHE 114 CO -0.06 -0.52 0.70 0.54 -1.34 0.00 0.00 175.22 174.54 1uen s ASN 115 N 1.69 7.25 0.08 1.98 4.22 -1.26 -2.31 114.94 126.59 1uen s ASN 115 Ca -0.10 1.49 -0.10 0.00 -2.14 0.00 0.00 52.86 52.01 1uen s ASN 115 Cb -0.06 -2.45 -0.06 0.00 1.28 0.00 0.00 41.25 39.97 1uen s ASN 115 CO -0.19 0.22 0.40 0.42 -2.04 0.00 0.00 177.10 175.90 1uen s THR 116 N -1.02 5.10 0.00 0.54 -4.23 -0.41 -4.82 115.64 110.79 1uen s THR 116 Ca 0.33 0.43 0.00 0.00 -1.18 0.00 0.00 61.69 61.28 1uen s THR 116 Cb -0.22 -3.64 0.00 0.00 1.34 0.00 0.00 72.50 69.98 1uen s THR 116 CO 0.23 0.28 0.55 -0.81 -0.54 0.00 0.00 174.62 174.33 1uen n PRO 117 N 0.88 0.00 0.00 3.99 -0.04 -1.26 -2.97 135.00 135.60 1uen n PRO 117 Ca -0.08 0.15 0.00 0.00 -0.04 0.00 0.00 63.50 63.53 1uen n PRO 117 Cb 0.52 -1.07 0.00 0.00 -0.04 0.00 0.00 33.50 32.91 1uen n PRO 117 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1uen n GLU 118 N -0.94 0.01 -0.65 0.54 2.13 -1.26 -4.42 120.64 116.04 1uen n GLU 118 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 1uen n GLU 118 Cb 0.00 -0.01 0.00 0.00 0.27 0.00 0.00 31.44 31.70 1uen n GLU 118 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1uen n GLY 119 N -0.44 -1.35 2.75 8.31 0.00 -1.26 -4.23 105.19 108.97 1uen n GLY 119 Ca 0.00 -0.71 -0.18 0.00 0.00 0.00 0.00 46.02 45.12 1uen n GLY 119 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1uen s SER 120 N 0.00 1.72 -0.07 1.61 0.15 -1.26 -5.07 113.70 110.78 1uen s SER 120 Ca 0.00 -0.66 -0.30 0.00 0.70 0.00 0.00 55.95 55.69 1uen s SER 120 Cb 0.00 0.44 -0.08 0.00 -1.71 0.00 0.00 66.02 64.67 1uen s SER 120 CO 0.00 -0.38 2.06 0.61 1.20 0.00 0.00 173.24 176.73 1uen n GLY 121 N 5.31 1.52 3.65 9.45 0.00 -1.26 -5.00 105.19 118.86 1uen n GLY 121 Ca -0.03 0.81 -0.30 0.00 0.00 0.00 0.00 46.02 46.50 1uen n GLY 121 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1uen s PRO 122 N 5.14 0.83 -0.27 1.61 0.02 -1.26 -5.05 135.00 136.01 1uen s PRO 122 Ca 0.94 1.30 -0.01 0.00 0.02 0.00 0.00 61.00 63.25 1uen s PRO 122 Cb -0.43 -1.72 0.13 0.00 0.02 0.00 0.00 34.50 32.49 1uen s PRO 122 CO 0.41 -2.68 0.27 0.45 -0.33 0.00 0.00 177.00 175.12 1uen s SER 123 N -2.80 1.75 0.36 2.53 0.15 -1.26 -5.14 113.70 109.29 1uen s SER 123 Ca 0.66 -0.68 0.05 0.00 0.70 0.00 0.00 55.95 56.68 1uen s SER 123 Cb -0.22 0.43 -0.03 0.00 -1.71 0.00 0.00 66.02 64.49 1uen s SER 123 CO 0.59 -0.38 0.19 -0.44 1.20 0.00 0.00 173.24 174.40 1uen s SER 124 N 2.34 2.11 0.00 5.45 0.01 -1.26 -5.36 113.70 117.00 1uen s SER 124 Ca 0.09 -1.69 0.00 0.00 1.31 0.00 0.00 55.95 55.66 1uen s SER 124 Cb -0.14 0.51 0.00 0.00 0.21 0.00 0.00 66.02 66.60 1uen s SER 124 CO -0.29 -0.98 0.00 0.61 0.41 0.00 0.00 173.24 172.99