#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wi5 s VAL 17 N 0.00 4.93 -0.05 6.31 1.01 -1.26 -4.26 120.40 127.07 2wi5 s VAL 17 Ca 0.00 -0.58 -0.14 0.00 0.00 0.00 0.00 61.98 61.26 2wi5 s VAL 17 Cb 0.00 -3.66 -0.05 0.00 0.00 0.00 0.00 36.38 32.67 2wi5 s VAL 17 CO 0.00 -0.15 0.36 -1.61 0.00 0.00 0.00 175.10 173.70 2wi5 s GLU 18 N 1.64 3.95 -0.16 2.72 2.02 -0.76 -4.98 118.70 123.13 2wi5 s GLU 18 Ca 0.04 0.30 -0.01 0.00 0.02 0.00 0.00 54.97 55.32 2wi5 s GLU 18 Cb -0.18 -3.27 -0.01 0.00 0.10 0.00 0.00 34.13 30.77 2wi5 s GLU 18 CO 0.08 0.58 -0.11 0.99 0.02 0.00 0.00 175.26 176.82 2wi5 s THR 19 N -0.66 3.07 0.13 3.63 2.01 -1.26 -1.32 115.64 121.24 2wi5 s THR 19 Ca 0.22 -0.64 0.09 0.00 0.31 0.00 0.00 61.69 61.67 2wi5 s THR 19 Cb -0.15 -2.32 -0.04 0.00 0.01 0.00 0.00 72.50 70.00 2wi5 s THR 19 CO 0.10 0.50 -0.18 -0.36 -0.69 0.00 0.00 174.62 174.00 2wi5 s PHE 20 N 0.71 2.53 -0.02 4.92 0.40 0.22 -4.99 117.98 121.76 2wi5 s PHE 20 Ca -0.05 -0.26 -0.29 0.00 -0.60 0.00 0.00 56.93 55.73 2wi5 s PHE 20 Cb -0.15 -1.33 -0.03 0.00 0.51 0.00 0.00 43.02 42.02 2wi5 s PHE 20 CO 0.02 0.41 0.93 0.00 0.70 0.00 0.00 175.22 177.27 2wi5 s ALA 21 N -1.24 3.20 0.51 5.36 0.00 -1.26 -0.78 121.76 127.55 2wi5 s ALA 21 Ca 0.19 0.45 -0.23 0.00 0.00 0.00 0.00 51.96 52.37 2wi5 s ALA 21 Cb -0.10 -3.27 -0.06 0.00 0.00 0.00 0.00 23.12 19.69 2wi5 s ALA 21 CO 0.11 -0.22 1.30 1.19 0.00 0.00 0.00 175.76 178.14 2wi5 n PHE 22 N 3.92 2.13 -1.23 0.00 3.72 -0.24 -4.91 117.46 120.85 2wi5 n PHE 22 Ca 0.05 0.45 -0.36 0.00 -0.05 0.00 0.00 57.45 57.54 2wi5 n PHE 22 Cb 0.51 -2.35 0.08 0.00 -0.94 0.00 0.00 39.48 36.78 2wi5 n PHE 22 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 2wi5 n GLN 23 N -0.65 0.28 -0.24 -1.08 6.02 -1.26 -4.73 117.38 115.72 2wi5 n GLN 23 Ca 0.09 0.14 0.06 0.00 -0.01 0.00 0.00 57.00 57.29 2wi5 n GLN 23 Cb 0.43 -1.96 0.31 0.00 1.02 0.00 0.00 30.24 30.04 2wi5 n GLN 23 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2wi5 h ALA 24 N -0.49 1.64 -0.35 -1.58 0.00 -1.98 -1.67 119.26 114.83 2wi5 h ALA 24 Ca -0.46 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.32 2wi5 h ALA 24 Cb 1.34 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 2wi5 h ALA 24 CO 0.43 0.22 -0.24 0.93 0.00 0.00 0.00 179.25 180.59 2wi5 h GLU 25 N 0.85 0.78 -0.66 0.00 3.07 -1.95 -2.03 114.58 114.64 2wi5 h GLU 25 Ca 0.36 -0.37 -0.05 0.00 -0.50 0.00 0.00 59.36 58.80 2wi5 h GLU 25 Cb 0.29 -0.01 -0.03 0.00 -0.84 0.00 0.00 28.75 28.16 2wi5 h GLU 25 CO -0.13 1.00 0.22 0.82 -1.40 0.00 0.00 179.01 179.52 2wi5 h ILE 26 N 0.56 1.25 -0.56 3.13 2.04 -1.74 -0.37 117.51 121.82 2wi5 h ILE 26 Ca 0.07 -0.82 -0.02 0.00 1.00 0.00 0.00 64.86 65.08 2wi5 h ILE 26 Cb 0.80 0.55 -0.03 0.00 -0.74 0.00 0.00 36.82 37.40 2wi5 h ILE 26 CO 0.06 0.32 0.26 0.00 0.00 0.00 0.00 178.15 178.79 2wi5 h ALA 27 N 1.09 1.40 0.06 1.87 0.00 -1.19 0.56 119.26 123.05 2wi5 h ALA 27 Ca 0.21 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 2wi5 h ALA 27 Cb 0.27 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.83 2wi5 h ALA 27 CO -0.01 0.47 -0.03 1.96 0.00 0.00 0.00 179.25 181.64 2wi5 h GLN 28 N 0.79 -0.08 -0.31 0.00 4.20 -1.17 -0.83 115.11 117.71 2wi5 h GLN 28 Ca 0.20 0.01 0.04 0.00 0.06 0.00 0.00 58.65 58.96 2wi5 h GLN 28 Cb 0.10 0.02 -0.08 0.00 0.30 0.00 0.00 27.48 27.82 2wi5 h GLN 28 CO -0.02 0.45 -0.54 1.25 -0.67 0.00 0.00 178.83 179.29 2wi5 h LEU 29 N -0.66 -1.77 -0.93 1.46 5.85 -0.95 0.12 115.31 118.42 2wi5 h LEU 29 Ca -0.01 0.23 0.18 0.00 0.84 0.00 0.00 57.88 59.12 2wi5 h LEU 29 Cb 0.56 0.72 -0.11 0.00 0.37 0.00 0.00 40.66 42.20 2wi5 h LEU 29 CO 0.01 -0.43 0.51 0.24 -0.34 0.00 0.00 178.44 178.43 2wi5 h MET 30 N -0.46 0.63 -0.66 1.25 2.86 -0.91 -0.04 114.93 117.61 2wi5 h MET 30 Ca 0.06 -0.04 -0.07 0.00 -2.06 0.00 0.00 59.70 57.59 2wi5 h MET 30 Cb 0.63 -0.14 -0.03 0.00 0.06 0.00 0.00 31.60 32.12 2wi5 h MET 30 CO -0.54 0.42 0.12 1.03 1.06 0.00 0.00 176.91 179.00 2wi5 h SER 31 N 0.65 1.03 -0.66 1.22 0.87 0.50 -1.59 113.55 115.58 2wi5 h SER 31 Ca 0.54 -0.25 -0.06 0.00 -1.23 0.00 0.00 61.79 60.79 2wi5 h SER 31 Cb 0.84 -0.27 -0.03 0.00 -0.44 0.00 0.00 62.40 62.50 2wi5 h SER 31 CO -0.40 1.02 0.19 0.25 -0.53 0.00 0.00 176.83 177.36 2wi5 h LEU 32 N 1.00 0.97 -1.01 2.23 6.46 0.00 -1.92 115.31 123.05 2wi5 h LEU 32 Ca 0.20 -0.22 -0.05 0.00 -0.12 0.00 0.00 57.88 57.69 2wi5 h LEU 32 Cb 0.42 -0.26 -0.02 0.00 -0.73 0.00 0.00 40.66 40.07 2wi5 h LEU 32 CO 0.01 0.93 0.12 0.40 -0.62 0.00 0.00 178.44 179.28 2wi5 h ILE 33 N 0.96 1.23 0.00 4.05 2.04 -0.62 0.81 117.51 125.98 2wi5 h ILE 33 Ca 0.21 -0.84 -0.04 0.00 1.00 0.00 0.00 64.86 65.19 2wi5 h ILE 33 Cb 0.32 0.69 -0.01 0.00 -0.74 0.00 0.00 36.82 37.08 2wi5 h ILE 33 CO -0.00 0.31 -0.19 0.40 0.00 0.00 0.00 178.15 178.66 2wi5 h ILE 34 N 0.80 0.34 0.00 -0.67 2.04 -1.23 -3.40 117.51 115.40 2wi5 h ILE 34 Ca 0.17 -1.47 -0.15 0.00 1.00 0.00 0.00 64.86 64.41 2wi5 h ILE 34 Cb 0.31 2.16 -0.03 0.00 -0.74 0.00 0.00 36.82 38.52 2wi5 h ILE 34 CO 0.00 0.19 -1.59 0.59 0.00 0.00 0.00 178.15 177.34 2wi5 n ASN 35 N -3.15 2.85 -4.70 1.72 3.02 -0.73 -4.97 115.26 109.30 2wi5 n ASN 35 Ca 0.03 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.16 2wi5 n ASN 35 Cb 0.61 0.74 -0.03 0.00 -0.61 0.00 0.00 39.78 40.49 2wi5 n ASN 35 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2wi5 s THR 36 N -2.23 3.11 0.12 3.41 2.01 0.25 -4.96 115.64 117.36 2wi5 s THR 36 Ca -0.04 0.67 -0.31 0.00 0.31 0.00 0.00 61.69 62.31 2wi5 s THR 36 Cb 0.03 -3.43 -0.10 0.00 0.01 0.00 0.00 72.50 69.01 2wi5 s THR 36 CO 0.36 0.02 1.71 0.12 -0.69 0.00 0.00 174.62 176.14 2wi5 s PHE 37 N 1.98 2.49 -0.33 4.92 5.36 -1.26 -4.95 117.98 126.18 2wi5 s PHE 37 Ca 0.70 0.25 -0.01 0.00 -0.96 0.00 0.00 56.93 56.90 2wi5 s PHE 37 Cb -0.39 -4.06 0.19 0.00 -0.34 0.00 0.00 43.02 38.42 2wi5 s PHE 37 CO 0.31 -4.21 0.82 -0.47 -1.46 0.00 0.00 175.22 170.20 2wi5 s TYR 38 N 2.24 -1.13 -0.28 10.12 5.04 -1.26 -5.06 117.35 127.01 2wi5 s TYR 38 Ca 0.76 0.40 0.27 0.00 -2.44 0.00 0.00 57.07 56.06 2wi5 s TYR 38 Cb -0.44 0.20 1.11 0.00 0.35 0.00 0.00 41.96 43.18 2wi5 s TYR 38 CO 0.34 -0.72 1.81 0.77 -1.34 0.00 0.00 175.55 176.41 2wi5 h SER 39 N 6.89 0.00 -0.16 4.32 0.02 -2.03 -3.34 113.55 119.25 2wi5 h SER 39 Ca -0.02 0.00 -0.34 0.00 -0.84 0.00 0.00 61.79 60.59 2wi5 h SER 39 Cb 1.20 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 63.67 2wi5 h SER 39 CO 0.02 0.00 0.67 -3.20 -1.14 0.00 0.00 176.83 173.18 2wi5 n ASN 40 N -2.54 6.20 0.30 3.07 4.05 -1.26 -4.63 115.26 120.46 2wi5 n ASN 40 Ca 0.02 -2.60 0.19 0.00 0.45 0.00 0.00 54.58 52.63 2wi5 n ASN 40 Cb 0.26 -1.43 0.97 0.00 1.23 0.00 0.00 39.78 40.81 2wi5 n ASN 40 CO 0.00 0.00 0.00 0.11 -3.05 0.00 0.00 177.26 174.32 2wi5 h LYS 41 N 3.47 0.00 0.00 1.20 1.57 -1.95 -3.25 116.57 117.61 2wi5 h LYS 41 Ca 0.37 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.15 2wi5 h LYS 41 Cb 1.14 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.45 2wi5 h LYS 41 CO 0.66 0.03 0.00 1.05 -0.57 0.00 0.00 179.45 180.62 2wi5 h GLU 42 N 0.00 0.00 0.00 3.15 4.11 -1.95 -2.09 114.58 117.80 2wi5 h GLU 42 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2wi5 h GLU 42 Cb 0.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.44 2wi5 h GLU 42 CO 0.00 0.00 0.00 0.44 0.07 0.00 0.00 179.01 179.52 2wi5 n ILE 43 N -2.99 1.29 -0.21 -1.06 -6.64 -1.23 -2.11 119.36 106.42 2wi5 n ILE 43 Ca -0.03 0.40 -0.00 0.00 -1.77 0.00 0.00 62.75 61.35 2wi5 n ILE 43 Cb 0.08 -1.30 0.23 0.00 -1.44 0.00 0.00 39.64 37.21 2wi5 n ILE 43 CO 0.00 0.00 0.00 2.19 -1.77 0.00 0.00 176.55 176.97 2wi5 h PHE 44 N 0.00 0.95 -0.38 4.28 -0.00 -1.61 -2.29 116.94 117.89 2wi5 h PHE 44 Ca 0.00 0.01 -0.09 0.00 -0.00 0.00 0.00 57.97 57.89 2wi5 h PHE 44 Cb 0.15 -0.32 -0.01 0.00 -0.00 0.00 0.00 35.95 35.78 2wi5 h PHE 44 CO 0.00 0.62 -0.12 1.25 -0.00 0.00 0.00 178.31 180.06 2wi5 h LEU 45 N 1.01 0.76 -1.05 2.10 5.85 -1.68 -1.55 115.31 120.74 2wi5 h LEU 45 Ca 0.27 -0.38 0.01 0.00 0.84 0.00 0.00 57.88 58.62 2wi5 h LEU 45 Cb -0.06 -0.21 -0.05 0.00 0.37 0.00 0.00 40.66 40.71 2wi5 h LEU 45 CO -0.05 0.96 0.63 -0.09 -0.34 0.00 0.00 178.44 179.55 2wi5 h ARG 46 N 0.55 1.27 -0.54 1.25 2.43 -1.65 -1.03 114.38 116.66 2wi5 h ARG 46 Ca 0.09 -0.08 -0.11 0.00 -0.81 0.00 0.00 59.98 59.07 2wi5 h ARG 46 Cb 0.65 -0.28 -0.02 0.00 -0.42 0.00 0.00 29.97 29.89 2wi5 h ARG 46 CO 0.04 0.85 -0.10 0.93 -1.51 0.00 0.00 179.97 180.17 2wi5 h GLU 47 N 1.31 1.03 -0.01 0.20 4.39 -0.79 -1.04 114.58 119.67 2wi5 h GLU 47 Ca 0.35 -0.38 -0.01 0.00 0.34 0.00 0.00 59.36 59.66 2wi5 h GLU 47 Cb -0.14 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 28.44 2wi5 h GLU 47 CO -0.08 1.07 -0.03 -0.07 -1.16 0.00 0.00 179.01 178.75 2wi5 h LEU 48 N 0.91 0.04 -1.49 1.33 3.38 -1.15 -0.90 115.31 117.44 2wi5 h LEU 48 Ca 0.14 -0.60 0.29 0.00 0.09 0.00 0.00 57.88 57.80 2wi5 h LEU 48 Cb 0.68 -0.01 -0.09 0.00 0.09 0.00 0.00 40.66 41.33 2wi5 h LEU 48 CO 0.05 0.64 0.71 0.40 0.09 0.00 0.00 178.44 180.33 2wi5 h ILE 49 N -0.55 0.47 0.02 1.22 2.04 -1.24 -0.40 117.51 119.06 2wi5 h ILE 49 Ca -0.00 -0.10 -0.22 0.00 1.00 0.00 0.00 64.86 65.54 2wi5 h ILE 49 Cb 0.63 0.15 -0.03 0.00 -0.74 0.00 0.00 36.82 36.84 2wi5 h ILE 49 CO 0.01 0.05 -1.05 -1.28 0.00 0.00 0.00 178.15 175.88 2wi5 h SER 50 N 0.29 0.05 -0.17 1.72 0.87 -1.09 -0.04 113.55 115.20 2wi5 h SER 50 Ca 0.60 -0.06 -0.01 0.00 -1.23 0.00 0.00 61.79 61.10 2wi5 h SER 50 Cb 1.72 -0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 63.66 2wi5 h SER 50 CO -0.25 1.04 0.07 0.78 -0.53 0.00 0.00 176.83 177.94 2wi5 h ASN 51 N 0.01 0.23 -0.06 6.23 2.35 -0.43 -1.73 115.58 122.17 2wi5 h ASN 51 Ca -0.03 -0.16 0.04 0.00 -0.55 0.00 0.00 56.30 55.59 2wi5 h ASN 51 Cb 1.80 -0.06 -0.05 0.00 0.05 0.00 0.00 38.32 40.06 2wi5 h ASN 51 CO 0.14 0.33 -0.21 0.28 -1.65 0.00 0.00 177.43 176.31 2wi5 h SER 52 N 0.11 -0.65 -0.55 5.81 0.02 -1.00 -1.69 113.55 115.61 2wi5 h SER 52 Ca 0.06 0.10 0.09 0.00 -0.84 0.00 0.00 61.79 61.20 2wi5 h SER 52 Cb 0.17 0.28 -0.07 0.00 0.14 0.00 0.00 62.40 62.92 2wi5 h SER 52 CO -0.00 -0.27 0.14 -1.28 -1.14 0.00 0.00 176.83 174.28 2wi5 h SER 53 N -0.31 0.07 -0.89 3.07 0.87 -0.96 -0.72 113.55 114.68 2wi5 h SER 53 Ca 0.08 0.09 0.13 0.00 -1.23 0.00 0.00 61.79 60.86 2wi5 h SER 53 Cb 0.42 0.11 -0.09 0.00 -0.44 0.00 0.00 62.40 62.40 2wi5 h SER 53 CO -0.24 0.06 0.50 0.44 -0.53 0.00 0.00 176.83 177.06 2wi5 h ASP 54 N 0.29 0.68 -0.01 6.23 3.32 -0.75 0.06 116.42 126.25 2wi5 h ASP 54 Ca 0.28 0.07 -0.07 0.00 0.02 0.00 0.00 57.03 57.33 2wi5 h ASP 54 Cb 0.37 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.85 2wi5 h ASP 54 CO -0.33 0.33 -0.19 0.00 -1.72 0.00 0.00 179.24 177.32 2wi5 h ALA 55 N 1.53 1.28 0.03 3.45 0.00 -0.68 -2.27 119.26 122.62 2wi5 h ALA 55 Ca 0.46 -0.28 -0.13 0.00 0.00 0.00 0.00 54.91 54.96 2wi5 h ALA 55 Cb 0.56 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.25 2wi5 h ALA 55 CO -0.31 0.48 -0.54 -0.07 0.00 0.00 0.00 179.25 178.81 2wi5 h LEU 56 N 0.33 0.41 -0.63 0.00 3.38 -0.43 0.28 115.31 118.66 2wi5 h LEU 56 Ca 0.06 -0.83 0.11 0.00 0.09 0.00 0.00 57.88 57.31 2wi5 h LEU 56 Cb 0.54 -0.13 -0.12 0.00 0.09 0.00 0.00 40.66 41.04 2wi5 h LEU 56 CO 0.04 1.19 -0.33 0.44 0.09 0.00 0.00 178.44 179.87 2wi5 h ASP 57 N -0.32 -1.15 -0.36 -0.43 3.32 -0.96 -0.92 116.42 115.60 2wi5 h ASP 57 Ca -0.08 0.23 0.06 0.00 0.02 0.00 0.00 57.03 57.26 2wi5 h ASP 57 Cb 1.30 0.58 -0.05 0.00 0.22 0.00 0.00 39.33 41.38 2wi5 h ASP 57 CO 0.10 -0.30 0.04 0.11 -1.72 0.00 0.00 179.24 177.48 2wi5 h LYS 58 N -0.14 0.15 -0.46 3.56 1.57 -1.40 1.00 116.57 120.85 2wi5 h LYS 58 Ca 0.25 -0.01 -0.09 0.00 -1.87 0.00 0.00 60.65 58.93 2wi5 h LYS 58 Cb 0.55 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.81 2wi5 h LYS 58 CO -0.71 0.10 -0.07 0.97 -0.57 0.00 0.00 179.45 179.17 2wi5 h ILE 59 N 0.16 1.27 -0.25 1.86 6.09 -1.34 -1.39 117.51 123.91 2wi5 h ILE 59 Ca 0.17 -1.17 0.06 0.00 -1.37 0.00 0.00 64.86 62.55 2wi5 h ILE 59 Cb 0.22 1.10 -0.06 0.00 0.47 0.00 0.00 36.82 38.55 2wi5 h ILE 59 CO -0.25 0.40 -0.14 -0.09 -3.07 0.00 0.00 178.15 175.00 2wi5 h ARG 60 N 0.69 -0.12 -0.44 2.19 2.43 -0.62 0.29 114.38 118.80 2wi5 h ARG 60 Ca 0.12 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.30 2wi5 h ARG 60 Cb 0.60 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.16 2wi5 h ARG 60 CO 0.04 -0.08 0.29 -0.92 -1.51 0.00 0.00 179.97 177.79 2wi5 h TYR 61 N -0.12 0.56 -0.54 2.20 3.20 -0.64 -1.61 116.97 120.02 2wi5 h TYR 61 Ca 0.13 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.01 2wi5 h TYR 61 Cb 0.32 -0.19 -0.03 0.00 1.54 0.00 0.00 36.73 38.38 2wi5 h TYR 61 CO -0.32 0.36 0.30 0.93 -1.64 0.00 0.00 178.16 177.79 2wi5 h GLU 62 N 0.60 0.75 0.00 1.82 5.08 -1.08 -2.50 114.58 119.25 2wi5 h GLU 62 Ca 0.16 -0.09 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 2wi5 h GLU 62 Cb -0.06 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.04 2wi5 h GLU 62 CO -0.03 0.58 0.00 -1.13 -1.00 0.00 0.00 179.01 177.42 2wi5 n SER 63 N -4.63 0.19 0.08 1.42 3.41 0.99 -2.44 113.62 112.65 2wi5 n SER 63 Ca 0.03 0.55 0.01 0.00 -0.26 0.00 0.00 58.87 59.20 2wi5 n SER 63 Cb 0.08 -0.59 0.34 0.00 -0.26 0.00 0.00 64.21 63.79 2wi5 n SER 63 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 2wi5 h LEU 64 N 0.00 0.31 -1.82 1.04 3.38 -0.86 -3.06 115.31 114.31 2wi5 h LEU 64 Ca 0.00 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.90 2wi5 h LEU 64 Cb 0.25 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.92 2wi5 h LEU 64 CO 0.00 0.47 0.00 0.35 0.09 0.00 0.00 178.44 179.35 2wi5 n THR 65 N -4.25 0.40 -3.43 0.22 -2.24 -1.10 -4.75 114.28 99.13 2wi5 n THR 65 Ca -0.00 -0.70 -0.28 0.00 -2.27 0.00 0.00 64.05 60.80 2wi5 n THR 65 Cb 0.28 0.81 -0.11 0.00 -2.10 0.00 0.00 70.33 69.21 2wi5 n THR 65 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2wi5 s ASP 66 N -0.44 2.38 0.00 3.42 2.15 -1.02 -5.01 116.67 118.15 2wi5 s ASP 66 Ca 0.01 -2.39 0.06 0.00 0.43 0.00 0.00 52.55 50.67 2wi5 s ASP 66 Cb 0.01 -0.32 0.28 0.00 -0.30 0.00 0.00 42.92 42.59 2wi5 s ASP 66 CO 0.01 -0.27 1.09 -0.81 -0.17 0.00 0.00 175.17 175.03 2wi5 n PRO 67 N 3.72 0.06 0.13 4.34 -0.04 -1.16 -2.36 135.00 139.68 2wi5 n PRO 67 Ca 0.17 0.29 0.13 0.00 -0.04 0.00 0.00 63.50 64.05 2wi5 n PRO 67 Cb 0.41 -1.50 0.43 0.00 -0.04 0.00 0.00 33.50 32.79 2wi5 n PRO 67 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2wi5 h SER 68 N 0.00 0.00 0.95 3.54 4.64 -1.95 -3.02 113.55 117.71 2wi5 h SER 68 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2wi5 h SER 68 Cb 0.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.16 2wi5 h SER 68 CO 0.00 0.00 0.00 0.11 -0.87 0.00 0.00 176.83 176.07 2wi5 h LYS 69 N 0.00 0.00 -0.67 4.77 1.57 -1.84 -0.23 116.57 120.18 2wi5 h LYS 69 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2wi5 h LYS 69 Cb 0.64 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.95 2wi5 h LYS 69 CO 0.00 0.00 0.00 1.28 -0.57 0.00 0.00 179.45 180.16 2wi5 n LEU 70 N -2.82 1.83 0.04 2.94 4.77 -1.14 -3.78 117.00 118.84 2wi5 n LEU 70 Ca 0.01 -0.92 -0.10 0.00 -0.03 0.00 0.00 56.01 54.97 2wi5 n LEU 70 Cb 0.29 -0.41 0.04 0.00 -2.33 0.00 0.00 43.42 41.00 2wi5 n LEU 70 CO 0.25 0.32 0.39 0.44 -1.33 0.00 0.00 177.39 177.45 2wi5 h ASP 71 N 1.05 0.51 0.00 -1.43 5.19 -1.22 -2.93 116.42 117.59 2wi5 h ASP 71 Ca 0.00 -0.32 0.00 0.00 -0.62 0.00 0.00 57.03 56.09 2wi5 h ASP 71 Cb 0.68 -0.15 0.00 0.00 0.18 0.00 0.00 39.33 40.04 2wi5 h ASP 71 CO 0.09 1.04 0.00 -1.54 -3.12 0.00 0.00 179.24 175.71 2wi5 n SER 72 N -3.87 0.11 0.00 6.45 3.41 -1.25 -4.83 113.62 113.64 2wi5 n SER 72 Ca -0.04 -1.85 0.00 0.00 -0.26 0.00 0.00 58.87 56.72 2wi5 n SER 72 Cb 0.68 -0.06 0.00 0.00 -0.26 0.00 0.00 64.21 64.57 2wi5 n SER 72 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2wi5 n GLY 73 N 0.38 3.53 0.07 5.00 0.00 -1.10 -3.83 105.19 109.23 2wi5 n GLY 73 Ca 0.00 -0.31 0.07 0.00 0.00 0.00 0.00 46.02 45.78 2wi5 n GLY 73 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2wi5 n LYS 74 N 0.00 0.64 -2.69 1.61 5.02 -1.24 -4.72 118.16 116.78 2wi5 n LYS 74 Ca 0.00 -0.00 -0.41 0.00 -2.02 0.00 0.00 58.31 55.88 2wi5 n LYS 74 Cb 0.00 -1.67 -0.04 0.00 -0.02 0.00 0.00 35.03 33.30 2wi5 n LYS 74 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 2wi5 s GLU 75 N -3.28 4.63 -0.42 1.97 2.02 -1.26 -4.98 118.70 117.39 2wi5 s GLU 75 Ca -0.05 1.49 -0.10 0.00 0.02 0.00 0.00 54.97 56.33 2wi5 s GLU 75 Cb 0.11 -3.39 0.07 0.00 0.10 0.00 0.00 34.13 31.02 2wi5 s GLU 75 CO 0.85 0.10 0.26 -0.51 0.02 0.00 0.00 175.26 175.98 2wi5 s LEU 76 N 0.31 5.12 0.31 1.80 1.43 -1.26 -4.72 118.68 121.66 2wi5 s LEU 76 Ca 0.49 -1.38 -0.14 0.00 -1.03 0.00 0.00 54.13 52.07 2wi5 s LEU 76 Cb -0.24 -2.02 0.02 0.00 0.03 0.00 0.00 46.19 43.99 2wi5 s LEU 76 CO 0.30 -0.52 0.62 -1.38 0.23 0.00 0.00 176.35 175.60 2wi5 s HIS 77 N 1.47 0.27 -0.10 0.29 -3.43 -1.26 -4.45 115.29 108.08 2wi5 s HIS 77 Ca 0.03 -0.72 0.02 0.00 -0.80 0.00 0.00 55.06 53.59 2wi5 s HIS 77 Cb -0.22 0.45 0.01 0.00 -1.43 0.00 0.00 32.58 31.39 2wi5 s HIS 77 CO 0.03 -1.23 -0.16 0.42 -2.00 0.00 0.00 174.74 171.80 2wi5 s ILE 78 N -3.39 1.54 -0.03 -5.38 1.01 -0.75 -2.30 121.20 111.89 2wi5 s ILE 78 Ca 0.19 -0.68 0.04 0.00 0.00 0.00 0.00 60.65 60.20 2wi5 s ILE 78 Cb -0.03 -1.39 -0.03 0.00 0.01 0.00 0.00 42.46 41.02 2wi5 s ILE 78 CO 0.11 0.45 -0.12 0.20 0.00 0.00 0.00 174.94 175.57 2wi5 s ASN 79 N 0.86 4.19 -0.24 3.58 0.02 0.11 -1.15 114.94 122.32 2wi5 s ASN 79 Ca -0.09 -0.19 -0.03 0.00 -1.02 0.00 0.00 52.86 51.53 2wi5 s ASN 79 Cb -0.15 -0.90 0.01 0.00 0.02 0.00 0.00 41.25 40.22 2wi5 s ASN 79 CO 0.00 0.32 -0.04 -0.76 0.02 0.00 0.00 177.10 176.64 2wi5 s LEU 80 N -0.97 3.09 -0.27 0.60 1.43 -0.40 -1.07 118.68 121.09 2wi5 s LEU 80 Ca 0.13 -0.64 0.02 0.00 -1.03 0.00 0.00 54.13 52.61 2wi5 s LEU 80 Cb -0.11 -1.71 0.07 0.00 0.03 0.00 0.00 46.19 44.47 2wi5 s LEU 80 CO 0.03 -0.08 -0.03 -0.63 0.23 0.00 0.00 176.35 175.86 2wi5 s ILE 81 N 1.41 1.73 0.22 -0.59 1.01 0.20 -1.40 121.20 123.78 2wi5 s ILE 81 Ca 0.03 -1.54 -0.20 0.00 0.00 0.00 0.00 60.65 58.94 2wi5 s ILE 81 Cb -0.15 -2.05 -0.08 0.00 0.01 0.00 0.00 42.46 40.18 2wi5 s ILE 81 CO -0.04 -0.25 0.72 -2.16 0.00 0.00 0.00 174.94 173.22 2wi5 s PRO 82 N 1.26 4.27 -0.20 2.79 0.04 -1.26 -0.18 135.00 141.72 2wi5 s PRO 82 Ca -0.01 0.88 -0.04 0.00 0.04 0.00 0.00 61.00 61.87 2wi5 s PRO 82 Cb -0.19 -2.91 0.07 0.00 0.04 0.00 0.00 34.50 31.51 2wi5 s PRO 82 CO -0.08 0.41 0.08 1.21 0.04 0.00 0.00 177.00 178.66 2wi5 s ASN 83 N -1.61 2.75 0.30 6.66 3.84 0.12 -4.84 114.94 122.15 2wi5 s ASN 83 Ca 0.42 -0.82 0.04 0.00 0.21 0.00 0.00 52.86 52.71 2wi5 s ASN 83 Cb -0.17 -0.36 0.49 0.00 -0.55 0.00 0.00 41.25 40.65 2wi5 s ASN 83 CO 0.21 -0.36 1.77 0.11 -2.79 0.00 0.00 177.10 176.04 2wi5 h LYS 84 N 8.36 0.43 -0.30 0.43 1.57 -1.92 -0.75 116.57 124.40 2wi5 h LYS 84 Ca -0.16 -0.15 -0.11 0.00 -1.87 0.00 0.00 60.65 58.36 2wi5 h LYS 84 Cb 1.11 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.38 2wi5 h LYS 84 CO 0.33 0.63 -0.24 1.96 -0.57 0.00 0.00 179.45 181.56 2wi5 h GLN 85 N 0.39 0.70 -0.00 3.15 4.20 -1.96 -3.02 115.11 118.57 2wi5 h GLN 85 Ca 0.06 -0.35 0.00 0.00 0.06 0.00 0.00 58.65 58.42 2wi5 h GLN 85 Cb 0.59 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.38 2wi5 h GLN 85 CO 0.04 0.96 -0.26 -0.25 -0.67 0.00 0.00 178.83 178.65 2wi5 n ASP 86 N -4.29 0.57 -3.72 1.46 9.92 -1.08 -4.95 116.55 114.46 2wi5 n ASP 86 Ca -0.03 -0.43 -0.24 0.00 -0.53 0.00 0.00 54.79 53.56 2wi5 n ASP 86 Cb 0.44 0.03 0.03 0.00 -0.64 0.00 0.00 41.12 40.98 2wi5 n ASP 86 CO 0.00 0.00 0.00 -1.14 0.13 0.00 0.00 177.20 176.19 2wi5 n ARG 87 N -1.11 -3.48 -4.57 -1.24 0.63 -0.34 -4.87 116.66 101.69 2wi5 n ARG 87 Ca 0.10 0.55 -0.23 0.00 -0.92 0.00 0.00 57.85 57.35 2wi5 n ARG 87 Cb 0.32 -4.82 -0.14 0.00 0.45 0.00 0.00 32.46 28.27 2wi5 n ARG 87 CO 0.00 0.00 0.00 0.95 -2.51 0.00 0.00 177.63 176.07 2wi5 s THR 88 N -3.67 1.28 -0.18 5.15 -4.23 -0.89 -1.77 115.64 111.33 2wi5 s THR 88 Ca 0.14 -0.91 0.00 0.00 -1.18 0.00 0.00 61.69 59.75 2wi5 s THR 88 Cb -0.04 -1.11 0.01 0.00 1.34 0.00 0.00 72.50 72.69 2wi5 s THR 88 CO 0.84 0.19 -0.17 -0.22 -0.54 0.00 0.00 174.62 174.71 2wi5 s LEU 89 N -0.84 2.28 -0.17 4.79 2.96 -0.85 -0.70 118.68 126.16 2wi5 s LEU 89 Ca 0.05 -0.59 -0.03 0.00 -0.22 0.00 0.00 54.13 53.34 2wi5 s LEU 89 Cb -0.07 -1.52 -0.02 0.00 0.50 0.00 0.00 46.19 45.07 2wi5 s LEU 89 CO 0.01 0.01 -0.06 -0.89 -1.32 0.00 0.00 176.35 174.10 2wi5 s THR 90 N 1.22 3.57 -0.38 3.68 2.01 0.75 -1.17 115.64 125.32 2wi5 s THR 90 Ca 0.03 -0.46 -0.10 0.00 0.31 0.00 0.00 61.69 61.47 2wi5 s THR 90 Cb -0.14 -2.57 0.04 0.00 0.01 0.00 0.00 72.50 69.85 2wi5 s THR 90 CO -0.09 0.48 0.20 -0.63 -0.69 0.00 0.00 174.62 173.89 2wi5 s ILE 91 N 0.68 4.35 -0.17 1.82 1.09 -0.21 -0.62 121.20 128.13 2wi5 s ILE 91 Ca -0.03 -1.04 -0.06 0.00 -1.10 0.00 0.00 60.65 58.42 2wi5 s ILE 91 Cb -0.15 -3.49 -0.04 0.00 -1.06 0.00 0.00 42.46 37.73 2wi5 s ILE 91 CO 0.02 -0.29 0.04 -0.69 -0.10 0.00 0.00 174.94 173.92 2wi5 s VAL 92 N 1.50 4.61 0.15 2.92 1.01 -0.23 -0.57 120.40 129.79 2wi5 s VAL 92 Ca 0.01 -0.10 0.08 0.00 0.00 0.00 0.00 61.98 61.97 2wi5 s VAL 92 Cb -0.20 -3.06 -0.04 0.00 0.00 0.00 0.00 36.38 33.08 2wi5 s VAL 92 CO 0.05 0.48 -0.18 1.51 0.00 0.00 0.00 175.10 176.96 2wi5 s ASP 93 N 0.21 2.58 -0.64 3.32 1.47 -0.26 0.10 116.67 123.45 2wi5 s ASP 93 Ca 0.03 -0.83 -0.02 0.00 1.18 0.00 0.00 52.55 52.91 2wi5 s ASP 93 Cb -0.13 -0.14 0.43 0.00 -0.34 0.00 0.00 42.92 42.74 2wi5 s ASP 93 CO 0.01 -0.03 2.04 0.35 0.68 0.00 0.00 175.17 178.21 2wi5 n THR 94 N 0.44 3.56 -0.10 2.11 -2.24 -0.97 -2.14 114.28 114.94 2wi5 n THR 94 Ca -0.14 -2.81 0.00 0.00 -2.27 0.00 0.00 64.05 58.83 2wi5 n THR 94 Cb 0.56 -1.18 0.00 0.00 -2.10 0.00 0.00 70.33 67.62 2wi5 n THR 94 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wi5 n GLY 95 N -0.80 -1.76 0.16 3.38 0.00 -1.26 -4.68 105.19 100.23 2wi5 n GLY 95 Ca 0.60 -1.48 0.13 0.00 0.00 0.00 0.00 46.02 45.27 2wi5 n GLY 95 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2wi5 h ILE 96 N -0.50 0.00 -1.45 -0.61 2.10 -1.28 -3.14 117.51 112.63 2wi5 h ILE 96 Ca 0.00 -0.35 0.17 0.00 1.08 0.00 0.00 64.86 65.76 2wi5 h ILE 96 Cb 0.00 1.19 -0.05 0.00 -1.09 0.00 0.00 36.82 36.87 2wi5 h ILE 96 CO 0.00 0.00 -0.29 0.61 -1.08 0.00 0.00 178.15 177.39 2wi5 n GLY 97 N 0.23 -1.81 3.29 8.18 0.00 -1.26 -4.38 105.19 109.44 2wi5 n GLY 97 Ca 0.02 -1.35 -0.23 0.00 0.00 0.00 0.00 46.02 44.46 2wi5 n GLY 97 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2wi5 s MET 98 N -1.92 1.14 0.69 1.61 1.00 -1.26 -4.78 119.30 115.79 2wi5 s MET 98 Ca 0.00 -1.23 -0.04 0.00 0.00 0.00 0.00 55.69 54.43 2wi5 s MET 98 Cb 0.00 -1.31 0.08 0.00 0.00 0.00 0.00 34.83 33.60 2wi5 s MET 98 CO 0.00 0.29 0.97 0.95 0.00 0.00 0.00 175.02 177.23 2wi5 s THR 99 N -1.49 2.32 0.28 2.05 -4.23 -1.26 -3.44 115.64 109.87 2wi5 s THR 99 Ca 0.09 -0.44 -0.00 0.00 -1.18 0.00 0.00 61.69 60.16 2wi5 s THR 99 Cb -0.08 -2.89 0.28 0.00 1.34 0.00 0.00 72.50 71.15 2wi5 s THR 99 CO 0.05 0.00 1.86 0.50 -0.54 0.00 0.00 174.62 176.49 2wi5 h LYS 100 N -0.49 1.04 -0.28 3.99 3.64 -1.97 0.27 116.57 122.77 2wi5 h LYS 100 Ca -0.42 -0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 58.88 2wi5 h LYS 100 Cb 1.29 -0.24 -0.01 0.00 -0.41 0.00 0.00 32.23 32.86 2wi5 h LYS 100 CO 0.51 0.69 0.08 0.00 -2.27 0.00 0.00 179.45 178.47 2wi5 h ALA 101 N 1.50 0.36 -0.06 5.00 0.00 -1.99 -2.09 119.26 121.99 2wi5 h ALA 101 Ca 0.47 -0.15 0.04 0.00 0.00 0.00 0.00 54.91 55.26 2wi5 h ALA 101 Cb 0.35 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 17.98 2wi5 h ALA 101 CO -0.22 -0.00 -0.21 -0.44 0.00 0.00 0.00 179.25 178.38 2wi5 h ASP 102 N 0.29 -0.63 -0.23 0.00 3.32 -1.75 0.14 116.42 117.56 2wi5 h ASP 102 Ca 0.09 0.10 0.06 0.00 0.02 0.00 0.00 57.03 57.30 2wi5 h ASP 102 Cb 0.25 0.27 -0.07 0.00 0.22 0.00 0.00 39.33 40.00 2wi5 h ASP 102 CO -0.00 -0.27 -0.21 -0.07 -1.72 0.00 0.00 179.24 176.97 2wi5 h LEU 103 N -0.31 -0.66 -1.00 1.55 3.38 -0.82 -0.68 115.31 116.77 2wi5 h LEU 103 Ca 0.08 0.13 -0.07 0.00 0.09 0.00 0.00 57.88 58.10 2wi5 h LEU 103 Cb 0.41 0.32 -0.02 0.00 0.09 0.00 0.00 40.66 41.47 2wi5 h LEU 103 CO -0.23 -0.25 -0.04 0.40 0.09 0.00 0.00 178.44 178.41 2wi5 h ILE 104 N -0.21 1.23 0.00 1.22 2.04 -1.12 0.11 117.51 120.79 2wi5 h ILE 104 Ca 0.13 -0.99 -0.66 0.00 1.00 0.00 0.00 64.86 64.35 2wi5 h ILE 104 Cb 0.41 0.97 0.01 0.00 -0.74 0.00 0.00 36.82 37.47 2wi5 h ILE 104 CO -0.35 0.34 2.85 0.59 0.00 0.00 0.00 178.15 181.57 2wi5 n ASN 105 N -4.22 3.90 -4.07 1.72 4.13 0.47 -4.60 115.26 112.59 2wi5 n ASN 105 Ca 0.02 -2.71 -0.36 0.00 1.68 0.00 0.00 54.58 53.20 2wi5 n ASN 105 Cb 0.30 -1.40 -0.02 0.00 -1.54 0.00 0.00 39.78 37.13 2wi5 n ASN 105 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 2wi5 n ASN 106 N 6.22 -2.15 -4.13 6.41 3.02 -1.24 -1.66 115.26 121.73 2wi5 n ASN 106 Ca 0.53 -1.20 -0.34 0.00 -0.03 0.00 0.00 54.58 53.53 2wi5 n ASN 106 Cb 0.36 -2.14 -0.05 0.00 -0.61 0.00 0.00 39.78 37.34 2wi5 n ASN 106 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2wi5 n LEU 107 N -4.68 -0.59 -0.01 3.41 4.32 0.40 -0.63 117.00 119.22 2wi5 n LEU 107 Ca -0.21 -1.18 -0.00 0.00 -0.02 0.00 0.00 56.01 54.60 2wi5 n LEU 107 Cb 0.63 -1.45 -0.00 0.00 -1.62 0.00 0.00 43.42 40.98 2wi5 n LEU 107 CO 0.77 0.55 -0.00 0.61 -1.22 0.00 0.00 177.39 178.10 2wi5 n GLY 108 N -2.29 0.40 3.91 -0.72 0.00 -0.39 -4.91 105.19 101.19 2wi5 n GLY 108 Ca -0.23 -0.02 -0.27 0.00 0.00 0.00 0.00 46.02 45.51 2wi5 n GLY 108 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2wi5 s THR 109 N -1.80 5.14 -0.53 2.61 -1.32 0.20 -4.99 115.64 114.94 2wi5 s THR 109 Ca 0.00 -0.74 -0.05 0.00 -1.21 0.00 0.00 61.69 59.69 2wi5 s THR 109 Cb 0.00 -3.63 -0.00 0.00 -1.51 0.00 0.00 72.50 67.36 2wi5 s THR 109 CO 0.00 -0.07 2.89 2.30 -2.21 0.00 0.00 174.62 177.54 2wi5 n ILE 110 N -0.41 3.57 -0.02 5.08 -5.35 -1.26 -4.62 119.36 116.36 2wi5 n ILE 110 Ca -0.07 -2.88 0.07 0.00 -0.27 0.00 0.00 62.75 59.60 2wi5 n ILE 110 Cb 0.54 -1.78 0.46 0.00 -1.74 0.00 0.00 39.64 37.11 2wi5 n ILE 110 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2wi5 h ALA 111 N 3.31 1.82 0.50 -1.28 0.00 -1.88 -0.64 119.26 121.09 2wi5 h ALA 111 Ca 0.42 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.28 2wi5 h ALA 111 Cb 0.80 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.46 2wi5 h ALA 111 CO 0.87 0.12 -0.24 -0.22 0.00 0.00 0.00 179.25 179.78 2wi5 h LYS 112 N 0.49 -0.65 0.00 0.00 3.64 -1.97 0.22 116.57 118.30 2wi5 h LYS 112 Ca 0.19 0.04 -0.06 0.00 -1.27 0.00 0.00 60.65 59.55 2wi5 h LYS 112 Cb 0.14 0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.10 2wi5 h LYS 112 CO -0.05 -0.43 -0.27 0.66 -2.27 0.00 0.00 179.45 177.10 2wi5 h SER 113 N -0.77 0.00 0.08 4.20 4.64 -1.95 -2.97 113.55 116.79 2wi5 h SER 113 Ca -0.07 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.25 2wi5 h SER 113 Cb 0.51 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.60 2wi5 h SER 113 CO 0.11 0.27 -0.04 1.23 -0.87 0.00 0.00 176.83 177.53 2wi5 h GLY 114 N 1.06 -0.12 1.60 -0.77 0.00 -1.14 -0.80 103.07 102.90 2wi5 h GLY 114 Ca -0.00 0.04 0.05 0.00 0.00 0.00 0.00 47.33 47.42 2wi5 h GLY 114 CO 0.03 -0.04 0.15 -0.84 0.00 0.00 0.00 176.54 175.85 2wi5 h THR 115 N -0.28 0.67 0.00 4.70 2.02 -0.45 0.61 112.91 120.17 2wi5 h THR 115 Ca -0.01 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.14 2wi5 h THR 115 Cb 0.24 0.89 -0.00 0.00 -1.74 0.00 0.00 68.15 67.53 2wi5 h THR 115 CO 0.02 0.00 -0.22 0.50 0.37 0.00 0.00 175.52 176.19 2wi5 h LYS 116 N 0.00 0.00 -0.70 6.66 3.64 -1.48 -0.80 116.57 123.89 2wi5 h LYS 116 Ca 0.08 0.00 0.13 0.00 -1.27 0.00 0.00 60.65 59.59 2wi5 h LYS 116 Cb 0.39 0.00 -0.13 0.00 -0.41 0.00 0.00 32.23 32.08 2wi5 h LYS 116 CO -0.00 0.48 -0.28 0.00 -2.27 0.00 0.00 179.45 177.38 2wi5 h ALA 117 N -0.58 0.20 0.19 5.00 0.00 -0.91 0.25 119.26 123.42 2wi5 h ALA 117 Ca -0.04 0.23 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 2wi5 h ALA 117 Cb 0.59 0.72 -0.00 0.00 0.00 0.00 0.00 17.79 19.09 2wi5 h ALA 117 CO -0.03 -0.56 -0.10 0.35 0.00 0.00 0.00 179.25 178.91 2wi5 h PHE 118 N -0.08 -0.27 0.00 0.00 3.57 0.12 -1.01 116.94 119.27 2wi5 h PHE 118 Ca 0.30 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.78 2wi5 h PHE 118 Cb 0.56 0.09 -0.00 0.00 2.79 0.00 0.00 35.95 39.39 2wi5 h PHE 118 CO -0.64 -0.17 -0.04 0.52 -2.23 0.00 0.00 178.31 175.75 2wi5 h MET 119 N -0.28 0.00 0.04 1.11 2.86 -0.49 0.14 114.93 118.31 2wi5 h MET 119 Ca -0.02 0.00 -0.23 0.00 -2.06 0.00 0.00 59.70 57.39 2wi5 h MET 119 Cb 0.22 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.88 2wi5 h MET 119 CO 0.03 0.04 -1.01 0.93 1.06 0.00 0.00 176.91 177.96 2wi5 h GLU 120 N 0.00 0.28 -0.19 1.72 5.08 -0.11 -2.44 114.58 118.91 2wi5 h GLU 120 Ca -0.00 -0.35 -0.12 0.00 -1.00 0.00 0.00 59.36 57.88 2wi5 h GLU 120 Cb 0.16 0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.51 2wi5 h GLU 120 CO 0.01 1.08 -0.41 0.00 -1.00 0.00 0.00 179.01 178.69 2wi5 h ALA 121 N 0.78 0.94 -0.67 3.43 0.00 0.52 -2.58 119.26 121.69 2wi5 h ALA 121 Ca -0.08 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.40 2wi5 h ALA 121 Cb 1.68 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.37 2wi5 h ALA 121 CO 0.16 0.63 0.00 1.28 0.00 0.00 0.00 179.25 181.32 2wi5 n LEU 122 N -4.02 0.07 -0.08 0.00 4.77 -0.04 -0.86 117.00 116.85 2wi5 n LEU 122 Ca -0.02 0.83 -0.01 0.00 -0.03 0.00 0.00 56.01 56.78 2wi5 n LEU 122 Cb 0.51 -0.39 -0.01 0.00 -2.33 0.00 0.00 43.42 41.20 2wi5 n LEU 122 CO 0.44 -0.39 0.09 0.00 -1.33 0.00 0.00 177.39 176.20 2wi5 n GLN 123 N -1.67 -0.07 -0.09 3.23 1.13 -0.92 0.23 117.38 119.22 2wi5 n GLN 123 Ca 0.00 0.28 -0.01 0.00 -1.94 0.00 0.00 57.00 55.33 2wi5 n GLN 123 Cb 0.00 -0.41 0.02 0.00 0.11 0.00 0.00 30.24 29.95 2wi5 n GLN 123 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2wi5 n ALA 124 N -3.87 2.72 -1.20 -1.58 0.00 -0.97 -4.84 120.51 110.76 2wi5 n ALA 124 Ca 0.01 -0.21 0.00 0.00 0.00 0.00 0.00 53.44 53.24 2wi5 n ALA 124 Cb 0.06 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 18.47 2wi5 n ALA 124 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wi5 n GLY 125 N 0.32 1.05 3.95 0.00 0.00 0.64 -5.01 105.19 106.13 2wi5 n GLY 125 Ca 0.04 -0.41 -0.19 0.00 0.00 0.00 0.00 46.02 45.46 2wi5 n GLY 125 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wi5 s ALA 126 N -2.29 4.20 0.41 4.61 0.00 -0.04 -5.00 121.76 123.66 2wi5 s ALA 126 Ca 0.00 -1.61 0.03 0.00 0.00 0.00 0.00 51.96 50.39 2wi5 s ALA 126 Cb 0.00 -1.47 -0.04 0.00 0.00 0.00 0.00 23.12 21.61 2wi5 s ALA 126 CO 0.00 -0.11 0.07 0.16 0.00 0.00 0.00 175.76 175.88 2wi5 s ASP 127 N -4.17 3.12 0.58 0.00 -4.77 -1.26 -4.59 116.67 105.57 2wi5 s ASP 127 Ca 0.47 -1.56 0.28 0.00 -3.30 0.00 0.00 52.55 48.43 2wi5 s ASP 127 Cb -0.08 0.27 1.57 0.00 -1.09 0.00 0.00 42.92 43.59 2wi5 s ASP 127 CO 0.30 -0.78 2.05 0.40 0.70 0.00 0.00 175.17 177.84 2wi5 h ILE 128 N 1.76 0.51 0.00 2.11 2.04 -2.00 -1.70 117.51 120.23 2wi5 h ILE 128 Ca -0.40 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.46 2wi5 h ILE 128 Cb 1.27 0.79 0.00 0.00 -0.74 0.00 0.00 36.82 38.14 2wi5 h ILE 128 CO 0.67 0.00 0.00 0.77 0.00 0.00 0.00 178.15 179.59 2wi5 h SER 129 N 0.00 0.00 0.01 1.72 4.64 -1.95 -1.74 113.55 116.23 2wi5 h SER 129 Ca 0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 2wi5 h SER 129 Cb 0.68 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.77 2wi5 h SER 129 CO -0.00 0.00 -0.02 0.23 -0.87 0.00 0.00 176.83 176.16 2wi5 n MET 130 N -2.94 1.63 -0.32 4.77 2.81 -0.64 -4.36 117.12 118.08 2wi5 n MET 130 Ca -0.02 -0.98 0.19 0.00 -1.81 0.00 0.00 57.70 55.07 2wi5 n MET 130 Cb 0.11 -1.48 0.39 0.00 -0.71 0.00 0.00 33.22 31.53 2wi5 n MET 130 CO 0.00 0.00 0.00 0.97 1.51 0.00 0.00 175.97 178.45 2wi5 h ILE 131 N 2.40 0.36 -0.74 2.02 2.10 -1.50 0.25 117.51 122.41 2wi5 h ILE 131 Ca 0.00 -0.12 0.06 0.00 1.08 0.00 0.00 64.86 65.88 2wi5 h ILE 131 Cb 0.53 -0.01 -0.04 0.00 -1.09 0.00 0.00 36.82 36.21 2wi5 h ILE 131 CO 0.00 0.06 0.48 1.23 -1.08 0.00 0.00 178.15 178.85 2wi5 h GLY 132 N 0.34 1.00 0.82 8.18 0.00 -1.83 -2.15 103.07 109.42 2wi5 h GLY 132 Ca 0.65 -0.32 0.05 0.00 0.00 0.00 0.00 47.33 47.70 2wi5 h GLY 132 CO -0.59 0.25 0.54 1.46 0.00 0.00 0.00 176.54 178.20 2wi5 h GLN 133 N 0.81 0.00 -0.39 4.80 4.20 -0.84 -2.57 115.11 121.12 2wi5 h GLN 133 Ca 0.31 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.02 2wi5 h GLN 133 Cb 0.20 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.98 2wi5 h GLN 133 CO -0.10 0.00 0.00 1.19 -0.67 0.00 0.00 178.83 179.25 2wi5 n PHE 134 N -3.01 0.57 -0.69 2.96 3.72 -0.81 -4.97 117.46 115.24 2wi5 n PHE 134 Ca 0.02 -0.53 0.00 0.00 -0.05 0.00 0.00 57.45 56.89 2wi5 n PHE 134 Cb 0.63 -0.05 0.00 0.00 -0.94 0.00 0.00 39.48 39.12 2wi5 n PHE 134 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2wi5 n GLY 135 N 0.59 0.64 0.76 1.37 0.00 -0.97 -4.46 105.19 103.13 2wi5 n GLY 135 Ca 0.14 -0.12 0.06 0.00 0.00 0.00 0.00 46.02 46.09 2wi5 n GLY 135 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2wi5 n VAL 136 N -2.69 1.54 0.28 1.61 0.24 -1.25 -4.66 118.33 113.40 2wi5 n VAL 136 Ca 0.00 -2.45 0.13 0.00 -2.04 0.00 0.00 64.34 59.98 2wi5 n VAL 136 Cb 0.00 0.10 0.84 0.00 -1.47 0.00 0.00 33.84 33.30 2wi5 n VAL 136 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 2wi5 h GLY 137 N 0.85 0.00 -0.14 7.63 0.00 -1.81 -2.59 103.07 107.00 2wi5 h GLY 137 Ca -0.06 0.00 0.21 0.00 0.00 0.00 0.00 47.33 47.48 2wi5 h GLY 137 CO 0.02 0.00 0.37 -2.75 0.00 0.00 0.00 176.54 174.19 2wi5 h PHE 138 N 0.00 0.62 0.00 5.60 3.57 -1.86 0.11 116.94 124.99 2wi5 h PHE 138 Ca 0.00 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.55 2wi5 h PHE 138 Cb 0.03 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 38.63 2wi5 h PHE 138 CO 0.00 -0.03 0.00 0.66 -2.23 0.00 0.00 178.31 176.71 2wi5 n TYR 139 N -5.04 0.00 0.78 0.41 4.01 -0.98 -2.26 117.16 114.09 2wi5 n TYR 139 Ca 0.21 0.00 0.05 0.00 -0.16 0.00 0.00 57.90 58.00 2wi5 n TYR 139 Cb 0.61 -0.32 0.32 0.00 -0.31 0.00 0.00 39.34 39.63 2wi5 n TYR 139 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 2wi5 n SER 140 N -1.32 0.00 0.13 7.72 3.41 0.40 -2.16 113.62 121.79 2wi5 n SER 140 Ca 0.09 -0.45 -0.02 0.00 -0.26 0.00 0.00 58.87 58.23 2wi5 n SER 140 Cb 0.17 0.00 0.18 0.00 -0.26 0.00 0.00 64.21 64.31 2wi5 n SER 140 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2wi5 h ALA 141 N 2.63 1.00 0.00 7.33 0.00 -1.65 -2.77 119.26 125.80 2wi5 h ALA 141 Ca 0.00 -0.53 0.00 0.00 0.00 0.00 0.00 54.91 54.38 2wi5 h ALA 141 Cb 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.70 2wi5 h ALA 141 CO 0.00 0.72 0.00 0.66 0.00 0.00 0.00 179.25 180.63 2wi5 n TYR 142 N -3.86 0.00 0.01 0.00 4.01 -0.92 -0.53 117.16 115.86 2wi5 n TYR 142 Ca -0.02 0.00 0.02 0.00 -0.16 0.00 0.00 57.90 57.74 2wi5 n TYR 142 Cb 0.59 -0.36 0.36 0.00 -0.31 0.00 0.00 39.34 39.62 2wi5 n TYR 142 CO 0.00 0.00 0.00 -0.07 -0.46 0.00 0.00 176.86 176.33 2wi5 h LEU 143 N 0.00 0.46 0.00 7.72 3.38 -1.68 -3.38 115.31 121.81 2wi5 h LEU 143 Ca 0.00 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.92 2wi5 h LEU 143 Cb 0.15 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.78 2wi5 h LEU 143 CO 0.00 0.45 -0.84 1.33 0.09 0.00 0.00 178.44 179.47 2wi5 n VAL 144 N -4.37 0.00 -4.44 1.22 0.24 -0.64 -5.00 118.33 105.35 2wi5 n VAL 144 Ca 0.02 -0.12 -0.34 0.00 -2.04 0.00 0.00 64.34 61.86 2wi5 n VAL 144 Cb 0.16 0.58 -0.11 0.00 -1.47 0.00 0.00 33.84 33.01 2wi5 n VAL 144 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2wi5 s ALA 145 N -1.88 3.08 -0.25 2.33 0.00 0.31 0.04 121.76 125.39 2wi5 s ALA 145 Ca -0.00 -0.83 0.19 0.00 0.00 0.00 0.00 51.96 51.31 2wi5 s ALA 145 Cb 0.01 -1.46 0.12 0.00 0.00 0.00 0.00 23.12 21.78 2wi5 s ALA 145 CO 0.05 0.40 1.37 1.05 0.00 0.00 0.00 175.76 178.63 2wi5 h GLU 146 N 5.93 0.00 -3.18 0.00 4.11 -1.27 -3.40 114.58 116.78 2wi5 h GLU 146 Ca -0.41 0.00 -0.19 0.00 0.07 0.00 0.00 59.36 58.84 2wi5 h GLU 146 Cb 1.19 0.00 -0.28 0.00 0.50 0.00 0.00 28.75 30.16 2wi5 h GLU 146 CO 0.58 0.26 -0.49 0.21 0.07 0.00 0.00 179.01 179.64 2wi5 s LYS 147 N -3.08 0.22 -0.07 1.06 2.20 -1.20 -4.36 119.74 114.50 2wi5 s LYS 147 Ca 0.04 0.36 0.03 0.00 -0.36 0.00 0.00 55.97 56.03 2wi5 s LYS 147 Cb 0.07 0.03 -0.02 0.00 -1.51 0.00 0.00 37.83 36.40 2wi5 s LYS 147 CO 0.74 -0.08 -0.16 0.08 -0.36 0.00 0.00 175.35 175.57 2wi5 s VAL 148 N 0.51 2.86 -0.08 4.02 1.01 -0.24 -0.79 120.40 127.70 2wi5 s VAL 148 Ca -0.03 -0.77 0.05 0.00 0.00 0.00 0.00 61.98 61.22 2wi5 s VAL 148 Cb -0.05 -2.13 -0.00 0.00 0.00 0.00 0.00 36.38 34.19 2wi5 s VAL 148 CO -0.03 0.57 -0.24 -0.89 0.00 0.00 0.00 175.10 174.51 2wi5 s THR 149 N -0.30 2.00 -0.25 3.92 2.01 -0.21 -1.84 115.64 120.98 2wi5 s THR 149 Ca 0.02 -1.01 0.01 0.00 0.31 0.00 0.00 61.69 61.02 2wi5 s THR 149 Cb -0.13 -1.71 0.04 0.00 0.01 0.00 0.00 72.50 70.71 2wi5 s THR 149 CO 0.03 0.55 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.72 2wi5 s VAL 150 N 0.09 2.41 -0.24 3.82 1.01 -0.12 0.13 120.40 127.50 2wi5 s VAL 150 Ca -0.11 -1.35 -0.10 0.00 0.00 0.00 0.00 61.98 60.42 2wi5 s VAL 150 Cb -0.16 -2.30 -0.05 0.00 0.00 0.00 0.00 36.38 33.87 2wi5 s VAL 150 CO 0.06 0.11 0.15 -0.63 0.00 0.00 0.00 175.10 174.78 2wi5 s ILE 151 N 1.20 5.17 0.02 2.22 -1.09 -0.21 -0.86 121.20 127.66 2wi5 s ILE 151 Ca -0.04 0.12 0.03 0.00 -2.23 0.00 0.00 60.65 58.52 2wi5 s ILE 151 Cb -0.18 -3.42 -0.02 0.00 -1.58 0.00 0.00 42.46 37.27 2wi5 s ILE 151 CO -0.06 0.34 -0.08 0.28 -1.23 0.00 0.00 174.94 174.19 2wi5 s THR 152 N 1.18 0.61 -0.07 2.92 -1.32 -0.76 -0.46 115.64 117.74 2wi5 s THR 152 Ca 0.07 -0.73 -0.02 0.00 -1.21 0.00 0.00 61.69 59.80 2wi5 s THR 152 Cb -0.14 -0.59 0.03 0.00 -1.51 0.00 0.00 72.50 70.29 2wi5 s THR 152 CO 0.05 -0.10 0.03 -0.75 -2.21 0.00 0.00 174.62 171.63 2wi5 s LYS 153 N -0.91 0.36 0.02 7.08 2.47 0.05 -2.13 119.74 126.68 2wi5 s LYS 153 Ca -0.03 0.17 0.03 0.00 -1.56 0.00 0.00 55.97 54.59 2wi5 s LYS 153 Cb -0.06 -0.89 -0.04 0.00 -1.46 0.00 0.00 37.83 35.38 2wi5 s LYS 153 CO 0.00 -0.34 -0.03 -1.58 0.16 0.00 0.00 175.35 173.57 2wi5 s HIS 154 N 2.04 2.97 0.33 4.03 5.65 -1.22 -1.93 115.29 127.15 2wi5 s HIS 154 Ca 0.05 0.00 0.11 0.00 0.25 0.00 0.00 55.06 55.47 2wi5 s HIS 154 Cb -0.12 -1.61 0.93 0.00 -1.18 0.00 0.00 32.58 30.59 2wi5 s HIS 154 CO -0.05 0.43 1.73 -0.91 -0.65 0.00 0.00 174.74 175.29 2wi5 h ASN 155 N 4.22 0.64 0.00 9.88 2.35 -1.90 -1.13 115.58 129.64 2wi5 h ASN 155 Ca -0.48 0.14 0.00 0.00 -0.55 0.00 0.00 56.30 55.40 2wi5 h ASN 155 Cb 1.17 0.04 0.00 0.00 0.05 0.00 0.00 38.32 39.58 2wi5 h ASN 155 CO 0.56 0.08 0.00 0.47 -1.65 0.00 0.00 177.43 176.89 2wi5 n ASP 156 N -4.88 0.00 -2.99 5.81 8.00 -1.26 -4.91 116.55 116.32 2wi5 n ASP 156 Ca 0.27 -0.95 -0.12 0.00 0.71 0.00 0.00 54.79 54.70 2wi5 n ASP 156 Cb 0.78 0.00 -0.01 0.00 -0.02 0.00 0.00 41.12 41.88 2wi5 n ASP 156 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2wi5 s ASP 157 N -1.68 0.56 0.62 -2.24 -1.08 -0.43 -5.10 116.67 107.32 2wi5 s ASP 157 Ca 0.15 -1.38 -0.01 0.00 -0.52 0.00 0.00 52.55 50.79 2wi5 s ASP 157 Cb 0.07 0.77 0.08 0.00 -1.46 0.00 0.00 42.92 42.38 2wi5 s ASP 157 CO 0.12 -1.52 0.52 -0.62 0.52 0.00 0.00 175.17 174.18 2wi5 n GLU 158 N -0.57 0.13 -3.04 4.34 -0.58 -1.26 -4.57 120.64 115.09 2wi5 n GLU 158 Ca -0.04 -1.32 -0.41 0.00 -0.42 0.00 0.00 57.16 54.98 2wi5 n GLU 158 Cb 0.61 -0.38 -0.05 0.00 -0.57 0.00 0.00 31.44 31.04 2wi5 n GLU 158 CO 0.00 0.00 0.00 -1.14 -0.48 0.00 0.00 177.13 175.51 2wi5 s GLN 159 N -3.84 4.19 0.18 3.49 0.74 -1.26 -4.49 119.66 118.67 2wi5 s GLN 159 Ca 0.34 0.72 0.08 0.00 0.05 0.00 0.00 55.36 56.55 2wi5 s GLN 159 Cb -0.02 -3.61 -0.04 0.00 1.10 0.00 0.00 33.01 30.44 2wi5 s GLN 159 CO 0.23 -0.35 -0.07 0.71 -0.55 0.00 0.00 175.29 175.26 2wi5 s TYR 160 N 2.27 2.70 -0.20 1.67 2.02 -0.91 0.94 117.35 125.84 2wi5 s TYR 160 Ca 0.31 -0.20 -0.05 0.00 -0.37 0.00 0.00 57.07 56.76 2wi5 s TYR 160 Cb -0.16 -1.31 -0.02 0.00 -0.40 0.00 0.00 41.96 40.07 2wi5 s TYR 160 CO 0.10 0.52 -0.00 0.00 -1.57 0.00 0.00 175.55 174.59 2wi5 s ALA 161 N -1.73 3.01 0.00 3.71 0.00 0.53 -1.83 121.76 125.44 2wi5 s ALA 161 Ca 0.26 -1.02 -0.02 0.00 0.00 0.00 0.00 51.96 51.18 2wi5 s ALA 161 Cb -0.09 -1.77 -0.04 0.00 0.00 0.00 0.00 23.12 21.22 2wi5 s ALA 161 CO 0.16 -0.20 0.17 -0.46 0.00 0.00 0.00 175.76 175.43 2wi5 s TRP 162 N 1.08 3.50 -0.06 0.00 -0.00 -0.04 -1.41 118.94 122.00 2wi5 s TRP 162 Ca 0.02 0.32 -0.23 0.00 -0.00 0.00 0.00 56.10 56.20 2wi5 s TRP 162 Cb -0.14 -1.80 0.05 0.00 -0.00 0.00 0.00 33.47 31.57 2wi5 s TRP 162 CO 0.01 0.62 0.53 -2.00 -0.00 0.00 0.00 176.95 176.12 2wi5 s GLU 163 N -1.97 0.86 -0.28 5.86 2.12 0.20 -0.95 118.70 124.55 2wi5 s GLU 163 Ca 0.27 0.19 -0.21 0.00 0.36 0.00 0.00 54.97 55.58 2wi5 s GLU 163 Cb -0.13 0.40 0.08 0.00 0.26 0.00 0.00 34.13 34.74 2wi5 s GLU 163 CO 0.19 -0.24 0.73 0.45 -0.54 0.00 0.00 175.26 175.85 2wi5 s SER 164 N -0.99 -0.82 -0.37 -1.70 0.15 -0.76 -1.14 113.70 108.06 2wi5 s SER 164 Ca -0.10 1.43 0.06 0.00 0.70 0.00 0.00 55.95 58.04 2wi5 s SER 164 Cb -0.02 1.40 0.51 0.00 -1.71 0.00 0.00 66.02 66.20 2wi5 s SER 164 CO 0.06 -0.24 1.57 -1.20 1.20 0.00 0.00 173.24 174.64 2wi5 n SER 165 N 3.44 3.83 0.00 5.45 7.64 -1.26 -1.08 113.62 131.64 2wi5 n SER 165 Ca -0.17 -3.77 0.00 0.00 1.01 0.00 0.00 58.87 55.95 2wi5 n SER 165 Cb 0.57 -0.67 0.00 0.00 -1.01 0.00 0.00 64.21 63.10 2wi5 n SER 165 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2wi5 n ALA 166 N -1.03 0.00 -0.96 -0.43 0.00 -1.26 -4.91 120.51 111.91 2wi5 n ALA 166 Ca 0.43 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.87 2wi5 n ALA 166 Cb 1.06 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.51 2wi5 n ALA 166 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wi5 n GLY 167 N 0.00 0.25 0.27 0.00 0.00 -1.26 -3.56 105.19 100.89 2wi5 n GLY 167 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2wi5 n GLY 167 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wi5 n GLY 168 N -0.92 0.30 3.11 -0.02 0.00 -1.26 -5.05 105.19 101.34 2wi5 n GLY 168 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 2wi5 n GLY 168 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2wi5 s SER 169 N -2.26 0.81 0.13 1.61 1.04 -1.23 -1.08 113.70 112.71 2wi5 s SER 169 Ca 0.00 -0.90 0.05 0.00 0.48 0.00 0.00 55.95 55.57 2wi5 s SER 169 Cb 0.00 0.12 -0.04 0.00 0.10 0.00 0.00 66.02 66.20 2wi5 s SER 169 CO 0.00 -0.46 -0.11 0.72 0.98 0.00 0.00 173.24 174.36 2wi5 s PHE 170 N -3.25 1.25 0.20 5.02 -0.12 0.04 -4.51 117.98 116.61 2wi5 s PHE 170 Ca 0.05 -0.67 0.10 0.00 -0.05 0.00 0.00 56.93 56.36 2wi5 s PHE 170 Cb 0.03 -0.65 -0.04 0.00 -0.63 0.00 0.00 43.02 41.72 2wi5 s PHE 170 CO -0.06 0.08 -0.14 0.95 -0.05 0.00 0.00 175.22 176.01 2wi5 s THR 171 N -2.75 2.92 -0.08 -4.49 -4.23 -0.30 0.72 115.64 107.44 2wi5 s THR 171 Ca 0.12 -1.83 0.02 0.00 -1.18 0.00 0.00 61.69 58.81 2wi5 s THR 171 Cb -0.01 -2.45 0.02 0.00 1.34 0.00 0.00 72.50 71.40 2wi5 s THR 171 CO 0.01 -0.15 -0.12 -0.69 -0.54 0.00 0.00 174.62 173.14 2wi5 s VAL 172 N -1.78 1.20 0.26 2.29 1.01 -0.43 -0.62 120.40 122.32 2wi5 s VAL 172 Ca 0.24 -0.48 0.09 0.00 0.00 0.00 0.00 61.98 61.83 2wi5 s VAL 172 Cb -0.08 -1.12 -0.05 0.00 0.00 0.00 0.00 36.38 35.13 2wi5 s VAL 172 CO 0.14 0.38 -0.15 0.00 0.00 0.00 0.00 175.10 175.47 2wi5 s ARG 173 N 0.93 1.54 0.48 2.72 1.04 -0.50 -1.82 118.95 123.34 2wi5 s ARG 173 Ca -0.09 -1.72 -0.22 0.00 -1.04 0.00 0.00 55.73 52.66 2wi5 s ARG 173 Cb -0.15 -1.43 -0.07 0.00 -2.04 0.00 0.00 34.95 31.26 2wi5 s ARG 173 CO 0.00 0.21 1.14 0.95 -0.04 0.00 0.00 175.30 177.56 2wi5 s THR 174 N -2.77 3.23 -0.11 4.99 -4.23 -1.26 -0.35 115.64 115.14 2wi5 s THR 174 Ca 0.27 0.87 -0.00 0.00 -1.18 0.00 0.00 61.69 61.65 2wi5 s THR 174 Cb -0.01 -3.42 -0.02 0.00 1.34 0.00 0.00 72.50 70.39 2wi5 s THR 174 CO 0.12 -0.06 -0.09 -0.62 -0.54 0.00 0.00 174.62 173.43 2wi5 s ASP 175 N -1.52 4.39 0.08 3.99 2.15 0.27 -4.64 116.67 121.39 2wi5 s ASP 175 Ca 0.65 -0.18 0.03 0.00 0.43 0.00 0.00 52.55 53.49 2wi5 s ASP 175 Cb -0.26 -1.46 -0.03 0.00 -0.30 0.00 0.00 42.92 40.87 2wi5 s ASP 175 CO 0.31 0.24 -0.10 0.42 -0.17 0.00 0.00 175.17 175.87 2wi5 s THR 176 N -0.06 0.84 0.00 1.71 -4.23 -1.26 -4.64 115.64 107.99 2wi5 s THR 176 Ca -0.01 -1.48 0.00 0.00 -1.18 0.00 0.00 61.69 59.02 2wi5 s THR 176 Cb -0.14 -1.16 0.00 0.00 1.34 0.00 0.00 72.50 72.54 2wi5 s THR 176 CO 0.03 -0.50 0.00 0.61 -0.54 0.00 0.00 174.62 174.23 2wi5 n GLY 177 N 0.83 2.63 2.47 3.99 0.00 -1.26 -4.94 105.19 108.92 2wi5 n GLY 177 Ca -0.18 -0.83 -0.26 0.00 0.00 0.00 0.00 46.02 44.74 2wi5 n GLY 177 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2wi5 n GLU 178 N 0.00 1.59 -1.57 1.61 2.13 -1.26 -5.10 120.64 118.03 2wi5 n GLU 178 Ca 0.00 -4.06 -0.44 0.00 0.66 0.00 0.00 57.16 53.32 2wi5 n GLU 178 Cb 0.00 -1.92 -0.01 0.00 0.27 0.00 0.00 31.44 29.77 2wi5 n GLU 178 CO 0.00 0.00 0.00 -2.30 -0.41 0.00 0.00 177.13 174.42 2wi5 n PRO 179 N 1.53 1.24 -0.01 5.31 -0.02 -1.26 -4.94 135.00 136.85 2wi5 n PRO 179 Ca 0.26 0.44 0.07 0.00 -2.02 0.00 0.00 63.50 62.24 2wi5 n PRO 179 Cb 0.44 -1.80 -0.10 0.00 -0.02 0.00 0.00 33.50 32.02 2wi5 n PRO 179 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2wi5 n MET 180 N 0.68 0.85 0.00 -0.52 0.00 -1.26 -5.02 117.12 111.85 2wi5 n MET 180 Ca 0.10 -0.10 0.00 0.00 0.00 0.00 0.00 57.70 57.70 2wi5 n MET 180 Cb 0.33 -1.29 0.00 0.00 0.00 0.00 0.00 33.22 32.26 2wi5 n MET 180 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2wi5 n GLY 181 N 1.64 1.87 3.64 3.17 0.00 -1.26 -4.86 105.19 109.39 2wi5 n GLY 181 Ca -0.02 -0.62 -0.08 0.00 0.00 0.00 0.00 46.02 45.31 2wi5 n GLY 181 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2wi5 s ARG 182 N 0.00 0.39 0.00 1.61 3.52 -1.25 -4.84 118.95 118.38 2wi5 s ARG 182 Ca 0.00 0.45 0.00 0.00 -0.13 0.00 0.00 55.73 56.05 2wi5 s ARG 182 Cb 0.00 0.19 0.00 0.00 -1.56 0.00 0.00 34.95 33.58 2wi5 s ARG 182 CO 0.00 -0.05 0.00 0.41 -0.81 0.00 0.00 175.30 174.85 2wi5 n GLY 183 N 2.03 0.66 2.89 8.12 0.00 -0.81 -4.44 105.19 113.63 2wi5 n GLY 183 Ca -0.12 -2.17 -0.13 0.00 0.00 0.00 0.00 46.02 43.60 2wi5 n GLY 183 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2wi5 s THR 184 N -0.84 -0.02 -0.14 2.61 2.01 -0.91 -0.77 115.64 117.58 2wi5 s THR 184 Ca 0.00 0.07 0.01 0.00 0.31 0.00 0.00 61.69 62.08 2wi5 s THR 184 Cb 0.00 -0.09 -0.00 0.00 0.01 0.00 0.00 72.50 72.41 2wi5 s THR 184 CO 0.00 0.03 -0.16 -0.54 -0.69 0.00 0.00 174.62 173.26 2wi5 s LYS 185 N 0.41 3.23 -0.34 4.92 1.02 0.39 -1.11 119.74 128.25 2wi5 s LYS 185 Ca -0.03 -0.76 -0.08 0.00 0.02 0.00 0.00 55.97 55.12 2wi5 s LYS 185 Cb -0.05 -2.57 0.03 0.00 -0.52 0.00 0.00 37.83 34.73 2wi5 s LYS 185 CO -0.01 0.09 0.13 0.08 -0.92 0.00 0.00 175.35 174.72 2wi5 s VAL 186 N 0.61 4.03 -0.28 3.17 1.01 0.26 -1.04 120.40 128.17 2wi5 s VAL 186 Ca -0.09 -1.01 -0.14 0.00 0.00 0.00 0.00 61.98 60.74 2wi5 s VAL 186 Cb -0.16 -3.25 -0.04 0.00 0.00 0.00 0.00 36.38 32.93 2wi5 s VAL 186 CO 0.03 -0.17 0.34 -0.63 0.00 0.00 0.00 175.10 174.67 2wi5 s ILE 187 N 1.46 5.20 -0.38 2.22 1.01 0.35 -1.05 121.20 130.01 2wi5 s ILE 187 Ca -0.00 0.41 -0.14 0.00 0.00 0.00 0.00 60.65 60.92 2wi5 s ILE 187 Cb -0.19 -3.69 0.00 0.00 0.01 0.00 0.00 42.46 38.59 2wi5 s ILE 187 CO 0.04 0.13 0.28 -0.76 0.00 0.00 0.00 174.94 174.63 2wi5 s LEU 188 N 2.01 4.83 -0.52 2.97 1.43 -0.32 -1.04 118.68 128.04 2wi5 s LEU 188 Ca 0.13 -0.67 -0.22 0.00 -1.03 0.00 0.00 54.13 52.34 2wi5 s LEU 188 Cb -0.16 -2.16 0.04 0.00 0.03 0.00 0.00 46.19 43.95 2wi5 s LEU 188 CO 0.10 -0.35 0.80 -1.00 0.23 0.00 0.00 176.35 176.13 2wi5 s HIS 189 N 1.71 2.92 0.35 0.29 3.76 0.03 -2.00 115.29 122.36 2wi5 s HIS 189 Ca 0.06 -0.18 -0.27 0.00 -0.15 0.00 0.00 55.06 54.51 2wi5 s HIS 189 Cb -0.18 -3.80 -0.09 0.00 1.11 0.00 0.00 32.58 29.61 2wi5 s HIS 189 CO 0.10 -1.17 1.23 -0.51 -0.85 0.00 0.00 174.74 173.54 2wi5 s LEU 190 N 3.35 4.35 0.59 0.89 1.43 -0.73 -0.89 118.68 127.68 2wi5 s LEU 190 Ca 0.24 2.52 -0.18 0.00 -1.03 0.00 0.00 54.13 55.68 2wi5 s LEU 190 Cb -0.15 -3.78 -0.06 0.00 0.03 0.00 0.00 46.19 42.23 2wi5 s LEU 190 CO 0.17 -0.56 0.83 0.29 0.23 0.00 0.00 176.35 177.32 2wi5 n LYS 191 N 0.56 0.77 0.21 1.70 5.02 0.11 -4.60 118.16 121.93 2wi5 n LYS 191 Ca 0.02 0.30 0.15 0.00 -2.02 0.00 0.00 58.31 56.75 2wi5 n LYS 191 Cb 0.44 -2.03 0.54 0.00 -0.02 0.00 0.00 35.03 33.96 2wi5 n LYS 191 CO 0.00 0.00 0.00 1.05 -0.52 0.00 0.00 177.40 177.93 2wi5 h GLU 192 N 0.40 0.00 -0.64 1.97 4.11 -1.95 -1.23 114.58 117.24 2wi5 h GLU 192 Ca -0.48 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.95 2wi5 h GLU 192 Cb 1.38 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.63 2wi5 h GLU 192 CO 0.50 0.00 0.00 -0.40 0.07 0.00 0.00 179.01 179.18 2wi5 n ASP 193 N -2.73 5.01 -0.34 3.06 5.68 -1.26 -4.32 116.55 121.65 2wi5 n ASP 193 Ca 0.02 -2.56 0.08 0.00 -0.50 0.00 0.00 54.79 51.83 2wi5 n ASP 193 Cb 0.32 -0.61 0.17 0.00 -1.14 0.00 0.00 41.12 39.86 2wi5 n ASP 193 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2wi5 n GLN 194 N 1.02 1.49 0.00 0.11 1.13 -0.47 -4.73 117.38 115.94 2wi5 n GLN 194 Ca 0.26 -2.87 0.10 0.00 -1.94 0.00 0.00 57.00 52.56 2wi5 n GLN 194 Cb 0.97 -1.57 0.61 0.00 0.11 0.00 0.00 30.24 30.35 2wi5 n GLN 194 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 2wi5 n THR 195 N -1.27 0.02 0.20 5.09 -2.24 -1.25 -2.92 114.28 111.91 2wi5 n THR 195 Ca 0.18 0.01 0.16 0.00 -2.27 0.00 0.00 64.05 62.13 2wi5 n THR 195 Cb 0.69 -0.68 0.80 0.00 -2.10 0.00 0.00 70.33 69.04 2wi5 n THR 195 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 2wi5 h GLU 196 N 0.00 0.00 -0.00 -0.78 4.11 -1.95 -2.70 114.58 113.26 2wi5 h GLU 196 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2wi5 h GLU 196 Cb 0.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.26 2wi5 h GLU 196 CO 0.00 0.00 -0.04 0.66 0.07 0.00 0.00 179.01 179.70 2wi5 n TYR 197 N -3.97 0.00 1.29 2.06 4.01 -1.15 -1.95 117.16 117.45 2wi5 n TYR 197 Ca 0.01 0.00 0.14 0.00 -0.16 0.00 0.00 57.90 57.89 2wi5 n TYR 197 Cb 0.30 -0.11 0.62 0.00 -0.31 0.00 0.00 39.34 39.83 2wi5 n TYR 197 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 2wi5 n LEU 198 N -0.84 0.25 -4.70 7.72 4.77 -1.02 -4.75 117.00 118.42 2wi5 n LEU 198 Ca 0.18 0.18 -0.39 0.00 -0.03 0.00 0.00 56.01 55.95 2wi5 n LEU 198 Cb 0.23 -0.28 -0.05 0.00 -2.33 0.00 0.00 43.42 40.98 2wi5 n LEU 198 CO 0.21 0.05 0.33 -1.61 -1.33 0.00 0.00 177.39 175.04 2wi5 s GLU 199 N -2.66 4.34 0.15 3.23 0.41 -0.82 -4.86 118.70 118.49 2wi5 s GLU 199 Ca 0.24 0.68 -0.17 0.00 -0.41 0.00 0.00 54.97 55.31 2wi5 s GLU 199 Cb 0.20 -3.49 0.06 0.00 -1.78 0.00 0.00 34.13 29.12 2wi5 s GLU 199 CO 0.51 -0.01 1.73 1.49 -0.49 0.00 0.00 175.26 178.49 2wi5 h GLU 200 N 6.98 0.19 -0.57 1.61 4.81 -1.92 0.47 114.58 126.15 2wi5 h GLU 200 Ca -0.38 -0.01 0.06 0.00 -0.13 0.00 0.00 59.36 58.89 2wi5 h GLU 200 Cb 1.17 -0.04 -0.05 0.00 0.63 0.00 0.00 28.75 30.46 2wi5 h GLU 200 CO 0.76 0.13 0.28 0.00 -0.73 0.00 0.00 179.01 179.45 2wi5 h ARG 201 N 0.20 0.52 -0.43 1.92 3.08 -1.94 0.15 114.38 117.88 2wi5 h ARG 201 Ca 0.16 -0.03 -0.04 0.00 0.07 0.00 0.00 59.98 60.14 2wi5 h ARG 201 Cb 0.17 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.09 2wi5 h ARG 201 CO -0.21 0.35 0.11 -0.09 -1.07 0.00 0.00 179.97 179.06 2wi5 h ARG 202 N 0.54 0.68 -0.26 0.04 9.65 -1.24 -1.81 114.38 121.98 2wi5 h ARG 202 Ca 0.26 -0.16 -0.06 0.00 -1.10 0.00 0.00 59.98 58.91 2wi5 h ARG 202 Cb 0.18 -0.09 -0.01 0.00 -1.39 0.00 0.00 29.97 28.66 2wi5 h ARG 202 CO -0.18 0.68 -0.07 0.82 2.80 0.00 0.00 179.97 184.01 2wi5 h ILE 203 N 0.55 1.29 -0.23 1.20 2.04 0.12 -1.45 117.51 121.03 2wi5 h ILE 203 Ca 0.14 -1.10 0.06 0.00 1.00 0.00 0.00 64.86 64.95 2wi5 h ILE 203 Cb 0.30 1.46 -0.07 0.00 -0.74 0.00 0.00 36.82 37.77 2wi5 h ILE 203 CO 0.00 0.35 -0.38 0.11 0.00 0.00 0.00 178.15 178.23 2wi5 h LYS 204 N 0.27 -0.38 -0.31 2.37 1.57 -0.70 -0.64 116.57 118.74 2wi5 h LYS 204 Ca 0.07 0.03 0.07 0.00 -1.87 0.00 0.00 60.65 58.94 2wi5 h LYS 204 Cb 0.55 0.09 -0.08 0.00 0.08 0.00 0.00 32.23 32.87 2wi5 h LYS 204 CO 0.03 -0.25 -0.24 1.49 -0.57 0.00 0.00 179.45 179.90 2wi5 h GLU 205 N -0.40 -0.20 -0.68 3.15 4.81 -1.17 0.11 114.58 120.20 2wi5 h GLU 205 Ca 0.11 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.36 2wi5 h GLU 205 Cb 0.58 0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.98 2wi5 h GLU 205 CO -0.45 -0.14 0.43 0.82 -0.73 0.00 0.00 179.01 178.95 2wi5 h ILE 206 N -0.21 1.18 -0.14 2.32 2.04 -0.84 0.16 117.51 122.02 2wi5 h ILE 206 Ca 0.16 -0.36 -0.17 0.00 1.00 0.00 0.00 64.86 65.49 2wi5 h ILE 206 Cb 0.46 0.20 0.01 0.00 -0.74 0.00 0.00 36.82 36.75 2wi5 h ILE 206 CO -0.44 0.18 -0.59 0.58 0.00 0.00 0.00 178.15 177.89 2wi5 h VAL 207 N 0.92 1.32 -0.45 1.67 2.07 -0.56 -0.62 116.25 120.60 2wi5 h VAL 207 Ca 0.25 -1.85 0.05 0.00 0.82 0.00 0.00 66.70 65.97 2wi5 h VAL 207 Cb -0.08 2.05 -0.05 0.00 -1.52 0.00 0.00 31.29 31.69 2wi5 h VAL 207 CO -0.05 0.57 0.19 0.50 0.02 0.00 0.00 177.57 178.80 2wi5 h LYS 208 N 0.32 0.38 0.00 1.57 1.63 -0.40 0.36 116.57 120.42 2wi5 h LYS 208 Ca -0.03 -0.02 -0.12 0.00 -0.85 0.00 0.00 60.65 59.62 2wi5 h LYS 208 Cb 1.22 -0.08 -0.02 0.00 -0.60 0.00 0.00 32.23 32.75 2wi5 h LYS 208 CO 0.12 0.25 -0.58 -0.22 -3.45 0.00 0.00 179.45 175.57 2wi5 h LYS 209 N 0.39 0.00 0.00 1.90 3.64 -0.55 -3.34 116.57 118.61 2wi5 h LYS 209 Ca 0.21 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.59 2wi5 h LYS 209 Cb 0.16 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.98 2wi5 h LYS 209 CO -0.18 0.58 -0.31 0.72 -2.27 0.00 0.00 179.45 177.99 2wi5 n HIS 210 N -3.48 0.00 -2.55 1.91 8.25 -0.25 -4.80 115.22 114.30 2wi5 n HIS 210 Ca 0.00 0.00 0.03 0.00 -0.26 0.00 0.00 57.72 57.49 2wi5 n HIS 210 Cb 0.67 0.00 0.03 0.00 1.12 0.00 0.00 29.99 31.81 2wi5 n HIS 210 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 2wi5 n SER 211 N -0.85 1.19 0.17 0.41 7.64 0.08 -4.90 113.62 117.36 2wi5 n SER 211 Ca 0.00 -2.08 0.13 0.00 1.01 0.00 0.00 58.87 57.93 2wi5 n SER 211 Cb 0.00 -0.35 0.40 0.00 -1.01 0.00 0.00 64.21 63.25 2wi5 n SER 211 CO 0.00 0.00 0.00 0.06 -3.01 0.00 0.00 175.04 172.09 2wi5 h GLN 212 N 1.39 0.00 -2.19 1.43 3.07 -1.57 -3.24 115.11 114.00 2wi5 h GLN 212 Ca -0.20 0.00 -0.69 0.00 0.09 0.00 0.00 58.65 57.86 2wi5 h GLN 212 Cb 1.72 0.00 -0.35 0.00 0.08 0.00 0.00 27.48 28.93 2wi5 h GLN 212 CO 0.12 0.00 0.10 1.19 0.09 0.00 0.00 178.83 180.34 2wi5 n PHE 213 N -2.63 3.45 -3.49 0.06 3.72 -1.26 -5.02 117.46 112.29 2wi5 n PHE 213 Ca 0.04 -3.26 -0.38 0.00 -0.05 0.00 0.00 57.45 53.80 2wi5 n PHE 213 Cb 0.40 -0.77 -0.06 0.00 -0.94 0.00 0.00 39.48 38.11 2wi5 n PHE 213 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 2wi5 s ILE 214 N -4.56 5.12 -1.84 4.37 -1.09 -1.23 -4.97 121.20 117.01 2wi5 s ILE 214 Ca 0.45 0.79 0.00 0.00 -2.23 0.00 0.00 60.65 59.66 2wi5 s ILE 214 Cb 0.27 -3.71 0.00 0.00 -1.58 0.00 0.00 42.46 37.44 2wi5 s ILE 214 CO -0.16 0.50 0.15 0.61 -1.23 0.00 0.00 174.94 174.81 2wi5 n GLY 215 N 2.33 -0.10 3.28 6.18 0.00 -1.26 -4.72 105.19 110.91 2wi5 n GLY 215 Ca -0.13 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.76 2wi5 n GLY 215 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2wi5 s TYR 216 N -1.84 -0.35 0.52 1.61 2.02 -1.26 -5.12 117.35 112.93 2wi5 s TYR 216 Ca 0.00 0.75 -0.23 0.00 -0.37 0.00 0.00 57.07 57.22 2wi5 s TYR 216 Cb 0.00 0.14 -0.06 0.00 -0.40 0.00 0.00 41.96 41.64 2wi5 s TYR 216 CO 0.00 -0.30 1.38 -1.25 -1.57 0.00 0.00 175.55 173.80 2wi5 s PRO 217 N -0.48 3.31 -0.08 -1.71 0.04 -1.26 -4.82 135.00 130.00 2wi5 s PRO 217 Ca -0.06 2.29 0.04 0.00 0.04 0.00 0.00 61.00 63.31 2wi5 s PRO 217 Cb -0.04 -2.38 0.00 0.00 0.04 0.00 0.00 34.50 32.12 2wi5 s PRO 217 CO 0.03 -1.07 -0.19 0.42 0.04 0.00 0.00 177.00 176.23 2wi5 s ILE 218 N -1.27 1.61 -0.14 0.56 1.01 -1.26 -1.82 121.20 119.90 2wi5 s ILE 218 Ca 0.68 -0.77 0.01 0.00 0.00 0.00 0.00 60.65 60.57 2wi5 s ILE 218 Cb -0.41 -1.41 0.02 0.00 0.01 0.00 0.00 42.46 40.66 2wi5 s ILE 218 CO 0.50 0.46 -0.16 -0.89 0.00 0.00 0.00 174.94 174.85 2wi5 s THR 219 N 0.39 1.69 -0.41 2.92 2.01 -0.30 -5.00 115.64 116.92 2wi5 s THR 219 Ca -0.14 -0.73 -0.19 0.00 0.31 0.00 0.00 61.69 60.95 2wi5 s THR 219 Cb -0.16 -1.55 0.02 0.00 0.01 0.00 0.00 72.50 70.82 2wi5 s THR 219 CO 0.06 0.48 0.52 -0.22 -0.69 0.00 0.00 174.62 174.77 2wi5 s LEU 220 N 1.23 4.64 0.58 4.42 2.96 -1.26 -1.27 118.68 129.97 2wi5 s LEU 220 Ca 0.00 -0.44 -0.20 0.00 -0.22 0.00 0.00 54.13 53.28 2wi5 s LEU 220 Cb -0.14 -2.54 -0.04 0.00 0.50 0.00 0.00 46.19 43.97 2wi5 s LEU 220 CO -0.07 -0.63 1.26 -0.36 -1.32 0.00 0.00 176.35 175.23 2wi5 s PHE 221 N 2.43 2.34 0.14 5.38 0.40 -0.49 -4.99 117.98 123.18 2wi5 s PHE 221 Ca 0.17 1.47 0.03 0.00 -0.60 0.00 0.00 56.93 58.00 2wi5 s PHE 221 Cb -0.16 -3.61 -0.04 0.00 0.51 0.00 0.00 43.02 39.73 2wi5 s PHE 221 CO 0.15 -2.49 0.23 0.08 0.70 0.00 0.00 175.22 173.89 2wi5 s VAL 222 N -1.46 5.11 0.08 -0.44 1.01 -1.26 -4.59 120.40 118.84 2wi5 s VAL 222 Ca 0.76 -0.74 0.08 0.00 0.00 0.00 0.00 61.98 62.08 2wi5 s VAL 222 Cb -0.35 -3.60 -0.04 0.00 0.00 0.00 0.00 36.38 32.40 2wi5 s VAL 222 CO 0.39 -0.05 -0.17 -1.61 0.00 0.00 0.00 175.10 173.65 2wi5 s GLU 223 N -3.07 1.95 0.00 2.72 2.02 -1.26 -5.00 118.70 116.06 2wi5 s GLU 223 Ca 0.34 -1.08 0.00 0.00 0.02 0.00 0.00 54.97 54.25 2wi5 s GLU 223 Cb -0.11 -2.17 0.00 0.00 0.10 0.00 0.00 34.13 31.95 2wi5 s GLU 223 CO 0.27 0.51 0.00 1.17 0.02 0.00 0.00 175.26 177.23