#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k4y s LEU 2 N 0.00 3.72 -0.05 3.17 2.96 -1.26 -1.79 118.68 125.43 3k4y s LEU 2 Ca 0.00 -0.06 0.01 0.00 -0.22 0.00 0.00 54.13 53.86 3k4y s LEU 2 Cb 0.00 -1.99 -0.03 0.00 0.50 0.00 0.00 46.19 44.67 3k4y s LEU 2 CO 0.00 0.03 -0.05 -0.89 -1.32 0.00 0.00 176.35 174.12 3k4y s THR 3 N 1.27 3.87 -0.18 3.68 2.01 0.41 -1.21 115.64 125.49 3k4y s THR 3 Ca 0.06 -0.50 0.01 0.00 0.31 0.00 0.00 61.69 61.57 3k4y s THR 3 Cb -0.14 -2.63 0.02 0.00 0.01 0.00 0.00 72.50 69.76 3k4y s THR 3 CO 0.05 0.54 -0.19 -0.63 -0.69 0.00 0.00 174.62 173.70 3k4y s ILE 4 N -0.89 1.98 -0.24 1.82 1.01 0.16 -0.87 121.20 124.17 3k4y s ILE 4 Ca 0.14 -0.92 -0.06 0.00 0.00 0.00 0.00 60.65 59.81 3k4y s ILE 4 Cb -0.11 -1.81 -0.02 0.00 0.01 0.00 0.00 42.46 40.52 3k4y s ILE 4 CO 0.04 0.50 0.03 -0.22 0.00 0.00 0.00 174.94 175.29 3k4y s LEU 5 N 1.32 3.26 -0.29 2.97 2.96 0.43 0.28 118.68 129.60 3k4y s LEU 5 Ca 0.04 -0.26 -0.14 0.00 -0.22 0.00 0.00 54.13 53.55 3k4y s LEU 5 Cb -0.13 -1.86 -0.03 0.00 0.50 0.00 0.00 46.19 44.66 3k4y s LEU 5 CO -0.12 -0.03 0.34 -0.75 -1.32 0.00 0.00 176.35 174.47 3k4y s LYS 6 N 1.55 3.87 -0.79 1.98 2.20 0.17 -1.45 119.74 127.27 3k4y s LYS 6 Ca 0.06 -0.15 -0.20 0.00 -0.36 0.00 0.00 55.97 55.32 3k4y s LYS 6 Cb -0.15 -3.70 0.11 0.00 -1.51 0.00 0.00 37.83 32.58 3k4y s LYS 6 CO 0.01 -0.34 1.01 -0.51 -0.36 0.00 0.00 175.35 175.16 3k4y s LEU 7 N 2.01 4.88 0.00 5.43 1.43 0.68 -1.69 118.68 131.43 3k4y s LEU 7 Ca 0.13 -1.60 0.00 0.00 -1.03 0.00 0.00 54.13 51.63 3k4y s LEU 7 Cb -0.16 -2.39 0.00 0.00 0.03 0.00 0.00 46.19 43.67 3k4y s LEU 7 CO 0.11 -1.20 0.00 0.61 0.23 0.00 0.00 176.35 176.10 3k4y n GLY 8 N 5.38 4.80 7.00 -3.19 0.00 -0.81 -4.06 105.19 114.32 3k4y n GLY 8 Ca 0.09 -1.58 0.00 0.00 0.00 0.00 0.00 46.02 44.53 3k4y n GLY 8 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k4y n GLY 9 N 5.00 2.24 0.77 -0.02 0.00 -1.25 -2.14 105.19 109.78 3k4y n GLY 9 Ca 0.00 -0.14 0.06 0.00 0.00 0.00 0.00 46.02 45.93 3k4y n GLY 9 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3k4y n SER 10 N 0.37 1.57 0.25 1.61 3.41 -1.26 -4.86 113.62 114.71 3k4y n SER 10 Ca 0.00 -3.44 0.09 0.00 -0.26 0.00 0.00 58.87 55.26 3k4y n SER 10 Cb 0.00 -0.47 0.65 0.00 -0.26 0.00 0.00 64.21 64.13 3k4y n SER 10 CO 0.00 0.00 0.00 0.16 -0.16 0.00 0.00 175.04 175.04 3k4y h ILE 11 N 2.31 0.91 0.00 -1.33 3.07 -1.79 -2.65 117.51 118.03 3k4y h ILE 11 Ca -0.05 -0.30 -0.08 0.00 1.55 0.00 0.00 64.86 65.97 3k4y h ILE 11 Cb 1.20 1.17 -0.01 0.00 -0.27 0.00 0.00 36.82 38.90 3k4y h ILE 11 CO 0.02 0.08 -1.55 0.18 -1.05 0.00 0.00 178.15 175.83 3k4y n LEU 12 N -4.22 0.51 -3.63 0.16 4.77 -1.26 -4.63 117.00 108.70 3k4y n LEU 12 Ca -0.03 0.21 -0.11 0.00 -0.03 0.00 0.00 56.01 56.05 3k4y n LEU 12 Cb 0.17 0.05 -0.07 0.00 -2.33 0.00 0.00 43.42 41.24 3k4y n LEU 12 CO 0.33 0.03 0.48 -0.55 -1.33 0.00 0.00 177.39 176.34 3k4y s SER 13 N -5.23 -0.73 -0.56 -1.43 0.15 -1.00 -0.86 113.70 104.04 3k4y s SER 13 Ca -0.04 1.32 -0.21 0.00 0.70 0.00 0.00 55.95 57.72 3k4y s SER 13 Cb 0.10 1.33 0.06 0.00 -1.71 0.00 0.00 66.02 65.80 3k4y s SER 13 CO 0.84 -0.22 0.80 -0.62 1.20 0.00 0.00 173.24 175.24 3k4y s ASP 14 N 0.68 6.25 0.20 5.45 -1.08 -1.26 -4.61 116.67 122.29 3k4y s ASP 14 Ca -0.02 -0.80 0.17 0.00 -0.52 0.00 0.00 52.55 51.37 3k4y s ASP 14 Cb -0.05 -2.36 0.80 0.00 -1.46 0.00 0.00 42.92 39.85 3k4y s ASP 14 CO -0.06 -1.13 1.51 2.29 0.52 0.00 0.00 175.17 178.30 3k4y n LYS 15 N 6.91 0.11 0.00 4.34 2.85 -1.26 -0.63 118.16 130.47 3k4y n LYS 15 Ca -0.04 0.51 0.13 0.00 -1.05 0.00 0.00 58.31 57.87 3k4y n LYS 15 Cb 0.46 -1.78 0.43 0.00 -0.65 0.00 0.00 35.03 33.49 3k4y n LYS 15 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 3k4y n ASN 16 N -2.00 1.33 -4.06 -5.58 3.02 -1.26 -4.59 115.26 102.12 3k4y n ASN 16 Ca 0.00 -1.22 -0.32 0.00 -0.03 0.00 0.00 54.58 53.01 3k4y n ASN 16 Cb 0.09 0.07 -0.14 0.00 -0.61 0.00 0.00 39.78 39.19 3k4y n ASN 16 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3k4y s VAL 17 N -2.25 2.44 -0.32 2.41 1.01 0.20 -5.07 120.40 118.81 3k4y s VAL 17 Ca 0.31 -2.07 -0.40 0.00 0.00 0.00 0.00 61.98 59.83 3k4y s VAL 17 Cb 0.20 -2.66 -0.18 0.00 0.00 0.00 0.00 36.38 33.74 3k4y s VAL 17 CO 0.43 -0.44 1.28 -0.81 0.00 0.00 0.00 175.10 175.56 3k4y n PRO 18 N 4.37 0.00 -2.95 2.72 -0.04 -1.26 0.41 135.00 138.25 3k4y n PRO 18 Ca -0.02 0.00 -0.22 0.00 -0.04 0.00 0.00 63.50 63.22 3k4y n PRO 18 Cb 0.42 -1.31 0.02 0.00 -0.04 0.00 0.00 33.50 32.59 3k4y n PRO 18 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 3k4y n TYR 19 N 2.92 -1.76 -1.98 0.54 4.01 -0.68 -4.94 117.16 115.27 3k4y n TYR 19 Ca 0.25 0.40 -0.39 0.00 -0.16 0.00 0.00 57.90 58.00 3k4y n TYR 19 Cb -0.02 -4.06 0.01 0.00 -0.31 0.00 0.00 39.34 34.96 3k4y n TYR 19 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 3k4y s SER 20 N -2.56 6.07 -0.08 7.72 0.15 0.17 -5.01 113.70 120.15 3k4y s SER 20 Ca 0.25 2.70 -0.01 0.00 0.70 0.00 0.00 55.95 59.59 3k4y s SER 20 Cb -0.12 -2.64 0.03 0.00 -1.71 0.00 0.00 66.02 61.58 3k4y s SER 20 CO 0.31 -1.02 0.00 -0.63 1.20 0.00 0.00 173.24 173.11 3k4y s ILE 21 N -1.28 0.39 -1.34 6.45 -1.09 -1.26 -4.31 121.20 118.77 3k4y s ILE 21 Ca 0.60 0.05 -0.14 0.00 -2.23 0.00 0.00 60.65 58.93 3k4y s ILE 21 Cb -0.39 -0.59 0.09 0.00 -1.58 0.00 0.00 42.46 40.00 3k4y s ILE 21 CO 0.49 0.21 1.90 0.29 -1.23 0.00 0.00 174.94 176.61 3k4y n LYS 22 N 5.14 3.19 -0.10 2.79 5.02 -0.04 -4.82 118.16 129.33 3k4y n LYS 22 Ca -0.07 -3.17 -0.07 0.00 -2.02 0.00 0.00 58.31 52.98 3k4y n LYS 22 Cb 0.50 -3.24 -0.00 0.00 -0.02 0.00 0.00 35.03 32.27 3k4y n LYS 22 CO 0.00 0.00 0.00 -1.49 -0.52 0.00 0.00 177.40 175.39 3k4y h TRP 23 N 6.56 -0.61 -0.36 2.13 4.06 -1.94 -0.38 115.95 125.41 3k4y h TRP 23 Ca 0.46 0.05 0.03 0.00 2.06 0.00 0.00 58.89 61.49 3k4y h TRP 23 Cb 0.74 0.32 -0.03 0.00 -1.00 0.00 0.00 29.16 29.19 3k4y h TRP 23 CO 1.36 -0.31 0.17 0.22 -3.56 0.00 0.00 178.44 176.31 3k4y h ASP 24 N -0.18 0.23 -0.43 -3.49 3.58 -1.98 0.12 116.42 114.28 3k4y h ASP 24 Ca 0.18 0.02 -0.00 0.00 0.42 0.00 0.00 57.03 57.65 3k4y h ASP 24 Cb 0.46 -0.02 -0.02 0.00 1.72 0.00 0.00 39.33 41.47 3k4y h ASP 24 CO -0.47 0.18 0.26 -1.13 -2.88 0.00 0.00 179.24 175.20 3k4y h ASN 25 N 0.35 0.50 -0.53 2.28 -0.00 -1.74 -1.23 115.58 115.22 3k4y h ASN 25 Ca 0.16 -0.04 -0.05 0.00 -0.00 0.00 0.00 56.30 56.37 3k4y h ASN 25 Cb 0.08 -0.13 -0.03 0.00 -0.00 0.00 0.00 38.32 38.25 3k4y h ASN 25 CO -0.12 0.40 0.16 0.25 -0.00 0.00 0.00 177.43 178.12 3k4y h LEU 26 N 0.57 0.81 -0.36 0.34 5.85 -0.31 -0.20 115.31 122.01 3k4y h LEU 26 Ca 0.15 -0.14 -0.13 0.00 0.84 0.00 0.00 57.88 58.61 3k4y h LEU 26 Cb -0.02 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 40.79 3k4y h LEU 26 CO -0.03 0.78 -0.27 -0.33 -0.34 0.00 0.00 178.44 178.25 3k4y h GLU 27 N 0.85 0.82 -0.67 1.25 5.08 -0.51 -1.57 114.58 119.82 3k4y h GLU 27 Ca 0.19 -0.40 -0.02 0.00 -1.00 0.00 0.00 59.36 58.13 3k4y h GLU 27 Cb 0.27 -0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.49 3k4y h GLU 27 CO -0.01 1.03 0.35 -0.09 -1.00 0.00 0.00 179.01 179.30 3k4y h ARG 28 N 0.61 0.95 -0.52 2.33 2.43 -0.88 -1.76 114.38 117.55 3k4y h ARG 28 Ca 0.07 -0.12 -0.00 0.00 -0.81 0.00 0.00 59.98 59.11 3k4y h ARG 28 Cb 0.84 -0.18 -0.03 0.00 -0.42 0.00 0.00 29.97 30.19 3k4y h ARG 28 CO 0.07 0.73 0.32 0.82 -1.51 0.00 0.00 179.97 180.41 3k4y h ILE 29 N 0.93 1.15 -0.49 1.20 2.04 -0.91 -1.04 117.51 120.38 3k4y h ILE 29 Ca 0.23 -0.32 0.03 0.00 1.00 0.00 0.00 64.86 65.80 3k4y h ILE 29 Cb 0.07 0.43 -0.04 0.00 -0.74 0.00 0.00 36.82 36.55 3k4y h ILE 29 CO -0.03 0.15 0.27 0.00 0.00 0.00 0.00 178.15 178.54 3k4y h ALA 30 N 1.16 0.63 0.06 1.87 0.00 -1.06 -0.88 119.26 121.04 3k4y h ALA 30 Ca 0.19 0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.12 3k4y h ALA 30 Cb -0.03 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 17.60 3k4y h ALA 30 CO -0.04 -0.05 -0.50 0.52 0.00 0.00 0.00 179.25 179.18 3k4y h MET 31 N 0.54 -0.66 -0.54 0.00 2.86 -0.54 0.28 114.93 116.88 3k4y h MET 31 Ca 0.21 0.05 0.08 0.00 -2.06 0.00 0.00 59.70 57.97 3k4y h MET 31 Cb 0.07 0.15 -0.06 0.00 0.06 0.00 0.00 31.60 31.82 3k4y h MET 31 CO -0.12 -0.44 0.19 0.93 1.06 0.00 0.00 176.91 178.53 3k4y h GLU 32 N -0.69 0.36 -0.65 1.72 5.08 -0.91 0.84 114.58 120.34 3k4y h GLU 32 Ca 0.01 -0.02 0.08 0.00 -1.00 0.00 0.00 59.36 58.43 3k4y h GLU 32 Cb 0.72 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.85 3k4y h GLU 32 CO -0.32 0.24 0.43 0.82 -1.00 0.00 0.00 179.01 179.18 3k4y h ILE 33 N 0.37 0.97 0.17 3.13 2.04 -0.87 0.24 117.51 123.56 3k4y h ILE 33 Ca 0.26 -0.20 -0.01 0.00 1.00 0.00 0.00 64.86 65.91 3k4y h ILE 33 Cb 0.30 0.33 0.00 0.00 -0.74 0.00 0.00 36.82 36.71 3k4y h ILE 33 CO -0.27 0.11 -0.08 0.50 0.00 0.00 0.00 178.15 178.40 3k4y h LYS 34 N 0.58 -0.23 -0.86 2.37 1.63 0.22 -1.48 116.57 118.81 3k4y h LYS 34 Ca 0.29 0.02 0.20 0.00 -0.85 0.00 0.00 60.65 60.30 3k4y h LYS 34 Cb 0.37 0.05 -0.12 0.00 -0.60 0.00 0.00 32.23 31.93 3k4y h LYS 34 CO -0.09 0.16 0.34 -0.91 -3.45 0.00 0.00 179.45 175.51 3k4y h ASN 35 N -0.69 0.26 -0.14 4.20 2.35 0.93 0.03 115.58 122.51 3k4y h ASN 35 Ca -0.02 0.15 -0.03 0.00 -0.55 0.00 0.00 56.30 55.85 3k4y h ASN 35 Cb 0.49 0.15 -0.00 0.00 0.05 0.00 0.00 38.32 39.00 3k4y h ASN 35 CO 0.04 -0.00 -0.03 0.00 -1.65 0.00 0.00 177.43 175.79 3k4y h ALA 36 N 1.68 0.19 -0.48 -0.83 0.00 -0.91 -0.72 119.26 118.20 3k4y h ALA 36 Ca 0.52 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 55.20 3k4y h ALA 36 Cb 0.96 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.68 3k4y h ALA 36 CO -0.52 -0.06 0.29 -0.07 0.00 0.00 0.00 179.25 178.89 3k4y h LEU 37 N -0.04 0.57 -1.41 0.00 3.38 -0.37 -0.14 115.31 117.30 3k4y h LEU 37 Ca 0.04 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 3k4y h LEU 37 Cb 0.45 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 3k4y h LEU 37 CO 0.01 0.46 0.28 0.44 0.09 0.00 0.00 178.44 179.71 3k4y h ASP 38 N 0.64 0.60 0.36 -0.43 3.32 -0.97 -2.16 116.42 117.78 3k4y h ASP 38 Ca 0.17 -0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.17 3k4y h ASP 38 Cb -0.01 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.39 3k4y h ASP 38 CO -0.03 0.48 -0.17 0.22 -1.72 0.00 0.00 179.24 178.02 3k4y h TYR 39 N 0.69 -0.44 0.00 4.55 3.20 -0.21 -2.45 116.97 122.30 3k4y h TYR 39 Ca 0.18 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.03 3k4y h TYR 39 Cb 0.01 0.15 -0.00 0.00 1.54 0.00 0.00 36.73 38.43 3k4y h TYR 39 CO 0.00 -0.19 -0.02 1.88 -1.64 0.00 0.00 178.16 178.19 3k4y h TYR 40 N -0.62 0.00 0.02 -3.82 -1.99 -0.63 -0.51 116.97 109.42 3k4y h TYR 40 Ca -0.05 0.00 -0.13 0.00 2.00 0.00 0.00 58.73 60.55 3k4y h TYR 40 Cb 0.45 0.00 0.01 0.00 2.00 0.00 0.00 36.73 39.19 3k4y h TYR 40 CO -0.02 0.02 -0.51 -0.22 -0.00 0.00 0.00 178.16 177.42 3k4y h LYS 41 N 0.00 0.32 -0.13 4.88 3.64 -1.30 0.06 116.57 124.05 3k4y h LYS 41 Ca -0.00 -0.36 -0.04 0.00 -1.27 0.00 0.00 60.65 58.97 3k4y h LYS 41 Cb 0.07 0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 31.99 3k4y h LYS 41 CO 0.00 1.07 -0.11 -0.91 -2.27 0.00 0.00 179.45 177.23 3k4y h ASN 42 N -0.27 0.18 -0.36 4.20 2.35 -0.65 0.17 115.58 121.20 3k4y h ASN 42 Ca -0.07 -0.03 0.00 0.00 -0.55 0.00 0.00 56.30 55.65 3k4y h ASN 42 Cb 1.26 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 39.58 3k4y h ASN 42 CO 0.10 0.31 0.00 0.00 -1.65 0.00 0.00 177.43 176.19 3k4y n GLN 43 N -4.31 2.28 -3.82 0.81 1.13 -0.50 -4.94 117.38 108.03 3k4y n GLN 43 Ca -0.01 -1.47 -0.30 0.00 -1.94 0.00 0.00 57.00 53.28 3k4y n GLN 43 Cb 0.24 -1.51 0.01 0.00 0.11 0.00 0.00 30.24 29.09 3k4y n GLN 43 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 3k4y n ASN 44 N 0.52 -3.29 -3.98 1.08 3.02 0.05 -4.95 115.26 107.71 3k4y n ASN 44 Ca 0.13 -0.91 -0.22 0.00 -0.03 0.00 0.00 54.58 53.55 3k4y n ASN 44 Cb 0.47 -1.20 -0.16 0.00 -0.61 0.00 0.00 39.78 38.27 3k4y n ASN 44 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 3k4y s LYS 45 N -5.96 1.29 -0.11 3.52 2.20 -0.00 -5.04 119.74 115.64 3k4y s LYS 45 Ca 0.24 -0.29 -0.30 0.00 -0.36 0.00 0.00 55.97 55.26 3k4y s LYS 45 Cb -0.14 -1.13 -0.02 0.00 -1.51 0.00 0.00 37.83 35.03 3k4y s LYS 45 CO 0.72 0.01 1.17 -1.21 -0.36 0.00 0.00 175.35 175.68 3k4y s GLU 46 N 0.66 4.32 -0.12 4.03 0.41 -1.26 -4.52 118.70 122.22 3k4y s GLU 46 Ca -0.12 1.59 -0.00 0.00 -0.41 0.00 0.00 54.97 56.03 3k4y s GLU 46 Cb -0.14 -3.62 0.03 0.00 -1.78 0.00 0.00 34.13 28.61 3k4y s GLU 46 CO 0.02 -0.52 -0.07 -1.50 -0.49 0.00 0.00 175.26 172.70 3k4y s ILE 47 N 2.65 1.04 -0.10 -1.63 2.07 -1.26 -3.33 121.20 120.64 3k4y s ILE 47 Ca 0.53 -0.35 -0.14 0.00 -1.41 0.00 0.00 60.65 59.28 3k4y s ILE 47 Cb -0.22 -1.09 -0.05 0.00 0.13 0.00 0.00 42.46 41.24 3k4y s ILE 47 CO 0.18 0.32 0.34 -0.54 -1.91 0.00 0.00 174.94 173.33 3k4y s LYS 48 N 1.70 4.08 -0.05 3.50 1.02 -0.74 -5.02 119.74 124.23 3k4y s LYS 48 Ca 0.04 0.22 0.03 0.00 0.02 0.00 0.00 55.97 56.28 3k4y s LYS 48 Cb -0.13 -3.34 0.01 0.00 -0.52 0.00 0.00 37.83 33.85 3k4y s LYS 48 CO -0.08 0.42 -0.12 -1.17 -0.92 0.00 0.00 175.35 173.47 3k4y s LEU 49 N -0.13 1.71 -0.08 3.17 2.96 -1.26 -0.45 118.68 124.60 3k4y s LEU 49 Ca 0.20 -0.29 0.05 0.00 -0.22 0.00 0.00 54.13 53.87 3k4y s LEU 49 Cb -0.14 -0.80 -0.01 0.00 0.50 0.00 0.00 46.19 45.75 3k4y s LEU 49 CO 0.08 0.06 -0.24 -0.63 -1.32 0.00 0.00 176.35 174.30 3k4y s ILE 50 N 0.47 2.01 0.00 6.68 1.01 -0.05 -4.01 121.20 127.31 3k4y s ILE 50 Ca -0.11 -1.02 0.01 0.00 0.00 0.00 0.00 60.65 59.54 3k4y s ILE 50 Cb -0.14 -1.72 -0.04 0.00 0.01 0.00 0.00 42.46 40.58 3k4y s ILE 50 CO 0.03 0.55 0.01 -0.76 0.00 0.00 0.00 174.94 174.78 3k4y s LEU 51 N 0.08 3.57 -0.03 2.97 1.43 -0.99 -0.43 118.68 125.29 3k4y s LEU 51 Ca -0.11 0.01 0.02 0.00 -1.03 0.00 0.00 54.13 53.02 3k4y s LEU 51 Cb -0.16 -2.07 0.01 0.00 0.03 0.00 0.00 46.19 44.00 3k4y s LEU 51 CO 0.06 0.27 -0.08 -0.69 0.23 0.00 0.00 176.35 176.14 3k4y s VAL 52 N -1.12 0.74 0.14 -1.59 1.01 -0.53 -1.52 120.40 117.52 3k4y s VAL 52 Ca 0.20 -0.33 0.05 0.00 0.00 0.00 0.00 61.98 61.90 3k4y s VAL 52 Cb -0.12 -0.67 -0.04 0.00 0.00 0.00 0.00 36.38 35.56 3k4y s VAL 52 CO 0.11 0.24 -0.11 -1.38 0.00 0.00 0.00 175.10 173.96 3k4y s HIS 53 N 0.27 1.26 0.00 5.22 -3.43 -0.79 -0.23 115.29 117.59 3k4y s HIS 53 Ca -0.04 -0.71 0.00 0.00 -0.80 0.00 0.00 55.06 53.51 3k4y s HIS 53 Cb -0.09 -0.65 0.00 0.00 -1.43 0.00 0.00 32.58 30.41 3k4y s HIS 53 CO 0.00 0.08 0.00 0.41 -2.00 0.00 0.00 174.74 173.24 3k4y n GLY 54 N 0.05 1.02 0.10 -1.38 0.00 -1.26 -1.02 105.19 102.70 3k4y n GLY 54 Ca -0.12 -1.87 0.06 0.00 0.00 0.00 0.00 46.02 44.10 3k4y n GLY 54 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k4y n GLY 55 N 5.00 -1.32 7.00 -0.02 0.00 -1.26 -4.54 105.19 110.05 3k4y n GLY 55 Ca 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 45.82 3k4y n GLY 55 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k4y n GLY 56 N 1.29 2.47 0.47 -0.02 0.00 -1.26 -0.08 105.19 108.06 3k4y n GLY 56 Ca -0.05 -0.19 0.02 0.00 0.00 0.00 0.00 46.02 45.80 3k4y n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k4y n ALA 57 N 7.86 2.60 -0.08 4.61 0.00 -1.26 -3.94 120.51 130.30 3k4y n ALA 57 Ca 0.00 -0.29 -0.16 0.00 0.00 0.00 0.00 53.44 52.99 3k4y n ALA 57 Cb 0.00 -1.00 -0.06 0.00 0.00 0.00 0.00 19.45 18.39 3k4y n ALA 57 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3k4y n PHE 58 N -0.01 0.00 0.00 0.00 3.72 0.89 -1.68 117.46 120.38 3k4y n PHE 58 Ca 0.05 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.45 3k4y n PHE 58 Cb 0.25 -0.56 0.00 0.00 -0.94 0.00 0.00 39.48 38.23 3k4y n PHE 58 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3k4y n GLY 59 N 2.11 -1.47 0.28 1.37 0.00 -0.54 -3.70 105.19 103.24 3k4y n GLY 59 Ca -0.30 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.72 3k4y n GLY 59 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 3k4y h HIS 60 N 0.00 0.77 -0.65 1.61 3.86 -1.83 0.12 115.15 119.03 3k4y h HIS 60 Ca 0.00 0.03 0.08 0.00 -1.16 0.00 0.00 60.37 59.32 3k4y h HIS 60 Cb 0.00 -0.23 -0.07 0.00 1.06 0.00 0.00 27.41 28.17 3k4y h HIS 60 CO 0.08 0.34 0.30 -1.35 0.86 0.00 0.00 177.93 178.17 3k4y h PRO 61 N 0.74 0.52 -0.14 2.45 0.11 -1.83 0.40 132.00 134.24 3k4y h PRO 61 Ca 0.34 -0.03 -0.22 0.00 0.11 0.00 0.00 66.00 66.20 3k4y h PRO 61 Cb 0.25 -0.12 0.01 0.00 0.11 0.00 0.00 31.00 31.26 3k4y h PRO 61 CO -0.21 0.34 -0.76 0.28 -0.21 0.00 0.00 178.00 177.44 3k4y h VAL 62 N 0.53 1.28 -0.45 3.15 2.07 -1.42 -3.26 116.25 118.16 3k4y h VAL 62 Ca 0.32 -1.97 -0.10 0.00 0.82 0.00 0.00 66.70 65.77 3k4y h VAL 62 Cb 0.33 2.01 -0.02 0.00 -1.52 0.00 0.00 31.29 32.10 3k4y h VAL 62 CO -0.26 0.62 -0.13 0.00 0.02 0.00 0.00 177.57 177.82 3k4y h ALA 63 N 0.54 0.92 -0.75 1.67 0.00 -0.35 -3.10 119.26 118.19 3k4y h ALA 63 Ca -0.05 -0.34 0.17 0.00 0.00 0.00 0.00 54.91 54.69 3k4y h ALA 63 Cb 1.40 -0.17 -0.13 0.00 0.00 0.00 0.00 17.79 18.88 3k4y h ALA 63 CO 0.16 0.62 -0.03 0.87 0.00 0.00 0.00 179.25 180.87 3k4y h LYS 64 N 0.74 0.08 -0.44 0.00 1.57 -0.27 0.28 116.57 118.53 3k4y h LYS 64 Ca 0.12 -0.00 0.13 0.00 -1.87 0.00 0.00 60.65 59.02 3k4y h LYS 64 Cb 0.64 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.91 3k4y h LYS 64 CO 0.04 0.05 0.50 0.87 -0.57 0.00 0.00 179.45 180.34 3k4y h LYS 65 N 0.08 0.00 -0.26 3.15 1.57 -1.67 -1.00 116.57 118.45 3k4y h LYS 65 Ca 0.40 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 59.18 3k4y h LYS 65 Cb 0.70 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.01 3k4y h LYS 65 CO -0.68 0.00 0.00 0.66 -0.57 0.00 0.00 179.45 178.86 3k4y n TYR 66 N -3.63 0.95 -5.25 -1.35 4.01 0.97 -4.96 117.16 107.89 3k4y n TYR 66 Ca 0.08 -0.88 -0.31 0.00 -0.16 0.00 0.00 57.90 56.63 3k4y n TYR 66 Cb 0.68 -0.32 -0.16 0.00 -0.31 0.00 0.00 39.34 39.23 3k4y n TYR 66 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 3k4y s LEU 67 N -2.84 2.05 0.05 7.72 1.43 -0.38 -1.21 118.68 125.51 3k4y s LEU 67 Ca 0.42 -0.47 0.01 0.00 -1.03 0.00 0.00 54.13 53.06 3k4y s LEU 67 Cb 0.34 -1.31 -0.03 0.00 0.03 0.00 0.00 46.19 45.22 3k4y s LEU 67 CO 0.09 0.28 -0.05 -0.54 0.23 0.00 0.00 176.35 176.36 3k4y s LYS 68 N -0.43 0.57 -0.42 1.70 -0.14 -0.71 -4.99 119.74 115.32 3k4y s LYS 68 Ca 0.05 -1.00 -0.17 0.00 -1.36 0.00 0.00 55.97 53.48 3k4y s LYS 68 Cb -0.11 -0.01 0.02 0.00 -1.68 0.00 0.00 37.83 36.05 3k4y s LYS 68 CO 0.01 -0.04 0.43 0.42 -0.76 0.00 0.00 175.35 175.40 3k4y s ILE 69 N -2.74 5.10 -0.16 2.17 -1.09 -1.26 -1.42 121.20 121.81 3k4y s ILE 69 Ca -0.01 -0.39 0.02 0.00 -2.23 0.00 0.00 60.65 58.04 3k4y s ILE 69 Cb -0.01 -4.03 0.01 0.00 -1.58 0.00 0.00 42.46 36.85 3k4y s ILE 69 CO -0.04 -0.42 -0.21 -0.70 -1.23 0.00 0.00 174.94 172.34 3k4y s GLU 70 N 2.10 2.97 -1.46 2.79 2.12 -0.33 -4.67 118.70 122.22 3k4y s GLU 70 Ca 0.11 -0.83 -0.09 0.00 0.36 0.00 0.00 54.97 54.52 3k4y s GLU 70 Cb -0.17 -2.47 0.04 0.00 0.26 0.00 0.00 34.13 31.80 3k4y s GLU 70 CO 0.13 -0.10 0.84 -3.47 -0.54 0.00 0.00 175.26 172.12 3k4y n ASP 71 N 4.31 -5.36 0.00 -1.70 4.64 -1.26 -1.91 116.55 115.28 3k4y n ASP 71 Ca -0.20 -0.52 0.00 0.00 -1.38 0.00 0.00 54.79 52.69 3k4y n ASP 71 Cb 0.51 -4.29 0.00 0.00 -1.04 0.00 0.00 41.12 36.30 3k4y n ASP 71 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 3k4y n GLY 72 N -1.63 3.11 4.00 0.27 0.00 -1.26 -5.01 105.19 104.67 3k4y n GLY 72 Ca -0.02 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.82 3k4y n GLY 72 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3k4y s LYS 73 N -0.26 2.71 0.25 1.61 1.02 -0.80 -5.03 119.74 119.24 3k4y s LYS 73 Ca 0.00 -1.09 -0.20 0.00 0.02 0.00 0.00 55.97 54.70 3k4y s LYS 73 Cb 0.00 -2.66 -0.09 0.00 -0.52 0.00 0.00 37.83 34.56 3k4y s LYS 73 CO 0.00 -0.45 0.76 0.15 -0.92 0.00 0.00 175.35 174.89 3k4y s LYS 74 N -4.51 4.27 -0.18 1.68 1.02 -1.26 -1.18 119.74 119.58 3k4y s LYS 74 Ca 0.56 0.92 -0.16 0.00 0.02 0.00 0.00 55.97 57.31 3k4y s LYS 74 Cb -0.10 -2.80 0.05 0.00 -0.52 0.00 0.00 37.83 34.46 3k4y s LYS 74 CO 0.35 0.34 0.48 -1.50 -0.92 0.00 0.00 175.35 174.10 3k4y s ILE 75 N -1.60 -0.00 -0.04 2.17 2.07 -0.50 -4.87 121.20 118.42 3k4y s ILE 75 Ca 0.46 0.01 -0.22 0.00 -1.41 0.00 0.00 60.65 59.48 3k4y s ILE 75 Cb -0.16 -0.67 -0.05 0.00 0.13 0.00 0.00 42.46 41.72 3k4y s ILE 75 CO 0.21 0.00 0.65 -0.36 -1.91 0.00 0.00 174.94 173.53 3k4y s PHE 76 N 0.34 3.63 0.29 3.50 0.08 -1.26 -1.73 117.98 122.82 3k4y s PHE 76 Ca -0.01 1.22 0.09 0.00 0.12 0.00 0.00 56.93 58.35 3k4y s PHE 76 Cb -0.04 -2.71 -0.06 0.00 -0.57 0.00 0.00 43.02 39.64 3k4y s PHE 76 CO -0.00 0.21 -0.11 0.96 -0.10 0.00 0.00 175.22 176.18 3k4y s ILE 77 N 0.33 2.03 -1.59 0.64 -4.36 -0.35 -4.80 121.20 113.10 3k4y s ILE 77 Ca 0.34 -2.22 -0.14 0.00 -0.26 0.00 0.00 60.65 58.37 3k4y s ILE 77 Cb -0.18 -2.44 0.11 0.00 1.25 0.00 0.00 42.46 41.20 3k4y s ILE 77 CO 0.18 -0.32 0.81 0.59 0.24 0.00 0.00 174.94 176.44 3k4y n ASN 78 N -0.64 -3.41 0.00 4.36 3.02 -1.26 -4.72 115.26 112.61 3k4y n ASN 78 Ca -0.06 -0.92 0.15 0.00 -0.03 0.00 0.00 54.58 53.73 3k4y n ASN 78 Cb 0.62 -3.26 0.87 0.00 -0.61 0.00 0.00 39.78 37.40 3k4y n ASN 78 CO 0.00 0.00 0.00 0.23 -2.62 0.00 0.00 177.26 174.87 3k4y n MET 79 N -4.50 0.90 0.27 3.52 2.81 -1.26 -0.91 117.12 117.94 3k4y n MET 79 Ca 0.00 0.00 0.16 0.00 -1.81 0.00 0.00 57.70 56.05 3k4y n MET 79 Cb 0.54 -1.50 0.65 0.00 -0.71 0.00 0.00 33.22 32.20 3k4y n MET 79 CO 0.00 0.00 0.00 1.05 1.51 0.00 0.00 175.97 178.53 3k4y h GLU 80 N 0.00 0.00 0.00 0.03 9.09 -2.01 -2.37 114.58 119.32 3k4y h GLU 80 Ca 0.00 0.00 -0.27 0.00 0.05 0.00 0.00 59.36 59.14 3k4y h GLU 80 Cb 0.02 0.00 -0.05 0.00 -1.65 0.00 0.00 28.75 27.07 3k4y h GLU 80 CO 0.00 0.04 -2.01 1.63 0.05 0.00 0.00 179.01 178.72 3k4y n LYS 81 N -3.16 0.44 -0.24 1.06 4.76 -0.75 -4.79 118.16 115.47 3k4y n LYS 81 Ca 0.00 0.11 -0.05 0.00 -2.87 0.00 0.00 58.31 55.50 3k4y n LYS 81 Cb 0.32 -1.33 0.05 0.00 -1.84 0.00 0.00 35.03 32.23 3k4y n LYS 81 CO 0.00 0.00 0.00 0.78 -1.37 0.00 0.00 177.40 176.81 3k4y h GLY 82 N 1.13 0.94 0.96 0.72 0.00 -0.98 -1.95 103.07 103.89 3k4y h GLY 82 Ca -0.40 -0.34 0.01 0.00 0.00 0.00 0.00 47.33 46.59 3k4y h GLY 82 CO -0.09 0.33 0.08 -2.75 0.00 0.00 0.00 176.54 174.11 3k4y h PHE 83 N 0.89 0.15 -0.37 5.60 3.57 -1.70 -1.26 116.94 123.82 3k4y h PHE 83 Ca 0.25 0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.69 3k4y h PHE 83 Cb -0.08 -0.05 -0.01 0.00 2.79 0.00 0.00 35.95 38.60 3k4y h PHE 83 CO -0.03 0.09 -0.01 2.35 -2.23 0.00 0.00 178.31 178.48 3k4y h TRP 84 N 0.17 0.73 -0.83 0.41 -0.00 -1.78 -1.16 115.95 113.49 3k4y h TRP 84 Ca 0.06 -0.13 0.10 0.00 -0.00 0.00 0.00 58.89 58.92 3k4y h TRP 84 Cb 0.00 -0.19 -0.08 0.00 -0.00 0.00 0.00 29.16 28.90 3k4y h TRP 84 CO -0.08 0.77 0.46 0.93 -0.00 0.00 0.00 178.44 180.52 3k4y h GLU 85 N 0.48 0.74 -0.08 2.65 4.39 -1.04 0.99 114.58 122.70 3k4y h GLU 85 Ca 0.10 -0.04 -0.22 0.00 0.34 0.00 0.00 59.36 59.54 3k4y h GLU 85 Cb 0.48 -0.17 0.01 0.00 -0.10 0.00 0.00 28.75 28.98 3k4y h GLU 85 CO 0.02 0.49 -0.81 0.82 -1.16 0.00 0.00 179.01 178.37 3k4y h ILE 86 N 0.76 1.31 -0.43 3.13 2.04 -1.19 -2.34 117.51 120.79 3k4y h ILE 86 Ca 0.41 -2.05 0.06 0.00 1.00 0.00 0.00 64.86 64.28 3k4y h ILE 86 Cb 0.41 2.21 -0.05 0.00 -0.74 0.00 0.00 36.82 38.64 3k4y h ILE 86 CO -0.27 0.63 0.11 1.56 0.00 0.00 0.00 178.15 180.19 3k4y h GLN 87 N 0.36 0.25 -0.12 2.37 4.20 -0.20 -1.27 115.11 120.70 3k4y h GLN 87 Ca -0.08 -0.01 0.02 0.00 0.06 0.00 0.00 58.65 58.64 3k4y h GLN 87 Cb 1.45 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 29.16 3k4y h GLN 87 CO 0.16 0.16 -0.01 -0.09 -0.67 0.00 0.00 178.83 178.39 3k4y h ARG 88 N 0.25 0.03 -0.74 1.46 2.43 0.11 0.18 114.38 118.10 3k4y h ARG 88 Ca 0.20 -0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 59.32 3k4y h ARG 88 Cb 0.23 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.74 3k4y h ARG 88 CO -0.25 0.02 0.27 0.00 -1.51 0.00 0.00 179.97 178.50 3k4y h ALA 89 N 1.11 0.97 -0.27 2.80 0.00 -1.24 -1.95 119.26 120.68 3k4y h ALA 89 Ca 0.06 -0.20 -0.12 0.00 0.00 0.00 0.00 54.91 54.64 3k4y h ALA 89 Cb 0.07 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 3k4y h ALA 89 CO -0.10 0.61 -0.35 0.52 0.00 0.00 0.00 179.25 179.93 3k4y h MET 90 N 1.08 0.58 -0.80 0.00 2.86 -0.86 -2.46 114.93 115.33 3k4y h MET 90 Ca 0.24 -0.27 -0.01 0.00 -2.06 0.00 0.00 59.70 57.61 3k4y h MET 90 Cb 0.25 -0.01 -0.04 0.00 0.06 0.00 0.00 31.60 31.87 3k4y h MET 90 CO -0.01 0.85 0.48 0.00 1.06 0.00 0.00 176.91 179.29 3k4y h ARG 91 N 0.49 1.09 0.17 1.72 3.08 -0.34 -0.38 114.38 120.21 3k4y h ARG 91 Ca 0.05 -0.10 -0.01 0.00 0.07 0.00 0.00 59.98 59.99 3k4y h ARG 91 Cb 0.84 -0.23 0.00 0.00 0.08 0.00 0.00 29.97 30.66 3k4y h ARG 91 CO 0.07 0.77 -0.08 -0.09 -1.07 0.00 0.00 179.97 179.57 3k4y h ARG 92 N 1.10 -0.22 -0.54 0.04 9.65 -1.28 0.30 114.38 123.43 3k4y h ARG 92 Ca 0.29 0.02 0.02 0.00 -1.10 0.00 0.00 59.98 59.20 3k4y h ARG 92 Cb -0.04 0.05 -0.03 0.00 -1.39 0.00 0.00 29.97 28.56 3k4y h ARG 92 CO -0.05 -0.15 0.34 0.35 2.80 0.00 0.00 179.97 183.26 3k4y h PHE 93 N -0.23 0.65 -0.33 2.20 3.57 -1.24 -1.47 116.94 120.09 3k4y h PHE 93 Ca -0.02 0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.52 3k4y h PHE 93 Cb 0.18 -0.21 -0.03 0.00 2.79 0.00 0.00 35.95 38.68 3k4y h PHE 93 CO -0.07 0.39 0.16 -0.97 -2.23 0.00 0.00 178.31 175.59 3k4y h ASN 94 N 0.69 0.24 -0.36 0.41 -1.24 -0.93 -1.63 115.58 112.75 3k4y h ASN 94 Ca 0.21 0.02 0.07 0.00 0.71 0.00 0.00 56.30 57.31 3k4y h ASN 94 Cb -0.03 -0.03 -0.07 0.00 0.73 0.00 0.00 38.32 38.93 3k4y h ASN 94 CO -0.07 0.18 -0.10 0.78 -1.29 0.00 0.00 177.43 176.93 3k4y h ASN 95 N 0.34 -0.35 -0.86 1.15 2.35 -0.37 0.65 115.58 118.49 3k4y h ASN 95 Ca 0.14 0.11 -0.03 0.00 -0.55 0.00 0.00 56.30 55.97 3k4y h ASN 95 Cb 0.05 0.23 -0.04 0.00 0.05 0.00 0.00 38.32 38.61 3k4y h ASN 95 CO -0.10 -0.13 0.43 0.40 -1.65 0.00 0.00 177.43 176.39 3k4y h ILE 96 N -0.01 1.26 -0.10 2.81 2.04 -1.01 0.15 117.51 122.65 3k4y h ILE 96 Ca 0.17 -0.70 -0.05 0.00 1.00 0.00 0.00 64.86 65.29 3k4y h ILE 96 Cb 0.27 0.14 -0.00 0.00 -0.74 0.00 0.00 36.82 36.49 3k4y h ILE 96 CO -0.38 0.31 -0.11 0.40 0.00 0.00 0.00 178.15 178.37 3k4y h ILE 97 N 1.22 1.36 -0.27 -0.67 2.04 -0.79 -2.36 117.51 118.04 3k4y h ILE 97 Ca 0.30 -1.29 -0.07 0.00 1.00 0.00 0.00 64.86 64.80 3k4y h ILE 97 Cb 0.09 1.98 -0.01 0.00 -0.74 0.00 0.00 36.82 38.14 3k4y h ILE 97 CO -0.04 0.37 -0.11 0.40 0.00 0.00 0.00 178.15 178.77 3k4y h ILE 98 N -0.15 1.29 -0.47 -0.67 2.04 -0.75 -0.67 117.51 118.13 3k4y h ILE 98 Ca 0.02 -1.18 0.09 0.00 1.00 0.00 0.00 64.86 64.80 3k4y h ILE 98 Cb 0.64 1.48 -0.09 0.00 -0.74 0.00 0.00 36.82 38.11 3k4y h ILE 98 CO 0.03 0.37 -0.10 0.44 0.00 0.00 0.00 178.15 178.89 3k4y h ASP 99 N 0.30 -0.40 -0.47 1.72 3.32 -0.78 0.23 116.42 120.34 3k4y h ASP 99 Ca 0.06 0.14 -0.02 0.00 0.02 0.00 0.00 57.03 57.23 3k4y h ASP 99 Cb 0.61 0.28 -0.02 0.00 0.22 0.00 0.00 39.33 40.42 3k4y h ASP 99 CO 0.04 -0.14 0.21 0.74 -1.72 0.00 0.00 179.24 178.37 3k4y h THR 100 N 0.02 1.20 -0.59 0.35 2.02 -1.12 0.52 112.91 115.31 3k4y h THR 100 Ca 0.23 -0.57 0.04 0.00 0.77 0.00 0.00 66.41 66.88 3k4y h THR 100 Cb 0.35 0.70 -0.04 0.00 -1.74 0.00 0.00 68.15 67.41 3k4y h THR 100 CO -0.47 0.22 0.33 -0.07 0.37 0.00 0.00 175.52 175.90 3k4y h LEU 101 N 0.62 0.51 -1.00 2.58 3.38 -0.47 -2.13 115.31 118.80 3k4y h LEU 101 Ca 0.16 0.02 -0.06 0.00 0.09 0.00 0.00 57.88 58.09 3k4y h LEU 101 Cb 0.15 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 3k4y h LEU 101 CO -0.02 0.35 0.05 1.56 0.09 0.00 0.00 178.44 180.47 3k4y h GLN 102 N 0.64 0.77 0.00 1.13 1.08 -0.07 -1.44 115.11 117.22 3k4y h GLN 102 Ca 0.25 -0.18 0.00 0.00 -1.45 0.00 0.00 58.65 57.27 3k4y h GLN 102 Cb 0.10 -0.10 0.00 0.00 -0.05 0.00 0.00 27.48 27.43 3k4y h GLN 102 CO -0.14 0.74 0.02 -1.13 -0.95 0.00 0.00 178.83 177.38 3k4y n SER 103 N -4.25 0.46 -0.95 1.46 3.41 0.13 0.12 113.62 114.01 3k4y n SER 103 Ca 0.03 0.71 0.05 0.00 -0.26 0.00 0.00 58.87 59.40 3k4y n SER 103 Cb 0.26 -0.76 0.24 0.00 -0.26 0.00 0.00 64.21 63.69 3k4y n SER 103 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 3k4y n TYR 104 N -2.13 0.98 -2.29 7.33 4.01 -0.63 -4.97 117.16 119.46 3k4y n TYR 104 Ca -0.01 -1.07 -0.21 0.00 -0.16 0.00 0.00 57.90 56.45 3k4y n TYR 104 Cb 0.05 -0.36 -0.02 0.00 -0.31 0.00 0.00 39.34 38.70 3k4y n TYR 104 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 3k4y n ASP 105 N -0.71 -5.81 -4.63 7.72 8.00 0.33 -4.91 116.55 116.54 3k4y n ASP 105 Ca 0.25 0.05 -0.42 0.00 0.71 0.00 0.00 54.79 55.38 3k4y n ASP 105 Cb 0.93 -4.86 -0.04 0.00 -0.02 0.00 0.00 41.12 37.13 3k4y n ASP 105 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3k4y s ILE 106 N -3.00 4.81 -0.83 0.53 1.01 -0.69 -4.94 121.20 118.09 3k4y s ILE 106 Ca 0.00 1.47 -0.06 0.00 0.00 0.00 0.00 60.65 62.06 3k4y s ILE 106 Cb 0.00 -4.14 -0.05 0.00 0.01 0.00 0.00 42.46 38.28 3k4y s ILE 106 CO 0.00 -0.14 2.01 -0.81 0.00 0.00 0.00 174.94 176.00 3k4y n PRO 107 N 6.10 1.89 -2.76 2.79 -0.04 -1.26 -3.75 135.00 137.96 3k4y n PRO 107 Ca 0.05 -1.39 -0.36 0.00 -0.04 0.00 0.00 63.50 61.77 3k4y n PRO 107 Cb 0.48 -2.43 -0.06 0.00 -0.04 0.00 0.00 33.50 31.45 3k4y n PRO 107 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3k4y s ALA 108 N 3.60 3.14 0.10 0.55 0.00 -1.26 0.22 121.76 128.11 3k4y s ALA 108 Ca 0.37 0.51 0.01 0.00 0.00 0.00 0.00 51.96 52.84 3k4y s ALA 108 Cb 0.09 -3.18 -0.04 0.00 0.00 0.00 0.00 23.12 19.99 3k4y s ALA 108 CO -0.03 0.11 -0.04 0.14 0.00 0.00 0.00 175.76 175.95 3k4y s VAL 109 N -1.79 0.55 -0.15 0.00 -7.23 -0.15 -4.84 120.40 106.79 3k4y s VAL 109 Ca 0.55 -1.91 -0.13 0.00 -1.81 0.00 0.00 61.98 58.68 3k4y s VAL 109 Cb -0.16 -1.74 -0.05 0.00 0.56 0.00 0.00 36.38 34.99 3k4y s VAL 109 CO 0.21 -0.81 0.27 -0.55 -0.31 0.00 0.00 175.10 173.90 3k4y s SER 110 N -3.04 6.43 -0.25 4.85 0.15 -1.26 0.60 113.70 121.19 3k4y s SER 110 Ca 0.13 0.51 -0.00 0.00 0.70 0.00 0.00 55.95 57.29 3k4y s SER 110 Cb 0.06 -2.16 0.04 0.00 -1.71 0.00 0.00 66.02 62.24 3k4y s SER 110 CO -0.04 0.16 -0.08 -0.63 1.20 0.00 0.00 173.24 173.85 3k4y s ILE 111 N 0.17 2.63 -0.57 6.45 -1.09 -0.15 -4.86 121.20 123.77 3k4y s ILE 111 Ca 0.16 -1.20 -0.07 0.00 -2.23 0.00 0.00 60.65 57.31 3k4y s ILE 111 Cb -0.13 -2.38 0.15 0.00 -1.58 0.00 0.00 42.46 38.52 3k4y s ILE 111 CO 0.04 0.15 0.43 -1.58 -1.23 0.00 0.00 174.94 172.75 3k4y s GLN 112 N 1.26 2.64 0.24 2.79 0.74 -1.26 -3.73 119.66 122.33 3k4y s GLN 112 Ca -0.02 -2.12 -0.04 0.00 0.05 0.00 0.00 55.36 53.22 3k4y s GLN 112 Cb -0.17 -3.91 0.41 0.00 1.10 0.00 0.00 33.01 30.44 3k4y s GLN 112 CO -0.05 -1.19 1.78 -1.35 -0.55 0.00 0.00 175.29 173.92 3k4y h PRO 113 N 7.86 0.62 -1.10 1.67 0.11 -1.93 -2.37 132.00 136.87 3k4y h PRO 113 Ca -0.09 -0.04 0.31 0.00 0.11 0.00 0.00 66.00 66.29 3k4y h PRO 113 Cb 1.03 -0.14 -0.06 0.00 0.11 0.00 0.00 31.00 31.93 3k4y h PRO 113 CO 0.78 0.41 0.76 0.66 -0.21 0.00 0.00 178.00 180.41 3k4y h SER 114 N 0.64 0.15 1.17 -2.05 4.64 -1.89 0.16 113.55 116.38 3k4y h SER 114 Ca 0.40 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.75 3k4y h SER 114 Cb 0.46 0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.56 3k4y h SER 114 CO -0.30 0.03 0.00 0.28 -0.87 0.00 0.00 176.83 175.97 3k4y h SER 115 N 0.13 0.00 0.00 4.97 0.02 -1.74 -3.40 113.55 113.54 3k4y h SER 115 Ca 0.56 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.51 3k4y h SER 115 Cb 1.94 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.48 3k4y h SER 115 CO -0.11 0.00 0.00 2.22 -1.14 0.00 0.00 176.83 177.80 3k4y n PHE 116 N -2.75 0.00 -3.75 3.45 1.16 0.04 -5.10 117.46 110.51 3k4y n PHE 116 Ca 0.02 0.00 -0.36 0.00 -1.87 0.00 0.00 57.45 55.25 3k4y n PHE 116 Cb 0.34 0.02 -0.07 0.00 -1.61 0.00 0.00 39.48 38.16 3k4y n PHE 116 CO 0.00 0.00 0.00 0.08 -1.87 0.00 0.00 176.76 174.97 3k4y s VAL 117 N 0.00 5.42 -0.19 1.97 1.01 0.35 -4.70 120.40 124.26 3k4y s VAL 117 Ca 0.00 0.22 -0.02 0.00 0.00 0.00 0.00 61.98 62.18 3k4y s VAL 117 Cb 0.00 -3.47 -0.01 0.00 0.00 0.00 0.00 36.38 32.91 3k4y s VAL 117 CO 0.00 0.48 -0.09 -0.69 0.00 0.00 0.00 175.10 174.80 3k4y s VAL 118 N 0.03 3.12 -0.82 2.92 1.01 -0.47 -4.16 120.40 122.03 3k4y s VAL 118 Ca 0.10 -0.59 -0.22 0.00 0.00 0.00 0.00 61.98 61.27 3k4y s VAL 118 Cb -0.11 -2.38 0.08 0.00 0.00 0.00 0.00 36.38 33.96 3k4y s VAL 118 CO -0.00 0.47 1.15 0.12 0.00 0.00 0.00 175.10 176.84 3k4y s PHE 119 N 1.13 2.72 0.00 5.22 5.36 0.08 -1.16 117.98 131.33 3k4y s PHE 119 Ca 0.01 -0.79 0.00 0.00 -0.96 0.00 0.00 56.93 55.19 3k4y s PHE 119 Cb -0.14 -4.42 0.00 0.00 -0.34 0.00 0.00 43.02 38.12 3k4y s PHE 119 CO -0.02 -1.72 0.00 0.41 -1.46 0.00 0.00 175.22 172.43 3k4y n GLY 120 N 5.69 2.71 0.20 13.12 0.00 -1.26 -3.35 105.19 122.30 3k4y n GLY 120 Ca 0.13 -2.06 0.07 0.00 0.00 0.00 0.00 46.02 44.15 3k4y n GLY 120 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3k4y h ASP 121 N 0.00 0.00 -4.06 1.61 3.32 -2.00 -3.39 116.42 111.90 3k4y h ASP 121 Ca 0.00 0.00 -0.69 0.00 0.02 0.00 0.00 57.03 56.36 3k4y h ASP 121 Cb 0.00 0.00 -0.27 0.00 0.22 0.00 0.00 39.33 39.28 3k4y h ASP 121 CO 0.00 0.32 -0.83 -0.54 -1.72 0.00 0.00 179.24 176.47 3k4y s LYS 122 N -3.67 2.54 0.30 3.56 -0.14 -1.26 -5.12 119.74 115.96 3k4y s LYS 122 Ca -0.00 -0.80 -0.30 0.00 -1.36 0.00 0.00 55.97 53.51 3k4y s LYS 122 Cb 0.11 -2.28 -0.11 0.00 -1.68 0.00 0.00 37.83 33.87 3k4y s LYS 122 CO 0.67 0.49 1.57 -0.51 -0.76 0.00 0.00 175.35 176.81 3k4y s LEU 123 N -0.41 4.34 -0.46 3.17 1.02 -1.26 -4.85 118.68 120.23 3k4y s LEU 123 Ca 0.04 2.96 -0.17 0.00 0.02 0.00 0.00 54.13 56.98 3k4y s LEU 123 Cb -0.12 -3.64 0.05 0.00 0.02 0.00 0.00 46.19 42.50 3k4y s LEU 123 CO 0.02 -0.90 0.45 -0.63 0.02 0.00 0.00 176.35 175.30 3k4y s ILE 124 N -0.19 5.12 -0.41 -0.59 1.01 -0.30 -4.92 121.20 120.92 3k4y s ILE 124 Ca 0.61 -0.70 0.05 0.00 0.00 0.00 0.00 60.65 60.61 3k4y s ILE 124 Cb -0.47 -4.12 0.17 0.00 0.01 0.00 0.00 42.46 38.05 3k4y s ILE 124 CO 0.50 -0.56 0.48 0.12 0.00 0.00 0.00 174.94 175.49 3k4y s PHE 125 N 2.00 -0.63 -0.23 3.97 5.99 -1.26 -1.36 117.98 126.46 3k4y s PHE 125 Ca 0.09 -0.76 -0.29 0.00 0.00 0.00 0.00 56.93 55.97 3k4y s PHE 125 Cb -0.21 -0.21 -0.02 0.00 0.00 0.00 0.00 43.02 42.59 3k4y s PHE 125 CO 0.10 -1.05 1.49 0.34 -0.00 0.00 0.00 175.22 176.11 3k4y s ASP 126 N 1.25 6.53 -0.07 6.13 -1.08 -1.26 -4.88 116.67 123.30 3k4y s ASP 126 Ca 0.21 1.54 0.17 0.00 -0.52 0.00 0.00 52.55 53.95 3k4y s ASP 126 Cb -0.08 -2.53 0.61 0.00 -1.46 0.00 0.00 42.92 39.45 3k4y s ASP 126 CO -0.06 -1.14 1.50 0.35 0.52 0.00 0.00 175.17 176.35 3k4y n THR 127 N 6.20 1.34 0.03 1.71 -2.24 -1.26 -4.57 114.28 115.49 3k4y n THR 127 Ca 0.17 -0.97 -0.11 0.00 -2.27 0.00 0.00 64.05 60.88 3k4y n THR 127 Cb 0.45 0.19 -0.04 0.00 -2.10 0.00 0.00 70.33 68.84 3k4y n THR 127 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 3k4y h SER 128 N 3.65 -0.83 -0.82 3.42 0.02 -2.01 -2.06 113.55 114.92 3k4y h SER 128 Ca 0.00 0.12 0.02 0.00 -0.84 0.00 0.00 61.79 61.09 3k4y h SER 128 Cb 1.15 0.35 -0.05 0.00 0.14 0.00 0.00 62.40 64.00 3k4y h SER 128 CO 0.14 -0.33 0.53 0.00 -1.14 0.00 0.00 176.83 176.03 3k4y h ALA 129 N 0.48 1.07 -0.82 3.77 0.00 -2.00 -1.34 119.26 120.41 3k4y h ALA 129 Ca 0.08 -0.04 0.04 0.00 0.00 0.00 0.00 54.91 54.99 3k4y h ALA 129 Cb 0.50 -0.30 -0.05 0.00 0.00 0.00 0.00 17.79 17.94 3k4y h ALA 129 CO -0.29 0.39 0.52 0.82 0.00 0.00 0.00 179.25 180.69 3k4y h ILE 130 N 1.06 1.11 -0.39 0.00 2.04 -1.80 -1.06 117.51 118.47 3k4y h ILE 130 Ca 0.32 -0.34 0.04 0.00 1.00 0.00 0.00 64.86 65.87 3k4y h ILE 130 Cb -0.04 0.02 -0.04 0.00 -0.74 0.00 0.00 36.82 36.02 3k4y h ILE 130 CO -0.10 0.18 0.17 0.11 0.00 0.00 0.00 178.15 178.52 3k4y h LYS 131 N 1.00 0.35 0.00 2.37 1.57 -0.55 -0.65 116.57 120.65 3k4y h LYS 131 Ca 0.33 -0.02 -0.06 0.00 -1.87 0.00 0.00 60.65 59.03 3k4y h LYS 131 Cb 0.04 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.26 3k4y h LYS 131 CO -0.12 0.23 -0.30 0.93 -0.57 0.00 0.00 179.45 179.61 3k4y h GLU 132 N 0.36 0.00 -0.11 3.15 4.39 -0.98 -0.78 114.58 120.61 3k4y h GLU 132 Ca 0.17 0.00 -0.14 0.00 0.34 0.00 0.00 59.36 59.73 3k4y h GLU 132 Cb 0.10 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 28.76 3k4y h GLU 132 CO -0.14 0.30 -0.48 0.52 -1.16 0.00 0.00 179.01 178.06 3k4y h MET 133 N 0.00 0.51 -0.52 2.33 2.86 -0.46 -2.65 114.93 116.99 3k4y h MET 133 Ca -0.00 -0.41 -0.02 0.00 -2.06 0.00 0.00 59.70 57.21 3k4y h MET 133 Cb 0.58 0.08 -0.02 0.00 0.06 0.00 0.00 31.60 32.30 3k4y h MET 133 CO 0.04 1.03 0.23 -0.07 1.06 0.00 0.00 176.91 179.21 3k4y h LEU 134 N 0.10 0.70 -1.27 1.22 3.38 -0.95 0.33 115.31 118.82 3k4y h LEU 134 Ca -0.03 -0.15 0.21 0.00 0.09 0.00 0.00 57.88 58.00 3k4y h LEU 134 Cb 1.12 -0.18 -0.09 0.00 0.09 0.00 0.00 40.66 41.60 3k4y h LEU 134 CO 0.10 0.65 0.62 0.50 0.09 0.00 0.00 178.44 180.40 3k4y h LYS 135 N 0.70 0.54 -0.63 1.13 3.64 -1.10 0.39 116.57 121.24 3k4y h LYS 135 Ca 0.18 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.52 3k4y h LYS 135 Cb 0.15 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 31.85 3k4y h LYS 135 CO -0.02 0.36 0.00 0.54 -2.27 0.00 0.00 179.45 178.06 3k4y n ARG 136 N -4.64 3.15 -1.63 1.90 1.74 -0.85 -4.93 116.66 111.41 3k4y n ARG 136 Ca 0.22 -2.37 -0.11 0.00 -0.77 0.00 0.00 57.85 54.82 3k4y n ARG 136 Cb 0.68 -1.74 -0.03 0.00 -1.02 0.00 0.00 32.46 30.35 3k4y n ARG 136 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 3k4y n ASN 137 N 0.99 -4.01 -4.88 0.55 4.05 0.14 -5.01 115.26 107.09 3k4y n ASN 137 Ca 0.22 0.17 -0.31 0.00 0.45 0.00 0.00 54.58 55.11 3k4y n ASN 137 Cb 0.73 -2.74 0.02 0.00 1.23 0.00 0.00 39.78 39.02 3k4y n ASN 137 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 177.26 173.45 3k4y s LEU 138 N -2.66 3.10 -0.54 1.20 1.43 0.03 -4.86 118.68 116.39 3k4y s LEU 138 Ca 0.00 1.30 -0.04 0.00 -1.03 0.00 0.00 54.13 54.36 3k4y s LEU 138 Cb 0.00 -4.24 0.14 0.00 0.03 0.00 0.00 46.19 42.12 3k4y s LEU 138 CO 0.00 -1.06 0.35 -0.69 0.23 0.00 0.00 176.35 175.18 3k4y s VAL 139 N -3.25 3.64 0.12 -1.59 1.01 0.13 -4.37 120.40 116.09 3k4y s VAL 139 Ca 0.56 -2.52 -0.31 0.00 0.00 0.00 0.00 61.98 59.71 3k4y s VAL 139 Cb -0.11 -3.41 -0.09 0.00 0.00 0.00 0.00 36.38 32.77 3k4y s VAL 139 CO 0.53 -0.80 1.62 -2.84 0.00 0.00 0.00 175.10 173.60 3k4y s PRO 140 N 0.50 4.20 -0.34 2.72 0.02 -1.26 -0.97 135.00 139.87 3k4y s PRO 140 Ca 0.13 2.35 -0.04 0.00 0.02 0.00 0.00 61.00 63.46 3k4y s PRO 140 Cb -0.21 -3.38 0.06 0.00 0.02 0.00 0.00 34.50 30.99 3k4y s PRO 140 CO -0.04 -0.67 0.10 0.08 -0.33 0.00 0.00 177.00 176.14 3k4y s VAL 141 N 1.90 3.45 0.03 3.83 1.01 0.20 -2.34 120.40 128.48 3k4y s VAL 141 Ca 0.72 -1.41 -0.01 0.00 0.00 0.00 0.00 61.98 61.28 3k4y s VAL 141 Cb -0.42 -3.05 -0.04 0.00 0.00 0.00 0.00 36.38 32.87 3k4y s VAL 141 CO 0.32 -0.27 0.19 -0.63 0.00 0.00 0.00 175.10 174.71 3k4y s ILE 142 N 1.30 5.38 0.03 2.22 1.09 -0.58 -0.98 121.20 129.67 3k4y s ILE 142 Ca -0.01 -0.30 0.02 0.00 -1.10 0.00 0.00 60.65 59.26 3k4y s ILE 142 Cb -0.20 -3.57 -0.02 0.00 -1.06 0.00 0.00 42.46 37.60 3k4y s ILE 142 CO 0.00 0.22 -0.07 -1.38 -0.10 0.00 0.00 174.94 173.61 3k4y s HIS 143 N -1.42 0.61 0.38 3.97 -3.43 -1.24 -1.88 115.29 112.27 3k4y s HIS 143 Ca 0.31 -0.43 -0.25 0.00 -0.80 0.00 0.00 55.06 53.89 3k4y s HIS 143 Cb -0.13 -0.37 -0.12 0.00 -1.43 0.00 0.00 32.58 30.53 3k4y s HIS 143 CO 0.24 -0.08 0.92 0.41 -2.00 0.00 0.00 174.74 174.23 3k4y n GLY 144 N 1.73 -0.48 3.66 -1.38 0.00 -0.19 -4.65 105.19 103.89 3k4y n GLY 144 Ca -0.21 0.18 -0.09 0.00 0.00 0.00 0.00 46.02 45.90 3k4y n GLY 144 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3k4y s ASP 145 N -0.73 -0.22 0.32 1.61 -1.08 -0.31 -4.75 116.67 111.51 3k4y s ASP 145 Ca 0.62 -0.65 -0.25 0.00 -0.52 0.00 0.00 52.55 51.75 3k4y s ASP 145 Cb -0.61 0.63 -0.10 0.00 -1.46 0.00 0.00 42.92 41.39 3k4y s ASP 145 CO 0.58 -1.18 0.93 -0.51 0.52 0.00 0.00 175.17 175.50 3k4y s ILE 146 N -3.93 4.25 0.02 4.11 1.10 -1.26 -0.87 121.20 124.62 3k4y s ILE 146 Ca 0.14 1.76 -0.15 0.00 -0.51 0.00 0.00 60.65 61.89 3k4y s ILE 146 Cb -0.03 -3.98 0.02 0.00 0.15 0.00 0.00 42.46 38.63 3k4y s ILE 146 CO 0.04 0.12 0.33 0.68 -2.11 0.00 0.00 174.94 174.00 3k4y s VAL 147 N -1.64 0.07 0.48 4.00 -7.23 -0.41 -3.86 120.40 111.81 3k4y s VAL 147 Ca 0.50 -0.58 -0.18 0.00 -1.81 0.00 0.00 61.98 59.91 3k4y s VAL 147 Cb -0.18 -0.84 -0.09 0.00 0.56 0.00 0.00 36.38 35.83 3k4y s VAL 147 CO 0.23 -0.32 0.97 0.27 -0.31 0.00 0.00 175.10 175.94 3k4y s ILE 148 N -2.15 4.43 0.11 -0.62 -5.25 -1.26 -0.94 121.20 115.53 3k4y s ILE 148 Ca -0.08 1.32 0.01 0.00 -0.99 0.00 0.00 60.65 60.91 3k4y s ILE 148 Cb -0.02 -3.65 0.01 0.00 2.95 0.00 0.00 42.46 41.75 3k4y s ILE 148 CO -0.01 -0.52 0.12 -0.90 -1.79 0.00 0.00 174.94 171.84 3k4y n ASP 149 N -1.19 0.94 -1.61 4.36 5.68 -0.84 -0.75 116.55 123.14 3k4y n ASP 149 Ca 0.07 -1.35 -0.14 0.00 -0.50 0.00 0.00 54.79 52.87 3k4y n ASP 149 Cb 0.54 -0.04 0.17 0.00 -1.14 0.00 0.00 41.12 40.65 3k4y n ASP 149 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 3k4y n ASP 150 N -2.37 3.42 -2.73 -1.12 5.68 -1.21 -4.56 116.55 113.65 3k4y n ASP 150 Ca 0.01 -3.75 -0.10 0.00 -0.50 0.00 0.00 54.79 50.45 3k4y n ASP 150 Cb 0.12 -0.70 0.03 0.00 -1.14 0.00 0.00 41.12 39.44 3k4y n ASP 150 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 3k4y n LYS 151 N -1.09 1.12 -1.32 0.11 4.76 -1.26 -4.97 118.16 115.51 3k4y n LYS 151 Ca 0.44 -3.10 -0.11 0.00 -2.87 0.00 0.00 58.31 52.67 3k4y n LYS 151 Cb 1.17 -1.17 -0.05 0.00 -1.84 0.00 0.00 35.03 33.13 3k4y n LYS 151 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 3k4y n ASN 152 N -0.07 -5.72 -0.20 4.39 3.02 -1.26 -4.88 115.26 110.53 3k4y n ASN 152 Ca 0.10 0.28 0.00 0.00 -0.03 0.00 0.00 54.58 54.92 3k4y n ASN 152 Cb 0.80 -4.20 0.00 0.00 -0.61 0.00 0.00 39.78 35.77 3k4y n ASN 152 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3k4y n GLY 153 N 0.23 5.78 3.13 7.41 0.00 -1.26 -5.03 105.19 115.44 3k4y n GLY 153 Ca -0.11 -1.66 -0.09 0.00 0.00 0.00 0.00 46.02 44.16 3k4y n GLY 153 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3k4y s TYR 154 N -0.53 0.73 -0.09 1.61 2.02 -1.26 -1.99 117.35 117.83 3k4y s TYR 154 Ca 0.00 -0.96 -0.17 0.00 -0.37 0.00 0.00 57.07 55.56 3k4y s TYR 154 Cb 0.00 -0.46 0.04 0.00 -0.40 0.00 0.00 41.96 41.14 3k4y s TYR 154 CO 0.00 -0.24 0.43 0.50 -1.57 0.00 0.00 175.55 174.66 3k4y s ARG 155 N -3.78 0.65 -0.27 -0.62 6.06 -0.12 -4.82 118.95 116.05 3k4y s ARG 155 Ca 0.09 0.26 -0.25 0.00 -2.50 0.00 0.00 55.73 53.32 3k4y s ARG 155 Cb 0.06 0.30 0.00 0.00 0.06 0.00 0.00 34.95 35.37 3k4y s ARG 155 CO -0.07 -0.15 0.88 0.42 -2.50 0.00 0.00 175.30 173.89 3k4y s ILE 156 N -0.56 4.75 -0.18 4.11 -1.09 -1.26 -1.29 121.20 125.68 3k4y s ILE 156 Ca -0.07 1.53 -0.19 0.00 -2.23 0.00 0.00 60.65 59.69 3k4y s ILE 156 Cb -0.03 -4.20 -0.03 0.00 -1.58 0.00 0.00 42.46 36.62 3k4y s ILE 156 CO 0.03 -0.21 0.54 -0.51 -1.23 0.00 0.00 174.94 173.56 3k4y s ILE 157 N 3.05 5.11 0.51 2.92 2.07 -0.05 -4.97 121.20 129.83 3k4y s ILE 157 Ca 0.37 1.02 0.09 0.00 -1.41 0.00 0.00 60.65 60.71 3k4y s ILE 157 Cb -0.14 -3.86 0.05 0.00 0.13 0.00 0.00 42.46 38.63 3k4y s ILE 157 CO 0.10 0.20 0.66 -0.94 -1.91 0.00 0.00 174.94 173.05 3k4y s SER 158 N 1.03 5.27 0.40 4.50 1.04 -1.26 -1.16 113.70 123.52 3k4y s SER 158 Ca 0.26 -0.71 0.08 0.00 0.48 0.00 0.00 55.95 56.05 3k4y s SER 158 Cb -0.16 -0.10 0.84 0.00 0.10 0.00 0.00 66.02 66.70 3k4y s SER 158 CO 0.10 -1.07 2.02 1.23 0.98 0.00 0.00 173.24 176.50 3k4y h GLY 159 N 0.44 0.69 1.78 7.32 0.00 -1.92 -1.31 103.07 110.08 3k4y h GLY 159 Ca -0.35 -0.24 -0.03 0.00 0.00 0.00 0.00 47.33 46.71 3k4y h GLY 159 CO 0.44 0.21 -0.02 -0.55 0.00 0.00 0.00 176.54 176.62 3k4y h ASP 160 N 0.61 0.26 0.36 0.19 3.45 -1.98 0.69 116.42 120.00 3k4y h ASP 160 Ca 0.22 -0.04 -0.31 0.00 0.43 0.00 0.00 57.03 57.33 3k4y h ASP 160 Cb 0.12 -0.07 0.03 0.00 -0.56 0.00 0.00 39.33 38.85 3k4y h ASP 160 CO -0.06 0.33 -1.37 0.44 -1.57 0.00 0.00 179.24 177.01 3k4y h ASP 161 N 0.28 0.72 -0.15 6.45 3.32 -1.76 -3.38 116.42 121.90 3k4y h ASP 161 Ca 0.06 -0.75 -0.11 0.00 0.02 0.00 0.00 57.03 56.26 3k4y h ASP 161 Cb 0.23 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 39.54 3k4y h ASP 161 CO 0.01 1.58 -0.33 0.40 -1.72 0.00 0.00 179.24 179.18 3k4y h ILE 162 N 0.15 1.36 0.78 0.35 2.04 -0.62 -3.00 117.51 118.56 3k4y h ILE 162 Ca -0.21 -1.60 -0.04 0.00 1.00 0.00 0.00 64.86 64.02 3k4y h ILE 162 Cb 2.06 2.01 0.01 0.00 -0.74 0.00 0.00 36.82 40.16 3k4y h ILE 162 CO 0.25 0.48 -0.37 0.58 0.00 0.00 0.00 178.15 179.08 3k4y h VAL 163 N 0.10 0.00 -0.67 1.67 2.07 -1.08 -0.63 116.25 117.71 3k4y h VAL 163 Ca 0.00 -0.02 0.14 0.00 0.82 0.00 0.00 66.70 67.64 3k4y h VAL 163 Cb 0.93 0.00 -0.12 0.00 -1.52 0.00 0.00 31.29 30.58 3k4y h VAL 163 CO 0.07 0.00 -0.11 -0.65 0.02 0.00 0.00 177.57 176.90 3k4y h PRO 164 N -1.07 0.03 -0.59 1.57 0.11 -1.73 0.11 132.00 130.42 3k4y h PRO 164 Ca -0.11 -0.00 0.03 0.00 0.11 0.00 0.00 66.00 66.03 3k4y h PRO 164 Cb 0.80 -0.01 -0.04 0.00 0.11 0.00 0.00 31.00 31.86 3k4y h PRO 164 CO 0.18 0.02 0.35 -0.92 -0.21 0.00 0.00 178.00 177.42 3k4y h TYR 165 N 0.03 0.66 -0.36 0.65 3.20 -1.35 -1.94 116.97 117.86 3k4y h TYR 165 Ca 0.34 0.02 -0.17 0.00 3.14 0.00 0.00 58.73 62.06 3k4y h TYR 165 Cb 0.54 -0.21 -0.00 0.00 1.54 0.00 0.00 36.73 38.59 3k4y h TYR 165 CO -0.49 0.37 -0.43 -0.07 -1.64 0.00 0.00 178.16 175.89 3k4y h LEU 166 N 0.69 1.01 -0.88 2.82 3.38 -0.14 -1.22 115.31 120.97 3k4y h LEU 166 Ca 0.24 -0.48 0.09 0.00 0.09 0.00 0.00 57.88 57.82 3k4y h LEU 166 Cb 0.05 -0.28 -0.07 0.00 0.09 0.00 0.00 40.66 40.44 3k4y h LEU 166 CO -0.11 1.29 0.53 0.00 0.09 0.00 0.00 178.44 180.23 3k4y h ALA 167 N 0.75 1.26 0.49 1.53 0.00 -0.46 0.45 119.26 123.28 3k4y h ALA 167 Ca 0.05 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 3k4y h ALA 167 Cb 1.04 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.65 3k4y h ALA 167 CO 0.10 0.18 -0.24 -0.97 0.00 0.00 0.00 179.25 178.33 3k4y h ASN 168 N 0.89 -0.56 -0.98 0.00 -1.24 -1.30 -0.40 115.58 112.00 3k4y h ASN 168 Ca 0.42 -0.03 0.08 0.00 0.71 0.00 0.00 56.30 57.48 3k4y h ASN 168 Cb 0.34 0.14 -0.07 0.00 0.73 0.00 0.00 38.32 39.47 3k4y h ASN 168 CO -0.23 -0.14 0.63 -0.08 -1.29 0.00 0.00 177.43 176.32 3k4y h GLU 169 N -1.12 1.07 -0.02 6.67 4.57 -0.83 -2.49 114.58 122.44 3k4y h GLU 169 Ca -0.07 -0.06 0.00 0.00 -1.18 0.00 0.00 59.36 58.05 3k4y h GLU 169 Cb 0.55 -0.24 0.00 0.00 -0.16 0.00 0.00 28.75 28.90 3k4y h GLU 169 CO 0.11 0.71 -0.29 1.28 -1.18 0.00 0.00 179.01 179.64 3k4y n LEU 170 N -4.52 2.05 -3.17 1.64 4.77 0.15 -5.01 117.00 112.91 3k4y n LEU 170 Ca 0.16 -0.83 -0.08 0.00 -0.03 0.00 0.00 56.01 55.23 3k4y n LEU 170 Cb 0.23 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.32 3k4y n LEU 170 CO 0.31 0.37 0.15 0.29 -1.33 0.00 0.00 177.39 177.19 3k4y n LYS 171 N 0.26 -1.61 -3.05 3.23 4.76 -0.24 -4.96 118.16 116.54 3k4y n LYS 171 Ca 0.09 1.50 -0.33 0.00 -2.87 0.00 0.00 58.31 56.70 3k4y n LYS 171 Cb 0.43 -4.95 -0.06 0.00 -1.84 0.00 0.00 35.03 28.60 3k4y n LYS 171 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3k4y s ALA 172 N -2.83 3.25 -0.11 7.82 0.00 -0.73 -4.75 121.76 124.41 3k4y s ALA 172 Ca 0.07 0.14 0.15 0.00 0.00 0.00 0.00 51.96 52.32 3k4y s ALA 172 Cb -0.02 -2.87 -0.24 0.00 0.00 0.00 0.00 23.12 19.99 3k4y s ALA 172 CO 0.79 0.28 0.40 -0.25 0.00 0.00 0.00 175.76 176.98 3k4y n ASP 173 N -0.40 0.50 -3.85 0.00 8.00 -0.35 -4.82 116.55 115.63 3k4y n ASP 173 Ca 0.04 0.23 -0.21 0.00 0.71 0.00 0.00 54.79 55.57 3k4y n ASP 173 Cb 0.53 0.40 -0.17 0.00 -0.02 0.00 0.00 41.12 41.86 3k4y n ASP 173 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 3k4y s LEU 174 N -5.83 1.11 -0.14 0.64 2.96 -1.05 -2.90 118.68 113.47 3k4y s LEU 174 Ca -0.07 -0.12 -0.02 0.00 -0.22 0.00 0.00 54.13 53.71 3k4y s LEU 174 Cb 0.07 -0.45 -0.02 0.00 0.50 0.00 0.00 46.19 46.29 3k4y s LEU 174 CO 0.83 -0.10 -0.09 -0.63 -1.32 0.00 0.00 176.35 175.03 3k4y s ILE 175 N 1.25 3.36 -0.21 6.68 -1.09 -0.36 -0.67 121.20 130.15 3k4y s ILE 175 Ca -0.06 -0.55 0.02 0.00 -2.23 0.00 0.00 60.65 57.83 3k4y s ILE 175 Cb -0.14 -2.44 0.04 0.00 -1.58 0.00 0.00 42.46 38.34 3k4y s ILE 175 CO -0.02 0.51 -0.16 -0.76 -1.23 0.00 0.00 174.94 173.29 3k4y s LEU 176 N 0.39 2.66 -0.61 2.97 1.43 0.14 -1.16 118.68 124.51 3k4y s LEU 176 Ca -0.08 -0.96 -0.17 0.00 -1.03 0.00 0.00 54.13 51.89 3k4y s LEU 176 Cb -0.15 -1.48 0.14 0.00 0.03 0.00 0.00 46.19 44.72 3k4y s LEU 176 CO 0.04 -0.09 0.62 -0.31 0.23 0.00 0.00 176.35 176.84 3k4y s TYR 177 N 1.23 3.25 -0.17 0.29 2.02 0.75 0.45 117.35 125.16 3k4y s TYR 177 Ca -0.01 -1.31 -0.28 0.00 -0.37 0.00 0.00 57.07 55.10 3k4y s TYR 177 Cb -0.16 -3.88 -0.00 0.00 -0.40 0.00 0.00 41.96 37.52 3k4y s TYR 177 CO -0.09 -1.11 0.99 0.00 -1.57 0.00 0.00 175.55 173.76 3k4y s ALA 178 N 1.73 3.55 0.19 3.71 0.00 -0.68 -1.61 121.76 128.65 3k4y s ALA 178 Ca 0.09 0.22 0.02 0.00 0.00 0.00 0.00 51.96 52.29 3k4y s ALA 178 Cb -0.25 -3.44 -0.01 0.00 0.00 0.00 0.00 23.12 19.42 3k4y s ALA 178 CO 0.02 -0.81 0.09 0.25 0.00 0.00 0.00 175.76 175.30 3k4y n THR 179 N 4.93 0.00 1.67 0.00 -2.24 0.17 -1.92 114.28 116.89 3k4y n THR 179 Ca 0.09 -1.17 0.15 0.00 -2.27 0.00 0.00 64.05 60.85 3k4y n THR 179 Cb 0.48 0.47 0.69 0.00 -2.10 0.00 0.00 70.33 69.86 3k4y n THR 179 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 3k4y n ASP 180 N -1.95 0.81 -4.34 3.42 8.00 -1.26 -1.19 116.55 120.03 3k4y n ASP 180 Ca -0.01 -1.20 -0.18 0.00 0.71 0.00 0.00 54.79 54.12 3k4y n ASP 180 Cb 0.30 -0.00 -0.10 0.00 -0.02 0.00 0.00 41.12 41.29 3k4y n ASP 180 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 3k4y s VAL 181 N -2.06 0.80 -1.47 2.53 -7.23 -1.26 -4.97 120.40 106.73 3k4y s VAL 181 Ca 0.40 -2.00 0.25 0.00 -1.81 0.00 0.00 61.98 58.82 3k4y s VAL 181 Cb 0.21 -2.59 0.46 0.00 0.56 0.00 0.00 36.38 35.03 3k4y s VAL 181 CO 0.37 -0.09 1.85 0.47 -0.31 0.00 0.00 175.10 177.39 3k4y n ASP 182 N -0.49 0.00 0.00 4.85 8.00 -1.26 -1.87 116.55 125.78 3k4y n ASP 182 Ca -0.02 -0.13 0.00 0.00 0.71 0.00 0.00 54.79 55.36 3k4y n ASP 182 Cb 0.66 -0.26 0.00 0.00 -0.02 0.00 0.00 41.12 41.49 3k4y n ASP 182 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3k4y n GLY 183 N 0.84 0.23 3.56 0.44 0.00 -1.25 -4.24 105.19 104.77 3k4y n GLY 183 Ca 0.12 -1.57 -0.40 0.00 0.00 0.00 0.00 46.02 44.18 3k4y n GLY 183 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3k4y s VAL 184 N -2.84 3.42 -0.41 1.61 1.01 -1.26 -4.88 120.40 117.04 3k4y s VAL 184 Ca 0.00 0.31 -0.29 0.00 0.00 0.00 0.00 61.98 62.00 3k4y s VAL 184 Cb 0.00 -3.90 0.01 0.00 0.00 0.00 0.00 36.38 32.49 3k4y s VAL 184 CO 0.00 -0.80 1.33 -0.76 0.00 0.00 0.00 175.10 174.86 3k4y s LEU 185 N 8.37 3.64 -0.79 3.92 1.02 -1.26 -2.27 118.68 131.30 3k4y s LEU 185 Ca 0.69 0.79 -0.02 0.00 0.02 0.00 0.00 54.13 55.61 3k4y s LEU 185 Cb -0.15 -3.54 0.20 0.00 0.02 0.00 0.00 46.19 42.72 3k4y s LEU 185 CO 0.24 -1.34 0.65 -0.63 0.02 0.00 0.00 176.35 175.29 3k4y s ILE 186 N 5.04 4.13 0.00 -0.59 1.01 0.79 -4.31 121.20 127.27 3k4y s ILE 186 Ca 0.57 -3.51 0.00 0.00 0.00 0.00 0.00 60.65 57.71 3k4y s ILE 186 Cb -0.12 -3.61 0.00 0.00 0.01 0.00 0.00 42.46 38.74 3k4y s ILE 186 CO 0.31 -1.01 0.00 -0.67 0.00 0.00 0.00 174.94 173.57 3k4y n ASP 187 N 2.78 -0.97 -2.19 3.58 4.64 -1.26 -4.01 116.55 119.12 3k4y n ASP 187 Ca 0.16 0.00 -0.08 0.00 -1.38 0.00 0.00 54.79 53.49 3k4y n ASP 187 Cb 0.38 -0.24 -0.01 0.00 -1.04 0.00 0.00 41.12 40.20 3k4y n ASP 187 CO 0.00 0.00 0.00 -3.20 -0.82 0.00 0.00 177.20 173.18 3k4y n ASN 188 N -0.50 -2.75 -3.74 1.67 5.15 -1.26 -4.92 115.26 108.91 3k4y n ASN 188 Ca 0.00 0.28 -0.12 0.00 -0.60 0.00 0.00 54.58 54.13 3k4y n ASN 188 Cb 0.24 -2.46 -0.13 0.00 -0.53 0.00 0.00 39.78 36.90 3k4y n ASN 188 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 3k4y s LYS 189 N -4.51 0.23 0.14 1.20 -0.14 -1.26 -5.07 119.74 110.34 3k4y s LYS 189 Ca 0.00 0.51 -0.30 0.00 -1.36 0.00 0.00 55.97 54.82 3k4y s LYS 189 Cb 0.00 -0.08 -0.07 0.00 -1.68 0.00 0.00 37.83 36.00 3k4y s LYS 189 CO 0.00 -0.14 1.24 -1.25 -0.76 0.00 0.00 175.35 174.44 3k4y s PRO 190 N 1.10 4.44 -0.02 -1.68 0.04 -1.26 -0.15 135.00 137.46 3k4y s PRO 190 Ca -0.08 1.90 -0.30 0.00 0.04 0.00 0.00 61.00 62.56 3k4y s PRO 190 Cb -0.09 -3.26 -0.04 0.00 0.04 0.00 0.00 34.50 31.15 3k4y s PRO 190 CO -0.07 -0.21 1.22 -1.50 0.04 0.00 0.00 177.00 176.48 3k4y s ILE 191 N 0.43 4.15 0.09 0.56 2.07 -0.96 -4.89 121.20 122.65 3k4y s ILE 191 Ca 0.57 1.50 -0.35 0.00 -1.41 0.00 0.00 60.65 60.96 3k4y s ILE 191 Cb -0.33 -3.97 -0.16 0.00 0.13 0.00 0.00 42.46 38.14 3k4y s ILE 191 CO 0.34 0.02 1.57 0.50 -1.91 0.00 0.00 174.94 175.46 3k4y h LYS 192 N 7.36 -0.89 -6.46 3.50 3.64 -1.93 -3.38 116.57 118.41 3k4y h LYS 192 Ca -0.36 0.06 -0.63 0.00 -1.27 0.00 0.00 60.65 58.45 3k4y h LYS 192 Cb 1.17 0.20 -0.24 0.00 -0.41 0.00 0.00 32.23 32.96 3k4y h LYS 192 CO 0.87 -0.59 -0.85 0.50 -2.27 0.00 0.00 179.45 177.10 3k4y s ARG 193 N -5.87 1.41 -0.15 1.90 3.52 -1.26 -0.25 118.95 118.25 3k4y s ARG 193 Ca -0.17 -1.14 -0.04 0.00 -0.13 0.00 0.00 55.73 54.25 3k4y s ARG 193 Cb 0.05 -1.68 0.05 0.00 -1.56 0.00 0.00 34.95 31.81 3k4y s ARG 193 CO 0.61 0.41 0.06 0.42 -0.81 0.00 0.00 175.30 175.99 3k4y s ILE 194 N -0.96 0.16 0.17 4.11 1.01 0.31 -4.92 121.20 121.09 3k4y s ILE 194 Ca 0.10 -0.20 0.03 0.00 0.00 0.00 0.00 60.65 60.58 3k4y s ILE 194 Cb -0.10 -0.68 -0.01 0.00 0.01 0.00 0.00 42.46 41.68 3k4y s ILE 194 CO 0.04 -0.15 0.12 -0.90 0.00 0.00 0.00 174.94 174.05 3k4y n ASP 195 N 5.19 -0.01 -0.24 3.58 5.68 -1.26 -1.74 116.55 127.74 3k4y n ASP 195 Ca -0.07 -2.08 0.00 0.00 -0.50 0.00 0.00 54.79 52.14 3k4y n ASP 195 Cb 0.49 0.75 0.00 0.00 -1.14 0.00 0.00 41.12 41.21 3k4y n ASP 195 CO 0.00 0.00 0.00 2.29 -1.33 0.00 0.00 177.20 178.16 3k4y n LYS 196 N -0.35 0.25 0.00 0.11 2.85 -1.26 -1.21 118.16 118.55 3k4y n LYS 196 Ca 0.02 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.28 3k4y n LYS 196 Cb 0.30 -1.06 0.00 0.00 -0.65 0.00 0.00 35.03 33.62 3k4y n LYS 196 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 3k4y n ASN 197 N -0.07 1.51 0.00 -5.58 3.02 -1.26 -4.75 115.26 108.12 3k4y n ASN 197 Ca 0.00 -1.57 0.00 0.00 -0.03 0.00 0.00 54.58 52.98 3k4y n ASN 197 Cb 0.03 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.20 3k4y n ASN 197 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 3k4y n ASN 198 N -0.28 0.00 0.16 6.41 6.94 -0.35 -4.96 115.26 123.18 3k4y n ASN 198 Ca 0.00 -1.00 -0.07 0.00 -0.02 0.00 0.00 54.58 53.49 3k4y n ASN 198 Cb 0.17 0.00 -0.04 0.00 -2.36 0.00 0.00 39.78 37.55 3k4y n ASN 198 CO 0.00 0.00 0.00 -0.29 -1.03 0.00 0.00 177.26 175.94 3k4y h ILE 199 N 1.97 0.00 -0.89 1.53 2.10 -1.66 0.43 117.51 120.99 3k4y h ILE 199 Ca 0.00 0.00 0.24 0.00 1.08 0.00 0.00 64.86 66.18 3k4y h ILE 199 Cb 0.74 0.00 -0.14 0.00 -1.09 0.00 0.00 36.82 36.34 3k4y h ILE 199 CO 0.00 0.00 0.32 1.88 -1.08 0.00 0.00 178.15 179.27 3k4y h TYR 200 N -0.45 0.51 -0.43 2.19 0.05 -1.95 1.05 116.97 117.95 3k4y h TYR 200 Ca -0.04 0.05 0.04 0.00 0.05 0.00 0.00 58.73 58.83 3k4y h TYR 200 Cb 0.36 -0.08 -0.02 0.00 1.01 0.00 0.00 36.73 37.99 3k4y h TYR 200 CO 0.03 -0.15 0.29 -0.22 -1.05 0.00 0.00 178.16 177.06 3k4y h LYS 201 N 0.28 0.40 0.04 4.88 3.64 -1.83 0.50 116.57 124.47 3k4y h LYS 201 Ca 0.57 -0.02 -0.11 0.00 -1.27 0.00 0.00 60.65 59.81 3k4y h LYS 201 Cb 1.14 -0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 32.87 3k4y h LYS 201 CO -0.60 0.26 -0.58 0.82 -2.27 0.00 0.00 179.45 177.08 3k4y h ILE 202 N 0.41 1.47 -0.75 2.00 1.08 0.31 -3.02 117.51 119.00 3k4y h ILE 202 Ca 0.18 -2.35 0.16 0.00 -0.39 0.00 0.00 64.86 62.46 3k4y h ILE 202 Cb 0.20 3.03 -0.11 0.00 -3.07 0.00 0.00 36.82 36.87 3k4y h ILE 202 CO -0.04 0.58 0.21 -0.07 -0.69 0.00 0.00 178.15 178.13 3k4y h LEU 203 N -0.81 0.07 -1.16 1.44 3.38 -0.10 0.13 115.31 118.26 3k4y h LEU 203 Ca -0.14 0.14 -0.05 0.00 0.09 0.00 0.00 57.88 57.93 3k4y h LEU 203 Cb 1.27 0.18 -0.02 0.00 0.09 0.00 0.00 40.66 42.18 3k4y h LEU 203 CO -0.01 -0.02 0.08 0.78 0.09 0.00 0.00 178.44 179.36 3k4y h ASN 204 N 0.30 0.61 -0.39 -0.43 2.35 -1.00 -1.88 115.58 115.15 3k4y h ASN 204 Ca 0.43 -0.11 -0.14 0.00 -0.55 0.00 0.00 56.30 55.93 3k4y h ASN 204 Cb 0.73 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.93 3k4y h ASN 204 CO -0.50 0.63 -0.29 0.22 -1.65 0.00 0.00 177.43 175.85 3k4y h TYR 205 N 0.64 1.07 0.00 1.19 3.20 -1.00 -2.89 116.97 119.17 3k4y h TYR 205 Ca 0.14 -0.28 -0.03 0.00 3.14 0.00 0.00 58.73 61.70 3k4y h TYR 205 Cb 0.29 -0.24 -0.00 0.00 1.54 0.00 0.00 36.73 38.31 3k4y h TYR 205 CO 0.01 1.09 -0.14 -0.07 -1.64 0.00 0.00 178.16 177.41 3k4y h LEU 206 N 0.77 0.00 0.00 2.82 3.38 -0.15 -0.31 115.31 121.82 3k4y h LEU 206 Ca 0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.06 3k4y h LEU 206 Cb 0.86 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.61 3k4y h LEU 206 CO 0.08 0.14 -0.22 -1.20 0.09 0.00 0.00 178.44 177.32 3k4y n SER 207 N -3.86 0.60 -2.69 -0.43 7.64 -0.77 -4.75 113.62 109.36 3k4y n SER 207 Ca -0.02 0.36 -0.06 0.00 1.01 0.00 0.00 58.87 60.15 3k4y n SER 207 Cb 0.23 -0.38 0.05 0.00 -1.01 0.00 0.00 64.21 63.11 3k4y n SER 207 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3k4y n GLY 208 N 1.37 -2.33 0.83 0.23 0.00 -0.13 -4.99 105.19 100.17 3k4y n GLY 208 Ca 0.05 -1.49 0.10 0.00 0.00 0.00 0.00 46.02 44.68 3k4y n GLY 208 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3k4y n SER 209 N -3.37 2.76 -0.00 1.61 3.41 -1.26 -4.21 113.62 112.56 3k4y n SER 209 Ca 0.03 -1.84 0.09 0.00 -0.26 0.00 0.00 58.87 56.89 3k4y n SER 209 Cb 0.13 -0.05 -0.11 0.00 -0.26 0.00 0.00 64.21 63.91 3k4y n SER 209 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3k4y n ASN 210 N 1.12 0.86 -4.77 4.04 5.03 -1.26 -4.98 115.26 115.30 3k4y n ASN 210 Ca 0.13 -0.86 -0.40 0.00 0.87 0.00 0.00 54.58 54.31 3k4y n ASN 210 Cb 0.50 1.08 -0.02 0.00 -1.02 0.00 0.00 39.78 40.31 3k4y n ASN 210 CO 0.00 0.00 0.00 -0.55 -1.83 0.00 0.00 177.26 174.88 3k4y s SER 211 N -2.90 6.82 0.33 6.41 0.15 -1.26 -4.76 113.70 118.49 3k4y s SER 211 Ca 0.06 2.59 0.26 0.00 0.70 0.00 0.00 55.95 59.56 3k4y s SER 211 Cb 0.14 -2.64 0.72 0.00 -1.71 0.00 0.00 66.02 62.53 3k4y s SER 211 CO 0.77 -0.49 1.73 0.40 1.20 0.00 0.00 173.24 176.85 3k4y h ILE 212 N 2.97 0.00 -3.68 6.45 5.03 -1.94 -3.41 117.51 122.93 3k4y h ILE 212 Ca -0.49 -0.64 -0.68 0.00 -0.12 0.00 0.00 64.86 62.94 3k4y h ILE 212 Cb 1.23 1.61 -0.35 0.00 -3.03 0.00 0.00 36.82 36.27 3k4y h ILE 212 CO 0.65 0.00 -0.67 -0.62 -0.68 0.00 0.00 178.15 176.83 3k4y s ASP 213 N -5.20 4.93 0.00 1.72 2.15 -1.26 -4.91 116.67 114.09 3k4y s ASP 213 Ca 0.08 -1.70 0.23 0.00 0.43 0.00 0.00 52.55 51.59 3k4y s ASP 213 Cb 0.09 -1.71 0.16 0.00 -0.30 0.00 0.00 42.92 41.16 3k4y s ASP 213 CO 0.59 -0.36 1.18 1.33 -0.17 0.00 0.00 175.17 177.74 3k4y n VAL 214 N 4.52 0.00 0.28 1.11 0.24 -1.26 -4.21 118.33 119.00 3k4y n VAL 214 Ca -0.06 -0.11 0.18 0.00 -2.04 0.00 0.00 64.34 62.30 3k4y n VAL 214 Cb 0.42 0.85 0.92 0.00 -1.47 0.00 0.00 33.84 34.56 3k4y n VAL 214 CO 0.00 0.00 0.00 0.71 -2.14 0.00 0.00 176.83 175.40 3k4y h THR 215 N 1.07 0.00 -0.32 3.34 1.35 -1.94 -3.45 112.91 112.96 3k4y h THR 215 Ca 0.00 -0.05 -0.14 0.00 -0.55 0.00 0.00 66.41 65.67 3k4y h THR 215 Cb 0.59 0.85 -0.05 0.00 -1.73 0.00 0.00 68.15 67.81 3k4y h THR 215 CO 0.00 0.00 -0.13 0.61 -0.25 0.00 0.00 175.52 175.75 3k4y n GLY 216 N -1.01 0.89 0.07 5.82 0.00 -1.26 -4.95 105.19 104.75 3k4y n GLY 216 Ca -0.02 -0.60 -0.14 0.00 0.00 0.00 0.00 46.02 45.27 3k4y n GLY 216 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3k4y h GLY 217 N 0.00 0.04 0.96 -0.02 0.00 -1.87 -3.17 103.07 99.01 3k4y h GLY 217 Ca -0.14 -0.06 -0.01 0.00 0.00 0.00 0.00 47.33 47.12 3k4y h GLY 217 CO 0.20 0.05 -0.09 -0.33 0.00 0.00 0.00 176.54 176.38 3k4y h MET 218 N -0.62 -0.24 -0.86 4.80 2.86 -1.92 -2.81 114.93 116.14 3k4y h MET 218 Ca -0.00 0.02 0.19 0.00 -2.06 0.00 0.00 59.70 57.84 3k4y h MET 218 Cb 0.71 0.05 -0.16 0.00 0.06 0.00 0.00 31.60 32.26 3k4y h MET 218 CO 0.01 -0.13 -0.14 0.87 1.06 0.00 0.00 176.91 178.58 3k4y h LYS 219 N -0.29 0.02 -0.59 1.72 1.57 -1.96 0.83 116.57 117.87 3k4y h LYS 219 Ca -0.03 -0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.73 3k4y h LYS 219 Cb 0.22 -0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.50 3k4y h LYS 219 CO 0.04 0.01 0.28 -0.92 -0.57 0.00 0.00 179.45 178.29 3k4y h TYR 220 N 0.02 0.86 0.11 -1.35 3.20 -1.48 -1.77 116.97 116.56 3k4y h TYR 220 Ca 0.44 -0.05 -0.01 0.00 3.14 0.00 0.00 58.73 62.26 3k4y h TYR 220 Cb 0.73 -0.27 0.00 0.00 1.54 0.00 0.00 36.73 38.74 3k4y h TYR 220 CO -0.61 0.67 -0.05 0.87 -1.64 0.00 0.00 178.16 177.40 3k4y h LYS 221 N 0.81 -0.14 -0.68 1.82 1.57 -0.66 -2.27 116.57 117.03 3k4y h LYS 221 Ca 0.20 0.01 0.14 0.00 -1.87 0.00 0.00 60.65 59.14 3k4y h LYS 221 Cb 0.14 0.03 -0.12 0.00 0.08 0.00 0.00 32.23 32.36 3k4y h LYS 221 CO -0.02 0.12 -0.05 0.82 -0.57 0.00 0.00 179.45 179.75 3k4y h ILE 222 N -0.39 0.39 -0.46 1.86 2.04 -1.08 -2.19 117.51 117.68 3k4y h ILE 222 Ca -0.01 -0.03 -0.08 0.00 1.00 0.00 0.00 64.86 65.74 3k4y h ILE 222 Cb 0.32 0.31 -0.02 0.00 -0.74 0.00 0.00 36.82 36.70 3k4y h ILE 222 CO 0.02 0.01 -0.05 -0.33 0.00 0.00 0.00 178.15 177.81 3k4y h GLU 223 N 0.07 0.78 -0.24 2.37 5.08 -1.10 -2.62 114.58 118.92 3k4y h GLU 223 Ca 0.35 -0.23 -0.12 0.00 -1.00 0.00 0.00 59.36 58.36 3k4y h GLU 223 Cb 0.58 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 3k4y h GLU 223 CO -0.62 0.81 -0.37 0.52 -1.00 0.00 0.00 179.01 178.35 3k4y h MET 224 N 0.72 0.53 0.00 2.33 2.86 -0.82 0.95 114.93 121.49 3k4y h MET 224 Ca 0.13 -0.25 -0.00 0.00 -2.06 0.00 0.00 59.70 57.52 3k4y h MET 224 Cb 0.50 -0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.16 3k4y h MET 224 CO 0.03 0.82 -0.00 0.82 1.06 0.00 0.00 176.91 179.64 3k4y h ILE 225 N 0.44 1.11 -0.99 -1.22 2.04 -1.08 -1.18 117.51 116.64 3k4y h ILE 225 Ca 0.04 -0.33 0.01 0.00 1.00 0.00 0.00 64.86 65.58 3k4y h ILE 225 Cb 0.85 1.33 -0.05 0.00 -0.74 0.00 0.00 36.82 38.21 3k4y h ILE 225 CO 0.07 0.09 0.65 -0.09 0.00 0.00 0.00 178.15 178.86 3k4y h ARG 226 N -0.14 1.30 0.00 2.37 2.43 -1.34 -1.40 114.38 117.60 3k4y h ARG 226 Ca -0.00 -0.08 -0.01 0.00 -0.81 0.00 0.00 59.98 59.07 3k4y h ARG 226 Cb 0.14 -0.29 -0.00 0.00 -0.42 0.00 0.00 29.97 29.40 3k4y h ARG 226 CO 0.00 0.87 -0.06 -0.22 -1.51 0.00 0.00 179.97 179.05 3k4y h LYS 227 N 1.34 0.00 -0.15 0.20 3.64 -0.40 -1.69 116.57 119.51 3k4y h LYS 227 Ca 0.36 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.74 3k4y h LYS 227 Cb -0.15 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.67 3k4y h LYS 227 CO -0.08 0.06 0.00 0.09 -2.27 0.00 0.00 179.45 177.25 3k4y n ASN 228 N -3.86 2.94 -3.81 4.20 4.13 -0.48 -4.98 115.26 113.40 3k4y n ASN 228 Ca -0.03 -1.90 -0.25 0.00 1.68 0.00 0.00 54.58 54.09 3k4y n ASN 228 Cb 0.15 -0.09 0.02 0.00 -1.54 0.00 0.00 39.78 38.32 3k4y n ASN 228 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 3k4y n LYS 229 N 1.22 -4.78 0.00 3.52 5.02 -0.61 -4.95 118.16 117.58 3k4y n LYS 229 Ca 0.14 0.57 0.00 0.00 -2.02 0.00 0.00 58.31 57.00 3k4y n LYS 229 Cb 0.53 -5.16 0.00 0.00 -0.02 0.00 0.00 35.03 30.38 3k4y n LYS 229 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3k4y s ARG 231 N 1.38 0.93 0.10 0.00 3.52 -1.14 -0.19 118.95 123.55 3k4y s ARG 231 Ca 0.00 -1.11 -0.24 0.00 -0.13 0.00 0.00 55.73 54.26 3k4y s ARG 231 Cb 0.00 -0.89 0.06 0.00 -1.56 0.00 0.00 34.95 32.56 3k4y s ARG 231 CO 0.00 0.18 0.59 0.20 -0.81 0.00 0.00 175.30 175.46 3k4y s GLY 232 N -2.10 -0.56 0.01 8.12 0.00 -0.40 -1.23 107.32 111.16 3k4y s GLY 232 Ca 0.04 0.61 0.06 0.00 0.00 0.00 0.00 44.72 45.42 3k4y s GLY 232 CO 0.03 0.28 -0.17 -1.36 0.00 0.00 0.00 173.10 171.88 3k4y s PHE 233 N -3.12 1.54 -0.23 1.90 0.08 -0.31 -0.78 117.98 117.06 3k4y s PHE 233 Ca -0.02 -0.32 0.02 0.00 0.12 0.00 0.00 56.93 56.73 3k4y s PHE 233 Cb -0.01 -0.96 0.04 0.00 -0.57 0.00 0.00 43.02 41.52 3k4y s PHE 233 CO -0.07 0.01 -0.14 0.08 -0.10 0.00 0.00 175.22 175.00 3k4y s VAL 234 N -0.55 2.21 0.28 -0.44 1.01 -0.64 -0.18 120.40 122.08 3k4y s VAL 234 Ca 0.06 -1.32 -0.01 0.00 0.00 0.00 0.00 61.98 60.71 3k4y s VAL 234 Cb -0.07 -2.15 -0.02 0.00 0.00 0.00 0.00 36.38 34.14 3k4y s VAL 234 CO 0.00 0.20 0.31 0.72 0.00 0.00 0.00 175.10 176.34 3k4y s PHE 235 N 1.19 1.17 -0.51 5.22 -0.12 -0.63 -1.77 117.98 122.53 3k4y s PHE 235 Ca -0.03 -1.33 -0.22 0.00 -0.05 0.00 0.00 56.93 55.30 3k4y s PHE 235 Cb -0.17 -0.36 0.04 0.00 -0.63 0.00 0.00 43.02 41.90 3k4y s PHE 235 CO -0.08 -0.89 0.81 1.21 -0.05 0.00 0.00 175.22 176.23 3k4y s ASN 236 N -3.21 6.32 0.00 1.98 3.84 -0.78 -0.66 114.94 122.43 3k4y s ASN 236 Ca 0.35 -0.44 0.18 0.00 0.21 0.00 0.00 52.86 53.16 3k4y s ASN 236 Cb 0.03 -2.38 1.09 0.00 -0.55 0.00 0.00 41.25 39.43 3k4y s ASN 236 CO 0.18 -1.05 1.62 0.61 -2.79 0.00 0.00 177.10 175.67 3k4y n GLY 237 N 5.10 -0.88 0.03 1.21 0.00 -0.33 -2.53 105.19 107.79 3k4y n GLY 237 Ca -0.00 -0.11 0.11 0.00 0.00 0.00 0.00 46.02 46.01 3k4y n GLY 237 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3k4y n ASN 238 N -0.82 0.80 -4.74 1.61 5.03 -1.26 -4.92 115.26 110.95 3k4y n ASN 238 Ca 0.14 -0.65 -0.37 0.00 0.87 0.00 0.00 54.58 54.56 3k4y n ASN 238 Cb 0.06 0.58 -0.07 0.00 -1.02 0.00 0.00 39.78 39.34 3k4y n ASN 238 CO 0.00 0.00 0.00 -0.75 -1.83 0.00 0.00 177.26 174.68 3k4y s LYS 239 N -2.96 4.22 0.05 3.52 2.20 -1.05 -5.02 119.74 120.70 3k4y s LYS 239 Ca 0.11 0.25 -0.33 0.00 -0.36 0.00 0.00 55.97 55.63 3k4y s LYS 239 Cb 0.17 -3.40 -0.12 0.00 -1.51 0.00 0.00 37.83 32.97 3k4y s LYS 239 CO 0.76 0.28 1.78 0.00 -0.36 0.00 0.00 175.35 177.81 3k4y n ALA 240 N 3.35 1.36 0.00 3.13 0.00 -1.26 -2.00 120.51 125.09 3k4y n ALA 240 Ca -0.11 0.34 0.00 0.00 0.00 0.00 0.00 53.44 53.67 3k4y n ALA 240 Cb 0.52 -2.48 0.00 0.00 0.00 0.00 0.00 19.45 17.49 3k4y n ALA 240 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3k4y n ASN 241 N 5.41 0.00 -0.30 0.00 5.03 -1.26 -4.89 115.26 119.24 3k4y n ASN 241 Ca 0.20 0.00 -0.00 0.00 0.87 0.00 0.00 54.58 55.64 3k4y n ASN 241 Cb 0.31 0.00 0.18 0.00 -1.02 0.00 0.00 39.78 39.26 3k4y n ASN 241 CO 0.00 0.00 0.00 0.78 -1.83 0.00 0.00 177.26 176.21 3k4y h ASN 242 N 0.00 1.01 0.17 6.41 -0.26 -1.70 0.25 115.58 121.45 3k4y h ASN 242 Ca 0.00 -0.02 -0.22 0.00 -0.56 0.00 0.00 56.30 55.50 3k4y h ASN 242 Cb 0.00 -0.25 0.00 0.00 -1.06 0.00 0.00 38.32 37.02 3k4y h ASN 242 CO 0.00 0.72 -0.85 0.40 -1.06 0.00 0.00 177.43 176.63 3k4y h ILE 243 N 1.18 1.35 0.12 2.81 2.04 -1.87 0.25 117.51 123.40 3k4y h ILE 243 Ca 0.33 -2.22 -0.01 0.00 1.00 0.00 0.00 64.86 63.96 3k4y h ILE 243 Cb -0.09 2.22 0.00 0.00 -0.74 0.00 0.00 36.82 38.21 3k4y h ILE 243 CO -0.08 0.68 -0.06 0.22 0.00 0.00 0.00 178.15 178.91 3k4y h TYR 244 N 0.33 -0.15 0.01 1.37 3.20 -1.73 -1.12 116.97 118.88 3k4y h TYR 244 Ca -0.06 -0.00 0.01 0.00 3.14 0.00 0.00 58.73 61.82 3k4y h TYR 244 Cb 1.47 0.05 -0.02 0.00 1.54 0.00 0.00 36.73 39.77 3k4y h TYR 244 CO 0.07 0.11 -0.09 0.87 -1.64 0.00 0.00 178.16 177.47 3k4y h LYS 245 N -0.41 -0.15 -0.79 1.82 1.57 -0.47 -2.14 116.57 115.99 3k4y h LYS 245 Ca -0.02 0.01 0.13 0.00 -1.87 0.00 0.00 60.65 58.90 3k4y h LYS 245 Cb 0.33 0.03 -0.09 0.00 0.08 0.00 0.00 32.23 32.59 3k4y h LYS 245 CO 0.03 -0.10 0.39 0.00 -0.57 0.00 0.00 179.45 179.19 3k4y h ALA 246 N 0.81 1.15 0.00 3.86 0.00 -0.51 0.54 119.26 125.11 3k4y h ALA 246 Ca 0.03 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 3k4y h ALA 246 Cb 0.20 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 3k4y h ALA 246 CO -0.08 -0.09 -0.06 -0.07 0.00 0.00 0.00 179.25 178.95 3k4y h LEU 247 N 0.59 0.00 0.00 0.00 3.38 -0.71 -0.01 115.31 118.56 3k4y h LEU 247 Ca 0.42 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.39 3k4y h LEU 247 Cb 0.56 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.31 3k4y h LEU 247 CO -0.34 0.06 -0.85 0.18 0.09 0.00 0.00 178.44 177.57 3k4y n LEU 248 N -3.63 0.70 0.00 1.67 4.77 0.16 -4.96 117.00 115.71 3k4y n LEU 248 Ca -0.02 0.19 0.00 0.00 -0.03 0.00 0.00 56.01 56.14 3k4y n LEU 248 Cb 0.16 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.13 3k4y n LEU 248 CO 0.28 -0.06 0.00 0.61 -1.33 0.00 0.00 177.39 176.88 3k4y n GLY 249 N 1.30 1.37 0.00 -0.72 0.00 0.54 -4.99 105.19 102.69 3k4y n GLY 249 Ca 0.02 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.88 3k4y n GLY 249 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 3k4y n GLU 250 N -1.51 0.03 -1.37 1.61 0.28 -0.69 -4.98 120.64 114.02 3k4y n GLU 250 Ca 0.00 -0.35 -0.37 0.00 -0.16 0.00 0.00 57.16 56.28 3k4y n GLU 250 Cb 0.05 -0.67 0.06 0.00 1.43 0.00 0.00 31.44 32.31 3k4y n GLU 250 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 177.13 178.52 3k4y n VAL 251 N -0.05 2.36 -3.69 3.84 3.14 -1.21 -4.82 118.33 117.90 3k4y n VAL 251 Ca 0.00 -0.43 -0.36 0.00 -2.96 0.00 0.00 64.34 60.59 3k4y n VAL 251 Cb 0.23 -0.86 -0.08 0.00 -1.06 0.00 0.00 33.84 32.07 3k4y n VAL 251 CO 0.00 0.00 0.00 -1.83 -6.46 0.00 0.00 176.83 168.54 3k4y s GLU 252 N -2.76 2.84 0.00 1.45 -1.05 -1.26 -4.89 118.70 113.04 3k4y s GLU 252 Ca 0.69 -2.85 0.00 0.00 -0.15 0.00 0.00 54.97 52.66 3k4y s GLU 252 Cb -0.37 -3.81 0.00 0.00 -0.44 0.00 0.00 34.13 29.50 3k4y s GLU 252 CO 0.54 -1.22 0.00 0.41 0.95 0.00 0.00 175.26 175.95 3k4y n GLY 253 N 2.99 2.27 3.01 -3.83 0.00 -1.26 -4.94 105.19 103.42 3k4y n GLY 253 Ca 0.14 -0.25 -0.26 0.00 0.00 0.00 0.00 46.02 45.65 3k4y n GLY 253 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3k4y s THR 254 N 1.76 1.19 0.05 2.61 2.01 -0.73 -4.46 115.64 118.08 3k4y s THR 254 Ca 0.00 -0.48 -0.12 0.00 0.31 0.00 0.00 61.69 61.41 3k4y s THR 254 Cb 0.00 -1.11 -0.06 0.00 0.01 0.00 0.00 72.50 71.34 3k4y s THR 254 CO 0.00 0.38 0.41 -0.70 -0.69 0.00 0.00 174.62 174.01 3k4y s GLU 255 N 0.94 3.81 -0.21 4.92 2.12 0.66 -1.63 118.70 129.32 3k4y s GLU 255 Ca -0.09 0.26 -0.01 0.00 0.36 0.00 0.00 54.97 55.49 3k4y s GLU 255 Cb -0.15 -3.07 0.06 0.00 0.26 0.00 0.00 34.13 31.23 3k4y s GLU 255 CO 0.00 0.60 -0.02 0.42 -0.54 0.00 0.00 175.26 175.73 3k4y s ILE 256 N -1.29 1.08 -0.18 -3.70 1.01 0.04 -0.53 121.20 117.64 3k4y s ILE 256 Ca 0.30 -0.88 0.01 0.00 0.00 0.00 0.00 60.65 60.08 3k4y s ILE 256 Cb -0.15 -1.43 0.03 0.00 0.01 0.00 0.00 42.46 40.93 3k4y s ILE 256 CO 0.16 -0.11 -0.15 -0.62 0.00 0.00 0.00 174.94 174.23 3k4y s ASP 257 N 1.61 3.21 -0.04 3.58 2.15 -0.71 -1.27 116.67 125.18 3k4y s ASP 257 Ca -0.03 -0.74 0.24 0.00 0.43 0.00 0.00 52.55 52.45 3k4y s ASP 257 Cb -0.18 -1.34 0.44 0.00 -0.30 0.00 0.00 42.92 41.54 3k4y s ASP 257 CO -0.07 -0.07 1.17 0.49 -0.17 0.00 0.00 175.17 176.52 3k4y n PHE 258 N 4.66 0.12 -1.73 -5.34 3.72 0.73 -4.31 117.46 115.31 3k4y n PHE 258 Ca -0.18 -0.72 -0.31 0.00 -0.05 0.00 0.00 57.45 56.20 3k4y n PHE 258 Cb 0.48 -0.17 0.04 0.00 -0.94 0.00 0.00 39.48 38.89 3k4y n PHE 258 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 3k4y s SER 259 N -2.25 5.68 0.00 4.37 1.04 -0.84 -2.63 113.70 119.07 3k4y s SER 259 Ca 0.34 1.45 0.00 0.00 0.48 0.00 0.00 55.95 58.22 3k4y s SER 259 Cb 0.38 -2.38 0.00 0.00 0.10 0.00 0.00 66.02 64.12 3k4y s SER 259 CO -0.15 -1.23 0.00 -0.62 0.98 0.00 0.00 173.24 172.22