#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cqz h ILE 2 N 0.00 1.26 -0.94 3.17 5.03 -2.05 -2.82 117.51 121.15 2cqz h ILE 2 Ca 0.00 -0.70 0.01 0.00 -0.12 0.00 0.00 64.86 64.05 2cqz h ILE 2 Cb 0.00 0.14 -0.05 0.00 -3.03 0.00 0.00 36.82 33.88 2cqz h ILE 2 CO 0.00 0.31 0.61 -0.08 -0.68 0.00 0.00 178.15 178.30 2cqz h GLU 3 N 1.22 1.25 -0.04 2.37 4.81 -2.05 -0.54 114.58 121.59 2cqz h GLU 3 Ca 0.30 -0.09 -0.01 0.00 -0.13 0.00 0.00 59.36 59.44 2cqz h GLU 3 Cb 0.09 -0.28 -0.00 0.00 0.63 0.00 0.00 28.75 29.19 2cqz h GLU 3 CO -0.04 0.84 0.00 -0.22 -0.73 0.00 0.00 179.01 178.86 2cqz h LYS 4 N 1.28 0.07 -0.80 1.92 1.63 -1.95 -1.90 116.57 116.82 2cqz h LYS 4 Ca 0.34 -0.02 -0.01 0.00 -0.85 0.00 0.00 60.65 60.12 2cqz h LYS 4 Cb -0.12 -0.01 -0.04 0.00 -0.60 0.00 0.00 32.23 31.46 2cqz h LYS 4 CO -0.07 0.33 0.48 0.82 -3.45 0.00 0.00 179.45 177.56 2cqz h ILE 5 N -0.19 1.23 -0.19 2.00 2.04 -1.26 -1.15 117.51 119.98 2cqz h ILE 5 Ca 0.01 -0.50 -0.06 0.00 1.00 0.00 0.00 64.86 65.31 2cqz h ILE 5 Cb 0.29 0.11 -0.01 0.00 -0.74 0.00 0.00 36.82 36.47 2cqz h ILE 5 CO 0.00 0.24 -0.14 -0.07 0.00 0.00 0.00 178.15 178.18 2cqz h LEU 6 N 1.10 0.29 -0.09 1.44 3.38 -1.04 -0.84 115.31 119.56 2cqz h LEU 6 Ca 0.29 -0.07 -0.02 0.00 0.09 0.00 0.00 57.88 58.17 2cqz h LEU 6 Cb -0.03 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 40.64 2cqz h LEU 6 CO -0.05 0.46 -0.04 0.25 0.09 0.00 0.00 178.44 179.15 2cqz h LEU 7 N 0.29 0.18 -1.37 1.67 5.85 -0.62 -3.16 115.31 118.15 2cqz h LEU 7 Ca 0.06 -0.40 -0.05 0.00 0.84 0.00 0.00 57.88 58.33 2cqz h LEU 7 Cb 0.42 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.39 2cqz h LEU 7 CO 0.02 0.54 -0.23 0.58 -0.34 0.00 0.00 178.44 179.02 2cqz h VAL 8 N -0.18 0.67 0.00 1.05 2.07 -0.92 -2.25 116.25 116.68 2cqz h VAL 8 Ca 0.02 -1.00 0.00 0.00 0.82 0.00 0.00 66.70 66.54 2cqz h VAL 8 Cb 0.47 1.64 0.00 0.00 -1.52 0.00 0.00 31.29 31.89 2cqz h VAL 8 CO 0.01 0.22 0.00 0.00 0.02 0.00 0.00 177.57 177.82 2cqz n GLN 9 N -3.55 0.03 0.31 1.57 6.02 -0.35 -1.83 117.38 119.59 2cqz n GLN 9 Ca -0.01 0.31 0.19 0.00 -0.01 0.00 0.00 57.00 57.48 2cqz n GLN 9 Cb 0.38 -1.57 0.97 0.00 1.02 0.00 0.00 30.24 31.04 2cqz n GLN 9 CO 0.00 0.00 0.00 1.15 -1.01 0.00 0.00 177.06 177.20 2cqz h THR 10 N 0.00 0.13 0.00 5.09 2.02 -1.46 -1.32 112.91 117.38 2cqz h THR 10 Ca 0.00 -0.24 -0.01 0.00 0.77 0.00 0.00 66.41 66.93 2cqz h THR 10 Cb 0.24 1.21 -0.00 0.00 -1.74 0.00 0.00 68.15 67.85 2cqz h THR 10 CO 0.00 0.02 -0.04 -0.07 0.37 0.00 0.00 175.52 175.80 2cqz h LEU 11 N 0.00 0.00 -0.97 2.58 3.38 -1.58 -0.45 115.31 118.28 2cqz h LEU 11 Ca -0.00 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 2cqz h LEU 11 Cb 0.21 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 2cqz h LEU 11 CO 0.00 0.04 -0.42 0.11 0.09 0.00 0.00 178.44 178.26 2cqz h LYS 12 N 0.00 0.00 0.00 1.13 1.57 -1.46 -1.87 116.57 115.94 2cqz h LYS 12 Ca -0.00 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.68 2cqz h LYS 12 Cb 0.19 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.49 2cqz h LYS 12 CO 0.01 0.42 -1.66 0.54 -0.57 0.00 0.00 179.45 178.19 2cqz n ARG 13 N -3.66 0.64 -2.99 3.15 1.74 -0.26 -4.78 116.66 110.50 2cqz n ARG 13 Ca -0.01 0.02 -0.40 0.00 -0.77 0.00 0.00 57.85 56.69 2cqz n ARG 13 Cb 0.51 -1.67 -0.05 0.00 -1.02 0.00 0.00 32.46 30.23 2cqz n ARG 13 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2cqz s LEU 14 N -5.19 4.45 0.37 0.55 1.43 -0.72 -4.99 118.68 114.57 2cqz s LEU 14 Ca -0.05 1.44 -0.13 0.00 -1.03 0.00 0.00 54.13 54.36 2cqz s LEU 14 Cb 0.10 -3.22 -0.08 0.00 0.03 0.00 0.00 46.19 43.03 2cqz s LEU 14 CO 0.84 0.02 0.77 -2.16 0.23 0.00 0.00 176.35 176.05 2cqz s PRO 15 N -0.06 3.90 -0.65 1.29 0.04 -1.26 -0.89 135.00 137.37 2cqz s PRO 15 Ca 0.38 0.60 -0.28 0.00 0.04 0.00 0.00 61.00 61.74 2cqz s PRO 15 Cb -0.20 -2.39 0.03 0.00 0.04 0.00 0.00 34.50 31.97 2cqz s PRO 15 CO 0.23 0.04 1.27 1.03 0.04 0.00 0.00 177.00 179.60 2cqz s ARG 16 N -3.46 3.33 0.37 4.56 1.81 -0.88 -4.54 118.95 120.14 2cqz s ARG 16 Ca 0.53 0.06 0.09 0.00 -1.72 0.00 0.00 55.73 54.69 2cqz s ARG 16 Cb -0.10 -4.11 0.83 0.00 -0.45 0.00 0.00 34.95 31.12 2cqz s ARG 16 CO 0.25 -1.94 1.90 0.52 -0.68 0.00 0.00 175.30 175.36 2cqz h MET 17 N 10.02 0.65 -0.75 3.54 2.86 -1.91 -3.04 114.93 126.30 2cqz h MET 17 Ca -0.26 -0.04 0.16 0.00 -2.06 0.00 0.00 59.70 57.50 2cqz h MET 17 Cb 1.06 -0.15 -0.11 0.00 0.06 0.00 0.00 31.60 32.46 2cqz h MET 17 CO 1.23 0.43 0.20 0.78 1.06 0.00 0.00 176.91 180.61 2cqz h GLY 18 N 0.67 1.06 0.89 8.32 0.00 -1.90 -0.95 103.07 111.16 2cqz h GLY 18 Ca 0.39 -0.05 0.02 0.00 0.00 0.00 0.00 47.33 47.69 2cqz h GLY 18 CO -0.16 -0.19 0.18 1.49 0.00 0.00 0.00 176.54 177.86 2cqz h TRP 19 N 0.29 0.34 -0.38 5.60 -0.00 -1.90 -1.80 115.95 118.11 2cqz h TRP 19 Ca 0.42 0.01 0.04 0.00 -0.00 0.00 0.00 58.89 59.36 2cqz h TRP 19 Cb 0.72 -0.11 -0.04 0.00 -0.00 0.00 0.00 29.16 29.74 2cqz h TRP 19 CO -0.25 0.20 0.15 -0.07 -0.00 0.00 0.00 178.44 178.47 2cqz h LEU 20 N 0.38 0.18 -1.09 -4.49 3.38 -1.31 -0.02 115.31 112.35 2cqz h LEU 20 Ca 0.13 0.03 0.04 0.00 0.09 0.00 0.00 57.88 58.18 2cqz h LEU 20 Cb 0.02 0.01 -0.06 0.00 0.09 0.00 0.00 40.66 40.72 2cqz h LEU 20 CO -0.07 0.14 0.62 0.40 0.09 0.00 0.00 178.44 179.62 2cqz h ILE 21 N 0.32 1.14 0.00 1.22 2.04 -1.12 0.95 117.51 122.06 2cqz h ILE 21 Ca 0.17 -0.40 0.00 0.00 1.00 0.00 0.00 64.86 65.63 2cqz h ILE 21 Cb 0.13 -0.12 0.00 0.00 -0.74 0.00 0.00 36.82 36.08 2cqz h ILE 21 CO -0.16 0.21 0.00 0.29 0.00 0.00 0.00 178.15 178.50 2cqz n LYS 22 N -4.45 0.89 -0.84 2.37 4.76 -0.70 -4.88 118.16 115.31 2cqz n LYS 22 Ca 0.13 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.57 2cqz n LYS 22 Cb 0.12 -1.28 0.00 0.00 -1.84 0.00 0.00 35.03 32.03 2cqz n LYS 22 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2cqz n GLY 23 N 0.60 0.64 3.65 0.72 0.00 0.33 -4.85 105.19 106.28 2cqz n GLY 23 Ca 0.12 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.71 2cqz n GLY 23 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2cqz s VAL 24 N -2.27 4.24 0.03 1.61 1.01 -0.10 -4.93 120.40 119.99 2cqz s VAL 24 Ca 0.00 1.48 -0.22 0.00 0.00 0.00 0.00 61.98 63.24 2cqz s VAL 24 Cb 0.00 -4.03 -0.15 0.00 0.00 0.00 0.00 36.38 32.19 2cqz s VAL 24 CO 0.00 -0.22 1.40 1.56 0.00 0.00 0.00 175.10 177.85 2cqz h GLN 25 N 8.49 0.19 -2.68 2.72 1.08 -1.92 -3.36 115.11 119.63 2cqz h GLN 25 Ca -0.26 -0.08 -0.70 0.00 -1.45 0.00 0.00 58.65 56.17 2cqz h GLN 25 Cb 1.10 -0.01 -0.36 0.00 -0.05 0.00 0.00 27.48 28.17 2cqz h GLN 25 CO 0.99 0.52 0.00 0.39 -0.95 0.00 0.00 178.83 179.78 2cqz n GLU 26 N -4.76 3.25 -2.09 1.46 1.02 -1.26 -5.03 120.64 113.23 2cqz n GLU 26 Ca -0.07 -4.60 -0.36 0.00 -0.02 0.00 0.00 57.16 52.11 2cqz n GLU 26 Cb 0.25 -2.38 0.02 0.00 -0.02 0.00 0.00 31.44 29.30 2cqz n GLU 26 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 2cqz s PRO 27 N -2.38 3.29 0.99 3.49 0.04 -1.26 -5.00 135.00 134.17 2cqz s PRO 27 Ca 0.34 1.84 -0.11 0.00 0.04 0.00 0.00 61.00 63.11 2cqz s PRO 27 Cb 0.07 -2.13 0.18 0.00 0.04 0.00 0.00 34.50 32.65 2cqz s PRO 27 CO 0.01 -0.96 1.04 -0.85 0.04 0.00 0.00 177.00 176.28 2cqz n GLU 28 N -1.14 -0.98 -2.71 4.56 0.28 -1.26 -4.78 120.64 114.61 2cqz n GLU 28 Ca 0.11 -0.23 -0.21 0.00 -0.16 0.00 0.00 57.16 56.67 2cqz n GLU 28 Cb 0.49 -2.27 0.05 0.00 1.43 0.00 0.00 31.44 31.13 2cqz n GLU 28 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 177.13 175.43 2cqz s SER 29 N -2.52 5.15 0.28 -1.84 1.04 -1.26 -2.07 113.70 112.49 2cqz s SER 29 Ca 0.66 -0.19 -0.01 0.00 0.48 0.00 0.00 55.95 56.90 2cqz s SER 29 Cb -0.23 -0.61 0.41 0.00 0.10 0.00 0.00 66.02 65.69 2cqz s SER 29 CO 0.61 -1.23 1.81 0.40 0.98 0.00 0.00 173.24 175.81 2cqz h ILE 30 N 0.05 1.23 -0.69 -1.02 2.04 -0.76 -2.32 117.51 116.05 2cqz h ILE 30 Ca -0.40 -0.88 -0.06 0.00 1.00 0.00 0.00 64.86 64.52 2cqz h ILE 30 Cb 1.29 0.79 -0.03 0.00 -0.74 0.00 0.00 36.82 38.13 2cqz h ILE 30 CO 0.48 0.32 0.18 0.00 0.00 0.00 0.00 178.15 179.13 2cqz h ALA 31 N 1.34 1.02 -0.12 1.87 0.00 -1.61 0.04 119.26 121.80 2cqz h ALA 31 Ca 0.15 -0.23 0.03 0.00 0.00 0.00 0.00 54.91 54.86 2cqz h ALA 31 Cb 0.36 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 2cqz h ALA 31 CO 0.01 0.64 -0.06 -0.44 0.00 0.00 0.00 179.25 179.40 2cqz h ASP 32 N 1.03 -0.20 -0.07 0.00 3.32 -1.72 -0.45 116.42 118.33 2cqz h ASP 32 Ca 0.22 0.05 0.03 0.00 0.02 0.00 0.00 57.03 57.35 2cqz h ASP 32 Cb 0.34 0.11 -0.04 0.00 0.22 0.00 0.00 39.33 39.97 2cqz h ASP 32 CO -0.00 -0.09 -0.14 -0.74 -1.72 0.00 0.00 179.24 176.56 2cqz h HIS 33 N -0.06 -0.35 -0.82 4.55 2.76 -1.09 -2.20 115.15 117.95 2cqz h HIS 33 Ca 0.07 0.02 0.04 0.00 -2.20 0.00 0.00 60.37 58.30 2cqz h HIS 33 Cb 0.16 0.16 -0.05 0.00 1.55 0.00 0.00 27.41 29.23 2cqz h HIS 33 CO -0.19 -0.20 0.54 0.77 -1.30 0.00 0.00 177.93 177.55 2cqz h SER 34 N -0.20 0.85 -0.55 3.26 0.02 -0.65 -0.34 113.55 115.95 2cqz h SER 34 Ca 0.07 -0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 60.98 2cqz h SER 34 Cb 0.29 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.62 2cqz h SER 34 CO -0.18 0.57 0.22 0.15 -1.14 0.00 0.00 176.83 176.45 2cqz h PHE 35 N 0.98 0.84 -0.09 3.45 3.04 -0.59 -0.18 116.94 124.38 2cqz h PHE 35 Ca 0.34 -0.06 0.01 0.00 3.98 0.00 0.00 57.97 62.23 2cqz h PHE 35 Cb 0.10 -0.25 -0.01 0.00 2.56 0.00 0.00 35.95 38.35 2cqz h PHE 35 CO -0.00 0.68 0.02 0.78 -2.02 0.00 0.00 178.31 177.77 2cqz h GLY 36 N 0.75 0.10 0.48 2.40 0.00 -0.63 0.60 103.07 106.77 2cqz h GLY 36 Ca 0.18 -0.01 0.08 0.00 0.00 0.00 0.00 47.33 47.59 2cqz h GLY 36 CO -0.02 0.00 0.28 -2.08 0.00 0.00 0.00 176.54 174.73 2cqz h VAL 37 N 0.06 0.83 -0.77 4.60 2.07 -0.85 0.19 116.25 122.38 2cqz h VAL 37 Ca 0.04 -0.17 0.00 0.00 0.82 0.00 0.00 66.70 67.39 2cqz h VAL 37 Cb 0.03 0.29 -0.04 0.00 -1.52 0.00 0.00 31.29 30.05 2cqz h VAL 37 CO -0.05 0.09 0.49 0.00 0.02 0.00 0.00 177.57 178.12 2cqz h ALA 38 N 1.40 0.98 -0.29 1.67 0.00 -0.42 0.49 119.26 123.09 2cqz h ALA 38 Ca 0.31 -0.07 -0.13 0.00 0.00 0.00 0.00 54.91 55.02 2cqz h ALA 38 Cb 0.33 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 2cqz h ALA 38 CO -0.26 0.42 -0.31 0.35 0.00 0.00 0.00 179.25 179.44 2cqz h PHE 39 N 1.05 0.87 -0.59 0.00 3.57 0.38 -2.02 116.94 120.20 2cqz h PHE 39 Ca 0.28 -0.27 -0.06 0.00 3.53 0.00 0.00 57.97 61.45 2cqz h PHE 39 Cb -0.09 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 38.45 2cqz h PHE 39 CO -0.01 1.02 0.14 0.82 -2.23 0.00 0.00 178.31 178.05 2cqz h ILE 40 N 0.47 1.25 -0.63 1.41 2.04 -0.52 -1.04 117.51 120.48 2cqz h ILE 40 Ca 0.04 -0.91 0.07 0.00 1.00 0.00 0.00 64.86 65.06 2cqz h ILE 40 Cb 0.89 0.71 -0.06 0.00 -0.74 0.00 0.00 36.82 37.62 2cqz h ILE 40 CO 0.08 0.34 0.32 0.74 0.00 0.00 0.00 178.15 179.63 2cqz h THR 41 N 0.86 0.92 0.44 -0.27 2.02 -0.83 0.16 112.91 116.20 2cqz h THR 41 Ca 0.18 -0.20 -0.02 0.00 0.77 0.00 0.00 66.41 67.14 2cqz h THR 41 Cb 0.36 0.28 0.00 0.00 -1.74 0.00 0.00 68.15 67.05 2cqz h THR 41 CO 0.00 0.11 -0.21 0.25 0.37 0.00 0.00 175.52 176.04 2cqz h LEU 42 N 0.59 -0.50 -0.31 2.58 5.85 -0.93 -0.28 115.31 122.32 2cqz h LEU 42 Ca 0.29 -0.02 0.05 0.00 0.84 0.00 0.00 57.88 59.04 2cqz h LEU 42 Cb 0.23 0.13 -0.05 0.00 0.37 0.00 0.00 40.66 41.34 2cqz h LEU 42 CO -0.21 -0.30 0.01 0.58 -0.34 0.00 0.00 178.44 178.18 2cqz h VAL 43 N -0.66 0.78 -0.65 1.05 2.07 -0.81 -2.53 116.25 115.50 2cqz h VAL 43 Ca -0.06 -0.03 -0.07 0.00 0.82 0.00 0.00 66.70 67.36 2cqz h VAL 43 Cb 0.49 0.68 -0.03 0.00 -1.52 0.00 0.00 31.29 30.91 2cqz h VAL 43 CO 0.10 0.02 0.13 -0.07 0.02 0.00 0.00 177.57 177.77 2cqz h LEU 44 N 0.10 1.01 -0.86 2.57 3.38 -0.68 -2.68 115.31 118.15 2cqz h LEU 44 Ca 0.15 -0.25 0.13 0.00 0.09 0.00 0.00 57.88 58.00 2cqz h LEU 44 Cb 0.19 -0.27 -0.09 0.00 0.09 0.00 0.00 40.66 40.59 2cqz h LEU 44 CO -0.24 1.00 0.47 0.00 0.09 0.00 0.00 178.44 179.75 2cqz h ALA 45 N 1.05 1.27 -0.49 1.53 0.00 -0.64 0.19 119.26 122.16 2cqz h ALA 45 Ca 0.20 0.06 -0.07 0.00 0.00 0.00 0.00 54.91 55.10 2cqz h ALA 45 Cb 0.40 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 2cqz h ALA 45 CO 0.01 -0.01 0.02 -0.44 0.00 0.00 0.00 179.25 178.83 2cqz h ASP 46 N 0.71 0.83 -0.26 0.00 3.45 -1.23 -0.10 116.42 119.82 2cqz h ASP 46 Ca 0.45 -0.30 0.00 0.00 0.43 0.00 0.00 57.03 57.61 2cqz h ASP 46 Cb 0.55 -0.22 -0.01 0.00 -0.56 0.00 0.00 39.33 39.09 2cqz h ASP 46 CO -0.32 0.93 0.17 0.58 -1.57 0.00 0.00 179.24 179.03 2cqz h VAL 47 N 0.72 1.07 -0.76 -1.35 2.07 -0.82 -1.38 116.25 115.79 2cqz h VAL 47 Ca 0.14 -0.13 0.01 0.00 0.82 0.00 0.00 66.70 67.55 2cqz h VAL 47 Cb 0.49 0.69 -0.04 0.00 -1.52 0.00 0.00 31.29 30.91 2cqz h VAL 47 CO 0.02 0.07 0.50 -0.07 0.02 0.00 0.00 177.57 178.11 2cqz h LEU 48 N 0.35 0.85 -0.15 2.57 3.38 -0.51 -2.12 115.31 119.68 2cqz h LEU 48 Ca 0.09 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 2cqz h LEU 48 Cb -0.04 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 2cqz h LEU 48 CO -0.02 0.61 0.07 -0.33 0.09 0.00 0.00 178.44 178.86 2cqz h GLU 49 N 1.01 0.22 0.00 1.13 5.08 -0.21 -1.77 114.58 120.04 2cqz h GLU 49 Ca 0.28 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.61 2cqz h GLU 49 Cb -0.08 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.13 2cqz h GLU 49 CO -0.07 0.27 0.00 1.63 -1.00 0.00 0.00 179.01 179.84 2cqz n LYS 50 N -4.90 0.12 -0.70 2.33 5.02 -0.60 -2.81 118.16 116.62 2cqz n LYS 50 Ca -0.05 0.19 0.03 0.00 -2.02 0.00 0.00 58.31 56.46 2cqz n LYS 50 Cb 0.09 -1.50 0.28 0.00 -0.02 0.00 0.00 35.03 33.89 2cqz n LYS 50 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2cqz n ARG 51 N -1.38 3.23 0.00 1.97 1.74 -0.74 -4.95 116.66 116.53 2cqz n ARG 51 Ca 0.06 -3.00 0.00 0.00 -0.77 0.00 0.00 57.85 54.14 2cqz n ARG 51 Cb 0.14 -1.99 0.00 0.00 -1.02 0.00 0.00 32.46 29.59 2cqz n ARG 51 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2cqz n GLY 52 N -0.37 3.05 3.57 -0.13 0.00 -1.12 -4.98 105.19 105.22 2cqz n GLY 52 Ca 0.29 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.88 2cqz n GLY 52 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2cqz s LYS 53 N -0.15 3.57 0.07 1.61 2.47 -0.74 -5.00 119.74 121.56 2cqz s LYS 53 Ca 0.00 0.26 -0.29 0.00 -1.56 0.00 0.00 55.97 54.38 2cqz s LYS 53 Cb 0.00 -3.95 -0.05 0.00 -1.46 0.00 0.00 37.83 32.37 2cqz s LYS 53 CO 0.00 -1.37 0.92 0.50 0.16 0.00 0.00 175.35 175.56 2cqz s ARG 54 N 4.19 4.62 0.10 4.03 3.00 -1.26 -3.43 118.95 130.20 2cqz s ARG 54 Ca 0.41 1.35 0.09 0.00 -1.00 0.00 0.00 55.73 56.58 2cqz s ARG 54 Cb -0.09 -3.40 -0.03 0.00 0.00 0.00 0.00 34.95 31.43 2cqz s ARG 54 CO 0.27 0.16 -0.22 0.42 0.00 0.00 0.00 175.30 175.93 2cqz s ILE 55 N 0.26 1.81 -1.07 4.11 -1.09 -1.26 -5.02 121.20 118.95 2cqz s ILE 55 Ca 0.46 -1.54 -0.18 0.00 -2.23 0.00 0.00 60.65 57.16 2cqz s ILE 55 Cb -0.22 -1.63 0.12 0.00 -1.58 0.00 0.00 42.46 39.15 2cqz s ILE 55 CO 0.28 0.00 1.34 -0.62 -1.23 0.00 0.00 174.94 174.71 2cqz s ASP 56 N -1.85 6.77 0.23 3.58 -1.08 -1.26 -4.85 116.67 118.20 2cqz s ASP 56 Ca 0.08 -2.28 -0.07 0.00 -0.52 0.00 0.00 52.55 49.76 2cqz s ASP 56 Cb -0.10 -2.45 0.33 0.00 -1.46 0.00 0.00 42.92 39.24 2cqz s ASP 56 CO 0.04 -1.05 1.79 0.58 0.52 0.00 0.00 175.17 177.05 2cqz h VAL 57 N 5.61 0.88 -0.16 1.11 2.07 -1.98 -1.00 116.25 122.77 2cqz h VAL 57 Ca 0.25 -0.22 0.04 0.00 0.82 0.00 0.00 66.70 67.58 2cqz h VAL 57 Cb 0.96 0.17 -0.04 0.00 -1.52 0.00 0.00 31.29 30.86 2cqz h VAL 57 CO 1.24 0.12 -0.09 -0.08 0.02 0.00 0.00 177.57 178.78 2cqz h GLU 58 N 0.65 -0.08 -0.74 1.57 4.81 -2.00 0.33 114.58 119.12 2cqz h GLU 58 Ca 0.35 0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.58 2cqz h GLU 58 Cb 0.34 0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.70 2cqz h GLU 58 CO -0.25 -0.05 0.45 -0.22 -0.73 0.00 0.00 179.01 178.21 2cqz h LYS 59 N -0.08 1.00 -0.32 1.92 3.64 -1.83 -1.81 116.57 119.09 2cqz h LYS 59 Ca 0.09 -0.09 -0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2cqz h LYS 59 Cb 0.22 -0.21 -0.02 0.00 -0.41 0.00 0.00 32.23 31.81 2cqz h LYS 59 CO -0.21 0.71 0.20 0.00 -2.27 0.00 0.00 179.45 177.87 2cqz h ALA 60 N 1.24 0.41 -0.73 5.00 0.00 -0.55 0.62 119.26 125.25 2cqz h ALA 60 Ca 0.27 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 55.08 2cqz h ALA 60 Cb -0.04 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.59 2cqz h ALA 60 CO -0.05 -0.10 0.24 -0.07 0.00 0.00 0.00 179.25 179.27 2cqz h LEU 61 N 0.42 1.05 -0.41 0.00 3.38 -0.72 0.14 115.31 119.18 2cqz h LEU 61 Ca 0.12 -0.19 -0.09 0.00 0.09 0.00 0.00 57.88 57.80 2cqz h LEU 61 Cb -0.01 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.45 2cqz h LEU 61 CO -0.02 0.97 -0.11 0.11 0.09 0.00 0.00 178.44 179.48 2cqz h LYS 62 N 1.09 0.80 -0.48 1.13 1.57 -1.13 -1.74 116.57 117.80 2cqz h LYS 62 Ca 0.24 -0.31 -0.03 0.00 -1.87 0.00 0.00 60.65 58.68 2cqz h LYS 62 Cb 0.29 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.53 2cqz h LYS 62 CO -0.01 0.93 0.19 1.98 -0.57 0.00 0.00 179.45 181.96 2cqz h MET 63 N 0.61 0.69 -0.31 3.15 4.05 -0.45 -0.44 114.93 122.24 2cqz h MET 63 Ca 0.10 -0.10 -0.18 0.00 -0.28 0.00 0.00 59.70 59.25 2cqz h MET 63 Cb 0.63 -0.13 -0.00 0.00 -0.80 0.00 0.00 31.60 31.31 2cqz h MET 63 CO 0.04 0.57 -0.50 0.00 0.23 0.00 0.00 176.91 177.25 2cqz h ALA 64 N 1.53 0.47 -0.42 0.39 0.00 -0.50 -0.56 119.26 120.17 2cqz h ALA 64 Ca 0.17 -0.50 -0.10 0.00 0.00 0.00 0.00 54.91 54.48 2cqz h ALA 64 Cb 0.14 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 2cqz h ALA 64 CO -0.02 0.66 -0.14 0.82 0.00 0.00 0.00 179.25 180.57 2cqz h ILE 65 N 0.67 1.26 0.00 0.00 2.04 -0.75 -3.26 117.51 117.47 2cqz h ILE 65 Ca 0.02 -1.21 0.00 0.00 1.00 0.00 0.00 64.86 64.67 2cqz h ILE 65 Cb 1.11 1.09 0.00 0.00 -0.74 0.00 0.00 36.82 38.28 2cqz h ILE 65 CO 0.11 0.41 -1.14 0.52 0.00 0.00 0.00 178.15 178.06 2cqz n VAL 66 N -4.15 0.37 -0.36 1.67 0.31 -0.22 -4.59 118.33 111.36 2cqz n VAL 66 Ca 0.01 -0.43 0.27 0.00 -0.01 0.00 0.00 64.34 64.18 2cqz n VAL 66 Cb 0.38 -0.11 0.52 0.00 -0.91 0.00 0.00 33.84 33.73 2cqz n VAL 66 CO 0.00 0.00 0.00 1.12 -1.32 0.00 0.00 176.83 176.63 2cqz h HIS 67 N 0.00 0.78 -0.33 3.52 2.07 -1.14 0.01 115.15 120.06 2cqz h HIS 67 Ca 0.00 0.03 0.00 0.00 -2.85 0.00 0.00 60.37 57.55 2cqz h HIS 67 Cb 0.90 -0.21 0.00 0.00 2.57 0.00 0.00 27.41 30.67 2cqz h HIS 67 CO 0.00 -0.13 0.00 -0.25 -3.07 0.00 0.00 177.93 174.48 2cqz n ASP 68 N -4.87 3.34 -0.18 3.10 8.00 -1.26 -4.71 116.55 119.96 2cqz n ASP 68 Ca 0.32 -2.36 0.26 0.00 0.71 0.00 0.00 54.79 53.72 2cqz n ASP 68 Cb 1.06 -0.35 0.67 0.00 -0.02 0.00 0.00 41.12 42.48 2cqz n ASP 68 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 2cqz h LEU 69 N 2.06 0.09 -1.62 0.64 5.85 -1.25 -0.59 115.31 120.49 2cqz h LEU 69 Ca 0.00 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.73 2cqz h LEU 69 Cb 1.00 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 42.03 2cqz h LEU 69 CO 0.08 0.03 0.00 0.00 -0.34 0.00 0.00 178.44 178.22 2cqz h ALA 70 N 1.58 1.00 0.00 1.25 0.00 -1.84 -1.98 119.26 119.27 2cqz h ALA 70 Ca 0.42 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.33 2cqz h ALA 70 Cb 1.54 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.33 2cqz h ALA 70 CO -0.05 0.00 0.00 0.93 0.00 0.00 0.00 179.25 180.13 2cqz h GLU 71 N 0.00 0.00 -0.07 0.00 5.08 -1.40 -1.40 114.58 116.79 2cqz h GLU 71 Ca 0.00 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.38 2cqz h GLU 71 Cb 0.27 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.52 2cqz h GLU 71 CO 0.00 0.00 0.12 0.00 -1.00 0.00 0.00 179.01 178.13 2cqz h ALA 72 N 2.18 1.44 0.00 3.43 0.00 -1.53 0.51 119.26 125.29 2cqz h ALA 72 Ca 0.00 -0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.74 2cqz h ALA 72 Cb 0.48 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.25 2cqz h ALA 72 CO 0.00 -0.16 -1.57 -0.89 0.00 0.00 0.00 179.25 176.63 2cqz n ILE 73 N -3.46 0.56 0.87 0.00 5.41 -1.03 -4.76 119.36 116.96 2cqz n ILE 73 Ca -0.01 -0.17 0.12 0.00 1.00 0.00 0.00 62.75 63.69 2cqz n ILE 73 Cb 0.21 -1.34 0.31 0.00 -0.71 0.00 0.00 39.64 38.11 2cqz n ILE 73 CO 0.00 0.00 0.00 2.30 0.00 0.00 0.00 176.55 178.85 2cqz n ILE 74 N -3.21 0.12 -0.26 1.39 -5.35 -0.56 -5.05 119.36 106.45 2cqz n ILE 74 Ca -0.19 -0.09 0.02 0.00 -0.27 0.00 0.00 62.75 62.23 2cqz n ILE 74 Cb 0.66 -0.03 -0.01 0.00 -1.74 0.00 0.00 39.64 38.52 2cqz n ILE 74 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 2cqz n THR 75 N -1.70 -0.24 -2.01 7.28 -2.24 0.18 -4.54 114.28 111.00 2cqz n THR 75 Ca 0.05 0.19 -0.41 0.00 -2.27 0.00 0.00 64.05 61.61 2cqz n THR 75 Cb 0.37 -0.29 -0.01 0.00 -2.10 0.00 0.00 70.33 68.29 2cqz n THR 75 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2cqz n ASP 76 N -2.25 4.00 -4.65 3.42 2.03 -1.26 -4.78 116.55 113.06 2cqz n ASP 76 Ca -0.01 -2.83 -0.43 0.00 0.52 0.00 0.00 54.79 52.03 2cqz n ASP 76 Cb 0.11 -1.63 -0.03 0.00 -0.72 0.00 0.00 41.12 38.85 2cqz n ASP 76 CO 0.00 0.00 0.00 -0.38 -1.92 0.00 0.00 177.20 174.90 2cqz n ILE 77 N 6.00 0.68 -1.85 5.18 5.41 -1.26 -4.05 119.36 129.47 2cqz n ILE 77 Ca 0.50 -0.19 -0.38 0.00 1.00 0.00 0.00 62.75 63.68 2cqz n ILE 77 Cb 0.43 -2.31 0.04 0.00 -0.71 0.00 0.00 39.64 37.09 2cqz n ILE 77 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 2cqz s PRO 78 N 4.78 3.06 0.41 0.38 0.04 -1.26 -4.83 135.00 137.57 2cqz s PRO 78 Ca 0.92 2.11 0.17 0.00 0.04 0.00 0.00 61.00 64.24 2cqz s PRO 78 Cb -0.45 -2.15 1.07 0.00 0.04 0.00 0.00 34.50 33.02 2cqz s PRO 78 CO 0.42 -1.21 1.82 1.25 0.04 0.00 0.00 177.00 179.32 2cqz h LEU 79 N 1.26 0.44 -1.90 -3.56 6.46 -1.99 0.54 115.31 116.56 2cqz h LEU 79 Ca -0.51 0.06 0.00 0.00 -0.12 0.00 0.00 57.88 57.31 2cqz h LEU 79 Cb 1.30 -0.02 0.00 0.00 -0.73 0.00 0.00 40.66 41.21 2cqz h LEU 79 CO 0.56 0.15 0.00 0.77 -0.62 0.00 0.00 178.44 179.30 2cqz h SER 80 N 0.42 0.00 0.21 1.25 4.64 -2.02 -2.50 113.55 115.57 2cqz h SER 80 Ca 0.52 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.80 2cqz h SER 80 Cb 1.28 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.37 2cqz h SER 80 CO -0.23 0.00 -1.82 0.00 -0.87 0.00 0.00 176.83 173.91 2cqz n ALA 81 N -2.02 2.61 0.66 5.18 0.00 0.18 -4.32 120.51 122.80 2cqz n ALA 81 Ca -0.01 -0.54 0.04 0.00 0.00 0.00 0.00 53.44 52.93 2cqz n ALA 81 Cb 0.19 -0.78 0.23 0.00 0.00 0.00 0.00 19.45 19.09 2cqz n ALA 81 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2cqz n GLN 82 N -2.41 0.33 0.11 0.00 6.02 -0.94 -0.95 117.38 119.54 2cqz n GLN 82 Ca -0.06 0.00 0.12 0.00 -0.01 0.00 0.00 57.00 57.05 2cqz n GLN 82 Cb 0.63 -1.37 0.27 0.00 1.02 0.00 0.00 30.24 30.79 2cqz n GLN 82 CO 0.00 0.00 0.00 1.49 -1.01 0.00 0.00 177.06 177.54 2cqz h GLU 83 N 0.00 0.00 0.00 -1.09 4.81 -1.75 -3.32 114.58 113.23 2cqz h GLU 83 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2cqz h GLU 83 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 2cqz h GLU 83 CO 0.00 0.00 -0.22 1.19 -0.73 0.00 0.00 179.01 179.25 2cqz n PHE 84 N -2.37 0.00 -4.32 0.92 3.72 -0.12 -5.01 117.46 110.29 2cqz n PHE 84 Ca 0.04 0.00 -0.23 0.00 -0.05 0.00 0.00 57.45 57.21 2cqz n PHE 84 Cb 0.46 -0.01 -0.17 0.00 -0.94 0.00 0.00 39.48 38.83 2cqz n PHE 84 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 2cqz s VAL 85 N -1.30 0.87 -1.08 -4.37 1.01 -0.82 -5.07 120.40 109.63 2cqz s VAL 85 Ca 0.00 -0.30 -0.22 0.00 0.00 0.00 0.00 61.98 61.46 2cqz s VAL 85 Cb 0.01 -0.84 0.02 0.00 0.00 0.00 0.00 36.38 35.57 2cqz s VAL 85 CO 0.07 0.30 1.68 -0.62 0.00 0.00 0.00 175.10 176.53 2cqz s ASP 86 N 0.93 6.13 0.26 3.32 -1.08 -1.26 -4.39 116.67 120.58 2cqz s ASP 86 Ca -0.10 -1.55 -0.04 0.00 -0.52 0.00 0.00 52.55 50.34 2cqz s ASP 86 Cb -0.15 -2.57 0.33 0.00 -1.46 0.00 0.00 42.92 39.07 2cqz s ASP 86 CO 0.01 -1.87 1.87 0.50 0.52 0.00 0.00 175.17 176.20 2cqz h LYS 87 N 9.58 1.08 -0.45 4.34 3.64 -1.97 -2.70 116.57 130.10 2cqz h LYS 87 Ca 0.24 -0.14 0.01 0.00 -1.27 0.00 0.00 60.65 59.49 2cqz h LYS 87 Cb 0.97 -0.20 -0.03 0.00 -0.41 0.00 0.00 32.23 32.56 2cqz h LYS 87 CO 1.37 0.82 0.28 -0.44 -2.27 0.00 0.00 179.45 179.21 2cqz h ASP 88 N 1.08 0.47 0.14 4.20 3.32 -1.99 0.22 116.42 123.85 2cqz h ASP 88 Ca 0.27 -0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.31 2cqz h ASP 88 Cb 0.08 -0.11 -0.00 0.00 0.22 0.00 0.00 39.33 39.52 2cqz h ASP 88 CO -0.04 0.34 -0.09 0.50 -1.72 0.00 0.00 179.24 178.23 2cqz h LYS 89 N 0.57 -0.21 -0.89 3.56 3.64 -1.93 -2.42 116.57 118.90 2cqz h LYS 89 Ca 0.17 0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.58 2cqz h LYS 89 Cb -0.03 0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 31.80 2cqz h LYS 89 CO -0.06 -0.14 0.58 0.00 -2.27 0.00 0.00 179.45 177.56 2cqz h ALA 90 N 0.64 1.14 -0.14 5.00 0.00 -1.13 -2.58 119.26 122.19 2cqz h ALA 90 Ca -0.01 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 54.87 2cqz h ALA 90 Cb 0.19 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 2cqz h ALA 90 CO 0.01 0.49 -0.00 0.93 0.00 0.00 0.00 179.25 180.68 2cqz h GLU 91 N 1.17 0.05 -0.89 0.00 5.08 -0.28 -2.37 114.58 117.34 2cqz h GLU 91 Ca 0.34 -0.00 0.07 0.00 -1.00 0.00 0.00 59.36 58.76 2cqz h GLU 91 Cb -0.09 -0.01 -0.06 0.00 0.50 0.00 0.00 28.75 29.09 2cqz h GLU 91 CO -0.09 0.03 0.55 0.00 -1.00 0.00 0.00 179.01 178.51 2cqz h ALA 92 N 1.12 1.23 0.40 3.43 0.00 -1.24 -2.03 119.26 122.18 2cqz h ALA 92 Ca 0.06 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 2cqz h ALA 92 Cb 0.08 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 2cqz h ALA 92 CO -0.11 0.29 -0.33 -0.07 0.00 0.00 0.00 179.25 179.02 2cqz h LEU 93 N 0.99 -0.88 -0.61 0.00 3.38 -1.04 0.28 115.31 117.42 2cqz h LEU 93 Ca 0.39 0.07 0.13 0.00 0.09 0.00 0.00 57.88 58.56 2cqz h LEU 93 Cb 0.20 0.29 -0.11 0.00 0.09 0.00 0.00 40.66 41.13 2cqz h LEU 93 CO -0.18 -0.49 -0.05 0.58 0.09 0.00 0.00 178.44 178.38 2cqz h VAL 94 N -0.74 0.46 -0.54 1.22 2.07 -1.23 0.21 116.25 117.70 2cqz h VAL 94 Ca -0.03 -0.02 -0.05 0.00 0.82 0.00 0.00 66.70 67.41 2cqz h VAL 94 Cb 0.65 0.38 -0.02 0.00 -1.52 0.00 0.00 31.29 30.77 2cqz h VAL 94 CO -0.02 0.01 0.12 -0.26 0.02 0.00 0.00 177.57 177.44 2cqz h PHE 95 N 0.07 0.86 -0.09 1.57 0.04 -1.08 1.24 116.94 119.55 2cqz h PHE 95 Ca 0.31 -0.08 -0.06 0.00 2.80 0.00 0.00 57.97 60.94 2cqz h PHE 95 Cb 0.50 -0.25 0.00 0.00 2.20 0.00 0.00 35.95 38.40 2cqz h PHE 95 CO -0.41 0.73 -0.16 0.87 -0.60 0.00 0.00 178.31 178.73 2cqz h LYS 96 N 0.80 0.27 0.11 1.51 1.57 0.61 0.13 116.57 121.58 2cqz h LYS 96 Ca 0.17 -0.17 -0.25 0.00 -1.87 0.00 0.00 60.65 58.53 2cqz h LYS 96 Cb 0.31 0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.64 2cqz h LYS 96 CO 0.00 0.76 -1.27 -0.22 -0.57 0.00 0.00 179.45 178.15 2cqz h LYS 97 N -0.18 0.23 0.08 3.15 3.64 -0.54 -3.37 116.57 119.59 2cqz h LYS 97 Ca 0.01 -0.40 -0.36 0.00 -1.27 0.00 0.00 60.65 58.63 2cqz h LYS 97 Cb 0.74 0.15 -0.03 0.00 -0.41 0.00 0.00 32.23 32.67 2cqz h LYS 97 CO 0.04 1.19 -2.06 0.28 -2.27 0.00 0.00 179.45 176.63 2cqz n VAL 98 N -4.00 1.69 -2.56 2.00 0.31 0.42 -4.62 118.33 111.57 2cqz n VAL 98 Ca -0.23 -0.67 -0.25 0.00 -0.01 0.00 0.00 64.34 63.18 2cqz n VAL 98 Cb 0.87 -1.52 -0.00 0.00 -0.91 0.00 0.00 33.84 32.27 2cqz n VAL 98 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 2cqz n PHE 99 N -3.35 3.18 -0.27 3.52 3.72 -0.78 -4.89 117.46 118.60 2cqz n PHE 99 Ca -0.32 -3.18 0.13 0.00 -0.05 0.00 0.00 57.45 54.03 2cqz n PHE 99 Cb 1.04 -0.16 0.40 0.00 -0.94 0.00 0.00 39.48 39.82 2cqz n PHE 99 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 2cqz h PRO 100 N 2.67 0.62 0.00 -1.08 0.13 -0.91 0.17 132.00 133.61 2cqz h PRO 100 Ca 0.23 -0.04 -0.01 0.00 -0.87 0.00 0.00 66.00 65.32 2cqz h PRO 100 Cb 0.91 -0.14 -0.00 0.00 0.13 0.00 0.00 31.00 31.90 2cqz h PRO 100 CO 0.80 0.41 -0.04 1.05 -0.23 0.00 0.00 178.00 180.00 2cqz h GLU 101 N 0.64 0.00 -0.32 0.86 9.09 -1.90 -2.27 114.58 120.68 2cqz h GLU 101 Ca 0.46 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.87 2cqz h GLU 101 Cb 0.81 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.91 2cqz h GLU 101 CO -0.21 0.04 0.00 1.19 0.05 0.00 0.00 179.01 180.08 2cqz n PHE 102 N -3.29 0.42 -0.21 2.06 3.72 0.54 -4.64 117.46 116.06 2cqz n PHE 102 Ca -0.02 -0.36 0.00 0.00 -0.05 0.00 0.00 57.45 57.02 2cqz n PHE 102 Cb 0.18 -0.02 0.24 0.00 -0.94 0.00 0.00 39.48 38.95 2cqz n PHE 102 CO 0.00 0.00 0.00 -0.92 -0.05 0.00 0.00 176.76 175.79 2cqz h TYR 103 N 2.59 0.94 -0.44 1.38 3.20 -0.89 -1.89 116.97 121.86 2cqz h TYR 103 Ca 0.00 0.01 -0.05 0.00 3.14 0.00 0.00 58.73 61.84 2cqz h TYR 103 Cb 0.73 -0.32 -0.02 0.00 1.54 0.00 0.00 36.73 38.67 2cqz h TYR 103 CO 0.21 0.61 0.09 1.49 -1.64 0.00 0.00 178.16 178.92 2cqz h GLU 104 N 1.00 0.72 -0.57 1.82 4.57 -1.82 0.22 114.58 120.52 2cqz h GLU 104 Ca 0.27 -0.18 -0.03 0.00 -1.18 0.00 0.00 59.36 58.24 2cqz h GLU 104 Cb -0.09 -0.09 -0.03 0.00 -0.16 0.00 0.00 28.75 28.39 2cqz h GLU 104 CO -0.05 0.73 0.25 -0.07 -1.18 0.00 0.00 179.01 178.68 2cqz h LEU 105 N 0.58 0.76 0.39 1.64 3.38 -1.83 -1.02 115.31 119.22 2cqz h LEU 105 Ca 0.14 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 57.93 2cqz h LEU 105 Cb 0.35 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.91 2cqz h LEU 105 CO 0.01 0.70 -0.19 0.22 0.09 0.00 0.00 178.44 179.27 2cqz h TYR 106 N 0.77 -0.49 -0.36 1.13 3.20 -1.09 -1.48 116.97 118.65 2cqz h TYR 106 Ca 0.19 -0.01 0.07 0.00 3.14 0.00 0.00 58.73 62.12 2cqz h TYR 106 Cb 0.16 0.16 -0.07 0.00 1.54 0.00 0.00 36.73 38.52 2cqz h TYR 106 CO 0.00 -0.27 -0.12 -0.09 -1.64 0.00 0.00 178.16 176.05 2cqz h ARG 107 N -0.59 -0.03 -0.46 1.82 1.12 -0.39 -1.04 114.38 114.81 2cqz h ARG 107 Ca -0.05 0.00 -0.04 0.00 -1.11 0.00 0.00 59.98 58.78 2cqz h ARG 107 Cb 0.44 0.01 -0.02 0.00 -0.01 0.00 0.00 29.97 30.38 2cqz h ARG 107 CO 0.09 -0.02 0.12 1.49 -3.11 0.00 0.00 179.97 178.53 2cqz h GLU 108 N -0.04 0.68 -0.36 0.20 4.81 -1.16 -2.74 114.58 115.98 2cqz h GLU 108 Ca 0.18 -0.12 -0.01 0.00 -0.13 0.00 0.00 59.36 59.27 2cqz h GLU 108 Cb 0.31 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.56 2cqz h GLU 108 CO -0.39 0.62 0.18 -0.92 -0.73 0.00 0.00 179.01 177.77 2cqz h TYR 109 N 0.67 0.50 0.00 0.92 3.20 -0.12 -2.67 116.97 119.47 2cqz h TYR 109 Ca 0.15 -0.02 -0.04 0.00 3.14 0.00 0.00 58.73 61.96 2cqz h TYR 109 Cb 0.24 -0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.35 2cqz h TYR 109 CO 0.01 0.41 -0.21 1.96 -1.64 0.00 0.00 178.16 178.70 2cqz h GLN 110 N 0.44 0.00 0.00 1.82 1.08 -1.03 -2.43 115.11 114.99 2cqz h GLN 110 Ca 0.12 0.00 -0.10 0.00 -1.45 0.00 0.00 58.65 57.22 2cqz h GLN 110 Cb 0.09 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.51 2cqz h GLN 110 CO -0.02 0.21 -0.49 0.93 -0.95 0.00 0.00 178.83 178.50 2cqz h GLU 111 N 0.00 0.00 -6.43 1.46 5.08 -1.19 -3.47 114.58 110.03 2cqz h GLU 111 Ca -0.00 0.00 -0.49 0.00 -1.00 0.00 0.00 59.36 57.87 2cqz h GLU 111 Cb 0.43 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.62 2cqz h GLU 111 CO 0.03 0.49 -0.84 0.00 -1.00 0.00 0.00 179.01 177.69 2cqz n SER 113 N -2.90 1.20 -4.73 0.00 7.64 -1.26 -4.75 113.62 108.82 2cqz n SER 113 Ca -0.16 0.20 -0.32 0.00 1.01 0.00 0.00 58.87 59.60 2cqz n SER 113 Cb 0.61 -0.47 0.11 0.00 -1.01 0.00 0.00 64.21 63.45 2cqz n SER 113 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2cqz s SER 114 N -6.21 3.99 0.21 6.43 1.04 -1.26 -4.82 113.70 113.08 2cqz s SER 114 Ca -0.19 2.04 -0.09 0.00 0.48 0.00 0.00 55.95 58.19 2cqz s SER 114 Cb 0.06 -2.55 0.24 0.00 0.10 0.00 0.00 66.02 63.87 2cqz s SER 114 CO 0.25 -2.39 1.80 -0.65 0.98 0.00 0.00 173.24 173.24 2cqz h PRO 115 N -1.13 0.65 -0.18 4.02 0.11 -1.96 -1.69 132.00 131.82 2cqz h PRO 115 Ca -0.44 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.62 2cqz h PRO 115 Cb 1.25 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 2cqz h PRO 115 CO 0.48 0.43 0.09 0.93 -0.21 0.00 0.00 178.00 179.73 2cqz h GLU 116 N 0.67 0.26 -0.72 1.05 3.07 -1.92 -0.90 114.58 116.10 2cqz h GLU 116 Ca 0.30 -0.04 0.03 0.00 -0.50 0.00 0.00 59.36 59.16 2cqz h GLU 116 Cb 0.20 -0.05 -0.04 0.00 -0.84 0.00 0.00 28.75 28.02 2cqz h GLU 116 CO -0.19 0.28 0.48 0.00 -1.40 0.00 0.00 179.01 178.18 2cqz h ALA 117 N 0.97 1.57 -0.02 3.43 0.00 -1.77 -1.31 119.26 122.13 2cqz h ALA 117 Ca 0.06 -0.04 -0.23 0.00 0.00 0.00 0.00 54.91 54.71 2cqz h ALA 117 Cb 0.10 -0.25 0.01 0.00 0.00 0.00 0.00 17.79 17.65 2cqz h ALA 117 CO -0.01 0.35 -0.93 1.96 0.00 0.00 0.00 179.25 180.62 2cqz h GLN 118 N 0.88 0.50 -0.22 0.00 4.20 -1.11 -2.60 115.11 116.76 2cqz h GLN 118 Ca 0.29 -0.51 0.01 0.00 0.06 0.00 0.00 58.65 58.49 2cqz h GLN 118 Cb 0.04 0.14 -0.02 0.00 0.30 0.00 0.00 27.48 27.95 2cqz h GLN 118 CO -0.08 1.15 0.11 1.25 -0.67 0.00 0.00 178.83 180.60 2cqz h LEU 119 N 0.29 0.18 -0.80 1.46 5.85 -0.53 0.30 115.31 122.06 2cqz h LEU 119 Ca -0.08 0.01 -0.07 0.00 0.84 0.00 0.00 57.88 58.57 2cqz h LEU 119 Cb 1.57 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 42.54 2cqz h LEU 119 CO 0.17 0.13 0.13 0.58 -0.34 0.00 0.00 178.44 179.12 2cqz h VAL 120 N 0.24 1.25 -0.65 1.05 2.07 -1.30 0.20 116.25 119.12 2cqz h VAL 120 Ca 0.09 -0.96 -0.04 0.00 0.82 0.00 0.00 66.70 66.61 2cqz h VAL 120 Cb 0.01 0.61 -0.03 0.00 -1.52 0.00 0.00 31.29 30.36 2cqz h VAL 120 CO -0.06 0.36 0.25 -0.09 0.02 0.00 0.00 177.57 178.06 2cqz h ARG 121 N 0.98 0.97 -0.20 1.57 9.65 -1.03 0.32 114.38 126.64 2cqz h ARG 121 Ca 0.20 -0.17 -0.07 0.00 -1.10 0.00 0.00 59.98 58.84 2cqz h ARG 121 Cb 0.38 -0.16 -0.00 0.00 -1.39 0.00 0.00 29.97 28.79 2cqz h ARG 121 CO 0.01 0.80 -0.17 0.82 2.80 0.00 0.00 179.97 184.23 2cqz h ILE 122 N 0.95 1.33 -0.47 1.20 2.04 -0.51 -2.27 117.51 119.77 2cqz h ILE 122 Ca 0.22 -1.31 0.03 0.00 1.00 0.00 0.00 64.86 64.80 2cqz h ILE 122 Cb 0.20 1.74 -0.03 0.00 -0.74 0.00 0.00 36.82 37.99 2cqz h ILE 122 CO -0.02 0.40 0.27 0.00 0.00 0.00 0.00 178.15 178.80 2cqz h ALA 123 N 0.66 0.60 -0.70 1.87 0.00 -0.57 0.18 119.26 121.29 2cqz h ALA 123 Ca 0.03 -0.00 0.09 0.00 0.00 0.00 0.00 54.91 55.03 2cqz h ALA 123 Cb 0.70 -0.12 -0.07 0.00 0.00 0.00 0.00 17.79 18.30 2cqz h ALA 123 CO 0.04 -0.05 0.35 0.22 0.00 0.00 0.00 179.25 179.81 2cqz h ASP 124 N 0.53 0.46 0.10 0.00 3.58 -0.29 -1.12 116.42 119.69 2cqz h ASP 124 Ca 0.19 0.06 -0.20 0.00 0.42 0.00 0.00 57.03 57.50 2cqz h ASP 124 Cb 0.04 -0.02 0.00 0.00 1.72 0.00 0.00 39.33 41.08 2cqz h ASP 124 CO -0.10 0.26 -0.76 0.11 -2.88 0.00 0.00 179.24 175.87 2cqz h LYS 125 N 0.60 0.56 -0.34 0.28 1.57 -0.74 -2.99 116.57 115.50 2cqz h LYS 125 Ca 0.34 -0.46 -0.04 0.00 -1.87 0.00 0.00 60.65 58.62 2cqz h LYS 125 Cb 0.36 0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.75 2cqz h LYS 125 CO -0.26 1.09 0.05 -0.07 -0.57 0.00 0.00 179.45 179.69 2cqz h LEU 126 N 0.38 0.54 -0.51 2.94 3.38 -0.15 -0.26 115.31 121.63 2cqz h LEU 126 Ca -0.04 -0.26 0.06 0.00 0.09 0.00 0.00 57.88 57.72 2cqz h LEU 126 Cb 1.36 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 41.91 2cqz h LEU 126 CO 0.14 0.67 0.22 -0.78 0.09 0.00 0.00 178.44 178.78 2cqz h ASP 127 N 0.40 0.28 -0.05 -0.43 3.58 -1.28 0.11 116.42 119.03 2cqz h ASP 127 Ca 0.10 0.04 -0.00 0.00 0.42 0.00 0.00 57.03 57.60 2cqz h ASP 127 Cb 0.36 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.40 2cqz h ASP 127 CO 0.01 0.19 0.03 -0.03 -2.88 0.00 0.00 179.24 176.56 2cqz h MET 128 N 0.43 0.07 0.07 0.28 4.05 -1.32 0.21 114.93 118.71 2cqz h MET 128 Ca 0.23 -0.01 0.00 0.00 -0.28 0.00 0.00 59.70 59.65 2cqz h MET 128 Cb 0.20 -0.01 -0.01 0.00 -0.80 0.00 0.00 31.60 30.98 2cqz h MET 128 CO -0.20 0.07 -0.06 0.82 0.23 0.00 0.00 176.91 177.77 2cqz h ILE 129 N 0.04 0.86 0.00 1.77 2.04 -0.59 0.99 117.51 122.62 2cqz h ILE 129 Ca 0.02 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.87 2cqz h ILE 129 Cb 0.02 0.86 -0.00 0.00 -0.74 0.00 0.00 36.82 36.96 2cqz h ILE 129 CO -0.00 0.00 -0.04 -0.07 0.00 0.00 0.00 178.15 178.04 2cqz h LEU 130 N -0.14 0.00 -0.05 1.44 3.38 -0.67 0.50 115.31 119.78 2cqz h LEU 130 Ca 0.00 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.73 2cqz h LEU 130 Cb 0.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.88 2cqz h LEU 130 CO -0.01 0.04 -1.07 -0.61 0.09 0.00 0.00 178.44 176.88 2cqz h GLN 131 N 0.00 0.33 -0.33 1.13 5.75 0.52 -2.31 115.11 120.21 2cqz h GLN 131 Ca -0.00 -0.43 -0.14 0.00 -0.15 0.00 0.00 58.65 57.93 2cqz h GLN 131 Cb 0.10 0.14 -0.01 0.00 1.07 0.00 0.00 27.48 28.78 2cqz h GLN 131 CO 0.01 1.14 -0.35 0.00 -2.65 0.00 0.00 178.83 176.98 2cqz h ALA 132 N 0.69 0.77 0.10 3.38 0.00 0.43 -2.02 119.26 122.61 2cqz h ALA 132 Ca -0.10 -0.43 0.01 0.00 0.00 0.00 0.00 54.91 54.40 2cqz h ALA 132 Cb 1.75 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 19.38 2cqz h ALA 132 CO 0.18 0.65 -0.19 -0.92 0.00 0.00 0.00 179.25 178.97 2cqz h TYR 133 N 0.62 -0.51 -1.01 0.00 3.20 -0.87 -1.69 116.97 116.72 2cqz h TYR 133 Ca 0.06 0.01 0.03 0.00 3.14 0.00 0.00 58.73 61.97 2cqz h TYR 133 Cb 0.88 0.21 -0.05 0.00 1.54 0.00 0.00 36.73 39.31 2cqz h TYR 133 CO 0.05 -0.28 0.66 0.37 -1.64 0.00 0.00 178.16 177.31 2cqz h GLN 134 N -0.37 1.27 0.00 1.82 -0.00 -1.26 -1.47 115.11 115.10 2cqz h GLN 134 Ca 0.03 -0.08 0.00 0.00 -0.00 0.00 0.00 58.65 58.60 2cqz h GLN 134 Cb 0.39 -0.29 0.00 0.00 0.00 0.00 0.00 27.48 27.58 2cqz h GLN 134 CO -0.11 0.84 0.00 0.66 0.00 0.00 0.00 178.83 180.22 2cqz n TYR 135 N -4.42 0.47 0.02 3.99 4.01 -0.77 -2.21 117.16 118.26 2cqz n TYR 135 Ca 0.13 0.17 -0.12 0.00 -0.16 0.00 0.00 57.90 57.92 2cqz n TYR 135 Cb 0.06 -0.77 -0.14 0.00 -0.31 0.00 0.00 39.34 38.18 2cqz n TYR 135 CO 0.00 0.00 0.00 0.93 -0.46 0.00 0.00 176.86 177.33 2cqz h GLU 136 N 0.00 0.11 0.00 -0.72 5.08 -0.36 -1.79 114.58 116.90 2cqz h GLU 136 Ca 0.00 -0.19 -0.06 0.00 -1.00 0.00 0.00 59.36 58.11 2cqz h GLU 136 Cb 0.42 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.73 2cqz h GLU 136 CO 0.00 0.87 -0.30 -0.07 -1.00 0.00 0.00 179.01 178.51 2cqz h LEU 137 N 0.03 0.00 0.00 1.33 3.38 -1.02 -0.41 115.31 118.62 2cqz h LEU 137 Ca -0.23 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.74 2cqz h LEU 137 Cb 1.97 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.72 2cqz h LEU 137 CO 0.12 0.30 0.00 -1.20 0.09 0.00 0.00 178.44 177.75 2cqz n SER 138 N -4.02 0.00 0.00 -0.43 7.64 -0.94 -4.91 113.62 110.97 2cqz n SER 138 Ca -0.02 0.18 0.00 0.00 1.01 0.00 0.00 58.87 60.04 2cqz n SER 138 Cb 0.36 -0.38 0.00 0.00 -1.01 0.00 0.00 64.21 63.18 2cqz n SER 138 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2cqz n GLY 139 N 1.02 0.99 3.70 0.23 0.00 -0.16 -5.08 105.19 105.88 2cqz n GLY 139 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 2cqz n GLY 139 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2cqz s ASN 140 N -1.98 6.92 -0.20 1.61 3.84 -0.68 -4.92 114.94 119.52 2cqz s ASN 140 Ca 0.00 2.08 0.16 0.00 0.21 0.00 0.00 52.86 55.31 2cqz s ASN 140 Cb 0.00 -2.57 0.57 0.00 -0.55 0.00 0.00 41.25 38.71 2cqz s ASN 140 CO 0.00 -0.65 1.48 2.29 -2.79 0.00 0.00 177.10 177.44 2cqz n LYS 141 N 4.89 3.11 -2.44 0.43 2.85 -1.26 -4.33 118.16 121.40 2cqz n LYS 141 Ca 0.12 -2.92 -0.15 0.00 -1.05 0.00 0.00 58.31 54.31 2cqz n LYS 141 Cb 0.44 -1.91 0.03 0.00 -0.65 0.00 0.00 35.03 32.94 2cqz n LYS 141 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 177.40 177.62 2cqz n ASN 142 N -0.42 3.36 -0.56 -5.58 2.04 -1.26 -4.70 115.26 108.14 2cqz n ASN 142 Ca 0.24 -3.06 0.06 0.00 -0.44 0.00 0.00 54.58 51.38 2cqz n ASN 142 Cb 0.97 -0.43 0.16 0.00 -2.53 0.00 0.00 39.78 37.94 2cqz n ASN 142 CO 0.00 0.00 0.00 0.18 -0.44 0.00 0.00 177.26 177.00 2cqz n LEU 143 N -0.55 3.00 -0.18 -4.53 4.77 -1.26 -4.77 117.00 113.47 2cqz n LEU 143 Ca 0.27 -2.38 -0.03 0.00 -0.03 0.00 0.00 56.01 53.83 2cqz n LEU 143 Cb 0.84 -0.30 0.03 0.00 -2.33 0.00 0.00 43.42 41.67 2cqz n LEU 143 CO 0.27 0.68 0.70 -0.78 -1.33 0.00 0.00 177.39 176.92 2cqz h ASP 144 N 1.45 -0.80 -0.75 -1.43 3.58 -1.95 -2.41 116.42 114.11 2cqz h ASP 144 Ca 0.00 0.19 0.17 0.00 0.42 0.00 0.00 57.03 57.81 2cqz h ASP 144 Cb 0.92 0.45 -0.11 0.00 1.72 0.00 0.00 39.33 42.30 2cqz h ASP 144 CO 0.06 -0.25 0.19 1.05 -2.88 0.00 0.00 179.24 177.41 2cqz h GLU 145 N -0.09 0.26 -0.49 0.28 4.11 -2.00 -1.62 114.58 115.04 2cqz h GLU 145 Ca 0.26 -0.02 0.14 0.00 0.07 0.00 0.00 59.36 59.81 2cqz h GLU 145 Cb 0.49 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.66 2cqz h GLU 145 CO -0.62 0.17 0.77 0.74 0.07 0.00 0.00 179.01 180.15 2cqz h PHE 146 N 0.27 0.00 0.00 2.06 0.04 -1.81 0.13 116.94 117.63 2cqz h PHE 146 Ca 0.43 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.20 2cqz h PHE 146 Cb 0.74 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.89 2cqz h PHE 146 CO -0.26 0.00 0.00 -1.49 -0.60 0.00 0.00 178.31 175.96 2cqz h TRP 147 N 0.00 0.00 0.00 -0.55 4.06 -1.45 -3.09 115.95 114.92 2cqz h TRP 147 Ca 0.23 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.18 2cqz h TRP 147 Cb 1.77 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.93 2cqz h TRP 147 CO 0.00 0.00 0.00 -0.85 -3.56 0.00 0.00 178.44 174.03 2cqz n GLU 148 N -2.35 0.90 0.12 0.49 0.28 0.47 -2.67 120.64 117.88 2cqz n GLU 148 Ca 0.04 0.00 0.13 0.00 -0.16 0.00 0.00 57.16 57.16 2cqz n GLU 148 Cb 0.35 -1.00 0.30 0.00 1.43 0.00 0.00 31.44 32.51 2cqz n GLU 148 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2cqz h ALA 149 N 2.80 0.90 -0.23 -1.84 0.00 -1.74 -3.01 119.26 116.14 2cqz h ALA 149 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 2cqz h ALA 149 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2cqz h ALA 149 CO 0.00 0.00 -0.30 0.82 0.00 0.00 0.00 179.25 179.77 2cqz h ILE 150 N 0.00 1.28 -0.27 0.00 2.04 -1.78 -1.46 117.51 117.32 2cqz h ILE 150 Ca 0.00 -1.36 -0.08 0.00 1.00 0.00 0.00 64.86 64.42 2cqz h ILE 150 Cb 0.80 1.44 -0.01 0.00 -0.74 0.00 0.00 36.82 38.31 2cqz h ILE 150 CO 0.00 0.43 -0.13 -0.33 0.00 0.00 0.00 178.15 178.12 2cqz h GLU 151 N 0.40 0.56 -0.41 2.37 4.39 -1.76 -2.10 114.58 118.03 2cqz h GLU 151 Ca 0.05 -0.25 0.06 0.00 0.34 0.00 0.00 59.36 59.56 2cqz h GLU 151 Cb 0.73 -0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 29.35 2cqz h GLU 151 CO 0.06 0.81 0.27 0.93 -1.16 0.00 0.00 179.01 179.92 2cqz h GLU 152 N 0.30 0.29 -0.22 2.33 5.08 -1.45 -1.01 114.58 119.90 2cqz h GLU 152 Ca 0.06 -0.02 -0.21 0.00 -1.00 0.00 0.00 59.36 58.19 2cqz h GLU 152 Cb 0.64 -0.06 0.01 0.00 0.50 0.00 0.00 28.75 29.84 2cqz h GLU 152 CO 0.04 0.19 -0.68 0.82 -1.00 0.00 0.00 179.01 178.38 2cqz h ILE 153 N 0.30 1.27 -0.16 3.13 2.04 -1.02 -3.13 117.51 119.94 2cqz h ILE 153 Ca 0.18 -1.86 0.02 0.00 1.00 0.00 0.00 64.86 64.19 2cqz h ILE 153 Cb 0.33 1.82 -0.01 0.00 -0.74 0.00 0.00 36.82 38.22 2cqz h ILE 153 CO -0.04 0.60 0.11 0.11 0.00 0.00 0.00 178.15 178.93 2cqz h LYS 154 N 0.60 0.14 0.00 2.37 1.79 -0.50 -1.52 116.57 119.45 2cqz h LYS 154 Ca -0.02 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.44 2cqz h LYS 154 Cb 1.30 -0.03 0.00 0.00 -1.58 0.00 0.00 32.23 31.92 2cqz h LYS 154 CO 0.14 0.09 0.00 0.54 -1.08 0.00 0.00 179.45 179.14 2cqz n ARG 155 N -4.51 0.10 -3.72 3.15 1.74 -1.02 -4.66 116.66 107.73 2cqz n ARG 155 Ca -0.00 0.23 -0.36 0.00 -0.77 0.00 0.00 57.85 56.96 2cqz n ARG 155 Cb 0.14 -1.50 -0.07 0.00 -1.02 0.00 0.00 32.46 30.00 2cqz n ARG 155 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2cqz s LEU 156 N -2.73 4.25 0.18 0.55 1.43 -0.57 -5.00 118.68 116.78 2cqz s LEU 156 Ca 0.08 0.34 -0.21 0.00 -1.03 0.00 0.00 54.13 53.31 2cqz s LEU 156 Cb 0.07 -2.15 0.10 0.00 0.03 0.00 0.00 46.19 44.24 2cqz s LEU 156 CO 0.18 0.21 1.60 -0.33 0.23 0.00 0.00 176.35 178.24 2cqz h GLU 157 N 6.34 -0.18 -1.08 1.70 5.08 -1.87 -1.53 114.58 123.03 2cqz h GLU 157 Ca -0.44 0.01 0.31 0.00 -1.00 0.00 0.00 59.36 58.25 2cqz h GLU 157 Cb 1.17 0.04 -0.04 0.00 0.50 0.00 0.00 28.75 30.42 2cqz h GLU 157 CO 0.73 -0.12 0.80 1.25 -1.00 0.00 0.00 179.01 180.67 2cqz h LEU 158 N -0.19 0.00 -2.04 1.33 5.85 -1.94 -0.69 115.31 117.63 2cqz h LEU 158 Ca 0.20 0.00 0.04 0.00 0.84 0.00 0.00 57.88 58.96 2cqz h LEU 158 Cb 0.52 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.54 2cqz h LEU 158 CO -0.58 0.00 0.10 0.77 -0.34 0.00 0.00 178.44 178.39 2cqz h SER 159 N 0.00 0.00 -1.14 1.25 4.64 -1.52 -2.15 113.55 114.63 2cqz h SER 159 Ca 0.51 0.00 0.36 0.00 -0.47 0.00 0.00 61.79 62.20 2cqz h SER 159 Cb 2.11 0.00 -0.13 0.00 -0.31 0.00 0.00 62.40 64.07 2cqz h SER 159 CO -0.01 0.00 0.70 0.50 -0.87 0.00 0.00 176.83 177.16 2cqz h LYS 160 N 0.00 0.22 -0.00 4.77 3.64 -1.27 1.14 116.57 125.07 2cqz h LYS 160 Ca 0.06 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 2cqz h LYS 160 Cb 0.26 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.03 2cqz h LYS 160 CO -0.00 0.14 -0.06 0.66 -2.27 0.00 0.00 179.45 177.92 2cqz n TYR 161 N -4.83 0.00 -0.79 1.91 4.01 -0.81 -4.02 117.16 112.64 2cqz n TYR 161 Ca 0.33 0.00 0.05 0.00 -0.16 0.00 0.00 57.90 58.11 2cqz n TYR 161 Cb 1.16 -0.15 0.06 0.00 -0.31 0.00 0.00 39.34 40.10 2cqz n TYR 161 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 2cqz n LEU 162 N -0.93 1.77 -0.21 7.72 4.77 0.39 -4.87 117.00 125.64 2cqz n LEU 162 Ca 0.17 -2.21 -0.03 0.00 -0.03 0.00 0.00 56.01 53.90 2cqz n LEU 162 Cb 0.24 -0.19 0.03 0.00 -2.33 0.00 0.00 43.42 41.17 2cqz n LEU 162 CO 0.22 0.52 0.66 -0.08 -1.33 0.00 0.00 177.39 177.39 2cqz h GLU 163 N 0.00 -0.11 -0.69 3.23 4.81 -1.60 -1.53 114.58 118.70 2cqz h GLU 163 Ca 0.00 0.01 0.14 0.00 -0.13 0.00 0.00 59.36 59.37 2cqz h GLU 163 Cb 0.87 0.02 -0.10 0.00 0.63 0.00 0.00 28.75 30.18 2cqz h GLU 163 CO 0.00 -0.07 0.19 0.38 -0.73 0.00 0.00 179.01 178.78 2cqz h ASP 164 N -0.11 0.09 -0.28 1.04 2.03 -1.91 -0.33 116.42 116.95 2cqz h ASP 164 Ca 0.26 0.12 -0.04 0.00 -0.73 0.00 0.00 57.03 56.64 2cqz h ASP 164 Cb 0.53 0.15 -0.01 0.00 -0.83 0.00 0.00 39.33 39.17 2cqz h ASP 164 CO -0.68 0.02 -0.00 0.40 -1.03 0.00 0.00 179.24 177.95 2cqz h ILE 165 N 0.32 1.26 0.00 4.15 2.04 -1.70 -2.25 117.51 121.32 2cqz h ILE 165 Ca 0.38 -0.93 -0.01 0.00 1.00 0.00 0.00 64.86 65.30 2cqz h ILE 165 Cb 0.59 1.32 -0.00 0.00 -0.74 0.00 0.00 36.82 37.99 2cqz h ILE 165 CO -0.44 0.30 -0.04 -0.07 0.00 0.00 0.00 178.15 177.90 2cqz h LEU 166 N 0.27 0.00 -0.18 1.44 3.38 -0.48 -1.43 115.31 118.32 2cqz h LEU 166 Ca 0.08 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.87 2cqz h LEU 166 Cb 0.43 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.19 2cqz h LEU 166 CO 0.01 0.04 -0.58 0.78 0.09 0.00 0.00 178.44 178.78 2cqz h ASN 167 N 0.00 0.82 -0.09 -0.43 4.21 -0.77 -1.52 115.58 117.80 2cqz h ASN 167 Ca -0.00 -0.60 -0.04 0.00 1.21 0.00 0.00 56.30 56.87 2cqz h ASN 167 Cb 0.08 -0.24 -0.01 0.00 -1.12 0.00 0.00 38.32 37.02 2cqz h ASN 167 CO 0.00 1.27 -0.06 0.28 -1.29 0.00 0.00 177.43 177.64 2cqz h SER 168 N 0.41 0.31 -0.01 5.81 0.02 -0.72 -1.01 113.55 118.37 2cqz h SER 168 Ca -0.02 -0.06 -0.00 0.00 -0.84 0.00 0.00 61.79 60.87 2cqz h SER 168 Cb 1.21 -0.08 -0.00 0.00 0.14 0.00 0.00 62.40 63.67 2cqz h SER 168 CO 0.12 0.42 -0.01 0.58 -1.14 0.00 0.00 176.83 176.80 2cqz h VAL 169 N 0.32 1.44 0.00 2.27 2.07 -1.17 -3.06 116.25 118.12 2cqz h VAL 169 Ca 0.07 -1.29 -0.02 0.00 0.82 0.00 0.00 66.70 66.28 2cqz h VAL 169 Cb 0.31 2.30 -0.00 0.00 -1.52 0.00 0.00 31.29 32.38 2cqz h VAL 169 CO 0.01 0.34 -0.07 1.23 0.02 0.00 0.00 177.57 179.10 2cqz h GLY 170 N -0.53 0.00 2.00 2.17 0.00 -1.10 -1.20 103.07 104.40 2cqz h GLY 170 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2cqz h GLY 170 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 176.54 176.45 2cqz h ARG 171 N 0.00 0.00 0.00 4.80 2.43 -1.09 -2.97 114.38 117.55 2cqz h ARG 171 Ca -0.00 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.15 2cqz h ARG 171 Cb 0.25 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.79 2cqz h ARG 171 CO 0.01 0.00 -0.09 -0.07 -1.51 0.00 0.00 179.97 178.31 2cqz h LEU 172 N 0.00 0.00 0.00 3.80 3.38 -1.16 -3.51 115.31 117.82 2cqz h LEU 172 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2cqz h LEU 172 Cb 0.58 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.33 2cqz h LEU 172 CO 0.00 0.09 0.00 1.17 0.09 0.00 0.00 178.44 179.79