#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dgg n VAL 2 N 0.00 1.16 -3.77 6.31 0.31 -1.26 -4.12 118.33 116.97 3dgg n VAL 2 Ca 0.00 -0.29 -0.13 0.00 -0.01 0.00 0.00 64.34 63.91 3dgg n VAL 2 Cb 0.00 -1.75 -0.11 0.00 -0.91 0.00 0.00 33.84 31.07 3dgg n VAL 2 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 3dgg s LYS 3 N -0.72 0.33 -0.25 5.55 2.20 -0.44 -4.98 119.74 121.44 3dgg s LYS 3 Ca 0.64 0.43 0.02 0.00 -0.36 0.00 0.00 55.97 56.70 3dgg s LYS 3 Cb -0.56 0.13 0.06 0.00 -1.51 0.00 0.00 37.83 35.95 3dgg s LYS 3 CO 0.51 -0.06 -0.10 -0.51 -0.36 0.00 0.00 175.35 174.84 3dgg s LEU 4 N 0.32 3.07 -0.37 5.43 1.43 -1.26 -1.50 118.68 125.81 3dgg s LEU 4 Ca -0.01 -1.28 -0.09 0.00 -1.03 0.00 0.00 54.13 51.72 3dgg s LEU 4 Cb -0.03 -1.42 0.04 0.00 0.03 0.00 0.00 46.19 44.81 3dgg s LEU 4 CO -0.01 -0.19 0.17 -1.58 0.23 0.00 0.00 176.35 174.97 3dgg s GLN 5 N 1.21 2.69 0.40 1.70 2.00 -0.09 -4.09 119.66 123.48 3dgg s GLN 5 Ca -0.07 -1.19 -0.10 0.00 -2.00 0.00 0.00 55.36 52.00 3dgg s GLN 5 Cb -0.19 -3.62 -0.06 0.00 0.80 0.00 0.00 33.01 29.94 3dgg s GLN 5 CO -0.06 -0.73 0.76 -0.65 -0.50 0.00 0.00 175.29 174.11 3dgg s GLN 6 N 1.46 3.75 0.93 1.67 -0.21 -1.26 -0.78 119.66 125.22 3dgg s GLN 6 Ca 0.01 0.42 -0.11 0.00 0.02 0.00 0.00 55.36 55.69 3dgg s GLN 6 Cb -0.20 -2.41 0.15 0.00 1.00 0.00 0.00 33.01 31.55 3dgg s GLN 6 CO 0.04 -0.03 1.09 -1.54 -2.12 0.00 0.00 175.29 172.73 3dgg s SER 7 N -3.22 3.08 1.12 5.90 1.04 -0.96 -4.98 113.70 115.68 3dgg s SER 7 Ca 0.50 1.65 -0.15 0.00 0.48 0.00 0.00 55.95 58.43 3dgg s SER 7 Cb -0.10 -2.30 0.22 0.00 0.10 0.00 0.00 66.02 63.94 3dgg s SER 7 CO 0.32 -2.91 0.96 0.61 0.98 0.00 0.00 173.24 173.20 3dgg n GLY 8 N -0.60 -2.22 3.75 7.32 0.00 -1.26 -4.56 105.19 107.62 3dgg n GLY 8 Ca 0.07 -1.57 -0.36 0.00 0.00 0.00 0.00 46.02 44.17 3dgg n GLY 8 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3dgg s PRO 9 N -5.14 2.86 -0.03 1.61 0.02 -1.26 -4.70 135.00 128.36 3dgg s PRO 9 Ca 0.59 1.83 0.02 0.00 0.02 0.00 0.00 61.00 63.46 3dgg s PRO 9 Cb -0.04 -1.91 0.01 0.00 0.02 0.00 0.00 34.50 32.57 3dgg s PRO 9 CO 0.44 -1.29 -0.07 -1.21 -0.33 0.00 0.00 177.00 174.53 3dgg s GLU 10 N -3.40 0.84 -0.22 5.54 0.41 -0.83 -5.00 118.70 116.04 3dgg s GLU 10 Ca 0.77 -0.23 -0.02 0.00 -0.41 0.00 0.00 54.97 55.09 3dgg s GLU 10 Cb -0.31 -0.80 0.01 0.00 -1.78 0.00 0.00 34.13 31.25 3dgg s GLU 10 CO 0.35 0.06 -0.09 -1.17 -0.49 0.00 0.00 175.26 173.92 3dgg s LEU 11 N 0.34 2.82 0.18 1.80 2.96 -1.26 -0.17 118.68 125.36 3dgg s LEU 11 Ca -0.05 -0.66 0.08 0.00 -0.22 0.00 0.00 54.13 53.28 3dgg s LEU 11 Cb -0.09 -1.64 -0.04 0.00 0.50 0.00 0.00 46.19 44.91 3dgg s LEU 11 CO 0.00 -0.06 -0.16 0.68 -1.32 0.00 0.00 176.35 175.50 3dgg s VAL 12 N 1.37 1.74 0.46 1.68 -7.23 -0.30 -4.97 120.40 113.15 3dgg s VAL 12 Ca 0.03 -2.07 -0.16 0.00 -1.81 0.00 0.00 61.98 57.98 3dgg s VAL 12 Cb -0.15 -1.93 -0.08 0.00 0.56 0.00 0.00 36.38 34.78 3dgg s VAL 12 CO -0.06 -0.48 0.91 -0.54 -0.31 0.00 0.00 175.10 174.62 3dgg s LYS 13 N -3.25 3.95 0.39 4.82 1.02 -1.24 0.08 119.74 125.51 3dgg s LYS 13 Ca 0.19 0.83 -0.28 0.00 0.02 0.00 0.00 55.97 56.74 3dgg s LYS 13 Cb -0.03 -2.23 -0.11 0.00 -0.52 0.00 0.00 37.83 34.94 3dgg s LYS 13 CO 0.07 -0.14 1.46 -0.35 -0.92 0.00 0.00 175.35 175.46 3dgg n PRO 14 N -1.28 2.54 0.00 -1.68 -0.04 -1.26 -2.33 135.00 130.95 3dgg n PRO 14 Ca 0.05 0.89 0.00 0.00 -0.04 0.00 0.00 63.50 64.41 3dgg n PRO 14 Cb 0.54 -2.63 0.00 0.00 -0.04 0.00 0.00 33.50 31.37 3dgg n PRO 14 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3dgg n GLY 15 N 0.51 1.99 3.80 0.55 0.00 0.12 -4.94 105.19 107.22 3dgg n GLY 15 Ca 0.02 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.75 3dgg n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dgg s ALA 16 N -2.38 1.78 0.06 4.61 0.00 -0.98 -4.25 121.76 120.59 3dgg s ALA 16 Ca 0.00 -0.77 0.08 0.00 0.00 0.00 0.00 51.96 51.27 3dgg s ALA 16 Cb 0.00 -2.94 -0.03 0.00 0.00 0.00 0.00 23.12 20.15 3dgg s ALA 16 CO 0.00 -2.48 -0.20 0.45 0.00 0.00 0.00 175.76 173.53 3dgg s SER 17 N -4.27 3.67 0.02 0.00 0.15 -1.26 -1.78 113.70 110.23 3dgg s SER 17 Ca 0.67 -0.50 0.01 0.00 0.70 0.00 0.00 55.95 56.84 3dgg s SER 17 Cb -0.11 -0.52 -0.02 0.00 -1.71 0.00 0.00 66.02 63.67 3dgg s SER 17 CO 0.53 0.24 -0.06 0.68 1.20 0.00 0.00 173.24 175.83 3dgg s VAL 18 N -0.95 0.39 -0.27 4.45 -7.23 -0.56 -4.99 120.40 111.24 3dgg s VAL 18 Ca 0.15 -0.77 0.03 0.00 -1.81 0.00 0.00 61.98 59.57 3dgg s VAL 18 Cb -0.10 -0.44 0.06 0.00 0.56 0.00 0.00 36.38 36.46 3dgg s VAL 18 CO 0.06 -0.26 -0.09 -0.75 -0.31 0.00 0.00 175.10 173.74 3dgg s LYS 19 N -1.11 2.15 0.31 4.82 2.20 -1.26 -1.14 119.74 125.71 3dgg s LYS 19 Ca -0.08 -1.39 -0.08 0.00 -0.36 0.00 0.00 55.97 54.06 3dgg s LYS 19 Cb -0.07 -2.91 -0.06 0.00 -1.51 0.00 0.00 37.83 33.27 3dgg s LYS 19 CO -0.00 -0.61 0.62 -1.64 -0.36 0.00 0.00 175.35 173.36 3dgg s MET 20 N 1.09 3.73 0.17 4.03 -1.94 -0.20 -4.93 119.30 121.24 3dgg s MET 20 Ca -0.07 0.23 0.11 0.00 -1.71 0.00 0.00 55.69 54.25 3dgg s MET 20 Cb -0.20 -2.57 -0.04 0.00 2.01 0.00 0.00 34.83 34.03 3dgg s MET 20 CO -0.05 0.17 -0.25 -1.54 -0.01 0.00 0.00 175.02 173.34 3dgg s SER 21 N -2.92 3.30 -0.25 3.03 1.04 -1.26 -1.47 113.70 115.17 3dgg s SER 21 Ca 0.47 -0.82 -0.03 0.00 0.48 0.00 0.00 55.95 56.06 3dgg s SER 21 Cb -0.11 -0.23 0.08 0.00 0.10 0.00 0.00 66.02 65.87 3dgg s SER 21 CO 0.27 0.13 0.09 0.00 0.98 0.00 0.00 173.24 174.71 3dgg s LYS 23 N 1.90 3.71 0.06 0.00 -0.14 0.04 -0.77 119.74 124.54 3dgg s LYS 23 Ca 0.05 -0.21 -0.08 0.00 -1.36 0.00 0.00 55.97 54.37 3dgg s LYS 23 Cb -0.17 -3.76 -0.05 0.00 -1.68 0.00 0.00 37.83 32.17 3dgg s LYS 23 CO -0.22 -0.49 0.35 0.00 -0.76 0.00 0.00 175.35 174.24 3dgg s ALA 24 N 2.14 3.77 0.09 5.17 0.00 0.04 -0.92 121.76 132.05 3dgg s ALA 24 Ca 0.15 -0.46 -0.09 0.00 0.00 0.00 0.00 51.96 51.56 3dgg s ALA 24 Cb -0.16 -2.19 0.00 0.00 0.00 0.00 0.00 23.12 20.77 3dgg s ALA 24 CO 0.12 0.60 0.21 -1.54 0.00 0.00 0.00 175.76 175.14 3dgg s SER 25 N -1.79 0.09 0.00 0.00 1.04 -0.56 -4.83 113.70 107.64 3dgg s SER 25 Ca 0.32 -0.61 0.00 0.00 0.48 0.00 0.00 55.95 56.14 3dgg s SER 25 Cb -0.14 0.35 0.00 0.00 0.10 0.00 0.00 66.02 66.33 3dgg s SER 25 CO 0.18 -0.73 0.00 0.61 0.98 0.00 0.00 173.24 174.28 3dgg n GLY 26 N -0.04 0.67 3.75 7.32 0.00 -1.26 -1.33 105.19 114.31 3dgg n GLY 26 Ca -0.15 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.79 3dgg n GLY 26 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3dgg s TYR 27 N -2.19 -0.17 -0.49 1.61 1.13 -1.26 -4.21 117.35 111.78 3dgg s TYR 27 Ca 0.00 -0.24 -0.28 0.00 -1.41 0.00 0.00 57.07 55.14 3dgg s TYR 27 Cb 0.00 0.61 0.01 0.00 -1.10 0.00 0.00 41.96 41.48 3dgg s TYR 27 CO 0.00 -1.14 1.50 0.99 -2.51 0.00 0.00 175.55 174.39 3dgg s THR 28 N -3.91 3.74 0.14 -3.49 2.01 -1.26 -4.92 115.64 107.96 3dgg s THR 28 Ca 0.11 0.68 -0.19 0.00 0.31 0.00 0.00 61.69 62.60 3dgg s THR 28 Cb -0.04 -4.22 -0.00 0.00 0.01 0.00 0.00 72.50 68.24 3dgg s THR 28 CO 0.04 -0.92 1.70 0.15 -0.69 0.00 0.00 174.62 174.90 3dgg h PHE 29 N 11.57 -0.09 0.00 4.92 3.57 -1.95 -2.45 116.94 132.50 3dgg h PHE 29 Ca -0.28 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.24 3dgg h PHE 29 Cb 1.11 0.08 0.00 0.00 2.79 0.00 0.00 35.95 39.93 3dgg h PHE 29 CO 1.01 -0.08 0.00 1.79 -2.23 0.00 0.00 178.31 178.79 3dgg h THR 30 N 0.03 0.00 0.00 4.41 1.35 -1.91 -2.96 112.91 113.84 3dgg h THR 30 Ca 0.12 -0.22 0.00 0.00 -0.55 0.00 0.00 66.41 65.77 3dgg h THR 30 Cb 0.17 0.95 0.00 0.00 -1.73 0.00 0.00 68.15 67.55 3dgg h THR 30 CO -0.24 0.00 0.00 0.28 -0.25 0.00 0.00 175.52 175.31 3dgg h SER 31 N 0.00 0.00 -3.91 5.36 0.02 -1.84 -3.28 113.55 109.90 3dgg h SER 31 Ca 0.00 0.00 -0.63 0.00 -0.84 0.00 0.00 61.79 60.32 3dgg h SER 31 Cb 0.29 0.00 -0.31 0.00 0.14 0.00 0.00 62.40 62.52 3dgg h SER 31 CO 0.00 0.00 -0.86 -0.31 -1.14 0.00 0.00 176.83 174.52 3dgg s TYR 32 N -3.32 2.12 0.39 3.45 1.51 -1.12 -4.99 117.35 115.39 3dgg s TYR 32 Ca 0.06 -0.64 -0.26 0.00 -1.01 0.00 0.00 57.07 55.22 3dgg s TYR 32 Cb 0.08 -1.40 -0.09 0.00 -0.11 0.00 0.00 41.96 40.44 3dgg s TYR 32 CO 0.58 -0.21 1.23 0.08 -1.11 0.00 0.00 175.55 176.12 3dgg s VAL 33 N -0.03 2.93 -0.11 0.71 1.01 -1.26 -4.46 120.40 119.20 3dgg s VAL 33 Ca -0.05 0.82 0.02 0.00 0.00 0.00 0.00 61.98 62.77 3dgg s VAL 33 Cb -0.13 -3.48 -0.01 0.00 0.00 0.00 0.00 36.38 32.76 3dgg s VAL 33 CO 0.03 0.11 -0.17 -0.32 0.00 0.00 0.00 175.10 174.75 3dgg s MET 34 N -2.19 3.13 0.23 2.72 1.75 -0.78 -1.54 119.30 122.61 3dgg s MET 34 Ca 0.56 -0.76 0.08 0.00 -1.25 0.00 0.00 55.69 54.31 3dgg s MET 34 Cb -0.34 -2.47 -0.04 0.00 2.84 0.00 0.00 34.83 34.82 3dgg s MET 34 CO 0.44 0.26 0.06 -1.01 -0.65 0.00 0.00 175.02 174.12 3dgg s HIS 35 N 0.19 2.88 0.05 4.11 3.76 0.15 -1.12 115.29 125.31 3dgg s HIS 35 Ca -0.10 -0.16 0.07 0.00 -0.15 0.00 0.00 55.06 54.72 3dgg s HIS 35 Cb -0.16 -1.32 -0.03 0.00 1.11 0.00 0.00 32.58 32.19 3dgg s HIS 35 CO 0.06 0.56 -0.20 -1.58 -0.85 0.00 0.00 174.74 172.73 3dgg s TRP 36 N -2.07 1.78 0.02 1.40 0.52 -0.56 -0.46 118.94 119.56 3dgg s TRP 36 Ca 0.31 -0.38 0.03 0.00 0.02 0.00 0.00 56.10 56.08 3dgg s TRP 36 Cb -0.08 -1.05 -0.01 0.00 -1.15 0.00 0.00 33.47 31.18 3dgg s TRP 36 CO 0.21 0.10 -0.09 0.08 0.02 0.00 0.00 176.95 177.27 3dgg s VAL 37 N -0.84 0.66 -0.09 4.03 1.01 0.38 -1.44 120.40 124.11 3dgg s VAL 37 Ca 0.07 -0.67 -0.01 0.00 0.00 0.00 0.00 61.98 61.37 3dgg s VAL 37 Cb -0.09 -0.62 -0.03 0.00 0.00 0.00 0.00 36.38 35.64 3dgg s VAL 37 CO 0.02 -0.03 -0.03 -0.75 0.00 0.00 0.00 175.10 174.31 3dgg s LYS 38 N -0.78 3.03 -0.15 2.72 2.20 0.60 -1.06 119.74 126.32 3dgg s LYS 38 Ca -0.01 -0.47 -0.04 0.00 -0.36 0.00 0.00 55.97 55.09 3dgg s LYS 38 Cb -0.06 -2.75 0.06 0.00 -1.51 0.00 0.00 37.83 33.57 3dgg s LYS 38 CO 0.00 0.61 0.12 -1.14 -0.36 0.00 0.00 175.35 174.58 3dgg s GLN 39 N -0.64 0.06 0.41 4.03 0.74 -0.18 -0.66 119.66 123.42 3dgg s GLN 39 Ca 0.10 0.12 -0.20 0.00 0.05 0.00 0.00 55.36 55.43 3dgg s GLN 39 Cb -0.12 -1.32 -0.11 0.00 1.10 0.00 0.00 33.01 32.57 3dgg s GLN 39 CO 0.02 -0.57 0.92 0.15 -0.55 0.00 0.00 175.29 175.26 3dgg s LYS 40 N 2.20 4.22 -0.46 1.67 1.02 -1.26 -1.09 119.74 126.04 3dgg s LYS 40 Ca 0.04 1.07 -0.46 0.00 0.02 0.00 0.00 55.97 56.63 3dgg s LYS 40 Cb -0.15 -2.26 -0.20 0.00 -0.52 0.00 0.00 37.83 34.71 3dgg s LYS 40 CO -0.08 0.02 1.55 -2.30 -0.92 0.00 0.00 175.35 173.61 3dgg n PRO 41 N -0.52 0.00 -1.53 -1.68 -0.02 -1.26 -1.52 135.00 128.48 3dgg n PRO 41 Ca 0.06 0.00 -0.14 0.00 -2.02 0.00 0.00 63.50 61.40 3dgg n PRO 41 Cb 0.54 -1.48 -0.05 0.00 -0.02 0.00 0.00 33.50 32.48 3dgg n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3dgg n GLY 42 N 3.78 1.21 3.62 -1.23 0.00 -1.26 -4.99 105.19 106.31 3dgg n GLY 42 Ca 0.30 -0.37 -0.29 0.00 0.00 0.00 0.00 46.02 45.66 3dgg n GLY 42 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3dgg s GLN 43 N -3.39 2.06 0.48 1.61 -0.21 -0.58 -5.16 119.66 114.47 3dgg s GLN 43 Ca 0.00 -2.29 -0.08 0.00 0.02 0.00 0.00 55.36 53.01 3dgg s GLN 43 Cb 0.00 -0.94 0.12 0.00 1.00 0.00 0.00 33.01 33.19 3dgg s GLN 43 CO 0.00 -0.46 0.52 0.41 -2.12 0.00 0.00 175.29 173.63 3dgg n GLY 44 N -1.07 -2.03 3.63 3.09 0.00 -1.26 -4.71 105.19 102.83 3dgg n GLY 44 Ca -0.11 -1.56 -0.36 0.00 0.00 0.00 0.00 46.02 43.98 3dgg n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dgg s LEU 45 N 0.00 3.96 -0.20 0.99 1.43 -1.26 -4.37 118.68 119.23 3dgg s LEU 45 Ca 0.31 0.07 -0.04 0.00 -1.03 0.00 0.00 54.13 53.44 3dgg s LEU 45 Cb -0.02 -2.05 -0.01 0.00 0.03 0.00 0.00 46.19 44.14 3dgg s LEU 45 CO 0.23 0.08 -0.04 -1.61 0.23 0.00 0.00 176.35 175.24 3dgg s GLU 46 N 0.94 3.46 0.16 1.70 2.02 0.17 -4.97 118.70 122.18 3dgg s GLU 46 Ca 0.06 -0.60 -0.30 0.00 0.02 0.00 0.00 54.97 54.15 3dgg s GLU 46 Cb -0.13 -2.97 -0.07 0.00 0.10 0.00 0.00 34.13 31.06 3dgg s GLU 46 CO 0.03 -0.05 1.17 -0.46 0.02 0.00 0.00 175.26 175.98 3dgg s TRP 47 N 1.10 3.47 -0.26 1.61 -0.00 -1.26 -0.29 118.94 123.31 3dgg s TRP 47 Ca 0.01 1.44 -0.14 0.00 -0.00 0.00 0.00 56.10 57.42 3dgg s TRP 47 Cb -0.15 -3.39 -0.14 0.00 -0.00 0.00 0.00 33.47 29.79 3dgg s TRP 47 CO -0.00 -1.07 -0.21 -0.89 -0.00 0.00 0.00 176.95 174.78 3dgg n ILE 48 N 2.76 1.54 -1.57 5.86 5.41 -0.52 -4.59 119.36 128.24 3dgg n ILE 48 Ca 0.05 -0.34 0.00 0.00 1.00 0.00 0.00 62.75 63.45 3dgg n ILE 48 Cb 0.45 -1.86 0.00 0.00 -0.71 0.00 0.00 39.64 37.52 3dgg n ILE 48 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3dgg n GLY 49 N 1.41 -2.27 3.14 7.39 0.00 -1.24 -1.49 105.19 112.14 3dgg n GLY 49 Ca -0.49 -1.30 -0.10 0.00 0.00 0.00 0.00 46.02 44.13 3dgg n GLY 49 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3dgg s TYR 50 N -2.38 0.79 -0.09 1.61 -0.85 -0.73 -1.50 117.35 114.21 3dgg s TYR 50 Ca 0.00 -0.92 0.02 0.00 -0.52 0.00 0.00 57.07 55.65 3dgg s TYR 50 Cb 0.00 -0.48 0.01 0.00 0.38 0.00 0.00 41.96 41.87 3dgg s TYR 50 CO 0.00 -0.19 -0.14 -1.50 -1.52 0.00 0.00 175.55 172.19 3dgg s ILE 51 N -3.54 1.36 -0.56 -3.49 1.10 -0.28 -2.85 121.20 112.95 3dgg s ILE 51 Ca 0.09 -0.58 -0.20 0.00 -0.51 0.00 0.00 60.65 59.45 3dgg s ILE 51 Cb 0.05 -1.24 0.07 0.00 0.15 0.00 0.00 42.46 41.49 3dgg s ILE 51 CO -0.06 0.41 0.73 0.21 -2.11 0.00 0.00 174.94 174.12 3dgg s ASN 52 N 0.80 6.22 0.34 4.50 3.84 0.35 -1.87 114.94 129.12 3dgg s ASN 52 Ca -0.11 -1.03 0.26 0.00 0.21 0.00 0.00 52.86 52.19 3dgg s ASN 52 Cb -0.16 -2.33 1.16 0.00 -0.55 0.00 0.00 41.25 39.38 3dgg s ASN 52 CO 0.02 -1.07 1.78 1.55 -2.79 0.00 0.00 177.10 176.59 3dgg h PRO 53 N 9.17 0.00 -0.27 0.43 0.13 -1.82 0.40 132.00 140.03 3dgg h PRO 53 Ca -0.28 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.71 3dgg h PRO 53 Cb 1.09 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.21 3dgg h PRO 53 CO 1.05 0.00 -0.39 -0.92 -0.23 0.00 0.00 178.00 177.51 3dgg h TYR 54 N 0.00 0.75 0.00 1.56 5.03 -1.90 -3.35 116.97 119.07 3dgg h TYR 54 Ca 0.00 -0.22 0.00 0.00 2.58 0.00 0.00 58.73 61.09 3dgg h TYR 54 Cb 0.31 -0.16 0.00 0.00 1.55 0.00 0.00 36.73 38.42 3dgg h TYR 54 CO 0.00 0.93 0.00 0.27 -1.32 0.00 0.00 178.16 178.04 3dgg n ASN 55 N -4.04 0.87 -1.96 -2.11 0.23 -1.05 -5.01 115.26 102.18 3dgg n ASN 55 Ca -0.02 -1.28 -0.20 0.00 -0.53 0.00 0.00 54.58 52.56 3dgg n ASN 55 Cb 0.52 0.00 -0.04 0.00 -2.08 0.00 0.00 39.78 38.18 3dgg n ASN 55 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 3dgg n ASP 56 N -0.14 -5.57 -4.78 0.53 9.92 0.14 -4.99 116.55 111.66 3dgg n ASP 56 Ca 0.00 0.19 -0.37 0.00 -0.53 0.00 0.00 54.79 54.08 3dgg n ASP 56 Cb 0.22 -4.69 -0.03 0.00 -0.64 0.00 0.00 41.12 35.98 3dgg n ASP 56 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 3dgg s ASP 57 N -2.38 6.63 0.06 -2.24 2.15 -1.17 -4.81 116.67 114.90 3dgg s ASP 57 Ca 0.00 2.12 0.02 0.00 0.43 0.00 0.00 52.55 55.11 3dgg s ASP 57 Cb 0.00 -2.59 -0.03 0.00 -0.30 0.00 0.00 42.92 40.00 3dgg s ASP 57 CO 0.00 -0.59 -0.06 0.42 -0.17 0.00 0.00 175.17 174.77 3dgg s THR 58 N -1.62 0.54 0.01 1.71 -4.23 -1.26 -0.49 115.64 110.30 3dgg s THR 58 Ca 0.59 -1.50 -0.08 0.00 -1.18 0.00 0.00 61.69 59.52 3dgg s THR 58 Cb -0.24 -1.12 0.00 0.00 1.34 0.00 0.00 72.50 72.48 3dgg s THR 58 CO 0.30 -0.66 0.16 0.21 -0.54 0.00 0.00 174.62 174.09 3dgg s ASN 59 N -2.31 0.02 0.06 3.99 2.47 -1.13 -5.01 114.94 113.03 3dgg s ASN 59 Ca 0.00 -0.24 0.04 0.00 0.42 0.00 0.00 52.86 53.09 3dgg s ASN 59 Cb -0.02 0.23 -0.03 0.00 -1.45 0.00 0.00 41.25 39.98 3dgg s ASN 59 CO -0.03 -0.42 -0.13 -0.31 -3.72 0.00 0.00 177.10 172.50 3dgg s TYR 60 N -1.65 1.08 0.22 0.43 2.02 -1.26 -1.78 117.35 116.41 3dgg s TYR 60 Ca -0.13 -0.45 -0.32 0.00 -0.37 0.00 0.00 57.07 55.81 3dgg s TYR 60 Cb -0.06 -0.62 -0.12 0.00 -0.40 0.00 0.00 41.96 40.76 3dgg s TYR 60 CO 0.01 0.02 1.69 -1.71 -1.57 0.00 0.00 175.55 173.98 3dgg n ASN 61 N 1.42 3.89 -0.33 2.29 2.85 -0.56 -4.91 115.26 119.92 3dgg n ASN 61 Ca -0.21 1.08 0.27 0.00 -0.11 0.00 0.00 54.58 55.60 3dgg n ASN 61 Cb 0.54 -1.57 0.51 0.00 1.24 0.00 0.00 39.78 40.51 3dgg n ASN 61 CO 0.00 0.00 0.00 -0.33 -2.11 0.00 0.00 177.26 174.82 3dgg h GLU 62 N 6.31 0.19 -0.59 1.20 4.39 -1.94 -0.15 114.58 124.00 3dgg h GLU 62 Ca -0.44 -0.01 0.17 0.00 0.34 0.00 0.00 59.36 59.42 3dgg h GLU 62 Cb 1.21 -0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 29.79 3dgg h GLU 62 CO 0.92 0.13 0.42 -0.22 -1.16 0.00 0.00 179.01 179.10 3dgg h LYS 63 N 0.20 0.03 -0.09 2.33 3.64 -1.94 -2.70 116.57 118.04 3dgg h LYS 63 Ca 0.77 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 60.15 3dgg h LYS 63 Cb 1.87 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 33.68 3dgg h LYS 63 CO -0.67 0.02 0.00 1.19 -2.27 0.00 0.00 179.45 177.72 3dgg n PHE 64 N -4.37 0.11 -0.24 1.91 3.72 -0.09 -4.72 117.46 113.78 3dgg n PHE 64 Ca 0.11 -0.17 0.05 0.00 -0.05 0.00 0.00 57.45 57.39 3dgg n PHE 64 Cb 0.65 -0.01 0.16 0.00 -0.94 0.00 0.00 39.48 39.34 3dgg n PHE 64 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 176.76 176.49 3dgg h LYS 65 N 1.54 0.22 0.00 -1.08 1.63 -1.27 0.29 116.57 117.89 3dgg h LYS 65 Ca 0.00 -0.01 -0.17 0.00 -0.85 0.00 0.00 60.65 59.62 3dgg h LYS 65 Cb 0.44 -0.05 -0.02 0.00 -0.60 0.00 0.00 32.23 32.00 3dgg h LYS 65 CO 0.00 0.14 -0.86 0.78 -3.45 0.00 0.00 179.45 176.06 3dgg h GLY 66 N 0.22 0.00 0.78 5.01 0.00 -1.85 -3.39 103.07 103.84 3dgg h GLY 66 Ca 0.40 0.00 -0.29 0.00 0.00 0.00 0.00 47.33 47.43 3dgg h GLY 66 CO -0.53 0.00 -1.43 1.70 0.00 0.00 0.00 176.54 176.29 3dgg h LYS 67 N 0.00 0.34 -6.33 4.80 1.63 -1.26 -3.45 116.57 112.30 3dgg h LYS 67 Ca -0.03 -0.58 -0.68 0.00 -0.85 0.00 0.00 60.65 58.51 3dgg h LYS 67 Cb 1.61 0.22 -0.19 0.00 -0.60 0.00 0.00 32.23 33.27 3dgg h LYS 67 CO 0.10 1.28 -0.73 0.00 -3.45 0.00 0.00 179.45 176.65 3dgg s ALA 68 N -2.52 2.91 -0.12 5.00 0.00 0.80 -1.69 121.76 126.14 3dgg s ALA 68 Ca -0.16 -1.03 -0.00 0.00 0.00 0.00 0.00 51.96 50.76 3dgg s ALA 68 Cb 0.04 -1.06 0.03 0.00 0.00 0.00 0.00 23.12 22.13 3dgg s ALA 68 CO 0.83 0.60 -0.07 0.99 0.00 0.00 0.00 175.76 178.10 3dgg s THR 69 N -0.94 1.03 -0.13 0.00 2.01 0.31 -4.80 115.64 113.13 3dgg s THR 69 Ca 0.16 -0.31 -0.06 0.00 0.31 0.00 0.00 61.69 61.78 3dgg s THR 69 Cb -0.11 -1.06 -0.04 0.00 0.01 0.00 0.00 72.50 71.30 3dgg s THR 69 CO 0.06 0.35 0.10 -0.76 -0.69 0.00 0.00 174.62 173.67 3dgg s LEU 70 N 1.70 4.12 0.19 4.42 1.43 -1.26 -0.64 118.68 128.64 3dgg s LEU 70 Ca 0.05 0.32 -0.05 0.00 -1.03 0.00 0.00 54.13 53.42 3dgg s LEU 70 Cb -0.13 -2.00 -0.03 0.00 0.03 0.00 0.00 46.19 44.06 3dgg s LEU 70 CO -0.08 0.35 0.22 0.42 0.23 0.00 0.00 176.35 177.48 3dgg s THR 71 N -0.67 0.04 -0.02 5.49 -4.23 -0.77 -5.00 115.64 110.49 3dgg s THR 71 Ca 0.12 -1.72 -0.12 0.00 -1.18 0.00 0.00 61.69 58.80 3dgg s THR 71 Cb -0.12 -2.18 0.02 0.00 1.34 0.00 0.00 72.50 71.55 3dgg s THR 71 CO 0.02 -0.17 0.25 -0.94 -0.54 0.00 0.00 174.62 173.24 3dgg s SER 72 N -3.06 -0.13 -0.24 3.99 1.04 -1.26 -0.37 113.70 113.67 3dgg s SER 72 Ca 0.27 0.03 0.02 0.00 0.48 0.00 0.00 55.95 56.75 3dgg s SER 72 Cb 0.05 0.30 0.05 0.00 0.10 0.00 0.00 66.02 66.51 3dgg s SER 72 CO 0.06 -0.39 -0.13 -0.62 0.98 0.00 0.00 173.24 173.15 3dgg s ASP 73 N -1.21 4.10 0.26 7.02 -1.08 -0.52 -5.02 116.67 120.21 3dgg s ASP 73 Ca -0.13 -1.15 -0.05 0.00 -0.52 0.00 0.00 52.55 50.71 3dgg s ASP 73 Cb -0.06 -1.55 0.30 0.00 -1.46 0.00 0.00 42.92 40.15 3dgg s ASP 73 CO 0.03 -0.14 1.86 0.11 0.52 0.00 0.00 175.17 177.56 3dgg h LYS 74 N 7.85 1.11 -0.05 4.34 1.57 -1.90 -2.20 116.57 127.29 3dgg h LYS 74 Ca -0.28 -0.15 -0.00 0.00 -1.87 0.00 0.00 60.65 58.36 3dgg h LYS 74 Cb 1.07 -0.21 -0.00 0.00 0.08 0.00 0.00 32.23 33.17 3dgg h LYS 74 CO 0.52 0.85 0.03 0.77 -0.57 0.00 0.00 179.45 181.05 3dgg h SER 75 N 1.11 0.06 -0.02 0.86 0.02 -1.97 -2.94 113.55 110.67 3dgg h SER 75 Ca 0.27 -0.06 0.00 0.00 -0.84 0.00 0.00 61.79 61.16 3dgg h SER 75 Cb 0.09 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 62.61 3dgg h SER 75 CO -0.04 0.10 0.00 -1.54 -1.14 0.00 0.00 176.83 174.22 3dgg n SER 76 N -5.02 0.97 -3.95 3.07 3.41 -1.17 -4.94 113.62 105.99 3dgg n SER 76 Ca -0.06 -1.35 -0.27 0.00 -0.26 0.00 0.00 58.87 56.93 3dgg n SER 76 Cb 0.06 -0.01 -0.02 0.00 -0.26 0.00 0.00 64.21 63.98 3dgg n SER 76 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 3dgg n SER 77 N -0.23 -0.74 -3.93 4.04 7.64 -0.85 -4.76 113.62 114.79 3dgg n SER 77 Ca 0.20 -1.03 -0.22 0.00 1.01 0.00 0.00 58.87 58.83 3dgg n SER 77 Cb 0.26 -2.96 -0.16 0.00 -1.01 0.00 0.00 64.21 60.34 3dgg n SER 77 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 3dgg s THR 78 N -3.93 0.74 0.00 0.44 2.01 -1.10 -0.78 115.64 113.02 3dgg s THR 78 Ca 0.05 -0.23 -0.09 0.00 0.31 0.00 0.00 61.69 61.73 3dgg s THR 78 Cb -0.02 -0.73 -0.05 0.00 0.01 0.00 0.00 72.50 71.70 3dgg s THR 78 CO 0.89 0.27 0.30 0.00 -0.69 0.00 0.00 174.62 175.40 3dgg s ALA 79 N 0.91 3.80 0.10 7.40 0.00 0.05 -1.44 121.76 132.58 3dgg s ALA 79 Ca -0.11 -0.48 0.08 0.00 0.00 0.00 0.00 51.96 51.45 3dgg s ALA 79 Cb -0.15 -2.15 -0.03 0.00 0.00 0.00 0.00 23.12 20.79 3dgg s ALA 79 CO 0.01 0.60 -0.21 0.71 0.00 0.00 0.00 175.76 176.87 3dgg s TYR 80 N -1.25 1.77 -0.11 0.00 2.02 0.51 0.28 117.35 120.57 3dgg s TYR 80 Ca 0.26 -0.42 0.01 0.00 -0.37 0.00 0.00 57.07 56.56 3dgg s TYR 80 Cb -0.14 -0.98 0.02 0.00 -0.40 0.00 0.00 41.96 40.47 3dgg s TYR 80 CO 0.14 0.19 -0.11 1.41 -1.57 0.00 0.00 175.55 175.61 3dgg s MET 81 N -1.84 1.85 -0.23 -0.62 -2.45 -0.54 -1.85 119.30 113.61 3dgg s MET 81 Ca 0.06 -0.41 -0.08 0.00 -1.25 0.00 0.00 55.69 54.01 3dgg s MET 81 Cb -0.10 -1.70 -0.04 0.00 1.25 0.00 0.00 34.83 34.24 3dgg s MET 81 CO 0.04 -0.15 0.10 -1.21 1.05 0.00 0.00 175.02 174.85 3dgg s GLU 82 N 1.29 3.87 -0.13 4.11 0.41 0.19 -1.04 118.70 127.40 3dgg s GLU 82 Ca -0.02 -0.38 -0.02 0.00 -0.41 0.00 0.00 54.97 54.14 3dgg s GLU 82 Cb -0.14 -3.38 -0.03 0.00 -1.78 0.00 0.00 34.13 28.80 3dgg s GLU 82 CO -0.05 -0.01 -0.05 -0.51 -0.49 0.00 0.00 175.26 174.16 3dgg s LEU 83 N 1.17 3.21 0.32 1.80 1.43 -0.29 -0.53 118.68 125.79 3dgg s LEU 83 Ca 0.05 -0.11 0.10 0.00 -1.03 0.00 0.00 54.13 53.15 3dgg s LEU 83 Cb -0.14 -1.75 -0.06 0.00 0.03 0.00 0.00 46.19 44.27 3dgg s LEU 83 CO 0.04 0.22 -0.13 -0.94 0.23 0.00 0.00 176.35 175.77 3dgg s SER 84 N 0.06 3.68 -1.36 2.29 1.04 -0.68 -1.49 113.70 117.23 3dgg s SER 84 Ca -0.01 -1.14 -0.01 0.00 0.48 0.00 0.00 55.95 55.28 3dgg s SER 84 Cb -0.14 -0.33 0.01 0.00 0.10 0.00 0.00 66.02 65.66 3dgg s SER 84 CO 0.03 -0.12 0.59 -1.20 0.98 0.00 0.00 173.24 173.52 3dgg n SER 85 N -0.73 -0.95 -4.77 7.02 7.64 -1.15 -4.86 113.62 115.83 3dgg n SER 85 Ca -0.05 -0.90 -0.39 0.00 1.01 0.00 0.00 58.87 58.54 3dgg n SER 85 Cb 0.62 -3.63 -0.01 0.00 -1.01 0.00 0.00 64.21 60.19 3dgg n SER 85 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3dgg s LEU 86 N -6.82 4.21 0.32 -3.43 1.43 -0.74 -4.67 118.68 108.99 3dgg s LEU 86 Ca 0.03 2.58 0.03 0.00 -1.03 0.00 0.00 54.13 55.75 3dgg s LEU 86 Cb -0.02 -3.93 -0.04 0.00 0.03 0.00 0.00 46.19 42.24 3dgg s LEU 86 CO 0.85 -0.80 0.15 0.42 0.23 0.00 0.00 176.35 177.19 3dgg s THR 87 N -1.29 0.41 0.58 5.49 -4.23 -1.26 0.14 115.64 115.47 3dgg s THR 87 Ca 0.57 -2.00 0.27 0.00 -1.18 0.00 0.00 61.69 59.35 3dgg s THR 87 Cb -0.36 -2.50 0.35 0.00 1.34 0.00 0.00 72.50 71.32 3dgg s THR 87 CO 0.46 0.00 2.17 0.77 -0.54 0.00 0.00 174.62 177.48 3dgg h SER 88 N 2.13 0.00 0.52 3.99 4.64 -1.98 -1.09 113.55 121.76 3dgg h SER 88 Ca -0.34 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.98 3dgg h SER 88 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 3dgg h SER 88 CO 0.53 0.00 0.00 -0.33 -0.87 0.00 0.00 176.83 176.16 3dgg h GLU 89 N 0.00 0.00 -0.01 4.77 4.39 -1.96 -1.72 114.58 120.05 3dgg h GLU 89 Ca 0.05 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.75 3dgg h GLU 89 Cb 0.24 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.89 3dgg h GLU 89 CO -0.00 0.00 -0.21 -0.25 -1.16 0.00 0.00 179.01 177.39 3dgg n ASP 90 N -2.60 0.86 -4.67 1.42 10.43 -0.41 -4.86 116.55 116.72 3dgg n ASP 90 Ca 0.00 -0.79 -0.42 0.00 2.57 0.00 0.00 54.79 56.14 3dgg n ASP 90 Cb 0.18 0.07 -0.03 0.00 1.84 0.00 0.00 41.12 43.18 3dgg n ASP 90 CO 0.00 0.00 0.00 -0.44 -1.07 0.00 0.00 177.20 175.69 3dgg s SER 91 N -2.49 6.65 -0.06 -2.24 0.01 -0.65 -4.85 113.70 110.07 3dgg s SER 91 Ca 0.26 2.33 -0.31 0.00 1.31 0.00 0.00 55.95 59.54 3dgg s SER 91 Cb 0.19 -2.54 0.12 0.00 0.21 0.00 0.00 66.02 64.00 3dgg s SER 91 CO 0.51 -0.91 1.35 0.00 0.41 0.00 0.00 173.24 174.60 3dgg s ALA 92 N 3.54 -2.51 -0.09 1.44 0.00 -0.95 -4.82 121.76 118.37 3dgg s ALA 92 Ca 0.74 0.47 -0.13 0.00 0.00 0.00 0.00 51.96 53.04 3dgg s ALA 92 Cb -0.36 0.60 -0.05 0.00 0.00 0.00 0.00 23.12 23.32 3dgg s ALA 92 CO 0.31 -1.11 0.32 0.08 0.00 0.00 0.00 175.76 175.36 3dgg s VAL 93 N -2.10 5.23 -0.13 0.00 1.01 -0.25 -0.50 120.40 123.65 3dgg s VAL 93 Ca 0.23 0.63 0.01 0.00 0.00 0.00 0.00 61.98 62.85 3dgg s VAL 93 Cb 0.03 -3.64 -0.01 0.00 0.00 0.00 0.00 36.38 32.77 3dgg s VAL 93 CO -0.04 0.50 -0.17 -0.31 0.00 0.00 0.00 175.10 175.08 3dgg s TYR 94 N -0.38 2.73 -0.03 5.22 2.02 0.13 -1.01 117.35 126.03 3dgg s TYR 94 Ca 0.20 -0.84 0.04 0.00 -0.37 0.00 0.00 57.07 56.10 3dgg s TYR 94 Cb -0.14 -1.81 -0.03 0.00 -0.40 0.00 0.00 41.96 39.58 3dgg s TYR 94 CO 0.08 -0.32 -0.15 0.71 -1.57 0.00 0.00 175.55 174.30 3dgg s TYR 95 N 0.44 2.67 0.09 2.71 2.02 -0.22 -0.66 117.35 124.41 3dgg s TYR 95 Ca -0.12 -0.18 0.02 0.00 -0.37 0.00 0.00 57.07 56.42 3dgg s TYR 95 Cb -0.16 -1.60 -0.04 0.00 -0.40 0.00 0.00 41.96 39.76 3dgg s TYR 95 CO 0.06 0.20 0.18 0.00 -1.57 0.00 0.00 175.55 174.42 3dgg s ALA 97 N -1.55 -0.69 -0.12 0.00 0.00 0.39 -1.28 121.76 118.52 3dgg s ALA 97 Ca 0.33 0.67 -0.20 0.00 0.00 0.00 0.00 51.96 52.76 3dgg s ALA 97 Cb -0.12 -0.35 -0.04 0.00 0.00 0.00 0.00 23.12 22.61 3dgg s ALA 97 CO 0.26 -0.16 0.56 0.50 0.00 0.00 0.00 175.76 176.92 3dgg s ARG 98 N -0.16 4.34 -0.13 0.00 3.52 -0.72 0.34 118.95 126.15 3dgg s ARG 98 Ca -0.03 0.58 -0.23 0.00 -0.13 0.00 0.00 55.73 55.92 3dgg s ARG 98 Cb -0.03 -3.47 -0.03 0.00 -1.56 0.00 0.00 34.95 29.87 3dgg s ARG 98 CO 0.01 0.06 0.70 -2.00 -0.81 0.00 0.00 175.30 173.26 3dgg s GLU 99 N 0.90 4.33 0.42 5.12 2.12 -0.59 -3.83 118.70 127.18 3dgg s GLU 99 Ca 0.29 0.82 -0.16 0.00 0.36 0.00 0.00 54.97 56.28 3dgg s GLU 99 Cb -0.16 -3.52 -0.09 0.00 0.26 0.00 0.00 34.13 30.63 3dgg s GLU 99 CO 0.12 -0.11 0.87 -0.51 -0.54 0.00 0.00 175.26 175.09 3dgg s ASP 100 N 0.99 6.72 0.49 -1.70 -0.00 0.79 -4.23 116.67 119.73 3dgg s ASP 100 Ca 0.35 1.44 0.14 0.00 -0.00 0.00 0.00 52.55 54.48 3dgg s ASP 100 Cb -0.17 -2.45 1.15 0.00 -0.00 0.00 0.00 42.92 41.46 3dgg s ASP 100 CO 0.14 -0.40 2.10 1.88 -0.00 0.00 0.00 175.17 178.89 3dgg h TYR 101 N 1.56 0.06 -1.01 4.23 0.05 -1.94 -2.89 116.97 117.04 3dgg h TYR 101 Ca -0.48 -0.00 -0.41 0.00 0.05 0.00 0.00 58.73 57.89 3dgg h TYR 101 Cb 1.18 -0.02 -0.06 0.00 1.01 0.00 0.00 36.73 38.84 3dgg h TYR 101 CO 0.62 0.09 1.02 -0.47 -1.05 0.00 0.00 178.16 178.37 3dgg s TYR 102 N -5.01 2.02 -0.28 4.88 6.14 -1.26 -3.89 117.35 119.95 3dgg s TYR 102 Ca -0.05 0.20 0.00 0.00 0.64 0.00 0.00 57.07 57.86 3dgg s TYR 102 Cb 0.17 -4.26 0.00 0.00 0.42 0.00 0.00 41.96 38.29 3dgg s TYR 102 CO 0.68 -1.86 0.00 0.41 0.64 0.00 0.00 175.55 175.42 3dgg n GLY 103 N 6.70 0.39 2.40 8.97 0.00 -1.26 -2.54 105.19 119.84 3dgg n GLY 103 Ca 0.35 -0.05 -0.16 0.00 0.00 0.00 0.00 46.02 46.15 3dgg n GLY 103 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3dgg n SER 104 N -0.67 -4.80 -4.81 1.61 3.41 -1.09 -5.01 113.62 102.26 3dgg n SER 104 Ca -0.03 -0.06 -0.34 0.00 -0.26 0.00 0.00 58.87 58.18 3dgg n SER 104 Cb 0.39 -3.85 -0.07 0.00 -0.26 0.00 0.00 64.21 60.41 3dgg n SER 104 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3dgg s ARG 105 N -4.94 4.28 -0.87 4.33 1.70 -1.05 -4.64 118.95 117.77 3dgg s ARG 105 Ca 0.06 1.12 -0.11 0.00 -0.47 0.00 0.00 55.73 56.32 3dgg s ARG 105 Cb -0.02 -2.35 0.23 0.00 -0.57 0.00 0.00 34.95 32.23 3dgg s ARG 105 CO 0.07 0.06 0.80 -1.58 -1.08 0.00 0.00 175.30 173.57 3dgg s TRP 106 N -2.03 3.83 -0.32 5.89 0.52 -1.26 -0.15 118.94 125.43 3dgg s TRP 106 Ca 0.58 -2.28 0.22 0.00 0.02 0.00 0.00 56.10 54.64 3dgg s TRP 106 Cb -0.11 -3.72 0.16 0.00 -1.15 0.00 0.00 33.47 28.65 3dgg s TRP 106 CO 0.16 -0.95 1.34 0.78 0.02 0.00 0.00 176.95 178.30 3dgg h GLY 107 N 7.37 0.00 -5.87 0.98 0.00 -1.96 -3.46 103.07 100.13 3dgg h GLY 107 Ca 0.11 0.00 -0.52 0.00 0.00 0.00 0.00 47.33 46.92 3dgg h GLY 107 CO 0.80 0.00 -0.82 -0.19 0.00 0.00 0.00 176.54 176.34 3dgg s TYR 108 N -3.22 1.52 0.05 5.60 2.02 -1.26 -5.08 117.35 116.98 3dgg s TYR 108 Ca 0.03 -0.57 0.07 0.00 -0.37 0.00 0.00 57.07 56.23 3dgg s TYR 108 Cb 0.07 -1.11 -0.03 0.00 -0.40 0.00 0.00 41.96 40.49 3dgg s TYR 108 CO 0.73 -0.30 -0.19 -1.58 -1.57 0.00 0.00 175.55 172.64 3dgg s TRP 109 N 0.70 1.67 1.03 2.71 0.52 -1.26 -1.75 118.94 122.56 3dgg s TRP 109 Ca -0.14 -0.38 -0.12 0.00 0.02 0.00 0.00 56.10 55.48 3dgg s TRP 109 Cb -0.16 -0.98 0.21 0.00 -1.15 0.00 0.00 33.47 31.39 3dgg s TRP 109 CO 0.03 0.10 1.07 0.20 0.02 0.00 0.00 176.95 178.38 3dgg s GLY 110 N -1.31 1.57 0.25 0.98 0.00 -0.40 -4.62 107.32 103.79 3dgg s GLY 110 Ca 0.06 -0.19 0.25 0.00 0.00 0.00 0.00 44.72 44.84 3dgg s GLY 110 CO 0.02 0.42 1.71 0.06 0.00 0.00 0.00 173.10 175.32 3dgg h GLN 111 N -2.07 0.00 0.00 2.90 -0.00 -1.90 -3.44 115.11 110.60 3dgg h GLN 111 Ca -0.55 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.10 3dgg h GLN 111 Cb 1.32 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.80 3dgg h GLN 111 CO 0.54 0.00 0.00 0.41 -0.00 0.00 0.00 178.83 179.78 3dgg n GLY 112 N 1.27 2.52 3.24 0.06 0.00 -1.26 -5.06 105.19 105.97 3dgg n GLY 112 Ca 0.05 -1.60 -0.33 0.00 0.00 0.00 0.00 46.02 44.14 3dgg n GLY 112 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3dgg s THR 113 N -1.24 2.48 -0.23 2.61 2.01 0.17 -4.90 115.64 116.54 3dgg s THR 113 Ca 0.00 -0.84 -0.16 0.00 0.31 0.00 0.00 61.69 61.00 3dgg s THR 113 Cb 0.00 -2.03 -0.04 0.00 0.01 0.00 0.00 72.50 70.45 3dgg s THR 113 CO 0.00 0.53 0.40 -0.89 -0.69 0.00 0.00 174.62 173.97 3dgg s THR 114 N 0.75 5.18 -0.16 -0.82 2.01 -1.26 0.18 115.64 121.50 3dgg s THR 114 Ca -0.07 0.67 -0.06 0.00 0.31 0.00 0.00 61.69 62.54 3dgg s THR 114 Cb -0.16 -3.73 -0.04 0.00 0.01 0.00 0.00 72.50 68.59 3dgg s THR 114 CO 0.01 0.20 0.04 -0.22 -0.69 0.00 0.00 174.62 173.96 3dgg s LEU 115 N 1.70 3.72 -0.19 4.42 2.96 0.34 -1.97 118.68 129.66 3dgg s LEU 115 Ca 0.18 0.07 -0.02 0.00 -0.22 0.00 0.00 54.13 54.14 3dgg s LEU 115 Cb -0.15 -1.92 -0.00 0.00 0.50 0.00 0.00 46.19 44.61 3dgg s LEU 115 CO 0.09 0.21 -0.10 -0.89 -1.32 0.00 0.00 176.35 174.33 3dgg s THR 116 N 0.16 3.03 -0.49 3.68 2.01 0.76 -2.24 115.64 122.55 3dgg s THR 116 Ca 0.03 -0.63 -0.09 0.00 0.31 0.00 0.00 61.69 61.31 3dgg s THR 116 Cb -0.13 -2.33 0.12 0.00 0.01 0.00 0.00 72.50 70.18 3dgg s THR 116 CO 0.01 0.48 0.36 -0.69 -0.69 0.00 0.00 174.62 174.09 3dgg s VAL 117 N 1.11 4.24 0.06 3.82 1.01 -1.26 -1.14 120.40 128.24 3dgg s VAL 117 Ca 0.01 -1.84 -0.11 0.00 0.00 0.00 0.00 61.98 60.04 3dgg s VAL 117 Cb -0.14 -3.79 0.01 0.00 0.00 0.00 0.00 36.38 32.46 3dgg s VAL 117 CO -0.02 -0.79 0.24 -0.55 0.00 0.00 0.00 175.10 173.98 3dgg s SER 118 N 2.61 -0.01 0.04 3.32 0.15 0.11 -4.13 113.70 115.79 3dgg s SER 118 Ca 0.06 -0.39 0.22 0.00 0.70 0.00 0.00 55.95 56.54 3dgg s SER 118 Cb -0.26 0.34 -0.16 0.00 -1.71 0.00 0.00 66.02 64.23 3dgg s SER 118 CO -0.01 -0.65 0.78 -0.24 1.20 0.00 0.00 173.24 174.32 3dgg n SER 119 N 0.36 0.44 -4.74 5.45 2.88 -1.26 -3.67 113.62 113.08 3dgg n SER 119 Ca -0.17 -0.13 -0.37 0.00 -1.33 0.00 0.00 58.87 56.87 3dgg n SER 119 Cb 0.60 1.27 0.06 0.00 -0.75 0.00 0.00 64.21 65.40 3dgg n SER 119 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3dgg s ALA 120 N -3.34 2.41 0.37 -1.46 0.00 -1.26 -5.00 121.76 113.49 3dgg s ALA 120 Ca -0.01 1.14 -0.12 0.00 0.00 0.00 0.00 51.96 52.97 3dgg s ALA 120 Cb 0.14 -3.52 -0.07 0.00 0.00 0.00 0.00 23.12 19.66 3dgg s ALA 120 CO 0.85 -1.49 0.76 0.15 0.00 0.00 0.00 175.76 176.03 3dgg s LYS 121 N -3.39 3.87 0.21 0.00 -0.14 -1.26 -5.01 119.74 114.02 3dgg s LYS 121 Ca 0.81 0.55 -0.30 0.00 -1.36 0.00 0.00 55.97 55.67 3dgg s LYS 121 Cb -0.35 -2.40 -0.09 0.00 -1.68 0.00 0.00 37.83 33.31 3dgg s LYS 121 CO 0.38 0.03 1.35 0.99 -0.76 0.00 0.00 175.35 177.34 3dgg s THR 122 N -2.23 3.05 -0.08 2.17 2.01 -1.26 -4.72 115.64 114.58 3dgg s THR 122 Ca 0.52 0.86 -0.03 0.00 0.31 0.00 0.00 61.69 63.36 3dgg s THR 122 Cb -0.10 -3.55 0.04 0.00 0.01 0.00 0.00 72.50 68.90 3dgg s THR 122 CO 0.26 0.13 0.17 -0.89 -0.69 0.00 0.00 174.62 173.60 3dgg s THR 123 N 0.08 -0.06 0.66 -0.82 2.01 0.83 -4.92 115.64 113.42 3dgg s THR 123 Ca 0.57 0.18 -0.13 0.00 0.31 0.00 0.00 61.69 62.63 3dgg s THR 123 Cb -0.38 -0.28 -0.00 0.00 0.01 0.00 0.00 72.50 71.85 3dgg s THR 123 CO 0.40 0.08 1.07 -2.16 -0.69 0.00 0.00 174.62 173.31 3dgg s PRO 124 N 1.26 2.98 0.51 4.92 0.04 -1.26 -0.75 135.00 142.70 3dgg s PRO 124 Ca -0.09 1.12 -0.18 0.00 0.04 0.00 0.00 61.00 61.90 3dgg s PRO 124 Cb -0.11 -1.99 -0.08 0.00 0.04 0.00 0.00 34.50 32.36 3dgg s PRO 124 CO -0.07 -1.07 0.99 -1.25 0.04 0.00 0.00 177.00 175.65 3dgg s PRO 125 N -4.56 3.89 -0.20 0.56 0.04 -1.26 -4.29 135.00 129.17 3dgg s PRO 125 Ca 0.61 1.07 -0.09 0.00 0.04 0.00 0.00 61.00 62.64 3dgg s PRO 125 Cb -0.16 -2.12 -0.04 0.00 0.04 0.00 0.00 34.50 32.21 3dgg s PRO 125 CO 0.47 -0.32 0.10 -1.12 0.04 0.00 0.00 177.00 176.17 3dgg s SER 126 N -2.73 5.83 -0.20 6.66 0.01 -0.00 -4.91 113.70 118.35 3dgg s SER 126 Ca 0.61 0.10 -0.05 0.00 1.31 0.00 0.00 55.95 57.92 3dgg s SER 126 Cb -0.11 -2.02 -0.02 0.00 0.21 0.00 0.00 66.02 64.07 3dgg s SER 126 CO 0.27 0.14 -0.00 -0.69 0.41 0.00 0.00 173.24 173.37 3dgg s VAL 127 N 0.61 3.92 -0.09 3.43 1.01 -1.26 -0.44 120.40 127.58 3dgg s VAL 127 Ca 0.05 -0.32 0.04 0.00 0.00 0.00 0.00 61.98 61.75 3dgg s VAL 127 Cb -0.13 -2.78 -0.00 0.00 0.00 0.00 0.00 36.38 33.48 3dgg s VAL 127 CO 0.01 0.42 -0.22 -0.31 0.00 0.00 0.00 175.10 175.00 3dgg s TYR 128 N 1.07 2.36 0.18 5.22 1.51 0.34 -4.98 117.35 123.05 3dgg s TYR 128 Ca 0.02 -0.91 -0.30 0.00 -1.01 0.00 0.00 57.07 54.88 3dgg s TYR 128 Cb -0.14 -1.58 -0.07 0.00 -0.11 0.00 0.00 41.96 40.05 3dgg s TYR 128 CO 0.01 -0.36 1.02 -2.14 -1.11 0.00 0.00 175.55 172.98 3dgg s PRO 129 N 0.28 4.69 -0.42 -1.71 0.02 -1.26 -0.73 135.00 135.87 3dgg s PRO 129 Ca -0.15 1.59 -0.07 0.00 0.02 0.00 0.00 61.00 62.39 3dgg s PRO 129 Cb -0.17 -3.30 0.10 0.00 0.02 0.00 0.00 34.50 31.14 3dgg s PRO 129 CO 0.07 0.23 0.24 -0.51 -0.33 0.00 0.00 177.00 176.70 3dgg s LEU 130 N -0.50 5.22 0.26 -5.54 1.43 0.08 -4.91 118.68 114.72 3dgg s LEU 130 Ca 0.46 -1.74 -0.03 0.00 -1.03 0.00 0.00 54.13 51.79 3dgg s LEU 130 Cb -0.27 -1.93 -0.05 0.00 0.03 0.00 0.00 46.19 43.98 3dgg s LEU 130 CO 0.33 -0.56 0.50 0.00 0.23 0.00 0.00 176.35 176.85 3dgg s ALA 131 N 1.31 3.70 0.00 4.21 0.00 -1.26 -0.75 121.76 128.97 3dgg s ALA 131 Ca 0.05 -0.67 0.00 0.00 0.00 0.00 0.00 51.96 51.33 3dgg s ALA 131 Cb -0.23 -2.18 0.00 0.00 0.00 0.00 0.00 23.12 20.70 3dgg s ALA 131 CO -0.01 0.29 0.00 -2.30 0.00 0.00 0.00 175.76 173.74 3dgg n PRO 132 N -0.91 0.82 -0.38 0.00 -0.02 -1.26 -4.98 135.00 128.28 3dgg n PRO 132 Ca -0.03 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.45 3dgg n PRO 132 Cb 0.54 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.02 3dgg n PRO 132 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3dgg n SER 140 N 0.00 -2.28 -4.96 2.55 2.88 -1.26 -4.76 113.62 105.79 3dgg n SER 140 Ca 0.00 0.39 -0.23 0.00 -1.33 0.00 0.00 58.87 57.70 3dgg n SER 140 Cb 0.00 -0.42 -0.02 0.00 -0.75 0.00 0.00 64.21 63.01 3dgg n SER 140 CO 0.00 0.00 0.00 -0.04 -1.23 0.00 0.00 175.04 173.77 3dgg s MET 141 N -4.71 3.45 -0.07 -1.46 1.00 -1.26 -0.72 119.30 115.52 3dgg s MET 141 Ca 0.00 -0.65 0.04 0.00 0.00 0.00 0.00 55.69 55.08 3dgg s MET 141 Cb 0.00 -2.90 -0.00 0.00 0.00 0.00 0.00 34.83 31.93 3dgg s MET 141 CO 0.00 0.44 -0.20 0.54 0.00 0.00 0.00 175.02 175.80 3dgg s VAL 142 N -1.92 1.74 -0.21 -6.03 0.11 0.27 -4.68 120.40 109.68 3dgg s VAL 142 Ca 0.35 -0.86 -0.09 0.00 -2.93 0.00 0.00 61.98 58.45 3dgg s VAL 142 Cb -0.10 -1.50 -0.04 0.00 -1.53 0.00 0.00 36.38 33.21 3dgg s VAL 142 CO 0.29 0.49 0.11 -0.89 -3.33 0.00 0.00 175.10 171.77 3dgg s THR 143 N 0.19 5.06 0.29 5.04 2.01 -1.26 -0.54 115.64 126.42 3dgg s THR 143 Ca -0.10 0.07 0.10 0.00 0.31 0.00 0.00 61.69 62.06 3dgg s THR 143 Cb -0.15 -3.32 -0.05 0.00 0.01 0.00 0.00 72.50 68.99 3dgg s THR 143 CO 0.05 0.40 -0.01 -0.76 -0.69 0.00 0.00 174.62 173.61 3dgg s LEU 144 N 0.76 3.07 0.23 4.42 1.43 0.75 -4.65 118.68 124.69 3dgg s LEU 144 Ca 0.06 -0.79 0.02 0.00 -1.03 0.00 0.00 54.13 52.39 3dgg s LEU 144 Cb -0.13 -1.55 -0.05 0.00 0.03 0.00 0.00 46.19 44.49 3dgg s LEU 144 CO 0.02 -0.07 0.06 -0.83 0.23 0.00 0.00 176.35 175.75 3dgg s GLY 145 N -3.68 1.57 -0.17 -3.19 0.00 0.07 -1.09 107.32 100.83 3dgg s GLY 145 Ca 0.33 -1.78 -0.06 0.00 0.00 0.00 0.00 44.72 43.21 3dgg s GLY 145 CO 0.19 -1.59 0.35 0.00 0.00 0.00 0.00 173.10 172.05 3dgg s LEU 147 N 2.52 3.62 -0.38 0.00 2.96 0.09 -1.23 118.68 126.25 3dgg s LEU 147 Ca 0.00 -0.10 -0.03 0.00 -0.22 0.00 0.00 54.13 53.79 3dgg s LEU 147 Cb -0.12 -1.96 0.09 0.00 0.50 0.00 0.00 46.19 44.70 3dgg s LEU 147 CO -0.11 0.03 0.16 -0.69 -1.32 0.00 0.00 176.35 174.42 3dgg s VAL 148 N 1.26 3.27 -0.04 1.68 1.01 0.12 -0.50 120.40 127.19 3dgg s VAL 148 Ca 0.05 -1.88 0.04 0.00 0.00 0.00 0.00 61.98 60.19 3dgg s VAL 148 Cb -0.14 -3.16 -0.03 0.00 0.00 0.00 0.00 36.38 33.05 3dgg s VAL 148 CO 0.04 -0.56 -0.14 -0.75 0.00 0.00 0.00 175.10 173.69 3dgg s LYS 149 N 1.18 2.49 -0.74 2.72 2.20 0.42 -1.59 119.74 126.42 3dgg s LYS 149 Ca 0.05 -0.71 -0.00 0.00 -0.36 0.00 0.00 55.97 54.95 3dgg s LYS 149 Cb -0.22 -2.38 -0.00 0.00 -1.51 0.00 0.00 37.83 33.72 3dgg s LYS 149 CO -0.03 0.62 0.62 0.41 -0.36 0.00 0.00 175.35 176.60 3dgg n GLY 150 N 2.25 -0.09 3.58 5.54 0.00 -0.15 -0.82 105.19 115.49 3dgg n GLY 150 Ca -0.17 -0.09 -0.24 0.00 0.00 0.00 0.00 46.02 45.52 3dgg n GLY 150 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3dgg s TYR 151 N -3.22 2.50 -0.27 1.61 1.13 -0.82 -4.42 117.35 113.85 3dgg s TYR 151 Ca 0.03 -0.33 -0.24 0.00 -1.41 0.00 0.00 57.07 55.12 3dgg s TYR 151 Cb -0.00 -1.22 0.08 0.00 -1.10 0.00 0.00 41.96 39.72 3dgg s TYR 151 CO 0.45 0.61 0.78 0.12 -2.51 0.00 0.00 175.55 175.00 3dgg s PHE 152 N -2.46 -0.76 0.03 -3.49 5.36 0.07 -0.49 117.98 116.25 3dgg s PHE 152 Ca 0.32 1.80 -0.00 0.00 -0.96 0.00 0.00 56.93 58.08 3dgg s PHE 152 Cb -0.04 0.33 0.01 0.00 -0.34 0.00 0.00 43.02 42.98 3dgg s PHE 152 CO 0.18 -0.37 0.04 -0.35 -1.46 0.00 0.00 175.22 173.26 3dgg n PRO 153 N 2.82 0.39 -1.25 10.12 -0.04 -1.26 -0.12 135.00 145.66 3dgg n PRO 153 Ca -0.15 -0.09 -0.32 0.00 -0.04 0.00 0.00 63.50 62.90 3dgg n PRO 153 Cb 0.56 -0.03 0.10 0.00 -0.04 0.00 0.00 33.50 34.09 3dgg n PRO 153 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 3dgg s GLU 154 N -2.68 2.02 0.38 0.54 0.41 -1.26 -4.73 118.70 113.39 3dgg s GLU 154 Ca 0.03 1.43 0.07 0.00 -0.41 0.00 0.00 54.97 56.09 3dgg s GLU 154 Cb -0.00 -1.85 -0.00 0.00 -1.78 0.00 0.00 34.13 30.50 3dgg s GLU 154 CO 0.02 -1.86 0.50 -1.25 -0.49 0.00 0.00 175.26 172.18 3dgg s PRO 155 N -4.48 2.91 0.28 0.39 0.04 -1.26 -4.94 135.00 127.93 3dgg s PRO 155 Ca 0.66 -1.18 0.10 0.00 0.04 0.00 0.00 61.00 60.62 3dgg s PRO 155 Cb -0.22 -2.74 -0.05 0.00 0.04 0.00 0.00 34.50 31.54 3dgg s PRO 155 CO 0.51 -0.12 -0.05 0.54 0.04 0.00 0.00 177.00 177.93 3dgg s VAL 156 N -2.29 3.10 -0.14 -0.36 0.11 -1.26 -4.50 120.40 115.06 3dgg s VAL 156 Ca 0.50 -2.04 -0.00 0.00 -2.93 0.00 0.00 61.98 57.51 3dgg s VAL 156 Cb -0.09 -2.71 0.03 0.00 -1.53 0.00 0.00 36.38 32.08 3dgg s VAL 156 CO 0.32 -0.36 -0.07 -0.89 -3.33 0.00 0.00 175.10 170.77 3dgg s THR 157 N -2.40 1.12 -0.11 5.04 2.01 0.01 -4.97 115.64 116.33 3dgg s THR 157 Ca 0.32 -0.48 -0.01 0.00 0.31 0.00 0.00 61.69 61.82 3dgg s THR 157 Cb -0.05 -1.20 -0.03 0.00 0.01 0.00 0.00 72.50 71.23 3dgg s THR 157 CO 0.19 0.26 -0.06 -0.69 -0.69 0.00 0.00 174.62 173.63 3dgg s VAL 158 N 1.65 3.77 0.22 3.82 1.01 -1.26 -0.69 120.40 128.93 3dgg s VAL 158 Ca 0.03 -0.43 0.01 0.00 0.00 0.00 0.00 61.98 61.59 3dgg s VAL 158 Cb -0.14 -2.60 -0.05 0.00 0.00 0.00 0.00 36.38 33.60 3dgg s VAL 158 CO -0.08 0.55 0.08 0.28 0.00 0.00 0.00 175.10 175.92 3dgg s THR 159 N -0.18 0.46 -0.08 3.92 -1.32 0.15 -4.97 115.64 113.62 3dgg s THR 159 Ca 0.03 -1.99 0.03 0.00 -1.21 0.00 0.00 61.69 58.54 3dgg s THR 159 Cb -0.13 -2.45 0.01 0.00 -1.51 0.00 0.00 72.50 68.42 3dgg s THR 159 CO 0.03 -0.15 -0.15 0.26 -2.21 0.00 0.00 174.62 172.40 3dgg s TRP 160 N -3.82 1.79 -1.25 9.09 0.52 -1.26 0.05 118.94 124.06 3dgg s TRP 160 Ca 0.34 -0.71 -0.09 0.00 0.02 0.00 0.00 56.10 55.66 3dgg s TRP 160 Cb 0.07 -1.27 0.07 0.00 -1.15 0.00 0.00 33.47 31.19 3dgg s TRP 160 CO 0.10 -0.34 0.45 0.09 0.02 0.00 0.00 176.95 177.27 3dgg n ASN 161 N 3.80 -3.66 -3.66 2.95 5.03 -0.52 -0.92 115.26 118.30 3dgg n ASN 161 Ca -0.21 -0.34 -0.24 0.00 0.87 0.00 0.00 54.58 54.66 3dgg n ASN 161 Cb 0.52 -3.04 0.04 0.00 -1.02 0.00 0.00 39.78 36.27 3dgg n ASN 161 CO 0.00 0.00 0.00 -1.20 -1.83 0.00 0.00 177.26 174.23 3dgg n SER 162 N -2.24 -3.08 0.00 6.41 7.64 -1.26 -3.11 113.62 117.98 3dgg n SER 162 Ca -0.02 -0.88 0.00 0.00 1.01 0.00 0.00 58.87 58.98 3dgg n SER 162 Cb 0.54 -3.92 0.00 0.00 -1.01 0.00 0.00 64.21 59.83 3dgg n SER 162 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3dgg n GLY 163 N -1.60 1.67 0.25 0.23 0.00 -0.09 -4.92 105.19 100.73 3dgg n GLY 163 Ca -0.21 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 45.81 3dgg n GLY 163 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3dgg h SER 164 N 0.00 0.38 -0.66 1.61 0.02 -1.39 -2.94 113.55 110.57 3dgg h SER 164 Ca 0.00 -0.09 0.00 0.00 -0.84 0.00 0.00 61.79 60.86 3dgg h SER 164 Cb 0.00 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 62.44 3dgg h SER 164 CO 0.00 0.54 0.00 0.18 -1.14 0.00 0.00 176.83 176.41 3dgg n LEU 165 N -4.22 3.99 -0.55 5.07 4.77 -1.19 -4.68 117.00 120.19 3dgg n LEU 165 Ca 0.00 -2.00 0.43 0.00 -0.03 0.00 0.00 56.01 54.41 3dgg n LEU 165 Cb 0.30 -0.50 0.69 0.00 -2.33 0.00 0.00 43.42 41.58 3dgg n LEU 165 CO 0.39 0.87 1.24 -0.24 -1.33 0.00 0.00 177.39 178.32 3dgg n SER 166 N 1.36 0.08 0.05 -1.43 2.88 -1.11 -2.79 113.62 112.65 3dgg n SER 166 Ca 0.24 1.04 -0.09 0.00 -1.33 0.00 0.00 58.87 58.73 3dgg n SER 166 Cb 0.68 -0.52 -0.06 0.00 -0.75 0.00 0.00 64.21 63.56 3dgg n SER 166 CO 0.00 0.00 0.00 -1.28 -1.23 0.00 0.00 175.04 172.53 3dgg h SER 167 N 0.00 -0.93 -0.81 -3.46 0.87 -1.88 -3.19 113.55 104.15 3dgg h SER 167 Ca 0.83 0.10 -0.51 0.00 -1.23 0.00 0.00 61.79 60.98 3dgg h SER 167 Cb 3.06 0.35 -0.24 0.00 -0.44 0.00 0.00 62.40 65.13 3dgg h SER 167 CO -0.18 -0.31 0.66 0.61 -0.53 0.00 0.00 176.83 177.08 3dgg n GLY 168 N -1.27 4.88 3.68 5.77 0.00 -1.12 -4.96 105.19 112.17 3dgg n GLY 168 Ca -0.04 -1.58 -0.35 0.00 0.00 0.00 0.00 46.02 44.04 3dgg n GLY 168 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3dgg s VAL 169 N -3.55 4.43 -0.23 1.61 1.01 -1.21 -1.77 120.40 120.69 3dgg s VAL 169 Ca 0.51 -0.19 -0.00 0.00 0.00 0.00 0.00 61.98 62.29 3dgg s VAL 169 Cb 0.41 -2.89 0.06 0.00 0.00 0.00 0.00 36.38 33.96 3dgg s VAL 169 CO 0.02 0.58 -0.02 -1.00 0.00 0.00 0.00 175.10 174.68 3dgg s HIS 170 N -0.65 2.07 -0.31 5.22 3.76 -0.36 -5.00 115.29 120.03 3dgg s HIS 170 Ca 0.11 -1.58 -0.10 0.00 -0.15 0.00 0.00 55.06 53.34 3dgg s HIS 170 Cb -0.12 -1.49 -0.01 0.00 1.11 0.00 0.00 32.58 32.07 3dgg s HIS 170 CO 0.02 -0.75 0.15 0.99 -0.85 0.00 0.00 174.74 174.31 3dgg s THR 171 N 1.50 4.62 0.42 1.30 2.01 -1.26 -0.62 115.64 123.61 3dgg s THR 171 Ca -0.03 -0.42 -0.12 0.00 0.31 0.00 0.00 61.69 61.43 3dgg s THR 171 Cb -0.18 -3.36 -0.07 0.00 0.01 0.00 0.00 72.50 68.90 3dgg s THR 171 CO -0.08 0.06 0.81 -0.36 -0.69 0.00 0.00 174.62 174.37 3dgg s PHE 172 N 1.62 3.46 0.44 4.92 0.08 -0.73 -5.01 117.98 122.75 3dgg s PHE 172 Ca 0.05 1.15 -0.25 0.00 0.12 0.00 0.00 56.93 57.99 3dgg s PHE 172 Cb -0.17 -2.52 -0.08 0.00 -0.57 0.00 0.00 43.02 39.67 3dgg s PHE 172 CO 0.06 -0.15 1.39 -2.14 -0.10 0.00 0.00 175.22 174.28 3dgg s PRO 173 N -3.85 3.76 0.40 0.24 0.02 -1.26 -4.55 135.00 129.76 3dgg s PRO 173 Ca 0.53 2.35 -0.26 0.00 0.02 0.00 0.00 61.00 63.64 3dgg s PRO 173 Cb -0.10 -2.68 -0.09 0.00 0.02 0.00 0.00 34.50 31.65 3dgg s PRO 173 CO 0.31 -0.73 1.27 0.00 -0.33 0.00 0.00 177.00 177.51 3dgg s ALA 174 N -1.22 3.23 -0.12 -1.55 0.00 -1.26 -4.82 121.76 116.01 3dgg s ALA 174 Ca 0.60 1.17 0.01 0.00 0.00 0.00 0.00 51.96 53.74 3dgg s ALA 174 Cb -0.42 -3.46 -0.01 0.00 0.00 0.00 0.00 23.12 19.22 3dgg s ALA 174 CO 0.54 -0.76 -0.16 0.08 0.00 0.00 0.00 175.76 175.47 3dgg s VAL 175 N -1.29 2.82 -0.13 0.00 1.01 -0.59 -4.92 120.40 117.29 3dgg s VAL 175 Ca 0.57 -0.75 -0.23 0.00 0.00 0.00 0.00 61.98 61.57 3dgg s VAL 175 Cb -0.36 -2.16 -0.03 0.00 0.00 0.00 0.00 36.38 33.83 3dgg s VAL 175 CO 0.46 0.53 0.71 -0.22 0.00 0.00 0.00 175.10 176.59 3dgg s LEU 176 N 0.37 4.23 -0.05 3.92 2.96 -1.26 -1.94 118.68 126.91 3dgg s LEU 176 Ca -0.12 1.08 -0.02 0.00 -0.22 0.00 0.00 54.13 54.85 3dgg s LEU 176 Cb -0.16 -3.06 0.04 0.00 0.50 0.00 0.00 46.19 43.50 3dgg s LEU 176 CO 0.06 -0.23 0.11 -1.58 -1.32 0.00 0.00 176.35 173.38 3dgg s GLN 177 N 1.47 0.04 -1.43 1.98 2.00 0.69 -4.90 119.66 119.51 3dgg s GLN 177 Ca 0.35 0.33 -0.05 0.00 -2.00 0.00 0.00 55.36 53.99 3dgg s GLN 177 Cb -0.17 -0.22 0.04 0.00 0.80 0.00 0.00 33.01 33.46 3dgg s GLN 177 CO 0.14 -0.18 0.71 0.43 -0.50 0.00 0.00 175.29 175.89 3dgg n SER 178 N 4.33 -2.12 -2.43 6.67 7.64 -1.26 -1.16 113.62 125.29 3dgg n SER 178 Ca -0.24 -0.87 -0.21 0.00 1.01 0.00 0.00 58.87 58.55 3dgg n SER 178 Cb 0.51 -3.63 -0.01 0.00 -1.01 0.00 0.00 64.21 60.07 3dgg n SER 178 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 3dgg n ASP 179 N -2.94 -5.95 -3.82 6.43 8.00 -1.26 -4.99 116.55 112.02 3dgg n ASP 179 Ca -0.18 -0.04 -0.12 0.00 0.71 0.00 0.00 54.79 55.16 3dgg n ASP 179 Cb 0.62 -4.94 -0.12 0.00 -0.02 0.00 0.00 41.12 36.66 3dgg n ASP 179 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3dgg s LEU 180 N -6.06 1.32 0.17 0.64 1.43 -0.31 -4.85 118.68 111.01 3dgg s LEU 180 Ca 0.02 0.30 -0.08 0.00 -1.03 0.00 0.00 54.13 53.34 3dgg s LEU 180 Cb -0.01 0.65 -0.06 0.00 0.03 0.00 0.00 46.19 46.80 3dgg s LEU 180 CO 0.02 -0.11 0.46 -0.31 0.23 0.00 0.00 176.35 176.64 3dgg s TYR 181 N -0.11 3.48 -0.01 0.29 2.02 0.36 -0.22 117.35 123.16 3dgg s TYR 181 Ca -0.02 0.75 0.00 0.00 -0.37 0.00 0.00 57.07 57.43 3dgg s TYR 181 Cb -0.02 -2.15 0.02 0.00 -0.40 0.00 0.00 41.96 39.40 3dgg s TYR 181 CO 0.00 0.38 0.00 0.99 -1.57 0.00 0.00 175.55 175.36 3dgg s THR 182 N -1.66 0.08 0.18 -0.71 2.01 -0.82 -0.98 115.64 113.75 3dgg s THR 182 Ca 0.42 0.06 -0.02 0.00 0.31 0.00 0.00 61.69 62.46 3dgg s THR 182 Cb -0.12 -0.14 -0.04 0.00 0.01 0.00 0.00 72.50 72.21 3dgg s THR 182 CO 0.22 0.08 0.13 -1.48 -0.69 0.00 0.00 174.62 172.88 3dgg s LEU 183 N 0.57 1.26 0.12 4.42 0.05 -0.62 -1.53 118.68 122.94 3dgg s LEU 183 Ca -0.05 -1.31 0.03 0.00 0.05 0.00 0.00 54.13 52.85 3dgg s LEU 183 Cb -0.08 0.45 -0.04 0.00 -2.05 0.00 0.00 46.19 44.47 3dgg s LEU 183 CO -0.01 -0.83 -0.07 -0.94 -0.55 0.00 0.00 176.35 173.95 3dgg s SER 184 N -3.12 1.35 -0.02 1.48 1.04 -1.26 -0.70 113.70 112.46 3dgg s SER 184 Ca 0.34 -1.02 0.00 0.00 0.48 0.00 0.00 55.95 55.75 3dgg s SER 184 Cb 0.07 0.06 0.02 0.00 0.10 0.00 0.00 66.02 66.27 3dgg s SER 184 CO 0.09 -0.43 0.01 -0.55 0.98 0.00 0.00 173.24 173.33 3dgg s SER 185 N -3.10 0.24 0.04 7.02 0.15 -0.37 -1.78 113.70 115.91 3dgg s SER 185 Ca 0.14 -0.00 0.03 0.00 0.70 0.00 0.00 55.95 56.83 3dgg s SER 185 Cb 0.05 -0.13 -0.04 0.00 -1.71 0.00 0.00 66.02 64.19 3dgg s SER 185 CO -0.02 -0.09 -0.02 -0.94 1.20 0.00 0.00 173.24 173.37 3dgg s SER 186 N 0.86 4.93 -0.03 5.45 1.04 0.20 -1.48 113.70 124.68 3dgg s SER 186 Ca -0.08 -0.12 0.02 0.00 0.48 0.00 0.00 55.95 56.25 3dgg s SER 186 Cb -0.11 -1.20 0.01 0.00 0.10 0.00 0.00 66.02 64.82 3dgg s SER 186 CO -0.02 0.24 -0.07 0.54 0.98 0.00 0.00 173.24 174.91 3dgg s VAL 187 N -1.15 0.62 -0.16 5.02 0.11 -0.25 -1.22 120.40 123.37 3dgg s VAL 187 Ca 0.21 -0.24 -0.02 0.00 -2.93 0.00 0.00 61.98 59.01 3dgg s VAL 187 Cb -0.11 -0.58 -0.01 0.00 -1.53 0.00 0.00 36.38 34.14 3dgg s VAL 187 CO 0.13 0.22 -0.10 -0.89 -3.33 0.00 0.00 175.10 171.13 3dgg s THR 188 N 0.43 3.25 0.07 5.04 2.01 -0.73 -0.18 115.64 125.53 3dgg s THR 188 Ca -0.06 -0.58 0.01 0.00 0.31 0.00 0.00 61.69 61.37 3dgg s THR 188 Cb -0.10 -2.40 -0.04 0.00 0.01 0.00 0.00 72.50 69.97 3dgg s THR 188 CO 0.00 0.50 -0.05 0.68 -0.69 0.00 0.00 174.62 175.06 3dgg s VAL 189 N 0.62 0.47 0.37 3.82 -7.23 0.30 -4.52 120.40 114.24 3dgg s VAL 189 Ca -0.06 -1.74 -0.28 0.00 -1.81 0.00 0.00 61.98 58.09 3dgg s VAL 189 Cb -0.15 -1.43 -0.11 0.00 0.56 0.00 0.00 36.38 35.25 3dgg s VAL 189 CO 0.03 -0.85 1.50 -2.84 -0.31 0.00 0.00 175.10 172.63 3dgg s PRO 190 N -3.50 4.10 0.35 4.82 0.02 -1.26 0.95 135.00 140.48 3dgg s PRO 190 Ca 0.06 2.58 0.25 0.00 0.02 0.00 0.00 61.00 63.91 3dgg s PRO 190 Cb 0.04 -2.97 1.28 0.00 0.02 0.00 0.00 34.50 32.87 3dgg s PRO 190 CO -0.06 -0.55 1.75 0.77 -0.33 0.00 0.00 177.00 178.58 3dgg h SER 191 N 3.12 0.00 0.47 2.53 0.02 -1.20 0.13 113.55 118.63 3dgg h SER 191 Ca -0.51 0.00 -0.20 0.00 -0.84 0.00 0.00 61.79 60.24 3dgg h SER 191 Cb 1.24 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.77 3dgg h SER 191 CO 0.65 0.00 -0.86 0.77 -1.14 0.00 0.00 176.83 176.25 3dgg h SER 192 N 0.00 0.35 0.99 3.07 4.64 -1.90 -3.33 113.55 117.37 3dgg h SER 192 Ca 0.00 -0.27 -0.12 0.00 -0.47 0.00 0.00 61.79 60.93 3dgg h SER 192 Cb 0.07 -0.11 -0.02 0.00 -0.31 0.00 0.00 62.40 62.04 3dgg h SER 192 CO 0.00 1.06 -0.58 0.71 -0.87 0.00 0.00 176.83 177.15 3dgg h THR 193 N 0.16 1.16 -3.93 2.95 1.35 -1.33 -3.40 112.91 109.87 3dgg h THR 193 Ca -0.05 -2.19 -0.51 0.00 -0.55 0.00 0.00 66.41 63.11 3dgg h THR 193 Cb 1.48 2.27 -0.31 0.00 -1.73 0.00 0.00 68.15 69.86 3dgg h THR 193 CO 0.14 0.57 -0.82 0.86 -0.25 0.00 0.00 175.52 176.02 3dgg s TRP 194 N -3.27 1.41 -0.91 4.73 -0.00 -1.18 -0.69 118.94 119.02 3dgg s TRP 194 Ca 0.01 -0.37 0.10 0.00 -0.00 0.00 0.00 56.10 55.84 3dgg s TRP 194 Cb 0.10 -0.96 0.47 0.00 -0.00 0.00 0.00 33.47 33.08 3dgg s TRP 194 CO 0.74 -0.12 1.27 -0.35 -0.00 0.00 0.00 176.95 178.49 3dgg n PRO 195 N 3.12 3.01 -0.02 5.86 -0.04 -1.26 -4.72 135.00 140.95 3dgg n PRO 195 Ca -0.18 -1.81 0.02 0.00 -0.04 0.00 0.00 63.50 61.50 3dgg n PRO 195 Cb 0.54 -1.81 0.37 0.00 -0.04 0.00 0.00 33.50 32.56 3dgg n PRO 195 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 3dgg h SER 196 N 2.43 0.52 -3.92 3.54 4.64 -1.77 -3.41 113.55 115.58 3dgg h SER 196 Ca 0.00 -0.04 -0.69 0.00 -0.47 0.00 0.00 61.79 60.59 3dgg h SER 196 Cb 1.19 -0.13 -0.22 0.00 -0.31 0.00 0.00 62.40 62.93 3dgg h SER 196 CO 0.22 0.44 -0.85 -1.61 -0.87 0.00 0.00 176.83 174.17 3dgg s GLU 197 N -5.36 1.63 -0.10 4.77 2.02 0.14 -5.11 118.70 116.69 3dgg s GLU 197 Ca -0.08 -1.23 -0.30 0.00 0.02 0.00 0.00 54.97 53.38 3dgg s GLU 197 Cb 0.17 -2.00 -0.01 0.00 0.10 0.00 0.00 34.13 32.38 3dgg s GLU 197 CO 0.75 0.48 1.02 0.95 0.02 0.00 0.00 175.26 178.47 3dgg s THR 198 N -1.04 4.74 -0.04 3.63 -4.23 -1.26 -4.53 115.64 112.92 3dgg s THR 198 Ca 0.15 2.01 -0.01 0.00 -1.18 0.00 0.00 61.69 62.65 3dgg s THR 198 Cb -0.10 -4.29 -0.04 0.00 1.34 0.00 0.00 72.50 69.41 3dgg s THR 198 CO 0.07 0.01 0.07 -0.69 -0.54 0.00 0.00 174.62 173.53 3dgg s VAL 199 N 2.00 4.70 -0.19 2.29 1.01 -1.26 -4.98 120.40 123.97 3dgg s VAL 199 Ca 0.49 -0.30 -0.10 0.00 0.00 0.00 0.00 61.98 62.07 3dgg s VAL 199 Cb -0.19 -3.09 0.07 0.00 0.00 0.00 0.00 36.38 33.17 3dgg s VAL 199 CO 0.19 0.45 0.45 0.28 0.00 0.00 0.00 175.10 176.46 3dgg s THR 200 N -1.09 -0.10 -0.03 3.92 -1.32 -1.26 -0.74 115.64 115.01 3dgg s THR 200 Ca 0.19 0.09 -0.18 0.00 -1.21 0.00 0.00 61.69 60.58 3dgg s THR 200 Cb -0.12 -0.67 -0.05 0.00 -1.51 0.00 0.00 72.50 70.15 3dgg s THR 200 CO 0.10 0.04 0.49 0.00 -2.21 0.00 0.00 174.62 173.04 3dgg s ASN 202 N -0.31 4.17 -0.11 0.00 0.01 0.11 -1.94 114.94 116.86 3dgg s ASN 202 Ca 0.27 -0.37 0.02 0.00 -0.71 0.00 0.00 52.86 52.07 3dgg s ASN 202 Cb -0.17 -1.68 0.01 0.00 0.41 0.00 0.00 41.25 39.82 3dgg s ASN 202 CO 0.14 0.05 -0.18 -0.69 -1.51 0.00 0.00 177.10 174.91 3dgg s VAL 203 N 1.04 1.72 -0.13 1.60 1.01 -0.17 -0.67 120.40 124.80 3dgg s VAL 203 Ca 0.00 -0.78 0.01 0.00 0.00 0.00 0.00 61.98 61.21 3dgg s VAL 203 Cb -0.15 -1.54 -0.01 0.00 0.00 0.00 0.00 36.38 34.69 3dgg s VAL 203 CO -0.01 0.48 -0.15 0.00 0.00 0.00 0.00 175.10 175.42 3dgg s ALA 204 N 0.84 2.52 -0.47 5.51 0.00 0.14 -1.33 121.76 128.97 3dgg s ALA 204 Ca -0.09 -0.92 0.03 0.00 0.00 0.00 0.00 51.96 50.98 3dgg s ALA 204 Cb -0.15 -1.13 0.13 0.00 0.00 0.00 0.00 23.12 21.96 3dgg s ALA 204 CO -0.00 0.23 0.24 -1.58 0.00 0.00 0.00 175.76 174.65 3dgg s HIS 205 N 0.39 2.49 0.46 0.00 2.46 -0.07 -0.81 115.29 120.20 3dgg s HIS 205 Ca -0.12 -2.74 0.12 0.00 0.47 0.00 0.00 55.06 52.80 3dgg s HIS 205 Cb -0.16 -2.28 1.05 0.00 -0.13 0.00 0.00 32.58 31.05 3dgg s HIS 205 CO 0.06 -0.77 2.07 -1.00 -2.47 0.00 0.00 174.74 172.63 3dgg h PRO 206 N 6.66 0.32 0.00 2.88 0.13 -1.80 -1.45 132.00 138.73 3dgg h PRO 206 Ca -0.04 -0.02 -0.01 0.00 -0.87 0.00 0.00 66.00 65.06 3dgg h PRO 206 Cb 0.91 -0.07 -0.00 0.00 0.13 0.00 0.00 31.00 31.97 3dgg h PRO 206 CO 0.57 0.21 -0.04 0.00 -0.23 0.00 0.00 178.00 178.51 3dgg h ALA 207 N 1.81 1.79 -0.31 -0.56 0.00 -1.93 -1.47 119.26 118.59 3dgg h ALA 207 Ca 0.14 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.01 3dgg h ALA 207 Cb 0.14 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.93 3dgg h ALA 207 CO -0.03 0.05 0.00 -1.13 0.00 0.00 0.00 179.25 178.14 3dgg n SER 208 N -4.28 2.94 -3.74 0.00 3.41 -0.93 -5.00 113.62 106.01 3dgg n SER 208 Ca -0.03 -2.11 -0.25 0.00 -0.26 0.00 0.00 58.87 56.22 3dgg n SER 208 Cb 0.12 -0.24 0.02 0.00 -0.26 0.00 0.00 64.21 63.85 3dgg n SER 208 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 3dgg n SER 209 N 0.31 -2.47 -4.31 4.04 7.64 -0.55 -4.97 113.62 113.30 3dgg n SER 209 Ca 0.12 -0.93 -0.34 0.00 1.01 0.00 0.00 58.87 58.72 3dgg n SER 209 Cb 0.46 -3.63 -0.14 0.00 -1.01 0.00 0.00 64.21 59.89 3dgg n SER 209 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 3dgg s THR 210 N -3.68 3.22 -0.27 0.44 2.01 -0.61 -5.00 115.64 111.76 3dgg s THR 210 Ca 0.17 -0.56 0.01 0.00 0.31 0.00 0.00 61.69 61.62 3dgg s THR 210 Cb -0.06 -2.44 0.08 0.00 0.01 0.00 0.00 72.50 70.10 3dgg s THR 210 CO 0.85 0.46 0.02 -0.54 -0.69 0.00 0.00 174.62 174.71 3dgg s LYS 211 N 1.19 1.21 -0.06 4.92 1.02 -1.26 -0.90 119.74 125.86 3dgg s LYS 211 Ca 0.02 -1.13 0.05 0.00 0.02 0.00 0.00 55.97 54.94 3dgg s LYS 211 Cb -0.14 -2.47 -0.01 0.00 -0.52 0.00 0.00 37.83 34.70 3dgg s LYS 211 CO -0.02 -0.79 -0.22 0.14 -0.92 0.00 0.00 175.35 173.54 3dgg s VAL 212 N 1.42 1.83 -0.13 3.17 -7.23 -0.44 -4.99 120.40 114.03 3dgg s VAL 212 Ca 0.03 -0.93 -0.01 0.00 -1.81 0.00 0.00 61.98 59.26 3dgg s VAL 212 Cb -0.18 -1.56 -0.02 0.00 0.56 0.00 0.00 36.38 35.17 3dgg s VAL 212 CO -0.13 0.51 -0.09 -1.81 -0.31 0.00 0.00 175.10 173.28 3dgg s ASP 213 N 0.03 4.41 -0.18 4.85 1.01 -1.26 -0.99 116.67 124.53 3dgg s ASP 213 Ca -0.07 -0.21 0.00 0.00 0.71 0.00 0.00 52.55 52.99 3dgg s ASP 213 Cb -0.14 -1.61 0.04 0.00 1.01 0.00 0.00 42.92 42.22 3dgg s ASP 213 CO 0.04 0.19 -0.09 -0.54 0.21 0.00 0.00 175.17 174.99 3dgg s LYS 214 N 0.19 1.85 0.14 8.23 -0.14 -0.82 -5.01 119.74 124.18 3dgg s LYS 214 Ca -0.05 -0.67 -0.30 0.00 -1.36 0.00 0.00 55.97 53.59 3dgg s LYS 214 Cb -0.14 -2.20 -0.07 0.00 -1.68 0.00 0.00 37.83 33.74 3dgg s LYS 214 CO 0.04 -0.40 1.02 0.21 -0.76 0.00 0.00 175.35 175.47 3dgg s LYS 215 N 1.50 4.65 -0.62 1.68 2.20 -1.26 -1.93 119.74 125.96 3dgg s LYS 215 Ca 0.01 1.57 -0.25 0.00 -0.36 0.00 0.00 55.97 56.94 3dgg s LYS 215 Cb -0.15 -3.33 0.04 0.00 -1.51 0.00 0.00 37.83 32.88 3dgg s LYS 215 CO -0.08 0.15 1.06 0.42 -0.36 0.00 0.00 175.35 176.54 3dgg s ILE 216 N -0.11 4.17 -0.10 5.43 -1.09 0.08 -4.93 121.20 124.65 3dgg s ILE 216 Ca 0.48 0.24 -0.02 0.00 -2.23 0.00 0.00 60.65 59.13 3dgg s ILE 216 Cb -0.26 -4.69 -0.03 0.00 -1.58 0.00 0.00 42.46 35.90 3dgg s ILE 216 CO 0.32 -1.40 -0.02 -0.69 -1.23 0.00 0.00 174.94 171.92 3dgg s VAL 217 N 4.52 4.08 0.50 2.92 1.01 -1.26 -4.68 120.40 127.50 3dgg s VAL 217 Ca 0.31 -0.32 -0.23 0.00 0.00 0.00 0.00 61.98 61.75 3dgg s VAL 217 Cb -0.12 -2.73 -0.06 0.00 0.00 0.00 0.00 36.38 33.47 3dgg s VAL 217 CO 0.17 0.57 1.29 -2.16 0.00 0.00 0.00 175.10 174.97 3dgg s PRO 218 N -0.52 3.43 0.00 2.72 0.04 -1.26 -4.71 135.00 134.70 3dgg s PRO 218 Ca 0.08 2.07 0.29 0.00 0.04 0.00 0.00 61.00 63.48 3dgg s PRO 218 Cb -0.12 -2.36 1.71 0.00 0.04 0.00 0.00 34.50 33.77 3dgg s PRO 218 CO 0.02 -0.90 2.05 0.54 0.04 0.00 0.00 177.00 178.74