#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k4z n GLY -19 N 0.00 3.27 3.68 3.03 0.00 -1.26 -5.05 105.19 108.86 2k4z n GLY -19 Ca 0.00 -1.00 -0.42 0.00 0.00 0.00 0.00 46.02 44.60 2k4z n GLY -19 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2k4z s SER -18 N 0.00 7.12 0.00 1.61 0.15 -1.26 -4.91 113.70 116.41 2k4z s SER -18 Ca 0.00 1.67 0.17 0.00 0.70 0.00 0.00 55.95 58.50 2k4z s SER -18 Cb 0.00 -2.55 0.77 0.00 -1.71 0.00 0.00 66.02 62.53 2k4z s SER -18 CO 0.00 -0.55 1.53 -1.20 1.20 0.00 0.00 173.24 174.22 2k4z n SER -17 N 5.31 0.93 -1.05 5.45 7.64 -1.26 -4.88 113.62 125.76 2k4z n SER -17 Ca 0.10 -1.66 -0.11 0.00 1.01 0.00 0.00 58.87 58.22 2k4z n SER -17 Cb 0.47 -0.07 -0.02 0.00 -1.01 0.00 0.00 64.21 63.57 2k4z n SER -17 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 2k4z n HIS -16 N -0.14 -0.27 -4.65 1.43 8.25 -1.26 -5.01 115.22 113.57 2k4z n HIS -16 Ca 0.13 0.00 -0.26 0.00 -0.26 0.00 0.00 57.72 57.33 2k4z n HIS -16 Cb 0.20 -2.31 -0.17 0.00 1.12 0.00 0.00 29.99 28.83 2k4z n HIS -16 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 2k4z s HIS -15 N -2.48 1.67 -0.09 4.41 3.76 -1.26 -5.13 115.29 116.17 2k4z s HIS -15 Ca 0.00 -0.65 0.00 0.00 -0.15 0.00 0.00 55.06 54.26 2k4z s HIS -15 Cb 0.00 -1.20 -0.03 0.00 1.11 0.00 0.00 32.58 32.46 2k4z s HIS -15 CO 0.00 -0.32 -0.07 -1.01 -0.85 0.00 0.00 174.74 172.49 2k4z s HIS -14 N 0.67 2.93 -0.34 1.40 0.09 -1.26 -5.09 115.29 113.69 2k4z s HIS -14 Ca -0.14 -0.09 -0.14 0.00 -0.00 0.00 0.00 55.06 54.69 2k4z s HIS -14 Cb -0.16 -1.76 -0.01 0.00 -0.00 0.00 0.00 32.58 30.65 2k4z s HIS -14 CO 0.04 0.22 0.30 -1.01 -0.00 0.00 0.00 174.74 174.29 2k4z s HIS -13 N -0.52 3.22 -0.34 1.40 3.76 -1.26 -5.04 115.29 116.51 2k4z s HIS -13 Ca 0.08 -0.14 0.00 0.00 -0.15 0.00 0.00 55.06 54.85 2k4z s HIS -13 Cb -0.12 -2.58 0.08 0.00 1.11 0.00 0.00 32.58 31.07 2k4z s HIS -13 CO 0.02 -0.41 0.05 -1.58 -0.85 0.00 0.00 174.74 171.98 2k4z s HIS -12 N 1.87 3.50 -0.77 1.40 2.46 -1.26 -5.05 115.29 117.44 2k4z s HIS -12 Ca 0.09 -2.43 -0.23 0.00 0.47 0.00 0.00 55.06 52.96 2k4z s HIS -12 Cb -0.17 -2.63 0.07 0.00 -0.13 0.00 0.00 32.58 29.72 2k4z s HIS -12 CO 0.11 -0.91 1.13 -3.38 -2.47 0.00 0.00 174.74 169.23 2k4z s HIS -11 N 1.09 2.63 0.49 3.88 -3.43 -1.26 -5.00 115.29 113.69 2k4z s HIS -11 Ca 0.03 -0.60 -0.23 0.00 -0.80 0.00 0.00 55.06 53.45 2k4z s HIS -11 Cb -0.20 -4.43 -0.08 0.00 -1.43 0.00 0.00 32.58 26.44 2k4z s HIS -11 CO -0.05 -1.77 1.20 0.43 -2.00 0.00 0.00 174.74 172.56 2k4z n SER -10 N 8.09 2.09 -4.60 7.38 7.64 -1.26 -4.87 113.62 128.09 2k4z n SER -10 Ca 0.07 1.01 -0.43 0.00 1.01 0.00 0.00 58.87 60.54 2k4z n SER -10 Cb 0.48 -1.48 -0.03 0.00 -1.01 0.00 0.00 64.21 62.17 2k4z n SER -10 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2k4z s SER -9 N -0.79 5.75 0.00 6.43 0.01 -1.26 -1.29 113.70 122.55 2k4z s SER -9 Ca 0.67 1.39 0.00 0.00 1.31 0.00 0.00 55.95 59.32 2k4z s SER -9 Cb -0.47 -2.52 0.00 0.00 0.21 0.00 0.00 66.02 63.23 2k4z s SER -9 CO 0.54 -1.81 0.00 0.61 0.41 0.00 0.00 173.24 172.99 2k4z n GLY -8 N 5.51 1.07 3.58 3.44 0.00 -1.26 -5.05 105.19 112.48 2k4z n GLY -8 Ca 0.25 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.85 2k4z n GLY -8 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2k4z s LEU -7 N 0.00 3.44 0.04 0.99 2.96 -0.41 -4.98 118.68 120.72 2k4z s LEU -7 Ca 0.00 0.36 -0.31 0.00 -0.22 0.00 0.00 54.13 53.97 2k4z s LEU -7 Cb 0.00 -3.16 -0.07 0.00 0.50 0.00 0.00 46.19 43.46 2k4z s LEU -7 CO 0.00 -1.63 1.50 0.68 -1.32 0.00 0.00 176.35 175.58 2k4z s VAL -6 N 5.80 3.37 0.74 1.68 -7.23 -1.26 -4.96 120.40 118.54 2k4z s VAL -6 Ca 0.53 0.83 -0.14 0.00 -1.81 0.00 0.00 61.98 61.38 2k4z s VAL -6 Cb -0.11 -3.53 0.04 0.00 0.56 0.00 0.00 36.38 33.35 2k4z s VAL -6 CO 0.27 0.01 1.17 -2.84 -0.31 0.00 0.00 175.10 173.39 2k4z s PRO -5 N 2.30 2.16 -0.11 4.82 0.02 -1.26 -4.98 135.00 137.95 2k4z s PRO -5 Ca 0.68 1.62 -0.19 0.00 0.02 0.00 0.00 61.00 63.13 2k4z s PRO -5 Cb -0.36 -1.85 -0.27 0.00 0.02 0.00 0.00 34.50 32.04 2k4z s PRO -5 CO 0.29 -1.79 0.60 0.00 -0.33 0.00 0.00 177.00 175.77 2k4z h ARG -4 N -0.46 0.21 0.00 5.54 3.08 -2.06 -3.50 114.38 117.19 2k4z h ARG -4 Ca -0.47 -0.36 0.00 0.00 0.07 0.00 0.00 59.98 59.23 2k4z h ARG -4 Cb 1.28 0.13 0.00 0.00 0.08 0.00 0.00 29.97 31.46 2k4z h ARG -4 CO 0.50 1.17 0.00 0.41 -1.07 0.00 0.00 179.97 180.98 2k4z n GLY -3 N 1.69 -0.28 3.93 0.04 0.00 -1.26 -4.88 105.19 104.42 2k4z n GLY -3 Ca -0.22 -1.07 -0.26 0.00 0.00 0.00 0.00 46.02 44.47 2k4z n GLY -3 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2k4z s SER -2 N -4.00 5.72 -0.03 1.61 1.04 -1.26 -4.88 113.70 111.90 2k4z s SER -2 Ca 0.00 0.61 0.05 0.00 0.48 0.00 0.00 55.95 57.09 2k4z s SER -2 Cb 0.00 -1.70 0.20 0.00 0.10 0.00 0.00 66.02 64.62 2k4z s SER -2 CO 0.00 -0.92 0.99 1.41 0.98 0.00 0.00 173.24 175.70 2k4z n HIS -1 N -2.41 0.41 -3.62 5.02 8.25 -1.26 -4.84 115.22 116.77 2k4z n HIS -1 Ca 0.03 -0.16 -0.10 0.00 -0.26 0.00 0.00 57.72 57.23 2k4z n HIS -1 Cb 0.57 -0.11 -0.02 0.00 1.12 0.00 0.00 29.99 31.55 2k4z n HIS -1 CO 0.00 0.00 0.00 1.41 0.64 0.00 0.00 176.34 178.39 2k4z s MET 0 N -1.60 1.43 0.00 -0.41 1.75 -1.26 -4.98 119.30 114.23 2k4z s MET 0 Ca 0.14 -0.71 0.26 0.00 -1.25 0.00 0.00 55.69 54.13 2k4z s MET 0 Cb 0.09 0.57 1.23 0.00 2.84 0.00 0.00 34.83 39.56 2k4z s MET 0 CO 0.07 -0.63 1.83 -1.33 -0.65 0.00 0.00 175.02 174.31 2k4z n MET 1 N -0.39 1.41 -1.69 4.11 0.00 -1.26 -4.89 117.12 114.41 2k4z n MET 1 Ca -0.12 -0.60 -0.43 0.00 0.00 0.00 0.00 57.70 56.55 2k4z n MET 1 Cb 0.63 -1.44 -0.03 0.00 0.00 0.00 0.00 33.22 32.37 2k4z n MET 1 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 175.97 176.31 2k4z n PHE 2 N -0.24 2.59 -3.49 2.03 7.35 -1.02 -4.59 117.46 120.09 2k4z n PHE 2 Ca 0.19 -0.06 -0.41 0.00 -0.76 0.00 0.00 57.45 56.41 2k4z n PHE 2 Cb 0.24 -2.70 -0.04 0.00 0.35 0.00 0.00 39.48 37.34 2k4z n PHE 2 CO 0.00 0.00 0.00 0.15 -0.76 0.00 0.00 176.76 176.15 2k4z s LYS 3 N 2.31 3.48 -0.42 -4.13 1.02 -0.54 -5.00 119.74 116.46 2k4z s LYS 3 Ca 0.81 -2.92 -0.21 0.00 0.02 0.00 0.00 55.97 53.66 2k4z s LYS 3 Cb -0.52 -4.20 0.02 0.00 -0.52 0.00 0.00 37.83 32.61 2k4z s LYS 3 CO 0.37 -1.25 0.69 -1.17 -0.92 0.00 0.00 175.35 173.07 2k4z s LEU 4 N -0.71 4.36 0.26 3.17 0.20 -1.26 -0.09 118.68 124.61 2k4z s LEU 4 Ca 0.24 -0.12 -0.30 0.00 0.69 0.00 0.00 54.13 54.63 2k4z s LEU 4 Cb -0.11 -2.82 -0.11 0.00 -0.43 0.00 0.00 46.19 42.72 2k4z s LEU 4 CO -0.09 -0.77 1.55 0.42 -0.29 0.00 0.00 176.35 177.18 2k4z s THR 5 N 2.93 2.29 0.49 3.68 -4.23 -1.06 -4.80 115.64 114.95 2k4z s THR 5 Ca 0.25 0.24 0.23 0.00 -1.18 0.00 0.00 61.69 61.23 2k4z s THR 5 Cb -0.14 -3.15 0.40 0.00 1.34 0.00 0.00 72.50 70.95 2k4z s THR 5 CO 0.19 0.04 1.94 -0.65 -0.54 0.00 0.00 174.62 175.59 2k4z h PRO 6 N 5.16 0.16 -0.33 3.99 0.11 -1.92 0.22 132.00 139.40 2k4z h PRO 6 Ca -0.46 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.61 2k4z h PRO 6 Cb 1.22 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 2k4z h PRO 6 CO 0.81 0.11 0.11 0.00 -0.21 0.00 0.00 178.00 178.82 2k4z h ALA 7 N 1.66 0.43 -0.13 -0.75 0.00 -1.93 -0.84 119.26 117.70 2k4z h ALA 7 Ca 0.34 -0.15 -0.19 0.00 0.00 0.00 0.00 54.91 54.92 2k4z h ALA 7 Cb 1.10 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.76 2k4z h ALA 7 CO -0.06 0.06 -0.68 0.00 0.00 0.00 0.00 179.25 178.57 2k4z h ALA 8 N 0.95 0.56 -0.74 0.00 0.00 -1.36 -3.01 119.26 115.66 2k4z h ALA 8 Ca 0.11 -0.57 0.04 0.00 0.00 0.00 0.00 54.91 54.48 2k4z h ALA 8 Cb 0.23 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.92 2k4z h ALA 8 CO -0.01 0.72 0.49 0.00 0.00 0.00 0.00 179.25 180.46 2k4z h ALA 9 N 0.86 1.57 -0.57 0.00 0.00 -0.48 -0.30 119.26 120.34 2k4z h ALA 9 Ca -0.02 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 2k4z h ALA 9 Cb 1.26 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.77 2k4z h ALA 9 CO 0.13 0.35 0.20 1.49 0.00 0.00 0.00 179.25 181.41 2k4z h GLU 10 N 0.89 0.84 -0.15 0.00 4.81 -1.02 0.46 114.58 120.41 2k4z h GLU 10 Ca 0.30 -0.14 -0.18 0.00 -0.13 0.00 0.00 59.36 59.21 2k4z h GLU 10 Cb 0.07 -0.14 -0.00 0.00 0.63 0.00 0.00 28.75 29.31 2k4z h GLU 10 CO -0.09 0.71 -0.64 0.37 -0.73 0.00 0.00 179.01 178.63 2k4z h GLN 11 N 0.82 0.56 -0.65 1.92 4.15 -1.10 -0.73 115.11 120.08 2k4z h GLN 11 Ca 0.19 -0.40 -0.01 0.00 0.77 0.00 0.00 58.65 59.20 2k4z h GLN 11 Cb 0.21 0.07 -0.03 0.00 0.21 0.00 0.00 27.48 27.94 2k4z h GLN 11 CO -0.01 1.02 0.38 0.28 -1.93 0.00 0.00 178.83 178.57 2k4z h VAL 12 N 0.41 1.20 -0.89 2.39 2.07 -0.66 0.57 116.25 121.34 2k4z h VAL 12 Ca -0.01 -0.46 0.00 0.00 0.82 0.00 0.00 66.70 67.05 2k4z h VAL 12 Cb 1.21 0.32 -0.04 0.00 -1.52 0.00 0.00 31.29 31.26 2k4z h VAL 12 CO 0.12 0.21 0.57 0.25 0.02 0.00 0.00 177.57 178.74 2k4z h LEU 13 N 0.89 1.03 -0.28 2.57 5.85 -0.69 -0.64 115.31 124.05 2k4z h LEU 13 Ca 0.23 -0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.91 2k4z h LEU 13 Cb 0.00 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 40.76 2k4z h LEU 13 CO -0.04 0.77 0.15 0.50 -0.34 0.00 0.00 178.44 179.48 2k4z h LYS 14 N 1.21 0.39 -1.00 1.25 3.64 -0.51 0.90 116.57 122.45 2k4z h LYS 14 Ca 0.32 -0.04 0.02 0.00 -1.27 0.00 0.00 60.65 59.68 2k4z h LYS 14 Cb -0.11 -0.08 -0.05 0.00 -0.41 0.00 0.00 32.23 31.58 2k4z h LYS 14 CO -0.07 0.34 0.66 0.00 -2.27 0.00 0.00 179.45 178.11 2k4z h ALA 15 N 1.03 1.32 -0.38 5.00 0.00 -0.40 -1.13 119.26 124.69 2k4z h ALA 15 Ca 0.10 -0.06 -0.11 0.00 0.00 0.00 0.00 54.91 54.84 2k4z h ALA 15 Cb 0.06 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.46 2k4z h ALA 15 CO -0.02 0.61 -0.18 0.00 0.00 0.00 0.00 179.25 179.66 2k4z h ALA 16 N 1.40 0.54 0.00 0.00 0.00 -0.83 -3.01 119.26 117.36 2k4z h ALA 16 Ca 0.38 -0.36 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 2k4z h ALA 16 Cb -0.07 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.58 2k4z h ALA 16 CO -0.10 0.48 -0.08 -0.22 0.00 0.00 0.00 179.25 179.32 2k4z h LYS 17 N 0.60 0.00 -0.00 0.00 3.64 -0.06 -1.39 116.57 119.35 2k4z h LYS 17 Ca 0.09 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 2k4z h LYS 17 Cb 0.73 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.55 2k4z h LYS 17 CO 0.05 0.08 -0.01 1.04 -2.27 0.00 0.00 179.45 178.34 2k4z n GLN 18 N -3.71 0.76 0.00 1.90 6.02 -0.50 -4.92 117.38 116.93 2k4z n GLN 18 Ca -0.02 -0.07 0.00 0.00 -0.01 0.00 0.00 57.00 56.90 2k4z n GLN 18 Cb 0.18 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 29.94 2k4z n GLN 18 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2k4z n GLY 19 N 1.16 3.08 0.00 1.08 0.00 -0.96 -5.00 105.19 104.55 2k4z n GLY 19 Ca 0.19 -0.67 0.15 0.00 0.00 0.00 0.00 46.02 45.69 2k4z n GLY 19 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k4z n GLY 20 N 0.00 -1.15 0.28 -0.02 0.00 -1.26 -3.36 105.19 99.67 2k4z n GLY 20 Ca 0.00 -0.17 0.18 0.00 0.00 0.00 0.00 46.02 46.03 2k4z n GLY 20 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2k4z h THR 21 N 0.01 0.00 -0.58 2.61 1.35 -1.88 -2.25 112.91 112.16 2k4z h THR 21 Ca 0.00 -0.23 0.10 0.00 -0.55 0.00 0.00 66.41 65.73 2k4z h THR 21 Cb 0.16 1.16 -0.03 0.00 -1.73 0.00 0.00 68.15 67.70 2k4z h THR 21 CO 0.00 0.00 0.39 -0.08 -0.25 0.00 0.00 175.52 175.58 2k4z h GLU 22 N 0.00 0.35 -0.70 4.72 4.81 -1.27 -1.88 114.58 120.61 2k4z h GLU 22 Ca 0.00 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 2k4z h GLU 22 Cb 0.25 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.55 2k4z h GLU 22 CO 0.00 0.23 0.00 0.41 -0.73 0.00 0.00 179.01 178.92 2k4z n GLY 23 N -1.53 1.95 2.25 1.92 0.00 -0.85 -4.87 105.19 104.06 2k4z n GLY 23 Ca 0.10 -0.46 -0.16 0.00 0.00 0.00 0.00 46.02 45.49 2k4z n GLY 23 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2k4z n MET 24 N 0.38 0.63 -4.52 1.61 2.81 -0.71 -4.99 117.12 112.33 2k4z n MET 24 Ca 0.14 -2.32 -0.27 0.00 -1.81 0.00 0.00 57.70 53.44 2k4z n MET 24 Cb 0.65 1.36 -0.10 0.00 -0.71 0.00 0.00 33.22 34.42 2k4z n MET 24 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2k4z s LEU 26 N -3.75 5.24 -0.11 0.00 2.96 -1.20 -0.08 118.68 121.73 2k4z s LEU 26 Ca 0.36 -1.02 -0.05 0.00 -0.22 0.00 0.00 54.13 53.19 2k4z s LEU 26 Cb 0.09 -2.26 -0.04 0.00 0.50 0.00 0.00 46.19 44.48 2k4z s LEU 26 CO 0.19 -0.62 0.10 -0.60 -1.32 0.00 0.00 176.35 174.09 2k4z s ARG 27 N 1.91 3.32 -0.06 1.98 3.52 -0.27 -0.37 118.95 128.97 2k4z s ARG 27 Ca 0.08 -0.22 0.03 0.00 -0.13 0.00 0.00 55.73 55.49 2k4z s ARG 27 Cb -0.21 -3.07 -0.02 0.00 -1.56 0.00 0.00 34.95 30.09 2k4z s ARG 27 CO 0.10 0.74 -0.16 -0.51 -0.81 0.00 0.00 175.30 174.67 2k4z s LEU 28 N -0.95 2.64 0.15 -0.88 1.43 -0.98 -2.08 118.68 118.01 2k4z s LEU 28 Ca 0.14 -0.26 0.11 0.00 -1.03 0.00 0.00 54.13 53.09 2k4z s LEU 28 Cb -0.12 -1.54 -0.04 0.00 0.03 0.00 0.00 46.19 44.52 2k4z s LEU 28 CO 0.03 0.31 -0.25 0.00 0.23 0.00 0.00 176.35 176.67 2k4z s ALA 29 N -0.49 2.46 -0.03 4.21 0.00 -0.04 -4.49 121.76 123.37 2k4z s ALA 29 Ca 0.06 -1.53 0.05 0.00 0.00 0.00 0.00 51.96 50.54 2k4z s ALA 29 Cb -0.12 -0.38 -0.01 0.00 0.00 0.00 0.00 23.12 22.62 2k4z s ALA 29 CO 0.02 0.50 -0.18 0.00 0.00 0.00 0.00 175.76 176.10 2k4z s ALA 30 N -1.30 1.53 -0.34 0.00 0.00 -1.26 -0.18 121.76 120.21 2k4z s ALA 30 Ca 0.17 -0.75 0.00 0.00 0.00 0.00 0.00 51.96 51.38 2k4z s ALA 30 Cb -0.09 -0.44 0.11 0.00 0.00 0.00 0.00 23.12 22.69 2k4z s ALA 30 CO 0.08 0.33 0.12 0.20 0.00 0.00 0.00 175.76 176.49 2k4z s GLY 31 N -0.21 1.23 -0.52 0.00 0.00 0.52 -4.97 107.32 103.37 2k4z s GLY 31 Ca 0.02 -1.90 -0.23 0.00 0.00 0.00 0.00 44.72 42.61 2k4z s GLY 31 CO 0.01 1.57 0.86 -1.60 0.00 0.00 0.00 173.10 173.94 2k4z s ARG 32 N 1.33 3.33 -0.47 2.90 3.52 -1.26 -1.40 118.95 126.90 2k4z s ARG 32 Ca 0.11 -0.29 -0.18 0.00 -0.13 0.00 0.00 55.73 55.25 2k4z s ARG 32 Cb -0.19 -4.03 0.05 0.00 -1.56 0.00 0.00 34.95 29.22 2k4z s ARG 32 CO -0.19 -1.35 0.52 -0.80 -0.81 0.00 0.00 175.30 172.67 2k4z s ASN 33 N 2.63 6.20 0.33 -2.12 0.01 -1.06 -4.91 114.94 116.02 2k4z s ASN 33 Ca 0.29 -0.89 0.26 0.00 -0.71 0.00 0.00 52.86 51.80 2k4z s ASN 33 Cb -0.13 -2.25 1.13 0.00 0.41 0.00 0.00 41.25 40.41 2k4z s ASN 33 CO 0.19 -0.73 1.77 1.55 -1.51 0.00 0.00 177.10 178.37 2k4z h PRO 34 N 8.85 0.00 0.00 -0.60 0.13 -1.95 -1.56 132.00 136.87 2k4z h PRO 34 Ca -0.27 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.80 2k4z h PRO 34 Cb 1.10 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.22 2k4z h PRO 34 CO 0.89 0.00 -0.68 0.22 -0.23 0.00 0.00 178.00 178.20 2k4z h ASP 35 N 0.00 0.00 0.00 1.44 3.58 -2.03 -3.48 116.42 115.93 2k4z h ASP 35 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2k4z h ASP 35 Cb 0.31 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.36 2k4z h ASP 35 CO 0.00 0.22 0.00 0.61 -2.88 0.00 0.00 179.24 177.19 2k4z n GLY 36 N 1.21 3.41 3.68 -0.78 0.00 -0.59 -5.18 105.19 106.93 2k4z n GLY 36 Ca -0.00 -0.43 -0.29 0.00 0.00 0.00 0.00 46.02 45.30 2k4z n GLY 36 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2k4z s SER 37 N 1.06 4.03 -0.44 1.61 0.15 -1.22 -4.88 113.70 114.02 2k4z s SER 37 Ca 0.00 -1.39 -0.16 0.00 0.70 0.00 0.00 55.95 55.10 2k4z s SER 37 Cb 0.00 -0.18 0.04 0.00 -1.71 0.00 0.00 66.02 64.17 2k4z s SER 37 CO 0.00 -0.57 0.39 -0.63 1.20 0.00 0.00 173.24 173.63 2k4z s ILE 38 N -2.73 5.18 -0.11 6.45 1.01 -1.26 -2.57 121.20 127.16 2k4z s ILE 38 Ca 0.29 -0.68 -0.04 0.00 0.00 0.00 0.00 60.65 60.22 2k4z s ILE 38 Cb 0.07 -4.04 -0.04 0.00 0.01 0.00 0.00 42.46 38.46 2k4z s ILE 38 CO 0.15 -0.45 0.03 -0.62 0.00 0.00 0.00 174.94 174.05 2k4z s ASP 39 N 2.05 5.46 -0.02 3.58 2.15 -0.49 -4.97 116.67 124.42 2k4z s ASP 39 Ca 0.07 0.17 0.07 0.00 0.43 0.00 0.00 52.55 53.29 2k4z s ASP 39 Cb -0.20 -1.68 -0.02 0.00 -0.30 0.00 0.00 42.92 40.72 2k4z s ASP 39 CO 0.10 0.33 -0.23 -0.31 -0.17 0.00 0.00 175.17 174.90 2k4z s TYR 40 N -0.60 2.43 -0.16 -5.34 2.02 -1.26 -0.35 117.35 114.08 2k4z s TYR 40 Ca 0.10 -0.36 -0.03 0.00 -0.37 0.00 0.00 57.07 56.41 2k4z s TYR 40 Cb -0.12 -1.53 -0.02 0.00 -0.40 0.00 0.00 41.96 39.89 2k4z s TYR 40 CO 0.02 0.03 -0.04 0.50 -1.57 0.00 0.00 175.55 174.49 2k4z s ARG 41 N -0.67 3.62 -0.20 -0.62 6.06 0.75 -4.98 118.95 122.90 2k4z s ARG 41 Ca 0.11 -0.54 -0.06 0.00 -2.50 0.00 0.00 55.73 52.73 2k4z s ARG 41 Cb -0.10 -2.90 -0.03 0.00 0.06 0.00 0.00 34.95 31.97 2k4z s ARG 41 CO -0.00 0.19 0.02 1.41 -2.50 0.00 0.00 175.30 174.42 2k4z s MET 42 N 0.49 3.72 -0.11 5.12 -2.45 -1.26 -0.86 119.30 123.94 2k4z s MET 42 Ca -0.04 -0.47 -0.13 0.00 -1.25 0.00 0.00 55.69 53.80 2k4z s MET 42 Cb -0.14 -3.14 0.03 0.00 1.25 0.00 0.00 34.83 32.83 2k4z s MET 42 CO 0.03 0.07 0.35 0.20 1.05 0.00 0.00 175.02 176.72 2k4z s GLY 43 N 0.88 -0.25 0.01 2.11 0.00 -0.88 -5.04 107.32 104.15 2k4z s GLY 43 Ca 0.02 0.88 -0.30 0.00 0.00 0.00 0.00 44.72 45.32 2k4z s GLY 43 CO 0.02 0.73 1.16 -1.36 0.00 0.00 0.00 173.10 173.65 2k4z s PHE 44 N -0.10 3.40 0.27 1.90 0.08 -1.26 -1.11 117.98 121.16 2k4z s PHE 44 Ca -0.03 1.35 -0.01 0.00 0.12 0.00 0.00 56.93 58.37 2k4z s PHE 44 Cb -0.03 -3.36 0.00 0.00 -0.57 0.00 0.00 43.02 39.06 2k4z s PHE 44 CO 0.01 -1.04 0.36 -3.47 -0.10 0.00 0.00 175.22 170.99 2k4z n ASP 45 N 4.34 -1.00 -4.82 1.36 -0.08 0.89 -4.89 116.55 112.34 2k4z n ASP 45 Ca 0.09 -2.46 -0.29 0.00 -1.51 0.00 0.00 54.79 50.62 2k4z n ASP 45 Cb 0.47 1.89 0.11 0.00 2.34 0.00 0.00 41.12 45.93 2k4z n ASP 45 CO 0.00 0.00 0.00 1.51 0.12 0.00 0.00 177.20 178.83 2k4z s ASP 46 N -2.66 4.05 -0.56 1.67 1.47 -1.26 -0.10 116.67 119.26 2k4z s ASP 46 Ca 0.23 1.02 -0.16 0.00 1.18 0.00 0.00 52.55 54.81 2k4z s ASP 46 Cb -0.01 -1.62 0.14 0.00 -0.34 0.00 0.00 42.92 41.09 2k4z s ASP 46 CO 0.16 -2.22 0.52 -0.22 0.68 0.00 0.00 175.17 174.10 2k4z s LEU 47 N -5.84 6.23 -0.08 2.11 0.20 -1.26 -4.59 118.68 115.44 2k4z s LEU 47 Ca 0.62 -1.86 -0.25 0.00 0.69 0.00 0.00 54.13 53.34 2k4z s LEU 47 Cb -0.14 -2.21 -0.03 0.00 -0.43 0.00 0.00 46.19 43.38 2k4z s LEU 47 CO 0.53 -0.84 0.78 -0.89 -0.29 0.00 0.00 176.35 175.63 2k4z s THR 48 N 1.50 4.98 -0.62 3.68 2.01 -1.26 -4.94 115.64 120.98 2k4z s THR 48 Ca 0.04 1.59 0.25 0.00 0.31 0.00 0.00 61.69 63.89 2k4z s THR 48 Cb -0.28 -4.11 0.27 0.00 0.01 0.00 0.00 72.50 68.39 2k4z s THR 48 CO 0.02 0.18 1.75 1.21 -0.69 0.00 0.00 174.62 177.09 2k4z n GLU 49 N 4.17 0.23 0.00 4.92 2.13 -1.26 -1.71 120.64 129.13 2k4z n GLU 49 Ca 0.01 0.31 0.13 0.00 0.66 0.00 0.00 57.16 58.27 2k4z n GLU 49 Cb 0.51 -1.83 0.40 0.00 0.27 0.00 0.00 31.44 30.79 2k4z n GLU 49 CO 0.00 0.00 0.00 -3.47 -0.41 0.00 0.00 177.13 173.25 2k4z n ASP 50 N -2.25 1.56 -3.99 4.31 2.03 -1.26 -4.92 116.55 112.03 2k4z n ASP 50 Ca 0.04 -1.38 -0.20 0.00 0.52 0.00 0.00 54.79 53.77 2k4z n ASP 50 Cb 0.34 0.07 0.11 0.00 -0.72 0.00 0.00 41.12 40.92 2k4z n ASP 50 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 2k4z n ASP 51 N 0.06 0.91 -4.34 1.67 -0.08 -0.69 -4.93 116.55 109.15 2k4z n ASP 51 Ca 0.16 -1.83 -0.41 0.00 -1.51 0.00 0.00 54.79 51.20 2k4z n ASP 51 Cb 0.39 -0.59 -0.10 0.00 2.34 0.00 0.00 41.12 43.15 2k4z n ASP 51 CO 0.00 0.00 0.00 -0.63 0.12 0.00 0.00 177.20 176.69 2k4z s ILE 52 N -2.68 4.49 -0.25 5.18 1.01 -1.23 -4.97 121.20 122.75 2k4z s ILE 52 Ca 0.56 -1.06 -0.18 0.00 0.00 0.00 0.00 60.65 59.96 2k4z s ILE 52 Cb -0.03 -3.60 -0.03 0.00 0.01 0.00 0.00 42.46 38.81 2k4z s ILE 52 CO 0.38 -0.35 0.53 -0.13 0.00 0.00 0.00 174.94 175.36 2k4z s ARG 53 N 1.51 4.09 -0.21 2.79 0.52 -1.26 -1.62 118.95 124.78 2k4z s ARG 53 Ca 0.02 0.36 -0.00 0.00 -0.52 0.00 0.00 55.73 55.59 2k4z s ARG 53 Cb -0.21 -3.64 0.06 0.00 0.52 0.00 0.00 34.95 31.68 2k4z s ARG 53 CO 0.05 -0.32 -0.04 -0.48 0.02 0.00 0.00 175.30 174.53 2k4z s LEU 54 N 2.22 2.10 -0.14 2.53 2.34 0.93 -4.43 118.68 124.23 2k4z s LEU 54 Ca 0.22 -1.00 -0.25 0.00 0.06 0.00 0.00 54.13 53.16 2k4z s LEU 54 Cb -0.16 -1.01 -0.02 0.00 -0.56 0.00 0.00 46.19 44.44 2k4z s LEU 54 CO 0.09 -0.24 0.79 -0.89 -1.06 0.00 0.00 176.35 175.04 2k4z s THR 55 N 1.53 4.93 0.05 5.48 2.01 -1.26 -0.28 115.64 128.11 2k4z s THR 55 Ca -0.04 1.56 0.01 0.00 0.31 0.00 0.00 61.69 63.54 2k4z s THR 55 Cb -0.18 -4.10 0.01 0.00 0.01 0.00 0.00 72.50 68.24 2k4z s THR 55 CO -0.07 0.09 0.08 -1.20 -0.69 0.00 0.00 174.62 172.82 2k4z n SER 56 N 4.86 0.20 -3.54 3.53 7.64 0.30 -4.56 113.62 122.05 2k4z n SER 56 Ca 0.03 -1.14 -0.41 0.00 1.01 0.00 0.00 58.87 58.36 2k4z n SER 56 Cb 0.49 -0.04 -0.01 0.00 -1.01 0.00 0.00 64.21 63.64 2k4z n SER 56 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2k4z n GLU 57 N -1.12 3.57 0.00 1.43 -0.58 -1.26 -3.90 120.64 118.78 2k4z n GLU 57 Ca 0.02 -2.69 0.00 0.00 -0.42 0.00 0.00 57.16 54.06 2k4z n GLU 57 Cb 0.06 -2.94 0.00 0.00 -0.57 0.00 0.00 31.44 27.98 2k4z n GLU 57 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2k4z n GLY 58 N 3.35 3.96 3.11 0.62 0.00 -1.26 -4.75 105.19 110.23 2k4z n GLY 58 Ca 0.63 -0.60 -0.19 0.00 0.00 0.00 0.00 46.02 45.86 2k4z n GLY 58 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2k4z s VAL 59 N 0.00 0.99 -0.12 1.61 1.01 -1.25 -4.92 120.40 117.72 2k4z s VAL 59 Ca 0.00 -0.90 -0.08 0.00 0.00 0.00 0.00 61.98 61.00 2k4z s VAL 59 Cb 0.00 -0.90 -0.04 0.00 0.00 0.00 0.00 36.38 35.44 2k4z s VAL 59 CO 0.00 0.01 0.16 -0.70 0.00 0.00 0.00 175.10 174.56 2k4z s GLU 60 N -1.01 3.54 -0.04 2.72 2.12 -1.26 -0.54 118.70 124.22 2k4z s GLU 60 Ca 0.01 -0.10 0.02 0.00 0.36 0.00 0.00 54.97 55.26 2k4z s GLU 60 Cb -0.07 -3.21 -0.03 0.00 0.26 0.00 0.00 34.13 31.08 2k4z s GLU 60 CO 0.01 0.73 -0.09 0.42 -0.54 0.00 0.00 175.26 175.79 2k4z s ILE 61 N -0.91 3.49 -0.15 -3.70 1.01 0.62 -3.26 121.20 118.30 2k4z s ILE 61 Ca 0.15 -0.63 0.01 0.00 0.00 0.00 0.00 60.65 60.18 2k4z s ILE 61 Cb -0.12 -2.43 0.02 0.00 0.01 0.00 0.00 42.46 39.93 2k4z s ILE 61 CO 0.04 0.54 -0.17 0.68 0.00 0.00 0.00 174.94 176.04 2k4z s VAL 62 N -0.83 1.73 -0.18 2.92 -7.23 0.50 -0.05 120.40 117.25 2k4z s VAL 62 Ca 0.13 -0.75 -0.01 0.00 -1.81 0.00 0.00 61.98 59.55 2k4z s VAL 62 Cb -0.11 -1.58 0.05 0.00 0.56 0.00 0.00 36.38 35.30 2k4z s VAL 62 CO 0.03 0.49 -0.03 -0.63 -0.31 0.00 0.00 175.10 174.64 2k4z s ILE 63 N 1.27 1.02 0.35 -0.62 1.01 -0.64 -2.33 121.20 121.27 2k4z s ILE 63 Ca 0.01 -0.72 -0.27 0.00 0.00 0.00 0.00 60.65 59.67 2k4z s ILE 63 Cb -0.14 -1.31 -0.12 0.00 0.01 0.00 0.00 42.46 40.91 2k4z s ILE 63 CO -0.08 -0.01 1.24 0.00 0.00 0.00 0.00 174.94 176.09 2k4z n ALA 64 N 4.88 1.07 -0.26 9.38 0.00 -1.26 -3.56 120.51 130.76 2k4z n ALA 64 Ca -0.11 0.35 0.28 0.00 0.00 0.00 0.00 53.44 53.96 2k4z n ALA 64 Cb 0.47 -2.22 0.67 0.00 0.00 0.00 0.00 19.45 18.36 2k4z n ALA 64 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2k4z h PRO 65 N 2.37 0.12 -0.06 0.00 0.11 -1.96 0.18 132.00 132.77 2k4z h PRO 65 Ca -0.45 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.63 2k4z h PRO 65 Cb 1.29 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.37 2k4z h PRO 65 CO 0.62 0.08 -0.02 0.22 -0.21 0.00 0.00 178.00 178.69 2k4z h ASP 66 N 0.12 0.12 0.65 -2.05 3.58 -2.01 -3.29 116.42 113.55 2k4z h ASP 66 Ca 0.51 -0.39 -0.19 0.00 0.42 0.00 0.00 57.03 57.38 2k4z h ASP 66 Cb 1.78 -0.03 -0.02 0.00 1.72 0.00 0.00 39.33 42.78 2k4z h ASP 66 CO -0.08 0.48 -0.84 1.88 -2.88 0.00 0.00 179.24 177.79 2k4z h TYR 67 N -0.24 0.19 0.00 0.28 0.05 -1.31 -3.19 116.97 112.75 2k4z h TYR 67 Ca 0.01 -0.10 0.00 0.00 0.05 0.00 0.00 58.73 58.69 2k4z h TYR 67 Cb 0.43 -0.02 0.00 0.00 1.01 0.00 0.00 36.73 38.15 2k4z h TYR 67 CO 0.06 0.91 0.00 1.55 -1.05 0.00 0.00 178.16 179.63 2k4z n VAL 68 N -3.64 1.11 0.21 -2.88 3.14 0.43 -2.66 118.33 114.04 2k4z n VAL 68 Ca -0.03 0.38 0.07 0.00 -2.96 0.00 0.00 64.34 61.81 2k4z n VAL 68 Cb 0.79 -1.29 0.33 0.00 -1.06 0.00 0.00 33.84 32.61 2k4z n VAL 68 CO 0.00 0.00 0.00 -1.20 -6.46 0.00 0.00 176.83 169.17 2k4z n SER 69 N -1.92 0.31 0.00 6.55 7.64 -1.21 -1.74 113.62 123.25 2k4z n SER 69 Ca 0.01 0.62 0.00 0.00 1.01 0.00 0.00 58.87 60.51 2k4z n SER 69 Cb 0.14 -0.67 0.00 0.00 -1.01 0.00 0.00 64.21 62.67 2k4z n SER 69 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2k4z n LEU 70 N -1.88 0.74 -0.78 -3.43 4.77 -1.09 -4.73 117.00 110.59 2k4z n LEU 70 Ca 0.00 -0.85 0.07 0.00 -0.03 0.00 0.00 56.01 55.21 2k4z n LEU 70 Cb 0.08 0.00 0.20 0.00 -2.33 0.00 0.00 43.42 41.37 2k4z n LEU 70 CO 0.09 0.18 0.67 0.18 -1.33 0.00 0.00 177.39 177.18 2k4z n LEU 71 N -0.22 3.39 0.00 2.23 4.77 -0.71 -4.73 117.00 121.73 2k4z n LEU 71 Ca 0.00 -2.42 0.00 0.00 -0.03 0.00 0.00 56.01 53.56 2k4z n LEU 71 Cb 0.01 -0.37 0.00 0.00 -2.33 0.00 0.00 43.42 40.73 2k4z n LEU 71 CO 0.00 0.71 0.49 -0.90 -1.33 0.00 0.00 177.39 176.36 2k4z n ASP 72 N 0.14 0.00 -1.47 -1.43 5.75 -1.23 -3.00 116.55 115.31 2k4z n ASP 72 Ca 0.16 0.97 -0.02 0.00 -0.01 0.00 0.00 54.79 55.89 2k4z n ASP 72 Cb 0.63 -0.47 0.19 0.00 -1.03 0.00 0.00 41.12 40.44 2k4z n ASP 72 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2k4z n GLN 73 N -2.04 2.77 -2.47 0.11 6.02 -1.26 -2.45 117.38 118.06 2k4z n GLN 73 Ca 0.00 -1.84 -0.43 0.00 -0.01 0.00 0.00 57.00 54.72 2k4z n GLN 73 Cb 0.00 -1.87 -0.02 0.00 1.02 0.00 0.00 30.24 29.37 2k4z n GLN 73 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 2k4z s THR 74 N -2.01 4.28 -0.11 5.09 2.01 -1.16 -3.86 115.64 119.87 2k4z s THR 74 Ca 0.33 1.50 -0.11 0.00 0.31 0.00 0.00 61.69 63.72 2k4z s THR 74 Cb 0.26 -4.14 -0.05 0.00 0.01 0.00 0.00 72.50 68.58 2k4z s THR 74 CO 0.08 -0.32 0.25 -0.89 -0.69 0.00 0.00 174.62 173.05 2k4z s THR 75 N 3.87 5.32 -0.17 -0.82 2.01 -1.26 -1.47 115.64 123.12 2k4z s THR 75 Ca 0.53 0.46 -0.02 0.00 0.31 0.00 0.00 61.69 62.97 2k4z s THR 75 Cb -0.18 -3.55 -0.01 0.00 0.01 0.00 0.00 72.50 68.78 2k4z s THR 75 CO 0.18 0.53 -0.10 -0.22 -0.69 0.00 0.00 174.62 174.32 2k4z s LEU 76 N -0.53 2.75 0.05 4.42 2.96 0.88 -1.03 118.68 128.17 2k4z s LEU 76 Ca 0.17 -0.38 0.01 0.00 -0.22 0.00 0.00 54.13 53.71 2k4z s LEU 76 Cb -0.13 -1.66 -0.03 0.00 0.50 0.00 0.00 46.19 44.87 2k4z s LEU 76 CO 0.06 0.07 -0.06 -0.62 -1.32 0.00 0.00 176.35 174.48 2k4z s ASP 77 N 0.92 0.71 -0.24 3.68 2.15 -1.06 -2.55 116.67 120.28 2k4z s ASP 77 Ca -0.02 -0.72 -0.07 0.00 0.43 0.00 0.00 52.55 52.17 2k4z s ASP 77 Cb -0.15 0.09 -0.03 0.00 -0.30 0.00 0.00 42.92 42.54 2k4z s ASP 77 CO -0.00 -0.36 0.05 -0.72 -0.17 0.00 0.00 175.17 173.97 2k4z s TYR 78 N -2.37 3.07 0.13 -5.34 1.13 -1.26 -0.20 117.35 112.51 2k4z s TYR 78 Ca -0.03 -0.49 0.10 0.00 -1.41 0.00 0.00 57.07 55.23 2k4z s TYR 78 Cb -0.03 -2.20 -0.04 0.00 -1.10 0.00 0.00 41.96 38.59 2k4z s TYR 78 CO -0.03 -0.36 -0.23 0.14 -2.51 0.00 0.00 175.55 172.56 2k4z s VAL 79 N 1.51 1.98 -0.76 -3.49 -7.23 0.13 -4.88 120.40 107.66 2k4z s VAL 79 Ca 0.06 -1.71 -0.15 0.00 -1.81 0.00 0.00 61.98 58.37 2k4z s VAL 79 Cb -0.15 -1.80 0.18 0.00 0.56 0.00 0.00 36.38 35.18 2k4z s VAL 79 CO 0.02 -0.04 0.75 -0.70 -0.31 0.00 0.00 175.10 174.83 2k4z s GLU 80 N -2.13 3.44 0.23 4.82 2.12 -1.26 -0.35 118.70 125.57 2k4z s GLU 80 Ca 0.11 -2.14 0.01 0.00 0.36 0.00 0.00 54.97 53.31 2k4z s GLU 80 Cb -0.09 -4.45 0.25 0.00 0.26 0.00 0.00 34.13 30.10 2k4z s GLU 80 CO 0.06 -1.37 1.59 -0.07 -0.54 0.00 0.00 175.26 174.92 2k4z h LEU 81 N 8.48 0.49 -7.84 2.70 3.38 -1.93 -3.43 115.31 117.16 2k4z h LEU 81 Ca 0.00 -0.23 -0.32 0.00 0.09 0.00 0.00 57.88 57.42 2k4z h LEU 81 Cb 1.05 -0.14 -0.29 0.00 0.09 0.00 0.00 40.66 41.37 2k4z h LEU 81 CO 0.88 0.88 -0.75 -1.61 0.09 0.00 0.00 178.44 177.93 2k4z s GLU 82 N -4.11 0.38 -0.37 1.13 2.02 -1.26 -5.07 118.70 111.41 2k4z s GLU 82 Ca -0.06 -0.13 -0.40 0.00 0.02 0.00 0.00 54.97 54.40 2k4z s GLU 82 Cb 0.12 -0.39 -0.15 0.00 0.10 0.00 0.00 34.13 33.81 2k4z s GLU 82 CO 0.81 0.06 1.99 -0.35 0.02 0.00 0.00 175.26 177.79 2k4z n PRO 83 N 3.18 0.77 0.00 0.39 -0.04 -1.26 0.05 135.00 138.08 2k4z n PRO 83 Ca -0.15 0.24 0.00 0.00 -0.04 0.00 0.00 63.50 63.55 2k4z n PRO 83 Cb 0.57 -2.04 0.00 0.00 -0.04 0.00 0.00 33.50 31.99 2k4z n PRO 83 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2k4z n GLY 84 N 5.80 3.13 3.23 0.55 0.00 -1.26 -5.03 105.19 111.62 2k4z n GLY 84 Ca 0.39 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.99 2k4z n GLY 84 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2k4z s GLN 85 N -0.71 2.58 -0.51 1.61 -0.21 0.11 -5.03 119.66 117.49 2k4z s GLN 85 Ca 0.00 -1.74 -0.19 0.00 0.02 0.00 0.00 55.36 53.45 2k4z s GLN 85 Cb 0.00 -3.99 0.06 0.00 1.00 0.00 0.00 33.01 30.08 2k4z s GLN 85 CO 0.00 -1.20 0.64 -0.06 -2.12 0.00 0.00 175.29 172.54 2k4z s PHE 86 N 1.41 3.04 -0.14 0.91 0.08 -1.26 -3.26 117.98 118.76 2k4z s PHE 86 Ca 0.05 -0.52 -0.06 0.00 0.12 0.00 0.00 56.93 56.53 2k4z s PHE 86 Cb -0.27 -3.55 -0.04 0.00 -0.57 0.00 0.00 43.02 38.59 2k4z s PHE 86 CO 0.00 -1.04 0.08 -1.01 -0.10 0.00 0.00 175.22 173.15 2k4z s HIS 87 N 2.67 3.35 -0.32 0.36 3.76 0.52 -4.85 115.29 120.79 2k4z s HIS 87 Ca 0.16 0.27 -0.29 0.00 -0.15 0.00 0.00 55.06 55.05 2k4z s HIS 87 Cb -0.19 -1.96 0.02 0.00 1.11 0.00 0.00 32.58 31.56 2k4z s HIS 87 CO 0.12 0.44 1.11 -0.06 -0.85 0.00 0.00 174.74 175.50 2k4z s PHE 88 N -0.43 3.07 -0.11 1.40 0.08 -1.26 -0.69 117.98 120.04 2k4z s PHE 88 Ca 0.10 1.13 -0.02 0.00 0.12 0.00 0.00 56.93 58.26 2k4z s PHE 88 Cb -0.12 -3.75 -0.03 0.00 -0.57 0.00 0.00 43.02 38.55 2k4z s PHE 88 CO 0.02 -0.92 -0.03 0.96 -0.10 0.00 0.00 175.22 175.15 2k4z s ILE 89 N 3.77 4.05 -0.73 0.64 -4.36 0.72 -4.95 121.20 120.34 2k4z s ILE 89 Ca 0.47 -0.33 -0.22 0.00 -0.26 0.00 0.00 60.65 60.31 2k4z s ILE 89 Cb -0.13 -2.73 0.08 0.00 1.25 0.00 0.00 42.46 40.94 2k4z s ILE 89 CO 0.17 0.55 1.03 -0.36 0.24 0.00 0.00 174.94 176.57 2k4z s PHE 90 N -0.32 2.74 0.01 1.37 0.08 -1.26 -2.55 117.98 118.05 2k4z s PHE 90 Ca 0.06 -0.71 -0.24 0.00 0.12 0.00 0.00 56.93 56.16 2k4z s PHE 90 Cb -0.12 -4.32 -0.13 0.00 -0.57 0.00 0.00 43.02 37.87 2k4z s PHE 90 CO 0.02 -1.65 1.07 -0.07 -0.10 0.00 0.00 175.22 174.50 2k4z h LEU 91 N 11.31 -0.73 -2.53 -0.37 3.38 -1.46 -3.48 115.31 121.43 2k4z h LEU 91 Ca -0.18 0.03 -0.08 0.00 0.09 0.00 0.00 57.88 57.74 2k4z h LEU 91 Cb 1.06 0.19 0.00 0.00 0.09 0.00 0.00 40.66 42.00 2k4z h LEU 91 CO 1.18 -0.40 -0.59 -3.20 0.09 0.00 0.00 178.44 175.53 2k4z n ASN 92 N -5.00 -7.48 -4.13 -0.43 5.15 -1.25 -4.69 115.26 97.43 2k4z n ASN 92 Ca -0.11 0.34 -0.35 0.00 -0.60 0.00 0.00 54.58 53.86 2k4z n ASN 92 Cb 0.34 -4.70 -0.07 0.00 -0.53 0.00 0.00 39.78 34.82 2k4z n ASN 92 CO 0.00 0.00 0.00 -2.65 1.40 0.00 0.00 177.26 176.01 2k4z n PRO 93 N -0.47 1.37 0.12 1.20 -0.02 -1.25 -3.53 135.00 132.42 2k4z n PRO 93 Ca 0.07 -2.08 0.00 0.00 -2.02 0.00 0.00 63.50 59.46 2k4z n PRO 93 Cb 0.51 -3.34 0.00 0.00 -0.02 0.00 0.00 33.50 30.65 2k4z n PRO 93 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 2k4z n ARG 94 N 7.75 0.00 -0.11 -0.52 0.63 -1.26 -5.01 116.66 118.14 2k4z n ARG 94 Ca 0.47 0.00 -0.17 0.00 -0.92 0.00 0.00 57.85 57.22 2k4z n ARG 94 Cb 0.44 0.00 -0.06 0.00 0.45 0.00 0.00 32.46 33.29 2k4z n ARG 94 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 2k4z n ASP 95 N -3.06 1.94 -4.65 6.15 8.00 -1.23 -4.88 116.55 118.82 2k4z n ASP 95 Ca 0.00 0.35 -0.43 0.00 0.71 0.00 0.00 54.79 55.42 2k4z n ASP 95 Cb 0.00 -0.79 -0.02 0.00 -0.02 0.00 0.00 41.12 40.29 2k4z n ASP 95 CO 0.00 0.00 0.00 -2.84 -0.39 0.00 0.00 177.20 173.97 2k4z s PRO 96 N -2.70 4.14 -0.30 -0.24 0.02 -1.26 -5.01 135.00 129.65 2k4z s PRO 96 Ca -0.32 1.47 -0.13 0.00 0.02 0.00 0.00 61.00 62.03 2k4z s PRO 96 Cb 0.08 -3.78 -0.03 0.00 0.02 0.00 0.00 34.50 30.79 2k4z s PRO 96 CO 0.45 -0.82 0.30 0.95 -0.33 0.00 0.00 177.00 177.54 2k4z s THR 97 N 3.72 5.23 -0.50 0.99 -4.23 -1.26 -4.69 115.64 114.90 2k4z s THR 97 Ca 0.53 0.24 -0.19 0.00 -1.18 0.00 0.00 61.69 61.09 2k4z s THR 97 Cb -0.19 -3.67 0.06 0.00 1.34 0.00 0.00 72.50 70.04 2k4z s THR 97 CO 0.16 0.12 0.60 -0.31 -0.54 0.00 0.00 174.62 174.65 2k4z s TYR 98 N 1.92 3.07 -0.32 3.99 2.02 -1.26 -5.04 117.35 121.73 2k4z s TYR 98 Ca 0.11 -0.56 -0.23 0.00 -0.37 0.00 0.00 57.07 56.02 2k4z s TYR 98 Cb -0.16 -3.49 0.00 0.00 -0.40 0.00 0.00 41.96 37.91 2k4z s TYR 98 CO 0.11 -1.00 0.75 1.03 -1.57 0.00 0.00 175.55 174.86 2k4z s ARG 99 N 2.54 3.91 0.55 -0.62 0.52 -1.26 -5.05 118.95 119.53 2k4z s ARG 99 Ca 0.14 0.47 0.01 0.00 -0.52 0.00 0.00 55.73 55.83 2k4z s ARG 99 Cb -0.19 -3.74 0.03 0.00 0.52 0.00 0.00 34.95 31.56 2k4z s ARG 99 CO 0.12 -0.69 0.77 -1.25 0.02 0.00 0.00 175.30 174.27 2k4z s PRO 100 N 2.90 2.57 0.00 3.54 0.04 -1.26 -4.98 135.00 137.82 2k4z s PRO 100 Ca 0.31 -0.75 0.10 0.00 0.04 0.00 0.00 61.00 60.70 2k4z s PRO 100 Cb -0.14 -2.48 0.46 0.00 0.04 0.00 0.00 34.50 32.37 2k4z s PRO 100 CO 0.13 -0.70 1.29 -0.35 0.04 0.00 0.00 177.00 177.41 2k4z n PRO 101 N -2.34 0.05 0.28 0.56 -0.04 -1.26 -2.29 135.00 129.96 2k4z n PRO 101 Ca 0.08 0.28 0.18 0.00 -0.04 0.00 0.00 63.50 63.99 2k4z n PRO 101 Cb 0.60 -1.50 0.74 0.00 -0.04 0.00 0.00 33.50 33.30 2k4z n PRO 101 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 2k4z h SER 102 N 0.00 0.00 -2.57 3.54 0.02 -2.01 -3.42 113.55 109.11 2k4z h SER 102 Ca 0.00 0.00 -0.57 0.00 -0.84 0.00 0.00 61.79 60.38 2k4z h SER 102 Cb 0.15 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.67 2k4z h SER 102 CO 0.00 0.01 1.22 -0.83 -1.14 0.00 0.00 176.83 176.09 2k4z s GLY 103 N -4.18 1.08 0.00 -3.77 0.00 -0.97 -5.27 107.32 94.21 2k4z s GLY 103 Ca 0.00 0.62 0.00 0.00 0.00 0.00 0.00 44.72 45.34 2k4z s GLY 103 CO 0.53 3.23 0.00 0.61 0.00 0.00 0.00 173.10 177.47