#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ibn n ASP 38 N 0.00 3.01 -0.05 4.04 8.00 -1.26 -4.93 116.55 125.36 2ibn n ASP 38 Ca 0.00 0.00 -0.16 0.00 0.71 0.00 0.00 54.79 55.34 2ibn n ASP 38 Cb 0.00 0.75 -0.06 0.00 -0.02 0.00 0.00 41.12 41.79 2ibn n ASP 38 CO 0.00 0.00 0.00 -0.09 -0.39 0.00 0.00 177.20 176.72 2ibn h ARG 39 N 0.00 0.73 -0.13 -1.24 2.43 -1.99 -0.55 114.38 113.63 2ibn h ARG 39 Ca -0.20 -0.53 0.03 0.00 -0.81 0.00 0.00 59.98 58.47 2ibn h ARG 39 Cb 1.41 0.09 -0.04 0.00 -0.42 0.00 0.00 29.97 31.02 2ibn h ARG 39 CO 0.01 1.15 -0.09 0.28 -1.51 0.00 0.00 179.97 179.81 2ibn h VAL 40 N 0.44 0.74 -0.15 0.20 2.07 -1.89 0.58 116.25 118.23 2ibn h VAL 40 Ca -0.02 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.54 2ibn h VAL 40 Cb 1.20 0.74 -0.03 0.00 -1.52 0.00 0.00 31.29 31.67 2ibn h VAL 40 CO 0.12 0.00 -0.07 0.15 0.02 0.00 0.00 177.57 177.80 2ibn h PHE 41 N -0.09 -0.15 -0.96 1.57 3.57 -1.88 -2.24 116.94 116.77 2ibn h PHE 41 Ca 0.08 0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.62 2ibn h PHE 41 Cb 0.21 0.09 -0.05 0.00 2.79 0.00 0.00 35.95 38.99 2ibn h PHE 41 CO -0.21 -0.11 0.63 1.15 -2.23 0.00 0.00 178.31 177.54 2ibn h THR 42 N -0.05 1.19 -0.37 4.41 2.02 -0.88 0.12 112.91 119.36 2ibn h THR 42 Ca 0.08 -0.42 0.05 0.00 0.77 0.00 0.00 66.41 66.88 2ibn h THR 42 Cb 0.17 -0.15 -0.04 0.00 -1.74 0.00 0.00 68.15 66.38 2ibn h THR 42 CO -0.18 0.23 0.11 0.74 0.37 0.00 0.00 175.52 176.79 2ibn h THR 43 N 1.24 0.87 -0.11 3.16 2.02 -0.60 -1.97 112.91 117.52 2ibn h THR 43 Ca 0.37 -0.09 -0.16 0.00 0.77 0.00 0.00 66.41 67.30 2ibn h THR 43 Cb -0.05 0.59 -0.01 0.00 -1.74 0.00 0.00 68.15 66.94 2ibn h THR 43 CO -0.10 0.05 -0.62 1.88 0.37 0.00 0.00 175.52 177.10 2ibn h TYR 44 N 0.26 0.50 -0.22 3.16 0.05 -0.80 -3.17 116.97 116.75 2ibn h TYR 44 Ca 0.17 -0.20 0.02 0.00 0.05 0.00 0.00 58.73 58.78 2ibn h TYR 44 Cb 0.16 -0.09 -0.02 0.00 1.01 0.00 0.00 36.73 37.79 2ibn h TYR 44 CO -0.16 0.91 0.08 -0.22 -1.05 0.00 0.00 178.16 177.72 2ibn h LYS 45 N 0.29 0.18 -0.84 4.88 3.64 -0.55 0.17 116.57 124.34 2ibn h LYS 45 Ca -0.01 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 2ibn h LYS 45 Cb 1.16 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.93 2ibn h LYS 45 CO 0.11 0.12 0.00 1.28 -2.27 0.00 0.00 179.45 178.69 2ibn n LEU 46 N -5.03 0.29 0.00 5.20 4.77 -0.76 -1.75 117.00 119.72 2ibn n LEU 46 Ca -0.02 -0.14 0.00 0.00 -0.03 0.00 0.00 56.01 55.81 2ibn n LEU 46 Cb 0.08 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 2ibn n LEU 46 CO 0.30 0.06 0.00 1.41 -1.33 0.00 0.00 177.39 177.83 2ibn n HIS 48 N 0.62 0.00 -0.04 -1.77 8.25 0.59 -1.62 115.22 121.26 2ibn n HIS 48 Ca 0.00 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.31 2ibn n HIS 48 Cb 0.06 0.00 -0.13 0.00 1.12 0.00 0.00 29.99 31.04 2ibn n HIS 48 CO 0.00 0.00 0.00 1.15 0.64 0.00 0.00 176.34 178.13 2ibn h THR 49 N 0.00 1.68 0.00 1.59 2.02 -1.46 -3.39 112.91 113.35 2ibn h THR 49 Ca 0.00 -2.24 0.00 0.00 0.77 0.00 0.00 66.41 64.94 2ibn h THR 49 Cb 0.00 3.18 0.00 0.00 -1.74 0.00 0.00 68.15 69.59 2ibn h THR 49 CO 0.00 0.60 -1.69 1.41 0.37 0.00 0.00 175.52 176.21 2ibn n HIS 50 N -4.52 0.08 -2.63 3.16 -0.00 -0.64 -4.10 115.22 106.57 2ibn n HIS 50 Ca -0.11 0.02 -0.42 0.00 -0.00 0.00 0.00 57.72 57.22 2ibn n HIS 50 Cb 0.53 -0.44 -0.03 0.00 -0.00 0.00 0.00 29.99 30.06 2ibn n HIS 50 CO 0.00 0.00 0.00 -0.65 -0.00 0.00 0.00 176.34 175.69 2ibn s GLN 51 N -3.40 3.61 0.45 -0.41 -1.52 -1.26 -4.75 119.66 112.39 2ibn s GLN 51 Ca -0.04 -1.29 0.08 0.00 -1.95 0.00 0.00 55.36 52.15 2ibn s GLN 51 Cb 0.14 -5.28 0.00 0.00 -0.22 0.00 0.00 33.01 27.65 2ibn s GLN 51 CO 0.89 -2.13 0.46 0.95 -0.25 0.00 0.00 175.29 175.21 2ibn s THR 52 N 4.48 2.50 0.13 -0.19 -4.23 -1.26 -4.94 115.64 112.13 2ibn s THR 52 Ca 0.44 -1.28 -0.28 0.00 -1.18 0.00 0.00 61.69 59.39 2ibn s THR 52 Cb -0.01 -2.78 -0.06 0.00 1.34 0.00 0.00 72.50 71.00 2ibn s THR 52 CO -0.09 0.00 1.60 0.58 -0.54 0.00 0.00 174.62 176.17 2ibn h VAL 53 N 0.83 0.22 -0.73 2.29 2.07 -1.93 -1.58 116.25 117.44 2ibn h VAL 53 Ca -0.39 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.24 2ibn h VAL 53 Cb 1.28 0.22 -0.08 0.00 -1.52 0.00 0.00 31.29 31.19 2ibn h VAL 53 CO 0.54 0.00 0.34 0.44 0.02 0.00 0.00 177.57 178.91 2ibn h ASP 54 N -0.51 0.40 -0.46 0.57 3.32 -1.97 -1.24 116.42 116.53 2ibn h ASP 54 Ca 0.06 0.08 0.02 0.00 0.02 0.00 0.00 57.03 57.20 2ibn h ASP 54 Cb 0.60 0.02 -0.03 0.00 0.22 0.00 0.00 39.33 40.14 2ibn h ASP 54 CO -0.31 0.21 0.28 0.15 -1.72 0.00 0.00 179.24 177.85 2ibn h PHE 55 N 0.55 0.53 -0.30 4.55 3.57 -1.79 0.11 116.94 124.15 2ibn h PHE 55 Ca 0.38 0.02 -0.13 0.00 3.53 0.00 0.00 57.97 61.76 2ibn h PHE 55 Cb 0.47 -0.17 -0.00 0.00 2.79 0.00 0.00 35.95 39.03 2ibn h PHE 55 CO -0.13 0.31 -0.32 0.28 -2.23 0.00 0.00 178.31 176.23 2ibn h VAL 56 N 0.57 1.30 -0.79 1.41 2.07 -0.76 -1.55 116.25 118.50 2ibn h VAL 56 Ca 0.18 -1.49 -0.01 0.00 0.82 0.00 0.00 66.70 66.20 2ibn h VAL 56 Cb -0.01 1.55 -0.04 0.00 -1.52 0.00 0.00 31.29 31.27 2ibn h VAL 56 CO -0.07 0.48 0.45 0.03 0.02 0.00 0.00 177.57 178.48 2ibn h ARG 57 N 0.51 1.09 -0.87 1.57 3.08 -0.97 -0.31 114.38 118.47 2ibn h ARG 57 Ca 0.05 -0.12 0.04 0.00 0.07 0.00 0.00 59.98 60.02 2ibn h ARG 57 Cb 0.89 -0.22 -0.05 0.00 0.08 0.00 0.00 29.97 30.68 2ibn h ARG 57 CO 0.08 0.79 0.57 0.77 -1.07 0.00 0.00 179.97 181.11 2ibn h SER 58 N 1.09 0.93 0.48 7.04 0.02 -0.44 -2.15 113.55 120.52 2ibn h SER 58 Ca 0.28 -0.01 -0.21 0.00 -0.84 0.00 0.00 61.79 61.01 2ibn h SER 58 Cb 0.01 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.33 2ibn h SER 58 CO -0.05 0.64 -0.91 0.11 -1.14 0.00 0.00 176.83 175.48 2ibn h LYS 59 N 1.08 0.28 -0.85 3.45 1.79 -0.39 -0.55 116.57 121.38 2ibn h LYS 59 Ca 0.35 -0.31 -0.01 0.00 -2.18 0.00 0.00 60.65 58.50 2ibn h LYS 59 Cb 0.04 0.09 -0.04 0.00 -1.58 0.00 0.00 32.23 30.74 2ibn h LYS 59 CO -0.11 1.02 0.48 0.45 -1.08 0.00 0.00 179.45 180.21 2ibn h HIS 60 N 0.16 1.15 -0.17 -1.35 3.86 -0.82 -1.53 115.15 116.45 2ibn h HIS 60 Ca -0.06 -0.02 -0.07 0.00 -1.16 0.00 0.00 60.37 59.06 2ibn h HIS 60 Cb 1.54 -0.37 -0.00 0.00 1.06 0.00 0.00 27.41 29.64 2ibn h HIS 60 CO 0.04 0.79 -0.17 0.00 0.86 0.00 0.00 177.93 179.45 2ibn h ALA 61 N 1.34 0.25 -1.00 2.45 0.00 -1.18 -1.42 119.26 119.69 2ibn h ALA 61 Ca 0.30 -0.34 0.02 0.00 0.00 0.00 0.00 54.91 54.89 2ibn h ALA 61 Cb 0.01 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 17.69 2ibn h ALA 61 CO -0.05 0.16 0.66 0.37 0.00 0.00 0.00 179.25 180.39 2ibn h GLN 62 N 0.06 1.28 -0.02 0.00 4.15 -0.88 -3.06 115.11 116.64 2ibn h GLN 62 Ca 0.03 -0.08 0.00 0.00 0.77 0.00 0.00 58.65 59.37 2ibn h GLN 62 Cb 0.71 -0.29 0.00 0.00 0.21 0.00 0.00 27.48 28.11 2ibn h GLN 62 CO 0.04 0.85 -0.19 1.19 -1.93 0.00 0.00 178.83 178.79 2ibn n PHE 63 N -4.40 0.00 0.94 3.99 3.72 -0.60 -4.56 117.46 116.55 2ibn n PHE 63 Ca 0.13 0.00 0.10 0.00 -0.05 0.00 0.00 57.45 57.63 2ibn n PHE 63 Cb 0.05 0.00 0.52 0.00 -0.94 0.00 0.00 39.48 39.10 2ibn n PHE 63 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2ibn n GLY 64 N 1.11 -1.05 0.05 1.37 0.00 -0.53 -2.59 105.19 103.54 2ibn n GLY 64 Ca 0.09 -0.09 0.11 0.00 0.00 0.00 0.00 46.02 46.12 2ibn n GLY 64 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ibn n GLY 65 N 0.57 -1.24 3.64 -0.02 0.00 -1.26 -5.02 105.19 101.86 2ibn n GLY 65 Ca 0.09 -0.38 -0.20 0.00 0.00 0.00 0.00 46.02 45.52 2ibn n GLY 65 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2ibn n PHE 66 N -2.20 -1.98 -1.24 1.61 3.72 -1.07 -4.92 117.46 111.39 2ibn n PHE 66 Ca 0.00 0.86 0.08 0.00 -0.05 0.00 0.00 57.45 58.35 2ibn n PHE 66 Cb 0.49 -4.54 0.12 0.00 -0.94 0.00 0.00 39.48 34.61 2ibn n PHE 66 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 2ibn n SER 67 N -3.07 1.95 0.08 4.37 3.41 -1.14 -3.85 113.62 115.38 2ibn n SER 67 Ca -0.30 -2.94 -0.22 0.00 -0.26 0.00 0.00 58.87 55.16 2ibn n SER 67 Cb 0.68 -0.40 -0.13 0.00 -0.26 0.00 0.00 64.21 64.10 2ibn n SER 67 CO 0.00 0.00 0.00 1.88 -0.16 0.00 0.00 175.04 176.76 2ibn h TYR 68 N 0.04 1.02 -2.51 7.33 -1.99 -1.26 -3.48 116.97 116.12 2ibn h TYR 68 Ca -0.00 -0.63 -0.09 0.00 2.00 0.00 0.00 58.73 60.01 2ibn h TYR 68 Cb 1.07 -0.09 -0.21 0.00 2.00 0.00 0.00 36.73 39.50 2ibn h TYR 68 CO 0.04 1.47 -0.08 0.21 -0.00 0.00 0.00 178.16 179.80 2ibn s LYS 69 N -3.03 0.73 -0.14 4.88 2.20 -0.79 -5.01 119.74 118.58 2ibn s LYS 69 Ca -0.10 0.39 -0.04 0.00 -0.36 0.00 0.00 55.97 55.87 2ibn s LYS 69 Cb 0.06 0.34 -0.03 0.00 -1.51 0.00 0.00 37.83 36.69 2ibn s LYS 69 CO 0.93 -0.16 -0.01 0.15 -0.36 0.00 0.00 175.35 175.90 2ibn s LYS 70 N -0.46 3.55 0.34 4.03 -0.14 -1.26 -0.73 119.74 125.06 2ibn s LYS 70 Ca -0.06 -0.46 0.07 0.00 -1.36 0.00 0.00 55.97 54.17 2ibn s LYS 70 Cb -0.03 -2.94 -0.03 0.00 -1.68 0.00 0.00 37.83 33.15 2ibn s LYS 70 CO 0.04 0.37 0.28 0.95 -0.76 0.00 0.00 175.35 176.23 2ibn s THR 72 N 0.04 3.51 -0.25 2.17 -4.23 -1.26 -4.90 115.64 110.71 2ibn s THR 72 Ca 0.02 -1.39 0.00 0.00 -1.18 0.00 0.00 61.69 59.14 2ibn s THR 72 Cb -0.13 -3.18 0.00 0.00 1.34 0.00 0.00 72.50 70.53 2ibn s THR 72 CO 0.02 -0.18 0.00 0.52 -0.54 0.00 0.00 174.62 174.45 2ibn n VAL 73 N -1.36 0.00 0.00 2.29 0.31 -1.26 -1.95 118.33 116.36 2ibn n VAL 73 Ca -0.02 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.31 2ibn n VAL 73 Cb 0.60 -0.21 0.00 0.00 -0.91 0.00 0.00 33.84 33.32 2ibn n VAL 73 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2ibn n GLU 75 N 0.64 0.00 0.02 5.55 1.02 -1.26 -1.26 120.64 125.35 2ibn n GLU 75 Ca 0.00 0.00 -0.12 0.00 -0.02 0.00 0.00 57.16 57.02 2ibn n GLU 75 Cb 0.00 0.00 -0.06 0.00 -0.02 0.00 0.00 31.44 31.36 2ibn n GLU 75 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2ibn h ALA 76 N 0.00 0.06 -0.35 0.62 0.00 -1.82 0.92 119.26 118.68 2ibn h ALA 76 Ca 0.00 -0.03 0.07 0.00 0.00 0.00 0.00 54.91 54.96 2ibn h ALA 76 Cb 0.00 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 17.70 2ibn h ALA 76 CO 0.00 -0.42 -0.13 0.28 0.00 0.00 0.00 179.25 178.97 2ibn h VAL 77 N 0.02 0.55 -0.02 0.00 2.07 -1.47 -2.68 116.25 114.72 2ibn h VAL 77 Ca 0.02 0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.45 2ibn h VAL 77 Cb 0.04 0.55 -0.01 0.00 -1.52 0.00 0.00 31.29 30.35 2ibn h VAL 77 CO -0.00 0.00 -0.38 0.44 0.02 0.00 0.00 177.57 177.65 2ibn h ASP 78 N -0.07 0.05 -0.21 0.57 3.32 -1.77 -2.73 116.42 115.59 2ibn h ASP 78 Ca 0.18 -0.02 -0.03 0.00 0.02 0.00 0.00 57.03 57.18 2ibn h ASP 78 Cb 0.33 -0.01 -0.02 0.00 0.22 0.00 0.00 39.33 39.85 2ibn h ASP 78 CO -0.40 0.42 0.06 -0.07 -1.72 0.00 0.00 179.24 177.53 2ibn h LEU 79 N 0.04 0.38 -0.08 1.55 3.38 -0.48 -2.06 115.31 118.04 2ibn h LEU 79 Ca 0.00 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.93 2ibn h LEU 79 Cb 0.69 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.34 2ibn h LEU 79 CO 0.05 0.40 0.00 0.18 0.09 0.00 0.00 178.44 179.16 2ibn n LEU 80 N -4.36 0.12 -0.29 1.67 4.77 -1.03 -2.44 117.00 115.44 2ibn n LEU 80 Ca 0.01 -0.05 0.16 0.00 -0.03 0.00 0.00 56.01 56.11 2ibn n LEU 80 Cb 0.18 -0.00 0.43 0.00 -2.33 0.00 0.00 43.42 41.69 2ibn n LEU 80 CO 0.37 0.02 1.22 0.44 -1.33 0.00 0.00 177.39 178.11 2ibn h ASP 81 N 0.18 0.58 -1.85 -1.43 3.32 -1.42 -2.90 116.42 112.90 2ibn h ASP 81 Ca 0.00 0.06 -0.75 0.00 0.02 0.00 0.00 57.03 56.36 2ibn h ASP 81 Cb 0.04 -0.05 -0.27 0.00 0.22 0.00 0.00 39.33 39.27 2ibn h ASP 81 CO 0.00 0.23 1.03 0.61 -1.72 0.00 0.00 179.24 179.40 2ibn n GLY 82 N -1.44 5.55 3.06 2.75 0.00 -1.02 -4.67 105.19 109.42 2ibn n GLY 82 Ca 0.20 -2.45 -0.12 0.00 0.00 0.00 0.00 46.02 43.65 2ibn n GLY 82 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2ibn s LEU 83 N -4.02 -0.39 -0.19 0.99 2.96 -1.11 -5.00 118.68 111.93 2ibn s LEU 83 Ca 0.54 0.67 -0.07 0.00 -0.22 0.00 0.00 54.13 55.04 2ibn s LEU 83 Cb 0.45 0.86 -0.04 0.00 0.50 0.00 0.00 46.19 47.96 2ibn s LEU 83 CO -0.36 -0.24 0.06 -0.69 -1.32 0.00 0.00 176.35 173.80 2ibn s VAL 84 N 2.47 4.68 -0.33 1.68 1.01 -1.26 -1.37 120.40 127.27 2ibn s VAL 84 Ca 0.01 -0.07 -0.29 0.00 0.00 0.00 0.00 61.98 61.63 2ibn s VAL 84 Cb -0.12 -3.11 0.01 0.00 0.00 0.00 0.00 36.38 33.16 2ibn s VAL 84 CO -0.10 0.45 1.19 -0.62 0.00 0.00 0.00 175.10 176.02 2ibn s ASP 85 N 0.53 6.76 0.00 3.32 -1.08 -1.26 -4.91 116.67 120.03 2ibn s ASP 85 Ca 0.03 1.03 0.28 0.00 -0.52 0.00 0.00 52.55 53.38 2ibn s ASP 85 Cb -0.13 -2.54 1.60 0.00 -1.46 0.00 0.00 42.92 40.39 2ibn s ASP 85 CO 0.01 -1.03 2.04 -0.62 0.52 0.00 0.00 175.17 176.09 2ibn n GLU 86 N 7.23 1.11 0.00 4.34 1.02 -1.26 -3.06 120.64 130.02 2ibn n GLU 86 Ca 0.13 -0.16 0.12 0.00 -0.02 0.00 0.00 57.16 57.23 2ibn n GLU 86 Cb 0.47 -1.45 0.08 0.00 -0.02 0.00 0.00 31.44 30.52 2ibn n GLU 86 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 2ibn n SER 87 N -0.77 1.95 0.00 1.62 3.41 -1.26 -3.24 113.62 115.34 2ibn n SER 87 Ca 0.21 -1.46 0.00 0.00 -0.26 0.00 0.00 58.87 57.36 2ibn n SER 87 Cb 0.14 0.37 0.00 0.00 -0.26 0.00 0.00 64.21 64.46 2ibn n SER 87 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 2ibn n ASP 88 N 0.01 0.00 0.00 4.04 5.68 -1.17 -4.90 116.55 120.21 2ibn n ASP 88 Ca 0.10 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.39 2ibn n ASP 88 Cb 0.46 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.44 2ibn n ASP 88 CO 0.00 0.00 0.00 -0.67 -1.33 0.00 0.00 177.20 175.20 2ibn n ASP 92 N 0.00 0.00 -4.94 -1.12 -0.08 -1.26 -5.05 116.55 104.10 2ibn n ASP 92 Ca 0.00 0.00 -0.24 0.00 -1.51 0.00 0.00 54.79 53.04 2ibn n ASP 92 Cb 0.00 0.00 0.03 0.00 2.34 0.00 0.00 41.12 43.49 2ibn n ASP 92 CO 0.00 0.00 0.00 0.72 0.12 0.00 0.00 177.20 178.04 2ibn s PHE 93 N -2.00 3.13 0.32 -0.67 -0.71 -1.26 -4.98 117.98 111.82 2ibn s PHE 93 Ca 0.00 0.34 -0.29 0.00 -1.04 0.00 0.00 56.93 55.94 2ibn s PHE 93 Cb 0.00 -2.62 -0.12 0.00 -1.21 0.00 0.00 43.02 39.07 2ibn s PHE 93 CO 0.00 -0.71 1.39 -2.30 -1.34 0.00 0.00 175.22 172.26 2ibn n PRO 94 N -2.37 2.28 0.33 1.99 -0.02 -1.26 -4.71 135.00 131.24 2ibn n PRO 94 Ca 0.04 0.81 0.21 0.00 -2.02 0.00 0.00 63.50 62.53 2ibn n PRO 94 Cb 0.58 -2.46 1.12 0.00 -0.02 0.00 0.00 33.50 32.73 2ibn n PRO 94 CO 0.00 0.00 0.00 -0.97 1.98 0.00 0.00 175.50 176.51 2ibn h ASN 95 N 3.29 0.00 -0.99 2.55 -1.24 -1.19 -2.28 115.58 115.73 2ibn h ASN 95 Ca -0.47 0.00 0.01 0.00 0.71 0.00 0.00 56.30 56.55 2ibn h ASN 95 Cb 1.27 0.00 -0.05 0.00 0.73 0.00 0.00 38.32 40.27 2ibn h ASN 95 CO 0.68 0.00 0.65 0.77 -1.29 0.00 0.00 177.43 178.25 2ibn h SER 96 N 0.00 1.13 -0.86 1.15 4.64 -1.78 -2.16 113.55 115.68 2ibn h SER 96 Ca -0.00 -0.03 -0.03 0.00 -0.47 0.00 0.00 61.79 61.26 2ibn h SER 96 Cb 0.03 -0.28 -0.04 0.00 -0.31 0.00 0.00 62.40 61.80 2ibn h SER 96 CO 0.00 0.82 0.42 -0.26 -0.87 0.00 0.00 176.83 176.94 2ibn h PHE 97 N 1.34 1.23 -0.77 4.77 0.04 -1.74 -2.30 116.94 119.51 2ibn h PHE 97 Ca 0.36 -0.06 0.04 0.00 2.80 0.00 0.00 57.97 61.11 2ibn h PHE 97 Cb -0.15 -0.38 -0.04 0.00 2.20 0.00 0.00 35.95 37.57 2ibn h PHE 97 CO -0.00 0.88 0.51 1.25 -0.60 0.00 0.00 178.31 180.35 2ibn h HIS 98 N 1.23 0.90 0.20 -0.55 2.76 -1.50 -0.15 115.15 118.05 2ibn h HIS 98 Ca 0.30 0.02 0.01 0.00 -2.20 0.00 0.00 60.37 58.50 2ibn h HIS 98 Cb 0.11 -0.30 -0.02 0.00 1.55 0.00 0.00 27.41 28.74 2ibn h HIS 98 CO 0.01 0.52 -0.22 0.00 -1.30 0.00 0.00 177.93 176.94 2ibn h ALA 99 N 1.55 -0.44 -0.35 5.26 0.00 -0.89 -1.10 119.26 123.29 2ibn h ALA 99 Ca 0.31 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.15 2ibn h ALA 99 Cb 0.07 0.33 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 2ibn h ALA 99 CO -0.09 -0.78 0.20 0.74 0.00 0.00 0.00 179.25 179.31 2ibn h PHE 100 N -0.47 0.48 -0.34 0.00 0.04 -1.42 -1.93 116.94 113.31 2ibn h PHE 100 Ca 0.00 -0.01 0.06 0.00 2.80 0.00 0.00 57.97 60.82 2ibn h PHE 100 Cb 0.45 -0.15 -0.05 0.00 2.20 0.00 0.00 35.95 38.39 2ibn h PHE 100 CO -0.17 0.38 0.01 1.96 -0.60 0.00 0.00 178.31 179.89 2ibn h GLN 101 N 0.45 0.11 -0.20 1.51 4.20 -0.93 0.63 115.11 120.87 2ibn h GLN 101 Ca 0.12 -0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.82 2ibn h GLN 101 Cb 0.05 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.80 2ibn h GLN 101 CO -0.02 0.07 0.10 1.15 -0.67 0.00 0.00 178.83 179.46 2ibn h THR 102 N 0.11 1.14 -0.81 -0.54 2.02 -1.15 -0.76 112.91 112.91 2ibn h THR 102 Ca 0.16 -0.39 0.02 0.00 0.77 0.00 0.00 66.41 66.97 2ibn h THR 102 Cb 0.22 1.02 -0.05 0.00 -1.74 0.00 0.00 68.15 67.60 2ibn h THR 102 CO -0.26 0.13 0.53 0.00 0.37 0.00 0.00 175.52 176.28 2ibn h ALA 103 N 0.96 1.05 -0.01 6.16 0.00 -1.13 -1.85 119.26 124.44 2ibn h ALA 103 Ca 0.07 -0.04 -0.13 0.00 0.00 0.00 0.00 54.91 54.80 2ibn h ALA 103 Cb 0.12 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 2ibn h ALA 103 CO -0.01 0.38 -0.62 0.93 0.00 0.00 0.00 179.25 179.94 2ibn h GLU 104 N 1.05 0.04 -0.23 0.00 4.39 -0.60 -0.71 114.58 118.52 2ibn h GLU 104 Ca 0.31 -0.03 -0.05 0.00 0.34 0.00 0.00 59.36 59.93 2ibn h GLU 104 Cb -0.05 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.60 2ibn h GLU 104 CO -0.09 0.65 -0.06 0.78 -1.16 0.00 0.00 179.01 179.13 2ibn h GLY 105 N 1.79 0.49 1.01 -3.84 0.00 -0.63 -1.90 103.07 99.98 2ibn h GLY 105 Ca -0.01 -0.40 0.00 0.00 0.00 0.00 0.00 47.33 46.92 2ibn h GLY 105 CO 0.08 0.37 0.46 -2.22 0.00 0.00 0.00 176.54 175.23 2ibn h ILE 106 N 0.18 1.19 -0.44 2.60 2.04 -1.27 -2.90 117.51 118.92 2ibn h ILE 106 Ca 0.06 -0.38 -0.05 0.00 1.00 0.00 0.00 64.86 65.49 2ibn h ILE 106 Cb 0.52 0.15 -0.02 0.00 -0.74 0.00 0.00 36.82 36.73 2ibn h ILE 106 CO 0.02 0.19 0.07 -0.09 0.00 0.00 0.00 178.15 178.34 2ibn h ARG 107 N 0.98 0.67 -0.66 2.37 2.43 -1.00 0.18 114.38 119.35 2ibn h ARG 107 Ca 0.26 -0.14 -0.09 0.00 -0.81 0.00 0.00 59.98 59.21 2ibn h ARG 107 Cb -0.08 -0.10 -0.03 0.00 -0.42 0.00 0.00 29.97 29.34 2ibn h ARG 107 CO -0.05 0.65 0.07 -0.22 -1.51 0.00 0.00 179.97 178.90 2ibn h LYS 108 N 0.65 1.11 0.00 0.20 3.64 -1.18 -2.78 116.57 118.22 2ibn h LYS 108 Ca 0.14 -0.32 0.00 0.00 -1.27 0.00 0.00 60.65 59.20 2ibn h LYS 108 Cb 0.31 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.01 2ibn h LYS 108 CO 0.00 1.04 -0.87 0.00 -2.27 0.00 0.00 179.45 177.36 2ibn h ALA 109 N 1.03 0.51 -1.91 5.00 0.00 -1.25 -3.39 119.26 119.25 2ibn h ALA 109 Ca 0.20 0.00 -0.48 0.00 0.00 0.00 0.00 54.91 54.62 2ibn h ALA 109 Cb 0.49 0.00 -0.39 0.00 0.00 0.00 0.00 17.79 17.89 2ibn h ALA 109 CO 0.02 0.00 -1.15 0.72 0.00 0.00 0.00 179.25 178.84 2ibn n HIS 110 N -2.39 -0.07 0.05 0.00 8.25 0.58 -5.02 115.22 116.62 2ibn n HIS 110 Ca 0.01 -3.69 0.01 0.00 -0.26 0.00 0.00 57.72 53.80 2ibn n HIS 110 Cb 0.50 -0.31 0.36 0.00 1.12 0.00 0.00 29.99 31.65 2ibn n HIS 110 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 2ibn h PRO 111 N 3.19 0.40 -0.07 -0.41 0.11 -1.70 -1.84 132.00 131.68 2ibn h PRO 111 Ca 0.08 -0.08 0.00 0.00 0.11 0.00 0.00 66.00 66.12 2ibn h PRO 111 Cb 0.96 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.01 2ibn h PRO 111 CO 0.48 0.45 0.00 -0.40 -0.21 0.00 0.00 178.00 178.32 2ibn n ASP 112 N -4.31 1.40 -4.17 -2.05 5.75 -1.26 -4.62 116.55 107.29 2ibn n ASP 112 Ca 0.01 -1.54 -0.42 0.00 -0.01 0.00 0.00 54.79 52.83 2ibn n ASP 112 Cb 0.23 -0.04 -0.02 0.00 -1.03 0.00 0.00 41.12 40.27 2ibn n ASP 112 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 2ibn n LYS 113 N 0.11 3.46 -0.30 0.11 4.76 -0.69 -4.92 118.16 120.69 2ibn n LYS 113 Ca 0.18 -4.49 -0.05 0.00 -2.87 0.00 0.00 58.31 51.07 2ibn n LYS 113 Cb 0.32 -2.49 0.07 0.00 -1.84 0.00 0.00 35.03 31.08 2ibn n LYS 113 CO 0.00 0.00 0.00 0.38 -1.37 0.00 0.00 177.40 176.41 2ibn h ASP 114 N 6.12 1.11 -0.28 4.39 2.03 -1.83 -1.22 116.42 126.74 2ibn h ASP 114 Ca 0.18 -0.16 0.08 0.00 -0.73 0.00 0.00 57.03 56.40 2ibn h ASP 114 Cb 0.79 -0.29 -0.01 0.00 -0.83 0.00 0.00 39.33 38.99 2ibn h ASP 114 CO 1.03 0.97 0.21 4.11 -1.03 0.00 0.00 179.24 184.53 2ibn h TRP 115 N 1.19 0.00 0.14 4.15 5.08 -1.97 -2.09 115.95 122.44 2ibn h TRP 115 Ca 0.28 0.00 -0.29 0.00 1.08 0.00 0.00 58.89 59.96 2ibn h TRP 115 Cb 0.18 0.00 0.02 0.00 -3.00 0.00 0.00 29.16 26.36 2ibn h TRP 115 CO 0.02 0.00 -1.25 0.35 -1.28 0.00 0.00 178.44 176.28 2ibn h PHE 116 N 0.00 0.78 -0.72 0.12 3.57 -1.61 -1.96 116.94 117.12 2ibn h PHE 116 Ca 0.13 -0.52 0.04 0.00 3.53 0.00 0.00 57.97 61.15 2ibn h PHE 116 Cb 0.54 -0.05 -0.05 0.00 2.79 0.00 0.00 35.95 39.18 2ibn h PHE 116 CO 0.00 1.38 0.44 0.45 -2.23 0.00 0.00 178.31 178.36 2ibn h HIS 117 N 0.18 0.82 -0.19 0.41 3.86 -1.13 -2.58 115.15 116.52 2ibn h HIS 117 Ca -0.17 0.02 -0.10 0.00 -1.16 0.00 0.00 60.37 58.96 2ibn h HIS 117 Cb 1.94 -0.27 -0.01 0.00 1.06 0.00 0.00 27.41 30.13 2ibn h HIS 117 CO 0.09 0.45 -0.32 1.25 0.86 0.00 0.00 177.93 180.26 2ibn h LEU 118 N 0.84 0.39 -0.79 2.43 5.85 -1.27 -2.14 115.31 120.62 2ibn h LEU 118 Ca 0.30 -0.14 0.08 0.00 0.84 0.00 0.00 57.88 58.96 2ibn h LEU 118 Cb 0.08 -0.11 -0.07 0.00 0.37 0.00 0.00 40.66 40.94 2ibn h LEU 118 CO -0.14 0.70 0.45 0.58 -0.34 0.00 0.00 178.44 179.69 2ibn h VAL 119 N 0.33 0.94 -0.45 1.05 2.07 -0.97 -0.19 116.25 119.04 2ibn h VAL 119 Ca 0.04 -0.27 0.09 0.00 0.82 0.00 0.00 66.70 67.38 2ibn h VAL 119 Cb 0.73 0.09 -0.08 0.00 -1.52 0.00 0.00 31.29 30.51 2ibn h VAL 119 CO 0.06 0.14 -0.06 1.23 0.02 0.00 0.00 177.57 178.96 2ibn h GLY 120 N 0.78 0.39 1.18 2.17 0.00 -1.15 -0.96 103.07 105.48 2ibn h GLY 120 Ca 0.37 0.10 -0.05 0.00 0.00 0.00 0.00 47.33 47.75 2ibn h GLY 120 CO -0.22 -0.15 0.21 -2.00 0.00 0.00 0.00 176.54 174.38 2ibn h LEU 121 N 0.05 0.96 0.00 3.11 5.85 -1.11 -3.27 115.31 120.90 2ibn h LEU 121 Ca 0.22 -0.17 -0.14 0.00 0.84 0.00 0.00 57.88 58.63 2ibn h LEU 121 Cb 0.33 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.09 2ibn h LEU 121 CO -0.42 0.90 -0.80 -0.07 -0.34 0.00 0.00 178.44 177.71 2ibn h LEU 122 N 0.99 0.00 -1.39 2.25 3.38 -0.74 -3.42 115.31 116.38 2ibn h LEU 122 Ca 0.22 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.16 2ibn h LEU 122 Cb 0.28 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.01 2ibn h LEU 122 CO -0.01 0.64 0.13 1.12 0.09 0.00 0.00 178.44 180.42 2ibn h HIS 123 N 0.00 0.54 -0.51 1.13 2.07 -1.23 -2.11 115.15 115.04 2ibn h HIS 123 Ca -0.04 -0.02 0.00 0.00 -2.85 0.00 0.00 60.37 57.46 2ibn h HIS 123 Cb 1.52 -0.17 0.00 0.00 2.57 0.00 0.00 27.41 31.33 2ibn h HIS 123 CO 0.00 0.45 0.00 -0.25 -3.07 0.00 0.00 177.93 175.06 2ibn n ASP 124 N -4.37 4.05 0.26 3.10 8.00 -1.26 -4.61 116.55 121.71 2ibn n ASP 124 Ca 0.02 -2.38 0.16 0.00 0.71 0.00 0.00 54.79 53.30 2ibn n ASP 124 Cb 0.16 -0.47 0.56 0.00 -0.02 0.00 0.00 41.12 41.34 2ibn n ASP 124 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 2ibn h LEU 125 N 3.16 0.00 -0.67 0.64 3.38 -1.64 -1.63 115.31 118.55 2ibn h LEU 125 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2ibn h LEU 125 Cb 1.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.96 2ibn h LEU 125 CO 0.15 0.00 0.11 0.61 0.09 0.00 0.00 178.44 179.40 2ibn n GLY 126 N 0.30 -0.60 0.00 0.83 0.00 -1.26 -1.80 105.19 102.65 2ibn n GLY 126 Ca 0.01 0.09 0.03 0.00 0.00 0.00 0.00 46.02 46.16 2ibn n GLY 126 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2ibn n LYS 127 N -1.84 0.01 0.33 1.61 5.02 -0.61 -2.22 118.16 120.45 2ibn n LYS 127 Ca -0.01 0.38 0.22 0.00 -2.02 0.00 0.00 58.31 56.88 2ibn n LYS 127 Cb 0.13 -1.50 1.16 0.00 -0.02 0.00 0.00 35.03 34.80 2ibn n LYS 127 CO 0.00 0.00 0.00 -0.39 -0.52 0.00 0.00 177.40 176.49 2ibn h VAL 128 N 0.00 0.00 -1.01 -0.18 -1.51 -1.61 -1.44 116.25 110.50 2ibn h VAL 128 Ca 0.00 0.00 0.24 0.00 -1.23 0.00 0.00 66.70 65.71 2ibn h VAL 128 Cb 0.10 0.95 -0.10 0.00 -2.13 0.00 0.00 31.29 30.10 2ibn h VAL 128 CO 0.00 0.00 0.64 -0.07 -1.23 0.00 0.00 177.57 176.91 2ibn h LEU 129 N 0.00 0.56 -0.86 4.19 3.38 -1.72 -1.14 115.31 119.71 2ibn h LEU 129 Ca 0.00 0.09 -0.08 0.00 0.09 0.00 0.00 57.88 57.98 2ibn h LEU 129 Cb 0.03 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 2ibn h LEU 129 CO 0.00 0.13 -0.01 0.00 0.09 0.00 0.00 178.44 178.65 2ibn h ALA 130 N 1.65 1.05 0.00 1.53 0.00 -1.46 -0.91 119.26 121.13 2ibn h ALA 130 Ca 0.59 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 55.22 2ibn h ALA 130 Cb 1.30 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.89 2ibn h ALA 130 CO -0.34 0.59 0.00 1.28 0.00 0.00 0.00 179.25 180.78 2ibn n LEU 131 N -4.20 0.45 -0.85 0.00 4.77 -0.49 -2.26 117.00 114.42 2ibn n LEU 131 Ca 0.02 0.59 0.09 0.00 -0.03 0.00 0.00 56.01 56.68 2ibn n LEU 131 Cb 0.32 -0.49 0.26 0.00 -2.33 0.00 0.00 43.42 41.17 2ibn n LEU 131 CO 0.42 -0.33 0.71 0.49 -1.33 0.00 0.00 177.39 177.35 2ibn n PHE 132 N -1.97 0.50 -0.03 -1.77 3.72 -0.39 -4.91 117.46 112.61 2ibn n PHE 132 Ca 0.04 -0.25 0.00 0.00 -0.05 0.00 0.00 57.45 57.19 2ibn n PHE 132 Cb 0.27 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.81 2ibn n PHE 132 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2ibn n GLY 133 N 1.28 0.72 3.74 1.37 0.00 -0.96 -5.07 105.19 106.28 2ibn n GLY 133 Ca 0.17 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.79 2ibn n GLY 133 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2ibn s GLU 134 N -0.97 4.76 0.62 1.61 0.41 -0.93 -5.02 118.70 119.18 2ibn s GLU 134 Ca 0.00 1.43 -0.16 0.00 -0.41 0.00 0.00 54.97 55.84 2ibn s GLU 134 Cb 0.00 -3.32 -0.02 0.00 -1.78 0.00 0.00 34.13 29.01 2ibn s GLU 134 CO 0.00 0.39 1.09 -1.25 -0.49 0.00 0.00 175.26 175.00 2ibn s PRO 135 N -0.66 3.09 0.47 0.39 0.04 -1.26 -4.37 135.00 132.70 2ibn s PRO 135 Ca 0.43 1.31 0.24 0.00 0.04 0.00 0.00 61.00 63.02 2ibn s PRO 135 Cb -0.24 -1.99 1.13 0.00 0.04 0.00 0.00 34.50 33.43 2ibn s PRO 135 CO 0.30 -1.01 1.94 1.96 0.04 0.00 0.00 177.00 180.23 2ibn h GLN 136 N 0.31 0.00 0.00 4.56 4.20 -1.96 0.34 115.11 122.56 2ibn h GLN 136 Ca -0.47 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.24 2ibn h GLN 136 Cb 1.23 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.01 2ibn h GLN 136 CO 0.56 0.21 0.00 -2.67 -0.67 0.00 0.00 178.83 176.26 2ibn n TRP 137 N -3.61 0.18 -0.47 2.96 4.27 -1.26 -0.51 117.44 119.00 2ibn n TRP 137 Ca -0.01 0.08 0.08 0.00 -3.89 0.00 0.00 57.50 53.76 2ibn n TRP 137 Cb 0.34 -0.62 0.26 0.00 -1.36 0.00 0.00 31.31 29.93 2ibn n TRP 137 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 2ibn n ALA 138 N -1.56 2.60 0.04 -1.67 0.00 0.11 -4.73 120.51 115.30 2ibn n ALA 138 Ca 0.02 -1.48 0.00 0.00 0.00 0.00 0.00 53.44 51.98 2ibn n ALA 138 Cb 0.14 -0.74 0.00 0.00 0.00 0.00 0.00 19.45 18.86 2ibn n ALA 138 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2ibn n VAL 139 N 0.76 0.05 -3.63 0.00 0.31 -0.60 -4.00 118.33 111.22 2ibn n VAL 139 Ca 0.20 0.02 -0.22 0.00 -0.01 0.00 0.00 64.34 64.32 2ibn n VAL 139 Cb 0.67 -0.64 -0.02 0.00 -0.91 0.00 0.00 33.84 32.94 2ibn n VAL 139 CO 0.00 0.00 0.00 0.68 -1.32 0.00 0.00 176.83 176.19 2ibn s VAL 140 N -2.00 2.37 0.00 2.52 -7.23 0.33 -1.05 120.40 115.34 2ibn s VAL 140 Ca 0.00 -1.37 0.00 0.00 -1.81 0.00 0.00 61.98 58.80 2ibn s VAL 140 Cb 0.00 -2.74 0.00 0.00 0.56 0.00 0.00 36.38 34.20 2ibn s VAL 140 CO 0.00 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.40 2ibn n GLY 141 N -1.63 1.97 3.73 2.32 0.00 -1.26 -4.72 105.19 105.60 2ibn n GLY 141 Ca 0.03 -1.99 -0.39 0.00 0.00 0.00 0.00 46.02 43.67 2ibn n GLY 141 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2ibn n ASP 142 N 0.00 2.65 -4.84 1.61 9.92 -1.26 -4.89 116.55 119.75 2ibn n ASP 142 Ca 0.00 1.01 -0.21 0.00 -0.53 0.00 0.00 54.79 55.05 2ibn n ASP 142 Cb 0.00 -1.56 -0.04 0.00 -0.64 0.00 0.00 41.12 38.88 2ibn n ASP 142 CO 0.00 0.00 0.00 0.42 0.13 0.00 0.00 177.20 177.75 2ibn s THR 143 N -1.27 3.17 -0.09 -3.53 -4.23 -0.35 -5.00 115.64 104.33 2ibn s THR 143 Ca 0.69 -1.42 -0.30 0.00 -1.18 0.00 0.00 61.69 59.48 2ibn s THR 143 Cb -0.43 -3.09 0.07 0.00 1.34 0.00 0.00 72.50 70.38 2ibn s THR 143 CO 0.52 -0.12 0.71 0.72 -0.54 0.00 0.00 174.62 175.90 2ibn s PHE 144 N -2.38 -0.66 0.29 3.99 -0.12 -1.26 -4.47 117.98 113.36 2ibn s PHE 144 Ca 0.43 1.22 -0.30 0.00 -0.05 0.00 0.00 56.93 58.23 2ibn s PHE 144 Cb -0.04 0.39 -0.11 0.00 -0.63 0.00 0.00 43.02 42.63 2ibn s PHE 144 CO 0.26 -0.56 1.55 -2.14 -0.05 0.00 0.00 175.22 174.28 2ibn s PRO 145 N -0.94 4.16 0.39 1.99 0.02 -1.26 -1.37 135.00 137.98 2ibn s PRO 145 Ca -0.09 2.51 -0.01 0.00 0.02 0.00 0.00 61.00 63.43 2ibn s PRO 145 Cb -0.01 -3.04 -0.03 0.00 0.02 0.00 0.00 34.50 31.44 2ibn s PRO 145 CO 0.08 -0.57 0.63 0.14 -0.33 0.00 0.00 177.00 176.94 2ibn s VAL 146 N -0.11 4.99 0.00 3.83 -7.23 0.18 -4.40 120.40 117.66 2ibn s VAL 146 Ca 0.61 -0.27 0.00 0.00 -1.81 0.00 0.00 61.98 60.51 2ibn s VAL 146 Cb -0.46 -3.84 0.00 0.00 0.56 0.00 0.00 36.38 32.63 2ibn s VAL 146 CO 0.48 -0.64 0.00 0.61 -0.31 0.00 0.00 175.10 175.25 2ibn n GLY 147 N -1.94 0.66 3.32 2.32 0.00 -1.26 -4.61 105.19 103.68 2ibn n GLY 147 Ca -0.03 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.89 2ibn n GLY 147 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ibn n ARG 149 N -0.24 1.67 -2.12 0.00 0.63 -0.44 -4.91 116.66 111.25 2ibn n ARG 149 Ca -0.16 0.60 -0.41 0.00 -0.92 0.00 0.00 57.85 56.96 2ibn n ARG 149 Cb 0.64 -2.24 -0.02 0.00 0.45 0.00 0.00 32.46 31.29 2ibn n ARG 149 CO 0.00 0.00 0.00 -1.25 -2.51 0.00 0.00 177.63 173.87 2ibn s PRO 150 N 0.07 4.36 0.41 -0.14 0.04 -1.26 -4.90 135.00 133.58 2ibn s PRO 150 Ca 0.75 2.21 0.07 0.00 0.04 0.00 0.00 61.00 64.07 2ibn s PRO 150 Cb -0.77 -3.08 0.01 0.00 0.04 0.00 0.00 34.50 30.70 2ibn s PRO 150 CO 0.47 -0.19 0.57 -0.65 0.04 0.00 0.00 177.00 177.24 2ibn s GLN 151 N -1.67 2.87 0.36 4.56 -0.21 -1.26 -5.02 119.66 119.28 2ibn s GLN 151 Ca 0.49 -1.16 0.04 0.00 0.02 0.00 0.00 55.36 54.75 2ibn s GLN 151 Cb -0.40 -2.75 0.69 0.00 1.00 0.00 0.00 33.01 31.56 2ibn s GLN 151 CO 0.52 -0.24 1.99 0.00 -2.12 0.00 0.00 175.29 175.44 2ibn h ALA 152 N 0.65 1.63 -0.00 6.09 0.00 -1.99 -1.79 119.26 123.84 2ibn h ALA 152 Ca -0.41 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.47 2ibn h ALA 152 Cb 1.28 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.84 2ibn h ALA 152 CO 0.47 0.30 0.00 -1.13 0.00 0.00 0.00 179.25 178.89 2ibn n SER 153 N -4.46 0.10 -4.67 0.00 3.41 -1.26 -4.71 113.62 102.03 2ibn n SER 153 Ca 0.08 -1.10 -0.42 0.00 -0.26 0.00 0.00 58.87 57.17 2ibn n SER 153 Cb 0.13 -0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.05 2ibn n SER 153 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2ibn s VAL 154 N -2.00 3.58 0.24 -3.33 1.01 -0.67 -4.53 120.40 114.70 2ibn s VAL 154 Ca 0.44 0.81 -0.31 0.00 0.00 0.00 0.00 61.98 62.91 2ibn s VAL 154 Cb 0.21 -3.52 -0.13 0.00 0.00 0.00 0.00 36.38 32.93 2ibn s VAL 154 CO 0.34 -0.05 1.42 0.55 0.00 0.00 0.00 175.10 177.36 2ibn n VAL 155 N 5.23 0.91 -3.57 2.92 3.14 -1.26 -1.15 118.33 124.54 2ibn n VAL 155 Ca 0.16 -0.23 -0.27 0.00 -2.96 0.00 0.00 64.34 61.05 2ibn n VAL 155 Cb 0.43 -1.49 0.01 0.00 -1.06 0.00 0.00 33.84 31.73 2ibn n VAL 155 CO 0.00 0.00 0.00 0.49 -6.46 0.00 0.00 176.83 170.86 2ibn n PHE 156 N 1.97 -1.99 -0.32 1.45 3.72 -1.26 -4.88 117.46 116.15 2ibn n PHE 156 Ca 0.12 0.65 0.06 0.00 -0.05 0.00 0.00 57.45 58.23 2ibn n PHE 156 Cb 0.31 -3.50 0.22 0.00 -0.94 0.00 0.00 39.48 35.56 2ibn n PHE 156 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2ibn h ASP 158 N 0.79 0.00 -0.01 0.00 3.32 -1.90 -3.34 116.42 115.28 2ibn h ASP 158 Ca 0.46 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.51 2ibn h ASP 158 Cb 0.53 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.08 2ibn h ASP 158 CO -0.30 0.44 -0.06 -1.54 -1.72 0.00 0.00 179.24 176.06 2ibn n SER 159 N -3.88 1.77 0.00 6.45 3.41 -0.91 -4.76 113.62 115.71 2ibn n SER 159 Ca -0.01 -1.39 0.00 0.00 -0.26 0.00 0.00 58.87 57.21 2ibn n SER 159 Cb 0.49 0.13 0.00 0.00 -0.26 0.00 0.00 64.21 64.56 2ibn n SER 159 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2ibn n THR 160 N 0.41 0.00 0.99 6.66 -2.24 -1.03 -4.78 114.28 114.30 2ibn n THR 160 Ca 0.06 -0.29 0.12 0.00 -2.27 0.00 0.00 64.05 61.67 2ibn n THR 160 Cb 0.27 1.15 0.13 0.00 -2.10 0.00 0.00 70.33 69.78 2ibn n THR 160 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 2ibn n PHE 161 N -0.37 0.03 -0.31 4.78 3.72 -1.26 -3.91 117.46 120.14 2ibn n PHE 161 Ca 0.00 -0.01 0.11 0.00 -0.05 0.00 0.00 57.45 57.50 2ibn n PHE 161 Cb 0.04 0.00 0.28 0.00 -0.94 0.00 0.00 39.48 38.86 2ibn n PHE 161 CO 0.00 0.00 0.00 1.96 -0.05 0.00 0.00 176.76 178.67 2ibn h GLN 162 N 4.57 0.50 -0.58 -1.08 7.50 -1.90 -1.81 115.11 122.32 2ibn h GLN 162 Ca 0.00 -0.03 0.00 0.00 0.50 0.00 0.00 58.65 59.12 2ibn h GLN 162 Cb 0.97 -0.11 0.00 0.00 0.05 0.00 0.00 27.48 28.39 2ibn h GLN 162 CO 0.00 0.33 0.00 -0.25 -1.50 0.00 0.00 178.83 177.41 2ibn n ASP 163 N -4.95 3.60 -4.63 1.46 8.00 -1.26 -4.89 116.55 113.88 2ibn n ASP 163 Ca 0.21 -1.98 -0.43 0.00 0.71 0.00 0.00 54.79 53.29 2ibn n ASP 163 Cb 0.57 -0.38 -0.02 0.00 -0.02 0.00 0.00 41.12 41.27 2ibn n ASP 163 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 2ibn s ASN 164 N -1.07 6.51 0.49 -2.24 3.84 -0.68 -4.90 114.94 116.89 2ibn s ASN 164 Ca 0.41 1.58 0.25 0.00 0.21 0.00 0.00 52.86 55.31 2ibn s ASN 164 Cb 0.22 -2.53 1.26 0.00 -0.55 0.00 0.00 41.25 39.64 2ibn s ASN 164 CO 0.29 -1.15 2.00 1.55 -2.79 0.00 0.00 177.10 176.99 2ibn h PRO 165 N 10.11 0.00 0.00 0.43 0.13 -1.89 -2.73 132.00 138.05 2ibn h PRO 165 Ca -0.32 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.79 2ibn h PRO 165 Cb 1.14 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.27 2ibn h PRO 165 CO 1.00 0.17 -0.10 -0.44 -0.23 0.00 0.00 178.00 178.40 2ibn h ASP 166 N 0.00 0.00 0.07 1.44 5.19 -1.92 -2.98 116.42 118.22 2ibn h ASP 166 Ca -0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2ibn h ASP 166 Cb 0.45 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.96 2ibn h ASP 166 CO 0.02 0.10 -0.00 0.18 -3.12 0.00 0.00 179.24 176.42 2ibn n LEU 167 N -3.43 0.13 -0.62 1.55 4.77 -1.03 -1.88 117.00 116.50 2ibn n LEU 167 Ca -0.01 -0.01 0.06 0.00 -0.03 0.00 0.00 56.01 56.03 2ibn n LEU 167 Cb 0.26 -0.04 0.11 0.00 -2.33 0.00 0.00 43.42 41.42 2ibn n LEU 167 CO 0.29 0.02 0.54 0.00 -1.33 0.00 0.00 177.39 176.91 2ibn n GLN 168 N -0.94 1.69 -3.18 3.23 6.02 -1.13 -4.76 117.38 118.31 2ibn n GLN 168 Ca 0.22 -1.65 -0.41 0.00 -0.01 0.00 0.00 57.00 55.16 2ibn n GLN 168 Cb 0.15 -1.28 -0.07 0.00 1.02 0.00 0.00 30.24 30.06 2ibn n GLN 168 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 2ibn s ASP 169 N -1.04 6.44 0.47 1.08 -1.08 -0.79 -4.95 116.67 116.80 2ibn s ASP 169 Ca 0.20 0.39 0.32 0.00 -0.52 0.00 0.00 52.55 52.94 2ibn s ASP 169 Cb 0.12 -2.30 1.60 0.00 -1.46 0.00 0.00 42.92 40.88 2ibn s ASP 169 CO 0.17 -0.41 1.97 1.55 0.52 0.00 0.00 175.17 178.97 2ibn h PRO 170 N 8.17 0.00 0.00 4.34 0.13 -1.93 0.77 132.00 143.48 2ibn h PRO 170 Ca -0.28 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.80 2ibn h PRO 170 Cb 1.13 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.25 2ibn h PRO 170 CO 0.76 0.00 -0.26 0.00 -0.23 0.00 0.00 178.00 178.27 2ibn h ARG 171 N 0.00 0.00 0.00 0.86 3.08 -1.92 -3.37 114.38 113.03 2ibn h ARG 171 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2ibn h ARG 171 Cb 0.16 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.21 2ibn h ARG 171 CO 0.00 0.26 0.00 0.66 -1.07 0.00 0.00 179.97 179.82 2ibn n TYR 172 N -3.77 0.00 0.62 3.04 4.01 0.11 -4.37 117.16 116.80 2ibn n TYR 172 Ca -0.01 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 57.85 2ibn n TYR 172 Cb 0.36 0.00 0.27 0.00 -0.31 0.00 0.00 39.34 39.67 2ibn n TYR 172 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 2ibn n SER 173 N -0.65 0.72 -4.92 7.72 3.41 -0.30 -2.31 113.62 117.30 2ibn n SER 173 Ca 0.00 0.29 -0.27 0.00 -0.26 0.00 0.00 58.87 58.63 2ibn n SER 173 Cb 0.01 -0.22 0.02 0.00 -0.26 0.00 0.00 64.21 63.76 2ibn n SER 173 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2ibn s THR 174 N -3.13 4.08 0.22 6.66 -4.23 -1.26 -4.32 115.64 113.66 2ibn s THR 174 Ca 0.08 0.05 -0.15 0.00 -1.18 0.00 0.00 61.69 60.50 2ibn s THR 174 Cb 0.13 -3.59 0.25 0.00 1.34 0.00 0.00 72.50 70.64 2ibn s THR 174 CO 0.67 -0.59 1.60 -0.08 -0.54 0.00 0.00 174.62 175.68 2ibn h GLU 175 N -0.02 -0.04 0.00 3.99 4.81 -1.90 -1.07 114.58 120.34 2ibn h GLU 175 Ca -0.46 0.00 -0.18 0.00 -0.13 0.00 0.00 59.36 58.59 2ibn h GLU 175 Cb 1.24 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 30.60 2ibn h GLU 175 CO 0.61 -0.03 -1.59 1.28 -0.73 0.00 0.00 179.01 178.55 2ibn n LEU 176 N -5.48 0.69 0.00 1.64 4.77 -1.26 -4.32 117.00 113.04 2ibn n LEU 176 Ca 0.09 0.31 0.00 0.00 -0.03 0.00 0.00 56.01 56.37 2ibn n LEU 176 Cb 0.38 0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.59 2ibn n LEU 176 CO -0.01 0.19 0.00 0.61 -1.33 0.00 0.00 177.39 176.84 2ibn n GLY 177 N 1.43 0.00 1.27 -0.72 0.00 -1.01 -4.71 105.19 101.46 2ibn n GLY 177 Ca -0.12 0.00 0.01 0.00 0.00 0.00 0.00 46.02 45.91 2ibn n GLY 177 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2ibn n TYR 179 N 0.00 -2.21 -3.24 1.61 4.01 -1.26 -4.82 117.16 111.25 2ibn n TYR 179 Ca 0.00 1.20 -0.31 0.00 -0.16 0.00 0.00 57.90 58.63 2ibn n TYR 179 Cb 0.00 -1.87 -0.05 0.00 -0.31 0.00 0.00 39.34 37.11 2ibn n TYR 179 CO 0.00 0.00 0.00 -0.65 -0.46 0.00 0.00 176.86 175.75 2ibn s GLN 180 N -4.73 3.83 0.24 -0.72 -0.21 -1.26 -5.04 119.66 111.76 2ibn s GLN 180 Ca 0.00 0.37 -0.31 0.00 0.02 0.00 0.00 55.36 55.44 2ibn s GLN 180 Cb 0.00 -2.54 -0.13 0.00 1.00 0.00 0.00 33.01 31.34 2ibn s GLN 180 CO 0.00 0.20 1.58 -2.30 -2.12 0.00 0.00 175.29 172.65 2ibn n PRO 181 N -0.51 2.47 -3.52 2.91 -0.02 -1.26 -3.32 135.00 131.75 2ibn n PRO 181 Ca 0.01 0.88 -0.26 0.00 -2.02 0.00 0.00 63.50 62.12 2ibn n PRO 181 Cb 0.53 -2.65 0.04 0.00 -0.02 0.00 0.00 33.50 31.40 2ibn n PRO 181 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 2ibn n HIS 182 N 2.73 -2.32 -0.02 6.00 8.25 0.16 -4.88 115.22 125.13 2ibn n HIS 182 Ca 0.12 0.78 0.03 0.00 -0.26 0.00 0.00 57.72 58.40 2ibn n HIS 182 Cb 0.34 -4.28 0.40 0.00 1.12 0.00 0.00 29.99 27.56 2ibn n HIS 182 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2ibn n GLY 184 N -1.42 1.91 0.24 0.00 0.00 0.84 -4.67 105.19 102.10 2ibn n GLY 184 Ca 0.03 -1.70 0.08 0.00 0.00 0.00 0.00 46.02 44.44 2ibn n GLY 184 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2ibn h LEU 185 N 0.00 0.00 -0.68 0.99 3.38 -1.92 -1.84 115.31 115.24 2ibn h LEU 185 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2ibn h LEU 185 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 2ibn h LEU 185 CO 0.00 0.13 0.00 -0.90 0.09 0.00 0.00 178.44 177.76 2ibn n ASP 186 N -4.11 0.65 -1.14 -0.43 5.75 -1.26 -2.01 116.55 114.00 2ibn n ASP 186 Ca -0.02 0.66 0.10 0.00 -0.01 0.00 0.00 54.79 55.52 2ibn n ASP 186 Cb 0.22 -0.80 0.27 0.00 -1.03 0.00 0.00 41.12 39.78 2ibn n ASP 186 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2ibn n ARG 187 N -2.22 2.75 -3.62 0.11 1.74 -0.69 -4.95 116.66 109.77 2ibn n ARG 187 Ca 0.02 -2.47 -0.36 0.00 -0.77 0.00 0.00 57.85 54.27 2ibn n ARG 187 Cb 0.23 -1.48 -0.06 0.00 -1.02 0.00 0.00 32.46 30.13 2ibn n ARG 187 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2ibn s VAL 188 N -1.02 5.16 0.54 1.55 1.01 -0.85 -4.99 120.40 121.81 2ibn s VAL 188 Ca 0.41 0.53 -0.02 0.00 0.00 0.00 0.00 61.98 62.91 2ibn s VAL 188 Cb 0.22 -3.62 0.02 0.00 0.00 0.00 0.00 36.38 32.99 2ibn s VAL 188 CO 0.28 0.48 0.80 -0.22 0.00 0.00 0.00 175.10 176.44 2ibn s LEU 189 N -1.39 3.35 0.15 3.92 2.96 -1.26 -5.03 118.68 121.38 2ibn s LEU 189 Ca 0.25 0.35 -0.24 0.00 -0.22 0.00 0.00 54.13 54.27 2ibn s LEU 189 Cb -0.15 -3.19 -0.08 0.00 0.50 0.00 0.00 46.19 43.27 2ibn s LEU 189 CO 0.13 -1.00 0.73 -0.94 -1.32 0.00 0.00 176.35 173.96 2ibn s SER 191 N -4.32 7.32 0.10 3.68 1.04 -0.47 -0.65 113.70 120.39 2ibn s SER 191 Ca 0.53 1.57 -0.25 0.00 0.48 0.00 0.00 55.95 58.28 2ibn s SER 191 Cb -0.10 -2.47 -0.07 0.00 0.10 0.00 0.00 66.02 63.48 2ibn s SER 191 CO 0.41 0.22 0.77 0.86 0.98 0.00 0.00 173.24 176.48 2ibn s TRP 192 N -1.15 3.81 -1.18 5.02 -0.11 -1.26 -4.80 118.94 119.28 2ibn s TRP 192 Ca 0.35 1.54 0.00 0.00 1.22 0.00 0.00 56.10 59.21 2ibn s TRP 192 Cb -0.22 -2.80 0.00 0.00 -1.50 0.00 0.00 33.47 28.95 2ibn s TRP 192 CO 0.25 0.38 0.00 0.41 -4.62 0.00 0.00 176.95 173.37 2ibn n GLY 193 N 2.04 -0.60 0.30 5.86 0.00 -1.26 -4.18 105.19 107.36 2ibn n GLY 193 Ca -0.04 -0.62 0.09 0.00 0.00 0.00 0.00 46.02 45.44 2ibn n GLY 193 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 173.32 174.44 2ibn h HIS 194 N 0.00 0.20 0.33 1.61 2.07 -1.31 -2.67 115.15 115.38 2ibn h HIS 194 Ca 0.00 0.00 -0.02 0.00 -2.85 0.00 0.00 60.37 57.51 2ibn h HIS 194 Cb 0.00 -0.07 0.00 0.00 2.57 0.00 0.00 27.41 29.91 2ibn h HIS 194 CO 0.00 0.12 -0.16 -0.44 -3.07 0.00 0.00 177.93 174.38 2ibn h ASP 195 N 0.21 -0.37 -0.74 3.10 5.19 -1.85 -3.34 116.42 118.63 2ibn h ASP 195 Ca 0.10 0.01 -0.05 0.00 -0.62 0.00 0.00 57.03 56.48 2ibn h ASP 195 Cb 0.15 0.10 -0.03 0.00 0.18 0.00 0.00 39.33 39.73 2ibn h ASP 195 CO -0.02 -0.26 0.28 -0.08 -3.12 0.00 0.00 179.24 176.05 2ibn h GLU 196 N -0.46 1.12 0.00 3.56 4.57 -1.75 -1.31 114.58 120.32 2ibn h GLU 196 Ca -0.04 -0.21 0.00 0.00 -1.18 0.00 0.00 59.36 57.92 2ibn h GLU 196 Cb 0.34 -0.18 0.00 0.00 -0.16 0.00 0.00 28.75 28.75 2ibn h GLU 196 CO 0.07 0.92 0.00 0.98 -1.18 0.00 0.00 179.01 179.81 2ibn n TYR 197 N -4.32 0.00 0.00 0.92 9.36 -1.01 -0.26 117.16 121.85 2ibn n TYR 197 Ca 0.06 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.28 2ibn n TYR 197 Cb 0.19 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 38.90 2ibn n TYR 197 CO 0.00 0.00 0.00 0.98 0.22 0.00 0.00 176.86 178.06 2ibn n TYR 199 N -0.11 0.00 0.00 2.98 9.36 -0.49 -0.96 117.16 127.94 2ibn n TYR 199 Ca 0.00 0.00 -0.08 0.00 3.32 0.00 0.00 57.90 61.14 2ibn n TYR 199 Cb 0.00 0.00 0.09 0.00 -0.63 0.00 0.00 39.34 38.80 2ibn n TYR 199 CO 0.00 0.00 0.00 1.96 0.22 0.00 0.00 176.86 179.04 2ibn h GLN 200 N 0.00 0.54 -0.33 2.98 4.20 -0.89 -1.58 115.11 120.03 2ibn h GLN 200 Ca 0.00 -0.30 0.00 0.00 0.06 0.00 0.00 58.65 58.41 2ibn h GLN 200 Cb 0.00 0.02 0.00 0.00 0.30 0.00 0.00 27.48 27.80 2ibn h GLN 200 CO 0.00 0.89 0.00 0.28 -0.67 0.00 0.00 178.83 179.33 2ibn n VAL 201 N -4.00 0.01 0.00 -0.54 0.31 -0.14 -1.06 118.33 112.92 2ibn n VAL 201 Ca -0.02 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.31 2ibn n VAL 201 Cb 0.55 -0.11 0.00 0.00 -0.91 0.00 0.00 33.84 33.36 2ibn n VAL 201 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 2ibn n LYS 203 N 0.52 0.00 -0.32 5.55 4.76 -0.59 -1.31 118.16 126.76 2ibn n LYS 203 Ca 0.00 0.00 -0.04 0.00 -2.87 0.00 0.00 58.31 55.40 2ibn n LYS 203 Cb 0.03 0.00 0.08 0.00 -1.84 0.00 0.00 35.03 33.30 2ibn n LYS 203 CO 0.00 0.00 0.00 0.35 -1.37 0.00 0.00 177.40 176.38 2ibn h PHE 204 N 0.00 1.14 -0.01 2.13 3.57 -1.36 -2.54 116.94 119.87 2ibn h PHE 204 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 2ibn h PHE 204 Cb 0.00 -0.38 0.00 0.00 2.79 0.00 0.00 35.95 38.36 2ibn h PHE 204 CO 0.00 0.76 -0.16 0.09 -2.23 0.00 0.00 178.31 176.76 2ibn n ASN 205 N -4.42 0.79 -3.06 0.41 3.02 -0.42 -4.96 115.26 106.61 2ibn n ASN 205 Ca 0.09 -0.80 -0.16 0.00 -0.03 0.00 0.00 54.58 53.69 2ibn n ASN 205 Cb 0.05 0.02 0.07 0.00 -0.61 0.00 0.00 39.78 39.32 2ibn n ASN 205 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2ibn n LYS 206 N -0.73 -5.91 -1.67 3.52 5.02 -0.96 -4.93 118.16 112.51 2ibn n LYS 206 Ca 0.14 0.71 -0.43 0.00 -2.02 0.00 0.00 58.31 56.71 2ibn n LYS 206 Cb 0.31 -5.34 -0.01 0.00 -0.02 0.00 0.00 35.03 29.97 2ibn n LYS 206 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 2ibn n PHE 207 N -3.91 2.01 -2.30 2.13 3.01 -1.26 -4.88 117.46 112.26 2ibn n PHE 207 Ca -0.17 0.57 -0.40 0.00 1.01 0.00 0.00 57.45 58.46 2ibn n PHE 207 Cb 0.62 -2.38 0.02 0.00 -0.01 0.00 0.00 39.48 37.72 2ibn n PHE 207 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 2ibn n SER 208 N 1.10 7.45 -4.87 4.37 3.41 -0.31 -4.95 113.62 119.82 2ibn n SER 208 Ca 0.07 -3.62 -0.24 0.00 -0.26 0.00 0.00 58.87 54.83 2ibn n SER 208 Cb 0.34 -1.18 -0.04 0.00 -0.26 0.00 0.00 64.21 63.07 2ibn n SER 208 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2ibn s LEU 209 N -3.82 4.01 0.78 1.04 1.43 -1.26 -4.89 118.68 115.97 2ibn s LEU 209 Ca 0.46 -0.07 -0.12 0.00 -1.03 0.00 0.00 54.13 53.36 2ibn s LEU 209 Cb 0.26 -2.57 0.07 0.00 0.03 0.00 0.00 46.19 43.98 2ibn s LEU 209 CO -0.20 0.01 1.13 -2.16 0.23 0.00 0.00 176.35 175.35 2ibn s PRO 210 N -3.53 2.02 0.37 1.29 0.04 -1.26 -4.87 135.00 129.06 2ibn s PRO 210 Ca 0.33 1.39 0.10 0.00 0.04 0.00 0.00 61.00 62.86 2ibn s PRO 210 Cb -0.09 -1.85 0.85 0.00 0.04 0.00 0.00 34.50 33.44 2ibn s PRO 210 CO 0.26 -1.86 1.88 -1.35 0.04 0.00 0.00 177.00 175.98 2ibn h PRO 211 N -0.99 0.63 -0.39 0.56 0.11 -2.00 -1.37 132.00 128.55 2ibn h PRO 211 Ca -0.45 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2ibn h PRO 211 Cb 1.25 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 32.20 2ibn h PRO 211 CO 0.49 0.42 0.26 0.93 -0.21 0.00 0.00 178.00 179.89 2ibn h GLU 212 N 0.65 0.51 -0.21 1.05 3.07 -1.99 -2.47 114.58 115.19 2ibn h GLU 212 Ca 0.43 -0.03 -0.02 0.00 -0.50 0.00 0.00 59.36 59.23 2ibn h GLU 212 Cb 0.71 -0.11 -0.01 0.00 -0.84 0.00 0.00 28.75 28.50 2ibn h GLU 212 CO -0.19 0.34 0.03 0.00 -1.40 0.00 0.00 179.01 177.79 2ibn h ALA 213 N 1.76 0.27 -0.87 3.43 0.00 -1.60 -2.95 119.26 119.31 2ibn h ALA 213 Ca 0.14 -0.18 0.10 0.00 0.00 0.00 0.00 54.91 54.98 2ibn h ALA 213 Cb -0.06 -0.08 -0.08 0.00 0.00 0.00 0.00 17.79 17.58 2ibn h ALA 213 CO -0.03 -0.05 0.51 0.74 0.00 0.00 0.00 179.25 180.41 2ibn h PHE 214 N 0.14 0.92 0.00 0.00 0.04 -1.42 -2.66 116.94 113.96 2ibn h PHE 214 Ca 0.06 0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.86 2ibn h PHE 214 Cb 0.32 -0.28 0.00 0.00 2.20 0.00 0.00 35.95 38.19 2ibn h PHE 214 CO 0.02 0.37 0.00 0.98 -0.60 0.00 0.00 178.31 179.08 2ibn n TYR 215 N -4.71 0.00 0.00 -0.55 9.36 -0.97 -1.07 117.16 119.21 2ibn n TYR 215 Ca 0.15 -0.26 0.00 0.00 3.32 0.00 0.00 57.90 61.11 2ibn n TYR 215 Cb 0.29 -0.17 0.00 0.00 -0.63 0.00 0.00 39.34 38.83 2ibn n TYR 215 CO 0.00 0.00 0.00 -0.89 0.22 0.00 0.00 176.86 176.19 2ibn n ILE 217 N 0.46 0.00 0.23 2.97 5.41 -1.00 -1.23 119.36 126.20 2ibn n ILE 217 Ca 0.00 0.00 0.06 0.00 1.00 0.00 0.00 62.75 63.81 2ibn n ILE 217 Cb 0.32 0.00 0.54 0.00 -0.71 0.00 0.00 39.64 39.79 2ibn n ILE 217 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 176.55 176.46 2ibn h ARG 218 N 0.00 0.00 -0.04 0.38 2.43 -1.30 -3.18 114.38 112.67 2ibn h ARG 218 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2ibn h ARG 218 Cb 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.55 2ibn h ARG 218 CO 0.00 0.14 0.00 1.19 -1.51 0.00 0.00 179.97 179.79 2ibn n PHE 219 N -4.36 0.05 0.28 2.20 3.72 -0.37 -4.33 117.46 114.65 2ibn n PHE 219 Ca -0.03 -0.50 0.14 0.00 -0.05 0.00 0.00 57.45 57.02 2ibn n PHE 219 Cb 0.21 -0.05 0.84 0.00 -0.94 0.00 0.00 39.48 39.54 2ibn n PHE 219 CO 0.00 0.00 0.00 1.12 -0.05 0.00 0.00 176.76 177.83 2ibn h HIS 220 N 0.21 0.00 -0.02 1.38 2.07 -1.76 -1.61 115.15 115.42 2ibn h HIS 220 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 2ibn h HIS 220 Cb 0.52 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.50 2ibn h HIS 220 CO 0.02 0.06 -0.02 0.43 -3.07 0.00 0.00 177.93 175.35 2ibn n SER 221 N -3.71 1.80 -3.20 3.10 7.64 -1.26 -4.62 113.62 113.37 2ibn n SER 221 Ca -0.02 -1.58 -0.36 0.00 1.01 0.00 0.00 58.87 57.92 2ibn n SER 221 Cb 0.16 0.01 -0.04 0.00 -1.01 0.00 0.00 64.21 63.33 2ibn n SER 221 CO 0.00 0.00 0.00 0.33 -3.01 0.00 0.00 175.04 172.36 2ibn n PHE 222 N 0.38 2.21 -0.31 1.43 7.35 -0.61 -1.22 117.46 126.70 2ibn n PHE 222 Ca 0.17 -2.87 0.03 0.00 -0.76 0.00 0.00 57.45 54.02 2ibn n PHE 222 Cb 0.41 -2.27 0.17 0.00 0.35 0.00 0.00 39.48 38.14 2ibn n PHE 222 CO 0.00 0.00 0.00 1.88 -0.76 0.00 0.00 176.76 177.88 2ibn h TYR 223 N 4.69 0.93 -1.01 -5.13 0.05 -1.82 -1.56 116.97 113.13 2ibn h TYR 223 Ca 0.77 0.03 0.25 0.00 0.05 0.00 0.00 58.73 59.83 2ibn h TYR 223 Cb 0.41 -0.29 -0.08 0.00 1.01 0.00 0.00 36.73 37.77 2ibn h TYR 223 CO 1.82 0.41 0.66 -1.35 -1.05 0.00 0.00 178.16 178.65 2ibn h PRO 224 N 0.88 0.35 0.00 4.88 0.11 -1.81 0.14 132.00 136.55 2ibn h PRO 224 Ca 0.40 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.49 2ibn h PRO 224 Cb 0.31 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.34 2ibn h PRO 224 CO -0.22 0.23 -0.18 2.35 -0.21 0.00 0.00 178.00 179.97 2ibn h TRP 225 N 0.36 0.00 0.00 0.65 7.01 -1.52 0.24 115.95 122.70 2ibn h TRP 225 Ca 0.55 0.00 -0.03 0.00 2.11 0.00 0.00 58.89 61.52 2ibn h TRP 225 Cb 1.46 0.00 -0.00 0.00 -2.10 0.00 0.00 29.16 28.52 2ibn h TRP 225 CO -0.00 0.00 -0.13 1.12 -2.79 0.00 0.00 178.44 176.64 2ibn h HIS 226 N -0.80 0.00 0.00 2.65 2.07 -1.31 -2.78 115.15 114.98 2ibn h HIS 226 Ca 0.00 0.00 -0.08 0.00 -2.85 0.00 0.00 60.37 57.44 2ibn h HIS 226 Cb 0.18 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.15 2ibn h HIS 226 CO -0.08 0.13 -1.27 2.41 -3.07 0.00 0.00 177.93 176.05 2ibn n THR 227 N -3.39 0.27 0.24 6.12 -1.04 0.25 -4.72 114.28 112.01 2ibn n THR 227 Ca -0.01 -0.08 0.12 0.00 -2.04 0.00 0.00 64.05 62.04 2ibn n THR 227 Cb 0.32 -1.20 0.53 0.00 -1.82 0.00 0.00 70.33 68.16 2ibn n THR 227 CO 0.00 0.00 0.00 1.23 -0.64 0.00 0.00 175.07 175.66 2ibn h GLY 228 N 0.04 0.00 -1.39 3.41 0.00 -0.83 -3.47 103.07 100.84 2ibn h GLY 228 Ca -0.12 0.00 -0.38 0.00 0.00 0.00 0.00 47.33 46.84 2ibn h GLY 228 CO -0.05 0.00 -0.38 0.54 0.00 0.00 0.00 176.54 176.65 2ibn n ARG 229 N -3.31 -1.35 -1.89 4.80 5.12 -0.34 -4.94 116.66 114.76 2ibn n ARG 229 Ca 0.00 1.08 -0.29 0.00 -1.93 0.00 0.00 57.85 56.71 2ibn n ARG 229 Cb 0.39 -5.44 0.21 0.00 -1.16 0.00 0.00 32.46 26.46 2ibn n ARG 229 CO 0.00 0.00 0.00 -0.25 -1.93 0.00 0.00 177.63 175.45 2ibn n ASP 230 N -1.16 0.07 -2.06 0.55 8.00 0.69 -4.53 116.55 118.12 2ibn n ASP 230 Ca -0.20 -1.48 -0.18 0.00 0.71 0.00 0.00 54.79 53.65 2ibn n ASP 230 Cb 0.63 -1.02 -0.01 0.00 -0.02 0.00 0.00 41.12 40.70 2ibn n ASP 230 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2ibn n TYR 231 N -3.86 -0.85 0.31 1.24 4.01 -1.26 -4.37 117.16 112.38 2ibn n TYR 231 Ca 0.17 0.00 0.19 0.00 -0.16 0.00 0.00 57.90 58.10 2ibn n TYR 231 Cb 0.58 -3.58 1.00 0.00 -0.31 0.00 0.00 39.34 37.02 2ibn n TYR 231 CO 0.00 0.00 0.00 1.96 -0.46 0.00 0.00 176.86 178.36 2ibn h GLN 232 N 0.00 0.00 0.00 -0.72 1.08 -1.96 -2.03 115.11 111.48 2ibn h GLN 232 Ca -0.43 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.77 2ibn h GLN 232 Cb 1.32 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.75 2ibn h GLN 232 CO 0.51 0.02 0.00 1.96 -0.95 0.00 0.00 178.83 180.37 2ibn h GLN 233 N 0.00 0.00 0.00 1.46 7.50 -1.97 -3.31 115.11 118.79 2ibn h GLN 233 Ca -0.00 0.00 -0.26 0.00 0.50 0.00 0.00 58.65 58.89 2ibn h GLN 233 Cb 0.17 0.00 -0.05 0.00 0.05 0.00 0.00 27.48 27.65 2ibn h GLN 233 CO 0.00 0.00 -1.96 1.28 -1.50 0.00 0.00 178.83 176.65 2ibn n LEU 234 N -3.07 0.12 -4.83 1.46 4.77 -0.77 0.36 117.00 115.04 2ibn n LEU 234 Ca -0.00 -0.00 -0.31 0.00 -0.03 0.00 0.00 56.01 55.66 2ibn n LEU 234 Cb 0.23 0.31 0.04 0.00 -2.33 0.00 0.00 43.42 41.67 2ibn n LEU 234 CO 0.25 0.36 0.71 0.00 -1.33 0.00 0.00 177.39 177.38 2ibn n SER 236 N -2.95 2.81 -0.26 0.00 3.41 -1.26 -4.46 113.62 110.91 2ibn n SER 236 Ca 0.07 -2.86 0.14 0.00 -0.26 0.00 0.00 58.87 55.96 2ibn n SER 236 Cb 0.54 0.40 0.41 0.00 -0.26 0.00 0.00 64.21 65.30 2ibn n SER 236 CO 0.00 0.00 0.00 -0.61 -0.16 0.00 0.00 175.04 174.27 2ibn h GLN 237 N 0.00 0.60 -0.60 4.33 5.75 -1.98 -1.80 115.11 121.41 2ibn h GLN 237 Ca -0.34 -0.04 -0.08 0.00 -0.15 0.00 0.00 58.65 58.05 2ibn h GLN 237 Cb 1.06 -0.13 -0.02 0.00 1.07 0.00 0.00 27.48 29.45 2ibn h GLN 237 CO 0.56 0.39 0.07 1.96 -2.65 0.00 0.00 178.83 179.16 2ibn h GLN 238 N 0.61 0.99 -0.36 1.69 4.20 -1.99 -0.80 115.11 119.45 2ibn h GLN 238 Ca 0.46 -0.26 -0.13 0.00 0.06 0.00 0.00 58.65 58.78 2ibn h GLN 238 Cb 0.85 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 28.50 2ibn h GLN 238 CO -0.21 0.92 -0.30 -0.44 -0.67 0.00 0.00 178.83 178.14 2ibn h ASP 239 N 0.92 0.79 -0.86 1.46 3.32 -1.81 -2.98 116.42 117.28 2ibn h ASP 239 Ca 0.18 -0.32 0.01 0.00 0.02 0.00 0.00 57.03 56.93 2ibn h ASP 239 Cb 0.43 -0.22 -0.04 0.00 0.22 0.00 0.00 39.33 39.72 2ibn h ASP 239 CO 0.01 1.04 0.57 0.25 -1.72 0.00 0.00 179.24 179.39 2ibn h LEU 240 N 0.65 0.97 -1.33 1.55 5.85 -0.68 -1.48 115.31 120.84 2ibn h LEU 240 Ca 0.08 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.77 2ibn h LEU 240 Cb 0.83 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 41.62 2ibn h LEU 240 CO 0.07 0.70 0.00 0.00 -0.34 0.00 0.00 178.44 178.87 2ibn n ALA 241 N -2.34 1.23 0.00 1.25 0.00 -0.37 -4.43 120.51 115.85 2ibn n ALA 241 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.53 2ibn n ALA 241 Cb 0.03 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.48 2ibn n ALA 241 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2ibn n LEU 243 N 0.64 0.00 0.01 0.00 7.94 -0.56 -4.62 117.00 120.42 2ibn n LEU 243 Ca 0.00 0.00 0.02 0.00 -1.11 0.00 0.00 56.01 54.92 2ibn n LEU 243 Cb 0.02 0.00 0.38 0.00 0.53 0.00 0.00 43.42 44.34 2ibn n LEU 243 CO 0.00 0.00 1.06 1.55 -1.11 0.00 0.00 177.39 178.89 2ibn h PRO 244 N 0.00 0.50 -0.30 1.96 0.13 -1.89 -0.80 132.00 131.60 2ibn h PRO 244 Ca 0.00 -0.06 -0.02 0.00 -0.87 0.00 0.00 66.00 65.05 2ibn h PRO 244 Cb 0.00 -0.10 -0.01 0.00 0.13 0.00 0.00 31.00 31.02 2ibn h PRO 244 CO 0.00 0.43 0.11 -1.49 -0.23 0.00 0.00 178.00 176.81 2ibn h TRP 245 N 0.51 0.47 -0.51 1.56 4.06 -1.95 -1.87 115.95 118.22 2ibn h TRP 245 Ca 0.13 -0.04 -0.10 0.00 2.06 0.00 0.00 58.89 60.93 2ibn h TRP 245 Cb 0.11 -0.14 -0.02 0.00 -1.00 0.00 0.00 29.16 28.12 2ibn h TRP 245 CO 0.00 0.47 -0.09 0.28 -3.56 0.00 0.00 178.44 175.55 2ibn h VAL 246 N 0.34 1.27 -0.08 1.49 2.07 -1.87 -1.30 116.25 118.17 2ibn h VAL 246 Ca 0.10 -1.22 -0.13 0.00 0.82 0.00 0.00 66.70 66.27 2ibn h VAL 246 Cb 0.21 1.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.99 2ibn h VAL 246 CO -0.01 0.43 -0.52 0.03 0.02 0.00 0.00 177.57 177.52 2ibn h ARG 247 N 0.82 0.21 -0.04 1.57 3.08 -1.14 -0.20 114.38 118.68 2ibn h ARG 247 Ca 0.13 -0.12 -0.00 0.00 0.07 0.00 0.00 59.98 60.06 2ibn h ARG 247 Cb 0.64 0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.70 2ibn h ARG 247 CO 0.04 0.68 0.02 1.49 -1.07 0.00 0.00 179.97 181.13 2ibn h GLU 248 N 0.16 0.05 -0.25 0.04 4.57 -1.19 -2.78 114.58 115.19 2ibn h GLU 248 Ca 0.00 -0.01 0.03 0.00 -1.18 0.00 0.00 59.36 58.21 2ibn h GLU 248 Cb 0.97 -0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 29.52 2ibn h GLU 248 CO 0.08 0.19 0.06 0.35 -1.18 0.00 0.00 179.01 178.50 2ibn h PHE 249 N -0.09 0.10 -0.54 0.92 3.57 -1.08 -2.82 116.94 117.00 2ibn h PHE 249 Ca 0.01 0.01 0.11 0.00 3.53 0.00 0.00 57.97 61.64 2ibn h PHE 249 Cb 0.15 -0.01 -0.03 0.00 2.79 0.00 0.00 35.95 38.85 2ibn h PHE 249 CO -0.02 0.03 0.37 -0.97 -2.23 0.00 0.00 178.31 175.49 2ibn h ASN 250 N 0.16 0.21 -0.95 0.41 -1.24 -0.92 0.51 115.58 113.76 2ibn h ASN 250 Ca 0.11 0.01 0.19 0.00 0.71 0.00 0.00 56.30 57.32 2ibn h ASN 250 Cb 0.11 -0.04 -0.08 0.00 0.73 0.00 0.00 38.32 39.04 2ibn h ASN 250 CO -0.14 0.13 0.61 0.11 -1.29 0.00 0.00 177.43 176.84 2ibn h LYS 251 N 0.24 0.56 0.00 6.67 1.57 -1.22 -1.17 116.57 123.22 2ibn h LYS 251 Ca 0.25 -0.03 -0.05 0.00 -1.87 0.00 0.00 60.65 58.95 2ibn h LYS 251 Cb 0.69 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.86 2ibn h LYS 251 CO -0.05 0.37 -1.47 1.19 -0.57 0.00 0.00 179.45 178.92 2ibn n PHE 252 N -4.60 0.61 -0.06 -1.35 3.72 0.14 -3.88 117.46 112.03 2ibn n PHE 252 Ca 0.21 0.18 -0.12 0.00 -0.05 0.00 0.00 57.45 57.67 2ibn n PHE 252 Cb 0.63 -0.84 -0.06 0.00 -0.94 0.00 0.00 39.48 38.27 2ibn n PHE 252 CO 0.00 0.00 0.00 0.22 -0.05 0.00 0.00 176.76 176.93 2ibn h ASP 253 N 0.00 0.39 -2.19 4.37 3.58 -1.10 -3.42 116.42 118.04 2ibn h ASP 253 Ca -0.06 -0.40 -0.71 0.00 0.42 0.00 0.00 57.03 56.28 2ibn h ASP 253 Cb 1.17 -0.11 -0.17 0.00 1.72 0.00 0.00 39.33 41.94 2ibn h ASP 253 CO 0.01 0.71 1.17 -0.76 -2.88 0.00 0.00 179.24 177.48 2ibn s LEU 254 N -9.27 4.97 -0.09 2.28 1.43 -0.48 -5.00 118.68 112.52 2ibn s LEU 254 Ca -0.14 -2.53 -0.02 0.00 -1.03 0.00 0.00 54.13 50.41 2ibn s LEU 254 Cb 0.06 -2.41 -0.03 0.00 0.03 0.00 0.00 46.19 43.84 2ibn s LEU 254 CO 0.75 -0.92 0.01 -0.76 0.23 0.00 0.00 176.35 175.66 2ibn s LEU 261 N 2.23 3.61 0.92 1.79 1.43 -1.26 -5.01 118.68 122.40 2ibn s LEU 261 Ca 0.39 0.15 -0.12 0.00 -1.03 0.00 0.00 54.13 53.52 2ibn s LEU 261 Cb -0.03 -1.83 0.14 0.00 0.03 0.00 0.00 46.19 44.51 2ibn s LEU 261 CO -0.04 0.38 1.10 -2.16 0.23 0.00 0.00 176.35 175.86 2ibn s PRO 262 N -0.89 1.03 -1.18 1.29 0.04 -1.26 -4.93 135.00 129.10 2ibn s PRO 262 Ca 0.13 0.57 -0.11 0.00 0.04 0.00 0.00 61.00 61.63 2ibn s PRO 262 Cb -0.11 -1.80 0.22 0.00 0.04 0.00 0.00 34.50 32.84 2ibn s PRO 262 CO 0.02 -2.33 1.34 -0.25 0.04 0.00 0.00 177.00 175.83 2ibn n ASP 263 N -3.91 5.37 0.22 6.66 8.00 -1.26 -4.87 116.55 126.76 2ibn n ASP 263 Ca 0.06 -3.02 0.10 0.00 0.71 0.00 0.00 54.79 52.64 2ibn n ASP 263 Cb 0.57 -1.49 0.46 0.00 -0.02 0.00 0.00 41.12 40.64 2ibn n ASP 263 CO 0.00 0.00 0.00 -0.37 -0.39 0.00 0.00 177.20 176.44 2ibn h VAL 264 N 4.20 0.59 -0.43 2.53 -1.51 -2.00 -2.88 116.25 116.74 2ibn h VAL 264 Ca 0.27 -1.13 -0.10 0.00 -1.23 0.00 0.00 66.70 64.51 2ibn h VAL 264 Cb 0.85 1.76 -0.02 0.00 -2.13 0.00 0.00 31.29 31.75 2ibn h VAL 264 CO 1.18 0.23 -0.13 0.44 -1.23 0.00 0.00 177.57 178.07 2ibn h ASP 265 N 0.00 0.78 0.38 4.19 3.32 -2.02 -2.63 116.42 120.44 2ibn h ASP 265 Ca -0.00 -0.24 -0.03 0.00 0.02 0.00 0.00 57.03 56.77 2ibn h ASP 265 Cb 0.74 -0.21 -0.00 0.00 0.22 0.00 0.00 39.33 40.07 2ibn h ASP 265 CO 0.03 0.92 -0.16 0.11 -1.72 0.00 0.00 179.24 178.42 2ibn h LYS 266 N 0.71 0.00 0.00 3.56 1.57 -1.94 -2.97 116.57 117.49 2ibn h LYS 266 Ca 0.12 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.87 2ibn h LYS 266 Cb 0.61 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.92 2ibn h LYS 266 CO 0.04 0.16 -0.69 -0.07 -0.57 0.00 0.00 179.45 178.33 2ibn h LEU 267 N 0.00 0.00 -0.33 2.94 3.38 -1.56 -3.40 115.31 116.34 2ibn h LEU 267 Ca -0.00 0.00 0.07 0.00 0.09 0.00 0.00 57.88 58.04 2ibn h LEU 267 Cb 0.39 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.07 2ibn h LEU 267 CO 0.02 0.09 -0.11 0.03 0.09 0.00 0.00 178.44 178.56 2ibn h ARG 268 N 0.00 -0.04 -0.94 1.13 3.08 -1.32 -2.63 114.38 113.66 2ibn h ARG 268 Ca -0.02 0.00 0.03 0.00 0.07 0.00 0.00 59.98 60.07 2ibn h ARG 268 Cb 1.09 0.01 -0.05 0.00 0.08 0.00 0.00 29.97 31.09 2ibn h ARG 268 CO 0.01 -0.02 0.62 -1.35 -1.07 0.00 0.00 179.97 178.15 2ibn h PRO 269 N -0.04 1.15 -0.30 0.04 0.11 -1.79 0.26 132.00 131.44 2ibn h PRO 269 Ca 0.16 -0.07 -0.01 0.00 0.11 0.00 0.00 66.00 66.19 2ibn h PRO 269 Cb 0.29 -0.26 -0.01 0.00 0.11 0.00 0.00 31.00 31.12 2ibn h PRO 269 CO -0.36 0.76 0.15 -0.92 -0.21 0.00 0.00 178.00 177.42 2ibn h TYR 270 N 1.19 0.43 -0.15 0.65 3.20 -1.76 -1.88 116.97 118.65 2ibn h TYR 270 Ca 0.37 -0.02 -0.15 0.00 3.14 0.00 0.00 58.73 62.08 2ibn h TYR 270 Cb -0.00 -0.13 -0.01 0.00 1.54 0.00 0.00 36.73 38.13 2ibn h TYR 270 CO -0.00 0.38 -0.53 1.88 -1.64 0.00 0.00 178.16 178.25 2ibn h TYR 271 N 0.35 0.53 -0.85 -3.82 0.05 -1.18 -2.31 116.97 109.75 2ibn h TYR 271 Ca 0.10 -0.18 0.11 0.00 0.05 0.00 0.00 58.73 58.81 2ibn h TYR 271 Cb 0.11 -0.10 -0.08 0.00 1.01 0.00 0.00 36.73 37.67 2ibn h TYR 271 CO -0.02 0.86 0.48 0.37 -1.05 0.00 0.00 178.16 178.80 2ibn h GLN 272 N 0.33 0.75 -0.82 4.88 5.75 -0.27 -1.03 115.11 124.70 2ibn h GLN 272 Ca 0.01 -0.05 0.04 0.00 -0.15 0.00 0.00 58.65 58.50 2ibn h GLN 272 Cb 1.03 -0.17 -0.05 0.00 1.07 0.00 0.00 27.48 29.36 2ibn h GLN 272 CO 0.09 0.50 0.52 0.78 -2.65 0.00 0.00 178.83 178.06 2ibn h GLY 273 N 0.77 1.19 0.92 2.39 0.00 -0.80 -1.57 103.07 105.97 2ibn h GLY 273 Ca 0.42 -0.39 -0.06 0.00 0.00 0.00 0.00 47.33 47.30 2ibn h GLY 273 CO -0.27 0.31 -0.03 1.41 0.00 0.00 0.00 176.54 177.96 2ibn h LEU 274 N 0.99 0.63 -0.33 3.11 3.38 -1.10 -0.48 115.31 121.51 2ibn h LEU 274 Ca 0.33 -0.33 0.04 0.00 0.09 0.00 0.00 57.88 58.02 2ibn h LEU 274 Cb 0.05 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 40.59 2ibn h LEU 274 CO -0.13 0.81 0.08 0.40 0.09 0.00 0.00 178.44 179.70 2ibn h ILE 275 N 0.44 0.86 -0.65 1.22 2.04 -1.05 0.17 117.51 120.55 2ibn h ILE 275 Ca 0.10 -0.07 0.08 0.00 1.00 0.00 0.00 64.86 65.96 2ibn h ILE 275 Cb 0.51 0.64 -0.04 0.00 -0.74 0.00 0.00 36.82 37.18 2ibn h ILE 275 CO 0.02 0.04 0.43 0.44 0.00 0.00 0.00 178.15 179.08 2ibn h ASP 276 N 0.20 0.52 0.01 1.72 3.32 -0.99 0.35 116.42 121.55 2ibn h ASP 276 Ca 0.15 0.01 -0.21 0.00 0.02 0.00 0.00 57.03 57.00 2ibn h ASP 276 Cb 0.16 -0.10 0.02 0.00 0.22 0.00 0.00 39.33 39.62 2ibn h ASP 276 CO -0.19 0.33 -0.83 0.50 -1.72 0.00 0.00 179.24 177.33 2ibn h LYS 277 N 0.58 0.54 0.00 3.56 3.64 -0.51 -3.38 116.57 121.00 2ibn h LYS 277 Ca 0.29 -0.60 -0.02 0.00 -1.27 0.00 0.00 60.65 59.05 2ibn h LYS 277 Cb 0.37 0.17 -0.00 0.00 -0.41 0.00 0.00 32.23 32.36 2ibn h LYS 277 CO -0.09 1.22 -1.40 0.66 -2.27 0.00 0.00 179.45 177.56 2ibn n TYR 278 N -4.04 0.00 -2.78 1.91 4.01 -0.00 -4.86 117.16 111.40 2ibn n TYR 278 Ca -0.11 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.53 2ibn n TYR 278 Cb 0.78 -0.22 0.08 0.00 -0.31 0.00 0.00 39.34 39.67 2ibn n TYR 278 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2ibn s PRO 280 N -0.08 3.41 0.99 0.00 0.04 -0.80 -4.72 135.00 133.83 2ibn s PRO 280 Ca 0.24 1.17 0.00 0.00 0.04 0.00 0.00 61.00 62.45 2ibn s PRO 280 Cb 0.31 -2.05 0.00 0.00 0.04 0.00 0.00 34.50 32.80 2ibn s PRO 280 CO -0.06 -0.73 0.00 0.41 0.04 0.00 0.00 177.00 176.66 2ibn n GLY 281 N -1.08 -1.96 3.69 0.56 0.00 -1.26 -4.78 105.19 100.36 2ibn n GLY 281 Ca 0.08 -1.51 -0.42 0.00 0.00 0.00 0.00 46.02 44.17 2ibn n GLY 281 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2ibn s ILE 282 N 0.00 4.79 0.27 -0.61 1.09 -1.26 -4.30 121.20 121.18 2ibn s ILE 282 Ca 0.00 2.01 0.07 0.00 -1.10 0.00 0.00 60.65 61.63 2ibn s ILE 282 Cb 0.00 -4.30 -0.03 0.00 -1.06 0.00 0.00 42.46 37.07 2ibn s ILE 282 CO 0.00 0.01 0.23 -0.76 -0.10 0.00 0.00 174.94 174.31 2ibn s LEU 283 N 2.01 3.77 -0.24 2.97 1.43 -1.26 -4.95 118.68 122.42 2ibn s LEU 283 Ca 0.48 -0.30 -0.13 0.00 -1.03 0.00 0.00 54.13 53.14 2ibn s LEU 283 Cb -0.18 -2.33 -0.04 0.00 0.03 0.00 0.00 46.19 43.67 2ibn s LEU 283 CO 0.17 -0.12 0.28 -0.44 0.23 0.00 0.00 176.35 176.47 2ibn s SER 284 N -3.89 6.22 0.00 2.29 0.01 -1.26 -4.18 113.70 112.90 2ibn s SER 284 Ca 0.35 0.24 0.06 0.00 1.31 0.00 0.00 55.95 57.92 2ibn s SER 284 Cb -0.07 -2.17 0.05 0.00 0.21 0.00 0.00 66.02 64.04 2ibn s SER 284 CO 0.25 -0.05 0.70 0.79 0.41 0.00 0.00 173.24 175.35