#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2crq n SER 2 N 0.00 -1.02 -4.69 1.61 7.64 -1.26 -4.89 113.62 111.01 2crq n SER 2 Ca 0.00 -1.15 -0.29 0.00 1.01 0.00 0.00 58.87 58.44 2crq n SER 2 Cb 0.00 -1.47 -0.09 0.00 -1.01 0.00 0.00 64.21 61.65 2crq n SER 2 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2crq s SER 3 N -3.38 4.08 -0.31 6.43 0.01 -1.26 -5.06 113.70 114.21 2crq s SER 3 Ca 0.57 -1.40 -0.07 0.00 1.31 0.00 0.00 55.95 56.37 2crq s SER 3 Cb -0.33 -0.11 0.24 0.00 0.21 0.00 0.00 66.02 66.03 2crq s SER 3 CO 0.94 -0.61 1.21 0.61 0.41 0.00 0.00 173.24 175.79 2crq n GLY 4 N -1.14 -1.90 2.81 3.44 0.00 -1.26 -4.98 105.19 102.17 2crq n GLY 4 Ca -0.08 1.28 -0.15 0.00 0.00 0.00 0.00 46.02 47.07 2crq n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2crq n SER 5 N 2.11 -4.33 -3.65 1.61 2.88 -1.26 -5.01 113.62 105.97 2crq n SER 5 Ca 0.06 -0.36 -0.05 0.00 -1.33 0.00 0.00 58.87 57.19 2crq n SER 5 Cb 0.68 -3.47 -0.02 0.00 -0.75 0.00 0.00 64.21 60.66 2crq n SER 5 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2crq s SER 6 N -3.34 -0.24 0.06 -3.46 0.01 -1.26 -5.18 113.70 100.29 2crq s SER 6 Ca 0.31 -0.23 0.07 0.00 1.31 0.00 0.00 55.95 57.41 2crq s SER 6 Cb -0.14 0.43 -0.03 0.00 0.21 0.00 0.00 66.02 66.49 2crq s SER 6 CO 0.48 -0.76 -0.17 -0.83 0.41 0.00 0.00 173.24 172.37 2crq s GLY 7 N -2.76 1.63 -0.45 3.44 0.00 -1.26 -4.96 107.32 102.96 2crq s GLY 7 Ca 0.10 -1.21 -0.28 0.00 0.00 0.00 0.00 44.72 43.32 2crq s GLY 7 CO -0.02 -1.13 1.76 2.56 0.00 0.00 0.00 173.10 176.27 2crq s PRO 8 N -1.64 3.11 -0.68 2.90 0.04 -1.26 -4.95 135.00 132.53 2crq s PRO 8 Ca 0.16 1.05 -0.08 0.00 0.04 0.00 0.00 61.00 62.16 2crq s PRO 8 Cb -0.11 -4.24 0.18 0.00 0.04 0.00 0.00 34.50 30.37 2crq s PRO 8 CO 0.07 -2.13 0.55 0.15 0.04 0.00 0.00 177.00 175.68 2crq s LYS 9 N 6.05 2.96 0.30 4.56 -0.14 -1.26 -4.94 119.74 127.28 2crq s LYS 9 Ca 0.72 -2.37 0.11 0.00 -1.36 0.00 0.00 55.97 53.08 2crq s LYS 9 Cb -0.17 -4.04 0.96 0.00 -1.68 0.00 0.00 37.83 32.89 2crq s LYS 9 CO 0.29 -1.23 1.35 0.25 -0.76 0.00 0.00 175.35 175.25 2crq n THR 10 N 3.93 -0.36 -3.30 2.17 -2.24 -1.26 -4.86 114.28 108.36 2crq n THR 10 Ca 0.07 1.80 0.05 0.00 -2.27 0.00 0.00 64.05 63.71 2crq n THR 10 Cb 0.42 -2.80 -0.01 0.00 -2.10 0.00 0.00 70.33 65.83 2crq n THR 10 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2crq n GLY 11 N -1.31 -1.55 3.69 3.38 0.00 -1.26 -4.87 105.19 103.27 2crq n GLY 11 Ca 0.28 -1.17 -0.29 0.00 0.00 0.00 0.00 46.02 44.83 2crq n GLY 11 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2crq s PRO 12 N -0.72 0.78 0.27 1.61 0.04 -1.26 -4.99 135.00 130.73 2crq s PRO 12 Ca 0.00 0.65 -0.29 0.00 0.04 0.00 0.00 61.00 61.39 2crq s PRO 12 Cb 0.00 -1.77 -0.09 0.00 0.04 0.00 0.00 34.50 32.68 2crq s PRO 12 CO 0.00 -2.53 1.22 0.99 0.04 0.00 0.00 177.00 176.72 2crq s THR 13 N -2.95 3.20 -0.03 1.26 2.01 -1.26 -5.04 115.64 112.83 2crq s THR 13 Ca 0.64 1.13 -0.01 0.00 0.31 0.00 0.00 61.69 63.76 2crq s THR 13 Cb -0.18 -3.72 0.03 0.00 0.01 0.00 0.00 72.50 68.64 2crq s THR 13 CO 0.57 0.24 0.05 0.00 -0.69 0.00 0.00 174.62 174.79 2crq s MET 14 N -1.12 -0.05 -0.05 4.92 0.23 -1.26 -5.14 119.30 116.82 2crq s MET 14 Ca 0.49 0.30 0.03 0.00 -1.03 0.00 0.00 55.69 55.49 2crq s MET 14 Cb -0.35 -0.37 0.00 0.00 -1.53 0.00 0.00 34.83 32.58 2crq s MET 14 CO 0.44 -0.25 -0.14 0.99 -2.03 0.00 0.00 175.02 174.02 2crq s THR 15 N 1.65 1.23 0.24 3.16 2.01 -1.26 -4.50 115.64 118.18 2crq s THR 15 Ca -0.02 -0.58 -0.02 0.00 0.31 0.00 0.00 61.69 61.38 2crq s THR 15 Cb -0.12 -1.08 -0.04 0.00 0.01 0.00 0.00 72.50 71.26 2crq s THR 15 CO -0.03 0.37 0.45 -0.54 -0.69 0.00 0.00 174.62 174.18 2crq s LYS 16 N 0.26 3.55 0.01 4.92 -0.14 0.79 -5.00 119.74 124.13 2crq s LYS 16 Ca -0.07 -0.25 -0.01 0.00 -1.36 0.00 0.00 55.97 54.28 2crq s LYS 16 Cb -0.12 -2.77 -0.01 0.00 -1.68 0.00 0.00 37.83 33.25 2crq s LYS 16 CO 0.02 0.32 0.00 -1.21 -0.76 0.00 0.00 175.35 173.73 2crq s GLU 17 N -3.49 0.27 -0.03 1.68 2.02 -1.26 -0.58 118.70 117.31 2crq s GLU 17 Ca 0.40 -0.45 -0.00 0.00 0.02 0.00 0.00 54.97 54.94 2crq s GLU 17 Cb -0.11 0.10 0.03 0.00 0.10 0.00 0.00 34.13 34.25 2crq s GLU 17 CO 0.30 -0.05 0.03 -1.17 0.02 0.00 0.00 175.26 174.39 2crq s LEU 18 N -1.13 0.83 -0.05 1.80 2.96 -0.02 -4.90 118.68 118.17 2crq s LEU 18 Ca -0.12 0.02 0.05 0.00 -0.22 0.00 0.00 54.13 53.86 2crq s LEU 18 Cb -0.08 -0.16 -0.00 0.00 0.50 0.00 0.00 46.19 46.45 2crq s LEU 18 CO -0.00 -0.16 -0.19 -0.69 -1.32 0.00 0.00 176.35 173.99 2crq s VAL 19 N 1.40 1.58 -0.24 1.68 1.01 -1.26 -0.85 120.40 123.72 2crq s VAL 19 Ca -0.05 -0.80 -0.27 0.00 0.00 0.00 0.00 61.98 60.87 2crq s VAL 19 Cb -0.13 -1.35 0.13 0.00 0.00 0.00 0.00 36.38 35.02 2crq s VAL 19 CO -0.03 0.45 1.03 0.72 0.00 0.00 0.00 175.10 177.27 2crq s PHE 20 N 0.01 -0.43 0.41 5.22 -0.12 -1.19 -5.02 117.98 116.87 2crq s PHE 20 Ca -0.04 0.94 -0.25 0.00 -0.05 0.00 0.00 56.93 57.53 2crq s PHE 20 Cb -0.12 0.40 -0.08 0.00 -0.63 0.00 0.00 43.02 42.58 2crq s PHE 20 CO 0.03 -0.27 1.18 -1.54 -0.05 0.00 0.00 175.22 174.57 2crq s SER 21 N -0.28 6.42 0.55 1.98 1.04 -1.26 -3.54 113.70 118.61 2crq s SER 21 Ca 0.01 2.37 0.25 0.00 0.48 0.00 0.00 55.95 59.07 2crq s SER 21 Cb -0.03 -2.61 1.56 0.00 0.10 0.00 0.00 66.02 65.03 2crq s SER 21 CO -0.03 -0.75 2.16 0.77 0.98 0.00 0.00 173.24 176.37 2crq h SER 22 N 2.52 0.00 -0.95 7.02 4.64 -1.94 -2.21 113.55 122.64 2crq h SER 22 Ca -0.49 0.00 0.27 0.00 -0.47 0.00 0.00 61.79 61.11 2crq h SER 22 Cb 1.24 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.29 2crq h SER 22 CO 0.62 0.05 0.71 -1.13 -0.87 0.00 0.00 176.83 176.22 2crq h ASN 23 N 0.00 0.00 -0.77 4.97 -1.24 -1.91 -3.43 115.58 113.20 2crq h ASN 23 Ca -0.00 0.00 -0.53 0.00 0.71 0.00 0.00 56.30 56.48 2crq h ASN 23 Cb 0.13 0.00 0.08 0.00 0.73 0.00 0.00 38.32 39.26 2crq h ASN 23 CO 0.01 0.00 -0.38 0.00 -1.29 0.00 0.00 177.43 175.77 2crq n ILE 24 N -4.14 1.44 -2.22 2.57 3.06 -0.83 -4.93 119.36 114.31 2crq n ILE 24 Ca 0.20 -0.36 -0.27 0.00 -2.50 0.00 0.00 62.75 59.82 2crq n ILE 24 Cb 1.04 0.00 0.16 0.00 0.54 0.00 0.00 39.64 41.38 2crq n ILE 24 CO 0.00 0.00 0.00 -0.83 -2.50 0.00 0.00 176.55 173.22 2crq s GLY 25 N -0.72 1.78 0.05 4.50 0.00 -1.26 -4.83 107.32 106.83 2crq s GLY 25 Ca 0.51 -1.49 -0.20 0.00 0.00 0.00 0.00 44.72 43.54 2crq s GLY 25 CO 0.43 -0.77 1.36 -1.61 0.00 0.00 0.00 173.10 172.51 2crq h GLN 26 N -1.23 0.39 -0.53 2.90 5.75 -1.98 0.08 115.11 120.49 2crq h GLN 26 Ca -0.40 -0.20 0.06 0.00 -0.15 0.00 0.00 58.65 57.95 2crq h GLN 26 Cb 1.24 0.01 -0.05 0.00 1.07 0.00 0.00 27.48 29.74 2crq h GLN 26 CO 0.37 0.76 0.24 0.45 -2.65 0.00 0.00 178.83 177.99 2crq h HIS 27 N 0.03 0.44 0.42 3.99 3.86 -2.00 -1.03 115.15 120.86 2crq h HIS 27 Ca 0.03 0.02 -0.02 0.00 -1.16 0.00 0.00 60.37 59.24 2crq h HIS 27 Cb 0.68 -0.12 0.00 0.00 1.06 0.00 0.00 27.41 29.04 2crq h HIS 27 CO 0.08 0.18 -0.20 -0.44 0.86 0.00 0.00 177.93 178.41 2crq h ASP 28 N 0.46 -0.48 -1.35 2.45 5.19 -1.94 -3.18 116.42 117.57 2crq h ASP 28 Ca 0.25 0.02 0.39 0.00 -0.62 0.00 0.00 57.03 57.07 2crq h ASP 28 Cb 0.21 0.12 -0.05 0.00 0.18 0.00 0.00 39.33 39.79 2crq h ASP 28 CO -0.20 -0.08 1.09 0.25 -3.12 0.00 0.00 179.24 177.17 2crq h LEU 29 N -1.08 0.00 -0.54 1.55 5.85 -0.94 0.44 115.31 120.61 2crq h LEU 29 Ca -0.06 0.00 0.06 0.00 0.84 0.00 0.00 57.88 58.72 2crq h LEU 29 Cb 0.43 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.41 2crq h LEU 29 CO 0.09 0.00 0.24 -0.78 -0.34 0.00 0.00 178.44 177.66 2crq h ASP 30 N 0.00 0.31 0.09 1.25 3.58 -1.16 -2.17 116.42 118.33 2crq h ASP 30 Ca 0.64 0.04 -0.18 0.00 0.42 0.00 0.00 57.03 57.95 2crq h ASP 30 Cb 2.81 -0.01 -0.00 0.00 1.72 0.00 0.00 39.33 43.85 2crq h ASP 30 CO -0.01 0.21 -0.68 0.74 -2.88 0.00 0.00 179.24 176.63 2crq h THR 31 N 0.46 1.34 -0.85 2.25 2.02 -0.23 -3.19 112.91 114.72 2crq h THR 31 Ca 0.25 -1.99 0.15 0.00 0.77 0.00 0.00 66.41 65.59 2crq h THR 31 Cb 0.21 1.97 -0.10 0.00 -1.74 0.00 0.00 68.15 68.49 2crq h THR 31 CO -0.21 0.61 0.43 0.11 0.37 0.00 0.00 175.52 176.83 2crq h LYS 32 N 0.38 0.59 -0.23 6.66 1.79 -1.18 0.82 116.57 125.40 2crq h LYS 32 Ca -0.02 -0.04 -0.09 0.00 -2.18 0.00 0.00 60.65 58.33 2crq h LYS 32 Cb 1.25 -0.13 -0.01 0.00 -1.58 0.00 0.00 32.23 31.76 2crq h LYS 32 CO 0.12 0.39 -0.23 0.77 -1.08 0.00 0.00 179.45 179.42 2crq h SER 33 N 0.60 0.42 0.28 0.86 0.02 -1.44 -3.14 113.55 111.15 2crq h SER 33 Ca 0.46 -0.13 0.00 0.00 -0.84 0.00 0.00 61.79 61.28 2crq h SER 33 Cb 0.67 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 63.07 2crq h SER 33 CO -0.37 0.66 -0.28 0.11 -1.14 0.00 0.00 176.83 175.81 2crq h LYS 34 N 0.38 -0.57 -0.85 3.45 1.79 -0.85 0.11 116.57 120.03 2crq h LYS 34 Ca 0.06 0.04 0.17 0.00 -2.18 0.00 0.00 60.65 58.74 2crq h LYS 34 Cb 0.61 0.13 -0.11 0.00 -1.58 0.00 0.00 32.23 31.29 2crq h LYS 34 CO 0.04 -0.38 0.40 0.37 -1.08 0.00 0.00 179.45 178.80 2crq h GLN 35 N -0.60 0.49 -0.39 3.15 5.75 -1.44 -0.41 115.11 121.67 2crq h GLN 35 Ca -0.01 -0.03 -0.09 0.00 -0.15 0.00 0.00 58.65 58.37 2crq h GLN 35 Cb 0.55 -0.11 -0.01 0.00 1.07 0.00 0.00 27.48 28.98 2crq h GLN 35 CO -0.06 0.33 -0.12 0.82 -2.65 0.00 0.00 178.83 177.14 2crq h ILE 36 N 0.51 1.28 -0.76 2.39 2.04 -1.41 -2.87 117.51 118.69 2crq h ILE 36 Ca 0.49 -1.21 0.19 0.00 1.00 0.00 0.00 64.86 65.33 2crq h ILE 36 Cb 0.81 1.26 -0.04 0.00 -0.74 0.00 0.00 36.82 38.10 2crq h ILE 36 CO -0.43 0.40 0.53 -0.61 0.00 0.00 0.00 178.15 178.04 2crq h GLN 37 N 0.57 0.19 0.11 2.37 4.15 0.92 -0.57 115.11 122.85 2crq h GLN 37 Ca 0.10 -0.01 -0.01 0.00 0.77 0.00 0.00 58.65 59.50 2crq h GLN 37 Cb 0.65 -0.04 0.00 0.00 0.21 0.00 0.00 27.48 28.29 2crq h GLN 37 CO 0.04 0.13 -0.05 1.96 -1.93 0.00 0.00 178.83 178.98 2crq h GLN 38 N 0.20 -0.15 -0.31 1.69 1.08 -1.20 -2.97 115.11 113.45 2crq h GLN 38 Ca 0.37 0.01 0.03 0.00 -1.45 0.00 0.00 58.65 57.62 2crq h GLN 38 Cb 1.18 0.03 -0.03 0.00 -0.05 0.00 0.00 27.48 28.61 2crq h GLN 38 CO -0.07 0.29 0.11 -1.49 -0.95 0.00 0.00 178.83 176.72 2crq h TRP 39 N -0.65 0.20 -0.59 2.96 6.55 -1.24 -2.57 115.95 120.61 2crq h TRP 39 Ca -0.02 0.02 0.12 0.00 0.95 0.00 0.00 58.89 59.96 2crq h TRP 39 Cb 0.50 -0.05 -0.10 0.00 -0.86 0.00 0.00 29.16 28.66 2crq h TRP 39 CO 0.08 0.09 -0.02 0.82 -1.05 0.00 0.00 178.44 178.36 2crq h ILE 40 N 0.25 0.50 -0.86 1.49 1.08 -1.21 -0.12 117.51 118.65 2crq h ILE 40 Ca 0.14 -0.04 0.22 0.00 -0.39 0.00 0.00 64.86 64.79 2crq h ILE 40 Cb 0.10 0.39 -0.13 0.00 -3.07 0.00 0.00 36.82 34.11 2crq h ILE 40 CO -0.14 0.02 0.28 -0.33 -0.69 0.00 0.00 178.15 177.30 2crq h GLU 41 N 0.10 0.28 -0.99 2.37 4.39 -1.28 0.79 114.58 120.24 2crq h GLU 41 Ca 0.31 -0.02 -0.12 0.00 0.34 0.00 0.00 59.36 59.87 2crq h GLU 41 Cb 0.49 -0.06 -0.07 0.00 -0.10 0.00 0.00 28.75 29.00 2crq h GLU 41 CO -0.52 0.19 0.15 1.63 -1.16 0.00 0.00 179.01 179.30 2crq n LYS 42 N -5.15 1.37 -4.21 2.33 5.02 -0.10 -4.84 118.16 112.58 2crq n LYS 42 Ca 0.20 -0.76 -0.30 0.00 -2.02 0.00 0.00 58.31 55.43 2crq n LYS 42 Cb 0.63 -1.33 -0.07 0.00 -0.02 0.00 0.00 35.03 34.24 2crq n LYS 42 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2crq n LYS 43 N 0.09 -1.52 -3.78 1.97 4.76 0.27 -4.91 118.16 115.05 2crq n LYS 43 Ca 0.14 0.17 -0.37 0.00 -2.87 0.00 0.00 58.31 55.39 2crq n LYS 43 Cb 0.77 -3.79 -0.13 0.00 -1.84 0.00 0.00 35.03 30.05 2crq n LYS 43 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 2crq s TYR 44 N -4.23 3.11 -0.06 2.13 2.02 -0.95 -5.02 117.35 114.35 2crq s TYR 44 Ca 0.03 -0.84 -0.33 0.00 -0.37 0.00 0.00 57.07 55.56 2crq s TYR 44 Cb -0.01 -2.23 -0.10 0.00 -0.40 0.00 0.00 41.96 39.21 2crq s TYR 44 CO 0.97 -0.52 1.94 0.72 -1.57 0.00 0.00 175.55 177.09 2crq n HIS 45 N 4.87 2.36 -3.91 2.71 8.25 -1.26 -4.23 115.22 124.02 2crq n HIS 45 Ca -0.15 -0.14 -0.35 0.00 -0.26 0.00 0.00 57.72 56.82 2crq n HIS 45 Cb 0.49 -2.72 -0.14 0.00 1.12 0.00 0.00 29.99 28.75 2crq n HIS 45 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2crq s VAL 46 N 4.50 3.08 -0.37 1.59 1.01 -1.24 -0.15 120.40 128.83 2crq s VAL 46 Ca 0.92 -1.12 -0.17 0.00 0.00 0.00 0.00 61.98 61.61 2crq s VAL 46 Cb -0.59 -2.65 0.00 0.00 0.00 0.00 0.00 36.38 33.14 2crq s VAL 46 CO 0.48 0.06 0.47 -1.58 0.00 0.00 0.00 175.10 174.52 2crq s GLN 47 N 1.32 3.47 -0.12 2.72 0.74 0.25 -2.02 119.66 126.03 2crq s GLN 47 Ca -0.02 -0.37 -0.10 0.00 0.05 0.00 0.00 55.36 54.92 2crq s GLN 47 Cb -0.18 -3.85 -0.05 0.00 1.10 0.00 0.00 33.01 30.03 2crq s GLN 47 CO -0.02 -0.69 0.21 0.08 -0.55 0.00 0.00 175.29 174.33 2crq s VAL 48 N 2.28 5.37 -0.17 1.34 1.01 0.02 -0.84 120.40 129.42 2crq s VAL 48 Ca 0.16 0.38 -0.01 0.00 0.00 0.00 0.00 61.98 62.51 2crq s VAL 48 Cb -0.16 -3.51 0.04 0.00 0.00 0.00 0.00 36.38 32.76 2crq s VAL 48 CO 0.13 0.54 -0.04 -0.89 0.00 0.00 0.00 175.10 174.85 2crq s THR 49 N -0.54 1.03 -0.15 3.92 2.01 -0.03 -1.88 115.64 119.99 2crq s THR 49 Ca 0.16 -0.63 -0.11 0.00 0.31 0.00 0.00 61.69 61.41 2crq s THR 49 Cb -0.13 -1.26 -0.05 0.00 0.01 0.00 0.00 72.50 71.08 2crq s THR 49 CO 0.05 0.07 0.21 -0.63 -0.69 0.00 0.00 174.62 173.63 2crq s ILE 50 N 1.66 5.36 -0.39 1.82 1.01 -0.87 -3.16 121.20 126.63 2crq s ILE 50 Ca 0.00 0.37 -0.01 0.00 0.00 0.00 0.00 60.65 61.01 2crq s ILE 50 Cb -0.16 -3.53 0.11 0.00 0.01 0.00 0.00 42.46 38.89 2crq s ILE 50 CO -0.07 0.47 0.16 -0.54 0.00 0.00 0.00 174.94 174.96 2crq s LYS 51 N 0.00 1.86 0.57 2.79 1.02 -1.23 -2.33 119.74 122.42 2crq s LYS 51 Ca 0.14 -1.86 -0.19 0.00 0.02 0.00 0.00 55.97 54.08 2crq s LYS 51 Cb -0.12 -3.48 -0.05 0.00 -0.52 0.00 0.00 37.83 33.66 2crq s LYS 51 CO 0.02 -1.04 1.15 1.03 -0.92 0.00 0.00 175.35 175.59 2crq s ARG 52 N 1.04 3.19 0.82 1.68 1.81 -0.69 -3.76 118.95 123.05 2crq s ARG 52 Ca 0.09 1.64 -0.12 0.00 -1.72 0.00 0.00 55.73 55.63 2crq s ARG 52 Cb -0.22 -1.98 0.08 0.00 -0.45 0.00 0.00 34.95 32.39 2crq s ARG 52 CO -0.05 -0.99 1.14 -0.98 -0.68 0.00 0.00 175.30 173.74 2crq s ARG 53 N -3.39 1.89 0.00 3.54 1.70 -1.26 -4.91 118.95 116.52 2crq s ARG 53 Ca 0.73 0.31 0.26 0.00 -0.47 0.00 0.00 55.73 56.56 2crq s ARG 53 Cb -0.25 -1.92 0.68 0.00 -0.57 0.00 0.00 34.95 32.89 2crq s ARG 53 CO 0.30 -1.69 1.52 0.36 -1.08 0.00 0.00 175.30 174.71 2crq n LYS 54 N -3.42 0.59 -2.04 3.89 2.85 -1.26 -4.20 118.16 114.57 2crq n LYS 54 Ca 0.07 -0.34 -0.39 0.00 -1.05 0.00 0.00 58.31 56.59 2crq n LYS 54 Cb 0.59 -1.49 0.04 0.00 -0.65 0.00 0.00 35.03 33.51 2crq n LYS 54 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 2crq n ASP 55 N -0.91 7.35 -3.56 -5.58 9.92 -1.26 -4.93 116.55 117.59 2crq n ASP 55 Ca 0.10 -3.82 -0.08 0.00 -0.53 0.00 0.00 54.79 50.46 2crq n ASP 55 Cb 0.34 -1.05 -0.04 0.00 -0.64 0.00 0.00 41.12 39.74 2crq n ASP 55 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2crq s ALA 56 N -4.08 -1.93 -0.17 2.24 0.00 -1.26 -5.03 121.76 111.54 2crq s ALA 56 Ca 0.50 1.42 -0.01 0.00 0.00 0.00 0.00 51.96 53.87 2crq s ALA 56 Cb 0.41 -0.29 0.07 0.00 0.00 0.00 0.00 23.12 23.30 2crq s ALA 56 CO -0.37 -0.48 2.22 -0.85 0.00 0.00 0.00 175.76 176.28 2crq n GLU 57 N 0.26 1.53 -1.22 0.00 0.28 -1.26 -4.97 120.64 115.26 2crq n GLU 57 Ca -0.07 -0.92 -0.38 0.00 -0.16 0.00 0.00 57.16 55.62 2crq n GLU 57 Cb 0.59 -1.44 0.02 0.00 1.43 0.00 0.00 31.44 32.05 2crq n GLU 57 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2crq n GLN 58 N 1.07 0.05 -3.75 3.44 0.00 -1.26 -5.00 117.38 111.93 2crq n GLN 58 Ca 0.20 0.02 -0.14 0.00 0.00 0.00 0.00 57.00 57.09 2crq n GLN 58 Cb 0.58 -1.10 -0.09 0.00 0.00 0.00 0.00 30.24 29.63 2crq n GLN 58 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 2crq s SER 59 N -1.04 -0.24 0.59 2.61 0.15 -1.26 -5.00 113.70 109.51 2crq s SER 59 Ca 0.55 0.19 0.29 0.00 0.70 0.00 0.00 55.95 57.68 2crq s SER 59 Cb -0.43 0.37 1.55 0.00 -1.71 0.00 0.00 66.02 65.80 2crq s SER 59 CO 0.68 -0.42 1.97 -0.33 1.20 0.00 0.00 173.24 176.34 2crq h GLU 60 N 4.02 0.00 0.00 5.44 5.08 -1.95 0.37 114.58 127.54 2crq h GLU 60 Ca -0.29 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 57.92 2crq h GLU 60 Cb 1.18 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.40 2crq h GLU 60 CO 0.39 0.00 -1.16 0.93 -1.00 0.00 0.00 179.01 178.16 2crq h GLU 61 N 0.00 0.00 0.04 2.33 5.08 -1.97 -3.36 114.58 116.70 2crq h GLU 61 Ca 0.16 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.52 2crq h GLU 61 Cb 0.90 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.15 2crq h GLU 61 CO -0.00 0.36 -0.02 0.93 -1.00 0.00 0.00 179.01 179.28 2crq h GLU 62 N 0.00 -0.05 -0.73 2.33 4.39 -0.76 -3.29 114.58 116.47 2crq h GLU 62 Ca -0.12 0.00 0.21 0.00 0.34 0.00 0.00 59.36 59.80 2crq h GLU 62 Cb 1.53 0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 30.17 2crq h GLU 62 CO 0.05 0.05 1.08 1.15 -1.16 0.00 0.00 179.01 180.19 2crq h THR 63 N -1.01 0.03 -0.45 1.13 2.02 -1.23 0.85 112.91 114.26 2crq h THR 63 Ca -0.01 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.15 2crq h THR 63 Cb 0.12 0.08 -0.02 0.00 -1.74 0.00 0.00 68.15 66.59 2crq h THR 63 CO 0.01 0.00 0.17 -0.33 0.37 0.00 0.00 175.52 175.74 2crq h GLU 64 N 0.00 0.67 -0.93 6.66 5.08 -1.71 -2.88 114.58 121.47 2crq h GLU 64 Ca 0.35 -0.12 0.36 0.00 -1.00 0.00 0.00 59.36 58.94 2crq h GLU 64 Cb 2.51 -0.11 -0.17 0.00 0.50 0.00 0.00 28.75 31.48 2crq h GLU 64 CO -0.00 0.62 0.38 -0.85 -1.00 0.00 0.00 179.01 178.15 2crq n GLU 65 N -4.60 -0.06 0.13 2.33 0.28 0.29 0.35 120.64 119.37 2crq n GLU 65 Ca 0.01 1.32 -0.13 0.00 -0.16 0.00 0.00 57.16 58.19 2crq n GLU 65 Cb 0.15 -2.29 -0.08 0.00 1.43 0.00 0.00 31.44 30.65 2crq n GLU 65 CO 0.00 0.00 0.00 0.82 -0.16 0.00 0.00 177.13 177.79 2crq h ILE 66 N 0.00 0.81 -0.96 3.84 1.08 -1.66 -2.62 117.51 118.00 2crq h ILE 66 Ca 0.73 -0.52 0.23 0.00 -0.39 0.00 0.00 64.86 64.92 2crq h ILE 66 Cb 1.86 1.10 -0.12 0.00 -3.07 0.00 0.00 36.82 36.58 2crq h ILE 66 CO -0.76 0.11 0.53 -0.26 -0.69 0.00 0.00 178.15 177.07 2crq h PHE 67 N -0.61 0.90 -0.27 1.37 0.04 -0.16 0.35 116.94 118.56 2crq h PHE 67 Ca -0.03 0.04 -0.01 0.00 2.80 0.00 0.00 57.97 60.76 2crq h PHE 67 Cb 0.44 -0.25 -0.01 0.00 2.20 0.00 0.00 35.95 38.33 2crq h PHE 67 CO 0.01 0.05 0.11 -0.91 -0.60 0.00 0.00 178.31 176.97 2crq h ASN 68 N 0.54 0.37 -0.88 2.17 2.35 -1.19 -2.66 115.58 116.29 2crq h ASN 68 Ca 0.61 -0.16 0.21 0.00 -0.55 0.00 0.00 56.30 56.40 2crq h ASN 68 Cb 1.13 -0.10 -0.12 0.00 0.05 0.00 0.00 38.32 39.28 2crq h ASN 68 CO -0.48 0.43 0.38 1.56 -1.65 0.00 0.00 177.43 177.67 2crq h GLN 69 N 0.28 0.40 -0.26 0.81 4.20 -0.55 0.43 115.11 120.42 2crq h GLN 69 Ca 0.09 -0.02 -0.10 0.00 0.06 0.00 0.00 58.65 58.67 2crq h GLN 69 Cb 0.17 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 27.85 2crq h GLN 69 CO -0.01 0.26 -0.27 0.82 -0.67 0.00 0.00 178.83 178.96 2crq h ILE 70 N 0.41 1.27 0.00 2.54 2.04 -1.24 -2.59 117.51 119.94 2crq h ILE 70 Ca 0.54 -1.33 0.00 0.00 1.00 0.00 0.00 64.86 65.07 2crq h ILE 70 Cb 0.99 1.37 0.00 0.00 -0.74 0.00 0.00 36.82 38.44 2crq h ILE 70 CO -0.51 0.42 0.00 0.25 0.00 0.00 0.00 178.15 178.31 2crq h LEU 71 N 0.46 0.00 0.00 1.44 5.85 -0.09 -3.04 115.31 119.93 2crq h LEU 71 Ca 0.06 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.78 2crq h LEU 71 Cb 0.71 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.74 2crq h LEU 71 CO 0.05 0.00 0.00 0.00 -0.34 0.00 0.00 178.44 178.15 2crq n GLN 72 N -3.02 0.22 -0.03 1.25 6.02 0.11 -1.29 117.38 120.64 2crq n GLN 72 Ca 0.03 0.13 0.02 0.00 -0.01 0.00 0.00 57.00 57.17 2crq n GLN 72 Cb 0.47 -1.50 -0.12 0.00 1.02 0.00 0.00 30.24 30.11 2crq n GLN 72 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 2crq n THR 73 N -1.31 0.42 -2.41 5.09 -2.24 -1.15 -4.59 114.28 108.09 2crq n THR 73 Ca 0.08 -0.46 -0.16 0.00 -2.27 0.00 0.00 64.05 61.24 2crq n THR 73 Cb 0.15 -0.18 0.03 0.00 -2.10 0.00 0.00 70.33 68.23 2crq n THR 73 CO 0.00 0.00 0.00 1.15 -0.57 0.00 0.00 175.07 175.65 2crq n MET 74 N -2.25 2.75 0.00 -0.78 0.00 -1.02 -4.83 117.12 110.99 2crq n MET 74 Ca -0.12 -3.92 0.07 0.00 0.00 0.00 0.00 57.70 53.74 2crq n MET 74 Cb 0.64 -1.96 0.38 0.00 0.00 0.00 0.00 33.22 32.29 2crq n MET 74 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 175.97 175.62 2crq n PRO 75 N -0.57 0.24 0.00 3.17 -0.04 -0.41 0.66 135.00 138.04 2crq n PRO 75 Ca 0.28 0.13 0.00 0.00 -0.04 0.00 0.00 63.50 63.87 2crq n PRO 75 Cb 0.85 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.81 2crq n PRO 75 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2crq n ASP 76 N -1.25 0.40 -0.02 3.54 8.00 -1.26 -4.75 116.55 121.20 2crq n ASP 76 Ca 0.08 -0.30 0.01 0.00 0.71 0.00 0.00 54.79 55.29 2crq n ASP 76 Cb 0.11 0.68 -0.07 0.00 -0.02 0.00 0.00 41.12 41.83 2crq n ASP 76 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2crq n ILE 77 N -0.72 0.22 -4.29 0.53 3.06 -1.04 -4.76 119.36 112.36 2crq n ILE 77 Ca 0.00 -0.26 -0.15 0.00 -2.50 0.00 0.00 62.75 59.84 2crq n ILE 77 Cb 0.00 -0.12 -0.10 0.00 0.54 0.00 0.00 39.64 39.95 2crq n ILE 77 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 2crq s ALA 78 N -2.45 1.61 0.12 1.51 0.00 0.21 -3.64 121.76 119.12 2crq s ALA 78 Ca -0.04 -1.67 -0.12 0.00 0.00 0.00 0.00 51.96 50.13 2crq s ALA 78 Cb 0.04 0.47 0.01 0.00 0.00 0.00 0.00 23.12 23.65 2crq s ALA 78 CO 0.35 -0.26 0.29 -0.08 0.00 0.00 0.00 175.76 176.07 2crq s THR 79 N -3.50 0.10 -0.75 0.00 -1.32 0.21 -4.38 115.64 106.01 2crq s THR 79 Ca 0.26 -1.02 -0.26 0.00 -1.21 0.00 0.00 61.69 59.46 2crq s THR 79 Cb 0.05 -1.41 0.00 0.00 -1.51 0.00 0.00 72.50 69.64 2crq s THR 79 CO 0.06 -0.44 1.59 -0.36 -2.21 0.00 0.00 174.62 173.26 2crq s PHE 80 N -3.87 2.03 -0.08 9.09 0.08 -1.26 -2.47 117.98 121.50 2crq s PHE 80 Ca 0.07 0.24 -0.24 0.00 0.12 0.00 0.00 56.93 57.12 2crq s PHE 80 Cb 0.03 -4.37 -0.30 0.00 -0.57 0.00 0.00 43.02 37.81 2crq s PHE 80 CO -0.09 -2.11 0.84 1.03 -0.10 0.00 0.00 175.22 174.80 2crq h SER 81 N 11.97 0.33 -3.46 1.36 0.87 -1.84 -3.43 113.55 119.34 2crq h SER 81 Ca -0.17 -0.96 -0.63 0.00 -1.23 0.00 0.00 61.79 58.80 2crq h SER 81 Cb 1.08 -0.11 -0.40 0.00 -0.44 0.00 0.00 62.40 62.54 2crq h SER 81 CO 1.27 1.29 -0.74 -0.44 -0.53 0.00 0.00 176.83 177.68 2crq s SER 82 N -6.76 4.42 0.20 6.23 0.01 -1.22 -4.97 113.70 111.61 2crq s SER 82 Ca -0.15 -1.90 -0.30 0.00 1.31 0.00 0.00 55.95 54.91 2crq s SER 82 Cb -0.00 -1.29 -0.17 0.00 0.21 0.00 0.00 66.02 64.77 2crq s SER 82 CO 0.79 -0.39 0.75 0.54 0.41 0.00 0.00 173.24 175.34 2crq n ARG 83 N 4.52 0.42 -2.05 12.44 3.00 -1.26 -2.89 116.66 130.83 2crq n ARG 83 Ca 0.01 0.15 -0.40 0.00 -0.01 0.00 0.00 57.85 57.60 2crq n ARG 83 Cb 0.42 -1.33 -0.03 0.00 0.00 0.00 0.00 32.46 31.52 2crq n ARG 83 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.63 176.38 2crq s PRO 84 N -0.96 2.86 0.54 5.56 0.04 -1.26 -4.72 135.00 137.07 2crq s PRO 84 Ca 0.66 0.83 -0.02 0.00 0.04 0.00 0.00 61.00 62.51 2crq s PRO 84 Cb -0.91 -4.32 0.02 0.00 0.04 0.00 0.00 34.50 29.33 2crq s PRO 84 CO 0.57 -2.44 0.80 -1.59 0.04 0.00 0.00 177.00 174.37 2crq s LYS 85 N 6.56 2.79 -0.31 4.56 0.00 -1.16 -4.82 119.74 127.36 2crq s LYS 85 Ca 0.70 -0.42 -0.27 0.00 0.00 0.00 0.00 55.97 55.98 2crq s LYS 85 Cb -0.15 -2.42 0.01 0.00 0.00 0.00 0.00 37.83 35.27 2crq s LYS 85 CO 0.25 -0.61 0.98 0.00 0.00 0.00 0.00 175.35 175.97 2crq s ALA 86 N -2.80 3.52 0.49 0.59 0.00 -1.26 -2.91 121.76 119.39 2crq s ALA 86 Ca 0.53 -0.16 0.04 0.00 0.00 0.00 0.00 51.96 52.37 2crq s ALA 86 Cb -0.10 -3.55 -0.01 0.00 0.00 0.00 0.00 23.12 19.45 2crq s ALA 86 CO 0.41 -1.38 0.17 0.96 0.00 0.00 0.00 175.76 175.91 2crq s ILE 87 N 3.42 1.62 -0.71 0.00 -4.36 0.10 -4.60 121.20 116.67 2crq s ILE 87 Ca 0.41 -1.77 0.00 0.00 -0.26 0.00 0.00 60.65 59.03 2crq s ILE 87 Cb -0.13 -2.39 0.00 0.00 1.25 0.00 0.00 42.46 41.19 2crq s ILE 87 CO 0.14 0.00 0.00 0.54 0.24 0.00 0.00 174.94 175.86 2crq n ARG 88 N -1.40 -2.07 0.00 0.37 5.12 -1.26 0.97 116.66 118.39 2crq n ARG 88 Ca -0.09 0.40 0.00 0.00 -1.93 0.00 0.00 57.85 56.23 2crq n ARG 88 Cb 0.66 -4.82 0.00 0.00 -1.16 0.00 0.00 32.46 27.13 2crq n ARG 88 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2crq n GLY 89 N -0.51 2.79 0.00 -0.13 0.00 -1.26 -4.25 105.19 101.84 2crq n GLY 89 Ca -0.09 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.77 2crq n GLY 89 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2crq n GLY 90 N 0.00 0.73 0.27 -0.02 0.00 0.27 -4.98 105.19 101.45 2crq n GLY 90 Ca 0.00 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.17 2crq n GLY 90 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2crq h THR 91 N 0.00 0.25 -3.35 2.61 2.02 -1.73 -3.42 112.91 109.29 2crq h THR 91 Ca 0.00 -0.58 -0.38 0.00 0.77 0.00 0.00 66.41 66.23 2crq h THR 91 Cb 0.00 1.46 -0.16 0.00 -1.74 0.00 0.00 68.15 67.71 2crq h THR 91 CO 0.00 0.08 -0.73 0.00 0.37 0.00 0.00 175.52 175.23 2crq s ALA 92 N -3.86 1.56 0.08 6.16 0.00 -1.20 -1.70 121.76 122.80 2crq s ALA 92 Ca -0.01 -1.45 0.03 0.00 0.00 0.00 0.00 51.96 50.53 2crq s ALA 92 Cb 0.11 -0.02 -0.03 0.00 0.00 0.00 0.00 23.12 23.18 2crq s ALA 92 CO 0.55 -0.00 -0.10 -1.12 0.00 0.00 0.00 175.76 175.09 2crq s SER 93 N -2.96 1.28 -0.07 0.00 0.01 -0.98 0.01 113.70 110.98 2crq s SER 93 Ca 0.15 -0.73 0.02 0.00 1.31 0.00 0.00 55.95 56.70 2crq s SER 93 Cb -0.01 0.02 0.01 0.00 0.21 0.00 0.00 66.02 66.26 2crq s SER 93 CO 0.02 -0.24 -0.12 -0.32 0.41 0.00 0.00 173.24 173.00 2crq s MET 94 N -2.40 1.70 0.05 12.44 0.00 -1.15 -2.04 119.30 127.90 2crq s MET 94 Ca 0.01 -0.40 -0.01 0.00 0.00 0.00 0.00 55.69 55.29 2crq s MET 94 Cb -0.05 -1.46 -0.04 0.00 0.00 0.00 0.00 34.83 33.28 2crq s MET 94 CO -0.00 -0.02 -0.03 0.00 0.00 0.00 0.00 175.02 174.97 2crq s VAL 96 N -3.90 2.00 -0.21 0.00 1.01 -1.14 -0.80 120.40 117.37 2crq s VAL 96 Ca 0.07 -1.08 -0.03 0.00 0.00 0.00 0.00 61.98 60.94 2crq s VAL 96 Cb 0.08 -1.66 -0.00 0.00 0.00 0.00 0.00 36.38 34.79 2crq s VAL 96 CO -0.10 0.56 -0.07 -0.36 0.00 0.00 0.00 175.10 175.14 2crq s PHE 97 N -0.55 2.92 0.34 5.22 0.40 -0.85 -2.60 117.98 122.86 2crq s PHE 97 Ca 0.08 -1.02 0.07 0.00 -0.60 0.00 0.00 56.93 55.46 2crq s PHE 97 Cb -0.10 -2.06 -0.07 0.00 0.51 0.00 0.00 43.02 41.30 2crq s PHE 97 CO -0.01 -0.56 -0.02 -0.98 0.70 0.00 0.00 175.22 174.35 2crq s ARG 98 N 1.38 1.73 0.06 0.44 1.70 -1.03 -3.63 118.95 119.59 2crq s ARG 98 Ca 0.05 -1.93 -0.12 0.00 -0.47 0.00 0.00 55.73 53.26 2crq s ARG 98 Cb -0.14 -1.31 -0.06 0.00 -0.57 0.00 0.00 34.95 32.87 2crq s ARG 98 CO -0.04 -0.02 0.42 -1.58 -1.08 0.00 0.00 175.30 172.99 2crq s HIS 99 N -2.93 3.63 -0.33 5.89 5.65 -1.26 0.67 115.29 126.61 2crq s HIS 99 Ca 0.33 0.88 -0.33 0.00 0.25 0.00 0.00 55.06 56.19 2crq s HIS 99 Cb 0.06 -2.22 -0.10 0.00 -1.18 0.00 0.00 32.58 29.15 2crq s HIS 99 CO 0.15 0.55 2.22 1.28 -0.65 0.00 0.00 174.74 178.29 2crq n LEU 100 N 1.18 2.43 0.00 8.88 4.77 -1.24 -4.86 117.00 128.16 2crq n LEU 100 Ca -0.10 0.31 -0.16 0.00 -0.03 0.00 0.00 56.01 56.03 2crq n LEU 100 Cb 0.52 -1.36 0.16 0.00 -2.33 0.00 0.00 43.42 40.42 2crq n LEU 100 CO 0.41 -0.76 0.19 -1.20 -1.33 0.00 0.00 177.39 174.70 2crq n SER 101 N 10.66 -3.16 0.09 -1.43 7.64 -1.26 -4.47 113.62 121.69 2crq n SER 101 Ca 0.38 -0.47 0.07 0.00 1.01 0.00 0.00 58.87 59.86 2crq n SER 101 Cb 0.30 -0.75 0.34 0.00 -1.01 0.00 0.00 64.21 63.09 2crq n SER 101 CO 0.00 0.00 0.00 2.29 -3.01 0.00 0.00 175.04 174.32 2crq n LYS 102 N -1.88 0.08 0.03 1.43 0.00 -1.26 -1.92 118.16 114.64 2crq n LYS 102 Ca 0.07 0.53 -0.19 0.00 -0.00 0.00 0.00 58.31 58.72 2crq n LYS 102 Cb 0.32 -1.74 -0.13 0.00 -0.00 0.00 0.00 35.03 33.48 2crq n LYS 102 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.40 178.27 2crq h LYS 103 N 0.00 0.32 -6.56 -1.58 1.79 -1.99 -3.47 116.57 105.07 2crq h LYS 103 Ca 0.00 -0.47 -0.45 0.00 -2.18 0.00 0.00 60.65 57.55 2crq h LYS 103 Cb 0.07 0.16 0.02 0.00 -1.58 0.00 0.00 32.23 30.90 2crq h LYS 103 CO 0.00 1.19 -0.18 -1.21 -1.08 0.00 0.00 179.45 178.16 2crq s GLU 104 N -2.66 3.05 -0.42 3.15 8.01 -0.81 -4.98 118.70 124.04 2crq s GLU 104 Ca -0.14 -0.71 -0.43 0.00 0.01 0.00 0.00 54.97 53.70 2crq s GLU 104 Cb 0.01 -2.65 -0.17 0.00 -4.31 0.00 0.00 34.13 27.01 2crq s GLU 104 CO 0.82 -0.18 1.86 -1.91 0.01 0.00 0.00 175.26 175.87 2crq n GLU 105 N -1.93 0.46 -3.92 1.61 2.13 -1.26 -4.55 120.64 113.17 2crq n GLU 105 Ca 0.01 0.15 -0.22 0.00 0.66 0.00 0.00 57.16 57.76 2crq n GLU 105 Cb 0.58 -1.79 -0.05 0.00 0.27 0.00 0.00 31.44 30.45 2crq n GLU 105 CO 0.00 0.00 0.00 -1.59 -0.41 0.00 0.00 177.13 175.13 2crq s LYS 106 N 4.36 2.47 0.91 5.31 -2.85 -1.26 -4.58 119.74 124.10 2crq s LYS 106 Ca 1.08 -1.52 -0.10 0.00 -1.00 0.00 0.00 55.97 54.42 2crq s LYS 106 Cb -1.30 -2.27 0.14 0.00 -2.06 0.00 0.00 37.83 32.35 2crq s LYS 106 CO 0.69 0.01 1.14 -1.54 0.10 0.00 0.00 175.35 175.75 2crq s SER 107 N -3.95 3.01 0.82 0.03 1.04 -1.26 -5.02 113.70 108.37 2crq s SER 107 Ca 0.41 2.13 -0.08 0.00 0.48 0.00 0.00 55.95 58.90 2crq s SER 107 Cb -0.03 -2.55 0.15 0.00 0.10 0.00 0.00 66.02 63.69 2crq s SER 107 CO 0.25 -3.04 1.13 -0.83 0.98 0.00 0.00 173.24 171.73 2crq s GLY 108 N -2.74 1.76 -0.59 7.32 0.00 -1.26 -4.97 107.32 106.83 2crq s GLY 108 Ca 0.66 -1.43 -0.27 0.00 0.00 0.00 0.00 44.72 43.69 2crq s GLY 108 CO 0.58 -0.79 1.85 2.56 0.00 0.00 0.00 173.10 177.30 2crq s PRO 109 N -5.47 2.67 0.08 2.90 0.04 -1.26 -4.94 135.00 129.03 2crq s PRO 109 Ca 0.69 0.66 -0.07 0.00 0.04 0.00 0.00 61.00 62.32 2crq s PRO 109 Cb -0.05 -4.37 -0.01 0.00 0.04 0.00 0.00 34.50 30.10 2crq s PRO 109 CO 0.48 -2.67 0.14 0.45 0.04 0.00 0.00 177.00 175.44 2crq s SER 110 N 7.95 0.20 -0.24 6.66 0.15 -1.26 -5.14 113.70 122.02 2crq s SER 110 Ca 0.68 -0.74 -0.01 0.00 0.70 0.00 0.00 55.95 56.57 2crq s SER 110 Cb -0.13 0.31 0.07 0.00 -1.71 0.00 0.00 66.02 64.56 2crq s SER 110 CO 0.21 -0.71 0.02 -0.55 1.20 0.00 0.00 173.24 173.42 2crq s SER 111 N -2.88 3.53 0.00 5.45 0.15 -1.26 -5.07 113.70 113.63 2crq s SER 111 Ca 0.06 -1.16 0.00 0.00 0.70 0.00 0.00 55.95 55.55 2crq s SER 111 Cb 0.06 -0.89 0.00 0.00 -1.71 0.00 0.00 66.02 63.48 2crq s SER 111 CO -0.10 -0.31 0.00 0.61 1.20 0.00 0.00 173.24 174.64