#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 -0.36 -4.97 1.61 7.64 -1.26 -4.81 113.62 111.47 1uen n SER 2 Ca 0.00 0.00 -0.22 0.00 1.01 0.00 0.00 58.87 59.66 1uen n SER 2 Cb 0.00 0.00 0.03 0.00 -1.01 0.00 0.00 64.21 63.23 1uen n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1uen s SER 3 N -4.00 4.91 0.00 6.43 0.15 -1.26 -5.07 113.70 114.86 1uen s SER 3 Ca 0.00 -1.00 0.00 0.00 0.70 0.00 0.00 55.95 55.65 1uen s SER 3 Cb 0.00 0.30 0.00 0.00 -1.71 0.00 0.00 66.02 64.61 1uen s SER 3 CO 0.00 -1.20 0.00 0.61 1.20 0.00 0.00 173.24 173.85 1uen n GLY 4 N -2.01 0.07 0.00 9.45 0.00 -1.26 -5.19 105.19 106.26 1uen n GLY 4 Ca 0.08 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.94 1uen n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1uen n SER 5 N 0.00 0.00 -2.70 1.61 3.41 -1.26 -5.06 113.62 109.61 1uen n SER 5 Ca 0.00 0.00 -0.06 0.00 -0.26 0.00 0.00 58.87 58.55 1uen n SER 5 Cb 0.00 0.00 0.07 0.00 -0.26 0.00 0.00 64.21 64.02 1uen n SER 5 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1uen n SER 6 N 0.00 -2.01 0.00 4.04 7.64 -1.26 -5.17 113.62 116.87 1uen n SER 6 Ca 0.00 -2.60 0.00 0.00 1.01 0.00 0.00 58.87 57.28 1uen n SER 6 Cb 0.00 1.34 0.00 0.00 -1.01 0.00 0.00 64.21 64.54 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 1.26 0.06 3.38 0.23 0.00 -1.26 -5.12 105.19 103.74 1uen n GLY 7 Ca 0.04 -1.62 -0.15 0.00 0.00 0.00 0.00 46.02 44.28 1uen n GLY 7 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1uen s HIS 8 N -2.93 -0.42 0.63 1.61 4.02 -1.26 -5.18 115.29 111.76 1uen s HIS 8 Ca 0.00 0.74 -0.08 0.00 1.02 0.00 0.00 55.06 56.74 1uen s HIS 8 Cb 0.00 0.24 0.14 0.00 -1.02 0.00 0.00 32.58 31.94 1uen s HIS 8 CO 0.00 -0.47 0.85 0.43 1.02 0.00 0.00 174.74 176.57 1uen n SER 9 N 1.26 0.39 -0.28 1.40 7.64 -1.26 -5.02 113.62 117.74 1uen n SER 9 Ca -0.20 -1.51 0.00 0.00 1.01 0.00 0.00 58.87 58.18 1uen n SER 9 Cb 0.56 -0.62 0.00 0.00 -1.01 0.00 0.00 64.21 63.14 1uen n SER 9 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1uen n GLY 10 N -0.87 -0.69 0.00 0.23 0.00 -1.26 -4.74 105.19 97.86 1uen n GLY 10 Ca 0.12 -0.66 0.02 0.00 0.00 0.00 0.00 46.02 45.50 1uen n GLY 10 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1uen n GLU 11 N 0.08 0.01 -0.00 1.61 0.00 -1.26 -1.87 120.64 119.21 1uen n GLU 11 Ca 0.00 0.40 0.03 0.00 0.00 0.00 0.00 57.16 57.59 1uen n GLU 11 Cb 0.00 -1.50 -0.04 0.00 0.00 0.00 0.00 31.44 29.90 1uen n GLU 11 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 1uen n ASP 12 N -1.46 0.89 -4.80 4.31 9.92 -1.26 -4.96 116.55 119.19 1uen n ASP 12 Ca 0.01 -0.54 -0.33 0.00 -0.53 0.00 0.00 54.79 53.40 1uen n ASP 12 Cb 0.04 1.06 -0.00 0.00 -0.64 0.00 0.00 41.12 41.58 1uen n ASP 12 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 1uen s LEU 13 N -2.54 3.57 0.97 0.64 1.43 -0.78 -4.49 118.68 117.48 1uen s LEU 13 Ca 0.02 1.82 -0.11 0.00 -1.03 0.00 0.00 54.13 54.82 1uen s LEU 13 Cb 0.05 -4.54 0.17 0.00 0.03 0.00 0.00 46.19 41.91 1uen s LEU 13 CO 0.28 -1.06 1.09 -2.16 0.23 0.00 0.00 176.35 174.73 1uen s PRO 14 N -3.93 0.65 -0.14 1.29 0.04 -1.26 -4.65 135.00 127.00 1uen s PRO 14 Ca 0.64 1.03 0.06 0.00 0.04 0.00 0.00 61.00 62.77 1uen s PRO 14 Cb -0.16 -1.72 -0.13 0.00 0.04 0.00 0.00 34.50 32.53 1uen s PRO 14 CO 0.34 -2.72 -0.05 -1.33 0.04 0.00 0.00 177.00 173.28 1uen n MET 15 N -4.24 1.18 -4.27 4.56 2.81 0.42 -4.74 117.12 112.84 1uen n MET 15 Ca 0.07 0.04 -0.15 0.00 -1.81 0.00 0.00 57.70 55.86 1uen n MET 15 Cb 0.54 -1.32 -0.10 0.00 -0.71 0.00 0.00 33.22 31.63 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 -2.31 1.21 0.57 2.03 -7.23 -1.26 -4.60 120.40 108.81 1uen s VAL 16 Ca -0.14 -2.07 -0.11 0.00 -1.81 0.00 0.00 61.98 57.85 1uen s VAL 16 Cb 0.05 -1.93 -0.05 0.00 0.56 0.00 0.00 36.38 35.01 1uen s VAL 16 CO 0.44 -0.68 0.97 0.00 -0.31 0.00 0.00 175.10 175.52 1uen s ALA 17 N -3.31 3.15 1.05 1.32 0.00 -1.19 -4.48 121.76 118.31 1uen s ALA 17 Ca 0.19 -0.10 -0.12 0.00 0.00 0.00 0.00 51.96 51.93 1uen s ALA 17 Cb 0.03 -2.99 0.21 0.00 0.00 0.00 0.00 23.12 20.37 1uen s ALA 17 CO 0.02 -0.51 1.04 -2.30 0.00 0.00 0.00 175.76 174.02 1uen n PRO 18 N -2.36 -1.44 0.00 0.00 -0.02 -1.26 -4.96 135.00 124.96 1uen n PRO 18 Ca 0.05 -0.37 0.00 0.00 -2.02 0.00 0.00 63.50 61.16 1uen n PRO 18 Cb 0.54 -2.25 0.00 0.00 -0.02 0.00 0.00 33.50 31.77 1uen n PRO 18 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1uen n GLY 19 N 0.69 -2.61 3.61 -1.23 0.00 -1.26 -4.65 105.19 99.75 1uen n GLY 19 Ca 0.07 -1.37 -0.49 0.00 0.00 0.00 0.00 46.02 44.23 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 -1.61 3.04 -4.85 1.61 5.15 -1.26 -4.72 115.26 112.63 1uen n ASN 20 Ca 0.00 0.71 -0.32 0.00 -0.60 0.00 0.00 54.58 54.38 1uen n ASN 20 Cb 0.00 -1.36 -0.04 0.00 -0.53 0.00 0.00 39.78 37.85 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 5.56 4.57 0.16 3.44 1.01 -1.26 -4.64 120.40 129.24 1uen s VAL 21 Ca 0.99 1.13 0.09 0.00 0.00 0.00 0.00 61.98 64.18 1uen s VAL 21 Cb -0.70 -3.71 -0.04 0.00 0.00 0.00 0.00 36.38 31.93 1uen s VAL 21 CO 0.49 -0.61 -0.19 -0.13 0.00 0.00 0.00 175.10 174.65 1uen s ARG 22 N -3.92 1.30 -0.09 2.72 1.81 -0.01 -5.00 118.95 115.75 1uen s ARG 22 Ca 0.58 -1.40 -0.08 0.00 -1.72 0.00 0.00 55.73 53.11 1uen s ARG 22 Cb -0.10 -1.42 0.03 0.00 -0.45 0.00 0.00 34.95 33.01 1uen s ARG 22 CO 0.29 0.30 0.24 0.54 -0.68 0.00 0.00 175.30 175.99 1uen s VAL 23 N -1.89 -0.00 -0.16 3.52 0.11 -1.26 -0.10 120.40 120.61 1uen s VAL 23 Ca 0.15 0.02 0.00 0.00 -2.93 0.00 0.00 61.98 59.23 1uen s VAL 23 Cb -0.07 -0.35 0.03 0.00 -1.53 0.00 0.00 36.38 34.46 1uen s VAL 23 CO 0.07 0.01 -0.14 0.20 -3.33 0.00 0.00 175.10 171.91 1uen s ASN 24 N 0.25 2.87 0.25 3.54 0.01 0.34 -4.96 114.94 117.23 1uen s ASN 24 Ca -0.01 -0.58 -0.30 0.00 -0.71 0.00 0.00 52.86 51.26 1uen s ASN 24 Cb -0.03 -1.21 -0.10 0.00 0.41 0.00 0.00 41.25 40.32 1uen s ASN 24 CO -0.01 -0.07 1.46 -0.69 -1.51 0.00 0.00 177.10 176.29 1uen s VAL 25 N 1.45 2.60 -0.23 1.60 1.01 -1.26 -0.38 120.40 125.19 1uen s VAL 25 Ca 0.04 0.50 -0.17 0.00 0.00 0.00 0.00 61.98 62.35 1uen s VAL 25 Cb -0.13 -3.32 -0.13 0.00 0.00 0.00 0.00 36.38 32.79 1uen s VAL 25 CO -0.10 0.08 -0.11 0.52 0.00 0.00 0.00 175.10 175.48 1uen n VAL 26 N 2.41 1.52 -4.11 2.92 0.31 -0.42 -4.86 118.33 116.09 1uen n VAL 26 Ca 0.07 -0.12 -0.11 0.00 -0.01 0.00 0.00 64.34 64.17 1uen n VAL 26 Cb 0.40 -2.05 -0.04 0.00 -0.91 0.00 0.00 33.84 31.24 1uen n VAL 26 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1uen n ASN 27 N -4.38 -0.48 0.07 4.52 3.02 -0.28 -4.99 115.26 112.73 1uen n ASN 27 Ca -0.36 -2.23 0.02 0.00 -0.03 0.00 0.00 54.58 51.98 1uen n ASN 27 Cb 0.70 1.06 0.39 0.00 -0.61 0.00 0.00 39.78 41.32 1uen n ASN 27 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 1uen h SER 28 N 1.17 0.35 -0.36 6.41 4.64 -1.98 -3.17 113.55 120.61 1uen h SER 28 Ca -0.14 -0.05 -0.27 0.00 -0.47 0.00 0.00 61.79 60.86 1uen h SER 28 Cb 0.69 -0.09 -0.36 0.00 -0.31 0.00 0.00 62.40 62.33 1uen h SER 28 CO 0.20 0.39 -0.97 0.35 -0.87 0.00 0.00 176.83 175.93 1uen n THR 29 N -4.35 1.36 -3.72 2.95 -2.24 -1.26 -2.81 114.28 104.22 1uen n THR 29 Ca 0.01 -2.82 -0.12 0.00 -2.27 0.00 0.00 64.05 58.84 1uen n THR 29 Cb 0.20 0.55 -0.10 0.00 -2.10 0.00 0.00 70.33 68.87 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 -2.88 0.23 -0.09 3.22 1.98 -1.20 -3.87 118.68 116.08 1uen s LEU 30 Ca 0.35 0.87 -0.08 0.00 -2.89 0.00 0.00 54.13 52.39 1uen s LEU 30 Cb 0.36 1.44 0.03 0.00 0.66 0.00 0.00 46.19 48.67 1uen s LEU 30 CO -0.05 -0.16 0.23 0.00 -1.89 0.00 0.00 176.35 174.48 1uen s ALA 31 N 0.57 -0.57 -0.21 5.97 0.00 -1.10 -1.13 121.76 125.29 1uen s ALA 31 Ca -0.03 0.70 -0.07 0.00 0.00 0.00 0.00 51.96 52.57 1uen s ALA 31 Cb -0.05 -0.42 -0.03 0.00 0.00 0.00 0.00 23.12 22.62 1uen s ALA 31 CO -0.03 -0.12 0.05 -2.00 0.00 0.00 0.00 175.76 173.66 1uen s GLU 32 N 0.31 3.79 -0.01 0.00 2.56 0.49 -0.08 118.70 125.76 1uen s GLU 32 Ca -0.02 -0.43 -0.04 0.00 0.00 0.00 0.00 54.97 54.48 1uen s GLU 32 Cb -0.03 -3.23 -0.04 0.00 2.00 0.00 0.00 34.13 32.82 1uen s GLU 32 CO -0.01 0.05 0.21 0.08 -0.56 0.00 0.00 175.26 175.03 1uen s VAL 33 N 0.96 5.39 0.06 3.70 1.01 0.13 -0.51 120.40 131.16 1uen s VAL 33 Ca 0.03 -0.03 0.06 0.00 0.00 0.00 0.00 61.98 62.05 1uen s VAL 33 Cb -0.14 -3.54 -0.03 0.00 0.00 0.00 0.00 36.38 32.67 1uen s VAL 33 CO 0.03 0.35 -0.17 -1.00 0.00 0.00 0.00 175.10 174.30 1uen s HIS 34 N -1.31 1.49 0.19 5.22 0.09 0.86 -1.84 115.29 120.00 1uen s HIS 34 Ca 0.27 -0.40 0.03 0.00 -0.00 0.00 0.00 55.06 54.96 1uen s HIS 34 Cb -0.13 -0.85 -0.01 0.00 -0.00 0.00 0.00 32.58 31.59 1uen s HIS 34 CO 0.17 0.10 0.12 -2.67 -0.00 0.00 0.00 174.74 172.45 1uen n TRP 35 N 1.52 -0.19 -4.85 1.40 2.14 0.31 -0.83 117.44 116.93 1uen n TRP 35 Ca -0.19 -1.44 -0.33 0.00 2.07 0.00 0.00 57.50 57.62 1uen n TRP 35 Cb 0.54 0.08 -0.13 0.00 -0.81 0.00 0.00 31.31 30.99 1uen n TRP 35 CO 0.00 0.00 0.00 -0.51 2.07 0.00 0.00 177.69 179.25 1uen s ASP 36 N -2.27 4.03 -0.27 -0.67 1.11 -1.26 -4.75 116.67 112.59 1uen s ASP 36 Ca 0.16 -0.23 -0.29 0.00 0.18 0.00 0.00 52.55 52.37 1uen s ASP 36 Cb 0.01 -1.09 -0.02 0.00 1.07 0.00 0.00 42.92 42.88 1uen s ASP 36 CO 0.12 0.29 1.72 -2.16 1.18 0.00 0.00 175.17 176.32 1uen s PRO 37 N -0.39 3.57 0.38 8.23 0.04 -1.26 -4.35 135.00 141.21 1uen s PRO 37 Ca 0.04 1.58 -0.26 0.00 0.04 0.00 0.00 61.00 62.40 1uen s PRO 37 Cb -0.12 -4.12 -0.09 0.00 0.04 0.00 0.00 34.50 30.20 1uen s PRO 37 CO 0.02 -1.57 1.18 0.08 0.04 0.00 0.00 177.00 176.75 1uen s VAL 38 N 6.05 3.14 0.25 -0.36 1.01 -1.26 -4.97 120.40 124.26 1uen s VAL 38 Ca 0.77 1.00 -0.31 0.00 0.00 0.00 0.00 61.98 63.44 1uen s VAL 38 Cb -0.24 -3.58 -0.11 0.00 0.00 0.00 0.00 36.38 32.44 1uen s VAL 38 CO 0.32 0.13 1.58 -2.16 0.00 0.00 0.00 175.10 174.97 1uen s PRO 39 N -2.12 4.17 0.36 2.72 0.05 -1.26 -4.92 135.00 134.00 1uen s PRO 39 Ca 0.54 2.49 0.05 0.00 0.05 0.00 0.00 61.00 64.12 1uen s PRO 39 Cb -0.32 -3.07 0.70 0.00 0.05 0.00 0.00 34.50 31.86 1uen s PRO 39 CO 0.41 -0.60 1.98 -0.07 0.05 0.00 0.00 177.00 178.77 1uen h LEU 40 N 5.53 0.69 -1.35 -3.56 4.07 -1.94 -1.80 115.31 116.94 1uen h LEU 40 Ca -0.45 -0.00 0.19 0.00 0.08 0.00 0.00 57.88 57.69 1uen h LEU 40 Cb 1.21 -0.15 -0.08 0.00 1.08 0.00 0.00 40.66 42.72 1uen h LEU 40 CO 0.84 0.47 0.60 0.50 -1.08 0.00 0.00 178.44 179.76 1uen h LYS 41 N 0.79 0.53 0.00 1.13 1.63 -1.95 -0.60 116.57 118.11 1uen h LYS 41 Ca 0.28 -0.03 0.00 0.00 -0.85 0.00 0.00 60.65 60.05 1uen h LYS 41 Cb 0.13 -0.12 0.00 0.00 -0.60 0.00 0.00 32.23 31.64 1uen h LYS 41 CO -0.08 0.35 -1.05 -1.13 -3.45 0.00 0.00 179.45 174.09 1uen n SER 42 N -4.58 0.62 0.02 4.20 3.41 -0.75 -3.52 113.62 113.03 1uen n SER 42 Ca 0.20 -0.31 -0.05 0.00 -0.26 0.00 0.00 58.87 58.45 1uen n SER 42 Cb 0.63 0.86 0.17 0.00 -0.26 0.00 0.00 64.21 65.61 1uen n SER 42 CO 0.00 0.00 0.00 0.40 -0.16 0.00 0.00 175.04 175.28 1uen h ILE 43 N 0.00 1.29 0.00 -1.33 2.04 -0.41 0.12 117.51 119.21 1uen h ILE 43 Ca 0.00 -1.43 0.00 0.00 1.00 0.00 0.00 64.86 64.43 1uen h ILE 43 Cb 0.70 1.49 0.00 0.00 -0.74 0.00 0.00 36.82 38.26 1uen h ILE 43 CO 0.00 0.45 0.00 0.54 0.00 0.00 0.00 178.15 179.14 1uen n ARG 44 N -4.07 -1.35 -0.81 2.37 1.74 -0.37 -3.97 116.66 110.19 1uen n ARG 44 Ca -0.01 0.34 0.00 0.00 -0.77 0.00 0.00 57.85 57.41 1uen n ARG 44 Cb 0.46 -4.81 0.00 0.00 -1.02 0.00 0.00 32.46 27.09 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 0.01 1.95 3.65 -0.13 0.00 -1.26 -4.76 105.19 104.65 1uen n GLY 45 Ca 0.00 -0.89 -0.43 0.00 0.00 0.00 0.00 46.02 44.71 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 -5.99 2.29 0.08 1.61 3.76 -1.26 -5.00 115.29 110.79 1uen s HIS 46 Ca 0.00 0.53 -0.31 0.00 -0.15 0.00 0.00 55.06 55.13 1uen s HIS 46 Cb 0.00 -3.80 -0.10 0.00 1.11 0.00 0.00 32.58 29.79 1uen s HIS 46 CO 0.00 -2.96 1.91 -0.11 -0.85 0.00 0.00 174.74 172.73 1uen n LEU 47 N 7.22 4.12 0.03 0.89 -0.00 -1.26 -3.64 117.00 124.35 1uen n LEU 47 Ca 0.16 0.95 -0.12 0.00 -0.00 0.00 0.00 56.01 57.00 1uen n LEU 47 Cb 0.44 -1.54 -0.14 0.00 -0.00 0.00 0.00 43.42 42.18 1uen n LEU 47 CO 0.61 0.20 -0.30 1.56 -0.00 0.00 0.00 177.39 179.45 1uen h GLN 48 N 9.52 0.12 0.00 1.96 1.08 -1.42 -3.44 115.11 122.93 1uen h GLN 48 Ca -0.48 -0.20 0.00 0.00 -1.45 0.00 0.00 58.65 56.52 1uen h GLN 48 Cb 1.23 0.07 0.00 0.00 -0.05 0.00 0.00 27.48 28.73 1uen h GLN 48 CO 0.95 0.91 0.00 0.41 -0.95 0.00 0.00 178.83 180.14 1uen n GLY 49 N 1.57 -2.04 3.15 3.46 0.00 -1.23 -1.07 105.19 109.04 1uen n GLY 49 Ca -0.13 -1.43 -0.34 0.00 0.00 0.00 0.00 46.02 44.12 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 -1.96 3.16 -0.46 1.61 2.02 0.18 -1.97 117.35 119.93 1uen s TYR 50 Ca 0.00 -1.85 -0.24 0.00 -0.37 0.00 0.00 57.07 54.61 1uen s TYR 50 Cb 0.00 -2.03 0.03 0.00 -0.40 0.00 0.00 41.96 39.56 1uen s TYR 50 CO 0.00 -0.80 0.83 0.50 -1.57 0.00 0.00 175.55 174.51 1uen s ARG 51 N 1.24 3.41 -0.19 -0.62 3.52 0.26 -1.99 118.95 124.59 1uen s ARG 51 Ca -0.03 -0.09 -0.24 0.00 -0.13 0.00 0.00 55.73 55.23 1uen s ARG 51 Cb -0.18 -3.95 -0.01 0.00 -1.56 0.00 0.00 34.95 29.24 1uen s ARG 51 CO -0.04 -1.18 0.80 0.42 -0.81 0.00 0.00 175.30 174.49 1uen s ILE 52 N 3.44 4.89 0.26 4.11 1.01 -0.64 -1.53 121.20 132.74 1uen s ILE 52 Ca 0.31 1.56 -0.06 0.00 0.00 0.00 0.00 60.65 62.45 1uen s ILE 52 Cb -0.12 -4.11 -0.06 0.00 0.01 0.00 0.00 42.46 38.19 1uen s ILE 52 CO 0.23 0.01 0.54 -0.31 0.00 0.00 0.00 174.94 175.42 1uen s TYR 53 N 2.28 3.46 0.14 3.97 1.51 -1.23 -0.36 117.35 127.13 1uen s TYR 53 Ca 0.36 0.71 -0.24 0.00 -1.01 0.00 0.00 57.07 56.89 1uen s TYR 53 Cb -0.16 -2.15 0.07 0.00 -0.11 0.00 0.00 41.96 39.61 1uen s TYR 53 CO 0.11 0.21 0.63 1.52 -1.11 0.00 0.00 175.55 176.91 1uen s TYR 54 N -1.98 -0.53 0.02 2.71 1.13 -0.93 -0.58 117.35 117.19 1uen s TYR 54 Ca 0.45 0.34 -0.13 0.00 -1.41 0.00 0.00 57.07 56.32 1uen s TYR 54 Cb -0.11 0.55 0.02 0.00 -1.10 0.00 0.00 41.96 41.32 1uen s TYR 54 CO 0.27 -0.82 0.28 1.67 -2.51 0.00 0.00 175.55 174.44 1uen s TRP 55 N -3.62 -0.09 -0.11 -3.49 -2.14 -0.17 -0.96 118.94 108.35 1uen s TRP 55 Ca 0.01 0.00 -0.29 0.00 2.66 0.00 0.00 56.10 58.48 1uen s TRP 55 Cb -0.01 0.07 -0.04 0.00 -3.10 0.00 0.00 33.47 30.38 1uen s TRP 55 CO -0.12 -0.45 1.60 0.21 -2.66 0.00 0.00 176.95 175.54 1uen s LYS 56 N -2.14 4.08 0.14 3.25 2.47 -1.25 -2.62 119.74 123.66 1uen s LYS 56 Ca -0.08 1.99 -0.16 0.00 -1.56 0.00 0.00 55.97 56.16 1uen s LYS 56 Cb -0.02 -3.98 -0.07 0.00 -1.46 0.00 0.00 37.83 32.30 1uen s LYS 56 CO -0.01 -0.96 0.58 0.99 0.16 0.00 0.00 175.35 176.11 1uen s THR 57 N 4.32 4.79 0.00 3.43 2.01 -0.80 -4.87 115.64 124.52 1uen s THR 57 Ca 0.71 0.97 0.00 0.00 0.31 0.00 0.00 61.69 63.68 1uen s THR 57 Cb -0.30 -3.78 0.00 0.00 0.01 0.00 0.00 72.50 68.43 1uen s THR 57 CO 0.28 0.30 0.00 0.00 -0.69 0.00 0.00 174.62 174.50 1uen n GLN 58 N 0.97 0.00 -3.67 4.92 1.13 -1.26 -4.25 117.38 115.21 1uen n GLN 58 Ca -0.06 0.00 -0.12 0.00 -1.94 0.00 0.00 57.00 54.88 1uen n GLN 58 Cb 0.51 0.00 -0.06 0.00 0.11 0.00 0.00 30.24 30.80 1uen n GLN 58 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 1uen s SER 59 N 1.00 -0.24 0.00 1.08 0.15 -1.26 -4.94 113.70 109.49 1uen s SER 59 Ca 0.00 -0.12 0.00 0.00 0.70 0.00 0.00 55.95 56.53 1uen s SER 59 Cb 0.00 0.43 0.00 0.00 -1.71 0.00 0.00 66.02 64.74 1uen s SER 59 CO 0.00 -0.71 0.41 -0.24 1.20 0.00 0.00 173.24 173.90 1uen n SER 60 N 0.32 0.71 -3.94 5.45 2.88 -1.26 -4.91 113.62 112.86 1uen n SER 60 Ca -0.18 -1.14 -0.30 0.00 -1.33 0.00 0.00 58.87 55.92 1uen n SER 60 Cb 0.61 0.00 -0.16 0.00 -0.75 0.00 0.00 64.21 63.91 1uen n SER 60 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1uen s SER 61 N -0.14 3.51 -0.46 -3.46 0.15 -1.26 -4.91 113.70 107.13 1uen s SER 61 Ca 0.00 -0.99 -0.30 0.00 0.70 0.00 0.00 55.95 55.36 1uen s SER 61 Cb 0.00 -1.13 0.04 0.00 -1.71 0.00 0.00 66.02 63.22 1uen s SER 61 CO 0.00 -0.20 0.59 0.29 1.20 0.00 0.00 173.24 175.12 1uen n LYS 62 N 4.72 -1.67 -4.56 5.44 5.02 -1.26 -5.02 118.16 120.84 1uen n LYS 62 Ca -0.13 1.17 -0.23 0.00 -2.02 0.00 0.00 58.31 57.10 1uen n LYS 62 Cb 0.45 -1.82 -0.16 0.00 -0.02 0.00 0.00 35.03 33.49 1uen n LYS 62 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1uen s ARG 63 N -2.62 1.37 -0.07 1.97 1.81 -1.26 -5.11 118.95 115.04 1uen s ARG 63 Ca 0.29 -0.41 -0.30 0.00 -1.72 0.00 0.00 55.73 53.60 1uen s ARG 63 Cb -0.03 -1.21 -0.05 0.00 -0.45 0.00 0.00 34.95 33.22 1uen s ARG 63 CO 0.79 0.12 1.55 1.21 -0.68 0.00 0.00 175.30 178.29 1uen s ASN 64 N 0.30 6.74 -0.06 0.23 2.47 -1.26 -5.00 114.94 118.36 1uen s ASN 64 Ca -0.07 2.11 -0.24 0.00 0.42 0.00 0.00 52.86 55.09 1uen s ASN 64 Cb -0.11 -2.54 0.05 0.00 -1.45 0.00 0.00 41.25 37.20 1uen s ASN 64 CO 0.02 -0.88 0.53 -0.60 -3.72 0.00 0.00 177.10 172.46 1uen s ARG 65 N 3.80 0.87 0.00 0.43 3.00 -1.26 -5.12 118.95 120.67 1uen s ARG 65 Ca 0.69 0.16 0.00 0.00 -1.00 0.00 0.00 55.73 55.58 1uen s ARG 65 Cb -0.31 0.41 0.00 0.00 0.00 0.00 0.00 34.95 35.05 1uen s ARG 65 CO 0.26 -0.25 0.32 0.54 0.00 0.00 0.00 175.30 176.18 1uen n ARG 66 N 1.27 0.00 -3.83 5.12 3.00 -1.26 -5.02 116.66 115.93 1uen n ARG 66 Ca -0.19 0.03 -0.09 0.00 -0.01 0.00 0.00 57.85 57.59 1uen n ARG 66 Cb 0.57 -0.82 -0.05 0.00 0.00 0.00 0.00 32.46 32.15 1uen n ARG 66 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.63 174.25 1uen s HIS 67 N -0.64 0.08 -0.23 -1.55 -3.43 -1.26 -5.14 115.29 103.12 1uen s HIS 67 Ca 0.00 -0.43 -0.19 0.00 -0.80 0.00 0.00 55.06 53.64 1uen s HIS 67 Cb 0.00 0.24 -0.03 0.00 -1.43 0.00 0.00 32.58 31.36 1uen s HIS 67 CO 0.00 -0.87 0.54 0.42 -2.00 0.00 0.00 174.74 172.83 1uen s ILE 68 N -3.92 5.07 0.03 -5.38 1.01 -1.26 -5.05 121.20 111.71 1uen s ILE 68 Ca 0.13 0.96 -0.30 0.00 0.00 0.00 0.00 60.65 61.43 1uen s ILE 68 Cb 0.00 -3.85 -0.06 0.00 0.01 0.00 0.00 42.46 38.56 1uen s ILE 68 CO -0.01 0.12 1.30 -1.83 0.00 0.00 0.00 174.94 174.52 1uen s GLU 69 N 1.99 4.35 0.12 2.79 -1.05 -1.26 -5.05 118.70 120.58 1uen s GLU 69 Ca 0.23 1.87 0.04 0.00 -0.15 0.00 0.00 54.97 56.97 1uen s GLU 69 Cb -0.16 -3.44 -0.04 0.00 -0.44 0.00 0.00 34.13 30.06 1uen s GLU 69 CO 0.09 -0.42 -0.11 0.15 0.95 0.00 0.00 175.26 175.92 1uen s LYS 70 N 1.70 0.94 0.22 -4.83 1.02 -1.26 -3.96 119.74 113.57 1uen s LYS 70 Ca 0.61 -1.25 -0.01 0.00 0.02 0.00 0.00 55.97 55.33 1uen s LYS 70 Cb -0.31 -0.64 -0.04 0.00 -0.52 0.00 0.00 37.83 36.33 1uen s LYS 70 CO 0.27 0.10 0.18 0.15 -0.92 0.00 0.00 175.35 175.13 1uen s LYS 71 N -3.01 1.30 0.05 1.68 -0.14 -0.13 -5.01 119.74 114.47 1uen s LYS 71 Ca 0.09 -1.64 0.04 0.00 -1.36 0.00 0.00 55.97 53.10 1uen s LYS 71 Cb -0.02 0.29 -0.02 0.00 -1.68 0.00 0.00 37.83 36.40 1uen s LYS 71 CO 0.01 -0.44 -0.13 0.42 -0.76 0.00 0.00 175.35 174.45 1uen s ILE 72 N -4.06 0.98 0.05 2.17 1.09 -1.26 -2.19 121.20 117.98 1uen s ILE 72 Ca 0.38 -1.13 0.05 0.00 -1.10 0.00 0.00 60.65 58.85 1uen s ILE 72 Cb 0.06 -0.94 -0.02 0.00 -1.06 0.00 0.00 42.46 40.49 1uen s ILE 72 CO 0.13 -0.17 -0.14 -0.76 -0.10 0.00 0.00 174.94 173.91 1uen s LEU 73 N -1.46 2.21 -0.49 2.97 1.43 0.51 -5.00 118.68 118.86 1uen s LEU 73 Ca -0.02 -0.52 0.04 0.00 -1.03 0.00 0.00 54.13 52.60 1uen s LEU 73 Cb -0.09 -0.57 0.13 0.00 0.03 0.00 0.00 46.19 45.69 1uen s LEU 73 CO 0.02 -0.01 0.23 -0.89 0.23 0.00 0.00 176.35 175.92 1uen s THR 74 N -1.02 2.51 -1.18 5.49 2.01 -1.26 -1.62 115.64 120.57 1uen s THR 74 Ca 0.00 -3.16 -0.10 0.00 0.31 0.00 0.00 61.69 58.74 1uen s THR 74 Cb -0.09 -2.76 0.22 0.00 0.01 0.00 0.00 72.50 69.89 1uen s THR 74 CO 0.02 -0.77 1.43 0.49 -0.69 0.00 0.00 174.62 175.10 1uen n PHE 75 N 3.29 4.32 -2.12 4.92 3.72 -0.84 -5.00 117.46 125.75 1uen n PHE 75 Ca 0.05 -3.31 -0.38 0.00 -0.05 0.00 0.00 57.45 53.75 1uen n PHE 75 Cb 0.34 -1.88 -0.00 0.00 -0.94 0.00 0.00 39.48 37.00 1uen n PHE 75 CO 0.00 0.00 0.00 1.14 -0.05 0.00 0.00 176.76 177.85 1uen s GLN 76 N -0.10 3.78 0.00 -1.08 -2.07 -1.26 -0.64 119.66 118.28 1uen s GLN 76 Ca 0.37 1.99 0.00 0.00 -1.82 0.00 0.00 55.36 55.90 1uen s GLN 76 Cb -0.02 -2.55 0.00 0.00 -1.09 0.00 0.00 33.01 29.36 1uen s GLN 76 CO -0.01 -0.60 0.00 0.41 -1.32 0.00 0.00 175.29 173.78 1uen n GLY 77 N 0.60 0.08 0.35 2.60 0.00 -0.23 -4.78 105.19 103.80 1uen n GLY 77 Ca 0.06 -1.78 0.00 0.00 0.00 0.00 0.00 46.02 44.30 1uen n GLY 77 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1uen n SER 78 N -0.95 0.68 -4.30 1.61 7.64 -1.26 -4.30 113.62 112.73 1uen n SER 78 Ca 0.00 -1.96 -0.33 0.00 1.01 0.00 0.00 58.87 57.59 1uen n SER 78 Cb 0.00 -0.34 0.12 0.00 -1.01 0.00 0.00 64.21 62.98 1uen n SER 78 CO 0.00 0.00 0.00 2.29 -3.01 0.00 0.00 175.04 174.32 1uen n LYS 79 N -0.15 -0.64 0.00 1.43 0.00 -1.26 -4.98 118.16 112.56 1uen n LYS 79 Ca 0.00 -0.16 0.00 0.00 -0.00 0.00 0.00 58.31 58.15 1uen n LYS 79 Cb 0.17 -1.65 0.00 0.00 -0.00 0.00 0.00 35.03 33.55 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 -3.72 0.70 -3.89 0.58 -2.24 -1.26 -4.92 114.28 99.53 1uen n THR 80 Ca 0.03 -0.72 -0.09 0.00 -2.27 0.00 0.00 64.05 61.00 1uen n THR 80 Cb 0.58 0.66 -0.07 0.00 -2.10 0.00 0.00 70.33 69.41 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 -0.70 0.25 0.17 4.78 0.00 -1.26 -0.53 115.29 118.01 1uen s HIS 81 Ca 0.00 -0.63 -0.24 0.00 -3.00 0.00 0.00 55.06 51.20 1uen s HIS 81 Cb 0.00 0.01 0.06 0.00 -4.00 0.00 0.00 32.58 28.65 1uen s HIS 81 CO 0.00 -0.71 0.77 0.20 -1.00 0.00 0.00 174.74 174.00 1uen s GLY 82 N -2.93 -0.33 0.11 -1.38 0.00 -0.77 -5.00 107.32 97.03 1uen s GLY 82 Ca 0.13 0.22 0.07 0.00 0.00 0.00 0.00 44.72 45.13 1uen s GLY 82 CO -0.03 0.07 -0.07 1.06 0.00 0.00 0.00 173.10 174.12 1uen s MET 83 N -3.60 2.23 -0.80 2.90 -1.94 -1.26 -0.69 119.30 116.14 1uen s MET 83 Ca 0.08 -1.00 0.02 0.00 -1.71 0.00 0.00 55.69 53.07 1uen s MET 83 Cb -0.03 -2.35 0.20 0.00 2.01 0.00 0.00 34.83 34.65 1uen s MET 83 CO -0.02 0.51 0.64 1.28 -0.01 0.00 0.00 175.02 177.42 1uen n LEU 84 N 0.57 3.62 -4.91 -0.03 7.99 0.89 -4.96 117.00 120.17 1uen n LEU 84 Ca -0.12 -5.18 -0.27 0.00 -0.01 0.00 0.00 56.01 50.42 1uen n LEU 84 Cb 0.53 -0.92 0.01 0.00 -0.11 0.00 0.00 43.42 42.93 1uen n LEU 84 CO 0.35 1.67 0.49 -2.16 -1.51 0.00 0.00 177.39 176.23 1uen s PRO 85 N -1.46 3.24 0.00 3.23 0.04 -1.26 -2.71 135.00 136.08 1uen s PRO 85 Ca 0.27 0.10 0.00 0.00 0.04 0.00 0.00 61.00 61.41 1uen s PRO 85 Cb -0.05 -2.32 0.00 0.00 0.04 0.00 0.00 34.50 32.17 1uen s PRO 85 CO -0.15 -0.45 0.00 0.41 0.04 0.00 0.00 177.00 176.85 1uen n GLY 86 N -2.42 0.51 3.98 0.56 0.00 -1.25 -5.02 105.19 101.55 1uen n GLY 86 Ca 0.03 -0.50 -0.21 0.00 0.00 0.00 0.00 46.02 45.34 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 3.25 0.22 0.99 2.01 -1.26 -5.13 118.68 118.76 1uen s LEU 87 Ca 0.00 -0.11 0.02 0.00 0.01 0.00 0.00 54.13 54.05 1uen s LEU 87 Cb 0.00 -2.71 -0.04 0.00 0.01 0.00 0.00 46.19 43.46 1uen s LEU 87 CO 0.00 -1.22 0.37 -1.61 1.01 0.00 0.00 176.35 174.91 1uen s GLU 88 N -4.78 3.47 0.89 1.70 2.02 -1.26 -4.59 118.70 116.15 1uen s GLU 88 Ca 0.58 -0.52 -0.12 0.00 0.02 0.00 0.00 54.97 54.93 1uen s GLU 88 Cb -0.10 -2.86 0.17 0.00 0.10 0.00 0.00 34.13 31.44 1uen s GLU 88 CO 0.39 0.41 1.24 -1.25 0.02 0.00 0.00 175.26 176.06 1uen s PRO 89 N -3.59 0.98 -1.19 0.39 0.04 -1.12 -4.65 135.00 125.85 1uen s PRO 89 Ca 0.36 -0.53 -0.24 0.00 0.04 0.00 0.00 61.00 60.64 1uen s PRO 89 Cb -0.10 -1.97 0.03 0.00 0.04 0.00 0.00 34.50 32.51 1uen s PRO 89 CO 0.30 -2.13 0.45 0.34 0.04 0.00 0.00 177.00 176.00 1uen n PHE 90 N -3.52 -1.22 -3.75 0.56 7.35 -1.24 -4.97 117.46 110.67 1uen n PHE 90 Ca 0.15 0.18 -0.10 0.00 -0.76 0.00 0.00 57.45 56.91 1uen n PHE 90 Cb 0.60 -2.52 -0.07 0.00 0.35 0.00 0.00 39.48 37.84 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 -3.82 -0.08 0.25 -2.13 0.01 -1.26 -4.99 113.70 101.67 1uen s SER 91 Ca 0.33 -0.37 -0.09 0.00 1.31 0.00 0.00 55.95 57.13 1uen s SER 91 Cb -0.19 0.38 -0.07 0.00 0.21 0.00 0.00 66.02 66.35 1uen s SER 91 CO 0.90 -0.71 0.57 -2.28 0.41 0.00 0.00 173.24 172.12 1uen s HIS 92 N -3.28 3.43 0.08 2.43 2.46 -1.26 -2.03 115.29 117.12 1uen s HIS 92 Ca 0.00 0.87 0.03 0.00 0.47 0.00 0.00 55.06 56.42 1uen s HIS 92 Cb 0.02 -2.26 -0.03 0.00 -0.13 0.00 0.00 32.58 30.17 1uen s HIS 92 CO -0.08 0.24 -0.08 0.71 -2.47 0.00 0.00 174.74 173.05 1uen s TYR 93 N -1.88 0.87 -0.02 3.88 2.02 -0.14 -1.90 117.35 120.18 1uen s TYR 93 Ca 0.47 -0.68 0.05 0.00 -0.37 0.00 0.00 57.07 56.55 1uen s TYR 93 Cb -0.11 -0.50 -0.01 0.00 -0.40 0.00 0.00 41.96 40.94 1uen s TYR 93 CO 0.22 -0.08 -0.18 0.99 -1.57 0.00 0.00 175.55 174.94 1uen s THR 94 N -2.42 1.44 0.12 -0.71 2.01 -1.08 -1.81 115.64 113.19 1uen s THR 94 Ca 0.02 -0.77 -0.06 0.00 0.31 0.00 0.00 61.69 61.19 1uen s THR 94 Cb -0.03 -1.21 -0.02 0.00 0.01 0.00 0.00 72.50 71.25 1uen s THR 94 CO -0.01 0.41 0.15 -1.48 -0.69 0.00 0.00 174.62 173.00 1uen s LEU 95 N -0.32 1.53 0.00 4.42 -0.00 -0.50 -1.00 118.68 122.80 1uen s LEU 95 Ca 0.04 -0.90 0.04 0.00 -0.00 0.00 0.00 54.13 53.31 1uen s LEU 95 Cb -0.08 0.78 -0.01 0.00 -0.00 0.00 0.00 46.19 46.88 1uen s LEU 95 CO -0.00 -0.76 0.13 0.59 -0.00 0.00 0.00 176.35 176.31 1uen n ASN 96 N -0.09 0.48 -3.96 1.48 4.13 0.26 -0.23 115.26 117.33 1uen n ASN 96 Ca -0.10 -2.38 -0.16 0.00 1.68 0.00 0.00 54.58 53.61 1uen n ASN 96 Cb 0.63 0.82 -0.15 0.00 -1.54 0.00 0.00 39.78 39.54 1uen n ASN 96 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 1uen s VAL 97 N -2.66 0.43 -0.03 2.41 1.01 -1.26 -3.47 120.40 116.83 1uen s VAL 97 Ca 0.18 -0.23 -0.01 0.00 0.00 0.00 0.00 61.98 61.92 1uen s VAL 97 Cb 0.01 -0.37 0.03 0.00 0.00 0.00 0.00 36.38 36.05 1uen s VAL 97 CO 0.13 0.13 0.06 -0.60 0.00 0.00 0.00 175.10 174.82 1uen s ARG 98 N -0.08 -0.01 0.56 2.72 3.52 -0.58 -1.14 118.95 123.94 1uen s ARG 98 Ca 0.01 0.26 -0.17 0.00 -0.13 0.00 0.00 55.73 55.70 1uen s ARG 98 Cb -0.03 -0.26 -0.05 0.00 -1.56 0.00 0.00 34.95 33.05 1uen s ARG 98 CO -0.00 -0.19 1.05 0.14 -0.81 0.00 0.00 175.30 175.49 1uen s VAL 99 N 1.23 3.83 0.03 7.11 -7.23 -1.26 -0.57 120.40 123.54 1uen s VAL 99 Ca -0.07 0.94 0.01 0.00 -1.81 0.00 0.00 61.98 61.05 1uen s VAL 99 Cb -0.13 -3.42 -0.02 0.00 0.56 0.00 0.00 36.38 33.38 1uen s VAL 99 CO -0.04 -0.44 -0.05 -0.69 -0.31 0.00 0.00 175.10 173.57 1uen s VAL 100 N -2.33 0.32 0.00 1.32 1.01 -0.83 -3.73 120.40 116.16 1uen s VAL 100 Ca 0.64 -1.00 0.00 0.00 0.00 0.00 0.00 61.98 61.63 1uen s VAL 100 Cb -0.16 -0.43 0.00 0.00 0.00 0.00 0.00 36.38 35.79 1uen s VAL 100 CO 0.32 -0.44 0.00 -0.46 0.00 0.00 0.00 175.10 174.52 1uen n ASN 101 N 1.53 0.10 0.00 3.32 0.23 -1.05 -1.08 115.26 118.31 1uen n ASN 101 Ca -0.23 -0.89 0.00 0.00 -0.53 0.00 0.00 54.58 52.93 1uen n ASN 101 Cb 0.55 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.25 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 0.26 -0.29 0.76 4.83 0.00 -1.24 -3.42 105.19 106.09 1uen n GLY 102 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.01 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 -1.29 0.03 -1.24 1.61 3.00 -1.26 -5.12 118.16 113.88 1uen n LYS 103 Ca 0.00 0.01 0.00 0.00 -0.00 0.00 0.00 58.31 58.32 1uen n LYS 103 Cb 0.00 -0.65 0.00 0.00 0.00 0.00 0.00 35.03 34.38 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 3.02 0.74 3.98 3.14 0.00 -1.22 -5.03 105.19 109.82 1uen n GLY 104 Ca -0.03 -0.76 -0.20 0.00 0.00 0.00 0.00 46.02 45.03 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 -1.00 2.82 0.00 1.61 2.02 -1.26 -2.53 118.70 120.36 1uen s GLU 105 Ca 0.00 -0.83 0.00 0.00 0.02 0.00 0.00 54.97 54.16 1uen s GLU 105 Cb 0.00 -2.61 0.00 0.00 0.10 0.00 0.00 34.13 31.62 1uen s GLU 105 CO 0.00 -0.40 0.00 0.41 0.02 0.00 0.00 175.26 175.29 1uen n GLY 106 N -2.07 6.31 3.76 -1.39 0.00 -1.24 -4.55 105.19 106.00 1uen n GLY 106 Ca 0.05 -1.70 -0.35 0.00 0.00 0.00 0.00 46.02 44.01 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 3.07 0.43 1.61 0.04 -1.26 -4.91 135.00 135.25 1uen s PRO 107 Ca 0.00 1.72 0.01 0.00 0.04 0.00 0.00 61.00 62.77 1uen s PRO 107 Cb 0.00 -1.95 -0.00 0.00 0.04 0.00 0.00 34.50 32.58 1uen s PRO 107 CO 0.00 -1.10 0.64 0.00 0.04 0.00 0.00 177.00 176.57 1uen s ALA 108 N -1.72 3.84 1.20 8.56 0.00 -1.26 -3.16 121.76 129.22 1uen s ALA 108 Ca 0.75 -1.13 -0.19 0.00 0.00 0.00 0.00 51.96 51.39 1uen s ALA 108 Cb -0.27 -2.06 0.29 0.00 0.00 0.00 0.00 23.12 21.07 1uen s ALA 108 CO 0.32 -0.32 1.10 -1.54 0.00 0.00 0.00 175.76 175.32 1uen s SER 109 N -4.21 0.91 0.49 0.00 1.04 -0.29 -4.68 113.70 106.94 1uen s SER 109 Ca 0.48 0.69 -0.21 0.00 0.48 0.00 0.00 55.95 57.38 1uen s SER 109 Cb -0.10 -0.97 -0.10 0.00 0.10 0.00 0.00 66.02 64.95 1uen s SER 109 CO 0.37 -4.14 0.72 -2.65 0.98 0.00 0.00 173.24 168.52 1uen n PRO 110 N -4.78 0.81 -2.44 4.02 -0.02 -1.26 -4.17 135.00 127.16 1uen n PRO 110 Ca 0.12 0.30 -0.41 0.00 -2.02 0.00 0.00 63.50 61.50 1uen n PRO 110 Cb 0.59 -1.79 -0.03 0.00 -0.02 0.00 0.00 33.50 32.25 1uen n PRO 110 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1uen s ASP 111 N -0.99 5.99 0.73 2.55 1.11 -1.26 -4.55 116.67 120.26 1uen s ASP 111 Ca 0.66 -0.23 -0.11 0.00 0.18 0.00 0.00 52.55 53.05 1uen s ASP 111 Cb -0.52 -2.55 0.03 0.00 1.07 0.00 0.00 42.92 40.95 1uen s ASP 111 CO 0.55 -1.93 1.08 -0.13 1.18 0.00 0.00 175.17 175.93 1uen s ARG 112 N 5.96 2.63 0.08 8.23 1.81 0.68 -4.88 118.95 133.45 1uen s ARG 112 Ca 0.43 0.69 0.02 0.00 -1.72 0.00 0.00 55.73 55.15 1uen s ARG 112 Cb -0.09 -1.98 -0.04 0.00 -0.45 0.00 0.00 34.95 32.40 1uen s ARG 112 CO 0.17 -1.25 -0.07 0.14 -0.68 0.00 0.00 175.30 173.61 1uen s VAL 113 N -3.17 0.66 -0.06 3.52 -7.23 -1.26 -1.41 120.40 111.45 1uen s VAL 113 Ca 0.59 -1.71 -0.15 0.00 -1.81 0.00 0.00 61.98 58.89 1uen s VAL 113 Cb -0.13 -1.41 0.03 0.00 0.56 0.00 0.00 36.38 35.43 1uen s VAL 113 CO 0.54 -0.74 0.35 0.72 -0.31 0.00 0.00 175.10 175.66 1uen s PHE 114 N -3.03 -0.29 0.01 2.82 -0.71 -0.75 -4.84 117.98 111.19 1uen s PHE 114 Ca 0.06 0.56 0.03 0.00 -1.04 0.00 0.00 56.93 56.54 1uen s PHE 114 Cb 0.01 0.13 -0.04 0.00 -1.21 0.00 0.00 43.02 41.92 1uen s PHE 114 CO -0.03 -0.34 -0.04 0.54 -1.34 0.00 0.00 175.22 174.01 1uen s ASN 115 N -0.82 4.82 0.76 1.98 4.22 -1.26 -0.97 114.94 123.67 1uen s ASN 115 Ca -0.09 -0.11 -0.10 0.00 -2.14 0.00 0.00 52.86 50.42 1uen s ASN 115 Cb -0.04 -1.17 0.06 0.00 1.28 0.00 0.00 41.25 41.39 1uen s ASN 115 CO 0.03 0.27 1.12 0.42 -2.04 0.00 0.00 177.10 176.90 1uen s THR 116 N -1.06 2.30 0.00 0.54 -4.23 -0.86 -4.76 115.64 107.57 1uen s THR 116 Ca 0.19 -0.02 0.00 0.00 -1.18 0.00 0.00 61.69 60.68 1uen s THR 116 Cb -0.11 -3.07 0.00 0.00 1.34 0.00 0.00 72.50 70.66 1uen s THR 116 CO 0.10 -0.09 0.44 -0.81 -0.54 0.00 0.00 174.62 173.72 1uen n PRO 117 N -3.15 0.00 0.00 3.99 -0.04 -1.26 -4.62 135.00 129.92 1uen n PRO 117 Ca 0.08 0.25 0.00 0.00 -0.04 0.00 0.00 63.50 63.78 1uen n PRO 117 Cb 0.60 -1.04 0.00 0.00 -0.04 0.00 0.00 33.50 33.02 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 -1.24 0.00 0.00 0.54 2.13 -1.26 -4.72 120.64 116.09 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 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.71 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 -0.82 -1.62 1.64 8.31 0.00 -1.26 -3.68 105.19 107.75 1uen n GLY 119 Ca 0.00 -1.37 -0.03 0.00 0.00 0.00 0.00 46.02 44.62 1uen n GLY 119 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1uen n SER 120 N -1.02 -1.05 -4.93 1.61 2.88 -1.26 -4.96 113.62 104.88 1uen n SER 120 Ca 0.00 0.19 -0.25 0.00 -1.33 0.00 0.00 58.87 57.48 1uen n SER 120 Cb 0.00 -1.24 0.01 0.00 -0.75 0.00 0.00 64.21 62.23 1uen n SER 120 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1uen s GLY 121 N -1.49 1.51 0.91 0.46 0.00 -1.26 -5.08 107.32 102.36 1uen s GLY 121 Ca 0.00 -0.84 -0.12 0.00 0.00 0.00 0.00 44.72 43.76 1uen s GLY 121 CO 0.00 -0.67 1.10 2.56 0.00 0.00 0.00 173.10 176.09 1uen s PRO 122 N -4.62 1.16 -0.17 2.90 0.04 -1.26 -5.07 135.00 127.97 1uen s PRO 122 Ca 0.47 0.58 -0.04 0.00 0.04 0.00 0.00 61.00 62.05 1uen s PRO 122 Cb -0.10 -1.82 0.07 0.00 0.04 0.00 0.00 34.50 32.70 1uen s PRO 122 CO 0.40 -2.25 0.16 -1.12 0.04 0.00 0.00 177.00 174.24 1uen s SER 123 N -3.66 1.64 -0.08 6.66 0.01 -1.26 -5.13 113.70 111.88 1uen s SER 123 Ca 0.63 -0.29 -0.30 0.00 1.31 0.00 0.00 55.95 57.30 1uen s SER 123 Cb -0.17 0.14 0.07 0.00 0.21 0.00 0.00 66.02 66.27 1uen s SER 123 CO 0.56 -0.32 0.69 -0.55 0.41 0.00 0.00 173.24 174.03 1uen s SER 124 N 2.25 -0.67 0.00 2.44 0.15 -1.26 -5.33 113.70 111.28 1uen s SER 124 Ca 0.05 0.81 0.00 0.00 0.70 0.00 0.00 55.95 57.51 1uen s SER 124 Cb -0.15 0.66 0.00 0.00 -1.71 0.00 0.00 66.02 64.82 1uen s SER 124 CO -0.10 -0.56 0.00 0.61 1.20 0.00 0.00 173.24 174.39