#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 4.76 -0.08 1.61 1.04 -1.26 -5.10 113.70 114.67 1x4k s SER 2 Ca 0.00 -1.85 -0.00 0.00 0.48 0.00 0.00 55.95 54.58 1x4k s SER 2 Cb 0.00 -1.64 -0.03 0.00 0.10 0.00 0.00 66.02 64.45 1x4k s SER 2 CO 0.00 -0.34 -0.06 -0.94 0.98 0.00 0.00 173.24 172.88 1x4k s SER 3 N 1.11 4.70 -0.04 7.02 1.04 -1.26 -5.11 113.70 121.16 1x4k s SER 3 Ca 0.04 -0.03 -0.29 0.00 0.48 0.00 0.00 55.95 56.14 1x4k s SER 3 Cb -0.20 -1.29 0.10 0.00 0.10 0.00 0.00 66.02 64.73 1x4k s SER 3 CO -0.06 0.33 0.88 -0.83 0.98 0.00 0.00 173.24 174.54 1x4k s GLY 4 N -0.62 -0.43 0.04 7.32 0.00 -1.26 -5.08 107.32 107.29 1x4k s GLY 4 Ca 0.09 1.26 -0.16 0.00 0.00 0.00 0.00 44.72 45.91 1x4k s GLY 4 CO 0.02 0.55 1.25 1.76 0.00 0.00 0.00 173.10 176.67 1x4k h SER 5 N 2.22 -0.62 -3.77 1.64 0.02 -1.99 -3.40 113.55 107.64 1x4k h SER 5 Ca -0.22 0.05 -0.67 0.00 -0.84 0.00 0.00 61.79 60.11 1x4k h SER 5 Cb 1.22 0.20 -0.37 0.00 0.14 0.00 0.00 62.40 63.59 1x4k h SER 5 CO 0.32 -0.30 -0.81 -0.44 -1.14 0.00 0.00 176.83 174.47 1x4k s SER 6 N -3.18 4.27 0.13 3.07 0.01 -1.26 -5.11 113.70 111.63 1x4k s SER 6 Ca -0.08 -1.31 0.10 0.00 1.31 0.00 0.00 55.95 55.98 1x4k s SER 6 Cb 0.02 -1.52 -0.04 0.00 0.21 0.00 0.00 66.02 64.69 1x4k s SER 6 CO 0.27 -0.17 -0.23 -0.83 0.41 0.00 0.00 173.24 172.68 1x4k s GLY 7 N 1.14 1.63 0.68 3.44 0.00 -1.26 -1.31 107.32 111.63 1x4k s GLY 7 Ca -0.07 -1.44 -0.11 0.00 0.00 0.00 0.00 44.72 43.10 1x4k s GLY 7 CO -0.06 -1.42 1.07 0.00 0.00 0.00 0.00 173.10 172.69 1x4k n GLN 9 N -2.96 0.64 0.00 0.00 1.13 -0.83 -3.55 117.38 111.81 1x4k n GLN 9 Ca 0.07 0.09 0.00 0.00 -1.94 0.00 0.00 57.00 55.22 1x4k n GLN 9 Cb 0.55 -1.37 0.00 0.00 0.11 0.00 0.00 30.24 29.53 1x4k n GLN 9 CO 0.00 0.00 0.00 -1.91 -1.44 0.00 0.00 177.06 173.71 1x4k n GLU 10 N -2.97 0.00 0.07 -1.09 0.00 -1.26 -3.55 120.64 111.84 1x4k n GLU 10 Ca -0.31 0.42 0.13 0.00 0.00 0.00 0.00 57.16 57.40 1x4k n GLU 10 Cb 0.87 -1.41 0.43 0.00 0.00 0.00 0.00 31.44 31.33 1x4k n GLU 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1x4k n LYS 12 N -2.02 -6.90 -2.97 0.00 4.76 -1.23 -5.02 118.16 104.78 1x4k n LYS 12 Ca 0.06 0.81 -0.15 0.00 -2.87 0.00 0.00 58.31 56.16 1x4k n LYS 12 Cb 0.40 -5.76 -0.01 0.00 -1.84 0.00 0.00 35.03 27.82 1x4k n LYS 12 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 1x4k n LYS 13 N -4.34 1.19 -3.16 1.97 4.76 -1.25 -4.84 118.16 112.49 1x4k n LYS 13 Ca -0.17 -1.82 -0.43 0.00 -2.87 0.00 0.00 58.31 53.02 1x4k n LYS 13 Cb 0.62 0.32 -0.07 0.00 -1.84 0.00 0.00 35.03 34.06 1x4k n LYS 13 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 1x4k s THR 14 N -1.61 4.90 -0.64 -0.18 2.01 -1.26 -0.18 115.64 118.67 1x4k s THR 14 Ca 0.09 0.12 -0.27 0.00 0.31 0.00 0.00 61.69 61.94 1x4k s THR 14 Cb -0.01 -4.14 0.03 0.00 0.01 0.00 0.00 72.50 68.40 1x4k s THR 14 CO 0.06 -0.50 1.21 -0.63 -0.69 0.00 0.00 174.62 174.07 1x4k s ILE 15 N 2.65 3.93 0.50 1.82 1.01 -0.43 -4.91 121.20 125.78 1x4k s ILE 15 Ca 0.21 0.67 -0.22 0.00 0.00 0.00 0.00 60.65 61.31 1x4k s ILE 15 Cb -0.15 -4.79 -0.08 0.00 0.01 0.00 0.00 42.46 37.45 1x4k s ILE 15 CO 0.17 -1.52 1.02 0.23 0.00 0.00 0.00 174.94 174.84 1x4k n MET 16 N 8.72 1.23 0.00 2.79 2.81 -1.26 -4.65 117.12 126.76 1x4k n MET 16 Ca 0.06 0.45 0.08 0.00 -1.81 0.00 0.00 57.70 56.48 1x4k n MET 16 Cb 0.49 -2.14 0.45 0.00 -0.71 0.00 0.00 33.22 31.31 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 -0.35 0.46 -0.03 0.03 -0.04 -1.26 -2.98 135.00 130.82 1x4k n PRO 17 Ca 0.11 0.02 -0.22 0.00 -0.04 0.00 0.00 63.50 63.37 1x4k n PRO 17 Cb 0.43 -1.50 -0.13 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 2.43 0.19 -1.82 0.55 0.00 -2.02 -3.47 103.07 98.93 1x4k h GLY 18 Ca 0.00 -0.49 -0.48 0.00 0.00 0.00 0.00 47.33 46.36 1x4k h GLY 18 CO 0.00 0.43 0.34 -1.08 0.00 0.00 0.00 176.54 176.23 1x4k s THR 19 N -2.47 4.59 0.26 4.70 -1.32 -1.16 -5.05 115.64 115.18 1x4k s THR 19 Ca -0.24 1.10 -0.19 0.00 -1.21 0.00 0.00 61.69 61.15 1x4k s THR 19 Cb 0.06 -3.73 -0.09 0.00 -1.51 0.00 0.00 72.50 67.23 1x4k s THR 19 CO 0.71 -0.70 0.75 -0.13 -2.21 0.00 0.00 174.62 173.03 1x4k s ARG 20 N -4.13 4.23 0.19 7.08 0.52 -1.26 -4.86 118.95 120.72 1x4k s ARG 20 Ca 0.57 0.87 0.01 0.00 -0.52 0.00 0.00 55.73 56.67 1x4k s ARG 20 Cb -0.10 -2.77 -0.05 0.00 0.52 0.00 0.00 34.95 32.56 1x4k s ARG 20 CO 0.33 0.33 0.05 -1.59 0.02 0.00 0.00 175.30 174.44 1x4k s LYS 21 N -2.21 1.18 -0.40 3.54 -2.85 -1.26 -2.82 119.74 114.92 1x4k s LYS 21 Ca 0.46 -1.59 -0.11 0.00 -1.00 0.00 0.00 55.97 53.72 1x4k s LYS 21 Cb -0.15 -0.14 0.04 0.00 -2.06 0.00 0.00 37.83 35.52 1x4k s LYS 21 CO 0.20 -0.22 0.25 -1.64 0.10 0.00 0.00 175.35 174.04 1x4k s MET 22 N -3.99 2.80 -0.40 1.78 -1.94 0.49 -4.89 119.30 113.15 1x4k s MET 22 Ca 0.29 -1.19 -0.25 0.00 -1.71 0.00 0.00 55.69 52.84 1x4k s MET 22 Cb 0.07 -3.81 0.02 0.00 2.01 0.00 0.00 34.83 33.12 1x4k s MET 22 CO 0.07 -0.80 0.87 -1.21 -0.01 0.00 0.00 175.02 173.95 1x4k s GLU 23 N 1.55 3.69 -0.03 2.03 2.02 -1.26 -1.20 118.70 125.50 1x4k s GLU 23 Ca 0.03 0.32 -0.00 0.00 0.02 0.00 0.00 54.97 55.33 1x4k s GLU 23 Cb -0.21 -3.85 0.03 0.00 0.10 0.00 0.00 34.13 30.20 1x4k s GLU 23 CO 0.06 -1.01 0.04 -0.47 0.02 0.00 0.00 175.26 173.90 1x4k s TYR 24 N 3.42 0.01 -1.47 1.61 6.14 0.10 -4.86 117.35 122.31 1x4k s TYR 24 Ca 0.35 0.18 -0.10 0.00 0.64 0.00 0.00 57.07 58.14 1x4k s TYR 24 Cb -0.12 -0.25 0.06 0.00 0.42 0.00 0.00 41.96 42.07 1x4k s TYR 24 CO 0.21 -0.11 0.90 1.17 0.64 0.00 0.00 175.55 178.35 1x4k n LYS 25 N 4.31 -5.32 0.00 4.97 4.81 -1.26 -1.45 118.16 124.23 1x4k n LYS 25 Ca -0.25 0.60 0.00 0.00 -0.87 0.00 0.00 58.31 57.79 1x4k n LYS 25 Cb 0.50 -5.38 0.00 0.00 0.02 0.00 0.00 35.03 30.17 1x4k n LYS 25 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1x4k n GLY 26 N -1.67 1.04 3.83 3.14 0.00 -1.26 -4.95 105.19 105.31 1x4k n GLY 26 Ca -0.06 -0.01 -0.30 0.00 0.00 0.00 0.00 46.02 45.64 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 5.21 0.14 1.61 0.01 -0.53 -5.04 113.70 115.10 1x4k s SER 27 Ca 0.00 1.41 0.07 0.00 1.31 0.00 0.00 55.95 58.74 1x4k s SER 27 Cb 0.00 -2.25 -0.04 0.00 0.21 0.00 0.00 66.02 63.94 1x4k s SER 27 CO 0.00 -1.53 -0.17 -0.44 0.41 0.00 0.00 173.24 171.51 1x4k s SER 28 N -3.97 2.39 -0.04 2.44 0.01 -1.26 0.02 113.70 113.30 1x4k s SER 28 Ca 0.59 -0.82 0.00 0.00 1.31 0.00 0.00 55.95 57.03 1x4k s SER 28 Cb -0.13 -0.12 0.03 0.00 0.21 0.00 0.00 66.02 66.00 1x4k s SER 28 CO 0.54 -0.07 -0.00 0.26 0.41 0.00 0.00 173.24 174.38 1x4k s TRP 29 N -1.97 0.39 0.63 2.43 0.51 -0.34 -1.97 118.94 118.61 1x4k s TRP 29 Ca 0.12 -0.02 -0.17 0.00 -2.12 0.00 0.00 56.10 53.90 1x4k s TRP 29 Cb -0.06 -0.49 -0.11 0.00 -0.81 0.00 0.00 33.47 32.00 1x4k s TRP 29 CO 0.05 -0.16 0.09 0.72 -0.51 0.00 0.00 176.95 177.13 1x4k n HIS 30 N 4.33 -2.20 0.05 -1.98 8.25 -1.26 -0.38 115.22 122.03 1x4k n HIS 30 Ca -0.22 0.37 0.21 0.00 -0.26 0.00 0.00 57.72 57.81 1x4k n HIS 30 Cb 0.50 -1.77 0.64 0.00 1.12 0.00 0.00 29.99 30.48 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 -0.16 0.00 0.00 -0.41 4.11 -1.88 -1.87 114.58 114.37 1x4k h GLU 31 Ca -0.43 0.00 -0.08 0.00 0.07 0.00 0.00 59.36 58.92 1x4k h GLU 31 Cb 1.40 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.64 1x4k h GLU 31 CO 0.41 0.00 -1.19 0.25 0.07 0.00 0.00 179.01 178.55 1x4k n THR 32 N -3.41 1.47 -0.13 -1.06 -2.24 -1.26 -4.34 114.28 103.31 1x4k n THR 32 Ca 0.10 0.07 0.23 0.00 -2.27 0.00 0.00 64.05 62.18 1x4k n THR 32 Cb 0.85 -2.21 0.36 0.00 -2.10 0.00 0.00 70.33 67.23 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 -3.07 0.08 -0.22 0.00 7.35 -0.73 -4.87 117.46 116.00 1x4k n PHE 34 Ca 0.19 -0.39 -0.21 0.00 -0.76 0.00 0.00 57.45 56.29 1x4k n PHE 34 Cb 1.41 -0.22 0.20 0.00 0.35 0.00 0.00 39.48 41.22 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 0.32 0.00 -2.48 -2.13 -6.64 0.35 -4.08 119.36 104.70 1x4k n ILE 35 Ca 0.02 0.00 -0.25 0.00 -1.77 0.00 0.00 62.75 60.75 1x4k n ILE 35 Cb 0.46 -0.67 0.04 0.00 -1.44 0.00 0.00 39.64 38.03 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 -2.55 0.00 -0.06 0.00 8.25 -0.41 -3.16 115.22 117.30 1x4k n HIS 37 Ca 0.05 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.40 1x4k n HIS 37 Cb 0.59 -0.05 -0.04 0.00 1.12 0.00 0.00 29.99 31.61 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 -1.56 0.34 0.02 -0.41 0.63 -1.26 -4.69 116.66 109.74 1x4k n ARG 38 Ca 0.03 0.14 0.12 0.00 -0.92 0.00 0.00 57.85 57.22 1x4k n ARG 38 Cb 0.34 -1.09 0.13 0.00 0.45 0.00 0.00 32.46 32.29 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 -1.81 -6.63 -4.38 0.00 1.13 -1.19 -4.91 117.38 99.58 1x4k n GLN 40 Ca 0.04 0.74 -0.30 0.00 -1.94 0.00 0.00 57.00 55.54 1x4k n GLN 40 Cb 0.40 -5.68 -0.11 0.00 0.11 0.00 0.00 30.24 24.95 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 -6.14 1.91 -1.15 -1.09 -0.21 -1.26 -4.58 119.66 107.14 1x4k s GLN 41 Ca 0.39 -1.10 -0.23 0.00 0.02 0.00 0.00 55.36 54.44 1x4k s GLN 41 Cb -0.18 -2.17 -0.08 0.00 1.00 0.00 0.00 33.01 31.58 1x4k s GLN 41 CO 0.77 0.50 1.94 -1.25 -2.12 0.00 0.00 175.29 175.12 1x4k s PRO 42 N -1.97 2.50 0.20 2.91 0.04 -1.26 0.45 135.00 137.88 1x4k s PRO 42 Ca 0.18 -1.06 -0.17 0.00 0.04 0.00 0.00 61.00 59.98 1x4k s PRO 42 Cb -0.11 -5.22 0.19 0.00 0.04 0.00 0.00 34.50 29.40 1x4k s PRO 42 CO 0.09 -3.91 1.60 0.82 0.04 0.00 0.00 177.00 175.64 1x4k h ILE 43 N 6.31 0.25 0.00 0.56 2.04 -1.86 -3.46 117.51 121.35 1x4k h ILE 43 Ca 0.20 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.06 1x4k h ILE 43 Cb 0.95 0.25 0.00 0.00 -0.74 0.00 0.00 36.82 37.28 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 -1.45 2.76 3.03 5.37 0.00 -1.26 -4.23 105.19 109.41 1x4k n GLY 44 Ca 0.06 -0.29 -0.33 0.00 0.00 0.00 0.00 46.02 45.46 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 3.39 0.30 2.61 -4.23 -1.26 -5.04 115.64 111.40 1x4k s THR 45 Ca 0.00 -3.42 -0.20 0.00 -1.18 0.00 0.00 61.69 56.90 1x4k s THR 45 Cb 0.00 -3.22 0.04 0.00 1.34 0.00 0.00 72.50 70.66 1x4k s THR 45 CO 0.00 -0.91 0.77 -1.59 -0.54 0.00 0.00 174.62 172.35 1x4k s LYS 46 N -0.56 1.88 -0.55 3.99 -2.85 -1.26 -5.09 119.74 115.30 1x4k s LYS 46 Ca 0.20 -1.11 -0.29 0.00 -1.00 0.00 0.00 55.97 53.77 1x4k s LYS 46 Cb -0.17 0.60 -0.11 0.00 -2.06 0.00 0.00 37.83 36.08 1x4k s LYS 46 CO -0.06 -0.87 2.42 0.43 0.10 0.00 0.00 175.35 177.37 1x4k n SER 47 N -0.78 1.91 -3.82 0.03 7.64 -1.26 -4.89 113.62 112.44 1x4k n SER 47 Ca -0.05 -0.11 -0.12 0.00 1.01 0.00 0.00 58.87 59.60 1x4k n SER 47 Cb 0.59 -1.37 -0.11 0.00 -1.01 0.00 0.00 64.21 62.32 1x4k n SER 47 CO 0.00 0.00 0.00 0.72 -3.01 0.00 0.00 175.04 172.75 1x4k s PHE 48 N 10.18 -0.12 -0.49 1.43 -0.71 -1.26 -3.67 117.98 123.34 1x4k s PHE 48 Ca 1.09 0.25 -0.17 0.00 -1.04 0.00 0.00 56.93 57.07 1x4k s PHE 48 Cb -0.57 0.03 0.08 0.00 -1.21 0.00 0.00 43.02 41.34 1x4k s PHE 48 CO 0.37 -0.21 0.48 0.42 -1.34 0.00 0.00 175.22 174.94 1x4k s ILE 49 N -0.62 5.12 -0.13 -4.49 1.09 0.40 -4.94 121.20 117.64 1x4k s ILE 49 Ca -0.07 -0.95 -0.29 0.00 -1.10 0.00 0.00 60.65 58.23 1x4k s ILE 49 Cb -0.04 -4.20 -0.04 0.00 -1.06 0.00 0.00 42.46 37.12 1x4k s ILE 49 CO 0.01 -0.69 1.55 -2.16 -0.10 0.00 0.00 174.94 173.55 1x4k s PRO 50 N 1.93 4.08 0.33 2.79 0.04 -1.26 -2.27 135.00 140.65 1x4k s PRO 50 Ca 0.07 1.91 -0.11 0.00 0.04 0.00 0.00 61.00 62.91 1x4k s PRO 50 Cb -0.23 -3.95 -0.07 0.00 0.04 0.00 0.00 34.50 30.29 1x4k s PRO 50 CO 0.08 -0.94 0.69 0.21 0.04 0.00 0.00 177.00 177.07 1x4k s LYS 51 N 4.09 3.83 0.02 4.56 2.47 0.30 -4.97 119.74 130.04 1x4k s LYS 51 Ca 0.68 0.42 -0.04 0.00 -1.56 0.00 0.00 55.97 55.48 1x4k s LYS 51 Cb -0.28 -2.49 -0.01 0.00 -1.46 0.00 0.00 37.83 33.59 1x4k s LYS 51 CO 0.26 0.12 0.64 -0.25 0.16 0.00 0.00 175.35 176.28 1x4k n ASP 52 N -0.75 -0.13 -0.55 1.43 8.00 -1.26 -1.67 116.55 121.61 1x4k n ASP 52 Ca 0.02 0.67 0.06 0.00 0.71 0.00 0.00 54.79 56.25 1x4k n ASP 52 Cb 0.53 -0.25 0.20 0.00 -0.02 0.00 0.00 41.12 41.58 1x4k n ASP 52 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1x4k n ASN 53 N -3.05 1.81 -3.30 -2.24 5.15 -1.26 -5.04 115.26 107.34 1x4k n ASN 53 Ca 0.00 -3.81 -0.11 0.00 -0.60 0.00 0.00 54.58 50.06 1x4k n ASN 53 Cb 0.03 -0.52 -0.02 0.00 -0.53 0.00 0.00 39.78 38.74 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 -3.20 1.95 -0.03 1.20 -0.21 -0.67 -5.17 119.66 113.53 1x4k s GLN 54 Ca 0.37 -1.52 -0.01 0.00 0.02 0.00 0.00 55.36 54.23 1x4k s GLN 54 Cb 0.36 0.52 0.03 0.00 1.00 0.00 0.00 33.01 34.92 1x4k s GLN 54 CO -0.06 -0.86 0.02 -0.80 -2.12 0.00 0.00 175.29 171.48 1x4k s ASN 55 N -3.12 0.64 -0.02 5.90 0.01 -1.26 0.11 114.94 117.19 1x4k s ASN 55 Ca 0.23 0.01 0.02 0.00 -0.71 0.00 0.00 52.86 52.41 1x4k s ASN 55 Cb -0.02 -0.18 0.01 0.00 0.41 0.00 0.00 41.25 41.46 1x4k s ASN 55 CO 0.15 -0.16 -0.06 -0.36 -1.51 0.00 0.00 177.10 175.16 1x4k s PHE 56 N 1.44 0.67 1.06 2.20 0.40 -0.96 -1.28 117.98 121.50 1x4k s PHE 56 Ca -0.04 -0.15 -0.18 0.00 -0.60 0.00 0.00 56.93 55.96 1x4k s PHE 56 Cb -0.13 -0.52 0.27 0.00 0.51 0.00 0.00 43.02 43.15 1x4k s PHE 56 CO -0.03 -0.10 0.79 0.00 0.70 0.00 0.00 175.22 176.59 1x4k h VAL 58 N -2.83 1.17 0.00 0.00 2.07 -1.92 0.32 116.25 115.06 1x4k h VAL 58 Ca -0.32 -0.65 -0.05 0.00 0.82 0.00 0.00 66.70 66.50 1x4k h VAL 58 Cb 1.02 1.60 -0.01 0.00 -1.52 0.00 0.00 31.29 32.38 1x4k h VAL 58 CO 0.20 0.17 -0.26 1.55 0.02 0.00 0.00 177.57 179.25 1x4k h PRO 59 N -0.33 0.00 0.00 1.57 0.13 -1.92 -2.44 132.00 129.01 1x4k h PRO 59 Ca -0.00 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.09 1x4k h PRO 59 Cb 0.31 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.43 1x4k h PRO 59 CO 0.01 0.26 -0.34 0.00 -0.23 0.00 0.00 178.00 177.70 1x4k h TYR 61 N -1.00 0.08 -0.91 0.00 3.20 -0.44 -0.36 116.97 117.54 1x4k h TYR 61 Ca -0.05 0.04 0.14 0.00 3.14 0.00 0.00 58.73 62.00 1x4k h TYR 61 Cb 0.50 0.05 -0.09 0.00 1.54 0.00 0.00 36.73 38.73 1x4k h TYR 61 CO -0.01 -0.07 0.52 0.93 -1.64 0.00 0.00 178.16 177.89 1x4k h GLU 62 N 0.19 0.75 -0.56 1.82 5.08 -1.61 -1.09 114.58 119.16 1x4k h GLU 62 Ca 0.28 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.58 1x4k h GLU 62 Cb 0.43 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 29.48 1x4k h GLU 62 CO -0.41 0.50 0.29 0.87 -1.00 0.00 0.00 179.01 179.26 1x4k h LYS 63 N 0.78 0.78 -0.71 2.33 1.57 -1.14 0.27 116.57 120.45 1x4k h LYS 63 Ca 0.48 -0.10 0.16 0.00 -1.87 0.00 0.00 60.65 59.32 1x4k h LYS 63 Cb 0.59 -0.15 -0.12 0.00 0.08 0.00 0.00 32.23 32.63 1x4k h LYS 63 CO -0.32 0.62 0.03 1.96 -0.57 0.00 0.00 179.45 181.17 1x4k h GLN 64 N 0.75 0.13 0.00 3.15 4.20 -0.64 -2.95 115.11 119.75 1x4k h GLN 64 Ca 0.19 -0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.89 1x4k h GLN 64 Cb 0.07 -0.03 -0.00 0.00 0.30 0.00 0.00 27.48 27.82 1x4k h GLN 64 CO -0.03 0.09 -0.08 1.25 -0.67 0.00 0.00 178.83 179.38 1x4k h HIS 65 N 0.13 0.00 -1.67 2.96 2.76 -1.39 -3.44 115.15 114.50 1x4k h HIS 65 Ca 0.39 0.00 -0.60 0.00 -2.20 0.00 0.00 60.37 57.96 1x4k h HIS 65 Cb 0.67 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 29.62 1x4k h HIS 65 CO -0.38 0.34 1.50 0.00 -1.30 0.00 0.00 177.93 178.09 1x4k n ALA 66 N -2.82 1.47 -0.06 5.26 0.00 0.92 -4.77 120.51 120.51 1x4k n ALA 66 Ca -0.05 -0.28 -0.13 0.00 0.00 0.00 0.00 53.44 52.98 1x4k n ALA 66 Cb 0.18 -2.85 -0.04 0.00 0.00 0.00 0.00 19.45 16.74 1x4k n ALA 66 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1x4k n SER 67 N 11.72 0.89 0.02 0.00 2.88 -1.22 -4.09 113.62 123.83 1x4k n SER 67 Ca 0.34 0.15 -0.16 0.00 -1.33 0.00 0.00 58.87 57.88 1x4k n SER 67 Cb 0.40 -0.37 -0.10 0.00 -0.75 0.00 0.00 64.21 63.39 1x4k n SER 67 CO 0.00 0.00 0.00 1.23 -1.23 0.00 0.00 175.04 175.04 1x4k h GLY 68 N -0.44 -1.11 0.98 0.46 0.00 -1.97 -2.82 103.07 98.17 1x4k h GLY 68 Ca -0.32 0.67 -0.12 0.00 0.00 0.00 0.00 47.33 47.57 1x4k h GLY 68 CO -0.19 -0.21 -0.29 -0.56 0.00 0.00 0.00 176.54 175.28 1x4k h PRO 69 N -0.63 0.71 -4.09 4.80 0.13 -1.98 -3.42 132.00 127.53 1x4k h PRO 69 Ca 0.02 -0.38 -0.57 0.00 -0.87 0.00 0.00 66.00 64.20 1x4k h PRO 69 Cb 0.70 0.01 -0.39 0.00 0.13 0.00 0.00 31.00 31.46 1x4k h PRO 69 CO -0.40 0.99 -0.78 -1.12 -0.23 0.00 0.00 178.00 176.46 1x4k s SER 70 N -6.56 3.43 0.12 1.44 0.01 -1.10 -5.10 113.70 105.93 1x4k s SER 70 Ca -0.12 -1.00 -0.31 0.00 1.31 0.00 0.00 55.95 55.83 1x4k s SER 70 Cb 0.09 -0.97 -0.10 0.00 0.21 0.00 0.00 66.02 65.25 1x4k s SER 70 CO 0.83 -0.25 1.80 -0.44 0.41 0.00 0.00 173.24 175.59 1x4k s SER 71 N 1.57 6.45 0.00 2.44 0.01 -1.08 -3.38 113.70 119.70 1x4k s SER 71 Ca -0.03 2.71 0.00 0.00 1.31 0.00 0.00 55.95 59.94 1x4k s SER 71 Cb -0.18 -2.57 0.00 0.00 0.21 0.00 0.00 66.02 63.49 1x4k s SER 71 CO -0.07 -0.98 0.00 0.61 0.41 0.00 0.00 173.24 173.21