#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x4b s SER 2 N 0.00 -0.24 0.17 1.61 0.01 -1.26 -5.19 113.70 108.81 1x4b s SER 2 Ca 0.00 -0.64 -0.24 0.00 1.31 0.00 0.00 55.95 56.37 1x4b s SER 2 Cb 0.00 0.73 0.06 0.00 0.21 0.00 0.00 66.02 67.02 1x4b s SER 2 CO 0.00 -1.36 0.95 -0.94 0.41 0.00 0.00 173.24 172.30 1x4b s SER 3 N -2.93 -0.17 0.00 2.44 1.04 -1.26 -5.18 113.70 107.64 1x4b s SER 3 Ca 0.11 -0.45 0.00 0.00 0.48 0.00 0.00 55.95 56.10 1x4b s SER 3 Cb -0.06 0.51 0.00 0.00 0.10 0.00 0.00 66.02 66.57 1x4b s SER 3 CO 0.07 -0.95 0.00 0.61 0.98 0.00 0.00 173.24 173.95 1x4b n GLY 4 N -0.48 3.47 3.57 7.32 0.00 -1.26 -5.19 105.19 112.62 1x4b n GLY 4 Ca -0.06 -0.34 -0.07 0.00 0.00 0.00 0.00 46.02 45.55 1x4b n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1x4b s SER 5 N 0.00 -0.26 0.00 1.61 0.15 -1.26 -5.19 113.70 108.75 1x4b s SER 5 Ca 0.00 0.14 0.00 0.00 0.70 0.00 0.00 55.95 56.79 1x4b s SER 5 Cb 0.00 0.25 0.00 0.00 -1.71 0.00 0.00 66.02 64.56 1x4b s SER 5 CO 0.00 -0.35 0.00 -1.20 1.20 0.00 0.00 173.24 172.89 1x4b n SER 6 N 0.20 0.00 0.00 5.45 7.64 -1.26 -5.17 113.62 120.48 1x4b n SER 6 Ca -0.06 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.82 1x4b n SER 6 Cb 0.59 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.79 1x4b n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x4b n GLY 7 N -0.10 3.48 2.79 0.23 0.00 -1.26 -5.14 105.19 105.20 1x4b n GLY 7 Ca 0.00 -0.86 0.01 0.00 0.00 0.00 0.00 46.02 45.17 1x4b n GLY 7 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1x4b s MET 8 N -4.34 0.22 0.21 1.61 1.75 -1.26 -5.17 119.30 112.32 1x4b s MET 8 Ca 0.00 -0.08 -0.02 0.00 -1.25 0.00 0.00 55.69 54.34 1x4b s MET 8 Cb 0.00 0.02 -0.04 0.00 2.84 0.00 0.00 34.83 37.66 1x4b s MET 8 CO 0.00 -0.32 0.16 -1.21 -0.65 0.00 0.00 175.02 173.00 1x4b s GLU 9 N 1.91 1.24 0.49 4.11 0.41 -1.26 -5.18 118.70 120.42 1x4b s GLU 9 Ca 0.15 -1.62 0.02 0.00 -0.41 0.00 0.00 54.97 53.11 1x4b s GLU 9 Cb 0.03 0.28 -0.02 0.00 -1.78 0.00 0.00 34.13 32.65 1x4b s GLU 9 CO -0.14 -0.41 0.02 -1.59 -0.49 0.00 0.00 175.26 172.65 1x4b s LYS 10 N -4.13 2.15 0.02 1.61 0.00 -1.26 -5.17 119.74 112.96 1x4b s LYS 10 Ca 0.38 -2.36 -0.11 0.00 0.00 0.00 0.00 55.97 53.87 1x4b s LYS 10 Cb 0.06 -1.37 0.01 0.00 0.00 0.00 0.00 37.83 36.54 1x4b s LYS 10 CO 0.12 -0.38 0.24 -0.08 0.00 0.00 0.00 175.35 175.25 1x4b s THR 11 N -2.93 0.08 0.51 3.79 -1.32 -1.26 -5.17 115.64 109.34 1x4b s THR 11 Ca 0.09 -0.69 0.06 0.00 -1.21 0.00 0.00 61.69 59.95 1x4b s THR 11 Cb 0.02 -0.72 0.02 0.00 -1.51 0.00 0.00 72.50 70.31 1x4b s THR 11 CO 0.05 -0.38 0.40 -1.48 -2.21 0.00 0.00 174.62 171.01 1x4b s LEU 12 N -1.69 2.89 0.02 9.08 2.34 -1.26 -5.13 118.68 124.92 1x4b s LEU 12 Ca -0.10 -1.12 0.03 0.00 0.06 0.00 0.00 54.13 53.01 1x4b s LEU 12 Cb -0.04 -1.40 -0.04 0.00 -0.56 0.00 0.00 46.19 44.16 1x4b s LEU 12 CO -0.00 -0.99 -0.03 -0.70 -1.06 0.00 0.00 176.35 173.56 1x4b s GLU 13 N -4.25 2.60 -0.16 1.48 2.12 -1.26 -5.11 118.70 114.12 1x4b s GLU 13 Ca 0.39 -0.72 -0.33 0.00 0.36 0.00 0.00 54.97 54.66 1x4b s GLU 13 Cb -0.02 -2.55 0.14 0.00 0.26 0.00 0.00 34.13 31.95 1x4b s GLU 13 CO 0.24 0.59 1.15 -0.08 -0.54 0.00 0.00 175.26 176.62 1x4b s THR 14 N -1.10 0.00 0.34 -1.70 -1.32 -1.26 -5.16 115.64 105.44 1x4b s THR 14 Ca 0.20 0.00 -0.19 0.00 -1.21 0.00 0.00 61.69 60.49 1x4b s THR 14 Cb -0.11 -1.00 -0.10 0.00 -1.51 0.00 0.00 72.50 69.78 1x4b s THR 14 CO 0.11 0.00 0.83 0.68 -2.21 0.00 0.00 174.62 174.03 1x4b s VAL 15 N -2.33 4.51 -1.10 5.08 -7.23 -1.26 -4.94 120.40 113.13 1x4b s VAL 15 Ca 0.08 1.29 -0.18 0.00 -1.81 0.00 0.00 61.98 61.36 1x4b s VAL 15 Cb -0.01 -3.70 -0.07 0.00 0.56 0.00 0.00 36.38 33.16 1x4b s VAL 15 CO -0.05 -0.12 2.08 -0.81 -0.31 0.00 0.00 175.10 175.89 1x4b n PRO 16 N -0.15 2.16 -3.15 4.82 -0.04 -1.26 -4.62 135.00 132.76 1x4b n PRO 16 Ca 0.03 -2.18 0.05 0.00 -0.04 0.00 0.00 63.50 61.37 1x4b n PRO 16 Cb 0.53 -3.07 -0.02 0.00 -0.04 0.00 0.00 33.50 30.90 1x4b n PRO 16 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1x4b s LEU 17 N 1.59 -0.36 -0.30 1.53 1.98 -1.26 -5.15 118.68 116.72 1x4b s LEU 17 Ca 0.53 0.20 -0.18 0.00 -2.89 0.00 0.00 54.13 51.79 1x4b s LEU 17 Cb 0.14 1.29 0.20 0.00 0.66 0.00 0.00 46.19 48.49 1x4b s LEU 17 CO 0.02 -0.07 1.27 -0.70 -1.89 0.00 0.00 176.35 174.98 1x4b s GLU 18 N 2.96 0.05 0.26 1.98 -6.30 -1.26 -5.18 118.70 111.21 1x4b s GLU 18 Ca -0.01 0.10 0.11 0.00 -2.50 0.00 0.00 54.97 52.68 1x4b s GLU 18 Cb -0.09 0.04 -0.05 0.00 0.00 0.00 0.00 34.13 34.03 1x4b s GLU 18 CO -0.11 -0.01 -0.17 -0.98 0.02 0.00 0.00 175.26 174.00 1x4b s ARG 19 N 1.60 1.77 0.09 4.30 1.70 -1.26 -4.90 118.95 122.25 1x4b s ARG 19 Ca -0.03 -1.64 0.00 0.00 -0.47 0.00 0.00 55.73 53.58 1x4b s ARG 19 Cb -0.02 -1.87 0.00 0.00 -0.57 0.00 0.00 34.95 32.50 1x4b s ARG 19 CO -0.13 0.35 0.00 1.17 -1.08 0.00 0.00 175.30 175.61 1x4b n LYS 20 N -0.47 0.00 -0.01 3.89 4.81 -1.26 -4.95 118.16 120.17 1x4b n LYS 20 Ca -0.07 0.00 -0.19 0.00 -0.87 0.00 0.00 58.31 57.18 1x4b n LYS 20 Cb 0.59 -0.00 -0.14 0.00 0.02 0.00 0.00 35.03 35.50 1x4b n LYS 20 CO 0.00 0.00 0.00 0.36 1.17 0.00 0.00 177.40 178.93 1x4b n LYS 21 N -2.80 0.73 0.00 1.64 2.85 -1.26 -5.02 118.16 114.30 1x4b n LYS 21 Ca 0.00 0.25 0.00 0.00 -1.05 0.00 0.00 58.31 57.51 1x4b n LYS 21 Cb 0.00 -1.70 0.00 0.00 -0.65 0.00 0.00 35.03 32.68 1x4b n LYS 21 CO 0.00 0.00 0.00 -2.13 -0.05 0.00 0.00 177.40 175.22 1x4b n ARG 22 N -3.40 0.00 0.00 -1.58 0.63 -1.26 -5.01 116.66 106.04 1x4b n ARG 22 Ca -0.32 0.00 0.13 0.00 -0.92 0.00 0.00 57.85 56.74 1x4b n ARG 22 Cb 1.04 0.00 0.45 0.00 0.45 0.00 0.00 32.46 34.40 1x4b n ARG 22 CO 0.00 0.00 0.00 -0.85 -2.51 0.00 0.00 177.63 174.27 1x4b n GLU 23 N -0.29 0.20 0.10 -0.14 0.28 -1.26 -3.25 120.64 116.28 1x4b n GLU 23 Ca 0.00 -0.08 0.11 0.00 -0.16 0.00 0.00 57.16 57.03 1x4b n GLU 23 Cb 0.00 -1.50 -0.01 0.00 1.43 0.00 0.00 31.44 31.37 1x4b n GLU 23 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 177.13 178.14 1x4b n LYS 24 N -1.33 0.61 -0.05 3.44 0.00 -1.26 -3.57 118.16 116.00 1x4b n LYS 24 Ca 0.08 0.11 -0.00 0.00 0.00 0.00 0.00 58.31 58.50 1x4b n LYS 24 Cb 0.32 -1.82 -0.00 0.00 0.00 0.00 0.00 35.03 33.53 1x4b n LYS 24 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.40 178.89 1x4b h GLU 25 N 0.00 0.00 -1.06 1.64 4.81 -1.93 -3.24 114.58 114.80 1x4b h GLU 25 Ca 0.00 0.00 0.28 0.00 -0.13 0.00 0.00 59.36 59.51 1x4b h GLU 25 Cb 1.00 0.00 -0.08 0.00 0.63 0.00 0.00 28.75 30.30 1x4b h GLU 25 CO 0.00 0.00 0.71 -0.56 -0.73 0.00 0.00 179.01 178.43 1x4b h GLN 26 N -0.90 0.25 -0.36 1.92 3.07 -1.74 0.27 115.11 117.61 1x4b h GLN 26 Ca 0.00 -0.02 0.02 0.00 0.09 0.00 0.00 58.65 58.74 1x4b h GLN 26 Cb 0.03 -0.06 -0.02 0.00 0.08 0.00 0.00 27.48 27.51 1x4b h GLN 26 CO 0.00 0.17 0.21 0.74 0.09 0.00 0.00 178.83 180.04 1x4b h PHE 27 N 0.26 0.39 -1.28 0.06 -1.00 -1.67 -2.73 116.94 110.97 1x4b h PHE 27 Ca 0.57 0.01 -0.66 0.00 2.81 0.00 0.00 57.97 60.70 1x4b h PHE 27 Cb 1.71 -0.13 -0.33 0.00 3.61 0.00 0.00 35.95 40.81 1x4b h PHE 27 CO -0.00 0.23 0.32 0.54 -1.61 0.00 0.00 178.31 177.79 1x4b n ARG 28 N -4.89 3.02 -3.66 1.51 3.00 0.84 -4.90 116.66 111.58 1x4b n ARG 28 Ca 0.00 -3.72 -0.20 0.00 -0.01 0.00 0.00 57.85 53.92 1x4b n ARG 28 Cb 0.06 -2.28 -0.17 0.00 0.00 0.00 0.00 32.46 30.07 1x4b n ARG 28 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.63 177.84 1x4b s LYS 29 N -3.80 -0.04 0.09 5.56 2.20 -0.52 -2.97 119.74 120.26 1x4b s LYS 29 Ca 0.56 0.39 0.08 0.00 -0.36 0.00 0.00 55.97 56.65 1x4b s LYS 29 Cb 0.45 -0.55 -0.04 0.00 -1.51 0.00 0.00 37.83 36.19 1x4b s LYS 29 CO -0.13 -0.35 -0.19 -0.51 -0.36 0.00 0.00 175.35 173.81 1x4b s LEU 30 N 2.20 2.65 -0.49 5.43 2.01 -1.02 -2.46 118.68 126.99 1x4b s LEU 30 Ca 0.04 -0.53 -0.18 0.00 0.01 0.00 0.00 54.13 53.48 1x4b s LEU 30 Cb -0.12 -1.52 0.07 0.00 0.01 0.00 0.00 46.19 44.62 1x4b s LEU 30 CO -0.04 0.20 0.53 0.12 1.01 0.00 0.00 176.35 178.17 1x4b s PHE 31 N -1.07 3.13 0.04 0.29 2.19 0.28 -2.07 117.98 120.77 1x4b s PHE 31 Ca 0.17 -0.71 -0.30 0.00 0.33 0.00 0.00 56.93 56.41 1x4b s PHE 31 Cb -0.11 -3.39 -0.04 0.00 -1.31 0.00 0.00 43.02 38.18 1x4b s PHE 31 CO 0.08 -0.93 1.00 0.42 1.83 0.00 0.00 175.22 177.62 1x4b s ILE 32 N 2.20 4.66 -0.03 3.12 -1.09 0.44 0.67 121.20 131.17 1x4b s ILE 32 Ca 0.10 2.00 0.05 0.00 -2.23 0.00 0.00 60.65 60.57 1x4b s ILE 32 Cb -0.21 -4.28 -0.01 0.00 -1.58 0.00 0.00 42.46 36.38 1x4b s ILE 32 CO 0.09 0.20 -0.17 -0.83 -1.23 0.00 0.00 174.94 173.01 1x4b s GLY 33 N 0.70 0.90 0.00 6.18 0.00 -0.19 -1.03 107.32 113.88 1x4b s GLY 33 Ca 0.51 -0.72 0.00 0.00 0.00 0.00 0.00 44.72 44.52 1x4b s GLY 33 CO 0.29 -0.45 0.00 0.61 0.00 0.00 0.00 173.10 173.55 1x4b n GLY 34 N 2.98 0.09 0.62 0.20 0.00 0.49 -0.36 105.19 109.20 1x4b n GLY 34 Ca -0.17 -0.32 0.13 0.00 0.00 0.00 0.00 46.02 45.66 1x4b n GLY 34 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1x4b n LEU 35 N -0.87 2.06 0.00 0.99 4.77 0.19 -4.03 117.00 120.10 1x4b n LEU 35 Ca 0.00 -0.69 0.00 0.00 -0.03 0.00 0.00 56.01 55.29 1x4b n LEU 35 Cb 0.40 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.47 1x4b n LEU 35 CO 0.00 0.36 0.00 -1.54 -1.33 0.00 0.00 177.39 174.88 1x4b n SER 36 N 0.42 0.00 0.00 -1.43 3.41 -1.26 -2.58 113.62 112.18 1x4b n SER 36 Ca 0.14 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.75 1x4b n SER 36 Cb 0.46 -0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.41 1x4b n SER 36 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 1x4b n PHE 37 N -2.00 0.00 -0.04 7.33 3.72 -1.26 -4.78 117.46 120.43 1x4b n PHE 37 Ca 0.00 0.00 -0.05 0.00 -0.05 0.00 0.00 57.45 57.35 1x4b n PHE 37 Cb 0.00 -0.30 -0.02 0.00 -0.94 0.00 0.00 39.48 38.23 1x4b n PHE 37 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 176.76 174.80 1x4b n GLU 38 N -2.00 0.30 -1.43 -1.08 2.13 -1.20 -4.53 120.64 112.83 1x4b n GLU 38 Ca 0.00 0.12 -0.34 0.00 0.66 0.00 0.00 57.16 57.60 1x4b n GLU 38 Cb 0.00 -1.00 -0.16 0.00 0.27 0.00 0.00 31.44 30.54 1x4b n GLU 38 CO 0.00 0.00 0.00 2.41 -0.41 0.00 0.00 177.13 179.13 1x4b n THR 39 N -3.82 0.00 -0.96 6.31 -1.04 -1.06 -4.85 114.28 108.86 1x4b n THR 39 Ca -0.08 -0.13 -0.11 0.00 -2.04 0.00 0.00 64.05 61.69 1x4b n THR 39 Cb 0.30 -0.34 0.09 0.00 -1.82 0.00 0.00 70.33 68.55 1x4b n THR 39 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 1x4b n THR 40 N 6.62 0.00 0.05 12.58 -2.24 -1.26 -4.59 114.28 125.44 1x4b n THR 40 Ca 0.63 -0.25 -0.11 0.00 -2.27 0.00 0.00 64.05 62.05 1x4b n THR 40 Cb 0.06 -1.38 -0.05 0.00 -2.10 0.00 0.00 70.33 66.86 1x4b n THR 40 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1x4b h GLU 41 N 0.00 -0.41 0.61 -0.78 5.08 -1.93 0.27 114.58 117.41 1x4b h GLU 41 Ca -0.15 0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 58.20 1x4b h GLU 41 Cb 0.45 0.09 0.01 0.00 0.50 0.00 0.00 28.75 29.80 1x4b h GLU 41 CO 0.10 -0.27 -0.29 1.49 -1.00 0.00 0.00 179.01 179.04 1x4b h GLU 42 N -0.42 -0.79 -1.59 2.33 4.81 -1.96 0.45 114.58 117.42 1x4b h GLU 42 Ca 0.07 0.05 0.47 0.00 -0.13 0.00 0.00 59.36 59.82 1x4b h GLU 42 Cb 0.52 0.18 -0.08 0.00 0.63 0.00 0.00 28.75 29.99 1x4b h GLU 42 CO -0.26 -0.52 1.12 0.77 -0.73 0.00 0.00 179.01 179.39 1x4b h SER 43 N -0.87 0.07 0.14 1.04 0.02 -1.88 1.67 113.55 113.74 1x4b h SER 43 Ca -0.08 0.03 -0.20 0.00 -0.84 0.00 0.00 61.79 60.70 1x4b h SER 43 Cb 0.63 0.03 0.02 0.00 0.14 0.00 0.00 62.40 63.22 1x4b h SER 43 CO 0.14 -0.04 -0.88 0.25 -1.14 0.00 0.00 176.83 175.16 1x4b h LEU 44 N 0.03 0.53 -0.15 5.07 5.85 0.00 -3.29 115.31 123.35 1x4b h LEU 44 Ca 0.80 -0.93 -0.01 0.00 0.84 0.00 0.00 57.88 58.58 1x4b h LEU 44 Cb 3.02 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 43.88 1x4b h LEU 44 CO -0.11 1.42 0.06 0.03 -0.34 0.00 0.00 178.44 179.50 1x4b h ARG 45 N -0.28 0.22 -0.55 1.25 3.08 0.68 -0.82 114.38 117.96 1x4b h ARG 45 Ca -0.15 -0.04 0.16 0.00 0.07 0.00 0.00 59.98 60.02 1x4b h ARG 45 Cb 1.68 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 31.68 1x4b h ARG 45 CO 0.17 0.30 0.73 -0.97 -1.07 0.00 0.00 179.97 179.13 1x4b h ASN 46 N 0.09 0.00 0.00 7.04 -1.24 0.69 1.20 115.58 123.36 1x4b h ASN 46 Ca 0.05 0.00 -0.14 0.00 0.71 0.00 0.00 56.30 56.92 1x4b h ASN 46 Cb 0.17 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 39.19 1x4b h ASN 46 CO -0.00 0.00 -0.88 0.22 -1.29 0.00 0.00 177.43 175.48 1x4b h TYR 47 N 0.00 0.00 -0.42 0.67 3.20 -1.37 -3.37 116.97 115.68 1x4b h TYR 47 Ca 0.26 0.00 -0.19 0.00 3.14 0.00 0.00 58.73 61.94 1x4b h TYR 47 Cb 1.71 0.00 -0.12 0.00 1.54 0.00 0.00 36.73 39.87 1x4b h TYR 47 CO 0.00 1.02 0.25 0.66 -1.64 0.00 0.00 178.16 178.44 1x4b n TYR 48 N -4.51 1.32 0.03 -3.82 4.01 0.14 -3.69 117.16 110.64 1x4b n TYR 48 Ca -0.22 -0.97 0.11 0.00 -0.16 0.00 0.00 57.90 56.66 1x4b n TYR 48 Cb 0.53 -0.52 -0.16 0.00 -0.31 0.00 0.00 39.34 38.88 1x4b n TYR 48 CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 1x4b n GLU 49 N -0.15 0.63 0.16 -0.72 1.02 0.39 -3.98 120.64 118.00 1x4b n GLU 49 Ca 0.25 -0.17 -0.07 0.00 -0.02 0.00 0.00 57.16 57.14 1x4b n GLU 49 Cb 0.97 -1.54 -0.04 0.00 -0.02 0.00 0.00 31.44 30.82 1x4b n GLU 49 CO 0.00 0.00 0.00 1.96 1.18 0.00 0.00 177.13 180.27 1x4b h GLN 50 N 0.00 -0.46 -0.83 3.49 4.20 -1.80 -3.26 115.11 116.44 1x4b h GLN 50 Ca 0.00 0.03 0.17 0.00 0.06 0.00 0.00 58.65 58.91 1x4b h GLN 50 Cb 0.98 0.11 -0.11 0.00 0.30 0.00 0.00 27.48 28.76 1x4b h GLN 50 CO 0.00 -0.31 0.36 -1.49 -0.67 0.00 0.00 178.83 176.72 1x4b h TRP 51 N -1.01 0.61 -1.48 2.96 6.55 -1.82 -3.44 115.95 118.31 1x4b h TRP 51 Ca -0.05 0.04 0.23 0.00 0.95 0.00 0.00 58.89 60.06 1x4b h TRP 51 Cb 0.37 -0.14 -0.20 0.00 -0.86 0.00 0.00 29.16 28.33 1x4b h TRP 51 CO 0.01 0.04 0.79 0.20 -1.05 0.00 0.00 178.44 178.43 1x4b s GLY 52 N -3.61 -0.25 -0.17 1.49 0.00 -1.23 -4.61 107.32 98.94 1x4b s GLY 52 Ca -0.12 1.76 -0.29 0.00 0.00 0.00 0.00 44.72 46.06 1x4b s GLY 52 CO 0.77 0.64 1.08 0.54 0.00 0.00 0.00 173.10 176.13 1x4b s LYS 53 N -2.17 4.31 -0.41 2.90 1.02 -1.25 -3.66 119.74 120.48 1x4b s LYS 53 Ca 0.08 1.44 -0.29 0.00 0.02 0.00 0.00 55.97 57.23 1x4b s LYS 53 Cb -0.01 -3.62 0.00 0.00 -0.52 0.00 0.00 37.83 33.68 1x4b s LYS 53 CO -0.05 -0.54 1.49 -0.51 -0.92 0.00 0.00 175.35 174.82 1x4b s LEU 54 N 2.83 3.55 0.28 3.17 1.43 -1.26 -2.64 118.68 126.05 1x4b s LEU 54 Ca 0.48 0.87 0.25 0.00 -1.03 0.00 0.00 54.13 54.69 1x4b s LEU 54 Cb -0.18 -3.49 0.98 0.00 0.03 0.00 0.00 46.19 43.54 1x4b s LEU 54 CO 0.12 -1.52 1.75 0.71 0.23 0.00 0.00 176.35 177.64 1x4b h THR 55 N 6.53 0.00 -1.22 5.49 1.35 0.19 -3.41 112.91 121.85 1x4b h THR 55 Ca -0.29 -0.31 0.06 0.00 -0.55 0.00 0.00 66.41 65.32 1x4b h THR 55 Cb 1.12 1.12 -0.22 0.00 -1.73 0.00 0.00 68.15 68.44 1x4b h THR 55 CO 1.08 0.00 -0.28 -1.81 -0.25 0.00 0.00 175.52 174.27 1x4b s ASP 56 N -4.46 -1.18 -0.09 5.36 1.01 -1.09 -5.00 116.67 111.21 1x4b s ASP 56 Ca 0.05 0.88 0.01 0.00 0.71 0.00 0.00 52.55 54.21 1x4b s ASP 56 Cb 0.10 2.06 0.02 0.00 1.01 0.00 0.00 42.92 46.11 1x4b s ASP 56 CO 0.45 -0.26 -0.11 0.00 0.21 0.00 0.00 175.17 175.45 1x4b s VAL 58 N 1.09 0.97 -0.23 0.00 1.01 -0.33 -4.97 120.40 117.94 1x4b s VAL 58 Ca -0.06 -0.63 0.02 0.00 0.00 0.00 0.00 61.98 61.31 1x4b s VAL 58 Cb -0.14 -0.83 0.04 0.00 0.00 0.00 0.00 36.38 35.45 1x4b s VAL 58 CO -0.02 0.19 -0.14 0.54 0.00 0.00 0.00 175.10 175.67 1x4b s VAL 59 N -0.44 2.15 0.47 2.92 0.11 -1.26 0.29 120.40 124.65 1x4b s VAL 59 Ca 0.04 -1.34 -0.23 0.00 -2.93 0.00 0.00 61.98 57.52 1x4b s VAL 59 Cb -0.05 -2.12 -0.07 0.00 -1.53 0.00 0.00 36.38 32.60 1x4b s VAL 59 CO -0.00 0.20 1.17 -0.04 -3.33 0.00 0.00 175.10 173.11 1x4b s MET 60 N 1.18 3.69 -0.04 1.54 -1.94 -0.16 -4.91 119.30 118.67 1x4b s MET 60 Ca -0.03 1.79 0.03 0.00 -1.71 0.00 0.00 55.69 55.77 1x4b s MET 60 Cb -0.17 -2.37 0.00 0.00 2.01 0.00 0.00 34.83 34.30 1x4b s MET 60 CO -0.08 -0.61 -0.14 1.03 -0.01 0.00 0.00 175.02 175.21 1x4b s ARG 61 N -2.75 1.50 0.02 2.03 0.52 -1.26 -0.30 118.95 118.71 1x4b s ARG 61 Ca 0.65 -0.49 -0.39 0.00 -0.52 0.00 0.00 55.73 54.98 1x4b s ARG 61 Cb -0.29 -1.32 -0.19 0.00 0.52 0.00 0.00 34.95 33.67 1x4b s ARG 61 CO 0.35 0.18 1.05 -0.25 0.02 0.00 0.00 175.30 176.65 1x4b n ASP 62 N 3.26 0.04 0.00 0.23 8.00 -1.26 -4.65 116.55 122.17 1x4b n ASP 62 Ca -0.19 1.15 0.11 0.00 0.71 0.00 0.00 54.79 56.58 1x4b n ASP 62 Cb 0.53 -0.95 0.51 0.00 -0.02 0.00 0.00 41.12 41.19 1x4b n ASP 62 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 1x4b n PRO 63 N 1.54 0.13 -0.04 -0.24 -0.04 -1.26 0.19 135.00 135.27 1x4b n PRO 63 Ca 0.20 0.10 -0.06 0.00 -0.04 0.00 0.00 63.50 63.70 1x4b n PRO 63 Cb 0.10 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.02 1x4b n PRO 63 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1x4b n ALA 64 N -1.42 1.83 0.05 0.55 0.00 -1.26 -4.70 120.51 115.57 1x4b n ALA 64 Ca 0.07 -0.38 -0.19 0.00 0.00 0.00 0.00 53.44 52.95 1x4b n ALA 64 Cb 0.23 0.30 -0.14 0.00 0.00 0.00 0.00 19.45 19.83 1x4b n ALA 64 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1x4b h SER 65 N -0.01 0.44 -2.47 0.00 0.02 -1.92 -3.47 113.55 106.13 1x4b h SER 65 Ca -0.20 -0.67 -0.40 0.00 -0.84 0.00 0.00 61.79 59.68 1x4b h SER 65 Cb 1.31 -0.14 -0.06 0.00 0.14 0.00 0.00 62.40 63.64 1x4b h SER 65 CO -0.03 1.56 -0.47 0.29 -1.14 0.00 0.00 176.83 177.04 1x4b n LYS 66 N -3.47 -1.65 -3.08 3.45 4.01 0.50 -4.88 118.16 113.03 1x4b n LYS 66 Ca -0.21 1.04 -0.24 0.00 -0.51 0.00 0.00 58.31 58.39 1x4b n LYS 66 Cb 1.05 -5.61 -0.04 0.00 -0.51 0.00 0.00 35.03 29.92 1x4b n LYS 66 CO 0.00 0.00 0.00 0.54 -1.11 0.00 0.00 177.40 176.83 1x4b n ARG 67 N -2.79 2.24 -1.81 1.97 1.74 -1.26 -4.84 116.66 111.91 1x4b n ARG 67 Ca -0.23 -4.24 0.00 0.00 -0.77 0.00 0.00 57.85 52.62 1x4b n ARG 67 Cb 0.67 -1.99 0.00 0.00 -1.02 0.00 0.00 32.46 30.12 1x4b n ARG 67 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1x4b n SER 68 N 0.13 -9.25 0.05 0.55 7.64 -1.26 -4.75 113.62 106.73 1x4b n SER 68 Ca 0.28 1.31 -0.17 0.00 1.01 0.00 0.00 58.87 61.30 1x4b n SER 68 Cb 0.49 -4.88 -0.14 0.00 -1.01 0.00 0.00 64.21 58.68 1x4b n SER 68 CO 0.00 0.00 0.00 -0.09 -3.01 0.00 0.00 175.04 171.94 1x4b h ARG 69 N 2.97 0.24 0.00 1.43 1.12 -0.93 -3.35 114.38 115.86 1x4b h ARG 69 Ca 0.00 -0.41 0.00 0.00 -1.11 0.00 0.00 59.98 58.46 1x4b h ARG 69 Cb 0.00 0.15 0.00 0.00 -0.01 0.00 0.00 29.97 30.11 1x4b h ARG 69 CO 0.00 1.09 0.00 0.41 -3.11 0.00 0.00 179.97 178.36 1x4b n GLY 70 N 1.73 1.59 3.52 2.80 0.00 -1.26 -4.75 105.19 108.83 1x4b n GLY 70 Ca -0.20 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.65 1x4b n GLY 70 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1x4b s PHE 71 N -2.00 -0.65 0.00 1.61 -0.12 -1.26 0.18 117.98 115.74 1x4b s PHE 71 Ca 0.00 1.20 0.00 0.00 -0.05 0.00 0.00 56.93 58.08 1x4b s PHE 71 Cb 0.00 0.37 0.00 0.00 -0.63 0.00 0.00 43.02 42.76 1x4b s PHE 71 CO 0.00 -0.56 0.00 0.41 -0.05 0.00 0.00 175.22 175.02 1x4b n GLY 72 N 1.21 3.13 3.25 1.99 0.00 -0.19 -0.98 105.19 113.59 1x4b n GLY 72 Ca -0.18 -0.98 -0.25 0.00 0.00 0.00 0.00 46.02 44.61 1x4b n GLY 72 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1x4b s PHE 73 N -4.22 1.75 -0.10 1.61 0.40 0.15 -0.42 117.98 117.15 1x4b s PHE 73 Ca 0.00 -0.38 -0.01 0.00 -0.60 0.00 0.00 56.93 55.94 1x4b s PHE 73 Cb 0.00 -1.02 0.03 0.00 0.51 0.00 0.00 43.02 42.53 1x4b s PHE 73 CO 0.00 0.11 -0.05 0.14 0.70 0.00 0.00 175.22 176.12 1x4b s VAL 74 N -0.89 0.80 -0.30 -0.44 -7.23 -0.88 -1.18 120.40 110.29 1x4b s VAL 74 Ca 0.07 -0.15 -0.03 0.00 -1.81 0.00 0.00 61.98 60.05 1x4b s VAL 74 Cb -0.09 -0.86 0.04 0.00 0.56 0.00 0.00 36.38 36.02 1x4b s VAL 74 CO 0.02 0.33 0.02 -0.89 -0.31 0.00 0.00 175.10 174.27 1x4b s THR 75 N 1.74 3.28 0.90 5.32 2.01 0.12 -2.44 115.64 126.56 1x4b s THR 75 Ca 0.04 -1.17 -0.14 0.00 0.31 0.00 0.00 61.69 60.73 1x4b s THR 75 Cb -0.13 -2.81 0.14 0.00 0.01 0.00 0.00 72.50 69.71 1x4b s THR 75 CO -0.07 -0.04 1.21 -0.36 -0.69 0.00 0.00 174.62 174.67 1x4b s PHE 76 N 1.33 2.32 -0.12 4.92 0.08 -1.16 0.19 117.98 125.54 1x4b s PHE 76 Ca -0.02 0.62 -0.21 0.00 0.12 0.00 0.00 56.93 57.44 1x4b s PHE 76 Cb -0.19 -3.67 -0.26 0.00 -0.57 0.00 0.00 43.02 38.33 1x4b s PHE 76 CO -0.00 -2.27 0.61 1.03 -0.10 0.00 0.00 175.22 174.48 1x4b h SER 77 N -1.40 0.25 -2.75 1.36 0.87 -1.85 -3.40 113.55 106.62 1x4b h SER 77 Ca -0.46 -0.84 -0.59 0.00 -1.23 0.00 0.00 61.79 58.66 1x4b h SER 77 Cb 1.30 -0.08 -0.11 0.00 -0.44 0.00 0.00 62.40 63.07 1x4b h SER 77 CO 0.55 1.42 -0.66 -0.44 -0.53 0.00 0.00 176.83 177.17 1x4b s SER 78 N -6.81 4.69 0.08 6.23 0.01 -1.26 -5.01 113.70 111.62 1x4b s SER 78 Ca -0.20 -0.46 0.27 0.00 1.31 0.00 0.00 55.95 56.87 1x4b s SER 78 Cb 0.02 -0.96 1.06 0.00 0.21 0.00 0.00 66.02 66.36 1x4b s SER 78 CO 0.73 0.07 1.85 0.80 0.41 0.00 0.00 173.24 177.10 1x4b n MET 79 N -0.27 0.09 -0.02 12.44 1.56 -1.26 -3.25 117.12 126.40 1x4b n MET 79 Ca -0.09 0.09 -0.12 0.00 -0.27 0.00 0.00 57.70 57.31 1x4b n MET 79 Cb 0.56 -1.61 -0.10 0.00 2.15 0.00 0.00 33.22 34.22 1x4b n MET 79 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 1x4b h ALA 80 N 2.80 -0.06 0.33 -5.12 0.00 -1.98 -2.64 119.26 112.60 1x4b h ALA 80 Ca 0.00 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 54.58 1x4b h ALA 80 Cb 0.56 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 1x4b h ALA 80 CO 0.00 -0.13 -0.34 0.93 0.00 0.00 0.00 179.25 179.71 1x4b h GLU 81 N -0.85 -0.67 -0.66 0.00 4.39 -1.81 -1.27 114.58 113.71 1x4b h GLU 81 Ca -0.01 0.05 0.14 0.00 0.34 0.00 0.00 59.36 59.88 1x4b h GLU 81 Cb 0.68 0.15 -0.11 0.00 -0.10 0.00 0.00 28.75 29.37 1x4b h GLU 81 CO 0.01 -0.45 -0.02 -0.24 -1.16 0.00 0.00 179.01 177.15 1x4b h VAL 82 N -0.70 0.44 -0.24 3.13 3.04 -1.68 1.55 116.25 121.79 1x4b h VAL 82 Ca -0.02 -0.03 0.07 0.00 -1.01 0.00 0.00 66.70 65.71 1x4b h VAL 82 Cb 0.63 0.33 -0.01 0.00 -2.01 0.00 0.00 31.29 30.23 1x4b h VAL 82 CO -0.07 0.02 0.22 -0.78 -1.01 0.00 0.00 177.57 175.95 1x4b h ASP 83 N 0.10 0.00 0.14 3.17 1.82 -1.02 0.40 116.42 121.03 1x4b h ASP 83 Ca 0.34 0.00 -0.01 0.00 -0.39 0.00 0.00 57.03 56.98 1x4b h ASP 83 Cb 0.57 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.58 1x4b h ASP 83 CO -0.58 0.00 -0.07 0.00 -1.61 0.00 0.00 179.24 176.98 1x4b h ALA 84 N 1.79 -0.19 -0.87 -0.78 0.00 0.32 -2.94 119.26 116.59 1x4b h ALA 84 Ca 0.12 -0.10 0.16 0.00 0.00 0.00 0.00 54.91 55.08 1x4b h ALA 84 Cb 0.55 0.07 -0.10 0.00 0.00 0.00 0.00 17.79 18.31 1x4b h ALA 84 CO -0.00 -0.19 0.45 0.00 0.00 0.00 0.00 179.25 179.51 1x4b h ALA 85 N -0.88 1.34 -0.41 0.00 0.00 -0.05 0.18 119.26 119.43 1x4b h ALA 85 Ca -0.02 0.09 0.07 0.00 0.00 0.00 0.00 54.91 55.06 1x4b h ALA 85 Cb 0.27 -0.00 -0.06 0.00 0.00 0.00 0.00 17.79 17.99 1x4b h ALA 85 CO 0.03 -0.11 0.04 0.52 0.00 0.00 0.00 179.25 179.73 1x4b h MET 86 N 0.61 0.15 -1.84 0.00 2.07 -0.31 -1.78 114.93 113.85 1x4b h MET 86 Ca 0.49 -0.01 -0.75 0.00 -2.07 0.00 0.00 59.70 57.36 1x4b h MET 86 Cb 0.73 -0.03 -0.28 0.00 -1.87 0.00 0.00 31.60 30.14 1x4b h MET 86 CO -0.38 0.10 0.94 0.00 1.07 0.00 0.00 176.91 178.64 1x4b n ALA 87 N -2.51 6.42 -2.47 6.32 0.00 -0.03 -4.45 120.51 123.78 1x4b n ALA 87 Ca 0.03 -4.05 -0.12 0.00 0.00 0.00 0.00 53.44 49.31 1x4b n ALA 87 Cb 0.21 -1.88 0.03 0.00 0.00 0.00 0.00 19.45 17.81 1x4b n ALA 87 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1x4b n ALA 88 N -0.59 3.77 -2.43 0.00 0.00 -0.67 -4.94 120.51 115.65 1x4b n ALA 88 Ca 0.54 -3.28 -0.25 0.00 0.00 0.00 0.00 53.44 50.45 1x4b n ALA 88 Cb 0.31 -0.63 -0.00 0.00 0.00 0.00 0.00 19.45 19.13 1x4b n ALA 88 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1x4b s ARG 89 N -3.67 3.39 1.10 0.00 0.52 -1.26 -4.45 118.95 114.57 1x4b s ARG 89 Ca 0.38 -0.17 -0.18 0.00 -0.52 0.00 0.00 55.73 55.24 1x4b s ARG 89 Cb 0.37 -2.52 0.25 0.00 0.52 0.00 0.00 34.95 33.57 1x4b s ARG 89 CO -0.01 -0.10 1.23 -1.25 0.02 0.00 0.00 175.30 175.19 1x4b s PRO 90 N -4.55 -0.45 -0.12 3.54 0.04 -1.26 -5.16 135.00 127.05 1x4b s PRO 90 Ca 0.45 -0.31 -0.00 0.00 0.04 0.00 0.00 61.00 61.18 1x4b s PRO 90 Cb -0.10 -1.71 0.02 0.00 0.04 0.00 0.00 34.50 32.76 1x4b s PRO 90 CO 0.40 -3.16 -0.09 -1.01 0.04 0.00 0.00 177.00 173.18 1x4b s HIS 91 N -3.48 1.66 -0.21 0.56 3.76 -1.26 -5.09 115.29 111.24 1x4b s HIS 91 Ca 0.73 -0.86 -0.02 0.00 -0.15 0.00 0.00 55.06 54.77 1x4b s HIS 91 Cb -0.06 -1.32 0.01 0.00 1.11 0.00 0.00 32.58 32.32 1x4b s HIS 91 CO 0.55 -0.55 -0.10 -1.54 -0.85 0.00 0.00 174.74 172.24 1x4b s SER 92 N 1.63 3.88 0.04 1.40 1.04 -1.26 0.23 113.70 120.66 1x4b s SER 92 Ca 0.05 -0.56 0.03 0.00 0.48 0.00 0.00 55.95 55.94 1x4b s SER 92 Cb -0.13 -1.63 -0.02 0.00 0.10 0.00 0.00 66.02 64.34 1x4b s SER 92 CO -0.09 -0.03 -0.08 -0.63 0.98 0.00 0.00 173.24 173.39 1x4b s ILE 93 N 1.39 0.62 -0.83 -1.02 1.01 0.12 -4.73 121.20 117.76 1x4b s ILE 93 Ca 0.05 -0.93 0.00 0.00 0.00 0.00 0.00 60.65 59.76 1x4b s ILE 93 Cb -0.14 -0.64 0.00 0.00 0.01 0.00 0.00 42.46 41.69 1x4b s ILE 93 CO -0.07 -0.24 0.00 -0.67 0.00 0.00 0.00 174.94 173.96 1x4b n ASP 94 N 1.76 -5.43 0.00 3.58 -0.08 -1.26 -0.15 116.55 114.97 1x4b n ASP 94 Ca -0.20 0.19 0.00 0.00 -1.51 0.00 0.00 54.79 53.27 1x4b n ASP 94 Cb 0.55 -3.61 0.00 0.00 2.34 0.00 0.00 41.12 40.40 1x4b n ASP 94 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1x4b n GLY 95 N -0.04 1.27 3.90 0.27 0.00 -1.26 -5.02 105.19 104.29 1x4b n GLY 95 Ca -0.08 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.74 1x4b n GLY 95 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1x4b s ARG 96 N -0.41 2.66 -0.50 1.61 1.70 0.78 -5.08 118.95 119.72 1x4b s ARG 96 Ca 0.00 -1.40 -0.17 0.00 -0.47 0.00 0.00 55.73 53.69 1x4b s ARG 96 Cb 0.00 -2.48 0.08 0.00 -0.57 0.00 0.00 34.95 31.97 1x4b s ARG 96 CO 0.00 -0.11 0.51 0.08 -1.08 0.00 0.00 175.30 174.70 1x4b s VAL 97 N -2.39 5.07 0.45 4.99 1.01 -1.26 0.11 120.40 128.38 1x4b s VAL 97 Ca 0.47 -0.90 -0.05 0.00 0.00 0.00 0.00 61.98 61.50 1x4b s VAL 97 Cb -0.05 -4.24 0.10 0.00 0.00 0.00 0.00 36.38 32.19 1x4b s VAL 97 CO 0.28 -0.73 0.62 1.33 0.00 0.00 0.00 175.10 176.60 1x4b n VAL 98 N 5.38 0.00 -3.18 2.92 0.24 0.14 -4.96 118.33 118.86 1x4b n VAL 98 Ca -0.10 -0.65 0.02 0.00 -2.04 0.00 0.00 64.34 61.57 1x4b n VAL 98 Cb 0.44 -1.47 -0.02 0.00 -1.47 0.00 0.00 33.84 31.32 1x4b n VAL 98 CO 0.00 0.00 0.00 -1.83 -2.14 0.00 0.00 176.83 172.86 1x4b s GLU 99 N -4.21 0.54 0.67 7.34 1.03 0.51 -4.31 118.70 120.28 1x4b s GLU 99 Ca 0.37 0.94 -0.12 0.00 0.03 0.00 0.00 54.97 56.20 1x4b s GLU 99 Cb -0.01 0.41 -0.00 0.00 -0.80 0.00 0.00 34.13 33.72 1x4b s GLU 99 CO 0.26 -0.62 1.06 -1.25 -1.33 0.00 0.00 175.26 173.37 1x4b s PRO 100 N 2.82 3.04 0.20 -4.83 0.04 -1.26 -1.02 135.00 133.98 1x4b s PRO 100 Ca 0.20 1.00 -0.05 0.00 0.04 0.00 0.00 61.00 62.19 1x4b s PRO 100 Cb -0.15 -2.00 -0.03 0.00 0.04 0.00 0.00 34.50 32.36 1x4b s PRO 100 CO -0.20 -1.02 0.22 0.15 0.04 0.00 0.00 177.00 176.18 1x4b s LYS 101 N -4.85 1.24 -0.16 4.56 -0.14 0.21 -4.84 119.74 115.76 1x4b s LYS 101 Ca 0.59 -1.47 -0.18 0.00 -1.36 0.00 0.00 55.97 53.55 1x4b s LYS 101 Cb -0.14 0.32 -0.04 0.00 -1.68 0.00 0.00 37.83 36.29 1x4b s LYS 101 CO 0.51 -0.43 0.47 1.03 -0.76 0.00 0.00 175.35 176.17 1x4b s ARG 102 N -4.09 4.26 -0.92 1.68 0.52 -1.26 0.99 118.95 120.12 1x4b s ARG 102 Ca 0.31 0.38 -0.03 0.00 -0.52 0.00 0.00 55.73 55.87 1x4b s ARG 102 Cb 0.05 -3.50 0.18 0.00 0.52 0.00 0.00 34.95 32.20 1x4b s ARG 102 CO 0.09 0.02 2.33 0.00 0.02 0.00 0.00 175.30 177.75 1x4b n ALA 103 N 4.20 6.51 -2.53 2.13 0.00 -1.03 -4.57 120.51 125.22 1x4b n ALA 103 Ca -0.07 -3.89 -0.18 0.00 0.00 0.00 0.00 53.44 49.30 1x4b n ALA 103 Cb 0.51 -2.33 -0.11 0.00 0.00 0.00 0.00 19.45 17.51 1x4b n ALA 103 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1x4b s VAL 104 N -2.80 1.31 0.00 0.00 -7.23 -1.26 -4.70 120.40 105.71 1x4b s VAL 104 Ca 0.52 -1.63 0.00 0.00 -1.81 0.00 0.00 61.98 59.06 1x4b s VAL 104 Cb 0.29 -1.45 0.00 0.00 0.56 0.00 0.00 36.38 35.78 1x4b s VAL 104 CO -0.20 -0.36 0.00 0.00 -0.31 0.00 0.00 175.10 174.23 1x4b n ALA 105 N 0.69 0.00 -1.16 1.32 0.00 -1.26 -4.89 120.51 115.21 1x4b n ALA 105 Ca -0.17 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 52.91 1x4b n ALA 105 Cb 0.56 0.00 0.01 0.00 0.00 0.00 0.00 19.45 20.02 1x4b n ALA 105 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1x4b n ARG 106 N 0.00 0.00 -2.47 0.00 1.74 -1.26 -4.02 116.66 110.65 1x4b n ARG 106 Ca 0.00 0.00 -0.05 0.00 -0.77 0.00 0.00 57.85 57.03 1x4b n ARG 106 Cb 0.00 -0.94 0.01 0.00 -1.02 0.00 0.00 32.46 30.50 1x4b n ARG 106 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1x4b n GLU 107 N 1.48 -1.68 -0.08 5.56 1.02 -1.26 -5.02 120.64 120.67 1x4b n GLU 107 Ca 0.07 1.65 -0.07 0.00 -0.02 0.00 0.00 57.16 58.79 1x4b n GLU 107 Cb 0.45 -4.49 -0.03 0.00 -0.02 0.00 0.00 31.44 27.35 1x4b n GLU 107 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 1x4b n GLU 108 N -0.40 0.48 -2.47 3.49 2.13 -1.26 -5.04 120.64 117.57 1x4b n GLU 108 Ca 0.08 0.46 -0.02 0.00 0.66 0.00 0.00 57.16 58.34 1x4b n GLU 108 Cb 0.34 -1.64 -0.02 0.00 0.27 0.00 0.00 31.44 30.38 1x4b n GLU 108 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 1x4b n SER 109 N -4.57 -5.20 0.00 4.31 2.88 -1.26 -4.96 113.62 104.83 1x4b n SER 109 Ca -0.11 1.58 0.00 0.00 -1.33 0.00 0.00 58.87 59.01 1x4b n SER 109 Cb 0.35 -4.84 0.00 0.00 -0.75 0.00 0.00 64.21 58.97 1x4b n SER 109 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x4b n GLY 110 N 1.86 -0.19 3.16 0.46 0.00 -1.26 -5.05 105.19 104.16 1x4b n GLY 110 Ca -0.17 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.82 1x4b n GLY 110 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1x4b n SER 111 N -0.83 -6.67 -3.81 1.61 2.88 -1.26 -4.97 113.62 100.58 1x4b n SER 111 Ca 0.00 0.48 -0.29 0.00 -1.33 0.00 0.00 58.87 57.73 1x4b n SER 111 Cb 0.00 -2.04 -0.16 0.00 -0.75 0.00 0.00 64.21 61.26 1x4b n SER 111 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1x4b s GLY 112 N -1.12 0.97 -1.06 0.46 0.00 -1.26 -5.06 107.32 100.25 1x4b s GLY 112 Ca 0.03 -1.07 -0.23 0.00 0.00 0.00 0.00 44.72 43.45 1x4b s GLY 112 CO 0.16 1.27 1.74 2.56 0.00 0.00 0.00 173.10 178.83 1x4b s PRO 113 N 1.66 3.14 -0.27 2.90 0.04 -1.26 -4.82 135.00 136.38 1x4b s PRO 113 Ca -0.01 -1.01 -0.29 0.00 0.04 0.00 0.00 61.00 59.73 1x4b s PRO 113 Cb -0.18 -5.27 0.18 0.00 0.04 0.00 0.00 34.50 29.27 1x4b s PRO 113 CO -0.10 -2.89 1.32 0.45 0.04 0.00 0.00 177.00 175.82 1x4b s SER 114 N 6.10 -0.09 0.00 6.66 0.15 -1.26 -5.14 113.70 120.12 1x4b s SER 114 Ca 0.59 0.10 0.00 0.00 0.70 0.00 0.00 55.95 57.34 1x4b s SER 114 Cb -0.02 0.08 0.00 0.00 -1.71 0.00 0.00 66.02 64.38 1x4b s SER 114 CO -0.00 -0.07 0.00 -1.20 1.20 0.00 0.00 173.24 173.17 1x4b n SER 115 N 0.68 0.00 0.00 5.45 7.64 -1.26 -5.23 113.62 120.91 1x4b n SER 115 Ca -0.03 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.85 1x4b n SER 115 Cb 0.59 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.79 1x4b n SER 115 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64