#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bsm s VAL 17 N 0.00 1.97 -0.00 6.31 1.01 -1.26 -4.27 120.40 124.15 2bsm s VAL 17 Ca 0.00 -0.97 -0.07 0.00 0.00 0.00 0.00 61.98 60.94 2bsm s VAL 17 Cb 0.00 -1.83 -0.05 0.00 0.00 0.00 0.00 36.38 34.50 2bsm s VAL 17 CO 0.00 0.45 0.27 -1.61 0.00 0.00 0.00 175.10 174.21 2bsm s GLU 18 N 1.31 3.60 -0.09 2.72 2.02 -0.47 -4.96 118.70 122.83 2bsm s GLU 18 Ca 0.03 -0.03 0.03 0.00 0.02 0.00 0.00 54.97 55.02 2bsm s GLU 18 Cb -0.14 -3.10 -0.02 0.00 0.10 0.00 0.00 34.13 30.98 2bsm s GLU 18 CO -0.12 0.66 -0.17 0.99 0.02 0.00 0.00 175.26 176.64 2bsm s THR 19 N -1.26 2.72 0.12 3.63 2.01 -1.26 -1.55 115.64 120.06 2bsm s THR 19 Ca 0.26 -0.81 0.07 0.00 0.31 0.00 0.00 61.69 61.52 2bsm s THR 19 Cb -0.13 -2.08 -0.04 0.00 0.01 0.00 0.00 72.50 70.26 2bsm s THR 19 CO 0.15 0.56 -0.17 -0.36 -0.69 0.00 0.00 174.62 174.10 2bsm s PHE 20 N -0.07 1.63 -0.14 4.92 0.40 0.17 -5.00 117.98 119.88 2bsm s PHE 20 Ca -0.04 -0.48 -0.13 0.00 -0.60 0.00 0.00 56.93 55.69 2bsm s PHE 20 Cb -0.14 -0.86 -0.05 0.00 0.51 0.00 0.00 43.02 42.49 2bsm s PHE 20 CO 0.04 0.21 0.28 0.00 0.70 0.00 0.00 175.22 176.45 2bsm s ALA 21 N -1.72 3.65 0.31 5.36 0.00 -1.26 -1.73 121.76 126.36 2bsm s ALA 21 Ca 0.09 -0.46 -0.29 0.00 0.00 0.00 0.00 51.96 51.30 2bsm s ALA 21 Cb -0.07 -2.33 -0.13 0.00 0.00 0.00 0.00 23.12 20.59 2bsm s ALA 21 CO 0.04 0.21 1.27 1.19 0.00 0.00 0.00 175.76 178.48 2bsm n PHE 22 N 3.14 2.08 -1.32 0.00 3.72 -0.81 -4.93 117.46 119.34 2bsm n PHE 22 Ca -0.13 0.55 -0.36 0.00 -0.05 0.00 0.00 57.45 57.45 2bsm n PHE 22 Cb 0.52 -2.40 0.07 0.00 -0.94 0.00 0.00 39.48 36.73 2bsm n PHE 22 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 2bsm n GLN 23 N 0.97 0.40 -0.35 -1.08 6.02 -1.26 -4.70 117.38 117.37 2bsm n GLN 23 Ca 0.07 0.18 0.02 0.00 -0.01 0.00 0.00 57.00 57.26 2bsm n GLN 23 Cb 0.34 -1.94 0.17 0.00 1.02 0.00 0.00 30.24 29.83 2bsm n GLN 23 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2bsm h ALA 24 N -0.25 1.34 -0.48 -1.58 0.00 -1.99 -1.72 119.26 114.58 2bsm h ALA 24 Ca -0.46 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.34 2bsm h ALA 24 Cb 1.35 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.84 2bsm h ALA 24 CO 0.44 0.39 -0.08 0.93 0.00 0.00 0.00 179.25 180.93 2bsm h GLU 25 N 1.11 0.87 -0.32 0.00 3.07 -1.95 -0.99 114.58 116.37 2bsm h GLU 25 Ca 0.42 -0.29 -0.08 0.00 -0.50 0.00 0.00 59.36 58.91 2bsm h GLU 25 Cb 0.19 -0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 28.01 2bsm h GLU 25 CO -0.18 0.92 -0.11 0.82 -1.40 0.00 0.00 179.01 179.07 2bsm h ILE 26 N 0.79 1.28 -0.97 3.13 5.03 -1.66 -0.09 117.51 125.02 2bsm h ILE 26 Ca 0.13 -1.18 0.04 0.00 -0.12 0.00 0.00 64.86 63.73 2bsm h ILE 26 Cb 0.59 1.38 -0.06 0.00 -3.03 0.00 0.00 36.82 35.70 2bsm h ILE 26 CO 0.04 0.38 0.63 0.00 -0.68 0.00 0.00 178.15 178.52 2bsm h ALA 27 N 0.79 1.38 -0.53 1.87 0.00 -1.21 -0.84 119.26 120.71 2bsm h ALA 27 Ca 0.08 -0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.82 2bsm h ALA 27 Cb 0.62 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 2bsm h ALA 27 CO 0.04 0.53 -0.14 1.96 0.00 0.00 0.00 179.25 181.63 2bsm h GLN 28 N 1.22 1.03 -0.88 0.00 4.20 -0.74 -1.87 115.11 118.07 2bsm h GLN 28 Ca 0.39 -0.40 0.04 0.00 0.06 0.00 0.00 58.65 58.74 2bsm h GLN 28 Cb 0.01 -0.06 -0.06 0.00 0.30 0.00 0.00 27.48 27.68 2bsm h GLN 28 CO -0.12 1.09 0.56 1.25 -0.67 0.00 0.00 178.83 180.94 2bsm h LEU 29 N 0.91 0.92 -0.60 1.46 5.85 -0.49 -1.89 115.31 121.47 2bsm h LEU 29 Ca 0.13 0.00 -0.15 0.00 0.84 0.00 0.00 57.88 58.70 2bsm h LEU 29 Cb 0.72 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.54 2bsm h LEU 29 CO 0.06 0.62 -0.53 0.24 -0.34 0.00 0.00 178.44 178.48 2bsm h MET 30 N 1.07 0.46 -0.25 1.25 2.86 -0.76 -1.22 114.93 118.35 2bsm h MET 30 Ca 0.36 -0.28 -0.11 0.00 -2.06 0.00 0.00 59.70 57.61 2bsm h MET 30 Cb 0.06 0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.73 2bsm h MET 30 CO -0.13 0.88 -0.30 0.77 1.06 0.00 0.00 176.91 179.19 2bsm h SER 31 N 0.36 0.51 -0.32 1.22 0.02 -1.21 -2.15 113.55 111.98 2bsm h SER 31 Ca 0.01 -0.19 -0.11 0.00 -0.84 0.00 0.00 61.79 60.66 2bsm h SER 31 Cb 1.05 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 63.45 2bsm h SER 31 CO 0.10 0.78 -0.24 0.25 -1.14 0.00 0.00 176.83 176.58 2bsm h LEU 32 N 0.43 0.76 -0.88 5.07 6.46 -0.92 -1.32 115.31 124.92 2bsm h LEU 32 Ca 0.06 -0.45 -0.08 0.00 -0.12 0.00 0.00 57.88 57.29 2bsm h LEU 32 Cb 0.74 -0.21 -0.02 0.00 -0.73 0.00 0.00 40.66 40.44 2bsm h LEU 32 CO 0.06 1.04 -0.04 0.40 -0.62 0.00 0.00 178.44 179.28 2bsm h ILE 33 N 0.48 1.25 0.02 4.05 2.04 -1.22 -2.55 117.51 121.58 2bsm h ILE 33 Ca 0.06 -1.06 -0.21 0.00 1.00 0.00 0.00 64.86 64.64 2bsm h ILE 33 Cb 0.80 0.94 -0.02 0.00 -0.74 0.00 0.00 36.82 37.80 2bsm h ILE 33 CO 0.06 0.37 -1.00 0.40 0.00 0.00 0.00 178.15 177.98 2bsm h ILE 34 N 0.72 1.66 0.00 -0.67 2.04 -1.23 -3.39 117.51 116.64 2bsm h ILE 34 Ca 0.13 -3.24 0.00 0.00 1.00 0.00 0.00 64.86 62.76 2bsm h ILE 34 Cb 0.50 2.79 0.00 0.00 -0.74 0.00 0.00 36.82 39.37 2bsm h ILE 34 CO 0.03 0.93 -1.46 0.59 0.00 0.00 0.00 178.15 178.23 2bsm n ASN 35 N -3.43 1.89 -4.70 1.72 3.02 -0.51 -4.94 115.26 108.31 2bsm n ASN 35 Ca -0.01 -0.10 -0.42 0.00 -0.03 0.00 0.00 54.58 54.01 2bsm n ASN 35 Cb 0.92 1.51 -0.03 0.00 -0.61 0.00 0.00 39.78 41.58 2bsm n ASN 35 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2bsm s THR 36 N -2.80 3.92 -0.12 3.41 2.01 -0.96 -4.97 115.64 116.13 2bsm s THR 36 Ca -0.04 1.32 -0.29 0.00 0.31 0.00 0.00 61.69 62.99 2bsm s THR 36 Cb 0.08 -3.85 -0.05 0.00 0.01 0.00 0.00 72.50 68.70 2bsm s THR 36 CO 0.53 0.03 1.78 0.12 -0.69 0.00 0.00 174.62 176.39 2bsm s PHE 37 N 1.88 1.77 -0.30 4.92 5.36 -1.26 -4.94 117.98 125.41 2bsm s PHE 37 Ca 0.60 0.23 -0.07 0.00 -0.96 0.00 0.00 56.93 56.72 2bsm s PHE 37 Cb -0.29 -4.01 0.15 0.00 -0.34 0.00 0.00 43.02 38.53 2bsm s PHE 37 CO 0.26 -3.92 0.63 -0.47 -1.46 0.00 0.00 175.22 170.27 2bsm s TYR 38 N 5.10 -1.42 -0.11 10.12 5.04 -1.26 -5.08 117.35 129.74 2bsm s TYR 38 Ca 0.79 2.16 0.15 0.00 -2.44 0.00 0.00 57.07 57.74 2bsm s TYR 38 Cb -0.32 0.74 -0.10 0.00 0.35 0.00 0.00 41.96 42.63 2bsm s TYR 38 CO 0.33 -0.73 0.99 0.77 -1.34 0.00 0.00 175.55 175.57 2bsm h SER 39 N 8.00 0.00 -0.13 4.32 0.02 -2.04 -3.38 113.55 120.34 2bsm h SER 39 Ca -0.19 0.00 -0.56 0.00 -0.84 0.00 0.00 61.79 60.19 2bsm h SER 39 Cb 1.12 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.64 2bsm h SER 39 CO 0.15 0.61 2.68 -3.20 -1.14 0.00 0.00 176.83 175.93 2bsm n ASN 40 N -3.01 7.86 0.27 3.07 4.05 -1.26 -4.67 115.26 121.56 2bsm n ASN 40 Ca -0.07 -2.62 0.15 0.00 0.45 0.00 0.00 54.58 52.49 2bsm n ASN 40 Cb 0.84 -1.50 0.71 0.00 1.23 0.00 0.00 39.78 41.05 2bsm n ASN 40 CO 0.00 0.00 0.00 0.11 -3.05 0.00 0.00 177.26 174.32 2bsm h LYS 41 N 4.46 0.00 0.00 1.20 1.57 -1.96 -3.30 116.57 118.53 2bsm h LYS 41 Ca 0.69 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.47 2bsm h LYS 41 Cb 0.57 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.88 2bsm h LYS 41 CO 1.38 0.10 0.00 1.05 -0.57 0.00 0.00 179.45 181.41 2bsm h GLU 42 N 0.00 0.00 0.00 3.15 4.11 -1.97 -2.69 114.58 117.17 2bsm h GLU 42 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2bsm h GLU 42 Cb 0.45 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.70 2bsm h GLU 42 CO 0.01 0.00 0.00 -0.84 0.07 0.00 0.00 179.01 178.25 2bsm h ILE 43 N 0.00 0.00 -0.96 -1.06 -0.00 -1.98 -2.97 117.51 110.54 2bsm h ILE 43 Ca 0.00 -0.03 0.14 0.00 -0.00 0.00 0.00 64.86 64.96 2bsm h ILE 43 Cb 0.09 0.69 -0.09 0.00 -0.00 0.00 0.00 36.82 37.50 2bsm h ILE 43 CO 0.00 0.00 0.58 2.19 -0.00 0.00 0.00 178.15 180.92 2bsm h PHE 44 N 0.00 1.03 -0.56 0.16 -0.00 -1.75 -2.38 116.94 113.44 2bsm h PHE 44 Ca 0.00 0.03 -0.09 0.00 -0.00 0.00 0.00 57.97 57.91 2bsm h PHE 44 Cb 0.04 -0.32 -0.02 0.00 -0.00 0.00 0.00 35.95 35.65 2bsm h PHE 44 CO 0.00 0.35 -0.00 1.25 -0.00 0.00 0.00 178.31 179.91 2bsm h LEU 45 N 0.86 0.97 -0.31 2.10 5.85 -1.81 -1.86 115.31 121.11 2bsm h LEU 45 Ca 0.50 -0.31 0.01 0.00 0.84 0.00 0.00 57.88 58.92 2bsm h LEU 45 Cb 0.58 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.33 2bsm h LEU 45 CO -0.30 1.04 0.18 -0.09 -0.34 0.00 0.00 178.44 178.93 2bsm h ARG 46 N 0.87 0.36 -0.77 1.25 2.43 -1.65 -1.00 114.38 115.86 2bsm h ARG 46 Ca 0.16 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.29 2bsm h ARG 46 Cb 0.54 -0.08 -0.04 0.00 -0.42 0.00 0.00 29.97 29.97 2bsm h ARG 46 CO 0.03 0.24 0.44 0.93 -1.51 0.00 0.00 179.97 180.09 2bsm h GLU 47 N 0.37 1.06 0.05 0.20 4.39 -1.06 -0.18 114.58 119.41 2bsm h GLU 47 Ca 0.12 -0.11 -0.27 0.00 0.34 0.00 0.00 59.36 59.44 2bsm h GLU 47 Cb -0.00 -0.22 0.02 0.00 -0.10 0.00 0.00 28.75 28.45 2bsm h GLU 47 CO -0.06 0.77 -1.11 -0.07 -1.16 0.00 0.00 179.01 177.38 2bsm h LEU 48 N 1.07 0.84 -0.73 1.33 3.38 -1.12 -1.55 115.31 118.52 2bsm h LEU 48 Ca 0.27 -0.72 -0.02 0.00 0.09 0.00 0.00 57.88 57.51 2bsm h LEU 48 Cb 0.00 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.46 2bsm h LEU 48 CO -0.05 1.52 0.38 0.40 0.09 0.00 0.00 178.44 180.78 2bsm h ILE 49 N 0.32 1.23 -0.47 1.22 2.04 -1.12 -0.98 117.51 119.75 2bsm h ILE 49 Ca -0.15 -0.61 -0.13 0.00 1.00 0.00 0.00 64.86 64.97 2bsm h ILE 49 Cb 1.77 0.29 -0.01 0.00 -0.74 0.00 0.00 36.82 38.13 2bsm h ILE 49 CO 0.21 0.26 -0.22 -1.28 0.00 0.00 0.00 178.15 177.13 2bsm h SER 50 N 1.02 1.00 -0.43 1.72 0.87 -1.01 0.85 113.55 117.57 2bsm h SER 50 Ca 0.26 -0.38 0.04 0.00 -1.23 0.00 0.00 61.79 60.47 2bsm h SER 50 Cb 0.08 -0.28 -0.04 0.00 -0.44 0.00 0.00 62.40 61.72 2bsm h SER 50 CO -0.04 1.17 0.21 0.78 -0.53 0.00 0.00 176.83 178.42 2bsm h ASN 51 N 0.84 0.29 -0.60 6.23 4.21 -1.16 -1.24 115.58 124.15 2bsm h ASN 51 Ca 0.11 0.03 0.03 0.00 1.21 0.00 0.00 56.30 57.68 2bsm h ASN 51 Cb 0.80 -0.03 -0.04 0.00 -1.12 0.00 0.00 38.32 37.93 2bsm h ASN 51 CO 0.07 0.21 0.36 0.28 -1.29 0.00 0.00 177.43 177.06 2bsm h SER 52 N 0.42 0.57 -0.32 5.81 0.02 -0.61 -2.02 113.55 117.42 2bsm h SER 52 Ca 0.19 0.01 0.03 0.00 -0.84 0.00 0.00 61.79 61.17 2bsm h SER 52 Cb 0.10 -0.11 -0.03 0.00 0.14 0.00 0.00 62.40 62.50 2bsm h SER 52 CO -0.14 0.40 0.13 -1.28 -1.14 0.00 0.00 176.83 174.80 2bsm h SER 53 N 0.70 0.17 -0.61 3.07 0.87 -0.43 -0.22 113.55 117.10 2bsm h SER 53 Ca 0.25 0.03 0.09 0.00 -1.23 0.00 0.00 61.79 60.92 2bsm h SER 53 Cb 0.05 -0.00 -0.07 0.00 -0.44 0.00 0.00 62.40 61.94 2bsm h SER 53 CO -0.11 0.14 0.26 0.44 -0.53 0.00 0.00 176.83 177.02 2bsm h ASP 54 N 0.29 0.29 -0.28 6.23 3.32 -0.89 0.99 116.42 126.37 2bsm h ASP 54 Ca 0.14 0.07 -0.07 0.00 0.02 0.00 0.00 57.03 57.18 2bsm h ASP 54 Cb 0.09 0.03 -0.02 0.00 0.22 0.00 0.00 39.33 39.65 2bsm h ASP 54 CO -0.12 0.18 -0.06 0.00 -1.72 0.00 0.00 179.24 177.52 2bsm h ALA 55 N 1.40 1.17 -0.24 3.45 0.00 -0.95 -2.13 119.26 121.95 2bsm h ALA 55 Ca 0.30 -0.27 -0.17 0.00 0.00 0.00 0.00 54.91 54.78 2bsm h ALA 55 Cb 0.33 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 2bsm h ALA 55 CO -0.27 0.53 -0.53 -0.07 0.00 0.00 0.00 179.25 178.91 2bsm h LEU 56 N 0.61 0.79 -1.06 0.00 3.38 -0.53 -1.09 115.31 117.42 2bsm h LEU 56 Ca 0.12 -0.42 -0.01 0.00 0.09 0.00 0.00 57.88 57.66 2bsm h LEU 56 Cb 0.47 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.95 2bsm h LEU 56 CO 0.02 1.17 0.47 0.44 0.09 0.00 0.00 178.44 180.63 2bsm h ASP 57 N 0.55 1.00 -0.30 -0.43 3.32 -0.59 -1.91 116.42 118.06 2bsm h ASP 57 Ca 0.02 -0.07 -0.09 0.00 0.02 0.00 0.00 57.03 56.91 2bsm h ASP 57 Cb 1.10 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 40.39 2bsm h ASP 57 CO 0.11 0.79 -0.15 0.11 -1.72 0.00 0.00 179.24 178.38 2bsm h LYS 58 N 1.14 0.64 -0.27 3.56 1.57 -1.19 0.83 116.57 122.84 2bsm h LYS 58 Ca 0.29 -0.28 -0.14 0.00 -1.87 0.00 0.00 60.65 58.65 2bsm h LYS 58 Cb -0.01 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.28 2bsm h LYS 58 CO -0.05 0.86 -0.43 0.97 -0.57 0.00 0.00 179.45 180.24 2bsm h ILE 59 N 0.39 1.30 -0.07 1.86 6.09 -1.37 -1.93 117.51 123.79 2bsm h ILE 59 Ca 0.07 -1.61 -0.00 0.00 -1.37 0.00 0.00 64.86 61.95 2bsm h ILE 59 Cb 0.67 1.55 -0.00 0.00 0.47 0.00 0.00 36.82 39.51 2bsm h ILE 59 CO 0.04 0.51 0.03 -0.09 -3.07 0.00 0.00 178.15 175.58 2bsm h ARG 60 N 0.53 0.09 -0.96 2.19 2.43 -1.22 -0.21 114.38 117.23 2bsm h ARG 60 Ca 0.04 -0.01 0.09 0.00 -0.81 0.00 0.00 59.98 59.28 2bsm h ARG 60 Cb 0.96 -0.02 -0.07 0.00 -0.42 0.00 0.00 29.97 30.42 2bsm h ARG 60 CO 0.09 0.15 0.62 -0.92 -1.51 0.00 0.00 179.97 178.40 2bsm h TYR 61 N 0.01 1.11 -0.29 2.20 3.20 -0.75 -2.49 116.97 119.95 2bsm h TYR 61 Ca 0.02 0.03 -0.05 0.00 3.14 0.00 0.00 58.73 61.87 2bsm h TYR 61 Cb 0.09 -0.36 -0.01 0.00 1.54 0.00 0.00 36.73 37.99 2bsm h TYR 61 CO -0.04 0.53 -0.03 0.93 -1.64 0.00 0.00 178.16 177.91 2bsm h GLU 62 N 1.04 0.54 -0.00 1.82 5.08 -0.98 -2.82 114.58 119.26 2bsm h GLU 62 Ca 0.44 -0.19 0.00 0.00 -1.00 0.00 0.00 59.36 58.61 2bsm h GLU 62 Cb 0.31 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.52 2bsm h GLU 62 CO -0.19 0.71 0.06 0.66 -1.00 0.00 0.00 179.01 179.24 2bsm h SER 63 N 0.32 0.00 -0.66 1.42 4.64 -0.60 -2.64 113.55 116.03 2bsm h SER 63 Ca 0.08 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.40 2bsm h SER 63 Cb 0.48 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.54 2bsm h SER 63 CO 0.02 0.00 0.42 -0.07 -0.87 0.00 0.00 176.83 176.33 2bsm h LEU 64 N 0.00 0.77 0.00 5.97 3.38 -1.22 -3.07 115.31 121.15 2bsm h LEU 64 Ca 0.00 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.94 2bsm h LEU 64 Cb 0.11 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.67 2bsm h LEU 64 CO -0.00 0.58 -1.55 0.35 0.09 0.00 0.00 178.44 177.91 2bsm n THR 65 N -4.42 0.00 -3.53 0.22 -2.24 -1.09 -4.83 114.28 98.40 2bsm n THR 65 Ca 0.07 -0.31 -0.29 0.00 -2.27 0.00 0.00 64.05 61.25 2bsm n THR 65 Cb 0.05 0.25 -0.12 0.00 -2.10 0.00 0.00 70.33 68.41 2bsm n THR 65 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2bsm s ASP 66 N -3.49 3.10 0.60 3.42 2.15 -1.02 -5.01 116.67 116.42 2bsm s ASP 66 Ca -0.04 -2.33 0.36 0.00 0.43 0.00 0.00 52.55 50.97 2bsm s ASP 66 Cb 0.09 -0.56 1.94 0.00 -0.30 0.00 0.00 42.92 44.09 2bsm s ASP 66 CO 0.58 -0.29 2.23 -0.65 -0.17 0.00 0.00 175.17 176.86 2bsm h PRO 67 N 6.89 0.00 0.00 4.34 0.11 -1.81 -2.35 132.00 139.18 2bsm h PRO 67 Ca 0.05 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.16 2bsm h PRO 67 Cb 0.96 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.07 2bsm h PRO 67 CO 0.32 0.03 0.00 -1.13 -0.21 0.00 0.00 178.00 177.01 2bsm n SER 68 N -3.38 0.42 0.31 -2.05 3.41 -1.26 -1.90 113.62 109.17 2bsm n SER 68 Ca -0.02 0.65 0.18 0.00 -0.26 0.00 0.00 58.87 59.43 2bsm n SER 68 Cb 0.14 -0.72 1.04 0.00 -0.26 0.00 0.00 64.21 64.41 2bsm n SER 68 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 2bsm h LYS 69 N 0.00 0.00 -0.65 4.33 1.79 -1.79 -1.57 116.57 118.69 2bsm h LYS 69 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2bsm h LYS 69 Cb 0.14 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.79 2bsm h LYS 69 CO 0.00 0.00 0.00 1.28 -1.08 0.00 0.00 179.45 179.65 2bsm n LEU 70 N -3.52 3.48 -0.10 2.94 4.77 -0.80 -4.33 117.00 119.44 2bsm n LEU 70 Ca -0.03 -1.74 0.02 0.00 -0.03 0.00 0.00 56.01 54.23 2bsm n LEU 70 Cb 0.09 -0.44 0.33 0.00 -2.33 0.00 0.00 43.42 41.08 2bsm n LEU 70 CO 0.24 0.86 1.17 0.44 -1.33 0.00 0.00 177.39 178.77 2bsm h ASP 71 N 3.76 0.66 0.00 -1.43 3.32 -1.45 -1.99 116.42 119.28 2bsm h ASP 71 Ca 0.00 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.02 2bsm h ASP 71 Cb 0.88 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 40.27 2bsm h ASP 71 CO 0.01 0.50 0.00 -1.54 -1.72 0.00 0.00 179.24 176.49 2bsm n SER 72 N -4.43 0.61 0.00 6.45 3.41 -1.26 -4.83 113.62 113.57 2bsm n SER 72 Ca 0.05 -1.52 0.00 0.00 -0.26 0.00 0.00 58.87 57.14 2bsm n SER 72 Cb 0.07 -0.30 0.00 0.00 -0.26 0.00 0.00 64.21 63.72 2bsm n SER 72 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2bsm n GLY 73 N 0.15 3.28 0.12 5.00 0.00 -0.75 -3.77 105.19 109.22 2bsm n GLY 73 Ca 0.00 -0.73 -0.00 0.00 0.00 0.00 0.00 46.02 45.29 2bsm n GLY 73 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2bsm h LYS 74 N 0.00 0.00 -6.50 1.61 1.57 -1.87 -3.44 116.57 107.94 2bsm h LYS 74 Ca 0.00 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 58.25 2bsm h LYS 74 Cb 0.00 0.00 0.02 0.00 0.08 0.00 0.00 32.23 32.33 2bsm h LYS 74 CO 0.00 0.63 0.90 -1.21 -0.57 0.00 0.00 179.45 179.20 2bsm s GLU 75 N -2.89 4.23 -0.32 3.15 2.02 -1.26 -4.99 118.70 118.63 2bsm s GLU 75 Ca 0.03 2.26 0.03 0.00 0.02 0.00 0.00 54.97 57.31 2bsm s GLU 75 Cb 0.08 -3.41 0.09 0.00 0.10 0.00 0.00 34.13 30.99 2bsm s GLU 75 CO 0.77 -0.63 0.02 -0.51 0.02 0.00 0.00 175.26 174.92 2bsm s LEU 76 N 1.95 4.46 0.32 1.80 1.43 -1.26 -4.72 118.68 122.66 2bsm s LEU 76 Ca 0.70 -1.96 -0.14 0.00 -1.03 0.00 0.00 54.13 51.70 2bsm s LEU 76 Cb -0.39 -1.62 0.02 0.00 0.03 0.00 0.00 46.19 44.23 2bsm s LEU 76 CO 0.31 -0.34 0.64 -1.38 0.23 0.00 0.00 176.35 175.81 2bsm s HIS 77 N 0.96 0.24 -0.05 0.29 -3.43 -1.26 -4.36 115.29 107.69 2bsm s HIS 77 Ca 0.06 -0.71 0.01 0.00 -0.80 0.00 0.00 55.06 53.61 2bsm s HIS 77 Cb -0.19 0.50 0.02 0.00 -1.43 0.00 0.00 32.58 31.47 2bsm s HIS 77 CO -0.07 -1.27 -0.04 0.42 -2.00 0.00 0.00 174.74 171.78 2bsm s ILE 78 N -3.29 0.54 0.03 -5.38 1.01 -0.61 -2.51 121.20 110.99 2bsm s ILE 78 Ca 0.18 -0.12 0.06 0.00 0.00 0.00 0.00 60.65 60.78 2bsm s ILE 78 Cb -0.04 -0.57 -0.03 0.00 0.01 0.00 0.00 42.46 41.83 2bsm s ILE 78 CO 0.11 0.23 -0.16 0.20 0.00 0.00 0.00 174.94 175.32 2bsm s ASN 79 N 0.99 3.91 -0.22 3.58 0.02 0.60 -1.32 114.94 122.50 2bsm s ASN 79 Ca -0.10 -0.37 0.01 0.00 -1.02 0.00 0.00 52.86 51.38 2bsm s ASN 79 Cb -0.14 -0.68 0.03 0.00 0.02 0.00 0.00 41.25 40.48 2bsm s ASN 79 CO -0.00 0.26 -0.14 -0.76 0.02 0.00 0.00 177.10 176.48 2bsm s LEU 80 N -1.38 2.80 -0.33 0.60 1.43 0.19 -1.30 118.68 120.69 2bsm s LEU 80 Ca 0.15 -0.94 0.03 0.00 -1.03 0.00 0.00 54.13 52.34 2bsm s LEU 80 Cb -0.11 -1.55 0.10 0.00 0.03 0.00 0.00 46.19 44.66 2bsm s LEU 80 CO 0.05 -0.09 0.04 -0.63 0.23 0.00 0.00 176.35 175.96 2bsm s ILE 81 N 1.24 2.04 0.25 -0.59 1.01 0.14 -1.28 121.20 124.01 2bsm s ILE 81 Ca -0.01 -2.12 -0.23 0.00 0.00 0.00 0.00 60.65 58.29 2bsm s ILE 81 Cb -0.16 -2.48 -0.09 0.00 0.01 0.00 0.00 42.46 39.74 2bsm s ILE 81 CO -0.08 -0.56 0.82 -2.16 0.00 0.00 0.00 174.94 172.96 2bsm s PRO 82 N 1.04 4.44 -0.28 2.79 0.04 -1.26 -0.69 135.00 141.08 2bsm s PRO 82 Ca 0.09 1.10 -0.04 0.00 0.04 0.00 0.00 61.00 62.20 2bsm s PRO 82 Cb -0.19 -2.93 0.10 0.00 0.04 0.00 0.00 34.50 31.52 2bsm s PRO 82 CO -0.10 0.39 0.15 1.21 0.04 0.00 0.00 177.00 178.69 2bsm s ASN 83 N -1.54 3.12 0.34 6.66 3.84 0.32 -4.86 114.94 122.82 2bsm s ASN 83 Ca 0.44 -1.13 0.08 0.00 0.21 0.00 0.00 52.86 52.46 2bsm s ASN 83 Cb -0.19 -0.19 0.61 0.00 -0.55 0.00 0.00 41.25 40.93 2bsm s ASN 83 CO 0.23 -0.42 1.80 0.11 -2.79 0.00 0.00 177.10 176.03 2bsm h LYS 84 N 8.39 0.22 -0.09 0.43 1.57 -1.91 0.14 116.57 125.31 2bsm h LYS 84 Ca -0.19 -0.08 -0.01 0.00 -1.87 0.00 0.00 60.65 58.51 2bsm h LYS 84 Cb 1.03 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 33.32 2bsm h LYS 84 CO 0.41 0.50 0.02 1.96 -0.57 0.00 0.00 179.45 181.77 2bsm h GLN 85 N 0.20 0.14 -0.00 3.15 7.50 -1.96 -2.91 115.11 121.23 2bsm h GLN 85 Ca 0.03 -0.03 0.00 0.00 0.50 0.00 0.00 58.65 59.15 2bsm h GLN 85 Cb 0.62 -0.02 0.00 0.00 0.05 0.00 0.00 27.48 28.13 2bsm h GLN 85 CO 0.04 0.32 -0.12 -0.25 -1.50 0.00 0.00 178.83 177.32 2bsm n ASP 86 N -4.89 0.15 -3.65 1.46 8.00 -1.18 -4.96 116.55 111.46 2bsm n ASP 86 Ca -0.06 0.20 -0.23 0.00 0.71 0.00 0.00 54.79 55.41 2bsm n ASP 86 Cb 0.14 -0.28 0.04 0.00 -0.02 0.00 0.00 41.12 41.00 2bsm n ASP 86 CO 0.00 0.00 0.00 -1.14 -0.39 0.00 0.00 177.20 175.67 2bsm n ARG 87 N -1.44 -3.67 -4.47 -1.24 0.63 0.39 -4.88 116.66 101.98 2bsm n ARG 87 Ca 0.08 0.60 -0.21 0.00 -0.92 0.00 0.00 57.85 57.40 2bsm n ARG 87 Cb 0.33 -4.98 -0.14 0.00 0.45 0.00 0.00 32.46 28.11 2bsm n ARG 87 CO 0.00 0.00 0.00 0.95 -2.51 0.00 0.00 177.63 176.07 2bsm s THR 88 N -3.61 1.21 -0.19 5.15 -4.23 -0.58 -1.75 115.64 111.64 2bsm s THR 88 Ca 0.16 -0.94 -0.03 0.00 -1.18 0.00 0.00 61.69 59.70 2bsm s THR 88 Cb -0.05 -1.07 -0.01 0.00 1.34 0.00 0.00 72.50 72.72 2bsm s THR 88 CO 0.82 0.11 -0.06 -0.22 -0.54 0.00 0.00 174.62 174.72 2bsm s LEU 89 N -0.96 2.90 -0.11 4.79 2.96 -0.79 -0.52 118.68 126.95 2bsm s LEU 89 Ca 0.03 -0.34 -0.00 0.00 -0.22 0.00 0.00 54.13 53.60 2bsm s LEU 89 Cb -0.07 -1.71 -0.02 0.00 0.50 0.00 0.00 46.19 44.88 2bsm s LEU 89 CO 0.01 0.05 -0.10 -0.89 -1.32 0.00 0.00 176.35 174.10 2bsm s THR 90 N 1.05 3.39 -0.22 3.68 2.01 0.14 -0.85 115.64 124.84 2bsm s THR 90 Ca 0.01 -0.56 -0.03 0.00 0.31 0.00 0.00 61.69 61.41 2bsm s THR 90 Cb -0.15 -2.42 0.00 0.00 0.01 0.00 0.00 72.50 69.95 2bsm s THR 90 CO -0.00 0.54 -0.06 -0.63 -0.69 0.00 0.00 174.62 173.78 2bsm s ILE 91 N -0.04 3.16 -0.06 1.82 1.09 -0.38 0.24 121.20 127.03 2bsm s ILE 91 Ca -0.01 -0.65 0.04 0.00 -1.10 0.00 0.00 60.65 58.94 2bsm s ILE 91 Cb -0.14 -2.47 -0.02 0.00 -1.06 0.00 0.00 42.46 38.78 2bsm s ILE 91 CO 0.03 0.38 -0.19 -0.69 -0.10 0.00 0.00 174.94 174.38 2bsm s VAL 92 N 1.43 2.65 0.10 2.92 1.01 -0.42 -0.18 120.40 127.92 2bsm s VAL 92 Ca 0.05 -0.86 0.01 0.00 0.00 0.00 0.00 61.98 61.17 2bsm s VAL 92 Cb -0.15 -2.02 -0.04 0.00 0.00 0.00 0.00 36.38 34.18 2bsm s VAL 92 CO -0.04 0.58 -0.03 1.51 0.00 0.00 0.00 175.10 177.11 2bsm s ASP 93 N -0.43 0.89 -0.55 3.32 1.47 -0.20 -0.29 116.67 120.88 2bsm s ASP 93 Ca 0.05 -1.05 0.01 0.00 1.18 0.00 0.00 52.55 52.73 2bsm s ASP 93 Cb -0.12 0.15 0.46 0.00 -0.34 0.00 0.00 42.92 43.07 2bsm s ASP 93 CO 0.02 -0.55 1.79 0.35 0.68 0.00 0.00 175.17 177.47 2bsm n THR 94 N -0.04 3.31 -0.46 2.11 -2.24 -1.04 -2.21 114.28 113.70 2bsm n THR 94 Ca -0.11 -3.25 0.00 0.00 -2.27 0.00 0.00 64.05 58.42 2bsm n THR 94 Cb 0.62 -1.12 0.00 0.00 -2.10 0.00 0.00 70.33 67.72 2bsm n THR 94 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2bsm n GLY 95 N -0.87 -0.99 0.20 3.38 0.00 -1.26 -4.67 105.19 100.97 2bsm n GLY 95 Ca 0.57 -1.64 0.05 0.00 0.00 0.00 0.00 46.02 45.00 2bsm n GLY 95 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2bsm h ILE 96 N -0.50 1.08 -0.11 -0.61 2.10 -1.54 -3.13 117.51 114.80 2bsm h ILE 96 Ca 0.00 -1.19 0.01 0.00 1.08 0.00 0.00 64.86 64.76 2bsm h ILE 96 Cb 0.00 1.67 -0.00 0.00 -1.09 0.00 0.00 36.82 37.40 2bsm h ILE 96 CO 0.00 0.32 -0.02 0.61 -1.08 0.00 0.00 178.15 177.98 2bsm n GLY 97 N -0.37 -1.37 3.10 8.18 0.00 -1.26 -4.19 105.19 109.26 2bsm n GLY 97 Ca -0.02 -1.52 -0.23 0.00 0.00 0.00 0.00 46.02 44.25 2bsm n GLY 97 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2bsm s MET 98 N -1.16 1.29 0.88 1.61 1.00 -1.26 -4.73 119.30 116.92 2bsm s MET 98 Ca 0.00 -0.50 -0.11 0.00 0.00 0.00 0.00 55.69 55.09 2bsm s MET 98 Cb 0.00 -1.20 0.12 0.00 0.00 0.00 0.00 34.83 33.76 2bsm s MET 98 CO 0.00 0.25 1.10 0.95 0.00 0.00 0.00 175.02 177.32 2bsm s THR 99 N -0.12 2.69 0.28 2.05 -4.23 -1.26 -4.02 115.64 111.04 2bsm s THR 99 Ca 0.01 0.23 0.02 0.00 -1.18 0.00 0.00 61.69 60.77 2bsm s THR 99 Cb -0.08 -2.56 0.28 0.00 1.34 0.00 0.00 72.50 71.48 2bsm s THR 99 CO 0.00 -0.29 1.80 0.50 -0.54 0.00 0.00 174.62 176.09 2bsm h LYS 100 N -1.57 0.82 -0.62 3.99 3.64 -1.98 -1.67 116.57 119.18 2bsm h LYS 100 Ca -0.47 -0.05 -0.09 0.00 -1.27 0.00 0.00 60.65 58.78 2bsm h LYS 100 Cb 1.26 -0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 32.88 2bsm h LYS 100 CO 0.50 0.54 0.05 0.00 -2.27 0.00 0.00 179.45 178.27 2bsm h ALA 101 N 1.57 0.83 -0.48 5.00 0.00 -1.99 -2.26 119.26 121.92 2bsm h ALA 101 Ca 0.51 -0.29 0.01 0.00 0.00 0.00 0.00 54.91 55.14 2bsm h ALA 101 Cb 0.63 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 2bsm h ALA 101 CO -0.32 0.64 0.31 -0.44 0.00 0.00 0.00 179.25 179.44 2bsm h ASP 102 N 0.97 0.53 -0.46 0.00 3.32 -1.68 -0.27 116.42 118.83 2bsm h ASP 102 Ca 0.18 -0.01 0.04 0.00 0.02 0.00 0.00 57.03 57.26 2bsm h ASP 102 Cb 0.50 -0.12 -0.04 0.00 0.22 0.00 0.00 39.33 39.89 2bsm h ASP 102 CO 0.02 0.38 0.23 -0.07 -1.72 0.00 0.00 179.24 178.08 2bsm h LEU 103 N 0.63 0.34 -0.25 1.55 3.38 -1.10 -1.88 115.31 117.97 2bsm h LEU 103 Ca 0.18 0.02 -0.06 0.00 0.09 0.00 0.00 57.88 58.11 2bsm h LEU 103 Cb -0.05 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 2bsm h LEU 103 CO -0.05 0.24 -0.09 0.40 0.09 0.00 0.00 178.44 179.03 2bsm h ILE 104 N 0.46 1.29 0.00 1.22 2.04 -1.24 -2.45 117.51 118.84 2bsm h ILE 104 Ca 0.20 -1.13 -0.55 0.00 1.00 0.00 0.00 64.86 64.37 2bsm h ILE 104 Cb 0.10 1.50 0.02 0.00 -0.74 0.00 0.00 36.82 37.70 2bsm h ILE 104 CO -0.14 0.35 3.22 0.59 0.00 0.00 0.00 178.15 182.17 2bsm n ASN 105 N -4.52 6.51 -3.84 1.72 4.13 -0.13 -4.66 115.26 114.47 2bsm n ASN 105 Ca -0.04 -2.50 -0.26 0.00 1.68 0.00 0.00 54.58 53.46 2bsm n ASN 105 Cb 0.32 -1.35 0.02 0.00 -1.54 0.00 0.00 39.78 37.23 2bsm n ASN 105 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 2bsm n ASN 106 N 4.24 -2.83 -3.88 6.41 3.02 -1.20 -2.51 115.26 118.52 2bsm n ASN 106 Ca 0.61 -0.83 -0.27 0.00 -0.03 0.00 0.00 54.58 54.07 2bsm n ASN 106 Cb 0.21 -3.84 0.01 0.00 -0.61 0.00 0.00 39.78 35.56 2bsm n ASN 106 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2bsm n LEU 107 N -4.48 -2.60 -0.34 3.41 4.32 -0.85 -2.30 117.00 114.17 2bsm n LEU 107 Ca -0.13 -0.87 -0.04 0.00 -0.02 0.00 0.00 56.01 54.95 2bsm n LEU 107 Cb 0.60 -2.48 -0.02 0.00 -1.62 0.00 0.00 43.42 39.91 2bsm n LEU 107 CO 0.73 0.42 -0.04 0.61 -1.22 0.00 0.00 177.39 177.89 2bsm n GLY 108 N -1.69 0.72 3.93 -0.72 0.00 -0.77 -4.94 105.19 101.72 2bsm n GLY 108 Ca -0.15 -0.61 -0.19 0.00 0.00 0.00 0.00 46.02 45.06 2bsm n GLY 108 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2bsm s THR 109 N -2.10 3.01 -0.87 2.61 -4.23 -0.97 -5.03 115.64 108.06 2bsm s THR 109 Ca 0.00 -1.20 -0.00 0.00 -1.18 0.00 0.00 61.69 59.30 2bsm s THR 109 Cb 0.00 -3.06 0.34 0.00 1.34 0.00 0.00 72.50 71.12 2bsm s THR 109 CO 0.00 -0.04 1.76 2.30 -0.54 0.00 0.00 174.62 178.10 2bsm n ILE 110 N -1.63 4.57 0.22 2.99 -5.35 -1.26 -4.70 119.36 114.21 2bsm n ILE 110 Ca 0.04 -5.23 0.06 0.00 -0.27 0.00 0.00 62.75 57.35 2bsm n ILE 110 Cb 0.60 -1.40 0.51 0.00 -1.74 0.00 0.00 39.64 37.62 2bsm n ILE 110 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2bsm h ALA 111 N 3.50 1.52 -0.03 -1.28 0.00 -1.88 -0.66 119.26 120.44 2bsm h ALA 111 Ca 0.49 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 55.20 2bsm h ALA 111 Cb 0.28 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 2bsm h ALA 111 CO 1.21 0.27 -0.01 -0.22 0.00 0.00 0.00 179.25 180.51 2bsm h LYS 112 N 0.00 0.05 -0.01 0.00 3.64 -1.97 -0.12 116.57 118.16 2bsm h LYS 112 Ca -0.00 -0.02 -0.20 0.00 -1.27 0.00 0.00 60.65 59.15 2bsm h LYS 112 Cb 0.41 -0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.23 2bsm h LYS 112 CO 0.03 0.41 -0.87 0.66 -2.27 0.00 0.00 179.45 177.41 2bsm h SER 113 N -0.30 0.40 -0.57 4.20 4.64 -1.95 -2.89 113.55 117.08 2bsm h SER 113 Ca 0.01 -0.31 -0.05 0.00 -0.47 0.00 0.00 61.79 60.96 2bsm h SER 113 Cb 0.39 -0.12 -0.03 0.00 -0.31 0.00 0.00 62.40 62.33 2bsm h SER 113 CO 0.00 1.10 0.17 1.23 -0.87 0.00 0.00 176.83 178.46 2bsm h GLY 114 N 1.50 1.00 1.05 -0.77 0.00 -1.14 -1.80 103.07 102.92 2bsm h GLY 114 Ca -0.06 -0.58 -0.06 0.00 0.00 0.00 0.00 47.33 46.64 2bsm h GLY 114 CO 0.14 0.54 0.23 -0.84 0.00 0.00 0.00 176.54 176.61 2bsm h THR 115 N 0.90 1.26 0.17 4.70 2.02 -1.03 -1.73 112.91 119.20 2bsm h THR 115 Ca 0.20 -0.90 -0.01 0.00 0.77 0.00 0.00 66.41 66.47 2bsm h THR 115 Cb 0.29 0.47 0.00 0.00 -1.74 0.00 0.00 68.15 67.17 2bsm h THR 115 CO -0.00 0.35 -0.08 0.50 0.37 0.00 0.00 175.52 176.66 2bsm h LYS 116 N 1.07 -0.22 -0.21 6.66 3.64 -1.26 -1.45 116.57 124.80 2bsm h LYS 116 Ca 0.23 0.01 0.04 0.00 -1.27 0.00 0.00 60.65 59.67 2bsm h LYS 116 Cb 0.31 0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 32.14 2bsm h LYS 116 CO -0.01 -0.05 -0.05 0.00 -2.27 0.00 0.00 179.45 177.07 2bsm h ALA 117 N 0.47 0.14 -0.99 5.00 0.00 -1.38 -1.94 119.26 120.55 2bsm h ALA 117 Ca -0.02 0.08 0.11 0.00 0.00 0.00 0.00 54.91 55.08 2bsm h ALA 117 Cb 0.27 0.16 -0.08 0.00 0.00 0.00 0.00 17.79 18.14 2bsm h ALA 117 CO 0.04 -0.47 0.62 0.35 0.00 0.00 0.00 179.25 179.79 2bsm h PHE 118 N -0.00 1.14 0.01 0.00 3.57 -1.23 -1.71 116.94 118.71 2bsm h PHE 118 Ca 0.10 0.03 -0.20 0.00 3.53 0.00 0.00 57.97 61.43 2bsm h PHE 118 Cb 0.16 -0.36 -0.01 0.00 2.79 0.00 0.00 35.95 38.52 2bsm h PHE 118 CO -0.23 0.48 -0.90 0.52 -2.23 0.00 0.00 178.31 175.95 2bsm h MET 119 N 1.02 0.18 0.00 1.11 2.86 -0.92 -1.19 114.93 117.99 2bsm h MET 119 Ca 0.48 -0.21 -0.05 0.00 -2.06 0.00 0.00 59.70 57.86 2bsm h MET 119 Cb 0.41 0.06 -0.01 0.00 0.06 0.00 0.00 31.60 32.13 2bsm h MET 119 CO -0.24 0.97 -0.24 0.93 1.06 0.00 0.00 176.91 179.38 2bsm h GLU 120 N 0.10 0.00 -0.01 1.72 5.08 -1.02 -2.54 114.58 117.90 2bsm h GLU 120 Ca -0.05 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.21 2bsm h GLU 120 Cb 1.54 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.80 2bsm h GLU 120 CO 0.14 0.24 -0.41 0.00 -1.00 0.00 0.00 179.01 177.98 2bsm h ALA 121 N 1.76 0.06 -0.25 3.43 0.00 -0.98 -2.89 119.26 120.40 2bsm h ALA 121 Ca -0.00 -0.51 0.07 0.00 0.00 0.00 0.00 54.91 54.47 2bsm h ALA 121 Cb 0.53 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 2bsm h ALA 121 CO 0.03 0.21 0.18 -0.07 0.00 0.00 0.00 179.25 179.60 2bsm h LEU 122 N -0.28 0.01 0.06 0.00 3.38 -1.09 -0.46 115.31 116.92 2bsm h LEU 122 Ca -0.05 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.92 2bsm h LEU 122 Cb 1.13 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.88 2bsm h LEU 122 CO 0.08 0.00 -0.03 1.56 0.09 0.00 0.00 178.44 180.15 2bsm h GLN 123 N 0.01 -0.08 -0.30 1.13 1.08 -1.52 -3.18 115.11 112.26 2bsm h GLN 123 Ca 0.12 0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.32 2bsm h GLN 123 Cb 0.47 0.02 0.00 0.00 -0.05 0.00 0.00 27.48 27.92 2bsm h GLN 123 CO -0.00 0.36 0.00 0.00 -0.95 0.00 0.00 178.83 178.24 2bsm n ALA 124 N -2.38 1.70 0.00 3.87 0.00 -0.24 -4.85 120.51 118.61 2bsm n ALA 124 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.36 2bsm n ALA 124 Cb 0.25 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.70 2bsm n ALA 124 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bsm n GLY 125 N 0.19 2.73 3.38 0.00 0.00 -0.83 -5.02 105.19 105.63 2bsm n GLY 125 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 2bsm n GLY 125 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bsm n ALA 126 N -0.49 -2.89 -2.58 4.61 0.00 -1.04 -4.96 120.51 113.16 2bsm n ALA 126 Ca 0.00 -0.64 -0.26 0.00 0.00 0.00 0.00 53.44 52.53 2bsm n ALA 126 Cb 0.00 -1.74 -0.10 0.00 0.00 0.00 0.00 19.45 17.61 2bsm n ALA 126 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 2bsm s ASP 127 N -1.93 3.40 0.62 0.00 -4.77 -1.26 -4.42 116.67 108.30 2bsm s ASP 127 Ca 0.55 -1.41 0.33 0.00 -3.30 0.00 0.00 52.55 48.73 2bsm s ASP 127 Cb -0.20 -0.19 1.92 0.00 -1.09 0.00 0.00 42.92 43.35 2bsm s ASP 127 CO 0.69 -0.55 2.22 0.40 0.70 0.00 0.00 175.17 178.62 2bsm h ILE 128 N 1.84 0.34 0.00 2.11 2.04 -1.99 -1.60 117.51 120.25 2bsm h ILE 128 Ca -0.43 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.43 2bsm h ILE 128 Cb 1.25 0.93 0.00 0.00 -0.74 0.00 0.00 36.82 38.26 2bsm h ILE 128 CO 0.76 0.00 0.00 0.77 0.00 0.00 0.00 178.15 179.68 2bsm h SER 129 N 0.00 0.00 -0.26 1.72 4.64 -1.97 -2.30 113.55 115.38 2bsm h SER 129 Ca 0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 2bsm h SER 129 Cb 0.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.29 2bsm h SER 129 CO -0.00 0.00 0.00 0.23 -0.87 0.00 0.00 176.83 176.19 2bsm n MET 130 N -2.79 2.19 -0.33 4.77 2.81 -0.60 -4.55 117.12 118.61 2bsm n MET 130 Ca -0.02 -1.78 0.25 0.00 -1.81 0.00 0.00 57.70 54.33 2bsm n MET 130 Cb 0.06 -1.46 0.48 0.00 -0.71 0.00 0.00 33.22 31.59 2bsm n MET 130 CO 0.00 0.00 0.00 0.97 1.51 0.00 0.00 175.97 178.45 2bsm h ILE 131 N 3.62 0.23 0.00 2.02 2.10 -1.60 -0.81 117.51 123.06 2bsm h ILE 131 Ca 0.00 -0.08 -0.03 0.00 1.08 0.00 0.00 64.86 65.83 2bsm h ILE 131 Cb 0.79 -0.03 -0.00 0.00 -1.09 0.00 0.00 36.82 36.49 2bsm h ILE 131 CO 0.00 0.04 -0.14 1.23 -1.08 0.00 0.00 178.15 178.20 2bsm h GLY 132 N 0.23 0.00 2.00 8.18 0.00 -1.86 -2.09 103.07 109.54 2bsm h GLY 132 Ca 0.74 0.00 0.00 0.00 0.00 0.00 0.00 47.33 48.07 2bsm h GLY 132 CO -0.66 0.00 0.00 1.46 0.00 0.00 0.00 176.54 177.34 2bsm h GLN 133 N 0.00 0.00 -0.39 4.80 4.20 -1.49 -2.18 115.11 120.06 2bsm h GLN 133 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2bsm h GLN 133 Cb 0.30 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.08 2bsm h GLN 133 CO 0.02 0.00 0.00 1.19 -0.67 0.00 0.00 178.83 179.37 2bsm n PHE 134 N -2.49 0.52 -0.92 2.96 3.72 -0.79 -5.00 117.46 115.46 2bsm n PHE 134 Ca -0.01 -0.50 0.00 0.00 -0.05 0.00 0.00 57.45 56.89 2bsm n PHE 134 Cb 0.09 -0.02 0.00 0.00 -0.94 0.00 0.00 39.48 38.61 2bsm n PHE 134 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2bsm n GLY 135 N 0.63 0.71 0.97 1.37 0.00 -0.82 -4.43 105.19 103.62 2bsm n GLY 135 Ca 0.13 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.16 2bsm n GLY 135 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2bsm n VAL 136 N -2.56 2.02 0.01 1.61 0.24 -1.24 -4.65 118.33 113.76 2bsm n VAL 136 Ca 0.00 -3.17 0.15 0.00 -2.04 0.00 0.00 64.34 59.27 2bsm n VAL 136 Cb 0.00 -0.23 0.61 0.00 -1.47 0.00 0.00 33.84 32.75 2bsm n VAL 136 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 2bsm h GLY 137 N 1.23 0.23 -0.56 7.63 0.00 -1.84 -2.80 103.07 106.95 2bsm h GLY 137 Ca 0.03 -0.07 0.22 0.00 0.00 0.00 0.00 47.33 47.52 2bsm h GLY 137 CO 0.14 0.04 0.09 -2.75 0.00 0.00 0.00 176.54 174.05 2bsm h PHE 138 N 0.16 0.08 0.00 5.60 3.57 -1.87 -2.02 116.94 122.47 2bsm h PHE 138 Ca 0.22 0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.77 2bsm h PHE 138 Cb 0.64 0.10 0.00 0.00 2.79 0.00 0.00 35.95 39.49 2bsm h PHE 138 CO -0.00 -0.29 0.00 0.66 -2.23 0.00 0.00 178.31 176.45 2bsm n TYR 139 N -5.35 0.03 0.31 0.41 4.01 -1.06 -0.87 117.16 114.64 2bsm n TYR 139 Ca 0.19 0.01 0.16 0.00 -0.16 0.00 0.00 57.90 58.10 2bsm n TYR 139 Cb 0.62 -0.52 0.72 0.00 -0.31 0.00 0.00 39.34 39.86 2bsm n TYR 139 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 2bsm h SER 140 N 0.00 0.00 -1.05 7.72 4.64 -1.55 -2.44 113.55 120.87 2bsm h SER 140 Ca 0.00 0.00 0.28 0.00 -0.47 0.00 0.00 61.79 61.60 2bsm h SER 140 Cb 0.25 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 62.23 2bsm h SER 140 CO 0.00 0.00 0.67 0.00 -0.87 0.00 0.00 176.83 176.63 2bsm h ALA 141 N 2.08 2.19 0.00 5.18 0.00 -1.19 0.20 119.26 127.71 2bsm h ALA 141 Ca 0.00 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2bsm h ALA 141 Cb 0.29 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.12 2bsm h ALA 141 CO 0.00 -0.63 0.00 0.66 0.00 0.00 0.00 179.25 179.28 2bsm n TYR 142 N -4.69 0.00 0.05 0.00 4.01 -0.92 -1.35 117.16 114.26 2bsm n TYR 142 Ca 0.27 0.00 -0.04 0.00 -0.16 0.00 0.00 57.90 57.97 2bsm n TYR 142 Cb 0.90 0.00 0.19 0.00 -0.31 0.00 0.00 39.34 40.12 2bsm n TYR 142 CO 0.00 0.00 0.00 -0.07 -0.46 0.00 0.00 176.86 176.33 2bsm h LEU 143 N 0.00 0.39 0.00 7.72 3.38 -1.16 -3.39 115.31 122.25 2bsm h LEU 143 Ca 0.00 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 57.81 2bsm h LEU 143 Cb 0.00 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.64 2bsm h LEU 143 CO 0.00 0.73 -0.90 1.33 0.09 0.00 0.00 178.44 179.69 2bsm n VAL 144 N -4.05 0.00 -4.41 1.22 0.24 -0.97 -5.02 118.33 105.35 2bsm n VAL 144 Ca -0.01 -0.09 -0.34 0.00 -2.04 0.00 0.00 64.34 61.86 2bsm n VAL 144 Cb 0.47 0.55 -0.11 0.00 -1.47 0.00 0.00 33.84 33.29 2bsm n VAL 144 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2bsm s ALA 145 N -1.93 3.12 0.00 2.33 0.00 -0.46 0.08 121.76 124.90 2bsm s ALA 145 Ca -0.00 -0.82 0.11 0.00 0.00 0.00 0.00 51.96 51.25 2bsm s ALA 145 Cb 0.01 -1.50 -0.21 0.00 0.00 0.00 0.00 23.12 21.42 2bsm s ALA 145 CO 0.04 0.40 0.90 1.05 0.00 0.00 0.00 175.76 178.15 2bsm h GLU 146 N 5.94 0.00 -4.65 0.00 4.11 -1.18 -3.41 114.58 115.40 2bsm h GLU 146 Ca -0.41 0.00 -0.34 0.00 0.07 0.00 0.00 59.36 58.68 2bsm h GLU 146 Cb 1.19 0.00 -0.25 0.00 0.50 0.00 0.00 28.75 30.19 2bsm h GLU 146 CO 0.59 0.64 -0.76 0.21 0.07 0.00 0.00 179.01 179.76 2bsm s LYS 147 N -2.67 0.59 -0.02 1.06 2.20 -1.20 -4.46 119.74 115.24 2bsm s LYS 147 Ca -0.02 -0.53 0.04 0.00 -0.36 0.00 0.00 55.97 55.09 2bsm s LYS 147 Cb 0.09 -0.50 -0.01 0.00 -1.51 0.00 0.00 37.83 35.90 2bsm s LYS 147 CO 0.82 0.12 -0.13 0.08 -0.36 0.00 0.00 175.35 175.88 2bsm s VAL 148 N -0.76 1.10 -0.15 4.02 1.01 -0.49 -1.67 120.40 123.46 2bsm s VAL 148 Ca -0.02 -0.56 0.01 0.00 0.00 0.00 0.00 61.98 61.40 2bsm s VAL 148 Cb -0.06 -0.93 0.02 0.00 0.00 0.00 0.00 36.38 35.40 2bsm s VAL 148 CO 0.00 0.32 -0.16 -0.89 0.00 0.00 0.00 175.10 174.37 2bsm s THR 149 N -0.10 1.71 -0.28 3.92 2.01 -0.78 -1.29 115.64 120.83 2bsm s THR 149 Ca 0.01 -0.72 -0.05 0.00 0.31 0.00 0.00 61.69 61.24 2bsm s THR 149 Cb -0.08 -1.58 0.01 0.00 0.01 0.00 0.00 72.50 70.87 2bsm s THR 149 CO 0.00 0.48 0.04 -0.69 -0.69 0.00 0.00 174.62 173.76 2bsm s VAL 150 N 1.40 3.68 -0.17 3.82 1.01 0.16 -1.09 120.40 129.20 2bsm s VAL 150 Ca 0.04 -0.74 -0.05 0.00 0.00 0.00 0.00 61.98 61.23 2bsm s VAL 150 Cb -0.13 -2.87 -0.03 0.00 0.00 0.00 0.00 36.38 33.35 2bsm s VAL 150 CO -0.11 0.14 0.00 -0.63 0.00 0.00 0.00 175.10 174.51 2bsm s ILE 151 N 1.46 4.20 -0.01 2.22 1.01 0.18 -0.13 121.20 130.13 2bsm s ILE 151 Ca 0.02 -0.24 -0.11 0.00 0.00 0.00 0.00 60.65 60.32 2bsm s ILE 151 Cb -0.17 -2.87 0.01 0.00 0.01 0.00 0.00 42.46 39.44 2bsm s ILE 151 CO 0.00 0.47 0.23 0.28 0.00 0.00 0.00 174.94 175.92 2bsm s THR 152 N 0.49 0.07 -0.09 2.92 -1.32 -0.64 0.20 115.64 117.28 2bsm s THR 152 Ca -0.01 -0.57 -0.03 0.00 -1.21 0.00 0.00 61.69 59.88 2bsm s THR 152 Cb -0.14 -0.52 0.04 0.00 -1.51 0.00 0.00 72.50 70.37 2bsm s THR 152 CO 0.02 -0.31 0.09 -0.75 -2.21 0.00 0.00 174.62 171.46 2bsm s LYS 153 N -1.32 -0.01 0.11 7.08 2.47 0.21 -2.09 119.74 126.18 2bsm s LYS 153 Ca -0.14 0.30 0.04 0.00 -1.56 0.00 0.00 55.97 54.62 2bsm s LYS 153 Cb -0.06 -0.79 -0.04 0.00 -1.46 0.00 0.00 37.83 35.47 2bsm s LYS 153 CO 0.03 -0.42 0.07 -1.58 0.16 0.00 0.00 175.35 173.61 2bsm s HIS 154 N 2.19 3.11 0.41 4.03 5.65 -1.26 -1.88 115.29 127.55 2bsm s HIS 154 Ca 0.04 0.01 0.11 0.00 0.25 0.00 0.00 55.06 55.47 2bsm s HIS 154 Cb -0.13 -1.55 0.93 0.00 -1.18 0.00 0.00 32.58 30.64 2bsm s HIS 154 CO -0.05 0.51 1.99 -0.91 -0.65 0.00 0.00 174.74 175.62 2bsm h ASN 155 N 3.02 0.46 -0.39 9.88 2.35 -1.90 -2.98 115.58 126.02 2bsm h ASN 155 Ca -0.47 0.00 -0.09 0.00 -0.55 0.00 0.00 56.30 55.19 2bsm h ASN 155 Cb 1.18 -0.09 -0.05 0.00 0.05 0.00 0.00 38.32 39.40 2bsm h ASN 155 CO 0.63 0.29 0.11 0.47 -1.65 0.00 0.00 177.43 177.29 2bsm n ASP 156 N -4.48 3.56 -3.59 5.81 8.00 -1.26 -4.94 116.55 119.66 2bsm n ASP 156 Ca 0.09 -2.63 -0.02 0.00 0.71 0.00 0.00 54.79 52.94 2bsm n ASP 156 Cb 0.29 -0.63 0.00 0.00 -0.02 0.00 0.00 41.12 40.76 2bsm n ASP 156 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2bsm s ASP 157 N -0.37 -0.07 0.76 -2.24 -1.08 -1.13 -5.05 116.67 107.49 2bsm s ASP 157 Ca 0.30 -0.44 -0.05 0.00 -0.52 0.00 0.00 52.55 51.84 2bsm s ASP 157 Cb 0.24 0.41 0.12 0.00 -1.46 0.00 0.00 42.92 42.23 2bsm s ASP 157 CO 0.08 -0.78 1.05 -1.61 0.52 0.00 0.00 175.17 174.43 2bsm s GLU 158 N -2.61 1.61 -0.14 4.34 0.41 -1.26 -4.49 118.70 116.56 2bsm s GLU 158 Ca 0.17 -0.77 -0.27 0.00 -0.41 0.00 0.00 54.97 53.69 2bsm s GLU 158 Cb -0.01 -2.20 -0.01 0.00 -1.78 0.00 0.00 34.13 30.13 2bsm s GLU 158 CO 0.02 -1.57 0.92 -1.14 -0.49 0.00 0.00 175.26 173.00 2bsm s GLN 159 N -5.30 4.36 0.22 1.61 0.74 -1.26 -4.57 119.66 115.47 2bsm s GLN 159 Ca 0.66 1.21 0.10 0.00 0.05 0.00 0.00 55.36 57.38 2bsm s GLN 159 Cb -0.06 -3.55 -0.04 0.00 1.10 0.00 0.00 33.01 30.45 2bsm s GLN 159 CO 0.46 -0.31 -0.13 0.71 -0.55 0.00 0.00 175.29 175.46 2bsm s TYR 160 N 2.06 2.49 -0.13 1.67 2.02 -0.89 -0.33 117.35 124.24 2bsm s TYR 160 Ca 0.43 -0.28 0.02 0.00 -0.37 0.00 0.00 57.07 56.88 2bsm s TYR 160 Cb -0.17 -1.17 0.01 0.00 -0.40 0.00 0.00 41.96 40.23 2bsm s TYR 160 CO 0.15 0.58 -0.19 0.00 -1.57 0.00 0.00 175.55 174.52 2bsm s ALA 161 N -2.00 2.04 0.01 3.71 0.00 0.30 -1.62 121.76 124.20 2bsm s ALA 161 Ca 0.26 -0.97 -0.01 0.00 0.00 0.00 0.00 51.96 51.25 2bsm s ALA 161 Cb -0.07 -0.97 -0.04 0.00 0.00 0.00 0.00 23.12 22.04 2bsm s ALA 161 CO 0.15 -0.11 0.13 -0.46 0.00 0.00 0.00 175.76 175.46 2bsm s TRP 162 N 0.99 3.38 -0.16 0.00 -0.00 0.81 -1.41 118.94 122.56 2bsm s TRP 162 Ca -0.04 0.24 -0.18 0.00 -0.00 0.00 0.00 56.10 56.12 2bsm s TRP 162 Cb -0.15 -1.75 0.05 0.00 -0.00 0.00 0.00 33.47 31.62 2bsm s TRP 162 CO -0.04 0.58 0.49 -2.00 -0.00 0.00 0.00 176.95 175.98 2bsm s GLU 163 N -1.96 0.62 -0.17 5.86 2.12 -0.31 0.40 118.70 125.26 2bsm s GLU 163 Ca 0.26 0.56 -0.18 0.00 0.36 0.00 0.00 54.97 55.97 2bsm s GLU 163 Cb -0.12 0.30 0.05 0.00 0.26 0.00 0.00 34.13 34.61 2bsm s GLU 163 CO 0.18 -0.10 0.50 0.45 -0.54 0.00 0.00 175.26 175.74 2bsm s SER 164 N -0.02 -0.51 -0.33 -1.70 0.15 -0.41 -0.84 113.70 110.05 2bsm s SER 164 Ca -0.02 0.93 0.07 0.00 0.70 0.00 0.00 55.95 57.63 2bsm s SER 164 Cb -0.03 0.95 0.51 0.00 -1.71 0.00 0.00 66.02 65.73 2bsm s SER 164 CO 0.02 -0.21 1.50 -1.20 1.20 0.00 0.00 173.24 174.54 2bsm n SER 165 N 2.62 3.14 0.00 5.45 7.64 -1.26 -1.39 113.62 129.82 2bsm n SER 165 Ca -0.14 -3.79 0.00 0.00 1.01 0.00 0.00 58.87 55.95 2bsm n SER 165 Cb 0.57 -0.64 0.00 0.00 -1.01 0.00 0.00 64.21 63.13 2bsm n SER 165 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2bsm n ALA 166 N -1.07 0.00 -2.00 -0.43 0.00 -1.26 -4.92 120.51 110.83 2bsm n ALA 166 Ca 0.38 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.62 2bsm n ALA 166 Cb 1.03 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 20.44 2bsm n ALA 166 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bsm n GLY 167 N 0.00 0.65 0.83 0.00 0.00 -1.26 -3.54 105.19 101.87 2bsm n GLY 167 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2bsm n GLY 167 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bsm n GLY 168 N -0.68 0.65 3.11 -0.02 0.00 -1.26 -5.05 105.19 101.94 2bsm n GLY 168 Ca -0.22 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.70 2bsm n GLY 168 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2bsm s SER 169 N -2.97 0.05 0.12 1.61 1.04 -1.23 -1.92 113.70 110.40 2bsm s SER 169 Ca 0.00 -0.25 0.04 0.00 0.48 0.00 0.00 55.95 56.22 2bsm s SER 169 Cb 0.00 0.20 -0.04 0.00 0.10 0.00 0.00 66.02 66.28 2bsm s SER 169 CO 0.00 -0.39 -0.11 0.72 0.98 0.00 0.00 173.24 174.44 2bsm s PHE 170 N -1.53 1.22 0.19 5.02 -0.12 -0.70 -4.40 117.98 117.64 2bsm s PHE 170 Ca -0.14 -0.68 0.09 0.00 -0.05 0.00 0.00 56.93 56.15 2bsm s PHE 170 Cb -0.07 -0.64 -0.04 0.00 -0.63 0.00 0.00 43.02 41.64 2bsm s PHE 170 CO 0.01 0.07 -0.07 0.95 -0.05 0.00 0.00 175.22 176.13 2bsm s THR 171 N -2.79 3.32 -0.04 -4.49 -4.23 -0.02 -0.66 115.64 106.74 2bsm s THR 171 Ca 0.11 -1.63 0.02 0.00 -1.18 0.00 0.00 61.69 59.01 2bsm s THR 171 Cb -0.01 -2.66 0.01 0.00 1.34 0.00 0.00 72.50 71.18 2bsm s THR 171 CO 0.01 -0.13 -0.09 -0.69 -0.54 0.00 0.00 174.62 173.18 2bsm s VAL 172 N -1.76 0.82 0.07 2.29 1.01 -0.59 -1.17 120.40 121.06 2bsm s VAL 172 Ca 0.26 -0.32 0.02 0.00 0.00 0.00 0.00 61.98 61.94 2bsm s VAL 172 Cb -0.09 -0.76 -0.03 0.00 0.00 0.00 0.00 36.38 35.50 2bsm s VAL 172 CO 0.16 0.27 -0.07 0.00 0.00 0.00 0.00 175.10 175.46 2bsm s ARG 173 N 0.57 0.65 -0.32 2.72 1.70 -0.50 -1.37 118.95 122.41 2bsm s ARG 173 Ca -0.10 -1.00 -0.29 0.00 -0.47 0.00 0.00 55.73 53.87 2bsm s ARG 173 Cb -0.13 -0.25 0.00 0.00 -0.57 0.00 0.00 34.95 34.01 2bsm s ARG 173 CO 0.01 0.02 1.31 0.95 -1.08 0.00 0.00 175.30 176.52 2bsm s THR 174 N -2.34 4.10 -0.38 4.99 -4.23 -1.26 -0.54 115.64 115.99 2bsm s THR 174 Ca -0.01 1.22 -0.29 0.00 -1.18 0.00 0.00 61.69 61.44 2bsm s THR 174 Cb -0.03 -4.18 0.02 0.00 1.34 0.00 0.00 72.50 69.64 2bsm s THR 174 CO -0.02 -0.54 1.18 -0.62 -0.54 0.00 0.00 174.62 174.08 2bsm s ASP 175 N 2.97 6.70 0.00 3.99 2.15 0.55 -4.88 116.67 128.16 2bsm s ASP 175 Ca 0.57 0.85 0.24 0.00 0.43 0.00 0.00 52.55 54.64 2bsm s ASP 175 Cb -0.16 -2.54 0.32 0.00 -0.30 0.00 0.00 42.92 40.24 2bsm s ASP 175 CO 0.25 -1.12 1.29 0.35 -0.17 0.00 0.00 175.17 175.77 2bsm n THR 176 N 6.42 0.00 0.00 1.71 -2.24 -1.26 -4.68 114.28 114.23 2bsm n THR 176 Ca 0.13 -0.16 0.00 0.00 -2.27 0.00 0.00 64.05 61.75 2bsm n THR 176 Cb 0.48 0.81 0.00 0.00 -2.10 0.00 0.00 70.33 69.52 2bsm n THR 176 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2bsm n GLY 177 N 1.40 -1.43 3.52 3.38 0.00 -1.26 -4.82 105.19 105.98 2bsm n GLY 177 Ca 0.10 -1.11 -0.45 0.00 0.00 0.00 0.00 46.02 44.56 2bsm n GLY 177 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2bsm n GLU 178 N 0.00 1.25 -2.00 1.61 4.07 -1.26 -4.93 120.64 119.38 2bsm n GLU 178 Ca 0.00 0.28 -0.39 0.00 -0.06 0.00 0.00 57.16 56.98 2bsm n GLU 178 Cb 0.00 -2.84 0.00 0.00 -0.06 0.00 0.00 31.44 28.54 2bsm n GLU 178 CO 0.00 0.00 0.00 -1.25 -0.06 0.00 0.00 177.13 175.82 2bsm s PRO 179 N 6.92 3.90 0.00 5.31 0.04 -1.26 -4.95 135.00 144.96 2bsm s PRO 179 Ca 1.06 2.20 0.00 0.00 0.04 0.00 0.00 61.00 64.31 2bsm s PRO 179 Cb -0.58 -2.73 0.00 0.00 0.04 0.00 0.00 34.50 31.23 2bsm s PRO 179 CO 0.40 -0.57 0.28 0.00 0.04 0.00 0.00 177.00 177.15 2bsm n MET 180 N 0.04 1.73 0.00 4.56 0.00 -1.26 -5.05 117.12 117.14 2bsm n MET 180 Ca 0.04 -0.28 0.00 0.00 0.00 0.00 0.00 57.70 57.46 2bsm n MET 180 Cb 0.43 -0.75 0.00 0.00 0.00 0.00 0.00 33.22 32.90 2bsm n MET 180 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2bsm n GLY 181 N 0.33 2.04 3.64 3.17 0.00 -1.26 -4.74 105.19 108.36 2bsm n GLY 181 Ca 0.00 -0.32 -0.08 0.00 0.00 0.00 0.00 46.02 45.62 2bsm n GLY 181 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2bsm s ARG 182 N 0.00 0.51 0.00 1.61 3.52 -1.25 -4.86 118.95 118.48 2bsm s ARG 182 Ca 0.00 0.65 0.00 0.00 -0.13 0.00 0.00 55.73 56.25 2bsm s ARG 182 Cb 0.00 0.22 0.00 0.00 -1.56 0.00 0.00 34.95 33.61 2bsm s ARG 182 CO 0.00 -0.07 0.00 0.41 -0.81 0.00 0.00 175.30 174.83 2bsm n GLY 183 N 2.57 0.94 2.82 8.12 0.00 -0.79 -4.47 105.19 114.39 2bsm n GLY 183 Ca -0.14 -1.92 -0.14 0.00 0.00 0.00 0.00 46.02 43.83 2bsm n GLY 183 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2bsm s THR 184 N -2.58 -0.01 -0.17 2.61 2.01 -0.94 -0.62 115.64 115.95 2bsm s THR 184 Ca 0.00 0.10 0.01 0.00 0.31 0.00 0.00 61.69 62.11 2bsm s THR 184 Cb 0.00 -0.07 0.01 0.00 0.01 0.00 0.00 72.50 72.46 2bsm s THR 184 CO 0.00 0.05 -0.20 -0.75 -0.69 0.00 0.00 174.62 173.04 2bsm s LYS 185 N 0.54 3.04 -0.27 4.92 2.20 0.13 -1.04 119.74 129.26 2bsm s LYS 185 Ca -0.05 -0.82 -0.05 0.00 -0.36 0.00 0.00 55.97 54.69 2bsm s LYS 185 Cb -0.07 -2.55 0.01 0.00 -1.51 0.00 0.00 37.83 33.71 2bsm s LYS 185 CO -0.01 -0.13 0.04 0.08 -0.36 0.00 0.00 175.35 174.97 2bsm s VAL 186 N 1.10 3.68 -0.29 4.02 1.01 0.75 -0.65 120.40 130.02 2bsm s VAL 186 Ca 0.00 -0.72 -0.08 0.00 0.00 0.00 0.00 61.98 61.18 2bsm s VAL 186 Cb -0.14 -2.86 -0.01 0.00 0.00 0.00 0.00 36.38 33.37 2bsm s VAL 186 CO -0.08 0.15 0.12 -0.63 0.00 0.00 0.00 175.10 174.66 2bsm s ILE 187 N 1.46 4.40 -0.43 2.22 1.01 -0.25 -1.24 121.20 128.36 2bsm s ILE 187 Ca 0.03 -0.41 -0.16 0.00 0.00 0.00 0.00 60.65 60.11 2bsm s ILE 187 Cb -0.17 -3.20 0.04 0.00 0.01 0.00 0.00 42.46 39.14 2bsm s ILE 187 CO 0.00 0.14 0.38 -0.76 0.00 0.00 0.00 174.94 174.70 2bsm s LEU 188 N 1.59 5.18 -0.70 2.97 1.43 -0.03 -1.86 118.68 127.26 2bsm s LEU 188 Ca 0.05 -0.96 -0.27 0.00 -1.03 0.00 0.00 54.13 51.92 2bsm s LEU 188 Cb -0.17 -2.23 0.02 0.00 0.03 0.00 0.00 46.19 43.84 2bsm s LEU 188 CO 0.05 -0.56 1.39 -1.00 0.23 0.00 0.00 176.35 176.46 2bsm s HIS 189 N 1.83 2.18 0.36 0.29 3.76 -0.67 -1.88 115.29 121.16 2bsm s HIS 189 Ca 0.07 0.16 -0.27 0.00 -0.15 0.00 0.00 55.06 54.86 2bsm s HIS 189 Cb -0.20 -4.51 -0.09 0.00 1.11 0.00 0.00 32.58 28.89 2bsm s HIS 189 CO 0.10 -2.10 1.21 -0.51 -0.85 0.00 0.00 174.74 172.59 2bsm s LEU 190 N 6.36 4.33 0.54 0.89 1.43 -0.72 -0.72 118.68 130.78 2bsm s LEU 190 Ca 0.42 2.45 -0.21 0.00 -1.03 0.00 0.00 54.13 55.77 2bsm s LEU 190 Cb -0.09 -3.83 -0.06 0.00 0.03 0.00 0.00 46.19 42.23 2bsm s LEU 190 CO 0.17 -0.55 1.12 0.29 0.23 0.00 0.00 176.35 177.61 2bsm n LYS 191 N 0.49 1.29 -0.32 1.70 5.02 0.11 -4.60 118.16 121.85 2bsm n LYS 191 Ca 0.02 0.48 0.10 0.00 -2.02 0.00 0.00 58.31 56.89 2bsm n LYS 191 Cb 0.45 -2.29 0.27 0.00 -0.02 0.00 0.00 35.03 33.44 2bsm n LYS 191 CO 0.00 0.00 0.00 1.49 -0.52 0.00 0.00 177.40 178.37 2bsm h GLU 192 N 1.06 0.65 -0.41 1.97 4.81 -1.94 -1.20 114.58 119.52 2bsm h GLU 192 Ca -0.48 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 58.71 2bsm h GLU 192 Cb 1.34 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 30.57 2bsm h GLU 192 CO 0.54 0.43 0.00 -0.40 -0.73 0.00 0.00 179.01 178.85 2bsm n ASP 193 N -4.84 1.57 -0.45 1.04 5.75 -1.26 -4.10 116.55 114.26 2bsm n ASP 193 Ca 0.20 -2.08 0.07 0.00 -0.01 0.00 0.00 54.79 52.97 2bsm n ASP 193 Cb 0.51 -0.26 0.16 0.00 -1.03 0.00 0.00 41.12 40.50 2bsm n ASP 193 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2bsm n GLN 194 N 0.18 1.32 0.00 0.11 1.13 -0.45 -4.76 117.38 114.90 2bsm n GLN 194 Ca 0.08 -2.86 0.13 0.00 -1.94 0.00 0.00 57.00 52.40 2bsm n GLN 194 Cb 0.29 -1.43 0.73 0.00 0.11 0.00 0.00 30.24 29.93 2bsm n GLN 194 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 2bsm n THR 195 N -1.10 0.08 0.30 5.09 -2.24 -1.26 -3.13 114.28 112.02 2bsm n THR 195 Ca 0.16 0.02 0.18 0.00 -2.27 0.00 0.00 64.05 62.15 2bsm n THR 195 Cb 0.70 -0.61 0.92 0.00 -2.10 0.00 0.00 70.33 69.25 2bsm n THR 195 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 2bsm h GLU 196 N 0.00 0.00 -0.18 -0.78 4.11 -1.94 -2.34 114.58 113.44 2bsm h GLU 196 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2bsm h GLU 196 Cb 0.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.34 2bsm h GLU 196 CO 0.00 0.03 0.00 0.66 0.07 0.00 0.00 179.01 179.77 2bsm n TYR 197 N -3.24 0.24 0.79 2.06 4.01 -1.18 -2.29 117.16 117.55 2bsm n TYR 197 Ca -0.02 -0.12 0.09 0.00 -0.16 0.00 0.00 57.90 57.69 2bsm n TYR 197 Cb 0.19 0.00 -0.00 0.00 -0.31 0.00 0.00 39.34 39.22 2bsm n TYR 197 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 2bsm n LEU 198 N 0.03 1.75 -4.70 7.72 4.77 -0.88 -4.83 117.00 120.86 2bsm n LEU 198 Ca 0.07 -0.77 -0.41 0.00 -0.03 0.00 0.00 56.01 54.87 2bsm n LEU 198 Cb 0.16 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.21 2bsm n LEU 198 CO 0.05 0.33 0.52 -1.61 -1.33 0.00 0.00 177.39 175.35 2bsm s GLU 199 N -2.04 4.42 0.16 3.23 0.41 -0.97 -4.88 118.70 119.03 2bsm s GLU 199 Ca 0.15 1.03 -0.19 0.00 -0.41 0.00 0.00 54.97 55.55 2bsm s GLU 199 Cb 0.14 -3.49 0.07 0.00 -1.78 0.00 0.00 34.13 29.08 2bsm s GLU 199 CO 0.44 -0.07 1.66 1.49 -0.49 0.00 0.00 175.26 178.29 2bsm h GLU 200 N 6.93 -0.09 -0.65 1.61 4.81 -1.93 -1.67 114.58 123.60 2bsm h GLU 200 Ca -0.38 0.01 0.13 0.00 -0.13 0.00 0.00 59.36 58.99 2bsm h GLU 200 Cb 1.18 0.02 -0.10 0.00 0.63 0.00 0.00 28.75 30.48 2bsm h GLU 200 CO 0.78 -0.06 0.11 0.00 -0.73 0.00 0.00 179.01 179.11 2bsm h ARG 201 N -0.09 0.22 -0.23 1.92 3.08 -1.95 -0.77 114.38 116.57 2bsm h ARG 201 Ca 0.17 -0.01 -0.12 0.00 0.07 0.00 0.00 59.98 60.09 2bsm h ARG 201 Cb 0.35 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.35 2bsm h ARG 201 CO -0.40 0.15 -0.31 -0.09 -1.07 0.00 0.00 179.97 178.24 2bsm h ARG 202 N 0.23 0.62 -0.30 0.04 9.65 -1.72 -2.06 114.38 120.83 2bsm h ARG 202 Ca 0.35 -0.36 -0.04 0.00 -1.10 0.00 0.00 59.98 58.83 2bsm h ARG 202 Cb 0.56 0.03 -0.01 0.00 -1.39 0.00 0.00 29.97 29.16 2bsm h ARG 202 CO -0.47 0.97 0.03 0.82 2.80 0.00 0.00 179.97 184.11 2bsm h ILE 203 N 0.32 1.25 -0.66 1.20 2.04 -1.03 -1.76 117.51 118.87 2bsm h ILE 203 Ca 0.03 -0.87 0.12 0.00 1.00 0.00 0.00 64.86 65.14 2bsm h ILE 203 Cb 0.89 1.22 -0.09 0.00 -0.74 0.00 0.00 36.82 38.11 2bsm h ILE 203 CO 0.07 0.28 0.18 0.11 0.00 0.00 0.00 178.15 178.80 2bsm h LYS 204 N 0.33 0.31 -0.34 2.37 1.57 -1.18 -0.31 116.57 119.31 2bsm h LYS 204 Ca 0.09 -0.02 -0.03 0.00 -1.87 0.00 0.00 60.65 58.82 2bsm h LYS 204 Cb 0.39 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.61 2bsm h LYS 204 CO 0.01 0.20 0.09 1.49 -0.57 0.00 0.00 179.45 180.68 2bsm h GLU 205 N 0.32 0.54 -0.48 3.15 4.81 -1.16 -0.65 114.58 121.11 2bsm h GLU 205 Ca 0.35 -0.12 -0.06 0.00 -0.13 0.00 0.00 59.36 59.40 2bsm h GLU 205 Cb 0.53 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.82 2bsm h GLU 205 CO -0.41 0.58 0.06 0.82 -0.73 0.00 0.00 179.01 179.34 2bsm h ILE 206 N 0.40 1.25 -0.55 2.32 2.04 -0.87 -1.95 117.51 120.16 2bsm h ILE 206 Ca 0.11 -0.94 -0.06 0.00 1.00 0.00 0.00 64.86 64.96 2bsm h ILE 206 Cb 0.28 0.93 -0.02 0.00 -0.74 0.00 0.00 36.82 37.27 2bsm h ILE 206 CO -0.00 0.33 0.11 0.58 0.00 0.00 0.00 178.15 179.17 2bsm h VAL 207 N 0.67 1.25 -0.68 1.67 2.07 -0.91 -1.56 116.25 118.76 2bsm h VAL 207 Ca 0.14 -0.93 -0.03 0.00 0.82 0.00 0.00 66.70 66.71 2bsm h VAL 207 Cb 0.41 0.80 -0.03 0.00 -1.52 0.00 0.00 31.29 30.95 2bsm h VAL 207 CO 0.01 0.34 0.32 0.50 0.02 0.00 0.00 177.57 178.76 2bsm h LYS 208 N 0.79 0.96 -0.02 1.57 3.64 -1.03 -1.47 116.57 121.01 2bsm h LYS 208 Ca 0.17 -0.13 -0.19 0.00 -1.27 0.00 0.00 60.65 59.23 2bsm h LYS 208 Cb 0.38 -0.18 0.01 0.00 -0.41 0.00 0.00 32.23 32.04 2bsm h LYS 208 CO 0.01 0.75 -0.74 -0.22 -2.27 0.00 0.00 179.45 176.98 2bsm h LYS 209 N 0.96 0.54 -0.00 1.90 3.64 -1.06 -3.37 116.57 119.17 2bsm h LYS 209 Ca 0.24 -0.55 0.00 0.00 -1.27 0.00 0.00 60.65 59.07 2bsm h LYS 209 Cb 0.10 0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.07 2bsm h LYS 209 CO -0.03 1.18 -0.03 0.72 -2.27 0.00 0.00 179.45 179.02 2bsm n HIS 210 N -4.09 0.00 -2.36 1.91 8.25 -0.61 -4.75 115.22 113.56 2bsm n HIS 210 Ca -0.10 0.00 0.01 0.00 -0.26 0.00 0.00 57.72 57.37 2bsm n HIS 210 Cb 0.73 0.00 -0.00 0.00 1.12 0.00 0.00 29.99 31.84 2bsm n HIS 210 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 2bsm n SER 211 N -0.51 0.40 0.15 0.41 7.64 -0.56 -4.91 113.62 116.24 2bsm n SER 211 Ca 0.00 -2.00 0.01 0.00 1.01 0.00 0.00 58.87 57.89 2bsm n SER 211 Cb 0.02 -0.12 0.20 0.00 -1.01 0.00 0.00 64.21 63.31 2bsm n SER 211 CO 0.00 0.00 0.00 0.06 -3.01 0.00 0.00 175.04 172.09 2bsm h GLN 212 N 0.74 0.00 -2.20 1.43 -0.00 -1.69 -3.29 115.11 110.10 2bsm h GLN 212 Ca -0.33 0.00 -0.66 0.00 -0.00 0.00 0.00 58.65 57.66 2bsm h GLN 212 Cb 1.74 0.00 -0.37 0.00 -0.00 0.00 0.00 27.48 28.84 2bsm h GLN 212 CO -0.02 0.55 -0.13 1.19 -0.00 0.00 0.00 178.83 180.42 2bsm n PHE 213 N -3.63 3.62 -3.82 0.06 3.72 -1.26 -4.99 117.46 111.17 2bsm n PHE 213 Ca -0.01 -3.47 -0.35 0.00 -0.05 0.00 0.00 57.45 53.57 2bsm n PHE 213 Cb 0.61 -0.67 -0.08 0.00 -0.94 0.00 0.00 39.48 38.40 2bsm n PHE 213 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 2bsm s ILE 214 N -4.56 5.32 -0.61 4.37 -1.09 -1.24 -5.01 121.20 118.38 2bsm s ILE 214 Ca 0.46 0.15 0.03 0.00 -2.23 0.00 0.00 60.65 59.06 2bsm s ILE 214 Cb 0.27 -3.39 0.20 0.00 -1.58 0.00 0.00 42.46 37.97 2bsm s ILE 214 CO -0.15 0.49 0.94 0.61 -1.23 0.00 0.00 174.94 175.60 2bsm n GLY 215 N 3.09 2.10 3.00 6.18 0.00 -1.26 -4.77 105.19 113.54 2bsm n GLY 215 Ca -0.17 -0.25 -0.14 0.00 0.00 0.00 0.00 46.02 45.45 2bsm n GLY 215 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2bsm s TYR 216 N -1.29 0.54 0.32 1.61 2.02 -1.26 -5.11 117.35 114.18 2bsm s TYR 216 Ca 0.14 -0.28 -0.29 0.00 -0.37 0.00 0.00 57.07 56.27 2bsm s TYR 216 Cb 0.11 -0.34 -0.11 0.00 -0.40 0.00 0.00 41.96 41.22 2bsm s TYR 216 CO 0.04 -0.05 1.56 -1.25 -1.57 0.00 0.00 175.55 174.28 2bsm s PRO 217 N -0.79 4.12 -0.22 -1.71 0.04 -1.26 -4.82 135.00 130.35 2bsm s PRO 217 Ca -0.04 2.58 0.00 0.00 0.04 0.00 0.00 61.00 63.58 2bsm s PRO 217 Cb -0.06 -3.01 0.03 0.00 0.04 0.00 0.00 34.50 31.51 2bsm s PRO 217 CO 0.00 -0.60 -0.13 0.42 0.04 0.00 0.00 177.00 176.73 2bsm s ILE 218 N -0.37 2.38 -0.22 0.56 1.01 -1.25 -1.58 121.20 121.72 2bsm s ILE 218 Ca 0.60 -1.09 -0.07 0.00 0.00 0.00 0.00 60.65 60.08 2bsm s ILE 218 Cb -0.47 -2.15 -0.03 0.00 0.01 0.00 0.00 42.46 39.81 2bsm s ILE 218 CO 0.53 0.31 0.06 -0.89 0.00 0.00 0.00 174.94 174.95 2bsm s THR 219 N 1.27 4.39 -0.42 2.92 2.01 -0.43 -5.00 115.64 120.38 2bsm s THR 219 Ca 0.01 -0.15 -0.18 0.00 0.31 0.00 0.00 61.69 61.67 2bsm s THR 219 Cb -0.16 -3.02 0.02 0.00 0.01 0.00 0.00 72.50 69.35 2bsm s THR 219 CO -0.08 0.38 0.51 -0.22 -0.69 0.00 0.00 174.62 174.52 2bsm s LEU 220 N 1.17 4.70 0.68 4.42 2.96 -1.26 -0.63 118.68 130.72 2bsm s LEU 220 Ca 0.04 -0.51 -0.14 0.00 -0.22 0.00 0.00 54.13 53.30 2bsm s LEU 220 Cb -0.14 -2.51 0.01 0.00 0.50 0.00 0.00 46.19 44.05 2bsm s LEU 220 CO 0.03 -0.63 1.11 -0.36 -1.32 0.00 0.00 176.35 175.18 2bsm s PHE 221 N 2.38 2.56 0.35 5.38 0.40 -0.40 -4.98 117.98 123.67 2bsm s PHE 221 Ca 0.16 1.56 0.09 0.00 -0.60 0.00 0.00 56.93 58.14 2bsm s PHE 221 Cb -0.16 -3.17 -0.06 0.00 0.51 0.00 0.00 43.02 40.14 2bsm s PHE 221 CO 0.15 -1.78 -0.00 0.54 0.70 0.00 0.00 175.22 174.83 2bsm s VAL 222 N -2.40 2.45 0.03 -0.44 0.11 -1.26 -4.66 120.40 114.23 2bsm s VAL 222 Ca 0.67 -2.02 0.04 0.00 -2.93 0.00 0.00 61.98 57.74 2bsm s VAL 222 Cb -0.21 -2.79 -0.04 0.00 -1.53 0.00 0.00 36.38 31.82 2bsm s VAL 222 CO 0.44 -0.17 -0.05 -1.61 -3.33 0.00 0.00 175.10 170.39 2bsm s GLU 223 N -3.70 2.53 0.00 1.54 2.02 -1.26 -4.99 118.70 114.84 2bsm s GLU 223 Ca 0.35 -0.77 0.00 0.00 0.02 0.00 0.00 54.97 54.57 2bsm s GLU 223 Cb 0.02 -2.51 0.00 0.00 0.10 0.00 0.00 34.13 31.74 2bsm s GLU 223 CO 0.19 0.58 0.00 1.17 0.02 0.00 0.00 175.26 177.22