#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3bim s ASP 6 N 0.00 7.01 0.03 0.00 2.15 -1.26 -5.04 116.67 119.57 3bim s ASP 6 Ca 0.00 2.45 -0.00 0.00 0.43 0.00 0.00 52.55 55.43 3bim s ASP 6 Cb 0.00 -2.63 0.00 0.00 -0.30 0.00 0.00 42.92 39.99 3bim s ASP 6 CO 0.00 -0.36 0.05 -0.24 -0.17 0.00 0.00 175.17 174.45 3bim n SER 7 N 1.30 -0.13 -3.13 -0.34 2.88 -1.26 -5.14 113.62 107.80 3bim n SER 7 Ca 0.01 -1.17 0.05 0.00 -1.33 0.00 0.00 58.87 56.42 3bim n SER 7 Cb 0.43 0.25 -0.00 0.00 -0.75 0.00 0.00 64.21 64.14 3bim n SER 7 CO 0.00 0.00 0.00 -1.58 -1.23 0.00 0.00 175.04 172.23 3bim s GLN 8 N -2.07 0.31 -0.21 -1.46 -0.44 -1.26 -5.16 119.66 109.37 3bim s GLN 8 Ca 0.03 0.25 -0.08 0.00 -2.50 0.00 0.00 55.36 53.05 3bim s GLN 8 Cb -0.00 0.12 -0.04 0.00 -1.64 0.00 0.00 33.01 31.45 3bim s GLN 8 CO 0.02 -0.56 0.09 0.42 0.50 0.00 0.00 175.29 175.76 3bim s ILE 9 N 2.82 4.85 -0.30 -2.34 1.01 -1.26 -5.07 121.20 120.90 3bim s ILE 9 Ca 0.21 -0.00 -0.13 0.00 0.00 0.00 0.00 60.65 60.72 3bim s ILE 9 Cb -0.04 -3.23 -0.03 0.00 0.01 0.00 0.00 42.46 39.17 3bim s ILE 9 CO -0.23 0.40 0.29 -1.10 0.00 0.00 0.00 174.94 174.30 3bim s GLN 10 N 0.87 3.83 -0.72 2.79 -0.21 -1.26 -5.03 119.66 119.93 3bim s GLN 10 Ca 0.05 -0.27 -0.23 0.00 0.02 0.00 0.00 55.36 54.93 3bim s GLN 10 Cb -0.13 -3.71 0.06 0.00 1.00 0.00 0.00 33.01 30.23 3bim s GLN 10 CO 0.03 -0.32 1.08 -0.06 -2.12 0.00 0.00 175.29 173.90 3bim s PHE 11 N 1.91 2.60 -1.09 0.91 0.40 -1.26 -4.89 117.98 116.56 3bim s PHE 11 Ca 0.10 -0.50 0.04 0.00 -0.60 0.00 0.00 56.93 55.97 3bim s PHE 11 Cb -0.16 -4.40 0.18 0.00 0.51 0.00 0.00 43.02 39.15 3bim s PHE 11 CO 0.11 -1.76 1.10 0.25 0.70 0.00 0.00 175.22 175.61 3bim n THR 12 N 6.06 1.57 -0.06 0.64 -2.24 -1.26 -1.47 114.28 117.51 3bim n THR 12 Ca 0.02 0.39 0.03 0.00 -2.27 0.00 0.00 64.05 62.22 3bim n THR 12 Cb 0.47 -1.32 0.08 0.00 -2.10 0.00 0.00 70.33 67.45 3bim n THR 12 CO 0.00 0.00 0.00 -2.11 -0.57 0.00 0.00 175.07 172.39 3bim n ARG 13 N -1.46 2.65 0.23 -0.78 1.85 -1.26 -4.74 116.66 113.15 3bim n ARG 13 Ca 0.01 -1.71 -0.15 0.00 -1.00 0.00 0.00 57.85 55.00 3bim n ARG 13 Cb 0.04 -1.14 -0.08 0.00 -1.05 0.00 0.00 32.46 30.23 3bim n ARG 13 CO 0.00 0.00 0.00 1.25 -0.01 0.00 0.00 177.63 178.87 3bim h HIS 14 N 1.09 -0.53 -0.52 2.89 2.76 -1.67 -1.05 115.15 118.12 3bim h HIS 14 Ca 0.00 -0.01 0.10 0.00 -2.20 0.00 0.00 60.37 58.26 3bim h HIS 14 Cb 0.59 0.18 -0.10 0.00 1.55 0.00 0.00 27.41 29.63 3bim h HIS 14 CO 0.11 -0.32 -0.15 0.00 -1.30 0.00 0.00 177.93 176.27 3bim h ALA 15 N 0.05 0.30 -0.01 5.26 0.00 -1.85 0.56 119.26 123.58 3bim h ALA 15 Ca -0.05 0.20 -0.06 0.00 0.00 0.00 0.00 54.91 55.00 3bim h ALA 15 Cb 0.43 0.43 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 3bim h ALA 15 CO 0.07 -0.46 -0.28 1.03 0.00 0.00 0.00 179.25 179.62 3bim h SER 16 N -0.02 0.02 0.40 0.00 0.87 -1.84 -1.29 113.55 111.69 3bim h SER 16 Ca 0.25 -0.01 -0.24 0.00 -1.23 0.00 0.00 61.79 60.56 3bim h SER 16 Cb 0.41 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.36 3bim h SER 16 CO -0.55 0.30 -1.03 0.44 -0.53 0.00 0.00 176.83 175.46 3bim h ASP 17 N 0.02 0.52 -0.17 6.23 3.32 0.08 -2.11 116.42 124.31 3bim h ASP 17 Ca 0.00 -0.45 -0.02 0.00 0.02 0.00 0.00 57.03 56.58 3bim h ASP 17 Cb 0.50 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.88 3bim h ASP 17 CO 0.04 1.28 0.03 0.58 -1.72 0.00 0.00 179.24 179.45 3bim h VAL 18 N 0.19 1.21 -0.43 -1.35 2.07 -0.48 -2.32 116.25 115.14 3bim h VAL 18 Ca -0.10 -0.68 0.06 0.00 0.82 0.00 0.00 66.70 66.80 3bim h VAL 18 Cb 1.69 1.35 -0.06 0.00 -1.52 0.00 0.00 31.29 32.76 3bim h VAL 18 CO 0.18 0.21 0.11 0.25 0.02 0.00 0.00 177.57 178.33 3bim h LEU 19 N 0.07 0.06 -0.70 2.57 5.85 -1.30 0.21 115.31 122.07 3bim h LEU 19 Ca 0.05 0.07 0.12 0.00 0.84 0.00 0.00 57.88 58.96 3bim h LEU 19 Cb 0.29 0.08 -0.09 0.00 0.37 0.00 0.00 40.66 41.31 3bim h LEU 19 CO 0.00 0.07 0.28 0.25 -0.34 0.00 0.00 178.44 178.70 3bim h LEU 20 N 0.25 0.27 -0.43 2.25 7.12 -1.37 0.15 115.31 123.56 3bim h LEU 20 Ca 0.21 0.10 -0.18 0.00 0.13 0.00 0.00 57.88 58.14 3bim h LEU 20 Cb 0.24 0.07 -0.01 0.00 -0.53 0.00 0.00 40.66 40.43 3bim h LEU 20 CO -0.25 0.13 -0.76 0.78 -0.13 0.00 0.00 178.44 178.20 3bim h ASN 21 N 0.45 0.28 -0.65 1.25 2.35 -0.80 -1.02 115.58 117.44 3bim h ASN 21 Ca 0.37 -0.20 0.02 0.00 -0.55 0.00 0.00 56.30 55.94 3bim h ASN 21 Cb 0.52 -0.08 -0.04 0.00 0.05 0.00 0.00 38.32 38.77 3bim h ASN 21 CO -0.36 0.94 0.42 -0.07 -1.65 0.00 0.00 177.43 176.70 3bim h LEU 22 N 0.15 0.71 -1.04 1.61 3.38 0.10 0.52 115.31 120.74 3bim h LEU 22 Ca -0.03 -0.01 -0.07 0.00 0.09 0.00 0.00 57.88 57.86 3bim h LEU 22 Cb 1.34 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.91 3bim h LEU 22 CO 0.12 0.50 -0.05 -1.13 0.09 0.00 0.00 178.44 177.97 3bim h ASN 23 N 0.84 0.60 -0.64 -0.43 -0.00 -0.52 0.14 115.58 115.57 3bim h ASN 23 Ca 0.25 -0.15 -0.01 0.00 -0.00 0.00 0.00 56.30 56.40 3bim h ASN 23 Cb -0.05 -0.16 -0.03 0.00 -0.00 0.00 0.00 38.32 38.08 3bim h ASN 23 CO -0.08 0.71 0.38 0.03 -0.00 0.00 0.00 177.43 178.47 3bim h ARG 24 N 0.59 0.88 -0.96 6.67 2.47 -0.86 0.14 114.38 123.31 3bim h ARG 24 Ca 0.11 -0.08 0.02 0.00 -1.26 0.00 0.00 59.98 58.77 3bim h ARG 24 Cb 0.45 -0.18 -0.05 0.00 -1.65 0.00 0.00 29.97 28.54 3bim h ARG 24 CO 0.02 0.64 0.63 -0.07 0.56 0.00 0.00 179.97 181.75 3bim h LEU 25 N 0.87 1.08 -0.03 3.04 3.38 -0.10 -2.58 115.31 120.98 3bim h LEU 25 Ca 0.23 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.18 3bim h LEU 25 Cb -0.01 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.48 3bim h LEU 25 CO -0.04 0.76 0.01 -0.09 0.09 0.00 0.00 178.44 179.17 3bim h ARG 26 N 1.26 0.05 -1.11 1.13 2.43 -0.16 0.57 114.38 118.55 3bim h ARG 26 Ca 0.36 -0.01 0.31 0.00 -0.81 0.00 0.00 59.98 59.83 3bim h ARG 26 Cb -0.09 -0.01 -0.07 0.00 -0.42 0.00 0.00 29.97 29.38 3bim h ARG 26 CO -0.09 0.25 0.77 0.77 -1.51 0.00 0.00 179.97 180.16 3bim h SER 27 N -0.16 0.19 -0.31 -3.80 0.02 -0.38 -1.42 113.55 107.69 3bim h SER 27 Ca 0.01 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 61.00 3bim h SER 27 Cb 0.23 0.01 0.00 0.00 0.14 0.00 0.00 62.40 62.77 3bim h SER 27 CO -0.00 0.03 0.00 0.54 -1.14 0.00 0.00 176.83 176.26 3bim n ARG 28 N -4.38 2.95 -4.17 3.45 1.74 -0.96 -4.97 116.66 110.31 3bim n ARG 28 Ca 0.25 -2.52 -0.34 0.00 -0.77 0.00 0.00 57.85 54.47 3bim n ARG 28 Cb 1.09 -1.62 -0.03 0.00 -1.02 0.00 0.00 32.46 30.88 3bim n ARG 28 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 3bim n ASP 29 N -0.05 -2.36 -4.57 0.55 4.64 -0.53 -4.94 116.55 109.29 3bim n ASP 29 Ca 0.17 -1.03 -0.41 0.00 -1.38 0.00 0.00 54.79 52.14 3bim n ASP 29 Cb 0.71 -2.74 -0.07 0.00 -1.04 0.00 0.00 41.12 37.97 3bim n ASP 29 CO 0.00 0.00 0.00 -0.63 -0.82 0.00 0.00 177.20 175.75 3bim s ILE 30 N -3.50 4.98 0.00 5.18 1.09 0.13 -4.34 121.20 124.73 3bim s ILE 30 Ca 0.53 0.53 0.00 0.00 -1.10 0.00 0.00 60.65 60.62 3bim s ILE 30 Cb -0.29 -3.97 0.00 0.00 -1.06 0.00 0.00 42.46 37.13 3bim s ILE 30 CO 0.93 -0.19 0.00 0.18 -0.10 0.00 0.00 174.94 175.76 3bim n LEU 31 N 5.80 0.31 -4.60 2.97 4.77 -1.26 -4.67 117.00 120.32 3bim n LEU 31 Ca -0.03 0.00 -0.47 0.00 -0.03 0.00 0.00 56.01 55.48 3bim n LEU 31 Cb 0.49 -0.61 -0.03 0.00 -2.33 0.00 0.00 43.42 40.94 3bim n LEU 31 CO 0.45 -0.19 0.71 0.35 -1.33 0.00 0.00 177.39 177.39 3bim n THR 32 N -2.15 1.31 -0.44 -5.08 -2.24 -1.26 -4.85 114.28 99.57 3bim n THR 32 Ca 0.00 -0.33 0.00 0.00 -2.27 0.00 0.00 64.05 61.45 3bim n THR 32 Cb 0.03 -1.01 0.00 0.00 -2.10 0.00 0.00 70.33 67.26 3bim n THR 32 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 3bim n ASP 33 N 1.74 1.03 -3.76 3.42 3.85 -0.82 -4.95 116.55 117.07 3bim n ASP 33 Ca 0.12 -1.47 -0.13 0.00 -0.71 0.00 0.00 54.79 52.60 3bim n ASP 33 Cb 0.28 0.00 -0.10 0.00 -1.35 0.00 0.00 41.12 39.96 3bim n ASP 33 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.20 176.73 3bim s VAL 34 N -0.47 0.03 -0.17 2.12 0.11 -1.15 -4.67 120.40 116.20 3bim s VAL 34 Ca 0.00 -0.24 -0.06 0.00 -2.93 0.00 0.00 61.98 58.75 3bim s VAL 34 Cb 0.00 -0.54 -0.04 0.00 -1.53 0.00 0.00 36.38 34.27 3bim s VAL 34 CO 0.00 -0.13 0.04 0.68 -3.33 0.00 0.00 175.10 172.36 3bim s VAL 35 N -0.56 4.56 -0.30 2.04 -7.23 0.70 -0.92 120.40 118.70 3bim s VAL 35 Ca -0.07 -0.12 -0.17 0.00 -1.81 0.00 0.00 61.98 59.81 3bim s VAL 35 Cb -0.04 -3.03 -0.02 0.00 0.56 0.00 0.00 36.38 33.85 3bim s VAL 35 CO 0.02 0.49 0.48 -0.63 -0.31 0.00 0.00 175.10 175.15 3bim s ILE 36 N 0.21 5.08 -0.30 -0.62 -1.09 0.16 -0.65 121.20 123.98 3bim s ILE 36 Ca 0.02 0.58 -0.12 0.00 -2.23 0.00 0.00 60.65 58.91 3bim s ILE 36 Cb -0.13 -3.85 -0.04 0.00 -1.58 0.00 0.00 42.46 36.87 3bim s ILE 36 CO 0.01 -0.02 0.21 -0.69 -1.23 0.00 0.00 174.94 173.22 3bim s VAL 37 N 2.28 5.27 -0.49 2.92 1.01 0.55 -0.91 120.40 131.02 3bim s VAL 37 Ca 0.18 0.00 -0.03 0.00 0.00 0.00 0.00 61.98 62.13 3bim s VAL 37 Cb -0.16 -3.59 0.13 0.00 0.00 0.00 0.00 36.38 32.76 3bim s VAL 37 CO 0.11 0.15 0.30 -0.69 0.00 0.00 0.00 175.10 174.96 3bim s VAL 38 N 1.74 3.48 0.00 2.92 1.01 -0.74 -0.64 120.40 128.17 3bim s VAL 38 Ca 0.07 -2.38 0.00 0.00 0.00 0.00 0.00 61.98 59.67 3bim s VAL 38 Cb -0.17 -3.34 0.00 0.00 0.00 0.00 0.00 36.38 32.87 3bim s VAL 38 CO 0.11 -0.76 0.00 -1.20 0.00 0.00 0.00 175.10 173.24 3bim n SER 39 N 4.20 0.00 -0.01 3.32 7.64 -1.26 -2.23 113.62 125.28 3bim n SER 39 Ca 0.01 0.00 0.01 0.00 1.01 0.00 0.00 58.87 59.91 3bim n SER 39 Cb 0.40 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.55 3bim n SER 39 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 3bim n ARG 40 N 0.00 0.96 -2.48 1.43 1.74 -1.26 -5.00 116.66 112.05 3bim n ARG 40 Ca 0.00 -0.04 -0.40 0.00 -0.77 0.00 0.00 57.85 56.64 3bim n ARG 40 Cb 0.00 -1.14 -0.04 0.00 -1.02 0.00 0.00 32.46 30.26 3bim n ARG 40 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 3bim s GLU 41 N -2.34 4.65 -0.03 5.56 8.01 -0.94 -5.08 118.70 128.52 3bim s GLU 41 Ca -0.02 1.80 0.07 0.00 0.01 0.00 0.00 54.97 56.82 3bim s GLU 41 Cb 0.03 -3.19 -0.01 0.00 -4.31 0.00 0.00 34.13 26.65 3bim s GLU 41 CO 0.24 0.22 -0.23 -0.65 0.01 0.00 0.00 175.26 174.85 3bim s GLN 42 N -1.44 2.04 -0.05 1.61 -0.21 -1.26 -1.80 119.66 118.55 3bim s GLN 42 Ca 0.44 -0.83 -0.01 0.00 0.02 0.00 0.00 55.36 54.99 3bim s GLN 42 Cb -0.32 -1.88 0.03 0.00 1.00 0.00 0.00 33.01 31.84 3bim s GLN 42 CO 0.41 0.45 0.00 -0.06 -2.12 0.00 0.00 175.29 173.97 3bim s PHE 43 N -0.39 0.50 0.04 0.91 0.40 -0.08 -4.96 117.98 114.39 3bim s PHE 43 Ca 0.05 -0.07 -0.08 0.00 -0.60 0.00 0.00 56.93 56.23 3bim s PHE 43 Cb -0.10 -0.64 -0.05 0.00 0.51 0.00 0.00 43.02 42.74 3bim s PHE 43 CO 0.01 -0.24 0.34 1.03 0.70 0.00 0.00 175.22 177.05 3bim s ARG 44 N 1.62 3.68 0.29 0.44 0.52 -1.26 0.39 118.95 124.64 3bim s ARG 44 Ca -0.01 0.07 -0.19 0.00 -0.52 0.00 0.00 55.73 55.08 3bim s ARG 44 Cb -0.13 -3.04 0.06 0.00 0.52 0.00 0.00 34.95 32.36 3bim s ARG 44 CO -0.03 0.61 0.87 0.00 0.02 0.00 0.00 175.30 176.77 3bim s ALA 45 N -1.34 -1.13 -0.23 2.13 0.00 -0.09 -4.95 121.76 116.15 3bim s ALA 45 Ca 0.30 -0.50 -0.16 0.00 0.00 0.00 0.00 51.96 51.60 3bim s ALA 45 Cb -0.14 0.72 -0.04 0.00 0.00 0.00 0.00 23.12 23.66 3bim s ALA 45 CO 0.17 -1.02 0.41 -1.01 0.00 0.00 0.00 175.76 174.31 3bim s HIS 46 N -2.52 3.33 0.32 0.00 3.76 -1.26 -1.94 115.29 116.98 3bim s HIS 46 Ca 0.17 0.57 0.10 0.00 -0.15 0.00 0.00 55.06 55.74 3bim s HIS 46 Cb -0.04 -2.56 0.92 0.00 1.11 0.00 0.00 32.58 32.00 3bim s HIS 46 CO 0.08 -0.10 1.69 0.87 -0.85 0.00 0.00 174.74 176.43 3bim h LYS 47 N 7.65 0.40 -0.16 1.40 1.57 -1.92 -1.99 116.57 123.52 3bim h LYS 47 Ca -0.34 -0.02 -0.11 0.00 -1.87 0.00 0.00 60.65 58.30 3bim h LYS 47 Cb 1.16 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 33.37 3bim h LYS 47 CO 0.70 0.26 -0.40 1.79 -0.57 0.00 0.00 179.45 181.24 3bim h THR 48 N 0.41 1.30 -0.36 -0.16 1.35 -1.98 -0.15 112.91 113.33 3bim h THR 48 Ca 0.65 -1.52 -0.11 0.00 -0.55 0.00 0.00 66.41 64.88 3bim h THR 48 Cb 1.36 1.62 -0.01 0.00 -1.73 0.00 0.00 68.15 69.39 3bim h THR 48 CO -0.55 0.46 -0.21 0.58 -0.25 0.00 0.00 175.52 175.55 3bim h VAL 49 N 0.30 1.29 -0.26 6.82 2.07 -1.80 -1.02 116.25 123.65 3bim h VAL 49 Ca 0.03 -1.35 0.01 0.00 0.82 0.00 0.00 66.70 66.20 3bim h VAL 49 Cb 0.83 1.38 -0.01 0.00 -1.52 0.00 0.00 31.29 31.97 3bim h VAL 49 CO 0.07 0.44 0.16 -0.07 0.02 0.00 0.00 177.57 178.19 3bim h LEU 50 N 0.56 0.28 -1.81 2.57 3.38 -0.96 -2.43 115.31 116.91 3bim h LEU 50 Ca 0.07 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 3bim h LEU 50 Cb 0.77 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.45 3bim h LEU 50 CO 0.06 0.20 -0.06 0.24 0.09 0.00 0.00 178.44 178.97 3bim h MET 51 N 0.34 0.05 0.00 1.13 2.86 -0.97 0.42 114.93 118.75 3bim h MET 51 Ca 0.10 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.73 3bim h MET 51 Cb -0.03 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 31.62 3bim h MET 51 CO -0.03 0.11 0.00 0.00 1.06 0.00 0.00 176.91 178.05 3bim n ALA 52 N -2.52 2.17 -0.05 6.32 0.00 -0.39 -4.06 120.51 121.98 3bim n ALA 52 Ca -0.02 -0.04 -0.06 0.00 0.00 0.00 0.00 53.44 53.32 3bim n ALA 52 Cb 0.16 -1.44 -0.06 0.00 0.00 0.00 0.00 19.45 18.11 3bim n ALA 52 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3bim s SER 54 N -4.50 1.52 0.35 0.00 1.04 -0.03 -4.80 113.70 107.28 3bim s SER 54 Ca -0.09 -0.25 0.08 0.00 0.48 0.00 0.00 55.95 56.18 3bim s SER 54 Cb 0.03 -0.59 0.80 0.00 0.10 0.00 0.00 66.02 66.36 3bim s SER 54 CO 0.29 0.04 1.87 1.23 0.98 0.00 0.00 173.24 177.65 3bim h GLY 55 N 6.73 1.22 0.95 7.32 0.00 -1.65 -1.38 103.07 116.27 3bim h GLY 55 Ca -0.33 -0.31 -0.03 0.00 0.00 0.00 0.00 47.33 46.66 3bim h GLY 55 CO 0.48 0.10 0.16 -2.00 0.00 0.00 0.00 176.54 175.27 3bim h LEU 56 N 0.71 0.62 -0.21 3.11 5.85 -1.84 -0.66 115.31 122.88 3bim h LEU 56 Ca 0.45 -0.19 -0.22 0.00 0.84 0.00 0.00 57.88 58.76 3bim h LEU 56 Cb 0.69 -0.16 0.01 0.00 0.37 0.00 0.00 40.66 41.56 3bim h LEU 56 CO -0.21 0.64 -0.79 -0.26 -0.34 0.00 0.00 178.44 177.48 3bim h PHE 57 N 0.56 0.92 -0.48 1.25 0.05 -1.74 0.18 116.94 117.68 3bim h PHE 57 Ca 0.14 -0.42 0.10 0.00 3.82 0.00 0.00 57.97 61.61 3bim h PHE 57 Cb 0.23 -0.14 -0.10 0.00 2.00 0.00 0.00 35.95 37.94 3bim h PHE 57 CO 0.01 1.23 -0.26 -0.92 -0.18 0.00 0.00 178.31 178.19 3bim h TYR 58 N 0.45 -0.69 -0.27 -0.55 3.20 -1.25 0.29 116.97 118.15 3bim h TYR 58 Ca -0.05 0.06 0.03 0.00 3.14 0.00 0.00 58.73 61.91 3bim h TYR 58 Cb 1.41 0.37 -0.03 0.00 1.54 0.00 0.00 36.73 40.02 3bim h TYR 58 CO 0.08 -0.34 0.08 0.77 -1.64 0.00 0.00 178.16 177.11 3bim h SER 59 N -0.15 0.07 0.30 -2.11 0.02 -0.74 -1.15 113.55 109.79 3bim h SER 59 Ca 0.22 0.03 -0.01 0.00 -0.84 0.00 0.00 61.79 61.19 3bim h SER 59 Cb 0.50 0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.07 3bim h SER 59 CO -0.57 0.07 -0.15 0.40 -1.14 0.00 0.00 176.83 175.44 3bim h ILE 60 N 0.19 0.72 -0.00 3.27 2.04 0.32 -2.11 117.51 121.94 3bim h ILE 60 Ca 0.12 -0.14 0.00 0.00 1.00 0.00 0.00 64.86 65.84 3bim h ILE 60 Cb 0.10 0.80 0.00 0.00 -0.74 0.00 0.00 36.82 36.98 3bim h ILE 60 CO -0.14 0.03 -0.01 0.49 0.00 0.00 0.00 178.15 178.52 3bim n PHE 61 N -5.23 0.00 0.83 1.37 3.01 0.92 -2.33 117.46 116.02 3bim n PHE 61 Ca -0.10 0.00 0.10 0.00 1.01 0.00 0.00 57.45 58.46 3bim n PHE 61 Cb 0.20 -0.10 -0.12 0.00 -0.01 0.00 0.00 39.48 39.45 3bim n PHE 61 CO 0.00 0.00 0.00 -2.37 1.01 0.00 0.00 176.76 175.40 3bim n THR 62 N -1.00 0.00 -2.16 4.37 5.66 -0.44 -4.45 114.28 116.25 3bim n THR 62 Ca 0.20 -0.08 -0.43 0.00 -3.05 0.00 0.00 64.05 60.69 3bim n THR 62 Cb 0.18 0.87 -0.02 0.00 -1.55 0.00 0.00 70.33 69.80 3bim n THR 62 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 3bim s ASP 63 N -3.12 6.51 0.10 1.09 -1.08 -0.81 -4.93 116.67 114.43 3bim s ASP 63 Ca 0.06 1.69 0.13 0.00 -0.52 0.00 0.00 52.55 53.90 3bim s ASP 63 Cb 0.15 -2.53 0.58 0.00 -1.46 0.00 0.00 42.92 39.65 3bim s ASP 63 CO 0.84 -1.14 1.39 0.00 0.52 0.00 0.00 175.17 176.78 3bim n GLN 64 N 7.44 0.06 0.02 4.34 3.00 -1.26 -0.19 117.38 130.79 3bim n GLN 64 Ca 0.18 0.43 0.13 0.00 -0.01 0.00 0.00 57.00 57.72 3bim n GLN 64 Cb 0.45 -1.64 0.37 0.00 0.00 0.00 0.00 30.24 29.41 3bim n GLN 64 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 3bim n LEU 65 N -1.76 0.41 0.00 1.08 7.99 -1.26 -4.20 117.00 119.27 3bim n LEU 65 Ca 0.01 0.26 0.00 0.00 -0.01 0.00 0.00 56.01 56.27 3bim n LEU 65 Cb 0.10 -0.32 0.00 0.00 -0.11 0.00 0.00 43.42 43.09 3bim n LEU 65 CO 0.10 0.02 0.00 0.29 -1.51 0.00 0.00 177.39 176.29 3bim n LYS 66 N -1.69 6.42 -0.27 3.23 5.02 0.74 -4.83 118.16 126.78 3bim n LYS 66 Ca 0.06 -0.01 0.04 0.00 -2.02 0.00 0.00 58.31 56.38 3bim n LYS 66 Cb 0.37 -0.47 0.18 0.00 -0.02 0.00 0.00 35.03 35.08 3bim n LYS 66 CO 0.00 0.00 0.00 -0.09 -0.52 0.00 0.00 177.40 176.79 3bim h ARG 67 N 0.00 0.58 -0.11 1.97 1.12 -1.40 -1.63 114.38 114.91 3bim h ARG 67 Ca 0.00 -0.03 0.00 0.00 -1.11 0.00 0.00 59.98 58.84 3bim h ARG 67 Cb 0.00 -0.13 0.00 0.00 -0.01 0.00 0.00 29.97 29.83 3bim h ARG 67 CO 0.00 0.38 0.00 0.09 -3.11 0.00 0.00 179.97 177.33 3bim n ASN 68 N -4.88 1.77 -4.76 -3.80 3.02 -1.26 -4.93 115.26 100.42 3bim n ASN 68 Ca 0.14 -1.66 -0.41 0.00 -0.03 0.00 0.00 54.58 52.62 3bim n ASN 68 Cb 0.35 -0.07 -0.03 0.00 -0.61 0.00 0.00 39.78 39.42 3bim n ASN 68 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3bim s LEU 69 N -1.75 4.47 -0.01 3.41 1.43 -0.61 -4.92 118.68 120.69 3bim s LEU 69 Ca 0.35 2.45 0.19 0.00 -1.03 0.00 0.00 54.13 56.08 3bim s LEU 69 Cb 0.19 -3.63 -0.24 0.00 0.03 0.00 0.00 46.19 42.54 3bim s LEU 69 CO 0.30 -0.39 0.64 -1.54 0.23 0.00 0.00 176.35 175.59 3bim n SER 70 N 1.48 0.77 -4.41 2.29 3.41 -1.26 -4.88 113.62 111.03 3bim n SER 70 Ca 0.01 -0.56 -0.35 0.00 -0.26 0.00 0.00 58.87 57.71 3bim n SER 70 Cb 0.43 1.35 -0.13 0.00 -0.26 0.00 0.00 64.21 65.61 3bim n SER 70 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3bim s VAL 71 N -2.99 3.85 -0.24 -3.33 1.01 -1.26 -0.21 120.40 117.23 3bim s VAL 71 Ca 0.01 -0.34 0.00 0.00 0.00 0.00 0.00 61.98 61.66 3bim s VAL 71 Cb 0.13 -2.75 0.04 0.00 0.00 0.00 0.00 36.38 33.80 3bim s VAL 71 CO 0.78 0.41 -0.11 -0.63 0.00 0.00 0.00 175.10 175.55 3bim s ILE 72 N 1.19 2.46 -0.36 2.22 -1.09 0.17 -4.99 121.20 120.81 3bim s ILE 72 Ca 0.03 -1.23 -0.24 0.00 -2.23 0.00 0.00 60.65 56.99 3bim s ILE 72 Cb -0.15 -2.28 0.01 0.00 -1.58 0.00 0.00 42.46 38.47 3bim s ILE 72 CO 0.01 0.19 0.82 0.20 -1.23 0.00 0.00 174.94 174.93 3bim s ASN 73 N 1.24 6.60 0.77 3.58 0.01 -1.26 -0.33 114.94 125.54 3bim s ASN 73 Ca -0.02 0.44 -0.12 0.00 -0.71 0.00 0.00 52.86 52.46 3bim s ASN 73 Cb -0.17 -2.41 0.06 0.00 0.41 0.00 0.00 41.25 39.13 3bim s ASN 73 CO -0.06 -0.75 1.12 -0.76 -1.51 0.00 0.00 177.10 175.13 3bim s LEU 74 N 3.18 2.64 0.06 0.60 1.43 0.19 -4.96 118.68 121.82 3bim s LEU 74 Ca 0.33 1.09 -0.36 0.00 -1.03 0.00 0.00 54.13 54.17 3bim s LEU 74 Cb -0.13 -3.73 -0.15 0.00 0.03 0.00 0.00 46.19 42.21 3bim s LEU 74 CO 0.17 -1.76 1.52 -0.67 0.23 0.00 0.00 176.35 175.85 3bim n ASP 75 N -3.27 2.42 0.30 2.29 -0.08 -1.26 -4.68 116.55 112.28 3bim n ASP 75 Ca 0.07 1.09 0.16 0.00 -1.51 0.00 0.00 54.79 54.60 3bim n ASP 75 Cb 0.58 -1.29 0.93 0.00 2.34 0.00 0.00 41.12 43.68 3bim n ASP 75 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 3bim h PRO 76 N 5.80 0.00 0.00 -0.67 0.11 -1.94 0.96 132.00 136.26 3bim h PRO 76 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3bim h PRO 76 Cb 1.30 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.41 3bim h PRO 76 CO 0.85 0.03 0.00 -1.91 -0.21 0.00 0.00 178.00 176.76 3bim n GLU 77 N -3.63 0.57 -2.23 1.05 2.13 -1.26 -4.54 120.64 112.73 3bim n GLU 77 Ca -0.03 0.03 -0.42 0.00 0.66 0.00 0.00 57.16 57.41 3bim n GLU 77 Cb 0.12 -1.50 -0.03 0.00 0.27 0.00 0.00 31.44 30.30 3bim n GLU 77 CO 0.00 0.00 0.00 0.42 -0.41 0.00 0.00 177.13 177.14 3bim s ILE 78 N -2.28 3.31 -0.52 6.31 -1.09 0.33 -4.97 121.20 122.30 3bim s ILE 78 Ca 0.30 1.03 -0.28 0.00 -2.23 0.00 0.00 60.65 59.47 3bim s ILE 78 Cb 0.17 -3.66 0.03 0.00 -1.58 0.00 0.00 42.46 37.42 3bim s ILE 78 CO 0.33 0.13 1.14 0.21 -1.23 0.00 0.00 174.94 175.51 3bim s ASN 79 N 0.55 6.55 0.24 3.58 3.04 -1.26 -4.78 114.94 122.86 3bim s ASN 79 Ca 0.58 0.28 -0.06 0.00 0.04 0.00 0.00 52.86 53.70 3bim s ASN 79 Cb -0.36 -2.54 0.43 0.00 -1.54 0.00 0.00 41.25 37.24 3bim s ASN 79 CO 0.36 -1.32 1.67 -0.65 -3.04 0.00 0.00 177.10 174.12 3bim h PRO 80 N 9.34 0.20 -0.56 0.43 0.11 -1.93 0.19 132.00 139.78 3bim h PRO 80 Ca -0.24 -0.01 0.06 0.00 0.11 0.00 0.00 66.00 65.92 3bim h PRO 80 Cb 1.06 -0.05 -0.03 0.00 0.11 0.00 0.00 31.00 32.09 3bim h PRO 80 CO 1.14 0.13 0.38 1.49 -0.21 0.00 0.00 178.00 180.93 3bim h GLU 81 N 0.21 0.51 0.05 1.05 4.81 -1.99 0.42 114.58 119.64 3bim h GLU 81 Ca 0.40 -0.03 -0.24 0.00 -0.13 0.00 0.00 59.36 59.35 3bim h GLU 81 Cb 0.68 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.95 3bim h GLU 81 CO -0.54 0.34 -1.05 0.78 -0.73 0.00 0.00 179.01 177.80 3bim h GLY 82 N 0.52 0.42 0.95 1.92 0.00 -0.97 -2.10 103.07 103.82 3bim h GLY 82 Ca 0.24 -0.83 -0.04 0.00 0.00 0.00 0.00 47.33 46.70 3bim h GLY 82 CO -0.07 0.73 -0.47 -2.75 0.00 0.00 0.00 176.54 173.99 3bim h PHE 83 N 0.18 -1.22 -0.86 5.60 3.57 -0.50 -2.67 116.94 121.04 3bim h PHE 83 Ca -0.10 -0.02 0.22 0.00 3.53 0.00 0.00 57.97 61.60 3bim h PHE 83 Cb 1.72 0.42 -0.13 0.00 2.79 0.00 0.00 35.95 40.74 3bim h PHE 83 CO 0.06 -0.74 0.26 -0.97 -2.23 0.00 0.00 178.31 174.70 3bim h ASN 84 N -1.26 0.07 0.22 0.41 -0.73 -1.02 0.87 115.58 114.14 3bim h ASN 84 Ca -0.12 0.18 -0.03 0.00 1.87 0.00 0.00 56.30 58.20 3bim h ASN 84 Cb 0.98 0.23 -0.00 0.00 0.27 0.00 0.00 38.32 39.79 3bim h ASN 84 CO 0.18 -0.11 -0.16 0.40 -0.37 0.00 0.00 177.43 177.37 3bim h ILE 85 N 0.25 0.95 0.14 2.57 2.04 -1.32 -1.45 117.51 120.69 3bim h ILE 85 Ca 0.54 -0.58 -0.36 0.00 1.00 0.00 0.00 64.86 65.46 3bim h ILE 85 Cb 1.05 1.33 -0.01 0.00 -0.74 0.00 0.00 36.82 38.44 3bim h ILE 85 CO -0.61 0.16 -1.90 -0.07 0.00 0.00 0.00 178.15 175.73 3bim h LEU 86 N 0.00 0.45 -0.36 1.44 3.38 0.91 -2.49 115.31 118.64 3bim h LEU 86 Ca -0.00 -0.89 0.07 0.00 0.09 0.00 0.00 57.88 57.15 3bim h LEU 86 Cb 0.31 -0.15 -0.09 0.00 0.09 0.00 0.00 40.66 40.83 3bim h LEU 86 CO 0.02 1.78 -0.38 0.25 0.09 0.00 0.00 178.44 180.20 3bim h LEU 87 N 0.08 -1.25 -1.75 1.67 5.85 -0.36 0.19 115.31 119.73 3bim h LEU 87 Ca -0.39 0.20 0.03 0.00 0.84 0.00 0.00 57.88 58.56 3bim h LEU 87 Cb 2.05 0.56 -0.02 0.00 0.37 0.00 0.00 40.66 43.62 3bim h LEU 87 CO 0.12 -0.36 0.22 0.44 -0.34 0.00 0.00 178.44 178.52 3bim h ASP 88 N -0.32 0.28 -0.39 1.25 3.45 -1.35 -1.87 116.42 117.46 3bim h ASP 88 Ca 0.14 -0.00 -0.15 0.00 0.43 0.00 0.00 57.03 57.45 3bim h ASP 88 Cb 0.57 -0.06 -0.01 0.00 -0.56 0.00 0.00 39.33 39.27 3bim h ASP 88 CO -0.53 0.19 -0.32 0.15 -1.57 0.00 0.00 179.24 177.16 3bim h PHE 89 N 0.32 1.08 -0.78 4.55 3.57 -0.83 -1.94 116.94 122.90 3bim h PHE 89 Ca 0.14 -0.31 0.05 0.00 3.53 0.00 0.00 57.97 61.38 3bim h PHE 89 Cb 0.15 -0.23 -0.05 0.00 2.79 0.00 0.00 35.95 38.60 3bim h PHE 89 CO -0.00 1.12 0.48 0.52 -2.23 0.00 0.00 178.31 178.20 3bim h MET 90 N 0.72 0.88 -0.04 1.11 2.86 -0.20 0.18 114.93 120.45 3bim h MET 90 Ca 0.07 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.66 3bim h MET 90 Cb 0.91 -0.20 0.00 0.00 0.06 0.00 0.00 31.60 32.37 3bim h MET 90 CO 0.08 0.59 0.00 0.66 1.06 0.00 0.00 176.91 179.30 3bim n TYR 91 N -4.65 0.03 -0.03 -0.22 4.02 -0.91 -4.47 117.16 110.93 3bim n TYR 91 Ca 0.10 -0.02 0.00 0.00 -0.01 0.00 0.00 57.90 57.97 3bim n TYR 91 Cb 0.13 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.45 3bim n TYR 91 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 176.86 176.10 3bim n THR 92 N 0.30 0.00 -0.80 -0.72 -2.24 -0.74 -4.51 114.28 105.57 3bim n THR 92 Ca 0.18 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.96 3bim n THR 92 Cb 0.37 0.68 0.00 0.00 -2.10 0.00 0.00 70.33 69.28 3bim n THR 92 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 3bim n SER 93 N 0.00 0.00 -4.27 3.42 7.64 0.60 -4.99 113.62 116.03 3bim n SER 93 Ca 0.00 0.00 -0.35 0.00 1.01 0.00 0.00 58.87 59.53 3bim n SER 93 Cb 0.00 -0.19 -0.14 0.00 -1.01 0.00 0.00 64.21 62.87 3bim n SER 93 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 3bim s ARG 94 N -0.07 3.20 -0.35 1.43 0.52 -1.25 -5.03 118.95 117.41 3bim s ARG 94 Ca 0.00 -0.74 -0.15 0.00 -0.52 0.00 0.00 55.73 54.33 3bim s ARG 94 Cb 0.00 -2.99 -0.01 0.00 0.52 0.00 0.00 34.95 32.48 3bim s ARG 94 CO 0.00 -0.26 0.33 -1.17 0.02 0.00 0.00 175.30 174.22 3bim s LEU 95 N 1.43 4.55 -0.65 2.53 2.96 -1.26 -3.72 118.68 124.52 3bim s LEU 95 Ca 0.04 -0.38 -0.14 0.00 -0.22 0.00 0.00 54.13 53.43 3bim s LEU 95 Cb -0.15 -2.27 0.16 0.00 0.50 0.00 0.00 46.19 44.44 3bim s LEU 95 CO -0.04 -0.34 0.59 0.20 -1.32 0.00 0.00 176.35 175.44 3bim s ASN 96 N 1.73 6.33 -0.23 3.68 0.02 -1.26 -5.04 114.94 120.17 3bim s ASN 96 Ca 0.10 -2.19 -0.08 0.00 -1.02 0.00 0.00 52.86 49.66 3bim s ASN 96 Cb -0.17 -2.18 -0.04 0.00 0.02 0.00 0.00 41.25 38.88 3bim s ASN 96 CO 0.11 -0.71 0.10 -0.76 0.02 0.00 0.00 177.10 175.86 3bim s LEU 97 N 0.96 3.76 0.36 0.60 1.43 -1.26 -4.98 118.68 119.55 3bim s LEU 97 Ca 0.10 -0.03 0.04 0.00 -1.03 0.00 0.00 54.13 53.21 3bim s LEU 97 Cb -0.22 -1.99 -0.06 0.00 0.03 0.00 0.00 46.19 43.95 3bim s LEU 97 CO -0.02 0.05 0.05 0.00 0.23 0.00 0.00 176.35 176.66 3bim s ARG 98 N 1.10 1.77 0.14 1.70 1.70 -1.26 -5.06 118.95 119.04 3bim s ARG 98 Ca 0.05 -2.00 -0.27 0.00 -0.47 0.00 0.00 55.73 53.04 3bim s ARG 98 Cb -0.14 -1.04 -0.03 0.00 -0.57 0.00 0.00 34.95 33.17 3bim s ARG 98 CO 0.04 -0.19 1.60 0.93 -1.08 0.00 0.00 175.30 176.59 3bim h GLU 99 N 1.98 -0.41 -0.88 3.89 5.08 -2.02 -2.37 114.58 119.84 3bim h GLU 99 Ca -0.41 0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 57.97 3bim h GLU 99 Cb 1.25 0.09 -0.00 0.00 0.50 0.00 0.00 28.75 30.59 3bim h GLU 99 CO 0.71 -0.27 0.01 0.41 -1.00 0.00 0.00 179.01 178.87 3bim n GLY 100 N -1.42 1.97 0.00 -3.84 0.00 -1.26 -3.55 105.19 97.09 3bim n GLY 100 Ca -0.03 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.72 3bim n GLY 100 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3bim n ASN 101 N 0.18 3.49 -0.32 1.61 0.23 -0.91 -4.86 115.26 114.68 3bim n ASN 101 Ca 0.09 -0.12 0.00 0.00 -0.53 0.00 0.00 54.58 54.02 3bim n ASN 101 Cb 0.54 0.93 0.18 0.00 -2.08 0.00 0.00 39.78 39.35 3bim n ASN 101 CO 0.00 0.00 0.00 -0.29 -0.93 0.00 0.00 177.26 176.04 3bim h ILE 102 N 0.00 1.19 -0.73 1.53 2.10 -1.57 0.67 117.51 120.70 3bim h ILE 102 Ca 0.00 -0.41 0.02 0.00 1.08 0.00 0.00 64.86 65.55 3bim h ILE 102 Cb 0.00 -0.11 -0.04 0.00 -1.09 0.00 0.00 36.82 35.59 3bim h ILE 102 CO 0.00 0.22 0.48 0.24 -1.08 0.00 0.00 178.15 178.01 3bim h MET 103 N 1.20 0.93 -0.63 2.19 2.86 -1.90 -0.90 114.93 118.67 3bim h MET 103 Ca 0.35 -0.06 -0.04 0.00 -2.06 0.00 0.00 59.70 57.89 3bim h MET 103 Cb -0.06 -0.21 -0.03 0.00 0.06 0.00 0.00 31.60 31.36 3bim h MET 103 CO -0.09 0.62 0.22 0.00 1.06 0.00 0.00 176.91 178.72 3bim h ALA 104 N 1.28 0.82 -0.00 6.32 0.00 -0.73 0.35 119.26 127.31 3bim h ALA 104 Ca 0.28 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.99 3bim h ALA 104 Cb -0.07 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.48 3bim h ALA 104 CO -0.08 0.47 0.00 0.28 0.00 0.00 0.00 179.25 179.93 3bim n VAL 105 N -4.40 0.00 -0.35 0.00 0.31 0.19 -0.59 118.33 113.50 3bim n VAL 105 Ca 0.04 1.50 0.07 0.00 -0.01 0.00 0.00 64.34 65.94 3bim n VAL 105 Cb 0.20 -2.43 0.16 0.00 -0.91 0.00 0.00 33.84 30.86 3bim n VAL 105 CO 0.00 0.00 0.00 -0.03 -1.32 0.00 0.00 176.83 175.48 3bim h MET 106 N 0.00 0.00 -0.37 5.55 -1.53 -1.21 0.72 114.93 118.10 3bim h MET 106 Ca 0.00 -0.00 0.03 0.00 -3.44 0.00 0.00 59.70 56.29 3bim h MET 106 Cb 0.00 -0.00 -0.03 0.00 -0.55 0.00 0.00 31.60 31.02 3bim h MET 106 CO 0.00 0.00 0.16 0.00 0.14 0.00 0.00 176.91 177.21 3bim h ALA 107 N 1.97 0.44 -0.38 0.39 0.00 -0.20 -0.56 119.26 120.92 3bim h ALA 107 Ca 0.49 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.39 3bim h ALA 107 Cb 0.81 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.55 3bim h ALA 107 CO -0.99 -0.22 0.10 1.15 0.00 0.00 0.00 179.25 179.30 3bim h THR 108 N 0.34 1.22 -0.90 0.00 2.02 0.19 -1.44 112.91 114.33 3bim h THR 108 Ca 0.16 -0.75 0.15 0.00 0.77 0.00 0.00 66.41 66.74 3bim h THR 108 Cb 0.10 0.99 -0.09 0.00 -1.74 0.00 0.00 68.15 67.41 3bim h THR 108 CO -0.13 0.26 0.51 0.00 0.37 0.00 0.00 175.52 176.52 3bim h ALA 109 N 0.95 1.39 -0.24 6.16 0.00 0.57 -1.44 119.26 126.65 3bim h ALA 109 Ca 0.12 0.07 -0.05 0.00 0.00 0.00 0.00 54.91 55.05 3bim h ALA 109 Cb 0.29 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 3bim h ALA 109 CO -0.00 -0.01 -0.04 0.00 0.00 0.00 0.00 179.25 179.20 3bim h MET 110 N 0.73 0.45 -0.50 0.00 3.00 -0.33 -0.88 114.93 117.40 3bim h MET 110 Ca 0.49 -0.17 0.02 0.00 0.00 0.00 0.00 59.70 60.04 3bim h MET 110 Cb 0.64 -0.03 -0.03 0.00 0.00 0.00 0.00 31.60 32.19 3bim h MET 110 CO -0.34 0.67 0.33 -0.92 0.00 0.00 0.00 176.91 176.65 3bim h TYR 111 N 0.19 0.57 0.00 -0.10 3.20 -0.84 -2.52 116.97 117.49 3bim h TYR 111 Ca 0.06 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.95 3bim h TYR 111 Cb 0.49 -0.19 0.00 0.00 1.54 0.00 0.00 36.73 38.57 3bim h TYR 111 CO 0.05 0.35 -0.18 1.28 -1.64 0.00 0.00 178.16 178.01 3bim n LEU 112 N -4.47 0.37 -1.74 2.82 4.77 -0.58 -4.80 117.00 113.37 3bim n LEU 112 Ca 0.05 0.38 -0.05 0.00 -0.03 0.00 0.00 56.01 56.35 3bim n LEU 112 Cb 0.11 -0.37 0.03 0.00 -2.33 0.00 0.00 43.42 40.86 3bim n LEU 112 CO 0.35 -0.02 0.04 0.00 -1.33 0.00 0.00 177.39 176.43 3bim n GLN 113 N -1.74 -2.07 -3.55 3.23 6.02 -0.42 -3.03 117.38 115.82 3bim n GLN 113 Ca 0.06 0.26 -0.27 0.00 -0.01 0.00 0.00 57.00 57.04 3bim n GLN 113 Cb 0.37 -3.54 -0.09 0.00 1.02 0.00 0.00 30.24 27.99 3bim n GLN 113 CO 0.00 0.00 0.00 -1.33 -1.01 0.00 0.00 177.06 174.72 3bim n MET 114 N -1.97 1.99 0.16 -1.09 2.81 -0.68 -3.81 117.12 114.53 3bim n MET 114 Ca -0.09 -4.39 0.02 0.00 -1.81 0.00 0.00 57.70 51.43 3bim n MET 114 Cb 0.55 -2.13 0.25 0.00 -0.71 0.00 0.00 33.22 31.18 3bim n MET 114 CO 0.00 0.00 0.00 1.49 1.51 0.00 0.00 175.97 178.97 3bim h GLU 115 N 4.63 0.00 0.00 0.03 4.57 -1.94 -2.04 114.58 119.83 3bim h GLU 115 Ca 0.18 0.00 -0.06 0.00 -1.18 0.00 0.00 59.36 58.29 3bim h GLU 115 Cb 0.73 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.31 3bim h GLU 115 CO 0.74 0.51 -0.29 1.12 -1.18 0.00 0.00 179.01 179.90 3bim h HIS 116 N 0.00 0.00 -0.28 0.92 2.07 -1.96 -1.57 115.15 114.33 3bim h HIS 116 Ca -0.01 0.00 -0.18 0.00 -2.85 0.00 0.00 60.37 57.33 3bim h HIS 116 Cb 0.98 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.96 3bim h HIS 116 CO 0.00 0.29 -0.54 0.28 -3.07 0.00 0.00 177.93 174.89 3bim h VAL 117 N 0.00 1.28 0.07 6.12 2.07 -1.77 -2.83 116.25 121.19 3bim h VAL 117 Ca -0.00 -1.72 0.02 0.00 0.82 0.00 0.00 66.70 65.81 3bim h VAL 117 Cb 0.54 1.66 -0.02 0.00 -1.52 0.00 0.00 31.29 31.94 3bim h VAL 117 CO 0.04 0.56 -0.16 0.58 0.02 0.00 0.00 177.57 178.61 3bim h VAL 118 N 0.63 0.62 0.00 2.57 2.07 -1.32 -0.40 116.25 120.43 3bim h VAL 118 Ca 0.01 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.52 3bim h VAL 118 Cb 1.15 0.62 -0.00 0.00 -1.52 0.00 0.00 31.29 31.54 3bim h VAL 118 CO 0.12 0.00 -0.05 0.44 0.02 0.00 0.00 177.57 178.10 3bim h ASP 119 N -0.30 0.00 -0.09 0.57 3.32 -1.32 -1.12 116.42 117.47 3bim h ASP 119 Ca 0.03 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 56.95 3bim h ASP 119 Cb 0.33 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.89 3bim h ASP 119 CO -0.10 0.05 -0.44 0.74 -1.72 0.00 0.00 179.24 177.76 3bim h THR 120 N 0.00 1.39 -0.76 0.35 2.02 -1.10 -1.04 112.91 113.77 3bim h THR 120 Ca -0.00 -1.80 -0.05 0.00 0.77 0.00 0.00 66.41 65.33 3bim h THR 120 Cb 0.11 2.24 -0.03 0.00 -1.74 0.00 0.00 68.15 68.73 3bim h THR 120 CO 0.01 0.53 0.26 0.00 0.37 0.00 0.00 175.52 176.69 3bim h ARG 122 N 1.12 -0.30 0.00 0.00 2.43 -1.25 -2.88 114.38 113.50 3bim h ARG 122 Ca 0.25 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.44 3bim h ARG 122 Cb 0.28 0.07 0.00 0.00 -0.42 0.00 0.00 29.97 29.89 3bim h ARG 122 CO -0.01 -0.20 0.00 1.17 -1.51 0.00 0.00 179.97 179.42 3bim n LYS 123 N -3.06 0.00 -0.13 0.20 4.81 -0.40 -0.56 118.16 119.01 3bim n LYS 123 Ca -0.04 0.00 -0.28 0.00 -0.87 0.00 0.00 58.31 57.12 3bim n LYS 123 Cb 0.12 -0.99 -0.10 0.00 0.02 0.00 0.00 35.03 34.08 3bim n LYS 123 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 3bim n PHE 124 N -0.30 0.14 -1.55 5.64 7.35 -0.58 -4.94 117.46 123.22 3bim n PHE 124 Ca 0.00 0.06 -0.49 0.00 -0.76 0.00 0.00 57.45 56.26 3bim n PHE 124 Cb 0.00 -0.99 -0.06 0.00 0.35 0.00 0.00 39.48 38.78 3bim n PHE 124 CO 0.00 0.00 0.00 -0.89 -0.76 0.00 0.00 176.76 175.11 3bim n ILE 125 N -4.28 0.32 0.05 -2.13 5.41 0.27 -5.09 119.36 113.91 3bim n ILE 125 Ca -0.50 -0.26 0.01 0.00 1.00 0.00 0.00 62.75 63.00 3bim n ILE 125 Cb 0.84 -1.88 0.01 0.00 -0.71 0.00 0.00 39.64 37.90 3bim n ILE 125 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84