#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k8p n SER 31 N 0.00 -6.00 0.05 1.61 7.64 -1.26 -5.10 113.62 110.56 3k8p n SER 31 Ca 0.00 0.77 0.04 0.00 1.01 0.00 0.00 58.87 60.69 3k8p n SER 31 Cb 0.00 -3.00 -0.06 0.00 -1.01 0.00 0.00 64.21 60.14 3k8p n SER 31 CO 0.00 0.00 0.00 1.67 -3.01 0.00 0.00 175.04 173.70 3k8p n GLN 32 N 0.75 0.62 -0.22 1.43 7.27 -1.26 -3.90 117.38 122.07 3k8p n GLN 32 Ca 0.00 0.16 -0.01 0.00 0.07 0.00 0.00 57.00 57.22 3k8p n GLN 32 Cb 0.00 -1.79 0.06 0.00 2.41 0.00 0.00 30.24 30.92 3k8p n GLN 32 CO 0.00 0.00 0.00 1.03 0.07 0.00 0.00 177.06 178.16 3k8p h SER 33 N 0.00 -0.72 0.36 1.69 0.87 -1.87 -1.06 113.55 112.82 3k8p h SER 33 Ca -0.11 0.21 -0.11 0.00 -1.23 0.00 0.00 61.79 60.54 3k8p h SER 33 Cb 1.38 0.44 -0.01 0.00 -0.44 0.00 0.00 62.40 63.77 3k8p h SER 33 CO 0.03 -0.24 -0.48 0.11 -0.53 0.00 0.00 176.83 175.72 3k8p h LYS 34 N -0.03 0.14 -0.10 2.24 1.79 -1.87 -1.58 116.57 117.16 3k8p h LYS 34 Ca 0.31 -0.07 -0.02 0.00 -2.18 0.00 0.00 60.65 58.68 3k8p h LYS 34 Cb 0.50 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.15 3k8p h LYS 34 CO -0.69 0.59 -0.01 -0.92 -1.08 0.00 0.00 179.45 177.34 3k8p h TYR 35 N 0.11 0.20 -0.24 -1.35 3.20 -1.52 -3.20 116.97 114.18 3k8p h TYR 35 Ca 0.00 -0.04 -0.01 0.00 3.14 0.00 0.00 58.73 61.82 3k8p h TYR 35 Cb 0.89 -0.05 -0.01 0.00 1.54 0.00 0.00 36.73 39.10 3k8p h TYR 35 CO 0.01 0.46 0.10 -0.07 -1.64 0.00 0.00 178.16 177.02 3k8p h LEU 36 N -0.11 0.32 -0.66 2.82 3.38 -1.11 -2.93 115.31 117.02 3k8p h LEU 36 Ca 0.03 -0.16 0.14 0.00 0.09 0.00 0.00 57.88 57.98 3k8p h LEU 36 Cb 0.39 -0.08 -0.12 0.00 0.09 0.00 0.00 40.66 40.94 3k8p h LEU 36 CO 0.01 0.39 -0.03 -0.33 0.09 0.00 0.00 178.44 178.56 3k8p h GLU 37 N 0.23 0.08 -0.42 1.13 5.08 -1.36 -0.23 114.58 119.11 3k8p h GLU 37 Ca 0.08 -0.01 -0.12 0.00 -1.00 0.00 0.00 59.36 58.32 3k8p h GLU 37 Cb 0.16 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.38 3k8p h GLU 37 CO -0.01 0.06 -0.20 -0.84 -1.00 0.00 0.00 179.01 177.02 3k8p h ILE 38 N 0.09 1.28 0.00 3.13 3.07 -1.56 -2.46 117.51 121.05 3k8p h ILE 38 Ca 0.34 -1.34 -0.00 0.00 1.55 0.00 0.00 64.86 65.41 3k8p h ILE 38 Cb 0.57 1.24 -0.00 0.00 -0.27 0.00 0.00 36.82 38.36 3k8p h ILE 38 CO -0.59 0.45 -0.01 0.25 -1.05 0.00 0.00 178.15 177.20 3k8p h LEU 39 N 0.70 0.00 0.19 0.16 5.85 -1.08 0.11 115.31 121.24 3k8p h LEU 39 Ca 0.09 0.00 -0.27 0.00 0.84 0.00 0.00 57.88 58.54 3k8p h LEU 39 Cb 0.76 0.00 0.03 0.00 0.37 0.00 0.00 40.66 41.82 3k8p h LEU 39 CO 0.06 0.01 -1.22 0.00 -0.34 0.00 0.00 178.44 176.95 3k8p h VAL 41 N -0.11 1.29 0.00 0.00 2.07 -1.23 -3.42 116.25 114.85 3k8p h VAL 41 Ca -0.22 -2.13 -0.15 0.00 0.82 0.00 0.00 66.70 65.02 3k8p h VAL 41 Cb 1.92 2.59 -0.02 0.00 -1.52 0.00 0.00 31.29 34.26 3k8p h VAL 41 CO 0.20 0.44 -0.71 -0.07 0.02 0.00 0.00 177.57 177.45 3k8p h LEU 42 N -1.00 0.00 -9.54 2.57 3.38 -0.98 -3.44 115.31 106.30 3k8p h LEU 42 Ca -0.12 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.32 3k8p h LEU 42 Cb 1.01 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.78 3k8p h LEU 42 CO -0.07 0.71 0.81 0.86 0.09 0.00 0.00 178.44 180.84 3k8p s TRP 43 N -3.06 3.07 -0.14 1.13 -0.11 -1.25 -4.86 118.94 113.73 3k8p s TRP 43 Ca 0.01 0.78 -0.33 0.00 1.22 0.00 0.00 56.10 57.78 3k8p s TRP 43 Cb 0.10 -3.78 -0.10 0.00 -1.50 0.00 0.00 33.47 28.18 3k8p s TRP 43 CO 0.77 -2.86 1.99 -2.30 -4.62 0.00 0.00 176.95 169.93 3k8p n PRO 44 N 4.24 2.04 -0.17 5.86 -0.02 -1.26 -4.82 135.00 140.86 3k8p n PRO 44 Ca 0.13 0.71 0.28 0.00 -2.02 0.00 0.00 63.50 62.60 3k8p n PRO 44 Cb 0.41 -2.74 0.56 0.00 -0.02 0.00 0.00 33.50 31.71 3k8p n PRO 44 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 3k8p h GLU 45 N 10.68 0.00 -0.04 -0.52 3.07 -1.89 0.91 114.58 126.79 3k8p h GLU 45 Ca -0.44 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.42 3k8p h GLU 45 Cb 1.27 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.18 3k8p h GLU 45 CO 0.96 0.00 0.00 1.28 -1.40 0.00 0.00 179.01 179.85 3k8p n LEU 46 N -3.44 2.30 -4.75 1.33 7.99 -1.26 -4.91 117.00 114.25 3k8p n LEU 46 Ca 0.21 -0.78 -0.33 0.00 -0.01 0.00 0.00 56.01 55.09 3k8p n LEU 46 Cb 1.32 -0.01 0.07 0.00 -0.11 0.00 0.00 43.42 44.68 3k8p n LEU 46 CO 0.27 0.39 0.75 -0.62 -1.51 0.00 0.00 177.39 176.66 3k8p s ASP 47 N -1.97 4.73 0.24 -1.43 -1.08 0.31 -4.97 116.67 112.50 3k8p s ASP 47 Ca 0.33 2.07 -0.30 0.00 -0.52 0.00 0.00 52.55 54.13 3k8p s ASP 47 Cb 0.20 -2.56 -0.09 0.00 -1.46 0.00 0.00 42.92 39.01 3k8p s ASP 47 CO 0.31 -1.89 1.32 -0.62 0.52 0.00 0.00 175.17 174.81 3k8p s ASP 48 N -2.54 6.85 0.43 -0.34 -1.08 -1.26 -4.92 116.67 113.80 3k8p s ASP 48 Ca 0.68 2.50 0.12 0.00 -0.52 0.00 0.00 52.55 55.32 3k8p s ASP 48 Cb -0.22 -2.62 0.97 0.00 -1.46 0.00 0.00 42.92 39.59 3k8p s ASP 48 CO 0.45 -0.54 2.00 -0.65 0.52 0.00 0.00 175.17 176.95 3k8p h PRO 49 N 4.84 0.45 -0.17 4.34 0.11 -1.93 -1.55 132.00 138.08 3k8p h PRO 49 Ca -0.46 -0.03 0.05 0.00 0.11 0.00 0.00 66.00 65.67 3k8p h PRO 49 Cb 1.22 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 3k8p h PRO 49 CO 0.74 0.30 0.22 0.87 -0.21 0.00 0.00 178.00 179.92 3k8p h LYS 50 N 0.46 0.00 0.00 1.05 1.57 -1.95 0.49 116.57 118.19 3k8p h LYS 50 Ca 0.24 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.02 3k8p h LYS 50 Cb 0.35 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.66 3k8p h LYS 50 CO -0.06 0.00 0.00 0.09 -0.57 0.00 0.00 179.45 178.91 3k8p n ASN 51 N -3.65 0.00 -0.10 0.86 4.13 -0.58 -1.96 115.26 113.97 3k8p n ASN 51 Ca 0.01 -0.16 0.05 0.00 1.68 0.00 0.00 54.58 56.16 3k8p n ASN 51 Cb 0.34 -0.18 -0.04 0.00 -1.54 0.00 0.00 39.78 38.36 3k8p n ASN 51 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 3k8p n LEU 52 N -1.18 0.80 -0.11 3.41 4.77 0.17 -4.57 117.00 120.29 3k8p n LEU 52 Ca 0.10 -0.61 0.27 0.00 -0.03 0.00 0.00 56.01 55.74 3k8p n LEU 52 Cb 0.11 0.00 0.69 0.00 -2.33 0.00 0.00 43.42 41.88 3k8p n LEU 52 CO 0.12 0.17 1.24 0.25 -1.33 0.00 0.00 177.39 177.85 3k8p h LEU 53 N 0.48 0.00 -1.95 2.23 5.85 -1.33 0.41 115.31 121.01 3k8p h LEU 53 Ca 0.00 0.00 0.05 0.00 0.84 0.00 0.00 57.88 58.77 3k8p h LEU 53 Cb 0.30 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.32 3k8p h LEU 53 CO 0.00 0.00 0.14 2.19 -0.34 0.00 0.00 178.44 180.43 3k8p h PHE 54 N 0.00 0.06 0.00 1.25 -5.15 -1.81 -1.79 116.94 109.50 3k8p h PHE 54 Ca 0.38 0.00 -0.05 0.00 -0.20 0.00 0.00 57.97 58.09 3k8p h PHE 54 Cb 1.84 -0.02 -0.01 0.00 0.22 0.00 0.00 35.95 37.98 3k8p h PHE 54 CO 0.00 0.04 -0.26 -0.07 -2.00 0.00 0.00 178.31 176.02 3k8p h LEU 55 N 0.06 0.00 0.07 2.10 3.38 -0.52 -2.38 115.31 118.02 3k8p h LEU 55 Ca 0.09 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.83 3k8p h LEU 55 Cb 0.29 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 3k8p h LEU 55 CO -0.01 0.26 -1.23 -0.09 0.09 0.00 0.00 178.44 177.46 3k8p h ARG 56 N 0.00 0.15 -0.91 1.13 2.43 -1.46 -3.34 114.38 112.38 3k8p h ARG 56 Ca -0.00 -0.25 0.05 0.00 -0.81 0.00 0.00 59.98 58.96 3k8p h ARG 56 Cb 0.62 0.09 -0.05 0.00 -0.42 0.00 0.00 29.97 30.21 3k8p h ARG 56 CO 0.03 1.12 0.59 0.93 -1.51 0.00 0.00 179.97 181.14 3k8p h GLU 57 N -0.56 1.07 0.00 0.20 5.08 -1.53 0.82 114.58 119.66 3k8p h GLU 57 Ca -0.29 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.01 3k8p h GLU 57 Cb 1.56 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 30.57 3k8p h GLU 57 CO -0.02 0.71 0.00 -0.11 -1.00 0.00 0.00 179.01 178.59 3k8p n LEU 58 N -4.46 0.00 0.00 1.33 0.00 -0.90 -1.51 117.00 111.46 3k8p n LEU 58 Ca 0.13 0.04 0.00 0.00 0.00 0.00 0.00 56.01 56.18 3k8p n LEU 58 Cb 0.14 -0.04 0.00 0.00 0.00 0.00 0.00 43.42 43.52 3k8p n LEU 58 CO 0.34 -0.04 -0.47 1.21 0.00 0.00 0.00 177.39 178.43 3k8p n GLU 59 N -1.01 2.14 0.19 1.96 4.07 0.26 -4.70 120.64 123.55 3k8p n GLU 59 Ca 0.00 0.00 0.14 0.00 -0.06 0.00 0.00 57.16 57.24 3k8p n GLU 59 Cb 0.00 -0.97 0.54 0.00 -0.06 0.00 0.00 31.44 30.96 3k8p n GLU 59 CO 0.00 0.00 0.00 0.93 -0.06 0.00 0.00 177.13 178.00 3k8p h GLU 60 N 0.00 0.00 0.00 5.31 5.08 0.36 -3.44 114.58 121.89 3k8p h GLU 60 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3k8p h GLU 60 Cb 0.93 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.18 3k8p h GLU 60 CO 0.00 0.00 0.00 -1.91 -1.00 0.00 0.00 179.01 176.10 3k8p n GLU 61 N -2.61 0.00 0.00 2.33 4.07 -0.94 -5.01 120.64 118.48 3k8p n GLU 61 Ca 0.02 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.12 3k8p n GLU 61 Cb 0.29 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.67 3k8p n GLU 61 CO 0.00 0.00 0.00 1.33 -0.06 0.00 0.00 177.13 178.40 3k8p n VAL 62 N 0.00 0.00 0.00 6.31 0.24 -1.26 -4.61 118.33 119.00 3k8p n VAL 62 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 3k8p n VAL 62 Cb 0.00 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.37 3k8p n VAL 62 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3k8p n TYR 101 N 0.00 0.00 1.18 6.34 -0.00 -1.26 -4.81 117.16 118.61 3k8p n TYR 101 Ca 0.00 0.00 0.10 0.00 -0.00 0.00 0.00 57.90 58.00 3k8p n TYR 101 Cb 0.00 -0.05 0.57 0.00 -0.00 0.00 0.00 39.34 39.86 3k8p n TYR 101 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.86 178.44 3k8p n HIS 102 N 0.00 0.00 -0.28 2.98 -0.00 -1.26 -1.12 115.22 115.55 3k8p n HIS 102 Ca 0.00 0.00 -0.08 0.00 0.46 0.00 0.00 57.72 58.10 3k8p n HIS 102 Cb 0.00 -0.06 0.16 0.00 -0.12 0.00 0.00 29.99 29.96 3k8p n HIS 102 CO 0.00 0.00 0.00 0.39 0.46 0.00 0.00 176.34 177.19 3k8p n GLU 103 N -1.06 2.34 0.07 1.57 -0.58 -1.26 -3.95 120.64 117.76 3k8p n GLU 103 Ca 0.14 -1.85 0.13 0.00 -0.42 0.00 0.00 57.16 55.16 3k8p n GLU 103 Cb 0.09 -1.80 0.44 0.00 -0.57 0.00 0.00 31.44 29.60 3k8p n GLU 103 CO 0.00 0.00 0.00 -0.11 -0.48 0.00 0.00 177.13 176.54 3k8p n LEU 104 N -0.18 0.55 0.20 -4.62 7.94 -0.27 -3.21 117.00 117.41 3k8p n LEU 104 Ca 0.29 0.50 0.08 0.00 -1.11 0.00 0.00 56.01 55.77 3k8p n LEU 104 Cb 1.07 -0.36 0.38 0.00 0.53 0.00 0.00 43.42 45.05 3k8p n LEU 104 CO 0.31 -0.11 0.73 0.06 -1.11 0.00 0.00 177.39 177.27 3k8p h GLN 105 N 0.00 0.00 -0.61 1.96 3.07 -1.83 -2.77 115.11 114.93 3k8p h GLN 105 Ca 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 58.65 58.73 3k8p h GLN 105 Cb 0.66 0.00 -0.03 0.00 0.08 0.00 0.00 27.48 28.19 3k8p h GLN 105 CO 0.00 0.30 0.36 0.93 0.09 0.00 0.00 178.83 180.51 3k8p h GLU 106 N 0.00 0.82 -0.05 0.06 4.39 -1.87 -2.01 114.58 115.93 3k8p h GLU 106 Ca -0.00 -0.07 -0.04 0.00 0.34 0.00 0.00 59.36 59.58 3k8p h GLU 106 Cb 0.84 -0.17 0.00 0.00 -0.10 0.00 0.00 28.75 29.32 3k8p h GLU 106 CO 0.04 0.58 -0.14 0.35 -1.16 0.00 0.00 179.01 178.69 3k8p h PHE 107 N 0.84 0.24 -0.51 4.33 3.04 -1.69 0.50 116.94 123.68 3k8p h PHE 107 Ca 0.22 -0.09 0.06 0.00 3.98 0.00 0.00 57.97 62.13 3k8p h PHE 107 Cb -0.02 -0.04 -0.05 0.00 2.56 0.00 0.00 35.95 38.40 3k8p h PHE 107 CO 0.00 0.75 0.22 -0.84 -2.02 0.00 0.00 178.31 176.42 3k8p h ILE 108 N -0.34 0.89 0.00 1.41 3.07 -1.45 0.55 117.51 121.64 3k8p h ILE 108 Ca -0.00 -0.15 0.00 0.00 1.55 0.00 0.00 64.86 66.26 3k8p h ILE 108 Cb 0.75 0.42 0.00 0.00 -0.27 0.00 0.00 36.82 37.72 3k8p h ILE 108 CO 0.03 0.08 0.00 0.77 -1.05 0.00 0.00 178.15 177.98 3k8p h SER 109 N 0.43 0.00 -0.15 2.16 4.64 -1.41 0.13 113.55 119.35 3k8p h SER 109 Ca 0.23 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.53 3k8p h SER 109 Cb 0.20 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.28 3k8p h SER 109 CO -0.20 0.00 0.02 0.50 -0.87 0.00 0.00 176.83 176.28 3k8p h LYS 110 N 0.00 0.26 0.25 4.77 3.64 0.87 0.31 116.57 126.67 3k8p h LYS 110 Ca 0.00 -0.07 -0.01 0.00 -1.27 0.00 0.00 60.65 59.30 3k8p h LYS 110 Cb 0.66 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.46 3k8p h LYS 110 CO 0.00 0.45 -0.12 0.87 -2.27 0.00 0.00 179.45 178.38 3k8p h LYS 111 N 0.03 -0.32 0.00 1.90 1.79 -0.56 -2.95 116.57 116.47 3k8p h LYS 111 Ca 0.05 0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.54 3k8p h LYS 111 Cb 0.32 0.07 0.00 0.00 -1.58 0.00 0.00 32.23 31.04 3k8p h LYS 111 CO 0.00 0.04 0.00 1.28 -1.08 0.00 0.00 179.45 179.69 3k8p n LEU 112 N -5.04 0.00 -3.60 2.94 4.32 0.41 -4.87 117.00 111.15 3k8p n LEU 112 Ca -0.09 0.48 -0.21 0.00 -0.02 0.00 0.00 56.01 56.18 3k8p n LEU 112 Cb 0.26 -0.48 0.05 0.00 -1.62 0.00 0.00 43.42 41.63 3k8p n LEU 112 CO 0.28 -0.33 -0.02 -3.20 -1.22 0.00 0.00 177.39 172.89 3k8p n ASN 113 N -1.48 -2.11 0.00 -1.43 5.15 0.76 -1.74 115.26 114.40 3k8p n ASN 113 Ca 0.02 -0.78 0.00 0.00 -0.60 0.00 0.00 54.58 53.22 3k8p n ASN 113 Cb 0.10 -4.33 0.00 0.00 -0.53 0.00 0.00 39.78 35.02 3k8p n ASN 113 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 3k8p n ASN 114 N -3.06 -2.82 -4.70 1.20 3.02 0.62 -4.94 115.26 104.58 3k8p n ASN 114 Ca -0.26 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 53.86 3k8p n ASN 114 Cb 0.67 -2.37 -0.03 0.00 -0.61 0.00 0.00 39.78 37.43 3k8p n ASN 114 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 3k8p s LYS 115 N -1.17 4.28 0.24 3.52 1.02 -0.71 -5.01 119.74 121.91 3k8p s LYS 115 Ca 0.00 2.06 -0.24 0.00 0.02 0.00 0.00 55.97 57.81 3k8p s LYS 115 Cb 0.00 -3.49 -0.09 0.00 -0.52 0.00 0.00 37.83 33.74 3k8p s LYS 115 CO 0.00 -0.56 0.83 -0.08 -0.92 0.00 0.00 175.35 174.62 3k8p s THR 116 N 2.08 4.36 -0.81 2.17 -1.32 -1.26 -4.90 115.64 115.95 3k8p s THR 116 Ca 0.66 1.64 0.02 0.00 -1.21 0.00 0.00 61.69 62.79 3k8p s THR 116 Cb -0.34 -4.02 0.20 0.00 -1.51 0.00 0.00 72.50 66.82 3k8p s THR 116 CO 0.28 0.29 0.65 -0.22 -2.21 0.00 0.00 174.62 173.41 3k8p s LEU 117 N -1.73 5.20 0.38 9.08 1.98 -1.26 -4.96 118.68 127.37 3k8p s LEU 117 Ca 0.43 -3.81 0.24 0.00 -2.89 0.00 0.00 54.13 48.10 3k8p s LEU 117 Cb -0.20 -1.78 0.40 0.00 0.66 0.00 0.00 46.19 45.27 3k8p s LEU 117 CO 0.24 -0.13 1.59 -0.33 -1.89 0.00 0.00 176.35 175.83 3k8p h GLU 118 N 5.69 0.00 -2.55 1.98 5.08 -1.93 -3.38 114.58 119.47 3k8p h GLU 118 Ca 0.15 0.00 0.14 0.00 -1.00 0.00 0.00 59.36 58.65 3k8p h GLU 118 Cb 0.78 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.98 3k8p h GLU 118 CO 0.79 0.00 0.47 0.54 -1.00 0.00 0.00 179.01 179.82 3k8p s ASN 119 N -5.81 -0.09 0.17 1.42 2.20 -1.26 -4.80 114.94 106.77 3k8p s ASN 119 Ca 0.07 -0.62 -0.22 0.00 -0.94 0.00 0.00 52.86 51.14 3k8p s ASN 119 Cb 0.07 0.56 0.08 0.00 -2.00 0.00 0.00 41.25 39.96 3k8p s ASN 119 CO 0.67 -1.08 1.60 0.15 -2.94 0.00 0.00 177.10 175.49 3k8p h PHE 120 N 2.00 -0.89 -0.65 1.54 3.57 -1.91 0.33 116.94 120.92 3k8p h PHE 120 Ca -0.26 0.06 0.05 0.00 3.53 0.00 0.00 57.97 61.35 3k8p h PHE 120 Cb 1.23 0.46 -0.05 0.00 2.79 0.00 0.00 35.95 40.38 3k8p h PHE 120 CO 0.88 -0.38 0.36 1.49 -2.23 0.00 0.00 178.31 178.44 3k8p h GLU 121 N -0.22 0.66 -0.39 1.11 4.81 -1.98 0.41 114.58 118.98 3k8p h GLU 121 Ca 0.19 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.37 3k8p h GLU 121 Cb 0.54 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.75 3k8p h GLU 121 CO -0.58 0.44 0.20 1.49 -0.73 0.00 0.00 179.01 179.83 3k8p h GLU 122 N 0.68 0.55 -0.32 1.92 4.81 -1.66 -2.75 114.58 117.81 3k8p h GLU 122 Ca 0.29 -0.07 0.06 0.00 -0.13 0.00 0.00 59.36 59.51 3k8p h GLU 122 Cb 0.16 -0.10 -0.06 0.00 0.63 0.00 0.00 28.75 29.38 3k8p h GLU 122 CO -0.17 0.46 -0.07 2.35 -0.73 0.00 0.00 179.01 180.85 3k8p h TRP 123 N 0.49 -0.15 -0.55 0.92 7.01 0.90 -2.94 115.95 121.63 3k8p h TRP 123 Ca 0.13 0.03 -0.07 0.00 2.11 0.00 0.00 58.89 61.10 3k8p h TRP 123 Cb 0.08 0.12 -0.02 0.00 -2.10 0.00 0.00 29.16 27.23 3k8p h TRP 123 CO -0.02 -0.13 0.07 1.25 -2.79 0.00 0.00 178.44 176.82 3k8p h LEU 124 N 0.01 0.84 -0.69 0.65 5.85 -0.12 0.36 115.31 122.21 3k8p h LEU 124 Ca 0.15 -0.19 -0.04 0.00 0.84 0.00 0.00 57.88 58.64 3k8p h LEU 124 Cb 0.23 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.01 3k8p h LEU 124 CO -0.32 0.86 0.27 -0.09 -0.34 0.00 0.00 178.44 178.82 3k8p h ARG 125 N 0.83 1.04 -0.35 1.25 2.43 -1.46 -1.27 114.38 116.85 3k8p h ARG 125 Ca 0.17 -0.20 -0.14 0.00 -0.81 0.00 0.00 59.98 59.00 3k8p h ARG 125 Cb 0.40 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.78 3k8p h ARG 125 CO 0.01 0.87 -0.34 0.93 -1.51 0.00 0.00 179.97 179.93 3k8p h GLU 126 N 0.99 0.80 -0.22 0.20 4.39 -1.24 -2.06 114.58 117.45 3k8p h GLU 126 Ca 0.23 -0.39 -0.19 0.00 0.34 0.00 0.00 59.36 59.35 3k8p h GLU 126 Cb 0.22 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.87 3k8p h GLU 126 CO -0.02 1.02 -0.63 -0.09 -1.16 0.00 0.00 179.01 178.13 3k8p h ARG 127 N 0.67 0.75 -0.23 2.33 9.65 -0.24 -1.17 114.38 126.14 3k8p h ARG 127 Ca 0.07 -0.52 0.04 0.00 -1.10 0.00 0.00 59.98 58.47 3k8p h ARG 127 Cb 0.89 0.08 -0.04 0.00 -1.39 0.00 0.00 29.97 29.51 3k8p h ARG 127 CO 0.08 1.15 -0.03 0.82 2.80 0.00 0.00 179.97 184.79 3k8p h ILE 128 N 0.56 0.80 0.28 1.20 2.04 -1.19 -1.55 117.51 119.64 3k8p h ILE 128 Ca -0.01 -0.01 -0.01 0.00 1.00 0.00 0.00 64.86 65.83 3k8p h ILE 128 Cb 1.23 0.77 0.00 0.00 -0.74 0.00 0.00 36.82 38.08 3k8p h ILE 128 CO 0.13 0.01 -0.13 -0.07 0.00 0.00 0.00 178.15 178.08 3k8p h LEU 129 N 0.03 -0.32 -1.92 1.44 3.38 -1.27 0.23 115.31 116.88 3k8p h LEU 129 Ca 0.11 -0.07 0.11 0.00 0.09 0.00 0.00 57.88 58.12 3k8p h LEU 129 Cb 0.15 0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 3k8p h LEU 129 CO -0.21 -0.13 0.30 0.40 0.09 0.00 0.00 178.44 178.89 3k8p h ILE 130 N -0.49 0.83 0.00 1.22 2.04 -1.16 -0.69 117.51 119.26 3k8p h ILE 130 Ca -0.04 -0.03 -0.00 0.00 1.00 0.00 0.00 64.86 65.79 3k8p h ILE 130 Cb 0.36 0.73 -0.00 0.00 -0.74 0.00 0.00 36.82 37.17 3k8p h ILE 130 CO 0.06 0.02 -0.82 0.00 0.00 0.00 0.00 178.15 177.41 3k8p h ASN 132 N 0.00 0.61 0.00 0.00 -1.24 0.56 0.23 115.58 115.74 3k8p h ASN 132 Ca -0.00 -0.20 0.00 0.00 0.71 0.00 0.00 56.30 56.81 3k8p h ASN 132 Cb 1.00 -0.16 0.00 0.00 0.73 0.00 0.00 38.32 39.89 3k8p h ASN 132 CO 0.00 0.81 0.26 1.21 -1.29 0.00 0.00 177.43 178.42 3k8p n GLU 133 N -4.14 0.00 -0.13 6.67 2.13 -0.84 -2.23 120.64 122.11 3k8p n GLU 133 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 3k8p n GLU 133 Cb 0.39 -1.70 0.00 0.00 0.27 0.00 0.00 31.44 30.40 3k8p n GLU 133 CO 0.00 0.00 0.00 -0.89 -0.41 0.00 0.00 177.13 175.83 3k8p n ILE 135 N -0.74 0.00 0.20 6.31 2.08 0.07 -5.08 119.36 122.20 3k8p n ILE 135 Ca 0.00 -0.02 0.16 0.00 0.56 0.00 0.00 62.75 63.45 3k8p n ILE 135 Cb 0.26 0.00 0.80 0.00 -0.75 0.00 0.00 39.64 39.95 3k8p n ILE 135 CO 0.00 0.00 0.00 1.55 0.56 0.00 0.00 176.55 178.66 3k8p h PRO 136 N 1.15 0.00 0.00 0.38 0.13 -1.69 -1.89 132.00 130.09 3k8p h PRO 136 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 3k8p h PRO 136 Cb 0.02 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.15 3k8p h PRO 136 CO 0.02 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 176.94 3k8p n GLU 137 N -3.97 0.18 -3.57 0.86 0.00 -1.26 -4.23 120.64 108.64 3k8p n GLU 137 Ca 0.01 0.37 -0.28 0.00 0.00 0.00 0.00 57.16 57.27 3k8p n GLU 137 Cb 0.29 -1.82 -0.11 0.00 0.00 0.00 0.00 31.44 29.80 3k8p n GLU 137 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.13 178.12 3k8p s THR 138 N -3.25 1.10 0.04 3.84 2.01 -0.71 -4.92 115.64 113.75 3k8p s THR 138 Ca 0.05 -2.93 0.21 0.00 0.31 0.00 0.00 61.69 59.34 3k8p s THR 138 Cb 0.10 -1.75 0.19 0.00 0.01 0.00 0.00 72.50 71.04 3k8p s THR 138 CO 0.40 -1.10 1.72 -0.65 -0.69 0.00 0.00 174.62 174.30 3k8p h PRO 139 N 5.90 0.00 -0.19 4.92 0.11 -1.77 -2.73 132.00 138.24 3k8p h PRO 139 Ca 0.17 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.28 3k8p h PRO 139 Cb 0.88 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.99 3k8p h PRO 139 CO 0.46 0.30 0.00 1.28 -0.21 0.00 0.00 178.00 179.83 3k8p n LEU 140 N -3.36 1.46 -0.35 2.35 4.32 -1.26 -4.45 117.00 115.72 3k8p n LEU 140 Ca 0.01 -0.65 0.03 0.00 -0.02 0.00 0.00 56.01 55.37 3k8p n LEU 140 Cb 0.51 -0.12 0.09 0.00 -1.62 0.00 0.00 43.42 42.28 3k8p n LEU 140 CO 0.35 0.33 0.59 -0.11 -1.22 0.00 0.00 177.39 177.33 3k8p n LEU 141 N 0.22 -0.45 -1.41 2.23 0.00 -1.03 -0.77 117.00 115.78 3k8p n LEU 141 Ca 0.14 1.63 -0.05 0.00 0.00 0.00 0.00 56.01 57.72 3k8p n LEU 141 Cb 0.27 -0.44 0.13 0.00 0.00 0.00 0.00 43.42 43.38 3k8p n LEU 141 CO 0.11 -1.52 0.74 -1.22 0.00 0.00 0.00 177.39 175.50 3k8p n TYR 142 N -5.47 1.27 0.16 1.96 4.01 -1.26 -4.39 117.16 113.44 3k8p n TYR 142 Ca 0.13 -0.81 0.06 0.00 -0.16 0.00 0.00 57.90 57.11 3k8p n TYR 142 Cb 0.43 -0.46 0.52 0.00 -0.31 0.00 0.00 39.34 39.52 3k8p n TYR 142 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 3k8p h SER 143 N 1.07 0.18 -0.67 7.72 4.64 -1.29 -2.50 113.55 122.69 3k8p h SER 143 Ca 0.18 -0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 61.48 3k8p h SER 143 Cb 1.61 -0.04 -0.03 0.00 -0.31 0.00 0.00 62.40 63.62 3k8p h SER 143 CO 0.41 0.18 0.38 1.62 -0.87 0.00 0.00 176.83 178.55 3k8p h VAL 144 N 0.20 1.20 0.00 0.95 3.04 -1.84 -0.96 116.25 118.85 3k8p h VAL 144 Ca 0.05 -0.48 -0.04 0.00 -1.01 0.00 0.00 66.70 65.22 3k8p h VAL 144 Cb 0.07 0.31 -0.01 0.00 -2.01 0.00 0.00 31.29 29.66 3k8p h VAL 144 CO -0.00 0.22 -0.17 -0.07 -1.01 0.00 0.00 177.57 176.53 3k8p h LEU 145 N 0.91 0.00 0.00 3.16 4.07 -1.80 -3.03 115.31 118.63 3k8p h LEU 145 Ca 0.24 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.20 3k8p h LEU 145 Cb 0.01 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.75 3k8p h LEU 145 CO -0.04 0.17 -1.01 -2.67 -1.08 0.00 0.00 178.44 173.82 3k8p n TRP 146 N -3.89 0.00 0.02 1.13 2.14 -1.07 -4.50 117.44 111.27 3k8p n TRP 146 Ca -0.02 0.00 -0.18 0.00 2.07 0.00 0.00 57.50 59.37 3k8p n TRP 146 Cb 0.27 -0.08 -0.13 0.00 -0.81 0.00 0.00 31.31 30.56 3k8p n TRP 146 CO 0.00 0.00 0.00 1.49 2.07 0.00 0.00 177.69 181.25 3k8p h GLU 147 N 0.00 0.32 -1.03 -2.67 4.81 -1.05 -3.30 114.58 111.66 3k8p h GLU 147 Ca 0.00 -0.44 -0.67 0.00 -0.13 0.00 0.00 59.36 58.13 3k8p h GLU 147 Cb 0.48 0.15 -0.31 0.00 0.63 0.00 0.00 28.75 29.70 3k8p h GLU 147 CO 0.00 1.15 0.69 0.25 -0.73 0.00 0.00 179.01 180.37 3k8p n THR 148 N -4.21 3.50 -2.97 0.32 -2.24 -1.22 -4.97 114.28 102.48 3k8p n THR 148 Ca -0.12 -3.16 -0.40 0.00 -2.27 0.00 0.00 64.05 58.10 3k8p n THR 148 Cb 0.72 -1.16 -0.05 0.00 -2.10 0.00 0.00 70.33 67.74 3k8p n THR 148 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3k8p s ALA 149 N -3.82 3.37 0.59 6.98 0.00 -1.25 -5.05 121.76 122.58 3k8p s ALA 149 Ca 0.63 0.30 -0.06 0.00 0.00 0.00 0.00 51.96 52.83 3k8p s ALA 149 Cb 0.49 -3.01 0.00 0.00 0.00 0.00 0.00 23.12 20.61 3k8p s ALA 149 CO -0.03 0.08 0.90 0.15 0.00 0.00 0.00 175.76 176.86 3k8p s LYS 150 N -0.13 3.01 -0.76 0.00 3.01 -1.26 -4.81 119.74 118.80 3k8p s LYS 150 Ca 0.39 0.07 -0.34 0.00 -1.01 0.00 0.00 55.97 55.07 3k8p s LYS 150 Cb -0.21 -2.26 -0.20 0.00 -1.01 0.00 0.00 37.83 34.15 3k8p s LYS 150 CO 0.24 -0.66 2.35 0.45 0.51 0.00 0.00 175.35 178.24 3k8p n SER 151 N -2.58 0.45 -0.30 2.83 2.88 -1.26 -1.95 113.62 113.69 3k8p n SER 151 Ca 0.04 0.36 -0.04 0.00 -1.33 0.00 0.00 58.87 57.90 3k8p n SER 151 Cb 0.57 -0.87 -0.02 0.00 -0.75 0.00 0.00 64.21 63.15 3k8p n SER 151 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 3k8p n LYS 152 N 7.70 -0.43 0.22 -1.46 5.02 -1.26 -4.87 118.16 123.08 3k8p n LYS 152 Ca 0.59 0.53 0.10 0.00 -2.02 0.00 0.00 58.31 57.51 3k8p n LYS 152 Cb 0.00 -4.17 0.49 0.00 -0.02 0.00 0.00 35.03 31.33 3k8p n LYS 152 CO 0.00 0.00 0.00 -0.39 -0.52 0.00 0.00 177.40 176.49 3k8p h VAL 153 N 0.00 0.59 -3.32 -0.18 -1.51 -1.75 -3.39 116.25 106.69 3k8p h VAL 153 Ca -0.08 -1.07 -0.67 0.00 -1.23 0.00 0.00 66.70 63.65 3k8p h VAL 153 Cb 0.33 1.72 -0.30 0.00 -2.13 0.00 0.00 31.29 30.91 3k8p h VAL 153 CO 0.12 0.22 -0.82 -0.76 -1.23 0.00 0.00 177.57 175.10 3k8p s LEU 154 N -6.89 2.44 0.77 4.19 1.43 -1.26 -4.36 118.68 115.00 3k8p s LEU 154 Ca -0.00 -0.43 -0.11 0.00 -1.03 0.00 0.00 54.13 52.56 3k8p s LEU 154 Cb 0.11 -1.52 0.06 0.00 0.03 0.00 0.00 46.19 44.86 3k8p s LEU 154 CO 0.63 0.16 1.09 -0.94 0.23 0.00 0.00 176.35 177.52 3k8p s SER 155 N 0.37 4.53 0.52 2.29 1.04 -1.26 -4.90 113.70 116.29 3k8p s SER 155 Ca -0.14 1.75 0.18 0.00 0.48 0.00 0.00 55.95 58.22 3k8p s SER 155 Cb -0.17 -2.47 1.29 0.00 0.10 0.00 0.00 66.02 64.77 3k8p s SER 155 CO 0.07 -2.01 2.11 0.71 0.98 0.00 0.00 173.24 175.10 3k8p h THR 156 N -1.11 0.94 -0.63 2.02 1.35 -1.99 0.37 112.91 113.86 3k8p h THR 156 Ca -0.44 -0.00 0.13 0.00 -0.55 0.00 0.00 66.41 65.54 3k8p h THR 156 Cb 1.23 0.93 -0.12 0.00 -1.73 0.00 0.00 68.15 68.46 3k8p h THR 156 CO 0.53 0.00 -0.10 0.11 -0.25 0.00 0.00 175.52 175.81 3k8p h LYS 157 N 0.01 0.04 -0.01 4.72 1.79 -1.99 0.16 116.57 121.29 3k8p h LYS 157 Ca 0.06 -0.00 -0.00 0.00 -2.18 0.00 0.00 60.65 58.53 3k8p h LYS 157 Cb 0.24 -0.01 -0.00 0.00 -1.58 0.00 0.00 32.23 30.89 3k8p h LYS 157 CO -0.00 0.02 0.00 0.35 -1.08 0.00 0.00 179.45 178.74 3k8p h PHE 158 N 0.04 0.01 -0.14 -1.35 3.04 -1.27 -2.46 116.94 114.81 3k8p h PHE 158 Ca 0.31 -0.00 -0.03 0.00 3.98 0.00 0.00 57.97 62.23 3k8p h PHE 158 Cb 0.50 -0.00 -0.01 0.00 2.56 0.00 0.00 35.95 38.99 3k8p h PHE 158 CO -0.46 0.24 -0.06 0.82 -2.02 0.00 0.00 178.31 176.83 3k8p h ILE 159 N -0.22 1.13 -0.38 1.41 2.04 -1.33 -2.15 117.51 118.00 3k8p h ILE 159 Ca 0.00 -0.53 -0.06 0.00 1.00 0.00 0.00 64.86 65.28 3k8p h ILE 159 Cb 0.23 1.09 -0.01 0.00 -0.74 0.00 0.00 36.82 37.39 3k8p h ILE 159 CO 0.00 0.17 0.00 1.23 0.00 0.00 0.00 178.15 179.55 3k8p h GLY 160 N 0.54 0.73 0.55 5.37 0.00 -0.50 0.51 103.07 110.27 3k8p h GLY 160 Ca 0.04 -0.53 0.09 0.00 0.00 0.00 0.00 47.33 46.94 3k8p h GLY 160 CO 0.01 0.49 0.52 -0.25 0.00 0.00 0.00 176.54 177.31 3k8p h TRP 161 N 0.50 0.94 0.07 5.60 7.01 -0.93 2.77 115.95 131.90 3k8p h TRP 161 Ca 0.11 0.03 -0.00 0.00 2.11 0.00 0.00 58.89 61.14 3k8p h TRP 161 Cb 0.46 -0.29 0.00 0.00 -2.10 0.00 0.00 29.16 27.23 3k8p h TRP 161 CO 0.04 0.40 -0.03 0.28 -2.79 0.00 0.00 178.44 176.34 3k8p h VAL 162 N 0.87 1.00 0.00 2.65 2.07 -0.77 0.63 116.25 122.70 3k8p h VAL 162 Ca 0.41 -0.23 -0.09 0.00 0.82 0.00 0.00 66.70 67.62 3k8p h VAL 162 Cb 0.35 1.15 -0.01 0.00 -1.52 0.00 0.00 31.29 31.26 3k8p h VAL 162 CO -0.24 0.06 -0.41 -0.33 0.02 0.00 0.00 177.57 176.67 3k8p h GLU 163 N -0.19 0.00 0.00 1.57 4.39 -0.15 -0.22 114.58 119.98 3k8p h GLU 163 Ca -0.01 0.00 -0.25 0.00 0.34 0.00 0.00 59.36 59.44 3k8p h GLU 163 Cb 0.16 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 28.77 3k8p h GLU 163 CO 0.02 0.41 -1.70 0.41 -1.16 0.00 0.00 179.01 176.98 3k8p n GLY 164 N -0.26 -1.06 0.98 -3.84 0.00 0.92 -4.41 105.19 97.52 3k8p n GLY 164 Ca -0.02 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.89 3k8p n GLY 164 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3k8p n VAL 165 N -2.94 0.00 -0.21 1.61 0.31 0.22 -4.08 118.33 113.24 3k8p n VAL 165 Ca -0.16 0.00 0.01 0.00 -0.01 0.00 0.00 64.34 64.18 3k8p n VAL 165 Cb 0.98 -0.72 0.11 0.00 -0.91 0.00 0.00 33.84 33.30 3k8p n VAL 165 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 3k8p h LEU 166 N 0.00 -0.21 0.34 7.52 3.38 -1.47 0.29 115.31 125.15 3k8p h LEU 166 Ca 0.00 0.15 -0.02 0.00 0.09 0.00 0.00 57.88 58.10 3k8p h LEU 166 Cb 0.00 0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.00 3k8p h LEU 166 CO 0.00 -0.09 -0.16 0.11 0.09 0.00 0.00 178.44 178.39 3k8p h LYS 167 N 0.15 -0.44 -0.69 1.13 1.57 -1.28 0.18 116.57 117.18 3k8p h LYS 167 Ca 0.33 0.03 0.14 0.00 -1.87 0.00 0.00 60.65 59.27 3k8p h LYS 167 Cb 0.53 0.10 -0.10 0.00 0.08 0.00 0.00 32.23 32.84 3k8p h LYS 167 CO -0.51 -0.11 0.20 -1.35 -0.57 0.00 0.00 179.45 177.11 3k8p h PRO 168 N -0.85 0.31 0.07 3.15 0.11 -1.67 -0.16 132.00 132.95 3k8p h PRO 168 Ca -0.05 -0.02 0.02 0.00 0.11 0.00 0.00 66.00 66.07 3k8p h PRO 168 Cb 0.53 -0.07 -0.04 0.00 0.11 0.00 0.00 31.00 31.53 3k8p h PRO 168 CO 0.08 0.21 -0.25 1.25 -0.21 0.00 0.00 178.00 179.07 3k8p h LEU 169 N 0.32 -0.73 -0.16 2.35 5.85 -0.25 -0.45 115.31 122.25 3k8p h LEU 169 Ca 0.38 0.09 0.05 0.00 0.84 0.00 0.00 57.88 59.23 3k8p h LEU 169 Cb 0.59 0.29 -0.05 0.00 0.37 0.00 0.00 40.66 41.85 3k8p h LEU 169 CO -0.44 -0.33 -0.17 -0.78 -0.34 0.00 0.00 178.44 176.38 3k8p h ASP 170 N -0.43 -0.54 -0.68 1.25 3.58 -0.12 -0.06 116.42 119.42 3k8p h ASP 170 Ca 0.04 0.10 0.10 0.00 0.42 0.00 0.00 57.03 57.69 3k8p h ASP 170 Cb 0.48 0.26 -0.07 0.00 1.72 0.00 0.00 39.33 41.71 3k8p h ASP 170 CO -0.18 -0.22 0.31 -0.74 -2.88 0.00 0.00 179.24 175.53 3k8p h HIS 171 N -0.20 0.55 0.59 0.28 2.76 -0.67 0.25 115.15 118.71 3k8p h HIS 171 Ca 0.11 0.03 -0.03 0.00 -2.20 0.00 0.00 60.37 58.28 3k8p h HIS 171 Cb 0.36 -0.14 0.01 0.00 1.55 0.00 0.00 27.41 29.18 3k8p h HIS 171 CO -0.30 0.17 -0.29 1.25 -1.30 0.00 0.00 177.93 177.47 3k8p h LEU 172 N 0.53 -0.68 -0.81 0.26 7.12 -0.73 -0.15 115.31 120.85 3k8p h LEU 172 Ca 0.34 -0.01 0.12 0.00 0.13 0.00 0.00 57.88 58.45 3k8p h LEU 172 Cb 0.39 0.17 -0.13 0.00 -0.53 0.00 0.00 40.66 40.57 3k8p h LEU 172 CO -0.29 -0.41 -0.42 0.78 -0.13 0.00 0.00 178.44 177.97 3k8p h ASN 173 N -0.91 -1.51 0.06 1.25 2.35 -0.53 -0.77 115.58 115.52 3k8p h ASN 173 Ca -0.08 0.28 0.00 0.00 -0.55 0.00 0.00 56.30 55.95 3k8p h ASN 173 Cb 0.65 0.73 0.00 0.00 0.05 0.00 0.00 38.32 39.75 3k8p h ASN 173 CO 0.13 -0.30 -0.01 0.29 -1.65 0.00 0.00 177.43 175.89 3k8p n LYS 174 N -5.42 1.12 -0.06 0.81 5.02 0.84 -0.79 118.16 119.68 3k8p n LYS 174 Ca 0.06 -0.28 -0.22 0.00 -2.02 0.00 0.00 58.31 55.84 3k8p n LYS 174 Cb 0.36 -1.49 -0.12 0.00 -0.02 0.00 0.00 35.03 33.75 3k8p n LYS 174 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 3k8p n ARG 175 N -0.69 0.64 -0.80 1.97 0.63 -0.08 -4.55 116.66 113.78 3k8p n ARG 175 Ca 0.21 0.45 0.08 0.00 -0.92 0.00 0.00 57.85 57.67 3k8p n ARG 175 Cb 0.20 -1.73 0.39 0.00 0.45 0.00 0.00 32.46 31.77 3k8p n ARG 175 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 3k8p n LEU 176 N -4.06 5.40 -4.02 6.15 4.77 -0.37 -4.94 117.00 119.93 3k8p n LEU 176 Ca -0.32 -2.79 -0.39 0.00 -0.03 0.00 0.00 56.01 52.47 3k8p n LEU 176 Cb 0.83 -0.65 0.00 0.00 -2.33 0.00 0.00 43.42 41.27 3k8p n LEU 176 CO 0.28 0.69 -0.21 1.41 -1.33 0.00 0.00 177.39 178.23 3k8p n HIS 177 N 0.73 -1.50 -4.56 -1.77 8.25 -0.59 -4.98 115.22 110.79 3k8p n HIS 177 Ca 0.27 0.31 -0.26 0.00 -0.26 0.00 0.00 57.72 57.78 3k8p n HIS 177 Cb 1.10 -3.02 -0.10 0.00 1.12 0.00 0.00 29.99 29.08 3k8p n HIS 177 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3k8p s LEU 178 N -7.20 2.52 -0.35 2.41 1.43 0.03 -5.05 118.68 112.47 3k8p s LEU 178 Ca 0.36 -1.41 0.14 0.00 -1.03 0.00 0.00 54.13 52.19 3k8p s LEU 178 Cb -0.18 -0.65 0.39 0.00 0.03 0.00 0.00 46.19 45.79 3k8p s LEU 178 CO 0.95 -0.57 0.84 2.30 0.23 0.00 0.00 176.35 180.09 3k8p n ILE 179 N -0.89 0.31 -1.77 -0.59 -5.35 -1.26 -4.55 119.36 105.27 3k8p n ILE 179 Ca -0.05 -3.84 -0.42 0.00 -0.27 0.00 0.00 62.75 58.17 3k8p n ILE 179 Cb 0.67 0.18 -0.03 0.00 -1.74 0.00 0.00 39.64 38.72 3k8p n ILE 179 CO 0.00 0.00 0.00 -0.36 -1.76 0.00 0.00 176.55 174.43 3k8p s PHE 180 N -2.61 2.93 0.39 4.28 0.40 -1.26 -4.81 117.98 117.30 3k8p s PHE 180 Ca 0.34 0.41 -0.24 0.00 -0.60 0.00 0.00 56.93 56.84 3k8p s PHE 180 Cb 0.39 -4.10 -0.09 0.00 0.51 0.00 0.00 43.02 39.73 3k8p s PHE 180 CO -0.03 -4.13 1.04 0.15 0.70 0.00 0.00 175.22 172.95 3k8p s LYS 181 N 1.09 4.20 0.36 0.44 1.02 -1.26 -4.91 119.74 120.68 3k8p s LYS 181 Ca 0.73 1.48 0.08 0.00 0.02 0.00 0.00 55.97 58.29 3k8p s LYS 181 Cb -0.49 -2.55 0.79 0.00 -0.52 0.00 0.00 37.83 35.07 3k8p s LYS 181 CO 0.33 -0.11 1.91 0.82 -0.92 0.00 0.00 175.35 177.38 3k8p h ILE 182 N 2.21 0.92 -0.03 2.17 2.04 -1.92 -0.22 117.51 122.68 3k8p h ILE 182 Ca -0.48 -0.24 -0.02 0.00 1.00 0.00 0.00 64.86 65.12 3k8p h ILE 182 Cb 1.21 0.14 0.00 0.00 -0.74 0.00 0.00 36.82 37.43 3k8p h ILE 182 CO 0.62 0.13 -0.05 0.78 0.00 0.00 0.00 178.15 179.63 3k8p h ASN 183 N 0.71 0.09 -0.19 1.72 2.35 -1.96 -1.48 115.58 116.82 3k8p h ASN 183 Ca 0.39 -0.55 -0.02 0.00 -0.55 0.00 0.00 56.30 55.56 3k8p h ASN 183 Cb 0.52 -0.03 -0.01 0.00 0.05 0.00 0.00 38.32 38.85 3k8p h ASN 183 CO -0.15 0.63 0.07 1.05 -1.65 0.00 0.00 177.43 177.37 3k8p h GLU 184 N -0.44 0.36 -0.69 0.81 4.11 -1.89 -1.41 114.58 115.43 3k8p h GLU 184 Ca 0.00 -0.05 -0.06 0.00 0.07 0.00 0.00 59.36 59.33 3k8p h GLU 184 Cb 0.61 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.76 3k8p h GLU 184 CO 0.01 0.33 0.21 2.35 0.07 0.00 0.00 179.01 181.99 3k8p h TRP 185 N 0.36 1.12 -0.12 2.06 2.91 -0.79 -3.07 115.95 118.42 3k8p h TRP 185 Ca 0.09 -0.12 -0.11 0.00 1.13 0.00 0.00 58.89 59.88 3k8p h TRP 185 Cb 0.13 -0.32 0.00 0.00 -0.51 0.00 0.00 29.16 28.46 3k8p h TRP 185 CO 0.00 0.90 -0.35 0.93 -1.03 0.00 0.00 178.44 178.89 3k8p h GLU 186 N 1.02 0.45 -6.02 2.65 5.08 -0.89 -3.47 114.58 113.40 3k8p h GLU 186 Ca 0.22 -0.33 -0.54 0.00 -1.00 0.00 0.00 59.36 57.72 3k8p h GLU 186 Cb 0.31 0.05 -0.09 0.00 0.50 0.00 0.00 28.75 29.53 3k8p h GLU 186 CO -0.01 0.94 1.35 0.15 -1.00 0.00 0.00 179.01 180.45 3k8p s LYS 187 N -3.86 3.38 -0.17 2.33 1.02 -0.57 -4.99 119.74 116.88 3k8p s LYS 187 Ca -0.13 -0.96 -0.08 0.00 0.02 0.00 0.00 55.97 54.82 3k8p s LYS 187 Cb 0.05 -5.30 -0.04 0.00 -0.52 0.00 0.00 37.83 32.02 3k8p s LYS 187 CO 0.80 -2.46 0.09 -2.14 -0.92 0.00 0.00 175.35 170.72 3k8p s PRO 189 N 5.40 3.88 0.48 -1.68 0.02 -1.26 -5.06 135.00 136.78 3k8p s PRO 189 Ca 0.51 -0.27 0.19 0.00 0.02 0.00 0.00 61.00 61.45 3k8p s PRO 189 Cb -0.01 -3.24 1.19 0.00 0.02 0.00 0.00 34.50 32.45 3k8p s PRO 189 CO -0.08 0.40 2.03 0.38 -0.33 0.00 0.00 177.00 179.41 3k8p h ASP 190 N 6.27 0.00 -0.19 2.53 3.04 -1.97 -0.18 116.42 125.92 3k8p h ASP 190 Ca -0.42 0.00 0.02 0.00 -3.24 0.00 0.00 57.03 53.39 3k8p h ASP 190 Cb 1.17 0.00 -0.02 0.00 -1.04 0.00 0.00 39.33 39.44 3k8p h ASP 190 CO 0.69 0.15 0.05 -1.28 -2.04 0.00 0.00 179.24 176.81 3k8p h SER 191 N 0.00 0.04 1.73 4.15 0.87 -2.00 0.11 113.55 118.44 3k8p h SER 191 Ca -0.00 0.02 -0.02 0.00 -1.23 0.00 0.00 61.79 60.56 3k8p h SER 191 Cb 0.31 0.03 -0.00 0.00 -0.44 0.00 0.00 62.40 62.29 3k8p h SER 191 CO 0.02 0.05 -0.11 1.05 -0.53 0.00 0.00 176.83 177.30 3k8p h GLU 192 N 0.13 0.00 0.65 2.24 4.11 -1.87 -2.38 114.58 117.45 3k8p h GLU 192 Ca 0.08 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 59.48 3k8p h GLU 192 Cb 0.07 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.32 3k8p h GLU 192 CO -0.10 0.11 -0.32 1.25 0.07 0.00 0.00 179.01 180.03 3k8p h LEU 193 N 0.00 -0.76 -1.03 3.06 6.46 -0.35 -1.67 115.31 121.03 3k8p h LEU 193 Ca -0.00 0.03 0.02 0.00 -0.12 0.00 0.00 57.88 57.81 3k8p h LEU 193 Cb 1.01 0.20 -0.05 0.00 -0.73 0.00 0.00 40.66 41.09 3k8p h LEU 193 CO 0.01 -0.53 0.65 -0.26 -0.62 0.00 0.00 178.44 177.70 3k8p h PHE 194 N -0.88 1.24 -0.06 1.25 0.04 -0.87 -2.63 116.94 115.03 3k8p h PHE 194 Ca -0.09 0.03 -0.02 0.00 2.80 0.00 0.00 57.97 60.69 3k8p h PHE 194 Cb 0.68 -0.42 -0.01 0.00 2.20 0.00 0.00 35.95 38.40 3k8p h PHE 194 CO -0.04 0.76 -0.06 0.87 -0.60 0.00 0.00 178.31 179.25 3k8p h LYS 195 N 1.31 0.08 0.00 1.51 1.57 -1.10 -1.40 116.57 118.54 3k8p h LYS 195 Ca 0.37 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.14 3k8p h LYS 195 Cb -0.10 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.19 3k8p h LYS 195 CO -0.09 0.14 -0.93 0.44 -0.57 0.00 0.00 179.45 178.44 3k8p n ILE 196 N -4.42 0.17 0.30 1.86 -5.35 -0.66 -3.28 119.36 107.98 3k8p n ILE 196 Ca -0.02 -0.21 0.16 0.00 -0.27 0.00 0.00 62.75 62.41 3k8p n ILE 196 Cb 0.16 0.21 0.63 0.00 -1.74 0.00 0.00 39.64 38.90 3k8p n ILE 196 CO 0.00 0.00 0.00 0.40 -1.76 0.00 0.00 176.55 175.19 3k8p h ILE 197 N 0.00 0.00 -3.62 7.28 2.04 -0.91 -3.41 117.51 118.90 3k8p h ILE 197 Ca 0.00 -0.49 -0.68 0.00 1.00 0.00 0.00 64.86 64.69 3k8p h ILE 197 Cb 0.70 1.45 -0.35 0.00 -0.74 0.00 0.00 36.82 37.88 3k8p h ILE 197 CO 0.00 0.00 -0.63 -0.36 0.00 0.00 0.00 178.15 177.16 3k8p s PHE 198 N -3.58 3.50 0.00 1.37 0.40 -0.86 -5.04 117.98 113.77 3k8p s PHE 198 Ca 0.02 -2.32 0.00 0.00 -0.60 0.00 0.00 56.93 54.03 3k8p s PHE 198 Cb 0.09 -2.79 0.00 0.00 0.51 0.00 0.00 43.02 40.83 3k8p s PHE 198 CO 0.53 -0.91 0.00 -3.47 0.70 0.00 0.00 175.22 172.07 3k8p n ASP 199 N 4.55 0.16 0.11 1.36 2.03 -1.26 -4.90 116.55 118.59 3k8p n ASP 199 Ca -0.05 -0.00 -0.24 0.00 0.52 0.00 0.00 54.79 55.02 3k8p n ASP 199 Cb 0.42 0.04 -0.15 0.00 -0.72 0.00 0.00 41.12 40.70 3k8p n ASP 199 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3k8p h ALA 211 N 0.00 -0.06 -0.39 -1.67 0.00 -2.03 -3.54 119.26 111.57 3k8p h ALA 211 Ca 0.00 -0.93 0.08 0.00 0.00 0.00 0.00 54.91 54.06 3k8p h ALA 211 Cb 0.00 0.26 -0.09 0.00 0.00 0.00 0.00 17.79 17.96 3k8p h ALA 211 CO 0.00 0.75 -0.25 0.22 0.00 0.00 0.00 179.25 179.97 3k8p h ASP 212 N 0.05 -0.83 -0.78 0.00 -0.00 -2.03 0.19 116.42 113.03 3k8p h ASP 212 Ca -0.27 0.17 0.17 0.00 -0.00 0.00 0.00 57.03 57.10 3k8p h ASP 212 Cb 2.07 0.42 -0.11 0.00 -0.00 0.00 0.00 39.33 41.71 3k8p h ASP 212 CO 0.23 -0.27 0.25 0.58 -0.00 0.00 0.00 179.24 180.03 3k8p h VAL 213 N -0.18 0.53 -0.15 2.25 2.07 -1.99 -0.55 116.25 118.23 3k8p h VAL 213 Ca 0.19 -0.11 -0.13 0.00 0.82 0.00 0.00 66.70 67.46 3k8p h VAL 213 Cb 0.48 0.17 0.00 0.00 -1.52 0.00 0.00 31.29 30.42 3k8p h VAL 213 CO -0.50 0.06 -0.41 0.40 0.02 0.00 0.00 177.57 177.14 3k8p h ILE 214 N 0.33 1.35 0.20 4.57 1.08 -1.73 -1.12 117.51 122.20 3k8p h ILE 214 Ca 0.45 -1.69 -0.01 0.00 -0.39 0.00 0.00 64.86 63.22 3k8p h ILE 214 Cb 0.77 2.03 0.00 0.00 -3.07 0.00 0.00 36.82 36.56 3k8p h ILE 214 CO -0.50 0.51 -0.10 -0.33 -0.69 0.00 0.00 178.15 177.05 3k8p h GLU 215 N 0.17 -0.26 -0.13 2.37 5.08 0.09 -1.62 114.58 120.28 3k8p h GLU 215 Ca -0.01 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 3k8p h GLU 215 Cb 1.03 0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.34 3k8p h GLU 215 CO 0.09 -0.12 0.00 -0.40 -1.00 0.00 0.00 179.01 177.57 3k8p n ASP 216 N -5.18 2.42 -0.01 1.42 5.68 -0.29 -4.34 116.55 116.26 3k8p n ASP 216 Ca -0.09 -2.10 -0.05 0.00 -0.50 0.00 0.00 54.79 52.05 3k8p n ASP 216 Cb 0.15 -0.13 -0.02 0.00 -1.14 0.00 0.00 41.12 39.99 3k8p n ASP 216 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 3k8p n GLU 217 N -0.19 0.17 0.10 0.11 1.02 -0.51 -4.09 120.64 117.24 3k8p n GLU 217 Ca 0.06 0.07 -0.10 0.00 -0.02 0.00 0.00 57.16 57.17 3k8p n GLU 217 Cb 0.36 -0.79 -0.06 0.00 -0.02 0.00 0.00 31.44 30.93 3k8p n GLU 217 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 3k8p h LEU 218 N -0.30 -0.28 0.11 -4.62 5.85 -1.26 -2.88 115.31 111.93 3k8p h LEU 218 Ca -0.08 -0.22 0.01 0.00 0.84 0.00 0.00 57.88 58.43 3k8p h LEU 218 Cb 0.63 0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.72 3k8p h LEU 218 CO -0.05 0.22 -0.12 0.00 -0.34 0.00 0.00 178.44 178.16 3k8p h ALA 219 N -0.58 -0.22 -0.56 1.25 0.00 -1.51 0.16 119.26 117.80 3k8p h ALA 219 Ca -0.03 -0.03 0.10 0.00 0.00 0.00 0.00 54.91 54.95 3k8p h ALA 219 Cb 0.48 0.17 -0.08 0.00 0.00 0.00 0.00 17.79 18.37 3k8p h ALA 219 CO 0.06 -0.64 0.11 -1.35 0.00 0.00 0.00 179.25 177.42 3k8p h PRO 220 N -0.26 0.23 0.41 0.00 0.11 -1.76 0.34 132.00 131.08 3k8p h PRO 220 Ca 0.01 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 66.10 3k8p h PRO 220 Cb 0.25 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 31.29 3k8p h PRO 220 CO -0.04 0.15 -0.33 1.15 -0.21 0.00 0.00 178.00 178.72 3k8p h THR 221 N 0.24 0.31 -0.51 -1.15 2.02 -1.24 -0.91 112.91 111.67 3k8p h THR 221 Ca 0.29 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.53 3k8p h THR 221 Cb 0.41 0.31 -0.05 0.00 -1.74 0.00 0.00 68.15 67.08 3k8p h THR 221 CO -0.38 0.00 0.21 -0.07 0.37 0.00 0.00 175.52 175.66 3k8p h LEU 222 N -0.74 0.26 0.07 2.58 3.38 -0.01 -2.37 115.31 118.48 3k8p h LEU 222 Ca -0.04 0.05 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 3k8p h LEU 222 Cb 0.65 0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.41 3k8p h LEU 222 CO -0.02 0.18 -0.04 -1.28 0.09 0.00 0.00 178.44 177.38 3k8p h SER 223 N 0.42 -0.08 0.48 -0.43 0.87 -0.26 0.32 113.55 114.86 3k8p h SER 223 Ca 0.24 -0.04 -0.02 0.00 -1.23 0.00 0.00 61.79 60.74 3k8p h SER 223 Cb 0.22 0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 62.19 3k8p h SER 223 CO -0.21 -0.01 -0.30 0.22 -0.53 0.00 0.00 176.83 176.00 3k8p h TYR 224 N -0.15 -0.79 0.00 2.24 5.03 -0.89 -2.29 116.97 120.13 3k8p h TYR 224 Ca -0.01 -0.01 0.00 0.00 2.58 0.00 0.00 58.73 61.29 3k8p h TYR 224 Cb 0.12 0.28 0.00 0.00 1.55 0.00 0.00 36.73 38.68 3k8p h TYR 224 CO -0.06 -0.46 0.00 0.41 -1.32 0.00 0.00 178.16 176.74 3k8p n GLY 225 N -1.43 -0.69 3.76 1.82 0.00 -0.92 -4.90 105.19 102.83 3k8p n GLY 225 Ca -0.11 -0.14 -0.34 0.00 0.00 0.00 0.00 46.02 45.43 3k8p n GLY 225 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3k8p n LYS 226 N -1.00 -1.09 -0.18 1.61 5.02 -0.57 -4.92 118.16 117.03 3k8p n LYS 226 Ca 0.16 0.39 0.07 0.00 -2.02 0.00 0.00 58.31 56.91 3k8p n LYS 226 Cb 0.08 -3.84 0.15 0.00 -0.02 0.00 0.00 35.03 31.39 3k8p n LYS 226 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3k8p n LYS 227 N -4.35 2.35 0.13 1.97 5.02 -0.00 -4.79 118.16 118.49 3k8p n LYS 227 Ca -0.10 -2.36 -0.14 0.00 -2.02 0.00 0.00 58.31 53.69 3k8p n LYS 227 Cb 0.59 -1.46 -0.07 0.00 -0.02 0.00 0.00 35.03 34.06 3k8p n LYS 227 CO 0.00 0.00 0.00 -1.49 -0.52 0.00 0.00 177.40 175.39 3k8p h TRP 228 N 0.83 -1.13 -0.38 2.13 4.06 -1.92 0.57 115.95 120.11 3k8p h TRP 228 Ca 0.00 0.03 0.03 0.00 2.06 0.00 0.00 58.89 61.00 3k8p h TRP 228 Cb 0.99 0.47 -0.02 0.00 -1.00 0.00 0.00 29.16 29.60 3k8p h TRP 228 CO 0.18 -0.51 0.26 1.49 -3.56 0.00 0.00 178.44 176.29 3k8p h GLU 229 N -0.66 0.39 0.25 0.49 4.81 -1.88 -0.42 114.58 117.55 3k8p h GLU 229 Ca 0.02 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.21 3k8p h GLU 229 Cb 0.68 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.97 3k8p h GLU 229 CO -0.21 0.26 -0.12 1.15 -0.73 0.00 0.00 179.01 179.36 3k8p h THR 230 N 0.41 0.80 0.02 0.32 2.02 -1.65 -1.89 112.91 112.94 3k8p h THR 230 Ca 0.16 -0.65 0.00 0.00 0.77 0.00 0.00 66.41 66.69 3k8p h THR 230 Cb 0.12 1.15 -0.00 0.00 -1.74 0.00 0.00 68.15 67.68 3k8p h THR 230 CO -0.04 0.13 -0.02 0.15 0.37 0.00 0.00 175.52 176.12 3k8p h PHE 231 N -0.69 -0.06 -0.46 3.16 3.57 -0.56 -1.93 116.94 119.98 3k8p h PHE 231 Ca -0.03 0.00 0.09 0.00 3.53 0.00 0.00 57.97 61.56 3k8p h PHE 231 Cb 0.48 0.02 -0.09 0.00 2.79 0.00 0.00 35.95 39.14 3k8p h PHE 231 CO 0.03 -0.04 -0.19 0.82 -2.23 0.00 0.00 178.31 176.70 3k8p h ILE 232 N -0.05 0.40 -0.56 1.41 2.04 -1.12 0.49 117.51 120.13 3k8p h ILE 232 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 3k8p h ILE 232 Cb 0.05 0.40 -0.03 0.00 -0.74 0.00 0.00 36.82 36.51 3k8p h ILE 232 CO -0.01 0.00 0.36 0.74 0.00 0.00 0.00 178.15 179.24 3k8p h THR 233 N -0.09 1.15 0.00 -0.27 2.02 -1.07 0.13 112.91 114.78 3k8p h THR 233 Ca 0.22 -0.30 -0.01 0.00 0.77 0.00 0.00 66.41 67.09 3k8p h THR 233 Cb 0.43 0.35 -0.00 0.00 -1.74 0.00 0.00 68.15 67.19 3k8p h THR 233 CO -0.52 0.15 -1.14 1.21 0.37 0.00 0.00 175.52 175.59 3k8p n GLU 234 N -4.68 0.61 -0.02 6.66 2.13 -0.70 -4.51 120.64 120.13 3k8p n GLU 234 Ca 0.03 0.10 -0.02 0.00 0.66 0.00 0.00 57.16 57.93 3k8p n GLU 234 Cb 0.03 -1.79 -0.02 0.00 0.27 0.00 0.00 31.44 29.92 3k8p n GLU 234 CO 0.00 0.00 0.00 1.19 -0.41 0.00 0.00 177.13 177.91 3k8p n PHE 235 N -2.65 0.00 -2.45 4.31 3.01 0.16 -4.82 117.46 115.03 3k8p n PHE 235 Ca -0.01 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 58.03 3k8p n PHE 235 Cb 0.57 -0.15 0.01 0.00 -0.01 0.00 0.00 39.48 39.90 3k8p n PHE 235 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 3k8p n PHE 236 N -2.20 2.64 -4.21 1.38 7.35 0.46 -4.61 117.46 118.28 3k8p n PHE 236 Ca -0.05 -2.71 -0.14 0.00 -0.76 0.00 0.00 57.45 53.79 3k8p n PHE 236 Cb 0.60 -1.64 -0.05 0.00 0.35 0.00 0.00 39.48 38.73 3k8p n PHE 236 CO 0.00 0.00 0.00 0.27 -0.76 0.00 0.00 176.76 176.27 3k8p n ASN 237 N 2.13 -0.30 0.24 -2.13 0.23 -1.26 -4.78 115.26 109.39 3k8p n ASN 237 Ca 0.43 -2.49 0.12 0.00 -0.53 0.00 0.00 54.58 52.11 3k8p n ASN 237 Cb 0.31 1.09 0.54 0.00 -2.08 0.00 0.00 39.78 39.64 3k8p n ASN 237 CO 0.00 0.00 0.00 0.07 -0.93 0.00 0.00 177.26 176.40 3k8p h LYS 238 N 0.00 0.00 -0.22 -3.83 2.10 -1.89 -0.39 116.57 112.34 3k8p h LYS 238 Ca -0.17 0.00 -0.14 0.00 -2.00 0.00 0.00 60.65 58.35 3k8p h LYS 238 Cb 0.82 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.15 3k8p h LYS 238 CO 0.25 0.17 -0.39 1.96 -2.00 0.00 0.00 179.45 179.44 3k8p h GLN 239 N 0.00 0.66 0.00 0.07 7.50 -1.97 -3.26 115.11 118.11 3k8p h GLN 239 Ca -0.00 -0.41 -0.17 0.00 0.50 0.00 0.00 58.65 58.57 3k8p h GLN 239 Cb 0.65 0.04 -0.02 0.00 0.05 0.00 0.00 27.48 28.20 3k8p h GLN 239 CO 0.02 1.03 -0.85 1.96 -1.50 0.00 0.00 178.83 179.49 3k8p h GLN 240 N 0.36 0.00 -2.51 1.46 1.08 -1.77 -3.39 115.11 110.34 3k8p h GLN 240 Ca 0.02 0.00 -0.63 0.00 -1.45 0.00 0.00 58.65 56.59 3k8p h GLN 240 Cb 0.98 0.00 -0.40 0.00 -0.05 0.00 0.00 27.48 28.01 3k8p h GLN 240 CO 0.09 0.76 -0.45 1.19 -0.95 0.00 0.00 178.83 179.47 3k8p n PHE 241 N -3.27 3.51 0.24 2.96 3.01 -0.17 -4.85 117.46 118.88 3k8p n PHE 241 Ca -0.00 -4.07 0.09 0.00 1.01 0.00 0.00 57.45 54.48 3k8p n PHE 241 Cb 0.86 -0.67 0.59 0.00 -0.01 0.00 0.00 39.48 40.25 3k8p n PHE 241 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 3k8p h SER 242 N 4.64 0.00 -1.19 4.37 4.64 -1.78 -3.44 113.55 120.79 3k8p h SER 242 Ca 0.19 0.00 -0.33 0.00 -0.47 0.00 0.00 61.79 61.18 3k8p h SER 242 Cb 0.68 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 62.68 3k8p h SER 242 CO 0.85 0.19 -0.33 0.18 -0.87 0.00 0.00 176.83 176.86 3k8p n LEU 243 N -3.82 -1.32 0.14 5.97 4.77 -1.26 -4.71 117.00 116.77 3k8p n LEU 243 Ca -0.02 0.28 -0.01 0.00 -0.03 0.00 0.00 56.01 56.24 3k8p n LEU 243 Cb 0.29 -2.33 0.18 0.00 -2.33 0.00 0.00 43.42 39.23 3k8p n LEU 243 CO 0.33 -0.65 0.51 0.50 -1.33 0.00 0.00 177.39 176.75 3k8p h LYS 244 N 0.00 0.00 -6.75 3.23 3.64 -1.89 -3.34 116.57 111.46 3k8p h LYS 244 Ca -0.34 0.00 -0.68 0.00 -1.27 0.00 0.00 60.65 58.36 3k8p h LYS 244 Cb 1.11 0.00 -0.19 0.00 -0.41 0.00 0.00 32.23 32.74 3k8p h LYS 244 CO 0.47 0.60 -0.81 -1.54 -2.27 0.00 0.00 179.45 175.90 3k8p s SER 245 N -6.81 3.81 0.22 4.20 1.04 -1.26 -4.91 113.70 109.99 3k8p s SER 245 Ca -0.01 -0.59 -0.09 0.00 0.48 0.00 0.00 55.95 55.74 3k8p s SER 245 Cb 0.13 -0.50 0.34 0.00 0.10 0.00 0.00 66.02 66.09 3k8p s SER 245 CO 0.76 0.18 1.67 -0.78 0.98 0.00 0.00 173.24 176.04 3k8p h ASP 246 N 3.74 -0.19 -0.68 7.02 1.82 -1.98 -1.22 116.42 124.93 3k8p h ASP 246 Ca -0.50 0.15 -0.05 0.00 -0.39 0.00 0.00 57.03 56.24 3k8p h ASP 246 Cb 1.17 0.25 -0.03 0.00 0.68 0.00 0.00 39.33 41.40 3k8p h ASP 246 CO 0.45 -0.09 0.24 0.71 -1.61 0.00 0.00 179.24 178.94 3k8p h THR 247 N 0.16 1.25 -0.19 2.25 1.35 -1.98 0.26 112.91 116.01 3k8p h THR 247 Ca 0.35 -0.83 -0.00 0.00 -0.55 0.00 0.00 66.41 65.38 3k8p h THR 247 Cb 0.57 0.45 -0.01 0.00 -1.73 0.00 0.00 68.15 67.44 3k8p h THR 247 CO -0.52 0.33 0.10 -1.13 -0.25 0.00 0.00 175.52 174.04 3k8p h ASN 248 N 1.03 0.24 -0.57 5.36 -0.73 -1.80 -1.30 115.58 117.81 3k8p h ASN 248 Ca 0.23 -0.09 0.08 0.00 1.87 0.00 0.00 56.30 58.39 3k8p h ASN 248 Cb 0.25 -0.06 -0.07 0.00 0.27 0.00 0.00 38.32 38.72 3k8p h ASN 248 CO -0.01 0.26 0.21 0.22 -0.37 0.00 0.00 177.43 177.74 3k8p h TYR 249 N 0.19 0.37 0.00 0.67 5.03 -0.65 0.80 116.97 123.39 3k8p h TYR 249 Ca 0.07 0.03 -0.06 0.00 2.58 0.00 0.00 58.73 61.34 3k8p h TYR 249 Cb 0.08 -0.08 -0.01 0.00 1.55 0.00 0.00 36.73 38.27 3k8p h TYR 249 CO -0.04 0.11 -0.28 0.37 -1.32 0.00 0.00 178.16 177.00 3k8p h GLN 250 N 0.40 0.00 0.02 1.82 5.75 -0.52 -0.30 115.11 122.27 3k8p h GLN 250 Ca 0.28 0.00 -0.21 0.00 -0.15 0.00 0.00 58.65 58.58 3k8p h GLN 250 Cb 0.33 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.86 3k8p h GLN 250 CO -0.28 0.28 -0.94 1.25 -2.65 0.00 0.00 178.83 176.49 3k8p h LEU 251 N 0.00 0.19 -0.92 -2.39 5.85 -0.39 -2.66 115.31 114.99 3k8p h LEU 251 Ca -0.00 -0.17 0.05 0.00 0.84 0.00 0.00 57.88 58.60 3k8p h LEU 251 Cb 0.52 -0.06 -0.06 0.00 0.37 0.00 0.00 40.66 41.43 3k8p h LEU 251 CO 0.04 1.02 0.59 0.15 -0.34 0.00 0.00 178.44 179.89 3k8p h PHE 252 N 0.06 1.09 0.05 1.25 3.04 0.86 -2.08 116.94 121.20 3k8p h PHE 252 Ca -0.04 0.03 -0.24 0.00 3.98 0.00 0.00 57.97 61.69 3k8p h PHE 252 Cb 1.61 -0.36 0.01 0.00 2.56 0.00 0.00 35.95 39.76 3k8p h PHE 252 CO 0.02 0.59 -1.05 0.82 -2.02 0.00 0.00 178.31 176.67 3k8p h ILE 253 N 1.10 1.41 0.18 1.41 1.08 -1.31 -1.83 117.51 119.55 3k8p h ILE 253 Ca 0.39 -2.60 -0.01 0.00 -0.39 0.00 0.00 64.86 62.25 3k8p h ILE 253 Cb 0.11 2.58 0.00 0.00 -3.07 0.00 0.00 36.82 36.43 3k8p h ILE 253 CO -0.15 0.77 -0.09 0.11 -0.69 0.00 0.00 178.15 178.10 3k8p h LYS 254 N 0.20 -0.24 -0.73 2.37 1.57 -1.32 -1.21 116.57 117.20 3k8p h LYS 254 Ca -0.10 0.02 -0.05 0.00 -1.87 0.00 0.00 60.65 58.64 3k8p h LYS 254 Cb 1.71 0.05 -0.03 0.00 0.08 0.00 0.00 32.23 34.04 3k8p h LYS 254 CO 0.18 -0.02 0.25 -0.07 -0.57 0.00 0.00 179.45 179.22 3k8p h LEU 255 N -0.41 1.05 0.10 2.94 3.38 -1.47 -2.22 115.31 118.68 3k8p h LEU 255 Ca -0.03 -0.20 0.02 0.00 0.09 0.00 0.00 57.88 57.77 3k8p h LEU 255 Cb 0.32 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.76 3k8p h LEU 255 CO 0.04 0.96 -0.26 0.22 0.09 0.00 0.00 178.44 179.49 3k8p h TYR 256 N 1.07 -0.69 -0.73 1.13 3.20 -1.24 -1.12 116.97 118.58 3k8p h TYR 256 Ca 0.24 0.02 0.03 0.00 3.14 0.00 0.00 58.73 62.16 3k8p h TYR 256 Cb 0.27 0.29 -0.04 0.00 1.54 0.00 0.00 36.73 38.79 3k8p h TYR 256 CO 0.02 -0.36 0.48 1.88 -1.64 0.00 0.00 178.16 178.55 3k8p h TYR 257 N -0.46 0.87 0.00 -3.82 0.99 -0.62 0.20 116.97 114.12 3k8p h TYR 257 Ca 0.03 0.02 -0.08 0.00 2.00 0.00 0.00 58.73 60.71 3k8p h TYR 257 Cb 0.49 -0.29 -0.01 0.00 1.00 0.00 0.00 36.73 37.92 3k8p h TYR 257 CO -0.24 0.51 -1.16 0.66 -0.00 0.00 0.00 178.16 177.93 3k8p h SER 258 N 0.90 0.00 -0.28 3.88 4.64 -1.38 -1.94 113.55 119.37 3k8p h SER 258 Ca 0.29 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 61.43 3k8p h SER 258 Cb 0.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.13 3k8p h SER 258 CO -0.08 0.27 -0.54 -0.07 -0.87 0.00 0.00 176.83 175.54 3k8p h LEU 259 N 0.00 0.97 -0.38 5.97 3.38 -0.66 -1.89 115.31 122.71 3k8p h LEU 259 Ca -0.07 -0.52 0.01 0.00 0.09 0.00 0.00 57.88 57.39 3k8p h LEU 259 Cb 1.27 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.72 3k8p h LEU 259 CO 0.02 1.32 0.23 -0.08 0.09 0.00 0.00 178.44 180.02 3k8p h GLU 260 N 0.67 0.45 -0.67 1.13 4.81 -0.61 -2.58 114.58 117.78 3k8p h GLU 260 Ca 0.02 -0.03 0.08 0.00 -0.13 0.00 0.00 59.36 59.30 3k8p h GLU 260 Cb 1.15 -0.10 -0.06 0.00 0.63 0.00 0.00 28.75 30.36 3k8p h GLU 260 CO 0.12 0.30 0.34 -0.22 -0.73 0.00 0.00 179.01 178.82 3k8p h LYS 261 N 0.47 0.58 -0.93 1.92 3.64 -1.30 -2.67 116.57 118.28 3k8p h LYS 261 Ca 0.15 -0.03 -0.19 0.00 -1.27 0.00 0.00 60.65 59.31 3k8p h LYS 261 Cb -0.01 -0.13 -0.11 0.00 -0.41 0.00 0.00 32.23 31.57 3k8p h LYS 261 CO -0.06 0.38 0.24 0.41 -2.27 0.00 0.00 179.45 178.15 3k8p n GLY 262 N -1.29 2.99 2.95 5.01 0.00 -0.72 -4.80 105.19 109.33 3k8p n GLY 262 Ca 0.10 -0.55 -0.14 0.00 0.00 0.00 0.00 46.02 45.43 3k8p n GLY 262 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3k8p s VAL 263 N -1.80 -0.44 -0.46 1.61 1.01 -1.01 -5.00 120.40 114.30 3k8p s VAL 263 Ca 0.30 0.12 0.07 0.00 0.00 0.00 0.00 61.98 62.46 3k8p s VAL 263 Cb 0.24 -0.57 0.26 0.00 0.00 0.00 0.00 36.38 36.31 3k8p s VAL 263 CO 0.07 -0.00 0.86 0.29 0.00 0.00 0.00 175.10 176.31 3k8p n LYS 264 N 5.35 0.82 0.00 2.72 5.02 -1.26 -4.87 118.16 125.93 3k8p n LYS 264 Ca -0.06 -2.09 0.00 0.00 -2.02 0.00 0.00 58.31 54.14 3k8p n LYS 264 Cb 0.50 -1.36 0.00 0.00 -0.02 0.00 0.00 35.03 34.14 3k8p n LYS 264 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 3k8p n GLU 268 N 1.34 0.00 0.00 1.97 0.00 -1.26 -4.87 120.64 117.82 3k8p n GLU 268 Ca 0.11 0.00 0.11 0.00 0.00 0.00 0.00 57.16 57.39 3k8p n GLU 268 Cb 0.63 -0.23 0.12 0.00 0.00 0.00 0.00 31.44 31.96 3k8p n GLU 268 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 3k8p n ALA 269 N 0.06 3.96 -0.07 4.31 0.00 -1.26 -4.01 120.51 123.50 3k8p n ALA 269 Ca 0.00 -0.44 -0.12 0.00 0.00 0.00 0.00 53.44 52.88 3k8p n ALA 269 Cb 0.00 -1.00 -0.05 0.00 0.00 0.00 0.00 19.45 18.40 3k8p n ALA 269 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3k8p h SER 270 N 0.00 0.45 0.56 0.00 0.87 -1.90 -1.32 113.55 112.21 3k8p h SER 270 Ca 0.00 -0.40 -0.04 0.00 -1.23 0.00 0.00 61.79 60.11 3k8p h SER 270 Cb 0.51 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 62.34 3k8p h SER 270 CO 0.00 0.76 -0.21 0.03 -0.53 0.00 0.00 176.83 176.88 3k8p h ARG 271 N 0.15 0.00 -0.05 2.24 3.08 -1.99 -0.68 114.38 117.12 3k8p h ARG 271 Ca 0.05 0.00 -0.22 0.00 0.07 0.00 0.00 59.98 59.88 3k8p h ARG 271 Cb 0.58 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.64 3k8p h ARG 271 CO 0.03 0.21 -0.87 -0.22 -1.07 0.00 0.00 179.97 178.05 3k8p h LYS 272 N 0.00 0.54 -0.10 0.04 3.11 -1.66 0.23 116.57 118.73 3k8p h LYS 272 Ca -0.00 -0.51 -0.01 0.00 -2.81 0.00 0.00 60.65 57.32 3k8p h LYS 272 Cb 0.55 0.13 -0.00 0.00 -1.00 0.00 0.00 32.23 31.90 3k8p h LYS 272 CO 0.03 1.14 0.03 1.25 -2.81 0.00 0.00 179.45 179.09 3k8p h LEU 273 N 0.33 0.15 -0.45 5.20 5.85 -0.72 -1.42 115.31 124.25 3k8p h LEU 273 Ca -0.07 -0.20 -0.15 0.00 0.84 0.00 0.00 57.88 58.30 3k8p h LEU 273 Cb 1.50 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 42.48 3k8p h LEU 273 CO 0.16 0.30 -0.34 1.56 -0.34 0.00 0.00 178.44 179.78 3k8p h GLN 274 N -0.02 0.92 -0.55 1.25 4.20 -1.13 -0.51 115.11 119.26 3k8p h GLN 274 Ca 0.03 -0.45 0.01 0.00 0.06 0.00 0.00 58.65 58.30 3k8p h GLN 274 Cb 0.21 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.96 3k8p h GLN 274 CO -0.00 1.11 0.37 1.03 -0.67 0.00 0.00 178.83 180.66 3k8p h SER 275 N 0.76 0.63 0.98 1.46 0.87 -0.50 -1.99 113.55 115.75 3k8p h SER 275 Ca 0.07 -0.02 -0.21 0.00 -1.23 0.00 0.00 61.79 60.40 3k8p h SER 275 Cb 0.92 -0.16 -0.03 0.00 -0.44 0.00 0.00 62.40 62.70 3k8p h SER 275 CO 0.09 0.45 -1.03 0.78 -0.53 0.00 0.00 176.83 176.59 3k8p h ASN 276 N 0.74 0.01 0.13 6.23 4.21 -0.80 -0.25 115.58 125.85 3k8p h ASN 276 Ca 0.20 -0.01 -0.01 0.00 1.21 0.00 0.00 56.30 57.70 3k8p h ASN 276 Cb -0.07 -0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.13 3k8p h ASN 276 CO -0.05 1.00 -0.06 0.58 -1.29 0.00 0.00 177.43 177.62 3k8p h VAL 277 N 0.00 0.90 -0.36 2.81 2.07 -0.81 0.19 116.25 121.05 3k8p h VAL 277 Ca -0.02 -0.11 -0.01 0.00 0.82 0.00 0.00 66.70 67.38 3k8p h VAL 277 Cb 1.78 0.98 -0.02 0.00 -1.52 0.00 0.00 31.29 32.51 3k8p h VAL 277 CO 0.13 0.03 0.19 0.58 0.02 0.00 0.00 177.57 178.51 3k8p h VAL 278 N -0.22 1.12 -0.08 2.57 2.07 -1.36 -1.13 116.25 119.22 3k8p h VAL 278 Ca -0.02 -0.33 -0.04 0.00 0.82 0.00 0.00 66.70 67.14 3k8p h VAL 278 Cb 0.18 0.65 -0.00 0.00 -1.52 0.00 0.00 31.29 30.59 3k8p h VAL 278 CO 0.03 0.14 -0.09 -0.78 0.02 0.00 0.00 177.57 176.88 3k8p h ASP 279 N 0.50 0.23 -0.16 0.57 3.58 -0.75 -1.57 116.42 118.81 3k8p h ASP 279 Ca 0.13 -0.49 0.04 0.00 0.42 0.00 0.00 57.03 57.13 3k8p h ASP 279 Cb 0.04 -0.06 -0.04 0.00 1.72 0.00 0.00 39.33 40.98 3k8p h ASP 279 CO -0.02 0.68 -0.11 0.40 -2.88 0.00 0.00 179.24 177.31 3k8p h ILE 280 N -0.22 0.68 -0.66 2.25 2.04 -0.35 -2.42 117.51 118.83 3k8p h ILE 280 Ca 0.01 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.84 3k8p h ILE 280 Cb 0.61 0.68 -0.03 0.00 -0.74 0.00 0.00 36.82 37.35 3k8p h ILE 280 CO 0.02 0.00 0.30 -0.07 0.00 0.00 0.00 178.15 178.40 3k8p h LEU 281 N -0.11 0.86 -0.89 1.44 3.38 -1.25 -1.70 115.31 117.05 3k8p h LEU 281 Ca 0.10 -0.10 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 3k8p h LEU 281 Cb 0.25 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 3k8p h LEU 281 CO -0.23 0.74 -0.11 0.15 0.09 0.00 0.00 178.44 179.08 3k8p h PHE 282 N 0.94 0.76 0.00 1.13 3.57 -0.81 -1.15 116.94 121.39 3k8p h PHE 282 Ca 0.23 -0.13 -0.20 0.00 3.53 0.00 0.00 57.97 61.40 3k8p h PHE 282 Cb 0.13 -0.20 -0.03 0.00 2.79 0.00 0.00 35.95 38.63 3k8p h PHE 282 CO 0.01 0.78 -1.60 0.72 -2.23 0.00 0.00 178.31 175.99 3k8p n HIS 283 N -4.17 0.81 -0.44 0.41 8.25 -1.02 -3.43 115.22 115.63 3k8p n HIS 283 Ca 0.01 0.27 0.06 0.00 -0.26 0.00 0.00 57.72 57.80 3k8p n HIS 283 Cb 0.35 -1.05 0.16 0.00 1.12 0.00 0.00 29.99 30.57 3k8p n HIS 283 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 3k8p n ASN 284 N -2.85 2.99 -0.33 0.41 3.02 -0.65 -4.60 115.26 113.25 3k8p n ASN 284 Ca -0.13 -2.36 0.20 0.00 -0.03 0.00 0.00 54.58 52.26 3k8p n ASN 284 Cb 0.89 -0.29 0.45 0.00 -0.61 0.00 0.00 39.78 40.22 3k8p n ASN 284 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 3k8p h SER 285 N 1.48 0.55 -0.21 6.41 4.64 -1.41 -1.27 113.55 123.73 3k8p h SER 285 Ca 0.00 0.10 -0.01 0.00 -0.47 0.00 0.00 61.79 61.40 3k8p h SER 285 Cb 0.91 0.01 -0.01 0.00 -0.31 0.00 0.00 62.40 63.00 3k8p h SER 285 CO 0.06 0.12 0.08 -0.08 -0.87 0.00 0.00 176.83 176.14 3k8p h GLU 286 N 0.49 0.32 -0.90 4.77 4.81 -1.87 0.15 114.58 122.35 3k8p h GLU 286 Ca 0.60 -0.06 0.04 0.00 -0.13 0.00 0.00 59.36 59.82 3k8p h GLU 286 Cb 1.35 -0.05 -0.05 0.00 0.63 0.00 0.00 28.75 30.62 3k8p h GLU 286 CO -0.35 0.38 0.59 -0.91 -0.73 0.00 0.00 179.01 177.99 3k8p h ASN 287 N 0.18 0.95 -0.37 1.04 2.35 -1.65 -2.89 115.58 115.19 3k8p h ASN 287 Ca 0.07 -0.01 -0.07 0.00 -0.55 0.00 0.00 56.30 55.74 3k8p h ASN 287 Cb 0.18 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.33 3k8p h ASN 287 CO -0.01 0.64 -0.05 0.25 -1.65 0.00 0.00 177.43 176.62 3k8p h LEU 288 N 1.10 0.69 -2.50 1.61 5.85 -0.78 -2.74 115.31 118.52 3k8p h LEU 288 Ca 0.37 -0.34 -0.00 0.00 0.84 0.00 0.00 57.88 58.75 3k8p h LEU 288 Cb 0.07 -0.19 -0.00 0.00 0.37 0.00 0.00 40.66 40.92 3k8p h LEU 288 CO -0.12 0.86 -0.00 -0.26 -0.34 0.00 0.00 178.44 178.58 3k8p h PHE 289 N 0.50 0.00 -0.01 1.25 0.04 -0.53 0.24 116.94 118.42 3k8p h PHE 289 Ca 0.10 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.87 3k8p h PHE 289 Cb 0.54 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.69 3k8p h PHE 289 CO 0.04 0.00 -0.15 0.09 -0.60 0.00 0.00 178.31 177.70 3k8p n ASN 290 N -3.09 0.84 -4.87 2.17 3.02 -1.04 -4.94 115.26 107.35 3k8p n ASN 290 Ca -0.02 -0.87 -0.29 0.00 -0.03 0.00 0.00 54.58 53.37 3k8p n ASN 290 Cb 0.15 0.03 0.09 0.00 -0.61 0.00 0.00 39.78 39.44 3k8p n ASN 290 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3k8p s LEU 291 N -2.39 2.46 0.29 3.41 1.43 0.07 -5.05 118.68 118.91 3k8p s LEU 291 Ca 0.29 0.89 -0.09 0.00 -1.03 0.00 0.00 54.13 54.20 3k8p s LEU 291 Cb 0.20 -3.40 -0.07 0.00 0.03 0.00 0.00 46.19 42.95 3k8p s LEU 291 CO 0.47 -1.96 0.62 -0.94 0.23 0.00 0.00 176.35 174.77 3k8p s SER 292 N -4.40 6.58 -1.48 2.29 1.04 -1.26 -3.94 113.70 112.52 3k8p s SER 292 Ca 0.62 0.96 -0.06 0.00 0.48 0.00 0.00 55.95 57.95 3k8p s SER 292 Cb -0.12 -2.24 0.01 0.00 0.10 0.00 0.00 66.02 63.76 3k8p s SER 292 CO 0.51 -0.19 0.78 -1.20 0.98 0.00 0.00 173.24 174.11 3k8p n SER 293 N -0.63 -6.18 -0.40 7.02 7.64 -1.26 -4.81 113.62 115.01 3k8p n SER 293 Ca 0.01 -0.36 -0.06 0.00 1.01 0.00 0.00 58.87 59.46 3k8p n SER 293 Cb 0.53 -4.93 -0.03 0.00 -1.01 0.00 0.00 64.21 58.77 3k8p n SER 293 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 3k8p h LEU 294 N -1.78 -1.81 -0.72 -3.43 5.85 -1.91 0.21 115.31 111.71 3k8p h LEU 294 Ca -0.54 0.32 0.11 0.00 0.84 0.00 0.00 57.88 58.62 3k8p h LEU 294 Cb 1.36 0.86 -0.08 0.00 0.37 0.00 0.00 40.66 43.17 3k8p h LEU 294 CO 0.56 -0.26 0.33 0.00 -0.34 0.00 0.00 178.44 178.72 3k8p h THR 295 N -0.01 0.77 -0.40 1.05 1.03 -1.93 0.71 112.91 114.12 3k8p h THR 295 Ca 0.25 -0.18 -0.06 0.00 -0.01 0.00 0.00 66.41 66.41 3k8p h THR 295 Cb 0.50 0.19 -0.01 0.00 -1.07 0.00 0.00 68.15 67.76 3k8p h THR 295 CO -0.96 0.10 0.02 -0.74 -0.01 0.00 0.00 175.52 173.92 3k8p h HIS 296 N 0.53 0.76 -0.69 0.00 -0.00 -1.36 -2.38 115.15 112.01 3k8p h HIS 296 Ca 0.37 -0.13 -0.02 0.00 -0.00 0.00 0.00 60.37 60.59 3k8p h HIS 296 Cb 0.47 -0.20 -0.03 0.00 -0.00 0.00 0.00 27.41 27.65 3k8p h HIS 296 CO -0.13 0.77 0.34 0.87 -0.00 0.00 0.00 177.93 179.77 3k8p h LYS 297 N 0.53 0.97 -0.34 5.26 1.57 0.24 -0.50 116.57 124.30 3k8p h LYS 297 Ca 0.12 -0.12 -0.10 0.00 -1.87 0.00 0.00 60.65 58.68 3k8p h LYS 297 Cb 0.45 -0.19 -0.02 0.00 0.08 0.00 0.00 32.23 32.56 3k8p h LYS 297 CO 0.02 0.74 -0.19 -0.07 -0.57 0.00 0.00 179.45 179.38 3k8p h LEU 298 N 0.97 0.63 -0.45 2.94 3.38 0.44 -0.17 115.31 123.06 3k8p h LEU 298 Ca 0.24 -0.20 -0.09 0.00 0.09 0.00 0.00 57.88 57.92 3k8p h LEU 298 Cb 0.08 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 3k8p h LEU 298 CO -0.03 0.82 -0.06 0.44 0.09 0.00 0.00 178.44 179.70 3k8p h ASP 299 N 0.57 0.83 0.21 -0.43 3.32 -1.02 -0.49 116.42 119.40 3k8p h ASP 299 Ca 0.09 -0.34 -0.01 0.00 0.02 0.00 0.00 57.03 56.79 3k8p h ASP 299 Cb 0.64 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 39.96 3k8p h ASP 299 CO 0.04 0.97 -0.10 -0.08 -1.72 0.00 0.00 179.24 178.36 3k8p h GLU 300 N 0.67 -0.27 -0.61 3.56 4.81 -0.61 -0.04 114.58 122.09 3k8p h GLU 300 Ca 0.12 0.02 0.06 0.00 -0.13 0.00 0.00 59.36 59.42 3k8p h GLU 300 Cb 0.59 0.06 -0.05 0.00 0.63 0.00 0.00 28.75 29.98 3k8p h GLU 300 CO 0.04 -0.18 0.32 -0.07 -0.73 0.00 0.00 179.01 178.39 3k8p h LEU 301 N -0.29 0.45 -0.95 1.64 3.38 -1.02 -2.32 115.31 116.20 3k8p h LEU 301 Ca -0.03 0.03 0.01 0.00 0.09 0.00 0.00 57.88 57.98 3k8p h LEU 301 Cb 0.22 -0.05 -0.05 0.00 0.09 0.00 0.00 40.66 40.87 3k8p h LEU 301 CO 0.05 0.30 0.62 -0.25 0.09 0.00 0.00 178.44 179.25 3k8p h TRP 302 N 0.59 1.20 -0.95 1.13 2.91 -0.73 0.15 115.95 120.25 3k8p h TRP 302 Ca 0.27 0.02 0.17 0.00 1.13 0.00 0.00 58.89 60.49 3k8p h TRP 302 Cb 0.19 -0.41 -0.17 0.00 -0.51 0.00 0.00 29.16 28.26 3k8p h TRP 302 CO -0.10 0.76 -0.32 1.03 -1.03 0.00 0.00 178.44 178.79 3k8p h SER 303 N 1.29 -1.17 0.20 2.65 0.87 -0.44 -0.28 113.55 116.67 3k8p h SER 303 Ca 0.35 0.30 -0.01 0.00 -1.23 0.00 0.00 61.79 61.19 3k8p h SER 303 Cb -0.14 0.67 0.00 0.00 -0.44 0.00 0.00 62.40 62.49 3k8p h SER 303 CO -0.07 -0.30 -0.10 0.40 -0.53 0.00 0.00 176.83 176.23 3k8p h ILE 304 N -0.01 0.00 -1.32 2.23 2.04 -1.11 -3.33 117.51 116.00 3k8p h ILE 304 Ca 0.39 -0.41 0.41 0.00 1.00 0.00 0.00 64.86 66.26 3k8p h ILE 304 Cb 0.64 0.00 -0.11 0.00 -0.74 0.00 0.00 36.82 36.61 3k8p h ILE 304 CO -0.97 0.00 0.87 -0.07 0.00 0.00 0.00 178.15 177.98 3k8p h LEU 305 N -0.68 0.24 -1.07 1.44 3.38 -0.67 0.13 115.31 118.08 3k8p h LEU 305 Ca -0.03 0.11 0.00 0.00 0.09 0.00 0.00 57.88 58.05 3k8p h LEU 305 Cb 0.21 0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.04 3k8p h LEU 305 CO 0.05 -0.11 0.00 0.77 0.09 0.00 0.00 178.44 179.24 3k8p h SER 306 N 0.12 0.00 0.82 -0.43 4.64 -1.16 -1.24 113.55 116.31 3k8p h SER 306 Ca 0.77 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 62.09 3k8p h SER 306 Cb 2.48 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.57 3k8p h SER 306 CO -0.33 0.00 -0.81 1.23 -0.87 0.00 0.00 176.83 176.04 3k8p h GLY 307 N 1.70 0.00 -1.28 -0.77 0.00 -1.14 -3.49 103.07 98.10 3k8p h GLY 307 Ca 0.00 0.00 -0.52 0.00 0.00 0.00 0.00 47.33 46.81 3k8p h GLY 307 CO 0.00 0.00 0.24 -1.36 0.00 0.00 0.00 176.54 175.42 3k8p s PHE 308 N -3.23 1.79 1.03 5.60 0.40 -0.47 -5.00 117.98 118.11 3k8p s PHE 308 Ca 0.04 1.74 -0.12 0.00 -0.60 0.00 0.00 56.93 57.99 3k8p s PHE 308 Cb 0.12 -3.29 0.21 0.00 0.51 0.00 0.00 43.02 40.58 3k8p s PHE 308 CO 0.76 -2.64 1.07 -2.14 0.70 0.00 0.00 175.22 172.97 3k8p s PRO 309 N -4.70 0.14 0.55 0.24 0.02 -1.26 -4.89 135.00 125.10 3k8p s PRO 309 Ca 0.66 0.84 0.36 0.00 0.02 0.00 0.00 61.00 62.88 3k8p s PRO 309 Cb -0.22 -1.68 1.51 0.00 0.02 0.00 0.00 34.50 34.14 3k8p s PRO 309 CO 0.58 -3.01 1.77 -0.44 -0.33 0.00 0.00 177.00 175.56 3k8p h ASP 310 N -2.11 0.00 -3.96 2.53 5.19 -1.97 -3.41 116.42 112.70 3k8p h ASP 310 Ca -0.55 0.00 -0.12 0.00 -0.62 0.00 0.00 57.03 55.74 3k8p h ASP 310 Cb 1.31 0.00 -0.24 0.00 0.18 0.00 0.00 39.33 40.59 3k8p h ASP 310 CO 0.52 0.00 -0.22 -1.83 -3.12 0.00 0.00 179.24 174.59 3k8p s GLU 311 N -4.86 0.51 0.04 3.56 -1.05 -1.26 -1.09 118.70 114.54 3k8p s GLU 311 Ca -0.05 0.54 0.04 0.00 -0.15 0.00 0.00 54.97 55.35 3k8p s GLU 311 Cb 0.22 0.25 -0.02 0.00 -0.44 0.00 0.00 34.13 34.13 3k8p s GLU 311 CO 0.76 -0.07 -0.12 0.42 0.95 0.00 0.00 175.26 177.20 3k8p s ILE 312 N 0.12 0.89 -0.02 1.83 -1.09 -0.59 -5.02 121.20 117.32 3k8p s ILE 312 Ca -0.01 -0.97 0.05 0.00 -2.23 0.00 0.00 60.65 57.49 3k8p s ILE 312 Cb -0.03 -0.84 -0.01 0.00 -1.58 0.00 0.00 42.46 40.00 3k8p s ILE 312 CO 0.01 -0.11 -0.17 -0.89 -1.23 0.00 0.00 174.94 172.55 3k8p s THR 313 N -0.95 1.37 0.32 2.92 2.01 -1.26 -1.77 115.64 118.28 3k8p s THR 313 Ca -0.02 -0.73 0.03 0.00 0.31 0.00 0.00 61.69 61.28 3k8p s THR 313 Cb -0.08 -1.14 -0.05 0.00 0.01 0.00 0.00 72.50 71.24 3k8p s THR 313 CO 0.01 0.39 0.11 0.27 -0.69 0.00 0.00 174.62 174.71 3k8p s ILE 314 N -0.35 0.69 0.00 1.82 -4.36 -0.69 -4.76 121.20 113.55 3k8p s ILE 314 Ca 0.05 -2.00 0.00 0.00 -0.26 0.00 0.00 60.65 58.44 3k8p s ILE 314 Cb -0.07 -2.58 0.00 0.00 1.25 0.00 0.00 42.46 41.05 3k8p s ILE 314 CO -0.00 0.00 0.00 1.21 0.24 0.00 0.00 174.94 176.39 3k8p n GLU 315 N -0.66 0.00 0.00 0.37 2.13 -1.26 -3.29 120.64 117.93 3k8p n GLU 315 Ca -0.02 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.80 3k8p n GLU 315 Cb 0.66 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.37 3k8p n GLU 315 CO 0.00 0.00 0.00 -0.85 -0.41 0.00 0.00 177.13 175.87 3k8p n GLU 316 N 14.00 0.00 -2.23 5.31 0.28 -1.26 -4.72 120.64 132.01 3k8p n GLU 316 Ca 0.00 0.01 -0.02 0.00 -0.16 0.00 0.00 57.16 56.99 3k8p n GLU 316 Cb 0.00 -0.66 0.05 0.00 1.43 0.00 0.00 31.44 32.26 3k8p n GLU 316 CO 0.00 0.00 0.00 1.04 -0.16 0.00 0.00 177.13 178.01 3k8p n GLN 317 N -0.17 1.02 -2.60 3.44 6.02 -1.25 -5.10 117.38 118.74 3k8p n GLN 317 Ca 0.00 -1.92 -0.43 0.00 -0.01 0.00 0.00 57.00 54.64 3k8p n GLN 317 Cb 0.00 -0.19 -0.02 0.00 1.02 0.00 0.00 30.24 31.05 3k8p n GLN 317 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 3k8p s LYS 318 N -1.02 4.29 -0.11 -1.09 1.02 -1.21 -4.96 119.74 116.67 3k8p s LYS 318 Ca 0.16 1.46 0.02 0.00 0.02 0.00 0.00 55.97 57.62 3k8p s LYS 318 Cb 0.32 -3.64 0.01 0.00 -0.52 0.00 0.00 37.83 34.00 3k8p s LYS 318 CO -0.09 -0.57 -0.16 0.99 -0.92 0.00 0.00 175.35 174.60 3k8p s THR 319 N 2.95 1.56 -0.08 2.17 2.01 -1.26 -1.70 115.64 121.29 3k8p s THR 319 Ca 0.48 -0.68 0.04 0.00 0.31 0.00 0.00 61.69 61.84 3k8p s THR 319 Cb -0.18 -1.41 -0.01 0.00 0.01 0.00 0.00 72.50 70.91 3k8p s THR 319 CO 0.11 0.45 -0.20 -0.63 -0.69 0.00 0.00 174.62 173.67 3k8p s ILE 320 N 0.92 2.48 0.56 1.82 1.01 -0.73 -4.99 121.20 122.26 3k8p s ILE 320 Ca -0.08 -0.90 -0.01 0.00 0.00 0.00 0.00 60.65 59.66 3k8p s ILE 320 Cb -0.15 -1.96 0.03 0.00 0.01 0.00 0.00 42.46 40.39 3k8p s ILE 320 CO -0.01 0.56 0.80 0.42 0.00 0.00 0.00 174.94 176.72 3k8p s THR 321 N -0.06 2.97 0.24 2.92 -4.23 -1.26 -1.55 115.64 114.67 3k8p s THR 321 Ca -0.05 -0.51 -0.04 0.00 -1.18 0.00 0.00 61.69 59.91 3k8p s THR 321 Cb -0.14 -3.14 0.11 0.00 1.34 0.00 0.00 72.50 70.67 3k8p s THR 321 CO 0.04 -0.11 1.74 0.00 -0.54 0.00 0.00 174.62 175.75 3k8p h ALA 322 N 0.01 1.04 -0.56 3.99 0.00 -1.33 -2.72 119.26 119.69 3k8p h ALA 322 Ca -0.44 -0.26 -0.11 0.00 0.00 0.00 0.00 54.91 54.10 3k8p h ALA 322 Cb 1.29 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.84 3k8p h ALA 322 CO 0.55 0.61 -0.07 1.25 0.00 0.00 0.00 179.25 181.59 3k8p h LEU 323 N 0.86 1.02 -1.47 0.00 5.85 -1.95 -0.00 115.31 119.62 3k8p h LEU 323 Ca 0.17 -0.32 0.00 0.00 0.84 0.00 0.00 57.88 58.57 3k8p h LEU 323 Cb 0.44 -0.28 0.00 0.00 0.37 0.00 0.00 40.66 41.19 3k8p h LEU 323 CO 0.02 1.11 0.00 -0.62 -0.34 0.00 0.00 178.44 178.60 3k8p n GLU 324 N -4.16 0.31 0.00 1.25 1.02 -1.03 -2.30 120.64 115.74 3k8p n GLU 324 Ca 0.02 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.16 3k8p n GLU 324 Cb 0.38 -1.24 0.00 0.00 -0.02 0.00 0.00 31.44 30.56 3k8p n GLU 324 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 3k8p n LYS 326 N 0.58 0.00 -0.13 3.49 4.81 -0.02 -0.36 118.16 126.53 3k8p n LYS 326 Ca 0.00 0.00 -0.13 0.00 -0.87 0.00 0.00 58.31 57.31 3k8p n LYS 326 Cb 0.11 0.00 -0.02 0.00 0.02 0.00 0.00 35.03 35.15 3k8p n LYS 326 CO 0.00 0.00 0.00 1.96 1.17 0.00 0.00 177.40 180.53 3k8p h GLN 327 N 0.00 0.95 0.00 1.64 4.20 -1.73 0.13 115.11 120.30 3k8p h GLN 327 Ca 0.00 -0.48 0.00 0.00 0.06 0.00 0.00 58.65 58.23 3k8p h GLN 327 Cb 0.00 0.01 0.00 0.00 0.30 0.00 0.00 27.48 27.79 3k8p h GLN 327 CO 0.00 1.14 0.00 1.19 -0.67 0.00 0.00 178.83 180.49 3k8p n PHE 328 N -4.08 0.00 0.00 2.96 3.01 0.51 -0.06 117.46 119.80 3k8p n PHE 328 Ca -0.02 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.44 3k8p n PHE 328 Cb 0.53 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.00 3k8p n PHE 328 CO 0.00 0.00 0.00 -1.91 1.01 0.00 0.00 176.76 175.86 3k8p n GLU 330 N -0.20 0.00 0.10 -1.08 2.13 0.44 -1.25 120.64 120.78 3k8p n GLU 330 Ca 0.00 0.00 -0.13 0.00 0.66 0.00 0.00 57.16 57.69 3k8p n GLU 330 Cb 0.00 0.00 -0.08 0.00 0.27 0.00 0.00 31.44 31.63 3k8p n GLU 330 CO 0.00 0.00 0.00 0.35 -0.41 0.00 0.00 177.13 177.07 3k8p h PHE 331 N 0.00 -0.18 -0.64 4.31 3.57 -0.71 0.51 116.94 123.80 3k8p h PHE 331 Ca 0.00 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.48 3k8p h PHE 331 Cb 0.00 0.06 -0.03 0.00 2.79 0.00 0.00 35.95 38.77 3k8p h PHE 331 CO 0.00 -0.04 0.33 0.74 -2.23 0.00 0.00 178.31 177.10 3k8p h PHE 332 N -0.27 0.88 0.19 0.41 0.04 -1.28 0.21 116.94 117.12 3k8p h PHE 332 Ca -0.02 -0.02 -0.31 0.00 2.80 0.00 0.00 57.97 60.42 3k8p h PHE 332 Cb 0.21 -0.28 0.02 0.00 2.20 0.00 0.00 35.95 38.10 3k8p h PHE 332 CO -0.04 0.63 -1.45 0.82 -0.60 0.00 0.00 178.31 177.66 3k8p h ILE 333 N 0.90 1.16 0.05 -0.55 2.04 -1.78 -3.40 117.51 115.94 3k8p h ILE 333 Ca 0.23 -2.56 -0.35 0.00 1.00 0.00 0.00 64.86 63.18 3k8p h ILE 333 Cb 0.06 2.92 -0.04 0.00 -0.74 0.00 0.00 36.82 39.02 3k8p h ILE 333 CO -0.03 0.79 -2.03 0.29 0.00 0.00 0.00 178.15 177.17 3k8p n LYS 334 N -3.78 0.69 -0.01 2.37 5.02 0.18 -4.90 118.16 117.73 3k8p n LYS 334 Ca -0.21 0.22 -0.02 0.00 -2.02 0.00 0.00 58.31 56.28 3k8p n LYS 334 Cb 1.01 -1.68 -0.01 0.00 -0.02 0.00 0.00 35.03 34.33 3k8p n LYS 334 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3k8p s SER 336 N -5.37 -0.64 -0.24 0.00 0.15 0.03 -5.00 113.70 102.63 3k8p s SER 336 Ca -0.08 1.17 0.14 0.00 0.70 0.00 0.00 55.95 57.88 3k8p s SER 336 Cb 0.01 1.18 0.68 0.00 -1.71 0.00 0.00 66.02 66.18 3k8p s SER 336 CO 0.12 -0.27 1.63 0.35 1.20 0.00 0.00 173.24 176.26 3k8p n THR 337 N 2.49 2.62 -0.22 6.45 -2.24 -1.26 -3.84 114.28 118.27 3k8p n THR 337 Ca -0.15 -1.71 -0.02 0.00 -2.27 0.00 0.00 64.05 59.91 3k8p n THR 337 Cb 0.56 -0.29 0.09 0.00 -2.10 0.00 0.00 70.33 68.59 3k8p n THR 337 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 3k8p h LYS 338 N 2.75 0.64 -5.58 -0.78 3.64 -1.97 -3.40 116.57 111.87 3k8p h LYS 338 Ca 0.06 -0.04 -0.65 0.00 -1.27 0.00 0.00 60.65 58.76 3k8p h LYS 338 Cb 1.84 -0.15 -0.13 0.00 -0.41 0.00 0.00 32.23 33.39 3k8p h LYS 338 CO 0.44 0.43 -0.55 -0.06 -2.27 0.00 0.00 179.45 177.43 3k8p s PHE 339 N -6.10 3.34 1.10 1.91 0.40 -1.26 -5.10 117.98 112.28 3k8p s PHE 339 Ca -0.13 0.26 -0.13 0.00 -0.60 0.00 0.00 56.93 56.34 3k8p s PHE 339 Cb 0.16 -1.96 0.25 0.00 0.51 0.00 0.00 43.02 41.98 3k8p s PHE 339 CO 0.76 0.43 1.05 -1.54 0.70 0.00 0.00 175.22 176.62 3k8p s SER 340 N -0.41 1.60 0.17 1.36 1.04 -1.26 -4.74 113.70 111.45 3k8p s SER 340 Ca 0.10 1.33 -0.15 0.00 0.48 0.00 0.00 55.95 57.70 3k8p s SER 340 Cb -0.12 -2.07 0.12 0.00 0.10 0.00 0.00 66.02 64.05 3k8p s SER 340 CO 0.02 -3.79 1.72 0.15 0.98 0.00 0.00 173.24 172.32 3k8p h PHE 341 N -2.34 0.11 -0.13 5.02 3.04 -1.87 -0.41 116.94 120.36 3k8p h PHE 341 Ca -0.59 0.03 0.02 0.00 3.98 0.00 0.00 57.97 61.40 3k8p h PHE 341 Cb 1.34 0.01 -0.02 0.00 2.56 0.00 0.00 35.95 39.84 3k8p h PHE 341 CO 0.26 -0.00 -0.00 -0.22 -2.02 0.00 0.00 178.31 176.33 3k8p h LYS 342 N 0.20 0.04 -0.69 1.11 3.64 -1.88 -1.10 116.57 117.88 3k8p h LYS 342 Ca 0.20 -0.00 0.01 0.00 -1.27 0.00 0.00 60.65 59.59 3k8p h LYS 342 Cb 0.25 -0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.02 3k8p h LYS 342 CO -0.27 0.03 0.45 0.93 -2.27 0.00 0.00 179.45 178.32 3k8p h GLU 343 N 0.04 0.88 -0.56 1.90 5.08 -1.86 -1.33 114.58 118.73 3k8p h GLU 343 Ca 0.06 -0.05 0.07 0.00 -1.00 0.00 0.00 59.36 58.43 3k8p h GLU 343 Cb 0.07 -0.20 -0.06 0.00 0.50 0.00 0.00 28.75 29.06 3k8p h GLU 343 CO -0.10 0.59 0.25 0.82 -1.00 0.00 0.00 179.01 179.57 3k8p h ILE 344 N 0.91 0.88 -0.77 3.13 1.08 -0.77 -0.60 117.51 121.37 3k8p h ILE 344 Ca 0.26 -0.16 -0.04 0.00 -0.39 0.00 0.00 64.86 64.53 3k8p h ILE 344 Cb -0.07 0.36 -0.03 0.00 -3.07 0.00 0.00 36.82 34.01 3k8p h ILE 344 CO -0.07 0.09 0.34 0.15 -0.69 0.00 0.00 178.15 177.96 3k8p h PHE 345 N 0.48 1.14 -0.64 1.37 3.57 -0.75 -2.18 116.94 119.93 3k8p h PHE 345 Ca 0.27 -0.07 -0.05 0.00 3.53 0.00 0.00 57.97 61.65 3k8p h PHE 345 Cb 0.24 -0.35 -0.03 0.00 2.79 0.00 0.00 35.95 38.61 3k8p h PHE 345 CO -0.13 0.85 0.22 0.00 -2.23 0.00 0.00 178.31 177.02 3k8p h ALA 346 N 1.17 1.18 -0.59 2.41 0.00 -0.51 -2.00 119.26 120.91 3k8p h ALA 346 Ca 0.26 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 3k8p h ALA 346 Cb 0.17 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 3k8p h ALA 346 CO -0.03 0.58 0.36 0.82 0.00 0.00 0.00 179.25 180.98 3k8p h ILE 347 N 0.94 1.17 -0.73 0.00 2.04 -0.81 -1.55 117.51 118.57 3k8p h ILE 347 Ca 0.21 -0.37 0.15 0.00 1.00 0.00 0.00 64.86 65.85 3k8p h ILE 347 Cb 0.24 0.33 -0.05 0.00 -0.74 0.00 0.00 36.82 36.60 3k8p h ILE 347 CO -0.01 0.17 0.49 0.74 0.00 0.00 0.00 178.15 179.54 3k8p h THR 348 N 0.82 0.80 -0.21 -0.27 2.02 -0.73 -2.84 112.91 112.49 3k8p h THR 348 Ca 0.21 -0.13 0.00 0.00 0.77 0.00 0.00 66.41 67.26 3k8p h THR 348 Cb -0.03 0.38 0.00 0.00 -1.74 0.00 0.00 68.15 66.76 3k8p h THR 348 CO -0.04 0.07 0.00 0.00 0.37 0.00 0.00 175.52 175.92 3k8p n GLN 349 N -4.47 2.70 -2.34 6.66 6.02 -0.65 -4.74 117.38 120.56 3k8p n GLN 349 Ca 0.14 -2.24 -0.28 0.00 -0.01 0.00 0.00 57.00 54.61 3k8p n GLN 349 Cb 0.53 -1.41 0.03 0.00 1.02 0.00 0.00 30.24 30.40 3k8p n GLN 349 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 3k8p s GLU 350 N -1.78 3.08 0.67 -1.09 2.02 -0.78 -5.08 118.70 115.74 3k8p s GLU 350 Ca 0.25 0.15 -0.14 0.00 0.02 0.00 0.00 54.97 55.25 3k8p s GLU 350 Cb 0.18 -2.24 0.01 0.00 0.10 0.00 0.00 34.13 32.17 3k8p s GLU 350 CO 0.09 -0.64 1.11 -2.00 0.02 0.00 0.00 175.26 173.84 3k8p s GLU 351 N -5.01 2.73 0.30 1.61 2.12 -1.26 -4.81 118.70 114.40 3k8p s GLU 351 Ca 0.53 1.37 0.04 0.00 0.36 0.00 0.00 54.97 57.27 3k8p s GLU 351 Cb -0.11 -1.94 0.79 0.00 0.26 0.00 0.00 34.13 33.13 3k8p s GLU 351 CO 0.47 -1.30 1.61 1.49 -0.54 0.00 0.00 175.26 176.99 3k8p h GLU 352 N -0.09 0.11 0.19 4.30 4.81 -1.98 -1.21 114.58 120.71 3k8p h GLU 352 Ca -0.46 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 58.75 3k8p h GLU 352 Cb 1.25 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.60 3k8p h GLU 352 CO 0.54 0.08 -0.09 1.03 -0.73 0.00 0.00 179.01 179.83 3k8p h SER 353 N 0.12 -0.21 -0.92 1.04 0.87 -1.93 -1.26 113.55 111.25 3k8p h SER 353 Ca 0.60 -0.11 0.06 0.00 -1.23 0.00 0.00 61.79 61.11 3k8p h SER 353 Cb 1.27 0.05 -0.06 0.00 -0.44 0.00 0.00 62.40 63.22 3k8p h SER 353 CO -0.75 -0.02 0.59 0.00 -0.53 0.00 0.00 176.83 176.11 3k8p h ALA 354 N 0.39 1.27 -0.39 6.23 0.00 -1.69 -2.13 119.26 122.93 3k8p h ALA 354 Ca -0.03 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 3k8p h ALA 354 Cb 0.31 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 3k8p h ALA 354 CO 0.04 0.36 0.21 1.96 0.00 0.00 0.00 179.25 181.83 3k8p h GLN 355 N 1.07 0.55 -0.65 0.00 4.20 -0.96 0.57 115.11 119.90 3k8p h GLN 355 Ca 0.40 -0.07 -0.01 0.00 0.06 0.00 0.00 58.65 59.02 3k8p h GLN 355 Cb 0.15 -0.11 -0.03 0.00 0.30 0.00 0.00 27.48 27.79 3k8p h GLN 355 CO -0.17 0.45 0.35 1.25 -0.67 0.00 0.00 178.83 180.05 3k8p h LEU 356 N 0.50 0.81 -0.05 1.46 5.85 -0.94 0.22 115.31 123.15 3k8p h LEU 356 Ca 0.14 -0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.76 3k8p h LEU 356 Cb 0.07 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 40.89 3k8p h LEU 356 CO -0.02 0.68 0.04 0.00 -0.34 0.00 0.00 178.44 178.79 3k8p h ALA 357 N 1.17 0.07 -0.05 1.25 0.00 -1.03 -0.44 119.26 120.23 3k8p h ALA 357 Ca 0.23 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.10 3k8p h ALA 357 Cb 0.05 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 3k8p h ALA 357 CO -0.04 -0.43 -0.07 0.45 0.00 0.00 0.00 179.25 179.16 3k8p h HIS 358 N 0.06 0.07 -0.20 0.00 3.86 -0.47 -1.00 115.15 117.47 3k8p h HIS 358 Ca 0.02 -0.00 -0.12 0.00 -1.16 0.00 0.00 60.37 59.10 3k8p h HIS 358 Cb 0.01 -0.02 0.00 0.00 1.06 0.00 0.00 27.41 28.46 3k8p h HIS 358 CO -0.07 0.15 -0.36 0.35 0.86 0.00 0.00 177.93 178.86 3k8p h PHE 359 N 0.07 0.74 -0.10 2.45 3.04 0.21 -2.27 116.94 121.09 3k8p h PHE 359 Ca 0.02 -0.26 -0.20 0.00 3.98 0.00 0.00 57.97 61.51 3k8p h PHE 359 Cb 0.18 -0.14 -0.00 0.00 2.56 0.00 0.00 35.95 38.55 3k8p h PHE 359 CO 0.00 1.00 -0.75 0.66 -2.02 0.00 0.00 178.31 177.21 3k8p h SER 360 N 0.27 0.62 -0.68 0.41 4.64 -0.78 -1.31 113.55 116.72 3k8p h SER 360 Ca 0.01 -0.41 0.14 0.00 -0.47 0.00 0.00 61.79 61.06 3k8p h SER 360 Cb 0.95 -0.18 -0.10 0.00 -0.31 0.00 0.00 62.40 62.76 3k8p h SER 360 CO 0.08 1.17 0.17 0.28 -0.87 0.00 0.00 176.83 177.65 3k8p h SER 361 N 0.36 0.03 -0.48 4.97 0.02 -1.21 0.36 113.55 117.60 3k8p h SER 361 Ca -0.04 0.13 -0.08 0.00 -0.84 0.00 0.00 61.79 60.96 3k8p h SER 361 Cb 1.34 0.17 -0.02 0.00 0.14 0.00 0.00 62.40 64.03 3k8p h SER 361 CO 0.14 -0.00 -0.02 0.25 -1.14 0.00 0.00 176.83 176.06 3k8p h LEU 362 N 0.29 0.85 -0.20 5.07 5.85 -0.87 -0.99 115.31 125.32 3k8p h LEU 362 Ca 0.37 -0.32 -0.02 0.00 0.84 0.00 0.00 57.88 58.75 3k8p h LEU 362 Cb 0.59 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.39 3k8p h LEU 362 CO -0.45 0.96 0.03 0.00 -0.34 0.00 0.00 178.44 178.64 3k8p h HIS 364 N 0.12 0.53 0.05 0.00 -0.00 -0.22 0.67 115.15 116.30 3k8p h HIS 364 Ca 0.06 -0.01 -0.00 0.00 -0.00 0.00 0.00 60.37 60.41 3k8p h HIS 364 Cb 0.31 -0.17 0.00 0.00 -0.00 0.00 0.00 27.41 27.55 3k8p h HIS 364 CO 0.02 0.42 -0.02 1.49 -0.00 0.00 0.00 177.93 179.84 3k8p h GLU 365 N 0.50 -0.06 -0.32 5.26 4.81 -1.16 -2.42 114.58 121.19 3k8p h GLU 365 Ca 0.14 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.34 3k8p h GLU 365 Cb 0.06 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.44 3k8p h GLU 365 CO -0.02 0.05 0.09 0.93 -0.73 0.00 0.00 179.01 179.33 3k8p h GLU 366 N -0.16 0.50 -0.88 1.92 4.39 -1.11 -2.25 114.58 117.00 3k8p h GLU 366 Ca -0.01 -0.12 0.20 0.00 0.34 0.00 0.00 59.36 59.77 3k8p h GLU 366 Cb 0.14 -0.07 -0.06 0.00 -0.10 0.00 0.00 28.75 28.66 3k8p h GLU 366 CO 0.01 0.56 0.58 0.74 -1.16 0.00 0.00 179.01 179.74 3k8p h PHE 367 N 0.35 0.51 -0.00 4.33 0.04 -0.85 -0.38 116.94 120.94 3k8p h PHE 367 Ca 0.10 0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.89 3k8p h PHE 367 Cb 0.28 -0.16 0.00 0.00 2.20 0.00 0.00 35.95 38.27 3k8p h PHE 367 CO 0.01 0.14 -0.13 0.09 -0.60 0.00 0.00 178.31 177.82 3k8p n ASN 368 N -4.49 0.59 -0.04 2.17 4.13 -0.87 -3.71 115.26 113.03 3k8p n ASN 368 Ca 0.18 -0.65 -0.02 0.00 1.68 0.00 0.00 54.58 55.77 3k8p n ASN 368 Cb 0.68 -0.04 -0.10 0.00 -1.54 0.00 0.00 39.78 38.79 3k8p n ASN 368 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 3k8p n LYS 369 N -0.88 1.49 -1.74 3.52 5.02 -0.30 -5.03 118.16 120.25 3k8p n LYS 369 Ca 0.14 -0.04 -0.42 0.00 -2.02 0.00 0.00 58.31 55.97 3k8p n LYS 369 Cb 0.29 -1.32 -0.01 0.00 -0.02 0.00 0.00 35.03 33.97 3k8p n LYS 369 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3k8p n ALA 370 N -2.30 2.12 0.17 7.82 0.00 -0.36 -4.88 120.51 123.08 3k8p n ALA 370 Ca -0.15 0.36 0.08 0.00 0.00 0.00 0.00 53.44 53.74 3k8p n ALA 370 Cb 0.73 -2.39 0.60 0.00 0.00 0.00 0.00 19.45 18.38 3k8p n ALA 370 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 3k8p h ASN 371 N 3.71 0.11 -2.29 0.00 4.21 -1.92 -3.42 115.58 115.98 3k8p h ASN 371 Ca -0.48 -0.00 0.02 0.00 1.21 0.00 0.00 56.30 57.05 3k8p h ASN 371 Cb 1.25 -0.03 -0.22 0.00 -1.12 0.00 0.00 38.32 38.20 3k8p h ASN 371 CO 0.71 0.07 -0.18 -0.70 -1.29 0.00 0.00 177.43 176.04 3k8p s GLU 372 N -5.16 0.52 0.42 0.81 2.56 -1.26 -5.05 118.70 111.54 3k8p s GLU 372 Ca -0.06 1.30 0.16 0.00 0.00 0.00 0.00 54.97 56.38 3k8p s GLU 372 Cb 0.17 0.63 1.05 0.00 2.00 0.00 0.00 34.13 37.98 3k8p s GLU 372 CO 0.69 -0.21 1.89 0.82 -0.56 0.00 0.00 175.26 177.89 3k8p h ILE 373 N 5.91 0.74 -0.47 -3.70 2.04 -1.86 0.17 117.51 120.34 3k8p h ILE 373 Ca -0.20 -0.15 0.09 0.00 1.00 0.00 0.00 64.86 65.60 3k8p h ILE 373 Cb 1.12 0.28 -0.03 0.00 -0.74 0.00 0.00 36.82 37.45 3k8p h ILE 373 CO 0.12 0.08 0.32 0.77 0.00 0.00 0.00 178.15 179.44 3k8p h SER 374 N 0.43 0.24 -0.01 1.72 4.64 -1.98 -1.02 113.55 117.56 3k8p h SER 374 Ca 0.42 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 61.58 3k8p h SER 374 Cb 0.99 -0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 63.03 3k8p h SER 374 CO -0.15 0.15 -0.55 0.77 -0.87 0.00 0.00 176.83 176.19 3k8p h SER 375 N 0.27 0.66 0.63 4.97 4.64 -1.39 -0.26 113.55 123.09 3k8p h SER 375 Ca 0.22 -0.35 -0.20 0.00 -0.47 0.00 0.00 61.79 60.99 3k8p h SER 375 Cb 0.50 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 62.39 3k8p h SER 375 CO -0.05 1.08 -0.88 0.15 -0.87 0.00 0.00 176.83 176.26 3k8p h PHE 376 N 0.46 0.24 -0.09 4.77 3.57 -1.45 -2.53 116.94 121.92 3k8p h PHE 376 Ca 0.01 -0.14 -0.00 0.00 3.53 0.00 0.00 57.97 61.37 3k8p h PHE 376 Cb 1.10 -0.03 -0.00 0.00 2.79 0.00 0.00 35.95 39.81 3k8p h PHE 376 CO 0.05 0.96 0.05 -0.07 -2.23 0.00 0.00 178.31 177.06 3k8p h LEU 377 N 0.09 0.11 -1.28 0.59 3.38 -1.05 -2.81 115.31 114.33 3k8p h LEU 377 Ca -0.04 -0.09 0.07 0.00 0.09 0.00 0.00 57.88 57.91 3k8p h LEU 377 Cb 1.51 -0.03 -0.05 0.00 0.09 0.00 0.00 40.66 42.18 3k8p h LEU 377 CO 0.13 0.17 0.53 -0.61 0.09 0.00 0.00 178.44 178.75 3k8p h GLN 378 N 0.04 0.82 -1.28 1.13 5.75 -1.01 0.10 115.11 120.67 3k8p h GLN 378 Ca 0.03 -0.05 0.00 0.00 -0.15 0.00 0.00 58.65 58.48 3k8p h GLN 378 Cb 0.09 -0.19 0.00 0.00 1.07 0.00 0.00 27.48 28.45 3k8p h GLN 378 CO -0.00 0.55 0.00 0.00 -2.65 0.00 0.00 178.83 176.72 3k8p n ALA 379 N -2.43 1.84 0.00 3.38 0.00 -0.96 -2.46 120.51 119.88 3k8p n ALA 379 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.56 3k8p n ALA 379 Cb 0.24 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.69 3k8p n ALA 379 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3k8p n TYR 381 N 0.66 0.00 0.17 0.00 4.01 0.35 -2.68 117.16 119.67 3k8p n TYR 381 Ca 0.00 0.00 0.07 0.00 -0.16 0.00 0.00 57.90 57.81 3k8p n TYR 381 Cb 0.18 0.00 0.09 0.00 -0.31 0.00 0.00 39.34 39.30 3k8p n TYR 381 CO 0.00 0.00 0.00 0.93 -0.46 0.00 0.00 176.86 177.33 3k8p h GLU 382 N 0.00 0.00 0.00 -0.72 4.39 -1.75 -3.35 114.58 113.15 3k8p h GLU 382 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 3k8p h GLU 382 Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 3k8p h GLU 382 CO 0.00 0.29 0.00 0.25 -1.16 0.00 0.00 179.01 178.39 3k8p n THR 383 N -3.17 0.00 0.69 1.13 -2.24 -1.09 -4.88 114.28 104.71 3k8p n THR 383 Ca 0.03 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 61.94 3k8p n THR 383 Cb 0.65 -0.01 0.37 0.00 -2.10 0.00 0.00 70.33 69.24 3k8p n THR 383 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 3k8p n VAL 384 N -0.02 0.42 -2.04 2.28 0.31 -1.26 -3.22 118.33 114.80 3k8p n VAL 384 Ca 0.00 -0.23 -0.25 0.00 -0.01 0.00 0.00 64.34 63.85 3k8p n VAL 384 Cb 0.00 -0.42 0.02 0.00 -0.91 0.00 0.00 33.84 32.53 3k8p n VAL 384 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 3k8p n LEU 385 N -2.08 5.06 -4.56 7.52 4.77 -1.26 -4.92 117.00 121.53 3k8p n LEU 385 Ca 0.05 -4.78 -0.39 0.00 -0.03 0.00 0.00 56.01 50.86 3k8p n LEU 385 Cb 0.41 -0.39 -0.11 0.00 -2.33 0.00 0.00 43.42 41.01 3k8p n LEU 385 CO 0.32 2.09 -0.13 -0.62 -1.33 0.00 0.00 177.39 177.72 3k8p s ASP 386 N -3.49 6.05 0.00 -1.43 -1.08 -1.20 -4.35 116.67 111.17 3k8p s ASP 386 Ca 0.51 -0.22 0.24 0.00 -0.52 0.00 0.00 52.55 52.57 3k8p s ASP 386 Cb 0.41 -2.14 1.06 0.00 -1.46 0.00 0.00 42.92 40.80 3k8p s ASP 386 CO 0.01 -0.16 1.78 2.30 0.52 0.00 0.00 175.17 179.62 3k8p n ILE 387 N 5.09 0.33 0.60 4.11 -5.35 -1.26 -3.44 119.36 119.44 3k8p n ILE 387 Ca -0.13 0.08 0.12 0.00 -0.27 0.00 0.00 62.75 62.56 3k8p n ILE 387 Cb 0.51 -0.67 0.27 0.00 -1.74 0.00 0.00 39.64 38.00 3k8p n ILE 387 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 3k8p n SER 388 N -1.47 0.74 -3.63 7.28 3.41 -1.26 -4.91 113.62 113.78 3k8p n SER 388 Ca 0.07 0.29 -0.10 0.00 -0.26 0.00 0.00 58.87 58.87 3k8p n SER 388 Cb 0.27 -0.21 -0.04 0.00 -0.26 0.00 0.00 64.21 63.96 3k8p n SER 388 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 175.04 173.29 3k8p s LYS 389 N -3.14 1.11 0.40 4.33 -2.85 -1.22 -5.16 119.74 113.21 3k8p s LYS 389 Ca 0.08 -0.72 -0.05 0.00 -1.00 0.00 0.00 55.97 54.28 3k8p s LYS 389 Cb 0.13 0.48 -0.05 0.00 -2.06 0.00 0.00 37.83 36.33 3k8p s LYS 389 CO 0.67 -0.44 0.69 0.16 0.10 0.00 0.00 175.35 176.53 3k8p s ASP 390 N -2.81 6.37 -0.26 0.03 1.47 -1.26 -4.72 116.67 115.49 3k8p s ASP 390 Ca 0.04 0.85 -0.17 0.00 1.18 0.00 0.00 52.55 54.44 3k8p s ASP 390 Cb 0.01 -2.21 -0.03 0.00 -0.34 0.00 0.00 42.92 40.36 3k8p s ASP 390 CO -0.11 -0.40 0.47 -0.62 0.68 0.00 0.00 175.17 175.18 3k8p s ASP 391 N -3.67 6.39 0.00 2.11 2.15 -1.26 -4.92 116.67 117.47 3k8p s ASP 391 Ca 0.46 0.46 0.18 0.00 0.43 0.00 0.00 52.55 54.08 3k8p s ASP 391 Cb -0.10 -2.26 0.50 0.00 -0.30 0.00 0.00 42.92 40.76 3k8p s ASP 391 CO 0.37 -0.24 1.42 0.29 -0.17 0.00 0.00 175.17 176.84 3k8p n LYS 392 N 5.37 2.21 -0.03 4.34 5.02 -1.26 -4.12 118.16 129.69 3k8p n LYS 392 Ca -0.06 -1.87 -0.03 0.00 -2.02 0.00 0.00 58.31 54.33 3k8p n LYS 392 Cb 0.50 -1.43 -0.01 0.00 -0.02 0.00 0.00 35.03 34.07 3k8p n LYS 392 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 3k8p n ILE 393 N 1.03 0.69 -2.66 -0.18 5.41 -1.26 -4.79 119.36 117.60 3k8p n ILE 393 Ca 0.18 0.30 -0.43 0.00 1.00 0.00 0.00 62.75 63.80 3k8p n ILE 393 Cb 0.46 -1.78 0.00 0.00 -0.71 0.00 0.00 39.64 37.60 3k8p n ILE 393 CO 0.00 0.00 0.00 0.49 0.00 0.00 0.00 176.55 177.04 3k8p n PHE 394 N -3.34 3.78 1.46 1.39 3.01 -1.26 -3.88 117.46 118.62 3k8p n PHE 394 Ca -0.05 -3.04 0.13 0.00 1.01 0.00 0.00 57.45 55.50 3k8p n PHE 394 Cb 0.20 -1.99 0.74 0.00 -0.01 0.00 0.00 39.48 38.42 3k8p n PHE 394 CO 0.00 0.00 0.00 0.25 1.01 0.00 0.00 176.76 178.02 3k8p n THR 395 N 3.66 0.08 -0.61 4.37 -2.24 -1.26 -3.36 114.28 114.93 3k8p n THR 395 Ca 0.37 0.02 0.00 0.00 -2.27 0.00 0.00 64.05 62.17 3k8p n THR 395 Cb 0.39 -0.58 0.00 0.00 -2.10 0.00 0.00 70.33 68.04 3k8p n THR 395 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 3k8p n ARG 396 N -1.17 1.05 -4.59 -0.78 0.63 -1.26 -5.03 116.66 105.51 3k8p n ARG 396 Ca 0.16 -0.83 -0.22 0.00 -0.92 0.00 0.00 57.85 56.04 3k8p n ARG 396 Cb 0.16 -0.70 -0.15 0.00 0.45 0.00 0.00 32.46 32.23 3k8p n ARG 396 CO 0.00 0.00 0.00 0.96 -2.51 0.00 0.00 177.63 176.08 3k8p s ILE 397 N -0.36 1.04 0.00 5.15 -4.36 -1.21 -4.73 121.20 116.73 3k8p s ILE 397 Ca 0.00 -0.55 0.00 0.00 -0.26 0.00 0.00 60.65 59.84 3k8p s ILE 397 Cb 0.00 -0.88 0.00 0.00 1.25 0.00 0.00 42.46 42.83 3k8p s ILE 397 CO 0.00 0.30 0.00 -1.54 0.24 0.00 0.00 174.94 173.94 3k8p n SER 398 N 2.88 0.00 0.00 4.36 3.41 -1.26 -4.90 113.62 118.11 3k8p n SER 398 Ca -0.15 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.46 3k8p n SER 398 Cb 0.55 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.50 3k8p n SER 398 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3k8p n ASP 400 N 0.00 0.00 -0.04 4.04 9.92 -1.26 -2.00 116.55 127.21 3k8p n ASP 400 Ca 0.00 0.00 0.11 0.00 -0.53 0.00 0.00 54.79 54.37 3k8p n ASP 400 Cb 0.00 0.00 0.52 0.00 -0.64 0.00 0.00 41.12 41.00 3k8p n ASP 400 CO 0.00 0.00 0.00 -0.33 0.13 0.00 0.00 177.20 177.00 3k8p h GLU 401 N 0.00 0.35 -0.00 -1.24 5.08 -1.99 0.22 114.58 117.00 3k8p h GLU 401 Ca 0.00 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.34 3k8p h GLU 401 Cb 0.00 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.17 3k8p h GLU 401 CO 0.00 0.23 -0.00 0.87 -1.00 0.00 0.00 179.01 179.11 3k8p h LYS 402 N 0.36 0.00 -0.87 2.33 1.57 -1.75 -1.96 116.57 116.24 3k8p h LYS 402 Ca 0.24 -0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 59.00 3k8p h LYS 402 Cb 0.47 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.74 3k8p h LYS 402 CO -0.06 0.64 0.47 -0.07 -0.57 0.00 0.00 179.45 179.86 3k8p h LEU 403 N -0.64 1.10 0.52 2.94 3.38 -1.73 -1.26 115.31 119.61 3k8p h LEU 403 Ca -0.00 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 57.85 3k8p h LEU 403 Cb 0.64 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 3k8p h LEU 403 CO 0.00 0.89 -0.37 0.22 0.09 0.00 0.00 178.44 179.27 3k8p h TYR 404 N 1.22 -0.98 -1.00 1.13 5.03 -0.56 0.06 116.97 121.87 3k8p h TYR 404 Ca 0.31 -0.00 0.33 0.00 2.58 0.00 0.00 58.73 61.94 3k8p h TYR 404 Cb 0.04 0.36 -0.15 0.00 1.55 0.00 0.00 36.73 38.53 3k8p h TYR 404 CO 0.01 -0.54 0.55 1.03 -1.32 0.00 0.00 178.16 177.89 3k8p h SER 405 N -0.86 0.47 -0.18 -2.11 0.87 -1.12 -0.11 113.55 110.51 3k8p h SER 405 Ca -0.06 0.20 -0.20 0.00 -1.23 0.00 0.00 61.79 60.50 3k8p h SER 405 Cb 0.72 0.16 0.01 0.00 -0.44 0.00 0.00 62.40 62.85 3k8p h SER 405 CO 0.03 -0.18 -0.69 0.40 -0.53 0.00 0.00 176.83 175.86 3k8p h ILE 406 N 0.28 1.29 -0.61 2.23 2.04 -0.40 -1.94 117.51 120.38 3k8p h ILE 406 Ca 0.75 -1.89 -0.07 0.00 1.00 0.00 0.00 64.86 64.65 3k8p h ILE 406 Cb 1.74 1.92 -0.03 0.00 -0.74 0.00 0.00 36.82 39.71 3k8p h ILE 406 CO -0.63 0.60 0.11 -0.07 0.00 0.00 0.00 178.15 178.16 3k8p h LEU 407 N 0.52 0.93 -0.89 1.44 3.38 0.63 0.13 115.31 121.46 3k8p h LEU 407 Ca -0.03 -0.20 -0.07 0.00 0.09 0.00 0.00 57.88 57.67 3k8p h LEU 407 Cb 1.31 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.79 3k8p h LEU 407 CO 0.14 0.92 0.09 -0.08 0.09 0.00 0.00 178.44 179.61 3k8p h GLU 408 N 0.93 0.91 -0.24 1.13 4.81 -1.05 -0.68 114.58 120.39 3k8p h GLU 408 Ca 0.19 -0.22 -0.10 0.00 -0.13 0.00 0.00 59.36 59.10 3k8p h GLU 408 Cb 0.39 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 29.64 3k8p h GLU 408 CO 0.01 0.85 -0.26 0.82 -0.73 0.00 0.00 179.01 179.70 3k8p h ILE 409 N 0.87 1.32 -0.09 2.32 2.04 -0.61 -2.72 117.51 120.64 3k8p h ILE 409 Ca 0.18 -1.43 -0.07 0.00 1.00 0.00 0.00 64.86 64.54 3k8p h ILE 409 Cb 0.38 1.69 -0.01 0.00 -0.74 0.00 0.00 36.82 38.14 3k8p h ILE 409 CO 0.01 0.45 -0.25 -0.07 0.00 0.00 0.00 178.15 178.28 3k8p h LEU 410 N 0.31 0.15 0.02 1.44 3.38 -0.66 -3.11 115.31 116.83 3k8p h LEU 410 Ca 0.04 -0.04 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 3k8p h LEU 410 Cb 0.82 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.53 3k8p h LEU 410 CO 0.06 0.41 -0.01 -0.07 0.09 0.00 0.00 178.44 178.92 3k8p h LEU 411 N 0.14 -0.02 -3.05 1.67 3.38 -1.05 0.20 115.31 116.58 3k8p h LEU 411 Ca 0.02 -0.33 0.00 0.00 0.09 0.00 0.00 57.88 57.66 3k8p h LEU 411 Cb 0.53 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.28 3k8p h LEU 411 CO 0.04 0.32 0.00 1.67 0.09 0.00 0.00 178.44 180.56 3k8p n GLN 412 N -4.94 0.06 -1.15 1.13 -0.06 -1.03 -4.50 117.38 106.89 3k8p n GLN 412 Ca -0.08 0.00 -0.01 0.00 -2.00 0.00 0.00 57.00 54.91 3k8p n GLN 412 Cb 0.19 -1.47 0.01 0.00 -4.06 0.00 0.00 30.24 24.90 3k8p n GLN 412 CO 0.00 0.00 0.00 0.09 -0.20 0.00 0.00 177.06 176.95 3k8p n ASN 414 N 1.51 -0.20 -3.89 1.69 3.02 -0.20 -5.11 115.26 112.07 3k8p n ASN 414 Ca 0.00 -0.77 -0.42 0.00 -0.03 0.00 0.00 54.58 53.35 3k8p n ASN 414 Cb 0.03 0.08 0.01 0.00 -0.61 0.00 0.00 39.78 39.29 3k8p n ASN 414 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3k8p n GLU 415 N -0.13 4.77 -0.09 3.52 -0.58 -0.11 -4.86 120.64 123.16 3k8p n GLU 415 Ca -0.04 -4.58 -0.04 0.00 -0.42 0.00 0.00 57.16 52.09 3k8p n GLU 415 Cb 0.45 -2.50 0.18 0.00 -0.57 0.00 0.00 31.44 29.00 3k8p n GLU 415 CO 0.00 0.00 0.00 0.74 -0.48 0.00 0.00 177.13 177.39 3k8p h PHE 416 N 5.07 0.79 -0.24 -0.32 -1.00 -1.95 -2.43 116.94 116.87 3k8p h PHE 416 Ca 0.30 -0.10 0.04 0.00 2.81 0.00 0.00 57.97 61.02 3k8p h PHE 416 Cb 0.52 -0.22 -0.04 0.00 3.61 0.00 0.00 35.95 39.82 3k8p h PHE 416 CO 1.12 0.73 -0.02 0.00 -1.61 0.00 0.00 178.31 178.53 3k8p h ALA 417 N 1.31 0.19 -0.84 2.45 0.00 -1.98 -1.26 119.26 119.12 3k8p h ALA 417 Ca 0.14 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 3k8p h ALA 417 Cb 0.42 0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.30 3k8p h ALA 417 CO 0.02 -0.44 0.47 1.88 0.00 0.00 0.00 179.25 181.17 3k8p h TYR 418 N 0.04 1.14 -0.49 0.00 -1.99 -1.90 -0.68 116.97 113.10 3k8p h TYR 418 Ca 0.11 -0.02 0.06 0.00 2.00 0.00 0.00 58.73 60.89 3k8p h TYR 418 Cb 0.15 -0.37 -0.05 0.00 2.00 0.00 0.00 36.73 38.46 3k8p h TYR 418 CO -0.21 0.79 0.19 0.82 -0.00 0.00 0.00 178.16 179.74 3k8p h ILE 419 N 1.17 0.85 0.55 -2.88 2.04 -1.02 0.16 117.51 118.39 3k8p h ILE 419 Ca 0.30 -0.13 -0.02 0.00 1.00 0.00 0.00 64.86 66.01 3k8p h ILE 419 Cb 0.01 0.45 -0.00 0.00 -0.74 0.00 0.00 36.82 36.54 3k8p h ILE 419 CO -0.05 0.07 -0.32 -0.33 0.00 0.00 0.00 178.15 177.52 3k8p h GLU 420 N 0.37 -0.79 -0.33 2.37 5.08 -0.61 -1.21 114.58 119.47 3k8p h GLU 420 Ca 0.23 0.05 0.06 0.00 -1.00 0.00 0.00 59.36 58.71 3k8p h GLU 420 Cb 0.23 0.18 -0.08 0.00 0.50 0.00 0.00 28.75 29.58 3k8p h GLU 420 CO -0.23 -0.52 -0.40 0.00 -1.00 0.00 0.00 179.01 176.86 3k8p h ALA 421 N -0.41 -0.41 -0.32 3.43 0.00 -0.67 -0.60 119.26 120.28 3k8p h ALA 421 Ca -0.07 0.05 0.07 0.00 0.00 0.00 0.00 54.91 54.97 3k8p h ALA 421 Cb 0.66 0.81 -0.07 0.00 0.00 0.00 0.00 17.79 19.19 3k8p h ALA 421 CO 0.08 -0.85 -0.17 0.82 0.00 0.00 0.00 179.25 179.14 3k8p h ILE 422 N -0.35 0.50 -0.77 0.00 2.04 -0.91 -0.16 117.51 117.85 3k8p h ILE 422 Ca 0.13 0.00 0.12 0.00 1.00 0.00 0.00 64.86 66.11 3k8p h ILE 422 Cb 0.58 0.50 -0.09 0.00 -0.74 0.00 0.00 36.82 37.08 3k8p h ILE 422 CO -0.51 0.00 0.37 0.40 0.00 0.00 0.00 178.15 178.41 3k8p h ILE 423 N -0.12 0.76 -0.18 -0.67 2.04 -0.40 -2.29 117.51 116.64 3k8p h ILE 423 Ca 0.16 -0.20 -0.02 0.00 1.00 0.00 0.00 64.86 65.81 3k8p h ILE 423 Cb 0.37 0.14 -0.01 0.00 -0.74 0.00 0.00 36.82 36.58 3k8p h ILE 423 CO -0.39 0.10 0.06 -0.33 0.00 0.00 0.00 178.15 177.59 3k8p h GLU 424 N 0.57 0.29 0.25 2.37 4.39 -0.25 -1.29 114.58 120.91 3k8p h GLU 424 Ca 0.41 -0.06 -0.01 0.00 0.34 0.00 0.00 59.36 60.03 3k8p h GLU 424 Cb 0.53 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.15 3k8p h GLU 424 CO -0.34 0.40 -0.12 -0.09 -1.16 0.00 0.00 179.01 177.70 3k8p h ARG 425 N 0.12 -0.32 -0.68 2.33 2.43 -0.53 -2.84 114.38 114.89 3k8p h ARG 425 Ca 0.06 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.25 3k8p h ARG 425 Cb 0.23 0.07 0.00 0.00 -0.42 0.00 0.00 29.97 29.86 3k8p h ARG 425 CO -0.00 -0.19 0.00 1.19 -1.51 0.00 0.00 179.97 179.46 3k8p n PHE 426 N -5.22 1.38 -3.86 2.20 3.01 -0.92 -4.94 117.46 109.12 3k8p n PHE 426 Ca -0.09 -0.49 -0.32 0.00 1.01 0.00 0.00 57.45 57.55 3k8p n PHE 426 Cb 0.16 -0.34 0.01 0.00 -0.01 0.00 0.00 39.48 39.30 3k8p n PHE 426 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 3k8p n ASP 427 N 0.53 -3.16 -1.07 4.37 2.03 -1.00 -4.88 116.55 113.37 3k8p n ASP 427 Ca 0.19 -1.07 0.07 0.00 0.52 0.00 0.00 54.79 54.50 3k8p n ASP 427 Cb 0.86 -2.94 0.23 0.00 -0.72 0.00 0.00 41.12 38.56 3k8p n ASP 427 CO 0.00 0.00 0.00 -1.22 -1.92 0.00 0.00 177.20 174.06 3k8p n TYR 428 N -4.41 0.90 -1.59 -0.67 4.01 -0.52 -4.97 117.16 109.90 3k8p n TYR 428 Ca -0.18 -0.38 -0.52 0.00 -0.16 0.00 0.00 57.90 56.66 3k8p n TYR 428 Cb 0.62 -0.13 -0.06 0.00 -0.31 0.00 0.00 39.34 39.47 3k8p n TYR 428 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 3k8p n SER 429 N 0.75 1.64 -1.74 7.72 7.64 -1.26 -1.12 113.62 127.26 3k8p n SER 429 Ca 0.17 1.12 -0.20 0.00 1.01 0.00 0.00 58.87 60.97 3k8p n SER 429 Cb 0.57 -1.19 -0.07 0.00 -1.01 0.00 0.00 64.21 62.51 3k8p n SER 429 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 3k8p n ASN 430 N 2.52 -5.32 -4.70 6.43 4.13 -0.38 -4.94 115.26 112.99 3k8p n ASN 430 Ca 0.18 0.40 -0.42 0.00 1.68 0.00 0.00 54.58 56.42 3k8p n ASN 430 Cb 0.19 -4.66 -0.03 0.00 -1.54 0.00 0.00 39.78 33.74 3k8p n ASN 430 CO 0.00 0.00 0.00 0.21 0.28 0.00 0.00 177.26 177.75 3k8p s ASN 431 N -2.56 6.82 0.14 6.41 3.84 -0.28 -4.79 114.94 124.52 3k8p s ASN 431 Ca 0.00 2.22 -0.20 0.00 0.21 0.00 0.00 52.86 55.09 3k8p s ASN 431 Cb 0.00 -2.57 0.00 0.00 -0.55 0.00 0.00 41.25 38.13 3k8p s ASN 431 CO 0.00 -0.71 1.68 0.74 -2.79 0.00 0.00 177.10 176.02 3k8p h THR 432 N 4.70 0.68 -0.85 -5.21 2.02 -1.92 0.62 112.91 112.95 3k8p h THR 432 Ca -0.40 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 66.76 3k8p h THR 432 Cb 1.19 0.68 -0.04 0.00 -1.74 0.00 0.00 68.15 68.24 3k8p h THR 432 CO 0.89 0.00 0.43 1.56 0.37 0.00 0.00 175.52 178.77 3k8p h GLN 433 N -0.07 1.20 -0.33 6.66 4.20 -1.98 -1.49 115.11 123.30 3k8p h GLN 433 Ca 0.12 -0.16 -0.07 0.00 0.06 0.00 0.00 58.65 58.59 3k8p h GLN 433 Cb 0.25 -0.22 -0.01 0.00 0.30 0.00 0.00 27.48 27.79 3k8p h GLN 433 CO -0.27 0.91 -0.08 0.82 -0.67 0.00 0.00 178.83 179.54 3k8p h ILE 434 N 1.19 1.28 -0.45 2.54 1.08 -1.84 -2.25 117.51 119.06 3k8p h ILE 434 Ca 0.29 -1.13 0.09 0.00 -0.39 0.00 0.00 64.86 63.72 3k8p h ILE 434 Cb 0.08 1.34 -0.10 0.00 -3.07 0.00 0.00 36.82 35.08 3k8p h ILE 434 CO -0.04 0.37 -0.30 0.22 -0.69 0.00 0.00 178.15 177.71 3k8p h TYR 435 N 0.41 -0.81 -0.05 1.37 3.20 -0.52 -0.05 116.97 120.53 3k8p h TYR 435 Ca 0.08 0.06 -0.06 0.00 3.14 0.00 0.00 58.73 61.95 3k8p h TYR 435 Cb 0.58 0.42 -0.01 0.00 1.54 0.00 0.00 36.73 39.26 3k8p h TYR 435 CO 0.05 -0.36 -0.26 0.93 -1.64 0.00 0.00 178.16 176.88 3k8p h GLU 436 N -0.20 0.08 0.13 1.82 5.08 -1.16 0.65 114.58 120.98 3k8p h GLU 436 Ca 0.20 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.52 3k8p h GLU 436 Cb 0.52 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.76 3k8p h GLU 436 CO -0.56 0.34 -0.06 1.25 -1.00 0.00 0.00 179.01 178.98 3k8p h LEU 437 N 0.08 -0.15 -0.29 1.33 5.85 -0.76 0.64 115.31 122.00 3k8p h LEU 437 Ca 0.01 -0.33 0.07 0.00 0.84 0.00 0.00 57.88 58.47 3k8p h LEU 437 Cb 0.51 0.04 -0.08 0.00 0.37 0.00 0.00 40.66 41.50 3k8p h LEU 437 CO 0.04 0.28 -0.25 -0.07 -0.34 0.00 0.00 178.44 178.10 3k8p h LEU 438 N -0.62 -0.81 -0.37 2.25 3.38 -0.75 -0.62 115.31 117.77 3k8p h LEU 438 Ca -0.02 0.15 0.03 0.00 0.09 0.00 0.00 57.88 58.13 3k8p h LEU 438 Cb 0.48 0.39 -0.03 0.00 0.09 0.00 0.00 40.66 41.58 3k8p h LEU 438 CO 0.03 -0.28 0.19 0.58 0.09 0.00 0.00 178.44 179.05 3k8p h VAL 439 N -0.23 0.99 -0.96 1.22 2.07 -0.86 0.13 116.25 118.60 3k8p h VAL 439 Ca 0.15 -0.13 0.14 0.00 0.82 0.00 0.00 66.70 67.68 3k8p h VAL 439 Cb 0.47 0.57 -0.08 0.00 -1.52 0.00 0.00 31.29 30.73 3k8p h VAL 439 CO -0.43 0.07 0.61 0.50 0.02 0.00 0.00 177.57 178.34 3k8p h LYS 440 N 0.38 0.81 0.03 1.57 3.64 -0.37 -1.60 116.57 121.03 3k8p h LYS 440 Ca 0.15 -0.05 -0.21 0.00 -1.27 0.00 0.00 60.65 59.27 3k8p h LYS 440 Cb 0.06 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 31.68 3k8p h LYS 440 CO -0.10 0.54 -0.97 0.74 -2.27 0.00 0.00 179.45 177.38 3k8p h PHE 441 N 0.83 0.24 -0.36 1.91 -1.00 -0.28 -2.29 116.94 116.00 3k8p h PHE 441 Ca 0.49 -0.15 0.06 0.00 2.81 0.00 0.00 57.97 61.18 3k8p h PHE 441 Cb 0.65 -0.02 -0.05 0.00 3.61 0.00 0.00 35.95 40.14 3k8p h PHE 441 CO -0.00 1.03 0.04 0.35 -1.61 0.00 0.00 178.31 178.11 3k8p h PHE 442 N 0.07 0.05 -0.38 -0.55 3.04 -0.06 0.02 116.94 119.13 3k8p h PHE 442 Ca -0.05 0.02 -0.09 0.00 3.98 0.00 0.00 57.97 61.84 3k8p h PHE 442 Cb 1.65 0.03 -0.02 0.00 2.56 0.00 0.00 35.95 40.17 3k8p h PHE 442 CO 0.03 -0.02 -0.12 -1.49 -2.02 0.00 0.00 178.31 174.68 3k8p h TRP 443 N 0.15 0.74 -0.02 0.41 4.06 -1.36 0.69 115.95 120.62 3k8p h TRP 443 Ca 0.17 -0.13 0.00 0.00 2.06 0.00 0.00 58.89 60.99 3k8p h TRP 443 Cb 0.22 -0.19 -0.00 0.00 -1.00 0.00 0.00 29.16 28.19 3k8p h TRP 443 CO -0.22 0.76 0.01 1.25 -3.56 0.00 0.00 178.44 176.69 3k8p h HIS 444 N 0.61 0.01 -0.51 0.49 2.76 -0.80 0.20 115.15 117.92 3k8p h HIS 444 Ca 0.11 0.00 -0.03 0.00 -2.20 0.00 0.00 60.37 58.25 3k8p h HIS 444 Cb 0.56 -0.00 -0.02 0.00 1.55 0.00 0.00 27.41 29.50 3k8p h HIS 444 CO 0.03 0.01 0.22 0.74 -1.30 0.00 0.00 177.93 177.62 3k8p h PHE 445 N 0.02 0.77 -0.17 5.26 0.05 -0.84 -2.10 116.94 119.93 3k8p h PHE 445 Ca 0.01 -0.05 0.03 0.00 3.82 0.00 0.00 57.97 61.77 3k8p h PHE 445 Cb 0.00 -0.23 -0.03 0.00 2.00 0.00 0.00 35.95 37.69 3k8p h PHE 445 CO -0.08 0.63 -0.02 0.35 -0.18 0.00 0.00 178.31 179.01 3k8p h PHE 446 N 0.69 -0.05 0.00 -0.55 3.57 -0.48 -1.83 116.94 118.29 3k8p h PHE 446 Ca 0.17 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.69 3k8p h PHE 446 Cb 0.18 0.05 0.00 0.00 2.79 0.00 0.00 35.95 38.96 3k8p h PHE 446 CO 0.00 -0.05 0.00 -0.91 -2.23 0.00 0.00 178.31 175.13 3k8p h ASN 447 N 0.03 0.00 1.41 0.41 2.35 -0.51 -2.69 115.58 116.58 3k8p h ASN 447 Ca 0.08 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.83 3k8p h ASN 447 Cb 0.11 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.48 3k8p h ASN 447 CO -0.15 0.00 -0.57 0.78 -1.65 0.00 0.00 177.43 175.84 3k8p h ASN 448 N 0.00 0.00 -4.02 5.81 2.35 -0.66 -3.46 115.58 115.60 3k8p h ASN 448 Ca 0.00 -0.01 -0.55 0.00 -0.55 0.00 0.00 56.30 55.20 3k8p h ASN 448 Cb 0.50 0.00 0.13 0.00 0.05 0.00 0.00 38.32 39.00 3k8p h ASN 448 CO 0.00 0.00 0.65 0.00 -1.65 0.00 0.00 177.43 176.43 3k8p s ALA 449 N -3.29 3.03 -0.58 -0.83 0.00 -0.76 -4.93 121.76 114.39 3k8p s ALA 449 Ca 0.03 1.38 0.15 0.00 0.00 0.00 0.00 51.96 53.52 3k8p s ALA 449 Cb 0.08 -3.57 -0.18 0.00 0.00 0.00 0.00 23.12 19.45 3k8p s ALA 449 CO 0.74 -1.26 0.59 -1.13 0.00 0.00 0.00 175.76 174.70 3k8p n SER 450 N -0.60 0.86 -3.83 0.00 3.41 -1.26 -4.53 113.62 107.67 3k8p n SER 450 Ca 0.08 -0.69 -0.09 0.00 -0.26 0.00 0.00 58.87 57.90 3k8p n SER 450 Cb 0.44 1.15 -0.04 0.00 -0.26 0.00 0.00 64.21 65.49 3k8p n SER 450 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3k8p s ASN 451 N -2.72 0.01 0.00 4.04 2.20 -1.26 -4.40 114.94 112.80 3k8p s ASN 451 Ca 0.03 -0.97 0.26 0.00 -0.94 0.00 0.00 52.86 51.24 3k8p s ASN 451 Cb 0.11 0.63 0.74 0.00 -2.00 0.00 0.00 41.25 40.73 3k8p s ASN 451 CO 0.63 -1.22 1.57 0.61 -2.94 0.00 0.00 177.10 175.75 3k8p n GLY 452 N -0.42 0.39 3.77 0.45 0.00 -1.26 -4.71 105.19 103.42 3k8p n GLY 452 Ca -0.02 -0.53 -0.41 0.00 0.00 0.00 0.00 46.02 45.06 3k8p n GLY 452 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3k8p s LEU 453 N -1.95 4.30 0.55 0.99 1.43 -1.26 -2.48 118.68 120.27 3k8p s LEU 453 Ca 0.35 2.94 0.29 0.00 -1.03 0.00 0.00 54.13 56.68 3k8p s LEU 453 Cb 0.20 -3.72 1.46 0.00 0.03 0.00 0.00 46.19 44.17 3k8p s LEU 453 CO 0.32 -0.85 1.92 0.03 0.23 0.00 0.00 176.35 178.00 3k8p h ARG 454 N 2.96 0.00 0.00 1.70 2.47 -1.93 -1.16 114.38 118.42 3k8p h ARG 454 Ca -0.50 0.00 -0.07 0.00 -1.26 0.00 0.00 59.98 58.14 3k8p h ARG 454 Cb 1.24 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.55 3k8p h ARG 454 CO 0.64 0.00 -0.34 1.57 0.56 0.00 0.00 179.97 182.40 3k8p h LYS 455 N 0.00 0.00 -6.61 0.04 2.10 -1.98 -3.34 116.57 106.78 3k8p h LYS 455 Ca 0.32 0.00 -0.56 0.00 -2.00 0.00 0.00 60.65 58.41 3k8p h LYS 455 Cb 1.38 0.00 0.07 0.00 -0.90 0.00 0.00 32.23 32.77 3k8p h LYS 455 CO -0.00 0.34 0.84 -1.91 -2.00 0.00 0.00 179.45 176.72 3k8p n GLU 456 N -3.20 2.40 -0.26 0.07 4.07 -0.44 -4.78 120.64 118.49 3k8p n GLU 456 Ca 0.02 0.86 0.03 0.00 -0.06 0.00 0.00 57.16 58.01 3k8p n GLU 456 Cb 0.65 -2.63 0.16 0.00 -0.06 0.00 0.00 31.44 29.56 3k8p n GLU 456 CO 0.00 0.00 0.00 -1.35 -0.06 0.00 0.00 177.13 175.72 3k8p h PRO 457 N 5.67 0.60 -1.65 5.31 0.11 -1.89 -0.37 132.00 139.78 3k8p h PRO 457 Ca -0.45 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.63 3k8p h PRO 457 Cb 1.24 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.21 3k8p h PRO 457 CO 0.87 0.40 0.00 0.39 -0.21 0.00 0.00 178.00 179.45 3k8p n GLU 458 N -4.86 0.42 0.00 1.05 -0.58 -1.26 -2.04 120.64 113.37 3k8p n GLU 458 Ca 0.13 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.87 3k8p n GLU 458 Cb 0.32 -1.29 0.00 0.00 -0.57 0.00 0.00 31.44 29.90 3k8p n GLU 458 CO 0.00 0.00 0.00 1.17 -0.48 0.00 0.00 177.13 177.82 3k8p n LYS 460 N 0.96 0.00 -0.08 3.49 4.81 -0.15 -1.22 118.16 125.97 3k8p n LYS 460 Ca 0.00 0.00 -0.11 0.00 -0.87 0.00 0.00 58.31 57.33 3k8p n LYS 460 Cb 0.21 0.00 0.02 0.00 0.02 0.00 0.00 35.03 35.28 3k8p n LYS 460 CO 0.00 0.00 0.00 0.87 1.17 0.00 0.00 177.40 179.44 3k8p h LYS 461 N 0.00 0.80 -0.50 1.64 1.57 -1.68 0.17 116.57 118.56 3k8p h LYS 461 Ca 0.00 -0.43 0.05 0.00 -1.87 0.00 0.00 60.65 58.41 3k8p h LYS 461 Cb 0.00 0.02 -0.05 0.00 0.08 0.00 0.00 32.23 32.28 3k8p h LYS 461 CO 0.00 1.06 0.23 0.00 -0.57 0.00 0.00 179.45 180.17 3k8p h ALA 462 N 0.88 0.64 0.33 3.86 0.00 -1.44 0.17 119.26 123.69 3k8p h ALA 462 Ca 0.05 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 3k8p h ALA 462 Cb 0.97 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.73 3k8p h ALA 462 CO 0.09 -0.14 -0.16 1.03 0.00 0.00 0.00 179.25 180.08 3k8p h SER 463 N 0.45 -0.37 -0.76 0.00 0.87 -1.71 -2.36 113.55 109.66 3k8p h SER 463 Ca 0.23 -0.00 0.09 0.00 -1.23 0.00 0.00 61.79 60.88 3k8p h SER 463 Cb 0.18 0.10 -0.05 0.00 -0.44 0.00 0.00 62.40 62.19 3k8p h SER 463 CO -0.19 -0.25 0.50 1.56 -0.53 0.00 0.00 176.83 177.92 3k8p h GLN 464 N -0.46 0.66 -0.39 2.24 4.20 -0.39 -0.70 115.11 120.27 3k8p h GLN 464 Ca -0.05 -0.04 -0.06 0.00 0.06 0.00 0.00 58.65 58.57 3k8p h GLN 464 Cb 0.35 -0.15 -0.02 0.00 0.30 0.00 0.00 27.48 27.97 3k8p h GLN 464 CO 0.07 0.44 0.00 1.15 -0.67 0.00 0.00 178.83 179.82 3k8p h THR 465 N 0.68 1.21 -0.11 -0.54 2.02 -0.45 -2.70 112.91 113.03 3k8p h THR 465 Ca 0.35 -0.86 -0.22 0.00 0.77 0.00 0.00 66.41 66.44 3k8p h THR 465 Cb 0.45 0.92 0.01 0.00 -1.74 0.00 0.00 68.15 67.79 3k8p h THR 465 CO -0.13 0.30 -0.80 -0.07 0.37 0.00 0.00 175.52 175.19 3k8p h LEU 466 N 0.58 0.90 -1.65 2.58 3.38 -0.64 -2.35 115.31 118.10 3k8p h LEU 466 Ca 0.12 -0.66 0.12 0.00 0.09 0.00 0.00 57.88 57.55 3k8p h LEU 466 Cb 0.37 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.81 3k8p h LEU 466 CO 0.01 1.42 0.43 1.56 0.09 0.00 0.00 178.44 181.95 3k8p h GLN 467 N 0.44 0.37 -0.22 1.13 4.20 -1.15 1.13 115.11 121.02 3k8p h GLN 467 Ca -0.07 -0.02 -0.13 0.00 0.06 0.00 0.00 58.65 58.49 3k8p h GLN 467 Cb 1.44 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 29.14 3k8p h GLN 467 CO 0.16 0.24 -0.38 0.82 -0.67 0.00 0.00 178.83 179.01 3k8p h ILE 468 N 0.38 1.32 -0.66 2.54 2.04 -1.42 -0.22 117.51 121.49 3k8p h ILE 468 Ca 0.30 -1.59 0.03 0.00 1.00 0.00 0.00 64.86 64.60 3k8p h ILE 468 Cb 0.66 1.81 -0.04 0.00 -0.74 0.00 0.00 36.82 38.50 3k8p h ILE 468 CO -0.08 0.50 0.40 0.40 0.00 0.00 0.00 178.15 179.37 3k8p h ILE 469 N 0.33 1.06 0.44 -0.67 2.04 -0.47 -0.40 117.51 119.85 3k8p h ILE 469 Ca 0.01 -0.27 -0.02 0.00 1.00 0.00 0.00 64.86 65.59 3k8p h ILE 469 Cb 0.97 0.22 0.00 0.00 -0.74 0.00 0.00 36.82 37.27 3k8p h ILE 469 CO 0.09 0.14 -0.24 -0.61 0.00 0.00 0.00 178.15 177.53 3k8p h GLN 470 N 0.78 -0.61 -0.39 2.37 5.75 0.13 -3.04 115.11 120.10 3k8p h GLN 470 Ca 0.27 0.04 -0.07 0.00 -0.15 0.00 0.00 58.65 58.74 3k8p h GLN 470 Cb 0.05 0.14 -0.02 0.00 1.07 0.00 0.00 27.48 28.72 3k8p h GLN 470 CO -0.12 -0.40 -0.05 0.87 -2.65 0.00 0.00 178.83 176.47 3k8p h LYS 471 N -0.63 0.65 -0.52 1.69 1.57 -0.89 -3.35 116.57 115.09 3k8p h LYS 471 Ca -0.06 -0.18 -0.37 0.00 -1.87 0.00 0.00 60.65 58.17 3k8p h LYS 471 Cb 0.50 -0.07 -0.37 0.00 0.08 0.00 0.00 32.23 32.37 3k8p h LYS 471 CO 0.08 0.70 -0.87 0.72 -0.57 0.00 0.00 179.45 179.51 3k8p n HIS 472 N -4.21 1.83 0.00 -1.35 8.25 -0.17 -5.08 115.22 114.48 3k8p n HIS 472 Ca 0.02 -2.00 0.00 0.00 -0.26 0.00 0.00 57.72 55.47 3k8p n HIS 472 Cb 0.31 -0.29 0.00 0.00 1.12 0.00 0.00 29.99 31.13 3k8p n HIS 472 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 3k8p n SER 474 N -0.66 0.00 -0.10 0.41 7.64 -1.15 -1.25 113.62 118.50 3k8p n SER 474 Ca 0.29 0.00 -0.07 0.00 1.01 0.00 0.00 58.87 60.09 3k8p n SER 474 Cb 0.90 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 64.09 3k8p n SER 474 CO 0.00 0.00 0.00 1.56 -3.01 0.00 0.00 175.04 173.59 3k8p h GLN 475 N 0.00 -0.23 0.00 1.43 1.08 -1.94 -0.78 115.11 114.68 3k8p h GLN 475 Ca 0.00 0.02 -0.03 0.00 -1.45 0.00 0.00 58.65 57.18 3k8p h GLN 475 Cb 0.00 0.05 -0.00 0.00 -0.05 0.00 0.00 27.48 27.48 3k8p h GLN 475 CO 0.00 -0.15 -0.16 -0.09 -0.95 0.00 0.00 178.83 177.48 3k8p h ARG 476 N -0.23 0.00 0.16 1.46 9.65 -1.96 -3.10 114.38 120.36 3k8p h ARG 476 Ca 0.17 0.00 -0.29 0.00 -1.10 0.00 0.00 59.98 58.76 3k8p h ARG 476 Cb 0.51 0.00 0.01 0.00 -1.39 0.00 0.00 29.97 29.10 3k8p h ARG 476 CO -0.50 0.16 -1.31 0.00 2.80 0.00 0.00 179.97 181.11 3k8p h ALA 477 N 1.84 0.04 -0.62 2.80 0.00 -1.81 -3.49 119.26 118.03 3k8p h ALA 477 Ca -0.00 -0.89 0.00 0.00 0.00 0.00 0.00 54.91 54.02 3k8p h ALA 477 Cb 0.85 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.70 3k8p h ALA 477 CO 0.02 0.92 0.00 0.41 0.00 0.00 0.00 179.25 180.60 3k8p n GLY 478 N 1.58 2.87 0.17 0.00 0.00 -0.34 -1.16 105.19 108.32 3k8p n GLY 478 Ca -0.11 -0.16 0.13 0.00 0.00 0.00 0.00 46.02 45.88 3k8p n GLY 478 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3k8p h THR 479 N 0.00 0.00 0.00 2.61 1.35 -1.93 -3.18 112.91 111.76 3k8p h THR 479 Ca 0.00 -0.29 -0.04 0.00 -0.55 0.00 0.00 66.41 65.53 3k8p h THR 479 Cb 0.00 1.08 -0.01 0.00 -1.73 0.00 0.00 68.15 67.49 3k8p h THR 479 CO 0.00 0.00 -0.21 -1.13 -0.25 0.00 0.00 175.52 173.93 3k8p h ASN 480 N 0.00 0.00 -0.32 5.36 -1.24 -1.53 -2.67 115.58 115.18 3k8p h ASN 480 Ca 0.00 0.00 -0.08 0.00 0.71 0.00 0.00 56.30 56.93 3k8p h ASN 480 Cb 0.38 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.42 3k8p h ASN 480 CO 0.00 0.21 -0.13 0.25 -1.29 0.00 0.00 177.43 176.47 3k8p h LEU 481 N 0.00 0.67 0.12 0.34 5.85 -1.64 -2.59 115.31 118.05 3k8p h LEU 481 Ca -0.00 -0.40 0.02 0.00 0.84 0.00 0.00 57.88 58.34 3k8p h LEU 481 Cb 0.48 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 41.29 3k8p h LEU 481 CO 0.03 0.91 -0.38 0.74 -0.34 0.00 0.00 178.44 179.41 3k8p h THR 482 N 0.41 0.22 -0.50 1.05 2.02 -1.68 0.86 112.91 115.29 3k8p h THR 482 Ca 0.07 0.00 0.10 0.00 0.77 0.00 0.00 66.41 67.35 3k8p h THR 482 Cb 0.65 0.22 -0.10 0.00 -1.74 0.00 0.00 68.15 67.19 3k8p h THR 482 CO 0.04 0.00 -0.25 0.11 0.37 0.00 0.00 175.52 175.80 3k8p h LYS 483 N -0.61 -0.13 -0.52 6.66 1.57 -1.53 -0.41 116.57 121.61 3k8p h LYS 483 Ca 0.03 0.01 -0.07 0.00 -1.87 0.00 0.00 60.65 58.74 3k8p h LYS 483 Cb 0.64 0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.96 3k8p h LYS 483 CO -0.22 -0.08 0.05 -0.07 -0.57 0.00 0.00 179.45 178.55 3k8p h LEU 484 N -0.13 0.86 -0.84 2.94 3.38 -1.01 0.44 115.31 120.94 3k8p h LEU 484 Ca 0.23 -0.28 0.04 0.00 0.09 0.00 0.00 57.88 57.95 3k8p h LEU 484 Cb 0.49 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 40.96 3k8p h LEU 484 CO -0.59 0.93 0.54 -0.33 0.09 0.00 0.00 178.44 179.08 3k8p h GLU 485 N 0.76 1.01 -0.27 1.13 5.08 -0.51 -2.17 114.58 119.60 3k8p h GLU 485 Ca 0.15 -0.06 -0.09 0.00 -1.00 0.00 0.00 59.36 58.37 3k8p h GLU 485 Cb 0.46 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.47 3k8p h GLU 485 CO 0.02 0.67 -0.16 0.28 -1.00 0.00 0.00 179.01 178.81 3k8p h VAL 486 N 1.04 1.30 -0.81 3.13 2.07 -0.21 -2.50 116.25 120.27 3k8p h VAL 486 Ca 0.34 -1.27 0.09 0.00 0.82 0.00 0.00 66.70 66.67 3k8p h VAL 486 Cb 0.03 1.54 -0.05 0.00 -1.52 0.00 0.00 31.29 31.28 3k8p h VAL 486 CO -0.12 0.40 0.53 0.25 0.02 0.00 0.00 177.57 178.65 3k8p h LEU 487 N 0.33 0.71 -0.59 2.57 5.85 0.11 -0.83 115.31 123.45 3k8p h LEU 487 Ca 0.06 0.01 -0.10 0.00 0.84 0.00 0.00 57.88 58.69 3k8p h LEU 487 Cb 0.69 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.56 3k8p h LEU 487 CO 0.05 0.43 -0.03 -0.07 -0.34 0.00 0.00 178.44 178.48 3k8p h LEU 488 N 0.79 1.05 -0.61 2.25 3.38 -1.29 -2.24 115.31 118.64 3k8p h LEU 488 Ca 0.36 -0.32 -0.03 0.00 0.09 0.00 0.00 57.88 57.99 3k8p h LEU 488 Cb 0.38 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.82 3k8p h LEU 488 CO -0.14 1.11 0.28 -0.08 0.09 0.00 0.00 178.44 179.70 3k8p h GLU 489 N 0.95 0.89 0.00 1.13 4.57 -0.73 -2.01 114.58 119.38 3k8p h GLU 489 Ca 0.16 -0.14 -0.13 0.00 -1.18 0.00 0.00 59.36 58.08 3k8p h GLU 489 Cb 0.59 -0.15 -0.02 0.00 -0.16 0.00 0.00 28.75 29.01 3k8p h GLU 489 CO 0.04 0.73 -0.61 -0.84 -1.18 0.00 0.00 179.01 177.14 3k8p h ILE 490 N 0.84 1.26 -0.47 2.32 3.07 -1.26 -2.20 117.51 121.05 3k8p h ILE 490 Ca 0.21 -2.24 0.04 0.00 1.55 0.00 0.00 64.86 64.41 3k8p h ILE 490 Cb 0.14 2.27 -0.04 0.00 -0.27 0.00 0.00 36.82 38.93 3k8p h ILE 490 CO -0.02 0.60 0.25 0.28 -1.05 0.00 0.00 178.15 178.20 3k8p h SER 491 N 0.00 0.36 -0.26 2.16 0.02 -1.12 0.28 113.55 114.99 3k8p h SER 491 Ca -0.01 0.02 -0.00 0.00 -0.84 0.00 0.00 61.79 60.96 3k8p h SER 491 Cb 1.22 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 63.70 3k8p h SER 491 CO 0.08 0.26 0.14 -0.78 -1.14 0.00 0.00 176.83 175.39 3k8p h ASP 492 N 0.49 0.32 -0.08 3.07 1.82 -1.05 -2.62 116.42 118.37 3k8p h ASP 492 Ca 0.20 -0.08 -0.00 0.00 -0.39 0.00 0.00 57.03 56.76 3k8p h ASP 492 Cb 0.10 -0.08 -0.00 0.00 0.68 0.00 0.00 39.33 40.02 3k8p h ASP 492 CO -0.14 0.31 0.05 0.11 -1.61 0.00 0.00 179.24 177.96 3k8p h LYS 493 N 0.30 0.11 -0.56 0.28 1.57 -1.03 -2.67 116.57 114.57 3k8p h LYS 493 Ca 0.09 -0.01 0.06 0.00 -1.87 0.00 0.00 60.65 58.92 3k8p h LYS 493 Cb 0.06 -0.02 -0.03 0.00 0.08 0.00 0.00 32.23 32.32 3k8p h LYS 493 CO -0.01 0.12 0.37 -0.07 -0.57 0.00 0.00 179.45 179.29 3k8p h LEU 494 N 0.07 0.46 0.00 2.94 3.38 -0.44 -0.90 115.31 120.81 3k8p h LEU 494 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 3k8p h LEU 494 Cb 0.04 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.69 3k8p h LEU 494 CO -0.01 0.30 0.00 -1.20 0.09 0.00 0.00 178.44 177.62 3k8p n SER 495 N -4.47 0.00 -0.72 -0.43 7.64 -0.99 -2.47 113.62 112.17 3k8p n SER 495 Ca 0.08 -0.99 0.10 0.00 1.01 0.00 0.00 58.87 59.07 3k8p n SER 495 Cb 0.24 0.00 0.31 0.00 -1.01 0.00 0.00 64.21 63.74 3k8p n SER 495 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 3k8p n HIS 496 N -0.91 0.33 -4.22 1.43 8.25 -0.34 -4.90 115.22 114.87 3k8p n HIS 496 Ca 0.16 -0.17 -0.14 0.00 -0.26 0.00 0.00 57.72 57.32 3k8p n HIS 496 Cb 0.07 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.08 3k8p n HIS 496 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 3k8p s TYR 497 N -1.67 1.17 -0.06 4.41 1.51 -1.03 -5.12 117.35 116.57 3k8p s TYR 497 Ca 0.33 -0.73 -0.30 0.00 -1.01 0.00 0.00 57.07 55.36 3k8p s TYR 497 Cb 0.18 -0.62 -0.03 0.00 -0.11 0.00 0.00 41.96 41.38 3k8p s TYR 497 CO 0.26 0.04 1.24 -1.12 -1.11 0.00 0.00 175.55 174.86 3k8p s SER 498 N -2.88 7.01 -0.03 2.29 0.01 -1.26 -5.03 113.70 113.81 3k8p s SER 498 Ca 0.12 1.86 0.05 0.00 1.31 0.00 0.00 55.95 59.28 3k8p s SER 498 Cb 0.01 -2.56 -0.01 0.00 0.21 0.00 0.00 66.02 63.67 3k8p s SER 498 CO -0.00 -0.62 -0.18 -0.63 0.41 0.00 0.00 173.24 172.22 3k8p s ILE 499 N 2.36 1.43 -0.10 1.44 1.01 -1.26 -4.60 121.20 121.48 3k8p s ILE 499 Ca 0.57 -0.74 0.16 0.00 0.00 0.00 0.00 60.65 60.64 3k8p s ILE 499 Cb -0.26 -1.22 0.35 0.00 0.01 0.00 0.00 42.46 41.35 3k8p s ILE 499 CO 0.22 0.41 1.16 -0.46 0.00 0.00 0.00 174.94 176.27 3k8p n ASN 500 N 2.94 1.34 -3.61 3.58 6.94 -1.26 -4.69 115.26 120.50 3k8p n ASN 500 Ca -0.17 -2.89 -0.42 0.00 -0.02 0.00 0.00 54.58 51.08 3k8p n ASN 500 Cb 0.53 -0.39 -0.05 0.00 -2.36 0.00 0.00 39.78 37.51 3k8p n ASN 500 CO 0.00 0.00 0.00 0.18 -1.03 0.00 0.00 177.26 176.41 3k8p n LEU 501 N -0.47 4.39 0.00 -4.53 4.77 -1.26 -5.14 117.00 114.76 3k8p n LEU 501 Ca 0.12 -3.01 0.00 0.00 -0.03 0.00 0.00 56.01 53.09 3k8p n LEU 501 Cb 0.84 -1.16 0.00 0.00 -2.33 0.00 0.00 43.42 40.77 3k8p n LEU 501 CO -0.03 -0.18 0.00 0.59 -1.33 0.00 0.00 177.39 176.44 3k8p n ASN 502 N 7.19 0.00 -2.91 -1.43 3.02 -1.26 -4.99 115.26 114.88 3k8p n ASN 502 Ca 0.50 0.00 -0.08 0.00 -0.03 0.00 0.00 54.58 54.97 3k8p n ASN 502 Cb 0.39 0.00 0.07 0.00 -0.61 0.00 0.00 39.78 39.63 3k8p n ASN 502 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3k8p n ALA 512 N -3.00 -1.09 -3.02 5.41 0.00 -1.26 -5.29 120.51 112.26 3k8p n ALA 512 Ca 0.00 -0.40 -0.39 0.00 0.00 0.00 0.00 53.44 52.65 3k8p n ALA 512 Cb 0.00 -0.03 -0.12 0.00 0.00 0.00 0.00 19.45 19.30 3k8p n ALA 512 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 3k8p s PHE 513 N -1.40 3.21 0.20 0.00 5.36 -1.26 -5.08 117.98 119.00 3k8p s PHE 513 Ca 0.18 -1.00 -0.27 0.00 -0.96 0.00 0.00 56.93 54.87 3k8p s PHE 513 Cb -0.02 -2.33 -0.08 0.00 -0.34 0.00 0.00 43.02 40.24 3k8p s PHE 513 CO 0.14 -0.61 0.85 0.15 -1.46 0.00 0.00 175.22 174.29 3k8p s LYS 514 N 1.51 4.69 0.55 10.12 1.02 -1.26 -4.53 119.74 131.85 3k8p s LYS 514 Ca 0.02 1.30 0.34 0.00 0.02 0.00 0.00 55.97 57.65 3k8p s LYS 514 Cb -0.18 -3.27 1.51 0.00 -0.52 0.00 0.00 37.83 35.36 3k8p s LYS 514 CO 0.04 0.54 1.83 -1.35 -0.92 0.00 0.00 175.35 175.50 3k8p h PRO 515 N 4.29 0.00 0.00 -1.68 0.11 -1.84 0.30 132.00 133.17 3k8p h PRO 515 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 3k8p h PRO 515 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 3k8p h PRO 515 CO 0.67 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 179.12 3k8p h SER 516 N 0.00 0.00 0.48 -2.05 4.64 -1.87 -1.97 113.55 112.79 3k8p h SER 516 Ca 0.48 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.71 3k8p h SER 516 Cb 1.99 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 64.07 3k8p h SER 516 CO -0.01 0.00 -0.41 0.78 -0.87 0.00 0.00 176.83 176.33 3k8p h ASN 517 N 0.00 0.00 -0.71 4.97 2.35 -1.31 -2.98 115.58 117.90 3k8p h ASN 517 Ca 0.00 0.00 0.15 0.00 -0.55 0.00 0.00 56.30 55.90 3k8p h ASN 517 Cb 0.51 0.00 -0.10 0.00 0.05 0.00 0.00 38.32 38.78 3k8p h ASN 517 CO 0.00 0.41 0.20 0.40 -1.65 0.00 0.00 177.43 176.78 3k8p h ILE 518 N 0.00 0.57 -0.43 2.81 2.04 -1.44 -0.03 117.51 121.04 3k8p h ILE 518 Ca -0.00 -0.11 -0.01 0.00 1.00 0.00 0.00 64.86 65.74 3k8p h ILE 518 Cb 0.76 0.24 -0.02 0.00 -0.74 0.00 0.00 36.82 37.06 3k8p h ILE 518 CO 0.05 0.06 0.22 -0.07 0.00 0.00 0.00 178.15 178.41 3k8p h LEU 519 N 0.31 0.52 -2.69 1.44 3.38 -1.69 -1.94 115.31 114.65 3k8p h LEU 519 Ca 0.39 -0.04 -0.00 0.00 0.09 0.00 0.00 57.88 58.33 3k8p h LEU 519 Cb 0.64 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.26 3k8p h LEU 519 CO -0.46 0.44 -0.01 -0.33 0.09 0.00 0.00 178.44 178.17 3k8p h GLU 520 N 0.59 0.00 -0.69 1.13 5.08 -1.08 -2.38 114.58 117.23 3k8p h GLU 520 Ca 0.15 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 3k8p h GLU 520 Cb 0.05 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.30 3k8p h GLU 520 CO -0.02 0.01 0.00 0.66 -1.00 0.00 0.00 179.01 178.65 3k8p n TYR 521 N -3.40 1.07 0.08 4.33 4.02 -0.73 -4.63 117.16 117.90 3k8p n TYR 521 Ca -0.03 -0.50 0.20 0.00 -0.01 0.00 0.00 57.90 57.57 3k8p n TYR 521 Cb 0.09 -0.07 0.63 0.00 -0.02 0.00 0.00 39.34 39.98 3k8p n TYR 521 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 176.86 175.76 3k8p h ARG 522 N 4.03 0.00 -0.01 -0.72 2.43 -1.48 0.23 114.38 118.86 3k8p h ARG 522 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3k8p h ARG 522 Cb 1.06 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.61 3k8p h ARG 522 CO 0.06 0.00 -0.43 -0.25 -1.51 0.00 0.00 179.97 177.84 3k8p n ASP 523 N -3.36 1.65 -3.05 -3.80 9.92 -1.26 -4.60 116.55 112.05 3k8p n ASP 523 Ca 0.09 -1.32 -0.15 0.00 -0.53 0.00 0.00 54.79 52.87 3k8p n ASP 523 Cb 0.83 0.54 0.00 0.00 -0.64 0.00 0.00 41.12 41.85 3k8p n ASP 523 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3k8p h PRO 525 N 2.98 0.44 -0.27 0.00 0.11 -1.60 -1.53 132.00 132.13 3k8p h PRO 525 Ca 0.04 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 66.12 3k8p h PRO 525 Cb 1.02 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.02 3k8p h PRO 525 CO 0.41 0.29 0.16 -0.07 -0.21 0.00 0.00 178.00 178.59 3k8p h LEU 526 N 0.46 0.32 -2.09 2.35 3.38 -1.93 -0.58 115.31 117.21 3k8p h LEU 526 Ca 0.16 -0.01 0.08 0.00 0.09 0.00 0.00 57.88 58.20 3k8p h LEU 526 Cb 0.08 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 3k8p h LEU 526 CO -0.04 0.25 0.33 0.44 0.09 0.00 0.00 178.44 179.51 3k8p h ASP 527 N 0.37 0.00 0.22 -0.43 5.19 -1.65 0.40 116.42 120.52 3k8p h ASP 527 Ca 0.10 0.00 -0.30 0.00 -0.62 0.00 0.00 57.03 56.21 3k8p h ASP 527 Cb -0.01 0.00 0.03 0.00 0.18 0.00 0.00 39.33 39.53 3k8p h ASP 527 CO -0.02 0.00 -1.31 0.40 -3.12 0.00 0.00 179.24 175.19 3k8p h ILE 528 N 0.00 1.34 -0.66 0.35 2.04 -1.24 -2.95 117.51 116.39 3k8p h ILE 528 Ca 0.14 -2.65 -0.07 0.00 1.00 0.00 0.00 64.86 63.28 3k8p h ILE 528 Cb 0.79 3.07 -0.03 0.00 -0.74 0.00 0.00 36.82 39.92 3k8p h ILE 528 CO -0.00 0.78 0.13 0.40 0.00 0.00 0.00 178.15 179.47 3k8p h ILE 529 N 0.03 1.26 -0.07 -0.67 1.08 -1.04 -2.41 117.51 115.68 3k8p h ILE 529 Ca -0.23 -0.98 0.00 0.00 -0.39 0.00 0.00 64.86 63.27 3k8p h ILE 529 Cb 2.03 0.61 -0.00 0.00 -3.07 0.00 0.00 36.82 36.38 3k8p h ILE 529 CO 0.25 0.37 0.04 -1.28 -0.69 0.00 0.00 178.15 176.83 3k8p h SER 530 N 1.00 0.06 -1.00 1.72 0.87 -0.36 -1.46 113.55 114.38 3k8p h SER 530 Ca 0.21 0.00 0.08 0.00 -1.23 0.00 0.00 61.79 60.85 3k8p h SER 530 Cb 0.39 -0.01 -0.07 0.00 -0.44 0.00 0.00 62.40 62.26 3k8p h SER 530 CO 0.01 0.05 0.64 -1.13 -0.53 0.00 0.00 176.83 175.86 3k8p h ASN 531 N 0.08 0.99 0.40 6.23 -1.24 -1.42 -1.61 115.58 119.01 3k8p h ASN 531 Ca 0.03 0.02 -0.02 0.00 0.71 0.00 0.00 56.30 57.04 3k8p h ASN 531 Cb -0.00 -0.19 0.00 0.00 0.73 0.00 0.00 38.32 38.87 3k8p h ASN 531 CO -0.01 0.60 -0.19 -0.07 -1.29 0.00 0.00 177.43 176.47 3k8p h LEU 532 N 1.11 -0.46 -0.97 0.34 3.38 -1.07 -1.36 115.31 116.29 3k8p h LEU 532 Ca 0.45 -0.05 0.17 0.00 0.09 0.00 0.00 57.88 58.54 3k8p h LEU 532 Cb 0.27 0.12 -0.10 0.00 0.09 0.00 0.00 40.66 41.04 3k8p h LEU 532 CO -0.20 -0.24 0.58 -0.07 0.09 0.00 0.00 178.44 178.59 3k8p h LEU 533 N -0.65 0.76 0.20 1.67 3.38 -0.91 0.27 115.31 120.02 3k8p h LEU 533 Ca -0.06 0.09 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 3k8p h LEU 533 Cb 0.47 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.17 3k8p h LEU 533 CO 0.09 0.31 -0.10 -0.08 0.09 0.00 0.00 178.44 178.75 3k8p h GLU 534 N 0.78 -0.26 0.00 1.13 4.81 -1.21 -3.32 114.58 116.51 3k8p h GLU 534 Ca 0.54 0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.78 3k8p h GLU 534 Cb 0.76 0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.20 3k8p h GLU 534 CO -0.35 0.02 -0.14 -0.07 -0.73 0.00 0.00 179.01 177.74 3k8p h LEU 535 N -0.54 0.00 -7.31 1.64 3.38 -0.53 -3.39 115.31 108.56 3k8p h LEU 535 Ca -0.03 -0.04 -0.63 0.00 0.09 0.00 0.00 57.88 57.27 3k8p h LEU 535 Cb 0.40 0.00 -0.41 0.00 0.09 0.00 0.00 40.66 40.74 3k8p h LEU 535 CO 0.05 0.02 -0.64 0.20 0.09 0.00 0.00 178.44 178.15 3k8p s ASN 536 N -4.69 4.25 0.00 -0.43 0.01 0.87 -4.75 114.94 110.20 3k8p s ASN 536 Ca 0.09 -3.02 0.06 0.00 -0.71 0.00 0.00 52.86 49.28 3k8p s ASN 536 Cb 0.12 -1.56 0.28 0.00 0.41 0.00 0.00 41.25 40.50 3k8p s ASN 536 CO 0.63 -0.23 1.15 -2.65 -1.51 0.00 0.00 177.10 174.50 3k8p n PRO 537 N 3.09 0.03 -0.03 -0.60 -0.02 -1.26 -0.76 135.00 135.45 3k8p n PRO 537 Ca 0.06 0.34 0.06 0.00 -2.02 0.00 0.00 63.50 61.94 3k8p n PRO 537 Cb 0.33 -1.50 0.06 0.00 -0.02 0.00 0.00 33.50 32.37 3k8p n PRO 537 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3k8p n ARG 538 N -1.43 0.90 0.17 -0.52 1.74 -1.26 -4.63 116.66 111.62 3k8p n ARG 538 Ca 0.02 -1.30 0.02 0.00 -0.77 0.00 0.00 57.85 55.82 3k8p n ARG 538 Cb 0.07 -1.22 0.33 0.00 -1.02 0.00 0.00 32.46 30.61 3k8p n ARG 538 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 3k8p h LEU 539 N 2.20 0.04 -1.93 0.55 5.85 -1.25 -2.77 115.31 118.00 3k8p h LEU 539 Ca 0.00 -0.01 0.06 0.00 0.84 0.00 0.00 57.88 58.77 3k8p h LEU 539 Cb 0.51 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.52 3k8p h LEU 539 CO 0.00 0.42 0.42 0.10 -0.34 0.00 0.00 178.44 179.04 3k8p h TYR 540 N 0.03 0.00 -0.00 1.25 -0.00 -1.82 0.35 116.97 116.78 3k8p h TYR 540 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.73 3k8p h TYR 540 Cb 0.71 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.44 3k8p h TYR 540 CO 0.00 0.00 -0.11 1.63 -0.00 0.00 0.00 178.16 179.68 3k8p n LYS 541 N -3.31 0.29 -2.84 0.10 5.02 -1.04 -4.35 118.16 112.02 3k8p n LYS 541 Ca 0.03 -0.07 -0.31 0.00 -2.02 0.00 0.00 58.31 55.94 3k8p n LYS 541 Cb 0.53 -1.50 -0.02 0.00 -0.02 0.00 0.00 35.03 34.02 3k8p n LYS 541 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 3k8p n ASP 542 N -1.29 5.41 -0.22 4.39 -0.08 0.12 -4.88 116.55 120.01 3k8p n ASP 542 Ca 0.10 -3.69 -0.03 0.00 -1.51 0.00 0.00 54.79 49.67 3k8p n ASP 542 Cb 0.30 -0.75 0.08 0.00 2.34 0.00 0.00 41.12 43.09 3k8p n ASP 542 CO 0.00 0.00 0.00 0.25 0.12 0.00 0.00 177.20 177.57 3k8p h LEU 543 N 3.37 0.55 -0.98 -2.67 5.85 -1.77 -2.21 115.31 117.44 3k8p h LEU 543 Ca 0.26 0.02 0.29 0.00 0.84 0.00 0.00 57.88 59.29 3k8p h LEU 543 Cb 0.44 -0.09 -0.18 0.00 0.37 0.00 0.00 40.66 41.20 3k8p h LEU 543 CO 0.93 0.37 0.13 -0.65 -0.34 0.00 0.00 178.44 178.88 3k8p h PRO 544 N 0.68 0.02 0.14 5.25 0.11 -1.96 -0.71 132.00 135.52 3k8p h PRO 544 Ca 0.27 -0.00 -0.36 0.00 0.11 0.00 0.00 66.00 66.03 3k8p h PRO 544 Cb 0.13 -0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.22 3k8p h PRO 544 CO -0.15 0.01 -1.89 1.79 -0.21 0.00 0.00 178.00 177.55 3k8p h THR 545 N 0.02 0.76 -0.01 -1.15 1.35 -1.82 -2.83 112.91 109.23 3k8p h THR 545 Ca 0.64 -2.43 0.00 0.00 -0.55 0.00 0.00 66.41 64.07 3k8p h THR 545 Cb 1.39 2.60 -0.00 0.00 -1.73 0.00 0.00 68.15 70.41 3k8p h THR 545 CO -0.88 0.87 0.01 0.00 -0.25 0.00 0.00 175.52 175.27 3k8p h THR 546 N 0.08 0.54 0.15 6.82 1.03 -1.30 -0.91 112.91 119.33 3k8p h THR 546 Ca -0.39 0.00 -0.29 0.00 -0.01 0.00 0.00 66.41 65.72 3k8p h THR 546 Cb 2.06 0.99 0.01 0.00 -1.07 0.00 0.00 68.15 70.14 3k8p h THR 546 CO 0.12 0.00 -1.36 0.50 -0.01 0.00 0.00 175.52 174.78 3k8p h LYS 547 N 0.00 0.32 0.00 0.00 3.64 -1.16 -2.27 116.57 117.10 3k8p h LYS 547 Ca 0.01 -0.54 -0.10 0.00 -1.27 0.00 0.00 60.65 58.74 3k8p h LYS 547 Cb 0.03 0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 32.04 3k8p h LYS 547 CO -0.00 1.24 -0.49 0.66 -2.27 0.00 0.00 179.45 178.59 3k8p h SER 548 N 0.09 0.00 0.32 4.20 4.64 -1.10 -2.18 113.55 119.52 3k8p h SER 548 Ca -0.18 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.12 3k8p h SER 548 Cb 2.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.11 3k8p h SER 548 CO 0.21 0.49 -0.15 -0.07 -0.87 0.00 0.00 176.83 176.43 3k8p h LEU 549 N 0.00 -0.36 -0.52 5.97 3.38 -1.19 0.04 115.31 122.63 3k8p h LEU 549 Ca -0.00 -0.09 0.02 0.00 0.09 0.00 0.00 57.88 57.89 3k8p h LEU 549 Cb 1.22 0.09 -0.03 0.00 0.09 0.00 0.00 40.66 42.03 3k8p h LEU 549 CO 0.06 -0.12 0.32 0.25 0.09 0.00 0.00 178.44 179.04 3k8p h LEU 550 N -0.60 0.52 0.00 1.67 5.85 -1.36 0.49 115.31 121.89 3k8p h LEU 550 Ca -0.04 0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.57 3k8p h LEU 550 Cb 0.43 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.34 3k8p h LEU 550 CO 0.07 0.37 -0.51 -0.26 -0.34 0.00 0.00 178.44 177.77 3k8p h PHE 551 N 0.64 0.00 -0.78 1.25 -1.00 -1.45 -2.17 116.94 113.42 3k8p h PHE 551 Ca 0.21 0.00 -0.05 0.00 2.81 0.00 0.00 57.97 60.94 3k8p h PHE 551 Cb 0.01 0.00 -0.03 0.00 3.61 0.00 0.00 35.95 39.53 3k8p h PHE 551 CO -0.06 0.51 0.31 0.78 -1.61 0.00 0.00 178.31 178.24 3k8p h GLY 552 N 3.49 1.26 1.40 -1.45 0.00 -0.47 -1.50 103.07 105.80 3k8p h GLY 552 Ca -0.01 -0.69 -0.10 0.00 0.00 0.00 0.00 47.33 46.54 3k8p h GLY 552 CO 0.07 0.65 -0.18 -2.22 0.00 0.00 0.00 176.54 174.86 3k8p h ILE 553 N 1.14 1.26 -0.45 2.60 2.04 -0.65 0.05 117.51 123.50 3k8p h ILE 553 Ca 0.26 -1.24 -0.05 0.00 1.00 0.00 0.00 64.86 64.83 3k8p h ILE 553 Cb 0.22 1.17 -0.02 0.00 -0.74 0.00 0.00 36.82 37.46 3k8p h ILE 553 CO -0.02 0.41 0.09 1.88 0.00 0.00 0.00 178.15 180.51 3k8p h TYR 554 N 0.62 0.79 0.02 1.37 -1.99 -1.19 -2.75 116.97 113.84 3k8p h TYR 554 Ca 0.10 -0.10 -0.18 0.00 2.00 0.00 0.00 58.73 60.54 3k8p h TYR 554 Cb 0.65 -0.22 0.02 0.00 2.00 0.00 0.00 36.73 39.18 3k8p h TYR 554 CO 0.03 0.74 -0.70 -0.44 -0.00 0.00 0.00 178.16 177.78 3k8p h ASP 555 N 0.61 0.59 -0.62 3.88 3.32 -1.12 0.72 116.42 123.81 3k8p h ASP 555 Ca 0.14 -0.78 -0.04 0.00 0.02 0.00 0.00 57.03 56.37 3k8p h ASP 555 Cb 0.36 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 39.70 3k8p h ASP 555 CO 0.01 1.29 0.23 0.28 -1.72 0.00 0.00 179.24 179.33 3k8p h SER 556 N -0.05 0.89 -0.58 6.45 0.02 -1.08 -2.49 113.55 116.71 3k8p h SER 556 Ca -0.09 -0.14 0.00 0.00 -0.84 0.00 0.00 61.79 60.72 3k8p h SER 556 Cb 1.42 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 63.73 3k8p h SER 556 CO 0.14 0.82 0.00 0.18 -1.14 0.00 0.00 176.83 176.83 3k8p n LEU 557 N -4.29 3.44 -3.99 5.07 4.32 -1.04 -4.78 117.00 115.73 3k8p n LEU 557 Ca 0.05 -1.73 -0.29 0.00 -0.02 0.00 0.00 56.01 54.03 3k8p n LEU 557 Cb 0.19 -0.44 -0.01 0.00 -1.62 0.00 0.00 43.42 41.55 3k8p n LEU 557 CO 0.40 0.76 -0.11 -1.20 -1.22 0.00 0.00 177.39 176.02 3k8p n SER 558 N 1.13 -1.90 -4.72 -1.43 7.64 -0.94 -4.93 113.62 108.47 3k8p n SER 558 Ca 0.20 -0.95 -0.41 0.00 1.01 0.00 0.00 58.87 58.72 3k8p n SER 558 Cb 0.58 -3.21 -0.04 0.00 -1.01 0.00 0.00 64.21 60.53 3k8p n SER 558 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 3k8p s ILE 559 N -3.65 4.91 0.36 0.44 1.01 0.25 -5.02 121.20 119.50 3k8p s ILE 559 Ca 0.30 1.70 -0.28 0.00 0.00 0.00 0.00 60.65 62.37 3k8p s ILE 559 Cb -0.16 -4.15 -0.12 0.00 0.01 0.00 0.00 42.46 38.04 3k8p s ILE 559 CO 0.88 0.25 1.41 -3.20 0.00 0.00 0.00 174.94 174.28 3k8p n ASN 560 N 3.59 3.34 -3.23 3.58 5.15 -1.26 -4.67 115.26 121.76 3k8p n ASN 560 Ca 0.01 1.22 -0.24 0.00 -0.60 0.00 0.00 54.58 54.96 3k8p n ASN 560 Cb 0.51 -1.56 -0.07 0.00 -0.53 0.00 0.00 39.78 38.13 3k8p n ASN 560 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 3k8p n ARG 561 N 0.57 0.86 -1.46 1.20 1.74 -1.26 -5.01 116.66 113.31 3k8p n ARG 561 Ca 0.03 -3.36 -0.41 0.00 -0.77 0.00 0.00 57.85 53.33 3k8p n ARG 561 Cb 0.37 -1.34 -0.04 0.00 -1.02 0.00 0.00 32.46 30.43 3k8p n ARG 561 CO 0.00 0.00 0.00 -0.85 -1.52 0.00 0.00 177.63 175.26 3k8p n GLU 562 N 1.44 1.90 -1.11 5.56 0.00 -1.26 -3.94 120.64 123.23 3k8p n GLU 562 Ca 0.22 -2.16 -0.08 0.00 0.00 0.00 0.00 57.16 55.14 3k8p n GLU 562 Cb 0.51 -3.12 -0.03 0.00 0.00 0.00 0.00 31.44 28.80 3k8p n GLU 562 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3k8p n GLY 563 N 4.62 0.78 0.30 -1.84 0.00 -1.26 -4.73 105.19 103.06 3k8p n GLY 563 Ca 0.50 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.57 3k8p n GLY 563 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3k8p n GLN 564 N -0.73 1.38 0.17 1.61 1.13 -1.25 -3.79 117.38 115.89 3k8p n GLN 564 Ca -0.08 -0.58 0.05 0.00 -1.94 0.00 0.00 57.00 54.45 3k8p n GLN 564 Cb 0.44 -1.22 0.13 0.00 0.11 0.00 0.00 30.24 29.69 3k8p n GLN 564 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3k8p h THR 565 N 1.04 0.67 0.30 5.09 1.03 -1.85 -0.52 112.91 118.68 3k8p h THR 565 Ca 0.00 -1.83 -0.01 0.00 -0.01 0.00 0.00 66.41 64.56 3k8p h THR 565 Cb 0.23 2.24 0.00 0.00 -1.07 0.00 0.00 68.15 69.55 3k8p h THR 565 CO 0.00 0.37 -0.14 1.23 -0.01 0.00 0.00 175.52 176.96 3k8p h GLY 566 N 3.30 -0.42 0.37 2.99 0.00 -1.98 -2.18 103.07 105.16 3k8p h GLY 566 Ca -0.00 0.16 0.07 0.00 0.00 0.00 0.00 47.33 47.55 3k8p h GLY 566 CO 0.05 -0.15 -0.00 1.70 0.00 0.00 0.00 176.54 178.14 3k8p h LYS 567 N -0.62 0.10 -0.42 4.80 3.11 -1.79 -2.63 116.57 119.12 3k8p h LYS 567 Ca -0.04 -0.01 0.03 0.00 -2.81 0.00 0.00 60.65 57.83 3k8p h LYS 567 Cb 0.44 -0.02 -0.04 0.00 -1.00 0.00 0.00 32.23 31.61 3k8p h LYS 567 CO 0.07 0.07 0.21 0.28 -2.81 0.00 0.00 179.45 177.27 3k8p h VAL 568 N 0.10 0.98 -0.81 2.00 2.07 -1.09 -0.85 116.25 118.66 3k8p h VAL 568 Ca 0.19 -0.15 0.11 0.00 0.82 0.00 0.00 66.70 67.67 3k8p h VAL 568 Cb 0.27 0.51 -0.08 0.00 -1.52 0.00 0.00 31.29 30.47 3k8p h VAL 568 CO -0.32 0.08 0.44 -0.33 0.02 0.00 0.00 177.57 177.45 3k8p h GLU 569 N 0.43 0.68 0.14 1.57 5.08 -1.17 -0.76 114.58 120.55 3k8p h GLU 569 Ca 0.18 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.49 3k8p h GLU 569 Cb 0.08 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.18 3k8p h GLU 569 CO -0.13 0.45 -0.06 0.28 -1.00 0.00 0.00 179.01 178.55 3k8p h VAL 570 N 0.70 0.96 -0.84 3.13 2.07 -0.92 -2.48 116.25 118.86 3k8p h VAL 570 Ca 0.41 -0.37 0.12 0.00 0.82 0.00 0.00 66.70 67.68 3k8p h VAL 570 Cb 0.45 1.19 -0.06 0.00 -1.52 0.00 0.00 31.29 31.34 3k8p h VAL 570 CO -0.29 0.09 0.54 0.44 0.02 0.00 0.00 177.57 178.38 3k8p h ASP 571 N -0.35 0.63 0.00 0.57 3.32 -0.89 -0.27 116.42 119.43 3k8p h ASP 571 Ca -0.02 0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.06 3k8p h ASP 571 Cb 0.28 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.73 3k8p h ASP 571 CO 0.03 0.35 0.00 -0.11 -1.72 0.00 0.00 179.24 177.79 3k8p n LEU 572 N -4.53 0.26 0.00 1.55 7.94 -0.32 -2.55 117.00 119.35 3k8p n LEU 572 Ca 0.15 -0.13 0.00 0.00 -1.11 0.00 0.00 56.01 54.92 3k8p n LEU 572 Cb 0.41 -0.10 0.00 0.00 0.53 0.00 0.00 43.42 44.26 3k8p n LEU 572 CO 0.31 0.06 0.00 0.52 -1.11 0.00 0.00 177.39 177.17 3k8p n VAL 574 N 0.46 0.00 -0.21 1.96 0.31 -0.11 -2.45 118.33 118.29 3k8p n VAL 574 Ca 0.00 0.00 -0.06 0.00 -0.01 0.00 0.00 64.34 64.27 3k8p n VAL 574 Cb 0.06 0.00 0.04 0.00 -0.91 0.00 0.00 33.84 33.02 3k8p n VAL 574 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 3k8p h LEU 575 N 0.00 0.71 -1.17 7.52 3.38 -1.75 -0.23 115.31 123.77 3k8p h LEU 575 Ca 0.00 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 3k8p h LEU 575 Cb 0.00 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.54 3k8p h LEU 575 CO 0.00 0.53 0.41 0.45 0.09 0.00 0.00 178.44 179.93 3k8p h HIS 576 N 0.82 0.95 -0.10 1.13 3.86 -1.78 -1.69 115.15 118.34 3k8p h HIS 576 Ca 0.22 -0.01 -0.01 0.00 -1.16 0.00 0.00 60.37 59.42 3k8p h HIS 576 Cb -0.07 -0.31 -0.00 0.00 1.06 0.00 0.00 27.41 28.09 3k8p h HIS 576 CO -0.03 0.65 0.04 0.82 0.86 0.00 0.00 177.93 180.27 3k8p h ILE 577 N 0.99 1.16 -0.68 2.45 2.04 -1.75 0.16 117.51 121.88 3k8p h ILE 577 Ca 0.26 -0.47 0.15 0.00 1.00 0.00 0.00 64.86 65.80 3k8p h ILE 577 Cb -0.01 1.28 -0.12 0.00 -0.74 0.00 0.00 36.82 37.23 3k8p h ILE 577 CO -0.05 0.14 -0.02 0.44 0.00 0.00 0.00 178.15 178.66 3k8p h ASP 578 N -0.01 -0.36 1.33 1.72 5.19 -0.25 -1.61 116.42 122.44 3k8p h ASP 578 Ca 0.03 0.18 -0.04 0.00 -0.62 0.00 0.00 57.03 56.58 3k8p h ASP 578 Cb 0.18 0.32 -0.01 0.00 0.18 0.00 0.00 39.33 40.01 3k8p h ASP 578 CO -0.00 -0.16 -0.69 1.88 -3.12 0.00 0.00 179.24 177.15 3k8p h TYR 579 N 0.09 0.00 -0.41 4.55 -1.99 -1.17 -2.39 116.97 115.65 3k8p h TYR 579 Ca 0.36 0.00 -0.03 0.00 2.00 0.00 0.00 58.73 61.06 3k8p h TYR 579 Cb 0.60 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 39.31 3k8p h TYR 579 CO -0.42 0.16 0.13 0.00 -0.00 0.00 0.00 178.16 178.03 3k8p h ALA 580 N 1.84 0.54 -0.21 3.88 0.00 -0.34 -0.52 119.26 124.45 3k8p h ALA 580 Ca -0.03 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.70 3k8p h ALA 580 Cb 1.14 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 3k8p h ALA 580 CO 0.02 0.18 0.05 -0.07 0.00 0.00 0.00 179.25 179.42 3k8p h LEU 581 N 0.52 0.32 -0.97 0.00 3.38 -1.27 0.19 115.31 117.47 3k8p h LEU 581 Ca 0.13 -0.23 0.23 0.00 0.09 0.00 0.00 57.88 58.10 3k8p h LEU 581 Cb 0.25 -0.08 -0.12 0.00 0.09 0.00 0.00 40.66 40.80 3k8p h LEU 581 CO -0.01 0.47 0.54 0.58 0.09 0.00 0.00 178.44 180.12 3k8p h VAL 582 N 0.15 0.55 -0.45 1.22 2.07 -1.36 0.37 116.25 118.80 3k8p h VAL 582 Ca 0.07 -0.19 -0.05 0.00 0.82 0.00 0.00 66.70 67.34 3k8p h VAL 582 Cb 0.27 -0.06 -0.03 0.00 -1.52 0.00 0.00 31.29 29.95 3k8p h VAL 582 CO 0.00 0.10 0.06 0.59 0.02 0.00 0.00 177.57 178.35 3k8p n ASN 583 N -4.91 4.27 -2.91 0.57 3.02 -0.21 -4.92 115.26 110.17 3k8p n ASN 583 Ca 0.25 -2.73 -0.22 0.00 -0.03 0.00 0.00 54.58 51.85 3k8p n ASN 583 Cb 0.69 -0.65 0.03 0.00 -0.61 0.00 0.00 39.78 39.24 3k8p n ASN 583 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 3k8p n LEU 584 N 0.30 -2.63 -3.75 3.41 4.77 0.13 -4.93 117.00 114.30 3k8p n LEU 584 Ca 0.23 -0.26 -0.29 0.00 -0.03 0.00 0.00 56.01 55.66 3k8p n LEU 584 Cb 0.98 -2.94 -0.10 0.00 -2.33 0.00 0.00 43.42 39.03 3k8p n LEU 584 CO 0.26 0.20 0.07 -0.67 -1.33 0.00 0.00 177.39 175.91 3k8p n ASP 585 N -2.40 3.47 -0.26 -1.43 2.03 0.56 -4.93 116.55 113.60 3k8p n ASP 585 Ca -0.12 -3.30 0.08 0.00 0.52 0.00 0.00 54.79 51.97 3k8p n ASP 585 Cb 0.62 -0.76 0.33 0.00 -0.72 0.00 0.00 41.12 40.59 3k8p n ASP 585 CO 0.00 0.00 0.00 0.15 -1.92 0.00 0.00 177.20 175.43 3k8p h PHE 586 N 5.01 0.88 -0.02 -0.67 3.57 -1.92 -2.44 116.94 121.35 3k8p h PHE 586 Ca 0.17 0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.72 3k8p h PHE 586 Cb 0.72 -0.28 -0.04 0.00 2.79 0.00 0.00 35.95 39.14 3k8p h PHE 586 CO 0.71 0.40 -0.19 0.78 -2.23 0.00 0.00 178.31 177.79 3k8p h GLY 587 N 0.81 -0.24 1.09 2.40 0.00 -1.96 0.17 103.07 105.35 3k8p h GLY 587 Ca 0.39 0.22 -0.10 0.00 0.00 0.00 0.00 47.33 47.84 3k8p h GLY 587 CO -0.16 -0.17 -0.04 -0.84 0.00 0.00 0.00 176.54 175.33 3k8p h THR 588 N -0.30 1.27 -0.32 4.70 2.02 -1.93 -1.79 112.91 116.55 3k8p h THR 588 Ca 0.06 -1.20 0.07 0.00 0.77 0.00 0.00 66.41 66.11 3k8p h THR 588 Cb 0.38 0.85 -0.07 0.00 -1.74 0.00 0.00 68.15 67.57 3k8p h THR 588 CO -0.19 0.43 -0.13 0.00 0.37 0.00 0.00 175.52 176.01 3k8p h ALA 589 N 0.97 0.14 -0.27 6.16 0.00 -0.98 -2.22 119.26 123.07 3k8p h ALA 589 Ca 0.16 0.12 -0.06 0.00 0.00 0.00 0.00 54.91 55.14 3k8p h ALA 589 Cb 0.61 0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 3k8p h ALA 589 CO 0.04 -0.51 -0.05 -0.92 0.00 0.00 0.00 179.25 177.80 3k8p h TYR 590 N -0.07 0.58 -0.28 0.00 3.20 -0.33 0.10 116.97 120.17 3k8p h TYR 590 Ca 0.16 -0.12 0.05 0.00 3.14 0.00 0.00 58.73 61.96 3k8p h TYR 590 Cb 0.32 -0.14 -0.05 0.00 1.54 0.00 0.00 36.73 38.40 3k8p h TYR 590 CO -0.34 0.71 -0.02 0.93 -1.64 0.00 0.00 178.16 177.80 3k8p h GLU 591 N 0.27 0.05 -0.04 1.82 5.08 -1.26 0.17 114.58 120.68 3k8p h GLU 591 Ca 0.07 -0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.44 3k8p h GLU 591 Cb 0.52 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.74 3k8p h GLU 591 CO 0.02 0.04 -0.06 -0.07 -1.00 0.00 0.00 179.01 177.94 3k8p h LEU 592 N 0.06 -0.18 -1.50 1.33 3.38 -1.26 -0.67 115.31 116.47 3k8p h LEU 592 Ca 0.13 0.03 0.12 0.00 0.09 0.00 0.00 57.88 58.26 3k8p h LEU 592 Cb 0.19 0.09 -0.05 0.00 0.09 0.00 0.00 40.66 40.97 3k8p h LEU 592 CO -0.24 -0.08 0.49 1.23 0.09 0.00 0.00 178.44 179.92 3k8p h GLY 593 N -0.08 0.82 1.33 0.83 0.00 -0.40 0.16 103.07 105.72 3k8p h GLY 593 Ca 0.04 -0.22 -0.25 0.00 0.00 0.00 0.00 47.33 46.89 3k8p h GLY 593 CO -0.09 0.11 -1.01 1.70 0.00 0.00 0.00 176.54 177.24 3k8p h LYS 594 N 0.53 0.60 -0.09 4.80 3.64 -0.25 -2.69 116.57 123.10 3k8p h LYS 594 Ca 0.35 -0.65 -0.14 0.00 -1.27 0.00 0.00 60.65 58.94 3k8p h LYS 594 Cb 0.63 0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 32.63 3k8p h LYS 594 CO -0.12 1.25 -0.55 0.37 -2.27 0.00 0.00 179.45 178.13 3k8p h GLN 595 N 0.34 0.28 -0.19 1.90 4.15 -0.26 -2.69 115.11 118.63 3k8p h GLN 595 Ca -0.11 -0.17 -0.04 0.00 0.77 0.00 0.00 58.65 59.09 3k8p h GLN 595 Cb 1.66 0.02 -0.01 0.00 0.21 0.00 0.00 27.48 29.37 3k8p h GLN 595 CO 0.19 0.75 -0.05 0.28 -1.93 0.00 0.00 178.83 178.07 3k8p h VAL 596 N 0.21 1.29 -0.88 2.39 2.07 -0.73 -1.74 116.25 118.86 3k8p h VAL 596 Ca 0.00 -1.05 0.11 0.00 0.82 0.00 0.00 66.70 66.58 3k8p h VAL 596 Cb 1.03 1.60 -0.07 0.00 -1.52 0.00 0.00 31.29 32.33 3k8p h VAL 596 CO 0.09 0.32 0.57 -0.26 0.02 0.00 0.00 177.57 178.30 3k8p h PHE 597 N 0.08 0.91 0.53 1.57 0.05 -1.40 -1.73 116.94 116.96 3k8p h PHE 597 Ca 0.05 0.03 -0.03 0.00 3.82 0.00 0.00 57.97 61.84 3k8p h PHE 597 Cb 0.51 -0.29 0.01 0.00 2.00 0.00 0.00 35.95 38.17 3k8p h PHE 597 CO 0.05 0.40 -0.25 0.93 -0.18 0.00 0.00 178.31 179.26 3k8p h GLU 598 N 0.83 -0.68 -0.97 1.51 5.08 -1.31 -0.84 114.58 118.20 3k8p h GLU 598 Ca 0.42 0.05 0.30 0.00 -1.00 0.00 0.00 59.36 59.13 3k8p h GLU 598 Cb 0.48 0.16 -0.17 0.00 0.50 0.00 0.00 28.75 29.71 3k8p h GLU 598 CO -0.18 -0.46 0.20 0.82 -1.00 0.00 0.00 179.01 178.39 3k8p h ILE 599 N -1.17 0.07 -0.30 3.13 2.04 -1.19 0.35 117.51 120.44 3k8p h ILE 599 Ca -0.07 -0.02 -0.15 0.00 1.00 0.00 0.00 64.86 65.62 3k8p h ILE 599 Cb 0.54 0.02 -0.01 0.00 -0.74 0.00 0.00 36.82 36.63 3k8p h ILE 599 CO 0.12 0.01 -0.41 0.00 0.00 0.00 0.00 178.15 177.87 3k8p h GLN 601 N 0.59 0.65 0.19 0.00 4.20 0.12 -2.02 115.11 118.84 3k8p h GLN 601 Ca 0.05 -0.04 -0.01 0.00 0.06 0.00 0.00 58.65 58.71 3k8p h GLN 601 Cb 0.96 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 28.59 3k8p h GLN 601 CO 0.09 0.43 -0.09 0.93 -0.67 0.00 0.00 178.83 179.51 3k8p h GLU 602 N 0.67 -0.25 -0.54 1.46 5.08 -1.34 -3.07 114.58 116.59 3k8p h GLU 602 Ca 0.31 0.02 0.16 0.00 -1.00 0.00 0.00 59.36 58.84 3k8p h GLU 602 Cb 0.22 0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.50 3k8p h GLU 602 CO -0.20 0.16 0.98 0.00 -1.00 0.00 0.00 179.01 178.95 3k8p h ALA 603 N -0.18 2.41 0.00 3.43 0.00 -1.08 -3.46 119.26 120.40 3k8p h ALA 603 Ca -0.03 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3k8p h ALA 603 Cb 0.52 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.35 3k8p h ALA 603 CO 0.04 -1.25 0.00 0.41 0.00 0.00 0.00 179.25 178.45 3k8p n GLY 604 N -1.58 -3.22 0.28 0.00 0.00 -0.78 -4.66 105.19 95.23 3k8p n GLY 604 Ca 0.12 -2.12 0.08 0.00 0.00 0.00 0.00 46.02 44.10 3k8p n GLY 604 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3k8p h GLN 605 N 0.78 0.10 -4.61 1.61 1.08 -1.85 -3.44 115.11 108.78 3k8p h GLN 605 Ca 0.00 -0.01 -0.38 0.00 -1.45 0.00 0.00 58.65 56.81 3k8p h GLN 605 Cb 0.00 -0.02 0.09 0.00 -0.05 0.00 0.00 27.48 27.50 3k8p h GLN 605 CO 0.00 0.07 1.29 1.58 -0.95 0.00 0.00 178.83 180.82 3k8p n HIS 606 N -4.52 0.08 0.00 2.96 -0.00 -1.26 -4.59 115.22 107.89 3k8p n HIS 606 Ca -0.01 -0.56 0.00 0.00 0.46 0.00 0.00 57.72 57.61 3k8p n HIS 606 Cb 0.13 -0.74 0.00 0.00 -0.12 0.00 0.00 29.99 29.26 3k8p n HIS 606 CO 0.00 0.00 0.00 1.17 0.46 0.00 0.00 176.34 177.97 3k8p n LYS 609 N 6.86 0.00 -0.02 1.57 4.81 -1.26 -4.66 118.16 125.45 3k8p n LYS 609 Ca 0.31 0.00 -0.12 0.00 -0.87 0.00 0.00 58.31 57.62 3k8p n LYS 609 Cb 0.27 -0.18 -0.08 0.00 0.02 0.00 0.00 35.03 35.06 3k8p n LYS 609 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3k8p h ALA 610 N 0.00 0.09 -0.77 3.14 0.00 -1.94 0.89 119.26 120.67 3k8p h ALA 610 Ca 0.00 -0.20 0.13 0.00 0.00 0.00 0.00 54.91 54.84 3k8p h ALA 610 Cb 0.00 -0.02 -0.09 0.00 0.00 0.00 0.00 17.79 17.68 3k8p h ALA 610 CO 0.00 -0.21 0.37 1.25 0.00 0.00 0.00 179.25 180.66 3k8p h LEU 611 N -0.20 0.43 0.48 0.00 5.85 -1.94 -1.74 115.31 118.19 3k8p h LEU 611 Ca 0.02 0.09 -0.02 0.00 0.84 0.00 0.00 57.88 58.80 3k8p h LEU 611 Cb 0.39 0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.45 3k8p h LEU 611 CO 0.01 0.20 -0.23 1.23 -0.34 0.00 0.00 178.44 179.30 3k8p h GLY 612 N 0.56 -0.68 1.66 3.75 0.00 -1.63 -1.31 103.07 105.42 3k8p h GLY 612 Ca 0.41 0.25 -0.00 0.00 0.00 0.00 0.00 47.33 47.99 3k8p h GLY 612 CO -0.34 -0.25 0.19 -0.55 0.00 0.00 0.00 176.54 175.59 3k8p h ASP 613 N -0.96 0.40 0.23 0.19 3.32 -0.66 -2.56 116.42 116.37 3k8p h ASP 613 Ca -0.07 -0.02 -0.35 0.00 0.02 0.00 0.00 57.03 56.62 3k8p h ASP 613 Cb 0.59 -0.10 -0.03 0.00 0.22 0.00 0.00 39.33 40.01 3k8p h ASP 613 CO 0.11 0.32 -1.94 -0.62 -1.72 0.00 0.00 179.24 175.39 3k8p n GLU 614 N -4.45 0.72 0.00 3.56 1.02 -0.67 -4.68 120.64 116.14 3k8p n GLU 614 Ca 0.02 0.26 0.00 0.00 -0.02 0.00 0.00 57.16 57.42 3k8p n GLU 614 Cb 0.09 -1.72 0.00 0.00 -0.02 0.00 0.00 31.44 29.79 3k8p n GLU 614 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 3k8p n HIS 615 N -3.33 0.00 -0.20 -0.32 8.25 -0.50 -4.75 115.22 114.38 3k8p n HIS 615 Ca -0.28 -0.13 0.18 0.00 -0.26 0.00 0.00 57.72 57.23 3k8p n HIS 615 Cb 1.05 -0.01 0.53 0.00 1.12 0.00 0.00 29.99 32.68 3k8p n HIS 615 CO 0.00 0.00 0.00 0.11 0.64 0.00 0.00 176.34 177.09 3k8p h TRP 616 N 0.00 0.45 -0.35 4.41 5.08 -1.52 -2.07 115.95 121.95 3k8p h TRP 616 Ca 0.00 0.01 -0.04 0.00 1.08 0.00 0.00 58.89 59.94 3k8p h TRP 616 Cb 0.16 -0.14 -0.02 0.00 -3.00 0.00 0.00 29.16 26.16 3k8p h TRP 616 CO 0.00 0.14 0.05 1.25 -1.28 0.00 0.00 178.44 178.60 3k8p h LEU 617 N 0.36 0.49 -0.41 0.11 5.85 -1.87 0.73 115.31 120.57 3k8p h LEU 617 Ca 0.42 -0.08 -0.02 0.00 0.84 0.00 0.00 57.88 59.04 3k8p h LEU 617 Cb 1.08 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.97 3k8p h LEU 617 CO -0.13 0.52 0.17 0.74 -0.34 0.00 0.00 178.44 179.41 3k8p h THR 618 N 0.51 1.19 -0.19 1.05 2.02 -1.74 -0.76 112.91 114.99 3k8p h THR 618 Ca 0.12 -0.58 -0.18 0.00 0.77 0.00 0.00 66.41 66.54 3k8p h THR 618 Cb 0.26 0.81 -0.00 0.00 -1.74 0.00 0.00 68.15 67.47 3k8p h THR 618 CO 0.00 0.21 -0.61 -0.26 0.37 0.00 0.00 175.52 175.24 3k8p h PHE 619 N 0.52 0.83 -0.62 3.16 -1.00 -1.41 -2.92 116.94 115.51 3k8p h PHE 619 Ca 0.14 -0.31 -0.00 0.00 2.81 0.00 0.00 57.97 60.60 3k8p h PHE 619 Cb 0.17 -0.15 -0.03 0.00 3.61 0.00 0.00 35.95 39.55 3k8p h PHE 619 CO -0.00 1.09 0.38 -0.92 -1.61 0.00 0.00 178.31 177.25 3k8p h TYR 620 N 0.48 0.80 0.00 -0.55 3.20 -0.84 -0.68 116.97 119.38 3k8p h TYR 620 Ca -0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 3k8p h TYR 620 Cb 1.18 -0.27 0.00 0.00 1.54 0.00 0.00 36.73 39.19 3k8p h TYR 620 CO 0.06 0.53 0.00 1.04 -1.64 0.00 0.00 178.16 178.15 3k8p n GLN 621 N -4.62 0.23 0.00 1.82 6.02 -0.30 -1.29 117.38 119.24 3k8p n GLN 621 Ca 0.04 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.03 3k8p n GLN 621 Cb 0.04 -1.39 0.00 0.00 1.02 0.00 0.00 30.24 29.92 3k8p n GLN 621 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3k8p n GLY 623 N 1.08 0.00 0.64 1.08 0.00 -0.26 -1.19 105.19 106.54 3k8p n GLY 623 Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.12 3k8p n GLY 623 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3k8p n LYS 624 N 0.00 1.67 -1.83 1.61 4.81 -0.41 -4.91 118.16 119.09 3k8p n LYS 624 Ca 0.00 -1.33 -0.41 0.00 -0.87 0.00 0.00 58.31 55.70 3k8p n LYS 624 Cb 0.00 -1.41 -0.01 0.00 0.02 0.00 0.00 35.03 33.63 3k8p n LYS 624 CO 0.00 0.00 0.00 0.12 1.17 0.00 0.00 177.40 178.69 3k8p s PHE 625 N -2.05 2.68 -0.09 5.64 5.36 -0.34 -5.02 117.98 124.16 3k8p s PHE 625 Ca 0.21 1.09 -0.01 0.00 -0.96 0.00 0.00 56.93 57.26 3k8p s PHE 625 Cb 0.17 -4.00 0.03 0.00 -0.34 0.00 0.00 43.02 38.88 3k8p s PHE 625 CO 0.40 -3.03 -0.05 0.08 -1.46 0.00 0.00 175.22 171.16 3k8p s VAL 626 N -0.81 0.76 -0.21 3.12 1.01 -1.26 -5.10 120.40 117.91 3k8p s VAL 626 Ca 0.55 -0.13 -0.23 0.00 0.00 0.00 0.00 61.98 62.16 3k8p s VAL 626 Cb -0.46 -0.82 -0.01 0.00 0.00 0.00 0.00 36.38 35.08 3k8p s VAL 626 CO 0.58 0.32 0.76 -0.62 0.00 0.00 0.00 175.10 176.13 3k8p s ASP 627 N 1.70 6.80 0.41 3.32 -1.08 -1.26 -4.93 116.67 121.64 3k8p s ASP 627 Ca 0.03 0.99 0.10 0.00 -0.52 0.00 0.00 52.55 53.15 3k8p s ASP 627 Cb -0.13 -2.41 0.87 0.00 -1.46 0.00 0.00 42.92 39.80 3k8p s ASP 627 CO -0.06 -0.41 1.98 -0.65 0.52 0.00 0.00 175.17 176.55 3k8p h PRO 628 N 7.56 0.26 0.00 4.34 0.11 -2.00 -2.42 132.00 139.86 3k8p h PRO 628 Ca -0.27 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.79 3k8p h PRO 628 Cb 1.12 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.19 3k8p h PRO 628 CO 0.83 0.32 0.00 0.09 -0.21 0.00 0.00 178.00 179.02 3k8p n ASN 629 N -4.35 0.08 -4.61 -2.05 5.03 -1.26 -4.79 115.26 103.31 3k8p n ASN 629 Ca -0.00 0.51 -0.53 0.00 0.87 0.00 0.00 54.58 55.43 3k8p n ASN 629 Cb 0.20 -0.53 -0.06 0.00 -1.02 0.00 0.00 39.78 38.37 3k8p n ASN 629 CO 0.00 0.00 0.00 0.79 -1.83 0.00 0.00 177.26 176.22 3k8p n TRP 630 N -1.58 1.58 -1.61 3.10 8.01 -0.91 -4.82 117.44 121.21 3k8p n TRP 630 Ca 0.05 0.63 -0.51 0.00 -1.31 0.00 0.00 57.50 56.37 3k8p n TRP 630 Cb 0.27 -2.35 -0.06 0.00 -2.01 0.00 0.00 31.31 27.17 3k8p n TRP 630 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.69 176.96 3k8p n VAL 631 N 2.85 0.38 -1.09 -0.99 0.31 -1.26 -1.49 118.33 117.04 3k8p n VAL 631 Ca 0.20 -0.16 -0.03 0.00 -0.01 0.00 0.00 64.34 64.34 3k8p n VAL 631 Cb 0.18 -1.68 -0.01 0.00 -0.91 0.00 0.00 33.84 31.41 3k8p n VAL 631 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 3k8p n ASP 632 N 7.64 -3.56 -1.40 4.52 8.00 -1.26 -3.08 116.55 127.42 3k8p n ASP 632 Ca 0.30 0.08 -0.16 0.00 0.71 0.00 0.00 54.79 55.71 3k8p n ASP 632 Cb 0.24 -1.33 -0.07 0.00 -0.02 0.00 0.00 41.12 39.94 3k8p n ASP 632 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3k8p n ASN 633 N 0.85 -4.62 -4.82 -2.24 3.02 -0.56 -4.96 115.26 101.93 3k8p n ASN 633 Ca -0.03 0.40 -0.36 0.00 -0.03 0.00 0.00 54.58 54.56 3k8p n ASN 633 Cb 0.13 -4.05 -0.07 0.00 -0.61 0.00 0.00 39.78 35.18 3k8p n ASN 633 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 3k8p s GLU 634 N -3.35 3.72 0.11 3.52 2.56 -1.18 -5.03 118.70 119.06 3k8p s GLU 634 Ca 0.00 -0.16 -0.31 0.00 0.00 0.00 0.00 54.97 54.49 3k8p s GLU 634 Cb 0.00 -3.28 -0.09 0.00 2.00 0.00 0.00 34.13 32.77 3k8p s GLU 634 CO 0.00 0.60 1.57 0.42 -0.56 0.00 0.00 175.26 177.29 3k8p s ILE 635 N -0.50 2.93 0.39 -3.70 1.01 -1.26 -4.66 121.20 115.40 3k8p s ILE 635 Ca 0.12 0.55 -0.27 0.00 0.00 0.00 0.00 60.65 61.06 3k8p s ILE 635 Cb -0.12 -3.36 -0.09 0.00 0.01 0.00 0.00 42.46 38.91 3k8p s ILE 635 CO 0.02 0.02 1.31 -2.84 0.00 0.00 0.00 174.94 173.45 3k8p s PRO 636 N 1.82 4.05 0.25 2.79 0.02 -1.26 -4.82 135.00 137.86 3k8p s PRO 636 Ca 0.71 2.18 -0.03 0.00 0.02 0.00 0.00 61.00 63.87 3k8p s PRO 636 Cb -0.41 -2.82 0.40 0.00 0.02 0.00 0.00 34.50 31.69 3k8p s PRO 636 CO 0.31 -0.44 1.85 1.15 -0.33 0.00 0.00 177.00 179.55 3k8p h THR 637 N 2.59 1.01 0.00 0.99 2.02 -1.93 0.92 112.91 118.51 3k8p h THR 637 Ca -0.49 -0.34 -0.05 0.00 0.77 0.00 0.00 66.41 66.29 3k8p h THR 637 Cb 1.24 -0.07 -0.01 0.00 -1.74 0.00 0.00 68.15 67.58 3k8p h THR 637 CO 0.63 0.18 -0.24 1.05 0.37 0.00 0.00 175.52 177.51 3k8p h GLU 638 N 0.99 0.00 0.04 6.66 4.11 -1.90 -2.51 114.58 121.98 3k8p h GLU 638 Ca 0.41 0.00 -0.15 0.00 0.07 0.00 0.00 59.36 59.69 3k8p h GLU 638 Cb 0.26 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.52 3k8p h GLU 638 CO -0.20 0.24 -0.63 0.82 0.07 0.00 0.00 179.01 179.31 3k8p h ILE 639 N 0.00 1.47 -0.67 -1.06 2.04 -1.22 -2.38 117.51 115.70 3k8p h ILE 639 Ca -0.00 -2.21 0.12 0.00 1.00 0.00 0.00 64.86 63.76 3k8p h ILE 639 Cb 0.49 2.81 -0.12 0.00 -0.74 0.00 0.00 36.82 39.26 3k8p h ILE 639 CO 0.03 0.63 -0.31 0.40 0.00 0.00 0.00 178.15 178.90 3k8p h ILE 640 N -0.23 0.17 -0.10 -0.67 2.04 -1.04 0.23 117.51 117.91 3k8p h ILE 640 Ca -0.09 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.77 3k8p h ILE 640 Cb 1.38 0.17 -0.00 0.00 -0.74 0.00 0.00 36.82 37.63 3k8p h ILE 640 CO 0.12 0.00 0.07 0.58 0.00 0.00 0.00 178.15 178.92 3k8p h VAL 641 N -0.11 1.03 -0.25 1.67 2.07 -1.46 -2.69 116.25 116.51 3k8p h VAL 641 Ca 0.27 -0.05 0.03 0.00 0.82 0.00 0.00 66.70 67.76 3k8p h VAL 641 Cb 0.55 0.88 -0.03 0.00 -1.52 0.00 0.00 31.29 31.18 3k8p h VAL 641 CO -0.73 0.03 0.08 -0.07 0.02 0.00 0.00 177.57 176.90 3k8p h LEU 642 N 0.13 0.09 -2.10 2.57 3.38 -0.80 -1.99 115.31 116.60 3k8p h LEU 642 Ca 0.04 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.03 3k8p h LEU 642 Cb -0.01 0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.75 3k8p h LEU 642 CO -0.01 0.09 0.00 0.00 0.09 0.00 0.00 178.44 178.61 3k8p n GLN 643 N -5.04 0.00 0.00 1.13 6.02 0.73 -1.36 117.38 118.87 3k8p n GLN 643 Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.98 3k8p n GLN 643 Cb 0.09 -1.34 0.00 0.00 1.02 0.00 0.00 30.24 30.01 3k8p n GLN 643 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 3k8p n SER 645 N 0.91 0.00 -0.11 1.08 2.88 -0.75 -1.89 113.62 115.74 3k8p n SER 645 Ca 0.00 0.00 -0.06 0.00 -1.33 0.00 0.00 58.87 57.48 3k8p n SER 645 Cb 0.00 0.00 0.02 0.00 -0.75 0.00 0.00 64.21 63.48 3k8p n SER 645 CO 0.00 0.00 0.00 0.40 -1.23 0.00 0.00 175.04 174.21 3k8p h ILE 646 N 0.00 0.84 -0.75 2.46 2.04 -1.50 -0.16 117.51 120.44 3k8p h ILE 646 Ca 0.00 -0.07 -0.01 0.00 1.00 0.00 0.00 64.86 65.78 3k8p h ILE 646 Cb 0.00 0.60 -0.04 0.00 -0.74 0.00 0.00 36.82 36.65 3k8p h ILE 646 CO 0.00 0.04 0.43 -0.07 0.00 0.00 0.00 178.15 178.55 3k8p h LEU 647 N 0.22 0.91 -0.79 1.44 3.38 -1.65 0.18 115.31 119.00 3k8p h LEU 647 Ca 0.17 -0.06 -0.12 0.00 0.09 0.00 0.00 57.88 57.95 3k8p h LEU 647 Cb 0.18 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 3k8p h LEU 647 CO -0.21 0.72 -0.41 1.23 0.09 0.00 0.00 178.44 179.87 3k8p h GLY 648 N 1.07 0.46 1.68 0.83 0.00 -1.71 -0.52 103.07 104.89 3k8p h GLY 648 Ca 0.27 -0.45 -0.12 0.00 0.00 0.00 0.00 47.33 47.03 3k8p h GLY 648 CO -0.05 0.40 -0.43 3.21 0.00 0.00 0.00 176.54 179.68 3k8p h ARG 649 N 0.35 0.36 0.00 4.80 3.08 -0.37 -3.00 114.38 119.60 3k8p h ARG 649 Ca 0.03 -0.18 -0.07 0.00 0.07 0.00 0.00 59.98 59.83 3k8p h ARG 649 Cb 0.87 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.91 3k8p h ARG 649 CO 0.07 0.73 -0.34 1.25 -1.07 0.00 0.00 179.97 180.61 3k8p h LEU 650 N 0.29 0.00 -1.81 3.04 5.85 0.23 -2.76 115.31 120.16 3k8p h LEU 650 Ca 0.02 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.74 3k8p h LEU 650 Cb 0.88 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.91 3k8p h LEU 650 CO 0.07 0.34 0.00 -0.07 -0.34 0.00 0.00 178.44 178.45 3k8p h LEU 651 N 0.00 0.00 -0.42 2.25 3.38 -0.97 -1.09 115.31 118.45 3k8p h LEU 651 Ca -0.00 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.80 3k8p h LEU 651 Cb 0.62 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 3k8p h LEU 651 CO 0.04 0.00 -0.44 -0.08 0.09 0.00 0.00 178.44 178.06 3k8p h GLU 652 N 0.00 0.85 0.00 1.13 4.81 -1.59 -3.39 114.58 116.39 3k8p h GLU 652 Ca 0.00 -0.47 0.00 0.00 -0.13 0.00 0.00 59.36 58.76 3k8p h GLU 652 Cb 0.34 0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.75 3k8p h GLU 652 CO 0.00 1.11 0.00 1.33 -0.73 0.00 0.00 179.01 180.72 3k8p n VAL 653 N -4.03 0.60 -2.96 0.32 0.24 -0.84 -5.07 118.33 106.58 3k8p n VAL 653 Ca -0.03 -0.72 -0.27 0.00 -2.04 0.00 0.00 64.34 61.28 3k8p n VAL 653 Cb 0.57 0.75 -0.01 0.00 -1.47 0.00 0.00 33.84 33.67 3k8p n VAL 653 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3k8p n PRO 655 N -1.72 1.28 0.22 0.00 -0.02 -1.26 -4.83 135.00 128.67 3k8p n PRO 655 Ca -0.01 0.48 0.06 0.00 -2.02 0.00 0.00 63.50 62.01 3k8p n PRO 655 Cb 0.55 -2.28 0.50 0.00 -0.02 0.00 0.00 33.50 32.25 3k8p n PRO 655 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 3k8p h LEU 656 N 1.07 0.00 -2.30 2.45 3.38 -1.99 -1.30 115.31 116.62 3k8p h LEU 656 Ca -0.48 0.00 0.03 0.00 0.09 0.00 0.00 57.88 57.52 3k8p h LEU 656 Cb 1.34 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.08 3k8p h LEU 656 CO 0.54 0.22 0.12 -0.33 0.09 0.00 0.00 178.44 179.08 3k8p h GLU 657 N 0.00 0.00 -0.52 1.13 5.08 -2.05 -2.98 114.58 115.25 3k8p h GLU 657 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3k8p h GLU 657 Cb 0.41 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.66 3k8p h GLU 657 CO 0.03 0.00 0.00 0.39 -1.00 0.00 0.00 179.01 178.43 3k8p n GLU 658 N -3.87 2.58 0.11 2.33 -0.58 -0.49 -4.49 120.64 116.23 3k8p n GLU 658 Ca -0.00 -2.42 -0.03 0.00 -0.42 0.00 0.00 57.16 54.29 3k8p n GLU 658 Cb 0.23 -1.52 0.17 0.00 -0.57 0.00 0.00 31.44 29.75 3k8p n GLU 658 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 3k8p h VAL 659 N 4.30 1.38 0.70 2.62 2.07 -1.60 -2.87 116.25 122.86 3k8p h VAL 659 Ca 0.00 -1.89 -0.03 0.00 0.82 0.00 0.00 66.70 65.60 3k8p h VAL 659 Cb 0.98 1.96 0.01 0.00 -1.52 0.00 0.00 31.29 32.72 3k8p h VAL 659 CO 0.00 0.55 -0.34 -0.08 0.02 0.00 0.00 177.57 177.72 3k8p h GLU 660 N 0.12 -0.91 -0.54 1.57 4.81 -1.82 -1.95 114.58 115.86 3k8p h GLU 660 Ca -0.00 0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 59.28 3k8p h GLU 660 Cb 1.02 0.21 -0.03 0.00 0.63 0.00 0.00 28.75 30.58 3k8p h GLU 660 CO 0.08 -0.61 0.29 -0.84 -0.73 0.00 0.00 179.01 177.20 3k8p h ILE 661 N -1.15 1.17 -0.13 2.32 3.07 -1.88 0.27 117.51 121.18 3k8p h ILE 661 Ca -0.10 -0.42 -0.00 0.00 1.55 0.00 0.00 64.86 65.89 3k8p h ILE 661 Cb 0.72 0.45 -0.01 0.00 -0.27 0.00 0.00 36.82 37.71 3k8p h ILE 661 CO 0.16 0.18 0.07 0.58 -1.05 0.00 0.00 178.15 178.09 3k8p h VAL 662 N 0.74 1.11 -0.64 0.16 2.07 -1.58 -2.24 116.25 115.87 3k8p h VAL 662 Ca 0.19 -0.30 -0.01 0.00 0.82 0.00 0.00 66.70 67.40 3k8p h VAL 662 Cb 0.03 1.07 -0.03 0.00 -1.52 0.00 0.00 31.29 30.84 3k8p h VAL 662 CO -0.03 0.10 0.36 0.74 0.02 0.00 0.00 177.57 178.75 3k8p h THR 663 N 0.10 1.20 -0.62 2.57 2.02 -0.51 -1.86 112.91 115.81 3k8p h THR 663 Ca 0.04 -0.49 0.08 0.00 0.77 0.00 0.00 66.41 66.81 3k8p h THR 663 Cb 0.09 0.36 -0.06 0.00 -1.74 0.00 0.00 68.15 66.80 3k8p h THR 663 CO -0.01 0.22 0.29 0.28 0.37 0.00 0.00 175.52 176.67 3k8p h SER 664 N 0.87 0.37 0.02 4.18 0.02 -0.32 0.14 113.55 118.84 3k8p h SER 664 Ca 0.23 0.05 -0.00 0.00 -0.84 0.00 0.00 61.79 61.23 3k8p h SER 664 Cb 0.03 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 62.56 3k8p h SER 664 CO -0.04 0.23 -0.01 -0.61 -1.14 0.00 0.00 176.83 175.26 3k8p h GLN 665 N 0.52 -0.03 -0.75 3.45 5.75 -1.17 0.28 115.11 123.16 3k8p h GLN 665 Ca 0.30 0.00 0.16 0.00 -0.15 0.00 0.00 58.65 58.96 3k8p h GLN 665 Cb 0.29 0.01 -0.14 0.00 1.07 0.00 0.00 27.48 28.70 3k8p h GLN 665 CO -0.24 0.21 -0.14 2.35 -2.65 0.00 0.00 178.83 178.36 3k8p h TRP 666 N -0.27 -0.32 -0.66 3.99 7.01 -0.81 0.19 115.95 125.08 3k8p h TRP 666 Ca -0.00 0.06 -0.03 0.00 2.11 0.00 0.00 58.89 61.03 3k8p h TRP 666 Cb 0.26 0.26 -0.03 0.00 -2.10 0.00 0.00 29.16 27.54 3k8p h TRP 666 CO 0.01 -0.31 0.30 1.03 -2.79 0.00 0.00 178.44 176.68 3k8p h SER 667 N 0.02 0.88 -0.86 2.65 0.87 -0.14 -0.44 113.55 116.54 3k8p h SER 667 Ca 0.37 -0.14 0.03 0.00 -1.23 0.00 0.00 61.79 60.83 3k8p h SER 667 Cb 0.60 -0.23 -0.05 0.00 -0.44 0.00 0.00 62.40 62.28 3k8p h SER 667 CO -0.75 0.78 0.55 0.74 -0.53 0.00 0.00 176.83 177.62 3k8p h THR 668 N 0.93 1.13 -0.28 2.23 2.02 0.14 -0.91 112.91 118.16 3k8p h THR 668 Ca 0.23 -0.37 -0.16 0.00 0.77 0.00 0.00 66.41 66.88 3k8p h THR 668 Cb 0.14 -0.03 -0.00 0.00 -1.74 0.00 0.00 68.15 66.52 3k8p h THR 668 CO -0.03 0.19 -0.48 -0.07 0.37 0.00 0.00 175.52 175.51 3k8p h LEU 669 N 1.07 0.83 -0.82 2.58 3.38 -0.53 -2.85 115.31 118.96 3k8p h LEU 669 Ca 0.34 -0.41 -0.02 0.00 0.09 0.00 0.00 57.88 57.88 3k8p h LEU 669 Cb 0.01 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.49 3k8p h LEU 669 CO -0.12 1.17 0.43 -0.08 0.09 0.00 0.00 178.44 179.93 3k8p h GLU 670 N 0.60 1.16 -0.38 1.13 4.22 -0.57 -1.45 114.58 119.29 3k8p h GLU 670 Ca 0.03 -0.15 -0.08 0.00 0.08 0.00 0.00 59.36 59.24 3k8p h GLU 670 Cb 1.05 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 30.07 3k8p h GLU 670 CO 0.10 0.87 -0.09 -0.07 -2.18 0.00 0.00 179.01 177.64 3k8p h LEU 671 N 1.15 0.74 -0.70 1.64 3.38 -1.15 -1.35 115.31 119.02 3k8p h LEU 671 Ca 0.29 -0.36 -0.06 0.00 0.09 0.00 0.00 57.88 57.84 3k8p h LEU 671 Cb 0.06 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.58 3k8p h LEU 671 CO -0.04 0.93 0.22 -0.08 0.09 0.00 0.00 178.44 179.55 3k8p h GLU 672 N 0.53 1.08 -0.40 1.13 4.57 -1.34 -2.62 114.58 117.54 3k8p h GLU 672 Ca 0.10 -0.23 0.01 0.00 -1.18 0.00 0.00 59.36 58.05 3k8p h GLU 672 Cb 0.61 -0.16 -0.02 0.00 -0.16 0.00 0.00 28.75 29.02 3k8p h GLU 672 CO 0.04 0.93 0.25 1.25 -1.18 0.00 0.00 179.01 180.30 3k8p h LEU 673 N 1.02 0.42 0.00 1.64 5.85 -1.14 -1.45 115.31 121.65 3k8p h LEU 673 Ca 0.22 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.94 3k8p h LEU 673 Cb 0.30 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.24 3k8p h LEU 673 CO -0.01 0.30 0.00 -1.54 -0.34 0.00 0.00 178.44 176.85 3k8p n SER 674 N -4.84 0.00 -0.76 1.25 3.41 -0.52 -1.94 113.62 110.23 3k8p n SER 674 Ca 0.01 0.40 0.09 0.00 -0.26 0.00 0.00 58.87 59.10 3k8p n SER 674 Cb 0.04 -0.42 0.11 0.00 -0.26 0.00 0.00 64.21 63.68 3k8p n SER 674 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3k8p n ALA 675 N -1.42 2.43 -2.90 7.33 0.00 -0.55 -4.96 120.51 120.44 3k8p n ALA 675 Ca 0.01 -0.76 -0.31 0.00 0.00 0.00 0.00 53.44 52.39 3k8p n ALA 675 Cb 0.04 -0.60 -0.04 0.00 0.00 0.00 0.00 19.45 18.84 3k8p n ALA 675 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3k8p s ARG 676 N -1.35 3.38 -0.58 0.00 0.52 -0.82 -5.06 118.95 115.04 3k8p s ARG 676 Ca 0.23 -0.46 -0.25 0.00 -0.52 0.00 0.00 55.73 54.73 3k8p s ARG 676 Cb 0.15 -3.01 0.04 0.00 0.52 0.00 0.00 34.95 32.66 3k8p s ARG 676 CO 0.22 0.61 1.01 0.34 0.02 0.00 0.00 175.30 177.50 3k8p s ASP 677 N -2.49 6.32 0.41 0.23 -1.08 -1.26 -4.89 116.67 113.91 3k8p s ASP 677 Ca 0.34 -0.37 0.21 0.00 -0.52 0.00 0.00 52.55 52.21 3k8p s ASP 677 Cb -0.13 -2.46 0.78 0.00 -1.46 0.00 0.00 42.92 39.65 3k8p s ASP 677 CO 0.27 -1.34 1.77 -0.07 0.52 0.00 0.00 175.17 176.32 3k8p h LEU 678 N 11.32 0.00 0.05 -1.34 -0.00 -1.97 -2.99 115.31 120.38 3k8p h LEU 678 Ca -0.26 0.00 -0.00 0.00 -0.00 0.00 0.00 57.88 57.61 3k8p h LEU 678 Cb 1.07 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.73 3k8p h LEU 678 CO 1.13 0.30 -0.03 0.58 -0.00 0.00 0.00 178.44 180.42 3k8p h VAL 679 N 0.00 1.29 -2.40 1.22 2.07 -2.03 -3.36 116.25 113.04 3k8p h VAL 679 Ca -0.00 -1.34 -0.63 0.00 0.82 0.00 0.00 66.70 65.55 3k8p h VAL 679 Cb 0.84 2.15 -0.40 0.00 -1.52 0.00 0.00 31.29 32.36 3k8p h VAL 679 CO 0.04 0.33 -0.41 0.29 0.02 0.00 0.00 177.57 177.83 3k8p n LYS 680 N -4.84 2.70 -3.09 1.57 5.02 -1.22 -5.07 118.16 113.23 3k8p n LYS 680 Ca -0.09 -4.64 -0.42 0.00 -2.02 0.00 0.00 58.31 51.15 3k8p n LYS 680 Cb 0.29 -2.30 -0.06 0.00 -0.02 0.00 0.00 35.03 32.94 3k8p n LYS 680 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 3k8p s ASP 681 N -2.22 6.48 0.00 4.39 2.15 -1.13 -4.81 116.67 121.53 3k8p s ASP 681 Ca 0.37 0.31 0.14 0.00 0.43 0.00 0.00 52.55 53.80 3k8p s ASP 681 Cb 0.11 -2.34 0.83 0.00 -0.30 0.00 0.00 42.92 41.23 3k8p s ASP 681 CO -0.02 -0.56 1.25 1.17 -0.17 0.00 0.00 175.17 176.85 3k8p n LYS 682 N 6.02 0.49 -4.07 4.34 4.81 -1.26 -4.76 118.16 123.72 3k8p n LYS 682 Ca -0.00 0.00 -0.08 0.00 -0.87 0.00 0.00 58.31 57.36 3k8p n LYS 682 Cb 0.49 -1.45 -0.10 0.00 0.02 0.00 0.00 35.03 33.99 3k8p n LYS 682 CO 0.00 0.00 0.00 0.71 1.17 0.00 0.00 177.40 179.28 3k8p s TYR 683 N -2.00 0.50 0.00 5.64 2.02 -1.26 -5.10 117.35 117.16 3k8p s TYR 683 Ca 0.21 -0.92 0.00 0.00 -0.37 0.00 0.00 57.07 55.99 3k8p s TYR 683 Cb 0.10 -0.36 0.00 0.00 -0.40 0.00 0.00 41.96 41.30 3k8p s TYR 683 CO 0.16 -0.31 0.00 0.00 -1.57 0.00 0.00 175.55 173.84