#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3jwo s ILE 2 N 0.00 5.13 -0.06 0.53 2.07 -1.26 -5.06 121.20 122.55 3jwo s ILE 2 Ca 0.00 0.85 -0.18 0.00 -1.41 0.00 0.00 60.65 59.91 3jwo s ILE 2 Cb 0.00 -3.75 -0.05 0.00 0.13 0.00 0.00 42.46 38.79 3jwo s ILE 2 CO 0.00 0.44 0.51 -1.10 -1.91 0.00 0.00 174.94 172.88 3jwo s GLN 3 N -0.12 4.26 -0.24 3.50 -0.21 -1.26 -4.91 119.66 120.67 3jwo s GLN 3 Ca 0.24 0.54 -0.07 0.00 0.02 0.00 0.00 55.36 56.08 3jwo s GLN 3 Cb -0.16 -3.37 -0.03 0.00 1.00 0.00 0.00 33.01 30.46 3jwo s GLN 3 CO 0.11 0.32 0.07 -1.64 -2.12 0.00 0.00 175.29 172.03 3jwo s MET 4 N 0.04 3.66 -0.28 2.91 -1.94 -1.26 -1.63 119.30 120.81 3jwo s MET 4 Ca 0.27 -0.47 0.02 0.00 -1.71 0.00 0.00 55.69 53.80 3jwo s MET 4 Cb -0.16 -3.31 0.07 0.00 2.01 0.00 0.00 34.83 33.44 3jwo s MET 4 CO 0.13 -0.16 -0.04 0.99 -0.01 0.00 0.00 175.02 175.93 3jwo s THR 5 N 1.54 1.92 0.05 2.05 2.01 -0.42 -3.83 115.64 118.95 3jwo s THR 5 Ca 0.06 -1.67 0.03 0.00 0.31 0.00 0.00 61.69 60.42 3jwo s THR 5 Cb -0.15 -2.19 -0.04 0.00 0.01 0.00 0.00 72.50 70.13 3jwo s THR 5 CO 0.03 -0.23 -0.00 0.00 -0.69 0.00 0.00 174.62 173.73 3jwo s GLN 6 N 1.17 2.65 0.07 4.92 -2.07 -1.26 -1.81 119.66 123.34 3jwo s GLN 6 Ca -0.02 -0.74 -0.10 0.00 -1.82 0.00 0.00 55.36 52.68 3jwo s GLN 6 Cb -0.19 -2.59 0.00 0.00 -1.09 0.00 0.00 33.01 29.14 3jwo s GLN 6 CO -0.07 0.58 0.22 -1.12 -1.32 0.00 0.00 175.29 173.57 3jwo s SER 7 N -1.95 0.04 1.05 12.60 0.01 -0.59 -4.59 113.70 120.26 3jwo s SER 7 Ca 0.23 -0.47 -0.16 0.00 1.31 0.00 0.00 55.95 56.86 3jwo s SER 7 Cb -0.12 0.33 0.22 0.00 0.21 0.00 0.00 66.02 66.66 3jwo s SER 7 CO 0.14 -0.66 1.16 -2.84 0.41 0.00 0.00 173.24 171.46 3jwo s PRO 8 N -3.23 -0.00 0.14 12.44 0.02 -1.26 -1.79 135.00 141.32 3jwo s PRO 8 Ca -0.00 0.02 -0.01 0.00 0.02 0.00 0.00 61.00 61.03 3jwo s PRO 8 Cb 0.02 -1.73 -0.08 0.00 0.02 0.00 0.00 34.50 32.73 3jwo s PRO 8 CO -0.08 -2.91 1.32 0.66 -0.33 0.00 0.00 177.00 175.66 3jwo h SER 9 N -2.01 0.39 -4.56 2.53 4.64 -1.81 -3.41 113.55 109.32 3jwo h SER 9 Ca -0.47 -0.32 -0.17 0.00 -0.47 0.00 0.00 61.79 60.35 3jwo h SER 9 Cb 1.30 -0.12 -0.23 0.00 -0.31 0.00 0.00 62.40 63.04 3jwo h SER 9 CO 0.45 1.14 -0.61 -0.55 -0.87 0.00 0.00 176.83 176.39 3jwo s SER 10 N -7.01 0.06 -0.14 4.97 0.15 -1.26 -1.24 113.70 109.23 3jwo s SER 10 Ca -0.04 -0.18 -0.07 0.00 0.70 0.00 0.00 55.95 56.36 3jwo s SER 10 Cb 0.09 0.16 0.05 0.00 -1.71 0.00 0.00 66.02 64.61 3jwo s SER 10 CO 0.85 -0.23 0.33 0.54 1.20 0.00 0.00 173.24 175.93 3jwo s VAL 11 N -0.92 -0.03 -0.14 4.45 0.11 0.23 -4.92 120.40 119.17 3jwo s VAL 11 Ca -0.10 0.12 -0.05 0.00 -2.93 0.00 0.00 61.98 59.02 3jwo s VAL 11 Cb -0.06 -0.50 -0.04 0.00 -1.53 0.00 0.00 36.38 34.26 3jwo s VAL 11 CO 0.00 0.05 0.04 -0.94 -3.33 0.00 0.00 175.10 170.92 3jwo s SER 12 N 1.34 5.53 0.02 3.54 1.04 -1.26 -1.93 113.70 121.98 3jwo s SER 12 Ca -0.09 0.13 -0.13 0.00 0.48 0.00 0.00 55.95 56.34 3jwo s SER 12 Cb -0.09 -1.81 0.02 0.00 0.10 0.00 0.00 66.02 64.24 3jwo s SER 12 CO -0.11 0.27 0.29 0.00 0.98 0.00 0.00 173.24 174.67 3jwo s ALA 13 N -0.22 -0.66 0.67 5.32 0.00 -1.00 -4.97 121.76 120.90 3jwo s ALA 13 Ca 0.07 0.06 -0.04 0.00 0.00 0.00 0.00 51.96 52.06 3jwo s ALA 13 Cb -0.12 0.23 0.07 0.00 0.00 0.00 0.00 23.12 23.30 3jwo s ALA 13 CO 0.02 -0.35 0.95 -1.12 0.00 0.00 0.00 175.76 175.25 3jwo s SER 14 N -1.82 4.83 0.55 0.00 0.01 -1.26 -3.28 113.70 112.72 3jwo s SER 14 Ca -0.08 0.18 -0.20 0.00 1.31 0.00 0.00 55.95 57.17 3jwo s SER 14 Cb -0.02 -0.85 -0.05 0.00 0.21 0.00 0.00 66.02 65.30 3jwo s SER 14 CO -0.01 -1.53 1.16 -0.69 0.41 0.00 0.00 173.24 172.58 3jwo s VAL 15 N -3.10 2.98 0.00 3.43 1.01 -1.26 -2.62 120.40 120.84 3jwo s VAL 15 Ca 0.61 0.63 0.00 0.00 0.00 0.00 0.00 61.98 63.21 3jwo s VAL 15 Cb -0.10 -3.26 0.00 0.00 0.00 0.00 0.00 36.38 33.02 3jwo s VAL 15 CO 0.43 -0.11 0.00 0.61 0.00 0.00 0.00 175.10 176.02 3jwo n GLY 16 N 0.31 2.89 3.74 4.51 0.00 -0.42 -4.87 105.19 111.35 3jwo n GLY 16 Ca 0.12 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.82 3jwo n GLY 16 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3jwo s ASP 17 N -1.01 4.15 -0.14 1.61 -1.08 -1.08 -4.20 116.67 114.92 3jwo s ASP 17 Ca 0.00 2.05 -0.02 0.00 -0.52 0.00 0.00 52.55 54.06 3jwo s ASP 17 Cb 0.00 -2.55 -0.02 0.00 -1.46 0.00 0.00 42.92 38.89 3jwo s ASP 17 CO 0.00 -2.28 -0.09 -0.60 0.52 0.00 0.00 175.17 172.72 3jwo s ARG 18 N -4.49 3.51 0.01 4.34 3.52 -1.22 -1.44 118.95 123.17 3jwo s ARG 18 Ca 0.66 -0.61 0.08 0.00 -0.13 0.00 0.00 55.73 55.73 3jwo s ARG 18 Cb -0.21 -2.77 -0.02 0.00 -1.56 0.00 0.00 34.95 30.38 3jwo s ARG 18 CO 0.52 0.21 -0.24 0.08 -0.81 0.00 0.00 175.30 175.06 3jwo s VAL 19 N 0.40 1.88 -0.11 7.11 1.01 -0.75 -5.00 120.40 124.93 3jwo s VAL 19 Ca -0.07 -1.12 -0.00 0.00 0.00 0.00 0.00 61.98 60.79 3jwo s VAL 19 Cb -0.15 -1.58 0.02 0.00 0.00 0.00 0.00 36.38 34.67 3jwo s VAL 19 CO 0.04 0.43 -0.08 -0.89 0.00 0.00 0.00 175.10 174.60 3jwo s THR 20 N -0.65 1.07 -0.04 3.92 2.01 -1.26 -1.35 115.64 119.34 3jwo s THR 20 Ca 0.09 -0.33 0.05 0.00 0.31 0.00 0.00 61.69 61.82 3jwo s THR 20 Cb -0.09 -1.07 -0.02 0.00 0.01 0.00 0.00 72.50 71.32 3jwo s THR 20 CO 0.00 0.37 -0.20 0.27 -0.69 0.00 0.00 174.62 174.38 3jwo s ILE 21 N 1.60 2.58 0.17 1.82 -4.36 -0.22 -4.84 121.20 117.96 3jwo s ILE 21 Ca 0.03 -0.90 0.09 0.00 -0.26 0.00 0.00 60.65 59.61 3jwo s ILE 21 Cb -0.13 -1.97 -0.04 0.00 1.25 0.00 0.00 42.46 41.57 3jwo s ILE 21 CO -0.07 0.58 -0.09 0.42 0.24 0.00 0.00 174.94 176.02 3jwo s THR 22 N -0.57 3.24 0.27 8.37 -4.23 -0.74 -0.41 115.64 121.57 3jwo s THR 22 Ca 0.08 -1.60 0.06 0.00 -1.18 0.00 0.00 61.69 59.05 3jwo s THR 22 Cb -0.11 -2.59 -0.06 0.00 1.34 0.00 0.00 72.50 71.08 3jwo s THR 22 CO 0.01 -0.08 -0.04 0.00 -0.54 0.00 0.00 174.62 173.96 3jwo s ARG 24 N -3.76 0.52 0.12 0.00 3.52 -0.75 -2.01 118.95 116.59 3jwo s ARG 24 Ca 0.29 1.14 -0.13 0.00 -0.13 0.00 0.00 55.73 56.90 3jwo s ARG 24 Cb 0.04 0.67 -0.07 0.00 -1.56 0.00 0.00 34.95 34.04 3jwo s ARG 24 CO 0.11 -0.34 0.51 0.00 -0.81 0.00 0.00 175.30 174.78 3jwo s ALA 25 N 2.84 3.62 -0.52 6.12 0.00 -0.47 -1.30 121.76 132.03 3jwo s ALA 25 Ca 0.04 -0.19 0.24 0.00 0.00 0.00 0.00 51.96 52.06 3jwo s ALA 25 Cb -0.12 -2.46 0.95 0.00 0.00 0.00 0.00 23.12 21.48 3jwo s ALA 25 CO -0.19 0.48 1.73 -1.13 0.00 0.00 0.00 175.76 176.65 3jwo n SER 26 N 0.88 0.72 -3.91 0.00 3.41 -0.65 -4.75 113.62 109.33 3jwo n SER 26 Ca -0.06 0.65 -0.10 0.00 -0.26 0.00 0.00 58.87 59.09 3jwo n SER 26 Cb 0.52 -0.81 -0.10 0.00 -0.26 0.00 0.00 64.21 63.55 3jwo n SER 26 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 3jwo s GLN 27 N -3.28 0.45 0.07 4.33 -0.21 -1.26 -4.99 119.66 114.77 3jwo s GLN 27 Ca 0.06 -0.50 -0.34 0.00 0.02 0.00 0.00 55.36 54.60 3jwo s GLN 27 Cb 0.10 0.18 -0.13 0.00 1.00 0.00 0.00 33.01 34.16 3jwo s GLN 27 CO 0.44 -0.10 1.72 -3.47 -2.12 0.00 0.00 175.29 171.77 3jwo n ASP 28 N 1.41 3.37 -0.18 5.90 2.03 -1.26 -4.79 116.55 123.03 3jwo n ASP 28 Ca -0.23 1.03 0.04 0.00 0.52 0.00 0.00 54.79 56.15 3jwo n ASP 28 Cb 0.56 -1.43 0.05 0.00 -0.72 0.00 0.00 41.12 39.58 3jwo n ASP 28 CO 0.00 0.00 0.00 2.30 -1.92 0.00 0.00 177.20 177.58 3jwo n ILE 29 N 4.22 0.84 -4.78 5.18 -5.35 -0.13 -5.02 119.36 114.33 3jwo n ILE 29 Ca 0.19 -0.98 0.00 0.00 -0.27 0.00 0.00 62.75 61.69 3jwo n ILE 29 Cb 0.30 0.32 0.00 0.00 -1.74 0.00 0.00 39.64 38.52 3jwo n ILE 29 CO 0.00 0.00 0.00 -0.24 -1.76 0.00 0.00 176.55 174.55 3jwo n SER 30 N -0.60 0.00 -1.85 7.28 2.88 -1.21 -2.59 113.62 117.54 3jwo n SER 30 Ca 0.06 0.00 0.07 0.00 -1.33 0.00 0.00 58.87 57.67 3jwo n SER 30 Cb 0.57 0.00 0.40 0.00 -0.75 0.00 0.00 64.21 64.43 3jwo n SER 30 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 3jwo n THR 31 N 0.00 2.75 -2.84 2.46 -2.24 -1.26 -0.69 114.28 112.45 3jwo n THR 31 Ca 0.00 -1.43 -0.44 0.00 -2.27 0.00 0.00 64.05 59.91 3jwo n THR 31 Cb 0.00 -0.27 0.00 0.00 -2.10 0.00 0.00 70.33 67.96 3jwo n THR 31 CO 0.00 0.00 0.00 0.79 -0.57 0.00 0.00 175.07 175.29 3jwo n TRP 32 N 0.58 4.68 -4.16 4.78 5.03 -1.07 -2.95 117.44 124.33 3jwo n TRP 32 Ca 0.28 -3.26 -0.10 0.00 3.03 0.00 0.00 57.50 57.45 3jwo n TRP 32 Cb 1.19 -2.18 -0.10 0.00 -1.03 0.00 0.00 31.31 29.19 3jwo n TRP 32 CO 0.00 0.00 0.00 -1.17 -0.03 0.00 0.00 177.69 176.49 3jwo s LEU 33 N 1.47 2.50 -0.05 -0.99 2.96 -1.26 -1.85 118.68 121.46 3jwo s LEU 33 Ca 0.43 -1.01 -0.08 0.00 -0.22 0.00 0.00 54.13 53.26 3jwo s LEU 33 Cb -0.01 -0.05 0.02 0.00 0.50 0.00 0.00 46.19 46.65 3jwo s LEU 33 CO 0.01 -0.48 0.19 0.00 -1.32 0.00 0.00 176.35 174.75 3jwo s ALA 34 N -3.65 -0.48 -0.07 5.97 0.00 -0.72 -1.46 121.76 121.36 3jwo s ALA 34 Ca 0.12 0.38 0.03 0.00 0.00 0.00 0.00 51.96 52.49 3jwo s ALA 34 Cb 0.05 -0.20 -0.02 0.00 0.00 0.00 0.00 23.12 22.96 3jwo s ALA 34 CO -0.05 -0.13 -0.16 -1.58 0.00 0.00 0.00 175.76 173.83 3jwo s TRP 35 N -0.36 2.67 0.12 0.00 0.52 -0.44 -0.77 118.94 120.69 3jwo s TRP 35 Ca -0.05 -0.42 0.10 0.00 0.02 0.00 0.00 56.10 55.75 3jwo s TRP 35 Cb -0.03 -1.68 -0.04 0.00 -1.15 0.00 0.00 33.47 30.57 3jwo s TRP 35 CO 0.01 -0.01 -0.24 0.71 0.02 0.00 0.00 176.95 177.44 3jwo s TYR 36 N -0.30 2.05 -0.02 -1.98 1.51 0.60 -0.84 117.35 118.37 3jwo s TYR 36 Ca 0.02 -0.40 0.03 0.00 -1.01 0.00 0.00 57.07 55.71 3jwo s TYR 36 Cb -0.13 -1.10 -0.03 0.00 -0.11 0.00 0.00 41.96 40.59 3jwo s TYR 36 CO 0.03 0.29 -0.09 -1.14 -1.11 0.00 0.00 175.55 173.53 3jwo s GLN 37 N -2.09 2.54 -0.19 -0.62 0.74 -0.63 -1.35 119.66 118.07 3jwo s GLN 37 Ca 0.11 -0.70 -0.04 0.00 0.05 0.00 0.00 55.36 54.78 3jwo s GLN 37 Cb -0.10 -2.47 0.09 0.00 1.10 0.00 0.00 33.01 31.63 3jwo s GLN 37 CO 0.06 0.61 0.25 -1.14 -0.55 0.00 0.00 175.29 174.52 3jwo s GLN 38 N -1.18 0.19 0.19 1.67 0.74 0.07 -0.42 119.66 120.92 3jwo s GLN 38 Ca 0.15 0.40 -0.12 0.00 0.05 0.00 0.00 55.36 55.83 3jwo s GLN 38 Cb -0.11 -0.78 -0.07 0.00 1.10 0.00 0.00 33.01 33.15 3jwo s GLN 38 CO 0.05 -0.55 0.56 0.15 -0.55 0.00 0.00 175.29 174.95 3jwo s LYS 39 N 2.38 3.91 0.16 1.67 1.02 -1.26 -2.30 119.74 125.32 3jwo s LYS 39 Ca 0.06 0.41 -0.34 0.00 0.02 0.00 0.00 55.97 56.13 3jwo s LYS 39 Cb -0.15 -2.78 -0.15 0.00 -0.52 0.00 0.00 37.83 34.24 3jwo s LYS 39 CO -0.11 0.39 1.32 -2.30 -0.92 0.00 0.00 175.35 173.73 3jwo n PRO 40 N 0.33 1.49 -0.61 -1.68 -0.02 -1.26 -2.61 135.00 130.64 3jwo n PRO 40 Ca -0.02 0.53 0.00 0.00 -2.02 0.00 0.00 63.50 61.99 3jwo n PRO 40 Cb 0.52 -2.14 0.00 0.00 -0.02 0.00 0.00 33.50 31.86 3jwo n PRO 40 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3jwo n GLY 41 N 2.38 0.72 3.38 -1.23 0.00 -1.26 -5.04 105.19 104.14 3jwo n GLY 41 Ca 0.15 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.06 3jwo n GLY 41 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3jwo s LYS 42 N -0.39 1.42 0.33 1.61 1.02 -1.07 -5.16 119.74 117.50 3jwo s LYS 42 Ca 0.00 -1.52 -0.26 0.00 0.02 0.00 0.00 55.97 54.22 3jwo s LYS 42 Cb 0.00 0.36 -0.10 0.00 -0.52 0.00 0.00 37.83 37.57 3jwo s LYS 42 CO 0.00 -0.53 0.94 0.00 -0.92 0.00 0.00 175.35 174.84 3jwo s ALA 43 N -3.97 3.20 0.72 5.17 0.00 -1.26 -4.69 121.76 120.92 3jwo s ALA 43 Ca 0.32 0.51 -0.16 0.00 0.00 0.00 0.00 51.96 52.63 3jwo s ALA 43 Cb 0.03 -3.18 0.00 0.00 0.00 0.00 0.00 23.12 19.98 3jwo s ALA 43 CO 0.12 0.17 0.93 -2.30 0.00 0.00 0.00 175.76 174.68 3jwo n PRO 44 N 0.46 0.48 -4.52 0.00 -0.02 -1.26 -4.83 135.00 125.31 3jwo n PRO 44 Ca 0.02 0.22 -0.29 0.00 -2.02 0.00 0.00 63.50 61.43 3jwo n PRO 44 Cb 0.50 -2.18 -0.17 0.00 -0.02 0.00 0.00 33.50 31.63 3jwo n PRO 44 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 3jwo s LYS 45 N -3.29 2.42 0.17 -0.52 2.20 0.44 -4.96 119.74 116.19 3jwo s LYS 45 Ca 0.72 -0.63 -0.32 0.00 -0.36 0.00 0.00 55.97 55.38 3jwo s LYS 45 Cb -0.34 -2.02 -0.10 0.00 -1.51 0.00 0.00 37.83 33.85 3jwo s LYS 45 CO 0.51 -0.05 1.58 -1.17 -0.36 0.00 0.00 175.35 175.87 3jwo s LEU 46 N 0.93 4.37 -0.07 5.43 2.96 -1.26 -1.60 118.68 129.44 3jwo s LEU 46 Ca -0.07 2.65 -0.09 0.00 -0.22 0.00 0.00 54.13 56.40 3jwo s LEU 46 Cb -0.15 -3.60 -0.04 0.00 0.50 0.00 0.00 46.19 42.90 3jwo s LEU 46 CO -0.01 -0.84 -0.19 0.18 -1.32 0.00 0.00 176.35 174.17 3jwo n LEU 47 N 3.90 1.43 -4.06 -0.68 4.77 -0.02 -4.86 117.00 117.48 3jwo n LEU 47 Ca 0.14 0.23 -0.21 0.00 -0.03 0.00 0.00 56.01 56.14 3jwo n LEU 47 Cb 0.38 -0.52 -0.15 0.00 -2.33 0.00 0.00 43.42 40.80 3jwo n LEU 47 CO 0.62 -0.31 -0.45 -0.63 -1.33 0.00 0.00 177.39 175.29 3jwo s ILE 48 N -2.43 0.92 0.10 -0.08 1.01 -1.09 -1.33 121.20 118.30 3jwo s ILE 48 Ca -0.17 -0.48 0.05 0.00 0.00 0.00 0.00 60.65 60.05 3jwo s ILE 48 Cb 0.04 -0.78 -0.03 0.00 0.01 0.00 0.00 42.46 41.69 3jwo s ILE 48 CO 0.24 0.27 -0.13 -0.72 0.00 0.00 0.00 174.94 174.59 3jwo s TYR 49 N -0.16 1.28 -1.48 3.97 -0.85 -0.31 -1.33 117.35 118.47 3jwo s TYR 49 Ca 0.02 -0.54 -0.00 0.00 -0.52 0.00 0.00 57.07 56.04 3jwo s TYR 49 Cb -0.06 -0.69 0.00 0.00 0.38 0.00 0.00 41.96 41.59 3jwo s TYR 49 CO -0.00 0.09 0.01 0.00 -1.52 0.00 0.00 175.55 174.13 3jwo n ALA 50 N 0.82 -0.52 0.00 9.51 0.00 -0.73 -1.40 120.51 128.19 3jwo n ALA 50 Ca -0.18 0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.41 3jwo n ALA 50 Cb 0.56 -1.94 0.00 0.00 0.00 0.00 0.00 19.45 18.07 3jwo n ALA 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3jwo n ALA 51 N -1.87 0.00 0.00 0.00 0.00 -0.53 -3.99 120.51 114.11 3jwo n ALA 51 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.24 3jwo n ALA 51 Cb 0.66 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.11 3jwo n ALA 51 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3jwo n SER 52 N 0.68 2.12 -4.70 0.00 3.41 -1.24 -3.64 113.62 110.25 3jwo n SER 52 Ca 0.00 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.19 3jwo n SER 52 Cb 0.00 0.40 -0.03 0.00 -0.26 0.00 0.00 64.21 64.33 3jwo n SER 52 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 3jwo s THR 53 N -0.90 4.54 0.14 6.66 2.01 -0.49 -4.56 115.64 123.03 3jwo s THR 53 Ca 0.00 1.83 -0.30 0.00 0.31 0.00 0.00 61.69 63.53 3jwo s THR 53 Cb 0.00 -4.17 -0.07 0.00 0.01 0.00 0.00 72.50 68.27 3jwo s THR 53 CO 0.00 0.07 0.95 -0.22 -0.69 0.00 0.00 174.62 174.73 3jwo s LEU 54 N 1.59 4.53 0.45 4.42 2.96 -1.26 -1.16 118.68 130.22 3jwo s LEU 54 Ca 0.53 1.82 -0.23 0.00 -0.22 0.00 0.00 54.13 56.03 3jwo s LEU 54 Cb -0.23 -3.58 -0.08 0.00 0.50 0.00 0.00 46.19 42.81 3jwo s LEU 54 CO 0.24 -0.01 1.12 -1.58 -1.32 0.00 0.00 176.35 174.80 3jwo s GLN 55 N -0.29 3.82 0.27 1.98 2.00 -0.44 -4.90 119.66 122.10 3jwo s GLN 55 Ca 0.45 1.66 -0.30 0.00 -2.00 0.00 0.00 55.36 55.17 3jwo s GLN 55 Cb -0.24 -2.37 -0.11 0.00 0.80 0.00 0.00 33.01 31.09 3jwo s GLN 55 CO 0.30 -0.47 1.50 -1.54 -0.50 0.00 0.00 175.29 174.59 3jwo s SER 56 N -1.50 6.53 -0.12 6.67 1.04 -1.26 -2.69 113.70 122.36 3jwo s SER 56 Ca 0.63 2.80 0.00 0.00 0.48 0.00 0.00 55.95 59.86 3jwo s SER 56 Cb -0.25 -2.63 0.00 0.00 0.10 0.00 0.00 66.02 63.24 3jwo s SER 56 CO 0.31 -0.79 0.00 0.61 0.98 0.00 0.00 173.24 174.35 3jwo n GLY 57 N 2.08 0.42 3.36 7.32 0.00 -1.26 -5.04 105.19 112.07 3jwo n GLY 57 Ca 0.07 -0.97 -0.33 0.00 0.00 0.00 0.00 46.02 44.79 3jwo n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3jwo s VAL 58 N -2.05 2.90 0.17 1.61 1.01 -1.10 -5.09 120.40 117.86 3jwo s VAL 58 Ca 0.00 -0.72 -0.32 0.00 0.00 0.00 0.00 61.98 60.94 3jwo s VAL 58 Cb 0.00 -2.20 -0.17 0.00 0.00 0.00 0.00 36.38 34.02 3jwo s VAL 58 CO 0.00 0.54 0.92 -2.65 0.00 0.00 0.00 175.10 173.91 3jwo n PRO 59 N 3.37 0.64 0.28 2.72 -0.02 -1.26 -4.85 135.00 135.88 3jwo n PRO 59 Ca -0.18 0.23 0.19 0.00 -2.02 0.00 0.00 63.50 61.71 3jwo n PRO 59 Cb 0.53 -1.55 0.87 0.00 -0.02 0.00 0.00 33.50 33.33 3jwo n PRO 59 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 3jwo h SER 60 N 2.34 0.00 0.13 2.55 4.64 -1.99 -2.35 113.55 118.88 3jwo h SER 60 Ca -0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.93 3jwo h SER 60 Cb 1.39 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.48 3jwo h SER 60 CO 0.64 0.00 0.00 -2.11 -0.87 0.00 0.00 176.83 174.49 3jwo n ARG 61 N -2.96 0.40 -3.70 4.77 1.85 -1.26 -4.61 116.66 111.15 3jwo n ARG 61 Ca -0.01 0.06 -0.37 0.00 -1.00 0.00 0.00 57.85 56.53 3jwo n ARG 61 Cb 0.19 -1.50 -0.07 0.00 -1.05 0.00 0.00 32.46 30.04 3jwo n ARG 61 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 3jwo s PHE 62 N -2.25 3.57 -0.28 2.89 0.40 -0.89 -1.41 117.98 120.01 3jwo s PHE 62 Ca 0.21 0.61 -0.25 0.00 -0.60 0.00 0.00 56.93 56.90 3jwo s PHE 62 Cb 0.11 -2.14 0.11 0.00 0.51 0.00 0.00 43.02 41.62 3jwo s PHE 62 CO 0.22 0.54 0.97 -1.54 0.70 0.00 0.00 175.22 176.11 3jwo s SER 63 N -0.48 -0.50 0.12 1.36 1.04 -0.99 -4.98 113.70 109.27 3jwo s SER 63 Ca 0.16 0.96 0.09 0.00 0.48 0.00 0.00 55.95 57.64 3jwo s SER 63 Cb -0.13 0.97 -0.04 0.00 0.10 0.00 0.00 66.02 66.92 3jwo s SER 63 CO 0.05 -0.18 -0.21 -0.83 0.98 0.00 0.00 173.24 173.06 3jwo s GLY 64 N 0.21 1.32 0.16 7.32 0.00 -1.26 -0.85 107.32 114.23 3jwo s GLY 64 Ca 0.02 -1.33 0.03 0.00 0.00 0.00 0.00 44.72 43.44 3jwo s GLY 64 CO -0.05 -1.34 0.09 -1.14 0.00 0.00 0.00 173.10 170.66 3jwo n SER 65 N 0.87 0.43 0.00 1.64 3.41 -0.50 -4.06 113.62 115.40 3jwo n SER 65 Ca -0.18 -1.96 0.00 0.00 -0.26 0.00 0.00 58.87 56.47 3jwo n SER 65 Cb 0.54 0.59 0.00 0.00 -0.26 0.00 0.00 64.21 65.08 3jwo n SER 65 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3jwo n GLY 66 N 0.38 2.39 3.54 5.00 0.00 -1.26 -2.24 105.19 112.99 3jwo n GLY 66 Ca 0.00 -1.90 -0.13 0.00 0.00 0.00 0.00 46.02 43.99 3jwo n GLY 66 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3jwo s SER 67 N 0.00 -0.69 0.00 1.61 0.15 -1.18 -4.89 113.70 108.70 3jwo s SER 67 Ca 0.00 1.29 0.00 0.00 0.70 0.00 0.00 55.95 57.94 3jwo s SER 67 Cb 0.00 1.29 0.00 0.00 -1.71 0.00 0.00 66.02 65.60 3jwo s SER 67 CO 0.00 -0.22 0.00 0.61 1.20 0.00 0.00 173.24 174.83 3jwo n GLY 68 N 2.96 1.23 0.00 9.45 0.00 0.13 -4.28 105.19 114.68 3jwo n GLY 68 Ca -0.15 -0.54 0.00 0.00 0.00 0.00 0.00 46.02 45.33 3jwo n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3jwo n THR 69 N 0.00 0.00 -3.61 2.61 -2.24 -1.26 -0.95 114.28 108.82 3jwo n THR 69 Ca 0.00 0.00 -0.38 0.00 -2.27 0.00 0.00 64.05 61.40 3jwo n THR 69 Cb 0.00 -0.55 -0.11 0.00 -2.10 0.00 0.00 70.33 67.57 3jwo n THR 69 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 3jwo s ASP 70 N -2.96 5.85 0.32 3.42 1.01 -1.26 -1.37 116.67 121.67 3jwo s ASP 70 Ca 0.00 -0.13 0.04 0.00 0.71 0.00 0.00 52.55 53.17 3jwo s ASP 70 Cb 0.00 -2.08 -0.06 0.00 1.01 0.00 0.00 42.92 41.79 3jwo s ASP 70 CO 0.00 -0.08 0.04 -0.36 0.21 0.00 0.00 175.17 174.98 3jwo s PHE 71 N 1.72 1.95 -0.28 4.23 0.40 -0.85 -3.09 117.98 122.06 3jwo s PHE 71 Ca 0.07 -0.93 -0.17 0.00 -0.60 0.00 0.00 56.93 55.30 3jwo s PHE 71 Cb -0.16 -1.26 0.10 0.00 0.51 0.00 0.00 43.02 42.21 3jwo s PHE 71 CO 0.09 0.04 0.77 -1.54 0.70 0.00 0.00 175.22 175.29 3jwo s SER 72 N -3.48 -0.80 -0.12 1.36 1.04 -0.95 -1.21 113.70 109.54 3jwo s SER 72 Ca 0.35 1.32 -0.08 0.00 0.48 0.00 0.00 55.95 58.02 3jwo s SER 72 Cb 0.08 1.33 -0.04 0.00 0.10 0.00 0.00 66.02 67.49 3jwo s SER 72 CO 0.15 -0.21 0.17 -0.22 0.98 0.00 0.00 173.24 174.11 3jwo s LEU 73 N 1.37 4.38 -0.02 2.42 2.96 0.45 -1.41 118.68 128.82 3jwo s LEU 73 Ca -0.08 0.50 0.00 0.00 -0.22 0.00 0.00 54.13 54.33 3jwo s LEU 73 Cb -0.05 -2.13 0.03 0.00 0.50 0.00 0.00 46.19 44.54 3jwo s LEU 73 CO -0.16 0.37 0.01 -0.89 -1.32 0.00 0.00 176.35 174.36 3jwo s THR 74 N -0.85 0.06 -0.20 3.68 2.01 -0.03 -1.06 115.64 119.26 3jwo s THR 74 Ca 0.15 0.15 -0.04 0.00 0.31 0.00 0.00 61.69 62.26 3jwo s THR 74 Cb -0.12 -0.18 -0.02 0.00 0.01 0.00 0.00 72.50 72.19 3jwo s THR 74 CO 0.04 0.12 -0.03 -0.63 -0.69 0.00 0.00 174.62 173.43 3jwo s ILE 75 N 1.03 3.66 0.00 1.82 1.01 -0.46 -2.34 121.20 125.92 3jwo s ILE 75 Ca -0.10 -0.41 0.00 0.00 0.00 0.00 0.00 60.65 60.14 3jwo s ILE 75 Cb -0.13 -2.64 0.00 0.00 0.01 0.00 0.00 42.46 39.69 3jwo s ILE 75 CO -0.02 0.44 0.00 0.59 0.00 0.00 0.00 174.94 175.95 3jwo n ASN 76 N 4.32 0.00 -4.55 3.58 3.02 -0.50 -1.82 115.26 119.31 3jwo n ASN 76 Ca -0.18 0.00 -0.40 0.00 -0.03 0.00 0.00 54.58 53.97 3jwo n ASN 76 Cb 0.52 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.66 3jwo n ASN 76 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 3jwo s SER 77 N -1.62 6.09 0.37 6.41 0.15 -1.26 -3.45 113.70 120.39 3jwo s SER 77 Ca 0.00 -0.54 -0.28 0.00 0.70 0.00 0.00 55.95 55.83 3jwo s SER 77 Cb 0.00 -2.56 -0.11 0.00 -1.71 0.00 0.00 66.02 61.64 3jwo s SER 77 CO 0.00 -1.87 1.49 -0.11 1.20 0.00 0.00 173.24 173.96 3jwo n LEU 78 N 9.79 4.70 -4.49 3.45 7.94 -0.52 -4.71 117.00 133.16 3jwo n LEU 78 Ca 0.11 1.22 -0.24 0.00 -1.11 0.00 0.00 56.01 55.99 3jwo n LEU 78 Cb 0.50 -1.61 -0.10 0.00 0.53 0.00 0.00 43.42 42.73 3jwo n LEU 78 CO 0.70 0.14 -0.42 -1.10 -1.11 0.00 0.00 177.39 175.60 3jwo s GLN 79 N -1.91 1.70 0.37 1.96 -1.52 -1.26 -1.30 119.66 117.70 3jwo s GLN 79 Ca 0.54 -1.83 0.06 0.00 -1.95 0.00 0.00 55.36 52.18 3jwo s GLN 79 Cb -0.48 -1.61 0.75 0.00 -0.22 0.00 0.00 33.01 31.46 3jwo s GLN 79 CO 0.62 0.19 1.98 -1.35 -0.25 0.00 0.00 175.29 176.49 3jwo h PRO 80 N 2.18 0.71 -0.54 2.91 0.11 -1.99 -1.17 132.00 134.20 3jwo h PRO 80 Ca -0.41 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.66 3jwo h PRO 80 Cb 1.25 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.20 3jwo h PRO 80 CO 0.66 0.47 0.00 -0.85 -0.21 0.00 0.00 178.00 178.07 3jwo n GLU 81 N -4.47 2.34 0.00 1.05 0.00 -1.26 -3.67 120.64 114.63 3jwo n GLU 81 Ca 0.09 -1.50 0.09 0.00 0.00 0.00 0.00 57.16 55.84 3jwo n GLU 81 Cb 0.18 -1.53 -0.02 0.00 0.00 0.00 0.00 31.44 30.06 3jwo n GLU 81 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 3jwo n ASP 82 N 0.52 1.58 -4.57 -1.84 8.00 -0.44 -4.88 116.55 114.91 3jwo n ASP 82 Ca 0.14 -1.29 -0.42 0.00 0.71 0.00 0.00 54.79 53.92 3jwo n ASP 82 Cb 0.49 0.58 -0.03 0.00 -0.02 0.00 0.00 41.12 42.15 3jwo n ASP 82 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3jwo s PHE 83 N -2.22 2.66 0.00 1.24 0.40 -1.24 -4.91 117.98 113.90 3jwo s PHE 83 Ca 0.13 0.34 0.00 0.00 -0.60 0.00 0.00 56.93 56.80 3jwo s PHE 83 Cb 0.14 -4.41 0.00 0.00 0.51 0.00 0.00 43.02 39.27 3jwo s PHE 83 CO 0.52 -1.51 0.00 0.00 0.70 0.00 0.00 175.22 174.93 3jwo n ALA 84 N 8.19 0.00 -2.95 5.36 0.00 -1.19 -4.95 120.51 124.97 3jwo n ALA 84 Ca 0.07 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.18 3jwo n ALA 84 Cb 0.49 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.81 3jwo n ALA 84 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3jwo s THR 85 N -2.91 3.56 -0.03 0.00 2.01 -0.97 -0.74 115.64 116.56 3jwo s THR 85 Ca 0.00 -0.49 0.02 0.00 0.31 0.00 0.00 61.69 61.54 3jwo s THR 85 Cb 0.00 -2.52 -0.03 0.00 0.01 0.00 0.00 72.50 69.95 3jwo s THR 85 CO 0.00 0.52 -0.07 -0.31 -0.69 0.00 0.00 174.62 174.07 3jwo s TYR 86 N 0.22 2.91 0.02 4.92 1.51 0.60 -0.76 117.35 126.78 3jwo s TYR 86 Ca -0.05 -0.01 0.06 0.00 -1.01 0.00 0.00 57.07 56.06 3jwo s TYR 86 Cb -0.14 -1.65 -0.02 0.00 -0.11 0.00 0.00 41.96 40.03 3jwo s TYR 86 CO 0.04 0.36 -0.17 0.71 -1.11 0.00 0.00 175.55 175.37 3jwo s TYR 87 N -0.93 1.53 0.36 2.71 1.51 -0.46 -1.29 117.35 120.79 3jwo s TYR 87 Ca 0.15 -0.34 0.07 0.00 -1.01 0.00 0.00 57.07 55.95 3jwo s TYR 87 Cb -0.11 -0.93 -0.01 0.00 -0.11 0.00 0.00 41.96 40.80 3jwo s TYR 87 CO 0.05 0.04 0.47 0.00 -1.11 0.00 0.00 175.55 175.00 3jwo s GLN 89 N -4.19 0.64 0.37 0.00 0.74 0.05 -1.60 119.66 115.66 3jwo s GLN 89 Ca 0.47 1.34 -0.28 0.00 0.05 0.00 0.00 55.36 56.94 3jwo s GLN 89 Cb -0.09 0.50 -0.11 0.00 1.10 0.00 0.00 33.01 34.41 3jwo s GLN 89 CO 0.31 -0.18 1.46 0.94 -0.55 0.00 0.00 175.29 177.27 3jwo n GLN 90 N 4.88 2.58 -0.42 1.67 7.27 -0.73 -1.75 117.38 130.87 3jwo n GLN 90 Ca -0.16 0.90 0.00 0.00 0.07 0.00 0.00 57.00 57.82 3jwo n GLN 90 Cb 0.54 -2.61 0.01 0.00 2.41 0.00 0.00 30.24 30.59 3jwo n GLN 90 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 3jwo n ALA 91 N 0.48 1.91 0.06 1.69 0.00 -0.77 -3.91 120.51 119.97 3jwo n ALA 91 Ca 0.02 -1.03 0.11 0.00 0.00 0.00 0.00 53.44 52.55 3jwo n ALA 91 Cb 0.38 -0.44 -0.10 0.00 0.00 0.00 0.00 19.45 19.29 3jwo n ALA 91 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 3jwo n ASN 92 N -0.07 0.35 0.00 0.00 6.94 -1.26 -4.92 115.26 116.30 3jwo n ASN 92 Ca 0.01 0.11 0.00 0.00 -0.02 0.00 0.00 54.58 54.67 3jwo n ASN 92 Cb 0.67 1.36 0.00 0.00 -2.36 0.00 0.00 39.78 39.45 3jwo n ASN 92 CO 0.00 0.00 0.00 -1.54 -1.03 0.00 0.00 177.26 174.69 3jwo n SER 93 N -2.40 0.00 -4.91 0.53 3.41 -1.26 -5.12 113.62 103.87 3jwo n SER 93 Ca -0.02 0.00 -0.27 0.00 -0.26 0.00 0.00 58.87 58.32 3jwo n SER 93 Cb 0.56 0.31 0.05 0.00 -0.26 0.00 0.00 64.21 64.86 3jwo n SER 93 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 3jwo s PHE 94 N -0.90 3.18 -0.27 7.33 0.40 -1.26 -5.03 117.98 121.42 3jwo s PHE 94 Ca 0.00 0.69 0.17 0.00 -0.60 0.00 0.00 56.93 57.19 3jwo s PHE 94 Cb 0.00 -2.94 0.49 0.00 0.51 0.00 0.00 43.02 41.08 3jwo s PHE 94 CO 0.00 -1.07 1.14 1.19 0.70 0.00 0.00 175.22 177.18 3jwo n PHE 96 N -2.78 1.83 -1.67 0.36 3.01 -1.25 -3.73 117.46 113.23 3jwo n PHE 96 Ca 0.06 -2.19 -0.44 0.00 1.01 0.00 0.00 57.45 55.89 3jwo n PHE 96 Cb 0.58 -0.27 -0.02 0.00 -0.01 0.00 0.00 39.48 39.76 3jwo n PHE 96 CO 0.00 0.00 0.00 2.41 1.01 0.00 0.00 176.76 180.18 3jwo n THR 97 N -0.63 1.59 -3.82 4.37 -1.04 -1.26 -4.62 114.28 108.87 3jwo n THR 97 Ca 0.21 -0.40 -0.30 0.00 -2.04 0.00 0.00 64.05 61.52 3jwo n THR 97 Cb 0.86 -1.42 -0.04 0.00 -1.82 0.00 0.00 70.33 67.91 3jwo n THR 97 CO 0.00 0.00 0.00 -0.36 -0.64 0.00 0.00 175.07 174.07 3jwo s PHE 98 N -0.69 3.50 0.62 -1.42 0.40 -1.26 -1.77 117.98 117.35 3jwo s PHE 98 Ca 0.61 0.34 -0.12 0.00 -0.60 0.00 0.00 56.93 57.15 3jwo s PHE 98 Cb -0.63 -1.83 -0.03 0.00 0.51 0.00 0.00 43.02 41.04 3jwo s PHE 98 CO 0.57 0.51 1.03 0.20 0.70 0.00 0.00 175.22 178.23 3jwo s GLY 99 N -2.67 1.75 0.27 4.36 0.00 -0.63 -4.63 107.32 105.77 3jwo s GLY 99 Ca 0.37 0.02 -0.04 0.00 0.00 0.00 0.00 44.72 45.07 3jwo s GLY 99 CO 0.27 0.31 1.61 -1.33 0.00 0.00 0.00 173.10 173.96 3jwo h GLY 100 N -0.18 0.98 0.00 0.20 0.00 -1.85 -3.43 103.07 98.78 3jwo h GLY 100 Ca -0.45 0.13 0.00 0.00 0.00 0.00 0.00 47.33 47.01 3jwo h GLY 100 CO 0.60 -0.36 0.00 0.61 0.00 0.00 0.00 176.54 177.39 3jwo n GLY 101 N -1.45 3.81 2.68 4.60 0.00 -1.26 -5.07 105.19 108.49 3jwo n GLY 101 Ca 0.17 -1.58 -0.24 0.00 0.00 0.00 0.00 46.02 44.37 3jwo n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3jwo s THR 102 N -1.99 0.07 -0.20 2.61 2.01 -0.42 -4.48 115.64 113.25 3jwo s THR 102 Ca 0.00 0.05 -0.16 0.00 0.31 0.00 0.00 61.69 61.89 3jwo s THR 102 Cb 0.00 -0.48 -0.04 0.00 0.01 0.00 0.00 72.50 72.00 3jwo s THR 102 CO 0.00 -0.01 0.41 -0.75 -0.69 0.00 0.00 174.62 173.59 3jwo s LYS 103 N 2.08 4.18 -0.60 4.92 2.20 -0.37 -0.29 119.74 131.87 3jwo s LYS 103 Ca 0.03 0.23 -0.08 0.00 -0.36 0.00 0.00 55.97 55.80 3jwo s LYS 103 Cb -0.14 -3.53 0.15 0.00 -1.51 0.00 0.00 37.83 32.80 3jwo s LYS 103 CO -0.06 -0.04 0.46 0.08 -0.36 0.00 0.00 175.35 175.44 3jwo s VAL 104 N 1.30 4.32 0.44 4.02 1.01 0.08 -0.60 120.40 130.98 3jwo s VAL 104 Ca 0.20 -2.33 0.08 0.00 0.00 0.00 0.00 61.98 59.93 3jwo s VAL 104 Cb -0.15 -3.79 0.02 0.00 0.00 0.00 0.00 36.38 32.46 3jwo s VAL 104 CO 0.08 -0.86 0.59 -1.83 0.00 0.00 0.00 175.10 173.08 3jwo s GLU 105 N 0.62 2.74 0.94 2.72 4.04 -0.81 -3.15 118.70 125.81 3jwo s GLU 105 Ca 0.12 -1.31 -0.14 0.00 0.04 0.00 0.00 54.97 53.68 3jwo s GLU 105 Cb -0.21 -2.72 0.20 0.00 0.02 0.00 0.00 34.13 31.42 3jwo s GLU 105 CO -0.04 -0.35 1.29 0.42 -1.84 0.00 0.00 175.26 174.75 3jwo s ILE 106 N -2.40 2.01 -0.03 1.83 1.01 -1.26 -2.37 121.20 119.99 3jwo s ILE 106 Ca 0.55 -0.09 0.02 0.00 0.00 0.00 0.00 60.65 61.13 3jwo s ILE 106 Cb -0.09 -2.92 0.01 0.00 0.01 0.00 0.00 42.46 39.47 3jwo s ILE 106 CO 0.33 0.00 -0.09 -0.75 0.00 0.00 0.00 174.94 174.44 3jwo s LYS 107 N -5.81 1.02 0.00 2.79 2.20 -1.21 -4.68 119.74 114.05 3jwo s LYS 107 Ca 0.74 -0.28 0.00 0.00 -0.36 0.00 0.00 55.97 56.07 3jwo s LYS 107 Cb -0.03 -0.94 0.00 0.00 -1.51 0.00 0.00 37.83 35.35 3jwo s LYS 107 CO 0.52 0.07 0.00 2.89 -0.36 0.00 0.00 175.35 178.47 3jwo n ARG 108 N 3.46 0.00 -3.64 4.03 1.85 -1.26 -4.86 116.66 116.24 3jwo n ARG 108 Ca -0.20 0.00 -0.30 0.00 -1.00 0.00 0.00 57.85 56.35 3jwo n ARG 108 Cb 0.53 0.00 -0.04 0.00 -1.05 0.00 0.00 32.46 31.90 3jwo n ARG 108 CO 0.00 0.00 0.00 0.95 -0.01 0.00 0.00 177.63 178.57 3jwo s THR 109 N -2.01 5.16 0.09 8.89 -4.23 -1.26 -5.02 115.64 117.26 3jwo s THR 109 Ca 0.00 -0.10 -0.31 0.00 -1.18 0.00 0.00 61.69 60.10 3jwo s THR 109 Cb 0.00 -3.67 -0.11 0.00 1.34 0.00 0.00 72.50 70.06 3jwo s THR 109 CO 0.00 -0.08 1.86 0.52 -0.54 0.00 0.00 174.62 176.39 3jwo n VAL 110 N -0.29 0.46 -5.11 2.29 0.31 -1.26 -4.74 118.33 109.98 3jwo n VAL 110 Ca -0.03 -0.08 -0.30 0.00 -0.01 0.00 0.00 64.34 63.92 3jwo n VAL 110 Cb 0.53 -2.12 -0.17 0.00 -0.91 0.00 0.00 33.84 31.17 3jwo n VAL 110 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3jwo s ALA 111 N 3.15 1.96 0.45 3.52 0.00 -0.81 -4.95 121.76 125.08 3jwo s ALA 111 Ca 0.84 -0.91 -0.23 0.00 0.00 0.00 0.00 51.96 51.67 3jwo s ALA 111 Cb -0.50 -0.66 -0.08 0.00 0.00 0.00 0.00 23.12 21.88 3jwo s ALA 111 CO 0.40 0.33 1.11 0.00 0.00 0.00 0.00 175.76 177.60 3jwo s ALA 112 N 0.06 2.97 0.02 0.00 0.00 -1.26 -2.53 121.76 121.02 3jwo s ALA 112 Ca -0.08 0.81 -0.27 0.00 0.00 0.00 0.00 51.96 52.42 3jwo s ALA 112 Cb -0.14 -3.33 -0.05 0.00 0.00 0.00 0.00 23.12 19.60 3jwo s ALA 112 CO 0.05 -0.48 0.83 -2.14 0.00 0.00 0.00 175.76 174.02 3jwo s PRO 113 N -2.75 4.53 -0.60 0.00 0.02 -1.26 -4.57 135.00 130.38 3jwo s PRO 113 Ca 0.63 1.17 -0.28 0.00 0.02 0.00 0.00 61.00 62.54 3jwo s PRO 113 Cb -0.25 -3.41 0.02 0.00 0.02 0.00 0.00 34.50 30.89 3jwo s PRO 113 CO 0.30 0.15 1.33 -1.12 -0.33 0.00 0.00 177.00 177.32 3jwo s SER 114 N 0.38 6.23 -0.01 2.53 0.01 -0.65 -4.82 113.70 117.37 3jwo s SER 114 Ca 0.43 0.11 -0.21 0.00 1.31 0.00 0.00 55.95 57.59 3jwo s SER 114 Cb -0.20 -2.55 -0.05 0.00 0.21 0.00 0.00 66.02 63.42 3jwo s SER 114 CO 0.24 -1.66 0.63 -0.69 0.41 0.00 0.00 173.24 172.16 3jwo s VAL 115 N 5.69 4.92 0.27 3.43 1.01 -1.26 -1.16 120.40 133.30 3jwo s VAL 115 Ca 0.47 1.31 0.02 0.00 0.00 0.00 0.00 61.98 63.77 3jwo s VAL 115 Cb -0.09 -3.96 -0.05 0.00 0.00 0.00 0.00 36.38 32.27 3jwo s VAL 115 CO 0.24 0.38 0.09 -0.36 0.00 0.00 0.00 175.10 175.45 3jwo s PHE 116 N 0.00 1.62 -0.17 5.22 0.40 0.41 -5.00 117.98 120.46 3jwo s PHE 116 Ca 0.33 -1.13 -0.07 0.00 -0.60 0.00 0.00 56.93 55.45 3jwo s PHE 116 Cb -0.18 -0.98 0.07 0.00 0.51 0.00 0.00 43.02 42.44 3jwo s PHE 116 CO 0.18 -0.26 0.38 -1.50 0.70 0.00 0.00 175.22 174.72 3jwo s ILE 117 N -3.66 -0.34 -0.21 0.64 1.10 -1.26 -2.23 121.20 115.24 3jwo s ILE 117 Ca 0.37 0.15 0.01 0.00 -0.51 0.00 0.00 60.65 60.67 3jwo s ILE 117 Cb 0.08 -0.59 0.03 0.00 0.15 0.00 0.00 42.46 42.12 3jwo s ILE 117 CO 0.14 0.06 -0.15 -0.36 -2.11 0.00 0.00 174.94 172.52 3jwo s PHE 118 N 2.03 2.93 0.75 3.50 2.99 -0.18 -5.03 117.98 124.97 3jwo s PHE 118 Ca -0.05 -1.70 -0.11 0.00 0.00 0.00 0.00 56.93 55.07 3jwo s PHE 118 Cb -0.11 -1.96 0.04 0.00 0.00 0.00 0.00 43.02 41.00 3jwo s PHE 118 CO -0.12 -0.79 1.08 -2.14 -0.00 0.00 0.00 175.22 173.25 3jwo s PRO 119 N 1.28 2.46 0.23 0.24 0.02 -1.26 -1.89 135.00 136.07 3jwo s PRO 119 Ca 0.02 0.90 -0.31 0.00 0.02 0.00 0.00 61.00 61.63 3jwo s PRO 119 Cb -0.15 -1.94 -0.11 0.00 0.02 0.00 0.00 34.50 32.33 3jwo s PRO 119 CO -0.09 -1.43 1.56 -1.25 -0.33 0.00 0.00 177.00 175.46 3jwo s PRO 120 N -5.04 4.19 0.00 5.54 0.04 -1.26 -4.88 135.00 133.60 3jwo s PRO 120 Ca 0.60 2.43 0.00 0.00 0.04 0.00 0.00 61.00 64.07 3jwo s PRO 120 Cb -0.15 -3.10 0.00 0.00 0.04 0.00 0.00 34.50 31.29 3jwo s PRO 120 CO 0.55 -0.58 0.00 -1.13 0.04 0.00 0.00 177.00 175.88 3jwo n SER 121 N 3.06 -0.07 0.12 6.66 3.41 -1.26 -4.95 113.62 120.58 3jwo n SER 121 Ca 0.11 -0.34 -0.05 0.00 -0.26 0.00 0.00 58.87 58.33 3jwo n SER 121 Cb 0.38 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.31 3jwo n SER 121 CO 0.00 0.00 0.00 -2.24 -0.16 0.00 0.00 175.04 172.64 3jwo h ASP 122 N -0.07 -0.28 -0.22 4.04 2.03 -2.01 -3.32 116.42 116.60 3jwo h ASP 122 Ca 0.00 0.01 0.06 0.00 -0.73 0.00 0.00 57.03 56.37 3jwo h ASP 122 Cb 0.00 0.07 -0.01 0.00 -0.83 0.00 0.00 39.33 38.56 3jwo h ASP 122 CO 0.00 -0.08 0.16 -0.33 -1.03 0.00 0.00 179.24 177.96 3jwo h GLU 123 N -0.56 0.00 0.00 4.15 5.08 -1.99 -0.72 114.58 120.54 3jwo h GLU 123 Ca -0.03 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.33 3jwo h GLU 123 Cb 0.25 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.50 3jwo h GLU 123 CO 0.05 0.00 -0.00 0.37 -1.00 0.00 0.00 179.01 178.43 3jwo h GLN 124 N 0.00 0.00 0.00 2.33 4.15 -1.90 -2.69 115.11 117.00 3jwo h GLN 124 Ca 0.10 0.00 -0.06 0.00 0.77 0.00 0.00 58.65 59.46 3jwo h GLN 124 Cb 0.42 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.10 3jwo h GLN 124 CO -0.00 0.00 -1.05 -0.07 -1.93 0.00 0.00 178.83 175.78 3jwo h LEU 125 N 0.00 0.00 -0.30 -2.39 3.38 -1.23 -3.26 115.31 111.51 3jwo h LEU 125 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3jwo h LEU 125 Cb 0.56 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.31 3jwo h LEU 125 CO 0.00 0.21 0.00 0.29 0.09 0.00 0.00 178.44 179.03 3jwo n LYS 126 N -2.80 1.20 -0.00 1.13 5.02 -1.02 -3.15 118.16 118.55 3jwo n LYS 126 Ca -0.03 -0.30 0.03 0.00 -2.02 0.00 0.00 58.31 55.99 3jwo n LYS 126 Cb 0.65 -1.33 -0.04 0.00 -0.02 0.00 0.00 35.03 34.29 3jwo n LYS 126 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 3jwo n SER 127 N -0.50 0.88 0.00 4.39 3.41 -1.23 -5.03 113.62 115.55 3jwo n SER 127 Ca 0.15 -0.53 0.00 0.00 -0.26 0.00 0.00 58.87 58.24 3jwo n SER 127 Cb 0.14 1.05 0.00 0.00 -0.26 0.00 0.00 64.21 65.14 3jwo n SER 127 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3jwo n GLY 128 N 1.32 0.83 3.09 5.00 0.00 -1.19 -5.06 105.19 109.19 3jwo n GLY 128 Ca 0.01 -0.64 -0.09 0.00 0.00 0.00 0.00 46.02 45.30 3jwo n GLY 128 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3jwo s THR 129 N -2.00 -0.62 -0.03 2.61 2.01 -1.23 -3.69 115.64 112.70 3jwo s THR 129 Ca 0.00 0.07 0.01 0.00 0.31 0.00 0.00 61.69 62.08 3jwo s THR 129 Cb 0.00 -0.72 -0.03 0.00 0.01 0.00 0.00 72.50 71.75 3jwo s THR 129 CO 0.00 -0.01 -0.03 0.00 -0.69 0.00 0.00 174.62 173.88 3jwo s ALA 130 N 2.58 3.14 -0.07 7.40 0.00 -0.52 -4.61 121.76 129.67 3jwo s ALA 130 Ca 0.05 -0.94 -0.03 0.00 0.00 0.00 0.00 51.96 51.04 3jwo s ALA 130 Cb -0.14 -1.28 0.04 0.00 0.00 0.00 0.00 23.12 21.75 3jwo s ALA 130 CO -0.14 0.61 0.16 -1.12 0.00 0.00 0.00 175.76 175.28 3jwo s SER 131 N -1.26 -0.04 -0.17 0.00 0.01 -1.26 -1.74 113.70 109.24 3jwo s SER 131 Ca 0.16 0.34 -0.09 0.00 1.31 0.00 0.00 55.95 57.67 3jwo s SER 131 Cb -0.11 0.24 -0.05 0.00 0.21 0.00 0.00 66.02 66.31 3jwo s SER 131 CO 0.06 -0.16 0.14 -0.69 0.41 0.00 0.00 173.24 173.00 3jwo s VAL 132 N 1.33 5.44 -0.11 3.43 1.01 -0.33 -4.27 120.40 126.89 3jwo s VAL 132 Ca -0.08 0.21 -0.06 0.00 0.00 0.00 0.00 61.98 62.05 3jwo s VAL 132 Cb -0.11 -3.45 -0.04 0.00 0.00 0.00 0.00 36.38 32.78 3jwo s VAL 132 CO -0.06 0.51 0.10 -0.69 0.00 0.00 0.00 175.10 174.96 3jwo s VAL 133 N -0.15 5.20 -0.07 2.92 1.01 -0.79 -0.64 120.40 127.88 3jwo s VAL 133 Ca 0.11 0.09 0.04 0.00 0.00 0.00 0.00 61.98 62.22 3jwo s VAL 133 Cb -0.11 -3.25 0.00 0.00 0.00 0.00 0.00 36.38 33.02 3jwo s VAL 133 CO 0.00 0.62 -0.18 0.00 0.00 0.00 0.00 175.10 175.54 3jwo s LEU 135 N 0.32 1.99 -0.34 0.00 2.96 -0.95 -1.27 118.68 121.40 3jwo s LEU 135 Ca -0.12 -0.69 -0.12 0.00 -0.22 0.00 0.00 54.13 52.99 3jwo s LEU 135 Cb -0.15 -1.21 -0.01 0.00 0.50 0.00 0.00 46.19 45.32 3jwo s LEU 135 CO 0.05 -0.10 0.21 -0.76 -1.32 0.00 0.00 176.35 174.43 3jwo s LEU 136 N 1.44 4.44 -0.03 -0.68 1.02 0.18 -0.45 118.68 124.60 3jwo s LEU 136 Ca 0.02 -0.55 -0.01 0.00 0.02 0.00 0.00 54.13 53.61 3jwo s LEU 136 Cb -0.14 -2.08 -0.04 0.00 0.02 0.00 0.00 46.19 43.95 3jwo s LEU 136 CO -0.10 -0.25 0.08 0.21 0.02 0.00 0.00 176.35 176.31 3jwo s ASN 137 N 1.66 5.68 0.00 2.29 2.47 -0.31 -1.46 114.94 125.28 3jwo s ASN 137 Ca 0.05 0.18 0.00 0.00 0.42 0.00 0.00 52.86 53.51 3jwo s ASN 137 Cb -0.18 -1.65 0.00 0.00 -1.45 0.00 0.00 41.25 37.98 3jwo s ASN 137 CO 0.09 0.30 0.00 0.59 -3.72 0.00 0.00 177.10 174.35 3jwo n ASN 138 N 1.39 -5.06 -3.69 -4.21 3.02 -1.10 -1.63 115.26 103.97 3jwo n ASN 138 Ca -0.14 0.35 -0.13 0.00 -0.03 0.00 0.00 54.58 54.62 3jwo n ASN 138 Cb 0.53 -1.18 -0.07 0.00 -0.61 0.00 0.00 39.78 38.45 3jwo n ASN 138 CO 0.00 0.00 0.00 0.72 -2.62 0.00 0.00 177.26 175.36 3jwo s PHE 139 N -0.67 1.03 -0.28 3.10 -0.12 -0.69 -4.39 117.98 115.96 3jwo s PHE 139 Ca 0.00 -1.24 -0.25 0.00 -0.05 0.00 0.00 56.93 55.39 3jwo s PHE 139 Cb 0.00 -0.24 0.11 0.00 -0.63 0.00 0.00 43.02 42.26 3jwo s PHE 139 CO 0.00 -0.93 0.98 -0.47 -0.05 0.00 0.00 175.22 174.75 3jwo s TYR 140 N -3.63 -0.53 0.13 3.49 5.04 -1.05 -1.13 117.35 119.67 3jwo s TYR 140 Ca 0.32 1.29 -0.02 0.00 -2.44 0.00 0.00 57.07 56.22 3jwo s TYR 140 Cb 0.02 0.35 0.03 0.00 0.35 0.00 0.00 41.96 42.71 3jwo s TYR 140 CO 0.16 -0.26 0.17 -2.30 -1.34 0.00 0.00 175.55 171.99 3jwo n PRO 141 N 2.32 -0.06 0.00 4.97 -0.02 -1.26 -1.93 135.00 139.02 3jwo n PRO 141 Ca -0.13 -0.29 0.05 0.00 -2.02 0.00 0.00 63.50 61.11 3jwo n PRO 141 Cb 0.56 -0.17 0.25 0.00 -0.02 0.00 0.00 33.50 34.11 3jwo n PRO 141 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 3jwo n ARG 142 N -1.36 0.05 -2.93 -0.52 0.63 -1.26 -4.71 116.66 106.55 3jwo n ARG 142 Ca 0.02 0.27 -0.41 0.00 -0.92 0.00 0.00 57.85 56.82 3jwo n ARG 142 Cb 0.08 -1.50 -0.04 0.00 0.45 0.00 0.00 32.46 31.45 3jwo n ARG 142 CO 0.00 0.00 0.00 -1.21 -2.51 0.00 0.00 177.63 173.91 3jwo s GLU 143 N -2.87 4.38 -0.27 -0.14 8.01 -1.26 -5.03 118.70 121.52 3jwo s GLU 143 Ca 0.07 1.00 -0.21 0.00 0.01 0.00 0.00 54.97 55.84 3jwo s GLU 143 Cb 0.07 -3.51 0.07 0.00 -4.31 0.00 0.00 34.13 26.45 3jwo s GLU 143 CO 0.19 -0.15 0.69 0.00 0.01 0.00 0.00 175.26 176.00 3jwo s ALA 144 N 1.50 -1.76 -0.34 5.21 0.00 -1.26 -4.64 121.76 120.48 3jwo s ALA 144 Ca 0.39 2.10 -0.06 0.00 0.00 0.00 0.00 51.96 54.39 3jwo s ALA 144 Cb -0.18 -1.23 0.04 0.00 0.00 0.00 0.00 23.12 21.76 3jwo s ALA 144 CO 0.16 -0.34 0.11 0.21 0.00 0.00 0.00 175.76 175.90 3jwo s LYS 145 N 0.80 2.60 -0.19 0.00 2.20 -0.88 -5.01 119.74 119.25 3jwo s LYS 145 Ca -0.03 -1.21 -0.05 0.00 -0.36 0.00 0.00 55.97 54.32 3jwo s LYS 145 Cb -0.05 -3.47 -0.02 0.00 -1.51 0.00 0.00 37.83 32.78 3jwo s LYS 145 CO -0.06 -0.69 -0.01 0.08 -0.36 0.00 0.00 175.35 174.31 3jwo s VAL 146 N 1.39 3.88 0.02 4.02 1.01 -1.26 -1.68 120.40 127.79 3jwo s VAL 146 Ca -0.01 -0.34 0.08 0.00 0.00 0.00 0.00 61.98 61.71 3jwo s VAL 146 Cb -0.20 -2.74 -0.03 0.00 0.00 0.00 0.00 36.38 33.41 3jwo s VAL 146 CO 0.02 0.44 -0.25 -1.10 0.00 0.00 0.00 175.10 174.22 3jwo s GLN 147 N 0.89 1.96 -0.23 2.72 -0.21 -0.73 -5.01 119.66 119.05 3jwo s GLN 147 Ca 0.01 -1.02 -0.07 0.00 0.02 0.00 0.00 55.36 54.29 3jwo s GLN 147 Cb -0.14 -2.04 -0.03 0.00 1.00 0.00 0.00 33.01 31.79 3jwo s GLN 147 CO 0.02 0.54 0.07 -1.58 -2.12 0.00 0.00 175.29 172.21 3jwo s TRP 148 N -0.76 3.11 -0.26 0.91 0.52 -1.26 -1.40 118.94 119.80 3jwo s TRP 148 Ca 0.12 -0.31 0.02 0.00 0.02 0.00 0.00 56.10 55.95 3jwo s TRP 148 Cb -0.10 -2.20 0.07 0.00 -1.15 0.00 0.00 33.47 30.09 3jwo s TRP 148 CO 0.01 -0.24 -0.06 0.15 0.02 0.00 0.00 176.95 176.84 3jwo s LYS 149 N 1.31 1.83 -0.33 4.98 1.02 -0.73 -2.73 119.74 125.08 3jwo s LYS 149 Ca 0.05 -1.23 -0.14 0.00 0.02 0.00 0.00 55.97 54.66 3jwo s LYS 149 Cb -0.15 -2.76 -0.02 0.00 -0.52 0.00 0.00 37.83 34.39 3jwo s LYS 149 CO 0.03 -0.64 0.33 0.08 -0.92 0.00 0.00 175.35 174.23 3jwo s VAL 150 N 1.23 5.20 -1.42 3.17 1.01 -1.05 -2.53 120.40 126.02 3jwo s VAL 150 Ca -0.05 0.02 -0.08 0.00 0.00 0.00 0.00 61.98 61.86 3jwo s VAL 150 Cb -0.19 -3.78 0.04 0.00 0.00 0.00 0.00 36.38 32.45 3jwo s VAL 150 CO -0.07 -0.04 0.95 0.47 0.00 0.00 0.00 175.10 176.41 3jwo n ASP 151 N 5.30 -3.94 -1.09 3.32 8.00 -0.03 -1.18 116.55 126.91 3jwo n ASP 151 Ca -0.10 -0.73 -0.14 0.00 0.71 0.00 0.00 54.79 54.52 3jwo n ASP 151 Cb 0.50 -4.25 -0.06 0.00 -0.02 0.00 0.00 41.12 37.29 3jwo n ASP 151 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3jwo n ASN 152 N -2.95 -5.08 -4.10 -2.24 3.02 -1.26 -4.96 115.26 97.68 3jwo n ASN 152 Ca -0.08 0.35 -0.36 0.00 -0.03 0.00 0.00 54.58 54.47 3jwo n ASN 152 Cb 0.58 -3.84 -0.12 0.00 -0.61 0.00 0.00 39.78 35.80 3jwo n ASN 152 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3jwo s ALA 153 N -2.41 3.20 0.00 5.41 0.00 -0.33 -5.07 121.76 122.57 3jwo s ALA 153 Ca 0.00 -2.65 -0.30 0.00 0.00 0.00 0.00 51.96 49.01 3jwo s ALA 153 Cb 0.00 -2.41 -0.07 0.00 0.00 0.00 0.00 23.12 20.64 3jwo s ALA 153 CO 0.00 -1.84 1.66 -1.17 0.00 0.00 0.00 175.76 174.41 3jwo s LEU 154 N 0.93 4.35 0.32 0.00 2.96 -1.26 -2.52 118.68 123.46 3jwo s LEU 154 Ca 0.10 2.35 0.10 0.00 -0.22 0.00 0.00 54.13 56.46 3jwo s LEU 154 Cb -0.22 -3.55 -0.06 0.00 0.50 0.00 0.00 46.19 42.86 3jwo s LEU 154 CO -0.04 -0.90 -0.09 -1.10 -1.32 0.00 0.00 176.35 172.89 3jwo s GLN 155 N 3.41 1.87 -0.04 1.98 -0.21 -1.11 -5.01 119.66 120.55 3jwo s GLN 155 Ca 0.74 -1.82 -0.08 0.00 0.02 0.00 0.00 55.36 54.22 3jwo s GLN 155 Cb -0.36 -1.80 0.01 0.00 1.00 0.00 0.00 33.01 31.86 3jwo s GLN 155 CO 0.31 0.20 0.19 0.45 -2.12 0.00 0.00 175.29 174.32 3jwo s SER 156 N -3.61 -0.11 0.00 5.90 0.15 -1.26 -4.57 113.70 110.20 3jwo s SER 156 Ca 0.32 0.13 0.00 0.00 0.70 0.00 0.00 55.95 57.10 3jwo s SER 156 Cb -0.01 0.32 0.00 0.00 -1.71 0.00 0.00 66.02 64.62 3jwo s SER 156 CO 0.17 -0.23 0.00 0.61 1.20 0.00 0.00 173.24 174.99 3jwo n GLY 157 N 2.20 2.01 1.35 9.45 0.00 -1.26 -4.94 105.19 114.00 3jwo n GLY 157 Ca -0.17 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.80 3jwo n GLY 157 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3jwo n ASN 158 N 0.00 3.29 -4.15 1.61 0.23 -1.26 -4.97 115.26 110.02 3jwo n ASN 158 Ca 0.00 -3.50 -0.21 0.00 -0.53 0.00 0.00 54.58 50.34 3jwo n ASN 158 Cb 0.00 -0.66 -0.14 0.00 -2.08 0.00 0.00 39.78 36.91 3jwo n ASN 158 CO 0.00 0.00 0.00 -0.94 -0.93 0.00 0.00 177.26 175.39 3jwo s SER 159 N -2.03 1.72 -0.05 0.53 1.04 -1.26 -1.61 113.70 112.04 3jwo s SER 159 Ca 0.47 -0.43 0.00 0.00 0.48 0.00 0.00 55.95 56.47 3jwo s SER 159 Cb 0.41 -0.12 0.02 0.00 0.10 0.00 0.00 66.02 66.42 3jwo s SER 159 CO 0.05 0.06 -0.03 -1.10 0.98 0.00 0.00 173.24 173.20 3jwo s GLN 160 N -1.02 0.76 0.31 4.02 -0.21 -0.01 -4.93 119.66 118.59 3jwo s GLN 160 Ca 0.03 -0.05 0.09 0.00 0.02 0.00 0.00 55.36 55.44 3jwo s GLN 160 Cb -0.08 -0.86 -0.05 0.00 1.00 0.00 0.00 33.01 33.03 3jwo s GLN 160 CO 0.01 -0.13 0.04 -1.83 -2.12 0.00 0.00 175.29 171.25 3jwo s GLU 161 N 1.15 2.23 -0.20 2.91 -1.05 -1.26 -0.06 118.70 122.42 3jwo s GLU 161 Ca -0.07 -1.57 -0.19 0.00 -0.15 0.00 0.00 54.97 52.99 3jwo s GLU 161 Cb -0.14 -2.08 0.05 0.00 -0.44 0.00 0.00 34.13 31.53 3jwo s GLU 161 CO -0.01 0.21 0.54 -1.54 0.95 0.00 0.00 175.26 175.41 3jwo s SER 162 N -3.73 -0.57 -0.07 0.83 1.04 -0.85 -4.99 113.70 105.36 3jwo s SER 162 Ca 0.34 1.09 0.00 0.00 0.48 0.00 0.00 55.95 57.86 3jwo s SER 162 Cb -0.03 1.10 -0.03 0.00 0.10 0.00 0.00 66.02 67.16 3jwo s SER 162 CO 0.20 -0.19 -0.05 -0.69 0.98 0.00 0.00 173.24 173.50 3jwo s VAL 163 N 0.33 3.86 0.81 5.02 1.01 -1.26 -2.31 120.40 127.86 3jwo s VAL 163 Ca -0.00 -0.43 -0.12 0.00 0.00 0.00 0.00 61.98 61.43 3jwo s VAL 163 Cb -0.04 -2.59 0.08 0.00 0.00 0.00 0.00 36.38 33.82 3jwo s VAL 163 CO 0.00 0.59 1.12 0.42 0.00 0.00 0.00 175.10 177.23 3jwo s THR 164 N -0.84 2.75 0.81 3.92 -4.23 -0.31 -4.99 115.64 112.75 3jwo s THR 164 Ca 0.13 0.24 -0.11 0.00 -1.18 0.00 0.00 61.69 60.77 3jwo s THR 164 Cb -0.11 -3.07 0.08 0.00 1.34 0.00 0.00 72.50 70.74 3jwo s THR 164 CO 0.02 -0.32 1.09 -1.61 -0.54 0.00 0.00 174.62 173.26 3jwo s GLU 165 N -5.28 1.98 0.14 3.99 0.41 -1.26 -4.57 118.70 114.12 3jwo s GLU 165 Ca 0.61 0.81 -0.31 0.00 -0.41 0.00 0.00 54.97 55.67 3jwo s GLU 165 Cb -0.13 -1.89 -0.09 0.00 -1.78 0.00 0.00 34.13 30.23 3jwo s GLU 165 CO 0.53 -1.73 1.58 -1.14 -0.49 0.00 0.00 175.26 174.00 3jwo s GLN 166 N -5.04 4.22 0.23 1.61 0.74 -1.26 -4.75 119.66 115.40 3jwo s GLN 166 Ca 0.61 2.34 -0.32 0.00 0.05 0.00 0.00 55.36 58.04 3jwo s GLN 166 Cb -0.16 -3.27 -0.12 0.00 1.10 0.00 0.00 33.01 30.56 3jwo s GLN 166 CO 0.55 -0.63 1.61 -3.47 -0.55 0.00 0.00 175.29 172.80 3jwo n ASP 167 N 4.36 3.59 0.28 6.67 -0.08 -0.48 -4.83 116.55 126.05 3jwo n ASP 167 Ca 0.14 1.11 0.16 0.00 -1.51 0.00 0.00 54.79 54.68 3jwo n ASP 167 Cb 0.39 -1.53 0.76 0.00 2.34 0.00 0.00 41.12 43.08 3jwo n ASP 167 CO 0.00 0.00 0.00 0.77 0.12 0.00 0.00 177.20 178.09 3jwo h SER 168 N 5.56 0.00 0.00 1.67 4.64 -1.92 0.55 113.55 124.06 3jwo h SER 168 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 3jwo h SER 168 Cb 1.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 3jwo h SER 168 CO 0.86 0.08 -0.71 2.29 -0.87 0.00 0.00 176.83 178.48 3jwo n LYS 169 N -3.34 0.44 -0.19 4.77 2.85 -1.26 -4.65 118.16 116.78 3jwo n LYS 169 Ca -0.01 0.32 0.12 0.00 -1.05 0.00 0.00 58.31 57.69 3jwo n LYS 169 Cb 0.26 -1.44 0.21 0.00 -0.65 0.00 0.00 35.03 33.41 3jwo n LYS 169 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 177.40 176.95 3jwo n ASP 170 N -4.30 3.44 -4.11 -5.58 5.68 -1.26 -4.99 116.55 105.43 3jwo n ASP 170 Ca -0.10 -1.98 -0.34 0.00 -0.50 0.00 0.00 54.79 51.87 3jwo n ASP 170 Cb 0.37 -0.25 -0.04 0.00 -1.14 0.00 0.00 41.12 40.06 3jwo n ASP 170 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 3jwo n SER 171 N 1.45 -1.28 -4.51 -1.12 3.41 0.18 -4.92 113.62 106.84 3jwo n SER 171 Ca 0.19 -1.20 -0.24 0.00 -0.26 0.00 0.00 58.87 57.36 3jwo n SER 171 Cb 0.60 -2.11 -0.11 0.00 -0.26 0.00 0.00 64.21 62.33 3jwo n SER 171 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 3jwo s THR 172 N -3.98 1.85 0.41 6.66 -4.23 -1.26 -4.67 115.64 110.42 3jwo s THR 172 Ca 0.18 -2.11 0.08 0.00 -1.18 0.00 0.00 61.69 58.66 3jwo s THR 172 Cb -0.09 -2.67 -0.03 0.00 1.34 0.00 0.00 72.50 71.05 3jwo s THR 172 CO 0.96 -0.17 0.32 -0.31 -0.54 0.00 0.00 174.62 174.88 3jwo s TYR 173 N -2.86 2.69 -0.08 3.99 1.51 -0.28 -1.38 117.35 120.94 3jwo s TYR 173 Ca 0.33 -0.51 -0.07 0.00 -1.01 0.00 0.00 57.07 55.80 3jwo s TYR 173 Cb 0.05 -2.10 0.02 0.00 -0.11 0.00 0.00 41.96 39.82 3jwo s TYR 173 CO 0.15 -0.03 0.20 -1.12 -1.11 0.00 0.00 175.55 173.64 3jwo s SER 174 N -4.07 -0.21 -0.01 2.29 0.01 -1.26 -1.70 113.70 108.75 3jwo s SER 174 Ca 0.46 0.41 0.03 0.00 1.31 0.00 0.00 55.95 58.16 3jwo s SER 174 Cb -0.01 0.41 -0.01 0.00 0.21 0.00 0.00 66.02 66.62 3jwo s SER 174 CO 0.26 -0.07 -0.10 -0.22 0.41 0.00 0.00 173.24 173.52 3jwo s LEU 175 N 0.13 1.98 -0.07 2.44 0.20 -0.54 -1.16 118.68 121.67 3jwo s LEU 175 Ca -0.00 -0.19 0.02 0.00 0.69 0.00 0.00 54.13 54.64 3jwo s LEU 175 Cb -0.02 -0.55 0.02 0.00 -0.43 0.00 0.00 46.19 45.21 3jwo s LEU 175 CO 0.00 0.12 -0.11 -0.94 -0.29 0.00 0.00 176.35 175.13 3jwo s SER 176 N -0.18 1.75 -0.13 3.68 1.04 -0.98 -0.64 113.70 118.24 3jwo s SER 176 Ca 0.03 -0.28 -0.01 0.00 0.48 0.00 0.00 55.95 56.16 3jwo s SER 176 Cb -0.05 -0.80 -0.02 0.00 0.10 0.00 0.00 66.02 65.25 3jwo s SER 176 CO -0.00 0.01 -0.09 -0.55 0.98 0.00 0.00 173.24 173.59 3jwo s SER 177 N 0.81 4.41 -0.20 7.02 0.15 -0.40 -2.01 113.70 123.47 3jwo s SER 177 Ca -0.12 -0.20 -0.04 0.00 0.70 0.00 0.00 55.95 56.29 3jwo s SER 177 Cb -0.15 -1.59 -0.01 0.00 -1.71 0.00 0.00 66.02 62.56 3jwo s SER 177 CO 0.02 0.20 -0.04 -0.89 1.20 0.00 0.00 173.24 173.73 3jwo s THR 178 N 0.15 3.54 -0.50 6.45 2.01 0.91 -1.02 115.64 127.18 3jwo s THR 178 Ca -0.04 -0.45 -0.15 0.00 0.31 0.00 0.00 61.69 61.36 3jwo s THR 178 Cb -0.14 -2.60 0.11 0.00 0.01 0.00 0.00 72.50 69.88 3jwo s THR 178 CO 0.04 0.43 0.44 -0.22 -0.69 0.00 0.00 174.62 174.62 3jwo s LEU 179 N 1.20 5.90 -0.08 4.42 2.96 0.19 -0.83 118.68 132.44 3jwo s LEU 179 Ca 0.03 -1.66 -0.17 0.00 -0.22 0.00 0.00 54.13 52.10 3jwo s LEU 179 Cb -0.14 -2.16 -0.05 0.00 0.50 0.00 0.00 46.19 44.34 3jwo s LEU 179 CO -0.01 -0.76 0.46 -0.89 -1.32 0.00 0.00 176.35 173.84 3jwo s THR 180 N 1.57 5.13 0.00 3.68 2.01 -0.63 -1.19 115.64 126.20 3jwo s THR 180 Ca 0.04 0.94 0.00 0.00 0.31 0.00 0.00 61.69 62.97 3jwo s THR 180 Cb -0.27 -3.80 0.00 0.00 0.01 0.00 0.00 72.50 68.44 3jwo s THR 180 CO 0.03 0.39 0.00 0.18 -0.69 0.00 0.00 174.62 174.54 3jwo n LEU 181 N 3.16 0.00 0.00 4.42 4.77 -0.71 -4.83 117.00 123.81 3jwo n LEU 181 Ca -0.09 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.89 3jwo n LEU 181 Cb 0.52 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.61 3jwo n LEU 181 CO 0.42 0.00 0.00 -1.54 -1.33 0.00 0.00 177.39 174.94 3jwo n SER 182 N 0.00 0.00 -0.05 -1.43 3.41 -1.26 -4.75 113.62 109.54 3jwo n SER 182 Ca 0.00 0.00 -0.02 0.00 -0.26 0.00 0.00 58.87 58.59 3jwo n SER 182 Cb 0.00 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 63.83 3jwo n SER 182 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 3jwo n LYS 183 N 0.00 1.23 -0.10 4.33 4.81 -1.24 -1.44 118.16 125.76 3jwo n LYS 183 Ca 0.00 -0.05 -0.13 0.00 -0.87 0.00 0.00 58.31 57.26 3jwo n LYS 183 Cb 0.00 -1.38 -0.11 0.00 0.02 0.00 0.00 35.03 33.56 3jwo n LYS 183 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3jwo n ALA 184 N -2.39 1.56 0.60 3.14 0.00 -1.26 -4.31 120.51 117.85 3jwo n ALA 184 Ca -0.17 -0.97 0.07 0.00 0.00 0.00 0.00 53.44 52.37 3jwo n ALA 184 Cb 0.80 -0.03 0.34 0.00 0.00 0.00 0.00 19.45 20.57 3jwo n ALA 184 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3jwo n ASP 185 N -2.96 0.00 -0.03 0.00 10.43 -1.26 -2.02 116.55 120.70 3jwo n ASP 185 Ca -0.34 0.28 -0.12 0.00 2.57 0.00 0.00 54.79 57.18 3jwo n ASP 185 Cb 0.94 -0.39 -0.14 0.00 1.84 0.00 0.00 41.12 43.37 3jwo n ASP 185 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 3jwo n TYR 186 N -1.39 0.86 0.09 1.24 9.36 -1.26 -4.33 117.16 121.73 3jwo n TYR 186 Ca 0.05 0.27 0.09 0.00 3.32 0.00 0.00 57.90 61.64 3jwo n TYR 186 Cb 0.14 -1.15 -0.02 0.00 -0.63 0.00 0.00 39.34 37.69 3jwo n TYR 186 CO 0.00 0.00 0.00 0.39 0.22 0.00 0.00 176.86 177.47 3jwo n GLU 187 N -3.10 0.61 0.00 2.98 1.02 -1.02 -3.57 120.64 117.56 3jwo n GLU 187 Ca -0.24 0.14 0.09 0.00 -0.02 0.00 0.00 57.16 57.13 3jwo n GLU 187 Cb 1.06 -1.82 0.51 0.00 -0.02 0.00 0.00 31.44 31.17 3jwo n GLU 187 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 3jwo n LYS 188 N -2.71 0.39 -4.38 3.49 4.01 -0.86 -4.74 118.16 113.36 3jwo n LYS 188 Ca -0.02 0.07 -0.19 0.00 -0.51 0.00 0.00 58.31 57.66 3jwo n LYS 188 Cb 0.61 -1.50 -0.10 0.00 -0.51 0.00 0.00 35.03 33.52 3jwo n LYS 188 CO 0.00 0.00 0.00 -1.01 -1.11 0.00 0.00 177.40 175.28 3jwo s HIS 189 N -2.36 1.74 0.00 2.13 3.76 -1.23 -5.08 115.29 114.26 3jwo s HIS 189 Ca 0.22 -1.09 0.00 0.00 -0.15 0.00 0.00 55.06 54.04 3jwo s HIS 189 Cb 0.13 -1.08 0.00 0.00 1.11 0.00 0.00 32.58 32.73 3jwo s HIS 189 CO 0.26 -0.18 0.00 1.17 -0.85 0.00 0.00 174.74 175.14 3jwo n LYS 190 N -0.58 0.44 -3.98 1.40 4.81 -1.26 -4.94 118.16 114.05 3jwo n LYS 190 Ca -0.01 0.00 -0.31 0.00 -0.87 0.00 0.00 58.31 57.12 3jwo n LYS 190 Cb 0.66 -0.04 -0.15 0.00 0.02 0.00 0.00 35.03 35.52 3jwo n LYS 190 CO 0.00 0.00 0.00 -1.17 1.17 0.00 0.00 177.40 177.40 3jwo s LEU 191 N 0.00 3.24 0.21 3.14 2.96 -1.26 -4.18 118.68 122.79 3jwo s LEU 191 Ca 0.00 -1.48 0.09 0.00 -0.22 0.00 0.00 54.13 52.52 3jwo s LEU 191 Cb 0.00 -1.35 -0.04 0.00 0.50 0.00 0.00 46.19 45.30 3jwo s LEU 191 CO 0.00 -0.27 -0.08 -0.31 -1.32 0.00 0.00 176.35 174.37 3jwo s TYR 192 N 1.23 2.62 0.08 5.38 1.51 -1.18 -0.85 117.35 126.13 3jwo s TYR 192 Ca -0.02 -0.23 -0.26 0.00 -1.01 0.00 0.00 57.07 55.54 3jwo s TYR 192 Cb -0.19 -1.24 0.08 0.00 -0.11 0.00 0.00 41.96 40.50 3jwo s TYR 192 CO -0.08 0.55 0.85 0.00 -1.11 0.00 0.00 175.55 175.76 3jwo s ALA 193 N -1.91 -1.71 -0.14 3.71 0.00 -1.05 -2.32 121.76 118.34 3jwo s ALA 193 Ca 0.27 0.62 -0.03 0.00 0.00 0.00 0.00 51.96 52.81 3jwo s ALA 193 Cb -0.08 0.58 0.05 0.00 0.00 0.00 0.00 23.12 23.67 3jwo s ALA 193 CO 0.16 -0.81 0.05 0.00 0.00 0.00 0.00 175.76 175.16 3jwo s GLU 195 N 2.01 4.42 -0.27 0.00 2.12 -0.50 -3.20 118.70 123.28 3jwo s GLU 195 Ca 0.02 1.60 -0.01 0.00 0.36 0.00 0.00 54.97 56.94 3jwo s GLU 195 Cb -0.15 -3.49 0.04 0.00 0.26 0.00 0.00 34.13 30.79 3jwo s GLU 195 CO -0.07 -0.31 -0.05 0.08 -0.54 0.00 0.00 175.26 174.36 3jwo s VAL 196 N 1.71 2.81 -0.44 3.70 1.01 -0.43 -1.78 120.40 126.98 3jwo s VAL 196 Ca 0.55 -1.22 -0.11 0.00 0.00 0.00 0.00 61.98 61.19 3jwo s VAL 196 Cb -0.24 -2.51 0.08 0.00 0.00 0.00 0.00 36.38 33.71 3jwo s VAL 196 CO 0.24 0.08 0.31 -0.89 0.00 0.00 0.00 175.10 174.83 3jwo s THR 197 N 1.27 4.58 0.13 3.92 2.01 -0.68 -2.36 115.64 124.51 3jwo s THR 197 Ca -0.03 -1.30 0.10 0.00 0.31 0.00 0.00 61.69 60.78 3jwo s THR 197 Cb -0.18 -3.78 -0.04 0.00 0.01 0.00 0.00 72.50 68.51 3jwo s THR 197 CO -0.04 -0.54 -0.24 -2.28 -0.69 0.00 0.00 174.62 170.84 3jwo s HIS 198 N 1.50 2.07 -0.29 4.92 2.46 -1.26 -2.08 115.29 122.61 3jwo s HIS 198 Ca 0.03 -0.40 0.27 0.00 0.47 0.00 0.00 55.06 55.44 3jwo s HIS 198 Cb -0.24 -1.10 1.10 0.00 -0.13 0.00 0.00 32.58 32.21 3jwo s HIS 198 CO 0.04 0.31 1.81 -0.56 -2.47 0.00 0.00 174.74 173.86 3jwo h GLN 199 N 3.80 0.00 -0.12 2.88 -0.00 -1.92 -1.37 115.11 118.39 3jwo h GLN 199 Ca -0.48 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.17 3jwo h GLN 199 Cb 1.18 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.66 3jwo h GLN 199 CO 0.41 0.00 0.00 0.41 -0.00 0.00 0.00 178.83 179.65 3jwo n GLY 200 N 0.10 -0.13 3.33 0.06 0.00 -1.26 -4.77 105.19 102.51 3jwo n GLY 200 Ca 0.02 -0.32 -0.33 0.00 0.00 0.00 0.00 46.02 45.39 3jwo n GLY 200 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3jwo s LEU 201 N -1.55 2.67 0.17 0.99 1.43 -0.52 -4.41 118.68 117.45 3jwo s LEU 201 Ca 0.30 -0.38 -0.16 0.00 -1.03 0.00 0.00 54.13 52.86 3jwo s LEU 201 Cb 0.16 -1.62 0.12 0.00 0.03 0.00 0.00 46.19 44.88 3jwo s LEU 201 CO 0.24 0.11 1.69 0.77 0.23 0.00 0.00 176.35 179.40 3jwo h SER 202 N 7.12 -0.18 -4.62 2.29 4.64 -1.86 -3.44 113.55 117.51 3jwo h SER 202 Ca -0.31 0.10 -0.22 0.00 -0.47 0.00 0.00 61.79 60.89 3jwo h SER 202 Cb 1.20 0.17 -0.15 0.00 -0.31 0.00 0.00 62.40 63.31 3jwo h SER 202 CO 0.57 -0.05 -0.70 -0.94 -0.87 0.00 0.00 176.83 174.84 3jwo s SER 203 N -5.25 1.12 0.16 4.97 1.04 -1.26 -5.12 113.70 109.35 3jwo s SER 203 Ca -0.13 -0.98 -0.34 0.00 0.48 0.00 0.00 55.95 54.97 3jwo s SER 203 Cb 0.14 0.09 -0.14 0.00 0.10 0.00 0.00 66.02 66.21 3jwo s SER 203 CO 0.71 -0.45 1.50 -0.81 0.98 0.00 0.00 173.24 175.17 3jwo n PRO 204 N 0.04 1.94 -3.74 4.02 -0.04 -1.26 -4.94 135.00 131.00 3jwo n PRO 204 Ca -0.13 0.70 -0.37 0.00 -0.04 0.00 0.00 63.50 63.66 3jwo n PRO 204 Cb 0.60 -2.42 -0.12 0.00 -0.04 0.00 0.00 33.50 31.52 3jwo n PRO 204 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3jwo s VAL 205 N 0.67 4.29 -0.13 0.52 1.01 -1.00 -4.92 120.40 120.84 3jwo s VAL 205 Ca 0.78 -0.27 -0.06 0.00 0.00 0.00 0.00 61.98 62.44 3jwo s VAL 205 Cb -0.73 -3.05 -0.04 0.00 0.00 0.00 0.00 36.38 32.56 3jwo s VAL 205 CO 0.41 0.28 0.08 -0.89 0.00 0.00 0.00 175.10 174.98 3jwo s THR 206 N 1.60 5.00 -0.16 3.92 2.01 -1.26 -1.31 115.64 125.43 3jwo s THR 206 Ca 0.06 0.02 0.00 0.00 0.31 0.00 0.00 61.69 62.08 3jwo s THR 206 Cb -0.16 -3.19 0.03 0.00 0.01 0.00 0.00 72.50 69.20 3jwo s THR 206 CO 0.04 0.56 -0.10 -0.75 -0.69 0.00 0.00 174.62 173.67 3jwo s LYS 207 N -0.51 1.95 0.38 4.92 2.47 -1.20 -4.99 119.74 122.77 3jwo s LYS 207 Ca 0.11 -0.60 0.04 0.00 -1.56 0.00 0.00 55.97 53.95 3jwo s LYS 207 Cb -0.12 -2.12 -0.04 0.00 -1.46 0.00 0.00 37.83 34.10 3jwo s LYS 207 CO 0.02 -0.34 0.10 -1.54 0.16 0.00 0.00 175.35 173.75 3jwo s SER 208 N 1.52 2.64 0.25 1.43 1.04 -1.26 -2.44 113.70 116.87 3jwo s SER 208 Ca 0.02 -1.57 -0.17 0.00 0.48 0.00 0.00 55.95 54.71 3jwo s SER 208 Cb -0.14 0.32 0.01 0.00 0.10 0.00 0.00 66.02 66.31 3jwo s SER 208 CO -0.09 -0.83 0.59 0.72 0.98 0.00 0.00 173.24 174.61 3jwo s PHE 209 N -3.25 0.04 0.00 5.02 -0.12 -0.98 -5.01 117.98 113.68 3jwo s PHE 209 Ca 0.27 -0.44 0.00 0.00 -0.05 0.00 0.00 56.93 56.72 3jwo s PHE 209 Cb 0.05 0.44 0.00 0.00 -0.63 0.00 0.00 43.02 42.88 3jwo s PHE 209 CO 0.14 -1.08 0.15 0.09 -0.05 0.00 0.00 175.22 174.47