#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dgg s VAL 2 N 0.00 3.48 -0.07 6.31 1.01 -1.26 -4.16 120.40 125.71 3dgg s VAL 2 Ca 0.00 1.18 -0.04 0.00 0.00 0.00 0.00 61.98 63.12 3dgg s VAL 2 Cb 0.00 -3.75 0.03 0.00 0.00 0.00 0.00 36.38 32.66 3dgg s VAL 2 CO 0.00 0.15 0.17 -0.75 0.00 0.00 0.00 175.10 174.67 3dgg s LYS 3 N 0.22 0.14 -0.22 2.72 2.20 -0.17 -5.00 119.74 119.62 3dgg s LYS 3 Ca 0.57 0.36 -0.02 0.00 -0.36 0.00 0.00 55.97 56.52 3dgg s LYS 3 Cb -0.34 -0.10 0.01 0.00 -1.51 0.00 0.00 37.83 35.89 3dgg s LYS 3 CO 0.35 -0.13 -0.08 -0.51 -0.36 0.00 0.00 175.35 174.62 3dgg s LEU 4 N 0.91 2.87 -0.31 5.43 1.43 -1.26 -1.34 118.68 126.40 3dgg s LEU 4 Ca -0.07 -0.62 -0.04 0.00 -1.03 0.00 0.00 54.13 52.37 3dgg s LEU 4 Cb -0.09 -1.66 0.04 0.00 0.03 0.00 0.00 46.19 44.51 3dgg s LEU 4 CO -0.05 -0.06 0.05 -1.58 0.23 0.00 0.00 176.35 174.94 3dgg s GLN 5 N 1.39 2.65 0.44 1.70 2.00 0.28 -4.09 119.66 124.02 3dgg s GLN 5 Ca 0.04 -1.14 -0.05 0.00 -2.00 0.00 0.00 55.36 52.20 3dgg s GLN 5 Cb -0.15 -3.31 -0.04 0.00 0.80 0.00 0.00 33.01 30.31 3dgg s GLN 5 CO -0.06 -0.59 0.74 -0.65 -0.50 0.00 0.00 175.29 174.23 3dgg s GLN 6 N 1.36 3.58 0.81 1.67 -0.21 -1.26 -0.93 119.66 124.67 3dgg s GLN 6 Ca -0.02 0.16 -0.11 0.00 0.02 0.00 0.00 55.36 55.41 3dgg s GLN 6 Cb -0.19 -2.43 0.08 0.00 1.00 0.00 0.00 33.01 31.46 3dgg s GLN 6 CO 0.01 -0.10 1.09 -1.54 -2.12 0.00 0.00 175.29 172.62 3dgg s SER 7 N -3.88 4.25 1.11 5.90 1.04 -0.89 -4.98 113.70 116.25 3dgg s SER 7 Ca 0.47 1.69 -0.17 0.00 0.48 0.00 0.00 55.95 58.42 3dgg s SER 7 Cb -0.10 -2.39 0.24 0.00 0.10 0.00 0.00 66.02 63.87 3dgg s SER 7 CO 0.41 -2.18 1.14 -0.83 0.98 0.00 0.00 173.24 172.76 3dgg s GLY 8 N -3.45 1.60 0.70 7.32 0.00 -1.26 -4.60 107.32 107.64 3dgg s GLY 8 Ca 0.62 -0.84 -0.16 0.00 0.00 0.00 0.00 44.72 44.33 3dgg s GLY 8 CO 0.56 -0.05 1.26 2.56 0.00 0.00 0.00 173.10 177.43 3dgg s PRO 9 N -5.38 2.25 -0.03 2.90 0.04 -1.26 -4.74 135.00 128.78 3dgg s PRO 9 Ca 0.70 1.94 0.02 0.00 0.04 0.00 0.00 61.00 63.69 3dgg s PRO 9 Cb -0.11 -1.83 0.01 0.00 0.04 0.00 0.00 34.50 32.61 3dgg s PRO 9 CO 0.56 -1.79 -0.08 -1.21 0.04 0.00 0.00 177.00 174.52 3dgg s GLU 10 N -3.65 0.85 -0.14 4.56 2.02 -0.36 -4.99 118.70 116.99 3dgg s GLU 10 Ca 0.79 -0.25 0.00 0.00 0.02 0.00 0.00 54.97 55.54 3dgg s GLU 10 Cb -0.34 -0.81 0.02 0.00 0.10 0.00 0.00 34.13 33.11 3dgg s GLU 10 CO 0.43 0.08 -0.14 -1.17 0.02 0.00 0.00 175.26 174.48 3dgg s LEU 11 N 0.28 1.65 0.11 1.80 2.96 -1.26 -0.95 118.68 123.26 3dgg s LEU 11 Ca -0.04 -0.46 0.01 0.00 -0.22 0.00 0.00 54.13 53.42 3dgg s LEU 11 Cb -0.09 -1.14 -0.04 0.00 0.50 0.00 0.00 46.19 45.42 3dgg s LEU 11 CO 0.00 -0.05 -0.03 0.68 -1.32 0.00 0.00 176.35 175.63 3dgg s VAL 12 N 1.44 0.53 0.49 1.68 -7.23 -0.59 -5.01 120.40 111.72 3dgg s VAL 12 Ca 0.03 -1.92 -0.09 0.00 -1.81 0.00 0.00 61.98 58.20 3dgg s VAL 12 Cb -0.13 -1.79 -0.05 0.00 0.56 0.00 0.00 36.38 34.97 3dgg s VAL 12 CO -0.09 -0.76 0.85 -0.54 -0.31 0.00 0.00 175.10 174.24 3dgg s LYS 13 N -3.89 3.64 0.36 4.82 -0.14 -1.26 -2.37 119.74 120.91 3dgg s LYS 13 Ca 0.15 0.44 -0.28 0.00 -1.36 0.00 0.00 55.97 54.92 3dgg s LYS 13 Cb 0.06 -2.30 -0.11 0.00 -1.68 0.00 0.00 37.83 33.80 3dgg s LYS 13 CO -0.03 -0.24 1.49 -2.14 -0.76 0.00 0.00 175.35 173.67 3dgg s PRO 14 N -4.56 4.12 0.00 -1.68 0.02 -1.26 -2.20 135.00 129.45 3dgg s PRO 14 Ca 0.51 2.55 0.00 0.00 0.02 0.00 0.00 61.00 64.08 3dgg s PRO 14 Cb -0.10 -2.98 0.00 0.00 0.02 0.00 0.00 34.50 31.43 3dgg s PRO 14 CO 0.42 -0.53 0.00 0.41 -0.33 0.00 0.00 177.00 176.98 3dgg n GLY 15 N 0.72 3.08 3.60 0.52 0.00 0.47 -4.96 105.19 108.62 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 -2.92 0.59 0.28 4.61 0.00 -0.93 -4.24 121.76 119.14 3dgg s ALA 16 Ca 0.00 -0.69 0.04 0.00 0.00 0.00 0.00 51.96 51.31 3dgg s ALA 16 Cb 0.00 -2.99 -0.06 0.00 0.00 0.00 0.00 23.12 20.07 3dgg s ALA 16 CO 0.00 -3.39 0.01 -1.54 0.00 0.00 0.00 175.76 170.84 3dgg s SER 17 N -3.62 2.26 0.05 0.00 1.04 -1.26 -1.40 113.70 110.77 3dgg s SER 17 Ca 0.69 -1.27 -0.12 0.00 0.48 0.00 0.00 55.95 55.72 3dgg s SER 17 Cb -0.14 -0.07 0.01 0.00 0.10 0.00 0.00 66.02 65.93 3dgg s SER 17 CO 0.57 -0.51 0.27 0.54 0.98 0.00 0.00 173.24 175.09 3dgg s VAL 18 N -3.28 0.09 -0.20 5.02 0.11 -0.28 -5.00 120.40 116.87 3dgg s VAL 18 Ca 0.32 -0.76 -0.00 0.00 -2.93 0.00 0.00 61.98 58.60 3dgg s VAL 18 Cb 0.06 -0.97 0.05 0.00 -1.53 0.00 0.00 36.38 34.00 3dgg s VAL 18 CO 0.12 -0.42 -0.04 -0.75 -3.33 0.00 0.00 175.10 170.68 3dgg s LYS 19 N -2.69 1.40 0.09 1.54 2.20 -1.26 -0.89 119.74 120.13 3dgg s LYS 19 Ca -0.04 -0.69 -0.04 0.00 -0.36 0.00 0.00 55.97 54.83 3dgg s LYS 19 Cb -0.00 -2.26 -0.05 0.00 -1.51 0.00 0.00 37.83 34.00 3dgg s LYS 19 CO -0.04 -0.53 0.32 -1.64 -0.36 0.00 0.00 175.35 173.09 3dgg s MET 20 N 1.57 3.57 0.15 4.03 -1.94 0.13 -4.94 119.30 121.88 3dgg s MET 20 Ca -0.02 -0.16 0.10 0.00 -1.71 0.00 0.00 55.69 53.90 3dgg s MET 20 Cb -0.17 -2.95 -0.04 0.00 2.01 0.00 0.00 34.83 33.68 3dgg s MET 20 CO -0.07 0.54 -0.23 -1.54 -0.01 0.00 0.00 175.02 173.71 3dgg s SER 21 N -2.28 3.12 -0.27 3.03 1.04 -1.26 -1.06 113.70 116.02 3dgg s SER 21 Ca 0.37 -0.80 -0.03 0.00 0.48 0.00 0.00 55.95 55.96 3dgg s SER 21 Cb -0.13 -0.21 0.09 0.00 0.10 0.00 0.00 66.02 65.88 3dgg s SER 21 CO 0.23 0.10 0.11 0.00 0.98 0.00 0.00 173.24 174.67 3dgg s LYS 23 N 1.98 4.26 0.09 0.00 2.20 -0.11 -0.88 119.74 127.29 3dgg s LYS 23 Ca 0.07 0.30 0.04 0.00 -0.36 0.00 0.00 55.97 56.02 3dgg s LYS 23 Cb -0.16 -3.47 -0.04 0.00 -1.51 0.00 0.00 37.83 32.64 3dgg s LYS 23 CO -0.28 0.09 0.07 0.00 -0.36 0.00 0.00 175.35 174.86 3dgg s ALA 24 N 0.88 3.50 0.01 3.13 0.00 -0.21 -0.56 121.76 128.51 3dgg s ALA 24 Ca 0.22 -1.06 -0.24 0.00 0.00 0.00 0.00 51.96 50.88 3dgg s ALA 24 Cb -0.15 -1.37 0.05 0.00 0.00 0.00 0.00 23.12 21.66 3dgg s ALA 24 CO 0.08 0.72 0.55 -1.54 0.00 0.00 0.00 175.76 175.57 3dgg s SER 25 N -2.44 -0.48 0.00 0.00 1.04 -0.45 -4.86 113.70 106.50 3dgg s SER 25 Ca 0.29 0.33 0.00 0.00 0.48 0.00 0.00 55.95 57.04 3dgg s SER 25 Cb -0.12 0.49 0.00 0.00 0.10 0.00 0.00 66.02 66.49 3dgg s SER 25 CO 0.21 -0.67 0.00 0.61 0.98 0.00 0.00 173.24 174.38 3dgg n GLY 26 N 0.63 0.72 3.75 7.32 0.00 -1.26 -1.00 105.19 115.35 3dgg n GLY 26 Ca -0.19 -0.26 -0.07 0.00 0.00 0.00 0.00 46.02 45.51 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 -2.00 -0.23 -0.61 1.61 1.13 -1.26 -4.40 117.35 111.58 3dgg s TYR 27 Ca 0.00 -0.13 -0.28 0.00 -1.41 0.00 0.00 57.07 55.25 3dgg s TYR 27 Cb 0.00 0.66 0.02 0.00 -1.10 0.00 0.00 41.96 41.54 3dgg s TYR 27 CO 0.00 -1.03 1.39 0.99 -2.51 0.00 0.00 175.55 174.39 3dgg s THR 28 N -3.67 3.76 0.30 -3.49 2.01 -1.26 -4.92 115.64 108.38 3dgg s THR 28 Ca 0.10 0.59 0.06 0.00 0.31 0.00 0.00 61.69 62.75 3dgg s THR 28 Cb -0.04 -4.56 0.30 0.00 0.01 0.00 0.00 72.50 68.22 3dgg s THR 28 CO 0.02 -1.35 1.76 0.15 -0.69 0.00 0.00 174.62 174.52 3dgg h PHE 29 N 10.94 1.04 0.00 4.92 3.57 -1.96 -1.59 116.94 133.87 3dgg h PHE 29 Ca -0.27 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.27 3dgg h PHE 29 Cb 1.08 -0.31 0.00 0.00 2.79 0.00 0.00 35.95 39.51 3dgg h PHE 29 CO 1.06 0.20 0.00 0.25 -2.23 0.00 0.00 178.31 177.59 3dgg n THR 30 N -4.80 0.54 1.73 4.41 -2.24 -1.26 -3.56 114.28 109.10 3dgg n THR 30 Ca 0.24 -0.06 0.14 0.00 -2.27 0.00 0.00 64.05 62.10 3dgg n THR 30 Cb 0.60 -0.72 0.68 0.00 -2.10 0.00 0.00 70.33 68.78 3dgg n THR 30 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 3dgg n SER 31 N -2.00 0.73 -3.93 3.42 7.64 -0.60 -3.13 113.62 115.76 3dgg n SER 31 Ca 0.05 -1.32 -0.17 0.00 1.01 0.00 0.00 58.87 58.44 3dgg n SER 31 Cb 0.34 -0.01 -0.15 0.00 -1.01 0.00 0.00 64.21 63.38 3dgg n SER 31 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 3dgg s TYR 32 N -1.97 0.51 0.28 1.43 1.51 -1.23 -4.99 117.35 112.89 3dgg s TYR 32 Ca 0.40 -0.10 -0.29 0.00 -1.01 0.00 0.00 57.07 56.07 3dgg s TYR 32 Cb 0.20 -0.39 -0.10 0.00 -0.11 0.00 0.00 41.96 41.56 3dgg s TYR 32 CO 0.32 -0.06 1.09 0.08 -1.11 0.00 0.00 175.55 175.88 3dgg s VAL 33 N 0.24 3.51 -0.17 0.71 1.01 -1.26 -4.40 120.40 120.04 3dgg s VAL 33 Ca -0.03 1.50 -0.03 0.00 0.00 0.00 0.00 61.98 63.43 3dgg s VAL 33 Cb -0.06 -3.95 -0.02 0.00 0.00 0.00 0.00 36.38 32.35 3dgg s VAL 33 CO -0.00 0.35 -0.06 -0.32 0.00 0.00 0.00 175.10 175.06 3dgg s MET 34 N -1.49 3.49 0.18 2.72 1.75 -0.63 -1.72 119.30 123.61 3dgg s MET 34 Ca 0.45 -0.60 0.04 0.00 -1.25 0.00 0.00 55.69 54.33 3dgg s MET 34 Cb -0.31 -2.88 -0.03 0.00 2.84 0.00 0.00 34.83 34.44 3dgg s MET 34 CO 0.40 0.08 0.26 -1.01 -0.65 0.00 0.00 175.02 174.10 3dgg s HIS 35 N 0.76 3.36 0.04 4.11 3.76 0.10 -1.31 115.29 126.11 3dgg s HIS 35 Ca -0.03 0.04 0.07 0.00 -0.15 0.00 0.00 55.06 54.99 3dgg s HIS 35 Cb -0.15 -1.58 -0.02 0.00 1.11 0.00 0.00 32.58 31.93 3dgg s HIS 35 CO 0.02 0.50 -0.21 -1.58 -0.85 0.00 0.00 174.74 172.62 3dgg s TRP 36 N -1.83 1.88 0.01 1.40 0.52 0.18 -1.15 118.94 119.95 3dgg s TRP 36 Ca 0.33 -0.38 0.01 0.00 0.02 0.00 0.00 56.10 56.08 3dgg s TRP 36 Cb -0.10 -1.13 -0.01 0.00 -1.15 0.00 0.00 33.47 31.08 3dgg s TRP 36 CO 0.27 0.08 -0.02 0.08 0.02 0.00 0.00 176.95 177.38 3dgg s VAL 37 N -0.77 0.16 -0.15 4.03 1.01 -0.03 -1.00 120.40 123.66 3dgg s VAL 37 Ca 0.08 -0.28 -0.02 0.00 0.00 0.00 0.00 61.98 61.75 3dgg s VAL 37 Cb -0.09 -0.18 -0.02 0.00 0.00 0.00 0.00 36.38 36.09 3dgg s VAL 37 CO 0.02 -0.08 -0.07 -0.75 0.00 0.00 0.00 175.10 174.22 3dgg s LYS 38 N -0.38 3.57 -0.19 2.72 2.20 0.64 -0.34 119.74 127.96 3dgg s LYS 38 Ca -0.03 -0.57 -0.00 0.00 -0.36 0.00 0.00 55.97 55.00 3dgg s LYS 38 Cb -0.03 -2.82 0.05 0.00 -1.51 0.00 0.00 37.83 33.52 3dgg s LYS 38 CO -0.00 0.24 -0.05 -1.14 -0.36 0.00 0.00 175.35 174.04 3dgg s GLN 39 N 0.34 1.44 0.50 4.03 0.74 0.32 -0.55 119.66 126.48 3dgg s GLN 39 Ca -0.06 -0.65 -0.19 0.00 0.05 0.00 0.00 55.36 54.50 3dgg s GLN 39 Cb -0.15 -2.20 -0.08 0.00 1.10 0.00 0.00 33.01 31.69 3dgg s GLN 39 CO 0.04 -0.50 1.02 0.15 -0.55 0.00 0.00 175.29 175.46 3dgg s LYS 40 N 1.58 3.79 -0.14 1.67 1.02 -1.26 -0.57 119.74 125.83 3dgg s LYS 40 Ca -0.01 1.26 -0.41 0.00 0.02 0.00 0.00 55.97 56.82 3dgg s LYS 40 Cb -0.16 -2.10 -0.18 0.00 -0.52 0.00 0.00 37.83 34.86 3dgg s LYS 40 CO -0.07 -0.42 1.37 -2.30 -0.92 0.00 0.00 175.35 173.00 3dgg n PRO 41 N -1.17 0.47 -1.21 -1.68 -0.02 -1.26 -1.05 135.00 129.07 3dgg n PRO 41 Ca 0.09 0.17 -0.07 0.00 -2.02 0.00 0.00 63.50 61.66 3dgg n PRO 41 Cb 0.53 -1.73 -0.03 0.00 -0.02 0.00 0.00 33.50 32.24 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 2.75 0.75 3.76 -1.23 0.00 -1.26 -4.95 105.19 105.00 3dgg n GLY 42 Ca 0.23 -0.04 -0.33 0.00 0.00 0.00 0.00 46.02 45.88 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 -2.50 2.18 0.04 1.61 -1.52 -0.21 -5.16 119.66 114.10 3dgg s GLN 43 Ca 0.00 -2.38 -0.01 0.00 -1.95 0.00 0.00 55.36 51.02 3dgg s GLN 43 Cb 0.00 -1.54 0.01 0.00 -0.22 0.00 0.00 33.01 31.26 3dgg s GLN 43 CO 0.00 -0.35 0.05 0.41 -0.25 0.00 0.00 175.29 175.16 3dgg n GLY 44 N -1.25 -1.28 3.70 3.09 0.00 -1.26 -4.60 105.19 103.60 3dgg n GLY 44 Ca -0.18 -1.65 -0.35 0.00 0.00 0.00 0.00 46.02 43.84 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 4.05 -0.13 0.99 1.43 -1.26 -4.10 118.68 119.65 3dgg s LEU 45 Ca 0.03 0.19 0.03 0.00 -1.03 0.00 0.00 54.13 53.35 3dgg s LEU 45 Cb -0.00 -2.03 0.01 0.00 0.03 0.00 0.00 46.19 44.20 3dgg s LEU 45 CO 0.02 0.21 -0.21 -0.70 0.23 0.00 0.00 176.35 175.89 3dgg s GLU 46 N 0.19 3.06 0.12 1.70 2.12 0.29 -4.98 118.70 121.19 3dgg s GLU 46 Ca 0.07 -0.85 -0.31 0.00 0.36 0.00 0.00 54.97 54.25 3dgg s GLU 46 Cb -0.12 -2.43 -0.07 0.00 0.26 0.00 0.00 34.13 31.77 3dgg s GLU 46 CO -0.00 0.03 1.29 -0.46 -0.54 0.00 0.00 175.26 175.58 3dgg s TRP 47 N 0.71 3.33 -0.24 5.30 -0.00 -1.26 -0.26 118.94 126.52 3dgg s TRP 47 Ca -0.09 1.16 -0.18 0.00 -0.00 0.00 0.00 56.10 56.98 3dgg s TRP 47 Cb -0.16 -3.56 -0.16 0.00 -0.00 0.00 0.00 33.47 29.60 3dgg s TRP 47 CO 0.01 -1.82 -0.07 -0.89 -0.00 0.00 0.00 176.95 174.18 3dgg n ILE 48 N 3.61 1.53 -0.31 5.86 2.08 -0.18 -4.53 119.36 127.43 3dgg n ILE 48 Ca 0.09 -0.20 0.00 0.00 0.56 0.00 0.00 62.75 63.20 3dgg n ILE 48 Cb 0.44 -1.97 0.00 0.00 -0.75 0.00 0.00 39.64 37.36 3dgg n ILE 48 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 3dgg n GLY 49 N 1.35 -2.50 3.10 7.39 0.00 -1.22 -0.33 105.19 112.98 3dgg n GLY 49 Ca -0.43 -1.26 -0.10 0.00 0.00 0.00 0.00 46.02 44.23 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 -2.08 0.67 -0.04 1.61 -0.85 -0.24 -0.64 117.35 115.77 3dgg s TYR 50 Ca 0.00 -0.80 0.06 0.00 -0.52 0.00 0.00 57.07 55.81 3dgg s TYR 50 Cb 0.00 -0.41 -0.01 0.00 0.38 0.00 0.00 41.96 41.91 3dgg s TYR 50 CO 0.00 -0.19 -0.23 -1.50 -1.52 0.00 0.00 175.55 172.11 3dgg s ILE 51 N -2.84 1.84 -0.50 -3.49 2.07 -0.43 -2.05 121.20 115.81 3dgg s ILE 51 Ca 0.02 -0.96 -0.16 0.00 -1.41 0.00 0.00 60.65 58.13 3dgg s ILE 51 Cb 0.00 -1.56 0.09 0.00 0.13 0.00 0.00 42.46 41.13 3dgg s ILE 51 CO -0.04 0.52 0.44 0.21 -1.91 0.00 0.00 174.94 174.16 3dgg s ASN 52 N -0.22 6.16 0.64 4.50 3.84 0.36 -1.60 114.94 128.62 3dgg s ASN 52 Ca -0.00 -1.48 0.43 0.00 0.21 0.00 0.00 52.86 52.02 3dgg s ASN 52 Cb -0.12 -2.20 2.28 0.00 -0.55 0.00 0.00 41.25 40.66 3dgg s ASN 52 CO 0.02 -0.73 2.30 1.55 -2.79 0.00 0.00 177.10 177.45 3dgg h PRO 53 N 8.81 0.00 -0.64 0.43 0.13 -1.81 0.49 132.00 139.41 3dgg h PRO 53 Ca -0.29 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 3dgg h PRO 53 Cb 1.11 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.20 3dgg h PRO 53 CO 0.94 0.00 0.41 -0.92 -0.23 0.00 0.00 178.00 178.20 3dgg h TYR 54 N 0.00 0.81 0.00 1.56 5.03 -1.87 -3.34 116.97 119.16 3dgg h TYR 54 Ca 0.00 0.01 0.00 0.00 2.58 0.00 0.00 58.73 61.32 3dgg h TYR 54 Cb 0.05 -0.27 0.00 0.00 1.55 0.00 0.00 36.73 38.06 3dgg h TYR 54 CO 0.00 0.53 0.00 0.27 -1.32 0.00 0.00 178.16 177.64 3dgg n ASN 55 N -4.63 0.85 -1.05 -2.11 0.23 -1.02 -5.01 115.26 102.52 3dgg n ASN 55 Ca 0.05 -1.42 -0.14 0.00 -0.53 0.00 0.00 54.58 52.54 3dgg n ASN 55 Cb 0.03 0.00 -0.06 0.00 -2.08 0.00 0.00 39.78 37.67 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 -0.21 -5.50 -4.78 0.53 8.00 0.17 -4.97 116.55 109.79 3dgg n ASP 56 Ca 0.00 0.34 -0.36 0.00 0.71 0.00 0.00 54.79 55.48 3dgg n ASP 56 Cb 0.39 -4.21 -0.04 0.00 -0.02 0.00 0.00 41.12 37.24 3dgg n ASP 56 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 3dgg s ASP 57 N -2.55 6.65 0.12 -2.24 1.11 -1.19 -4.78 116.67 113.78 3dgg s ASP 57 Ca 0.00 2.04 0.04 0.00 0.18 0.00 0.00 52.55 54.81 3dgg s ASP 57 Cb 0.00 -2.58 -0.04 0.00 1.07 0.00 0.00 42.92 41.37 3dgg s ASP 57 CO 0.00 -0.57 -0.11 0.42 1.18 0.00 0.00 175.17 176.10 3dgg s THR 58 N -1.70 1.06 0.03 -1.27 -4.23 -1.26 -0.49 115.64 107.78 3dgg s THR 58 Ca 0.60 -1.79 -0.04 0.00 -1.18 0.00 0.00 61.69 59.27 3dgg s THR 58 Cb -0.22 -1.55 -0.01 0.00 1.34 0.00 0.00 72.50 72.06 3dgg s THR 58 CO 0.27 -0.61 0.07 0.21 -0.54 0.00 0.00 174.62 174.02 3dgg s ASN 59 N -2.70 0.18 0.02 3.99 3.04 -0.87 -4.99 114.94 113.62 3dgg s ASN 59 Ca 0.10 -0.49 0.03 0.00 0.04 0.00 0.00 52.86 52.54 3dgg s ASN 59 Cb -0.01 0.19 -0.01 0.00 -1.54 0.00 0.00 41.25 39.88 3dgg s ASN 59 CO 0.00 -0.44 -0.10 -0.31 -3.04 0.00 0.00 177.10 173.22 3dgg s TYR 60 N -2.19 0.86 -0.16 0.43 2.02 -1.26 -1.08 117.35 115.96 3dgg s TYR 60 Ca -0.09 -0.26 -0.29 0.00 -0.37 0.00 0.00 57.07 56.06 3dgg s TYR 60 Cb -0.04 -0.53 -0.03 0.00 -0.40 0.00 0.00 41.96 40.96 3dgg s TYR 60 CO -0.03 -0.01 1.61 1.21 -1.57 0.00 0.00 175.55 176.76 3dgg s ASN 61 N -0.71 6.50 0.49 2.29 2.47 0.55 -4.89 114.94 121.63 3dgg s ASN 61 Ca 0.00 1.83 0.28 0.00 0.42 0.00 0.00 52.86 55.39 3dgg s ASN 61 Cb -0.06 -2.53 1.02 0.00 -1.45 0.00 0.00 41.25 38.23 3dgg s ASN 61 CO 0.00 -1.13 1.86 -0.08 -3.72 0.00 0.00 177.10 174.03 3dgg h GLU 62 N 10.24 0.00 0.00 0.43 4.57 -1.93 -2.61 114.58 125.28 3dgg h GLU 62 Ca -0.35 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.83 3dgg h GLU 62 Cb 1.16 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.75 3dgg h GLU 62 CO 0.98 0.09 -0.01 0.87 -1.18 0.00 0.00 179.01 179.76 3dgg h LYS 63 N 0.00 0.00 -6.65 1.92 1.57 -1.95 -3.45 116.57 108.01 3dgg h LYS 63 Ca -0.00 0.00 -0.52 0.00 -1.87 0.00 0.00 60.65 58.26 3dgg h LYS 63 Cb 0.69 0.00 0.06 0.00 0.08 0.00 0.00 32.23 33.06 3dgg h LYS 63 CO 0.01 0.00 0.99 0.12 -0.57 0.00 0.00 179.45 180.00 3dgg s PHE 64 N -3.11 2.93 -0.19 -1.35 2.19 -0.98 -4.92 117.98 112.54 3dgg s PHE 64 Ca 0.10 0.39 0.20 0.00 0.33 0.00 0.00 56.93 57.94 3dgg s PHE 64 Cb 0.12 -4.11 -0.03 0.00 -1.31 0.00 0.00 43.02 37.68 3dgg s PHE 64 CO 0.61 -4.18 1.01 0.87 1.83 0.00 0.00 175.22 175.35 3dgg h LYS 65 N 6.79 0.00 -7.50 10.12 1.79 -1.89 -3.47 116.57 122.41 3dgg h LYS 65 Ca -0.43 0.00 -0.46 0.00 -2.18 0.00 0.00 60.65 57.58 3dgg h LYS 65 Cb 1.20 0.00 0.13 0.00 -1.58 0.00 0.00 32.23 31.99 3dgg h LYS 65 CO 0.95 0.16 0.30 0.20 -1.08 0.00 0.00 179.45 179.98 3dgg s GLY 66 N -4.55 1.58 -0.71 3.86 0.00 -1.26 -5.02 107.32 101.23 3dgg s GLY 66 Ca -0.01 -0.57 -0.12 0.00 0.00 0.00 0.00 44.72 44.02 3dgg s GLY 66 CO 0.79 0.01 0.62 0.54 0.00 0.00 0.00 173.10 175.06 3dgg s LYS 67 N -5.31 3.19 -0.05 2.90 1.02 -1.26 -5.06 119.74 115.17 3dgg s LYS 67 Ca 0.65 -2.29 -0.03 0.00 0.02 0.00 0.00 55.97 54.32 3dgg s LYS 67 Cb -0.14 -4.22 -0.04 0.00 -0.52 0.00 0.00 37.83 32.91 3dgg s LYS 67 CO 0.53 -1.26 0.10 0.00 -0.92 0.00 0.00 175.35 173.80 3dgg s ALA 68 N 0.47 3.66 -0.07 5.17 0.00 -1.26 -1.88 121.76 127.85 3dgg s ALA 68 Ca 0.14 -0.78 -0.01 0.00 0.00 0.00 0.00 51.96 51.31 3dgg s ALA 68 Cb -0.17 -1.71 0.03 0.00 0.00 0.00 0.00 23.12 21.27 3dgg s ALA 68 CO -0.05 0.66 -0.02 0.99 0.00 0.00 0.00 175.76 177.34 3dgg s THR 69 N -1.12 0.54 -0.19 0.00 2.01 -0.16 -4.98 115.64 111.74 3dgg s THR 69 Ca 0.20 -0.00 -0.08 0.00 0.31 0.00 0.00 61.69 62.11 3dgg s THR 69 Cb -0.12 -0.64 -0.04 0.00 0.01 0.00 0.00 72.50 71.71 3dgg s THR 69 CO 0.10 0.28 0.08 -0.76 -0.69 0.00 0.00 174.62 173.62 3dgg s LEU 70 N 1.73 3.89 0.30 4.42 1.43 -1.26 -0.98 118.68 128.21 3dgg s LEU 70 Ca 0.02 0.10 0.03 0.00 -1.03 0.00 0.00 54.13 53.26 3dgg s LEU 70 Cb -0.13 -1.99 -0.04 0.00 0.03 0.00 0.00 46.19 44.07 3dgg s LEU 70 CO -0.05 0.17 0.17 0.42 0.23 0.00 0.00 176.35 177.29 3dgg s THR 71 N 0.41 0.27 0.10 5.49 -4.23 -0.47 -4.97 115.64 112.24 3dgg s THR 71 Ca 0.04 -2.00 -0.13 0.00 -1.18 0.00 0.00 61.69 58.42 3dgg s THR 71 Cb -0.12 -2.50 0.02 0.00 1.34 0.00 0.00 72.50 71.24 3dgg s THR 71 CO -0.00 0.00 0.32 -0.94 -0.54 0.00 0.00 174.62 173.46 3dgg s SER 72 N -3.37 -0.10 -0.16 3.99 1.04 -1.26 -0.57 113.70 113.27 3dgg s SER 72 Ca 0.36 -0.41 -0.01 0.00 0.48 0.00 0.00 55.95 56.38 3dgg s SER 72 Cb 0.05 0.41 0.04 0.00 0.10 0.00 0.00 66.02 66.62 3dgg s SER 72 CO 0.18 -0.78 -0.05 -0.62 0.98 0.00 0.00 173.24 172.96 3dgg s ASP 73 N -2.71 2.80 0.15 7.02 -1.08 0.18 -4.99 116.67 118.03 3dgg s ASP 73 Ca 0.02 -0.65 -0.17 0.00 -0.52 0.00 0.00 52.55 51.23 3dgg s ASP 73 Cb 0.02 -0.89 0.01 0.00 -1.46 0.00 0.00 42.92 40.60 3dgg s ASP 73 CO -0.10 -0.19 1.78 0.11 0.52 0.00 0.00 175.17 177.29 3dgg h LYS 74 N 8.13 0.37 -0.80 4.34 1.57 -1.93 -1.44 116.57 126.81 3dgg h LYS 74 Ca -0.24 -0.02 0.01 0.00 -1.87 0.00 0.00 60.65 58.52 3dgg h LYS 74 Cb 1.11 -0.08 -0.04 0.00 0.08 0.00 0.00 32.23 33.30 3dgg h LYS 74 CO 0.40 0.24 0.52 0.66 -0.57 0.00 0.00 179.45 180.70 3dgg h SER 75 N 0.38 0.93 -0.23 0.86 4.64 -1.97 -2.11 113.55 116.06 3dgg h SER 75 Ca 0.13 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 3dgg h SER 75 Cb 0.01 -0.23 0.00 0.00 -0.31 0.00 0.00 62.40 61.87 3dgg h SER 75 CO -0.07 0.69 0.00 -1.54 -0.87 0.00 0.00 176.83 175.04 3dgg n SER 76 N -4.51 2.61 -4.09 4.97 3.41 -1.21 -4.97 113.62 109.83 3dgg n SER 76 Ca 0.08 -1.86 -0.29 0.00 -0.26 0.00 0.00 58.87 56.54 3dgg n SER 76 Cb 0.02 -0.15 -0.04 0.00 -0.26 0.00 0.00 64.21 63.79 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 0.96 -0.71 -4.14 4.04 7.64 -0.58 -4.72 113.62 116.10 3dgg n SER 77 Ca 0.17 -1.06 -0.27 0.00 1.01 0.00 0.00 58.87 58.72 3dgg n SER 77 Cb 0.49 -2.69 -0.16 0.00 -1.01 0.00 0.00 64.21 60.84 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 -3.89 1.55 -0.05 0.44 2.01 -0.95 -1.05 115.64 113.70 3dgg s THR 78 Ca 0.17 -0.76 -0.04 0.00 0.31 0.00 0.00 61.69 61.37 3dgg s THR 78 Cb -0.09 -1.34 -0.04 0.00 0.01 0.00 0.00 72.50 71.04 3dgg s THR 78 CO 0.92 0.44 0.13 0.00 -0.69 0.00 0.00 174.62 175.42 3dgg s ALA 79 N 0.17 3.78 -0.02 7.40 0.00 -0.06 -0.65 121.76 132.39 3dgg s ALA 79 Ca -0.08 -0.75 0.06 0.00 0.00 0.00 0.00 51.96 51.19 3dgg s ALA 79 Cb -0.14 -1.80 -0.01 0.00 0.00 0.00 0.00 23.12 21.17 3dgg s ALA 79 CO 0.04 0.68 -0.19 0.71 0.00 0.00 0.00 175.76 177.00 3dgg s TYR 80 N -1.15 1.68 -0.13 0.00 2.02 0.27 0.12 117.35 120.15 3dgg s TYR 80 Ca 0.21 -0.34 0.03 0.00 -0.37 0.00 0.00 57.07 56.60 3dgg s TYR 80 Cb -0.12 -1.09 0.01 0.00 -0.40 0.00 0.00 41.96 40.36 3dgg s TYR 80 CO 0.11 -0.04 -0.22 1.41 -1.57 0.00 0.00 175.55 175.24 3dgg s MET 81 N -0.38 2.97 -0.15 -0.62 -2.45 -0.22 -1.36 119.30 117.09 3dgg s MET 81 Ca 0.06 -0.84 -0.05 0.00 -1.25 0.00 0.00 55.69 53.61 3dgg s MET 81 Cb -0.08 -2.37 -0.03 0.00 1.25 0.00 0.00 34.83 33.60 3dgg s MET 81 CO -0.00 0.02 0.00 -2.00 1.05 0.00 0.00 175.02 174.09 3dgg s GLU 82 N 0.72 3.66 -0.12 4.11 -6.30 -0.15 0.21 118.70 120.83 3dgg s GLU 82 Ca -0.10 -0.44 0.02 0.00 -2.50 0.00 0.00 54.97 51.95 3dgg s GLU 82 Cb -0.16 -2.99 0.01 0.00 0.00 0.00 0.00 34.13 30.99 3dgg s GLU 82 CO 0.00 0.34 -0.17 -0.51 0.02 0.00 0.00 175.26 174.94 3dgg s LEU 83 N 0.14 1.85 0.40 2.70 1.43 -0.07 -0.99 118.68 124.13 3dgg s LEU 83 Ca 0.01 -0.49 0.08 0.00 -1.03 0.00 0.00 54.13 52.70 3dgg s LEU 83 Cb -0.13 -1.21 -0.05 0.00 0.03 0.00 0.00 46.19 44.83 3dgg s LEU 83 CO 0.02 0.03 0.16 -0.44 0.23 0.00 0.00 176.35 176.35 3dgg s SER 84 N 0.96 4.43 -1.33 2.29 0.01 -0.79 -1.12 113.70 118.15 3dgg s SER 84 Ca -0.06 -1.03 -0.07 0.00 1.31 0.00 0.00 55.95 56.09 3dgg s SER 84 Cb -0.15 -0.51 0.00 0.00 0.21 0.00 0.00 66.02 65.57 3dgg s SER 84 CO -0.02 -0.49 0.52 -1.20 0.41 0.00 0.00 173.24 172.47 3dgg n SER 85 N -1.20 -1.78 -4.77 2.44 7.64 -1.18 -4.36 113.62 110.41 3dgg n SER 85 Ca -0.02 -1.03 -0.38 0.00 1.01 0.00 0.00 58.87 58.46 3dgg n SER 85 Cb 0.64 -3.05 -0.04 0.00 -1.01 0.00 0.00 64.21 60.75 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 -6.87 4.28 0.36 -3.43 1.43 -0.49 -4.74 118.68 109.22 3dgg s LEU 86 Ca 0.15 2.17 0.04 0.00 -1.03 0.00 0.00 54.13 55.46 3dgg s LEU 86 Cb -0.06 -3.97 -0.03 0.00 0.03 0.00 0.00 46.19 42.16 3dgg s LEU 86 CO 0.89 -0.41 0.16 0.42 0.23 0.00 0.00 176.35 177.64 3dgg s THR 87 N -1.45 0.45 0.52 5.49 -4.23 -1.26 -0.40 115.64 114.75 3dgg s THR 87 Ca 0.53 -2.00 0.21 0.00 -1.18 0.00 0.00 61.69 59.25 3dgg s THR 87 Cb -0.27 -2.44 0.28 0.00 1.34 0.00 0.00 72.50 71.41 3dgg s THR 87 CO 0.34 0.00 2.15 0.77 -0.54 0.00 0.00 174.62 177.33 3dgg h SER 88 N 1.99 0.00 0.57 3.99 4.64 -1.98 -1.48 113.55 121.28 3dgg h SER 88 Ca -0.33 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.99 3dgg h SER 88 Cb 1.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 3dgg h SER 88 CO 0.53 0.05 0.00 -1.84 -0.87 0.00 0.00 176.83 174.69 3dgg n GLU 89 N -4.20 0.08 0.00 4.77 0.28 -1.26 -1.32 120.64 118.99 3dgg n GLU 89 Ca -0.03 0.33 0.14 0.00 -0.16 0.00 0.00 57.16 57.44 3dgg n GLU 89 Cb 0.13 -1.65 0.63 0.00 1.43 0.00 0.00 31.44 31.98 3dgg n GLU 89 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 3dgg n ASP 90 N -1.79 0.12 -4.67 -1.84 8.00 -0.56 -4.87 116.55 110.94 3dgg n ASP 90 Ca 0.03 0.05 -0.42 0.00 0.71 0.00 0.00 54.79 55.16 3dgg n ASP 90 Cb 0.19 -0.29 -0.03 0.00 -0.02 0.00 0.00 41.12 40.97 3dgg n ASP 90 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 3dgg s SER 91 N -2.78 6.74 0.03 -2.24 0.01 -0.43 -4.89 113.70 110.14 3dgg s SER 91 Ca 0.21 2.18 -0.28 0.00 1.31 0.00 0.00 55.95 59.38 3dgg s SER 91 Cb 0.19 -2.55 0.10 0.00 0.21 0.00 0.00 66.02 63.98 3dgg s SER 91 CO 0.51 -0.85 1.22 0.00 0.41 0.00 0.00 173.24 174.53 3dgg s ALA 92 N 3.33 -2.16 -0.21 1.44 0.00 -0.95 -4.74 121.76 118.47 3dgg s ALA 92 Ca 0.69 0.19 -0.14 0.00 0.00 0.00 0.00 51.96 52.70 3dgg s ALA 92 Cb -0.33 0.67 -0.04 0.00 0.00 0.00 0.00 23.12 23.42 3dgg s ALA 92 CO 0.27 -1.09 0.30 0.08 0.00 0.00 0.00 175.76 175.32 3dgg s VAL 93 N -2.27 5.27 -0.13 0.00 1.01 0.26 -1.30 120.40 123.24 3dgg s VAL 93 Ca 0.22 0.49 -0.04 0.00 0.00 0.00 0.00 61.98 62.65 3dgg s VAL 93 Cb 0.01 -3.63 -0.03 0.00 0.00 0.00 0.00 36.38 32.72 3dgg s VAL 93 CO -0.00 0.31 0.00 -0.31 0.00 0.00 0.00 175.10 175.10 3dgg s TYR 94 N 1.08 3.15 0.05 5.22 2.02 0.19 -0.52 117.35 128.54 3dgg s TYR 94 Ca 0.14 0.03 0.09 0.00 -0.37 0.00 0.00 57.07 56.96 3dgg s TYR 94 Cb -0.14 -1.90 -0.03 0.00 -0.40 0.00 0.00 41.96 39.49 3dgg s TYR 94 CO 0.06 0.26 -0.25 0.71 -1.57 0.00 0.00 175.55 174.76 3dgg s TYR 95 N -0.26 2.37 -0.11 2.71 2.02 0.53 -0.85 117.35 123.77 3dgg s TYR 95 Ca 0.06 -0.38 -0.05 0.00 -0.37 0.00 0.00 57.07 56.33 3dgg s TYR 95 Cb -0.12 -1.39 -0.04 0.00 -0.40 0.00 0.00 41.96 40.01 3dgg s TYR 95 CO 0.02 0.18 0.09 0.00 -1.57 0.00 0.00 175.55 174.27 3dgg s ALA 97 N -0.92 -0.39 -0.13 0.00 0.00 -0.30 -0.30 121.76 119.73 3dgg s ALA 97 Ca 0.14 0.29 -0.14 0.00 0.00 0.00 0.00 51.96 52.25 3dgg s ALA 97 Cb -0.12 -0.16 -0.05 0.00 0.00 0.00 0.00 23.12 22.79 3dgg s ALA 97 CO 0.03 -0.12 0.32 0.50 0.00 0.00 0.00 175.76 176.49 3dgg s ARG 98 N -0.34 4.14 -0.16 0.00 3.52 -0.18 0.01 118.95 125.93 3dgg s ARG 98 Ca -0.04 0.17 -0.16 0.00 -0.13 0.00 0.00 55.73 55.56 3dgg s ARG 98 Cb -0.03 -3.37 -0.04 0.00 -1.56 0.00 0.00 34.95 29.95 3dgg s ARG 98 CO 0.01 0.35 0.41 -2.00 -0.81 0.00 0.00 175.30 173.26 3dgg s GLU 99 N 0.10 4.26 0.45 5.12 2.12 -0.70 -3.52 118.70 126.52 3dgg s GLU 99 Ca 0.19 0.29 -0.15 0.00 0.36 0.00 0.00 54.97 55.65 3dgg s GLU 99 Cb -0.14 -3.48 -0.08 0.00 0.26 0.00 0.00 34.13 30.70 3dgg s GLU 99 CO 0.06 0.09 0.89 -0.51 -0.54 0.00 0.00 175.26 175.25 3dgg s ASP 100 N 0.76 6.66 0.38 -1.70 -0.00 0.23 -4.27 116.67 118.73 3dgg s ASP 100 Ca 0.21 1.42 0.14 0.00 -0.00 0.00 0.00 52.55 54.33 3dgg s ASP 100 Cb -0.14 -2.44 0.77 0.00 -0.00 0.00 0.00 42.92 41.10 3dgg s ASP 100 CO 0.08 -0.45 1.84 1.88 -0.00 0.00 0.00 175.17 178.51 3dgg h TYR 101 N 1.32 0.00 -1.20 4.23 0.05 -1.94 -3.07 116.97 116.36 3dgg h TYR 101 Ca -0.47 0.00 -0.35 0.00 0.05 0.00 0.00 58.73 57.95 3dgg h TYR 101 Cb 1.18 0.00 -0.04 0.00 1.01 0.00 0.00 36.73 38.89 3dgg h TYR 101 CO 0.62 0.35 0.96 0.71 -1.05 0.00 0.00 178.16 179.76 3dgg s TYR 102 N -4.16 1.65 -1.98 4.88 1.51 -1.26 -3.86 117.35 114.13 3dgg s TYR 102 Ca -0.03 0.87 0.00 0.00 -1.01 0.00 0.00 57.07 56.90 3dgg s TYR 102 Cb 0.14 -3.98 0.00 0.00 -0.11 0.00 0.00 41.96 38.01 3dgg s TYR 102 CO 0.71 -1.99 0.00 0.41 -1.11 0.00 0.00 175.55 173.58 3dgg n GLY 103 N 6.38 1.06 3.08 0.71 0.00 -1.26 -2.52 105.19 112.63 3dgg n GLY 103 Ca 0.33 -0.05 -0.22 0.00 0.00 0.00 0.00 46.02 46.08 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 -1.45 -5.38 -4.84 1.61 3.41 -1.16 -4.97 113.62 100.84 3dgg n SER 104 Ca -0.21 -0.29 -0.33 0.00 -0.26 0.00 0.00 58.87 57.77 3dgg n SER 104 Cb 0.67 -4.38 -0.06 0.00 -0.26 0.00 0.00 64.21 60.18 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 -5.75 4.04 -0.89 4.33 1.70 -1.05 -4.68 118.95 116.64 3dgg s ARG 105 Ca 0.31 0.71 -0.09 0.00 -0.47 0.00 0.00 55.73 56.19 3dgg s ARG 105 Cb -0.15 -2.46 0.23 0.00 -0.57 0.00 0.00 34.95 32.00 3dgg s ARG 105 CO 0.39 0.17 0.82 -1.58 -1.08 0.00 0.00 175.30 174.02 3dgg s TRP 106 N -1.95 3.88 0.09 5.89 0.52 -1.26 0.78 118.94 126.89 3dgg s TRP 106 Ca 0.53 -2.46 -0.03 0.00 0.02 0.00 0.00 56.10 54.17 3dgg s TRP 106 Cb -0.11 -3.65 -0.24 0.00 -1.15 0.00 0.00 33.47 28.32 3dgg s TRP 106 CO 0.18 -0.92 1.19 0.78 0.02 0.00 0.00 176.95 178.19 3dgg h GLY 107 N 7.08 0.29 -5.40 0.98 0.00 -1.95 -3.45 103.07 100.61 3dgg h GLY 107 Ca 0.12 -0.69 -0.67 0.00 0.00 0.00 0.00 47.33 46.09 3dgg h GLY 107 CO 0.84 0.60 -0.84 -0.19 0.00 0.00 0.00 176.54 176.95 3dgg s TYR 108 N -2.75 2.64 0.02 5.60 2.02 -1.26 -5.05 117.35 118.57 3dgg s TYR 108 Ca -0.04 -0.86 0.06 0.00 -0.37 0.00 0.00 57.07 55.86 3dgg s TYR 108 Cb 0.08 -1.75 -0.02 0.00 -0.40 0.00 0.00 41.96 39.87 3dgg s TYR 108 CO 0.87 -0.32 -0.18 -1.58 -1.57 0.00 0.00 175.55 172.77 3dgg s TRP 109 N 0.28 1.61 1.05 2.71 0.52 -1.26 -1.01 118.94 122.83 3dgg s TRP 109 Ca -0.14 -0.34 -0.12 0.00 0.02 0.00 0.00 56.10 55.52 3dgg s TRP 109 Cb -0.17 -0.99 0.22 0.00 -1.15 0.00 0.00 33.47 31.38 3dgg s TRP 109 CO 0.07 0.03 1.07 0.20 0.02 0.00 0.00 176.95 178.34 3dgg s GLY 110 N -0.84 1.58 0.04 0.98 0.00 0.59 -4.66 107.32 105.00 3dgg s GLY 110 Ca 0.06 -0.11 0.28 0.00 0.00 0.00 0.00 44.72 44.95 3dgg s GLY 110 CO 0.01 0.51 1.89 0.61 0.00 0.00 0.00 173.10 176.12 3dgg n GLN 111 N -4.47 0.05 0.00 2.90 0.00 -1.26 -4.72 117.38 109.88 3dgg n GLN 111 Ca 0.05 0.05 0.00 0.00 0.00 0.00 0.00 57.00 57.10 3dgg n GLN 111 Cb 0.55 -1.56 0.00 0.00 0.00 0.00 0.00 30.24 29.23 3dgg n GLN 111 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3dgg n GLY 112 N 1.44 2.22 3.18 2.61 0.00 -1.26 -5.06 105.19 108.33 3dgg n GLY 112 Ca 0.07 -1.68 -0.32 0.00 0.00 0.00 0.00 46.02 44.09 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 -1.66 1.99 -0.31 2.61 2.01 -0.03 -4.89 115.64 115.36 3dgg s THR 113 Ca 0.00 -0.96 -0.21 0.00 0.31 0.00 0.00 61.69 60.83 3dgg s THR 113 Cb 0.00 -1.74 -0.00 0.00 0.01 0.00 0.00 72.50 70.76 3dgg s THR 113 CO 0.00 0.54 0.68 -0.89 -0.69 0.00 0.00 174.62 174.26 3dgg s THR 114 N 0.61 4.89 -0.25 -0.82 2.01 -1.26 -0.64 115.64 120.18 3dgg s THR 114 Ca -0.13 0.94 -0.10 0.00 0.31 0.00 0.00 61.69 62.71 3dgg s THR 114 Cb -0.17 -4.05 -0.05 0.00 0.01 0.00 0.00 72.50 68.24 3dgg s THR 114 CO 0.03 -0.19 0.15 -0.22 -0.69 0.00 0.00 174.62 173.70 3dgg s LEU 115 N 2.73 3.96 -0.16 4.42 0.20 -0.42 -1.22 118.68 128.19 3dgg s LEU 115 Ca 0.27 0.02 -0.00 0.00 0.69 0.00 0.00 54.13 55.11 3dgg s LEU 115 Cb -0.15 -2.07 -0.01 0.00 -0.43 0.00 0.00 46.19 43.54 3dgg s LEU 115 CO 0.12 0.02 -0.13 -0.89 -0.29 0.00 0.00 176.35 175.18 3dgg s THR 116 N 1.30 2.85 -0.19 3.68 2.01 -0.12 -2.24 115.64 122.92 3dgg s THR 116 Ca 0.07 -0.71 0.00 0.00 0.31 0.00 0.00 61.69 61.36 3dgg s THR 116 Cb -0.14 -2.22 0.02 0.00 0.01 0.00 0.00 72.50 70.16 3dgg s THR 116 CO 0.06 0.51 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.64 3dgg s VAL 117 N 0.79 2.35 -0.15 3.82 1.01 -1.26 -1.54 120.40 125.41 3dgg s VAL 117 Ca -0.05 -0.88 -0.23 0.00 0.00 0.00 0.00 61.98 60.82 3dgg s VAL 117 Cb -0.15 -2.02 0.06 0.00 0.00 0.00 0.00 36.38 34.26 3dgg s VAL 117 CO 0.01 0.49 0.59 -0.55 0.00 0.00 0.00 175.10 175.63 3dgg s SER 118 N 1.32 -0.58 0.04 3.32 0.15 -1.00 -4.25 113.70 112.70 3dgg s SER 118 Ca 0.05 0.94 0.25 0.00 0.70 0.00 0.00 55.95 57.89 3dgg s SER 118 Cb -0.14 0.93 1.03 0.00 -1.71 0.00 0.00 66.02 66.13 3dgg s SER 118 CO -0.11 -0.34 1.79 -1.54 1.20 0.00 0.00 173.24 174.24 3dgg n SER 119 N 2.08 0.13 -4.78 5.45 3.41 -1.26 -4.30 113.62 114.35 3dgg n SER 119 Ca -0.16 0.52 -0.33 0.00 -0.26 0.00 0.00 58.87 58.63 3dgg n SER 119 Cb 0.56 -0.55 0.03 0.00 -0.26 0.00 0.00 64.21 63.99 3dgg n SER 119 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3dgg s ALA 120 N -3.03 2.58 0.36 7.33 0.00 -1.26 -5.08 121.76 122.66 3dgg s ALA 120 Ca 0.11 0.57 0.09 0.00 0.00 0.00 0.00 51.96 52.73 3dgg s ALA 120 Cb 0.15 -3.31 -0.06 0.00 0.00 0.00 0.00 23.12 19.91 3dgg s ALA 120 CO 0.47 -1.06 0.01 0.15 0.00 0.00 0.00 175.76 175.33 3dgg s LYS 121 N -3.92 2.03 0.08 0.00 1.02 -1.26 -5.06 119.74 112.63 3dgg s LYS 121 Ca 0.67 -1.84 -0.30 0.00 0.02 0.00 0.00 55.97 54.52 3dgg s LYS 121 Cb -0.20 -1.86 -0.10 0.00 -0.52 0.00 0.00 37.83 35.16 3dgg s LYS 121 CO 0.37 0.08 1.90 0.99 -0.92 0.00 0.00 175.35 177.78 3dgg s THR 122 N -2.57 2.77 -0.03 2.17 2.01 -1.26 -4.63 115.64 114.10 3dgg s THR 122 Ca 0.35 0.03 0.01 0.00 0.31 0.00 0.00 61.69 62.38 3dgg s THR 122 Cb 0.02 -3.02 0.03 0.00 0.01 0.00 0.00 72.50 69.54 3dgg s THR 122 CO 0.19 -0.00 -0.01 -0.89 -0.69 0.00 0.00 174.62 173.22 3dgg s THR 123 N 3.63 0.24 0.58 -0.82 2.01 0.19 -4.94 115.64 116.53 3dgg s THR 123 Ca 0.85 0.05 -0.14 0.00 0.31 0.00 0.00 61.69 62.75 3dgg s THR 123 Cb -0.44 -0.32 -0.05 0.00 0.01 0.00 0.00 72.50 71.70 3dgg s THR 123 CO 0.39 0.16 1.02 -2.16 -0.69 0.00 0.00 174.62 173.34 3dgg s PRO 124 N 0.98 3.57 0.49 4.92 0.04 -1.26 -1.01 135.00 142.73 3dgg s PRO 124 Ca -0.10 0.97 -0.21 0.00 0.04 0.00 0.00 61.00 61.70 3dgg s PRO 124 Cb -0.14 -2.08 -0.07 0.00 0.04 0.00 0.00 34.50 32.25 3dgg s PRO 124 CO -0.01 -0.59 1.08 -1.25 0.04 0.00 0.00 177.00 176.27 3dgg s PRO 125 N -4.45 3.68 -0.11 0.56 0.04 -1.26 -4.41 135.00 129.04 3dgg s PRO 125 Ca 0.59 1.51 -0.23 0.00 0.04 0.00 0.00 61.00 62.91 3dgg s PRO 125 Cb -0.12 -2.14 -0.03 0.00 0.04 0.00 0.00 34.50 32.25 3dgg s PRO 125 CO 0.41 -0.56 0.70 -1.12 0.04 0.00 0.00 177.00 176.47 3dgg s SER 126 N -1.80 6.92 -0.34 6.66 0.01 0.41 -4.90 113.70 120.66 3dgg s SER 126 Ca 0.68 1.11 -0.02 0.00 1.31 0.00 0.00 55.95 59.03 3dgg s SER 126 Cb -0.21 -2.40 0.08 0.00 0.21 0.00 0.00 66.02 63.70 3dgg s SER 126 CO 0.25 -0.18 0.08 -0.69 0.41 0.00 0.00 173.24 173.11 3dgg s VAL 127 N 1.18 3.04 -0.16 3.43 1.01 -1.26 -0.31 120.40 127.34 3dgg s VAL 127 Ca 0.36 -1.71 -0.05 0.00 0.00 0.00 0.00 61.98 60.57 3dgg s VAL 127 Cb -0.17 -2.92 -0.03 0.00 0.00 0.00 0.00 36.38 33.26 3dgg s VAL 127 CO 0.16 -0.36 0.01 -0.31 0.00 0.00 0.00 175.10 174.59 3dgg s TYR 128 N 1.18 3.14 0.24 5.22 1.51 0.32 -4.94 117.35 124.02 3dgg s TYR 128 Ca 0.01 -0.10 -0.30 0.00 -1.01 0.00 0.00 57.07 55.67 3dgg s TYR 128 Cb -0.21 -2.01 -0.09 0.00 -0.11 0.00 0.00 41.96 39.55 3dgg s TYR 128 CO -0.03 0.08 1.05 -1.25 -1.11 0.00 0.00 175.55 174.29 3dgg s PRO 129 N 0.31 4.68 -0.35 -1.71 0.04 -1.26 -0.60 135.00 136.11 3dgg s PRO 129 Ca -0.00 1.69 -0.01 0.00 0.04 0.00 0.00 61.00 62.72 3dgg s PRO 129 Cb -0.13 -3.24 0.09 0.00 0.04 0.00 0.00 34.50 31.25 3dgg s PRO 129 CO 0.02 0.25 0.09 -0.51 0.04 0.00 0.00 177.00 176.89 3dgg s LEU 130 N -1.04 4.62 0.20 -3.56 1.43 0.07 -4.92 118.68 115.50 3dgg s LEU 130 Ca 0.45 -1.76 -0.02 0.00 -1.03 0.00 0.00 54.13 51.76 3dgg s LEU 130 Cb -0.29 -1.74 -0.05 0.00 0.03 0.00 0.00 46.19 44.14 3dgg s LEU 130 CO 0.37 -0.40 0.41 0.00 0.23 0.00 0.00 176.35 176.96 3dgg s ALA 131 N 1.14 3.79 0.22 4.21 0.00 -1.26 -1.63 121.76 128.22 3dgg s ALA 131 Ca 0.03 -0.71 -0.31 0.00 0.00 0.00 0.00 51.96 50.97 3dgg s ALA 131 Cb -0.21 -2.08 -0.15 0.00 0.00 0.00 0.00 23.12 20.68 3dgg s ALA 131 CO -0.04 0.46 1.17 -2.30 0.00 0.00 0.00 175.76 175.06 3dgg n PRO 132 N -0.51 1.40 -0.01 0.00 -0.02 -1.26 -4.92 135.00 129.68 3dgg n PRO 132 Ca -0.04 0.50 -0.01 0.00 -2.02 0.00 0.00 63.50 61.93 3dgg n PRO 132 Cb 0.53 -1.99 -0.01 0.00 -0.02 0.00 0.00 33.50 32.01 3dgg n PRO 132 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3dgg n GLY 133 N 1.81 -0.03 0.00 -1.23 0.00 -1.26 -4.80 105.19 99.68 3dgg n GLY 133 Ca 0.13 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.13 3dgg n GLY 133 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3dgg n SER 134 N -2.50 0.00 0.00 1.61 3.41 -1.26 -5.25 113.62 109.63 3dgg n SER 134 Ca -0.03 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.58 3dgg n SER 134 Cb 0.54 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.49 3dgg n SER 134 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3dgg n SER 140 N 0.00 0.00 -4.17 4.04 3.41 -1.26 -5.25 113.62 110.39 3dgg n SER 140 Ca 0.00 0.00 -0.26 0.00 -0.26 0.00 0.00 58.87 58.35 3dgg n SER 140 Cb 0.00 0.00 -0.16 0.00 -0.26 0.00 0.00 64.21 63.79 3dgg n SER 140 CO 0.00 0.00 0.00 -0.32 -0.16 0.00 0.00 175.04 174.56 3dgg s MET 141 N -1.70 1.65 -0.15 4.33 -2.45 -1.26 -2.65 119.30 117.07 3dgg s MET 141 Ca 0.00 -0.66 -0.05 0.00 -1.25 0.00 0.00 55.69 53.73 3dgg s MET 141 Cb 0.00 -1.53 -0.04 0.00 1.25 0.00 0.00 34.83 34.52 3dgg s MET 141 CO 0.00 0.35 0.04 0.08 1.05 0.00 0.00 175.02 176.54 3dgg s VAL 142 N -0.27 4.63 -0.13 10.11 1.01 0.20 -4.81 120.40 131.15 3dgg s VAL 142 Ca 0.03 -0.10 -0.04 0.00 0.00 0.00 0.00 61.98 61.87 3dgg s VAL 142 Cb -0.09 -3.04 -0.03 0.00 0.00 0.00 0.00 36.38 33.22 3dgg s VAL 142 CO 0.00 0.52 0.01 -0.89 0.00 0.00 0.00 175.10 174.75 3dgg s THR 143 N -0.11 4.37 0.38 3.92 2.01 -1.26 -0.50 115.64 124.44 3dgg s THR 143 Ca 0.06 -0.21 0.08 0.00 0.31 0.00 0.00 61.69 61.93 3dgg s THR 143 Cb -0.12 -2.89 -0.07 0.00 0.01 0.00 0.00 72.50 69.42 3dgg s THR 143 CO 0.01 0.54 -0.03 -0.76 -0.69 0.00 0.00 174.62 173.70 3dgg s LEU 144 N -0.25 2.79 0.22 4.42 1.43 0.50 -4.61 118.68 123.18 3dgg s LEU 144 Ca 0.06 -1.30 -0.06 0.00 -1.03 0.00 0.00 54.13 51.80 3dgg s LEU 144 Cb -0.12 -0.91 -0.02 0.00 0.03 0.00 0.00 46.19 45.16 3dgg s LEU 144 CO 0.02 -0.36 0.28 -0.83 0.23 0.00 0.00 176.35 175.68 3dgg s GLY 145 N -3.66 1.04 -0.14 -3.19 0.00 -0.64 -1.28 107.32 99.45 3dgg s GLY 145 Ca 0.34 -1.34 -0.06 0.00 0.00 0.00 0.00 44.72 43.66 3dgg s GLY 145 CO 0.17 -1.07 0.31 0.00 0.00 0.00 0.00 173.10 172.52 3dgg s LEU 147 N 2.08 3.48 -0.44 0.00 2.96 0.23 -1.52 118.68 125.48 3dgg s LEU 147 Ca -0.03 -0.11 0.01 0.00 -0.22 0.00 0.00 54.13 53.78 3dgg s LEU 147 Cb -0.11 -1.89 0.12 0.00 0.50 0.00 0.00 46.19 44.81 3dgg s LEU 147 CO -0.10 0.08 0.20 -0.69 -1.32 0.00 0.00 176.35 174.52 3dgg s VAL 148 N 0.90 2.84 -0.06 1.68 1.01 0.20 -0.52 120.40 126.46 3dgg s VAL 148 Ca 0.02 -2.58 0.04 0.00 0.00 0.00 0.00 61.98 59.47 3dgg s VAL 148 Cb -0.14 -2.98 -0.02 0.00 0.00 0.00 0.00 36.38 33.24 3dgg s VAL 148 CO 0.02 -0.71 -0.18 -0.75 0.00 0.00 0.00 175.10 173.48 3dgg s LYS 149 N 0.56 2.56 -0.65 2.72 2.20 0.58 -1.09 119.74 126.62 3dgg s LYS 149 Ca 0.12 -0.78 -0.01 0.00 -0.36 0.00 0.00 55.97 54.94 3dgg s LYS 149 Cb -0.22 -2.31 0.00 0.00 -1.51 0.00 0.00 37.83 33.79 3dgg s LYS 149 CO -0.05 0.51 0.55 0.41 -0.36 0.00 0.00 175.35 176.42 3dgg n GLY 150 N 2.61 0.07 3.77 5.54 0.00 -0.20 -0.44 105.19 116.55 3dgg n GLY 150 Ca -0.17 -0.18 -0.25 0.00 0.00 0.00 0.00 46.02 45.42 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 -3.18 3.04 -0.20 1.61 1.13 -0.64 -4.48 117.35 114.64 3dgg s TYR 151 Ca 0.09 -0.09 -0.18 0.00 -1.41 0.00 0.00 57.07 55.49 3dgg s TYR 151 Cb -0.04 -1.42 0.05 0.00 -1.10 0.00 0.00 41.96 39.45 3dgg s TYR 151 CO 0.38 0.53 0.52 0.12 -2.51 0.00 0.00 175.55 174.59 3dgg s PHE 152 N -1.93 -0.58 0.30 -3.49 5.36 -0.18 -0.65 117.98 116.80 3dgg s PHE 152 Ca 0.31 1.40 -0.02 0.00 -0.96 0.00 0.00 56.93 57.66 3dgg s PHE 152 Cb -0.09 0.21 0.06 0.00 -0.34 0.00 0.00 43.02 42.86 3dgg s PHE 152 CO 0.23 -0.28 0.41 -0.35 -1.46 0.00 0.00 175.22 173.76 3dgg n PRO 153 N 2.89 0.05 -1.43 10.12 -0.04 -1.26 -0.64 135.00 144.70 3dgg n PRO 153 Ca -0.14 -0.90 -0.33 0.00 -0.04 0.00 0.00 63.50 62.10 3dgg n PRO 153 Cb 0.56 -0.33 0.08 0.00 -0.04 0.00 0.00 33.50 33.77 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 -3.62 2.28 0.56 0.54 0.41 -1.26 -4.73 118.70 112.88 3dgg s GLU 154 Ca 0.25 1.46 0.06 0.00 -0.41 0.00 0.00 54.97 56.34 3dgg s GLU 154 Cb -0.01 -1.88 0.07 0.00 -1.78 0.00 0.00 34.13 30.53 3dgg s GLU 154 CO 0.17 -1.67 0.77 -1.25 -0.49 0.00 0.00 175.26 172.79 3dgg s PRO 155 N -4.28 2.36 0.09 0.39 0.04 -1.26 -5.00 135.00 127.34 3dgg s PRO 155 Ca 0.68 -1.33 0.08 0.00 0.04 0.00 0.00 61.00 60.47 3dgg s PRO 155 Cb -0.22 -2.60 -0.03 0.00 0.04 0.00 0.00 34.50 31.68 3dgg s PRO 155 CO 0.48 -0.80 -0.20 0.54 0.04 0.00 0.00 177.00 177.06 3dgg s VAL 156 N -2.69 1.60 -0.14 -0.36 0.11 -1.26 -4.54 120.40 113.12 3dgg s VAL 156 Ca 0.60 -1.49 0.01 0.00 -2.93 0.00 0.00 61.98 58.17 3dgg s VAL 156 Cb -0.07 -1.47 -0.00 0.00 -1.53 0.00 0.00 36.38 33.31 3dgg s VAL 156 CO 0.38 -0.08 -0.18 -0.89 -3.33 0.00 0.00 175.10 171.00 3dgg s THR 157 N -1.17 2.49 -0.11 5.04 2.01 -0.47 -4.98 115.64 118.45 3dgg s THR 157 Ca 0.05 -0.84 0.02 0.00 0.31 0.00 0.00 61.69 61.23 3dgg s THR 157 Cb -0.10 -2.03 -0.01 0.00 0.01 0.00 0.00 72.50 70.37 3dgg s THR 157 CO 0.04 0.53 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.63 3dgg s VAL 158 N 0.71 2.67 0.18 3.82 1.01 -1.26 -1.52 120.40 126.01 3dgg s VAL 158 Ca -0.08 -0.80 0.03 0.00 0.00 0.00 0.00 61.98 61.13 3dgg s VAL 158 Cb -0.16 -2.08 -0.05 0.00 0.00 0.00 0.00 36.38 34.09 3dgg s VAL 158 CO 0.01 0.54 -0.03 0.42 0.00 0.00 0.00 175.10 176.04 3dgg s THR 159 N 0.29 0.91 -0.12 3.92 -4.23 -0.34 -4.98 115.64 111.08 3dgg s THR 159 Ca -0.13 -2.01 0.02 0.00 -1.18 0.00 0.00 61.69 58.39 3dgg s THR 159 Cb -0.16 -2.10 0.01 0.00 1.34 0.00 0.00 72.50 71.59 3dgg s THR 159 CO 0.07 -0.51 -0.17 0.26 -0.54 0.00 0.00 174.62 173.72 3dgg s TRP 160 N -3.50 2.20 -1.58 3.99 0.52 -1.26 -0.24 118.94 119.07 3dgg s TRP 160 Ca 0.23 -1.07 -0.08 0.00 0.02 0.00 0.00 56.10 55.20 3dgg s TRP 160 Cb 0.05 -1.55 0.08 0.00 -1.15 0.00 0.00 33.47 30.89 3dgg s TRP 160 CO 0.04 -0.52 0.48 0.09 0.02 0.00 0.00 176.95 177.05 3dgg n ASN 161 N 4.17 -1.21 -3.81 2.95 4.13 -0.01 -1.40 115.26 120.09 3dgg n ASN 161 Ca -0.19 -1.08 -0.28 0.00 1.68 0.00 0.00 54.58 54.70 3dgg n ASN 161 Cb 0.51 -2.54 0.04 0.00 -1.54 0.00 0.00 39.78 36.26 3dgg n ASN 161 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 3dgg n SER 162 N -2.81 -5.07 0.00 6.41 7.64 -1.26 -1.54 113.62 116.99 3dgg n SER 162 Ca -0.15 -0.71 0.00 0.00 1.01 0.00 0.00 58.87 59.02 3dgg n SER 162 Cb 0.60 -4.24 0.00 0.00 -1.01 0.00 0.00 64.21 59.56 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 -1.77 1.36 0.28 0.23 0.00 -0.49 -4.93 105.19 99.87 3dgg n GLY 163 Ca 0.01 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.15 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 0.00 -0.38 1.61 0.02 -0.93 -2.78 113.55 111.10 3dgg h SER 164 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3dgg h SER 164 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 3dgg h SER 164 CO 0.00 0.00 0.00 0.18 -1.14 0.00 0.00 176.83 175.87 3dgg n LEU 165 N -4.31 4.09 -0.46 5.07 4.77 -1.08 -4.76 117.00 120.32 3dgg n LEU 165 Ca -0.02 -2.73 0.41 0.00 -0.03 0.00 0.00 56.01 53.64 3dgg n LEU 165 Cb 0.15 -0.51 0.75 0.00 -2.33 0.00 0.00 43.42 41.48 3dgg n LEU 165 CO 0.32 0.70 1.37 0.28 -1.33 0.00 0.00 177.39 178.73 3dgg h SER 166 N 2.47 0.05 -0.55 -1.43 0.02 -1.73 -2.86 113.55 109.51 3dgg h SER 166 Ca 0.00 0.02 0.08 0.00 -0.84 0.00 0.00 61.79 61.04 3dgg h SER 166 Cb 1.39 0.01 -0.06 0.00 0.14 0.00 0.00 62.40 63.88 3dgg h SER 166 CO 0.22 -0.01 0.21 0.28 -1.14 0.00 0.00 176.83 176.39 3dgg h SER 167 N 0.03 0.23 -0.86 3.07 0.02 -1.87 -2.78 113.55 111.38 3dgg h SER 167 Ca 0.71 0.06 -0.59 0.00 -0.84 0.00 0.00 61.79 61.14 3dgg h SER 167 Cb 2.76 0.04 -0.33 0.00 0.14 0.00 0.00 62.40 65.01 3dgg h SER 167 CO -0.06 0.15 0.17 0.61 -1.14 0.00 0.00 176.83 176.56 3dgg n GLY 168 N -1.28 5.95 3.54 -3.77 0.00 -1.08 -5.00 105.19 103.56 3dgg n GLY 168 Ca 0.07 -2.31 -0.34 0.00 0.00 0.00 0.00 46.02 43.43 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 -4.57 3.95 -0.21 1.61 1.01 -1.05 -0.79 120.40 120.35 3dgg s VAL 169 Ca 0.58 -0.35 0.00 0.00 0.00 0.00 0.00 61.98 62.21 3dgg s VAL 169 Cb 0.46 -2.71 0.05 0.00 0.00 0.00 0.00 36.38 34.19 3dgg s VAL 169 CO 0.01 0.52 -0.05 -1.00 0.00 0.00 0.00 175.10 174.59 3dgg s HIS 170 N 0.02 2.09 -0.27 5.22 3.76 -0.33 -4.99 115.29 120.79 3dgg s HIS 170 Ca 0.01 -1.48 -0.10 0.00 -0.15 0.00 0.00 55.06 53.34 3dgg s HIS 170 Cb -0.13 -1.47 -0.04 0.00 1.11 0.00 0.00 32.58 32.05 3dgg s HIS 170 CO 0.03 -0.72 0.15 0.99 -0.85 0.00 0.00 174.74 174.34 3dgg s THR 171 N 1.50 5.02 0.27 1.30 2.01 -1.26 -0.23 115.64 124.25 3dgg s THR 171 Ca -0.03 0.07 -0.12 0.00 0.31 0.00 0.00 61.69 61.92 3dgg s THR 171 Cb -0.17 -3.38 -0.08 0.00 0.01 0.00 0.00 72.50 68.88 3dgg s THR 171 CO -0.07 0.28 0.63 -0.36 -0.69 0.00 0.00 174.62 174.41 3dgg s PHE 172 N 1.66 3.40 0.33 4.92 0.08 -0.37 -5.01 117.98 123.00 3dgg s PHE 172 Ca 0.07 1.01 -0.29 0.00 0.12 0.00 0.00 56.93 57.84 3dgg s PHE 172 Cb -0.16 -2.37 -0.11 0.00 -0.57 0.00 0.00 43.02 39.81 3dgg s PHE 172 CO 0.08 0.19 1.55 -2.14 -0.10 0.00 0.00 175.22 174.81 3dgg s PRO 173 N -2.91 4.11 0.49 0.24 0.02 -1.26 -4.43 135.00 131.25 3dgg s PRO 173 Ca 0.50 2.59 -0.24 0.00 0.02 0.00 0.00 61.00 63.87 3dgg s PRO 173 Cb -0.11 -2.99 -0.07 0.00 0.02 0.00 0.00 34.50 31.34 3dgg s PRO 173 CO 0.20 -0.60 1.34 0.00 -0.33 0.00 0.00 177.00 177.61 3dgg n ALA 174 N 1.37 1.58 -2.34 -1.55 0.00 -1.26 -4.83 120.51 113.49 3dgg n ALA 174 Ca 0.05 0.20 -0.30 0.00 0.00 0.00 0.00 53.44 53.38 3dgg n ALA 174 Cb 0.38 -2.33 -0.16 0.00 0.00 0.00 0.00 19.45 17.34 3dgg n ALA 174 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3dgg s VAL 175 N -1.25 1.97 -0.21 0.00 1.01 -0.49 -4.95 120.40 116.49 3dgg s VAL 175 Ca 0.66 -1.09 -0.22 0.00 0.00 0.00 0.00 61.98 61.33 3dgg s VAL 175 Cb -0.45 -1.64 -0.02 0.00 0.00 0.00 0.00 36.38 34.27 3dgg s VAL 175 CO 0.54 0.54 0.69 -0.22 0.00 0.00 0.00 175.10 176.65 3dgg s LEU 176 N -0.64 4.12 -0.09 3.92 2.96 -1.26 -1.55 118.68 126.15 3dgg s LEU 176 Ca 0.10 0.89 -0.02 0.00 -0.22 0.00 0.00 54.13 54.88 3dgg s LEU 176 Cb -0.10 -2.98 0.04 0.00 0.50 0.00 0.00 46.19 43.65 3dgg s LEU 176 CO -0.01 -0.35 0.04 -1.58 -1.32 0.00 0.00 176.35 173.13 3dgg s GLN 177 N 2.22 0.30 -1.28 1.98 0.74 0.11 -4.87 119.66 118.87 3dgg s GLN 177 Ca 0.31 0.12 -0.01 0.00 0.05 0.00 0.00 55.36 55.82 3dgg s GLN 177 Cb -0.16 -1.06 -0.00 0.00 1.10 0.00 0.00 33.01 32.89 3dgg s GLN 177 CO 0.10 -0.40 0.75 -1.13 -0.55 0.00 0.00 175.29 174.06 3dgg n SER 178 N 5.21 -1.62 -0.16 6.67 3.41 -1.26 -2.37 113.62 123.49 3dgg n SER 178 Ca -0.06 -0.80 -0.02 0.00 -0.26 0.00 0.00 58.87 57.73 3dgg n SER 178 Cb 0.50 -4.22 -0.01 0.00 -0.26 0.00 0.00 64.21 60.21 3dgg n SER 178 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3dgg n ASP 179 N -3.06 -4.79 -4.18 4.04 9.92 -1.26 -4.98 116.55 112.23 3dgg n ASP 179 Ca -0.28 0.05 -0.13 0.00 -0.53 0.00 0.00 54.79 53.90 3dgg n ASP 179 Cb 0.67 -2.48 -0.10 0.00 -0.64 0.00 0.00 41.12 38.57 3dgg n ASP 179 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 3dgg s LEU 180 N -0.49 2.47 0.00 0.64 1.43 -1.00 -4.62 118.68 117.12 3dgg s LEU 180 Ca 0.00 -0.92 -0.05 0.00 -1.03 0.00 0.00 54.13 52.13 3dgg s LEU 180 Cb 0.00 -0.21 -0.05 0.00 0.03 0.00 0.00 46.19 45.96 3dgg s LEU 180 CO 0.00 -0.36 0.24 -0.31 0.23 0.00 0.00 176.35 176.15 3dgg s TYR 181 N -3.06 3.57 -0.02 0.29 2.02 0.17 0.08 117.35 120.40 3dgg s TYR 181 Ca 0.10 0.50 0.02 0.00 -0.37 0.00 0.00 57.07 57.31 3dgg s TYR 181 Cb 0.01 -1.94 0.00 0.00 -0.40 0.00 0.00 41.96 39.64 3dgg s TYR 181 CO -0.02 0.62 -0.05 0.99 -1.57 0.00 0.00 175.55 175.52 3dgg s THR 182 N -1.31 0.47 0.18 -0.71 2.01 -0.59 -1.03 115.64 114.66 3dgg s THR 182 Ca 0.28 -0.21 -0.04 0.00 0.31 0.00 0.00 61.69 62.03 3dgg s THR 182 Cb -0.13 -0.43 -0.03 0.00 0.01 0.00 0.00 72.50 71.92 3dgg s THR 182 CO 0.17 0.16 0.19 -1.48 -0.69 0.00 0.00 174.62 172.96 3dgg s LEU 183 N 0.17 1.17 0.23 4.42 0.05 -0.25 -1.40 118.68 123.07 3dgg s LEU 183 Ca -0.02 -1.17 0.05 0.00 0.05 0.00 0.00 54.13 53.04 3dgg s LEU 183 Cb -0.06 0.71 -0.05 0.00 -2.05 0.00 0.00 46.19 44.74 3dgg s LEU 183 CO -0.00 -0.86 -0.05 -0.44 -0.55 0.00 0.00 176.35 174.44 3dgg s SER 184 N -3.07 2.20 -0.05 1.48 0.01 -1.26 -0.62 113.70 112.39 3dgg s SER 184 Ca 0.28 -1.15 -0.04 0.00 1.31 0.00 0.00 55.95 56.35 3dgg s SER 184 Cb 0.05 -0.07 0.02 0.00 0.21 0.00 0.00 66.02 66.24 3dgg s SER 184 CO 0.06 -0.39 0.12 -0.55 0.41 0.00 0.00 173.24 172.89 3dgg s SER 185 N -3.33 -0.11 0.11 2.44 0.15 -0.57 -1.23 113.70 111.16 3dgg s SER 185 Ca 0.26 0.24 0.09 0.00 0.70 0.00 0.00 55.95 57.23 3dgg s SER 185 Cb 0.04 0.21 -0.04 0.00 -1.71 0.00 0.00 66.02 64.52 3dgg s SER 185 CO 0.08 -0.07 -0.17 -0.94 1.20 0.00 0.00 173.24 173.34 3dgg s SER 186 N 0.34 3.92 -0.02 5.45 1.04 0.67 -1.21 113.70 123.89 3dgg s SER 186 Ca -0.02 -0.54 0.02 0.00 0.48 0.00 0.00 55.95 55.89 3dgg s SER 186 Cb -0.04 -0.57 0.00 0.00 0.10 0.00 0.00 66.02 65.52 3dgg s SER 186 CO -0.01 0.18 -0.07 0.54 0.98 0.00 0.00 173.24 174.86 3dgg s VAL 187 N -1.14 0.66 -0.21 5.02 0.11 -0.40 -1.18 120.40 123.26 3dgg s VAL 187 Ca 0.18 -0.29 -0.03 0.00 -2.93 0.00 0.00 61.98 58.90 3dgg s VAL 187 Cb -0.11 -0.60 -0.01 0.00 -1.53 0.00 0.00 36.38 34.14 3dgg s VAL 187 CO 0.10 0.21 -0.06 0.28 -3.33 0.00 0.00 175.10 172.31 3dgg s THR 188 N 0.23 3.31 0.11 5.04 -1.32 0.03 -0.37 115.64 122.66 3dgg s THR 188 Ca -0.03 -0.52 0.04 0.00 -1.21 0.00 0.00 61.69 59.96 3dgg s THR 188 Cb -0.08 -2.49 -0.04 0.00 -1.51 0.00 0.00 72.50 68.38 3dgg s THR 188 CO 0.00 0.44 -0.10 0.68 -2.21 0.00 0.00 174.62 173.43 3dgg s VAL 189 N 1.34 0.99 0.50 5.08 -7.23 0.34 -4.54 120.40 116.88 3dgg s VAL 189 Ca 0.04 -1.83 -0.23 0.00 -1.81 0.00 0.00 61.98 58.15 3dgg s VAL 189 Cb -0.14 -1.58 -0.06 0.00 0.56 0.00 0.00 36.38 35.16 3dgg s VAL 189 CO -0.03 -0.67 1.38 -2.84 -0.31 0.00 0.00 175.10 172.63 3dgg s PRO 190 N -3.27 3.39 0.51 4.82 0.02 -1.26 0.61 135.00 139.82 3dgg s PRO 190 Ca 0.10 2.29 0.19 0.00 0.02 0.00 0.00 61.00 63.60 3dgg s PRO 190 Cb 0.00 -2.42 1.28 0.00 0.02 0.00 0.00 34.50 33.37 3dgg s PRO 190 CO -0.00 -1.01 2.08 0.77 -0.33 0.00 0.00 177.00 178.50 3dgg h SER 191 N 1.83 0.05 0.76 2.53 0.02 -1.79 0.63 113.55 117.59 3dgg h SER 191 Ca -0.51 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.44 3dgg h SER 191 Cb 1.28 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.81 3dgg h SER 191 CO 0.59 0.03 0.00 0.77 -1.14 0.00 0.00 176.83 177.08 3dgg h SER 192 N 0.06 0.00 0.28 3.07 4.64 -1.91 -3.23 113.55 116.46 3dgg h SER 192 Ca 0.12 0.00 -0.33 0.00 -0.47 0.00 0.00 61.79 61.11 3dgg h SER 192 Cb 0.41 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.46 3dgg h SER 192 CO -0.01 0.00 -1.94 0.35 -0.87 0.00 0.00 176.83 174.36 3dgg n THR 193 N -2.37 1.62 -4.75 2.95 -2.24 0.21 -4.72 114.28 104.97 3dgg n THR 193 Ca 0.02 -0.75 -0.24 0.00 -2.27 0.00 0.00 64.05 60.81 3dgg n THR 193 Cb 0.24 -1.17 -0.15 0.00 -2.10 0.00 0.00 70.33 67.15 3dgg n THR 193 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 3dgg s TRP 194 N -2.57 1.44 -2.26 4.78 -0.00 -1.17 -0.63 118.94 118.54 3dgg s TRP 194 Ca -0.12 -0.29 0.21 0.00 -0.00 0.00 0.00 56.10 55.90 3dgg s TRP 194 Cb 0.07 -0.94 0.83 0.00 -0.00 0.00 0.00 33.47 33.43 3dgg s TRP 194 CO 0.79 -0.04 1.59 -0.35 -0.00 0.00 0.00 176.95 178.94 3dgg n PRO 195 N 2.75 1.63 -0.22 5.86 -0.04 -1.26 -4.72 135.00 139.00 3dgg n PRO 195 Ca -0.15 -0.95 0.02 0.00 -0.04 0.00 0.00 63.50 62.39 3dgg n PRO 195 Cb 0.54 -1.39 0.13 0.00 -0.04 0.00 0.00 33.50 32.74 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 1.95 0.03 -2.60 3.54 4.64 -1.85 -3.41 113.55 115.84 3dgg h SER 196 Ca 0.00 0.12 -0.56 0.00 -0.47 0.00 0.00 61.79 60.88 3dgg h SER 196 Cb 0.42 0.16 -0.07 0.00 -0.31 0.00 0.00 62.40 62.60 3dgg h SER 196 CO 0.00 0.01 -0.57 -1.61 -0.87 0.00 0.00 176.83 173.79 3dgg s GLU 197 N -6.09 2.83 0.04 4.77 0.41 0.20 -5.10 118.70 115.77 3dgg s GLU 197 Ca -0.13 -0.95 -0.26 0.00 -0.41 0.00 0.00 54.97 53.22 3dgg s GLU 197 Cb 0.19 -2.58 -0.05 0.00 -1.78 0.00 0.00 34.13 29.91 3dgg s GLU 197 CO 0.75 0.46 0.79 0.95 -0.49 0.00 0.00 175.26 177.72 3dgg s THR 198 N -1.84 4.74 -0.07 3.63 -4.23 -1.26 -4.51 115.64 112.09 3dgg s THR 198 Ca 0.31 1.69 0.05 0.00 -1.18 0.00 0.00 61.69 62.55 3dgg s THR 198 Cb -0.09 -4.14 -0.00 0.00 1.34 0.00 0.00 72.50 69.60 3dgg s THR 198 CO 0.23 0.34 -0.23 -0.69 -0.54 0.00 0.00 174.62 173.73 3dgg s VAL 199 N 0.08 1.95 -0.04 2.29 1.01 -1.26 -5.02 120.40 119.40 3dgg s VAL 199 Ca 0.40 -0.98 0.01 0.00 0.00 0.00 0.00 61.98 61.41 3dgg s VAL 199 Cb -0.21 -1.67 0.02 0.00 0.00 0.00 0.00 36.38 34.52 3dgg s VAL 199 CO 0.24 0.54 -0.05 -0.89 0.00 0.00 0.00 175.10 174.93 3dgg s THR 200 N 0.11 0.57 -0.07 3.92 2.01 -1.26 -0.64 115.64 120.28 3dgg s THR 200 Ca -0.11 -0.17 -0.16 0.00 0.31 0.00 0.00 61.69 61.56 3dgg s THR 200 Cb -0.15 -0.57 -0.05 0.00 0.01 0.00 0.00 72.50 71.73 3dgg s THR 200 CO 0.06 0.22 0.43 0.00 -0.69 0.00 0.00 174.62 174.64 3dgg s ASN 202 N -0.13 4.85 -0.09 0.00 -0.87 0.66 -1.11 114.94 118.25 3dgg s ASN 202 Ca 0.24 -0.14 0.03 0.00 -1.57 0.00 0.00 52.86 51.42 3dgg s ASN 202 Cb -0.16 -1.80 0.01 0.00 -0.02 0.00 0.00 41.25 39.28 3dgg s ASN 202 CO 0.11 0.14 -0.18 -0.69 -2.57 0.00 0.00 177.10 173.91 3dgg s VAL 203 N 0.54 1.61 -0.11 1.60 1.01 0.21 -1.20 120.40 124.06 3dgg s VAL 203 Ca -0.02 -0.75 0.02 0.00 0.00 0.00 0.00 61.98 61.23 3dgg s VAL 203 Cb -0.14 -1.43 -0.01 0.00 0.00 0.00 0.00 36.38 34.80 3dgg s VAL 203 CO 0.02 0.46 -0.17 0.00 0.00 0.00 0.00 175.10 175.41 3dgg s ALA 204 N 0.58 2.45 -0.45 5.51 0.00 -0.58 -0.91 121.76 128.36 3dgg s ALA 204 Ca -0.15 -0.93 0.02 0.00 0.00 0.00 0.00 51.96 50.91 3dgg s ALA 204 Cb -0.17 -1.04 0.13 0.00 0.00 0.00 0.00 23.12 22.05 3dgg s ALA 204 CO 0.05 0.29 0.24 -1.58 0.00 0.00 0.00 175.76 174.76 3dgg s HIS 205 N 0.25 2.25 0.33 0.00 2.46 -0.23 -1.36 115.29 118.99 3dgg s HIS 205 Ca -0.12 -2.58 0.05 0.00 0.47 0.00 0.00 55.06 52.88 3dgg s HIS 205 Cb -0.16 -2.10 0.67 0.00 -0.13 0.00 0.00 32.58 30.87 3dgg s HIS 205 CO 0.06 -0.78 1.90 -1.35 -2.47 0.00 0.00 174.74 172.10 3dgg h PRO 206 N 6.71 0.83 -0.60 2.88 0.11 -1.80 -1.49 132.00 138.64 3dgg h PRO 206 Ca -0.03 -0.05 0.03 0.00 0.11 0.00 0.00 66.00 66.06 3dgg h PRO 206 Cb 0.92 -0.19 -0.03 0.00 0.11 0.00 0.00 31.00 31.81 3dgg h PRO 206 CO 0.53 0.55 0.40 0.00 -0.21 0.00 0.00 178.00 179.26 3dgg h ALA 207 N 1.56 1.67 -0.48 -0.75 0.00 -1.93 -0.45 119.26 118.89 3dgg h ALA 207 Ca 0.41 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.29 3dgg h ALA 207 Cb 0.43 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.02 3dgg h ALA 207 CO -0.17 0.26 0.00 -1.13 0.00 0.00 0.00 179.25 178.21 3dgg n SER 208 N -4.46 3.46 -3.71 0.00 3.41 -1.02 -4.99 113.62 106.30 3dgg n SER 208 Ca 0.07 -1.96 -0.27 0.00 -0.26 0.00 0.00 58.87 56.45 3dgg n SER 208 Cb 0.13 -0.31 0.03 0.00 -0.26 0.00 0.00 64.21 63.80 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 1.34 -3.44 -4.43 4.04 7.64 -0.18 -4.98 113.62 113.61 3dgg n SER 209 Ca 0.19 -0.95 -0.33 0.00 1.01 0.00 0.00 58.87 58.79 3dgg n SER 209 Cb 0.56 -3.58 -0.13 0.00 -1.01 0.00 0.00 64.21 60.05 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 -3.61 3.43 -0.16 0.44 2.01 -0.64 -5.00 115.64 112.11 3dgg s THR 210 Ca 0.27 -0.53 -0.03 0.00 0.31 0.00 0.00 61.69 61.71 3dgg s THR 210 Cb -0.09 -2.46 0.05 0.00 0.01 0.00 0.00 72.50 70.01 3dgg s THR 210 CO 0.85 0.52 0.05 -0.54 -0.69 0.00 0.00 174.62 174.80 3dgg s LYS 211 N 0.28 0.43 -0.00 4.92 1.02 -1.26 -1.06 119.74 124.07 3dgg s LYS 211 Ca -0.07 -0.18 0.07 0.00 0.02 0.00 0.00 55.97 55.81 3dgg s LYS 211 Cb -0.15 -1.73 -0.02 0.00 -0.52 0.00 0.00 37.83 35.41 3dgg s LYS 211 CO 0.04 -0.57 -0.22 0.08 -0.92 0.00 0.00 175.35 173.76 3dgg s VAL 212 N 1.98 1.77 -0.12 3.17 1.01 -0.09 -4.98 120.40 123.13 3dgg s VAL 212 Ca 0.01 -1.02 0.02 0.00 0.00 0.00 0.00 61.98 60.99 3dgg s VAL 212 Cb -0.16 -1.49 -0.00 0.00 0.00 0.00 0.00 36.38 34.73 3dgg s VAL 212 CO -0.07 0.45 -0.19 -1.81 0.00 0.00 0.00 175.10 173.47 3dgg s ASP 213 N -0.67 3.47 -0.17 3.32 1.01 -1.26 -0.62 116.67 121.76 3dgg s ASP 213 Ca 0.09 -0.48 0.01 0.00 0.71 0.00 0.00 52.55 52.88 3dgg s ASP 213 Cb -0.09 -1.50 0.02 0.00 1.01 0.00 0.00 42.92 42.36 3dgg s ASP 213 CO -0.00 0.14 -0.17 -0.54 0.21 0.00 0.00 175.17 174.81 3dgg s LYS 214 N 0.48 2.66 0.14 8.23 -0.14 -0.27 -4.99 119.74 125.86 3dgg s LYS 214 Ca -0.13 -0.72 -0.30 0.00 -1.36 0.00 0.00 55.97 53.47 3dgg s LYS 214 Cb -0.17 -2.37 -0.07 0.00 -1.68 0.00 0.00 37.83 33.55 3dgg s LYS 214 CO 0.05 -0.23 0.99 0.21 -0.76 0.00 0.00 175.35 175.61 3dgg s LYS 215 N 1.38 4.70 -0.45 1.68 2.20 -1.26 -1.33 119.74 126.65 3dgg s LYS 215 Ca 0.05 1.51 -0.25 0.00 -0.36 0.00 0.00 55.97 56.92 3dgg s LYS 215 Cb -0.13 -3.35 0.03 0.00 -1.51 0.00 0.00 37.83 32.87 3dgg s LYS 215 CO -0.12 0.22 0.88 0.42 -0.36 0.00 0.00 175.35 176.39 3dgg s ILE 216 N -0.19 4.54 -0.03 5.43 -1.09 0.19 -4.86 121.20 125.19 3dgg s ILE 216 Ca 0.47 0.67 -0.00 0.00 -2.23 0.00 0.00 60.65 59.55 3dgg s ILE 216 Cb -0.25 -4.39 -0.04 0.00 -1.58 0.00 0.00 42.46 36.21 3dgg s ILE 216 CO 0.31 -0.77 0.02 -0.69 -1.23 0.00 0.00 174.94 172.58 3dgg s VAL 217 N 3.58 4.38 0.63 2.92 1.01 -1.26 -4.59 120.40 127.07 3dgg s VAL 217 Ca 0.35 -0.42 -0.18 0.00 0.00 0.00 0.00 61.98 61.73 3dgg s VAL 217 Cb -0.11 -2.93 -0.03 0.00 0.00 0.00 0.00 36.38 33.31 3dgg s VAL 217 CO 0.25 0.45 1.08 -2.65 0.00 0.00 0.00 175.10 174.23 3dgg n PRO 218 N 1.60 0.93 -2.06 2.72 -0.02 -1.26 -4.70 135.00 132.21 3dgg n PRO 218 Ca -0.16 0.37 -0.27 0.00 -2.02 0.00 0.00 63.50 61.42 3dgg n PRO 218 Cb 0.53 -2.31 -0.05 0.00 -0.02 0.00 0.00 33.50 31.66 3dgg n PRO 218 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 3dgg s ARG 219 N -3.04 2.58 0.00 -0.52 0.52 -1.26 -5.10 118.95 112.13 3dgg s ARG 219 Ca 0.79 -0.33 0.30 0.00 -0.52 0.00 0.00 55.73 55.97 3dgg s ARG 219 Cb -0.40 -5.07 1.41 0.00 0.52 0.00 0.00 34.95 31.41 3dgg s ARG 219 CO 0.44 -3.36 1.95 -3.47 0.02 0.00 0.00 175.30 170.88