#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cn3 s GLU 35 N 0.00 4.35 -0.25 2.12 2.12 -0.71 -4.96 118.70 121.37 1cn3 s GLU 35 Ca 0.00 0.75 -0.11 0.00 0.36 0.00 0.00 54.97 55.97 1cn3 s GLU 35 Cb 0.00 -3.49 -0.05 0.00 0.26 0.00 0.00 34.13 30.85 1cn3 s GLU 35 CO 0.00 -0.03 0.20 0.08 -0.54 0.00 0.00 175.26 174.98 1cn3 s VAL 36 N 1.15 5.32 0.00 3.70 1.01 -1.26 -0.65 120.40 129.68 1cn3 s VAL 36 Ca 0.33 0.25 0.00 0.00 0.00 0.00 0.00 61.98 62.57 1cn3 s VAL 36 Cb -0.17 -3.54 0.00 0.00 0.00 0.00 0.00 36.38 32.67 1cn3 s VAL 36 CO 0.14 0.31 0.00 0.18 0.00 0.00 0.00 175.10 175.73 1cn3 n LEU 37 N 4.53 0.00 -4.81 3.92 4.77 0.11 -4.96 117.00 120.55 1cn3 n LEU 37 Ca -0.14 0.00 -0.30 0.00 -0.03 0.00 0.00 56.01 55.54 1cn3 n LEU 37 Cb 0.52 0.00 0.09 0.00 -2.33 0.00 0.00 43.42 41.70 1cn3 n LEU 37 CO 0.35 0.00 0.72 -1.81 -1.33 0.00 0.00 177.39 175.32 1cn3 s ASP 38 N -1.00 4.52 0.27 -1.43 1.11 -1.26 -4.68 116.67 114.20 1cn3 s ASP 38 Ca 0.00 1.26 -0.29 0.00 0.18 0.00 0.00 52.55 53.70 1cn3 s ASP 38 Cb 0.00 -1.98 -0.09 0.00 1.07 0.00 0.00 42.92 41.92 1cn3 s ASP 38 CO 0.00 -1.94 0.96 -0.76 1.18 0.00 0.00 175.17 174.61 1cn3 s LEU 39 N -5.75 4.55 0.19 1.23 1.43 -1.26 -0.65 118.68 118.42 1cn3 s LEU 39 Ca 0.61 1.96 -0.30 0.00 -1.03 0.00 0.00 54.13 55.37 1cn3 s LEU 39 Cb -0.14 -3.73 -0.08 0.00 0.03 0.00 0.00 46.19 42.28 1cn3 s LEU 39 CO 0.54 0.05 1.01 -0.69 0.23 0.00 0.00 176.35 177.49 1cn3 s VAL 40 N -1.30 4.05 0.43 -1.59 1.01 -0.07 -4.81 120.40 118.12 1cn3 s VAL 40 Ca 0.44 1.87 0.07 0.00 0.00 0.00 0.00 61.98 64.36 1cn3 s VAL 40 Cb -0.25 -4.19 -0.05 0.00 0.00 0.00 0.00 36.38 31.89 1cn3 s VAL 40 CO 0.31 0.37 0.17 0.42 0.00 0.00 0.00 175.10 176.37 1cn3 s THR 41 N -0.58 2.19 0.00 3.92 -4.23 -1.26 -4.70 115.64 110.98 1cn3 s THR 41 Ca 0.45 -1.72 0.00 0.00 -1.18 0.00 0.00 61.69 59.24 1cn3 s THR 41 Cb -0.27 -2.91 0.00 0.00 1.34 0.00 0.00 72.50 70.66 1cn3 s THR 41 CO 0.33 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 175.02 1cn3 n GLY 42 N -1.25 0.78 3.63 3.99 0.00 -1.26 -4.87 105.19 106.21 1cn3 n GLY 42 Ca -0.02 -2.20 -0.50 0.00 0.00 0.00 0.00 46.02 43.30 1cn3 n GLY 42 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1cn3 n PRO 43 N -0.34 1.60 -3.70 1.61 -0.04 -1.26 -2.68 135.00 130.18 1cn3 n PRO 43 Ca 0.00 0.58 -0.26 0.00 -0.04 0.00 0.00 63.50 63.78 1cn3 n PRO 43 Cb 0.00 -2.28 0.06 0.00 -0.04 0.00 0.00 33.50 31.24 1cn3 n PRO 43 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1cn3 n ASP 44 N 3.08 -5.46 0.03 3.54 8.00 -1.26 -4.89 116.55 119.59 1cn3 n ASP 44 Ca 0.18 -0.63 0.11 0.00 0.71 0.00 0.00 54.79 55.16 1cn3 n ASP 44 Cb 0.23 -4.63 -0.02 0.00 -0.02 0.00 0.00 41.12 36.68 1cn3 n ASP 44 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1cn3 n SER 45 N -2.97 0.55 -4.44 -2.24 3.41 -1.09 -4.85 113.62 102.00 1cn3 n SER 45 Ca -0.01 -0.11 -0.31 0.00 -0.26 0.00 0.00 58.87 58.18 1cn3 n SER 45 Cb 0.56 0.97 -0.13 0.00 -0.26 0.00 0.00 64.21 65.35 1cn3 n SER 45 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1cn3 s VAL 46 N -3.28 2.71 0.06 -3.33 1.01 -1.26 -0.07 120.40 116.24 1cn3 s VAL 46 Ca 0.01 -1.10 -0.14 0.00 0.00 0.00 0.00 61.98 60.75 1cn3 s VAL 46 Cb 0.13 -2.10 0.02 0.00 0.00 0.00 0.00 36.38 34.44 1cn3 s VAL 46 CO 0.82 0.42 0.31 0.28 0.00 0.00 0.00 175.10 176.93 1cn3 s THR 47 N -0.84 0.09 0.02 3.92 -1.32 0.35 -4.99 115.64 112.87 1cn3 s THR 47 Ca 0.13 -0.72 0.08 0.00 -1.21 0.00 0.00 61.69 59.97 1cn3 s THR 47 Cb -0.10 -1.02 -0.03 0.00 -1.51 0.00 0.00 72.50 69.83 1cn3 s THR 47 CO 0.03 -0.40 -0.23 -1.61 -2.21 0.00 0.00 174.62 170.21 1cn3 s GLU 48 N -2.89 2.01 -0.04 7.08 2.02 -1.26 -0.17 118.70 125.45 1cn3 s GLU 48 Ca -0.03 -1.00 0.02 0.00 0.02 0.00 0.00 54.97 53.99 1cn3 s GLU 48 Cb 0.00 -2.09 0.01 0.00 0.10 0.00 0.00 34.13 32.15 1cn3 s GLU 48 CO -0.05 0.54 -0.09 0.42 0.02 0.00 0.00 175.26 176.09 1cn3 s ILE 49 N -0.79 0.85 0.15 -1.63 -1.09 0.88 -4.96 121.20 114.61 1cn3 s ILE 49 Ca 0.12 -0.37 0.10 0.00 -2.23 0.00 0.00 60.65 58.27 1cn3 s ILE 49 Cb -0.10 -0.78 -0.04 0.00 -1.58 0.00 0.00 42.46 39.96 1cn3 s ILE 49 CO 0.02 0.27 -0.19 -1.61 -1.23 0.00 0.00 174.94 172.21 1cn3 s GLU 50 N 0.37 1.73 -0.14 2.79 2.02 -1.26 -0.02 118.70 124.20 1cn3 s GLU 50 Ca -0.07 -1.31 -0.30 0.00 0.02 0.00 0.00 54.97 53.31 1cn3 s GLU 50 Cb -0.11 -2.03 0.13 0.00 0.10 0.00 0.00 34.13 32.22 1cn3 s GLU 50 CO 0.01 0.44 1.01 0.00 0.02 0.00 0.00 175.26 176.74 1cn3 s ALA 51 N -1.41 -1.93 -0.02 5.21 0.00 0.09 -5.00 121.76 118.70 1cn3 s ALA 51 Ca 0.20 1.49 0.06 0.00 0.00 0.00 0.00 51.96 53.71 1cn3 s ALA 51 Cb -0.09 -0.48 -0.01 0.00 0.00 0.00 0.00 23.12 22.54 1cn3 s ALA 51 CO 0.11 -0.40 -0.20 -0.59 0.00 0.00 0.00 175.76 174.68 1cn3 s PHE 52 N -1.60 1.78 -0.19 0.00 -0.12 -1.26 0.02 117.98 116.61 1cn3 s PHE 52 Ca 0.01 -0.36 -0.02 0.00 -0.05 0.00 0.00 56.93 56.51 1cn3 s PHE 52 Cb -0.01 -1.15 -0.01 0.00 -0.63 0.00 0.00 43.02 41.22 1cn3 s PHE 52 CO -0.01 -0.05 -0.08 -0.51 -0.05 0.00 0.00 175.22 174.52 1cn3 s LEU 53 N -0.41 2.78 0.51 -1.99 1.02 0.31 -4.94 118.68 115.95 1cn3 s LEU 53 Ca 0.06 -0.40 -0.18 0.00 0.02 0.00 0.00 54.13 53.63 1cn3 s LEU 53 Cb -0.08 -1.68 -0.08 0.00 0.02 0.00 0.00 46.19 44.37 1cn3 s LEU 53 CO -0.00 0.03 1.01 0.20 0.02 0.00 0.00 176.35 177.61 1cn3 s ASN 54 N 1.17 6.37 0.72 2.29 0.01 -1.26 -1.18 114.94 123.05 1cn3 s ASN 54 Ca 0.02 1.77 -0.12 0.00 -0.71 0.00 0.00 52.86 53.82 1cn3 s ASN 54 Cb -0.14 -2.54 0.03 0.00 0.41 0.00 0.00 41.25 39.01 1cn3 s ASN 54 CO -0.02 -0.76 1.09 -2.16 -1.51 0.00 0.00 177.10 173.73 1cn3 s PRO 55 N -3.64 2.59 -0.60 -0.60 0.04 -1.26 -4.84 135.00 126.68 1cn3 s PRO 55 Ca 0.63 1.18 0.06 0.00 0.04 0.00 0.00 61.00 62.91 1cn3 s PRO 55 Cb -0.13 -1.94 0.21 0.00 0.04 0.00 0.00 34.50 32.68 1cn3 s PRO 55 CO 0.26 -1.39 0.58 0.54 0.04 0.00 0.00 177.00 177.02 1cn3 n ARG 56 N -3.09 1.73 0.08 4.56 5.12 -1.26 -4.78 116.66 119.01 1cn3 n ARG 56 Ca 0.09 -4.21 0.12 0.00 -1.93 0.00 0.00 57.85 51.92 1cn3 n ARG 56 Cb 0.53 -2.04 0.28 0.00 -1.16 0.00 0.00 32.46 30.06 1cn3 n ARG 56 CO 0.00 0.00 0.00 -1.33 -1.93 0.00 0.00 177.63 174.37 1cn3 n MET 57 N 1.56 0.28 0.00 5.56 2.81 -1.26 -0.32 117.12 125.75 1cn3 n MET 57 Ca 0.25 0.15 0.00 0.00 -1.81 0.00 0.00 57.70 56.29 1cn3 n MET 57 Cb 0.42 -1.74 0.00 0.00 -0.71 0.00 0.00 33.22 31.18 1cn3 n MET 57 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1cn3 n GLY 58 N 1.32 3.04 3.66 3.03 0.00 -1.25 -3.40 105.19 111.60 1cn3 n GLY 58 Ca 0.04 -0.42 -0.43 0.00 0.00 0.00 0.00 46.02 45.22 1cn3 n GLY 58 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1cn3 s GLN 59 N 0.00 4.28 1.00 1.61 2.00 -1.11 -4.32 119.66 123.12 1cn3 s GLN 59 Ca 0.00 1.28 -0.12 0.00 -2.00 0.00 0.00 55.36 54.52 1cn3 s GLN 59 Cb 0.00 -3.62 0.19 0.00 0.80 0.00 0.00 33.01 30.38 1cn3 s GLN 59 CO 0.00 -0.54 1.08 -2.14 -0.50 0.00 0.00 175.29 173.19 1cn3 s PRO 60 N 2.87 0.41 0.48 1.67 0.02 -1.26 -4.54 135.00 134.65 1cn3 s PRO 60 Ca 0.43 0.83 0.13 0.00 0.02 0.00 0.00 61.00 62.41 1cn3 s PRO 60 Cb -0.16 -1.71 1.13 0.00 0.02 0.00 0.00 34.50 33.79 1cn3 s PRO 60 CO 0.09 -2.82 2.11 -1.35 -0.33 0.00 0.00 177.00 174.70 1cn3 h PRO 61 N -1.97 0.16 -6.49 5.54 0.11 -1.96 -3.42 132.00 123.96 1cn3 h PRO 61 Ca -0.53 -0.01 -0.64 0.00 0.11 0.00 0.00 66.00 64.92 1cn3 h PRO 61 Cb 1.31 -0.04 -0.17 0.00 0.11 0.00 0.00 31.00 32.21 1cn3 h PRO 61 CO 0.53 0.12 -0.81 0.95 -0.21 0.00 0.00 178.00 178.58 1cn3 s THR 62 N -5.18 2.37 0.61 -1.15 -4.23 -1.26 -4.10 115.64 102.71 1cn3 s THR 62 Ca -0.06 -2.13 -0.19 0.00 -1.18 0.00 0.00 61.69 58.13 1cn3 s THR 62 Cb 0.17 -2.17 -0.03 0.00 1.34 0.00 0.00 72.50 71.82 1cn3 s THR 62 CO 0.69 -0.19 1.27 -2.16 -0.54 0.00 0.00 174.62 173.69 1cn3 s PRO 63 N -2.89 2.80 0.42 3.99 0.04 -1.26 -4.96 135.00 133.13 1cn3 s PRO 63 Ca 0.23 2.00 0.23 0.00 0.04 0.00 0.00 61.00 63.50 1cn3 s PRO 63 Cb -0.07 -1.94 0.30 0.00 0.04 0.00 0.00 34.50 32.84 1cn3 s PRO 63 CO 0.11 -1.39 1.56 0.93 0.04 0.00 0.00 177.00 178.25 1cn3 h GLU 64 N 0.81 0.00 -6.25 4.56 5.08 -1.94 -3.10 114.58 113.73 1cn3 h GLU 64 Ca -0.51 0.00 -0.69 0.00 -1.00 0.00 0.00 59.36 57.17 1cn3 h GLU 64 Cb 1.32 0.00 0.05 0.00 0.50 0.00 0.00 28.75 30.62 1cn3 h GLU 64 CO 0.54 0.01 0.52 0.45 -1.00 0.00 0.00 179.01 179.54 1cn3 n SER 65 N -3.07 1.76 0.00 1.42 2.88 -1.26 -4.49 113.62 110.86 1cn3 n SER 65 Ca 0.04 1.11 0.06 0.00 -1.33 0.00 0.00 58.87 58.75 1cn3 n SER 65 Cb 0.54 -1.19 0.34 0.00 -0.75 0.00 0.00 64.21 63.15 1cn3 n SER 65 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1cn3 n LEU 66 N 2.92 0.00 0.00 2.46 4.77 -1.26 -0.09 117.00 125.80 1cn3 n LEU 66 Ca 0.19 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.17 1cn3 n LEU 66 Cb 0.18 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.27 1cn3 n LEU 66 CO 0.65 0.00 -0.13 0.35 -1.33 0.00 0.00 177.39 176.93 1cn3 n THR 67 N -0.71 0.00 -0.79 -5.08 -2.24 -1.26 -4.29 114.28 99.90 1cn3 n THR 67 Ca 0.09 -0.29 0.08 0.00 -2.27 0.00 0.00 64.05 61.65 1cn3 n THR 67 Cb 0.04 0.82 0.24 0.00 -2.10 0.00 0.00 70.33 69.34 1cn3 n THR 67 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1cn3 n GLU 68 N -0.96 3.02 0.00 -0.78 1.02 -1.09 -4.90 120.64 116.96 1cn3 n GLU 68 Ca 0.00 -2.68 0.00 0.00 -0.02 0.00 0.00 57.16 54.46 1cn3 n GLU 68 Cb 0.00 -1.73 0.00 0.00 -0.02 0.00 0.00 31.44 29.69 1cn3 n GLU 68 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1cn3 n GLY 69 N -0.19 1.12 0.36 0.62 0.00 -1.21 -4.79 105.19 101.11 1cn3 n GLY 69 Ca 0.19 -0.06 0.19 0.00 0.00 0.00 0.00 46.02 46.34 1cn3 n GLY 69 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1cn3 h GLY 70 N 0.00 0.00 2.00 -0.02 0.00 -0.42 0.11 103.07 104.74 1cn3 h GLY 70 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1cn3 h GLY 70 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 1cn3 n GLN 71 N -3.76 0.14 -0.10 4.80 0.00 -1.23 -1.87 117.38 115.37 1cn3 n GLN 71 Ca 0.05 0.49 0.12 0.00 0.00 0.00 0.00 57.00 57.66 1cn3 n GLN 71 Cb 0.49 -1.83 0.23 0.00 0.00 0.00 0.00 30.24 29.12 1cn3 n GLN 71 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72 1cn3 n TYR 72 N -2.11 0.26 -1.98 2.61 4.01 0.40 -4.94 117.16 115.41 1cn3 n TYR 72 Ca 0.01 -0.13 -0.42 0.00 -0.16 0.00 0.00 57.90 57.20 1cn3 n TYR 72 Cb 0.13 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.13 1cn3 n TYR 72 CO 0.00 0.00 0.00 -0.47 -0.46 0.00 0.00 176.86 175.93 1cn3 s TYR 73 N -1.74 2.78 0.00 -0.72 6.04 -0.78 -0.90 117.35 122.03 1cn3 s TYR 73 Ca 0.34 0.54 0.00 0.00 0.04 0.00 0.00 57.07 58.00 1cn3 s TYR 73 Cb 0.21 -3.90 0.00 0.00 -1.04 0.00 0.00 41.96 37.23 1cn3 s TYR 73 CO 0.31 -3.43 0.00 0.41 -1.54 0.00 0.00 175.55 171.30 1cn3 n GLY 74 N 3.82 0.47 3.32 8.97 0.00 -1.26 -5.06 105.19 115.45 1cn3 n GLY 74 Ca 0.14 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.00 1cn3 n GLY 74 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1cn3 s TRP 75 N -2.00 1.51 0.56 1.61 0.52 -0.08 -1.70 118.94 119.35 1cn3 s TRP 75 Ca 0.00 -1.03 0.01 0.00 0.02 0.00 0.00 56.10 55.11 1cn3 s TRP 75 Cb 0.00 -0.89 0.04 0.00 -1.15 0.00 0.00 33.47 31.47 1cn3 s TRP 75 CO 0.00 -0.16 0.78 -1.54 0.02 0.00 0.00 176.95 176.05 1cn3 s SER 76 N -3.29 5.25 0.82 2.95 1.04 -0.26 -2.74 113.70 117.47 1cn3 s SER 76 Ca 0.31 -0.02 -0.10 0.00 0.48 0.00 0.00 55.95 56.62 1cn3 s SER 76 Cb 0.07 -0.85 0.12 0.00 0.10 0.00 0.00 66.02 65.46 1cn3 s SER 76 CO 0.10 -1.16 1.16 -0.13 0.98 0.00 0.00 173.24 174.18 1cn3 s ARG 77 N -4.77 1.52 0.03 4.02 1.81 0.44 -4.50 118.95 117.50 1cn3 s ARG 77 Ca 0.58 -0.35 -0.35 0.00 -1.72 0.00 0.00 55.73 53.88 1cn3 s ARG 77 Cb -0.10 -2.03 -0.14 0.00 -0.45 0.00 0.00 34.95 32.23 1cn3 s ARG 77 CO 0.39 -1.77 1.65 0.41 -0.68 0.00 0.00 175.30 175.30 1cn3 n GLY 78 N -3.30 1.10 3.68 -3.53 0.00 -1.26 -4.61 105.19 97.27 1cn3 n GLY 78 Ca 0.12 0.75 -0.42 0.00 0.00 0.00 0.00 46.02 46.46 1cn3 n GLY 78 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1cn3 s ILE 79 N 2.05 3.44 -0.13 -0.61 1.01 -0.48 -4.83 121.20 121.64 1cn3 s ILE 79 Ca 0.86 0.73 -0.06 0.00 0.00 0.00 0.00 60.65 62.18 1cn3 s ILE 79 Cb -0.76 -3.47 -0.04 0.00 0.01 0.00 0.00 42.46 38.19 1cn3 s ILE 79 CO 0.46 -0.03 0.09 0.54 0.00 0.00 0.00 174.94 176.00 1cn3 s ASN 80 N 2.67 5.95 0.24 3.58 4.22 -1.26 -4.71 114.94 125.63 1cn3 s ASN 80 Ca 0.71 0.29 -0.02 0.00 -2.14 0.00 0.00 52.86 51.71 1cn3 s ASN 80 Cb -0.35 -1.91 -0.04 0.00 1.28 0.00 0.00 41.25 40.23 1cn3 s ASN 80 CO 0.29 0.33 0.45 -0.76 -2.04 0.00 0.00 177.10 175.38 1cn3 s LEU 81 N -0.59 4.16 0.61 3.54 1.43 -1.26 -4.77 118.68 121.81 1cn3 s LEU 81 Ca 0.12 0.49 -0.18 0.00 -1.03 0.00 0.00 54.13 53.53 1cn3 s LEU 81 Cb -0.12 -3.28 -0.05 0.00 0.03 0.00 0.00 46.19 42.77 1cn3 s LEU 81 CO 0.02 -0.11 0.91 0.00 0.23 0.00 0.00 176.35 177.40 1cn3 n ALA 82 N -0.85 -0.01 0.77 4.21 0.00 -1.26 -4.88 120.51 118.48 1cn3 n ALA 82 Ca -0.04 -0.01 0.11 0.00 0.00 0.00 0.00 53.44 53.50 1cn3 n ALA 82 Cb 0.54 -2.07 -0.03 0.00 0.00 0.00 0.00 19.45 17.89 1cn3 n ALA 82 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1cn3 n THR 83 N -1.81 0.05 -3.83 0.00 -2.24 0.47 -4.98 114.28 101.94 1cn3 n THR 83 Ca 0.14 -0.12 -0.07 0.00 -2.27 0.00 0.00 64.05 61.73 1cn3 n THR 83 Cb 0.48 0.56 0.01 0.00 -2.10 0.00 0.00 70.33 69.27 1cn3 n THR 83 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1cn3 s SER 84 N -3.42 -0.06 0.33 3.42 1.04 -1.22 -4.95 113.70 108.83 1cn3 s SER 84 Ca 0.06 -0.86 0.24 0.00 0.48 0.00 0.00 55.95 55.86 1cn3 s SER 84 Cb 0.16 0.71 1.18 0.00 0.10 0.00 0.00 66.02 68.16 1cn3 s SER 84 CO 0.83 -1.38 1.73 -0.78 0.98 0.00 0.00 173.24 174.61 1cn3 h ASP 85 N 2.00 0.00 0.00 7.02 1.82 -2.04 -2.72 116.42 122.49 1cn3 h ASP 85 Ca -0.28 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.36 1cn3 h ASP 85 Cb 1.24 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.25 1cn3 h ASP 85 CO 0.35 0.00 -0.00 0.35 -1.61 0.00 0.00 179.24 178.32 1cn3 n THR 86 N -2.33 0.84 -3.70 2.25 -2.24 -1.26 -4.89 114.28 102.95 1cn3 n THR 86 Ca -0.00 -0.85 -0.29 0.00 -2.27 0.00 0.00 64.05 60.64 1cn3 n THR 86 Cb 0.12 0.57 -0.12 0.00 -2.10 0.00 0.00 70.33 68.79 1cn3 n THR 86 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1cn3 s GLU 87 N -0.87 1.51 -0.35 -0.78 0.41 -1.03 -5.03 118.70 112.56 1cn3 s GLU 87 Ca 0.01 -2.36 0.02 0.00 -0.41 0.00 0.00 54.97 52.23 1cn3 s GLU 87 Cb 0.01 -2.44 0.11 0.00 -1.78 0.00 0.00 34.13 30.02 1cn3 s GLU 87 CO 0.00 -1.23 0.10 0.34 -0.49 0.00 0.00 175.26 173.98 1cn3 s ASP 88 N -0.14 4.31 -0.61 -0.19 3.68 -1.26 -0.40 116.67 122.06 1cn3 s ASP 88 Ca 0.22 -2.05 0.04 0.00 2.13 0.00 0.00 52.55 52.90 1cn3 s ASP 88 Cb -0.14 -1.24 0.15 0.00 -1.45 0.00 0.00 42.92 40.24 1cn3 s ASP 88 CO -0.08 -0.37 0.38 -0.44 0.13 0.00 0.00 175.17 174.80 1cn3 s SER 89 N 1.07 4.48 0.33 -0.34 0.01 -1.26 -0.36 113.70 117.62 1cn3 s SER 89 Ca 0.12 -3.45 -0.29 0.00 1.31 0.00 0.00 55.95 53.64 1cn3 s SER 89 Cb -0.19 -1.58 -0.10 0.00 0.21 0.00 0.00 66.02 64.35 1cn3 s SER 89 CO -0.14 -0.15 1.34 -2.16 0.41 0.00 0.00 173.24 172.54 1cn3 s PRO 90 N -0.87 4.31 0.48 12.44 0.04 -1.26 -4.98 135.00 145.15 1cn3 s PRO 90 Ca 0.22 2.28 -0.22 0.00 0.04 0.00 0.00 61.00 63.31 1cn3 s PRO 90 Cb -0.14 -3.06 -0.07 0.00 0.04 0.00 0.00 34.50 31.27 1cn3 s PRO 90 CO -0.09 -0.26 1.13 0.20 0.04 0.00 0.00 177.00 178.02 1cn3 s GLY 91 N -0.37 2.72 0.38 0.56 0.00 -1.26 -4.50 107.32 104.84 1cn3 s GLY 91 Ca 0.50 0.86 0.05 0.00 0.00 0.00 0.00 44.72 46.13 1cn3 s GLY 91 CO 0.54 1.27 2.03 3.43 0.00 0.00 0.00 173.10 180.38 1cn3 h ASN 92 N 1.85 0.59 -0.04 1.64 2.35 -1.95 -1.57 115.58 118.46 1cn3 h ASN 92 Ca -0.49 -0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.24 1cn3 h ASN 92 Cb 1.25 -0.15 0.00 0.00 0.05 0.00 0.00 38.32 39.47 1cn3 h ASN 92 CO 0.59 0.43 0.00 -0.46 -1.65 0.00 0.00 177.43 176.35 1cn3 n ASN 93 N -4.45 0.20 -0.52 5.81 0.23 -1.26 -2.50 115.26 112.76 1cn3 n ASN 93 Ca 0.05 -1.93 0.06 0.00 -0.53 0.00 0.00 54.58 52.23 1cn3 n ASN 93 Cb 0.06 -0.02 0.06 0.00 -2.08 0.00 0.00 39.78 37.79 1cn3 n ASN 93 CO 0.00 0.00 0.00 0.35 -0.93 0.00 0.00 177.26 176.68 1cn3 n THR 94 N -0.43 0.08 -3.76 5.53 -2.24 -0.59 -0.42 114.28 112.46 1cn3 n THR 94 Ca 0.03 -0.54 -0.37 0.00 -2.27 0.00 0.00 64.05 60.90 1cn3 n THR 94 Cb 0.04 1.20 -0.12 0.00 -2.10 0.00 0.00 70.33 69.35 1cn3 n THR 94 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1cn3 s LEU 95 N -1.04 4.53 0.43 3.22 1.43 -1.04 -4.86 118.68 121.34 1cn3 s LEU 95 Ca 0.16 -1.36 -0.25 0.00 -1.03 0.00 0.00 54.13 51.64 1cn3 s LEU 95 Cb 0.11 -1.85 -0.09 0.00 0.03 0.00 0.00 46.19 44.38 1cn3 s LEU 95 CO 0.16 -0.38 1.30 -2.65 0.23 0.00 0.00 176.35 175.01 1cn3 n PRO 96 N 4.76 1.99 -4.51 1.29 -0.02 -1.22 -4.35 135.00 132.93 1cn3 n PRO 96 Ca -0.11 0.71 -0.24 0.00 -2.02 0.00 0.00 63.50 61.84 1cn3 n PRO 96 Cb 0.44 -2.44 -0.11 0.00 -0.02 0.00 0.00 33.50 31.37 1cn3 n PRO 96 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1cn3 s THR 97 N -1.20 1.63 0.38 3.45 -4.23 0.56 -1.67 115.64 114.56 1cn3 s THR 97 Ca 0.61 -2.03 -0.26 0.00 -1.18 0.00 0.00 61.69 58.82 1cn3 s THR 97 Cb -0.49 -2.80 -0.09 0.00 1.34 0.00 0.00 72.50 70.45 1cn3 s THR 97 CO 0.58 -0.06 1.23 0.26 -0.54 0.00 0.00 174.62 176.09 1cn3 s TRP 98 N -2.99 3.02 0.05 3.99 0.52 0.13 -4.40 118.94 119.26 1cn3 s TRP 98 Ca 0.35 1.49 -0.08 0.00 0.02 0.00 0.00 56.10 57.88 1cn3 s TRP 98 Cb 0.08 -3.53 -0.05 0.00 -1.15 0.00 0.00 33.47 28.81 1cn3 s TRP 98 CO 0.16 -1.62 0.34 -1.12 0.02 0.00 0.00 176.95 174.72 1cn3 s SER 99 N -0.86 6.56 0.04 2.95 0.01 0.39 -0.94 113.70 121.85 1cn3 s SER 99 Ca 0.55 0.66 -0.20 0.00 1.31 0.00 0.00 55.95 58.26 1cn3 s SER 99 Cb -0.35 -2.13 0.04 0.00 0.21 0.00 0.00 66.02 63.80 1cn3 s SER 99 CO 0.45 0.19 0.46 0.00 0.41 0.00 0.00 173.24 174.76 1cn3 s MET 100 N -1.94 0.96 -0.04 12.44 0.23 -1.26 -1.23 119.30 128.46 1cn3 s MET 100 Ca 0.31 -0.26 -0.09 0.00 -1.03 0.00 0.00 55.69 54.62 1cn3 s MET 100 Cb -0.13 0.43 0.01 0.00 -1.53 0.00 0.00 34.83 33.61 1cn3 s MET 100 CO 0.18 -0.33 0.21 0.00 -2.03 0.00 0.00 175.02 173.05 1cn3 s ALA 101 N -2.30 -0.51 -0.23 3.16 0.00 0.38 -4.54 121.76 117.71 1cn3 s ALA 101 Ca -0.06 0.27 -0.01 0.00 0.00 0.00 0.00 51.96 52.16 1cn3 s ALA 101 Cb -0.01 -0.09 0.02 0.00 0.00 0.00 0.00 23.12 23.04 1cn3 s ALA 101 CO -0.01 -0.18 -0.09 0.21 0.00 0.00 0.00 175.76 175.70 1cn3 s LYS 102 N -0.76 2.91 -0.14 0.00 2.20 -1.26 -0.44 119.74 122.26 1cn3 s LYS 102 Ca -0.08 -0.92 -0.07 0.00 -0.36 0.00 0.00 55.97 54.53 1cn3 s LYS 102 Cb -0.05 -2.91 -0.04 0.00 -1.51 0.00 0.00 37.83 33.32 1cn3 s LYS 102 CO 0.02 -0.35 0.13 -0.51 -0.36 0.00 0.00 175.35 174.28 1cn3 s LEU 103 N 1.33 4.29 -0.14 5.43 1.43 0.12 -4.87 118.68 126.28 1cn3 s LEU 103 Ca 0.01 0.39 -0.26 0.00 -1.03 0.00 0.00 54.13 53.24 1cn3 s LEU 103 Cb -0.16 -2.06 -0.02 0.00 0.03 0.00 0.00 46.19 43.99 1cn3 s LEU 103 CO -0.06 0.35 0.86 -1.10 0.23 0.00 0.00 176.35 176.63 1cn3 s GLN 104 N -0.66 4.35 0.34 1.70 1.11 -1.26 0.62 119.66 125.85 1cn3 s GLN 104 Ca 0.13 1.10 0.07 0.00 0.01 0.00 0.00 55.36 56.67 1cn3 s GLN 104 Cb -0.12 -3.55 -0.02 0.00 -1.01 0.00 0.00 33.01 28.32 1cn3 s GLN 104 CO 0.02 -0.27 0.39 -0.51 0.01 0.00 0.00 175.29 174.94 1cn3 s LEU 105 N 1.92 3.81 0.30 2.90 1.43 0.42 -4.96 118.68 124.50 1cn3 s LEU 105 Ca 0.41 -0.32 -0.28 0.00 -1.03 0.00 0.00 54.13 52.91 1cn3 s LEU 105 Cb -0.17 -2.52 -0.14 0.00 0.03 0.00 0.00 46.19 43.39 1cn3 s LEU 105 CO 0.15 -0.40 1.09 -2.65 0.23 0.00 0.00 176.35 174.77 1cn3 n PRO 106 N -1.53 1.57 -1.31 1.29 -0.02 -1.26 -4.93 135.00 128.82 1cn3 n PRO 106 Ca -0.01 0.55 -0.33 0.00 -2.02 0.00 0.00 63.50 61.70 1cn3 n PRO 106 Cb 0.59 -1.98 0.10 0.00 -0.02 0.00 0.00 33.50 32.19 1cn3 n PRO 106 CO 0.00 0.00 0.00 -1.64 1.98 0.00 0.00 175.50 175.84 1cn3 s MET 107 N -1.63 2.05 0.00 -0.52 -1.94 -1.26 -5.01 119.30 110.99 1cn3 s MET 107 Ca 0.58 1.54 0.00 0.00 -1.71 0.00 0.00 55.69 56.09 1cn3 s MET 107 Cb -0.67 -1.85 0.00 0.00 2.01 0.00 0.00 34.83 34.33 1cn3 s MET 107 CO 0.60 -1.86 0.00 1.28 -0.01 0.00 0.00 175.02 175.04 1cn3 n LEU 108 N -3.13 0.96 -4.38 -0.03 4.77 -1.26 -5.08 117.00 108.85 1cn3 n LEU 108 Ca 0.12 0.00 -0.36 0.00 -0.03 0.00 0.00 56.01 55.74 1cn3 n LEU 108 Cb 0.51 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.47 1cn3 n LEU 108 CO 0.49 0.07 -0.32 0.20 -1.33 0.00 0.00 177.39 176.50 1cn3 s ASN 109 N -4.05 4.84 0.00 -1.43 0.01 -1.26 -4.87 114.94 108.18 1cn3 s ASN 109 Ca 0.00 -0.35 0.00 0.00 -0.71 0.00 0.00 52.86 51.80 1cn3 s ASN 109 Cb 0.00 -1.85 0.00 0.00 0.41 0.00 0.00 41.25 39.81 1cn3 s ASN 109 CO 0.00 -0.06 0.71 -0.62 -1.51 0.00 0.00 177.10 175.63 1cn3 n GLU 110 N 4.87 0.00 -2.56 -0.60 -0.58 -1.26 -4.57 120.64 115.94 1cn3 n GLU 110 Ca -0.17 0.22 -0.43 0.00 -0.42 0.00 0.00 57.16 56.36 1cn3 n GLU 110 Cb 0.51 -1.21 -0.02 0.00 -0.57 0.00 0.00 31.44 30.14 1cn3 n GLU 110 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 1cn3 s ASP 111 N -2.01 6.87 0.11 1.62 3.68 -1.26 -4.90 116.67 120.78 1cn3 s ASP 111 Ca 0.00 1.17 0.19 0.00 2.13 0.00 0.00 52.55 56.05 1cn3 s ASP 111 Cb 0.00 -2.54 -0.09 0.00 -1.45 0.00 0.00 42.92 38.84 1cn3 s ASP 111 CO 0.00 -0.91 0.89 0.18 0.13 0.00 0.00 175.17 175.46 1cn3 n LEU 112 N 7.02 0.82 -1.04 -1.34 4.77 -1.26 -3.68 117.00 122.30 1cn3 n LEU 112 Ca 0.13 0.34 0.03 0.00 -0.03 0.00 0.00 56.01 56.48 1cn3 n LEU 112 Cb 0.47 0.02 0.16 0.00 -2.33 0.00 0.00 43.42 41.74 1cn3 n LEU 112 CO 0.60 0.01 0.51 0.35 -1.33 0.00 0.00 177.39 177.53 1cn3 n THR 113 N -2.79 1.08 -3.03 -5.08 -2.24 -1.26 -4.88 114.28 96.08 1cn3 n THR 113 Ca -0.06 -0.56 -0.40 0.00 -2.27 0.00 0.00 64.05 60.76 1cn3 n THR 113 Cb 0.72 -0.37 -0.05 0.00 -2.10 0.00 0.00 70.33 68.54 1cn3 n THR 113 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1cn3 h ASP 115 N 6.48 -0.11 -3.26 0.00 3.58 -1.93 -3.36 116.42 117.82 1cn3 h ASP 115 Ca -0.42 0.25 -0.64 0.00 0.42 0.00 0.00 57.03 56.64 1cn3 h ASP 115 Cb 1.20 0.35 -0.36 0.00 1.72 0.00 0.00 39.33 42.24 1cn3 h ASP 115 CO 0.74 -0.30 -0.83 -0.89 -2.88 0.00 0.00 179.24 175.08 1cn3 s THR 116 N -5.86 1.83 0.51 2.25 2.01 -1.26 -4.51 115.64 110.61 1cn3 s THR 116 Ca -0.12 -0.95 0.05 0.00 0.31 0.00 0.00 61.69 60.99 1cn3 s THR 116 Cb 0.29 -1.76 0.01 0.00 0.01 0.00 0.00 72.50 71.05 1cn3 s THR 116 CO 0.78 0.36 0.32 -0.76 -0.69 0.00 0.00 174.62 174.62 1cn3 s LEU 117 N 1.35 2.76 0.08 4.42 1.43 -0.38 -4.92 118.68 123.42 1cn3 s LEU 117 Ca 0.02 -1.24 0.07 0.00 -1.03 0.00 0.00 54.13 51.95 1cn3 s LEU 117 Cb -0.15 -1.23 -0.04 0.00 0.03 0.00 0.00 46.19 44.81 1cn3 s LEU 117 CO -0.10 -0.96 -0.15 -1.10 0.23 0.00 0.00 176.35 174.27 1cn3 s GLN 118 N -4.16 2.03 0.06 1.70 -0.21 -1.26 0.37 119.66 118.19 1cn3 s GLN 118 Ca 0.32 -1.04 0.03 0.00 0.02 0.00 0.00 55.36 54.69 1cn3 s GLN 118 Cb -0.01 -2.22 -0.03 0.00 1.00 0.00 0.00 33.01 31.75 1cn3 s GLN 118 CO 0.19 0.52 -0.10 -1.64 -2.12 0.00 0.00 175.29 172.14 1cn3 s MET 119 N -1.90 0.67 0.14 2.91 -1.94 0.87 -4.76 119.30 115.28 1cn3 s MET 119 Ca 0.18 -0.90 -0.29 0.00 -1.71 0.00 0.00 55.69 52.96 1cn3 s MET 119 Cb -0.11 -0.45 -0.07 0.00 2.01 0.00 0.00 34.83 36.21 1cn3 s MET 119 CO 0.10 0.08 0.93 -1.58 -0.01 0.00 0.00 175.02 174.54 1cn3 s TRP 120 N -1.65 3.85 -0.11 -0.03 0.52 -1.26 0.20 118.94 120.46 1cn3 s TRP 120 Ca -0.04 1.79 0.03 0.00 0.02 0.00 0.00 56.10 57.89 1cn3 s TRP 120 Cb -0.08 -3.00 0.01 0.00 -1.15 0.00 0.00 33.47 29.25 1cn3 s TRP 120 CO 0.00 0.29 -0.19 -2.00 0.02 0.00 0.00 176.95 175.07 1cn3 s GLU 121 N -0.36 2.60 -0.17 4.98 2.12 0.58 -0.86 118.70 127.59 1cn3 s GLU 121 Ca 0.44 -0.71 -0.26 0.00 0.36 0.00 0.00 54.97 54.80 1cn3 s GLU 121 Cb -0.24 -2.08 -0.01 0.00 0.26 0.00 0.00 34.13 32.06 1cn3 s GLU 121 CO 0.29 0.04 0.89 0.00 -0.54 0.00 0.00 175.26 175.94 1cn3 s ALA 122 N 0.70 3.53 -0.22 6.30 0.00 0.20 -0.64 121.76 131.63 1cn3 s ALA 122 Ca -0.12 0.10 -0.06 0.00 0.00 0.00 0.00 51.96 51.88 1cn3 s ALA 122 Cb -0.16 -3.31 -0.19 0.00 0.00 0.00 0.00 23.12 19.46 1cn3 s ALA 122 CO 0.02 -0.72 -0.02 0.28 0.00 0.00 0.00 175.76 175.32 1cn3 n VAL 123 N 4.82 1.59 -3.62 0.00 0.31 0.34 -3.45 118.33 118.33 1cn3 n VAL 123 Ca 0.06 -0.50 -0.09 0.00 -0.01 0.00 0.00 64.34 63.81 1cn3 n VAL 123 Cb 0.48 -1.67 -0.02 0.00 -0.91 0.00 0.00 33.84 31.73 1cn3 n VAL 123 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 1cn3 s SER 124 N -6.89 -0.38 -0.03 4.52 1.04 -1.17 -0.23 113.70 110.56 1cn3 s SER 124 Ca -0.31 -0.26 -0.03 0.00 0.48 0.00 0.00 55.95 55.83 1cn3 s SER 124 Cb 0.09 0.59 0.01 0.00 0.10 0.00 0.00 66.02 66.81 1cn3 s SER 124 CO 0.63 -1.03 0.08 0.54 0.98 0.00 0.00 173.24 174.44 1cn3 s VAL 125 N -3.64 -0.01 -0.22 5.02 0.11 0.53 -1.16 120.40 121.04 1cn3 s VAL 125 Ca 0.06 0.02 -0.07 0.00 -2.93 0.00 0.00 61.98 59.06 1cn3 s VAL 125 Cb -0.03 -0.12 -0.03 0.00 -1.53 0.00 0.00 36.38 34.67 1cn3 s VAL 125 CO -0.04 0.01 0.06 -0.54 -3.33 0.00 0.00 175.10 171.27 1cn3 s LYS 126 N 0.15 3.78 0.08 1.54 1.02 0.33 -0.06 119.74 126.59 1cn3 s LYS 126 Ca -0.01 -0.43 0.05 0.00 0.02 0.00 0.00 55.97 55.60 1cn3 s LYS 126 Cb -0.02 -3.27 -0.03 0.00 -0.52 0.00 0.00 37.83 33.99 1cn3 s LYS 126 CO -0.00 0.01 -0.13 -0.08 -0.92 0.00 0.00 175.35 174.23 1cn3 s THR 127 N 1.08 1.09 -0.17 2.17 -1.32 -1.26 -0.56 115.64 116.67 1cn3 s THR 127 Ca 0.04 -1.43 -0.19 0.00 -1.21 0.00 0.00 61.69 58.90 1cn3 s THR 127 Cb -0.14 -1.18 0.05 0.00 -1.51 0.00 0.00 72.50 69.72 1cn3 s THR 127 CO 0.03 -0.33 0.53 -0.70 -2.21 0.00 0.00 174.62 171.94 1cn3 s GLU 128 N -2.08 0.66 -0.28 7.08 2.12 0.30 -4.93 118.70 121.57 1cn3 s GLU 128 Ca 0.01 0.63 -0.13 0.00 0.36 0.00 0.00 54.97 55.84 1cn3 s GLU 128 Cb -0.08 0.32 -0.04 0.00 0.26 0.00 0.00 34.13 34.59 1cn3 s GLU 128 CO 0.02 -0.10 0.29 0.08 -0.54 0.00 0.00 175.26 175.01 1cn3 s VAL 129 N 0.04 5.23 -0.11 3.70 1.01 -1.26 0.75 120.40 129.76 1cn3 s VAL 129 Ca -0.02 0.34 -0.08 0.00 0.00 0.00 0.00 61.98 62.22 1cn3 s VAL 129 Cb -0.04 -3.64 -0.04 0.00 0.00 0.00 0.00 36.38 32.66 1cn3 s VAL 129 CO 0.02 0.17 0.17 -0.69 0.00 0.00 0.00 175.10 174.76 1cn3 s VAL 130 N 1.93 5.46 0.00 2.92 1.01 -0.50 -4.64 120.40 126.57 1cn3 s VAL 130 Ca 0.11 0.27 0.00 0.00 0.00 0.00 0.00 61.98 62.36 1cn3 s VAL 130 Cb -0.16 -3.43 0.00 0.00 0.00 0.00 0.00 36.38 32.79 1cn3 s VAL 130 CO 0.11 0.61 0.00 0.61 0.00 0.00 0.00 175.10 176.43 1cn3 n GLY 131 N 2.00 1.10 0.26 4.51 0.00 -1.26 -4.06 105.19 107.74 1cn3 n GLY 131 Ca -0.19 0.00 0.08 0.00 0.00 0.00 0.00 46.02 45.91 1cn3 n GLY 131 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1cn3 h SER 132 N 0.00 0.00 0.01 1.61 4.64 -1.99 0.87 113.55 118.69 1cn3 h SER 132 Ca 0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1cn3 h SER 132 Cb 0.00 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1cn3 h SER 132 CO 0.00 0.00 -0.00 1.23 -0.87 0.00 0.00 176.83 177.19 1cn3 h GLY 133 N 0.01 0.00 2.00 -0.77 0.00 -1.98 0.30 103.07 102.63 1cn3 h GLY 133 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1cn3 h GLY 133 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 176.54 178.02 1cn3 h SER 134 N 0.00 0.00 0.60 0.19 4.64 -1.23 -0.94 113.55 116.80 1cn3 h SER 134 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1cn3 h SER 134 Cb 0.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.10 1cn3 h SER 134 CO 0.00 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.14 1cn3 n LEU 135 N -2.86 0.13 -0.01 5.97 4.77 0.09 -2.03 117.00 123.06 1cn3 n LEU 135 Ca -0.00 0.53 0.16 0.00 -0.03 0.00 0.00 56.01 56.66 1cn3 n LEU 135 Cb 0.20 -0.51 0.87 0.00 -2.33 0.00 0.00 43.42 41.65 1cn3 n LEU 135 CO 0.22 -0.28 1.07 0.18 -1.33 0.00 0.00 177.39 177.25 1cn3 n LEU 136 N -1.64 0.03 -4.58 2.23 4.77 -0.36 -4.61 117.00 112.84 1cn3 n LEU 136 Ca 0.04 0.10 -0.42 0.00 -0.03 0.00 0.00 56.01 55.70 1cn3 n LEU 136 Cb 0.20 -0.11 -0.02 0.00 -2.33 0.00 0.00 43.42 41.16 1cn3 n LEU 136 CO 0.16 0.00 1.26 -0.62 -1.33 0.00 0.00 177.39 176.86 1cn3 s ASP 137 N -2.22 6.17 -0.23 -1.43 -1.08 -0.86 -4.79 116.67 112.23 1cn3 s ASP 137 Ca 0.40 0.45 0.11 0.00 -0.52 0.00 0.00 52.55 52.99 1cn3 s ASP 137 Cb 0.21 -2.54 0.44 0.00 -1.46 0.00 0.00 42.92 39.56 1cn3 s ASP 137 CO 0.41 -1.64 1.21 1.33 0.52 0.00 0.00 175.17 176.99 1cn3 n VAL 138 N 6.94 2.19 0.14 1.11 0.24 -1.26 -4.63 118.33 123.05 1cn3 n VAL 138 Ca 0.14 -3.45 0.02 0.00 -2.04 0.00 0.00 64.34 59.01 1cn3 n VAL 138 Cb 0.49 -0.44 0.03 0.00 -1.47 0.00 0.00 33.84 32.45 1cn3 n VAL 138 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1cn3 n HIS 139 N -0.91 0.04 0.00 6.34 1.44 -1.26 -1.23 115.22 119.64 1cn3 n HIS 139 Ca 0.26 -0.10 0.00 0.00 -2.01 0.00 0.00 57.72 55.87 1cn3 n HIS 139 Cb 0.80 -0.01 0.00 0.00 0.12 0.00 0.00 29.99 30.90 1cn3 n HIS 139 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1cn3 n GLY 140 N 0.19 -0.91 1.33 -1.39 0.00 -1.26 -4.89 105.19 98.26 1cn3 n GLY 140 Ca 0.03 -1.42 -0.07 0.00 0.00 0.00 0.00 46.02 44.55 1cn3 n GLY 140 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1cn3 n PHE 141 N -0.15 1.40 -1.69 1.61 7.35 -1.26 -4.59 117.46 120.13 1cn3 n PHE 141 Ca 0.00 -1.63 -0.30 0.00 -0.76 0.00 0.00 57.45 54.76 1cn3 n PHE 141 Cb 0.00 -0.56 0.18 0.00 0.35 0.00 0.00 39.48 39.45 1cn3 n PHE 141 CO 0.00 0.00 0.00 -0.80 -0.76 0.00 0.00 176.76 175.20 1cn3 s ASN 142 N -2.33 2.84 0.10 -2.13 0.01 -1.26 -4.37 114.94 107.79 1cn3 s ASN 142 Ca 0.47 0.49 -0.36 0.00 -0.71 0.00 0.00 52.86 52.75 1cn3 s ASN 142 Cb 0.42 -0.69 -0.16 0.00 0.41 0.00 0.00 41.25 41.23 1cn3 s ASN 142 CO 0.02 -2.92 1.40 1.17 -1.51 0.00 0.00 177.10 175.26 1cn3 n LYS 143 N -3.93 1.39 -2.21 -0.60 4.81 0.36 -4.48 118.16 113.50 1cn3 n LYS 143 Ca 0.13 0.50 -0.30 0.00 -0.87 0.00 0.00 58.31 57.77 1cn3 n LYS 143 Cb 0.60 -2.18 -0.00 0.00 0.02 0.00 0.00 35.03 33.47 1cn3 n LYS 143 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 1cn3 s PRO 144 N 0.64 3.63 0.39 1.64 0.04 -1.26 -0.67 135.00 139.40 1cn3 s PRO 144 Ca 0.83 0.59 0.20 0.00 0.04 0.00 0.00 61.00 62.66 1cn3 s PRO 144 Cb -0.89 -2.19 0.75 0.00 0.04 0.00 0.00 34.50 32.21 1cn3 s PRO 144 CO 0.45 -0.40 1.77 1.79 0.04 0.00 0.00 177.00 180.65 1cn3 h THR 145 N 0.06 0.84 -3.61 1.26 1.35 -0.86 -3.34 112.91 108.61 1cn3 h THR 145 Ca -0.45 -1.40 -0.74 0.00 -0.55 0.00 0.00 66.41 63.27 1cn3 h THR 145 Cb 1.19 1.86 -0.31 0.00 -1.73 0.00 0.00 68.15 69.17 1cn3 h THR 145 CO 0.62 0.34 -0.19 -0.62 -0.25 0.00 0.00 175.52 175.41 1cn3 s ASP 146 N -6.42 5.89 0.37 5.36 2.15 -0.38 -4.90 116.67 118.74 1cn3 s ASP 146 Ca -0.00 -2.65 0.20 0.00 0.43 0.00 0.00 52.55 50.53 1cn3 s ASP 146 Cb 0.11 -2.01 0.50 0.00 -0.30 0.00 0.00 42.92 41.21 1cn3 s ASP 146 CO 0.68 -0.50 1.64 0.71 -0.17 0.00 0.00 175.17 177.53 1cn3 h THR 147 N 5.22 0.62 -0.54 1.71 1.35 -1.83 0.12 112.91 119.56 1cn3 h THR 147 Ca -0.00 -1.56 -0.02 0.00 -0.55 0.00 0.00 66.41 64.28 1cn3 h THR 147 Cb 1.00 2.07 -0.02 0.00 -1.73 0.00 0.00 68.15 69.47 1cn3 h THR 147 CO 0.75 0.31 0.27 0.58 -0.25 0.00 0.00 175.52 177.18 1cn3 h VAL 148 N 0.00 1.19 -0.14 6.82 2.07 -1.95 -3.20 116.25 121.05 1cn3 h VAL 148 Ca -0.00 -0.52 0.00 0.00 0.82 0.00 0.00 66.70 66.99 1cn3 h VAL 148 Cb 1.04 0.55 0.00 0.00 -1.52 0.00 0.00 31.29 31.36 1cn3 h VAL 148 CO 0.04 0.21 0.00 0.59 0.02 0.00 0.00 177.57 178.43 1cn3 n ASN 149 N -4.59 2.29 -3.33 0.57 3.02 -1.22 -4.98 115.26 107.02 1cn3 n ASN 149 Ca 0.03 -1.66 -0.17 0.00 -0.03 0.00 0.00 54.58 52.74 1cn3 n ASN 149 Cb 0.11 -0.09 0.07 0.00 -0.61 0.00 0.00 39.78 39.26 1cn3 n ASN 149 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 1cn3 n THR 150 N 0.58 -8.29 -3.19 3.41 -1.04 0.23 -5.01 114.28 100.96 1cn3 n THR 150 Ca 0.08 -1.17 0.00 0.00 -2.04 0.00 0.00 64.05 60.92 1cn3 n THR 150 Cb 0.33 -6.03 0.00 0.00 -1.82 0.00 0.00 70.33 62.82 1cn3 n THR 150 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 1cn3 n LYS 151 N -3.48 0.07 0.00 -2.82 4.76 -0.20 -5.00 118.16 111.49 1cn3 n LYS 151 Ca -0.11 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.33 1cn3 n LYS 151 Cb 0.63 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.82 1cn3 n LYS 151 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1cn3 n GLY 152 N 0.10 1.55 3.40 0.72 0.00 -1.26 -1.24 105.19 108.46 1cn3 n GLY 152 Ca 0.00 -0.67 -0.20 0.00 0.00 0.00 0.00 46.02 45.15 1cn3 n GLY 152 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1cn3 s ILE 153 N 0.00 1.14 -0.25 -0.61 -4.36 -1.26 -4.88 121.20 110.98 1cn3 s ILE 153 Ca 0.00 -2.03 -0.29 0.00 -0.26 0.00 0.00 60.65 58.07 1cn3 s ILE 153 Cb 0.00 -2.61 -0.00 0.00 1.25 0.00 0.00 42.46 41.10 1cn3 s ILE 153 CO 0.00 -0.13 1.25 -0.55 0.24 0.00 0.00 174.94 175.75 1cn3 s SER 154 N -3.41 6.82 0.04 4.36 0.15 -0.36 -0.70 113.70 120.60 1cn3 s SER 154 Ca 0.33 1.37 -0.36 0.00 0.70 0.00 0.00 55.95 57.99 1cn3 s SER 154 Cb 0.07 -2.54 -0.15 0.00 -1.71 0.00 0.00 66.02 61.70 1cn3 s SER 154 CO 0.13 -0.93 1.57 0.41 1.20 0.00 0.00 173.24 175.63 1cn3 n THR 155 N 5.84 0.14 -1.55 6.45 -1.04 0.15 -4.60 114.28 119.67 1cn3 n THR 155 Ca 0.14 -0.02 -0.29 0.00 -2.04 0.00 0.00 64.05 61.83 1cn3 n THR 155 Cb 0.46 -1.33 0.11 0.00 -1.82 0.00 0.00 70.33 67.75 1cn3 n THR 155 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 1cn3 s PRO 156 N 1.62 1.58 0.20 -2.82 0.04 -1.26 -4.76 135.00 129.61 1cn3 s PRO 156 Ca 0.85 0.45 -0.32 0.00 0.04 0.00 0.00 61.00 62.02 1cn3 s PRO 156 Cb -0.81 -1.88 -0.13 0.00 0.04 0.00 0.00 34.50 31.72 1cn3 s PRO 156 CO 0.46 -1.93 1.55 0.28 0.04 0.00 0.00 177.00 177.41 1cn3 n VAL 157 N -3.61 0.38 -4.00 -0.36 0.31 -1.26 -4.85 118.33 104.94 1cn3 n VAL 157 Ca 0.07 -0.09 -0.09 0.00 -0.01 0.00 0.00 64.34 64.21 1cn3 n VAL 157 Cb 0.58 -1.63 -0.05 0.00 -0.91 0.00 0.00 33.84 31.83 1cn3 n VAL 157 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 1cn3 s GLU 158 N 0.42 1.57 0.00 5.55 2.02 -0.65 -4.58 118.70 123.03 1cn3 s GLU 158 Ca 0.74 -1.29 0.00 0.00 0.02 0.00 0.00 54.97 54.44 1cn3 s GLU 158 Cb -0.63 0.47 0.00 0.00 0.10 0.00 0.00 34.13 34.07 1cn3 s GLU 158 CO 0.42 -0.65 0.00 0.41 0.02 0.00 0.00 175.26 175.45 1cn3 n GLY 159 N -0.39 0.09 3.74 -1.39 0.00 0.73 0.14 105.19 108.11 1cn3 n GLY 159 Ca -0.01 -2.06 -0.41 0.00 0.00 0.00 0.00 46.02 43.53 1cn3 n GLY 159 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1cn3 s SER 160 N -4.00 6.98 0.08 1.61 0.01 -1.11 -4.14 113.70 113.12 1cn3 s SER 160 Ca 0.00 2.38 0.07 0.00 1.31 0.00 0.00 55.95 59.71 1cn3 s SER 160 Cb 0.00 -2.62 -0.03 0.00 0.21 0.00 0.00 66.02 63.58 1cn3 s SER 160 CO 0.00 -0.43 -0.19 -1.10 0.41 0.00 0.00 173.24 171.92 1cn3 s GLN 161 N -0.57 1.12 -0.17 12.44 -0.21 0.75 -2.59 119.66 130.43 1cn3 s GLN 161 Ca 0.53 -1.03 -0.06 0.00 0.02 0.00 0.00 55.36 54.81 1cn3 s GLN 161 Cb -0.35 -1.28 0.08 0.00 1.00 0.00 0.00 33.01 32.45 1cn3 s GLN 161 CO 0.40 0.31 0.35 -0.47 -2.12 0.00 0.00 175.29 173.76 1cn3 s TYR 162 N -1.06 -0.62 -0.14 0.91 6.04 -0.62 -1.07 117.35 120.80 1cn3 s TYR 162 Ca 0.05 1.26 -0.01 0.00 0.04 0.00 0.00 57.07 58.42 1cn3 s TYR 162 Cb -0.09 0.16 0.03 0.00 -1.04 0.00 0.00 41.96 41.02 1cn3 s TYR 162 CO 0.03 -0.41 -0.05 -1.01 -1.54 0.00 0.00 175.55 172.56 1cn3 s HIS 163 N 2.40 1.51 0.00 4.97 3.76 -0.25 -0.92 115.29 126.76 1cn3 s HIS 163 Ca -0.01 -0.86 0.01 0.00 -0.15 0.00 0.00 55.06 54.04 1cn3 s HIS 163 Cb -0.12 -1.23 -0.01 0.00 1.11 0.00 0.00 32.58 32.34 1cn3 s HIS 163 CO -0.11 -0.55 -0.03 0.08 -0.85 0.00 0.00 174.74 173.28 1cn3 s VAL 164 N 1.70 0.21 0.03 -0.90 1.01 -0.30 -0.50 120.40 121.65 1cn3 s VAL 164 Ca 0.03 -0.25 -0.08 0.00 0.00 0.00 0.00 61.98 61.67 1cn3 s VAL 164 Cb -0.14 -0.21 0.00 0.00 0.00 0.00 0.00 36.38 36.03 1cn3 s VAL 164 CO -0.08 -0.03 0.17 0.72 0.00 0.00 0.00 175.10 175.88 1cn3 s PHE 165 N -0.29 0.07 -0.00 5.22 -0.12 -0.72 -1.36 117.98 120.78 1cn3 s PHE 165 Ca -0.01 -0.27 -0.08 0.00 -0.05 0.00 0.00 56.93 56.52 1cn3 s PHE 165 Cb -0.02 -0.05 0.00 0.00 -0.63 0.00 0.00 43.02 42.32 1cn3 s PHE 165 CO -0.00 -0.39 0.15 0.00 -0.05 0.00 0.00 175.22 174.94 1cn3 s ALA 166 N -2.29 -0.37 -0.06 1.99 0.00 0.48 -0.68 121.76 120.84 1cn3 s ALA 166 Ca -0.07 -0.05 0.00 0.00 0.00 0.00 0.00 51.96 51.84 1cn3 s ALA 166 Cb -0.03 0.08 0.02 0.00 0.00 0.00 0.00 23.12 23.19 1cn3 s ALA 166 CO -0.03 -0.20 -0.04 0.08 0.00 0.00 0.00 175.76 175.57 1cn3 s VAL 167 N -1.26 0.58 0.24 0.00 1.01 -0.66 -1.75 120.40 118.57 1cn3 s VAL 167 Ca -0.13 -0.10 -0.15 0.00 0.00 0.00 0.00 61.98 61.60 1cn3 s VAL 167 Cb -0.07 -0.63 0.01 0.00 0.00 0.00 0.00 36.38 35.69 1cn3 s VAL 167 CO 0.02 0.26 0.53 -0.83 0.00 0.00 0.00 175.10 175.07 1cn3 s GLY 168 N 1.25 0.29 0.00 4.51 0.00 -0.59 -0.63 107.32 112.14 1cn3 s GLY 168 Ca -0.06 -0.64 0.20 0.00 0.00 0.00 0.00 44.72 44.23 1cn3 s GLY 168 CO -0.02 -0.46 1.49 0.61 0.00 0.00 0.00 173.10 174.73 1cn3 n GLY 169 N -0.38 0.57 3.70 0.20 0.00 -0.07 -0.74 105.19 108.46 1cn3 n GLY 169 Ca -0.04 -0.47 -0.09 0.00 0.00 0.00 0.00 46.02 45.42 1cn3 n GLY 169 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1cn3 s GLU 170 N -1.71 1.76 0.63 1.61 -1.05 -1.26 -3.23 118.70 115.44 1cn3 s GLU 170 Ca 0.32 -1.24 -0.18 0.00 -0.15 0.00 0.00 54.97 53.72 1cn3 s GLU 170 Cb 0.18 0.54 -0.03 0.00 -0.44 0.00 0.00 34.13 34.38 1cn3 s GLU 170 CO 0.26 -0.77 1.14 -2.30 0.95 0.00 0.00 175.26 174.54 1cn3 n PRO 171 N -0.45 1.00 -2.07 -4.83 -0.02 -1.26 -4.68 135.00 122.70 1cn3 n PRO 171 Ca -0.03 0.39 -0.42 0.00 -2.02 0.00 0.00 63.50 61.42 1cn3 n PRO 171 Cb 0.61 -2.36 -0.03 0.00 -0.02 0.00 0.00 33.50 31.69 1cn3 n PRO 171 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1cn3 s LEU 172 N -3.27 4.37 -0.00 2.45 2.96 -1.26 -4.72 118.68 119.21 1cn3 s LEU 172 Ca 0.80 2.45 -0.30 0.00 -0.22 0.00 0.00 54.13 56.86 1cn3 s LEU 172 Cb -0.40 -3.59 -0.03 0.00 0.50 0.00 0.00 46.19 42.67 1cn3 s LEU 172 CO 0.43 -0.73 0.97 -1.81 -1.32 0.00 0.00 176.35 173.89 1cn3 s ASP 173 N 1.11 7.35 -0.03 3.68 1.01 -1.26 -0.00 116.67 128.53 1cn3 s ASP 173 Ca 0.67 1.64 0.02 0.00 0.71 0.00 0.00 52.55 55.59 1cn3 s ASP 173 Cb -0.40 -2.56 -0.03 0.00 1.01 0.00 0.00 42.92 40.94 1cn3 s ASP 173 CO 0.31 -0.25 -0.07 -0.76 0.21 0.00 0.00 175.17 174.61 1cn3 s LEU 174 N 0.99 3.16 -0.17 1.23 1.43 -0.27 -0.61 118.68 124.44 1cn3 s LEU 174 Ca 0.51 -0.09 -0.01 0.00 -1.03 0.00 0.00 54.13 53.52 1cn3 s LEU 174 Cb -0.21 -1.75 -0.00 0.00 0.03 0.00 0.00 46.19 44.26 1cn3 s LEU 174 CO 0.28 0.32 -0.13 -1.58 0.23 0.00 0.00 176.35 175.47 1cn3 s GLN 175 N -1.11 3.25 0.40 1.70 2.00 0.24 -1.79 119.66 124.35 1cn3 s GLN 175 Ca 0.15 -0.72 -0.23 0.00 -2.00 0.00 0.00 55.36 52.56 1cn3 s GLN 175 Cb -0.11 -2.72 -0.10 0.00 0.80 0.00 0.00 33.01 30.88 1cn3 s GLN 175 CO 0.04 -0.05 0.96 0.20 -0.50 0.00 0.00 175.29 175.95 1cn3 s GLY 176 N 1.00 2.55 -0.29 2.59 0.00 0.14 -1.16 107.32 112.15 1cn3 s GLY 176 Ca -0.01 0.48 -0.15 0.00 0.00 0.00 0.00 44.72 45.03 1cn3 s GLY 176 CO -0.02 0.82 0.97 -2.27 0.00 0.00 0.00 173.10 172.59 1cn3 s LEU 177 N -2.84 -0.56 0.31 0.66 0.20 0.17 -4.63 118.68 112.00 1cn3 s LEU 177 Ca 0.59 0.84 0.07 0.00 0.69 0.00 0.00 54.13 56.31 1cn3 s LEU 177 Cb -0.13 1.73 -0.06 0.00 -0.43 0.00 0.00 46.19 47.30 1cn3 s LEU 177 CO 0.18 -0.12 -0.05 0.68 -0.29 0.00 0.00 176.35 176.74 1cn3 s VAL 178 N 1.88 1.79 0.12 1.68 -7.23 0.20 -4.32 120.40 114.52 1cn3 s VAL 178 Ca -0.06 -2.13 -0.13 0.00 -1.81 0.00 0.00 61.98 57.86 1cn3 s VAL 178 Cb -0.05 -2.58 -0.07 0.00 0.56 0.00 0.00 36.38 34.24 1cn3 s VAL 178 CO -0.16 -0.22 1.43 0.74 -0.31 0.00 0.00 175.10 176.58 1cn3 h THR 179 N 2.15 1.29 -3.13 5.32 2.02 -1.87 -3.36 112.91 115.32 1cn3 h THR 179 Ca -0.41 -1.58 -0.41 0.00 0.77 0.00 0.00 66.41 64.78 1cn3 h THR 179 Cb 1.24 1.54 -0.40 0.00 -1.74 0.00 0.00 68.15 68.79 1cn3 h THR 179 CO 0.69 0.51 -0.74 -0.62 0.37 0.00 0.00 175.52 175.74 1cn3 s ASP 180 N -6.76 1.79 0.00 4.18 3.68 -1.26 -4.90 116.67 113.40 1cn3 s ASP 180 Ca -0.11 -0.30 0.11 0.00 2.13 0.00 0.00 52.55 54.38 1cn3 s ASP 180 Cb 0.10 -0.16 0.53 0.00 -1.45 0.00 0.00 42.92 41.94 1cn3 s ASP 180 CO 0.86 -0.31 1.28 0.00 0.13 0.00 0.00 175.17 177.14 1cn3 n ALA 181 N 5.29 1.63 1.08 3.66 0.00 -1.26 -1.67 120.51 129.24 1cn3 n ALA 181 Ca -0.05 -0.05 0.12 0.00 0.00 0.00 0.00 53.44 53.46 1cn3 n ALA 181 Cb 0.49 -1.18 0.15 0.00 0.00 0.00 0.00 19.45 18.91 1cn3 n ALA 181 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1cn3 n ARG 182 N -1.34 0.68 -1.72 0.00 1.74 -1.26 -4.50 116.66 110.25 1cn3 n ARG 182 Ca 0.05 -0.50 -0.43 0.00 -0.77 0.00 0.00 57.85 56.20 1cn3 n ARG 182 Cb 0.10 -1.49 -0.02 0.00 -1.02 0.00 0.00 32.46 30.03 1cn3 n ARG 182 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 1cn3 n THR 183 N -0.73 1.24 -3.32 0.55 -1.04 -0.67 -4.77 114.28 105.55 1cn3 n THR 183 Ca 0.09 -0.31 -0.45 0.00 -2.04 0.00 0.00 64.05 61.34 1cn3 n THR 183 Cb 0.38 -1.78 -0.00 0.00 -1.82 0.00 0.00 70.33 67.11 1cn3 n THR 183 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 1cn3 n LYS 184 N 1.72 3.61 -2.25 -2.82 5.02 0.51 -5.03 118.16 118.92 1cn3 n LYS 184 Ca 0.08 -4.47 -0.37 0.00 -2.02 0.00 0.00 58.31 51.53 1cn3 n LYS 184 Cb 0.35 -2.54 -0.01 0.00 -0.02 0.00 0.00 35.03 32.81 1cn3 n LYS 184 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 1cn3 s TYR 185 N -1.43 2.91 0.51 2.13 2.02 -1.26 -4.26 117.35 117.97 1cn3 s TYR 185 Ca 0.31 1.53 -0.22 0.00 -0.37 0.00 0.00 57.07 58.32 1cn3 s TYR 185 Cb -0.09 -3.41 -0.07 0.00 -0.40 0.00 0.00 41.96 38.00 1cn3 s TYR 185 CO -0.07 -1.52 1.23 1.63 -1.57 0.00 0.00 175.55 175.26 1cn3 n LYS 186 N -0.32 1.58 0.13 -0.62 4.76 -1.26 -4.89 118.16 117.53 1cn3 n LYS 186 Ca 0.06 0.58 0.01 0.00 -2.87 0.00 0.00 58.31 56.09 1cn3 n LYS 186 Cb 0.47 -2.40 0.03 0.00 -1.84 0.00 0.00 35.03 31.29 1cn3 n LYS 186 CO 0.00 0.00 0.00 0.93 -1.37 0.00 0.00 177.40 176.96 1cn3 h GLU 187 N 1.44 0.00 -6.46 1.97 5.08 -1.93 -3.43 114.58 111.25 1cn3 h GLU 187 Ca -0.49 0.00 -0.67 0.00 -1.00 0.00 0.00 59.36 57.20 1cn3 h GLU 187 Cb 1.32 0.00 -0.18 0.00 0.50 0.00 0.00 28.75 30.39 1cn3 h GLU 187 CO 0.57 0.58 -0.74 -1.21 -1.00 0.00 0.00 179.01 177.20 1cn3 s GLU 188 N -2.98 2.28 0.00 2.33 2.02 -1.26 -4.63 118.70 116.46 1cn3 s GLU 188 Ca 0.03 -0.89 0.00 0.00 0.02 0.00 0.00 54.97 54.13 1cn3 s GLU 188 Cb 0.08 -2.35 0.00 0.00 0.10 0.00 0.00 34.13 31.96 1cn3 s GLU 188 CO 0.75 0.55 0.00 0.41 0.02 0.00 0.00 175.26 177.00 1cn3 n GLY 189 N 1.27 0.62 3.24 -1.39 0.00 -1.26 -5.01 105.19 102.65 1cn3 n GLY 189 Ca -0.15 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.74 1cn3 n GLY 189 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1cn3 s VAL 190 N -2.23 0.05 -0.33 1.61 -7.23 -1.26 -4.85 120.40 106.15 1cn3 s VAL 190 Ca 0.00 -0.43 -0.12 0.00 -1.81 0.00 0.00 61.98 59.62 1cn3 s VAL 190 Cb 0.00 -0.61 -0.01 0.00 0.56 0.00 0.00 36.38 36.31 1cn3 s VAL 190 CO 0.00 -0.24 0.21 -0.69 -0.31 0.00 0.00 175.10 174.08 1cn3 s VAL 191 N -1.22 5.07 0.51 1.32 1.01 0.12 -4.91 120.40 122.30 1cn3 s VAL 191 Ca -0.13 -0.27 0.01 0.00 0.00 0.00 0.00 61.98 61.59 1cn3 s VAL 191 Cb -0.05 -3.60 -0.01 0.00 0.00 0.00 0.00 36.38 32.72 1cn3 s VAL 191 CO 0.04 0.02 0.02 0.42 0.00 0.00 0.00 175.10 175.60 1cn3 s THR 192 N 1.69 1.03 0.22 3.92 -4.23 -1.26 -4.20 115.64 112.81 1cn3 s THR 192 Ca 0.06 -2.00 -0.08 0.00 -1.18 0.00 0.00 61.69 58.49 1cn3 s THR 192 Cb -0.17 -2.12 0.17 0.00 1.34 0.00 0.00 72.50 71.71 1cn3 s THR 192 CO 0.09 0.00 1.82 0.40 -0.54 0.00 0.00 174.62 176.39 1cn3 h ILE 193 N 1.37 0.97 -0.27 2.99 2.04 -1.96 -1.28 117.51 121.37 1cn3 h ILE 193 Ca -0.43 -0.26 -0.01 0.00 1.00 0.00 0.00 64.86 65.17 1cn3 h ILE 193 Cb 1.32 0.15 -0.01 0.00 -0.74 0.00 0.00 36.82 37.54 1cn3 h ILE 193 CO 0.71 0.14 0.14 0.50 0.00 0.00 0.00 178.15 179.64 1cn3 h LYS 194 N 0.75 0.36 -0.84 2.37 3.64 -1.94 0.58 116.57 121.49 1cn3 h LYS 194 Ca 0.33 -0.03 0.02 0.00 -1.27 0.00 0.00 60.65 59.70 1cn3 h LYS 194 Cb 0.21 -0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 31.91 1cn3 h LYS 194 CO -0.19 0.28 0.56 1.15 -2.27 0.00 0.00 179.45 178.97 1cn3 h THR 195 N 0.37 1.18 0.07 1.00 2.02 -1.55 0.23 112.91 116.23 1cn3 h THR 195 Ca 0.10 -0.38 -0.12 0.00 0.77 0.00 0.00 66.41 66.77 1cn3 h THR 195 Cb 0.03 -0.02 0.00 0.00 -1.74 0.00 0.00 68.15 66.42 1cn3 h THR 195 CO -0.02 0.20 -0.58 0.40 0.37 0.00 0.00 175.52 175.89 1cn3 h ILE 196 N 1.10 1.52 0.00 3.11 1.08 -0.94 -3.36 117.51 120.03 1cn3 h ILE 196 Ca 0.32 -2.41 0.00 0.00 -0.39 0.00 0.00 64.86 62.38 1cn3 h ILE 196 Cb -0.06 3.14 0.00 0.00 -3.07 0.00 0.00 36.82 36.83 1cn3 h ILE 196 CO -0.08 0.64 -0.30 0.71 -0.69 0.00 0.00 178.15 178.43 1cn3 h THR 197 N -0.68 0.00 0.00 -0.27 1.35 -0.92 -3.47 112.91 108.92 1cn3 h THR 197 Ca -0.12 -0.61 0.00 0.00 -0.55 0.00 0.00 66.41 65.13 1cn3 h THR 197 Cb 1.36 1.42 0.00 0.00 -1.73 0.00 0.00 68.15 69.20 1cn3 h THR 197 CO 0.05 0.00 0.00 0.29 -0.25 0.00 0.00 175.52 175.61 1cn3 n LYS 198 N -2.38 -0.51 -4.35 4.72 4.76 0.81 -4.96 118.16 116.25 1cn3 n LYS 198 Ca 0.04 0.13 -0.18 0.00 -2.87 0.00 0.00 58.31 55.43 1cn3 n LYS 198 Cb 0.46 -3.65 -0.10 0.00 -1.84 0.00 0.00 35.03 29.89 1cn3 n LYS 198 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 1cn3 s LYS 199 N -0.68 1.42 0.59 1.97 -0.14 -1.25 -5.05 119.74 116.59 1cn3 s LYS 199 Ca 0.00 -1.74 -0.18 0.00 -1.36 0.00 0.00 55.97 52.69 1cn3 s LYS 199 Cb 0.00 -0.60 -0.04 0.00 -1.68 0.00 0.00 37.83 35.52 1cn3 s LYS 199 CO 0.00 -0.15 1.12 -0.51 -0.76 0.00 0.00 175.35 175.05 1cn3 s ASP 200 N -3.34 5.48 0.83 2.83 -0.00 -1.26 -4.18 116.67 117.03 1cn3 s ASP 200 Ca 0.32 2.10 -0.12 0.00 -0.00 0.00 0.00 52.55 54.85 1cn3 s ASP 200 Cb 0.07 -2.57 0.10 0.00 -0.00 0.00 0.00 42.92 40.52 1cn3 s ASP 200 CO 0.11 -1.38 1.16 -0.04 -0.00 0.00 0.00 175.17 175.02 1cn3 s MET 201 N -3.62 1.55 0.36 8.23 -1.94 -1.26 -4.97 119.30 117.66 1cn3 s MET 201 Ca 0.70 1.57 0.09 0.00 -1.71 0.00 0.00 55.69 56.34 1cn3 s MET 201 Cb -0.22 -1.79 -0.06 0.00 2.01 0.00 0.00 34.83 34.77 1cn3 s MET 201 CO 0.33 -2.24 -0.02 0.14 -0.01 0.00 0.00 175.02 173.22 1cn3 s VAL 202 N -2.46 2.28 0.54 -6.03 -7.23 -1.26 -4.94 120.40 101.31 1cn3 s VAL 202 Ca 0.68 -2.06 0.22 0.00 -1.81 0.00 0.00 61.98 59.01 1cn3 s VAL 202 Cb -0.24 -2.80 0.32 0.00 0.56 0.00 0.00 36.38 34.22 1cn3 s VAL 202 CO 0.54 -0.14 2.14 -0.55 -0.31 0.00 0.00 175.10 176.77 1cn3 h ASN 203 N 1.86 0.00 0.27 4.85 -1.07 -1.96 0.61 115.58 120.14 1cn3 h ASN 203 Ca -0.43 0.00 0.00 0.00 0.07 0.00 0.00 56.30 55.94 1cn3 h ASN 203 Cb 1.25 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.50 1cn3 h ASN 203 CO 0.72 0.00 0.00 0.11 0.07 0.00 0.00 177.43 178.33 1cn3 h LYS 204 N 0.00 0.00 0.00 4.14 1.57 -1.95 -2.10 116.57 118.23 1cn3 h LYS 204 Ca 0.05 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 1cn3 h LYS 204 Cb 0.24 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.55 1cn3 h LYS 204 CO -0.00 0.00 0.00 -0.25 -0.57 0.00 0.00 179.45 178.63 1cn3 n ASP 205 N -2.89 0.00 -0.02 0.86 8.00 0.20 -1.65 116.55 121.05 1cn3 n ASP 205 Ca -0.02 0.43 0.13 0.00 0.71 0.00 0.00 54.79 56.04 1cn3 n ASP 205 Cb 0.12 -0.47 0.44 0.00 -0.02 0.00 0.00 41.12 41.20 1cn3 n ASP 205 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1cn3 n GLN 206 N -1.47 0.09 0.00 -1.24 6.02 -0.79 -0.62 117.38 119.37 1cn3 n GLN 206 Ca 0.05 -0.03 0.00 0.00 -0.01 0.00 0.00 57.00 57.00 1cn3 n GLN 206 Cb 0.18 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 29.94 1cn3 n GLN 206 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 177.06 177.38 1cn3 n VAL 207 N -1.43 0.00 -2.97 5.09 0.24 -0.66 -4.68 118.33 113.93 1cn3 n VAL 207 Ca 0.07 0.00 -0.43 0.00 -2.04 0.00 0.00 64.34 61.94 1cn3 n VAL 207 Cb 0.33 0.00 -0.05 0.00 -1.47 0.00 0.00 33.84 32.65 1cn3 n VAL 207 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 1cn3 s LEU 208 N 0.00 4.26 -0.32 1.34 0.20 -1.25 -4.73 118.68 118.18 1cn3 s LEU 208 Ca 0.00 -0.11 -0.01 0.00 0.69 0.00 0.00 54.13 54.69 1cn3 s LEU 208 Cb 0.00 -2.96 0.07 0.00 -0.43 0.00 0.00 46.19 42.87 1cn3 s LEU 208 CO 0.00 -0.91 0.04 0.21 -0.29 0.00 0.00 176.35 175.39 1cn3 s ASN 209 N 2.13 4.93 0.66 3.68 2.47 -1.23 -4.96 114.94 122.61 1cn3 s ASN 209 Ca 0.30 -1.50 0.34 0.00 0.42 0.00 0.00 52.86 52.42 1cn3 s ASN 209 Cb -0.12 -1.72 1.84 0.00 -1.45 0.00 0.00 41.25 39.80 1cn3 s ASN 209 CO 0.23 -0.32 2.06 -0.65 -3.72 0.00 0.00 177.10 174.69 1cn3 h PRO 210 N 7.96 0.00 0.00 0.43 0.11 -1.94 -0.60 132.00 137.96 1cn3 h PRO 210 Ca -0.18 0.00 -0.13 0.00 0.11 0.00 0.00 66.00 65.80 1cn3 h PRO 210 Cb 1.05 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.15 1cn3 h PRO 210 CO 0.56 0.00 -0.61 0.82 -0.21 0.00 0.00 178.00 178.56 1cn3 h ILE 211 N 0.00 1.33 -1.67 4.15 2.04 -1.99 -3.38 117.51 117.98 1cn3 h ILE 211 Ca 0.02 -2.17 -0.72 0.00 1.00 0.00 0.00 64.86 62.99 1cn3 h ILE 211 Cb 0.50 2.21 -0.14 0.00 -0.74 0.00 0.00 36.82 38.64 1cn3 h ILE 211 CO -0.00 0.60 1.69 -1.20 0.00 0.00 0.00 178.15 179.23 1cn3 n SER 212 N -3.65 5.11 -4.28 1.72 7.64 -0.24 -4.92 113.62 115.00 1cn3 n SER 212 Ca -0.01 -2.96 -0.23 0.00 1.01 0.00 0.00 58.87 56.68 1cn3 n SER 212 Cb 0.64 -1.64 -0.12 0.00 -1.01 0.00 0.00 64.21 62.08 1cn3 n SER 212 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 1cn3 s LYS 213 N 2.52 1.11 0.26 1.43 1.02 -1.26 0.27 119.74 125.09 1cn3 s LYS 213 Ca 0.47 -1.17 -0.03 0.00 0.02 0.00 0.00 55.97 55.25 1cn3 s LYS 213 Cb -0.00 -1.34 0.01 0.00 -0.52 0.00 0.00 37.83 35.99 1cn3 s LYS 213 CO 0.03 0.31 0.40 0.00 -0.92 0.00 0.00 175.35 175.16 1cn3 n ALA 214 N 1.02 -0.48 -2.53 5.17 0.00 -0.74 -4.95 120.51 118.00 1cn3 n ALA 214 Ca -0.19 -1.09 -0.24 0.00 0.00 0.00 0.00 53.44 51.93 1cn3 n ALA 214 Cb 0.54 0.87 -0.15 0.00 0.00 0.00 0.00 19.45 20.71 1cn3 n ALA 214 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1cn3 s LYS 215 N -2.44 1.28 -1.02 0.00 1.02 -1.26 -1.11 119.74 116.21 1cn3 s LYS 215 Ca 0.18 -0.66 -0.22 0.00 0.02 0.00 0.00 55.97 55.29 1cn3 s LYS 215 Cb -0.01 -1.27 0.06 0.00 -0.52 0.00 0.00 37.83 36.09 1cn3 s LYS 215 CO 0.13 0.34 1.41 -1.17 -0.92 0.00 0.00 175.35 175.14 1cn3 s LEU 216 N -0.61 3.76 0.00 3.17 2.96 1.00 -4.65 118.68 124.30 1cn3 s LEU 216 Ca 0.06 -1.58 0.05 0.00 -0.22 0.00 0.00 54.13 52.44 1cn3 s LEU 216 Cb -0.07 -2.54 0.12 0.00 0.50 0.00 0.00 46.19 44.20 1cn3 s LEU 216 CO -0.00 -1.43 1.04 -0.90 -1.32 0.00 0.00 176.35 173.74 1cn3 n ASP 217 N 8.50 2.24 -3.88 3.68 3.85 -1.26 -4.14 116.55 125.54 1cn3 n ASP 217 Ca 0.32 -1.87 -0.12 0.00 -0.71 0.00 0.00 54.79 52.41 1cn3 n ASP 217 Cb 0.51 -0.08 -0.13 0.00 -1.35 0.00 0.00 41.12 40.06 1cn3 n ASP 217 CO 0.00 0.00 0.00 -0.54 -1.01 0.00 0.00 177.20 175.65 1cn3 s LYS 218 N -0.91 0.10 0.21 0.11 1.02 -1.26 -5.12 119.74 113.89 1cn3 s LYS 218 Ca 0.09 -0.06 -0.22 0.00 0.02 0.00 0.00 55.97 55.80 1cn3 s LYS 218 Cb 0.05 0.04 -0.08 0.00 -0.52 0.00 0.00 37.83 37.32 1cn3 s LYS 218 CO 0.07 -0.02 0.77 0.34 -0.92 0.00 0.00 175.35 175.59 1cn3 s ASP 219 N -0.25 7.21 -1.46 2.83 2.15 -1.26 -4.25 116.67 121.64 1cn3 s ASP 219 Ca -0.03 1.55 -0.08 0.00 0.43 0.00 0.00 52.55 54.42 1cn3 s ASP 219 Cb -0.02 -2.47 0.02 0.00 -0.30 0.00 0.00 42.92 40.16 1cn3 s ASP 219 CO -0.00 0.09 0.89 0.61 -0.17 0.00 0.00 175.17 176.59 1cn3 n GLY 220 N 1.03 -0.53 0.00 2.66 0.00 -0.11 -4.85 105.19 103.38 1cn3 n GLY 220 Ca -0.03 0.19 0.00 0.00 0.00 0.00 0.00 46.02 46.18 1cn3 n GLY 220 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1cn3 n MET 221 N -4.51 2.26 -3.41 1.61 2.81 -1.26 -4.91 117.12 109.71 1cn3 n MET 221 Ca -0.04 0.00 -0.44 0.00 -1.81 0.00 0.00 57.70 55.42 1cn3 n MET 221 Cb 0.58 -0.62 -0.09 0.00 -0.71 0.00 0.00 33.22 32.38 1cn3 n MET 221 CO 0.00 0.00 0.00 0.71 1.51 0.00 0.00 175.97 178.19 1cn3 s TYR 222 N -0.96 3.24 0.27 2.03 2.02 -1.26 0.10 117.35 122.79 1cn3 s TYR 222 Ca 0.00 -0.77 -0.30 0.00 -0.37 0.00 0.00 57.07 55.63 1cn3 s TYR 222 Cb 0.00 -2.92 -0.11 0.00 -0.40 0.00 0.00 41.96 38.53 1cn3 s TYR 222 CO 0.00 -0.71 1.56 -2.14 -1.57 0.00 0.00 175.55 172.69 1cn3 s PRO 223 N 1.68 4.16 0.26 -1.71 0.02 -1.26 -0.70 135.00 137.46 1cn3 s PRO 223 Ca 0.05 2.50 0.24 0.00 0.02 0.00 0.00 61.00 63.81 1cn3 s PRO 223 Cb -0.22 -3.05 0.96 0.00 0.02 0.00 0.00 34.50 32.21 1cn3 s PRO 223 CO 0.08 -0.58 1.73 1.33 -0.33 0.00 0.00 177.00 179.23 1cn3 n VAL 224 N 2.41 0.78 1.60 3.83 0.24 -0.67 -1.40 118.33 125.11 1cn3 n VAL 224 Ca 0.09 0.12 0.15 0.00 -2.04 0.00 0.00 64.34 62.66 1cn3 n VAL 224 Cb 0.38 -1.05 0.71 0.00 -1.47 0.00 0.00 33.84 32.41 1cn3 n VAL 224 CO 0.00 0.00 0.00 -1.84 -2.14 0.00 0.00 176.83 172.85 1cn3 n GLU 225 N -2.27 0.90 -0.03 7.34 0.28 -1.26 -4.04 120.64 121.56 1cn3 n GLU 225 Ca 0.03 -0.25 -0.04 0.00 -0.16 0.00 0.00 57.16 56.73 1cn3 n GLU 225 Cb 0.27 -1.49 -0.02 0.00 1.43 0.00 0.00 31.44 31.62 1cn3 n GLU 225 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 177.13 176.08 1cn3 n ILE 226 N -0.83 0.32 -3.87 3.84 5.41 -0.61 -4.50 119.36 119.11 1cn3 n ILE 226 Ca 0.18 -0.11 -0.36 0.00 1.00 0.00 0.00 62.75 63.46 1cn3 n ILE 226 Cb 0.24 -0.90 -0.13 0.00 -0.71 0.00 0.00 39.64 38.14 1cn3 n ILE 226 CO 0.00 0.00 0.00 0.26 0.00 0.00 0.00 176.55 176.81 1cn3 s TRP 227 N -2.11 3.05 0.16 1.39 0.52 -0.50 -0.65 118.94 120.79 1cn3 s TRP 227 Ca -0.08 -0.55 0.11 0.00 0.02 0.00 0.00 56.10 55.60 1cn3 s TRP 227 Cb 0.02 -2.17 -0.04 0.00 -1.15 0.00 0.00 33.47 30.13 1cn3 s TRP 227 CO 0.12 -0.37 -0.25 -1.01 0.02 0.00 0.00 176.95 175.46 1cn3 s HIS 228 N 1.43 2.22 0.26 -1.98 3.76 -0.31 -4.66 115.29 116.01 1cn3 s HIS 228 Ca 0.05 -0.38 -0.31 0.00 -0.15 0.00 0.00 55.06 54.28 1cn3 s HIS 228 Cb -0.15 -1.16 -0.13 0.00 1.11 0.00 0.00 32.58 32.25 1cn3 s HIS 228 CO 0.01 0.39 1.37 -2.30 -0.85 0.00 0.00 174.74 173.36 1cn3 n PRO 229 N 0.62 2.01 -3.00 8.40 -0.02 -1.26 0.82 135.00 142.57 1cn3 n PRO 229 Ca -0.16 0.71 -0.43 0.00 -2.02 0.00 0.00 63.50 61.61 1cn3 n PRO 229 Cb 0.55 -2.34 -0.06 0.00 -0.02 0.00 0.00 33.50 31.63 1cn3 n PRO 229 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1cn3 s ASP 230 N 0.14 6.44 0.16 2.55 -1.08 0.22 -4.51 116.67 120.60 1cn3 s ASP 230 Ca 0.66 0.01 0.22 0.00 -0.52 0.00 0.00 52.55 52.92 1cn3 s ASP 230 Cb -0.64 -2.37 0.88 0.00 -1.46 0.00 0.00 42.92 39.33 1cn3 s ASP 230 CO 0.52 -0.82 1.68 -0.81 0.52 0.00 0.00 175.17 176.27 1cn3 n PRO 231 N 6.51 0.14 0.00 4.34 -0.04 -1.26 -2.13 135.00 142.57 1cn3 n PRO 231 Ca 0.02 0.31 0.13 0.00 -0.04 0.00 0.00 63.50 63.91 1cn3 n PRO 231 Cb 0.48 -1.73 0.40 0.00 -0.04 0.00 0.00 33.50 32.61 1cn3 n PRO 231 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1cn3 n ALA 232 N -1.68 3.08 -2.97 0.55 0.00 -1.26 -4.84 120.51 113.38 1cn3 n ALA 232 Ca 0.03 -0.26 0.00 0.00 0.00 0.00 0.00 53.44 53.21 1cn3 n ALA 232 Cb 0.26 -1.25 0.00 0.00 0.00 0.00 0.00 19.45 18.46 1cn3 n ALA 232 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1cn3 n LYS 233 N -1.44 0.00 -3.72 0.00 5.02 -0.90 -4.93 118.16 112.18 1cn3 n LYS 233 Ca 0.07 0.00 -0.28 0.00 -2.02 0.00 0.00 58.31 56.08 1cn3 n LYS 233 Cb 0.33 0.00 -0.02 0.00 -0.02 0.00 0.00 35.03 35.32 1cn3 n LYS 233 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1cn3 n ASN 234 N 0.00 -3.17 0.16 4.39 3.02 -1.26 -4.81 115.26 113.59 1cn3 n ASN 234 Ca 0.00 -0.62 0.09 0.00 -0.03 0.00 0.00 54.58 54.01 1cn3 n ASN 234 Cb 0.00 -2.64 0.59 0.00 -0.61 0.00 0.00 39.78 37.13 1cn3 n ASN 234 CO 0.00 0.00 0.00 -0.08 -2.62 0.00 0.00 177.26 174.56 1cn3 h GLU 235 N -1.06 0.13 -0.32 3.52 4.57 -1.92 -2.90 114.58 116.60 1cn3 h GLU 235 Ca -0.47 -0.01 -0.12 0.00 -1.18 0.00 0.00 59.36 57.59 1cn3 h GLU 235 Cb 1.31 -0.03 -0.07 0.00 -0.16 0.00 0.00 28.75 29.80 1cn3 h GLU 235 CO 0.61 0.09 -0.03 -1.71 -1.18 0.00 0.00 179.01 176.79 1cn3 n ASN 236 N -4.51 3.00 -3.90 1.04 5.15 -1.26 -4.98 115.26 109.80 1cn3 n ASN 236 Ca 0.00 -3.47 -0.11 0.00 -0.60 0.00 0.00 54.58 50.40 1cn3 n ASN 236 Cb 0.15 -0.60 -0.12 0.00 -0.53 0.00 0.00 39.78 38.68 1cn3 n ASN 236 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 1cn3 s THR 237 N -3.09 0.05 -0.12 -0.44 2.01 -1.09 -0.89 115.64 112.06 1cn3 s THR 237 Ca 0.44 -0.38 -0.00 0.00 0.31 0.00 0.00 61.69 62.05 1cn3 s THR 237 Cb 0.38 -0.17 -0.02 0.00 0.01 0.00 0.00 72.50 72.70 1cn3 s THR 237 CO 0.03 -0.21 -0.11 -0.13 -0.69 0.00 0.00 174.62 173.51 1cn3 s ARG 238 N -0.64 3.28 0.08 4.92 1.81 0.20 -4.94 118.95 123.67 1cn3 s ARG 238 Ca -0.07 -0.65 0.04 0.00 -1.72 0.00 0.00 55.73 53.34 1cn3 s ARG 238 Cb -0.04 -2.65 -0.03 0.00 -0.45 0.00 0.00 34.95 31.78 1cn3 s ARG 238 CO -0.00 0.30 -0.12 1.52 -0.68 0.00 0.00 175.30 176.32 1cn3 s TYR 239 N 0.13 1.11 -0.10 -0.53 1.13 -1.26 -1.65 117.35 116.18 1cn3 s TYR 239 Ca -0.05 -0.54 -0.04 0.00 -1.41 0.00 0.00 57.07 55.02 1cn3 s TYR 239 Cb -0.15 -0.61 0.05 0.00 -1.10 0.00 0.00 41.96 40.15 1cn3 s TYR 239 CO 0.04 0.03 0.19 -0.06 -2.51 0.00 0.00 175.55 173.24 1cn3 s PHE 240 N -1.80 -0.25 0.08 -3.49 0.08 0.15 -5.00 117.98 107.75 1cn3 s PHE 240 Ca 0.01 0.71 -0.00 0.00 0.12 0.00 0.00 56.93 57.76 1cn3 s PHE 240 Cb -0.07 -0.18 -0.04 0.00 -0.57 0.00 0.00 43.02 42.16 1cn3 s PHE 240 CO 0.01 -0.29 -0.02 0.20 -0.10 0.00 0.00 175.22 175.03 1cn3 s GLY 241 N 2.23 0.64 -0.05 4.36 0.00 -1.26 -1.75 107.32 111.49 1cn3 s GLY 241 Ca 0.02 -1.30 -0.14 0.00 0.00 0.00 0.00 44.72 43.30 1cn3 s GLY 241 CO -0.07 -1.36 0.33 0.54 0.00 0.00 0.00 173.10 172.55 1cn3 s ASN 242 N -2.97 -0.25 -0.03 1.64 2.20 0.34 -4.98 114.94 110.89 1cn3 s ASN 242 Ca 0.12 0.29 0.03 0.00 -0.94 0.00 0.00 52.86 52.36 1cn3 s ASN 242 Cb 0.07 0.44 -0.00 0.00 -2.00 0.00 0.00 41.25 39.76 1cn3 s ASN 242 CO -0.06 -0.35 -0.13 -0.47 -2.94 0.00 0.00 177.10 173.14 1cn3 s TYR 243 N -0.86 1.31 -0.09 1.54 6.14 -1.26 -1.10 117.35 123.03 1cn3 s TYR 243 Ca -0.09 -0.35 -0.00 0.00 0.64 0.00 0.00 57.07 57.27 1cn3 s TYR 243 Cb -0.04 -0.90 0.02 0.00 0.42 0.00 0.00 41.96 41.46 1cn3 s TYR 243 CO 0.03 -0.12 -0.06 0.99 0.64 0.00 0.00 175.55 177.03 1cn3 s THR 244 N 0.09 0.86 0.00 4.34 2.01 -0.23 -5.00 115.64 117.71 1cn3 s THR 244 Ca -0.03 -0.21 0.00 0.00 0.31 0.00 0.00 61.69 61.76 1cn3 s THR 244 Cb -0.10 -0.90 0.00 0.00 0.01 0.00 0.00 72.50 71.51 1cn3 s THR 244 CO 0.01 0.33 0.00 0.61 -0.69 0.00 0.00 174.62 174.88 1cn3 n GLY 245 N 4.78 1.31 0.00 4.40 0.00 -1.26 -0.18 105.19 114.24 1cn3 n GLY 245 Ca -0.14 -1.81 0.00 0.00 0.00 0.00 0.00 46.02 44.07 1cn3 n GLY 245 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1cn3 n GLY 246 N 5.00 1.16 0.05 -0.02 0.00 -1.26 -4.26 105.19 105.86 1cn3 n GLY 246 Ca 0.00 -1.99 -0.04 0.00 0.00 0.00 0.00 46.02 43.99 1cn3 n GLY 246 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1cn3 n THR 247 N 1.71 0.71 -1.67 2.61 -2.24 -1.26 -2.76 114.28 111.38 1cn3 n THR 247 Ca 0.00 -0.49 0.04 0.00 -2.27 0.00 0.00 64.05 61.33 1cn3 n THR 247 Cb 0.00 -0.51 0.07 0.00 -2.10 0.00 0.00 70.33 67.79 1cn3 n THR 247 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1cn3 n THR 248 N -2.38 0.86 -1.72 4.28 -2.24 -1.26 -3.66 114.28 108.16 1cn3 n THR 248 Ca -0.17 -1.16 -0.42 0.00 -2.27 0.00 0.00 64.05 60.03 1cn3 n THR 248 Cb 0.81 0.22 -0.03 0.00 -2.10 0.00 0.00 70.33 69.23 1cn3 n THR 248 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1cn3 n THR 249 N -0.57 0.30 -2.00 4.28 -1.04 -1.26 -4.26 114.28 109.73 1cn3 n THR 249 Ca 0.08 -0.07 -0.42 0.00 -2.04 0.00 0.00 64.05 61.59 1cn3 n THR 249 Cb 0.72 -1.94 -0.03 0.00 -1.82 0.00 0.00 70.33 67.26 1cn3 n THR 249 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 1cn3 s PRO 250 N 0.66 4.23 0.40 -2.82 0.02 -1.26 -0.19 135.00 136.04 1cn3 s PRO 250 Ca 0.72 2.26 -0.25 0.00 0.02 0.00 0.00 61.00 63.75 1cn3 s PRO 250 Cb -0.52 -3.40 -0.08 0.00 0.02 0.00 0.00 34.50 30.52 1cn3 s PRO 250 CO 0.37 -0.63 1.19 -2.14 -0.33 0.00 0.00 177.00 175.47 1cn3 s PRO 251 N 1.91 4.02 -0.01 5.54 0.02 -1.26 -4.92 135.00 140.30 1cn3 s PRO 251 Ca 0.70 1.89 0.03 0.00 0.02 0.00 0.00 61.00 63.65 1cn3 s PRO 251 Cb -0.40 -2.68 -0.01 0.00 0.02 0.00 0.00 34.50 31.44 1cn3 s PRO 251 CO 0.31 -0.36 -0.11 0.08 -0.33 0.00 0.00 177.00 176.59 1cn3 s VAL 252 N -1.39 0.88 -0.26 3.83 1.01 -1.26 -5.13 120.40 118.08 1cn3 s VAL 252 Ca 0.57 -0.47 -0.21 0.00 0.00 0.00 0.00 61.98 61.88 1cn3 s VAL 252 Cb -0.32 -0.74 0.07 0.00 0.00 0.00 0.00 36.38 35.39 1cn3 s VAL 252 CO 0.40 0.25 0.67 -0.22 0.00 0.00 0.00 175.10 176.20 1cn3 s LEU 253 N -0.20 -0.68 0.11 3.92 2.96 -1.26 -5.15 118.68 118.39 1cn3 s LEU 253 Ca 0.03 1.39 0.08 0.00 -0.22 0.00 0.00 54.13 55.41 1cn3 s LEU 253 Cb -0.05 2.30 -0.04 0.00 0.50 0.00 0.00 46.19 48.90 1cn3 s LEU 253 CO -0.00 -0.23 -0.14 -1.10 -1.32 0.00 0.00 176.35 173.55 1cn3 s GLN 254 N 0.80 1.94 -0.13 1.98 -0.21 -1.26 -5.09 119.66 117.69 1cn3 s GLN 254 Ca -0.04 -1.11 -0.09 0.00 0.02 0.00 0.00 55.36 54.15 1cn3 s GLN 254 Cb -0.05 -2.20 0.04 0.00 1.00 0.00 0.00 33.01 31.80 1cn3 s GLN 254 CO -0.06 0.49 0.32 -0.59 -2.12 0.00 0.00 175.29 173.33 1cn3 s PHE 255 N -1.17 -0.41 -0.08 0.91 -0.71 -1.26 -4.80 117.98 110.46 1cn3 s PHE 255 Ca 0.19 0.95 -0.30 0.00 -1.04 0.00 0.00 56.93 56.73 1cn3 s PHE 255 Cb -0.11 0.14 0.07 0.00 -1.21 0.00 0.00 43.02 41.91 1cn3 s PHE 255 CO 0.12 -0.24 0.68 -0.08 -1.34 0.00 0.00 175.22 174.36 1cn3 s THR 256 N 0.86 0.00 -0.63 -4.49 -1.32 -1.26 -5.03 115.64 103.77 1cn3 s THR 256 Ca -0.06 -0.00 0.13 0.00 -1.21 0.00 0.00 61.69 60.55 1cn3 s THR 256 Cb -0.07 -1.00 0.66 0.00 -1.51 0.00 0.00 72.50 70.59 1cn3 s THR 256 CO -0.06 -0.00 1.53 -0.46 -2.21 0.00 0.00 174.62 173.42 1cn3 n ASN 257 N 1.13 4.70 -0.55 8.08 6.94 -1.26 -4.29 115.26 130.02 1cn3 n ASN 257 Ca -0.18 -2.66 0.05 0.00 -0.02 0.00 0.00 54.58 51.77 1cn3 n ASN 257 Cb 0.57 -0.62 0.13 0.00 -2.36 0.00 0.00 39.78 37.50 1cn3 n ASN 257 CO 0.00 0.00 0.00 0.35 -1.03 0.00 0.00 177.26 176.58 1cn3 n THR 258 N 0.64 1.01 -4.79 5.53 -2.24 -1.26 -4.99 114.28 108.19 1cn3 n THR 258 Ca 0.23 -1.01 -0.31 0.00 -2.27 0.00 0.00 64.05 60.69 1cn3 n THR 258 Cb 0.96 0.50 -0.13 0.00 -2.10 0.00 0.00 70.33 69.55 1cn3 n THR 258 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1cn3 s LEU 259 N -1.01 2.52 0.00 3.22 1.43 -1.26 -5.12 118.68 118.46 1cn3 s LEU 259 Ca 0.20 -0.42 0.05 0.00 -1.03 0.00 0.00 54.13 52.93 1cn3 s LEU 259 Cb 0.10 -1.48 -0.01 0.00 0.03 0.00 0.00 46.19 44.83 1cn3 s LEU 259 CO 0.13 0.28 -0.14 -0.89 0.23 0.00 0.00 176.35 175.96 1cn3 s THR 260 N -0.85 1.14 -0.27 5.49 2.01 -1.26 -4.58 115.64 117.32 1cn3 s THR 260 Ca 0.13 -0.72 -0.07 0.00 0.31 0.00 0.00 61.69 61.34 1cn3 s THR 260 Cb -0.10 -0.97 -0.02 0.00 0.01 0.00 0.00 72.50 71.42 1cn3 s THR 260 CO 0.04 0.24 0.08 -0.89 -0.69 0.00 0.00 174.62 173.39 1cn3 s THR 261 N -0.47 4.23 0.09 -0.82 2.01 0.91 -4.94 115.64 116.64 1cn3 s THR 261 Ca 0.05 -0.35 -0.30 0.00 0.31 0.00 0.00 61.69 61.40 1cn3 s THR 261 Cb -0.06 -3.05 -0.06 0.00 0.01 0.00 0.00 72.50 69.34 1cn3 s THR 261 CO -0.00 0.24 1.14 -0.69 -0.69 0.00 0.00 174.62 174.62 1cn3 s VAL 262 N 1.58 4.09 -2.60 3.82 1.01 -1.26 -0.34 120.40 126.70 1cn3 s VAL 262 Ca 0.05 1.59 0.21 0.00 0.00 0.00 0.00 61.98 63.83 1cn3 s VAL 262 Cb -0.16 -4.02 0.15 0.00 0.00 0.00 0.00 36.38 32.36 1cn3 s VAL 262 CO 0.03 0.17 1.16 0.18 0.00 0.00 0.00 175.10 176.65 1cn3 n LEU 263 N 3.42 2.69 -4.76 3.92 4.77 0.69 -4.94 117.00 122.79 1cn3 n LEU 263 Ca 0.07 -0.97 -0.41 0.00 -0.03 0.00 0.00 56.01 54.67 1cn3 n LEU 263 Cb 0.47 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.53 1cn3 n LEU 263 CO 0.54 0.46 0.93 -0.76 -1.33 0.00 0.00 177.39 177.23 1cn3 s LEU 264 N -1.86 4.46 0.00 2.23 1.43 -1.24 -4.24 118.68 119.46 1cn3 s LEU 264 Ca 0.24 2.53 0.00 0.00 -1.03 0.00 0.00 54.13 55.87 1cn3 s LEU 264 Cb 0.18 -3.64 0.00 0.00 0.03 0.00 0.00 46.19 42.76 1cn3 s LEU 264 CO 0.30 -0.42 0.00 -0.90 0.23 0.00 0.00 176.35 175.56 1cn3 n ASP 265 N 1.19 0.00 0.33 2.29 5.68 0.10 -4.80 116.55 121.33 1cn3 n ASP 265 Ca 0.01 -0.96 0.20 0.00 -0.50 0.00 0.00 54.79 53.54 1cn3 n ASP 265 Cb 0.43 0.00 1.13 0.00 -1.14 0.00 0.00 41.12 41.53 1cn3 n ASP 265 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 1cn3 h GLU 266 N 0.00 0.00 -0.64 0.11 9.09 -1.96 0.56 114.58 121.73 1cn3 h GLU 266 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 1cn3 h GLU 266 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.10 1cn3 h GLU 266 CO 0.00 0.00 0.00 0.09 0.05 0.00 0.00 179.01 179.15 1cn3 n ASN 267 N -3.31 3.49 -0.04 3.06 3.02 -1.26 -4.90 115.26 115.31 1cn3 n ASN 267 Ca -0.03 -2.03 -0.01 0.00 -0.03 0.00 0.00 54.58 52.49 1cn3 n ASN 267 Cb 0.08 -0.44 -0.00 0.00 -0.61 0.00 0.00 39.78 38.81 1cn3 n ASN 267 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1cn3 n GLY 268 N 1.49 0.45 3.49 7.41 0.00 0.19 -5.03 105.19 113.19 1cn3 n GLY 268 Ca 0.22 -0.76 -0.34 0.00 0.00 0.00 0.00 46.02 45.14 1cn3 n GLY 268 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1cn3 s VAL 269 N -2.01 3.65 0.59 1.61 1.01 -1.26 -4.76 120.40 119.24 1cn3 s VAL 269 Ca 0.00 -0.46 0.07 0.00 0.00 0.00 0.00 61.98 61.59 1cn3 s VAL 269 Cb 0.00 -2.56 0.09 0.00 0.00 0.00 0.00 36.38 33.90 1cn3 s VAL 269 CO 0.00 0.52 0.82 -0.83 0.00 0.00 0.00 175.10 175.61 1cn3 s GLY 270 N 0.11 1.76 0.24 4.51 0.00 -1.26 0.02 107.32 112.69 1cn3 s GLY 270 Ca -0.02 -2.00 -0.31 0.00 0.00 0.00 0.00 44.72 42.39 1cn3 s GLY 270 CO 0.03 -1.54 1.26 -1.05 0.00 0.00 0.00 173.10 171.80 1cn3 n PRO 271 N -2.34 1.67 -4.09 2.90 -0.02 -1.22 -4.64 135.00 127.26 1cn3 n PRO 271 Ca 0.15 0.59 -0.34 0.00 -2.02 0.00 0.00 63.50 61.88 1cn3 n PRO 271 Cb 0.61 -2.15 -0.10 0.00 -0.02 0.00 0.00 33.50 31.84 1cn3 n PRO 271 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1cn3 s LEU 272 N 0.21 3.69 -0.85 2.45 1.43 -1.26 -0.63 118.68 123.71 1cn3 s LEU 272 Ca 0.67 0.03 -0.24 0.00 -1.03 0.00 0.00 54.13 53.56 1cn3 s LEU 272 Cb -0.71 -1.92 0.05 0.00 0.03 0.00 0.00 46.19 43.64 1cn3 s LEU 272 CO 0.53 0.17 1.29 0.00 0.23 0.00 0.00 176.35 178.57 1cn3 h LYS 274 N 9.76 -0.35 -0.65 0.00 1.57 -1.79 -1.58 116.57 123.53 1cn3 h LYS 274 Ca -0.06 0.02 -0.30 0.00 -1.87 0.00 0.00 60.65 58.44 1cn3 h LYS 274 Cb 1.04 0.08 -0.18 0.00 0.08 0.00 0.00 32.23 33.25 1cn3 h LYS 274 CO 1.31 -0.24 0.26 0.41 -0.57 0.00 0.00 179.45 180.62 1cn3 n GLY 275 N -1.41 4.50 2.51 3.86 0.00 -1.26 -4.88 105.19 108.51 1cn3 n GLY 275 Ca -0.02 -1.13 -0.20 0.00 0.00 0.00 0.00 46.02 44.67 1cn3 n GLY 275 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1cn3 n GLU 276 N -0.94 -1.45 -3.76 1.61 4.71 -0.60 -4.95 120.64 115.26 1cn3 n GLU 276 Ca 0.44 1.12 -0.36 0.00 -0.01 0.00 0.00 57.16 58.35 1cn3 n GLU 276 Cb 1.32 -5.55 -0.11 0.00 -1.01 0.00 0.00 31.44 26.09 1cn3 n GLU 276 CO 0.00 0.00 0.00 0.20 0.09 0.00 0.00 177.13 177.42 1cn3 s GLY 277 N -2.57 1.84 -0.21 0.62 0.00 -1.26 -0.44 107.32 105.31 1cn3 s GLY 277 Ca 0.00 -1.03 -0.09 0.00 0.00 0.00 0.00 44.72 43.60 1cn3 s GLY 277 CO 0.00 0.46 0.10 -2.27 0.00 0.00 0.00 173.10 171.39 1cn3 s LEU 278 N 1.37 3.93 -0.22 0.66 2.96 0.20 -4.55 118.68 123.03 1cn3 s LEU 278 Ca 0.06 0.09 -0.09 0.00 -0.22 0.00 0.00 54.13 53.96 1cn3 s LEU 278 Cb -0.15 -2.02 -0.05 0.00 0.50 0.00 0.00 46.19 44.48 1cn3 s LEU 278 CO 0.05 0.13 0.12 -0.31 -1.32 0.00 0.00 176.35 175.02 1cn3 s TYR 279 N 0.66 3.28 -0.11 5.38 1.51 0.08 0.15 117.35 128.29 1cn3 s TYR 279 Ca 0.05 0.12 0.01 0.00 -1.01 0.00 0.00 57.07 56.24 1cn3 s TYR 279 Cb -0.13 -2.21 -0.02 0.00 -0.11 0.00 0.00 41.96 39.50 1cn3 s TYR 279 CO 0.01 0.06 -0.14 -0.51 -1.11 0.00 0.00 175.55 173.86 1cn3 s LEU 280 N 0.88 2.67 0.02 -1.29 1.43 0.42 -1.54 118.68 121.26 1cn3 s LEU 280 Ca 0.06 -0.32 0.01 0.00 -1.03 0.00 0.00 54.13 52.85 1cn3 s LEU 280 Cb -0.13 -1.58 -0.01 0.00 0.03 0.00 0.00 46.19 44.49 1cn3 s LEU 280 CO 0.03 0.20 -0.04 -0.44 0.23 0.00 0.00 176.35 176.33 1cn3 s SER 281 N 0.14 0.43 0.10 2.29 0.01 -0.72 -0.47 113.70 115.49 1cn3 s SER 281 Ca -0.07 -0.31 -0.27 0.00 1.31 0.00 0.00 55.95 56.62 1cn3 s SER 281 Cb -0.15 0.02 0.08 0.00 0.21 0.00 0.00 66.02 66.18 1cn3 s SER 281 CO 0.05 -0.12 1.06 0.00 0.41 0.00 0.00 173.24 174.64 1cn3 s VAL 283 N -3.02 -0.00 -0.38 0.00 0.11 -0.47 -0.46 120.40 116.19 1cn3 s VAL 283 Ca 0.13 0.01 0.01 0.00 -2.93 0.00 0.00 61.98 59.20 1cn3 s VAL 283 Cb 0.01 -0.96 0.14 0.00 -1.53 0.00 0.00 36.38 34.04 1cn3 s VAL 283 CO 0.00 0.00 0.23 -1.81 -3.33 0.00 0.00 175.10 170.20 1cn3 s ASP 284 N 1.55 2.96 -0.16 3.54 1.11 -1.25 -1.15 116.67 123.28 1cn3 s ASP 284 Ca -0.09 -2.39 -0.16 0.00 0.18 0.00 0.00 52.55 50.08 1cn3 s ASP 284 Cb -0.05 -0.54 -0.04 0.00 1.07 0.00 0.00 42.92 43.35 1cn3 s ASP 284 CO -0.18 -0.28 0.41 -0.63 1.18 0.00 0.00 175.17 175.67 1cn3 s ILE 285 N 0.79 5.22 -0.37 0.77 1.01 -0.09 -1.66 121.20 126.86 1cn3 s ILE 285 Ca 0.20 0.79 0.22 0.00 0.00 0.00 0.00 60.65 61.86 1cn3 s ILE 285 Cb -0.20 -3.75 -0.22 0.00 0.01 0.00 0.00 42.46 38.30 1cn3 s ILE 285 CO -0.02 0.31 0.77 0.23 0.00 0.00 0.00 174.94 176.24 1cn3 n MET 286 N 3.94 0.44 0.00 2.79 2.81 0.13 -1.59 117.12 125.65 1cn3 n MET 286 Ca -0.08 -0.07 0.00 0.00 -1.81 0.00 0.00 57.70 55.73 1cn3 n MET 286 Cb 0.51 -1.58 0.00 0.00 -0.71 0.00 0.00 33.22 31.45 1cn3 n MET 286 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1cn3 n GLY 287 N 1.32 0.52 3.30 3.03 0.00 -1.07 -4.46 105.19 107.83 1cn3 n GLY 287 Ca -0.01 -1.74 -0.18 0.00 0.00 0.00 0.00 46.02 44.09 1cn3 n GLY 287 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1cn3 s TRP 288 N -2.43 1.57 0.13 1.61 0.51 0.12 -0.64 118.94 119.80 1cn3 s TRP 288 Ca 0.00 -0.59 0.05 0.00 -2.12 0.00 0.00 56.10 53.45 1cn3 s TRP 288 Cb 0.00 -0.77 -0.04 0.00 -0.81 0.00 0.00 33.47 31.85 1cn3 s TRP 288 CO 0.00 0.25 0.05 -0.98 -0.51 0.00 0.00 176.95 175.76 1cn3 s ARG 289 N -3.28 2.65 -0.06 4.98 1.70 -0.39 -1.63 118.95 122.92 1cn3 s ARG 289 Ca 0.17 -0.89 0.04 0.00 -0.47 0.00 0.00 55.73 54.57 1cn3 s ARG 289 Cb -0.02 -2.55 0.00 0.00 -0.57 0.00 0.00 34.95 31.81 1cn3 s ARG 289 CO 0.05 0.51 -0.17 0.14 -1.08 0.00 0.00 175.30 174.74 1cn3 s VAL 290 N -1.54 1.47 0.92 4.99 -7.23 -1.26 -1.32 120.40 116.42 1cn3 s VAL 290 Ca 0.28 -0.71 -0.14 0.00 -1.81 0.00 0.00 61.98 59.60 1cn3 s VAL 290 Cb -0.11 -1.28 0.15 0.00 0.56 0.00 0.00 36.38 35.70 1cn3 s VAL 290 CO 0.20 0.43 1.20 0.42 -0.31 0.00 0.00 175.10 177.04 1cn3 s THR 291 N 0.27 1.97 -2.13 5.32 -4.23 0.82 -0.49 115.64 117.18 1cn3 s THR 291 Ca -0.10 0.00 0.31 0.00 -1.18 0.00 0.00 61.69 60.72 1cn3 s THR 291 Cb -0.14 -2.88 0.81 0.00 1.34 0.00 0.00 72.50 71.63 1cn3 s THR 291 CO 0.04 0.00 2.09 0.54 -0.54 0.00 0.00 174.62 176.75 1cn3 n ARG 292 N -3.70 1.17 -4.03 3.99 1.74 -1.26 -3.85 116.66 110.71 1cn3 n ARG 292 Ca 0.10 -0.25 -0.32 0.00 -0.77 0.00 0.00 57.85 56.61 1cn3 n ARG 292 Cb 0.60 -1.49 -0.15 0.00 -1.02 0.00 0.00 32.46 30.40 1cn3 n ARG 292 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 1cn3 s ASN 293 N -1.99 4.60 -1.77 0.55 0.01 -1.26 -4.72 114.94 110.37 1cn3 s ASN 293 Ca 0.45 -1.60 -0.00 0.00 -0.71 0.00 0.00 52.86 51.00 1cn3 s ASN 293 Cb 0.22 -1.60 0.00 0.00 0.41 0.00 0.00 41.25 40.28 1cn3 s ASN 293 CO 0.36 -0.26 0.05 -1.22 -1.51 0.00 0.00 177.10 174.52 1cn3 n TYR 294 N 4.41 -1.09 -3.79 2.20 0.53 -1.26 -2.69 117.16 115.47 1cn3 n TYR 294 Ca -0.09 0.04 -0.29 0.00 -1.02 0.00 0.00 57.90 56.54 1cn3 n TYR 294 Cb 0.42 -4.02 -0.01 0.00 -1.03 0.00 0.00 39.34 34.70 1cn3 n TYR 294 CO 0.00 0.00 0.00 -0.25 -1.02 0.00 0.00 176.86 175.59 1cn3 n ASP 295 N -2.06 -3.76 -4.70 7.72 10.43 -1.25 -4.87 116.55 118.06 1cn3 n ASP 295 Ca -0.24 -0.69 -0.42 0.00 2.57 0.00 0.00 54.79 56.01 1cn3 n ASP 295 Cb 0.68 -3.07 -0.03 0.00 1.84 0.00 0.00 41.12 40.54 1cn3 n ASP 295 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 1cn3 s VAL 296 N -3.12 3.03 -0.06 2.53 1.01 -1.09 -4.69 120.40 118.00 1cn3 s VAL 296 Ca 0.58 0.60 -0.10 0.00 0.00 0.00 0.00 61.98 63.07 1cn3 s VAL 296 Cb -0.31 -3.39 -0.05 0.00 0.00 0.00 0.00 36.38 32.64 1cn3 s VAL 296 CO 0.72 0.02 0.25 -1.00 0.00 0.00 0.00 175.10 175.09 1cn3 s HIS 297 N 1.97 3.65 -0.07 5.22 3.76 -1.26 -0.13 115.29 128.42 1cn3 s HIS 297 Ca 0.70 0.71 0.02 0.00 -0.15 0.00 0.00 55.06 56.34 1cn3 s HIS 297 Cb -0.40 -2.07 0.02 0.00 1.11 0.00 0.00 32.58 31.23 1cn3 s HIS 297 CO 0.31 0.69 -0.12 -1.01 -0.85 0.00 0.00 174.74 173.77 1cn3 s HIS 298 N -1.07 1.48 0.49 1.40 3.76 -0.44 -1.38 115.29 119.53 1cn3 s HIS 298 Ca 0.19 -0.58 -0.22 0.00 -0.15 0.00 0.00 55.06 54.30 1cn3 s HIS 298 Cb -0.14 -1.11 -0.07 0.00 1.11 0.00 0.00 32.58 32.38 1cn3 s HIS 298 CO 0.09 -0.32 1.18 -1.58 -0.85 0.00 0.00 174.74 173.26 1cn3 s TRP 299 N 0.84 2.75 -0.08 1.40 0.52 -1.26 -1.26 118.94 121.85 1cn3 s TRP 299 Ca -0.11 1.52 0.04 0.00 0.02 0.00 0.00 56.10 57.57 1cn3 s TRP 299 Cb -0.15 -3.42 -0.00 0.00 -1.15 0.00 0.00 33.47 28.75 1cn3 s TRP 299 CO 0.02 -1.71 -0.23 0.50 0.02 0.00 0.00 176.95 175.55 1cn3 s ARG 300 N -2.86 2.72 0.17 4.98 6.06 0.19 -1.10 118.95 129.10 1cn3 s ARG 300 Ca 0.67 -0.83 0.07 0.00 -2.50 0.00 0.00 55.73 53.14 1cn3 s ARG 300 Cb -0.29 -2.14 -0.04 0.00 0.06 0.00 0.00 34.95 32.54 1cn3 s ARG 300 CO 0.35 0.23 -0.15 0.20 -2.50 0.00 0.00 175.30 173.42 1cn3 s GLY 301 N 0.20 1.33 0.10 8.12 0.00 -0.69 -0.69 107.32 115.70 1cn3 s GLY 301 Ca -0.13 -1.53 0.07 0.00 0.00 0.00 0.00 44.72 43.13 1cn3 s GLY 301 CO 0.07 -1.60 -0.17 1.08 0.00 0.00 0.00 173.10 172.47 1cn3 s LEU 302 N -2.94 2.33 0.58 0.66 1.43 -0.66 -4.81 118.68 115.27 1cn3 s LEU 302 Ca 0.17 -0.71 -0.18 0.00 -1.03 0.00 0.00 54.13 52.39 1cn3 s LEU 302 Cb -0.03 -0.70 -0.04 0.00 0.03 0.00 0.00 46.19 45.45 1cn3 s LEU 302 CO 0.06 -0.03 1.11 -2.16 0.23 0.00 0.00 176.35 175.56 1cn3 s PRO 303 N -2.11 3.20 -0.06 1.29 0.04 -1.26 -4.42 135.00 131.68 1cn3 s PRO 303 Ca 0.05 1.50 0.06 0.00 0.04 0.00 0.00 61.00 62.65 1cn3 s PRO 303 Cb -0.09 -1.99 -0.01 0.00 0.04 0.00 0.00 34.50 32.45 1cn3 s PRO 303 CO 0.04 -0.95 -0.24 0.50 0.04 0.00 0.00 177.00 176.38 1cn3 s ARG 304 N -3.60 2.50 -0.06 4.56 3.52 -0.33 -1.42 118.95 124.12 1cn3 s ARG 304 Ca 0.70 -0.88 -0.05 0.00 -0.13 0.00 0.00 55.73 55.38 1cn3 s ARG 304 Cb -0.22 -2.11 -0.04 0.00 -1.56 0.00 0.00 34.95 31.03 1cn3 s ARG 304 CO 0.32 0.36 0.15 -0.47 -0.81 0.00 0.00 175.30 174.85 1cn3 s TYR 305 N -0.12 3.55 -0.05 5.12 5.04 0.23 -0.53 117.35 130.59 1cn3 s TYR 305 Ca -0.04 0.42 0.02 0.00 -2.44 0.00 0.00 57.07 55.03 1cn3 s TYR 305 Cb -0.14 -1.87 0.01 0.00 0.35 0.00 0.00 41.96 40.31 1cn3 s TYR 305 CO 0.04 0.68 -0.08 -0.06 -1.34 0.00 0.00 175.55 174.79 1cn3 s PHE 306 N -1.17 1.01 -0.23 4.97 0.08 0.10 -0.54 117.98 122.20 1cn3 s PHE 306 Ca 0.21 -0.31 -0.01 0.00 0.12 0.00 0.00 56.93 56.94 1cn3 s PHE 306 Cb -0.12 -0.79 0.07 0.00 -0.57 0.00 0.00 43.02 41.61 1cn3 s PHE 306 CO 0.11 -0.19 0.01 0.21 -0.10 0.00 0.00 175.22 175.26 1cn3 s LYS 307 N 0.65 1.07 -0.16 0.44 2.20 0.28 -0.74 119.74 123.49 1cn3 s LYS 307 Ca -0.11 -0.80 -0.06 0.00 -0.36 0.00 0.00 55.97 54.64 1cn3 s LYS 307 Cb -0.14 -2.31 -0.04 0.00 -1.51 0.00 0.00 37.83 33.83 1cn3 s LYS 307 CO 0.01 -0.69 0.04 0.42 -0.36 0.00 0.00 175.35 174.77 1cn3 s ILE 308 N 1.60 4.58 -0.21 5.43 1.09 0.97 -0.51 121.20 134.16 1cn3 s ILE 308 Ca -0.01 -0.12 -0.09 0.00 -1.10 0.00 0.00 60.65 59.33 1cn3 s ILE 308 Cb -0.18 -3.03 -0.05 0.00 -1.06 0.00 0.00 42.46 38.14 1cn3 s ILE 308 CO -0.10 0.49 0.12 -0.89 -0.10 0.00 0.00 174.94 174.46 1cn3 s THR 309 N 0.14 5.18 0.13 2.92 2.01 -0.31 -0.08 115.64 125.63 1cn3 s THR 309 Ca 0.03 0.11 0.09 0.00 0.31 0.00 0.00 61.69 62.24 1cn3 s THR 309 Cb -0.13 -3.38 -0.04 0.00 0.01 0.00 0.00 72.50 68.97 1cn3 s THR 309 CO 0.01 0.41 -0.22 -0.76 -0.69 0.00 0.00 174.62 173.37 1cn3 s LEU 310 N 0.64 2.35 0.06 4.42 1.02 0.76 -0.50 118.68 127.42 1cn3 s LEU 310 Ca 0.06 -0.76 0.01 0.00 0.02 0.00 0.00 54.13 53.46 1cn3 s LEU 310 Cb -0.12 -0.98 -0.03 0.00 0.02 0.00 0.00 46.19 45.07 1cn3 s LEU 310 CO 0.01 0.07 -0.05 0.00 0.02 0.00 0.00 176.35 176.40 1cn3 s ARG 311 N -2.23 0.60 0.17 1.70 1.70 0.18 -0.50 118.95 120.58 1cn3 s ARG 311 Ca 0.12 -1.02 -0.24 0.00 -0.47 0.00 0.00 55.73 54.12 1cn3 s ARG 311 Cb -0.09 -0.07 -0.08 0.00 -0.57 0.00 0.00 34.95 34.14 1cn3 s ARG 311 CO 0.06 -0.03 0.76 0.15 -1.08 0.00 0.00 175.30 175.16 1cn3 s LYS 312 N -2.80 4.52 0.00 3.89 1.02 0.90 -0.31 119.74 126.97 1cn3 s LYS 312 Ca -0.00 1.11 0.07 0.00 0.02 0.00 0.00 55.97 57.17 1cn3 s LYS 312 Cb -0.01 -3.22 -0.02 0.00 -0.52 0.00 0.00 37.83 34.06 1cn3 s LYS 312 CO -0.04 0.56 -0.22 0.50 -0.92 0.00 0.00 175.35 175.23 1cn3 s ARG 313 N -1.23 1.69 0.02 1.68 6.06 0.13 -0.90 118.95 126.40 1cn3 s ARG 313 Ca 0.36 -0.84 -0.27 0.00 -2.50 0.00 0.00 55.73 52.48 1cn3 s ARG 313 Cb -0.22 -1.69 -0.04 0.00 0.06 0.00 0.00 34.95 33.05 1cn3 s ARG 313 CO 0.25 0.45 0.86 -1.58 -2.50 0.00 0.00 175.30 172.79 1cn3 s TRP 314 N -0.60 3.69 0.04 5.12 0.52 0.18 -0.09 118.94 127.81 1cn3 s TRP 314 Ca 0.08 1.57 0.05 0.00 0.02 0.00 0.00 56.10 57.82 1cn3 s TRP 314 Cb -0.09 -2.96 -0.02 0.00 -1.15 0.00 0.00 33.47 29.25 1cn3 s TRP 314 CO -0.00 0.13 -0.15 0.14 0.02 0.00 0.00 176.95 177.08 1cn3 s VAL 315 N 0.48 1.23 -2.70 4.03 -7.23 0.16 0.05 120.40 116.41 1cn3 s VAL 315 Ca 0.44 -1.03 0.22 0.00 -1.81 0.00 0.00 61.98 59.80 1cn3 s VAL 315 Cb -0.21 -1.10 0.17 0.00 0.56 0.00 0.00 36.38 35.81 1cn3 s VAL 315 CO 0.25 0.06 1.18 1.17 -0.31 0.00 0.00 175.10 177.45