#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vxs s VAL 2 N 0.00 3.82 -0.03 3.84 1.01 -1.26 -4.09 120.40 123.69 2vxs s VAL 2 Ca 0.00 1.18 0.04 0.00 0.00 0.00 0.00 61.98 63.20 2vxs s VAL 2 Cb 0.00 -3.76 -0.01 0.00 0.00 0.00 0.00 36.38 32.62 2vxs s VAL 2 CO 0.00 -0.01 -0.16 -1.10 0.00 0.00 0.00 175.10 173.83 2vxs s GLN 3 N 2.53 1.50 -0.17 2.72 -1.52 -0.68 -5.01 119.66 119.03 2vxs s GLN 3 Ca 0.62 -0.55 -0.03 0.00 -1.95 0.00 0.00 55.36 53.46 2vxs s GLN 3 Cb -0.30 -1.36 0.05 0.00 -0.22 0.00 0.00 33.01 31.19 2vxs s GLN 3 CO 0.25 0.26 0.04 -0.51 -0.25 0.00 0.00 175.29 175.07 2vxs s LEU 4 N -0.07 0.99 -0.35 2.90 1.43 -1.26 -1.29 118.68 121.03 2vxs s LEU 4 Ca -0.00 -0.67 -0.07 0.00 -1.03 0.00 0.00 54.13 52.35 2vxs s LEU 4 Cb -0.09 -0.53 0.04 0.00 0.03 0.00 0.00 46.19 45.63 2vxs s LEU 4 CO 0.01 -0.29 0.12 -0.22 0.23 0.00 0.00 176.35 176.20 2vxs s LEU 5 N 1.91 4.40 0.29 1.79 0.20 0.01 -3.79 118.68 123.48 2vxs s LEU 5 Ca 0.00 -1.12 -0.14 0.00 0.69 0.00 0.00 54.13 53.56 2vxs s LEU 5 Cb -0.16 -1.89 -0.08 0.00 -0.43 0.00 0.00 46.19 43.62 2vxs s LEU 5 CO -0.08 -0.34 0.69 -1.61 -0.29 0.00 0.00 176.35 174.73 2vxs s GLU 6 N 1.43 3.99 0.25 1.98 8.01 -1.26 -0.67 118.70 132.42 2vxs s GLU 6 Ca -0.01 0.61 -0.21 0.00 0.01 0.00 0.00 54.97 55.36 2vxs s GLU 6 Cb -0.19 -2.54 0.03 0.00 -4.31 0.00 0.00 34.13 27.12 2vxs s GLU 6 CO 0.03 0.22 0.68 -1.54 0.01 0.00 0.00 175.26 174.66 2vxs s SER 7 N -2.21 -0.33 0.00 -0.19 1.04 -0.72 -4.84 113.70 106.44 2vxs s SER 7 Ca 0.51 -0.46 0.00 0.00 0.48 0.00 0.00 55.95 56.48 2vxs s SER 7 Cb -0.11 0.69 0.00 0.00 0.10 0.00 0.00 66.02 66.70 2vxs s SER 7 CO 0.19 -1.24 0.00 0.61 0.98 0.00 0.00 173.24 173.78 2vxs n GLY 8 N -0.43 1.44 3.82 7.32 0.00 -1.26 -1.49 105.19 114.58 2vxs n GLY 8 Ca -0.07 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.62 2vxs n GLY 8 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2vxs s GLY 9 N -2.07 2.28 0.00 -0.02 0.00 -1.26 -4.64 107.32 101.61 2vxs s GLY 9 Ca 0.00 0.38 0.00 0.00 0.00 0.00 0.00 44.72 45.10 2vxs s GLY 9 CO 0.00 0.68 0.00 0.61 0.00 0.00 0.00 173.10 174.39 2vxs n GLY 10 N -0.88 -0.78 3.70 0.20 0.00 -0.41 -4.77 105.19 102.24 2vxs n GLY 10 Ca 0.08 -0.85 -0.42 0.00 0.00 0.00 0.00 46.02 44.83 2vxs n GLY 10 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2vxs s LEU 11 N 0.00 4.33 0.07 0.99 2.96 -1.26 -2.10 118.68 123.67 2vxs s LEU 11 Ca 0.00 1.71 0.05 0.00 -0.22 0.00 0.00 54.13 55.67 2vxs s LEU 11 Cb 0.00 -3.57 -0.03 0.00 0.50 0.00 0.00 46.19 43.09 2vxs s LEU 11 CO 0.00 -0.38 -0.14 0.68 -1.32 0.00 0.00 176.35 175.19 2vxs s VAL 12 N 1.40 1.07 0.60 1.68 -7.23 -0.79 -5.00 120.40 112.13 2vxs s VAL 12 Ca 0.53 -1.28 -0.17 0.00 -1.81 0.00 0.00 61.98 59.24 2vxs s VAL 12 Cb -0.22 -1.03 -0.03 0.00 0.56 0.00 0.00 36.38 35.65 2vxs s VAL 12 CO 0.25 -0.23 1.12 -1.10 -0.31 0.00 0.00 175.10 174.83 2vxs s GLN 13 N -1.72 3.08 0.61 4.82 -0.21 -1.25 -1.67 119.66 123.32 2vxs s GLN 13 Ca -0.03 1.52 -0.19 0.00 0.02 0.00 0.00 55.36 56.68 2vxs s GLN 13 Cb -0.10 -1.98 -0.03 0.00 1.00 0.00 0.00 33.01 31.91 2vxs s GLN 13 CO 0.02 -1.05 1.28 -2.14 -2.12 0.00 0.00 175.29 171.28 2vxs s PRO 14 N -3.66 2.79 0.00 2.91 0.02 -1.26 -1.63 135.00 134.17 2vxs s PRO 14 Ca 0.70 2.02 0.00 0.00 0.02 0.00 0.00 61.00 63.74 2vxs s PRO 14 Cb -0.23 -1.95 0.00 0.00 0.02 0.00 0.00 34.50 32.35 2vxs s PRO 14 CO 0.34 -1.40 0.00 0.41 -0.33 0.00 0.00 177.00 176.02 2vxs n GLY 15 N 0.75 2.30 0.00 0.52 0.00 0.17 -4.91 105.19 104.02 2vxs n GLY 15 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 2vxs n GLY 15 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vxs n GLY 16 N -2.00 -1.02 3.13 -0.02 0.00 -0.65 -4.08 105.19 100.56 2vxs n GLY 16 Ca 0.00 -1.67 -0.11 0.00 0.00 0.00 0.00 46.02 44.25 2vxs n GLY 16 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2vxs s SER 17 N -1.00 0.04 -0.13 1.61 0.15 -1.26 -1.89 113.70 111.23 2vxs s SER 17 Ca 0.00 -0.27 -0.29 0.00 0.70 0.00 0.00 55.95 56.09 2vxs s SER 17 Cb 0.00 0.23 0.07 0.00 -1.71 0.00 0.00 66.02 64.61 2vxs s SER 17 CO 0.00 -0.43 0.70 -0.22 1.20 0.00 0.00 173.24 174.49 2vxs s LEU 18 N -1.63 -0.69 -0.13 3.45 2.96 -0.46 -5.02 118.68 117.16 2vxs s LEU 18 Ca -0.12 0.97 -0.00 0.00 -0.22 0.00 0.00 54.13 54.76 2vxs s LEU 18 Cb -0.05 2.50 0.02 0.00 0.50 0.00 0.00 46.19 49.16 2vxs s LEU 18 CO -0.00 -0.48 -0.11 -0.60 -1.32 0.00 0.00 176.35 173.84 2vxs s ARG 19 N -0.64 1.90 -0.02 1.98 3.52 -1.26 -1.05 118.95 123.37 2vxs s ARG 19 Ca -0.07 -0.41 -0.08 0.00 -0.13 0.00 0.00 55.73 55.04 2vxs s ARG 19 Cb -0.02 -1.85 -0.05 0.00 -1.56 0.00 0.00 34.95 31.47 2vxs s ARG 19 CO 0.07 -0.26 0.26 -0.51 -0.81 0.00 0.00 175.30 174.05 2vxs s LEU 20 N 1.60 4.39 0.16 -0.88 1.43 0.12 -4.58 118.68 120.91 2vxs s LEU 20 Ca 0.05 0.61 0.08 0.00 -1.03 0.00 0.00 54.13 53.83 2vxs s LEU 20 Cb -0.13 -2.53 -0.04 0.00 0.03 0.00 0.00 46.19 43.52 2vxs s LEU 20 CO -0.09 0.30 -0.17 -0.94 0.23 0.00 0.00 176.35 175.67 2vxs s SER 21 N -1.46 2.51 -0.09 2.29 1.04 -0.56 -1.02 113.70 116.41 2vxs s SER 21 Ca 0.24 -0.87 -0.02 0.00 0.48 0.00 0.00 55.95 55.78 2vxs s SER 21 Cb -0.13 -0.13 0.04 0.00 0.10 0.00 0.00 66.02 65.89 2vxs s SER 21 CO 0.13 -0.07 0.04 0.00 0.98 0.00 0.00 173.24 174.32 2vxs s ALA 23 N 2.06 3.48 -0.09 0.00 0.00 0.16 -1.20 121.76 126.16 2vxs s ALA 23 Ca 0.04 -0.20 0.01 0.00 0.00 0.00 0.00 51.96 51.81 2vxs s ALA 23 Cb -0.13 -2.71 -0.03 0.00 0.00 0.00 0.00 23.12 20.25 2vxs s ALA 23 CO -0.05 -0.10 -0.09 0.00 0.00 0.00 0.00 175.76 175.52 2vxs s ALA 24 N 0.86 2.87 0.15 0.00 0.00 -0.61 -0.81 121.76 124.23 2vxs s ALA 24 Ca 0.27 -0.90 -0.02 0.00 0.00 0.00 0.00 51.96 51.31 2vxs s ALA 24 Cb -0.15 -1.22 -0.04 0.00 0.00 0.00 0.00 23.12 21.71 2vxs s ALA 24 CO 0.11 0.48 0.10 -1.54 0.00 0.00 0.00 175.76 174.90 2vxs s SER 25 N -0.47 0.25 -0.00 0.00 1.04 -0.41 -4.84 113.70 109.26 2vxs s SER 25 Ca 0.07 -1.22 0.00 0.00 0.48 0.00 0.00 55.95 55.28 2vxs s SER 25 Cb -0.12 0.33 0.00 0.00 0.10 0.00 0.00 66.02 66.33 2vxs s SER 25 CO 0.02 -0.77 0.00 0.61 0.98 0.00 0.00 173.24 174.08 2vxs n GLY 26 N -0.14 0.50 3.69 7.32 0.00 -1.26 -1.69 105.19 113.60 2vxs n GLY 26 Ca -0.04 -0.03 -0.08 0.00 0.00 0.00 0.00 46.02 45.87 2vxs n GLY 26 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2vxs s PHE 27 N -2.00 0.00 -1.02 1.61 -0.71 -1.26 -4.43 117.98 110.18 2vxs s PHE 27 Ca 0.00 -0.40 -0.21 0.00 -1.04 0.00 0.00 56.93 55.28 2vxs s PHE 27 Cb 0.00 0.46 0.08 0.00 -1.21 0.00 0.00 43.02 42.35 2vxs s PHE 27 CO 0.00 -1.08 1.38 0.99 -1.34 0.00 0.00 175.22 175.17 2vxs s THR 28 N -3.94 4.19 0.14 -4.49 2.01 -1.26 -4.86 115.64 107.42 2vxs s THR 28 Ca 0.14 -1.12 -0.20 0.00 0.31 0.00 0.00 61.69 60.83 2vxs s THR 28 Cb -0.03 -4.99 -0.00 0.00 0.01 0.00 0.00 72.50 67.49 2vxs s THR 28 CO 0.05 -1.82 1.70 0.15 -0.69 0.00 0.00 174.62 174.01 2vxs h PHE 29 N 9.30 -0.14 0.00 4.92 3.04 -1.96 -2.06 116.94 130.05 2vxs h PHE 29 Ca 0.21 0.02 0.00 0.00 3.98 0.00 0.00 57.97 62.18 2vxs h PHE 29 Cb 1.00 0.10 0.00 0.00 2.56 0.00 0.00 35.95 39.61 2vxs h PHE 29 CO 1.25 -0.11 0.00 -1.13 -2.02 0.00 0.00 178.31 176.30 2vxs n SER 30 N -5.22 0.00 -1.08 0.41 3.41 -1.26 -2.12 113.62 107.76 2vxs n SER 30 Ca -0.02 -0.89 0.10 0.00 -0.26 0.00 0.00 58.87 57.81 2vxs n SER 30 Cb 0.15 0.00 0.23 0.00 -0.26 0.00 0.00 64.21 64.32 2vxs n SER 30 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2vxs n SER 31 N -0.84 3.43 -4.14 4.04 7.64 -0.77 -4.38 113.62 118.60 2vxs n SER 31 Ca 0.11 -1.96 -0.29 0.00 1.01 0.00 0.00 58.87 57.74 2vxs n SER 31 Cb 0.05 -0.31 -0.17 0.00 -1.01 0.00 0.00 64.21 62.77 2vxs n SER 31 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 2vxs s TYR 32 N -1.19 2.15 0.63 1.43 1.51 -0.90 -4.90 117.35 116.09 2vxs s TYR 32 Ca 0.37 -0.89 -0.18 0.00 -1.01 0.00 0.00 57.07 55.36 2vxs s TYR 32 Cb 0.21 -1.48 -0.02 0.00 -0.11 0.00 0.00 41.96 40.56 2vxs s TYR 32 CO 0.28 -0.39 1.27 0.00 -1.11 0.00 0.00 175.55 175.60 2vxs s ALA 33 N 0.54 2.42 0.09 3.71 0.00 -1.24 -3.85 121.76 123.43 2vxs s ALA 33 Ca -0.16 1.16 0.01 0.00 0.00 0.00 0.00 51.96 52.97 2vxs s ALA 33 Cb -0.17 -3.53 -0.04 0.00 0.00 0.00 0.00 23.12 19.38 2vxs s ALA 33 CO 0.06 -1.49 -0.06 -1.64 0.00 0.00 0.00 175.76 172.63 2vxs s MET 34 N -3.38 0.79 0.21 0.00 1.00 0.02 -1.16 119.30 116.78 2vxs s MET 34 Ca 0.81 -1.31 -0.13 0.00 0.00 0.00 0.00 55.69 55.06 2vxs s MET 34 Cb -0.35 -0.12 0.00 0.00 0.00 0.00 0.00 34.83 34.35 2vxs s MET 34 CO 0.38 -0.04 0.43 -1.54 0.00 0.00 0.00 175.02 174.26 2vxs s SER 35 N -3.02 -0.09 -0.06 3.03 1.04 -0.40 -0.71 113.70 113.49 2vxs s SER 35 Ca 0.11 -0.81 0.04 0.00 0.48 0.00 0.00 55.95 55.77 2vxs s SER 35 Cb 0.06 0.54 0.00 0.00 0.10 0.00 0.00 66.02 66.72 2vxs s SER 35 CO -0.06 -1.05 -0.18 0.26 0.98 0.00 0.00 173.24 173.20 2vxs s TRP 36 N -3.97 1.82 0.00 5.02 0.52 -0.27 -1.29 118.94 120.77 2vxs s TRP 36 Ca 0.18 -0.59 0.01 0.00 0.02 0.00 0.00 56.10 55.72 2vxs s TRP 36 Cb 0.00 -1.24 -0.01 0.00 -1.15 0.00 0.00 33.47 31.08 2vxs s TRP 36 CO 0.04 -0.23 -0.04 0.08 0.02 0.00 0.00 176.95 176.82 2vxs s VAL 37 N 0.20 0.33 0.36 4.03 1.01 -0.37 -0.96 120.40 125.01 2vxs s VAL 37 Ca -0.08 -0.33 0.04 0.00 0.00 0.00 0.00 61.98 61.61 2vxs s VAL 37 Cb -0.13 -0.31 -0.06 0.00 0.00 0.00 0.00 36.38 35.88 2vxs s VAL 37 CO 0.04 -0.01 0.06 0.00 0.00 0.00 0.00 175.10 175.19 2vxs s ARG 38 N -0.37 1.75 -0.28 2.72 1.70 0.73 0.10 118.95 125.30 2vxs s ARG 38 Ca -0.01 -2.00 -0.00 0.00 -0.47 0.00 0.00 55.73 53.25 2vxs s ARG 38 Cb -0.03 -0.92 0.17 0.00 -0.57 0.00 0.00 34.95 33.60 2vxs s ARG 38 CO -0.00 -0.24 0.51 -1.14 -1.08 0.00 0.00 175.30 173.36 2vxs s GLN 39 N -3.85 0.49 0.42 3.89 0.74 -0.27 -0.38 119.66 120.70 2vxs s GLN 39 Ca 0.33 0.73 -0.24 0.00 0.05 0.00 0.00 55.36 56.22 2vxs s GLN 39 Cb 0.07 0.12 -0.08 0.00 1.10 0.00 0.00 33.01 34.23 2vxs s GLN 39 CO 0.15 -0.72 1.14 0.00 -0.55 0.00 0.00 175.29 175.31 2vxs s ALA 40 N 2.73 3.08 -0.17 1.58 0.00 -1.26 -1.26 121.76 126.46 2vxs s ALA 40 Ca 0.16 0.90 -0.35 0.00 0.00 0.00 0.00 51.96 52.67 2vxs s ALA 40 Cb -0.14 -3.36 -0.12 0.00 0.00 0.00 0.00 23.12 19.50 2vxs s ALA 40 CO -0.21 -0.51 1.93 -0.35 0.00 0.00 0.00 175.76 176.62 2vxs n PRO 41 N -0.15 1.82 -0.80 0.00 -0.04 -1.26 -1.13 135.00 133.44 2vxs n PRO 41 Ca 0.05 0.64 0.00 0.00 -0.04 0.00 0.00 63.50 64.16 2vxs n PRO 41 Cb 0.48 -2.56 0.00 0.00 -0.04 0.00 0.00 33.50 31.37 2vxs n PRO 41 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2vxs n GLY 42 N 4.79 0.92 2.31 0.55 0.00 -1.26 -5.03 105.19 107.47 2vxs n GLY 42 Ca 0.27 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.13 2vxs n GLY 42 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2vxs n LYS 43 N -2.00 0.97 -2.04 1.61 4.01 -0.29 -5.14 118.16 115.28 2vxs n LYS 43 Ca 0.00 -2.06 -0.28 0.00 -0.51 0.00 0.00 58.31 55.47 2vxs n LYS 43 Cb 0.00 0.18 0.08 0.00 -0.51 0.00 0.00 35.03 34.79 2vxs n LYS 43 CO 0.00 0.00 0.00 0.20 -1.11 0.00 0.00 177.40 176.49 2vxs s GLY 44 N -3.21 1.64 0.40 0.72 0.00 -1.26 -4.71 107.32 100.91 2vxs s GLY 44 Ca 0.21 -0.81 -0.25 0.00 0.00 0.00 0.00 44.72 43.87 2vxs s GLY 44 CO 0.13 -0.34 1.16 1.08 0.00 0.00 0.00 173.10 175.13 2vxs s LEU 45 N -5.44 4.20 -0.06 0.66 1.43 -1.26 -4.34 118.68 113.86 2vxs s LEU 45 Ca 0.62 2.33 -0.02 0.00 -1.03 0.00 0.00 54.13 56.03 2vxs s LEU 45 Cb -0.10 -4.02 0.03 0.00 0.03 0.00 0.00 46.19 42.12 2vxs s LEU 45 CO 0.47 -0.66 0.02 -0.70 0.23 0.00 0.00 176.35 175.72 2vxs s GLU 46 N -2.29 0.34 0.27 1.70 2.12 0.49 -4.98 118.70 116.35 2vxs s GLU 46 Ca 0.57 0.21 -0.30 0.00 0.36 0.00 0.00 54.97 55.81 2vxs s GLU 46 Cb -0.30 -0.79 -0.10 0.00 0.26 0.00 0.00 34.13 33.19 2vxs s GLU 46 CO 0.38 -0.31 1.41 -0.46 -0.54 0.00 0.00 175.26 175.74 2vxs s TRP 47 N 2.05 3.01 -0.14 5.30 -0.00 -1.26 -0.19 118.94 127.71 2vxs s TRP 47 Ca 0.05 1.11 -0.08 0.00 -0.00 0.00 0.00 56.10 57.18 2vxs s TRP 47 Cb -0.12 -3.80 -0.06 0.00 -0.00 0.00 0.00 33.47 29.49 2vxs s TRP 47 CO -0.04 -2.50 -0.20 0.28 -0.00 0.00 0.00 176.95 174.48 2vxs n VAL 48 N 1.95 0.96 -3.59 5.86 0.31 -0.13 -4.63 118.33 119.06 2vxs n VAL 48 Ca 0.05 -0.12 -0.07 0.00 -0.01 0.00 0.00 64.34 64.19 2vxs n VAL 48 Cb 0.41 -1.77 -0.02 0.00 -0.91 0.00 0.00 33.84 31.55 2vxs n VAL 48 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 2vxs s SER 49 N -6.31 -0.33 0.12 4.52 0.15 -0.95 -0.87 113.70 110.03 2vxs s SER 49 Ca -0.21 -0.17 -0.20 0.00 0.70 0.00 0.00 55.95 56.08 2vxs s SER 49 Cb 0.07 0.47 0.05 0.00 -1.71 0.00 0.00 66.02 64.91 2vxs s SER 49 CO 0.27 -0.81 0.49 0.00 1.20 0.00 0.00 173.24 174.38 2vxs s ALA 50 N -3.33 -1.24 -0.07 5.45 0.00 -0.82 -1.11 121.76 120.64 2vxs s ALA 50 Ca 0.07 0.28 -0.10 0.00 0.00 0.00 0.00 51.96 52.21 2vxs s ALA 50 Cb -0.01 0.68 0.02 0.00 0.00 0.00 0.00 23.12 23.81 2vxs s ALA 50 CO -0.05 -0.65 0.25 -1.50 0.00 0.00 0.00 175.76 173.81 2vxs s ILE 51 N -3.47 0.02 0.76 0.00 2.07 0.11 -1.55 121.20 119.15 2vxs s ILE 51 Ca 0.00 -0.18 -0.11 0.00 -1.41 0.00 0.00 60.65 58.96 2vxs s ILE 51 Cb 0.00 -0.42 0.05 0.00 0.13 0.00 0.00 42.46 42.22 2vxs s ILE 51 CO -0.10 -0.10 1.08 -0.94 -1.91 0.00 0.00 174.94 172.97 2vxs s SER 52 N -0.33 4.66 0.27 4.50 1.04 -0.77 -0.80 113.70 122.27 2vxs s SER 52 Ca -0.04 1.70 -0.00 0.00 0.48 0.00 0.00 55.95 58.08 2vxs s SER 52 Cb -0.03 -2.45 0.56 0.00 0.10 0.00 0.00 66.02 64.20 2vxs s SER 52 CO 0.01 -1.92 1.76 1.23 0.98 0.00 0.00 173.24 175.30 2vxs h GLY 52 N -1.05 1.43 2.00 7.32 0.00 -1.84 0.45 103.07 111.38 2vxs h GLY 52 Ca -0.44 -0.26 0.00 0.00 0.00 0.00 0.00 47.33 46.62 2vxs h GLY 52 CO 0.54 -0.05 0.00 -1.14 0.00 0.00 0.00 176.54 175.89 2vxs n SER 53 N -4.86 0.70 0.00 0.19 3.41 -1.26 -4.78 113.62 107.02 2vxs n SER 53 Ca 0.18 0.61 0.00 0.00 -0.26 0.00 0.00 58.87 59.40 2vxs n SER 53 Cb 0.45 -0.78 0.00 0.00 -0.26 0.00 0.00 64.21 63.62 2vxs n SER 53 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2vxs n GLY 54 N 0.68 1.12 0.00 5.00 0.00 0.15 -4.91 105.19 107.22 2vxs n GLY 54 Ca 0.04 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.20 2vxs n GLY 54 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vxs n GLY 55 N -2.00 -1.34 2.71 -0.02 0.00 -1.26 -4.68 105.19 98.60 2vxs n GLY 55 Ca 0.00 -0.12 -0.21 0.00 0.00 0.00 0.00 46.02 45.70 2vxs n GLY 55 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2vxs s SER 56 N -2.77 1.42 0.00 1.61 0.15 -1.26 -5.05 113.70 107.80 2vxs s SER 56 Ca 0.21 -0.09 0.06 0.00 0.70 0.00 0.00 55.95 56.82 2vxs s SER 56 Cb 0.19 0.01 -0.02 0.00 -1.71 0.00 0.00 66.02 64.49 2vxs s SER 56 CO 0.47 -0.29 -0.18 0.42 1.20 0.00 0.00 173.24 174.86 2vxs s THR 57 N 2.22 1.45 0.03 6.45 -4.23 -1.26 -1.84 115.64 118.45 2vxs s THR 57 Ca 0.04 -0.89 0.05 0.00 -1.18 0.00 0.00 61.69 59.71 2vxs s THR 57 Cb -0.14 -1.23 -0.02 0.00 1.34 0.00 0.00 72.50 72.45 2vxs s THR 57 CO -0.07 0.32 -0.15 -0.31 -0.54 0.00 0.00 174.62 173.87 2vxs s TYR 58 N -0.55 1.36 -0.09 3.99 1.51 -0.59 -5.01 117.35 117.98 2vxs s TYR 58 Ca 0.07 -0.34 -0.08 0.00 -1.01 0.00 0.00 57.07 55.71 2vxs s TYR 58 Cb -0.07 -0.82 0.02 0.00 -0.11 0.00 0.00 41.96 40.98 2vxs s TYR 58 CO 0.00 0.04 0.22 0.71 -1.11 0.00 0.00 175.55 175.41 2vxs s TYR 59 N -0.74 -0.25 0.55 2.71 2.02 -1.26 -1.94 117.35 118.44 2vxs s TYR 59 Ca 0.04 0.61 -0.20 0.00 -0.37 0.00 0.00 57.07 57.15 2vxs s TYR 59 Cb -0.08 0.08 -0.05 0.00 -0.40 0.00 0.00 41.96 41.51 2vxs s TYR 59 CO 0.01 -0.13 1.20 0.00 -1.57 0.00 0.00 175.55 175.06 2vxs s ALA 60 N 0.21 2.68 0.49 3.71 0.00 -0.05 -4.77 121.76 124.03 2vxs s ALA 60 Ca -0.01 0.99 0.21 0.00 0.00 0.00 0.00 51.96 53.15 2vxs s ALA 60 Cb -0.02 -3.43 1.24 0.00 0.00 0.00 0.00 23.12 20.91 2vxs s ALA 60 CO -0.00 -1.01 1.98 -0.44 0.00 0.00 0.00 175.76 176.29 2vxs h ASP 61 N 1.22 0.16 0.05 0.00 3.32 -1.93 -1.56 116.42 117.68 2vxs h ASP 61 Ca -0.50 0.01 0.00 0.00 0.02 0.00 0.00 57.03 56.56 2vxs h ASP 61 Cb 1.28 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.81 2vxs h ASP 61 CO 0.57 0.09 0.00 -1.54 -1.72 0.00 0.00 179.24 176.64 2vxs n SER 62 N -4.43 0.00 0.00 6.45 3.41 -1.26 -3.28 113.62 114.51 2vxs n SER 62 Ca 0.10 -0.89 0.00 0.00 -0.26 0.00 0.00 58.87 57.83 2vxs n SER 62 Cb 0.53 -0.03 0.00 0.00 -0.26 0.00 0.00 64.21 64.45 2vxs n SER 62 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 2vxs n VAL 63 N -1.03 0.00 -1.64 -3.33 0.24 -0.68 -5.01 118.33 106.88 2vxs n VAL 63 Ca 0.22 -0.18 -0.52 0.00 -2.04 0.00 0.00 64.34 61.82 2vxs n VAL 63 Cb 0.12 1.22 -0.06 0.00 -1.47 0.00 0.00 33.84 33.65 2vxs n VAL 63 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86 2vxs n LYS 64 N -0.23 1.39 0.00 7.34 3.00 -0.68 -0.99 118.16 127.99 2vxs n LYS 64 Ca 0.00 0.50 0.00 0.00 -0.00 0.00 0.00 58.31 58.81 2vxs n LYS 64 Cb 0.05 -2.19 0.00 0.00 0.00 0.00 0.00 35.03 32.89 2vxs n LYS 64 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2vxs n GLY 65 N 3.28 2.43 0.06 3.14 0.00 -1.26 -4.78 105.19 108.05 2vxs n GLY 65 Ca 0.21 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.16 2vxs n GLY 65 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2vxs n ARG 66 N -2.00 1.73 -4.19 1.61 1.74 -0.16 -5.03 116.66 110.37 2vxs n ARG 66 Ca 0.00 0.02 -0.31 0.00 -0.77 0.00 0.00 57.85 56.79 2vxs n ARG 66 Cb 0.00 -1.28 -0.08 0.00 -1.02 0.00 0.00 32.46 30.07 2vxs n ARG 66 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 2vxs s PHE 67 N -2.27 2.99 -0.10 -1.55 0.40 -0.80 -0.94 117.98 115.71 2vxs s PHE 67 Ca -0.09 -0.01 -0.02 0.00 -0.60 0.00 0.00 56.93 56.21 2vxs s PHE 67 Cb 0.04 -1.57 0.04 0.00 0.51 0.00 0.00 43.02 42.04 2vxs s PHE 67 CO 0.42 0.47 0.03 0.99 0.70 0.00 0.00 175.22 177.83 2vxs s THR 68 N -1.24 0.23 0.27 0.64 2.01 0.90 -4.88 115.64 113.57 2vxs s THR 68 Ca 0.24 0.02 -0.17 0.00 0.31 0.00 0.00 61.69 62.08 2vxs s THR 68 Cb -0.12 -0.55 -0.09 0.00 0.01 0.00 0.00 72.50 71.76 2vxs s THR 68 CO 0.16 0.07 0.72 -0.51 -0.69 0.00 0.00 174.62 174.37 2vxs s ILE 69 N 2.02 4.64 0.11 1.82 2.07 -1.26 -0.79 121.20 129.81 2vxs s ILE 69 Ca 0.03 1.08 -0.26 0.00 -1.41 0.00 0.00 60.65 60.09 2vxs s ILE 69 Cb -0.14 -3.72 0.08 0.00 0.13 0.00 0.00 42.46 38.81 2vxs s ILE 69 CO -0.06 0.00 1.00 -0.94 -1.91 0.00 0.00 174.94 173.03 2vxs s SER 70 N -1.99 -0.18 -0.00 4.50 1.04 -1.15 -4.99 113.70 110.93 2vxs s SER 70 Ca 0.49 -0.32 -0.04 0.00 0.48 0.00 0.00 55.95 56.56 2vxs s SER 70 Cb -0.13 0.43 -0.00 0.00 0.10 0.00 0.00 66.02 66.42 2vxs s SER 70 CO 0.19 -0.79 0.07 0.00 0.98 0.00 0.00 173.24 173.69 2vxs s ARG 71 N -3.15 0.30 -0.41 4.02 1.70 -1.26 -0.36 118.95 119.79 2vxs s ARG 71 Ca 0.12 -0.29 -0.03 0.00 -0.47 0.00 0.00 55.73 55.05 2vxs s ARG 71 Cb -0.01 0.12 0.11 0.00 -0.57 0.00 0.00 34.95 34.61 2vxs s ARG 71 CO 0.00 -0.06 0.21 0.34 -1.08 0.00 0.00 175.30 174.71 2vxs s ASP 72 N -0.93 5.27 0.33 -2.89 -1.08 -0.12 -4.97 116.67 112.28 2vxs s ASP 72 Ca -0.10 -2.02 0.05 0.00 -0.52 0.00 0.00 52.55 49.95 2vxs s ASP 72 Cb -0.06 -1.83 0.58 0.00 -1.46 0.00 0.00 42.92 40.14 2vxs s ASP 72 CO 0.00 -0.55 1.84 0.78 0.52 0.00 0.00 175.17 177.76 2vxs h ASN 73 N 8.06 0.44 0.16 -0.34 2.35 -1.94 -1.11 115.58 123.20 2vxs h ASN 73 Ca -0.13 -0.10 -0.00 0.00 -0.55 0.00 0.00 56.30 55.51 2vxs h ASN 73 Cb 1.05 -0.12 -0.00 0.00 0.05 0.00 0.00 38.32 39.30 2vxs h ASN 73 CO 0.70 0.58 -0.02 0.77 -1.65 0.00 0.00 177.43 177.81 2vxs h SER 74 N 0.43 0.00 -0.29 5.81 4.64 -1.96 -2.71 113.55 119.48 2vxs h SER 74 Ca 0.09 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 2vxs h SER 74 Cb 0.43 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.52 2vxs h SER 74 CO 0.02 0.02 0.00 0.29 -0.87 0.00 0.00 176.83 176.30 2vxs n LYS 75 N -3.43 2.21 -4.01 4.77 5.02 -0.46 -4.98 118.16 117.28 2vxs n LYS 75 Ca -0.02 -1.88 -0.27 0.00 -2.02 0.00 0.00 58.31 54.11 2vxs n LYS 75 Cb 0.13 -1.30 -0.03 0.00 -0.02 0.00 0.00 35.03 33.81 2vxs n LYS 75 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2vxs n ASN 76 N 0.72 -0.80 -3.95 4.39 4.13 -0.95 -4.84 115.26 113.96 2vxs n ASN 76 Ca 0.12 -1.02 -0.20 0.00 1.68 0.00 0.00 54.58 55.16 2vxs n ASN 76 Cb 0.42 -2.95 -0.16 0.00 -1.54 0.00 0.00 39.78 35.55 2vxs n ASN 76 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 2vxs s THR 77 N -3.87 0.64 -0.09 3.41 2.01 -1.01 -1.57 115.64 115.17 2vxs s THR 77 Ca 0.13 -0.25 -0.01 0.00 0.31 0.00 0.00 61.69 61.87 2vxs s THR 77 Cb -0.07 -0.61 -0.03 0.00 0.01 0.00 0.00 72.50 71.80 2vxs s THR 77 CO 0.90 0.22 -0.03 -0.22 -0.69 0.00 0.00 174.62 174.80 2vxs s LEU 78 N 0.48 3.37 0.19 4.42 2.96 -0.34 -0.94 118.68 128.81 2vxs s LEU 78 Ca -0.07 0.03 0.11 0.00 -0.22 0.00 0.00 54.13 53.98 2vxs s LEU 78 Cb -0.11 -1.76 -0.04 0.00 0.50 0.00 0.00 46.19 44.77 2vxs s LEU 78 CO 0.00 0.33 -0.19 -0.31 -1.32 0.00 0.00 176.35 174.86 2vxs s TYR 79 N -0.61 2.41 -0.08 5.38 1.51 0.51 0.02 117.35 126.50 2vxs s TYR 79 Ca 0.10 -0.31 -0.01 0.00 -1.01 0.00 0.00 57.07 55.83 2vxs s TYR 79 Cb -0.12 -1.19 0.03 0.00 -0.11 0.00 0.00 41.96 40.57 2vxs s TYR 79 CO 0.02 0.50 -0.02 -1.17 -1.11 0.00 0.00 175.55 173.77 2vxs s LEU 80 N -2.70 0.77 -0.27 -1.29 2.96 -0.19 -2.92 118.68 115.04 2vxs s LEU 80 Ca 0.22 -0.15 -0.09 0.00 -0.22 0.00 0.00 54.13 53.89 2vxs s LEU 80 Cb -0.08 -0.55 -0.04 0.00 0.50 0.00 0.00 46.19 46.02 2vxs s LEU 80 CO 0.11 -0.17 0.14 -1.58 -1.32 0.00 0.00 176.35 173.53 2vxs s GLN 81 N 1.88 3.75 -0.29 1.98 2.00 0.03 -0.71 119.66 128.30 2vxs s GLN 81 Ca 0.05 -0.43 -0.02 0.00 -2.00 0.00 0.00 55.36 52.96 2vxs s GLN 81 Cb -0.12 -3.51 0.05 0.00 0.80 0.00 0.00 33.01 30.22 2vxs s GLN 81 CO -0.06 -0.21 -0.01 -1.64 -0.50 0.00 0.00 175.29 172.86 2vxs s MET 82 N 1.68 2.50 0.40 1.67 -1.94 -0.22 -0.07 119.30 123.32 2vxs s MET 82 Ca 0.06 -1.22 0.08 0.00 -1.71 0.00 0.00 55.69 52.90 2vxs s MET 82 Cb -0.16 -3.14 -0.04 0.00 2.01 0.00 0.00 34.83 33.50 2vxs s MET 82 CO 0.07 -0.58 0.25 -0.80 -0.01 0.00 0.00 175.02 173.95 2vxs s ASN 82 N 1.26 4.75 -1.29 3.03 0.02 -0.12 -1.36 114.94 121.23 2vxs s ASN 82 Ca -0.04 -0.87 -0.22 0.00 -1.02 0.00 0.00 52.86 50.71 2vxs s ASN 82 Cb -0.19 -0.59 0.02 0.00 0.02 0.00 0.00 41.25 40.51 2vxs s ASN 82 CO -0.02 -0.52 0.53 -1.20 0.02 0.00 0.00 177.10 175.91 2vxs n SER 82 N -1.34 -2.85 -4.75 -1.22 7.64 -0.99 -4.71 113.62 105.40 2vxs n SER 82 Ca 0.00 -1.23 -0.41 0.00 1.01 0.00 0.00 58.87 58.25 2vxs n SER 82 Cb 0.63 -2.05 -0.04 0.00 -1.01 0.00 0.00 64.21 61.74 2vxs n SER 82 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2vxs s LEU 82 N -7.25 4.51 0.35 -3.43 1.43 -0.79 -4.69 118.68 108.80 2vxs s LEU 82 Ca 0.34 2.32 0.09 0.00 -1.03 0.00 0.00 54.13 55.86 2vxs s LEU 82 Cb -0.17 -3.62 -0.06 0.00 0.03 0.00 0.00 46.19 42.36 2vxs s LEU 82 CO 0.95 -0.26 -0.04 0.00 0.23 0.00 0.00 176.35 177.23 2vxs s ARG 83 N -1.18 1.94 0.21 1.70 1.70 -1.26 0.43 118.95 122.50 2vxs s ARG 83 Ca 0.47 -1.87 -0.12 0.00 -0.47 0.00 0.00 55.73 53.75 2vxs s ARG 83 Cb -0.33 -1.80 0.28 0.00 -0.57 0.00 0.00 34.95 32.53 2vxs s ARG 83 CO 0.42 0.12 1.64 0.00 -1.08 0.00 0.00 175.30 176.40 2vxs h ALA 84 N 1.91 0.54 0.00 7.88 0.00 -1.97 -0.04 119.26 127.58 2vxs h ALA 84 Ca -0.42 0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.70 2vxs h ALA 84 Cb 1.25 0.40 0.00 0.00 0.00 0.00 0.00 17.79 19.44 2vxs h ALA 84 CO 0.70 -0.41 0.00 -0.85 0.00 0.00 0.00 179.25 178.68 2vxs n GLU 85 N -5.35 0.01 0.00 0.00 0.00 -1.26 -0.79 120.64 113.24 2vxs n GLU 85 Ca 0.09 0.25 0.13 0.00 0.00 0.00 0.00 57.16 57.63 2vxs n GLU 85 Cb 0.36 -1.50 0.40 0.00 0.00 0.00 0.00 31.44 30.70 2vxs n GLU 85 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 2vxs n ASP 86 N -1.26 1.31 -4.69 -1.84 8.00 -0.03 -4.91 116.55 113.13 2vxs n ASP 86 Ca 0.00 -1.17 -0.42 0.00 0.71 0.00 0.00 54.79 53.91 2vxs n ASP 86 Cb 0.00 0.10 -0.03 0.00 -0.02 0.00 0.00 41.12 41.17 2vxs n ASP 86 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2vxs s THR 87 N -2.30 2.84 0.00 -3.53 2.01 0.03 -4.86 115.64 109.82 2vxs s THR 87 Ca 0.29 0.32 0.00 0.00 0.31 0.00 0.00 61.69 62.61 2vxs s THR 87 Cb 0.20 -3.21 0.00 0.00 0.01 0.00 0.00 72.50 69.50 2vxs s THR 87 CO 0.45 -0.00 0.00 0.00 -0.69 0.00 0.00 174.62 174.38 2vxs n ALA 88 N 5.60 0.00 -2.59 7.40 0.00 -0.35 -4.45 120.51 126.12 2vxs n ALA 88 Ca 0.16 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.20 2vxs n ALA 88 Cb 0.40 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.80 2vxs n ALA 88 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2vxs s VAL 89 N -2.00 4.87 -0.19 0.00 1.01 -0.39 -0.71 120.40 122.99 2vxs s VAL 89 Ca 0.00 1.72 -0.07 0.00 0.00 0.00 0.00 61.98 63.63 2vxs s VAL 89 Cb 0.00 -4.16 -0.04 0.00 0.00 0.00 0.00 36.38 32.18 2vxs s VAL 89 CO 0.00 0.26 0.06 -0.31 0.00 0.00 0.00 175.10 175.11 2vxs s TYR 90 N 0.55 3.23 -0.08 5.22 1.51 -0.07 -1.12 117.35 126.60 2vxs s TYR 90 Ca 0.43 0.03 0.00 0.00 -1.01 0.00 0.00 57.07 56.52 2vxs s TYR 90 Cb -0.20 -2.09 -0.03 0.00 -0.11 0.00 0.00 41.96 39.54 2vxs s TYR 90 CO 0.23 0.11 -0.06 0.71 -1.11 0.00 0.00 175.55 175.44 2vxs s TYR 91 N 0.46 2.98 -0.14 2.71 2.02 0.11 -1.96 117.35 123.53 2vxs s TYR 91 Ca 0.03 0.03 -0.07 0.00 -0.37 0.00 0.00 57.07 56.69 2vxs s TYR 91 Cb -0.13 -1.74 -0.04 0.00 -0.40 0.00 0.00 41.96 39.66 2vxs s TYR 91 CO 0.01 0.33 0.12 0.00 -1.57 0.00 0.00 175.55 174.44 2vxs s ALA 93 N -0.65 -0.24 -0.19 0.00 0.00 -0.41 0.07 121.76 120.35 2vxs s ALA 93 Ca 0.13 0.11 -0.10 0.00 0.00 0.00 0.00 51.96 52.10 2vxs s ALA 93 Cb -0.12 -0.08 -0.05 0.00 0.00 0.00 0.00 23.12 22.87 2vxs s ALA 93 CO 0.02 -0.10 0.15 0.50 0.00 0.00 0.00 175.76 176.34 2vxs s ARG 94 N -0.41 4.12 -0.11 0.00 3.52 -0.93 -1.27 118.95 123.87 2vxs s ARG 94 Ca -0.05 -0.17 -0.02 0.00 -0.13 0.00 0.00 55.73 55.37 2vxs s ARG 94 Cb -0.03 -3.40 -0.03 0.00 -1.56 0.00 0.00 34.95 29.93 2vxs s ARG 94 CO 0.00 0.35 -0.04 -0.51 -0.81 0.00 0.00 175.30 174.29 2vxs s ASP 95 N 0.22 4.81 0.22 -2.12 1.01 -0.31 -0.61 116.67 119.89 2vxs s ASP 95 Ca 0.10 -0.04 -0.00 0.00 0.71 0.00 0.00 52.55 53.31 2vxs s ASP 95 Cb -0.11 -1.51 0.22 0.00 1.01 0.00 0.00 42.92 42.53 2vxs s ASP 95 CO -0.01 0.28 1.58 -0.07 0.21 0.00 0.00 175.17 177.16 2vxs h LEU 96 N 5.90 0.53 -7.82 1.23 3.38 -0.93 -3.29 115.31 114.31 2vxs h LEU 96 Ca -0.41 -0.25 -0.07 0.00 0.09 0.00 0.00 57.88 57.24 2vxs h LEU 96 Cb 1.18 -0.15 -0.12 0.00 0.09 0.00 0.00 40.66 41.66 2vxs h LEU 96 CO 0.57 0.91 -0.19 0.27 0.09 0.00 0.00 178.44 180.10 2vxs s ILE 97 N -4.13 0.07 -0.29 1.22 -4.36 -1.25 -4.88 121.20 107.58 2vxs s ILE 97 Ca -0.07 -1.06 -0.42 0.00 -0.26 0.00 0.00 60.65 58.84 2vxs s ILE 97 Cb 0.12 -1.59 -0.18 0.00 1.25 0.00 0.00 42.46 42.06 2vxs s ILE 97 CO 0.82 -0.30 1.57 1.57 0.24 0.00 0.00 174.94 178.84 2vxs n HIS 98 N -0.23 1.72 -0.68 1.37 -0.00 -1.26 -0.67 115.22 115.47 2vxs n HIS 98 Ca -0.11 0.83 0.00 0.00 -0.00 0.00 0.00 57.72 58.45 2vxs n HIS 98 Cb 0.63 -2.32 0.00 0.00 -0.00 0.00 0.00 29.99 28.30 2vxs n HIS 98 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2vxs n GLY 99 N 3.63 0.90 3.03 1.57 0.00 -1.26 -5.00 105.19 108.05 2vxs n GLY 99 Ca 0.27 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.96 2vxs n GLY 99 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2vxs s VAL 100 N -3.39 2.96 -0.00 1.61 1.01 0.16 -5.07 120.40 117.68 2vxs s VAL 100 Ca 0.00 -2.88 -0.13 0.00 0.00 0.00 0.00 61.98 58.96 2vxs s VAL 100 Cb 0.00 -3.03 -0.06 0.00 0.00 0.00 0.00 36.38 33.30 2vxs s VAL 100 CO 0.00 -0.77 0.38 0.42 0.00 0.00 0.00 175.10 175.12 2vxs s THR 100 N 0.17 5.09 -0.01 3.92 -4.23 -1.26 -0.27 115.64 119.04 2vxs s THR 100 Ca 0.15 0.73 0.00 0.00 -1.18 0.00 0.00 61.69 61.39 2vxs s THR 100 Cb -0.23 -3.67 -0.01 0.00 1.34 0.00 0.00 72.50 69.94 2vxs s THR 100 CO -0.03 0.55 0.00 -1.14 -0.54 0.00 0.00 174.62 173.47 2vxs n ARG 101 N 1.74 3.54 -4.04 3.99 3.00 0.22 -4.92 116.66 120.18 2vxs n ARG 101 Ca -0.14 0.00 -0.11 0.00 -0.00 0.00 0.00 57.85 57.60 2vxs n ARG 101 Cb 0.53 -1.01 -0.11 0.00 0.00 0.00 0.00 32.46 31.86 2vxs n ARG 101 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.63 176.83 2vxs s ASN 102 N -3.16 0.66 0.09 6.15 0.01 -1.23 -5.02 114.94 112.44 2vxs s ASN 102 Ca -0.00 -0.59 0.10 0.00 -0.71 0.00 0.00 52.86 51.65 2vxs s ASN 102 Cb 0.00 0.07 -0.03 0.00 0.41 0.00 0.00 41.25 41.70 2vxs s ASN 102 CO 0.02 -0.28 -0.25 0.26 -1.51 0.00 0.00 177.10 175.34 2vxs s TRP 103 N -1.70 2.19 1.03 2.20 0.52 -1.26 -2.18 118.94 119.73 2vxs s TRP 103 Ca -0.09 -0.40 -0.17 0.00 0.02 0.00 0.00 56.10 55.46 2vxs s TRP 103 Cb -0.08 -1.24 0.25 0.00 -1.15 0.00 0.00 33.47 31.25 2vxs s TRP 103 CO -0.01 0.22 1.02 0.41 0.02 0.00 0.00 176.95 178.61 2vxs n GLY 104 N 1.33 -2.41 1.01 0.98 0.00 0.11 -4.74 105.19 101.47 2vxs n GLY 104 Ca -0.18 -1.54 0.11 0.00 0.00 0.00 0.00 46.02 44.41 2vxs n GLY 104 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vxs n GLN 105 N -4.20 2.30 0.00 1.61 0.00 -1.25 -4.83 117.38 111.01 2vxs n GLN 105 Ca 0.14 -2.06 0.00 0.00 0.00 0.00 0.00 57.00 55.08 2vxs n GLN 105 Cb 0.52 -1.46 0.00 0.00 0.00 0.00 0.00 30.24 29.29 2vxs n GLN 105 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2vxs n GLY 106 N 1.35 -0.02 3.28 2.61 0.00 -1.26 -5.04 105.19 106.11 2vxs n GLY 106 Ca 0.16 -1.75 -0.10 0.00 0.00 0.00 0.00 46.02 44.33 2vxs n GLY 106 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2vxs s THR 107 N -2.42 -0.14 -0.15 2.61 -1.32 -0.83 -4.70 115.64 108.69 2vxs s THR 107 Ca 0.00 0.11 -0.27 0.00 -1.21 0.00 0.00 61.69 60.32 2vxs s THR 107 Cb 0.00 -0.63 -0.01 0.00 -1.51 0.00 0.00 72.50 70.35 2vxs s THR 107 CO 0.00 0.04 0.91 -0.22 -2.21 0.00 0.00 174.62 173.14 2vxs s LEU 108 N 1.64 4.20 -0.24 9.08 2.96 -1.26 -0.89 118.68 134.17 2vxs s LEU 108 Ca -0.08 1.31 -0.03 0.00 -0.22 0.00 0.00 54.13 55.11 2vxs s LEU 108 Cb -0.09 -3.37 0.01 0.00 0.50 0.00 0.00 46.19 43.24 2vxs s LEU 108 CO -0.13 -0.43 -0.04 -0.69 -1.32 0.00 0.00 176.35 173.73 2vxs s VAL 109 N 2.17 3.21 -0.28 1.68 1.01 0.12 -1.29 120.40 127.02 2vxs s VAL 109 Ca 0.42 -0.70 -0.02 0.00 0.00 0.00 0.00 61.98 61.68 2vxs s VAL 109 Cb -0.17 -2.53 0.04 0.00 0.00 0.00 0.00 36.38 33.72 2vxs s VAL 109 CO 0.14 0.32 -0.02 -0.89 0.00 0.00 0.00 175.10 174.65 2vxs s THR 110 N 1.42 3.01 -0.44 3.92 2.01 -0.89 -1.21 115.64 123.46 2vxs s THR 110 Ca 0.04 -1.18 -0.16 0.00 0.31 0.00 0.00 61.69 60.70 2vxs s THR 110 Cb -0.15 -2.63 0.04 0.00 0.01 0.00 0.00 72.50 69.77 2vxs s THR 110 CO -0.04 0.04 0.38 -0.69 -0.69 0.00 0.00 174.62 173.63 2vxs s VAL 111 N 1.30 5.19 0.07 3.82 1.01 -1.26 -1.88 120.40 128.65 2vxs s VAL 111 Ca -0.02 -0.76 -0.22 0.00 0.00 0.00 0.00 61.98 60.97 2vxs s VAL 111 Cb -0.18 -4.05 0.05 0.00 0.00 0.00 0.00 36.38 32.20 2vxs s VAL 111 CO -0.02 -0.47 0.53 -0.55 0.00 0.00 0.00 175.10 174.59 2vxs s SER 112 N 2.15 -0.45 0.13 3.32 0.15 -0.67 -4.59 113.70 113.73 2vxs s SER 112 Ca 0.06 0.12 0.25 0.00 0.70 0.00 0.00 55.95 57.09 2vxs s SER 112 Cb -0.21 0.51 0.48 0.00 -1.71 0.00 0.00 66.02 65.10 2vxs s SER 112 CO 0.09 -0.77 1.44 -1.20 1.20 0.00 0.00 173.24 174.01 2vxs n SER 113 N 0.23 0.70 -4.75 5.45 7.64 -1.26 -3.88 113.62 117.74 2vxs n SER 113 Ca -0.18 0.21 -0.33 0.00 1.01 0.00 0.00 58.87 59.59 2vxs n SER 113 Cb 0.61 -0.07 0.08 0.00 -1.01 0.00 0.00 64.21 63.83 2vxs n SER 113 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2vxs s ALA 114 N -3.14 2.21 0.40 -0.43 0.00 -1.26 -5.03 121.76 114.52 2vxs s ALA 114 Ca 0.08 0.56 -0.11 0.00 0.00 0.00 0.00 51.96 52.49 2vxs s ALA 114 Cb 0.13 -3.36 -0.06 0.00 0.00 0.00 0.00 23.12 19.83 2vxs s ALA 114 CO 0.69 -1.72 0.77 -1.12 0.00 0.00 0.00 175.76 174.38 2vxs s SER 115 N -2.66 6.53 0.25 0.00 0.01 -1.26 -5.02 113.70 111.55 2vxs s SER 115 Ca 0.67 1.13 -0.30 0.00 1.31 0.00 0.00 55.95 58.76 2vxs s SER 115 Cb -0.22 -2.32 -0.11 0.00 0.21 0.00 0.00 66.02 63.58 2vxs s SER 115 CO 0.48 -0.39 1.55 -0.89 0.41 0.00 0.00 173.24 174.39 2vxs s THR 116 N -2.36 2.34 -0.06 1.44 2.01 -1.26 -4.80 115.64 112.95 2vxs s THR 116 Ca 0.51 0.28 0.01 0.00 0.31 0.00 0.00 61.69 62.80 2vxs s THR 116 Cb -0.10 -3.18 0.02 0.00 0.01 0.00 0.00 72.50 69.25 2vxs s THR 116 CO 0.31 0.04 -0.07 -0.75 -0.69 0.00 0.00 174.62 173.46 2vxs s LYS 117 N -0.11 1.16 0.55 4.92 2.20 0.04 -4.97 119.74 123.53 2vxs s LYS 117 Ca 0.64 -0.20 -0.20 0.00 -0.36 0.00 0.00 55.97 55.85 2vxs s LYS 117 Cb -0.45 -1.11 -0.05 0.00 -1.51 0.00 0.00 37.83 34.70 2vxs s LYS 117 CO 0.43 -0.09 1.18 0.20 -0.36 0.00 0.00 175.35 176.71 2vxs s GLY 118 N 1.02 2.71 0.57 5.54 0.00 -1.26 -1.85 107.32 114.05 2vxs s GLY 118 Ca -0.09 0.94 -0.16 0.00 0.00 0.00 0.00 44.72 45.41 2vxs s GLY 118 CO -0.00 1.33 1.03 2.56 0.00 0.00 0.00 173.10 178.02 2vxs s PRO 119 N -3.18 3.55 -0.00 2.90 0.04 -1.26 -4.57 135.00 132.47 2vxs s PRO 119 Ca 0.73 1.09 -0.02 0.00 0.04 0.00 0.00 61.00 62.84 2vxs s PRO 119 Cb -0.28 -2.07 -0.04 0.00 0.04 0.00 0.00 34.50 32.15 2vxs s PRO 119 CO 0.31 -0.62 0.15 -1.54 0.04 0.00 0.00 177.00 175.35 2vxs s SER 120 N -2.98 6.16 -0.15 6.66 1.04 -0.89 -4.94 113.70 118.59 2vxs s SER 120 Ca 0.61 0.28 0.02 0.00 0.48 0.00 0.00 55.95 57.34 2vxs s SER 120 Cb -0.13 -1.89 0.01 0.00 0.10 0.00 0.00 66.02 64.11 2vxs s SER 120 CO 0.36 0.26 -0.20 -0.69 0.98 0.00 0.00 173.24 173.95 2vxs s VAL 121 N -1.30 2.20 -0.07 5.02 1.01 -1.26 -1.57 120.40 124.43 2vxs s VAL 121 Ca 0.26 -0.92 0.05 0.00 0.00 0.00 0.00 61.98 61.37 2vxs s VAL 121 Cb -0.12 -1.90 -0.00 0.00 0.00 0.00 0.00 36.38 34.35 2vxs s VAL 121 CO 0.18 0.54 -0.22 -0.36 0.00 0.00 0.00 175.10 175.23 2vxs s PHE 122 N 0.93 2.27 0.42 5.22 0.08 0.30 -4.96 117.98 122.24 2vxs s PHE 122 Ca -0.04 -0.78 -0.24 0.00 0.12 0.00 0.00 56.93 55.99 2vxs s PHE 122 Cb -0.15 -1.51 -0.08 0.00 -0.57 0.00 0.00 43.02 40.70 2vxs s PHE 122 CO -0.04 -0.28 1.11 -1.25 -0.10 0.00 0.00 175.22 174.66 2vxs s PRO 123 N 0.11 4.01 -0.52 0.24 0.04 -1.26 0.15 135.00 137.77 2vxs s PRO 123 Ca -0.10 1.65 -0.04 0.00 0.04 0.00 0.00 61.00 62.56 2vxs s PRO 123 Cb -0.15 -2.52 0.14 0.00 0.04 0.00 0.00 34.50 32.00 2vxs s PRO 123 CO 0.05 -0.30 0.33 -0.51 0.04 0.00 0.00 177.00 176.61 2vxs s LEU 124 N -2.74 5.32 0.33 -3.56 1.43 0.24 -4.81 118.68 114.90 2vxs s LEU 124 Ca 0.59 -2.39 -0.29 0.00 -1.03 0.00 0.00 54.13 51.01 2vxs s LEU 124 Cb -0.26 -1.87 -0.11 0.00 0.03 0.00 0.00 46.19 43.99 2vxs s LEU 124 CO 0.32 -0.48 1.53 0.00 0.23 0.00 0.00 176.35 177.94 2vxs s ALA 125 N 0.62 3.66 0.34 4.21 0.00 -1.26 -1.71 121.76 127.62 2vxs s ALA 125 Ca 0.12 1.54 -0.29 0.00 0.00 0.00 0.00 51.96 53.34 2vxs s ALA 125 Cb -0.22 -3.62 -0.11 0.00 0.00 0.00 0.00 23.12 19.17 2vxs s ALA 125 CO -0.04 -0.98 1.54 -0.35 0.00 0.00 0.00 175.76 175.93 2vxs n PRO 126 N 1.43 2.69 -2.11 0.00 -0.04 -1.26 -4.88 135.00 130.84 2vxs n PRO 126 Ca 0.05 0.95 -0.40 0.00 -0.04 0.00 0.00 63.50 64.06 2vxs n PRO 126 Cb 0.38 -2.71 -0.01 0.00 -0.04 0.00 0.00 33.50 31.13 2vxs n PRO 126 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2vxs s SER 127 N 0.15 6.54 0.15 3.54 0.15 -1.26 -4.54 113.70 118.43 2vxs s SER 127 Ca 0.58 2.63 0.16 0.00 0.70 0.00 0.00 55.95 60.02 2vxs s SER 127 Cb -0.48 -2.64 0.72 0.00 -1.71 0.00 0.00 66.02 61.91 2vxs s SER 127 CO 0.57 -0.69 1.48 -0.24 1.20 0.00 0.00 173.24 175.56 2vxs n SER 128 N 0.42 0.33 -4.69 5.45 2.88 -1.26 -4.67 113.62 112.08 2vxs n SER 128 Ca 0.02 0.61 -0.37 0.00 -1.33 0.00 0.00 58.87 57.80 2vxs n SER 128 Cb 0.43 -0.67 -0.07 0.00 -0.75 0.00 0.00 64.21 63.15 2vxs n SER 128 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 2vxs s LYS 129 N -3.23 4.21 -0.08 -1.46 3.01 -1.26 -5.07 119.74 115.86 2vxs s LYS 129 Ca 0.02 0.13 -0.14 0.00 -1.01 0.00 0.00 55.97 54.98 2vxs s LYS 129 Cb 0.06 -3.49 -0.05 0.00 -1.01 0.00 0.00 37.83 33.35 2vxs s LYS 129 CO 0.22 0.09 0.34 0.45 0.51 0.00 0.00 175.35 176.97 2vxs s SER 130 N 0.80 6.62 0.88 2.83 0.15 -1.26 -4.93 113.70 118.79 2vxs s SER 130 Ca 0.17 0.74 -0.11 0.00 0.70 0.00 0.00 55.95 57.45 2vxs s SER 130 Cb -0.14 -2.21 0.12 0.00 -1.71 0.00 0.00 66.02 62.08 2vxs s SER 130 CO 0.06 0.23 1.09 0.42 1.20 0.00 0.00 173.24 176.25 2vxs s THR 131 N -0.41 2.73 -0.44 6.45 -4.23 -1.25 -4.89 115.64 113.60 2vxs s THR 131 Ca 0.21 0.24 0.16 0.00 -1.18 0.00 0.00 61.69 61.12 2vxs s THR 131 Cb -0.15 -2.75 0.16 0.00 1.34 0.00 0.00 72.50 71.11 2vxs s THR 131 CO 0.09 -0.31 1.50 -1.54 -0.54 0.00 0.00 174.62 173.82 2vxs n SER 132 N -3.82 0.42 -0.80 3.99 3.41 -1.26 -1.19 113.62 114.37 2vxs n SER 132 Ca 0.07 0.68 0.12 0.00 -0.26 0.00 0.00 58.87 59.48 2vxs n SER 132 Cb 0.55 -0.74 0.07 0.00 -0.26 0.00 0.00 64.21 63.83 2vxs n SER 132 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2vxs n GLY 133 N -1.18 0.67 2.16 5.00 0.00 -1.26 -5.00 105.19 105.59 2vxs n GLY 133 Ca -0.01 -0.67 -0.08 0.00 0.00 0.00 0.00 46.02 45.26 2vxs n GLY 133 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vxs n GLY 134 N 1.37 0.05 3.46 -0.02 0.00 -0.33 -5.02 105.19 104.70 2vxs n GLY 134 Ca 0.12 -0.54 -0.29 0.00 0.00 0.00 0.00 46.02 45.31 2vxs n GLY 134 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2vxs s THR 135 N -2.43 2.70 -0.02 2.61 -4.23 -1.26 -1.22 115.64 111.78 2vxs s THR 135 Ca 0.01 -1.58 0.07 0.00 -1.18 0.00 0.00 61.69 59.01 2vxs s THR 135 Cb -0.00 -2.23 -0.02 0.00 1.34 0.00 0.00 72.50 71.59 2vxs s THR 135 CO 0.01 0.09 -0.24 0.00 -0.54 0.00 0.00 174.62 173.93 2vxs s ALA 136 N -1.15 2.03 -0.04 3.99 0.00 0.02 -3.83 121.76 122.77 2vxs s ALA 136 Ca 0.17 -1.05 -0.17 0.00 0.00 0.00 0.00 51.96 50.91 2vxs s ALA 136 Cb -0.10 -0.52 -0.05 0.00 0.00 0.00 0.00 23.12 22.44 2vxs s ALA 136 CO 0.09 0.49 0.47 0.00 0.00 0.00 0.00 175.76 176.82 2vxs s ALA 137 N -0.56 3.57 0.06 0.00 0.00 -1.26 -0.86 121.76 122.70 2vxs s ALA 137 Ca 0.09 -0.15 -0.06 0.00 0.00 0.00 0.00 51.96 51.83 2vxs s ALA 137 Cb -0.10 -2.56 -0.01 0.00 0.00 0.00 0.00 23.12 20.45 2vxs s ALA 137 CO -0.01 0.23 0.12 -0.48 0.00 0.00 0.00 175.76 175.62 2vxs s LEU 138 N -0.26 1.74 0.00 0.00 0.05 -0.48 -3.99 118.68 115.73 2vxs s LEU 138 Ca 0.26 -0.63 -0.00 0.00 0.05 0.00 0.00 54.13 53.81 2vxs s LEU 138 Cb -0.16 0.72 0.00 0.00 -2.05 0.00 0.00 46.19 44.70 2vxs s LEU 138 CO 0.13 -0.60 0.02 0.61 -0.55 0.00 0.00 176.35 175.96 2vxs n GLY 139 N 0.38 1.92 2.94 -3.48 0.00 -0.70 -0.19 105.19 106.07 2vxs n GLY 139 Ca -0.17 -1.01 -0.21 0.00 0.00 0.00 0.00 46.02 44.63 2vxs n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vxs s LEU 141 N 0.72 4.14 -0.55 0.00 2.96 0.12 -1.35 118.68 124.72 2vxs s LEU 141 Ca -0.11 0.40 -0.03 0.00 -0.22 0.00 0.00 54.13 54.17 2vxs s LEU 141 Cb -0.14 -2.40 0.14 0.00 0.50 0.00 0.00 46.19 44.29 2vxs s LEU 141 CO 0.01 -0.05 0.36 -0.69 -1.32 0.00 0.00 176.35 174.66 2vxs s VAL 142 N 1.30 3.54 -0.12 1.68 1.01 -0.06 -0.54 120.40 127.21 2vxs s VAL 142 Ca 0.16 -2.69 -0.07 0.00 0.00 0.00 0.00 61.98 59.38 2vxs s VAL 142 Cb -0.14 -3.35 -0.04 0.00 0.00 0.00 0.00 36.38 32.85 2vxs s VAL 142 CO 0.07 -0.82 0.12 -0.75 0.00 0.00 0.00 175.10 173.73 2vxs s LYS 143 N 0.30 3.41 -0.92 2.72 2.20 -0.61 -1.41 119.74 125.43 2vxs s LYS 143 Ca 0.14 -0.16 -0.06 0.00 -0.36 0.00 0.00 55.97 55.53 2vxs s LYS 143 Cb -0.21 -3.15 -0.02 0.00 -1.51 0.00 0.00 37.83 32.93 2vxs s LYS 143 CO -0.03 0.76 0.77 -0.25 -0.36 0.00 0.00 175.35 176.24 2vxs n ASP 144 N 2.05 -6.63 -4.54 1.43 8.00 0.08 -2.10 116.55 114.84 2vxs n ASP 144 Ca -0.20 -0.56 -0.25 0.00 0.71 0.00 0.00 54.79 54.49 2vxs n ASP 144 Cb 0.55 -4.48 -0.11 0.00 -0.02 0.00 0.00 41.12 37.06 2vxs n ASP 144 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 2vxs s TYR 145 N -3.21 2.33 -0.28 1.24 -0.85 -0.31 -4.38 117.35 111.89 2vxs s TYR 145 Ca 0.24 -0.59 -0.23 0.00 -0.52 0.00 0.00 57.07 55.96 2vxs s TYR 145 Cb -0.05 -1.42 0.12 0.00 0.38 0.00 0.00 41.96 40.99 2vxs s TYR 145 CO 0.79 0.48 1.01 0.12 -1.52 0.00 0.00 175.55 176.42 2vxs s PHE 146 N -2.73 -0.51 0.00 -3.49 5.36 -0.77 -0.49 117.98 115.35 2vxs s PHE 146 Ca 0.33 1.20 0.00 0.00 -0.96 0.00 0.00 56.93 57.50 2vxs s PHE 146 Cb 0.05 0.37 0.00 0.00 -0.34 0.00 0.00 43.02 43.09 2vxs s PHE 146 CO 0.16 -0.25 0.00 -0.35 -1.46 0.00 0.00 175.22 173.32 2vxs n PRO 147 N 2.52 1.06 -2.08 10.12 -0.04 -1.26 -0.78 135.00 144.53 2vxs n PRO 147 Ca -0.14 0.00 -0.33 0.00 -0.04 0.00 0.00 63.50 62.99 2vxs n PRO 147 Cb 0.56 0.00 0.01 0.00 -0.04 0.00 0.00 33.50 34.03 2vxs n PRO 147 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 2vxs s GLN 148 N -0.78 3.29 0.14 0.54 -1.52 -1.26 -4.69 119.66 115.39 2vxs s GLN 148 Ca 0.00 1.30 0.05 0.00 -1.95 0.00 0.00 55.36 54.77 2vxs s GLN 148 Cb 0.00 -2.02 -0.04 0.00 -0.22 0.00 0.00 33.01 30.73 2vxs s GLN 148 CO 0.00 -0.85 0.06 -1.25 -0.25 0.00 0.00 175.29 173.00 2vxs s PRO 149 N -3.88 2.67 0.24 2.91 0.04 -1.26 -4.91 135.00 130.81 2vxs s PRO 149 Ca 0.66 -0.92 0.01 0.00 0.04 0.00 0.00 61.00 60.79 2vxs s PRO 149 Cb -0.18 -2.54 -0.04 0.00 0.04 0.00 0.00 34.50 31.78 2vxs s PRO 149 CO 0.34 0.50 0.41 0.14 0.04 0.00 0.00 177.00 178.43 2vxs s VAL 150 N -1.61 5.20 -0.01 -0.36 -7.23 -1.26 -4.19 120.40 110.95 2vxs s VAL 150 Ca 0.29 -0.52 0.03 0.00 -1.81 0.00 0.00 61.98 59.96 2vxs s VAL 150 Cb -0.10 -3.79 -0.00 0.00 0.56 0.00 0.00 36.38 33.05 2vxs s VAL 150 CO 0.21 -0.28 -0.08 0.28 -0.31 0.00 0.00 175.10 174.91 2vxs s THR 151 N -1.98 0.68 0.01 5.32 -1.32 0.48 -4.97 115.64 113.86 2vxs s THR 151 Ca 0.38 -0.35 0.03 0.00 -1.21 0.00 0.00 61.69 60.53 2vxs s THR 151 Cb -0.10 -0.59 -0.01 0.00 -1.51 0.00 0.00 72.50 70.29 2vxs s THR 151 CO 0.30 0.20 -0.10 -0.69 -2.21 0.00 0.00 174.62 172.12 2vxs s VAL 152 N -0.10 0.80 0.21 5.08 1.01 -1.26 -0.31 120.40 125.84 2vxs s VAL 152 Ca 0.02 -0.59 -0.08 0.00 0.00 0.00 0.00 61.98 61.34 2vxs s VAL 152 Cb -0.05 -0.70 -0.02 0.00 0.00 0.00 0.00 36.38 35.61 2vxs s VAL 152 CO -0.00 0.12 0.31 -0.94 0.00 0.00 0.00 175.10 174.59 2vxs s SER 153 N -0.53 0.03 -0.04 3.32 1.04 -0.44 -4.99 113.70 112.08 2vxs s SER 153 Ca 0.02 -1.09 0.06 0.00 0.48 0.00 0.00 55.95 55.42 2vxs s SER 153 Cb -0.05 0.48 -0.01 0.00 0.10 0.00 0.00 66.02 66.54 2vxs s SER 153 CO 0.00 -0.98 -0.22 0.26 0.98 0.00 0.00 173.24 173.27 2vxs s TRP 154 N -4.06 2.14 -1.40 5.02 0.52 -1.26 -0.54 118.94 119.36 2vxs s TRP 154 Ca 0.28 -0.56 -0.08 0.00 0.02 0.00 0.00 56.10 55.75 2vxs s TRP 154 Cb 0.03 -1.40 0.01 0.00 -1.15 0.00 0.00 33.47 30.95 2vxs s TRP 154 CO 0.09 -0.14 0.35 0.09 0.02 0.00 0.00 176.95 177.35 2vxs n ASN 155 N 2.85 -1.06 -2.41 2.95 3.02 -0.19 -0.95 115.26 119.47 2vxs n ASN 155 Ca -0.17 -1.16 -0.13 0.00 -0.03 0.00 0.00 54.58 53.09 2vxs n ASN 155 Cb 0.52 -2.31 -0.01 0.00 -0.61 0.00 0.00 39.78 37.38 2vxs n ASN 155 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 2vxs n SER 156 N -2.77 -4.07 0.00 6.41 7.64 -1.26 -1.78 113.62 117.79 2vxs n SER 156 Ca -0.26 0.18 0.00 0.00 1.01 0.00 0.00 58.87 59.80 2vxs n SER 156 Cb 0.66 -3.46 0.00 0.00 -1.01 0.00 0.00 64.21 60.40 2vxs n SER 156 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2vxs n GLY 157 N -0.81 1.51 0.23 0.23 0.00 -0.13 -4.95 105.19 101.27 2vxs n GLY 157 Ca -0.16 0.00 0.03 0.00 0.00 0.00 0.00 46.02 45.90 2vxs n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vxs h ALA 158 N 0.00 1.56 -2.81 4.61 0.00 -1.29 -3.41 119.26 117.93 2vxs h ALA 158 Ca 0.00 -0.21 -0.71 0.00 0.00 0.00 0.00 54.91 53.99 2vxs h ALA 158 Cb 0.00 -0.06 -0.25 0.00 0.00 0.00 0.00 17.79 17.48 2vxs h ALA 158 CO 0.00 0.32 -0.51 -1.17 0.00 0.00 0.00 179.25 177.89 2vxs s LEU 159 N -8.66 4.77 0.00 0.00 0.20 -1.12 -4.89 118.68 108.99 2vxs s LEU 159 Ca -0.05 -1.06 0.00 0.00 0.69 0.00 0.00 54.13 53.72 2vxs s LEU 159 Cb 0.15 -2.02 0.00 0.00 -0.43 0.00 0.00 46.19 43.90 2vxs s LEU 159 CO 0.72 -0.40 0.00 0.35 -0.29 0.00 0.00 176.35 176.72 2vxs n THR 160 N 4.99 0.00 -2.26 3.68 -2.24 -1.26 -4.23 114.28 112.96 2vxs n THR 160 Ca -0.12 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.25 2vxs n THR 160 Cb 0.46 -0.31 -0.03 0.00 -2.10 0.00 0.00 70.33 68.34 2vxs n THR 160 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2vxs s SER 161 N -2.10 6.95 0.00 3.42 0.01 -1.26 -3.28 113.70 117.43 2vxs s SER 161 Ca 0.00 2.36 0.00 0.00 1.31 0.00 0.00 55.95 59.62 2vxs s SER 161 Cb 0.00 -2.61 0.00 0.00 0.21 0.00 0.00 66.02 63.62 2vxs s SER 161 CO 0.00 -0.48 0.00 0.61 0.41 0.00 0.00 173.24 173.78 2vxs n GLY 162 N 2.24 0.34 3.71 3.44 0.00 -1.26 -4.70 105.19 108.95 2vxs n GLY 162 Ca 0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.66 2vxs n GLY 162 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2vxs s VAL 163 N -1.78 4.96 -0.20 1.61 1.01 -1.21 -1.80 120.40 122.98 2vxs s VAL 163 Ca 0.00 1.69 -0.04 0.00 0.00 0.00 0.00 61.98 63.64 2vxs s VAL 163 Cb 0.00 -4.15 0.07 0.00 0.00 0.00 0.00 36.38 32.29 2vxs s VAL 163 CO 0.00 0.18 0.07 -2.28 0.00 0.00 0.00 175.10 173.07 2vxs s HIS 164 N 1.12 0.73 -0.25 5.22 2.46 0.11 -5.00 115.29 119.69 2vxs s HIS 164 Ca 0.43 -0.75 -0.15 0.00 0.47 0.00 0.00 55.06 55.06 2vxs s HIS 164 Cb -0.19 -0.95 -0.04 0.00 -0.13 0.00 0.00 32.58 31.27 2vxs s HIS 164 CO 0.20 -0.62 0.39 0.99 -2.47 0.00 0.00 174.74 173.23 2vxs s THR 165 N 1.96 5.17 0.07 0.89 2.01 -1.26 -1.61 115.64 122.86 2vxs s THR 165 Ca 0.02 0.63 -0.22 0.00 0.31 0.00 0.00 61.69 62.43 2vxs s THR 165 Cb -0.17 -3.71 -0.06 0.00 0.01 0.00 0.00 72.50 68.57 2vxs s THR 165 CO -0.13 0.18 0.64 -0.36 -0.69 0.00 0.00 174.62 174.26 2vxs s PHE 166 N 1.89 3.78 0.29 4.92 0.40 -0.22 -5.01 117.98 124.04 2vxs s PHE 166 Ca 0.16 1.35 -0.28 0.00 -0.60 0.00 0.00 56.93 57.57 2vxs s PHE 166 Cb -0.15 -2.63 -0.14 0.00 0.51 0.00 0.00 43.02 40.61 2vxs s PHE 166 CO 0.09 0.46 0.95 -2.30 0.70 0.00 0.00 175.22 175.13 2vxs n PRO 167 N 2.13 1.22 -1.99 0.24 -0.01 -1.26 -4.31 135.00 131.01 2vxs n PRO 167 Ca -0.07 0.43 -0.34 0.00 -0.01 0.00 0.00 63.50 63.50 2vxs n PRO 167 Cb 0.50 -1.77 0.03 0.00 -0.01 0.00 0.00 33.50 32.25 2vxs n PRO 167 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 175.50 175.49 2vxs s ALA 168 N -1.08 2.58 0.06 3.55 0.00 -1.26 -4.83 121.76 120.78 2vxs s ALA 168 Ca 0.59 0.68 -0.17 0.00 0.00 0.00 0.00 51.96 53.06 2vxs s ALA 168 Cb -0.71 -3.34 -0.06 0.00 0.00 0.00 0.00 23.12 19.01 2vxs s ALA 168 CO 0.59 -1.04 0.51 0.54 0.00 0.00 0.00 175.76 176.37 2vxs s VAL 169 N -2.07 4.86 -0.40 0.00 0.11 0.17 -4.91 120.40 118.16 2vxs s VAL 169 Ca 0.70 1.03 -0.12 0.00 -2.93 0.00 0.00 61.98 60.66 2vxs s VAL 169 Cb -0.22 -3.81 0.03 0.00 -1.53 0.00 0.00 36.38 30.85 2vxs s VAL 169 CO 0.35 0.53 0.25 -0.22 -3.33 0.00 0.00 175.10 172.67 2vxs s LEU 170 N -1.21 4.94 0.71 2.54 2.96 -1.26 -0.94 118.68 126.42 2vxs s LEU 170 Ca 0.28 -1.04 -0.11 0.00 -0.22 0.00 0.00 54.13 53.04 2vxs s LEU 170 Cb -0.18 -2.07 0.01 0.00 0.50 0.00 0.00 46.19 44.45 2vxs s LEU 170 CO 0.17 -0.44 1.07 -1.10 -1.32 0.00 0.00 176.35 174.73 2vxs s GLN 171 N 1.58 2.87 0.58 1.98 -0.21 -0.03 -4.90 119.66 121.52 2vxs s GLN 171 Ca 0.03 0.76 0.35 0.00 0.02 0.00 0.00 55.36 56.52 2vxs s GLN 171 Cb -0.20 -2.00 1.38 0.00 1.00 0.00 0.00 33.01 33.20 2vxs s GLN 171 CO 0.07 -1.10 1.61 0.77 -2.12 0.00 0.00 175.29 174.52 2vxs h SER 172 N -0.71 0.00 1.47 5.90 0.02 -1.99 -0.14 113.55 118.11 2vxs h SER 172 Ca -0.45 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.50 2vxs h SER 172 Cb 1.23 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.77 2vxs h SER 172 CO 0.60 0.00 -0.01 -1.54 -1.14 0.00 0.00 176.83 174.73 2vxs n SER 173 N -3.73 0.83 0.00 3.07 3.41 -1.26 -4.89 113.62 111.05 2vxs n SER 173 Ca 0.26 0.57 0.00 0.00 -0.26 0.00 0.00 58.87 59.44 2vxs n SER 173 Cb 1.42 -0.78 0.00 0.00 -0.26 0.00 0.00 64.21 64.59 2vxs n SER 173 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2vxs n GLY 174 N 1.31 1.13 3.87 5.00 0.00 -0.06 -5.08 105.19 111.36 2vxs n GLY 174 Ca 0.05 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.74 2vxs n GLY 174 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2vxs s LEU 175 N 0.00 4.29 0.42 0.99 1.43 -1.26 -4.82 118.68 119.73 2vxs s LEU 175 Ca 0.00 0.88 -0.02 0.00 -1.03 0.00 0.00 54.13 53.96 2vxs s LEU 175 Cb 0.00 -3.30 -0.03 0.00 0.03 0.00 0.00 46.19 42.89 2vxs s LEU 175 CO 0.00 0.07 0.67 -0.31 0.23 0.00 0.00 176.35 177.01 2vxs s TYR 176 N -1.57 3.51 -0.08 0.29 1.51 0.36 -0.85 117.35 120.52 2vxs s TYR 176 Ca 0.39 0.55 -0.07 0.00 -1.01 0.00 0.00 57.07 56.93 2vxs s TYR 176 Cb -0.13 -2.12 0.02 0.00 -0.11 0.00 0.00 41.96 39.62 2vxs s TYR 176 CO 0.20 -0.10 0.21 -1.12 -1.11 0.00 0.00 175.55 173.63 2vxs s SER 177 N -4.08 -0.22 0.14 2.29 0.01 -0.11 -0.74 113.70 110.99 2vxs s SER 177 Ca 0.44 0.42 0.00 0.00 1.31 0.00 0.00 55.95 58.12 2vxs s SER 177 Cb -0.10 0.43 -0.04 0.00 0.21 0.00 0.00 66.02 66.52 2vxs s SER 177 CO 0.40 -0.08 0.02 -1.48 0.41 0.00 0.00 173.24 172.52 2vxs s LEU 178 N 0.09 2.00 0.17 2.44 0.05 -0.50 0.41 118.68 123.34 2vxs s LEU 178 Ca -0.00 -1.17 0.10 0.00 0.05 0.00 0.00 54.13 53.11 2vxs s LEU 178 Cb -0.02 0.12 -0.04 0.00 -2.05 0.00 0.00 46.19 44.20 2vxs s LEU 178 CO 0.00 -0.64 -0.22 -0.44 -0.55 0.00 0.00 176.35 174.50 2vxs s SER 179 N -3.10 3.08 -0.04 1.48 0.01 -1.26 -0.88 113.70 112.99 2vxs s SER 179 Ca 0.23 -0.84 0.02 0.00 1.31 0.00 0.00 55.95 56.66 2vxs s SER 179 Cb 0.07 -0.21 0.01 0.00 0.21 0.00 0.00 66.02 66.10 2vxs s SER 179 CO 0.02 0.06 -0.09 -0.55 0.41 0.00 0.00 173.24 173.09 2vxs s SER 180 N -2.58 1.35 0.04 2.44 0.15 -0.46 -1.06 113.70 113.59 2vxs s SER 180 Ca 0.17 -0.21 0.06 0.00 0.70 0.00 0.00 55.95 56.67 2vxs s SER 180 Cb -0.07 -0.54 -0.02 0.00 -1.71 0.00 0.00 66.02 63.67 2vxs s SER 180 CO 0.08 0.02 -0.16 -0.69 1.20 0.00 0.00 173.24 173.69 2vxs s VAL 181 N 0.56 1.31 0.00 4.45 1.01 -0.63 -0.57 120.40 126.53 2vxs s VAL 181 Ca -0.10 -1.07 0.06 0.00 0.00 0.00 0.00 61.98 60.88 2vxs s VAL 181 Cb -0.13 -1.17 -0.02 0.00 0.00 0.00 0.00 36.38 35.07 2vxs s VAL 181 CO 0.02 0.08 -0.19 -0.69 0.00 0.00 0.00 175.10 174.31 2vxs s VAL 182 N -0.83 1.52 -0.23 2.92 1.01 0.73 0.09 120.40 125.61 2vxs s VAL 182 Ca 0.04 -0.93 -0.12 0.00 0.00 0.00 0.00 61.98 60.97 2vxs s VAL 182 Cb -0.08 -1.29 -0.05 0.00 0.00 0.00 0.00 36.38 34.96 2vxs s VAL 182 CO 0.01 0.34 0.24 -0.89 0.00 0.00 0.00 175.10 174.80 2vxs s THR 183 N -0.57 5.30 0.30 3.92 2.01 -0.75 -1.39 115.64 124.48 2vxs s THR 183 Ca 0.07 0.34 0.06 0.00 0.31 0.00 0.00 61.69 62.47 2vxs s THR 183 Cb -0.08 -3.57 -0.06 0.00 0.01 0.00 0.00 72.50 68.80 2vxs s THR 183 CO 0.00 0.30 -0.02 0.68 -0.69 0.00 0.00 174.62 174.89 2vxs s VAL 184 N 1.24 1.57 0.13 3.82 -7.23 -0.04 -4.67 120.40 115.21 2vxs s VAL 184 Ca 0.11 -2.08 -0.30 0.00 -1.81 0.00 0.00 61.98 57.90 2vxs s VAL 184 Cb -0.14 -2.58 -0.07 0.00 0.56 0.00 0.00 36.38 34.15 2vxs s VAL 184 CO 0.06 -0.20 1.10 -2.16 -0.31 0.00 0.00 175.10 173.59 2vxs s PRO 185 N -3.77 4.56 0.54 4.82 0.04 -1.26 -0.80 135.00 139.13 2vxs s PRO 185 Ca 0.32 1.68 0.23 0.00 0.04 0.00 0.00 61.00 63.26 2vxs s PRO 185 Cb 0.06 -3.32 1.40 0.00 0.04 0.00 0.00 34.50 32.67 2vxs s PRO 185 CO 0.13 0.00 2.05 0.77 0.04 0.00 0.00 177.00 180.00 2vxs h SER 186 N 5.68 0.00 0.61 6.66 0.02 -1.45 -0.79 113.55 124.28 2vxs h SER 186 Ca -0.43 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.52 2vxs h SER 186 Cb 1.21 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.75 2vxs h SER 186 CO 0.75 0.00 0.00 -1.54 -1.14 0.00 0.00 176.83 174.90 2vxs n SER 187 N -4.34 0.06 -0.00 3.07 3.41 -1.26 -2.36 113.62 112.20 2vxs n SER 187 Ca 0.05 0.51 0.11 0.00 -0.26 0.00 0.00 58.87 59.29 2vxs n SER 187 Cb 0.42 -0.52 0.12 0.00 -0.26 0.00 0.00 64.21 63.97 2vxs n SER 187 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2vxs n SER 188 N -1.56 0.67 0.24 4.04 3.41 -0.30 -4.53 113.62 115.59 2vxs n SER 188 Ca 0.04 -0.51 0.08 0.00 -0.26 0.00 0.00 58.87 58.22 2vxs n SER 188 Cb 0.21 0.51 0.60 0.00 -0.26 0.00 0.00 64.21 65.26 2vxs n SER 188 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 2vxs h LEU 189 N 0.00 0.00 -0.05 1.04 3.38 -1.58 0.27 115.31 118.37 2vxs h LEU 189 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2vxs h LEU 189 Cb 0.50 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.25 2vxs h LEU 189 CO 0.00 0.14 0.00 1.23 0.09 0.00 0.00 178.44 179.90 2vxs h GLY 190 N 0.56 0.00 0.00 0.83 0.00 -1.81 -3.40 103.07 99.25 2vxs h GLY 190 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2vxs h GLY 190 CO 0.02 0.00 -0.75 2.41 0.00 0.00 0.00 176.54 178.22 2vxs n THR 191 N -2.60 0.00 -3.89 4.70 -1.04 -0.65 -5.03 114.28 105.77 2vxs n THR 191 Ca 0.05 0.00 -0.35 0.00 -2.04 0.00 0.00 64.05 61.70 2vxs n THR 191 Cb 0.46 -0.68 -0.11 0.00 -1.82 0.00 0.00 70.33 68.19 2vxs n THR 191 CO 0.00 0.00 0.00 -1.10 -0.64 0.00 0.00 175.07 173.33 2vxs s GLN 192 N -1.75 3.88 0.09 -2.82 -1.52 -0.01 -5.07 119.66 112.46 2vxs s GLN 192 Ca 0.00 -0.38 -0.28 0.00 -1.95 0.00 0.00 55.36 52.75 2vxs s GLN 192 Cb 0.00 -3.30 -0.06 0.00 -0.22 0.00 0.00 33.01 29.43 2vxs s GLN 192 CO 0.00 0.09 0.87 -0.08 -0.25 0.00 0.00 175.29 175.92 2vxs s THR 193 N 0.89 4.59 -0.24 -0.19 -1.32 -1.26 -4.79 115.64 113.32 2vxs s THR 193 Ca 0.04 1.88 0.02 0.00 -1.21 0.00 0.00 61.69 62.42 2vxs s THR 193 Cb -0.14 -4.23 0.05 0.00 -1.51 0.00 0.00 72.50 66.67 2vxs s THR 193 CO 0.03 0.35 -0.13 -0.31 -2.21 0.00 0.00 174.62 172.35 2vxs s TYR 194 N -0.07 3.16 -0.06 9.09 2.02 -1.26 -4.97 117.35 125.25 2vxs s TYR 194 Ca 0.43 -2.15 0.03 0.00 -0.37 0.00 0.00 57.07 55.01 2vxs s TYR 194 Cb -0.22 -1.94 -0.03 0.00 -0.40 0.00 0.00 41.96 39.38 2vxs s TYR 194 CO 0.27 -0.86 -0.13 0.42 -1.57 0.00 0.00 175.55 173.68 2vxs s ILE 195 N 1.15 3.20 -0.19 2.71 1.01 -1.26 -0.70 121.20 127.11 2vxs s ILE 195 Ca -0.06 -0.67 -0.03 0.00 0.00 0.00 0.00 60.65 59.90 2vxs s ILE 195 Cb -0.18 -2.27 -0.01 0.00 0.01 0.00 0.00 42.46 40.00 2vxs s ILE 195 CO -0.07 0.59 -0.06 0.00 0.00 0.00 0.00 174.94 175.40 2vxs s ASN 197 N 1.10 5.12 -0.19 0.00 -0.87 0.29 -1.03 114.94 119.36 2vxs s ASN 197 Ca 0.01 -1.15 -0.04 0.00 -1.57 0.00 0.00 52.86 50.11 2vxs s ASN 197 Cb -0.15 -1.81 -0.02 0.00 -0.02 0.00 0.00 41.25 39.26 2vxs s ASN 197 CO -0.01 -0.29 -0.04 -0.69 -2.57 0.00 0.00 177.10 173.51 2vxs s VAL 198 N 1.35 3.62 -0.12 1.60 1.01 0.38 -1.33 120.40 126.91 2vxs s VAL 198 Ca -0.03 -0.43 0.01 0.00 0.00 0.00 0.00 61.98 61.53 2vxs s VAL 198 Cb -0.19 -2.62 -0.01 0.00 0.00 0.00 0.00 36.38 33.55 2vxs s VAL 198 CO 0.01 0.44 -0.15 0.21 0.00 0.00 0.00 175.10 175.62 2vxs s ASN 199 N 1.03 3.88 -0.55 3.32 3.84 0.58 -0.86 114.94 126.17 2vxs s ASN 199 Ca 0.01 -0.35 0.04 0.00 0.21 0.00 0.00 52.86 52.77 2vxs s ASN 199 Cb -0.15 -1.53 0.16 0.00 -0.55 0.00 0.00 41.25 39.18 2vxs s ASN 199 CO 0.01 0.18 0.37 -2.28 -2.79 0.00 0.00 177.10 172.58 2vxs s HIS 200 N 0.28 2.60 0.41 0.43 5.65 -0.39 -0.39 115.29 123.89 2vxs s HIS 200 Ca -0.11 -2.88 0.23 0.00 0.25 0.00 0.00 55.06 52.55 2vxs s HIS 200 Cb -0.16 -2.14 1.26 0.00 -1.18 0.00 0.00 32.58 30.37 2vxs s HIS 200 CO 0.06 -0.69 2.03 1.57 -0.65 0.00 0.00 174.74 177.06 2vxs h LYS 201 N 5.92 0.00 0.00 2.88 -0.00 -1.80 -1.72 116.57 121.84 2vxs h LYS 201 Ca 0.10 0.00 -0.00 0.00 -0.00 0.00 0.00 60.65 60.75 2vxs h LYS 201 Cb 0.85 0.00 -0.00 0.00 -0.00 0.00 0.00 32.23 33.08 2vxs h LYS 201 CO 0.58 0.16 -0.02 -1.35 -0.00 0.00 0.00 179.45 178.82 2vxs h PRO 202 N 0.00 0.00 -0.24 0.07 0.11 -1.90 -2.59 132.00 127.45 2vxs h PRO 202 Ca -0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 2vxs h PRO 202 Cb 0.37 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.48 2vxs h PRO 202 CO 0.02 0.02 0.00 -1.13 -0.21 0.00 0.00 178.00 176.70 2vxs n SER 203 N -3.61 2.62 -3.89 -2.05 3.41 -0.72 -4.98 113.62 104.40 2vxs n SER 203 Ca -0.03 -1.98 -0.26 0.00 -0.26 0.00 0.00 58.87 56.35 2vxs n SER 203 Cb 0.11 -0.16 0.01 0.00 -0.26 0.00 0.00 64.21 63.91 2vxs n SER 203 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2vxs n ASN 204 N 0.22 -1.71 -4.02 4.04 4.13 -0.79 -4.97 115.26 112.17 2vxs n ASN 204 Ca 0.08 -0.90 -0.28 0.00 1.68 0.00 0.00 54.58 55.16 2vxs n ASN 204 Cb 0.37 -3.52 -0.17 0.00 -1.54 0.00 0.00 39.78 34.92 2vxs n ASN 204 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 2vxs s THR 205 N -3.67 1.39 -0.06 3.41 2.01 -1.13 -5.03 115.64 112.56 2vxs s THR 205 Ca 0.20 -0.56 0.06 0.00 0.31 0.00 0.00 61.69 61.69 2vxs s THR 205 Cb -0.10 -1.29 -0.01 0.00 0.01 0.00 0.00 72.50 71.11 2vxs s THR 205 CO 0.86 0.42 -0.24 -0.75 -0.69 0.00 0.00 174.62 174.21 2vxs s LYS 206 N 1.14 2.52 -0.04 4.92 2.36 -1.26 -1.27 119.74 128.11 2vxs s LYS 206 Ca -0.04 -0.88 0.03 0.00 -2.55 0.00 0.00 55.97 52.53 2vxs s LYS 206 Cb -0.14 -2.12 0.01 0.00 -1.05 0.00 0.00 37.83 34.52 2vxs s LYS 206 CO -0.03 0.36 -0.11 0.08 1.55 0.00 0.00 175.35 177.19 2vxs s VAL 207 N -0.11 1.00 -0.22 4.02 1.01 -0.04 -4.99 120.40 121.07 2vxs s VAL 207 Ca -0.05 -0.45 -0.04 0.00 0.00 0.00 0.00 61.98 61.44 2vxs s VAL 207 Cb -0.14 -0.90 -0.01 0.00 0.00 0.00 0.00 36.38 35.33 2vxs s VAL 207 CO 0.04 0.31 -0.04 -1.81 0.00 0.00 0.00 175.10 173.60 2vxs s ASP 208 N 0.36 4.33 -0.09 3.32 -0.00 -1.26 -0.47 116.67 122.87 2vxs s ASP 208 Ca -0.07 -0.38 0.02 0.00 -0.00 0.00 0.00 52.55 52.12 2vxs s ASP 208 Cb -0.12 -1.74 0.01 0.00 -0.00 0.00 0.00 42.92 41.07 2vxs s ASP 208 CO 0.02 -0.01 -0.16 -0.75 -0.00 0.00 0.00 175.17 174.27 2vxs s LYS 209 N 1.44 2.14 0.04 8.23 2.47 -0.19 -4.93 119.74 128.94 2vxs s LYS 209 Ca 0.05 -0.56 -0.28 0.00 -1.56 0.00 0.00 55.97 53.62 2vxs s LYS 209 Cb -0.14 -1.74 -0.05 0.00 -1.46 0.00 0.00 37.83 34.44 2vxs s LYS 209 CO -0.03 0.03 0.90 0.21 0.16 0.00 0.00 175.35 176.63 2vxs s LYS 210 N 0.70 4.59 -0.26 4.03 2.20 -1.26 -0.42 119.74 129.30 2vxs s LYS 210 Ca -0.13 1.31 -0.05 0.00 -0.36 0.00 0.00 55.97 56.74 2vxs s LYS 210 Cb -0.16 -3.41 0.00 0.00 -1.51 0.00 0.00 37.83 32.75 2vxs s LYS 210 CO 0.03 0.12 0.02 0.54 -0.36 0.00 0.00 175.35 175.71 2vxs s VAL 211 N 0.42 3.66 0.27 4.02 0.11 0.12 -4.89 120.40 124.10 2vxs s VAL 211 Ca 0.46 -0.66 0.08 0.00 -2.93 0.00 0.00 61.98 58.94 2vxs s VAL 211 Cb -0.21 -2.82 -0.04 0.00 -1.53 0.00 0.00 36.38 31.78 2vxs s VAL 211 CO 0.27 0.20 0.09 -1.61 -3.33 0.00 0.00 175.10 170.72 2vxs s GLU 212 N 1.47 2.56 0.29 1.54 2.02 -1.26 -4.42 118.70 120.90 2vxs s GLU 212 Ca 0.03 -1.28 -0.29 0.00 0.02 0.00 0.00 54.97 53.45 2vxs s GLU 212 Cb -0.16 -2.33 -0.10 0.00 0.10 0.00 0.00 34.13 31.64 2vxs s GLU 212 CO -0.00 0.36 1.35 -2.14 0.02 0.00 0.00 175.26 174.85 2vxs s PRO 213 N -3.76 4.33 0.24 0.39 0.02 -1.26 -4.41 135.00 130.55 2vxs s PRO 213 Ca 0.33 2.23 -0.31 0.00 0.02 0.00 0.00 61.00 63.26 2vxs s PRO 213 Cb -0.07 -3.10 -0.13 0.00 0.02 0.00 0.00 34.50 31.23 2vxs s PRO 213 CO 0.22 -0.28 1.57 1.63 -0.33 0.00 0.00 177.00 179.81 2vxs n LYS 214 N 1.52 2.45 -3.56 5.54 4.76 -1.26 -4.92 118.16 122.68 2vxs n LYS 214 Ca 0.03 0.87 -0.37 0.00 -2.87 0.00 0.00 58.31 55.97 2vxs n LYS 214 Cb 0.41 -2.64 -0.09 0.00 -1.84 0.00 0.00 35.03 30.88 2vxs n LYS 214 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 2vxs s SER 215 N 0.65 6.21 0.00 4.39 0.15 -1.26 -5.09 113.70 118.74 2vxs s SER 215 Ca 0.70 0.23 0.13 0.00 0.70 0.00 0.00 55.95 57.71 2vxs s SER 215 Cb -0.57 -2.15 0.10 0.00 -1.71 0.00 0.00 66.02 61.70 2vxs s SER 215 CO 0.44 0.00 0.91 0.00 1.20 0.00 0.00 173.24 175.79