#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 1.01 -0.24 3.17 5.03 -2.05 -2.71 117.51 121.72 2cqz h ILE 2 Ca 0.00 -0.13 -0.12 0.00 -0.12 0.00 0.00 64.86 64.49 2cqz h ILE 2 Cb 0.00 0.60 -0.01 0.00 -3.03 0.00 0.00 36.82 34.38 2cqz h ILE 2 CO 0.00 0.07 -0.36 -0.08 -0.68 0.00 0.00 178.15 177.10 2cqz h GLU 3 N 0.38 0.53 0.02 2.37 4.81 -2.05 -1.49 114.58 119.15 2cqz h GLU 3 Ca 0.16 -0.25 -0.00 0.00 -0.13 0.00 0.00 59.36 59.14 2cqz h GLU 3 Cb 0.15 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.53 2cqz h GLU 3 CO -0.04 0.81 -0.01 -0.22 -0.73 0.00 0.00 179.01 178.83 2cqz h LYS 4 N 0.45 -0.02 -0.35 1.92 1.63 -1.93 -2.32 116.57 115.95 2cqz h LYS 4 Ca 0.05 0.00 0.02 0.00 -0.85 0.00 0.00 60.65 59.87 2cqz h LYS 4 Cb 0.83 0.01 -0.03 0.00 -0.60 0.00 0.00 32.23 32.44 2cqz h LYS 4 CO 0.07 0.44 0.18 0.82 -3.45 0.00 0.00 179.45 177.51 2cqz h ILE 5 N -0.50 1.00 -0.57 2.00 2.04 -1.48 -0.56 117.51 119.44 2cqz h ILE 5 Ca -0.00 -0.13 0.06 0.00 1.00 0.00 0.00 64.86 65.79 2cqz h ILE 5 Cb 0.48 0.59 -0.03 0.00 -0.74 0.00 0.00 36.82 37.12 2cqz h ILE 5 CO 0.00 0.07 0.38 -0.07 0.00 0.00 0.00 178.15 178.53 2cqz h LEU 6 N 0.37 0.48 -0.04 1.44 3.38 -1.32 0.07 115.31 119.68 2cqz h LEU 6 Ca 0.14 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.10 2cqz h LEU 6 Cb 0.04 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 40.69 2cqz h LEU 6 CO -0.09 0.31 -0.01 0.25 0.09 0.00 0.00 178.44 178.99 2cqz h LEU 7 N 0.55 0.09 -1.85 1.67 5.85 -0.57 -2.97 115.31 118.07 2cqz h LEU 7 Ca 0.24 -0.39 -0.00 0.00 0.84 0.00 0.00 57.88 58.57 2cqz h LEU 7 Cb 0.27 -0.02 -0.00 0.00 0.37 0.00 0.00 40.66 41.27 2cqz h LEU 7 CO -0.07 0.46 -0.02 0.58 -0.34 0.00 0.00 178.44 179.04 2cqz h VAL 8 N -0.28 0.08 0.00 1.05 2.07 -0.70 -1.91 116.25 116.56 2cqz h VAL 8 Ca 0.01 -0.43 0.00 0.00 0.82 0.00 0.00 66.70 67.10 2cqz h VAL 8 Cb 0.42 1.39 0.00 0.00 -1.52 0.00 0.00 31.29 31.58 2cqz h VAL 8 CO 0.01 0.02 0.00 0.00 0.02 0.00 0.00 177.57 177.62 2cqz n GLN 9 N -3.15 0.05 0.30 1.57 6.02 -0.03 -2.40 117.38 119.73 2cqz n GLN 9 Ca -0.01 0.18 0.18 0.00 -0.01 0.00 0.00 57.00 57.35 2cqz n GLN 9 Cb 0.25 -1.57 0.93 0.00 1.02 0.00 0.00 30.24 30.86 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 0.15 0.00 5.09 2.02 -1.36 -1.77 112.91 117.03 2cqz h THR 10 Ca 0.00 -0.29 0.00 0.00 0.77 0.00 0.00 66.41 66.89 2cqz h THR 10 Cb 0.40 1.25 0.00 0.00 -1.74 0.00 0.00 68.15 68.05 2cqz h THR 10 CO 0.00 0.03 0.00 -0.07 0.37 0.00 0.00 175.52 175.85 2cqz h LEU 11 N 0.00 0.00 -0.64 2.58 3.38 -1.67 -0.44 115.31 118.52 2cqz h LEU 11 Ca -0.00 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 2cqz h LEU 11 Cb 0.25 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 2cqz h LEU 11 CO 0.00 0.00 -0.28 0.11 0.09 0.00 0.00 178.44 178.37 2cqz h LYS 12 N 0.00 0.00 0.00 1.13 1.57 -1.55 -1.86 116.57 115.86 2cqz h LYS 12 Ca 0.00 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.67 2cqz h LYS 12 Cb 0.18 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.47 2cqz h LYS 12 CO 0.00 0.28 -2.04 0.54 -0.57 0.00 0.00 179.45 177.66 2cqz n ARG 13 N -3.30 0.66 -2.62 3.15 1.74 -0.27 -4.78 116.66 111.25 2cqz n ARG 13 Ca 0.01 -0.11 -0.42 0.00 -0.77 0.00 0.00 57.85 56.56 2cqz n ARG 13 Cb 0.53 -1.55 -0.03 0.00 -1.02 0.00 0.00 32.46 30.40 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 -4.89 4.36 0.59 0.55 1.43 -0.66 -4.99 118.68 115.08 2cqz s LEU 14 Ca -0.08 1.76 -0.07 0.00 -1.03 0.00 0.00 54.13 54.71 2cqz s LEU 14 Cb 0.11 -3.57 -0.01 0.00 0.03 0.00 0.00 46.19 42.75 2cqz s LEU 14 CO 0.88 -0.33 0.93 -2.16 0.23 0.00 0.00 176.35 175.89 2cqz s PRO 15 N 1.09 3.13 -0.82 1.29 0.04 -1.26 -0.83 135.00 137.63 2cqz s PRO 15 Ca 0.54 0.22 -0.21 0.00 0.04 0.00 0.00 61.00 61.59 2cqz s PRO 15 Cb -0.23 -2.22 0.09 0.00 0.04 0.00 0.00 34.50 32.18 2cqz s PRO 15 CO 0.28 -0.64 1.10 1.03 0.04 0.00 0.00 177.00 178.81 2cqz s ARG 16 N -5.03 3.38 0.42 4.56 1.81 -0.63 -4.52 118.95 118.93 2cqz s ARG 16 Ca 0.53 -1.25 0.25 0.00 -1.72 0.00 0.00 55.73 53.54 2cqz s ARG 16 Cb -0.11 -4.65 1.29 0.00 -0.45 0.00 0.00 34.95 31.03 2cqz s ARG 16 CO 0.47 -1.85 1.68 0.52 -0.68 0.00 0.00 175.30 175.45 2cqz h MET 17 N 9.29 0.21 -0.99 3.54 2.86 -1.90 -2.68 114.93 125.25 2cqz h MET 17 Ca -0.04 -0.01 0.12 0.00 -2.06 0.00 0.00 59.70 57.71 2cqz h MET 17 Cb 1.04 -0.05 -0.08 0.00 0.06 0.00 0.00 31.60 32.57 2cqz h MET 17 CO 1.18 0.14 0.62 0.78 1.06 0.00 0.00 176.91 180.68 2cqz h GLY 18 N 0.21 1.62 0.92 8.32 0.00 -1.92 -1.65 103.07 110.57 2cqz h GLY 18 Ca 0.73 -0.42 -0.02 0.00 0.00 0.00 0.00 47.33 47.62 2cqz h GLY 18 CO -0.38 0.16 0.12 1.49 0.00 0.00 0.00 176.54 177.92 2cqz h TRP 19 N 0.98 0.46 -0.40 5.60 -0.00 -1.86 -2.33 115.95 118.40 2cqz h TRP 19 Ca 0.49 -0.04 0.03 0.00 -0.00 0.00 0.00 58.89 59.37 2cqz h TRP 19 Cb 0.48 -0.14 -0.03 0.00 -0.00 0.00 0.00 29.16 29.47 2cqz h TRP 19 CO -0.01 0.45 0.21 -0.07 -0.00 0.00 0.00 178.44 179.02 2cqz h LEU 20 N 0.33 0.31 -2.13 -4.49 3.38 -1.48 0.16 115.31 111.39 2cqz h LEU 20 Ca 0.10 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 2cqz h LEU 20 Cb 0.18 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 40.89 2cqz h LEU 20 CO -0.01 0.23 -0.03 0.40 0.09 0.00 0.00 178.44 179.12 2cqz h ILE 21 N 0.42 0.81 -0.31 1.22 2.04 -1.23 0.33 117.51 120.80 2cqz h ILE 21 Ca 0.17 -0.10 0.00 0.00 1.00 0.00 0.00 64.86 65.93 2cqz h ILE 21 Cb 0.06 1.06 0.00 0.00 -0.74 0.00 0.00 36.82 37.20 2cqz h ILE 21 CO -0.11 0.03 0.00 0.29 0.00 0.00 0.00 178.15 178.36 2cqz n LYS 22 N -4.20 1.93 -1.46 2.37 4.76 -0.07 -4.89 118.16 116.60 2cqz n LYS 22 Ca -0.03 -1.19 -0.07 0.00 -2.87 0.00 0.00 58.31 54.15 2cqz n LYS 22 Cb 0.11 -1.36 -0.02 0.00 -1.84 0.00 0.00 35.03 31.92 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 0.86 0.68 3.65 0.72 0.00 0.11 -4.81 105.19 106.40 2cqz n GLY 23 Ca 0.11 -0.70 -0.42 0.00 0.00 0.00 0.00 46.02 45.01 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 -2.28 4.78 0.00 1.61 1.01 0.36 -4.99 120.40 120.89 2cqz s VAL 24 Ca 0.00 1.74 0.00 0.00 0.00 0.00 0.00 61.98 63.72 2cqz s VAL 24 Cb 0.00 -4.19 0.00 0.00 0.00 0.00 0.00 36.38 32.19 2cqz s VAL 24 CO 0.00 -0.10 0.58 0.00 0.00 0.00 0.00 175.10 175.58 2cqz n GLN 25 N 6.06 0.00 -3.49 2.72 3.00 -1.26 -4.01 117.38 120.40 2cqz n GLN 25 Ca 0.08 0.23 -0.41 0.00 -0.01 0.00 0.00 57.00 56.88 2cqz n GLN 25 Cb 0.47 -1.08 -0.04 0.00 0.00 0.00 0.00 30.24 29.59 2cqz n GLN 25 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.06 175.85 2cqz s GLU 26 N -1.34 3.55 0.65 -1.09 2.02 -1.26 -5.02 118.70 116.22 2cqz s GLU 26 Ca 0.00 -2.98 -0.16 0.00 0.02 0.00 0.00 54.97 51.84 2cqz s GLU 26 Cb 0.00 -4.22 -0.00 0.00 0.10 0.00 0.00 34.13 30.00 2cqz s GLU 26 CO 0.00 -1.25 1.16 -1.25 0.02 0.00 0.00 175.26 173.94 2cqz s PRO 27 N -0.82 2.72 0.69 0.39 0.04 -1.26 -5.00 135.00 131.76 2cqz s PRO 27 Ca 0.25 1.63 -0.16 0.00 0.04 0.00 0.00 61.00 62.76 2cqz s PRO 27 Cb -0.11 -1.92 0.01 0.00 0.04 0.00 0.00 34.50 32.53 2cqz s PRO 27 CO -0.09 -1.36 1.20 -1.83 0.04 0.00 0.00 177.00 174.96 2cqz s GLU 28 N -3.76 2.43 0.67 4.56 -1.05 -1.26 -4.78 118.70 115.50 2cqz s GLU 28 Ca 0.72 1.75 -0.07 0.00 -0.15 0.00 0.00 54.97 57.22 2cqz s GLU 28 Cb -0.26 -1.87 0.04 0.00 -0.44 0.00 0.00 34.13 31.60 2cqz s GLU 28 CO 0.39 -1.61 0.99 -1.54 0.95 0.00 0.00 175.26 174.43 2cqz s SER 29 N -1.96 5.11 0.39 0.83 1.04 -1.26 -1.61 113.70 116.25 2cqz s SER 29 Ca 0.75 0.60 0.06 0.00 0.48 0.00 0.00 55.95 57.84 2cqz s SER 29 Cb -0.29 -1.37 0.79 0.00 0.10 0.00 0.00 66.02 65.25 2cqz s SER 29 CO 0.42 -1.41 2.03 0.40 0.98 0.00 0.00 173.24 175.66 2cqz h ILE 30 N -0.47 1.13 -0.26 -1.02 2.04 -0.77 -2.03 117.51 116.13 2cqz h ILE 30 Ca -0.45 -0.29 -0.11 0.00 1.00 0.00 0.00 64.86 65.01 2cqz h ILE 30 Cb 1.29 0.53 -0.01 0.00 -0.74 0.00 0.00 36.82 37.89 2cqz h ILE 30 CO 0.61 0.13 -0.32 0.00 0.00 0.00 0.00 178.15 178.57 2cqz h ALA 31 N 1.69 0.97 -0.54 1.87 0.00 -1.61 0.63 119.26 122.27 2cqz h ALA 31 Ca 0.15 -0.39 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 2cqz h ALA 31 Cb -0.01 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.64 2cqz h ALA 31 CO -0.03 0.61 0.30 -0.44 0.00 0.00 0.00 179.25 179.68 2cqz h ASP 32 N 0.46 0.67 0.25 0.00 3.32 -1.65 -0.98 116.42 118.49 2cqz h ASP 32 Ca 0.05 -0.09 -0.01 0.00 0.02 0.00 0.00 57.03 57.00 2cqz h ASP 32 Cb 0.78 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 40.17 2cqz h ASP 32 CO 0.06 0.57 -0.12 -0.74 -1.72 0.00 0.00 179.24 177.30 2cqz h HIS 33 N 0.72 -0.31 -0.92 4.55 2.76 -1.13 -2.11 115.15 118.72 2cqz h HIS 33 Ca 0.19 -0.01 0.12 0.00 -2.20 0.00 0.00 60.37 58.47 2cqz h HIS 33 Cb 0.05 0.10 -0.08 0.00 1.55 0.00 0.00 27.41 29.03 2cqz h HIS 33 CO -0.01 -0.11 0.54 0.77 -1.30 0.00 0.00 177.93 177.82 2cqz h SER 34 N -0.45 0.77 -0.38 3.26 0.02 -0.67 0.45 113.55 116.54 2cqz h SER 34 Ca -0.03 0.06 0.01 0.00 -0.84 0.00 0.00 61.79 60.98 2cqz h SER 34 Cb 0.34 -0.09 -0.02 0.00 0.14 0.00 0.00 62.40 62.77 2cqz h SER 34 CO 0.06 0.40 0.25 0.15 -1.14 0.00 0.00 176.83 176.55 2cqz h PHE 35 N 0.85 0.47 -0.58 3.45 3.04 -0.98 -0.97 116.94 122.23 2cqz h PHE 35 Ca 0.46 0.01 0.02 0.00 3.98 0.00 0.00 57.97 62.44 2cqz h PHE 35 Cb 0.49 -0.16 -0.04 0.00 2.56 0.00 0.00 35.95 38.81 2cqz h PHE 35 CO -0.04 0.30 0.36 0.78 -2.02 0.00 0.00 178.31 177.69 2cqz h GLY 36 N 0.51 0.83 0.96 2.40 0.00 -0.31 0.26 103.07 107.72 2cqz h GLY 36 Ca 0.14 -0.28 -0.00 0.00 0.00 0.00 0.00 47.33 47.19 2cqz h GLY 36 CO -0.03 0.24 0.15 -2.08 0.00 0.00 0.00 176.54 174.82 2cqz h VAL 37 N 0.72 1.12 -0.35 4.60 2.07 -0.70 -1.02 116.25 122.69 2cqz h VAL 37 Ca 0.23 -0.30 0.05 0.00 0.82 0.00 0.00 66.70 67.50 2cqz h VAL 37 Cb -0.01 0.84 -0.04 0.00 -1.52 0.00 0.00 31.29 30.56 2cqz h VAL 37 CO -0.08 0.11 0.09 0.00 0.02 0.00 0.00 177.57 177.71 2cqz h ALA 38 N 1.03 0.38 -0.51 1.67 0.00 -0.68 0.20 119.26 121.34 2cqz h ALA 38 Ca 0.09 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 2cqz h ALA 38 Cb 0.05 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 2cqz h ALA 38 CO -0.02 -0.31 0.25 0.35 0.00 0.00 0.00 179.25 179.52 2cqz h PHE 39 N 0.22 0.73 -0.19 0.00 3.57 -0.71 -0.43 116.94 120.13 2cqz h PHE 39 Ca 0.16 -0.03 -0.10 0.00 3.53 0.00 0.00 57.97 61.53 2cqz h PHE 39 Cb 0.16 -0.23 -0.01 0.00 2.79 0.00 0.00 35.95 38.66 2cqz h PHE 39 CO -0.17 0.57 -0.32 0.82 -2.23 0.00 0.00 178.31 176.99 2cqz h ILE 40 N 0.68 1.28 -0.48 1.41 2.04 -0.89 -1.05 117.51 120.50 2cqz h ILE 40 Ca 0.18 -1.36 -0.06 0.00 1.00 0.00 0.00 64.86 64.62 2cqz h ILE 40 Cb 0.11 1.49 -0.02 0.00 -0.74 0.00 0.00 36.82 37.67 2cqz h ILE 40 CO -0.02 0.42 0.07 0.74 0.00 0.00 0.00 178.15 179.36 2cqz h THR 41 N 0.33 1.25 0.85 -0.27 2.02 -0.17 0.90 112.91 117.81 2cqz h THR 41 Ca 0.04 -0.93 -0.04 0.00 0.77 0.00 0.00 66.41 66.25 2cqz h THR 41 Cb 0.73 0.92 0.01 0.00 -1.74 0.00 0.00 68.15 68.06 2cqz h THR 41 CO 0.06 0.33 -0.41 0.25 0.37 0.00 0.00 175.52 176.12 2cqz h LEU 42 N 0.67 -0.96 -0.69 2.58 5.85 -0.71 -0.30 115.31 121.75 2cqz h LEU 42 Ca 0.15 0.03 0.11 0.00 0.84 0.00 0.00 57.88 59.01 2cqz h LEU 42 Cb 0.40 0.25 -0.08 0.00 0.37 0.00 0.00 40.66 41.59 2cqz h LEU 42 CO 0.01 -0.67 0.28 0.58 -0.34 0.00 0.00 178.44 178.30 2cqz h VAL 43 N -1.18 0.73 -0.26 1.05 2.07 -1.16 -1.72 116.25 115.78 2cqz h VAL 43 Ca -0.12 -0.16 -0.12 0.00 0.82 0.00 0.00 66.70 67.12 2cqz h VAL 43 Cb 0.88 0.24 -0.01 0.00 -1.52 0.00 0.00 31.29 30.87 2cqz h VAL 43 CO 0.19 0.08 -0.35 -0.07 0.02 0.00 0.00 177.57 177.45 2cqz h LEU 44 N 0.46 0.60 -0.48 2.57 3.38 -0.76 -2.76 115.31 118.32 2cqz h LEU 44 Ca 0.36 -0.24 0.05 0.00 0.09 0.00 0.00 57.88 58.13 2cqz h LEU 44 Cb 0.48 -0.17 -0.05 0.00 0.09 0.00 0.00 40.66 41.02 2cqz h LEU 44 CO -0.34 0.90 0.22 0.00 0.09 0.00 0.00 178.44 179.31 2cqz h ALA 45 N 1.14 0.61 -0.57 1.53 0.00 -0.14 0.06 119.26 121.88 2cqz h ALA 45 Ca 0.05 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 2cqz h ALA 45 Cb 0.83 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.56 2cqz h ALA 45 CO 0.07 -0.14 0.35 -0.44 0.00 0.00 0.00 179.25 179.09 2cqz h ASP 46 N 0.44 0.67 -0.30 0.00 3.45 -1.27 0.13 116.42 119.55 2cqz h ASP 46 Ca 0.22 -0.05 0.02 0.00 0.43 0.00 0.00 57.03 57.65 2cqz h ASP 46 Cb 0.16 -0.17 -0.02 0.00 -0.56 0.00 0.00 39.33 38.73 2cqz h ASP 46 CO -0.17 0.53 0.15 0.58 -1.57 0.00 0.00 179.24 178.76 2cqz h VAL 47 N 0.76 1.00 -0.88 -1.35 2.07 -1.09 -2.03 116.25 114.73 2cqz h VAL 47 Ca 0.20 -0.11 -0.00 0.00 0.82 0.00 0.00 66.70 67.61 2cqz h VAL 47 Cb -0.03 0.65 -0.04 0.00 -1.52 0.00 0.00 31.29 30.35 2cqz h VAL 47 CO -0.04 0.06 0.54 -0.07 0.02 0.00 0.00 177.57 178.08 2cqz h LEU 48 N 0.32 1.04 0.15 2.57 3.38 -0.55 -2.73 115.31 119.48 2cqz h LEU 48 Ca 0.12 -0.05 0.02 0.00 0.09 0.00 0.00 57.88 58.06 2cqz h LEU 48 Cb 0.03 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.48 2cqz h LEU 48 CO -0.08 0.79 -0.31 -0.08 0.09 0.00 0.00 178.44 178.85 2cqz h GLU 49 N 1.20 -0.53 -0.52 1.13 4.57 -0.08 -1.59 114.58 118.77 2cqz h GLU 49 Ca 0.32 0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.53 2cqz h GLU 49 Cb -0.07 0.12 0.00 0.00 -0.16 0.00 0.00 28.75 28.64 2cqz h GLU 49 CO -0.06 -0.35 0.00 0.36 -1.18 0.00 0.00 179.01 177.78 2cqz n LYS 50 N -5.41 0.97 -0.09 1.92 2.85 -0.83 -2.58 118.16 114.98 2cqz n LYS 50 Ca -0.07 0.00 0.06 0.00 -1.05 0.00 0.00 58.31 57.25 2cqz n LYS 50 Cb 0.32 -1.26 0.08 0.00 -0.65 0.00 0.00 35.03 33.53 2cqz n LYS 50 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 2cqz n ARG 51 N -0.23 1.57 0.00 -1.58 1.74 -0.81 -4.98 116.66 112.37 2cqz n ARG 51 Ca 0.00 -2.03 0.00 0.00 -0.77 0.00 0.00 57.85 55.05 2cqz n ARG 51 Cb 0.13 -1.22 0.00 0.00 -1.02 0.00 0.00 32.46 30.35 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 -0.97 2.78 3.60 -0.13 0.00 -1.07 -5.00 105.19 104.40 2cqz n GLY 52 Ca 0.09 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.30 3.79 0.10 1.61 2.47 -0.66 -5.00 119.74 121.75 2cqz s LYS 53 Ca 0.00 0.52 -0.26 0.00 -1.56 0.00 0.00 55.97 54.67 2cqz s LYS 53 Cb 0.00 -3.82 -0.06 0.00 -1.46 0.00 0.00 37.83 32.48 2cqz s LYS 53 CO 0.00 -1.00 0.79 0.50 0.16 0.00 0.00 175.35 175.81 2cqz s ARG 54 N 3.53 4.55 0.03 4.03 3.52 -1.26 -3.32 118.95 130.03 2cqz s ARG 54 Ca 0.38 1.15 0.05 0.00 -0.13 0.00 0.00 55.73 57.18 2cqz s ARG 54 Cb -0.12 -3.33 -0.02 0.00 -1.56 0.00 0.00 34.95 29.93 2cqz s ARG 54 CO 0.20 0.38 -0.16 0.42 -0.81 0.00 0.00 175.30 175.33 2cqz s ILE 55 N -0.44 1.24 -1.16 4.11 -1.09 -1.26 -5.02 121.20 117.58 2cqz s ILE 55 Ca 0.39 -0.94 -0.19 0.00 -2.23 0.00 0.00 60.65 57.68 2cqz s ILE 55 Cb -0.22 -1.09 0.09 0.00 -1.58 0.00 0.00 42.46 39.66 2cqz s ILE 55 CO 0.25 0.13 1.54 -0.62 -1.23 0.00 0.00 174.94 175.01 2cqz s ASP 56 N -0.93 6.74 0.20 3.58 -1.08 -1.26 -4.83 116.67 119.09 2cqz s ASP 56 Ca 0.04 -2.17 -0.12 0.00 -0.52 0.00 0.00 52.55 49.78 2cqz s ASP 56 Cb -0.07 -2.53 0.26 0.00 -1.46 0.00 0.00 42.92 39.11 2cqz s ASP 56 CO 0.01 -1.20 1.67 0.58 0.52 0.00 0.00 175.17 176.74 2cqz h VAL 57 N 5.85 0.52 0.05 1.11 2.07 -1.99 -1.34 116.25 122.52 2cqz h VAL 57 Ca 0.32 -0.04 0.02 0.00 0.82 0.00 0.00 66.70 67.82 2cqz h VAL 57 Cb 0.93 0.40 -0.05 0.00 -1.52 0.00 0.00 31.29 31.05 2cqz h VAL 57 CO 1.38 0.02 -0.48 -0.08 0.02 0.00 0.00 177.57 178.43 2cqz h GLU 58 N 0.11 -0.63 -0.94 1.57 4.81 -2.00 0.27 114.58 117.76 2cqz h GLU 58 Ca 0.30 0.04 0.13 0.00 -0.13 0.00 0.00 59.36 59.70 2cqz h GLU 58 Cb 0.47 0.14 -0.08 0.00 0.63 0.00 0.00 28.75 29.92 2cqz h GLU 58 CO -0.50 -0.42 0.60 -0.22 -0.73 0.00 0.00 179.01 177.73 2cqz h LYS 59 N -0.66 0.80 0.41 1.92 3.64 -1.84 -1.59 116.57 119.25 2cqz h LYS 59 Ca 0.02 -0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 59.33 2cqz h LYS 59 Cb 0.71 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 32.35 2cqz h LYS 59 CO -0.31 0.53 -0.20 0.00 -2.27 0.00 0.00 179.45 177.20 2cqz h ALA 60 N 1.58 -0.55 -0.51 5.00 0.00 -0.09 -0.63 119.26 124.06 2cqz h ALA 60 Ca 0.47 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.23 2cqz h ALA 60 Cb 0.61 0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.59 2cqz h ALA 60 CO -0.23 -0.78 0.29 -0.07 0.00 0.00 0.00 179.25 178.46 2cqz h LEU 61 N -0.61 0.62 -0.60 0.00 3.38 -0.49 0.25 115.31 117.86 2cqz h LEU 61 Ca -0.06 -0.04 -0.14 0.00 0.09 0.00 0.00 57.88 57.74 2cqz h LEU 61 Cb 0.45 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 2cqz h LEU 61 CO 0.09 0.49 -0.38 0.11 0.09 0.00 0.00 178.44 178.84 2cqz h LYS 62 N 0.71 0.68 -0.27 1.13 1.57 -1.15 -1.92 116.57 117.32 2cqz h LYS 62 Ca 0.18 -0.34 -0.11 0.00 -1.87 0.00 0.00 60.65 58.52 2cqz h LYS 62 Cb 0.01 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.31 2cqz h LYS 62 CO -0.03 0.95 -0.28 1.98 -0.57 0.00 0.00 179.45 181.49 2cqz h MET 63 N 0.56 0.55 -0.09 3.15 4.05 -0.28 -1.94 114.93 120.93 2cqz h MET 63 Ca 0.05 -0.22 -0.21 0.00 -0.28 0.00 0.00 59.70 59.03 2cqz h MET 63 Cb 0.91 -0.02 0.00 0.00 -0.80 0.00 0.00 31.60 31.69 2cqz h MET 63 CO 0.08 0.77 -0.81 0.00 0.23 0.00 0.00 176.91 177.19 2cqz h ALA 64 N 1.22 0.42 -0.07 0.39 0.00 -0.80 -0.73 119.26 119.70 2cqz h ALA 64 Ca 0.06 -0.63 -0.10 0.00 0.00 0.00 0.00 54.91 54.24 2cqz h ALA 64 Cb 0.73 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 2cqz h ALA 64 CO 0.06 0.74 -0.42 0.82 0.00 0.00 0.00 179.25 180.44 2cqz h ILE 65 N 0.38 1.31 -0.00 0.00 2.04 -1.21 -3.27 117.51 116.75 2cqz h ILE 65 Ca -0.05 -1.51 0.00 0.00 1.00 0.00 0.00 64.86 64.29 2cqz h ILE 65 Cb 1.42 1.73 0.00 0.00 -0.74 0.00 0.00 36.82 39.22 2cqz h ILE 65 CO 0.15 0.45 -0.70 0.52 0.00 0.00 0.00 178.15 178.56 2cqz n VAL 66 N -4.02 0.00 -0.05 1.67 0.31 -0.74 -4.68 118.33 110.82 2cqz n VAL 66 Ca -0.02 -0.15 0.19 0.00 -0.01 0.00 0.00 64.34 64.35 2cqz n VAL 66 Cb 0.47 1.05 0.63 0.00 -0.91 0.00 0.00 33.84 35.09 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 0.51 0.15 -0.18 3.52 2.07 -1.18 -1.75 115.15 118.29 2cqz h HIS 67 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 2cqz h HIS 67 Cb 0.46 -0.05 0.00 0.00 2.57 0.00 0.00 27.41 30.39 2cqz h HIS 67 CO 0.00 0.06 0.00 -0.25 -3.07 0.00 0.00 177.93 174.67 2cqz n ASP 68 N -4.41 3.07 0.12 3.10 8.00 -1.26 -4.75 116.55 120.42 2cqz n ASP 68 Ca 0.11 -2.69 0.18 0.00 0.71 0.00 0.00 54.79 53.10 2cqz n ASP 68 Cb 0.58 -0.38 0.75 0.00 -0.02 0.00 0.00 41.12 42.05 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 1.18 0.00 -1.61 0.64 5.85 -1.60 -1.65 115.31 118.13 2cqz h LEU 69 Ca 0.00 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.70 2cqz h LEU 69 Cb 1.06 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.09 2cqz h LEU 69 CO 0.09 0.00 -0.10 0.00 -0.34 0.00 0.00 178.44 178.09 2cqz h ALA 70 N 1.74 1.08 0.00 1.25 0.00 -1.85 -2.49 119.26 118.99 2cqz h ALA 70 Ca 0.15 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2cqz h ALA 70 Cb 0.71 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.48 2cqz h ALA 70 CO -0.00 0.13 0.00 0.39 0.00 0.00 0.00 179.25 179.77 2cqz n GLU 71 N -3.33 0.10 0.24 0.00 1.02 -0.62 -1.90 120.64 116.16 2cqz n GLU 71 Ca -0.01 0.33 0.17 0.00 -0.02 0.00 0.00 57.16 57.63 2cqz n GLU 71 Cb 0.31 -1.69 0.82 0.00 -0.02 0.00 0.00 31.44 30.86 2cqz n GLU 71 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2cqz h ALA 72 N 2.39 1.00 0.00 0.62 0.00 -1.62 0.82 119.26 122.47 2cqz h ALA 72 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 2cqz h ALA 72 Cb 0.31 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 2cqz h ALA 72 CO 0.00 0.00 -1.22 -0.89 0.00 0.00 0.00 179.25 177.14 2cqz n ILE 73 N -2.70 0.22 1.00 0.00 5.41 -0.80 -4.79 119.36 117.70 2cqz n ILE 73 Ca -0.01 -0.09 0.11 0.00 1.00 0.00 0.00 62.75 63.76 2cqz n ILE 73 Cb 0.13 -0.69 -0.01 0.00 -0.71 0.00 0.00 39.64 38.36 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 -2.51 0.00 -1.03 1.39 -5.35 -0.88 -5.09 119.36 105.88 2cqz n ILE 74 Ca -0.07 -0.26 0.13 0.00 -0.27 0.00 0.00 62.75 62.29 2cqz n ILE 74 Cb 0.58 1.25 -0.06 0.00 -1.74 0.00 0.00 39.64 39.67 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 -0.04 -0.51 -1.24 7.28 -2.24 0.28 -4.48 114.28 113.32 2cqz n THR 75 Ca 0.09 0.60 -0.40 0.00 -2.27 0.00 0.00 64.05 62.07 2cqz n THR 75 Cb 0.47 -0.95 -0.04 0.00 -2.10 0.00 0.00 70.33 67.71 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 -3.71 3.33 -4.53 3.42 2.03 -1.26 -4.76 116.55 111.07 2cqz n ASP 76 Ca -0.06 -2.67 -0.48 0.00 0.52 0.00 0.00 54.79 52.10 2cqz n ASP 76 Cb 0.49 -1.25 -0.05 0.00 -0.72 0.00 0.00 41.12 39.59 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 5.49 0.29 -1.51 5.18 5.41 -1.26 -4.16 119.36 128.80 2cqz n ILE 77 Ca 0.51 -0.31 -0.37 0.00 1.00 0.00 0.00 62.75 63.58 2cqz n ILE 77 Cb 0.36 -1.98 0.07 0.00 -0.71 0.00 0.00 39.64 37.38 2cqz n ILE 77 CO 0.00 0.00 0.00 -0.81 0.00 0.00 0.00 176.55 175.74 2cqz n PRO 78 N 8.19 0.72 -0.25 0.38 -0.04 -1.26 -4.82 135.00 137.93 2cqz n PRO 78 Ca 0.35 0.30 0.04 0.00 -0.04 0.00 0.00 63.50 64.14 2cqz n PRO 78 Cb 0.31 -2.24 0.16 0.00 -0.04 0.00 0.00 33.50 31.69 2cqz n PRO 78 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 2cqz h LEU 79 N 0.11 0.30 -2.00 1.53 6.46 -1.98 -0.41 115.31 119.32 2cqz h LEU 79 Ca -0.48 0.10 0.18 0.00 -0.12 0.00 0.00 57.88 57.55 2cqz h LEU 79 Cb 1.35 0.06 -0.02 0.00 -0.73 0.00 0.00 40.66 41.32 2cqz h LEU 79 CO 0.49 0.14 0.48 0.77 -0.62 0.00 0.00 178.44 179.69 2cqz h SER 80 N 0.47 0.00 1.06 1.25 4.64 -2.01 0.12 113.55 119.07 2cqz h SER 80 Ca 0.38 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.61 2cqz h SER 80 Cb 0.54 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.61 2cqz h SER 80 CO -0.36 0.00 -0.99 0.00 -0.87 0.00 0.00 176.83 174.60 2cqz h ALA 81 N 1.63 0.64 0.00 5.18 0.00 -1.43 -3.36 119.26 121.92 2cqz h ALA 81 Ca 0.29 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.75 2cqz h ALA 81 Cb 1.24 0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.13 2cqz h ALA 81 CO -0.00 0.52 0.00 1.04 0.00 0.00 0.00 179.25 180.80 2cqz n GLN 82 N -2.91 0.24 0.00 0.00 6.02 0.43 -0.39 117.38 120.77 2cqz n GLN 82 Ca -0.03 0.00 0.13 0.00 -0.01 0.00 0.00 57.00 57.08 2cqz n GLN 82 Cb 0.71 -1.34 0.40 0.00 1.02 0.00 0.00 30.24 31.02 2cqz n GLN 82 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 177.06 174.14 2cqz n GLU 83 N -0.84 0.19 0.00 -1.09 2.13 -1.26 -4.03 120.64 115.74 2cqz n GLU 83 Ca 0.04 -0.09 0.00 0.00 0.66 0.00 0.00 57.16 57.77 2cqz n GLU 83 Cb 0.02 -1.50 0.00 0.00 0.27 0.00 0.00 31.44 30.23 2cqz n GLU 83 CO 0.00 0.00 0.00 1.19 -0.41 0.00 0.00 177.13 177.91 2cqz n PHE 84 N -1.33 0.00 -5.06 4.31 3.72 0.47 -5.03 117.46 114.54 2cqz n PHE 84 Ca 0.08 0.00 -0.32 0.00 -0.05 0.00 0.00 57.45 57.16 2cqz n PHE 84 Cb 0.33 0.00 -0.16 0.00 -0.94 0.00 0.00 39.48 38.71 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 -1.67 2.45 -1.16 -4.37 1.01 -0.84 -5.06 120.40 110.76 2cqz s VAL 85 Ca 0.00 -0.89 -0.20 0.00 0.00 0.00 0.00 61.98 60.89 2cqz s VAL 85 Cb 0.00 -1.96 0.07 0.00 0.00 0.00 0.00 36.38 34.49 2cqz s VAL 85 CO 0.00 0.55 1.57 -0.62 0.00 0.00 0.00 175.10 176.60 2cqz s ASP 86 N 0.16 6.71 0.36 3.32 -1.08 -1.26 -4.44 116.67 120.44 2cqz s ASP 86 Ca -0.11 -2.06 0.05 0.00 -0.52 0.00 0.00 52.55 49.91 2cqz s ASP 86 Cb -0.16 -2.55 0.69 0.00 -1.46 0.00 0.00 42.92 39.43 2cqz s ASP 86 CO 0.06 -1.27 1.95 0.50 0.52 0.00 0.00 175.17 176.93 2cqz h LYS 87 N 8.51 0.58 -0.09 4.34 3.64 -1.97 -2.70 116.57 128.89 2cqz h LYS 87 Ca 0.32 -0.08 -0.00 0.00 -1.27 0.00 0.00 60.65 59.62 2cqz h LYS 87 Cb 0.93 -0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 32.64 2cqz h LYS 87 CO 1.42 0.49 0.04 -0.44 -2.27 0.00 0.00 179.45 178.69 2cqz h ASP 88 N 0.58 0.11 -0.45 4.20 3.32 -1.99 -0.09 116.42 122.10 2cqz h ASP 88 Ca 0.14 -0.11 0.05 0.00 0.02 0.00 0.00 57.03 57.14 2cqz h ASP 88 Cb 0.14 -0.03 -0.05 0.00 0.22 0.00 0.00 39.33 39.61 2cqz h ASP 88 CO -0.01 0.19 0.17 0.50 -1.72 0.00 0.00 179.24 178.36 2cqz h LYS 89 N 0.03 0.34 -0.38 3.56 3.64 -1.94 -2.11 116.57 119.70 2cqz h LYS 89 Ca 0.03 -0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.40 2cqz h LYS 89 Cb 0.10 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 31.83 2cqz h LYS 89 CO -0.00 0.22 0.24 0.00 -2.27 0.00 0.00 179.45 177.64 2cqz h ALA 90 N 1.28 0.48 -0.16 5.00 0.00 -1.15 -2.56 119.26 122.15 2cqz h ALA 90 Ca 0.21 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.12 2cqz h ALA 90 Cb 0.19 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 2cqz h ALA 90 CO -0.20 -0.08 0.02 0.93 0.00 0.00 0.00 179.25 179.91 2cqz h GLU 91 N 0.49 0.08 -0.57 0.00 5.08 -0.53 -1.74 114.58 117.39 2cqz h GLU 91 Ca 0.14 -0.00 0.09 0.00 -1.00 0.00 0.00 59.36 58.59 2cqz h GLU 91 Cb -0.03 -0.02 -0.07 0.00 0.50 0.00 0.00 28.75 29.13 2cqz h GLU 91 CO -0.05 0.05 0.19 0.00 -1.00 0.00 0.00 179.01 178.21 2cqz h ALA 92 N 1.13 0.72 -0.22 3.43 0.00 -1.28 -0.42 119.26 122.62 2cqz h ALA 92 Ca 0.07 0.09 0.02 0.00 0.00 0.00 0.00 54.91 55.09 2cqz h ALA 92 Cb 0.08 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 2cqz h ALA 92 CO -0.11 -0.22 0.07 -0.07 0.00 0.00 0.00 179.25 178.92 2cqz h LEU 93 N 0.36 0.07 -0.33 0.00 3.38 -1.01 0.18 115.31 117.96 2cqz h LEU 93 Ca 0.29 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.27 2cqz h LEU 93 Cb 0.36 0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.11 2cqz h LEU 93 CO -0.30 0.07 0.16 0.58 0.09 0.00 0.00 178.44 179.04 2cqz h VAL 94 N 0.17 1.15 -0.84 1.22 2.07 -0.78 0.52 116.25 119.76 2cqz h VAL 94 Ca 0.10 -0.43 0.03 0.00 0.82 0.00 0.00 66.70 67.22 2cqz h VAL 94 Cb 0.07 0.83 -0.05 0.00 -1.52 0.00 0.00 31.29 30.63 2cqz h VAL 94 CO -0.11 0.16 0.55 -0.26 0.02 0.00 0.00 177.57 177.93 2cqz h PHE 95 N 0.40 1.03 -0.22 1.57 0.04 -0.76 0.73 116.94 119.73 2cqz h PHE 95 Ca 0.11 0.03 -0.11 0.00 2.80 0.00 0.00 57.97 60.80 2cqz h PHE 95 Cb 0.10 -0.34 -0.01 0.00 2.20 0.00 0.00 35.95 37.90 2cqz h PHE 95 CO -0.02 0.61 -0.33 0.87 -0.60 0.00 0.00 178.31 178.84 2cqz h LYS 96 N 1.08 0.45 0.08 1.51 1.57 -0.26 -0.33 116.57 120.67 2cqz h LYS 96 Ca 0.33 -0.20 -0.36 0.00 -1.87 0.00 0.00 60.65 58.55 2cqz h LYS 96 Cb -0.03 -0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.23 2cqz h LYS 96 CO -0.10 0.73 -2.10 1.17 -0.57 0.00 0.00 179.45 178.58 2cqz n LYS 97 N -4.07 0.72 -0.10 3.15 4.81 0.14 -4.36 118.16 118.44 2cqz n LYS 97 Ca -0.01 0.23 -0.13 0.00 -0.87 0.00 0.00 58.31 57.52 2cqz n LYS 97 Cb 0.45 -1.67 -0.11 0.00 0.02 0.00 0.00 35.03 33.73 2cqz n LYS 97 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 2cqz n VAL 98 N -3.36 1.24 -2.48 3.15 0.31 0.25 -4.69 118.33 112.76 2cqz n VAL 98 Ca -0.34 -0.55 -0.27 0.00 -0.01 0.00 0.00 64.34 63.17 2cqz n VAL 98 Cb 1.04 -1.08 0.00 0.00 -0.91 0.00 0.00 33.84 32.89 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 -3.01 3.37 0.02 3.52 3.72 -0.98 -4.87 117.46 119.23 2cqz n PHE 99 Ca -0.36 -3.10 0.10 0.00 -0.05 0.00 0.00 57.45 54.04 2cqz n PHE 99 Cb 0.96 -0.09 0.53 0.00 -0.94 0.00 0.00 39.48 39.94 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 2.58 0.30 0.00 -1.08 0.13 -1.27 -0.29 132.00 132.38 2cqz h PRO 100 Ca 0.29 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.41 2cqz h PRO 100 Cb 0.93 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.00 2cqz h PRO 100 CO 0.84 0.20 0.00 1.05 -0.23 0.00 0.00 178.00 179.86 2cqz h GLU 101 N 0.31 0.00 -0.15 0.86 9.09 -1.89 -2.42 114.58 120.38 2cqz h GLU 101 Ca 0.19 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.60 2cqz h GLU 101 Cb 0.35 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.45 2cqz h GLU 101 CO -0.04 0.00 0.00 1.19 0.05 0.00 0.00 179.01 180.21 2cqz n PHE 102 N -2.77 0.20 0.11 2.06 3.72 -0.16 -4.66 117.46 115.96 2cqz n PHE 102 Ca -0.00 -0.27 0.03 0.00 -0.05 0.00 0.00 57.45 57.16 2cqz n PHE 102 Cb 0.19 -0.02 0.42 0.00 -0.94 0.00 0.00 39.48 39.14 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 1.62 0.27 -0.52 1.38 3.20 -0.98 -1.35 116.97 120.59 2cqz h TYR 103 Ca 0.00 -0.02 -0.10 0.00 3.14 0.00 0.00 58.73 61.75 2cqz h TYR 103 Cb 0.53 -0.08 -0.02 0.00 1.54 0.00 0.00 36.73 38.71 2cqz h TYR 103 CO 0.10 0.32 -0.06 1.49 -1.64 0.00 0.00 178.16 178.36 2cqz h GLU 104 N 0.26 0.95 -0.56 1.82 4.57 -1.83 0.15 114.58 119.95 2cqz h GLU 104 Ca 0.06 -0.34 -0.06 0.00 -1.18 0.00 0.00 59.36 57.85 2cqz h GLU 104 Cb 0.26 -0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 28.75 2cqz h GLU 104 CO 0.01 1.00 0.13 -0.07 -1.18 0.00 0.00 179.01 178.90 2cqz h LEU 105 N 0.82 0.85 0.05 1.64 3.38 -1.79 -1.78 115.31 118.49 2cqz h LEU 105 Ca 0.14 -0.24 -0.00 0.00 0.09 0.00 0.00 57.88 57.87 2cqz h LEU 105 Cb 0.61 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.14 2cqz h LEU 105 CO 0.04 0.87 -0.02 0.22 0.09 0.00 0.00 178.44 179.63 2cqz h TYR 106 N 0.80 -0.06 -0.52 1.13 3.20 -0.97 -1.41 116.97 119.14 2cqz h TYR 106 Ca 0.17 -0.00 0.06 0.00 3.14 0.00 0.00 58.73 62.10 2cqz h TYR 106 Cb 0.35 0.02 -0.05 0.00 1.54 0.00 0.00 36.73 38.59 2cqz h TYR 106 CO 0.02 0.09 0.23 -0.09 -1.64 0.00 0.00 178.16 176.78 2cqz h ARG 107 N -0.21 0.43 -0.54 1.82 1.12 -0.62 -1.20 114.38 115.18 2cqz h ARG 107 Ca -0.01 -0.03 -0.09 0.00 -1.11 0.00 0.00 59.98 58.75 2cqz h ARG 107 Cb 0.18 -0.10 -0.02 0.00 -0.01 0.00 0.00 29.97 30.03 2cqz h ARG 107 CO 0.01 0.28 -0.03 1.49 -3.11 0.00 0.00 179.97 178.62 2cqz h GLU 108 N 0.44 0.95 -0.56 0.20 4.81 -1.27 -2.69 114.58 116.46 2cqz h GLU 108 Ca 0.24 -0.30 -0.01 0.00 -0.13 0.00 0.00 59.36 59.16 2cqz h GLU 108 Cb 0.20 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.47 2cqz h GLU 108 CO -0.20 0.96 0.32 -0.92 -0.73 0.00 0.00 179.01 178.44 2cqz h TYR 109 N 0.87 0.75 -0.15 0.92 3.20 -0.61 -2.51 116.97 119.45 2cqz h TYR 109 Ca 0.16 -0.01 -0.05 0.00 3.14 0.00 0.00 58.73 61.97 2cqz h TYR 109 Cb 0.55 -0.24 -0.01 0.00 1.54 0.00 0.00 36.73 38.56 2cqz h TYR 109 CO 0.03 0.53 -0.12 1.96 -1.64 0.00 0.00 178.16 178.93 2cqz h GLN 110 N 0.75 0.24 0.00 1.82 1.08 -1.05 -2.47 115.11 115.48 2cqz h GLN 110 Ca 0.20 -0.05 -0.06 0.00 -1.45 0.00 0.00 58.65 57.29 2cqz h GLN 110 Cb 0.02 -0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 27.41 2cqz h GLN 110 CO -0.03 0.37 -0.26 0.93 -0.95 0.00 0.00 178.83 178.88 2cqz h GLU 111 N 0.23 0.00 -6.60 1.46 5.08 -1.13 -3.47 114.58 110.15 2cqz h GLU 111 Ca 0.05 0.00 -0.52 0.00 -1.00 0.00 0.00 59.36 57.88 2cqz h GLU 111 Cb 0.36 0.00 -0.11 0.00 0.50 0.00 0.00 28.75 29.49 2cqz h GLU 111 CO 0.02 0.26 -0.87 0.00 -1.00 0.00 0.00 179.01 177.43 2cqz n SER 113 N -2.86 1.20 -4.68 0.00 7.64 -1.26 -4.74 113.62 108.91 2cqz n SER 113 Ca -0.16 0.19 -0.31 0.00 1.01 0.00 0.00 58.87 59.60 2cqz n SER 113 Cb 0.61 -0.45 0.16 0.00 -1.01 0.00 0.00 64.21 63.52 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 -6.07 3.02 0.26 6.43 1.04 -1.26 -4.78 113.70 112.34 2cqz s SER 114 Ca -0.16 2.20 -0.05 0.00 0.48 0.00 0.00 55.95 58.42 2cqz s SER 114 Cb 0.05 -2.57 0.30 0.00 0.10 0.00 0.00 66.02 63.89 2cqz s SER 114 CO 0.22 -3.04 1.93 -0.65 0.98 0.00 0.00 173.24 172.68 2cqz h PRO 115 N -1.76 1.27 -0.06 4.02 0.11 -1.96 -1.85 132.00 131.76 2cqz h PRO 115 Ca -0.43 -0.08 -0.01 0.00 0.11 0.00 0.00 66.00 65.59 2cqz h PRO 115 Cb 1.27 -0.28 -0.00 0.00 0.11 0.00 0.00 31.00 32.10 2cqz h PRO 115 CO 0.42 0.85 0.01 0.93 -0.21 0.00 0.00 178.00 180.00 2cqz h GLU 116 N 1.30 0.10 -0.75 1.05 3.07 -1.92 -1.41 114.58 116.02 2cqz h GLU 116 Ca 0.35 -0.03 0.05 0.00 -0.50 0.00 0.00 59.36 59.23 2cqz h GLU 116 Cb -0.13 -0.01 -0.05 0.00 -0.84 0.00 0.00 28.75 27.71 2cqz h GLU 116 CO -0.07 0.32 0.46 0.00 -1.40 0.00 0.00 179.01 178.32 2cqz h ALA 117 N 0.77 1.01 -0.22 3.43 0.00 -1.83 -1.58 119.26 120.84 2cqz h ALA 117 Ca 0.02 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.79 2cqz h ALA 117 Cb 0.27 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 2cqz h ALA 117 CO 0.00 0.20 -0.39 1.96 0.00 0.00 0.00 179.25 181.02 2cqz h GLN 118 N 0.86 0.51 -0.08 0.00 4.20 -1.27 -2.30 115.11 117.04 2cqz h GLN 118 Ca 0.32 -0.25 -0.00 0.00 0.06 0.00 0.00 58.65 58.78 2cqz h GLN 118 Cb 0.11 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.88 2cqz h GLN 118 CO -0.15 0.82 0.04 1.25 -0.67 0.00 0.00 178.83 180.12 2cqz h LEU 119 N 0.42 0.10 -0.89 1.46 5.85 -0.67 0.06 115.31 121.65 2cqz h LEU 119 Ca 0.04 -0.11 -0.04 0.00 0.84 0.00 0.00 57.88 58.61 2cqz h LEU 119 Cb 0.87 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.84 2cqz h LEU 119 CO 0.07 0.18 0.32 0.58 -0.34 0.00 0.00 178.44 179.25 2cqz h VAL 120 N 0.01 1.25 -0.77 1.05 2.07 -1.29 0.18 116.25 118.75 2cqz h VAL 120 Ca 0.03 -0.78 -0.05 0.00 0.82 0.00 0.00 66.70 66.72 2cqz h VAL 120 Cb 0.11 0.33 -0.03 0.00 -1.52 0.00 0.00 31.29 30.17 2cqz h VAL 120 CO -0.00 0.32 0.27 -0.09 0.02 0.00 0.00 177.57 178.09 2cqz h ARG 121 N 1.10 1.17 -0.19 1.57 9.65 -1.14 0.22 114.38 126.76 2cqz h ARG 121 Ca 0.26 -0.23 -0.13 0.00 -1.10 0.00 0.00 59.98 58.77 2cqz h ARG 121 Cb 0.19 -0.18 -0.01 0.00 -1.39 0.00 0.00 29.97 28.58 2cqz h ARG 121 CO -0.02 0.97 -0.45 0.82 2.80 0.00 0.00 179.97 184.09 2cqz h ILE 122 N 1.13 1.31 -0.11 1.20 2.04 -0.27 -2.21 117.51 120.61 2cqz h ILE 122 Ca 0.25 -1.64 -0.13 0.00 1.00 0.00 0.00 64.86 64.34 2cqz h ILE 122 Cb 0.26 1.65 -0.01 0.00 -0.74 0.00 0.00 36.82 37.98 2cqz h ILE 122 CO -0.01 0.51 -0.53 0.00 0.00 0.00 0.00 178.15 178.12 2cqz h ALA 123 N 1.13 0.91 -0.32 1.87 0.00 -0.08 -1.27 119.26 121.49 2cqz h ALA 123 Ca 0.03 -0.49 -0.04 0.00 0.00 0.00 0.00 54.91 54.41 2cqz h ALA 123 Cb 0.94 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 2cqz h ALA 123 CO 0.08 0.68 0.06 0.22 0.00 0.00 0.00 179.25 180.29 2cqz h ASP 124 N 0.23 0.50 0.21 0.00 3.58 -0.30 -2.22 116.42 118.42 2cqz h ASP 124 Ca 0.01 -0.25 -0.13 0.00 0.42 0.00 0.00 57.03 57.07 2cqz h ASP 124 Cb 1.00 -0.13 -0.01 0.00 1.72 0.00 0.00 39.33 41.91 2cqz h ASP 124 CO 0.08 0.63 -0.50 0.11 -2.88 0.00 0.00 179.24 176.69 2cqz h LYS 125 N 0.36 0.33 -0.12 0.28 1.79 -1.28 -2.95 116.57 114.97 2cqz h LYS 125 Ca 0.10 -0.19 -0.17 0.00 -2.18 0.00 0.00 60.65 58.21 2cqz h LYS 125 Cb 0.33 0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 30.99 2cqz h LYS 125 CO 0.00 0.75 -0.63 -0.07 -1.08 0.00 0.00 179.45 178.43 2cqz h LEU 126 N 0.26 0.52 -0.68 2.94 3.38 -1.15 -0.34 115.31 120.24 2cqz h LEU 126 Ca 0.01 -0.31 -0.08 0.00 0.09 0.00 0.00 57.88 57.59 2cqz h LEU 126 Cb 0.97 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.54 2cqz h LEU 126 CO 0.08 1.02 0.08 -0.78 0.09 0.00 0.00 178.44 178.93 2cqz h ASP 127 N 0.33 1.06 -0.07 -0.43 3.58 -1.39 -0.65 116.42 118.86 2cqz h ASP 127 Ca -0.01 -0.26 -0.03 0.00 0.42 0.00 0.00 57.03 57.14 2cqz h ASP 127 Cb 1.18 -0.28 -0.00 0.00 1.72 0.00 0.00 39.33 41.95 2cqz h ASP 127 CO 0.11 1.06 -0.07 -0.03 -2.88 0.00 0.00 179.24 177.43 2cqz h MET 128 N 1.02 0.17 -0.47 0.28 4.05 -1.37 0.23 114.93 118.84 2cqz h MET 128 Ca 0.20 -0.09 0.00 0.00 -0.28 0.00 0.00 59.70 59.53 2cqz h MET 128 Cb 0.47 0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 31.25 2cqz h MET 128 CO 0.02 0.62 0.30 0.82 0.23 0.00 0.00 176.91 178.89 2cqz h ILE 129 N -0.28 1.13 0.00 1.77 2.04 -0.96 0.21 117.51 121.41 2cqz h ILE 129 Ca 0.01 -0.26 -0.07 0.00 1.00 0.00 0.00 64.86 65.54 2cqz h ILE 129 Cb 0.59 0.47 -0.01 0.00 -0.74 0.00 0.00 36.82 37.13 2cqz h ILE 129 CO 0.02 0.13 -0.31 -0.07 0.00 0.00 0.00 178.15 177.91 2cqz h LEU 130 N 0.63 0.00 -0.26 1.44 4.07 -1.12 -0.48 115.31 119.59 2cqz h LEU 130 Ca 0.17 0.00 -0.20 0.00 0.08 0.00 0.00 57.88 57.93 2cqz h LEU 130 Cb -0.05 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.70 2cqz h LEU 130 CO -0.03 0.31 -0.66 -0.61 -1.08 0.00 0.00 178.44 176.37 2cqz h GLN 131 N 0.00 0.80 -0.46 1.13 5.75 0.95 -2.75 115.11 120.54 2cqz h GLN 131 Ca -0.00 -0.58 0.02 0.00 -0.15 0.00 0.00 58.65 57.94 2cqz h GLN 131 Cb 0.82 0.09 -0.03 0.00 1.07 0.00 0.00 27.48 29.43 2cqz h GLN 131 CO 0.04 1.20 0.26 0.00 -2.65 0.00 0.00 178.83 177.68 2cqz h ALA 132 N 0.66 0.58 -0.72 3.38 0.00 -0.45 -0.64 119.26 122.07 2cqz h ALA 132 Ca -0.02 -0.00 0.13 0.00 0.00 0.00 0.00 54.91 55.01 2cqz h ALA 132 Cb 1.27 -0.12 -0.09 0.00 0.00 0.00 0.00 17.79 18.86 2cqz h ALA 132 CO 0.14 -0.06 0.28 -0.92 0.00 0.00 0.00 179.25 178.69 2cqz h TYR 133 N 0.53 0.49 -0.38 0.00 3.20 -1.03 -0.64 116.97 119.14 2cqz h TYR 133 Ca 0.18 0.03 -0.05 0.00 3.14 0.00 0.00 58.73 62.04 2cqz h TYR 133 Cb 0.03 -0.11 -0.01 0.00 1.54 0.00 0.00 36.73 38.18 2cqz h TYR 133 CO -0.07 0.08 0.04 0.37 -1.64 0.00 0.00 178.16 176.94 2cqz h GLN 134 N 0.45 0.64 0.00 1.82 -0.00 -0.86 -2.55 115.11 114.61 2cqz h GLN 134 Ca 0.38 -0.18 -0.01 0.00 -0.00 0.00 0.00 58.65 58.84 2cqz h GLN 134 Cb 0.54 -0.07 -0.00 0.00 0.00 0.00 0.00 27.48 27.95 2cqz h GLN 134 CO -0.37 0.72 -0.06 1.88 0.00 0.00 0.00 178.83 180.99 2cqz h TYR 135 N 0.48 0.00 -0.20 3.99 0.05 -0.55 -1.59 116.97 119.15 2cqz h TYR 135 Ca 0.11 0.00 -0.13 0.00 0.05 0.00 0.00 58.73 58.76 2cqz h TYR 135 Cb 0.40 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.14 2cqz h TYR 135 CO 0.03 0.06 -0.38 1.49 -1.05 0.00 0.00 178.16 178.31 2cqz h GLU 136 N 0.00 0.61 0.00 4.88 4.81 -0.74 -1.37 114.58 122.77 2cqz h GLU 136 Ca -0.00 -0.39 -0.02 0.00 -0.13 0.00 0.00 59.36 58.81 2cqz h GLU 136 Cb 0.27 0.05 -0.00 0.00 0.63 0.00 0.00 28.75 29.69 2cqz h GLU 136 CO 0.01 1.01 -0.11 -0.07 -0.73 0.00 0.00 179.01 179.12 2cqz h LEU 137 N 0.29 0.00 0.00 1.64 3.38 -1.00 -0.80 115.31 118.81 2cqz h LEU 137 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2cqz h LEU 137 Cb 0.98 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.73 2cqz h LEU 137 CO 0.09 0.11 -0.13 -1.20 0.09 0.00 0.00 178.44 177.40 2cqz n SER 138 N -3.48 0.81 0.00 -0.43 7.64 -0.83 -4.92 113.62 112.40 2cqz n SER 138 Ca -0.01 0.48 0.00 0.00 1.01 0.00 0.00 58.87 60.35 2cqz n SER 138 Cb 0.26 -0.60 0.00 0.00 -1.01 0.00 0.00 64.21 62.85 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 1.31 1.46 3.72 0.23 0.00 -0.31 -5.09 105.19 106.52 2cqz n GLY 139 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 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 -1.54 6.78 -0.15 1.61 3.84 -0.55 -4.91 114.94 120.03 2cqz s ASN 140 Ca 0.00 2.43 0.18 0.00 0.21 0.00 0.00 52.86 55.67 2cqz s ASN 140 Cb 0.00 -2.60 0.39 0.00 -0.55 0.00 0.00 41.25 38.49 2cqz s ASN 140 CO 0.00 -0.66 1.26 2.29 -2.79 0.00 0.00 177.10 177.21 2cqz n LYS 141 N 3.46 2.00 -0.70 0.43 2.85 -1.26 -4.29 118.16 120.65 2cqz n LYS 141 Ca 0.10 -2.67 0.05 0.00 -1.05 0.00 0.00 58.31 54.74 2cqz n LYS 141 Cb 0.42 -1.64 0.19 0.00 -0.65 0.00 0.00 35.03 33.35 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 -1.03 1.70 -3.90 -5.58 6.94 -1.26 -4.78 115.26 107.35 2cqz n ASN 142 Ca 0.18 -3.75 -0.43 0.00 -0.02 0.00 0.00 54.58 50.56 2cqz n ASN 142 Cb 0.74 -0.51 0.01 0.00 -2.36 0.00 0.00 39.78 37.66 2cqz n ASN 142 CO 0.00 0.00 0.00 0.18 -1.03 0.00 0.00 177.26 176.41 2cqz n LEU 143 N -0.98 6.64 -0.03 -4.53 4.77 -1.26 -4.83 117.00 116.78 2cqz n LEU 143 Ca 0.18 -4.97 -0.13 0.00 -0.03 0.00 0.00 56.01 51.06 2cqz n LEU 143 Cb 0.73 -1.36 -0.11 0.00 -2.33 0.00 0.00 43.42 40.35 2cqz n LEU 143 CO -0.03 1.60 0.52 -2.24 -1.33 0.00 0.00 177.39 175.91 2cqz h ASP 144 N 5.47 -0.01 -1.05 -1.43 3.04 -1.99 -3.44 116.42 117.01 2cqz h ASP 144 Ca 0.32 -0.69 -0.63 0.00 -3.24 0.00 0.00 57.03 52.79 2cqz h ASP 144 Cb 0.59 0.00 -0.09 0.00 -1.04 0.00 0.00 39.33 38.79 2cqz h ASP 144 CO 1.46 0.69 1.75 -1.83 -2.04 0.00 0.00 179.24 179.28 2cqz s GLU 145 N -3.37 3.75 -0.03 4.15 -1.05 -1.26 -4.59 118.70 116.30 2cqz s GLU 145 Ca -0.17 -1.48 0.01 0.00 -0.15 0.00 0.00 54.97 53.18 2cqz s GLU 145 Cb -0.00 -5.42 -0.03 0.00 -0.44 0.00 0.00 34.13 28.24 2cqz s GLU 145 CO 0.67 -2.21 -0.01 0.34 0.95 0.00 0.00 175.26 175.00 2cqz n PHE 146 N 8.62 0.00 0.22 4.83 7.35 -1.26 -4.42 117.46 132.79 2cqz n PHE 146 Ca 0.39 0.00 0.02 0.00 -0.76 0.00 0.00 57.45 57.10 2cqz n PHE 146 Cb 0.49 -0.13 0.11 0.00 0.35 0.00 0.00 39.48 40.30 2cqz n PHE 146 CO 0.00 0.00 0.00 0.91 -0.76 0.00 0.00 176.76 176.91 2cqz n TRP 147 N -2.32 0.00 0.32 -5.13 7.02 -1.26 -1.79 117.44 114.27 2cqz n TRP 147 Ca -0.05 0.00 0.04 0.00 -1.02 0.00 0.00 57.50 56.47 2cqz n TRP 147 Cb 0.58 -0.25 0.03 0.00 -2.42 0.00 0.00 31.31 29.24 2cqz n TRP 147 CO 0.00 0.00 0.00 -0.85 -2.02 0.00 0.00 177.69 174.82 2cqz n GLU 148 N -1.25 0.31 -0.11 -0.99 0.28 -1.26 -3.04 120.64 114.58 2cqz n GLU 148 Ca 0.02 -0.90 -0.24 0.00 -0.16 0.00 0.00 57.16 55.88 2cqz n GLU 148 Cb 0.03 -1.13 -0.11 0.00 1.43 0.00 0.00 31.44 31.66 2cqz n GLU 148 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2cqz n ALA 149 N 0.34 1.17 0.02 -1.84 0.00 -0.83 -2.70 120.51 116.66 2cqz n ALA 149 Ca 0.04 -0.95 -0.11 0.00 0.00 0.00 0.00 53.44 52.42 2cqz n ALA 149 Cb 0.18 -0.14 -0.06 0.00 0.00 0.00 0.00 19.45 19.44 2cqz n ALA 149 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 2cqz h ILE 150 N -0.57 0.93 -0.25 0.00 1.08 -1.54 -0.95 117.51 116.21 2cqz h ILE 150 Ca -0.58 0.00 -0.05 0.00 -0.39 0.00 0.00 64.86 63.84 2cqz h ILE 150 Cb 1.70 0.93 -0.01 0.00 -3.07 0.00 0.00 36.82 36.37 2cqz h ILE 150 CO -0.23 0.00 -0.05 -0.08 -0.69 0.00 0.00 178.15 177.09 2cqz h GLU 151 N -0.01 0.39 -0.19 2.37 4.22 -1.71 -1.34 114.58 118.32 2cqz h GLU 151 Ca 0.03 -0.08 -0.10 0.00 0.08 0.00 0.00 59.36 59.28 2cqz h GLU 151 Cb 0.05 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 2cqz h GLU 151 CO -0.06 0.46 -0.34 0.93 -2.18 0.00 0.00 179.01 177.83 2cqz h GLU 152 N 0.37 0.38 -0.22 1.92 5.08 -1.15 -2.54 114.58 118.43 2cqz h GLU 152 Ca 0.08 -0.16 -0.12 0.00 -1.00 0.00 0.00 59.36 58.16 2cqz h GLU 152 Cb 0.34 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.58 2cqz h GLU 152 CO 0.01 0.68 -0.32 0.82 -1.00 0.00 0.00 179.01 179.20 2cqz h ILE 153 N 0.33 1.33 -0.47 3.13 2.04 -0.45 -3.03 117.51 120.38 2cqz h ILE 153 Ca 0.04 -1.53 0.14 0.00 1.00 0.00 0.00 64.86 64.51 2cqz h ILE 153 Cb 0.75 1.79 -0.02 0.00 -0.74 0.00 0.00 36.82 38.60 2cqz h ILE 153 CO 0.06 0.47 0.35 0.11 0.00 0.00 0.00 178.15 179.14 2cqz h LYS 154 N 0.29 0.00 0.00 2.37 1.79 -1.02 -0.06 116.57 119.93 2cqz h LYS 154 Ca 0.02 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.49 2cqz h LYS 154 Cb 0.91 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.56 2cqz h LYS 154 CO 0.07 0.00 0.00 0.54 -1.08 0.00 0.00 179.45 178.98 2cqz n ARG 155 N -4.35 0.39 -3.87 3.15 1.74 -0.98 -4.70 116.66 108.05 2cqz n ARG 155 Ca 0.08 0.07 -0.35 0.00 -0.77 0.00 0.00 57.85 56.88 2cqz n ARG 155 Cb 0.56 -1.50 -0.08 0.00 -1.02 0.00 0.00 32.46 30.41 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 -2.43 4.07 0.16 0.55 1.43 -0.04 -5.01 118.68 117.42 2cqz s LEU 156 Ca 0.23 0.21 -0.25 0.00 -1.03 0.00 0.00 54.13 53.28 2cqz s LEU 156 Cb 0.14 -2.03 0.03 0.00 0.03 0.00 0.00 46.19 44.35 2cqz s LEU 156 CO 0.30 0.22 1.58 -0.33 0.23 0.00 0.00 176.35 178.34 2cqz h GLU 157 N 6.40 -0.28 -0.34 1.70 5.08 -1.86 -1.03 114.58 124.26 2cqz h GLU 157 Ca -0.42 0.02 0.10 0.00 -1.00 0.00 0.00 59.36 58.06 2cqz h GLU 157 Cb 1.17 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.47 2cqz h GLU 157 CO 0.71 -0.19 0.69 1.25 -1.00 0.00 0.00 179.01 180.47 2cqz h LEU 158 N -0.29 0.00 -1.41 1.33 5.85 -1.95 0.19 115.31 119.03 2cqz h LEU 158 Ca 0.16 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.83 2cqz h LEU 158 Cb 0.57 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.59 2cqz h LEU 158 CO -0.58 0.00 -0.11 0.77 -0.34 0.00 0.00 178.44 178.18 2cqz h SER 159 N 0.00 0.24 -1.36 1.25 4.64 -1.44 -2.86 113.55 114.02 2cqz h SER 159 Ca 0.16 -0.05 0.46 0.00 -0.47 0.00 0.00 61.79 61.89 2cqz h SER 159 Cb 1.53 -0.06 -0.13 0.00 -0.31 0.00 0.00 62.40 63.43 2cqz h SER 159 CO -0.00 0.38 0.88 0.50 -0.87 0.00 0.00 176.83 177.72 2cqz h LYS 160 N 0.24 0.05 -0.00 4.77 3.64 -0.77 1.54 116.57 126.04 2cqz h LYS 160 Ca 0.05 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 2cqz h LYS 160 Cb 0.35 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.15 2cqz h LYS 160 CO 0.02 0.03 -0.06 0.66 -2.27 0.00 0.00 179.45 177.83 2cqz n TYR 161 N -4.69 0.00 -0.17 1.91 4.01 -1.08 -3.98 117.16 113.16 2cqz n TYR 161 Ca 0.39 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 58.13 2cqz n TYR 161 Cb 1.50 -0.13 0.00 0.00 -0.31 0.00 0.00 39.34 40.40 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 -0.84 1.55 -0.32 7.72 4.77 0.52 -4.86 117.00 125.54 2cqz n LEU 162 Ca 0.17 -1.55 0.19 0.00 -0.03 0.00 0.00 56.01 54.80 2cqz n LEU 162 Cb 0.25 0.00 0.40 0.00 -2.33 0.00 0.00 43.42 41.74 2cqz n LEU 162 CO 0.21 0.39 1.04 -0.33 -1.33 0.00 0.00 177.39 177.37 2cqz h GLU 163 N 0.00 0.27 -0.70 3.23 3.07 -1.60 0.59 114.58 119.44 2cqz h GLU 163 Ca 0.00 -0.02 -0.04 0.00 -0.50 0.00 0.00 59.36 58.81 2cqz h GLU 163 Cb 0.52 -0.06 -0.03 0.00 -0.84 0.00 0.00 28.75 28.33 2cqz h GLU 163 CO 0.00 0.18 0.29 0.38 -1.40 0.00 0.00 179.01 178.46 2cqz h ASP 164 N 0.28 0.94 0.12 1.42 2.03 -1.91 -1.62 116.42 117.67 2cqz h ASP 164 Ca 0.66 -0.13 -0.01 0.00 -0.73 0.00 0.00 57.03 56.83 2cqz h ASP 164 Cb 1.44 -0.24 0.00 0.00 -0.83 0.00 0.00 39.33 39.70 2cqz h ASP 164 CO -0.63 0.83 -0.06 0.40 -1.03 0.00 0.00 179.24 178.75 2cqz h ILE 165 N 1.01 1.07 0.00 4.15 2.04 -1.29 -2.75 117.51 121.75 2cqz h ILE 165 Ca 0.24 -1.02 0.00 0.00 1.00 0.00 0.00 64.86 65.08 2cqz h ILE 165 Cb 0.18 1.68 0.00 0.00 -0.74 0.00 0.00 36.82 37.94 2cqz h ILE 165 CO -0.02 0.23 0.00 -0.07 0.00 0.00 0.00 178.15 178.29 2cqz h LEU 166 N -0.66 0.00 0.10 1.44 3.38 -1.28 0.96 115.31 119.25 2cqz h LEU 166 Ca -0.02 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.69 2cqz h LEU 166 Cb 0.51 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 2cqz h LEU 166 CO 0.03 0.00 -1.20 0.78 0.09 0.00 0.00 178.44 178.13 2cqz h ASN 167 N 0.00 0.31 0.17 -0.43 -0.26 -1.14 -2.49 115.58 111.74 2cqz h ASN 167 Ca 0.00 -0.34 -0.14 0.00 -0.56 0.00 0.00 56.30 55.26 2cqz h ASN 167 Cb 0.04 -0.10 -0.01 0.00 -1.06 0.00 0.00 38.32 37.19 2cqz h ASN 167 CO 0.00 1.27 -0.52 0.28 -1.06 0.00 0.00 177.43 177.40 2cqz h SER 168 N 0.05 0.43 0.56 5.81 0.02 -0.54 -2.43 113.55 117.45 2cqz h SER 168 Ca -0.11 -0.22 -0.03 0.00 -0.84 0.00 0.00 61.79 60.59 2cqz h SER 168 Cb 1.93 -0.12 0.01 0.00 0.14 0.00 0.00 62.40 64.35 2cqz h SER 168 CO 0.18 0.87 -0.27 0.58 -1.14 0.00 0.00 176.83 177.05 2cqz h VAL 169 N 0.30 0.22 0.00 2.27 2.07 -1.37 -2.63 116.25 117.13 2cqz h VAL 169 Ca 0.01 -0.41 0.00 0.00 0.82 0.00 0.00 66.70 67.12 2cqz h VAL 169 Cb 1.02 0.32 0.00 0.00 -1.52 0.00 0.00 31.29 31.10 2cqz h VAL 169 CO 0.09 0.04 0.06 1.23 0.02 0.00 0.00 177.57 179.01 2cqz h GLY 170 N -1.08 0.00 1.96 2.17 0.00 -1.50 0.29 103.07 104.91 2cqz h GLY 170 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.25 2cqz h GLY 170 CO 0.13 0.00 -0.04 -0.09 0.00 0.00 0.00 176.54 176.54 2cqz h ARG 171 N 0.00 0.00 -0.08 4.80 2.43 -1.07 -2.88 114.38 117.59 2cqz h ARG 171 Ca 0.00 0.00 -0.08 0.00 -0.81 0.00 0.00 59.98 59.09 2cqz h ARG 171 Cb 0.13 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.67 2cqz h ARG 171 CO 0.00 0.00 -0.32 -0.07 -1.51 0.00 0.00 179.97 178.07 2cqz h LEU 172 N 0.00 0.15 0.00 3.80 3.38 -0.19 -3.51 115.31 118.94 2cqz h LEU 172 Ca 0.00 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.92 2cqz h LEU 172 Cb 0.97 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.68 2cqz h LEU 172 CO 0.00 0.47 0.00 1.17 0.09 0.00 0.00 178.44 180.17