#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hhu s VAL 17 N 0.00 2.66 -0.14 6.31 1.01 -1.26 -4.49 120.40 124.49 3hhu s VAL 17 Ca 0.00 -0.78 -0.09 0.00 0.00 0.00 0.00 61.98 61.11 3hhu s VAL 17 Cb 0.00 -2.11 -0.04 0.00 0.00 0.00 0.00 36.38 34.22 3hhu s VAL 17 CO 0.00 0.52 0.17 -1.61 0.00 0.00 0.00 175.10 174.18 3hhu s GLU 18 N 0.70 3.78 -0.12 2.72 2.02 -0.76 -4.97 118.70 122.07 3hhu s GLU 18 Ca -0.07 -0.10 -0.01 0.00 0.02 0.00 0.00 54.97 54.81 3hhu s GLU 18 Cb -0.16 -3.28 -0.02 0.00 0.10 0.00 0.00 34.13 30.77 3hhu s GLU 18 CO 0.02 0.58 -0.10 0.99 0.02 0.00 0.00 175.26 176.76 3hhu s THR 19 N -0.47 3.36 0.12 3.63 2.01 -1.26 -1.08 115.64 121.96 3hhu s THR 19 Ca 0.14 -0.56 0.08 0.00 0.31 0.00 0.00 61.69 61.66 3hhu s THR 19 Cb -0.12 -2.41 -0.04 0.00 0.01 0.00 0.00 72.50 69.94 3hhu s THR 19 CO 0.03 0.53 -0.20 -0.36 -0.69 0.00 0.00 174.62 173.93 3hhu s PHE 20 N 0.07 1.82 -0.01 4.92 0.40 0.20 -5.00 117.98 120.38 3hhu s PHE 20 Ca -0.03 -0.43 -0.19 0.00 -0.60 0.00 0.00 56.93 55.68 3hhu s PHE 20 Cb -0.14 -0.97 -0.05 0.00 0.51 0.00 0.00 43.02 42.36 3hhu s PHE 20 CO 0.04 0.25 0.53 0.00 0.70 0.00 0.00 175.22 176.73 3hhu s ALA 21 N -1.42 3.55 0.56 5.36 0.00 -1.26 -1.42 121.76 127.12 3hhu s ALA 21 Ca 0.09 -0.06 -0.21 0.00 0.00 0.00 0.00 51.96 51.78 3hhu s ALA 21 Cb -0.09 -2.63 -0.04 0.00 0.00 0.00 0.00 23.12 20.36 3hhu s ALA 21 CO 0.05 0.25 1.32 -0.06 0.00 0.00 0.00 175.76 177.32 3hhu s PHE 22 N -0.42 2.33 0.58 0.00 0.08 -0.54 -4.93 117.98 115.07 3hhu s PHE 22 Ca 0.28 1.42 -0.19 0.00 0.12 0.00 0.00 56.93 58.55 3hhu s PHE 22 Cb -0.18 -3.71 -0.05 0.00 -0.57 0.00 0.00 43.02 38.51 3hhu s PHE 22 CO 0.15 -2.70 1.02 1.04 -0.10 0.00 0.00 175.22 174.63 3hhu n GLN 23 N -1.15 1.04 -0.25 0.44 6.02 -1.26 -4.77 117.38 117.45 3hhu n GLN 23 Ca 0.11 0.40 0.00 0.00 -0.01 0.00 0.00 57.00 57.50 3hhu n GLN 23 Cb 0.46 -2.20 0.13 0.00 1.02 0.00 0.00 30.24 29.65 3hhu n GLN 23 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3hhu h ALA 24 N 0.71 0.99 -0.54 -1.58 0.00 -1.99 -1.51 119.26 115.34 3hhu h ALA 24 Ca -0.48 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.42 3hhu h ALA 24 Cb 1.35 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 19.02 3hhu h ALA 24 CO 0.52 0.03 0.17 0.93 0.00 0.00 0.00 179.25 180.91 3hhu h GLU 25 N 0.69 0.80 -0.16 0.00 3.07 -1.99 -1.46 114.58 115.54 3hhu h GLU 25 Ca 0.34 -0.14 -0.21 0.00 -0.50 0.00 0.00 59.36 58.85 3hhu h GLU 25 Cb 0.28 -0.13 0.01 0.00 -0.84 0.00 0.00 28.75 28.07 3hhu h GLU 25 CO -0.22 0.69 -0.73 0.82 -1.40 0.00 0.00 179.01 178.17 3hhu h ILE 26 N 0.79 1.30 -0.67 3.13 5.03 -1.69 -1.42 117.51 123.98 3hhu h ILE 26 Ca 0.18 -1.97 -0.01 0.00 -0.12 0.00 0.00 64.86 62.95 3hhu h ILE 26 Cb 0.22 1.95 -0.03 0.00 -3.03 0.00 0.00 36.82 35.93 3hhu h ILE 26 CO -0.01 0.62 0.38 0.00 -0.68 0.00 0.00 178.15 178.46 3hhu h ALA 27 N 0.66 1.42 -0.21 1.87 0.00 -1.00 -0.58 119.26 121.42 3hhu h ALA 27 Ca -0.04 -0.09 -0.17 0.00 0.00 0.00 0.00 54.91 54.61 3hhu h ALA 27 Cb 1.35 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.86 3hhu h ALA 27 CO 0.15 0.49 -0.57 1.96 0.00 0.00 0.00 179.25 181.28 3hhu h GLN 28 N 0.92 0.67 -0.46 0.00 4.20 -1.13 -1.51 115.11 117.80 3hhu h GLN 28 Ca 0.24 -0.43 -0.02 0.00 0.06 0.00 0.00 58.65 58.50 3hhu h GLN 28 Cb -0.00 0.05 -0.02 0.00 0.30 0.00 0.00 27.48 27.81 3hhu h GLN 28 CO -0.04 1.05 0.22 1.25 -0.67 0.00 0.00 178.83 180.64 3hhu h LEU 29 N 0.51 0.60 -0.79 1.46 5.85 -0.77 -1.36 115.31 120.81 3hhu h LEU 29 Ca 0.01 -0.13 -0.08 0.00 0.84 0.00 0.00 57.88 58.52 3hhu h LEU 29 Cb 1.14 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.99 3hhu h LEU 29 CO 0.11 0.56 0.08 0.24 -0.34 0.00 0.00 178.44 179.10 3hhu h MET 30 N 0.60 1.00 -0.51 1.25 2.86 -1.02 -1.56 114.93 117.55 3hhu h MET 30 Ca 0.16 -0.26 -0.08 0.00 -2.06 0.00 0.00 59.70 57.46 3hhu h MET 30 Cb 0.12 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 31.64 3hhu h MET 30 CO -0.02 0.93 0.01 1.03 1.06 0.00 0.00 176.91 179.92 3hhu h SER 31 N 0.94 0.82 -0.36 1.22 0.87 -1.09 -1.44 113.55 114.50 3hhu h SER 31 Ca 0.19 -0.20 -0.02 0.00 -1.23 0.00 0.00 61.79 60.53 3hhu h SER 31 Cb 0.43 -0.22 -0.02 0.00 -0.44 0.00 0.00 62.40 62.16 3hhu h SER 31 CO 0.01 0.88 0.15 0.25 -0.53 0.00 0.00 176.83 177.59 3hhu h LEU 32 N 0.79 0.49 -1.09 2.23 6.46 -0.86 -1.22 115.31 122.11 3hhu h LEU 32 Ca 0.15 -0.15 -0.03 0.00 -0.12 0.00 0.00 57.88 57.73 3hhu h LEU 32 Cb 0.46 -0.13 -0.03 0.00 -0.73 0.00 0.00 40.66 40.24 3hhu h LEU 32 CO 0.02 0.51 0.27 0.40 -0.62 0.00 0.00 178.44 179.02 3hhu h ILE 33 N 0.43 1.22 0.02 4.05 2.04 -1.01 -1.30 117.51 122.96 3hhu h ILE 33 Ca 0.12 -0.66 -0.21 0.00 1.00 0.00 0.00 64.86 65.11 3hhu h ILE 33 Cb 0.17 0.44 -0.02 0.00 -0.74 0.00 0.00 36.82 36.67 3hhu h ILE 33 CO -0.01 0.27 -0.96 0.40 0.00 0.00 0.00 178.15 177.85 3hhu h ILE 34 N 0.91 1.60 0.00 -0.67 2.04 -1.05 -3.38 117.51 116.96 3hhu h ILE 34 Ca 0.22 -3.02 0.00 0.00 1.00 0.00 0.00 64.86 63.06 3hhu h ILE 34 Cb 0.15 2.68 0.00 0.00 -0.74 0.00 0.00 36.82 38.91 3hhu h ILE 34 CO -0.02 0.87 -0.64 0.59 0.00 0.00 0.00 178.15 178.94 3hhu n ASN 35 N -3.51 0.74 -4.74 1.72 3.02 -0.48 -4.96 115.26 107.06 3hhu n ASN 35 Ca -0.02 -0.67 -0.41 0.00 -0.03 0.00 0.00 54.58 53.45 3hhu n ASN 35 Cb 0.88 1.06 -0.04 0.00 -0.61 0.00 0.00 39.78 41.07 3hhu n ASN 35 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3hhu s THR 36 N -2.14 4.00 -0.19 3.41 2.01 -0.50 -5.00 115.64 117.22 3hhu s THR 36 Ca 0.03 1.78 -0.29 0.00 0.31 0.00 0.00 61.69 63.52 3hhu s THR 36 Cb 0.08 -4.14 -0.01 0.00 0.01 0.00 0.00 72.50 68.44 3hhu s THR 36 CO 0.46 0.33 1.32 0.12 -0.69 0.00 0.00 174.62 176.16 3hhu s PHE 37 N -0.43 2.70 -0.30 4.92 5.36 -1.26 -4.97 117.98 124.00 3hhu s PHE 37 Ca 0.47 0.89 -0.01 0.00 -0.96 0.00 0.00 56.93 57.31 3hhu s PHE 37 Cb -0.28 -3.66 0.19 0.00 -0.34 0.00 0.00 43.02 38.93 3hhu s PHE 37 CO 0.34 -1.94 0.64 -0.47 -1.46 0.00 0.00 175.22 172.33 3hhu s TYR 38 N 3.87 -1.54 -0.27 10.12 5.04 -1.26 -5.06 117.35 128.24 3hhu s TYR 38 Ca 0.57 1.58 0.20 0.00 -2.44 0.00 0.00 57.07 56.99 3hhu s TYR 38 Cb -0.21 0.52 0.29 0.00 0.35 0.00 0.00 41.96 42.91 3hhu s TYR 38 CO 0.19 -0.85 1.57 0.77 -1.34 0.00 0.00 175.55 175.89 3hhu h SER 39 N 8.00 0.00 0.00 4.32 0.02 -2.04 -3.37 113.55 120.48 3hhu h SER 39 Ca -0.21 0.00 -0.55 0.00 -0.84 0.00 0.00 61.79 60.20 3hhu h SER 39 Cb 1.16 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.71 3hhu h SER 39 CO 0.22 0.22 2.80 -3.20 -1.14 0.00 0.00 176.83 175.73 3hhu n ASN 40 N -3.17 7.85 0.24 3.07 4.05 -1.26 -4.64 115.26 121.41 3hhu n ASN 40 Ca 0.03 -2.54 0.16 0.00 0.45 0.00 0.00 54.58 52.67 3hhu n ASN 40 Cb 0.60 -1.52 0.60 0.00 1.23 0.00 0.00 39.78 40.69 3hhu n ASN 40 CO 0.00 0.00 0.00 0.11 -3.05 0.00 0.00 177.26 174.32 3hhu h LYS 41 N 4.53 0.00 0.00 1.20 1.57 -1.96 -3.30 116.57 118.60 3hhu h LYS 41 Ca 0.70 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.48 3hhu h LYS 41 Cb 0.58 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.89 3hhu h LYS 41 CO 1.40 0.00 0.00 1.05 -0.57 0.00 0.00 179.45 181.33 3hhu h GLU 42 N 0.00 0.00 0.00 3.15 4.11 -1.97 -2.63 114.58 117.24 3hhu h GLU 42 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 3hhu h GLU 42 Cb 0.53 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.78 3hhu h GLU 42 CO 0.00 0.00 0.00 0.44 0.07 0.00 0.00 179.01 179.52 3hhu n ILE 43 N -2.64 0.67 -0.24 -1.06 -6.64 -1.24 -2.76 119.36 105.44 3hhu n ILE 43 Ca -0.01 0.17 0.05 0.00 -1.77 0.00 0.00 62.75 61.19 3hhu n ILE 43 Cb 0.13 -0.93 0.29 0.00 -1.44 0.00 0.00 39.64 37.69 3hhu n ILE 43 CO 0.00 0.00 0.00 2.19 -1.77 0.00 0.00 176.55 176.97 3hhu h PHE 44 N 0.00 0.92 -0.32 4.28 -0.00 -1.74 -2.90 116.94 117.17 3hhu h PHE 44 Ca 0.00 0.02 -0.14 0.00 -0.00 0.00 0.00 57.97 57.85 3hhu h PHE 44 Cb 0.15 -0.30 -0.00 0.00 -0.00 0.00 0.00 35.95 35.80 3hhu h PHE 44 CO 0.00 0.49 -0.35 1.25 -0.00 0.00 0.00 178.31 179.70 3hhu h LEU 45 N 0.91 0.87 -1.39 2.10 5.85 -1.80 -2.36 115.31 119.49 3hhu h LEU 45 Ca 0.35 -0.48 -0.04 0.00 0.84 0.00 0.00 57.88 58.54 3hhu h LEU 45 Cb 0.20 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 40.97 3hhu h LEU 45 CO -0.12 1.17 -0.07 0.08 -0.34 0.00 0.00 178.44 179.16 3hhu h ARG 46 N 0.59 0.31 -0.33 1.25 0.11 -1.73 -0.35 114.38 114.22 3hhu h ARG 46 Ca 0.05 -0.06 -0.14 0.00 0.10 0.00 0.00 59.98 59.92 3hhu h ARG 46 Cb 0.94 -0.05 -0.01 0.00 1.11 0.00 0.00 29.97 31.96 3hhu h ARG 46 CO 0.09 0.40 -0.37 0.93 0.10 0.00 0.00 179.97 181.12 3hhu h GLU 47 N 0.30 0.78 -0.23 0.08 4.39 -1.27 0.43 114.58 119.05 3hhu h GLU 47 Ca 0.06 -0.39 -0.19 0.00 0.34 0.00 0.00 59.36 59.18 3hhu h GLU 47 Cb 0.33 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.98 3hhu h GLU 47 CO 0.02 1.02 -0.62 -0.07 -1.16 0.00 0.00 179.01 178.19 3hhu h LEU 48 N 0.64 0.94 -1.01 1.33 3.38 -1.08 -2.10 115.31 117.41 3hhu h LEU 48 Ca 0.06 -0.57 -0.04 0.00 0.09 0.00 0.00 57.88 57.42 3hhu h LEU 48 Cb 0.92 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 41.37 3hhu h LEU 48 CO 0.08 1.34 0.25 0.40 0.09 0.00 0.00 178.44 180.61 3hhu h ILE 49 N 0.58 1.23 -0.56 1.22 2.04 -1.01 -1.50 117.51 119.52 3hhu h ILE 49 Ca -0.01 -0.73 -0.03 0.00 1.00 0.00 0.00 64.86 65.08 3hhu h ILE 49 Cb 1.24 0.47 -0.02 0.00 -0.74 0.00 0.00 36.82 37.76 3hhu h ILE 49 CO 0.13 0.29 0.22 -1.28 0.00 0.00 0.00 178.15 177.51 3hhu h SER 50 N 0.94 0.77 -0.67 1.72 0.87 -0.84 -0.60 113.55 115.74 3hhu h SER 50 Ca 0.22 -0.17 -0.04 0.00 -1.23 0.00 0.00 61.79 60.57 3hhu h SER 50 Cb 0.20 -0.20 -0.03 0.00 -0.44 0.00 0.00 62.40 61.93 3hhu h SER 50 CO -0.02 0.74 0.28 0.78 -0.53 0.00 0.00 176.83 178.08 3hhu h ASN 51 N 0.76 0.93 -0.51 6.23 2.35 -1.03 -1.48 115.58 122.83 3hhu h ASN 51 Ca 0.18 -0.13 -0.06 0.00 -0.55 0.00 0.00 56.30 55.75 3hhu h ASN 51 Cb 0.21 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 38.32 3hhu h ASN 51 CO -0.01 0.82 0.10 0.28 -1.65 0.00 0.00 177.43 176.97 3hhu h SER 52 N 0.99 0.79 -0.82 5.81 0.02 -0.87 -1.63 113.55 117.84 3hhu h SER 52 Ca 0.23 -0.25 -0.01 0.00 -0.84 0.00 0.00 61.79 60.92 3hhu h SER 52 Cb 0.18 -0.21 -0.04 0.00 0.14 0.00 0.00 62.40 62.48 3hhu h SER 52 CO -0.02 0.84 0.46 -1.28 -1.14 0.00 0.00 176.83 175.69 3hhu h SER 53 N 0.71 1.01 -0.55 3.07 0.87 -0.74 -0.44 113.55 117.49 3hhu h SER 53 Ca 0.16 -0.09 -0.02 0.00 -1.23 0.00 0.00 61.79 60.60 3hhu h SER 53 Cb 0.38 -0.26 -0.02 0.00 -0.44 0.00 0.00 62.40 62.05 3hhu h SER 53 CO 0.01 0.81 0.25 0.44 -0.53 0.00 0.00 176.83 177.80 3hhu h ASP 54 N 1.13 0.73 -0.11 6.23 3.32 -0.97 0.40 116.42 127.15 3hhu h ASP 54 Ca 0.29 -0.14 -0.07 0.00 0.02 0.00 0.00 57.03 57.12 3hhu h ASP 54 Cb 0.01 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.36 3hhu h ASP 54 CO -0.05 0.67 -0.14 0.00 -1.72 0.00 0.00 179.24 178.01 3hhu h ALA 55 N 1.09 1.26 -0.27 3.45 0.00 -0.85 -2.08 119.26 121.87 3hhu h ALA 55 Ca 0.19 -0.27 -0.19 0.00 0.00 0.00 0.00 54.91 54.64 3hhu h ALA 55 Cb 0.15 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.81 3hhu h ALA 55 CO -0.02 0.49 -0.58 -0.07 0.00 0.00 0.00 179.25 179.07 3hhu h LEU 56 N 0.43 0.96 -1.16 0.00 3.38 -0.71 -2.00 115.31 116.20 3hhu h LEU 56 Ca 0.08 -0.53 0.05 0.00 0.09 0.00 0.00 57.88 57.57 3hhu h LEU 56 Cb 0.50 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 40.92 3hhu h LEU 56 CO 0.03 1.33 0.58 0.44 0.09 0.00 0.00 178.44 180.90 3hhu h ASP 57 N 0.65 0.91 -0.23 -0.43 3.32 -0.58 -1.54 116.42 118.51 3hhu h ASP 57 Ca 0.01 -0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.01 3hhu h ASP 57 Cb 1.19 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 40.53 3hhu h ASP 57 CO 0.13 0.61 -0.04 0.11 -1.72 0.00 0.00 179.24 178.33 3hhu h LYS 58 N 1.05 0.43 -0.09 3.56 1.57 -1.18 -1.15 116.57 120.76 3hhu h LYS 58 Ca 0.37 -0.16 -0.15 0.00 -1.87 0.00 0.00 60.65 58.84 3hhu h LYS 58 Cb 0.12 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.39 3hhu h LYS 58 CO -0.12 0.65 -0.61 0.97 -0.57 0.00 0.00 179.45 179.77 3hhu h ILE 59 N 0.18 1.38 -0.17 1.86 6.09 -1.38 -2.09 117.51 123.37 3hhu h ILE 59 Ca 0.06 -1.97 0.01 0.00 -1.37 0.00 0.00 64.86 61.59 3hhu h ILE 59 Cb 0.48 1.98 -0.01 0.00 0.47 0.00 0.00 36.82 39.74 3hhu h ILE 59 CO 0.02 0.59 0.10 -0.09 -3.07 0.00 0.00 178.15 175.69 3hhu h ARG 60 N 0.22 0.20 -0.45 2.19 9.65 -1.14 -1.40 114.38 123.64 3hhu h ARG 60 Ca -0.01 -0.01 -0.14 0.00 -1.10 0.00 0.00 59.98 58.72 3hhu h ARG 60 Cb 1.12 -0.04 -0.01 0.00 -1.39 0.00 0.00 29.97 29.65 3hhu h ARG 60 CO 0.10 0.13 -0.27 -0.92 2.80 0.00 0.00 179.97 181.81 3hhu h TYR 61 N 0.20 1.14 -0.73 2.20 3.20 -1.10 -2.93 116.97 118.96 3hhu h TYR 61 Ca 0.07 -0.30 0.01 0.00 3.14 0.00 0.00 58.73 61.65 3hhu h TYR 61 Cb -0.00 -0.26 -0.04 0.00 1.54 0.00 0.00 36.73 37.97 3hhu h TYR 61 CO -0.08 1.13 0.48 0.93 -1.64 0.00 0.00 178.16 178.97 3hhu h GLU 62 N 0.83 0.96 0.00 1.82 5.08 -1.31 -2.46 114.58 119.49 3hhu h GLU 62 Ca 0.10 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 3hhu h GLU 62 Cb 0.85 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.89 3hhu h GLU 62 CO 0.08 0.64 0.00 -1.13 -1.00 0.00 0.00 179.01 177.59 3hhu n SER 63 N -4.58 0.65 0.14 1.42 3.41 -0.54 -2.29 113.62 111.84 3hhu n SER 63 Ca 0.07 0.69 0.02 0.00 -0.26 0.00 0.00 58.87 59.39 3hhu n SER 63 Cb 0.02 -0.82 0.38 0.00 -0.26 0.00 0.00 64.21 63.54 3hhu n SER 63 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 3hhu h LEU 64 N 0.00 0.15 0.00 1.04 3.38 -1.33 -3.03 115.31 115.52 3hhu h LEU 64 Ca 0.00 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.93 3hhu h LEU 64 Cb 0.27 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.98 3hhu h LEU 64 CO 0.00 0.38 -0.61 0.35 0.09 0.00 0.00 178.44 178.65 3hhu n THR 65 N -4.23 0.00 -3.40 0.22 -2.24 -0.97 -4.83 114.28 98.84 3hhu n THR 65 Ca -0.01 -0.21 -0.20 0.00 -2.27 0.00 0.00 64.05 61.36 3hhu n THR 65 Cb 0.31 0.98 -0.09 0.00 -2.10 0.00 0.00 70.33 69.43 3hhu n THR 65 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3hhu s ASP 66 N -2.20 1.76 0.61 3.42 -1.08 -1.00 -5.01 116.67 113.17 3hhu s ASP 66 Ca 0.04 -1.51 0.35 0.00 -0.52 0.00 0.00 52.55 50.92 3hhu s ASP 66 Cb 0.09 0.31 1.97 0.00 -1.46 0.00 0.00 42.92 43.83 3hhu s ASP 66 CO 0.51 -0.31 2.26 -0.65 0.52 0.00 0.00 175.17 177.50 3hhu h PRO 67 N 7.38 0.00 0.00 4.34 0.11 -1.84 -2.15 132.00 139.85 3hhu h PRO 67 Ca -0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 3hhu h PRO 67 Cb 1.04 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.15 3hhu h PRO 67 CO 0.25 0.02 0.00 0.66 -0.21 0.00 0.00 178.00 178.73 3hhu h SER 68 N 0.00 0.00 0.33 -2.05 4.64 -1.95 -1.57 113.55 112.95 3hhu h SER 68 Ca -0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3hhu h SER 68 Cb 0.09 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.17 3hhu h SER 68 CO 0.00 0.00 -0.01 0.11 -0.87 0.00 0.00 176.83 176.06 3hhu h LYS 69 N 0.00 0.00 -0.38 4.77 1.79 -1.75 -1.72 116.57 119.28 3hhu h LYS 69 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 3hhu h LYS 69 Cb 0.33 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.98 3hhu h LYS 69 CO 0.00 0.01 0.00 1.28 -1.08 0.00 0.00 179.45 179.66 3hhu n LEU 70 N -3.16 3.10 0.32 2.94 4.77 -0.59 -4.24 117.00 120.14 3hhu n LEU 70 Ca -0.02 -1.36 0.19 0.00 -0.03 0.00 0.00 56.01 54.79 3hhu n LEU 70 Cb 0.15 -0.24 1.05 0.00 -2.33 0.00 0.00 43.42 42.05 3hhu n LEU 70 CO 0.23 0.68 1.14 0.44 -1.33 0.00 0.00 177.39 178.55 3hhu h ASP 71 N 3.94 0.00 -0.33 -1.43 3.32 -1.44 -0.07 116.42 120.41 3hhu h ASP 71 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3hhu h ASP 71 Cb 0.87 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.42 3hhu h ASP 71 CO 0.00 0.01 0.00 -1.54 -1.72 0.00 0.00 179.24 175.99 3hhu n SER 72 N -3.42 1.84 0.00 6.45 3.41 -1.26 -4.90 113.62 115.74 3hhu n SER 72 Ca -0.03 -1.97 0.00 0.00 -0.26 0.00 0.00 58.87 56.62 3hhu n SER 72 Cb 0.10 -0.22 0.00 0.00 -0.26 0.00 0.00 64.21 63.83 3hhu n SER 72 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3hhu n GLY 73 N 1.06 3.63 0.08 5.00 0.00 -0.04 -3.79 105.19 111.14 3hhu n GLY 73 Ca 0.12 -0.42 -0.06 0.00 0.00 0.00 0.00 46.02 45.66 3hhu n GLY 73 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hhu h LYS 74 N 0.00 0.00 -6.40 1.61 1.57 -1.90 -3.44 116.57 108.01 3hhu h LYS 74 Ca 0.00 0.00 -0.54 0.00 -1.87 0.00 0.00 60.65 58.24 3hhu h LYS 74 Cb 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 3hhu h LYS 74 CO 0.00 0.46 0.60 -1.21 -0.57 0.00 0.00 179.45 178.73 3hhu s GLU 75 N -2.71 4.41 -0.39 3.15 8.01 -1.26 -5.00 118.70 124.91 3hhu s GLU 75 Ca -0.04 1.70 -0.05 0.00 0.01 0.00 0.00 54.97 56.59 3hhu s GLU 75 Cb 0.08 -3.45 0.09 0.00 -4.31 0.00 0.00 34.13 26.54 3hhu s GLU 75 CO 0.82 -0.32 0.18 -0.51 0.01 0.00 0.00 175.26 175.44 3hhu s LEU 76 N 1.56 4.92 0.34 1.80 1.43 -1.26 -4.76 118.68 122.72 3hhu s LEU 76 Ca 0.57 -1.68 -0.14 0.00 -1.03 0.00 0.00 54.13 51.84 3hhu s LEU 76 Cb -0.27 -1.86 0.03 0.00 0.03 0.00 0.00 46.19 44.13 3hhu s LEU 76 CO 0.26 -0.48 0.69 -1.38 0.23 0.00 0.00 176.35 175.67 3hhu s HIS 77 N 1.26 0.25 -0.06 0.29 -3.43 -1.26 -4.45 115.29 107.89 3hhu s HIS 77 Ca 0.03 -0.77 0.02 0.00 -0.80 0.00 0.00 55.06 53.54 3hhu s HIS 77 Cb -0.22 0.59 0.01 0.00 -1.43 0.00 0.00 32.58 31.54 3hhu s HIS 77 CO -0.01 -1.38 -0.10 0.42 -2.00 0.00 0.00 174.74 171.67 3hhu s ILE 78 N -2.91 0.96 -0.06 -5.38 1.01 -0.46 -2.74 121.20 111.62 3hhu s ILE 78 Ca 0.18 -0.38 0.03 0.00 0.00 0.00 0.00 60.65 60.48 3hhu s ILE 78 Cb -0.04 -0.89 -0.02 0.00 0.01 0.00 0.00 42.46 41.51 3hhu s ILE 78 CO 0.12 0.31 -0.16 0.20 0.00 0.00 0.00 174.94 175.42 3hhu s ASN 79 N 0.69 3.90 -0.18 3.58 0.01 0.89 -0.97 114.94 122.86 3hhu s ASN 79 Ca -0.13 -0.26 -0.03 0.00 -0.71 0.00 0.00 52.86 51.73 3hhu s ASN 79 Cb -0.15 -0.94 -0.01 0.00 0.41 0.00 0.00 41.25 40.55 3hhu s ASN 79 CO 0.03 0.31 -0.07 -0.76 -1.51 0.00 0.00 177.10 175.10 3hhu s LEU 80 N -0.50 2.92 -0.32 0.60 1.43 0.25 -0.72 118.68 122.34 3hhu s LEU 80 Ca 0.07 -0.31 0.01 0.00 -1.03 0.00 0.00 54.13 52.86 3hhu s LEU 80 Cb -0.12 -1.71 0.10 0.00 0.03 0.00 0.00 46.19 44.49 3hhu s LEU 80 CO 0.01 0.08 0.08 -0.63 0.23 0.00 0.00 176.35 176.13 3hhu s ILE 81 N 0.87 1.28 0.28 -0.59 1.01 0.25 -1.20 121.20 123.09 3hhu s ILE 81 Ca -0.02 -1.68 -0.21 0.00 0.00 0.00 0.00 60.65 58.75 3hhu s ILE 81 Cb -0.15 -1.96 -0.09 0.00 0.01 0.00 0.00 42.46 40.27 3hhu s ILE 81 CO 0.01 -0.66 0.80 -2.16 0.00 0.00 0.00 174.94 172.93 3hhu s PRO 82 N 1.41 4.29 -0.22 2.79 0.04 -1.26 -1.23 135.00 140.82 3hhu s PRO 82 Ca 0.10 0.97 -0.04 0.00 0.04 0.00 0.00 61.00 62.08 3hhu s PRO 82 Cb -0.18 -2.74 0.09 0.00 0.04 0.00 0.00 34.50 31.72 3hhu s PRO 82 CO -0.20 0.30 0.20 1.21 0.04 0.00 0.00 177.00 178.55 3hhu s ASN 83 N -1.78 1.77 0.34 6.66 3.84 -0.17 -4.84 114.94 120.76 3hhu s ASN 83 Ca 0.48 -0.45 0.18 0.00 0.21 0.00 0.00 52.86 53.28 3hhu s ASN 83 Cb -0.16 0.23 0.46 0.00 -0.55 0.00 0.00 41.25 41.24 3hhu s ASN 83 CO 0.20 -0.35 1.63 0.11 -2.79 0.00 0.00 177.10 175.90 3hhu h LYS 84 N 8.33 0.00 -0.50 0.43 1.57 -1.92 0.25 116.57 124.73 3hhu h LYS 84 Ca -0.17 0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.49 3hhu h LYS 84 Cb 1.13 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.42 3hhu h LYS 84 CO 0.30 0.42 -0.16 1.96 -0.57 0.00 0.00 179.45 181.40 3hhu h GLN 85 N 0.00 1.00 0.00 3.15 7.50 -1.96 -3.08 115.11 121.72 3hhu h GLN 85 Ca -0.00 -0.40 0.00 0.00 0.50 0.00 0.00 58.65 58.74 3hhu h GLN 85 Cb 1.08 -0.05 0.00 0.00 0.05 0.00 0.00 27.48 28.56 3hhu h GLN 85 CO 0.05 1.08 -0.73 -0.25 -1.50 0.00 0.00 178.83 177.48 3hhu n ASP 86 N -4.14 0.66 -3.63 1.46 8.00 -1.17 -4.97 116.55 112.75 3hhu n ASP 86 Ca 0.01 -0.44 -0.20 0.00 0.71 0.00 0.00 54.79 54.87 3hhu n ASP 86 Cb 0.43 0.55 0.05 0.00 -0.02 0.00 0.00 41.12 42.13 3hhu n ASP 86 CO 0.00 0.00 0.00 -1.14 -0.39 0.00 0.00 177.20 175.67 3hhu n ARG 87 N -1.60 -5.40 -4.53 -1.24 0.63 0.01 -4.90 116.66 99.63 3hhu n ARG 87 Ca 0.04 0.68 -0.23 0.00 -0.92 0.00 0.00 57.85 57.42 3hhu n ARG 87 Cb 0.35 -5.37 -0.14 0.00 0.45 0.00 0.00 32.46 27.76 3hhu n ARG 87 CO 0.00 0.00 0.00 0.95 -2.51 0.00 0.00 177.63 176.07 3hhu s THR 88 N -3.58 1.41 -0.17 5.15 -4.23 -0.77 -2.07 115.64 111.37 3hhu s THR 88 Ca 0.02 -1.07 0.01 0.00 -1.18 0.00 0.00 61.69 59.46 3hhu s THR 88 Cb -0.01 -1.24 0.01 0.00 1.34 0.00 0.00 72.50 72.60 3hhu s THR 88 CO 0.79 0.14 -0.17 -0.22 -0.54 0.00 0.00 174.62 174.62 3hhu s LEU 89 N -1.09 2.33 -0.13 4.79 2.96 -0.68 -1.00 118.68 125.86 3hhu s LEU 89 Ca 0.05 -0.55 0.00 0.00 -0.22 0.00 0.00 54.13 53.42 3hhu s LEU 89 Cb -0.08 -1.53 -0.01 0.00 0.50 0.00 0.00 46.19 45.07 3hhu s LEU 89 CO 0.01 0.05 -0.15 -0.89 -1.32 0.00 0.00 176.35 174.05 3hhu s THR 90 N 1.03 2.86 -0.24 3.68 2.01 -0.36 -0.51 115.64 124.11 3hhu s THR 90 Ca -0.01 -0.72 -0.07 0.00 0.31 0.00 0.00 61.69 61.19 3hhu s THR 90 Cb -0.15 -2.19 -0.03 0.00 0.01 0.00 0.00 72.50 70.14 3hhu s THR 90 CO -0.05 0.52 0.06 -0.63 -0.69 0.00 0.00 174.62 173.84 3hhu s ILE 91 N 0.46 4.27 -0.10 1.82 1.09 -0.01 -0.58 121.20 128.16 3hhu s ILE 91 Ca -0.10 -0.19 0.03 0.00 -1.10 0.00 0.00 60.65 59.29 3hhu s ILE 91 Cb -0.16 -2.99 -0.00 0.00 -1.06 0.00 0.00 42.46 38.25 3hhu s ILE 91 CO 0.05 0.36 -0.22 -0.69 -0.10 0.00 0.00 174.94 174.34 3hhu s VAL 92 N 1.45 2.29 0.18 2.92 1.01 0.10 -0.43 120.40 127.92 3hhu s VAL 92 Ca 0.05 -0.94 0.06 0.00 0.00 0.00 0.00 61.98 61.15 3hhu s VAL 92 Cb -0.15 -1.89 -0.05 0.00 0.00 0.00 0.00 36.38 34.30 3hhu s VAL 92 CO 0.03 0.55 -0.11 1.51 0.00 0.00 0.00 175.10 177.08 3hhu s ASP 93 N 0.26 2.14 -0.53 3.32 1.47 -0.23 -0.08 116.67 123.02 3hhu s ASP 93 Ca -0.15 -1.03 0.02 0.00 1.18 0.00 0.00 52.55 52.57 3hhu s ASP 93 Cb -0.17 -0.06 0.45 0.00 -0.34 0.00 0.00 42.92 42.79 3hhu s ASP 93 CO 0.07 -0.28 1.67 0.35 0.68 0.00 0.00 175.17 177.67 3hhu n THR 94 N -0.29 3.15 -0.13 2.11 -2.24 -1.11 -2.06 114.28 113.71 3hhu n THR 94 Ca -0.09 -3.62 0.00 0.00 -2.27 0.00 0.00 64.05 58.07 3hhu n THR 94 Cb 0.61 -1.16 0.00 0.00 -2.10 0.00 0.00 70.33 67.67 3hhu n THR 94 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3hhu n GLY 95 N -0.79 -1.14 0.14 3.38 0.00 -1.26 -4.71 105.19 100.80 3hhu n GLY 95 Ca 0.54 -1.58 0.13 0.00 0.00 0.00 0.00 46.02 45.11 3hhu n GLY 95 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3hhu h ILE 96 N -0.27 0.00 -0.60 -0.61 2.10 -1.71 -3.20 117.51 113.23 3hhu h ILE 96 Ca 0.00 -0.38 0.06 0.00 1.08 0.00 0.00 64.86 65.62 3hhu h ILE 96 Cb 0.00 1.23 -0.01 0.00 -1.09 0.00 0.00 36.82 36.95 3hhu h ILE 96 CO 0.00 0.00 -0.08 0.61 -1.08 0.00 0.00 178.15 177.60 3hhu n GLY 97 N 0.47 -2.09 2.95 8.18 0.00 -1.26 -4.37 105.19 109.08 3hhu n GLY 97 Ca 0.03 -1.42 -0.14 0.00 0.00 0.00 0.00 46.02 44.49 3hhu n GLY 97 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3hhu s MET 98 N -0.88 0.32 0.82 1.61 1.00 -1.26 -4.80 119.30 116.11 3hhu s MET 98 Ca 0.00 -0.26 -0.12 0.00 0.00 0.00 0.00 55.69 55.31 3hhu s MET 98 Cb 0.00 -0.24 0.08 0.00 0.00 0.00 0.00 34.83 34.67 3hhu s MET 98 CO 0.00 0.06 1.11 0.95 0.00 0.00 0.00 175.02 177.14 3hhu s THR 99 N -0.40 2.75 0.26 2.05 -4.23 -1.26 -3.87 115.64 110.94 3hhu s THR 99 Ca -0.02 0.24 -0.04 0.00 -1.18 0.00 0.00 61.69 60.70 3hhu s THR 99 Cb -0.03 -3.03 0.26 0.00 1.34 0.00 0.00 72.50 71.04 3hhu s THR 99 CO -0.00 -0.32 1.90 0.50 -0.54 0.00 0.00 174.62 176.16 3hhu h LYS 100 N -1.16 1.21 -0.62 3.99 3.64 -1.98 -1.26 116.57 120.39 3hhu h LYS 100 Ca -0.48 -0.07 -0.03 0.00 -1.27 0.00 0.00 60.65 58.80 3hhu h LYS 100 Cb 1.29 -0.27 -0.03 0.00 -0.41 0.00 0.00 32.23 32.81 3hhu h LYS 100 CO 0.61 0.80 0.26 0.00 -2.27 0.00 0.00 179.45 178.85 3hhu h ALA 101 N 1.42 0.80 -0.12 5.00 0.00 -2.00 -2.10 119.26 122.26 3hhu h ALA 101 Ca 0.40 -0.16 -0.14 0.00 0.00 0.00 0.00 54.91 55.02 3hhu h ALA 101 Cb 0.04 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 3hhu h ALA 101 CO -0.14 0.40 -0.53 -0.44 0.00 0.00 0.00 179.25 178.55 3hhu h ASP 102 N 0.86 0.38 -0.22 0.00 5.19 -1.79 0.31 116.42 121.16 3hhu h ASP 102 Ca 0.21 -0.20 0.04 0.00 -0.62 0.00 0.00 57.03 56.46 3hhu h ASP 102 Cb 0.18 -0.11 -0.04 0.00 0.18 0.00 0.00 39.33 39.54 3hhu h ASP 102 CO -0.02 0.84 -0.04 -0.07 -3.12 0.00 0.00 179.24 176.84 3hhu h LEU 103 N 0.27 -0.16 -0.59 1.55 3.38 -0.94 -0.65 115.31 118.17 3hhu h LEU 103 Ca 0.01 0.06 -0.12 0.00 0.09 0.00 0.00 57.88 57.92 3hhu h LEU 103 Cb 1.02 0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.87 3hhu h LEU 103 CO 0.09 -0.05 -0.20 0.40 0.09 0.00 0.00 178.44 178.77 3hhu h ILE 104 N 0.02 1.27 0.00 1.22 2.04 -1.16 -1.37 117.51 119.53 3hhu h ILE 104 Ca 0.10 -1.34 -0.55 0.00 1.00 0.00 0.00 64.86 64.08 3hhu h ILE 104 Cb 0.15 1.13 0.02 0.00 -0.74 0.00 0.00 36.82 37.37 3hhu h ILE 104 CO -0.21 0.46 3.17 -3.20 0.00 0.00 0.00 178.15 178.37 3hhu n ASN 105 N -4.12 7.37 -3.70 1.72 4.05 0.08 -4.56 115.26 116.10 3hhu n ASN 105 Ca 0.00 -2.48 -0.25 0.00 0.45 0.00 0.00 54.58 52.30 3hhu n ASN 105 Cb 0.44 -1.40 0.06 0.00 1.23 0.00 0.00 39.78 40.10 3hhu n ASN 105 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 177.26 174.80 3hhu n ASN 106 N 3.66 -5.22 -4.07 1.20 5.03 -1.21 -2.73 115.26 111.93 3hhu n ASN 106 Ca 0.66 -0.64 -0.32 0.00 0.87 0.00 0.00 54.58 55.15 3hhu n ASN 106 Cb 0.25 -4.60 -0.01 0.00 -1.02 0.00 0.00 39.78 34.40 3hhu n ASN 106 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 3hhu n LEU 107 N -4.79 -2.09 0.00 3.41 4.32 -0.44 -1.62 117.00 115.79 3hhu n LEU 107 Ca -0.02 -0.95 0.00 0.00 -0.02 0.00 0.00 56.01 55.02 3hhu n LEU 107 Cb 0.56 -2.25 0.00 0.00 -1.62 0.00 0.00 43.42 40.11 3hhu n LEU 107 CO 0.68 0.37 0.00 0.61 -1.22 0.00 0.00 177.39 177.84 3hhu n GLY 108 N -1.62 0.64 3.96 -0.72 0.00 -0.38 -4.89 105.19 102.18 3hhu n GLY 108 Ca -0.04 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.76 3hhu n GLY 108 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3hhu s THR 109 N -2.59 5.23 -1.36 2.61 -4.23 -0.64 -5.00 115.64 109.66 3hhu s THR 109 Ca 0.00 -0.88 -0.06 0.00 -1.18 0.00 0.00 61.69 59.56 3hhu s THR 109 Cb 0.00 -3.86 0.09 0.00 1.34 0.00 0.00 72.50 70.08 3hhu s THR 109 CO 0.00 -0.36 2.44 2.30 -0.54 0.00 0.00 174.62 178.46 3hhu n ILE 110 N -1.44 5.07 -0.27 2.99 -5.35 -1.26 -4.78 119.36 114.32 3hhu n ILE 110 Ca -0.08 -4.09 -0.05 0.00 -0.27 0.00 0.00 62.75 58.26 3hhu n ILE 110 Cb 0.57 -2.17 0.06 0.00 -1.74 0.00 0.00 39.64 36.36 3hhu n ILE 110 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3hhu h ALA 111 N 4.72 0.95 0.93 -1.28 0.00 -1.87 0.16 119.26 122.86 3hhu h ALA 111 Ca 0.71 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 55.47 3hhu h ALA 111 Cb 0.32 -0.30 0.01 0.00 0.00 0.00 0.00 17.79 17.82 3hhu h ALA 111 CO 1.53 0.45 -0.45 -0.22 0.00 0.00 0.00 179.25 180.56 3hhu h LYS 112 N 1.02 -1.20 -0.13 0.00 1.63 -1.98 0.76 116.57 116.67 3hhu h LYS 112 Ca 0.26 0.08 -0.14 0.00 -0.85 0.00 0.00 60.65 60.00 3hhu h LYS 112 Cb 0.02 0.27 -0.01 0.00 -0.60 0.00 0.00 32.23 31.91 3hhu h LYS 112 CO -0.04 -0.80 -0.54 0.66 -3.45 0.00 0.00 179.45 175.28 3hhu h SER 113 N -1.30 0.40 -0.56 4.20 4.64 -1.96 -2.73 113.55 116.25 3hhu h SER 113 Ca -0.13 -0.21 -0.06 0.00 -0.47 0.00 0.00 61.79 60.92 3hhu h SER 113 Cb 0.96 -0.11 -0.02 0.00 -0.31 0.00 0.00 62.40 62.91 3hhu h SER 113 CO 0.21 0.86 0.11 1.23 -0.87 0.00 0.00 176.83 178.37 3hhu h GLY 114 N 1.27 0.98 1.11 -0.77 0.00 -0.67 -2.19 103.07 102.80 3hhu h GLY 114 Ca 0.01 -0.63 -0.07 0.00 0.00 0.00 0.00 47.33 46.63 3hhu h GLY 114 CO 0.09 0.59 0.13 -0.84 0.00 0.00 0.00 176.54 176.51 3hhu h THR 115 N 0.81 1.26 -0.19 4.70 2.02 -0.76 -0.64 112.91 120.12 3hhu h THR 115 Ca 0.17 -1.00 0.00 0.00 0.77 0.00 0.00 66.41 66.35 3hhu h THR 115 Cb 0.38 0.60 -0.01 0.00 -1.74 0.00 0.00 68.15 67.38 3hhu h THR 115 CO 0.01 0.38 0.12 0.50 0.37 0.00 0.00 175.52 176.89 3hhu h LYS 116 N 1.03 0.25 -0.20 6.66 3.64 -1.32 -1.21 116.57 125.42 3hhu h LYS 116 Ca 0.21 -0.02 -0.09 0.00 -1.27 0.00 0.00 60.65 59.48 3hhu h LYS 116 Cb 0.40 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.16 3hhu h LYS 116 CO 0.01 0.19 -0.28 0.00 -2.27 0.00 0.00 179.45 177.09 3hhu h ALA 117 N 1.05 1.15 -0.39 5.00 0.00 -1.23 -2.46 119.26 122.38 3hhu h ALA 117 Ca 0.07 -0.35 -0.05 0.00 0.00 0.00 0.00 54.91 54.58 3hhu h ALA 117 Cb -0.01 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 3hhu h ALA 117 CO -0.01 0.54 0.04 0.35 0.00 0.00 0.00 179.25 180.17 3hhu h PHE 118 N 0.34 0.71 -0.70 0.00 3.57 -0.75 -1.72 116.94 118.39 3hhu h PHE 118 Ca 0.05 -0.11 -0.07 0.00 3.53 0.00 0.00 57.97 61.37 3hhu h PHE 118 Cb 0.67 -0.19 -0.03 0.00 2.79 0.00 0.00 35.95 39.19 3hhu h PHE 118 CO 0.02 0.71 0.17 0.52 -2.23 0.00 0.00 178.31 177.50 3hhu h MET 119 N 0.49 1.12 -0.41 1.11 2.86 -1.05 -1.24 114.93 117.81 3hhu h MET 119 Ca 0.11 -0.27 -0.06 0.00 -2.06 0.00 0.00 59.70 57.43 3hhu h MET 119 Cb 0.41 -0.15 -0.02 0.00 0.06 0.00 0.00 31.60 31.90 3hhu h MET 119 CO 0.01 0.99 0.00 0.93 1.06 0.00 0.00 176.91 179.90 3hhu h GLU 120 N 1.07 0.67 -0.20 1.72 5.08 -1.33 -2.53 114.58 119.06 3hhu h GLU 120 Ca 0.22 -0.16 -0.12 0.00 -1.00 0.00 0.00 59.36 58.30 3hhu h GLU 120 Cb 0.37 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.52 3hhu h GLU 120 CO 0.00 0.68 -0.39 0.00 -1.00 0.00 0.00 179.01 178.31 3hhu h ALA 121 N 1.38 0.97 0.00 3.43 0.00 -0.63 -2.55 119.26 121.85 3hhu h ALA 121 Ca 0.13 -0.42 -0.02 0.00 0.00 0.00 0.00 54.91 54.60 3hhu h ALA 121 Cb 0.39 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 3hhu h ALA 121 CO 0.01 0.62 -0.11 -0.07 0.00 0.00 0.00 179.25 179.70 3hhu h LEU 122 N 0.37 0.00 0.00 0.00 3.38 -0.82 0.20 115.31 118.44 3hhu h LEU 122 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 3hhu h LEU 122 Cb 0.85 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.60 3hhu h LEU 122 CO 0.07 0.11 -0.33 1.56 0.09 0.00 0.00 178.44 179.94 3hhu h GLN 123 N 0.00 0.00 -0.47 1.13 1.08 -1.26 -3.31 115.11 112.28 3hhu h GLN 123 Ca -0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 3hhu h GLN 123 Cb 0.39 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.82 3hhu h GLN 123 CO 0.01 0.00 0.00 0.00 -0.95 0.00 0.00 178.83 177.89 3hhu n ALA 124 N -1.91 2.37 0.00 3.87 0.00 -0.38 -4.93 120.51 119.53 3hhu n ALA 124 Ca 0.04 -1.09 0.00 0.00 0.00 0.00 0.00 53.44 52.39 3hhu n ALA 124 Cb 0.47 -0.79 0.00 0.00 0.00 0.00 0.00 19.45 19.13 3hhu n ALA 124 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hhu n GLY 125 N 1.35 0.91 3.81 0.00 0.00 -0.98 -5.06 105.19 105.22 3hhu n GLY 125 Ca 0.19 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.90 3hhu n GLY 125 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hhu s ALA 126 N -2.00 2.64 0.48 4.61 0.00 -0.08 -5.00 121.76 122.41 3hhu s ALA 126 Ca 0.00 0.12 0.02 0.00 0.00 0.00 0.00 51.96 52.10 3hhu s ALA 126 Cb 0.00 -3.19 -0.01 0.00 0.00 0.00 0.00 23.12 19.92 3hhu s ALA 126 CO 0.00 -1.26 0.06 0.16 0.00 0.00 0.00 175.76 174.72 3hhu s ASP 127 N -3.71 3.60 0.55 0.00 -4.77 -1.26 -4.46 116.67 106.63 3hhu s ASP 127 Ca 0.59 -1.69 0.23 0.00 -3.30 0.00 0.00 52.55 48.38 3hhu s ASP 127 Cb -0.14 0.57 1.52 0.00 -1.09 0.00 0.00 42.92 43.78 3hhu s ASP 127 CO 0.54 -0.92 2.16 0.40 0.70 0.00 0.00 175.17 178.06 3hhu h ILE 128 N 1.51 0.74 0.00 2.11 2.04 -2.00 -1.78 117.51 120.12 3hhu h ILE 128 Ca -0.40 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.46 3hhu h ILE 128 Cb 1.30 0.95 0.00 0.00 -0.74 0.00 0.00 36.82 38.33 3hhu h ILE 128 CO 0.66 0.00 0.00 -1.54 0.00 0.00 0.00 178.15 177.27 3hhu n SER 129 N -4.18 0.48 -0.43 1.72 3.41 -1.26 -1.57 113.62 111.79 3hhu n SER 129 Ca -0.01 0.64 0.09 0.00 -0.26 0.00 0.00 58.87 59.33 3hhu n SER 129 Cb 0.17 -0.73 0.36 0.00 -0.26 0.00 0.00 64.21 63.75 3hhu n SER 129 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 3hhu n MET 130 N -2.05 1.57 -0.31 4.33 2.81 -0.67 -4.43 117.12 118.36 3hhu n MET 130 Ca 0.02 -0.86 0.07 0.00 -1.81 0.00 0.00 57.70 55.13 3hhu n MET 130 Cb 0.18 -1.34 0.28 0.00 -0.71 0.00 0.00 33.22 31.63 3hhu n MET 130 CO 0.00 0.00 0.00 0.97 1.51 0.00 0.00 175.97 178.45 3hhu h ILE 131 N 1.66 0.95 0.00 2.02 2.10 -1.47 -1.09 117.51 121.67 3hhu h ILE 131 Ca 0.00 -0.31 0.00 0.00 1.08 0.00 0.00 64.86 65.63 3hhu h ILE 131 Cb 0.37 -0.04 0.00 0.00 -1.09 0.00 0.00 36.82 36.05 3hhu h ILE 131 CO 0.00 0.17 0.00 1.23 -1.08 0.00 0.00 178.15 178.47 3hhu h GLY 132 N 0.91 0.00 2.00 8.18 0.00 -1.85 -2.20 103.07 110.12 3hhu h GLY 132 Ca 0.44 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.77 3hhu h GLY 132 CO -0.20 0.00 0.00 -1.06 0.00 0.00 0.00 176.54 175.28 3hhu n GLN 133 N -2.48 0.04 -0.05 4.80 6.02 -0.41 -2.98 117.38 122.31 3hhu n GLN 133 Ca 0.01 0.24 0.02 0.00 -0.01 0.00 0.00 57.00 57.26 3hhu n GLN 133 Cb 0.22 -1.57 0.04 0.00 1.02 0.00 0.00 30.24 29.95 3hhu n GLN 133 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 3hhu n PHE 134 N -1.65 0.13 -0.59 1.08 3.72 -0.83 -4.99 117.46 114.34 3hhu n PHE 134 Ca 0.04 -0.51 0.00 0.00 -0.05 0.00 0.00 57.45 56.93 3hhu n PHE 134 Cb 0.21 -0.05 0.00 0.00 -0.94 0.00 0.00 39.48 38.71 3hhu n PHE 134 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3hhu n GLY 135 N -0.23 0.77 0.51 1.37 0.00 -1.16 -4.36 105.19 102.10 3hhu n GLY 135 Ca 0.03 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.12 3hhu n GLY 135 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3hhu n VAL 136 N -2.17 2.15 0.23 1.61 0.24 -1.25 -4.49 118.33 114.66 3hhu n VAL 136 Ca 0.00 -2.76 0.15 0.00 -2.04 0.00 0.00 64.34 59.69 3hhu n VAL 136 Cb 0.00 -0.25 0.81 0.00 -1.47 0.00 0.00 33.84 32.93 3hhu n VAL 136 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 3hhu h GLY 137 N 0.72 0.00 0.20 7.63 0.00 -1.84 -2.66 103.07 107.11 3hhu h GLY 137 Ca 0.03 0.00 0.17 0.00 0.00 0.00 0.00 47.33 47.53 3hhu h GLY 137 CO 0.07 0.00 0.55 -2.75 0.00 0.00 0.00 176.54 174.41 3hhu h PHE 138 N 0.00 0.98 0.00 5.60 3.57 -1.85 -1.57 116.94 123.66 3hhu h PHE 138 Ca 0.05 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.59 3hhu h PHE 138 Cb 0.27 -0.29 0.00 0.00 2.79 0.00 0.00 35.95 38.72 3hhu h PHE 138 CO 0.00 0.24 0.00 0.66 -2.23 0.00 0.00 178.31 176.98 3hhu n TYR 139 N -4.79 0.01 0.29 0.41 4.01 -1.00 -1.32 117.16 114.77 3hhu n TYR 139 Ca 0.21 0.00 0.05 0.00 -0.16 0.00 0.00 57.90 58.00 3hhu n TYR 139 Cb 0.50 -0.50 0.24 0.00 -0.31 0.00 0.00 39.34 39.27 3hhu n TYR 139 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 3hhu n SER 140 N -1.51 0.11 0.22 7.72 3.41 -0.59 -2.11 113.62 120.87 3hhu n SER 140 Ca 0.04 0.54 0.12 0.00 -0.26 0.00 0.00 58.87 59.31 3hhu n SER 140 Cb 0.19 -0.55 0.72 0.00 -0.26 0.00 0.00 64.21 64.31 3hhu n SER 140 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3hhu h ALA 141 N 2.26 1.97 0.00 7.33 0.00 -1.39 -1.34 119.26 128.09 3hhu h ALA 141 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3hhu h ALA 141 Cb 0.15 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.95 3hhu h ALA 141 CO 0.00 -0.13 0.00 0.66 0.00 0.00 0.00 179.25 179.78 3hhu n TYR 142 N -4.31 0.00 0.20 0.00 4.01 -0.90 -1.51 117.16 114.66 3hhu n TYR 142 Ca -0.01 0.00 0.04 0.00 -0.16 0.00 0.00 57.90 57.77 3hhu n TYR 142 Cb 0.19 0.00 0.42 0.00 -0.31 0.00 0.00 39.34 39.64 3hhu n TYR 142 CO 0.00 0.00 0.00 -0.07 -0.46 0.00 0.00 176.86 176.33 3hhu h LEU 143 N 0.00 0.00 0.00 7.72 3.38 -1.45 -3.38 115.31 121.58 3hhu h LEU 143 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3hhu h LEU 143 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 3hhu h LEU 143 CO 0.00 0.31 -0.58 1.33 0.09 0.00 0.00 178.44 179.58 3hhu n VAL 144 N -4.11 0.00 -4.49 1.22 0.24 -0.83 -5.03 118.33 105.33 3hhu n VAL 144 Ca -0.02 -0.07 -0.34 0.00 -2.04 0.00 0.00 64.34 61.87 3hhu n VAL 144 Cb 0.35 0.48 -0.11 0.00 -1.47 0.00 0.00 33.84 33.09 3hhu n VAL 144 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3hhu s ALA 145 N -1.30 3.06 -0.24 2.33 0.00 -0.57 -0.71 121.76 124.34 3hhu s ALA 145 Ca 0.00 -0.85 0.19 0.00 0.00 0.00 0.00 51.96 51.30 3hhu s ALA 145 Cb 0.00 -1.39 0.09 0.00 0.00 0.00 0.00 23.12 21.82 3hhu s ALA 145 CO 0.00 0.47 1.32 1.05 0.00 0.00 0.00 175.76 178.60 3hhu h GLU 146 N 5.67 0.00 -3.39 0.00 4.11 -1.25 -3.41 114.58 116.31 3hhu h GLU 146 Ca -0.44 0.00 -0.16 0.00 0.07 0.00 0.00 59.36 58.84 3hhu h GLU 146 Cb 1.18 0.00 -0.23 0.00 0.50 0.00 0.00 28.75 30.21 3hhu h GLU 146 CO 0.56 0.26 -0.48 0.21 0.07 0.00 0.00 179.01 179.63 3hhu s LYS 147 N -3.08 0.40 -0.05 1.06 2.20 -1.20 -4.48 119.74 114.60 3hhu s LYS 147 Ca 0.03 -0.13 0.03 0.00 -0.36 0.00 0.00 55.97 55.54 3hhu s LYS 147 Cb 0.07 0.17 0.01 0.00 -1.51 0.00 0.00 37.83 36.57 3hhu s LYS 147 CO 0.74 -0.09 -0.12 0.08 -0.36 0.00 0.00 175.35 175.60 3hhu s VAL 148 N -0.81 1.09 -0.14 4.02 1.01 -0.73 -1.26 120.40 123.58 3hhu s VAL 148 Ca -0.09 -0.50 0.01 0.00 0.00 0.00 0.00 61.98 61.41 3hhu s VAL 148 Cb -0.05 -0.97 -0.00 0.00 0.00 0.00 0.00 36.38 35.35 3hhu s VAL 148 CO 0.01 0.33 -0.17 -0.89 0.00 0.00 0.00 175.10 174.38 3hhu s THR 149 N 0.37 2.57 -0.27 3.92 2.01 -0.64 -1.94 115.64 121.65 3hhu s THR 149 Ca -0.08 -0.82 -0.01 0.00 0.31 0.00 0.00 61.69 61.09 3hhu s THR 149 Cb -0.13 -2.06 0.04 0.00 0.01 0.00 0.00 72.50 70.37 3hhu s THR 149 CO 0.02 0.53 -0.05 -0.69 -0.69 0.00 0.00 174.62 173.75 3hhu s VAL 150 N 0.62 2.76 -0.18 3.82 1.01 0.56 -0.24 120.40 128.75 3hhu s VAL 150 Ca -0.09 -1.32 -0.07 0.00 0.00 0.00 0.00 61.98 60.49 3hhu s VAL 150 Cb -0.16 -2.53 -0.04 0.00 0.00 0.00 0.00 36.38 33.65 3hhu s VAL 150 CO 0.03 0.01 0.05 -0.63 0.00 0.00 0.00 175.10 174.56 3hhu s ILE 151 N 1.24 4.63 0.02 2.22 1.01 -0.05 -0.65 121.20 129.62 3hhu s ILE 151 Ca -0.04 -0.09 -0.03 0.00 0.00 0.00 0.00 60.65 60.48 3hhu s ILE 151 Cb -0.19 -3.08 -0.01 0.00 0.01 0.00 0.00 42.46 39.19 3hhu s ILE 151 CO -0.03 0.46 0.05 0.28 0.00 0.00 0.00 174.94 175.70 3hhu s THR 152 N 0.40 0.10 -0.09 2.92 -1.32 -0.75 0.40 115.64 117.31 3hhu s THR 152 Ca 0.02 -0.87 -0.03 0.00 -1.21 0.00 0.00 61.69 59.61 3hhu s THR 152 Cb -0.13 -0.41 0.04 0.00 -1.51 0.00 0.00 72.50 70.49 3hhu s THR 152 CO 0.01 -0.48 0.06 -0.75 -2.21 0.00 0.00 174.62 171.25 3hhu s LYS 153 N -1.60 0.12 0.07 7.08 2.47 0.31 -2.23 119.74 125.97 3hhu s LYS 153 Ca -0.14 0.16 0.02 0.00 -1.56 0.00 0.00 55.97 54.45 3hhu s LYS 153 Cb -0.08 -1.04 -0.04 0.00 -1.46 0.00 0.00 37.83 35.21 3hhu s LYS 153 CO -0.01 -0.44 0.12 -1.58 0.16 0.00 0.00 175.35 173.61 3hhu s HIS 154 N 2.11 3.29 0.55 4.03 5.65 -1.25 -1.17 115.29 128.50 3hhu s HIS 154 Ca 0.04 0.14 0.24 0.00 0.25 0.00 0.00 55.06 55.73 3hhu s HIS 154 Cb -0.13 -1.67 1.49 0.00 -1.18 0.00 0.00 32.58 31.09 3hhu s HIS 154 CO -0.05 0.54 2.10 -0.91 -0.65 0.00 0.00 174.74 175.77 3hhu h ASN 155 N 3.28 0.00 -0.28 9.88 2.35 -1.91 -2.39 115.58 126.50 3hhu h ASN 155 Ca -0.46 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.29 3hhu h ASN 155 Cb 1.16 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.53 3hhu h ASN 155 CO 0.69 0.00 0.00 0.47 -1.65 0.00 0.00 177.43 176.94 3hhu n ASP 156 N -4.18 2.66 -3.13 5.81 8.00 -1.26 -4.97 116.55 119.49 3hhu n ASP 156 Ca 0.02 -1.88 -0.15 0.00 0.71 0.00 0.00 54.79 53.50 3hhu n ASP 156 Cb 0.32 -0.18 -0.03 0.00 -0.02 0.00 0.00 41.12 41.21 3hhu n ASP 156 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3hhu s ASP 157 N -1.53 0.95 0.74 -2.24 -1.08 -0.90 -5.08 116.67 107.53 3hhu s ASP 157 Ca 0.35 -1.51 -0.04 0.00 -0.52 0.00 0.00 52.55 50.83 3hhu s ASP 157 Cb 0.20 0.69 0.12 0.00 -1.46 0.00 0.00 42.92 42.47 3hhu s ASP 157 CO 0.29 -1.35 1.03 -1.61 0.52 0.00 0.00 175.17 174.05 3hhu s GLU 158 N -2.89 1.68 -0.04 4.34 0.41 -1.26 -4.42 118.70 116.52 3hhu s GLU 158 Ca 0.30 -0.78 -0.27 0.00 -0.41 0.00 0.00 54.97 53.81 3hhu s GLU 158 Cb -0.01 -2.23 -0.03 0.00 -1.78 0.00 0.00 34.13 30.08 3hhu s GLU 158 CO 0.21 -1.51 0.85 -1.14 -0.49 0.00 0.00 175.26 173.18 3hhu s GLN 159 N -5.26 4.49 0.12 1.61 0.74 -1.26 -4.56 119.66 115.53 3hhu s GLN 159 Ca 0.66 1.15 0.05 0.00 0.05 0.00 0.00 55.36 57.27 3hhu s GLN 159 Cb -0.07 -3.46 -0.04 0.00 1.10 0.00 0.00 33.01 30.54 3hhu s GLN 159 CO 0.45 -0.02 -0.13 0.71 -0.55 0.00 0.00 175.29 175.75 3hhu s TYR 160 N 1.00 1.34 -0.16 1.67 2.02 -0.94 -1.37 117.35 120.91 3hhu s TYR 160 Ca 0.45 -0.57 0.02 0.00 -0.37 0.00 0.00 57.07 56.60 3hhu s TYR 160 Cb -0.19 -0.71 0.02 0.00 -0.40 0.00 0.00 41.96 40.68 3hhu s TYR 160 CO 0.22 0.12 -0.20 0.00 -1.57 0.00 0.00 175.55 174.12 3hhu s ALA 161 N -2.14 2.21 -0.01 3.71 0.00 0.50 -1.81 121.76 124.23 3hhu s ALA 161 Ca 0.08 -1.10 -0.03 0.00 0.00 0.00 0.00 51.96 50.91 3hhu s ALA 161 Cb -0.05 -1.07 -0.04 0.00 0.00 0.00 0.00 23.12 21.97 3hhu s ALA 161 CO 0.02 -0.20 0.18 -0.46 0.00 0.00 0.00 175.76 175.31 3hhu s TRP 162 N 1.09 3.55 -0.12 0.00 -0.00 0.18 -1.49 118.94 122.14 3hhu s TRP 162 Ca -0.01 0.35 -0.17 0.00 -0.00 0.00 0.00 56.10 56.27 3hhu s TRP 162 Cb -0.14 -1.83 0.04 0.00 -0.00 0.00 0.00 33.47 31.55 3hhu s TRP 162 CO -0.07 0.64 0.44 -2.00 -0.00 0.00 0.00 176.95 175.96 3hhu s GLU 163 N -1.97 0.61 -0.22 5.86 2.12 -0.56 -0.32 118.70 124.21 3hhu s GLU 163 Ca 0.28 0.41 -0.19 0.00 0.36 0.00 0.00 54.97 55.83 3hhu s GLU 163 Cb -0.13 0.29 0.06 0.00 0.26 0.00 0.00 34.13 34.61 3hhu s GLU 163 CO 0.19 -0.11 0.58 0.45 -0.54 0.00 0.00 175.26 175.83 3hhu s SER 164 N -0.24 -0.63 -0.34 -1.70 0.15 -0.82 -0.82 113.70 109.29 3hhu s SER 164 Ca -0.04 1.18 0.08 0.00 0.70 0.00 0.00 55.95 57.87 3hhu s SER 164 Cb -0.03 1.17 0.59 0.00 -1.71 0.00 0.00 66.02 66.04 3hhu s SER 164 CO 0.02 -0.21 1.66 -1.20 1.20 0.00 0.00 173.24 174.72 3hhu n SER 165 N 3.06 3.27 0.00 5.45 7.64 -1.26 -1.77 113.62 130.01 3hhu n SER 165 Ca -0.15 -3.61 0.00 0.00 1.01 0.00 0.00 58.87 56.12 3hhu n SER 165 Cb 0.56 -0.71 0.00 0.00 -1.01 0.00 0.00 64.21 63.05 3hhu n SER 165 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3hhu n ALA 166 N -0.99 0.00 -0.98 -0.43 0.00 -1.26 -4.90 120.51 111.94 3hhu n ALA 166 Ca 0.43 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.87 3hhu n ALA 166 Cb 1.29 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.74 3hhu n ALA 166 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hhu n GLY 167 N 0.00 0.26 0.00 0.00 0.00 -1.26 -3.37 105.19 100.81 3hhu n GLY 167 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3hhu n GLY 167 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hhu n GLY 168 N -1.01 0.39 3.16 -0.02 0.00 -1.26 -5.07 105.19 101.38 3hhu n GLY 168 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 3hhu n GLY 168 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3hhu s SER 169 N -2.32 1.09 0.12 1.61 1.04 -1.22 -1.47 113.70 112.55 3hhu s SER 169 Ca 0.00 -0.97 -0.00 0.00 0.48 0.00 0.00 55.95 55.46 3hhu s SER 169 Cb 0.00 0.10 -0.04 0.00 0.10 0.00 0.00 66.02 66.17 3hhu s SER 169 CO 0.00 -0.45 0.01 0.72 0.98 0.00 0.00 173.24 174.50 3hhu s PHE 170 N -3.47 0.86 0.18 5.02 -0.12 -0.51 -4.41 117.98 115.53 3hhu s PHE 170 Ca 0.10 -1.12 0.11 0.00 -0.05 0.00 0.00 56.93 55.97 3hhu s PHE 170 Cb 0.04 -0.51 -0.04 0.00 -0.63 0.00 0.00 43.02 41.88 3hhu s PHE 170 CO -0.05 -0.38 -0.23 0.95 -0.05 0.00 0.00 175.22 175.47 3hhu s THR 171 N -3.89 2.46 -0.04 -4.49 -4.23 0.00 -0.63 115.64 104.82 3hhu s THR 171 Ca 0.19 -1.91 0.02 0.00 -1.18 0.00 0.00 61.69 58.80 3hhu s THR 171 Cb 0.07 -2.16 0.01 0.00 1.34 0.00 0.00 72.50 71.76 3hhu s THR 171 CO -0.01 -0.07 -0.09 -0.69 -0.54 0.00 0.00 174.62 173.23 3hhu s VAL 172 N -1.54 0.80 0.09 2.29 1.01 -0.24 -1.50 120.40 121.31 3hhu s VAL 172 Ca 0.20 -0.33 -0.02 0.00 0.00 0.00 0.00 61.98 61.83 3hhu s VAL 172 Cb -0.09 -0.74 -0.04 0.00 0.00 0.00 0.00 36.38 35.52 3hhu s VAL 172 CO 0.10 0.26 0.03 0.00 0.00 0.00 0.00 175.10 175.49 3hhu s ARG 173 N 0.48 0.77 0.51 2.72 1.70 -0.55 -1.84 118.95 122.74 3hhu s ARG 173 Ca -0.08 -1.28 -0.21 0.00 -0.47 0.00 0.00 55.73 53.69 3hhu s ARG 173 Cb -0.12 0.24 -0.06 0.00 -0.57 0.00 0.00 34.95 34.44 3hhu s ARG 173 CO 0.01 -0.19 1.16 0.95 -1.08 0.00 0.00 175.30 176.15 3hhu s THR 174 N -3.97 3.05 -0.12 4.99 -4.23 -1.26 -0.37 115.64 113.74 3hhu s THR 174 Ca 0.14 0.72 0.03 0.00 -1.18 0.00 0.00 61.69 61.40 3hhu s THR 174 Cb 0.07 -3.32 0.00 0.00 1.34 0.00 0.00 72.50 70.59 3hhu s THR 174 CO -0.05 -0.08 -0.23 -0.62 -0.54 0.00 0.00 174.62 173.10 3hhu s ASP 175 N -1.55 3.13 0.07 3.99 2.15 -0.47 -4.66 116.67 119.33 3hhu s ASP 175 Ca 0.69 -0.57 -0.01 0.00 0.43 0.00 0.00 52.55 53.09 3hhu s ASP 175 Cb -0.27 -1.43 -0.04 0.00 -0.30 0.00 0.00 42.92 40.88 3hhu s ASP 175 CO 0.31 0.13 -0.01 0.42 -0.17 0.00 0.00 175.17 175.85 3hhu s THR 176 N 0.55 0.19 0.00 1.71 -4.23 -1.26 -4.69 115.64 107.90 3hhu s THR 176 Ca -0.14 -1.83 0.00 0.00 -1.18 0.00 0.00 61.69 58.54 3hhu s THR 176 Cb -0.17 -1.65 0.00 0.00 1.34 0.00 0.00 72.50 72.02 3hhu s THR 176 CO 0.04 -0.86 0.00 0.61 -0.54 0.00 0.00 174.62 173.87 3hhu n GLY 177 N 0.06 2.79 2.36 3.99 0.00 -1.26 -4.93 105.19 108.21 3hhu n GLY 177 Ca -0.12 -0.97 -0.26 0.00 0.00 0.00 0.00 46.02 44.67 3hhu n GLY 177 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3hhu n GLU 178 N 0.00 0.53 -1.80 1.61 1.02 -1.26 -5.12 120.64 115.62 3hhu n GLU 178 Ca 0.00 -3.33 -0.42 0.00 -0.02 0.00 0.00 57.16 53.40 3hhu n GLU 178 Cb 0.00 -1.59 -0.03 0.00 -0.02 0.00 0.00 31.44 29.80 3hhu n GLU 178 CO 0.00 0.00 0.00 -2.14 1.18 0.00 0.00 177.13 176.17 3hhu s PRO 179 N -0.51 4.15 0.13 3.49 0.02 -1.26 -5.03 135.00 135.99 3hhu s PRO 179 Ca 0.33 2.52 -0.02 0.00 0.02 0.00 0.00 61.00 63.86 3hhu s PRO 179 Cb 0.08 -3.09 -0.05 0.00 0.02 0.00 0.00 34.50 31.46 3hhu s PRO 179 CO -0.16 -0.69 0.32 0.00 -0.33 0.00 0.00 177.00 176.13 3hhu s MET 180 N 0.94 3.53 0.05 5.54 0.23 -1.26 -5.03 119.30 123.30 3hhu s MET 180 Ca 0.72 -0.28 -0.25 0.00 -1.03 0.00 0.00 55.69 54.85 3hhu s MET 180 Cb -0.48 -2.92 -0.17 0.00 -1.53 0.00 0.00 34.83 29.74 3hhu s MET 180 CO 0.34 0.51 1.56 0.78 -2.03 0.00 0.00 175.02 176.17 3hhu h GLY 181 N 2.72 -0.09 -5.59 3.16 0.00 -1.96 -3.47 103.07 97.84 3hhu h GLY 181 Ca -0.46 0.03 0.11 0.00 0.00 0.00 0.00 47.33 47.01 3hhu h GLY 181 CO 0.73 -0.03 0.62 -1.60 0.00 0.00 0.00 176.54 176.25 3hhu s ARG 182 N -5.51 0.33 0.00 4.80 3.52 -1.25 -4.87 118.95 115.98 3hhu s ARG 182 Ca -0.14 0.39 0.00 0.00 -0.13 0.00 0.00 55.73 55.85 3hhu s ARG 182 Cb 0.04 0.16 0.00 0.00 -1.56 0.00 0.00 34.95 33.60 3hhu s ARG 182 CO 0.65 -0.04 0.00 0.41 -0.81 0.00 0.00 175.30 175.51 3hhu n GLY 183 N 1.96 0.79 2.90 8.12 0.00 -0.32 -4.43 105.19 114.21 3hhu n GLY 183 Ca -0.12 -2.06 -0.13 0.00 0.00 0.00 0.00 46.02 43.72 3hhu n GLY 183 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3hhu s THR 184 N -1.66 0.11 -0.18 2.61 2.01 -0.88 -0.53 115.64 117.12 3hhu s THR 184 Ca 0.00 -0.13 0.01 0.00 0.31 0.00 0.00 61.69 61.87 3hhu s THR 184 Cb 0.00 -0.11 0.03 0.00 0.01 0.00 0.00 72.50 72.42 3hhu s THR 184 CO 0.00 -0.02 -0.14 -0.75 -0.69 0.00 0.00 174.62 173.02 3hhu s LYS 185 N -0.16 2.39 -0.32 4.92 2.20 0.16 -1.06 119.74 127.88 3hhu s LYS 185 Ca -0.01 -0.75 -0.10 0.00 -0.36 0.00 0.00 55.97 54.76 3hhu s LYS 185 Cb -0.01 -2.35 -0.00 0.00 -1.51 0.00 0.00 37.83 33.95 3hhu s LYS 185 CO -0.00 -0.30 0.15 0.08 -0.36 0.00 0.00 175.35 174.92 3hhu s VAL 186 N 1.39 4.58 -0.36 4.02 1.01 0.43 -0.87 120.40 130.60 3hhu s VAL 186 Ca 0.02 -0.47 -0.12 0.00 0.00 0.00 0.00 61.98 61.42 3hhu s VAL 186 Cb -0.14 -3.35 0.00 0.00 0.00 0.00 0.00 36.38 32.89 3hhu s VAL 186 CO -0.10 0.04 0.23 -0.63 0.00 0.00 0.00 175.10 174.64 3hhu s ILE 187 N 1.60 4.97 -0.41 2.22 1.01 0.67 -0.83 121.20 130.43 3hhu s ILE 187 Ca 0.04 -0.49 -0.19 0.00 0.00 0.00 0.00 60.65 60.01 3hhu s ILE 187 Cb -0.17 -3.64 0.02 0.00 0.01 0.00 0.00 42.46 38.68 3hhu s ILE 187 CO 0.06 -0.10 0.52 -0.76 0.00 0.00 0.00 174.94 174.66 3hhu s LEU 188 N 1.65 4.63 -0.69 2.97 1.43 0.33 -1.63 118.68 127.37 3hhu s LEU 188 Ca 0.05 -0.42 -0.24 0.00 -1.03 0.00 0.00 54.13 52.48 3hhu s LEU 188 Cb -0.18 -2.54 0.05 0.00 0.03 0.00 0.00 46.19 43.55 3hhu s LEU 188 CO 0.09 -0.62 1.10 -1.00 0.23 0.00 0.00 176.35 176.14 3hhu s HIS 189 N 2.42 2.51 0.41 0.29 3.76 -0.39 -1.68 115.29 122.61 3hhu s HIS 189 Ca 0.17 -0.35 -0.24 0.00 -0.15 0.00 0.00 55.06 54.49 3hhu s HIS 189 Cb -0.16 -4.43 -0.09 0.00 1.11 0.00 0.00 32.58 29.01 3hhu s HIS 189 CO 0.15 -1.83 1.10 -0.51 -0.85 0.00 0.00 174.74 172.80 3hhu s LEU 190 N 4.76 4.15 0.78 0.89 1.43 -0.88 -0.84 118.68 128.96 3hhu s LEU 190 Ca 0.28 2.16 -0.13 0.00 -1.03 0.00 0.00 54.13 55.41 3hhu s LEU 190 Cb -0.13 -4.14 0.07 0.00 0.03 0.00 0.00 46.19 42.02 3hhu s LEU 190 CO 0.12 -0.60 1.16 -0.54 0.23 0.00 0.00 176.35 176.73 3hhu s LYS 191 N -2.44 1.94 0.51 1.70 1.02 0.12 -4.62 119.74 117.96 3hhu s LYS 191 Ca 0.58 1.57 0.15 0.00 0.02 0.00 0.00 55.97 58.29 3hhu s LYS 191 Cb -0.25 -1.83 1.23 0.00 -0.52 0.00 0.00 37.83 36.45 3hhu s LYS 191 CO 0.32 -1.95 2.14 1.49 -0.92 0.00 0.00 175.35 176.42 3hhu h GLU 192 N -0.80 0.04 -0.68 1.68 4.81 -1.95 -1.80 114.58 115.88 3hhu h GLU 192 Ca -0.46 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.77 3hhu h GLU 192 Cb 1.27 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.64 3hhu h GLU 192 CO 0.48 0.04 0.00 -0.40 -0.73 0.00 0.00 179.01 178.40 3hhu n ASP 193 N -4.53 4.72 -0.52 1.04 5.75 -1.26 -4.32 116.55 117.42 3hhu n ASP 193 Ca -0.03 -2.38 0.06 0.00 -0.01 0.00 0.00 54.79 52.43 3hhu n ASP 193 Cb 0.09 -0.58 0.19 0.00 -1.03 0.00 0.00 41.12 39.80 3hhu n ASP 193 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3hhu n GLN 194 N 1.25 1.58 0.00 0.11 1.13 -0.68 -4.77 117.38 116.00 3hhu n GLN 194 Ca 0.26 -3.08 0.13 0.00 -1.94 0.00 0.00 57.00 52.37 3hhu n GLN 194 Cb 0.86 -1.62 0.73 0.00 0.11 0.00 0.00 30.24 30.33 3hhu n GLN 194 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 3hhu n THR 195 N -1.19 0.03 0.28 5.09 -2.24 -1.26 -3.01 114.28 111.99 3hhu n THR 195 Ca 0.20 0.01 0.14 0.00 -2.27 0.00 0.00 64.05 62.13 3hhu n THR 195 Cb 0.72 -0.61 0.83 0.00 -2.10 0.00 0.00 70.33 69.17 3hhu n THR 195 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 3hhu h GLU 196 N 0.00 0.00 -0.06 -0.78 4.11 -1.95 -2.14 114.58 113.75 3hhu h GLU 196 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 3hhu h GLU 196 Cb 0.03 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.28 3hhu h GLU 196 CO 0.00 0.07 0.00 0.66 0.07 0.00 0.00 179.01 179.81 3hhu n TYR 197 N -3.67 0.08 0.83 2.06 4.01 -1.16 -2.07 117.16 117.23 3hhu n TYR 197 Ca -0.02 -0.04 0.09 0.00 -0.16 0.00 0.00 57.90 57.77 3hhu n TYR 197 Cb 0.17 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.14 3hhu n TYR 197 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 3hhu n LEU 198 N -0.39 1.24 -4.73 7.72 4.77 -0.81 -4.82 117.00 119.99 3hhu n LEU 198 Ca 0.07 -0.61 -0.40 0.00 -0.03 0.00 0.00 56.01 55.03 3hhu n LEU 198 Cb 0.08 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.13 3hhu n LEU 198 CO 0.05 0.26 0.52 -1.61 -1.33 0.00 0.00 177.39 175.28 3hhu s GLU 199 N -2.43 4.54 0.19 3.23 0.41 -0.88 -4.87 118.70 118.87 3hhu s GLU 199 Ca 0.10 1.16 -0.12 0.00 -0.41 0.00 0.00 54.97 55.70 3hhu s GLU 199 Cb 0.14 -3.39 0.14 0.00 -1.78 0.00 0.00 34.13 29.25 3hhu s GLU 199 CO 0.62 0.21 1.81 1.49 -0.49 0.00 0.00 175.26 178.89 3hhu h GLU 200 N 5.89 0.59 0.00 1.61 4.81 -1.93 -1.97 114.58 123.58 3hhu h GLU 200 Ca -0.43 -0.04 -0.10 0.00 -0.13 0.00 0.00 59.36 58.66 3hhu h GLU 200 Cb 1.21 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 30.44 3hhu h GLU 200 CO 0.72 0.39 -0.48 0.07 -0.73 0.00 0.00 179.01 178.98 3hhu h ARG 201 N 0.61 0.00 -0.26 1.92 0.11 -1.94 -1.58 114.38 113.23 3hhu h ARG 201 Ca 0.23 0.00 -0.13 0.00 0.10 0.00 0.00 59.98 60.18 3hhu h ARG 201 Cb 0.08 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.16 3hhu h ARG 201 CO -0.13 0.48 -0.35 -0.09 0.10 0.00 0.00 179.97 179.98 3hhu h ARG 202 N 0.00 0.71 -0.34 0.08 9.65 -1.70 -1.99 114.38 120.79 3hhu h ARG 202 Ca -0.00 -0.41 -0.04 0.00 -1.10 0.00 0.00 59.98 58.43 3hhu h ARG 202 Cb 0.87 0.03 -0.01 0.00 -1.39 0.00 0.00 29.97 29.47 3hhu h ARG 202 CO 0.06 1.02 0.06 0.82 2.80 0.00 0.00 179.97 184.74 3hhu h ILE 203 N 0.44 1.23 -0.73 1.20 2.04 -1.16 -1.86 117.51 118.66 3hhu h ILE 203 Ca 0.03 -0.81 0.06 0.00 1.00 0.00 0.00 64.86 65.14 3hhu h ILE 203 Cb 0.94 1.12 -0.06 0.00 -0.74 0.00 0.00 36.82 38.08 3hhu h ILE 203 CO 0.08 0.27 0.43 0.11 0.00 0.00 0.00 178.15 179.04 3hhu h LYS 204 N 0.39 0.76 -0.61 2.37 1.57 -1.32 -1.31 116.57 118.42 3hhu h LYS 204 Ca 0.10 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.82 3hhu h LYS 204 Cb 0.34 -0.17 -0.03 0.00 0.08 0.00 0.00 32.23 32.45 3hhu h LYS 204 CO 0.01 0.50 0.32 1.49 -0.57 0.00 0.00 179.45 181.20 3hhu h GLU 205 N 0.78 0.86 -0.24 3.15 4.81 -1.06 -1.81 114.58 121.08 3hhu h GLU 205 Ca 0.32 -0.11 -0.19 0.00 -0.13 0.00 0.00 59.36 59.26 3hhu h GLU 205 Cb 0.18 -0.17 -0.00 0.00 0.63 0.00 0.00 28.75 29.39 3hhu h GLU 205 CO -0.18 0.67 -0.58 0.82 -0.73 0.00 0.00 179.01 179.01 3hhu h ILE 206 N 0.84 1.29 -0.60 2.32 2.04 -0.90 -1.51 117.51 120.99 3hhu h ILE 206 Ca 0.21 -1.79 -0.00 0.00 1.00 0.00 0.00 64.86 64.28 3hhu h ILE 206 Cb 0.07 1.72 -0.03 0.00 -0.74 0.00 0.00 36.82 37.84 3hhu h ILE 206 CO -0.03 0.57 0.36 0.58 0.00 0.00 0.00 178.15 179.63 3hhu h VAL 207 N 0.58 1.18 -0.12 1.67 2.07 -1.11 -1.40 116.25 119.12 3hhu h VAL 207 Ca 0.00 -0.41 -0.11 0.00 0.82 0.00 0.00 66.70 67.01 3hhu h VAL 207 Cb 1.18 0.37 -0.01 0.00 -1.52 0.00 0.00 31.29 31.31 3hhu h VAL 207 CO 0.12 0.19 -0.40 0.50 0.02 0.00 0.00 177.57 178.00 3hhu h LYS 208 N 0.81 0.27 -0.01 1.57 3.64 -1.20 0.99 116.57 122.63 3hhu h LYS 208 Ca 0.21 -0.12 -0.24 0.00 -1.27 0.00 0.00 60.65 59.23 3hhu h LYS 208 Cb -0.01 -0.00 0.02 0.00 -0.41 0.00 0.00 32.23 31.82 3hhu h LYS 208 CO -0.04 0.63 -0.92 -0.22 -2.27 0.00 0.00 179.45 176.63 3hhu h LYS 209 N 0.22 0.65 0.00 1.90 3.64 -0.97 -3.37 116.57 118.65 3hhu h LYS 209 Ca 0.02 -0.68 0.00 0.00 -1.27 0.00 0.00 60.65 58.72 3hhu h LYS 209 Cb 0.81 0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.81 3hhu h LYS 209 CO 0.06 1.27 -0.78 0.72 -2.27 0.00 0.00 179.45 178.46 3hhu n HIS 210 N -3.95 0.00 -2.60 1.91 8.25 -0.56 -4.77 115.22 113.51 3hhu n HIS 210 Ca -0.11 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.28 3hhu n HIS 210 Cb 0.82 -0.02 0.04 0.00 1.12 0.00 0.00 29.99 31.96 3hhu n HIS 210 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 3hhu n SER 211 N -1.40 2.56 0.02 0.41 7.64 0.29 -4.91 113.62 118.23 3hhu n SER 211 Ca -0.00 -2.56 -0.09 0.00 1.01 0.00 0.00 58.87 57.23 3hhu n SER 211 Cb 0.02 -0.44 0.07 0.00 -1.01 0.00 0.00 64.21 62.85 3hhu n SER 211 CO 0.00 0.00 0.00 -0.61 -3.01 0.00 0.00 175.04 171.42 3hhu h GLN 212 N 2.51 0.51 -3.66 1.43 4.15 -1.58 -3.38 115.11 115.08 3hhu h GLN 212 Ca 0.01 -0.32 -0.65 0.00 0.77 0.00 0.00 58.65 58.46 3hhu h GLN 212 Cb 1.33 0.04 -0.40 0.00 0.21 0.00 0.00 27.48 28.66 3hhu h GLN 212 CO 0.37 0.92 -0.61 -0.06 -1.93 0.00 0.00 178.83 177.52 3hhu s PHE 213 N -3.98 3.32 0.09 3.99 0.08 -1.26 -5.03 117.98 115.20 3hhu s PHE 213 Ca -0.07 -3.07 0.10 0.00 0.12 0.00 0.00 56.93 54.01 3hhu s PHE 213 Cb 0.11 -2.90 -0.04 0.00 -0.57 0.00 0.00 43.02 39.63 3hhu s PHE 213 CO 0.83 -0.80 -0.26 0.42 -0.10 0.00 0.00 175.22 175.31 3hhu s ILE 214 N -0.02 2.24 -1.61 0.64 -1.09 -1.26 -5.04 121.20 115.06 3hhu s ILE 214 Ca 0.16 -1.59 0.00 0.00 -2.23 0.00 0.00 60.65 56.99 3hhu s ILE 214 Cb -0.24 -1.94 0.01 0.00 -1.58 0.00 0.00 42.46 38.71 3hhu s ILE 214 CO -0.02 0.21 0.82 0.61 -1.23 0.00 0.00 174.94 175.33 3hhu n GLY 215 N 1.26 0.01 3.03 6.18 0.00 -1.26 -4.76 105.19 109.65 3hhu n GLY 215 Ca -0.17 -0.01 -0.09 0.00 0.00 0.00 0.00 46.02 45.74 3hhu n GLY 215 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3hhu s TYR 216 N -1.62 0.22 0.25 1.61 2.02 -1.26 -5.11 117.35 113.46 3hhu s TYR 216 Ca 0.01 -0.47 -0.30 0.00 -0.37 0.00 0.00 57.07 55.94 3hhu s TYR 216 Cb 0.01 -0.17 -0.10 0.00 -0.40 0.00 0.00 41.96 41.30 3hhu s TYR 216 CO 0.00 -0.24 1.42 -2.14 -1.57 0.00 0.00 175.55 173.02 3hhu s PRO 217 N -1.72 4.28 -0.18 -1.71 0.02 -1.26 -4.86 135.00 129.58 3hhu s PRO 217 Ca -0.13 2.27 -0.02 0.00 0.02 0.00 0.00 61.00 63.14 3hhu s PRO 217 Cb -0.07 -3.12 -0.01 0.00 0.02 0.00 0.00 34.50 31.32 3hhu s PRO 217 CO -0.01 -0.40 -0.09 0.42 -0.33 0.00 0.00 177.00 176.59 3hhu s ILE 218 N -0.03 3.14 -0.18 2.83 1.01 -1.26 -1.35 121.20 125.36 3hhu s ILE 218 Ca 0.59 -0.60 -0.02 0.00 0.00 0.00 0.00 60.65 60.62 3hhu s ILE 218 Cb -0.41 -2.38 -0.01 0.00 0.01 0.00 0.00 42.46 39.67 3hhu s ILE 218 CO 0.43 0.48 -0.10 -0.89 0.00 0.00 0.00 174.94 174.86 3hhu s THR 219 N 0.98 3.04 -0.36 2.92 2.01 -0.14 -5.01 115.64 119.07 3hhu s THR 219 Ca -0.01 -0.63 -0.16 0.00 0.31 0.00 0.00 61.69 61.19 3hhu s THR 219 Cb -0.15 -2.33 -0.00 0.00 0.01 0.00 0.00 72.50 70.03 3hhu s THR 219 CO -0.01 0.48 0.42 -0.22 -0.69 0.00 0.00 174.62 174.60 3hhu s LEU 220 N 1.00 4.52 0.47 4.42 2.96 -1.26 -0.58 118.68 130.21 3hhu s LEU 220 Ca -0.01 -0.29 -0.23 0.00 -0.22 0.00 0.00 54.13 53.38 3hhu s LEU 220 Cb -0.15 -2.41 -0.07 0.00 0.50 0.00 0.00 46.19 44.06 3hhu s LEU 220 CO -0.01 -0.44 1.19 -0.36 -1.32 0.00 0.00 176.35 175.41 3hhu s PHE 221 N 2.15 2.81 0.21 5.38 0.40 -0.34 -4.98 117.98 123.60 3hhu s PHE 221 Ca 0.14 1.52 -0.06 0.00 -0.60 0.00 0.00 56.93 57.92 3hhu s PHE 221 Cb -0.16 -3.43 -0.06 0.00 0.51 0.00 0.00 43.02 39.87 3hhu s PHE 221 CO 0.13 -1.67 0.48 0.08 0.70 0.00 0.00 175.22 174.93 3hhu s VAL 222 N -1.51 5.05 -2.99 -0.44 1.01 -1.26 -4.64 120.40 115.61 3hhu s VAL 222 Ca 0.64 0.19 0.24 0.00 0.00 0.00 0.00 61.98 63.05 3hhu s VAL 222 Cb -0.30 -3.65 0.19 0.00 0.00 0.00 0.00 36.38 32.62 3hhu s VAL 222 CO 0.36 -0.09 1.26 -0.62 0.00 0.00 0.00 175.10 176.01