#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x4k n SER 2 N 0.00 5.97 -4.56 1.61 2.88 -1.26 -4.98 113.62 113.28 1x4k n SER 2 Ca 0.00 -3.77 -0.21 0.00 -1.33 0.00 0.00 58.87 53.57 1x4k n SER 2 Cb 0.00 -0.61 -0.06 0.00 -0.75 0.00 0.00 64.21 62.79 1x4k n SER 2 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1x4k s SER 3 N -2.86 4.49 0.00 -3.46 1.04 -1.26 -4.43 113.70 107.23 1x4k s SER 3 Ca 0.55 -0.49 0.00 0.00 0.48 0.00 0.00 55.95 56.50 1x4k s SER 3 Cb 0.44 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 64.00 1x4k s SER 3 CO -0.03 -3.39 0.00 0.61 0.98 0.00 0.00 173.24 171.41 1x4k n GLY 4 N 6.71 -1.27 3.13 7.32 0.00 -1.26 -5.16 105.19 114.66 1x4k n GLY 4 Ca 0.43 0.67 -0.32 0.00 0.00 0.00 0.00 46.02 46.81 1x4k n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1x4k s SER 5 N 0.00 2.95 0.52 1.61 1.04 -1.26 -5.13 113.70 113.43 1x4k s SER 5 Ca 0.00 -0.57 0.02 0.00 0.48 0.00 0.00 55.95 55.88 1x4k s SER 5 Cb 0.00 -1.36 0.03 0.00 0.10 0.00 0.00 66.02 64.78 1x4k s SER 5 CO 0.00 0.05 0.74 -0.94 0.98 0.00 0.00 173.24 174.07 1x4k s SER 6 N 0.93 5.40 -0.29 7.02 1.04 -1.26 -5.09 113.70 121.45 1x4k s SER 6 Ca -0.05 -0.00 -0.17 0.00 0.48 0.00 0.00 55.95 56.20 1x4k s SER 6 Cb -0.15 -0.96 0.12 0.00 0.10 0.00 0.00 66.02 65.14 1x4k s SER 6 CO -0.03 -1.04 0.89 -0.83 0.98 0.00 0.00 173.24 173.21 1x4k s GLY 7 N -4.39 -0.22 0.79 7.32 0.00 -1.26 -3.80 107.32 105.77 1x4k s GLY 7 Ca 0.56 2.84 -0.11 0.00 0.00 0.00 0.00 44.72 48.01 1x4k s GLY 7 CO 0.38 2.42 1.09 0.00 0.00 0.00 0.00 173.10 176.98 1x4k n GLN 9 N -3.53 1.06 0.16 0.00 3.00 -0.97 -3.60 117.38 113.50 1x4k n GLN 9 Ca 0.08 0.05 -0.06 0.00 -0.01 0.00 0.00 57.00 57.05 1x4k n GLN 9 Cb 0.54 -1.26 -0.03 0.00 0.00 0.00 0.00 30.24 29.49 1x4k n GLN 9 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.06 178.55 1x4k h GLU 10 N 0.00 -0.39 0.00 -1.09 4.22 -1.91 -3.28 114.58 112.13 1x4k h GLU 10 Ca -0.28 0.03 0.00 0.00 0.08 0.00 0.00 59.36 59.18 1x4k h GLU 10 Cb 1.51 0.09 0.00 0.00 0.50 0.00 0.00 28.75 30.85 1x4k h GLU 10 CO -0.02 -0.26 -0.60 0.00 -2.18 0.00 0.00 179.01 175.95 1x4k n LYS 12 N -1.68 -6.58 -5.08 0.00 4.76 -1.24 -5.01 118.16 103.33 1x4k n LYS 12 Ca 0.05 0.73 -0.32 0.00 -2.87 0.00 0.00 58.31 55.90 1x4k n LYS 12 Cb 0.37 -5.45 -0.15 0.00 -1.84 0.00 0.00 35.03 27.96 1x4k n LYS 12 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 1x4k s LYS 13 N -5.82 2.44 -0.27 1.97 -0.14 -1.26 -4.82 119.74 111.84 1x4k s LYS 13 Ca 0.34 -0.81 -0.38 0.00 -1.36 0.00 0.00 55.97 53.76 1x4k s LYS 13 Cb -0.15 -2.25 -0.14 0.00 -1.68 0.00 0.00 37.83 33.61 1x4k s LYS 13 CO 0.64 0.54 1.87 2.41 -0.76 0.00 0.00 175.35 180.04 1x4k n THR 14 N 2.54 0.33 -2.79 2.17 -1.04 -1.26 -1.52 114.28 112.70 1x4k n THR 14 Ca -0.17 -0.10 -0.43 0.00 -2.04 0.00 0.00 64.05 61.32 1x4k n THR 14 Cb 0.52 -1.40 -0.04 0.00 -1.82 0.00 0.00 70.33 67.59 1x4k n THR 14 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 1x4k s ILE 15 N 4.43 4.59 0.63 12.58 1.01 -1.25 -4.85 121.20 138.34 1x4k s ILE 15 Ca 1.00 1.28 -0.17 0.00 0.00 0.00 0.00 60.65 62.76 1x4k s ILE 15 Cb -0.98 -4.33 -0.02 0.00 0.01 0.00 0.00 42.46 37.15 1x4k s ILE 15 CO 0.60 -0.50 1.17 -0.04 0.00 0.00 0.00 174.94 176.17 1x4k s MET 16 N 3.46 2.83 0.17 2.79 -1.94 -1.26 -4.57 119.30 120.77 1x4k s MET 16 Ca 0.39 1.66 0.20 0.00 -1.71 0.00 0.00 55.69 56.23 1x4k s MET 16 Cb -0.12 -1.93 0.86 0.00 2.01 0.00 0.00 34.83 35.65 1x4k s MET 16 CO 0.18 -1.28 1.62 -0.35 -0.01 0.00 0.00 175.02 175.18 1x4k n PRO 17 N -1.99 0.13 -0.07 2.03 -0.04 -1.26 -3.37 135.00 130.44 1x4k n PRO 17 Ca 0.12 0.37 -0.11 0.00 -0.04 0.00 0.00 63.50 63.85 1x4k n PRO 17 Cb 0.51 -1.75 -0.09 0.00 -0.04 0.00 0.00 33.50 32.13 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 2.30 0.00 -1.98 0.55 0.00 -2.03 -3.46 103.07 98.44 1x4k h GLY 18 Ca 0.00 0.00 -0.52 0.00 0.00 0.00 0.00 47.33 46.81 1x4k h GLY 18 CO 0.00 0.00 0.43 -1.08 0.00 0.00 0.00 176.54 175.89 1x4k s THR 19 N -2.05 2.87 0.18 4.70 -1.32 -1.22 -4.99 115.64 113.81 1x4k s THR 19 Ca -0.15 0.50 -0.30 0.00 -1.21 0.00 0.00 61.69 60.53 1x4k s THR 19 Cb -0.01 -3.14 -0.08 0.00 -1.51 0.00 0.00 72.50 67.77 1x4k s THR 19 CO 0.48 -0.16 0.98 -0.13 -2.21 0.00 0.00 174.62 173.59 1x4k s ARG 20 N -3.52 4.74 0.22 7.08 0.52 -1.26 -4.83 118.95 121.89 1x4k s ARG 20 Ca 0.74 1.53 0.03 0.00 -0.52 0.00 0.00 55.73 57.51 1x4k s ARG 20 Cb -0.26 -3.31 -0.05 0.00 0.52 0.00 0.00 34.95 31.84 1x4k s ARG 20 CO 0.34 0.31 -0.00 -1.59 0.02 0.00 0.00 175.30 174.38 1x4k s LYS 21 N -0.60 1.29 -0.27 3.54 -2.85 -1.26 -2.15 119.74 117.44 1x4k s LYS 21 Ca 0.45 -1.65 0.00 0.00 -1.00 0.00 0.00 55.97 53.77 1x4k s LYS 21 Cb -0.26 -0.54 0.05 0.00 -2.06 0.00 0.00 37.83 35.02 1x4k s LYS 21 CO 0.32 -0.11 -0.07 -1.64 0.10 0.00 0.00 175.35 173.96 1x4k s MET 22 N -3.88 2.46 -0.36 1.78 -1.94 0.11 -4.91 119.30 112.57 1x4k s MET 22 Ca 0.28 -1.22 -0.21 0.00 -1.71 0.00 0.00 55.69 52.82 1x4k s MET 22 Cb 0.06 -3.00 0.00 0.00 2.01 0.00 0.00 34.83 33.90 1x4k s MET 22 CO 0.08 -0.54 0.66 -1.21 -0.01 0.00 0.00 175.02 174.00 1x4k s GLU 23 N 1.21 3.69 -0.05 2.03 2.02 -1.26 -0.56 118.70 125.78 1x4k s GLU 23 Ca -0.05 0.09 -0.02 0.00 0.02 0.00 0.00 54.97 55.01 1x4k s GLU 23 Cb -0.19 -3.81 0.03 0.00 0.10 0.00 0.00 34.13 30.27 1x4k s GLU 23 CO -0.04 -0.75 0.08 -0.47 0.02 0.00 0.00 175.26 174.11 1x4k s TYR 24 N 2.76 -0.02 -1.25 1.61 6.14 0.84 -4.86 117.35 122.57 1x4k s TYR 24 Ca 0.25 0.33 -0.08 0.00 0.64 0.00 0.00 57.07 58.22 1x4k s TYR 24 Cb -0.14 -0.34 0.01 0.00 0.42 0.00 0.00 41.96 41.91 1x4k s TYR 24 CO 0.15 -0.18 1.10 1.63 0.64 0.00 0.00 175.55 178.88 1x4k n LYS 25 N 4.95 -7.37 0.00 4.97 4.76 -1.26 -2.51 118.16 121.69 1x4k n LYS 25 Ca -0.11 0.77 0.00 0.00 -2.87 0.00 0.00 58.31 56.10 1x4k n LYS 25 Cb 0.50 -5.64 0.00 0.00 -1.84 0.00 0.00 35.03 28.05 1x4k n LYS 25 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1x4k n GLY 26 N -1.87 1.47 3.83 0.72 0.00 -1.26 -4.96 105.19 103.11 1x4k n GLY 26 Ca -0.00 -0.14 -0.31 0.00 0.00 0.00 0.00 46.02 45.57 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 0.00 5.38 0.26 1.61 0.01 -1.05 -5.03 113.70 114.89 1x4k s SER 27 Ca 0.00 1.48 0.10 0.00 1.31 0.00 0.00 55.95 58.84 1x4k s SER 27 Cb 0.00 -2.36 -0.05 0.00 0.21 0.00 0.00 66.02 63.82 1x4k s SER 27 CO 0.00 -1.42 -0.17 -0.44 0.41 0.00 0.00 173.24 171.62 1x4k s SER 28 N -3.94 3.21 -0.08 2.44 0.01 -1.26 -0.11 113.70 113.97 1x4k s SER 28 Ca 0.58 -1.04 -0.04 0.00 1.31 0.00 0.00 55.95 56.76 1x4k s SER 28 Cb -0.13 -0.24 0.04 0.00 0.21 0.00 0.00 66.02 65.90 1x4k s SER 28 CO 0.54 -0.06 0.18 0.26 0.41 0.00 0.00 173.24 174.57 1x4k s TRP 29 N -2.70 -0.22 0.97 2.43 0.51 0.28 -2.28 118.94 117.93 1x4k s TRP 29 Ca 0.28 0.61 -0.14 0.00 -2.12 0.00 0.00 56.10 54.73 1x4k s TRP 29 Cb -0.03 -0.10 0.00 0.00 -0.81 0.00 0.00 33.47 32.53 1x4k s TRP 29 CO 0.12 -0.22 0.14 0.72 -0.51 0.00 0.00 176.95 177.21 1x4k n HIS 30 N 4.59 -2.18 0.06 -1.98 8.25 -1.26 0.06 115.22 122.76 1x4k n HIS 30 Ca -0.19 0.18 0.03 0.00 -0.26 0.00 0.00 57.72 57.48 1x4k n HIS 30 Cb 0.51 -1.71 0.42 0.00 1.12 0.00 0.00 29.99 30.34 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 -1.47 0.39 0.00 -0.41 4.11 -1.79 0.17 114.58 115.58 1x4k h GLU 31 Ca -0.44 -0.05 -0.06 0.00 0.07 0.00 0.00 59.36 58.88 1x4k h GLU 31 Cb 1.29 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 30.45 1x4k h GLU 31 CO 0.32 0.35 -1.23 0.25 0.07 0.00 0.00 179.01 178.77 1x4k n THR 32 N -4.40 0.77 0.09 -1.06 -2.24 -1.26 -3.99 114.28 102.20 1x4k n THR 32 Ca 0.01 -0.60 -0.00 0.00 -2.27 0.00 0.00 64.05 61.19 1x4k n THR 32 Cb 0.15 -0.44 -0.03 0.00 -2.10 0.00 0.00 70.33 67.91 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 -3.17 0.46 -0.86 0.00 7.35 0.52 -4.85 117.46 116.91 1x4k n PHE 34 Ca -0.02 -0.49 -0.30 0.00 -0.76 0.00 0.00 57.45 55.89 1x4k n PHE 34 Cb 0.81 -0.29 0.18 0.00 0.35 0.00 0.00 39.48 40.53 1x4k n PHE 34 CO 0.00 0.00 0.00 0.96 -0.76 0.00 0.00 176.76 176.96 1x4k s ILE 35 N -0.86 2.29 0.89 -2.13 -5.25 -1.23 -4.25 121.20 110.67 1x4k s ILE 35 Ca 0.10 0.10 -0.11 0.00 -0.99 0.00 0.00 60.65 59.74 1x4k s ILE 35 Cb 0.08 -2.32 0.13 0.00 2.95 0.00 0.00 42.46 43.29 1x4k s ILE 35 CO 0.02 -0.12 1.09 0.00 -1.79 0.00 0.00 174.94 174.14 1x4k n HIS 37 N -3.92 0.01 -0.07 0.00 8.25 -0.39 -3.17 115.22 115.92 1x4k n HIS 37 Ca 0.08 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.45 1x4k n HIS 37 Cb 0.54 -0.19 -0.03 0.00 1.12 0.00 0.00 29.99 31.43 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 -1.78 0.45 0.08 -0.41 0.63 -1.26 -4.65 116.66 109.72 1x4k n ARG 38 Ca 0.01 0.18 0.12 0.00 -0.92 0.00 0.00 57.85 57.24 1x4k n ARG 38 Cb 0.42 -1.29 0.21 0.00 0.45 0.00 0.00 32.46 32.25 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 -2.24 -7.35 -4.61 0.00 1.13 -1.19 -4.94 117.38 98.18 1x4k n GLN 40 Ca 0.04 0.84 -0.30 0.00 -1.94 0.00 0.00 57.00 55.63 1x4k n GLN 40 Cb 0.45 -5.87 -0.13 0.00 0.11 0.00 0.00 30.24 24.80 1x4k n GLN 40 CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 1x4k s GLN 41 N -5.87 1.82 -1.17 -1.09 -0.21 -1.26 -4.65 119.66 107.24 1x4k s GLN 41 Ca 0.31 -1.12 -0.23 0.00 0.02 0.00 0.00 55.36 54.35 1x4k s GLN 41 Cb -0.14 -2.07 -0.08 0.00 1.00 0.00 0.00 33.01 31.72 1x4k s GLN 41 CO 0.73 0.51 1.93 -1.25 -2.12 0.00 0.00 175.29 175.09 1x4k s PRO 42 N -1.63 2.50 0.10 2.91 0.04 -1.26 0.42 135.00 138.08 1x4k s PRO 42 Ca 0.14 -1.11 -0.19 0.00 0.04 0.00 0.00 61.00 59.89 1x4k s PRO 42 Cb -0.10 -5.23 -0.04 0.00 0.04 0.00 0.00 34.50 29.16 1x4k s PRO 42 CO 0.05 -3.94 1.28 -0.89 0.04 0.00 0.00 177.00 173.54 1x4k n ILE 43 N 7.81 -0.41 0.00 0.56 5.41 -1.26 -4.88 119.36 126.59 1x4k n ILE 43 Ca 0.44 1.98 0.00 0.00 1.00 0.00 0.00 62.75 66.18 1x4k n ILE 43 Cb 0.47 -2.50 0.00 0.00 -0.71 0.00 0.00 39.64 36.89 1x4k n ILE 43 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1x4k n GLY 44 N -1.15 1.04 2.43 7.39 0.00 -1.26 -4.25 105.19 109.40 1x4k n GLY 44 Ca 0.01 -0.91 -0.12 0.00 0.00 0.00 0.00 46.02 44.99 1x4k n GLY 44 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1x4k n THR 45 N 0.00 1.89 -3.75 2.61 -2.24 -1.26 -5.01 114.28 106.52 1x4k n THR 45 Ca 0.00 -3.59 -0.23 0.00 -2.27 0.00 0.00 64.05 57.96 1x4k n THR 45 Cb 0.00 0.06 -0.03 0.00 -2.10 0.00 0.00 70.33 68.26 1x4k n THR 45 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 1x4k s LYS 46 N -3.69 2.39 -0.21 -0.78 -2.85 -1.26 -5.03 119.74 108.31 1x4k s LYS 46 Ca 0.39 -1.73 -0.32 0.00 -1.00 0.00 0.00 55.97 53.32 1x4k s LYS 46 Cb 0.37 -2.23 -0.09 0.00 -2.06 0.00 0.00 37.83 33.82 1x4k s LYS 46 CO -0.00 -0.30 2.13 0.45 0.10 0.00 0.00 175.35 177.72 1x4k n SER 47 N -1.55 3.03 -3.79 0.03 2.88 -1.26 -4.93 113.62 108.02 1x4k n SER 47 Ca 0.02 0.47 -0.13 0.00 -1.33 0.00 0.00 58.87 57.90 1x4k n SER 47 Cb 0.63 -1.43 -0.10 0.00 -0.75 0.00 0.00 64.21 62.56 1x4k n SER 47 CO 0.00 0.00 0.00 0.72 -1.23 0.00 0.00 175.04 174.53 1x4k s PHE 48 N 6.89 -0.18 -0.48 0.66 -0.71 -1.26 -3.69 117.98 119.21 1x4k s PHE 48 Ca 1.01 0.36 -0.17 0.00 -1.04 0.00 0.00 56.93 57.09 1x4k s PHE 48 Cb -0.57 0.07 0.06 0.00 -1.21 0.00 0.00 43.02 41.37 1x4k s PHE 48 CO 0.43 -0.28 0.47 0.42 -1.34 0.00 0.00 175.22 174.92 1x4k s ILE 49 N -0.82 5.10 -0.15 -4.49 1.09 0.44 -4.92 121.20 117.45 1x4k s ILE 49 Ca -0.09 -0.81 -0.29 0.00 -1.10 0.00 0.00 60.65 58.36 1x4k s ILE 49 Cb -0.05 -4.17 -0.03 0.00 -1.06 0.00 0.00 42.46 37.15 1x4k s ILE 49 CO 0.02 -0.64 1.56 -2.16 -0.10 0.00 0.00 174.94 173.62 1x4k s PRO 50 N 2.02 4.01 0.35 2.79 0.04 -1.26 -2.30 135.00 140.65 1x4k s PRO 50 Ca 0.08 1.84 -0.13 0.00 0.04 0.00 0.00 61.00 62.83 1x4k s PRO 50 Cb -0.22 -3.97 -0.08 0.00 0.04 0.00 0.00 34.50 30.27 1x4k s PRO 50 CO 0.09 -1.03 0.74 0.21 0.04 0.00 0.00 177.00 177.06 1x4k s LYS 51 N 4.23 3.93 0.02 4.56 2.47 0.30 -4.97 119.74 130.29 1x4k s LYS 51 Ca 0.69 0.60 -0.04 0.00 -1.56 0.00 0.00 55.97 55.66 1x4k s LYS 51 Cb -0.27 -2.42 -0.01 0.00 -1.46 0.00 0.00 37.83 33.67 1x4k s LYS 51 CO 0.27 0.10 0.55 -0.25 0.16 0.00 0.00 175.35 176.17 1x4k n ASP 52 N -0.65 -0.13 -0.61 1.43 8.00 -1.26 -1.52 116.55 121.81 1x4k n ASP 52 Ca 0.03 0.58 0.06 0.00 0.71 0.00 0.00 54.79 56.17 1x4k n ASP 52 Cb 0.53 -0.21 0.19 0.00 -0.02 0.00 0.00 41.12 41.62 1x4k n ASP 52 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 1x4k n ASN 53 N -3.03 1.71 -3.45 -2.24 6.94 -1.26 -5.04 115.26 108.90 1x4k n ASN 53 Ca 0.00 -3.69 -0.11 0.00 -0.02 0.00 0.00 54.58 50.76 1x4k n ASN 53 Cb 0.03 -0.50 -0.03 0.00 -2.36 0.00 0.00 39.78 36.92 1x4k n ASN 53 CO 0.00 0.00 0.00 -1.10 -1.03 0.00 0.00 177.26 175.13 1x4k s GLN 54 N -2.97 1.86 -0.05 -3.83 -0.21 -0.58 -5.17 119.66 108.72 1x4k s GLN 54 Ca 0.37 -1.49 0.00 0.00 0.02 0.00 0.00 55.36 54.26 1x4k s GLN 54 Cb 0.36 0.50 0.02 0.00 1.00 0.00 0.00 33.01 34.90 1x4k s GLN 54 CO -0.07 -0.80 -0.02 -0.80 -2.12 0.00 0.00 175.29 171.48 1x4k s ASN 55 N -3.11 1.15 -0.04 5.90 0.01 -1.26 0.11 114.94 117.70 1x4k s ASN 55 Ca 0.24 -0.11 0.01 0.00 -0.71 0.00 0.00 52.86 52.29 1x4k s ASN 55 Cb -0.02 -0.43 0.02 0.00 0.41 0.00 0.00 41.25 41.23 1x4k s ASN 55 CO 0.14 -0.11 -0.04 -0.36 -1.51 0.00 0.00 177.10 175.22 1x4k s PHE 56 N 1.32 0.68 1.10 2.20 0.08 -0.97 -1.27 117.98 121.12 1x4k s PHE 56 Ca -0.05 -0.17 -0.18 0.00 0.12 0.00 0.00 56.93 56.65 1x4k s PHE 56 Cb -0.13 -0.59 0.28 0.00 -0.57 0.00 0.00 43.02 42.01 1x4k s PHE 56 CO -0.02 -0.15 0.74 0.00 -0.10 0.00 0.00 175.22 175.69 1x4k h VAL 58 N -3.03 1.20 0.00 0.00 2.07 -1.92 0.35 116.25 114.92 1x4k h VAL 58 Ca -0.31 -0.67 -0.02 0.00 0.82 0.00 0.00 66.70 66.51 1x4k h VAL 58 Cb 1.03 1.65 -0.00 0.00 -1.52 0.00 0.00 31.29 32.45 1x4k h VAL 58 CO 0.19 0.17 -0.10 1.55 0.02 0.00 0.00 177.57 179.41 1x4k h PRO 59 N -0.32 0.00 0.00 1.57 0.13 -1.92 -2.68 132.00 128.79 1x4k h PRO 59 Ca -0.00 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.10 1x4k h PRO 59 Cb 0.30 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.43 1x4k h PRO 59 CO 0.00 0.10 -0.52 0.00 -0.23 0.00 0.00 178.00 177.35 1x4k h TYR 61 N -1.00 -0.62 -0.93 0.00 3.20 -0.39 0.42 116.97 117.64 1x4k h TYR 61 Ca -0.04 0.05 0.28 0.00 3.14 0.00 0.00 58.73 62.15 1x4k h TYR 61 Cb 0.54 0.34 -0.15 0.00 1.54 0.00 0.00 36.73 39.01 1x4k h TYR 61 CO -0.13 -0.32 0.35 0.93 -1.64 0.00 0.00 178.16 177.35 1x4k h GLU 62 N -0.15 0.22 0.35 1.82 4.39 -1.66 0.28 114.58 119.82 1x4k h GLU 62 Ca 0.21 -0.01 -0.02 0.00 0.34 0.00 0.00 59.36 59.88 1x4k h GLU 62 Cb 0.48 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.08 1x4k h GLU 62 CO -0.54 0.14 -0.17 0.87 -1.16 0.00 0.00 179.01 178.16 1x4k h LYS 63 N 0.22 -0.45 -0.21 2.33 1.57 -1.10 -3.20 116.57 115.73 1x4k h LYS 63 Ca 0.63 0.03 0.05 0.00 -1.87 0.00 0.00 60.65 59.50 1x4k h LYS 63 Cb 1.37 0.10 -0.07 0.00 0.08 0.00 0.00 32.23 33.71 1x4k h LYS 63 CO -0.67 -0.14 -0.38 0.37 -0.57 0.00 0.00 179.45 178.07 1x4k h GLN 64 N -0.96 -0.39 -1.99 3.15 5.75 -0.04 -0.65 115.11 119.98 1x4k h GLN 64 Ca -0.05 0.03 -0.07 0.00 -0.15 0.00 0.00 58.65 58.41 1x4k h GLN 64 Cb 0.52 0.09 -0.03 0.00 1.07 0.00 0.00 27.48 29.13 1x4k h GLN 64 CO 0.08 -0.26 -0.10 1.58 -2.65 0.00 0.00 178.83 177.48 1x4k n HIS 65 N -5.42 0.06 -3.89 3.99 -0.00 0.87 -4.79 115.22 106.05 1x4k n HIS 65 Ca -0.02 -1.19 -0.11 0.00 0.46 0.00 0.00 57.72 56.86 1x4k n HIS 65 Cb 0.35 -0.85 -0.10 0.00 -0.12 0.00 0.00 29.99 29.26 1x4k n HIS 65 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1x4k s ALA 66 N 0.22 -0.26 0.79 1.57 0.00 -0.25 -4.92 121.76 118.92 1x4k s ALA 66 Ca 0.21 -0.18 -0.15 0.00 0.00 0.00 0.00 51.96 51.84 1x4k s ALA 66 Cb 0.11 0.10 0.01 0.00 0.00 0.00 0.00 23.12 23.34 1x4k s ALA 66 CO -0.00 -0.19 0.69 0.45 0.00 0.00 0.00 175.76 176.71 1x4k n SER 67 N 1.55 -0.73 -1.85 0.00 2.88 -1.26 -4.97 113.62 109.24 1x4k n SER 67 Ca -0.22 0.54 -0.00 0.00 -1.33 0.00 0.00 58.87 57.86 1x4k n SER 67 Cb 0.56 -1.30 0.01 0.00 -0.75 0.00 0.00 64.21 62.72 1x4k n SER 67 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x4k n GLY 68 N 1.32 0.79 0.00 0.46 0.00 -1.26 -4.99 105.19 101.52 1x4k n GLY 68 Ca 0.10 -0.95 0.07 0.00 0.00 0.00 0.00 46.02 45.24 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 -0.27 0.49 -4.19 1.61 -0.04 -1.26 -4.73 135.00 126.61 1x4k n PRO 69 Ca 0.00 0.00 -0.22 0.00 -0.04 0.00 0.00 63.50 63.24 1x4k n PRO 69 Cb 0.19 -1.43 -0.06 0.00 -0.04 0.00 0.00 33.50 32.16 1x4k n PRO 69 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1x4k s SER 70 N -1.94 5.01 -0.08 3.54 0.15 -1.26 -5.07 113.70 114.06 1x4k s SER 70 Ca 0.20 -0.47 -0.08 0.00 0.70 0.00 0.00 55.95 56.30 1x4k s SER 70 Cb 0.09 -1.09 -0.04 0.00 -1.71 0.00 0.00 66.02 63.27 1x4k s SER 70 CO 0.16 -0.04 -0.17 -0.24 1.20 0.00 0.00 173.24 174.14 1x4k n SER 71 N -1.05 1.26 0.00 5.45 2.88 -1.26 -5.06 113.62 115.84 1x4k n SER 71 Ca -0.07 0.20 0.00 0.00 -1.33 0.00 0.00 58.87 57.67 1x4k n SER 71 Cb 0.59 -0.47 0.00 0.00 -0.75 0.00 0.00 64.21 63.58 1x4k n SER 71 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42