#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2o98 s PRO 5 N 0.00 4.08 0.89 0.00 0.04 -1.26 -5.07 135.00 133.68 2o98 s PRO 5 Ca 0.00 0.65 -0.11 0.00 0.04 0.00 0.00 61.00 61.58 2o98 s PRO 5 Cb 0.00 -2.81 0.13 0.00 0.04 0.00 0.00 34.50 31.86 2o98 s PRO 5 CO 0.00 0.38 1.10 0.95 0.04 0.00 0.00 177.00 179.47 2o98 s THR 6 N -1.60 2.64 0.46 1.26 -4.23 -1.26 -4.77 115.64 108.15 2o98 s THR 6 Ca 0.43 0.21 0.20 0.00 -1.18 0.00 0.00 61.69 61.35 2o98 s THR 6 Cb -0.15 -2.53 0.24 0.00 1.34 0.00 0.00 72.50 71.41 2o98 s THR 6 CO 0.20 -0.27 2.06 0.00 -0.54 0.00 0.00 174.62 176.07 2o98 h ALA 7 N -1.62 1.59 0.13 3.99 0.00 -1.98 0.11 119.26 121.47 2o98 h ALA 7 Ca -0.47 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.31 2o98 h ALA 7 Cb 1.27 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.04 2o98 h ALA 7 CO 0.50 0.16 -0.06 -0.09 0.00 0.00 0.00 179.25 179.76 2o98 h ARG 8 N 0.00 -0.16 -0.88 0.00 2.43 -1.97 -2.17 114.38 111.63 2o98 h ARG 8 Ca -0.00 0.01 0.09 0.00 -0.81 0.00 0.00 59.98 59.27 2o98 h ARG 8 Cb 0.26 0.04 -0.07 0.00 -0.42 0.00 0.00 29.97 29.77 2o98 h ARG 8 CO 0.02 0.31 0.53 1.49 -1.51 0.00 0.00 179.97 180.81 2o98 h GLU 9 N -0.80 0.88 -0.41 0.20 4.81 -1.86 -1.22 114.58 116.18 2o98 h GLU 9 Ca -0.02 -0.05 -0.05 0.00 -0.13 0.00 0.00 59.36 59.11 2o98 h GLU 9 Cb 0.55 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 29.71 2o98 h GLU 9 CO 0.03 0.58 0.08 1.49 -0.73 0.00 0.00 179.01 180.46 2o98 h GLU 10 N 0.91 0.67 -0.30 1.92 4.57 -0.84 -2.15 114.58 119.35 2o98 h GLU 10 Ca 0.41 -0.17 -0.04 0.00 -1.18 0.00 0.00 59.36 58.38 2o98 h GLU 10 Cb 0.32 -0.08 -0.02 0.00 -0.16 0.00 0.00 28.75 28.82 2o98 h GLU 10 CO -0.23 0.70 0.01 -0.91 -1.18 0.00 0.00 179.01 177.40 2o98 h ASN 11 N 0.52 0.42 -0.14 1.04 2.35 -0.66 -0.95 115.58 118.15 2o98 h ASN 11 Ca 0.12 -0.07 -0.06 0.00 -0.55 0.00 0.00 56.30 55.75 2o98 h ASN 11 Cb 0.35 -0.11 -0.00 0.00 0.05 0.00 0.00 38.32 38.61 2o98 h ASN 11 CO 0.01 0.48 -0.14 0.58 -1.65 0.00 0.00 177.43 176.71 2o98 h VAL 12 N 0.44 1.35 -0.68 2.81 2.07 -1.08 0.15 116.25 121.30 2o98 h VAL 12 Ca 0.10 -1.29 0.06 0.00 0.82 0.00 0.00 66.70 66.39 2o98 h VAL 12 Cb 0.28 1.87 -0.06 0.00 -1.52 0.00 0.00 31.29 31.87 2o98 h VAL 12 CO 0.01 0.38 0.38 0.22 0.02 0.00 0.00 177.57 178.57 2o98 h TYR 13 N -0.03 0.69 -0.95 1.57 5.03 -1.30 -1.80 116.97 120.18 2o98 h TYR 13 Ca 0.02 0.03 0.06 0.00 2.58 0.00 0.00 58.73 61.42 2o98 h TYR 13 Cb 0.66 -0.21 -0.06 0.00 1.55 0.00 0.00 36.73 38.67 2o98 h TYR 13 CO 0.08 0.32 0.62 0.52 -1.32 0.00 0.00 178.16 178.39 2o98 h MET 14 N 0.69 1.08 -0.77 1.82 2.86 -0.75 -1.32 114.93 118.54 2o98 h MET 14 Ca 0.31 -0.06 -0.05 0.00 -2.06 0.00 0.00 59.70 57.83 2o98 h MET 14 Cb 0.20 -0.24 -0.03 0.00 0.06 0.00 0.00 31.60 31.58 2o98 h MET 14 CO -0.19 0.71 0.28 0.00 1.06 0.00 0.00 176.91 178.77 2o98 h ALA 15 N 1.48 1.03 -0.40 6.32 0.00 0.11 -1.95 119.26 125.85 2o98 h ALA 15 Ca 0.41 -0.21 -0.14 0.00 0.00 0.00 0.00 54.91 54.96 2o98 h ALA 15 Cb 0.16 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 2o98 h ALA 15 CO -0.15 0.67 -0.32 0.87 0.00 0.00 0.00 179.25 180.31 2o98 h LYS 16 N 1.13 0.90 -0.37 0.00 1.57 -0.73 -0.68 116.57 118.39 2o98 h LYS 16 Ca 0.25 -0.43 0.03 0.00 -1.87 0.00 0.00 60.65 58.64 2o98 h LYS 16 Cb 0.26 -0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.53 2o98 h LYS 16 CO -0.01 1.08 0.16 -0.07 -0.57 0.00 0.00 179.45 180.03 2o98 h LEU 17 N 0.75 0.21 -0.88 2.94 3.38 -1.09 -2.89 115.31 117.73 2o98 h LEU 17 Ca 0.08 0.03 -0.05 0.00 0.09 0.00 0.00 57.88 58.02 2o98 h LEU 17 Cb 0.89 -0.01 -0.03 0.00 0.09 0.00 0.00 40.66 41.60 2o98 h LEU 17 CO 0.08 0.16 0.22 0.00 0.09 0.00 0.00 178.44 178.99 2o98 h ALA 18 N 1.21 1.09 -0.70 1.53 0.00 -0.95 -0.75 119.26 120.69 2o98 h ALA 18 Ca 0.16 -0.21 0.01 0.00 0.00 0.00 0.00 54.91 54.87 2o98 h ALA 18 Cb 0.10 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 17.59 2o98 h ALA 18 CO -0.14 0.62 0.47 1.49 0.00 0.00 0.00 179.25 181.69 2o98 h GLU 19 N 1.02 0.92 -0.02 0.00 4.22 -1.03 0.29 114.58 119.97 2o98 h GLU 19 Ca 0.23 -0.06 -0.21 0.00 0.08 0.00 0.00 59.36 59.40 2o98 h GLU 19 Cb 0.27 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.32 2o98 h GLU 19 CO -0.01 0.61 -0.88 1.96 -2.18 0.00 0.00 179.01 178.51 2o98 h GLN 20 N 0.95 0.41 0.00 1.92 4.20 -1.25 -2.75 115.11 118.59 2o98 h GLN 20 Ca 0.26 -0.41 0.00 0.00 0.06 0.00 0.00 58.65 58.56 2o98 h GLN 20 Cb -0.10 0.11 0.00 0.00 0.30 0.00 0.00 27.48 27.78 2o98 h GLN 20 CO -0.06 1.07 0.00 0.00 -0.67 0.00 0.00 178.83 179.17 2o98 n ALA 21 N -2.53 2.12 -2.03 3.87 0.00 -0.33 -4.90 120.51 116.71 2o98 n ALA 21 Ca -0.06 -0.08 -0.07 0.00 0.00 0.00 0.00 53.44 53.23 2o98 n ALA 21 Cb 0.80 -1.39 -0.01 0.00 0.00 0.00 0.00 19.45 18.85 2o98 n ALA 21 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2o98 n GLU 22 N -1.50 -0.56 -3.11 0.00 1.02 0.47 -4.95 120.64 112.02 2o98 n GLU 22 Ca 0.06 0.39 -0.40 0.00 -0.02 0.00 0.00 57.16 57.19 2o98 n GLU 22 Cb 0.28 -4.28 -0.01 0.00 -0.02 0.00 0.00 31.44 27.42 2o98 n GLU 22 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2o98 n ARG 23 N -1.81 4.05 -0.03 3.49 1.74 0.71 -4.88 116.66 119.94 2o98 n ARG 23 Ca -0.08 -4.57 -0.09 0.00 -0.77 0.00 0.00 57.85 52.33 2o98 n ARG 23 Cb 0.53 -2.46 0.07 0.00 -1.02 0.00 0.00 32.46 29.57 2o98 n ARG 23 CO 0.00 0.00 0.00 1.88 -1.52 0.00 0.00 177.63 177.99 2o98 h TYR 24 N 5.27 0.76 -0.35 -1.55 0.05 -1.93 -1.78 116.97 117.45 2o98 h TYR 24 Ca 0.20 -0.23 0.06 0.00 0.05 0.00 0.00 58.73 58.80 2o98 h TYR 24 Cb 0.64 -0.16 -0.05 0.00 1.01 0.00 0.00 36.73 38.17 2o98 h TYR 24 CO 0.94 0.96 0.04 0.93 -1.05 0.00 0.00 178.16 179.98 2o98 h GLU 25 N 0.51 0.14 -0.72 4.88 4.39 -1.89 0.61 114.58 122.51 2o98 h GLU 25 Ca 0.04 -0.01 -0.02 0.00 0.34 0.00 0.00 59.36 59.70 2o98 h GLU 25 Cb 0.96 -0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 29.54 2o98 h GLU 25 CO 0.09 0.10 0.35 0.93 -1.16 0.00 0.00 179.01 179.31 2o98 h GLU 26 N 0.15 1.02 -0.03 2.33 5.08 -1.94 -1.07 114.58 120.11 2o98 h GLU 26 Ca 0.17 -0.14 0.03 0.00 -1.00 0.00 0.00 59.36 58.42 2o98 h GLU 26 Cb 0.21 -0.19 -0.04 0.00 0.50 0.00 0.00 28.75 29.23 2o98 h GLU 26 CO -0.24 0.78 -0.20 1.98 -1.00 0.00 0.00 179.01 180.33 2o98 h MET 27 N 1.01 -0.29 -0.54 2.33 4.05 -0.35 0.27 114.93 121.41 2o98 h MET 27 Ca 0.25 0.02 0.11 0.00 -0.28 0.00 0.00 59.70 59.80 2o98 h MET 27 Cb 0.10 0.06 -0.09 0.00 -0.80 0.00 0.00 31.60 30.87 2o98 h MET 27 CO -0.03 -0.19 -0.01 0.28 0.23 0.00 0.00 176.91 177.18 2o98 h VAL 28 N -0.30 0.55 -0.30 -5.77 2.07 -0.60 -0.08 116.25 111.82 2o98 h VAL 28 Ca 0.07 -0.04 0.04 0.00 0.82 0.00 0.00 66.70 67.59 2o98 h VAL 28 Cb 0.39 0.44 -0.04 0.00 -1.52 0.00 0.00 31.29 30.56 2o98 h VAL 28 CO -0.21 0.02 0.06 -0.33 0.02 0.00 0.00 177.57 177.13 2o98 h GLU 29 N 0.11 0.17 -0.40 1.57 5.08 0.04 0.38 114.58 121.52 2o98 h GLU 29 Ca 0.28 -0.01 -0.04 0.00 -1.00 0.00 0.00 59.36 58.59 2o98 h GLU 29 Cb 0.43 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.63 2o98 h GLU 29 CO -0.47 0.11 0.11 0.74 -1.00 0.00 0.00 179.01 178.50 2o98 h PHE 30 N 0.17 0.67 -0.59 4.33 0.05 0.00 -0.96 116.94 120.61 2o98 h PHE 30 Ca 0.14 -0.08 -0.09 0.00 3.82 0.00 0.00 57.97 61.77 2o98 h PHE 30 Cb 0.15 -0.19 -0.02 0.00 2.00 0.00 0.00 35.95 37.89 2o98 h PHE 30 CO -0.17 0.64 0.03 0.52 -0.18 0.00 0.00 178.31 179.15 2o98 h MET 31 N 0.51 1.02 -0.85 1.51 2.86 -0.51 -2.57 114.93 116.90 2o98 h MET 31 Ca 0.13 -0.31 -0.02 0.00 -2.06 0.00 0.00 59.70 57.44 2o98 h MET 31 Cb 0.30 -0.10 -0.04 0.00 0.06 0.00 0.00 31.60 31.82 2o98 h MET 31 CO 0.00 0.99 0.45 0.93 1.06 0.00 0.00 176.91 180.35 2o98 h GLU 32 N 0.92 1.20 0.00 1.72 5.08 -0.15 -1.89 114.58 121.46 2o98 h GLU 32 Ca 0.17 -0.15 -0.00 0.00 -1.00 0.00 0.00 59.36 58.38 2o98 h GLU 32 Cb 0.51 -0.23 -0.00 0.00 0.50 0.00 0.00 28.75 29.53 2o98 h GLU 32 CO 0.02 0.89 -0.02 0.87 -1.00 0.00 0.00 179.01 179.78 2o98 h LYS 33 N 1.20 0.00 0.02 2.33 1.57 -0.87 -1.84 116.57 118.98 2o98 h LYS 33 Ca 0.30 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 59.05 2o98 h LYS 33 Cb 0.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.37 2o98 h LYS 33 CO -0.05 0.02 -0.10 0.28 -0.57 0.00 0.00 179.45 179.03 2o98 h VAL 34 N 0.00 1.76 0.00 0.50 2.07 -1.01 -3.18 116.25 116.39 2o98 h VAL 34 Ca -0.00 -2.35 0.00 0.00 0.82 0.00 0.00 66.70 65.17 2o98 h VAL 34 Cb 0.13 3.35 0.00 0.00 -1.52 0.00 0.00 31.29 33.25 2o98 h VAL 34 CO 0.00 0.62 0.00 -1.54 0.02 0.00 0.00 177.57 176.67 2o98 n SER 35 N -4.55 0.00 0.02 0.57 3.41 -0.77 -2.30 113.62 110.00 2o98 n SER 35 Ca -0.10 0.29 -0.09 0.00 -0.26 0.00 0.00 58.87 58.71 2o98 n SER 35 Cb 0.52 -0.42 -0.13 0.00 -0.26 0.00 0.00 64.21 63.92 2o98 n SER 35 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 2o98 h ASN 36 N 0.00 0.05 1.46 4.04 2.35 -1.41 -3.37 115.58 118.70 2o98 h ASN 36 Ca 0.00 -0.08 -0.05 0.00 -0.55 0.00 0.00 56.30 55.63 2o98 h ASN 36 Cb 0.32 -0.02 -0.01 0.00 0.05 0.00 0.00 38.32 38.67 2o98 h ASN 36 CO 0.00 1.07 -0.22 0.77 -1.65 0.00 0.00 177.43 177.40 2o98 h SER 37 N 0.01 0.00 -3.85 5.81 4.64 -1.43 -3.45 113.55 115.28 2o98 h SER 37 Ca -0.19 0.00 -0.50 0.00 -0.47 0.00 0.00 61.79 60.63 2o98 h SER 37 Cb 1.93 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 64.04 2o98 h SER 37 CO 0.11 0.22 0.49 -0.76 -0.87 0.00 0.00 176.83 176.01 2o98 s LEU 38 N -6.43 4.45 0.00 5.97 1.43 -1.13 -5.04 118.68 117.93 2o98 s LEU 38 Ca 0.04 2.30 0.00 0.00 -1.03 0.00 0.00 54.13 55.44 2o98 s LEU 38 Cb 0.08 -3.74 0.00 0.00 0.03 0.00 0.00 46.19 42.55 2o98 s LEU 38 CO 0.67 -0.29 0.00 0.61 0.23 0.00 0.00 176.35 177.57 2o98 n GLY 39 N 0.98 0.39 0.28 -3.19 0.00 -1.26 -4.87 105.19 97.52 2o98 n GLY 39 Ca 0.00 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.19 2o98 n GLY 39 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2o98 h SER 40 N 0.00 0.00 -3.85 1.61 4.64 -2.01 -3.44 113.55 110.50 2o98 h SER 40 Ca 0.00 0.00 -0.51 0.00 -0.47 0.00 0.00 61.79 60.81 2o98 h SER 40 Cb 0.00 0.00 0.04 0.00 -0.31 0.00 0.00 62.40 62.13 2o98 h SER 40 CO 0.00 0.06 0.56 -1.61 -0.87 0.00 0.00 176.83 174.97 2o98 s GLU 41 N -3.87 4.48 0.67 4.77 8.01 -1.26 -4.95 118.70 126.54 2o98 s GLU 41 Ca -0.01 2.02 -0.06 0.00 0.01 0.00 0.00 54.97 56.93 2o98 s GLU 41 Cb 0.11 -3.11 0.04 0.00 -4.31 0.00 0.00 34.13 26.86 2o98 s GLU 41 CO 0.54 -0.01 0.97 -1.83 0.01 0.00 0.00 175.26 174.94 2o98 s GLU 42 N -1.65 2.42 0.43 1.61 -1.05 -1.26 -4.92 118.70 114.27 2o98 s GLU 42 Ca 0.47 -0.20 -0.22 0.00 -0.15 0.00 0.00 54.97 54.87 2o98 s GLU 42 Cb -0.36 -2.21 -0.09 0.00 -0.44 0.00 0.00 34.13 31.03 2o98 s GLU 42 CO 0.47 -1.07 1.03 -0.51 0.95 0.00 0.00 175.26 176.13 2o98 s LEU 43 N -5.16 4.02 1.10 1.83 1.43 -1.26 -5.05 118.68 115.59 2o98 s LEU 43 Ca 0.58 1.95 -0.12 0.00 -1.03 0.00 0.00 54.13 55.51 2o98 s LEU 43 Cb -0.11 -4.35 0.25 0.00 0.03 0.00 0.00 46.19 42.01 2o98 s LEU 43 CO 0.45 -0.56 1.06 0.42 0.23 0.00 0.00 176.35 177.95 2o98 s THR 44 N -1.83 2.05 0.18 5.49 -4.23 -1.26 -4.68 115.64 111.35 2o98 s THR 44 Ca 0.61 0.01 -0.17 0.00 -1.18 0.00 0.00 61.69 60.97 2o98 s THR 44 Cb -0.18 -2.07 0.12 0.00 1.34 0.00 0.00 72.50 71.72 2o98 s THR 44 CO 0.23 -0.02 1.65 0.58 -0.54 0.00 0.00 174.62 176.52 2o98 h VAL 45 N -2.42 0.51 0.23 2.29 2.07 -1.99 -0.61 116.25 116.32 2o98 h VAL 45 Ca -0.57 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 66.95 2o98 h VAL 45 Cb 1.32 0.51 -0.01 0.00 -1.52 0.00 0.00 31.29 31.58 2o98 h VAL 45 CO 0.48 0.00 -0.19 -0.08 0.02 0.00 0.00 177.57 177.80 2o98 h GLU 46 N -0.03 -0.42 0.38 1.57 4.81 -1.99 -0.05 114.58 118.85 2o98 h GLU 46 Ca 0.21 0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.47 2o98 h GLU 46 Cb 0.36 0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.81 2o98 h GLU 46 CO -0.47 -0.28 -0.41 0.93 -0.73 0.00 0.00 179.01 178.05 2o98 h GLU 47 N -0.43 -0.79 -0.25 1.92 5.08 -1.88 0.19 114.58 118.42 2o98 h GLU 47 Ca -0.01 0.05 0.02 0.00 -1.00 0.00 0.00 59.36 58.43 2o98 h GLU 47 Cb 0.39 0.18 -0.03 0.00 0.50 0.00 0.00 28.75 29.79 2o98 h GLU 47 CO -0.02 -0.52 -0.15 -2.13 -1.00 0.00 0.00 179.01 175.18 2o98 n ARG 48 N -5.50 -0.11 0.21 2.33 0.63 -0.25 -0.53 116.66 113.43 2o98 n ARG 48 Ca -0.10 0.58 -0.15 0.00 -0.92 0.00 0.00 57.85 57.26 2o98 n ARG 48 Cb 0.40 -0.85 -0.08 0.00 0.45 0.00 0.00 32.46 32.38 2o98 n ARG 48 CO 0.00 0.00 0.00 -0.91 -2.51 0.00 0.00 177.63 174.21 2o98 h ASN 49 N 0.00 -0.39 -0.79 6.15 2.35 -0.07 -0.50 115.58 122.32 2o98 h ASN 49 Ca 0.04 -0.01 0.17 0.00 -0.55 0.00 0.00 56.30 55.95 2o98 h ASN 49 Cb 0.10 0.10 -0.15 0.00 0.05 0.00 0.00 38.32 38.43 2o98 h ASN 49 CO -0.24 -0.25 -0.09 -0.07 -1.65 0.00 0.00 177.43 175.13 2o98 h LEU 50 N -0.51 -0.55 0.35 1.61 -0.00 0.21 0.12 115.31 116.54 2o98 h LEU 50 Ca -0.05 0.22 -0.02 0.00 -0.00 0.00 0.00 57.88 58.04 2o98 h LEU 50 Cb 0.38 0.43 0.00 0.00 -0.00 0.00 0.00 40.66 41.48 2o98 h LEU 50 CO 0.08 -0.24 -0.18 0.25 -0.00 0.00 0.00 178.44 178.35 2o98 h LEU 51 N 0.04 -0.43 -1.04 1.67 5.85 -0.16 -1.69 115.31 119.55 2o98 h LEU 51 Ca 0.41 0.02 0.03 0.00 0.84 0.00 0.00 57.88 59.19 2o98 h LEU 51 Cb 0.70 0.12 -0.06 0.00 0.37 0.00 0.00 40.66 41.79 2o98 h LEU 51 CO -0.76 -0.30 0.64 0.77 -0.34 0.00 0.00 178.44 178.45 2o98 h SER 52 N -0.49 1.08 -0.47 1.25 4.64 0.20 -2.06 113.55 117.70 2o98 h SER 52 Ca -0.04 -0.01 -0.08 0.00 -0.47 0.00 0.00 61.79 61.18 2o98 h SER 52 Cb 0.38 -0.25 -0.02 0.00 -0.31 0.00 0.00 62.40 62.20 2o98 h SER 52 CO 0.07 0.74 -0.04 0.58 -0.87 0.00 0.00 176.83 177.32 2o98 h VAL 53 N 1.25 1.27 0.47 0.95 2.07 -0.83 0.70 116.25 122.13 2o98 h VAL 53 Ca 0.38 -1.12 -0.01 0.00 0.82 0.00 0.00 66.70 66.77 2o98 h VAL 53 Cb -0.02 1.05 -0.01 0.00 -1.52 0.00 0.00 31.29 30.78 2o98 h VAL 53 CO -0.11 0.39 -0.37 0.00 0.02 0.00 0.00 177.57 177.49 2o98 h ALA 54 N 0.91 -0.87 -0.69 1.67 0.00 -0.64 -0.09 119.26 119.55 2o98 h ALA 54 Ca 0.13 -0.15 0.02 0.00 0.00 0.00 0.00 54.91 54.91 2o98 h ALA 54 Cb 0.56 0.50 -0.04 0.00 0.00 0.00 0.00 17.79 18.81 2o98 h ALA 54 CO 0.03 -1.02 0.44 1.88 0.00 0.00 0.00 179.25 180.59 2o98 h TYR 55 N -0.84 0.84 -0.46 0.00 0.05 -1.39 -0.36 116.97 114.81 2o98 h TYR 55 Ca -0.05 0.02 0.09 0.00 0.05 0.00 0.00 58.73 58.85 2o98 h TYR 55 Cb 0.72 -0.28 -0.09 0.00 1.01 0.00 0.00 36.73 38.09 2o98 h TYR 55 CO -0.16 0.50 -0.12 -0.22 -1.05 0.00 0.00 178.16 177.11 2o98 h LYS 56 N 0.88 -0.00 -0.17 4.88 3.64 -0.62 0.23 116.57 125.41 2o98 h LYS 56 Ca 0.27 0.00 -0.12 0.00 -1.27 0.00 0.00 60.65 59.53 2o98 h LYS 56 Cb -0.03 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.79 2o98 h LYS 56 CO -0.09 -0.00 -0.35 -0.91 -2.27 0.00 0.00 179.45 175.83 2o98 h ASN 57 N -0.00 0.60 -0.57 4.20 4.21 -0.73 0.68 115.58 123.97 2o98 h ASN 57 Ca 0.22 -0.56 0.04 0.00 1.21 0.00 0.00 56.30 57.21 2o98 h ASN 57 Cb 0.34 -0.17 -0.04 0.00 -1.12 0.00 0.00 38.32 37.32 2o98 h ASN 57 CO -0.48 1.05 0.32 0.58 -1.29 0.00 0.00 177.43 177.61 2o98 h VAL 58 N 0.17 1.01 0.04 2.81 2.07 -0.92 -1.02 116.25 120.41 2o98 h VAL 58 Ca 0.00 -0.22 -0.24 0.00 0.82 0.00 0.00 66.70 67.07 2o98 h VAL 58 Cb 0.95 0.33 0.00 0.00 -1.52 0.00 0.00 31.29 31.05 2o98 h VAL 58 CO 0.08 0.11 -1.02 -0.29 0.02 0.00 0.00 177.57 176.47 2o98 h ILE 59 N 0.63 1.43 -0.17 4.57 -0.00 -0.92 -3.30 117.51 119.75 2o98 h ILE 59 Ca 0.24 -2.63 -0.00 0.00 -0.00 0.00 0.00 64.86 62.47 2o98 h ILE 59 Cb 0.09 2.57 -0.01 0.00 -0.00 0.00 0.00 36.82 39.47 2o98 h ILE 59 CO -0.13 0.78 0.10 1.23 -0.00 0.00 0.00 178.15 180.13 2o98 h GLY 60 N 1.37 0.25 -0.27 8.18 0.00 0.70 -1.08 103.07 112.20 2o98 h GLY 60 Ca -0.09 -0.10 0.28 0.00 0.00 0.00 0.00 47.33 47.42 2o98 h GLY 60 CO 0.17 0.10 0.67 0.00 0.00 0.00 0.00 176.54 177.48 2o98 h ALA 61 N 1.02 2.18 0.09 3.60 0.00 -1.27 0.16 119.26 125.04 2o98 h ALA 61 Ca 0.06 0.09 -0.29 0.00 0.00 0.00 0.00 54.91 54.77 2o98 h ALA 61 Cb 0.03 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 2o98 h ALA 61 CO -0.01 -0.64 -1.43 0.00 0.00 0.00 0.00 179.25 177.17 2o98 h ARG 62 N 0.39 0.18 -0.24 0.00 -0.00 -1.38 -2.03 114.38 111.31 2o98 h ARG 62 Ca 0.64 -0.31 -0.02 0.00 -0.50 0.00 0.00 59.98 59.79 2o98 h ARG 62 Cb 1.58 0.12 -0.01 0.00 0.00 0.00 0.00 29.97 31.66 2o98 h ARG 62 CO -0.37 1.04 0.07 0.00 0.00 0.00 0.00 179.97 180.71 2o98 h ARG 63 N 0.05 0.37 -0.26 0.04 3.08 -0.46 0.16 114.38 117.36 2o98 h ARG 63 Ca -0.20 -0.08 0.06 0.00 0.07 0.00 0.00 59.98 59.83 2o98 h ARG 63 Cb 1.97 -0.05 -0.08 0.00 0.08 0.00 0.00 29.97 31.89 2o98 h ARG 63 CO 0.15 0.46 -0.36 0.00 -1.07 0.00 0.00 179.97 179.15 2o98 h ALA 64 N 0.90 -0.37 -0.64 0.04 0.00 -1.04 0.81 119.26 118.95 2o98 h ALA 64 Ca 0.08 0.05 0.10 0.00 0.00 0.00 0.00 54.91 55.14 2o98 h ALA 64 Cb 0.25 0.72 -0.08 0.00 0.00 0.00 0.00 17.79 18.68 2o98 h ALA 64 CO -0.00 -0.81 0.25 0.77 0.00 0.00 0.00 179.25 179.45 2o98 h SER 65 N -0.36 0.25 -0.42 0.00 0.02 -1.13 -0.59 113.55 111.32 2o98 h SER 65 Ca 0.12 0.08 -0.02 0.00 -0.84 0.00 0.00 61.79 61.14 2o98 h SER 65 Cb 0.57 0.06 -0.02 0.00 0.14 0.00 0.00 62.40 63.15 2o98 h SER 65 CO -0.45 0.14 0.20 -0.25 -1.14 0.00 0.00 176.83 175.32 2o98 h TRP 66 N 0.43 0.61 -0.43 3.45 7.01 0.78 -1.51 115.95 126.29 2o98 h TRP 66 Ca 0.33 -0.03 -0.14 0.00 2.11 0.00 0.00 58.89 61.16 2o98 h TRP 66 Cb 0.42 -0.19 -0.01 0.00 -2.10 0.00 0.00 29.16 27.28 2o98 h TRP 66 CO -0.17 0.50 -0.27 0.00 -2.79 0.00 0.00 178.44 175.72 2o98 h ARG 67 N 0.54 0.94 0.21 2.65 3.08 -0.27 -0.47 114.38 121.06 2o98 h ARG 67 Ca 0.14 -0.44 0.01 0.00 0.07 0.00 0.00 59.98 59.77 2o98 h ARG 67 Cb 0.12 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.14 2o98 h ARG 67 CO -0.02 1.10 -0.25 0.82 -1.07 0.00 0.00 179.97 180.55 2o98 h ILE 68 N 0.77 0.46 -0.39 2.04 1.08 -0.91 -1.36 117.51 119.20 2o98 h ILE 68 Ca 0.09 0.00 0.06 0.00 -0.39 0.00 0.00 64.86 64.61 2o98 h ILE 68 Cb 0.85 0.46 -0.05 0.00 -3.07 0.00 0.00 36.82 35.01 2o98 h ILE 68 CO 0.07 0.00 0.10 0.40 -0.69 0.00 0.00 178.15 178.03 2o98 h ILE 69 N -0.51 0.83 -0.37 -0.67 1.08 -1.23 -1.85 117.51 114.79 2o98 h ILE 69 Ca 0.00 -0.08 0.07 0.00 -0.39 0.00 0.00 64.86 64.46 2o98 h ILE 69 Cb 0.49 0.58 -0.06 0.00 -3.07 0.00 0.00 36.82 34.76 2o98 h ILE 69 CO -0.08 0.04 -0.01 0.28 -0.69 0.00 0.00 178.15 177.69 2o98 h SER 70 N 0.23 -0.17 -0.93 1.72 0.02 -0.94 0.66 113.55 114.14 2o98 h SER 70 Ca 0.18 0.09 0.15 0.00 -0.84 0.00 0.00 61.79 61.37 2o98 h SER 70 Cb 0.20 0.16 -0.09 0.00 0.14 0.00 0.00 62.40 62.81 2o98 h SER 70 CO -0.22 -0.05 0.54 0.28 -1.14 0.00 0.00 176.83 176.24 2o98 h SER 71 N 0.09 0.72 -0.40 3.07 0.02 -0.87 -1.23 113.55 114.94 2o98 h SER 71 Ca 0.18 0.08 -0.14 0.00 -0.84 0.00 0.00 61.79 61.06 2o98 h SER 71 Cb 0.25 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 62.73 2o98 h SER 71 CO -0.31 0.32 -0.31 0.40 -1.14 0.00 0.00 176.83 175.80 2o98 h ILE 72 N 0.77 1.27 -0.90 3.27 2.04 -0.51 -2.39 117.51 121.08 2o98 h ILE 72 Ca 0.50 -1.47 0.05 0.00 1.00 0.00 0.00 64.86 64.94 2o98 h ILE 72 Cb 0.65 1.32 -0.06 0.00 -0.74 0.00 0.00 36.82 38.00 2o98 h ILE 72 CO -0.33 0.49 0.57 -0.08 0.00 0.00 0.00 178.15 178.80 2o98 h GLU 73 N 0.74 1.03 -0.02 2.37 4.81 0.19 -0.13 114.58 123.57 2o98 h GLU 73 Ca 0.08 -0.06 -0.17 0.00 -0.13 0.00 0.00 59.36 59.08 2o98 h GLU 73 Cb 0.89 -0.23 -0.02 0.00 0.63 0.00 0.00 28.75 30.02 2o98 h GLU 73 CO 0.08 0.68 -0.75 1.96 -0.73 0.00 0.00 179.01 180.25 2o98 h GLN 74 N 1.07 0.14 -0.17 1.92 4.20 -1.17 0.26 115.11 121.35 2o98 h GLN 74 Ca 0.38 -0.13 -0.13 0.00 0.06 0.00 0.00 58.65 58.84 2o98 h GLN 74 Cb 0.11 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.91 2o98 h GLN 74 CO -0.15 0.82 -0.43 -0.22 -0.67 0.00 0.00 178.83 178.18 2o98 h LYS 75 N 0.09 0.42 0.21 1.46 3.64 -0.87 -2.63 116.57 118.89 2o98 h LYS 75 Ca -0.02 -0.21 -0.29 0.00 -1.27 0.00 0.00 60.65 58.86 2o98 h LYS 75 Cb 1.32 0.00 0.03 0.00 -0.41 0.00 0.00 32.23 33.18 2o98 h LYS 75 CO 0.11 0.77 -1.25 1.49 -2.27 0.00 0.00 179.45 178.31 2o98 h GLU 76 N 0.34 0.48 -0.41 1.90 4.57 -0.85 -3.22 114.58 117.39 2o98 h GLU 76 Ca 0.03 -0.79 -0.02 0.00 -1.18 0.00 0.00 59.36 57.39 2o98 h GLU 76 Cb 0.90 0.29 -0.02 0.00 -0.16 0.00 0.00 28.75 29.76 2o98 h GLU 76 CO 0.08 1.38 0.15 1.49 -1.18 0.00 0.00 179.01 180.92 2o98 h GLU 77 N -0.00 0.59 -0.40 1.92 4.81 -0.51 0.52 114.58 121.50 2o98 h GLU 77 Ca -0.21 -0.08 0.00 0.00 -0.13 0.00 0.00 59.36 58.94 2o98 h GLU 77 Cb 1.98 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 31.25 2o98 h GLU 77 CO 0.23 0.50 0.00 -1.13 -0.73 0.00 0.00 179.01 177.88 2o98 n SER 78 N -4.37 1.09 -0.00 1.04 3.41 -0.99 -3.01 113.62 110.80 2o98 n SER 78 Ca 0.03 -2.06 0.02 0.00 -0.26 0.00 0.00 58.87 56.60 2o98 n SER 78 Cb 0.15 -0.24 -0.02 0.00 -0.26 0.00 0.00 64.21 63.85 2o98 n SER 78 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2o98 n ARG 79 N -0.04 5.32 -0.94 4.33 1.74 0.14 -5.02 116.66 122.20 2o98 n ARG 79 Ca 0.05 -0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.12 2o98 n ARG 79 Cb 0.21 -0.71 0.00 0.00 -1.02 0.00 0.00 32.46 30.95 2o98 n ARG 79 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2o98 n GLY 80 N 1.19 0.43 3.53 -0.13 0.00 -0.99 -4.96 105.19 104.26 2o98 n GLY 80 Ca 0.01 -0.93 -0.43 0.00 0.00 0.00 0.00 46.02 44.67 2o98 n GLY 80 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2o98 s ASN 81 N -2.84 6.92 0.20 1.61 0.01 -1.18 -4.76 114.94 114.90 2o98 s ASN 81 Ca 0.00 -2.64 -0.10 0.00 -0.71 0.00 0.00 52.86 49.41 2o98 s ASN 81 Cb 0.00 -2.51 0.25 0.00 0.41 0.00 0.00 41.25 39.40 2o98 s ASN 81 CO 0.00 -1.01 1.75 -0.33 -1.51 0.00 0.00 177.10 176.00 2o98 h GLU 82 N 7.47 0.40 -0.42 -0.60 5.08 -1.93 -0.75 114.58 123.83 2o98 h GLU 82 Ca 0.39 -0.02 0.08 0.00 -1.00 0.00 0.00 59.36 58.80 2o98 h GLU 82 Cb 0.88 -0.09 -0.07 0.00 0.50 0.00 0.00 28.75 29.96 2o98 h GLU 82 CO 1.37 0.27 -0.01 0.93 -1.00 0.00 0.00 179.01 180.57 2o98 h GLU 83 N 0.42 0.09 -0.07 2.33 5.08 -2.00 -0.22 114.58 120.21 2o98 h GLU 83 Ca 0.29 -0.01 -0.22 0.00 -1.00 0.00 0.00 59.36 58.42 2o98 h GLU 83 Cb 0.33 -0.02 0.01 0.00 0.50 0.00 0.00 28.75 29.57 2o98 h GLU 83 CO -0.28 0.06 -0.84 0.45 -1.00 0.00 0.00 179.01 177.40 2o98 h HIS 84 N 0.10 0.83 0.00 4.33 3.86 -1.90 -3.04 115.15 119.32 2o98 h HIS 84 Ca 0.21 -0.40 -0.00 0.00 -1.16 0.00 0.00 60.37 59.02 2o98 h HIS 84 Cb 0.31 -0.12 -0.00 0.00 1.06 0.00 0.00 27.41 28.66 2o98 h HIS 84 CO -0.29 1.21 -0.00 0.28 0.86 0.00 0.00 177.93 179.98 2o98 h VAL 85 N 0.38 0.90 0.30 2.45 2.07 -0.39 0.88 116.25 122.84 2o98 h VAL 85 Ca -0.07 -0.02 -0.01 0.00 0.82 0.00 0.00 66.70 67.42 2o98 h VAL 85 Cb 1.46 1.01 0.00 0.00 -1.52 0.00 0.00 31.29 32.24 2o98 h VAL 85 CO 0.16 0.00 -0.14 0.78 0.02 0.00 0.00 177.57 178.39 2o98 h ASN 86 N 0.00 -0.34 -0.83 0.57 -0.26 -0.95 -2.36 115.58 111.41 2o98 h ASN 86 Ca -0.00 -0.20 0.14 0.00 -0.56 0.00 0.00 56.30 55.68 2o98 h ASN 86 Cb 0.01 0.09 -0.09 0.00 -1.06 0.00 0.00 38.32 37.26 2o98 h ASN 86 CO 0.00 0.09 0.41 0.28 -1.06 0.00 0.00 177.43 177.16 2o98 h SER 87 N -0.86 0.49 -0.20 5.81 0.02 -1.37 0.40 113.55 117.83 2o98 h SER 87 Ca -0.04 0.09 -0.12 0.00 -0.84 0.00 0.00 61.79 60.89 2o98 h SER 87 Cb 0.52 0.02 -0.01 0.00 0.14 0.00 0.00 62.40 63.06 2o98 h SER 87 CO 0.07 0.21 -0.27 0.40 -1.14 0.00 0.00 176.83 176.10 2o98 h ILE 88 N 0.60 1.28 -0.12 3.27 2.04 -0.83 -0.71 117.51 123.03 2o98 h ILE 88 Ca 0.45 -1.37 -0.06 0.00 1.00 0.00 0.00 64.86 64.88 2o98 h ILE 88 Cb 0.63 1.30 -0.00 0.00 -0.74 0.00 0.00 36.82 38.01 2o98 h ILE 88 CO -0.36 0.45 -0.16 0.03 0.00 0.00 0.00 178.15 178.11 2o98 h ARG 89 N 0.59 0.32 -0.69 2.37 3.08 -0.83 0.15 114.38 119.38 2o98 h ARG 89 Ca 0.08 -0.18 0.15 0.00 0.07 0.00 0.00 59.98 60.10 2o98 h ARG 89 Cb 0.76 0.01 -0.12 0.00 0.08 0.00 0.00 29.97 30.71 2o98 h ARG 89 CO 0.06 0.75 0.04 1.49 -1.07 0.00 0.00 179.97 181.24 2o98 h GLU 90 N -0.08 0.14 -0.27 0.04 4.57 -0.79 -1.43 114.58 116.76 2o98 h GLU 90 Ca 0.01 -0.01 -0.19 0.00 -1.18 0.00 0.00 59.36 57.99 2o98 h GLU 90 Cb 0.70 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 29.26 2o98 h GLU 90 CO 0.04 0.09 -0.59 -0.92 -1.18 0.00 0.00 179.01 176.45 2o98 h TYR 91 N 0.14 1.10 -0.60 0.92 3.20 -0.88 -2.40 116.97 118.46 2o98 h TYR 91 Ca 0.38 -0.41 0.05 0.00 3.14 0.00 0.00 58.73 61.88 2o98 h TYR 91 Cb 0.64 -0.20 -0.05 0.00 1.54 0.00 0.00 36.73 38.66 2o98 h TYR 91 CO -0.36 1.24 0.33 -0.09 -1.64 0.00 0.00 178.16 177.64 2o98 h ARG 92 N 0.65 0.61 -0.60 1.82 2.43 -0.31 -2.24 114.38 116.74 2o98 h ARG 92 Ca 0.00 -0.04 0.05 0.00 -0.81 0.00 0.00 59.98 59.18 2o98 h ARG 92 Cb 1.20 -0.14 -0.05 0.00 -0.42 0.00 0.00 29.97 30.56 2o98 h ARG 92 CO 0.13 0.41 0.33 1.03 -1.51 0.00 0.00 179.97 180.36 2o98 h SER 93 N 0.63 0.50 -0.59 -3.80 0.87 -1.19 0.24 113.55 110.22 2o98 h SER 93 Ca 0.26 0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.85 2o98 h SER 93 Cb 0.13 -0.08 -0.03 0.00 -0.44 0.00 0.00 62.40 61.98 2o98 h SER 93 CO -0.15 0.34 0.38 0.50 -0.53 0.00 0.00 176.83 177.36 2o98 h LYS 94 N 0.64 0.78 -0.05 2.24 3.64 -0.90 -1.61 116.57 121.30 2o98 h LYS 94 Ca 0.26 -0.05 -0.10 0.00 -1.27 0.00 0.00 60.65 59.49 2o98 h LYS 94 Cb 0.14 -0.17 0.01 0.00 -0.41 0.00 0.00 32.23 31.79 2o98 h LYS 94 CO -0.16 0.53 -0.35 0.82 -2.27 0.00 0.00 179.45 178.02 2o98 h ILE 95 N 0.81 1.44 -1.01 2.00 2.04 -0.84 -3.05 117.51 118.89 2o98 h ILE 95 Ca 0.22 -1.81 0.24 0.00 1.00 0.00 0.00 64.86 64.51 2o98 h ILE 95 Cb -0.07 2.42 -0.12 0.00 -0.74 0.00 0.00 36.82 38.31 2o98 h ILE 95 CO -0.04 0.52 0.61 -0.33 0.00 0.00 0.00 178.15 178.90 2o98 h GLU 96 N -0.19 0.56 -0.05 2.37 5.08 -0.25 0.23 114.58 122.33 2o98 h GLU 96 Ca -0.03 -0.03 0.02 0.00 -1.00 0.00 0.00 59.36 58.31 2o98 h GLU 96 Cb 1.02 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 30.13 2o98 h GLU 96 CO 0.07 0.37 -0.05 -0.91 -1.00 0.00 0.00 179.01 177.49 2o98 h ASN 97 N 0.57 -0.15 -0.80 1.42 2.35 -1.28 -0.67 115.58 117.03 2o98 h ASN 97 Ca 0.63 0.03 -0.00 0.00 -0.55 0.00 0.00 56.30 56.41 2o98 h ASN 97 Cb 1.23 0.08 -0.04 0.00 0.05 0.00 0.00 38.32 39.64 2o98 h ASN 97 CO -0.43 -0.07 0.49 -0.33 -1.65 0.00 0.00 177.43 175.43 2o98 h GLU 98 N -0.07 1.08 -0.53 0.81 5.08 -0.52 -0.91 114.58 119.53 2o98 h GLU 98 Ca 0.04 -0.09 0.01 0.00 -1.00 0.00 0.00 59.36 58.31 2o98 h GLU 98 Cb 0.12 -0.23 -0.03 0.00 0.50 0.00 0.00 28.75 29.11 2o98 h GLU 98 CO -0.09 0.75 0.35 -0.07 -1.00 0.00 0.00 179.01 178.96 2o98 h LEU 99 N 1.09 0.60 -0.12 1.33 3.38 -0.83 -1.76 115.31 119.01 2o98 h LEU 99 Ca 0.29 -0.01 0.04 0.00 0.09 0.00 0.00 57.88 58.28 2o98 h LEU 99 Cb -0.05 -0.15 -0.06 0.00 0.09 0.00 0.00 40.66 40.49 2o98 h LEU 99 CO -0.05 0.43 -0.45 0.28 0.09 0.00 0.00 178.44 178.74 2o98 h SER 100 N 0.71 -1.41 -0.16 -0.43 0.02 0.18 -0.64 113.55 111.82 2o98 h SER 100 Ca 0.19 0.18 -0.08 0.00 -0.84 0.00 0.00 61.79 61.24 2o98 h SER 100 Cb -0.08 0.56 -0.02 0.00 0.14 0.00 0.00 62.40 63.01 2o98 h SER 100 CO -0.05 -0.45 -0.15 0.11 -1.14 0.00 0.00 176.83 175.16 2o98 h LYS 101 N -0.53 0.56 0.14 3.45 1.57 -0.80 -1.32 116.57 119.64 2o98 h LYS 101 Ca 0.06 -0.18 -0.01 0.00 -1.87 0.00 0.00 60.65 58.66 2o98 h LYS 101 Cb 0.65 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.91 2o98 h LYS 101 CO -0.40 0.69 -0.07 0.82 -0.57 0.00 0.00 179.45 179.93 2o98 h ILE 102 N 0.51 1.03 -0.96 1.86 2.04 -1.26 -2.38 117.51 118.35 2o98 h ILE 102 Ca 0.09 -0.91 0.19 0.00 1.00 0.00 0.00 64.86 65.23 2o98 h ILE 102 Cb 0.55 1.57 -0.09 0.00 -0.74 0.00 0.00 36.82 38.12 2o98 h ILE 102 CO 0.04 0.21 0.61 0.00 0.00 0.00 0.00 178.15 179.00 2o98 h ASP 104 N 0.63 0.00 0.05 0.00 5.19 -1.10 0.59 116.42 121.77 2o98 h ASP 104 Ca 0.52 0.00 -0.00 0.00 -0.62 0.00 0.00 57.03 56.93 2o98 h ASP 104 Cb 0.97 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.48 2o98 h ASP 104 CO -0.27 0.58 -0.02 1.23 -3.12 0.00 0.00 179.24 177.64 2o98 h GLY 105 N 3.31 -0.07 1.07 2.75 0.00 -0.79 -2.60 103.07 106.74 2o98 h GLY 105 Ca -0.01 0.02 -0.11 0.00 0.00 0.00 0.00 47.33 47.24 2o98 h GLY 105 CO 0.08 -0.02 -0.10 1.19 0.00 0.00 0.00 176.54 177.68 2o98 h ILE 106 N -0.48 1.27 -0.23 2.60 6.09 -1.52 -2.78 117.51 122.46 2o98 h ILE 106 Ca -0.01 -1.25 -0.05 0.00 -1.37 0.00 0.00 64.86 62.19 2o98 h ILE 106 Cb 0.43 1.02 -0.01 0.00 0.47 0.00 0.00 36.82 38.72 2o98 h ILE 106 CO 0.01 0.44 -0.08 0.25 -3.07 0.00 0.00 178.15 175.70 2o98 h LEU 107 N 0.84 0.34 -0.08 2.19 5.85 -0.90 -0.60 115.31 122.94 2o98 h LEU 107 Ca 0.13 -0.07 -0.17 0.00 0.84 0.00 0.00 57.88 58.61 2o98 h LEU 107 Cb 0.66 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.58 2o98 h LEU 107 CO 0.05 0.46 -0.82 0.07 -0.34 0.00 0.00 178.44 177.86 2o98 h LYS 108 N 0.35 0.00 0.07 1.25 2.10 -1.44 -2.82 116.57 116.08 2o98 h LYS 108 Ca 0.07 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.72 2o98 h LYS 108 Cb 0.36 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.69 2o98 h LYS 108 CO 0.02 0.82 -0.03 1.25 -2.00 0.00 0.00 179.45 179.50 2o98 h LEU 109 N 0.00 -0.08 -0.86 7.07 5.85 -1.10 -0.63 115.31 125.55 2o98 h LEU 109 Ca -0.01 -0.28 0.22 0.00 0.84 0.00 0.00 57.88 58.66 2o98 h LEU 109 Cb 1.59 0.02 -0.14 0.00 0.37 0.00 0.00 40.66 42.51 2o98 h LEU 109 CO 0.11 0.24 0.24 -0.07 -0.34 0.00 0.00 178.44 178.62 2o98 h LEU 110 N -0.41 0.03 0.18 2.25 4.07 -1.18 -0.61 115.31 119.64 2o98 h LEU 110 Ca -0.01 0.19 -0.30 0.00 0.08 0.00 0.00 57.88 57.84 2o98 h LEU 110 Cb 0.36 0.25 0.02 0.00 1.08 0.00 0.00 40.66 42.36 2o98 h LEU 110 CO 0.02 -0.13 -1.36 0.44 -1.08 0.00 0.00 178.44 176.33 2o98 h ASP 111 N 0.23 0.59 0.21 -0.43 3.32 -1.37 0.19 116.42 119.17 2o98 h ASP 111 Ca 0.54 -0.64 -0.33 0.00 0.02 0.00 0.00 57.03 56.61 2o98 h ASP 111 Cb 1.06 -0.19 0.02 0.00 0.22 0.00 0.00 39.33 40.44 2o98 h ASP 111 CO -0.63 1.51 -1.55 0.00 -1.72 0.00 0.00 179.24 176.85 2o98 h ALA 112 N 0.40 0.00 0.00 3.45 0.00 -0.87 -3.41 119.26 118.83 2o98 h ALA 112 Ca -0.19 -0.99 0.00 0.00 0.00 0.00 0.00 54.91 53.73 2o98 h ALA 112 Cb 2.06 0.32 0.00 0.00 0.00 0.00 0.00 17.79 20.17 2o98 h ALA 112 CO 0.23 0.82 -0.15 1.63 0.00 0.00 0.00 179.25 181.79 2o98 n LYS 113 N -3.71 0.08 0.14 0.00 4.76 -0.26 -4.72 118.16 114.44 2o98 n LYS 113 Ca -0.21 0.03 -0.13 0.00 -2.87 0.00 0.00 58.31 55.13 2o98 n LYS 113 Cb 1.06 -0.54 -0.08 0.00 -1.84 0.00 0.00 35.03 33.63 2o98 n LYS 113 CO 0.00 0.00 0.00 -0.07 -1.37 0.00 0.00 177.40 175.96 2o98 h LEU 114 N -0.15 -0.30 0.64 -0.35 3.38 -1.48 -2.16 115.31 114.90 2o98 h LEU 114 Ca 0.00 -0.18 -0.02 0.00 0.09 0.00 0.00 57.88 57.77 2o98 h LEU 114 Cb 0.15 0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 2o98 h LEU 114 CO 0.00 0.03 -0.47 0.40 0.09 0.00 0.00 178.44 178.49 2o98 h ILE 115 N -0.65 0.07 -0.54 1.22 2.04 -0.87 -2.85 117.51 115.93 2o98 h ILE 115 Ca -0.04 0.00 0.09 0.00 1.00 0.00 0.00 64.86 65.91 2o98 h ILE 115 Cb 0.46 0.07 -0.10 0.00 -0.74 0.00 0.00 36.82 36.51 2o98 h ILE 115 CO 0.06 0.00 -0.40 -0.65 0.00 0.00 0.00 178.15 177.16 2o98 h PRO 116 N -1.06 -0.22 0.00 2.37 0.11 -1.74 0.17 132.00 131.62 2o98 h PRO 116 Ca -0.08 0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.05 2o98 h PRO 116 Cb 0.88 0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.04 2o98 h PRO 116 CO 0.03 -0.15 0.00 -1.13 -0.21 0.00 0.00 178.00 176.55 2o98 n SER 117 N -5.42 0.00 -4.64 -2.05 3.41 -0.82 -4.70 113.62 99.41 2o98 n SER 117 Ca 0.02 -0.23 -0.43 0.00 -0.26 0.00 0.00 58.87 57.97 2o98 n SER 117 Cb 0.35 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.28 2o98 n SER 117 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2o98 s ALA 118 N -2.00 3.53 -0.23 7.33 0.00 0.04 -4.47 121.76 125.96 2o98 s ALA 118 Ca 0.11 0.00 0.01 0.00 0.00 0.00 0.00 51.96 52.08 2o98 s ALA 118 Cb 0.05 -3.66 -0.19 0.00 0.00 0.00 0.00 23.12 19.32 2o98 s ALA 118 CO 0.09 -1.41 -0.09 0.00 0.00 0.00 0.00 175.76 174.34 2o98 n ALA 119 N 6.80 1.33 -2.04 0.00 0.00 -1.26 -4.76 120.51 120.58 2o98 n ALA 119 Ca 0.12 -1.01 -0.19 0.00 0.00 0.00 0.00 53.44 52.36 2o98 n ALA 119 Cb 0.47 -0.22 0.05 0.00 0.00 0.00 0.00 19.45 19.74 2o98 n ALA 119 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2o98 s SER 120 N -6.58 5.22 0.02 0.00 1.04 -1.26 -4.96 113.70 107.18 2o98 s SER 120 Ca -0.31 -0.76 -0.20 0.00 0.48 0.00 0.00 55.95 55.16 2o98 s SER 120 Cb 0.08 0.06 -0.11 0.00 0.10 0.00 0.00 66.02 66.16 2o98 s SER 120 CO 0.64 -1.19 1.09 1.23 0.98 0.00 0.00 173.24 175.99 2o98 h GLY 121 N 0.31 -0.74 0.00 7.32 0.00 -1.95 -1.03 103.07 106.98 2o98 h GLY 121 Ca -0.32 0.27 0.00 0.00 0.00 0.00 0.00 47.33 47.28 2o98 h GLY 121 CO 0.42 -0.27 0.00 1.34 0.00 0.00 0.00 176.54 178.03 2o98 n ASP 122 N -4.28 0.00 -0.02 0.19 2.03 -1.26 0.04 116.55 113.25 2o98 n ASP 122 Ca -0.09 0.00 -0.10 0.00 0.52 0.00 0.00 54.79 55.12 2o98 n ASP 122 Cb 0.28 0.00 -0.04 0.00 -0.72 0.00 0.00 41.12 40.64 2o98 n ASP 122 CO 0.00 0.00 0.00 -1.28 -1.92 0.00 0.00 177.20 174.00 2o98 h SER 123 N 0.00 0.08 -0.12 1.67 0.87 -1.95 -1.64 113.55 112.46 2o98 h SER 123 Ca 0.00 0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.56 2o98 h SER 123 Cb 0.00 -0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 61.95 2o98 h SER 123 CO 0.00 0.07 0.04 0.11 -0.53 0.00 0.00 176.83 176.52 2o98 h LYS 124 N 0.14 0.19 -0.97 2.24 1.57 0.26 -2.51 116.57 117.49 2o98 h LYS 124 Ca 0.06 -0.04 0.09 0.00 -1.87 0.00 0.00 60.65 58.89 2o98 h LYS 124 Cb 0.03 -0.03 -0.08 0.00 0.08 0.00 0.00 32.23 32.24 2o98 h LYS 124 CO -0.06 0.33 0.61 0.28 -0.57 0.00 0.00 179.45 180.05 2o98 h VAL 125 N 0.01 0.99 -0.67 0.50 2.07 -0.33 -0.22 116.25 118.61 2o98 h VAL 125 Ca 0.04 -0.36 0.00 0.00 0.82 0.00 0.00 66.70 67.20 2o98 h VAL 125 Cb 0.22 -0.14 -0.03 0.00 -1.52 0.00 0.00 31.29 29.82 2o98 h VAL 125 CO -0.00 0.19 0.42 0.15 0.02 0.00 0.00 177.57 178.35 2o98 h PHE 126 N 1.04 0.86 0.17 1.57 3.04 -0.91 0.17 116.94 122.88 2o98 h PHE 126 Ca 0.45 0.01 -0.27 0.00 3.98 0.00 0.00 57.97 62.14 2o98 h PHE 126 Cb 0.33 -0.29 0.02 0.00 2.56 0.00 0.00 35.95 38.57 2o98 h PHE 126 CO -0.01 0.57 -1.26 1.88 -2.02 0.00 0.00 178.31 177.47 2o98 h TYR 127 N 0.91 0.65 -0.53 0.41 0.05 -1.21 -2.86 116.97 114.38 2o98 h TYR 127 Ca 0.24 -0.47 0.11 0.00 0.05 0.00 0.00 58.73 58.66 2o98 h TYR 127 Cb -0.06 -0.03 -0.10 0.00 1.01 0.00 0.00 36.73 37.56 2o98 h TYR 127 CO -0.02 1.49 -0.08 -0.07 -1.05 0.00 0.00 178.16 178.42 2o98 h LEU 128 N -0.17 -0.39 -0.43 3.88 3.38 -0.93 0.13 115.31 120.78 2o98 h LEU 128 Ca -0.24 0.15 0.09 0.00 0.09 0.00 0.00 57.88 57.97 2o98 h LEU 128 Cb 1.86 0.29 -0.08 0.00 0.09 0.00 0.00 40.66 42.82 2o98 h LEU 128 CO 0.16 -0.14 -0.09 0.50 0.09 0.00 0.00 178.44 178.96 2o98 h LYS 129 N 0.04 0.01 -0.41 1.13 3.64 -0.74 -0.81 116.57 119.44 2o98 h LYS 129 Ca 0.26 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.65 2o98 h LYS 129 Cb 0.41 -0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.21 2o98 h LYS 129 CO -0.51 0.01 0.27 0.52 -2.27 0.00 0.00 179.45 177.46 2o98 h MET 130 N 0.01 0.55 -0.17 1.90 2.86 -0.82 0.19 114.93 119.45 2o98 h MET 130 Ca 0.21 -0.04 -0.03 0.00 -2.06 0.00 0.00 59.70 57.78 2o98 h MET 130 Cb 0.32 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 31.85 2o98 h MET 130 CO -0.43 0.37 -0.02 -0.22 1.06 0.00 0.00 176.91 177.67 2o98 h LYS 131 N 0.56 0.31 -0.79 1.72 3.64 0.57 -2.40 116.57 120.18 2o98 h LYS 131 Ca 0.15 -0.11 -0.00 0.00 -1.27 0.00 0.00 60.65 59.42 2o98 h LYS 131 Cb -0.05 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 31.71 2o98 h LYS 131 CO -0.03 0.55 0.48 0.78 -2.27 0.00 0.00 179.45 178.96 2o98 h GLY 132 N 0.03 1.14 0.26 5.01 0.00 -0.91 -2.75 103.07 105.86 2o98 h GLY 132 Ca 0.05 -0.48 0.06 0.00 0.00 0.00 0.00 47.33 46.96 2o98 h GLY 132 CO 0.01 0.46 -0.19 -0.55 0.00 0.00 0.00 176.54 176.27 2o98 h ASP 133 N 1.08 -0.61 1.81 0.19 3.32 -0.59 0.19 116.42 121.81 2o98 h ASP 133 Ca 0.28 0.12 -0.01 0.00 0.02 0.00 0.00 57.03 57.44 2o98 h ASP 133 Cb -0.04 0.30 -0.00 0.00 0.22 0.00 0.00 39.33 39.81 2o98 h ASP 133 CO -0.05 -0.23 -0.19 1.88 -1.72 0.00 0.00 179.24 178.93 2o98 h TYR 134 N -0.19 0.00 -0.12 4.55 -1.99 -1.42 0.41 116.97 118.20 2o98 h TYR 134 Ca 0.13 0.00 -0.12 0.00 2.00 0.00 0.00 58.73 60.75 2o98 h TYR 134 Cb 0.39 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.11 2o98 h TYR 134 CO -0.35 0.07 -0.44 0.45 -0.00 0.00 0.00 178.16 177.89 2o98 h HIS 135 N 0.00 0.34 -0.11 4.88 3.86 -1.17 -3.10 115.15 119.85 2o98 h HIS 135 Ca -0.00 -0.10 -0.17 0.00 -1.16 0.00 0.00 60.37 58.94 2o98 h HIS 135 Cb 1.05 -0.07 -0.01 0.00 1.06 0.00 0.00 27.41 29.44 2o98 h HIS 135 CO 0.00 0.68 -0.64 -0.09 0.86 0.00 0.00 177.93 178.74 2o98 h ARG 136 N 0.23 0.42 -0.60 2.45 2.43 0.15 -1.73 114.38 117.74 2o98 h ARG 136 Ca 0.02 -0.30 -0.08 0.00 -0.81 0.00 0.00 59.98 58.80 2o98 h ARG 136 Cb 0.87 0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 30.45 2o98 h ARG 136 CO 0.07 0.92 0.05 1.88 -1.51 0.00 0.00 179.97 181.38 2o98 h TYR 137 N 0.30 1.07 0.22 2.20 0.99 -1.28 -0.86 116.97 119.62 2o98 h TYR 137 Ca -0.01 -0.16 -0.01 0.00 2.00 0.00 0.00 58.73 60.55 2o98 h TYR 137 Cb 1.19 -0.29 0.00 0.00 1.00 0.00 0.00 36.73 38.63 2o98 h TYR 137 CO 0.04 0.93 -0.11 -0.07 -0.00 0.00 0.00 178.16 178.96 2o98 h LEU 138 N 0.93 -0.25 -2.00 3.88 3.38 -1.43 -2.88 115.31 116.95 2o98 h LEU 138 Ca 0.18 -0.04 0.19 0.00 0.09 0.00 0.00 57.88 58.30 2o98 h LEU 138 Cb 0.48 0.06 -0.03 0.00 0.09 0.00 0.00 40.66 41.26 2o98 h LEU 138 CO 0.02 -0.12 0.49 0.00 0.09 0.00 0.00 178.44 178.91 2o98 h ALA 139 N 0.41 2.62 -0.48 1.53 0.00 -0.92 0.45 119.26 122.88 2o98 h ALA 139 Ca -0.03 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.80 2o98 h ALA 139 Cb 0.27 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 2o98 h ALA 139 CO 0.05 -0.83 0.07 0.93 0.00 0.00 0.00 179.25 179.47 2o98 h GLU 140 N 0.00 0.74 0.00 0.00 5.08 -0.93 -3.35 114.58 116.12 2o98 h GLU 140 Ca 0.32 -0.16 -0.03 0.00 -1.00 0.00 0.00 59.36 58.49 2o98 h GLU 140 Cb 1.29 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.43 2o98 h GLU 140 CO -0.00 0.70 -1.15 1.97 -1.00 0.00 0.00 179.01 179.53 2o98 n PHE 141 N -4.27 0.00 -0.73 4.33 -1.74 -0.56 -5.05 117.46 109.44 2o98 n PHE 141 Ca 0.03 0.00 -0.32 0.00 -0.56 0.00 0.00 57.45 56.60 2o98 n PHE 141 Cb 0.24 -0.10 0.15 0.00 1.52 0.00 0.00 39.48 41.29 2o98 n PHE 141 CO 0.00 0.00 0.00 1.63 -0.56 0.00 0.00 176.76 177.83 2o98 n LYS 142 N -1.94 -0.71 -3.77 3.97 4.76 0.15 -5.04 118.16 115.57 2o98 n LYS 142 Ca -0.03 -0.17 -0.15 0.00 -2.87 0.00 0.00 58.31 55.10 2o98 n LYS 142 Cb 0.43 -1.94 -0.16 0.00 -1.84 0.00 0.00 35.03 31.52 2o98 n LYS 142 CO 0.00 0.00 0.00 -0.08 -1.37 0.00 0.00 177.40 175.95 2o98 s THR 143 N -2.41 -0.06 0.00 -0.18 -1.32 -1.26 -4.71 115.64 105.70 2o98 s THR 143 Ca 0.59 0.21 0.00 0.00 -1.21 0.00 0.00 61.69 61.28 2o98 s THR 143 Cb -0.20 -0.08 0.00 0.00 -1.51 0.00 0.00 72.50 70.71 2o98 s THR 143 CO 0.65 0.09 0.00 0.61 -2.21 0.00 0.00 174.62 173.76 2o98 n GLY 144 N 4.15 2.67 0.26 6.08 0.00 -1.26 -3.82 105.19 113.26 2o98 n GLY 144 Ca -0.27 -0.30 -0.09 0.00 0.00 0.00 0.00 46.02 45.36 2o98 n GLY 144 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2o98 h ALA 145 N -0.34 -0.12 0.00 4.61 0.00 -1.99 0.76 119.26 122.18 2o98 h ALA 145 Ca 0.00 0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 2o98 h ALA 145 Cb 0.00 0.46 -0.00 0.00 0.00 0.00 0.00 17.79 18.25 2o98 h ALA 145 CO 0.00 -0.66 -0.12 0.93 0.00 0.00 0.00 179.25 179.40 2o98 h GLU 146 N -0.24 0.00 0.18 0.00 5.08 -1.97 -2.47 114.58 115.16 2o98 h GLU 146 Ca 0.13 0.00 -0.31 0.00 -1.00 0.00 0.00 59.36 58.18 2o98 h GLU 146 Cb 0.44 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.70 2o98 h GLU 146 CO -0.35 0.12 -1.39 -0.09 -1.00 0.00 0.00 179.01 176.30 2o98 h ARG 147 N 0.00 0.39 0.23 2.33 2.43 -1.49 -2.39 114.38 115.89 2o98 h ARG 147 Ca -0.00 -0.67 0.01 0.00 -0.81 0.00 0.00 59.98 58.51 2o98 h ARG 147 Cb 0.37 0.25 -0.03 0.00 -0.42 0.00 0.00 29.97 30.13 2o98 h ARG 147 CO 0.02 1.31 -0.33 0.87 -1.51 0.00 0.00 179.97 180.33 2o98 h LYS 148 N 0.11 -0.61 -0.06 0.20 1.57 -0.44 0.22 116.57 117.55 2o98 h LYS 148 Ca -0.20 0.04 0.03 0.00 -1.87 0.00 0.00 60.65 58.65 2o98 h LYS 148 Cb 2.07 0.14 -0.06 0.00 0.08 0.00 0.00 32.23 34.46 2o98 h LYS 148 CO 0.23 -0.41 -0.45 1.49 -0.57 0.00 0.00 179.45 179.75 2o98 h GLU 149 N -0.63 -0.54 -0.41 3.15 4.81 -1.55 0.23 114.58 119.64 2o98 h GLU 149 Ca 0.00 0.04 0.08 0.00 -0.13 0.00 0.00 59.36 59.35 2o98 h GLU 149 Cb 0.61 0.12 -0.09 0.00 0.63 0.00 0.00 28.75 30.02 2o98 h GLU 149 CO -0.12 -0.36 -0.31 0.00 -0.73 0.00 0.00 179.01 177.49 2o98 h ALA 150 N -0.05 -0.13 -0.50 2.92 0.00 -1.29 0.33 119.26 120.53 2o98 h ALA 150 Ca 0.05 0.11 0.01 0.00 0.00 0.00 0.00 54.91 55.09 2o98 h ALA 150 Cb 0.66 0.68 -0.03 0.00 0.00 0.00 0.00 17.79 19.10 2o98 h ALA 150 CO -0.36 -0.70 0.32 0.00 0.00 0.00 0.00 179.25 178.51 2o98 h ALA 151 N 0.83 0.64 0.19 0.00 0.00 -0.14 0.13 119.26 120.91 2o98 h ALA 151 Ca 0.18 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.08 2o98 h ALA 151 Cb 0.53 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 18.10 2o98 h ALA 151 CO -0.54 0.06 -0.35 0.93 0.00 0.00 0.00 179.25 179.35 2o98 h GLU 152 N 0.66 -0.60 -0.87 0.00 4.39 0.07 -0.99 114.58 117.23 2o98 h GLU 152 Ca 0.19 0.04 0.10 0.00 0.34 0.00 0.00 59.36 60.03 2o98 h GLU 152 Cb -0.05 0.14 -0.07 0.00 -0.10 0.00 0.00 28.75 28.67 2o98 h GLU 152 CO -0.06 -0.40 0.52 0.77 -1.16 0.00 0.00 179.01 178.68 2o98 h SER 153 N -0.62 0.76 0.03 1.42 0.02 0.15 -0.91 113.55 114.40 2o98 h SER 153 Ca 0.01 0.04 0.01 0.00 -0.84 0.00 0.00 61.79 61.02 2o98 h SER 153 Cb 0.62 -0.11 -0.02 0.00 0.14 0.00 0.00 62.40 63.04 2o98 h SER 153 CO -0.16 0.44 -0.10 0.74 -1.14 0.00 0.00 176.83 176.60 2o98 h THR 154 N 0.87 0.75 -0.50 -2.27 2.02 -0.47 -1.99 112.91 111.32 2o98 h THR 154 Ca 0.42 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.60 2o98 h THR 154 Cb 0.36 0.75 -0.02 0.00 -1.74 0.00 0.00 68.15 67.49 2o98 h THR 154 CO -0.24 0.00 0.32 0.25 0.37 0.00 0.00 175.52 176.22 2o98 h LEU 155 N -0.19 0.59 -0.31 2.58 5.85 0.11 -1.25 115.31 122.69 2o98 h LEU 155 Ca 0.03 -0.04 0.06 0.00 0.84 0.00 0.00 57.88 58.76 2o98 h LEU 155 Cb 0.22 -0.15 -0.05 0.00 0.37 0.00 0.00 40.66 41.05 2o98 h LEU 155 CO -0.08 0.46 -0.01 0.74 -0.34 0.00 0.00 178.44 179.20 2o98 h THR 156 N 0.68 0.76 -0.09 1.05 2.02 -1.15 -0.63 112.91 115.55 2o98 h THR 156 Ca 0.18 -0.03 -0.17 0.00 0.77 0.00 0.00 66.41 67.16 2o98 h THR 156 Cb -0.04 0.68 0.01 0.00 -1.74 0.00 0.00 68.15 67.06 2o98 h THR 156 CO -0.04 0.01 -0.63 0.00 0.37 0.00 0.00 175.52 175.24 2o98 h ALA 157 N 1.27 0.19 -0.16 6.16 0.00 -0.85 -2.63 119.26 123.24 2o98 h ALA 157 Ca 0.15 -0.55 -0.00 0.00 0.00 0.00 0.00 54.91 54.50 2o98 h ALA 157 Cb 0.21 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 2o98 h ALA 157 CO -0.26 0.47 0.09 1.88 0.00 0.00 0.00 179.25 181.43 2o98 h TYR 158 N 0.20 0.22 -0.12 0.00 0.05 -1.23 -2.21 116.97 113.88 2o98 h TYR 158 Ca -0.05 -0.00 -0.00 0.00 0.05 0.00 0.00 58.73 58.72 2o98 h TYR 158 Cb 1.28 -0.07 -0.01 0.00 1.01 0.00 0.00 36.73 38.94 2o98 h TYR 158 CO 0.11 0.21 0.06 -0.22 -1.05 0.00 0.00 178.16 177.27 2o98 h LYS 159 N 0.16 0.17 0.56 4.88 3.64 -1.06 0.67 116.57 125.58 2o98 h LYS 159 Ca 0.06 -0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.40 2o98 h LYS 159 Cb 0.06 -0.04 0.01 0.00 -0.41 0.00 0.00 32.23 31.85 2o98 h LYS 159 CO -0.01 0.13 -0.27 0.00 -2.27 0.00 0.00 179.45 177.03 2o98 h ALA 160 N 1.90 -0.75 -0.91 5.00 0.00 -1.41 -2.74 119.26 120.35 2o98 h ALA 160 Ca 0.04 -0.16 0.24 0.00 0.00 0.00 0.00 54.91 55.03 2o98 h ALA 160 Cb 0.02 0.29 -0.13 0.00 0.00 0.00 0.00 17.79 17.97 2o98 h ALA 160 CO -0.01 -0.70 0.38 0.00 0.00 0.00 0.00 179.25 178.93 2o98 h ALA 161 N -1.20 1.48 -0.32 0.00 0.00 -0.79 -1.37 119.26 117.05 2o98 h ALA 161 Ca -0.08 0.18 -0.11 0.00 0.00 0.00 0.00 54.91 54.91 2o98 h ALA 161 Cb 0.58 0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 2o98 h ALA 161 CO 0.13 -0.42 -0.23 0.37 0.00 0.00 0.00 179.25 179.10 2o98 h GLN 162 N 0.33 0.73 -0.48 0.00 4.15 -0.94 0.90 115.11 119.81 2o98 h GLN 162 Ca 0.59 -0.35 0.01 0.00 0.77 0.00 0.00 58.65 59.67 2o98 h GLN 162 Cb 1.19 -0.00 -0.03 0.00 0.21 0.00 0.00 27.48 28.85 2o98 h GLN 162 CO -0.58 0.97 0.30 0.22 -1.93 0.00 0.00 178.83 177.81 2o98 h ASP 163 N 0.50 0.51 -0.43 -0.69 -0.00 -0.94 0.18 116.42 115.54 2o98 h ASP 163 Ca 0.06 -0.01 -0.03 0.00 -0.00 0.00 0.00 57.03 57.06 2o98 h ASP 163 Cb 0.79 -0.12 -0.02 0.00 -0.00 0.00 0.00 39.33 39.98 2o98 h ASP 163 CO 0.06 0.36 0.15 0.40 -0.00 0.00 0.00 179.24 180.22 2o98 h ILE 164 N 0.61 1.21 -0.77 2.25 2.04 -1.35 -2.20 117.51 119.30 2o98 h ILE 164 Ca 0.18 -0.68 -0.02 0.00 1.00 0.00 0.00 64.86 65.34 2o98 h ILE 164 Cb -0.03 0.84 -0.04 0.00 -0.74 0.00 0.00 36.82 36.86 2o98 h ILE 164 CO -0.06 0.25 0.42 0.00 0.00 0.00 0.00 178.15 178.75 2o98 h ALA 165 N 1.00 0.99 -0.20 1.87 0.00 -0.50 0.24 119.26 122.66 2o98 h ALA 165 Ca 0.14 -0.12 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 2o98 h ALA 165 Cb 0.23 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 2o98 h ALA 165 CO -0.01 0.51 -0.22 1.15 0.00 0.00 0.00 179.25 180.68 2o98 h THR 166 N 1.07 1.24 0.01 0.00 2.02 -0.40 -1.36 112.91 115.50 2o98 h THR 166 Ca 0.27 -1.13 -0.29 0.00 0.77 0.00 0.00 66.41 66.03 2o98 h THR 166 Cb 0.05 1.34 -0.05 0.00 -1.74 0.00 0.00 68.15 67.75 2o98 h THR 166 CO -0.04 0.35 -1.67 0.71 0.37 0.00 0.00 175.52 175.24 2o98 h THR 167 N 0.33 0.90 0.00 3.16 1.35 -1.15 -3.43 112.91 114.06 2o98 h THR 167 Ca 0.05 -2.73 -0.03 0.00 -0.55 0.00 0.00 66.41 63.15 2o98 h THR 167 Cb 0.58 2.46 -0.01 0.00 -1.73 0.00 0.00 68.15 69.45 2o98 h THR 167 CO 0.04 0.54 -1.31 -0.62 -0.25 0.00 0.00 175.52 173.92 2o98 n GLU 168 N -3.10 1.10 -4.05 4.72 1.02 0.81 -5.03 120.64 116.12 2o98 n GLU 168 Ca -0.16 -0.04 -0.33 0.00 -0.02 0.00 0.00 57.16 56.61 2o98 n GLU 168 Cb 1.04 -1.15 -0.06 0.00 -0.02 0.00 0.00 31.44 31.25 2o98 n GLU 168 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2o98 s LEU 169 N -3.74 3.99 0.49 -4.62 1.43 -0.52 -4.93 118.68 110.78 2o98 s LEU 169 Ca -0.02 0.17 -0.24 0.00 -1.03 0.00 0.00 54.13 53.01 2o98 s LEU 169 Cb 0.03 -2.38 -0.07 0.00 0.03 0.00 0.00 46.19 43.80 2o98 s LEU 169 CO 0.25 0.26 1.40 0.00 0.23 0.00 0.00 176.35 178.48 2o98 n ALA 170 N 1.03 1.84 0.31 4.21 0.00 -1.26 -4.72 120.51 121.92 2o98 n ALA 170 Ca -0.12 0.20 0.19 0.00 0.00 0.00 0.00 53.44 53.72 2o98 n ALA 170 Cb 0.52 -2.37 1.04 0.00 0.00 0.00 0.00 19.45 18.64 2o98 n ALA 170 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2o98 h PRO 171 N 1.97 0.00 -0.00 0.00 0.13 -1.90 -0.98 132.00 131.21 2o98 h PRO 171 Ca -0.51 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 2o98 h PRO 171 Cb 1.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.41 2o98 h PRO 171 CO 0.59 0.00 -0.26 0.25 -0.23 0.00 0.00 178.00 178.35 2o98 n THR 172 N -3.37 0.00 -2.00 1.56 -2.24 -1.26 -4.39 114.28 102.58 2o98 n THR 172 Ca -0.02 -0.01 -0.42 0.00 -2.27 0.00 0.00 64.05 61.33 2o98 n THR 172 Cb 0.14 -0.07 -0.03 0.00 -2.10 0.00 0.00 70.33 68.28 2o98 n THR 172 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 2o98 s HIS 173 N -2.92 3.11 0.55 4.78 5.04 -0.37 -4.69 115.29 120.77 2o98 s HIS 173 Ca 0.15 0.74 0.28 0.00 -1.54 0.00 0.00 55.06 54.68 2o98 s HIS 173 Cb 0.18 -3.86 1.68 0.00 0.04 0.00 0.00 32.58 30.63 2o98 s HIS 173 CO 0.60 -3.10 2.20 -1.35 -2.34 0.00 0.00 174.74 170.76 2o98 h PRO 174 N 6.65 0.00 -0.02 2.88 0.11 -1.88 -1.16 132.00 138.57 2o98 h PRO 174 Ca -0.43 0.00 -0.25 0.00 0.11 0.00 0.00 66.00 65.43 2o98 h PRO 174 Cb 1.21 0.00 0.02 0.00 0.11 0.00 0.00 31.00 32.33 2o98 h PRO 174 CO 0.89 0.03 -0.98 0.82 -0.21 0.00 0.00 178.00 178.55 2o98 h ILE 175 N 0.00 1.30 -0.40 4.15 2.04 -1.94 -1.61 117.51 121.05 2o98 h ILE 175 Ca -0.00 -2.24 -0.02 0.00 1.00 0.00 0.00 64.86 63.59 2o98 h ILE 175 Cb 0.08 2.32 -0.02 0.00 -0.74 0.00 0.00 36.82 38.47 2o98 h ILE 175 CO 0.00 0.69 0.16 -0.09 0.00 0.00 0.00 178.15 178.91 2o98 h ARG 176 N 0.38 0.60 -0.46 2.37 2.43 -1.72 -2.29 114.38 115.70 2o98 h ARG 176 Ca -0.11 -0.11 -0.07 0.00 -0.81 0.00 0.00 59.98 58.88 2o98 h ARG 176 Cb 1.63 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 31.06 2o98 h ARG 176 CO 0.19 0.57 0.03 -0.07 -1.51 0.00 0.00 179.97 179.17 2o98 h LEU 177 N 0.50 0.77 -0.67 3.80 -0.00 -1.24 -2.03 115.31 116.44 2o98 h LEU 177 Ca 0.13 -0.29 0.06 0.00 -0.00 0.00 0.00 57.88 57.78 2o98 h LEU 177 Cb 0.19 -0.21 -0.06 0.00 -0.00 0.00 0.00 40.66 40.59 2o98 h LEU 177 CO -0.01 0.87 0.37 1.23 -0.00 0.00 0.00 178.44 180.90 2o98 h GLY 178 N 0.64 0.99 0.82 0.83 0.00 -1.24 0.11 103.07 105.22 2o98 h GLY 178 Ca 0.13 -0.25 -0.00 0.00 0.00 0.00 0.00 47.33 47.21 2o98 h GLY 178 CO 0.02 0.14 -0.05 -2.00 0.00 0.00 0.00 176.54 174.65 2o98 h LEU 179 N 0.67 -0.11 -0.71 3.11 6.46 -1.21 -1.53 115.31 121.99 2o98 h LEU 179 Ca 0.31 -0.16 0.13 0.00 -0.12 0.00 0.00 57.88 58.04 2o98 h LEU 179 Cb 0.21 0.03 -0.09 0.00 -0.73 0.00 0.00 40.66 40.08 2o98 h LEU 179 CO -0.20 0.09 0.25 0.00 -0.62 0.00 0.00 178.44 177.97 2o98 h ALA 180 N 0.56 0.95 0.33 1.25 0.00 -0.76 0.27 119.26 121.87 2o98 h ALA 180 Ca -0.01 0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 2o98 h ALA 180 Cb 0.26 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 2o98 h ALA 180 CO 0.02 -0.23 -0.24 1.25 0.00 0.00 0.00 179.25 180.05 2o98 h LEU 181 N 0.40 -0.63 -0.45 0.00 5.85 -0.60 -1.49 115.31 118.39 2o98 h LEU 181 Ca 0.38 0.05 -0.09 0.00 0.84 0.00 0.00 57.88 59.06 2o98 h LEU 181 Cb 0.57 0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.78 2o98 h LEU 181 CO -0.40 -0.37 -0.06 0.78 -0.34 0.00 0.00 178.44 178.05 2o98 h ASN 182 N -0.57 0.83 -0.46 1.25 2.35 -0.20 -1.33 115.58 117.47 2o98 h ASN 182 Ca -0.03 -0.34 0.05 0.00 -0.55 0.00 0.00 56.30 55.44 2o98 h ASN 182 Cb 0.49 -0.23 -0.05 0.00 0.05 0.00 0.00 38.32 38.59 2o98 h ASN 182 CO 0.00 0.98 0.19 0.15 -1.65 0.00 0.00 177.43 177.10 2o98 h PHE 183 N 0.68 0.34 -0.49 1.19 3.04 -0.49 0.44 116.94 121.64 2o98 h PHE 183 Ca 0.12 0.02 -0.07 0.00 3.98 0.00 0.00 57.97 62.02 2o98 h PHE 183 Cb 0.58 -0.09 -0.02 0.00 2.56 0.00 0.00 35.95 38.98 2o98 h PHE 183 CO 0.04 0.15 0.01 0.66 -2.02 0.00 0.00 178.31 177.15 2o98 h SER 184 N 0.38 0.78 -0.49 0.41 4.64 -1.09 -0.98 113.55 117.21 2o98 h SER 184 Ca 0.21 -0.19 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 2o98 h SER 184 Cb 0.17 -0.21 -0.02 0.00 -0.31 0.00 0.00 62.40 62.03 2o98 h SER 184 CO -0.19 0.84 0.31 0.58 -0.87 0.00 0.00 176.83 177.51 2o98 h VAL 185 N 0.76 1.14 -0.29 0.95 2.07 -0.37 -2.11 116.25 118.40 2o98 h VAL 185 Ca 0.15 -0.28 0.07 0.00 0.82 0.00 0.00 66.70 67.46 2o98 h VAL 185 Cb 0.45 0.45 -0.08 0.00 -1.52 0.00 0.00 31.29 30.59 2o98 h VAL 185 CO 0.02 0.13 -0.27 0.15 0.02 0.00 0.00 177.57 177.62 2o98 h PHE 186 N 0.65 -0.73 -0.30 1.57 3.57 0.11 0.61 116.94 122.42 2o98 h PHE 186 Ca 0.18 0.05 -0.03 0.00 3.53 0.00 0.00 57.97 61.69 2o98 h PHE 186 Cb -0.05 0.37 -0.02 0.00 2.79 0.00 0.00 35.95 39.04 2o98 h PHE 186 CO -0.04 -0.35 0.07 1.88 -2.23 0.00 0.00 178.31 177.65 2o98 h TYR 187 N -0.26 0.43 0.12 0.41 0.05 -1.25 0.15 116.97 116.62 2o98 h TYR 187 Ca 0.15 -0.02 -0.01 0.00 0.05 0.00 0.00 58.73 58.90 2o98 h TYR 187 Cb 0.49 -0.13 0.00 0.00 1.01 0.00 0.00 36.73 38.10 2o98 h TYR 187 CO -0.44 0.39 -0.06 -0.92 -1.05 0.00 0.00 178.16 176.08 2o98 h TYR 188 N 0.43 -0.14 0.05 4.88 3.20 -0.38 0.30 116.97 125.32 2o98 h TYR 188 Ca 0.10 -0.00 -0.28 0.00 3.14 0.00 0.00 58.73 61.69 2o98 h TYR 188 Cb 0.17 0.05 -0.03 0.00 1.54 0.00 0.00 36.73 38.46 2o98 h TYR 188 CO 0.01 0.30 -1.47 0.93 -1.64 0.00 0.00 178.16 176.28 2o98 h GLU 189 N -0.93 0.11 0.00 1.82 5.08 0.23 -2.98 114.58 117.92 2o98 h GLU 189 Ca -0.02 -0.18 -0.40 0.00 -1.00 0.00 0.00 59.36 57.76 2o98 h GLU 189 Cb 0.51 0.07 -0.07 0.00 0.50 0.00 0.00 28.75 29.76 2o98 h GLU 189 CO 0.03 0.89 -2.48 -0.89 -1.00 0.00 0.00 179.01 175.56 2o98 n ILE 190 N -3.30 1.50 0.51 3.13 2.08 0.46 -4.46 119.36 119.29 2o98 n ILE 190 Ca -0.13 -0.54 0.12 0.00 0.56 0.00 0.00 62.75 62.76 2o98 n ILE 190 Cb 1.02 -1.51 0.11 0.00 -0.75 0.00 0.00 39.64 38.51 2o98 n ILE 190 CO 0.00 0.00 0.00 0.18 0.56 0.00 0.00 176.55 177.29 2o98 n LEU 191 N -3.44 0.69 -3.51 1.39 4.32 -0.85 -4.98 117.00 110.61 2o98 n LEU 191 Ca -0.47 0.17 -0.22 0.00 -0.02 0.00 0.00 56.01 55.47 2o98 n LEU 191 Cb 0.97 -0.15 0.05 0.00 -1.62 0.00 0.00 43.42 42.68 2o98 n LEU 191 CO 0.22 -0.04 -0.02 -3.20 -1.22 0.00 0.00 177.39 173.13 2o98 n ASN 192 N -2.14 -4.57 -3.63 -1.43 5.15 -0.32 -4.97 115.26 103.35 2o98 n ASN 192 Ca 0.02 -0.83 -0.27 0.00 -0.60 0.00 0.00 54.58 52.90 2o98 n ASN 192 Cb 0.45 -4.32 -0.11 0.00 -0.53 0.00 0.00 39.78 35.27 2o98 n ASN 192 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 2o98 n SER 193 N -3.00 1.36 -0.02 1.20 7.64 0.92 -4.99 113.62 116.73 2o98 n SER 193 Ca -0.15 -2.82 0.11 0.00 1.01 0.00 0.00 58.87 57.02 2o98 n SER 193 Cb 0.63 -0.66 0.53 0.00 -1.01 0.00 0.00 64.21 63.70 2o98 n SER 193 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 2o98 h PRO 194 N 5.40 0.32 -0.22 1.43 0.13 -1.87 -1.84 132.00 135.35 2o98 h PRO 194 Ca 0.20 -0.02 -0.14 0.00 -0.87 0.00 0.00 66.00 65.18 2o98 h PRO 194 Cb 0.82 -0.07 -0.01 0.00 0.13 0.00 0.00 31.00 31.87 2o98 h PRO 194 CO 0.56 0.21 -0.44 -0.44 -0.23 0.00 0.00 178.00 177.66 2o98 h ASP 195 N 0.33 0.59 0.59 1.44 3.45 -1.95 -0.81 116.42 120.06 2o98 h ASP 195 Ca 0.23 -0.27 -0.10 0.00 0.43 0.00 0.00 57.03 57.31 2o98 h ASP 195 Cb 0.46 -0.17 -0.01 0.00 -0.56 0.00 0.00 39.33 39.05 2o98 h ASP 195 CO -0.05 0.95 -0.48 0.03 -1.57 0.00 0.00 179.24 178.11 2o98 h ARG 196 N 0.45 0.00 0.16 3.56 3.08 -1.82 -1.88 114.38 117.93 2o98 h ARG 196 Ca 0.03 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.07 2o98 h ARG 196 Cb 0.94 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.99 2o98 h ARG 196 CO 0.08 0.48 -0.08 0.00 -1.07 0.00 0.00 179.97 179.39 2o98 h ALA 197 N 1.52 -0.21 -0.35 0.04 0.00 -0.99 -2.20 119.26 117.07 2o98 h ALA 197 Ca -0.00 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.67 2o98 h ALA 197 Cb 0.91 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 2o98 h ALA 197 CO 0.06 -0.41 0.08 0.00 0.00 0.00 0.00 179.25 178.98 2o98 h ASN 199 N 0.41 0.36 -0.09 0.00 -0.26 -1.42 0.22 115.58 114.80 2o98 h ASN 199 Ca 0.11 0.03 -0.01 0.00 -0.56 0.00 0.00 56.30 55.87 2o98 h ASN 199 Cb 0.32 -0.03 -0.00 0.00 -1.06 0.00 0.00 38.32 37.54 2o98 h ASN 199 CO 0.00 0.25 0.01 0.25 -1.06 0.00 0.00 177.43 176.88 2o98 h LEU 200 N 0.50 0.15 -0.10 1.61 6.46 -1.25 -2.36 115.31 120.33 2o98 h LEU 200 Ca 0.24 -0.27 -0.01 0.00 -0.12 0.00 0.00 57.88 57.72 2o98 h LEU 200 Cb 0.17 -0.04 -0.00 0.00 -0.73 0.00 0.00 40.66 40.05 2o98 h LEU 200 CO -0.18 0.39 0.04 0.00 -0.62 0.00 0.00 178.44 178.07 2o98 h ALA 201 N 0.77 0.13 -0.92 1.25 0.00 -0.86 -2.21 119.26 117.42 2o98 h ALA 201 Ca 0.03 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 2o98 h ALA 201 Cb 0.30 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.01 2o98 h ALA 201 CO 0.00 -0.28 0.53 -0.22 0.00 0.00 0.00 179.25 179.28 2o98 h LYS 202 N 0.01 1.27 -0.27 0.00 3.64 -0.62 -0.72 116.57 119.88 2o98 h LYS 202 Ca 0.03 -0.13 -0.01 0.00 -1.27 0.00 0.00 60.65 59.27 2o98 h LYS 202 Cb 0.17 -0.26 -0.01 0.00 -0.41 0.00 0.00 32.23 31.72 2o98 h LYS 202 CO -0.00 0.91 0.14 1.96 -2.27 0.00 0.00 179.45 180.19 2o98 h GLN 203 N 1.28 0.39 -0.38 1.90 4.20 -1.24 0.18 115.11 121.43 2o98 h GLN 203 Ca 0.33 -0.05 -0.12 0.00 0.06 0.00 0.00 58.65 58.87 2o98 h GLN 203 Cb -0.01 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 27.68 2o98 h GLN 203 CO -0.06 0.35 -0.23 0.00 -0.67 0.00 0.00 178.83 178.22 2o98 h ALA 204 N 1.02 0.87 0.45 3.87 0.00 -0.94 -0.40 119.26 124.13 2o98 h ALA 204 Ca 0.10 -0.37 -0.02 0.00 0.00 0.00 0.00 54.91 54.61 2o98 h ALA 204 Cb 0.08 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.73 2o98 h ALA 204 CO -0.01 0.63 -0.22 0.35 0.00 0.00 0.00 179.25 180.00 2o98 h PHE 205 N 0.67 -0.56 -0.35 0.00 3.57 -0.94 -2.81 116.94 116.52 2o98 h PHE 205 Ca 0.09 -0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.54 2o98 h PHE 205 Cb 0.74 0.18 -0.02 0.00 2.79 0.00 0.00 35.95 39.65 2o98 h PHE 205 CO 0.04 -0.33 0.04 -0.44 -2.23 0.00 0.00 178.31 175.39 2o98 h ASP 206 N -0.63 0.49 0.00 0.41 3.32 -0.18 -1.19 116.42 118.65 2o98 h ASP 206 Ca -0.06 -0.08 -0.09 0.00 0.02 0.00 0.00 57.03 56.82 2o98 h ASP 206 Cb 0.48 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.89 2o98 h ASP 206 CO 0.10 0.53 -0.27 -0.33 -1.72 0.00 0.00 179.24 177.55 2o98 h GLU 207 N 0.51 0.42 -0.39 3.56 5.08 -1.11 0.40 114.58 123.05 2o98 h GLU 207 Ca 0.12 -0.16 -0.04 0.00 -1.00 0.00 0.00 59.36 58.27 2o98 h GLU 207 Cb 0.27 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.48 2o98 h GLU 207 CO 0.00 0.66 0.07 0.00 -1.00 0.00 0.00 179.01 178.75 2o98 h ALA 208 N 1.34 0.51 -0.58 3.43 0.00 -0.97 -2.65 119.26 120.35 2o98 h ALA 208 Ca 0.05 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 54.71 2o98 h ALA 208 Cb 0.68 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 2o98 h ALA 208 CO 0.05 0.21 0.16 0.82 0.00 0.00 0.00 179.25 180.49 2o98 h ILE 209 N 0.48 1.24 0.00 0.00 1.08 -1.21 -2.33 117.51 116.78 2o98 h ILE 209 Ca 0.12 -0.85 0.00 0.00 -0.39 0.00 0.00 64.86 63.74 2o98 h ILE 209 Cb 0.35 0.70 0.00 0.00 -3.07 0.00 0.00 36.82 34.79 2o98 h ILE 209 CO 0.01 0.32 0.00 0.00 -0.69 0.00 0.00 178.15 177.78 2o98 h ALA 210 N 1.04 1.00 -0.71 1.87 0.00 -0.71 -3.12 119.26 118.63 2o98 h ALA 210 Ca 0.18 0.00 -0.47 0.00 0.00 0.00 0.00 54.91 54.62 2o98 h ALA 210 Cb 0.31 0.00 -0.42 0.00 0.00 0.00 0.00 17.79 17.68 2o98 h ALA 210 CO -0.00 0.00 -0.90 0.39 0.00 0.00 0.00 179.25 178.74 2o98 n GLU 211 N -2.84 3.08 0.29 0.00 1.02 -0.89 -4.82 120.64 116.49 2o98 n GLU 211 Ca -0.02 -4.00 0.19 0.00 -0.02 0.00 0.00 57.16 53.30 2o98 n GLU 211 Cb 0.07 -2.09 0.97 0.00 -0.02 0.00 0.00 31.44 30.38 2o98 n GLU 211 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 2o98 h LEU 212 N 2.32 0.00 -2.00 -4.62 -0.00 -1.47 0.18 115.31 109.73 2o98 h LEU 212 Ca 0.23 0.00 0.23 0.00 -0.00 0.00 0.00 57.88 58.34 2o98 h LEU 212 Cb 1.43 0.00 -0.03 0.00 -0.00 0.00 0.00 40.66 42.06 2o98 h LEU 212 CO 0.61 0.00 0.57 -0.78 -0.00 0.00 0.00 178.44 178.85 2o98 h ASP 213 N 0.00 0.00 -0.62 -0.43 3.58 -1.90 -2.90 116.42 114.15 2o98 h ASP 213 Ca 0.03 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.48 2o98 h ASP 213 Cb 0.34 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.39 2o98 h ASP 213 CO -0.00 0.00 0.00 0.35 -2.88 0.00 0.00 179.24 176.71 2o98 n THR 214 N -4.29 1.39 -1.74 2.25 -2.24 0.64 -4.92 114.28 105.37 2o98 n THR 214 Ca 0.16 -1.12 -0.38 0.00 -2.27 0.00 0.00 64.05 60.44 2o98 n THR 214 Cb 0.87 0.32 0.05 0.00 -2.10 0.00 0.00 70.33 69.47 2o98 n THR 214 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2o98 s LEU 215 N -1.41 3.74 0.03 3.22 1.43 -1.10 -4.85 118.68 119.73 2o98 s LEU 215 Ca 0.45 2.74 0.07 0.00 -1.03 0.00 0.00 54.13 56.36 2o98 s LEU 215 Cb 0.27 -4.40 -0.02 0.00 0.03 0.00 0.00 46.19 42.06 2o98 s LEU 215 CO 0.26 -1.77 -0.19 -0.83 0.23 0.00 0.00 176.35 174.05 2o98 s GLY 216 N -1.09 1.02 0.16 -3.19 0.00 -1.26 -4.95 107.32 98.01 2o98 s GLY 216 Ca 0.76 -0.96 -0.06 0.00 0.00 0.00 0.00 44.72 44.46 2o98 s GLY 216 CO 0.45 -0.87 0.95 1.18 0.00 0.00 0.00 173.10 174.81 2o98 n GLU 217 N 2.07 -0.07 -0.07 2.90 1.02 -1.26 -0.26 120.64 124.96 2o98 n GLU 217 Ca -0.17 0.95 -0.15 0.00 -0.02 0.00 0.00 57.16 57.77 2o98 n GLU 217 Cb 0.54 -1.41 -0.14 0.00 -0.02 0.00 0.00 31.44 30.40 2o98 n GLU 217 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2o98 n GLU 218 N -4.97 0.68 0.14 3.49 1.02 -1.26 -4.48 120.64 115.26 2o98 n GLU 218 Ca 0.09 0.16 0.17 0.00 -0.02 0.00 0.00 57.16 57.56 2o98 n GLU 218 Cb 0.29 -1.61 0.75 0.00 -0.02 0.00 0.00 31.44 30.85 2o98 n GLU 218 CO 0.00 0.00 0.00 0.77 1.18 0.00 0.00 177.13 179.08 2o98 h SER 219 N 0.02 0.00 0.14 1.62 0.02 -1.16 -3.35 113.55 110.84 2o98 h SER 219 Ca -0.48 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 60.39 2o98 h SER 219 Cb 2.05 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 64.57 2o98 h SER 219 CO 0.01 0.00 -0.26 0.10 -1.14 0.00 0.00 176.83 175.54 2o98 h TYR 220 N 0.00 0.23 -0.08 3.45 -0.00 -0.86 -2.26 116.97 117.45 2o98 h TYR 220 Ca 0.13 -0.04 -0.24 0.00 0.00 0.00 0.00 58.73 58.58 2o98 h TYR 220 Cb 0.61 -0.06 0.02 0.00 0.00 0.00 0.00 36.73 37.29 2o98 h TYR 220 CO 0.00 0.46 -0.91 0.87 -0.00 0.00 0.00 178.16 178.58 2o98 h LYS 221 N 0.19 0.75 -0.50 0.10 1.57 -1.86 -1.19 116.57 115.63 2o98 h LYS 221 Ca 0.03 -0.70 -0.08 0.00 -1.87 0.00 0.00 60.65 58.03 2o98 h LYS 221 Cb 0.57 0.17 -0.02 0.00 0.08 0.00 0.00 32.23 33.04 2o98 h LYS 221 CO 0.04 1.29 0.01 -0.44 -0.57 0.00 0.00 179.45 179.77 2o98 h ASP 222 N 0.47 0.87 0.04 0.86 3.32 -1.74 -1.59 116.42 118.64 2o98 h ASP 222 Ca -0.09 -0.30 -0.27 0.00 0.02 0.00 0.00 57.03 56.39 2o98 h ASP 222 Cb 1.55 -0.23 0.02 0.00 0.22 0.00 0.00 39.33 40.89 2o98 h ASP 222 CO 0.18 0.96 -1.07 0.77 -1.72 0.00 0.00 179.24 178.36 2o98 h SER 223 N 0.75 0.89 -0.95 6.45 4.64 -1.45 -2.42 113.55 121.46 2o98 h SER 223 Ca 0.14 -0.73 0.10 0.00 -0.47 0.00 0.00 61.79 60.83 2o98 h SER 223 Cb 0.51 -0.27 -0.08 0.00 -0.31 0.00 0.00 62.40 62.25 2o98 h SER 223 CO 0.02 1.53 0.59 0.74 -0.87 0.00 0.00 176.83 178.85 2o98 h THR 224 N 0.37 0.96 -0.29 2.95 2.02 -1.21 -1.03 112.91 116.68 2o98 h THR 224 Ca -0.14 -0.34 -0.02 0.00 0.77 0.00 0.00 66.41 66.68 2o98 h THR 224 Cb 1.73 -0.10 -0.01 0.00 -1.74 0.00 0.00 68.15 68.02 2o98 h THR 224 CO 0.21 0.18 0.08 0.25 0.37 0.00 0.00 175.52 176.61 2o98 h LEU 225 N 0.98 0.42 -0.55 2.58 6.46 -1.12 -2.84 115.31 121.25 2o98 h LEU 225 Ca 0.45 -0.21 -0.08 0.00 -0.12 0.00 0.00 57.88 57.92 2o98 h LEU 225 Cb 0.37 -0.11 -0.02 0.00 -0.73 0.00 0.00 40.66 40.17 2o98 h LEU 225 CO -0.24 0.52 0.03 0.40 -0.62 0.00 0.00 178.44 178.54 2o98 h ILE 226 N 0.30 1.26 -0.39 4.05 2.04 -1.03 -0.66 117.51 123.09 2o98 h ILE 226 Ca 0.09 -1.07 0.08 0.00 1.00 0.00 0.00 64.86 64.96 2o98 h ILE 226 Cb 0.26 0.87 -0.07 0.00 -0.74 0.00 0.00 36.82 37.13 2o98 h ILE 226 CO -0.00 0.38 -0.08 0.24 0.00 0.00 0.00 178.15 178.69 2o98 h MET 227 N 0.83 0.01 0.00 2.37 2.86 -1.20 0.04 114.93 119.84 2o98 h MET 227 Ca 0.16 -0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 57.73 2o98 h MET 227 Cb 0.50 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.14 2o98 h MET 227 CO 0.02 0.01 -0.34 -0.56 1.06 0.00 0.00 176.91 177.10 2o98 h GLN 228 N 0.01 0.00 -0.61 1.72 3.07 -1.22 -2.20 115.11 115.89 2o98 h GLN 228 Ca 0.19 0.00 -0.04 0.00 0.09 0.00 0.00 58.65 58.89 2o98 h GLN 228 Cb 0.28 0.00 -0.03 0.00 0.08 0.00 0.00 27.48 27.81 2o98 h GLN 228 CO -0.39 0.34 0.24 -0.07 0.09 0.00 0.00 178.83 179.04 2o98 h LEU 229 N 0.00 0.84 -0.56 0.06 3.38 0.35 0.29 115.31 119.68 2o98 h LEU 229 Ca -0.00 -0.17 0.03 0.00 0.09 0.00 0.00 57.88 57.82 2o98 h LEU 229 Cb 0.79 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 41.29 2o98 h LEU 229 CO 0.04 0.79 0.33 -0.07 0.09 0.00 0.00 178.44 179.62 2o98 h LEU 230 N 0.84 0.54 -1.46 1.67 3.38 -0.67 -1.00 115.31 118.61 2o98 h LEU 230 Ca 0.20 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.16 2o98 h LEU 230 Cb 0.21 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 2o98 h LEU 230 CO -0.02 0.38 0.20 -0.09 0.09 0.00 0.00 178.44 179.01 2o98 h ARG 231 N 0.66 0.57 0.28 1.13 2.43 -1.19 0.56 114.38 118.82 2o98 h ARG 231 Ca 0.23 -0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 59.32 2o98 h ARG 231 Cb 0.03 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 29.47 2o98 h ARG 231 CO -0.10 0.44 -0.13 -0.44 -1.51 0.00 0.00 179.97 178.23 2o98 h ASP 232 N 0.57 -0.32 -0.32 -3.80 3.32 -0.09 -0.32 116.42 115.46 2o98 h ASP 232 Ca 0.15 -0.17 0.07 0.00 0.02 0.00 0.00 57.03 57.10 2o98 h ASP 232 Cb 0.06 0.08 -0.07 0.00 0.22 0.00 0.00 39.33 39.61 2o98 h ASP 232 CO -0.02 0.00 -0.18 0.78 -1.72 0.00 0.00 179.24 178.10 2o98 h ASN 233 N -0.66 -0.61 -0.55 6.45 2.35 -0.99 -1.01 115.58 120.56 2o98 h ASN 233 Ca -0.04 0.13 0.06 0.00 -0.55 0.00 0.00 56.30 55.91 2o98 h ASN 233 Cb 0.46 0.32 -0.05 0.00 0.05 0.00 0.00 38.32 39.10 2o98 h ASN 233 CO 0.06 -0.22 0.25 -0.07 -1.65 0.00 0.00 177.43 175.80 2o98 h LEU 234 N -0.14 0.32 -0.85 1.61 3.38 -0.83 0.46 115.31 119.26 2o98 h LEU 234 Ca 0.17 0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.18 2o98 h LEU 234 Cb 0.40 -0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.10 2o98 h LEU 234 CO -0.41 0.21 0.51 0.74 0.09 0.00 0.00 178.44 179.58 2o98 h THR 235 N 0.47 1.24 -0.15 0.22 2.02 -0.44 0.12 112.91 116.39 2o98 h THR 235 Ca 0.25 -0.52 -0.21 0.00 0.77 0.00 0.00 66.41 66.70 2o98 h THR 235 Cb 0.22 0.05 0.01 0.00 -1.74 0.00 0.00 68.15 66.69 2o98 h THR 235 CO -0.21 0.25 -0.76 0.25 0.37 0.00 0.00 175.52 175.42 2o98 h LEU 236 N 1.16 0.86 -0.34 2.58 5.85 -0.34 -3.16 115.31 121.93 2o98 h LEU 236 Ca 0.30 -0.56 -0.14 0.00 0.84 0.00 0.00 57.88 58.33 2o98 h LEU 236 Cb -0.04 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 40.73 2o98 h LEU 236 CO -0.06 1.35 -0.32 -0.50 -0.34 0.00 0.00 178.44 178.57 2o98 h TRP 237 N 0.50 0.97 -0.14 1.25 6.55 0.48 -3.27 115.95 122.28 2o98 h TRP 237 Ca -0.04 -0.29 0.00 0.00 0.95 0.00 0.00 58.89 59.51 2o98 h TRP 237 Cb 1.37 -0.21 -0.01 0.00 -0.86 0.00 0.00 29.16 29.46 2o98 h TRP 237 CO 0.08 1.07 0.08 1.15 -1.05 0.00 0.00 178.44 179.77 2o98 h THR 238 N 0.59 1.02 0.00 1.49 2.02 -0.87 -2.57 112.91 114.60 2o98 h THR 238 Ca 0.06 -0.06 0.00 0.00 0.77 0.00 0.00 66.41 67.17 2o98 h THR 238 Cb 0.90 0.83 0.00 0.00 -1.74 0.00 0.00 68.15 68.14 2o98 h THR 238 CO 0.08 0.03 0.00 -1.54 0.37 0.00 0.00 175.52 174.46 2o98 n SER 239 N -5.01 0.55 0.00 4.18 3.41 -1.19 -5.12 113.62 110.44 2o98 n SER 239 Ca -0.04 -0.63 0.00 0.00 -0.26 0.00 0.00 58.87 57.94 2o98 n SER 239 Cb 0.04 -0.16 0.00 0.00 -0.26 0.00 0.00 64.21 63.83 2o98 n SER 239 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35