#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kzv s LYS 3 N 0.00 4.46 -0.28 1.61 -0.14 -1.26 -4.81 119.74 119.32 3kzv s LYS 3 Ca 0.00 1.62 -0.10 0.00 -1.36 0.00 0.00 55.97 56.13 3kzv s LYS 3 Cb 0.00 -2.90 -0.04 0.00 -1.68 0.00 0.00 37.83 33.21 3kzv s LYS 3 CO 0.00 0.10 0.16 0.08 -0.76 0.00 0.00 175.35 174.93 3kzv s VAL 4 N -1.40 4.97 -0.10 3.17 1.01 -1.26 -1.51 120.40 125.28 3kzv s VAL 4 Ca 0.50 -0.03 0.02 0.00 0.00 0.00 0.00 61.98 62.47 3kzv s VAL 4 Cb -0.26 -3.40 0.01 0.00 0.00 0.00 0.00 36.38 32.73 3kzv s VAL 4 CO 0.33 0.22 -0.17 -0.63 0.00 0.00 0.00 175.10 174.86 3kzv s ILE 5 N 1.70 1.57 0.02 2.22 1.01 0.25 -0.06 121.20 127.90 3kzv s ILE 5 Ca 0.06 -0.70 -0.14 0.00 0.00 0.00 0.00 60.65 59.87 3kzv s ILE 5 Cb -0.16 -1.41 -0.06 0.00 0.01 0.00 0.00 42.46 40.84 3kzv s ILE 5 CO 0.09 0.45 0.42 -0.76 0.00 0.00 0.00 174.94 175.14 3kzv s LEU 6 N 0.81 4.45 -0.04 2.97 1.02 -0.33 -1.45 118.68 126.11 3kzv s LEU 6 Ca -0.10 0.95 -0.00 0.00 0.02 0.00 0.00 54.13 55.00 3kzv s LEU 6 Cb -0.16 -2.69 0.03 0.00 0.02 0.00 0.00 46.19 43.39 3kzv s LEU 6 CO 0.01 0.29 0.00 -0.69 0.02 0.00 0.00 176.35 175.98 3kzv s VAL 7 N -1.15 0.21 0.36 -1.59 1.01 -0.45 -0.18 120.40 118.61 3kzv s VAL 7 Ca 0.26 0.11 0.07 0.00 0.00 0.00 0.00 61.98 62.43 3kzv s VAL 7 Cb -0.16 -0.33 -0.02 0.00 0.00 0.00 0.00 36.38 35.87 3kzv s VAL 7 CO 0.15 0.18 0.35 0.42 0.00 0.00 0.00 175.10 176.19 3kzv s THR 8 N 1.31 3.37 -1.37 3.92 -4.23 -1.02 -2.27 115.64 115.35 3kzv s THR 8 Ca -0.06 -1.30 -0.05 0.00 -1.18 0.00 0.00 61.69 59.10 3kzv s THR 8 Cb -0.13 -3.16 0.01 0.00 1.34 0.00 0.00 72.50 70.55 3kzv s THR 8 CO -0.02 -0.12 0.61 0.61 -0.54 0.00 0.00 174.62 175.15 3kzv n GLY 9 N -1.47 -0.39 0.19 3.99 0.00 -1.13 -4.37 105.19 102.02 3kzv n GLY 9 Ca 0.00 0.04 0.14 0.00 0.00 0.00 0.00 46.02 46.21 3kzv n GLY 9 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3kzv n VAL 10 N -4.43 0.00 -0.02 1.61 0.24 -1.16 -4.11 118.33 110.46 3kzv n VAL 10 Ca -0.09 -0.10 -0.06 0.00 -2.04 0.00 0.00 64.34 62.05 3kzv n VAL 10 Cb 0.60 0.05 0.15 0.00 -1.47 0.00 0.00 33.84 33.17 3kzv n VAL 10 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 3kzv h SER 11 N 0.96 0.61 -5.39 -1.34 4.64 -1.91 -3.22 113.55 107.90 3kzv h SER 11 Ca 0.00 -0.22 -0.15 0.00 -0.47 0.00 0.00 61.79 60.95 3kzv h SER 11 Cb 0.36 -0.17 -0.13 0.00 -0.31 0.00 0.00 62.40 62.15 3kzv h SER 11 CO 0.00 0.85 -0.47 -0.13 -0.87 0.00 0.00 176.83 176.22 3kzv s ARG 12 N -4.49 1.14 4.41 4.77 3.00 -1.26 -4.84 118.95 121.67 3kzv s ARG 12 Ca -0.08 -1.37 0.00 0.00 0.00 0.00 0.00 55.73 54.28 3kzv s ARG 12 Cb 0.13 0.32 0.00 0.00 0.00 0.00 0.00 34.95 35.40 3kzv s ARG 12 CO 0.81 -0.39 0.00 0.41 0.00 0.00 0.00 175.30 176.13 3kzv n GLY 13 N -0.21 1.38 0.23 -3.53 0.00 -1.26 -3.23 105.19 98.57 3kzv n GLY 13 Ca -0.04 -0.59 -0.01 0.00 0.00 0.00 0.00 46.02 45.38 3kzv n GLY 13 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3kzv h ILE 14 N 0.00 1.23 -0.96 -0.61 -0.00 -1.90 -2.32 117.51 112.94 3kzv h ILE 14 Ca 0.00 -1.07 0.02 0.00 -0.00 0.00 0.00 64.86 63.80 3kzv h ILE 14 Cb 0.00 1.31 -0.05 0.00 -0.00 0.00 0.00 36.82 38.08 3kzv h ILE 14 CO 0.00 0.34 0.64 1.23 -0.00 0.00 0.00 178.15 180.35 3kzv h GLY 15 N 0.94 1.37 0.97 8.18 0.00 -1.70 -0.55 103.07 112.28 3kzv h GLY 15 Ca 0.05 -0.50 -0.06 0.00 0.00 0.00 0.00 47.33 46.83 3kzv h GLY 15 CO 0.04 0.48 0.07 1.70 0.00 0.00 0.00 176.54 178.83 3kzv h LYS 16 N 1.29 0.78 -0.75 4.80 3.64 -1.42 -2.62 116.57 122.28 3kzv h LYS 16 Ca 0.36 -0.21 -0.05 0.00 -1.27 0.00 0.00 60.65 59.48 3kzv h LYS 16 Cb -0.11 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 31.58 3kzv h LYS 16 CO -0.09 0.79 0.29 0.77 -2.27 0.00 0.00 179.45 178.94 3kzv h SER 17 N 0.65 1.04 -0.72 4.20 0.02 -0.97 -1.73 113.55 116.03 3kzv h SER 17 Ca 0.14 -0.18 0.01 0.00 -0.84 0.00 0.00 61.79 60.92 3kzv h SER 17 Cb 0.39 -0.27 -0.04 0.00 0.14 0.00 0.00 62.40 62.62 3kzv h SER 17 CO 0.01 0.94 0.48 0.40 -1.14 0.00 0.00 176.83 177.52 3kzv h ILE 18 N 1.08 1.19 -0.42 3.27 2.04 -1.03 0.72 117.51 124.37 3kzv h ILE 18 Ca 0.25 -0.34 0.01 0.00 1.00 0.00 0.00 64.86 65.78 3kzv h ILE 18 Cb 0.23 0.12 -0.03 0.00 -0.74 0.00 0.00 36.82 36.41 3kzv h ILE 18 CO -0.02 0.18 0.25 0.58 0.00 0.00 0.00 178.15 179.15 3kzv h VAL 19 N 0.98 1.06 -0.64 1.67 2.07 -1.06 0.29 116.25 120.61 3kzv h VAL 19 Ca 0.27 -0.18 0.01 0.00 0.82 0.00 0.00 66.70 67.61 3kzv h VAL 19 Cb -0.11 0.50 -0.03 0.00 -1.52 0.00 0.00 31.29 30.12 3kzv h VAL 19 CO -0.06 0.09 0.42 0.44 0.02 0.00 0.00 177.57 178.49 3kzv h ASP 20 N 0.52 0.74 -0.33 0.57 3.32 -0.81 -2.37 116.42 118.07 3kzv h ASP 20 Ca 0.16 -0.02 -0.08 0.00 0.02 0.00 0.00 57.03 57.11 3kzv h ASP 20 Cb -0.01 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.34 3kzv h ASP 20 CO -0.06 0.55 -0.09 0.58 -1.72 0.00 0.00 179.24 178.49 3kzv h VAL 21 N 0.87 1.28 -0.71 -1.35 2.07 -0.62 -2.47 116.25 115.33 3kzv h VAL 21 Ca 0.24 -1.15 0.12 0.00 0.82 0.00 0.00 66.70 66.73 3kzv h VAL 21 Cb -0.09 1.35 -0.09 0.00 -1.52 0.00 0.00 31.29 30.95 3kzv h VAL 21 CO -0.05 0.37 0.28 -0.07 0.02 0.00 0.00 177.57 178.12 3kzv h LEU 22 N 0.41 0.28 -0.73 2.57 3.38 -0.49 -1.72 115.31 119.02 3kzv h LEU 22 Ca 0.08 0.09 -0.14 0.00 0.09 0.00 0.00 57.88 58.01 3kzv h LEU 22 Cb 0.59 0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.40 3kzv h LEU 22 CO 0.03 0.13 -0.58 -0.26 0.09 0.00 0.00 178.44 177.86 3kzv h PHE 23 N 0.45 0.23 0.00 1.13 0.04 -1.30 -2.59 116.94 114.90 3kzv h PHE 23 Ca 0.37 -0.09 0.00 0.00 2.80 0.00 0.00 57.97 61.06 3kzv h PHE 23 Cb 0.52 -0.04 0.00 0.00 2.20 0.00 0.00 35.95 38.63 3kzv h PHE 23 CO -0.16 0.72 0.00 0.66 -0.60 0.00 0.00 178.31 178.92 3kzv h SER 24 N 0.14 0.00 0.70 2.17 4.64 -0.89 -3.29 113.55 117.01 3kzv h SER 24 Ca -0.00 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.13 3kzv h SER 24 Cb 1.06 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.12 3kzv h SER 24 CO 0.09 0.00 -1.42 -0.07 -0.87 0.00 0.00 176.83 174.55 3kzv h LEU 25 N 0.00 0.00 -7.33 5.97 3.38 -0.93 -3.47 115.31 112.93 3kzv h LEU 25 Ca 0.00 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.82 3kzv h LEU 25 Cb 0.60 0.00 -0.27 0.00 0.09 0.00 0.00 40.66 41.08 3kzv h LEU 25 CO 0.00 0.64 -0.37 -0.62 0.09 0.00 0.00 178.44 178.18 3kzv s ASP 26 N -5.85 -0.37 0.22 -0.43 2.15 -1.20 -5.05 116.67 106.14 3kzv s ASP 26 Ca -0.03 0.68 0.25 0.00 0.43 0.00 0.00 52.55 53.89 3kzv s ASP 26 Cb 0.09 0.62 0.60 0.00 -0.30 0.00 0.00 42.92 43.93 3kzv s ASP 26 CO 0.81 -0.15 1.62 0.11 -0.17 0.00 0.00 175.17 177.39 3kzv h LYS 27 N 6.53 0.00 0.00 4.34 1.57 -1.89 -3.39 116.57 123.72 3kzv h LYS 27 Ca -0.34 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.29 3kzv h LYS 27 Cb 1.18 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.46 3kzv h LYS 27 CO 0.32 0.00 -1.77 -0.25 -0.57 0.00 0.00 179.45 177.18 3kzv n ASP 28 N -2.37 0.40 -4.71 0.86 10.43 -1.26 -5.01 116.55 114.90 3kzv n ASP 28 Ca 0.05 0.17 -0.42 0.00 2.57 0.00 0.00 54.79 57.15 3kzv n ASP 28 Cb 0.45 0.92 -0.01 0.00 1.84 0.00 0.00 41.12 44.33 3kzv n ASP 28 CO 0.00 0.00 0.00 0.41 -1.07 0.00 0.00 177.20 176.54 3kzv n THR 29 N -2.65 1.80 -5.02 -3.53 -1.04 -1.26 -4.17 114.28 98.41 3kzv n THR 29 Ca -0.13 -0.45 -0.32 0.00 -2.04 0.00 0.00 64.05 61.11 3kzv n THR 29 Cb 0.81 -1.66 -0.14 0.00 -1.82 0.00 0.00 70.33 67.51 3kzv n THR 29 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 3kzv s VAL 30 N -0.89 2.70 -0.08 12.58 1.01 -0.57 -4.90 120.40 130.25 3kzv s VAL 30 Ca 0.57 -0.85 0.04 0.00 0.00 0.00 0.00 61.98 61.75 3kzv s VAL 30 Cb -0.56 -2.04 -0.00 0.00 0.00 0.00 0.00 36.38 33.79 3kzv s VAL 30 CO 0.60 0.58 -0.22 -0.69 0.00 0.00 0.00 175.10 175.36 3kzv s VAL 31 N -0.47 1.91 -0.32 2.92 1.01 -0.56 -0.59 120.40 124.30 3kzv s VAL 31 Ca 0.06 -0.95 -0.09 0.00 0.00 0.00 0.00 61.98 61.00 3kzv s VAL 31 Cb -0.12 -1.65 0.01 0.00 0.00 0.00 0.00 36.38 34.62 3kzv s VAL 31 CO 0.01 0.53 0.14 -0.31 0.00 0.00 0.00 175.10 175.47 3kzv s TYR 32 N 0.24 3.19 0.38 5.22 2.02 -0.53 -1.52 117.35 126.35 3kzv s TYR 32 Ca -0.14 -0.84 0.08 0.00 -0.37 0.00 0.00 57.07 55.79 3kzv s TYR 32 Cb -0.16 -2.34 -0.04 0.00 -0.40 0.00 0.00 41.96 39.02 3kzv s TYR 32 CO 0.07 -0.56 0.24 0.20 -1.57 0.00 0.00 175.55 173.94 3kzv s GLY 33 N 1.55 2.08 0.01 0.71 0.00 0.00 -1.34 107.32 110.33 3kzv s GLY 33 Ca 0.03 -1.89 -0.01 0.00 0.00 0.00 0.00 44.72 42.85 3kzv s GLY 33 CO 0.05 -1.75 -0.00 0.54 0.00 0.00 0.00 173.10 171.93 3kzv s VAL 34 N -2.47 0.07 0.20 1.40 0.11 -0.96 -1.95 120.40 116.81 3kzv s VAL 34 Ca 0.42 -0.62 -0.16 0.00 -2.93 0.00 0.00 61.98 58.70 3kzv s VAL 34 Cb -0.02 -0.20 0.02 0.00 -1.53 0.00 0.00 36.38 34.65 3kzv s VAL 34 CO 0.25 -0.34 0.49 0.00 -3.33 0.00 0.00 175.10 172.17 3kzv s ALA 35 N -1.00 -0.69 0.17 1.54 0.00 -1.23 -2.84 121.76 117.71 3kzv s ALA 35 Ca -0.11 -0.44 0.08 0.00 0.00 0.00 0.00 51.96 51.49 3kzv s ALA 35 Cb -0.07 0.89 -0.00 0.00 0.00 0.00 0.00 23.12 23.93 3kzv s ALA 35 CO -0.00 -0.80 1.40 0.00 0.00 0.00 0.00 175.76 176.35 3kzv h ARG 36 N 2.25 0.02 -5.38 0.00 3.08 -1.90 -1.31 114.38 111.14 3kzv h ARG 36 Ca -0.28 -0.02 -0.60 0.00 0.07 0.00 0.00 59.98 59.15 3kzv h ARG 36 Cb 1.25 0.01 -0.11 0.00 0.08 0.00 0.00 29.97 31.20 3kzv h ARG 36 CO 0.38 0.87 -0.43 0.45 -1.07 0.00 0.00 179.97 180.17 3kzv s SER 37 N -6.78 6.31 0.23 7.04 0.15 -1.26 -4.27 113.70 115.12 3kzv s SER 37 Ca -0.00 0.35 0.06 0.00 0.70 0.00 0.00 55.95 57.06 3kzv s SER 37 Cb 0.11 -2.12 0.24 0.00 -1.71 0.00 0.00 66.02 62.53 3kzv s SER 37 CO 0.80 0.17 1.54 -0.08 1.20 0.00 0.00 173.24 176.87 3kzv h GLU 38 N 6.54 0.15 -0.42 5.44 4.81 -1.99 -3.36 114.58 125.75 3kzv h GLU 38 Ca -0.42 -0.11 0.08 0.00 -0.13 0.00 0.00 59.36 58.77 3kzv h GLU 38 Cb 1.16 0.02 -0.09 0.00 0.63 0.00 0.00 28.75 30.47 3kzv h GLU 38 CO 0.75 0.75 -0.35 0.00 -0.73 0.00 0.00 179.01 179.42 3kzv h ALA 39 N 1.22 -0.23 0.00 2.92 0.00 -2.00 -0.73 119.26 120.44 3kzv h ALA 39 Ca -0.01 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.00 3kzv h ALA 39 Cb 1.17 0.76 0.00 0.00 0.00 0.00 0.00 17.79 19.73 3kzv h ALA 39 CO 0.10 -0.76 0.00 -1.00 0.00 0.00 0.00 179.25 177.59 3kzv h PRO 40 N -0.26 0.00 -0.24 0.00 0.13 -1.92 -2.20 132.00 127.51 3kzv h PRO 40 Ca 0.17 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 65.23 3kzv h PRO 40 Cb 0.55 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.68 3kzv h PRO 40 CO -0.57 0.00 -0.13 -0.07 -0.23 0.00 0.00 178.00 177.00 3kzv h LEU 41 N 0.00 0.53 -0.70 1.56 3.38 -1.46 -1.89 115.31 116.73 3kzv h LEU 41 Ca 0.00 -0.42 0.07 0.00 0.09 0.00 0.00 57.88 57.62 3kzv h LEU 41 Cb 0.76 -0.15 -0.06 0.00 0.09 0.00 0.00 40.66 41.30 3kzv h LEU 41 CO 0.00 0.84 0.39 0.11 0.09 0.00 0.00 178.44 179.87 3kzv h LYS 42 N 0.23 0.69 -0.65 1.13 1.57 -0.92 0.16 116.57 118.78 3kzv h LYS 42 Ca 0.05 -0.04 -0.06 0.00 -1.87 0.00 0.00 60.65 58.73 3kzv h LYS 42 Cb 0.64 -0.16 -0.03 0.00 0.08 0.00 0.00 32.23 32.77 3kzv h LYS 42 CO 0.04 0.46 0.15 0.87 -0.57 0.00 0.00 179.45 180.40 3kzv h LYS 43 N 0.72 1.03 -0.48 3.15 1.57 -1.35 0.22 116.57 121.43 3kzv h LYS 43 Ca 0.32 -0.24 -0.06 0.00 -1.87 0.00 0.00 60.65 58.80 3kzv h LYS 43 Cb 0.22 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.37 3kzv h LYS 43 CO -0.20 0.91 0.07 -0.07 -0.57 0.00 0.00 179.45 179.59 3kzv h LEU 44 N 0.98 0.77 -0.52 2.94 3.38 -0.92 -2.26 115.31 119.67 3kzv h LEU 44 Ca 0.21 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 3kzv h LEU 44 Cb 0.35 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 3kzv h LEU 44 CO 0.00 0.84 0.28 0.50 0.09 0.00 0.00 178.44 180.15 3kzv h LYS 45 N 0.67 0.73 0.00 1.13 1.63 -0.06 -1.33 116.57 119.34 3kzv h LYS 45 Ca 0.14 -0.09 -0.02 0.00 -0.85 0.00 0.00 60.65 59.83 3kzv h LYS 45 Cb 0.41 -0.14 -0.00 0.00 -0.60 0.00 0.00 32.23 31.90 3kzv h LYS 45 CO 0.01 0.58 -0.08 0.93 -3.45 0.00 0.00 179.45 177.44 3kzv h GLU 46 N 0.70 0.00 0.20 1.90 5.08 -0.53 0.35 114.58 122.27 3kzv h GLU 46 Ca 0.18 0.00 -0.32 0.00 -1.00 0.00 0.00 59.36 58.22 3kzv h GLU 46 Cb 0.07 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.33 3kzv h GLU 46 CO -0.03 0.08 -1.55 -0.22 -1.00 0.00 0.00 179.01 176.29 3kzv h LYS 47 N 0.00 0.41 -0.00 2.33 3.64 -1.07 -3.39 116.57 118.49 3kzv h LYS 47 Ca -0.00 -0.71 0.00 0.00 -1.27 0.00 0.00 60.65 58.67 3kzv h LYS 47 Cb 0.15 0.26 0.00 0.00 -0.41 0.00 0.00 32.23 32.23 3kzv h LYS 47 CO 0.01 1.34 -0.59 0.66 -2.27 0.00 0.00 179.45 178.59 3kzv n TYR 48 N -3.72 0.00 -4.86 1.91 4.01 -0.53 -5.07 117.16 108.90 3kzv n TYR 48 Ca -0.22 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.52 3kzv n TYR 48 Cb 1.04 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 40.07 3kzv n TYR 48 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3kzv n GLY 49 N 1.29 2.54 0.73 2.72 0.00 0.12 -2.79 105.19 109.80 3kzv n GLY 49 Ca 0.03 -0.46 0.01 0.00 0.00 0.00 0.00 46.02 45.60 3kzv n GLY 49 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3kzv n ASP 50 N 1.23 1.76 0.15 1.61 8.00 -1.26 -1.25 116.55 126.79 3kzv n ASP 50 Ca 0.00 -2.13 0.12 0.00 0.71 0.00 0.00 54.79 53.49 3kzv n ASP 50 Cb 0.00 -0.53 0.08 0.00 -0.02 0.00 0.00 41.12 40.66 3kzv n ASP 50 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 3kzv h ARG 51 N 0.50 0.00 -5.80 -1.24 3.08 -1.86 -3.48 114.38 105.58 3kzv h ARG 51 Ca 0.01 0.00 -0.63 0.00 0.07 0.00 0.00 59.98 59.43 3kzv h ARG 51 Cb 0.74 0.00 -0.31 0.00 0.08 0.00 0.00 29.97 30.49 3kzv h ARG 51 CO 0.07 0.00 -0.86 0.12 -1.07 0.00 0.00 179.97 178.23 3kzv s PHE 52 N -3.29 2.04 0.04 3.04 5.36 -0.38 -1.49 117.98 123.30 3kzv s PHE 52 Ca 0.03 -0.54 0.02 0.00 -0.96 0.00 0.00 56.93 55.48 3kzv s PHE 52 Cb 0.08 -1.34 -0.02 0.00 -0.34 0.00 0.00 43.02 41.39 3kzv s PHE 52 CO 0.74 -0.15 -0.08 -0.06 -1.46 0.00 0.00 175.22 174.21 3kzv s PHE 53 N -0.19 0.67 0.07 10.12 0.08 -0.58 -4.81 117.98 123.33 3kzv s PHE 53 Ca -0.00 -0.51 -0.04 0.00 0.12 0.00 0.00 56.93 56.50 3kzv s PHE 53 Cb -0.11 -0.40 -0.02 0.00 -0.57 0.00 0.00 43.02 41.91 3kzv s PHE 53 CO 0.02 -0.09 0.06 1.52 -0.10 0.00 0.00 175.22 176.63 3kzv s TYR 54 N -1.43 0.37 -0.06 0.36 -0.85 -1.26 -0.82 117.35 113.67 3kzv s TYR 54 Ca -0.10 -0.87 0.05 0.00 -0.52 0.00 0.00 57.07 55.64 3kzv s TYR 54 Cb -0.10 -0.25 -0.02 0.00 0.38 0.00 0.00 41.96 41.98 3kzv s TYR 54 CO 0.00 -0.45 -0.22 0.08 -1.52 0.00 0.00 175.55 173.44 3kzv s VAL 55 N -3.90 2.32 -0.17 -3.49 1.01 -0.82 -4.95 120.40 110.40 3kzv s VAL 55 Ca 0.06 -0.98 -0.16 0.00 0.00 0.00 0.00 61.98 60.91 3kzv s VAL 55 Cb 0.07 -1.86 -0.04 0.00 0.00 0.00 0.00 36.38 34.54 3kzv s VAL 55 CO -0.10 0.57 0.39 -0.69 0.00 0.00 0.00 175.10 175.26 3kzv s VAL 56 N -0.30 5.23 -5.00 2.92 1.01 -1.26 -3.49 120.40 119.50 3kzv s VAL 56 Ca 0.01 0.71 0.00 0.00 0.00 0.00 0.00 61.98 62.70 3kzv s VAL 56 Cb -0.13 -3.72 0.00 0.00 0.00 0.00 0.00 36.38 32.53 3kzv s VAL 56 CO 0.02 0.30 0.00 0.61 0.00 0.00 0.00 175.10 176.04 3kzv n GLY 57 N 3.66 -1.89 3.60 4.51 0.00 -0.49 -4.99 105.19 109.58 3kzv n GLY 57 Ca -0.09 -1.41 -0.41 0.00 0.00 0.00 0.00 46.02 44.11 3kzv n GLY 57 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3kzv s ASP 58 N -1.21 6.44 0.00 1.61 -1.08 -1.26 -3.38 116.67 117.78 3kzv s ASP 58 Ca 0.00 0.39 0.19 0.00 -0.52 0.00 0.00 52.55 52.60 3kzv s ASP 58 Cb 0.00 -2.30 1.11 0.00 -1.46 0.00 0.00 42.92 40.27 3kzv s ASP 58 CO 0.00 -0.41 1.52 2.30 0.52 0.00 0.00 175.17 179.10 3kzv n ILE 59 N 5.31 0.03 1.13 4.11 -5.35 -1.26 -0.32 119.36 123.00 3kzv n ILE 59 Ca -0.03 0.01 0.13 0.00 -0.27 0.00 0.00 62.75 62.59 3kzv n ILE 59 Cb 0.49 -0.71 0.63 0.00 -1.74 0.00 0.00 39.64 38.30 3kzv n ILE 59 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 3kzv n THR 60 N -1.02 0.18 -3.04 7.28 -2.24 -1.26 -4.54 114.28 109.64 3kzv n THR 60 Ca 0.14 0.04 -0.42 0.00 -2.27 0.00 0.00 64.05 61.55 3kzv n THR 60 Cb 0.07 -0.61 -0.06 0.00 -2.10 0.00 0.00 70.33 67.63 3kzv n THR 60 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3kzv s GLU 61 N -2.72 3.86 0.48 -0.78 2.02 0.56 -4.97 118.70 117.15 3kzv s GLU 61 Ca 0.21 0.34 0.15 0.00 0.02 0.00 0.00 54.97 55.69 3kzv s GLU 61 Cb 0.17 -3.75 1.15 0.00 0.10 0.00 0.00 34.13 31.80 3kzv s GLU 61 CO 0.42 -0.66 2.07 -0.44 0.02 0.00 0.00 175.26 176.67 3kzv h ASP 62 N 8.25 0.18 -0.41 -0.19 3.32 -1.86 -1.86 116.42 123.86 3kzv h ASP 62 Ca -0.26 -0.00 -0.03 0.00 0.02 0.00 0.00 57.03 56.77 3kzv h ASP 62 Cb 1.11 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 40.59 3kzv h ASP 62 CO 0.84 0.12 0.18 0.77 -1.72 0.00 0.00 179.24 179.44 3kzv h SER 63 N 0.21 0.60 -0.39 6.45 4.64 -1.93 -0.06 113.55 123.06 3kzv h SER 63 Ca 0.13 -0.07 -0.11 0.00 -0.47 0.00 0.00 61.79 61.28 3kzv h SER 63 Cb 0.27 -0.15 -0.01 0.00 -0.31 0.00 0.00 62.40 62.19 3kzv h SER 63 CO -0.02 0.55 -0.18 0.58 -0.87 0.00 0.00 176.83 176.88 3kzv h VAL 64 N 0.65 1.28 -0.19 0.95 2.07 -1.62 -0.93 116.25 118.47 3kzv h VAL 64 Ca 0.16 -1.31 -0.00 0.00 0.82 0.00 0.00 66.70 66.37 3kzv h VAL 64 Cb 0.14 1.29 -0.01 0.00 -1.52 0.00 0.00 31.29 31.19 3kzv h VAL 64 CO -0.01 0.44 0.11 -0.07 0.02 0.00 0.00 177.57 178.06 3kzv h LEU 65 N 0.62 0.22 -0.81 2.57 3.38 -1.17 -1.40 115.31 118.72 3kzv h LEU 65 Ca 0.09 -0.04 -0.08 0.00 0.09 0.00 0.00 57.88 57.94 3kzv h LEU 65 Cb 0.73 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.40 3kzv h LEU 65 CO 0.06 0.20 0.03 0.11 0.09 0.00 0.00 178.44 178.93 3kzv h LYS 66 N 0.23 0.93 -0.39 1.13 1.57 -0.92 -1.10 116.57 118.01 3kzv h LYS 66 Ca 0.07 -0.25 0.04 0.00 -1.87 0.00 0.00 60.65 58.64 3kzv h LYS 66 Cb 0.01 -0.11 -0.04 0.00 0.08 0.00 0.00 32.23 32.18 3kzv h LYS 66 CO -0.01 0.90 0.15 1.96 -0.57 0.00 0.00 179.45 181.88 3kzv h GLN 67 N 0.86 0.31 -0.11 3.15 4.20 -0.77 0.20 115.11 122.95 3kzv h GLN 67 Ca 0.17 -0.02 -0.02 0.00 0.06 0.00 0.00 58.65 58.84 3kzv h GLN 67 Cb 0.46 -0.07 -0.00 0.00 0.30 0.00 0.00 27.48 28.17 3kzv h GLN 67 CO 0.02 0.21 0.01 1.25 -0.67 0.00 0.00 178.83 179.64 3kzv h LEU 68 N 0.32 0.18 -0.01 1.46 5.85 -0.95 0.22 115.31 122.37 3kzv h LEU 68 Ca 0.18 -0.29 -0.00 0.00 0.84 0.00 0.00 57.88 58.61 3kzv h LEU 68 Cb 0.14 -0.05 -0.00 0.00 0.37 0.00 0.00 40.66 41.12 3kzv h LEU 68 CO -0.17 0.42 0.01 0.58 -0.34 0.00 0.00 178.44 178.94 3kzv h VAL 69 N -0.07 1.03 -0.80 1.05 2.07 -1.09 -2.01 116.25 116.44 3kzv h VAL 69 Ca 0.03 -0.08 0.06 0.00 0.82 0.00 0.00 66.70 67.53 3kzv h VAL 69 Cb 0.32 1.06 -0.05 0.00 -1.52 0.00 0.00 31.29 31.10 3kzv h VAL 69 CO 0.00 0.02 0.52 0.78 0.02 0.00 0.00 177.57 178.92 3kzv h ASN 70 N -0.01 0.77 -0.42 0.57 2.35 -0.49 -1.74 115.58 116.61 3kzv h ASN 70 Ca 0.00 0.00 -0.13 0.00 -0.55 0.00 0.00 56.30 55.63 3kzv h ASN 70 Cb 0.03 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.23 3kzv h ASN 70 CO -0.00 0.50 -0.23 0.00 -1.65 0.00 0.00 177.43 176.05 3kzv h ALA 71 N 1.56 0.59 -0.32 -0.83 0.00 -0.33 0.79 119.26 120.74 3kzv h ALA 71 Ca 0.34 -0.39 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 3kzv h ALA 71 Cb 0.21 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 3kzv h ALA 71 CO -0.12 0.58 0.05 0.00 0.00 0.00 0.00 179.25 179.77 3kzv h ALA 72 N 0.82 0.42 -0.39 0.00 0.00 -0.98 -0.85 119.26 118.28 3kzv h ALA 72 Ca 0.09 -0.19 -0.12 0.00 0.00 0.00 0.00 54.91 54.68 3kzv h ALA 72 Cb 0.80 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 3kzv h ALA 72 CO 0.07 0.11 -0.25 0.28 0.00 0.00 0.00 179.25 179.45 3kzv h VAL 73 N 0.35 1.27 -0.54 0.00 2.07 -1.18 -0.08 116.25 118.15 3kzv h VAL 73 Ca 0.10 -1.39 -0.01 0.00 0.82 0.00 0.00 66.70 66.22 3kzv h VAL 73 Cb 0.34 1.24 -0.03 0.00 -1.52 0.00 0.00 31.29 31.33 3kzv h VAL 73 CO 0.01 0.46 0.31 0.11 0.02 0.00 0.00 177.57 178.48 3kzv h LYS 74 N 0.69 0.75 0.07 1.57 6.56 -0.79 0.29 116.57 125.72 3kzv h LYS 74 Ca 0.09 -0.08 -0.31 0.00 -1.06 0.00 0.00 60.65 59.29 3kzv h LYS 74 Cb 0.78 -0.15 -0.03 0.00 -0.57 0.00 0.00 32.23 32.27 3kzv h LYS 74 CO 0.06 0.57 -1.70 0.78 -2.06 0.00 0.00 179.45 177.11 3kzv h GLY 75 N 0.73 0.17 0.00 3.86 0.00 -1.07 -3.40 103.07 103.36 3kzv h GLY 75 Ca 0.19 -0.42 0.00 0.00 0.00 0.00 0.00 47.33 47.10 3kzv h GLY 75 CO -0.03 0.37 0.00 1.42 0.00 0.00 0.00 176.54 178.30 3kzv n HIS 76 N -3.30 0.00 -0.25 5.60 8.25 -0.06 -5.03 115.22 120.44 3kzv n HIS 76 Ca -0.20 -0.07 0.00 0.00 -0.26 0.00 0.00 57.72 57.19 3kzv n HIS 76 Cb 1.04 -0.01 0.00 0.00 1.12 0.00 0.00 29.99 32.15 3kzv n HIS 76 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3kzv n GLY 77 N -0.07 2.38 3.82 -1.41 0.00 0.10 -4.95 105.19 105.07 3kzv n GLY 77 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.97 3kzv n GLY 77 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3kzv s LYS 78 N -0.04 1.54 -0.05 1.61 -2.85 -1.26 -4.90 119.74 113.79 3kzv s LYS 78 Ca 0.00 -0.94 -0.01 0.00 -1.00 0.00 0.00 55.97 54.02 3kzv s LYS 78 Cb 0.00 0.47 0.03 0.00 -2.06 0.00 0.00 37.83 36.26 3kzv s LYS 78 CO 0.00 -0.71 0.02 0.42 0.10 0.00 0.00 175.35 175.18 3kzv s ILE 79 N -2.74 0.15 -0.08 3.79 1.01 -1.26 -4.49 121.20 117.58 3kzv s ILE 79 Ca 0.16 0.23 -0.09 0.00 0.00 0.00 0.00 60.65 60.95 3kzv s ILE 79 Cb -0.03 -0.34 -0.29 0.00 0.01 0.00 0.00 42.46 41.81 3kzv s ILE 79 CO 0.06 0.21 0.55 0.44 0.00 0.00 0.00 174.94 176.20 3kzv h ASP 80 N 8.16 0.54 -5.09 3.58 3.32 -0.82 -3.38 116.42 122.73 3kzv h ASP 80 Ca -0.21 -0.94 -0.08 0.00 0.02 0.00 0.00 57.03 55.81 3kzv h ASP 80 Cb 1.12 -0.18 -0.15 0.00 0.22 0.00 0.00 39.33 40.35 3kzv h ASP 80 CO 0.26 1.82 -0.26 -0.44 -1.72 0.00 0.00 179.24 178.90 3kzv s SER 81 N -7.20 -0.05 -0.08 6.45 0.01 -1.08 -1.94 113.70 109.81 3kzv s SER 81 Ca -0.18 -0.38 0.01 0.00 1.31 0.00 0.00 55.95 56.70 3kzv s SER 81 Cb 0.06 0.37 0.02 0.00 0.21 0.00 0.00 66.02 66.68 3kzv s SER 81 CO 0.82 -0.70 -0.10 -0.22 0.41 0.00 0.00 173.24 173.45 3kzv s LEU 82 N -2.49 1.48 -0.47 2.44 2.96 -0.38 -1.18 118.68 121.04 3kzv s LEU 82 Ca 0.00 -0.29 -0.12 0.00 -0.22 0.00 0.00 54.13 53.50 3kzv s LEU 82 Cb 0.02 -0.81 0.10 0.00 0.50 0.00 0.00 46.19 45.99 3kzv s LEU 82 CO -0.08 -0.02 0.36 -0.69 -1.32 0.00 0.00 176.35 174.59 3kzv s VAL 83 N 1.03 4.61 -0.40 1.68 1.01 0.75 -0.96 120.40 128.12 3kzv s VAL 83 Ca -0.08 -1.45 -0.19 0.00 0.00 0.00 0.00 61.98 60.26 3kzv s VAL 83 Cb -0.15 -3.89 0.01 0.00 0.00 0.00 0.00 36.38 32.36 3kzv s VAL 83 CO -0.01 -0.66 0.56 0.00 0.00 0.00 0.00 175.10 174.99 3kzv s ALA 84 N 1.49 3.41 -0.05 5.51 0.00 -0.21 -2.43 121.76 129.47 3kzv s ALA 84 Ca 0.04 -1.19 -0.01 0.00 0.00 0.00 0.00 51.96 50.79 3kzv s ALA 84 Cb -0.25 -3.16 0.03 0.00 0.00 0.00 0.00 23.12 19.73 3kzv s ALA 84 CO 0.02 -1.55 0.03 1.21 0.00 0.00 0.00 175.76 175.47 3kzv s ASN 85 N 1.88 1.21 0.06 0.00 2.47 -1.26 -1.03 114.94 118.26 3kzv s ASN 85 Ca 0.19 -0.01 0.21 0.00 0.42 0.00 0.00 52.86 53.67 3kzv s ASN 85 Cb -0.15 -0.28 0.86 0.00 -1.45 0.00 0.00 41.25 40.22 3kzv s ASN 85 CO 0.16 -0.20 1.65 0.00 -3.72 0.00 0.00 177.10 174.99 3kzv n ALA 86 N 5.04 1.89 0.00 1.71 0.00 -1.26 -3.40 120.51 124.49 3kzv n ALA 86 Ca -0.09 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.31 3kzv n ALA 86 Cb 0.50 -1.34 0.00 0.00 0.00 0.00 0.00 19.45 18.61 3kzv n ALA 86 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3kzv n GLY 87 N 0.50 -2.91 3.77 0.00 0.00 -1.26 -4.85 105.19 100.44 3kzv n GLY 87 Ca 0.04 -1.82 -0.36 0.00 0.00 0.00 0.00 46.02 43.89 3kzv n GLY 87 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3kzv s VAL 88 N -0.67 3.05 0.26 1.61 -7.23 -1.26 -4.98 120.40 111.18 3kzv s VAL 88 Ca 0.00 0.68 -0.31 0.00 -1.81 0.00 0.00 61.98 60.54 3kzv s VAL 88 Cb 0.00 -3.29 -0.12 0.00 0.56 0.00 0.00 36.38 33.54 3kzv s VAL 88 CO 0.00 -0.12 1.62 -0.11 -0.31 0.00 0.00 175.10 176.18 3kzv n LEU 89 N -1.22 4.15 -3.68 1.32 7.94 0.37 -4.97 117.00 120.91 3kzv n LEU 89 Ca 0.11 1.12 -0.12 0.00 -1.11 0.00 0.00 56.01 56.01 3kzv n LEU 89 Cb 0.50 -1.57 -0.06 0.00 0.53 0.00 0.00 43.42 42.82 3kzv n LEU 89 CO 0.43 0.11 0.13 -1.83 -1.11 0.00 0.00 177.39 175.13 3kzv s GLU 90 N 0.02 0.92 0.42 1.96 -1.05 -1.26 -4.69 118.70 115.02 3kzv s GLU 90 Ca 0.68 -0.43 -0.26 0.00 -0.15 0.00 0.00 54.97 54.81 3kzv s GLU 90 Cb -0.51 0.41 -0.08 0.00 -0.44 0.00 0.00 34.13 33.50 3kzv s GLU 90 CO 0.44 -0.32 1.32 -2.14 0.95 0.00 0.00 175.26 175.51 3kzv s PRO 91 N -2.65 3.90 -0.01 -4.83 0.02 -1.26 -5.02 135.00 125.15 3kzv s PRO 91 Ca -0.04 2.18 0.04 0.00 0.02 0.00 0.00 61.00 63.20 3kzv s PRO 91 Cb -0.00 -2.72 -0.01 0.00 0.02 0.00 0.00 34.50 31.79 3kzv s PRO 91 CO -0.04 -0.56 -0.11 0.08 -0.33 0.00 0.00 177.00 176.04 3kzv s VAL 92 N -1.26 0.90 0.21 3.83 1.01 -1.26 -5.12 120.40 118.70 3kzv s VAL 92 Ca 0.58 -0.50 -0.32 0.00 0.00 0.00 0.00 61.98 61.75 3kzv s VAL 92 Cb -0.39 -0.75 -0.12 0.00 0.00 0.00 0.00 36.38 35.12 3kzv s VAL 92 CO 0.49 0.25 1.68 -1.58 0.00 0.00 0.00 175.10 175.95 3kzv s GLN 93 N -0.29 4.14 0.00 2.72 0.74 -1.26 -3.11 119.66 122.61 3kzv s GLN 93 Ca 0.04 2.56 0.00 0.00 0.05 0.00 0.00 55.36 58.01 3kzv s GLN 93 Cb -0.04 -3.08 0.00 0.00 1.10 0.00 0.00 33.01 30.98 3kzv s GLN 93 CO -0.00 -0.72 0.00 0.09 -0.55 0.00 0.00 175.29 174.11 3kzv n ASN 94 N 3.85 -3.33 0.20 6.67 5.03 -1.16 -4.81 115.26 121.71 3kzv n ASN 94 Ca 0.15 0.00 0.06 0.00 0.87 0.00 0.00 54.58 55.66 3kzv n ASN 94 Cb 0.36 -1.76 0.44 0.00 -1.02 0.00 0.00 39.78 37.79 3kzv n ASN 94 CO 0.00 0.00 0.00 0.58 -1.83 0.00 0.00 177.26 176.01 3kzv h VAL 95 N 0.00 1.00 -0.11 2.41 2.07 -1.45 -1.79 116.25 118.39 3kzv h VAL 95 Ca 0.00 -1.17 -0.02 0.00 0.82 0.00 0.00 66.70 66.33 3kzv h VAL 95 Cb 0.36 1.68 -0.01 0.00 -1.52 0.00 0.00 31.29 31.80 3kzv h VAL 95 CO 0.00 0.31 0.02 -3.20 0.02 0.00 0.00 177.57 174.72 3kzv n ASN 96 N -3.84 2.08 -4.40 0.57 5.15 0.26 -4.64 115.26 110.44 3kzv n ASN 96 Ca -0.01 -2.17 -0.21 0.00 -0.60 0.00 0.00 54.58 51.59 3kzv n ASN 96 Cb 0.40 -0.54 -0.10 0.00 -0.53 0.00 0.00 39.78 39.01 3kzv n ASN 96 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 3kzv s GLU 97 N -1.09 1.48 -1.26 1.20 0.41 -0.67 -4.78 118.70 113.99 3kzv s GLU 97 Ca 0.09 -1.68 -0.18 0.00 -0.41 0.00 0.00 54.97 52.79 3kzv s GLU 97 Cb 0.07 -1.37 0.08 0.00 -1.78 0.00 0.00 34.13 31.12 3kzv s GLU 97 CO 0.02 0.23 1.68 0.42 -0.49 0.00 0.00 175.26 177.12 3kzv s ILE 98 N -2.80 4.17 -0.28 -1.63 -1.09 -1.26 -4.85 121.20 113.46 3kzv s ILE 98 Ca 0.26 -1.84 -0.02 0.00 -2.23 0.00 0.00 60.65 56.81 3kzv s ILE 98 Cb -0.02 -5.16 0.09 0.00 -1.58 0.00 0.00 42.46 35.79 3kzv s ILE 98 CO 0.10 -1.98 0.10 -0.62 -1.23 0.00 0.00 174.94 171.31 3kzv s ASP 99 N 4.20 3.68 0.33 3.58 -1.08 -1.26 -5.01 116.67 121.11 3kzv s ASP 99 Ca 0.52 -1.39 0.05 0.00 -0.52 0.00 0.00 52.55 51.21 3kzv s ASP 99 Cb 0.03 -0.65 0.70 0.00 -1.46 0.00 0.00 42.92 41.53 3kzv s ASP 99 CO 0.05 -0.41 1.89 1.62 0.52 0.00 0.00 175.17 178.84 3kzv h VAL 100 N 6.47 0.93 -0.68 1.11 3.04 -1.96 -1.20 116.25 123.96 3kzv h VAL 100 Ca -0.16 -0.28 -0.03 0.00 -1.01 0.00 0.00 66.70 65.22 3kzv h VAL 100 Cb 1.03 0.03 -0.03 0.00 -2.01 0.00 0.00 31.29 30.31 3kzv h VAL 100 CO 0.44 0.15 0.32 0.78 -1.01 0.00 0.00 177.57 178.25 3kzv h ASN 101 N 0.83 0.90 -0.24 3.17 -0.26 -1.98 0.40 115.58 118.40 3kzv h ASN 101 Ca 0.42 -0.14 -0.11 0.00 -0.56 0.00 0.00 56.30 55.92 3kzv h ASN 101 Cb 0.50 -0.23 -0.00 0.00 -1.06 0.00 0.00 38.32 37.52 3kzv h ASN 101 CO -0.19 0.79 -0.27 0.00 -1.06 0.00 0.00 177.43 176.71 3kzv h ALA 102 N 1.15 0.35 -0.84 -0.83 0.00 -1.64 -1.64 119.26 115.81 3kzv h ALA 102 Ca 0.23 -0.39 0.03 0.00 0.00 0.00 0.00 54.91 54.78 3kzv h ALA 102 Cb 0.13 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 17.80 3kzv h ALA 102 CO -0.03 0.35 0.55 -1.49 0.00 0.00 0.00 179.25 178.62 3kzv h TRP 103 N 0.30 1.03 -0.72 0.00 4.06 -1.02 -0.40 115.95 119.19 3kzv h TRP 103 Ca 0.03 0.03 -0.05 0.00 2.06 0.00 0.00 58.89 60.96 3kzv h TRP 103 Cb 0.83 -0.34 -0.03 0.00 -1.00 0.00 0.00 29.16 28.62 3kzv h TRP 103 CO 0.08 0.61 0.24 0.87 -3.56 0.00 0.00 178.44 176.67 3kzv h LYS 104 N 1.08 1.12 -0.53 0.49 1.57 -0.82 -0.09 116.57 119.38 3kzv h LYS 104 Ca 0.33 -0.23 -0.07 0.00 -1.87 0.00 0.00 60.65 58.81 3kzv h LYS 104 Cb -0.03 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.09 3kzv h LYS 104 CO -0.10 0.95 0.06 -0.22 -0.57 0.00 0.00 179.45 179.56 3kzv h LYS 105 N 1.06 0.90 -0.45 3.15 3.64 -0.61 -0.46 116.57 123.81 3kzv h LYS 105 Ca 0.24 -0.26 -0.06 0.00 -1.27 0.00 0.00 60.65 59.29 3kzv h LYS 105 Cb 0.29 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 31.99 3kzv h LYS 105 CO -0.01 0.90 0.03 1.25 -2.27 0.00 0.00 179.45 179.35 3kzv h LEU 106 N 0.78 0.75 -1.62 5.20 5.85 -0.85 -1.87 115.31 123.55 3kzv h LEU 106 Ca 0.16 -0.29 -0.01 0.00 0.84 0.00 0.00 57.88 58.58 3kzv h LEU 106 Cb 0.45 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.27 3kzv h LEU 106 CO 0.02 0.85 0.12 1.88 -0.34 0.00 0.00 178.44 180.97 3kzv h TYR 107 N 0.62 0.36 -0.20 1.25 -1.99 -0.91 0.21 116.97 116.31 3kzv h TYR 107 Ca 0.13 -0.00 -0.05 0.00 2.00 0.00 0.00 58.73 60.80 3kzv h TYR 107 Cb 0.45 -0.12 -0.01 0.00 2.00 0.00 0.00 36.73 39.06 3kzv h TYR 107 CO 0.03 0.28 -0.09 0.22 -0.00 0.00 0.00 178.16 178.60 3kzv h ASP 108 N 0.38 0.42 -0.12 3.88 3.58 -0.80 0.13 116.42 123.88 3kzv h ASP 108 Ca 0.10 -0.40 0.04 0.00 0.42 0.00 0.00 57.03 57.18 3kzv h ASP 108 Cb 0.05 -0.12 -0.05 0.00 1.72 0.00 0.00 39.33 40.94 3kzv h ASP 108 CO -0.01 0.73 -0.18 0.40 -2.88 0.00 0.00 179.24 177.30 3kzv h ILE 109 N 0.11 0.54 0.00 2.25 2.04 -0.96 0.03 117.51 121.52 3kzv h ILE 109 Ca 0.04 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.90 3kzv h ILE 109 Cb 0.57 0.54 0.00 0.00 -0.74 0.00 0.00 36.82 37.19 3kzv h ILE 109 CO 0.03 0.00 -1.08 0.59 0.00 0.00 0.00 178.15 177.68 3kzv n ASN 110 N -5.32 0.67 0.05 1.72 3.02 0.70 -4.72 115.26 111.38 3kzv n ASN 110 Ca -0.03 0.14 0.00 0.00 -0.03 0.00 0.00 54.58 54.66 3kzv n ASN 110 Cb 0.24 0.68 0.00 0.00 -0.61 0.00 0.00 39.78 40.09 3kzv n ASN 110 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 3kzv n PHE 111 N -2.39 -0.74 -0.34 3.10 7.35 0.23 -4.72 117.46 119.95 3kzv n PHE 111 Ca 0.00 0.13 -0.02 0.00 -0.76 0.00 0.00 57.45 56.81 3kzv n PHE 111 Cb 0.51 0.35 0.14 0.00 0.35 0.00 0.00 39.48 40.83 3kzv n PHE 111 CO 0.00 0.00 0.00 0.74 -0.76 0.00 0.00 176.76 176.74 3kzv h PHE 112 N 0.00 1.19 -0.68 -5.13 0.04 -0.95 -0.66 116.94 110.74 3kzv h PHE 112 Ca 0.00 0.02 0.07 0.00 2.80 0.00 0.00 57.97 60.86 3kzv h PHE 112 Cb 0.00 -0.40 -0.04 0.00 2.20 0.00 0.00 35.95 37.71 3kzv h PHE 112 CO 0.00 0.76 0.45 0.66 -0.60 0.00 0.00 178.31 179.58 3kzv h SER 113 N 1.27 0.58 -0.10 2.17 4.64 -1.21 0.21 113.55 121.11 3kzv h SER 113 Ca 0.34 0.01 -0.09 0.00 -0.47 0.00 0.00 61.79 61.57 3kzv h SER 113 Cb -0.12 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 61.85 3kzv h SER 113 CO -0.07 0.37 -0.30 0.40 -0.87 0.00 0.00 176.83 176.36 3kzv h ILE 114 N 0.66 1.40 -0.49 0.95 1.08 -1.44 0.26 117.51 119.93 3kzv h ILE 114 Ca 0.30 -1.63 0.10 0.00 -0.39 0.00 0.00 64.86 63.23 3kzv h ILE 114 Cb 0.32 2.18 -0.09 0.00 -3.07 0.00 0.00 36.82 36.17 3kzv h ILE 114 CO -0.10 0.48 -0.05 0.58 -0.69 0.00 0.00 178.15 178.37 3kzv h VAL 115 N -0.07 0.57 -0.57 1.67 2.07 -0.75 -0.84 116.25 118.33 3kzv h VAL 115 Ca -0.01 -0.02 0.04 0.00 0.82 0.00 0.00 66.70 67.53 3kzv h VAL 115 Cb 0.92 0.50 -0.04 0.00 -1.52 0.00 0.00 31.29 31.15 3kzv h VAL 115 CO 0.06 0.01 0.32 -1.28 0.02 0.00 0.00 177.57 176.71 3kzv h SER 116 N 0.06 0.50 -0.76 0.57 0.87 -0.53 -1.90 113.55 112.36 3kzv h SER 116 Ca 0.24 0.02 -0.04 0.00 -1.23 0.00 0.00 61.79 60.78 3kzv h SER 116 Cb 0.37 -0.08 -0.03 0.00 -0.44 0.00 0.00 62.40 62.21 3kzv h SER 116 CO -0.45 0.34 0.30 0.25 -0.53 0.00 0.00 176.83 176.75 3kzv h LEU 117 N 0.63 1.05 -0.51 2.23 5.85 -0.33 -1.40 115.31 122.83 3kzv h LEU 117 Ca 0.24 -0.17 -0.03 0.00 0.84 0.00 0.00 57.88 58.76 3kzv h LEU 117 Cb 0.09 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 40.83 3kzv h LEU 117 CO -0.14 0.94 0.20 0.58 -0.34 0.00 0.00 178.44 179.69 3kzv h VAL 118 N 1.10 1.21 -0.81 1.05 2.07 -0.99 -0.14 116.25 119.75 3kzv h VAL 118 Ca 0.25 -0.67 -0.02 0.00 0.82 0.00 0.00 66.70 67.08 3kzv h VAL 118 Cb 0.22 0.69 -0.04 0.00 -1.52 0.00 0.00 31.29 30.64 3kzv h VAL 118 CO -0.02 0.25 0.41 1.23 0.02 0.00 0.00 177.57 179.47 3kzv h GLY 119 N 0.69 1.23 1.00 2.17 0.00 -1.01 0.99 103.07 108.14 3kzv h GLY 119 Ca 0.17 -0.59 -0.11 0.00 0.00 0.00 0.00 47.33 46.80 3kzv h GLY 119 CO -0.01 0.56 -0.22 -2.22 0.00 0.00 0.00 176.54 174.65 3kzv h ILE 120 N 1.13 1.29 0.00 2.60 2.04 -0.91 -3.20 117.51 120.46 3kzv h ILE 120 Ca 0.28 -1.36 0.00 0.00 1.00 0.00 0.00 64.86 64.78 3kzv h ILE 120 Cb 0.08 1.40 0.00 0.00 -0.74 0.00 0.00 36.82 37.56 3kzv h ILE 120 CO -0.04 0.45 -0.33 0.00 0.00 0.00 0.00 178.15 178.23 3kzv n ALA 121 N -2.48 2.65 -0.24 1.87 0.00 -0.10 -4.41 120.51 117.80 3kzv n ALA 121 Ca -0.02 -0.15 -0.01 0.00 0.00 0.00 0.00 53.44 53.26 3kzv n ALA 121 Cb 0.43 -1.31 0.11 0.00 0.00 0.00 0.00 19.45 18.69 3kzv n ALA 121 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 3kzv h LEU 122 N 0.00 0.57 -1.17 0.00 5.85 -0.79 -0.53 115.31 119.23 3kzv h LEU 122 Ca 0.00 0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.73 3kzv h LEU 122 Cb 0.73 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.65 3kzv h LEU 122 CO 0.00 0.36 0.30 -0.65 -0.34 0.00 0.00 178.44 178.11 3kzv h PRO 123 N 0.70 0.88 -0.51 5.25 0.11 -1.79 0.20 132.00 136.83 3kzv h PRO 123 Ca 0.32 -0.11 -0.11 0.00 0.11 0.00 0.00 66.00 66.21 3kzv h PRO 123 Cb 0.22 -0.17 -0.02 0.00 0.11 0.00 0.00 31.00 31.14 3kzv h PRO 123 CO -0.20 0.68 -0.11 0.93 -0.21 0.00 0.00 178.00 179.10 3kzv h GLU 124 N 0.88 0.95 -0.41 1.05 4.39 -1.60 -3.01 114.58 116.83 3kzv h GLU 124 Ca 0.22 -0.34 -0.07 0.00 0.34 0.00 0.00 59.36 59.51 3kzv h GLU 124 Cb 0.09 -0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 28.65 3kzv h GLU 124 CO -0.03 1.00 -0.03 -0.07 -1.16 0.00 0.00 179.01 178.73 3kzv h LEU 125 N 0.85 0.64 -1.53 1.33 3.38 -0.32 -2.10 115.31 117.57 3kzv h LEU 125 Ca 0.14 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 3kzv h LEU 125 Cb 0.65 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.21 3kzv h LEU 125 CO 0.04 0.73 0.14 0.11 0.09 0.00 0.00 178.44 179.56 3kzv h LYS 126 N 0.63 0.45 -0.42 1.13 1.57 -0.61 -0.64 116.57 118.68 3kzv h LYS 126 Ca 0.12 -0.05 -0.09 0.00 -1.87 0.00 0.00 60.65 58.77 3kzv h LYS 126 Cb 0.43 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.64 3kzv h LYS 126 CO 0.02 0.37 -0.10 0.87 -0.57 0.00 0.00 179.45 180.04 3kzv h LYS 127 N 0.46 0.74 -0.58 3.15 1.57 -1.24 -2.38 116.57 118.28 3kzv h LYS 127 Ca 0.12 -0.23 0.00 0.00 -1.87 0.00 0.00 60.65 58.66 3kzv h LYS 127 Cb 0.08 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.32 3kzv h LYS 127 CO -0.01 0.81 0.00 0.25 -0.57 0.00 0.00 179.45 179.93 3kzv n THR 128 N -4.18 0.85 -3.89 -0.16 -2.24 -1.07 -4.95 114.28 98.64 3kzv n THR 128 Ca 0.01 -0.92 -0.26 0.00 -2.27 0.00 0.00 64.05 60.61 3kzv n THR 128 Cb 0.35 0.65 -0.01 0.00 -2.10 0.00 0.00 70.33 69.22 3kzv n THR 128 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3kzv n ASN 129 N 1.43 -1.13 -2.07 3.42 3.02 -0.66 -4.94 115.26 114.34 3kzv n ASN 129 Ca 0.21 -1.00 0.00 0.00 -0.03 0.00 0.00 54.58 53.76 3kzv n ASN 129 Cb 0.58 -3.17 0.00 0.00 -0.61 0.00 0.00 39.78 36.58 3kzv n ASN 129 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3kzv n GLY 130 N -1.91 -0.39 3.11 7.41 0.00 -0.34 -4.72 105.19 108.35 3kzv n GLY 130 Ca -0.28 -1.76 -0.24 0.00 0.00 0.00 0.00 46.02 43.74 3kzv n GLY 130 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3kzv s ASN 131 N -1.00 1.83 -0.25 1.61 0.01 -0.82 -1.80 114.94 114.52 3kzv s ASN 131 Ca 0.00 -0.29 -0.02 0.00 -0.71 0.00 0.00 52.86 51.84 3kzv s ASN 131 Cb 0.00 -0.36 0.02 0.00 0.41 0.00 0.00 41.25 41.33 3kzv s ASN 131 CO 0.00 0.16 -0.04 -0.69 -1.51 0.00 0.00 177.10 175.02 3kzv s VAL 132 N -0.13 3.04 -0.30 1.60 1.01 0.39 -1.25 120.40 124.77 3kzv s VAL 132 Ca 0.01 -0.97 -0.06 0.00 0.00 0.00 0.00 61.98 60.96 3kzv s VAL 132 Cb -0.08 -2.55 0.02 0.00 0.00 0.00 0.00 36.38 33.77 3kzv s VAL 132 CO 0.01 0.18 0.06 -0.69 0.00 0.00 0.00 175.10 174.66 3kzv s VAL 133 N 1.35 3.77 -0.02 2.92 1.01 -0.13 -1.62 120.40 127.68 3kzv s VAL 133 Ca 0.01 -0.82 -0.15 0.00 0.00 0.00 0.00 61.98 61.02 3kzv s VAL 133 Cb -0.17 -2.97 -0.05 0.00 0.00 0.00 0.00 36.38 33.18 3kzv s VAL 133 CO -0.03 0.05 0.40 -0.36 0.00 0.00 0.00 175.10 175.15 3kzv s PHE 134 N 1.46 3.70 -0.60 5.22 0.08 0.57 -1.04 117.98 127.36 3kzv s PHE 134 Ca 0.01 0.95 -0.19 0.00 0.12 0.00 0.00 56.93 57.83 3kzv s PHE 134 Cb -0.17 -2.29 0.11 0.00 -0.57 0.00 0.00 43.02 40.09 3kzv s PHE 134 CO 0.01 0.60 0.71 0.08 -0.10 0.00 0.00 175.22 176.52 3kzv s VAL 135 N -0.90 4.86 0.00 -0.44 1.01 -0.20 -1.40 120.40 123.34 3kzv s VAL 135 Ca 0.23 -1.08 0.00 0.00 0.00 0.00 0.00 61.98 61.13 3kzv s VAL 135 Cb -0.16 -4.49 0.00 0.00 0.00 0.00 0.00 36.38 31.73 3kzv s VAL 135 CO 0.12 -1.12 0.00 -0.24 0.00 0.00 0.00 175.10 173.86 3kzv n SER 136 N 6.22 0.34 -4.53 3.32 2.88 -0.72 -4.53 113.62 116.60 3kzv n SER 136 Ca -0.08 -0.42 -0.26 0.00 -1.33 0.00 0.00 58.87 56.78 3kzv n SER 136 Cb 0.43 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.79 3kzv n SER 136 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 3kzv s SER 137 N -0.80 4.03 0.20 -3.46 1.04 -1.26 -4.32 113.70 109.13 3kzv s SER 137 Ca 0.00 -0.70 0.05 0.00 0.48 0.00 0.00 55.95 55.78 3kzv s SER 137 Cb 0.00 -0.58 0.13 0.00 0.10 0.00 0.00 66.02 65.66 3kzv s SER 137 CO 0.00 0.09 1.47 0.44 0.98 0.00 0.00 173.24 176.22 3kzv h ASP 138 N 2.80 0.20 0.00 7.02 3.32 -1.92 -3.24 116.42 124.60 3kzv h ASP 138 Ca -0.46 -0.14 0.00 0.00 0.02 0.00 0.00 57.03 56.45 3kzv h ASP 138 Cb 1.22 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.71 3kzv h ASP 138 CO 0.54 0.88 0.06 0.00 -1.72 0.00 0.00 179.24 178.99 3kzv n ALA 139 N -2.45 0.80 -1.26 3.45 0.00 -1.26 -2.61 120.51 117.18 3kzv n ALA 139 Ca -0.03 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.12 3kzv n ALA 139 Cb 0.72 -1.18 0.05 0.00 0.00 0.00 0.00 19.45 19.05 3kzv n ALA 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3kzv s ASN 141 N -1.00 7.08 -0.00 0.00 0.01 -1.07 -4.77 114.94 115.18 3kzv s ASN 141 Ca 0.53 -3.02 0.14 0.00 -0.71 0.00 0.00 52.86 49.80 3kzv s ASN 141 Cb 0.41 -2.37 -0.20 0.00 0.41 0.00 0.00 41.25 39.50 3kzv s ASN 141 CO -0.06 -0.70 0.74 0.24 -1.51 0.00 0.00 177.10 175.81 3kzv h MET 142 N 7.18 0.00 -0.04 -0.60 2.86 -1.89 -3.38 114.93 119.06 3kzv h MET 142 Ca 0.29 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.93 3kzv h MET 142 Cb 0.88 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.54 3kzv h MET 142 CO 1.20 0.43 -0.02 0.66 1.06 0.00 0.00 176.91 180.24 3kzv n TYR 143 N -3.00 -0.02 -5.02 -0.22 0.53 -1.26 -3.09 117.16 105.08 3kzv n TYR 143 Ca -0.14 0.05 -0.32 0.00 -1.02 0.00 0.00 57.90 56.47 3kzv n TYR 143 Cb 0.98 -0.22 -0.15 0.00 -1.03 0.00 0.00 39.34 38.91 3kzv n TYR 143 CO 0.00 0.00 0.00 0.12 -1.02 0.00 0.00 176.86 175.96 3kzv s PHE 144 N -3.25 2.64 -0.19 -0.72 5.36 -1.26 -5.11 117.98 115.46 3kzv s PHE 144 Ca -0.00 -0.68 -0.13 0.00 -0.96 0.00 0.00 56.93 55.16 3kzv s PHE 144 Cb 0.00 -1.72 0.06 0.00 -0.34 0.00 0.00 43.02 41.03 3kzv s PHE 144 CO 0.03 -0.19 0.47 0.45 -1.46 0.00 0.00 175.22 174.51 3kzv s SER 145 N 0.04 -0.57 -0.16 6.13 0.15 -1.18 -4.77 113.70 113.34 3kzv s SER 145 Ca -0.07 1.00 0.16 0.00 0.70 0.00 0.00 55.95 57.74 3kzv s SER 145 Cb -0.15 0.92 0.72 0.00 -1.71 0.00 0.00 66.02 65.80 3kzv s SER 145 CO 0.05 -0.19 1.64 -1.20 1.20 0.00 0.00 173.24 174.74 3kzv n SER 146 N 3.78 4.95 -0.24 5.45 7.64 -1.26 -4.49 113.62 129.46 3kzv n SER 146 Ca -0.20 -2.69 0.10 0.00 1.01 0.00 0.00 58.87 57.10 3kzv n SER 146 Cb 0.56 -0.60 0.50 0.00 -1.01 0.00 0.00 64.21 63.67 3kzv n SER 146 CO 0.00 0.00 0.00 0.79 -3.01 0.00 0.00 175.04 172.82 3kzv n TRP 147 N 0.70 0.08 -4.08 1.43 7.02 -1.26 -4.87 117.44 116.46 3kzv n TRP 147 Ca 0.25 -0.04 0.00 0.00 -1.02 0.00 0.00 57.50 56.69 3kzv n TRP 147 Cb 0.99 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.88 3kzv n TRP 147 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 3kzv n GLY 148 N 0.95 3.08 0.22 6.99 0.00 -1.26 -1.88 105.19 113.30 3kzv n GLY 148 Ca 0.16 -0.31 0.08 0.00 0.00 0.00 0.00 46.02 45.94 3kzv n GLY 148 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kzv h ALA 149 N -0.98 1.19 -0.91 4.61 0.00 -1.95 -2.56 119.26 118.65 3kzv h ALA 149 Ca 0.00 -0.24 0.07 0.00 0.00 0.00 0.00 54.91 54.74 3kzv h ALA 149 Cb 0.00 -0.04 -0.07 0.00 0.00 0.00 0.00 17.79 17.68 3kzv h ALA 149 CO 0.00 0.33 0.57 1.88 0.00 0.00 0.00 179.25 182.03 3kzv h TYR 150 N 0.00 1.05 0.03 0.00 0.05 -1.74 -2.07 116.97 114.29 3kzv h TYR 150 Ca -0.00 0.03 -0.17 0.00 0.05 0.00 0.00 58.73 58.64 3kzv h TYR 150 Cb 0.63 -0.34 0.01 0.00 1.01 0.00 0.00 36.73 38.05 3kzv h TYR 150 CO 0.00 0.51 -0.67 0.78 -1.05 0.00 0.00 178.16 177.74 3kzv h GLY 151 N 1.01 0.45 1.15 3.88 0.00 -1.32 -3.20 103.07 105.03 3kzv h GLY 151 Ca 0.41 -0.84 -0.21 0.00 0.00 0.00 0.00 47.33 46.69 3kzv h GLY 151 CO -0.19 0.74 -0.69 1.48 0.00 0.00 0.00 176.54 177.88 3kzv h SER 152 N -0.14 0.94 -0.34 0.19 4.64 -1.45 -2.35 113.55 115.04 3kzv h SER 152 Ca -0.09 -0.60 -0.05 0.00 -0.47 0.00 0.00 61.79 60.58 3kzv h SER 152 Cb 1.40 -0.28 -0.02 0.00 -0.31 0.00 0.00 62.40 63.19 3kzv h SER 152 CO 0.13 1.38 0.06 0.77 -0.87 0.00 0.00 176.83 178.31 3kzv h SER 153 N 0.56 0.61 -0.09 4.97 4.64 -1.54 -2.45 113.55 120.25 3kzv h SER 153 Ca -0.03 -0.11 -0.08 0.00 -0.47 0.00 0.00 61.79 61.10 3kzv h SER 153 Cb 1.31 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 3kzv h SER 153 CO 0.15 0.64 -0.24 0.50 -0.87 0.00 0.00 176.83 177.00 3kzv h LYS 154 N 0.63 0.33 0.00 4.77 1.63 -1.52 -3.20 116.57 119.21 3kzv h LYS 154 Ca 0.14 -0.23 0.00 0.00 -0.85 0.00 0.00 60.65 59.71 3kzv h LYS 154 Cb 0.30 0.04 0.00 0.00 -0.60 0.00 0.00 32.23 31.97 3kzv h LYS 154 CO 0.00 0.84 0.00 0.00 -3.45 0.00 0.00 179.45 176.85 3kzv n ALA 155 N -2.47 1.69 0.20 5.00 0.00 -0.90 -3.45 120.51 120.57 3kzv n ALA 155 Ca -0.08 0.07 0.16 0.00 0.00 0.00 0.00 53.44 53.59 3kzv n ALA 155 Cb 0.45 -1.38 0.80 0.00 0.00 0.00 0.00 19.45 19.31 3kzv n ALA 155 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3kzv h ALA 156 N 2.29 1.87 -0.06 0.00 0.00 -1.43 -0.37 119.26 121.57 3kzv h ALA 156 Ca 0.00 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.92 3kzv h ALA 156 Cb 0.37 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 3kzv h ALA 156 CO 0.00 -0.25 0.08 -0.07 0.00 0.00 0.00 179.25 179.01 3kzv h LEU 157 N 0.00 0.00 0.66 0.00 3.38 -1.79 -3.05 115.31 114.51 3kzv h LEU 157 Ca 0.08 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.02 3kzv h LEU 157 Cb 0.40 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.15 3kzv h LEU 157 CO -0.00 0.00 -0.34 0.78 0.09 0.00 0.00 178.44 178.97 3kzv h ASN 158 N 0.00 -0.81 0.47 -0.43 -0.26 -1.34 -2.06 115.58 111.15 3kzv h ASN 158 Ca 0.03 0.03 -0.05 0.00 -0.56 0.00 0.00 56.30 55.75 3kzv h ASN 158 Cb 0.18 0.22 -0.01 0.00 -1.06 0.00 0.00 38.32 37.65 3kzv h ASN 158 CO -0.00 -0.56 -0.24 -0.74 -1.06 0.00 0.00 177.43 174.83 3kzv h HIS 159 N -0.92 0.00 -0.49 1.19 2.76 -1.73 -2.95 115.15 113.02 3kzv h HIS 159 Ca -0.09 0.00 -0.11 0.00 -2.20 0.00 0.00 60.37 57.98 3kzv h HIS 159 Cb 0.71 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 29.65 3kzv h HIS 159 CO -0.04 0.24 -0.12 0.35 -1.30 0.00 0.00 177.93 177.06 3kzv h PHE 160 N 0.00 1.00 -0.49 5.26 3.57 -1.35 -1.91 116.94 123.02 3kzv h PHE 160 Ca -0.00 -0.20 0.07 0.00 3.53 0.00 0.00 57.97 61.37 3kzv h PHE 160 Cb 0.54 -0.25 -0.06 0.00 2.79 0.00 0.00 35.95 38.97 3kzv h PHE 160 CO 0.00 0.96 0.14 0.00 -2.23 0.00 0.00 178.31 177.18 3kzv h ALA 161 N 1.05 0.57 -0.32 2.41 0.00 -1.20 0.32 119.26 122.10 3kzv h ALA 161 Ca 0.13 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.10 3kzv h ALA 161 Cb 0.65 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 3kzv h ALA 161 CO 0.05 -0.26 0.13 1.98 0.00 0.00 0.00 179.25 181.14 3kzv h MET 162 N 0.29 0.47 -0.47 0.00 1.85 -1.39 -1.34 114.93 114.35 3kzv h MET 162 Ca 0.24 -0.08 -0.01 0.00 -0.61 0.00 0.00 59.70 59.24 3kzv h MET 162 Cb 0.29 -0.08 -0.02 0.00 0.43 0.00 0.00 31.60 32.21 3kzv h MET 162 CO -0.28 0.47 0.25 1.15 -0.40 0.00 0.00 176.91 178.10 3kzv h THR 163 N 0.37 1.17 -0.48 -0.77 2.02 -1.07 -1.41 112.91 112.75 3kzv h THR 163 Ca 0.11 -0.45 -0.01 0.00 0.77 0.00 0.00 66.41 66.83 3kzv h THR 163 Cb 0.17 0.61 -0.02 0.00 -1.74 0.00 0.00 68.15 67.16 3kzv h THR 163 CO -0.01 0.18 0.24 0.25 0.37 0.00 0.00 175.52 176.55 3kzv h LEU 164 N 0.62 0.61 -0.91 2.58 5.85 -0.91 -1.67 115.31 121.48 3kzv h LEU 164 Ca 0.17 -0.11 -0.11 0.00 0.84 0.00 0.00 57.88 58.66 3kzv h LEU 164 Cb 0.07 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 40.93 3kzv h LEU 164 CO -0.03 0.55 -0.40 0.00 -0.34 0.00 0.00 178.44 178.23 3kzv h ALA 165 N 1.08 1.08 -0.72 1.25 0.00 -1.12 -0.84 119.26 120.00 3kzv h ALA 165 Ca 0.17 -0.41 -0.07 0.00 0.00 0.00 0.00 54.91 54.60 3kzv h ALA 165 Cb 0.09 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 3kzv h ALA 165 CO -0.02 0.59 0.19 -0.91 0.00 0.00 0.00 179.25 179.10 3kzv h ASN 166 N 0.25 1.08 1.10 0.00 2.35 -1.03 -3.31 115.58 116.02 3kzv h ASN 166 Ca 0.02 -0.22 -0.13 0.00 -0.55 0.00 0.00 56.30 55.42 3kzv h ASN 166 Cb 0.81 -0.29 -0.02 0.00 0.05 0.00 0.00 38.32 38.88 3kzv h ASN 166 CO 0.06 1.03 -0.95 -0.08 -1.65 0.00 0.00 177.43 175.84 3kzv h GLU 167 N 1.09 0.00 -3.10 0.81 4.22 -1.06 -3.41 114.58 113.12 3kzv h GLU 167 Ca 0.23 0.00 -0.62 0.00 0.08 0.00 0.00 59.36 59.05 3kzv h GLU 167 Cb 0.36 0.00 -0.40 0.00 0.50 0.00 0.00 28.75 29.21 3kzv h GLU 167 CO -0.00 0.39 -0.71 -1.21 -2.18 0.00 0.00 179.01 175.30 3kzv s GLU 168 N -2.96 1.49 0.12 1.92 0.41 -0.34 -4.99 118.70 114.35 3kzv s GLU 168 Ca 0.01 -2.19 0.21 0.00 -0.41 0.00 0.00 54.97 52.59 3kzv s GLU 168 Cb 0.08 -2.62 0.86 0.00 -1.78 0.00 0.00 34.13 30.67 3kzv s GLU 168 CO 0.78 -1.15 1.66 0.54 -0.49 0.00 0.00 175.26 176.60 3kzv n ARG 169 N 3.42 0.10 0.00 1.61 5.12 -1.26 -2.72 116.66 122.92 3kzv n ARG 169 Ca 0.08 0.27 0.13 0.00 -1.93 0.00 0.00 57.85 56.40 3kzv n ARG 169 Cb 0.34 -1.67 0.44 0.00 -1.16 0.00 0.00 32.46 30.41 3kzv n ARG 169 CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 3kzv n GLN 170 N -1.85 0.70 -4.46 5.56 6.02 -1.26 -4.86 117.38 117.22 3kzv n GLN 170 Ca 0.04 -0.36 -0.23 0.00 -0.01 0.00 0.00 57.00 56.43 3kzv n GLN 170 Cb 0.25 -1.49 -0.10 0.00 1.02 0.00 0.00 30.24 29.91 3kzv n GLN 170 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.06 176.19 3kzv s VAL 171 N -2.55 2.23 0.17 5.09 -7.23 -1.10 -4.03 120.40 112.97 3kzv s VAL 171 Ca 0.24 -2.30 0.08 0.00 -1.81 0.00 0.00 61.98 58.19 3kzv s VAL 171 Cb 0.19 -2.35 -0.04 0.00 0.56 0.00 0.00 36.38 34.74 3kzv s VAL 171 CO 0.52 -0.38 -0.09 -0.54 -0.31 0.00 0.00 175.10 174.30 3kzv s LYS 172 N -3.58 2.08 0.03 4.82 1.02 -0.74 -4.92 119.74 118.45 3kzv s LYS 172 Ca 0.29 -1.21 -0.05 0.00 0.02 0.00 0.00 55.97 55.02 3kzv s LYS 172 Cb -0.02 -2.19 -0.01 0.00 -0.52 0.00 0.00 37.83 35.09 3kzv s LYS 172 CO 0.14 0.45 0.09 0.00 -0.92 0.00 0.00 175.35 175.11 3kzv s ALA 173 N -1.60 -0.09 -0.11 5.17 0.00 -1.26 -0.46 121.76 123.41 3kzv s ALA 173 Ca 0.24 -0.48 -0.20 0.00 0.00 0.00 0.00 51.96 51.52 3kzv s ALA 173 Cb -0.09 0.21 0.05 0.00 0.00 0.00 0.00 23.12 23.29 3kzv s ALA 173 CO 0.15 -0.28 0.50 -1.50 0.00 0.00 0.00 175.76 174.63 3kzv s ILE 174 N -2.25 0.02 -0.18 0.00 2.07 -0.64 0.01 121.20 120.22 3kzv s ILE 174 Ca -0.08 -0.14 -0.00 0.00 -1.41 0.00 0.00 60.65 59.02 3kzv s ILE 174 Cb -0.03 -0.76 0.00 0.00 0.13 0.00 0.00 42.46 41.80 3kzv s ILE 174 CO -0.03 -0.07 -0.14 0.00 -1.91 0.00 0.00 174.94 172.78 3kzv s ALA 175 N -0.55 2.51 -0.13 1.50 0.00 -0.37 -0.31 121.76 124.40 3kzv s ALA 175 Ca -0.07 -1.14 0.03 0.00 0.00 0.00 0.00 51.96 50.78 3kzv s ALA 175 Cb -0.03 -1.33 0.01 0.00 0.00 0.00 0.00 23.12 21.77 3kzv s ALA 175 CO 0.04 -0.25 -0.22 0.08 0.00 0.00 0.00 175.76 175.41 3kzv s VAL 176 N 1.15 2.07 0.19 0.00 1.01 -0.49 -1.12 120.40 123.21 3kzv s VAL 176 Ca 0.01 -0.98 -0.29 0.00 0.00 0.00 0.00 61.98 60.72 3kzv s VAL 176 Cb -0.14 -1.82 -0.08 0.00 0.00 0.00 0.00 36.38 34.34 3kzv s VAL 176 CO -0.06 0.55 0.89 0.00 0.00 0.00 0.00 175.10 176.49 3kzv s ALA 177 N 0.74 3.35 -2.44 5.51 0.00 -0.08 -1.75 121.76 127.08 3kzv s ALA 177 Ca -0.09 0.53 0.26 0.00 0.00 0.00 0.00 51.96 52.66 3kzv s ALA 177 Cb -0.16 -3.15 0.95 0.00 0.00 0.00 0.00 23.12 20.77 3kzv s ALA 177 CO -0.00 0.18 1.68 -0.35 0.00 0.00 0.00 175.76 177.27 3kzv n PRO 178 N 1.81 1.70 -1.01 0.00 -0.04 -1.26 -1.20 135.00 134.99 3kzv n PRO 178 Ca -0.02 -1.02 -0.00 0.00 -0.04 0.00 0.00 63.50 62.41 3kzv n PRO 178 Cb 0.48 -1.46 -0.00 0.00 -0.04 0.00 0.00 33.50 32.48 3kzv n PRO 178 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3kzv n GLY 179 N 1.17 0.46 3.38 0.55 0.00 -1.26 -4.75 105.19 104.74 3kzv n GLY 179 Ca 0.18 -0.14 -0.10 0.00 0.00 0.00 0.00 46.02 45.96 3kzv n GLY 179 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3kzv s ILE 180 N -1.93 0.06 -0.23 -0.61 -4.36 -1.26 -5.10 121.20 107.77 3kzv s ILE 180 Ca 0.00 -0.97 -0.22 0.00 -0.26 0.00 0.00 60.65 59.20 3kzv s ILE 180 Cb 0.00 -1.54 -0.02 0.00 1.25 0.00 0.00 42.46 42.16 3kzv s ILE 180 CO 0.00 -0.29 0.70 -0.69 0.24 0.00 0.00 174.94 174.91 3kzv s VAL 181 N -3.89 4.94 -0.30 8.37 1.01 -1.26 -4.51 120.40 124.77 3kzv s VAL 181 Ca 0.10 1.30 -0.29 0.00 0.00 0.00 0.00 61.98 63.09 3kzv s VAL 181 Cb 0.02 -4.00 -0.02 0.00 0.00 0.00 0.00 36.38 32.38 3kzv s VAL 181 CO -0.05 0.02 1.65 -0.62 0.00 0.00 0.00 175.10 176.10 3kzv s ASP 182 N 1.35 6.17 0.20 3.32 2.15 -1.26 -4.98 116.67 123.63 3kzv s ASP 182 Ca 0.30 1.35 0.04 0.00 0.43 0.00 0.00 52.55 54.67 3kzv s ASP 182 Cb -0.16 -2.53 -0.05 0.00 -0.30 0.00 0.00 42.92 39.88 3kzv s ASP 182 CO 0.09 -1.47 -0.04 0.42 -0.17 0.00 0.00 175.17 174.00 3kzv s THR 183 N 5.92 1.06 0.15 1.71 -4.23 -1.26 -0.48 115.64 118.51 3kzv s THR 183 Ca 0.73 -2.04 -0.31 0.00 -1.18 0.00 0.00 61.69 58.88 3kzv s THR 183 Cb -0.22 -2.15 -0.10 0.00 1.34 0.00 0.00 72.50 71.38 3kzv s THR 183 CO 0.32 -0.49 1.54 -0.62 -0.54 0.00 0.00 174.62 174.82 3kzv s ASP 184 N -3.25 6.63 0.06 3.99 -1.08 -1.26 -4.16 116.67 117.60 3kzv s ASP 184 Ca 0.24 2.56 0.22 0.00 -0.52 0.00 0.00 52.55 55.05 3kzv s ASP 184 Cb 0.05 -2.59 -0.07 0.00 -1.46 0.00 0.00 42.92 38.85 3kzv s ASP 184 CO 0.05 -0.79 0.89 0.23 0.52 0.00 0.00 175.17 176.08 3kzv n MET 185 N 3.98 0.41 -2.24 4.34 2.81 -1.26 -4.92 117.12 120.23 3kzv n MET 185 Ca 0.13 -0.03 -0.41 0.00 -1.81 0.00 0.00 57.70 55.59 3kzv n MET 185 Cb 0.39 -1.61 -0.03 0.00 -0.71 0.00 0.00 33.22 31.26 3kzv n MET 185 CO 0.00 0.00 0.00 -0.65 1.51 0.00 0.00 175.97 176.83 3kzv s GLN 186 N -3.29 4.45 -0.01 0.03 -0.21 -1.26 -4.94 119.66 114.44 3kzv s GLN 186 Ca 0.00 2.07 -0.30 0.00 0.02 0.00 0.00 55.36 57.15 3kzv s GLN 186 Cb 0.14 -3.12 -0.06 0.00 1.00 0.00 0.00 33.01 30.96 3kzv s GLN 186 CO 0.83 -0.06 1.64 0.08 -2.12 0.00 0.00 175.29 175.66 3kzv s VAL 187 N -1.04 3.42 0.05 1.09 1.01 -1.26 -4.97 120.40 118.69 3kzv s VAL 187 Ca 0.48 0.65 0.05 0.00 0.00 0.00 0.00 61.98 63.16 3kzv s VAL 187 Cb -0.37 -3.42 -0.02 0.00 0.00 0.00 0.00 36.38 32.57 3kzv s VAL 187 CO 0.48 -0.04 -0.15 0.20 0.00 0.00 0.00 175.10 175.59 3kzv s ASN 188 N 2.98 1.76 0.31 3.32 0.01 -1.26 -5.12 114.94 116.93 3kzv s ASN 188 Ca 0.73 -0.49 -0.30 0.00 -0.71 0.00 0.00 52.86 52.09 3kzv s ASN 188 Cb -0.35 -0.11 -0.12 0.00 0.41 0.00 0.00 41.25 41.08 3kzv s ASN 188 CO 0.31 0.03 1.51 -0.38 -1.51 0.00 0.00 177.10 177.05 3kzv n ILE 189 N 1.77 1.31 -1.72 0.60 2.08 -1.26 -4.98 119.36 117.17 3kzv n ILE 189 Ca -0.18 -0.33 -0.40 0.00 0.56 0.00 0.00 62.75 62.40 3kzv n ILE 189 Cb 0.54 -1.84 0.03 0.00 -0.75 0.00 0.00 39.64 37.62 3kzv n ILE 189 CO 0.00 0.00 0.00 0.54 0.56 0.00 0.00 176.55 177.65 3kzv n ARG 190 N 1.61 1.81 -4.04 0.38 1.74 -1.26 -5.03 116.66 111.88 3kzv n ARG 190 Ca 0.07 0.65 -0.31 0.00 -0.77 0.00 0.00 57.85 57.50 3kzv n ARG 190 Cb 0.36 -2.47 -0.06 0.00 -1.02 0.00 0.00 32.46 29.26 3kzv n ARG 190 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 3kzv s GLU 191 N -2.53 2.91 -0.47 5.56 2.12 -1.26 -5.05 118.70 119.98 3kzv s GLU 191 Ca 0.66 -0.67 -0.29 0.00 0.36 0.00 0.00 54.97 55.03 3kzv s GLU 191 Cb -0.46 -2.75 0.02 0.00 0.26 0.00 0.00 34.13 31.21 3kzv s GLU 191 CO 0.54 0.57 1.21 1.21 -0.54 0.00 0.00 175.26 178.25 3kzv s ASN 192 N -2.39 6.54 -0.20 -1.70 2.47 -1.26 -4.99 114.94 113.41 3kzv s ASN 192 Ca 0.30 0.53 -0.01 0.00 0.42 0.00 0.00 52.86 54.10 3kzv s ASN 192 Cb -0.12 -2.55 0.01 0.00 -1.45 0.00 0.00 41.25 37.14 3kzv s ASN 192 CO 0.22 -1.32 -0.14 -0.69 -3.72 0.00 0.00 177.10 171.46 3kzv s VAL 193 N 4.75 2.58 0.63 -5.21 1.01 -1.26 -5.13 120.40 117.77 3kzv s VAL 193 Ca 0.51 -0.78 -0.08 0.00 0.00 0.00 0.00 61.98 61.63 3kzv s VAL 193 Cb -0.09 -2.13 0.01 0.00 0.00 0.00 0.00 36.38 34.17 3kzv s VAL 193 CO 0.32 0.48 0.97 -0.83 0.00 0.00 0.00 175.10 176.04 3kzv s GLY 194 N 1.36 1.61 0.37 4.51 0.00 -1.26 -4.89 107.32 109.02 3kzv s GLY 194 Ca 0.05 -0.57 0.27 0.00 0.00 0.00 0.00 44.72 44.47 3kzv s GLY 194 CO -0.09 -0.26 1.82 -0.56 0.00 0.00 0.00 173.10 174.01 3kzv h PRO 195 N -0.34 0.00 0.00 2.90 0.13 -1.96 -1.39 132.00 131.34 3kzv h PRO 195 Ca -0.45 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.67 3kzv h PRO 195 Cb 1.26 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.38 3kzv h PRO 195 CO 0.62 0.00 -0.04 0.77 -0.23 0.00 0.00 178.00 179.12 3kzv h SER 196 N 0.00 0.00 0.07 1.44 0.02 -1.94 -3.33 113.55 109.81 3kzv h SER 196 Ca 0.00 0.00 -0.36 0.00 -0.84 0.00 0.00 61.79 60.59 3kzv h SER 196 Cb 0.43 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 62.93 3kzv h SER 196 CO 0.00 0.04 -2.07 -0.24 -1.14 0.00 0.00 176.83 173.42 3kzv n SER 197 N -3.13 2.05 -3.79 3.07 2.88 -0.55 -0.57 113.62 113.57 3kzv n SER 197 Ca 0.01 0.16 -0.13 0.00 -1.33 0.00 0.00 58.87 57.58 3kzv n SER 197 Cb 0.39 -0.76 -0.12 0.00 -0.75 0.00 0.00 64.21 62.96 3kzv n SER 197 CO 0.00 0.00 0.00 -0.04 -1.23 0.00 0.00 175.04 173.77 3kzv s MET 198 N -2.52 0.23 1.00 -1.46 -1.94 -1.05 -3.27 119.30 110.28 3kzv s MET 198 Ca -0.28 0.32 -0.11 0.00 -1.71 0.00 0.00 55.69 53.91 3kzv s MET 198 Cb 0.08 0.07 0.19 0.00 2.01 0.00 0.00 34.83 37.18 3kzv s MET 198 CO 0.69 -0.05 1.09 -1.54 -0.01 0.00 0.00 175.02 175.19 3kzv s SER 199 N 0.31 2.39 0.25 3.03 1.04 -1.26 -4.11 113.70 115.35 3kzv s SER 199 Ca -0.02 1.75 -0.04 0.00 0.48 0.00 0.00 55.95 58.13 3kzv s SER 199 Cb -0.03 -2.37 0.39 0.00 0.10 0.00 0.00 66.02 64.11 3kzv s SER 199 CO -0.01 -3.36 1.85 0.00 0.98 0.00 0.00 173.24 172.69 3kzv h ALA 200 N -2.05 1.27 -0.46 5.32 0.00 -1.95 -0.60 119.26 120.79 3kzv h ALA 200 Ca -0.52 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.35 3kzv h ALA 200 Cb 1.29 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.84 3kzv h ALA 200 CO 0.48 0.27 0.13 0.93 0.00 0.00 0.00 179.25 181.07 3kzv h GLU 201 N 0.98 0.72 -0.42 0.00 5.08 -1.99 0.01 114.58 118.97 3kzv h GLU 201 Ca 0.41 -0.16 -0.01 0.00 -1.00 0.00 0.00 59.36 58.59 3kzv h GLU 201 Cb 0.24 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.37 3kzv h GLU 201 CO -0.20 0.70 0.21 1.96 -1.00 0.00 0.00 179.01 180.68 3kzv h GLN 202 N 0.61 0.60 -0.41 2.33 4.20 -1.71 -1.15 115.11 119.57 3kzv h GLN 202 Ca 0.15 -0.08 -0.02 0.00 0.06 0.00 0.00 58.65 58.76 3kzv h GLN 202 Cb 0.29 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 27.94 3kzv h GLN 202 CO -0.00 0.51 0.19 1.25 -0.67 0.00 0.00 178.83 180.11 3kzv h LEU 203 N 0.54 0.54 -0.51 1.46 5.85 -1.01 -0.07 115.31 122.10 3kzv h LEU 203 Ca 0.14 -0.13 -0.03 0.00 0.84 0.00 0.00 57.88 58.70 3kzv h LEU 203 Cb 0.10 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 40.97 3kzv h LEU 203 CO -0.02 0.52 0.20 0.50 -0.34 0.00 0.00 178.44 179.30 3kzv h LYS 204 N 0.52 0.77 -0.49 1.25 3.64 -0.86 -1.51 116.57 119.88 3kzv h LYS 204 Ca 0.14 -0.14 -0.05 0.00 -1.27 0.00 0.00 60.65 59.33 3kzv h LYS 204 Cb 0.13 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 31.80 3kzv h LYS 204 CO -0.02 0.68 0.11 1.98 -2.27 0.00 0.00 179.45 179.93 3kzv h MET 205 N 0.69 0.80 -0.61 1.90 4.05 -1.11 -1.79 114.93 118.87 3kzv h MET 205 Ca 0.17 -0.20 0.07 0.00 -0.28 0.00 0.00 59.70 59.46 3kzv h MET 205 Cb 0.20 -0.10 -0.06 0.00 -0.80 0.00 0.00 31.60 30.84 3kzv h MET 205 CO -0.01 0.78 0.29 0.35 0.23 0.00 0.00 176.91 178.55 3kzv h PHE 206 N 0.68 0.53 -0.13 1.39 3.57 -0.83 0.26 116.94 122.41 3kzv h PHE 206 Ca 0.15 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.62 3kzv h PHE 206 Cb 0.35 -0.15 -0.00 0.00 2.79 0.00 0.00 35.95 38.95 3kzv h PHE 206 CO 0.02 0.22 -0.14 0.00 -2.23 0.00 0.00 178.31 176.19 3kzv h ARG 207 N 0.54 0.32 -0.43 1.11 3.08 -1.14 -0.75 114.38 117.09 3kzv h ARG 207 Ca 0.28 -0.17 0.09 0.00 0.07 0.00 0.00 59.98 60.25 3kzv h ARG 207 Cb 0.25 0.01 -0.09 0.00 0.08 0.00 0.00 29.97 30.22 3kzv h ARG 207 CO -0.22 0.72 -0.22 0.78 -1.07 0.00 0.00 179.97 179.95 3kzv h GLY 208 N -0.07 0.06 0.95 0.04 0.00 -0.89 0.27 103.07 103.43 3kzv h GLY 208 Ca 0.02 0.29 -0.00 0.00 0.00 0.00 0.00 47.33 47.63 3kzv h GLY 208 CO 0.03 -0.21 0.10 1.41 0.00 0.00 0.00 176.54 177.87 3kzv h LEU 209 N -0.14 0.21 0.05 3.11 4.07 -0.34 -2.86 115.31 119.41 3kzv h LEU 209 Ca 0.21 -0.06 0.00 0.00 0.08 0.00 0.00 57.88 58.11 3kzv h LEU 209 Cb 0.46 -0.05 -0.01 0.00 1.08 0.00 0.00 40.66 42.14 3kzv h LEU 209 CO -0.52 0.21 -0.06 0.50 -1.08 0.00 0.00 178.44 177.49 3kzv h LYS 210 N 0.19 -0.12 -0.21 1.13 3.64 -0.79 -0.78 116.57 119.63 3kzv h LYS 210 Ca 0.06 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.45 3kzv h LYS 210 Cb 0.05 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 31.89 3kzv h LYS 210 CO -0.01 -0.08 0.00 -1.91 -2.27 0.00 0.00 179.45 175.18 3kzv n GLU 211 N -5.17 0.45 0.00 1.90 2.13 0.91 -2.30 120.64 118.55 3kzv n GLU 211 Ca -0.07 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.75 3kzv n GLU 211 Cb 0.10 -1.10 0.00 0.00 0.27 0.00 0.00 31.44 30.71 3kzv n GLU 211 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 3kzv n ASN 212 N -0.14 3.23 -4.80 4.31 3.02 -0.60 -5.01 115.26 115.27 3kzv n ASN 212 Ca 0.00 0.00 -0.32 0.00 -0.03 0.00 0.00 54.58 54.23 3kzv n ASN 212 Cb 0.05 0.29 0.03 0.00 -0.61 0.00 0.00 39.78 39.55 3kzv n ASN 212 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 3kzv s ASN 213 N -2.48 5.46 0.00 6.41 0.01 -0.40 -5.09 114.94 118.84 3kzv s ASN 213 Ca 0.00 1.80 0.00 0.00 -0.71 0.00 0.00 52.86 53.95 3kzv s ASN 213 Cb 0.00 -2.53 0.00 0.00 0.41 0.00 0.00 41.25 39.13 3kzv s ASN 213 CO 0.00 -1.39 0.00 -0.24 -1.51 0.00 0.00 177.10 173.96 3kzv n SER 218 N -2.50 0.00 0.23 -1.22 2.88 -1.26 -4.84 113.62 106.91 3kzv n SER 218 Ca 0.09 0.00 0.07 0.00 -1.33 0.00 0.00 58.87 57.70 3kzv n SER 218 Cb 0.53 0.00 0.57 0.00 -0.75 0.00 0.00 64.21 64.55 3kzv n SER 218 CO 0.00 0.00 0.00 -1.28 -1.23 0.00 0.00 175.04 172.53 3kzv h SER 219 N 1.96 0.00 0.25 -3.46 0.87 -1.98 -1.10 113.55 110.10 3kzv h SER 219 Ca 0.00 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.55 3kzv h SER 219 Cb 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.96 3kzv h SER 219 CO 0.00 0.17 -0.12 0.58 -0.53 0.00 0.00 176.83 176.93 3kzv h VAL 220 N 0.00 0.55 -0.13 2.23 2.07 -2.00 -2.45 116.25 116.52 3kzv h VAL 220 Ca -0.00 -0.90 -0.07 0.00 0.82 0.00 0.00 66.70 66.55 3kzv h VAL 220 Cb 0.33 0.91 -0.01 0.00 -1.52 0.00 0.00 31.29 30.99 3kzv h VAL 220 CO 0.02 0.14 -0.22 1.55 0.02 0.00 0.00 177.57 179.08 3kzv h PRO 221 N -0.95 0.22 -0.58 1.57 0.13 -1.85 -2.29 132.00 128.26 3kzv h PRO 221 Ca -0.03 -0.07 0.11 0.00 -0.87 0.00 0.00 66.00 65.14 3kzv h PRO 221 Cb 0.49 -0.02 -0.03 0.00 0.13 0.00 0.00 31.00 31.56 3kzv h PRO 221 CO 0.06 0.44 0.39 0.00 -0.23 0.00 0.00 178.00 178.66 3kzv h ALA 222 N 1.57 2.10 -0.43 -0.56 0.00 -1.20 -1.62 119.26 119.13 3kzv h ALA 222 Ca 0.04 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.79 3kzv h ALA 222 Cb 0.51 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 3kzv h ALA 222 CO 0.03 -0.23 -0.30 1.15 0.00 0.00 0.00 179.25 179.90 3kzv h THR 223 N 0.33 1.27 -0.11 0.00 2.02 -0.91 -1.11 112.91 114.41 3kzv h THR 223 Ca 0.27 -1.46 0.02 0.00 0.77 0.00 0.00 66.41 66.01 3kzv h THR 223 Cb 0.62 1.25 -0.02 0.00 -1.74 0.00 0.00 68.15 68.26 3kzv h THR 223 CO -0.07 0.50 -0.04 0.58 0.37 0.00 0.00 175.52 176.86 3kzv h VAL 224 N 0.79 0.87 -0.76 3.16 2.07 -1.14 0.40 116.25 121.63 3kzv h VAL 224 Ca 0.09 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.59 3kzv h VAL 224 Cb 0.87 0.87 -0.04 0.00 -1.52 0.00 0.00 31.29 31.48 3kzv h VAL 224 CO 0.08 0.00 0.40 1.88 0.02 0.00 0.00 177.57 179.95 3kzv h TYR 225 N -0.02 1.06 -0.49 1.57 0.05 -1.40 -0.89 116.97 116.85 3kzv h TYR 225 Ca 0.05 -0.04 -0.11 0.00 0.05 0.00 0.00 58.73 58.69 3kzv h TYR 225 Cb 0.10 -0.33 -0.02 0.00 1.01 0.00 0.00 36.73 37.49 3kzv h TYR 225 CO -0.16 0.76 -0.14 0.00 -1.05 0.00 0.00 178.16 177.56 3kzv h ALA 226 N 1.20 0.82 -0.00 3.88 0.00 -0.68 -2.08 119.26 122.40 3kzv h ALA 226 Ca 0.26 -0.35 -0.18 0.00 0.00 0.00 0.00 54.91 54.64 3kzv h ALA 226 Cb 0.07 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 3kzv h ALA 226 CO -0.04 0.65 -0.80 0.87 0.00 0.00 0.00 179.25 179.93 3kzv h LYS 227 N 0.83 0.10 -0.31 0.00 1.57 0.07 -0.74 116.57 118.09 3kzv h LYS 227 Ca 0.13 -0.10 -0.03 0.00 -1.87 0.00 0.00 60.65 58.77 3kzv h LYS 227 Cb 0.68 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.01 3kzv h LYS 227 CO 0.05 0.85 0.07 -0.07 -0.57 0.00 0.00 179.45 179.77 3kzv h LEU 228 N 0.06 0.47 -0.85 2.94 3.38 -1.06 0.49 115.31 120.74 3kzv h LEU 228 Ca -0.02 -0.24 -0.03 0.00 0.09 0.00 0.00 57.88 57.68 3kzv h LEU 228 Cb 1.40 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 41.99 3kzv h LEU 228 CO 0.11 0.59 0.42 0.00 0.09 0.00 0.00 178.44 179.66 3kzv h ALA 229 N 0.90 1.10 -0.01 1.53 0.00 -1.16 -0.16 119.26 121.45 3kzv h ALA 229 Ca 0.10 -0.16 -0.13 0.00 0.00 0.00 0.00 54.91 54.72 3kzv h ALA 229 Cb 0.31 -0.34 0.01 0.00 0.00 0.00 0.00 17.79 17.77 3kzv h ALA 229 CO 0.00 0.65 -0.49 -0.07 0.00 0.00 0.00 179.25 179.35 3kzv h LEU 230 N 1.21 0.45 0.00 0.00 3.38 -1.00 -3.39 115.31 115.96 3kzv h LEU 230 Ca 0.29 -0.75 0.00 0.00 0.09 0.00 0.00 57.88 57.51 3kzv h LEU 230 Cb 0.10 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.72 3kzv h LEU 230 CO -0.04 1.14 -1.58 1.41 0.09 0.00 0.00 178.44 179.46 3kzv n HIS 231 N -4.30 0.00 0.00 1.13 8.25 0.15 -5.02 115.22 115.42 3kzv n HIS 231 Ca -0.10 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.36 3kzv n HIS 231 Cb 0.62 -0.29 0.00 0.00 1.12 0.00 0.00 29.99 31.44 3kzv n HIS 231 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3kzv n GLY 232 N 1.36 2.34 3.69 -1.41 0.00 -0.07 -5.00 105.19 106.10 3kzv n GLY 232 Ca -0.01 -1.81 -0.41 0.00 0.00 0.00 0.00 46.02 43.79 3kzv n GLY 232 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3kzv s ILE 233 N -2.42 4.90 0.53 -0.61 1.01 -1.25 -4.72 121.20 118.65 3kzv s ILE 233 Ca 0.00 1.75 -0.22 0.00 0.00 0.00 0.00 60.65 62.19 3kzv s ILE 233 Cb 0.00 -4.18 -0.05 0.00 0.01 0.00 0.00 42.46 38.23 3kzv s ILE 233 CO 0.00 0.11 1.28 -2.84 0.00 0.00 0.00 174.94 173.49 3kzv s PRO 234 N 1.53 3.29 0.24 2.79 0.02 -1.26 -4.87 135.00 136.74 3kzv s PRO 234 Ca 0.43 2.04 -0.05 0.00 0.02 0.00 0.00 61.00 63.43 3kzv s PRO 234 Cb -0.18 -2.25 0.35 0.00 0.02 0.00 0.00 34.50 32.45 3kzv s PRO 234 CO 0.18 -1.01 1.83 0.22 -0.33 0.00 0.00 177.00 177.89 3kzv h ASP 235 N 1.54 0.73 0.37 2.53 3.58 -1.98 -0.62 116.42 122.58 3kzv h ASP 235 Ca -0.50 0.03 0.00 0.00 0.42 0.00 0.00 57.03 56.98 3kzv h ASP 235 Cb 1.28 -0.12 0.00 0.00 1.72 0.00 0.00 39.33 42.22 3kzv h ASP 235 CO 0.58 0.45 0.00 1.23 -2.88 0.00 0.00 179.24 178.61 3kzv h GLY 236 N 0.86 0.00 -0.73 -0.78 0.00 -2.02 -1.85 103.07 98.55 3kzv h GLY 236 Ca 0.38 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.71 3kzv h GLY 236 CO -0.21 0.00 0.00 3.33 0.00 0.00 0.00 176.54 179.66 3kzv n VAL 237 N -2.64 0.98 -1.84 4.60 0.24 -0.29 -4.98 118.33 114.39 3kzv n VAL 237 Ca -0.01 -0.99 -0.41 0.00 -2.04 0.00 0.00 64.34 60.89 3kzv n VAL 237 Cb 0.14 0.51 -0.01 0.00 -1.47 0.00 0.00 33.84 33.02 3kzv n VAL 237 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 3kzv s ASN 238 N -0.99 6.42 0.00 -1.34 2.47 -0.70 -1.60 114.94 119.21 3kzv s ASN 238 Ca 0.13 2.94 0.00 0.00 0.42 0.00 0.00 52.86 56.35 3kzv s ASN 238 Cb 0.07 -2.65 0.00 0.00 -1.45 0.00 0.00 41.25 37.22 3kzv s ASN 238 CO 0.09 -0.85 0.00 0.61 -3.72 0.00 0.00 177.10 173.23 3kzv n GLY 239 N 1.45 2.19 4.00 1.21 0.00 0.10 -4.97 105.19 109.18 3kzv n GLY 239 Ca 0.05 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.89 3kzv n GLY 239 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3kzv s GLN 240 N -0.25 2.75 -0.08 1.61 -0.21 -0.63 -3.01 119.66 119.84 3kzv s GLN 240 Ca 0.00 -1.16 0.04 0.00 0.02 0.00 0.00 55.36 54.26 3kzv s GLN 240 Cb 0.00 -2.70 0.00 0.00 1.00 0.00 0.00 33.01 31.31 3kzv s GLN 240 CO 0.00 -0.38 -0.21 -0.47 -2.12 0.00 0.00 175.29 172.11 3kzv s TYR 241 N -2.45 2.23 0.01 0.91 5.04 -1.26 -1.23 117.35 120.60 3kzv s TYR 241 Ca 0.56 -0.84 -0.13 0.00 -2.44 0.00 0.00 57.07 54.22 3kzv s TYR 241 Cb -0.10 -1.51 0.02 0.00 0.35 0.00 0.00 41.96 40.72 3kzv s TYR 241 CO 0.34 -0.33 0.27 -0.51 -1.34 0.00 0.00 175.55 173.99 3kzv s LEU 242 N 0.28 1.01 0.62 6.97 1.43 -0.27 -4.98 118.68 123.74 3kzv s LEU 242 Ca -0.14 -0.07 -0.17 0.00 -1.03 0.00 0.00 54.13 52.73 3kzv s LEU 242 Cb -0.16 1.17 -0.02 0.00 0.03 0.00 0.00 46.19 47.21 3kzv s LEU 242 CO 0.06 -0.49 1.14 -0.44 0.23 0.00 0.00 176.35 176.86 3kzv s SER 243 N -1.59 5.19 0.57 2.29 0.01 -1.26 -0.91 113.70 118.01 3kzv s SER 243 Ca -0.11 2.15 0.30 0.00 1.31 0.00 0.00 55.95 59.61 3kzv s SER 243 Cb -0.04 -2.57 1.70 0.00 0.21 0.00 0.00 66.02 65.32 3kzv s SER 243 CO 0.01 -1.58 2.18 0.10 0.41 0.00 0.00 173.24 174.37 3kzv h TYR 244 N 0.47 0.00 -0.66 2.43 -0.00 -1.50 -0.40 116.97 117.32 3kzv h TYR 244 Ca -0.48 0.00 -0.11 0.00 0.00 0.00 0.00 58.73 58.13 3kzv h TYR 244 Cb 1.26 0.00 -0.07 0.00 0.00 0.00 0.00 36.73 37.93 3kzv h TYR 244 CO 0.51 0.05 0.15 0.27 -0.00 0.00 0.00 178.16 179.14 3kzv n ASN 245 N -3.68 5.25 -4.76 0.10 0.23 -1.26 -4.82 115.26 106.32 3kzv n ASN 245 Ca -0.02 -3.07 -0.40 0.00 -0.53 0.00 0.00 54.58 50.55 3kzv n ASN 245 Cb 0.15 -0.72 -0.04 0.00 -2.08 0.00 0.00 39.78 37.09 3kzv n ASN 245 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 3kzv s ASP 246 N -0.87 7.19 0.58 0.53 2.15 -0.16 -4.92 116.67 121.17 3kzv s ASP 246 Ca 0.54 2.32 0.28 0.00 0.43 0.00 0.00 52.55 56.12 3kzv s ASP 246 Cb 0.42 -2.63 1.64 0.00 -0.30 0.00 0.00 42.92 42.06 3kzv s ASP 246 CO 0.15 -0.21 2.11 -0.65 -0.17 0.00 0.00 175.17 176.40 3kzv h PRO 247 N 3.87 0.00 0.00 4.34 0.11 -1.92 0.19 132.00 138.59 3kzv h PRO 247 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3kzv h PRO 247 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 3kzv h PRO 247 CO 0.67 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.46 3kzv h ALA 248 N 1.80 1.00 -0.38 -0.75 0.00 -1.96 -0.88 119.26 118.09 3kzv h ALA 248 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.99 3kzv h ALA 248 Cb 0.44 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.23 3kzv h ALA 248 CO -0.00 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.53 3kzv n LEU 249 N -2.40 3.36 -0.34 0.00 4.77 0.66 -4.67 117.00 118.37 3kzv n LEU 249 Ca -0.01 -1.55 0.30 0.00 -0.03 0.00 0.00 56.01 54.72 3kzv n LEU 249 Cb 0.09 -0.25 0.56 0.00 -2.33 0.00 0.00 43.42 41.49 3kzv n LEU 249 CO 0.14 0.74 1.11 0.00 -1.33 0.00 0.00 177.39 178.04 3kzv h ALA 250 N 4.09 2.17 0.00 -1.18 0.00 -1.22 0.10 119.26 123.23 3kzv h ALA 250 Ca 0.00 0.22 0.00 0.00 0.00 0.00 0.00 54.91 55.13 3kzv h ALA 250 Cb 0.93 0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.97 3kzv h ALA 250 CO 0.00 -0.87 0.00 -0.25 0.00 0.00 0.00 179.25 178.13 3kzv n ASP 251 N -5.10 0.00 -0.78 0.00 8.00 -1.26 -2.69 116.55 114.73 3kzv n ASP 251 Ca 0.36 -0.45 0.09 0.00 0.71 0.00 0.00 54.79 55.49 3kzv n ASP 251 Cb 1.20 -0.17 0.11 0.00 -0.02 0.00 0.00 41.12 42.24 3kzv n ASP 251 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3kzv n PHE 252 N -1.17 0.15 -1.51 1.24 3.72 0.36 -4.98 117.46 115.26 3kzv n PHE 252 Ca 0.17 -0.10 -0.30 0.00 -0.05 0.00 0.00 57.45 57.17 3kzv n PHE 252 Cb 0.18 -0.00 0.10 0.00 -0.94 0.00 0.00 39.48 38.81 3kzv n PHE 252 CO 0.00 0.00 0.00 -1.64 -0.05 0.00 0.00 176.76 175.07 3kzv s MET 253 N -1.40 1.99 0.00 -1.08 -1.94 -1.09 -3.05 119.30 112.72 3kzv s MET 253 Ca 0.24 0.67 0.00 0.00 -1.71 0.00 0.00 55.69 54.89 3kzv s MET 253 Cb 0.16 -1.90 0.00 0.00 2.01 0.00 0.00 34.83 35.09 3kzv s MET 253 CO 0.23 -1.70 0.28 -2.30 -0.01 0.00 0.00 175.02 171.53