#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1t2s n ALA 2 N 0.00 -1.11 -2.22 4.61 0.00 -1.26 -4.89 120.51 115.64 1t2s n ALA 2 Ca 0.00 0.27 -0.40 0.00 0.00 0.00 0.00 53.44 53.31 1t2s n ALA 2 Cb 0.00 -4.17 -0.03 0.00 0.00 0.00 0.00 19.45 15.25 1t2s n ALA 2 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 1t2s s MET 3 N -6.02 2.93 -0.41 0.00 -2.45 -1.26 -4.94 119.30 107.15 1t2s s MET 3 Ca 0.43 0.43 -0.16 0.00 -1.25 0.00 0.00 55.69 55.14 1t2s s MET 3 Cb -0.20 -4.28 0.02 0.00 1.25 0.00 0.00 34.83 31.62 1t2s s MET 3 CO 0.54 -2.39 0.36 0.00 1.05 0.00 0.00 175.02 174.58 1t2s s ALA 4 N 7.58 3.46 -0.30 4.11 0.00 -1.26 -1.91 121.76 133.45 1t2s s ALA 4 Ca 0.58 -1.62 -0.10 0.00 0.00 0.00 0.00 51.96 50.82 1t2s s ALA 4 Cb -0.12 -2.96 -0.02 0.00 0.00 0.00 0.00 23.12 20.02 1t2s s ALA 4 CO 0.21 -1.51 0.15 -1.64 0.00 0.00 0.00 175.76 172.98 1t2s s MET 5 N 1.89 3.52 0.10 0.00 -1.94 0.82 -4.89 119.30 118.80 1t2s s MET 5 Ca 0.08 -0.60 -0.36 0.00 -1.71 0.00 0.00 55.69 53.11 1t2s s MET 5 Cb -0.18 -3.56 -0.16 0.00 2.01 0.00 0.00 34.83 32.93 1t2s s MET 5 CO 0.12 -0.34 1.34 -2.30 -0.01 0.00 0.00 175.02 173.83 1t2s n PRO 6 N 5.00 1.26 -0.13 2.03 -0.02 -1.26 -0.08 135.00 141.79 1t2s n PRO 6 Ca -0.14 0.45 0.09 0.00 -2.02 0.00 0.00 63.50 61.88 1t2s n PRO 6 Cb 0.50 -2.09 0.43 0.00 -0.02 0.00 0.00 33.50 32.32 1t2s n PRO 6 CO 0.00 0.00 0.00 1.98 1.98 0.00 0.00 175.50 179.46 1t2s h MET 7 N 4.55 0.56 -0.42 -0.52 4.05 -0.92 0.28 114.93 122.51 1t2s h MET 7 Ca -0.47 -0.03 -0.15 0.00 -0.28 0.00 0.00 59.70 58.77 1t2s h MET 7 Cb 1.33 -0.13 -0.01 0.00 -0.80 0.00 0.00 31.60 31.99 1t2s h MET 7 CO 0.78 0.37 -0.32 0.82 0.23 0.00 0.00 176.91 178.79 1t2s h ILE 8 N 0.58 1.27 -0.04 1.77 1.08 -1.80 -2.66 117.51 117.71 1t2s h ILE 8 Ca 0.29 -1.49 -0.15 0.00 -0.39 0.00 0.00 64.86 63.13 1t2s h ILE 8 Cb 0.39 1.30 -0.01 0.00 -3.07 0.00 0.00 36.82 35.42 1t2s h ILE 8 CO -0.09 0.50 -0.63 -0.08 -0.69 0.00 0.00 178.15 177.16 1t2s h GLU 9 N 0.78 0.16 -0.66 2.37 4.81 -1.23 -1.71 114.58 119.11 1t2s h GLU 9 Ca 0.08 -0.12 0.03 0.00 -0.13 0.00 0.00 59.36 59.21 1t2s h GLU 9 Cb 0.91 0.02 -0.04 0.00 0.63 0.00 0.00 28.75 30.27 1t2s h GLU 9 CO 0.08 0.74 0.41 -0.92 -0.73 0.00 0.00 179.01 178.60 1t2s h TYR 10 N 0.12 0.77 -0.55 0.92 3.20 -0.47 -0.62 116.97 120.34 1t2s h TYR 10 Ca -0.01 0.02 -0.08 0.00 3.14 0.00 0.00 58.73 61.81 1t2s h TYR 10 Cb 1.14 -0.25 -0.02 0.00 1.54 0.00 0.00 36.73 39.13 1t2s h TYR 10 CO 0.02 0.45 0.04 -0.07 -1.64 0.00 0.00 178.16 176.96 1t2s h LEU 11 N 0.81 0.91 0.21 2.82 3.38 -1.16 -1.37 115.31 120.91 1t2s h LEU 11 Ca 0.26 -0.28 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 1t2s h LEU 11 Cb 0.00 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.51 1t2s h LEU 11 CO -0.10 0.97 -0.13 -0.33 0.09 0.00 0.00 178.44 178.94 1t2s h GLU 12 N 0.82 -0.32 -0.02 1.13 5.08 -0.80 0.35 114.58 120.81 1t2s h GLU 12 Ca 0.16 0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.52 1t2s h GLU 12 Cb 0.47 0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.80 1t2s h GLU 12 CO 0.02 -0.22 -0.08 0.00 -1.00 0.00 0.00 179.01 177.73 1t2s h ARG 13 N -0.33 0.10 0.00 2.33 3.08 -1.11 -2.57 114.38 115.87 1t2s h ARG 13 Ca -0.02 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 59.96 1t2s h ARG 13 Cb 0.28 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.34 1t2s h ARG 13 CO 0.02 0.72 -0.61 1.19 -1.07 0.00 0.00 179.97 180.22 1t2s n PHE 14 N -4.68 0.00 0.03 3.04 3.72 -0.53 -4.42 117.46 114.62 1t2s n PHE 14 Ca -0.09 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.19 1t2s n PHE 14 Cb 0.37 -0.30 -0.08 0.00 -0.94 0.00 0.00 39.48 38.52 1t2s n PHE 14 CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 176.76 177.48 1t2s h SER 15 N -0.61 -0.02 0.00 4.37 0.02 -1.42 -3.28 113.55 112.61 1t2s h SER 15 Ca 0.00 -0.17 0.00 0.00 -0.84 0.00 0.00 61.79 60.78 1t2s h SER 15 Cb 0.61 0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.16 1t2s h SER 15 CO 0.00 0.16 -1.65 0.18 -1.14 0.00 0.00 176.83 174.38 1t2s n LEU 16 N -5.02 0.33 -0.36 5.07 4.77 0.12 -4.95 117.00 116.97 1t2s n LEU 16 Ca -0.08 -0.17 -0.05 0.00 -0.03 0.00 0.00 56.01 55.69 1t2s n LEU 16 Cb 0.12 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.19 1t2s n LEU 16 CO 0.33 0.08 -0.04 0.29 -1.33 0.00 0.00 177.39 176.72 1t2s n LYS 17 N -2.00 -1.21 -3.80 3.23 4.76 -1.20 -4.94 118.16 113.00 1t2s n LYS 17 Ca -0.01 0.55 -0.13 0.00 -2.87 0.00 0.00 58.31 55.85 1t2s n LYS 17 Cb 0.48 -4.58 -0.09 0.00 -1.84 0.00 0.00 35.03 29.00 1t2s n LYS 17 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1t2s s ALA 18 N -1.73 -0.62 0.16 7.82 0.00 -0.97 -4.99 121.76 121.43 1t2s s ALA 18 Ca 0.00 0.18 -0.30 0.00 0.00 0.00 0.00 51.96 51.84 1t2s s ALA 18 Cb 0.00 0.07 -0.08 0.00 0.00 0.00 0.00 23.12 23.11 1t2s s ALA 18 CO 0.00 -0.24 1.21 0.21 0.00 0.00 0.00 175.76 176.95 1t2s s LYS 19 N -1.29 4.47 -0.05 0.00 2.20 -1.26 -4.02 119.74 119.80 1t2s s LYS 19 Ca -0.13 1.87 -0.30 0.00 -0.36 0.00 0.00 55.97 57.05 1t2s s LYS 19 Cb -0.06 -3.26 -0.03 0.00 -1.51 0.00 0.00 37.83 32.97 1t2s s LYS 19 CO 0.03 -0.14 1.10 0.42 -0.36 0.00 0.00 175.35 176.40 1t2s s ILE 20 N 0.23 4.49 0.21 5.43 1.01 -1.26 -5.02 121.20 126.29 1t2s s ILE 20 Ca 0.55 1.79 0.01 0.00 0.00 0.00 0.00 60.65 62.99 1t2s s ILE 20 Cb -0.32 -4.15 -0.00 0.00 0.01 0.00 0.00 42.46 38.00 1t2s s ILE 20 CO 0.35 0.04 0.04 0.59 0.00 0.00 0.00 174.94 175.96 1t2s n ASN 21 N 4.76 1.78 0.14 3.58 3.02 -1.26 -5.02 115.26 122.26 1t2s n ASN 21 Ca 0.09 -2.02 0.12 0.00 -0.03 0.00 0.00 54.58 52.74 1t2s n ASN 21 Cb 0.48 0.34 0.51 0.00 -0.61 0.00 0.00 39.78 40.50 1t2s n ASN 21 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 1t2s n ASN 22 N -1.51 0.68 -1.33 6.41 6.94 -1.26 -2.43 115.26 122.76 1t2s n ASN 22 Ca -0.06 0.69 0.07 0.00 -0.02 0.00 0.00 54.58 55.26 1t2s n ASN 22 Cb 0.29 -0.82 0.28 0.00 -2.36 0.00 0.00 39.78 37.17 1t2s n ASN 22 CO 0.00 0.00 0.00 0.35 -1.03 0.00 0.00 177.26 176.58 1t2s n THR 23 N -2.27 1.48 -2.51 5.53 -2.24 -1.26 -4.91 114.28 108.10 1t2s n THR 23 Ca 0.02 -0.93 -0.41 0.00 -2.27 0.00 0.00 64.05 60.46 1t2s n THR 23 Cb 0.21 0.01 -0.04 0.00 -2.10 0.00 0.00 70.33 68.41 1t2s n THR 23 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1t2s s THR 24 N -1.82 3.81 -0.36 4.28 -4.23 -1.02 -4.93 115.64 111.36 1t2s s THR 24 Ca 0.40 1.59 0.05 0.00 -1.18 0.00 0.00 61.69 62.55 1t2s s THR 24 Cb 0.26 -4.02 0.55 0.00 1.34 0.00 0.00 72.50 70.64 1t2s s THR 24 CO 0.19 0.29 1.69 -0.46 -0.54 0.00 0.00 174.62 175.79 1t2s n ASN 25 N 2.20 3.82 0.00 3.99 6.94 -1.26 -4.43 115.26 126.52 1t2s n ASN 25 Ca 0.02 -3.18 0.07 0.00 -0.02 0.00 0.00 54.58 51.47 1t2s n ASN 25 Cb 0.46 -0.75 0.36 0.00 -2.36 0.00 0.00 39.78 37.49 1t2s n ASN 25 CO 0.00 0.00 0.00 0.18 -1.03 0.00 0.00 177.26 176.41 1t2s n LEU 26 N -0.57 0.00 0.05 -4.53 4.77 -1.26 -2.99 117.00 112.47 1t2s n LEU 26 Ca 0.43 0.31 -0.15 0.00 -0.03 0.00 0.00 56.01 56.57 1t2s n LEU 26 Cb 1.36 -0.31 -0.09 0.00 -2.33 0.00 0.00 43.42 42.05 1t2s n LEU 26 CO 0.44 -0.16 0.54 0.44 -1.33 0.00 0.00 177.39 177.32 1t2s h ASP 27 N 0.00 -1.54 1.28 -1.43 5.19 -1.81 0.13 116.42 118.24 1t2s h ASP 27 Ca 0.00 0.18 0.00 0.00 -0.62 0.00 0.00 57.03 56.59 1t2s h ASP 27 Cb 0.15 0.59 0.00 0.00 0.18 0.00 0.00 39.33 40.25 1t2s h ASP 27 CO 0.00 -0.50 -0.15 -1.22 -3.12 0.00 0.00 179.24 174.25 1t2s n TYR 28 N -5.46 0.75 0.12 4.55 4.01 -1.16 -3.41 117.16 116.56 1t2s n TYR 28 Ca -0.07 0.22 0.04 0.00 -0.16 0.00 0.00 57.90 57.93 1t2s n TYR 28 Cb 0.39 -0.83 0.02 0.00 -0.31 0.00 0.00 39.34 38.61 1t2s n TYR 28 CO 0.00 0.00 0.00 0.77 -0.46 0.00 0.00 176.86 177.17 1t2s h SER 29 N 0.00 0.00 -0.62 7.72 0.02 -1.43 -3.32 113.55 115.91 1t2s h SER 29 Ca 0.00 0.00 0.14 0.00 -0.84 0.00 0.00 61.79 61.09 1t2s h SER 29 Cb 0.71 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.22 1t2s h SER 29 CO 0.00 0.39 0.43 -0.09 -1.14 0.00 0.00 176.83 176.42 1t2s h ARG 30 N 0.00 0.21 0.00 3.45 9.65 -0.79 0.15 114.38 127.05 1t2s h ARG 30 Ca -0.04 -0.01 -0.07 0.00 -1.10 0.00 0.00 59.98 58.75 1t2s h ARG 30 Cb 1.34 -0.05 -0.01 0.00 -1.39 0.00 0.00 29.97 29.86 1t2s h ARG 30 CO 0.04 0.14 -0.34 -0.09 2.80 0.00 0.00 179.97 182.52 1t2s h ARG 31 N 0.22 0.00 -0.01 0.20 2.43 -1.80 -0.38 114.38 115.04 1t2s h ARG 31 Ca 0.30 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.47 1t2s h ARG 31 Cb 0.87 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.42 1t2s h ARG 31 CO -0.06 0.34 -0.61 1.19 -1.51 0.00 0.00 179.97 179.33 1t2s n PHE 32 N -4.06 0.00 0.10 2.20 3.72 0.40 -3.51 117.46 116.32 1t2s n PHE 32 Ca -0.02 0.00 0.04 0.00 -0.05 0.00 0.00 57.45 57.42 1t2s n PHE 32 Cb 0.39 -0.09 -0.00 0.00 -0.94 0.00 0.00 39.48 38.84 1t2s n PHE 32 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 1t2s h LEU 33 N 0.81 0.00 -0.59 4.37 3.38 -0.42 -3.35 115.31 119.51 1t2s h LEU 33 Ca 0.00 0.00 0.11 0.00 0.09 0.00 0.00 57.88 58.08 1t2s h LEU 33 Cb 0.56 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 41.20 1t2s h LEU 33 CO 0.00 0.41 -0.28 -0.33 0.09 0.00 0.00 178.44 178.33 1t2s h GLU 34 N 0.00 -0.12 -0.34 1.13 5.08 -1.14 -1.48 114.58 117.71 1t2s h GLU 34 Ca -0.06 0.01 0.10 0.00 -1.00 0.00 0.00 59.36 58.41 1t2s h GLU 34 Cb 1.37 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.63 1t2s h GLU 34 CO 0.04 -0.08 0.30 -1.35 -1.00 0.00 0.00 179.01 176.92 1t2s h PRO 35 N -0.12 0.00 0.05 2.33 0.11 -1.77 0.22 132.00 132.81 1t2s h PRO 35 Ca 0.25 0.00 -0.27 0.00 0.11 0.00 0.00 66.00 66.09 1t2s h PRO 35 Cb 0.53 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.62 1t2s h PRO 35 CO -0.67 0.00 -1.39 0.35 -0.21 0.00 0.00 178.00 176.08 1t2s h PHE 36 N 0.00 0.19 -0.00 0.65 3.57 -1.58 -3.28 116.94 116.49 1t2s h PHE 36 Ca 0.16 -0.14 0.00 0.00 3.53 0.00 0.00 57.97 61.52 1t2s h PHE 36 Cb 0.76 -0.01 0.00 0.00 2.79 0.00 0.00 35.95 39.49 1t2s h PHE 36 CO 0.00 1.16 -0.06 1.28 -2.23 0.00 0.00 178.31 178.46 1t2s n LEU 37 N -3.32 0.17 -4.60 0.59 4.32 0.32 -4.78 117.00 109.70 1t2s n LEU 37 Ca -0.11 0.21 -0.43 0.00 -0.02 0.00 0.00 56.01 55.66 1t2s n LEU 37 Cb 1.01 -0.27 -0.03 0.00 -1.62 0.00 0.00 43.42 42.51 1t2s n LEU 37 CO 0.48 0.03 1.54 -0.60 -1.22 0.00 0.00 177.39 177.63 1t2s s ARG 38 N -2.61 3.34 0.00 3.23 3.52 0.50 -2.93 118.95 124.00 1t2s s ARG 38 Ca 0.26 1.47 0.00 0.00 -0.13 0.00 0.00 55.73 57.33 1t2s s ARG 38 Cb 0.20 -4.20 0.00 0.00 -1.56 0.00 0.00 34.95 29.39 1t2s s ARG 38 CO 0.48 -1.85 0.00 0.41 -0.81 0.00 0.00 175.30 173.53 1t2s n GLY 39 N 5.43 0.91 3.81 8.12 0.00 0.32 -5.03 105.19 118.75 1t2s n GLY 39 Ca 0.23 -0.56 -0.22 0.00 0.00 0.00 0.00 46.02 45.47 1t2s n GLY 39 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1t2s s ILE 40 N -2.83 3.11 -0.14 -0.61 -4.36 -1.08 -4.91 121.20 110.38 1t2s s ILE 40 Ca 0.00 -1.49 0.02 0.00 -0.26 0.00 0.00 60.65 58.91 1t2s s ILE 40 Cb 0.00 -3.07 0.00 0.00 1.25 0.00 0.00 42.46 40.64 1t2s s ILE 40 CO 0.00 -0.13 -0.19 0.54 0.24 0.00 0.00 174.94 175.40 1t2s s ASN 41 N -3.97 3.36 -0.04 4.36 2.20 -1.26 -0.03 114.94 119.56 1t2s s ASN 41 Ca 0.41 -0.53 0.03 0.00 -0.94 0.00 0.00 52.86 51.83 1t2s s ASN 41 Cb -0.04 -1.49 0.00 0.00 -2.00 0.00 0.00 41.25 37.73 1t2s s ASN 41 CO 0.25 0.10 -0.11 0.68 -2.94 0.00 0.00 177.10 175.08 1t2s s VAL 42 N 0.73 0.98 -0.25 3.54 -7.23 -0.74 -3.20 120.40 114.22 1t2s s VAL 42 Ca -0.08 -0.45 -0.26 0.00 -1.81 0.00 0.00 61.98 59.37 1t2s s VAL 42 Cb -0.16 -0.87 0.00 0.00 0.56 0.00 0.00 36.38 35.91 1t2s s VAL 42 CO 0.01 0.30 0.92 0.54 -0.31 0.00 0.00 175.10 176.56 1t2s s VAL 43 N 0.28 4.75 -0.66 1.32 0.11 0.11 -0.28 120.40 126.02 1t2s s VAL 43 Ca -0.06 1.72 -0.24 0.00 -2.93 0.00 0.00 61.98 60.47 1t2s s VAL 43 Cb -0.11 -4.21 0.06 0.00 -1.53 0.00 0.00 36.38 30.59 1t2s s VAL 43 CO 0.01 -0.16 1.03 -0.47 -3.33 0.00 0.00 175.10 172.18 1t2s s TYR 44 N 3.05 2.61 -0.50 1.54 5.04 0.82 -1.48 117.35 128.43 1t2s s TYR 44 Ca 0.39 -0.39 -0.17 0.00 -2.44 0.00 0.00 57.07 54.46 1t2s s TYR 44 Cb -0.15 -4.34 0.07 0.00 0.35 0.00 0.00 41.96 37.90 1t2s s TYR 44 CO 0.08 -1.70 0.53 0.99 -1.34 0.00 0.00 175.55 174.11 1t2s s THR 45 N 4.39 5.04 0.28 4.34 2.01 -0.83 -2.15 115.64 128.71 1t2s s THR 45 Ca 0.26 -0.85 -0.30 0.00 0.31 0.00 0.00 61.69 61.11 1t2s s THR 45 Cb -0.15 -4.25 -0.10 0.00 0.01 0.00 0.00 72.50 68.01 1t2s s THR 45 CO 0.12 -0.75 1.43 -2.84 -0.69 0.00 0.00 174.62 171.89 1t2s s PRO 46 N 2.15 4.26 0.62 4.92 0.02 -1.26 -4.87 135.00 140.84 1t2s s PRO 46 Ca 0.09 2.33 -0.18 0.00 0.02 0.00 0.00 61.00 63.27 1t2s s PRO 46 Cb -0.23 -3.08 -0.04 0.00 0.02 0.00 0.00 34.50 31.17 1t2s s PRO 46 CO 0.08 -0.41 0.97 -2.30 -0.33 0.00 0.00 177.00 175.02 1t2s n PRO 47 N 1.88 0.84 -0.35 5.54 -0.02 -1.26 -4.79 135.00 136.84 1t2s n PRO 47 Ca 0.05 0.33 0.14 0.00 -2.02 0.00 0.00 63.50 62.01 1t2s n PRO 47 Cb 0.40 -2.19 0.34 0.00 -0.02 0.00 0.00 33.50 32.03 1t2s n PRO 47 CO 0.00 0.00 0.00 -0.56 1.98 0.00 0.00 175.50 176.92 1t2s h GLN 48 N 0.37 0.67 0.00 -0.52 3.07 -1.95 0.25 115.11 116.99 1t2s h GLN 48 Ca -0.49 -0.04 0.00 0.00 0.09 0.00 0.00 58.65 58.21 1t2s h GLN 48 Cb 1.36 -0.15 0.00 0.00 0.08 0.00 0.00 27.48 28.77 1t2s h GLN 48 CO 0.50 0.44 0.00 0.43 0.09 0.00 0.00 178.83 180.29 1t2s n SER 49 N -4.82 0.00 -0.01 0.06 7.64 -1.26 -1.36 113.62 113.87 1t2s n SER 49 Ca 0.24 0.19 -0.10 0.00 1.01 0.00 0.00 58.87 60.22 1t2s n SER 49 Cb 0.63 -0.31 -0.14 0.00 -1.01 0.00 0.00 64.21 63.38 1t2s n SER 49 CO 0.00 0.00 0.00 -0.26 -3.01 0.00 0.00 175.04 171.77 1t2s h PHE 50 N 0.00 0.04 -2.95 1.43 -1.00 -0.78 -3.48 116.94 110.20 1t2s h PHE 50 Ca 0.00 -0.03 -0.33 0.00 2.81 0.00 0.00 57.97 60.42 1t2s h PHE 50 Cb 0.10 -0.00 -0.04 0.00 3.61 0.00 0.00 35.95 39.61 1t2s h PHE 50 CO 0.00 1.06 -0.40 1.04 -1.61 0.00 0.00 178.31 178.40 1t2s n GLN 51 N -3.10 -1.83 -3.33 1.51 3.00 -0.46 -4.97 117.38 108.20 1t2s n GLN 51 Ca -0.17 0.84 -0.21 0.00 -0.01 0.00 0.00 57.00 57.45 1t2s n GLN 51 Cb 1.05 -5.40 -0.00 0.00 0.00 0.00 0.00 30.24 25.89 1t2s n GLN 51 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 1t2s s SER 52 N -2.12 5.98 -0.18 1.08 0.15 -1.26 -5.08 113.70 112.28 1t2s s SER 52 Ca 0.00 0.07 -0.17 0.00 0.70 0.00 0.00 55.95 56.56 1t2s s SER 52 Cb 0.00 -1.48 -0.04 0.00 -1.71 0.00 0.00 66.02 62.79 1t2s s SER 52 CO 0.00 -0.48 0.42 0.00 1.20 0.00 0.00 173.24 174.38 1t2s s ALA 53 N -2.31 3.54 0.25 5.45 0.00 -1.26 -4.66 121.76 122.77 1t2s s ALA 53 Ca 0.45 -0.42 -0.30 0.00 0.00 0.00 0.00 51.96 51.69 1t2s s ALA 53 Cb -0.10 -2.64 -0.10 0.00 0.00 0.00 0.00 23.12 20.28 1t2s s ALA 53 CO 0.34 -0.21 1.46 -2.14 0.00 0.00 0.00 175.76 175.21 1t2s s PRO 54 N 1.10 4.25 0.00 0.00 0.02 -1.26 -4.84 135.00 134.28 1t2s s PRO 54 Ca 0.21 2.33 0.01 0.00 0.02 0.00 0.00 61.00 63.57 1t2s s PRO 54 Cb -0.15 -3.10 -0.00 0.00 0.02 0.00 0.00 34.50 31.27 1t2s s PRO 54 CO 0.08 -0.44 -0.03 0.50 -0.33 0.00 0.00 177.00 176.78 1t2s s ARG 55 N -0.39 0.25 0.08 5.54 3.52 -0.91 -4.92 118.95 122.11 1t2s s ARG 55 Ca 0.60 -0.17 -0.27 0.00 -0.13 0.00 0.00 55.73 55.75 1t2s s ARG 55 Cb -0.42 -0.20 -0.06 0.00 -1.56 0.00 0.00 34.95 32.71 1t2s s ARG 55 CO 0.44 0.05 0.85 0.08 -0.81 0.00 0.00 175.30 175.91 1t2s s VAL 56 N -0.23 4.62 0.02 7.11 1.01 -1.26 -0.13 120.40 131.54 1t2s s VAL 56 Ca -0.01 1.82 0.09 0.00 0.00 0.00 0.00 61.98 63.88 1t2s s VAL 56 Cb -0.02 -4.21 -0.03 0.00 0.00 0.00 0.00 36.38 32.13 1t2s s VAL 56 CO -0.00 0.35 -0.26 -0.31 0.00 0.00 0.00 175.10 174.88 1t2s s TYR 57 N -0.07 2.34 -0.57 5.22 2.02 0.61 -4.92 117.35 121.98 1t2s s TYR 57 Ca 0.42 -0.41 -0.25 0.00 -0.37 0.00 0.00 57.07 56.46 1t2s s TYR 57 Cb -0.22 -1.43 0.04 0.00 -0.40 0.00 0.00 41.96 39.95 1t2s s TYR 57 CO 0.26 0.08 1.02 0.50 -1.57 0.00 0.00 175.55 175.83 1t2s s ARG 58 N -1.03 3.36 -0.18 -0.62 6.06 -1.26 -1.80 118.95 123.47 1t2s s ARG 58 Ca 0.11 -0.17 -0.29 0.00 -2.50 0.00 0.00 55.73 52.88 1t2s s ARG 58 Cb -0.10 -4.06 -0.02 0.00 0.06 0.00 0.00 34.95 30.83 1t2s s ARG 58 CO 0.01 -1.57 1.44 0.08 -2.50 0.00 0.00 175.30 172.75 1t2s s VAL 59 N 4.26 3.97 0.06 7.11 1.01 0.95 -4.62 120.40 133.15 1t2s s VAL 59 Ca 0.33 1.14 -0.09 0.00 0.00 0.00 0.00 61.98 63.36 1t2s s VAL 59 Cb -0.11 -3.84 -0.31 0.00 0.00 0.00 0.00 36.38 32.11 1t2s s VAL 59 CO 0.20 -0.22 1.09 -1.13 0.00 0.00 0.00 175.10 175.04 1t2s h ASN 60 N 9.29 0.61 0.00 3.32 -0.00 -1.79 0.99 115.58 128.00 1t2s h ASN 60 Ca -0.31 -0.65 0.00 0.00 -0.00 0.00 0.00 56.30 55.35 1t2s h ASN 60 Cb 1.13 -0.20 0.00 0.00 -0.00 0.00 0.00 38.32 39.25 1t2s h ASN 60 CO 0.99 1.50 0.00 0.61 -0.00 0.00 0.00 177.43 180.53 1t2s n GLY 61 N 1.58 -0.76 3.28 1.57 0.00 -1.12 -4.14 105.19 105.60 1t2s n GLY 61 Ca -0.12 -0.20 -0.23 0.00 0.00 0.00 0.00 46.02 45.47 1t2s n GLY 61 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1t2s s LEU 62 N 0.00 2.31 0.21 0.99 1.43 -1.26 -0.41 118.68 121.95 1t2s s LEU 62 Ca 0.00 -0.69 -0.20 0.00 -1.03 0.00 0.00 54.13 52.20 1t2s s LEU 62 Cb 0.00 -0.86 -0.08 0.00 0.03 0.00 0.00 46.19 45.28 1t2s s LEU 62 CO 0.00 0.04 0.73 -0.44 0.23 0.00 0.00 176.35 176.91 1t2s s SER 63 N -1.94 7.09 0.00 2.29 0.01 0.43 -4.70 113.70 116.87 1t2s s SER 63 Ca 0.06 1.44 0.09 0.00 1.31 0.00 0.00 55.95 58.86 1t2s s SER 63 Cb -0.10 -2.43 0.43 0.00 0.21 0.00 0.00 66.02 64.13 1t2s s SER 63 CO 0.04 0.05 1.18 -1.14 0.41 0.00 0.00 173.24 173.79 1t2s n ARG 64 N 0.83 0.10 -4.82 12.44 3.00 -1.26 -3.95 116.66 122.99 1t2s n ARG 64 Ca -0.03 0.24 -0.29 0.00 -0.00 0.00 0.00 57.85 57.77 1t2s n ARG 64 Cb 0.51 -1.50 -0.17 0.00 0.00 0.00 0.00 32.46 31.30 1t2s n ARG 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1t2s s ALA 65 N -2.67 1.75 0.88 5.13 0.00 -1.26 -5.02 121.76 120.56 1t2s s ALA 65 Ca 0.07 -0.72 -0.11 0.00 0.00 0.00 0.00 51.96 51.20 1t2s s ALA 65 Cb 0.06 -0.73 0.12 0.00 0.00 0.00 0.00 23.12 22.57 1t2s s ALA 65 CO 0.14 0.14 1.16 -2.14 0.00 0.00 0.00 175.76 175.06 1t2s s PRO 66 N 0.60 1.27 0.59 0.00 0.02 -1.26 -3.06 135.00 133.17 1t2s s PRO 66 Ca -0.15 1.57 0.37 0.00 0.02 0.00 0.00 61.00 62.81 1t2s s PRO 66 Cb -0.17 -1.75 1.84 0.00 0.02 0.00 0.00 34.50 34.44 1t2s s PRO 66 CO 0.05 -2.45 2.17 0.00 -0.33 0.00 0.00 177.00 176.44 1t2s h ALA 67 N -1.57 1.07 0.00 -1.55 0.00 -1.11 -0.01 119.26 116.09 1t2s h ALA 67 Ca -0.44 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1t2s h ALA 67 Cb 1.27 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1t2s h ALA 67 CO 0.43 0.03 -0.15 0.77 0.00 0.00 0.00 179.25 180.34 1t2s h SER 68 N 0.00 0.00 0.00 0.00 0.02 -1.71 -2.21 113.55 109.65 1t2s h SER 68 Ca -0.00 -0.01 -0.07 0.00 -0.84 0.00 0.00 61.79 60.87 1t2s h SER 68 Cb 0.25 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.78 1t2s h SER 68 CO 0.00 0.01 -1.93 -1.54 -1.14 0.00 0.00 176.83 172.23 1t2s n SER 69 N -2.83 0.70 -4.61 3.07 3.41 -0.10 -4.88 113.62 108.38 1t2s n SER 69 Ca 0.04 0.00 -0.43 0.00 -0.26 0.00 0.00 58.87 58.22 1t2s n SER 69 Cb 0.51 1.66 -0.03 0.00 -0.26 0.00 0.00 64.21 66.09 1t2s n SER 69 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1t2s s GLU 70 N -3.12 3.86 -0.03 4.33 0.41 -0.72 -5.00 118.70 118.43 1t2s s GLU 70 Ca -0.07 0.67 0.01 0.00 -0.41 0.00 0.00 54.97 55.16 1t2s s GLU 70 Cb 0.11 -3.81 -0.03 0.00 -1.78 0.00 0.00 34.13 28.61 1t2s s GLU 70 CO 0.77 -1.02 -0.01 0.95 -0.49 0.00 0.00 175.26 175.45 1t2s s THR 71 N 3.70 4.10 0.04 3.63 -4.23 -1.26 -1.70 115.64 119.92 1t2s s THR 71 Ca 0.41 -0.49 0.01 0.00 -1.18 0.00 0.00 61.69 60.44 1t2s s THR 71 Cb -0.11 -2.77 -0.03 0.00 1.34 0.00 0.00 72.50 70.93 1t2s s THR 71 CO 0.20 0.48 -0.05 0.72 -0.54 0.00 0.00 174.62 175.43 1t2s s PHE 72 N -0.98 0.50 -0.42 3.99 -0.71 -0.15 -4.97 117.98 115.24 1t2s s PHE 72 Ca 0.17 -0.62 -0.20 0.00 -1.04 0.00 0.00 56.93 55.23 1t2s s PHE 72 Cb -0.11 -0.32 0.02 0.00 -1.21 0.00 0.00 43.02 41.39 1t2s s PHE 72 CO 0.06 -0.17 0.62 -2.00 -1.34 0.00 0.00 175.22 172.39 1t2s s GLU 73 N -2.03 3.32 -0.13 1.99 2.12 -1.26 -1.91 118.70 120.80 1t2s s GLU 73 Ca -0.08 -0.35 0.01 0.00 0.36 0.00 0.00 54.97 54.90 1t2s s GLU 73 Cb -0.06 -3.93 0.02 0.00 0.26 0.00 0.00 34.13 30.42 1t2s s GLU 73 CO -0.02 -0.95 -0.13 -1.58 -0.54 0.00 0.00 175.26 172.04 1t2s s HIS 74 N 2.73 1.98 -1.38 5.30 2.46 0.12 -4.66 115.29 121.83 1t2s s HIS 74 Ca 0.22 -1.04 0.00 0.00 0.47 0.00 0.00 55.06 54.71 1t2s s HIS 74 Cb -0.14 -1.47 0.00 0.00 -0.13 0.00 0.00 32.58 30.83 1t2s s HIS 74 CO 0.18 -0.58 0.00 -3.47 -2.47 0.00 0.00 174.74 168.40 1t2s n ASP 75 N 4.61 -4.61 0.00 9.88 2.03 -1.26 -1.19 116.55 126.01 1t2s n ASP 75 Ca -0.17 0.13 0.00 0.00 0.52 0.00 0.00 54.79 55.27 1t2s n ASP 75 Cb 0.50 -3.62 0.00 0.00 -0.72 0.00 0.00 41.12 37.28 1t2s n ASP 75 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1t2s n GLY 76 N -1.07 0.93 3.58 0.27 0.00 -1.26 -5.01 105.19 102.63 1t2s n GLY 76 Ca -0.17 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.51 1t2s n GLY 76 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1t2s s LYS 77 N -0.02 3.54 -0.52 1.61 2.47 -0.34 -5.05 119.74 121.44 1t2s s LYS 77 Ca 0.00 -0.45 -0.20 0.00 -1.56 0.00 0.00 55.97 53.76 1t2s s LYS 77 Cb 0.00 -2.94 0.06 0.00 -1.46 0.00 0.00 37.83 33.49 1t2s s LYS 77 CO 0.00 0.38 0.68 0.15 0.16 0.00 0.00 175.35 176.72 1t2s s LYS 78 N 0.00 3.14 0.21 4.03 1.02 -1.26 0.11 119.74 127.01 1t2s s LYS 78 Ca 0.02 -0.83 0.11 0.00 0.02 0.00 0.00 55.97 55.29 1t2s s LYS 78 Cb -0.13 -4.10 -0.05 0.00 -0.52 0.00 0.00 37.83 33.03 1t2s s LYS 78 CO 0.02 -1.28 -0.20 0.14 -0.92 0.00 0.00 175.35 173.11 1t2s s VAL 79 N 2.83 2.57 0.74 3.17 -7.23 -0.80 -4.90 120.40 116.77 1t2s s VAL 79 Ca 0.17 -2.05 -0.10 0.00 -1.81 0.00 0.00 61.98 58.18 1t2s s VAL 79 Cb -0.19 -2.28 0.05 0.00 0.56 0.00 0.00 36.38 34.53 1t2s s VAL 79 CO 0.12 -0.19 1.10 0.42 -0.31 0.00 0.00 175.10 176.24 1t2s s THR 80 N -1.90 2.65 0.26 5.32 -4.23 -1.26 -0.98 115.64 115.50 1t2s s THR 80 Ca 0.24 0.10 -0.03 0.00 -1.18 0.00 0.00 61.69 60.81 1t2s s THR 80 Cb -0.07 -3.19 0.25 0.00 1.34 0.00 0.00 72.50 70.83 1t2s s THR 80 CO 0.12 -0.23 1.86 0.40 -0.54 0.00 0.00 174.62 176.23 1t2s h ILE 81 N -0.77 1.04 -0.38 2.99 1.08 -0.73 -0.76 117.51 119.99 1t2s h ILE 81 Ca -0.45 -0.36 -0.03 0.00 -0.39 0.00 0.00 64.86 63.62 1t2s h ILE 81 Cb 1.30 -0.11 -0.02 0.00 -3.07 0.00 0.00 36.82 34.92 1t2s h ILE 81 CO 0.64 0.19 0.11 0.00 -0.69 0.00 0.00 178.15 178.40 1t2s h ALA 82 N 1.45 0.49 -0.98 1.87 0.00 -1.76 -2.82 119.26 117.51 1t2s h ALA 82 Ca 0.42 -0.17 0.04 0.00 0.00 0.00 0.00 54.91 55.20 1t2s h ALA 82 Cb 0.21 -0.14 -0.06 0.00 0.00 0.00 0.00 17.79 17.80 1t2s h ALA 82 CO -0.19 0.14 0.64 0.77 0.00 0.00 0.00 179.25 180.62 1t2s h SER 83 N 0.46 1.06 -0.13 0.00 0.02 -1.61 0.69 113.55 114.03 1t2s h SER 83 Ca 0.12 -0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 61.06 1t2s h SER 83 Cb 0.27 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.57 1t2s h SER 83 CO -0.00 0.71 0.05 0.22 -1.14 0.00 0.00 176.83 176.67 1t2s h TYR 84 N 1.22 0.20 -0.48 3.45 3.20 -0.98 0.70 116.97 124.28 1t2s h TYR 84 Ca 0.40 -0.02 -0.11 0.00 3.14 0.00 0.00 58.73 62.14 1t2s h TYR 84 Cb 0.04 -0.06 -0.02 0.00 1.54 0.00 0.00 36.73 38.23 1t2s h TYR 84 CO -0.00 0.29 -0.15 0.74 -1.64 0.00 0.00 178.16 177.41 1t2s h PHE 85 N 0.06 1.04 -0.51 -3.82 -1.00 -1.25 -2.61 116.94 108.85 1t2s h PHE 85 Ca 0.04 -0.22 -0.03 0.00 2.81 0.00 0.00 57.97 60.58 1t2s h PHE 85 Cb 0.18 -0.26 -0.02 0.00 3.61 0.00 0.00 35.95 39.46 1t2s h PHE 85 CO -0.01 1.00 0.20 1.25 -1.61 0.00 0.00 178.31 179.14 1t2s h HIS 86 N 0.82 0.74 0.00 -0.55 2.76 -0.62 -0.45 115.15 117.85 1t2s h HIS 86 Ca 0.12 -0.04 -0.05 0.00 -2.20 0.00 0.00 60.37 58.21 1t2s h HIS 86 Cb 0.69 -0.23 -0.01 0.00 1.55 0.00 0.00 27.41 29.41 1t2s h HIS 86 CO 0.04 0.58 -0.22 0.77 -1.30 0.00 0.00 177.93 177.80 1t2s h SER 87 N 0.73 0.00 -0.60 3.26 0.02 -0.61 -2.64 113.55 113.71 1t2s h SER 87 Ca 0.17 0.00 -0.26 0.00 -0.84 0.00 0.00 61.79 60.86 1t2s h SER 87 Cb 0.16 0.00 -0.16 0.00 0.14 0.00 0.00 62.40 62.54 1t2s h SER 87 CO -0.02 0.22 0.34 0.54 -1.14 0.00 0.00 176.83 176.77 1t2s n ARG 88 N -3.55 2.26 -1.22 3.45 5.12 -0.24 -4.86 116.66 117.61 1t2s n ARG 88 Ca -0.01 -2.03 -0.08 0.00 -1.93 0.00 0.00 57.85 53.80 1t2s n ARG 88 Cb 0.36 -1.84 -0.03 0.00 -1.16 0.00 0.00 32.46 29.79 1t2s n ARG 88 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 1t2s n ASN 89 N -0.36 -4.08 -3.83 0.55 3.02 -0.99 -4.69 115.26 104.87 1t2s n ASN 89 Ca 0.35 0.19 -0.30 0.00 -0.03 0.00 0.00 54.58 54.79 1t2s n ASN 89 Cb 1.19 -2.25 -0.15 0.00 -0.61 0.00 0.00 39.78 37.96 1t2s n ASN 89 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1t2s s TYR 90 N -2.23 2.42 -0.37 3.10 5.04 -0.81 -4.96 117.35 119.54 1t2s s TYR 90 Ca 0.00 -2.17 -0.29 0.00 -2.44 0.00 0.00 57.07 52.17 1t2s s TYR 90 Cb 0.00 -2.13 0.01 0.00 0.35 0.00 0.00 41.96 40.19 1t2s s TYR 90 CO 0.00 -0.90 1.27 -1.25 -1.34 0.00 0.00 175.55 173.32 1t2s s PRO 91 N 1.37 3.81 0.11 4.97 0.04 -1.26 -2.68 135.00 141.36 1t2s s PRO 91 Ca 0.10 1.00 -0.31 0.00 0.04 0.00 0.00 61.00 61.83 1t2s s PRO 91 Cb -0.18 -3.90 -0.09 0.00 0.04 0.00 0.00 34.50 30.37 1t2s s PRO 91 CO -0.19 -1.26 1.58 -0.51 0.04 0.00 0.00 177.00 176.66 1t2s s LEU 92 N 4.57 4.37 0.24 -3.56 1.43 -1.26 -4.90 118.68 119.56 1t2s s LEU 92 Ca 0.54 2.51 0.11 0.00 -1.03 0.00 0.00 54.13 56.27 1t2s s LEU 92 Cb -0.13 -3.58 0.19 0.00 0.03 0.00 0.00 46.19 42.70 1t2s s LEU 92 CO 0.26 -0.83 1.51 0.11 0.23 0.00 0.00 176.35 177.63 1t2s h LYS 93 N 7.46 0.00 -1.84 1.70 1.57 -2.02 -3.37 116.57 120.07 1t2s h LYS 93 Ca -0.42 0.00 -0.51 0.00 -1.87 0.00 0.00 60.65 57.85 1t2s h LYS 93 Cb 1.20 0.00 -0.37 0.00 0.08 0.00 0.00 32.23 33.14 1t2s h LYS 93 CO 0.92 0.70 -1.08 1.97 -0.57 0.00 0.00 179.45 181.38 1t2s n PHE 94 N -3.56 -0.44 0.74 -1.35 1.16 -1.26 -4.81 117.46 107.93 1t2s n PHE 94 Ca -0.00 -3.50 0.09 0.00 -1.87 0.00 0.00 57.45 52.16 1t2s n PHE 94 Cb 0.72 -0.21 0.41 0.00 -1.61 0.00 0.00 39.48 38.79 1t2s n PHE 94 CO 0.00 0.00 0.00 -0.35 -1.87 0.00 0.00 176.76 174.54 1t2s n PRO 95 N 1.07 0.15 -0.00 3.97 -0.04 -1.26 -2.60 135.00 136.29 1t2s n PRO 95 Ca 0.21 0.15 0.13 0.00 -0.04 0.00 0.00 63.50 63.95 1t2s n PRO 95 Cb 0.58 -1.50 0.75 0.00 -0.04 0.00 0.00 33.50 33.29 1t2s n PRO 95 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1t2s n GLN 96 N -1.37 1.04 -3.00 0.54 3.00 -1.26 -1.62 117.38 114.71 1t2s n GLN 96 Ca 0.07 -0.06 -0.38 0.00 -0.01 0.00 0.00 57.00 56.61 1t2s n GLN 96 Cb 0.17 -1.41 -0.06 0.00 0.00 0.00 0.00 30.24 28.94 1t2s n GLN 96 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 1t2s s LEU 97 N -1.81 4.49 0.26 1.08 1.43 -1.07 -4.59 118.68 118.47 1t2s s LEU 97 Ca 0.39 1.59 -0.30 0.00 -1.03 0.00 0.00 54.13 54.78 1t2s s LEU 97 Cb 0.18 -3.47 -0.13 0.00 0.03 0.00 0.00 46.19 42.80 1t2s s LEU 97 CO 0.30 0.12 1.40 1.41 0.23 0.00 0.00 176.35 179.82 1t2s n HIS 98 N 1.20 2.25 -2.22 0.29 8.25 -1.26 -2.75 115.22 120.97 1t2s n HIS 98 Ca -0.04 0.44 -0.38 0.00 -0.26 0.00 0.00 57.72 57.47 1t2s n HIS 98 Cb 0.50 -2.46 -0.01 0.00 1.12 0.00 0.00 29.99 29.13 1t2s n HIS 98 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1t2s s LEU 100 N -2.53 4.37 -0.61 0.00 2.96 0.52 -0.43 118.68 122.95 1t2s s LEU 100 Ca 0.58 2.36 -0.15 0.00 -0.22 0.00 0.00 54.13 56.70 1t2s s LEU 100 Cb -0.33 -3.59 0.15 0.00 0.50 0.00 0.00 46.19 42.93 1t2s s LEU 100 CO 0.41 -0.69 0.56 0.21 -1.32 0.00 0.00 176.35 175.53 1t2s s ASN 101 N 1.17 6.31 0.17 3.68 2.47 0.46 -2.33 114.94 126.86 1t2s s ASN 101 Ca 0.66 -2.03 0.02 0.00 0.42 0.00 0.00 52.86 51.93 1t2s s ASN 101 Cb -0.38 -2.20 -0.01 0.00 -1.45 0.00 0.00 41.25 37.22 1t2s s ASN 101 CO 0.30 -0.78 0.08 1.33 -3.72 0.00 0.00 177.10 174.31 1t2s n VAL 102 N 4.91 0.00 0.00 -5.21 0.24 -1.09 -2.78 118.33 114.39 1t2s n VAL 102 Ca -0.07 -1.02 0.00 0.00 -2.04 0.00 0.00 64.34 61.21 1t2s n VAL 102 Cb 0.42 0.40 0.00 0.00 -1.47 0.00 0.00 33.84 33.19 1t2s n VAL 102 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1t2s n GLY 103 N 0.70 1.02 3.40 7.63 0.00 -1.26 -1.46 105.19 115.22 1t2s n GLY 103 Ca -0.01 -0.50 -0.10 0.00 0.00 0.00 0.00 46.02 45.42 1t2s n GLY 103 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1t2s s SER 104 N -4.00 -0.17 0.31 1.61 0.15 0.28 -4.98 113.70 106.91 1t2s s SER 104 Ca 0.00 -0.52 0.14 0.00 0.70 0.00 0.00 55.95 56.27 1t2s s SER 104 Cb 0.00 0.50 0.48 0.00 -1.71 0.00 0.00 66.02 65.29 1t2s s SER 104 CO 0.00 -0.94 1.65 -1.28 1.20 0.00 0.00 173.24 173.87 1t2s h SER 105 N 2.35 0.00 0.11 5.45 0.87 -1.99 -2.87 113.55 117.48 1t2s h SER 105 Ca -0.31 0.00 -0.33 0.00 -1.23 0.00 0.00 61.79 59.92 1t2s h SER 105 Cb 1.25 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.20 1t2s h SER 105 CO 0.44 0.52 -1.77 0.16 -0.53 0.00 0.00 176.83 175.64 1t2s h ILE 106 N 0.00 0.76 -3.53 2.23 3.07 -1.98 -3.41 117.51 114.65 1t2s h ILE 106 Ca -0.01 -2.34 -0.73 0.00 1.55 0.00 0.00 64.86 63.33 1t2s h ILE 106 Cb 1.03 2.52 -0.33 0.00 -0.27 0.00 0.00 36.82 39.78 1t2s h ILE 106 CO 0.07 0.78 -0.08 -0.75 -1.05 0.00 0.00 178.15 177.11 1t2s s LYS 107 N -2.52 3.22 -0.01 0.16 2.20 -1.22 -5.06 119.74 116.51 1t2s s LYS 107 Ca -0.22 -2.86 -0.24 0.00 -0.36 0.00 0.00 55.97 52.28 1t2s s LYS 107 Cb 0.06 -4.05 -0.04 0.00 -1.51 0.00 0.00 37.83 32.29 1t2s s LYS 107 CO 0.75 -1.24 0.75 -1.12 -0.36 0.00 0.00 175.35 174.13 1t2s s SER 108 N 0.77 7.12 -0.13 1.43 0.01 -1.08 -0.56 113.70 121.25 1t2s s SER 108 Ca 0.22 1.34 0.01 0.00 1.31 0.00 0.00 55.95 58.83 1t2s s SER 108 Cb -0.13 -2.45 -0.01 0.00 0.21 0.00 0.00 66.02 63.65 1t2s s SER 108 CO -0.08 -0.06 -0.17 0.27 0.41 0.00 0.00 173.24 173.61 1t2s s ILE 109 N 0.40 2.63 -0.27 1.44 -4.36 -0.54 -4.95 121.20 115.56 1t2s s ILE 109 Ca 0.39 -0.80 -0.11 0.00 -0.26 0.00 0.00 60.65 59.87 1t2s s ILE 109 Cb -0.19 -2.08 -0.05 0.00 1.25 0.00 0.00 42.46 41.38 1t2s s ILE 109 CO 0.21 0.53 0.19 -0.76 0.24 0.00 0.00 174.94 175.35 1t2s s LEU 110 N 0.55 4.04 0.00 0.37 1.02 -1.25 -2.68 118.68 120.73 1t2s s LEU 110 Ca -0.10 0.02 0.06 0.00 0.02 0.00 0.00 54.13 54.12 1t2s s LEU 110 Cb -0.16 -2.12 -0.02 0.00 0.02 0.00 0.00 46.19 43.91 1t2s s LEU 110 CO 0.04 -0.02 -0.17 -0.76 0.02 0.00 0.00 176.35 175.45 1t2s s LEU 111 N 1.59 2.07 -0.17 1.79 1.43 -0.99 -4.83 118.68 119.58 1t2s s LEU 111 Ca 0.07 -0.36 -0.29 0.00 -1.03 0.00 0.00 54.13 52.52 1t2s s LEU 111 Cb -0.15 -0.86 -0.05 0.00 0.03 0.00 0.00 46.19 45.15 1t2s s LEU 111 CO 0.09 0.18 2.01 -2.16 0.23 0.00 0.00 176.35 176.70 1t2s s PRO 112 N -0.63 3.51 0.65 1.29 0.04 -1.26 -0.36 135.00 138.25 1t2s s PRO 112 Ca 0.06 2.04 0.38 0.00 0.04 0.00 0.00 61.00 63.52 1t2s s PRO 112 Cb -0.07 -4.24 2.10 0.00 0.04 0.00 0.00 34.50 32.32 1t2s s PRO 112 CO -0.00 -1.66 2.23 0.97 0.04 0.00 0.00 177.00 178.58 1t2s h ILE 113 N 6.57 0.11 -0.87 0.56 2.10 -1.94 0.11 117.51 124.15 1t2s h ILE 113 Ca -0.41 0.00 0.18 0.00 1.08 0.00 0.00 64.86 65.71 1t2s h ILE 113 Cb 1.22 0.90 -0.06 0.00 -1.09 0.00 0.00 36.82 37.78 1t2s h ILE 113 CO 0.97 0.00 0.58 -0.08 -1.08 0.00 0.00 178.15 178.54 1t2s h GLU 114 N 0.00 0.44 -0.62 2.19 4.57 -1.94 -0.63 114.58 118.58 1t2s h GLU 114 Ca 0.01 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.17 1t2s h GLU 114 Cb 0.22 -0.10 0.00 0.00 -0.16 0.00 0.00 28.75 28.71 1t2s h GLU 114 CO -0.00 0.29 0.00 1.28 -1.18 0.00 0.00 179.01 179.40 1t2s n LEU 115 N -4.52 3.63 -4.80 1.64 4.77 0.37 -4.67 117.00 113.43 1t2s n LEU 115 Ca 0.18 -1.82 -0.32 0.00 -0.03 0.00 0.00 56.01 54.02 1t2s n LEU 115 Cb 0.63 -0.46 -0.07 0.00 -2.33 0.00 0.00 43.42 41.20 1t2s n LEU 115 CO 0.31 0.76 -0.24 0.00 -1.33 0.00 0.00 177.39 176.89 1t2s s SER 117 N -1.98 0.65 0.10 0.00 0.15 -0.55 -0.36 113.70 111.72 1t2s s SER 117 Ca 0.26 0.12 -0.31 0.00 0.70 0.00 0.00 55.95 56.72 1t2s s SER 117 Cb -0.12 -0.04 -0.07 0.00 -1.71 0.00 0.00 66.02 64.08 1t2s s SER 117 CO 0.17 -0.20 1.27 -0.63 1.20 0.00 0.00 173.24 175.05 1t2s s ILE 118 N 1.76 3.68 -0.00 6.45 1.01 0.88 0.05 121.20 135.03 1t2s s ILE 118 Ca -0.01 1.23 -0.05 0.00 0.00 0.00 0.00 60.65 61.83 1t2s s ILE 118 Cb -0.12 -3.79 -0.04 0.00 0.01 0.00 0.00 42.46 38.51 1t2s s ILE 118 CO -0.04 0.11 0.22 -0.70 0.00 0.00 0.00 174.94 174.54 1t2s s GLU 119 N 0.87 3.50 0.15 2.79 2.12 -1.19 -0.13 118.70 126.82 1t2s s GLU 119 Ca 0.60 -0.20 0.11 0.00 0.36 0.00 0.00 54.97 55.84 1t2s s GLU 119 Cb -0.33 -3.08 0.58 0.00 0.26 0.00 0.00 34.13 31.56 1t2s s GLU 119 CO 0.31 0.66 1.34 -0.85 -0.54 0.00 0.00 175.26 176.18 1t2s n GLU 120 N 1.03 0.07 -0.20 4.30 0.28 -0.80 -3.91 120.64 121.40 1t2s n GLU 120 Ca -0.11 0.55 -0.08 0.00 -0.16 0.00 0.00 57.16 57.37 1t2s n GLU 120 Cb 0.53 -1.72 -0.02 0.00 1.43 0.00 0.00 31.44 31.65 1t2s n GLU 120 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 177.13 177.75 1t2s h GLY 121 N 0.16 -0.37 1.02 -1.84 0.00 -1.94 -1.70 103.07 98.41 1t2s h GLY 121 Ca 0.00 0.53 0.00 0.00 0.00 0.00 0.00 47.33 47.86 1t2s h GLY 121 CO 0.00 -0.18 -0.78 0.06 0.00 0.00 0.00 176.54 175.65 1t2s h GLN 122 N -0.21 0.00 -0.02 4.80 3.07 -1.97 -3.54 115.11 117.23 1t2s h GLN 122 Ca 0.19 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.93 1t2s h GLN 122 Cb 0.56 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.12 1t2s h GLN 122 CO -0.68 0.00 0.00 0.00 0.09 0.00 0.00 178.83 178.24