#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k98 s GLN 10 N 0.00 3.77 0.39 -0.67 -1.52 -1.26 -5.10 119.66 115.28 3k98 s GLN 10 Ca 0.00 0.24 -0.24 0.00 -1.95 0.00 0.00 55.36 53.41 3k98 s GLN 10 Cb 0.00 -2.64 -0.10 0.00 -0.22 0.00 0.00 33.01 30.05 3k98 s GLN 10 CO 0.00 0.29 0.98 -1.25 -0.25 0.00 0.00 175.29 175.06 3k98 s PRO 11 N -2.95 4.31 0.13 2.91 0.04 -1.26 -4.99 135.00 133.20 3k98 s PRO 11 Ca 0.47 1.31 -0.14 0.00 0.04 0.00 0.00 61.00 62.68 3k98 s PRO 11 Cb -0.11 -2.49 -0.01 0.00 0.04 0.00 0.00 34.50 31.93 3k98 s PRO 11 CO 0.23 0.02 1.60 0.52 0.04 0.00 0.00 177.00 179.41 3k98 h MET 12 N 2.49 0.74 -5.08 4.56 2.86 -2.08 -3.44 114.93 114.97 3k98 h MET 12 Ca -0.48 -0.22 -0.38 0.00 -2.06 0.00 0.00 59.70 56.56 3k98 h MET 12 Cb 1.20 -0.08 -0.22 0.00 0.06 0.00 0.00 31.60 32.56 3k98 h MET 12 CO 0.63 0.79 -0.77 -1.21 1.06 0.00 0.00 176.91 177.41 3k98 s GLU 13 N -5.09 0.74 -0.04 1.72 8.01 -1.26 -5.13 118.70 117.65 3k98 s GLU 13 Ca -0.13 -0.82 0.00 0.00 0.01 0.00 0.00 54.97 54.04 3k98 s GLU 13 Cb 0.10 -0.69 0.02 0.00 -4.31 0.00 0.00 34.13 29.26 3k98 s GLU 13 CO 0.79 0.15 -0.02 -2.00 0.01 0.00 0.00 175.26 174.20 3k98 s GLU 14 N -1.48 0.58 -0.04 1.61 2.12 -1.26 -5.15 118.70 115.07 3k98 s GLU 14 Ca -0.03 0.00 -0.29 0.00 0.36 0.00 0.00 54.97 55.01 3k98 s GLU 14 Cb -0.09 -0.71 0.08 0.00 0.26 0.00 0.00 34.13 33.67 3k98 s GLU 14 CO 0.01 -0.14 0.74 -1.83 -0.54 0.00 0.00 175.26 173.51 3k98 s GLU 15 N 1.12 0.98 0.39 4.30 -1.05 -1.26 -5.15 118.70 118.03 3k98 s GLU 15 Ca -0.08 0.09 -0.23 0.00 -0.15 0.00 0.00 54.97 54.59 3k98 s GLU 15 Cb -0.14 0.46 -0.10 0.00 -0.44 0.00 0.00 34.13 33.92 3k98 s GLU 15 CO -0.01 -0.34 0.98 -1.21 0.95 0.00 0.00 175.26 175.63 3k98 s GLU 16 N -1.69 4.31 -0.08 -4.83 0.41 -1.26 -5.07 118.70 110.50 3k98 s GLU 16 Ca -0.06 1.31 0.02 0.00 -0.41 0.00 0.00 54.97 55.82 3k98 s GLU 16 Cb -0.00 -2.48 0.02 0.00 -1.78 0.00 0.00 34.13 29.88 3k98 s GLU 16 CO 0.04 0.02 -0.12 0.08 -0.49 0.00 0.00 175.26 174.79 3k98 s VAL 17 N -1.84 1.20 -0.18 2.63 1.01 -1.26 -4.54 120.40 117.42 3k98 s VAL 17 Ca 0.57 -0.48 -0.03 0.00 0.00 0.00 0.00 61.98 62.04 3k98 s VAL 17 Cb -0.16 -1.11 -0.02 0.00 0.00 0.00 0.00 36.38 35.09 3k98 s VAL 17 CO 0.21 0.38 -0.06 -1.61 0.00 0.00 0.00 175.10 174.01 3k98 s GLU 18 N 0.91 3.48 -0.19 2.72 2.02 -0.80 -4.98 118.70 121.85 3k98 s GLU 18 Ca -0.09 -0.60 -0.16 0.00 0.02 0.00 0.00 54.97 54.13 3k98 s GLU 18 Cb -0.15 -2.89 -0.04 0.00 0.10 0.00 0.00 34.13 31.15 3k98 s GLU 18 CO 0.01 0.04 0.41 0.99 0.02 0.00 0.00 175.26 176.73 3k98 s THR 19 N 0.85 5.20 -0.02 3.63 2.01 -1.26 -1.12 115.64 124.93 3k98 s THR 19 Ca -0.02 0.74 0.03 0.00 0.31 0.00 0.00 61.69 62.75 3k98 s THR 19 Cb -0.15 -3.74 -0.03 0.00 0.01 0.00 0.00 72.50 68.59 3k98 s THR 19 CO 0.01 0.27 -0.07 -0.36 -0.69 0.00 0.00 174.62 173.78 3k98 s PHE 20 N 1.18 2.90 0.13 4.92 0.40 0.96 -4.95 117.98 123.52 3k98 s PHE 20 Ca 0.20 -0.02 -0.30 0.00 -0.60 0.00 0.00 56.93 56.21 3k98 s PHE 20 Cb -0.15 -1.64 -0.06 0.00 0.51 0.00 0.00 43.02 41.68 3k98 s PHE 20 CO 0.08 0.36 0.97 0.00 0.70 0.00 0.00 175.22 177.34 3k98 s ALA 21 N -0.95 3.27 0.59 5.36 0.00 -1.26 -0.92 121.76 127.85 3k98 s ALA 21 Ca 0.16 0.61 -0.19 0.00 0.00 0.00 0.00 51.96 52.53 3k98 s ALA 21 Cb -0.11 -3.28 -0.03 0.00 0.00 0.00 0.00 23.12 19.70 3k98 s ALA 21 CO 0.06 -0.01 1.28 -0.06 0.00 0.00 0.00 175.76 177.02 3k98 s PHE 22 N -0.18 2.27 0.40 0.00 0.08 -0.80 -4.64 117.98 115.11 3k98 s PHE 22 Ca 0.46 1.47 -0.27 0.00 0.12 0.00 0.00 56.93 58.71 3k98 s PHE 22 Cb -0.24 -3.64 -0.10 0.00 -0.57 0.00 0.00 43.02 38.47 3k98 s PHE 22 CO 0.31 -2.62 1.44 -1.14 -0.10 0.00 0.00 175.22 173.11 3k98 s GLN 23 N -3.20 3.99 0.22 0.44 -0.44 0.04 -4.74 119.66 115.96 3k98 s GLN 23 Ca 0.77 2.47 -0.10 0.00 -2.50 0.00 0.00 55.36 56.00 3k98 s GLN 23 Cb -0.36 -2.86 0.32 0.00 -1.64 0.00 0.00 33.01 28.47 3k98 s GLN 23 CO 0.39 -0.59 1.65 0.00 0.50 0.00 0.00 175.29 177.24 3k98 h ALA 24 N 2.80 0.62 -0.27 1.58 0.00 -1.93 0.18 119.26 122.23 3k98 h ALA 24 Ca -0.51 0.21 -0.08 0.00 0.00 0.00 0.00 54.91 54.53 3k98 h ALA 24 Cb 1.25 0.37 -0.01 0.00 0.00 0.00 0.00 17.79 19.40 3k98 h ALA 24 CO 0.63 -0.41 -0.18 0.93 0.00 0.00 0.00 179.25 180.23 3k98 h GLU 25 N 0.09 0.47 -0.07 0.00 5.08 -1.99 0.85 114.58 119.03 3k98 h GLU 25 Ca 0.34 -0.15 -0.15 0.00 -1.00 0.00 0.00 59.36 58.40 3k98 h GLU 25 Cb 0.56 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.76 3k98 h GLU 25 CO -0.58 0.64 -0.62 0.82 -1.00 0.00 0.00 179.01 178.27 3k98 h ILE 26 N 0.43 1.39 -0.70 3.13 2.04 -1.49 -0.80 117.51 121.50 3k98 h ILE 26 Ca 0.07 -2.01 -0.04 0.00 1.00 0.00 0.00 64.86 63.88 3k98 h ILE 26 Cb 0.56 2.02 -0.03 0.00 -0.74 0.00 0.00 36.82 38.63 3k98 h ILE 26 CO 0.04 0.59 0.26 0.00 0.00 0.00 0.00 178.15 179.04 3k98 h ALA 27 N 1.18 0.91 -0.38 1.87 0.00 0.14 -1.44 119.26 121.53 3k98 h ALA 27 Ca -0.01 -0.19 -0.15 0.00 0.00 0.00 0.00 54.91 54.56 3k98 h ALA 27 Cb 1.12 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 3k98 h ALA 27 CO 0.10 0.55 -0.33 1.96 0.00 0.00 0.00 179.25 181.52 3k98 h GLN 28 N 1.01 0.90 0.01 0.00 4.20 -0.63 -2.19 115.11 118.42 3k98 h GLN 28 Ca 0.23 -0.46 0.00 0.00 0.06 0.00 0.00 58.65 58.49 3k98 h GLN 28 Cb 0.23 0.01 -0.00 0.00 0.30 0.00 0.00 27.48 28.02 3k98 h GLN 28 CO -0.02 1.11 -0.02 1.25 -0.67 0.00 0.00 178.83 180.49 3k98 h LEU 29 N 0.72 -0.05 -0.89 1.46 5.85 -1.07 0.54 115.31 121.88 3k98 h LEU 29 Ca 0.07 0.01 0.07 0.00 0.84 0.00 0.00 57.88 58.86 3k98 h LEU 29 Cb 0.92 0.02 -0.06 0.00 0.37 0.00 0.00 40.66 41.90 3k98 h LEU 29 CO 0.08 -0.03 0.55 0.24 -0.34 0.00 0.00 178.44 178.95 3k98 h MET 30 N -0.04 0.96 -0.40 1.25 2.86 -1.20 0.23 114.93 118.59 3k98 h MET 30 Ca 0.00 -0.06 -0.02 0.00 -2.06 0.00 0.00 59.70 57.56 3k98 h MET 30 Cb 0.04 -0.22 -0.02 0.00 0.06 0.00 0.00 31.60 31.46 3k98 h MET 30 CO -0.01 0.63 0.17 1.03 1.06 0.00 0.00 176.91 179.79 3k98 h SER 31 N 0.99 0.55 -0.32 1.22 0.87 -1.04 -0.71 113.55 115.11 3k98 h SER 31 Ca 0.39 -0.16 0.04 0.00 -1.23 0.00 0.00 61.79 60.83 3k98 h SER 31 Cb 0.21 -0.14 -0.04 0.00 -0.44 0.00 0.00 62.40 61.99 3k98 h SER 31 CO -0.19 0.56 0.10 -0.07 -0.53 0.00 0.00 176.83 176.70 3k98 h LEU 32 N 0.50 0.09 -0.90 2.23 3.38 0.03 -1.42 115.31 119.23 3k98 h LEU 32 Ca 0.13 0.04 -0.00 0.00 0.09 0.00 0.00 57.88 58.14 3k98 h LEU 32 Cb 0.18 0.04 -0.04 0.00 0.09 0.00 0.00 40.66 40.92 3k98 h LEU 32 CO -0.01 0.09 0.56 0.40 0.09 0.00 0.00 178.44 179.56 3k98 h ILE 33 N 0.23 1.24 -0.19 1.22 2.04 -0.35 -2.76 117.51 118.94 3k98 h ILE 33 Ca 0.15 -0.50 -0.19 0.00 1.00 0.00 0.00 64.86 65.32 3k98 h ILE 33 Cb 0.13 -0.04 -0.00 0.00 -0.74 0.00 0.00 36.82 36.17 3k98 h ILE 33 CO -0.16 0.25 -0.64 0.40 0.00 0.00 0.00 178.15 178.00 3k98 h ILE 34 N 1.23 1.31 -0.54 -0.67 2.04 -0.79 -3.35 117.51 116.74 3k98 h ILE 34 Ca 0.32 -1.88 0.00 0.00 1.00 0.00 0.00 64.86 64.30 3k98 h ILE 34 Cb -0.08 1.84 0.00 0.00 -0.74 0.00 0.00 36.82 37.84 3k98 h ILE 34 CO -0.06 0.59 0.00 0.59 0.00 0.00 0.00 178.15 179.27 3k98 n ASN 35 N -3.95 3.57 -4.21 1.72 3.02 -0.57 -4.93 115.26 109.92 3k98 n ASN 35 Ca -0.05 -1.98 -0.31 0.00 -0.03 0.00 0.00 54.58 52.22 3k98 n ASN 35 Cb 0.66 -0.36 -0.17 0.00 -0.61 0.00 0.00 39.78 39.31 3k98 n ASN 35 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3k98 s THR 36 N -1.13 1.91 0.14 3.41 2.01 -1.05 -5.05 115.64 115.87 3k98 s THR 36 Ca 0.40 -0.95 -0.30 0.00 0.31 0.00 0.00 61.69 61.15 3k98 s THR 36 Cb 0.22 -1.64 -0.08 0.00 0.01 0.00 0.00 72.50 71.01 3k98 s THR 36 CO 0.29 0.53 1.24 0.12 -0.69 0.00 0.00 174.62 176.11 3k98 s PHE 37 N 0.18 3.38 0.03 4.92 5.36 -1.26 -4.94 117.98 125.65 3k98 s PHE 37 Ca -0.12 1.29 0.03 0.00 -0.96 0.00 0.00 56.93 57.17 3k98 s PHE 37 Cb -0.16 -3.49 -0.02 0.00 -0.34 0.00 0.00 43.02 39.01 3k98 s PHE 37 CO 0.06 -1.51 -0.10 0.71 -1.46 0.00 0.00 175.22 172.92 3k98 s TYR 38 N 0.43 0.86 -0.33 10.12 2.02 -1.26 -5.06 117.35 124.13 3k98 s TYR 38 Ca 0.57 -0.37 0.21 0.00 -0.37 0.00 0.00 57.07 57.11 3k98 s TYR 38 Cb -0.33 -0.51 0.20 0.00 -0.40 0.00 0.00 41.96 40.92 3k98 s TYR 38 CO 0.34 -0.02 1.45 0.66 -1.57 0.00 0.00 175.55 176.41 3k98 h SER 39 N 4.91 0.00 -1.98 2.29 4.64 -2.03 -3.37 113.55 118.01 3k98 h SER 39 Ca -0.35 0.00 -0.64 0.00 -0.47 0.00 0.00 61.79 60.32 3k98 h SER 39 Cb 1.19 0.00 -0.38 0.00 -0.31 0.00 0.00 62.40 62.90 3k98 h SER 39 CO 0.43 0.14 -0.22 0.59 -0.87 0.00 0.00 176.83 176.90 3k98 n ASN 40 N -3.05 5.36 0.26 4.97 4.13 -1.26 -4.83 115.26 120.84 3k98 n ASN 40 Ca 0.02 -3.72 0.17 0.00 1.68 0.00 0.00 54.58 52.74 3k98 n ASN 40 Cb 0.59 -0.68 0.82 0.00 -1.54 0.00 0.00 39.78 38.98 3k98 n ASN 40 CO 0.00 0.00 0.00 0.11 0.28 0.00 0.00 177.26 177.65 3k98 h LYS 41 N 3.02 0.00 0.00 3.52 1.57 -1.99 -3.03 116.57 119.66 3k98 h LYS 41 Ca 0.30 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.08 3k98 h LYS 41 Cb 0.56 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.87 3k98 h LYS 41 CO 0.96 0.00 0.13 1.05 -0.57 0.00 0.00 179.45 181.02 3k98 h GLU 42 N 0.00 0.00 0.00 3.15 4.11 -1.96 -2.91 114.58 116.97 3k98 h GLU 42 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 3k98 h GLU 42 Cb 0.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.49 3k98 h GLU 42 CO 0.00 0.00 0.00 0.44 0.07 0.00 0.00 179.01 179.52 3k98 n ILE 43 N -2.26 0.79 -0.36 -1.06 -5.35 -1.15 -2.63 119.36 107.34 3k98 n ILE 43 Ca -0.01 0.15 0.07 0.00 -0.27 0.00 0.00 62.75 62.69 3k98 n ILE 43 Cb 0.16 -1.03 0.25 0.00 -1.74 0.00 0.00 39.64 37.27 3k98 n ILE 43 CO 0.00 0.00 0.00 2.19 -1.76 0.00 0.00 176.55 176.98 3k98 h PHE 44 N 0.00 1.14 -0.49 4.28 -5.15 -1.80 -1.33 116.94 113.60 3k98 h PHE 44 Ca 0.00 0.03 -0.07 0.00 -0.20 0.00 0.00 57.97 57.73 3k98 h PHE 44 Cb 0.41 -0.36 -0.02 0.00 0.22 0.00 0.00 35.95 36.20 3k98 h PHE 44 CO 0.00 0.45 0.04 1.25 -2.00 0.00 0.00 178.31 178.04 3k98 h LEU 45 N 0.98 0.81 -0.45 2.10 5.85 -1.79 -1.15 115.31 121.66 3k98 h LEU 45 Ca 0.50 -0.29 0.06 0.00 0.84 0.00 0.00 57.88 58.99 3k98 h LEU 45 Cb 0.50 -0.22 -0.05 0.00 0.37 0.00 0.00 40.66 41.26 3k98 h LEU 45 CO -0.26 0.90 0.14 -0.09 -0.34 0.00 0.00 178.44 178.78 3k98 h ARG 46 N 0.70 0.29 -0.49 1.25 2.43 -1.47 -0.16 114.38 116.94 3k98 h ARG 46 Ca 0.14 -0.02 -0.05 0.00 -0.81 0.00 0.00 59.98 59.25 3k98 h ARG 46 Cb 0.46 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.92 3k98 h ARG 46 CO 0.02 0.19 0.11 0.93 -1.51 0.00 0.00 179.97 179.71 3k98 h GLU 47 N 0.30 0.78 -0.12 0.20 4.39 -0.70 0.23 114.58 119.66 3k98 h GLU 47 Ca 0.21 -0.19 -0.10 0.00 0.34 0.00 0.00 59.36 59.62 3k98 h GLU 47 Cb 0.23 -0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 28.77 3k98 h GLU 47 CO -0.24 0.76 -0.37 -0.07 -1.16 0.00 0.00 179.01 177.94 3k98 h LEU 48 N 0.67 0.27 -0.56 1.33 3.38 -0.98 -2.27 115.31 117.14 3k98 h LEU 48 Ca 0.15 -0.10 -0.16 0.00 0.09 0.00 0.00 57.88 57.86 3k98 h LEU 48 Cb 0.34 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 3k98 h LEU 48 CO 0.00 0.62 -0.67 0.40 0.09 0.00 0.00 178.44 178.89 3k98 h ILE 49 N 0.22 1.41 -0.05 1.22 2.04 -0.59 -2.35 117.51 119.41 3k98 h ILE 49 Ca 0.02 -2.12 -0.00 0.00 1.00 0.00 0.00 64.86 63.76 3k98 h ILE 49 Cb 0.76 2.10 -0.00 0.00 -0.74 0.00 0.00 36.82 38.94 3k98 h ILE 49 CO 0.06 0.63 0.03 0.28 0.00 0.00 0.00 178.15 179.14 3k98 h SER 50 N 0.17 0.06 -0.88 1.72 0.02 -0.53 -0.33 113.55 113.78 3k98 h SER 50 Ca -0.01 -0.07 0.05 0.00 -0.84 0.00 0.00 61.79 60.91 3k98 h SER 50 Cb 1.20 -0.02 -0.06 0.00 0.14 0.00 0.00 62.40 63.67 3k98 h SER 50 CO 0.10 0.11 0.56 0.78 -1.14 0.00 0.00 176.83 177.25 3k98 h ASN 51 N 0.01 0.92 -0.07 3.07 2.35 -1.41 -0.04 115.58 120.41 3k98 h ASN 51 Ca 0.02 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.71 3k98 h ASN 51 Cb 0.06 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.23 3k98 h ASN 51 CO -0.00 0.61 -0.13 0.28 -1.65 0.00 0.00 177.43 176.54 3k98 h SER 52 N 1.06 0.38 -0.14 5.81 0.02 -1.06 -1.22 113.55 118.40 3k98 h SER 52 Ca 0.37 -0.09 -0.09 0.00 -0.84 0.00 0.00 61.79 61.13 3k98 h SER 52 Cb 0.08 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 62.52 3k98 h SER 52 CO -0.14 0.54 -0.27 -1.28 -1.14 0.00 0.00 176.83 174.54 3k98 h SER 53 N 0.37 0.47 -0.81 3.07 0.87 0.16 -1.06 113.55 116.62 3k98 h SER 53 Ca 0.07 -0.56 0.01 0.00 -1.23 0.00 0.00 61.79 60.09 3k98 h SER 53 Cb 0.46 -0.14 -0.04 0.00 -0.44 0.00 0.00 62.40 62.24 3k98 h SER 53 CO 0.03 0.94 0.53 0.44 -0.53 0.00 0.00 176.83 178.24 3k98 h ASP 54 N 0.02 0.91 0.44 6.23 3.32 -0.88 0.13 116.42 126.60 3k98 h ASP 54 Ca 0.00 -0.02 -0.08 0.00 0.02 0.00 0.00 57.03 56.95 3k98 h ASP 54 Cb 0.86 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 40.17 3k98 h ASP 54 CO 0.06 0.65 -0.39 0.00 -1.72 0.00 0.00 179.24 177.85 3k98 h ALA 55 N 1.30 1.30 -0.08 3.45 0.00 -1.18 -1.53 119.26 122.52 3k98 h ALA 55 Ca 0.30 -0.35 -0.13 0.00 0.00 0.00 0.00 54.91 54.73 3k98 h ALA 55 Cb -0.10 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 17.64 3k98 h ALA 55 CO -0.07 0.48 -0.46 -0.07 0.00 0.00 0.00 179.25 179.13 3k98 h LEU 56 N 0.00 0.55 -1.12 0.00 3.38 -0.19 -0.82 115.31 117.11 3k98 h LEU 56 Ca -0.00 -0.65 0.12 0.00 0.09 0.00 0.00 57.88 57.44 3k98 h LEU 56 Cb 0.71 -0.16 -0.08 0.00 0.09 0.00 0.00 40.66 41.22 3k98 h LEU 56 CO 0.05 1.11 0.61 0.44 0.09 0.00 0.00 178.44 180.74 3k98 h ASP 57 N 0.02 0.83 0.02 -0.43 3.32 -0.51 -1.98 116.42 117.68 3k98 h ASP 57 Ca -0.03 0.04 -0.00 0.00 0.02 0.00 0.00 57.03 57.06 3k98 h ASP 57 Cb 1.11 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 40.54 3k98 h ASP 57 CO 0.09 0.44 -0.01 0.50 -1.72 0.00 0.00 179.24 178.55 3k98 h LYS 58 N 0.89 -0.02 0.00 3.56 3.11 -1.24 -2.34 116.57 120.52 3k98 h LYS 58 Ca 0.47 0.00 -0.03 0.00 -2.81 0.00 0.00 60.65 58.28 3k98 h LYS 58 Cb 0.55 0.00 -0.00 0.00 -1.00 0.00 0.00 32.23 31.78 3k98 h LYS 58 CO -0.24 0.29 -0.16 0.97 -2.81 0.00 0.00 179.45 177.51 3k98 h ILE 59 N -0.34 0.78 0.30 2.00 6.09 -1.41 -2.71 117.51 122.22 3k98 h ILE 59 Ca -0.00 -0.61 -0.01 0.00 -1.37 0.00 0.00 64.86 62.86 3k98 h ILE 59 Cb 0.33 1.37 0.00 0.00 0.47 0.00 0.00 36.82 38.99 3k98 h ILE 59 CO 0.00 0.15 -0.14 -0.09 -3.07 0.00 0.00 178.15 175.00 3k98 h ARG 60 N 0.00 -0.39 -0.22 2.19 2.43 -0.84 -1.28 114.38 116.28 3k98 h ARG 60 Ca -0.00 0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.18 3k98 h ARG 60 Cb 0.35 0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.98 3k98 h ARG 60 CO 0.02 -0.14 0.08 1.88 -1.51 0.00 0.00 179.97 180.30 3k98 h TYR 61 N -0.60 0.33 -0.03 2.20 0.05 -1.34 -0.17 116.97 117.42 3k98 h TYR 61 Ca -0.04 -0.03 0.01 0.00 0.05 0.00 0.00 58.73 58.72 3k98 h TYR 61 Cb 0.43 -0.10 -0.00 0.00 1.01 0.00 0.00 36.73 38.07 3k98 h TYR 61 CO -0.01 0.38 0.18 0.93 -1.05 0.00 0.00 178.16 178.60 3k98 h GLU 62 N 0.19 0.00 0.08 4.88 5.08 -1.48 0.35 114.58 123.68 3k98 h GLU 62 Ca 0.07 0.00 -0.26 0.00 -1.00 0.00 0.00 59.36 58.17 3k98 h GLU 62 Cb 0.20 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.44 3k98 h GLU 62 CO -0.00 0.00 -1.21 0.66 -1.00 0.00 0.00 179.01 177.46 3k98 h SER 63 N 0.00 0.27 0.20 1.42 4.64 0.20 -1.71 113.55 118.58 3k98 h SER 63 Ca 0.01 -0.30 0.01 0.00 -0.47 0.00 0.00 61.79 61.04 3k98 h SER 63 Cb 0.38 -0.09 -0.04 0.00 -0.31 0.00 0.00 62.40 62.34 3k98 h SER 63 CO -0.00 1.24 -0.53 -0.07 -0.87 0.00 0.00 176.83 176.60 3k98 h LEU 64 N 0.05 -1.56 0.00 5.97 3.38 -0.43 -2.98 115.31 119.74 3k98 h LEU 64 Ca -0.11 0.16 -0.08 0.00 0.09 0.00 0.00 57.88 57.93 3k98 h LEU 64 Cb 1.91 0.56 0.01 0.00 0.09 0.00 0.00 40.66 43.23 3k98 h LEU 64 CO 0.17 -0.58 -0.33 0.71 0.09 0.00 0.00 178.44 178.50 3k98 h THR 65 N -0.81 1.53 -3.57 0.22 1.35 -1.69 -3.41 112.91 106.53 3k98 h THR 65 Ca -0.02 -2.00 -0.71 0.00 -0.55 0.00 0.00 66.41 63.13 3k98 h THR 65 Cb 0.79 2.76 -0.33 0.00 -1.73 0.00 0.00 68.15 69.63 3k98 h THR 65 CO -0.24 0.55 -0.30 -0.62 -0.25 0.00 0.00 175.52 174.66 3k98 s ASP 66 N -6.42 5.51 0.40 5.36 -1.08 -0.64 -4.92 116.67 114.88 3k98 s ASP 66 Ca -0.15 -2.73 0.10 0.00 -0.52 0.00 0.00 52.55 49.24 3k98 s ASP 66 Cb 0.01 -1.92 0.83 0.00 -1.46 0.00 0.00 42.92 40.38 3k98 s ASP 66 CO 0.76 -0.43 1.94 -0.65 0.52 0.00 0.00 175.17 177.31 3k98 h PRO 67 N 7.28 0.23 0.00 4.34 0.11 -1.74 -2.45 132.00 139.78 3k98 h PRO 67 Ca -0.01 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.05 3k98 h PRO 67 Cb 0.98 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.05 3k98 h PRO 67 CO 0.73 0.34 0.01 0.66 -0.21 0.00 0.00 178.00 179.53 3k98 h SER 68 N 0.22 0.00 0.71 -2.05 4.64 -1.91 -1.56 113.55 113.61 3k98 h SER 68 Ca 0.05 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.30 3k98 h SER 68 Cb 0.32 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.40 3k98 h SER 68 CO 0.02 0.00 -0.33 0.11 -0.87 0.00 0.00 176.83 175.76 3k98 h LYS 69 N 0.00 0.00 -0.18 4.77 1.57 -1.75 -2.48 116.57 118.49 3k98 h LYS 69 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3k98 h LYS 69 Cb 0.02 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.33 3k98 h LYS 69 CO 0.00 0.33 0.00 1.28 -0.57 0.00 0.00 179.45 180.49 3k98 n LEU 70 N -3.61 1.55 0.26 2.94 4.77 -0.59 -3.99 117.00 118.34 3k98 n LEU 70 Ca -0.01 -0.67 0.12 0.00 -0.03 0.00 0.00 56.01 55.42 3k98 n LEU 70 Cb 0.45 -0.11 0.77 0.00 -2.33 0.00 0.00 43.42 42.19 3k98 n LEU 70 CO 0.36 0.33 1.10 0.44 -1.33 0.00 0.00 177.39 178.30 3k98 h ASP 71 N 2.00 0.00 0.54 -1.43 5.19 -1.58 -0.11 116.42 121.03 3k98 h ASP 71 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 3k98 h ASP 71 Cb 0.44 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.95 3k98 h ASP 71 CO 0.00 0.00 -0.05 -1.54 -3.12 0.00 0.00 179.24 174.53 3k98 n SER 72 N -4.20 0.16 0.00 6.45 3.41 -1.26 -4.85 113.62 113.34 3k98 n SER 72 Ca -0.02 -0.23 0.00 0.00 -0.26 0.00 0.00 58.87 58.36 3k98 n SER 72 Cb 0.12 -0.22 0.00 0.00 -0.26 0.00 0.00 64.21 63.86 3k98 n SER 72 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3k98 n GLY 73 N 1.31 3.20 0.13 5.00 0.00 -0.06 -3.92 105.19 110.85 3k98 n GLY 73 Ca 0.13 0.03 -0.22 0.00 0.00 0.00 0.00 46.02 45.97 3k98 n GLY 73 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3k98 n LYS 74 N -0.03 0.71 -1.74 1.61 4.76 -1.21 -4.62 118.16 117.64 3k98 n LYS 74 Ca 0.00 0.35 -0.42 0.00 -2.87 0.00 0.00 58.31 55.37 3k98 n LYS 74 Cb 0.00 -1.72 -0.03 0.00 -1.84 0.00 0.00 35.03 31.44 3k98 n LYS 74 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 3k98 s GLU 75 N -2.51 4.12 -0.32 1.97 2.02 -1.26 -4.99 118.70 117.74 3k98 s GLU 75 Ca -0.24 2.60 -0.01 0.00 0.02 0.00 0.00 54.97 57.34 3k98 s GLU 75 Cb 0.06 -3.07 0.06 0.00 0.10 0.00 0.00 34.13 31.29 3k98 s GLU 75 CO 0.73 -0.74 0.03 -0.51 0.02 0.00 0.00 175.26 174.79 3k98 s LEU 76 N 0.93 4.16 0.24 1.80 1.43 -1.26 -4.75 118.68 121.22 3k98 s LEU 76 Ca 0.73 -1.47 -0.18 0.00 -1.03 0.00 0.00 54.13 52.18 3k98 s LEU 76 Cb -0.49 -1.72 0.02 0.00 0.03 0.00 0.00 46.19 44.03 3k98 s LEU 76 CO 0.34 -0.31 0.61 -1.38 0.23 0.00 0.00 176.35 175.84 3k98 s HIS 77 N 1.20 -0.07 -0.13 0.29 -3.43 -1.26 -4.40 115.29 107.48 3k98 s HIS 77 Ca -0.02 -0.32 0.01 0.00 -0.80 0.00 0.00 55.06 53.93 3k98 s HIS 77 Cb -0.20 0.50 0.02 0.00 -1.43 0.00 0.00 32.58 31.47 3k98 s HIS 77 CO -0.02 -1.08 -0.14 0.42 -2.00 0.00 0.00 174.74 171.92 3k98 s ILE 78 N -3.92 1.52 -0.08 -5.38 1.01 0.24 -2.59 121.20 111.99 3k98 s ILE 78 Ca 0.12 -0.62 -0.02 0.00 0.00 0.00 0.00 60.65 60.14 3k98 s ILE 78 Cb -0.03 -1.41 -0.03 0.00 0.01 0.00 0.00 42.46 40.99 3k98 s ILE 78 CO 0.04 0.45 0.00 0.20 0.00 0.00 0.00 174.94 175.63 3k98 s ASN 79 N 1.31 5.25 -0.13 3.58 0.01 0.16 -0.86 114.94 124.25 3k98 s ASN 79 Ca 0.01 0.15 0.02 0.00 -0.71 0.00 0.00 52.86 52.32 3k98 s ASN 79 Cb -0.14 -1.48 0.00 0.00 0.41 0.00 0.00 41.25 40.05 3k98 s ASN 79 CO -0.07 0.38 -0.20 -0.76 -1.51 0.00 0.00 177.10 174.94 3k98 s LEU 80 N -0.90 2.24 -0.36 0.60 1.43 0.55 -0.48 118.68 121.76 3k98 s LEU 80 Ca 0.13 -0.54 0.00 0.00 -1.03 0.00 0.00 54.13 52.70 3k98 s LEU 80 Cb -0.11 -1.48 0.12 0.00 0.03 0.00 0.00 46.19 44.75 3k98 s LEU 80 CO 0.02 0.11 0.17 -0.63 0.23 0.00 0.00 176.35 176.25 3k98 s ILE 81 N 0.65 0.93 0.24 -0.59 1.01 0.13 -0.56 121.20 123.01 3k98 s ILE 81 Ca -0.10 -1.86 -0.30 0.00 0.00 0.00 0.00 60.65 58.39 3k98 s ILE 81 Cb -0.16 -1.68 -0.09 0.00 0.01 0.00 0.00 42.46 40.53 3k98 s ILE 81 CO 0.02 -0.81 1.25 -2.16 0.00 0.00 0.00 174.94 173.24 3k98 s PRO 82 N 1.08 4.45 -0.29 2.79 0.04 -1.24 -1.72 135.00 140.10 3k98 s PRO 82 Ca 0.14 2.01 -0.02 0.00 0.04 0.00 0.00 61.00 63.16 3k98 s PRO 82 Cb -0.21 -3.17 0.10 0.00 0.04 0.00 0.00 34.50 31.25 3k98 s PRO 82 CO -0.12 -0.12 0.11 1.21 0.04 0.00 0.00 177.00 178.12 3k98 s ASN 83 N -0.12 3.70 0.23 6.66 3.84 -0.19 -2.33 114.94 126.72 3k98 s ASN 83 Ca 0.52 -1.40 -0.03 0.00 0.21 0.00 0.00 52.86 52.16 3k98 s ASN 83 Cb -0.36 -0.60 0.23 0.00 -0.55 0.00 0.00 41.25 39.98 3k98 s ASN 83 CO 0.42 -0.42 1.64 0.11 -2.79 0.00 0.00 177.10 176.06 3k98 h LYS 84 N 8.25 0.69 -0.88 0.43 1.57 -1.83 0.16 116.57 124.96 3k98 h LYS 84 Ca -0.17 -0.28 0.02 0.00 -1.87 0.00 0.00 60.65 58.35 3k98 h LYS 84 Cb 1.02 -0.03 -0.05 0.00 0.08 0.00 0.00 32.23 33.26 3k98 h LYS 84 CO 0.44 0.87 0.58 0.37 -0.57 0.00 0.00 179.45 181.15 3k98 h GLN 85 N 0.60 1.11 0.00 3.15 4.15 -1.95 -2.63 115.11 119.53 3k98 h GLN 85 Ca 0.08 -0.07 0.00 0.00 0.77 0.00 0.00 58.65 59.43 3k98 h GLN 85 Cb 0.74 -0.25 0.00 0.00 0.21 0.00 0.00 27.48 28.18 3k98 h GLN 85 CO 0.06 0.73 -0.90 -0.25 -1.93 0.00 0.00 178.83 176.54 3k98 n ASP 86 N -4.43 0.64 -3.42 -0.69 10.43 -1.00 -4.97 116.55 113.12 3k98 n ASP 86 Ca 0.11 -0.32 -0.24 0.00 2.57 0.00 0.00 54.79 56.91 3k98 n ASP 86 Cb 0.07 0.69 0.05 0.00 1.84 0.00 0.00 41.12 43.77 3k98 n ASP 86 CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 177.20 176.67 3k98 n ARG 87 N -1.80 -6.45 -4.54 -1.24 1.74 0.52 -4.90 116.66 99.99 3k98 n ARG 87 Ca 0.03 0.82 -0.31 0.00 -0.77 0.00 0.00 57.85 57.62 3k98 n ARG 87 Cb 0.40 -5.78 -0.12 0.00 -1.02 0.00 0.00 32.46 25.94 3k98 n ARG 87 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 3k98 s THR 88 N -3.25 3.10 -0.15 0.55 -4.23 -0.97 -1.49 115.64 109.20 3k98 s THR 88 Ca 0.49 -1.09 0.01 0.00 -1.18 0.00 0.00 61.69 59.92 3k98 s THR 88 Cb -0.22 -2.34 0.01 0.00 1.34 0.00 0.00 72.50 71.28 3k98 s THR 88 CO 0.60 0.32 -0.19 -0.22 -0.54 0.00 0.00 174.62 174.59 3k98 s LEU 89 N -1.56 2.27 -0.11 4.79 2.96 -0.26 -1.02 118.68 125.75 3k98 s LEU 89 Ca 0.16 -0.55 0.00 0.00 -0.22 0.00 0.00 54.13 53.53 3k98 s LEU 89 Cb -0.11 -1.50 -0.02 0.00 0.50 0.00 0.00 46.19 45.06 3k98 s LEU 89 CO 0.07 0.08 -0.11 -0.89 -1.32 0.00 0.00 176.35 174.18 3k98 s THR 90 N 0.83 3.25 -0.23 3.68 2.01 -0.70 -0.53 115.64 123.95 3k98 s THR 90 Ca -0.06 -0.61 -0.01 0.00 0.31 0.00 0.00 61.69 61.32 3k98 s THR 90 Cb -0.15 -2.35 0.02 0.00 0.01 0.00 0.00 72.50 70.02 3k98 s THR 90 CO -0.01 0.54 -0.08 -0.63 -0.69 0.00 0.00 174.62 173.74 3k98 s ILE 91 N -0.01 2.81 -0.06 1.82 1.09 0.40 -0.70 121.20 126.55 3k98 s ILE 91 Ca -0.03 -0.91 0.04 0.00 -1.10 0.00 0.00 60.65 58.65 3k98 s ILE 91 Cb -0.14 -2.36 -0.02 0.00 -1.06 0.00 0.00 42.46 38.88 3k98 s ILE 91 CO 0.04 0.30 -0.17 -0.69 -0.10 0.00 0.00 174.94 174.32 3k98 s VAL 92 N 1.34 2.79 0.20 2.92 1.01 0.37 -0.13 120.40 128.90 3k98 s VAL 92 Ca 0.02 -0.81 0.01 0.00 0.00 0.00 0.00 61.98 61.20 3k98 s VAL 92 Cb -0.16 -2.08 -0.05 0.00 0.00 0.00 0.00 36.38 34.10 3k98 s VAL 92 CO -0.06 0.58 0.04 1.51 0.00 0.00 0.00 175.10 177.17 3k98 s ASP 93 N -0.46 1.14 -0.34 3.32 1.47 -0.68 0.36 116.67 121.48 3k98 s ASP 93 Ca 0.06 -1.25 0.07 0.00 1.18 0.00 0.00 52.55 52.61 3k98 s ASP 93 Cb -0.12 0.15 0.56 0.00 -0.34 0.00 0.00 42.92 43.17 3k98 s ASP 93 CO 0.02 -0.63 1.62 0.35 0.68 0.00 0.00 175.17 177.20 3k98 n THR 94 N -0.31 2.77 -0.07 2.11 -2.24 -1.07 -2.44 114.28 113.03 3k98 n THR 94 Ca -0.04 -2.47 0.00 0.00 -2.27 0.00 0.00 64.05 59.27 3k98 n THR 94 Cb 0.64 -0.37 0.00 0.00 -2.10 0.00 0.00 70.33 68.50 3k98 n THR 94 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3k98 n GLY 95 N -1.11 -3.04 0.14 3.38 0.00 -1.26 -4.54 105.19 98.75 3k98 n GLY 95 Ca 0.42 -1.29 0.13 0.00 0.00 0.00 0.00 46.02 45.28 3k98 n GLY 95 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3k98 h ILE 96 N -1.18 0.00 -0.57 -0.61 2.10 -1.46 -2.98 117.51 112.80 3k98 h ILE 96 Ca 0.00 -0.58 0.07 0.00 1.08 0.00 0.00 64.86 65.43 3k98 h ILE 96 Cb 0.00 1.55 -0.02 0.00 -1.09 0.00 0.00 36.82 37.26 3k98 h ILE 96 CO 0.00 0.00 -0.09 0.61 -1.08 0.00 0.00 178.15 177.59 3k98 n GLY 97 N 1.07 -2.19 3.10 8.18 0.00 -1.26 -4.37 105.19 109.72 3k98 n GLY 97 Ca 0.05 -1.47 -0.18 0.00 0.00 0.00 0.00 46.02 44.42 3k98 n GLY 97 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3k98 s MET 98 N -1.18 0.78 0.75 1.61 1.00 -1.26 -4.82 119.30 116.18 3k98 s MET 98 Ca 0.00 -0.69 -0.09 0.00 0.00 0.00 0.00 55.69 54.91 3k98 s MET 98 Cb 0.00 -0.74 0.07 0.00 0.00 0.00 0.00 34.83 34.16 3k98 s MET 98 CO 0.00 0.18 1.09 0.95 0.00 0.00 0.00 175.02 177.24 3k98 s THR 99 N -0.88 2.19 0.18 2.05 -4.23 -1.26 -3.95 115.64 109.74 3k98 s THR 99 Ca -0.01 -0.12 -0.17 0.00 -1.18 0.00 0.00 61.69 60.21 3k98 s THR 99 Cb -0.08 -3.02 0.14 0.00 1.34 0.00 0.00 72.50 70.88 3k98 s THR 99 CO 0.01 -0.02 1.64 0.50 -0.54 0.00 0.00 174.62 176.21 3k98 h LYS 100 N -0.81 -0.05 -0.60 3.99 3.64 -1.98 0.44 116.57 121.19 3k98 h LYS 100 Ca -0.45 0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 58.87 3k98 h LYS 100 Cb 1.32 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 33.13 3k98 h LYS 100 CO 0.63 -0.03 0.13 0.00 -2.27 0.00 0.00 179.45 177.91 3k98 h ALA 101 N 1.36 0.79 -0.75 5.00 0.00 -1.99 -1.52 119.26 122.16 3k98 h ALA 101 Ca 0.23 -0.24 0.10 0.00 0.00 0.00 0.00 54.91 55.00 3k98 h ALA 101 Cb 0.40 -0.23 -0.07 0.00 0.00 0.00 0.00 17.79 17.89 3k98 h ALA 101 CO -0.51 0.51 0.39 -0.44 0.00 0.00 0.00 179.25 179.20 3k98 h ASP 102 N 0.88 0.52 -0.32 0.00 3.32 -1.71 0.33 116.42 119.45 3k98 h ASP 102 Ca 0.19 0.06 -0.00 0.00 0.02 0.00 0.00 57.03 57.29 3k98 h ASP 102 Cb 0.37 -0.03 -0.02 0.00 0.22 0.00 0.00 39.33 39.87 3k98 h ASP 102 CO 0.00 0.29 0.18 0.25 -1.72 0.00 0.00 179.24 178.25 3k98 h LEU 103 N 0.65 0.39 -0.14 1.55 5.85 -0.44 -0.84 115.31 122.34 3k98 h LEU 103 Ca 0.37 -0.07 -0.17 0.00 0.84 0.00 0.00 57.88 58.84 3k98 h LEU 103 Cb 0.38 -0.10 0.01 0.00 0.37 0.00 0.00 40.66 41.32 3k98 h LEU 103 CO -0.27 0.35 -0.59 0.40 -0.34 0.00 0.00 178.44 177.99 3k98 h ILE 104 N 0.40 1.33 -0.06 4.05 2.04 -0.34 -1.12 117.51 123.80 3k98 h ILE 104 Ca 0.11 -1.85 -0.21 0.00 1.00 0.00 0.00 64.86 63.91 3k98 h ILE 104 Cb 0.04 2.07 0.01 0.00 -0.74 0.00 0.00 36.82 38.20 3k98 h ILE 104 CO -0.02 0.57 -0.77 0.78 0.00 0.00 0.00 178.15 178.71 3k98 h ASN 105 N 0.30 0.78 0.73 1.72 2.35 -0.40 -2.94 115.58 118.13 3k98 h ASN 105 Ca -0.04 -0.70 0.00 0.00 -0.55 0.00 0.00 56.30 55.02 3k98 h ASN 105 Cb 1.22 -0.23 0.00 0.00 0.05 0.00 0.00 38.32 39.36 3k98 h ASN 105 CO 0.12 1.36 -1.01 0.59 -1.65 0.00 0.00 177.43 176.84 3k98 n ASN 106 N -4.03 0.68 -2.22 5.81 3.02 -0.32 -3.27 115.26 114.93 3k98 n ASN 106 Ca -0.09 0.11 -0.25 0.00 -0.03 0.00 0.00 54.58 54.32 3k98 n ASN 106 Cb 0.75 0.61 0.01 0.00 -0.61 0.00 0.00 39.78 40.54 3k98 n ASN 106 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 3k98 n LEU 107 N -2.33 4.86 0.00 3.41 4.77 -0.42 -4.93 117.00 122.36 3k98 n LEU 107 Ca 0.01 -4.95 0.00 0.00 -0.03 0.00 0.00 56.01 51.04 3k98 n LEU 107 Cb 0.50 -0.40 0.00 0.00 -2.33 0.00 0.00 43.42 41.19 3k98 n LEU 107 CO 0.40 2.16 0.00 0.61 -1.33 0.00 0.00 177.39 179.23 3k98 n GLY 108 N -0.61 1.19 0.08 -0.72 0.00 -1.25 -4.89 105.19 98.99 3k98 n GLY 108 Ca 0.42 -0.07 0.10 0.00 0.00 0.00 0.00 46.02 46.46 3k98 n GLY 108 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3k98 n THR 109 N 0.00 0.54 -4.52 2.61 -2.24 -1.11 -0.78 114.28 108.78 3k98 n THR 109 Ca 0.00 -0.56 -0.33 0.00 -2.27 0.00 0.00 64.05 60.89 3k98 n THR 109 Cb 0.00 -0.30 -0.16 0.00 -2.10 0.00 0.00 70.33 67.78 3k98 n THR 109 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 3k98 s ILE 110 N -3.34 2.48 -0.18 2.28 1.01 -1.20 -4.49 121.20 117.77 3k98 s ILE 110 Ca -0.03 -0.83 -0.08 0.00 0.00 0.00 0.00 60.65 59.71 3k98 s ILE 110 Cb 0.10 -2.04 -0.05 0.00 0.01 0.00 0.00 42.46 40.49 3k98 s ILE 110 CO 0.82 0.52 0.11 0.00 0.00 0.00 0.00 174.94 176.39 3k98 s ALA 111 N 0.86 3.62 0.75 9.38 0.00 -1.26 -4.92 121.76 130.19 3k98 s ALA 111 Ca -0.05 -0.70 -0.12 0.00 0.00 0.00 0.00 51.96 51.09 3k98 s ALA 111 Cb -0.15 -2.04 0.05 0.00 0.00 0.00 0.00 23.12 20.98 3k98 s ALA 111 CO -0.01 0.26 1.12 0.15 0.00 0.00 0.00 175.76 177.27 3k98 s LYS 112 N 0.08 2.27 -0.99 0.00 1.02 -1.26 -4.90 119.74 115.95 3k98 s LYS 112 Ca 0.08 1.36 -0.24 0.00 0.02 0.00 0.00 55.97 57.19 3k98 s LYS 112 Cb -0.12 -1.89 -0.02 0.00 -0.52 0.00 0.00 37.83 35.29 3k98 s LYS 112 CO -0.00 -1.66 1.80 -1.12 -0.92 0.00 0.00 175.35 173.45 3k98 s SER 113 N -2.87 5.60 0.00 2.83 0.01 -1.26 -1.55 113.70 116.46 3k98 s SER 113 Ca 0.65 -1.11 0.00 0.00 1.31 0.00 0.00 55.95 56.80 3k98 s SER 113 Cb -0.20 -2.57 0.00 0.00 0.21 0.00 0.00 66.02 63.46 3k98 s SER 113 CO 0.50 -2.36 0.00 0.61 0.41 0.00 0.00 173.24 172.40 3k98 n GLY 114 N 6.65 -0.73 0.13 3.44 0.00 -1.26 -4.96 105.19 108.46 3k98 n GLY 114 Ca 0.39 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.18 3k98 n GLY 114 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3k98 n THR 115 N 0.00 1.57 0.07 2.61 -1.04 -0.59 -4.02 114.28 112.89 3k98 n THR 115 Ca 0.00 -0.42 0.06 0.00 -2.04 0.00 0.00 64.05 61.65 3k98 n THR 115 Cb 0.00 -1.76 0.50 0.00 -1.82 0.00 0.00 70.33 67.26 3k98 n THR 115 CO 0.00 0.00 0.00 0.50 -0.64 0.00 0.00 175.07 174.93 3k98 h LYS 116 N -0.50 0.35 -0.10 -2.82 3.64 -1.93 -1.39 116.57 113.83 3k98 h LYS 116 Ca -0.54 -0.02 -0.13 0.00 -1.27 0.00 0.00 60.65 58.69 3k98 h LYS 116 Cb 1.72 -0.08 0.01 0.00 -0.41 0.00 0.00 32.23 33.46 3k98 h LYS 116 CO -0.18 0.23 -0.43 0.00 -2.27 0.00 0.00 179.45 176.80 3k98 h ALA 117 N 1.82 0.19 0.40 5.00 0.00 -1.90 -2.14 119.26 122.63 3k98 h ALA 117 Ca 0.11 -0.48 -0.02 0.00 0.00 0.00 0.00 54.91 54.53 3k98 h ALA 117 Cb 0.02 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3k98 h ALA 117 CO -0.03 0.32 -0.19 0.35 0.00 0.00 0.00 179.25 179.70 3k98 h PHE 118 N 0.05 -0.49 -1.26 0.00 3.57 -1.63 -1.42 116.94 115.76 3k98 h PHE 118 Ca -0.03 -0.01 0.37 0.00 3.53 0.00 0.00 57.97 61.84 3k98 h PHE 118 Cb 1.07 0.16 -0.10 0.00 2.79 0.00 0.00 35.95 39.88 3k98 h PHE 118 CO 0.12 -0.17 0.84 1.98 -2.23 0.00 0.00 178.31 178.85 3k98 h MET 119 N -0.86 0.16 -0.01 1.11 4.05 -1.34 0.49 114.93 118.52 3k98 h MET 119 Ca -0.05 -0.01 -0.22 0.00 -0.28 0.00 0.00 59.70 59.13 3k98 h MET 119 Cb 0.55 -0.04 0.00 0.00 -0.80 0.00 0.00 31.60 31.31 3k98 h MET 119 CO 0.09 0.10 -0.92 0.93 0.23 0.00 0.00 176.91 177.34 3k98 h GLU 120 N 0.16 0.43 -0.37 0.39 5.08 -1.11 -2.82 114.58 116.34 3k98 h GLU 120 Ca 0.70 -0.45 -0.10 0.00 -1.00 0.00 0.00 59.36 58.51 3k98 h GLU 120 Cb 2.27 0.12 -0.02 0.00 0.50 0.00 0.00 28.75 31.63 3k98 h GLU 120 CO -0.26 1.11 -0.19 0.00 -1.00 0.00 0.00 179.01 178.67 3k98 h ALA 121 N 0.74 0.96 -0.02 3.43 0.00 0.98 -1.57 119.26 123.78 3k98 h ALA 121 Ca -0.08 -0.35 -0.00 0.00 0.00 0.00 0.00 54.91 54.48 3k98 h ALA 121 Cb 1.55 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 19.19 3k98 h ALA 121 CO 0.16 0.61 0.01 -0.07 0.00 0.00 0.00 179.25 179.95 3k98 h LEU 122 N 0.63 0.02 -0.23 0.00 3.38 -0.95 0.59 115.31 118.76 3k98 h LEU 122 Ca 0.09 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 57.88 3k98 h LEU 122 Cb 0.67 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.42 3k98 h LEU 122 CO 0.05 0.20 0.00 0.00 0.09 0.00 0.00 178.44 178.78 3k98 n GLN 123 N -4.98 0.22 0.21 1.13 10.64 -1.07 0.44 117.38 123.97 3k98 n GLN 123 Ca -0.07 0.27 0.14 0.00 -1.83 0.00 0.00 57.00 55.51 3k98 n GLN 123 Cb 0.12 -1.81 0.44 0.00 -0.86 0.00 0.00 30.24 28.12 3k98 n GLN 123 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 3k98 h ALA 124 N 2.46 1.00 0.00 2.61 0.00 -0.95 -3.47 119.26 120.91 3k98 h ALA 124 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3k98 h ALA 124 Cb 0.59 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.38 3k98 h ALA 124 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 3k98 n GLY 125 N 0.60 1.11 3.44 0.00 0.00 0.17 -5.07 105.19 105.44 3k98 n GLY 125 Ca 0.03 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.73 3k98 n GLY 125 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k98 n ALA 126 N -0.24 -2.63 -1.99 4.61 0.00 0.19 -4.94 120.51 115.51 3k98 n ALA 126 Ca 0.00 -0.83 -0.32 0.00 0.00 0.00 0.00 53.44 52.29 3k98 n ALA 126 Cb 0.00 -1.84 -0.05 0.00 0.00 0.00 0.00 19.45 17.55 3k98 n ALA 126 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3k98 s ASP 127 N -2.15 6.76 0.11 0.00 2.15 -1.26 -4.67 116.67 117.60 3k98 s ASP 127 Ca 0.60 1.45 0.27 0.00 0.43 0.00 0.00 52.55 55.30 3k98 s ASP 127 Cb -0.20 -2.45 1.00 0.00 -0.30 0.00 0.00 42.92 40.98 3k98 s ASP 127 CO 0.65 -0.36 1.83 0.00 -0.17 0.00 0.00 175.17 177.12 3k98 n ILE 128 N -0.84 0.35 0.01 4.11 0.13 -1.26 -4.02 119.36 117.85 3k98 n ILE 128 Ca 0.05 -0.11 0.20 0.00 -1.10 0.00 0.00 62.75 61.79 3k98 n ILE 128 Cb 0.54 -0.59 0.70 0.00 -0.84 0.00 0.00 39.64 39.44 3k98 n ILE 128 CO 0.00 0.00 0.00 0.77 2.80 0.00 0.00 176.55 180.12 3k98 h SER 129 N 0.00 0.00 -0.10 9.51 4.64 -1.93 -1.70 113.55 123.97 3k98 h SER 129 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3k98 h SER 129 Cb 0.59 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.68 3k98 h SER 129 CO 0.00 0.00 0.00 0.23 -0.87 0.00 0.00 176.83 176.19 3k98 n MET 130 N -4.32 1.53 -0.33 4.77 2.81 -1.26 -4.38 117.12 115.94 3k98 n MET 130 Ca 0.09 -0.79 0.14 0.00 -1.81 0.00 0.00 57.70 55.34 3k98 n MET 130 Cb 0.60 -1.38 0.36 0.00 -0.71 0.00 0.00 33.22 32.09 3k98 n MET 130 CO 0.00 0.00 0.00 0.97 1.51 0.00 0.00 175.97 178.45 3k98 h ILE 131 N 1.64 0.71 -0.49 2.02 2.10 -1.61 -2.04 117.51 119.84 3k98 h ILE 131 Ca 0.00 -0.24 -0.05 0.00 1.08 0.00 0.00 64.86 65.65 3k98 h ILE 131 Cb 0.36 -0.05 -0.02 0.00 -1.09 0.00 0.00 36.82 36.02 3k98 h ILE 131 CO 0.00 0.13 0.09 1.23 -1.08 0.00 0.00 178.15 178.51 3k98 h GLY 132 N 0.69 0.81 0.49 8.18 0.00 -1.85 -1.30 103.07 110.10 3k98 h GLY 132 Ca 0.55 -0.48 0.00 0.00 0.00 0.00 0.00 47.33 47.40 3k98 h GLY 132 CO -0.33 0.45 0.00 -1.06 0.00 0.00 0.00 176.54 175.60 3k98 n GLN 133 N -4.27 0.81 -0.05 4.80 6.02 -0.77 -1.85 117.38 122.07 3k98 n GLN 133 Ca 0.03 0.00 0.05 0.00 -0.01 0.00 0.00 57.00 57.07 3k98 n GLN 133 Cb 0.24 -1.24 0.07 0.00 1.02 0.00 0.00 30.24 30.32 3k98 n GLN 133 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 3k98 n PHE 134 N -0.74 0.13 -0.73 1.08 3.01 -0.49 -5.00 117.46 114.71 3k98 n PHE 134 Ca 0.09 -0.17 0.00 0.00 1.01 0.00 0.00 57.45 58.39 3k98 n PHE 134 Cb 0.04 -0.01 0.00 0.00 -0.01 0.00 0.00 39.48 39.50 3k98 n PHE 134 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3k98 n GLY 135 N 0.46 0.61 0.64 1.37 0.00 -0.77 -4.51 105.19 103.00 3k98 n GLY 135 Ca 0.07 -0.20 0.06 0.00 0.00 0.00 0.00 46.02 45.95 3k98 n GLY 135 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3k98 n VAL 136 N -2.73 1.29 -0.12 1.61 0.24 -1.23 -4.82 118.33 112.56 3k98 n VAL 136 Ca 0.00 -1.98 0.22 0.00 -2.04 0.00 0.00 64.34 60.55 3k98 n VAL 136 Cb 0.00 0.15 0.65 0.00 -1.47 0.00 0.00 33.84 33.17 3k98 n VAL 136 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 3k98 h GLY 137 N 0.58 0.22 0.72 7.63 0.00 -1.79 -1.14 103.07 109.28 3k98 h GLY 137 Ca -0.05 -0.05 0.12 0.00 0.00 0.00 0.00 47.33 47.35 3k98 h GLY 137 CO 0.02 0.01 0.52 -2.75 0.00 0.00 0.00 176.54 174.34 3k98 h PHE 138 N 0.11 0.69 0.00 5.60 3.57 -1.87 -1.59 116.94 123.46 3k98 h PHE 138 Ca 0.36 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.88 3k98 h PHE 138 Cb 1.26 -0.22 0.00 0.00 2.79 0.00 0.00 35.95 39.78 3k98 h PHE 138 CO -0.00 0.29 0.00 0.66 -2.23 0.00 0.00 178.31 177.03 3k98 n TYR 139 N -4.51 0.03 0.29 0.41 4.01 -0.43 -1.58 117.16 115.37 3k98 n TYR 139 Ca 0.15 0.01 0.16 0.00 -0.16 0.00 0.00 57.90 58.05 3k98 n TYR 139 Cb 0.42 -0.52 0.76 0.00 -0.31 0.00 0.00 39.34 39.70 3k98 n TYR 139 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 3k98 h SER 140 N 0.00 0.00 -0.95 7.72 4.64 -1.43 -2.34 113.55 121.19 3k98 h SER 140 Ca 0.00 0.00 0.25 0.00 -0.47 0.00 0.00 61.79 61.57 3k98 h SER 140 Cb 0.33 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.36 3k98 h SER 140 CO 0.00 0.00 0.65 0.00 -0.87 0.00 0.00 176.83 176.61 3k98 h ALA 141 N 2.06 2.55 0.00 5.18 0.00 -1.48 0.14 119.26 127.70 3k98 h ALA 141 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3k98 h ALA 141 Cb 0.18 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.00 3k98 h ALA 141 CO 0.00 -0.85 0.00 0.66 0.00 0.00 0.00 179.25 179.06 3k98 n TYR 142 N -4.41 0.00 0.11 0.00 4.01 -0.88 -1.21 117.16 114.79 3k98 n TYR 142 Ca 0.21 0.00 0.01 0.00 -0.16 0.00 0.00 57.90 57.96 3k98 n TYR 142 Cb 0.89 0.00 0.35 0.00 -0.31 0.00 0.00 39.34 40.27 3k98 n TYR 142 CO 0.00 0.00 0.00 -0.07 -0.46 0.00 0.00 176.86 176.33 3k98 h LEU 143 N 0.00 0.22 0.00 7.72 3.38 -0.92 -3.37 115.31 122.34 3k98 h LEU 143 Ca 0.00 -0.06 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 3k98 h LEU 143 Cb 0.00 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 40.69 3k98 h LEU 143 CO 0.00 0.44 -1.00 1.33 0.09 0.00 0.00 178.44 179.29 3k98 n VAL 144 N -4.22 0.00 -4.31 1.22 0.24 -0.87 -4.99 118.33 105.41 3k98 n VAL 144 Ca -0.01 -0.00 -0.33 0.00 -2.04 0.00 0.00 64.34 61.96 3k98 n VAL 144 Cb 0.32 -0.07 -0.09 0.00 -1.47 0.00 0.00 33.84 32.53 3k98 n VAL 144 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3k98 s ALA 145 N -2.00 3.25 -0.30 2.33 0.00 -0.35 0.18 121.76 124.86 3k98 s ALA 145 Ca -0.00 -0.95 0.22 0.00 0.00 0.00 0.00 51.96 51.23 3k98 s ALA 145 Cb 0.00 -1.32 -0.14 0.00 0.00 0.00 0.00 23.12 21.66 3k98 s ALA 145 CO 0.00 0.64 0.80 -0.85 0.00 0.00 0.00 175.76 176.35 3k98 n GLU 146 N 1.45 0.50 -3.78 0.00 0.28 -0.31 -4.46 120.64 114.32 3k98 n GLU 146 Ca -0.15 -0.05 -0.13 0.00 -0.16 0.00 0.00 57.16 56.67 3k98 n GLU 146 Cb 0.53 -1.62 -0.10 0.00 1.43 0.00 0.00 31.44 31.68 3k98 n GLU 146 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 177.13 177.18 3k98 s LYS 147 N -3.36 0.45 -0.06 3.44 2.20 -1.18 -4.48 119.74 116.75 3k98 s LYS 147 Ca -0.02 0.15 -0.00 0.00 -0.36 0.00 0.00 55.97 55.74 3k98 s LYS 147 Cb 0.13 0.21 0.02 0.00 -1.51 0.00 0.00 37.83 36.68 3k98 s LYS 147 CO 0.85 -0.09 -0.03 0.08 -0.36 0.00 0.00 175.35 175.80 3k98 s VAL 148 N -0.43 0.54 -0.14 4.02 1.01 -0.56 -1.10 120.40 123.74 3k98 s VAL 148 Ca -0.05 -0.05 0.00 0.00 0.00 0.00 0.00 61.98 61.88 3k98 s VAL 148 Cb -0.04 -0.62 -0.01 0.00 0.00 0.00 0.00 36.38 35.72 3k98 s VAL 148 CO 0.02 0.26 -0.15 -0.89 0.00 0.00 0.00 175.10 174.34 3k98 s THR 149 N 1.45 2.79 -0.21 3.92 2.01 -0.56 -1.93 115.64 123.10 3k98 s THR 149 Ca -0.03 -0.74 -0.02 0.00 0.31 0.00 0.00 61.69 61.21 3k98 s THR 149 Cb -0.13 -2.17 -0.00 0.00 0.01 0.00 0.00 72.50 70.21 3k98 s THR 149 CO -0.03 0.52 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.64 3k98 s VAL 150 N 0.58 3.00 -0.10 3.82 1.01 0.11 -0.20 120.40 128.62 3k98 s VAL 150 Ca -0.09 -0.62 -0.00 0.00 0.00 0.00 0.00 61.98 61.27 3k98 s VAL 150 Cb -0.16 -2.34 -0.03 0.00 0.00 0.00 0.00 36.38 33.85 3k98 s VAL 150 CO 0.03 0.46 -0.07 -0.63 0.00 0.00 0.00 175.10 174.89 3k98 s ILE 151 N 1.42 3.64 -0.11 2.22 -1.09 0.58 -0.42 121.20 127.44 3k98 s ILE 151 Ca 0.06 -0.48 -0.13 0.00 -2.23 0.00 0.00 60.65 57.86 3k98 s ILE 151 Cb -0.14 -2.52 0.03 0.00 -1.58 0.00 0.00 42.46 38.26 3k98 s ILE 151 CO -0.06 0.56 0.36 0.28 -1.23 0.00 0.00 174.94 174.85 3k98 s THR 152 N -0.38 0.01 -0.10 2.92 -1.32 -0.60 0.12 115.64 116.28 3k98 s THR 152 Ca 0.05 -0.08 -0.01 0.00 -1.21 0.00 0.00 61.69 60.44 3k98 s THR 152 Cb -0.12 -0.53 0.03 0.00 -1.51 0.00 0.00 72.50 70.36 3k98 s THR 152 CO 0.02 -0.05 -0.02 -0.75 -2.21 0.00 0.00 174.62 171.62 3k98 s LYS 153 N -0.09 0.92 -0.08 7.08 2.47 0.91 -1.18 119.74 129.77 3k98 s LYS 153 Ca -0.03 -0.07 -0.01 0.00 -1.56 0.00 0.00 55.97 54.31 3k98 s LYS 153 Cb -0.03 -1.30 -0.03 0.00 -1.46 0.00 0.00 37.83 35.01 3k98 s LYS 153 CO 0.01 -0.33 -0.03 -1.58 0.16 0.00 0.00 175.35 173.59 3k98 s HIS 154 N 1.87 3.07 0.33 4.03 5.65 -1.25 -1.55 115.29 127.43 3k98 s HIS 154 Ca 0.04 0.12 -0.27 0.00 0.25 0.00 0.00 55.06 55.20 3k98 s HIS 154 Cb -0.13 -1.76 -0.13 0.00 -1.18 0.00 0.00 32.58 29.38 3k98 s HIS 154 CO -0.06 0.40 1.00 0.09 -0.65 0.00 0.00 174.74 175.52 3k98 n ASN 155 N 2.20 1.25 -1.15 9.88 3.02 -1.26 -1.17 115.26 128.03 3k98 n ASN 155 Ca -0.18 1.14 -0.15 0.00 -0.03 0.00 0.00 54.58 55.35 3k98 n ASN 155 Cb 0.53 -1.30 -0.06 0.00 -0.61 0.00 0.00 39.78 38.33 3k98 n ASN 155 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 3k98 n ASP 156 N 1.05 -5.20 -4.14 6.41 2.03 -1.26 -4.97 116.55 110.47 3k98 n ASP 156 Ca 0.09 0.37 -0.09 0.00 0.52 0.00 0.00 54.79 55.68 3k98 n ASP 156 Cb 0.34 -4.02 -0.10 0.00 -0.72 0.00 0.00 41.12 36.62 3k98 n ASP 156 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 3k98 s ASP 157 N -2.69 0.45 0.83 1.67 -1.08 -0.31 -5.17 116.67 110.37 3k98 s ASP 157 Ca 0.00 -1.14 -0.12 0.00 -0.52 0.00 0.00 52.55 50.77 3k98 s ASP 157 Cb 0.00 0.25 0.09 0.00 -1.46 0.00 0.00 42.92 41.80 3k98 s ASP 157 CO 0.00 -0.67 1.11 -1.61 0.52 0.00 0.00 175.17 174.51 3k98 s GLU 158 N -4.00 1.83 0.01 4.34 2.02 -1.26 -4.48 118.70 117.16 3k98 s GLU 158 Ca 0.19 0.54 -0.30 0.00 0.02 0.00 0.00 54.97 55.42 3k98 s GLU 158 Cb 0.07 -1.90 -0.03 0.00 0.10 0.00 0.00 34.13 32.37 3k98 s GLU 158 CO -0.02 -1.77 0.99 -1.14 0.02 0.00 0.00 175.26 173.34 3k98 s GLN 159 N -5.19 4.56 0.21 1.61 0.74 -1.26 -4.38 119.66 115.95 3k98 s GLN 159 Ca 0.62 1.44 0.11 0.00 0.05 0.00 0.00 55.36 57.58 3k98 s GLN 159 Cb -0.14 -3.45 -0.05 0.00 1.10 0.00 0.00 33.01 30.47 3k98 s GLN 159 CO 0.54 -0.04 -0.22 0.71 -0.55 0.00 0.00 175.29 175.72 3k98 s TYR 160 N 0.92 2.32 -0.14 1.67 2.02 -0.32 0.48 117.35 124.31 3k98 s TYR 160 Ca 0.52 -0.35 0.02 0.00 -0.37 0.00 0.00 57.07 56.89 3k98 s TYR 160 Cb -0.22 -1.12 0.02 0.00 -0.40 0.00 0.00 41.96 40.24 3k98 s TYR 160 CO 0.28 0.55 -0.18 0.00 -1.57 0.00 0.00 175.55 174.63 3k98 s ALA 161 N -1.84 1.98 -0.09 3.71 0.00 0.72 -1.56 121.76 124.68 3k98 s ALA 161 Ca 0.23 -0.94 -0.02 0.00 0.00 0.00 0.00 51.96 51.23 3k98 s ALA 161 Cb -0.07 -0.97 -0.03 0.00 0.00 0.00 0.00 23.12 22.04 3k98 s ALA 161 CO 0.11 -0.16 -0.00 -0.46 0.00 0.00 0.00 175.76 175.25 3k98 s TRP 162 N 1.07 3.14 -0.09 0.00 -0.00 0.44 -1.51 118.94 121.99 3k98 s TRP 162 Ca -0.03 0.17 -0.14 0.00 -0.00 0.00 0.00 56.10 56.10 3k98 s TRP 162 Cb -0.14 -1.79 0.03 0.00 -0.00 0.00 0.00 33.47 31.57 3k98 s TRP 162 CO -0.05 0.45 0.35 -2.00 -0.00 0.00 0.00 176.95 175.70 3k98 s GLU 163 N -0.84 0.54 -0.24 5.86 2.12 -0.38 0.06 118.70 125.81 3k98 s GLU 163 Ca 0.13 0.23 -0.26 0.00 0.36 0.00 0.00 54.97 55.43 3k98 s GLU 163 Cb -0.11 0.25 0.08 0.00 0.26 0.00 0.00 34.13 34.60 3k98 s GLU 163 CO 0.02 -0.11 0.75 0.45 -0.54 0.00 0.00 175.26 175.83 3k98 s SER 164 N -0.44 -0.70 -0.06 -1.70 0.15 -0.81 -1.19 113.70 108.95 3k98 s SER 164 Ca -0.06 1.27 0.13 0.00 0.70 0.00 0.00 55.95 57.99 3k98 s SER 164 Cb -0.04 1.26 0.39 0.00 -1.71 0.00 0.00 66.02 65.93 3k98 s SER 164 CO 0.02 -0.29 1.32 -1.20 1.20 0.00 0.00 173.24 174.29 3k98 n SER 165 N 2.36 3.30 -2.66 5.45 7.64 -1.26 -1.49 113.62 126.95 3k98 n SER 165 Ca -0.14 -2.35 -0.14 0.00 1.01 0.00 0.00 58.87 57.24 3k98 n SER 165 Cb 0.55 -0.34 0.06 0.00 -1.01 0.00 0.00 64.21 63.47 3k98 n SER 165 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3k98 n ALA 166 N 0.20 -1.12 0.55 -0.43 0.00 -1.26 -4.84 120.51 113.60 3k98 n ALA 166 Ca 0.15 0.14 0.06 0.00 0.00 0.00 0.00 53.44 53.79 3k98 n ALA 166 Cb 0.59 -3.05 0.19 0.00 0.00 0.00 0.00 19.45 17.18 3k98 n ALA 166 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3k98 n GLY 167 N -1.35 1.20 0.33 0.00 0.00 -1.26 -4.85 105.19 99.27 3k98 n GLY 167 Ca -0.08 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.48 3k98 n GLY 167 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k98 n GLY 168 N 0.97 0.49 3.43 -0.02 0.00 -1.26 -5.08 105.19 103.72 3k98 n GLY 168 Ca 0.14 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.05 3k98 n GLY 168 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3k98 s SER 169 N -2.76 0.12 0.06 1.61 1.04 -1.26 -1.91 113.70 110.60 3k98 s SER 169 Ca 0.00 -1.17 -0.09 0.00 0.48 0.00 0.00 55.95 55.18 3k98 s SER 169 Cb 0.00 0.52 -0.00 0.00 0.10 0.00 0.00 66.02 66.64 3k98 s SER 169 CO 0.00 -1.04 0.18 0.72 0.98 0.00 0.00 173.24 174.08 3k98 s PHE 170 N -3.97 0.12 0.04 5.02 -0.12 -0.10 -4.43 117.98 114.55 3k98 s PHE 170 Ca 0.30 -0.44 0.06 0.00 -0.05 0.00 0.00 56.93 56.79 3k98 s PHE 170 Cb 0.02 -0.06 -0.03 0.00 -0.63 0.00 0.00 43.02 42.32 3k98 s PHE 170 CO 0.12 -0.48 -0.12 0.95 -0.05 0.00 0.00 175.22 175.64 3k98 s THR 171 N -3.18 3.22 0.02 -4.49 -4.23 -0.33 -0.03 115.64 106.61 3k98 s THR 171 Ca -0.00 -1.06 0.06 0.00 -1.18 0.00 0.00 61.69 59.51 3k98 s THR 171 Cb 0.02 -2.41 -0.02 0.00 1.34 0.00 0.00 72.50 71.43 3k98 s THR 171 CO -0.07 0.31 -0.19 -0.69 -0.54 0.00 0.00 174.62 173.43 3k98 s VAL 172 N -1.02 1.53 0.15 2.29 1.01 -0.27 -1.25 120.40 122.85 3k98 s VAL 172 Ca 0.17 -1.00 -0.19 0.00 0.00 0.00 0.00 61.98 60.96 3k98 s VAL 172 Cb -0.11 -1.31 0.05 0.00 0.00 0.00 0.00 36.38 35.01 3k98 s VAL 172 CO 0.08 0.29 0.50 0.00 0.00 0.00 0.00 175.10 175.97 3k98 s ARG 173 N -0.83 1.22 0.24 2.72 1.70 -0.57 -1.91 118.95 121.52 3k98 s ARG 173 Ca 0.07 -0.65 -0.31 0.00 -0.47 0.00 0.00 55.73 54.37 3k98 s ARG 173 Cb -0.08 0.53 -0.11 0.00 -0.57 0.00 0.00 34.95 34.72 3k98 s ARG 173 CO 0.01 -0.51 1.57 0.99 -1.08 0.00 0.00 175.30 176.27 3k98 s THR 174 N -3.80 2.33 0.19 4.99 2.01 -1.26 -0.20 115.64 119.90 3k98 s THR 174 Ca 0.03 0.26 -0.28 0.00 0.31 0.00 0.00 61.69 62.02 3k98 s THR 174 Cb 0.00 -3.17 -0.08 0.00 0.01 0.00 0.00 72.50 69.26 3k98 s THR 174 CO -0.10 0.03 0.86 -0.62 -0.69 0.00 0.00 174.62 174.10 3k98 s ASP 175 N 0.69 7.50 -0.09 3.53 2.15 0.18 -4.70 116.67 125.93 3k98 s ASP 175 Ca 0.65 1.78 0.14 0.00 0.43 0.00 0.00 52.55 55.55 3k98 s ASP 175 Cb -0.46 -2.55 0.43 0.00 -0.30 0.00 0.00 42.92 40.04 3k98 s ASP 175 CO 0.41 0.16 1.35 0.35 -0.17 0.00 0.00 175.17 177.27 3k98 n THR 176 N 1.67 1.66 -1.07 1.71 -2.24 -1.26 -4.82 114.28 109.92 3k98 n THR 176 Ca -0.03 -1.43 0.00 0.00 -2.27 0.00 0.00 64.05 60.32 3k98 n THR 176 Cb 0.48 0.12 0.00 0.00 -2.10 0.00 0.00 70.33 68.83 3k98 n THR 176 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3k98 n GLY 177 N 0.04 0.77 3.70 3.38 0.00 -1.26 -5.01 105.19 106.81 3k98 n GLY 177 Ca 0.17 -1.85 -0.42 0.00 0.00 0.00 0.00 46.02 43.92 3k98 n GLY 177 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3k98 s GLU 178 N 1.70 4.20 0.07 1.61 0.41 -1.26 -4.92 118.70 120.51 3k98 s GLU 178 Ca 0.00 2.33 -0.31 0.00 -0.41 0.00 0.00 54.97 56.59 3k98 s GLU 178 Cb 0.00 -3.49 -0.08 0.00 -1.78 0.00 0.00 34.13 28.79 3k98 s GLU 178 CO 0.00 -0.70 1.52 -2.14 -0.49 0.00 0.00 175.26 173.45 3k98 s PRO 179 N 2.25 4.25 0.25 0.39 0.02 -1.26 -5.02 135.00 135.88 3k98 s PRO 179 Ca 0.73 2.18 -0.08 0.00 0.02 0.00 0.00 61.00 63.85 3k98 s PRO 179 Cb -0.41 -3.48 -0.06 0.00 0.02 0.00 0.00 34.50 30.57 3k98 s PRO 179 CO 0.32 -0.62 0.55 -1.64 -0.33 0.00 0.00 177.00 175.28 3k98 s MET 180 N 2.12 3.73 -0.01 5.54 -1.94 -1.26 -5.04 119.30 122.43 3k98 s MET 180 Ca 0.69 0.16 -0.06 0.00 -1.71 0.00 0.00 55.69 54.77 3k98 s MET 180 Cb -0.37 -2.65 -0.03 0.00 2.01 0.00 0.00 34.83 33.79 3k98 s MET 180 CO 0.30 0.27 0.48 0.78 -0.01 0.00 0.00 175.02 176.84 3k98 h GLY 181 N 2.18 -0.21 -4.83 -0.03 0.00 -1.96 -3.49 103.07 94.74 3k98 h GLY 181 Ca -0.47 0.08 -0.13 0.00 0.00 0.00 0.00 47.33 46.80 3k98 h GLY 181 CO 0.68 -0.08 -0.34 -1.60 0.00 0.00 0.00 176.54 175.20 3k98 s ARG 182 N -2.35 0.53 0.00 4.80 3.52 -1.25 -4.85 118.95 119.35 3k98 s ARG 182 Ca -0.03 -0.01 0.00 0.00 -0.13 0.00 0.00 55.73 55.56 3k98 s ARG 182 Cb 0.00 0.24 0.00 0.00 -1.56 0.00 0.00 34.95 33.63 3k98 s ARG 182 CO 0.09 -0.12 0.00 0.41 -0.81 0.00 0.00 175.30 174.86 3k98 n GLY 183 N 1.87 0.54 2.81 8.12 0.00 -0.59 -4.35 105.19 113.59 3k98 n GLY 183 Ca -0.19 -2.24 -0.15 0.00 0.00 0.00 0.00 46.02 43.45 3k98 n GLY 183 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3k98 s THR 184 N -0.39 0.03 -0.21 2.61 2.01 -1.02 -0.06 115.64 118.60 3k98 s THR 184 Ca 0.00 0.13 -0.01 0.00 0.31 0.00 0.00 61.69 62.12 3k98 s THR 184 Cb 0.00 -0.13 0.01 0.00 0.01 0.00 0.00 72.50 72.40 3k98 s THR 184 CO 0.00 0.09 -0.11 -0.75 -0.69 0.00 0.00 174.62 173.16 3k98 s LYS 185 N 0.83 3.06 -0.25 4.92 2.20 0.31 -1.68 119.74 129.13 3k98 s LYS 185 Ca -0.07 -0.81 -0.08 0.00 -0.36 0.00 0.00 55.97 54.64 3k98 s LYS 185 Cb -0.10 -2.84 -0.03 0.00 -1.51 0.00 0.00 37.83 33.34 3k98 s LYS 185 CO -0.02 -0.27 0.10 0.08 -0.36 0.00 0.00 175.35 174.88 3k98 s VAL 186 N 1.36 4.60 -0.33 4.02 1.01 0.82 -0.31 120.40 131.57 3k98 s VAL 186 Ca 0.04 -0.08 -0.07 0.00 0.00 0.00 0.00 61.98 61.87 3k98 s VAL 186 Cb -0.15 -3.15 0.03 0.00 0.00 0.00 0.00 36.38 33.11 3k98 s VAL 186 CO -0.07 0.33 0.10 -0.63 0.00 0.00 0.00 175.10 174.83 3k98 s ILE 187 N 1.52 3.83 -0.39 2.22 1.01 0.72 -0.45 121.20 129.65 3k98 s ILE 187 Ca 0.06 -1.02 -0.19 0.00 0.00 0.00 0.00 60.65 59.50 3k98 s ILE 187 Cb -0.15 -3.12 0.01 0.00 0.01 0.00 0.00 42.46 39.21 3k98 s ILE 187 CO 0.05 -0.11 0.54 -0.76 0.00 0.00 0.00 174.94 174.66 3k98 s LEU 188 N 1.43 4.50 -0.64 2.97 1.43 0.31 -1.50 118.68 127.17 3k98 s LEU 188 Ca -0.01 -0.25 -0.24 0.00 -1.03 0.00 0.00 54.13 52.61 3k98 s LEU 188 Cb -0.19 -2.60 0.06 0.00 0.03 0.00 0.00 46.19 43.49 3k98 s LEU 188 CO 0.03 -0.60 1.01 -1.00 0.23 0.00 0.00 176.35 176.01 3k98 s HIS 189 N 2.49 2.64 0.32 0.29 3.76 -0.26 -1.10 115.29 123.44 3k98 s HIS 189 Ca 0.19 -0.34 -0.27 0.00 -0.15 0.00 0.00 55.06 54.49 3k98 s HIS 189 Cb -0.15 -4.29 -0.09 0.00 1.11 0.00 0.00 32.58 29.16 3k98 s HIS 189 CO 0.15 -1.64 1.04 -0.51 -0.85 0.00 0.00 174.74 172.93 3k98 s LEU 190 N 4.29 4.41 0.72 0.89 1.43 -0.55 -1.16 118.68 128.70 3k98 s LEU 190 Ca 0.26 2.09 -0.16 0.00 -1.03 0.00 0.00 54.13 55.29 3k98 s LEU 190 Cb -0.14 -3.85 -0.03 0.00 0.03 0.00 0.00 46.19 42.19 3k98 s LEU 190 CO 0.13 -0.20 0.63 0.29 0.23 0.00 0.00 176.35 177.43 3k98 n LYS 191 N 0.75 0.35 -0.10 1.70 5.02 0.47 -4.65 118.16 121.70 3k98 n LYS 191 Ca 0.01 0.16 -0.01 0.00 -2.02 0.00 0.00 58.31 56.46 3k98 n LYS 191 Cb 0.47 -1.91 0.26 0.00 -0.02 0.00 0.00 35.03 33.83 3k98 n LYS 191 CO 0.00 0.00 0.00 1.49 -0.52 0.00 0.00 177.40 178.37 3k98 h GLU 192 N -0.34 0.76 -0.72 1.97 4.81 -1.95 -1.76 114.58 117.36 3k98 h GLU 192 Ca -0.46 -0.11 0.00 0.00 -0.13 0.00 0.00 59.36 58.66 3k98 h GLU 192 Cb 1.35 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 30.59 3k98 h GLU 192 CO 0.44 0.63 0.00 -0.40 -0.73 0.00 0.00 179.01 178.94 3k98 n ASP 193 N -4.34 3.95 -0.59 1.04 5.75 -1.26 -3.86 116.55 117.24 3k98 n ASP 193 Ca 0.04 -2.56 0.06 0.00 -0.01 0.00 0.00 54.79 52.32 3k98 n ASP 193 Cb 0.16 -0.60 0.16 0.00 -1.03 0.00 0.00 41.12 39.81 3k98 n ASP 193 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3k98 n GLN 194 N 0.42 1.25 0.00 0.11 1.13 -0.66 -4.77 117.38 114.86 3k98 n GLN 194 Ca 0.18 -2.88 0.14 0.00 -1.94 0.00 0.00 57.00 52.49 3k98 n GLN 194 Cb 0.83 -1.34 0.77 0.00 0.11 0.00 0.00 30.24 30.61 3k98 n GLN 194 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 3k98 n THR 195 N -0.94 0.05 0.27 5.09 -2.24 -1.25 -2.92 114.28 112.35 3k98 n THR 195 Ca 0.16 0.01 0.14 0.00 -2.27 0.00 0.00 64.05 62.10 3k98 n THR 195 Cb 0.74 -0.56 0.78 0.00 -2.10 0.00 0.00 70.33 69.18 3k98 n THR 195 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 3k98 h GLU 196 N 0.00 0.00 -0.01 -0.78 4.11 -1.91 -1.70 114.58 114.29 3k98 h GLU 196 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 3k98 h GLU 196 Cb 0.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.37 3k98 h GLU 196 CO 0.00 0.09 0.00 0.66 0.07 0.00 0.00 179.01 179.83 3k98 n TYR 197 N -3.53 0.01 0.28 2.06 4.01 -1.15 -1.66 117.16 117.18 3k98 n TYR 197 Ca -0.02 -0.00 0.12 0.00 -0.16 0.00 0.00 57.90 57.84 3k98 n TYR 197 Cb 0.22 0.00 0.09 0.00 -0.31 0.00 0.00 39.34 39.34 3k98 n TYR 197 CO 0.00 0.00 0.00 -0.07 -0.46 0.00 0.00 176.86 176.33 3k98 h LEU 198 N 0.10 0.00 -9.45 7.72 3.38 -1.55 -3.45 115.31 112.05 3k98 h LEU 198 Ca 0.00 -0.07 -0.53 0.00 0.09 0.00 0.00 57.88 57.37 3k98 h LEU 198 Cb 0.02 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 3k98 h LEU 198 CO 0.00 0.03 0.37 -1.61 0.09 0.00 0.00 178.44 177.33 3k98 s GLU 199 N -3.28 4.59 0.21 1.13 2.02 -0.67 -4.78 118.70 117.93 3k98 s GLU 199 Ca 0.03 1.44 -0.05 0.00 0.02 0.00 0.00 54.97 56.40 3k98 s GLU 199 Cb 0.10 -3.43 0.18 0.00 0.10 0.00 0.00 34.13 31.07 3k98 s GLU 199 CO 0.75 0.01 1.66 1.05 0.02 0.00 0.00 175.26 178.75 3k98 h GLU 200 N 6.47 0.89 -0.56 1.61 4.11 -1.91 -1.34 114.58 123.85 3k98 h GLU 200 Ca -0.42 -0.30 0.05 0.00 0.07 0.00 0.00 59.36 58.76 3k98 h GLU 200 Cb 1.22 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 30.37 3k98 h GLU 200 CO 0.74 0.94 0.37 -0.09 0.07 0.00 0.00 179.01 181.05 3k98 h ARG 201 N 0.80 0.57 -0.08 1.06 2.43 -1.95 0.20 114.38 117.41 3k98 h ARG 201 Ca 0.13 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.25 3k98 h ARG 201 Cb 0.61 -0.13 -0.00 0.00 -0.42 0.00 0.00 29.97 30.03 3k98 h ARG 201 CO 0.04 0.38 -0.01 -0.09 -1.51 0.00 0.00 179.97 178.77 3k98 h ARG 202 N 0.58 0.15 -0.50 0.20 9.65 -1.56 -2.75 114.38 120.15 3k98 h ARG 202 Ca 0.23 -0.05 -0.03 0.00 -1.10 0.00 0.00 59.98 59.03 3k98 h ARG 202 Cb 0.18 -0.01 -0.02 0.00 -1.39 0.00 0.00 29.97 28.73 3k98 h ARG 202 CO -0.06 0.45 0.19 0.82 2.80 0.00 0.00 179.97 184.17 3k98 h ILE 203 N -0.17 1.22 -0.34 1.20 2.04 -0.48 -1.56 117.51 119.42 3k98 h ILE 203 Ca 0.02 -0.70 0.03 0.00 1.00 0.00 0.00 64.86 65.22 3k98 h ILE 203 Cb 0.39 0.73 -0.03 0.00 -0.74 0.00 0.00 36.82 37.17 3k98 h ILE 203 CO 0.01 0.26 0.13 0.11 0.00 0.00 0.00 178.15 178.65 3k98 h LYS 204 N 0.68 0.27 -0.15 2.37 1.57 -0.69 -0.93 116.57 119.68 3k98 h LYS 204 Ca 0.17 -0.02 -0.11 0.00 -1.87 0.00 0.00 60.65 58.82 3k98 h LYS 204 Cb 0.22 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.46 3k98 h LYS 204 CO -0.01 0.18 -0.40 1.05 -0.57 0.00 0.00 179.45 179.69 3k98 h GLU 205 N 0.28 0.34 -0.15 3.15 4.11 -1.23 -0.89 114.58 120.19 3k98 h GLU 205 Ca 0.15 -0.16 -0.18 0.00 0.07 0.00 0.00 59.36 59.24 3k98 h GLU 205 Cb 0.11 -0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.35 3k98 h GLU 205 CO -0.14 0.69 -0.64 0.82 0.07 0.00 0.00 179.01 179.81 3k98 h ILE 206 N 0.29 1.33 -0.26 -1.06 2.04 -1.05 -1.26 117.51 117.53 3k98 h ILE 206 Ca 0.03 -1.93 -0.16 0.00 1.00 0.00 0.00 64.86 63.79 3k98 h ILE 206 Cb 0.84 1.91 -0.00 0.00 -0.74 0.00 0.00 36.82 38.82 3k98 h ILE 206 CO 0.07 0.60 -0.49 0.58 0.00 0.00 0.00 178.15 178.90 3k98 h VAL 207 N 0.40 1.29 0.00 1.67 2.07 -1.03 -2.09 116.25 118.57 3k98 h VAL 207 Ca -0.01 -1.70 -0.06 0.00 0.82 0.00 0.00 66.70 65.75 3k98 h VAL 207 Cb 1.21 1.62 -0.01 0.00 -1.52 0.00 0.00 31.29 32.59 3k98 h VAL 207 CO 0.12 0.54 -0.30 0.50 0.02 0.00 0.00 177.57 178.45 3k98 h LYS 208 N 0.57 0.00 0.16 1.57 3.64 -1.06 -1.34 116.57 120.11 3k98 h LYS 208 Ca 0.03 0.00 -0.34 0.00 -1.27 0.00 0.00 60.65 59.07 3k98 h LYS 208 Cb 1.06 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.88 3k98 h LYS 208 CO 0.10 0.30 -1.69 -0.22 -2.27 0.00 0.00 179.45 175.67 3k98 h LYS 209 N 0.00 0.34 0.00 1.90 3.64 -1.10 -3.41 116.57 117.95 3k98 h LYS 209 Ca -0.00 -0.59 -0.00 0.00 -1.27 0.00 0.00 60.65 58.79 3k98 h LYS 209 Cb 0.60 0.22 -0.00 0.00 -0.41 0.00 0.00 32.23 32.64 3k98 h LYS 209 CO 0.04 1.24 -1.05 0.72 -2.27 0.00 0.00 179.45 178.14 3k98 n HIS 210 N -3.54 0.00 -1.80 1.91 8.25 -0.80 -4.74 115.22 114.51 3k98 n HIS 210 Ca -0.22 0.00 -0.14 0.00 -0.26 0.00 0.00 57.72 57.10 3k98 n HIS 210 Cb 1.07 -0.02 0.10 0.00 1.12 0.00 0.00 29.99 32.25 3k98 n HIS 210 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 3k98 n SER 211 N -1.58 3.92 0.21 0.41 7.64 -0.51 -4.73 113.62 118.98 3k98 n SER 211 Ca -0.00 -3.80 0.11 0.00 1.01 0.00 0.00 58.87 56.19 3k98 n SER 211 Cb 0.07 -0.46 0.16 0.00 -1.01 0.00 0.00 64.21 62.97 3k98 n SER 211 CO 0.00 0.00 0.00 0.06 -3.01 0.00 0.00 175.04 172.09 3k98 h GLN 212 N 1.71 0.00 -0.52 1.43 -0.00 -1.77 -3.19 115.11 112.77 3k98 h GLN 212 Ca 0.26 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.91 3k98 h GLN 212 Cb 1.36 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.84 3k98 h GLN 212 CO 0.56 0.04 0.00 1.19 -0.00 0.00 0.00 178.83 180.62 3k98 n PHE 213 N -3.11 0.69 -2.40 0.06 3.72 -1.26 -4.94 117.46 110.22 3k98 n PHE 213 Ca 0.04 -0.44 -0.42 0.00 -0.05 0.00 0.00 57.45 56.57 3k98 n PHE 213 Cb 0.55 -0.01 -0.03 0.00 -0.94 0.00 0.00 39.48 39.05 3k98 n PHE 213 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 3k98 s ILE 214 N -1.06 4.11 -0.41 4.37 -1.09 -1.21 -4.93 121.20 120.98 3k98 s ILE 214 Ca 0.37 1.46 -0.00 0.00 -2.23 0.00 0.00 60.65 60.24 3k98 s ILE 214 Cb 0.20 -3.94 0.33 0.00 -1.58 0.00 0.00 42.46 37.47 3k98 s ILE 214 CO 0.26 0.01 1.93 0.61 -1.23 0.00 0.00 174.94 176.52 3k98 n GLY 215 N 3.41 4.48 3.07 6.18 0.00 -1.26 -4.85 105.19 116.23 3k98 n GLY 215 Ca 0.11 -1.34 -0.08 0.00 0.00 0.00 0.00 46.02 44.71 3k98 n GLY 215 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3k98 s TYR 216 N -2.45 0.51 0.18 1.61 2.02 -1.26 -5.12 117.35 112.84 3k98 s TYR 216 Ca 0.42 -0.91 -0.32 0.00 -0.37 0.00 0.00 57.07 55.89 3k98 s TYR 216 Cb 0.33 -0.36 -0.11 0.00 -0.40 0.00 0.00 41.96 41.42 3k98 s TYR 216 CO 0.01 -0.30 1.70 -2.14 -1.57 0.00 0.00 175.55 173.26 3k98 s PRO 217 N -3.27 4.15 -0.26 -1.71 0.02 -1.26 -4.86 135.00 127.81 3k98 s PRO 217 Ca 0.02 2.54 -0.01 0.00 0.02 0.00 0.00 61.00 63.57 3k98 s PRO 217 Cb 0.03 -3.19 0.04 0.00 0.02 0.00 0.00 34.50 31.39 3k98 s PRO 217 CO -0.07 -0.74 -0.06 0.42 -0.33 0.00 0.00 177.00 176.22 3k98 s ILE 218 N 1.48 2.73 -0.06 2.83 1.01 -1.26 -0.59 121.20 127.33 3k98 s ILE 218 Ca 0.75 -1.20 0.05 0.00 0.00 0.00 0.00 60.65 60.25 3k98 s ILE 218 Cb -0.47 -2.45 -0.01 0.00 0.01 0.00 0.00 42.46 39.54 3k98 s ILE 218 CO 0.32 0.12 -0.23 -0.89 0.00 0.00 0.00 174.94 174.26 3k98 s THR 219 N 1.27 2.20 -0.02 2.92 2.01 -0.04 -5.00 115.64 118.98 3k98 s THR 219 Ca -0.02 -1.01 -0.13 0.00 0.31 0.00 0.00 61.69 60.84 3k98 s THR 219 Cb -0.18 -1.81 -0.05 0.00 0.01 0.00 0.00 72.50 70.47 3k98 s THR 219 CO -0.04 0.57 0.36 -0.22 -0.69 0.00 0.00 174.62 174.60 3k98 s LEU 220 N -0.14 4.46 -0.28 4.42 2.96 -1.26 -0.33 118.68 128.51 3k98 s LEU 220 Ca -0.04 0.88 0.00 0.00 -0.22 0.00 0.00 54.13 54.75 3k98 s LEU 220 Cb -0.14 -2.52 0.08 0.00 0.50 0.00 0.00 46.19 44.11 3k98 s LEU 220 CO 0.04 0.33 0.03 -0.36 -1.32 0.00 0.00 176.35 175.07 3k98 s PHE 221 N -1.09 2.25 -0.57 5.38 0.08 0.27 -4.93 117.98 119.37 3k98 s PHE 221 Ca 0.23 -1.88 -0.28 0.00 0.12 0.00 0.00 56.93 55.12 3k98 s PHE 221 Cb -0.16 -1.81 0.03 0.00 -0.57 0.00 0.00 43.02 40.51 3k98 s PHE 221 CO 0.12 -0.82 1.25 0.08 -0.10 0.00 0.00 175.22 175.74 3k98 s VAL 222 N 1.44 3.96 -0.13 -0.44 1.01 -1.26 -3.73 120.40 121.25 3k98 s VAL 222 Ca 0.03 0.85 -0.23 0.00 0.00 0.00 0.00 61.98 62.63 3k98 s VAL 222 Cb -0.18 -4.66 -0.03 0.00 0.00 0.00 0.00 36.38 31.51 3k98 s VAL 222 CO -0.14 -1.30 0.73 -0.70 0.00 0.00 0.00 175.10 173.70 3k98 s GLU 223 N 5.08 4.33 -0.10 2.72 2.12 -0.98 -5.03 118.70 126.83 3k98 s GLU 223 Ca 0.45 0.87 -0.04 0.00 0.36 0.00 0.00 54.97 56.61 3k98 s GLU 223 Cb -0.08 -3.52 0.05 0.00 0.26 0.00 0.00 34.13 30.84 3k98 s GLU 223 CO 0.25 -0.15 0.18 0.15 -0.54 0.00 0.00 175.26 175.16 3k98 s LYS 224 N 1.54 0.06 0.24 4.30 1.02 -1.26 -4.43 119.74 121.21 3k98 s LYS 224 Ca 0.36 0.54 -0.30 0.00 0.02 0.00 0.00 55.97 56.59 3k98 s LYS 224 Cb -0.17 -0.36 -0.09 0.00 -0.52 0.00 0.00 37.83 36.70 3k98 s LYS 224 CO 0.14 -0.34 1.01 -1.21 -0.92 0.00 0.00 175.35 174.03 3k98 s GLU 225 N 2.31 4.75 0.55 1.68 8.01 -1.26 -5.04 118.70 129.70 3k98 s GLU 225 Ca 0.03 1.62 -0.04 0.00 0.01 0.00 0.00 54.97 56.59 3k98 s GLU 225 Cb -0.12 -3.25 0.01 0.00 -4.31 0.00 0.00 34.13 26.45 3k98 s GLU 225 CO -0.07 0.35 0.84 -0.51 0.01 0.00 0.00 175.26 175.89 3k98 s LEU 226 N -1.14 3.34 0.13 1.80 1.43 -1.25 -4.96 118.68 118.03 3k98 s LEU 226 Ca 0.43 0.60 -0.35 0.00 -1.03 0.00 0.00 54.13 53.79 3k98 s LEU 226 Cb -0.28 -3.45 -0.16 0.00 0.03 0.00 0.00 46.19 42.34 3k98 s LEU 226 CO 0.35 -0.97 1.35 1.21 0.23 0.00 0.00 176.35 178.52 3k98 n GLU 227 N -2.45 1.40 0.00 1.70 2.13 -1.26 -0.94 120.64 121.22 3k98 n GLU 227 Ca 0.04 0.50 0.00 0.00 0.66 0.00 0.00 57.16 58.36 3k98 n GLU 227 Cb 0.58 -2.13 0.00 0.00 0.27 0.00 0.00 31.44 30.15 3k98 n GLU 227 CO 0.00 0.00 0.00 0.72 -0.41 0.00 0.00 177.13 177.44 3k98 n HIS 228 N 2.39 0.00 1.04 4.31 8.25 -1.26 -5.35 115.22 124.60 3k98 n HIS 228 Ca 0.17 0.00 0.12 0.00 -0.26 0.00 0.00 57.72 57.75 3k98 n HIS 228 Cb 0.23 -0.07 0.13 0.00 1.12 0.00 0.00 29.99 31.41 3k98 n HIS 228 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70