#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uen s SER 2 N 0.00 5.70 0.12 1.61 0.15 -1.26 -4.87 113.70 115.15 1uen s SER 2 Ca 0.00 -0.91 -0.25 0.00 0.70 0.00 0.00 55.95 55.49 1uen s SER 2 Cb 0.00 -2.56 0.07 0.00 -1.71 0.00 0.00 66.02 61.82 1uen s SER 2 CO 0.00 -2.23 0.74 -0.44 1.20 0.00 0.00 173.24 172.51 1uen s SER 3 N 6.73 -0.43 0.11 5.45 0.01 -1.26 -5.18 113.70 119.12 1uen s SER 3 Ca 0.60 -0.11 -0.20 0.00 1.31 0.00 0.00 55.95 57.55 1uen s SER 3 Cb -0.04 0.54 0.05 0.00 0.21 0.00 0.00 66.02 66.77 1uen s SER 3 CO -0.03 -0.90 0.50 -0.83 0.41 0.00 0.00 173.24 172.40 1uen s GLY 4 N -2.70 -0.43 0.10 3.44 0.00 -1.26 -5.08 107.32 101.39 1uen s GLY 4 Ca 0.04 0.33 0.00 0.00 0.00 0.00 0.00 44.72 45.09 1uen s GLY 4 CO -0.08 0.04 0.00 -1.26 0.00 0.00 0.00 173.10 171.80 1uen n SER 5 N -0.05 -0.86 -4.41 1.64 2.88 -1.26 -5.12 113.62 106.44 1uen n SER 5 Ca -0.17 0.45 -0.29 0.00 -1.33 0.00 0.00 58.87 57.53 1uen n SER 5 Cb 0.63 1.10 0.21 0.00 -0.75 0.00 0.00 64.21 65.39 1uen n SER 5 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1uen s SER 6 N -1.72 1.80 0.00 -3.46 0.01 -1.26 -4.96 113.70 104.11 1uen s SER 6 Ca 0.00 1.06 0.00 0.00 1.31 0.00 0.00 55.95 58.32 1uen s SER 6 Cb 0.00 -1.64 0.00 0.00 0.21 0.00 0.00 66.02 64.59 1uen s SER 6 CO 0.00 -3.63 0.00 0.61 0.41 0.00 0.00 173.24 170.63 1uen n GLY 7 N -0.72 -0.12 3.76 3.44 0.00 -1.26 -5.13 105.19 105.16 1uen n GLY 7 Ca 0.07 -0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.78 1uen n GLY 7 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1uen s HIS 8 N 0.00 2.54 0.07 1.61 5.04 -1.26 -5.09 115.29 118.20 1uen s HIS 8 Ca 0.00 1.40 -0.09 0.00 -1.54 0.00 0.00 55.06 54.83 1uen s HIS 8 Cb 0.00 -3.08 -0.00 0.00 0.04 0.00 0.00 32.58 29.54 1uen s HIS 8 CO 0.00 -1.98 0.19 0.45 -2.34 0.00 0.00 174.74 171.06 1uen s SER 9 N -3.47 0.09 0.00 9.88 0.15 -1.26 -5.00 113.70 114.09 1uen s SER 9 Ca 0.62 -0.55 0.00 0.00 0.70 0.00 0.00 55.95 56.72 1uen s SER 9 Cb -0.17 0.32 0.00 0.00 -1.71 0.00 0.00 66.02 64.46 1uen s SER 9 CO 0.56 -0.66 0.00 0.61 1.20 0.00 0.00 173.24 174.95 1uen n GLY 10 N 0.23 2.37 3.64 9.45 0.00 -1.26 -5.01 105.19 114.61 1uen n GLY 10 Ca -0.16 -0.51 -0.29 0.00 0.00 0.00 0.00 46.02 45.05 1uen n GLY 10 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1uen n GLU 11 N 0.00 -1.25 0.28 1.61 1.02 -1.26 -4.88 120.64 116.16 1uen n GLU 11 Ca 0.00 0.55 0.15 0.00 -0.02 0.00 0.00 57.16 57.84 1uen n GLU 11 Cb 0.00 -4.14 0.79 0.00 -0.02 0.00 0.00 31.44 28.08 1uen n GLU 11 CO 0.00 0.00 0.00 -0.44 1.18 0.00 0.00 177.13 177.87 1uen h ASP 12 N -1.64 0.00 -3.38 1.62 3.32 -1.95 -3.44 116.42 110.95 1uen h ASP 12 Ca -0.62 0.00 -0.52 0.00 0.02 0.00 0.00 57.03 55.90 1uen h ASP 12 Cb 1.34 0.00 0.03 0.00 0.22 0.00 0.00 39.33 40.92 1uen h ASP 12 CO 0.46 0.08 0.66 -0.76 -1.72 0.00 0.00 179.24 177.96 1uen s LEU 13 N -6.90 4.41 0.39 1.55 1.43 -1.26 -4.21 118.68 114.09 1uen s LEU 13 Ca -0.02 2.42 -0.27 0.00 -1.03 0.00 0.00 54.13 55.22 1uen s LEU 13 Cb 0.12 -3.61 -0.10 0.00 0.03 0.00 0.00 46.19 42.63 1uen s LEU 13 CO 0.55 -0.54 1.45 -2.84 0.23 0.00 0.00 176.35 175.20 1uen s PRO 14 N -0.11 4.03 -0.03 1.29 0.02 -1.26 -4.87 135.00 134.07 1uen s PRO 14 Ca 0.57 2.49 -0.21 0.00 0.02 0.00 0.00 61.00 63.87 1uen s PRO 14 Cb -0.37 -2.90 -0.32 0.00 0.02 0.00 0.00 34.50 30.93 1uen s PRO 14 CO 0.38 -0.56 0.93 0.52 -0.33 0.00 0.00 177.00 177.94 1uen h MET 15 N 2.87 0.36 -4.59 5.54 2.86 -0.95 -3.39 114.93 117.63 1uen h MET 15 Ca -0.51 -0.60 -0.23 0.00 -2.06 0.00 0.00 59.70 56.30 1uen h MET 15 Cb 1.24 0.22 -0.15 0.00 0.06 0.00 0.00 31.60 32.98 1uen h MET 15 CO 0.63 1.28 -0.65 0.14 1.06 0.00 0.00 176.91 179.38 1uen s VAL 16 N -2.51 0.29 0.55 -2.22 -7.23 -1.25 -4.64 120.40 103.40 1uen s VAL 16 Ca -0.13 -1.95 0.03 0.00 -1.81 0.00 0.00 61.98 58.13 1uen s VAL 16 Cb 0.02 -2.16 0.05 0.00 0.56 0.00 0.00 36.38 34.85 1uen s VAL 16 CO 0.86 -0.38 0.77 0.00 -0.31 0.00 0.00 175.10 176.03 1uen s ALA 17 N -3.92 4.09 1.09 1.32 0.00 -1.25 -4.69 121.76 118.39 1uen s ALA 17 Ca 0.27 -1.56 -0.13 0.00 0.00 0.00 0.00 51.96 50.54 1uen s ALA 17 Cb 0.07 -1.90 0.24 0.00 0.00 0.00 0.00 23.12 21.53 1uen s ALA 17 CO 0.04 -0.78 1.06 -1.25 0.00 0.00 0.00 175.76 174.83 1uen s PRO 18 N -4.73 -0.34 0.89 0.00 0.04 -1.26 -4.81 135.00 124.80 1uen s PRO 18 Ca 0.59 0.68 -0.13 0.00 0.04 0.00 0.00 61.00 62.17 1uen s PRO 18 Cb -0.09 -1.63 0.13 0.00 0.04 0.00 0.00 34.50 32.95 1uen s PRO 18 CO 0.38 -3.29 1.20 0.20 0.04 0.00 0.00 177.00 175.54 1uen s GLY 19 N -2.96 1.64 -0.44 0.56 0.00 -0.13 -4.73 107.32 101.27 1uen s GLY 19 Ca 0.67 -0.78 -0.34 0.00 0.00 0.00 0.00 44.72 44.28 1uen s GLY 19 CO 0.61 -0.18 2.28 -2.01 0.00 0.00 0.00 173.10 173.80 1uen n ASN 20 N -3.61 1.96 -4.75 1.64 5.15 -1.26 -2.44 115.26 111.95 1uen n ASN 20 Ca 0.10 0.26 -0.35 0.00 -0.60 0.00 0.00 54.58 53.99 1uen n ASN 20 Cb 0.60 -1.27 0.05 0.00 -0.53 0.00 0.00 39.78 38.63 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 8.16 2.64 0.04 3.44 1.01 -1.26 -4.46 120.40 129.97 1uen s VAL 21 Ca 1.11 0.36 -0.03 0.00 0.00 0.00 0.00 61.98 63.41 1uen s VAL 21 Cb -0.81 -3.02 -0.02 0.00 0.00 0.00 0.00 36.38 32.53 1uen s VAL 21 CO 0.46 -0.13 0.03 -0.13 0.00 0.00 0.00 175.10 175.33 1uen s ARG 22 N -3.63 0.57 -0.07 2.72 1.81 0.29 -4.94 118.95 115.70 1uen s ARG 22 Ca 0.75 -0.93 -0.10 0.00 -1.72 0.00 0.00 55.73 53.72 1uen s ARG 22 Cb -0.28 0.21 0.02 0.00 -0.45 0.00 0.00 34.95 34.45 1uen s ARG 22 CO 0.38 -0.13 0.25 0.54 -0.68 0.00 0.00 175.30 175.66 1uen s VAL 23 N -3.05 0.02 -0.10 3.52 0.11 -1.26 -0.42 120.40 119.23 1uen s VAL 23 Ca -0.01 -0.20 0.03 0.00 -2.93 0.00 0.00 61.98 58.87 1uen s VAL 23 Cb 0.02 -0.42 0.01 0.00 -1.53 0.00 0.00 36.38 34.45 1uen s VAL 23 CO -0.07 -0.11 -0.18 0.21 -3.33 0.00 0.00 175.10 171.62 1uen s ASN 24 N -0.38 2.57 -0.19 3.54 2.47 0.35 -4.95 114.94 118.35 1uen s ASN 24 Ca -0.05 -0.46 -0.27 0.00 0.42 0.00 0.00 52.86 52.50 1uen s ASN 24 Cb -0.03 -1.17 -0.00 0.00 -1.45 0.00 0.00 41.25 38.59 1uen s ASN 24 CO 0.01 0.08 0.93 -0.69 -3.72 0.00 0.00 177.10 173.72 1uen s VAL 25 N 0.62 4.79 -0.15 -5.21 1.01 -1.26 -0.46 120.40 119.74 1uen s VAL 25 Ca -0.14 1.83 -0.26 0.00 0.00 0.00 0.00 61.98 63.40 1uen s VAL 25 Cb -0.16 -4.22 -0.24 0.00 0.00 0.00 0.00 36.38 31.76 1uen s VAL 25 CO 0.04 -0.06 0.65 0.58 0.00 0.00 0.00 175.10 176.31 1uen h VAL 26 N 5.29 1.58 -2.41 2.92 2.07 -1.65 -3.48 116.25 120.56 1uen h VAL 26 Ca -0.25 -2.25 -0.05 0.00 0.82 0.00 0.00 66.70 64.97 1uen h VAL 26 Cb 1.11 3.05 -0.01 0.00 -1.52 0.00 0.00 31.29 33.92 1uen h VAL 26 CO 0.89 0.53 0.01 -0.46 0.02 0.00 0.00 177.57 178.56 1uen n ASN 27 N -4.59 -0.45 -0.18 0.57 0.23 -0.53 -5.01 115.26 105.31 1uen n ASN 27 Ca -0.13 -1.45 0.10 0.00 -0.53 0.00 0.00 54.58 52.57 1uen n ASN 27 Cb 0.49 0.78 0.42 0.00 -2.08 0.00 0.00 39.78 39.39 1uen n ASN 27 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 1uen h SER 28 N 0.50 0.55 0.00 0.53 4.64 -1.90 -3.03 113.55 114.85 1uen h SER 28 Ca -0.08 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.26 1uen h SER 28 Cb 0.31 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 62.30 1uen h SER 28 CO 0.10 0.32 -0.17 0.35 -0.87 0.00 0.00 176.83 176.57 1uen n THR 29 N -4.49 1.08 -3.80 2.95 -2.24 -1.26 -2.70 114.28 103.81 1uen n THR 29 Ca 0.13 -1.28 -0.13 0.00 -2.27 0.00 0.00 64.05 60.50 1uen n THR 29 Cb 0.36 0.14 -0.12 0.00 -2.10 0.00 0.00 70.33 68.61 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 -1.60 1.21 0.17 3.22 1.98 -1.15 -3.53 118.68 118.97 1uen s LEU 30 Ca 0.17 0.41 -0.01 0.00 -2.89 0.00 0.00 54.13 51.81 1uen s LEU 30 Cb 0.15 0.72 -0.04 0.00 0.66 0.00 0.00 46.19 47.68 1uen s LEU 30 CO 0.02 -0.08 0.10 0.00 -1.89 0.00 0.00 176.35 174.49 1uen s ALA 31 N 0.08 0.99 0.04 5.97 0.00 -0.80 -1.45 121.76 126.60 1uen s ALA 31 Ca -0.00 -1.57 0.06 0.00 0.00 0.00 0.00 51.96 50.45 1uen s ALA 31 Cb -0.02 1.12 -0.02 0.00 0.00 0.00 0.00 23.12 24.20 1uen s ALA 31 CO 0.00 -0.54 -0.17 -2.00 0.00 0.00 0.00 175.76 173.06 1uen s GLU 32 N -4.10 1.09 -0.04 0.00 -6.30 0.40 -0.15 118.70 109.59 1uen s GLU 32 Ca 0.31 -0.84 0.03 0.00 -2.50 0.00 0.00 54.97 51.97 1uen s GLU 32 Cb 0.07 -1.14 0.01 0.00 0.00 0.00 0.00 34.13 33.06 1uen s GLU 32 CO 0.07 0.29 -0.11 0.08 0.02 0.00 0.00 175.26 175.61 1uen s VAL 33 N -0.85 0.95 0.11 3.70 1.01 0.19 -0.50 120.40 125.00 1uen s VAL 33 Ca 0.04 -0.42 0.10 0.00 0.00 0.00 0.00 61.98 61.69 1uen s VAL 33 Cb -0.08 -0.86 -0.04 0.00 0.00 0.00 0.00 36.38 35.40 1uen s VAL 33 CO 0.02 0.30 -0.24 -1.00 0.00 0.00 0.00 175.10 174.17 1uen s HIS 34 N 0.39 2.08 0.04 5.22 0.09 0.44 -1.07 115.29 122.47 1uen s HIS 34 Ca -0.08 -0.40 -0.11 0.00 -0.00 0.00 0.00 55.06 54.48 1uen s HIS 34 Cb -0.12 -1.14 0.01 0.00 -0.00 0.00 0.00 32.58 31.33 1uen s HIS 34 CO 0.02 0.26 0.24 1.67 -0.00 0.00 0.00 174.74 176.93 1uen s TRP 35 N -1.07 -0.02 0.10 1.40 -2.14 0.20 -0.55 118.94 116.87 1uen s TRP 35 Ca 0.11 -0.14 -0.17 0.00 2.66 0.00 0.00 56.10 58.55 1uen s TRP 35 Cb -0.10 0.02 -0.07 0.00 -3.10 0.00 0.00 33.47 30.23 1uen s TRP 35 CO 0.05 -0.45 0.55 -0.51 -2.66 0.00 0.00 176.95 173.94 1uen s ASP 36 N -2.00 6.95 0.02 -2.66 1.11 -1.02 -4.70 116.67 114.37 1uen s ASP 36 Ca -0.06 1.17 -0.30 0.00 0.18 0.00 0.00 52.55 53.54 1uen s ASP 36 Cb -0.02 -2.33 -0.07 0.00 1.07 0.00 0.00 42.92 41.58 1uen s ASP 36 CO -0.03 0.20 1.58 -2.16 1.18 0.00 0.00 175.17 175.95 1uen s PRO 37 N -1.48 4.22 1.01 8.23 0.04 -1.26 -0.95 135.00 144.81 1uen s PRO 37 Ca 0.33 2.19 -0.15 0.00 0.04 0.00 0.00 61.00 63.41 1uen s PRO 37 Cb -0.17 -3.69 0.04 0.00 0.04 0.00 0.00 34.50 30.71 1uen s PRO 37 CO 0.19 -0.72 0.15 1.33 0.04 0.00 0.00 177.00 177.99 1uen n VAL 38 N 4.91 0.00 0.00 -0.36 0.24 -1.26 -4.74 118.33 117.11 1uen n VAL 38 Ca 0.15 -0.24 0.00 0.00 -2.04 0.00 0.00 64.34 62.21 1uen n VAL 38 Cb 0.42 -0.56 0.00 0.00 -1.47 0.00 0.00 33.84 32.23 1uen n VAL 38 CO 0.00 0.00 0.00 -0.81 -2.14 0.00 0.00 176.83 173.88 1uen n PRO 39 N -1.45 1.63 0.00 7.34 -0.04 -1.26 -5.07 135.00 136.16 1uen n PRO 39 Ca 0.04 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.50 1uen n PRO 39 Cb 0.57 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.03 1uen n PRO 39 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1uen n LEU 40 N 0.00 0.23 -0.25 1.53 4.77 -1.26 -4.76 117.00 117.26 1uen n LEU 40 Ca 0.00 0.00 0.06 0.00 -0.03 0.00 0.00 56.01 56.04 1uen n LEU 40 Cb 0.00 0.00 0.19 0.00 -2.33 0.00 0.00 43.42 41.28 1uen n LEU 40 CO 0.00 0.04 0.96 0.11 -1.33 0.00 0.00 177.39 177.17 1uen h LYS 41 N 0.00 0.32 0.00 3.23 6.56 -1.96 0.91 116.57 125.63 1uen h LYS 41 Ca 0.00 -0.02 -0.12 0.00 -1.06 0.00 0.00 60.65 59.45 1uen h LYS 41 Cb 0.47 -0.07 -0.02 0.00 -0.57 0.00 0.00 32.23 32.04 1uen h LYS 41 CO 0.00 0.21 -0.57 0.66 -2.06 0.00 0.00 179.45 177.69 1uen h SER 42 N 0.33 0.00 0.22 0.86 4.64 -1.95 -2.46 113.55 115.18 1uen h SER 42 Ca 0.42 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.70 1uen h SER 42 Cb 0.70 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.79 1uen h SER 42 CO -0.48 0.57 -0.18 0.40 -0.87 0.00 0.00 176.83 176.27 1uen h ILE 43 N 0.00 1.04 0.00 0.95 2.04 -1.18 0.18 117.51 120.54 1uen h ILE 43 Ca -0.01 -0.65 0.00 0.00 1.00 0.00 0.00 64.86 65.21 1uen h ILE 43 Cb 1.20 1.36 0.00 0.00 -0.74 0.00 0.00 36.82 38.64 1uen h ILE 43 CO 0.07 0.18 0.00 0.54 0.00 0.00 0.00 178.15 178.94 1uen n ARG 44 N -4.19 0.00 -0.95 2.37 5.12 -0.42 -4.29 116.66 114.30 1uen n ARG 44 Ca -0.02 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.90 1uen n ARG 44 Cb 0.25 -1.67 0.00 0.00 -1.16 0.00 0.00 32.46 29.88 1uen n ARG 44 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1uen n GLY 45 N -0.55 5.54 3.80 -0.13 0.00 -1.26 -4.76 105.19 107.84 1uen n GLY 45 Ca 0.00 -1.89 -0.34 0.00 0.00 0.00 0.00 46.02 43.79 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 -0.55 3.11 0.06 1.61 3.76 -1.26 -4.97 115.29 117.05 1uen s HIS 46 Ca 0.00 1.59 -0.31 0.00 -0.15 0.00 0.00 55.06 56.20 1uen s HIS 46 Cb 0.00 -2.99 -0.06 0.00 1.11 0.00 0.00 32.58 30.64 1uen s HIS 46 CO 0.00 -0.58 1.20 -1.17 -0.85 0.00 0.00 174.74 173.34 1uen s LEU 47 N -3.35 4.37 -0.15 0.89 1.98 -1.26 -3.72 118.68 117.43 1uen s LEU 47 Ca 0.65 2.01 0.18 0.00 -2.89 0.00 0.00 54.13 54.08 1uen s LEU 47 Cb -0.14 -3.58 -0.25 0.00 0.66 0.00 0.00 46.19 42.88 1uen s LEU 47 CO 0.18 -0.47 0.21 0.00 -1.89 0.00 0.00 176.35 174.38 1uen n GLN 48 N 3.96 0.68 0.00 1.98 1.13 -0.63 -4.91 117.38 119.58 1uen n GLN 48 Ca 0.09 0.02 0.00 0.00 -1.94 0.00 0.00 57.00 55.17 1uen n GLN 48 Cb 0.46 -1.57 0.00 0.00 0.11 0.00 0.00 30.24 29.25 1uen n GLN 48 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1uen n GLY 49 N 1.67 -0.92 3.34 1.08 0.00 -1.16 -1.61 105.19 107.59 1uen n GLY 49 Ca -0.27 -1.25 -0.27 0.00 0.00 0.00 0.00 46.02 44.23 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 -2.00 2.07 -0.12 1.61 1.51 -0.36 -1.15 117.35 118.91 1uen s TYR 50 Ca 0.00 -0.40 0.02 0.00 -1.01 0.00 0.00 57.07 55.69 1uen s TYR 50 Cb 0.00 -1.13 0.01 0.00 -0.11 0.00 0.00 41.96 40.73 1uen s TYR 50 CO 0.00 0.28 -0.19 0.50 -1.11 0.00 0.00 175.55 175.03 1uen s ARG 51 N -1.98 2.62 -0.22 -0.62 3.52 0.00 -2.48 118.95 119.79 1uen s ARG 51 Ca 0.10 -0.71 -0.16 0.00 -0.13 0.00 0.00 55.73 54.84 1uen s ARG 51 Cb -0.10 -2.14 -0.04 0.00 -1.56 0.00 0.00 34.95 31.11 1uen s ARG 51 CO 0.05 -0.02 0.40 0.42 -0.81 0.00 0.00 175.30 175.34 1uen s ILE 52 N 0.84 5.18 0.13 4.11 1.01 -0.97 -1.09 121.20 130.42 1uen s ILE 52 Ca -0.08 0.68 -0.11 0.00 0.00 0.00 0.00 60.65 61.14 1uen s ILE 52 Cb -0.15 -3.73 -0.06 0.00 0.01 0.00 0.00 42.46 38.52 1uen s ILE 52 CO -0.01 0.21 0.48 -0.31 0.00 0.00 0.00 174.94 175.32 1uen s TYR 53 N 1.58 3.56 0.25 3.97 2.02 -0.80 -1.15 117.35 126.77 1uen s TYR 53 Ca 0.18 0.88 -0.18 0.00 -0.37 0.00 0.00 57.07 57.58 1uen s TYR 53 Cb -0.15 -2.24 0.02 0.00 -0.40 0.00 0.00 41.96 39.19 1uen s TYR 53 CO 0.08 0.44 0.61 1.52 -1.57 0.00 0.00 175.55 176.63 1uen s TYR 54 N -1.51 -0.05 0.07 2.71 1.13 -0.72 -0.45 117.35 118.52 1uen s TYR 54 Ca 0.38 -0.35 -0.12 0.00 -1.41 0.00 0.00 57.07 55.57 1uen s TYR 54 Cb -0.14 0.50 0.01 0.00 -1.10 0.00 0.00 41.96 41.24 1uen s TYR 54 CO 0.19 -1.09 0.26 1.67 -2.51 0.00 0.00 175.55 174.08 1uen s TRP 55 N -3.93 -0.01 0.23 -3.49 -2.14 0.27 -0.57 118.94 109.30 1uen s TRP 55 Ca 0.13 -0.25 -0.30 0.00 2.66 0.00 0.00 56.10 58.35 1uen s TRP 55 Cb -0.03 0.05 -0.09 0.00 -3.10 0.00 0.00 33.47 30.30 1uen s TRP 55 CO 0.04 -0.53 1.14 0.21 -2.66 0.00 0.00 176.95 175.16 1uen s LYS 56 N -3.09 4.57 0.06 3.25 2.36 -1.26 -2.07 119.74 123.56 1uen s LYS 56 Ca -0.01 1.83 0.05 0.00 -2.55 0.00 0.00 55.97 55.29 1uen s LYS 56 Cb 0.01 -3.21 -0.03 0.00 -1.05 0.00 0.00 37.83 33.55 1uen s LYS 56 CO -0.07 0.07 -0.14 0.99 1.55 0.00 0.00 175.35 177.76 1uen s THR 57 N -0.65 1.09 0.00 3.43 2.01 -0.26 -4.90 115.64 116.36 1uen s THR 57 Ca 0.48 -1.17 0.00 0.00 0.31 0.00 0.00 61.69 61.32 1uen s THR 57 Cb -0.32 -1.03 0.00 0.00 0.01 0.00 0.00 72.50 71.16 1uen s THR 57 CO 0.39 -0.13 0.00 0.00 -0.69 0.00 0.00 174.62 174.19 1uen n GLN 58 N 1.55 0.61 -3.26 4.92 10.64 -1.26 -3.41 117.38 127.16 1uen n GLN 58 Ca -0.20 0.00 -0.15 0.00 -1.83 0.00 0.00 57.00 54.83 1uen n GLN 58 Cb 0.54 -0.34 0.00 0.00 -0.86 0.00 0.00 30.24 29.58 1uen n GLN 58 CO 0.00 0.00 0.00 0.45 -1.83 0.00 0.00 177.06 175.68 1uen n SER 59 N -0.43 -2.67 -4.53 2.61 2.88 -1.26 -5.02 113.62 105.21 1uen n SER 59 Ca 0.00 -0.56 -0.30 0.00 -1.33 0.00 0.00 58.87 56.67 1uen n SER 59 Cb 0.00 -0.89 -0.06 0.00 -0.75 0.00 0.00 64.21 62.51 1uen n SER 59 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1uen n SER 60 N -1.25 3.30 -4.06 -3.46 7.64 -1.26 -5.12 113.62 109.42 1uen n SER 60 Ca -0.18 -3.09 -0.35 0.00 1.01 0.00 0.00 58.87 56.27 1uen n SER 60 Cb 0.39 0.32 -0.11 0.00 -1.01 0.00 0.00 64.21 63.80 1uen n SER 60 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1uen s SER 61 N -3.65 4.99 0.82 6.43 0.01 -1.26 -5.08 113.70 115.96 1uen s SER 61 Ca 0.01 -2.93 -0.12 0.00 1.31 0.00 0.00 55.95 54.23 1uen s SER 61 Cb -0.00 -1.80 0.09 0.00 0.21 0.00 0.00 66.02 64.52 1uen s SER 61 CO 0.01 -0.33 1.16 -0.54 0.41 0.00 0.00 173.24 173.95 1uen s LYS 62 N -0.17 1.67 -0.05 12.44 -0.14 -1.26 -4.97 119.74 127.26 1uen s LYS 62 Ca 0.17 1.55 -0.06 0.00 -1.36 0.00 0.00 55.97 56.27 1uen s LYS 62 Cb -0.22 -1.80 -0.28 0.00 -1.68 0.00 0.00 37.83 33.85 1uen s LYS 62 CO -0.03 -2.15 0.66 -0.09 -0.76 0.00 0.00 175.35 172.98 1uen h ARG 63 N -1.15 0.30 -1.97 1.68 2.43 -2.09 -3.43 114.38 110.14 1uen h ARG 63 Ca -0.45 -0.51 -0.35 0.00 -0.81 0.00 0.00 59.98 57.86 1uen h ARG 63 Cb 1.27 0.19 -0.31 0.00 -0.42 0.00 0.00 29.97 30.70 1uen h ARG 63 CO 0.46 1.18 -0.67 1.21 -1.51 0.00 0.00 179.97 180.64 1uen s ASN 64 N -7.06 1.22 -0.27 -3.80 3.84 -1.26 -5.13 114.94 102.48 1uen s ASN 64 Ca -0.14 -1.37 -0.22 0.00 0.21 0.00 0.00 52.86 51.34 1uen s ASN 64 Cb 0.06 0.58 0.07 0.00 -0.55 0.00 0.00 41.25 41.41 1uen s ASN 64 CO 0.83 -0.29 0.71 -0.60 -2.79 0.00 0.00 177.10 174.97 1uen s ARG 65 N 1.66 0.79 -0.47 0.43 3.52 -1.26 -5.13 118.95 118.50 1uen s ARG 65 Ca 0.15 1.08 0.06 0.00 -0.13 0.00 0.00 55.73 56.89 1uen s ARG 65 Cb -0.15 0.31 0.18 0.00 -1.56 0.00 0.00 34.95 33.73 1uen s ARG 65 CO -0.10 -0.12 0.58 0.50 -0.81 0.00 0.00 175.30 175.35 1uen s ARG 66 N 0.84 0.97 -0.29 5.12 3.52 -1.26 -4.85 118.95 123.01 1uen s ARG 66 Ca -0.04 -1.28 0.04 0.00 -0.13 0.00 0.00 55.73 54.32 1uen s ARG 66 Cb -0.05 -0.48 0.19 0.00 -1.56 0.00 0.00 34.95 33.05 1uen s ARG 66 CO -0.07 -1.32 0.54 -1.01 -0.81 0.00 0.00 175.30 172.63 1uen s HIS 67 N 0.76 -1.61 -0.22 5.12 3.76 -1.26 -5.12 115.29 116.72 1uen s HIS 67 Ca 0.29 1.00 -0.20 0.00 -0.15 0.00 0.00 55.06 55.99 1uen s HIS 67 Cb -0.01 0.24 -0.02 0.00 1.11 0.00 0.00 32.58 33.90 1uen s HIS 67 CO -0.09 -1.03 0.60 0.42 -0.85 0.00 0.00 174.74 173.79 1uen s ILE 68 N 2.76 5.03 0.23 0.60 1.01 -1.26 -5.08 121.20 124.50 1uen s ILE 68 Ca 0.11 1.09 -0.30 0.00 0.00 0.00 0.00 60.65 61.56 1uen s ILE 68 Cb -0.11 -3.91 -0.09 0.00 0.01 0.00 0.00 42.46 38.36 1uen s ILE 68 CO -0.26 0.10 0.97 -0.70 0.00 0.00 0.00 174.94 175.05 1uen s GLU 69 N 2.07 4.80 -0.14 2.79 2.12 -1.26 -5.07 118.70 124.02 1uen s GLU 69 Ca 0.26 1.55 0.03 0.00 0.36 0.00 0.00 54.97 57.16 1uen s GLU 69 Cb -0.16 -3.27 0.01 0.00 0.26 0.00 0.00 34.13 30.97 1uen s GLU 69 CO 0.09 0.42 -0.22 0.15 -0.54 0.00 0.00 175.26 175.17 1uen s LYS 70 N -1.07 2.97 0.35 4.30 1.02 -1.26 -4.42 119.74 121.63 1uen s LYS 70 Ca 0.42 -0.84 0.04 0.00 0.02 0.00 0.00 55.97 55.62 1uen s LYS 70 Cb -0.27 -2.39 -0.01 0.00 -0.52 0.00 0.00 37.83 34.64 1uen s LYS 70 CO 0.33 -0.00 0.51 0.15 -0.92 0.00 0.00 175.35 175.42 1uen s LYS 71 N 0.79 3.19 0.04 1.68 -0.14 0.26 -4.98 119.74 120.58 1uen s LYS 71 Ca -0.08 -0.77 0.02 0.00 -1.36 0.00 0.00 55.97 53.78 1uen s LYS 71 Cb -0.16 -2.75 -0.02 0.00 -1.68 0.00 0.00 37.83 33.22 1uen s LYS 71 CO -0.01 0.04 -0.07 0.42 -0.76 0.00 0.00 175.35 174.97 1uen s ILE 72 N -2.26 0.49 -0.01 2.17 1.01 -1.26 -1.75 121.20 119.59 1uen s ILE 72 Ca 0.44 -1.05 0.00 0.00 0.00 0.00 0.00 60.65 60.04 1uen s ILE 72 Cb -0.10 -0.56 0.01 0.00 0.01 0.00 0.00 42.46 41.82 1uen s ILE 72 CO 0.33 -0.39 -0.00 -0.76 0.00 0.00 0.00 174.94 174.12 1uen s LEU 73 N -1.54 1.74 -0.17 2.97 1.43 -0.30 -5.00 118.68 117.81 1uen s LEU 73 Ca -0.11 -0.01 -0.11 0.00 -1.03 0.00 0.00 54.13 52.88 1uen s LEU 73 Cb -0.10 -0.07 -0.05 0.00 0.03 0.00 0.00 46.19 46.00 1uen s LEU 73 CO 0.00 -0.03 0.18 -0.89 0.23 0.00 0.00 176.35 175.85 1uen s THR 74 N 0.29 5.39 -0.41 5.49 2.01 -1.26 -2.29 115.64 124.86 1uen s THR 74 Ca -0.02 0.31 0.08 0.00 0.31 0.00 0.00 61.69 62.37 1uen s THR 74 Cb -0.04 -3.51 0.27 0.00 0.01 0.00 0.00 72.50 69.23 1uen s THR 74 CO -0.01 0.47 0.63 0.49 -0.69 0.00 0.00 174.62 175.51 1uen n PHE 75 N 3.17 -0.85 -2.04 4.92 3.72 -1.03 -4.99 117.46 120.35 1uen n PHE 75 Ca -0.16 -3.26 -0.41 0.00 -0.05 0.00 0.00 57.45 53.57 1uen n PHE 75 Cb 0.53 0.01 -0.03 0.00 -0.94 0.00 0.00 39.48 39.05 1uen n PHE 75 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 1uen s GLN 76 N -1.02 4.28 0.00 -1.08 -0.21 -1.26 -1.23 119.66 119.14 1uen s GLN 76 Ca 0.35 2.26 0.00 0.00 0.02 0.00 0.00 55.36 57.99 1uen s GLN 76 Cb 0.21 -3.14 0.00 0.00 1.00 0.00 0.00 33.01 31.08 1uen s GLN 76 CO -0.13 -0.42 0.00 0.41 -2.12 0.00 0.00 175.29 173.03 1uen n GLY 77 N 2.52 0.88 0.00 3.09 0.00 -0.64 -4.84 105.19 106.21 1uen n GLY 77 Ca 0.08 -2.11 0.11 0.00 0.00 0.00 0.00 46.02 44.10 1uen n GLY 77 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1uen n SER 78 N 0.00 0.00 -4.43 1.61 3.41 -1.26 -4.24 113.62 108.71 1uen n SER 78 Ca 0.00 -0.78 -0.41 0.00 -0.26 0.00 0.00 58.87 57.43 1uen n SER 78 Cb 0.00 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 63.96 1uen n SER 78 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1uen n LYS 79 N -0.98 0.48 0.00 4.33 4.76 -1.26 -4.92 118.16 120.58 1uen n LYS 79 Ca 0.17 0.18 0.11 0.00 -2.87 0.00 0.00 58.31 55.90 1uen n LYS 79 Cb 0.08 -1.47 0.05 0.00 -1.84 0.00 0.00 35.03 31.85 1uen n LYS 79 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 1uen n THR 80 N -1.05 0.00 -3.95 -0.18 -2.24 -1.26 -4.92 114.28 100.69 1uen n THR 80 Ca 0.11 -0.35 -0.10 0.00 -2.27 0.00 0.00 64.05 61.45 1uen n THR 80 Cb 0.41 1.32 -0.06 0.00 -2.10 0.00 0.00 70.33 69.90 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 -2.29 0.34 -0.24 4.78 -3.43 -1.26 -0.63 115.29 112.55 1uen s HIS 81 Ca 0.22 -0.69 -0.36 0.00 -0.80 0.00 0.00 55.06 53.44 1uen s HIS 81 Cb 0.19 0.07 0.15 0.00 -1.43 0.00 0.00 32.58 31.56 1uen s HIS 81 CO 0.47 -0.84 1.29 0.20 -2.00 0.00 0.00 174.74 173.86 1uen s GLY 82 N -2.98 -0.21 0.47 -1.38 0.00 -0.23 -4.98 107.32 98.01 1uen s GLY 82 Ca 0.19 1.87 -0.04 0.00 0.00 0.00 0.00 44.72 46.74 1uen s GLY 82 CO 0.03 0.65 0.76 1.06 0.00 0.00 0.00 173.10 175.60 1uen s MET 83 N -2.08 3.50 -0.57 2.90 -1.94 -1.26 -0.64 119.30 119.20 1uen s MET 83 Ca 0.10 0.11 0.02 0.00 -1.71 0.00 0.00 55.69 54.21 1uen s MET 83 Cb -0.01 -2.41 0.14 0.00 2.01 0.00 0.00 34.83 34.57 1uen s MET 83 CO -0.04 -0.19 0.34 -0.51 -0.01 0.00 0.00 175.02 174.62 1uen s LEU 84 N -4.70 4.66 0.31 -0.03 2.01 0.78 -4.91 118.68 116.80 1uen s LEU 84 Ca 0.47 -3.04 -0.03 0.00 0.01 0.00 0.00 54.13 51.54 1uen s LEU 84 Cb -0.10 -1.72 -0.04 0.00 0.01 0.00 0.00 46.19 44.34 1uen s LEU 84 CO 0.44 -0.26 0.55 -2.16 1.01 0.00 0.00 176.35 175.92 1uen s PRO 85 N -0.32 3.57 0.00 1.29 0.04 -1.26 -1.90 135.00 136.42 1uen s PRO 85 Ca 0.18 -0.13 0.00 0.00 0.04 0.00 0.00 61.00 61.09 1uen s PRO 85 Cb -0.23 -2.66 0.00 0.00 0.04 0.00 0.00 34.50 31.66 1uen s PRO 85 CO -0.02 0.19 0.00 0.41 0.04 0.00 0.00 177.00 177.62 1uen n GLY 86 N -1.24 1.04 4.01 0.56 0.00 -1.23 -5.04 105.19 103.29 1uen n GLY 86 Ca -0.03 -0.51 -0.20 0.00 0.00 0.00 0.00 46.02 45.28 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 3.23 0.06 0.99 2.01 -1.25 -5.11 118.68 118.61 1uen s LEU 87 Ca 0.00 -0.77 0.04 0.00 0.01 0.00 0.00 54.13 53.41 1uen s LEU 87 Cb 0.00 -1.88 -0.03 0.00 0.01 0.00 0.00 46.19 44.29 1uen s LEU 87 CO 0.00 -1.13 -0.11 -1.61 1.01 0.00 0.00 176.35 174.51 1uen s GLU 88 N -4.51 0.69 0.90 1.70 0.41 -1.25 -4.54 118.70 112.09 1uen s GLU 88 Ca 0.57 -0.88 -0.12 0.00 -0.41 0.00 0.00 54.97 54.13 1uen s GLU 88 Cb -0.06 -0.57 0.13 0.00 -1.78 0.00 0.00 34.13 31.85 1uen s GLU 88 CO 0.35 0.12 1.10 -1.25 -0.49 0.00 0.00 175.26 175.08 1uen s PRO 89 N -1.74 1.22 -1.26 0.39 0.04 -1.10 -4.16 135.00 128.39 1uen s PRO 89 Ca -0.05 0.68 -0.06 0.00 0.04 0.00 0.00 61.00 61.61 1uen s PRO 89 Cb -0.10 -1.82 0.04 0.00 0.04 0.00 0.00 34.50 32.67 1uen s PRO 89 CO 0.01 -2.23 0.38 0.34 0.04 0.00 0.00 177.00 175.54 1uen n PHE 90 N -3.86 -1.73 -4.18 0.56 7.35 0.35 -4.94 117.46 111.02 1uen n PHE 90 Ca 0.07 0.36 -0.17 0.00 -0.76 0.00 0.00 57.45 56.95 1uen n PHE 90 Cb 0.56 -3.12 -0.12 0.00 0.35 0.00 0.00 39.48 37.15 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 -2.55 1.35 0.36 -2.13 0.01 -1.26 -4.93 113.70 104.56 1uen s SER 91 Ca 0.29 -0.53 -0.13 0.00 1.31 0.00 0.00 55.95 56.88 1uen s SER 91 Cb -0.15 -0.04 -0.08 0.00 0.21 0.00 0.00 66.02 65.97 1uen s SER 91 CO 0.35 -0.08 0.76 -2.28 0.41 0.00 0.00 173.24 172.40 1uen s HIS 92 N -1.14 3.41 0.03 2.43 2.46 -1.22 -1.29 115.29 119.97 1uen s HIS 92 Ca -0.03 1.17 0.01 0.00 0.47 0.00 0.00 55.06 56.68 1uen s HIS 92 Cb -0.09 -2.51 -0.02 0.00 -0.13 0.00 0.00 32.58 29.83 1uen s HIS 92 CO 0.01 -0.00 -0.06 0.71 -2.47 0.00 0.00 174.74 172.93 1uen s TYR 93 N -2.16 0.52 -0.05 3.88 1.51 0.07 -1.10 117.35 120.02 1uen s TYR 93 Ca 0.53 -0.48 0.04 0.00 -1.01 0.00 0.00 57.07 56.16 1uen s TYR 93 Cb -0.10 -0.32 -0.00 0.00 -0.11 0.00 0.00 41.96 41.42 1uen s TYR 93 CO 0.23 -0.11 -0.17 0.99 -1.11 0.00 0.00 175.55 175.38 1uen s THR 94 N -1.32 1.43 0.14 -0.71 2.01 -0.88 -2.53 115.64 113.78 1uen s THR 94 Ca -0.11 -0.71 -0.10 0.00 0.31 0.00 0.00 61.69 61.08 1uen s THR 94 Cb -0.09 -1.23 0.00 0.00 0.01 0.00 0.00 72.50 71.18 1uen s THR 94 CO -0.00 0.41 0.29 -1.48 -0.69 0.00 0.00 174.62 173.15 1uen s LEU 95 N 0.09 0.97 0.24 4.42 -0.00 -1.19 -0.57 118.68 122.64 1uen s LEU 95 Ca -0.05 -0.73 -0.11 0.00 -0.00 0.00 0.00 54.13 53.24 1uen s LEU 95 Cb -0.12 1.28 -0.01 0.00 -0.00 0.00 0.00 46.19 47.34 1uen s LEU 95 CO 0.02 -0.86 0.42 0.20 -0.00 0.00 0.00 176.35 176.14 1uen s ASN 96 N -2.92 -0.05 0.11 1.48 -0.87 0.40 -1.27 114.94 111.83 1uen s ASN 96 Ca 0.12 -0.99 0.09 0.00 -1.57 0.00 0.00 52.86 50.52 1uen s ASN 96 Cb 0.03 0.55 -0.04 0.00 -0.02 0.00 0.00 41.25 41.77 1uen s ASN 96 CO -0.04 -1.08 -0.21 -0.69 -2.57 0.00 0.00 177.10 172.50 1uen s VAL 97 N -4.03 2.66 0.01 1.60 1.01 -1.26 -1.91 120.40 118.47 1uen s VAL 97 Ca 0.24 -1.55 -0.00 0.00 0.00 0.00 0.00 61.98 60.67 1uen s VAL 97 Cb 0.01 -2.20 -0.01 0.00 0.00 0.00 0.00 36.38 34.18 1uen s VAL 97 CO 0.09 0.12 -0.02 -0.60 0.00 0.00 0.00 175.10 174.69 1uen s ARG 98 N -2.05 0.23 0.36 2.72 3.52 -0.25 -0.33 118.95 123.15 1uen s ARG 98 Ca 0.16 -0.44 -0.09 0.00 -0.13 0.00 0.00 55.73 55.23 1uen s ARG 98 Cb -0.10 0.08 -0.06 0.00 -1.56 0.00 0.00 34.95 33.31 1uen s ARG 98 CO 0.08 -0.04 0.70 0.14 -0.81 0.00 0.00 175.30 175.38 1uen s VAL 99 N -1.07 4.84 -0.01 7.11 -7.23 -1.26 -0.82 120.40 121.97 1uen s VAL 99 Ca -0.12 0.50 0.03 0.00 -1.81 0.00 0.00 61.98 60.59 1uen s VAL 99 Cb -0.07 -3.72 -0.01 0.00 0.56 0.00 0.00 36.38 33.15 1uen s VAL 99 CO -0.01 -0.42 -0.10 -0.69 -0.31 0.00 0.00 175.10 173.57 1uen s VAL 100 N -2.24 0.80 0.03 1.32 1.01 -0.30 -3.44 120.40 117.59 1uen s VAL 100 Ca 0.49 -0.42 0.01 0.00 0.00 0.00 0.00 61.98 62.06 1uen s VAL 100 Cb -0.10 -0.68 -0.00 0.00 0.00 0.00 0.00 36.38 35.59 1uen s VAL 100 CO 0.29 0.23 0.03 -0.46 0.00 0.00 0.00 175.10 175.19 1uen n ASN 101 N 2.93 0.08 0.00 3.32 0.23 -0.79 -1.60 115.26 119.43 1uen n ASN 101 Ca -0.15 -1.21 0.02 0.00 -0.53 0.00 0.00 54.58 52.71 1uen n ASN 101 Cb 0.56 0.15 0.07 0.00 -2.08 0.00 0.00 39.78 38.49 1uen n ASN 101 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1uen n GLY 102 N 0.24 -0.52 0.72 4.83 0.00 -1.24 -3.50 105.19 105.71 1uen n GLY 102 Ca 0.01 -0.01 -0.05 0.00 0.00 0.00 0.00 46.02 45.96 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 -1.41 0.19 -0.57 1.61 3.00 -1.26 -5.15 118.16 114.57 1uen n LYS 103 Ca 0.01 0.08 0.00 0.00 -0.00 0.00 0.00 58.31 58.40 1uen n LYS 103 Cb 0.03 -0.83 0.00 0.00 0.00 0.00 0.00 35.03 34.24 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 2.69 1.48 3.91 3.14 0.00 -1.23 -5.07 105.19 110.12 1uen n GLY 104 Ca -0.08 -0.75 -0.27 0.00 0.00 0.00 0.00 46.02 44.92 1uen n GLY 104 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1uen s GLU 105 N -0.08 3.46 0.00 1.61 2.02 -1.26 -1.88 118.70 122.56 1uen s GLU 105 Ca 0.00 0.16 0.00 0.00 0.02 0.00 0.00 54.97 55.15 1uen s GLU 105 Cb 0.00 -2.37 0.00 0.00 0.10 0.00 0.00 34.13 31.86 1uen s GLU 105 CO 0.00 -0.27 0.00 0.41 0.02 0.00 0.00 175.26 175.42 1uen n GLY 106 N -2.30 7.03 3.71 -1.39 0.00 -1.22 -4.44 105.19 106.58 1uen n GLY 106 Ca 0.01 -1.95 -0.33 0.00 0.00 0.00 0.00 46.02 43.76 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 1.27 1.73 0.28 1.61 0.04 -1.26 -4.76 135.00 133.92 1uen s PRO 107 Ca 0.00 1.62 -0.03 0.00 0.04 0.00 0.00 61.00 62.62 1uen s PRO 107 Cb 0.00 -1.80 -0.05 0.00 0.04 0.00 0.00 34.50 32.69 1uen s PRO 107 CO 0.00 -2.11 0.52 0.00 0.04 0.00 0.00 177.00 175.45 1uen s ALA 108 N -2.33 3.67 1.01 8.56 0.00 -1.26 -3.91 121.76 127.50 1uen s ALA 108 Ca 0.70 -0.65 -0.12 0.00 0.00 0.00 0.00 51.96 51.89 1uen s ALA 108 Cb -0.25 -2.22 0.19 0.00 0.00 0.00 0.00 23.12 20.84 1uen s ALA 108 CO 0.51 0.25 1.08 -1.12 0.00 0.00 0.00 175.76 176.48 1uen s SER 109 N -3.26 2.41 0.93 0.00 0.01 0.56 -4.73 113.70 109.61 1uen s SER 109 Ca 0.42 1.50 -0.11 0.00 1.31 0.00 0.00 55.95 59.08 1uen s SER 109 Cb -0.11 -2.18 0.15 0.00 0.21 0.00 0.00 66.02 64.10 1uen s SER 109 CO 0.30 -3.31 1.10 -2.16 0.41 0.00 0.00 173.24 169.59 1uen s PRO 110 N -4.76 0.94 0.34 12.44 0.04 -1.26 -4.50 135.00 138.23 1uen s PRO 110 Ca 0.66 1.20 -0.29 0.00 0.04 0.00 0.00 61.00 62.61 1uen s PRO 110 Cb -0.21 -1.74 -0.11 0.00 0.04 0.00 0.00 34.50 32.48 1uen s PRO 110 CO 0.60 -2.57 1.50 0.16 0.04 0.00 0.00 177.00 176.72 1uen s ASP 111 N -2.93 6.42 0.52 6.66 -4.77 -1.26 -4.63 116.67 116.69 1uen s ASP 111 Ca 0.65 2.96 0.07 0.00 -3.30 0.00 0.00 52.55 52.93 1uen s ASP 111 Cb -0.21 -2.65 0.05 0.00 -1.09 0.00 0.00 42.92 39.02 1uen s ASP 111 CO 0.59 -0.84 0.72 -0.13 0.70 0.00 0.00 175.17 176.21 1uen s ARG 112 N -1.45 2.49 0.13 2.11 1.81 -0.39 -4.99 118.95 118.65 1uen s ARG 112 Ca 0.56 -1.31 0.05 0.00 -1.72 0.00 0.00 55.73 53.31 1uen s ARG 112 Cb -0.46 -2.64 -0.04 0.00 -0.45 0.00 0.00 34.95 31.36 1uen s ARG 112 CO 0.56 -0.66 -0.12 0.14 -0.68 0.00 0.00 175.30 174.54 1uen s VAL 113 N -2.60 1.20 -0.11 3.52 -7.23 -1.26 -3.17 120.40 110.75 1uen s VAL 113 Ca 0.59 -1.81 -0.21 0.00 -1.81 0.00 0.00 61.98 58.74 1uen s VAL 113 Cb -0.08 -1.59 0.05 0.00 0.56 0.00 0.00 36.38 35.31 1uen s VAL 113 CO 0.37 -0.56 0.51 0.72 -0.31 0.00 0.00 175.10 175.83 1uen s PHE 114 N -2.59 -0.49 0.07 2.82 -0.71 -1.05 -4.71 117.98 111.32 1uen s PHE 114 Ca 0.11 1.03 0.08 0.00 -1.04 0.00 0.00 56.93 57.11 1uen s PHE 114 Cb -0.02 0.23 -0.03 0.00 -1.21 0.00 0.00 43.02 41.99 1uen s PHE 114 CO 0.02 -0.40 -0.22 0.54 -1.34 0.00 0.00 175.22 173.82 1uen s ASN 115 N -0.55 2.68 0.37 1.98 4.22 -1.26 -0.75 114.94 121.62 1uen s ASN 115 Ca -0.07 -0.60 -0.04 0.00 -2.14 0.00 0.00 52.86 50.01 1uen s ASN 115 Cb -0.03 -0.20 -0.04 0.00 1.28 0.00 0.00 41.25 42.26 1uen s ASN 115 CO 0.04 0.15 0.64 0.42 -2.04 0.00 0.00 177.10 176.31 1uen s THR 116 N -0.93 4.98 0.91 0.54 -4.23 -0.41 -4.93 115.64 111.56 1uen s THR 116 Ca 0.08 0.04 -0.11 0.00 -1.18 0.00 0.00 61.69 60.52 1uen s THR 116 Cb -0.09 -3.80 0.13 0.00 1.34 0.00 0.00 72.50 70.08 1uen s THR 116 CO 0.03 -0.55 1.09 -2.16 -0.54 0.00 0.00 174.62 172.49 1uen s PRO 117 N -4.10 1.17 0.56 3.99 0.04 -1.26 -3.42 135.00 131.98 1uen s PRO 117 Ca 0.45 0.85 0.25 0.00 0.04 0.00 0.00 61.00 62.59 1uen s PRO 117 Cb -0.10 -1.80 1.53 0.00 0.04 0.00 0.00 34.50 34.17 1uen s PRO 117 CO 0.36 -2.31 2.11 1.49 0.04 0.00 0.00 177.00 178.69 1uen h GLU 118 N -1.60 0.00 0.00 4.56 4.81 -1.95 0.10 114.58 120.50 1uen h GLU 118 Ca -0.50 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.73 1uen h GLU 118 Cb 1.28 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.66 1uen h GLU 118 CO 0.54 0.00 0.00 0.41 -0.73 0.00 0.00 179.01 179.23 1uen n GLY 119 N -1.48 1.68 3.47 1.92 0.00 -1.26 -4.14 105.19 105.39 1uen n GLY 119 Ca 0.01 -0.77 -0.09 0.00 0.00 0.00 0.00 46.02 45.17 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 -4.00 -0.12 0.00 1.61 0.15 -1.26 -4.89 113.70 105.19 1uen s SER 120 Ca 0.00 -0.71 0.00 0.00 0.70 0.00 0.00 55.95 55.94 1uen s SER 120 Cb 0.00 0.53 0.00 0.00 -1.71 0.00 0.00 66.02 64.84 1uen s SER 120 CO 0.00 -1.02 0.00 0.61 1.20 0.00 0.00 173.24 174.03 1uen n GLY 121 N -0.30 -0.60 3.77 9.45 0.00 -1.26 -5.13 105.19 111.11 1uen n GLY 121 Ca -0.07 0.58 -0.40 0.00 0.00 0.00 0.00 46.02 46.13 1uen n GLY 121 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1uen s PRO 122 N 0.00 3.93 0.01 1.61 0.04 -1.26 -5.05 135.00 134.28 1uen s PRO 122 Ca 0.00 2.22 -0.02 0.00 0.04 0.00 0.00 61.00 63.23 1uen s PRO 122 Cb 0.00 -2.75 -0.01 0.00 0.04 0.00 0.00 34.50 31.78 1uen s PRO 122 CO 0.00 -0.55 0.03 -1.54 0.04 0.00 0.00 177.00 174.98 1uen s SER 123 N -0.67 0.13 1.04 6.66 1.04 -1.26 -5.17 113.70 115.47 1uen s SER 123 Ca 0.57 -0.32 -0.15 0.00 0.48 0.00 0.00 55.95 56.53 1uen s SER 123 Cb -0.39 0.13 0.21 0.00 0.10 0.00 0.00 66.02 66.07 1uen s SER 123 CO 0.51 -0.28 1.14 -0.44 0.98 0.00 0.00 173.24 175.15 1uen s SER 124 N -1.22 2.37 0.00 7.02 0.01 -1.26 -5.33 113.70 115.29 1uen s SER 124 Ca -0.13 0.82 0.00 0.00 1.31 0.00 0.00 55.95 57.94 1uen s SER 124 Cb -0.08 -1.24 0.00 0.00 0.21 0.00 0.00 66.02 64.91 1uen s SER 124 CO -0.00 -3.25 0.00 0.61 0.41 0.00 0.00 173.24 171.01