#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3iam n PRO 27 N 0.00 0.62 -0.05 2.98 -0.02 -1.26 -2.07 135.00 135.20 3iam n PRO 27 Ca 0.00 0.00 -0.05 0.00 -2.02 0.00 0.00 63.50 61.43 3iam n PRO 27 Cb 0.00 -1.26 -0.09 0.00 -0.02 0.00 0.00 33.50 32.14 3iam n PRO 27 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 3iam n ASP 28 N 0.07 2.25 -4.26 2.55 8.00 -1.26 -4.91 116.55 118.99 3iam n ASP 28 Ca 0.00 0.00 -0.37 0.00 0.71 0.00 0.00 54.79 55.13 3iam n ASP 28 Cb 0.13 0.82 -0.13 0.00 -0.02 0.00 0.00 41.12 41.92 3iam n ASP 28 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3iam s ALA 29 N -2.30 2.96 0.16 2.24 0.00 -0.88 -5.09 121.76 118.85 3iam s ALA 29 Ca -0.05 -1.64 -0.32 0.00 0.00 0.00 0.00 51.96 49.95 3iam s ALA 29 Cb 0.04 -2.10 -0.17 0.00 0.00 0.00 0.00 23.12 20.88 3iam s ALA 29 CO 0.46 -1.15 0.90 -0.35 0.00 0.00 0.00 175.76 175.62 3iam n PRO 30 N 4.77 0.54 -2.54 0.00 -0.04 -1.26 -4.90 135.00 131.58 3iam n PRO 30 Ca -0.14 0.19 -0.43 0.00 -0.04 0.00 0.00 63.50 63.09 3iam n PRO 30 Cb 0.46 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.39 3iam n PRO 30 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3iam s VAL 31 N -0.53 4.44 -0.48 0.52 1.01 -1.16 -4.78 120.40 119.42 3iam s VAL 31 Ca 0.72 1.75 -0.23 0.00 0.00 0.00 0.00 61.98 64.21 3iam s VAL 31 Cb -0.95 -4.12 0.03 0.00 0.00 0.00 0.00 36.38 31.34 3iam s VAL 31 CO 0.55 -0.04 0.83 0.00 0.00 0.00 0.00 175.10 176.44 3iam s ALA 32 N 2.47 3.26 0.19 5.51 0.00 -1.26 -1.81 121.76 130.12 3iam s ALA 32 Ca 0.52 -1.08 0.05 0.00 0.00 0.00 0.00 51.96 51.45 3iam s ALA 32 Cb -0.21 -3.55 -0.04 0.00 0.00 0.00 0.00 23.12 19.32 3iam s ALA 32 CO 0.18 -2.06 0.20 -0.51 0.00 0.00 0.00 175.76 173.57 3iam s LEU 33 N 3.46 3.94 0.55 0.00 1.02 -0.75 -4.99 118.68 121.90 3iam s LEU 33 Ca 0.30 -0.10 -0.14 0.00 0.02 0.00 0.00 54.13 54.21 3iam s LEU 33 Cb -0.12 -2.52 -0.06 0.00 0.02 0.00 0.00 46.19 43.51 3iam s LEU 33 CO 0.22 0.02 0.99 -0.54 0.02 0.00 0.00 176.35 177.06 3iam s LYS 34 N -3.41 3.81 0.53 1.70 -0.14 -1.26 -4.37 119.74 116.60 3iam s LYS 34 Ca 0.32 0.85 0.24 0.00 -1.36 0.00 0.00 55.97 56.02 3iam s LYS 34 Cb -0.09 -2.13 1.48 0.00 -1.68 0.00 0.00 37.83 35.41 3iam s LYS 34 CO 0.25 -0.36 2.14 -1.00 -0.76 0.00 0.00 175.35 175.62 3iam h PRO 35 N 0.49 0.00 -0.00 -1.68 0.13 -1.98 -1.57 132.00 127.39 3iam h PRO 35 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 3iam h PRO 35 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 3iam h PRO 35 CO 0.62 0.07 -0.12 -2.13 -0.23 0.00 0.00 178.00 176.21 3iam n ARG 36 N -3.99 0.18 -1.54 0.86 3.00 -1.26 -4.56 116.66 109.35 3iam n ARG 36 Ca -0.03 -0.04 -0.43 0.00 -0.00 0.00 0.00 57.85 57.36 3iam n ARG 36 Cb 0.16 -1.50 0.00 0.00 0.00 0.00 0.00 32.46 31.12 3iam n ARG 36 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97 3iam n PHE 37 N -1.37 0.49 -3.10 -0.14 7.35 -0.59 -4.92 117.46 115.18 3iam n PHE 37 Ca 0.09 0.63 -0.45 0.00 -0.76 0.00 0.00 57.45 56.96 3iam n PHE 37 Cb 0.31 -2.13 -0.03 0.00 0.35 0.00 0.00 39.48 37.99 3iam n PHE 37 CO 0.00 0.00 0.00 -1.01 -0.76 0.00 0.00 176.76 174.99 3iam s HIS 38 N -1.28 3.31 0.00 -5.13 3.76 -1.26 -4.60 115.29 110.09 3iam s HIS 38 Ca 0.62 -1.50 0.00 0.00 -0.15 0.00 0.00 55.06 54.04 3iam s HIS 38 Cb -0.63 -4.07 0.00 0.00 1.11 0.00 0.00 32.58 28.99 3iam s HIS 38 CO 0.58 -1.29 0.00 0.41 -0.85 0.00 0.00 174.74 173.59 3iam n GLY 39 N 4.93 5.28 3.69 -2.22 0.00 -0.45 -4.91 105.19 111.51 3iam n GLY 39 Ca 0.13 -2.04 -0.42 0.00 0.00 0.00 0.00 46.02 43.70 3iam n GLY 39 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3iam n ARG 40 N -0.01 2.83 -1.55 1.61 0.63 -0.53 -3.38 116.66 116.25 3iam n ARG 40 Ca 0.00 1.03 -0.47 0.00 -0.92 0.00 0.00 57.85 57.49 3iam n ARG 40 Cb 0.00 -2.94 -0.03 0.00 0.45 0.00 0.00 32.46 29.94 3iam n ARG 40 CO 0.00 0.00 0.00 0.72 -2.51 0.00 0.00 177.63 175.84 3iam n HIS 41 N 5.93 0.95 -4.87 -0.14 8.25 -1.26 -1.41 115.22 122.67 3iam n HIS 41 Ca 0.18 0.75 -0.31 0.00 -0.26 0.00 0.00 57.72 58.09 3iam n HIS 41 Cb 0.38 -2.21 -0.14 0.00 1.12 0.00 0.00 29.99 29.14 3iam n HIS 41 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 3iam s VAL 42 N -0.67 2.41 -0.32 1.59 0.11 0.42 -4.73 120.40 119.22 3iam s VAL 42 Ca 0.66 -1.24 -0.10 0.00 -2.93 0.00 0.00 61.98 58.37 3iam s VAL 42 Cb -0.82 -1.96 -0.00 0.00 -1.53 0.00 0.00 36.38 32.07 3iam s VAL 42 CO 0.56 0.40 0.17 -0.76 -3.33 0.00 0.00 175.10 172.13 3iam s LEU 43 N -1.20 4.21 0.51 2.54 1.43 0.47 -2.09 118.68 124.54 3iam s LEU 43 Ca 0.12 -0.56 -0.04 0.00 -1.03 0.00 0.00 54.13 52.62 3iam s LEU 43 Cb -0.10 -2.02 -0.01 0.00 0.03 0.00 0.00 46.19 44.09 3iam s LEU 43 CO 0.03 -0.22 0.79 0.42 0.23 0.00 0.00 176.35 177.60 3iam s THR 44 N 1.62 4.14 0.33 5.49 -4.23 -0.59 -2.00 115.64 120.40 3iam s THR 44 Ca 0.04 -0.10 0.09 0.00 -1.18 0.00 0.00 61.69 60.54 3iam s THR 44 Cb -0.17 -3.59 -0.05 0.00 1.34 0.00 0.00 72.50 70.03 3iam s THR 44 CO 0.07 -0.53 0.04 -0.13 -0.54 0.00 0.00 174.62 173.53 3iam s ARG 45 N -4.78 2.18 0.84 3.99 0.52 -1.26 -2.72 118.95 117.73 3iam s ARG 45 Ca 0.50 -1.65 -0.13 0.00 -0.52 0.00 0.00 55.73 53.94 3iam s ARG 45 Cb -0.10 -2.03 0.11 0.00 0.52 0.00 0.00 34.95 33.45 3iam s ARG 45 CO 0.43 0.16 1.20 -1.01 0.02 0.00 0.00 175.30 176.10 3iam s HIS 46 N -2.47 2.54 0.13 -0.53 3.76 -0.41 -4.84 115.29 113.47 3iam s HIS 46 Ca 0.35 0.58 -0.28 0.00 -0.15 0.00 0.00 55.06 55.56 3iam s HIS 46 Cb -0.02 -3.65 -0.06 0.00 1.11 0.00 0.00 32.58 29.97 3iam s HIS 46 CO 0.20 -2.00 1.60 -1.35 -0.85 0.00 0.00 174.74 172.34 3iam h PRO 47 N -1.18 -0.49 -1.80 8.40 0.11 -2.01 -2.51 132.00 132.52 3iam h PRO 47 Ca -0.45 0.03 0.54 0.00 0.11 0.00 0.00 66.00 66.23 3iam h PRO 47 Cb 1.30 0.11 -0.09 0.00 0.11 0.00 0.00 31.00 32.43 3iam h PRO 47 CO 0.57 -0.33 1.27 -0.91 -0.21 0.00 0.00 178.00 178.40 3iam h ASN 48 N -0.51 0.05 0.00 -2.05 4.21 -2.03 -3.44 115.58 111.81 3iam h ASN 48 Ca 0.06 0.03 0.00 0.00 1.21 0.00 0.00 56.30 57.61 3iam h ASN 48 Cb 0.61 0.03 0.00 0.00 -1.12 0.00 0.00 38.32 37.85 3iam h ASN 48 CO -0.33 -0.05 0.00 0.61 -1.29 0.00 0.00 177.43 176.37 3iam n GLY 49 N -1.83 0.64 3.78 2.83 0.00 -0.94 -5.08 105.19 104.59 3iam n GLY 49 Ca 0.42 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 46.11 3iam n GLY 49 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3iam s LEU 50 N 0.00 3.57 0.64 0.99 2.01 -1.26 -4.81 118.68 119.82 3iam s LEU 50 Ca 0.00 1.98 -0.14 0.00 0.01 0.00 0.00 54.13 55.98 3iam s LEU 50 Cb 0.00 -4.55 -0.01 0.00 0.01 0.00 0.00 46.19 41.63 3iam s LEU 50 CO 0.00 -1.27 1.06 -1.61 1.01 0.00 0.00 176.35 175.54 3iam s GLU 51 N -3.78 3.09 0.25 1.70 2.02 -0.76 -1.28 118.70 119.94 3iam s GLU 51 Ca 0.67 1.14 0.23 0.00 0.02 0.00 0.00 54.97 57.03 3iam s GLU 51 Cb -0.19 -2.00 0.23 0.00 0.10 0.00 0.00 34.13 32.27 3iam s GLU 51 CO 0.34 -0.99 1.32 0.87 0.02 0.00 0.00 175.26 176.82 3iam h LYS 52 N -0.06 0.00 -6.13 1.61 1.57 -1.84 -3.39 116.57 108.33 3iam h LYS 52 Ca -0.46 0.00 -0.57 0.00 -1.87 0.00 0.00 60.65 57.76 3iam h LYS 52 Cb 1.22 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 33.48 3iam h LYS 52 CO 0.56 0.00 0.47 0.00 -0.57 0.00 0.00 179.45 179.91 3iam n ILE 54 N 4.55 2.66 -3.34 0.00 -5.35 -1.26 -4.14 119.36 112.49 3iam n ILE 54 Ca 0.06 -3.00 -0.24 0.00 -0.27 0.00 0.00 62.75 59.30 3iam n ILE 54 Cb 0.49 -0.52 0.02 0.00 -1.74 0.00 0.00 39.64 37.88 3iam n ILE 54 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3iam n GLY 55 N -1.05 -0.50 0.02 3.28 0.00 -1.26 -4.37 105.19 101.31 3iam n GLY 55 Ca 0.38 0.13 0.13 0.00 0.00 0.00 0.00 46.02 46.66 3iam n GLY 55 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iam n SER 57 N -1.66 -5.42 0.01 0.00 2.88 -1.26 -4.85 113.62 103.33 3iam n SER 57 Ca 0.06 0.08 -0.12 0.00 -1.33 0.00 0.00 58.87 57.56 3iam n SER 57 Cb 0.36 -4.56 -0.14 0.00 -0.75 0.00 0.00 64.21 59.12 3iam n SER 57 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 3iam h LEU 58 N 0.00 0.15 0.61 2.46 5.85 -1.95 -2.92 115.31 119.50 3iam h LEU 58 Ca -0.44 -0.26 -0.03 0.00 0.84 0.00 0.00 57.88 57.98 3iam h LEU 58 Cb 1.32 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 42.31 3iam h LEU 58 CO 0.54 1.23 -0.32 0.00 -0.34 0.00 0.00 178.44 179.54 3iam n ALA 60 N -2.48 1.43 -0.10 0.00 0.00 -1.25 -1.13 120.51 116.98 3iam n ALA 60 Ca -0.11 0.79 -0.13 0.00 0.00 0.00 0.00 53.44 54.00 3iam n ALA 60 Cb 0.34 -1.04 -0.04 0.00 0.00 0.00 0.00 19.45 18.72 3iam n ALA 60 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3iam h ALA 61 N 1.41 0.43 0.00 0.00 0.00 -1.18 -3.18 119.26 116.74 3iam h ALA 61 Ca 0.86 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 55.41 3iam h ALA 61 Cb 2.93 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 20.62 3iam h ALA 61 CO -0.36 0.39 0.00 0.00 0.00 0.00 0.00 179.25 179.28 3iam h ALA 62 N 0.74 1.00 -2.22 0.00 0.00 -0.81 -3.46 119.26 114.51 3iam h ALA 62 Ca 0.06 0.00 -0.55 0.00 0.00 0.00 0.00 54.91 54.42 3iam h ALA 62 Cb 0.76 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 3iam h ALA 62 CO 0.06 0.00 1.07 0.00 0.00 0.00 0.00 179.25 180.38 3iam h PRO 64 N 9.58 0.00 -0.01 0.00 0.13 -1.90 -3.18 132.00 136.61 3iam h PRO 64 Ca -0.37 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 3iam h PRO 64 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 3iam h PRO 64 CO 0.96 0.05 -0.53 0.00 -0.23 0.00 0.00 178.00 178.25 3iam n ALA 65 N -2.16 3.66 -3.65 -0.56 0.00 -1.26 -4.98 120.51 111.56 3iam n ALA 65 Ca -0.02 -0.61 -0.27 0.00 0.00 0.00 0.00 53.44 52.54 3iam n ALA 65 Cb 0.20 -0.73 0.04 0.00 0.00 0.00 0.00 19.45 18.96 3iam n ALA 65 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3iam n TYR 66 N -0.28 -1.96 0.24 0.00 4.01 -1.20 -4.91 117.16 113.05 3iam n TYR 66 Ca 0.08 0.58 0.03 0.00 -0.16 0.00 0.00 57.90 58.43 3iam n TYR 66 Cb 0.42 -3.69 0.03 0.00 -0.31 0.00 0.00 39.34 35.79 3iam n TYR 66 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3iam n ALA 67 N -4.08 2.46 -3.02 -0.72 0.00 -1.26 -4.99 120.51 108.89 3iam n ALA 67 Ca -0.14 -0.59 -0.28 0.00 0.00 0.00 0.00 53.44 52.43 3iam n ALA 67 Cb 0.61 -0.22 -0.16 0.00 0.00 0.00 0.00 19.45 19.68 3iam n ALA 67 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3iam s ILE 68 N -0.58 1.58 -0.12 0.00 1.01 -1.26 -2.05 121.20 119.78 3iam s ILE 68 Ca 0.08 -0.78 0.02 0.00 0.00 0.00 0.00 60.65 59.97 3iam s ILE 68 Cb 0.06 -1.36 0.01 0.00 0.01 0.00 0.00 42.46 41.17 3iam s ILE 68 CO 0.08 0.45 -0.19 -0.47 0.00 0.00 0.00 174.94 174.81 3iam s TYR 69 N 0.16 2.35 -0.14 3.97 6.14 -0.54 -4.78 117.35 124.51 3iam s TYR 69 Ca -0.08 -1.15 -0.00 0.00 0.64 0.00 0.00 57.07 56.48 3iam s TYR 69 Cb -0.14 -1.63 0.03 0.00 0.42 0.00 0.00 41.96 40.64 3iam s TYR 69 CO 0.04 -0.54 -0.10 0.08 0.64 0.00 0.00 175.55 175.66 3iam s VAL 70 N 0.87 1.30 -0.19 3.14 1.01 -1.26 -2.07 120.40 123.21 3iam s VAL 70 Ca -0.07 -0.49 -0.08 0.00 0.00 0.00 0.00 61.98 61.34 3iam s VAL 70 Cb -0.15 -1.28 -0.04 0.00 0.00 0.00 0.00 36.38 34.90 3iam s VAL 70 CO -0.01 0.39 0.08 -1.61 0.00 0.00 0.00 175.10 173.94 3iam s GLU 71 N 1.59 4.01 0.33 2.72 2.02 -0.60 -4.92 118.70 123.86 3iam s GLU 71 Ca 0.04 -0.32 0.02 0.00 0.02 0.00 0.00 54.97 54.73 3iam s GLU 71 Cb -0.13 -3.26 -0.03 0.00 0.10 0.00 0.00 34.13 30.81 3iam s GLU 71 CO -0.09 0.27 0.51 -2.14 0.02 0.00 0.00 175.26 173.82 3iam s PRO 72 N 0.40 3.43 0.08 0.39 0.02 -1.26 -0.13 135.00 137.93 3iam s PRO 72 Ca 0.04 -0.47 -0.08 0.00 0.02 0.00 0.00 61.00 60.51 3iam s PRO 72 Cb -0.12 -2.72 -0.00 0.00 0.02 0.00 0.00 34.50 31.68 3iam s PRO 72 CO -0.00 0.18 0.18 0.00 -0.33 0.00 0.00 177.00 177.03 3iam s ALA 73 N -2.25 -0.19 -0.16 -1.55 0.00 -0.67 -4.49 121.76 112.46 3iam s ALA 73 Ca 0.39 -0.63 -0.23 0.00 0.00 0.00 0.00 51.96 51.49 3iam s ALA 73 Cb -0.09 0.46 -0.02 0.00 0.00 0.00 0.00 23.12 23.46 3iam s ALA 73 CO 0.34 -0.49 0.73 -2.00 0.00 0.00 0.00 175.76 174.35 3iam s GLU 74 N -3.78 4.30 0.49 0.00 2.12 -1.26 -1.68 118.70 118.89 3iam s GLU 74 Ca 0.04 0.85 -0.22 0.00 0.36 0.00 0.00 54.97 56.00 3iam s GLU 74 Cb 0.05 -3.55 -0.08 0.00 0.26 0.00 0.00 34.13 30.81 3iam s GLU 74 CO -0.10 -0.21 1.04 0.09 -0.54 0.00 0.00 175.26 175.53 3iam n ASN 75 N 4.85 1.31 -4.64 -1.70 3.02 -0.93 -4.92 115.26 112.25 3iam n ASN 75 Ca 0.01 0.96 -0.39 0.00 -0.03 0.00 0.00 54.58 55.13 3iam n ASN 75 Cb 0.50 -1.40 -0.08 0.00 -0.61 0.00 0.00 39.78 38.19 3iam n ASN 75 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3iam s ASP 76 N -0.90 6.41 0.34 6.41 -1.08 -1.26 -4.97 116.67 121.63 3iam s ASP 76 Ca 0.68 0.49 0.06 0.00 -0.52 0.00 0.00 52.55 53.25 3iam s ASP 76 Cb -0.49 -2.25 0.72 0.00 -1.46 0.00 0.00 42.92 39.44 3iam s ASP 76 CO 0.53 -0.18 1.89 -0.65 0.52 0.00 0.00 175.17 177.28 3iam h PRO 77 N 7.75 0.78 -0.31 4.34 0.11 -1.99 -2.01 132.00 140.67 3iam h PRO 77 Ca -0.33 -0.05 -0.14 0.00 0.11 0.00 0.00 66.00 65.60 3iam h PRO 77 Cb 1.15 -0.18 -0.00 0.00 0.11 0.00 0.00 31.00 32.08 3iam h PRO 77 CO 0.70 0.52 -0.34 1.49 -0.21 0.00 0.00 178.00 180.16 3iam h GLU 78 N 0.81 0.78 -2.74 1.05 4.57 -2.04 -3.39 114.58 113.63 3iam h GLU 78 Ca 0.42 -0.42 -0.61 0.00 -1.18 0.00 0.00 59.36 57.57 3iam h GLU 78 Cb 0.52 0.02 -0.40 0.00 -0.16 0.00 0.00 28.75 28.73 3iam h GLU 78 CO -0.19 1.05 -0.78 1.21 -1.18 0.00 0.00 179.01 179.13 3iam s ASN 79 N -6.66 3.14 0.23 1.04 2.47 -0.89 -5.13 114.94 109.14 3iam s ASN 79 Ca -0.12 -3.36 -0.24 0.00 0.42 0.00 0.00 52.86 49.55 3iam s ASN 79 Cb 0.09 -1.02 -0.09 0.00 -1.45 0.00 0.00 41.25 38.79 3iam s ASN 79 CO 0.85 -0.14 0.82 -2.16 -3.72 0.00 0.00 177.10 172.75 3iam s PRO 80 N -0.57 4.51 -0.13 0.43 0.04 -0.81 -4.15 135.00 134.33 3iam s PRO 80 Ca 0.28 1.15 -0.22 0.00 0.04 0.00 0.00 61.00 62.25 3iam s PRO 80 Cb -0.03 -3.04 -0.26 0.00 0.04 0.00 0.00 34.50 31.22 3iam s PRO 80 CO -0.16 0.44 0.60 0.28 0.04 0.00 0.00 177.00 178.20 3iam h VAL 81 N 2.96 1.33 -4.60 -0.36 2.07 -1.96 -3.49 116.25 112.20 3iam h VAL 81 Ca -0.47 -2.35 -0.29 0.00 0.82 0.00 0.00 66.70 64.40 3iam h VAL 81 Cb 1.20 2.90 -0.14 0.00 -1.52 0.00 0.00 31.29 33.73 3iam h VAL 81 CO 0.66 0.58 -0.54 -0.94 0.02 0.00 0.00 177.57 177.35 3iam s SER 82 N -6.72 0.57 0.48 0.57 1.04 -1.26 -1.83 113.70 106.55 3iam s SER 82 Ca -0.21 -1.47 0.27 0.00 0.48 0.00 0.00 55.95 55.03 3iam s SER 82 Cb 0.02 0.45 0.73 0.00 0.10 0.00 0.00 66.02 67.32 3iam s SER 82 CO 0.71 -0.93 1.75 0.00 0.98 0.00 0.00 173.24 175.75 3iam h ALA 83 N 2.45 1.00 -3.00 5.32 0.00 -1.88 -3.46 119.26 119.69 3iam h ALA 83 Ca -0.32 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.58 3iam h ALA 83 Cb 1.24 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.03 3iam h ALA 83 CO 0.47 0.01 0.00 0.41 0.00 0.00 0.00 179.25 180.14 3iam n GLY 84 N 0.69 -1.12 0.46 0.00 0.00 -1.26 -4.94 105.19 99.02 3iam n GLY 84 Ca 0.03 -1.46 0.12 0.00 0.00 0.00 0.00 46.02 44.70 3iam n GLY 84 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 3iam n GLU 85 N 0.00 1.20 -4.74 1.61 0.28 -1.26 -4.88 120.64 112.84 3iam n GLU 85 Ca 0.00 -0.92 -0.28 0.00 -0.16 0.00 0.00 57.16 55.80 3iam n GLU 85 Cb 0.00 -1.48 -0.17 0.00 1.43 0.00 0.00 31.44 31.22 3iam n GLU 85 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 177.13 177.47 3iam s ARG 86 N -2.44 2.30 0.48 3.44 3.52 -1.26 -2.19 118.95 122.79 3iam s ARG 86 Ca 0.21 -0.61 0.02 0.00 -0.13 0.00 0.00 55.73 55.22 3iam s ARG 86 Cb 0.19 -1.84 -0.01 0.00 -1.56 0.00 0.00 34.95 31.72 3iam s ARG 86 CO 0.53 0.05 0.07 1.52 -0.81 0.00 0.00 175.30 176.66 3iam s TYR 87 N 0.66 1.77 -0.44 5.12 -0.85 -0.68 -4.32 117.35 118.62 3iam s TYR 87 Ca -0.13 -1.16 -0.12 0.00 -0.52 0.00 0.00 57.07 55.14 3iam s TYR 87 Cb -0.16 -1.38 0.07 0.00 0.38 0.00 0.00 41.96 40.87 3iam s TYR 87 CO 0.04 -0.06 0.31 0.00 -1.52 0.00 0.00 175.55 174.32 3iam s ALA 88 N -3.02 3.40 0.04 9.51 0.00 -1.26 -1.67 121.76 128.77 3iam s ALA 88 Ca 0.11 -2.11 -0.27 0.00 0.00 0.00 0.00 51.96 49.68 3iam s ALA 88 Cb 0.01 -2.83 -0.17 0.00 0.00 0.00 0.00 23.12 20.13 3iam s ALA 88 CO 0.07 -1.67 1.45 -0.22 0.00 0.00 0.00 175.76 175.39 3iam h LYS 89 N 8.55 -0.49 -5.62 0.00 3.64 -0.76 -3.42 116.57 118.48 3iam h LYS 89 Ca -0.25 0.03 -0.68 0.00 -1.27 0.00 0.00 60.65 58.48 3iam h LYS 89 Cb 1.10 0.11 -0.29 0.00 -0.41 0.00 0.00 32.23 32.74 3iam h LYS 89 CO 0.80 -0.23 -0.82 0.08 -2.27 0.00 0.00 179.45 177.01 3iam s VAL 90 N -5.36 2.55 -0.08 2.00 1.01 -0.77 -4.98 120.40 114.77 3iam s VAL 90 Ca -0.15 -0.86 0.00 0.00 0.00 0.00 0.00 61.98 60.97 3iam s VAL 90 Cb 0.03 -2.01 0.02 0.00 0.00 0.00 0.00 36.38 34.43 3iam s VAL 90 CO 0.59 0.55 -0.06 -0.47 0.00 0.00 0.00 175.10 175.71 3iam s TYR 91 N 0.09 1.11 -0.07 5.22 5.04 -1.26 -1.55 117.35 125.92 3iam s TYR 91 Ca -0.09 -0.44 -0.03 0.00 -2.44 0.00 0.00 57.07 54.07 3iam s TYR 91 Cb -0.15 -0.96 0.04 0.00 0.35 0.00 0.00 41.96 41.24 3iam s TYR 91 CO 0.05 -0.34 0.16 -1.21 -1.34 0.00 0.00 175.55 172.87 3iam s GLU 92 N 1.36 0.10 -0.22 4.97 2.02 -0.88 -2.44 118.70 123.61 3iam s GLU 92 Ca -0.03 0.41 0.02 0.00 0.02 0.00 0.00 54.97 55.39 3iam s GLU 92 Cb -0.14 -0.18 0.04 0.00 0.10 0.00 0.00 34.13 33.96 3iam s GLU 92 CO -0.03 -0.18 -0.14 0.42 0.02 0.00 0.00 175.26 175.35 3iam s ILE 93 N 1.28 2.04 -0.97 -1.63 1.01 -1.16 -1.47 121.20 120.30 3iam s ILE 93 Ca -0.08 -1.28 -0.24 0.00 0.00 0.00 0.00 60.65 59.05 3iam s ILE 93 Cb -0.11 -2.03 0.02 0.00 0.01 0.00 0.00 42.46 40.35 3iam s ILE 93 CO -0.06 0.21 1.59 0.21 0.00 0.00 0.00 174.94 176.88 3iam s ASN 94 N 1.22 6.10 0.65 3.58 3.04 -0.87 -1.76 114.94 126.89 3iam s ASN 94 Ca -0.03 -1.17 0.38 0.00 0.04 0.00 0.00 52.86 52.08 3iam s ASN 94 Cb -0.17 -2.57 2.12 0.00 -1.54 0.00 0.00 41.25 39.09 3iam s ASN 94 CO -0.08 -1.87 2.24 0.24 -3.04 0.00 0.00 177.10 174.58 3iam h MET 95 N 10.29 0.00 0.00 0.43 2.86 -1.75 0.26 114.93 127.03 3iam h MET 95 Ca 0.15 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.79 3iam h MET 95 Cb 1.01 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.67 3iam h MET 95 CO 1.36 0.00 0.00 1.28 1.06 0.00 0.00 176.91 180.61 3iam n LEU 96 N -3.23 0.29 -0.12 1.22 4.77 -1.26 -3.17 117.00 115.49 3iam n LEU 96 Ca -0.02 0.54 -0.16 0.00 -0.03 0.00 0.00 56.01 56.34 3iam n LEU 96 Cb 0.16 -0.46 -0.13 0.00 -2.33 0.00 0.00 43.42 40.66 3iam n LEU 96 CO 0.21 -0.16 -1.29 -1.14 -1.33 0.00 0.00 177.39 173.68 3iam n ARG 97 N -1.78 0.66 -1.52 3.23 3.00 0.85 -5.01 116.66 116.10 3iam n ARG 97 Ca 0.05 0.11 -0.37 0.00 -0.00 0.00 0.00 57.85 57.64 3iam n ARG 97 Cb 0.32 -1.52 0.06 0.00 0.00 0.00 0.00 32.46 31.31 3iam n ARG 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 3iam n ILE 99 N -1.91 0.00 -2.80 0.00 0.13 -1.26 -4.98 119.36 108.55 3iam n ILE 99 Ca 0.13 -0.33 -0.10 0.00 -1.10 0.00 0.00 62.75 61.35 3iam n ILE 99 Cb 0.48 0.83 0.05 0.00 -0.84 0.00 0.00 39.64 40.16 3iam n ILE 99 CO 0.00 0.00 0.00 0.49 2.80 0.00 0.00 176.55 179.84 3iam n PHE 100 N -1.16 -1.31 0.49 9.51 3.01 -1.26 -4.98 117.46 121.77 3iam n PHE 100 Ca 0.00 0.55 0.11 0.00 1.01 0.00 0.00 57.45 59.11 3iam n PHE 100 Cb 0.00 -3.77 -0.08 0.00 -0.01 0.00 0.00 39.48 35.62 3iam n PHE 100 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3iam n GLY 102 N 1.37 0.31 0.37 0.00 0.00 -1.26 -4.81 105.19 101.16 3iam n GLY 102 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.12 3iam n GLY 102 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3iam h LEU 103 N 0.00 0.71 0.17 0.99 3.38 -1.95 -2.07 115.31 116.54 3iam h LEU 103 Ca 0.00 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 3iam h LEU 103 Cb 0.38 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.02 3iam h LEU 103 CO 0.00 0.39 -0.08 0.00 0.09 0.00 0.00 178.44 178.84 3iam h GLU 105 N -0.32 0.00 0.09 0.00 4.81 -1.59 -1.23 114.58 116.34 3iam h GLU 105 Ca -0.02 0.00 -0.29 0.00 -0.13 0.00 0.00 59.36 58.92 3iam h GLU 105 Cb 0.25 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.61 3iam h GLU 105 CO 0.04 0.00 -1.47 1.49 -0.73 0.00 0.00 179.01 178.34 3iam h GLU 106 N 0.00 0.18 0.01 1.92 4.81 -0.91 -3.33 114.58 117.27 3iam h GLU 106 Ca 0.04 -0.31 -0.20 0.00 -0.13 0.00 0.00 59.36 58.76 3iam h GLU 106 Cb 0.30 0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.77 3iam h GLU 106 CO -0.00 1.02 -0.91 0.00 -0.73 0.00 0.00 179.01 178.39 3iam h ALA 107 N 0.63 0.50 -2.48 2.92 0.00 -0.23 -3.45 119.26 117.14 3iam h ALA 107 Ca -0.21 -0.79 -0.53 0.00 0.00 0.00 0.00 54.91 53.38 3iam h ALA 107 Cb 1.98 -0.11 0.03 0.00 0.00 0.00 0.00 17.79 19.69 3iam h ALA 107 CO 0.15 1.05 1.08 0.00 0.00 0.00 0.00 179.25 181.52 3iam n PRO 109 N 5.74 0.31 -0.03 0.00 -0.04 -1.26 -4.05 135.00 135.67 3iam n PRO 109 Ca 0.17 0.02 -0.00 0.00 -0.04 0.00 0.00 63.50 63.65 3iam n PRO 109 Cb 0.39 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.27 3iam n PRO 109 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 3iam n THR 110 N -1.34 0.34 -1.63 0.52 -2.24 -1.26 -5.01 114.28 103.67 3iam n THR 110 Ca 0.12 -0.32 0.00 0.00 -2.27 0.00 0.00 64.05 61.58 3iam n THR 110 Cb 0.25 -0.27 0.00 0.00 -2.10 0.00 0.00 70.33 68.21 3iam n THR 110 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3iam n GLY 111 N 2.18 0.83 0.00 3.38 0.00 -1.26 -5.02 105.19 105.31 3iam n GLY 111 Ca -0.09 -0.62 -0.00 0.00 0.00 0.00 0.00 46.02 45.31 3iam n GLY 111 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iam h ALA 112 N 0.00 0.00 -2.40 4.61 0.00 -1.89 -3.43 119.26 116.15 3iam h ALA 112 Ca 0.00 -0.08 -0.54 0.00 0.00 0.00 0.00 54.91 54.29 3iam h ALA 112 Cb 0.76 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 3iam h ALA 112 CO 0.00 0.00 0.48 -1.50 0.00 0.00 0.00 179.25 178.23 3iam s ILE 113 N -1.02 4.60 -0.19 0.00 1.10 -1.26 -1.55 121.20 122.88 3iam s ILE 113 Ca -0.00 1.87 -0.10 0.00 -0.51 0.00 0.00 60.65 61.91 3iam s ILE 113 Cb 0.00 -4.20 0.07 0.00 0.15 0.00 0.00 42.46 38.48 3iam s ILE 113 CO 0.00 0.11 0.45 -0.69 -2.11 0.00 0.00 174.94 172.70 3iam s VAL 114 N 1.28 -0.18 0.45 4.00 1.01 -0.89 -4.24 120.40 121.84 3iam s VAL 114 Ca 0.53 0.10 -0.25 0.00 0.00 0.00 0.00 61.98 62.37 3iam s VAL 114 Cb -0.23 -0.68 -0.08 0.00 0.00 0.00 0.00 36.38 35.40 3iam s VAL 114 CO 0.26 0.04 1.34 -0.76 0.00 0.00 0.00 175.10 175.98 3iam s LEU 115 N 1.73 4.08 0.00 3.92 1.43 -1.26 -0.44 118.68 128.15 3iam s LEU 115 Ca -0.08 2.72 0.00 0.00 -1.03 0.00 0.00 54.13 55.74 3iam s LEU 115 Cb -0.09 -4.03 0.00 0.00 0.03 0.00 0.00 46.19 42.10 3iam s LEU 115 CO -0.14 -1.11 0.00 0.61 0.23 0.00 0.00 176.35 175.95 3iam n GLY 116 N 0.63 3.89 0.00 -3.19 0.00 -0.50 -4.65 105.19 101.37 3iam n GLY 116 Ca 0.06 -1.67 0.00 0.00 0.00 0.00 0.00 46.02 44.41 3iam n GLY 116 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3iam n TYR 117 N 0.00 0.00 -1.61 1.61 4.01 -1.26 -1.34 117.16 118.57 3iam n TYR 117 Ca 0.00 0.00 -0.50 0.00 -0.16 0.00 0.00 57.90 57.24 3iam n TYR 117 Cb 0.00 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 38.98 3iam n TYR 117 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 3iam n ASP 118 N -2.15 2.02 0.00 7.72 9.92 -1.26 -4.65 116.55 128.15 3iam n ASP 118 Ca 0.00 1.11 0.00 0.00 -0.53 0.00 0.00 54.79 55.37 3iam n ASP 118 Cb 0.50 -1.25 0.00 0.00 -0.64 0.00 0.00 41.12 39.72 3iam n ASP 118 CO 0.00 0.00 0.00 2.22 0.13 0.00 0.00 177.20 179.55 3iam n PHE 119 N 2.73 0.00 -2.03 1.24 1.16 -1.26 -1.46 117.46 117.84 3iam n PHE 119 Ca 0.18 0.00 -0.26 0.00 -1.87 0.00 0.00 57.45 55.49 3iam n PHE 119 Cb 0.22 0.00 -0.05 0.00 -1.61 0.00 0.00 39.48 38.03 3iam n PHE 119 CO 0.00 0.00 0.00 -1.21 -1.87 0.00 0.00 176.76 173.68 3iam s GLU 120 N -1.10 2.50 -0.13 3.97 2.02 -1.26 -4.64 118.70 120.05 3iam s GLU 120 Ca 0.00 -0.48 0.11 0.00 0.02 0.00 0.00 54.97 54.62 3iam s GLU 120 Cb 0.00 -5.10 0.26 0.00 0.10 0.00 0.00 34.13 29.39 3iam s GLU 120 CO 0.00 -3.58 1.20 0.00 0.02 0.00 0.00 175.26 172.90 3iam n MET 121 N 8.71 0.60 -2.06 1.61 0.00 -1.26 -4.71 117.12 120.00 3iam n MET 121 Ca 0.42 -1.55 -0.32 0.00 0.00 0.00 0.00 57.70 56.24 3iam n MET 121 Cb 0.47 0.13 0.01 0.00 0.00 0.00 0.00 33.22 33.82 3iam n MET 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 3iam s ALA 122 N -0.44 2.81 0.26 3.17 0.00 -1.26 -4.93 121.76 121.37 3iam s ALA 122 Ca 0.12 0.30 -0.07 0.00 0.00 0.00 0.00 51.96 52.31 3iam s ALA 122 Cb 0.24 -3.20 0.03 0.00 0.00 0.00 0.00 23.12 20.19 3iam s ALA 122 CO -0.07 -0.73 0.47 -3.47 0.00 0.00 0.00 175.76 171.95 3iam n ASP 123 N -2.09 -1.36 -0.12 0.00 -0.08 -1.26 -4.79 116.55 106.85 3iam n ASP 123 Ca 0.08 -2.15 -0.24 0.00 -1.51 0.00 0.00 54.79 50.97 3iam n ASP 123 Cb 0.53 2.32 -0.08 0.00 2.34 0.00 0.00 41.12 46.23 3iam n ASP 123 CO 0.00 0.00 0.00 -1.22 0.12 0.00 0.00 177.20 176.10 3iam n TYR 124 N -0.37 0.00 -3.57 -0.67 4.01 -1.26 -4.92 117.16 110.38 3iam n TYR 124 Ca -0.04 0.00 -0.36 0.00 -0.16 0.00 0.00 57.90 57.34 3iam n TYR 124 Cb 0.40 -0.86 -0.07 0.00 -0.31 0.00 0.00 39.34 38.50 3iam n TYR 124 CO 0.00 0.00 0.00 -1.21 -0.46 0.00 0.00 176.86 175.19 3iam s GLU 125 N -2.59 4.25 0.18 -0.72 2.02 -1.26 -5.00 118.70 115.58 3iam s GLU 125 Ca -0.36 0.04 -0.24 0.00 0.02 0.00 0.00 54.97 54.44 3iam s GLU 125 Cb 0.12 -3.43 0.07 0.00 0.10 0.00 0.00 34.13 31.00 3iam s GLU 125 CO 0.46 0.25 1.57 -0.92 0.02 0.00 0.00 175.26 176.64 3iam h TYR 126 N 6.69 -1.19 0.00 1.61 5.03 -2.02 0.13 116.97 127.21 3iam h TYR 126 Ca -0.41 0.08 0.00 0.00 2.58 0.00 0.00 58.73 60.98 3iam h TYR 126 Cb 1.16 0.61 0.00 0.00 1.55 0.00 0.00 36.73 40.05 3iam h TYR 126 CO 0.60 -0.41 0.00 -1.13 -1.32 0.00 0.00 178.16 175.90 3iam n SER 127 N -5.41 0.00 -0.61 -2.11 3.41 -1.26 -1.14 113.62 106.50 3iam n SER 127 Ca 0.03 -0.66 0.13 0.00 -0.26 0.00 0.00 58.87 58.11 3iam n SER 127 Cb 0.35 0.00 0.37 0.00 -0.26 0.00 0.00 64.21 64.68 3iam n SER 127 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3iam n ASP 128 N -0.78 1.94 -0.82 4.04 9.92 0.45 -4.08 116.55 127.23 3iam n ASP 128 Ca 0.06 -1.61 0.09 0.00 -0.53 0.00 0.00 54.79 52.80 3iam n ASP 128 Cb 0.03 0.02 0.12 0.00 -0.64 0.00 0.00 41.12 40.65 3iam n ASP 128 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 3iam n LEU 129 N 0.47 2.79 -4.55 0.64 4.77 -0.29 -4.76 117.00 116.07 3iam n LEU 129 Ca 0.17 -1.26 -0.43 0.00 -0.03 0.00 0.00 56.01 54.46 3iam n LEU 129 Cb 0.43 -0.10 -0.05 0.00 -2.33 0.00 0.00 43.42 41.37 3iam n LEU 129 CO 0.17 0.56 0.59 0.54 -1.33 0.00 0.00 177.39 177.91 3iam s VAL 130 N -1.38 4.64 0.77 4.08 0.11 -1.26 -2.09 120.40 125.26 3iam s VAL 130 Ca 0.26 0.51 -0.11 0.00 -2.93 0.00 0.00 61.98 59.70 3iam s VAL 130 Cb 0.16 -4.32 0.05 0.00 -1.53 0.00 0.00 36.38 30.74 3iam s VAL 130 CO 0.24 -0.70 1.10 -0.31 -3.33 0.00 0.00 175.10 172.09 3iam s TYR 131 N 3.32 2.99 0.39 1.54 1.51 -0.72 -4.89 117.35 121.49 3iam s TYR 131 Ca 0.31 1.12 0.04 0.00 -1.01 0.00 0.00 57.07 57.52 3iam s TYR 131 Cb -0.12 -3.11 -0.03 0.00 -0.11 0.00 0.00 41.96 38.59 3iam s TYR 131 CO 0.23 -1.58 0.12 0.20 -1.11 0.00 0.00 175.55 173.40 3iam s GLY 132 N -4.05 2.50 0.21 0.71 0.00 -1.26 -2.99 107.32 102.43 3iam s GLY 132 Ca 0.60 -1.38 -0.16 0.00 0.00 0.00 0.00 44.72 43.77 3iam s GLY 132 CO 0.53 -1.82 1.59 1.70 0.00 0.00 0.00 173.10 175.10 3iam h LYS 133 N 1.86 -0.07 0.00 2.90 3.64 -1.90 0.71 116.57 123.71 3iam h LYS 133 Ca -0.36 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.02 3iam h LYS 133 Cb 1.27 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 33.10 3iam h LYS 133 CO 0.59 -0.05 0.00 -0.85 -2.27 0.00 0.00 179.45 176.87 3iam n GLU 134 N -5.47 0.07 0.07 1.90 0.00 -1.26 -1.76 120.64 114.19 3iam n GLU 134 Ca 0.07 0.40 0.11 0.00 0.00 0.00 0.00 57.16 57.75 3iam n GLU 134 Cb 0.37 -1.67 0.01 0.00 0.00 0.00 0.00 31.44 30.15 3iam n GLU 134 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 3iam n ASP 135 N -1.81 0.67 0.00 -1.84 8.00 0.24 -4.44 116.55 117.37 3iam n ASP 135 Ca 0.02 0.14 0.00 0.00 0.71 0.00 0.00 54.79 55.66 3iam n ASP 135 Cb 0.14 0.69 0.00 0.00 -0.02 0.00 0.00 41.12 41.93 3iam n ASP 135 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 3iam n MET 136 N -2.39 1.53 -0.67 -1.24 2.81 -0.72 -4.88 117.12 111.56 3iam n MET 136 Ca 0.00 -1.01 -0.29 0.00 -1.81 0.00 0.00 57.70 54.59 3iam n MET 136 Cb 0.51 -0.79 0.21 0.00 -0.71 0.00 0.00 33.22 32.44 3iam n MET 136 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 3iam s LEU 137 N -0.53 1.74 0.26 4.03 1.02 -0.79 0.18 118.68 124.59 3iam s LEU 137 Ca 0.00 1.78 0.08 0.00 0.02 0.00 0.00 54.13 56.01 3iam s LEU 137 Cb 0.00 -3.92 0.31 0.00 0.02 0.00 0.00 46.19 42.60 3iam s LEU 137 CO 0.00 -3.64 1.59 -0.37 0.02 0.00 0.00 176.35 173.95 3iam h VAL 138 N -2.24 1.42 0.00 -1.59 -1.51 -1.76 -3.07 116.25 107.50 3iam h VAL 138 Ca -0.53 -2.07 -0.00 0.00 -1.23 0.00 0.00 66.70 62.86 3iam h VAL 138 Cb 1.30 2.09 -0.00 0.00 -2.13 0.00 0.00 31.29 32.56 3iam h VAL 138 CO 0.47 0.60 -0.01 -2.24 -1.23 0.00 0.00 177.57 175.17 3iam h ASP 139 N 0.07 0.00 -3.32 4.19 2.03 -1.91 -3.42 116.42 114.07 3iam h ASP 139 Ca -0.01 0.00 -0.57 0.00 -0.73 0.00 0.00 57.03 55.72 3iam h ASP 139 Cb 1.11 0.00 -0.06 0.00 -0.83 0.00 0.00 39.33 39.55 3iam h ASP 139 CO 0.09 0.01 0.35 0.54 -1.03 0.00 0.00 179.24 179.19 3iam s VAL 140 N -3.74 4.90 -0.33 4.15 0.11 -1.16 -5.02 120.40 119.30 3iam s VAL 140 Ca 0.00 1.65 -0.12 0.00 -2.93 0.00 0.00 61.98 60.58 3iam s VAL 140 Cb 0.10 -4.14 -0.01 0.00 -1.53 0.00 0.00 36.38 30.79 3iam s VAL 140 CO 0.53 0.07 0.22 -0.69 -3.33 0.00 0.00 175.10 171.89 3iam s VAL 141 N 1.86 5.09 0.00 2.04 1.01 -1.26 -4.92 120.40 124.22 3iam s VAL 141 Ca 0.39 -0.28 0.00 0.00 0.00 0.00 0.00 61.98 62.09 3iam s VAL 141 Cb -0.17 -3.61 0.00 0.00 0.00 0.00 0.00 36.38 32.60 3iam s VAL 141 CO 0.14 0.01 0.00 0.61 0.00 0.00 0.00 175.10 175.86 3iam n GLY 142 N 5.07 1.75 3.98 4.51 0.00 -1.26 -4.84 105.19 114.40 3iam n GLY 142 Ca -0.13 -1.98 -0.18 0.00 0.00 0.00 0.00 46.02 43.73 3iam n GLY 142 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3iam s THR 143 N -2.33 3.12 0.03 2.61 -4.23 -1.26 -4.87 115.64 108.71 3iam s THR 143 Ca 0.00 -1.07 -0.08 0.00 -1.18 0.00 0.00 61.69 59.36 3iam s THR 143 Cb 0.00 -3.07 -0.03 0.00 1.34 0.00 0.00 72.50 70.74 3iam s THR 143 CO 0.00 -0.03 1.14 0.11 -0.54 0.00 0.00 174.62 175.30 3iam h LYS 144 N 0.76 -0.12 -0.90 3.99 1.57 -1.91 -0.55 116.57 119.41 3iam h LYS 144 Ca -0.41 0.01 0.13 0.00 -1.87 0.00 0.00 60.65 58.50 3iam h LYS 144 Cb 1.27 0.03 -0.14 0.00 0.08 0.00 0.00 32.23 33.47 3iam h LYS 144 CO 0.49 -0.08 -0.44 -1.00 -0.57 0.00 0.00 179.45 177.85 3iam h PRO 145 N -0.12 -0.05 -0.91 3.15 0.13 -1.90 0.16 132.00 132.45 3iam h PRO 145 Ca 0.01 0.00 0.14 0.00 -0.87 0.00 0.00 66.00 65.28 3iam h PRO 145 Cb 0.16 0.01 -0.07 0.00 0.13 0.00 0.00 31.00 31.23 3iam h PRO 145 CO -0.13 -0.03 0.59 1.96 -0.23 0.00 0.00 178.00 180.15 3iam h GLN 146 N -0.05 0.74 0.01 0.86 4.20 -1.68 -0.39 115.11 118.81 3iam h GLN 146 Ca 0.27 -0.04 -0.27 0.00 0.06 0.00 0.00 58.65 58.67 3iam h GLN 146 Cb 0.55 -0.17 -0.04 0.00 0.30 0.00 0.00 27.48 28.12 3iam h GLN 146 CO -0.91 0.49 -1.48 0.00 -0.67 0.00 0.00 178.83 176.26 3iam h ARG 147 N 0.77 0.03 -0.36 1.46 3.08 -0.25 -2.87 114.38 116.22 3iam h ARG 147 Ca 0.46 -0.04 -0.16 0.00 0.07 0.00 0.00 59.98 60.30 3iam h ARG 147 Cb 0.65 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.71 3iam h ARG 147 CO -0.22 0.71 -0.40 -0.09 -1.07 0.00 0.00 179.97 178.91 3iam h ARG 148 N 0.01 0.89 -0.13 0.04 2.43 -0.19 -2.58 114.38 114.85 3iam h ARG 148 Ca -0.20 -0.48 -0.18 0.00 -0.81 0.00 0.00 59.98 58.31 3iam h ARG 148 Cb 1.94 0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 31.51 3iam h ARG 148 CO 0.10 1.12 -0.66 1.49 -1.51 0.00 0.00 179.97 180.51 3iam h GLU 149 N 0.73 0.53 0.00 0.20 4.81 -1.20 -2.57 114.58 117.07 3iam h GLU 149 Ca 0.06 -0.39 0.00 0.00 -0.13 0.00 0.00 59.36 58.90 3iam h GLU 149 Cb 0.98 0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.43 3iam h GLU 149 CO 0.10 1.01 0.00 0.00 -0.73 0.00 0.00 179.01 179.39 3iam n ALA 150 N -2.53 2.30 -0.05 2.92 0.00 -1.08 -3.28 120.51 118.78 3iam n ALA 150 Ca -0.04 -0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.29 3iam n ALA 150 Cb 0.67 -1.29 0.00 0.00 0.00 0.00 0.00 19.45 18.84 3iam n ALA 150 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 3iam n LYS 151 N -0.90 0.00 0.00 0.00 3.00 -0.97 -2.95 118.16 116.34 3iam n LYS 151 Ca 0.13 0.32 0.00 0.00 -0.00 0.00 0.00 58.31 58.76 3iam n LYS 151 Cb 0.06 -0.81 0.00 0.00 0.00 0.00 0.00 35.03 34.28 3iam n LYS 151 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.40 180.29 3iam n ARG 152 N -2.10 0.18 0.00 1.64 1.85 -1.22 -2.64 116.66 114.37 3iam n ARG 152 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.85 3iam n ARG 152 Cb 0.00 -1.10 0.00 0.00 -1.05 0.00 0.00 32.46 30.31 3iam n ARG 152 CO 0.00 0.00 0.00 2.41 -0.01 0.00 0.00 177.63 180.03 3iam n THR 153 N 0.43 0.00 -1.62 8.89 -1.04 -1.20 -5.03 114.28 114.71 3iam n THR 153 Ca 0.00 0.00 -0.19 0.00 -2.04 0.00 0.00 64.05 61.82 3iam n THR 153 Cb 0.05 -0.09 -0.08 0.00 -1.82 0.00 0.00 70.33 68.39 3iam n THR 153 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3iam n GLY 154 N 0.72 1.68 3.23 3.41 0.00 -1.08 -4.96 105.19 108.18 3iam n GLY 154 Ca 0.00 -0.09 -0.35 0.00 0.00 0.00 0.00 46.02 45.58 3iam n GLY 154 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3iam s LYS 155 N -3.73 2.90 0.66 1.61 2.47 -1.26 -5.09 119.74 117.30 3iam s LYS 155 Ca 0.00 -0.95 -0.17 0.00 -1.56 0.00 0.00 55.97 53.29 3iam s LYS 155 Cb 0.00 -3.06 -0.12 0.00 -1.46 0.00 0.00 37.83 33.18 3iam s LYS 155 CO 0.00 -0.40 -0.09 -2.30 0.16 0.00 0.00 175.35 172.72 3iam n PRO 156 N 4.71 0.10 -2.57 4.03 -0.02 -1.26 -4.63 135.00 135.35 3iam n PRO 156 Ca -0.16 0.04 -0.41 0.00 -2.02 0.00 0.00 63.50 60.95 3iam n PRO 156 Cb 0.47 -1.22 -0.04 0.00 -0.02 0.00 0.00 33.50 32.70 3iam n PRO 156 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 3iam s VAL 157 N -1.96 4.23 -0.23 -1.45 -7.23 -1.26 -5.03 120.40 107.47 3iam s VAL 157 Ca 0.56 1.75 -0.06 0.00 -1.81 0.00 0.00 61.98 62.42 3iam s VAL 157 Cb -0.40 -4.12 -0.02 0.00 0.56 0.00 0.00 36.38 32.41 3iam s VAL 157 CO 0.67 0.22 0.01 -0.54 -0.31 0.00 0.00 175.10 175.16 3iam s LYS 158 N 0.34 3.55 0.10 4.82 1.02 -1.26 -5.09 119.74 123.21 3iam s LYS 158 Ca 0.52 -0.54 -0.25 0.00 0.02 0.00 0.00 55.97 55.72 3iam s LYS 158 Cb -0.27 -3.16 -0.06 0.00 -0.52 0.00 0.00 37.83 33.82 3iam s LYS 158 CO 0.31 -0.15 0.78 0.08 -0.92 0.00 0.00 175.35 175.45 3iam s VAL 159 N 1.44 4.57 -0.27 3.17 1.01 -1.26 -4.95 120.40 124.11 3iam s VAL 159 Ca 0.05 1.68 -0.04 0.00 0.00 0.00 0.00 61.98 63.68 3iam s VAL 159 Cb -0.15 -4.13 -0.01 0.00 0.00 0.00 0.00 36.38 32.09 3iam s VAL 159 CO 0.01 0.43 2.81 0.61 0.00 0.00 0.00 175.10 178.95 3iam n GLY 160 N 2.06 3.79 3.80 4.51 0.00 -1.26 -4.89 105.19 113.20 3iam n GLY 160 Ca -0.04 -1.41 -0.09 0.00 0.00 0.00 0.00 46.02 44.49 3iam n GLY 160 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3iam s TYR 161 N -0.86 0.15 0.07 1.61 -0.85 -1.26 -2.98 117.35 113.23 3iam s TYR 161 Ca 0.51 -0.85 -0.21 0.00 -0.52 0.00 0.00 57.07 56.00 3iam s TYR 161 Cb 0.31 0.85 0.05 0.00 0.38 0.00 0.00 41.96 43.55 3iam s TYR 161 CO -0.10 -1.60 0.51 0.14 -1.52 0.00 0.00 175.55 172.97 3iam s VAL 162 N -2.12 0.03 0.06 -3.49 -7.23 -0.75 -4.79 120.40 102.10 3iam s VAL 162 Ca 0.16 -0.28 -0.04 0.00 -1.81 0.00 0.00 61.98 60.01 3iam s VAL 162 Cb -0.05 -1.01 -0.02 0.00 0.56 0.00 0.00 36.38 35.86 3iam s VAL 162 CO 0.12 -0.15 0.07 0.68 -0.31 0.00 0.00 175.10 175.50 3iam s VAL 163 N -2.79 0.17 0.12 1.32 -7.23 -1.21 -1.82 120.40 108.96 3iam s VAL 163 Ca -0.03 -1.40 -0.15 0.00 -1.81 0.00 0.00 61.98 58.58 3iam s VAL 163 Cb -0.00 -1.26 -0.02 0.00 0.56 0.00 0.00 36.38 35.65 3iam s VAL 163 CO -0.05 -0.78 1.57 1.55 -0.31 0.00 0.00 175.10 177.09 3iam h PRO 164 N 3.22 0.68 -2.55 4.82 0.13 -1.82 -3.10 132.00 133.38 3iam h PRO 164 Ca -0.34 -0.21 -0.04 0.00 -0.87 0.00 0.00 66.00 64.54 3iam h PRO 164 Cb 1.17 -0.06 -0.15 0.00 0.13 0.00 0.00 31.00 32.09 3iam h PRO 164 CO 0.58 0.77 0.20 1.52 -0.23 0.00 0.00 178.00 180.85 3iam s TYR 165 N -5.02 -0.59 -0.16 1.56 -0.85 -1.26 -4.52 117.35 106.51 3iam s TYR 165 Ca -0.13 0.68 -0.19 0.00 -0.52 0.00 0.00 57.07 56.92 3iam s TYR 165 Cb 0.10 0.49 -0.04 0.00 0.38 0.00 0.00 41.96 42.90 3iam s TYR 165 CO 0.79 -0.74 0.53 0.14 -1.52 0.00 0.00 175.55 174.75 3iam s VAL 166 N -2.60 5.12 0.59 -3.49 -7.23 -1.26 -4.66 120.40 106.87 3iam s VAL 166 Ca -0.04 1.02 -0.18 0.00 -1.81 0.00 0.00 61.98 60.97 3iam s VAL 166 Cb -0.01 -3.86 -0.14 0.00 0.56 0.00 0.00 36.38 32.93 3iam s VAL 166 CO -0.03 0.23 -0.19 0.54 -0.31 0.00 0.00 175.10 175.35 3iam n ARG 167 N 4.30 0.03 -0.30 4.82 1.74 -1.26 -4.82 116.66 121.17 3iam n ARG 167 Ca -0.05 0.01 0.08 0.00 -0.77 0.00 0.00 57.85 57.13 3iam n ARG 167 Cb 0.51 -1.06 0.24 0.00 -1.02 0.00 0.00 32.46 31.14 3iam n ARG 167 CO 0.00 0.00 0.00 -1.35 -1.52 0.00 0.00 177.63 174.76 3iam h PRO 168 N -0.17 0.60 -0.31 5.56 0.11 -1.97 -2.46 132.00 133.36 3iam h PRO 168 Ca -0.42 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 65.64 3iam h PRO 168 Cb 1.42 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 32.38 3iam h PRO 168 CO 0.39 0.40 0.10 0.93 -0.21 0.00 0.00 178.00 179.61 3iam h GLU 169 N 0.62 0.44 -1.44 1.05 3.07 -2.00 -3.04 114.58 113.27 3iam h GLU 169 Ca 0.49 -0.06 -0.26 0.00 -0.50 0.00 0.00 59.36 59.03 3iam h GLU 169 Cb 0.73 -0.08 -0.12 0.00 -0.84 0.00 0.00 28.75 28.43 3iam h GLU 169 CO -0.38 0.39 0.33 1.28 -1.40 0.00 0.00 179.01 179.23 3iam n LEU 170 N -4.39 5.84 -4.57 1.33 4.77 -0.93 -4.95 117.00 114.10 3iam n LEU 170 Ca 0.01 -2.95 -0.51 0.00 -0.03 0.00 0.00 56.01 52.53 3iam n LEU 170 Cb 0.15 -0.96 -0.05 0.00 -2.33 0.00 0.00 43.42 40.23 3iam n LEU 170 CO 0.37 1.07 0.75 1.21 -1.33 0.00 0.00 177.39 179.46 3iam n GLU 171 N 0.34 0.98 0.00 3.23 4.07 -1.15 -1.39 120.64 126.72 3iam n GLU 171 Ca 0.25 0.35 0.00 0.00 -0.06 0.00 0.00 57.16 57.70 3iam n GLU 171 Cb 0.67 -1.89 0.00 0.00 -0.06 0.00 0.00 31.44 30.16 3iam n GLU 171 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3iam n GLY 172 N 2.17 3.11 3.48 8.31 0.00 -1.26 -4.82 105.19 116.19 3iam n GLY 172 Ca 0.17 -0.87 -0.47 0.00 0.00 0.00 0.00 46.02 44.85 3iam n GLY 172 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 3iam n PHE 173 N 0.00 1.56 -2.88 1.61 7.35 -0.49 -4.88 117.46 119.73 3iam n PHE 173 Ca 0.00 0.21 -0.43 0.00 -0.76 0.00 0.00 57.45 56.47 3iam n PHE 173 Cb 0.00 -2.56 -0.05 0.00 0.35 0.00 0.00 39.48 37.22 3iam n PHE 173 CO 0.00 0.00 0.00 0.15 -0.76 0.00 0.00 176.76 176.15 3iam s LYS 174 N 6.67 3.39 0.08 -4.13 1.02 -1.26 -5.00 119.74 120.51 3iam s LYS 174 Ca 1.09 -0.14 0.04 0.00 0.02 0.00 0.00 55.97 56.98 3iam s LYS 174 Cb -0.73 -3.99 -0.03 0.00 -0.52 0.00 0.00 37.83 32.55 3iam s LYS 174 CO 0.44 -1.31 -0.12 0.00 -0.92 0.00 0.00 175.35 173.45 3iam s ALA 175 N 3.67 1.08 -0.75 5.17 0.00 -1.26 -4.98 121.76 124.70 3iam s ALA 175 Ca 0.31 -1.05 -0.26 0.00 0.00 0.00 0.00 51.96 50.96 3iam s ALA 175 Cb -0.12 -0.03 -0.04 0.00 0.00 0.00 0.00 23.12 22.93 3iam s ALA 175 CO 0.22 0.06 1.95 -1.25 0.00 0.00 0.00 175.76 176.73 3iam s PRO 176 N -2.17 2.53 -0.30 0.00 0.04 -1.26 -4.85 135.00 128.99 3iam s PRO 176 Ca 0.00 0.23 0.16 0.00 0.04 0.00 0.00 61.00 61.44 3iam s PRO 176 Cb -0.07 -4.72 0.48 0.00 0.04 0.00 0.00 34.50 30.23 3iam s PRO 176 CO 0.01 -3.12 1.10 0.25 0.04 0.00 0.00 177.00 175.28 3iam n THR 177 N 7.61 1.62 0.30 1.26 -2.24 -1.26 -3.29 114.28 118.28 3iam n THR 177 Ca 0.31 -3.46 0.12 0.00 -2.27 0.00 0.00 64.05 58.75 3iam n THR 177 Cb 0.49 0.34 0.63 0.00 -2.10 0.00 0.00 70.33 69.70 3iam n THR 177 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 3iam h GLU 178 N 2.59 0.00 0.00 -0.78 4.39 -1.89 -3.43 114.58 115.46 3iam h GLU 178 Ca 0.03 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.73 3iam h GLU 178 Cb 1.28 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.93 3iam h GLU 178 CO 0.45 0.00 0.00 0.41 -1.16 0.00 0.00 179.01 178.71