#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3jrs n GLN 39 N 0.00 0.08 0.00 -2.82 6.02 -1.26 -3.67 117.38 115.73 3jrs n GLN 39 Ca 0.00 0.48 0.13 0.00 -0.01 0.00 0.00 57.00 57.60 3jrs n GLN 39 Cb 0.00 -1.71 0.29 0.00 1.02 0.00 0.00 30.24 29.84 3jrs n GLN 39 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 3jrs n LEU 40 N -1.88 1.50 -0.08 1.08 4.32 -1.26 -4.55 117.00 116.14 3jrs n LEU 40 Ca 0.01 -0.48 -0.08 0.00 -0.02 0.00 0.00 56.01 55.43 3jrs n LEU 40 Cb 0.09 -0.06 -0.02 0.00 -1.62 0.00 0.00 43.42 41.80 3jrs n LEU 40 CO 0.09 0.27 0.64 0.28 -1.22 0.00 0.00 177.39 177.46 3jrs h SER 41 N 1.98 -1.04 0.29 -1.43 0.02 -1.99 0.36 113.55 111.75 3jrs h SER 41 Ca 0.00 0.18 0.00 0.00 -0.84 0.00 0.00 61.79 61.13 3jrs h SER 41 Cb 0.60 0.48 -0.02 0.00 0.14 0.00 0.00 62.40 63.60 3jrs h SER 41 CO 0.00 -0.33 -0.28 -0.61 -1.14 0.00 0.00 176.83 174.47 3jrs h GLN 42 N -0.29 -0.58 -0.22 3.45 5.75 -1.90 0.83 115.11 122.15 3jrs h GLN 42 Ca 0.15 0.04 0.04 0.00 -0.15 0.00 0.00 58.65 58.73 3jrs h GLN 42 Cb 0.53 0.13 -0.04 0.00 1.07 0.00 0.00 27.48 29.18 3jrs h GLN 42 CO -0.48 -0.39 -0.03 0.77 -2.65 0.00 0.00 178.83 176.05 3jrs h SER 43 N -0.60 -0.16 -0.89 -0.69 0.02 -1.70 1.13 113.55 110.67 3jrs h SER 43 Ca -0.01 0.06 0.05 0.00 -0.84 0.00 0.00 61.79 61.05 3jrs h SER 43 Cb 0.55 0.12 -0.05 0.00 0.14 0.00 0.00 62.40 63.15 3jrs h SER 43 CO -0.05 -0.05 0.58 0.40 -1.14 0.00 0.00 176.83 176.57 3jrs h ILE 44 N 0.02 1.11 -0.51 3.27 2.04 0.11 0.11 117.51 123.67 3jrs h ILE 44 Ca 0.10 -0.36 -0.11 0.00 1.00 0.00 0.00 64.86 65.49 3jrs h ILE 44 Cb 0.15 -0.04 -0.02 0.00 -0.74 0.00 0.00 36.82 36.17 3jrs h ILE 44 CO -0.20 0.19 -0.11 0.00 0.00 0.00 0.00 178.15 178.03 3jrs h ALA 45 N 1.50 0.70 -0.17 1.87 0.00 0.19 -1.73 119.26 121.61 3jrs h ALA 45 Ca 0.37 -0.35 -0.20 0.00 0.00 0.00 0.00 54.91 54.73 3jrs h ALA 45 Cb 0.11 -0.18 0.01 0.00 0.00 0.00 0.00 17.79 17.73 3jrs h ALA 45 CO -0.12 0.60 -0.69 1.49 0.00 0.00 0.00 179.25 180.53 3jrs h GLU 46 N 0.83 0.77 0.00 0.00 4.81 0.23 -3.39 114.58 117.83 3jrs h GLU 46 Ca 0.13 -0.60 0.00 0.00 -0.13 0.00 0.00 59.36 58.76 3jrs h GLU 46 Cb 0.67 0.12 0.00 0.00 0.63 0.00 0.00 28.75 30.17 3jrs h GLU 46 CO 0.05 1.21 -0.75 1.19 -0.73 0.00 0.00 179.01 179.98 3jrs n PHE 47 N -4.01 0.00 -1.75 0.92 3.72 0.30 -4.77 117.46 111.87 3jrs n PHE 47 Ca -0.07 0.00 0.05 0.00 -0.05 0.00 0.00 57.45 57.38 3jrs n PHE 47 Cb 0.70 -0.04 0.10 0.00 -0.94 0.00 0.00 39.48 39.30 3jrs n PHE 47 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 176.76 177.43 3jrs n HIS 48 N -1.39 0.00 -4.49 1.38 8.25 -0.68 -4.90 115.22 113.39 3jrs n HIS 48 Ca -0.00 -0.77 -0.34 0.00 -0.26 0.00 0.00 57.72 56.35 3jrs n HIS 48 Cb 0.06 -0.15 -0.12 0.00 1.12 0.00 0.00 29.99 30.90 3jrs n HIS 48 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 3jrs s THR 49 N -1.62 3.79 0.13 1.59 2.01 -1.03 -4.90 115.64 115.61 3jrs s THR 49 Ca 0.26 -0.41 0.08 0.00 0.31 0.00 0.00 61.69 61.93 3jrs s THR 49 Cb 0.26 -2.62 -0.04 0.00 0.01 0.00 0.00 72.50 70.11 3jrs s THR 49 CO -0.05 0.53 -0.20 -0.31 -0.69 0.00 0.00 174.62 173.91 3jrs s TYR 50 N 0.01 1.81 0.00 4.92 1.51 -1.26 -5.05 117.35 119.28 3jrs s TYR 50 Ca -0.00 -0.44 0.00 0.00 -1.01 0.00 0.00 57.07 55.62 3jrs s TYR 50 Cb -0.13 -0.95 0.00 0.00 -0.11 0.00 0.00 41.96 40.77 3jrs s TYR 50 CO 0.03 0.27 0.00 1.04 -1.11 0.00 0.00 175.55 175.78 3jrs n GLN 51 N 0.69 0.00 0.00 -0.62 6.02 -1.26 -5.14 117.38 117.07 3jrs n GLN 51 Ca -0.16 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.83 3jrs n GLN 51 Cb 0.55 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.81 3jrs n GLN 51 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3jrs n GLY 55 N 0.00 0.00 3.88 1.08 0.00 -1.26 -5.03 105.19 103.86 3jrs n GLY 55 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 3jrs n GLY 55 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3jrs s ARG 56 N 0.00 3.70 -0.02 1.61 0.52 -1.26 -2.38 118.95 121.13 3jrs s ARG 56 Ca 0.00 0.09 0.01 0.00 -0.52 0.00 0.00 55.73 55.31 3jrs s ARG 56 Cb 0.00 -2.98 0.01 0.00 0.52 0.00 0.00 34.95 32.50 3jrs s ARG 56 CO 0.00 0.55 -0.03 0.00 0.02 0.00 0.00 175.30 175.84 3jrs s SER 58 N 0.42 1.07 -0.10 0.00 1.04 -1.26 -1.32 113.70 113.55 3jrs s SER 58 Ca -0.04 -0.86 -0.20 0.00 0.48 0.00 0.00 55.95 55.32 3jrs s SER 58 Cb -0.08 0.07 0.05 0.00 0.10 0.00 0.00 66.02 66.16 3jrs s SER 58 CO -0.01 -0.38 0.48 -0.55 0.98 0.00 0.00 173.24 173.77 3jrs s SER 59 N -2.59 -0.45 -0.08 7.02 0.15 -1.12 -4.99 113.70 111.64 3jrs s SER 59 Ca 0.05 0.65 0.04 0.00 0.70 0.00 0.00 55.95 57.39 3jrs s SER 59 Cb 0.00 0.69 0.00 0.00 -1.71 0.00 0.00 66.02 65.00 3jrs s SER 59 CO -0.03 -0.36 -0.21 -0.22 1.20 0.00 0.00 173.24 173.61 3jrs s LEU 60 N -0.58 1.99 0.11 3.45 2.96 -1.26 -1.55 118.68 123.80 3jrs s LEU 60 Ca -0.07 -0.49 0.09 0.00 -0.22 0.00 0.00 54.13 53.44 3jrs s LEU 60 Cb -0.03 -1.26 -0.04 0.00 0.50 0.00 0.00 46.19 45.36 3jrs s LEU 60 CO 0.04 0.15 -0.17 -0.76 -1.32 0.00 0.00 176.35 174.29 3jrs s LEU 61 N 0.31 2.75 0.05 -0.68 1.02 0.46 -4.99 118.68 117.60 3jrs s LEU 61 Ca -0.15 -0.53 0.05 0.00 0.02 0.00 0.00 54.13 53.52 3jrs s LEU 61 Cb -0.16 -1.59 -0.02 0.00 0.02 0.00 0.00 46.19 44.43 3jrs s LEU 61 CO 0.07 0.18 -0.14 0.00 0.02 0.00 0.00 176.35 176.47 3jrs s ALA 62 N -1.15 1.20 -0.11 4.21 0.00 -1.26 -1.25 121.76 123.39 3jrs s ALA 62 Ca 0.18 -0.90 -0.05 0.00 0.00 0.00 0.00 51.96 51.19 3jrs s ALA 62 Cb -0.11 -0.16 0.05 0.00 0.00 0.00 0.00 23.12 22.91 3jrs s ALA 62 CO 0.11 0.21 0.25 -1.14 0.00 0.00 0.00 175.76 175.18 3jrs s GLN 63 N -1.38 0.18 0.16 0.00 2.00 -0.57 -4.98 119.66 115.07 3jrs s GLN 63 Ca 0.01 0.62 -0.24 0.00 -2.00 0.00 0.00 55.36 53.75 3jrs s GLN 63 Cb -0.09 -0.09 -0.08 0.00 0.80 0.00 0.00 33.01 33.55 3jrs s GLN 63 CO 0.02 -0.22 0.75 0.50 -0.50 0.00 0.00 175.29 175.84 3jrs s ARG 64 N 1.77 4.51 -0.05 1.67 3.52 -1.26 -1.50 118.95 127.61 3jrs s ARG 64 Ca -0.05 1.09 0.01 0.00 -0.13 0.00 0.00 55.73 56.66 3jrs s ARG 64 Cb -0.11 -3.22 0.02 0.00 -1.56 0.00 0.00 34.95 30.08 3jrs s ARG 64 CO -0.08 0.56 -0.05 0.42 -0.81 0.00 0.00 175.30 175.34 3jrs s ILE 65 N -1.18 0.59 -1.27 4.11 1.01 -0.43 -4.96 121.20 119.07 3jrs s ILE 65 Ca 0.36 -0.15 -0.07 0.00 0.00 0.00 0.00 60.65 60.80 3jrs s ILE 65 Cb -0.22 -0.61 0.16 0.00 0.01 0.00 0.00 42.46 41.80 3jrs s ILE 65 CO 0.25 0.24 2.10 1.41 0.00 0.00 0.00 174.94 178.94 3jrs n HIS 66 N 4.09 2.70 -3.61 3.97 8.25 -1.26 -1.28 115.22 128.08 3jrs n HIS 66 Ca -0.24 -2.78 -0.11 0.00 -0.26 0.00 0.00 57.72 54.34 3jrs n HIS 66 Cb 0.51 -1.80 -0.04 0.00 1.12 0.00 0.00 29.99 29.77 3jrs n HIS 66 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3jrs s ALA 67 N -0.85 -1.00 0.41 -1.41 0.00 -1.26 -4.63 121.76 113.03 3jrs s ALA 67 Ca 0.46 0.01 -0.24 0.00 0.00 0.00 0.00 51.96 52.19 3jrs s ALA 67 Cb 0.14 0.71 -0.08 0.00 0.00 0.00 0.00 23.12 23.89 3jrs s ALA 67 CO -0.04 -0.65 1.13 -2.14 0.00 0.00 0.00 175.76 174.06 3jrs s PRO 68 N -3.78 4.01 0.37 0.00 0.02 -1.26 -2.71 135.00 131.65 3jrs s PRO 68 Ca 0.03 1.73 0.05 0.00 0.02 0.00 0.00 61.00 62.83 3jrs s PRO 68 Cb 0.02 -2.57 0.73 0.00 0.02 0.00 0.00 34.50 32.69 3jrs s PRO 68 CO -0.12 -0.33 2.00 -1.00 -0.33 0.00 0.00 177.00 177.23 3jrs h PRO 69 N 2.46 0.64 -0.77 5.54 0.13 -1.89 -2.02 132.00 136.08 3jrs h PRO 69 Ca -0.49 -0.06 0.01 0.00 -0.87 0.00 0.00 66.00 64.60 3jrs h PRO 69 Cb 1.23 -0.13 -0.04 0.00 0.13 0.00 0.00 31.00 32.19 3jrs h PRO 69 CO 0.62 0.47 0.51 1.49 -0.23 0.00 0.00 178.00 180.85 3jrs h GLU 70 N 0.65 1.00 -0.52 0.86 4.22 -1.98 0.15 114.58 118.95 3jrs h GLU 70 Ca 0.17 -0.06 0.04 0.00 0.08 0.00 0.00 59.36 59.59 3jrs h GLU 70 Cb 0.01 -0.23 -0.04 0.00 0.50 0.00 0.00 28.75 28.99 3jrs h GLU 70 CO -0.03 0.66 0.27 1.15 -2.18 0.00 0.00 179.01 178.88 3jrs h THR 71 N 1.03 0.96 -0.26 0.32 2.02 -1.75 0.90 112.91 116.12 3jrs h THR 71 Ca 0.29 -0.18 -0.11 0.00 0.77 0.00 0.00 66.41 67.18 3jrs h THR 71 Cb -0.09 0.40 -0.00 0.00 -1.74 0.00 0.00 68.15 66.71 3jrs h THR 71 CO -0.07 0.10 -0.25 0.58 0.37 0.00 0.00 175.52 176.24 3jrs h VAL 72 N 0.52 1.31 -0.78 3.16 2.07 -1.13 -3.00 116.25 118.39 3jrs h VAL 72 Ca 0.23 -1.41 -0.03 0.00 0.82 0.00 0.00 66.70 66.31 3jrs h VAL 72 Cb 0.13 1.62 -0.04 0.00 -1.52 0.00 0.00 31.29 31.49 3jrs h VAL 72 CO -0.16 0.45 0.37 -0.25 0.02 0.00 0.00 177.57 178.00 3jrs h TRP 73 N 0.36 1.12 0.00 1.57 2.91 -0.44 -1.76 115.95 119.70 3jrs h TRP 73 Ca 0.04 -0.05 -0.00 0.00 1.13 0.00 0.00 58.89 60.01 3jrs h TRP 73 Cb 0.81 -0.35 -0.00 0.00 -0.51 0.00 0.00 29.16 29.11 3jrs h TRP 73 CO 0.07 0.81 -0.00 0.66 -1.03 0.00 0.00 178.44 178.95 3jrs h SER 74 N 1.11 0.00 0.10 2.65 4.64 -0.68 -0.31 113.55 121.06 3jrs h SER 74 Ca 0.27 0.00 -0.28 0.00 -0.47 0.00 0.00 61.79 61.31 3jrs h SER 74 Cb 0.11 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.19 3jrs h SER 74 CO -0.03 0.00 -1.48 0.58 -0.87 0.00 0.00 176.83 175.03 3jrs h VAL 75 N 0.00 0.95 -0.80 0.95 2.07 -1.39 -3.38 116.25 114.65 3jrs h VAL 75 Ca -0.00 -2.36 0.07 0.00 0.82 0.00 0.00 66.70 65.23 3jrs h VAL 75 Cb 0.01 2.61 -0.06 0.00 -1.52 0.00 0.00 31.29 32.33 3jrs h VAL 75 CO 0.00 0.68 0.48 0.58 0.02 0.00 0.00 177.57 179.33 3jrs h VAL 76 N -0.34 1.00 0.00 2.57 2.07 -0.96 -2.95 116.25 117.64 3jrs h VAL 76 Ca -0.33 -0.30 0.00 0.00 0.82 0.00 0.00 66.70 66.90 3jrs h VAL 76 Cb 1.74 0.06 0.00 0.00 -1.52 0.00 0.00 31.29 31.57 3jrs h VAL 76 CO 0.02 0.16 0.00 0.08 0.02 0.00 0.00 177.57 177.85 3jrs h ARG 77 N 0.86 0.00 -5.61 1.57 0.11 -1.27 -3.41 114.38 106.64 3jrs h ARG 77 Ca 0.36 0.00 -0.67 0.00 0.10 0.00 0.00 59.98 59.77 3jrs h ARG 77 Cb 0.20 0.00 -0.12 0.00 1.11 0.00 0.00 29.97 31.17 3jrs h ARG 77 CO -0.19 0.00 1.67 1.03 0.10 0.00 0.00 179.97 182.58 3jrs s ARG 78 N -3.29 3.85 0.53 0.08 1.81 -1.12 -4.77 118.95 116.04 3jrs s ARG 78 Ca 0.06 -1.84 0.19 0.00 -1.72 0.00 0.00 55.73 52.42 3jrs s ARG 78 Cb 0.10 -5.32 1.36 0.00 -0.45 0.00 0.00 34.95 30.65 3jrs s ARG 78 CO 0.51 -2.09 2.16 0.35 -0.68 0.00 0.00 175.30 175.55 3jrs h PHE 79 N 8.28 0.00 -0.00 -0.53 3.57 -1.88 0.40 116.94 126.78 3jrs h PHE 79 Ca 0.32 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.82 3jrs h PHE 79 Cb 0.93 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.67 3jrs h PHE 79 CO 1.29 0.00 -0.02 -0.40 -2.23 0.00 0.00 178.31 176.95 3jrs n ASP 80 N -4.42 0.12 -2.53 0.41 5.75 -1.26 -4.10 116.55 110.52 3jrs n ASP 80 Ca -0.02 -0.42 -0.14 0.00 -0.01 0.00 0.00 54.79 54.19 3jrs n ASP 80 Cb 0.12 -0.18 0.03 0.00 -1.03 0.00 0.00 41.12 40.06 3jrs n ASP 80 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 3jrs n ARG 81 N -1.14 2.36 0.29 0.11 1.74 0.14 -4.84 116.66 115.32 3jrs n ARG 81 Ca 0.16 -3.81 0.17 0.00 -0.77 0.00 0.00 57.85 53.60 3jrs n ARG 81 Cb 0.23 -1.79 0.96 0.00 -1.02 0.00 0.00 32.46 30.83 3jrs n ARG 81 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 3jrs h PRO 82 N 2.63 0.00 0.00 5.56 0.13 -1.71 -2.18 132.00 136.43 3jrs h PRO 82 Ca 0.09 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.22 3jrs h PRO 82 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 3jrs h PRO 82 CO 0.56 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.33 3jrs n GLN 83 N -3.69 0.11 0.00 0.86 0.00 -1.26 -0.54 117.38 112.87 3jrs n GLN 83 Ca -0.02 0.51 -0.06 0.00 0.00 0.00 0.00 57.00 57.42 3jrs n GLN 83 Cb 0.12 -1.79 0.13 0.00 0.00 0.00 0.00 30.24 28.70 3jrs n GLN 83 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.06 177.88 3jrs h ILE 84 N 0.00 1.30 0.00 -0.39 1.08 -1.74 -3.37 117.51 114.39 3jrs h ILE 84 Ca 0.00 -1.51 0.00 0.00 -0.39 0.00 0.00 64.86 62.96 3jrs h ILE 84 Cb 0.13 1.53 0.00 0.00 -3.07 0.00 0.00 36.82 35.41 3jrs h ILE 84 CO 0.00 0.48 -0.07 0.00 -0.69 0.00 0.00 178.15 177.86 3jrs n TYR 85 N -4.04 0.00 -2.79 1.37 4.11 -0.67 -4.95 117.16 110.20 3jrs n TYR 85 Ca -0.01 0.00 -0.42 0.00 -0.00 0.00 0.00 57.90 57.47 3jrs n TYR 85 Cb 0.49 0.00 -0.03 0.00 -0.00 0.00 0.00 39.34 39.80 3jrs n TYR 85 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 176.86 177.01 3jrs s LYS 86 N -0.69 4.38 0.21 -3.48 1.02 0.30 -3.96 119.74 117.52 3jrs s LYS 86 Ca 0.00 1.22 -0.09 0.00 0.02 0.00 0.00 55.97 57.12 3jrs s LYS 86 Cb 0.00 -3.55 0.29 0.00 -0.52 0.00 0.00 37.83 34.05 3jrs s LYS 86 CO 0.00 -0.29 1.76 1.25 -0.92 0.00 0.00 175.35 177.14 3jrs h HIS 87 N 7.16 0.48 -0.25 3.18 -0.00 -1.87 -2.75 115.15 121.09 3jrs h HIS 87 Ca -0.31 0.03 0.00 0.00 -0.00 0.00 0.00 60.37 60.09 3jrs h HIS 87 Cb 1.14 -0.12 0.00 0.00 -0.00 0.00 0.00 27.41 28.44 3jrs h HIS 87 CO 0.71 0.15 0.00 1.19 -0.00 0.00 0.00 177.93 179.98 3jrs n PHE 88 N -4.95 0.32 -2.88 5.26 3.72 -1.26 -4.94 117.46 112.73 3jrs n PHE 88 Ca 0.09 -0.21 -0.42 0.00 -0.05 0.00 0.00 57.45 56.86 3jrs n PHE 88 Cb 0.27 -0.01 -0.04 0.00 -0.94 0.00 0.00 39.48 38.76 3jrs n PHE 88 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 3jrs s ILE 89 N -1.30 4.80 -0.08 4.37 1.01 -1.04 -1.02 121.20 127.95 3jrs s ILE 89 Ca 0.28 1.52 -0.09 0.00 0.00 0.00 0.00 60.65 62.36 3jrs s ILE 89 Cb 0.17 -4.15 -0.29 0.00 0.01 0.00 0.00 42.46 38.21 3jrs s ILE 89 CO 0.24 -0.14 0.54 0.11 0.00 0.00 0.00 174.94 175.70 3jrs h LYS 90 N 7.78 0.33 -3.50 2.79 1.57 -0.96 -3.44 116.57 121.15 3jrs h LYS 90 Ca -0.23 -0.57 -0.03 0.00 -1.87 0.00 0.00 60.65 57.94 3jrs h LYS 90 Cb 1.09 0.21 -0.08 0.00 0.08 0.00 0.00 32.23 33.53 3jrs h LYS 90 CO 0.89 1.26 -0.03 -1.54 -0.57 0.00 0.00 179.45 179.46 3jrs s SER 91 N -7.17 -0.09 -0.03 0.86 1.04 -1.12 -4.98 113.70 102.20 3jrs s SER 91 Ca -0.18 -0.88 -0.01 0.00 0.48 0.00 0.00 55.95 55.36 3jrs s SER 91 Cb 0.06 0.63 0.03 0.00 0.10 0.00 0.00 66.02 66.84 3jrs s SER 91 CO 0.82 -1.21 0.05 0.00 0.98 0.00 0.00 173.24 173.88 3jrs s ASN 93 N 1.21 4.30 0.30 0.00 0.02 0.87 -4.97 114.94 116.68 3jrs s ASN 93 Ca -0.07 -0.13 -0.01 0.00 -1.02 0.00 0.00 52.86 51.62 3jrs s ASN 93 Cb -0.13 -1.07 -0.02 0.00 0.02 0.00 0.00 41.25 40.06 3jrs s ASN 93 CO -0.03 0.33 0.35 0.54 0.02 0.00 0.00 177.10 178.31 3jrs s VAL 94 N -0.63 0.00 0.74 1.60 0.11 -1.26 -0.36 120.40 120.60 3jrs s VAL 94 Ca 0.09 -1.76 -0.05 0.00 -2.93 0.00 0.00 61.98 57.33 3jrs s VAL 94 Cb -0.11 -2.52 0.11 0.00 -1.53 0.00 0.00 36.38 32.32 3jrs s VAL 94 CO 0.01 0.00 1.04 -0.94 -3.33 0.00 0.00 175.10 171.88 3jrs s SER 95 N -3.23 4.36 0.35 3.54 1.04 -1.26 -5.04 113.70 113.45 3jrs s SER 95 Ca 0.34 0.04 -0.28 0.00 0.48 0.00 0.00 55.95 56.52 3jrs s SER 95 Cb 0.02 -0.49 -0.12 0.00 0.10 0.00 0.00 66.02 65.53 3jrs s SER 95 CO 0.19 -1.87 1.36 -0.62 0.98 0.00 0.00 173.24 173.29 3jrs n GLU 96 N -2.98 2.30 -3.70 4.02 -0.58 -1.26 -3.39 120.64 115.05 3jrs n GLU 96 Ca 0.12 0.81 -0.22 0.00 -0.42 0.00 0.00 57.16 57.45 3jrs n GLU 96 Cb 0.60 -2.44 0.03 0.00 -0.57 0.00 0.00 31.44 29.06 3jrs n GLU 96 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 3jrs n ASP 97 N 0.77 -1.40 -4.53 1.62 8.00 -1.26 -4.57 116.55 115.19 3jrs n ASP 97 Ca 0.04 -0.83 -0.56 0.00 0.71 0.00 0.00 54.79 54.15 3jrs n ASP 97 Cb 0.37 -4.03 -0.07 0.00 -0.02 0.00 0.00 41.12 37.37 3jrs n ASP 97 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 3jrs n PHE 98 N -4.25 0.87 -3.05 1.24 7.35 -1.22 -4.88 117.46 113.53 3jrs n PHE 98 Ca -0.29 0.91 -0.44 0.00 -0.76 0.00 0.00 57.45 56.87 3jrs n PHE 98 Cb 0.67 -2.16 -0.04 0.00 0.35 0.00 0.00 39.48 38.30 3jrs n PHE 98 CO 0.00 0.00 0.00 -1.21 -0.76 0.00 0.00 176.76 174.79 3jrs s GLU 99 N 0.07 3.09 -0.95 -4.13 2.02 -1.26 -5.02 118.70 112.52 3jrs s GLU 99 Ca 0.87 -1.25 -0.24 0.00 0.02 0.00 0.00 54.97 54.37 3jrs s GLU 99 Cb -1.14 -4.29 0.04 0.00 0.10 0.00 0.00 34.13 28.84 3jrs s GLU 99 CO 0.54 -1.61 1.47 1.41 0.02 0.00 0.00 175.26 177.08 3jrs s MET 100 N 2.96 3.41 -0.01 1.61 1.75 -1.26 -4.70 119.30 123.05 3jrs s MET 100 Ca 0.15 -0.85 -0.05 0.00 -1.25 0.00 0.00 55.69 53.69 3jrs s MET 100 Cb -0.21 -5.10 0.00 0.00 2.84 0.00 0.00 34.83 32.36 3jrs s MET 100 CO 0.06 -2.31 0.10 1.03 -0.65 0.00 0.00 175.02 173.25 3jrs s ARG 101 N 5.33 0.32 0.16 4.11 0.52 -1.26 -5.08 118.95 123.06 3jrs s ARG 101 Ca 0.46 -0.24 -0.32 0.00 -0.52 0.00 0.00 55.73 55.12 3jrs s ARG 101 Cb -0.02 0.13 -0.17 0.00 0.52 0.00 0.00 34.95 35.41 3jrs s ARG 101 CO -0.04 -0.07 0.84 0.28 0.02 0.00 0.00 175.30 176.33 3jrs n VAL 102 N 2.05 1.32 0.00 3.52 0.31 -1.26 -0.71 118.33 123.55 3jrs n VAL 102 Ca -0.19 -0.33 0.00 0.00 -0.01 0.00 0.00 64.34 63.81 3jrs n VAL 102 Cb 0.57 -0.31 0.00 0.00 -0.91 0.00 0.00 33.84 33.19 3jrs n VAL 102 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3jrs n GLY 103 N 1.80 2.51 3.75 2.92 0.00 0.87 -4.99 105.19 112.05 3jrs n GLY 103 Ca 0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 3jrs n GLY 103 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3jrs s THR 105 N -2.85 1.85 0.02 0.00 -4.23 -1.26 -0.52 115.64 108.65 3jrs s THR 105 Ca 0.62 -2.13 -0.14 0.00 -1.18 0.00 0.00 61.69 58.87 3jrs s THR 105 Cb -0.18 -2.62 0.02 0.00 1.34 0.00 0.00 72.50 71.06 3jrs s THR 105 CO 0.56 -0.20 0.29 0.00 -0.54 0.00 0.00 174.62 174.73 3jrs s ARG 106 N -3.70 0.74 -0.18 3.99 1.70 -0.52 -4.75 118.95 116.22 3jrs s ARG 106 Ca 0.32 -0.40 -0.04 0.00 -0.47 0.00 0.00 55.73 55.14 3jrs s ARG 106 Cb 0.05 0.32 -0.02 0.00 -0.57 0.00 0.00 34.95 34.72 3jrs s ARG 106 CO 0.15 -0.22 -0.04 -0.51 -1.08 0.00 0.00 175.30 173.59 3jrs s ASP 107 N -1.77 4.60 0.00 -2.89 1.01 0.51 -1.31 116.67 116.81 3jrs s ASP 107 Ca -0.08 -0.23 0.01 0.00 0.71 0.00 0.00 52.55 52.95 3jrs s ASP 107 Cb -0.03 -1.76 -0.04 0.00 1.01 0.00 0.00 42.92 42.10 3jrs s ASP 107 CO -0.00 0.10 0.04 0.68 0.21 0.00 0.00 175.17 176.20 3jrs s VAL 108 N 0.76 4.45 -0.11 -1.27 -7.23 -0.01 -0.09 120.40 116.90 3jrs s VAL 108 Ca -0.02 -0.51 -0.01 0.00 -1.81 0.00 0.00 61.98 59.63 3jrs s VAL 108 Cb -0.15 -3.02 -0.03 0.00 0.56 0.00 0.00 36.38 33.75 3jrs s VAL 108 CO 0.02 0.35 -0.08 0.20 -0.31 0.00 0.00 175.10 175.29 3jrs s ASN 109 N -1.68 4.52 0.29 4.85 0.01 0.11 -1.78 114.94 121.26 3jrs s ASN 109 Ca 0.21 -0.13 0.12 0.00 -0.71 0.00 0.00 52.86 52.35 3jrs s ASN 109 Cb -0.12 -1.43 -0.05 0.00 0.41 0.00 0.00 41.25 40.06 3jrs s ASN 109 CO 0.12 0.26 -0.18 0.68 -1.51 0.00 0.00 177.10 176.47 3jrs s VAL 110 N -0.19 2.50 0.84 1.60 -7.23 -0.85 -0.28 120.40 116.79 3jrs s VAL 110 Ca 0.02 -2.37 -0.12 0.00 -1.81 0.00 0.00 61.98 57.70 3jrs s VAL 110 Cb -0.13 -2.36 0.10 0.00 0.56 0.00 0.00 36.38 34.56 3jrs s VAL 110 CO 0.03 -0.38 1.17 0.27 -0.31 0.00 0.00 175.10 175.87 3jrs s ILE 111 N -2.51 2.23 0.70 -0.62 -4.36 -0.19 -4.82 121.20 111.63 3jrs s ILE 111 Ca 0.30 0.09 -0.14 0.00 -0.26 0.00 0.00 60.65 60.64 3jrs s ILE 111 Cb -0.04 -2.35 0.02 0.00 1.25 0.00 0.00 42.46 41.34 3jrs s ILE 111 CO 0.15 -0.09 1.13 -0.44 0.24 0.00 0.00 174.94 175.94 3jrs s SER 112 N -2.51 4.76 0.00 4.36 0.01 -1.26 -4.23 113.70 114.83 3jrs s SER 112 Ca 0.69 2.07 0.00 0.00 1.31 0.00 0.00 55.95 60.02 3jrs s SER 112 Cb -0.25 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.43 3jrs s SER 112 CO 0.54 -1.87 0.00 0.61 0.41 0.00 0.00 173.24 172.93 3jrs n GLY 113 N -0.35 0.68 3.96 3.44 0.00 -1.26 -5.11 105.19 106.55 3jrs n GLY 113 Ca 0.11 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.94 3jrs n GLY 113 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3jrs s LEU 114 N 0.00 3.58 0.49 0.99 1.43 -1.26 -5.03 118.68 118.88 3jrs s LEU 114 Ca 0.00 -0.53 0.22 0.00 -1.03 0.00 0.00 54.13 52.79 3jrs s LEU 114 Cb 0.00 -2.43 1.26 0.00 0.03 0.00 0.00 46.19 45.05 3jrs s LEU 114 CO 0.00 -0.69 2.03 -0.65 0.23 0.00 0.00 176.35 177.27 3jrs h PRO 115 N 0.81 0.00 -4.60 1.29 0.11 -1.99 -3.41 132.00 124.21 3jrs h PRO 115 Ca -0.41 0.00 -0.24 0.00 0.11 0.00 0.00 66.00 65.46 3jrs h PRO 115 Cb 1.27 0.00 -0.18 0.00 0.11 0.00 0.00 31.00 32.20 3jrs h PRO 115 CO 0.50 0.16 -0.71 0.00 -0.21 0.00 0.00 178.00 177.73 3jrs s ALA 116 N -4.35 0.77 -1.32 -0.75 0.00 -1.26 -4.98 121.76 109.88 3jrs s ALA 116 Ca -0.03 -1.07 0.11 0.00 0.00 0.00 0.00 51.96 50.97 3jrs s ALA 116 Cb 0.14 0.11 0.08 0.00 0.00 0.00 0.00 23.12 23.44 3jrs s ALA 116 CO 0.63 -0.13 0.82 0.27 0.00 0.00 0.00 175.76 177.35 3jrs n ASN 117 N 0.68 1.83 -3.98 0.00 2.04 -1.26 -4.85 115.26 109.71 3jrs n ASN 117 Ca -0.17 -1.41 -0.09 0.00 -0.44 0.00 0.00 54.58 52.47 3jrs n ASN 117 Cb 0.58 0.06 -0.10 0.00 -2.53 0.00 0.00 39.78 37.79 3jrs n ASN 117 CO 0.00 0.00 0.00 0.28 -0.44 0.00 0.00 177.26 177.10 3jrs s THR 118 N -0.97 0.14 -0.03 5.53 -1.32 -1.26 -2.01 115.64 115.72 3jrs s THR 118 Ca 0.12 -1.17 -0.01 0.00 -1.21 0.00 0.00 61.69 59.43 3jrs s THR 118 Cb 0.09 -0.79 0.02 0.00 -1.51 0.00 0.00 72.50 70.31 3jrs s THR 118 CO 0.15 -0.64 0.06 -0.55 -2.21 0.00 0.00 174.62 171.43 3jrs s SER 119 N -2.03 -0.02 -0.24 8.08 0.15 -0.73 -4.98 113.70 113.92 3jrs s SER 119 Ca -0.07 0.11 -0.08 0.00 0.70 0.00 0.00 55.95 56.61 3jrs s SER 119 Cb -0.02 0.05 -0.03 0.00 -1.71 0.00 0.00 66.02 64.30 3jrs s SER 119 CO -0.04 -0.08 0.09 -0.60 1.20 0.00 0.00 173.24 173.81 3jrs s ARG 120 N 0.60 3.75 0.12 5.44 6.06 -1.26 -0.83 118.95 132.84 3jrs s ARG 120 Ca -0.05 -0.43 0.05 0.00 -2.50 0.00 0.00 55.73 52.80 3jrs s ARG 120 Cb -0.07 -3.37 -0.04 0.00 0.06 0.00 0.00 34.95 31.54 3jrs s ARG 120 CO -0.02 -0.12 -0.12 -1.21 -2.50 0.00 0.00 175.30 171.33 3jrs s GLU 121 N 1.45 0.99 -0.02 5.12 2.02 -0.43 -0.45 118.70 127.38 3jrs s GLU 121 Ca 0.06 -1.26 0.05 0.00 0.02 0.00 0.00 54.97 53.84 3jrs s GLU 121 Cb -0.15 -0.75 -0.01 0.00 0.10 0.00 0.00 34.13 33.32 3jrs s GLU 121 CO 0.05 0.13 -0.18 0.50 0.02 0.00 0.00 175.26 175.77 3jrs s ARG 122 N -2.92 1.62 -0.22 1.61 3.52 0.07 -1.44 118.95 121.19 3jrs s ARG 122 Ca 0.10 -0.66 -0.27 0.00 -0.13 0.00 0.00 55.73 54.77 3jrs s ARG 122 Cb -0.03 -1.51 -0.00 0.00 -1.56 0.00 0.00 34.95 31.85 3jrs s ARG 122 CO 0.02 0.36 0.91 -1.17 -0.81 0.00 0.00 175.30 174.61 3jrs s LEU 123 N -0.30 4.11 -0.22 -0.88 2.96 0.32 -1.52 118.68 123.16 3jrs s LEU 123 Ca 0.04 1.21 0.02 0.00 -0.22 0.00 0.00 54.13 55.17 3jrs s LEU 123 Cb -0.09 -3.34 -0.20 0.00 0.50 0.00 0.00 46.19 43.06 3jrs s LEU 123 CO 0.00 -0.55 -0.04 0.47 -1.32 0.00 0.00 176.35 174.91 3jrs n ASP 124 N 5.92 1.83 -3.96 3.68 8.00 0.22 -0.09 116.55 132.15 3jrs n ASP 124 Ca 0.08 -0.03 -0.10 0.00 0.71 0.00 0.00 54.79 55.45 3jrs n ASP 124 Cb 0.47 -0.40 -0.12 0.00 -0.02 0.00 0.00 41.12 41.06 3jrs n ASP 124 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3jrs s LEU 125 N -6.55 2.17 -0.30 0.64 1.43 -0.92 -4.81 118.68 110.35 3jrs s LEU 125 Ca -0.29 -0.40 -0.02 0.00 -1.03 0.00 0.00 54.13 52.39 3jrs s LEU 125 Cb 0.08 0.10 0.19 0.00 0.03 0.00 0.00 46.19 46.59 3jrs s LEU 125 CO 0.66 -0.25 0.64 -0.22 0.23 0.00 0.00 176.35 177.42 3jrs s LEU 126 N -1.19 -1.31 -0.24 1.79 2.96 -1.25 -2.39 118.68 117.05 3jrs s LEU 126 Ca -0.13 0.78 -0.00 0.00 -0.22 0.00 0.00 54.13 54.56 3jrs s LEU 126 Cb -0.08 2.09 0.07 0.00 0.50 0.00 0.00 46.19 48.76 3jrs s LEU 126 CO -0.01 -0.25 0.01 -0.62 -1.32 0.00 0.00 176.35 174.16 3jrs s ASP 127 N 2.87 3.63 0.28 3.68 -1.08 -0.16 -4.98 116.67 120.91 3jrs s ASP 127 Ca 0.18 -1.19 0.25 0.00 -0.52 0.00 0.00 52.55 51.27 3jrs s ASP 127 Cb -0.14 -0.96 0.72 0.00 -1.46 0.00 0.00 42.92 41.08 3jrs s ASP 127 CO -0.20 -0.30 1.74 0.44 0.52 0.00 0.00 175.17 177.37 3jrs h ASP 128 N 8.05 0.00 -0.07 -0.34 3.32 -1.97 0.14 116.42 125.55 3jrs h ASP 128 Ca -0.16 0.00 -0.24 0.00 0.02 0.00 0.00 57.03 56.65 3jrs h ASP 128 Cb 1.07 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.64 3jrs h ASP 128 CO 0.40 0.00 -0.89 0.44 -1.72 0.00 0.00 179.24 177.48 3jrs h ASP 129 N 0.00 0.91 -0.01 6.45 3.32 -1.97 -3.36 116.42 121.77 3jrs h ASP 129 Ca 0.00 -0.65 0.00 0.00 0.02 0.00 0.00 57.03 56.40 3jrs h ASP 129 Cb 0.77 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 40.05 3jrs h ASP 129 CO 0.00 1.45 -0.29 0.54 -1.72 0.00 0.00 179.24 179.22 3jrs n ARG 130 N -3.90 2.45 -3.02 3.56 1.74 -1.20 -5.02 116.66 111.28 3jrs n ARG 130 Ca -0.09 -0.46 -0.13 0.00 -0.77 0.00 0.00 57.85 56.40 3jrs n ARG 130 Cb 0.80 -1.07 0.06 0.00 -1.02 0.00 0.00 32.46 31.23 3jrs n ARG 130 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3jrs n ARG 131 N -0.50 -2.79 -4.77 5.56 1.74 0.46 -4.70 116.66 111.66 3jrs n ARG 131 Ca 0.04 0.72 -0.25 0.00 -0.77 0.00 0.00 57.85 57.59 3jrs n ARG 131 Cb 0.21 -5.18 -0.16 0.00 -1.02 0.00 0.00 32.46 26.31 3jrs n ARG 131 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3jrs s VAL 132 N -3.32 1.35 0.20 1.55 1.01 -1.00 -2.09 120.40 118.09 3jrs s VAL 132 Ca 0.29 -0.66 -0.06 0.00 0.00 0.00 0.00 61.98 61.55 3jrs s VAL 132 Cb -0.04 -1.17 -0.02 0.00 0.00 0.00 0.00 36.38 35.15 3jrs s VAL 132 CO 0.62 0.39 0.26 0.28 0.00 0.00 0.00 175.10 176.65 3jrs s THR 133 N 0.15 0.03 -0.19 3.92 -1.32 -0.45 -0.98 115.64 116.79 3jrs s THR 133 Ca -0.06 -1.66 -0.35 0.00 -1.21 0.00 0.00 61.69 58.41 3jrs s THR 133 Cb -0.12 -2.19 0.14 0.00 -1.51 0.00 0.00 72.50 68.82 3jrs s THR 133 CO 0.02 -0.13 1.23 -0.83 -2.21 0.00 0.00 174.62 172.71 3jrs s GLY 134 N -3.06 -0.29 0.26 6.08 0.00 -1.01 -0.32 107.32 108.98 3jrs s GLY 134 Ca 0.27 1.57 -0.08 0.00 0.00 0.00 0.00 44.72 46.47 3jrs s GLY 134 CO 0.07 0.51 0.42 -0.11 0.00 0.00 0.00 173.10 173.99 3jrs s PHE 135 N -2.38 0.67 0.07 1.90 -0.71 -0.48 -0.61 117.98 116.44 3jrs s PHE 135 Ca 0.10 -0.98 0.06 0.00 -1.04 0.00 0.00 56.93 55.07 3jrs s PHE 135 Cb -0.01 0.00 -0.03 0.00 -1.21 0.00 0.00 43.02 41.78 3jrs s PHE 135 CO -0.04 -0.98 -0.17 -1.12 -1.34 0.00 0.00 175.22 171.57 3jrs s SER 136 N -3.10 2.02 -0.14 1.98 0.01 -0.57 -0.59 113.70 113.30 3jrs s SER 136 Ca 0.27 -0.59 -0.12 0.00 1.31 0.00 0.00 55.95 56.82 3jrs s SER 136 Cb 0.01 -0.11 -0.05 0.00 0.21 0.00 0.00 66.02 66.08 3jrs s SER 136 CO 0.12 0.02 0.26 -0.63 0.41 0.00 0.00 173.24 173.42 3jrs s ILE 137 N -1.08 5.32 0.38 1.44 1.01 -0.01 -0.75 121.20 127.51 3jrs s ILE 137 Ca 0.02 0.48 0.12 0.00 0.00 0.00 0.00 60.65 61.28 3jrs s ILE 137 Cb -0.09 -3.58 0.11 0.00 0.01 0.00 0.00 42.46 38.90 3jrs s ILE 137 CO 0.03 0.45 1.86 0.74 0.00 0.00 0.00 174.94 178.01 3jrs h THR 138 N 4.48 1.23 0.00 2.92 2.02 -1.09 -3.40 112.91 119.07 3jrs h THR 138 Ca -0.44 -1.11 0.00 0.00 0.77 0.00 0.00 66.41 65.63 3jrs h THR 138 Cb 1.18 1.56 0.00 0.00 -1.74 0.00 0.00 68.15 69.15 3jrs h THR 138 CO 0.72 0.32 0.00 1.57 0.37 0.00 0.00 175.52 178.50 3jrs n HIS 142 N -4.16 0.00 0.86 3.16 -0.00 -1.26 -4.93 115.22 108.89 3jrs n HIS 142 Ca -0.02 0.00 0.13 0.00 0.46 0.00 0.00 57.72 58.29 3jrs n HIS 142 Cb 0.36 0.00 0.54 0.00 -0.12 0.00 0.00 29.99 30.78 3jrs n HIS 142 CO 0.00 0.00 0.00 0.54 0.46 0.00 0.00 176.34 177.34 3jrs n ARG 143 N 0.00 0.07 -1.69 1.57 1.74 -1.26 -4.04 116.66 113.06 3jrs n ARG 143 Ca 0.00 0.08 -0.36 0.00 -0.77 0.00 0.00 57.85 56.80 3jrs n ARG 143 Cb 0.00 -1.59 0.05 0.00 -1.02 0.00 0.00 32.46 29.91 3jrs n ARG 143 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3jrs n LEU 144 N -1.71 7.28 -4.77 0.55 4.77 -1.26 -4.61 117.00 117.25 3jrs n LEU 144 Ca 0.06 -4.60 -0.41 0.00 -0.03 0.00 0.00 56.01 51.03 3jrs n LEU 144 Cb 0.35 -0.94 -0.02 0.00 -2.33 0.00 0.00 43.42 40.48 3jrs n LEU 144 CO 0.27 1.68 1.03 0.00 -1.33 0.00 0.00 177.39 179.03 3jrs s ARG 145 N -3.90 4.30 -2.04 3.23 1.04 -1.25 -0.74 118.95 119.58 3jrs s ARG 145 Ca 0.58 2.29 0.00 0.00 -1.04 0.00 0.00 55.73 57.56 3jrs s ARG 145 Cb 0.47 -3.06 0.00 0.00 -2.04 0.00 0.00 34.95 30.32 3jrs s ARG 145 CO -0.19 -0.29 0.00 0.09 -0.04 0.00 0.00 175.30 174.88 3jrs n ASN 146 N 0.99 -5.41 -4.73 -2.89 5.03 -1.26 -1.80 115.26 105.18 3jrs n ASN 146 Ca 0.01 0.42 -0.42 0.00 0.87 0.00 0.00 54.58 55.47 3jrs n ASN 146 Cb 0.41 -4.62 -0.03 0.00 -1.02 0.00 0.00 39.78 34.52 3jrs n ASN 146 CO 0.00 0.00 0.00 -0.47 -1.83 0.00 0.00 177.26 174.96 3jrs s TYR 147 N -2.76 3.04 -0.06 3.10 6.14 0.08 -4.56 117.35 122.33 3jrs s TYR 147 Ca 0.00 0.89 -0.03 0.00 0.64 0.00 0.00 57.07 58.57 3jrs s TYR 147 Cb 0.00 -3.86 0.03 0.00 0.42 0.00 0.00 41.96 38.56 3jrs s TYR 147 CO 0.00 -2.92 0.13 0.21 0.64 0.00 0.00 175.55 173.61 3jrs s LYS 148 N 0.18 0.10 0.13 4.97 2.20 -0.15 -0.83 119.74 126.34 3jrs s LYS 148 Ca 0.63 0.31 0.04 0.00 -0.36 0.00 0.00 55.97 56.60 3jrs s LYS 148 Cb -0.42 -0.12 -0.04 0.00 -1.51 0.00 0.00 37.83 35.73 3jrs s LYS 148 CO 0.39 -0.13 -0.10 -1.54 -0.36 0.00 0.00 175.35 173.61 3jrs s SER 149 N 0.89 1.70 -0.03 1.43 1.04 0.24 -0.78 113.70 118.17 3jrs s SER 149 Ca -0.07 -0.94 0.01 0.00 0.48 0.00 0.00 55.95 55.43 3jrs s SER 149 Cb -0.09 -0.01 0.02 0.00 0.10 0.00 0.00 66.02 66.04 3jrs s SER 149 CO -0.04 -0.30 -0.05 -0.69 0.98 0.00 0.00 173.24 173.14 3jrs s VAL 150 N -2.99 0.50 -0.12 5.02 1.01 -0.43 -1.38 120.40 122.01 3jrs s VAL 150 Ca 0.13 -0.14 0.03 0.00 0.00 0.00 0.00 61.98 61.99 3jrs s VAL 150 Cb 0.01 -0.51 0.00 0.00 0.00 0.00 0.00 36.38 35.88 3jrs s VAL 150 CO 0.00 0.20 -0.22 -0.89 0.00 0.00 0.00 175.10 174.20 3jrs s THR 151 N 0.67 2.18 0.02 3.92 2.01 0.56 -1.68 115.64 123.31 3jrs s THR 151 Ca -0.09 -0.96 0.06 0.00 0.31 0.00 0.00 61.69 61.01 3jrs s THR 151 Cb -0.12 -1.86 -0.02 0.00 0.01 0.00 0.00 72.50 70.51 3jrs s THR 151 CO 0.00 0.55 -0.17 0.42 -0.69 0.00 0.00 174.62 174.73 3jrs s THR 152 N 0.57 1.33 -0.13 -0.82 -4.23 -0.07 -1.35 115.64 110.95 3jrs s THR 152 Ca -0.13 -0.94 0.01 0.00 -1.18 0.00 0.00 61.69 59.46 3jrs s THR 152 Cb -0.17 -1.15 -0.01 0.00 1.34 0.00 0.00 72.50 72.51 3jrs s THR 152 CO 0.04 0.19 -0.16 -0.69 -0.54 0.00 0.00 174.62 173.46 3jrs s VAL 153 N -0.66 2.72 -0.07 2.29 1.01 -0.89 -0.91 120.40 123.89 3jrs s VAL 153 Ca 0.05 -0.77 0.03 0.00 0.00 0.00 0.00 61.98 61.29 3jrs s VAL 153 Cb -0.07 -2.12 0.00 0.00 0.00 0.00 0.00 36.38 34.19 3jrs s VAL 153 CO 0.01 0.53 -0.18 -1.00 0.00 0.00 0.00 175.10 174.46 3jrs s HIS 154 N 0.44 1.95 0.10 5.22 3.76 0.80 -4.82 115.29 122.74 3jrs s HIS 154 Ca -0.12 -0.72 -0.30 0.00 -0.15 0.00 0.00 55.06 53.77 3jrs s HIS 154 Cb -0.16 -1.34 -0.06 0.00 1.11 0.00 0.00 32.58 32.13 3jrs s HIS 154 CO 0.05 -0.30 0.98 0.50 -0.85 0.00 0.00 174.74 175.12 3jrs s ARG 155 N 0.39 4.67 -0.07 1.40 3.52 -1.26 -1.34 118.95 126.25 3jrs s ARG 155 Ca -0.14 1.48 0.01 0.00 -0.13 0.00 0.00 55.73 56.96 3jrs s ARG 155 Cb -0.16 -3.38 0.02 0.00 -1.56 0.00 0.00 34.95 29.88 3jrs s ARG 155 CO 0.05 0.16 -0.09 -0.06 -0.81 0.00 0.00 175.30 174.55 3jrs s PHE 156 N 0.12 1.24 0.06 5.12 0.40 -0.22 -4.94 117.98 119.75 3jrs s PHE 156 Ca 0.48 -0.47 0.07 0.00 -0.60 0.00 0.00 56.93 56.41 3jrs s PHE 156 Cb -0.24 -0.98 -0.03 0.00 0.51 0.00 0.00 43.02 42.28 3jrs s PHE 156 CO 0.30 -0.30 -0.18 -1.21 0.70 0.00 0.00 175.22 174.53 3jrs s GLU 157 N 0.98 1.13 0.00 0.44 2.02 -1.26 0.11 118.70 122.12 3jrs s GLU 157 Ca -0.09 -0.96 0.00 0.00 0.02 0.00 0.00 54.97 53.94 3jrs s GLU 157 Cb -0.15 -1.25 0.00 0.00 0.10 0.00 0.00 34.13 32.84 3jrs s GLU 157 CO 0.00 0.30 0.00 0.54 0.02 0.00 0.00 175.26 176.13 3jrs n ARG 164 N 1.57 0.00 -3.73 1.61 3.00 -1.26 -4.99 116.66 112.86 3jrs n ARG 164 Ca -0.19 0.00 -0.13 0.00 -0.01 0.00 0.00 57.85 57.52 3jrs n ARG 164 Cb 0.54 -0.46 -0.10 0.00 0.00 0.00 0.00 32.46 32.44 3jrs n ARG 164 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.63 176.13 3jrs s ILE 165 N -2.95 0.01 0.35 0.55 2.07 -1.26 -5.18 121.20 114.79 3jrs s ILE 165 Ca 0.00 -0.08 0.04 0.00 -1.41 0.00 0.00 60.65 59.20 3jrs s ILE 165 Cb 0.00 -0.59 -0.02 0.00 0.13 0.00 0.00 42.46 41.98 3jrs s ILE 165 CO 0.00 -0.05 0.37 -1.66 -1.91 0.00 0.00 174.94 171.69 3jrs s TRP 166 N -0.11 1.53 0.10 3.50 -2.14 0.30 -4.49 118.94 117.62 3jrs s TRP 166 Ca -0.03 -1.55 0.08 0.00 2.66 0.00 0.00 56.10 57.26 3jrs s TRP 166 Cb -0.03 -0.47 -0.03 0.00 -3.10 0.00 0.00 33.47 29.83 3jrs s TRP 166 CO 0.02 -1.00 -0.19 0.99 -2.66 0.00 0.00 176.95 174.10 3jrs s THR 167 N -3.21 1.58 -0.07 0.66 2.01 -0.41 -1.06 115.64 115.16 3jrs s THR 167 Ca 0.37 -1.50 0.05 0.00 0.31 0.00 0.00 61.69 60.93 3jrs s THR 167 Cb 0.01 -1.46 -0.01 0.00 0.01 0.00 0.00 72.50 71.06 3jrs s THR 167 CO 0.26 -0.10 -0.23 -0.69 -0.69 0.00 0.00 174.62 173.17 3jrs s VAL 168 N -1.19 1.94 -0.16 3.82 1.01 -0.45 -1.31 120.40 124.06 3jrs s VAL 168 Ca 0.05 -0.99 -0.03 0.00 0.00 0.00 0.00 61.98 61.00 3jrs s VAL 168 Cb -0.10 -1.66 -0.02 0.00 0.00 0.00 0.00 36.38 34.60 3jrs s VAL 168 CO 0.04 0.54 -0.05 -0.69 0.00 0.00 0.00 175.10 174.94 3jrs s VAL 169 N 0.00 3.71 -0.09 2.92 1.01 -0.56 -0.14 120.40 127.26 3jrs s VAL 169 Ca -0.07 -0.41 -0.01 0.00 0.00 0.00 0.00 61.98 61.48 3jrs s VAL 169 Cb -0.14 -2.63 -0.03 0.00 0.00 0.00 0.00 36.38 33.57 3jrs s VAL 169 CO 0.05 0.48 -0.03 -0.76 0.00 0.00 0.00 175.10 174.84 3jrs s LEU 170 N 0.54 3.37 -0.02 3.92 1.43 -0.09 -1.52 118.68 126.31 3jrs s LEU 170 Ca -0.04 0.04 0.00 0.00 -1.03 0.00 0.00 54.13 53.10 3jrs s LEU 170 Cb -0.15 -1.76 0.03 0.00 0.03 0.00 0.00 46.19 44.34 3jrs s LEU 170 CO 0.03 0.34 0.02 -0.70 0.23 0.00 0.00 176.35 176.27 3jrs s GLU 171 N -0.67 0.00 0.21 1.70 2.12 -0.38 -0.89 118.70 120.81 3jrs s GLU 171 Ca 0.10 0.16 0.05 0.00 0.36 0.00 0.00 54.97 55.64 3jrs s GLU 171 Cb -0.12 -0.25 -0.05 0.00 0.26 0.00 0.00 34.13 33.97 3jrs s GLU 171 CO 0.02 -0.15 -0.06 -1.54 -0.54 0.00 0.00 175.26 172.99 3jrs s SER 172 N 0.96 2.09 0.12 -1.70 1.04 -0.68 -0.40 113.70 115.13 3jrs s SER 172 Ca -0.08 -1.13 -0.08 0.00 0.48 0.00 0.00 55.95 55.14 3jrs s SER 172 Cb -0.12 -0.05 -0.01 0.00 0.10 0.00 0.00 66.02 65.94 3jrs s SER 172 CO -0.03 -0.38 0.20 -0.72 0.98 0.00 0.00 173.24 173.29 3jrs s TYR 173 N -3.26 0.35 0.02 5.02 1.13 -0.59 -1.31 117.35 118.71 3jrs s TYR 173 Ca 0.25 -0.75 0.04 0.00 -1.41 0.00 0.00 57.07 55.19 3jrs s TYR 173 Cb 0.04 -0.12 -0.02 0.00 -1.10 0.00 0.00 41.96 40.76 3jrs s TYR 173 CO 0.07 -0.60 -0.11 0.54 -2.51 0.00 0.00 175.55 172.93 3jrs s VAL 174 N -3.93 0.85 -0.06 -3.49 0.11 0.04 -2.80 120.40 111.12 3jrs s VAL 174 Ca 0.12 -0.75 -0.13 0.00 -2.93 0.00 0.00 61.98 58.29 3jrs s VAL 174 Cb 0.05 -0.77 0.03 0.00 -1.53 0.00 0.00 36.38 34.15 3jrs s VAL 174 CO -0.05 0.03 0.31 0.54 -3.33 0.00 0.00 175.10 172.60 3jrs s VAL 175 N -0.66 0.04 -0.29 2.04 0.11 -0.44 -0.97 120.40 120.22 3jrs s VAL 175 Ca 0.01 -0.30 -0.15 0.00 -2.93 0.00 0.00 61.98 58.61 3jrs s VAL 175 Cb -0.06 -0.55 -0.03 0.00 -1.53 0.00 0.00 36.38 34.21 3jrs s VAL 175 CO 0.00 -0.16 0.36 -1.81 -3.33 0.00 0.00 175.10 170.16 3jrs s ASP 176 N -0.74 6.21 -0.25 3.54 -0.00 -0.75 -0.71 116.67 123.98 3jrs s ASP 176 Ca -0.08 0.13 -0.29 0.00 -0.00 0.00 0.00 52.55 52.30 3jrs s ASP 176 Cb -0.04 -2.20 0.00 0.00 -0.00 0.00 0.00 42.92 40.68 3jrs s ASP 176 CO 0.03 -0.22 1.20 0.54 -0.00 0.00 0.00 175.17 176.72 3jrs s VAL 177 N 2.04 4.35 0.60 -1.27 0.11 -1.00 -3.92 120.40 121.31 3jrs s VAL 177 Ca 0.14 1.58 -0.18 0.00 -2.93 0.00 0.00 61.98 60.59 3jrs s VAL 177 Cb -0.16 -4.19 -0.06 0.00 -1.53 0.00 0.00 36.38 30.44 3jrs s VAL 177 CO 0.11 -0.33 0.82 -2.65 -3.33 0.00 0.00 175.10 169.72 3jrs n PRO 178 N 6.85 0.75 -1.80 1.54 -0.02 -1.26 -4.86 135.00 136.19 3jrs n PRO 178 Ca 0.13 0.29 -0.41 0.00 -2.02 0.00 0.00 63.50 61.49 3jrs n PRO 178 Cb 0.46 -2.02 -0.02 0.00 -0.02 0.00 0.00 33.50 31.90 3jrs n PRO 178 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 3jrs s GLU 179 N -2.57 4.13 0.00 -0.52 0.41 -1.26 -1.69 118.70 117.20 3jrs s GLU 179 Ca 0.74 2.55 0.00 0.00 -0.41 0.00 0.00 54.97 57.85 3jrs s GLU 179 Cb -0.42 -3.03 0.00 0.00 -1.78 0.00 0.00 34.13 28.90 3jrs s GLU 179 CO 0.49 -0.62 0.00 0.41 -0.49 0.00 0.00 175.26 175.05 3jrs n GLY 180 N 2.20 2.97 3.76 -1.39 0.00 -1.26 -5.05 105.19 106.42 3jrs n GLY 180 Ca 0.08 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.77 3jrs n GLY 180 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3jrs s ASN 181 N 0.03 4.87 -0.24 1.61 0.02 -0.68 -4.99 114.94 115.56 3jrs s ASN 181 Ca 0.00 2.09 -0.27 0.00 -1.02 0.00 0.00 52.86 53.67 3jrs s ASN 181 Cb 0.00 -2.56 0.00 0.00 0.02 0.00 0.00 41.25 38.71 3jrs s ASN 181 CO 0.00 -1.79 0.93 -0.55 0.02 0.00 0.00 177.10 175.71 3jrs s SER 182 N -2.43 6.96 0.07 -1.22 0.15 -1.26 -4.93 113.70 111.04 3jrs s SER 182 Ca 0.69 1.20 -0.24 0.00 0.70 0.00 0.00 55.95 58.30 3jrs s SER 182 Cb -0.23 -2.49 -0.16 0.00 -1.71 0.00 0.00 66.02 61.43 3jrs s SER 182 CO 0.42 -0.60 1.63 -0.08 1.20 0.00 0.00 173.24 175.82 3jrs h GLU 183 N 7.57 -0.05 -0.70 5.44 4.81 -1.94 -1.25 114.58 128.46 3jrs h GLU 183 Ca -0.21 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 58.98 3jrs h GLU 183 Cb 1.08 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 30.44 3jrs h GLU 183 CO 0.93 0.06 0.28 1.05 -0.73 0.00 0.00 179.01 180.60 3jrs h GLU 184 N -0.15 1.04 -0.66 1.92 4.11 -1.99 0.74 114.58 119.59 3jrs h GLU 184 Ca -0.01 -0.19 -0.04 0.00 0.07 0.00 0.00 59.36 59.20 3jrs h GLU 184 Cb 0.13 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 29.19 3jrs h GLU 184 CO 0.01 0.86 0.24 -0.44 0.07 0.00 0.00 179.01 179.75 3jrs h ASP 185 N 0.99 0.93 -0.20 3.06 3.32 -1.96 -0.01 116.42 122.56 3jrs h ASP 185 Ca 0.23 -0.19 -0.02 0.00 0.02 0.00 0.00 57.03 57.08 3jrs h ASP 185 Cb 0.20 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.50 3jrs h ASP 185 CO -0.02 0.87 0.04 0.74 -1.72 0.00 0.00 179.24 179.15 3jrs h THR 186 N 0.94 1.21 -0.59 0.35 2.02 -0.68 -2.33 112.91 113.84 3jrs h THR 186 Ca 0.22 -0.69 -0.03 0.00 0.77 0.00 0.00 66.41 66.68 3jrs h THR 186 Cb 0.24 1.30 -0.03 0.00 -1.74 0.00 0.00 68.15 67.92 3jrs h THR 186 CO -0.01 0.21 0.27 -0.09 0.37 0.00 0.00 175.52 176.27 3jrs h ARG 187 N 0.12 0.86 -0.67 6.66 2.43 -0.83 -1.98 114.38 120.98 3jrs h ARG 187 Ca 0.06 -0.13 0.05 0.00 -0.81 0.00 0.00 59.98 59.14 3jrs h ARG 187 Cb 0.29 -0.15 -0.05 0.00 -0.42 0.00 0.00 29.97 29.64 3jrs h ARG 187 CO 0.00 0.71 0.39 1.25 -1.51 0.00 0.00 179.97 180.81 3jrs h LEU 188 N 0.81 0.61 -0.22 3.80 5.85 -0.97 0.21 115.31 125.40 3jrs h LEU 188 Ca 0.20 0.02 -0.05 0.00 0.84 0.00 0.00 57.88 58.89 3jrs h LEU 188 Cb 0.14 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.06 3jrs h LEU 188 CO -0.02 0.41 -0.05 0.15 -0.34 0.00 0.00 178.44 178.58 3jrs h PHE 189 N 0.74 0.46 -0.27 1.25 3.57 -1.25 -2.45 116.94 119.00 3jrs h PHE 189 Ca 0.29 -0.10 -0.03 0.00 3.53 0.00 0.00 57.97 61.66 3jrs h PHE 189 Cb 0.12 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 38.74 3jrs h PHE 189 CO -0.06 0.65 0.07 0.00 -2.23 0.00 0.00 178.31 176.73 3jrs h ALA 190 N 0.75 0.36 -0.88 2.41 0.00 -0.96 -1.10 119.26 119.83 3jrs h ALA 190 Ca 0.05 -0.16 0.12 0.00 0.00 0.00 0.00 54.91 54.92 3jrs h ALA 190 Cb 0.50 -0.10 -0.08 0.00 0.00 0.00 0.00 17.79 18.10 3jrs h ALA 190 CO 0.02 0.01 0.50 -0.44 0.00 0.00 0.00 179.25 179.35 3jrs h ASP 191 N 0.27 0.69 -0.21 0.00 3.32 -0.60 -1.23 116.42 118.66 3jrs h ASP 191 Ca 0.09 0.06 -0.09 0.00 0.02 0.00 0.00 57.03 57.11 3jrs h ASP 191 Cb 0.28 -0.06 -0.00 0.00 0.22 0.00 0.00 39.33 39.76 3jrs h ASP 191 CO 0.00 0.35 -0.24 0.74 -1.72 0.00 0.00 179.24 178.37 3jrs h THR 192 N 0.78 1.33 -0.46 0.35 2.02 -1.10 0.70 112.91 116.53 3jrs h THR 192 Ca 0.45 -1.42 -0.05 0.00 0.77 0.00 0.00 66.41 66.16 3jrs h THR 192 Cb 0.52 1.76 -0.02 0.00 -1.74 0.00 0.00 68.15 68.67 3jrs h THR 192 CO -0.30 0.44 0.08 0.58 0.37 0.00 0.00 175.52 176.69 3jrs h VAL 193 N 0.21 1.24 -0.23 3.16 2.07 -0.81 -0.89 116.25 121.01 3jrs h VAL 193 Ca 0.03 -0.89 -0.05 0.00 0.82 0.00 0.00 66.70 66.61 3jrs h VAL 193 Cb 0.80 0.94 -0.01 0.00 -1.52 0.00 0.00 31.29 31.50 3jrs h VAL 193 CO 0.06 0.31 -0.06 0.40 0.02 0.00 0.00 177.57 178.30 3jrs h ILE 194 N 0.62 1.29 -0.45 4.57 2.04 -1.06 0.70 117.51 125.23 3jrs h ILE 194 Ca 0.14 -1.06 0.06 0.00 1.00 0.00 0.00 64.86 65.00 3jrs h ILE 194 Cb 0.37 1.51 -0.06 0.00 -0.74 0.00 0.00 36.82 37.91 3jrs h ILE 194 CO 0.01 0.33 0.13 -0.09 0.00 0.00 0.00 178.15 178.53 3jrs h ARG 195 N 0.18 0.28 -0.66 2.37 2.43 -0.75 0.32 114.38 118.54 3jrs h ARG 195 Ca 0.06 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.20 3jrs h ARG 195 Cb 0.52 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 29.98 3jrs h ARG 195 CO 0.02 0.18 0.37 -0.07 -1.51 0.00 0.00 179.97 178.96 3jrs h LEU 196 N 0.28 0.82 -0.67 3.80 3.38 -0.82 -0.96 115.31 121.15 3jrs h LEU 196 Ca 0.22 -0.09 -0.04 0.00 0.09 0.00 0.00 57.88 58.05 3jrs h LEU 196 Cb 0.24 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.75 3jrs h LEU 196 CO -0.25 0.68 0.26 0.78 0.09 0.00 0.00 178.44 180.00 3jrs h ASN 197 N 0.90 0.93 0.16 -0.43 2.35 0.04 -0.62 115.58 118.90 3jrs h ASN 197 Ca 0.23 -0.17 -0.11 0.00 -0.55 0.00 0.00 56.30 55.69 3jrs h ASN 197 Cb 0.03 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.15 3jrs h ASN 197 CO -0.04 0.85 -0.41 -0.07 -1.65 0.00 0.00 177.43 176.11 3jrs h LEU 198 N 0.95 0.34 -0.50 1.61 3.38 -0.10 0.76 115.31 121.74 3jrs h LEU 198 Ca 0.22 -0.15 -0.13 0.00 0.09 0.00 0.00 57.88 57.91 3jrs h LEU 198 Cb 0.22 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 3jrs h LEU 198 CO -0.02 0.72 -0.23 1.56 0.09 0.00 0.00 178.44 180.56 3jrs h GLN 199 N 0.27 0.98 -0.32 1.13 4.20 -0.95 -1.12 115.11 119.30 3jrs h GLN 199 Ca 0.02 -0.42 -0.18 0.00 0.06 0.00 0.00 58.65 58.13 3jrs h GLN 199 Cb 0.84 -0.03 -0.00 0.00 0.30 0.00 0.00 27.48 28.59 3jrs h GLN 199 CO 0.07 1.09 -0.49 -0.22 -0.67 0.00 0.00 178.83 178.61 3jrs h LYS 200 N 0.84 0.89 -0.54 1.46 3.64 -0.62 -1.46 116.57 120.78 3jrs h LYS 200 Ca 0.11 -0.53 0.09 0.00 -1.27 0.00 0.00 60.65 59.05 3jrs h LYS 200 Cb 0.81 0.05 -0.07 0.00 -0.41 0.00 0.00 32.23 32.60 3jrs h LYS 200 CO 0.07 1.17 0.12 1.25 -2.27 0.00 0.00 179.45 179.79 3jrs h LEU 201 N 0.69 0.03 -0.47 5.20 5.85 -0.79 -0.06 115.31 125.77 3jrs h LEU 201 Ca 0.03 0.09 0.02 0.00 0.84 0.00 0.00 57.88 58.86 3jrs h LEU 201 Cb 1.10 0.12 -0.03 0.00 0.37 0.00 0.00 40.66 42.22 3jrs h LEU 201 CO 0.11 0.04 0.28 0.00 -0.34 0.00 0.00 178.44 178.54 3jrs h ALA 202 N 1.41 0.59 -0.51 1.25 0.00 -0.83 -0.62 119.26 120.55 3jrs h ALA 202 Ca 0.27 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.14 3jrs h ALA 202 Cb 0.37 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 3jrs h ALA 202 CO -0.34 -0.02 0.20 1.03 0.00 0.00 0.00 179.25 180.12 3jrs h SER 203 N 0.57 0.71 -0.54 0.00 0.87 -0.83 0.14 113.55 114.47 3jrs h SER 203 Ca 0.18 -0.17 -0.01 0.00 -1.23 0.00 0.00 61.79 60.55 3jrs h SER 203 Cb -0.00 -0.18 -0.03 0.00 -0.44 0.00 0.00 62.40 61.75 3jrs h SER 203 CO -0.07 0.69 0.28 0.40 -0.53 0.00 0.00 176.83 177.60 3jrs h ILE 204 N 0.69 1.19 0.15 2.23 1.08 -0.85 -2.02 117.51 119.98 3jrs h ILE 204 Ca 0.17 -0.50 -0.31 0.00 -0.39 0.00 0.00 64.86 63.83 3jrs h ILE 204 Cb 0.21 0.53 0.01 0.00 -3.07 0.00 0.00 36.82 34.49 3jrs h ILE 204 CO -0.01 0.21 -1.48 0.71 -0.69 0.00 0.00 178.15 176.89 3jrs h THR 205 N 0.73 1.24 -0.55 -0.27 1.35 -0.95 -2.86 112.91 111.60 3jrs h THR 205 Ca 0.19 -2.81 0.02 0.00 -0.55 0.00 0.00 66.41 63.26 3jrs h THR 205 Cb 0.07 2.86 -0.03 0.00 -1.73 0.00 0.00 68.15 69.32 3jrs h THR 205 CO -0.03 0.84 0.37 -0.33 -0.25 0.00 0.00 175.52 176.12 3jrs h GLU 206 N 0.09 0.67 -0.11 4.72 5.08 -0.75 -1.68 114.58 122.60 3jrs h GLU 206 Ca -0.23 -0.04 -0.06 0.00 -1.00 0.00 0.00 59.36 58.03 3jrs h GLU 206 Cb 2.04 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 31.13 3jrs h GLU 206 CO 0.20 0.44 -0.20 0.00 -1.00 0.00 0.00 179.01 178.45 3jrs h ALA 207 N 1.67 1.46 0.00 3.43 0.00 -1.24 -2.33 119.26 122.25 3jrs h ALA 207 Ca 0.21 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 3jrs h ALA 207 Cb 0.02 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 3jrs h ALA 207 CO -0.05 0.38 -0.20 0.52 0.00 0.00 0.00 179.25 179.90 3jrs h MET 208 N 0.17 0.00 -0.01 0.00 2.86 -1.09 -3.52 114.93 113.35 3jrs h MET 208 Ca 0.03 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.67 3jrs h MET 208 Cb 0.46 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.12 3jrs h MET 208 CO 0.03 0.20 0.00 -1.71 1.06 0.00 0.00 176.91 176.49