#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x4k s SER 2 N 0.00 2.34 0.26 1.61 1.04 -1.26 -5.02 113.70 112.67 1x4k s SER 2 Ca 0.00 -0.43 0.08 0.00 0.48 0.00 0.00 55.95 56.08 1x4k s SER 2 Cb 0.00 -0.22 0.80 0.00 0.10 0.00 0.00 66.02 66.70 1x4k s SER 2 CO 0.00 0.19 1.22 -1.20 0.98 0.00 0.00 173.24 174.43 1x4k n SER 3 N 2.23 0.08 -0.32 7.02 7.64 -1.26 0.16 113.62 129.17 1x4k n SER 3 Ca -0.16 1.30 0.05 0.00 1.01 0.00 0.00 58.87 61.07 1x4k n SER 3 Cb 0.53 -0.55 0.12 0.00 -1.01 0.00 0.00 64.21 63.30 1x4k n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x4k n GLY 4 N -1.30 -1.52 3.56 0.23 0.00 -1.26 -3.69 105.19 101.20 1x4k n GLY 4 Ca 0.23 0.96 -0.42 0.00 0.00 0.00 0.00 46.02 46.79 1x4k n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1x4k s SER 5 N -5.24 6.39 -0.25 1.61 0.15 0.12 -4.98 113.70 111.51 1x4k s SER 5 Ca -0.13 -0.06 -0.29 0.00 0.70 0.00 0.00 55.95 56.17 1x4k s SER 5 Cb 0.24 -2.53 -0.02 0.00 -1.71 0.00 0.00 66.02 62.00 1x4k s SER 5 CO 0.69 -1.47 1.48 -0.44 1.20 0.00 0.00 173.24 174.70 1x4k s SER 6 N 3.03 6.52 -0.01 5.45 0.01 -1.24 -4.80 113.70 122.66 1x4k s SER 6 Ca 0.39 1.48 0.04 0.00 1.31 0.00 0.00 55.95 59.17 1x4k s SER 6 Cb -0.09 -2.54 -0.03 0.00 0.21 0.00 0.00 66.02 63.58 1x4k s SER 6 CO 0.23 -1.16 -0.12 -0.83 0.41 0.00 0.00 173.24 171.76 1x4k s GLY 7 N 3.57 1.63 0.87 3.44 0.00 -1.26 -2.74 107.32 112.83 1x4k s GLY 7 Ca 0.65 -1.05 -0.11 0.00 0.00 0.00 0.00 44.72 44.21 1x4k s GLY 7 CO 0.26 -0.89 1.09 0.00 0.00 0.00 0.00 173.10 173.57 1x4k n GLN 9 N -3.87 2.03 0.23 0.00 1.13 -0.32 -3.56 117.38 113.03 1x4k n GLN 9 Ca 0.08 -0.02 -0.10 0.00 -1.94 0.00 0.00 57.00 55.02 1x4k n GLN 9 Cb 0.54 -1.26 -0.05 0.00 0.11 0.00 0.00 30.24 29.59 1x4k n GLN 9 CO 0.00 0.00 0.00 1.49 -1.44 0.00 0.00 177.06 177.11 1x4k h GLU 10 N 0.00 -0.60 -0.65 -1.09 4.57 -1.93 -3.32 114.58 111.56 1x4k h GLU 10 Ca -0.23 0.04 0.00 0.00 -1.18 0.00 0.00 59.36 57.99 1x4k h GLU 10 Cb 1.45 0.14 0.00 0.00 -0.16 0.00 0.00 28.75 30.18 1x4k h GLU 10 CO 0.01 -0.40 0.00 0.00 -1.18 0.00 0.00 179.01 177.44 1x4k n LYS 12 N 1.32 -1.27 -4.25 0.00 4.01 -1.23 -4.92 118.16 111.81 1x4k n LYS 12 Ca 0.23 0.16 -0.23 0.00 -0.51 0.00 0.00 58.31 57.96 1x4k n LYS 12 Cb 0.65 -4.15 -0.07 0.00 -0.51 0.00 0.00 35.03 30.95 1x4k n LYS 12 CO 0.00 0.00 0.00 0.15 -1.11 0.00 0.00 177.40 176.44 1x4k s LYS 13 N -7.23 2.44 -0.49 1.97 1.02 -1.26 -4.82 119.74 111.38 1x4k s LYS 13 Ca 0.32 -1.34 -0.28 0.00 0.02 0.00 0.00 55.97 54.69 1x4k s LYS 13 Cb -0.18 -2.25 0.01 0.00 -0.52 0.00 0.00 37.83 34.88 1x4k s LYS 13 CO 0.99 0.37 1.42 0.99 -0.92 0.00 0.00 175.35 178.21 1x4k s THR 14 N -2.28 3.84 -0.55 2.17 2.01 -1.26 -0.17 115.64 119.39 1x4k s THR 14 Ca 0.32 0.79 -0.28 0.00 0.31 0.00 0.00 61.69 62.83 1x4k s THR 14 Cb -0.07 -4.31 0.01 0.00 0.01 0.00 0.00 72.50 68.14 1x4k s THR 14 CO 0.21 -0.95 1.52 -0.63 -0.69 0.00 0.00 174.62 174.08 1x4k s ILE 15 N 5.83 3.69 0.55 1.82 1.01 -1.11 -4.94 121.20 128.04 1x4k s ILE 15 Ca 0.57 0.58 -0.20 0.00 0.00 0.00 0.00 60.65 61.60 1x4k s ILE 15 Cb -0.12 -4.29 -0.07 0.00 0.01 0.00 0.00 42.46 37.99 1x4k s ILE 15 CO 0.29 -1.06 0.95 0.23 0.00 0.00 0.00 174.94 175.34 1x4k n MET 16 N 8.73 1.02 0.00 2.79 2.81 -1.26 -4.79 117.12 126.42 1x4k n MET 16 Ca 0.14 0.38 0.07 0.00 -1.81 0.00 0.00 57.70 56.49 1x4k n MET 16 Cb 0.49 -2.10 0.39 0.00 -0.71 0.00 0.00 33.22 31.29 1x4k n MET 16 CO 0.00 0.00 0.00 -0.35 1.51 0.00 0.00 175.97 177.13 1x4k n PRO 17 N -0.58 0.26 0.09 0.03 -0.04 -1.26 -2.88 135.00 130.62 1x4k n PRO 17 Ca 0.12 0.12 -0.24 0.00 -0.04 0.00 0.00 63.50 63.47 1x4k n PRO 17 Cb 0.45 -1.50 -0.15 0.00 -0.04 0.00 0.00 33.50 32.26 1x4k n PRO 17 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 1x4k h GLY 18 N 2.44 0.50 -2.19 0.55 0.00 -2.02 -3.47 103.07 98.89 1x4k h GLY 18 Ca 0.00 -1.28 -0.49 0.00 0.00 0.00 0.00 47.33 45.56 1x4k h GLY 18 CO 0.00 1.12 0.18 -1.08 0.00 0.00 0.00 176.54 176.76 1x4k s THR 19 N -2.58 4.77 -0.25 4.70 -1.32 -1.14 -5.04 115.64 114.78 1x4k s THR 19 Ca -0.14 0.64 -0.21 0.00 -1.21 0.00 0.00 61.69 60.78 1x4k s THR 19 Cb 0.05 -3.77 -0.02 0.00 -1.51 0.00 0.00 72.50 67.25 1x4k s THR 19 CO 0.88 -0.66 0.64 -0.13 -2.21 0.00 0.00 174.62 173.14 1x4k s ARG 20 N -4.16 4.12 0.40 7.08 1.81 -1.26 -4.87 118.95 122.06 1x4k s ARG 20 Ca 0.52 0.58 0.08 0.00 -1.72 0.00 0.00 55.73 55.18 1x4k s ARG 20 Cb -0.10 -3.65 -0.02 0.00 -0.45 0.00 0.00 34.95 30.73 1x4k s ARG 20 CO 0.36 -0.41 0.39 -1.59 -0.68 0.00 0.00 175.30 173.36 1x4k s LYS 21 N 2.51 2.63 -0.37 3.54 -2.85 -1.26 -3.44 119.74 120.50 1x4k s LYS 21 Ca 0.27 -1.43 -0.04 0.00 -1.00 0.00 0.00 55.97 53.77 1x4k s LYS 21 Cb -0.15 -2.46 0.08 0.00 -2.06 0.00 0.00 37.83 33.23 1x4k s LYS 21 CO 0.08 -0.13 0.13 -1.64 0.10 0.00 0.00 175.35 173.90 1x4k s MET 22 N -4.13 2.27 -0.37 1.78 -1.94 -0.45 -4.92 119.30 111.54 1x4k s MET 22 Ca 0.47 -1.53 -0.22 0.00 -1.71 0.00 0.00 55.69 52.70 1x4k s MET 22 Cb -0.05 -3.46 0.01 0.00 2.01 0.00 0.00 34.83 33.34 1x4k s MET 22 CO 0.28 -0.87 0.75 -1.21 -0.01 0.00 0.00 175.02 173.96 1x4k s GLU 23 N 1.24 3.70 -0.04 2.03 2.02 -1.26 -1.29 118.70 125.10 1x4k s GLU 23 Ca 0.02 0.21 -0.01 0.00 0.02 0.00 0.00 54.97 55.21 1x4k s GLU 23 Cb -0.21 -3.82 0.03 0.00 0.10 0.00 0.00 34.13 30.22 1x4k s GLU 23 CO -0.02 -0.85 0.02 -0.47 0.02 0.00 0.00 175.26 173.97 1x4k s TYR 24 N 3.02 0.27 -1.62 1.61 6.14 0.11 -4.82 117.35 122.06 1x4k s TYR 24 Ca 0.29 0.07 -0.03 0.00 0.64 0.00 0.00 57.07 58.04 1x4k s TYR 24 Cb -0.13 -0.49 0.01 0.00 0.42 0.00 0.00 41.96 41.76 1x4k s TYR 24 CO 0.17 -0.18 0.33 1.63 0.64 0.00 0.00 175.55 178.13 1x4k n LYS 25 N 4.73 -3.41 0.00 4.97 5.02 -1.26 -1.83 118.16 126.38 1x4k n LYS 25 Ca -0.15 0.92 0.00 0.00 -2.02 0.00 0.00 58.31 57.06 1x4k n LYS 25 Cb 0.50 -5.68 0.00 0.00 -0.02 0.00 0.00 35.03 29.83 1x4k n LYS 25 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1x4k n GLY 26 N -1.27 2.25 3.84 0.72 0.00 -1.26 -5.01 105.19 104.46 1x4k n GLY 26 Ca -0.17 -0.40 -0.31 0.00 0.00 0.00 0.00 46.02 45.15 1x4k n GLY 26 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1x4k s SER 27 N 0.09 5.30 0.15 1.61 0.01 -0.76 -5.02 113.70 115.08 1x4k s SER 27 Ca 0.00 1.40 0.08 0.00 1.31 0.00 0.00 55.95 58.74 1x4k s SER 27 Cb 0.00 -2.26 -0.04 0.00 0.21 0.00 0.00 66.02 63.93 1x4k s SER 27 CO 0.00 -1.46 -0.17 -0.94 0.41 0.00 0.00 173.24 171.08 1x4k s SER 28 N -4.00 2.48 -0.06 2.44 1.04 -1.26 0.07 113.70 114.42 1x4k s SER 28 Ca 0.58 -0.86 -0.02 0.00 0.48 0.00 0.00 55.95 56.13 1x4k s SER 28 Cb -0.13 -0.13 0.04 0.00 0.10 0.00 0.00 66.02 65.90 1x4k s SER 28 CO 0.54 -0.07 0.11 0.26 0.98 0.00 0.00 173.24 175.05 1x4k s TRP 29 N -2.13 -0.07 0.79 5.02 0.51 -0.41 -1.18 118.94 121.47 1x4k s TRP 29 Ca 0.14 0.41 -0.16 0.00 -2.12 0.00 0.00 56.10 54.37 1x4k s TRP 29 Cb -0.05 -0.31 -0.08 0.00 -0.81 0.00 0.00 33.47 32.22 1x4k s TRP 29 CO 0.06 -0.20 -0.00 0.72 -0.51 0.00 0.00 176.95 177.01 1x4k n HIS 30 N 5.00 -2.58 0.22 -1.98 8.25 -1.26 -1.34 115.22 121.53 1x4k n HIS 30 Ca -0.10 0.25 0.12 0.00 -0.26 0.00 0.00 57.72 57.72 1x4k n HIS 30 Cb 0.50 -1.71 0.60 0.00 1.12 0.00 0.00 29.99 30.50 1x4k n HIS 30 CO 0.00 0.00 0.00 1.05 0.64 0.00 0.00 176.34 178.03 1x4k h GLU 31 N -0.64 0.00 -0.00 -0.41 4.11 -1.92 -0.35 114.58 115.36 1x4k h GLU 31 Ca -0.44 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.99 1x4k h GLU 31 Cb 1.35 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.60 1x4k h GLU 31 CO 0.36 0.00 -0.29 0.25 0.07 0.00 0.00 179.01 179.40 1x4k n THR 32 N -2.30 0.00 -0.00 -1.06 -2.24 -1.26 -4.50 114.28 102.91 1x4k n THR 32 Ca -0.01 -0.35 0.04 0.00 -2.27 0.00 0.00 64.05 61.45 1x4k n THR 32 Cb 0.08 1.06 -0.12 0.00 -2.10 0.00 0.00 70.33 69.25 1x4k n THR 32 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1x4k n PHE 34 N -2.60 0.16 -0.74 0.00 7.35 -0.52 -4.87 117.46 116.24 1x4k n PHE 34 Ca -0.11 -0.06 -0.33 0.00 -0.76 0.00 0.00 57.45 56.18 1x4k n PHE 34 Cb 0.77 -0.10 0.14 0.00 0.35 0.00 0.00 39.48 40.64 1x4k n PHE 34 CO 0.00 0.00 0.00 0.44 -0.76 0.00 0.00 176.76 176.44 1x4k n ILE 35 N -0.05 0.00 -1.55 -2.13 -6.64 -1.26 -4.34 119.36 103.39 1x4k n ILE 35 Ca 0.02 -0.22 -0.29 0.00 -1.77 0.00 0.00 62.75 60.49 1x4k n ILE 35 Cb 0.25 -0.45 0.12 0.00 -1.44 0.00 0.00 39.64 38.12 1x4k n ILE 35 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 1x4k n HIS 37 N -3.67 0.00 -0.09 0.00 8.25 -0.57 -3.28 115.22 115.86 1x4k n HIS 37 Ca 0.07 0.00 -0.16 0.00 -0.26 0.00 0.00 57.72 57.36 1x4k n HIS 37 Cb 0.59 -0.22 -0.05 0.00 1.12 0.00 0.00 29.99 31.42 1x4k n HIS 37 CO 0.00 0.00 0.00 -2.13 0.64 0.00 0.00 176.34 174.85 1x4k n ARG 38 N -1.80 0.46 0.00 -0.41 0.63 -1.26 -4.63 116.66 109.66 1x4k n ARG 38 Ca -0.00 0.19 0.12 0.00 -0.92 0.00 0.00 57.85 57.24 1x4k n ARG 38 Cb 0.39 -1.30 0.19 0.00 0.45 0.00 0.00 32.46 32.19 1x4k n ARG 38 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1x4k n GLN 40 N -1.01 -5.11 -4.42 0.00 3.00 -1.21 -4.91 117.38 103.73 1x4k n GLN 40 Ca 0.08 0.58 -0.31 0.00 -0.01 0.00 0.00 57.00 57.34 1x4k n GLN 40 Cb 0.36 -5.32 -0.11 0.00 0.00 0.00 0.00 30.24 25.17 1x4k n GLN 40 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.06 176.41 1x4k s GLN 41 N -6.44 2.27 -1.19 -1.09 -1.52 -1.26 -4.57 119.66 105.87 1x4k s GLN 41 Ca 0.43 -0.90 -0.23 0.00 -1.95 0.00 0.00 55.36 52.71 1x4k s GLN 41 Cb -0.22 -2.35 -0.09 0.00 -0.22 0.00 0.00 33.01 30.14 1x4k s GLN 41 CO 0.83 0.55 1.93 -1.25 -0.25 0.00 0.00 175.29 177.11 1x4k s PRO 42 N -1.74 2.49 0.17 2.91 0.04 -1.26 0.11 135.00 137.73 1x4k s PRO 42 Ca 0.18 -1.17 -0.24 0.00 0.04 0.00 0.00 61.00 59.81 1x4k s PRO 42 Cb -0.11 -5.24 0.06 0.00 0.04 0.00 0.00 34.50 29.25 1x4k s PRO 42 CO 0.09 -3.99 1.57 0.82 0.04 0.00 0.00 177.00 175.54 1x4k h ILE 43 N 6.18 0.11 0.00 0.56 2.04 -1.87 -3.46 117.51 121.07 1x4k h ILE 43 Ca 0.22 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.08 1x4k h ILE 43 Cb 0.94 0.11 0.00 0.00 -0.74 0.00 0.00 36.82 37.13 1x4k h ILE 43 CO 1.22 0.00 0.00 0.61 0.00 0.00 0.00 178.15 179.98 1x4k n GLY 44 N -1.42 2.16 2.91 5.37 0.00 -1.26 -4.32 105.19 108.63 1x4k n GLY 44 Ca 0.02 -0.32 -0.29 0.00 0.00 0.00 0.00 46.02 45.43 1x4k n GLY 44 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1x4k s THR 45 N 0.00 2.60 0.35 2.61 -4.23 -1.26 -5.06 115.64 110.65 1x4k s THR 45 Ca 0.00 -3.62 -0.17 0.00 -1.18 0.00 0.00 61.69 56.72 1x4k s THR 45 Cb 0.00 -2.77 0.05 0.00 1.34 0.00 0.00 72.50 71.12 1x4k s THR 45 CO 0.00 -0.89 0.77 -1.59 -0.54 0.00 0.00 174.62 172.38 1x4k s LYS 46 N -0.67 2.11 -0.41 3.99 -2.85 -1.26 -5.10 119.74 115.54 1x4k s LYS 46 Ca 0.20 -1.31 -0.30 0.00 -1.00 0.00 0.00 55.97 53.57 1x4k s LYS 46 Cb -0.18 0.62 -0.09 0.00 -2.06 0.00 0.00 37.83 36.12 1x4k s LYS 46 CO -0.06 -0.98 2.32 -1.13 0.10 0.00 0.00 175.35 175.60 1x4k n SER 47 N -1.14 2.37 -3.80 0.03 3.41 -1.26 -4.91 113.62 108.32 1x4k n SER 47 Ca -0.07 0.02 -0.12 0.00 -0.26 0.00 0.00 58.87 58.44 1x4k n SER 47 Cb 0.60 -1.43 -0.10 0.00 -0.26 0.00 0.00 64.21 63.02 1x4k n SER 47 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 1x4k s PHE 48 N 9.41 -0.13 -0.47 7.33 -0.71 -1.26 -3.58 117.98 128.57 1x4k s PHE 48 Ca 1.06 0.24 -0.13 0.00 -1.04 0.00 0.00 56.93 57.05 1x4k s PHE 48 Cb -0.51 0.05 0.09 0.00 -1.21 0.00 0.00 43.02 41.43 1x4k s PHE 48 CO 0.37 -0.30 0.37 0.42 -1.34 0.00 0.00 175.22 174.75 1x4k s ILE 49 N -1.00 4.89 -0.15 -4.49 1.09 0.80 -4.92 121.20 117.42 1x4k s ILE 49 Ca -0.11 -1.27 -0.29 0.00 -1.10 0.00 0.00 60.65 57.88 1x4k s ILE 49 Cb -0.05 -3.99 -0.03 0.00 -1.06 0.00 0.00 42.46 37.33 1x4k s ILE 49 CO 0.02 -0.61 1.56 -2.16 -0.10 0.00 0.00 174.94 173.65 1x4k s PRO 50 N 1.56 4.02 0.42 2.79 0.04 -1.26 -2.12 135.00 140.45 1x4k s PRO 50 Ca 0.04 1.85 -0.12 0.00 0.04 0.00 0.00 61.00 62.81 1x4k s PRO 50 Cb -0.25 -3.97 -0.07 0.00 0.04 0.00 0.00 34.50 30.26 1x4k s PRO 50 CO 0.04 -1.02 0.81 0.21 0.04 0.00 0.00 177.00 177.08 1x4k s LYS 51 N 4.22 3.81 0.03 4.56 2.47 0.28 -4.96 119.74 130.15 1x4k s LYS 51 Ca 0.69 0.56 -0.06 0.00 -1.56 0.00 0.00 55.97 55.60 1x4k s LYS 51 Cb -0.27 -2.35 -0.01 0.00 -1.46 0.00 0.00 37.83 33.74 1x4k s LYS 51 CO 0.27 -0.08 0.77 -0.25 0.16 0.00 0.00 175.35 176.22 1x4k n ASP 52 N -1.34 -0.20 -0.53 1.43 9.92 -1.26 -1.89 116.55 122.70 1x4k n ASP 52 Ca 0.03 0.81 0.06 0.00 -0.53 0.00 0.00 54.79 55.17 1x4k n ASP 52 Cb 0.54 -0.29 0.19 0.00 -0.64 0.00 0.00 41.12 40.93 1x4k n ASP 52 CO 0.00 0.00 0.00 -3.20 0.13 0.00 0.00 177.20 174.13 1x4k n ASN 53 N -3.27 1.95 -3.03 -2.24 5.15 -1.26 -5.04 115.26 107.53 1x4k n ASN 53 Ca 0.00 -3.70 -0.13 0.00 -0.60 0.00 0.00 54.58 50.16 1x4k n ASN 53 Cb 0.05 -0.52 -0.01 0.00 -0.53 0.00 0.00 39.78 38.77 1x4k n ASN 53 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 1x4k s GLN 54 N -3.15 2.09 -0.02 1.20 -0.21 -0.79 -5.17 119.66 113.61 1x4k s GLN 54 Ca 0.37 -1.67 -0.00 0.00 0.02 0.00 0.00 55.36 54.08 1x4k s GLN 54 Cb 0.35 0.52 0.03 0.00 1.00 0.00 0.00 33.01 34.91 1x4k s GLN 54 CO -0.04 -0.92 0.03 -0.80 -2.12 0.00 0.00 175.29 171.44 1x4k s ASN 55 N -3.19 0.07 -0.02 5.90 -0.87 -1.26 0.10 114.94 115.67 1x4k s ASN 55 Ca 0.25 0.04 0.01 0.00 -1.57 0.00 0.00 52.86 51.59 1x4k s ASN 55 Cb -0.02 -0.06 0.01 0.00 -0.02 0.00 0.00 41.25 41.15 1x4k s ASN 55 CO 0.17 -0.13 -0.01 -0.36 -2.57 0.00 0.00 177.10 174.20 1x4k s PHE 56 N 1.06 0.30 0.99 2.20 0.08 -0.90 -1.51 117.98 120.20 1x4k s PHE 56 Ca -0.09 -0.02 -0.17 0.00 0.12 0.00 0.00 56.93 56.77 1x4k s PHE 56 Cb -0.13 -0.30 0.25 0.00 -0.57 0.00 0.00 43.02 42.27 1x4k s PHE 56 CO -0.03 -0.07 0.70 0.00 -0.10 0.00 0.00 175.22 175.72 1x4k h VAL 58 N -2.84 1.03 0.00 0.00 2.07 -1.91 0.32 116.25 114.91 1x4k h VAL 58 Ca -0.29 -0.68 -0.02 0.00 0.82 0.00 0.00 66.70 66.53 1x4k h VAL 58 Cb 0.94 1.46 -0.00 0.00 -1.52 0.00 0.00 31.29 32.17 1x4k h VAL 58 CO 0.18 0.16 -0.08 1.55 0.02 0.00 0.00 177.57 179.40 1x4k h PRO 59 N -0.49 0.00 0.00 1.57 0.13 -1.92 -2.85 132.00 128.44 1x4k h PRO 59 Ca -0.02 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 65.06 1x4k h PRO 59 Cb 0.39 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.51 1x4k h PRO 59 CO 0.03 0.08 -0.58 0.00 -0.23 0.00 0.00 178.00 177.30 1x4k h TYR 61 N -1.00 0.49 -0.64 0.00 3.20 -0.44 0.13 116.97 118.70 1x4k h TYR 61 Ca -0.09 0.02 0.07 0.00 3.14 0.00 0.00 58.73 61.87 1x4k h TYR 61 Cb 0.65 -0.14 -0.06 0.00 1.54 0.00 0.00 36.73 38.72 1x4k h TYR 61 CO -0.08 0.05 0.33 0.93 -1.64 0.00 0.00 178.16 177.76 1x4k h GLU 62 N 0.30 0.59 -0.63 1.82 4.39 -1.66 0.23 114.58 119.61 1x4k h GLU 62 Ca 0.56 -0.04 0.13 0.00 0.34 0.00 0.00 59.36 60.36 1x4k h GLU 62 Cb 1.61 -0.13 -0.11 0.00 -0.10 0.00 0.00 28.75 30.02 1x4k h GLU 62 CO -0.21 0.39 -0.03 0.87 -1.16 0.00 0.00 179.01 178.86 1x4k h LYS 63 N 0.60 0.08 0.09 2.33 6.56 -0.88 0.59 116.57 125.94 1x4k h LYS 63 Ca 0.30 -0.01 -0.00 0.00 -1.06 0.00 0.00 60.65 59.88 1x4k h LYS 63 Cb 0.24 -0.02 0.00 0.00 -0.57 0.00 0.00 32.23 31.88 1x4k h LYS 63 CO -0.21 0.06 -0.04 1.96 -2.06 0.00 0.00 179.45 179.15 1x4k h GLN 64 N 0.09 -0.11 0.05 3.15 1.08 -1.46 -3.38 115.11 114.53 1x4k h GLN 64 Ca 0.33 0.01 0.01 0.00 -1.45 0.00 0.00 58.65 57.54 1x4k h GLN 64 Cb 0.53 0.03 -0.02 0.00 -0.05 0.00 0.00 27.48 27.96 1x4k h GLN 64 CO -0.57 0.37 -0.25 1.25 -0.95 0.00 0.00 178.83 178.67 1x4k h HIS 65 N -0.93 -0.74 -3.17 2.96 2.76 -0.29 -3.38 115.15 112.36 1x4k h HIS 65 Ca -0.01 0.02 -0.57 0.00 -2.20 0.00 0.00 60.37 57.61 1x4k h HIS 65 Cb 0.53 0.31 -0.05 0.00 1.55 0.00 0.00 27.41 29.75 1x4k h HIS 65 CO 0.12 -0.29 0.95 0.00 -1.30 0.00 0.00 177.93 177.41 1x4k s ALA 66 N -4.55 3.40 0.45 5.26 0.00 0.20 -5.01 121.76 121.51 1x4k s ALA 66 Ca -0.08 0.08 0.03 0.00 0.00 0.00 0.00 51.96 51.99 1x4k s ALA 66 Cb 0.03 -3.75 -0.02 0.00 0.00 0.00 0.00 23.12 19.37 1x4k s ALA 66 CO 0.29 -1.71 0.06 -1.12 0.00 0.00 0.00 175.76 173.28 1x4k s SER 67 N 2.55 3.45 0.00 0.00 0.01 -1.26 -4.59 113.70 113.86 1x4k s SER 67 Ca 0.54 -1.63 0.00 0.00 1.31 0.00 0.00 55.95 56.17 1x4k s SER 67 Cb -0.16 0.43 0.00 0.00 0.21 0.00 0.00 66.02 66.50 1x4k s SER 67 CO 0.22 -0.85 0.00 0.61 0.41 0.00 0.00 173.24 173.62 1x4k n GLY 68 N -1.06 0.83 0.00 3.44 0.00 -1.26 -4.90 105.19 102.24 1x4k n GLY 68 Ca -0.12 -1.56 0.02 0.00 0.00 0.00 0.00 46.02 44.36 1x4k n GLY 68 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1x4k n PRO 69 N -1.49 0.49 -1.07 1.61 -0.04 -1.26 -4.43 135.00 128.82 1x4k n PRO 69 Ca 0.00 0.00 -0.34 0.00 -0.04 0.00 0.00 63.50 63.12 1x4k n PRO 69 Cb 0.00 -1.15 -0.03 0.00 -0.04 0.00 0.00 33.50 32.28 1x4k n PRO 69 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1x4k n SER 70 N -0.65 4.39 -0.02 3.54 7.64 -1.26 -4.10 113.62 123.15 1x4k n SER 70 Ca 0.04 -2.54 -0.07 0.00 1.01 0.00 0.00 58.87 57.31 1x4k n SER 70 Cb 0.02 -1.22 -0.02 0.00 -1.01 0.00 0.00 64.21 61.97 1x4k n SER 70 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1x4k n SER 71 N 5.50 0.71 0.00 6.43 2.88 -1.26 -5.16 113.62 122.71 1x4k n SER 71 Ca 0.51 0.11 0.00 0.00 -1.33 0.00 0.00 58.87 58.16 1x4k n SER 71 Cb 0.27 -0.27 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 1x4k n SER 71 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42