#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2z3i s LEU 3 N 0.00 -0.61 0.84 1.53 2.96 -1.26 -4.83 118.68 117.31 2z3i s LEU 3 Ca 0.00 -1.25 -0.12 0.00 -0.22 0.00 0.00 54.13 52.54 2z3i s LEU 3 Cb 0.00 1.08 0.10 0.00 0.50 0.00 0.00 46.19 47.87 2z3i s LEU 3 CO 0.00 -0.23 1.16 -0.94 -1.32 0.00 0.00 176.35 175.02 2z3i s SER 4 N 1.62 3.53 0.33 3.68 1.04 -1.26 -4.78 113.70 117.85 2z3i s SER 4 Ca 0.16 2.20 0.01 0.00 0.48 0.00 0.00 55.95 58.81 2z3i s SER 4 Cb -0.11 -2.57 0.57 0.00 0.10 0.00 0.00 66.02 64.01 2z3i s SER 4 CO -0.06 -2.70 1.95 -0.61 0.98 0.00 0.00 173.24 172.80 2z3i h GLN 5 N -1.27 0.81 -0.22 4.02 5.75 -2.01 -0.98 115.11 121.20 2z3i h GLN 5 Ca -0.45 -0.09 -0.02 0.00 -0.15 0.00 0.00 58.65 57.94 2z3i h GLN 5 Cb 1.27 -0.16 -0.01 0.00 1.07 0.00 0.00 27.48 29.65 2z3i h GLN 5 CO 0.45 0.60 0.04 0.93 -2.65 0.00 0.00 178.83 178.21 2z3i h GLU 6 N 0.82 0.37 0.13 1.69 3.07 -1.99 -0.65 114.58 118.01 2z3i h GLU 6 Ca 0.21 -0.09 -0.01 0.00 -0.50 0.00 0.00 59.36 58.97 2z3i h GLU 6 Cb 0.04 -0.04 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 2z3i h GLU 6 CO -0.03 0.50 -0.06 0.93 -1.40 0.00 0.00 179.01 178.94 2z3i h GLU 7 N 0.18 -0.17 -0.70 2.33 5.08 -1.84 -2.25 114.58 117.22 2z3i h GLU 7 Ca 0.07 0.01 0.06 0.00 -1.00 0.00 0.00 59.36 58.50 2z3i h GLU 7 Cb 0.30 0.04 -0.05 0.00 0.50 0.00 0.00 28.75 29.53 2z3i h GLU 7 CO 0.00 -0.02 0.40 1.03 -1.00 0.00 0.00 179.01 179.42 2z3i h SER 8 N -0.28 0.60 -0.33 1.42 0.87 -1.15 -1.37 113.55 113.32 2z3i h SER 8 Ca -0.02 0.03 -0.04 0.00 -1.23 0.00 0.00 61.79 60.53 2z3i h SER 8 Cb 0.22 -0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 62.07 2z3i h SER 8 CO 0.03 0.39 0.06 0.74 -0.53 0.00 0.00 176.83 177.52 2z3i h THR 9 N 0.74 1.23 -0.37 2.23 2.02 -1.03 -0.14 112.91 117.59 2z3i h THR 9 Ca 0.31 -0.79 0.00 0.00 0.77 0.00 0.00 66.41 66.70 2z3i h THR 9 Cb 0.17 1.12 -0.02 0.00 -1.74 0.00 0.00 68.15 67.68 2z3i h THR 9 CO -0.18 0.26 0.23 -0.07 0.37 0.00 0.00 175.52 176.14 2z3i h LEU 10 N 0.37 0.43 -0.64 2.58 3.38 -1.09 0.38 115.31 120.72 2z3i h LEU 10 Ca 0.10 -0.03 0.02 0.00 0.09 0.00 0.00 57.88 58.06 2z3i h LEU 10 Cb 0.33 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 40.93 2z3i h LEU 10 CO 0.00 0.34 0.40 0.40 0.09 0.00 0.00 178.44 179.68 2z3i h ILE 11 N 0.49 1.10 -0.58 1.22 2.04 -1.17 -1.19 117.51 119.41 2z3i h ILE 11 Ca 0.13 -0.27 -0.10 0.00 1.00 0.00 0.00 64.86 65.62 2z3i h ILE 11 Cb -0.02 0.23 -0.02 0.00 -0.74 0.00 0.00 36.82 36.26 2z3i h ILE 11 CO -0.03 0.15 -0.01 -0.08 0.00 0.00 0.00 178.15 178.18 2z3i h GLU 12 N 0.80 1.03 -0.33 2.37 4.57 -0.58 0.05 114.58 122.48 2z3i h GLU 12 Ca 0.25 -0.33 -0.01 0.00 -1.18 0.00 0.00 59.36 58.09 2z3i h GLU 12 Cb 0.00 -0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 28.48 2z3i h GLU 12 CO -0.10 1.02 0.16 0.00 -1.18 0.00 0.00 179.01 178.92 2z3i h ARG 13 N 0.92 0.48 -0.62 1.92 2.47 -0.71 0.16 114.38 119.00 2z3i h ARG 13 Ca 0.16 -0.07 -0.09 0.00 -1.26 0.00 0.00 59.98 58.72 2z3i h ARG 13 Cb 0.57 -0.09 -0.02 0.00 -1.65 0.00 0.00 29.97 28.78 2z3i h ARG 13 CO 0.03 0.44 0.04 0.00 0.56 0.00 0.00 179.97 181.04 2z3i h ALA 14 N 1.02 0.83 -0.20 0.04 0.00 -1.10 -1.84 119.26 118.01 2z3i h ALA 14 Ca 0.12 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.70 2z3i h ALA 14 Cb 0.11 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 2z3i h ALA 14 CO -0.01 0.65 0.03 1.15 0.00 0.00 0.00 179.25 181.07 2z3i h THR 15 N 0.98 1.22 -0.57 0.00 2.02 -0.80 -2.46 112.91 113.30 2z3i h THR 15 Ca 0.18 -0.74 0.05 0.00 0.77 0.00 0.00 66.41 66.68 2z3i h THR 15 Cb 0.52 1.33 -0.05 0.00 -1.74 0.00 0.00 68.15 68.21 2z3i h THR 15 CO 0.02 0.23 0.29 0.00 0.37 0.00 0.00 175.52 176.43 2z3i h ALA 16 N 0.83 0.74 -0.04 6.16 0.00 -0.61 -1.32 119.26 125.03 2z3i h ALA 16 Ca 0.06 0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.02 2z3i h ALA 16 Cb 0.32 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 2z3i h ALA 16 CO 0.00 -0.05 -0.13 1.15 0.00 0.00 0.00 179.25 180.22 2z3i h THR 17 N 0.55 0.66 -0.29 0.00 2.02 -1.13 -1.15 112.91 113.58 2z3i h THR 17 Ca 0.26 0.00 -0.15 0.00 0.77 0.00 0.00 66.41 67.29 2z3i h THR 17 Cb 0.17 0.66 -0.01 0.00 -1.74 0.00 0.00 68.15 67.24 2z3i h THR 17 CO -0.18 0.00 -0.43 -0.29 0.37 0.00 0.00 175.52 174.99 2z3i h ILE 18 N -0.20 1.29 0.00 3.11 6.09 -1.27 -2.60 117.51 123.93 2z3i h ILE 18 Ca 0.06 -1.61 0.00 0.00 -1.37 0.00 0.00 64.86 61.94 2z3i h ILE 18 Cb 0.28 1.53 0.00 0.00 0.47 0.00 0.00 36.82 39.10 2z3i h ILE 18 CO -0.16 0.52 0.00 0.78 -3.07 0.00 0.00 178.15 176.22 2z3i h ASN 19 N 0.58 0.00 0.65 2.19 2.35 -1.07 -3.10 115.58 117.18 2z3i h ASN 19 Ca 0.04 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.79 2z3i h ASN 19 Cb 0.98 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.35 2z3i h ASN 19 CO 0.09 0.00 -0.28 -1.54 -1.65 0.00 0.00 177.43 174.05 2z3i n SER 20 N -2.36 0.34 -4.66 5.81 3.41 -0.45 -4.91 113.62 110.79 2z3i n SER 20 Ca 0.02 -0.04 -0.25 0.00 -0.26 0.00 0.00 58.87 58.34 2z3i n SER 20 Cb 0.23 -0.05 -0.07 0.00 -0.26 0.00 0.00 64.21 64.06 2z3i n SER 20 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 2z3i s ILE 21 N -2.93 3.66 0.34 -1.33 -4.36 -1.17 -5.09 121.20 110.31 2z3i s ILE 21 Ca 0.14 -1.56 -0.28 0.00 -0.26 0.00 0.00 60.65 58.69 2z3i s ILE 21 Cb 0.18 -2.87 -0.12 0.00 1.25 0.00 0.00 42.46 40.89 2z3i s ILE 21 CO 0.61 -0.19 1.26 -2.65 0.24 0.00 0.00 174.94 174.21 2z3i n PRO 22 N -0.36 2.03 -1.71 0.37 -0.02 -1.26 -4.89 135.00 129.17 2z3i n PRO 22 Ca -0.09 0.71 -0.43 0.00 -2.02 0.00 0.00 63.50 61.67 2z3i n PRO 22 Cb 0.56 -2.27 -0.03 0.00 -0.02 0.00 0.00 33.50 31.74 2z3i n PRO 22 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 2z3i n ILE 23 N 0.31 0.25 -3.78 4.25 5.41 -1.26 -4.97 119.36 119.56 2z3i n ILE 23 Ca 0.05 -0.06 -0.13 0.00 1.00 0.00 0.00 62.75 63.61 2z3i n ILE 23 Cb 0.36 -1.82 -0.11 0.00 -0.71 0.00 0.00 39.64 37.36 2z3i n ILE 23 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 176.55 176.00 2z3i s SER 24 N 0.91 -0.25 0.32 4.38 0.15 -1.26 -5.02 113.70 112.93 2z3i s SER 24 Ca 0.74 0.46 0.24 0.00 0.70 0.00 0.00 55.95 58.09 2z3i s SER 24 Cb -0.56 0.51 0.54 0.00 -1.71 0.00 0.00 66.02 64.80 2z3i s SER 24 CO 0.38 -0.14 1.66 -0.33 1.20 0.00 0.00 173.24 176.01 2z3i h GLU 25 N 5.49 0.00 0.03 5.44 5.08 -2.00 -3.32 114.58 125.30 2z3i h GLU 25 Ca -0.26 0.00 -0.30 0.00 -1.00 0.00 0.00 59.36 57.79 2z3i h GLU 25 Cb 1.19 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.40 2z3i h GLU 25 CO 0.35 0.00 -1.70 -0.44 -1.00 0.00 0.00 179.01 176.22 2z3i h ASP 26 N 0.00 0.11 -3.39 1.42 3.45 -1.95 -3.44 116.42 112.62 2z3i h ASP 26 Ca 0.00 -0.22 -0.61 0.00 0.43 0.00 0.00 57.03 56.63 2z3i h ASP 26 Cb 0.87 -0.04 -0.40 0.00 -0.56 0.00 0.00 39.33 39.21 2z3i h ASP 26 CO 0.00 1.20 -0.75 -0.31 -1.57 0.00 0.00 179.24 177.81 2z3i s TYR 27 N -2.60 1.86 0.00 4.55 1.51 -1.25 -1.07 117.35 120.35 2z3i s TYR 27 Ca -0.08 -2.29 0.00 0.00 -1.01 0.00 0.00 57.07 53.69 2z3i s TYR 27 Cb 0.08 -1.79 0.00 0.00 -0.11 0.00 0.00 41.96 40.13 2z3i s TYR 27 CO 0.82 -0.80 0.17 -1.13 -1.11 0.00 0.00 175.55 173.50 2z3i n SER 28 N 3.72 0.33 -3.94 2.29 3.41 -1.25 -4.06 113.62 114.12 2z3i n SER 28 Ca 0.08 -0.73 -0.15 0.00 -0.26 0.00 0.00 58.87 57.82 2z3i n SER 28 Cb 0.35 0.20 -0.14 0.00 -0.26 0.00 0.00 64.21 64.36 2z3i n SER 28 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2z3i s VAL 29 N -0.20 0.31 0.27 -3.33 1.01 -1.26 -0.73 120.40 116.48 2z3i s VAL 29 Ca 0.00 -0.22 0.11 0.00 0.00 0.00 0.00 61.98 61.87 2z3i s VAL 29 Cb 0.00 -0.28 -0.05 0.00 0.00 0.00 0.00 36.38 36.06 2z3i s VAL 29 CO 0.00 0.05 -0.11 0.00 0.00 0.00 0.00 175.10 175.05 2z3i s ALA 30 N -0.18 2.95 0.06 5.51 0.00 -0.31 -1.31 121.76 128.49 2z3i s ALA 30 Ca 0.01 -1.77 0.02 0.00 0.00 0.00 0.00 51.96 50.21 2z3i s ALA 30 Cb -0.02 -0.50 -0.03 0.00 0.00 0.00 0.00 23.12 22.56 2z3i s ALA 30 CO -0.00 0.27 -0.07 0.45 0.00 0.00 0.00 175.76 176.41 2z3i s SER 31 N -3.59 0.87 0.01 0.00 0.15 -0.20 -0.04 113.70 110.89 2z3i s SER 31 Ca 0.31 -0.72 0.01 0.00 0.70 0.00 0.00 55.95 56.25 2z3i s SER 31 Cb -0.06 0.07 -0.01 0.00 -1.71 0.00 0.00 66.02 64.32 2z3i s SER 31 CO 0.17 -0.32 -0.02 0.00 1.20 0.00 0.00 173.24 174.27 2z3i s ALA 32 N -2.25 0.16 0.03 5.45 0.00 -0.89 -1.92 121.76 122.35 2z3i s ALA 32 Ca -0.03 -0.20 0.02 0.00 0.00 0.00 0.00 51.96 51.75 2z3i s ALA 32 Cb -0.04 0.00 -0.02 0.00 0.00 0.00 0.00 23.12 23.06 2z3i s ALA 32 CO -0.02 -0.00 -0.08 0.00 0.00 0.00 0.00 175.76 175.66 2z3i s ALA 33 N -0.37 0.61 -0.15 0.00 0.00 -0.13 -1.44 121.76 120.28 2z3i s ALA 33 Ca -0.03 -0.65 -0.09 0.00 0.00 0.00 0.00 51.96 51.19 2z3i s ALA 33 Cb -0.03 -0.02 -0.05 0.00 0.00 0.00 0.00 23.12 23.03 2z3i s ALA 33 CO -0.00 0.04 0.16 -1.17 0.00 0.00 0.00 175.76 174.78 2z3i s LEU 34 N -1.20 4.31 0.16 0.00 2.96 -0.14 -0.94 118.68 123.83 2z3i s LEU 34 Ca -0.06 0.40 0.03 0.00 -0.22 0.00 0.00 54.13 54.29 2z3i s LEU 34 Cb -0.08 -2.12 -0.04 0.00 0.50 0.00 0.00 46.19 44.45 2z3i s LEU 34 CO 0.00 0.30 0.27 -0.94 -1.32 0.00 0.00 176.35 174.65 2z3i s SER 35 N -0.39 6.20 0.40 3.68 1.04 -0.48 -0.51 113.70 123.65 2z3i s SER 35 Ca 0.13 0.11 0.29 0.00 0.48 0.00 0.00 55.95 56.96 2z3i s SER 35 Cb -0.12 -1.83 1.21 0.00 0.10 0.00 0.00 66.02 65.38 2z3i s SER 35 CO 0.02 0.04 1.85 0.77 0.98 0.00 0.00 173.24 176.91 2z3i h SER 36 N 2.10 0.00 -0.38 7.02 4.64 -1.31 -2.45 113.55 123.17 2z3i h SER 36 Ca -0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 2z3i h SER 36 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 2z3i h SER 36 CO 0.67 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.73 2z3i n ASP 37 N -2.64 2.94 -0.54 4.97 3.85 -1.26 -4.94 116.55 118.94 2z3i n ASP 37 Ca 0.01 -2.24 0.00 0.00 -0.71 0.00 0.00 54.79 51.85 2z3i n ASP 37 Cb 0.25 -0.43 0.00 0.00 -1.35 0.00 0.00 41.12 39.59 2z3i n ASP 37 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2z3i n GLY 38 N 0.80 0.87 3.31 6.12 0.00 -0.92 -5.09 105.19 110.28 2z3i n GLY 38 Ca 0.15 -0.58 -0.16 0.00 0.00 0.00 0.00 46.02 45.43 2z3i n GLY 38 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2z3i s ARG 39 N -4.34 1.29 -0.05 1.61 0.52 -1.25 -5.00 118.95 111.72 2z3i s ARG 39 Ca 0.00 -1.64 0.03 0.00 -0.52 0.00 0.00 55.73 53.60 2z3i s ARG 39 Cb 0.00 -0.56 0.00 0.00 0.52 0.00 0.00 34.95 34.91 2z3i s ARG 39 CO 0.00 -0.09 -0.15 0.42 0.02 0.00 0.00 175.30 175.50 2z3i s ILE 40 N -3.46 1.28 -0.05 1.52 1.01 -1.26 -1.38 121.20 118.87 2z3i s ILE 40 Ca 0.27 -0.61 0.05 0.00 0.00 0.00 0.00 60.65 60.36 2z3i s ILE 40 Cb 0.06 -1.12 -0.02 0.00 0.01 0.00 0.00 42.46 41.38 2z3i s ILE 40 CO 0.08 0.38 -0.20 -0.36 0.00 0.00 0.00 174.94 174.84 2z3i s PHE 41 N 0.24 2.54 0.37 3.97 0.40 -0.12 -4.94 117.98 120.44 2z3i s PHE 41 Ca -0.07 -0.37 0.06 0.00 -0.60 0.00 0.00 56.93 55.95 2z3i s PHE 41 Cb -0.13 -1.59 -0.07 0.00 0.51 0.00 0.00 43.02 41.74 2z3i s PHE 41 CO 0.03 0.02 0.02 0.95 0.70 0.00 0.00 175.22 176.94 2z3i s THR 42 N -0.54 1.75 -0.11 0.64 -4.23 -1.26 -0.95 115.64 110.93 2z3i s THR 42 Ca 0.07 -2.02 -0.33 0.00 -1.18 0.00 0.00 61.69 58.23 2z3i s THR 42 Cb -0.11 -2.89 0.13 0.00 1.34 0.00 0.00 72.50 70.97 2z3i s THR 42 CO 0.01 -0.03 1.26 -0.83 -0.54 0.00 0.00 174.62 174.49 2z3i s GLY 43 N -3.62 -0.35 0.14 3.99 0.00 -0.81 -4.51 107.32 102.17 2z3i s GLY 43 Ca 0.35 1.19 0.08 0.00 0.00 0.00 0.00 44.72 46.34 2z3i s GLY 43 CO 0.17 0.34 -0.17 -1.34 0.00 0.00 0.00 173.10 172.10 2z3i s VAL 44 N -2.39 1.65 0.92 1.40 -7.23 -1.26 -1.03 120.40 112.46 2z3i s VAL 44 Ca 0.12 -1.80 -0.12 0.00 -1.81 0.00 0.00 61.98 58.37 2z3i s VAL 44 Cb 0.02 -1.71 0.14 0.00 0.56 0.00 0.00 36.38 35.40 2z3i s VAL 44 CO -0.04 -0.31 1.09 0.54 -0.31 0.00 0.00 175.10 176.06 2z3i s ASN 45 N -2.50 3.21 -0.30 4.85 4.22 -0.42 -4.53 114.94 119.47 2z3i s ASN 45 Ca 0.12 1.48 -0.00 0.00 -2.14 0.00 0.00 52.86 52.33 2z3i s ASN 45 Cb -0.06 -2.16 0.09 0.00 1.28 0.00 0.00 41.25 40.41 2z3i s ASN 45 CO 0.05 -2.80 0.08 -0.69 -2.04 0.00 0.00 177.10 171.70 2z3i s VAL 46 N -2.90 1.11 0.11 3.54 1.01 -0.55 -4.41 120.40 118.31 2z3i s VAL 46 Ca 0.64 -1.48 -0.31 0.00 0.00 0.00 0.00 61.98 60.83 2z3i s VAL 46 Cb -0.19 -1.79 -0.07 0.00 0.00 0.00 0.00 36.38 34.33 2z3i s VAL 46 CO 0.57 -0.60 1.30 -0.47 0.00 0.00 0.00 175.10 175.91 2z3i s TYR 47 N 1.51 3.33 -0.15 5.22 6.14 -0.23 -3.28 117.35 129.89 2z3i s TYR 47 Ca 0.08 1.12 -0.28 0.00 0.64 0.00 0.00 57.07 58.63 2z3i s TYR 47 Cb -0.18 -3.57 0.07 0.00 0.42 0.00 0.00 41.96 38.71 2z3i s TYR 47 CO -0.20 -1.88 0.70 -1.58 0.64 0.00 0.00 175.55 173.22 2z3i s HIS 48 N 0.94 -0.72 0.44 4.97 2.46 -1.26 -4.82 115.29 117.30 2z3i s HIS 48 Ca 0.61 1.48 0.37 0.00 0.47 0.00 0.00 55.06 58.00 2z3i s HIS 48 Cb -0.34 0.35 1.88 0.00 -0.13 0.00 0.00 32.58 34.34 2z3i s HIS 48 CO 0.31 -0.51 2.19 0.27 -2.47 0.00 0.00 174.74 174.53 2z3i h PHE 49 N 3.90 0.00 -0.00 3.88 -0.00 -1.96 0.87 116.94 123.63 2z3i h PHE 49 Ca -0.28 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.69 2z3i h PHE 49 Cb 1.15 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.10 2z3i h PHE 49 CO 0.38 0.02 0.00 0.25 -0.00 0.00 0.00 178.31 178.97 2z3i n THR 50 N -3.22 0.00 0.00 0.88 -2.24 -1.26 -4.85 114.28 103.59 2z3i n THR 50 Ca -0.02 -0.05 0.00 0.00 -2.27 0.00 0.00 64.05 61.72 2z3i n THR 50 Cb 0.18 -0.30 0.00 0.00 -2.10 0.00 0.00 70.33 68.11 2z3i n THR 50 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2z3i n GLY 51 N 1.02 0.87 3.62 3.38 0.00 0.22 -5.07 105.19 109.23 2z3i n GLY 51 Ca 0.22 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.82 2z3i n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2z3i n GLY 52 N 0.00 -0.06 3.77 -0.02 0.00 -0.68 -4.85 105.19 103.34 2z3i n GLY 52 Ca 0.00 0.24 -0.39 0.00 0.00 0.00 0.00 46.02 45.86 2z3i n GLY 52 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2z3i s PRO 53 N -1.83 3.87 0.89 1.61 0.04 -1.20 -4.54 135.00 133.83 2z3i s PRO 53 Ca 0.60 2.22 -0.11 0.00 0.04 0.00 0.00 61.00 63.75 2z3i s PRO 53 Cb -0.61 -2.71 0.13 0.00 0.04 0.00 0.00 34.50 31.35 2z3i s PRO 53 CO 0.59 -0.60 1.10 0.00 0.04 0.00 0.00 177.00 178.13 2z3i h ALA 55 N -1.61 1.04 -0.50 0.00 0.00 -1.82 -0.70 119.26 115.68 2z3i h ALA 55 Ca -0.47 0.17 0.01 0.00 0.00 0.00 0.00 54.91 54.62 2z3i h ALA 55 Cb 1.27 0.22 -0.03 0.00 0.00 0.00 0.00 17.79 19.25 2z3i h ALA 55 CO 0.49 -0.34 0.33 1.96 0.00 0.00 0.00 179.25 181.69 2z3i h GLN 56 N 0.29 0.63 -0.01 0.00 7.50 -1.91 -0.32 115.11 121.28 2z3i h GLN 56 Ca 0.44 -0.04 -0.18 0.00 0.50 0.00 0.00 58.65 59.38 2z3i h GLN 56 Cb 0.78 -0.14 -0.01 0.00 0.05 0.00 0.00 27.48 28.15 2z3i h GLN 56 CO -0.52 0.42 -0.80 -0.07 -1.50 0.00 0.00 178.83 176.36 2z3i h LEU 57 N 0.65 0.24 -0.54 1.46 3.38 -1.49 -1.48 115.31 117.53 2z3i h LEU 57 Ca 0.19 -0.18 -0.05 0.00 0.09 0.00 0.00 57.88 57.93 2z3i h LEU 57 Cb -0.04 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 2z3i h LEU 57 CO -0.04 0.94 0.13 0.58 0.09 0.00 0.00 178.44 180.13 2z3i h VAL 58 N 0.12 1.25 -0.71 1.22 2.07 -1.00 -2.00 116.25 117.19 2z3i h VAL 58 Ca -0.03 -0.88 0.06 0.00 0.82 0.00 0.00 66.70 66.67 2z3i h VAL 58 Cb 1.39 0.79 -0.06 0.00 -1.52 0.00 0.00 31.29 31.90 2z3i h VAL 58 CO 0.12 0.32 0.41 0.58 0.02 0.00 0.00 177.57 179.02 2z3i h VAL 59 N 0.76 0.99 -0.81 2.57 2.07 -0.80 -0.69 116.25 120.33 2z3i h VAL 59 Ca 0.17 -0.26 -0.02 0.00 0.82 0.00 0.00 66.70 67.41 2z3i h VAL 59 Cb 0.35 0.17 -0.04 0.00 -1.52 0.00 0.00 31.29 30.25 2z3i h VAL 59 CO 0.00 0.14 0.43 -0.07 0.02 0.00 0.00 177.57 178.10 2z3i h LEU 60 N 0.76 1.02 -0.84 2.57 3.38 -0.83 0.59 115.31 121.96 2z3i h LEU 60 Ca 0.32 -0.10 -0.12 0.00 0.09 0.00 0.00 57.88 58.06 2z3i h LEU 60 Cb 0.18 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 2z3i h LEU 60 CO -0.18 0.83 -0.52 1.23 0.09 0.00 0.00 178.44 179.89 2z3i h GLY 61 N 1.13 0.15 0.85 0.83 0.00 -1.00 -0.41 103.07 104.61 2z3i h GLY 61 Ca 0.28 -0.17 -0.12 0.00 0.00 0.00 0.00 47.33 47.32 2z3i h GLY 61 CO -0.04 0.15 -0.39 -0.84 0.00 0.00 0.00 176.54 175.42 2z3i h THR 62 N 0.11 1.36 -0.15 4.70 2.02 -0.69 -0.84 112.91 119.42 2z3i h THR 62 Ca 0.00 -1.68 0.00 0.00 0.77 0.00 0.00 66.41 65.51 2z3i h THR 62 Cb 0.96 2.06 -0.01 0.00 -1.74 0.00 0.00 68.15 69.43 2z3i h THR 62 CO 0.08 0.50 0.09 0.00 0.37 0.00 0.00 175.52 176.56 2z3i h ALA 63 N 0.53 0.19 -1.01 6.16 0.00 -0.85 -2.70 119.26 121.57 2z3i h ALA 63 Ca -0.01 -0.00 0.04 0.00 0.00 0.00 0.00 54.91 54.93 2z3i h ALA 63 Cb 1.00 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.69 2z3i h ALA 63 CO 0.08 -0.34 0.66 0.00 0.00 0.00 0.00 179.25 179.65 2z3i h ALA 64 N 1.06 1.34 0.00 0.00 0.00 -1.03 -1.17 119.26 119.47 2z3i h ALA 64 Ca 0.06 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 2z3i h ALA 64 Cb -0.01 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 17.42 2z3i h ALA 64 CO -0.02 0.56 -0.07 0.00 0.00 0.00 0.00 179.25 179.71 2z3i h ALA 65 N 1.41 1.53 -0.65 0.00 0.00 -0.84 -1.84 119.26 118.89 2z3i h ALA 65 Ca 0.40 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.24 2z3i h ALA 65 Cb -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 2z3i h ALA 65 CO -0.12 0.09 0.00 0.00 0.00 0.00 0.00 179.25 179.22 2z3i n ALA 66 N -2.37 2.40 -3.84 0.00 0.00 -0.73 -4.96 120.51 111.01 2z3i n ALA 66 Ca -0.03 -1.16 -0.27 0.00 0.00 0.00 0.00 53.44 51.98 2z3i n ALA 66 Cb 0.16 -0.94 0.03 0.00 0.00 0.00 0.00 19.45 18.70 2z3i n ALA 66 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2z3i n ALA 67 N 1.47 -1.55 0.26 0.00 0.00 -0.69 -4.90 120.51 115.11 2z3i n ALA 67 Ca 0.22 0.07 0.15 0.00 0.00 0.00 0.00 53.44 53.88 2z3i n ALA 67 Cb 0.57 -3.59 0.68 0.00 0.00 0.00 0.00 19.45 17.12 2z3i n ALA 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2z3i h ALA 68 N 0.93 1.07 -0.96 0.00 0.00 -1.47 -3.49 119.26 115.34 2z3i h ALA 68 Ca -0.59 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.23 2z3i h ALA 68 Cb 1.37 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.15 2z3i h ALA 68 CO 0.63 0.12 0.00 0.41 0.00 0.00 0.00 179.25 180.41 2z3i n GLY 69 N -0.21 3.26 3.69 0.00 0.00 -1.26 -4.57 105.19 106.10 2z3i n GLY 69 Ca -0.00 -0.23 -0.42 0.00 0.00 0.00 0.00 46.02 45.36 2z3i n GLY 69 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2z3i s ASN 70 N -4.00 6.82 -0.09 1.61 0.01 -1.26 -4.94 114.94 113.08 2z3i s ASN 70 Ca 0.00 2.19 -0.11 0.00 -0.71 0.00 0.00 52.86 54.22 2z3i s ASN 70 Cb 0.00 -2.57 -0.05 0.00 0.41 0.00 0.00 41.25 39.05 2z3i s ASN 70 CO 0.00 -0.72 0.27 -0.76 -1.51 0.00 0.00 177.10 174.38 2z3i s LEU 71 N 2.19 4.37 -0.08 0.60 1.43 -1.26 -0.99 118.68 124.94 2z3i s LEU 71 Ca 0.65 0.64 0.13 0.00 -1.03 0.00 0.00 54.13 54.52 2z3i s LEU 71 Cb -0.33 -2.32 -0.19 0.00 0.03 0.00 0.00 46.19 43.37 2z3i s LEU 71 CO 0.28 0.29 0.16 0.35 0.23 0.00 0.00 176.35 177.66 2z3i n THR 72 N 2.40 0.53 -3.70 5.49 -2.24 0.34 -4.16 114.28 112.94 2z3i n THR 72 Ca -0.16 -0.46 -0.14 0.00 -2.27 0.00 0.00 64.05 61.02 2z3i n THR 72 Cb 0.53 -0.30 -0.08 0.00 -2.10 0.00 0.00 70.33 68.38 2z3i n THR 72 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2z3i s ILE 74 N -0.78 0.05 0.04 0.00 2.07 -0.50 -0.97 121.20 121.12 2z3i s ILE 74 Ca -0.09 -0.40 0.01 0.00 -1.41 0.00 0.00 60.65 58.76 2z3i s ILE 74 Cb -0.03 -0.41 -0.03 0.00 0.13 0.00 0.00 42.46 42.12 2z3i s ILE 74 CO 0.04 -0.22 -0.05 0.54 -1.91 0.00 0.00 174.94 173.34 2z3i s VAL 75 N -0.82 0.33 0.03 4.00 0.11 -0.52 -1.19 120.40 122.34 2z3i s VAL 75 Ca -0.09 -1.31 0.09 0.00 -2.93 0.00 0.00 61.98 57.74 2z3i s VAL 75 Cb -0.05 -0.84 -0.03 0.00 -1.53 0.00 0.00 36.38 33.93 2z3i s VAL 75 CO 0.01 -0.64 -0.25 0.00 -3.33 0.00 0.00 175.10 170.90 2z3i s ALA 76 N -2.31 2.12 -0.10 1.54 0.00 -1.26 -2.09 121.76 119.67 2z3i s ALA 76 Ca -0.05 -1.19 0.01 0.00 0.00 0.00 0.00 51.96 50.74 2z3i s ALA 76 Cb -0.04 -0.46 0.02 0.00 0.00 0.00 0.00 23.12 22.64 2z3i s ALA 76 CO -0.03 0.50 -0.12 0.42 0.00 0.00 0.00 175.76 176.53 2z3i s ILE 77 N -0.75 1.26 0.51 0.00 -1.09 0.94 -1.53 121.20 120.53 2z3i s ILE 77 Ca 0.10 -0.50 -0.19 0.00 -2.23 0.00 0.00 60.65 57.83 2z3i s ILE 77 Cb -0.10 -1.18 -0.07 0.00 -1.58 0.00 0.00 42.46 39.53 2z3i s ILE 77 CO 0.01 0.39 1.05 -0.83 -1.23 0.00 0.00 174.94 174.33 2z3i s GLY 78 N 1.06 2.44 1.25 6.18 0.00 -0.43 -1.16 107.32 116.66 2z3i s GLY 78 Ca -0.06 0.58 -0.19 0.00 0.00 0.00 0.00 44.72 45.05 2z3i s GLY 78 CO -0.02 0.90 1.04 0.54 0.00 0.00 0.00 173.10 175.56 2z3i s ASN 79 N -2.13 0.45 -1.49 1.64 4.22 0.09 -3.42 114.94 114.29 2z3i s ASN 79 Ca 0.67 0.89 -0.08 0.00 -2.14 0.00 0.00 52.86 52.20 2z3i s ASN 79 Cb -0.17 -1.31 0.06 0.00 1.28 0.00 0.00 41.25 41.11 2z3i s ASN 79 CO 0.24 -4.44 0.68 -0.62 -2.04 0.00 0.00 177.10 170.92 2z3i n GLU 80 N -5.01 -4.04 -2.99 3.55 1.02 -1.26 -2.24 120.64 109.67 2z3i n GLU 80 Ca 0.10 0.47 -0.21 0.00 -0.02 0.00 0.00 57.16 57.50 2z3i n GLU 80 Cb 0.59 -4.99 0.02 0.00 -0.02 0.00 0.00 31.44 27.03 2z3i n GLU 80 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2z3i n ASN 81 N -2.88 -5.24 0.11 1.62 5.03 -1.26 -4.88 115.26 107.75 2z3i n ASN 81 Ca -0.13 -0.24 0.13 0.00 0.87 0.00 0.00 54.58 55.21 2z3i n ASN 81 Cb 0.60 -4.29 0.41 0.00 -1.02 0.00 0.00 39.78 35.48 2z3i n ASN 81 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 2z3i n ARG 82 N -3.73 0.26 0.00 3.52 1.74 -0.95 -5.02 116.66 112.49 2z3i n ARG 82 Ca -0.10 0.24 0.00 0.00 -0.77 0.00 0.00 57.85 57.21 2z3i n ARG 82 Cb 0.61 -1.82 0.00 0.00 -1.02 0.00 0.00 32.46 30.23 2z3i n ARG 82 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2z3i n GLY 83 N 1.19 0.11 3.71 -0.13 0.00 -1.26 -4.79 105.19 104.02 2z3i n GLY 83 Ca 0.05 -0.93 -0.42 0.00 0.00 0.00 0.00 46.02 44.72 2z3i n GLY 83 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2z3i s ILE 84 N 0.00 3.03 -0.11 -0.61 1.01 -1.26 -1.31 121.20 121.94 2z3i s ILE 84 Ca 0.00 0.71 0.01 0.00 0.00 0.00 0.00 60.65 61.36 2z3i s ILE 84 Cb 0.00 -3.45 -0.02 0.00 0.01 0.00 0.00 42.46 39.00 2z3i s ILE 84 CO 0.00 0.05 -0.13 -0.76 0.00 0.00 0.00 174.94 174.09 2z3i s LEU 85 N 1.33 2.72 0.48 2.97 1.43 -0.58 -4.83 118.68 122.20 2z3i s LEU 85 Ca 0.68 -0.30 -0.23 0.00 -1.03 0.00 0.00 54.13 53.25 2z3i s LEU 85 Cb -0.40 -1.60 -0.07 0.00 0.03 0.00 0.00 46.19 44.16 2z3i s LEU 85 CO 0.31 0.21 1.30 -0.44 0.23 0.00 0.00 176.35 177.95 2z3i s SER 86 N 0.11 5.81 0.37 2.29 0.01 -1.26 -4.07 113.70 116.95 2z3i s SER 86 Ca -0.06 2.62 -0.28 0.00 1.31 0.00 0.00 55.95 59.54 2z3i s SER 86 Cb -0.15 -2.63 -0.11 0.00 0.21 0.00 0.00 66.02 63.34 2z3i s SER 86 CO 0.05 -1.19 1.50 -0.81 0.41 0.00 0.00 173.24 173.19 2z3i n PRO 87 N -0.55 2.69 -1.38 12.44 -0.04 -1.26 -4.98 135.00 141.92 2z3i n PRO 87 Ca 0.08 0.94 -0.29 0.00 -0.04 0.00 0.00 63.50 64.19 2z3i n PRO 87 Cb 0.45 -2.68 0.14 0.00 -0.04 0.00 0.00 33.50 31.37 2z3i n PRO 87 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2z3i h GLY 89 N -1.52 1.39 0.99 0.00 0.00 -1.98 -0.65 103.07 101.31 2z3i h GLY 89 Ca -0.51 -0.38 -0.00 0.00 0.00 0.00 0.00 47.33 46.44 2z3i h GLY 89 CO 0.59 0.19 0.24 -0.09 0.00 0.00 0.00 176.54 177.47 2z3i h ARG 90 N 0.92 0.52 -0.83 4.80 2.43 -2.00 -1.63 114.38 118.58 2z3i h ARG 90 Ca 0.44 -0.04 0.01 0.00 -0.81 0.00 0.00 59.98 59.58 2z3i h ARG 90 Cb 0.44 -0.11 -0.04 0.00 -0.42 0.00 0.00 29.97 29.84 2z3i h ARG 90 CO -0.20 0.38 0.55 0.00 -1.51 0.00 0.00 179.97 179.18 2z3i h ARG 92 N 1.11 1.02 -0.25 0.00 3.08 -0.83 0.41 114.38 118.92 2z3i h ARG 92 Ca 0.31 -0.10 -0.02 0.00 0.07 0.00 0.00 59.98 60.24 2z3i h ARG 92 Cb -0.10 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 29.73 2z3i h ARG 92 CO -0.08 0.73 0.09 0.37 -1.07 0.00 0.00 179.97 180.01 2z3i h GLN 93 N 1.02 0.39 -0.52 0.04 5.75 -0.82 -0.44 115.11 120.53 2z3i h GLN 93 Ca 0.27 -0.08 -0.05 0.00 -0.15 0.00 0.00 58.65 58.64 2z3i h GLN 93 Cb -0.02 -0.06 -0.02 0.00 1.07 0.00 0.00 27.48 28.45 2z3i h GLN 93 CO -0.05 0.45 0.13 0.28 -2.65 0.00 0.00 178.83 176.99 2z3i h VAL 94 N 0.25 1.24 -0.64 2.39 2.07 -1.03 -1.66 116.25 118.87 2z3i h VAL 94 Ca 0.08 -0.85 -0.04 0.00 0.82 0.00 0.00 66.70 66.71 2z3i h VAL 94 Cb 0.22 0.80 -0.03 0.00 -1.52 0.00 0.00 31.29 30.76 2z3i h VAL 94 CO -0.00 0.31 0.26 -0.07 0.02 0.00 0.00 177.57 178.09 2z3i h LEU 95 N 0.72 0.89 -0.81 2.57 3.38 -0.86 0.17 115.31 121.37 2z3i h LEU 95 Ca 0.16 -0.17 -0.05 0.00 0.09 0.00 0.00 57.88 57.91 2z3i h LEU 95 Cb 0.33 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.82 2z3i h LEU 95 CO 0.00 0.81 0.28 0.25 0.09 0.00 0.00 178.44 179.87 2z3i h LEU 96 N 0.91 1.08 -0.07 1.67 5.85 -0.84 0.92 115.31 124.82 2z3i h LEU 96 Ca 0.21 -0.18 -0.25 0.00 0.84 0.00 0.00 57.88 58.50 2z3i h LEU 96 Cb 0.20 -0.28 0.01 0.00 0.37 0.00 0.00 40.66 40.96 2z3i h LEU 96 CO -0.02 0.97 -1.02 0.44 -0.34 0.00 0.00 178.44 178.47 2z3i h ASP 97 N 1.12 0.69 0.00 1.25 3.32 -0.97 -3.19 116.42 118.64 2z3i h ASP 97 Ca 0.25 -0.57 -0.21 0.00 0.02 0.00 0.00 57.03 56.53 2z3i h ASP 97 Cb 0.26 -0.21 -0.04 0.00 0.22 0.00 0.00 39.33 39.55 2z3i h ASP 97 CO -0.02 1.37 -2.21 0.18 -1.72 0.00 0.00 179.24 176.85 2z3i n LEU 98 N -3.78 0.00 -3.19 1.55 4.77 0.58 -4.67 117.00 112.26 2z3i n LEU 98 Ca -0.09 0.00 -0.22 0.00 -0.03 0.00 0.00 56.01 55.67 2z3i n LEU 98 Cb 0.88 0.28 -0.06 0.00 -2.33 0.00 0.00 43.42 42.19 2z3i n LEU 98 CO 0.54 0.28 -0.26 1.41 -1.33 0.00 0.00 177.39 178.03 2z3i n HIS 99 N -2.53 -0.01 0.34 -1.77 8.25 0.31 -4.98 115.22 114.83 2z3i n HIS 99 Ca -0.20 -3.68 0.21 0.00 -0.26 0.00 0.00 57.72 53.79 2z3i n HIS 99 Cb 0.90 -0.38 1.13 0.00 1.12 0.00 0.00 29.99 32.75 2z3i n HIS 99 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 2z3i h PRO 100 N 3.62 0.00 -0.00 -0.41 0.13 -1.56 -0.14 132.00 133.64 2z3i h PRO 100 Ca 0.08 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.21 2z3i h PRO 100 Cb 0.90 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.03 2z3i h PRO 100 CO 0.49 0.00 -0.09 0.41 -0.23 0.00 0.00 178.00 178.58 2z3i n GLY 101 N -1.12 -0.84 3.81 1.56 0.00 -1.26 -4.74 105.19 102.60 2z3i n GLY 101 Ca -0.03 -0.28 -0.33 0.00 0.00 0.00 0.00 46.02 45.38 2z3i n GLY 101 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2z3i s ILE 102 N -2.38 4.06 0.05 -0.61 2.07 -0.06 -4.90 121.20 119.44 2z3i s ILE 102 Ca 0.32 1.11 0.05 0.00 -1.41 0.00 0.00 60.65 60.72 2z3i s ILE 102 Cb 0.20 -3.52 -0.04 0.00 0.13 0.00 0.00 42.46 39.24 2z3i s ILE 102 CO 0.45 -0.44 -0.08 -0.54 -1.91 0.00 0.00 174.94 172.42 2z3i s LYS 103 N -3.69 2.36 -0.05 3.50 1.02 -0.55 -1.86 119.74 120.48 2z3i s LYS 103 Ca 0.63 -0.86 0.03 0.00 0.02 0.00 0.00 55.97 55.79 2z3i s LYS 103 Cb -0.14 -2.41 -0.03 0.00 -0.52 0.00 0.00 37.83 34.74 2z3i s LYS 103 CO 0.27 0.56 -0.13 0.00 -0.92 0.00 0.00 175.35 175.12 2z3i s ALA 104 N -1.10 2.70 -0.19 5.17 0.00 0.11 -1.41 121.76 127.04 2z3i s ALA 104 Ca 0.19 -0.97 -0.23 0.00 0.00 0.00 0.00 51.96 50.95 2z3i s ALA 104 Cb -0.11 -0.99 -0.02 0.00 0.00 0.00 0.00 23.12 22.00 2z3i s ALA 104 CO 0.11 0.56 0.72 0.42 0.00 0.00 0.00 175.76 177.57 2z3i s ILE 105 N -0.75 4.95 0.26 0.00 1.01 -0.34 -0.86 121.20 125.48 2z3i s ILE 105 Ca 0.12 1.38 0.03 0.00 0.00 0.00 0.00 60.65 62.17 2z3i s ILE 105 Cb -0.11 -4.03 -0.05 0.00 0.01 0.00 0.00 42.46 38.28 2z3i s ILE 105 CO 0.01 0.06 0.04 0.68 0.00 0.00 0.00 174.94 175.72 2z3i s VAL 106 N 2.10 0.95 0.18 2.92 -7.23 0.08 -4.64 120.40 114.76 2z3i s VAL 106 Ca 0.33 -2.02 -0.27 0.00 -1.81 0.00 0.00 61.98 58.21 2z3i s VAL 106 Cb -0.16 -2.53 -0.08 0.00 0.56 0.00 0.00 36.38 34.17 2z3i s VAL 106 CO 0.11 -0.16 0.85 -0.54 -0.31 0.00 0.00 175.10 175.04 2z3i s LYS 107 N -3.91 4.68 0.33 4.82 1.02 -1.26 -0.34 119.74 125.08 2z3i s LYS 107 Ca 0.33 1.30 -0.03 0.00 0.02 0.00 0.00 55.97 57.58 2z3i s LYS 107 Cb 0.07 -3.28 0.07 0.00 -0.52 0.00 0.00 37.83 34.17 2z3i s LYS 107 CO 0.12 0.50 0.45 -0.40 -0.92 0.00 0.00 175.35 175.10 2z3i n ASP 108 N 1.74 0.31 -0.11 2.83 3.85 0.04 -4.87 116.55 120.34 2z3i n ASP 108 Ca -0.03 -1.33 0.14 0.00 -0.71 0.00 0.00 54.79 52.85 2z3i n ASP 108 Cb 0.48 -0.32 0.51 0.00 -1.35 0.00 0.00 41.12 40.44 2z3i n ASP 108 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.20 176.47 2z3i h SER 109 N -0.44 0.35 -0.26 -1.12 0.02 -1.98 0.08 113.55 110.20 2z3i h SER 109 Ca -0.15 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.81 2z3i h SER 109 Cb 0.47 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 62.96 2z3i h SER 109 CO 0.13 0.20 0.00 0.47 -1.14 0.00 0.00 176.83 176.49 2z3i n ASP 110 N -4.47 1.79 -0.19 3.07 9.92 -1.26 -4.90 116.55 120.52 2z3i n ASP 110 Ca 0.11 -1.85 -0.02 0.00 -0.53 0.00 0.00 54.79 52.50 2z3i n ASP 110 Cb 0.44 -0.17 -0.01 0.00 -0.64 0.00 0.00 41.12 40.74 2z3i n ASP 110 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2z3i n GLY 111 N 1.10 0.55 3.81 0.44 0.00 0.02 -5.04 105.19 106.07 2z3i n GLY 111 Ca 0.14 -0.97 -0.32 0.00 0.00 0.00 0.00 46.02 44.87 2z3i n GLY 111 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2z3i s GLN 112 N -2.28 3.09 0.24 1.61 -1.52 -1.26 -4.74 119.66 114.81 2z3i s GLN 112 Ca 0.00 -0.51 -0.31 0.00 -1.95 0.00 0.00 55.36 52.59 2z3i s GLN 112 Cb 0.00 -2.87 -0.11 0.00 -0.22 0.00 0.00 33.01 29.81 2z3i s GLN 112 CO 0.00 0.63 1.63 -2.14 -0.25 0.00 0.00 175.29 175.15 2z3i s PRO 113 N -1.99 4.14 -0.03 2.91 0.02 -1.26 -0.78 135.00 138.03 2z3i s PRO 113 Ca 0.26 2.54 -0.01 0.00 0.02 0.00 0.00 61.00 63.82 2z3i s PRO 113 Cb -0.12 -3.06 0.02 0.00 0.02 0.00 0.00 34.50 31.36 2z3i s PRO 113 CO 0.18 -0.66 0.05 -0.08 -0.33 0.00 0.00 177.00 176.16 2z3i s THR 114 N 0.55 -0.04 -0.17 0.99 -1.32 0.54 -4.55 115.64 111.64 2z3i s THR 114 Ca 0.68 0.15 -0.20 0.00 -1.21 0.00 0.00 61.69 61.11 2z3i s THR 114 Cb -0.48 -0.10 -0.03 0.00 -1.51 0.00 0.00 72.50 70.38 2z3i s THR 114 CO 0.40 0.06 0.58 0.00 -2.21 0.00 0.00 174.62 173.45 2z3i s ALA 115 N 0.81 3.51 0.04 11.08 0.00 -1.26 -0.74 121.76 135.19 2z3i s ALA 115 Ca -0.07 -0.25 0.07 0.00 0.00 0.00 0.00 51.96 51.71 2z3i s ALA 115 Cb -0.09 -2.87 -0.02 0.00 0.00 0.00 0.00 23.12 20.13 2z3i s ALA 115 CO -0.03 -0.38 -0.20 0.14 0.00 0.00 0.00 175.76 175.29 2z3i s VAL 116 N 1.49 1.59 0.41 0.00 -7.23 -0.04 -4.93 120.40 111.70 2z3i s VAL 116 Ca 0.28 -1.14 -0.26 0.00 -1.81 0.00 0.00 61.98 59.04 2z3i s VAL 116 Cb -0.16 -1.38 -0.09 0.00 0.56 0.00 0.00 36.38 35.31 2z3i s VAL 116 CO 0.11 0.20 1.41 -0.83 -0.31 0.00 0.00 175.10 175.68 2z3i s GLY 117 N -1.11 2.93 0.43 2.32 0.00 -1.26 -0.71 107.32 109.93 2z3i s GLY 117 Ca 0.07 1.43 0.10 0.00 0.00 0.00 0.00 44.72 46.32 2z3i s GLY 117 CO 0.01 2.06 2.05 1.19 0.00 0.00 0.00 173.10 178.41 2z3i h ILE 118 N 2.58 1.03 -0.07 0.90 6.09 -1.66 -1.85 117.51 124.53 2z3i h ILE 118 Ca -0.50 -0.15 -0.08 0.00 -1.37 0.00 0.00 64.86 62.75 2z3i h ILE 118 Cb 1.25 0.55 -0.01 0.00 0.47 0.00 0.00 36.82 39.08 2z3i h ILE 118 CO 0.63 0.08 -0.33 0.03 -3.07 0.00 0.00 178.15 175.49 2z3i h ARG 119 N 0.45 0.12 0.00 2.19 3.08 -1.87 -1.29 114.38 117.07 2z3i h ARG 119 Ca 0.17 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 60.17 2z3i h ARG 119 Cb 0.12 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.17 2z3i h ARG 119 CO -0.04 0.44 -0.04 0.93 -1.07 0.00 0.00 179.97 180.19 2z3i h GLU 120 N 0.11 0.00 0.00 0.04 5.08 -1.71 -2.73 114.58 115.38 2z3i h GLU 120 Ca 0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 2z3i h GLU 120 Cb 0.64 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.89 2z3i h GLU 120 CO 0.05 0.04 -0.64 1.28 -1.00 0.00 0.00 179.01 178.74 2z3i n LEU 121 N -3.73 0.61 -3.44 1.33 4.77 -0.50 -4.36 117.00 111.68 2z3i n LEU 121 Ca -0.03 0.12 -0.26 0.00 -0.03 0.00 0.00 56.01 55.81 2z3i n LEU 121 Cb 0.14 -0.20 -0.09 0.00 -2.33 0.00 0.00 43.42 40.94 2z3i n LEU 121 CO 0.28 0.02 -0.16 0.18 -1.33 0.00 0.00 177.39 176.38 2z3i n LEU 122 N -1.88 1.47 -4.76 2.23 4.77 -1.03 -5.06 117.00 112.73 2z3i n LEU 122 Ca 0.04 -4.90 -0.39 0.00 -0.03 0.00 0.00 56.01 50.73 2z3i n LEU 122 Cb 0.40 0.01 0.02 0.00 -2.33 0.00 0.00 43.42 41.52 2z3i n LEU 122 CO 0.36 1.95 1.01 -2.84 -1.33 0.00 0.00 177.39 176.55 2z3i s PRO 123 N -1.24 3.54 -1.32 3.23 0.02 -1.21 -2.69 135.00 135.33 2z3i s PRO 123 Ca 0.34 2.29 -0.05 0.00 0.02 0.00 0.00 61.00 63.60 2z3i s PRO 123 Cb 0.09 -2.52 -0.00 0.00 0.02 0.00 0.00 34.50 32.08 2z3i s PRO 123 CO -0.12 -0.89 0.57 0.45 -0.33 0.00 0.00 177.00 176.68 2z3i n SER 124 N -0.45 -1.63 -4.76 2.53 2.88 -1.26 -4.88 113.62 106.05 2z3i n SER 124 Ca 0.07 -0.96 -0.41 0.00 -1.33 0.00 0.00 58.87 56.24 2z3i n SER 124 Cb 0.43 -3.38 -0.03 0.00 -0.75 0.00 0.00 64.21 60.48 2z3i n SER 124 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2z3i s GLY 125 N -4.17 2.96 0.13 0.46 0.00 -1.10 -4.99 107.32 100.62 2z3i s GLY 125 Ca 0.11 1.05 -0.31 0.00 0.00 0.00 0.00 44.72 45.56 2z3i s GLY 125 CO 0.86 1.73 1.46 -0.47 0.00 0.00 0.00 173.10 176.68 2z3i s TYR 126 N -0.95 3.16 -0.36 1.90 5.04 -1.26 -4.98 117.35 119.90 2z3i s TYR 126 Ca 0.48 0.82 -0.07 0.00 -2.44 0.00 0.00 57.07 55.86 2z3i s TYR 126 Cb -0.35 -3.78 0.05 0.00 0.35 0.00 0.00 41.96 38.23 2z3i s TYR 126 CO 0.45 -2.81 0.14 0.08 -1.34 0.00 0.00 175.55 172.06 2z3i s VAL 127 N 1.14 3.82 -0.10 3.14 1.01 -1.26 -5.02 120.40 123.13 2z3i s VAL 127 Ca 0.67 -1.24 -0.30 0.00 0.00 0.00 0.00 61.98 61.12 2z3i s VAL 127 Cb -0.40 -3.22 -0.03 0.00 0.00 0.00 0.00 36.38 32.73 2z3i s VAL 127 CO 0.31 -0.26 1.41 0.86 0.00 0.00 0.00 175.10 177.41 2z3i s TRP 128 N 1.39 2.57 -1.19 5.22 -0.00 -1.26 -2.70 118.94 122.96 2z3i s TRP 128 Ca -0.00 0.71 -0.06 0.00 -0.00 0.00 0.00 56.10 56.75 2z3i s TRP 128 Cb -0.20 -3.66 -0.02 0.00 -0.00 0.00 0.00 33.47 29.59 2z3i s TRP 128 CO 0.02 -2.51 0.82 -1.91 -0.00 0.00 0.00 176.95 173.37 2z3i n GLU 129 N 6.57 -3.69 0.00 5.86 4.07 -1.26 -5.14 120.64 127.05 2z3i n GLU 129 Ca 0.15 0.69 0.03 0.00 -0.06 0.00 0.00 57.16 57.96 2z3i n GLU 129 Cb 0.44 -5.23 0.03 0.00 -0.06 0.00 0.00 31.44 26.61 2z3i n GLU 129 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48