#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3iam s VAL 2 N 0.00 5.45 -0.68 2.03 1.01 0.40 -4.88 120.40 123.72 3iam s VAL 2 Ca 0.00 0.24 -0.18 0.00 0.00 0.00 0.00 61.98 62.04 3iam s VAL 2 Cb 0.00 -3.44 0.12 0.00 0.00 0.00 0.00 36.38 33.06 3iam s VAL 2 CO 0.00 0.56 0.79 -0.60 0.00 0.00 0.00 175.10 175.85 3iam s ARG 3 N -0.57 3.22 -0.06 2.72 6.06 -1.26 -2.52 118.95 126.54 3iam s ARG 3 Ca 0.13 -1.54 -0.01 0.00 -2.50 0.00 0.00 55.73 51.82 3iam s ARG 3 Cb -0.12 -4.40 -0.03 0.00 0.06 0.00 0.00 34.95 30.46 3iam s ARG 3 CO 0.03 -1.56 0.01 0.08 -2.50 0.00 0.00 175.30 171.36 3iam s VAL 4 N 2.39 4.30 -0.36 7.11 1.01 -0.79 -1.78 120.40 132.28 3iam s VAL 4 Ca 0.16 -0.36 -0.04 0.00 0.00 0.00 0.00 61.98 61.74 3iam s VAL 4 Cb -0.19 -2.85 0.07 0.00 0.00 0.00 0.00 36.38 33.41 3iam s VAL 4 CO 0.02 0.52 0.12 -0.75 0.00 0.00 0.00 175.10 175.01 3iam s LYS 5 N -1.14 2.36 0.00 2.72 2.20 -0.87 0.66 119.74 125.68 3iam s LYS 5 Ca 0.16 -1.45 0.00 0.00 -0.36 0.00 0.00 55.97 54.32 3iam s LYS 5 Cb -0.11 -3.45 0.00 0.00 -1.51 0.00 0.00 37.83 32.76 3iam s LYS 5 CO 0.05 -0.82 0.00 0.28 -0.36 0.00 0.00 175.35 174.51 3iam n VAL 6 N 4.70 0.00 -0.02 4.02 0.31 -0.04 -1.96 118.33 125.34 3iam n VAL 6 Ca -0.09 0.00 -0.00 0.00 -0.01 0.00 0.00 64.34 64.24 3iam n VAL 6 Cb 0.43 -0.41 -0.00 0.00 -0.91 0.00 0.00 33.84 32.95 3iam n VAL 6 CO 0.00 0.00 0.00 0.78 -1.32 0.00 0.00 176.83 176.29 3iam h ASN 7 N 0.00 0.00 0.00 4.52 2.35 -1.97 -3.20 115.58 117.28 3iam h ASN 7 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3iam h ASN 7 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.37 3iam h ASN 7 CO 0.00 0.19 0.00 -0.90 -1.65 0.00 0.00 177.43 175.07 3iam n ASP 8 N -3.00 0.05 -4.74 5.81 5.68 -1.26 -4.95 116.55 114.13 3iam n ASP 8 Ca -0.00 -0.33 -0.37 0.00 -0.50 0.00 0.00 54.79 53.59 3iam n ASP 8 Cb 0.01 0.48 -0.07 0.00 -1.14 0.00 0.00 41.12 40.41 3iam n ASP 8 CO 0.00 0.00 0.00 -0.60 -1.33 0.00 0.00 177.20 175.27 3iam s ARG 9 N -0.48 4.21 -0.04 0.11 3.52 -1.26 -5.08 118.95 119.94 3iam s ARG 9 Ca 0.00 0.24 -0.04 0.00 -0.13 0.00 0.00 55.73 55.79 3iam s ARG 9 Cb 0.00 -3.39 -0.04 0.00 -1.56 0.00 0.00 34.95 29.95 3iam s ARG 9 CO 0.00 0.29 0.18 0.42 -0.81 0.00 0.00 175.30 175.38 3iam s ILE 10 N 0.27 5.45 -0.05 4.11 1.09 -1.26 -0.86 121.20 129.95 3iam s ILE 10 Ca 0.20 -0.01 -0.03 0.00 -1.10 0.00 0.00 60.65 59.71 3iam s ILE 10 Cb -0.14 -3.50 0.03 0.00 -1.06 0.00 0.00 42.46 37.78 3iam s ILE 10 CO 0.07 0.42 0.12 -0.69 -0.10 0.00 0.00 174.94 174.77 3iam s VAL 11 N -1.23 -0.03 0.67 2.92 1.01 0.21 -4.95 120.40 119.01 3iam s VAL 11 Ca 0.23 0.10 -0.13 0.00 0.00 0.00 0.00 61.98 62.19 3iam s VAL 11 Cb -0.12 -0.20 0.00 0.00 0.00 0.00 0.00 36.38 36.06 3iam s VAL 11 CO 0.14 0.04 1.07 -1.61 0.00 0.00 0.00 175.10 174.74 3iam s GLU 12 N 0.66 2.90 -0.29 2.72 2.02 -1.26 -1.89 118.70 123.55 3iam s GLU 12 Ca -0.05 1.15 -0.26 0.00 0.02 0.00 0.00 54.97 55.83 3iam s GLU 12 Cb -0.07 -1.98 0.19 0.00 0.10 0.00 0.00 34.13 32.37 3iam s GLU 12 CO -0.03 -1.14 1.41 0.54 0.02 0.00 0.00 175.26 176.06 3iam s VAL 13 N -2.72 0.00 0.80 2.63 0.11 -1.05 -4.93 120.40 115.24 3iam s VAL 13 Ca 0.62 0.00 -0.13 0.00 -2.93 0.00 0.00 61.98 59.54 3iam s VAL 13 Cb -0.16 -1.00 0.08 0.00 -1.53 0.00 0.00 36.38 33.77 3iam s VAL 13 CO 0.47 0.00 1.19 -2.16 -3.33 0.00 0.00 175.10 171.27 3iam s PRO 14 N -0.09 1.72 0.24 1.54 0.04 -1.26 -0.46 135.00 136.74 3iam s PRO 14 Ca 0.07 1.69 -0.04 0.00 0.04 0.00 0.00 61.00 62.76 3iam s PRO 14 Cb -0.04 -1.79 0.40 0.00 0.04 0.00 0.00 34.50 33.11 3iam s PRO 14 CO -0.14 -2.14 1.80 -1.00 0.04 0.00 0.00 177.00 175.56 3iam h PRO 15 N -0.88 0.71 -2.00 0.56 0.13 -1.93 -3.14 132.00 125.45 3iam h PRO 15 Ca -0.46 -0.04 -0.25 0.00 -0.87 0.00 0.00 66.00 64.38 3iam h PRO 15 Cb 1.29 -0.16 -0.09 0.00 0.13 0.00 0.00 31.00 32.17 3iam h PRO 15 CO 0.47 0.47 -0.22 0.41 -0.23 0.00 0.00 178.00 178.90 3iam n GLY 16 N -1.32 3.26 3.49 1.56 0.00 -1.26 -4.55 105.19 106.37 3iam n GLY 16 Ca 0.14 -1.30 -0.33 0.00 0.00 0.00 0.00 46.02 44.52 3iam n GLY 16 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3iam s THR 17 N 0.29 3.20 0.49 2.61 2.01 -1.19 -4.56 115.64 118.50 3iam s THR 17 Ca 0.63 -0.67 -0.20 0.00 0.31 0.00 0.00 61.69 61.76 3iam s THR 17 Cb 0.32 -2.27 -0.08 0.00 0.01 0.00 0.00 72.50 70.48 3iam s THR 17 CO -0.04 0.59 1.04 -0.94 -0.69 0.00 0.00 174.62 174.58 3iam s SER 18 N -0.70 6.29 0.50 3.53 1.04 -1.26 -1.92 113.70 121.18 3iam s SER 18 Ca 0.11 1.92 0.27 0.00 0.48 0.00 0.00 55.95 58.73 3iam s SER 18 Cb -0.11 -2.56 1.28 0.00 0.10 0.00 0.00 66.02 64.73 3iam s SER 18 CO 0.01 -0.82 1.98 0.58 0.98 0.00 0.00 173.24 175.97 3iam h VAL 19 N 1.47 0.51 0.22 5.02 2.07 0.06 -0.06 116.25 125.54 3iam h VAL 19 Ca -0.49 -0.74 -0.01 0.00 0.82 0.00 0.00 66.70 66.27 3iam h VAL 19 Cb 1.22 1.50 0.00 0.00 -1.52 0.00 0.00 31.29 32.50 3iam h VAL 19 CO 0.59 0.15 -0.11 -0.03 0.02 0.00 0.00 177.57 178.19 3iam h MET 20 N 0.00 -0.29 0.00 1.57 4.05 -1.30 -0.60 114.93 118.36 3iam h MET 20 Ca -0.00 0.02 0.00 0.00 -0.28 0.00 0.00 59.70 59.44 3iam h MET 20 Cb 0.49 0.07 0.00 0.00 -0.80 0.00 0.00 31.60 31.36 3iam h MET 20 CO 0.02 -0.19 0.10 -0.44 0.23 0.00 0.00 176.91 176.63 3iam h ASP 21 N -0.38 0.00 -0.07 1.39 3.45 -1.81 0.38 116.42 119.38 3iam h ASP 21 Ca -0.03 0.00 -0.04 0.00 0.43 0.00 0.00 57.03 57.39 3iam h ASP 21 Cb 0.23 0.00 -0.00 0.00 -0.56 0.00 0.00 39.33 39.00 3iam h ASP 21 CO 0.05 0.00 -0.11 0.00 -1.57 0.00 0.00 179.24 177.61 3iam h ALA 22 N 1.75 0.11 -0.01 3.45 0.00 -0.80 -1.12 119.26 122.64 3iam h ALA 22 Ca 0.00 -0.32 -0.16 0.00 0.00 0.00 0.00 54.91 54.44 3iam h ALA 22 Cb 0.21 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 3iam h ALA 22 CO 0.00 -0.03 -0.73 0.28 0.00 0.00 0.00 179.25 178.76 3iam h VAL 23 N -0.25 1.51 0.04 0.00 2.07 0.13 -2.30 116.25 117.44 3iam h VAL 23 Ca 0.01 -2.46 -0.23 0.00 0.82 0.00 0.00 66.70 64.83 3iam h VAL 23 Cb 0.65 2.33 -0.00 0.00 -1.52 0.00 0.00 31.29 32.75 3iam h VAL 23 CO 0.02 0.71 -1.02 -0.26 0.02 0.00 0.00 177.57 177.04 3iam h PHE 24 N 0.03 0.49 -0.20 1.57 0.04 -0.91 -2.94 116.94 115.02 3iam h PHE 24 Ca -0.01 -0.30 -0.04 0.00 2.80 0.00 0.00 57.97 60.43 3iam h PHE 24 Cb 1.30 -0.04 -0.01 0.00 2.20 0.00 0.00 35.95 39.39 3iam h PHE 24 CO 0.01 1.15 -0.04 1.25 -0.60 0.00 0.00 178.31 180.08 3iam h HIS 25 N 0.15 0.30 0.00 -0.55 2.76 -1.13 -2.77 115.15 113.91 3iam h HIS 25 Ca -0.09 -0.02 -0.11 0.00 -2.20 0.00 0.00 60.37 57.96 3iam h HIS 25 Cb 1.68 -0.09 -0.02 0.00 1.55 0.00 0.00 27.41 30.54 3iam h HIS 25 CO 0.05 0.34 -0.51 0.00 -1.30 0.00 0.00 177.93 176.52 3iam h ALA 26 N 1.68 1.08 0.00 5.26 0.00 -1.38 -3.43 119.26 122.46 3iam h ALA 26 Ca 0.07 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.52 3iam h ALA 26 Cb 0.26 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.97 3iam h ALA 26 CO 0.01 0.63 0.00 0.41 0.00 0.00 0.00 179.25 180.30 3iam n GLY 27 N 0.07 3.58 0.00 0.00 0.00 -1.05 -5.02 105.19 102.77 3iam n GLY 27 Ca -0.01 -0.98 0.00 0.00 0.00 0.00 0.00 46.02 45.03 3iam n GLY 27 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3iam n TYR 28 N 0.00 -2.15 -3.78 1.61 4.02 -1.12 -4.91 117.16 110.83 3iam n TYR 28 Ca 0.00 0.00 -0.02 0.00 -0.01 0.00 0.00 57.90 57.87 3iam n TYR 28 Cb 0.00 0.00 -0.00 0.00 -0.02 0.00 0.00 39.34 39.32 3iam n TYR 28 CO 0.00 0.00 0.00 0.16 -1.01 0.00 0.00 176.86 176.01 3iam s ASP 29 N -1.92 -0.08 -0.14 7.72 -4.77 -1.26 -4.15 116.67 112.06 3iam s ASP 29 Ca 0.00 -0.43 -0.30 0.00 -3.30 0.00 0.00 52.55 48.52 3iam s ASP 29 Cb 0.00 0.41 0.12 0.00 -1.09 0.00 0.00 42.92 42.37 3iam s ASP 29 CO 0.00 -0.78 0.99 0.54 0.70 0.00 0.00 175.17 176.62 3iam s VAL 30 N -2.69 0.00 0.95 2.11 0.11 -1.26 -5.00 120.40 114.62 3iam s VAL 30 Ca 0.17 0.00 -0.23 0.00 -2.93 0.00 0.00 61.98 58.98 3iam s VAL 30 Cb -0.00 -1.00 -0.13 0.00 -1.53 0.00 0.00 36.38 33.71 3iam s VAL 30 CO 0.02 0.00 -1.16 -2.65 -3.33 0.00 0.00 175.10 167.98 3iam n PRO 31 N 0.58 -0.22 0.00 1.54 -0.02 -1.26 -5.00 135.00 130.61 3iam n PRO 31 Ca -0.10 -0.06 0.00 0.00 -2.02 0.00 0.00 63.50 61.32 3iam n PRO 31 Cb 0.58 -1.08 0.00 0.00 -0.02 0.00 0.00 33.50 32.98 3iam n PRO 31 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 3iam n LEU 32 N 2.80 0.00 0.00 2.45 -0.00 -1.26 -4.40 117.00 116.58 3iam n LEU 32 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.00 3iam n LEU 32 Cb 0.64 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 44.06 3iam n LEU 32 CO 0.38 0.00 0.00 0.49 -0.00 0.00 0.00 177.39 178.26 3iam n PHE 33 N 0.00 0.00 -0.05 1.96 3.72 -1.26 -4.89 117.46 116.94 3iam n PHE 33 Ca 0.00 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.53 3iam n PHE 33 Cb 0.00 0.00 0.54 0.00 -0.94 0.00 0.00 39.48 39.08 3iam n PHE 33 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3iam s SER 35 N -6.29 7.47 0.10 0.00 0.01 -1.26 -4.46 113.70 109.26 3iam s SER 35 Ca -0.07 2.03 -0.04 0.00 1.31 0.00 0.00 55.95 59.18 3iam s SER 35 Cb 0.19 -2.61 -0.03 0.00 0.21 0.00 0.00 66.02 63.79 3iam s SER 35 CO 0.74 -0.01 0.09 -0.70 0.41 0.00 0.00 173.24 173.77 3iam s GLU 36 N -0.95 0.83 0.27 12.44 2.56 -1.23 -5.02 118.70 127.60 3iam s GLU 36 Ca 0.44 -1.20 -0.29 0.00 0.00 0.00 0.00 54.97 53.92 3iam s GLU 36 Cb -0.28 0.28 -0.10 0.00 2.00 0.00 0.00 34.13 36.03 3iam s GLU 36 CO 0.34 -0.23 1.21 0.15 -0.56 0.00 0.00 175.26 176.17 3iam s LYS 37 N -3.94 4.49 0.00 4.30 1.02 -1.26 -3.10 119.74 121.25 3iam s LYS 37 Ca 0.12 1.99 0.00 0.00 0.02 0.00 0.00 55.97 58.10 3iam s LYS 37 Cb 0.06 -3.16 0.00 0.00 -0.52 0.00 0.00 37.83 34.22 3iam s LYS 37 CO -0.06 -0.03 0.00 0.72 -0.92 0.00 0.00 175.35 175.07 3iam n HIS 38 N 1.43 0.00 -4.40 3.18 8.25 -1.26 -4.95 115.22 117.46 3iam n HIS 38 Ca 0.01 0.00 -0.32 0.00 -0.26 0.00 0.00 57.72 57.15 3iam n HIS 38 Cb 0.43 -1.27 -0.10 0.00 1.12 0.00 0.00 29.99 30.18 3iam n HIS 38 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3iam s LEU 39 N 0.00 3.27 0.02 2.41 1.43 -1.18 -4.95 118.68 119.69 3iam s LEU 39 Ca 0.00 -0.11 -0.36 0.00 -1.03 0.00 0.00 54.13 52.63 3iam s LEU 39 Cb 0.00 -1.87 -0.15 0.00 0.03 0.00 0.00 46.19 44.19 3iam s LEU 39 CO 0.00 0.28 1.52 -1.54 0.23 0.00 0.00 176.35 176.84 3iam n SER 40 N 1.50 2.30 -4.73 2.29 3.41 -1.26 -4.58 113.62 112.55 3iam n SER 40 Ca -0.15 1.09 -0.41 0.00 -0.26 0.00 0.00 58.87 59.14 3iam n SER 40 Cb 0.53 -1.26 -0.04 0.00 -0.26 0.00 0.00 64.21 63.18 3iam n SER 40 CO 0.00 0.00 0.00 -2.16 -0.16 0.00 0.00 175.04 172.72 3iam s PRO 41 N 1.47 4.67 0.24 4.33 0.04 -1.25 -4.81 135.00 139.69 3iam s PRO 41 Ca 0.86 1.47 0.02 0.00 0.04 0.00 0.00 61.00 63.39 3iam s PRO 41 Cb -0.88 -3.38 -0.05 0.00 0.04 0.00 0.00 34.50 30.23 3iam s PRO 41 CO 0.48 0.17 0.05 0.42 0.04 0.00 0.00 177.00 178.16 3iam s ILE 42 N 0.12 0.73 -0.96 0.56 1.01 -1.26 -4.83 121.20 116.55 3iam s ILE 42 Ca 0.48 -2.00 -0.02 0.00 0.00 0.00 0.00 60.65 59.10 3iam s ILE 42 Cb -0.24 -2.46 0.27 0.00 0.01 0.00 0.00 42.46 40.05 3iam s ILE 42 CO 0.30 -0.19 1.13 0.61 0.00 0.00 0.00 174.94 176.79 3iam n GLY 43 N -0.41 4.71 0.13 6.18 0.00 -1.26 -4.67 105.19 109.87 3iam n GLY 43 Ca -0.03 -2.66 -0.16 0.00 0.00 0.00 0.00 46.02 43.17 3iam n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iam n ALA 44 N 1.68 1.53 0.14 4.61 0.00 -1.26 -4.48 120.51 122.73 3iam n ALA 44 Ca 0.25 -0.92 0.02 0.00 0.00 0.00 0.00 53.44 52.79 3iam n ALA 44 Cb 0.36 0.03 0.06 0.00 0.00 0.00 0.00 19.45 19.90 3iam n ALA 44 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3iam n ARG 46 N -3.28 -6.41 -0.01 0.00 1.74 -1.26 -4.93 116.66 102.51 3iam n ARG 46 Ca 0.02 0.78 0.01 0.00 -0.77 0.00 0.00 57.85 57.88 3iam n ARG 46 Cb 0.72 -5.60 -0.03 0.00 -1.02 0.00 0.00 32.46 26.52 3iam n ARG 46 CO 0.00 0.00 0.00 -1.33 -1.52 0.00 0.00 177.63 174.78 3iam n MET 47 N -4.07 1.13 -0.28 5.56 2.81 -1.26 -4.61 117.12 116.41 3iam n MET 47 Ca -0.20 -0.03 0.01 0.00 -1.81 0.00 0.00 57.70 55.68 3iam n MET 47 Cb 0.63 -1.10 0.12 0.00 -0.71 0.00 0.00 33.22 32.15 3iam n MET 47 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3iam n LEU 49 N 0.17 4.61 -4.18 0.00 4.77 -1.25 -2.49 117.00 118.63 3iam n LEU 49 Ca 0.09 1.00 -0.14 0.00 -0.03 0.00 0.00 56.01 56.94 3iam n LEU 49 Cb 0.56 -1.51 -0.08 0.00 -2.33 0.00 0.00 43.42 40.05 3iam n LEU 49 CO 0.11 -0.83 -0.12 0.68 -1.33 0.00 0.00 177.39 175.89 3iam s VAL 50 N -1.29 0.00 -0.01 4.08 -7.23 0.37 -4.87 120.40 111.45 3iam s VAL 50 Ca 0.68 -1.89 -0.02 0.00 -1.81 0.00 0.00 61.98 58.94 3iam s VAL 50 Cb -0.45 -2.48 -0.04 0.00 0.56 0.00 0.00 36.38 33.97 3iam s VAL 50 CO 0.52 0.00 0.14 -0.60 -0.31 0.00 0.00 175.10 174.86 3iam s ARG 51 N -3.88 3.30 -0.03 4.82 3.52 -0.79 -1.41 118.95 124.49 3iam s ARG 51 Ca 0.37 -0.38 0.01 0.00 -0.13 0.00 0.00 55.73 55.60 3iam s ARG 51 Cb 0.04 -3.01 0.02 0.00 -1.56 0.00 0.00 34.95 30.44 3iam s ARG 51 CO 0.16 0.67 -0.03 0.42 -0.81 0.00 0.00 175.30 175.71 3iam s ILE 52 N -1.26 0.37 0.01 4.11 1.01 -1.26 -1.44 121.20 122.73 3iam s ILE 52 Ca 0.25 -0.05 0.07 0.00 0.00 0.00 0.00 60.65 60.92 3iam s ILE 52 Cb -0.12 -0.41 -0.03 0.00 0.01 0.00 0.00 42.46 41.91 3iam s ILE 52 CO 0.16 0.17 -0.20 -0.83 0.00 0.00 0.00 174.94 174.25 3iam s GLY 53 N 0.79 1.49 -0.11 6.18 0.00 -0.41 -0.38 107.32 114.88 3iam s GLY 53 Ca -0.09 -1.14 0.17 0.00 0.00 0.00 0.00 44.72 43.66 3iam s GLY 53 CO -0.01 -0.99 1.19 -0.10 0.00 0.00 0.00 173.10 173.20 3iam n LEU 54 N 1.92 1.91 0.00 0.66 7.94 -0.63 -0.82 117.00 127.98 3iam n LEU 54 Ca -0.16 -3.01 0.00 0.00 -1.11 0.00 0.00 56.01 51.73 3iam n LEU 54 Cb 0.52 -0.29 0.00 0.00 0.53 0.00 0.00 43.42 44.18 3iam n LEU 54 CO 0.25 0.98 0.00 -0.81 -1.11 0.00 0.00 177.39 176.70 3iam n PRO 55 N -0.41 3.12 -3.16 1.96 -0.04 -1.26 -4.82 135.00 130.38 3iam n PRO 55 Ca 0.13 0.00 -0.45 0.00 -0.04 0.00 0.00 63.50 63.14 3iam n PRO 55 Cb 0.88 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.34 3iam n PRO 55 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 3iam n ILE 73 N 0.00 4.48 -3.25 0.52 5.41 -1.26 -5.11 119.36 120.15 3iam n ILE 73 Ca 0.00 -5.14 -0.45 0.00 1.00 0.00 0.00 62.75 58.16 3iam n ILE 73 Cb 0.00 -2.52 -0.05 0.00 -0.71 0.00 0.00 39.64 36.35 3iam n ILE 73 CO 0.00 0.00 0.00 -1.10 0.00 0.00 0.00 176.55 175.45 3iam s GLN 74 N -0.26 3.02 0.08 0.38 -0.21 -1.26 -5.04 119.66 116.36 3iam s GLN 74 Ca 0.36 -1.45 -0.29 0.00 0.02 0.00 0.00 55.36 53.99 3iam s GLN 74 Cb -0.06 -4.24 -0.05 0.00 1.00 0.00 0.00 33.01 29.65 3iam s GLN 74 CO -0.04 -1.32 0.94 -1.58 -2.12 0.00 0.00 175.29 171.17 3iam s TRP 75 N 2.01 3.77 0.49 0.91 0.52 -1.26 -1.60 118.94 123.77 3iam s TRP 75 Ca 0.07 1.74 -0.23 0.00 0.02 0.00 0.00 56.10 57.70 3iam s TRP 75 Cb -0.26 -3.04 -0.07 0.00 -1.15 0.00 0.00 33.47 28.95 3iam s TRP 75 CO 0.05 0.17 1.27 -0.65 0.02 0.00 0.00 176.95 177.82 3iam s GLN 76 N 0.19 3.54 0.23 4.98 -1.52 0.49 -4.96 119.66 122.61 3iam s GLN 76 Ca 0.47 2.04 0.01 0.00 -1.95 0.00 0.00 55.36 55.92 3iam s GLN 76 Cb -0.22 -2.41 0.23 0.00 -0.22 0.00 0.00 33.01 30.39 3iam s GLN 76 CO 0.29 -0.81 1.57 -1.35 -0.25 0.00 0.00 175.29 174.74 3iam h PRO 77 N 1.92 0.43 -6.11 2.91 0.11 -1.96 -3.44 132.00 125.86 3iam h PRO 77 Ca -0.50 -0.25 -0.53 0.00 0.11 0.00 0.00 66.00 64.83 3iam h PRO 77 Cb 1.27 0.02 -0.07 0.00 0.11 0.00 0.00 31.00 32.33 3iam h PRO 77 CO 0.59 0.83 -0.51 -1.59 -0.21 0.00 0.00 178.00 177.12 3iam s LYS 78 N -4.03 2.44 0.31 1.05 -2.85 -1.26 -5.12 119.74 110.28 3iam s LYS 78 Ca -0.06 -1.51 -0.25 0.00 -1.00 0.00 0.00 55.97 53.15 3iam s LYS 78 Cb 0.12 -2.23 -0.10 0.00 -2.06 0.00 0.00 37.83 33.56 3iam s LYS 78 CO 0.81 0.08 0.91 -0.51 0.10 0.00 0.00 175.35 176.75 3iam s LEU 79 N -3.89 4.32 -0.11 2.77 1.43 -1.26 -4.75 118.68 117.18 3iam s LEU 79 Ca 0.39 1.76 -0.03 0.00 -1.03 0.00 0.00 54.13 55.23 3iam s LEU 79 Cb -0.03 -3.97 -0.03 0.00 0.03 0.00 0.00 46.19 42.19 3iam s LEU 79 CO 0.24 -0.07 -0.01 0.00 0.23 0.00 0.00 176.35 176.74 3iam s ALA 80 N -1.63 3.18 -0.34 4.21 0.00 -0.50 -4.84 121.76 121.85 3iam s ALA 80 Ca 0.50 -0.81 -0.29 0.00 0.00 0.00 0.00 51.96 51.35 3iam s ALA 80 Cb -0.18 -1.51 -0.00 0.00 0.00 0.00 0.00 23.12 21.43 3iam s ALA 80 CO 0.23 0.44 1.42 0.00 0.00 0.00 0.00 175.76 177.85 3iam s ALA 81 N -0.41 3.19 0.15 0.00 0.00 -1.26 -0.48 121.76 122.95 3iam s ALA 81 Ca 0.07 0.05 0.34 0.00 0.00 0.00 0.00 51.96 52.42 3iam s ALA 81 Cb -0.12 -3.87 1.42 0.00 0.00 0.00 0.00 23.12 20.54 3iam s ALA 81 CO 0.02 -2.11 2.00 0.66 0.00 0.00 0.00 175.76 176.34 3iam h SER 82 N 10.29 0.00 0.97 0.00 4.64 -1.82 -2.91 113.55 124.72 3iam h SER 82 Ca -0.28 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.04 3iam h SER 82 Cb 1.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.20 3iam h SER 82 CO 1.05 0.02 0.00 0.00 -0.87 0.00 0.00 176.83 177.03 3iam n VAL 84 N -1.83 0.56 -4.22 0.00 0.24 -1.10 -4.71 118.33 107.27 3iam n VAL 84 Ca 0.05 -1.59 -0.28 0.00 -2.04 0.00 0.00 64.34 60.48 3iam n VAL 84 Cb 0.31 0.71 -0.17 0.00 -1.47 0.00 0.00 33.84 33.22 3iam n VAL 84 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 3iam s THR 85 N -0.88 1.37 0.22 3.34 2.01 -1.22 -5.00 115.64 115.47 3iam s THR 85 Ca 0.35 -0.54 -0.30 0.00 0.31 0.00 0.00 61.69 61.51 3iam s THR 85 Cb 0.38 -1.29 -0.08 0.00 0.01 0.00 0.00 72.50 71.52 3iam s THR 85 CO -0.14 0.42 1.02 0.00 -0.69 0.00 0.00 174.62 175.23 3iam s ALA 86 N 1.26 3.35 0.14 7.40 0.00 -1.26 -1.12 121.76 131.53 3iam s ALA 86 Ca -0.01 0.73 -0.31 0.00 0.00 0.00 0.00 51.96 52.36 3iam s ALA 86 Cb -0.14 -3.28 -0.10 0.00 0.00 0.00 0.00 23.12 19.60 3iam s ALA 86 CO -0.05 -0.02 1.63 0.14 0.00 0.00 0.00 175.76 177.46 3iam s VAL 87 N -0.78 2.68 0.42 0.00 -7.23 -0.81 -4.87 120.40 109.80 3iam s VAL 87 Ca 0.45 0.39 0.00 0.00 -1.81 0.00 0.00 61.98 61.01 3iam s VAL 87 Cb -0.28 -3.25 -0.01 0.00 0.56 0.00 0.00 36.38 33.40 3iam s VAL 87 CO 0.35 0.02 0.63 0.00 -0.31 0.00 0.00 175.10 175.79 3iam s ALA 88 N 1.71 3.73 0.21 1.32 0.00 -1.26 -4.89 121.76 122.59 3iam s ALA 88 Ca 0.72 -1.00 -0.30 0.00 0.00 0.00 0.00 51.96 51.39 3iam s ALA 88 Cb -0.43 -2.14 -0.08 0.00 0.00 0.00 0.00 23.12 20.46 3iam s ALA 88 CO 0.32 -0.25 1.10 0.34 0.00 0.00 0.00 175.76 177.26 3iam s ASP 89 N -4.15 7.28 -0.91 0.00 -1.08 -1.26 -3.22 116.67 113.32 3iam s ASP 89 Ca 0.46 2.15 -0.02 0.00 -0.52 0.00 0.00 52.55 54.61 3iam s ASP 89 Cb -0.10 -2.61 0.00 0.00 -1.46 0.00 0.00 42.92 38.75 3iam s ASP 89 CO 0.37 -0.18 0.30 0.61 0.52 0.00 0.00 175.17 176.79 3iam n GLY 90 N 1.75 -0.02 3.88 2.66 0.00 -0.73 -4.97 105.19 107.76 3iam n GLY 90 Ca 0.01 -0.28 -0.29 0.00 0.00 0.00 0.00 46.02 45.46 3iam n GLY 90 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3iam s MET 91 N -5.11 3.71 -0.08 1.61 1.75 -1.20 -4.63 119.30 115.36 3iam s MET 91 Ca 0.15 0.37 0.03 0.00 -1.25 0.00 0.00 55.69 54.99 3iam s MET 91 Cb -0.07 -2.40 0.01 0.00 2.84 0.00 0.00 34.83 35.21 3iam s MET 91 CO 0.18 -0.06 -0.16 0.08 -0.65 0.00 0.00 175.02 174.41 3iam s VAL 92 N -2.44 1.46 -0.18 10.11 1.01 0.00 -2.05 120.40 128.30 3iam s VAL 92 Ca 0.50 -0.67 0.01 0.00 0.00 0.00 0.00 61.98 61.81 3iam s VAL 92 Cb -0.10 -1.29 0.02 0.00 0.00 0.00 0.00 36.38 35.00 3iam s VAL 92 CO 0.35 0.43 -0.18 -0.69 0.00 0.00 0.00 175.10 175.00 3iam s VAL 93 N 0.53 2.21 -0.25 2.92 1.01 -0.83 -1.28 120.40 124.71 3iam s VAL 93 Ca -0.16 -0.89 -0.07 0.00 0.00 0.00 0.00 61.98 60.86 3iam s VAL 93 Cb -0.16 -1.94 -0.03 0.00 0.00 0.00 0.00 36.38 34.25 3iam s VAL 93 CO 0.05 0.53 0.07 -0.62 0.00 0.00 0.00 175.10 175.13 3iam s ASP 94 N 1.29 5.14 0.00 3.32 2.15 -0.52 -3.55 116.67 124.50 3iam s ASP 94 Ca 0.05 -0.25 0.02 0.00 0.43 0.00 0.00 52.55 52.80 3iam s ASP 94 Cb -0.13 -1.92 0.02 0.00 -0.30 0.00 0.00 42.92 40.59 3iam s ASP 94 CO -0.11 -0.05 0.65 0.35 -0.17 0.00 0.00 175.17 175.84 3iam n THR 95 N 4.92 0.18 -0.04 1.71 -2.24 -1.26 -1.88 114.28 115.67 3iam n THR 95 Ca -0.16 -0.59 -0.04 0.00 -2.27 0.00 0.00 64.05 60.99 3iam n THR 95 Cb 0.51 0.95 -0.07 0.00 -2.10 0.00 0.00 70.33 69.61 3iam n THR 95 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 3iam n LEU 96 N 0.04 0.00 -4.35 3.22 4.77 -1.26 -4.68 117.00 114.73 3iam n LEU 96 Ca 0.01 0.00 -0.38 0.00 -0.03 0.00 0.00 56.01 55.61 3iam n LEU 96 Cb 0.09 0.21 0.02 0.00 -2.33 0.00 0.00 43.42 41.42 3iam n LEU 96 CO 0.01 0.21 -0.31 -0.24 -1.33 0.00 0.00 177.39 175.73 3iam n SER 97 N -2.31 -2.44 -0.21 -1.43 2.88 -1.26 -4.56 113.62 104.29 3iam n SER 97 Ca -0.14 0.69 0.18 0.00 -1.33 0.00 0.00 58.87 58.27 3iam n SER 97 Cb 0.76 -1.00 0.52 0.00 -0.75 0.00 0.00 64.21 63.74 3iam n SER 97 CO 0.00 0.00 0.00 0.44 -1.23 0.00 0.00 175.04 174.25 3iam h ASP 98 N 0.09 0.38 -0.77 -3.46 3.32 -1.99 -0.88 116.42 113.10 3iam h ASP 98 Ca -0.43 0.03 0.01 0.00 0.02 0.00 0.00 57.03 56.66 3iam h ASP 98 Cb 1.42 -0.04 -0.04 0.00 0.22 0.00 0.00 39.33 40.89 3iam h ASP 98 CO 0.44 0.17 0.51 0.58 -1.72 0.00 0.00 179.24 179.22 3iam h VAL 99 N 0.39 1.18 0.32 -1.35 2.07 -1.99 -0.46 116.25 116.41 3iam h VAL 99 Ca 0.43 -0.35 -0.02 0.00 0.82 0.00 0.00 66.70 67.58 3iam h VAL 99 Cb 1.06 0.06 0.00 0.00 -1.52 0.00 0.00 31.29 30.90 3iam h VAL 99 CO -0.14 0.19 -0.15 0.58 0.02 0.00 0.00 177.57 178.06 3iam h VAL 100 N 1.03 0.19 -0.50 2.57 2.07 -1.50 -2.96 116.25 117.16 3iam h VAL 100 Ca 0.29 -0.75 0.10 0.00 0.82 0.00 0.00 66.70 67.16 3iam h VAL 100 Cb -0.10 0.32 -0.09 0.00 -1.52 0.00 0.00 31.29 29.91 3iam h VAL 100 CO -0.07 0.05 -0.09 0.03 0.02 0.00 0.00 177.57 177.50 3iam h ARG 101 N -1.07 0.02 -0.97 1.57 3.08 -1.41 0.17 114.38 115.77 3iam h ARG 101 Ca -0.04 -0.00 0.19 0.00 0.07 0.00 0.00 59.98 60.19 3iam h ARG 101 Cb 0.41 -0.01 -0.11 0.00 0.08 0.00 0.00 29.97 30.35 3iam h ARG 101 CO 0.07 0.02 0.57 1.49 -1.07 0.00 0.00 179.97 181.05 3iam h GLU 102 N 0.03 0.69 0.37 0.04 4.81 -1.17 0.40 114.58 119.73 3iam h GLU 102 Ca 0.24 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.42 3iam h GLU 102 Cb 0.37 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 29.60 3iam h GLU 102 CO -0.49 0.45 -0.18 0.00 -0.73 0.00 0.00 179.01 178.06 3iam h ALA 103 N 1.64 -0.50 -0.92 2.92 0.00 -0.86 -2.98 119.26 118.57 3iam h ALA 103 Ca 0.57 -0.19 0.16 0.00 0.00 0.00 0.00 54.91 55.44 3iam h ALA 103 Cb 0.89 0.19 -0.16 0.00 0.00 0.00 0.00 17.79 18.72 3iam h ALA 103 CO -0.40 -0.57 -0.34 1.96 0.00 0.00 0.00 179.25 179.90 3iam h GLN 104 N -0.91 -0.02 0.00 0.00 4.20 0.18 0.71 115.11 119.27 3iam h GLN 104 Ca -0.05 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.66 3iam h GLN 104 Cb 0.54 0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.32 3iam h GLN 104 CO 0.08 -0.02 0.00 0.00 -0.67 0.00 0.00 178.83 178.23 3iam h ALA 105 N 1.46 1.00 0.02 3.87 0.00 -1.02 -1.27 119.26 123.33 3iam h ALA 105 Ca 0.36 0.00 -0.24 0.00 0.00 0.00 0.00 54.91 55.02 3iam h ALA 105 Cb 0.61 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.37 3iam h ALA 105 CO -0.94 0.00 -1.21 0.78 0.00 0.00 0.00 179.25 177.88 3iam h GLY 106 N 1.66 0.06 1.64 0.00 0.00 0.52 -2.60 103.07 104.36 3iam h GLY 106 Ca 0.00 -0.15 -0.20 0.00 0.00 0.00 0.00 47.33 46.99 3iam h GLY 106 CO 0.00 0.13 -0.82 -0.33 0.00 0.00 0.00 176.54 175.52 3iam h MET 107 N 0.01 0.33 0.16 4.80 2.07 0.08 -1.05 114.93 121.33 3iam h MET 107 Ca -0.10 -0.31 -0.00 0.00 -2.07 0.00 0.00 59.70 57.22 3iam h MET 107 Cb 1.86 0.08 -0.01 0.00 -1.87 0.00 0.00 31.60 31.66 3iam h MET 107 CO 0.13 0.98 -0.11 0.28 1.07 0.00 0.00 176.91 179.26 3iam h VAL 108 N 0.21 0.75 -0.84 -2.22 2.07 -1.45 -2.45 116.25 112.32 3iam h VAL 108 Ca -0.05 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.57 3iam h VAL 108 Cb 1.42 0.75 -0.07 0.00 -1.52 0.00 0.00 31.29 31.86 3iam h VAL 108 CO 0.14 0.00 0.48 -0.08 0.02 0.00 0.00 177.57 178.13 3iam h GLU 109 N -0.28 0.78 -0.15 1.57 4.81 -1.16 -1.53 114.58 118.61 3iam h GLU 109 Ca -0.01 -0.05 -0.14 0.00 -0.13 0.00 0.00 59.36 59.03 3iam h GLU 109 Cb 0.24 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 29.44 3iam h GLU 109 CO 0.00 0.51 -0.50 0.74 -0.73 0.00 0.00 179.01 179.03 3iam h PHE 110 N 0.80 0.50 0.28 0.92 0.04 -1.14 -2.15 116.94 116.19 3iam h PHE 110 Ca 0.41 -0.16 -0.01 0.00 2.80 0.00 0.00 57.97 61.00 3iam h PHE 110 Cb 0.39 -0.10 0.00 0.00 2.20 0.00 0.00 35.95 38.44 3iam h PHE 110 CO -0.06 0.83 -0.13 1.15 -0.60 0.00 0.00 178.31 179.50 3iam h THR 111 N 0.32 0.75 0.00 -1.55 2.02 -0.81 -3.05 112.91 110.60 3iam h THR 111 Ca 0.01 -0.55 0.00 0.00 0.77 0.00 0.00 66.41 66.64 3iam h THR 111 Cb 1.00 1.05 0.00 0.00 -1.74 0.00 0.00 68.15 68.45 3iam h THR 111 CO 0.09 0.11 0.00 0.18 0.37 0.00 0.00 175.52 176.27 3iam n LEU 112 N -5.13 0.63 -0.37 2.58 4.77 -0.76 -3.54 117.00 115.18 3iam n LEU 112 Ca -0.09 0.70 -0.05 0.00 -0.03 0.00 0.00 56.01 56.54 3iam n LEU 112 Cb 0.25 -0.67 -0.02 0.00 -2.33 0.00 0.00 43.42 40.65 3iam n LEU 112 CO 0.31 -0.71 0.49 -0.11 -1.33 0.00 0.00 177.39 176.05 3iam n LEU 113 N -2.25 -0.76 -1.05 2.23 7.94 -0.81 -1.98 117.00 120.32 3iam n LEU 113 Ca 0.01 1.61 0.06 0.00 -1.11 0.00 0.00 56.01 56.58 3iam n LEU 113 Cb 0.16 -0.30 0.26 0.00 0.53 0.00 0.00 43.42 44.07 3iam n LEU 113 CO 0.16 -1.39 0.74 0.59 -1.11 0.00 0.00 177.39 176.38 3iam n ASN 114 N -5.26 3.85 -4.82 1.96 3.02 -1.23 -4.88 115.26 107.89 3iam n ASN 114 Ca 0.06 -3.13 -0.33 0.00 -0.03 0.00 0.00 54.58 51.15 3iam n ASN 114 Cb 0.31 -0.58 -0.07 0.00 -0.61 0.00 0.00 39.78 38.84 3iam n ASN 114 CO 0.00 0.00 0.00 -2.28 -2.62 0.00 0.00 177.26 172.36 3iam s HIS 115 N -2.90 3.33 0.03 3.10 2.46 -0.84 -3.97 115.29 116.50 3iam s HIS 115 Ca 0.44 1.56 -0.27 0.00 0.47 0.00 0.00 55.06 57.26 3iam s HIS 115 Cb 0.36 -2.82 -0.17 0.00 -0.13 0.00 0.00 32.58 29.83 3iam s HIS 115 CO 0.08 -0.11 1.39 -1.00 -2.47 0.00 0.00 174.74 172.64 3iam h PRO 116 N 1.87 -0.48 -0.16 2.88 0.13 -1.89 -3.47 132.00 130.88 3iam h PRO 116 Ca -0.49 0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 3iam h PRO 116 Cb 1.18 0.11 0.00 0.00 0.13 0.00 0.00 31.00 32.42 3iam h PRO 116 CO 0.61 -0.21 0.00 -0.11 -0.23 0.00 0.00 178.00 178.07 3iam n LEU 117 N -5.22 -0.25 -0.33 1.56 7.94 -1.26 -5.02 117.00 114.41 3iam n LEU 117 Ca -0.10 0.00 0.04 0.00 -1.11 0.00 0.00 56.01 54.84 3iam n LEU 117 Cb 0.27 -0.06 0.05 0.00 0.53 0.00 0.00 43.42 44.20 3iam n LEU 117 CO 0.33 0.00 0.42 0.47 -1.11 0.00 0.00 177.39 177.49 3iam n ASP 118 N 0.12 1.84 -0.15 1.96 8.00 -1.26 -4.89 116.55 122.16 3iam n ASP 118 Ca 0.00 -1.46 -0.04 0.00 0.71 0.00 0.00 54.79 54.00 3iam n ASP 118 Cb 0.06 -0.03 -0.04 0.00 -0.02 0.00 0.00 41.12 41.09 3iam n ASP 118 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3iam h PRO 120 N 0.00 0.18 -1.58 0.00 0.13 -1.97 -2.81 132.00 125.94 3iam h PRO 120 Ca 0.06 -0.01 -0.60 0.00 -0.87 0.00 0.00 66.00 64.57 3iam h PRO 120 Cb 0.15 -0.04 -0.23 0.00 0.13 0.00 0.00 31.00 31.01 3iam h PRO 120 CO -0.35 0.12 0.75 -2.37 -0.23 0.00 0.00 178.00 175.92 3iam n THR 121 N -5.18 3.40 -4.14 1.56 5.66 0.20 -4.90 114.28 110.88 3iam n THR 121 Ca 0.07 -3.10 -0.24 0.00 -3.05 0.00 0.00 64.05 57.74 3iam n THR 121 Cb 0.30 -1.30 -0.17 0.00 -1.55 0.00 0.00 70.33 67.61 3iam n THR 121 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3iam h ASP 123 N 7.63 0.00 0.00 0.00 3.32 -1.90 -2.36 116.42 123.10 3iam h ASP 123 Ca -0.31 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.74 3iam h ASP 123 Cb 1.15 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.70 3iam h ASP 123 CO 0.42 0.00 0.00 1.17 -1.72 0.00 0.00 179.24 179.11 3iam n LYS 124 N -2.60 0.61 0.00 3.56 0.00 -1.26 -4.75 118.16 113.71 3iam n LYS 124 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.29 3iam n LYS 124 Cb 0.08 -1.24 0.00 0.00 0.00 0.00 0.00 35.03 33.86 3iam n LYS 124 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3iam n GLY 125 N 0.48 0.00 0.98 3.14 0.00 -0.89 -3.18 105.19 105.73 3iam n GLY 125 Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.12 3iam n GLY 125 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3iam n GLY 126 N 0.00 1.69 1.86 -0.02 0.00 -1.26 -4.41 105.19 103.05 3iam n GLY 126 Ca 0.00 -0.62 -0.17 0.00 0.00 0.00 0.00 46.02 45.22 3iam n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iam n ALA 127 N 1.22 4.86 -3.77 4.61 0.00 -1.19 -4.90 120.51 121.34 3iam n ALA 127 Ca 0.17 -1.87 -0.35 0.00 0.00 0.00 0.00 53.44 51.38 3iam n ALA 127 Cb 0.53 -1.36 -0.13 0.00 0.00 0.00 0.00 19.45 18.49 3iam n ALA 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3iam h GLU 129 N 7.96 0.00 0.37 0.00 5.08 -1.83 -1.94 114.58 124.22 3iam h GLU 129 Ca -0.14 -0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.20 3iam h GLU 129 Cb 1.05 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.30 3iam h GLU 129 CO 0.61 0.00 -0.18 1.25 -1.00 0.00 0.00 179.01 179.70 3iam h LEU 130 N 0.00 -0.42 -0.61 1.33 5.85 -1.94 -0.97 115.31 118.55 3iam h LEU 130 Ca 0.87 -0.01 0.05 0.00 0.84 0.00 0.00 57.88 59.64 3iam h LEU 130 Cb 2.63 0.11 -0.07 0.00 0.37 0.00 0.00 40.66 43.70 3iam h LEU 130 CO -0.58 0.02 -0.36 0.00 -0.34 0.00 0.00 178.44 177.18 3iam n GLN 131 N -5.11 -0.27 0.27 1.25 6.02 -0.94 -0.85 117.38 117.75 3iam n GLN 131 Ca -0.07 0.98 -0.12 0.00 -0.01 0.00 0.00 57.00 57.78 3iam n GLN 131 Cb 0.21 -1.44 -0.06 0.00 1.02 0.00 0.00 30.24 29.97 3iam n GLN 131 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 177.06 175.61 3iam h ASP 132 N 0.00 -0.73 -1.01 1.08 5.19 -1.34 -2.71 116.42 116.90 3iam h ASP 132 Ca 0.10 0.04 0.24 0.00 -0.62 0.00 0.00 57.03 56.78 3iam h ASP 132 Cb 0.25 0.21 -0.09 0.00 0.18 0.00 0.00 39.33 39.88 3iam h ASP 132 CO -0.57 -0.46 0.64 0.03 -3.12 0.00 0.00 179.24 175.76 3iam h ARG 133 N -0.73 0.46 -0.95 3.56 -0.00 -0.94 -0.52 114.38 115.25 3iam h ARG 133 Ca -0.07 -0.03 0.07 0.00 -0.50 0.00 0.00 59.98 59.45 3iam h ARG 133 Cb 0.58 -0.10 -0.07 0.00 0.00 0.00 0.00 29.97 30.38 3iam h ARG 133 CO 0.07 0.30 0.60 1.15 0.00 0.00 0.00 179.97 182.10 3iam h THR 134 N 0.47 1.06 -0.01 2.04 2.02 -0.67 0.37 112.91 118.20 3iam h THR 134 Ca 0.57 -0.37 0.00 0.00 0.77 0.00 0.00 66.41 67.38 3iam h THR 134 Cb 1.32 -0.13 0.00 0.00 -1.74 0.00 0.00 68.15 67.60 3iam h THR 134 CO -0.30 0.20 -0.22 0.55 0.37 0.00 0.00 175.52 176.12 3iam n VAL 135 N -4.56 0.00 -0.05 3.16 3.14 -0.26 -0.83 118.33 118.93 3iam n VAL 135 Ca 0.15 -0.10 -0.12 0.00 -2.96 0.00 0.00 64.34 61.30 3iam n VAL 135 Cb 0.20 0.23 -0.14 0.00 -1.06 0.00 0.00 33.84 33.07 3iam n VAL 135 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 3iam n GLU 136 N -0.79 0.67 0.00 1.45 1.02 -0.02 -4.67 120.64 118.30 3iam n GLU 136 Ca 0.12 0.18 0.00 0.00 -0.02 0.00 0.00 57.16 57.45 3iam n GLU 136 Cb 0.33 -1.67 0.00 0.00 -0.02 0.00 0.00 31.44 30.08 3iam n GLU 136 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 3iam n TYR 137 N -3.06 0.00 -1.36 -0.32 4.02 -0.36 -5.08 117.16 110.99 3iam n TYR 137 Ca -0.28 0.00 -0.28 0.00 -0.01 0.00 0.00 57.90 57.33 3iam n TYR 137 Cb 1.08 0.00 0.22 0.00 -0.02 0.00 0.00 39.34 40.62 3iam n TYR 137 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3iam n GLY 138 N 0.42 -2.26 3.55 2.72 0.00 -0.01 -3.70 105.19 105.92 3iam n GLY 138 Ca 0.00 -1.58 -0.18 0.00 0.00 0.00 0.00 46.02 44.26 3iam n GLY 138 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3iam n LEU 139 N 0.00 -3.56 -4.46 0.99 4.77 -1.26 -4.86 117.00 108.62 3iam n LEU 139 Ca 0.15 -0.69 -0.40 0.00 -0.03 0.00 0.00 56.01 55.04 3iam n LEU 139 Cb 0.56 -2.26 0.02 0.00 -2.33 0.00 0.00 43.42 39.41 3iam n LEU 139 CO 0.39 -0.09 0.05 0.00 -1.33 0.00 0.00 177.39 176.41 3iam n TYR 140 N -2.58 -0.65 -3.44 -1.77 9.36 -1.26 -4.94 117.16 111.88 3iam n TYR 140 Ca -0.19 0.51 -0.37 0.00 3.32 0.00 0.00 57.90 61.17 3iam n TYR 140 Cb 0.62 -1.97 -0.04 0.00 -0.63 0.00 0.00 39.34 37.32 3iam n TYR 140 CO 0.00 0.00 0.00 -1.91 0.22 0.00 0.00 176.86 175.17 3iam n GLU 141 N 0.32 3.11 -2.22 2.98 2.13 -1.26 -5.05 120.64 120.65 3iam n GLU 141 Ca 0.11 -4.52 -0.42 0.00 0.66 0.00 0.00 57.16 52.99 3iam n GLU 141 Cb 0.44 -2.43 -0.03 0.00 0.27 0.00 0.00 31.44 29.69 3iam n GLU 141 CO 0.00 0.00 0.00 -1.59 -0.41 0.00 0.00 177.13 175.13 3iam s LYS 142 N -1.81 4.30 -0.18 5.31 0.00 -1.26 -5.15 119.74 120.96 3iam s LYS 142 Ca 0.31 1.99 0.00 0.00 0.00 0.00 0.00 55.97 58.27 3iam s LYS 142 Cb -0.02 -3.47 0.04 0.00 0.00 0.00 0.00 37.83 34.37 3iam s LYS 142 CO -0.06 -0.52 -0.09 0.71 0.00 0.00 0.00 175.35 175.39 3iam s TYR 143 N 1.97 2.10 0.00 1.78 4.12 -1.26 -5.26 117.35 120.80 3iam s TYR 143 Ca 0.64 -1.33 0.00 0.00 0.02 0.00 0.00 57.07 56.40 3iam s TYR 143 Cb -0.33 -1.50 0.00 0.00 -1.52 0.00 0.00 41.96 38.61 3iam s TYR 143 CO 0.28 -0.68 0.00 0.39 0.02 0.00 0.00 175.55 175.56 3iam n GLU 150 N 4.77 0.00 -1.50 -0.62 4.71 -1.26 -5.29 120.64 121.46 3iam n GLU 150 Ca -0.14 0.00 -0.48 0.00 -0.01 0.00 0.00 57.16 56.53 3iam n GLU 150 Cb 0.48 0.00 -0.03 0.00 -1.01 0.00 0.00 31.44 30.87 3iam n GLU 150 CO 0.00 0.00 0.00 1.28 0.09 0.00 0.00 177.13 178.50 3iam n LEU 151 N 0.00 0.31 -4.74 -4.62 4.77 -1.26 -4.91 117.00 106.55 3iam n LEU 151 Ca 0.00 1.15 -0.41 0.00 -0.03 0.00 0.00 56.01 56.72 3iam n LEU 151 Cb 0.00 -1.10 -0.05 0.00 -2.33 0.00 0.00 43.42 39.95 3iam n LEU 151 CO 0.00 -2.07 0.69 -2.16 -1.33 0.00 0.00 177.39 172.52 3iam s PRO 152 N -0.90 4.72 -0.40 3.23 0.04 -1.26 -5.03 135.00 135.40 3iam s PRO 152 Ca 0.67 1.53 -0.20 0.00 0.04 0.00 0.00 61.00 63.05 3iam s PRO 152 Cb -0.89 -3.32 0.01 0.00 0.04 0.00 0.00 34.50 30.35 3iam s PRO 152 CO 0.56 0.28 0.59 0.08 0.04 0.00 0.00 177.00 178.55 3iam s VAL 153 N -0.45 4.91 -0.03 -0.36 1.01 -1.26 -4.93 120.40 119.29 3iam s VAL 153 Ca 0.46 0.19 -0.21 0.00 0.00 0.00 0.00 61.98 62.41 3iam s VAL 153 Cb -0.26 -4.11 -0.28 0.00 0.00 0.00 0.00 36.38 31.73 3iam s VAL 153 CO 0.32 -0.45 0.97 1.88 0.00 0.00 0.00 175.10 177.82 3iam h TYR 154 N 8.70 0.55 -3.26 5.22 0.05 -2.04 -3.45 116.97 122.75 3iam h TYR 154 Ca -0.26 -0.36 -0.45 0.00 0.05 0.00 0.00 58.73 57.71 3iam h TYR 154 Cb 1.11 -0.04 -0.38 0.00 1.01 0.00 0.00 36.73 38.43 3iam h TYR 154 CO 0.72 1.23 -0.77 -0.08 -1.05 0.00 0.00 178.16 178.21 3iam s THR 155 N -2.74 0.47 -0.06 -2.88 -1.32 -1.26 -5.01 115.64 102.84 3iam s THR 155 Ca -0.14 0.05 -0.13 0.00 -1.21 0.00 0.00 61.69 60.26 3iam s THR 155 Cb 0.02 -0.60 -0.30 0.00 -1.51 0.00 0.00 72.50 70.11 3iam s THR 155 CO 0.82 0.27 0.65 0.03 -2.21 0.00 0.00 174.62 174.18 3iam h ARG 156 N 8.24 0.35 -6.49 7.08 2.47 -1.98 -3.46 114.38 120.59 3iam h ARG 156 Ca -0.22 -0.59 -0.53 0.00 -1.26 0.00 0.00 59.98 57.38 3iam h ARG 156 Cb 1.13 0.22 0.03 0.00 -1.65 0.00 0.00 29.97 29.70 3iam h ARG 156 CO 0.29 1.28 1.05 0.12 0.56 0.00 0.00 179.97 183.28 3iam s PHE 157 N -2.54 2.32 -0.34 3.04 5.36 -1.26 -4.94 117.98 119.62 3iam s PHE 157 Ca -0.17 0.16 0.16 0.00 -0.96 0.00 0.00 56.93 56.12 3iam s PHE 157 Cb 0.05 -4.08 0.45 0.00 -0.34 0.00 0.00 43.02 39.10 3iam s PHE 157 CO 0.83 -4.37 0.95 -0.85 -1.46 0.00 0.00 175.22 170.31 3iam n GLU 158 N 5.51 1.39 -4.45 10.12 0.28 -1.26 -5.08 120.64 127.16 3iam n GLU 158 Ca 0.17 -3.41 -0.23 0.00 -0.16 0.00 0.00 57.16 53.52 3iam n GLU 158 Cb 0.39 -1.40 -0.09 0.00 1.43 0.00 0.00 31.44 31.78 3iam n GLU 158 CO 0.00 0.00 0.00 -0.06 -0.16 0.00 0.00 177.13 176.91 3iam s PHE 159 N -3.11 1.76 0.28 -1.84 0.40 -1.26 -5.11 117.98 109.08 3iam s PHE 159 Ca 0.31 -1.29 -0.30 0.00 -0.60 0.00 0.00 56.93 55.04 3iam s PHE 159 Cb 0.44 -1.07 -0.11 0.00 0.51 0.00 0.00 43.02 42.80 3iam s PHE 159 CO 0.00 -0.36 1.54 0.99 0.70 0.00 0.00 175.22 178.10 3iam s THR 160 N -3.33 2.27 0.32 0.64 2.01 -1.26 -5.01 115.64 111.28 3iam s THR 160 Ca 0.29 0.23 -0.03 0.00 0.31 0.00 0.00 61.69 62.49 3iam s THR 160 Cb 0.04 -3.15 0.07 0.00 0.01 0.00 0.00 72.50 69.47 3iam s THR 160 CO 0.16 0.04 0.44 0.54 -0.69 0.00 0.00 174.62 175.11 3iam n ARG 161 N 2.27 -0.08 -2.87 4.92 1.74 -1.26 -4.98 116.66 116.41 3iam n ARG 161 Ca 0.08 -0.90 -0.43 0.00 -0.77 0.00 0.00 57.85 55.82 3iam n ARG 161 Cb 0.38 -0.38 -0.02 0.00 -1.02 0.00 0.00 32.46 31.42 3iam n ARG 161 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 3iam s ARG 162 N -3.76 3.65 0.02 5.56 3.52 -1.25 -5.00 118.95 121.69 3iam s ARG 162 Ca 0.27 -1.75 -0.26 0.00 -0.13 0.00 0.00 55.73 53.86 3iam s ARG 162 Cb -0.01 -5.01 -0.05 0.00 -1.56 0.00 0.00 34.95 28.33 3iam s ARG 162 CO 0.18 -1.84 0.80 -1.01 -0.81 0.00 0.00 175.30 172.62 3iam s HIS 163 N 2.94 3.69 0.00 5.12 3.76 -1.26 -4.81 115.29 124.73 3iam s HIS 163 Ca 0.36 1.48 0.00 0.00 -0.15 0.00 0.00 55.06 56.75 3iam s HIS 163 Cb -0.04 -2.89 0.00 0.00 1.11 0.00 0.00 32.58 30.77 3iam s HIS 163 CO -0.08 0.18 0.00 1.33 -0.85 0.00 0.00 174.74 175.31 3iam n VAL 164 N 3.22 0.00 -1.78 -0.90 0.24 -1.26 -5.09 118.33 112.76 3iam n VAL 164 Ca -0.00 0.00 -0.42 0.00 -2.04 0.00 0.00 64.34 61.88 3iam n VAL 164 Cb 0.50 0.00 -0.02 0.00 -1.47 0.00 0.00 33.84 32.85 3iam n VAL 164 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 3iam s ASP 165 N 1.75 6.39 0.09 -1.34 2.15 -1.26 -4.86 116.67 119.59 3iam s ASP 165 Ca 0.00 2.90 0.04 0.00 0.43 0.00 0.00 52.55 55.91 3iam s ASP 165 Cb 0.00 -2.62 -0.04 0.00 -0.30 0.00 0.00 42.92 39.96 3iam s ASP 165 CO 0.00 -0.92 -0.10 -0.75 -0.17 0.00 0.00 175.17 173.23 3iam s LYS 166 N 0.17 0.84 -1.12 4.34 2.20 -1.26 -3.08 119.74 121.82 3iam s LYS 166 Ca 0.68 -1.15 -0.28 0.00 -0.36 0.00 0.00 55.97 54.86 3iam s LYS 166 Cb -0.48 -0.52 0.04 0.00 -1.51 0.00 0.00 37.83 35.36 3iam s LYS 166 CO 0.41 0.08 0.65 -2.39 -0.36 0.00 0.00 175.35 173.75 3iam n HIS 167 N 0.58 -1.47 -4.10 4.03 1.44 -1.23 -4.95 115.22 109.52 3iam n HIS 167 Ca -0.16 0.20 -0.34 0.00 -2.01 0.00 0.00 57.72 55.41 3iam n HIS 167 Cb 0.58 -2.70 -0.15 0.00 0.12 0.00 0.00 29.99 27.83 3iam n HIS 167 CO 0.00 0.00 0.00 -1.58 -2.81 0.00 0.00 176.34 171.95 3iam s HIS 168 N -3.44 2.83 -0.18 -1.40 5.04 -0.31 -4.92 115.29 112.92 3iam s HIS 168 Ca 0.39 -1.39 -0.29 0.00 -1.54 0.00 0.00 55.06 52.23 3iam s HIS 168 Cb -0.22 -1.97 -0.02 0.00 0.04 0.00 0.00 32.58 30.42 3iam s HIS 168 CO 0.95 -0.71 1.31 -1.25 -2.34 0.00 0.00 174.74 172.70 3iam s PRO 169 N 1.30 4.17 0.14 2.88 0.04 -1.26 0.15 135.00 142.42 3iam s PRO 169 Ca 0.04 1.64 -0.08 0.00 0.04 0.00 0.00 61.00 62.65 3iam s PRO 169 Cb -0.14 -3.80 -0.05 0.00 0.04 0.00 0.00 34.50 30.55 3iam s PRO 169 CO -0.09 -0.79 1.38 -0.07 0.04 0.00 0.00 177.00 177.47 3iam h LEU 170 N 9.98 0.76 0.00 -3.56 3.38 -1.46 -3.47 115.31 120.93 3iam h LEU 170 Ca -0.27 -0.48 -0.22 0.00 0.09 0.00 0.00 57.88 56.99 3iam h LEU 170 Cb 1.11 -0.22 -0.06 0.00 0.09 0.00 0.00 40.66 41.58 3iam h LEU 170 CO 0.98 1.26 -0.21 -1.54 0.09 0.00 0.00 178.44 179.01 3iam n SER 171 N -3.91 -0.34 0.00 -0.43 3.41 -1.11 -4.54 113.62 106.70 3iam n SER 171 Ca -0.06 -2.02 0.10 0.00 -0.26 0.00 0.00 58.87 56.63 3iam n SER 171 Cb 0.71 0.80 0.50 0.00 -0.26 0.00 0.00 64.21 65.96 3iam n SER 171 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 3iam n PRO 172 N -0.29 0.28 -0.00 4.33 -0.04 -1.26 -3.60 135.00 134.42 3iam n PRO 172 Ca 0.04 0.10 0.00 0.00 -0.04 0.00 0.00 63.50 63.59 3iam n PRO 172 Cb 0.28 -1.50 -0.00 0.00 -0.04 0.00 0.00 33.50 32.24 3iam n PRO 172 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 3iam n PHE 173 N -1.29 0.00 -4.02 0.54 0.99 -1.26 -4.57 117.46 107.85 3iam n PHE 173 Ca 0.09 0.00 -0.13 0.00 -0.00 0.00 0.00 57.45 57.41 3iam n PHE 173 Cb 0.16 -0.00 -0.13 0.00 -1.00 0.00 0.00 39.48 38.50 3iam n PHE 173 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.76 176.84 3iam s VAL 174 N -1.24 0.24 -0.08 -4.37 1.01 -1.24 -1.64 120.40 113.08 3iam s VAL 174 Ca 0.00 -0.36 -0.00 0.00 0.00 0.00 0.00 61.98 61.62 3iam s VAL 174 Cb 0.00 -0.25 0.03 0.00 0.00 0.00 0.00 36.38 36.16 3iam s VAL 174 CO 0.01 -0.08 -0.04 -0.51 0.00 0.00 0.00 175.10 174.48 3iam s ILE 175 N -0.44 0.66 -0.18 2.22 2.07 -0.54 -1.09 121.20 123.89 3iam s ILE 175 Ca -0.03 -0.08 -0.10 0.00 -1.41 0.00 0.00 60.65 59.02 3iam s ILE 175 Cb -0.04 -0.74 -0.05 0.00 0.13 0.00 0.00 42.46 41.77 3iam s ILE 175 CO -0.00 0.30 0.16 -0.22 -1.91 0.00 0.00 174.94 173.27 3iam s LEU 176 N 1.65 4.24 -0.36 8.50 2.96 0.39 -2.31 118.68 133.75 3iam s LEU 176 Ca 0.02 0.32 0.03 0.00 -0.22 0.00 0.00 54.13 54.27 3iam s LEU 176 Cb -0.13 -2.14 0.10 0.00 0.50 0.00 0.00 46.19 44.53 3iam s LEU 176 CO -0.05 0.20 0.08 -0.62 -1.32 0.00 0.00 176.35 174.64 3iam s ASP 177 N 0.17 4.82 0.19 3.68 -1.08 0.90 -1.16 116.67 124.19 3iam s ASP 177 Ca 0.10 -2.18 -0.09 0.00 -0.52 0.00 0.00 52.55 49.86 3iam s ASP 177 Cb -0.12 -1.66 0.10 0.00 -1.46 0.00 0.00 42.92 39.78 3iam s ASP 177 CO -0.00 -0.40 1.70 0.03 0.52 0.00 0.00 175.17 177.02 3iam h ARG 178 N 7.62 1.08 -0.88 4.34 3.08 -1.85 -2.75 114.38 125.02 3iam h ARG 178 Ca -0.05 -0.26 0.12 0.00 0.07 0.00 0.00 59.98 59.85 3iam h ARG 178 Cb 1.02 -0.14 -0.08 0.00 0.08 0.00 0.00 29.97 30.85 3iam h ARG 178 CO 0.55 0.96 0.50 0.93 -1.07 0.00 0.00 179.97 181.85 3iam h GLU 179 N 1.00 0.76 -0.36 0.04 5.08 -1.87 -3.03 114.58 116.20 3iam h GLU 179 Ca 0.21 -0.05 -0.17 0.00 -1.00 0.00 0.00 59.36 58.35 3iam h GLU 179 Cb 0.38 -0.17 -0.00 0.00 0.50 0.00 0.00 28.75 29.45 3iam h GLU 179 CO 0.00 0.50 -0.44 0.00 -1.00 0.00 0.00 179.01 178.08 3iam h ARG 180 N 0.78 0.93 -5.51 2.33 3.08 -1.82 -3.41 114.38 110.76 3iam h ARG 180 Ca 0.44 -0.52 -0.74 0.00 0.07 0.00 0.00 59.98 59.24 3iam h ARG 180 Cb 0.49 0.03 0.04 0.00 0.08 0.00 0.00 29.97 30.62 3iam h ARG 180 CO -0.29 1.17 0.14 0.00 -1.07 0.00 0.00 179.97 179.92 3iam n ILE 182 N 1.70 1.69 -1.27 0.00 -5.35 -1.26 -4.98 119.36 109.89 3iam n ILE 182 Ca 0.20 -1.41 -0.09 0.00 -0.27 0.00 0.00 62.75 61.17 3iam n ILE 182 Cb 0.06 0.12 -0.04 0.00 -1.74 0.00 0.00 39.64 38.03 3iam n ILE 182 CO 0.00 0.00 0.00 1.41 -1.76 0.00 0.00 176.55 176.20 3iam n HIS 183 N 0.14 0.00 -1.69 4.28 8.25 -1.26 -4.95 115.22 119.99 3iam n HIS 183 Ca 0.18 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.21 3iam n HIS 183 Cb 0.70 -2.24 -0.03 0.00 1.12 0.00 0.00 29.99 29.53 3iam n HIS 183 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3iam n LYS 185 N 5.46 0.52 -0.07 0.00 4.81 -1.26 -4.46 118.16 123.16 3iam n LYS 185 Ca 0.18 0.00 -0.07 0.00 -0.87 0.00 0.00 58.31 57.55 3iam n LYS 185 Cb 0.36 -1.18 -0.01 0.00 0.02 0.00 0.00 35.03 34.23 3iam n LYS 185 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3iam h ARG 186 N 0.33 -0.17 0.38 1.64 3.08 -1.87 -1.51 114.38 116.27 3iam h ARG 186 Ca 0.00 0.01 -0.02 0.00 0.07 0.00 0.00 59.98 60.04 3iam h ARG 186 Cb 0.18 0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.27 3iam h ARG 186 CO 0.00 -0.11 -0.18 0.00 -1.07 0.00 0.00 179.97 178.61 3iam h VAL 188 N -0.92 0.86 -0.93 0.00 -1.51 -1.79 -0.40 116.25 111.56 3iam h VAL 188 Ca -0.05 -0.17 0.03 0.00 -1.23 0.00 0.00 66.70 65.27 3iam h VAL 188 Cb 0.54 0.31 -0.05 0.00 -2.13 0.00 0.00 31.29 29.96 3iam h VAL 188 CO 0.09 0.09 0.61 -0.09 -1.23 0.00 0.00 177.57 177.04 3iam h ARG 189 N 0.51 1.15 -0.20 5.19 2.43 -1.24 -2.57 114.38 119.64 3iam h ARG 189 Ca 0.29 -0.07 -0.06 0.00 -0.81 0.00 0.00 59.98 59.33 3iam h ARG 189 Cb 0.28 -0.26 -0.00 0.00 -0.42 0.00 0.00 29.97 29.57 3iam h ARG 189 CO -0.24 0.76 -0.13 -0.92 -1.51 0.00 0.00 179.97 177.93 3iam h TYR 190 N 1.18 0.52 -0.59 2.20 3.20 0.42 -2.81 116.97 121.09 3iam h TYR 190 Ca 0.37 -0.14 0.04 0.00 3.14 0.00 0.00 58.73 62.14 3iam h TYR 190 Cb -0.02 -0.12 -0.04 0.00 1.54 0.00 0.00 36.73 38.09 3iam h TYR 190 CO -0.01 0.75 0.34 0.74 -1.64 0.00 0.00 178.16 178.34 3iam h PHE 191 N 0.13 0.63 -0.08 -3.82 0.04 -0.73 -0.56 116.94 112.55 3iam h PHE 191 Ca 0.04 0.02 -0.01 0.00 2.80 0.00 0.00 57.97 60.82 3iam h PHE 191 Cb 0.63 -0.20 -0.00 0.00 2.20 0.00 0.00 35.95 38.58 3iam h PHE 191 CO 0.07 0.34 0.01 1.05 -0.60 0.00 0.00 178.31 179.18 3iam h GLU 192 N 0.66 0.13 0.09 1.51 -0.00 -1.51 -0.07 114.58 115.38 3iam h GLU 192 Ca 0.25 -0.03 -0.00 0.00 -0.00 0.00 0.00 59.36 59.57 3iam h GLU 192 Cb 0.09 -0.02 0.00 0.00 -0.00 0.00 0.00 28.75 28.82 3iam h GLU 192 CO -0.13 0.34 -0.04 0.93 -0.00 0.00 0.00 179.01 180.10 3iam h GLU 193 N -0.10 -0.12 0.00 1.06 5.08 -1.19 -3.24 114.58 116.07 3iam h GLU 193 Ca 0.02 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 3iam h GLU 193 Cb 0.27 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.55 3iam h GLU 193 CO 0.00 0.41 -0.05 0.28 -1.00 0.00 0.00 179.01 178.65 3iam h VAL 194 N -0.85 0.00 0.12 3.13 2.07 -1.29 -3.40 116.25 116.02 3iam h VAL 194 Ca -0.01 -0.49 -0.16 0.00 0.82 0.00 0.00 66.70 66.86 3iam h VAL 194 Cb 0.58 0.00 0.02 0.00 -1.52 0.00 0.00 31.29 30.37 3iam h VAL 194 CO 0.02 0.00 -0.71 -0.65 0.02 0.00 0.00 177.57 176.26 3iam h PRO 195 N -0.49 0.27 0.00 1.57 0.11 -1.71 -3.43 132.00 128.32 3iam h PRO 195 Ca 0.00 -0.45 0.00 0.00 0.11 0.00 0.00 66.00 65.66 3iam h PRO 195 Cb 0.05 0.16 0.00 0.00 0.11 0.00 0.00 31.00 31.32 3iam h PRO 195 CO 0.00 1.21 0.00 0.41 -0.21 0.00 0.00 178.00 179.41 3iam n GLY 196 N 1.63 1.87 2.95 -0.55 0.00 -0.38 -4.98 105.19 105.73 3iam n GLY 196 Ca -0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.58 3iam n GLY 196 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3iam s ASP 197 N -2.00 4.54 -0.98 1.61 1.01 -0.18 -4.90 116.67 115.77 3iam s ASP 197 Ca 0.00 -2.22 -0.21 0.00 0.71 0.00 0.00 52.55 50.83 3iam s ASP 197 Cb 0.00 -1.49 -0.11 0.00 1.01 0.00 0.00 42.92 42.34 3iam s ASP 197 CO 0.00 -0.36 1.95 -0.62 0.21 0.00 0.00 175.17 176.35 3iam n GLU 198 N 4.15 1.78 -0.07 8.23 1.02 -1.26 -4.56 120.64 129.92 3iam n GLU 198 Ca 0.03 -2.18 0.08 0.00 -0.02 0.00 0.00 57.16 55.08 3iam n GLU 198 Cb 0.40 -3.20 0.11 0.00 -0.02 0.00 0.00 31.44 28.74 3iam n GLU 198 CO 0.00 0.00 0.00 1.33 1.18 0.00 0.00 177.13 179.64 3iam n VAL 199 N 6.40 0.28 -3.79 2.62 0.24 -1.26 -4.90 118.33 117.92 3iam n VAL 199 Ca 0.49 -0.64 -0.13 0.00 -2.04 0.00 0.00 64.34 62.02 3iam n VAL 199 Cb 0.42 1.11 -0.13 0.00 -1.47 0.00 0.00 33.84 33.78 3iam n VAL 199 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 3iam s LEU 200 N -1.28 1.08 0.16 1.34 2.96 -1.26 -4.58 118.68 117.09 3iam s LEU 200 Ca 0.24 0.40 -0.24 0.00 -0.22 0.00 0.00 54.13 54.31 3iam s LEU 200 Cb 0.15 0.64 0.06 0.00 0.50 0.00 0.00 46.19 47.54 3iam s LEU 200 CO 0.22 -0.09 0.70 -0.62 -1.32 0.00 0.00 176.35 175.23 3iam s ASP 201 N 0.40 -0.44 0.72 3.68 2.15 -1.08 -4.52 116.67 117.58 3iam s ASP 201 Ca -0.02 -0.16 -0.11 0.00 0.43 0.00 0.00 52.55 52.68 3iam s ASP 201 Cb -0.04 0.59 0.03 0.00 -0.30 0.00 0.00 42.92 43.20 3iam s ASP 201 CO -0.02 -0.99 1.08 -0.36 -0.17 0.00 0.00 175.17 174.71 3iam s PHE 202 N -3.66 2.78 0.00 -5.34 0.08 -1.26 -2.44 117.98 108.14 3iam s PHE 202 Ca 0.05 1.51 0.00 0.00 0.12 0.00 0.00 56.93 58.61 3iam s PHE 202 Cb -0.02 -3.01 0.00 0.00 -0.57 0.00 0.00 43.02 39.42 3iam s PHE 202 CO -0.07 -1.56 0.00 -0.89 -0.10 0.00 0.00 175.22 172.60 3iam n ILE 203 N -3.16 0.00 -0.70 0.64 2.08 -0.21 -4.89 119.36 113.11 3iam n ILE 203 Ca 0.09 0.00 -0.30 0.00 0.56 0.00 0.00 62.75 63.09 3iam n ILE 203 Cb 0.53 0.00 0.27 0.00 -0.75 0.00 0.00 39.64 39.69 3iam n ILE 203 CO 0.00 0.00 0.00 -1.61 0.56 0.00 0.00 176.55 175.50 3iam s GLU 204 N 1.99 -2.12 0.47 0.38 2.02 -1.26 -4.85 118.70 115.32 3iam s GLU 204 Ca 0.00 0.06 0.07 0.00 0.02 0.00 0.00 54.97 55.12 3iam s GLU 204 Cb 0.00 -1.48 0.07 0.00 0.10 0.00 0.00 34.13 32.83 3iam s GLU 204 CO 0.00 -4.33 0.62 2.89 0.02 0.00 0.00 175.26 174.46 3iam n ARG 205 N -5.22 0.69 0.00 1.61 1.85 -1.26 -4.06 116.66 110.27 3iam n ARG 205 Ca 0.13 -2.60 0.00 0.00 -1.00 0.00 0.00 57.85 54.37 3iam n ARG 205 Cb 0.60 -0.14 0.00 0.00 -1.05 0.00 0.00 32.46 31.87 3iam n ARG 205 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 3iam n GLY 206 N -0.77 1.97 0.00 2.89 0.00 -1.26 -2.55 105.19 105.47 3iam n GLY 206 Ca 0.12 -0.59 0.13 0.00 0.00 0.00 0.00 46.02 45.68 3iam n GLY 206 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3iam n VAL 207 N 0.00 0.00 0.21 1.61 0.24 -1.26 -3.58 118.33 115.55 3iam n VAL 207 Ca 0.00 0.00 0.10 0.00 -2.04 0.00 0.00 64.34 62.40 3iam n VAL 207 Cb 0.00 -0.48 0.19 0.00 -1.47 0.00 0.00 33.84 32.08 3iam n VAL 207 CO 0.00 0.00 0.00 1.41 -2.14 0.00 0.00 176.83 176.10 3iam n HIS 208 N -0.94 0.46 -2.86 6.34 8.25 -1.06 -5.01 115.22 120.40 3iam n HIS 208 Ca 0.20 -0.27 -0.36 0.00 -0.26 0.00 0.00 57.72 57.02 3iam n HIS 208 Cb 0.09 -0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.13 3iam n HIS 208 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 3iam s THR 209 N -1.32 4.32 0.27 1.59 -4.23 -1.23 -4.57 115.64 110.47 3iam s THR 209 Ca 0.34 1.65 -0.05 0.00 -1.18 0.00 0.00 61.69 62.45 3iam s THR 209 Cb 0.20 -3.92 -0.01 0.00 1.34 0.00 0.00 72.50 70.10 3iam s THR 209 CO 0.27 0.09 0.36 0.72 -0.54 0.00 0.00 174.62 175.52 3iam s PHE 210 N -1.68 0.92 -0.03 3.99 -0.12 -1.26 -4.92 117.98 114.88 3iam s PHE 210 Ca 0.50 -1.16 -0.07 0.00 -0.05 0.00 0.00 56.93 56.15 3iam s PHE 210 Cb -0.17 -0.18 -0.05 0.00 -0.63 0.00 0.00 43.02 41.99 3iam s PHE 210 CO 0.22 -0.93 0.24 0.42 -0.05 0.00 0.00 175.22 175.12 3iam s ILE 211 N -3.72 5.34 0.06 -4.49 -1.09 -1.26 -1.04 121.20 115.00 3iam s ILE 211 Ca 0.31 0.22 -0.27 0.00 -2.23 0.00 0.00 60.65 58.68 3iam s ILE 211 Cb 0.02 -3.53 0.09 0.00 -1.58 0.00 0.00 42.46 37.45 3iam s ILE 211 CO 0.15 0.46 0.91 -0.83 -1.23 0.00 0.00 174.94 174.40 3iam s GLY 212 N -1.47 -0.38 0.10 6.18 0.00 -1.02 -4.95 107.32 105.78 3iam s GLY 212 Ca 0.24 0.65 0.04 0.00 0.00 0.00 0.00 44.72 45.65 3iam s GLY 212 CO 0.13 0.20 -0.11 -1.08 0.00 0.00 0.00 173.10 172.24 3iam s THR 213 N -3.19 1.01 0.00 0.90 -1.32 -1.26 -2.62 115.64 109.16 3iam s THR 213 Ca 0.08 -1.67 0.00 0.00 -1.21 0.00 0.00 61.69 58.89 3iam s THR 213 Cb -0.01 -1.41 0.00 0.00 -1.51 0.00 0.00 72.50 69.57 3iam s THR 213 CO -0.05 -0.54 0.51 0.23 -2.21 0.00 0.00 174.62 172.56 3iam n MET 214 N 0.52 0.00 -0.82 7.08 2.81 -1.26 -4.68 117.12 120.78 3iam n MET 214 Ca -0.16 -0.60 0.05 0.00 -1.81 0.00 0.00 57.70 55.19 3iam n MET 214 Cb 0.58 -0.88 0.36 0.00 -0.71 0.00 0.00 33.22 32.56 3iam n MET 214 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 3iam n ASP 215 N -0.10 5.15 0.00 7.83 9.92 -1.26 -4.98 116.55 133.11 3iam n ASP 215 Ca 0.00 -3.02 0.00 0.00 -0.53 0.00 0.00 54.79 51.24 3iam n ASP 215 Cb 0.12 -0.66 0.00 0.00 -0.64 0.00 0.00 41.12 39.94 3iam n ASP 215 CO 0.00 0.00 0.00 0.49 0.13 0.00 0.00 177.20 177.82 3iam n PHE 216 N 0.22 0.00 -0.30 1.24 0.99 -1.26 -2.03 117.46 116.32 3iam n PHE 216 Ca 0.28 0.00 0.34 0.00 -0.00 0.00 0.00 57.45 58.07 3iam n PHE 216 Cb 1.16 0.00 0.63 0.00 -1.00 0.00 0.00 39.48 40.27 3iam n PHE 216 CO 0.00 0.00 0.00 0.78 -0.00 0.00 0.00 176.76 177.54 3iam h GLY 217 N 0.00 0.00 -4.92 1.37 0.00 -1.94 -3.43 103.07 94.16 3iam h GLY 217 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 47.33 47.15 3iam h GLY 217 CO 0.00 0.00 -0.60 1.04 0.00 0.00 0.00 176.54 176.98 3iam n LEU 218 N -3.63 -4.97 -0.11 3.11 7.99 -0.86 -4.66 117.00 113.88 3iam n LEU 218 Ca 0.26 -0.50 0.13 0.00 -0.01 0.00 0.00 56.01 55.88 3iam n LEU 218 Cb 1.45 -2.65 0.50 0.00 -0.11 0.00 0.00 43.42 42.61 3iam n LEU 218 CO 0.32 -0.02 1.19 -0.65 -1.51 0.00 0.00 177.39 176.72 3iam h PRO 219 N -0.72 0.40 -6.91 3.23 0.11 -1.87 -3.45 132.00 122.78 3iam h PRO 219 Ca -0.43 -0.02 -0.56 0.00 0.11 0.00 0.00 66.00 65.09 3iam h PRO 219 Cb 1.22 -0.09 0.15 0.00 0.11 0.00 0.00 31.00 32.39 3iam h PRO 219 CO 0.33 0.26 0.34 0.45 -0.21 0.00 0.00 178.00 179.18 3iam n SER 220 N -4.47 1.66 -1.31 -2.05 2.88 -1.26 -4.89 113.62 104.18 3iam n SER 220 Ca 0.11 0.90 -0.01 0.00 -1.33 0.00 0.00 58.87 58.54 3iam n SER 220 Cb 0.42 -1.47 0.17 0.00 -0.75 0.00 0.00 64.21 62.58 3iam n SER 220 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3iam n GLY 221 N 1.05 2.52 2.47 0.46 0.00 -1.26 -3.83 105.19 106.58 3iam n GLY 221 Ca 0.12 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.67 3iam n GLY 221 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3iam n PHE 222 N 0.13 0.40 0.05 1.61 3.72 -1.26 -2.94 117.46 119.17 3iam n PHE 222 Ca 0.18 -1.68 -0.08 0.00 -0.05 0.00 0.00 57.45 55.83 3iam n PHE 222 Cb 0.82 0.12 -0.12 0.00 -0.94 0.00 0.00 39.48 39.36 3iam n PHE 222 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 3iam h SER 223 N 1.91 0.02 0.14 4.37 4.64 -1.90 -3.29 113.55 119.43 3iam h SER 223 Ca -0.23 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.06 3iam h SER 223 Cb 1.40 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.48 3iam h SER 223 CO 0.08 1.02 0.00 1.23 -0.87 0.00 0.00 176.83 178.29 3iam h GLY 224 N 3.03 0.00 2.00 -0.77 0.00 -1.90 -2.96 103.07 102.47 3iam h GLY 224 Ca -0.07 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.21 3iam h GLY 224 CO 0.12 0.00 -0.22 3.43 0.00 0.00 0.00 176.54 179.87 3iam h ASN 225 N 0.00 0.00 -0.49 0.19 2.35 -1.83 -2.20 115.58 113.60 3iam h ASN 225 Ca 0.00 0.00 0.02 0.00 -0.55 0.00 0.00 56.30 55.77 3iam h ASN 225 Cb 0.07 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.42 3iam h ASN 225 CO 0.00 0.22 0.32 0.16 -1.65 0.00 0.00 177.43 176.48 3iam h ILE 226 N 0.00 1.09 -0.88 2.81 3.07 -1.78 -1.60 117.51 120.22 3iam h ILE 226 Ca -0.00 -0.21 0.20 0.00 1.55 0.00 0.00 64.86 66.40 3iam h ILE 226 Cb 0.83 0.43 -0.06 0.00 -0.27 0.00 0.00 36.82 37.74 3iam h ILE 226 CO 0.03 0.11 0.59 0.74 -1.05 0.00 0.00 178.15 178.57 3iam h THR 227 N 0.61 0.69 0.01 0.16 2.02 -1.60 -0.36 112.91 114.45 3iam h THR 227 Ca 0.19 -0.14 -0.29 0.00 0.77 0.00 0.00 66.41 66.94 3iam h THR 227 Cb 0.01 0.25 -0.04 0.00 -1.74 0.00 0.00 68.15 66.63 3iam h THR 227 CO -0.05 0.07 -1.67 0.44 0.37 0.00 0.00 175.52 174.69 3iam h ASP 228 N 0.40 0.05 -0.08 4.18 3.32 -1.44 -3.38 116.42 119.47 3iam h ASP 228 Ca 0.46 -0.10 -0.15 0.00 0.02 0.00 0.00 57.03 57.26 3iam h ASP 228 Cb 1.14 -0.02 0.01 0.00 0.22 0.00 0.00 39.33 40.68 3iam h ASP 228 CO -0.17 1.09 -0.54 0.40 -1.72 0.00 0.00 179.24 178.30 3iam h ILE 229 N 0.01 1.38 -1.69 0.35 2.04 -1.15 -3.45 117.51 114.98 3iam h ILE 229 Ca -0.27 -1.89 -0.70 0.00 1.00 0.00 0.00 64.86 63.00 3iam h ILE 229 Cb 2.00 2.28 0.03 0.00 -0.74 0.00 0.00 36.82 40.38 3iam h ILE 229 CO 0.09 0.56 0.84 0.00 0.00 0.00 0.00 178.15 179.64 3iam h PRO 231 N 6.98 0.00 0.00 0.00 0.13 -1.91 -3.45 132.00 133.74 3iam h PRO 231 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 3iam h PRO 231 Cb 1.31 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.44 3iam h PRO 231 CO 0.92 0.00 0.00 1.33 -0.23 0.00 0.00 178.00 180.02 3iam n VAL 232 N -2.84 0.00 -1.95 1.56 0.24 -1.26 -2.46 118.33 111.62 3iam n VAL 232 Ca 0.01 0.00 -0.36 0.00 -2.04 0.00 0.00 64.34 61.95 3iam n VAL 232 Cb 0.28 0.00 0.04 0.00 -1.47 0.00 0.00 33.84 32.68 3iam n VAL 232 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3iam n GLY 233 N 4.84 5.71 0.05 7.63 0.00 -1.26 -4.60 105.19 117.56 3iam n GLY 233 Ca 0.00 -2.52 -0.01 0.00 0.00 0.00 0.00 46.02 43.49 3iam n GLY 233 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iam h ALA 234 N 2.73 0.00 -2.36 4.61 0.00 -1.89 -3.41 119.26 118.95 3iam h ALA 234 Ca 0.51 -0.13 -0.64 0.00 0.00 0.00 0.00 54.91 54.65 3iam h ALA 234 Cb 0.39 0.13 -0.14 0.00 0.00 0.00 0.00 17.79 18.17 3iam h ALA 234 CO 1.31 0.13 0.08 -0.51 0.00 0.00 0.00 179.25 180.26 3iam s LEU 235 N -7.98 4.30 -0.02 0.00 1.43 -1.26 -0.07 118.68 115.08 3iam s LEU 235 Ca -0.04 0.06 0.01 0.00 -1.03 0.00 0.00 54.13 53.14 3iam s LEU 235 Cb 0.01 -2.71 0.01 0.00 0.03 0.00 0.00 46.19 43.52 3iam s LEU 235 CO 0.05 -0.56 -0.02 -0.76 0.23 0.00 0.00 176.35 175.29 3iam s LEU 236 N 2.60 1.55 -0.44 1.79 1.43 -0.98 -4.53 118.68 120.11 3iam s LEU 236 Ca 0.22 -0.06 -0.29 0.00 -1.03 0.00 0.00 54.13 52.97 3iam s LEU 236 Cb -0.15 -0.24 -0.09 0.00 0.03 0.00 0.00 46.19 45.74 3iam s LEU 236 CO 0.14 -0.03 2.34 -0.67 0.23 0.00 0.00 176.35 178.37 3iam n ASP 237 N 3.63 2.31 0.13 2.29 -0.08 -1.26 -1.47 116.55 122.10 3iam n ASP 237 Ca -0.21 -0.04 0.13 0.00 -1.51 0.00 0.00 54.79 53.16 3iam n ASP 237 Cb 0.54 -1.43 0.32 0.00 2.34 0.00 0.00 41.12 42.88 3iam n ASP 237 CO 0.00 0.00 0.00 0.25 0.12 0.00 0.00 177.20 177.57 3iam h LEU 238 N 15.94 0.00 -1.86 -2.67 5.85 -1.63 -3.01 115.31 127.92 3iam h LEU 238 Ca -0.27 -0.02 0.13 0.00 0.84 0.00 0.00 57.88 58.56 3iam h LEU 238 Cb 1.28 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 42.28 3iam h LEU 238 CO 1.10 0.01 0.38 0.00 -0.34 0.00 0.00 178.44 179.59 3iam h THR 239 N 0.00 0.79 -0.83 1.05 1.03 -1.81 -2.78 112.91 110.36 3iam h THR 239 Ca 0.00 -0.05 -0.47 0.00 -0.01 0.00 0.00 66.41 65.88 3iam h THR 239 Cb 0.81 0.64 -0.42 0.00 -1.07 0.00 0.00 68.15 68.11 3iam h THR 239 CO 0.00 0.03 -0.91 0.00 -0.01 0.00 0.00 175.52 174.63 3iam n ALA 240 N -2.59 4.32 -1.77 0.00 0.00 -1.14 -5.04 120.51 114.28 3iam n ALA 240 Ca 0.10 -3.58 -0.41 0.00 0.00 0.00 0.00 53.44 49.55 3iam n ALA 240 Cb 0.52 -0.54 -0.02 0.00 0.00 0.00 0.00 19.45 19.41 3iam n ALA 240 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 3iam s ARG 241 N -3.60 4.29 -1.18 0.00 3.52 -1.05 -4.07 118.95 116.86 3iam s ARG 241 Ca 0.43 2.31 -0.26 0.00 -0.13 0.00 0.00 55.73 58.07 3iam s ARG 241 Cb 0.39 -3.04 0.01 0.00 -1.56 0.00 0.00 34.95 30.75 3iam s ARG 241 CO -0.02 -0.28 0.73 1.19 -0.81 0.00 0.00 175.30 176.12 3iam n PHE 242 N 0.71 -1.68 -0.09 5.12 3.72 -1.26 -4.92 117.46 119.07 3iam n PHE 242 Ca 0.00 0.29 -0.17 0.00 -0.05 0.00 0.00 57.45 57.52 3iam n PHE 242 Cb 0.41 -3.16 -0.06 0.00 -0.94 0.00 0.00 39.48 35.73 3iam n PHE 242 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 3iam n ARG 243 N -4.57 0.42 -3.78 -1.08 5.12 -1.26 -5.10 116.66 106.41 3iam n ARG 243 Ca -0.11 0.18 -0.07 0.00 -1.93 0.00 0.00 57.85 55.93 3iam n ARG 243 Cb 0.58 -1.22 -0.02 0.00 -1.16 0.00 0.00 32.46 30.64 3iam n ARG 243 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3iam s ALA 244 N -2.47 -1.37 0.59 7.54 0.00 -1.26 -5.13 121.76 119.66 3iam s ALA 244 Ca -0.27 -0.10 -0.13 0.00 0.00 0.00 0.00 51.96 51.47 3iam s ALA 244 Cb 0.09 0.80 -0.05 0.00 0.00 0.00 0.00 23.12 23.96 3iam s ALA 244 CO 0.35 -1.00 1.02 1.03 0.00 0.00 0.00 175.76 177.16 3iam s ARG 245 N -3.75 3.63 0.39 0.00 1.81 -1.26 -4.96 118.95 114.81 3iam s ARG 245 Ca 0.10 0.85 0.07 0.00 -1.72 0.00 0.00 55.73 55.03 3iam s ARG 245 Cb -0.04 -2.09 0.82 0.00 -0.45 0.00 0.00 34.95 33.19 3iam s ARG 245 CO 0.03 -0.54 2.01 -0.91 -0.68 0.00 0.00 175.30 175.21 3iam h ASN 246 N 0.04 0.56 1.49 0.23 2.35 -1.93 -0.66 115.58 117.66 3iam h ASN 246 Ca -0.45 -0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.23 3iam h ASN 246 Cb 1.19 -0.13 -0.01 0.00 0.05 0.00 0.00 38.32 39.43 3iam h ASN 246 CO 0.61 0.38 -0.31 4.11 -1.65 0.00 0.00 177.43 180.57 3iam h TRP 247 N 0.64 0.00 0.00 1.19 0.09 -1.97 -3.14 115.95 112.77 3iam h TRP 247 Ca 0.24 0.00 0.00 0.00 0.09 0.00 0.00 58.89 59.22 3iam h TRP 247 Cb 0.14 0.00 0.00 0.00 0.08 0.00 0.00 29.16 29.38 3iam h TRP 247 CO -0.00 0.31 0.00 0.39 0.09 0.00 0.00 178.44 179.23 3iam n GLU 248 N -3.23 0.76 -3.63 0.12 1.02 -0.26 -4.81 120.64 110.62 3iam n GLU 248 Ca 0.02 0.00 -0.33 0.00 -0.02 0.00 0.00 57.16 56.83 3iam n GLU 248 Cb 0.61 -1.21 -0.05 0.00 -0.02 0.00 0.00 31.44 30.77 3iam n GLU 248 CO 0.00 0.00 0.00 -1.64 1.18 0.00 0.00 177.13 176.67 3iam s MET 249 N -2.00 3.68 -0.85 3.49 -1.94 -1.19 -4.78 119.30 115.71 3iam s MET 249 Ca 0.15 0.04 -0.14 0.00 -1.71 0.00 0.00 55.69 54.04 3iam s MET 249 Cb 0.07 -2.95 0.22 0.00 2.01 0.00 0.00 34.83 34.19 3iam s MET 249 CO 0.12 0.53 0.80 -2.00 -0.01 0.00 0.00 175.02 174.47 3iam s GLU 250 N -2.18 3.65 0.15 2.03 2.12 -0.03 -4.88 118.70 119.56 3iam s GLU 250 Ca 0.35 -2.51 -0.31 0.00 0.36 0.00 0.00 54.97 52.87 3iam s GLU 250 Cb -0.13 -4.45 -0.09 0.00 0.26 0.00 0.00 34.13 29.72 3iam s GLU 250 CO 0.20 -1.30 1.39 -1.21 -0.54 0.00 0.00 175.26 173.81 3iam s GLU 251 N 0.11 4.32 -0.30 4.30 2.02 -1.26 -3.27 118.70 124.61 3iam s GLU 251 Ca 0.19 2.12 0.01 0.00 0.02 0.00 0.00 54.97 57.32 3iam s GLU 251 Cb -0.10 -3.21 0.09 0.00 0.10 0.00 0.00 34.13 31.01 3iam s GLU 251 CO -0.09 -0.41 0.05 0.99 0.02 0.00 0.00 175.26 175.82 3iam s THR 252 N 0.75 1.54 -0.24 3.63 2.01 0.21 -4.92 115.64 118.61 3iam s THR 252 Ca 0.63 -1.72 -0.29 0.00 0.31 0.00 0.00 61.69 60.62 3iam s THR 252 Cb -0.38 -2.08 -0.02 0.00 0.01 0.00 0.00 72.50 70.04 3iam s THR 252 CO 0.34 -0.53 1.48 -2.16 -0.69 0.00 0.00 174.62 173.05 3iam s PRO 253 N 1.30 3.87 0.00 4.92 0.04 -1.26 -0.80 135.00 143.07 3iam s PRO 253 Ca 0.07 1.51 0.00 0.00 0.04 0.00 0.00 61.00 62.62 3iam s PRO 253 Cb -0.18 -3.96 0.00 0.00 0.04 0.00 0.00 34.50 30.40 3iam s PRO 253 CO -0.15 -1.19 0.00 -2.37 0.04 0.00 0.00 177.00 173.34 3iam n THR 254 N 6.25 0.00 -4.10 1.26 5.66 -0.88 -4.30 114.28 118.17 3iam n THR 254 Ca 0.17 0.00 -0.13 0.00 -3.05 0.00 0.00 64.05 61.03 3iam n THR 254 Cb 0.46 0.00 -0.11 0.00 -1.55 0.00 0.00 70.33 69.12 3iam n THR 254 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 175.07 171.13 3iam s THR 255 N -0.58 0.66 0.04 1.09 2.01 -1.25 -2.54 115.64 115.08 3iam s THR 255 Ca 0.00 -1.26 -0.22 0.00 0.31 0.00 0.00 61.69 60.52 3iam s THR 255 Cb 0.00 -0.86 -0.06 0.00 0.01 0.00 0.00 72.50 71.59 3iam s THR 255 CO 0.00 -0.44 0.66 0.00 -0.69 0.00 0.00 174.62 174.15 3iam n ALA 257 N 2.44 4.26 0.13 0.00 0.00 -1.26 -4.16 120.51 121.91 3iam n ALA 257 Ca -0.06 -3.48 0.10 0.00 0.00 0.00 0.00 53.44 50.00 3iam n ALA 257 Cb 0.50 -0.40 0.04 0.00 0.00 0.00 0.00 19.45 19.59 3iam n ALA 257 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3iam h LEU 258 N 1.80 0.00 -8.14 0.00 3.38 -1.97 -3.45 115.31 106.94 3iam h LEU 258 Ca 0.18 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 58.07 3iam h LEU 258 Cb 1.37 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.10 3iam h LEU 258 CO 0.44 0.07 0.14 0.00 0.09 0.00 0.00 178.44 179.19 3iam n PRO 260 N -0.53 0.20 0.15 0.00 -0.02 -1.26 -3.57 135.00 129.96 3iam n PRO 260 Ca -0.06 0.37 0.01 0.00 -2.02 0.00 0.00 63.50 61.80 3iam n PRO 260 Cb 0.60 -1.84 0.18 0.00 -0.02 0.00 0.00 33.50 32.43 3iam n PRO 260 CO 0.00 0.00 0.00 -0.39 1.98 0.00 0.00 175.50 177.09 3iam h VAL 261 N 0.00 1.22 -5.54 -1.45 -1.51 -1.91 -1.62 116.25 105.44 3iam h VAL 261 Ca 0.00 -2.08 -0.13 0.00 -1.23 0.00 0.00 66.70 63.26 3iam h VAL 261 Cb 0.43 2.18 0.06 0.00 -2.13 0.00 0.00 31.29 31.83 3iam h VAL 261 CO 0.00 0.56 -0.36 0.61 -1.23 0.00 0.00 177.57 177.14 3iam n GLY 262 N 0.47 -1.21 0.00 5.19 0.00 -1.23 -4.68 105.19 103.73 3iam n GLY 262 Ca -0.00 0.51 0.00 0.00 0.00 0.00 0.00 46.02 46.53 3iam n GLY 262 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iam s GLY 264 N 0.00 -0.51 0.50 0.00 0.00 -1.26 -4.33 107.32 101.72 3iam s GLY 264 Ca 0.00 1.34 0.02 0.00 0.00 0.00 0.00 44.72 46.08 3iam s GLY 264 CO 0.00 2.73 0.00 -0.26 0.00 0.00 0.00 173.10 175.57 3iam s ILE 265 N 2.64 1.25 -0.06 0.90 -4.36 -1.05 -0.09 121.20 120.43 3iam s ILE 265 Ca 0.08 -2.00 0.00 0.00 -0.26 0.00 0.00 60.65 58.48 3iam s ILE 265 Cb -0.14 -2.26 0.02 0.00 1.25 0.00 0.00 42.46 41.34 3iam s ILE 265 CO -0.16 0.00 -0.03 -0.89 0.24 0.00 0.00 174.94 174.10 3iam s THR 266 N -2.86 0.50 -0.21 8.37 2.01 -0.76 -2.08 115.64 120.61 3iam s THR 266 Ca 0.09 -0.05 -0.16 0.00 0.31 0.00 0.00 61.69 61.88 3iam s THR 266 Cb 0.03 -0.57 -0.04 0.00 0.01 0.00 0.00 72.50 71.93 3iam s THR 266 CO 0.05 0.24 0.42 0.00 -0.69 0.00 0.00 174.62 174.64 3iam s ALA 267 N 1.30 3.56 -0.27 7.40 0.00 0.02 -2.99 121.76 130.78 3iam s ALA 267 Ca -0.05 -0.54 -0.13 0.00 0.00 0.00 0.00 51.96 51.24 3iam s ALA 267 Cb -0.14 -2.68 -0.04 0.00 0.00 0.00 0.00 23.12 20.26 3iam s ALA 267 CO -0.02 -0.38 0.26 -0.51 0.00 0.00 0.00 175.76 175.11 3iam s ASP 268 N 1.15 6.13 0.33 0.00 1.01 -0.69 -0.62 116.67 123.99 3iam s ASP 268 Ca 0.19 0.13 0.03 0.00 0.71 0.00 0.00 52.55 53.62 3iam s ASP 268 Cb -0.15 -2.16 -0.05 0.00 1.01 0.00 0.00 42.92 41.58 3iam s ASP 268 CO 0.08 -0.09 0.10 0.42 0.21 0.00 0.00 175.17 175.90 3iam s THR 269 N 1.77 0.75 -0.30 -1.27 -4.23 -1.20 -1.10 115.64 110.05 3iam s THR 269 Ca 0.10 -2.00 -0.08 0.00 -1.18 0.00 0.00 61.69 58.54 3iam s THR 269 Cb -0.16 -2.59 0.19 0.00 1.34 0.00 0.00 72.50 71.29 3iam s THR 269 CO 0.10 0.00 0.95 -0.60 -0.54 0.00 0.00 174.62 174.53 3iam s ARG 270 N -3.86 0.23 0.00 3.99 3.52 -1.16 -0.85 118.95 120.82 3iam s ARG 270 Ca 0.33 0.24 0.00 0.00 -0.13 0.00 0.00 55.73 56.17 3iam s ARG 270 Cb 0.06 0.11 0.00 0.00 -1.56 0.00 0.00 34.95 33.56 3iam s ARG 270 CO 0.15 -0.42 0.00 0.43 -0.81 0.00 0.00 175.30 174.65 3iam n SER 271 N 5.19 -1.45 0.00 -2.12 7.64 -1.26 -4.06 113.62 117.55 3iam n SER 271 Ca 0.08 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.96 3iam n SER 271 Cb 0.57 -0.36 0.00 0.00 -1.01 0.00 0.00 64.21 63.40 3iam n SER 271 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3iam n GLY 272 N -0.53 0.33 3.46 0.23 0.00 -1.22 -4.91 105.19 102.54 3iam n GLY 272 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 3iam n GLY 272 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3iam s GLU 273 N -0.76 1.77 -0.34 1.61 -1.05 -1.26 0.33 118.70 119.01 3iam s GLU 273 Ca 0.00 -1.17 -0.21 0.00 -0.15 0.00 0.00 54.97 53.45 3iam s GLU 273 Cb 0.00 -2.08 0.00 0.00 -0.44 0.00 0.00 34.13 31.61 3iam s GLU 273 CO 0.00 0.49 0.66 -1.17 0.95 0.00 0.00 175.26 176.19 3iam s LEU 274 N -1.93 4.21 -0.21 1.83 2.96 -1.26 -2.99 118.68 121.29 3iam s LEU 274 Ca 0.16 0.25 -0.17 0.00 -0.22 0.00 0.00 54.13 54.15 3iam s LEU 274 Cb -0.10 -2.83 -0.14 0.00 0.50 0.00 0.00 46.19 43.62 3iam s LEU 274 CO 0.08 -0.59 -0.03 0.18 -1.32 0.00 0.00 176.35 174.68 3iam n LEU 275 N 6.06 1.88 -3.71 -0.68 7.99 -0.26 -4.92 117.00 123.36 3iam n LEU 275 Ca -0.00 0.43 -0.14 0.00 -0.01 0.00 0.00 56.01 56.29 3iam n LEU 275 Cb 0.49 -0.90 -0.08 0.00 -0.11 0.00 0.00 43.42 42.81 3iam n LEU 275 CO 0.49 0.18 0.12 -0.60 -1.51 0.00 0.00 177.39 176.07 3iam s ARG 276 N -2.41 0.70 -0.17 3.23 3.52 -1.00 -4.51 118.95 118.29 3iam s ARG 276 Ca -0.29 0.10 0.00 0.00 -0.13 0.00 0.00 55.73 55.41 3iam s ARG 276 Cb 0.07 0.32 0.01 0.00 -1.56 0.00 0.00 34.95 33.79 3iam s ARG 276 CO 0.49 -0.18 -0.17 0.42 -0.81 0.00 0.00 175.30 175.06 3iam s ILE 277 N -0.90 2.45 0.37 4.11 -1.09 -1.26 -1.70 121.20 123.18 3iam s ILE 277 Ca -0.10 -0.83 0.07 0.00 -2.23 0.00 0.00 60.65 57.57 3iam s ILE 277 Cb -0.04 -2.04 -0.07 0.00 -1.58 0.00 0.00 42.46 38.73 3iam s ILE 277 CO 0.04 0.52 -0.01 -0.13 -1.23 0.00 0.00 174.94 174.13 3iam s ARG 278 N 1.08 1.84 -0.14 2.79 0.52 -1.16 -4.86 118.95 119.01 3iam s ARG 278 Ca -0.00 -2.01 -0.14 0.00 -0.52 0.00 0.00 55.73 53.06 3iam s ARG 278 Cb -0.14 -1.48 -0.05 0.00 0.52 0.00 0.00 34.95 33.80 3iam s ARG 278 CO -0.05 -0.02 0.30 0.00 0.02 0.00 0.00 175.30 175.54 3iam s ALA 279 N -2.81 3.62 -0.02 2.13 0.00 -1.26 -1.82 121.76 121.59 3iam s ALA 279 Ca 0.34 -0.44 -0.22 0.00 0.00 0.00 0.00 51.96 51.63 3iam s ALA 279 Cb 0.07 -2.37 -0.05 0.00 0.00 0.00 0.00 23.12 20.78 3iam s ALA 279 CO 0.17 0.15 0.66 0.50 0.00 0.00 0.00 175.76 177.24 3iam s ARG 280 N 0.25 4.40 -0.01 0.00 3.52 0.86 -4.79 118.95 123.19 3iam s ARG 280 Ca 0.17 0.85 -0.30 0.00 -0.13 0.00 0.00 55.73 56.32 3iam s ARG 280 Cb -0.13 -3.39 -0.05 0.00 -1.56 0.00 0.00 34.95 29.82 3iam s ARG 280 CO 0.05 0.23 1.26 -2.00 -0.81 0.00 0.00 175.30 174.03 3iam s GLU 281 N 0.23 4.35 -0.46 5.12 2.12 -1.26 -4.52 118.70 124.27 3iam s GLU 281 Ca 0.35 1.79 0.06 0.00 0.36 0.00 0.00 54.97 57.52 3iam s GLU 281 Cb -0.18 -3.51 0.19 0.00 0.26 0.00 0.00 34.13 30.88 3iam s GLU 281 CO 0.18 -0.44 0.54 1.55 -0.54 0.00 0.00 175.26 176.55 3iam n VAL 282 N 4.46 -0.61 -0.34 3.70 3.14 -0.99 -5.04 118.33 122.65 3iam n VAL 282 Ca 0.11 -2.32 0.16 0.00 -2.96 0.00 0.00 64.34 59.33 3iam n VAL 282 Cb 0.45 -0.38 0.36 0.00 -1.06 0.00 0.00 33.84 33.22 3iam n VAL 282 CO 0.00 0.00 0.00 1.55 -6.46 0.00 0.00 176.83 171.92 3iam h PRO 283 N 5.19 0.58 -0.26 1.45 0.13 -1.73 0.10 132.00 137.46 3iam h PRO 283 Ca 0.15 -0.03 0.08 0.00 -0.87 0.00 0.00 66.00 65.32 3iam h PRO 283 Cb 1.00 -0.13 -0.01 0.00 0.13 0.00 0.00 31.00 31.99 3iam h PRO 283 CO 0.22 0.38 0.33 0.93 -0.23 0.00 0.00 178.00 179.63 3iam h GLU 284 N 0.59 0.00 0.00 0.86 4.39 -1.96 -3.42 114.58 115.05 3iam h GLU 284 Ca 0.62 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.32 3iam h GLU 284 Cb 1.14 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.79 3iam h GLU 284 CO -0.46 0.00 0.00 1.55 -1.16 0.00 0.00 179.01 178.94 3iam n VAL 285 N -3.62 0.00 -2.17 3.13 3.14 0.02 -4.71 118.33 114.13 3iam n VAL 285 Ca 0.04 0.00 -0.42 0.00 -2.96 0.00 0.00 64.34 61.00 3iam n VAL 285 Cb 0.47 0.00 -0.03 0.00 -1.06 0.00 0.00 33.84 33.22 3iam n VAL 285 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91 3iam s ASN 286 N 1.00 6.84 0.00 6.55 4.22 -1.24 -4.97 114.94 127.33 3iam s ASN 286 Ca 0.00 2.41 0.00 0.00 -2.14 0.00 0.00 52.86 53.13 3iam s ASN 286 Cb 0.00 -2.60 0.00 0.00 1.28 0.00 0.00 41.25 39.93 3iam s ASN 286 CO 0.00 -0.60 0.39 -0.62 -2.04 0.00 0.00 177.10 174.23 3iam n GLU 287 N 3.07 0.00 -0.56 3.55 1.02 -1.26 -3.77 120.64 122.69 3iam n GLU 287 Ca 0.08 0.18 0.02 0.00 -0.02 0.00 0.00 57.16 57.42 3iam n GLU 287 Cb 0.42 -0.96 0.03 0.00 -0.02 0.00 0.00 31.44 30.91 3iam n GLU 287 CO 0.00 0.00 0.00 0.44 1.18 0.00 0.00 177.13 178.75 3iam n ILE 288 N -1.03 0.39 -4.21 -3.67 -5.35 -1.26 -2.36 119.36 101.87 3iam n ILE 288 Ca 0.00 -0.61 -0.24 0.00 -0.27 0.00 0.00 62.75 61.62 3iam n ILE 288 Cb 0.00 0.42 -0.07 0.00 -1.74 0.00 0.00 39.64 38.25 3iam n ILE 288 CO 0.00 0.00 0.00 0.26 -1.76 0.00 0.00 176.55 175.05 3iam s TRP 289 N -0.59 2.87 -0.06 4.28 0.52 -1.26 -4.84 118.94 119.88 3iam s TRP 289 Ca 0.11 -0.15 -0.09 0.00 0.02 0.00 0.00 56.10 55.99 3iam s TRP 289 Cb 0.11 -1.33 0.02 0.00 -1.15 0.00 0.00 33.47 31.11 3iam s TRP 289 CO -0.02 0.55 0.22 0.42 0.02 0.00 0.00 176.95 178.15 3iam s ILE 290 N -2.00 0.03 0.55 2.03 -1.09 -1.26 -4.84 121.20 114.61 3iam s ILE 290 Ca 0.30 -0.24 -0.04 0.00 -2.23 0.00 0.00 60.65 58.44 3iam s ILE 290 Cb -0.08 -0.40 0.01 0.00 -1.58 0.00 0.00 42.46 40.41 3iam s ILE 290 CO 0.21 -0.13 0.83 0.00 -1.23 0.00 0.00 174.94 174.61 3iam h ASP 292 N -0.00 0.88 -0.25 0.00 3.32 -1.92 -2.17 116.42 116.28 3iam h ASP 292 Ca -0.45 -0.35 -0.05 0.00 0.02 0.00 0.00 57.03 56.19 3iam h ASP 292 Cb 1.26 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 40.55 3iam h ASP 292 CO 0.59 1.11 0.02 0.00 -1.72 0.00 0.00 179.24 179.24 3iam h ALA 293 N 0.95 1.38 0.00 3.45 0.00 -1.91 -0.62 119.26 122.51 3iam h ALA 293 Ca 0.08 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 54.73 3iam h ALA 293 Cb 0.84 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 3iam h ALA 293 CO 0.07 0.44 -0.33 0.78 0.00 0.00 0.00 179.25 180.20 3iam h GLY 294 N 0.83 0.00 0.11 0.00 0.00 -1.73 -2.62 103.07 99.66 3iam h GLY 294 Ca 0.12 0.00 -0.38 0.00 0.00 0.00 0.00 47.33 47.07 3iam h GLY 294 CO 0.01 0.00 -2.37 -2.13 0.00 0.00 0.00 176.54 172.04 3iam n ARG 295 N -3.38 0.67 0.00 4.80 0.63 -0.94 -4.63 116.66 113.81 3iam n ARG 295 Ca 0.01 0.14 0.08 0.00 -0.92 0.00 0.00 57.85 57.15 3iam n ARG 295 Cb 0.54 -1.55 -0.08 0.00 0.45 0.00 0.00 32.46 31.81 3iam n ARG 295 CO 0.00 0.00 0.00 1.19 -2.51 0.00 0.00 177.63 176.31 3iam n PHE 296 N -3.18 0.00 -3.42 -0.14 3.72 -0.26 -4.17 117.46 110.00 3iam n PHE 296 Ca -0.41 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 56.57 3iam n PHE 296 Cb 1.03 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 39.55 3iam n PHE 296 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 3iam s GLY 297 N -2.46 3.19 0.00 1.37 0.00 -0.98 -4.57 107.32 103.86 3iam s GLY 297 Ca 0.07 -3.84 0.00 0.00 0.00 0.00 0.00 44.72 40.95 3iam s GLY 297 CO 0.64 1.29 0.00 -2.39 0.00 0.00 0.00 173.10 172.64 3iam n HIS 298 N 2.61 0.00 1.16 1.90 1.44 -1.26 -4.84 115.22 116.23 3iam n HIS 298 Ca 0.23 0.00 0.13 0.00 -2.01 0.00 0.00 57.72 56.07 3iam n HIS 298 Cb 0.39 0.00 0.63 0.00 0.12 0.00 0.00 29.99 31.13 3iam n HIS 298 CO 0.00 0.00 0.00 0.39 -2.81 0.00 0.00 176.34 173.92 3iam n GLU 299 N 0.00 0.31 0.07 -1.40 1.02 -1.26 -3.00 120.64 116.38 3iam n GLU 299 Ca 0.00 0.05 -0.20 0.00 -0.02 0.00 0.00 57.16 56.99 3iam n GLU 299 Cb 0.17 -1.50 -0.15 0.00 -0.02 0.00 0.00 31.44 29.95 3iam n GLU 299 CO 0.00 0.00 0.00 0.11 1.18 0.00 0.00 177.13 178.42 3iam h TRP 300 N 0.00 0.59 0.00 -0.32 5.08 -1.87 -3.26 115.95 116.17 3iam h TRP 300 Ca 0.00 -0.43 -0.06 0.00 1.08 0.00 0.00 58.89 59.49 3iam h TRP 300 Cb 0.27 -0.02 -0.01 0.00 -3.00 0.00 0.00 29.16 26.40 3iam h TRP 300 CO 0.00 1.52 -0.27 0.00 -1.28 0.00 0.00 178.44 178.41 3iam h ALA 301 N 0.32 1.29 -0.55 0.11 0.00 -1.90 -2.72 119.26 115.81 3iam h ALA 301 Ca -0.29 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.36 3iam h ALA 301 Cb 2.06 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 19.78 3iam h ALA 301 CO 0.17 0.33 0.29 -0.44 0.00 0.00 0.00 179.25 179.60 3iam h ASP 302 N 0.00 0.71 0.00 0.00 3.45 -1.64 -3.47 116.42 115.47 3iam h ASP 302 Ca -0.00 -0.11 0.00 0.00 0.43 0.00 0.00 57.03 57.35 3iam h ASP 302 Cb 0.57 -0.18 0.00 0.00 -0.56 0.00 0.00 39.33 39.16 3iam h ASP 302 CO 0.03 0.61 0.00 0.00 -1.57 0.00 0.00 179.24 178.32 3iam n GLN 303 N -4.59 0.00 -1.86 3.56 1.13 -1.02 -4.93 117.38 109.66 3iam n GLN 303 Ca 0.03 0.00 -0.42 0.00 -1.94 0.00 0.00 57.00 54.67 3iam n GLN 303 Cb 0.10 0.00 -0.03 0.00 0.11 0.00 0.00 30.24 30.42 3iam n GLN 303 CO 0.00 0.00 0.00 -0.80 -1.44 0.00 0.00 177.06 174.82 3iam s ASN 304 N -1.00 6.56 -0.06 1.08 0.01 -1.26 -4.97 114.94 115.30 3iam s ASN 304 Ca 0.00 2.53 -0.11 0.00 -0.71 0.00 0.00 52.86 54.57 3iam s ASN 304 Cb 0.00 -2.56 0.02 0.00 0.41 0.00 0.00 41.25 39.13 3iam s ASN 304 CO 0.00 -0.94 0.28 -0.13 -1.51 0.00 0.00 177.10 174.80 3iam s ARG 305 N 3.09 0.47 -0.13 -0.60 1.81 -1.26 -4.77 118.95 117.56 3iam s ARG 305 Ca 0.77 0.09 -0.29 0.00 -1.72 0.00 0.00 55.73 54.58 3iam s ARG 305 Cb -0.41 0.22 -0.01 0.00 -0.45 0.00 0.00 34.95 34.30 3iam s ARG 305 CO 0.34 -0.10 1.02 -1.17 -0.68 0.00 0.00 175.30 174.71 3iam s LEU 306 N -0.56 4.21 -0.04 2.53 2.96 -0.80 -4.90 118.68 122.09 3iam s LEU 306 Ca -0.07 1.50 0.05 0.00 -0.22 0.00 0.00 54.13 55.39 3iam s LEU 306 Cb -0.04 -3.55 -0.07 0.00 0.50 0.00 0.00 46.19 43.03 3iam s LEU 306 CO 0.02 -0.50 0.04 0.29 -1.32 0.00 0.00 176.35 174.88 3iam n LYS 307 N 5.32 2.36 -4.87 1.98 5.02 -1.26 -4.68 118.16 122.03 3iam n LYS 307 Ca 0.10 -0.02 -0.31 0.00 -2.02 0.00 0.00 58.31 56.06 3iam n LYS 307 Cb 0.48 -1.13 -0.14 0.00 -0.02 0.00 0.00 35.03 34.23 3iam n LYS 307 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 3iam s THR 308 N -2.19 2.50 0.18 -0.18 -4.23 -1.26 -2.11 115.64 108.35 3iam s THR 308 Ca -0.02 -1.18 -0.31 0.00 -1.18 0.00 0.00 61.69 58.99 3iam s THR 308 Cb 0.02 -1.99 -0.10 0.00 1.34 0.00 0.00 72.50 71.76 3iam s THR 308 CO 0.21 0.42 1.56 -2.16 -0.54 0.00 0.00 174.62 174.11 3iam s PRO 309 N -1.16 4.21 -0.01 3.99 0.04 -1.26 -4.61 135.00 136.20 3iam s PRO 309 Ca 0.13 2.38 -0.02 0.00 0.04 0.00 0.00 61.00 63.52 3iam s PRO 309 Cb -0.10 -3.14 -0.04 0.00 0.04 0.00 0.00 34.50 31.26 3iam s PRO 309 CO 0.03 -0.59 0.14 -0.51 0.04 0.00 0.00 177.00 176.11 3iam s LEU 310 N 0.89 4.19 0.03 -3.56 1.43 -0.06 -1.20 118.68 120.41 3iam s LEU 310 Ca 0.69 0.27 0.02 0.00 -1.03 0.00 0.00 54.13 54.08 3iam s LEU 310 Cb -0.44 -2.49 -0.02 0.00 0.03 0.00 0.00 46.19 43.27 3iam s LEU 310 CO 0.33 0.27 -0.08 0.54 0.23 0.00 0.00 176.35 177.64 3iam s VAL 311 N -1.28 0.55 0.09 -1.59 0.11 -1.00 -1.72 120.40 115.57 3iam s VAL 311 Ca 0.26 -0.90 -0.29 0.00 -2.93 0.00 0.00 61.98 58.11 3iam s VAL 311 Cb -0.12 -0.58 -0.05 0.00 -1.53 0.00 0.00 36.38 34.09 3iam s VAL 311 CO 0.17 -0.26 0.94 -0.60 -3.33 0.00 0.00 175.10 172.02 3iam s ARG 312 N -1.26 4.65 0.00 1.54 3.52 -1.06 -2.03 118.95 124.31 3iam s ARG 312 Ca -0.07 1.40 0.00 0.00 -0.13 0.00 0.00 55.73 56.93 3iam s ARG 312 Cb -0.08 -3.39 0.00 0.00 -1.56 0.00 0.00 34.95 29.92 3iam s ARG 312 CO 0.00 0.19 0.00 1.17 -0.81 0.00 0.00 175.30 175.85 3iam n LYS 313 N 2.94 0.00 -1.66 5.12 3.00 -0.29 -4.89 118.16 122.37 3iam n LYS 313 Ca 0.02 0.00 -0.33 0.00 -0.00 0.00 0.00 58.31 58.00 3iam n LYS 313 Cb 0.50 0.00 -0.01 0.00 0.00 0.00 0.00 35.03 35.52 3iam n LYS 313 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 3iam n GLU 314 N -0.41 2.55 -1.09 1.64 -0.58 -1.26 -4.66 120.64 116.83 3iam n GLU 314 Ca 0.00 -2.88 -0.03 0.00 -0.42 0.00 0.00 57.16 53.83 3iam n GLU 314 Cb 0.00 -2.19 -0.01 0.00 -0.57 0.00 0.00 31.44 28.67 3iam n GLU 314 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3iam n GLY 315 N 0.17 0.59 3.28 0.62 0.00 -1.26 -4.99 105.19 103.60 3iam n GLY 315 Ca 0.51 -0.30 -0.15 0.00 0.00 0.00 0.00 46.02 46.08 3iam n GLY 315 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3iam s ARG 316 N -1.51 1.31 0.05 1.61 1.70 -1.26 -5.04 118.95 115.81 3iam s ARG 316 Ca 0.00 -1.69 0.00 0.00 -0.47 0.00 0.00 55.73 53.58 3iam s ARG 316 Cb 0.00 -0.20 -0.04 0.00 -0.57 0.00 0.00 34.95 34.14 3iam s ARG 316 CO 0.00 -0.26 0.18 -0.51 -1.08 0.00 0.00 175.30 173.62 3iam s LEU 317 N -3.26 4.23 0.12 -1.89 2.01 -1.26 -1.14 118.68 117.49 3iam s LEU 317 Ca 0.34 0.22 -0.05 0.00 0.01 0.00 0.00 54.13 54.65 3iam s LEU 317 Cb 0.07 -2.80 -0.02 0.00 0.01 0.00 0.00 46.19 43.45 3iam s LEU 317 CO 0.11 0.18 0.14 -0.69 1.01 0.00 0.00 176.35 177.11 3iam s VAL 318 N -1.45 0.12 0.07 -1.59 1.01 -0.86 -4.93 120.40 112.76 3iam s VAL 318 Ca 0.33 -1.59 -0.31 0.00 0.00 0.00 0.00 61.98 60.41 3iam s VAL 318 Cb -0.13 -1.77 -0.08 0.00 0.00 0.00 0.00 36.38 34.40 3iam s VAL 318 CO 0.25 -0.52 1.59 -0.70 0.00 0.00 0.00 175.10 175.72 3iam s GLU 319 N -3.97 4.22 0.10 2.72 2.12 -1.26 -2.37 118.70 120.26 3iam s GLU 319 Ca 0.16 2.27 0.01 0.00 0.36 0.00 0.00 54.97 57.76 3iam s GLU 319 Cb 0.06 -3.54 -0.00 0.00 0.26 0.00 0.00 34.13 30.90 3iam s GLU 319 CO -0.03 -0.69 0.04 0.00 -0.54 0.00 0.00 175.26 174.04 3iam n ALA 320 N 5.34 0.15 -2.51 6.30 0.00 -0.34 -4.93 120.51 124.52 3iam n ALA 320 Ca 0.15 -0.53 -0.26 0.00 0.00 0.00 0.00 53.44 52.81 3iam n ALA 320 Cb 0.41 0.35 -0.09 0.00 0.00 0.00 0.00 19.45 20.13 3iam n ALA 320 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3iam s THR 321 N -1.92 2.29 -0.35 0.00 2.01 -1.26 -4.22 115.64 112.18 3iam s THR 321 Ca 0.05 -1.86 0.21 0.00 0.31 0.00 0.00 61.69 60.40 3iam s THR 321 Cb 0.00 -2.95 0.21 0.00 0.01 0.00 0.00 72.50 69.77 3iam s THR 321 CO 0.04 -0.05 1.63 0.79 -0.69 0.00 0.00 174.62 176.34 3iam n TRP 322 N -1.09 0.70 0.02 4.92 7.02 -1.26 0.01 117.44 127.76 3iam n TRP 322 Ca -0.03 0.33 -0.02 0.00 -1.02 0.00 0.00 57.50 56.76 3iam n TRP 322 Cb 0.65 -1.03 -0.01 0.00 -2.42 0.00 0.00 31.31 28.50 3iam n TRP 322 CO 0.00 0.00 0.00 1.49 -2.02 0.00 0.00 177.69 177.16 3iam h GLU 323 N 0.00 -0.13 0.00 -0.99 4.57 -1.98 -0.26 114.58 115.79 3iam h GLU 323 Ca 0.00 0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.19 3iam h GLU 323 Cb 0.12 0.03 0.00 0.00 -0.16 0.00 0.00 28.75 28.74 3iam h GLU 323 CO 0.00 -0.09 0.08 0.93 -1.18 0.00 0.00 179.01 178.75 3iam h GLU 324 N -0.73 0.00 0.01 1.92 5.08 -1.81 -1.61 114.58 117.44 3iam h GLU 324 Ca -0.01 0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 58.12 3iam h GLU 324 Cb 0.10 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.32 3iam h GLU 324 CO 0.02 0.00 -1.21 0.00 -1.00 0.00 0.00 179.01 176.82 3iam h ALA 325 N 1.84 0.25 0.00 3.43 0.00 -0.50 -2.46 119.26 121.82 3iam h ALA 325 Ca 0.00 -1.16 -0.01 0.00 0.00 0.00 0.00 54.91 53.74 3iam h ALA 325 Cb 0.15 0.66 -0.00 0.00 0.00 0.00 0.00 17.79 18.61 3iam h ALA 325 CO 0.00 0.69 -0.03 0.35 0.00 0.00 0.00 179.25 180.26 3iam h PHE 326 N -0.89 0.00 0.00 0.00 3.57 -0.44 -0.62 116.94 118.56 3iam h PHE 326 Ca -0.32 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.17 3iam h PHE 326 Cb 1.35 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 40.09 3iam h PHE 326 CO 0.11 0.03 -0.10 -0.07 -2.23 0.00 0.00 178.31 176.05 3iam h LEU 327 N 0.00 0.00 -1.83 0.59 3.38 -1.45 -2.91 115.31 113.09 3iam h LEU 327 Ca -0.00 -0.30 0.00 0.00 0.09 0.00 0.00 57.88 57.67 3iam h LEU 327 Cb 0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.83 3iam h LEU 327 CO 0.00 0.71 0.34 0.00 0.09 0.00 0.00 178.44 179.58 3iam h ALA 328 N -0.70 1.33 0.01 1.53 0.00 -1.23 0.17 119.26 120.37 3iam h ALA 328 Ca -0.02 0.00 -0.28 0.00 0.00 0.00 0.00 54.91 54.61 3iam h ALA 328 Cb 0.38 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.13 3iam h ALA 328 CO -0.01 -0.33 -1.59 1.25 0.00 0.00 0.00 179.25 178.57 3iam h LEU 329 N 0.00 0.04 -0.68 0.00 5.85 -1.20 -2.87 115.31 116.44 3iam h LEU 329 Ca 0.00 -0.08 -0.13 0.00 0.84 0.00 0.00 57.88 58.51 3iam h LEU 329 Cb 0.68 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.69 3iam h LEU 329 CO 0.00 1.07 -0.40 0.11 -0.34 0.00 0.00 178.44 178.88 3iam h LYS 330 N 0.01 0.56 -0.05 1.25 1.57 -0.50 -3.17 116.57 116.24 3iam h LYS 330 Ca -0.24 -0.28 -0.01 0.00 -1.87 0.00 0.00 60.65 58.25 3iam h LYS 330 Cb 1.97 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 34.29 3iam h LYS 330 CO 0.09 0.86 0.01 1.49 -0.57 0.00 0.00 179.45 181.33 3iam h GLU 331 N 0.46 0.08 0.00 3.15 4.57 -1.31 -0.39 114.58 121.15 3iam h GLU 331 Ca 0.04 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.20 3iam h GLU 331 Cb 0.89 -0.01 0.00 0.00 -0.16 0.00 0.00 28.75 29.47 3iam h GLU 331 CO 0.08 0.32 0.00 0.41 -1.18 0.00 0.00 179.01 178.64 3iam n GLY 332 N -0.40 -0.83 0.00 1.92 0.00 -1.08 -3.10 105.19 101.70 3iam n GLY 332 Ca -0.07 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.89 3iam n GLY 332 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3iam n LEU 333 N -1.33 0.65 0.13 0.99 4.77 -1.08 -4.80 117.00 116.32 3iam n LEU 333 Ca 0.06 -0.76 -0.13 0.00 -0.03 0.00 0.00 56.01 55.14 3iam n LEU 333 Cb 0.13 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.16 3iam n LEU 333 CO 0.12 0.16 0.65 0.50 -1.33 0.00 0.00 177.39 177.49 3iam h LYS 334 N 0.00 -0.54 -2.31 3.23 3.64 -1.00 -2.91 116.57 116.67 3iam h LYS 334 Ca 0.00 0.04 -0.75 0.00 -1.27 0.00 0.00 60.65 58.66 3iam h LYS 334 Cb 0.04 0.12 -0.22 0.00 -0.41 0.00 0.00 32.23 31.77 3iam h LYS 334 CO 0.00 -0.36 1.42 0.39 -2.27 0.00 0.00 179.45 178.63 3iam n GLU 335 N -5.42 4.56 -5.03 1.90 -0.58 -1.26 -4.95 120.64 109.87 3iam n GLU 335 Ca -0.07 -3.93 -0.30 0.00 -0.42 0.00 0.00 57.16 52.45 3iam n GLU 335 Cb 0.33 -2.47 -0.17 0.00 -0.57 0.00 0.00 31.44 28.57 3iam n GLU 335 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3iam s ALA 336 N -3.06 1.88 0.16 0.62 0.00 -1.10 -5.12 121.76 115.14 3iam s ALA 336 Ca 0.47 -0.81 -0.30 0.00 0.00 0.00 0.00 51.96 51.33 3iam s ALA 336 Cb 0.24 -0.71 -0.07 0.00 0.00 0.00 0.00 23.12 22.58 3iam s ALA 336 CO -0.16 0.25 0.94 -0.98 0.00 0.00 0.00 175.76 175.81 3iam s ARG 337 N 0.36 4.75 0.00 0.00 3.03 -1.26 -4.92 118.95 120.91 3iam s ARG 337 Ca -0.15 1.45 0.00 0.00 2.03 0.00 0.00 55.73 59.06 3iam s ARG 337 Cb -0.17 -3.34 0.00 0.00 -1.03 0.00 0.00 34.95 30.42 3iam s ARG 337 CO 0.07 0.34 0.78 0.41 -1.13 0.00 0.00 175.30 175.77 3iam n GLY 338 N 1.94 1.43 0.00 3.88 0.00 -1.26 -1.99 105.19 109.19 3iam n GLY 338 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3iam n GLY 338 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3iam n GLU 339 N 0.83 3.11 0.00 1.61 0.00 -1.26 -4.15 120.64 120.79 3iam n GLU 339 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 57.16 57.29 3iam n GLU 339 Cb 0.34 -0.66 0.61 0.00 0.00 0.00 0.00 31.44 31.73 3iam n GLU 339 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 3iam n GLU 340 N -0.65 0.10 -1.90 5.31 -0.58 -0.84 -4.67 120.64 117.41 3iam n GLU 340 Ca 0.00 0.03 -0.42 0.00 -0.42 0.00 0.00 57.16 56.35 3iam n GLU 340 Cb 0.06 -1.50 -0.03 0.00 -0.57 0.00 0.00 31.44 29.40 3iam n GLU 340 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 3iam s VAL 341 N -2.90 3.34 -0.22 2.62 1.01 -1.18 -1.75 120.40 121.33 3iam s VAL 341 Ca 0.16 0.47 0.00 0.00 0.00 0.00 0.00 61.98 62.62 3iam s VAL 341 Cb 0.18 -3.30 0.03 0.00 0.00 0.00 0.00 36.38 33.29 3iam s VAL 341 CO 0.48 -0.04 -0.13 -0.83 0.00 0.00 0.00 175.10 174.58 3iam s GLY 342 N 3.55 1.53 -0.26 4.51 0.00 0.11 -4.47 107.32 112.29 3iam s GLY 342 Ca 0.78 -1.41 -0.11 0.00 0.00 0.00 0.00 44.72 43.97 3iam s GLY 342 CO 0.33 0.43 0.21 1.08 0.00 0.00 0.00 173.10 175.15 3iam s LEU 343 N 1.27 4.07 -0.30 0.66 1.43 -0.41 0.14 118.68 125.53 3iam s LEU 343 Ca 0.00 0.10 -0.01 0.00 -1.03 0.00 0.00 54.13 53.19 3iam s LEU 343 Cb -0.16 -2.16 0.10 0.00 0.03 0.00 0.00 46.19 44.00 3iam s LEU 343 CO -0.08 -0.02 0.10 -0.31 0.23 0.00 0.00 176.35 176.27 3iam s TYR 344 N 1.48 1.47 0.82 0.29 4.12 -0.49 -1.54 117.35 123.51 3iam s TYR 344 Ca 0.09 -1.57 -0.12 0.00 0.02 0.00 0.00 57.07 55.49 3iam s TYR 344 Cb -0.15 -1.56 0.10 0.00 -1.52 0.00 0.00 41.96 38.83 3iam s TYR 344 CO 0.08 -0.86 1.18 -0.51 0.02 0.00 0.00 175.55 175.47 3iam s LEU 345 N 1.70 2.56 0.70 -1.29 1.43 -0.65 -0.11 118.68 123.02 3iam s LEU 345 Ca 0.09 0.67 -0.05 0.00 -1.03 0.00 0.00 54.13 53.81 3iam s LEU 345 Cb -0.17 -3.11 0.08 0.00 0.03 0.00 0.00 46.19 43.02 3iam s LEU 345 CO -0.26 -2.00 1.00 0.00 0.23 0.00 0.00 176.35 175.32 3iam s ALA 346 N -3.59 3.28 -0.07 4.21 0.00 -1.23 -0.61 121.76 123.75 3iam s ALA 346 Ca 0.64 -1.12 0.31 0.00 0.00 0.00 0.00 51.96 51.78 3iam s ALA 346 Cb -0.10 -2.45 1.30 0.00 0.00 0.00 0.00 23.12 21.87 3iam s ALA 346 CO 0.49 -1.32 1.91 1.12 0.00 0.00 0.00 175.76 177.96 3iam h HIS 347 N -0.56 0.00 -0.76 0.00 2.07 -1.89 -3.00 115.15 111.01 3iam h HIS 347 Ca -0.43 0.00 -0.53 0.00 -2.85 0.00 0.00 60.37 56.56 3iam h HIS 347 Cb 1.30 0.00 -0.35 0.00 2.57 0.00 0.00 27.41 30.93 3iam h HIS 347 CO 0.15 0.00 -0.31 -0.40 -3.07 0.00 0.00 177.93 174.30 3iam n ASP 348 N -2.79 5.31 -4.72 3.10 5.68 -1.26 -1.84 116.55 120.03 3iam n ASP 348 Ca 0.01 -3.77 -0.42 0.00 -0.50 0.00 0.00 54.79 50.11 3iam n ASP 348 Cb 0.26 -0.54 -0.03 0.00 -1.14 0.00 0.00 41.12 39.67 3iam n ASP 348 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3iam s ALA 349 N -3.62 3.38 0.83 2.12 0.00 -1.13 -4.97 121.76 118.37 3iam s ALA 349 Ca 0.54 0.84 -0.13 0.00 0.00 0.00 0.00 51.96 53.21 3iam s ALA 349 Cb 0.43 -3.42 0.09 0.00 0.00 0.00 0.00 23.12 20.23 3iam s ALA 349 CO 0.02 -0.37 1.14 0.25 0.00 0.00 0.00 175.76 176.79 3iam n THR 350 N 3.48 1.54 0.11 0.00 -2.24 -1.26 -4.76 114.28 111.16 3iam n THR 350 Ca 0.07 -0.17 0.19 0.00 -2.27 0.00 0.00 64.05 61.87 3iam n THR 350 Cb 0.46 -1.12 0.76 0.00 -2.10 0.00 0.00 70.33 68.33 3iam n THR 350 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 3iam h LEU 351 N -1.12 0.00 0.10 3.22 5.85 -1.38 -1.27 115.31 120.72 3iam h LEU 351 Ca -0.45 0.00 -0.15 0.00 0.84 0.00 0.00 57.88 58.12 3iam h LEU 351 Cb 1.29 0.00 0.02 0.00 0.37 0.00 0.00 40.66 42.34 3iam h LEU 351 CO 0.44 0.00 -0.65 -0.33 -0.34 0.00 0.00 178.44 177.57 3iam h GLU 352 N 0.00 0.26 -0.20 1.25 3.07 -1.88 -2.85 114.58 114.23 3iam h GLU 352 Ca 0.16 -0.42 0.06 0.00 -0.50 0.00 0.00 59.36 58.67 3iam h GLU 352 Cb 0.81 0.15 -0.01 0.00 -0.84 0.00 0.00 28.75 28.86 3iam h GLU 352 CO -0.00 1.18 0.20 0.93 -1.40 0.00 0.00 179.01 179.92 3iam h GLU 353 N -0.45 0.00 0.05 2.33 5.08 -1.58 -2.11 114.58 117.90 3iam h GLU 353 Ca -0.11 0.00 -0.30 0.00 -1.00 0.00 0.00 59.36 57.95 3iam h GLU 353 Cb 1.49 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.71 3iam h GLU 353 CO 0.12 0.00 -1.67 0.78 -1.00 0.00 0.00 179.01 177.25 3iam h GLY 354 N 0.00 0.12 1.08 -3.84 0.00 -1.43 -2.99 103.07 96.00 3iam h GLY 354 Ca 0.10 -0.30 -0.06 0.00 0.00 0.00 0.00 47.33 47.07 3iam h GLY 354 CO -0.00 0.26 0.22 -2.00 0.00 0.00 0.00 176.54 175.03 3iam h LEU 355 N 0.03 1.07 -0.26 3.11 5.85 -1.14 -1.50 115.31 122.48 3iam h LEU 355 Ca -0.28 -0.20 -0.06 0.00 0.84 0.00 0.00 57.88 58.18 3iam h LEU 355 Cb 2.00 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 42.74 3iam h LEU 355 CO 0.10 1.00 -0.06 0.25 -0.34 0.00 0.00 178.44 179.39 3iam h LEU 356 N 1.10 0.50 -2.23 2.25 5.85 -1.60 -2.05 115.31 119.13 3iam h LEU 356 Ca 0.24 -0.37 -0.01 0.00 0.84 0.00 0.00 57.88 58.58 3iam h LEU 356 Cb 0.31 -0.14 -0.00 0.00 0.37 0.00 0.00 40.66 41.21 3iam h LEU 356 CO -0.01 0.75 -0.06 0.00 -0.34 0.00 0.00 178.44 178.79 3iam h ALA 357 N 0.77 1.37 0.32 1.25 0.00 -1.35 0.29 119.26 121.91 3iam h ALA 357 Ca 0.06 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 3iam h ALA 357 Cb 0.53 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.31 3iam h ALA 357 CO 0.03 0.07 -0.15 1.03 0.00 0.00 0.00 179.25 180.22 3iam h SER 358 N 0.00 -0.36 -0.93 0.00 0.87 -1.03 -2.81 113.55 109.28 3iam h SER 358 Ca -0.00 0.01 0.13 0.00 -1.23 0.00 0.00 61.79 60.70 3iam h SER 358 Cb 0.17 0.09 -0.09 0.00 -0.44 0.00 0.00 62.40 62.13 3iam h SER 358 CO 0.01 0.03 0.55 -0.33 -0.53 0.00 0.00 176.83 176.56 3iam h GLU 359 N -1.00 0.83 0.27 2.24 4.39 -1.14 0.39 114.58 120.56 3iam h GLU 359 Ca -0.04 -0.05 -0.01 0.00 0.34 0.00 0.00 59.36 59.60 3iam h GLU 359 Cb 0.33 -0.19 -0.00 0.00 -0.10 0.00 0.00 28.75 28.79 3iam h GLU 359 CO 0.07 0.55 -0.14 1.25 -1.16 0.00 0.00 179.01 179.58 3iam h LEU 360 N 0.85 -0.35 -0.29 1.33 5.85 -1.07 -0.27 115.31 121.36 3iam h LEU 360 Ca 0.47 0.02 0.00 0.00 0.84 0.00 0.00 57.88 59.21 3iam h LEU 360 Cb 0.53 0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.66 3iam h LEU 360 CO -0.29 -0.24 0.00 0.00 -0.34 0.00 0.00 178.44 177.57 3iam n ALA 361 N -2.28 1.73 -0.01 1.25 0.00 -0.64 0.25 120.51 120.81 3iam n ALA 361 Ca -0.09 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.35 3iam n ALA 361 Cb 0.18 -1.32 -0.00 0.00 0.00 0.00 0.00 19.45 18.31 3iam n ALA 361 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 3iam h LYS 362 N 0.00 -0.00 -0.66 0.00 3.64 0.33 -3.09 116.57 116.79 3iam h LYS 362 Ca 0.00 0.00 0.12 0.00 -1.27 0.00 0.00 60.65 59.50 3iam h LYS 362 Cb 0.34 0.00 -0.09 0.00 -0.41 0.00 0.00 32.23 32.07 3iam h LYS 362 CO 0.00 -0.00 0.20 0.00 -2.27 0.00 0.00 179.45 177.38 3iam h ALA 363 N -1.77 0.84 -1.19 5.00 0.00 -1.04 -3.01 119.26 118.09 3iam h ALA 363 Ca -0.00 0.12 -0.66 0.00 0.00 0.00 0.00 54.91 54.37 3iam h ALA 363 Cb 0.00 0.13 -0.11 0.00 0.00 0.00 0.00 17.79 17.81 3iam h ALA 363 CO 0.00 -0.26 1.68 -1.17 0.00 0.00 0.00 179.25 179.51 3iam s LEU 364 N -10.48 4.04 -0.75 0.00 0.20 0.14 -4.94 118.68 106.89 3iam s LEU 364 Ca -0.13 -2.14 -0.29 0.00 0.69 0.00 0.00 54.13 52.26 3iam s LEU 364 Cb 0.19 -2.53 -0.15 0.00 -0.43 0.00 0.00 46.19 43.27 3iam s LEU 364 CO 0.75 -1.21 2.55 0.29 -0.29 0.00 0.00 176.35 178.44 3iam n LYS 365 N 7.96 0.49 -3.78 1.98 5.02 -1.14 -4.44 118.16 124.24 3iam n LYS 365 Ca 0.39 0.01 -0.10 0.00 -2.02 0.00 0.00 58.31 56.59 3iam n LYS 365 Cb 0.48 -2.37 -0.06 0.00 -0.02 0.00 0.00 35.03 33.05 3iam n LYS 365 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 3iam s THR 366 N 10.30 0.12 -0.14 -0.18 -1.32 -1.17 -4.28 115.64 118.96 3iam s THR 366 Ca 1.19 -0.96 0.15 0.00 -1.21 0.00 0.00 61.69 60.86 3iam s THR 366 Cb -0.78 -1.24 0.41 0.00 -1.51 0.00 0.00 72.50 69.38 3iam s THR 366 CO 0.39 -0.53 1.20 -0.81 -2.21 0.00 0.00 174.62 172.67 3iam n PRO 367 N -0.03 1.11 -2.15 7.08 -0.04 -1.26 -4.78 135.00 134.92 3iam n PRO 367 Ca -0.16 -2.89 -0.29 0.00 -0.04 0.00 0.00 63.50 60.13 3iam n PRO 367 Cb 0.62 -1.14 0.02 0.00 -0.04 0.00 0.00 33.50 32.97 3iam n PRO 367 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 3iam n HIS 368 N -0.65 3.14 -3.97 0.54 8.25 -1.26 -2.91 115.22 118.36 3iam n HIS 368 Ca 0.15 -2.73 -0.33 0.00 -0.26 0.00 0.00 57.72 54.55 3iam n HIS 368 Cb 0.82 -0.46 -0.14 0.00 1.12 0.00 0.00 29.99 31.33 3iam n HIS 368 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 3iam s LEU 369 N -3.67 4.08 0.08 2.41 2.96 -1.26 -1.28 118.68 122.00 3iam s LEU 369 Ca 0.51 -1.59 -0.01 0.00 -0.22 0.00 0.00 54.13 52.83 3iam s LEU 369 Cb 0.42 -1.65 -0.04 0.00 0.50 0.00 0.00 46.19 45.42 3iam s LEU 369 CO -0.14 -0.29 -0.01 -0.62 -1.32 0.00 0.00 176.35 173.97 3iam s ASP 370 N 1.20 0.54 -0.03 3.68 2.15 -0.59 -0.88 116.67 122.74 3iam s ASP 370 Ca -0.02 -1.06 0.07 0.00 0.43 0.00 0.00 52.55 51.97 3iam s ASP 370 Cb -0.20 0.21 -0.02 0.00 -0.30 0.00 0.00 42.92 42.61 3iam s ASP 370 CO -0.04 -0.62 -0.24 0.72 -0.17 0.00 0.00 175.17 174.82 3iam s PHE 371 N -3.91 2.40 0.47 -5.34 -0.71 -1.23 -1.64 117.98 108.02 3iam s PHE 371 Ca 0.12 -0.44 0.37 0.00 -1.04 0.00 0.00 56.93 55.95 3iam s PHE 371 Cb 0.08 -1.53 1.57 0.00 -1.21 0.00 0.00 43.02 41.92 3iam s PHE 371 CO -0.06 -0.03 1.58 0.37 -1.34 0.00 0.00 175.22 175.74 3iam h GLN 372 N 5.55 0.00 0.00 1.99 4.15 -1.03 0.17 115.11 125.94 3iam h GLN 372 Ca -0.42 -0.00 -0.18 0.00 0.77 0.00 0.00 58.65 58.82 3iam h GLN 372 Cb 1.13 -0.00 -0.03 0.00 0.21 0.00 0.00 27.48 28.79 3iam h GLN 372 CO 0.48 0.00 -1.53 0.41 -1.93 0.00 0.00 178.83 176.26 3iam n GLY 373 N -1.63 -1.16 1.12 2.39 0.00 -1.26 -4.85 105.19 99.81 3iam n GLY 373 Ca 0.42 -0.15 -0.18 0.00 0.00 0.00 0.00 46.02 46.11 3iam n GLY 373 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3iam n ARG 374 N -2.86 0.00 -4.02 1.61 0.63 0.59 -4.49 116.66 108.12 3iam n ARG 374 Ca -0.12 0.00 -0.30 0.00 -0.92 0.00 0.00 57.85 56.52 3iam n ARG 374 Cb 0.87 -0.43 -0.06 0.00 0.45 0.00 0.00 32.46 33.29 3iam n ARG 374 CO 0.00 0.00 0.00 0.95 -2.51 0.00 0.00 177.63 176.07 3iam s THR 375 N -0.10 4.78 0.28 5.15 -4.23 -1.26 -5.01 115.64 115.24 3iam s THR 375 Ca 0.27 -0.71 0.01 0.00 -1.18 0.00 0.00 61.69 60.07 3iam s THR 375 Cb -0.38 -3.34 0.31 0.00 1.34 0.00 0.00 72.50 70.43 3iam s THR 375 CO 0.18 0.09 1.64 0.00 -0.54 0.00 0.00 174.62 175.99 3iam h ALA 376 N 3.06 1.22 -3.00 3.99 0.00 -1.82 -3.36 119.26 119.35 3iam h ALA 376 Ca -0.46 0.23 -0.66 0.00 0.00 0.00 0.00 54.91 54.01 3iam h ALA 376 Cb 1.17 0.33 -0.26 0.00 0.00 0.00 0.00 17.79 19.03 3iam h ALA 376 CO 0.68 -0.46 -0.67 0.00 0.00 0.00 0.00 179.25 178.80 3iam s ALA 377 N -5.96 2.99 -0.30 0.00 0.00 -0.19 -3.06 121.76 115.24 3iam s ALA 377 Ca -0.12 -1.23 -0.41 0.00 0.00 0.00 0.00 51.96 50.20 3iam s ALA 377 Cb 0.25 -1.94 -0.16 0.00 0.00 0.00 0.00 23.12 21.27 3iam s ALA 377 CO 0.77 -0.58 1.72 -2.30 0.00 0.00 0.00 175.76 175.37 3iam n PRO 378 N 4.85 1.01 0.31 0.00 -0.02 -1.26 -4.81 135.00 135.08 3iam n PRO 378 Ca -0.17 0.37 0.18 0.00 -2.02 0.00 0.00 63.50 61.87 3iam n PRO 378 Cb 0.50 -2.03 1.03 0.00 -0.02 0.00 0.00 33.50 32.98 3iam n PRO 378 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3iam h ALA 379 N 6.92 1.30 0.00 3.55 0.00 -1.92 0.16 119.26 129.27 3iam h ALA 379 Ca -0.46 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.44 3iam h ALA 379 Cb 1.32 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.11 3iam h ALA 379 CO 0.96 0.01 0.00 0.43 0.00 0.00 0.00 179.25 180.65 3iam n SER 380 N -3.52 0.00 -0.04 0.00 7.64 -1.26 -3.07 113.62 113.37 3iam n SER 380 Ca -0.03 -1.80 -0.14 0.00 1.01 0.00 0.00 58.87 57.91 3iam n SER 380 Cb 0.09 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.26 3iam n SER 380 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 3iam h LEU 381 N 0.00 0.87 -9.60 -3.43 7.12 -0.83 -1.90 115.31 107.54 3iam h LEU 381 Ca 0.00 -0.51 -0.67 0.00 0.13 0.00 0.00 57.88 56.84 3iam h LEU 381 Cb 0.00 -0.25 -0.08 0.00 -0.53 0.00 0.00 40.66 39.80 3iam h LEU 381 CO 0.00 1.29 -0.51 -0.36 -0.13 0.00 0.00 178.44 178.73 3iam s PHE 382 N -3.94 3.51 -0.29 1.25 0.40 -1.18 -4.76 117.98 112.98 3iam s PHE 382 Ca -0.10 0.44 -0.28 0.00 -0.60 0.00 0.00 56.93 56.39 3iam s PHE 382 Cb 0.10 -1.89 -0.03 0.00 0.51 0.00 0.00 43.02 41.71 3iam s PHE 382 CO 0.88 0.68 1.86 -1.25 0.70 0.00 0.00 175.22 178.08 3iam s PRO 383 N -1.16 3.37 0.17 0.24 0.04 -1.26 -4.92 135.00 131.49 3iam s PRO 383 Ca 0.17 1.59 -0.34 0.00 0.04 0.00 0.00 61.00 62.46 3iam s PRO 383 Cb -0.12 -4.21 -0.14 0.00 0.04 0.00 0.00 34.50 30.07 3iam s PRO 383 CO 0.06 -1.81 1.45 -2.30 0.04 0.00 0.00 177.00 174.44 3iam n PRO 384 N 8.38 1.86 -4.10 0.56 -0.02 -1.26 -1.95 135.00 138.47 3iam n PRO 384 Ca 0.24 0.67 -0.35 0.00 -2.02 0.00 0.00 63.50 62.03 3iam n PRO 384 Cb 0.46 -2.36 -0.09 0.00 -0.02 0.00 0.00 33.50 31.49 3iam n PRO 384 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3iam s ALA 385 N 0.47 3.47 0.32 3.55 0.00 -0.78 -4.77 121.76 124.03 3iam s ALA 385 Ca 0.76 -0.74 -0.29 0.00 0.00 0.00 0.00 51.96 51.70 3iam s ALA 385 Cb -0.73 -1.79 -0.13 0.00 0.00 0.00 0.00 23.12 20.47 3iam s ALA 385 CO 0.44 0.41 1.29 0.45 0.00 0.00 0.00 175.76 178.34 3iam n SER 386 N 2.75 2.65 0.21 0.00 2.88 -1.26 -4.70 113.62 116.15 3iam n SER 386 Ca -0.18 1.19 0.15 0.00 -1.33 0.00 0.00 58.87 58.70 3iam n SER 386 Cb 0.53 -1.46 0.69 0.00 -0.75 0.00 0.00 64.21 63.22 3iam n SER 386 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 3iam h LEU 387 N 2.79 0.00 0.00 2.46 5.85 -1.89 -0.09 115.31 124.43 3iam h LEU 387 Ca -0.45 0.00 -0.13 0.00 0.84 0.00 0.00 57.88 58.14 3iam h LEU 387 Cb 1.29 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.30 3iam h LEU 387 CO 0.65 0.00 -0.88 -0.08 -0.34 0.00 0.00 178.44 177.79 3iam h GLU 388 N 0.00 0.00 -0.37 1.25 4.81 -1.89 -3.31 114.58 115.07 3iam h GLU 388 Ca 0.00 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.19 3iam h GLU 388 Cb 0.23 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.59 3iam h GLU 388 CO 0.00 0.42 0.07 -0.44 -0.73 0.00 0.00 179.01 178.32 3iam h ASP 389 N 0.00 0.51 -0.70 1.04 3.32 -1.35 -2.07 116.42 117.17 3iam h ASP 389 Ca -0.06 -0.08 0.02 0.00 0.02 0.00 0.00 57.03 56.93 3iam h ASP 389 Cb 1.46 -0.13 -0.04 0.00 0.22 0.00 0.00 39.33 40.84 3iam h ASP 389 CO 0.06 0.53 0.46 0.25 -1.72 0.00 0.00 179.24 178.82 3iam h LEU 390 N 0.54 0.77 -0.77 1.55 5.85 -1.64 -0.20 115.31 121.42 3iam h LEU 390 Ca 0.12 -0.01 -0.07 0.00 0.84 0.00 0.00 57.88 58.76 3iam h LEU 390 Cb 0.24 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.06 3iam h LEU 390 CO 0.00 0.54 0.12 -0.07 -0.34 0.00 0.00 178.44 178.69 3iam h LEU 391 N 0.90 1.00 -0.89 2.25 3.38 -1.55 -3.08 115.31 117.33 3iam h LEU 391 Ca 0.27 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 58.01 3iam h LEU 391 Cb -0.03 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.46 3iam h LEU 391 CO -0.07 0.99 0.00 0.00 0.09 0.00 0.00 178.44 179.45 3iam n GLN 392 N -4.22 1.60 -1.56 1.13 6.02 -0.35 -4.84 117.38 115.16 3iam n GLN 392 Ca 0.04 -0.88 -0.30 0.00 -0.01 0.00 0.00 57.00 55.85 3iam n GLN 392 Cb 0.28 -1.44 0.23 0.00 1.02 0.00 0.00 30.24 30.33 3iam n GLN 392 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3iam s ALA 393 N -1.92 1.44 -0.04 -1.58 0.00 -0.23 -5.02 121.76 114.41 3iam s ALA 393 Ca 0.36 -1.23 0.02 0.00 0.00 0.00 0.00 51.96 51.11 3iam s ALA 393 Cb 0.19 -2.77 -0.04 0.00 0.00 0.00 0.00 23.12 20.50 3iam s ALA 393 CO 0.30 -3.13 -0.01 -0.25 0.00 0.00 0.00 175.76 172.68 3iam n ASP 394 N -4.33 3.91 -3.78 0.00 8.00 -0.94 -5.00 116.55 114.40 3iam n ASP 394 Ca 0.16 -0.01 -0.13 0.00 0.71 0.00 0.00 54.79 55.53 3iam n ASP 394 Cb 0.59 0.35 -0.09 0.00 -0.02 0.00 0.00 41.12 41.96 3iam n ASP 394 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 3iam s PHE 395 N -2.09 -0.13 -0.25 1.24 5.36 -1.26 -4.82 117.98 116.02 3iam s PHE 395 Ca -0.04 0.16 0.03 0.00 -0.96 0.00 0.00 56.93 56.12 3iam s PHE 395 Cb 0.01 0.07 0.06 0.00 -0.34 0.00 0.00 43.02 42.82 3iam s PHE 395 CO 0.14 -0.39 -0.11 0.00 -1.46 0.00 0.00 175.22 173.40 3iam s ALA 396 N -1.48 2.48 -0.37 11.12 0.00 0.38 -1.43 121.76 132.45 3iam s ALA 396 Ca -0.13 -1.67 -0.18 0.00 0.00 0.00 0.00 51.96 49.98 3iam s ALA 396 Cb -0.05 -1.53 0.00 0.00 0.00 0.00 0.00 23.12 21.54 3iam s ALA 396 CO 0.03 -1.11 0.51 -1.17 0.00 0.00 0.00 175.76 174.02 3iam s LEU 397 N 1.15 4.46 -0.14 0.00 2.96 -0.92 -0.70 118.68 125.49 3iam s LEU 397 Ca -0.07 -0.20 0.02 0.00 -0.22 0.00 0.00 54.13 53.66 3iam s LEU 397 Cb -0.19 -2.56 0.02 0.00 0.50 0.00 0.00 46.19 43.95 3iam s LEU 397 CO -0.06 -0.54 -0.19 -0.69 -1.32 0.00 0.00 176.35 173.56 3iam s VAL 398 N 2.40 1.84 -0.31 1.68 1.01 -0.47 -0.46 120.40 126.09 3iam s VAL 398 Ca 0.18 -0.83 0.02 0.00 0.00 0.00 0.00 61.98 61.34 3iam s VAL 398 Cb -0.16 -1.66 0.09 0.00 0.00 0.00 0.00 36.38 34.65 3iam s VAL 398 CO 0.14 0.51 0.05 -0.76 0.00 0.00 0.00 175.10 175.04 3iam s LEU 399 N 1.06 3.47 0.00 3.92 1.02 -0.01 -1.11 118.68 127.02 3iam s LEU 399 Ca -0.03 -1.79 0.00 0.00 0.02 0.00 0.00 54.13 52.33 3iam s LEU 399 Cb -0.14 -1.28 0.00 0.00 0.02 0.00 0.00 46.19 44.79 3iam s LEU 399 CO -0.05 -0.36 0.00 0.61 0.02 0.00 0.00 176.35 176.56 3iam n GLY 400 N 4.54 0.80 3.08 -3.19 0.00 -0.97 -2.50 105.19 106.96 3iam n GLY 400 Ca -0.01 -2.23 -0.35 0.00 0.00 0.00 0.00 46.02 43.43 3iam n GLY 400 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3iam s ASP 401 N -0.89 5.09 0.56 1.61 -1.08 -1.26 -4.64 116.67 116.06 3iam s ASP 401 Ca 0.00 -2.19 0.27 0.00 -0.52 0.00 0.00 52.55 50.11 3iam s ASP 401 Cb 0.00 -1.77 1.50 0.00 -1.46 0.00 0.00 42.92 41.18 3iam s ASP 401 CO 0.00 -0.47 2.02 -0.65 0.52 0.00 0.00 175.17 176.59 3iam h PRO 402 N 7.77 0.00 -0.20 4.34 0.11 -1.95 -1.05 132.00 141.01 3iam h PRO 402 Ca -0.09 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.01 3iam h PRO 402 Cb 1.02 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.12 3iam h PRO 402 CO 0.65 0.00 0.09 1.15 -0.21 0.00 0.00 178.00 179.68 3iam h THR 403 N 0.00 1.15 0.15 -1.15 2.02 -1.85 -2.10 112.91 111.14 3iam h THR 403 Ca 0.17 -0.46 -0.29 0.00 0.77 0.00 0.00 66.41 66.61 3iam h THR 403 Cb 0.81 1.09 0.01 0.00 -1.74 0.00 0.00 68.15 68.32 3iam h THR 403 CO -0.00 0.15 -1.40 -0.33 0.37 0.00 0.00 175.52 174.31 3iam h GLU 404 N 0.18 0.33 0.03 6.66 4.39 -1.55 -3.23 114.58 121.39 3iam h GLU 404 Ca 0.07 -0.56 -0.00 0.00 0.34 0.00 0.00 59.36 59.21 3iam h GLU 404 Cb 0.16 0.21 0.00 0.00 -0.10 0.00 0.00 28.75 29.02 3iam h GLU 404 CO -0.01 1.27 -0.01 0.93 -1.16 0.00 0.00 179.01 180.03 3iam h GLU 405 N -0.16 -0.04 -2.18 2.33 5.08 -1.39 -3.19 114.58 115.02 3iam h GLU 405 Ca -0.28 0.00 -0.58 0.00 -1.00 0.00 0.00 59.36 57.50 3iam h GLU 405 Cb 1.87 0.01 -0.40 0.00 0.50 0.00 0.00 28.75 30.73 3iam h GLU 405 CO 0.13 0.65 -0.94 0.00 -1.00 0.00 0.00 179.01 177.85 3iam n ALA 406 N -2.54 2.93 -0.32 3.43 0.00 -0.83 -4.65 120.51 118.52 3iam n ALA 406 Ca -0.09 -3.72 0.07 0.00 0.00 0.00 0.00 53.44 49.71 3iam n ALA 406 Cb 0.35 -0.83 0.15 0.00 0.00 0.00 0.00 19.45 19.12 3iam n ALA 406 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3iam n PRO 407 N 1.58 -0.08 0.16 0.00 -0.02 -0.97 -0.44 135.00 135.22 3iam n PRO 407 Ca 0.24 1.40 0.12 0.00 -2.02 0.00 0.00 63.50 63.25 3iam n PRO 407 Cb 0.48 -2.12 0.56 0.00 -0.02 0.00 0.00 33.50 32.41 3iam n PRO 407 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 3iam h ILE 408 N 0.00 0.00 -0.25 4.25 5.03 -1.88 -0.87 117.51 123.78 3iam h ILE 408 Ca 0.46 -0.14 -0.03 0.00 -0.12 0.00 0.00 64.86 65.02 3iam h ILE 408 Cb 0.76 0.79 -0.01 0.00 -3.03 0.00 0.00 36.82 35.32 3iam h ILE 408 CO -0.92 0.00 0.02 -0.07 -0.68 0.00 0.00 178.15 176.50 3iam h LEU 409 N 0.00 0.33 -1.42 1.44 3.38 -1.01 -1.60 115.31 116.43 3iam h LEU 409 Ca 0.00 -0.04 0.03 0.00 0.09 0.00 0.00 57.88 57.96 3iam h LEU 409 Cb 0.21 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 40.84 3iam h LEU 409 CO 0.00 0.37 0.42 -0.74 0.09 0.00 0.00 178.44 178.58 3iam h HIS 410 N 0.35 0.74 0.00 1.13 2.76 -1.32 0.10 115.15 118.91 3iam h HIS 410 Ca 0.08 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.27 3iam h HIS 410 Cb 0.21 -0.25 0.00 0.00 1.55 0.00 0.00 27.41 28.92 3iam h HIS 410 CO 0.01 0.43 -0.12 -0.07 -1.30 0.00 0.00 177.93 176.88 3iam h LEU 411 N 0.77 0.00 0.00 0.26 3.38 -1.42 -2.30 115.31 116.00 3iam h LEU 411 Ca 0.25 -0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.19 3iam h LEU 411 Cb 0.05 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.80 3iam h LEU 411 CO -0.07 0.00 -0.17 0.03 0.09 0.00 0.00 178.44 178.33 3iam h ARG 412 N 0.00 0.00 -0.74 1.13 2.47 -0.95 -3.23 114.38 113.07 3iam h ARG 412 Ca 0.00 0.00 0.21 0.00 -1.26 0.00 0.00 59.98 58.93 3iam h ARG 412 Cb 0.97 0.00 -0.03 0.00 -1.65 0.00 0.00 29.97 29.26 3iam h ARG 412 CO 0.00 0.68 0.57 -0.07 0.56 0.00 0.00 179.97 181.71 3iam h LEU 413 N -1.00 0.00 0.50 3.04 3.38 -0.82 0.36 115.31 120.76 3iam h LEU 413 Ca -0.04 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 3iam h LEU 413 Cb 0.74 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.50 3iam h LEU 413 CO -0.02 0.00 -0.24 -1.28 0.09 0.00 0.00 178.44 176.99 3iam h SER 414 N 0.00 -0.57 -0.14 -0.43 0.87 -1.50 -0.01 113.55 111.77 3iam h SER 414 Ca 0.35 -0.01 0.03 0.00 -1.23 0.00 0.00 61.79 60.93 3iam h SER 414 Cb 1.49 0.15 -0.02 0.00 -0.44 0.00 0.00 62.40 63.57 3iam h SER 414 CO -0.00 -0.36 -0.02 -0.33 -0.53 0.00 0.00 176.83 175.59 3iam h GLU 415 N -0.73 0.02 -0.34 2.24 5.08 -0.53 -3.01 114.58 117.32 3iam h GLU 415 Ca -0.07 -0.00 0.07 0.00 -1.00 0.00 0.00 59.36 58.36 3iam h GLU 415 Cb 0.54 -0.01 -0.08 0.00 0.50 0.00 0.00 28.75 29.70 3iam h GLU 415 CO 0.11 0.02 -0.33 0.35 -1.00 0.00 0.00 179.01 178.16 3iam h PHE 416 N 0.02 -0.92 -0.05 4.33 3.57 -0.47 -1.37 116.94 122.05 3iam h PHE 416 Ca 0.07 0.05 0.02 0.00 3.53 0.00 0.00 57.97 61.64 3iam h PHE 416 Cb 0.09 0.45 -0.00 0.00 2.79 0.00 0.00 35.95 39.28 3iam h PHE 416 CO -0.16 -0.39 0.15 0.28 -2.23 0.00 0.00 178.31 175.96 3iam h VAL 417 N -0.29 0.16 -0.55 1.41 2.07 -0.86 0.84 116.25 119.03 3iam h VAL 417 Ca 0.15 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.67 3iam h VAL 417 Cb 0.54 0.86 0.00 0.00 -1.52 0.00 0.00 31.29 31.17 3iam h VAL 417 CO -0.50 0.00 0.00 0.54 0.02 0.00 0.00 177.57 177.63 3iam n ARG 418 N -3.27 2.52 -1.48 1.57 1.74 -0.57 -2.26 116.66 114.91 3iam n ARG 418 Ca -0.01 -2.33 -0.16 0.00 -0.77 0.00 0.00 57.85 54.57 3iam n ARG 418 Cb 0.23 -1.52 -0.07 0.00 -1.02 0.00 0.00 32.46 30.08 3iam n ARG 418 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 3iam n ASP 419 N 1.44 -5.30 -4.70 0.55 9.92 0.29 -4.94 116.55 113.81 3iam n ASP 419 Ca 0.21 0.41 -0.42 0.00 -0.53 0.00 0.00 54.79 54.46 3iam n ASP 419 Cb 0.58 -4.25 -0.03 0.00 -0.64 0.00 0.00 41.12 36.77 3iam n ASP 419 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 3iam s LEU 420 N -3.75 4.35 0.17 0.64 1.43 -0.88 -5.02 118.68 115.62 3iam s LEU 420 Ca 0.00 2.25 0.09 0.00 -1.03 0.00 0.00 54.13 55.44 3iam s LEU 420 Cb 0.00 -3.57 -0.04 0.00 0.03 0.00 0.00 46.19 42.60 3iam s LEU 420 CO 0.00 -0.69 -0.20 -0.54 0.23 0.00 0.00 176.35 175.15 3iam s LYS 421 N 1.73 1.34 -0.09 1.70 1.02 -1.26 -4.47 119.74 119.71 3iam s LYS 421 Ca 0.65 -1.44 -0.41 0.00 0.02 0.00 0.00 55.97 54.79 3iam s LYS 421 Cb -0.35 -1.48 -0.19 0.00 -0.52 0.00 0.00 37.83 35.29 3iam s LYS 421 CO 0.29 0.31 1.24 -2.30 -0.92 0.00 0.00 175.35 173.97 3iam n PRO 422 N 0.29 0.24 -2.30 -1.68 -0.02 -1.26 -4.89 135.00 125.39 3iam n PRO 422 Ca -0.13 0.09 -0.35 0.00 -2.02 0.00 0.00 63.50 61.09 3iam n PRO 422 Cb 0.57 -1.62 -0.00 0.00 -0.02 0.00 0.00 33.50 32.42 3iam n PRO 422 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 3iam s PRO 423 N 0.77 3.44 0.43 0.52 0.04 -1.26 -5.01 135.00 133.93 3iam s PRO 423 Ca 0.93 1.52 -0.25 0.00 0.04 0.00 0.00 61.00 63.24 3iam s PRO 423 Cb -1.25 -2.03 -0.08 0.00 0.04 0.00 0.00 34.50 31.18 3iam s PRO 423 CO 0.60 -0.76 1.23 -1.58 0.04 0.00 0.00 177.00 176.53 3iam s HIS 424 N -1.89 2.87 -0.12 0.56 5.65 -1.26 -5.01 115.29 116.09 3iam s HIS 424 Ca 0.71 1.48 -0.12 0.00 0.25 0.00 0.00 55.06 57.37 3iam s HIS 424 Cb -0.21 -3.53 -0.05 0.00 -1.18 0.00 0.00 32.58 27.61 3iam s HIS 424 CO 0.26 -1.77 0.28 1.03 -0.65 0.00 0.00 174.74 173.89 3iam s ARG 425 N -2.40 4.02 0.49 2.88 0.52 -1.26 -4.60 118.95 118.59 3iam s ARG 425 Ca 0.59 0.11 0.05 0.00 -0.52 0.00 0.00 55.73 55.96 3iam s ARG 425 Cb -0.34 -3.33 0.05 0.00 0.52 0.00 0.00 34.95 31.85 3iam s ARG 425 CO 0.42 0.45 0.45 0.66 0.02 0.00 0.00 175.30 177.31 3iam n TYR 426 N 2.87 -1.15 0.28 -0.53 4.02 -0.24 -4.95 117.16 117.45 3iam n TYR 426 Ca -0.14 -1.99 0.14 0.00 -0.01 0.00 0.00 57.90 55.90 3iam n TYR 426 Cb 0.53 -0.42 0.84 0.00 -0.02 0.00 0.00 39.34 40.27 3iam n TYR 426 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 176.86 174.94 3iam h ASN 427 N 0.44 0.00 -0.20 7.72 2.35 -1.89 -1.07 115.58 122.93 3iam h ASN 427 Ca -0.29 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.46 3iam h ASN 427 Cb 1.11 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.48 3iam h ASN 427 CO 0.44 0.05 0.00 0.00 -1.65 0.00 0.00 177.43 176.27 3iam n HIS 428 N -3.78 0.24 0.00 1.19 1.44 -1.26 -5.04 115.22 108.01 3iam n HIS 428 Ca -0.03 -0.12 0.00 0.00 -2.01 0.00 0.00 57.72 55.56 3iam n HIS 428 Cb 0.14 -0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.25 3iam n HIS 428 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 3iam n GLY 429 N 1.40 0.44 3.72 -1.39 0.00 -0.41 -4.94 105.19 104.02 3iam n GLY 429 Ca 0.16 -1.29 -0.42 0.00 0.00 0.00 0.00 46.02 44.48 3iam n GLY 429 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3iam s THR 430 N 0.00 4.70 0.46 2.61 2.01 -1.26 -1.08 115.64 123.08 3iam s THR 430 Ca 0.00 2.02 -0.22 0.00 0.31 0.00 0.00 61.69 63.80 3iam s THR 430 Cb 0.00 -4.29 -0.11 0.00 0.01 0.00 0.00 72.50 68.11 3iam s THR 430 CO 0.00 0.20 0.76 -0.81 -0.69 0.00 0.00 174.62 174.09 3iam n PRO 431 N 3.57 0.89 0.05 4.92 -0.04 -1.26 -4.92 135.00 138.20 3iam n PRO 431 Ca 0.05 0.33 0.11 0.00 -0.04 0.00 0.00 63.50 63.95 3iam n PRO 431 Cb 0.50 -1.80 0.03 0.00 -0.04 0.00 0.00 33.50 32.20 3iam n PRO 431 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 3iam n PHE 432 N -0.91 0.44 -3.40 0.54 3.72 -1.26 -4.46 117.46 112.13 3iam n PHE 432 Ca 0.11 0.13 -0.22 0.00 -0.05 0.00 0.00 57.45 57.42 3iam n PHE 432 Cb 0.41 -0.59 -0.09 0.00 -0.94 0.00 0.00 39.48 38.27 3iam n PHE 432 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3iam s ALA 433 N -3.25 0.11 -0.46 4.37 0.00 -1.26 -3.53 121.76 117.74 3iam s ALA 433 Ca 0.02 -1.35 -0.19 0.00 0.00 0.00 0.00 51.96 50.45 3iam s ALA 433 Cb 0.13 -1.88 0.04 0.00 0.00 0.00 0.00 23.12 21.41 3iam s ALA 433 CO 0.79 -2.14 0.58 0.34 0.00 0.00 0.00 175.76 175.33 3iam s ASP 434 N 1.27 6.25 0.00 0.00 2.15 -1.26 -4.14 116.67 120.93 3iam s ASP 434 Ca 0.18 -0.68 0.07 0.00 0.43 0.00 0.00 52.55 52.55 3iam s ASP 434 Cb -0.18 -2.28 0.40 0.00 -0.30 0.00 0.00 42.92 40.56 3iam s ASP 434 CO -0.01 -0.77 0.98 0.18 -0.17 0.00 0.00 175.17 175.38 3iam n LEU 435 N 6.04 0.00 -0.03 -1.34 7.99 -1.26 -2.45 117.00 125.96 3iam n LEU 435 Ca -0.05 0.13 -0.15 0.00 -0.01 0.00 0.00 56.01 55.93 3iam n LEU 435 Cb 0.47 -0.13 -0.11 0.00 -0.11 0.00 0.00 43.42 43.54 3iam n LEU 435 CO 0.52 -0.10 0.43 -0.61 -1.51 0.00 0.00 177.39 176.12 3iam h GLN 436 N 0.00 0.16 -6.19 3.23 4.15 -1.90 -3.40 115.11 111.17 3iam h GLN 436 Ca 0.00 -0.16 -0.52 0.00 0.77 0.00 0.00 58.65 58.74 3iam h GLN 436 Cb 0.03 0.04 -0.06 0.00 0.21 0.00 0.00 27.48 27.70 3iam h GLN 436 CO 0.00 0.87 1.20 0.42 -1.93 0.00 0.00 178.83 179.39 3iam s ILE 437 N -3.27 3.55 0.37 2.39 1.01 -1.02 -4.99 121.20 119.24 3iam s ILE 437 Ca -0.16 0.33 -0.14 0.00 0.00 0.00 0.00 60.65 60.69 3iam s ILE 437 Cb 0.01 -4.43 -0.08 0.00 0.01 0.00 0.00 42.46 37.97 3iam s ILE 437 CO 0.73 -1.37 0.77 -0.54 0.00 0.00 0.00 174.94 174.54 3iam s LYS 438 N 6.32 3.92 0.63 2.79 -0.14 -1.26 -3.79 119.74 128.21 3iam s LYS 438 Ca 0.51 0.63 -0.17 0.00 -1.36 0.00 0.00 55.97 55.57 3iam s LYS 438 Cb -0.10 -2.39 -0.02 0.00 -1.68 0.00 0.00 37.83 33.64 3iam s LYS 438 CO 0.18 0.05 1.19 -2.00 -0.76 0.00 0.00 175.35 174.01 3iam s GLU 439 N -3.39 2.81 -1.34 1.68 2.12 -1.26 -3.56 118.70 115.76 3iam s GLU 439 Ca 0.54 1.73 -0.02 0.00 0.36 0.00 0.00 54.97 57.58 3iam s GLU 439 Cb -0.10 -1.92 0.01 0.00 0.26 0.00 0.00 34.13 32.38 3iam s GLU 439 CO 0.23 -1.31 0.13 -2.13 -0.54 0.00 0.00 175.26 171.65 3iam n ARG 440 N -1.92 -2.54 -1.64 4.30 3.00 -1.26 -4.87 116.66 111.73 3iam n ARG 440 Ca 0.13 0.73 -0.47 0.00 -0.00 0.00 0.00 57.85 58.24 3iam n ARG 440 Cb 0.50 -5.39 -0.04 0.00 0.00 0.00 0.00 32.46 27.53 3iam n ARG 440 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.63 176.30 3iam n MET 441 N -3.12 1.74 -2.30 -0.14 2.81 -1.23 -4.94 117.12 109.94 3iam n MET 441 Ca -0.15 0.62 -0.42 0.00 -1.81 0.00 0.00 57.70 55.94 3iam n MET 441 Cb 0.62 -2.27 -0.03 0.00 -0.71 0.00 0.00 33.22 30.84 3iam n MET 441 CO 0.00 0.00 0.00 -1.25 1.51 0.00 0.00 175.97 176.23 3iam s PRO 442 N 0.03 4.38 -0.01 0.03 0.04 -1.26 -5.02 135.00 133.18 3iam s PRO 442 Ca 0.74 1.91 -0.14 0.00 0.04 0.00 0.00 61.00 63.54 3iam s PRO 442 Cb -0.74 -3.32 -0.06 0.00 0.04 0.00 0.00 34.50 30.42 3iam s PRO 442 CO 0.47 -0.35 0.40 1.03 0.04 0.00 0.00 177.00 178.58 3iam s ARG 443 N 1.16 3.90 -0.15 4.56 0.52 -1.26 -4.84 118.95 122.85 3iam s ARG 443 Ca 0.61 0.39 -0.26 0.00 -0.52 0.00 0.00 55.73 55.95 3iam s ARG 443 Cb -0.33 -3.22 -0.02 0.00 0.52 0.00 0.00 34.95 31.90 3iam s ARG 443 CO 0.29 0.68 0.86 1.03 0.02 0.00 0.00 175.30 178.19 3iam s ARG 444 N -1.03 4.34 0.00 3.54 0.52 -0.96 -4.95 118.95 120.41 3iam s ARG 444 Ca 0.23 1.09 0.26 0.00 -0.52 0.00 0.00 55.73 56.79 3iam s ARG 444 Cb -0.16 -3.56 0.80 0.00 0.52 0.00 0.00 34.95 32.55 3iam s ARG 444 CO 0.13 -0.29 1.60 0.25 0.02 0.00 0.00 175.30 177.01 3iam n THR 445 N 4.61 0.05 -0.68 0.02 -2.24 -1.26 -4.20 114.28 110.59 3iam n THR 445 Ca 0.05 -0.34 0.08 0.00 -2.27 0.00 0.00 64.05 61.57 3iam n THR 445 Cb 0.49 0.72 0.25 0.00 -2.10 0.00 0.00 70.33 69.68 3iam n THR 445 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 3iam n ASP 446 N 0.51 3.83 -0.16 3.42 5.75 -1.26 -0.91 116.55 127.72 3iam n ASP 446 Ca 0.18 -2.61 0.02 0.00 -0.01 0.00 0.00 54.79 52.36 3iam n ASP 446 Cb 0.42 -0.46 0.01 0.00 -1.03 0.00 0.00 41.12 40.06 3iam n ASP 446 CO 0.00 0.00 0.00 1.17 -0.11 0.00 0.00 177.20 178.26 3iam n LYS 447 N 0.11 0.76 -3.92 0.11 4.81 -1.26 -5.01 118.16 113.76 3iam n LYS 447 Ca 0.19 -0.64 -0.10 0.00 -0.87 0.00 0.00 58.31 56.89 3iam n LYS 447 Cb 0.77 -1.02 -0.10 0.00 0.02 0.00 0.00 35.03 34.70 3iam n LYS 447 CO 0.00 0.00 0.00 1.41 1.17 0.00 0.00 177.40 179.98 3iam s MET 448 N -0.58 0.49 0.02 1.64 1.75 -1.26 -0.47 119.30 120.88 3iam s MET 448 Ca 0.05 -0.59 0.05 0.00 -1.25 0.00 0.00 55.69 53.94 3iam s MET 448 Cb 0.04 0.19 -0.02 0.00 2.84 0.00 0.00 34.83 37.88 3iam s MET 448 CO 0.08 -0.11 -0.14 0.00 -0.65 0.00 0.00 175.02 174.20 3iam s ALA 449 N -1.90 1.18 -0.03 4.11 0.00 0.13 -4.15 121.76 121.10 3iam s ALA 449 Ca -0.11 -0.73 0.02 0.00 0.00 0.00 0.00 51.96 51.14 3iam s ALA 449 Cb -0.06 -0.24 0.01 0.00 0.00 0.00 0.00 23.12 22.84 3iam s ALA 449 CO -0.01 0.25 -0.07 -1.17 0.00 0.00 0.00 175.76 174.76 3iam s LEU 450 N -0.77 1.66 -0.32 0.00 1.98 -0.71 -1.37 118.68 119.15 3iam s LEU 450 Ca 0.03 -0.15 -0.02 0.00 -2.89 0.00 0.00 54.13 51.11 3iam s LEU 450 Cb -0.07 -0.46 0.12 0.00 0.66 0.00 0.00 46.19 46.45 3iam s LEU 450 CO 0.00 0.02 0.19 -0.36 -1.89 0.00 0.00 176.35 174.31 3iam s PHE 451 N 0.40 0.37 -0.00 5.38 0.08 -0.27 -2.26 117.98 121.68 3iam s PHE 451 Ca -0.06 -1.10 0.01 0.00 0.12 0.00 0.00 56.93 55.90 3iam s PHE 451 Cb -0.10 -0.84 0.00 0.00 -0.57 0.00 0.00 43.02 41.52 3iam s PHE 451 CO 0.00 -0.85 -0.03 0.00 -0.10 0.00 0.00 175.22 174.25 3iam s ALA 452 N 1.69 0.27 -0.69 5.36 0.00 -1.24 -2.28 121.76 124.86 3iam s ALA 452 Ca 0.13 -0.11 0.00 0.00 0.00 0.00 0.00 51.96 51.98 3iam s ALA 452 Cb -0.18 -0.09 0.00 0.00 0.00 0.00 0.00 23.12 22.85 3iam s ALA 452 CO -0.20 0.05 0.00 -0.35 0.00 0.00 0.00 175.76 175.26 3iam n PRO 453 N 3.11 0.00 -3.83 0.00 -0.04 -1.26 -3.90 135.00 129.07 3iam n PRO 453 Ca -0.14 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.24 3iam n PRO 453 Cb 0.58 -0.97 0.01 0.00 -0.04 0.00 0.00 33.50 33.08 3iam n PRO 453 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 3iam s TYR 454 N -0.69 0.09 -0.86 0.54 -0.85 -1.26 -4.75 117.35 109.57 3iam s TYR 454 Ca 0.00 -0.70 -0.25 0.00 -0.52 0.00 0.00 57.07 55.59 3iam s TYR 454 Cb 0.00 0.76 -0.11 0.00 0.38 0.00 0.00 41.96 42.99 3iam s TYR 454 CO 0.00 -1.47 2.22 0.50 -1.52 0.00 0.00 175.55 175.28 3iam s ARG 455 N -2.72 1.90 0.31 -3.49 6.06 -1.26 -4.78 118.95 114.96 3iam s ARG 455 Ca 0.15 0.11 -0.29 0.00 -2.50 0.00 0.00 55.73 53.20 3iam s ARG 455 Cb -0.05 -4.91 -0.10 0.00 0.06 0.00 0.00 34.95 29.96 3iam s ARG 455 CO 0.11 -4.18 1.20 0.00 -2.50 0.00 0.00 175.30 169.93 3iam s ALA 456 N 13.34 3.43 0.21 6.12 0.00 -1.26 -4.95 121.76 138.65 3iam s ALA 456 Ca 0.84 1.06 -0.20 0.00 0.00 0.00 0.00 51.96 53.66 3iam s ALA 456 Cb -0.10 -3.40 0.18 0.00 0.00 0.00 0.00 23.12 19.80 3iam s ALA 456 CO 0.06 -0.40 1.52 -2.30 0.00 0.00 0.00 175.76 174.65 3iam n PRO 457 N 0.94 -0.27 -0.00 0.00 -0.02 -1.26 -1.77 135.00 132.62 3iam n PRO 457 Ca -0.00 1.51 0.11 0.00 -2.02 0.00 0.00 63.50 63.09 3iam n PRO 457 Cb 0.44 -2.23 0.62 0.00 -0.02 0.00 0.00 33.50 32.30 3iam n PRO 457 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 3iam n LEU 458 N -5.41 0.06 0.00 2.45 4.32 -1.26 -3.79 117.00 113.38 3iam n LEU 458 Ca 0.08 -0.02 0.01 0.00 -0.02 0.00 0.00 56.01 56.06 3iam n LEU 458 Cb 0.37 -0.00 0.07 0.00 -1.62 0.00 0.00 43.42 42.24 3iam n LEU 458 CO -0.14 0.01 0.42 0.23 -1.22 0.00 0.00 177.39 176.70 3iam n MET 459 N -0.79 0.05 0.08 3.23 2.81 -0.73 -1.45 117.12 120.33 3iam n MET 459 Ca 0.16 0.20 -0.18 0.00 -1.81 0.00 0.00 57.70 56.07 3iam n MET 459 Cb 0.08 -1.50 -0.10 0.00 -0.71 0.00 0.00 33.22 30.99 3iam n MET 459 CO 0.00 0.00 0.00 -0.22 1.51 0.00 0.00 175.97 177.26 3iam h LYS 460 N 0.00 0.48 -0.42 0.03 1.63 -1.80 -3.20 116.57 113.29 3iam h LYS 460 Ca 0.00 -0.61 0.00 0.00 -0.85 0.00 0.00 60.65 59.19 3iam h LYS 460 Cb 0.02 0.20 0.00 0.00 -0.60 0.00 0.00 32.23 31.85 3iam h LYS 460 CO 0.00 1.25 0.00 0.91 -3.45 0.00 0.00 179.45 178.16 3iam n TRP 461 N -3.72 0.56 -3.89 1.91 8.01 -0.53 -4.67 117.44 115.11 3iam n TRP 461 Ca -0.10 -0.28 -0.30 0.00 -1.31 0.00 0.00 57.50 55.51 3iam n TRP 461 Cb 0.93 0.00 -0.15 0.00 -2.01 0.00 0.00 31.31 30.08 3iam n TRP 461 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 3iam s ALA 462 N -1.44 2.07 0.19 6.99 0.00 -1.21 -4.10 121.76 124.26 3iam s ALA 462 Ca 0.31 -1.78 -0.12 0.00 0.00 0.00 0.00 51.96 50.37 3iam s ALA 462 Cb 0.16 -1.64 0.18 0.00 0.00 0.00 0.00 23.12 21.82 3iam s ALA 462 CO 0.21 -1.48 1.77 0.00 0.00 0.00 0.00 175.76 176.26 3iam h ALA 463 N 7.91 0.68 -0.75 0.00 0.00 -1.21 -3.28 119.26 122.60 3iam h ALA 463 Ca -0.12 0.04 -0.56 0.00 0.00 0.00 0.00 54.91 54.27 3iam h ALA 463 Cb 1.04 -0.03 -0.07 0.00 0.00 0.00 0.00 17.79 18.74 3iam h ALA 463 CO 0.46 -0.13 1.77 0.42 0.00 0.00 0.00 179.25 181.77 3iam s ILE 464 N -6.12 3.91 -0.05 0.00 -1.09 -1.26 -4.93 121.20 111.67 3iam s ILE 464 Ca -0.13 -1.49 0.01 0.00 -2.23 0.00 0.00 60.65 56.81 3iam s ILE 464 Cb 0.15 -4.97 0.02 0.00 -1.58 0.00 0.00 42.46 36.08 3iam s ILE 464 CO 0.74 -1.68 -0.06 -1.38 -1.23 0.00 0.00 174.94 171.33 3iam s HIS 465 N 6.52 0.87 -0.03 3.97 -3.43 -1.24 -1.74 115.29 120.22 3iam s HIS 465 Ca 0.58 -0.26 -0.05 0.00 -0.80 0.00 0.00 55.06 54.53 3iam s HIS 465 Cb 0.02 -0.73 0.01 0.00 -1.43 0.00 0.00 32.58 30.44 3iam s HIS 465 CO 0.08 -0.20 0.12 -2.00 -2.00 0.00 0.00 174.74 170.73 3iam s GLU 466 N 0.86 0.25 -0.25 -0.38 2.56 -0.96 -5.00 118.70 115.79 3iam s GLU 466 Ca -0.12 -0.04 -0.18 0.00 0.00 0.00 0.00 54.97 54.62 3iam s GLU 466 Cb -0.15 0.11 -0.03 0.00 2.00 0.00 0.00 34.13 36.07 3iam s GLU 466 CO 0.01 -0.05 0.53 0.08 -0.56 0.00 0.00 175.26 175.27 3iam s VAL 467 N -0.45 5.06 0.36 3.70 1.01 -1.26 -3.71 120.40 125.10 3iam s VAL 467 Ca -0.05 0.93 0.01 0.00 0.00 0.00 0.00 61.98 62.87 3iam s VAL 467 Cb -0.03 -3.85 0.01 0.00 0.00 0.00 0.00 36.38 32.51 3iam s VAL 467 CO 0.00 0.09 0.12 0.00 0.00 0.00 0.00 175.10 175.31 3iam n HIS 468 N 5.48 0.08 -3.67 5.22 1.44 -1.25 -4.98 115.22 117.54 3iam n HIS 468 Ca -0.04 -1.64 -0.24 0.00 -2.01 0.00 0.00 57.72 53.79 3iam n HIS 468 Cb 0.50 -0.26 -0.02 0.00 0.12 0.00 0.00 29.99 30.33 3iam n HIS 468 CO 0.00 0.00 0.00 1.03 -2.81 0.00 0.00 176.34 174.56 3iam s ARG 469 N -3.36 3.48 0.36 -1.40 0.52 -1.26 -4.16 118.95 113.13 3iam s ARG 469 Ca 0.09 -0.48 -0.28 0.00 -0.52 0.00 0.00 55.73 54.54 3iam s ARG 469 Cb -0.01 -2.79 -0.10 0.00 0.52 0.00 0.00 34.95 32.57 3iam s ARG 469 CO 0.06 0.32 1.39 -2.14 0.02 0.00 0.00 175.30 174.95 3iam s PRO 470 N -3.90 4.19 0.00 3.54 0.02 -1.26 -1.64 135.00 135.94 3iam s PRO 470 Ca 0.38 2.38 0.00 0.00 0.02 0.00 0.00 61.00 63.78 3iam s PRO 470 Cb -0.10 -2.98 0.00 0.00 0.02 0.00 0.00 34.50 31.44 3iam s PRO 470 CO 0.32 -0.39 0.00 0.41 -0.33 0.00 0.00 177.00 177.00 3iam n GLY 471 N 0.62 0.62 0.59 0.52 0.00 -1.26 -4.78 105.19 101.50 3iam n GLY 471 Ca 0.01 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.05 3iam n GLY 471 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3iam n GLU 472 N -2.00 1.66 0.09 1.61 2.13 -0.65 -3.43 120.64 120.04 3iam n GLU 472 Ca 0.00 -0.66 0.09 0.00 0.66 0.00 0.00 57.16 57.25 3iam n GLU 472 Cb 0.00 -1.43 -0.01 0.00 0.27 0.00 0.00 31.44 30.27 3iam n GLU 472 CO 0.00 0.00 0.00 1.05 -0.41 0.00 0.00 177.13 177.77 3iam h GLU 473 N 0.93 0.00 -0.36 5.31 4.11 -1.87 -3.31 114.58 119.39 3iam h GLU 473 Ca 0.00 0.00 0.10 0.00 0.07 0.00 0.00 59.36 59.53 3iam h GLU 473 Cb 0.56 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.79 3iam h GLU 473 CO 0.06 0.08 0.30 0.07 0.07 0.00 0.00 179.01 179.60 3iam h ARG 474 N 0.00 0.00 0.14 1.06 0.11 -1.93 -0.82 114.38 112.94 3iam h ARG 474 Ca -0.04 0.00 -0.35 0.00 0.10 0.00 0.00 59.98 59.69 3iam h ARG 474 Cb 1.15 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.22 3iam h ARG 474 CO 0.01 0.00 -1.85 0.93 0.10 0.00 0.00 179.97 179.16 3iam h GLU 475 N 0.00 0.30 -0.65 0.08 5.08 -1.85 -3.20 114.58 114.34 3iam h GLU 475 Ca 0.17 -0.51 0.01 0.00 -1.00 0.00 0.00 59.36 58.03 3iam h GLU 475 Cb 0.77 0.19 -0.03 0.00 0.50 0.00 0.00 28.75 30.18 3iam h GLU 475 CO -0.00 1.21 0.43 0.82 -1.00 0.00 0.00 179.01 180.47 3iam h ILE 476 N 0.08 1.17 -0.36 3.13 2.04 -1.42 -1.39 117.51 120.76 3iam h ILE 476 Ca -0.37 -0.31 -0.10 0.00 1.00 0.00 0.00 64.86 65.09 3iam h ILE 476 Cb 2.06 0.21 -0.01 0.00 -0.74 0.00 0.00 36.82 38.34 3iam h ILE 476 CO 0.13 0.16 -0.16 -0.07 0.00 0.00 0.00 178.15 178.21 3iam h LEU 477 N 0.89 0.76 -0.43 1.44 4.07 -1.30 -1.92 115.31 118.81 3iam h LEU 477 Ca 0.24 -0.40 0.06 0.00 0.08 0.00 0.00 57.88 57.86 3iam h LEU 477 Cb -0.10 -0.21 -0.05 0.00 1.08 0.00 0.00 40.66 41.37 3iam h LEU 477 CO -0.05 0.99 0.12 0.25 -1.08 0.00 0.00 178.44 178.67 3iam h LEU 478 N 0.53 0.09 -0.30 1.67 6.46 -1.42 -2.53 115.31 119.81 3iam h LEU 478 Ca 0.08 0.06 0.07 0.00 -0.12 0.00 0.00 57.88 57.97 3iam h LEU 478 Cb 0.70 0.07 -0.07 0.00 -0.73 0.00 0.00 40.66 40.63 3iam h LEU 478 CO 0.05 0.08 -0.14 0.00 -0.62 0.00 0.00 178.44 177.81 3iam h ALA 479 N 1.31 0.10 -0.08 1.25 0.00 -1.00 -2.26 119.26 118.57 3iam h ALA 479 Ca 0.21 0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.22 3iam h ALA 479 Cb 0.23 0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 3iam h ALA 479 CO -0.24 -0.53 0.01 -0.07 0.00 0.00 0.00 179.25 178.42 3iam h LEU 480 N -0.09 0.10 -0.27 0.00 3.38 -0.95 -1.69 115.31 115.80 3iam h LEU 480 Ca 0.15 -0.01 -0.06 0.00 0.09 0.00 0.00 57.88 58.06 3iam h LEU 480 Cb 0.33 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 3iam h LEU 480 CO -0.36 0.12 -0.07 -0.07 0.09 0.00 0.00 178.44 178.15 3iam h LEU 481 N 0.11 0.52 0.00 1.67 3.38 -1.08 -3.47 115.31 116.44 3iam h LEU 481 Ca 0.03 -0.37 0.00 0.00 0.09 0.00 0.00 57.88 57.63 3iam h LEU 481 Cb 0.06 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.67 3iam h LEU 481 CO -0.00 0.77 0.00 0.61 0.09 0.00 0.00 178.44 179.91 3iam n GLY 482 N -0.15 0.94 0.00 0.83 0.00 -0.63 -5.07 105.19 101.10 3iam n GLY 482 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.98 3iam n GLY 482 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3iam n ASP 483 N 0.00 1.38 -3.74 1.61 8.00 -1.22 -5.05 116.55 117.52 3iam n ASP 483 Ca 0.00 -1.67 -0.06 0.00 0.71 0.00 0.00 54.79 53.77 3iam n ASP 483 Cb 0.00 0.00 -0.01 0.00 -0.02 0.00 0.00 41.12 41.09 3iam n ASP 483 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 3iam s LYS 484 N -0.67 1.72 -0.04 -1.24 -0.14 -1.26 -4.96 119.74 113.15 3iam s LYS 484 Ca 0.00 -0.98 -0.06 0.00 -1.36 0.00 0.00 55.97 53.57 3iam s LYS 484 Cb 0.00 0.57 -0.04 0.00 -1.68 0.00 0.00 37.83 36.68 3iam s LYS 484 CO 0.00 -0.79 0.21 -2.00 -0.76 0.00 0.00 175.35 172.01 3iam s GLU 485 N -3.62 3.51 0.39 1.68 2.12 -1.26 -4.67 118.70 116.85 3iam s GLU 485 Ca 0.12 -0.13 0.05 0.00 0.36 0.00 0.00 54.97 55.37 3iam s GLU 485 Cb -0.05 -3.13 -0.07 0.00 0.26 0.00 0.00 34.13 31.14 3iam s GLU 485 CO 0.07 0.71 0.03 0.20 -0.54 0.00 0.00 175.26 175.73 3iam s GLY 486 N -1.48 2.39 0.86 -1.50 0.00 -1.26 -4.97 107.32 101.37 3iam s GLY 486 Ca 0.23 -1.99 -0.15 0.00 0.00 0.00 0.00 44.72 42.80 3iam s GLY 486 CO 0.12 -1.98 0.03 -1.14 0.00 0.00 0.00 173.10 170.13 3iam n SER 487 N -0.90 -3.16 -0.29 1.64 3.41 -1.26 -4.51 113.62 108.54 3iam n SER 487 Ca -0.05 0.38 0.02 0.00 -0.26 0.00 0.00 58.87 58.96 3iam n SER 487 Cb 0.67 -1.05 0.09 0.00 -0.26 0.00 0.00 64.21 63.67 3iam n SER 487 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 3iam h GLU 488 N -0.94 -0.01 -0.16 4.33 5.08 -2.00 0.81 114.58 121.69 3iam h GLU 488 Ca -0.44 0.00 0.04 0.00 -1.00 0.00 0.00 59.36 57.96 3iam h GLU 488 Cb 1.32 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.53 3iam h GLU 488 CO 0.34 -0.01 -0.10 0.52 -1.00 0.00 0.00 179.01 178.76 3iam h MET 489 N -0.01 -0.09 -0.92 2.33 2.86 -1.96 -0.15 114.93 116.98 3iam h MET 489 Ca 0.39 0.01 0.14 0.00 -2.06 0.00 0.00 59.70 58.17 3iam h MET 489 Cb 0.60 0.02 -0.08 0.00 0.06 0.00 0.00 31.60 32.21 3iam h MET 489 CO -0.85 -0.06 0.59 0.28 1.06 0.00 0.00 176.91 177.93 3iam h VAL 490 N -0.09 0.84 -0.17 -2.22 2.07 -1.15 0.30 116.25 115.83 3iam h VAL 490 Ca 0.10 -0.26 -0.22 0.00 0.82 0.00 0.00 66.70 67.14 3iam h VAL 490 Cb 0.24 0.02 0.01 0.00 -1.52 0.00 0.00 31.29 30.03 3iam h VAL 490 CO -0.22 0.14 -0.74 0.00 0.02 0.00 0.00 177.57 176.76 3iam h ALA 491 N 1.59 0.36 -0.69 1.67 0.00 -0.72 -0.23 119.26 121.25 3iam h ALA 491 Ca 0.47 -0.59 0.05 0.00 0.00 0.00 0.00 54.91 54.84 3iam h ALA 491 Cb 0.70 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.41 3iam h ALA 491 CO -0.23 0.69 0.40 0.87 0.00 0.00 0.00 179.25 180.98 3iam h LYS 492 N 0.54 0.73 0.81 0.00 1.79 0.87 -0.69 116.57 120.62 3iam h LYS 492 Ca -0.04 -0.04 -0.04 0.00 -2.18 0.00 0.00 60.65 58.34 3iam h LYS 492 Cb 1.37 -0.16 0.01 0.00 -1.58 0.00 0.00 32.23 31.86 3iam h LYS 492 CO 0.15 0.48 -0.39 0.00 -1.08 0.00 0.00 179.45 178.61 3iam h ALA 493 N 1.34 -1.18 -1.31 3.86 0.00 -0.38 -2.34 119.26 119.25 3iam h ALA 493 Ca 0.30 -0.24 0.39 0.00 0.00 0.00 0.00 54.91 55.36 3iam h ALA 493 Cb 0.15 0.42 -0.09 0.00 0.00 0.00 0.00 17.79 18.27 3iam h ALA 493 CO -0.16 -1.10 0.89 -0.22 0.00 0.00 0.00 179.25 178.65 3iam h LYS 494 N -1.20 0.12 -0.26 0.00 3.64 -0.87 0.27 116.57 118.28 3iam h LYS 494 Ca -0.11 -0.01 -0.10 0.00 -1.27 0.00 0.00 60.65 59.16 3iam h LYS 494 Cb 0.84 -0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 32.62 3iam h LYS 494 CO 0.18 0.08 -0.24 1.49 -2.27 0.00 0.00 179.45 178.70 3iam h GLU 495 N 0.13 0.61 -0.18 1.90 4.81 -0.80 -2.53 114.58 118.52 3iam h GLU 495 Ca 0.71 -0.32 -0.16 0.00 -0.13 0.00 0.00 59.36 59.46 3iam h GLU 495 Cb 2.39 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 31.77 3iam h GLU 495 CO -0.21 0.91 -0.55 0.00 -0.73 0.00 0.00 179.01 178.43 3iam h ALA 496 N 0.69 0.72 -0.71 2.92 0.00 0.01 -2.62 119.26 120.26 3iam h ALA 496 Ca 0.04 -0.51 -0.06 0.00 0.00 0.00 0.00 54.91 54.38 3iam h ALA 496 Cb 0.79 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.47 3iam h ALA 496 CO 0.06 0.69 0.21 2.35 0.00 0.00 0.00 179.25 182.55 3iam h TRP 497 N 0.41 1.16 0.76 0.00 2.91 -1.21 0.45 115.95 120.43 3iam h TRP 497 Ca 0.01 -0.12 -0.04 0.00 1.13 0.00 0.00 58.89 59.87 3iam h TRP 497 Cb 1.08 -0.33 0.00 0.00 -0.51 0.00 0.00 29.16 29.40 3iam h TRP 497 CO 0.04 0.92 -0.41 0.93 -1.03 0.00 0.00 178.44 178.89 3iam h GLU 498 N 1.07 -1.04 0.00 2.65 4.39 -1.35 -2.70 114.58 117.59 3iam h GLU 498 Ca 0.23 0.07 0.00 0.00 0.34 0.00 0.00 59.36 60.00 3iam h GLU 498 Cb 0.32 0.24 0.00 0.00 -0.10 0.00 0.00 28.75 29.21 3iam h GLU 498 CO -0.00 -0.69 0.01 1.63 -1.16 0.00 0.00 179.01 178.79 3iam n LYS 499 N -5.06 0.10 -1.79 2.33 5.02 -1.00 -4.72 118.16 113.05 3iam n LYS 499 Ca -0.13 0.59 -0.42 0.00 -2.02 0.00 0.00 58.31 56.33 3iam n LYS 499 Cb 0.44 -1.82 -0.03 0.00 -0.02 0.00 0.00 35.03 33.59 3iam n LYS 499 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3iam s ALA 500 N -3.38 3.84 -0.08 7.82 0.00 0.14 -4.93 121.76 125.17 3iam s ALA 500 Ca -0.02 1.48 -0.22 0.00 0.00 0.00 0.00 51.96 53.20 3iam s ALA 500 Cb 0.04 -3.70 -0.29 0.00 0.00 0.00 0.00 23.12 19.18 3iam s ALA 500 CO 0.14 -0.98 0.77 0.87 0.00 0.00 0.00 175.76 176.56 3iam h LYS 501 N 7.35 0.21 -0.75 0.00 6.56 -1.87 -3.43 116.57 124.64 3iam h LYS 501 Ca -0.44 -0.36 -0.32 0.00 -1.06 0.00 0.00 60.65 58.47 3iam h LYS 501 Cb 1.21 0.14 -0.22 0.00 -0.57 0.00 0.00 32.23 32.78 3iam h LYS 501 CO 0.94 1.17 -0.67 0.09 -2.06 0.00 0.00 179.45 178.92 3iam n ASN 502 N -4.20 -2.06 -4.89 0.86 3.02 -1.26 -5.04 115.26 101.69 3iam n ASN 502 Ca -0.16 -3.06 -0.27 0.00 -0.03 0.00 0.00 54.58 51.06 3iam n ASN 502 Cb 0.76 1.07 0.08 0.00 -0.61 0.00 0.00 39.78 41.08 3iam n ASN 502 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 3iam s PRO 503 N 0.20 2.03 0.18 3.52 0.04 -1.26 -2.22 135.00 137.49 3iam s PRO 503 Ca 0.33 -0.11 0.07 0.00 0.04 0.00 0.00 61.00 61.33 3iam s PRO 503 Cb 0.18 -2.06 -0.04 0.00 0.04 0.00 0.00 34.50 32.61 3iam s PRO 503 CO -0.19 -1.44 -0.14 0.08 0.04 0.00 0.00 177.00 175.34 3iam s VAL 504 N -3.42 1.61 -0.21 -0.36 1.01 -0.51 -4.33 120.40 114.19 3iam s VAL 504 Ca 0.61 -2.07 0.02 0.00 0.00 0.00 0.00 61.98 60.54 3iam s VAL 504 Cb -0.11 -1.90 0.03 0.00 0.00 0.00 0.00 36.38 34.40 3iam s VAL 504 CO 0.47 -0.54 -0.17 -0.22 0.00 0.00 0.00 175.10 174.64 3iam s LEU 505 N -3.06 2.58 -0.16 3.92 2.96 -0.98 -2.18 118.68 121.77 3iam s LEU 505 Ca 0.18 -0.90 -0.05 0.00 -0.22 0.00 0.00 54.13 53.15 3iam s LEU 505 Cb -0.02 -1.51 -0.03 0.00 0.50 0.00 0.00 46.19 45.13 3iam s LEU 505 CO 0.05 -0.06 0.01 -0.63 -1.32 0.00 0.00 176.35 174.40 3iam s ILE 506 N 1.23 4.31 0.04 6.68 1.01 0.39 -0.97 121.20 133.90 3iam s ILE 506 Ca 0.00 -0.21 -0.23 0.00 0.00 0.00 0.00 60.65 60.21 3iam s ILE 506 Cb -0.15 -2.91 0.05 0.00 0.01 0.00 0.00 42.46 39.47 3iam s ILE 506 CO -0.10 0.49 0.54 -1.48 0.00 0.00 0.00 174.94 174.39 3iam s LEU 507 N 0.24 -0.17 0.00 2.97 0.05 -0.89 -0.83 118.68 120.06 3iam s LEU 507 Ca 0.00 0.22 0.00 0.00 0.05 0.00 0.00 54.13 54.40 3iam s LEU 507 Cb -0.13 2.20 0.00 0.00 -2.05 0.00 0.00 46.19 46.21 3iam s LEU 507 CO 0.02 -0.72 0.00 0.61 -0.55 0.00 0.00 176.35 175.70 3iam n GLY 508 N 0.41 2.06 0.00 -3.48 0.00 -1.04 -0.63 105.19 102.51 3iam n GLY 508 Ca -0.18 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.51 3iam n GLY 508 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iam n ALA 509 N -3.00 0.00 -0.32 4.61 0.00 -1.26 -1.33 120.51 119.21 3iam n ALA 509 Ca 0.00 0.00 0.35 0.00 0.00 0.00 0.00 53.44 53.79 3iam n ALA 509 Cb 0.00 0.00 0.72 0.00 0.00 0.00 0.00 19.45 20.17 3iam n ALA 509 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3iam h GLY 510 N 0.00 0.00 0.71 0.00 0.00 -1.91 0.52 103.07 102.39 3iam h GLY 510 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.29 3iam h GLY 510 CO 0.00 0.00 -0.07 -2.08 0.00 0.00 0.00 176.54 174.39 3iam h VAL 511 N 0.00 1.33 0.00 4.60 2.07 -1.88 -2.89 116.25 119.48 3iam h VAL 511 Ca 0.57 -1.13 0.00 0.00 0.82 0.00 0.00 66.70 66.96 3iam h VAL 511 Cb 2.44 1.83 0.00 0.00 -1.52 0.00 0.00 31.29 34.04 3iam h VAL 511 CO -0.01 0.32 -0.22 0.18 0.02 0.00 0.00 177.57 177.87 3iam n LEU 512 N -4.68 0.26 -1.34 2.57 4.32 0.13 -2.85 117.00 115.42 3iam n LEU 512 Ca -0.06 0.30 0.08 0.00 -0.02 0.00 0.00 56.01 56.31 3iam n LEU 512 Cb 0.29 -0.38 0.32 0.00 -1.62 0.00 0.00 43.42 42.03 3iam n LEU 512 CO 0.37 0.04 0.78 1.67 -1.22 0.00 0.00 177.39 179.03 3iam n GLN 513 N -1.56 3.72 -3.46 3.23 -0.06 0.14 -1.02 117.38 118.36 3iam n GLN 513 Ca 0.06 -2.87 -0.23 0.00 -2.00 0.00 0.00 57.00 51.97 3iam n GLN 513 Cb 0.35 -1.92 -0.12 0.00 -4.06 0.00 0.00 30.24 24.49 3iam n GLN 513 CO 0.00 0.00 0.00 0.34 -0.20 0.00 0.00 177.06 177.20 3iam s ASP 514 N -1.24 2.45 0.15 1.69 -1.08 -1.10 -4.76 116.67 112.78 3iam s ASP 514 Ca 0.46 -1.14 -0.17 0.00 -0.52 0.00 0.00 52.55 51.19 3iam s ASP 514 Cb 0.34 0.11 0.08 0.00 -1.46 0.00 0.00 42.92 41.99 3iam s ASP 514 CO 0.16 -0.39 1.13 0.41 0.52 0.00 0.00 175.17 176.99 3iam n THR 515 N 5.11 -0.43 -0.12 1.71 -1.04 -1.26 -1.32 114.28 116.93 3iam n THR 515 Ca -0.01 1.73 -0.10 0.00 -2.04 0.00 0.00 64.05 63.63 3iam n THR 515 Cb 0.44 -2.22 -0.07 0.00 -1.82 0.00 0.00 70.33 66.65 3iam n THR 515 CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 3iam h VAL 516 N 0.00 0.00 0.71 12.58 2.07 -1.96 -2.21 116.25 127.43 3iam h VAL 516 Ca 0.20 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.68 3iam h VAL 516 Cb 0.38 0.00 0.01 0.00 -1.52 0.00 0.00 31.29 30.16 3iam h VAL 516 CO -0.71 0.00 -0.34 0.00 0.02 0.00 0.00 177.57 176.54 3iam h ALA 517 N -0.37 -1.02 -0.92 1.67 0.00 -1.48 -2.99 119.26 114.15 3iam h ALA 517 Ca 0.06 -0.21 0.25 0.00 0.00 0.00 0.00 54.91 55.00 3iam h ALA 517 Cb 0.40 0.37 -0.16 0.00 0.00 0.00 0.00 17.79 18.40 3iam h ALA 517 CO -0.44 -0.95 0.06 0.00 0.00 0.00 0.00 179.25 177.92 3iam h ALA 518 N -1.35 1.12 0.09 0.00 0.00 -1.13 0.15 119.26 118.14 3iam h ALA 518 Ca -0.10 0.30 0.00 0.00 0.00 0.00 0.00 54.91 55.12 3iam h ALA 518 Cb 0.73 0.51 -0.01 0.00 0.00 0.00 0.00 17.79 19.02 3iam h ALA 518 CO 0.16 -0.53 -0.09 1.49 0.00 0.00 0.00 179.25 180.28 3iam h GLU 519 N 0.06 -0.20 -0.77 0.00 4.57 -1.36 -1.47 114.58 115.41 3iam h GLU 519 Ca 0.55 0.01 0.09 0.00 -1.18 0.00 0.00 59.36 58.84 3iam h GLU 519 Cb 1.11 0.05 -0.05 0.00 -0.16 0.00 0.00 28.75 29.70 3iam h GLU 519 CO -0.82 -0.13 0.51 0.00 -1.18 0.00 0.00 179.01 177.38 3iam h ARG 520 N -0.21 0.71 0.54 1.92 3.08 -0.93 -2.53 114.38 116.96 3iam h ARG 520 Ca 0.01 -0.04 -0.02 0.00 0.07 0.00 0.00 59.98 60.00 3iam h ARG 520 Cb 0.20 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 30.07 3iam h ARG 520 CO -0.03 0.47 -0.51 0.00 -1.07 0.00 0.00 179.97 178.83 3iam h ALA 521 N 1.60 -1.17 -1.00 0.04 0.00 -0.08 -2.04 119.26 116.61 3iam h ALA 521 Ca 0.35 -0.20 0.29 0.00 0.00 0.00 0.00 54.91 55.35 3iam h ALA 521 Cb 0.40 0.73 -0.14 0.00 0.00 0.00 0.00 17.79 18.78 3iam h ALA 521 CO -0.13 -1.19 0.58 -0.09 0.00 0.00 0.00 179.25 178.42 3iam h ARG 522 N -1.04 0.43 0.60 0.00 2.43 -0.89 -0.39 114.38 115.53 3iam h ARG 522 Ca -0.07 -0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.05 3iam h ARG 522 Cb 0.89 -0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 30.35 3iam h ARG 522 CO -0.05 0.28 -0.35 -0.07 -1.51 0.00 0.00 179.97 178.27 3iam h LEU 523 N 0.44 -0.87 -0.98 3.80 3.38 -1.19 0.14 115.31 120.02 3iam h LEU 523 Ca 0.69 0.04 0.35 0.00 0.09 0.00 0.00 57.88 59.05 3iam h LEU 523 Cb 1.46 0.25 -0.17 0.00 0.09 0.00 0.00 40.66 42.29 3iam h LEU 523 CO -0.55 -0.55 0.38 0.25 0.09 0.00 0.00 178.44 178.07 3iam h LEU 524 N -0.89 0.12 -1.42 1.67 5.85 -0.39 0.94 115.31 121.20 3iam h LEU 524 Ca -0.08 0.25 0.00 0.00 0.84 0.00 0.00 57.88 58.89 3iam h LEU 524 Cb 0.70 0.30 0.00 0.00 0.37 0.00 0.00 40.66 42.03 3iam h LEU 524 CO 0.10 -0.34 -0.02 0.00 -0.34 0.00 0.00 178.44 177.84 3iam n ALA 525 N -2.53 2.57 -0.03 1.25 0.00 -1.00 -3.32 120.51 117.45 3iam n ALA 525 Ca 0.31 -0.57 -0.19 0.00 0.00 0.00 0.00 53.44 53.00 3iam n ALA 525 Cb 1.04 -0.98 -0.14 0.00 0.00 0.00 0.00 19.45 19.37 3iam n ALA 525 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 3iam n GLU 526 N 0.71 0.72 0.34 0.00 2.13 0.31 -3.20 120.64 121.65 3iam n GLU 526 Ca 0.16 0.24 -0.16 0.00 0.66 0.00 0.00 57.16 58.06 3iam n GLU 526 Cb 0.48 -1.68 -0.08 0.00 0.27 0.00 0.00 31.44 30.43 3iam n GLU 526 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3iam h ARG 527 N 0.05 -0.86 -6.82 5.31 3.08 -1.17 -3.41 114.38 110.57 3iam h ARG 527 Ca -0.44 0.06 -0.51 0.00 0.07 0.00 0.00 59.98 59.16 3iam h ARG 527 Cb 2.02 0.19 0.02 0.00 0.08 0.00 0.00 29.97 32.28 3iam h ARG 527 CO 0.05 -0.53 0.49 0.21 -1.07 0.00 0.00 179.97 179.12 3iam s LYS 528 N -5.02 4.59 -1.36 0.04 2.20 -1.21 -4.93 119.74 114.06 3iam s LYS 528 Ca -0.15 1.85 -0.15 0.00 -0.36 0.00 0.00 55.97 57.15 3iam s LYS 528 Cb 0.02 -3.16 0.01 0.00 -1.51 0.00 0.00 37.83 33.19 3iam s LYS 528 CO 0.49 0.15 2.18 0.41 -0.36 0.00 0.00 175.35 178.23 3iam n GLY 529 N 1.12 4.13 3.17 5.54 0.00 -1.26 -4.61 105.19 113.29 3iam n GLY 529 Ca -0.01 -1.54 -0.23 0.00 0.00 0.00 0.00 46.02 44.24 3iam n GLY 529 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iam s ALA 530 N 3.48 1.39 0.78 4.61 0.00 -1.19 -4.96 121.76 125.87 3iam s ALA 530 Ca 0.49 -0.84 -0.05 0.00 0.00 0.00 0.00 51.96 51.56 3iam s ALA 530 Cb 0.14 -0.28 0.15 0.00 0.00 0.00 0.00 23.12 23.13 3iam s ALA 530 CO -0.06 0.30 1.08 0.15 0.00 0.00 0.00 175.76 177.24 3iam s LYS 531 N -0.89 1.41 0.03 0.00 1.02 -1.26 -4.74 119.74 115.31 3iam s LYS 531 Ca 0.05 -0.92 -0.04 0.00 0.02 0.00 0.00 55.97 55.07 3iam s LYS 531 Cb -0.07 -2.20 -0.01 0.00 -0.52 0.00 0.00 37.83 35.02 3iam s LYS 531 CO 0.01 -1.70 0.07 0.08 -0.92 0.00 0.00 175.35 172.89 3iam s VAL 532 N -3.34 0.12 -0.25 3.17 1.01 -0.82 -2.31 120.40 117.98 3iam s VAL 532 Ca 0.68 -1.01 0.03 0.00 0.00 0.00 0.00 61.98 61.68 3iam s VAL 532 Cb -0.05 -0.69 0.06 0.00 0.00 0.00 0.00 36.38 35.69 3iam s VAL 532 CO 0.47 -0.56 -0.12 -0.76 0.00 0.00 0.00 175.10 174.13 3iam s LEU 533 N -1.87 3.26 -0.40 3.92 1.43 -0.14 -1.86 118.68 123.01 3iam s LEU 533 Ca -0.09 -1.30 -0.18 0.00 -1.03 0.00 0.00 54.13 51.54 3iam s LEU 533 Cb -0.04 -1.53 0.01 0.00 0.03 0.00 0.00 46.19 44.67 3iam s LEU 533 CO -0.03 -0.17 0.46 0.00 0.23 0.00 0.00 176.35 176.84 3iam s ALA 534 N 1.13 3.43 -1.23 4.21 0.00 -1.26 -2.09 121.76 125.96 3iam s ALA 534 Ca -0.07 -1.38 -0.14 0.00 0.00 0.00 0.00 51.96 50.37 3iam s ALA 534 Cb -0.19 -3.05 0.16 0.00 0.00 0.00 0.00 23.12 20.04 3iam s ALA 534 CO -0.06 -1.50 1.54 -1.33 0.00 0.00 0.00 175.76 174.40 3iam n MET 535 N 5.67 3.38 -2.23 0.00 2.81 0.20 -4.90 117.12 122.05 3iam n MET 535 Ca -0.07 -3.74 -0.33 0.00 -1.81 0.00 0.00 57.70 51.76 3iam n MET 535 Cb 0.48 -3.07 -0.01 0.00 -0.71 0.00 0.00 33.22 29.91 3iam n MET 535 CO 0.00 0.00 0.00 0.95 1.51 0.00 0.00 175.97 178.43 3iam s THR 536 N 1.69 3.88 -1.89 2.03 -4.23 -1.26 -4.31 115.64 111.56 3iam s THR 536 Ca 0.44 0.97 0.31 0.00 -1.18 0.00 0.00 61.69 62.23 3iam s THR 536 Cb -0.00 -3.44 0.82 0.00 1.34 0.00 0.00 72.50 71.21 3iam s THR 536 CO 0.01 -0.45 2.18 -0.81 -0.54 0.00 0.00 174.62 175.01 3iam n PRO 537 N -1.67 0.90 -4.58 3.99 -0.04 -1.26 -4.54 135.00 127.80 3iam n PRO 537 Ca 0.09 -0.03 -0.33 0.00 -0.04 0.00 0.00 63.50 63.18 3iam n PRO 537 Cb 0.53 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.35 3iam n PRO 537 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3iam s ALA 538 N -2.12 2.66 0.17 0.55 0.00 -1.26 -4.18 121.76 117.58 3iam s ALA 538 Ca 0.44 -0.95 -0.15 0.00 0.00 0.00 0.00 51.96 51.30 3iam s ALA 538 Cb 0.22 -1.31 0.14 0.00 0.00 0.00 0.00 23.12 22.16 3iam s ALA 538 CO 0.39 0.11 1.69 0.00 0.00 0.00 0.00 175.76 177.95 3iam h ALA 539 N 6.99 0.40 -0.67 0.00 0.00 -1.81 -1.64 119.26 122.54 3iam h ALA 539 Ca -0.29 0.13 -0.26 0.00 0.00 0.00 0.00 54.91 54.48 3iam h ALA 539 Cb 1.20 0.22 -0.16 0.00 0.00 0.00 0.00 17.79 19.05 3iam h ALA 539 CO 0.57 -0.39 0.27 -1.71 0.00 0.00 0.00 179.25 177.99 3iam n ASN 540 N -5.21 3.94 -0.20 0.00 5.15 -0.77 -4.22 115.26 113.95 3iam n ASN 540 Ca 0.04 -3.42 -0.02 0.00 -0.60 0.00 0.00 54.58 50.58 3iam n ASN 540 Cb 0.23 -0.72 0.05 0.00 -0.53 0.00 0.00 39.78 38.81 3iam n ASN 540 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3iam h ALA 541 N 1.77 0.33 0.00 5.20 0.00 -1.49 0.13 119.26 125.21 3iam h ALA 541 Ca 0.33 0.23 -0.01 0.00 0.00 0.00 0.00 54.91 55.45 3iam h ALA 541 Cb 2.24 0.52 -0.00 0.00 0.00 0.00 0.00 17.79 20.54 3iam h ALA 541 CO 0.70 -0.47 -0.06 -0.09 0.00 0.00 0.00 179.25 179.33 3iam h ARG 542 N -0.03 0.00 0.09 0.00 9.65 -1.83 -1.41 114.38 120.85 3iam h ARG 542 Ca 0.28 0.00 -0.37 0.00 -1.10 0.00 0.00 59.98 58.79 3iam h ARG 542 Cb 0.47 0.00 -0.03 0.00 -1.39 0.00 0.00 29.97 29.02 3iam h ARG 542 CO -0.64 0.06 -2.12 0.41 2.80 0.00 0.00 179.97 180.49 3iam n GLY 543 N -0.61 -0.51 0.26 2.80 0.00 -0.12 -3.46 105.19 103.55 3iam n GLY 543 Ca -0.02 -0.25 -0.01 0.00 0.00 0.00 0.00 46.02 45.75 3iam n GLY 543 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3iam h LEU 544 N 0.02 0.48 -1.33 0.99 3.38 -0.65 -1.08 115.31 117.12 3iam h LEU 544 Ca -0.47 -0.11 -0.07 0.00 0.09 0.00 0.00 57.88 57.32 3iam h LEU 544 Cb 1.98 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 42.60 3iam h LEU 544 CO 0.03 0.61 -0.33 -0.33 0.09 0.00 0.00 178.44 178.51 3iam h GLU 545 N 0.47 0.01 0.00 1.13 5.08 -1.42 -2.02 114.58 117.82 3iam h GLU 545 Ca 0.09 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 3iam h GLU 545 Cb 0.44 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.69 3iam h GLU 545 CO 0.02 0.34 0.00 0.00 -1.00 0.00 0.00 179.01 178.37 3iam n ALA 546 N -2.48 2.08 0.75 3.43 0.00 -0.43 -2.34 120.51 121.52 3iam n ALA 546 Ca -0.02 -0.07 0.09 0.00 0.00 0.00 0.00 53.44 53.43 3iam n ALA 546 Cb 0.37 -1.39 0.03 0.00 0.00 0.00 0.00 19.45 18.47 3iam n ALA 546 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 3iam n MET 547 N -1.56 1.57 -2.51 0.00 2.81 -1.03 -4.98 117.12 111.42 3iam n MET 547 Ca 0.06 -1.13 -0.07 0.00 -1.81 0.00 0.00 57.70 54.75 3iam n MET 547 Cb 0.28 -1.32 0.04 0.00 -0.71 0.00 0.00 33.22 31.51 3iam n MET 547 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3iam n GLY 548 N 1.12 0.10 2.11 3.03 0.00 -0.99 -4.79 105.19 105.77 3iam n GLY 548 Ca 0.08 -0.17 -0.26 0.00 0.00 0.00 0.00 46.02 45.67 3iam n GLY 548 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3iam n VAL 549 N -2.28 3.25 -4.13 1.61 0.31 -0.79 -4.76 118.33 111.54 3iam n VAL 549 Ca -0.10 -2.67 -0.24 0.00 -0.01 0.00 0.00 64.34 61.32 3iam n VAL 549 Cb 0.57 -0.80 -0.05 0.00 -0.91 0.00 0.00 33.84 32.64 3iam n VAL 549 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 3iam s LEU 550 N -3.55 3.69 0.72 7.52 1.02 -1.25 -3.53 118.68 123.31 3iam s LEU 550 Ca 0.58 -0.26 -0.12 0.00 0.02 0.00 0.00 54.13 54.35 3iam s LEU 550 Cb 0.48 -2.27 0.03 0.00 0.02 0.00 0.00 46.19 44.45 3iam s LEU 550 CO 0.04 0.02 1.09 -2.16 0.02 0.00 0.00 176.35 175.35 3iam s PRO 551 N -3.47 2.59 0.76 1.29 0.04 -0.06 -4.69 135.00 131.47 3iam s PRO 551 Ca 0.31 1.18 -0.11 0.00 0.04 0.00 0.00 61.00 62.42 3iam s PRO 551 Cb -0.09 -1.94 0.17 0.00 0.04 0.00 0.00 34.50 32.69 3iam s PRO 551 CO 0.23 -1.38 1.03 0.41 0.04 0.00 0.00 177.00 177.33 3iam n GLY 552 N -1.19 -1.11 0.43 0.56 0.00 -1.15 -4.94 105.19 97.80 3iam n GLY 552 Ca 0.09 -1.75 0.24 0.00 0.00 0.00 0.00 46.02 44.60 3iam n GLY 552 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iam h ALA 553 N -1.64 2.60 -2.66 4.61 0.00 -1.97 -3.25 119.26 116.95 3iam h ALA 553 Ca -0.34 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.56 3iam h ALA 553 Cb 0.96 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.79 3iam h ALA 553 CO 0.25 -0.83 0.00 1.17 0.00 0.00 0.00 179.25 179.84 3iam n LYS 554 N -4.36 0.00 0.00 0.00 3.00 -1.26 -4.93 118.16 110.61 3iam n LYS 554 Ca 0.16 0.37 0.00 0.00 -0.00 0.00 0.00 58.31 58.84 3iam n LYS 554 Cb 0.80 -0.82 0.00 0.00 0.00 0.00 0.00 35.03 35.01 3iam n LYS 554 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3iam n GLY 555 N -0.79 0.59 3.55 3.14 0.00 -1.23 -5.09 105.19 105.37 3iam n GLY 555 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 3iam n GLY 555 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iam s ALA 556 N 0.00 1.54 0.48 4.61 0.00 -1.26 -4.88 121.76 122.24 3iam s ALA 556 Ca 0.00 -0.41 0.08 0.00 0.00 0.00 0.00 51.96 51.62 3iam s ALA 556 Cb 0.00 -4.41 0.02 0.00 0.00 0.00 0.00 23.12 18.73 3iam s ALA 556 CO 0.00 -4.70 0.48 -1.54 0.00 0.00 0.00 175.76 170.01 3iam s SER 557 N 10.78 5.01 0.00 0.00 1.04 -1.23 -4.41 113.70 124.90 3iam s SER 557 Ca 0.88 -0.86 0.00 0.00 0.48 0.00 0.00 55.95 56.45 3iam s SER 557 Cb -0.14 -0.15 0.00 0.00 0.10 0.00 0.00 66.02 65.82 3iam s SER 557 CO 0.19 -0.92 0.87 -2.67 0.98 0.00 0.00 173.24 171.69 3iam n TRP 558 N -1.77 0.00 -0.07 5.02 4.27 -1.26 -0.10 117.44 123.53 3iam n TRP 558 Ca 0.05 0.00 0.00 0.00 -3.89 0.00 0.00 57.50 53.66 3iam n TRP 558 Cb 0.62 -0.37 0.00 0.00 -1.36 0.00 0.00 31.31 30.20 3iam n TRP 558 CO 0.00 0.00 0.00 -0.40 -2.29 0.00 0.00 177.69 175.00 3iam n ASP 559 N -1.37 0.15 -4.43 -0.67 5.75 -1.26 -4.68 116.55 110.04 3iam n ASP 559 Ca 0.00 -0.49 -0.42 0.00 -0.01 0.00 0.00 54.79 53.87 3iam n ASP 559 Cb 0.10 0.54 -0.10 0.00 -1.03 0.00 0.00 41.12 40.64 3iam n ASP 559 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 3iam s GLU 560 N -0.54 2.92 -0.56 0.11 2.02 0.86 -4.53 118.70 118.98 3iam s GLU 560 Ca 0.00 -1.06 -0.26 0.00 0.02 0.00 0.00 54.97 53.67 3iam s GLU 560 Cb 0.00 -3.92 -0.07 0.00 0.10 0.00 0.00 34.13 30.24 3iam s GLU 560 CO 0.00 -0.75 2.29 -1.25 0.02 0.00 0.00 175.26 175.57 3iam s PRO 561 N 1.64 2.15 0.00 0.39 0.04 -1.26 -3.47 135.00 134.49 3iam s PRO 561 Ca 0.04 1.10 0.00 0.00 0.04 0.00 0.00 61.00 62.18 3iam s PRO 561 Cb -0.19 -4.59 0.00 0.00 0.04 0.00 0.00 34.50 29.76 3iam s PRO 561 CO 0.09 -3.32 0.00 0.41 0.04 0.00 0.00 177.00 174.22 3iam n GLY 562 N 6.06 0.00 3.49 0.56 0.00 -1.26 -5.02 105.19 109.02 3iam n GLY 562 Ca 0.35 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.08 3iam n GLY 562 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iam s ALA 563 N -1.63 -0.30 0.00 4.61 0.00 -1.26 -4.99 121.76 118.19 3iam s ALA 563 Ca 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 51.96 51.60 3iam s ALA 563 Cb 0.00 -3.14 0.00 0.00 0.00 0.00 0.00 23.12 19.98 3iam s ALA 563 CO 0.00 -3.84 0.00 -0.11 0.00 0.00 0.00 175.76 171.81 3iam n LEU 564 N -4.94 1.16 -4.05 0.00 7.94 -1.01 -4.80 117.00 111.30 3iam n LEU 564 Ca 0.05 0.00 -0.31 0.00 -1.11 0.00 0.00 56.01 54.64 3iam n LEU 564 Cb 0.56 0.00 -0.16 0.00 0.53 0.00 0.00 43.42 44.35 3iam n LEU 564 CO 0.55 0.19 -0.48 -0.31 -1.11 0.00 0.00 177.39 176.23 3iam s TYR 565 N -1.55 2.66 0.02 1.96 2.02 -0.72 -0.56 117.35 121.17 3iam s TYR 565 Ca 0.00 -1.72 -0.06 0.00 -0.37 0.00 0.00 57.07 54.92 3iam s TYR 565 Cb 0.00 -1.77 -0.00 0.00 -0.40 0.00 0.00 41.96 39.79 3iam s TYR 565 CO 0.00 -0.78 0.11 0.00 -1.57 0.00 0.00 175.55 173.31 3iam s ALA 566 N 1.32 -0.20 -0.12 3.71 0.00 -0.81 0.05 121.76 125.72 3iam s ALA 566 Ca -0.00 -0.31 -0.07 0.00 0.00 0.00 0.00 51.96 51.57 3iam s ALA 566 Cb -0.16 0.16 -0.04 0.00 0.00 0.00 0.00 23.12 23.08 3iam s ALA 566 CO -0.09 -0.24 0.15 -0.47 0.00 0.00 0.00 175.76 175.11 3iam s TYR 567 N -1.77 3.60 -0.05 0.00 5.04 0.37 -2.20 117.35 122.33 3iam s TYR 567 Ca -0.12 0.54 0.02 0.00 -2.44 0.00 0.00 57.07 55.07 3iam s TYR 567 Cb -0.06 -1.95 0.02 0.00 0.35 0.00 0.00 41.96 40.32 3iam s TYR 567 CO -0.01 0.73 -0.09 0.71 -1.34 0.00 0.00 175.55 175.56 3iam s TYR 568 N -1.02 1.11 -0.49 4.97 2.02 0.07 -1.39 117.35 122.62 3iam s TYR 568 Ca 0.15 -0.37 0.03 0.00 -0.37 0.00 0.00 57.07 56.50 3iam s TYR 568 Cb -0.12 -0.87 0.52 0.00 -0.40 0.00 0.00 41.96 41.09 3iam s TYR 568 CO 0.04 -0.23 1.77 0.41 -1.57 0.00 0.00 175.55 175.98 3iam n GLY 569 N 3.89 5.46 0.00 0.71 0.00 0.85 -0.26 105.19 115.84 3iam n GLY 569 Ca -0.24 -1.88 0.00 0.00 0.00 0.00 0.00 46.02 43.90 3iam n GLY 569 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 3iam n PHE 570 N -0.98 0.00 -3.39 1.61 -1.74 -1.26 -3.54 117.46 108.16 3iam n PHE 570 Ca 0.54 0.00 -0.38 0.00 -0.56 0.00 0.00 57.45 57.05 3iam n PHE 570 Cb 1.02 0.00 -0.08 0.00 1.52 0.00 0.00 39.48 41.94 3iam n PHE 570 CO 0.00 0.00 0.00 0.08 -0.56 0.00 0.00 176.76 176.28 3iam s VAL 571 N -2.00 5.19 0.64 1.97 1.01 -1.26 -4.86 120.40 121.09 3iam s VAL 571 Ca 0.00 0.65 0.03 0.00 0.00 0.00 0.00 61.98 62.66 3iam s VAL 571 Cb 0.00 -3.71 0.10 0.00 0.00 0.00 0.00 36.38 32.76 3iam s VAL 571 CO 0.00 0.22 0.88 -2.16 0.00 0.00 0.00 175.10 174.04 3iam s PRO 572 N 1.57 2.04 0.53 2.72 0.05 -1.26 -5.07 135.00 135.59 3iam s PRO 572 Ca 0.17 -1.22 -0.23 0.00 0.05 0.00 0.00 61.00 59.77 3iam s PRO 572 Cb -0.15 -2.47 -0.06 0.00 0.05 0.00 0.00 34.50 31.88 3iam s PRO 572 CO 0.08 -1.11 1.38 -1.25 0.05 0.00 0.00 177.00 176.16 3iam s PRO 573 N -4.91 3.25 0.49 0.56 0.04 -1.26 -4.89 135.00 128.29 3iam s PRO 573 Ca 0.63 2.29 0.17 0.00 0.04 0.00 0.00 61.00 64.13 3iam s PRO 573 Cb -0.06 -2.35 1.20 0.00 0.04 0.00 0.00 34.50 33.33 3iam s PRO 573 CO 0.41 -1.12 2.06 1.49 0.04 0.00 0.00 177.00 179.88 3iam h GLU 574 N 1.64 0.16 0.00 4.56 4.81 -1.87 -2.27 114.58 121.62 3iam h GLU 574 Ca -0.51 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.71 3iam h GLU 574 Cb 1.29 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.64 3iam h GLU 574 CO 0.58 0.11 0.00 1.49 -0.73 0.00 0.00 179.01 180.46 3iam h GLU 575 N 0.17 0.00 -0.60 1.92 4.57 -1.90 -3.04 114.58 115.69 3iam h GLU 575 Ca 0.16 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.34 3iam h GLU 575 Cb 0.41 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.00 3iam h GLU 575 CO -0.02 0.00 0.00 0.00 -1.18 0.00 0.00 179.01 177.81 3iam n ALA 576 N -1.84 2.40 -0.02 2.92 0.00 -0.85 -4.04 120.51 119.08 3iam n ALA 576 Ca 0.03 -1.06 -0.01 0.00 0.00 0.00 0.00 53.44 52.39 3iam n ALA 576 Cb 0.30 -0.95 -0.05 0.00 0.00 0.00 0.00 19.45 18.75 3iam n ALA 576 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3iam n LEU 577 N 1.29 0.00 -4.76 0.00 4.77 -1.15 -4.56 117.00 112.59 3iam n LEU 577 Ca 0.20 0.00 -0.39 0.00 -0.03 0.00 0.00 56.01 55.79 3iam n LEU 577 Cb 0.52 0.10 0.01 0.00 -2.33 0.00 0.00 43.42 41.71 3iam n LEU 577 CO 0.14 0.10 0.98 -0.54 -1.33 0.00 0.00 177.39 176.73 3iam s LYS 578 N -2.24 3.73 0.00 3.23 1.02 -1.24 -2.54 119.74 121.70 3iam s LYS 578 Ca -0.03 2.19 0.00 0.00 0.02 0.00 0.00 55.97 58.16 3iam s LYS 578 Cb 0.02 -2.61 0.00 0.00 -0.52 0.00 0.00 37.83 34.73 3iam s LYS 578 CO 0.24 -0.70 0.00 0.41 -0.92 0.00 0.00 175.35 174.38 3iam n GLY 579 N 0.63 2.61 3.63 -3.33 0.00 -1.26 -4.99 105.19 102.49 3iam n GLY 579 Ca 0.06 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.74 3iam n GLY 579 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3iam n LYS 580 N -1.81 0.07 -0.09 1.61 5.02 -1.05 -4.98 118.16 116.92 3iam n LYS 580 Ca 0.00 0.09 -0.23 0.00 -2.02 0.00 0.00 58.31 56.15 3iam n LYS 580 Cb 0.00 -2.30 -0.12 0.00 -0.02 0.00 0.00 35.03 32.59 3iam n LYS 580 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3iam n ARG 581 N -2.94 0.63 -4.13 1.97 1.74 0.28 -4.93 116.66 109.27 3iam n ARG 581 Ca 0.12 0.41 -0.23 0.00 -0.77 0.00 0.00 57.85 57.38 3iam n ARG 581 Cb 0.51 -1.67 -0.17 0.00 -1.02 0.00 0.00 32.46 30.11 3iam n ARG 581 CO 0.00 0.00 0.00 0.12 -1.52 0.00 0.00 177.63 176.23 3iam s PHE 582 N -2.45 1.03 -0.13 -1.55 5.36 -1.07 -5.04 117.98 114.12 3iam s PHE 582 Ca -0.30 -0.37 0.02 0.00 -0.96 0.00 0.00 56.93 55.32 3iam s PHE 582 Cb 0.08 -0.89 0.01 0.00 -0.34 0.00 0.00 43.02 41.89 3iam s PHE 582 CO 0.62 -0.30 -0.19 0.14 -1.46 0.00 0.00 175.22 174.03 3iam s VAL 583 N 1.21 1.83 -0.24 3.12 -7.23 -1.26 -1.92 120.40 115.91 3iam s VAL 583 Ca -0.06 -0.83 -0.02 0.00 -1.81 0.00 0.00 61.98 59.26 3iam s VAL 583 Cb -0.14 -1.64 0.02 0.00 0.56 0.00 0.00 36.38 35.18 3iam s VAL 583 CO -0.02 0.50 -0.07 0.68 -0.31 0.00 0.00 175.10 175.89 3iam s VAL 584 N 0.97 2.88 -0.32 1.32 -7.23 -0.93 -2.37 120.40 114.71 3iam s VAL 584 Ca -0.05 -0.95 -0.11 0.00 -1.81 0.00 0.00 61.98 59.06 3iam s VAL 584 Cb -0.15 -2.42 -0.02 0.00 0.56 0.00 0.00 36.38 34.35 3iam s VAL 584 CO -0.03 0.26 0.19 -0.04 -0.31 0.00 0.00 175.10 175.17 3iam s MET 585 N 1.34 3.45 -1.12 4.82 -1.94 -0.43 -0.75 119.30 124.67 3iam s MET 585 Ca 0.01 -0.66 -0.09 0.00 -1.71 0.00 0.00 55.69 53.25 3iam s MET 585 Cb -0.16 -3.68 0.27 0.00 2.01 0.00 0.00 34.83 33.27 3iam s MET 585 CO -0.05 -0.41 1.23 1.58 -0.01 0.00 0.00 175.02 177.36 3iam n HIS 586 N 5.04 4.67 -2.55 -0.03 -0.00 0.64 -1.31 115.22 121.67 3iam n HIS 586 Ca -0.13 -3.61 -0.03 0.00 0.46 0.00 0.00 57.72 54.41 3iam n HIS 586 Cb 0.50 -1.67 0.01 0.00 -0.12 0.00 0.00 29.99 28.71 3iam n HIS 586 CO 0.00 0.00 0.00 1.28 0.46 0.00 0.00 176.34 178.08 3iam n LEU 587 N 2.70 0.00 0.00 0.27 4.77 -1.03 -4.22 117.00 119.49 3iam n LEU 587 Ca 0.26 -0.33 0.00 0.00 -0.03 0.00 0.00 56.01 55.91 3iam n LEU 587 Cb 0.38 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.39 3iam n LEU 587 CO 0.54 -0.56 -0.03 -1.54 -1.33 0.00 0.00 177.39 174.47 3iam n SER 588 N -2.96 0.27 -4.06 -1.43 3.41 -1.26 0.95 113.62 108.54 3iam n SER 588 Ca 0.02 -0.13 -0.07 0.00 -0.26 0.00 0.00 58.87 58.43 3iam n SER 588 Cb 0.09 0.32 -0.10 0.00 -0.26 0.00 0.00 64.21 64.26 3iam n SER 588 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 3iam s HIS 589 N -0.37 0.47 -0.53 7.33 3.76 -1.26 -1.90 115.29 122.79 3iam s HIS 589 Ca 0.00 -1.00 -0.22 0.00 -0.15 0.00 0.00 55.06 53.69 3iam s HIS 589 Cb 0.00 -0.35 0.05 0.00 1.11 0.00 0.00 32.58 33.39 3iam s HIS 589 CO 0.00 -0.39 0.79 -1.17 -0.85 0.00 0.00 174.74 173.12 3iam s LEU 590 N -2.87 4.51 0.40 0.89 2.96 -1.26 -4.81 118.68 118.50 3iam s LEU 590 Ca 0.06 -0.61 -0.23 0.00 -0.22 0.00 0.00 54.13 53.13 3iam s LEU 590 Cb 0.07 -2.65 -0.10 0.00 0.50 0.00 0.00 46.19 44.01 3iam s LEU 590 CO -0.10 -1.07 0.98 -2.28 -1.32 0.00 0.00 176.35 172.57 3iam s HIS 591 N 3.32 3.38 0.29 5.38 5.65 -1.26 -4.98 115.29 127.07 3iam s HIS 591 Ca 0.23 1.67 -0.02 0.00 0.25 0.00 0.00 55.06 57.19 3iam s HIS 591 Cb -0.16 -2.96 0.42 0.00 -1.18 0.00 0.00 32.58 28.70 3iam s HIS 591 CO 0.16 -0.22 1.88 -1.35 -0.65 0.00 0.00 174.74 174.56 3iam h PRO 592 N 2.37 0.92 -0.76 2.88 0.11 -2.00 -2.47 132.00 133.06 3iam h PRO 592 Ca -0.48 -0.13 0.00 0.00 0.11 0.00 0.00 66.00 65.49 3iam h PRO 592 Cb 1.20 -0.17 -0.04 0.00 0.11 0.00 0.00 31.00 32.10 3iam h PRO 592 CO 0.62 0.74 0.48 -0.07 -0.21 0.00 0.00 178.00 179.55 3iam h LEU 593 N 0.91 0.89 -0.44 2.35 -0.00 -2.00 -3.00 115.31 114.02 3iam h LEU 593 Ca 0.22 -0.04 -0.18 0.00 -0.00 0.00 0.00 57.88 57.89 3iam h LEU 593 Cb 0.14 -0.22 -0.01 0.00 -0.00 0.00 0.00 40.66 40.57 3iam h LEU 593 CO -0.02 0.67 -0.69 0.00 -0.00 0.00 0.00 178.44 178.40 3iam h ALA 594 N 1.49 0.63 0.00 1.53 0.00 -1.85 -2.63 119.26 118.43 3iam h ALA 594 Ca 0.27 -0.58 0.00 0.00 0.00 0.00 0.00 54.91 54.60 3iam h ALA 594 Cb -0.08 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.65 3iam h ALA 594 CO -0.06 0.74 0.00 -0.85 0.00 0.00 0.00 179.25 179.09 3iam n GLU 595 N -3.87 0.26 0.00 0.00 0.28 -1.03 -1.24 120.64 115.04 3iam n GLU 595 Ca -0.04 0.09 0.00 0.00 -0.16 0.00 0.00 57.16 57.05 3iam n GLU 595 Cb 0.68 -1.50 0.00 0.00 1.43 0.00 0.00 31.44 32.05 3iam n GLU 595 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 3iam n ARG 596 N -1.31 5.61 0.00 3.44 1.74 -1.20 -4.75 116.66 120.20 3iam n ARG 596 Ca 0.09 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.17 3iam n ARG 596 Cb 0.18 -0.56 0.00 0.00 -1.02 0.00 0.00 32.46 31.05 3iam n ARG 596 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 3iam n TYR 597 N -1.04 0.00 -4.02 -1.55 4.02 -1.00 -5.09 117.16 108.48 3iam n TYR 597 Ca 0.00 0.00 -0.23 0.00 -0.01 0.00 0.00 57.90 57.66 3iam n TYR 597 Cb 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.29 3iam n TYR 597 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 3iam s ALA 598 N -0.32 3.79 -0.05 -0.72 0.00 -0.38 -4.81 121.76 119.27 3iam s ALA 598 Ca 0.00 -1.24 0.04 0.00 0.00 0.00 0.00 51.96 50.77 3iam s ALA 598 Cb 0.00 -1.57 -0.06 0.00 0.00 0.00 0.00 23.12 21.49 3iam s ALA 598 CO 0.00 0.35 0.02 0.72 0.00 0.00 0.00 175.76 176.85 3iam n HIS 599 N -0.99 0.00 -3.66 0.00 8.25 -1.00 -4.84 115.22 112.98 3iam n HIS 599 Ca -0.08 0.00 -0.20 0.00 -0.26 0.00 0.00 57.72 57.17 3iam n HIS 599 Cb 0.56 -0.24 -0.18 0.00 1.12 0.00 0.00 29.99 31.26 3iam n HIS 599 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 3iam s VAL 600 N -2.12 -0.12 -0.25 1.59 1.01 -1.10 -2.57 120.40 116.85 3iam s VAL 600 Ca -0.02 0.36 -0.06 0.00 0.00 0.00 0.00 61.98 62.26 3iam s VAL 600 Cb 0.01 -0.20 -0.01 0.00 0.00 0.00 0.00 36.38 36.18 3iam s VAL 600 CO 0.20 0.13 0.03 -0.69 0.00 0.00 0.00 175.10 174.76 3iam s VAL 601 N 2.18 3.81 -0.15 2.92 1.01 -0.70 -1.31 120.40 128.16 3iam s VAL 601 Ca 0.05 -0.47 -0.03 0.00 0.00 0.00 0.00 61.98 61.52 3iam s VAL 601 Cb -0.12 -2.83 -0.03 0.00 0.00 0.00 0.00 36.38 33.40 3iam s VAL 601 CO -0.04 0.29 -0.04 -0.76 0.00 0.00 0.00 175.10 174.55 3iam s LEU 602 N 1.52 3.23 0.18 3.92 1.02 -0.43 -0.88 118.68 127.24 3iam s LEU 602 Ca 0.05 -0.12 -0.31 0.00 0.02 0.00 0.00 54.13 53.77 3iam s LEU 602 Cb -0.15 -1.77 -0.09 0.00 0.02 0.00 0.00 46.19 44.19 3iam s LEU 602 CO 0.00 0.18 1.45 -2.16 0.02 0.00 0.00 176.35 175.85 3iam s PRO 603 N 0.27 4.28 0.27 1.29 0.04 -1.26 -2.47 135.00 137.41 3iam s PRO 603 Ca -0.03 2.23 0.06 0.00 0.04 0.00 0.00 61.00 63.30 3iam s PRO 603 Cb -0.14 -3.17 -0.06 0.00 0.04 0.00 0.00 34.50 31.17 3iam s PRO 603 CO 0.03 -0.47 -0.05 0.00 0.04 0.00 0.00 177.00 176.55 3iam s ALA 604 N 0.72 2.23 0.14 8.56 0.00 0.27 -2.57 121.76 131.11 3iam s ALA 604 Ca 0.64 -1.86 -0.10 0.00 0.00 0.00 0.00 51.96 50.63 3iam s ALA 604 Cb -0.40 0.23 -0.06 0.00 0.00 0.00 0.00 23.12 22.88 3iam s ALA 604 CO 0.35 -0.10 0.47 -2.14 0.00 0.00 0.00 175.76 174.35 3iam s PRO 605 N -3.75 3.81 1.41 0.00 0.02 -1.26 -4.38 135.00 130.85 3iam s PRO 605 Ca 0.29 0.25 -0.22 0.00 0.02 0.00 0.00 61.00 61.33 3iam s PRO 605 Cb 0.04 -2.87 0.36 0.00 0.02 0.00 0.00 34.50 32.05 3iam s PRO 605 CO 0.11 0.46 0.94 0.95 -0.33 0.00 0.00 177.00 179.13 3iam s THR 606 N -1.56 1.24 -0.22 0.99 -4.23 -1.26 -4.93 115.64 105.68 3iam s THR 606 Ca 0.39 0.00 0.19 0.00 -1.18 0.00 0.00 61.69 61.09 3iam s THR 606 Cb -0.13 -2.08 0.18 0.00 1.34 0.00 0.00 72.50 71.81 3iam s THR 606 CO 0.20 0.00 1.54 2.19 -0.54 0.00 0.00 174.62 178.01 3iam h PHE 607 N -3.39 0.00 0.00 3.99 -5.15 -1.97 -3.06 116.94 107.36 3iam h PHE 607 Ca -0.44 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.33 3iam h PHE 607 Cb 1.34 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.51 3iam h PHE 607 CO -3.13 0.30 0.00 1.88 -2.00 0.00 0.00 178.31 175.37 3iam h TYR 608 N 0.00 0.00 0.00 6.09 0.05 -1.91 -2.86 116.97 118.34 3iam h TYR 608 Ca -0.00 0.00 -0.03 0.00 0.05 0.00 0.00 58.73 58.75 3iam h TYR 608 Cb 1.18 0.00 -0.06 0.00 1.01 0.00 0.00 36.73 38.86 3iam h TYR 608 CO 0.00 0.00 -0.48 -0.85 -1.05 0.00 0.00 178.16 175.78 3iam n GLU 609 N -2.69 1.19 -4.28 4.88 0.28 -1.16 -0.59 120.64 118.28 3iam n GLU 609 Ca -0.01 -2.82 -0.31 0.00 -0.16 0.00 0.00 57.16 53.86 3iam n GLU 609 Cb 0.12 -1.28 -0.09 0.00 1.43 0.00 0.00 31.44 31.61 3iam n GLU 609 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 177.13 177.12 3iam s LYS 610 N -2.48 2.48 -0.17 3.44 1.02 -1.08 -4.67 119.74 118.28 3iam s LYS 610 Ca 0.34 -0.82 -0.04 0.00 0.02 0.00 0.00 55.97 55.48 3iam s LYS 610 Cb 0.33 -2.49 -0.02 0.00 -0.52 0.00 0.00 37.83 35.13 3iam s LYS 610 CO -0.06 0.56 -0.04 0.50 -0.92 0.00 0.00 175.35 175.40 3iam s ARG 611 N -1.90 3.60 0.00 1.68 3.52 -1.26 -3.32 118.95 121.27 3iam s ARG 611 Ca 0.21 -0.55 0.00 0.00 -0.13 0.00 0.00 55.73 55.27 3iam s ARG 611 Cb -0.11 -2.94 0.00 0.00 -1.56 0.00 0.00 34.95 30.34 3iam s ARG 611 CO 0.13 0.14 0.00 0.41 -0.81 0.00 0.00 175.30 175.17 3iam n GLY 612 N 3.83 -1.08 3.62 8.12 0.00 -0.97 -5.02 105.19 113.69 3iam n GLY 612 Ca -0.17 -1.15 -0.26 0.00 0.00 0.00 0.00 46.02 44.44 3iam n GLY 612 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3iam s HIS 613 N -3.00 2.51 0.10 1.61 3.76 -1.26 -0.63 115.29 118.39 3iam s HIS 613 Ca 0.00 -0.55 0.01 0.00 -0.15 0.00 0.00 55.06 54.37 3iam s HIS 613 Cb 0.00 -1.62 -0.04 0.00 1.11 0.00 0.00 32.58 32.03 3iam s HIS 613 CO 0.00 0.46 -0.05 -0.51 -0.85 0.00 0.00 174.74 173.79 3iam s LEU 614 N -3.71 2.41 -0.18 0.89 1.43 -0.55 -0.85 118.68 118.11 3iam s LEU 614 Ca 0.35 -1.04 0.00 0.00 -1.03 0.00 0.00 54.13 52.41 3iam s LEU 614 Cb 0.04 -0.02 0.01 0.00 0.03 0.00 0.00 46.19 46.26 3iam s LEU 614 CO 0.19 -0.51 -0.17 -0.69 0.23 0.00 0.00 176.35 175.40 3iam s VAL 615 N -3.69 2.35 0.84 -1.59 1.01 -1.26 -1.94 120.40 116.12 3iam s VAL 615 Ca 0.14 -0.85 -0.11 0.00 0.00 0.00 0.00 61.98 61.16 3iam s VAL 615 Cb 0.06 -2.00 0.10 0.00 0.00 0.00 0.00 36.38 34.53 3iam s VAL 615 CO -0.04 0.52 1.13 0.21 0.00 0.00 0.00 175.10 176.92 3iam s ASN 616 N 1.26 3.71 0.41 3.32 3.84 0.18 -4.13 114.94 123.52 3iam s ASN 616 Ca 0.04 2.06 0.29 0.00 0.21 0.00 0.00 52.86 55.45 3iam s ASN 616 Cb -0.14 -2.55 1.36 0.00 -0.55 0.00 0.00 41.25 39.38 3iam s ASN 616 CO -0.09 -2.58 1.87 0.17 -2.79 0.00 0.00 177.10 173.68 3iam h LEU 617 N -1.39 0.00 -3.30 3.21 -0.00 -1.56 0.77 115.31 113.04 3iam h LEU 617 Ca -0.44 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.44 3iam h LEU 617 Cb 1.26 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.92 3iam h LEU 617 CO 0.46 0.00 0.00 -1.84 -0.00 0.00 0.00 178.44 177.06 3iam n GLU 618 N -2.57 3.72 -0.99 0.17 0.28 -1.26 -4.37 120.64 115.62 3iam n GLU 618 Ca -0.00 -2.88 0.00 0.00 -0.16 0.00 0.00 57.16 54.12 3iam n GLU 618 Cb 0.17 -1.94 0.00 0.00 1.43 0.00 0.00 31.44 31.10 3iam n GLU 618 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 3iam n GLY 619 N 0.29 0.45 3.93 -1.84 0.00 0.27 -4.56 105.19 103.72 3iam n GLY 619 Ca 0.23 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.98 3iam n GLY 619 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3iam s ARG 620 N -0.31 1.89 -0.10 1.61 3.52 -1.26 -1.77 118.95 122.53 3iam s ARG 620 Ca 0.00 -0.23 0.01 0.00 -0.13 0.00 0.00 55.73 55.39 3iam s ARG 620 Cb 0.00 -2.07 0.02 0.00 -1.56 0.00 0.00 34.95 31.33 3iam s ARG 620 CO 0.00 -1.51 -0.13 0.14 -0.81 0.00 0.00 175.30 172.99 3iam s VAL 621 N -3.42 1.34 0.05 7.11 -7.23 -0.54 0.49 120.40 118.20 3iam s VAL 621 Ca 0.63 -0.54 0.08 0.00 -1.81 0.00 0.00 61.98 60.34 3iam s VAL 621 Cb -0.10 -1.25 -0.03 0.00 0.56 0.00 0.00 36.38 35.56 3iam s VAL 621 CO 0.47 0.41 -0.23 -0.76 -0.31 0.00 0.00 175.10 174.68 3iam s LEU 622 N 1.11 2.35 0.38 1.32 1.02 -0.82 -0.40 118.68 123.64 3iam s LEU 622 Ca -0.05 -0.53 -0.25 0.00 0.02 0.00 0.00 54.13 53.32 3iam s LEU 622 Cb -0.14 -1.38 -0.09 0.00 0.02 0.00 0.00 46.19 44.60 3iam s LEU 622 CO -0.03 0.26 1.09 -2.16 0.02 0.00 0.00 176.35 175.53 3iam s PRO 623 N -1.35 4.21 -0.24 1.29 0.04 -1.26 -1.49 135.00 136.20 3iam s PRO 623 Ca 0.13 1.65 0.02 0.00 0.04 0.00 0.00 61.00 62.84 3iam s PRO 623 Cb -0.10 -2.69 0.04 0.00 0.04 0.00 0.00 34.50 31.79 3iam s PRO 623 CO 0.03 -0.13 -0.12 -1.17 0.04 0.00 0.00 177.00 175.65 3iam s LEU 624 N -2.40 3.08 0.28 -3.56 2.96 0.20 -3.86 118.68 115.38 3iam s LEU 624 Ca 0.55 -1.12 -0.01 0.00 -0.22 0.00 0.00 54.13 53.33 3iam s LEU 624 Cb -0.26 -1.55 -0.04 0.00 0.50 0.00 0.00 46.19 44.83 3iam s LEU 624 CO 0.33 -0.13 0.48 -0.44 -1.32 0.00 0.00 176.35 175.27 3iam s SER 625 N 1.19 6.36 -0.31 3.68 0.01 -1.25 -2.29 113.70 121.09 3iam s SER 625 Ca -0.04 0.47 -0.12 0.00 1.31 0.00 0.00 55.95 57.57 3iam s SER 625 Cb -0.18 -2.04 -0.04 0.00 0.21 0.00 0.00 66.02 63.98 3iam s SER 625 CO -0.07 -0.17 0.21 -2.16 0.41 0.00 0.00 173.24 171.46 3iam s PRO 626 N -3.79 3.76 0.42 12.44 0.04 -1.21 -4.23 135.00 142.42 3iam s PRO 626 Ca 0.40 -0.45 -0.22 0.00 0.04 0.00 0.00 61.00 60.77 3iam s PRO 626 Cb -0.10 -3.72 -0.10 0.00 0.04 0.00 0.00 34.50 30.61 3iam s PRO 626 CO 0.32 -0.29 0.98 0.00 0.04 0.00 0.00 177.00 178.04 3iam s ALA 627 N 1.75 3.05 0.00 8.56 0.00 0.25 -4.92 121.76 130.45 3iam s ALA 627 Ca 0.07 0.50 0.00 0.00 0.00 0.00 0.00 51.96 52.52 3iam s ALA 627 Cb -0.17 -3.19 0.00 0.00 0.00 0.00 0.00 23.12 19.77 3iam s ALA 627 CO 0.11 0.02 1.06 -2.30 0.00 0.00 0.00 175.76 174.65 3iam n PRO 628 N -0.41 0.60 -1.97 0.00 -0.02 -1.26 -4.72 135.00 127.23 3iam n PRO 628 Ca 0.06 0.00 -0.29 0.00 -2.02 0.00 0.00 63.50 61.25 3iam n PRO 628 Cb 0.52 -1.20 0.06 0.00 -0.02 0.00 0.00 33.50 32.87 3iam n PRO 628 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3iam s ILE 629 N 0.71 2.89 -0.83 4.25 1.01 -1.26 -3.44 121.20 124.53 3iam s ILE 629 Ca 0.00 0.21 -0.25 0.00 0.00 0.00 0.00 60.65 60.61 3iam s ILE 629 Cb 0.00 -3.27 0.01 0.00 0.01 0.00 0.00 42.46 39.21 3iam s ILE 629 CO 0.00 -0.35 1.60 -0.70 0.00 0.00 0.00 174.94 175.50 3iam s GLU 630 N -5.39 3.04 0.02 2.79 2.56 0.15 -4.82 118.70 117.05 3iam s GLU 630 Ca 0.59 -0.32 0.25 0.00 0.00 0.00 0.00 54.97 55.49 3iam s GLU 630 Cb -0.11 -4.76 1.05 0.00 2.00 0.00 0.00 34.13 32.31 3iam s GLU 630 CO 0.50 -2.57 1.79 0.27 -0.56 0.00 0.00 175.26 174.69 3iam n ASN 631 N 11.00 0.05 0.00 -1.70 6.94 -1.26 -5.01 115.26 125.28 3iam n ASN 631 Ca 0.24 0.51 0.00 0.00 -0.02 0.00 0.00 54.58 55.30 3iam n ASN 631 Cb 0.50 -0.52 0.00 0.00 -2.36 0.00 0.00 39.78 37.40 3iam n ASN 631 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3iam n GLY 632 N 1.06 3.18 2.76 4.83 0.00 -1.26 -2.36 105.19 113.39 3iam n GLY 632 Ca 0.06 -0.24 -0.38 0.00 0.00 0.00 0.00 46.02 45.45 3iam n GLY 632 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3iam n GLU 633 N 14.00 4.17 -4.12 1.61 2.13 -0.90 -5.01 120.64 132.53 3iam n GLU 633 Ca 0.00 -4.27 -0.27 0.00 0.66 0.00 0.00 57.16 53.28 3iam n GLU 633 Cb 0.00 -2.36 -0.06 0.00 0.27 0.00 0.00 31.44 29.28 3iam n GLU 633 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3iam s ALA 634 N -4.12 3.45 0.05 4.31 0.00 -0.99 -4.71 121.76 119.74 3iam s ALA 634 Ca 0.45 -1.24 0.03 0.00 0.00 0.00 0.00 51.96 51.20 3iam s ALA 634 Cb 0.30 -1.25 -0.02 0.00 0.00 0.00 0.00 23.12 22.14 3iam s ALA 634 CO -0.24 0.52 -0.09 -1.21 0.00 0.00 0.00 175.76 174.74 3iam s GLU 635 N -2.97 0.60 0.92 0.00 0.41 -1.06 -4.95 118.70 111.65 3iam s GLU 635 Ca 0.30 -0.79 -0.11 0.00 -0.41 0.00 0.00 54.97 53.95 3iam s GLU 635 Cb -0.10 -0.43 0.15 0.00 -1.78 0.00 0.00 34.13 31.97 3iam s GLU 635 CO 0.22 0.08 1.09 0.20 -0.49 0.00 0.00 175.26 176.36 3iam s GLY 636 N -1.59 1.62 0.50 -1.39 0.00 -1.26 -4.41 107.32 100.79 3iam s GLY 636 Ca -0.08 0.03 0.30 0.00 0.00 0.00 0.00 44.72 44.98 3iam s GLY 636 CO 0.01 0.53 1.87 0.00 0.00 0.00 0.00 173.10 175.51 3iam h ALA 637 N -1.70 1.00 0.12 3.20 0.00 -1.96 -1.63 119.26 118.29 3iam h ALA 637 Ca -0.50 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.42 3iam h ALA 637 Cb 1.28 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.05 3iam h ALA 637 CO 0.52 0.00 -0.31 1.25 0.00 0.00 0.00 179.25 180.71 3iam h LEU 638 N 0.00 -0.91 0.97 0.00 5.85 -1.92 -1.41 115.31 117.89 3iam h LEU 638 Ca 0.00 0.09 -0.05 0.00 0.84 0.00 0.00 57.88 58.76 3iam h LEU 638 Cb 0.62 0.33 0.01 0.00 0.37 0.00 0.00 40.66 41.99 3iam h LEU 638 CO 0.00 -0.34 -0.47 -0.61 -0.34 0.00 0.00 178.44 176.68 3iam h GLN 639 N -0.47 -1.26 -1.08 1.25 5.75 -1.73 -3.24 115.11 114.33 3iam h GLN 639 Ca -0.01 0.09 0.29 0.00 -0.15 0.00 0.00 58.65 58.86 3iam h GLN 639 Cb 0.46 0.29 -0.09 0.00 1.07 0.00 0.00 27.48 29.20 3iam h GLN 639 CO -0.14 -0.84 0.70 0.28 -2.65 0.00 0.00 178.83 176.18 3iam h VAL 640 N -1.33 0.48 -0.39 2.39 2.07 -1.33 -0.24 116.25 117.89 3iam h VAL 640 Ca -0.13 -0.11 -0.01 0.00 0.82 0.00 0.00 66.70 67.27 3iam h VAL 640 Cb 1.00 0.13 -0.02 0.00 -1.52 0.00 0.00 31.29 30.88 3iam h VAL 640 CO 0.22 0.06 0.21 -0.07 0.02 0.00 0.00 177.57 178.01 3iam h LEU 641 N 0.32 0.49 -2.15 2.57 3.38 -1.28 -2.43 115.31 116.21 3iam h LEU 641 Ca 0.61 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.49 3iam h LEU 641 Cb 1.68 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 42.30 3iam h LEU 641 CO -0.27 0.44 0.01 0.00 0.09 0.00 0.00 178.44 178.71 3iam h ALA 642 N 1.07 1.86 0.00 1.53 0.00 -1.11 0.12 119.26 122.72 3iam h ALA 642 Ca 0.14 -0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.96 3iam h ALA 642 Cb 0.06 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 3iam h ALA 642 CO -0.02 -0.02 -0.43 1.25 0.00 0.00 0.00 179.25 180.03 3iam h LEU 643 N 0.00 0.00 0.00 0.00 5.85 -1.27 -2.18 115.31 117.71 3iam h LEU 643 Ca 0.01 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.73 3iam h LEU 643 Cb 0.03 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.06 3iam h LEU 643 CO -0.00 0.43 -0.47 -0.11 -0.34 0.00 0.00 178.44 177.95 3iam n LEU 644 N -3.45 0.47 0.07 2.25 7.94 -0.10 -2.87 117.00 121.31 3iam n LEU 644 Ca 0.00 0.06 -0.23 0.00 -1.11 0.00 0.00 56.01 54.73 3iam n LEU 644 Cb 0.58 -0.26 -0.15 0.00 0.53 0.00 0.00 43.42 44.12 3iam n LEU 644 CO 0.38 0.10 -0.53 0.00 -1.11 0.00 0.00 177.39 176.23 3iam h ALA 645 N 2.96 0.15 0.42 1.96 0.00 -0.65 -3.25 119.26 120.86 3iam h ALA 645 Ca 0.00 -1.14 -0.02 0.00 0.00 0.00 0.00 54.91 53.75 3iam h ALA 645 Cb 0.52 0.46 0.00 0.00 0.00 0.00 0.00 17.79 18.77 3iam h ALA 645 CO 0.00 1.01 -0.20 0.93 0.00 0.00 0.00 179.25 180.99 3iam h GLU 646 N 0.09 -0.54 0.00 0.00 5.08 -1.50 -2.32 114.58 115.38 3iam h GLU 646 Ca -0.34 0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.05 3iam h GLU 646 Cb 2.09 0.12 0.00 0.00 0.50 0.00 0.00 28.75 31.46 3iam h GLU 646 CO 0.17 -0.27 0.06 0.00 -1.00 0.00 0.00 179.01 177.98 3iam n ALA 647 N -2.44 0.92 -1.00 3.43 0.00 -1.14 -0.69 120.51 119.59 3iam n ALA 647 Ca -0.11 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.35 3iam n ALA 647 Cb 0.28 -0.73 0.02 0.00 0.00 0.00 0.00 19.45 19.02 3iam n ALA 647 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3iam n LEU 648 N -1.10 0.85 0.00 0.00 4.77 -1.09 -4.65 117.00 115.79 3iam n LEU 648 Ca 0.00 -1.20 0.00 0.00 -0.03 0.00 0.00 56.01 54.78 3iam n LEU 648 Cb 0.06 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 3iam n LEU 648 CO 0.00 0.29 0.00 0.61 -1.33 0.00 0.00 177.39 176.96 3iam n GLY 649 N -0.34 0.96 3.64 -0.72 0.00 0.13 -5.04 105.19 103.82 3iam n GLY 649 Ca 0.02 -1.10 -0.48 0.00 0.00 0.00 0.00 46.02 44.46 3iam n GLY 649 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3iam n VAL 650 N 0.00 0.14 -2.07 1.61 0.31 -1.25 -4.44 118.33 112.62 3iam n VAL 650 Ca 0.00 -0.04 -0.38 0.00 -0.01 0.00 0.00 64.34 63.91 3iam n VAL 650 Cb 0.00 -1.26 0.01 0.00 -0.91 0.00 0.00 33.84 31.67 3iam n VAL 650 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3iam s ARG 651 N 0.57 3.65 0.44 5.55 1.04 -1.26 -4.25 118.95 124.69 3iam s ARG 651 Ca 0.79 2.00 -0.24 0.00 -1.04 0.00 0.00 55.73 57.24 3iam s ARG 651 Cb -0.77 -2.47 -0.08 0.00 -2.04 0.00 0.00 34.95 29.59 3iam s ARG 651 CO 0.43 -0.71 1.22 -1.25 -0.04 0.00 0.00 175.30 174.95 3iam s PRO 652 N -2.62 3.83 0.00 3.89 0.04 -1.26 -4.96 135.00 133.92 3iam s PRO 652 Ca 0.64 1.94 0.29 0.00 0.04 0.00 0.00 61.00 63.90 3iam s PRO 652 Cb -0.34 -2.56 1.22 0.00 0.04 0.00 0.00 34.50 32.86 3iam s PRO 652 CO 0.42 -0.53 1.90 -2.30 0.04 0.00 0.00 177.00 176.53 3iam n PRO 653 N -0.22 0.13 -4.91 0.56 -0.02 -1.26 -4.86 135.00 124.42 3iam n PRO 653 Ca 0.06 -0.01 -0.30 0.00 -2.02 0.00 0.00 63.50 61.22 3iam n PRO 653 Cb 0.46 -1.50 -0.15 0.00 -0.02 0.00 0.00 33.50 32.29 3iam n PRO 653 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 3iam s PHE 654 N -2.88 2.30 0.00 6.00 0.40 -1.26 -4.98 117.98 117.56 3iam s PHE 654 Ca 0.18 -0.41 0.00 0.00 -0.60 0.00 0.00 56.93 56.09 3iam s PHE 654 Cb 0.19 -1.38 0.00 0.00 0.51 0.00 0.00 43.02 42.34 3iam s PHE 654 CO 0.53 0.12 0.00 0.54 0.70 0.00 0.00 175.22 177.11 3iam n ARG 655 N 1.79 0.00 -1.60 0.44 1.74 -1.26 -4.82 116.66 112.95 3iam n ARG 655 Ca -0.17 0.00 -0.16 0.00 -0.77 0.00 0.00 57.85 56.75 3iam n ARG 655 Cb 0.52 0.00 0.10 0.00 -1.02 0.00 0.00 32.46 32.06 3iam n ARG 655 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3iam n LEU 656 N 0.00 0.00 0.08 0.55 4.77 -1.26 -4.42 117.00 116.71 3iam n LEU 656 Ca 0.00 -1.18 -0.13 0.00 -0.03 0.00 0.00 56.01 54.67 3iam n LEU 656 Cb 0.00 -0.50 -0.14 0.00 -2.33 0.00 0.00 43.42 40.45 3iam n LEU 656 CO 0.00 -0.92 -0.08 -0.74 -1.33 0.00 0.00 177.39 174.31 3iam h HIS 657 N -0.90 0.33 -0.91 -1.77 -0.00 -1.99 -3.00 115.15 106.91 3iam h HIS 657 Ca -0.23 -0.24 0.14 0.00 -0.00 0.00 0.00 60.37 60.03 3iam h HIS 657 Cb 0.77 -0.01 -0.07 0.00 -0.00 0.00 0.00 27.41 28.09 3iam h HIS 657 CO 0.00 1.21 0.58 1.25 -0.00 0.00 0.00 177.93 180.98 3iam h LEU 658 N 0.05 0.70 0.07 0.26 6.46 -2.01 -2.63 115.31 118.21 3iam h LEU 658 Ca -0.13 0.04 -0.34 0.00 -0.12 0.00 0.00 57.88 57.33 3iam h LEU 658 Cb 1.93 -0.10 -0.03 0.00 -0.73 0.00 0.00 40.66 41.73 3iam h LEU 658 CO 0.17 0.36 -1.94 -0.62 -0.62 0.00 0.00 178.44 175.79 3iam n GLU 659 N -4.57 0.71 0.04 1.25 -0.58 -1.25 -3.86 120.64 112.38 3iam n GLU 659 Ca 0.18 0.26 0.16 0.00 -0.42 0.00 0.00 57.16 57.33 3iam n GLU 659 Cb 0.45 -1.72 0.64 0.00 -0.57 0.00 0.00 31.44 30.24 3iam n GLU 659 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3iam h ALA 660 N 0.44 2.30 0.00 0.62 0.00 -1.36 -0.87 119.26 120.39 3iam h ALA 660 Ca -0.39 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.51 3iam h ALA 660 Cb 2.03 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.83 3iam h ALA 660 CO 0.07 -0.41 -0.01 1.96 0.00 0.00 0.00 179.25 180.86 3iam h GLN 661 N 0.08 0.00 0.00 0.00 1.08 -1.58 -1.57 115.11 113.12 3iam h GLN 661 Ca 0.20 0.00 -0.12 0.00 -1.45 0.00 0.00 58.65 57.28 3iam h GLN 661 Cb 0.70 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 28.11 3iam h GLN 661 CO -0.02 0.01 -0.57 0.87 -0.95 0.00 0.00 178.83 178.17 3iam h LYS 662 N 0.00 0.00 0.00 1.46 1.79 -1.35 -2.41 116.57 116.06 3iam h LYS 662 Ca -0.00 0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.45 3iam h LYS 662 Cb 0.03 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 30.67 3iam h LYS 662 CO 0.00 0.57 -0.11 0.00 -1.08 0.00 0.00 179.45 178.83 3iam h ALA 663 N 1.43 0.94 0.24 3.86 0.00 -1.38 -2.04 119.26 122.31 3iam h ALA 663 Ca -0.01 -0.10 -0.33 0.00 0.00 0.00 0.00 54.91 54.47 3iam h ALA 663 Cb 1.15 -0.02 0.04 0.00 0.00 0.00 0.00 17.79 18.96 3iam h ALA 663 CO 0.07 0.14 -1.46 -0.07 0.00 0.00 0.00 179.25 177.93 3iam h LEU 664 N 0.00 0.80 0.00 0.00 3.38 -1.46 -3.02 115.31 115.01 3iam h LEU 664 Ca -0.00 -0.86 0.00 0.00 0.09 0.00 0.00 57.88 57.11 3iam h LEU 664 Cb 0.99 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.48 3iam h LEU 664 CO 0.01 1.68 0.00 1.17 0.09 0.00 0.00 178.44 181.39 3iam n LYS 665 N -3.69 0.28 -0.10 1.13 4.81 -0.91 -2.21 118.16 117.46 3iam n LYS 665 Ca -0.16 0.11 -0.12 0.00 -0.87 0.00 0.00 58.31 57.27 3iam n LYS 665 Cb 1.10 -1.50 -0.15 0.00 0.02 0.00 0.00 35.03 34.50 3iam n LYS 665 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3iam n ALA 666 N -1.21 1.48 0.45 3.14 0.00 -0.78 -3.96 120.51 119.62 3iam n ALA 666 Ca 0.08 -1.27 0.12 0.00 0.00 0.00 0.00 53.44 52.37 3iam n ALA 666 Cb 0.10 -0.18 0.48 0.00 0.00 0.00 0.00 19.45 19.84 3iam n ALA 666 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3iam n ARG 667 N -2.87 0.22 -2.65 0.00 5.12 -0.94 -4.92 116.66 110.63 3iam n ARG 667 Ca -0.35 0.38 -0.05 0.00 -1.93 0.00 0.00 57.85 55.90 3iam n ARG 667 Cb 1.12 -1.87 0.01 0.00 -1.16 0.00 0.00 32.46 30.56 3iam n ARG 667 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 3iam n LYS 668 N -2.28 -1.50 -2.84 5.56 5.02 -0.96 -5.04 118.16 116.13 3iam n LYS 668 Ca 0.03 0.18 -0.42 0.00 -2.02 0.00 0.00 58.31 56.08 3iam n LYS 668 Cb 0.28 -3.30 -0.04 0.00 -0.02 0.00 0.00 35.03 31.95 3iam n LYS 668 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3iam s VAL 669 N -2.96 4.77 1.06 -0.18 0.11 -1.08 -5.03 120.40 117.08 3iam s VAL 669 Ca 0.11 1.58 -0.17 0.00 -2.93 0.00 0.00 61.98 60.57 3iam s VAL 669 Cb -0.05 -4.19 0.07 0.00 -1.53 0.00 0.00 36.38 30.69 3iam s VAL 669 CO 0.13 -0.17 0.10 -0.81 -3.33 0.00 0.00 175.10 171.03 3iam n PRO 670 N 6.19 -1.07 0.00 1.54 -0.04 -1.26 -4.69 135.00 135.66 3iam n PRO 670 Ca 0.07 -0.29 0.00 0.00 -0.04 0.00 0.00 63.50 63.24 3iam n PRO 670 Cb 0.47 -1.73 0.00 0.00 -0.04 0.00 0.00 33.50 32.20 3iam n PRO 670 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 3iam n GLU 671 N -1.77 -0.63 -1.94 0.54 2.13 -1.26 -4.86 120.64 112.85 3iam n GLU 671 Ca 0.03 0.00 -0.38 0.00 0.66 0.00 0.00 57.16 57.46 3iam n GLU 671 Cb 0.59 0.00 0.02 0.00 0.27 0.00 0.00 31.44 32.32 3iam n GLU 671 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3iam s ALA 672 N -2.99 2.97 0.00 4.31 0.00 -1.26 -2.96 121.76 121.83 3iam s ALA 672 Ca 0.00 1.23 0.00 0.00 0.00 0.00 0.00 51.96 53.19 3iam s ALA 672 Cb 0.00 -3.51 0.00 0.00 0.00 0.00 0.00 23.12 19.61 3iam s ALA 672 CO 0.00 -1.10 0.00 -1.33 0.00 0.00 0.00 175.76 173.33 3iam n MET 673 N -0.64 0.00 -1.98 0.00 2.81 0.46 -4.99 117.12 112.78 3iam n MET 673 Ca 0.08 0.00 -0.29 0.00 -1.81 0.00 0.00 57.70 55.68 3iam n MET 673 Cb 0.45 -1.78 0.18 0.00 -0.71 0.00 0.00 33.22 31.36 3iam n MET 673 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 3iam s GLY 674 N -1.66 1.78 -0.05 3.03 0.00 -1.15 -4.64 107.32 104.62 3iam s GLY 674 Ca 0.00 -1.23 0.03 0.00 0.00 0.00 0.00 44.72 43.52 3iam s GLY 674 CO 0.00 -0.48 -0.15 0.50 0.00 0.00 0.00 173.10 172.97 3iam s ARG 675 N -5.83 1.74 -0.41 2.90 0.52 -1.26 -1.46 118.95 115.15 3iam s ARG 675 Ca 0.73 -0.52 -0.13 0.00 -0.52 0.00 0.00 55.73 55.29 3iam s ARG 675 Cb -0.04 -1.47 0.03 0.00 0.52 0.00 0.00 34.95 33.99 3iam s ARG 675 CO 0.52 0.14 0.28 -1.17 0.02 0.00 0.00 175.30 175.09 3iam s LEU 676 N 0.32 5.06 0.04 2.53 1.98 -0.73 -4.84 118.68 123.04 3iam s LEU 676 Ca -0.09 -1.04 -0.30 0.00 -2.89 0.00 0.00 54.13 49.81 3iam s LEU 676 Cb -0.13 -2.10 -0.05 0.00 0.66 0.00 0.00 46.19 44.56 3iam s LEU 676 CO 0.03 -0.46 1.21 -0.44 -1.89 0.00 0.00 176.35 174.80 3iam s SER 677 N 1.80 7.06 -0.30 3.68 0.01 -1.26 -4.92 113.70 119.76 3iam s SER 677 Ca 0.04 2.00 -0.03 0.00 1.31 0.00 0.00 55.95 59.27 3iam s SER 677 Cb -0.20 -2.58 0.19 0.00 0.21 0.00 0.00 66.02 63.64 3iam s SER 677 CO 0.08 -0.50 0.77 0.12 0.41 0.00 0.00 173.24 174.12 3iam s PHE 678 N 1.28 -1.27 0.15 2.43 5.36 -1.26 -5.16 117.98 119.51 3iam s PHE 678 Ca 0.59 0.96 0.04 0.00 -0.96 0.00 0.00 56.93 57.56 3iam s PHE 678 Cb -0.29 0.30 -0.04 0.00 -0.34 0.00 0.00 43.02 42.65 3iam s PHE 678 CO 0.28 -0.73 0.16 1.03 -1.46 0.00 0.00 175.22 174.50 3iam s ARG 679 N 2.89 3.00 -0.12 10.12 0.52 -1.26 -4.80 118.95 129.29 3iam s ARG 679 Ca 0.15 -0.81 -0.04 0.00 -0.52 0.00 0.00 55.73 54.51 3iam s ARG 679 Cb -0.09 -2.71 0.06 0.00 0.52 0.00 0.00 34.95 32.73 3iam s ARG 679 CO -0.22 0.50 0.20 -1.17 0.02 0.00 0.00 175.30 174.63 3iam s LEU 680 N -3.07 -0.15 -0.40 2.53 2.96 -0.71 -5.01 118.68 114.82 3iam s LEU 680 Ca 0.31 0.33 -0.07 0.00 -0.22 0.00 0.00 54.13 54.48 3iam s LEU 680 Cb -0.10 0.42 0.08 0.00 0.50 0.00 0.00 46.19 47.09 3iam s LEU 680 CO 0.24 -0.26 0.21 -0.75 -1.32 0.00 0.00 176.35 174.48 3iam s LYS 681 N 2.34 2.45 0.00 1.98 2.20 -1.26 -4.12 119.74 123.32 3iam s LYS 681 Ca 0.03 -1.51 0.00 0.00 -0.36 0.00 0.00 55.97 54.13 3iam s LYS 681 Cb -0.13 -3.65 0.00 0.00 -1.51 0.00 0.00 37.83 32.54 3iam s LYS 681 CO -0.08 -0.93 0.00 -0.85 -0.36 0.00 0.00 175.35 173.13 3iam n GLU 682 N 4.80 0.00 -3.72 4.03 0.28 -1.26 -5.18 120.64 119.59 3iam n GLU 682 Ca -0.09 0.00 -0.12 0.00 -0.16 0.00 0.00 57.16 56.79 3iam n GLU 682 Cb 0.43 0.00 -0.13 0.00 1.43 0.00 0.00 31.44 33.17 3iam n GLU 682 CO 0.00 0.00 0.00 -0.48 -0.16 0.00 0.00 177.13 176.49 3iam s LEU 683 N 0.00 0.35 -0.58 -1.84 2.34 -1.26 -4.46 118.68 113.23 3iam s LEU 683 Ca 0.00 0.59 -0.10 0.00 0.06 0.00 0.00 54.13 54.68 3iam s LEU 683 Cb 0.00 0.85 0.15 0.00 -0.56 0.00 0.00 46.19 46.63 3iam s LEU 683 CO 0.00 -0.17 0.46 0.00 -1.06 0.00 0.00 176.35 175.58 3iam s ARG 684 N 1.24 2.76 0.91 1.48 1.70 -1.17 -5.07 118.95 120.79 3iam s ARG 684 Ca -0.09 -2.04 -0.15 0.00 -0.47 0.00 0.00 55.73 52.98 3iam s ARG 684 Cb -0.10 -4.03 0.22 0.00 -0.57 0.00 0.00 34.95 30.48 3iam s ARG 684 CO -0.09 -1.22 0.83 -0.35 -1.08 0.00 0.00 175.30 173.39 3iam n PRO 685 N 4.50 -2.51 -3.64 3.89 -0.04 -1.26 -4.67 135.00 131.27 3iam n PRO 685 Ca -0.01 -1.32 -0.05 0.00 -0.04 0.00 0.00 63.50 62.07 3iam n PRO 685 Cb 0.41 -1.21 -0.07 0.00 -0.04 0.00 0.00 33.50 32.59 3iam n PRO 685 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 3iam s LYS 686 N -4.87 0.23 0.29 0.54 2.20 -1.26 -5.06 119.74 111.81 3iam s LYS 686 Ca 0.53 0.26 -0.29 0.00 -0.36 0.00 0.00 55.97 56.11 3iam s LYS 686 Cb -0.05 0.11 -0.10 0.00 -1.51 0.00 0.00 37.83 36.29 3iam s LYS 686 CO 0.41 -0.03 1.17 -1.83 -0.36 0.00 0.00 175.35 174.70 3iam s GLU 687 N 0.05 4.55 -0.28 4.03 -1.05 -1.26 -4.93 118.70 119.81 3iam s GLU 687 Ca 0.06 1.93 -0.01 0.00 -0.15 0.00 0.00 54.97 56.80 3iam s GLU 687 Cb -0.05 -3.16 0.04 0.00 -0.44 0.00 0.00 34.13 30.53 3iam s GLU 687 CO -0.12 0.07 -0.04 1.03 0.95 0.00 0.00 175.26 177.16 3iam s ARG 688 N -1.43 2.54 -1.33 -4.83 1.81 -1.26 -5.04 118.95 109.41 3iam s ARG 688 Ca 0.46 -1.18 -0.15 0.00 -1.72 0.00 0.00 55.73 53.14 3iam s ARG 688 Cb -0.34 -3.08 -0.01 0.00 -0.45 0.00 0.00 34.95 31.08 3iam s ARG 688 CO 0.44 -0.54 2.20 0.36 -0.68 0.00 0.00 175.30 177.08 3iam n LYS 689 N 4.61 2.62 -1.51 3.54 2.85 -1.23 -4.94 118.16 124.10 3iam n LYS 689 Ca -0.14 -2.42 -0.39 0.00 -1.05 0.00 0.00 58.31 54.30 3iam n LYS 689 Cb 0.44 -3.19 -0.12 0.00 -0.65 0.00 0.00 35.03 31.52 3iam n LYS 689 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 3iam n GLY 690 N 4.16 -0.32 1.92 2.58 0.00 -1.26 -3.59 105.19 108.67 3iam n GLY 690 Ca 0.53 1.00 0.00 0.00 0.00 0.00 0.00 46.02 47.54 3iam n GLY 690 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iam n ALA 691 N 11.83 3.00 -2.53 4.61 0.00 -1.25 -4.99 120.51 131.18 3iam n ALA 691 Ca 0.59 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.72 3iam n ALA 691 Cb 0.17 0.03 -0.16 0.00 0.00 0.00 0.00 19.45 19.49 3iam n ALA 691 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 3iam s PHE 692 N -2.00 2.34 -0.22 0.00 0.40 -0.30 -3.72 117.98 114.48 3iam s PHE 692 Ca 0.00 -0.57 -0.09 0.00 -0.60 0.00 0.00 56.93 55.66 3iam s PHE 692 Cb 0.00 -1.52 -0.05 0.00 0.51 0.00 0.00 43.02 41.96 3iam s PHE 692 CO 0.00 -0.13 0.12 -0.47 0.70 0.00 0.00 175.22 175.45 3iam s TYR 693 N -0.38 3.32 -0.69 0.36 5.04 -0.62 -0.84 117.35 123.53 3iam s TYR 693 Ca 0.03 0.19 -0.21 0.00 -2.44 0.00 0.00 57.07 54.64 3iam s TYR 693 Cb -0.12 -2.19 0.09 0.00 0.35 0.00 0.00 41.96 40.09 3iam s TYR 693 CO 0.01 0.13 0.92 -0.51 -1.34 0.00 0.00 175.55 174.76 3iam s LEU 694 N 0.73 4.78 -0.23 6.97 1.43 -0.13 -0.27 118.68 131.96 3iam s LEU 694 Ca 0.07 -1.30 -0.29 0.00 -1.03 0.00 0.00 54.13 51.57 3iam s LEU 694 Cb -0.13 -2.38 -0.01 0.00 0.03 0.00 0.00 46.19 43.70 3iam s LEU 694 CO 0.02 -1.29 1.42 -0.60 0.23 0.00 0.00 176.35 176.12 3iam s ARG 695 N 3.44 3.95 0.18 1.70 3.52 0.68 0.18 118.95 132.60 3iam s ARG 695 Ca 0.21 1.51 -0.33 0.00 -0.13 0.00 0.00 55.73 56.99 3iam s ARG 695 Cb -0.17 -3.91 -0.14 0.00 -1.56 0.00 0.00 34.95 29.17 3iam s ARG 695 CO 0.06 -1.08 1.56 -0.35 -0.81 0.00 0.00 175.30 174.67 3iam n PRO 696 N 7.28 2.17 -4.24 5.12 -0.04 -1.26 -1.74 135.00 142.29 3iam n PRO 696 Ca 0.16 0.78 -0.15 0.00 -0.04 0.00 0.00 63.50 64.25 3iam n PRO 696 Cb 0.46 -2.54 -0.10 0.00 -0.04 0.00 0.00 33.50 31.28 3iam n PRO 696 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 3iam s THR 697 N 0.76 1.19 -0.02 0.52 -4.23 -1.25 -4.72 115.64 107.90 3iam s THR 697 Ca 0.77 -1.91 -0.21 0.00 -1.18 0.00 0.00 61.69 59.16 3iam s THR 697 Cb -0.67 -1.69 -0.12 0.00 1.34 0.00 0.00 72.50 71.36 3iam s THR 697 CO 0.39 -0.62 0.90 -0.03 -0.54 0.00 0.00 174.62 174.72 3iam h MET 698 N 3.10 -0.60 -6.79 3.99 4.05 -1.85 -3.44 114.93 113.39 3iam h MET 698 Ca -0.38 0.04 -0.53 0.00 -0.28 0.00 0.00 59.70 58.56 3iam h MET 698 Cb 1.19 0.14 0.06 0.00 -0.80 0.00 0.00 31.60 32.19 3iam h MET 698 CO 0.58 -0.33 0.75 -1.58 0.23 0.00 0.00 176.91 176.56 3iam s TRP 699 N -3.97 2.97 0.38 1.39 0.52 -1.26 -4.92 118.94 114.06 3iam s TRP 699 Ca -0.11 1.08 -0.02 0.00 0.02 0.00 0.00 56.10 57.07 3iam s TRP 699 Cb 0.01 -3.83 -0.04 0.00 -1.15 0.00 0.00 33.47 28.46 3iam s TRP 699 CO 0.37 -2.64 0.63 0.15 0.02 0.00 0.00 176.95 175.48 3iam s LYS 700 N -0.75 3.52 0.18 4.98 3.01 -1.26 -4.65 119.74 124.77 3iam s LYS 700 Ca 0.57 -0.12 0.09 0.00 -1.01 0.00 0.00 55.97 55.50 3iam s LYS 700 Cb -0.42 -2.57 0.02 0.00 -1.01 0.00 0.00 37.83 33.85 3iam s LYS 700 CO 0.47 0.04 1.41 0.00 0.51 0.00 0.00 175.35 177.78 3iam h ALA 701 N 0.69 0.60 0.00 5.17 0.00 -0.59 -2.92 119.26 122.20 3iam h ALA 701 Ca -0.49 -0.77 0.00 0.00 0.00 0.00 0.00 54.91 53.66 3iam h ALA 701 Cb 1.21 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.87 3iam h ALA 701 CO 0.62 1.05 0.00 -2.39 0.00 0.00 0.00 179.25 178.53 3iam n HIS 702 N -3.52 0.00 1.21 0.00 1.44 -1.26 -3.10 115.22 109.99 3iam n HIS 702 Ca -0.00 0.00 0.13 0.00 -2.01 0.00 0.00 57.72 55.83 3iam n HIS 702 Cb 0.81 0.00 0.30 0.00 0.12 0.00 0.00 29.99 31.22 3iam n HIS 702 CO 0.00 0.00 0.00 1.04 -2.81 0.00 0.00 176.34 174.57 3iam n GLN 703 N -0.77 1.08 -1.12 -1.40 6.02 -1.10 -4.75 117.38 115.33 3iam n GLN 703 Ca 0.12 -0.71 -0.34 0.00 -0.01 0.00 0.00 57.00 56.05 3iam n GLN 703 Cb 0.05 -1.49 -0.03 0.00 1.02 0.00 0.00 30.24 29.80 3iam n GLN 703 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3iam n ALA 704 N -0.34 5.11 -2.72 -1.58 0.00 -1.18 -4.69 120.51 115.11 3iam n ALA 704 Ca 0.12 -2.95 -0.17 0.00 0.00 0.00 0.00 53.44 50.44 3iam n ALA 704 Cb 0.38 -3.33 -0.14 0.00 0.00 0.00 0.00 19.45 16.37 3iam n ALA 704 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 3iam s VAL 705 N 3.50 0.67 0.00 0.00 -7.23 -1.24 -4.69 120.40 111.41 3iam s VAL 705 Ca 0.52 -0.54 0.00 0.00 -1.81 0.00 0.00 61.98 60.15 3iam s VAL 705 Cb 0.13 -0.59 0.00 0.00 0.56 0.00 0.00 36.38 36.48 3iam s VAL 705 CO -0.01 0.06 0.00 0.61 -0.31 0.00 0.00 175.10 175.45 3iam n GLY 706 N 2.54 1.10 0.13 2.32 0.00 -1.26 -2.40 105.19 107.61 3iam n GLY 706 Ca -0.15 0.32 -0.22 0.00 0.00 0.00 0.00 46.02 45.97 3iam n GLY 706 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3iam h LYS 707 N 0.00 0.20 -1.47 1.61 1.79 -1.92 -3.31 116.57 113.47 3iam h LYS 707 Ca 0.00 -0.34 0.00 0.00 -2.18 0.00 0.00 60.65 58.13 3iam h LYS 707 Cb 0.00 0.13 0.00 0.00 -1.58 0.00 0.00 32.23 30.78 3iam h LYS 707 CO 0.00 1.16 0.00 0.00 -1.08 0.00 0.00 179.45 179.53 3iam n ALA 708 N -3.10 2.31 -0.01 3.86 0.00 -1.01 -4.09 120.51 118.47 3iam n ALA 708 Ca -0.31 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 52.96 3iam n ALA 708 Cb 0.93 -1.06 -0.08 0.00 0.00 0.00 0.00 19.45 19.23 3iam n ALA 708 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 3iam h GLN 709 N 0.96 0.72 0.00 0.00 4.15 -1.65 -3.19 115.11 116.10 3iam h GLN 709 Ca 0.00 -0.62 -0.07 0.00 0.77 0.00 0.00 58.65 58.73 3iam h GLN 709 Cb 0.64 0.14 -0.01 0.00 0.21 0.00 0.00 27.48 28.46 3iam h GLN 709 CO 0.00 1.23 -1.72 0.39 -1.93 0.00 0.00 178.83 176.79 3iam n GLU 710 N -3.99 0.64 0.00 1.69 -0.58 -1.26 -3.91 120.64 113.23 3iam n GLU 710 Ca -0.08 -0.04 0.14 0.00 -0.42 0.00 0.00 57.16 56.76 3iam n GLU 710 Cb 0.74 -1.63 0.62 0.00 -0.57 0.00 0.00 31.44 30.60 3iam n GLU 710 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3iam n ALA 711 N -2.32 2.37 -1.29 0.62 0.00 -1.25 -2.61 120.51 116.03 3iam n ALA 711 Ca -0.07 -0.11 0.08 0.00 0.00 0.00 0.00 53.44 53.34 3iam n ALA 711 Cb 0.68 -1.46 0.14 0.00 0.00 0.00 0.00 19.45 18.80 3iam n ALA 711 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3iam n ALA 712 N -1.48 2.49 -1.76 0.00 0.00 -1.20 -4.83 120.51 113.72 3iam n ALA 712 Ca 0.08 -2.59 -0.39 0.00 0.00 0.00 0.00 53.44 50.54 3iam n ALA 712 Cb 0.33 -0.40 -0.05 0.00 0.00 0.00 0.00 19.45 19.33 3iam n ALA 712 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 3iam s ARG 713 N -2.59 4.62 0.70 0.00 3.52 -1.07 -4.66 118.95 119.47 3iam s ARG 713 Ca 0.30 1.57 -0.13 0.00 -0.13 0.00 0.00 55.73 57.34 3iam s ARG 713 Cb 0.27 -3.04 0.02 0.00 -1.56 0.00 0.00 34.95 30.63 3iam s ARG 713 CO 0.00 0.27 1.08 0.00 -0.81 0.00 0.00 175.30 175.84 3iam s ALA 714 N -1.33 2.48 -0.10 6.12 0.00 -1.26 -4.99 121.76 122.68 3iam s ALA 714 Ca 0.46 0.32 -0.11 0.00 0.00 0.00 0.00 51.96 52.64 3iam s ALA 714 Cb -0.26 -3.26 0.03 0.00 0.00 0.00 0.00 23.12 19.63 3iam s ALA 714 CO 0.33 -1.36 0.30 -1.83 0.00 0.00 0.00 175.76 173.20 3iam s GLU 715 N -4.58 0.41 -0.23 0.00 -1.05 -1.26 -2.86 118.70 109.12 3iam s GLU 715 Ca 0.62 0.32 -0.08 0.00 -0.15 0.00 0.00 54.97 55.68 3iam s GLU 715 Cb -0.17 0.19 -0.04 0.00 -0.44 0.00 0.00 34.13 33.67 3iam s GLU 715 CO 0.49 -0.06 0.09 -1.17 0.95 0.00 0.00 175.26 175.55 3iam s LEU 716 N -0.08 3.72 -0.00 1.83 0.20 0.29 -1.41 118.68 123.22 3iam s LEU 716 Ca -0.02 -0.04 0.00 0.00 0.69 0.00 0.00 54.13 54.76 3iam s LEU 716 Cb -0.03 -1.98 -0.04 0.00 -0.43 0.00 0.00 46.19 43.72 3iam s LEU 716 CO 0.01 0.05 0.05 0.26 -0.29 0.00 0.00 176.35 176.43 3iam s TRP 717 N 1.10 3.19 0.04 5.38 0.51 0.73 0.56 118.94 130.45 3iam s TRP 717 Ca 0.05 0.15 -0.27 0.00 -2.12 0.00 0.00 56.10 53.91 3iam s TRP 717 Cb -0.14 -1.71 0.07 0.00 -0.81 0.00 0.00 33.47 30.88 3iam s TRP 717 CO 0.04 0.51 0.63 0.00 -0.51 0.00 0.00 176.95 177.62 3iam s ALA 718 N -1.15 -1.65 -0.09 0.98 0.00 -0.51 -1.74 121.76 117.58 3iam s ALA 718 Ca 0.22 0.91 -0.30 0.00 0.00 0.00 0.00 51.96 52.79 3iam s ALA 718 Cb -0.12 0.40 -0.01 0.00 0.00 0.00 0.00 23.12 23.38 3iam s ALA 718 CO 0.13 -0.54 1.01 -1.58 0.00 0.00 0.00 175.76 174.77 3iam s HIS 719 N -2.35 3.52 0.38 0.00 2.46 -1.25 -1.76 115.29 116.28 3iam s HIS 719 Ca -0.06 1.59 0.28 0.00 0.47 0.00 0.00 55.06 57.35 3iam s HIS 719 Cb -0.00 -3.19 1.26 0.00 -0.13 0.00 0.00 32.58 30.52 3iam s HIS 719 CO -0.00 -0.25 1.30 -2.30 -2.47 0.00 0.00 174.74 171.02 3iam n PRO 720 N 4.91 -0.03 0.00 2.88 -0.02 -1.26 0.35 135.00 141.83 3iam n PRO 720 Ca 0.09 1.04 0.00 0.00 -2.02 0.00 0.00 63.50 62.60 3iam n PRO 720 Cb 0.49 -2.07 0.00 0.00 -0.02 0.00 0.00 33.50 31.90 3iam n PRO 720 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 3iam n GLU 721 N -4.31 0.00 -0.28 -0.52 1.02 -1.26 -2.15 120.64 113.14 3iam n GLU 721 Ca 0.34 0.18 0.26 0.00 -0.02 0.00 0.00 57.16 57.91 3iam n GLU 721 Cb 1.34 -0.97 0.59 0.00 -0.02 0.00 0.00 31.44 32.38 3iam n GLU 721 CO 0.00 0.00 0.00 1.79 1.18 0.00 0.00 177.13 180.10 3iam h THR 722 N 0.00 0.53 0.36 2.62 1.35 -1.55 0.73 112.91 116.96 3iam h THR 722 Ca 0.00 -0.09 -0.00 0.00 -0.55 0.00 0.00 66.41 65.77 3iam h THR 722 Cb 0.00 0.26 -0.03 0.00 -1.73 0.00 0.00 68.15 66.65 3iam h THR 722 CO 0.00 0.05 -0.52 0.00 -0.25 0.00 0.00 175.52 174.80 3iam h ALA 723 N 1.56 -1.09 0.00 6.62 0.00 -0.19 -1.96 119.26 124.20 3iam h ALA 723 Ca 0.54 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.28 3iam h ALA 723 Cb 1.63 0.80 0.00 0.00 0.00 0.00 0.00 17.79 20.22 3iam h ALA 723 CO -0.17 -1.16 0.00 -2.13 0.00 0.00 0.00 179.25 175.79 3iam n ARG 724 N -5.54 0.13 0.00 0.00 0.63 -0.15 -2.81 116.66 108.92 3iam n ARG 724 Ca -0.11 0.12 0.14 0.00 -0.92 0.00 0.00 57.85 57.08 3iam n ARG 724 Cb 0.45 -1.65 0.68 0.00 0.45 0.00 0.00 32.46 32.39 3iam n ARG 724 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3iam n ALA 725 N -1.64 2.37 -1.96 5.13 0.00 0.24 -3.13 120.51 121.53 3iam n ALA 725 Ca 0.06 -0.12 0.05 0.00 0.00 0.00 0.00 53.44 53.43 3iam n ALA 725 Cb 0.37 -1.46 0.11 0.00 0.00 0.00 0.00 19.45 18.47 3iam n ALA 725 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 3iam n GLU 726 N -1.34 0.79 -3.15 0.00 2.13 -0.83 -4.99 120.64 113.24 3iam n GLU 726 Ca 0.12 -2.53 -0.06 0.00 0.66 0.00 0.00 57.16 55.34 3iam n GLU 726 Cb 0.25 -0.86 0.02 0.00 0.27 0.00 0.00 31.44 31.13 3iam n GLU 726 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3iam n ALA 727 N -0.39 -2.51 -3.39 4.31 0.00 -1.18 -5.03 120.51 112.32 3iam n ALA 727 Ca 0.12 0.03 -0.26 0.00 0.00 0.00 0.00 53.44 53.33 3iam n ALA 727 Cb 0.88 -2.90 -0.10 0.00 0.00 0.00 0.00 19.45 17.32 3iam n ALA 727 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3iam s LEU 728 N -4.52 1.12 1.12 0.00 1.43 -1.12 -5.03 118.68 111.68 3iam s LEU 728 Ca 0.16 -2.72 -0.19 0.00 -1.03 0.00 0.00 54.13 50.35 3iam s LEU 728 Cb -0.02 -0.30 0.12 0.00 0.03 0.00 0.00 46.19 46.02 3iam s LEU 728 CO 0.75 -0.21 0.05 -2.65 0.23 0.00 0.00 176.35 174.52 3iam n PRO 729 N 3.22 -1.80 0.00 1.29 -0.02 -1.26 -4.40 135.00 132.03 3iam n PRO 729 Ca 0.24 -0.51 0.00 0.00 -2.02 0.00 0.00 63.50 61.21 3iam n PRO 729 Cb 0.45 -1.68 0.00 0.00 -0.02 0.00 0.00 33.50 32.25 3iam n PRO 729 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 3iam n GLU 730 N -2.15 0.00 -3.40 -0.52 4.07 -1.26 -4.30 120.64 113.08 3iam n GLU 730 Ca 0.01 0.14 -0.41 0.00 -0.06 0.00 0.00 57.16 56.85 3iam n GLU 730 Cb 0.60 -1.10 -0.03 0.00 -0.06 0.00 0.00 31.44 30.85 3iam n GLU 730 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3iam n GLY 731 N -0.63 4.36 2.95 8.31 0.00 -1.26 -4.13 105.19 114.79 3iam n GLY 731 Ca 0.00 -2.61 -0.18 0.00 0.00 0.00 0.00 46.02 43.22 3iam n GLY 731 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iam s ALA 732 N -1.63 0.63 0.50 4.61 0.00 -1.26 -4.97 121.76 119.64 3iam s ALA 732 Ca 0.30 -0.21 -0.21 0.00 0.00 0.00 0.00 51.96 51.85 3iam s ALA 732 Cb -0.05 -0.26 -0.07 0.00 0.00 0.00 0.00 23.12 22.73 3iam s ALA 732 CO -0.06 0.09 1.09 -0.65 0.00 0.00 0.00 175.76 176.23 3iam s GLN 733 N 0.26 3.65 -0.24 0.00 -1.52 -1.26 -2.78 119.66 117.77 3iam s GLN 733 Ca -0.03 1.53 -0.10 0.00 -1.95 0.00 0.00 55.36 54.81 3iam s GLN 733 Cb -0.08 -2.14 0.10 0.00 -0.22 0.00 0.00 33.01 30.67 3iam s GLN 733 CO -0.00 -0.59 0.53 0.08 -0.25 0.00 0.00 175.29 175.06 3iam s VAL 734 N -1.81 -0.56 -0.15 1.09 1.01 -0.63 -4.98 120.40 114.39 3iam s VAL 734 Ca 0.68 0.08 -0.29 0.00 0.00 0.00 0.00 61.98 62.45 3iam s VAL 734 Cb -0.22 -0.81 -0.03 0.00 0.00 0.00 0.00 36.38 35.32 3iam s VAL 734 CO 0.25 0.03 1.45 0.00 0.00 0.00 0.00 175.10 176.84 3iam s ALA 735 N 2.36 3.57 -0.15 5.51 0.00 -1.26 -2.79 121.76 128.99 3iam s ALA 735 Ca -0.06 0.60 0.02 0.00 0.00 0.00 0.00 51.96 52.52 3iam s ALA 735 Cb -0.10 -3.71 0.02 0.00 0.00 0.00 0.00 23.12 19.32 3iam s ALA 735 CO -0.16 -1.41 -0.20 0.08 0.00 0.00 0.00 175.76 174.07 3iam s VAL 736 N 4.01 1.94 -0.08 0.00 1.01 -0.74 -2.43 120.40 124.11 3iam s VAL 736 Ca 0.64 -0.89 -0.06 0.00 0.00 0.00 0.00 61.98 61.68 3iam s VAL 736 Cb -0.26 -1.74 -0.04 0.00 0.00 0.00 0.00 36.38 34.34 3iam s VAL 736 CO 0.22 0.52 0.16 -0.70 0.00 0.00 0.00 175.10 175.30 3iam s GLU 737 N 1.09 3.44 0.03 2.72 2.12 -0.21 -1.94 118.70 125.95 3iam s GLU 737 Ca -0.01 -0.19 -0.16 0.00 0.36 0.00 0.00 54.97 54.97 3iam s GLU 737 Cb -0.14 -3.16 0.03 0.00 0.26 0.00 0.00 34.13 31.12 3iam s GLU 737 CO -0.07 0.74 0.35 0.99 -0.54 0.00 0.00 175.26 176.74 3iam s THR 738 N -1.13 0.07 0.46 -1.70 2.01 -0.99 -2.56 115.64 111.80 3iam s THR 738 Ca 0.19 -0.55 0.22 0.00 0.31 0.00 0.00 61.69 61.86 3iam s THR 738 Cb -0.12 -0.90 0.22 0.00 0.01 0.00 0.00 72.50 71.71 3iam s THR 738 CO 0.09 -0.30 1.63 -0.65 -0.69 0.00 0.00 174.62 174.70 3iam h PRO 739 N 3.23 0.00 -0.02 4.92 0.11 -1.97 0.78 132.00 139.05 3iam h PRO 739 Ca -0.31 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.80 3iam h PRO 739 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 3iam h PRO 739 CO 0.44 0.00 -0.18 1.19 -0.21 0.00 0.00 178.00 179.24 3iam n PHE 740 N -2.58 0.00 0.00 0.65 3.72 -1.26 -4.01 117.46 113.98 3iam n PHE 740 Ca -0.01 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.39 3iam n PHE 740 Cb 0.42 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.96 3iam n PHE 740 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3iam n GLY 741 N 1.27 1.79 3.31 1.37 0.00 0.27 -4.79 105.19 108.40 3iam n GLY 741 Ca 0.11 -2.05 -0.46 0.00 0.00 0.00 0.00 46.02 43.62 3iam n GLY 741 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3iam s ARG 742 N -1.43 3.13 0.25 1.61 3.52 -1.26 -2.34 118.95 122.43 3iam s ARG 742 Ca 0.00 -1.95 0.00 0.00 -0.13 0.00 0.00 55.73 53.66 3iam s ARG 742 Cb 0.00 -4.31 -0.04 0.00 -1.56 0.00 0.00 34.95 29.04 3iam s ARG 742 CO 0.00 -1.31 0.44 0.08 -0.81 0.00 0.00 175.30 173.70 3iam s VAL 743 N 1.14 5.17 -0.07 7.11 1.01 -0.82 -4.93 120.40 129.02 3iam s VAL 743 Ca 0.08 -0.47 0.03 0.00 0.00 0.00 0.00 61.98 61.62 3iam s VAL 743 Cb -0.24 -3.79 -0.02 0.00 0.00 0.00 0.00 36.38 32.33 3iam s VAL 743 CO -0.01 -0.32 -0.16 -1.61 0.00 0.00 0.00 175.10 173.00 3iam s GLU 744 N -3.73 2.72 0.05 2.72 2.02 -1.26 -1.78 118.70 119.45 3iam s GLU 744 Ca 0.38 -0.74 -0.10 0.00 0.02 0.00 0.00 54.97 54.53 3iam s GLU 744 Cb -0.10 -2.39 0.01 0.00 0.10 0.00 0.00 34.13 31.74 3iam s GLU 744 CO 0.31 0.47 0.22 0.00 0.02 0.00 0.00 175.26 176.28 3iam s ALA 745 N -0.35 -0.40 0.09 5.21 0.00 -1.12 -4.29 121.76 120.90 3iam s ALA 745 Ca 0.03 -0.31 -0.18 0.00 0.00 0.00 0.00 51.96 51.50 3iam s ALA 745 Cb -0.12 0.35 -0.07 0.00 0.00 0.00 0.00 23.12 23.28 3iam s ALA 745 CO 0.02 -0.41 0.56 -0.98 0.00 0.00 0.00 175.76 174.95 3iam s ARG 746 N -2.92 4.13 0.28 0.00 1.70 -1.14 -1.60 118.95 119.41 3iam s ARG 746 Ca -0.02 0.67 -0.05 0.00 -0.47 0.00 0.00 55.73 55.85 3iam s ARG 746 Cb 0.01 -3.15 -0.05 0.00 -0.57 0.00 0.00 34.95 31.18 3iam s ARG 746 CO -0.06 0.60 0.55 0.54 -1.08 0.00 0.00 175.30 175.85 3iam s VAL 747 N -1.20 5.02 -0.03 4.99 0.11 -1.12 -0.55 120.40 127.61 3iam s VAL 747 Ca 0.31 0.10 -0.01 0.00 -2.93 0.00 0.00 61.98 59.45 3iam s VAL 747 Cb -0.18 -3.72 0.03 0.00 -1.53 0.00 0.00 36.38 30.98 3iam s VAL 747 CO 0.19 -0.29 0.06 -0.69 -3.33 0.00 0.00 175.10 171.04 3iam s VAL 748 N -2.05 -0.06 -0.11 2.04 1.01 0.19 -4.41 120.40 117.01 3iam s VAL 748 Ca 0.44 0.20 -0.29 0.00 0.00 0.00 0.00 61.98 62.34 3iam s VAL 748 Cb -0.11 -0.13 -0.01 0.00 0.00 0.00 0.00 36.38 36.13 3iam s VAL 748 CO 0.29 0.08 0.97 -1.00 0.00 0.00 0.00 175.10 175.44 3iam s HIS 749 N 1.07 3.51 -0.09 5.22 3.76 -1.26 -1.43 115.29 126.07 3iam s HIS 749 Ca -0.09 1.53 -0.03 0.00 -0.15 0.00 0.00 55.06 56.32 3iam s HIS 749 Cb -0.12 -3.14 0.05 0.00 1.11 0.00 0.00 32.58 30.47 3iam s HIS 749 CO -0.04 -0.21 0.14 1.03 -0.85 0.00 0.00 174.74 174.81 3iam s ARG 750 N 1.95 0.02 0.54 1.40 0.52 -0.72 -4.94 118.95 117.72 3iam s ARG 750 Ca 0.46 0.43 0.33 0.00 -0.52 0.00 0.00 55.73 56.43 3iam s ARG 750 Cb -0.18 -0.55 1.35 0.00 0.52 0.00 0.00 34.95 36.08 3iam s ARG 750 CO 0.17 -0.38 1.98 0.93 0.02 0.00 0.00 175.30 178.03 3iam h GLU 751 N 8.38 0.00 -0.14 3.54 5.08 -1.96 -2.67 114.58 126.82 3iam h GLU 751 Ca -0.13 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.23 3iam h GLU 751 Cb 1.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.37 3iam h GLU 751 CO 0.17 0.02 0.00 -0.40 -1.00 0.00 0.00 179.01 177.80 3iam n ASP 752 N -3.13 0.14 -4.34 1.42 5.75 -1.26 -4.70 116.55 110.44 3iam n ASP 752 Ca 0.00 -1.61 -0.34 0.00 -0.01 0.00 0.00 54.79 52.83 3iam n ASP 752 Cb 0.31 -0.07 -0.14 0.00 -1.03 0.00 0.00 41.12 40.19 3iam n ASP 752 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 3iam s VAL 753 N -1.82 3.35 0.22 2.12 1.01 -1.00 -4.43 120.40 119.84 3iam s VAL 753 Ca 0.00 -0.52 -0.31 0.00 0.00 0.00 0.00 61.98 61.15 3iam s VAL 753 Cb 0.00 -2.49 -0.15 0.00 0.00 0.00 0.00 36.38 33.74 3iam s VAL 753 CO 0.00 0.45 1.09 -0.81 0.00 0.00 0.00 175.10 175.83 3iam n PRO 754 N 4.37 1.20 -2.00 2.72 -0.04 -1.26 -4.23 135.00 135.76 3iam n PRO 754 Ca -0.18 0.42 -0.39 0.00 -0.04 0.00 0.00 63.50 63.31 3iam n PRO 754 Cb 0.51 -1.86 -0.00 0.00 -0.04 0.00 0.00 33.50 32.12 3iam n PRO 754 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 3iam s LYS 755 N -0.81 3.91 0.00 0.54 1.02 -1.26 -3.10 119.74 120.04 3iam s LYS 755 Ca 0.68 2.21 0.00 0.00 0.02 0.00 0.00 55.97 58.87 3iam s LYS 755 Cb -0.80 -2.73 0.00 0.00 -0.52 0.00 0.00 37.83 33.78 3iam s LYS 755 CO 0.55 -0.56 0.00 0.41 -0.92 0.00 0.00 175.35 174.83 3iam n GLY 756 N 0.64 2.78 3.86 -3.33 0.00 -1.26 -5.01 105.19 102.87 3iam n GLY 756 Ca 0.04 -0.02 -0.34 0.00 0.00 0.00 0.00 46.02 45.71 3iam n GLY 756 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3iam s HIS 757 N -1.75 3.52 -0.17 1.61 3.76 -1.18 -5.03 115.29 116.06 3iam s HIS 757 Ca 0.00 0.98 0.01 0.00 -0.15 0.00 0.00 55.06 55.90 3iam s HIS 757 Cb 0.00 -2.32 0.03 0.00 1.11 0.00 0.00 32.58 31.39 3iam s HIS 757 CO 0.00 0.36 -0.16 -0.51 -0.85 0.00 0.00 174.74 173.58 3iam s LEU 758 N -2.33 1.98 -0.34 0.89 1.02 -1.24 -4.61 118.68 114.05 3iam s LEU 758 Ca 0.42 -0.63 -0.24 0.00 0.02 0.00 0.00 54.13 53.70 3iam s LEU 758 Cb -0.13 -1.31 0.01 0.00 0.02 0.00 0.00 46.19 44.78 3iam s LEU 758 CO 0.20 -0.05 0.84 -0.31 0.02 0.00 0.00 176.35 177.05 3iam s TYR 759 N 1.39 3.14 -0.17 0.29 4.12 -0.71 -1.59 117.35 123.82 3iam s TYR 759 Ca 0.04 0.76 -0.11 0.00 0.02 0.00 0.00 57.07 57.78 3iam s TYR 759 Cb -0.14 -3.41 -0.05 0.00 -1.52 0.00 0.00 41.96 36.84 3iam s TYR 759 CO -0.11 -0.69 0.21 -1.17 0.02 0.00 0.00 175.55 173.81 3iam s LEU 760 N 3.18 4.25 -0.54 -1.29 2.96 0.62 -0.20 118.68 127.67 3iam s LEU 760 Ca 0.35 0.40 -0.26 0.00 -0.22 0.00 0.00 54.13 54.39 3iam s LEU 760 Cb -0.13 -2.22 -0.07 0.00 0.50 0.00 0.00 46.19 44.27 3iam s LEU 760 CO 0.15 0.18 2.31 -0.55 -1.32 0.00 0.00 176.35 177.13 3iam s SER 761 N 0.19 4.54 -0.60 3.68 0.15 -0.50 -0.23 113.70 120.93 3iam s SER 761 Ca 0.13 0.85 -0.24 0.00 0.70 0.00 0.00 55.95 57.39 3iam s SER 761 Cb -0.12 -2.51 0.05 0.00 -1.71 0.00 0.00 66.02 61.73 3iam s SER 761 CO 0.02 -2.88 0.98 0.00 1.20 0.00 0.00 173.24 172.56 3iam s ALA 762 N 11.87 3.11 -0.32 5.45 0.00 -0.71 -4.64 121.76 136.52 3iam s ALA 762 Ca 0.92 -1.41 0.03 0.00 0.00 0.00 0.00 51.96 51.50 3iam s ALA 762 Cb -0.16 -3.82 0.46 0.00 0.00 0.00 0.00 23.12 19.60 3iam s ALA 762 CO 0.23 -2.58 1.60 1.28 0.00 0.00 0.00 175.76 176.30 3iam n LEU 763 N 7.72 5.45 0.00 0.00 4.77 -1.26 -3.79 117.00 129.89 3iam n LEU 763 Ca 0.00 -2.87 0.00 0.00 -0.03 0.00 0.00 56.01 53.11 3iam n LEU 763 Cb 0.47 -0.72 0.00 0.00 -2.33 0.00 0.00 43.42 40.84 3iam n LEU 763 CO 0.65 0.85 0.00 0.61 -1.33 0.00 0.00 177.39 178.16 3iam n GLY 764 N -0.55 4.11 0.00 -0.72 0.00 -1.26 0.17 105.19 106.94 3iam n GLY 764 Ca 0.39 -1.72 0.06 0.00 0.00 0.00 0.00 46.02 44.75 3iam n GLY 764 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3iam n PRO 765 N 0.00 0.91 -0.37 1.61 -0.04 -1.26 -3.22 135.00 132.64 3iam n PRO 765 Ca 0.00 0.00 -0.02 0.00 -0.04 0.00 0.00 63.50 63.44 3iam n PRO 765 Cb 0.00 -1.20 0.12 0.00 -0.04 0.00 0.00 33.50 32.38 3iam n PRO 765 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3iam n ALA 766 N -0.70 3.23 -2.27 0.55 0.00 -1.26 -4.79 120.51 115.26 3iam n ALA 766 Ca 0.09 -0.82 -0.36 0.00 0.00 0.00 0.00 53.44 52.34 3iam n ALA 766 Cb 0.04 -1.09 -0.06 0.00 0.00 0.00 0.00 19.45 18.34 3iam n ALA 766 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3iam s ALA 767 N -1.47 3.55 0.00 0.00 0.00 -1.20 -4.12 121.76 118.52 3iam s ALA 767 Ca 0.20 -0.01 0.00 0.00 0.00 0.00 0.00 51.96 52.15 3iam s ALA 767 Cb 0.16 -2.62 0.00 0.00 0.00 0.00 0.00 23.12 20.66 3iam s ALA 767 CO 0.05 0.41 0.00 0.41 0.00 0.00 0.00 175.76 176.63 3iam n GLY 768 N 1.06 0.66 3.72 0.00 0.00 0.13 -4.88 105.19 105.89 3iam n GLY 768 Ca -0.06 -0.71 -0.26 0.00 0.00 0.00 0.00 46.02 44.99 3iam n GLY 768 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3iam s LEU 769 N 0.00 3.51 -0.20 0.99 1.43 -1.25 -4.11 118.68 119.06 3iam s LEU 769 Ca 0.00 -0.32 -0.03 0.00 -1.03 0.00 0.00 54.13 52.75 3iam s LEU 769 Cb 0.00 -2.13 -0.01 0.00 0.03 0.00 0.00 46.19 44.08 3iam s LEU 769 CO 0.00 0.06 -0.05 -0.13 0.23 0.00 0.00 176.35 176.46 3iam s ARG 770 N -3.16 3.43 0.00 1.70 0.52 -1.26 -0.96 118.95 119.23 3iam s ARG 770 Ca 0.29 -0.61 0.00 0.00 -0.52 0.00 0.00 55.73 54.90 3iam s ARG 770 Cb -0.09 -2.94 -0.01 0.00 0.52 0.00 0.00 34.95 32.43 3iam s ARG 770 CO 0.21 -0.06 -0.02 0.08 0.02 0.00 0.00 175.30 175.53 3iam s VAL 771 N 1.13 0.13 0.18 3.52 1.01 -0.02 -3.56 120.40 122.78 3iam s VAL 771 Ca 0.02 -0.26 -0.30 0.00 0.00 0.00 0.00 61.98 61.44 3iam s VAL 771 Cb -0.15 -0.15 -0.08 0.00 0.00 0.00 0.00 36.38 36.00 3iam s VAL 771 CO -0.01 -0.08 1.28 -1.61 0.00 0.00 0.00 175.10 174.68 3iam s GLU 772 N -0.36 4.41 0.13 2.72 0.41 -1.24 -1.15 118.70 123.62 3iam s GLU 772 Ca -0.03 1.99 -0.26 0.00 -0.41 0.00 0.00 54.97 56.26 3iam s GLU 772 Cb -0.03 -3.22 0.07 0.00 -1.78 0.00 0.00 34.13 29.17 3iam s GLU 772 CO -0.00 -0.23 0.95 0.20 -0.49 0.00 0.00 175.26 175.69 3iam s GLY 773 N 0.41 -0.27 0.29 -1.39 0.00 -1.26 -4.19 107.32 100.90 3iam s GLY 773 Ca 0.56 0.27 0.02 0.00 0.00 0.00 0.00 44.72 45.58 3iam s GLY 773 CO 0.36 0.06 0.28 1.09 0.00 0.00 0.00 173.10 174.89 3iam s ARG 774 N -3.26 1.63 -0.26 2.90 3.03 -1.06 -4.89 118.95 117.03 3iam s ARG 774 Ca 0.11 -1.83 0.02 0.00 2.03 0.00 0.00 55.73 56.06 3iam s ARG 774 Cb -0.01 0.34 0.07 0.00 -1.03 0.00 0.00 34.95 34.31 3iam s ARG 774 CO 0.00 -0.61 -0.06 0.08 -1.13 0.00 0.00 175.30 173.59 3iam s VAL 775 N -3.59 1.88 0.58 4.99 1.01 -1.26 -1.04 120.40 122.97 3iam s VAL 775 Ca 0.38 -1.56 -0.15 0.00 0.00 0.00 0.00 61.98 60.65 3iam s VAL 775 Cb 0.03 -2.12 -0.05 0.00 0.00 0.00 0.00 36.38 34.24 3iam s VAL 775 CO 0.21 -0.16 1.03 -1.48 0.00 0.00 0.00 175.10 174.70 3iam s LEU 776 N 1.21 3.46 0.00 3.92 2.34 -1.02 -5.01 118.68 123.58 3iam s LEU 776 Ca -0.04 1.63 0.00 0.00 0.06 0.00 0.00 54.13 55.78 3iam s LEU 776 Cb -0.19 -4.51 0.00 0.00 -0.56 0.00 0.00 46.19 40.93 3iam s LEU 776 CO -0.07 -0.93 0.32 0.52 -1.06 0.00 0.00 176.35 175.13