#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 2.98 3.17 3.03 0.00 -1.26 -4.76 105.19 108.36 2k4z n GLY -19 Ca 0.00 -1.15 -0.39 0.00 0.00 0.00 0.00 46.02 44.47 2k4z n GLY -19 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2k4z s SER -18 N 1.99 5.55 -0.42 1.61 0.01 -1.26 -5.05 113.70 116.13 2k4z s SER -18 Ca 0.64 -2.11 -0.14 0.00 1.31 0.00 0.00 55.95 55.64 2k4z s SER -18 Cb 0.30 -1.94 0.04 0.00 0.21 0.00 0.00 66.02 64.63 2k4z s SER -18 CO -0.00 -0.60 0.31 -0.44 0.41 0.00 0.00 173.24 172.92 2k4z s SER -17 N 2.12 6.03 -0.48 2.44 0.01 -1.26 -5.03 113.70 117.52 2k4z s SER -17 Ca 0.09 -1.07 -0.28 0.00 1.31 0.00 0.00 55.95 55.99 2k4z s SER -17 Cb -0.24 -2.13 0.01 0.00 0.21 0.00 0.00 66.02 63.87 2k4z s SER -17 CO -0.03 -0.50 1.43 -2.28 0.41 0.00 0.00 173.24 172.28 2k4z s HIS -16 N 1.63 2.32 -0.04 2.43 2.46 -1.26 -4.97 115.29 117.86 2k4z s HIS -16 Ca 0.04 0.60 -0.30 0.00 0.47 0.00 0.00 55.06 55.87 2k4z s HIS -16 Cb -0.21 -4.34 -0.03 0.00 -0.13 0.00 0.00 32.58 27.87 2k4z s HIS -16 CO 0.08 -2.00 1.12 -1.01 -2.47 0.00 0.00 174.74 170.47 2k4z s HIS -15 N 5.82 3.37 -0.37 3.88 3.76 -1.26 -5.00 115.29 125.49 2k4z s HIS -15 Ca 0.58 1.39 -0.17 0.00 -0.15 0.00 0.00 55.06 56.71 2k4z s HIS -15 Cb -0.12 -3.32 0.00 0.00 1.11 0.00 0.00 32.58 30.24 2k4z s HIS -15 CO 0.29 -0.87 0.44 -1.58 -0.85 0.00 0.00 174.74 172.18 2k4z s HIS -14 N 1.84 3.18 0.17 1.40 2.46 -1.26 -5.06 115.29 118.02 2k4z s HIS -14 Ca 0.54 -0.06 0.03 0.00 0.47 0.00 0.00 55.06 56.04 2k4z s HIS -14 Cb -0.23 -2.83 -0.03 0.00 -0.13 0.00 0.00 32.58 29.35 2k4z s HIS -14 CO 0.23 -0.56 0.30 -1.01 -2.47 0.00 0.00 174.74 171.23 2k4z s HIS -13 N 2.19 3.45 0.18 3.88 3.76 -1.26 -5.02 115.29 122.48 2k4z s HIS -13 Ca 0.14 0.07 -0.10 0.00 -0.15 0.00 0.00 55.06 55.02 2k4z s HIS -13 Cb -0.16 -1.63 0.06 0.00 1.11 0.00 0.00 32.58 31.96 2k4z s HIS -13 CO 0.13 0.50 1.65 0.45 -0.85 0.00 0.00 174.74 176.61 2k4z h HIS -12 N 1.89 1.11 -3.06 1.40 3.86 -2.07 -3.35 115.15 114.94 2k4z h HIS -12 Ca -0.49 -0.18 -0.75 0.00 -1.16 0.00 0.00 60.37 57.79 2k4z h HIS -12 Cb 1.20 -0.30 -0.23 0.00 1.06 0.00 0.00 27.41 29.15 2k4z h HIS -12 CO 0.51 0.98 -0.12 -1.01 0.86 0.00 0.00 177.93 179.14 2k4z s HIS -11 N -5.10 3.20 0.68 2.45 4.02 -1.26 -5.06 115.29 114.23 2k4z s HIS -11 Ca -0.12 -1.23 -0.11 0.00 1.02 0.00 0.00 55.06 54.62 2k4z s HIS -11 Cb 0.13 -3.86 0.00 0.00 -1.02 0.00 0.00 32.58 27.84 2k4z s HIS -11 CO 0.85 -1.09 1.06 -1.12 1.02 0.00 0.00 174.74 175.46 2k4z s SER -10 N 3.57 5.58 0.06 1.40 0.01 -1.26 -4.95 113.70 118.12 2k4z s SER -10 Ca 0.06 1.40 0.23 0.00 1.31 0.00 0.00 55.95 58.94 2k4z s SER -10 Cb -0.28 -2.30 0.93 0.00 0.21 0.00 0.00 66.02 64.57 2k4z s SER -10 CO 0.03 -1.28 1.71 -1.20 0.41 0.00 0.00 173.24 172.91 2k4z n SER -9 N -3.01 0.20 -0.01 2.44 7.64 -1.26 -2.63 113.62 117.00 2k4z n SER -9 Ca 0.07 0.53 0.09 0.00 1.01 0.00 0.00 58.87 60.57 2k4z n SER -9 Cb 0.55 -0.58 0.50 0.00 -1.01 0.00 0.00 64.21 63.67 2k4z n SER -9 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2k4z n GLY -8 N 0.74 -0.99 0.15 0.23 0.00 -1.26 -3.17 105.19 100.89 2k4z n GLY -8 Ca 0.05 -0.11 0.13 0.00 0.00 0.00 0.00 46.02 46.09 2k4z n GLY -8 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2k4z h LEU -7 N 0.02 0.00-10.12 0.99 5.85 -1.90 -3.45 115.31 106.71 2k4z h LEU -7 Ca 0.00 0.00 -0.51 0.00 0.84 0.00 0.00 57.88 58.21 2k4z h LEU -7 Cb 0.01 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.02 2k4z h LEU -7 CO 0.00 0.00 -0.30 0.68 -0.34 0.00 0.00 178.44 178.48 2k4z s VAL -6 N -3.16 5.18 -0.35 1.05 -7.23 -1.19 -5.01 120.40 109.68 2k4z s VAL -6 Ca 0.09 -0.42 -0.28 0.00 -1.81 0.00 0.00 61.98 59.56 2k4z s VAL -6 Cb 0.10 -3.77 -0.07 0.00 0.56 0.00 0.00 36.38 33.19 2k4z s VAL -6 CO 0.61 -0.28 2.31 -2.65 -0.31 0.00 0.00 175.10 174.78 2k4z n PRO -5 N -1.00 1.49 -3.85 4.82 -0.02 -1.26 -4.93 135.00 130.24 2k4z n PRO -5 Ca -0.05 0.29 -0.30 0.00 -2.02 0.00 0.00 63.50 61.43 2k4z n PRO -5 Cb 0.55 -3.21 -0.15 0.00 -0.02 0.00 0.00 33.50 30.66 2k4z n PRO -5 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2k4z s ARG -4 N 7.16 1.16 0.00 -0.52 1.81 -1.26 -5.07 118.95 122.22 2k4z s ARG -4 Ca 1.02 -1.09 0.00 0.00 -1.72 0.00 0.00 55.73 53.94 2k4z s ARG -4 Cb -0.34 -2.42 0.00 0.00 -0.45 0.00 0.00 34.95 31.74 2k4z s ARG -4 CO 0.33 -0.79 0.00 0.41 -0.68 0.00 0.00 175.30 174.57 2k4z n GLY -3 N 4.71 3.23 3.90 -3.53 0.00 -1.26 -5.13 105.19 107.11 2k4z n GLY -3 Ca -0.06 -1.56 -0.30 0.00 0.00 0.00 0.00 46.02 44.10 2k4z n GLY -3 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2k4z s SER -2 N 0.00 6.50 0.00 1.61 0.01 -1.26 -5.06 113.70 115.50 2k4z s SER -2 Ca 0.00 0.68 0.00 0.00 1.31 0.00 0.00 55.95 57.94 2k4z s SER -2 Cb 0.00 -2.13 0.00 0.00 0.21 0.00 0.00 66.02 64.10 2k4z s SER -2 CO 0.00 -0.05 0.00 1.41 0.41 0.00 0.00 173.24 175.01 2k4z n HIS -1 N -0.29 0.00 -2.77 2.43 8.25 -1.26 -4.81 115.22 116.77 2k4z n HIS -1 Ca -0.02 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.02 2k4z n HIS -1 Cb 0.53 -0.25 -0.03 0.00 1.12 0.00 0.00 29.99 31.35 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 -0.70 3.96 -0.89 -0.41 -2.45 -1.26 -4.94 119.30 112.62 2k4z s MET 0 Ca 0.00 0.78 -0.05 0.00 -1.25 0.00 0.00 55.69 55.17 2k4z s MET 0 Cb 0.00 -3.76 0.07 0.00 1.25 0.00 0.00 34.83 32.39 2k4z s MET 0 CO 0.00 -0.87 2.62 -1.33 1.05 0.00 0.00 175.02 176.50 2k4z n MET 1 N 6.68 3.49 -2.62 4.11 0.00 -1.26 -4.85 117.12 122.67 2k4z n MET 1 Ca 0.08 -2.83 -0.42 0.00 0.00 0.00 0.00 57.70 54.53 2k4z n MET 1 Cb 0.48 -2.39 -0.03 0.00 0.00 0.00 0.00 33.22 31.28 2k4z n MET 1 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 175.97 176.09 2k4z s PHE 2 N -1.25 2.44 -0.52 2.03 5.36 -1.26 -2.76 117.98 122.03 2k4z s PHE 2 Ca 0.57 -0.01 -0.16 0.00 -0.96 0.00 0.00 56.93 56.37 2k4z s PHE 2 Cb 0.28 -4.52 0.10 0.00 -0.34 0.00 0.00 43.02 38.54 2k4z s PHE 2 CO -0.15 -1.86 0.48 0.15 -1.46 0.00 0.00 175.22 172.38 2k4z s LYS 3 N 5.22 3.00 -0.27 10.12 1.02 -0.24 -4.99 119.74 133.60 2k4z s LYS 3 Ca 0.35 -1.51 -0.12 0.00 0.02 0.00 0.00 55.97 54.71 2k4z s LYS 3 Cb -0.09 -4.22 -0.05 0.00 -0.52 0.00 0.00 37.83 32.95 2k4z s LYS 3 CO 0.17 -1.23 0.25 -1.17 -0.92 0.00 0.00 175.35 172.46 2k4z s LEU 4 N 1.74 4.05 0.32 3.17 0.20 -1.26 0.18 118.68 127.08 2k4z s LEU 4 Ca 0.05 0.13 -0.29 0.00 0.69 0.00 0.00 54.13 54.70 2k4z s LEU 4 Cb -0.27 -2.23 -0.10 0.00 -0.43 0.00 0.00 46.19 43.16 2k4z s LEU 4 CO 0.05 -0.07 1.32 0.42 -0.29 0.00 0.00 176.35 177.77 2k4z s THR 5 N 1.71 2.74 0.39 3.68 -4.23 -0.66 -4.82 115.64 114.45 2k4z s THR 5 Ca 0.10 0.73 0.13 0.00 -1.18 0.00 0.00 61.69 61.47 2k4z s THR 5 Cb -0.15 -3.47 0.35 0.00 1.34 0.00 0.00 72.50 70.57 2k4z s THR 5 CO 0.09 0.17 1.87 -0.65 -0.54 0.00 0.00 174.62 175.56 2k4z h PRO 6 N 3.63 0.52 -0.30 3.99 0.11 -1.95 0.20 132.00 138.20 2k4z h PRO 6 Ca -0.48 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 65.57 2k4z h PRO 6 Cb 1.22 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 32.20 2k4z h PRO 6 CO 0.67 0.34 0.08 0.00 -0.21 0.00 0.00 178.00 178.89 2k4z h ALA 7 N 1.62 0.39 -0.11 -0.75 0.00 -1.97 -2.14 119.26 116.30 2k4z h ALA 7 Ca 0.44 -0.16 -0.16 0.00 0.00 0.00 0.00 54.91 55.03 2k4z h ALA 7 Cb 0.91 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 2k4z h ALA 7 CO -0.19 0.04 -0.63 0.00 0.00 0.00 0.00 179.25 178.47 2k4z h ALA 8 N 0.91 0.71 -0.33 0.00 0.00 -1.61 -3.01 119.26 115.93 2k4z h ALA 8 Ca 0.09 -0.56 0.02 0.00 0.00 0.00 0.00 54.91 54.46 2k4z h ALA 8 Cb 0.27 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 2k4z h ALA 8 CO -0.00 0.73 0.22 0.00 0.00 0.00 0.00 179.25 180.20 2k4z h ALA 9 N 1.03 1.82 -0.17 0.00 0.00 -0.47 -0.75 119.26 120.72 2k4z h ALA 9 Ca -0.01 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.76 2k4z h ALA 9 Cb 1.18 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.84 2k4z h ALA 9 CO 0.11 0.15 -0.40 1.49 0.00 0.00 0.00 179.25 180.59 2k4z h GLU 10 N 0.40 0.38 -0.14 0.00 4.81 -1.25 0.15 114.58 118.93 2k4z h GLU 10 Ca 0.13 -0.19 -0.20 0.00 -0.13 0.00 0.00 59.36 58.97 2k4z h GLU 10 Cb 0.03 -0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.41 2k4z h GLU 10 CO -0.03 0.73 -0.73 0.37 -0.73 0.00 0.00 179.01 178.61 2k4z h GLN 11 N 0.32 0.66 -0.48 1.92 4.15 -1.21 0.86 115.11 121.33 2k4z h GLN 11 Ca 0.03 -0.52 -0.04 0.00 0.77 0.00 0.00 58.65 58.89 2k4z h GLN 11 Cb 0.85 0.10 -0.02 0.00 0.21 0.00 0.00 27.48 28.62 2k4z h GLN 11 CO 0.07 1.14 0.15 0.28 -1.93 0.00 0.00 178.83 178.54 2k4z h VAL 12 N 0.46 1.23 -0.36 2.39 2.07 -1.00 -2.41 116.25 118.62 2k4z h VAL 12 Ca -0.04 -0.76 -0.03 0.00 0.82 0.00 0.00 66.70 66.69 2k4z h VAL 12 Cb 1.34 0.81 -0.02 0.00 -1.52 0.00 0.00 31.29 31.90 2k4z h VAL 12 CO 0.14 0.28 0.08 0.25 0.02 0.00 0.00 177.57 178.34 2k4z h LEU 13 N 0.64 0.49 -0.89 2.57 5.85 -0.58 -2.22 115.31 121.18 2k4z h LEU 13 Ca 0.15 -0.07 0.02 0.00 0.84 0.00 0.00 57.88 58.83 2k4z h LEU 13 Cb 0.27 -0.13 -0.05 0.00 0.37 0.00 0.00 40.66 41.13 2k4z h LEU 13 CO -0.00 0.50 0.59 0.50 -0.34 0.00 0.00 178.44 179.68 2k4z h LYS 14 N 0.53 1.14 -0.31 1.25 3.64 -0.37 0.41 116.57 122.85 2k4z h LYS 14 Ca 0.12 -0.07 -0.05 0.00 -1.27 0.00 0.00 60.65 59.39 2k4z h LYS 14 Cb 0.21 -0.26 -0.02 0.00 -0.41 0.00 0.00 32.23 31.76 2k4z h LYS 14 CO -0.00 0.76 -0.00 0.00 -2.27 0.00 0.00 179.45 177.93 2k4z h ALA 15 N 1.34 1.41 0.04 5.00 0.00 -0.94 -1.33 119.26 124.78 2k4z h ALA 15 Ca 0.34 -0.19 -0.22 0.00 0.00 0.00 0.00 54.91 54.83 2k4z h ALA 15 Cb -0.09 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 2k4z h ALA 15 CO -0.09 0.41 -1.01 0.00 0.00 0.00 0.00 179.25 178.56 2k4z h ALA 16 N 1.54 0.35 0.00 0.00 0.00 -1.15 -3.17 119.26 116.83 2k4z h ALA 16 Ca 0.10 -0.81 0.00 0.00 0.00 0.00 0.00 54.91 54.20 2k4z h ALA 16 Cb 0.31 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.04 2k4z h ALA 16 CO 0.01 1.00 0.00 -0.22 0.00 0.00 0.00 179.25 180.03 2k4z h LYS 17 N 0.08 0.00 0.00 0.00 3.64 0.59 -0.95 116.57 119.93 2k4z h LYS 17 Ca -0.06 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.31 2k4z h LYS 17 Cb 1.70 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 33.52 2k4z h LYS 17 CO 0.15 0.00 -0.02 1.96 -2.27 0.00 0.00 179.45 179.27 2k4z h GLN 18 N 0.00 0.00 0.00 1.90 4.20 -1.24 -3.48 115.11 116.48 2k4z h GLN 18 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2k4z h GLN 18 Cb 0.30 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.08 2k4z h GLN 18 CO 0.00 0.02 0.00 0.41 -0.67 0.00 0.00 178.83 178.59 2k4z n GLY 19 N -0.73 2.50 1.61 3.46 0.00 -0.36 -4.98 105.19 106.68 2k4z n GLY 19 Ca -0.02 -1.70 0.00 0.00 0.00 0.00 0.00 46.02 44.30 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 1.28 2.44 0.02 -0.02 0.00 -1.26 -4.69 105.19 102.96 2k4z n GLY 20 Ca 0.00 -0.51 0.12 0.00 0.00 0.00 0.00 46.02 45.63 2k4z n GLY 20 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2k4z n THR 21 N 0.00 0.45 -1.73 2.61 -2.24 -1.26 -4.79 114.28 107.31 2k4z n THR 21 Ca 0.00 0.06 -0.42 0.00 -2.27 0.00 0.00 64.05 61.42 2k4z n THR 21 Cb 0.00 -0.72 -0.02 0.00 -2.10 0.00 0.00 70.33 67.49 2k4z n THR 21 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2k4z n GLU 22 N -1.65 2.66 0.00 -0.78 1.02 -1.26 -1.31 120.64 119.32 2k4z n GLU 22 Ca 0.05 0.95 0.00 0.00 -0.02 0.00 0.00 57.16 58.15 2k4z n GLU 22 Cb 0.29 -2.74 0.00 0.00 -0.02 0.00 0.00 31.44 28.97 2k4z n GLU 22 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2k4z n GLY 23 N 2.67 3.21 3.36 0.62 0.00 -1.26 -4.99 105.19 108.81 2k4z n GLY 23 Ca 0.11 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.68 2k4z n GLY 23 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2k4z s MET 24 N -0.50 3.03 0.79 1.61 -1.94 -0.43 -4.78 119.30 117.08 2k4z s MET 24 Ca 0.00 -1.39 -0.11 0.00 -1.71 0.00 0.00 55.69 52.47 2k4z s MET 24 Cb 0.00 -4.26 0.07 0.00 2.01 0.00 0.00 34.83 32.66 2k4z s MET 24 CO 0.00 -1.43 1.12 0.00 -0.01 0.00 0.00 175.02 174.70 2k4z s LEU 26 N -5.88 3.75 -0.18 0.00 2.96 -0.80 -0.40 118.68 118.13 2k4z s LEU 26 Ca 0.65 0.77 -0.10 0.00 -0.22 0.00 0.00 54.13 55.23 2k4z s LEU 26 Cb -0.20 -3.55 -0.05 0.00 0.50 0.00 0.00 46.19 42.89 2k4z s LEU 26 CO 0.53 -1.14 0.14 -0.60 -1.32 0.00 0.00 176.35 173.96 2k4z s ARG 27 N 4.24 4.07 -0.25 1.98 3.52 0.60 -0.26 118.95 132.84 2k4z s ARG 27 Ca 0.50 -0.18 -0.11 0.00 -0.13 0.00 0.00 55.73 55.81 2k4z s ARG 27 Cb -0.10 -3.38 -0.05 0.00 -1.56 0.00 0.00 34.95 29.86 2k4z s ARG 27 CO 0.26 0.38 0.19 -0.51 -0.81 0.00 0.00 175.30 174.81 2k4z s LEU 28 N 0.12 4.08 -0.24 -0.88 1.43 -1.20 -2.33 118.68 119.67 2k4z s LEU 28 Ca 0.10 0.10 -0.04 0.00 -1.03 0.00 0.00 54.13 53.26 2k4z s LEU 28 Cb -0.11 -2.14 0.00 0.00 0.03 0.00 0.00 46.19 43.97 2k4z s LEU 28 CO -0.01 0.01 -0.03 0.00 0.23 0.00 0.00 176.35 176.56 2k4z s ALA 29 N 1.33 2.82 -0.54 4.21 0.00 -0.09 -4.62 121.76 124.86 2k4z s ALA 29 Ca 0.08 -1.29 -0.18 0.00 0.00 0.00 0.00 51.96 50.57 2k4z s ALA 29 Cb -0.14 -1.76 0.09 0.00 0.00 0.00 0.00 23.12 21.30 2k4z s ALA 29 CO 0.07 -0.60 0.61 0.00 0.00 0.00 0.00 175.76 175.83 2k4z s ALA 30 N 1.44 3.47 -0.32 0.00 0.00 -1.25 -1.12 121.76 123.97 2k4z s ALA 30 Ca 0.04 -2.13 -0.29 0.00 0.00 0.00 0.00 51.96 49.58 2k4z s ALA 30 Cb -0.15 -3.38 0.00 0.00 0.00 0.00 0.00 23.12 19.60 2k4z s ALA 30 CO -0.03 -2.12 1.29 0.20 0.00 0.00 0.00 175.76 175.10 2k4z s GLY 31 N 3.23 1.36 -0.33 0.00 0.00 0.81 -4.81 107.32 107.58 2k4z s GLY 31 Ca 0.10 0.03 -0.28 0.00 0.00 0.00 0.00 44.72 44.57 2k4z s GLY 31 CO 0.07 2.58 1.03 0.50 0.00 0.00 0.00 173.10 177.28 2k4z s ARG 32 N 4.24 4.02 0.30 2.90 0.52 -1.26 -0.12 118.95 129.55 2k4z s ARG 32 Ca 0.56 0.95 0.02 0.00 -0.52 0.00 0.00 55.73 56.73 2k4z s ARG 32 Cb -0.15 -3.75 -0.03 0.00 0.52 0.00 0.00 34.95 31.53 2k4z s ARG 32 CO 0.24 -0.89 0.48 -0.80 0.02 0.00 0.00 175.30 174.35 2k4z s ASN 33 N 1.69 6.32 -0.91 0.23 0.01 -0.72 -4.98 114.94 116.58 2k4z s ASN 33 Ca 0.43 0.34 -0.26 0.00 -0.71 0.00 0.00 52.86 52.66 2k4z s ASN 33 Cb -0.12 -1.98 -0.21 0.00 0.41 0.00 0.00 41.25 39.34 2k4z s ASN 33 CO 0.16 -0.20 1.96 -2.65 -1.51 0.00 0.00 177.10 174.86 2k4z n PRO 34 N -1.52 0.62 -1.01 -0.60 -0.02 -1.26 -3.79 135.00 127.41 2k4z n PRO 34 Ca -0.06 -1.81 -0.00 0.00 -2.02 0.00 0.00 63.50 59.60 2k4z n PRO 34 Cb 0.56 -3.56 -0.00 0.00 -0.02 0.00 0.00 33.50 30.48 2k4z n PRO 34 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2k4z n ASP 35 N 15.58 -5.34 -0.10 2.55 9.92 -1.26 -4.79 116.55 133.11 2k4z n ASP 35 Ca 0.44 0.01 -0.13 0.00 -0.53 0.00 0.00 54.79 54.58 2k4z n ASP 35 Cb 0.45 -2.87 -0.04 0.00 -0.64 0.00 0.00 41.12 38.02 2k4z n ASP 35 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2k4z n GLY 36 N 0.11 -0.59 3.53 0.44 0.00 -1.25 -5.08 105.19 102.35 2k4z n GLY 36 Ca -0.00 -0.26 -0.10 0.00 0.00 0.00 0.00 46.02 45.66 2k4z n GLY 36 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2k4z s SER 37 N -6.22 -0.02 -0.10 1.61 1.04 -1.26 -5.07 113.70 103.68 2k4z s SER 37 Ca -0.29 -1.02 0.03 0.00 0.48 0.00 0.00 55.95 55.15 2k4z s SER 37 Cb 0.06 0.56 0.01 0.00 0.10 0.00 0.00 66.02 66.75 2k4z s SER 37 CO 0.42 -1.11 -0.18 -0.63 0.98 0.00 0.00 173.24 172.72 2k4z s ILE 38 N -4.00 1.66 -0.49 -1.02 1.01 -1.26 -1.76 121.20 115.34 2k4z s ILE 38 Ca 0.25 -0.77 -0.22 0.00 0.00 0.00 0.00 60.65 59.92 2k4z s ILE 38 Cb 0.00 -1.47 0.04 0.00 0.01 0.00 0.00 42.46 41.04 2k4z s ILE 38 CO 0.10 0.47 0.75 -0.62 0.00 0.00 0.00 174.94 175.64 2k4z s ASP 39 N 0.64 6.32 -0.77 3.58 2.15 0.84 -4.86 116.67 124.55 2k4z s ASP 39 Ca -0.14 -0.46 -0.23 0.00 0.43 0.00 0.00 52.55 52.15 2k4z s ASP 39 Cb -0.16 -2.36 0.06 0.00 -0.30 0.00 0.00 42.92 40.16 2k4z s ASP 39 CO 0.04 -0.97 1.16 -0.31 -0.17 0.00 0.00 175.17 174.92 2k4z s TYR 40 N 3.18 2.59 -0.18 -5.34 2.02 -1.26 -0.13 117.35 118.23 2k4z s TYR 40 Ca 0.24 -0.56 -0.06 0.00 -0.37 0.00 0.00 57.07 56.33 2k4z s TYR 40 Cb -0.15 -4.46 -0.03 0.00 -0.40 0.00 0.00 41.96 36.92 2k4z s TYR 40 CO 0.18 -1.80 0.03 0.50 -1.57 0.00 0.00 175.55 172.88 2k4z s ARG 41 N 4.53 3.84 -0.19 -0.62 3.52 -0.28 -4.99 118.95 124.76 2k4z s ARG 41 Ca 0.31 -0.42 -0.06 0.00 -0.13 0.00 0.00 55.73 55.43 2k4z s ARG 41 Cb -0.10 -3.11 -0.03 0.00 -1.56 0.00 0.00 34.95 30.15 2k4z s ARG 41 CO 0.06 0.23 0.02 1.41 -0.81 0.00 0.00 175.30 176.20 2k4z s MET 42 N 0.46 3.75 -0.23 5.12 -2.45 -1.26 -0.91 119.30 123.78 2k4z s MET 42 Ca 0.01 -0.46 -0.26 0.00 -1.25 0.00 0.00 55.69 53.73 2k4z s MET 42 Cb -0.13 -3.10 0.07 0.00 1.25 0.00 0.00 34.83 32.92 2k4z s MET 42 CO 0.01 0.15 0.74 0.20 1.05 0.00 0.00 175.02 177.17 2k4z s GLY 43 N 0.66 -0.52 -0.00 2.11 0.00 -0.98 -5.03 107.32 103.56 2k4z s GLY 43 Ca 0.01 1.96 -0.30 0.00 0.00 0.00 0.00 44.72 46.38 2k4z s GLY 43 CO 0.02 1.61 1.42 -1.36 0.00 0.00 0.00 173.10 174.79 2k4z s PHE 44 N 0.08 2.80 0.00 1.90 0.08 -1.26 -0.29 117.98 121.28 2k4z s PHE 44 Ca -0.02 0.77 0.00 0.00 0.12 0.00 0.00 56.93 57.80 2k4z s PHE 44 Cb -0.04 -3.69 0.00 0.00 -0.57 0.00 0.00 43.02 38.72 2k4z s PHE 44 CO 0.02 -2.57 0.00 -3.47 -0.10 0.00 0.00 175.22 169.10 2k4z n ASP 45 N 5.47 0.26 -4.79 1.36 -0.08 0.47 -4.86 116.55 114.37 2k4z n ASP 45 Ca 0.13 -0.90 -0.36 0.00 -1.51 0.00 0.00 54.79 52.16 2k4z n ASP 45 Cb 0.43 0.00 -0.04 0.00 2.34 0.00 0.00 41.12 43.85 2k4z n ASP 45 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 2k4z s ASP 46 N -0.81 6.62 -0.20 1.67 2.15 -1.26 -2.91 116.67 121.93 2k4z s ASP 46 Ca 0.00 1.99 -0.15 0.00 0.43 0.00 0.00 52.55 54.82 2k4z s ASP 46 Cb 0.00 -2.58 -0.04 0.00 -0.30 0.00 0.00 42.92 40.00 2k4z s ASP 46 CO 0.00 -0.59 0.36 -0.22 -0.17 0.00 0.00 175.17 174.55 2k4z s LEU 47 N -2.94 4.17 -0.02 -1.34 0.20 -1.26 -4.80 118.68 112.68 2k4z s LEU 47 Ca 0.61 0.48 0.01 0.00 0.69 0.00 0.00 54.13 55.92 2k4z s LEU 47 Cb -0.20 -2.46 0.02 0.00 -0.43 0.00 0.00 46.19 43.12 2k4z s LEU 47 CO 0.25 -0.03 -0.01 -0.89 -0.29 0.00 0.00 176.35 175.37 2k4z s THR 48 N 1.14 0.20 -1.95 3.68 2.01 -1.26 -5.03 115.64 114.43 2k4z s THR 48 Ca 0.18 0.00 0.27 0.00 0.31 0.00 0.00 61.69 62.44 2k4z s THR 48 Cb -0.14 -0.25 0.73 0.00 0.01 0.00 0.00 72.50 72.85 2k4z s THR 48 CO 0.07 0.12 1.93 -0.62 -0.69 0.00 0.00 174.62 175.43 2k4z n GLU 49 N 3.71 0.79 0.21 4.92 1.02 -1.26 -2.14 120.64 127.89 2k4z n GLU 49 Ca -0.22 0.00 0.12 0.00 -0.02 0.00 0.00 57.16 57.05 2k4z n GLU 49 Cb 0.53 -1.50 0.16 0.00 -0.02 0.00 0.00 31.44 30.61 2k4z n GLU 49 CO 0.00 0.00 0.00 -0.44 1.18 0.00 0.00 177.13 177.87 2k4z h ASP 50 N 0.00 0.00 -3.91 1.62 5.19 -2.00 -3.45 116.42 113.87 2k4z h ASP 50 Ca 0.00 0.00 -0.47 0.00 -0.62 0.00 0.00 57.03 55.94 2k4z h ASP 50 Cb 0.02 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.52 2k4z h ASP 50 CO 0.00 0.00 0.23 -1.81 -3.12 0.00 0.00 179.24 174.54 2k4z s ASP 51 N -6.14 6.77 -0.22 6.45 1.11 -0.91 -4.79 116.67 118.95 2k4z s ASP 51 Ca 0.06 1.44 -0.29 0.00 0.18 0.00 0.00 52.55 53.95 2k4z s ASP 51 Cb 0.05 -2.44 -0.02 0.00 1.07 0.00 0.00 42.92 41.58 2k4z s ASP 51 CO 0.68 -0.34 1.40 -0.63 1.18 0.00 0.00 175.17 177.46 2k4z s ILE 52 N -2.20 4.01 -0.28 0.77 1.01 -0.00 -4.80 121.20 119.71 2k4z s ILE 52 Ca 0.57 1.18 -0.11 0.00 0.00 0.00 0.00 60.65 62.29 2k4z s ILE 52 Cb -0.10 -3.93 -0.05 0.00 0.01 0.00 0.00 42.46 38.40 2k4z s ILE 52 CO 0.20 -0.29 0.18 -0.60 0.00 0.00 0.00 174.94 174.42 2k4z s ARG 53 N 4.09 3.92 -0.11 2.79 3.52 -1.26 -0.73 118.95 131.17 2k4z s ARG 53 Ca 0.61 -0.34 0.01 0.00 -0.13 0.00 0.00 55.73 55.88 2k4z s ARG 53 Cb -0.22 -3.62 -0.02 0.00 -1.56 0.00 0.00 34.95 29.54 2k4z s ARG 53 CO 0.23 -0.18 -0.13 -0.51 -0.81 0.00 0.00 175.30 173.90 2k4z s LEU 54 N 1.74 2.73 -0.32 -0.88 1.43 0.14 -4.96 118.68 118.55 2k4z s LEU 54 Ca 0.07 -0.29 -0.05 0.00 -1.03 0.00 0.00 54.13 52.83 2k4z s LEU 54 Cb -0.16 -1.60 0.04 0.00 0.03 0.00 0.00 46.19 44.50 2k4z s LEU 54 CO 0.10 0.21 0.07 -0.89 0.23 0.00 0.00 176.35 176.07 2k4z s THR 55 N 0.07 3.59 -0.46 5.49 2.01 -1.26 0.50 115.64 125.57 2k4z s THR 55 Ca -0.05 -1.10 -0.06 0.00 0.31 0.00 0.00 61.69 60.79 2k4z s THR 55 Cb -0.15 -2.99 0.12 0.00 0.01 0.00 0.00 72.50 69.49 2k4z s THR 55 CO 0.04 -0.09 0.29 -0.55 -0.69 0.00 0.00 174.62 173.62 2k4z s SER 56 N 1.38 5.48 0.00 3.53 0.15 -0.72 -4.81 113.70 118.71 2k4z s SER 56 Ca -0.02 -2.05 0.00 0.00 0.70 0.00 0.00 55.95 54.59 2k4z s SER 56 Cb -0.19 -1.92 0.00 0.00 -1.71 0.00 0.00 66.02 62.20 2k4z s SER 56 CO 0.01 -0.60 0.00 1.21 1.20 0.00 0.00 173.24 175.06 2k4z n GLU 57 N 4.65 0.00 0.00 5.44 2.13 -1.26 -2.24 120.64 129.36 2k4z n GLU 57 Ca -0.04 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.78 2k4z n GLU 57 Cb 0.41 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.12 2k4z n GLU 57 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2k4z n GLY 58 N 0.00 0.04 3.69 8.31 0.00 -1.26 -5.10 105.19 110.87 2k4z n GLY 58 Ca 0.00 -0.02 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 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 -0.86 4.04 -0.26 1.61 1.01 -0.95 -5.00 120.40 120.00 2k4z s VAL 59 Ca 0.00 1.41 -0.15 0.00 0.00 0.00 0.00 61.98 63.24 2k4z s VAL 59 Cb 0.00 -3.91 -0.04 0.00 0.00 0.00 0.00 36.38 32.44 2k4z s VAL 59 CO 0.00 0.03 0.38 -0.70 0.00 0.00 0.00 175.10 174.81 2k4z s GLU 60 N 1.96 4.05 -0.18 2.72 2.12 -1.26 -1.76 118.70 126.35 2k4z s GLU 60 Ca 0.59 0.08 -0.07 0.00 0.36 0.00 0.00 54.97 55.93 2k4z s GLU 60 Cb -0.28 -3.63 -0.04 0.00 0.26 0.00 0.00 34.13 30.44 2k4z s GLU 60 CO 0.25 -0.24 0.04 0.42 -0.54 0.00 0.00 175.26 175.20 2k4z s ILE 61 N 1.94 4.64 -0.25 -3.70 -1.09 0.18 -1.91 121.20 121.01 2k4z s ILE 61 Ca 0.16 -0.09 0.00 0.00 -2.23 0.00 0.00 60.65 58.49 2k4z s ILE 61 Cb -0.16 -3.08 0.04 0.00 -1.58 0.00 0.00 42.46 37.69 2k4z s ILE 61 CO 0.09 0.47 -0.08 0.68 -1.23 0.00 0.00 174.94 174.87 2k4z s VAL 62 N 0.33 2.54 -0.19 2.92 -7.23 0.64 0.26 120.40 119.67 2k4z s VAL 62 Ca 0.02 -1.30 0.00 0.00 -1.81 0.00 0.00 61.98 58.90 2k4z s VAL 62 Cb -0.13 -2.37 0.02 0.00 0.56 0.00 0.00 36.38 34.46 2k4z s VAL 62 CO 0.01 0.11 -0.17 -0.63 -0.31 0.00 0.00 175.10 174.11 2k4z s ILE 63 N 1.23 2.31 0.39 -0.62 1.01 0.10 -3.24 121.20 122.38 2k4z s ILE 63 Ca -0.03 -0.89 -0.27 0.00 0.00 0.00 0.00 60.65 59.46 2k4z s ILE 63 Cb -0.18 -2.01 -0.09 0.00 0.01 0.00 0.00 42.46 40.19 2k4z s ILE 63 CO -0.05 0.49 1.30 0.00 0.00 0.00 0.00 174.94 176.67 2k4z s ALA 64 N 1.32 3.31 0.43 9.38 0.00 -1.26 -0.82 121.76 134.10 2k4z s ALA 64 Ca 0.05 1.22 0.25 0.00 0.00 0.00 0.00 51.96 53.48 2k4z s ALA 64 Cb -0.14 -3.48 1.29 0.00 0.00 0.00 0.00 23.12 20.79 2k4z s ALA 64 CO -0.11 -0.77 1.70 -1.35 0.00 0.00 0.00 175.76 175.24 2k4z h PRO 65 N 2.83 0.22 -0.82 0.00 0.11 -1.96 0.11 132.00 132.48 2k4z h PRO 65 Ca -0.49 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 65.57 2k4z h PRO 65 Cb 1.24 -0.05 -0.04 0.00 0.11 0.00 0.00 31.00 32.27 2k4z h PRO 65 CO 0.63 0.14 0.36 0.22 -0.21 0.00 0.00 178.00 179.15 2k4z h ASP 66 N 0.22 1.10 0.97 -2.05 3.58 -2.01 -2.99 116.42 115.24 2k4z h ASP 66 Ca 0.70 -0.15 0.00 0.00 0.42 0.00 0.00 57.03 58.00 2k4z h ASP 66 Cb 2.07 -0.28 0.00 0.00 1.72 0.00 0.00 39.33 42.83 2k4z h ASP 66 CO -0.33 0.95 -0.79 1.88 -2.88 0.00 0.00 179.24 178.07 2k4z h TYR 67 N 1.18 0.00 -0.89 0.28 0.05 -1.16 -3.35 116.97 113.07 2k4z h TYR 67 Ca 0.28 0.00 0.10 0.00 0.05 0.00 0.00 58.73 59.15 2k4z h TYR 67 Cb 0.16 0.00 -0.07 0.00 1.01 0.00 0.00 36.73 37.83 2k4z h TYR 67 CO 0.02 0.00 0.54 0.28 -1.05 0.00 0.00 178.16 177.95 2k4z h VAL 68 N 0.00 0.94 0.00 -2.88 2.07 -1.22 -0.96 116.25 114.21 2k4z h VAL 68 Ca 0.00 -0.31 0.00 0.00 0.82 0.00 0.00 66.70 67.21 2k4z h VAL 68 Cb 0.88 -0.04 0.00 0.00 -1.52 0.00 0.00 31.29 30.61 2k4z h VAL 68 CO 0.00 0.16 0.00 -0.24 0.02 0.00 0.00 177.57 177.51 2k4z n SER 69 N -4.67 0.64 -0.10 0.57 2.88 -1.25 -1.84 113.62 109.84 2k4z n SER 69 Ca 0.15 0.68 0.06 0.00 -1.33 0.00 0.00 58.87 58.44 2k4z n SER 69 Cb 0.28 -0.81 -0.05 0.00 -0.75 0.00 0.00 64.21 62.88 2k4z n SER 69 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2k4z n LEU 70 N -2.24 0.89 0.00 2.46 4.77 -0.41 -4.53 117.00 117.94 2k4z n LEU 70 Ca 0.01 -0.59 0.00 0.00 -0.03 0.00 0.00 56.01 55.40 2k4z n LEU 70 Cb 0.19 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.28 2k4z n LEU 70 CO 0.18 0.20 0.44 0.18 -1.33 0.00 0.00 177.39 177.05 2k4z n LEU 71 N -0.92 1.62 -4.73 2.23 4.77 -0.83 -5.00 117.00 114.14 2k4z n LEU 71 Ca 0.03 -1.62 -0.41 0.00 -0.03 0.00 0.00 56.01 53.98 2k4z n LEU 71 Cb 0.23 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.28 2k4z n LEU 71 CO 0.23 0.41 0.75 -0.62 -1.33 0.00 0.00 177.39 176.82 2k4z s ASP 72 N -0.76 7.35 -1.32 -1.43 2.15 -0.76 -3.34 116.67 118.56 2k4z s ASP 72 Ca 0.00 1.97 0.00 0.00 0.43 0.00 0.00 52.55 54.95 2k4z s ASP 72 Cb 0.00 -2.60 0.00 0.00 -0.30 0.00 0.00 42.92 40.02 2k4z s ASP 72 CO 0.00 -0.17 0.00 1.67 -0.17 0.00 0.00 175.17 176.50 2k4z n GLN 73 N 2.62 -0.94 -3.16 4.34 7.27 -1.11 -4.82 117.38 121.57 2k4z n GLN 73 Ca 0.03 0.88 -0.38 0.00 0.07 0.00 0.00 57.00 57.60 2k4z n GLN 73 Cb 0.47 -4.97 -0.06 0.00 2.41 0.00 0.00 30.24 28.09 2k4z n GLN 73 CO 0.00 0.00 0.00 0.95 0.07 0.00 0.00 177.06 178.08 2k4z s THR 74 N -2.53 4.61 -0.25 1.69 -4.23 -1.18 -4.59 115.64 109.16 2k4z s THR 74 Ca 0.00 1.32 -0.09 0.00 -1.18 0.00 0.00 61.69 61.75 2k4z s THR 74 Cb 0.00 -3.94 -0.04 0.00 1.34 0.00 0.00 72.50 69.87 2k4z s THR 74 CO 0.00 0.43 0.11 -0.89 -0.54 0.00 0.00 174.62 173.73 2k4z s THR 75 N -1.26 4.69 -0.31 3.99 2.01 -0.68 -1.08 115.64 123.00 2k4z s THR 75 Ca 0.35 -0.05 -0.10 0.00 0.31 0.00 0.00 61.69 62.21 2k4z s THR 75 Cb -0.19 -3.20 -0.01 0.00 0.01 0.00 0.00 72.50 69.10 2k4z s THR 75 CO 0.21 0.32 0.15 -0.22 -0.69 0.00 0.00 174.62 174.40 2k4z s LEU 76 N 1.56 4.09 0.20 4.42 2.96 0.13 0.23 118.68 132.26 2k4z s LEU 76 Ca 0.06 -0.47 0.00 0.00 -0.22 0.00 0.00 54.13 53.51 2k4z s LEU 76 Cb -0.15 -2.01 -0.04 0.00 0.50 0.00 0.00 46.19 44.48 2k4z s LEU 76 CO 0.06 -0.18 0.09 -0.62 -1.32 0.00 0.00 176.35 174.38 2k4z s ASP 77 N 1.63 0.63 -0.11 3.68 2.15 -1.04 -1.66 116.67 121.94 2k4z s ASP 77 Ca 0.05 -1.32 0.01 0.00 0.43 0.00 0.00 52.55 51.72 2k4z s ASP 77 Cb -0.17 0.26 -0.01 0.00 -0.30 0.00 0.00 42.92 42.70 2k4z s ASP 77 CO 0.07 -0.75 -0.15 -0.72 -0.17 0.00 0.00 175.17 173.45 2k4z s TYR 78 N -3.95 2.75 0.01 -5.34 1.13 -1.26 -0.01 117.35 110.68 2k4z s TYR 78 Ca 0.34 -0.63 0.02 0.00 -1.41 0.00 0.00 57.07 55.39 2k4z s TYR 78 Cb 0.07 -1.79 -0.01 0.00 -1.10 0.00 0.00 41.96 39.13 2k4z s TYR 78 CO 0.09 -0.18 -0.07 0.14 -2.51 0.00 0.00 175.55 173.02 2k4z s VAL 79 N 0.17 0.52 -1.22 -3.49 -7.23 -0.11 -4.92 120.40 104.11 2k4z s VAL 79 Ca -0.09 -0.58 -0.12 0.00 -1.81 0.00 0.00 61.98 59.38 2k4z s VAL 79 Cb -0.15 -0.49 0.18 0.00 0.56 0.00 0.00 36.38 36.47 2k4z s VAL 79 CO 0.05 -0.06 1.53 1.21 -0.31 0.00 0.00 175.10 177.52 2k4z n GLU 80 N 2.35 3.46 0.01 4.82 2.13 -1.26 0.35 120.64 132.51 2k4z n GLU 80 Ca -0.17 -3.81 -0.13 0.00 0.66 0.00 0.00 57.16 53.71 2k4z n GLU 80 Cb 0.57 -2.98 -0.09 0.00 0.27 0.00 0.00 31.44 29.21 2k4z n GLU 80 CO 0.00 0.00 0.00 -0.07 -0.41 0.00 0.00 177.13 176.65 2k4z h LEU 81 N 9.04 -0.00 -9.31 4.31 3.38 -1.91 -3.42 115.31 117.40 2k4z h LEU 81 Ca 0.33 -0.30 -0.57 0.00 0.09 0.00 0.00 57.88 57.42 2k4z h LEU 81 Cb 0.81 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.48 2k4z h LEU 81 CO 1.33 0.30 -0.07 -1.61 0.09 0.00 0.00 178.44 178.48 2k4z s GLU 82 N -4.99 4.34 -0.31 1.13 0.41 -1.23 -4.99 118.70 113.06 2k4z s GLU 82 Ca -0.15 0.55 -0.34 0.00 -0.41 0.00 0.00 54.97 54.62 2k4z s GLU 82 Cb 0.03 -3.46 -0.11 0.00 -1.78 0.00 0.00 34.13 28.82 2k4z s GLU 82 CO 0.67 0.09 2.15 -2.30 -0.49 0.00 0.00 175.26 175.38 2k4z n PRO 83 N 3.86 1.29 0.00 0.39 -0.02 -1.26 -0.23 135.00 139.03 2k4z n PRO 83 Ca -0.05 0.37 0.00 0.00 -2.02 0.00 0.00 63.50 61.80 2k4z n PRO 83 Cb 0.51 -2.57 0.00 0.00 -0.02 0.00 0.00 33.50 31.42 2k4z n PRO 83 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2k4z n GLY 84 N 6.16 1.47 3.04 -1.23 0.00 -1.26 -5.02 105.19 108.36 2k4z n GLY 84 Ca 0.37 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 46.08 2k4z n GLY 84 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2k4z s GLN 85 N -0.84 1.96 0.10 1.61 2.00 0.68 -5.09 119.66 120.09 2k4z s GLN 85 Ca 0.00 -1.46 -0.30 0.00 -2.00 0.00 0.00 55.36 51.59 2k4z s GLN 85 Cb 0.00 -2.94 -0.06 0.00 0.80 0.00 0.00 33.01 30.80 2k4z s GLN 85 CO 0.00 -0.68 1.18 -0.06 -0.50 0.00 0.00 175.29 175.23 2k4z s PHE 86 N 1.08 3.47 -0.16 1.67 0.08 -1.26 -3.55 117.98 119.30 2k4z s PHE 86 Ca -0.03 1.38 -0.02 0.00 0.12 0.00 0.00 56.93 58.38 2k4z s PHE 86 Cb -0.20 -3.39 -0.02 0.00 -0.57 0.00 0.00 43.02 38.84 2k4z s PHE 86 CO -0.06 -1.12 -0.07 -1.01 -0.10 0.00 0.00 175.22 172.85 2k4z s HIS 87 N 0.62 2.93 -0.30 0.36 3.76 0.16 -4.91 115.29 117.91 2k4z s HIS 87 Ca 0.56 -0.52 -0.29 0.00 -0.15 0.00 0.00 55.06 54.66 2k4z s HIS 87 Cb -0.30 -1.94 0.01 0.00 1.11 0.00 0.00 32.58 31.46 2k4z s HIS 87 CO 0.32 -0.18 1.16 -0.06 -0.85 0.00 0.00 174.74 175.13 2k4z s PHE 88 N 0.53 2.98 -0.22 1.40 0.08 -1.26 -0.93 117.98 120.55 2k4z s PHE 88 Ca -0.05 1.08 -0.06 0.00 0.12 0.00 0.00 56.93 58.02 2k4z s PHE 88 Cb -0.15 -3.73 -0.02 0.00 -0.57 0.00 0.00 43.02 38.55 2k4z s PHE 88 CO 0.03 -1.15 0.02 0.96 -0.10 0.00 0.00 175.22 174.98 2k4z s ILE 89 N 3.85 4.00 -0.63 0.64 -4.36 0.98 -4.95 121.20 120.74 2k4z s ILE 89 Ca 0.50 -0.29 -0.24 0.00 -0.26 0.00 0.00 60.65 60.36 2k4z s ILE 89 Cb -0.15 -2.83 0.05 0.00 1.25 0.00 0.00 42.46 40.78 2k4z s ILE 89 CO 0.17 0.40 1.00 -0.36 0.24 0.00 0.00 174.94 176.39 2k4z s PHE 90 N 1.27 2.66 -1.09 1.37 0.40 -1.26 -2.50 117.98 118.83 2k4z s PHE 90 Ca 0.04 -0.27 -0.22 0.00 -0.60 0.00 0.00 56.93 55.88 2k4z s PHE 90 Cb -0.15 -4.26 -0.01 0.00 0.51 0.00 0.00 43.02 39.12 2k4z s PHE 90 CO 0.02 -1.60 1.78 -0.51 0.70 0.00 0.00 175.22 175.61 2k4z s LEU 91 N 4.26 3.36 -0.20 -0.37 1.43 0.14 -4.85 118.68 122.45 2k4z s LEU 91 Ca 0.27 -1.49 -0.18 0.00 -1.03 0.00 0.00 54.13 51.70 2k4z s LEU 91 Cb -0.14 -2.57 -0.03 0.00 0.03 0.00 0.00 46.19 43.47 2k4z s LEU 91 CO 0.14 -2.21 0.48 0.21 0.23 0.00 0.00 176.35 175.21 2k4z s ASN 92 N 6.10 6.53 0.61 2.29 2.47 -1.26 -1.68 114.94 130.00 2k4z s ASN 92 Ca 0.60 0.63 0.30 0.00 0.42 0.00 0.00 52.86 54.82 2k4z s ASN 92 Cb -0.01 -2.28 1.68 0.00 -1.45 0.00 0.00 41.25 39.19 2k4z s ASN 92 CO 0.02 -0.15 2.04 -0.65 -3.72 0.00 0.00 177.10 174.65 2k4z h PRO 93 N 7.42 0.00 -0.49 0.43 0.11 -1.83 0.75 132.00 138.38 2k4z h PRO 93 Ca -0.35 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.76 2k4z h PRO 93 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2k4z h PRO 93 CO 0.73 0.00 0.00 0.54 -0.21 0.00 0.00 178.00 179.06 2k4z n ARG 94 N -3.52 2.54 -2.85 1.05 1.74 -1.26 -4.81 116.66 109.55 2k4z n ARG 94 Ca 0.02 -2.36 -0.37 0.00 -0.77 0.00 0.00 57.85 54.37 2k4z n ARG 94 Cb 0.39 -1.50 -0.06 0.00 -1.02 0.00 0.00 32.46 30.27 2k4z n ARG 94 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 2k4z s ASP 95 N -1.25 7.29 0.60 0.55 -1.08 0.25 -4.95 116.67 118.08 2k4z s ASP 95 Ca 0.40 1.75 0.36 0.00 -0.52 0.00 0.00 52.55 54.54 2k4z s ASP 95 Cb 0.22 -2.55 1.95 0.00 -1.46 0.00 0.00 42.92 41.09 2k4z s ASP 95 CO 0.30 -0.04 2.24 -0.65 0.52 0.00 0.00 175.17 177.54 2k4z h PRO 96 N 3.26 0.00 -4.93 4.34 0.11 -1.93 -3.41 132.00 129.44 2k4z h PRO 96 Ca -0.47 0.00 -0.67 0.00 0.11 0.00 0.00 66.00 64.97 2k4z h PRO 96 Cb 1.19 0.00 -0.32 0.00 0.11 0.00 0.00 31.00 31.99 2k4z h PRO 96 CO 0.65 0.03 -0.75 0.95 -0.21 0.00 0.00 178.00 178.66 2k4z s THR 97 N -4.23 2.87 0.09 -1.15 -4.23 -1.26 -4.94 115.64 102.77 2k4z s THR 97 Ca -0.04 -0.95 0.00 0.00 -1.18 0.00 0.00 61.69 59.52 2k4z s THR 97 Cb 0.13 -2.42 0.00 0.00 1.34 0.00 0.00 72.50 71.55 2k4z s THR 97 CO 0.50 0.25 0.00 0.00 -0.54 0.00 0.00 174.62 174.83 2k4z n TYR 98 N 4.68 -2.05 -4.05 3.99 9.36 -1.26 -4.78 117.16 123.05 2k4z n TYR 98 Ca -0.17 1.24 -0.19 0.00 3.32 0.00 0.00 57.90 62.10 2k4z n TYR 98 Cb 0.48 -2.70 -0.16 0.00 -0.63 0.00 0.00 39.34 36.32 2k4z n TYR 98 CO 0.00 0.00 0.00 1.03 0.22 0.00 0.00 176.86 178.11 2k4z s ARG 99 N -2.03 0.60 0.60 2.98 0.52 -1.26 -4.59 118.95 115.77 2k4z s ARG 99 Ca 0.00 -0.02 -0.18 0.00 -0.52 0.00 0.00 55.73 55.01 2k4z s ARG 99 Cb 0.00 -0.70 -0.08 0.00 0.52 0.00 0.00 34.95 34.69 2k4z s ARG 99 CO 0.00 -0.11 0.47 -2.30 0.02 0.00 0.00 175.30 173.37 2k4z n PRO 100 N 4.15 0.43 -1.57 3.54 -0.02 -1.26 -4.80 135.00 135.47 2k4z n PRO 100 Ca -0.24 0.17 -0.53 0.00 -2.02 0.00 0.00 63.50 60.88 2k4z n PRO 100 Cb 0.51 -1.68 -0.06 0.00 -0.02 0.00 0.00 33.50 32.25 2k4z n PRO 100 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2k4z n PRO 101 N -0.06 0.90 0.08 0.52 -0.02 -1.26 -4.88 135.00 130.29 2k4z n PRO 101 Ca 0.11 0.32 -0.06 0.00 -2.02 0.00 0.00 63.50 61.85 2k4z n PRO 101 Cb 0.48 -1.91 0.07 0.00 -0.02 0.00 0.00 33.50 32.12 2k4z n PRO 101 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2k4z h SER 102 N 4.02 0.26 -1.66 2.55 4.64 -2.06 -3.35 113.55 117.95 2k4z h SER 102 Ca -0.47 -0.17 -0.76 0.00 -0.47 0.00 0.00 61.79 59.91 2k4z h SER 102 Cb 1.36 -0.08 -0.17 0.00 -0.31 0.00 0.00 62.40 63.20 2k4z h SER 102 CO 0.74 0.88 1.80 0.61 -0.87 0.00 0.00 176.83 179.99 2k4z n GLY 103 N 0.50 4.78 0.29 -0.77 0.00 -1.26 -5.32 105.19 103.40 2k4z n GLY 103 Ca -0.03 -2.19 0.04 0.00 0.00 0.00 0.00 46.02 43.84 2k4z n GLY 103 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93