#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i4v s PHE 26 N 0.00 2.41 0.50 0.00 0.08 -1.26 -4.94 117.98 114.77 1i4v s PHE 26 Ca 0.00 -2.72 0.19 0.00 0.12 0.00 0.00 56.93 54.52 1i4v s PHE 26 Cb 0.00 -2.13 1.29 0.00 -0.57 0.00 0.00 43.02 41.61 1i4v s PHE 26 CO 0.00 -0.74 2.11 -1.00 -0.10 0.00 0.00 175.22 175.49 1i4v h PRO 27 N 6.36 0.00 -2.38 0.24 0.14 -2.10 -3.36 132.00 130.91 1i4v h PRO 27 Ca 0.03 0.00 -0.51 0.00 0.14 0.00 0.00 66.00 65.66 1i4v h PRO 27 Cb 0.89 0.00 -0.36 0.00 0.14 0.00 0.00 31.00 31.67 1i4v h PRO 27 CO 0.55 0.07 -0.79 -1.12 0.14 0.00 0.00 178.00 176.85 1i4v s SER 28 N -6.81 2.38 -0.29 1.44 0.01 -1.26 -5.09 113.70 104.08 1i4v s SER 28 Ca -0.04 -1.95 -0.28 0.00 1.31 0.00 0.00 55.95 55.00 1i4v s SER 28 Cb 0.16 -0.07 -0.05 0.00 0.21 0.00 0.00 66.02 66.27 1i4v s SER 28 CO 0.65 -0.30 2.26 -2.84 0.41 0.00 0.00 173.24 173.42 1i4v s PRO 29 N 1.24 2.88 0.04 12.44 0.01 -1.26 -4.90 135.00 145.45 1i4v s PRO 29 Ca 0.17 1.86 -0.27 0.00 0.01 0.00 0.00 61.00 62.77 1i4v s PRO 29 Cb -0.20 -4.42 0.09 0.00 0.01 0.00 0.00 34.50 29.98 1i4v s PRO 29 CO -0.02 -2.40 0.79 0.00 0.01 0.00 0.00 177.00 175.38 1i4v s ALA 30 N 9.24 -1.75 0.38 -1.55 0.00 -1.26 -5.14 121.76 121.69 1i4v s ALA 30 Ca 0.99 0.87 -0.27 0.00 0.00 0.00 0.00 51.96 53.56 1i4v s ALA 30 Cb -0.29 0.51 -0.09 0.00 0.00 0.00 0.00 23.12 23.25 1i4v s ALA 30 CO 0.33 -0.69 1.33 0.00 0.00 0.00 0.00 175.76 176.73 1i4v s ALA 31 N -3.17 3.36 -0.28 0.00 0.00 -1.26 -4.89 121.76 115.52 1i4v s ALA 31 Ca 0.03 1.29 -0.28 0.00 0.00 0.00 0.00 51.96 52.99 1i4v s ALA 31 Cb -0.01 -3.50 -0.03 0.00 0.00 0.00 0.00 23.12 19.58 1i4v s ALA 31 CO -0.09 -0.81 1.90 -0.51 0.00 0.00 0.00 175.76 176.26 1i4v s ASP 32 N -0.59 5.82 0.64 0.00 1.11 -1.26 -4.77 116.67 117.62 1i4v s ASP 32 Ca 0.54 1.51 0.00 0.00 0.18 0.00 0.00 52.55 54.78 1i4v s ASP 32 Cb -0.40 -2.52 0.00 0.00 1.07 0.00 0.00 42.92 41.07 1i4v s ASP 32 CO 0.52 -1.73 0.00 -1.22 1.18 0.00 0.00 175.17 173.91 1i4v n TYR 33 N 10.49 -1.40 -4.44 4.23 4.01 -1.26 -4.92 117.16 123.87 1i4v n TYR 33 Ca 0.24 0.00 -0.23 0.00 -0.16 0.00 0.00 57.90 57.76 1i4v n TYR 33 Cb 0.46 0.18 -0.08 0.00 -0.31 0.00 0.00 39.34 39.58 1i4v n TYR 33 CO 0.00 0.00 0.00 0.14 -0.46 0.00 0.00 176.86 176.54 1i4v s VAL 34 N 0.00 0.48 -0.76 -0.72 -7.23 -1.26 -5.04 120.40 105.86 1i4v s VAL 34 Ca 0.00 -2.00 -0.26 0.00 -1.81 0.00 0.00 61.98 57.91 1i4v s VAL 34 Cb 0.00 -2.43 -0.12 0.00 0.56 0.00 0.00 36.38 34.39 1i4v s VAL 34 CO 0.00 0.00 2.37 -1.61 -0.31 0.00 0.00 175.10 175.55 1i4v s GLU 35 N -3.71 1.73 -0.04 4.82 2.02 -1.26 -4.77 118.70 117.49 1i4v s GLU 35 Ca 0.29 0.54 -0.02 0.00 0.02 0.00 0.00 54.97 55.80 1i4v s GLU 35 Cb 0.03 -4.78 -0.01 0.00 0.10 0.00 0.00 34.13 29.47 1i4v s GLU 35 CO 0.17 -4.23 0.13 0.37 0.02 0.00 0.00 175.26 171.72 1i4v h GLN 36 N 13.41 -0.07 -5.38 1.61 4.15 -1.99 -3.50 115.11 123.36 1i4v h GLN 36 Ca -0.02 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.41 1i4v h GLN 36 Cb 1.03 0.02 -0.07 0.00 0.21 0.00 0.00 27.48 28.67 1i4v h GLN 36 CO 1.04 -0.05 -1.12 -2.13 -1.93 0.00 0.00 178.83 174.64 1i4v n ARG 37 N -3.53 -3.39 -1.80 1.69 0.63 -1.26 -4.61 116.66 104.39 1i4v n ARG 37 Ca -0.01 2.68 -0.20 0.00 -0.92 0.00 0.00 57.85 59.40 1i4v n ARG 37 Cb 0.03 -4.00 -0.08 0.00 0.45 0.00 0.00 32.46 28.87 1i4v n ARG 37 CO 0.00 0.00 0.00 -1.50 -2.51 0.00 0.00 177.63 173.62 1i4v s ILE 38 N -0.78 3.23 -1.18 5.15 2.07 -1.26 -4.64 121.20 123.79 1i4v s ILE 38 Ca -0.15 -0.31 0.25 0.00 -1.41 0.00 0.00 60.65 59.04 1i4v s ILE 38 Cb 0.01 -3.87 0.06 0.00 0.13 0.00 0.00 42.46 38.78 1i4v s ILE 38 CO 0.58 -0.45 1.43 -0.67 -1.91 0.00 0.00 174.94 173.91 1i4v n ASP 39 N 17.00 0.65 -0.17 4.50 -0.08 -1.26 -4.07 116.55 133.12 1i4v n ASP 39 Ca 0.43 -0.43 -0.07 0.00 -1.51 0.00 0.00 54.79 53.21 1i4v n ASP 39 Cb 0.46 0.25 0.02 0.00 2.34 0.00 0.00 41.12 44.19 1i4v n ASP 39 CO 0.00 0.00 0.00 0.25 0.12 0.00 0.00 177.20 177.57 1i4v h LEU 40 N 0.29 0.58 -0.12 -2.67 7.12 -1.97 0.13 115.31 118.68 1i4v h LEU 40 Ca 0.00 -0.02 0.00 0.00 0.13 0.00 0.00 57.88 57.99 1i4v h LEU 40 Cb 0.50 -0.15 0.00 0.00 -0.53 0.00 0.00 40.66 40.49 1i4v h LEU 40 CO 0.00 0.42 0.00 -0.46 -0.13 0.00 0.00 178.44 178.27 1i4v n ASN 41 N -4.73 0.26 -0.04 1.25 6.94 -1.26 -2.84 115.26 114.84 1i4v n ASN 41 Ca 0.02 0.54 -0.01 0.00 -0.02 0.00 0.00 54.58 55.11 1i4v n ASN 41 Cb 0.02 -0.60 -0.00 0.00 -2.36 0.00 0.00 39.78 36.83 1i4v n ASN 41 CO 0.00 0.00 0.00 -0.61 -1.03 0.00 0.00 177.26 175.62 1i4v h GLN 42 N 0.00 0.00 0.00 -3.83 -0.00 -1.00 -2.81 115.11 107.46 1i4v h GLN 42 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 1i4v h GLN 42 Cb 0.44 0.00 0.00 0.00 0.00 0.00 0.00 27.48 27.92 1i4v h GLN 42 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 178.83 180.30 1i4v n LEU 43 N -3.77 0.64 -0.01 -2.39 -0.00 -0.06 -2.65 117.00 108.76 1i4v n LEU 43 Ca -0.02 0.71 0.08 0.00 -0.00 0.00 0.00 56.01 56.77 1i4v n LEU 43 Cb 0.08 -0.68 -0.11 0.00 -0.00 0.00 0.00 43.42 42.71 1i4v n LEU 43 CO 0.03 -0.73 -0.49 0.18 -0.00 0.00 0.00 177.39 176.38 1i4v n LEU 44 N -2.26 0.22 -4.80 1.47 4.32 -1.13 -5.00 117.00 109.82 1i4v n LEU 44 Ca 0.01 -0.15 -0.26 0.00 -0.02 0.00 0.00 56.01 55.59 1i4v n LEU 44 Cb 0.15 0.00 -0.05 0.00 -1.62 0.00 0.00 43.42 41.90 1i4v n LEU 44 CO 0.16 0.05 -0.10 -0.63 -1.22 0.00 0.00 177.39 175.65 1i4v s ILE 45 N -2.91 1.99 0.00 -0.08 1.01 -1.06 -5.03 121.20 115.12 1i4v s ILE 45 Ca -0.02 -1.65 0.00 0.00 0.00 0.00 0.00 60.65 58.98 1i4v s ILE 45 Cb 0.11 -2.64 0.00 0.00 0.01 0.00 0.00 42.46 39.94 1i4v s ILE 45 CO 0.65 0.00 0.18 0.00 0.00 0.00 0.00 174.94 175.77 1i4v n GLN 46 N -1.42 1.07 -3.77 2.79 1.13 -1.26 -4.78 117.38 111.14 1i4v n GLN 46 Ca -0.03 -0.18 -0.12 0.00 -1.94 0.00 0.00 57.00 54.73 1i4v n GLN 46 Cb 0.65 -0.59 -0.08 0.00 0.11 0.00 0.00 30.24 30.32 1i4v n GLN 46 CO 0.00 0.00 0.00 -1.01 -1.44 0.00 0.00 177.06 174.61 1i4v s HIS 47 N -0.20 -0.09 0.17 1.08 3.76 -1.26 -5.05 115.29 113.70 1i4v s HIS 47 Ca 0.00 -0.01 -0.13 0.00 -0.15 0.00 0.00 55.06 54.77 1i4v s HIS 47 Cb 0.00 0.07 0.08 0.00 1.11 0.00 0.00 32.58 33.84 1i4v s HIS 47 CO 0.00 -0.46 1.77 -1.00 -0.85 0.00 0.00 174.74 174.20 1i4v h PRO 48 N 3.41 0.83 -1.45 8.40 0.14 -1.98 -3.38 132.00 137.97 1i4v h PRO 48 Ca -0.31 -0.11 -0.41 0.00 0.14 0.00 0.00 66.00 65.31 1i4v h PRO 48 Cb 1.19 -0.16 -0.29 0.00 0.14 0.00 0.00 31.00 31.89 1i4v h PRO 48 CO 0.45 0.65 -0.82 0.43 0.14 0.00 0.00 178.00 178.86 1i4v n SER 49 N -4.56 -1.40 -2.14 1.44 7.64 -1.26 -4.95 113.62 108.38 1i4v n SER 49 Ca 0.04 -2.79 -0.02 0.00 1.01 0.00 0.00 58.87 57.11 1i4v n SER 49 Cb 0.10 0.41 0.03 0.00 -1.01 0.00 0.00 64.21 63.74 1i4v n SER 49 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1i4v n ALA 50 N 2.13 -0.82 -3.11 -0.43 0.00 -1.26 -5.09 120.51 111.93 1i4v n ALA 50 Ca 0.20 -0.42 -0.21 0.00 0.00 0.00 0.00 53.44 53.02 1i4v n ALA 50 Cb 0.55 -0.74 -0.16 0.00 0.00 0.00 0.00 19.45 19.09 1i4v n ALA 50 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1i4v s THR 51 N 0.05 0.79 0.15 0.00 2.01 -1.26 -2.23 115.64 115.14 1i4v s THR 51 Ca 0.04 -0.35 0.07 0.00 0.31 0.00 0.00 61.69 61.76 1i4v s THR 51 Cb 0.14 -0.71 -0.04 0.00 0.01 0.00 0.00 72.50 71.90 1i4v s THR 51 CO -0.04 0.25 -0.03 -0.31 -0.69 0.00 0.00 174.62 173.80 1i4v s TYR 52 N 0.28 2.82 0.06 4.92 1.51 0.13 -4.76 117.35 122.31 1i4v s TYR 52 Ca -0.05 -0.13 -0.04 0.00 -1.01 0.00 0.00 57.07 55.85 1i4v s TYR 52 Cb -0.10 -1.41 -0.03 0.00 -0.11 0.00 0.00 41.96 40.32 1i4v s TYR 52 CO 0.01 0.49 0.05 -0.59 -1.11 0.00 0.00 175.55 174.40 1i4v s PHE 53 N -1.55 0.37 -0.22 2.71 -0.12 -1.26 0.94 117.98 118.85 1i4v s PHE 53 Ca 0.26 -0.86 -0.15 0.00 -0.05 0.00 0.00 56.93 56.13 1i4v s PHE 53 Cb -0.10 -0.26 0.06 0.00 -0.63 0.00 0.00 43.02 42.09 1i4v s PHE 53 CO 0.17 -0.42 0.55 0.54 -0.05 0.00 0.00 175.22 176.01 1i4v s VAL 54 N -3.71 -0.01 0.25 -2.49 0.11 -0.79 -4.94 120.40 108.81 1i4v s VAL 54 Ca 0.05 0.03 -0.30 0.00 -2.93 0.00 0.00 61.98 58.83 1i4v s VAL 54 Cb 0.06 -0.79 -0.09 0.00 -1.53 0.00 0.00 36.38 34.03 1i4v s VAL 54 CO -0.10 0.01 1.16 -0.75 -3.33 0.00 0.00 175.10 172.10 1i4v s LYS 55 N 1.07 4.55 -0.48 1.54 2.36 -1.26 -1.88 119.74 125.64 1i4v s LYS 55 Ca -0.06 1.88 -0.16 0.00 -2.55 0.00 0.00 55.97 55.08 1i4v s LYS 55 Cb -0.06 -3.20 0.08 0.00 -1.05 0.00 0.00 37.83 33.60 1i4v s LYS 55 CO -0.10 0.05 0.41 0.00 1.55 0.00 0.00 175.35 177.26 1i4v s ALA 56 N -0.72 3.56 -0.44 3.13 0.00 -0.58 -4.88 121.76 121.83 1i4v s ALA 56 Ca 0.48 -2.14 0.09 0.00 0.00 0.00 0.00 51.96 50.40 1i4v s ALA 56 Cb -0.33 -3.10 0.34 0.00 0.00 0.00 0.00 23.12 20.03 1i4v s ALA 56 CO 0.41 -1.77 0.79 0.43 0.00 0.00 0.00 175.76 175.62 1i4v n SER 57 N 5.25 2.03 0.00 0.00 7.64 -1.26 -1.52 113.62 125.75 1i4v n SER 57 Ca -0.12 -3.22 0.00 0.00 1.01 0.00 0.00 58.87 56.54 1i4v n SER 57 Cb 0.43 -0.60 0.00 0.00 -1.01 0.00 0.00 64.21 63.03 1i4v n SER 57 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1i4v n GLY 58 N 0.18 0.96 0.87 0.23 0.00 -1.26 -4.80 105.19 101.38 1i4v n GLY 58 Ca 0.27 -0.06 -0.04 0.00 0.00 0.00 0.00 46.02 46.19 1i4v n GLY 58 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1i4v n ASP 59 N 0.00 -0.60 0.00 1.61 5.68 -1.26 -1.58 116.55 120.40 1i4v n ASP 59 Ca 0.00 -1.72 0.11 0.00 -0.50 0.00 0.00 54.79 52.68 1i4v n ASP 59 Cb 0.00 0.18 0.03 0.00 -1.14 0.00 0.00 41.12 40.18 1i4v n ASP 59 CO 0.00 0.00 0.00 -0.24 -1.33 0.00 0.00 177.20 175.63 1i4v n SER 60 N 0.03 0.79 -1.22 -1.12 2.88 -1.26 -4.36 113.62 109.35 1i4v n SER 60 Ca -0.18 -0.68 0.04 0.00 -1.33 0.00 0.00 58.87 56.72 1i4v n SER 60 Cb 0.67 0.72 0.04 0.00 -0.75 0.00 0.00 64.21 64.88 1i4v n SER 60 CO 0.00 0.00 0.00 0.23 -1.23 0.00 0.00 175.04 174.04 1i4v n MET 61 N -1.53 0.16 0.25 -1.46 2.81 -1.26 -3.62 117.12 112.48 1i4v n MET 61 Ca 0.04 -1.95 0.17 0.00 -1.81 0.00 0.00 57.70 54.16 1i4v n MET 61 Cb 0.34 -0.26 0.89 0.00 -0.71 0.00 0.00 33.22 33.49 1i4v n MET 61 CO 0.00 0.00 0.00 0.82 1.51 0.00 0.00 175.97 178.30 1i4v h ILE 62 N 6.34 0.39 -0.64 2.02 2.04 -1.73 0.73 117.51 126.66 1i4v h ILE 62 Ca -0.17 0.00 0.19 0.00 1.00 0.00 0.00 64.86 65.88 1i4v h ILE 62 Cb 1.72 0.88 -0.03 0.00 -0.74 0.00 0.00 36.82 38.65 1i4v h ILE 62 CO 0.07 0.00 0.62 -2.24 0.00 0.00 0.00 178.15 176.60 1i4v h ASP 63 N 0.00 0.00 0.17 1.72 3.04 -1.86 0.22 116.42 119.71 1i4v h ASP 63 Ca 0.05 0.00 -0.36 0.00 -3.24 0.00 0.00 57.03 53.49 1i4v h ASP 63 Cb 0.34 0.00 -0.03 0.00 -1.04 0.00 0.00 39.33 38.60 1i4v h ASP 63 CO -0.00 0.00 -2.04 0.61 -2.04 0.00 0.00 179.24 175.77 1i4v n GLY 64 N -1.58 -0.63 0.00 7.15 0.00 0.24 -4.78 105.19 105.59 1i4v n GLY 64 Ca 0.13 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.93 1i4v n GLY 64 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1i4v n GLY 65 N 1.94 0.61 3.60 -0.02 0.00 0.78 -4.93 105.19 107.16 1i4v n GLY 65 Ca -0.31 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.28 1i4v n GLY 65 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1i4v s ILE 66 N 0.00 3.47 -0.49 -0.61 -5.25 -1.25 -4.89 121.20 112.19 1i4v s ILE 66 Ca 0.00 0.47 0.08 0.00 -0.99 0.00 0.00 60.65 60.20 1i4v s ILE 66 Cb 0.00 -3.65 0.28 0.00 2.95 0.00 0.00 42.46 42.04 1i4v s ILE 66 CO 0.00 -0.43 0.68 -0.24 -1.79 0.00 0.00 174.94 173.16 1i4v n SER 67 N 10.43 1.93 -2.97 4.36 2.88 -1.26 -2.96 113.62 126.02 1i4v n SER 67 Ca 0.23 -3.10 0.00 0.00 -1.33 0.00 0.00 58.87 54.66 1i4v n SER 67 Cb 0.47 -0.63 0.00 0.00 -0.75 0.00 0.00 64.21 63.30 1i4v n SER 67 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1i4v n ASP 68 N 0.82 -6.86 0.00 -3.46 2.03 -0.62 -4.70 116.55 103.77 1i4v n ASP 68 Ca 0.26 0.70 0.00 0.00 0.52 0.00 0.00 54.79 56.27 1i4v n ASP 68 Cb 0.50 -1.47 0.00 0.00 -0.72 0.00 0.00 41.12 39.43 1i4v n ASP 68 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1i4v n GLY 69 N 1.98 0.73 3.60 0.27 0.00 -0.57 -4.88 105.19 106.32 1i4v n GLY 69 Ca 0.00 -0.14 -0.04 0.00 0.00 0.00 0.00 46.02 45.84 1i4v n GLY 69 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1i4v s ASP 70 N -0.60 -0.13 -0.20 1.61 -4.77 -1.23 -4.09 116.67 107.26 1i4v s ASP 70 Ca 0.00 0.03 -0.03 0.00 -3.30 0.00 0.00 52.55 49.25 1i4v s ASP 70 Cb 0.00 0.13 -0.01 0.00 -1.09 0.00 0.00 42.92 41.95 1i4v s ASP 70 CO 0.00 -0.20 -0.05 -0.22 0.70 0.00 0.00 175.17 175.40 1i4v s LEU 71 N -1.93 2.96 0.06 2.11 1.98 -0.32 -1.52 118.68 122.01 1i4v s LEU 71 Ca 0.09 -0.33 -0.16 0.00 -2.89 0.00 0.00 54.13 50.84 1i4v s LEU 71 Cb -0.01 -1.74 -0.06 0.00 0.66 0.00 0.00 46.19 45.04 1i4v s LEU 71 CO -0.05 0.04 0.49 -0.22 -1.89 0.00 0.00 176.35 174.72 1i4v s LEU 72 N 1.14 4.45 -0.21 -0.68 1.98 -0.79 0.13 118.68 124.71 1i4v s LEU 72 Ca 0.02 1.07 -0.01 0.00 -2.89 0.00 0.00 54.13 52.31 1i4v s LEU 72 Cb -0.15 -2.86 0.06 0.00 0.66 0.00 0.00 46.19 43.91 1i4v s LEU 72 CO -0.01 0.25 -0.00 -0.63 -1.89 0.00 0.00 176.35 174.07 1i4v s ILE 73 N -1.20 0.96 0.25 6.68 -1.09 0.03 -1.89 121.20 124.94 1i4v s ILE 73 Ca 0.29 -0.85 0.07 0.00 -2.23 0.00 0.00 60.65 57.94 1i4v s ILE 73 Cb -0.17 -1.36 -0.04 0.00 -1.58 0.00 0.00 42.46 39.31 1i4v s ILE 73 CO 0.17 -0.16 0.15 0.54 -1.23 0.00 0.00 174.94 174.40 1i4v s VAL 74 N 1.66 4.24 -0.38 2.92 0.11 0.27 0.11 120.40 129.32 1i4v s VAL 74 Ca -0.03 -1.48 0.02 0.00 -2.93 0.00 0.00 61.98 57.56 1i4v s VAL 74 Cb -0.18 -3.27 0.11 0.00 -1.53 0.00 0.00 36.38 31.50 1i4v s VAL 74 CO -0.07 -0.33 0.12 -1.81 -3.33 0.00 0.00 175.10 169.67 1i4v s ASP 75 N -3.74 4.83 -0.69 3.54 1.01 -1.07 0.19 116.67 120.75 1i4v s ASP 75 Ca 0.32 -2.26 -0.27 0.00 0.71 0.00 0.00 52.55 51.06 1i4v s ASP 75 Cb -0.08 -1.68 0.04 0.00 1.01 0.00 0.00 42.92 42.21 1i4v s ASP 75 CO 0.24 -0.40 1.21 -0.94 0.21 0.00 0.00 175.17 175.49 1i4v s SER 76 N 0.95 6.23 0.00 0.27 1.04 -0.95 -1.32 113.70 119.92 1i4v s SER 76 Ca 0.11 -0.39 0.00 0.00 0.48 0.00 0.00 55.95 56.15 1i4v s SER 76 Cb -0.21 -2.54 0.00 0.00 0.10 0.00 0.00 66.02 63.38 1i4v s SER 76 CO -0.06 -1.69 0.00 0.00 0.98 0.00 0.00 173.24 172.47 1i4v n ALA 77 N 8.90 0.00 -2.67 5.32 0.00 -1.19 -4.23 120.51 126.64 1i4v n ALA 77 Ca 0.03 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.25 1i4v n ALA 77 Cb 0.48 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.88 1i4v n ALA 77 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1i4v s ILE 78 N -1.76 3.71 -0.21 0.00 1.01 -1.26 -4.99 121.20 117.70 1i4v s ILE 78 Ca 0.00 -1.64 -0.16 0.00 0.00 0.00 0.00 60.65 58.85 1i4v s ILE 78 Cb 0.00 -3.09 -0.04 0.00 0.01 0.00 0.00 42.46 39.34 1i4v s ILE 78 CO 0.00 -0.31 0.39 -0.89 0.00 0.00 0.00 174.94 174.13 1i4v s THR 79 N -2.28 5.20 0.00 2.92 2.01 -1.26 -2.95 115.64 119.28 1i4v s THR 79 Ca 0.34 0.69 0.00 0.00 0.31 0.00 0.00 61.69 63.03 1i4v s THR 79 Cb -0.06 -3.72 0.00 0.00 0.01 0.00 0.00 72.50 68.73 1i4v s THR 79 CO 0.23 0.24 0.00 0.00 -0.69 0.00 0.00 174.62 174.40 1i4v n ALA 80 N 4.57 0.00 -2.95 7.40 0.00 -1.04 -4.90 120.51 123.59 1i4v n ALA 80 Ca -0.08 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.26 1i4v n ALA 80 Cb 0.51 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.86 1i4v n ALA 80 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1i4v s SER 81 N -1.55 0.18 0.36 0.00 0.01 -1.26 -4.99 113.70 106.45 1i4v s SER 81 Ca 0.00 -0.44 -0.26 0.00 1.31 0.00 0.00 55.95 56.56 1i4v s SER 81 Cb 0.00 0.15 -0.12 0.00 0.21 0.00 0.00 66.02 66.26 1i4v s SER 81 CO 0.00 -0.36 0.96 1.41 0.41 0.00 0.00 173.24 175.66 1i4v n HIS 82 N 1.39 1.05 -1.99 2.43 8.25 -1.26 -2.89 115.22 122.20 1i4v n HIS 82 Ca -0.23 0.63 0.00 0.00 -0.26 0.00 0.00 57.72 57.86 1i4v n HIS 82 Cb 0.56 -2.21 0.00 0.00 1.12 0.00 0.00 29.99 29.45 1i4v n HIS 82 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1i4v n GLY 83 N 1.26 0.79 2.95 -1.41 0.00 -1.23 -5.05 105.19 102.51 1i4v n GLY 83 Ca 0.10 -0.68 -0.12 0.00 0.00 0.00 0.00 46.02 45.31 1i4v n GLY 83 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1i4v s ASP 84 N -2.87 -0.09 -0.86 1.61 1.11 -1.14 -5.02 116.67 109.41 1i4v s ASP 84 Ca 0.00 0.19 -0.25 0.00 0.18 0.00 0.00 52.55 52.67 1i4v s ASP 84 Cb 0.00 0.18 -0.07 0.00 1.07 0.00 0.00 42.92 44.10 1i4v s ASP 84 CO 0.00 -0.05 2.07 -0.51 1.18 0.00 0.00 175.17 177.86 1i4v s ILE 85 N 0.19 3.33 0.27 0.77 -1.16 -1.26 -3.75 121.20 119.58 1i4v s ILE 85 Ca -0.01 -0.25 0.03 0.00 -0.51 0.00 0.00 60.65 59.90 1i4v s ILE 85 Cb -0.02 -3.74 -0.05 0.00 0.61 0.00 0.00 42.46 39.26 1i4v s ILE 85 CO -0.01 -0.69 0.05 0.68 -2.81 0.00 0.00 174.94 172.16 1i4v s VAL 86 N 11.30 0.88 -0.28 4.00 -7.23 -1.13 -4.49 120.40 123.45 1i4v s VAL 86 Ca 0.76 -2.01 -0.21 0.00 -1.81 0.00 0.00 61.98 58.72 1i4v s VAL 86 Cb -0.09 -2.58 -0.01 0.00 0.56 0.00 0.00 36.38 34.27 1i4v s VAL 86 CO 0.03 -0.12 0.64 -0.51 -0.31 0.00 0.00 175.10 174.83 1i4v s ILE 87 N -3.52 4.94 0.53 -0.62 1.10 -1.26 -2.80 121.20 119.58 1i4v s ILE 87 Ca 0.34 0.99 -0.03 0.00 -0.51 0.00 0.00 60.65 61.45 1i4v s ILE 87 Cb 0.07 -3.98 0.01 0.00 0.15 0.00 0.00 42.46 38.71 1i4v s ILE 87 CO 0.12 -0.08 0.80 0.00 -2.11 0.00 0.00 174.94 173.67 1i4v s ALA 88 N 2.59 3.52 -0.15 1.50 0.00 -0.56 0.10 121.76 128.77 1i4v s ALA 88 Ca 0.26 -0.89 -0.18 0.00 0.00 0.00 0.00 51.96 51.15 1i4v s ALA 88 Cb -0.15 -2.38 0.05 0.00 0.00 0.00 0.00 23.12 20.64 1i4v s ALA 88 CO 0.10 -0.64 0.48 0.00 0.00 0.00 0.00 175.76 175.71 1i4v s ALA 89 N -2.81 -1.20 -0.20 0.00 0.00 0.39 -1.92 121.76 116.02 1i4v s ALA 89 Ca 0.52 1.22 -0.08 0.00 0.00 0.00 0.00 51.96 53.63 1i4v s ALA 89 Cb -0.10 -0.60 0.09 0.00 0.00 0.00 0.00 23.12 22.50 1i4v s ALA 89 CO 0.42 -0.25 0.44 0.54 0.00 0.00 0.00 175.76 176.90 1i4v s VAL 90 N -0.11 -0.52 -1.57 0.00 0.11 -1.24 -2.80 120.40 114.27 1i4v s VAL 90 Ca -0.03 0.14 0.00 0.00 -2.93 0.00 0.00 61.98 59.16 1i4v s VAL 90 Cb -0.03 -0.68 0.00 0.00 -1.53 0.00 0.00 36.38 34.14 1i4v s VAL 90 CO 0.02 0.06 0.00 0.47 -3.33 0.00 0.00 175.10 172.32 1i4v n ASP 91 N 5.14 -4.04 0.00 3.54 9.92 -1.26 -1.63 116.55 128.21 1i4v n ASP 91 Ca -0.12 0.35 0.00 0.00 -0.53 0.00 0.00 54.79 54.49 1i4v n ASP 91 Cb 0.51 -3.67 0.00 0.00 -0.64 0.00 0.00 41.12 37.32 1i4v n ASP 91 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1i4v n GLY 92 N -0.34 1.65 3.75 0.44 0.00 -1.26 -5.11 105.19 104.31 1i4v n GLY 92 Ca -0.15 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.64 1i4v n GLY 92 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1i4v s GLU 93 N -0.62 2.43 -0.16 1.61 2.02 -0.65 -5.12 118.70 118.20 1i4v s GLU 93 Ca 0.00 -1.50 -0.04 0.00 0.02 0.00 0.00 54.97 53.44 1i4v s GLU 93 Cb 0.00 -2.22 0.07 0.00 0.10 0.00 0.00 34.13 32.08 1i4v s GLU 93 CO 0.00 0.12 0.15 -0.06 0.02 0.00 0.00 175.26 175.49 1i4v s PHE 94 N -2.40 -0.06 0.16 1.61 0.08 -1.26 -3.62 117.98 112.49 1i4v s PHE 94 Ca 0.38 0.07 0.10 0.00 0.12 0.00 0.00 56.93 57.60 1i4v s PHE 94 Cb -0.03 -0.48 -0.04 0.00 -0.57 0.00 0.00 43.02 41.89 1i4v s PHE 94 CO 0.23 -0.49 -0.21 0.95 -0.10 0.00 0.00 175.22 175.60 1i4v s THR 95 N 2.24 2.58 -0.37 0.64 -4.23 -0.81 -4.93 115.64 110.76 1i4v s THR 95 Ca 0.04 -1.79 -0.01 0.00 -1.18 0.00 0.00 61.69 58.76 1i4v s THR 95 Cb -0.15 -2.21 0.10 0.00 1.34 0.00 0.00 72.50 71.58 1i4v s THR 95 CO -0.09 -0.02 0.13 -0.69 -0.54 0.00 0.00 174.62 173.41 1i4v s VAL 96 N -1.41 2.93 0.00 2.29 1.01 -1.26 -1.49 120.40 122.46 1i4v s VAL 96 Ca 0.19 -2.07 0.00 0.00 0.00 0.00 0.00 61.98 60.10 1i4v s VAL 96 Cb -0.09 -3.01 0.00 0.00 0.00 0.00 0.00 36.38 33.28 1i4v s VAL 96 CO 0.10 -0.59 0.00 0.29 0.00 0.00 0.00 175.10 174.90 1i4v n LYS 97 N 4.49 -3.10 -2.85 2.72 4.76 -1.12 -4.13 118.16 118.93 1i4v n LYS 97 Ca -0.02 0.00 -0.43 0.00 -2.87 0.00 0.00 58.31 54.99 1i4v n LYS 97 Cb 0.42 0.00 -0.02 0.00 -1.84 0.00 0.00 35.03 33.58 1i4v n LYS 97 CO 0.00 0.00 0.00 -1.59 -1.37 0.00 0.00 177.40 174.44 1i4v s LYS 98 N -2.00 3.66 0.30 1.97 -2.85 -1.25 -2.84 119.74 116.73 1i4v s LYS 98 Ca 0.00 -1.73 -0.29 0.00 -1.00 0.00 0.00 55.97 52.95 1i4v s LYS 98 Cb 0.00 -5.03 -0.10 0.00 -2.06 0.00 0.00 37.83 30.63 1i4v s LYS 98 CO 0.00 -1.87 1.40 -0.48 0.10 0.00 0.00 175.35 174.50 1i4v s LEU 99 N 3.06 4.39 -0.12 2.77 2.34 -1.26 -4.51 118.68 125.34 1i4v s LEU 99 Ca 0.37 2.74 0.02 0.00 0.06 0.00 0.00 54.13 57.31 1i4v s LEU 99 Cb -0.03 -3.64 0.01 0.00 -0.56 0.00 0.00 46.19 41.97 1i4v s LEU 99 CO -0.08 -0.67 -0.17 -1.10 -1.06 0.00 0.00 176.35 173.26 1i4v s GLN 100 N -1.11 2.48 0.00 1.48 -0.21 -1.12 -3.50 119.66 117.68 1i4v s GLN 100 Ca 0.55 -0.66 0.00 0.00 0.02 0.00 0.00 55.36 55.27 1i4v s GLN 100 Cb -0.42 -2.08 0.00 0.00 1.00 0.00 0.00 33.01 31.51 1i4v s GLN 100 CO 0.49 -0.06 0.01 1.28 -2.12 0.00 0.00 175.29 174.90 1i4v n LEU 101 N 4.20 0.03 0.09 2.90 4.77 -1.13 -1.69 117.00 126.15 1i4v n LEU 101 Ca -0.19 -0.30 -0.04 0.00 -0.03 0.00 0.00 56.01 55.45 1i4v n LEU 101 Cb 0.51 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.58 1i4v n LEU 101 CO 0.25 0.01 0.21 0.03 -1.33 0.00 0.00 177.39 176.55 1i4v h ARG 102 N 0.00 -0.25 0.30 3.23 2.47 -1.99 -3.36 114.38 114.78 1i4v h ARG 102 Ca 0.00 0.02 -0.01 0.00 -1.26 0.00 0.00 59.98 58.72 1i4v h ARG 102 Cb 0.01 0.06 0.00 0.00 -1.65 0.00 0.00 29.97 28.39 1i4v h ARG 102 CO 0.00 -0.16 -0.14 -1.00 0.56 0.00 0.00 179.97 179.22 1i4v h PRO 103 N -0.53 -0.38 -3.78 0.04 0.13 -2.02 -3.46 132.00 121.99 1i4v h PRO 103 Ca -0.03 0.03 -0.09 0.00 -0.87 0.00 0.00 66.00 65.04 1i4v h PRO 103 Cb 0.20 0.09 -0.12 0.00 0.13 0.00 0.00 31.00 31.29 1i4v h PRO 103 CO 0.04 -0.24 -0.27 0.99 -0.23 0.00 0.00 178.00 178.29 1i4v s THR 104 N -6.05 0.07 -0.55 1.56 2.01 -1.26 -5.12 115.64 106.30 1i4v s THR 104 Ca -0.15 -1.26 -0.18 0.00 0.31 0.00 0.00 61.69 60.41 1i4v s THR 104 Cb 0.05 -1.74 0.10 0.00 0.01 0.00 0.00 72.50 70.92 1i4v s THR 104 CO 0.64 -0.31 0.61 0.54 -0.69 0.00 0.00 174.62 175.41 1i4v s VAL 105 N -3.94 4.97 0.10 3.82 0.11 -1.26 -2.85 120.40 121.34 1i4v s VAL 105 Ca 0.14 -1.05 -0.12 0.00 -2.93 0.00 0.00 61.98 58.03 1i4v s VAL 105 Cb 0.03 -4.39 0.01 0.00 -1.53 0.00 0.00 36.38 30.50 1i4v s VAL 105 CO -0.02 -0.96 0.28 -1.10 -3.33 0.00 0.00 175.10 169.97 1i4v s GLN 106 N 2.31 0.92 0.02 1.54 -0.21 -0.68 -2.79 119.66 120.77 1i4v s GLN 106 Ca 0.09 -0.83 -0.08 0.00 0.02 0.00 0.00 55.36 54.57 1i4v s GLN 106 Cb -0.25 0.39 -0.00 0.00 1.00 0.00 0.00 33.01 34.15 1i4v s GLN 106 CO 0.06 -0.32 0.15 -1.17 -2.12 0.00 0.00 175.29 171.89 1i4v s LEU 107 N -2.78 1.55 -0.48 2.90 2.96 -1.08 -2.78 118.68 118.97 1i4v s LEU 107 Ca 0.03 -0.32 0.06 0.00 -0.22 0.00 0.00 54.13 53.69 1i4v s LEU 107 Cb 0.03 0.74 0.18 0.00 0.50 0.00 0.00 46.19 47.65 1i4v s LEU 107 CO -0.11 -0.45 0.63 -0.51 -1.32 0.00 0.00 176.35 174.59 1i4v s ILE 108 N -1.95 -0.70 0.00 6.68 1.10 -1.26 -2.71 121.20 122.35 1i4v s ILE 108 Ca -0.10 -1.25 0.00 0.00 -0.51 0.00 0.00 60.65 58.79 1i4v s ILE 108 Cb -0.04 -0.28 0.00 0.00 0.15 0.00 0.00 42.46 42.29 1i4v s ILE 108 CO -0.01 -0.27 0.00 -0.81 -2.11 0.00 0.00 174.94 171.74 1i4v n PRO 109 N 3.10 1.60 -1.00 3.50 -0.05 -1.26 -4.81 135.00 136.08 1i4v n PRO 109 Ca 0.19 0.00 0.07 0.00 -0.05 0.00 0.00 63.50 63.72 1i4v n PRO 109 Cb 0.54 0.00 -0.04 0.00 -0.05 0.00 0.00 33.50 33.95 1i4v n PRO 109 CO 0.00 0.00 0.00 -1.33 -0.05 0.00 0.00 175.50 174.12 1i4v n MET 110 N 0.00 -2.45 0.00 0.54 2.81 -1.25 -4.37 117.12 112.40 1i4v n MET 110 Ca 0.00 1.96 0.00 0.00 -1.81 0.00 0.00 57.70 57.85 1i4v n MET 110 Cb 0.00 -2.64 0.00 0.00 -0.71 0.00 0.00 33.22 29.87 1i4v n MET 110 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 1i4v n ASN 111 N -3.05 0.00 0.13 7.83 5.15 -1.24 -4.40 115.26 119.68 1i4v n ASN 111 Ca -0.04 0.00 -0.21 0.00 -0.60 0.00 0.00 54.58 53.73 1i4v n ASN 111 Cb 0.41 0.00 -0.15 0.00 -0.53 0.00 0.00 39.78 39.51 1i4v n ASN 111 CO 0.00 0.00 0.00 0.77 1.40 0.00 0.00 177.26 179.43 1i4v h SER 112 N 0.00 0.69 -0.55 1.20 4.64 -1.92 -3.32 113.55 114.29 1i4v h SER 112 Ca 0.00 -0.73 -0.51 0.00 -0.47 0.00 0.00 61.79 60.08 1i4v h SER 112 Cb 0.00 -0.23 -0.09 0.00 -0.31 0.00 0.00 62.40 61.78 1i4v h SER 112 CO 0.00 1.57 1.42 0.00 -0.87 0.00 0.00 176.83 178.95 1i4v n ALA 113 N -2.65 6.77 -2.11 5.18 0.00 -1.26 -4.94 120.51 121.50 1i4v n ALA 113 Ca -0.13 -3.06 -0.42 0.00 0.00 0.00 0.00 53.44 49.83 1i4v n ALA 113 Cb 1.07 -2.61 -0.03 0.00 0.00 0.00 0.00 19.45 17.88 1i4v n ALA 113 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 1i4v s TYR 114 N 0.04 2.62 -0.44 0.00 1.13 -1.25 -4.76 117.35 114.68 1i4v s TYR 114 Ca 0.63 0.60 0.03 0.00 -1.41 0.00 0.00 57.07 56.91 1i4v s TYR 114 Cb 0.27 -3.78 0.12 0.00 -1.10 0.00 0.00 41.96 37.47 1i4v s TYR 114 CO -0.10 -3.03 0.18 -1.12 -2.51 0.00 0.00 175.55 168.98 1i4v s SER 115 N 2.21 4.69 0.05 -0.18 0.01 -1.26 -5.07 113.70 114.15 1i4v s SER 115 Ca 0.68 -2.54 -0.30 0.00 1.31 0.00 0.00 55.95 55.10 1i4v s SER 115 Cb -0.34 -1.68 -0.09 0.00 0.21 0.00 0.00 66.02 64.12 1i4v s SER 115 CO 0.28 -0.34 1.93 -2.84 0.41 0.00 0.00 173.24 172.68 1i4v s PRO 116 N 0.38 4.14 -0.05 12.44 0.01 -1.26 -4.72 135.00 145.94 1i4v s PRO 116 Ca 0.14 2.60 0.01 0.00 0.01 0.00 0.00 61.00 63.76 1i4v s PRO 116 Cb -0.22 -4.04 0.02 0.00 0.01 0.00 0.00 34.50 30.27 1i4v s PRO 116 CO -0.04 -0.93 -0.05 -1.50 0.01 0.00 0.00 177.00 174.48 1i4v s ILE 117 N 4.11 0.62 0.51 2.83 2.07 -1.10 -5.05 121.20 125.19 1i4v s ILE 117 Ca 0.87 -0.16 -0.06 0.00 -1.41 0.00 0.00 60.65 59.88 1i4v s ILE 117 Cb -0.43 -0.63 -0.03 0.00 0.13 0.00 0.00 42.46 41.50 1i4v s ILE 117 CO 0.40 0.25 0.84 0.28 -1.91 0.00 0.00 174.94 174.79 1i4v s THR 118 N 0.93 4.75 0.41 4.00 -1.32 -1.26 -2.63 115.64 120.52 1i4v s THR 118 Ca -0.11 0.28 0.08 0.00 -1.21 0.00 0.00 61.69 60.73 1i4v s THR 118 Cb -0.14 -3.82 -0.03 0.00 -1.51 0.00 0.00 72.50 67.00 1i4v s THR 118 CO 0.00 -0.86 0.34 -0.63 -2.21 0.00 0.00 174.62 171.27 1i4v s ILE 119 N -2.84 2.65 -0.99 5.08 1.01 -1.12 -4.95 121.20 120.05 1i4v s ILE 119 Ca 0.49 -1.40 -0.22 0.00 0.00 0.00 0.00 60.65 59.52 1i4v s ILE 119 Cb -0.10 -3.01 0.07 0.00 0.01 0.00 0.00 42.46 39.43 1i4v s ILE 119 CO 0.46 -0.01 1.35 -0.44 0.00 0.00 0.00 174.94 176.30 1i4v s SER 120 N -4.09 6.53 -1.42 3.58 0.01 -1.26 -4.37 113.70 112.68 1i4v s SER 120 Ca 0.47 -1.61 -0.02 0.00 1.31 0.00 0.00 55.95 56.10 1i4v s SER 120 Cb -0.02 -2.52 0.01 0.00 0.21 0.00 0.00 66.02 63.70 1i4v s SER 120 CO 0.27 -1.38 0.49 -1.20 0.41 0.00 0.00 173.24 171.83 1i4v n SER 121 N 8.19 -0.74 -3.72 2.44 7.64 -1.26 -1.88 113.62 124.30 1i4v n SER 121 Ca 0.30 -0.98 -0.27 0.00 1.01 0.00 0.00 58.87 58.93 1i4v n SER 121 Cb 0.50 -3.18 0.03 0.00 -1.01 0.00 0.00 64.21 60.55 1i4v n SER 121 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 1i4v n GLU 122 N -4.39 -2.58 0.00 1.43 2.13 -1.26 -4.91 120.64 111.06 1i4v n GLU 122 Ca -0.27 0.51 0.00 0.00 0.66 0.00 0.00 57.16 58.05 1i4v n GLU 122 Cb 0.67 -4.55 0.00 0.00 0.27 0.00 0.00 31.44 27.82 1i4v n GLU 122 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 1i4v n ASP 123 N -2.86 0.00 -3.15 4.31 8.00 -0.78 -4.65 116.55 117.41 1i4v n ASP 123 Ca -0.19 0.79 -0.17 0.00 0.71 0.00 0.00 54.79 55.93 1i4v n ASP 123 Cb 0.63 -0.29 -0.06 0.00 -0.02 0.00 0.00 41.12 41.39 1i4v n ASP 123 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1i4v s THR 124 N -2.15 -0.23 -0.26 -3.53 2.01 -1.26 -5.09 115.64 105.12 1i4v s THR 124 Ca 0.00 -1.87 0.02 0.00 0.31 0.00 0.00 61.69 60.15 1i4v s THR 124 Cb 0.00 -0.72 0.07 0.00 0.01 0.00 0.00 72.50 71.85 1i4v s THR 124 CO 0.00 -0.71 -0.05 -0.76 -0.69 0.00 0.00 174.62 172.41 1i4v s LEU 125 N 0.50 3.10 0.06 4.42 2.01 -1.26 -3.98 118.68 123.53 1i4v s LEU 125 Ca 0.30 -1.40 -0.09 0.00 0.01 0.00 0.00 54.13 52.96 1i4v s LEU 125 Cb 0.01 -1.33 -0.00 0.00 0.01 0.00 0.00 46.19 44.88 1i4v s LEU 125 CO -0.13 -0.25 0.18 -0.62 1.01 0.00 0.00 176.35 176.54 1i4v s ASP 126 N 1.26 0.10 0.58 2.29 2.15 -1.12 -4.94 116.67 116.98 1i4v s ASP 126 Ca -0.03 -0.53 -0.17 0.00 0.43 0.00 0.00 52.55 52.25 1i4v s ASP 126 Cb -0.19 0.30 -0.04 0.00 -0.30 0.00 0.00 42.92 42.69 1i4v s ASP 126 CO -0.07 -0.63 1.08 -0.69 -0.17 0.00 0.00 175.17 174.69 1i4v s VAL 127 N -3.18 3.57 -0.25 1.11 1.01 -1.26 -0.46 120.40 120.94 1i4v s VAL 127 Ca -0.00 0.82 -0.03 0.00 0.00 0.00 0.00 61.98 62.77 1i4v s VAL 127 Cb 0.02 -3.32 -0.17 0.00 0.00 0.00 0.00 36.38 32.91 1i4v s VAL 127 CO -0.07 -0.36 -0.17 0.33 0.00 0.00 0.00 175.10 174.82 1i4v n PHE 128 N -1.78 0.18 -1.97 5.22 7.35 0.11 -4.78 117.46 121.79 1i4v n PHE 128 Ca 0.10 0.05 0.00 0.00 -0.76 0.00 0.00 57.45 56.83 1i4v n PHE 128 Cb 0.52 -1.02 0.00 0.00 0.35 0.00 0.00 39.48 39.33 1i4v n PHE 128 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1i4v n GLY 129 N 1.98 4.27 0.00 7.13 0.00 -1.25 -3.14 105.19 114.18 1i4v n GLY 129 Ca -0.46 -1.93 0.00 0.00 0.00 0.00 0.00 46.02 43.63 1i4v n GLY 129 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1i4v n VAL 130 N 0.00 0.00 -3.65 1.61 3.14 -0.43 -2.51 118.33 116.50 1i4v n VAL 130 Ca 0.00 0.00 -0.00 0.00 -2.96 0.00 0.00 64.34 61.38 1i4v n VAL 130 Cb 0.00 1.01 -0.01 0.00 -1.06 0.00 0.00 33.84 33.78 1i4v n VAL 130 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91 1i4v s VAL 131 N 0.00 0.00 -0.44 1.55 0.11 -1.26 -4.78 120.40 115.58 1i4v s VAL 131 Ca 0.00 -0.30 0.05 0.00 -2.93 0.00 0.00 61.98 58.80 1i4v s VAL 131 Cb 0.00 -1.92 0.17 0.00 -1.53 0.00 0.00 36.38 33.11 1i4v s VAL 131 CO 0.00 0.00 0.52 -0.63 -3.33 0.00 0.00 175.10 171.66 1i4v s ILE 132 N -2.63 -0.48 -0.22 7.04 1.09 -1.25 -2.58 121.20 122.18 1i4v s ILE 132 Ca 0.13 -1.32 -0.29 0.00 -1.10 0.00 0.00 60.65 58.08 1i4v s ILE 132 Cb 0.03 -0.50 -0.03 0.00 -1.06 0.00 0.00 42.46 40.90 1i4v s ILE 132 CO -0.03 -0.48 1.71 -1.00 -0.10 0.00 0.00 174.94 175.05 1i4v s HIS 133 N 0.91 1.93 -0.25 3.97 3.76 0.31 -4.68 115.29 121.24 1i4v s HIS 133 Ca 0.26 0.48 -0.25 0.00 -0.15 0.00 0.00 55.06 55.40 1i4v s HIS 133 Cb -0.04 -4.02 -0.00 0.00 1.11 0.00 0.00 32.58 29.63 1i4v s HIS 133 CO -0.08 -3.21 0.86 0.08 -0.85 0.00 0.00 174.74 171.54 1i4v s VAL 134 N 5.62 4.80 -0.60 -0.90 1.01 -1.26 -0.79 120.40 128.29 1i4v s VAL 134 Ca 0.76 1.62 -0.16 0.00 0.00 0.00 0.00 61.98 64.20 1i4v s VAL 134 Cb -0.26 -4.15 0.15 0.00 0.00 0.00 0.00 36.38 32.11 1i4v s VAL 134 CO 0.31 -0.11 0.56 -0.69 0.00 0.00 0.00 175.10 175.17 1i4v s VAL 135 N 2.92 5.27 -0.52 2.92 1.01 0.12 -4.96 120.40 127.15 1i4v s VAL 135 Ca 0.36 -1.66 -0.29 0.00 0.00 0.00 0.00 61.98 60.40 1i4v s VAL 135 Cb -0.15 -4.37 0.03 0.00 0.00 0.00 0.00 36.38 31.89 1i4v s VAL 135 CO 0.08 -0.91 1.19 -0.54 0.00 0.00 0.00 175.10 174.91 1i4v s LYS 136 N 1.39 3.61 -0.38 2.72 1.02 -1.26 -1.18 119.74 125.66 1i4v s LYS 136 Ca 0.06 0.45 -0.27 0.00 0.02 0.00 0.00 55.97 56.23 1i4v s LYS 136 Cb -0.26 -3.97 -0.06 0.00 -0.52 0.00 0.00 37.83 33.03 1i4v s LYS 136 CO 0.01 -1.54 2.27 0.00 -0.92 0.00 0.00 175.35 175.17 1i4v s ALA 137 N 4.79 2.16 -0.38 5.17 0.00 -1.26 -4.91 121.76 127.33 1i4v s ALA 137 Ca 0.47 0.30 -0.03 0.00 0.00 0.00 0.00 51.96 52.70 1i4v s ALA 137 Cb -0.08 -4.22 0.09 0.00 0.00 0.00 0.00 23.12 18.92 1i4v s ALA 137 CO 0.29 -3.67 0.15 -1.64 0.00 0.00 0.00 175.76 170.89 1i4v s MET 138 N 7.29 2.11 0.00 0.00 -1.94 -1.26 -5.02 119.30 120.48 1i4v s MET 138 Ca 0.96 -1.66 0.11 0.00 -1.71 0.00 0.00 55.69 53.39 1i4v s MET 138 Cb -0.23 -3.48 0.09 0.00 2.01 0.00 0.00 34.83 33.22 1i4v s MET 138 CO 0.30 -0.95 0.85 2.89 -0.01 0.00 0.00 175.02 178.10