#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1iam s THR 2 N 0.00 4.33 0.02 5.09 2.01 -1.26 -1.83 115.64 123.99 1iam s THR 2 Ca 0.00 1.61 -0.11 0.00 0.31 0.00 0.00 61.69 63.51 1iam s THR 2 Cb 0.00 -3.78 0.01 0.00 0.01 0.00 0.00 72.50 68.74 1iam s THR 2 CO 0.00 -0.11 0.22 -0.44 -0.69 0.00 0.00 174.62 173.60 1iam s SER 3 N -1.93 -0.03 0.01 3.53 0.01 -0.34 -4.72 113.70 110.24 1iam s SER 3 Ca 0.56 -0.24 0.02 0.00 1.31 0.00 0.00 55.95 57.60 1iam s SER 3 Cb -0.13 0.29 -0.01 0.00 0.21 0.00 0.00 66.02 66.37 1iam s SER 3 CO 0.18 -0.51 -0.06 0.54 0.41 0.00 0.00 173.24 173.79 1iam s VAL 4 N -2.14 0.47 -0.07 3.43 0.11 -1.26 -0.96 120.40 119.99 1iam s VAL 4 Ca -0.08 -0.51 -0.03 0.00 -2.93 0.00 0.00 61.98 58.43 1iam s VAL 4 Cb -0.03 -0.45 0.04 0.00 -1.53 0.00 0.00 36.38 34.41 1iam s VAL 4 CO -0.01 -0.04 0.14 -0.55 -3.33 0.00 0.00 175.10 171.30 1iam s SER 5 N -0.60 0.31 0.47 3.54 0.15 -0.86 -3.93 113.70 112.77 1iam s SER 5 Ca -0.02 0.29 -0.20 0.00 0.70 0.00 0.00 55.95 56.71 1iam s SER 5 Cb -0.05 0.19 -0.09 0.00 -1.71 0.00 0.00 66.02 64.36 1iam s SER 5 CO 0.00 -0.19 1.01 -2.84 1.20 0.00 0.00 173.24 172.42 1iam s PRO 6 N 1.67 3.95 0.08 5.44 0.02 -1.26 -1.52 135.00 143.38 1iam s PRO 6 Ca -0.04 1.27 0.26 0.00 0.02 0.00 0.00 61.00 62.52 1iam s PRO 6 Cb -0.12 -2.12 0.81 0.00 0.02 0.00 0.00 34.50 33.08 1iam s PRO 6 CO -0.06 -0.29 1.67 -1.13 -0.33 0.00 0.00 177.00 176.86 1iam n SER 7 N -0.87 0.46 -3.73 2.53 3.41 -1.25 -4.76 113.62 109.41 1iam n SER 7 Ca 0.08 0.31 -0.12 0.00 -0.26 0.00 0.00 58.87 58.88 1iam n SER 7 Cb 0.53 -0.31 -0.11 0.00 -0.26 0.00 0.00 64.21 64.06 1iam n SER 7 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 1iam s LYS 8 N -3.06 0.41 -0.05 4.33 2.47 -1.26 -1.02 119.74 121.57 1iam s LYS 8 Ca 0.11 0.61 -0.09 0.00 -1.56 0.00 0.00 55.97 55.04 1iam s LYS 8 Cb 0.16 0.11 0.02 0.00 -1.46 0.00 0.00 37.83 36.66 1iam s LYS 8 CO 0.62 -0.09 0.22 0.08 0.16 0.00 0.00 175.35 176.34 1iam s VAL 9 N 0.66 0.04 -0.12 4.02 1.01 -0.16 -4.93 120.40 120.91 1iam s VAL 9 Ca -0.04 -0.31 0.02 0.00 0.00 0.00 0.00 61.98 61.66 1iam s VAL 9 Cb -0.05 -0.43 0.01 0.00 0.00 0.00 0.00 36.38 35.91 1iam s VAL 9 CO -0.04 -0.17 -0.20 -0.51 0.00 0.00 0.00 175.10 174.18 1iam s ILE 10 N -0.64 1.84 0.05 2.22 2.07 -1.26 -0.71 121.20 124.77 1iam s ILE 10 Ca -0.07 -0.86 -0.03 0.00 -1.41 0.00 0.00 60.65 58.28 1iam s ILE 10 Cb -0.04 -1.63 -0.03 0.00 0.13 0.00 0.00 42.46 40.89 1iam s ILE 10 CO 0.02 0.51 0.03 -1.48 -1.91 0.00 0.00 174.94 172.11 1iam s LEU 11 N 0.79 2.14 0.61 8.50 2.34 0.32 -4.97 118.68 128.43 1iam s LEU 11 Ca -0.09 -0.80 -0.18 0.00 0.06 0.00 0.00 54.13 53.12 1iam s LEU 11 Cb -0.16 0.42 -0.02 0.00 -0.56 0.00 0.00 46.19 45.87 1iam s LEU 11 CO 0.00 -0.58 1.19 -2.16 -1.06 0.00 0.00 176.35 173.75 1iam s PRO 12 N -3.41 2.87 0.27 1.48 0.04 -1.26 -0.84 135.00 134.14 1iam s PRO 12 Ca 0.02 1.76 -0.31 0.00 0.04 0.00 0.00 61.00 62.52 1iam s PRO 12 Cb 0.04 -1.92 -0.13 0.00 0.04 0.00 0.00 34.50 32.53 1iam s PRO 12 CO -0.08 -1.27 1.45 -2.13 0.04 0.00 0.00 177.00 175.01 1iam n ARG 13 N -1.80 2.24 -1.00 4.56 0.63 0.04 -1.71 116.66 119.62 1iam n ARG 13 Ca 0.13 0.79 0.00 0.00 -0.92 0.00 0.00 57.85 57.86 1iam n ARG 13 Cb 0.50 -2.48 0.00 0.00 0.45 0.00 0.00 32.46 30.93 1iam n ARG 13 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1iam n GLY 14 N 2.00 0.69 1.05 5.14 0.00 0.96 -4.97 105.19 110.07 1iam n GLY 14 Ca 0.10 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.04 1iam n GLY 14 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1iam n GLY 15 N -2.60 -0.60 3.24 -0.02 0.00 -0.69 -3.77 105.19 100.75 1iam n GLY 15 Ca 0.00 -1.78 -0.17 0.00 0.00 0.00 0.00 46.02 44.07 1iam n GLY 15 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1iam s SER 16 N -2.25 1.94 -0.03 1.61 0.01 -1.26 -0.98 113.70 112.74 1iam s SER 16 Ca 0.20 -0.82 -0.11 0.00 1.31 0.00 0.00 55.95 56.53 1iam s SER 16 Cb -0.01 -0.06 0.02 0.00 0.21 0.00 0.00 66.02 66.18 1iam s SER 16 CO 0.14 -0.17 0.24 0.54 0.41 0.00 0.00 173.24 174.40 1iam s VAL 17 N -2.23 0.05 -0.16 3.43 0.11 -0.54 -4.99 120.40 116.07 1iam s VAL 17 Ca 0.09 -0.41 -0.15 0.00 -2.93 0.00 0.00 61.98 58.57 1iam s VAL 17 Cb -0.04 -0.49 -0.04 0.00 -1.53 0.00 0.00 36.38 34.27 1iam s VAL 17 CO 0.03 -0.23 0.35 -0.76 -3.33 0.00 0.00 175.10 171.16 1iam s LEU 18 N -0.95 4.23 -0.07 2.54 1.43 -1.26 -1.11 118.68 123.50 1iam s LEU 18 Ca -0.10 0.57 0.04 0.00 -1.03 0.00 0.00 54.13 53.61 1iam s LEU 18 Cb -0.05 -2.47 0.00 0.00 0.03 0.00 0.00 46.19 43.70 1iam s LEU 18 CO 0.02 0.05 -0.19 -0.69 0.23 0.00 0.00 176.35 175.77 1iam s VAL 19 N 0.66 1.63 -0.18 -1.59 1.01 -0.16 -4.50 120.40 117.26 1iam s VAL 19 Ca 0.19 -0.80 -0.01 0.00 0.00 0.00 0.00 61.98 61.36 1iam s VAL 19 Cb -0.14 -1.41 0.00 0.00 0.00 0.00 0.00 36.38 34.83 1iam s VAL 19 CO 0.06 0.46 -0.13 -0.89 0.00 0.00 0.00 175.10 174.60 1iam s THR 20 N 0.23 2.74 -0.21 3.92 2.01 -0.57 -0.83 115.64 122.92 1iam s THR 20 Ca -0.10 -0.73 -0.10 0.00 0.31 0.00 0.00 61.69 61.07 1iam s THR 20 Cb -0.15 -2.19 -0.05 0.00 0.01 0.00 0.00 72.50 70.13 1iam s THR 20 CO 0.05 0.49 0.13 0.00 -0.69 0.00 0.00 174.62 174.60 1iam s SER 22 N 0.64 1.75 -0.11 0.00 0.15 -0.13 -1.17 113.70 114.83 1iam s SER 22 Ca 0.07 -1.03 -0.06 0.00 0.70 0.00 0.00 55.95 55.64 1iam s SER 22 Cb -0.12 -0.00 0.05 0.00 -1.71 0.00 0.00 66.02 64.23 1iam s SER 22 CO 0.01 -0.35 0.26 0.28 1.20 0.00 0.00 173.24 174.63 1iam s THR 23 N -3.35 -0.04 -0.88 6.45 -1.32 -0.83 -1.20 115.64 114.46 1iam s THR 23 Ca 0.17 0.14 0.24 0.00 -1.21 0.00 0.00 61.69 61.03 1iam s THR 23 Cb 0.03 -0.40 0.22 0.00 -1.51 0.00 0.00 72.50 70.84 1iam s THR 23 CO 0.01 0.06 1.74 -1.20 -2.21 0.00 0.00 174.62 173.02 1iam n SER 24 N 4.22 0.25 -4.80 8.08 7.64 -0.76 -4.84 113.62 123.40 1iam n SER 24 Ca -0.25 0.54 -0.34 0.00 1.01 0.00 0.00 58.87 59.82 1iam n SER 24 Cb 0.53 -0.60 -0.05 0.00 -1.01 0.00 0.00 64.21 63.08 1iam n SER 24 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1iam h ASP 26 N 1.96 -0.05 -3.75 0.00 5.19 -2.04 -3.37 116.42 114.36 1iam h ASP 26 Ca -0.49 0.01 -0.71 0.00 -0.62 0.00 0.00 57.03 55.22 1iam h ASP 26 Cb 1.20 0.02 -0.34 0.00 0.18 0.00 0.00 39.33 40.40 1iam h ASP 26 CO 0.61 -0.01 -0.41 0.00 -3.12 0.00 0.00 179.24 176.30 1iam s GLN 27 N -3.08 2.40 -0.08 3.56 0.00 -1.26 -5.00 119.66 116.21 1iam s GLN 27 Ca -0.00 -2.15 -0.30 0.00 -0.00 0.00 0.00 55.36 52.91 1iam s GLN 27 Cb 0.00 -3.75 -0.03 0.00 0.00 0.00 0.00 33.01 29.24 1iam s GLN 27 CO 0.02 -1.15 1.20 -2.14 0.00 0.00 0.00 175.29 173.22 1iam s PRO 28 N 0.61 4.33 0.29 9.60 0.02 -1.26 -4.34 135.00 144.24 1iam s PRO 28 Ca 0.12 1.65 0.14 0.00 0.02 0.00 0.00 61.00 62.93 1iam s PRO 28 Cb -0.22 -3.60 0.32 0.00 0.02 0.00 0.00 34.50 31.03 1iam s PRO 28 CO -0.04 -0.50 1.57 0.87 -0.33 0.00 0.00 177.00 178.57 1iam h LYS 29 N 7.59 0.00 -1.96 5.54 1.57 -1.20 -3.46 116.57 124.65 1iam h LYS 29 Ca -0.32 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.43 1iam h LYS 29 Cb 1.15 0.00 -0.21 0.00 0.08 0.00 0.00 32.23 33.24 1iam h LYS 29 CO 0.90 0.56 0.17 -1.17 -0.57 0.00 0.00 179.45 179.34 1iam s LEU 30 N -6.97 -0.71 -0.12 2.94 2.96 -1.22 -4.95 118.68 110.61 1iam s LEU 30 Ca 0.01 1.32 -0.06 0.00 -0.22 0.00 0.00 54.13 55.18 1iam s LEU 30 Cb 0.10 2.41 0.05 0.00 0.50 0.00 0.00 46.19 49.26 1iam s LEU 30 CO 0.74 -0.27 0.29 -0.22 -1.32 0.00 0.00 176.35 175.56 1iam s LEU 31 N 0.22 0.28 0.00 -0.68 2.96 -1.26 -0.88 118.68 119.32 1iam s LEU 31 Ca -0.01 0.62 0.00 0.00 -0.22 0.00 0.00 54.13 54.52 1iam s LEU 31 Cb -0.05 0.90 0.00 0.00 0.50 0.00 0.00 46.19 47.54 1iam s LEU 31 CO 0.01 -0.17 0.00 0.61 -1.32 0.00 0.00 176.35 175.48 1iam n GLY 32 N 4.23 1.29 2.95 7.98 0.00 -0.42 -5.01 105.19 116.21 1iam n GLY 32 Ca -0.25 -0.86 -0.15 0.00 0.00 0.00 0.00 46.02 44.76 1iam n GLY 32 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1iam s ILE 33 N -2.49 0.35 -0.25 -0.61 2.07 -1.26 -1.28 121.20 117.73 1iam s ILE 33 Ca 0.00 -0.21 -0.06 0.00 -1.41 0.00 0.00 60.65 58.97 1iam s ILE 33 Cb 0.00 -0.30 -0.01 0.00 0.13 0.00 0.00 42.46 42.28 1iam s ILE 33 CO 0.00 0.09 0.03 -0.70 -1.91 0.00 0.00 174.94 172.44 1iam s GLU 34 N -0.14 3.40 -0.27 3.50 2.12 0.40 -4.98 118.70 122.74 1iam s GLU 34 Ca 0.01 -0.63 -0.26 0.00 0.36 0.00 0.00 54.97 54.45 1iam s GLU 34 Cb -0.02 -3.22 0.15 0.00 0.26 0.00 0.00 34.13 31.31 1iam s GLU 34 CO -0.00 -0.26 1.19 -0.08 -0.54 0.00 0.00 175.26 175.57 1iam s THR 35 N 1.53 0.00 -1.42 -1.70 -1.32 -1.26 -1.95 115.64 109.52 1iam s THR 35 Ca 0.05 0.00 0.29 0.00 -1.21 0.00 0.00 61.69 60.82 1iam s THR 35 Cb -0.15 -1.00 0.41 0.00 -1.51 0.00 0.00 72.50 70.25 1iam s THR 35 CO 0.01 0.00 1.91 -0.81 -2.21 0.00 0.00 174.62 173.52 1iam n PRO 36 N 1.58 0.43 -2.10 7.08 -0.04 -1.26 -4.93 135.00 135.76 1iam n PRO 36 Ca -0.10 -0.09 -0.36 0.00 -0.04 0.00 0.00 63.50 62.90 1iam n PRO 36 Cb 0.57 -1.50 0.02 0.00 -0.04 0.00 0.00 33.50 32.55 1iam n PRO 36 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1iam s LEU 37 N -2.63 3.81 0.04 1.53 1.43 -1.26 -4.94 118.68 116.67 1iam s LEU 37 Ca 0.25 2.38 -0.30 0.00 -1.03 0.00 0.00 54.13 55.43 1iam s LEU 37 Cb 0.20 -4.44 -0.09 0.00 0.03 0.00 0.00 46.19 41.89 1iam s LEU 37 CO 0.50 -1.31 1.94 -2.84 0.23 0.00 0.00 176.35 174.86 1iam s PRO 38 N -3.07 4.14 0.18 1.29 0.02 -1.26 -4.89 135.00 131.43 1iam s PRO 38 Ca 0.71 2.59 0.09 0.00 0.02 0.00 0.00 61.00 64.41 1iam s PRO 38 Cb -0.30 -4.08 -0.04 0.00 0.02 0.00 0.00 34.50 30.10 1iam s PRO 38 CO 0.34 -0.94 -0.17 -1.59 -0.33 0.00 0.00 177.00 174.31 1iam s LYS 39 N 4.21 1.31 -0.03 5.54 -2.85 -1.26 -1.35 119.74 125.31 1iam s LYS 39 Ca 0.87 -1.47 0.01 0.00 -1.00 0.00 0.00 55.97 54.38 1iam s LYS 39 Cb -0.43 -1.30 0.02 0.00 -2.06 0.00 0.00 37.83 34.06 1iam s LYS 39 CO 0.40 0.25 -0.04 0.21 0.10 0.00 0.00 175.35 176.28 1iam s LYS 40 N -3.04 0.59 -0.23 1.78 2.20 -0.93 -4.97 119.74 115.14 1iam s LYS 40 Ca 0.18 -0.08 -0.12 0.00 -0.36 0.00 0.00 55.97 55.59 1iam s LYS 40 Cb -0.04 -0.64 -0.05 0.00 -1.51 0.00 0.00 37.83 35.59 1iam s LYS 40 CO 0.07 -0.04 0.23 -2.00 -0.36 0.00 0.00 175.35 173.24 1iam s GLU 41 N 0.68 4.11 0.15 4.03 2.12 -1.26 -1.51 118.70 127.01 1iam s GLU 41 Ca -0.08 -0.14 0.01 0.00 0.36 0.00 0.00 54.97 55.13 1iam s GLU 41 Cb -0.11 -3.53 0.03 0.00 0.26 0.00 0.00 34.13 30.77 1iam s GLU 41 CO -0.00 0.05 0.20 1.28 -0.54 0.00 0.00 175.26 176.24 1iam n LEU 42 N 4.30 0.00 -3.79 2.70 4.32 0.76 -5.01 117.00 120.28 1iam n LEU 42 Ca -0.13 -0.53 -0.20 0.00 -0.02 0.00 0.00 56.01 55.14 1iam n LEU 42 Cb 0.52 -0.12 -0.17 0.00 -1.62 0.00 0.00 43.42 42.03 1iam n LEU 42 CO 0.36 -0.58 -0.37 -0.76 -1.22 0.00 0.00 177.39 174.82 1iam s LEU 43 N 0.00 0.84 0.00 2.23 1.02 -1.26 -4.26 118.68 117.25 1iam s LEU 43 Ca 0.14 -0.04 0.00 0.00 0.02 0.00 0.00 54.13 54.26 1iam s LEU 43 Cb -0.01 -0.30 0.00 0.00 0.02 0.00 0.00 46.19 45.90 1iam s LEU 43 CO 0.09 -0.15 0.00 0.18 0.02 0.00 0.00 176.35 176.50 1iam n LEU 44 N 4.62 0.00 0.00 1.79 4.77 -1.26 -4.89 117.00 122.03 1iam n LEU 44 Ca -0.17 0.00 0.06 0.00 -0.03 0.00 0.00 56.01 55.87 1iam n LEU 44 Cb 0.50 0.00 0.31 0.00 -2.33 0.00 0.00 43.42 41.90 1iam n LEU 44 CO 0.16 0.00 0.65 -2.65 -1.33 0.00 0.00 177.39 174.22 1iam n PRO 45 N 0.00 0.18 0.00 3.23 -0.02 -1.26 -4.82 135.00 132.31 1iam n PRO 45 Ca 0.00 0.16 0.00 0.00 -2.02 0.00 0.00 63.50 61.64 1iam n PRO 45 Cb 0.00 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 31.98 1iam n PRO 45 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1iam n GLY 46 N -0.24 1.10 0.00 -1.23 0.00 -1.02 -4.59 105.19 99.21 1iam n GLY 46 Ca 0.06 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.08 1iam n GLY 46 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1iam h ASN 47 N 0.00 -0.00 1.01 1.61 4.21 -2.01 -3.40 115.58 117.00 1iam h ASN 47 Ca 0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 1iam h ASN 47 Cb 0.00 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.20 1iam h ASN 47 CO 0.00 0.00 -0.15 0.59 -1.29 0.00 0.00 177.43 176.58 1iam n ASN 48 N -2.03 0.34 -3.87 5.81 4.13 -1.26 -4.83 115.26 113.55 1iam n ASN 48 Ca -0.00 0.35 -0.12 0.00 1.68 0.00 0.00 54.58 56.49 1iam n ASN 48 Cb 0.00 -0.37 -0.14 0.00 -1.54 0.00 0.00 39.78 37.73 1iam n ASN 48 CO 0.00 0.00 0.00 -0.13 0.28 0.00 0.00 177.26 177.41 1iam s ARG 49 N -3.04 0.04 0.01 3.52 0.52 -1.26 -1.97 118.95 116.76 1iam s ARG 49 Ca 0.12 -0.01 0.01 0.00 -0.52 0.00 0.00 55.73 55.34 1iam s ARG 49 Cb 0.17 0.02 -0.01 0.00 0.52 0.00 0.00 34.95 35.65 1iam s ARG 49 CO 0.59 -0.01 -0.05 0.15 0.02 0.00 0.00 175.30 176.01 1iam s LYS 50 N -0.07 0.39 -0.06 3.54 1.02 -0.32 -2.43 119.74 121.81 1iam s LYS 50 Ca -0.01 -0.28 0.06 0.00 0.02 0.00 0.00 55.97 55.76 1iam s LYS 50 Cb -0.01 -0.33 -0.01 0.00 -0.52 0.00 0.00 37.83 36.96 1iam s LYS 50 CO -0.00 0.08 -0.25 0.08 -0.92 0.00 0.00 175.35 174.34 1iam s VAL 51 N -0.37 2.06 -0.00 3.17 1.01 -1.26 -0.75 120.40 124.26 1iam s VAL 51 Ca -0.01 -1.06 0.04 0.00 0.00 0.00 0.00 61.98 60.95 1iam s VAL 51 Cb -0.03 -1.74 -0.01 0.00 0.00 0.00 0.00 36.38 34.59 1iam s VAL 51 CO -0.00 0.57 -0.14 -0.31 0.00 0.00 0.00 175.10 175.22 1iam s TYR 52 N -0.15 1.21 -0.27 5.22 1.51 -0.01 -0.17 117.35 124.68 1iam s TYR 52 Ca -0.04 -0.25 -0.09 0.00 -1.01 0.00 0.00 57.07 55.68 1iam s TYR 52 Cb -0.14 -0.77 -0.03 0.00 -0.11 0.00 0.00 41.96 40.92 1iam s TYR 52 CO 0.04 -0.01 0.11 -2.00 -1.11 0.00 0.00 175.55 172.58 1iam s GLU 53 N -0.47 3.61 -0.15 -0.62 2.12 -0.57 -0.99 118.70 121.63 1iam s GLU 53 Ca 0.05 -0.52 -0.15 0.00 0.36 0.00 0.00 54.97 54.71 1iam s GLU 53 Cb -0.06 -3.45 -0.05 0.00 0.26 0.00 0.00 34.13 30.84 1iam s GLU 53 CO -0.00 -0.25 0.33 -0.51 -0.54 0.00 0.00 175.26 174.29 1iam s LEU 54 N 1.64 4.26 0.13 2.70 1.02 -0.26 -2.18 118.68 125.98 1iam s LEU 54 Ca 0.06 0.59 0.07 0.00 0.02 0.00 0.00 54.13 54.87 1iam s LEU 54 Cb -0.16 -2.44 -0.04 0.00 0.02 0.00 0.00 46.19 43.57 1iam s LEU 54 CO 0.06 0.09 -0.17 -0.94 0.02 0.00 0.00 176.35 175.41 1iam s SER 55 N 0.43 2.31 -1.26 2.29 1.04 -0.46 -1.47 113.70 116.58 1iam s SER 55 Ca 0.19 -0.79 -0.00 0.00 0.48 0.00 0.00 55.95 55.82 1iam s SER 55 Cb -0.13 -0.11 -0.00 0.00 0.10 0.00 0.00 66.02 65.87 1iam s SER 55 CO 0.05 -0.06 0.82 -3.20 0.98 0.00 0.00 173.24 171.83 1iam n ASN 56 N 0.61 -1.59 -4.59 7.02 5.15 -0.15 -4.02 115.26 117.69 1iam n ASN 56 Ca -0.16 -0.74 -0.43 0.00 -0.60 0.00 0.00 54.58 52.65 1iam n ASN 56 Cb 0.56 -4.47 -0.02 0.00 -0.53 0.00 0.00 39.78 35.31 1iam n ASN 56 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 1iam s VAL 57 N -3.55 3.82 -0.13 3.44 1.01 -0.58 -4.69 120.40 119.72 1iam s VAL 57 Ca 0.01 0.81 0.17 0.00 0.00 0.00 0.00 61.98 62.97 1iam s VAL 57 Cb -0.00 -4.17 -0.12 0.00 0.00 0.00 0.00 36.38 32.08 1iam s VAL 57 CO 0.78 -0.79 0.84 0.00 0.00 0.00 0.00 175.10 175.93 1iam n GLN 58 N 8.24 0.62 -3.94 2.72 1.13 -1.26 -0.03 117.38 124.86 1iam n GLN 58 Ca 0.17 0.21 -0.09 0.00 -1.94 0.00 0.00 57.00 55.35 1iam n GLN 58 Cb 0.48 -1.81 -0.08 0.00 0.11 0.00 0.00 30.24 28.95 1iam n GLN 58 CO 0.00 0.00 0.00 -1.83 -1.44 0.00 0.00 177.06 173.79 1iam s GLU 59 N -2.97 0.93 0.27 -1.09 -1.05 -1.26 -4.70 118.70 108.83 1iam s GLU 59 Ca -0.03 -1.11 -0.28 0.00 -0.15 0.00 0.00 54.97 53.41 1iam s GLU 59 Cb 0.09 0.33 -0.15 0.00 -0.44 0.00 0.00 34.13 33.96 1iam s GLU 59 CO 0.81 -0.30 0.86 -0.25 0.95 0.00 0.00 175.26 177.33 1iam n ASP 60 N -0.10 0.53 -3.73 0.83 9.92 -1.26 -4.80 116.55 117.95 1iam n ASP 60 Ca -0.11 1.16 -0.12 0.00 -0.53 0.00 0.00 54.79 55.18 1iam n ASP 60 Cb 0.63 -1.19 -0.07 0.00 -0.64 0.00 0.00 41.12 39.84 1iam n ASP 60 CO 0.00 0.00 0.00 -0.44 0.13 0.00 0.00 177.20 176.89 1iam s SER 61 N -0.69 -0.19 -0.55 -2.24 0.01 -0.84 -5.01 113.70 104.19 1iam s SER 61 Ca 0.60 -0.05 0.07 0.00 1.31 0.00 0.00 55.95 57.88 1iam s SER 61 Cb -0.76 0.36 0.26 0.00 0.21 0.00 0.00 66.02 66.09 1iam s SER 61 CO 0.59 -0.57 0.69 0.00 0.41 0.00 0.00 173.24 174.36 1iam n GLN 62 N 0.78 1.98 -1.70 12.44 3.00 -1.26 -0.43 117.38 132.19 1iam n GLN 62 Ca -0.19 -4.21 -0.42 0.00 -0.01 0.00 0.00 57.00 52.16 1iam n GLN 62 Cb 0.58 -1.93 -0.00 0.00 0.00 0.00 0.00 30.24 28.90 1iam n GLN 62 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.06 174.76 1iam n PRO 63 N 0.93 2.11 -5.05 -1.09 -0.02 -1.14 -4.62 135.00 126.11 1iam n PRO 63 Ca 0.27 0.74 -0.29 0.00 -2.02 0.00 0.00 63.50 62.21 1iam n PRO 63 Cb 0.45 -2.36 -0.16 0.00 -0.02 0.00 0.00 33.50 31.42 1iam n PRO 63 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1iam s MET 64 N -1.96 2.14 0.55 -0.52 0.23 -0.82 -1.33 119.30 117.58 1iam s MET 64 Ca 0.57 -0.76 -0.07 0.00 -1.03 0.00 0.00 55.69 54.40 1iam s MET 64 Cb -0.55 -1.84 -0.02 0.00 -1.53 0.00 0.00 34.83 30.88 1iam s MET 64 CO 0.61 0.32 0.88 0.00 -2.03 0.00 0.00 175.02 174.81 1iam s TYR 66 N -2.93 -0.44 -0.15 0.00 -0.85 -0.40 -2.09 117.35 110.49 1iam s TYR 66 Ca 0.51 0.76 -0.11 0.00 -0.52 0.00 0.00 57.07 57.71 1iam s TYR 66 Cb -0.11 0.25 0.05 0.00 0.38 0.00 0.00 41.96 42.54 1iam s TYR 66 CO 0.47 -0.49 0.39 -1.54 -1.52 0.00 0.00 175.55 172.86 1iam s SER 67 N -1.15 -0.43 -0.53 -0.18 1.04 -1.12 -1.30 113.70 110.02 1iam s SER 67 Ca -0.11 0.80 -0.15 0.00 0.48 0.00 0.00 55.95 56.97 1iam s SER 67 Cb -0.03 0.76 0.13 0.00 0.10 0.00 0.00 66.02 66.98 1iam s SER 67 CO 0.07 -0.16 0.47 0.20 0.98 0.00 0.00 173.24 174.80 1iam s ASN 68 N 0.67 6.12 0.35 7.02 0.01 -0.06 -2.70 114.94 126.36 1iam s ASN 68 Ca -0.04 -1.78 0.03 0.00 -0.71 0.00 0.00 52.86 50.36 1iam s ASN 68 Cb -0.05 -2.18 -0.02 0.00 0.41 0.00 0.00 41.25 39.41 1iam s ASN 68 CO -0.05 -0.82 0.53 0.00 -1.51 0.00 0.00 177.10 175.25 1iam h PRO 70 N 0.77 0.26 -0.14 0.00 0.13 -1.98 -2.61 132.00 128.44 1iam h PRO 70 Ca -0.48 -0.04 -0.12 0.00 -0.87 0.00 0.00 66.00 64.49 1iam h PRO 70 Cb 1.24 -0.05 -0.01 0.00 0.13 0.00 0.00 31.00 32.31 1iam h PRO 70 CO 0.58 0.28 -0.44 -0.44 -0.23 0.00 0.00 178.00 177.75 1iam h ASP 71 N 0.26 0.34 0.00 1.44 3.32 -1.95 -3.48 116.42 116.36 1iam h ASP 71 Ca 0.06 -0.15 0.00 0.00 0.02 0.00 0.00 57.03 56.96 1iam h ASP 71 Cb 0.16 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.61 1iam h ASP 71 CO 0.00 0.74 0.00 0.61 -1.72 0.00 0.00 179.24 178.88 1iam n GLY 72 N -0.07 1.80 3.68 2.75 0.00 -0.98 -5.13 105.19 107.24 1iam n GLY 72 Ca -0.02 -0.93 -0.36 0.00 0.00 0.00 0.00 46.02 44.71 1iam n GLY 72 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1iam s GLN 73 N -2.00 4.11 0.29 1.61 0.74 -1.26 -2.09 119.66 121.06 1iam s GLN 73 Ca 0.00 -0.21 0.02 0.00 0.05 0.00 0.00 55.36 55.22 1iam s GLN 73 Cb 0.00 -3.51 -0.05 0.00 1.10 0.00 0.00 33.01 30.55 1iam s GLN 73 CO 0.00 0.11 0.11 -1.54 -0.55 0.00 0.00 175.29 173.42 1iam s SER 74 N 0.90 1.55 0.12 6.67 1.04 -1.10 -5.04 113.70 117.84 1iam s SER 74 Ca 0.09 -1.46 -0.01 0.00 0.48 0.00 0.00 55.95 55.05 1iam s SER 74 Cb -0.13 0.23 -0.04 0.00 0.10 0.00 0.00 66.02 66.18 1iam s SER 74 CO 0.03 -0.78 0.06 -0.89 0.98 0.00 0.00 173.24 172.64 1iam s THR 75 N -3.62 0.12 -0.18 2.02 2.01 -1.26 -2.81 115.64 111.91 1iam s THR 75 Ca 0.36 -1.87 -0.09 0.00 0.31 0.00 0.00 61.69 60.40 1iam s THR 75 Cb 0.07 -1.96 0.07 0.00 0.01 0.00 0.00 72.50 70.69 1iam s THR 75 CO 0.15 -0.53 0.44 0.00 -0.69 0.00 0.00 174.62 173.98 1iam s ALA 76 N -4.03 -1.14 -0.01 7.40 0.00 -0.89 -4.75 121.76 118.35 1iam s ALA 76 Ca 0.21 1.60 0.01 0.00 0.00 0.00 0.00 51.96 53.79 1iam s ALA 76 Cb 0.07 -1.03 -0.04 0.00 0.00 0.00 0.00 23.12 22.13 1iam s ALA 76 CO -0.00 -0.35 -0.00 0.21 0.00 0.00 0.00 175.76 175.62 1iam s LYS 77 N 1.60 2.80 -0.09 0.00 2.20 -1.26 -0.54 119.74 124.44 1iam s LYS 77 Ca -0.08 -0.60 0.03 0.00 -0.36 0.00 0.00 55.97 54.96 1iam s LYS 77 Cb -0.09 -2.67 -0.02 0.00 -1.51 0.00 0.00 37.83 33.54 1iam s LYS 77 CO -0.13 0.63 -0.18 -0.08 -0.36 0.00 0.00 175.35 175.23 1iam s THR 78 N -1.06 2.70 -0.29 3.43 -1.32 -0.44 -4.84 115.64 113.82 1iam s THR 78 Ca 0.19 -0.82 -0.11 0.00 -1.21 0.00 0.00 61.69 59.74 1iam s THR 78 Cb -0.11 -2.07 -0.04 0.00 -1.51 0.00 0.00 72.50 68.77 1iam s THR 78 CO 0.09 0.56 0.19 -0.36 -2.21 0.00 0.00 174.62 172.90 1iam s PHE 79 N -0.09 3.21 -0.17 9.09 0.40 -0.19 -2.89 117.98 127.35 1iam s PHE 79 Ca -0.04 -0.01 -0.07 0.00 -0.60 0.00 0.00 56.93 56.21 1iam s PHE 79 Cb -0.14 -2.39 -0.04 0.00 0.51 0.00 0.00 43.02 40.95 1iam s PHE 79 CO 0.04 -0.23 0.08 -0.51 0.70 0.00 0.00 175.22 175.30 1iam s LEU 80 N 1.74 3.94 -0.11 -0.37 1.02 0.43 -0.99 118.68 124.33 1iam s LEU 80 Ca 0.07 0.16 0.02 0.00 0.02 0.00 0.00 54.13 54.41 1iam s LEU 80 Cb -0.16 -1.99 0.01 0.00 0.02 0.00 0.00 46.19 44.07 1iam s LEU 80 CO 0.10 0.22 -0.19 -0.89 0.02 0.00 0.00 176.35 175.61 1iam s THR 81 N 0.08 1.79 -0.02 5.49 2.01 0.12 -1.98 115.64 123.12 1iam s THR 81 Ca 0.06 -0.83 -0.02 0.00 0.31 0.00 0.00 61.69 61.22 1iam s THR 81 Cb -0.12 -1.59 -0.04 0.00 0.01 0.00 0.00 72.50 70.76 1iam s THR 81 CO 0.00 0.50 0.09 0.68 -0.69 0.00 0.00 174.62 175.20 1iam s VAL 82 N 0.77 4.85 0.12 3.82 -7.23 -1.25 -0.52 120.40 120.97 1iam s VAL 82 Ca -0.10 -0.30 0.09 0.00 -1.81 0.00 0.00 61.98 59.87 1iam s VAL 82 Cb -0.16 -3.20 -0.04 0.00 0.56 0.00 0.00 36.38 33.55 1iam s VAL 82 CO 0.01 0.40 -0.23 -0.72 -0.31 0.00 0.00 175.10 174.24 1iam s TYR 83 N -1.16 2.02 -0.28 2.82 -0.85 -0.02 -3.44 117.35 116.44 1iam s TYR 83 Ca 0.22 -0.40 -0.20 0.00 -0.52 0.00 0.00 57.07 56.16 1iam s TYR 83 Cb -0.12 -1.09 0.12 0.00 0.38 0.00 0.00 41.96 41.25 1iam s TYR 83 CO 0.12 0.28 0.92 1.67 -1.52 0.00 0.00 175.55 177.03 1iam s TRP 84 N -1.21 -0.64 0.75 -3.49 1.48 -0.21 -0.78 118.94 114.84 1iam s TRP 84 Ca 0.11 1.40 -0.11 0.00 -1.06 0.00 0.00 56.10 56.44 1iam s TRP 84 Cb -0.10 0.39 0.04 0.00 -1.16 0.00 0.00 33.47 32.65 1iam s TRP 84 CO 0.05 -0.31 1.08 0.95 -4.06 0.00 0.00 176.95 174.66 1iam s THR 85 N 0.86 3.49 0.48 0.66 -4.23 -1.26 -1.32 115.64 114.32 1iam s THR 85 Ca -0.04 0.49 -0.22 0.00 -1.18 0.00 0.00 61.69 60.75 1iam s THR 85 Cb -0.05 -3.04 -0.09 0.00 1.34 0.00 0.00 72.50 70.66 1iam s THR 85 CO -0.11 -0.62 0.90 -2.65 -0.54 0.00 0.00 174.62 171.60 1iam n PRO 86 N -3.38 1.08 0.06 3.99 -0.02 -1.26 -4.22 135.00 131.25 1iam n PRO 86 Ca 0.09 0.40 0.13 0.00 -2.02 0.00 0.00 63.50 62.09 1iam n PRO 86 Cb 0.53 -1.98 0.33 0.00 -0.02 0.00 0.00 33.50 32.36 1iam n PRO 86 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 1iam n GLU 87 N -0.09 0.20 -3.64 -0.52 4.07 0.01 -4.83 120.64 115.84 1iam n GLU 87 Ca 0.11 0.11 -0.10 0.00 -0.06 0.00 0.00 57.16 57.21 1iam n GLU 87 Cb 0.42 -1.67 -0.07 0.00 -0.06 0.00 0.00 31.44 30.06 1iam n GLU 87 CO 0.00 0.00 0.00 0.50 -0.06 0.00 0.00 177.13 177.57 1iam s ARG 88 N -3.10 0.71 -0.22 5.31 3.52 -1.21 -4.99 118.95 118.97 1iam s ARG 88 Ca 0.10 0.99 -0.04 0.00 -0.13 0.00 0.00 55.73 56.64 1iam s ARG 88 Cb 0.14 0.27 0.08 0.00 -1.56 0.00 0.00 34.95 33.89 1iam s ARG 88 CO 0.65 -0.11 0.13 0.08 -0.81 0.00 0.00 175.30 175.24 1iam s VAL 89 N 0.85 -0.12 0.07 7.11 1.01 -1.26 -1.24 120.40 126.81 1iam s VAL 89 Ca -0.04 -0.39 -0.13 0.00 0.00 0.00 0.00 61.98 61.43 1iam s VAL 89 Cb -0.05 -0.75 0.02 0.00 0.00 0.00 0.00 36.38 35.60 1iam s VAL 89 CO -0.08 -0.44 0.29 -1.61 0.00 0.00 0.00 175.10 173.25 1iam s GLU 90 N 2.16 0.85 0.06 2.72 0.41 -0.91 -3.74 118.70 120.25 1iam s GLU 90 Ca 0.05 -0.65 -0.23 0.00 -0.41 0.00 0.00 54.97 53.73 1iam s GLU 90 Cb -0.16 0.36 -0.06 0.00 -1.78 0.00 0.00 34.13 32.49 1iam s GLU 90 CO -0.20 -0.28 0.71 -0.51 -0.49 0.00 0.00 175.26 174.48 1iam s LEU 91 N -2.36 4.48 0.41 1.80 1.43 -1.26 -0.50 118.68 122.69 1iam s LEU 91 Ca -0.02 1.41 -0.26 0.00 -1.03 0.00 0.00 54.13 54.24 1iam s LEU 91 Cb 0.01 -3.14 -0.10 0.00 0.03 0.00 0.00 46.19 42.99 1iam s LEU 91 CO -0.06 0.10 1.25 0.00 0.23 0.00 0.00 176.35 177.87 1iam n ALA 92 N 2.42 1.19 -1.66 4.21 0.00 0.11 -4.84 120.51 121.94 1iam n ALA 92 Ca -0.05 0.27 -0.48 0.00 0.00 0.00 0.00 53.44 53.18 1iam n ALA 92 Cb 0.50 -2.25 -0.05 0.00 0.00 0.00 0.00 19.45 17.66 1iam n ALA 92 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1iam n PRO 93 N 0.09 2.01 -4.39 0.00 -0.04 -1.26 -4.80 135.00 126.61 1iam n PRO 93 Ca 0.07 0.73 -0.19 0.00 -0.04 0.00 0.00 63.50 64.07 1iam n PRO 93 Cb 0.39 -2.50 -0.15 0.00 -0.04 0.00 0.00 33.50 31.21 1iam n PRO 93 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1iam s LEU 94 N 1.77 2.04 0.34 1.53 2.96 -1.26 -5.12 118.68 120.93 1iam s LEU 94 Ca 0.84 -0.21 -0.28 0.00 -0.22 0.00 0.00 54.13 54.25 1iam s LEU 94 Cb -0.73 -0.49 -0.12 0.00 0.50 0.00 0.00 46.19 45.35 1iam s LEU 94 CO 0.43 0.10 1.35 -0.81 -1.32 0.00 0.00 176.35 176.10 1iam n PRO 95 N 2.72 2.25 -0.03 0.98 -0.04 -1.26 -4.89 135.00 134.73 1iam n PRO 95 Ca -0.14 0.79 -0.10 0.00 -0.04 0.00 0.00 63.50 64.01 1iam n PRO 95 Cb 0.56 -2.42 0.04 0.00 -0.04 0.00 0.00 33.50 31.65 1iam n PRO 95 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1iam h SER 96 N 2.82 0.73 -3.16 3.54 0.87 -1.91 -3.43 113.55 113.01 1iam h SER 96 Ca -0.47 -0.36 -0.55 0.00 -1.23 0.00 0.00 61.79 59.18 1iam h SER 96 Cb 1.27 -0.21 -0.02 0.00 -0.44 0.00 0.00 62.40 63.01 1iam h SER 96 CO 0.64 1.09 0.62 -1.66 -0.53 0.00 0.00 176.83 177.00 1iam s TRP 97 N -4.15 3.33 -0.05 2.24 -2.14 -1.24 -0.77 118.94 116.16 1iam s TRP 97 Ca -0.08 1.32 -0.01 0.00 2.66 0.00 0.00 56.10 59.98 1iam s TRP 97 Cb 0.11 -3.37 0.03 0.00 -3.10 0.00 0.00 33.47 27.15 1iam s TRP 97 CO 0.85 -1.06 0.03 -1.14 -2.66 0.00 0.00 176.95 172.97 1iam s GLN 98 N 1.80 0.18 0.01 3.25 2.00 0.32 -4.94 119.66 122.29 1iam s GLN 98 Ca 0.55 0.24 -0.31 0.00 -2.00 0.00 0.00 55.36 53.85 1iam s GLN 98 Cb -0.25 -0.63 -0.10 0.00 0.80 0.00 0.00 33.01 32.84 1iam s GLN 98 CO 0.24 -0.28 1.95 -2.30 -0.50 0.00 0.00 175.29 174.40 1iam n PRO 99 N 5.01 2.72 -2.00 1.67 -0.02 -1.26 -3.55 135.00 137.56 1iam n PRO 99 Ca -0.09 1.00 -0.42 0.00 -2.02 0.00 0.00 63.50 61.97 1iam n PRO 99 Cb 0.50 -2.93 -0.03 0.00 -0.02 0.00 0.00 33.50 31.03 1iam n PRO 99 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1iam s VAL 100 N 4.30 2.71 0.00 -1.45 1.01 -1.26 -2.32 120.40 123.38 1iam s VAL 100 Ca 0.90 0.56 0.00 0.00 0.00 0.00 0.00 61.98 63.43 1iam s VAL 100 Cb -0.49 -3.36 0.00 0.00 0.00 0.00 0.00 36.38 32.53 1iam s VAL 100 CO 0.44 0.07 0.00 0.61 0.00 0.00 0.00 175.10 176.22 1iam n GLY 101 N 2.76 1.00 3.79 4.51 0.00 -0.04 -5.04 105.19 112.17 1iam n GLY 101 Ca 0.09 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.89 1iam n GLY 101 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1iam s LYS 102 N -0.56 2.68 0.11 1.61 -0.14 -0.98 -4.86 119.74 117.59 1iam s LYS 102 Ca 0.00 -1.27 -0.22 0.00 -1.36 0.00 0.00 55.97 53.12 1iam s LYS 102 Cb 0.00 -2.41 -0.07 0.00 -1.68 0.00 0.00 37.83 33.66 1iam s LYS 102 CO 0.00 0.24 0.68 -0.65 -0.76 0.00 0.00 175.35 174.86 1iam s GLN 103 N -3.87 4.39 0.06 1.68 -1.52 -1.26 -1.67 119.66 117.47 1iam s GLN 103 Ca 0.36 0.95 0.08 0.00 -1.95 0.00 0.00 55.36 54.79 1iam s GLN 103 Cb -0.06 -3.26 -0.03 0.00 -0.22 0.00 0.00 33.01 29.44 1iam s GLN 103 CO 0.24 0.57 -0.21 -1.17 -0.25 0.00 0.00 175.29 174.48 1iam s LEU 104 N -1.00 2.21 -0.13 2.90 0.20 -0.42 -4.96 118.68 117.49 1iam s LEU 104 Ca 0.33 -0.58 0.02 0.00 0.69 0.00 0.00 54.13 54.59 1iam s LEU 104 Cb -0.21 -0.95 -0.00 0.00 -0.43 0.00 0.00 46.19 44.60 1iam s LEU 104 CO 0.22 0.13 -0.18 -0.89 -0.29 0.00 0.00 176.35 175.34 1iam s THR 105 N -0.92 2.50 -0.07 3.68 2.01 -1.26 -0.46 115.64 121.11 1iam s THR 105 Ca 0.07 -0.85 -0.07 0.00 0.31 0.00 0.00 61.69 61.15 1iam s THR 105 Cb -0.09 -2.01 -0.04 0.00 0.01 0.00 0.00 72.50 70.36 1iam s THR 105 CO 0.03 0.54 0.19 -0.76 -0.69 0.00 0.00 174.62 173.92 1iam s LEU 106 N 0.51 4.39 -0.17 4.42 1.43 -0.36 -4.98 118.68 123.93 1iam s LEU 106 Ca -0.12 0.50 -0.04 0.00 -1.03 0.00 0.00 54.13 53.44 1iam s LEU 106 Cb -0.16 -2.29 0.07 0.00 0.03 0.00 0.00 46.19 43.83 1iam s LEU 106 CO 0.05 0.36 0.13 -0.60 0.23 0.00 0.00 176.35 176.51 1iam s ARG 107 N -1.29 0.08 -0.01 1.70 3.52 -1.26 -1.96 118.95 119.73 1iam s ARG 107 Ca 0.20 0.06 -0.12 0.00 -0.13 0.00 0.00 55.73 55.73 1iam s ARG 107 Cb -0.13 -1.49 -0.05 0.00 -1.56 0.00 0.00 34.95 31.72 1iam s ARG 107 CO 0.09 -0.62 0.36 0.00 -0.81 0.00 0.00 175.30 174.32 1iam s GLN 109 N -1.21 2.43 -0.29 0.00 -0.21 0.34 -1.86 119.66 118.86 1iam s GLN 109 Ca 0.24 -0.63 -0.00 0.00 0.02 0.00 0.00 55.36 54.99 1iam s GLN 109 Cb -0.15 -2.10 0.06 0.00 1.00 0.00 0.00 33.01 31.81 1iam s GLN 109 CO 0.13 -0.12 -0.03 0.08 -2.12 0.00 0.00 175.29 173.22 1iam s VAL 110 N 1.15 2.71 -0.27 1.09 1.01 -0.05 -2.13 120.40 123.90 1iam s VAL 110 Ca -0.02 -1.50 -0.15 0.00 0.00 0.00 0.00 61.98 60.31 1iam s VAL 110 Cb -0.14 -2.58 -0.04 0.00 0.00 0.00 0.00 36.38 33.62 1iam s VAL 110 CO -0.05 -0.10 0.38 -1.61 0.00 0.00 0.00 175.10 173.72 1iam s GLU 111 N 1.19 4.02 1.42 2.72 2.02 -0.37 -1.05 118.70 128.66 1iam s GLU 111 Ca -0.06 0.06 0.00 0.00 0.02 0.00 0.00 54.97 54.99 1iam s GLU 111 Cb -0.20 -3.66 0.00 0.00 0.10 0.00 0.00 34.13 30.38 1iam s GLU 111 CO -0.03 -0.28 0.00 0.41 0.02 0.00 0.00 175.26 175.38 1iam n GLY 112 N 4.66 -1.11 0.22 -1.39 0.00 -1.26 -0.81 105.19 105.49 1iam n GLY 112 Ca -0.08 -1.52 0.00 0.00 0.00 0.00 0.00 46.02 44.42 1iam n GLY 112 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1iam n GLY 113 N 0.00 -0.98 3.37 -0.02 0.00 -1.26 -4.69 105.19 101.62 1iam n GLY 113 Ca 0.00 -1.02 -0.14 0.00 0.00 0.00 0.00 46.02 44.87 1iam n GLY 113 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1iam s ALA 114 N -0.03 -1.23 0.22 4.61 0.00 -0.44 -4.14 121.76 120.75 1iam s ALA 114 Ca 0.00 0.56 -0.30 0.00 0.00 0.00 0.00 51.96 52.22 1iam s ALA 114 Cb 0.00 0.31 -0.09 0.00 0.00 0.00 0.00 23.12 23.34 1iam s ALA 114 CO 0.00 -0.46 1.35 -1.25 0.00 0.00 0.00 175.76 175.40 1iam s PRO 115 N -2.25 4.35 0.52 0.00 0.04 -1.22 -1.04 135.00 135.40 1iam s PRO 115 Ca -0.06 2.14 0.21 0.00 0.04 0.00 0.00 61.00 63.33 1iam s PRO 115 Cb -0.01 -3.16 1.38 0.00 0.04 0.00 0.00 34.50 32.75 1iam s PRO 115 CO -0.00 -0.30 2.12 0.00 0.04 0.00 0.00 177.00 178.85 1iam h ARG 116 N 5.20 0.00 0.00 4.56 2.47 -1.93 -2.12 114.38 122.56 1iam h ARG 116 Ca -0.45 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.27 1iam h ARG 116 Cb 1.22 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.54 1iam h ARG 116 CO 0.77 0.08 0.00 0.00 0.56 0.00 0.00 179.97 181.38 1iam n ALA 117 N -2.42 1.36 -0.94 0.04 0.00 -1.26 -1.88 120.51 115.41 1iam n ALA 117 Ca -0.03 -0.02 0.03 0.00 0.00 0.00 0.00 53.44 53.42 1iam n ALA 117 Cb 0.16 -1.09 0.04 0.00 0.00 0.00 0.00 19.45 18.56 1iam n ALA 117 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1iam n GLN 118 N -1.39 1.24 -3.97 0.00 1.13 -0.80 -5.02 117.38 108.55 1iam n GLN 118 Ca 0.02 -1.49 -0.35 0.00 -1.94 0.00 0.00 57.00 53.24 1iam n GLN 118 Cb 0.06 -0.93 -0.12 0.00 0.11 0.00 0.00 30.24 29.36 1iam n GLN 118 CO 0.00 0.00 0.00 -1.17 -1.44 0.00 0.00 177.06 174.45 1iam s LEU 119 N -1.11 3.48 -0.00 1.08 0.20 -0.79 -1.33 118.68 120.20 1iam s LEU 119 Ca 0.09 -0.12 0.08 0.00 0.69 0.00 0.00 54.13 54.87 1iam s LEU 119 Cb 0.08 -1.90 -0.02 0.00 -0.43 0.00 0.00 46.19 43.92 1iam s LEU 119 CO 0.01 0.07 -0.26 -0.89 -0.29 0.00 0.00 176.35 174.99 1iam s THR 120 N 1.00 2.03 -0.14 3.68 2.01 -0.40 -1.04 115.64 122.77 1iam s THR 120 Ca 0.03 -1.16 -0.04 0.00 0.31 0.00 0.00 61.69 60.83 1iam s THR 120 Cb -0.14 -1.70 -0.03 0.00 0.01 0.00 0.00 72.50 70.64 1iam s THR 120 CO 0.02 0.51 -0.00 -0.69 -0.69 0.00 0.00 174.62 173.77 1iam s VAL 121 N -0.65 4.22 -0.00 3.82 1.01 -0.09 -0.59 120.40 128.12 1iam s VAL 121 Ca 0.10 -0.25 0.03 0.00 0.00 0.00 0.00 61.98 61.86 1iam s VAL 121 Cb -0.10 -2.83 -0.01 0.00 0.00 0.00 0.00 36.38 33.44 1iam s VAL 121 CO -0.00 0.52 -0.10 0.68 0.00 0.00 0.00 175.10 176.20 1iam s VAL 122 N -0.05 0.79 -0.15 2.92 -7.23 0.35 -1.22 120.40 115.80 1iam s VAL 122 Ca 0.03 -0.46 -0.06 0.00 -1.81 0.00 0.00 61.98 59.68 1iam s VAL 122 Cb -0.13 -0.67 -0.04 0.00 0.56 0.00 0.00 36.38 36.11 1iam s VAL 122 CO 0.02 0.20 0.05 -0.76 -0.31 0.00 0.00 175.10 174.30 1iam s LEU 123 N -0.30 3.81 0.08 1.32 1.43 -0.32 -0.99 118.68 123.71 1iam s LEU 123 Ca 0.03 0.14 0.07 0.00 -1.03 0.00 0.00 54.13 53.34 1iam s LEU 123 Cb -0.04 -1.93 -0.03 0.00 0.03 0.00 0.00 46.19 44.21 1iam s LEU 123 CO -0.00 0.25 -0.18 -0.76 0.23 0.00 0.00 176.35 175.89 1iam s LEU 124 N -0.11 2.28 -0.40 1.79 1.02 0.46 -0.37 118.68 123.34 1iam s LEU 124 Ca 0.06 -0.64 -0.04 0.00 0.02 0.00 0.00 54.13 53.54 1iam s LEU 124 Cb -0.12 -0.73 0.10 0.00 0.02 0.00 0.00 46.19 45.46 1iam s LEU 124 CO 0.01 0.01 0.20 -0.60 0.02 0.00 0.00 176.35 175.99 1iam s ARG 125 N -1.76 2.12 7.99 1.70 3.52 -0.31 -1.28 118.95 130.93 1iam s ARG 125 Ca 0.03 -1.73 0.00 0.00 -0.13 0.00 0.00 55.73 53.90 1iam s ARG 125 Cb -0.10 -3.58 0.00 0.00 -1.56 0.00 0.00 34.95 29.71 1iam s ARG 125 CO 0.03 -1.03 0.00 0.41 -0.81 0.00 0.00 175.30 173.91 1iam n GLY 126 N 4.64 3.25 0.84 8.12 0.00 0.67 -1.57 105.19 121.14 1iam n GLY 126 Ca -0.04 -0.17 0.09 0.00 0.00 0.00 0.00 46.02 45.89 1iam n GLY 126 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1iam n GLU 127 N 12.95 2.08 -3.37 1.61 0.00 -1.26 -4.80 120.64 127.85 1iam n GLU 127 Ca 0.00 -1.93 -0.38 0.00 0.00 0.00 0.00 57.16 54.85 1iam n GLU 127 Cb 0.00 -1.37 -0.06 0.00 0.00 0.00 0.00 31.44 30.01 1iam n GLU 127 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.13 177.28 1iam s LYS 128 N -1.22 4.08 -0.18 3.44 1.02 -0.61 -5.06 119.74 121.21 1iam s LYS 128 Ca 0.28 0.58 -0.23 0.00 0.02 0.00 0.00 55.97 56.62 1iam s LYS 128 Cb 0.16 -3.24 -0.02 0.00 -0.52 0.00 0.00 37.83 34.21 1iam s LYS 128 CO 0.23 0.64 0.72 -1.83 -0.92 0.00 0.00 175.35 174.19 1iam s GLU 129 N -1.01 4.25 -0.21 1.68 1.03 -1.26 -1.16 118.70 122.03 1iam s GLU 129 Ca 0.27 0.80 0.07 0.00 0.03 0.00 0.00 54.97 56.14 1iam s GLU 129 Cb -0.18 -3.58 -0.21 0.00 -0.80 0.00 0.00 34.13 29.36 1iam s GLU 129 CO 0.16 -0.28 0.00 1.28 -1.33 0.00 0.00 175.26 175.09 1iam n LEU 130 N 5.13 1.78 -3.68 1.83 4.77 0.50 -4.94 117.00 122.39 1iam n LEU 130 Ca 0.01 -0.01 -0.15 0.00 -0.03 0.00 0.00 56.01 55.83 1iam n LEU 130 Cb 0.49 -0.38 -0.08 0.00 -2.33 0.00 0.00 43.42 41.13 1iam n LEU 130 CO 0.46 0.74 0.17 -0.75 -1.33 0.00 0.00 177.39 176.68 1iam s LYS 131 N -2.52 0.78 -0.03 3.23 2.47 -1.14 -4.98 119.74 117.55 1iam s LYS 131 Ca -0.23 0.07 -0.02 0.00 -1.56 0.00 0.00 55.97 54.22 1iam s LYS 131 Cb 0.08 0.36 0.02 0.00 -1.46 0.00 0.00 37.83 36.82 1iam s LYS 131 CO 0.71 -0.21 0.08 1.03 0.16 0.00 0.00 175.35 177.12 1iam s ARG 132 N -1.07 0.07 -0.15 4.03 0.52 -1.26 -1.17 118.95 119.91 1iam s ARG 132 Ca -0.11 0.16 -0.25 0.00 -0.52 0.00 0.00 55.73 55.00 1iam s ARG 132 Cb -0.03 -0.04 0.06 0.00 0.52 0.00 0.00 34.95 35.46 1iam s ARG 132 CO 0.06 -0.06 0.64 -1.21 0.02 0.00 0.00 175.30 174.75 1iam s GLU 133 N 0.38 0.88 0.50 3.54 2.02 -0.36 -5.00 118.70 120.66 1iam s GLU 133 Ca -0.03 0.57 -0.23 0.00 0.02 0.00 0.00 54.97 55.30 1iam s GLU 133 Cb -0.04 0.42 -0.06 0.00 0.10 0.00 0.00 34.13 34.55 1iam s GLU 133 CO -0.01 -0.19 1.31 -2.14 0.02 0.00 0.00 175.26 174.25 1iam s PRO 134 N -0.40 3.43 -0.28 0.39 0.02 -1.26 -0.91 135.00 135.99 1iam s PRO 134 Ca -0.05 2.14 -0.29 0.00 0.02 0.00 0.00 61.00 62.81 1iam s PRO 134 Cb -0.03 -2.39 -0.00 0.00 0.02 0.00 0.00 34.50 32.10 1iam s PRO 134 CO 0.05 -0.93 1.32 0.00 -0.33 0.00 0.00 177.00 177.11 1iam s ALA 135 N -1.34 3.39 0.02 -1.55 0.00 -0.21 -4.74 121.76 117.33 1iam s ALA 135 Ca 0.67 0.17 0.05 0.00 0.00 0.00 0.00 51.96 52.85 1iam s ALA 135 Cb -0.38 -3.76 -0.02 0.00 0.00 0.00 0.00 23.12 18.96 1iam s ALA 135 CO 0.46 -1.71 -0.15 0.08 0.00 0.00 0.00 175.76 174.44 1iam s VAL 136 N 4.32 1.17 0.00 0.00 1.01 -1.26 -4.89 120.40 120.75 1iam s VAL 136 Ca 0.57 -0.88 0.00 0.00 0.00 0.00 0.00 61.98 61.67 1iam s VAL 136 Cb -0.18 -1.03 0.00 0.00 0.00 0.00 0.00 36.38 35.17 1iam s VAL 136 CO 0.22 0.13 0.00 0.61 0.00 0.00 0.00 175.10 176.07 1iam n GLY 137 N 2.18 -1.04 2.74 4.51 0.00 -1.26 -3.89 105.19 108.44 1iam n GLY 137 Ca -0.17 -1.63 -0.19 0.00 0.00 0.00 0.00 46.02 44.03 1iam n GLY 137 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1iam s GLU 138 N -1.14 0.15 0.58 1.61 2.56 -1.26 -2.72 118.70 118.48 1iam s GLU 138 Ca 0.00 0.20 -0.17 0.00 0.00 0.00 0.00 54.97 55.00 1iam s GLU 138 Cb 0.00 -1.20 -0.04 0.00 2.00 0.00 0.00 34.13 34.89 1iam s GLU 138 CO 0.00 -0.62 1.08 -1.25 -0.56 0.00 0.00 175.26 173.91 1iam s PRO 139 N 2.29 3.30 -0.28 4.30 0.04 -1.26 -5.06 135.00 138.33 1iam s PRO 139 Ca 0.06 1.33 -0.29 0.00 0.04 0.00 0.00 61.00 62.13 1iam s PRO 139 Cb -0.15 -2.02 -0.00 0.00 0.04 0.00 0.00 34.50 32.36 1iam s PRO 139 CO -0.11 -0.84 1.34 0.00 0.04 0.00 0.00 177.00 177.42 1iam s ALA 140 N -2.25 3.38 -0.00 8.56 0.00 -0.22 -4.79 121.76 126.44 1iam s ALA 140 Ca 0.66 0.18 -0.00 0.00 0.00 0.00 0.00 51.96 52.80 1iam s ALA 140 Cb -0.18 -3.77 -0.04 0.00 0.00 0.00 0.00 23.12 19.13 1iam s ALA 140 CO 0.33 -1.74 0.09 -1.21 0.00 0.00 0.00 175.76 173.24 1iam s GLU 141 N 4.16 3.09 -0.03 0.00 2.02 -1.25 -0.87 118.70 125.81 1iam s GLU 141 Ca 0.58 -0.48 -0.00 0.00 0.02 0.00 0.00 54.97 55.09 1iam s GLU 141 Cb -0.18 -2.87 0.03 0.00 0.10 0.00 0.00 34.13 31.21 1iam s GLU 141 CO 0.23 0.65 0.02 0.08 0.02 0.00 0.00 175.26 176.25 1iam s VAL 142 N -1.21 0.09 0.14 2.63 1.01 -0.78 -4.83 120.40 117.45 1iam s VAL 142 Ca 0.23 0.17 0.06 0.00 0.00 0.00 0.00 61.98 62.44 1iam s VAL 142 Cb -0.12 -0.22 -0.04 0.00 0.00 0.00 0.00 36.38 36.00 1iam s VAL 142 CO 0.14 0.14 -0.15 0.42 0.00 0.00 0.00 175.10 175.66 1iam s THR 143 N 1.24 1.46 -0.11 3.92 -4.23 -1.26 -0.61 115.64 116.04 1iam s THR 143 Ca -0.07 -1.83 -0.27 0.00 -1.18 0.00 0.00 61.69 58.34 1iam s THR 143 Cb -0.13 -1.67 0.06 0.00 1.34 0.00 0.00 72.50 72.11 1iam s THR 143 CO -0.02 -0.44 0.65 0.28 -0.54 0.00 0.00 174.62 174.55 1iam s THR 144 N -2.29 0.00 0.24 3.99 -1.32 -0.83 -5.00 115.64 110.44 1iam s THR 144 Ca 0.12 -0.04 -0.08 0.00 -1.21 0.00 0.00 61.69 60.48 1iam s THR 144 Cb -0.04 -0.95 -0.07 0.00 -1.51 0.00 0.00 72.50 69.93 1iam s THR 144 CO 0.04 -0.02 0.54 0.42 -2.21 0.00 0.00 174.62 173.39 1iam s THR 145 N -0.70 4.97 -0.09 5.08 -4.23 -1.26 -1.23 115.64 118.18 1iam s THR 145 Ca -0.08 0.36 -0.02 0.00 -1.18 0.00 0.00 61.69 60.77 1iam s THR 145 Cb -0.02 -3.64 0.04 0.00 1.34 0.00 0.00 72.50 70.22 1iam s THR 145 CO 0.07 -0.12 0.04 -0.69 -0.54 0.00 0.00 174.62 173.38 1iam s VAL 146 N -1.87 0.12 -0.53 2.29 1.01 0.39 -4.96 120.40 116.85 1iam s VAL 146 Ca 0.46 0.12 -0.28 0.00 0.00 0.00 0.00 61.98 62.28 1iam s VAL 146 Cb -0.11 -0.44 0.02 0.00 0.00 0.00 0.00 36.38 35.84 1iam s VAL 146 CO 0.23 0.08 1.38 -0.22 0.00 0.00 0.00 175.10 176.57 1iam s LEU 147 N 2.07 3.45 -0.02 3.92 2.96 -1.26 -1.31 118.68 128.49 1iam s LEU 147 Ca 0.04 0.36 -0.30 0.00 -0.22 0.00 0.00 54.13 54.02 1iam s LEU 147 Cb -0.13 -3.17 -0.08 0.00 0.50 0.00 0.00 46.19 43.30 1iam s LEU 147 CO -0.05 -1.62 2.02 -0.69 -1.32 0.00 0.00 176.35 174.69 1iam s VAL 148 N 5.76 3.02 0.40 1.68 1.01 -0.67 -4.93 120.40 126.67 1iam s VAL 148 Ca 0.53 0.02 0.07 0.00 0.00 0.00 0.00 61.98 62.60 1iam s VAL 148 Cb -0.11 -3.02 -0.06 0.00 0.00 0.00 0.00 36.38 33.20 1iam s VAL 148 CO 0.27 -0.00 0.13 -0.13 0.00 0.00 0.00 175.10 175.36 1iam s ARG 149 N 4.88 2.16 0.41 2.72 0.52 -1.26 -0.86 118.95 127.52 1iam s ARG 149 Ca 0.91 -1.88 0.21 0.00 -0.52 0.00 0.00 55.73 54.45 1iam s ARG 149 Cb -0.40 -1.92 0.79 0.00 0.52 0.00 0.00 34.95 33.94 1iam s ARG 149 CO 0.40 -0.07 1.78 -0.09 0.02 0.00 0.00 175.30 177.34 1iam h ARG 150 N 1.54 0.00 -1.00 3.54 2.43 -1.99 -1.75 114.38 117.14 1iam h ARG 150 Ca -0.43 0.00 0.13 0.00 -0.81 0.00 0.00 59.98 58.87 1iam h ARG 150 Cb 1.25 0.00 -0.09 0.00 -0.42 0.00 0.00 29.97 30.71 1iam h ARG 150 CO 0.72 0.30 0.63 -0.44 -1.51 0.00 0.00 179.97 179.66 1iam h ASP 151 N 0.00 0.90 -1.82 -3.80 3.32 -1.98 -3.27 116.42 109.78 1iam h ASP 151 Ca -0.00 0.06 -0.54 0.00 0.02 0.00 0.00 57.03 56.57 1iam h ASP 151 Cb 0.82 -0.12 -0.08 0.00 0.22 0.00 0.00 39.33 40.17 1iam h ASP 151 CO 0.04 0.46 1.21 -1.00 -1.72 0.00 0.00 179.24 178.22 1iam s HIS 152 N -5.95 2.25 0.00 4.55 3.76 -0.66 -4.81 115.29 114.44 1iam s HIS 152 Ca -0.12 -0.14 0.00 0.00 -0.15 0.00 0.00 55.06 54.65 1iam s HIS 152 Cb 0.23 -4.55 0.00 0.00 1.11 0.00 0.00 32.58 29.37 1iam s HIS 152 CO 0.81 -2.04 0.00 -2.39 -0.85 0.00 0.00 174.74 170.27 1iam n HIS 153 N 9.95 0.00 -0.95 1.40 1.44 -1.24 -4.69 115.22 121.14 1iam n HIS 153 Ca 0.17 0.00 -0.22 0.00 -2.01 0.00 0.00 57.72 55.66 1iam n HIS 153 Cb 0.50 0.00 0.06 0.00 0.12 0.00 0.00 29.99 30.67 1iam n HIS 153 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1iam n GLY 154 N 4.62 4.54 3.68 -1.39 0.00 -1.26 -4.18 105.19 111.21 1iam n GLY 154 Ca 0.00 -1.38 -0.42 0.00 0.00 0.00 0.00 46.02 44.21 1iam n GLY 154 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1iam s ALA 155 N -2.47 3.56 -0.16 4.61 0.00 -1.26 -4.89 121.76 121.16 1iam s ALA 155 Ca 0.42 0.74 -0.12 0.00 0.00 0.00 0.00 51.96 52.99 1iam s ALA 155 Cb 0.33 -3.57 -0.05 0.00 0.00 0.00 0.00 23.12 19.83 1iam s ALA 155 CO 0.01 -0.90 0.25 -0.65 0.00 0.00 0.00 175.76 174.47 1iam s GLN 156 N 2.50 4.15 0.06 0.00 -0.21 -1.26 -2.67 119.66 122.23 1iam s GLN 156 Ca 0.60 0.03 0.04 0.00 0.02 0.00 0.00 55.36 56.05 1iam s GLN 156 Cb -0.28 -3.39 -0.04 0.00 1.00 0.00 0.00 33.01 30.30 1iam s GLN 156 CO 0.24 0.33 -0.03 -0.06 -2.12 0.00 0.00 175.29 173.64 1iam s PHE 157 N 0.22 2.94 0.24 0.91 0.40 0.80 -0.24 117.98 123.25 1iam s PHE 157 Ca 0.15 -0.03 -0.09 0.00 -0.60 0.00 0.00 56.93 56.35 1iam s PHE 157 Cb -0.13 -1.56 -0.01 0.00 0.51 0.00 0.00 43.02 41.83 1iam s PHE 157 CO 0.03 0.44 0.40 -1.54 0.70 0.00 0.00 175.22 175.25 1iam s SER 158 N -1.95 0.02 0.01 1.36 1.04 -0.41 -0.35 113.70 113.43 1iam s SER 158 Ca 0.22 -1.07 0.06 0.00 0.48 0.00 0.00 55.95 55.64 1iam s SER 158 Cb -0.11 0.54 -0.02 0.00 0.10 0.00 0.00 66.02 66.53 1iam s SER 158 CO 0.14 -1.08 -0.19 0.00 0.98 0.00 0.00 173.24 173.09 1iam s ARG 160 N -0.74 0.44 0.07 0.00 3.52 -0.16 -1.74 118.95 120.35 1iam s ARG 160 Ca 0.07 -0.56 0.09 0.00 -0.13 0.00 0.00 55.73 55.20 1iam s ARG 160 Cb -0.08 -0.25 -0.03 0.00 -1.56 0.00 0.00 34.95 33.03 1iam s ARG 160 CO 0.00 0.05 -0.21 0.95 -0.81 0.00 0.00 175.30 175.28 1iam s THR 161 N -1.01 2.61 -0.21 4.11 -4.23 -0.55 -0.50 115.64 115.87 1iam s THR 161 Ca -0.07 -1.39 0.00 0.00 -1.18 0.00 0.00 61.69 59.05 1iam s THR 161 Cb -0.07 -2.12 0.05 0.00 1.34 0.00 0.00 72.50 71.70 1iam s THR 161 CO 0.00 0.25 -0.06 -1.61 -0.54 0.00 0.00 174.62 172.66 1iam s GLU 162 N -1.67 1.59 -0.73 3.99 2.02 0.25 -2.42 118.70 121.72 1iam s GLU 162 Ca 0.15 -0.81 -0.14 0.00 0.02 0.00 0.00 54.97 54.19 1iam s GLU 162 Cb -0.10 -2.39 0.19 0.00 0.10 0.00 0.00 34.13 31.93 1iam s GLU 162 CO 0.06 -0.53 0.66 -1.17 0.02 0.00 0.00 175.26 174.31 1iam s LEU 163 N 1.48 6.50 -0.79 1.80 0.20 -0.24 -1.28 118.68 126.35 1iam s LEU 163 Ca -0.03 -2.43 -0.21 0.00 0.69 0.00 0.00 54.13 52.15 1iam s LEU 163 Cb -0.17 -2.19 0.09 0.00 -0.43 0.00 0.00 46.19 43.49 1iam s LEU 163 CO -0.07 -0.64 1.07 -0.62 -0.29 0.00 0.00 176.35 175.79 1iam s ASP 164 N 2.50 6.37 0.00 3.68 -1.08 -0.44 -1.36 116.67 126.33 1iam s ASP 164 Ca 0.13 -1.41 0.23 0.00 -0.52 0.00 0.00 52.55 50.98 1iam s ASP 164 Cb -0.17 -2.43 0.54 0.00 -1.46 0.00 0.00 42.92 39.41 1iam s ASP 164 CO -0.05 -1.32 1.47 0.18 0.52 0.00 0.00 175.17 175.98 1iam n LEU 165 N 7.41 3.62 -0.34 -1.34 4.32 -0.74 -4.44 117.00 125.49 1iam n LEU 165 Ca 0.09 -1.69 0.06 0.00 -0.02 0.00 0.00 56.01 54.45 1iam n LEU 165 Cb 0.47 -0.36 0.22 0.00 -1.62 0.00 0.00 43.42 42.13 1iam n LEU 165 CO 0.59 0.85 1.20 0.03 -1.22 0.00 0.00 177.39 178.84 1iam h ARG 166 N 4.30 0.88 0.00 3.23 3.08 -1.69 0.12 114.38 124.30 1iam h ARG 166 Ca 0.00 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.00 1iam h ARG 166 Cb 0.97 -0.20 0.00 0.00 0.08 0.00 0.00 29.97 30.82 1iam h ARG 166 CO 0.00 0.59 0.00 -0.35 -1.07 0.00 0.00 179.97 179.14 1iam n PRO 167 N -4.67 0.14 0.00 0.04 -0.04 -1.26 -1.30 135.00 127.90 1iam n PRO 167 Ca 0.17 0.20 0.10 0.00 -0.04 0.00 0.00 63.50 63.93 1iam n PRO 167 Cb 0.34 -1.50 0.03 0.00 -0.04 0.00 0.00 33.50 32.33 1iam n PRO 167 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1iam n GLN 168 N -1.31 1.60 0.00 0.54 3.00 0.35 -4.96 117.38 116.60 1iam n GLN 168 Ca 0.05 -1.23 0.00 0.00 -0.01 0.00 0.00 57.00 55.81 1iam n GLN 168 Cb 0.09 -1.39 0.00 0.00 0.00 0.00 0.00 30.24 28.95 1iam n GLN 168 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1iam n GLY 169 N 1.25 0.86 0.00 1.08 0.00 -0.42 -5.01 105.19 102.95 1iam n GLY 169 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 1iam n GLY 169 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1iam n LEU 170 N 0.00 0.00 -4.49 0.99 4.77 -0.81 -4.97 117.00 112.49 1iam n LEU 170 Ca 0.00 0.00 -0.25 0.00 -0.03 0.00 0.00 56.01 55.73 1iam n LEU 170 Cb 0.00 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.01 1iam n LEU 170 CO 0.00 0.00 -0.17 -1.83 -1.33 0.00 0.00 177.39 174.06 1iam s GLU 171 N 4.96 1.94 -0.16 3.23 -1.05 -1.26 -4.01 118.70 122.35 1iam s GLU 171 Ca 0.00 -2.19 -0.18 0.00 -0.15 0.00 0.00 54.97 52.45 1iam s GLU 171 Cb 0.00 -0.46 -0.04 0.00 -0.44 0.00 0.00 34.13 33.19 1iam s GLU 171 CO 0.00 -0.53 0.49 -1.17 0.95 0.00 0.00 175.26 174.99 1iam s LEU 172 N -3.59 4.20 -0.22 1.83 2.96 -1.26 -1.80 118.68 120.81 1iam s LEU 172 Ca 0.25 0.72 -0.06 0.00 -0.22 0.00 0.00 54.13 54.82 1iam s LEU 172 Cb 0.02 -2.68 -0.03 0.00 0.50 0.00 0.00 46.19 44.00 1iam s LEU 172 CO 0.16 -0.09 0.02 -0.36 -1.32 0.00 0.00 176.35 174.77 1iam s PHE 173 N 1.17 3.06 0.15 5.38 0.08 -0.47 -4.94 117.98 122.41 1iam s PHE 173 Ca 0.24 -0.44 0.07 0.00 0.12 0.00 0.00 56.93 56.92 1iam s PHE 173 Cb -0.15 -2.13 -0.04 0.00 -0.57 0.00 0.00 43.02 40.13 1iam s PHE 173 CO 0.10 -0.27 0.00 -1.21 -0.10 0.00 0.00 175.22 173.74 1iam s GLU 174 N 1.18 2.45 0.01 0.44 2.02 -1.26 -1.08 118.70 122.47 1iam s GLU 174 Ca 0.03 -1.03 -0.01 0.00 0.02 0.00 0.00 54.97 53.98 1iam s GLU 174 Cb -0.14 -2.41 -0.01 0.00 0.10 0.00 0.00 34.13 31.66 1iam s GLU 174 CO 0.02 0.48 0.00 -0.80 0.02 0.00 0.00 175.26 174.98 1iam s ASN 175 N -2.79 0.16 0.04 -0.19 -0.87 -1.02 -4.98 114.94 105.29 1iam s ASN 175 Ca 0.27 -0.34 0.03 0.00 -1.57 0.00 0.00 52.86 51.25 1iam s ASN 175 Cb -0.10 0.10 -0.02 0.00 -0.02 0.00 0.00 41.25 41.21 1iam s ASN 175 CO 0.19 -0.24 -0.09 -0.89 -2.57 0.00 0.00 177.10 173.49 1iam s THR 176 N -1.10 0.70 0.84 1.60 2.01 -1.26 -1.48 115.64 116.94 1iam s THR 176 Ca -0.12 -0.92 -0.07 0.00 0.31 0.00 0.00 61.69 60.88 1iam s THR 176 Cb -0.07 -0.69 0.17 0.00 0.01 0.00 0.00 72.50 71.91 1iam s THR 176 CO -0.00 -0.19 1.15 -0.94 -0.69 0.00 0.00 174.62 173.94 1iam s SER 177 N -1.23 3.73 0.49 3.53 1.04 -0.71 -4.92 113.70 115.64 1iam s SER 177 Ca -0.04 -0.15 -0.21 0.00 0.48 0.00 0.00 55.95 56.02 1iam s SER 177 Cb -0.08 -0.04 -0.07 0.00 0.10 0.00 0.00 66.02 65.93 1iam s SER 177 CO 0.01 -2.30 1.14 0.00 0.98 0.00 0.00 173.24 173.07 1iam s ALA 178 N -3.48 2.86 0.68 5.32 0.00 -1.26 -4.78 121.76 121.09 1iam s ALA 178 Ca 0.70 0.87 -0.11 0.00 0.00 0.00 0.00 51.96 53.43 1iam s ALA 178 Cb -0.04 -3.37 -0.00 0.00 0.00 0.00 0.00 23.12 19.71 1iam s ALA 178 CO 0.48 -0.68 1.07 -1.25 0.00 0.00 0.00 175.76 175.38 1iam s PRO 179 N -2.94 3.10 -0.15 0.00 0.04 -1.26 -4.75 135.00 129.04 1iam s PRO 179 Ca 0.67 0.64 0.02 0.00 0.04 0.00 0.00 61.00 62.37 1iam s PRO 179 Cb -0.26 -2.03 0.01 0.00 0.04 0.00 0.00 34.50 32.25 1iam s PRO 179 CO 0.31 -0.90 -0.20 -0.47 0.04 0.00 0.00 177.00 175.78 1iam s TYR 180 N -3.24 2.72 -0.19 0.56 5.04 0.53 -4.91 117.35 117.86 1iam s TYR 180 Ca 0.57 -1.30 -0.09 0.00 -2.44 0.00 0.00 57.07 53.81 1iam s TYR 180 Cb -0.12 -1.85 -0.05 0.00 0.35 0.00 0.00 41.96 40.29 1iam s TYR 180 CO 0.53 -0.60 0.10 -0.65 -1.34 0.00 0.00 175.55 173.59 1iam s GLN 181 N 0.89 4.08 -0.40 4.97 -0.21 -1.26 -0.14 119.66 127.58 1iam s GLN 181 Ca -0.05 -0.27 -0.24 0.00 0.02 0.00 0.00 55.36 54.82 1iam s GLN 181 Cb -0.15 -3.32 0.02 0.00 1.00 0.00 0.00 33.01 30.55 1iam s GLN 181 CO -0.03 0.31 0.84 -1.17 -2.12 0.00 0.00 175.29 173.12 1iam s LEU 182 N 0.31 4.10 -0.41 2.90 0.20 -1.09 -4.84 118.68 119.85 1iam s LEU 182 Ca 0.06 0.27 -0.11 0.00 0.69 0.00 0.00 54.13 55.04 1iam s LEU 182 Cb -0.12 -3.09 0.06 0.00 -0.43 0.00 0.00 46.19 42.61 1iam s LEU 182 CO -0.01 -0.86 0.27 -1.10 -0.29 0.00 0.00 176.35 174.36 1iam s GLN 183 N 3.34 2.73 0.68 1.98 -1.52 0.05 -4.40 119.66 122.53 1iam s GLN 183 Ca 0.34 -1.33 -0.01 0.00 -1.95 0.00 0.00 55.36 52.41 1iam s GLN 183 Cb -0.12 -3.83 0.14 0.00 -0.22 0.00 0.00 33.01 28.98 1iam s GLN 183 CO 0.20 -0.89 0.94 -2.37 -0.25 0.00 0.00 175.29 172.92 1iam n THR 184 N 4.99 0.00 -0.79 -0.19 5.66 -1.26 -0.52 114.28 122.17 1iam n THR 184 Ca -0.11 -1.41 0.00 0.00 -3.05 0.00 0.00 64.05 59.48 1iam n THR 184 Cb 0.44 -0.97 0.00 0.00 -1.55 0.00 0.00 70.33 68.25 1iam n THR 184 CO 0.00 0.00 0.00 0.49 -3.05 0.00 0.00 175.07 172.51