#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 -0.68 -0.30 1.61 1.04 -1.26 -5.16 113.70 108.96 2yrp s SER 2 Ca 0.00 1.07 -0.13 0.00 0.48 0.00 0.00 55.95 57.37 2yrp s SER 2 Cb 0.00 1.00 0.15 0.00 0.10 0.00 0.00 66.02 67.27 2yrp s SER 2 CO 0.00 -0.39 0.84 -0.94 0.98 0.00 0.00 173.24 173.73 2yrp s SER 3 N -0.33 -0.81 -0.41 7.02 1.04 -1.26 -5.05 113.70 113.91 2yrp s SER 3 Ca -0.04 1.14 -0.04 0.00 0.48 0.00 0.00 55.95 57.49 2yrp s SER 3 Cb -0.03 1.86 0.05 0.00 0.10 0.00 0.00 66.02 68.01 2yrp s SER 3 CO 0.04 -0.16 2.76 0.61 0.98 0.00 0.00 173.24 177.47 2yrp n GLY 4 N 5.02 4.23 3.54 7.32 0.00 -1.26 -4.86 105.19 119.18 2yrp n GLY 4 Ca -0.12 -1.76 -0.11 0.00 0.00 0.00 0.00 46.02 44.04 2yrp n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yrp s SER 5 N 0.45 -0.41 -0.32 1.61 0.01 -1.26 -5.04 113.70 108.75 2yrp s SER 5 Ca 0.57 0.27 -0.01 0.00 1.31 0.00 0.00 55.95 58.08 2yrp s SER 5 Cb 0.37 0.37 0.19 0.00 0.21 0.00 0.00 66.02 67.15 2yrp s SER 5 CO -0.19 -0.50 2.13 -1.20 0.41 0.00 0.00 173.24 173.89 2yrp n SER 6 N 0.33 6.44 -4.04 2.44 7.64 -1.26 -4.83 113.62 120.34 2yrp n SER 6 Ca -0.11 -3.06 -0.30 0.00 1.01 0.00 0.00 58.87 56.41 2yrp n SER 6 Cb 0.59 -1.08 -0.08 0.00 -1.01 0.00 0.00 64.21 62.63 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 0.46 -0.19 3.79 0.23 0.00 -1.26 -4.87 105.19 103.34 2yrp n GLY 7 Ca 0.32 0.12 -0.39 0.00 0.00 0.00 0.00 46.02 46.07 2yrp n GLY 7 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2yrp s LEU 8 N -6.51 4.45 1.08 0.99 1.43 -1.26 -5.01 118.68 113.86 2yrp s LEU 8 Ca 0.27 1.13 -0.15 0.00 -1.03 0.00 0.00 54.13 54.35 2yrp s LEU 8 Cb -0.16 -2.84 0.23 0.00 0.03 0.00 0.00 46.19 43.45 2yrp s LEU 8 CO 0.85 0.18 1.10 -2.16 0.23 0.00 0.00 176.35 176.55 2yrp s PRO 9 N -0.55 -0.26 0.01 1.29 0.04 -1.24 -4.57 135.00 129.72 2yrp s PRO 9 Ca 0.29 0.28 -0.17 0.00 0.04 0.00 0.00 61.00 61.43 2yrp s PRO 9 Cb -0.18 -1.68 0.03 0.00 0.04 0.00 0.00 34.50 32.71 2yrp s PRO 9 CO 0.17 -3.14 0.37 -1.14 0.04 0.00 0.00 177.00 173.29 2yrp s GLN 10 N -5.13 0.80 -0.29 4.56 0.74 -0.45 -4.87 119.66 115.02 2yrp s GLN 10 Ca 0.68 -0.26 -0.01 0.00 0.05 0.00 0.00 55.36 55.81 2yrp s GLN 10 Cb -0.15 0.35 0.09 0.00 1.10 0.00 0.00 33.01 34.41 2yrp s GLN 10 CO 0.57 -0.24 0.09 0.08 -0.55 0.00 0.00 175.29 175.24 2yrp s VAL 11 N -1.85 0.70 -0.11 1.34 1.01 -1.26 -2.98 120.40 117.26 2yrp s VAL 11 Ca -0.10 -1.19 -0.14 0.00 0.00 0.00 0.00 61.98 60.55 2yrp s VAL 11 Cb -0.03 -1.49 -0.12 0.00 0.00 0.00 0.00 36.38 34.74 2yrp s VAL 11 CO 0.02 -0.61 0.39 -0.08 0.00 0.00 0.00 175.10 174.81 2yrp h GLU 12 N 8.15 -0.02 -1.99 2.72 4.57 -0.23 -3.47 114.58 124.31 2yrp h GLU 12 Ca -0.15 0.00 -0.03 0.00 -1.18 0.00 0.00 59.36 58.00 2yrp h GLU 12 Cb 1.03 0.00 -0.21 0.00 -0.16 0.00 0.00 28.75 29.41 2yrp h GLU 12 CO 0.45 0.44 0.11 0.00 -1.18 0.00 0.00 179.01 178.84 2yrp s ALA 13 N -2.49 -1.80 0.30 2.92 0.00 -1.06 -5.01 121.76 114.62 2yrp s ALA 13 Ca -0.09 2.10 0.08 0.00 0.00 0.00 0.00 51.96 54.06 2yrp s ALA 13 Cb -0.01 -1.23 -0.04 0.00 0.00 0.00 0.00 23.12 21.84 2yrp s ALA 13 CO 0.33 -0.35 0.11 1.52 0.00 0.00 0.00 175.76 177.37 2yrp s TYR 14 N 0.61 2.78 -0.21 0.00 -0.85 -1.26 -0.43 117.35 117.99 2yrp s TYR 14 Ca -0.02 -0.27 -0.28 0.00 -0.52 0.00 0.00 57.07 55.98 2yrp s TYR 14 Cb -0.05 -1.45 0.11 0.00 0.38 0.00 0.00 41.96 40.96 2yrp s TYR 14 CO -0.03 0.46 0.95 0.45 -1.52 0.00 0.00 175.55 175.86 2yrp s SER 15 N -3.79 -0.48 0.50 -0.18 0.15 -0.49 -4.18 113.70 105.22 2yrp s SER 15 Ca 0.35 0.74 -0.21 0.00 0.70 0.00 0.00 55.95 57.52 2yrp s SER 15 Cb -0.05 0.69 -0.07 0.00 -1.71 0.00 0.00 66.02 64.88 2yrp s SER 15 CO 0.22 -0.28 1.15 -2.16 1.20 0.00 0.00 173.24 173.37 2yrp s PRO 16 N -0.41 3.59 0.45 5.44 0.04 -1.26 0.42 135.00 143.27 2yrp s PRO 16 Ca -0.01 1.70 0.29 0.00 0.04 0.00 0.00 61.00 63.02 2yrp s PRO 16 Cb -0.03 -2.23 1.36 0.00 0.04 0.00 0.00 34.50 33.64 2yrp s PRO 16 CO -0.01 -0.67 1.70 0.77 0.04 0.00 0.00 177.00 178.83 2yrp h SER 17 N 1.68 0.25 -5.89 6.66 0.02 -1.99 -3.42 113.55 110.86 2yrp h SER 17 Ca -0.50 0.08 -0.47 0.00 -0.84 0.00 0.00 61.79 60.07 2yrp h SER 17 Cb 1.25 0.06 -0.13 0.00 0.14 0.00 0.00 62.40 63.72 2yrp h SER 17 CO 0.59 -0.05 -0.47 0.00 -1.14 0.00 0.00 176.83 175.76 2yrp s ALA 18 N -5.27 1.83 0.23 3.77 0.00 -1.26 -4.68 121.76 116.38 2yrp s ALA 18 Ca -0.07 -2.06 -0.09 0.00 0.00 0.00 0.00 51.96 49.73 2yrp s ALA 18 Cb 0.27 1.47 0.03 0.00 0.00 0.00 0.00 23.12 24.89 2yrp s ALA 18 CO 0.82 -0.67 0.47 0.00 0.00 0.00 0.00 175.76 176.37 2yrp s SER 20 N -2.21 6.35 0.57 0.00 1.04 -1.26 0.13 113.70 118.31 2yrp s SER 20 Ca 0.09 0.21 0.27 0.00 0.48 0.00 0.00 55.95 57.01 2yrp s SER 20 Cb -0.03 -1.93 1.50 0.00 0.10 0.00 0.00 66.02 65.67 2yrp s SER 20 CO 0.07 0.02 2.00 -0.37 0.98 0.00 0.00 173.24 175.94 2yrp h VAL 21 N 1.58 0.54 -0.18 5.02 -1.51 -1.79 0.10 116.25 120.01 2yrp h VAL 21 Ca -0.49 0.00 -0.15 0.00 -1.23 0.00 0.00 66.70 64.83 2yrp h VAL 21 Cb 1.20 0.73 -0.01 0.00 -2.13 0.00 0.00 31.29 31.08 2yrp h VAL 21 CO 0.68 0.00 -0.53 0.08 -1.23 0.00 0.00 177.57 176.57 2yrp h ARG 22 N 0.00 0.51 0.00 5.19 0.11 -1.88 -2.73 114.38 115.58 2yrp h ARG 22 Ca 0.19 -0.31 0.00 0.00 0.10 0.00 0.00 59.98 59.96 2yrp h ARG 22 Cb 0.91 0.03 0.00 0.00 1.11 0.00 0.00 29.97 32.02 2yrp h ARG 22 CO -0.00 0.91 0.00 0.41 0.10 0.00 0.00 179.97 181.39 2yrp n GLY 23 N 0.20 1.70 3.72 0.08 0.00 0.35 -4.50 105.19 106.73 2yrp n GLY 23 Ca -0.03 -0.25 -0.27 0.00 0.00 0.00 0.00 46.02 45.46 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 -0.21 3.49 -0.02 0.00 -1.18 -4.78 105.19 102.49 2yrp n GLY 24 Ca 0.00 0.08 -0.23 0.00 0.00 0.00 0.00 46.02 45.87 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 -5.71 1.75 -0.56 1.61 2.02 -1.26 -5.00 118.70 111.54 2yrp s GLU 25 Ca 0.37 -2.00 -0.20 0.00 0.02 0.00 0.00 54.97 53.17 2yrp s GLU 25 Cb -0.22 -0.91 0.08 0.00 0.10 0.00 0.00 34.13 33.18 2yrp s GLU 25 CO 0.73 -0.23 0.73 -2.00 0.02 0.00 0.00 175.26 174.50 2yrp s GLU 26 N -3.85 3.11 -0.43 1.61 2.12 -1.26 -3.70 118.70 116.30 2yrp s GLU 26 Ca 0.33 -1.00 -0.14 0.00 0.36 0.00 0.00 54.97 54.52 2yrp s GLU 26 Cb 0.08 -4.18 0.04 0.00 0.26 0.00 0.00 34.13 30.33 2yrp s GLU 26 CO 0.15 -1.45 0.32 -1.17 -0.54 0.00 0.00 175.26 172.57 2yrp s LEU 27 N 2.96 5.27 -0.26 2.70 2.96 -1.19 -4.22 118.68 126.89 2yrp s LEU 27 Ca 0.16 -1.11 -0.11 0.00 -0.22 0.00 0.00 54.13 52.85 2yrp s LEU 27 Cb -0.20 -2.14 -0.05 0.00 0.50 0.00 0.00 46.19 44.29 2yrp s LEU 27 CO 0.10 -0.52 0.20 -0.69 -1.32 0.00 0.00 176.35 174.11 2yrp s VAL 28 N 1.64 5.32 -0.23 1.68 1.01 0.17 -3.37 120.40 126.61 2yrp s VAL 28 Ca 0.04 0.21 -0.07 0.00 0.00 0.00 0.00 61.98 62.16 2yrp s VAL 28 Cb -0.21 -3.53 -0.03 0.00 0.00 0.00 0.00 36.38 32.60 2yrp s VAL 28 CO 0.08 0.28 0.07 -0.76 0.00 0.00 0.00 175.10 174.77 2yrp s LEU 29 N 1.54 3.54 -0.11 3.92 1.43 -0.89 -1.40 118.68 126.71 2yrp s LEU 29 Ca 0.08 -0.14 -0.10 0.00 -1.03 0.00 0.00 54.13 52.95 2yrp s LEU 29 Cb -0.15 -1.94 -0.05 0.00 0.03 0.00 0.00 46.19 44.09 2yrp s LEU 29 CO 0.09 0.01 0.21 -0.89 0.23 0.00 0.00 176.35 176.00 2yrp s THR 30 N 1.33 5.37 0.00 5.49 2.01 0.43 -2.39 115.64 127.88 2yrp s THR 30 Ca 0.05 0.38 0.00 0.00 0.31 0.00 0.00 61.69 62.43 2yrp s THR 30 Cb -0.15 -3.50 0.00 0.00 0.01 0.00 0.00 72.50 68.86 2yrp s THR 30 CO 0.04 0.56 0.00 0.61 -0.69 0.00 0.00 174.62 175.14 2yrp n GLY 31 N 2.32 -0.56 3.71 4.40 0.00 -1.25 0.54 105.19 114.35 2yrp n GLY 31 Ca -0.17 0.30 0.01 0.00 0.00 0.00 0.00 46.02 46.15 2yrp n GLY 31 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2yrp s SER 32 N -4.00 -0.06 -1.40 1.61 0.15 -1.16 -4.50 113.70 104.33 2yrp s SER 32 Ca 0.00 -0.23 -0.07 0.00 0.70 0.00 0.00 55.95 56.35 2yrp s SER 32 Cb 0.00 0.23 0.04 0.00 -1.71 0.00 0.00 66.02 64.58 2yrp s SER 32 CO 0.00 -0.44 0.91 0.59 1.20 0.00 0.00 173.24 175.49 2yrp n ASN 33 N -0.62 -3.44 -4.95 5.45 4.13 -1.21 -1.35 115.26 113.28 2yrp n ASN 33 Ca -0.06 -0.75 -0.23 0.00 1.68 0.00 0.00 54.58 55.21 2yrp n ASN 33 Cb 0.62 -4.19 0.01 0.00 -1.54 0.00 0.00 39.78 34.67 2yrp n ASN 33 CO 0.00 0.00 0.00 -0.36 0.28 0.00 0.00 177.26 177.18 2yrp s PHE 34 N -3.45 3.26 0.03 3.10 0.08 -0.84 -3.69 117.98 116.47 2yrp s PHE 34 Ca 0.36 0.28 0.00 0.00 0.12 0.00 0.00 56.93 57.69 2yrp s PHE 34 Cb -0.17 -2.30 -0.03 0.00 -0.57 0.00 0.00 43.02 39.95 2yrp s PHE 34 CO 0.80 -0.34 -0.04 -0.51 -0.10 0.00 0.00 175.22 175.03 2yrp s LEU 35 N -4.57 2.30 0.00 -0.37 1.43 -1.26 -4.74 118.68 111.47 2yrp s LEU 35 Ca 0.48 -0.62 0.13 0.00 -1.03 0.00 0.00 54.13 53.09 2yrp s LEU 35 Cb -0.10 0.06 0.77 0.00 0.03 0.00 0.00 46.19 46.95 2yrp s LEU 35 CO 0.38 -0.34 1.20 -0.81 0.23 0.00 0.00 176.35 177.01 2yrp n PRO 36 N 1.24 0.49 -0.02 1.29 -0.04 -1.26 -2.20 135.00 134.50 2yrp n PRO 36 Ca -0.21 0.00 0.01 0.00 -0.04 0.00 0.00 63.50 63.25 2yrp n PRO 36 Cb 0.56 -1.41 -0.06 0.00 -0.04 0.00 0.00 33.50 32.55 2yrp n PRO 36 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 2yrp n ASP 37 N -0.91 3.28 -3.05 3.54 5.68 -1.26 -4.73 116.55 119.10 2yrp n ASP 37 Ca 0.10 0.00 -0.32 0.00 -0.50 0.00 0.00 54.79 54.07 2yrp n ASP 37 Cb 0.04 1.08 -0.01 0.00 -1.14 0.00 0.00 41.12 41.09 2yrp n ASP 37 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 2yrp n SER 38 N -1.95 -1.31 -4.38 -1.12 7.64 -0.93 -4.95 113.62 106.62 2yrp n SER 38 Ca -0.05 0.71 -0.31 0.00 1.01 0.00 0.00 58.87 60.22 2yrp n SER 38 Cb 0.40 -0.65 -0.14 0.00 -1.01 0.00 0.00 64.21 62.81 2yrp n SER 38 CO 0.00 0.00 0.00 -0.75 -3.01 0.00 0.00 175.04 171.28 2yrp s LYS 39 N -0.70 2.07 -0.31 1.43 2.20 -1.15 -4.95 119.74 118.33 2yrp s LYS 39 Ca 0.44 -0.96 0.03 0.00 -0.36 0.00 0.00 55.97 55.11 2yrp s LYS 39 Cb -0.57 -2.10 0.08 0.00 -1.51 0.00 0.00 37.83 33.73 2yrp s LYS 39 CO 0.41 0.55 -0.00 0.08 -0.36 0.00 0.00 175.35 176.03 2yrp s VAL 40 N -0.75 2.33 0.07 4.02 1.01 -1.26 -1.50 120.40 124.32 2yrp s VAL 40 Ca 0.12 -2.03 0.04 0.00 0.00 0.00 0.00 61.98 60.11 2yrp s VAL 40 Cb -0.10 -2.58 -0.04 0.00 0.00 0.00 0.00 36.38 33.66 2yrp s VAL 40 CO 0.01 -0.38 -0.01 0.68 0.00 0.00 0.00 175.10 175.41 2yrp s VAL 41 N 1.00 4.01 0.11 2.92 -7.23 -1.14 -3.64 120.40 116.44 2yrp s VAL 41 Ca 0.03 -0.91 0.05 0.00 -1.81 0.00 0.00 61.98 59.33 2yrp s VAL 41 Cb -0.20 -2.88 -0.04 0.00 0.56 0.00 0.00 36.38 33.83 2yrp s VAL 41 CO -0.06 0.18 0.05 -0.36 -0.31 0.00 0.00 175.10 174.59 2yrp s PHE 42 N -1.25 3.06 0.07 2.82 0.40 -1.24 -2.71 117.98 119.13 2yrp s PHE 42 Ca 0.24 -0.01 0.08 0.00 -0.60 0.00 0.00 56.93 56.64 2yrp s PHE 42 Cb -0.12 -1.54 -0.03 0.00 0.51 0.00 0.00 43.02 41.85 2yrp s PHE 42 CO 0.16 0.50 -0.21 0.96 0.70 0.00 0.00 175.22 177.33 2yrp s ILE 43 N -1.46 1.73 -0.13 0.64 -4.36 0.80 -4.56 121.20 113.86 2yrp s ILE 43 Ca 0.28 -1.38 -0.01 0.00 -0.26 0.00 0.00 60.65 59.28 2yrp s ILE 43 Cb -0.11 -1.54 0.03 0.00 1.25 0.00 0.00 42.46 42.10 2yrp s ILE 43 CO 0.20 0.10 -0.04 -0.70 0.24 0.00 0.00 174.94 174.74 2yrp s GLU 44 N -1.53 1.23 -0.02 0.37 2.12 -1.26 -2.77 118.70 116.84 2yrp s GLU 44 Ca 0.07 -0.29 -0.29 0.00 0.36 0.00 0.00 54.97 54.83 2yrp s GLU 44 Cb -0.09 -1.65 -0.03 0.00 0.26 0.00 0.00 34.13 32.61 2yrp s GLU 44 CO 0.03 -0.36 0.93 1.03 -0.54 0.00 0.00 175.26 176.35 2yrp s ARG 45 N 1.75 4.53 0.40 4.30 0.52 -1.26 -2.63 118.95 126.56 2yrp s ARG 45 Ca 0.03 1.33 0.08 0.00 -0.52 0.00 0.00 55.73 56.64 2yrp s ARG 45 Cb -0.14 -3.47 -0.01 0.00 0.52 0.00 0.00 34.95 31.85 2yrp s ARG 45 CO -0.07 -0.05 0.42 0.20 0.02 0.00 0.00 175.30 175.81 2yrp s GLY 46 N 0.98 2.01 0.00 -3.53 0.00 -1.25 -4.98 107.32 100.54 2yrp s GLY 46 Ca 0.49 -1.77 0.11 0.00 0.00 0.00 0.00 44.72 43.55 2yrp s GLY 46 CO 0.26 -1.61 1.10 -1.55 0.00 0.00 0.00 173.10 171.29 2yrp n PRO 47 N -1.60 0.49 0.01 2.90 -0.04 -1.26 -2.81 135.00 132.69 2yrp n PRO 47 Ca 0.04 0.00 -0.21 0.00 -0.04 0.00 0.00 63.50 63.28 2yrp n PRO 47 Cb 0.61 -1.36 -0.14 0.00 -0.04 0.00 0.00 33.50 32.57 2yrp n PRO 47 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 2yrp h ASP 48 N 0.00 0.39 0.00 3.54 3.32 -2.02 -3.49 116.42 118.17 2yrp h ASP 48 Ca 0.00 -0.86 0.00 0.00 0.02 0.00 0.00 57.03 56.19 2yrp h ASP 48 Cb 0.00 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 39.42 2yrp h ASP 48 CO 0.00 1.61 0.00 0.61 -1.72 0.00 0.00 179.24 179.74 2yrp n GLY 49 N 1.74 2.24 3.53 2.75 0.00 -1.12 -5.12 105.19 109.20 2yrp n GLY 49 Ca -0.24 -0.18 -0.32 0.00 0.00 0.00 0.00 46.02 45.28 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 2.46 0.08 1.61 -2.85 -1.26 -4.89 119.74 114.89 2yrp s LYS 50 Ca 0.00 -0.75 -0.16 0.00 -1.00 0.00 0.00 55.97 54.07 2yrp s LYS 50 Cb 0.00 -2.41 -0.06 0.00 -2.06 0.00 0.00 37.83 33.29 2yrp s LYS 50 CO 0.00 0.60 0.51 -0.48 0.10 0.00 0.00 175.35 176.08 2yrp s LEU 51 N -1.15 4.43 -0.27 2.77 0.05 -1.26 -3.88 118.68 119.37 2yrp s LEU 51 Ca 0.14 1.09 -0.00 0.00 0.05 0.00 0.00 54.13 55.41 2yrp s LEU 51 Cb -0.11 -2.96 0.15 0.00 -2.05 0.00 0.00 46.19 41.22 2yrp s LEU 51 CO 0.04 0.22 0.41 -1.10 -0.55 0.00 0.00 176.35 175.37 2yrp s GLN 52 N -1.47 0.39 -0.24 1.48 -0.21 -1.08 -4.90 119.66 113.64 2yrp s GLN 52 Ca 0.31 0.36 -0.04 0.00 0.02 0.00 0.00 55.36 56.01 2yrp s GLN 52 Cb -0.17 -0.34 0.13 0.00 1.00 0.00 0.00 33.01 33.63 2yrp s GLN 52 CO 0.18 -0.84 0.41 -0.46 -2.12 0.00 0.00 175.29 172.46 2yrp s TRP 53 N 2.56 -0.89 -0.55 0.91 -0.00 -1.26 -4.72 118.94 114.99 2yrp s TRP 53 Ca 0.12 1.15 -0.13 0.00 -0.00 0.00 0.00 56.10 57.24 2yrp s TRP 53 Cb -0.14 0.17 0.14 0.00 -0.00 0.00 0.00 33.47 33.63 2yrp s TRP 53 CO -0.23 -0.66 0.47 -2.00 -0.00 0.00 0.00 176.95 174.52 2yrp s GLU 54 N 2.60 2.84 -0.09 5.86 2.12 -1.26 -4.58 118.70 126.18 2yrp s GLU 54 Ca 0.09 -1.84 -0.03 0.00 0.36 0.00 0.00 54.97 53.55 2yrp s GLU 54 Cb -0.14 -4.15 0.05 0.00 0.26 0.00 0.00 34.13 30.15 2yrp s GLU 54 CO -0.15 -1.27 0.15 -1.21 -0.54 0.00 0.00 175.26 172.24 2yrp s GLU 55 N 1.30 0.03 -0.12 4.30 0.41 -1.26 -5.08 118.70 118.28 2yrp s GLU 55 Ca 0.06 0.48 -0.08 0.00 -0.41 0.00 0.00 54.97 55.02 2yrp s GLU 55 Cb -0.26 -0.45 -0.04 0.00 -1.78 0.00 0.00 34.13 31.59 2yrp s GLU 55 CO 0.00 -0.35 0.16 -2.00 -0.49 0.00 0.00 175.26 172.58 2yrp s GLU 56 N 2.27 3.56 0.03 1.61 2.56 -1.26 -3.65 118.70 123.82 2yrp s GLU 56 Ca 0.04 -0.10 -0.05 0.00 0.00 0.00 0.00 54.97 54.86 2yrp s GLU 56 Cb -0.12 -3.22 -0.05 0.00 2.00 0.00 0.00 34.13 32.74 2yrp s GLU 56 CO -0.06 0.72 0.27 0.00 -0.56 0.00 0.00 175.26 175.63 2yrp s ALA 57 N -0.88 3.87 -0.83 6.30 0.00 -1.24 -4.89 121.76 124.09 2yrp s ALA 57 Ca 0.15 -0.62 -0.25 0.00 0.00 0.00 0.00 51.96 51.24 2yrp s ALA 57 Cb -0.12 -2.03 -0.05 0.00 0.00 0.00 0.00 23.12 20.92 2yrp s ALA 57 CO 0.04 0.68 1.96 0.99 0.00 0.00 0.00 175.76 179.43 2yrp s THR 58 N -1.38 3.40 0.36 0.00 2.01 -1.26 -4.87 115.64 113.90 2yrp s THR 58 Ca 0.30 -0.22 -0.25 0.00 0.31 0.00 0.00 61.69 61.83 2yrp s THR 58 Cb -0.13 -3.92 -0.09 0.00 0.01 0.00 0.00 72.50 68.36 2yrp s THR 58 CO 0.19 -0.88 1.04 -0.69 -0.69 0.00 0.00 174.62 173.59 2yrp s VAL 59 N 10.15 3.78 -0.56 3.82 1.01 -1.26 -3.00 120.40 134.33 2yrp s VAL 59 Ca 0.71 1.46 0.04 0.00 0.00 0.00 0.00 61.98 64.19 2yrp s VAL 59 Cb -0.08 -3.80 0.15 0.00 0.00 0.00 0.00 36.38 32.64 2yrp s VAL 59 CO 0.05 0.11 0.36 0.21 0.00 0.00 0.00 175.10 175.82 2yrp s ASN 60 N -1.44 3.99 0.38 3.32 2.47 -0.87 -4.95 114.94 117.83 2yrp s ASN 60 Ca 0.54 -3.27 0.13 0.00 0.42 0.00 0.00 52.86 50.68 2yrp s ASN 60 Cb -0.23 -1.34 0.95 0.00 -1.45 0.00 0.00 41.25 39.18 2yrp s ASN 60 CO 0.29 -0.17 1.83 0.08 -3.72 0.00 0.00 177.10 175.42 2yrp h ARG 61 N 5.99 0.53 -0.95 0.43 -0.00 -1.84 -0.76 114.38 117.79 2yrp h ARG 61 Ca 0.07 -0.03 0.29 0.00 -0.00 0.00 0.00 59.98 60.31 2yrp h ARG 61 Cb 0.85 -0.12 -0.15 0.00 -0.00 0.00 0.00 29.97 30.55 2yrp h ARG 61 CO 0.61 0.35 0.39 -0.07 -0.00 0.00 0.00 179.97 181.25 2yrp h LEU 62 N 0.55 0.22 0.20 0.08 4.07 -1.95 0.47 115.31 118.95 2yrp h LEU 62 Ca 0.50 0.20 -0.30 0.00 0.08 0.00 0.00 57.88 58.36 2yrp h LEU 62 Cb 1.04 0.22 0.03 0.00 1.08 0.00 0.00 40.66 43.03 2yrp h LEU 62 CO -0.24 -0.18 -1.39 1.56 -1.08 0.00 0.00 178.44 177.12 2yrp h GLN 63 N 0.24 0.43 -6.96 1.13 1.08 -1.50 -3.46 115.11 106.08 2yrp h GLN 63 Ca 0.65 -0.74 -0.51 0.00 -1.45 0.00 0.00 58.65 56.60 2yrp h GLN 63 Cb 1.43 0.28 0.06 0.00 -0.05 0.00 0.00 27.48 29.19 2yrp h GLN 63 CO -0.66 1.35 0.51 0.45 -0.95 0.00 0.00 178.83 179.53 2yrp s SER 64 N -7.34 6.42 0.00 1.46 0.15 0.16 -4.83 113.70 109.71 2yrp s SER 64 Ca -0.13 2.36 0.00 0.00 0.70 0.00 0.00 55.95 58.88 2yrp s SER 64 Cb 0.04 -2.61 0.00 0.00 -1.71 0.00 0.00 66.02 61.73 2yrp s SER 64 CO 0.89 -0.75 0.00 -0.46 1.20 0.00 0.00 173.24 174.12 2yrp n ASN 65 N -0.06 0.00 0.09 5.45 6.94 -1.09 -4.83 115.26 121.76 2yrp n ASN 65 Ca 0.05 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.61 2yrp n ASN 65 Cb 0.47 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.89 2yrp n ASN 65 CO 0.00 0.00 0.00 1.21 -1.03 0.00 0.00 177.26 177.44 2yrp n GLU 66 N -1.67 0.00 -1.43 -3.83 4.07 -1.26 -4.69 120.64 111.83 2yrp n GLU 66 Ca 0.00 0.00 -0.19 0.00 -0.06 0.00 0.00 57.16 56.91 2yrp n GLU 66 Cb 0.00 -0.13 0.10 0.00 -0.06 0.00 0.00 31.44 31.35 2yrp n GLU 66 CO 0.00 0.00 0.00 1.33 -0.06 0.00 0.00 177.13 178.40 2yrp n VAL 67 N -3.24 2.75 -3.68 6.31 0.24 -1.26 -1.99 118.33 117.46 2yrp n VAL 67 Ca 0.00 -3.44 -0.11 0.00 -2.04 0.00 0.00 64.34 58.75 2yrp n VAL 67 Cb 0.04 -0.84 -0.09 0.00 -1.47 0.00 0.00 33.84 31.48 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 -4.15 -0.01 -0.05 3.34 2.01 -1.26 -3.81 115.64 111.70 2yrp s THR 68 Ca 0.51 0.04 0.01 0.00 0.31 0.00 0.00 61.69 62.57 2yrp s THR 68 Cb 0.43 -0.74 0.02 0.00 0.01 0.00 0.00 72.50 72.22 2yrp s THR 68 CO 0.01 0.02 -0.06 -0.76 -0.69 0.00 0.00 174.62 173.13 2yrp s LEU 69 N 1.09 1.38 -0.19 4.42 1.43 -1.01 -2.67 118.68 123.14 2yrp s LEU 69 Ca -0.07 -0.18 0.01 0.00 -1.03 0.00 0.00 54.13 52.87 2yrp s LEU 69 Cb -0.06 -0.57 0.03 0.00 0.03 0.00 0.00 46.19 45.62 2yrp s LEU 69 CO -0.10 -0.04 -0.17 -0.89 0.23 0.00 0.00 176.35 175.38 2yrp s THR 70 N 0.92 2.01 0.20 5.49 2.01 -1.26 -2.09 115.64 122.91 2yrp s THR 70 Ca -0.11 -1.02 -0.03 0.00 0.31 0.00 0.00 61.69 60.83 2yrp s THR 70 Cb -0.15 -1.88 -0.03 0.00 0.01 0.00 0.00 72.50 70.45 2yrp s THR 70 CO 0.01 0.42 0.19 -1.48 -0.69 0.00 0.00 174.62 173.07 2yrp s LEU 71 N 1.29 1.03 -0.36 4.42 2.34 -1.22 -2.06 118.68 124.12 2yrp s LEU 71 Ca 0.02 -1.28 -0.08 0.00 0.06 0.00 0.00 54.13 52.85 2yrp s LEU 71 Cb -0.14 0.65 0.04 0.00 -0.56 0.00 0.00 46.19 46.18 2yrp s LEU 71 CO -0.11 -0.89 0.16 -0.89 -1.06 0.00 0.00 176.35 173.56 2yrp s THR 72 N -4.12 4.13 -0.21 5.48 2.01 -1.16 -3.14 115.64 118.63 2yrp s THR 72 Ca 0.34 -1.05 -0.42 0.00 0.31 0.00 0.00 61.69 60.87 2yrp s THR 72 Cb 0.06 -3.34 -0.19 0.00 0.01 0.00 0.00 72.50 69.03 2yrp s THR 72 CO 0.10 -0.23 1.37 0.52 -0.69 0.00 0.00 174.62 175.69 2yrp n VAL 73 N 4.89 0.03 -1.15 3.82 0.31 -1.24 -4.09 118.33 120.91 2yrp n VAL 73 Ca -0.12 -0.01 -0.29 0.00 -0.01 0.00 0.00 64.34 63.92 2yrp n VAL 73 Cb 0.45 -0.40 0.19 0.00 -0.91 0.00 0.00 33.84 33.17 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 1.55 0.17 0.26 5.55 0.04 -1.26 -3.08 135.00 138.23 2yrp s PRO 74 Ca 0.96 0.44 -0.06 0.00 0.04 0.00 0.00 61.00 62.38 2yrp s PRO 74 Cb -1.31 -1.71 -0.06 0.00 0.04 0.00 0.00 34.50 31.46 2yrp s PRO 74 CO 0.66 -2.89 0.54 -1.21 0.04 0.00 0.00 177.00 174.15 2yrp s GLU 75 N -5.00 3.68 0.18 4.56 8.01 -1.26 -4.39 118.70 124.49 2yrp s GLU 75 Ca 0.66 0.09 -0.28 0.00 0.01 0.00 0.00 54.97 55.45 2yrp s GLU 75 Cb -0.18 -2.66 -0.08 0.00 -4.31 0.00 0.00 34.13 26.90 2yrp s GLU 75 CO 0.58 0.26 0.88 -0.47 0.01 0.00 0.00 175.26 176.51 2yrp s TYR 76 N -1.98 3.92 0.08 1.61 5.04 -1.03 -4.99 117.35 120.00 2yrp s TYR 76 Ca 0.45 1.78 -0.21 0.00 -2.44 0.00 0.00 57.07 56.65 2yrp s TYR 76 Cb -0.11 -2.91 -0.08 0.00 0.35 0.00 0.00 41.96 39.21 2yrp s TYR 76 CO 0.27 0.42 1.34 0.66 -1.34 0.00 0.00 175.55 176.91 2yrp h SER 77 N 4.54 -1.11 -2.82 4.32 4.64 -1.97 -3.23 113.55 117.92 2yrp h SER 77 Ca -0.45 0.14 -0.74 0.00 -0.47 0.00 0.00 61.79 60.26 2yrp h SER 77 Cb 1.20 0.44 -0.21 0.00 -0.31 0.00 0.00 62.40 63.52 2yrp h SER 77 CO 0.68 -0.29 0.76 0.21 -0.87 0.00 0.00 176.83 177.33 2yrp s ASN 78 N -4.05 6.89 -0.09 4.97 2.47 -1.26 -4.84 114.94 119.03 2yrp s ASN 78 Ca -0.09 -2.68 0.02 0.00 0.42 0.00 0.00 52.86 50.52 2yrp s ASN 78 Cb 0.05 -2.33 0.17 0.00 -1.45 0.00 0.00 41.25 37.68 2yrp s ASN 78 CO 0.38 -0.75 1.08 0.29 -3.72 0.00 0.00 177.10 174.38 2yrp n LYS 79 N 5.17 1.48 -1.71 0.43 4.76 -1.22 -3.97 118.16 123.10 2yrp n LYS 79 Ca 0.25 -0.71 -0.22 0.00 -2.87 0.00 0.00 58.31 54.77 2yrp n LYS 79 Cb 0.45 -1.40 0.06 0.00 -1.84 0.00 0.00 35.03 32.30 2yrp n LYS 79 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 2yrp n ARG 80 N 0.13 3.18 -5.20 1.97 1.74 -1.26 -5.01 116.66 112.21 2yrp n ARG 80 Ca 0.12 -3.90 -0.32 0.00 -0.77 0.00 0.00 57.85 52.98 2yrp n ARG 80 Cb 0.68 -2.19 -0.16 0.00 -1.02 0.00 0.00 32.46 29.77 2yrp n ARG 80 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 2yrp s VAL 81 N -4.42 2.22 -0.46 1.55 -7.23 -1.25 -5.01 120.40 105.81 2yrp s VAL 81 Ca 0.51 -1.01 0.07 0.00 -1.81 0.00 0.00 61.98 59.75 2yrp s VAL 81 Cb 0.42 -1.82 0.48 0.00 0.56 0.00 0.00 36.38 36.02 2yrp s VAL 81 CO 0.02 0.57 1.36 -1.20 -0.31 0.00 0.00 175.10 175.54 2yrp n SER 82 N 2.91 3.80 -3.96 4.85 7.64 -1.26 -4.88 113.62 122.72 2yrp n SER 82 Ca -0.17 -2.69 -0.08 0.00 1.01 0.00 0.00 58.87 56.93 2yrp n SER 82 Cb 0.52 -0.64 -0.09 0.00 -1.01 0.00 0.00 64.21 62.99 2yrp n SER 82 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 2yrp s ARG 83 N -2.07 0.66 0.66 1.43 0.52 -1.26 -4.94 118.95 113.94 2yrp s ARG 83 Ca 0.34 -0.95 -0.15 0.00 -0.52 0.00 0.00 55.73 54.45 2yrp s ARG 83 Cb 0.27 0.25 0.00 0.00 0.52 0.00 0.00 34.95 35.99 2yrp s ARG 83 CO 0.09 -0.17 1.11 -1.25 0.02 0.00 0.00 175.30 175.10 2yrp s PRO 84 N -3.33 2.80 -0.00 3.54 0.04 -1.26 -4.65 135.00 132.13 2yrp s PRO 84 Ca 0.01 1.39 0.04 0.00 0.04 0.00 0.00 61.00 62.48 2yrp s PRO 84 Cb 0.03 -1.95 -0.01 0.00 0.04 0.00 0.00 34.50 32.61 2yrp s PRO 84 CO -0.08 -1.25 -0.13 0.08 0.04 0.00 0.00 177.00 175.66 2yrp s VAL 85 N -2.34 1.03 -0.24 -0.36 1.01 -0.68 -4.95 120.40 113.87 2yrp s VAL 85 Ca 0.67 -0.63 -0.21 0.00 0.00 0.00 0.00 61.98 61.81 2yrp s VAL 85 Cb -0.20 -0.87 -0.02 0.00 0.00 0.00 0.00 36.38 35.28 2yrp s VAL 85 CO 0.42 0.24 0.65 -1.58 0.00 0.00 0.00 175.10 174.83 2yrp s GLN 86 N -0.45 4.13 0.40 2.72 2.00 -1.26 -0.62 119.66 126.59 2yrp s GLN 86 Ca 0.04 0.60 0.04 0.00 -2.00 0.00 0.00 55.36 54.05 2yrp s GLN 86 Cb -0.05 -3.64 -0.03 0.00 0.80 0.00 0.00 33.01 30.09 2yrp s GLN 86 CO -0.00 -0.40 0.14 0.14 -0.50 0.00 0.00 175.29 174.67 2yrp s VAL 87 N 2.46 0.57 0.03 1.34 -7.23 -0.05 -4.66 120.40 112.86 2yrp s VAL 87 Ca 0.28 -2.00 -0.12 0.00 -1.81 0.00 0.00 61.98 58.32 2yrp s VAL 87 Cb -0.16 -2.37 0.01 0.00 0.56 0.00 0.00 36.38 34.43 2yrp s VAL 87 CO 0.09 0.00 0.26 -0.31 -0.31 0.00 0.00 175.10 174.83 2yrp s TYR 88 N -3.23 -0.06 0.11 2.82 1.51 -1.12 -1.38 117.35 116.01 2yrp s TYR 88 Ca 0.25 -0.08 -0.04 0.00 -1.01 0.00 0.00 57.07 56.19 2yrp s TYR 88 Cb 0.03 0.05 -0.03 0.00 -0.11 0.00 0.00 41.96 41.90 2yrp s TYR 88 CO 0.15 -0.46 0.11 -0.59 -1.11 0.00 0.00 175.55 173.66 2yrp s PHE 89 N -2.37 0.53 0.17 2.71 -0.71 -1.24 -0.14 117.98 116.94 2yrp s PHE 89 Ca -0.06 -0.96 -0.23 0.00 -1.04 0.00 0.00 56.93 54.63 2yrp s PHE 89 Cb -0.02 -0.28 0.06 0.00 -1.21 0.00 0.00 43.02 41.57 2yrp s PHE 89 CO -0.02 -0.54 0.71 1.52 -1.34 0.00 0.00 175.22 175.55 2yrp s TYR 90 N -3.96 -0.36 -0.01 3.49 1.13 -1.10 -1.63 117.35 114.91 2yrp s TYR 90 Ca 0.15 0.08 -0.01 0.00 -1.41 0.00 0.00 57.07 55.87 2yrp s TYR 90 Cb 0.06 0.61 -0.04 0.00 -1.10 0.00 0.00 41.96 41.49 2yrp s TYR 90 CO -0.04 -0.93 0.12 0.08 -2.51 0.00 0.00 175.55 172.28 2yrp s VAL 91 N -3.67 5.02 -0.14 -3.49 1.01 -1.26 -2.87 120.40 115.00 2yrp s VAL 91 Ca 0.06 -0.31 0.01 0.00 0.00 0.00 0.00 61.98 61.74 2yrp s VAL 91 Cb -0.03 -3.32 0.02 0.00 0.00 0.00 0.00 36.38 33.06 2yrp s VAL 91 CO -0.05 0.34 -0.15 -0.55 0.00 0.00 0.00 175.10 174.69 2yrp s SER 92 N -1.82 2.66 -0.31 3.32 0.15 -0.56 -1.11 113.70 116.02 2yrp s SER 92 Ca 0.25 -0.48 0.01 0.00 0.70 0.00 0.00 55.95 56.42 2yrp s SER 92 Cb -0.12 -1.18 0.09 0.00 -1.71 0.00 0.00 66.02 63.10 2yrp s SER 92 CO 0.16 -0.03 0.06 0.20 1.20 0.00 0.00 173.24 174.84 2yrp s ASN 93 N 1.31 4.20 0.00 5.45 0.01 -0.37 -2.91 114.94 122.63 2yrp s ASN 93 Ca 0.01 -1.72 0.00 0.00 -0.71 0.00 0.00 52.86 50.44 2yrp s ASN 93 Cb -0.14 -1.12 0.00 0.00 0.41 0.00 0.00 41.25 40.40 2yrp s ASN 93 CO -0.08 -0.38 0.00 0.61 -1.51 0.00 0.00 177.10 175.74 2yrp n GLY 94 N 4.65 0.80 0.55 0.66 0.00 -1.26 -3.87 105.19 106.72 2yrp n GLY 94 Ca -0.02 -1.33 -0.01 0.00 0.00 0.00 0.00 46.02 44.67 2yrp n GLY 94 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2yrp n ARG 95 N 0.00 0.02 -0.01 1.61 1.85 -1.26 -4.90 116.66 113.97 2yrp n ARG 95 Ca 0.00 0.01 -0.01 0.00 -1.00 0.00 0.00 57.85 56.84 2yrp n ARG 95 Cb 0.00 -0.75 -0.02 0.00 -1.05 0.00 0.00 32.46 30.65 2yrp n ARG 95 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 2yrp n ARG 96 N -2.82 2.69 -1.96 2.89 1.74 -1.26 -4.98 116.66 112.97 2yrp n ARG 96 Ca -0.02 0.00 -0.43 0.00 -0.77 0.00 0.00 57.85 56.64 2yrp n ARG 96 Cb 0.51 -1.06 -0.03 0.00 -1.02 0.00 0.00 32.46 30.86 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 -2.06 3.43 0.35 5.56 1.02 -1.25 -4.93 119.74 121.87 2yrp s LYS 97 Ca -0.02 1.60 -0.11 0.00 0.02 0.00 0.00 55.97 57.46 2yrp s LYS 97 Cb 0.01 -4.19 0.03 0.00 -0.52 0.00 0.00 37.83 33.16 2yrp s LYS 97 CO 0.10 -1.74 0.64 -0.98 -0.92 0.00 0.00 175.35 172.45 2yrp s ARG 98 N 5.50 2.04 0.19 1.68 1.04 -1.26 -1.23 118.95 126.91 2yrp s ARG 98 Ca 0.81 -1.52 0.05 0.00 -1.04 0.00 0.00 55.73 54.04 2yrp s ARG 98 Cb -0.25 0.54 -0.04 0.00 -2.04 0.00 0.00 34.95 33.17 2yrp s ARG 98 CO 0.33 -0.91 0.17 -1.54 -0.04 0.00 0.00 175.30 173.32 2yrp s SER 99 N -3.12 5.61 0.91 -2.89 1.04 -0.27 -4.80 113.70 110.18 2yrp s SER 99 Ca 0.21 -0.14 -0.12 0.00 0.48 0.00 0.00 55.95 56.39 2yrp s SER 99 Cb -0.03 -1.48 0.14 0.00 0.10 0.00 0.00 66.02 64.75 2yrp s SER 99 CO 0.14 0.03 1.09 -2.16 0.98 0.00 0.00 173.24 173.33 2yrp s PRO 100 N -3.36 1.13 0.44 4.02 0.04 -1.26 -4.19 135.00 131.82 2yrp s PRO 100 Ca 0.32 0.77 -0.21 0.00 0.04 0.00 0.00 61.00 61.92 2yrp s PRO 100 Cb -0.09 -1.80 -0.10 0.00 0.04 0.00 0.00 34.50 32.54 2yrp s PRO 100 CO 0.24 -2.31 0.97 0.95 0.04 0.00 0.00 177.00 176.89 2yrp s THR 101 N -2.94 4.21 -0.13 1.26 -4.23 -1.26 -4.59 115.64 107.96 2yrp s THR 101 Ca 0.64 1.41 0.01 0.00 -1.18 0.00 0.00 61.69 62.57 2yrp s THR 101 Cb -0.18 -3.59 -0.00 0.00 1.34 0.00 0.00 72.50 70.06 2yrp s THR 101 CO 0.57 -0.26 -0.17 -1.10 -0.54 0.00 0.00 174.62 173.12 2yrp s GLN 102 N -3.10 3.22 -0.07 3.99 -1.52 -0.65 -4.93 119.66 116.59 2yrp s GLN 102 Ca 0.62 -0.77 -0.34 0.00 -1.95 0.00 0.00 55.36 52.93 2yrp s GLN 102 Cb -0.12 -2.54 -0.12 0.00 -0.22 0.00 0.00 33.01 30.02 2yrp s GLN 102 CO 0.16 0.12 1.86 -1.13 -0.25 0.00 0.00 175.29 176.05 2yrp n SER 103 N 3.76 3.44 -4.15 5.90 3.41 -1.26 -3.70 113.62 121.01 2yrp n SER 103 Ca -0.19 0.98 -0.10 0.00 -0.26 0.00 0.00 58.87 59.30 2yrp n SER 103 Cb 0.52 -1.38 -0.10 0.00 -0.26 0.00 0.00 64.21 63.00 2yrp n SER 103 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 2yrp s PHE 104 N 3.89 0.82 -0.20 7.33 5.36 -0.48 -5.02 117.98 129.68 2yrp s PHE 104 Ca 0.92 -1.08 -0.17 0.00 -0.96 0.00 0.00 56.93 55.64 2yrp s PHE 104 Cb -0.69 -0.50 0.05 0.00 -0.34 0.00 0.00 43.02 41.55 2yrp s PHE 104 CO 0.51 -0.35 0.52 0.50 -1.46 0.00 0.00 175.22 174.94 2yrp s ARG 105 N -3.94 0.60 -0.15 10.12 3.52 -1.26 -0.87 118.95 126.97 2yrp s ARG 105 Ca 0.16 0.76 -0.08 0.00 -0.13 0.00 0.00 55.73 56.44 2yrp s ARG 105 Cb 0.07 0.26 -0.04 0.00 -1.56 0.00 0.00 34.95 33.68 2yrp s ARG 105 CO -0.03 -0.08 0.14 -0.06 -0.81 0.00 0.00 175.30 174.45 2yrp s PHE 106 N 0.44 3.54 -0.07 5.12 0.08 0.21 -3.25 117.98 124.04 2yrp s PHE 106 Ca -0.01 0.46 -0.00 0.00 0.12 0.00 0.00 56.93 57.50 2yrp s PHE 106 Cb -0.04 -2.01 -0.03 0.00 -0.57 0.00 0.00 43.02 40.37 2yrp s PHE 106 CO -0.01 0.59 -0.04 -0.51 -0.10 0.00 0.00 175.22 175.15 2yrp s LEU 107 N -0.57 3.35 0.18 -0.37 1.43 0.12 -1.68 118.68 121.14 2yrp s LEU 107 Ca 0.13 0.04 -0.30 0.00 -1.03 0.00 0.00 54.13 52.96 2yrp s LEU 107 Cb -0.12 -1.76 -0.09 0.00 0.03 0.00 0.00 46.19 44.25 2yrp s LEU 107 CO 0.02 0.36 1.31 -2.16 0.23 0.00 0.00 176.35 176.12 2yrp s PRO 108 N -0.91 4.38 -0.09 1.29 0.04 -1.26 -2.60 135.00 135.85 2yrp s PRO 108 Ca 0.13 2.05 0.15 0.00 0.04 0.00 0.00 61.00 63.37 2yrp s PRO 108 Cb -0.11 -3.21 -0.21 0.00 0.04 0.00 0.00 34.50 31.01 2yrp s PRO 108 CO 0.03 -0.27 0.19 1.33 0.04 0.00 0.00 177.00 178.31 2yrp n VAL 109 N 2.83 0.53 -0.32 -0.36 0.24 -1.26 -4.54 118.33 115.46 2yrp n VAL 109 Ca 0.07 -0.50 0.25 0.00 -2.04 0.00 0.00 64.34 62.11 2yrp n VAL 109 Cb 0.43 -0.25 0.47 0.00 -1.47 0.00 0.00 33.84 33.01 2yrp n VAL 109 CO 0.00 0.00 0.00 -0.38 -2.14 0.00 0.00 176.83 174.31 2yrp n ILE 110 N -2.31 -0.41 -1.56 1.34 5.41 -1.26 -4.37 119.36 116.20 2yrp n ILE 110 Ca -0.14 2.03 -0.53 0.00 1.00 0.00 0.00 62.75 65.11 2yrp n ILE 110 Cb 0.71 -3.17 -0.07 0.00 -0.71 0.00 0.00 39.64 36.40 2yrp n ILE 110 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2yrp s LYS 112 N 4.97 4.15 0.32 0.00 1.02 -1.26 -4.99 119.74 123.94 2yrp s LYS 112 Ca 1.04 1.43 -0.04 0.00 0.02 0.00 0.00 55.97 58.42 2yrp s LYS 112 Cb -0.95 -3.76 -0.00 0.00 -0.52 0.00 0.00 37.83 32.60 2yrp s LYS 112 CO 0.57 -0.80 0.45 -1.21 -0.92 0.00 0.00 175.35 173.43 2yrp s GLU 113 N 3.59 1.80 0.00 1.68 0.41 -1.26 -5.26 118.70 119.66 2yrp s GLU 113 Ca 0.51 -1.68 0.30 0.00 -0.41 0.00 0.00 54.97 53.69 2yrp s GLU 113 Cb -0.18 0.43 1.47 0.00 -1.78 0.00 0.00 34.13 34.08 2yrp s GLU 113 CO 0.14 -0.74 1.98 -0.85 -0.49 0.00 0.00 175.26 175.31