#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2crq s SER 2 N 0.00 3.88 0.05 1.61 0.15 -1.26 -5.02 113.70 113.11 2crq s SER 2 Ca 0.00 -0.46 -0.25 0.00 0.70 0.00 0.00 55.95 55.95 2crq s SER 2 Cb 0.00 -1.63 -0.17 0.00 -1.71 0.00 0.00 66.02 62.51 2crq s SER 2 CO 0.00 0.03 1.55 0.28 1.20 0.00 0.00 173.24 176.30 2crq h SER 3 N 7.76 -0.08 -2.99 5.45 0.02 -2.15 -3.46 113.55 118.09 2crq h SER 3 Ca -0.39 -0.16 -0.13 0.00 -0.84 0.00 0.00 61.79 60.27 2crq h SER 3 Cb 1.17 0.02 -0.03 0.00 0.14 0.00 0.00 62.40 63.70 2crq h SER 3 CO 0.60 0.11 -0.11 0.61 -1.14 0.00 0.00 176.83 176.90 2crq n GLY 4 N -0.66 3.87 3.61 -3.77 0.00 -1.26 -5.18 105.19 101.80 2crq n GLY 4 Ca -0.08 -1.92 -0.08 0.00 0.00 0.00 0.00 46.02 43.94 2crq n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2crq s SER 5 N -1.60 -0.28 0.31 1.61 1.04 -1.26 -5.19 113.70 108.32 2crq s SER 5 Ca 0.06 0.36 0.03 0.00 0.48 0.00 0.00 55.95 56.89 2crq s SER 5 Cb 0.00 0.31 -0.04 0.00 0.10 0.00 0.00 66.02 66.39 2crq s SER 5 CO 0.04 -0.22 0.16 -0.44 0.98 0.00 0.00 173.24 173.76 2crq s SER 6 N -0.82 1.61 0.00 7.02 0.01 -1.26 -5.10 113.70 115.17 2crq s SER 6 Ca 0.02 -1.57 0.00 0.00 1.31 0.00 0.00 55.95 55.71 2crq s SER 6 Cb -0.02 0.39 0.00 0.00 0.21 0.00 0.00 66.02 66.61 2crq s SER 6 CO -0.03 -0.89 0.00 0.61 0.41 0.00 0.00 173.24 173.34 2crq n GLY 7 N -0.60 0.85 3.77 3.44 0.00 -1.26 -5.13 105.19 106.26 2crq n GLY 7 Ca 0.01 -0.31 -0.39 0.00 0.00 0.00 0.00 46.02 45.33 2crq n GLY 7 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2crq s PRO 8 N 0.00 4.19 -0.08 1.61 0.04 -1.26 -5.04 135.00 134.45 2crq s PRO 8 Ca 0.00 1.95 0.02 0.00 0.04 0.00 0.00 61.00 63.01 2crq s PRO 8 Cb 0.00 -2.84 -0.02 0.00 0.04 0.00 0.00 34.50 31.68 2crq s PRO 8 CO 0.00 -0.24 -0.14 0.21 0.04 0.00 0.00 177.00 176.87 2crq s LYS 9 N -2.07 2.87 -0.41 4.56 2.47 -1.26 -5.08 119.74 120.82 2crq s LYS 9 Ca 0.54 -0.70 0.01 0.00 -1.56 0.00 0.00 55.97 54.26 2crq s LYS 9 Cb -0.33 -2.47 0.14 0.00 -1.46 0.00 0.00 37.83 33.70 2crq s LYS 9 CO 0.43 0.44 0.25 0.95 0.16 0.00 0.00 175.35 177.58 2crq s THR 10 N -0.26 0.78 0.08 3.43 -4.23 -1.26 -5.12 115.64 109.06 2crq s THR 10 Ca 0.02 -2.25 0.01 0.00 -1.18 0.00 0.00 61.69 58.28 2crq s THR 10 Cb -0.13 -1.55 0.01 0.00 1.34 0.00 0.00 72.50 72.17 2crq s THR 10 CO 0.03 -0.98 0.06 0.61 -0.54 0.00 0.00 174.62 173.79 2crq n GLY 11 N 3.63 3.14 3.59 3.99 0.00 -1.26 -5.14 105.19 113.14 2crq n GLY 11 Ca 0.13 -2.20 -0.30 0.00 0.00 0.00 0.00 46.02 43.65 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 -2.34 -1.37 0.01 1.61 0.04 -1.26 -5.06 135.00 126.63 2crq s PRO 12 Ca 0.04 -0.12 0.01 0.00 0.04 0.00 0.00 61.00 60.98 2crq s PRO 12 Cb -0.00 -1.58 -0.04 0.00 0.04 0.00 0.00 34.50 32.92 2crq s PRO 12 CO 0.03 -3.80 0.03 -0.08 0.04 0.00 0.00 177.00 173.21 2crq s THR 13 N -3.01 4.34 0.50 1.26 -1.32 -1.26 -5.13 115.64 111.03 2crq s THR 13 Ca 0.71 -0.60 0.02 0.00 -1.21 0.00 0.00 61.69 60.62 2crq s THR 13 Cb -0.09 -2.98 -0.01 0.00 -1.51 0.00 0.00 72.50 67.91 2crq s THR 13 CO 0.56 0.32 0.05 -0.04 -2.21 0.00 0.00 174.62 173.29 2crq s MET 14 N -1.76 2.18 -0.05 7.08 -1.94 -1.26 -5.14 119.30 118.41 2crq s MET 14 Ca 0.22 -2.33 0.01 0.00 -1.71 0.00 0.00 55.69 51.88 2crq s MET 14 Cb -0.12 -1.61 0.02 0.00 2.01 0.00 0.00 34.83 35.14 2crq s MET 14 CO 0.13 -0.35 -0.04 0.99 -0.01 0.00 0.00 175.02 175.74 2crq s THR 15 N -2.85 0.52 -0.12 2.05 2.01 -1.26 -3.97 115.64 112.03 2crq s THR 15 Ca 0.12 -0.08 -0.07 0.00 0.31 0.00 0.00 61.69 61.97 2crq s THR 15 Cb 0.02 -0.57 -0.04 0.00 0.01 0.00 0.00 72.50 71.92 2crq s THR 15 CO 0.06 0.24 0.13 -0.54 -0.69 0.00 0.00 174.62 173.82 2crq s LYS 16 N 1.13 3.43 -0.13 4.92 -0.14 0.24 -5.01 119.74 124.18 2crq s LYS 16 Ca -0.08 -0.16 0.03 0.00 -1.36 0.00 0.00 55.97 54.40 2crq s LYS 16 Cb -0.14 -3.16 0.01 0.00 -1.68 0.00 0.00 37.83 32.86 2crq s LYS 16 CO -0.01 0.75 -0.22 -1.21 -0.76 0.00 0.00 175.35 173.89 2crq s GLU 17 N -0.95 3.02 -0.16 1.68 8.01 -1.26 -0.34 118.70 128.71 2crq s GLU 17 Ca 0.14 -0.86 0.00 0.00 0.01 0.00 0.00 54.97 54.27 2crq s GLU 17 Cb -0.12 -2.40 -0.00 0.00 -4.31 0.00 0.00 34.13 27.30 2crq s GLU 17 CO 0.04 0.04 -0.15 -1.17 0.01 0.00 0.00 175.26 174.02 2crq s LEU 18 N 0.69 2.48 -0.09 1.80 2.96 0.73 -4.95 118.68 122.30 2crq s LEU 18 Ca -0.10 -0.47 0.03 0.00 -0.22 0.00 0.00 54.13 53.36 2crq s LEU 18 Cb -0.16 -1.57 0.01 0.00 0.50 0.00 0.00 46.19 44.97 2crq s LEU 18 CO 0.01 0.08 -0.18 -0.69 -1.32 0.00 0.00 176.35 174.25 2crq s VAL 19 N 0.86 1.60 -0.22 1.68 1.01 -1.26 -0.67 120.40 123.39 2crq s VAL 19 Ca -0.04 -0.74 -0.24 0.00 0.00 0.00 0.00 61.98 60.96 2crq s VAL 19 Cb -0.15 -1.42 0.07 0.00 0.00 0.00 0.00 36.38 34.87 2crq s VAL 19 CO -0.01 0.46 0.67 0.72 0.00 0.00 0.00 175.10 176.94 2crq s PHE 20 N 0.64 -0.72 0.28 5.22 -0.12 -1.16 -5.01 117.98 117.12 2crq s PHE 20 Ca -0.14 1.68 -0.29 0.00 -0.05 0.00 0.00 56.93 58.13 2crq s PHE 20 Cb -0.16 0.27 -0.09 0.00 -0.63 0.00 0.00 43.02 42.40 2crq s PHE 20 CO 0.04 -0.39 1.05 -1.12 -0.05 0.00 0.00 175.22 174.75 2crq s SER 21 N 0.11 7.33 0.40 1.98 0.01 -1.26 -3.27 113.70 118.99 2crq s SER 21 Ca -0.02 2.17 0.22 0.00 1.31 0.00 0.00 55.95 59.63 2crq s SER 21 Cb -0.04 -2.62 1.21 0.00 0.21 0.00 0.00 66.02 64.78 2crq s SER 21 CO 0.02 -0.09 1.70 0.28 0.41 0.00 0.00 173.24 175.56 2crq h SER 22 N 3.80 0.39 -1.14 2.44 0.02 -1.87 0.14 113.55 117.32 2crq h SER 22 Ca -0.46 0.12 0.43 0.00 -0.84 0.00 0.00 61.79 61.03 2crq h SER 22 Cb 1.21 0.07 -0.16 0.00 0.14 0.00 0.00 62.40 63.66 2crq h SER 22 CO 0.67 -0.04 0.68 -1.13 -1.14 0.00 0.00 176.83 175.86 2crq h ASN 23 N 0.28 0.30 -0.40 3.07 -1.24 -1.91 -3.41 115.58 112.27 2crq h ASN 23 Ca 0.70 0.21 -0.59 0.00 0.71 0.00 0.00 56.30 57.33 2crq h ASN 23 Cb 1.90 0.21 -0.01 0.00 0.73 0.00 0.00 38.32 41.14 2crq h ASN 23 CO -0.39 -0.33 0.69 0.00 -1.29 0.00 0.00 177.43 176.11 2crq n ILE 24 N -5.03 0.00 -1.16 2.57 3.06 0.47 -4.86 119.36 114.42 2crq n ILE 24 Ca 0.38 0.00 -0.29 0.00 -2.50 0.00 0.00 62.75 60.33 2crq n ILE 24 Cb 1.35 -0.35 0.15 0.00 0.54 0.00 0.00 39.64 41.33 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 3.07 1.60 0.48 4.50 0.00 -1.26 -4.71 107.32 111.00 2crq s GLY 25 Ca 0.79 -0.14 0.14 0.00 0.00 0.00 0.00 44.72 45.52 2crq s GLY 25 CO 0.53 0.39 2.09 -1.61 0.00 0.00 0.00 173.10 174.51 2crq h GLN 26 N -1.70 0.08 0.20 2.90 5.75 -1.96 -0.02 115.11 120.37 2crq h GLN 26 Ca -0.51 -0.01 -0.00 0.00 -0.15 0.00 0.00 58.65 57.98 2crq h GLN 26 Cb 1.30 -0.02 -0.00 0.00 1.07 0.00 0.00 27.48 29.83 2crq h GLN 26 CO 0.55 0.10 -0.13 1.25 -2.65 0.00 0.00 178.83 177.95 2crq h HIS 27 N 0.08 -0.34 0.07 3.99 2.76 -2.00 -1.70 115.15 118.01 2crq h HIS 27 Ca 0.02 -0.00 -0.00 0.00 -2.20 0.00 0.00 60.37 58.18 2crq h HIS 27 Cb 0.08 0.12 0.00 0.00 1.55 0.00 0.00 27.41 29.16 2crq h HIS 27 CO 0.00 -0.21 -0.04 -0.44 -1.30 0.00 0.00 177.93 175.95 2crq h ASP 28 N -0.33 -0.08 -1.00 3.26 3.32 -1.85 -3.26 116.42 116.48 2crq h ASP 28 Ca -0.02 -0.52 0.34 0.00 0.02 0.00 0.00 57.03 56.85 2crq h ASP 28 Cb 0.28 0.02 -0.16 0.00 0.22 0.00 0.00 39.33 39.70 2crq h ASP 28 CO 0.01 0.54 0.54 0.25 -1.72 0.00 0.00 179.24 178.86 2crq h LEU 29 N -0.78 0.43 -0.81 1.55 5.85 -1.04 0.27 115.31 120.78 2crq h LEU 29 Ca -0.01 0.21 0.19 0.00 0.84 0.00 0.00 57.88 59.11 2crq h LEU 29 Cb 0.60 0.18 -0.14 0.00 0.37 0.00 0.00 40.66 41.67 2crq h LEU 29 CO 0.02 -0.22 -0.00 -0.78 -0.34 0.00 0.00 178.44 177.12 2crq h ASP 30 N 0.23 -0.39 -0.04 1.25 3.58 -1.34 -0.39 116.42 119.31 2crq h ASP 30 Ca 0.75 0.21 -0.01 0.00 0.42 0.00 0.00 57.03 58.41 2crq h ASP 30 Cb 1.79 0.38 -0.00 0.00 1.72 0.00 0.00 39.33 43.21 2crq h ASP 30 CO -0.66 -0.21 0.00 0.74 -2.88 0.00 0.00 179.24 176.23 2crq h THR 31 N 0.09 1.25 -1.17 2.25 2.02 -0.62 -2.98 112.91 113.74 2crq h THR 31 Ca 0.45 -0.76 0.44 0.00 0.77 0.00 0.00 66.41 67.32 2crq h THR 31 Cb 0.81 1.68 -0.16 0.00 -1.74 0.00 0.00 68.15 68.74 2crq h THR 31 CO -0.73 0.20 0.69 0.11 0.37 0.00 0.00 175.52 176.17 2crq h LYS 32 N -0.22 0.01 -0.09 6.66 1.79 -0.94 0.75 116.57 124.52 2crq h LYS 32 Ca 0.01 -0.00 -0.04 0.00 -2.18 0.00 0.00 60.65 58.44 2crq h LYS 32 Cb 0.33 -0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 30.97 2crq h LYS 32 CO 0.00 0.01 -0.11 0.77 -1.08 0.00 0.00 179.45 179.04 2crq h SER 33 N 0.01 0.26 -0.57 0.86 0.02 -1.32 -2.68 113.55 110.12 2crq h SER 33 Ca 0.86 -0.50 0.07 0.00 -0.84 0.00 0.00 61.79 61.39 2crq h SER 33 Cb 2.49 -0.07 -0.06 0.00 0.14 0.00 0.00 62.40 64.90 2crq h SER 33 CO -0.64 0.71 0.24 0.11 -1.14 0.00 0.00 176.83 176.12 2crq h LYS 34 N -0.18 0.44 -0.35 3.45 1.57 0.50 0.10 116.57 122.09 2crq h LYS 34 Ca 0.01 -0.03 0.01 0.00 -1.87 0.00 0.00 60.65 58.77 2crq h LYS 34 Cb 0.64 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.83 2crq h LYS 34 CO 0.03 0.29 0.23 0.37 -0.57 0.00 0.00 179.45 179.79 2crq h GLN 35 N 0.45 0.45 -0.60 3.15 5.75 -1.20 -2.67 115.11 120.44 2crq h GLN 35 Ca 0.28 -0.03 -0.04 0.00 -0.15 0.00 0.00 58.65 58.71 2crq h GLN 35 Cb 0.28 -0.10 -0.03 0.00 1.07 0.00 0.00 27.48 28.71 2crq h GLN 35 CO -0.25 0.30 0.24 0.82 -2.65 0.00 0.00 178.83 177.29 2crq h ILE 36 N 0.47 1.23 -0.65 2.39 2.04 -1.03 -2.88 117.51 119.08 2crq h ILE 36 Ca 0.13 -0.73 0.12 0.00 1.00 0.00 0.00 64.86 65.39 2crq h ILE 36 Cb -0.04 0.58 -0.09 0.00 -0.74 0.00 0.00 36.82 36.53 2crq h ILE 36 CO -0.04 0.28 0.16 -0.61 0.00 0.00 0.00 178.15 177.95 2crq h GLN 37 N 0.84 0.28 -0.26 2.37 4.15 -0.49 0.19 115.11 122.19 2crq h GLN 37 Ca 0.20 -0.02 0.01 0.00 0.77 0.00 0.00 58.65 59.61 2crq h GLN 37 Cb 0.21 -0.06 -0.01 0.00 0.21 0.00 0.00 27.48 27.82 2crq h GLN 37 CO -0.02 0.19 0.17 1.96 -1.93 0.00 0.00 178.83 179.20 2crq h GLN 38 N 0.29 0.31 0.11 1.69 4.20 -1.27 -2.39 115.11 118.05 2crq h GLN 38 Ca 0.34 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 59.03 2crq h GLN 38 Cb 0.52 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 28.24 2crq h GLN 38 CO -0.42 0.21 -0.05 -1.49 -0.67 0.00 0.00 178.83 176.41 2crq h TRP 39 N 0.32 -0.13 -0.89 2.96 6.55 -0.63 -3.28 115.95 120.85 2crq h TRP 39 Ca 0.10 -0.00 0.21 0.00 0.95 0.00 0.00 58.89 60.14 2crq h TRP 39 Cb 0.00 0.04 -0.12 0.00 -0.86 0.00 0.00 29.16 28.23 2crq h TRP 39 CO -0.00 0.37 0.39 0.82 -1.05 0.00 0.00 178.44 178.98 2crq h ILE 40 N -0.81 0.51 -0.73 1.49 1.08 -0.85 -0.19 117.51 118.01 2crq h ILE 40 Ca -0.01 -0.15 0.16 0.00 -0.39 0.00 0.00 64.86 64.47 2crq h ILE 40 Cb 0.57 0.05 -0.13 0.00 -3.07 0.00 0.00 36.82 34.23 2crq h ILE 40 CO 0.02 0.08 -0.07 -0.33 -0.69 0.00 0.00 178.15 177.17 2crq h GLU 41 N 0.43 0.06 -1.06 2.37 4.39 -1.49 0.72 114.58 119.99 2crq h GLU 41 Ca 0.54 -0.00 -0.13 0.00 0.34 0.00 0.00 59.36 60.11 2crq h GLU 41 Cb 0.99 -0.01 -0.08 0.00 -0.10 0.00 0.00 28.75 29.55 2crq h GLU 41 CO -0.50 0.04 0.17 1.63 -1.16 0.00 0.00 179.01 179.18 2crq n LYS 42 N -5.40 1.31 -4.10 2.33 5.02 -0.11 -4.83 118.16 112.38 2crq n LYS 42 Ca 0.12 -0.74 -0.28 0.00 -2.02 0.00 0.00 58.31 55.38 2crq n LYS 42 Cb 0.43 -1.29 -0.05 0.00 -0.02 0.00 0.00 35.03 34.10 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 0.16 -2.52 -3.75 1.97 4.01 0.25 -4.92 118.16 113.36 2crq n LYS 43 Ca 0.15 0.30 -0.36 0.00 -0.51 0.00 0.00 58.31 57.88 2crq n LYS 43 Cb 0.77 -4.30 -0.11 0.00 -0.51 0.00 0.00 35.03 30.88 2crq n LYS 43 CO 0.00 0.00 0.00 0.71 -1.11 0.00 0.00 177.40 177.00 2crq s TYR 44 N -4.02 3.20 -0.24 2.13 2.02 -1.00 -4.93 117.35 114.51 2crq s TYR 44 Ca 0.08 -0.04 -0.29 0.00 -0.37 0.00 0.00 57.07 56.46 2crq s TYR 44 Cb -0.05 -2.25 -0.03 0.00 -0.40 0.00 0.00 41.96 39.23 2crq s TYR 44 CO 0.93 -0.11 1.80 -1.01 -1.57 0.00 0.00 175.55 175.60 2crq s HIS 45 N 1.27 1.78 -0.38 2.71 3.76 -1.25 -4.14 115.29 119.03 2crq s HIS 45 Ca 0.06 0.49 -0.10 0.00 -0.15 0.00 0.00 55.06 55.36 2crq s HIS 45 Cb -0.14 -4.05 0.04 0.00 1.11 0.00 0.00 32.58 29.54 2crq s HIS 45 CO 0.05 -3.34 0.21 0.08 -0.85 0.00 0.00 174.74 170.88 2crq s VAL 46 N 6.23 4.40 -0.39 -0.90 1.01 -1.25 -0.60 120.40 128.90 2crq s VAL 46 Ca 0.80 -1.02 -0.18 0.00 0.00 0.00 0.00 61.98 61.58 2crq s VAL 46 Cb -0.27 -3.51 0.01 0.00 0.00 0.00 0.00 36.38 32.61 2crq s VAL 46 CO 0.33 -0.29 0.49 -1.58 0.00 0.00 0.00 175.10 174.04 2crq s GLN 47 N 1.51 3.37 -0.19 2.72 0.74 0.54 -2.64 119.66 125.71 2crq s GLN 47 Ca 0.02 -0.44 -0.10 0.00 0.05 0.00 0.00 55.36 54.88 2crq s GLN 47 Cb -0.20 -3.89 -0.05 0.00 1.10 0.00 0.00 33.01 29.97 2crq s GLN 47 CO 0.05 -0.76 0.15 0.08 -0.55 0.00 0.00 175.29 174.26 2crq s VAL 48 N 2.33 5.40 -0.24 1.34 1.01 0.28 -0.19 120.40 130.33 2crq s VAL 48 Ca 0.16 0.24 0.02 0.00 0.00 0.00 0.00 61.98 62.40 2crq s VAL 48 Cb -0.16 -3.49 0.06 0.00 0.00 0.00 0.00 36.38 32.79 2crq s VAL 48 CO 0.14 0.45 -0.08 -0.89 0.00 0.00 0.00 175.10 174.72 2crq s THR 49 N 0.26 1.76 -0.24 3.92 2.01 0.15 -1.95 115.64 121.55 2crq s THR 49 Ca 0.10 -1.35 -0.18 0.00 0.31 0.00 0.00 61.69 60.57 2crq s THR 49 Cb -0.11 -1.96 -0.03 0.00 0.01 0.00 0.00 72.50 70.41 2crq s THR 49 CO -0.01 -0.05 0.51 -0.63 -0.69 0.00 0.00 174.62 173.75 2crq s ILE 50 N 1.29 5.08 -0.15 1.82 1.01 -0.76 -2.98 121.20 126.52 2crq s ILE 50 Ca -0.07 0.90 -0.09 0.00 0.00 0.00 0.00 60.65 61.40 2crq s ILE 50 Cb -0.19 -3.83 -0.04 0.00 0.01 0.00 0.00 42.46 38.41 2crq s ILE 50 CO -0.06 0.12 0.15 -0.54 0.00 0.00 0.00 174.94 174.61 2crq s LYS 51 N 2.06 3.80 0.51 2.79 1.02 -1.20 -2.29 119.74 126.43 2crq s LYS 51 Ca 0.22 -0.15 0.05 0.00 0.02 0.00 0.00 55.97 56.12 2crq s LYS 51 Cb -0.16 -3.30 0.05 0.00 -0.52 0.00 0.00 37.83 33.91 2crq s LYS 51 CO 0.09 0.55 0.46 0.54 -0.92 0.00 0.00 175.35 176.07 2crq n ARG 52 N 2.69 0.72 -1.34 1.68 1.74 -1.26 -2.74 116.66 118.15 2crq n ARG 52 Ca -0.18 -3.07 -0.30 0.00 -0.77 0.00 0.00 57.85 53.53 2crq n ARG 52 Cb 0.54 0.21 0.12 0.00 -1.02 0.00 0.00 32.46 32.31 2crq n ARG 52 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2crq s ARG 53 N -4.14 1.57 0.16 5.56 0.52 -1.26 -4.97 118.95 116.40 2crq s ARG 53 Ca 0.35 0.75 -0.11 0.00 -0.52 0.00 0.00 55.73 56.19 2crq s ARG 53 Cb -0.03 -1.85 0.02 0.00 0.52 0.00 0.00 34.95 33.61 2crq s ARG 53 CO 0.22 -2.00 1.58 0.87 0.02 0.00 0.00 175.30 175.98 2crq h LYS 54 N -1.37 0.95 -0.61 3.54 1.79 -2.00 -3.26 116.57 115.62 2crq h LYS 54 Ca -0.48 -0.36 -0.44 0.00 -2.18 0.00 0.00 60.65 57.19 2crq h LYS 54 Cb 1.28 -0.06 -0.38 0.00 -1.58 0.00 0.00 32.23 31.49 2crq h LYS 54 CO 0.56 1.02 -0.84 -3.47 -1.08 0.00 0.00 179.45 175.64 2crq n ASP 55 N -4.21 3.99 -4.68 0.86 2.03 -1.26 -5.07 116.55 108.21 2crq n ASP 55 Ca 0.01 -3.46 -0.45 0.00 0.52 0.00 0.00 54.79 51.41 2crq n ASP 55 Cb 0.39 -0.38 -0.04 0.00 -0.72 0.00 0.00 41.12 40.37 2crq n ASP 55 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2crq n ALA 56 N -0.71 1.60 -1.22 -1.67 0.00 -1.23 -4.88 120.51 112.40 2crq n ALA 56 Ca 0.35 0.42 -0.30 0.00 0.00 0.00 0.00 53.44 53.90 2crq n ALA 56 Cb 0.92 -2.41 0.08 0.00 0.00 0.00 0.00 19.45 18.04 2crq n ALA 56 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 2crq n GLU 57 N 3.96 2.48 -4.51 0.00 0.28 -1.26 -4.94 120.64 116.64 2crq n GLU 57 Ca 0.17 -2.92 -0.26 0.00 -0.16 0.00 0.00 57.16 53.99 2crq n GLU 57 Cb 0.30 -2.15 -0.10 0.00 1.43 0.00 0.00 31.44 30.92 2crq n GLU 57 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 177.13 176.32 2crq s GLN 58 N -3.39 1.86 0.31 3.44 -1.52 -1.26 -5.15 119.66 113.95 2crq s GLN 58 Ca 0.58 -1.91 -0.03 0.00 -1.95 0.00 0.00 55.36 52.04 2crq s GLN 58 Cb 0.45 -1.74 -0.04 0.00 -0.22 0.00 0.00 33.01 31.46 2crq s GLN 58 CO 0.00 0.14 0.55 -1.12 -0.25 0.00 0.00 175.29 174.61 2crq s SER 59 N -3.63 6.38 0.24 5.90 0.01 -1.26 -5.00 113.70 116.34 2crq s SER 59 Ca 0.33 0.61 -0.01 0.00 1.31 0.00 0.00 55.95 58.19 2crq s SER 59 Cb 0.02 -2.10 0.26 0.00 0.21 0.00 0.00 66.02 64.41 2crq s SER 59 CO 0.17 -0.23 1.63 1.05 0.41 0.00 0.00 173.24 176.27 2crq h GLU 60 N 1.36 0.58 -1.09 12.44 -0.00 -1.99 -3.00 114.58 122.89 2crq h GLU 60 Ca -0.48 -0.26 0.30 0.00 -0.00 0.00 0.00 59.36 58.92 2crq h GLU 60 Cb 1.20 -0.01 -0.11 0.00 -0.00 0.00 0.00 28.75 29.83 2crq h GLU 60 CO 0.65 0.84 0.68 0.93 -0.00 0.00 0.00 179.01 182.11 2crq h GLU 61 N 0.49 0.34 -0.04 1.06 4.39 -2.01 0.92 114.58 119.73 2crq h GLU 61 Ca 0.06 -0.02 -0.10 0.00 0.34 0.00 0.00 59.36 59.63 2crq h GLU 61 Cb 0.81 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 29.37 2crq h GLU 61 CO 0.07 0.22 -0.44 0.93 -1.16 0.00 0.00 179.01 178.63 2crq h GLU 62 N 0.35 0.10 -0.19 2.33 5.08 -1.94 -2.87 114.58 117.43 2crq h GLU 62 Ca 0.66 -0.05 -0.07 0.00 -1.00 0.00 0.00 59.36 58.90 2crq h GLU 62 Cb 1.70 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.94 2crq h GLU 62 CO -0.38 0.52 -0.21 1.15 -1.00 0.00 0.00 179.01 179.10 2crq h THR 63 N 0.08 1.23 -0.73 1.13 2.02 0.76 -2.92 112.91 114.49 2crq h THR 63 Ca 0.00 -1.08 0.11 0.00 0.77 0.00 0.00 66.41 66.21 2crq h THR 63 Cb 0.82 1.32 -0.08 0.00 -1.74 0.00 0.00 68.15 68.48 2crq h THR 63 CO 0.06 0.34 0.35 -0.33 0.37 0.00 0.00 175.52 176.31 2crq h GLU 64 N 0.30 0.56 -0.99 6.66 5.08 -1.23 -2.38 114.58 122.58 2crq h GLU 64 Ca 0.05 -0.03 0.15 0.00 -1.00 0.00 0.00 59.36 58.53 2crq h GLU 64 Cb 0.55 -0.13 -0.16 0.00 0.50 0.00 0.00 28.75 29.51 2crq h GLU 64 CO 0.04 0.37 -0.39 0.39 -1.00 0.00 0.00 179.01 178.42 2crq n GLU 65 N -4.89 -0.23 -0.04 2.33 4.71 -1.10 -1.57 120.64 119.84 2crq n GLU 65 Ca 0.12 1.52 -0.01 0.00 -0.01 0.00 0.00 57.16 58.79 2crq n GLU 65 Cb 0.31 -2.26 -0.01 0.00 -1.01 0.00 0.00 31.44 28.47 2crq n GLU 65 CO 0.00 0.00 0.00 -0.89 0.09 0.00 0.00 177.13 176.33 2crq n ILE 66 N -5.46 -0.07 -0.30 -3.67 2.08 -0.90 0.35 119.36 111.41 2crq n ILE 66 Ca 0.10 1.39 0.12 0.00 0.56 0.00 0.00 62.75 64.92 2crq n ILE 66 Cb 0.40 -1.83 0.29 0.00 -0.75 0.00 0.00 39.64 37.75 2crq n ILE 66 CO 0.00 0.00 0.00 -0.26 0.56 0.00 0.00 176.55 176.85 2crq h PHE 67 N 0.00 0.52 -0.91 1.39 0.04 -1.44 0.29 116.94 116.83 2crq h PHE 67 Ca 0.02 0.04 0.00 0.00 2.80 0.00 0.00 57.97 60.83 2crq h PHE 67 Cb 0.04 -0.09 -0.04 0.00 2.20 0.00 0.00 35.95 38.05 2crq h PHE 67 CO -0.82 -0.11 0.58 -0.97 -0.60 0.00 0.00 178.31 176.39 2crq h ASN 68 N 0.32 1.07 -0.71 2.17 -1.24 0.34 -1.83 115.58 115.71 2crq h ASN 68 Ca 0.54 -0.05 0.05 0.00 0.71 0.00 0.00 56.30 57.56 2crq h ASN 68 Cb 1.05 -0.27 -0.04 0.00 0.73 0.00 0.00 38.32 39.79 2crq h ASN 68 CO -0.57 0.80 0.46 1.56 -1.29 0.00 0.00 177.43 178.40 2crq h GLN 69 N 1.25 0.76 0.00 6.67 4.20 0.35 -0.11 115.11 128.22 2crq h GLN 69 Ca 0.33 -0.05 -0.12 0.00 0.06 0.00 0.00 58.65 58.88 2crq h GLN 69 Cb -0.10 -0.17 -0.02 0.00 0.30 0.00 0.00 27.48 27.50 2crq h GLN 69 CO -0.07 0.50 -0.55 0.82 -0.67 0.00 0.00 178.83 178.87 2crq h ILE 70 N 0.78 1.05 0.00 2.54 2.04 -0.96 -3.14 117.51 119.82 2crq h ILE 70 Ca 0.30 -2.17 -0.10 0.00 1.00 0.00 0.00 64.86 63.89 2crq h ILE 70 Cb 0.18 2.30 -0.01 0.00 -0.74 0.00 0.00 36.82 38.55 2crq h ILE 70 CO -0.09 0.54 -0.47 0.25 0.00 0.00 0.00 178.15 178.37 2crq h LEU 71 N 0.00 0.00 -1.05 1.44 5.85 -0.37 -3.16 115.31 118.03 2crq h LEU 71 Ca -0.01 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.71 2crq h LEU 71 Cb 1.26 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.29 2crq h LEU 71 CO 0.07 0.47 0.00 0.00 -0.34 0.00 0.00 178.44 178.64 2crq n GLN 72 N -3.24 0.14 0.02 1.25 1.13 -0.20 -1.03 117.38 115.45 2crq n GLN 72 Ca 0.02 0.55 0.07 0.00 -1.94 0.00 0.00 57.00 55.70 2crq n GLN 72 Cb 0.71 -1.88 -0.10 0.00 0.11 0.00 0.00 30.24 29.08 2crq n GLN 72 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 2crq n THR 73 N -2.16 0.53 -2.50 5.09 -2.24 -1.19 -4.40 114.28 107.41 2crq n THR 73 Ca -0.00 -0.58 -0.15 0.00 -2.27 0.00 0.00 64.05 61.05 2crq n THR 73 Cb 0.09 -0.28 0.03 0.00 -2.10 0.00 0.00 70.33 68.07 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 -2.54 2.47 0.00 -0.78 -0.00 -0.34 -4.85 117.12 111.08 2crq n MET 74 Ca -0.07 -3.85 0.07 0.00 -0.00 0.00 0.00 57.70 53.86 2crq n MET 74 Cb 0.67 -1.84 0.40 0.00 -0.00 0.00 0.00 33.22 32.44 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 -0.47 0.30 0.00 3.17 -0.04 -0.19 0.54 135.00 138.31 2crq n PRO 75 Ca 0.25 0.10 0.00 0.00 -0.04 0.00 0.00 63.50 63.81 2crq n PRO 75 Cb 0.81 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.77 2crq n PRO 75 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 2crq n ASP 76 N -1.20 0.46 0.00 3.54 5.75 -1.26 -4.78 116.55 119.06 2crq n ASP 76 Ca 0.08 -1.02 0.00 0.00 -0.01 0.00 0.00 54.79 53.84 2crq n ASP 76 Cb 0.10 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.19 2crq n ASP 76 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2crq n ILE 77 N -0.01 0.00 -3.84 2.12 3.06 -0.99 -4.84 119.36 114.85 2crq n ILE 77 Ca 0.00 -0.02 -0.12 0.00 -2.50 0.00 0.00 62.75 60.11 2crq n ILE 77 Cb 0.15 0.39 -0.11 0.00 0.54 0.00 0.00 39.64 40.62 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 -1.38 -0.38 0.12 1.51 0.00 0.19 -3.35 121.76 118.47 2crq s ALA 78 Ca 0.00 0.13 0.03 0.00 0.00 0.00 0.00 51.96 52.12 2crq s ALA 78 Cb 0.00 -0.05 -0.04 0.00 0.00 0.00 0.00 23.12 23.02 2crq s ALA 78 CO 0.00 -0.16 -0.07 -0.08 0.00 0.00 0.00 175.76 175.45 2crq s THR 79 N -0.78 0.85 -0.43 0.00 -1.32 0.44 -4.20 115.64 110.21 2crq s THR 79 Ca -0.09 -1.98 -0.27 0.00 -1.21 0.00 0.00 61.69 58.14 2crq s THR 79 Cb -0.05 -1.78 -0.07 0.00 -1.51 0.00 0.00 72.50 69.09 2crq s THR 79 CO 0.01 -0.80 2.37 0.49 -2.21 0.00 0.00 174.62 174.48 2crq n PHE 80 N -0.11 1.55 0.07 9.09 3.72 -1.26 -2.84 117.46 127.68 2crq n PHE 80 Ca -0.11 0.07 -0.08 0.00 -0.05 0.00 0.00 57.45 57.27 2crq n PHE 80 Cb 0.61 -2.65 -0.06 0.00 -0.94 0.00 0.00 39.48 36.44 2crq n PHE 80 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 2crq h SER 81 N 17.88 -0.23 -3.58 4.37 0.87 -1.77 -3.43 113.55 127.66 2crq h SER 81 Ca -0.28 -0.21 -0.64 0.00 -1.23 0.00 0.00 61.79 59.42 2crq h SER 81 Cb 1.27 0.06 -0.40 0.00 -0.44 0.00 0.00 62.40 62.89 2crq h SER 81 CO 1.11 0.30 -0.73 -0.55 -0.53 0.00 0.00 176.83 176.42 2crq s SER 82 N -5.35 4.57 0.06 6.23 0.15 -1.22 -4.97 113.70 113.18 2crq s SER 82 Ca -0.09 -1.99 -0.35 0.00 0.70 0.00 0.00 55.95 54.21 2crq s SER 82 Cb 0.00 -1.45 -0.18 0.00 -1.71 0.00 0.00 66.02 62.68 2crq s SER 82 CO 0.33 -0.38 0.87 -1.14 1.20 0.00 0.00 173.24 174.13 2crq n ARG 83 N 4.40 0.00 -2.20 5.44 3.00 -1.26 -3.69 116.66 122.34 2crq n ARG 83 Ca 0.02 0.00 -0.42 0.00 -0.00 0.00 0.00 57.85 57.45 2crq n ARG 83 Cb 0.42 -1.30 -0.03 0.00 0.00 0.00 0.00 32.46 31.55 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 -0.29 4.34 0.04 -0.14 0.04 -1.26 -4.83 135.00 132.91 2crq s PRO 84 Ca 0.80 2.04 -0.01 0.00 0.04 0.00 0.00 61.00 63.86 2crq s PRO 84 Cb -1.12 -3.26 -0.03 0.00 0.04 0.00 0.00 34.50 30.13 2crq s PRO 84 CO 0.55 -0.41 -0.02 -1.59 0.04 0.00 0.00 177.00 175.57 2crq s LYS 85 N 1.04 0.53 -0.21 4.56 0.00 -1.24 -4.95 119.74 119.47 2crq s LYS 85 Ca 0.64 -1.02 -0.29 0.00 0.00 0.00 0.00 55.97 55.30 2crq s LYS 85 Cb -0.36 0.19 -0.04 0.00 0.00 0.00 0.00 37.83 37.62 2crq s LYS 85 CO 0.30 -0.10 1.86 0.00 0.00 0.00 0.00 175.35 177.41 2crq s ALA 86 N -3.15 3.08 0.31 0.59 0.00 -1.26 -3.26 121.76 118.06 2crq s ALA 86 Ca -0.00 0.61 0.07 0.00 0.00 0.00 0.00 51.96 52.64 2crq s ALA 86 Cb 0.02 -3.95 -0.03 0.00 0.00 0.00 0.00 23.12 19.17 2crq s ALA 86 CO -0.07 -2.27 0.25 0.96 0.00 0.00 0.00 175.76 174.62 2crq s ILE 87 N 6.28 3.83 -1.09 0.00 -4.36 0.60 -4.53 121.20 121.93 2crq s ILE 87 Ca 0.83 -1.40 -0.05 0.00 -0.26 0.00 0.00 60.65 59.77 2crq s ILE 87 Cb -0.29 -3.25 0.01 0.00 1.25 0.00 0.00 42.46 40.18 2crq s ILE 87 CO 0.33 -0.24 0.94 0.54 0.24 0.00 0.00 174.94 176.75 2crq n ARG 88 N -1.29 -6.30 0.00 0.37 1.74 -1.26 -2.96 116.66 106.96 2crq n ARG 88 Ca -0.04 0.70 0.00 0.00 -0.77 0.00 0.00 57.85 57.74 2crq n ARG 88 Cb 0.59 -5.32 0.00 0.00 -1.02 0.00 0.00 32.46 26.71 2crq n ARG 88 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2crq n GLY 89 N -1.55 2.32 0.00 -0.13 0.00 -1.26 -4.35 105.19 100.22 2crq n GLY 89 Ca -0.08 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.50 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 -1.10 1.74 -0.02 0.00 -1.15 -5.04 105.19 99.62 2crq n GLY 90 Ca 0.00 0.24 0.00 0.00 0.00 0.00 0.00 46.02 46.26 2crq n GLY 90 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2crq n THR 91 N 0.00 0.08 -4.29 2.61 -2.24 -1.19 -4.99 114.28 104.26 2crq n THR 91 Ca 0.00 0.03 -0.28 0.00 -2.27 0.00 0.00 64.05 61.53 2crq n THR 91 Cb 0.00 -0.76 -0.10 0.00 -2.10 0.00 0.00 70.33 67.37 2crq n THR 91 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2crq s ALA 92 N -2.00 2.88 0.12 6.98 0.00 -1.23 -4.11 121.76 124.39 2crq s ALA 92 Ca 0.00 -1.43 0.05 0.00 0.00 0.00 0.00 51.96 50.58 2crq s ALA 92 Cb 0.00 -0.72 -0.04 0.00 0.00 0.00 0.00 23.12 22.36 2crq s ALA 92 CO 0.00 0.51 0.03 0.45 0.00 0.00 0.00 175.76 176.75 2crq s SER 93 N -2.63 5.11 -0.04 0.00 0.15 -0.97 -0.29 113.70 115.03 2crq s SER 93 Ca 0.23 -0.20 0.02 0.00 0.70 0.00 0.00 55.95 56.70 2crq s SER 93 Cb -0.09 -1.23 0.02 0.00 -1.71 0.00 0.00 66.02 63.00 2crq s SER 93 CO 0.14 0.14 -0.07 -0.32 1.20 0.00 0.00 173.24 174.33 2crq s MET 94 N -2.59 1.02 0.05 5.44 0.00 -1.20 -1.82 119.30 120.20 2crq s MET 94 Ca 0.27 -0.20 -0.12 0.00 0.00 0.00 0.00 55.69 55.64 2crq s MET 94 Cb -0.11 -0.95 0.02 0.00 0.00 0.00 0.00 34.83 33.79 2crq s MET 94 CO 0.20 -0.02 0.27 0.00 0.00 0.00 0.00 175.02 175.47 2crq s VAL 96 N -2.65 1.85 0.07 0.00 1.01 -1.24 -0.56 120.40 118.88 2crq s VAL 96 Ca -0.04 -2.22 0.08 0.00 0.00 0.00 0.00 61.98 59.80 2crq s VAL 96 Cb -0.01 -2.19 -0.03 0.00 0.00 0.00 0.00 36.38 34.15 2crq s VAL 96 CO -0.04 -0.49 -0.23 -0.36 0.00 0.00 0.00 175.10 173.98 2crq s PHE 97 N -2.90 1.98 0.07 5.22 0.40 -1.08 -2.19 117.98 119.47 2crq s PHE 97 Ca 0.26 -0.39 -0.08 0.00 -0.60 0.00 0.00 56.93 56.11 2crq s PHE 97 Cb -0.00 -1.14 -0.00 0.00 0.51 0.00 0.00 43.02 42.38 2crq s PHE 97 CO 0.10 0.16 0.16 -0.98 0.70 0.00 0.00 175.22 175.36 2crq s ARG 98 N -1.50 0.75 0.42 0.44 1.70 -1.13 -3.93 118.95 115.71 2crq s ARG 98 Ca 0.09 -0.87 -0.23 0.00 -0.47 0.00 0.00 55.73 54.26 2crq s ARG 98 Cb -0.09 0.30 -0.09 0.00 -0.57 0.00 0.00 34.95 34.49 2crq s ARG 98 CO 0.03 -0.22 1.01 -1.58 -1.08 0.00 0.00 175.30 173.46 2crq s HIS 99 N -3.37 3.25 -0.50 5.89 5.65 -1.26 -0.42 115.29 124.54 2crq s HIS 99 Ca 0.01 1.63 -0.27 0.00 0.25 0.00 0.00 55.06 56.68 2crq s HIS 99 Cb 0.03 -3.03 -0.02 0.00 -1.18 0.00 0.00 32.58 28.38 2crq s HIS 99 CO -0.08 -0.47 1.86 -0.51 -0.65 0.00 0.00 174.74 174.88 2crq s LEU 100 N -2.92 3.38 -0.09 8.88 1.43 -1.21 -4.73 118.68 123.42 2crq s LEU 100 Ca 0.60 0.75 -0.02 0.00 -1.03 0.00 0.00 54.13 54.43 2crq s LEU 100 Cb -0.17 -2.91 -0.04 0.00 0.03 0.00 0.00 46.19 43.09 2crq s LEU 100 CO 0.22 -2.14 -0.10 -0.24 0.23 0.00 0.00 176.35 174.32 2crq n SER 101 N 11.95 1.74 0.29 2.29 2.88 -1.26 -4.53 113.62 126.99 2crq n SER 101 Ca 0.22 0.04 -0.11 0.00 -1.33 0.00 0.00 58.87 57.69 2crq n SER 101 Cb 0.50 -0.20 -0.05 0.00 -0.75 0.00 0.00 64.21 63.70 2crq n SER 101 CO 0.00 0.00 0.00 0.50 -1.23 0.00 0.00 175.04 174.31 2crq h LYS 102 N -0.19 -0.72 -5.22 -1.46 1.63 -2.03 -3.46 116.57 105.13 2crq h LYS 102 Ca -0.21 0.05 -0.55 0.00 -0.85 0.00 0.00 60.65 59.10 2crq h LYS 102 Cb 1.23 0.16 -0.13 0.00 -0.60 0.00 0.00 32.23 32.89 2crq h LYS 102 CO -0.09 -0.48 -0.57 -1.59 -3.45 0.00 0.00 179.45 173.27 2crq s LYS 103 N -4.29 1.85 -1.40 1.90 -2.85 -1.26 -4.83 119.74 108.86 2crq s LYS 103 Ca -0.11 -2.09 -0.06 0.00 -1.00 0.00 0.00 55.97 52.72 2crq s LYS 103 Cb 0.01 -0.97 0.03 0.00 -2.06 0.00 0.00 37.83 34.84 2crq s LYS 103 CO 0.33 -0.28 0.82 0.39 0.10 0.00 0.00 175.35 176.70 2crq n GLU 104 N -0.87 -5.20 -1.96 1.78 1.02 -1.26 -4.77 120.64 109.39 2crq n GLU 104 Ca -0.06 0.61 -0.29 0.00 -0.02 0.00 0.00 57.16 57.40 2crq n GLU 104 Cb 0.66 -5.30 0.11 0.00 -0.02 0.00 0.00 31.44 26.89 2crq n GLU 104 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2crq s GLU 105 N -6.25 1.72 -0.43 3.49 0.41 -1.26 -4.81 118.70 111.56 2crq s GLU 105 Ca 0.28 -0.07 -0.09 0.00 -0.41 0.00 0.00 54.97 54.67 2crq s GLU 105 Cb -0.14 -1.97 0.09 0.00 -1.78 0.00 0.00 34.13 30.33 2crq s GLU 105 CO 0.82 -1.71 0.28 0.15 -0.49 0.00 0.00 175.26 174.31 2crq s LYS 106 N -5.59 2.58 0.45 1.61 1.02 -1.26 -5.07 119.74 113.48 2crq s LYS 106 Ca 0.64 -1.52 -0.25 0.00 0.02 0.00 0.00 55.97 54.87 2crq s LYS 106 Cb -0.09 -3.82 -0.09 0.00 -0.52 0.00 0.00 37.83 33.31 2crq s LYS 106 CO 0.49 -1.01 1.28 0.45 -0.92 0.00 0.00 175.35 175.65 2crq n SER 107 N 4.92 2.54 -3.74 2.83 2.88 -1.26 -4.98 113.62 116.82 2crq n SER 107 Ca -0.10 1.07 0.02 0.00 -1.33 0.00 0.00 58.87 58.54 2crq n SER 107 Cb 0.42 -1.51 0.01 0.00 -0.75 0.00 0.00 64.21 62.38 2crq n SER 107 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2crq s GLY 108 N -0.62 -0.26 0.60 0.46 0.00 -1.26 -5.16 107.32 101.08 2crq s GLY 108 Ca 0.63 0.34 -0.17 0.00 0.00 0.00 0.00 44.72 45.52 2crq s GLY 108 CO 0.56 3.37 1.12 2.56 0.00 0.00 0.00 173.10 180.72 2crq s PRO 109 N -2.15 3.10 -0.07 2.90 0.04 -1.26 -5.01 135.00 132.55 2crq s PRO 109 Ca 0.23 1.51 -0.11 0.00 0.04 0.00 0.00 61.00 62.68 2crq s PRO 109 Cb 0.02 -1.98 -0.04 0.00 0.04 0.00 0.00 34.50 32.55 2crq s PRO 109 CO -0.02 -1.03 -0.21 0.43 0.04 0.00 0.00 177.00 176.21 2crq n SER 110 N -1.80 1.52 -0.11 6.66 7.64 -1.26 -4.88 113.62 121.39 2crq n SER 110 Ca 0.11 0.24 -0.24 0.00 1.01 0.00 0.00 58.87 59.99 2crq n SER 110 Cb 0.51 -0.57 -0.11 0.00 -1.01 0.00 0.00 64.21 63.03 2crq n SER 110 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2crq n SER 111 N -3.99 1.90 0.00 6.43 2.88 -1.26 -5.36 113.62 114.22 2crq n SER 111 Ca -0.08 0.38 0.00 0.00 -1.33 0.00 0.00 58.87 57.84 2crq n SER 111 Cb 0.31 -0.91 0.00 0.00 -0.75 0.00 0.00 64.21 62.85 2crq n SER 111 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42