#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i4v n PHE 26 N 0.00 1.01 -1.82 0.00 3.01 -1.26 -5.10 117.46 113.30 1i4v n PHE 26 Ca 0.00 -3.79 -0.42 0.00 1.01 0.00 0.00 57.45 54.25 1i4v n PHE 26 Cb 0.00 -0.42 -0.03 0.00 -0.01 0.00 0.00 39.48 39.02 1i4v n PHE 26 CO 0.00 0.00 0.00 -1.25 1.01 0.00 0.00 176.76 176.52 1i4v s PRO 27 N -2.05 4.16 0.02 -1.08 0.05 -1.26 -4.99 135.00 129.86 1i4v s PRO 27 Ca 0.39 2.50 -0.28 0.00 0.05 0.00 0.00 61.00 63.67 1i4v s PRO 27 Cb 0.23 -3.10 0.09 0.00 0.05 0.00 0.00 34.50 31.77 1i4v s PRO 27 CO -0.09 -0.67 0.75 -1.54 0.05 0.00 0.00 177.00 175.51 1i4v s SER 28 N 1.04 -0.51 0.52 6.66 1.04 -1.26 -5.02 113.70 116.17 1i4v s SER 28 Ca 0.71 0.23 0.23 0.00 0.48 0.00 0.00 55.95 57.60 1i4v s SER 28 Cb -0.47 0.49 1.41 0.00 0.10 0.00 0.00 66.02 67.54 1i4v s SER 28 CO 0.34 -0.70 2.11 -0.65 0.98 0.00 0.00 173.24 175.33 1i4v h PRO 29 N 2.32 0.00 -1.99 4.02 0.11 -1.99 -3.43 132.00 131.04 1i4v h PRO 29 Ca -0.27 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.83 1i4v h PRO 29 Cb 1.23 0.00 -0.21 0.00 0.11 0.00 0.00 31.00 32.13 1i4v h PRO 29 CO 0.35 0.09 0.09 0.00 -0.21 0.00 0.00 178.00 178.32 1i4v s ALA 30 N -4.56 -1.83 0.09 -0.75 0.00 -1.26 -5.02 121.76 108.43 1i4v s ALA 30 Ca -0.04 2.19 -0.17 0.00 0.00 0.00 0.00 51.96 53.94 1i4v s ALA 30 Cb 0.15 -1.29 -0.07 0.00 0.00 0.00 0.00 23.12 21.91 1i4v s ALA 30 CO 0.62 -0.35 1.49 0.00 0.00 0.00 0.00 175.76 177.51 1i4v h ALA 31 N 5.80 0.40 -4.69 0.00 0.00 -1.96 -3.45 119.26 115.36 1i4v h ALA 31 Ca -0.29 -0.28 -0.27 0.00 0.00 0.00 0.00 54.91 54.07 1i4v h ALA 31 Cb 1.19 -0.10 0.05 0.00 0.00 0.00 0.00 17.79 18.93 1i4v h ALA 31 CO 0.10 0.22 0.07 -0.25 0.00 0.00 0.00 179.25 179.39 1i4v n ASP 32 N -4.49 0.75 -0.83 0.00 8.00 -1.26 -5.05 116.55 113.67 1i4v n ASP 32 Ca -0.03 -1.64 -0.03 0.00 0.71 0.00 0.00 54.79 53.80 1i4v n ASP 32 Cb 0.32 -0.38 -0.03 0.00 -0.02 0.00 0.00 41.12 41.01 1i4v n ASP 32 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1i4v n TYR 33 N -2.27 0.00 -0.02 1.24 4.11 -1.26 -4.91 117.16 114.04 1i4v n TYR 33 Ca 0.10 -0.27 0.04 0.00 -0.00 0.00 0.00 57.90 57.76 1i4v n TYR 33 Cb 0.34 0.29 -0.12 0.00 -0.00 0.00 0.00 39.34 39.85 1i4v n TYR 33 CO 0.00 0.00 0.00 1.33 -0.00 0.00 0.00 176.86 178.19 1i4v n VAL 34 N 0.05 0.27 -1.83 -3.48 0.24 -1.26 -4.59 118.33 107.73 1i4v n VAL 34 Ca -0.12 -0.43 -0.36 0.00 -2.04 0.00 0.00 64.34 61.39 1i4v n VAL 34 Cb 0.67 -0.06 -0.02 0.00 -1.47 0.00 0.00 33.84 32.96 1i4v n VAL 34 CO 0.00 0.00 0.00 1.21 -2.14 0.00 0.00 176.83 175.90 1i4v n GLU 35 N -2.19 3.98 0.00 7.34 2.13 -1.26 -4.99 120.64 125.65 1i4v n GLU 35 Ca -0.09 -3.11 0.00 0.00 0.66 0.00 0.00 57.16 54.62 1i4v n GLU 35 Cb 0.57 -2.50 0.00 0.00 0.27 0.00 0.00 31.44 29.78 1i4v n GLU 35 CO 0.00 0.00 0.00 0.94 -0.41 0.00 0.00 177.13 177.66 1i4v n GLN 36 N 1.56 0.00 -3.40 5.31 -0.06 -1.26 -4.84 117.38 114.68 1i4v n GLN 36 Ca 0.59 0.00 -0.19 0.00 -2.00 0.00 0.00 57.00 55.40 1i4v n GLN 36 Cb 0.34 0.00 -0.02 0.00 -4.06 0.00 0.00 30.24 26.49 1i4v n GLN 36 CO 0.00 0.00 0.00 0.54 -0.20 0.00 0.00 177.06 177.40 1i4v n ARG 37 N 0.00 1.08 -2.69 3.69 1.74 -1.26 -4.87 116.66 114.35 1i4v n ARG 37 Ca 0.00 -2.34 -0.06 0.00 -0.77 0.00 0.00 57.85 54.69 1i4v n ARG 37 Cb 0.00 0.46 0.10 0.00 -1.02 0.00 0.00 32.46 31.99 1i4v n ARG 37 CO 0.00 0.00 0.00 1.51 -1.52 0.00 0.00 177.63 177.62 1i4v n ILE 38 N -1.07 0.00 -1.70 0.55 0.13 -1.26 -5.03 119.36 110.98 1i4v n ILE 38 Ca -0.08 -1.01 -0.32 0.00 -1.10 0.00 0.00 62.75 60.24 1i4v n ILE 38 Cb 0.41 1.25 -0.04 0.00 -0.84 0.00 0.00 39.64 40.43 1i4v n ILE 38 CO 0.00 0.00 0.00 -0.67 2.80 0.00 0.00 176.55 178.68 1i4v n ASP 39 N 0.69 7.16 -0.46 9.51 2.03 -1.26 -4.72 116.55 129.49 1i4v n ASP 39 Ca 0.00 -3.16 0.40 0.00 0.52 0.00 0.00 54.79 52.55 1i4v n ASP 39 Cb 0.72 -1.29 0.73 0.00 -0.72 0.00 0.00 41.12 40.55 1i4v n ASP 39 CO 0.00 0.00 0.00 0.17 -1.92 0.00 0.00 177.20 175.45 1i4v h LEU 40 N 4.69 0.10 -0.43 -2.67 8.10 -1.97 0.73 115.31 123.86 1i4v h LEU 40 Ca 0.53 0.04 -0.04 0.00 0.11 0.00 0.00 57.88 58.51 1i4v h LEU 40 Cb 0.55 0.03 -0.02 0.00 -0.44 0.00 0.00 40.66 40.78 1i4v h LEU 40 CO 1.13 -0.03 0.10 -0.55 -4.11 0.00 0.00 178.44 174.98 1i4v h ASN 41 N 0.06 0.66 0.65 0.17 -1.07 -1.93 -1.93 115.58 112.19 1i4v h ASN 41 Ca 0.73 -0.24 0.00 0.00 0.07 0.00 0.00 56.30 56.86 1i4v h ASN 41 Cb 2.70 -0.17 0.00 0.00 -2.07 0.00 0.00 38.32 38.78 1i4v h ASN 41 CO -0.12 0.73 -0.20 1.67 0.07 0.00 0.00 177.43 179.58 1i4v n GLN 42 N -4.52 0.19 0.01 4.14 7.27 0.21 -2.57 117.38 122.11 1i4v n GLN 42 Ca 0.00 -0.07 -0.01 0.00 0.07 0.00 0.00 57.00 57.00 1i4v n GLN 42 Cb 0.22 -1.50 -0.00 0.00 2.41 0.00 0.00 30.24 31.37 1i4v n GLN 42 CO 0.00 0.00 0.00 1.25 0.07 0.00 0.00 177.06 178.38 1i4v h LEU 43 N 0.16 -0.05 0.00 1.69 6.46 0.35 -3.40 115.31 120.52 1i4v h LEU 43 Ca 0.00 0.00 -0.18 0.00 -0.12 0.00 0.00 57.88 57.58 1i4v h LEU 43 Cb 0.46 0.01 -0.03 0.00 -0.73 0.00 0.00 40.66 40.37 1i4v h LEU 43 CO 0.00 0.09 -1.09 -0.07 -0.62 0.00 0.00 178.44 176.75 1i4v h LEU 44 N -0.31 0.00-10.36 2.25 -0.00 -1.63 -3.47 115.31 101.79 1i4v h LEU 44 Ca -0.01 0.00 -0.50 0.00 -0.00 0.00 0.00 57.88 57.37 1i4v h LEU 44 Cb 0.04 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 40.69 1i4v h LEU 44 CO 0.01 0.73 -0.28 -0.63 -0.00 0.00 0.00 178.44 178.27 1i4v s ILE 45 N -2.83 2.35 -0.01 1.22 -1.09 -1.06 -5.04 121.20 114.75 1i4v s ILE 45 Ca -0.00 -1.25 0.02 0.00 -2.23 0.00 0.00 60.65 57.19 1i4v s ILE 45 Cb 0.09 -2.60 0.03 0.00 -1.58 0.00 0.00 42.46 38.39 1i4v s ILE 45 CO 0.80 0.00 0.95 0.00 -1.23 0.00 0.00 174.94 175.45 1i4v n GLN 46 N -1.80 0.16 -3.76 2.79 6.02 -1.26 -4.35 117.38 115.17 1i4v n GLN 46 Ca 0.06 -1.08 -0.13 0.00 -0.01 0.00 0.00 57.00 55.84 1i4v n GLN 46 Cb 0.62 -0.59 -0.08 0.00 1.02 0.00 0.00 30.24 31.20 1i4v n GLN 46 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 177.06 175.04 1i4v s HIS 47 N -0.27 -0.14 0.04 1.08 3.76 -1.26 -5.06 115.29 113.44 1i4v s HIS 47 Ca 0.03 0.15 -0.29 0.00 -0.15 0.00 0.00 55.06 54.80 1i4v s HIS 47 Cb 0.02 0.09 -0.17 0.00 1.11 0.00 0.00 32.58 33.63 1i4v s HIS 47 CO 0.00 -0.42 1.42 -1.00 -0.85 0.00 0.00 174.74 173.89 1i4v h PRO 48 N 3.66 -0.71 -1.27 8.40 0.14 -1.98 -3.39 132.00 136.85 1i4v h PRO 48 Ca -0.30 0.05 -0.39 0.00 0.14 0.00 0.00 66.00 65.49 1i4v h PRO 48 Cb 1.18 0.16 -0.37 0.00 0.14 0.00 0.00 31.00 32.11 1i4v h PRO 48 CO 0.42 -0.41 -1.12 0.43 0.14 0.00 0.00 178.00 177.46 1i4v n SER 49 N -5.35 0.85 -2.74 1.44 7.64 -1.26 -4.90 113.62 109.30 1i4v n SER 49 Ca -0.12 -2.85 -0.00 0.00 1.01 0.00 0.00 58.87 56.91 1i4v n SER 49 Cb 0.33 -0.36 0.06 0.00 -1.01 0.00 0.00 64.21 63.22 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 0.05 2.61 -2.69 -0.43 0.00 -1.26 -5.09 120.51 113.71 1i4v n ALA 50 Ca 0.14 -2.52 -0.18 0.00 0.00 0.00 0.00 53.44 50.88 1i4v n ALA 50 Cb 0.76 -0.86 -0.14 0.00 0.00 0.00 0.00 19.45 19.21 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 -3.16 0.83 0.17 0.00 2.01 -1.26 -2.10 115.64 112.14 1i4v s THR 51 Ca 0.25 -0.66 0.11 0.00 0.31 0.00 0.00 61.69 61.70 1i4v s THR 51 Cb 0.34 -0.73 -0.04 0.00 0.01 0.00 0.00 72.50 72.07 1i4v s THR 51 CO -0.06 0.07 -0.24 -0.31 -0.69 0.00 0.00 174.62 173.40 1i4v s TYR 52 N -0.55 2.24 0.12 4.92 1.51 0.26 -4.66 117.35 121.19 1i4v s TYR 52 Ca 0.01 -0.38 -0.04 0.00 -1.01 0.00 0.00 57.07 55.66 1i4v s TYR 52 Cb -0.06 -1.14 -0.03 0.00 -0.11 0.00 0.00 41.96 40.63 1i4v s TYR 52 CO 0.00 0.44 0.12 -0.59 -1.11 0.00 0.00 175.55 174.42 1i4v s PHE 53 N -1.55 0.60 -0.21 2.71 -0.12 -1.26 0.90 117.98 119.05 1i4v s PHE 53 Ca 0.18 -1.00 -0.19 0.00 -0.05 0.00 0.00 56.93 55.87 1i4v s PHE 53 Cb -0.08 -0.30 0.05 0.00 -0.63 0.00 0.00 43.02 42.06 1i4v s PHE 53 CO 0.08 -0.56 0.55 0.54 -0.05 0.00 0.00 175.22 175.79 1i4v s VAL 54 N -3.99 -0.00 0.09 -2.49 0.11 -1.11 -4.95 120.40 108.06 1i4v s VAL 54 Ca 0.18 0.00 -0.31 0.00 -2.93 0.00 0.00 61.98 58.92 1i4v s VAL 54 Cb 0.06 -0.77 -0.06 0.00 -1.53 0.00 0.00 36.38 34.07 1i4v s VAL 54 CO -0.02 0.00 1.25 -0.75 -3.33 0.00 0.00 175.10 172.25 1i4v s LYS 55 N 0.33 4.41 -0.58 1.54 2.36 -1.26 -1.90 119.74 124.64 1i4v s LYS 55 Ca -0.00 1.86 -0.26 0.00 -2.55 0.00 0.00 55.97 55.01 1i4v s LYS 55 Cb -0.04 -3.31 0.04 0.00 -1.05 0.00 0.00 37.83 33.47 1i4v s LYS 55 CO 0.00 -0.29 1.09 0.00 1.55 0.00 0.00 175.35 177.70 1i4v s ALA 56 N 0.96 3.05 -0.47 3.13 0.00 -0.59 -4.90 121.76 122.95 1i4v s ALA 56 Ca 0.60 -1.05 0.09 0.00 0.00 0.00 0.00 51.96 51.59 1i4v s ALA 56 Cb -0.32 -3.92 0.34 0.00 0.00 0.00 0.00 23.12 19.22 1i4v s ALA 56 CO 0.30 -2.59 0.81 0.45 0.00 0.00 0.00 175.76 174.73 1i4v n SER 57 N 8.08 2.40 0.00 0.00 2.88 -1.26 -2.42 113.62 123.29 1i4v n SER 57 Ca 0.05 -3.28 0.00 0.00 -1.33 0.00 0.00 58.87 54.31 1i4v n SER 57 Cb 0.48 -0.60 0.00 0.00 -0.75 0.00 0.00 64.21 63.34 1i4v n SER 57 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1i4v n GLY 58 N 0.16 1.92 0.84 0.46 0.00 -1.26 -4.84 105.19 102.48 1i4v n GLY 58 Ca 0.27 -0.38 -0.03 0.00 0.00 0.00 0.00 46.02 45.88 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 -0.53 -0.09 1.61 5.75 -1.26 -1.06 116.55 120.97 1i4v n ASP 59 Ca 0.00 -1.06 -0.13 0.00 -0.01 0.00 0.00 54.79 53.59 1i4v n ASP 59 Cb 0.00 0.17 -0.08 0.00 -1.03 0.00 0.00 41.12 40.18 1i4v n ASP 59 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 1i4v n SER 60 N -0.05 2.45 -1.89 -1.12 3.41 -1.26 -4.56 113.62 110.60 1i4v n SER 60 Ca -0.14 -0.05 -0.20 0.00 -0.26 0.00 0.00 58.87 58.23 1i4v n SER 60 Cb 0.49 -0.32 0.16 0.00 -0.26 0.00 0.00 64.21 64.29 1i4v n SER 60 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 1i4v n MET 61 N -3.13 2.27 0.09 4.33 2.81 -1.26 0.16 117.12 122.39 1i4v n MET 61 Ca -0.32 -3.19 0.20 0.00 -1.81 0.00 0.00 57.70 52.58 1i4v n MET 61 Cb 0.82 -2.09 0.73 0.00 -0.71 0.00 0.00 33.22 31.97 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 1.08 0.33 -0.95 2.02 2.04 -1.79 0.27 117.51 120.51 1i4v h ILE 62 Ca 0.48 0.00 0.18 0.00 1.00 0.00 0.00 64.86 66.53 1i4v h ILE 62 Cb 2.05 0.61 -0.08 0.00 -0.74 0.00 0.00 36.82 38.66 1i4v h ILE 62 CO 0.94 0.00 0.61 -2.24 0.00 0.00 0.00 178.15 177.45 1i4v h ASP 63 N 0.00 0.62 0.12 1.72 2.03 -1.82 0.16 116.42 119.25 1i4v h ASP 63 Ca 0.20 0.06 -0.27 0.00 -0.73 0.00 0.00 57.03 56.29 1i4v h ASP 63 Cb 1.16 -0.05 0.02 0.00 -0.83 0.00 0.00 39.33 39.62 1i4v h ASP 63 CO -0.00 0.25 -1.07 1.23 -1.03 0.00 0.00 179.24 178.62 1i4v h GLY 64 N 0.62 0.69 0.00 7.15 0.00 -0.76 -3.44 103.07 107.33 1i4v h GLY 64 Ca 0.51 -1.27 0.00 0.00 0.00 0.00 0.00 47.33 46.58 1i4v h GLY 64 CO -0.26 1.12 0.00 0.61 0.00 0.00 0.00 176.54 178.00 1i4v n GLY 65 N 1.13 0.54 3.55 4.60 0.00 0.55 -4.81 105.19 110.75 1i4v n GLY 65 Ca -0.11 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.54 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 3.48 -0.47 -0.61 -5.25 -1.25 -4.83 121.20 112.26 1i4v s ILE 66 Ca 0.00 0.12 0.08 0.00 -0.99 0.00 0.00 60.65 59.87 1i4v s ILE 66 Cb 0.00 -4.23 0.29 0.00 2.95 0.00 0.00 42.46 41.47 1i4v s ILE 66 CO 0.00 -1.18 0.69 -0.24 -1.79 0.00 0.00 174.94 172.42 1i4v n SER 67 N 11.97 1.82 -1.39 4.36 2.88 -1.26 -3.15 113.62 128.84 1i4v n SER 67 Ca 0.20 -3.10 0.00 0.00 -1.33 0.00 0.00 58.87 54.64 1i4v n SER 67 Cb 0.51 -0.63 0.00 0.00 -0.75 0.00 0.00 64.21 63.34 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 0.74 -3.07 0.00 -3.46 -0.08 -0.22 -4.59 116.55 105.87 1i4v n ASP 68 Ca 0.26 0.33 0.00 0.00 -1.51 0.00 0.00 54.79 53.87 1i4v n ASP 68 Cb 0.51 -0.65 0.00 0.00 2.34 0.00 0.00 41.12 43.33 1i4v n ASP 68 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1i4v n GLY 69 N 1.40 0.77 3.61 0.27 0.00 -1.02 -4.94 105.19 105.29 1i4v n GLY 69 Ca 0.00 -0.08 -0.04 0.00 0.00 0.00 0.00 46.02 45.90 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 -0.47 -0.10 -0.26 1.61 -4.77 -1.26 -4.11 116.67 107.31 1i4v s ASP 70 Ca 0.00 0.00 -0.00 0.00 -3.30 0.00 0.00 52.55 49.25 1i4v s ASP 70 Cb 0.00 0.10 0.04 0.00 -1.09 0.00 0.00 42.92 41.97 1i4v s ASP 70 CO 0.00 -0.17 -0.07 -0.22 0.70 0.00 0.00 175.17 175.42 1i4v s LEU 71 N -2.10 3.36 0.46 2.11 1.98 0.71 -1.55 118.68 123.65 1i4v s LEU 71 Ca 0.10 -1.08 -0.22 0.00 -2.89 0.00 0.00 54.13 50.04 1i4v s LEU 71 Cb -0.01 -1.64 -0.08 0.00 0.66 0.00 0.00 46.19 45.12 1i4v s LEU 71 CO -0.04 -0.17 1.10 -0.22 -1.89 0.00 0.00 176.35 175.13 1i4v s LEU 72 N 1.25 3.99 -0.33 -0.68 0.20 -0.80 -0.32 118.68 121.99 1i4v s LEU 72 Ca -0.03 2.13 -0.01 0.00 0.69 0.00 0.00 54.13 56.91 1i4v s LEU 72 Cb -0.18 -4.33 0.11 0.00 -0.43 0.00 0.00 46.19 41.36 1i4v s LEU 72 CO -0.04 -0.79 0.12 -0.63 -0.29 0.00 0.00 176.35 174.71 1i4v s ILE 73 N -1.70 0.86 0.17 6.68 -1.09 0.17 -2.74 121.20 123.56 1i4v s ILE 73 Ca 0.64 -1.52 0.04 0.00 -2.23 0.00 0.00 60.65 57.58 1i4v s ILE 73 Cb -0.23 -1.65 -0.04 0.00 -1.58 0.00 0.00 42.46 38.96 1i4v s ILE 73 CO 0.28 -0.72 0.22 0.54 -1.23 0.00 0.00 174.94 174.04 1i4v s VAL 74 N 1.47 4.90 -0.47 2.92 0.11 0.26 0.50 120.40 130.09 1i4v s VAL 74 Ca 0.11 -0.94 -0.05 0.00 -2.93 0.00 0.00 61.98 58.17 1i4v s VAL 74 Cb -0.18 -3.54 0.12 0.00 -1.53 0.00 0.00 36.38 31.25 1i4v s VAL 74 CO -0.22 -0.15 0.29 -1.81 -3.33 0.00 0.00 175.10 169.89 1i4v s ASP 75 N -3.31 5.40 -0.68 3.54 1.01 -1.18 0.90 116.67 122.35 1i4v s ASP 75 Ca 0.33 -2.16 -0.27 0.00 0.71 0.00 0.00 52.55 51.16 1i4v s ASP 75 Cb -0.10 -1.89 0.02 0.00 1.01 0.00 0.00 42.92 41.96 1i4v s ASP 75 CO 0.26 -0.55 1.39 -0.94 0.21 0.00 0.00 175.17 175.54 1i4v s SER 76 N 1.85 6.03 0.08 0.27 1.04 -0.89 -1.30 113.70 120.78 1i4v s SER 76 Ca 0.09 -0.16 0.00 0.00 0.48 0.00 0.00 55.95 56.36 1i4v s SER 76 Cb -0.23 -2.55 0.00 0.00 0.10 0.00 0.00 66.02 63.34 1i4v s SER 76 CO -0.03 -1.88 0.00 0.00 0.98 0.00 0.00 173.24 172.31 1i4v n ALA 77 N 9.89 0.00 -2.73 5.32 0.00 -1.23 -4.06 120.51 127.69 1i4v n ALA 77 Ca 0.08 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.27 1i4v n ALA 77 Cb 0.50 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.93 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 -2.00 5.15 -0.23 0.00 1.01 -1.26 -4.99 121.20 118.87 1i4v s ILE 78 Ca 0.00 -0.50 -0.20 0.00 0.00 0.00 0.00 60.65 59.95 1i4v s ILE 78 Cb 0.00 -3.82 -0.02 0.00 0.01 0.00 0.00 42.46 38.62 1i4v s ILE 78 CO 0.00 -0.41 0.60 -0.89 0.00 0.00 0.00 174.94 174.24 1i4v s THR 79 N -2.14 5.02 0.00 2.92 2.01 -1.26 -3.01 115.64 119.19 1i4v s THR 79 Ca 0.39 1.09 0.00 0.00 0.31 0.00 0.00 61.69 63.48 1i4v s THR 79 Cb -0.10 -3.91 0.00 0.00 0.01 0.00 0.00 72.50 68.50 1i4v s THR 79 CO 0.33 0.08 0.00 0.00 -0.69 0.00 0.00 174.62 174.34 1i4v n ALA 80 N 5.37 0.00 -3.05 7.40 0.00 -1.04 -4.90 120.51 124.29 1i4v n ALA 80 Ca -0.02 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.32 1i4v n ALA 80 Cb 0.49 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.84 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 -1.98 0.10 0.44 0.00 0.01 -1.26 -5.05 113.70 105.97 1i4v s SER 81 Ca 0.00 -0.30 -0.26 0.00 1.31 0.00 0.00 55.95 56.70 1i4v s SER 81 Cb 0.00 0.16 -0.09 0.00 0.21 0.00 0.00 66.02 66.30 1i4v s SER 81 CO 0.00 -0.33 1.45 1.41 0.41 0.00 0.00 173.24 176.18 1i4v n HIS 82 N 1.58 2.77 -1.78 2.43 8.25 -1.26 -3.31 115.22 123.90 1i4v n HIS 82 Ca -0.23 0.44 0.00 0.00 -0.26 0.00 0.00 57.72 57.67 1i4v n HIS 82 Cb 0.55 -2.48 0.00 0.00 1.12 0.00 0.00 29.99 29.19 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 0.55 0.96 3.39 -1.41 0.00 -1.18 -4.98 105.19 102.54 1i4v n GLY 83 Ca 0.04 -0.50 -0.15 0.00 0.00 0.00 0.00 46.02 45.41 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 -2.72 -0.45 -0.77 1.61 1.01 -1.21 -5.00 116.67 109.14 1i4v s ASP 84 Ca 0.00 0.36 -0.25 0.00 0.71 0.00 0.00 52.55 53.36 1i4v s ASP 84 Cb 0.00 0.45 -0.06 0.00 1.01 0.00 0.00 42.92 44.32 1i4v s ASP 84 CO 0.00 -0.59 2.07 -0.51 0.21 0.00 0.00 175.17 176.35 1i4v s ILE 85 N -1.61 3.29 0.10 0.77 -1.16 -1.26 -3.60 121.20 117.72 1i4v s ILE 85 Ca -0.10 -0.13 0.06 0.00 -0.51 0.00 0.00 60.65 59.97 1i4v s ILE 85 Cb -0.02 -3.68 -0.03 0.00 0.61 0.00 0.00 42.46 39.34 1i4v s ILE 85 CO 0.05 -0.65 -0.16 0.68 -2.81 0.00 0.00 174.94 172.05 1i4v s VAL 86 N 11.10 1.39 -0.30 4.00 -7.23 -1.24 -4.47 120.40 123.64 1i4v s VAL 86 Ca 0.77 -1.51 -0.21 0.00 -1.81 0.00 0.00 61.98 59.21 1i4v s VAL 86 Cb -0.10 -1.37 -0.01 0.00 0.56 0.00 0.00 36.38 35.46 1i4v s VAL 86 CO 0.08 -0.23 0.69 -0.51 -0.31 0.00 0.00 175.10 174.83 1i4v s ILE 87 N -1.49 4.89 0.54 -0.62 1.10 -1.26 -3.60 121.20 120.75 1i4v s ILE 87 Ca 0.04 0.99 -0.03 0.00 -0.51 0.00 0.00 60.65 61.14 1i4v s ILE 87 Cb -0.09 -4.05 0.01 0.00 0.15 0.00 0.00 42.46 38.48 1i4v s ILE 87 CO 0.03 -0.17 0.81 0.00 -2.11 0.00 0.00 174.94 173.51 1i4v s ALA 88 N 2.73 3.50 -0.18 1.50 0.00 0.39 -2.61 121.76 127.08 1i4v s ALA 88 Ca 0.28 -0.87 -0.14 0.00 0.00 0.00 0.00 51.96 51.23 1i4v s ALA 88 Cb -0.15 -2.40 0.05 0.00 0.00 0.00 0.00 23.12 20.62 1i4v s ALA 88 CO 0.12 -0.66 0.47 0.00 0.00 0.00 0.00 175.76 175.68 1i4v s ALA 89 N -2.83 -1.18 -0.19 0.00 0.00 -0.14 -2.05 121.76 115.37 1i4v s ALA 89 Ca 0.52 1.50 -0.10 0.00 0.00 0.00 0.00 51.96 53.89 1i4v s ALA 89 Cb -0.10 -0.89 0.07 0.00 0.00 0.00 0.00 23.12 22.20 1i4v s ALA 89 CO 0.42 -0.25 0.45 0.54 0.00 0.00 0.00 175.76 176.92 1i4v s VAL 90 N 0.82 -0.18 -1.53 0.00 0.11 -1.23 -3.06 120.40 115.33 1i4v s VAL 90 Ca -0.05 0.09 0.00 0.00 -2.93 0.00 0.00 61.98 59.10 1i4v s VAL 90 Cb -0.05 -0.68 0.00 0.00 -1.53 0.00 0.00 36.38 34.11 1i4v s VAL 90 CO -0.06 0.04 0.00 0.47 -3.33 0.00 0.00 175.10 172.22 1i4v n ASP 91 N 4.54 -4.00 0.00 3.54 9.92 -1.26 -0.42 116.55 128.87 1i4v n ASP 91 Ca -0.19 0.33 0.00 0.00 -0.53 0.00 0.00 54.79 54.40 1i4v n ASP 91 Cb 0.54 -3.63 0.00 0.00 -0.64 0.00 0.00 41.12 37.39 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 -0.36 1.12 3.92 0.44 0.00 -1.26 -5.09 105.19 103.97 1i4v n GLY 92 Ca -0.15 -0.21 -0.26 0.00 0.00 0.00 0.00 46.02 45.39 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 -0.80 3.55 -0.36 1.61 2.02 0.44 -5.08 118.70 120.09 1i4v s GLU 93 Ca 0.00 -0.18 0.00 0.00 0.02 0.00 0.00 54.97 54.81 1i4v s GLU 93 Cb 0.00 -2.68 0.12 0.00 0.10 0.00 0.00 34.13 31.67 1i4v s GLU 93 CO 0.00 0.21 0.16 0.12 0.02 0.00 0.00 175.26 175.78 1i4v s PHE 94 N -2.15 1.55 0.34 1.61 5.36 -1.26 -3.53 117.98 119.90 1i4v s PHE 94 Ca 0.41 -1.89 0.09 0.00 -0.96 0.00 0.00 56.93 54.59 1i4v s PHE 94 Cb -0.10 -1.59 -0.06 0.00 -0.34 0.00 0.00 43.02 40.92 1i4v s PHE 94 CO 0.32 -0.84 -0.08 0.95 -1.46 0.00 0.00 175.22 174.12 1i4v s THR 95 N 1.15 2.11 0.00 0.12 -4.23 -0.87 -4.95 115.64 108.98 1i4v s THR 95 Ca 0.14 -2.18 0.00 0.00 -1.18 0.00 0.00 61.69 58.47 1i4v s THR 95 Cb -0.20 -2.64 0.00 0.00 1.34 0.00 0.00 72.50 71.00 1i4v s THR 95 CO -0.13 -0.20 0.00 0.52 -0.54 0.00 0.00 174.62 174.26 1i4v n VAL 96 N -0.77 0.00 -1.06 2.29 0.31 -1.26 0.15 118.33 117.99 1i4v n VAL 96 Ca -0.05 0.00 0.13 0.00 -0.01 0.00 0.00 64.34 64.41 1i4v n VAL 96 Cb 0.64 0.00 -0.07 0.00 -0.91 0.00 0.00 33.84 33.50 1i4v n VAL 96 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 1i4v n LYS 97 N 0.00 -2.42 -2.51 5.55 4.81 -1.24 -4.15 118.16 118.21 1i4v n LYS 97 Ca 0.00 1.94 -0.42 0.00 -0.87 0.00 0.00 58.31 58.95 1i4v n LYS 97 Cb 0.00 -2.84 -0.03 0.00 0.02 0.00 0.00 35.03 32.19 1i4v n LYS 97 CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 1i4v s LYS 98 N -3.68 4.37 0.16 1.64 1.02 -1.24 -3.63 119.74 118.38 1i4v s LYS 98 Ca 0.00 1.62 0.10 0.00 0.02 0.00 0.00 55.97 57.71 1i4v s LYS 98 Cb 0.00 -3.55 -0.04 0.00 -0.52 0.00 0.00 37.83 33.72 1i4v s LYS 98 CO 0.00 -0.41 -0.22 -0.48 -0.92 0.00 0.00 175.35 173.31 1i4v s LEU 99 N 2.13 2.39 -0.11 3.17 2.34 -1.26 -4.52 118.68 122.81 1i4v s LEU 99 Ca 0.54 -0.81 0.04 0.00 0.06 0.00 0.00 54.13 53.96 1i4v s LEU 99 Cb -0.23 -1.03 0.00 0.00 -0.56 0.00 0.00 46.19 44.36 1i4v s LEU 99 CO 0.21 0.08 -0.23 -1.10 -1.06 0.00 0.00 176.35 174.25 1i4v s GLN 100 N -2.44 3.05 0.00 1.48 -0.21 -1.09 -3.08 119.66 117.36 1i4v s GLN 100 Ca 0.15 -0.87 0.00 0.00 0.02 0.00 0.00 55.36 54.66 1i4v s GLN 100 Cb -0.08 -2.33 0.00 0.00 1.00 0.00 0.00 33.01 31.59 1i4v s GLN 100 CO 0.07 0.14 0.00 1.28 -2.12 0.00 0.00 175.29 174.66 1i4v n LEU 101 N 3.64 0.00 0.02 2.90 4.77 -1.22 -2.14 117.00 124.98 1i4v n LEU 101 Ca -0.19 -0.26 -0.05 0.00 -0.03 0.00 0.00 56.01 55.48 1i4v n LEU 101 Cb 0.53 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.58 1i4v n LEU 101 CO 0.28 0.00 0.15 0.03 -1.33 0.00 0.00 177.39 176.51 1i4v h ARG 102 N 0.00 -0.16 0.25 3.23 -0.00 -1.98 -3.37 114.38 112.35 1i4v h ARG 102 Ca 0.00 0.01 -0.01 0.00 -0.50 0.00 0.00 59.98 59.48 1i4v h ARG 102 Cb 0.00 0.04 0.00 0.00 0.00 0.00 0.00 29.97 30.01 1i4v h ARG 102 CO 0.00 0.04 -0.12 -1.00 0.00 0.00 0.00 179.97 178.89 1i4v h PRO 103 N -1.02 -0.32 -3.71 0.04 0.13 -2.02 -3.46 132.00 121.64 1i4v h PRO 103 Ca -0.02 0.02 -0.07 0.00 -0.87 0.00 0.00 66.00 65.06 1i4v h PRO 103 Cb 0.27 0.07 -0.10 0.00 0.13 0.00 0.00 31.00 31.38 1i4v h PRO 103 CO 0.03 -0.16 -0.16 0.99 -0.23 0.00 0.00 178.00 178.46 1i4v s THR 104 N -5.85 0.01 -0.65 1.56 2.01 -1.26 -5.10 115.64 106.37 1i4v s THR 104 Ca -0.15 -1.38 -0.22 0.00 0.31 0.00 0.00 61.69 60.26 1i4v s THR 104 Cb 0.04 -2.10 0.08 0.00 0.01 0.00 0.00 72.50 70.53 1i4v s THR 104 CO 0.63 -0.06 0.91 0.68 -0.69 0.00 0.00 174.62 176.10 1i4v s VAL 105 N -4.00 4.42 -0.07 3.82 -7.23 -1.26 -3.38 120.40 112.69 1i4v s VAL 105 Ca 0.21 -0.48 -0.07 0.00 -1.81 0.00 0.00 61.98 59.83 1i4v s VAL 105 Cb 0.00 -4.65 0.02 0.00 0.56 0.00 0.00 36.38 32.31 1i4v s VAL 105 CO 0.07 -1.40 0.20 -1.10 -0.31 0.00 0.00 175.10 172.56 1i4v s GLN 106 N 3.80 0.23 -0.01 4.82 -0.21 -0.91 -2.73 119.66 124.65 1i4v s GLN 106 Ca 0.20 0.28 -0.02 0.00 0.02 0.00 0.00 55.36 55.84 1i4v s GLN 106 Cb -0.18 0.11 0.00 0.00 1.00 0.00 0.00 33.01 33.94 1i4v s GLN 106 CO 0.09 -0.03 0.05 -1.17 -2.12 0.00 0.00 175.29 172.11 1i4v s LEU 107 N 0.13 1.83 -0.41 2.90 2.96 -0.75 -2.69 118.68 122.66 1i4v s LEU 107 Ca -0.00 0.00 0.06 0.00 -0.22 0.00 0.00 54.13 53.98 1i4v s LEU 107 Cb -0.02 0.21 0.22 0.00 0.50 0.00 0.00 46.19 47.11 1i4v s LEU 107 CO 0.00 -0.08 0.49 0.00 -1.32 0.00 0.00 176.35 175.44 1i4v n ILE 108 N 2.73 -0.82 0.00 6.68 0.13 -1.26 -2.77 119.36 124.05 1i4v n ILE 108 Ca -0.15 -3.56 0.00 0.00 -1.10 0.00 0.00 62.75 57.95 1i4v n ILE 108 Cb 0.59 -1.55 0.00 0.00 -0.84 0.00 0.00 39.64 37.84 1i4v n ILE 108 CO 0.00 0.00 0.00 -2.65 2.80 0.00 0.00 176.55 176.70 1i4v n PRO 109 N 1.97 2.68 -0.77 9.51 -0.02 -1.26 -4.74 135.00 142.37 1i4v n PRO 109 Ca 0.23 0.00 0.10 0.00 -2.02 0.00 0.00 63.50 61.81 1i4v n PRO 109 Cb 0.52 0.00 -0.03 0.00 -0.02 0.00 0.00 33.50 33.97 1i4v n PRO 109 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 1i4v n MET 110 N 0.00 -1.64 0.00 -0.52 2.81 -1.25 -4.52 117.12 111.99 1i4v n MET 110 Ca 0.00 1.20 0.00 0.00 -1.81 0.00 0.00 57.70 57.09 1i4v n MET 110 Cb 0.00 -1.97 0.00 0.00 -0.71 0.00 0.00 33.22 30.54 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 -3.32 0.00 0.05 7.83 2.85 0.42 -4.24 115.26 118.85 1i4v n ASN 111 Ca -0.02 0.00 -0.11 0.00 -0.11 0.00 0.00 54.58 54.35 1i4v n ASN 111 Cb 0.36 0.00 -0.13 0.00 1.24 0.00 0.00 39.78 41.25 1i4v n ASN 111 CO 0.00 0.00 0.00 0.77 -2.11 0.00 0.00 177.26 175.92 1i4v h SER 112 N 0.00 0.14 -1.13 1.20 4.64 -1.88 -3.35 113.55 113.16 1i4v h SER 112 Ca 0.00 -0.18 -0.69 0.00 -0.47 0.00 0.00 61.79 60.45 1i4v h SER 112 Cb 0.00 -0.04 -0.13 0.00 -0.31 0.00 0.00 62.40 61.91 1i4v h SER 112 CO 0.00 1.15 1.99 0.00 -0.87 0.00 0.00 176.83 179.09 1i4v n ALA 113 N -2.49 6.74 -1.82 5.18 0.00 -1.26 -4.97 120.51 121.88 1i4v n ALA 113 Ca -0.09 -3.86 -0.42 0.00 0.00 0.00 0.00 53.44 49.07 1i4v n ALA 113 Cb 1.00 -2.64 -0.03 0.00 0.00 0.00 0.00 19.45 17.78 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 -1.27 2.09 -0.41 0.00 1.13 -1.26 -4.84 117.35 112.80 1i4v s TYR 114 Ca 0.55 0.06 0.01 0.00 -1.41 0.00 0.00 57.07 56.29 1i4v s TYR 114 Cb 0.23 -4.08 0.11 0.00 -1.10 0.00 0.00 41.96 37.12 1i4v s TYR 114 CO -0.12 -4.48 0.16 -1.12 -2.51 0.00 0.00 175.55 167.48 1i4v s SER 115 N 2.95 4.90 -0.15 -0.18 0.01 -1.26 -5.06 113.70 114.91 1i4v s SER 115 Ca 0.79 -2.29 -0.33 0.00 1.31 0.00 0.00 55.95 55.43 1i4v s SER 115 Cb -0.42 -1.71 -0.10 0.00 0.21 0.00 0.00 66.02 64.00 1i4v s SER 115 CO 0.35 -0.41 2.02 -2.65 0.41 0.00 0.00 173.24 172.96 1i4v n PRO 116 N 4.14 2.03 -4.05 12.44 -0.01 -1.26 -4.75 135.00 143.55 1i4v n PRO 116 Ca 0.02 0.69 -0.17 0.00 -0.01 0.00 0.00 63.50 64.03 1i4v n PRO 116 Cb 0.40 -2.79 -0.16 0.00 -0.01 0.00 0.00 33.50 30.95 1i4v n PRO 116 CO 0.00 0.00 0.00 -1.50 -0.01 0.00 0.00 175.50 173.99 1i4v s ILE 117 N 5.62 0.31 0.37 4.25 2.07 -1.12 -5.05 121.20 127.65 1i4v s ILE 117 Ca 0.97 -0.06 -0.00 0.00 -1.41 0.00 0.00 60.65 60.15 1i4v s ILE 117 Cb -0.61 -0.34 -0.03 0.00 0.13 0.00 0.00 42.46 41.61 1i4v s ILE 117 CO 0.47 0.14 0.59 0.28 -1.91 0.00 0.00 174.94 174.51 1i4v s THR 118 N 0.59 5.06 0.57 4.00 -1.32 -1.26 -1.81 115.64 121.48 1i4v s THR 118 Ca -0.06 -0.36 -0.01 0.00 -1.21 0.00 0.00 61.69 60.04 1i4v s THR 118 Cb -0.10 -3.86 0.03 0.00 -1.51 0.00 0.00 72.50 67.07 1i4v s THR 118 CO -0.01 -0.60 0.81 -0.63 -2.21 0.00 0.00 174.62 171.99 1i4v s ILE 119 N -2.38 2.77 0.03 5.08 1.01 -1.10 -4.91 121.20 121.69 1i4v s ILE 119 Ca 0.41 -0.54 -0.09 0.00 0.00 0.00 0.00 60.65 60.43 1i4v s ILE 119 Cb -0.10 -3.07 -0.03 0.00 0.01 0.00 0.00 42.46 39.27 1i4v s ILE 119 CO 0.37 -0.05 1.14 0.28 0.00 0.00 0.00 174.94 176.68 1i4v h SER 120 N -0.03 -0.45 0.00 3.58 0.02 -1.99 -3.43 113.55 111.25 1i4v h SER 120 Ca -0.43 0.05 -0.09 0.00 -0.84 0.00 0.00 61.79 60.48 1i4v h SER 120 Cb 1.29 0.17 -0.13 0.00 0.14 0.00 0.00 62.40 63.87 1i4v h SER 120 CO 0.55 -0.13 -0.10 -0.24 -1.14 0.00 0.00 176.83 175.76 1i4v n SER 121 N -3.30 -1.51 -3.79 3.07 2.88 -1.26 -4.98 113.62 104.73 1i4v n SER 121 Ca -0.02 -1.99 -0.23 0.00 -1.33 0.00 0.00 58.87 55.30 1i4v n SER 121 Cb 0.10 0.86 0.02 0.00 -0.75 0.00 0.00 64.21 64.44 1i4v n SER 121 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 1i4v n GLU 122 N 1.54 -4.56 0.00 -1.46 4.07 -1.26 -4.93 120.64 114.03 1i4v n GLU 122 Ca 0.02 0.56 0.00 0.00 -0.06 0.00 0.00 57.16 57.69 1i4v n GLU 122 Cb 0.70 -5.05 0.00 0.00 -0.06 0.00 0.00 31.44 27.02 1i4v n GLU 122 CO 0.00 0.00 0.00 -3.47 -0.06 0.00 0.00 177.13 173.60 1i4v n ASP 123 N -3.02 0.00 -3.20 4.31 2.03 -1.26 -4.89 116.55 110.52 1i4v n ASP 123 Ca -0.27 0.29 -0.19 0.00 0.52 0.00 0.00 54.79 55.14 1i4v n ASP 123 Cb 0.66 -0.38 -0.06 0.00 -0.72 0.00 0.00 41.12 40.62 1i4v n ASP 123 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 1i4v s THR 124 N -0.76 -0.14 -0.33 5.18 2.01 -1.26 -5.08 115.64 115.26 1i4v s THR 124 Ca 0.00 -1.96 0.01 0.00 0.31 0.00 0.00 61.69 60.05 1i4v s THR 124 Cb 0.00 -0.81 0.10 0.00 0.01 0.00 0.00 72.50 71.80 1i4v s THR 124 CO 0.00 -0.79 0.08 -0.76 -0.69 0.00 0.00 174.62 172.46 1i4v s LEU 125 N 0.46 3.39 0.02 4.42 2.01 -1.26 -4.21 118.68 123.51 1i4v s LEU 125 Ca 0.30 -1.92 -0.09 0.00 0.01 0.00 0.00 54.13 52.43 1i4v s LEU 125 Cb 0.00 -1.21 0.00 0.00 0.01 0.00 0.00 46.19 44.99 1i4v s LEU 125 CO -0.13 -0.39 0.19 -0.62 1.01 0.00 0.00 176.35 176.40 1i4v s ASP 126 N 1.23 0.01 0.51 2.29 2.15 -1.17 -4.94 116.67 116.75 1i4v s ASP 126 Ca 0.11 -0.27 -0.17 0.00 0.43 0.00 0.00 52.55 52.64 1i4v s ASP 126 Cb -0.18 0.26 -0.08 0.00 -0.30 0.00 0.00 42.92 42.62 1i4v s ASP 126 CO -0.17 -0.48 0.99 -0.69 -0.17 0.00 0.00 175.17 174.65 1i4v s VAL 127 N -2.06 4.41 -0.15 1.11 1.01 -1.26 -0.97 120.40 122.49 1i4v s VAL 127 Ca -0.09 1.22 -0.12 0.00 0.00 0.00 0.00 61.98 62.99 1i4v s VAL 127 Cb -0.04 -3.66 -0.24 0.00 0.00 0.00 0.00 36.38 32.45 1i4v s VAL 127 CO -0.01 -0.59 0.32 0.33 0.00 0.00 0.00 175.10 175.14 1i4v n PHE 128 N -1.45 1.20 -1.54 5.22 -0.00 -1.07 -4.81 117.46 115.00 1i4v n PHE 128 Ca 0.07 0.33 0.00 0.00 -0.00 0.00 0.00 57.45 57.85 1i4v n PHE 128 Cb 0.54 -1.15 0.00 0.00 -0.00 0.00 0.00 39.48 38.87 1i4v n PHE 128 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1i4v n GLY 129 N 1.80 3.59 0.00 7.13 0.00 -1.26 -3.54 105.19 112.92 1i4v n GLY 129 Ca -0.32 -1.85 0.00 0.00 0.00 0.00 0.00 46.02 43.85 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 0.03 -3.81 1.61 3.14 -0.42 -2.49 118.33 116.39 1i4v n VAL 130 Ca 0.00 -0.04 -0.07 0.00 -2.96 0.00 0.00 64.34 61.27 1i4v n VAL 130 Cb 0.00 1.44 -0.02 0.00 -1.06 0.00 0.00 33.84 34.20 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 -0.03 0.00 -0.45 1.55 0.11 -1.26 -4.73 120.40 115.59 1i4v s VAL 131 Ca 0.00 -0.88 0.05 0.00 -2.93 0.00 0.00 61.98 58.22 1i4v s VAL 131 Cb 0.00 -1.90 0.18 0.00 -1.53 0.00 0.00 36.38 33.13 1i4v s VAL 131 CO 0.00 0.00 0.50 -0.63 -3.33 0.00 0.00 175.10 171.64 1i4v s ILE 132 N -3.85 -0.24 -0.31 7.04 1.09 -1.25 -3.10 121.20 120.57 1i4v s ILE 132 Ca 0.10 -1.91 -0.29 0.00 -1.10 0.00 0.00 60.65 57.45 1i4v s ILE 132 Cb -0.05 -0.72 0.00 0.00 -1.06 0.00 0.00 42.46 40.63 1i4v s ILE 132 CO 0.05 -0.71 1.31 -1.00 -0.10 0.00 0.00 174.94 174.49 1i4v s HIS 133 N 0.45 2.65 -0.22 3.97 3.76 0.18 -4.73 115.29 121.35 1i4v s HIS 133 Ca 0.31 0.84 -0.26 0.00 -0.15 0.00 0.00 55.06 55.81 1i4v s HIS 133 Cb 0.02 -3.96 -0.00 0.00 1.11 0.00 0.00 32.58 29.74 1i4v s HIS 133 CO -0.13 -1.74 0.89 0.08 -0.85 0.00 0.00 174.74 172.99 1i4v s VAL 134 N 4.49 4.81 -0.61 -0.90 1.01 -1.26 0.44 120.40 128.38 1i4v s VAL 134 Ca 0.57 1.71 -0.16 0.00 0.00 0.00 0.00 61.98 64.10 1i4v s VAL 134 Cb -0.16 -4.17 0.15 0.00 0.00 0.00 0.00 36.38 32.19 1i4v s VAL 134 CO 0.24 -0.08 0.57 -0.69 0.00 0.00 0.00 175.10 175.14 1i4v s VAL 135 N 2.77 5.29 -0.57 2.92 1.01 0.56 -4.93 120.40 127.46 1i4v s VAL 135 Ca 0.38 -1.71 -0.28 0.00 0.00 0.00 0.00 61.98 60.37 1i4v s VAL 135 Cb -0.16 -4.37 0.03 0.00 0.00 0.00 0.00 36.38 31.88 1i4v s VAL 135 CO 0.08 -0.91 1.20 -0.75 0.00 0.00 0.00 175.10 174.72 1i4v s LYS 136 N 1.30 3.53 -0.47 2.72 2.20 -1.26 -0.20 119.74 127.56 1i4v s LYS 136 Ca 0.07 0.30 -0.28 0.00 -0.36 0.00 0.00 55.97 55.70 1i4v s LYS 136 Cb -0.25 -4.01 -0.01 0.00 -1.51 0.00 0.00 37.83 32.04 1i4v s LYS 136 CO 0.00 -1.66 1.76 0.00 -0.36 0.00 0.00 175.35 175.09 1i4v s ALA 137 N 4.97 2.60 -0.31 3.13 0.00 -1.26 -4.95 121.76 125.94 1i4v s ALA 137 Ca 0.44 -0.21 0.01 0.00 0.00 0.00 0.00 51.96 52.21 1i4v s ALA 137 Cb -0.08 -4.13 0.07 0.00 0.00 0.00 0.00 23.12 18.99 1i4v s ALA 137 CO 0.26 -3.14 -0.00 -1.64 0.00 0.00 0.00 175.76 171.24 1i4v s MET 138 N 6.13 2.05 0.00 0.00 -1.94 -1.26 -4.95 119.30 119.33 1i4v s MET 138 Ca 0.71 -1.53 0.00 0.00 -1.71 0.00 0.00 55.69 53.16 1i4v s MET 138 Cb -0.17 -3.13 0.00 0.00 2.01 0.00 0.00 34.83 33.54 1i4v s MET 138 CO 0.28 -0.75 0.50 -2.13 -0.01 0.00 0.00 175.02 172.91