#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yrp s SER 2 N 0.00 4.81 -0.98 1.61 1.04 -1.26 -4.85 113.70 114.07 2yrp s SER 2 Ca 0.00 -0.62 -0.25 0.00 0.48 0.00 0.00 55.95 55.56 2yrp s SER 2 Cb 0.00 -2.56 -0.18 0.00 0.10 0.00 0.00 66.02 63.37 2yrp s SER 2 CO 0.00 -3.08 1.97 -1.54 0.98 0.00 0.00 173.24 171.57 2yrp n SER 3 N 15.19 2.14 0.00 7.02 3.41 -1.26 -4.59 113.62 135.52 2yrp n SER 3 Ca 0.42 -2.60 0.00 0.00 -0.26 0.00 0.00 58.87 56.43 2yrp n SER 3 Cb 0.46 -1.54 0.00 0.00 -0.26 0.00 0.00 64.21 62.87 2yrp n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2yrp n GLY 4 N 5.70 1.91 3.05 5.00 0.00 -1.26 -4.20 105.19 115.40 2yrp n GLY 4 Ca 0.44 0.40 -0.43 0.00 0.00 0.00 0.00 46.02 46.43 2yrp n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2yrp n SER 5 N 0.00 5.35 -3.94 1.61 2.88 -1.17 -4.65 113.62 113.69 2yrp n SER 5 Ca 0.00 -3.12 -0.30 0.00 -1.33 0.00 0.00 58.87 54.12 2yrp n SER 5 Cb 0.00 -1.46 -0.01 0.00 -0.75 0.00 0.00 64.21 61.99 2yrp n SER 5 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2yrp n SER 6 N 3.83 -1.69 0.00 -3.46 7.64 -1.26 -0.53 113.62 118.15 2yrp n SER 6 Ca 0.36 -1.07 0.00 0.00 1.01 0.00 0.00 58.87 59.17 2yrp n SER 6 Cb 0.37 -2.82 0.00 0.00 -1.01 0.00 0.00 64.21 60.75 2yrp n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2yrp n GLY 7 N -2.00 1.59 3.75 0.23 0.00 -1.26 -4.99 105.19 102.51 2yrp n GLY 7 Ca -0.24 -0.24 -0.40 0.00 0.00 0.00 0.00 46.02 45.14 2yrp n GLY 7 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2yrp n LEU 8 N 0.00 4.96 -4.71 0.99 4.77 0.31 -4.98 117.00 118.33 2yrp n LEU 8 Ca 0.00 1.11 -0.30 0.00 -0.03 0.00 0.00 56.01 56.79 2yrp n LEU 8 Cb 0.00 -1.58 0.14 0.00 -2.33 0.00 0.00 43.42 39.65 2yrp n LEU 8 CO 0.00 -0.27 0.66 -2.16 -1.33 0.00 0.00 177.39 174.30 2yrp s PRO 9 N -2.43 1.15 -0.06 3.23 0.04 -1.26 -3.03 135.00 132.63 2yrp s PRO 9 Ca 0.62 0.78 -0.05 0.00 0.04 0.00 0.00 61.00 62.38 2yrp s PRO 9 Cb -0.46 -1.80 0.02 0.00 0.04 0.00 0.00 34.50 32.30 2yrp s PRO 9 CO 0.57 -2.30 0.16 -0.65 0.04 0.00 0.00 177.00 174.82 2yrp s GLN 10 N -4.94 0.17 -0.43 4.56 -0.21 -1.10 -4.79 119.66 112.91 2yrp s GLN 10 Ca 0.64 0.25 0.04 0.00 0.02 0.00 0.00 55.36 56.31 2yrp s GLN 10 Cb -0.18 0.04 0.12 0.00 1.00 0.00 0.00 33.01 33.99 2yrp s GLN 10 CO 0.57 -0.05 0.17 0.08 -2.12 0.00 0.00 175.29 173.94 2yrp s VAL 11 N 0.30 2.27 0.02 1.09 1.01 -1.26 -2.08 120.40 121.73 2yrp s VAL 11 Ca -0.02 -2.78 -0.21 0.00 0.00 0.00 0.00 61.98 58.97 2yrp s VAL 11 Cb -0.03 -2.62 -0.12 0.00 0.00 0.00 0.00 36.38 33.62 2yrp s VAL 11 CO -0.01 -0.73 1.11 -0.08 0.00 0.00 0.00 175.10 175.39 2yrp h GLU 12 N 7.03 -0.73 -4.32 2.72 4.81 -0.58 -3.47 114.58 120.03 2yrp h GLU 12 Ca -0.06 0.05 -0.22 0.00 -0.13 0.00 0.00 59.36 59.00 2yrp h GLU 12 Cb 0.95 0.17 -0.12 0.00 0.63 0.00 0.00 28.75 30.37 2yrp h GLU 12 CO 0.59 -0.49 -0.42 0.00 -0.73 0.00 0.00 179.01 177.96 2yrp s ALA 13 N -4.59 0.81 -0.12 2.92 0.00 -0.93 -5.00 121.76 114.85 2yrp s ALA 13 Ca -0.11 -1.50 -0.12 0.00 0.00 0.00 0.00 51.96 50.23 2yrp s ALA 13 Cb 0.01 1.29 0.03 0.00 0.00 0.00 0.00 23.12 24.45 2yrp s ALA 13 CO 0.33 -0.69 0.33 1.52 0.00 0.00 0.00 175.76 177.25 2yrp s TYR 14 N -3.92 -0.35 0.00 0.00 -0.85 -1.26 0.39 117.35 111.35 2yrp s TYR 14 Ca 0.34 0.85 -0.10 0.00 -0.52 0.00 0.00 57.07 57.63 2yrp s TYR 14 Cb 0.04 0.12 0.01 0.00 0.38 0.00 0.00 41.96 42.51 2yrp s TYR 14 CO 0.14 -0.19 0.21 -1.54 -1.52 0.00 0.00 175.55 172.64 2yrp s SER 15 N 0.07 -0.05 0.50 -0.18 1.04 -1.19 -3.87 113.70 110.02 2yrp s SER 15 Ca -0.01 -0.13 -0.21 0.00 0.48 0.00 0.00 55.95 56.08 2yrp s SER 15 Cb -0.03 0.25 -0.07 0.00 0.10 0.00 0.00 66.02 66.28 2yrp s SER 15 CO 0.01 -0.43 1.15 -2.16 0.98 0.00 0.00 173.24 172.79 2yrp s PRO 16 N -1.54 3.58 0.49 4.02 0.04 -1.26 -1.81 135.00 138.51 2yrp s PRO 16 Ca -0.13 1.70 0.38 0.00 0.04 0.00 0.00 61.00 62.99 2yrp s PRO 16 Cb -0.06 -2.22 1.56 0.00 0.04 0.00 0.00 34.50 33.82 2yrp s PRO 16 CO 0.02 -0.68 1.60 0.66 0.04 0.00 0.00 177.00 178.63 2yrp h SER 17 N 1.67 0.14 -5.55 6.66 4.64 -2.01 -3.41 113.55 115.67 2yrp h SER 17 Ca -0.50 0.09 -0.24 0.00 -0.47 0.00 0.00 61.79 60.68 2yrp h SER 17 Cb 1.25 0.09 -0.13 0.00 -0.31 0.00 0.00 62.40 63.30 2yrp h SER 17 CO 0.59 -0.14 -0.46 0.00 -0.87 0.00 0.00 176.83 175.94 2yrp s ALA 18 N -5.12 0.94 0.29 5.18 0.00 -1.26 -4.68 121.76 117.09 2yrp s ALA 18 Ca -0.07 -1.57 -0.06 0.00 0.00 0.00 0.00 51.96 50.27 2yrp s ALA 18 Cb 0.29 1.32 -0.01 0.00 0.00 0.00 0.00 23.12 24.72 2yrp s ALA 18 CO 0.85 -0.67 0.43 0.00 0.00 0.00 0.00 175.76 176.36 2yrp s SER 20 N -3.14 6.92 0.27 0.00 0.01 -1.26 -0.18 113.70 116.32 2yrp s SER 20 Ca 0.29 1.21 0.01 0.00 1.31 0.00 0.00 55.95 58.77 2yrp s SER 20 Cb 0.01 -2.34 0.59 0.00 0.21 0.00 0.00 66.02 64.48 2yrp s SER 20 CO 0.15 0.09 1.75 -0.37 0.41 0.00 0.00 173.24 175.27 2yrp h VAL 21 N 2.82 0.69 -0.07 3.43 -1.51 -1.69 0.40 116.25 120.31 2yrp h VAL 21 Ca -0.48 -0.21 0.02 0.00 -1.23 0.00 0.00 66.70 64.80 2yrp h VAL 21 Cb 1.19 0.03 -0.00 0.00 -2.13 0.00 0.00 31.29 30.38 2yrp h VAL 21 CO 0.65 0.11 0.22 0.03 -1.23 0.00 0.00 177.57 177.36 2yrp h ARG 22 N 0.60 0.00 0.00 5.19 3.08 -1.90 -2.08 114.38 119.27 2yrp h ARG 22 Ca 0.49 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.54 2yrp h ARG 22 Cb 0.75 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.80 2yrp h ARG 22 CO -0.39 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 178.92 2yrp n GLY 23 N -1.25 0.70 2.02 0.04 0.00 0.14 -4.59 105.19 102.26 2yrp n GLY 23 Ca -0.01 -0.85 -0.01 0.00 0.00 0.00 0.00 46.02 45.16 2yrp n GLY 23 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2yrp n GLY 24 N 0.00 0.36 3.81 -0.02 0.00 -0.97 -4.91 105.19 103.46 2yrp n GLY 24 Ca 0.00 -0.90 -0.25 0.00 0.00 0.00 0.00 46.02 44.87 2yrp n GLY 24 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2yrp s GLU 25 N -3.54 2.29 -0.30 1.61 8.01 -1.26 -4.95 118.70 120.56 2yrp s GLU 25 Ca 0.00 -1.85 -0.20 0.00 0.01 0.00 0.00 54.97 52.93 2yrp s GLU 25 Cb 0.00 -2.06 -0.01 0.00 -4.31 0.00 0.00 34.13 27.74 2yrp s GLU 25 CO 0.00 -0.26 0.62 -2.00 0.01 0.00 0.00 175.26 173.63 2yrp s GLU 26 N -4.04 3.91 -0.20 1.61 2.12 -1.26 -2.91 118.70 117.93 2yrp s GLU 26 Ca 0.39 0.30 0.00 0.00 0.36 0.00 0.00 54.97 56.02 2yrp s GLU 26 Cb 0.01 -3.72 0.02 0.00 0.26 0.00 0.00 34.13 30.70 2yrp s GLU 26 CO 0.22 -0.55 -0.15 -1.17 -0.54 0.00 0.00 175.26 173.07 2yrp s LEU 27 N 2.58 2.51 -0.35 2.70 2.96 -0.27 -4.35 118.68 124.45 2yrp s LEU 27 Ca 0.25 -0.74 -0.06 0.00 -0.22 0.00 0.00 54.13 53.36 2yrp s LEU 27 Cb -0.15 -1.54 0.05 0.00 0.50 0.00 0.00 46.19 45.05 2yrp s LEU 27 CO 0.11 -0.04 0.13 -0.69 -1.32 0.00 0.00 176.35 174.54 2yrp s VAL 28 N 1.29 3.70 -0.17 1.68 1.01 -0.75 -1.78 120.40 125.38 2yrp s VAL 28 Ca 0.03 -1.31 -0.25 0.00 0.00 0.00 0.00 61.98 60.44 2yrp s VAL 28 Cb -0.14 -3.17 -0.01 0.00 0.00 0.00 0.00 36.38 33.05 2yrp s VAL 28 CO -0.10 -0.28 0.84 -0.76 0.00 0.00 0.00 175.10 174.80 2yrp s LEU 29 N 1.36 4.17 -0.10 3.92 1.43 -0.47 -3.15 118.68 125.85 2yrp s LEU 29 Ca -0.00 1.18 -0.13 0.00 -1.03 0.00 0.00 54.13 54.14 2yrp s LEU 29 Cb -0.20 -3.24 -0.05 0.00 0.03 0.00 0.00 46.19 42.72 2yrp s LEU 29 CO 0.01 -0.40 0.32 -0.89 0.23 0.00 0.00 176.35 175.62 2yrp s THR 30 N 2.17 5.24 -0.31 5.49 2.01 0.16 -2.43 115.64 127.96 2yrp s THR 30 Ca 0.38 0.63 0.00 0.00 0.31 0.00 0.00 61.69 63.01 2yrp s THR 30 Cb -0.17 -3.64 0.00 0.00 0.01 0.00 0.00 72.50 68.70 2yrp s THR 30 CO 0.12 0.48 0.00 0.61 -0.69 0.00 0.00 174.62 175.14 2yrp n GLY 31 N 2.65 -0.88 3.72 4.40 0.00 -1.23 0.20 105.19 114.06 2yrp n GLY 31 Ca -0.13 -0.13 -0.09 0.00 0.00 0.00 0.00 46.02 45.66 2yrp n GLY 31 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yrp s SER 32 N -4.00 0.05 -1.33 1.61 0.01 -0.89 -4.63 113.70 104.52 2yrp s SER 32 Ca 0.00 -0.99 -0.05 0.00 1.31 0.00 0.00 55.95 56.21 2yrp s SER 32 Cb 0.00 0.72 -0.00 0.00 0.21 0.00 0.00 66.02 66.95 2yrp s SER 32 CO 0.00 -1.40 0.54 -3.20 0.41 0.00 0.00 173.24 169.59 2yrp n ASN 33 N -0.89 -1.61 -5.00 2.44 2.85 -1.17 -2.73 115.26 109.16 2yrp n ASN 33 Ca -0.04 -0.99 -0.18 0.00 -0.11 0.00 0.00 54.58 53.26 2yrp n ASN 33 Cb 0.60 -3.23 0.03 0.00 1.24 0.00 0.00 39.78 38.42 2yrp n ASN 33 CO 0.00 0.00 0.00 -0.36 -2.11 0.00 0.00 177.26 174.79 2yrp s PHE 34 N -3.80 2.35 0.12 1.20 0.08 0.96 -4.40 117.98 114.49 2yrp s PHE 34 Ca 0.12 -0.46 0.05 0.00 0.12 0.00 0.00 56.93 56.77 2yrp s PHE 34 Cb -0.04 -2.39 -0.04 0.00 -0.57 0.00 0.00 43.02 39.98 2yrp s PHE 34 CO 0.87 -0.73 -0.13 -0.51 -0.10 0.00 0.00 175.22 174.62 2yrp s LEU 35 N -4.51 2.42 0.20 -0.37 1.43 -1.26 -4.75 118.68 111.84 2yrp s LEU 35 Ca 0.58 -0.84 -0.04 0.00 -1.03 0.00 0.00 54.13 52.80 2yrp s LEU 35 Cb -0.09 -0.49 0.14 0.00 0.03 0.00 0.00 46.19 45.78 2yrp s LEU 35 CO 0.36 -0.19 1.55 1.55 0.23 0.00 0.00 176.35 179.85 2yrp h PRO 36 N 3.41 0.66 -0.50 1.29 0.13 -1.91 -3.05 132.00 132.02 2yrp h PRO 36 Ca -0.39 -0.35 -0.05 0.00 -0.87 0.00 0.00 66.00 64.34 2yrp h PRO 36 Cb 1.20 0.01 -0.03 0.00 0.13 0.00 0.00 31.00 32.31 2yrp h PRO 36 CO 0.53 0.95 0.05 -0.25 -0.23 0.00 0.00 178.00 179.05 2yrp n ASP 37 N -4.03 4.87 -4.18 1.44 8.00 -1.26 -4.38 116.55 117.02 2yrp n ASP 37 Ca -0.02 -3.06 -0.35 0.00 0.71 0.00 0.00 54.79 52.07 2yrp n ASP 37 Cb 0.54 -0.65 0.08 0.00 -0.02 0.00 0.00 41.12 41.06 2yrp n ASP 37 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 2yrp n SER 38 N 0.04 -3.86 -4.15 -2.24 2.88 -1.16 -4.98 113.62 100.16 2yrp n SER 38 Ca 0.29 0.17 -0.32 0.00 -1.33 0.00 0.00 58.87 57.68 2yrp n SER 38 Cb 1.14 -0.90 -0.17 0.00 -0.75 0.00 0.00 64.21 63.53 2yrp n SER 38 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 2yrp s LYS 39 N -2.73 2.86 -0.36 -1.46 3.01 -1.18 -5.01 119.74 114.87 2yrp s LYS 39 Ca 0.47 -0.80 0.01 0.00 -1.01 0.00 0.00 55.97 54.65 2yrp s LYS 39 Cb -0.15 -2.33 0.10 0.00 -1.01 0.00 0.00 37.83 34.44 2yrp s LYS 39 CO 0.73 -0.03 0.09 0.08 0.51 0.00 0.00 175.35 176.74 2yrp s VAL 40 N 0.85 2.65 0.09 3.17 1.01 -1.26 -0.36 120.40 126.56 2yrp s VAL 40 Ca -0.07 -2.16 0.05 0.00 0.00 0.00 0.00 61.98 59.81 2yrp s VAL 40 Cb -0.15 -2.86 -0.04 0.00 0.00 0.00 0.00 36.38 33.33 2yrp s VAL 40 CO -0.02 -0.57 -0.03 0.68 0.00 0.00 0.00 175.10 175.16 2yrp s VAL 41 N 1.01 3.84 0.37 2.92 -7.23 -1.16 -3.92 120.40 116.24 2yrp s VAL 41 Ca 0.08 -1.04 0.08 0.00 -1.81 0.00 0.00 61.98 59.28 2yrp s VAL 41 Cb -0.20 -2.82 -0.03 0.00 0.56 0.00 0.00 36.38 33.89 2yrp s VAL 41 CO -0.06 0.13 0.31 -0.36 -0.31 0.00 0.00 175.10 174.81 2yrp s PHE 42 N -1.27 2.79 0.04 2.82 0.40 -1.25 -2.62 117.98 118.89 2yrp s PHE 42 Ca 0.24 -0.40 -0.00 0.00 -0.60 0.00 0.00 56.93 56.17 2yrp s PHE 42 Cb -0.11 -1.94 -0.03 0.00 0.51 0.00 0.00 43.02 41.44 2yrp s PHE 42 CO 0.17 0.08 -0.03 0.96 0.70 0.00 0.00 175.22 177.09 2yrp s ILE 43 N -2.40 0.20 -0.07 0.64 -4.36 0.83 -4.67 121.20 111.38 2yrp s ILE 43 Ca 0.43 -1.42 -0.03 0.00 -0.26 0.00 0.00 60.65 59.37 2yrp s ILE 43 Cb -0.04 -0.97 0.04 0.00 1.25 0.00 0.00 42.46 42.74 2yrp s ILE 43 CO 0.26 -0.77 0.17 -0.70 0.24 0.00 0.00 174.94 174.14 2yrp s GLU 44 N -2.82 0.12 0.09 0.37 2.12 -1.26 -2.98 118.70 114.33 2yrp s GLU 44 Ca -0.03 0.40 -0.23 0.00 0.36 0.00 0.00 54.97 55.47 2yrp s GLU 44 Cb -0.00 -0.16 -0.07 0.00 0.26 0.00 0.00 34.13 34.16 2yrp s GLU 44 CO -0.06 -0.16 0.70 1.03 -0.54 0.00 0.00 175.26 176.23 2yrp s ARG 45 N 1.15 4.42 0.41 4.30 0.52 -1.26 -2.19 118.95 126.30 2yrp s ARG 45 Ca -0.09 0.97 0.08 0.00 -0.52 0.00 0.00 55.73 56.17 2yrp s ARG 45 Cb -0.11 -3.29 -0.01 0.00 0.52 0.00 0.00 34.95 32.06 2yrp s ARG 45 CO -0.06 0.49 0.44 0.20 0.02 0.00 0.00 175.30 176.38 2yrp s GLY 46 N -0.72 2.04 0.00 -3.53 0.00 -1.13 -4.97 107.32 99.00 2yrp s GLY 46 Ca 0.34 -1.79 0.15 0.00 0.00 0.00 0.00 44.72 43.43 2yrp s GLY 46 CO 0.22 -1.61 1.37 -1.55 0.00 0.00 0.00 173.10 171.53 2yrp n PRO 47 N -1.63 0.39 0.05 2.90 -0.04 -1.26 -2.68 135.00 132.72 2yrp n PRO 47 Ca 0.04 0.05 -0.23 0.00 -0.04 0.00 0.00 63.50 63.33 2yrp n PRO 47 Cb 0.61 -1.50 -0.15 0.00 -0.04 0.00 0.00 33.50 32.42 2yrp n PRO 47 CO 0.00 0.00 0.00 0.38 -0.04 0.00 0.00 175.50 175.84 2yrp h ASP 48 N 0.00 0.55 0.00 3.54 3.04 -2.03 -3.49 116.42 118.04 2yrp h ASP 48 Ca 0.00 -0.94 0.00 0.00 -3.24 0.00 0.00 57.03 52.85 2yrp h ASP 48 Cb 0.05 -0.18 0.00 0.00 -1.04 0.00 0.00 39.33 38.16 2yrp h ASP 48 CO 0.00 1.79 0.00 0.61 -2.04 0.00 0.00 179.24 179.60 2yrp n GLY 49 N 1.88 2.37 3.84 7.15 0.00 -1.09 -5.13 105.19 114.22 2yrp n GLY 49 Ca -0.27 -0.22 -0.29 0.00 0.00 0.00 0.00 46.02 45.25 2yrp n GLY 49 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2yrp s LYS 50 N 0.00 3.10 -0.12 1.61 -2.85 -1.26 -4.82 119.74 115.39 2yrp s LYS 50 Ca 0.00 -0.68 -0.06 0.00 -1.00 0.00 0.00 55.97 54.23 2yrp s LYS 50 Cb 0.00 -2.81 -0.04 0.00 -2.06 0.00 0.00 37.83 32.92 2yrp s LYS 50 CO 0.00 0.54 0.11 -0.48 0.10 0.00 0.00 175.35 175.62 2yrp s LEU 51 N -2.78 4.21 -0.26 2.77 0.05 -1.26 -2.85 118.68 118.56 2yrp s LEU 51 Ca 0.32 0.38 -0.01 0.00 0.05 0.00 0.00 54.13 54.87 2yrp s LEU 51 Cb -0.11 -2.02 0.14 0.00 -2.05 0.00 0.00 46.19 42.15 2yrp s LEU 51 CO 0.25 0.38 0.40 0.00 -0.55 0.00 0.00 176.35 176.82 2yrp s GLN 52 N -0.86 0.38 -0.26 1.48 -2.07 -0.93 -4.90 119.66 112.50 2yrp s GLN 52 Ca 0.14 0.40 -0.02 0.00 -1.82 0.00 0.00 55.36 54.06 2yrp s GLN 52 Cb -0.12 -0.38 0.14 0.00 -1.09 0.00 0.00 33.01 31.56 2yrp s GLN 52 CO 0.03 -0.78 0.40 -0.46 -1.32 0.00 0.00 175.29 173.16 2yrp s TRP 53 N 2.55 -0.92 -0.58 9.60 -0.00 -1.26 -4.75 118.94 123.57 2yrp s TRP 53 Ca 0.12 0.83 -0.16 0.00 -0.00 0.00 0.00 56.10 56.89 2yrp s TRP 53 Cb -0.14 0.04 0.14 0.00 -0.00 0.00 0.00 33.47 33.51 2yrp s TRP 53 CO -0.21 -0.77 0.54 -2.00 -0.00 0.00 0.00 176.95 174.51 2yrp s GLU 54 N 2.57 3.08 -0.07 5.86 2.12 -1.26 -4.58 118.70 126.42 2yrp s GLU 54 Ca 0.13 -1.80 -0.03 0.00 0.36 0.00 0.00 54.97 53.63 2yrp s GLU 54 Cb -0.15 -4.32 0.04 0.00 0.26 0.00 0.00 34.13 29.96 2yrp s GLU 54 CO -0.18 -1.33 0.13 -1.21 -0.54 0.00 0.00 175.26 172.12 2yrp s GLU 55 N 1.43 0.02 -0.13 4.30 2.02 -1.26 -5.10 118.70 119.98 2yrp s GLU 55 Ca 0.05 0.44 -0.03 0.00 0.02 0.00 0.00 54.97 55.45 2yrp s GLU 55 Cb -0.27 -0.28 -0.03 0.00 0.10 0.00 0.00 34.13 33.64 2yrp s GLU 55 CO 0.01 -0.26 -0.01 -2.00 0.02 0.00 0.00 175.26 173.03 2yrp s GLU 56 N 1.84 3.43 0.01 1.61 2.56 -1.26 -3.82 118.70 123.07 2yrp s GLU 56 Ca -0.01 -0.45 -0.01 0.00 0.00 0.00 0.00 54.97 54.50 2yrp s GLU 56 Cb -0.12 -2.91 -0.04 0.00 2.00 0.00 0.00 34.13 33.07 2yrp s GLU 56 CO -0.05 0.44 0.13 0.00 -0.56 0.00 0.00 175.26 175.22 2yrp s ALA 57 N -0.16 3.76 0.30 6.30 0.00 -1.25 -4.93 121.76 125.77 2yrp s ALA 57 Ca 0.04 -0.85 -0.29 0.00 0.00 0.00 0.00 51.96 50.86 2yrp s ALA 57 Cb -0.13 -1.69 -0.10 0.00 0.00 0.00 0.00 23.12 21.20 2yrp s ALA 57 CO 0.02 0.74 1.40 0.99 0.00 0.00 0.00 175.76 178.91 2yrp s THR 58 N -1.30 2.58 0.00 0.00 2.01 -1.26 -4.85 115.64 112.82 2yrp s THR 58 Ca 0.27 0.54 0.06 0.00 0.31 0.00 0.00 61.69 62.87 2yrp s THR 58 Cb -0.12 -3.34 -0.03 0.00 0.01 0.00 0.00 72.50 69.02 2yrp s THR 58 CO 0.18 0.11 -0.19 -0.69 -0.69 0.00 0.00 174.62 173.34 2yrp s VAL 59 N -0.59 2.71 -0.70 3.82 1.01 -1.26 -2.58 120.40 122.81 2yrp s VAL 59 Ca 0.55 -1.04 -0.05 0.00 0.00 0.00 0.00 61.98 61.43 2yrp s VAL 59 Cb -0.42 -2.08 0.18 0.00 0.00 0.00 0.00 36.38 34.06 2yrp s VAL 59 CO 0.50 0.46 0.55 0.21 0.00 0.00 0.00 175.10 176.82 2yrp s ASN 60 N -1.06 5.65 0.44 3.32 2.47 -0.94 -4.90 114.94 119.92 2yrp s ASN 60 Ca 0.13 -2.91 0.30 0.00 0.42 0.00 0.00 52.86 50.80 2yrp s ASN 60 Cb -0.10 -1.94 1.55 0.00 -1.45 0.00 0.00 41.25 39.31 2yrp s ASN 60 CO 0.02 -0.40 1.93 0.08 -3.72 0.00 0.00 177.10 175.01 2yrp h ARG 61 N 7.10 0.00 0.00 0.43 -0.00 -1.86 0.40 114.38 120.45 2yrp h ARG 61 Ca 0.03 0.00 -0.11 0.00 -0.00 0.00 0.00 59.98 59.90 2yrp h ARG 61 Cb 0.96 0.00 -0.02 0.00 -0.00 0.00 0.00 29.97 30.91 2yrp h ARG 61 CO 0.73 0.00 -0.52 -0.07 -0.00 0.00 0.00 179.97 180.11 2yrp h LEU 62 N 0.00 0.00 0.00 0.08 3.38 -1.92 -3.34 115.31 113.51 2yrp h LEU 62 Ca 0.00 0.00 -0.38 0.00 0.09 0.00 0.00 57.88 57.59 2yrp h LEU 62 Cb 0.12 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.81 2yrp h LEU 62 CO 0.00 0.52 -2.30 0.00 0.09 0.00 0.00 178.44 176.75 2yrp n GLN 63 N -3.88 0.51 -1.53 1.13 6.02 -0.54 -4.99 117.38 114.11 2yrp n GLN 63 Ca -0.01 0.19 -0.54 0.00 -0.01 0.00 0.00 57.00 56.63 2yrp n GLN 63 Cb 0.54 -1.36 -0.06 0.00 1.02 0.00 0.00 30.24 30.38 2yrp n GLN 63 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 2yrp n SER 64 N -3.81 0.60 -4.76 1.08 3.41 0.02 -4.85 113.62 105.32 2yrp n SER 64 Ca -0.44 1.14 -0.29 0.00 -0.26 0.00 0.00 58.87 59.02 2yrp n SER 64 Cb 0.85 -1.06 -0.07 0.00 -0.26 0.00 0.00 64.21 63.67 2yrp n SER 64 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 2yrp s ASN 65 N 0.03 4.24 0.56 4.04 2.47 0.32 -4.88 114.94 121.72 2yrp s ASN 65 Ca 0.83 -1.40 0.27 0.00 0.42 0.00 0.00 52.86 52.98 2yrp s ASN 65 Cb -1.06 0.10 1.47 0.00 -1.45 0.00 0.00 41.25 40.31 2yrp s ASN 65 CO 0.53 -0.75 1.99 1.05 -3.72 0.00 0.00 177.10 176.20 2yrp h GLU 66 N 1.34 0.00 0.00 0.43 9.09 -1.93 -1.08 114.58 122.43 2yrp h GLU 66 Ca -0.42 0.00 -0.04 0.00 0.05 0.00 0.00 59.36 58.95 2yrp h GLU 66 Cb 1.28 0.00 -0.08 0.00 -1.65 0.00 0.00 28.75 28.31 2yrp h GLU 66 CO 0.71 0.00 -0.48 1.33 0.05 0.00 0.00 179.01 180.62 2yrp n VAL 67 N -4.11 1.44 -3.73 -1.06 0.24 -1.26 -0.03 118.33 109.82 2yrp n VAL 67 Ca 0.08 -2.19 -0.12 0.00 -2.04 0.00 0.00 64.34 60.07 2yrp n VAL 67 Cb 0.58 0.09 -0.10 0.00 -1.47 0.00 0.00 33.84 32.94 2yrp n VAL 67 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 2yrp s THR 68 N -2.14 -0.01 -0.27 3.34 2.01 -0.41 -3.47 115.64 114.70 2yrp s THR 68 Ca 0.31 0.02 -0.00 0.00 0.31 0.00 0.00 61.69 62.34 2yrp s THR 68 Cb 0.31 -0.57 0.08 0.00 0.01 0.00 0.00 72.50 72.33 2yrp s THR 68 CO -0.06 0.01 0.03 -0.76 -0.69 0.00 0.00 174.62 173.16 2yrp s LEU 69 N 0.50 2.46 -0.30 4.42 1.43 -1.02 0.12 118.68 126.29 2yrp s LEU 69 Ca -0.02 -1.40 -0.13 0.00 -1.03 0.00 0.00 54.13 51.55 2yrp s LEU 69 Cb -0.04 -1.01 -0.04 0.00 0.03 0.00 0.00 46.19 45.13 2yrp s LEU 69 CO -0.03 -0.33 0.26 -0.89 0.23 0.00 0.00 176.35 175.59 2yrp s THR 70 N 1.50 5.26 0.22 5.49 2.01 -1.26 -1.37 115.64 127.49 2yrp s THR 70 Ca 0.03 0.14 -0.06 0.00 0.31 0.00 0.00 61.69 62.11 2yrp s THR 70 Cb -0.18 -3.64 -0.02 0.00 0.01 0.00 0.00 72.50 68.67 2yrp s THR 70 CO -0.14 0.13 0.28 -1.48 -0.69 0.00 0.00 174.62 172.72 2yrp s LEU 71 N 1.84 0.80 -0.39 4.42 2.34 -0.73 -2.22 118.68 124.74 2yrp s LEU 71 Ca 0.09 -1.19 -0.09 0.00 0.06 0.00 0.00 54.13 53.00 2yrp s LEU 71 Cb -0.16 0.97 0.06 0.00 -0.56 0.00 0.00 46.19 46.50 2yrp s LEU 71 CO 0.11 -0.97 0.21 -0.89 -1.06 0.00 0.00 176.35 173.75 2yrp s THR 72 N -4.10 4.16 0.09 5.48 2.01 -1.06 -1.11 115.64 121.10 2yrp s THR 72 Ca 0.32 -1.24 -0.24 0.00 0.31 0.00 0.00 61.69 60.84 2yrp s THR 72 Cb 0.04 -3.46 -0.13 0.00 0.01 0.00 0.00 72.50 68.96 2yrp s THR 72 CO 0.11 -0.37 0.54 0.52 -0.69 0.00 0.00 174.62 174.73 2yrp n VAL 73 N 4.90 0.87 -1.17 3.82 0.31 -1.15 -4.25 118.33 121.66 2yrp n VAL 73 Ca -0.11 -0.22 -0.29 0.00 -0.01 0.00 0.00 64.34 63.72 2yrp n VAL 73 Cb 0.44 0.00 0.17 0.00 -0.91 0.00 0.00 33.84 33.54 2yrp n VAL 73 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 2yrp s PRO 74 N -0.44 0.56 -0.34 5.55 0.04 -1.26 -2.29 135.00 136.83 2yrp s PRO 74 Ca 0.55 0.57 -0.18 0.00 0.04 0.00 0.00 61.00 61.98 2yrp s PRO 74 Cb -0.78 -1.75 -0.01 0.00 0.04 0.00 0.00 34.50 32.00 2yrp s PRO 74 CO 0.41 -2.65 0.52 -1.21 0.04 0.00 0.00 177.00 174.11 2yrp s GLU 75 N -4.96 3.69 0.24 4.56 2.02 -1.26 -4.23 118.70 118.76 2yrp s GLU 75 Ca 0.65 -0.07 -0.31 0.00 0.02 0.00 0.00 54.97 55.25 2yrp s GLU 75 Cb -0.18 -3.79 -0.13 0.00 0.10 0.00 0.00 34.13 30.13 2yrp s GLU 75 CO 0.57 -0.61 1.50 0.98 0.02 0.00 0.00 175.26 177.73 2yrp n TYR 76 N 5.74 2.38 0.20 1.61 9.36 -0.78 -4.91 117.16 130.76 2yrp n TYR 76 Ca -0.04 0.34 -0.17 0.00 3.32 0.00 0.00 57.90 61.34 2yrp n TYR 76 Cb 0.49 -2.52 -0.10 0.00 -0.63 0.00 0.00 39.34 36.58 2yrp n TYR 76 CO 0.00 0.00 0.00 1.03 0.22 0.00 0.00 176.86 178.11 2yrp h SER 77 N 4.81 -1.51 -1.83 2.98 0.87 -1.96 -3.32 113.55 113.59 2yrp h SER 77 Ca -0.45 0.14 -0.63 0.00 -1.23 0.00 0.00 61.79 59.62 2yrp h SER 77 Cb 1.26 0.53 -0.13 0.00 -0.44 0.00 0.00 62.40 63.62 2yrp h SER 77 CO 0.80 -0.62 1.13 0.21 -0.53 0.00 0.00 176.83 177.82 2yrp s ASN 78 N -4.52 6.49 -0.21 6.23 3.84 -1.26 -4.79 114.94 120.71 2yrp s ASN 78 Ca -0.17 -1.53 -0.21 0.00 0.21 0.00 0.00 52.86 51.16 2yrp s ASN 78 Cb 0.05 -2.49 -0.18 0.00 -0.55 0.00 0.00 41.25 38.08 2yrp s ASN 78 CO 0.61 -1.37 0.16 0.29 -2.79 0.00 0.00 177.10 173.99 2yrp n LYS 79 N 7.98 0.56 -0.35 0.43 5.02 -1.25 -4.20 118.16 126.35 2yrp n LYS 79 Ca 0.24 0.55 0.30 0.00 -2.02 0.00 0.00 58.31 57.38 2yrp n LYS 79 Cb 0.50 -1.73 0.52 0.00 -0.02 0.00 0.00 35.03 34.30 2yrp n LYS 79 CO 0.00 0.00 0.00 2.89 -0.52 0.00 0.00 177.40 179.77 2yrp n ARG 80 N -4.42 -0.03 -1.12 1.97 1.85 -1.26 -4.55 116.66 109.09 2yrp n ARG 80 Ca -0.33 0.99 -0.37 0.00 -1.00 0.00 0.00 57.85 57.14 2yrp n ARG 80 Cb 0.68 -1.92 -0.01 0.00 -1.05 0.00 0.00 32.46 30.17 2yrp n ARG 80 CO 0.00 0.00 0.00 1.33 -0.01 0.00 0.00 177.63 178.95 2yrp n VAL 81 N -4.32 0.92 -0.53 8.89 0.24 -1.26 -4.87 118.33 117.40 2yrp n VAL 81 Ca 0.31 -0.42 0.07 0.00 -2.04 0.00 0.00 64.34 62.26 2yrp n VAL 81 Cb 1.19 0.00 0.19 0.00 -1.47 0.00 0.00 33.84 33.75 2yrp n VAL 81 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 2yrp n SER 82 N 1.87 3.30 -4.14 -1.34 2.88 -1.26 -4.97 113.62 109.96 2yrp n SER 82 Ca 0.11 -2.45 -0.15 0.00 -1.33 0.00 0.00 58.87 55.06 2yrp n SER 82 Cb 0.29 -0.36 -0.11 0.00 -0.75 0.00 0.00 64.21 63.28 2yrp n SER 82 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 2yrp s ARG 83 N -1.80 0.73 0.08 -1.46 1.81 -1.26 -4.93 118.95 112.13 2yrp s ARG 83 Ca 0.31 -0.99 -0.31 0.00 -1.72 0.00 0.00 55.73 53.02 2yrp s ARG 83 Cb 0.21 -0.50 -0.07 0.00 -0.45 0.00 0.00 34.95 34.14 2yrp s ARG 83 CO 0.12 0.09 1.38 -1.25 -0.68 0.00 0.00 175.30 174.96 2yrp s PRO 84 N -2.20 4.32 0.04 3.54 0.04 -1.26 -4.71 135.00 134.77 2yrp s PRO 84 Ca -0.01 2.03 0.02 0.00 0.04 0.00 0.00 61.00 63.08 2yrp s PRO 84 Cb -0.06 -3.35 -0.04 0.00 0.04 0.00 0.00 34.50 31.09 2yrp s PRO 84 CO 0.00 -0.46 0.05 0.08 0.04 0.00 0.00 177.00 176.71 2yrp s VAL 85 N 1.46 4.44 -0.26 -0.36 1.01 -0.83 -4.91 120.40 120.95 2yrp s VAL 85 Ca 0.64 -0.66 -0.11 0.00 0.00 0.00 0.00 61.98 61.85 2yrp s VAL 85 Cb -0.35 -3.08 -0.05 0.00 0.00 0.00 0.00 36.38 32.91 2yrp s VAL 85 CO 0.29 0.24 0.17 -1.58 0.00 0.00 0.00 175.10 174.22 2yrp s GLN 86 N -2.03 3.99 0.41 2.72 2.00 -1.26 0.02 119.66 125.51 2yrp s GLN 86 Ca 0.25 -0.30 0.03 0.00 -2.00 0.00 0.00 55.36 53.34 2yrp s GLN 86 Cb -0.12 -3.59 -0.03 0.00 0.80 0.00 0.00 33.01 30.07 2yrp s GLN 86 CO 0.17 -0.07 0.10 0.14 -0.50 0.00 0.00 175.29 175.13 2yrp s VAL 87 N 1.43 0.75 -0.01 1.34 -7.23 -0.28 -4.81 120.40 111.59 2yrp s VAL 87 Ca 0.07 -2.00 -0.04 0.00 -1.81 0.00 0.00 61.98 58.20 2yrp s VAL 87 Cb -0.15 -2.37 0.00 0.00 0.56 0.00 0.00 36.38 34.42 2yrp s VAL 87 CO 0.08 0.00 0.09 -0.31 -0.31 0.00 0.00 175.10 174.64 2yrp s TYR 88 N -3.17 0.02 0.21 2.82 1.51 -1.16 -1.14 117.35 116.44 2yrp s TYR 88 Ca 0.23 -0.05 0.00 0.00 -1.01 0.00 0.00 57.07 56.24 2yrp s TYR 88 Cb 0.03 -0.04 -0.04 0.00 -0.11 0.00 0.00 41.96 41.79 2yrp s TYR 88 CO 0.13 -0.17 0.09 -0.59 -1.11 0.00 0.00 175.55 173.90 2yrp s PHE 89 N -0.79 1.26 0.22 2.71 -0.12 -1.23 -0.12 117.98 119.92 2yrp s PHE 89 Ca -0.09 -1.23 -0.23 0.00 -0.05 0.00 0.00 56.93 55.33 2yrp s PHE 89 Cb -0.05 -0.69 0.04 0.00 -0.63 0.00 0.00 43.02 41.69 2yrp s PHE 89 CO 0.00 -0.45 0.82 1.52 -0.05 0.00 0.00 175.22 177.06 2yrp s TYR 90 N -3.92 -0.18 -0.22 3.49 1.13 -1.08 -1.52 117.35 115.05 2yrp s TYR 90 Ca 0.34 -0.20 -0.07 0.00 -1.41 0.00 0.00 57.07 55.73 2yrp s TYR 90 Cb 0.07 0.67 -0.03 0.00 -1.10 0.00 0.00 41.96 41.57 2yrp s TYR 90 CO 0.10 -1.05 0.07 0.08 -2.51 0.00 0.00 175.55 172.24 2yrp s VAL 91 N -3.64 4.51 -0.33 -3.49 1.01 -1.26 -3.00 120.40 114.20 2yrp s VAL 91 Ca 0.11 -0.12 -0.08 0.00 0.00 0.00 0.00 61.98 61.89 2yrp s VAL 91 Cb -0.04 -3.07 0.02 0.00 0.00 0.00 0.00 36.38 33.29 2yrp s VAL 91 CO 0.04 0.39 0.13 -0.94 0.00 0.00 0.00 175.10 174.72 2yrp s SER 92 N 1.08 5.39 -0.32 3.32 1.04 0.52 -0.55 113.70 124.18 2yrp s SER 92 Ca 0.04 -0.89 0.02 0.00 0.48 0.00 0.00 55.95 55.60 2yrp s SER 92 Cb -0.14 -1.93 0.09 0.00 0.10 0.00 0.00 66.02 64.15 2yrp s SER 92 CO 0.03 -0.28 0.05 0.20 0.98 0.00 0.00 173.24 174.21 2yrp s ASN 93 N 1.50 4.45 0.00 7.02 0.01 -0.47 -3.09 114.94 124.35 2yrp s ASN 93 Ca 0.01 -1.87 0.00 0.00 -0.71 0.00 0.00 52.86 50.29 2yrp s ASN 93 Cb -0.18 -1.36 0.00 0.00 0.41 0.00 0.00 41.25 40.12 2yrp s ASN 93 CO 0.04 -0.37 0.00 0.61 -1.51 0.00 0.00 177.10 175.87 2yrp n GLY 94 N 4.47 0.86 1.02 0.66 0.00 -1.26 -3.91 105.19 107.04 2yrp n GLY 94 Ca -0.00 -1.28 -0.00 0.00 0.00 0.00 0.00 46.02 44.73 2yrp n GLY 94 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2yrp n ARG 95 N 0.00 0.01 -0.01 1.61 1.74 -1.26 -4.88 116.66 113.87 2yrp n ARG 95 Ca 0.00 0.01 0.06 0.00 -0.77 0.00 0.00 57.85 57.14 2yrp n ARG 95 Cb 0.00 -0.52 -0.11 0.00 -1.02 0.00 0.00 32.46 30.81 2yrp n ARG 95 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2yrp n ARG 96 N -3.43 0.57 -2.36 5.56 1.74 -1.26 -4.90 116.66 112.58 2yrp n ARG 96 Ca -0.01 -0.12 -0.41 0.00 -0.77 0.00 0.00 57.85 56.55 2yrp n ARG 96 Cb 0.10 -1.33 -0.03 0.00 -1.02 0.00 0.00 32.46 30.18 2yrp n ARG 96 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 2yrp s LYS 97 N -2.91 3.12 0.32 5.56 3.01 -1.25 -4.94 119.74 122.65 2yrp s LYS 97 Ca -0.05 0.29 -0.05 0.00 -1.01 0.00 0.00 55.97 55.15 2yrp s LYS 97 Cb 0.08 -4.20 0.00 0.00 -1.01 0.00 0.00 37.83 32.71 2yrp s LYS 97 CO 0.58 -2.17 0.47 -0.98 0.51 0.00 0.00 175.35 173.76 2yrp s ARG 98 N 5.91 1.81 0.14 1.68 1.04 -1.26 -1.37 118.95 126.90 2yrp s ARG 98 Ca 0.51 -1.63 0.04 0.00 -1.04 0.00 0.00 55.73 53.61 2yrp s ARG 98 Cb -0.10 0.45 -0.04 0.00 -2.04 0.00 0.00 34.95 33.21 2yrp s ARG 98 CO 0.21 -0.75 0.13 0.45 -0.04 0.00 0.00 175.30 175.30 2yrp s SER 99 N -3.18 5.58 0.43 -2.89 0.15 0.29 -4.50 113.70 109.58 2yrp s SER 99 Ca 0.29 -0.07 -0.24 0.00 0.70 0.00 0.00 55.95 56.62 2yrp s SER 99 Cb -0.00 -1.49 -0.08 0.00 -1.71 0.00 0.00 66.02 62.74 2yrp s SER 99 CO 0.17 0.10 1.18 -2.16 1.20 0.00 0.00 173.24 173.72 2yrp s PRO 100 N -2.91 3.88 0.67 5.44 0.04 -1.26 -4.23 135.00 136.62 2yrp s PRO 100 Ca 0.31 1.83 -0.17 0.00 0.04 0.00 0.00 61.00 63.00 2yrp s PRO 100 Cb -0.11 -2.53 -0.02 0.00 0.04 0.00 0.00 34.50 31.88 2yrp s PRO 100 CO 0.23 -0.47 0.96 0.25 0.04 0.00 0.00 177.00 178.02 2yrp n THR 101 N -0.24 3.35 -5.10 1.26 -2.24 -1.26 -4.75 114.28 105.30 2yrp n THR 101 Ca 0.06 -0.44 -0.28 0.00 -2.27 0.00 0.00 64.05 61.12 2yrp n THR 101 Cb 0.47 -1.12 -0.16 0.00 -2.10 0.00 0.00 70.33 67.42 2yrp n THR 101 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 2yrp s GLN 102 N -3.06 1.81 -0.07 -0.78 -1.52 -0.58 -4.94 119.66 110.51 2yrp s GLN 102 Ca 0.75 -0.80 -0.30 0.00 -1.95 0.00 0.00 55.36 53.07 2yrp s GLN 102 Cb -0.38 -1.75 -0.05 0.00 -0.22 0.00 0.00 33.01 30.61 2yrp s GLN 102 CO 0.48 0.48 1.68 0.45 -0.25 0.00 0.00 175.29 178.13 2yrp s SER 103 N -0.52 6.59 0.16 5.90 0.15 -1.26 -3.50 113.70 121.23 2yrp s SER 103 Ca 0.09 2.17 0.02 0.00 0.70 0.00 0.00 55.95 58.92 2yrp s SER 103 Cb -0.09 -2.53 -0.05 0.00 -1.71 0.00 0.00 66.02 61.65 2yrp s SER 103 CO -0.01 -1.00 -0.01 0.12 1.20 0.00 0.00 173.24 173.54 2yrp s PHE 104 N 4.30 1.18 -0.20 3.44 5.36 -0.29 -5.03 117.98 126.74 2yrp s PHE 104 Ca 0.74 -0.99 -0.11 0.00 -0.96 0.00 0.00 56.93 55.61 2yrp s PHE 104 Cb -0.33 -0.67 0.06 0.00 -0.34 0.00 0.00 43.02 41.75 2yrp s PHE 104 CO 0.30 -0.18 0.48 0.50 -1.46 0.00 0.00 175.22 174.86 2yrp s ARG 105 N -3.89 0.48 -0.17 10.12 3.52 -1.26 -1.12 118.95 126.62 2yrp s ARG 105 Ca 0.22 0.89 -0.16 0.00 -0.13 0.00 0.00 55.73 56.55 2yrp s ARG 105 Cb 0.06 0.03 -0.04 0.00 -1.56 0.00 0.00 34.95 33.44 2yrp s ARG 105 CO 0.03 -0.15 0.38 -0.06 -0.81 0.00 0.00 175.30 174.68 2yrp s PHE 106 N 1.39 3.44 -0.02 5.12 0.08 0.10 -3.51 117.98 124.58 2yrp s PHE 106 Ca -0.09 0.67 -0.09 0.00 0.12 0.00 0.00 56.93 57.54 2yrp s PHE 106 Cb -0.07 -2.47 -0.05 0.00 -0.57 0.00 0.00 43.02 39.86 2yrp s PHE 106 CO -0.14 0.12 0.28 -0.51 -0.10 0.00 0.00 175.22 174.87 2yrp s LEU 107 N 0.86 4.40 0.20 -0.37 1.43 0.75 -1.96 118.68 123.98 2yrp s LEU 107 Ca 0.20 0.65 -0.30 0.00 -1.03 0.00 0.00 54.13 53.65 2yrp s LEU 107 Cb -0.14 -2.54 -0.09 0.00 0.03 0.00 0.00 46.19 43.45 2yrp s LEU 107 CO 0.07 0.30 1.31 -2.16 0.23 0.00 0.00 176.35 176.09 2yrp s PRO 108 N -1.45 4.39 0.04 1.29 0.04 -1.26 -2.06 135.00 135.99 2yrp s PRO 108 Ca 0.24 2.05 0.08 0.00 0.04 0.00 0.00 61.00 63.41 2yrp s PRO 108 Cb -0.14 -3.20 -0.23 0.00 0.04 0.00 0.00 34.50 30.98 2yrp s PRO 108 CO 0.13 -0.25 0.97 0.28 0.04 0.00 0.00 177.00 178.16 2yrp h VAL 109 N 3.75 1.28 -0.69 -0.36 2.07 -1.96 -3.47 116.25 116.88 2yrp h VAL 109 Ca -0.45 -3.04 -0.57 0.00 0.82 0.00 0.00 66.70 63.46 2yrp h VAL 109 Cb 1.21 2.66 0.02 0.00 -1.52 0.00 0.00 31.29 33.67 2yrp h VAL 109 CO 0.77 0.76 0.25 -0.38 0.02 0.00 0.00 177.57 178.98 2yrp n ILE 110 N -3.24 0.00 -3.41 4.57 5.41 -1.26 0.07 119.36 121.50 2yrp n ILE 110 Ca -0.09 0.00 -0.18 0.00 1.00 0.00 0.00 62.75 63.47 2yrp n ILE 110 Cb 1.00 -0.16 0.08 0.00 -0.71 0.00 0.00 39.64 39.85 2yrp n ILE 110 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2yrp n LYS 112 N -4.23 0.94 -0.03 0.00 4.81 0.11 -4.82 118.16 114.94 2yrp n LYS 112 Ca -0.16 0.34 -0.04 0.00 -0.87 0.00 0.00 58.31 57.58 2yrp n LYS 112 Cb 0.62 -2.00 -0.03 0.00 0.02 0.00 0.00 35.03 33.64 2yrp n LYS 112 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 2yrp n GLU 113 N 5.27 0.20 0.00 1.64 -0.58 -1.26 -5.19 120.64 120.72 2yrp n GLU 113 Ca 0.28 0.03 0.00 0.00 -0.42 0.00 0.00 57.16 57.06 2yrp n GLU 113 Cb 0.10 -1.12 0.00 0.00 -0.57 0.00 0.00 31.44 29.84 2yrp n GLU 113 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74