#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dgg s ILE 2 N 0.00 2.90 -0.17 2.12 1.01 -1.26 -4.85 121.20 120.95 3dgg s ILE 2 Ca 0.00 -1.01 -0.17 0.00 0.00 0.00 0.00 60.65 59.47 3dgg s ILE 2 Cb 0.00 -2.47 -0.04 0.00 0.01 0.00 0.00 42.46 39.96 3dgg s ILE 2 CO 0.00 0.20 0.46 0.68 0.00 0.00 0.00 174.94 176.28 3dgg s VAL 3 N 1.33 5.17 -0.24 2.92 -7.23 -1.26 -4.94 120.40 116.15 3dgg s VAL 3 Ca 0.00 0.87 -0.15 0.00 -1.81 0.00 0.00 61.98 60.89 3dgg s VAL 3 Cb -0.17 -3.79 -0.04 0.00 0.56 0.00 0.00 36.38 32.94 3dgg s VAL 3 CO -0.04 0.25 0.37 -0.76 -0.31 0.00 0.00 175.10 174.61 3dgg s LEU 4 N 1.17 4.09 -0.33 1.32 1.43 -1.26 -2.81 118.68 122.28 3dgg s LEU 4 Ca 0.23 0.36 -0.06 0.00 -1.03 0.00 0.00 54.13 53.63 3dgg s LEU 4 Cb -0.15 -2.43 0.04 0.00 0.03 0.00 0.00 46.19 43.67 3dgg s LEU 4 CO 0.09 -0.13 0.09 -0.89 0.23 0.00 0.00 176.35 175.75 3dgg s THR 5 N 1.72 3.74 0.01 5.49 2.01 -0.06 -4.69 115.64 123.85 3dgg s THR 5 Ca 0.16 -1.12 -0.11 0.00 0.31 0.00 0.00 61.69 60.93 3dgg s THR 5 Cb -0.15 -3.10 -0.05 0.00 0.01 0.00 0.00 72.50 69.20 3dgg s THR 5 CO 0.09 -0.15 0.35 -1.58 -0.69 0.00 0.00 174.62 172.64 3dgg s GLN 6 N 1.40 3.77 -0.02 4.92 0.74 -1.26 -1.38 119.66 127.84 3dgg s GLN 6 Ca -0.02 0.22 -0.20 0.00 0.05 0.00 0.00 55.36 55.42 3dgg s GLN 6 Cb -0.19 -3.14 0.04 0.00 1.10 0.00 0.00 33.01 30.81 3dgg s GLN 6 CO 0.03 0.66 0.43 -1.54 -0.55 0.00 0.00 175.29 174.32 3dgg s SER 7 N -1.32 -0.33 0.58 6.67 1.04 0.52 -4.64 113.70 116.22 3dgg s SER 7 Ca 0.25 0.25 -0.06 0.00 0.48 0.00 0.00 55.95 56.87 3dgg s SER 7 Cb -0.15 0.39 -0.00 0.00 0.10 0.00 0.00 66.02 66.36 3dgg s SER 7 CO 0.14 -0.52 0.90 -2.16 0.98 0.00 0.00 173.24 172.57 3dgg s PRO 8 N -1.45 3.05 0.37 4.02 0.04 -1.26 -0.43 135.00 139.33 3dgg s PRO 8 Ca -0.12 0.09 0.07 0.00 0.04 0.00 0.00 61.00 61.09 3dgg s PRO 8 Cb -0.03 -2.26 0.72 0.00 0.04 0.00 0.00 34.50 32.97 3dgg s PRO 8 CO 0.05 -0.64 1.91 0.00 0.04 0.00 0.00 177.00 178.36 3dgg h ALA 9 N -0.15 1.47 -3.45 8.56 0.00 -1.82 -3.40 119.26 120.47 3dgg h ALA 9 Ca -0.46 -0.19 -0.31 0.00 0.00 0.00 0.00 54.91 53.96 3dgg h ALA 9 Cb 1.24 -0.11 -0.24 0.00 0.00 0.00 0.00 17.79 18.68 3dgg h ALA 9 CO 0.61 0.38 -0.75 -1.12 0.00 0.00 0.00 179.25 178.37 3dgg s SER 10 N -6.82 0.86 -0.12 0.00 0.01 -1.26 -1.01 113.70 105.36 3dgg s SER 10 Ca -0.06 -0.40 -0.05 0.00 1.31 0.00 0.00 55.95 56.74 3dgg s SER 10 Cb 0.16 -0.01 0.05 0.00 0.21 0.00 0.00 66.02 66.43 3dgg s SER 10 CO 0.74 -0.10 0.26 -0.22 0.41 0.00 0.00 173.24 174.34 3dgg s LEU 11 N -1.09 0.10 -0.17 2.44 2.96 -0.74 -4.92 118.68 117.25 3dgg s LEU 11 Ca -0.05 0.57 -0.02 0.00 -0.22 0.00 0.00 54.13 54.41 3dgg s LEU 11 Cb -0.07 0.75 -0.01 0.00 0.50 0.00 0.00 46.19 47.36 3dgg s LEU 11 CO 0.00 -0.20 -0.10 0.00 -1.32 0.00 0.00 176.35 174.74 3dgg s ALA 12 N 1.74 2.68 0.02 5.97 0.00 -1.26 -0.33 121.76 130.58 3dgg s ALA 12 Ca -0.05 -1.04 0.02 0.00 0.00 0.00 0.00 51.96 50.89 3dgg s ALA 12 Cb -0.11 -1.42 -0.01 0.00 0.00 0.00 0.00 23.12 21.57 3dgg s ALA 12 CO -0.09 -0.10 -0.06 0.14 0.00 0.00 0.00 175.76 175.65 3dgg s VAL 13 N 0.93 0.43 0.63 0.00 -7.23 -0.64 -4.89 120.40 109.63 3dgg s VAL 13 Ca -0.02 -0.58 -0.16 0.00 -1.81 0.00 0.00 61.98 59.41 3dgg s VAL 13 Cb -0.15 -0.43 -0.02 0.00 0.56 0.00 0.00 36.38 36.34 3dgg s VAL 13 CO -0.00 -0.11 1.11 -0.44 -0.31 0.00 0.00 175.10 175.35 3dgg s SER 14 N -0.75 5.28 0.19 4.85 0.01 -1.26 -1.28 113.70 120.74 3dgg s SER 14 Ca -0.04 2.04 -0.32 0.00 1.31 0.00 0.00 55.95 58.94 3dgg s SER 14 Cb -0.05 -2.56 -0.12 0.00 0.21 0.00 0.00 66.02 63.50 3dgg s SER 14 CO 0.00 -1.51 1.74 -0.11 0.41 0.00 0.00 173.24 173.77 3dgg n LEU 15 N -2.13 3.98 0.00 2.44 7.94 -1.26 -1.90 117.00 126.07 3dgg n LEU 15 Ca 0.11 1.05 0.00 0.00 -1.11 0.00 0.00 56.01 56.06 3dgg n LEU 15 Cb 0.52 -1.57 0.00 0.00 0.53 0.00 0.00 43.42 42.90 3dgg n LEU 15 CO 0.46 0.17 0.00 0.61 -1.11 0.00 0.00 177.39 177.52 3dgg n GLY 16 N 3.99 3.30 3.50 -3.96 0.00 -0.64 -4.96 105.19 106.42 3dgg n GLY 16 Ca 0.16 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.89 3dgg n GLY 16 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3dgg s GLN 17 N -0.63 -1.23 -0.13 1.61 -0.21 -0.80 -4.30 119.66 113.96 3dgg s GLN 17 Ca 0.00 0.40 -0.10 0.00 0.02 0.00 0.00 55.36 55.68 3dgg s GLN 17 Cb 0.00 -1.55 -0.05 0.00 1.00 0.00 0.00 33.01 32.41 3dgg s GLN 17 CO 0.00 -3.82 0.20 0.50 -2.12 0.00 0.00 175.29 170.05 3dgg s ARG 18 N -4.90 3.83 -0.07 2.91 3.52 -1.26 -1.88 118.95 121.09 3dgg s ARG 18 Ca 0.68 -0.04 -0.01 0.00 -0.13 0.00 0.00 55.73 56.23 3dgg s ARG 18 Cb -0.18 -3.29 -0.03 0.00 -1.56 0.00 0.00 34.95 29.89 3dgg s ARG 18 CO 0.60 0.56 -0.02 0.00 -0.81 0.00 0.00 175.30 175.63 3dgg s ALA 19 N -0.43 3.20 -0.08 6.12 0.00 -0.00 -4.99 121.76 125.57 3dgg s ALA 19 Ca 0.15 -0.85 -0.00 0.00 0.00 0.00 0.00 51.96 51.25 3dgg s ALA 19 Cb -0.13 -1.39 0.02 0.00 0.00 0.00 0.00 23.12 21.63 3dgg s ALA 19 CO 0.04 0.59 -0.04 0.99 0.00 0.00 0.00 175.76 177.34 3dgg s THR 20 N -0.89 0.67 -0.07 0.00 2.01 -1.26 -1.56 115.64 114.54 3dgg s THR 20 Ca 0.14 -0.11 0.05 0.00 0.31 0.00 0.00 61.69 62.08 3dgg s THR 20 Cb -0.11 -0.74 -0.01 0.00 0.01 0.00 0.00 72.50 71.65 3dgg s THR 20 CO 0.03 0.29 -0.23 -0.63 -0.69 0.00 0.00 174.62 173.39 3dgg s ILE 21 N 1.55 2.17 0.03 1.82 1.01 -0.31 -4.77 121.20 122.70 3dgg s ILE 21 Ca -0.00 -1.01 0.06 0.00 0.00 0.00 0.00 60.65 59.69 3dgg s ILE 21 Cb -0.13 -1.81 -0.03 0.00 0.01 0.00 0.00 42.46 40.50 3dgg s ILE 21 CO -0.04 0.57 -0.13 -0.44 0.00 0.00 0.00 174.94 174.90 3dgg s SER 22 N -0.03 4.19 -0.05 3.58 0.01 0.43 -0.50 113.70 121.33 3dgg s SER 22 Ca -0.07 -0.31 -0.02 0.00 1.31 0.00 0.00 55.95 56.86 3dgg s SER 22 Cb -0.15 -0.82 0.03 0.00 0.21 0.00 0.00 66.02 65.29 3dgg s SER 22 CO 0.05 0.26 0.03 0.00 0.41 0.00 0.00 173.24 173.99 3dgg s ARG 24 N 1.98 1.67 0.07 0.00 1.70 -0.48 -0.65 118.95 123.24 3dgg s ARG 24 Ca 0.03 -1.78 0.05 0.00 -0.47 0.00 0.00 55.73 53.57 3dgg s ARG 24 Cb -0.12 -1.69 -0.03 0.00 -0.57 0.00 0.00 34.95 32.54 3dgg s ARG 24 CO -0.04 0.29 -0.14 0.00 -1.08 0.00 0.00 175.30 174.33 3dgg s ALA 25 N -2.57 1.15 0.33 7.88 0.00 -0.37 -0.88 121.76 127.29 3dgg s ALA 25 Ca 0.30 -0.97 0.13 0.00 0.00 0.00 0.00 51.96 51.42 3dgg s ALA 25 Cb -0.03 -0.10 0.66 0.00 0.00 0.00 0.00 23.12 23.65 3dgg s ALA 25 CO 0.14 0.17 1.78 0.66 0.00 0.00 0.00 175.76 178.51 3dgg h SER 26 N 4.37 0.00 -3.10 0.00 4.64 -1.85 -3.44 113.55 114.17 3dgg h SER 26 Ca -0.40 0.00 -0.47 0.00 -0.47 0.00 0.00 61.79 60.45 3dgg h SER 26 Cb 1.19 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 63.14 3dgg h SER 26 CO 0.41 0.42 -0.71 -0.54 -0.87 0.00 0.00 176.83 175.54 3dgg s LYS 27 N -3.99 1.42 0.24 4.77 1.02 -1.26 -5.05 119.74 116.90 3dgg s LYS 27 Ca -0.02 -1.67 -0.30 0.00 0.02 0.00 0.00 55.97 54.00 3dgg s LYS 27 Cb 0.14 -1.13 -0.10 0.00 -0.52 0.00 0.00 37.83 36.21 3dgg s LYS 27 CO 0.72 0.12 1.46 0.45 -0.92 0.00 0.00 175.35 177.19 3dgg s SER 28 N -3.37 6.63 -0.30 2.83 0.15 -1.26 -4.66 113.70 113.71 3dgg s SER 28 Ca 0.26 2.68 0.11 0.00 0.70 0.00 0.00 55.95 59.69 3dgg s SER 28 Cb 0.01 -2.62 0.68 0.00 -1.71 0.00 0.00 66.02 62.38 3dgg s SER 28 CO 0.09 -0.73 1.70 1.33 1.20 0.00 0.00 173.24 176.84 3dgg n VAL 29 N 2.48 2.79 -0.72 4.45 0.24 -0.57 -4.53 118.33 122.47 3dgg n VAL 29 Ca 0.07 -1.86 0.01 0.00 -2.04 0.00 0.00 64.34 60.53 3dgg n VAL 29 Cb 0.40 -0.34 0.02 0.00 -1.47 0.00 0.00 33.84 32.44 3dgg n VAL 29 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 3dgg n SER 30 N -0.40 1.08 0.26 -1.34 7.64 -1.26 -1.83 113.62 117.77 3dgg n SER 30 Ca 0.37 -1.76 0.16 0.00 1.01 0.00 0.00 58.87 58.66 3dgg n SER 30 Cb 1.27 -0.07 0.56 0.00 -1.01 0.00 0.00 64.21 64.96 3dgg n SER 30 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 3dgg h THR 31 N 1.88 0.00 -0.01 0.44 1.35 -1.81 -3.02 112.91 111.73 3dgg h THR 31 Ca 0.00 -0.61 0.00 0.00 -0.55 0.00 0.00 66.41 65.25 3dgg h THR 31 Cb 0.84 1.60 0.00 0.00 -1.73 0.00 0.00 68.15 68.86 3dgg h THR 31 CO 0.00 0.00 -0.55 -1.54 -0.25 0.00 0.00 175.52 173.18 3dgg n SER 32 N -3.05 1.80 0.00 5.36 3.41 -1.26 -5.02 113.62 114.86 3dgg n SER 32 Ca 0.01 -1.39 0.00 0.00 -0.26 0.00 0.00 58.87 57.24 3dgg n SER 32 Cb 0.35 0.54 0.00 0.00 -0.26 0.00 0.00 64.21 64.84 3dgg n SER 32 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3dgg n GLY 33 N 1.43 0.27 3.90 5.00 0.00 -1.14 -5.12 105.19 109.53 3dgg n GLY 33 Ca 0.09 -0.03 -0.28 0.00 0.00 0.00 0.00 46.02 45.80 3dgg n GLY 33 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3dgg s TYR 34 N 0.00 3.41 -0.46 1.61 2.02 -1.26 -4.94 117.35 117.74 3dgg s TYR 34 Ca 0.00 0.83 -0.19 0.00 -0.37 0.00 0.00 57.07 57.34 3dgg s TYR 34 Cb 0.00 -2.63 0.03 0.00 -0.40 0.00 0.00 41.96 38.97 3dgg s TYR 34 CO 0.00 -0.67 0.57 -1.12 -1.57 0.00 0.00 175.55 172.77 3dgg s SER 35 N -4.23 6.25 -1.42 2.29 0.01 -1.26 -4.30 113.70 111.03 3dgg s SER 35 Ca 0.52 -0.64 -0.15 0.00 1.31 0.00 0.00 55.95 56.99 3dgg s SER 35 Cb -0.11 -2.28 0.05 0.00 0.21 0.00 0.00 66.02 63.90 3dgg s SER 35 CO 0.47 -0.75 2.11 -1.22 0.41 0.00 0.00 173.24 174.26 3dgg n TYR 36 N 6.02 3.78 -4.29 2.43 4.01 -0.76 -3.41 117.16 124.94 3dgg n TYR 36 Ca -0.05 -2.95 -0.21 0.00 -0.16 0.00 0.00 57.90 54.53 3dgg n TYR 36 Cb 0.47 -2.56 -0.16 0.00 -0.31 0.00 0.00 39.34 36.77 3dgg n TYR 36 CO 0.00 0.00 0.00 -1.64 -0.46 0.00 0.00 176.86 174.76 3dgg s MET 37 N 3.36 1.01 0.17 -0.72 -1.94 -1.26 -4.34 119.30 115.58 3dgg s MET 37 Ca 0.48 -0.21 0.09 0.00 -1.71 0.00 0.00 55.69 54.34 3dgg s MET 37 Cb 0.12 -0.94 -0.04 0.00 2.01 0.00 0.00 34.83 35.98 3dgg s MET 37 CO -0.05 -0.01 -0.18 -1.01 -0.01 0.00 0.00 175.02 173.76 3dgg s HIS 38 N 0.68 1.82 -0.05 -0.03 3.76 -0.50 0.16 115.29 121.14 3dgg s HIS 38 Ca -0.10 -0.47 0.05 0.00 -0.15 0.00 0.00 55.06 54.38 3dgg s HIS 38 Cb -0.13 -0.90 -0.01 0.00 1.11 0.00 0.00 32.58 32.65 3dgg s HIS 38 CO 0.01 0.34 -0.20 -1.58 -0.85 0.00 0.00 174.74 172.46 3dgg s TRP 39 N -2.15 1.98 0.13 1.40 0.52 -0.07 -1.46 118.94 119.29 3dgg s TRP 39 Ca 0.17 -0.57 0.08 0.00 0.02 0.00 0.00 56.10 55.80 3dgg s TRP 39 Cb -0.05 -1.32 -0.04 0.00 -1.15 0.00 0.00 33.47 30.91 3dgg s TRP 39 CO 0.07 -0.18 -0.20 0.71 0.02 0.00 0.00 176.95 177.37 3dgg s TYR 40 N -0.06 1.83 -0.07 -1.98 1.51 0.76 -0.71 117.35 118.62 3dgg s TYR 40 Ca -0.03 -0.44 0.05 0.00 -1.01 0.00 0.00 57.07 55.64 3dgg s TYR 40 Cb -0.12 -0.96 -0.01 0.00 -0.11 0.00 0.00 41.96 40.76 3dgg s TYR 40 CO 0.03 0.27 -0.24 -1.14 -1.11 0.00 0.00 175.55 173.35 3dgg s GLN 41 N -2.28 2.69 -0.07 -0.62 0.74 0.62 -0.96 119.66 119.77 3dgg s GLN 41 Ca 0.11 -0.87 0.01 0.00 0.05 0.00 0.00 55.36 54.66 3dgg s GLN 41 Cb -0.08 -2.17 0.02 0.00 1.10 0.00 0.00 33.01 31.88 3dgg s GLN 41 CO 0.05 0.29 -0.07 -1.14 -0.55 0.00 0.00 175.29 173.87 3dgg s GLN 42 N 0.07 1.24 0.06 1.67 0.74 0.70 0.36 119.66 124.49 3dgg s GLN 42 Ca -0.10 -0.21 0.02 0.00 0.05 0.00 0.00 55.36 55.13 3dgg s GLN 42 Cb -0.15 -1.22 -0.04 0.00 1.10 0.00 0.00 33.01 32.69 3dgg s GLN 42 CO 0.06 -0.13 0.07 0.15 -0.55 0.00 0.00 175.29 174.89 3dgg s LYS 43 N 1.20 2.90 0.10 1.67 1.02 -1.26 -1.06 119.74 124.31 3dgg s LYS 43 Ca -0.06 -0.65 -0.36 0.00 0.02 0.00 0.00 55.97 54.93 3dgg s LYS 43 Cb -0.14 -2.74 -0.17 0.00 -0.52 0.00 0.00 37.83 34.26 3dgg s LYS 43 CO -0.02 0.58 1.30 -2.30 -0.92 0.00 0.00 175.35 174.00 3dgg n PRO 44 N 0.66 1.14 -1.00 -1.68 -0.02 -1.26 -1.79 135.00 131.06 3dgg n PRO 44 Ca -0.10 0.41 0.00 0.00 -2.02 0.00 0.00 63.50 61.79 3dgg n PRO 44 Cb 0.52 -2.02 0.00 0.00 -0.02 0.00 0.00 33.50 31.98 3dgg n PRO 44 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3dgg n GLY 45 N 2.41 0.53 3.29 -1.23 0.00 -1.26 -5.02 105.19 103.91 3dgg n GLY 45 Ca 0.18 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.97 3dgg n GLY 45 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3dgg s GLN 46 N -0.11 1.16 0.77 1.61 -0.21 -0.74 -5.14 119.66 116.99 3dgg s GLN 46 Ca 0.00 -1.26 -0.13 0.00 0.02 0.00 0.00 55.36 53.99 3dgg s GLN 46 Cb 0.00 -1.29 0.06 0.00 1.00 0.00 0.00 33.01 32.78 3dgg s GLN 46 CO 0.00 0.28 1.15 -1.25 -2.12 0.00 0.00 175.29 173.35 3dgg s PRO 47 N -2.33 2.01 0.67 2.91 0.04 -1.26 -4.57 135.00 132.47 3dgg s PRO 47 Ca 0.10 1.52 -0.17 0.00 0.04 0.00 0.00 61.00 62.49 3dgg s PRO 47 Cb -0.08 -1.84 0.01 0.00 0.04 0.00 0.00 34.50 32.63 3dgg s PRO 47 CO 0.05 -1.88 1.27 -2.14 0.04 0.00 0.00 177.00 174.33 3dgg s PRO 48 N -4.32 2.41 -0.08 0.56 0.02 -1.26 -4.66 135.00 127.67 3dgg s PRO 48 Ca 0.68 1.98 0.05 0.00 0.02 0.00 0.00 61.00 63.73 3dgg s PRO 48 Cb -0.24 -1.84 -0.01 0.00 0.02 0.00 0.00 34.50 32.44 3dgg s PRO 48 CO 0.50 -1.68 -0.25 0.21 -0.33 0.00 0.00 177.00 175.45 3dgg s LYS 49 N -3.53 2.79 0.03 5.54 2.20 0.16 -4.92 119.74 122.00 3dgg s LYS 49 Ca 0.80 -0.89 -0.30 0.00 -0.36 0.00 0.00 55.97 55.21 3dgg s LYS 49 Cb -0.35 -2.23 -0.06 0.00 -1.51 0.00 0.00 37.83 33.68 3dgg s LYS 49 CO 0.41 0.28 1.33 -1.17 -0.36 0.00 0.00 175.35 175.84 3dgg s LEU 50 N 0.08 4.33 -0.19 5.43 2.96 -1.26 -0.28 118.68 129.75 3dgg s LEU 50 Ca -0.11 2.10 -0.11 0.00 -0.22 0.00 0.00 54.13 55.79 3dgg s LEU 50 Cb -0.16 -3.57 -0.08 0.00 0.50 0.00 0.00 46.19 42.88 3dgg s LEU 50 CO 0.06 -0.63 -0.26 0.18 -1.32 0.00 0.00 176.35 174.38 3dgg n LEU 51 N 4.73 1.48 -3.99 -0.68 4.77 0.11 -4.81 117.00 118.61 3dgg n LEU 51 Ca 0.12 0.25 -0.21 0.00 -0.03 0.00 0.00 56.01 56.14 3dgg n LEU 51 Cb 0.44 -0.61 -0.16 0.00 -2.33 0.00 0.00 43.42 40.77 3dgg n LEU 51 CO 0.57 0.30 -0.44 -0.63 -1.33 0.00 0.00 177.39 175.87 3dgg s ILE 52 N -2.42 0.78 0.11 -0.08 -1.09 -1.13 -0.84 121.20 116.54 3dgg s ILE 52 Ca -0.27 -0.34 0.10 0.00 -2.23 0.00 0.00 60.65 57.90 3dgg s ILE 52 Cb 0.10 -0.71 -0.04 0.00 -1.58 0.00 0.00 42.46 40.23 3dgg s ILE 52 CO 0.35 0.25 -0.25 -0.72 -1.23 0.00 0.00 174.94 173.34 3dgg s TYR 53 N 0.33 2.18 -1.32 3.97 -0.85 0.08 -0.89 117.35 120.85 3dgg s TYR 53 Ca -0.05 -0.39 -0.01 0.00 -0.52 0.00 0.00 57.07 56.10 3dgg s TYR 53 Cb -0.10 -1.21 -0.00 0.00 0.38 0.00 0.00 41.96 41.03 3dgg s TYR 53 CO 0.01 0.27 0.64 1.28 -1.52 0.00 0.00 175.55 176.23 3dgg n LEU 54 N 1.10 -2.94 0.00 -3.49 4.77 -0.86 -1.22 117.00 114.36 3dgg n LEU 54 Ca -0.18 -0.87 0.00 0.00 -0.03 0.00 0.00 56.01 54.93 3dgg n LEU 54 Cb 0.53 -2.56 0.00 0.00 -2.33 0.00 0.00 43.42 39.06 3dgg n LEU 54 CO 0.23 0.41 0.00 0.00 -1.33 0.00 0.00 177.39 176.70 3dgg n ALA 55 N -4.28 0.00 -0.83 -1.18 0.00 0.12 -4.16 120.51 110.19 3dgg n ALA 55 Ca -0.29 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.15 3dgg n ALA 55 Cb 0.68 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.13 3dgg n ALA 55 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3dgg n SER 56 N 1.99 0.21 -4.64 0.00 3.41 -1.22 -2.96 113.62 110.42 3dgg n SER 56 Ca 0.00 -1.04 -0.39 0.00 -0.26 0.00 0.00 58.87 57.18 3dgg n SER 56 Cb 0.00 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 63.88 3dgg n SER 56 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 3dgg s ASN 57 N -0.04 6.47 -0.09 4.04 -0.87 -0.36 -4.61 114.94 119.48 3dgg s ASN 57 Ca 0.00 0.57 -0.30 0.00 -1.57 0.00 0.00 52.86 51.56 3dgg s ASN 57 Cb 0.00 -2.28 -0.03 0.00 -0.02 0.00 0.00 41.25 38.92 3dgg s ASN 57 CO 0.00 -0.23 1.29 -0.22 -2.57 0.00 0.00 177.10 175.38 3dgg s LEU 58 N 1.99 4.25 0.52 0.60 2.96 -1.26 -0.74 118.68 126.99 3dgg s LEU 58 Ca 0.22 1.84 -0.22 0.00 -0.22 0.00 0.00 54.13 55.75 3dgg s LEU 58 Cb -0.15 -3.55 -0.05 0.00 0.50 0.00 0.00 46.19 42.93 3dgg s LEU 58 CO 0.09 -0.71 1.29 -0.70 -1.32 0.00 0.00 176.35 175.00 3dgg s GLU 59 N 2.95 3.31 0.21 1.98 2.56 -0.02 -4.92 118.70 124.77 3dgg s GLU 59 Ca 0.58 2.06 -0.32 0.00 0.00 0.00 0.00 54.97 57.29 3dgg s GLU 59 Cb -0.25 -2.28 -0.12 0.00 2.00 0.00 0.00 34.13 33.49 3dgg s GLU 59 CO 0.20 -1.00 1.68 -1.12 -0.56 0.00 0.00 175.26 174.46 3dgg s SER 60 N -1.13 6.41 0.00 -1.70 0.01 -1.26 -2.46 113.70 113.57 3dgg s SER 60 Ca 0.70 2.84 0.00 0.00 1.31 0.00 0.00 55.95 60.79 3dgg s SER 60 Cb -0.36 -2.60 0.00 0.00 0.21 0.00 0.00 66.02 63.27 3dgg s SER 60 CO 0.42 -0.94 0.00 0.61 0.41 0.00 0.00 173.24 173.74 3dgg n GLY 61 N 3.70 1.13 3.82 3.44 0.00 -1.26 -5.05 105.19 110.96 3dgg n GLY 61 Ca 0.15 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.79 3dgg n GLY 61 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3dgg s VAL 62 N -2.39 5.14 0.63 1.61 -7.23 -1.03 -5.07 120.40 112.07 3dgg s VAL 62 Ca 0.00 0.72 -0.16 0.00 -1.81 0.00 0.00 61.98 60.73 3dgg s VAL 62 Cb 0.00 -3.66 -0.01 0.00 0.56 0.00 0.00 36.38 33.26 3dgg s VAL 62 CO 0.00 0.54 1.13 -2.16 -0.31 0.00 0.00 175.10 174.31 3dgg s PRO 63 N -0.76 2.87 0.00 4.82 0.04 -1.26 -4.86 135.00 135.85 3dgg s PRO 63 Ca 0.22 1.52 0.16 0.00 0.04 0.00 0.00 61.00 62.94 3dgg s PRO 63 Cb -0.15 -1.95 0.84 0.00 0.04 0.00 0.00 34.50 33.28 3dgg s PRO 63 CO 0.11 -1.22 1.44 0.00 0.04 0.00 0.00 177.00 177.37 3dgg n ALA 64 N -2.12 1.93 0.17 8.56 0.00 -1.26 -2.18 120.51 125.61 3dgg n ALA 64 Ca 0.11 -0.08 0.06 0.00 0.00 0.00 0.00 53.44 53.53 3dgg n ALA 64 Cb 0.51 -1.26 0.55 0.00 0.00 0.00 0.00 19.45 19.26 3dgg n ALA 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3dgg h ARG 65 N 0.00 0.19 -6.03 0.00 3.08 -1.92 -3.42 114.38 106.29 3dgg h ARG 65 Ca 0.00 -0.01 -0.57 0.00 0.07 0.00 0.00 59.98 59.46 3dgg h ARG 65 Cb 0.12 -0.04 -0.06 0.00 0.08 0.00 0.00 29.97 30.07 3dgg h ARG 65 CO 0.00 0.14 -0.06 -0.06 -1.07 0.00 0.00 179.97 178.92 3dgg s PHE 66 N -5.19 3.67 -0.01 3.04 0.08 -0.93 -1.84 117.98 116.80 3dgg s PHE 66 Ca -0.06 1.13 -0.17 0.00 0.12 0.00 0.00 56.93 57.95 3dgg s PHE 66 Cb 0.17 -2.55 0.03 0.00 -0.57 0.00 0.00 43.02 40.10 3dgg s PHE 66 CO 0.69 0.37 0.35 -1.54 -0.10 0.00 0.00 175.22 175.00 3dgg s SER 67 N -0.22 -0.24 0.13 1.36 1.04 -0.61 -4.97 113.70 110.18 3dgg s SER 67 Ca 0.29 0.14 0.10 0.00 0.48 0.00 0.00 55.95 56.96 3dgg s SER 67 Cb -0.18 0.34 -0.04 0.00 0.10 0.00 0.00 66.02 66.25 3dgg s SER 67 CO 0.16 -0.48 -0.24 -0.83 0.98 0.00 0.00 173.24 172.83 3dgg s GLY 68 N -1.37 1.44 0.29 7.32 0.00 -1.26 -0.79 107.32 112.95 3dgg s GLY 68 Ca -0.13 -1.40 -0.08 0.00 0.00 0.00 0.00 44.72 43.11 3dgg s GLY 68 CO 0.04 -1.40 0.47 -1.35 0.00 0.00 0.00 173.10 170.86 3dgg s SER 69 N -2.11 0.32 0.00 1.64 1.04 -0.75 -4.29 113.70 109.55 3dgg s SER 69 Ca 0.12 -1.19 0.00 0.00 0.48 0.00 0.00 55.95 55.35 3dgg s SER 69 Cb -0.09 0.62 0.00 0.00 0.10 0.00 0.00 66.02 66.64 3dgg s SER 69 CO 0.06 -1.21 0.00 0.61 0.98 0.00 0.00 173.24 173.67 3dgg n GLY 70 N -0.45 1.80 3.46 7.32 0.00 -1.26 -1.80 105.19 114.27 3dgg n GLY 70 Ca -0.01 -2.15 -0.12 0.00 0.00 0.00 0.00 46.02 43.74 3dgg n GLY 70 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3dgg s SER 71 N 0.00 -0.53 0.07 1.61 0.15 -0.94 -4.94 113.70 109.12 3dgg s SER 71 Ca 0.00 0.14 0.00 0.00 0.70 0.00 0.00 55.95 56.79 3dgg s SER 71 Cb 0.00 0.53 0.00 0.00 -1.71 0.00 0.00 66.02 64.84 3dgg s SER 71 CO 0.00 -0.80 0.00 0.61 1.20 0.00 0.00 173.24 174.25 3dgg n GLY 72 N -0.09 0.20 0.00 9.45 0.00 -1.26 -2.67 105.19 110.82 3dgg n GLY 72 Ca -0.15 0.71 0.03 0.00 0.00 0.00 0.00 46.02 46.61 3dgg n GLY 72 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 3dgg n THR 73 N 0.00 0.00 -4.55 2.61 5.66 -1.26 -1.51 114.28 115.23 3dgg n THR 73 Ca 0.00 -0.18 -0.24 0.00 -3.05 0.00 0.00 64.05 60.57 3dgg n THR 73 Cb 0.00 0.43 -0.16 0.00 -1.55 0.00 0.00 70.33 69.05 3dgg n THR 73 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 3dgg s ASP 74 N -2.64 1.69 0.01 1.09 2.15 -1.09 -1.24 116.67 116.64 3dgg s ASP 74 Ca -0.02 -0.28 0.01 0.00 0.43 0.00 0.00 52.55 52.69 3dgg s ASP 74 Cb 0.05 -0.77 -0.01 0.00 -0.30 0.00 0.00 42.92 41.89 3dgg s ASP 74 CO 0.29 0.03 -0.04 -0.36 -0.17 0.00 0.00 175.17 174.92 3dgg s PHE 75 N 0.65 0.36 0.05 -5.34 0.40 0.18 -2.22 117.98 112.06 3dgg s PHE 75 Ca -0.14 -0.26 0.04 0.00 -0.60 0.00 0.00 56.93 55.98 3dgg s PHE 75 Cb -0.15 -0.23 -0.02 0.00 0.51 0.00 0.00 43.02 43.12 3dgg s PHE 75 CO 0.03 -0.06 -0.13 0.95 0.70 0.00 0.00 175.22 176.71 3dgg s THR 76 N -0.68 0.98 -0.20 0.64 -4.23 -0.74 -0.51 115.64 110.90 3dgg s THR 76 Ca -0.05 -1.12 -0.03 0.00 -1.18 0.00 0.00 61.69 59.31 3dgg s THR 76 Cb -0.05 -0.94 -0.01 0.00 1.34 0.00 0.00 72.50 72.84 3dgg s THR 76 CO -0.00 -0.16 -0.05 -0.22 -0.54 0.00 0.00 174.62 173.65 3dgg s LEU 77 N -1.44 2.95 -0.12 4.79 2.96 0.35 -1.80 118.68 126.37 3dgg s LEU 77 Ca -0.02 -0.33 -0.02 0.00 -0.22 0.00 0.00 54.13 53.54 3dgg s LEU 77 Cb -0.09 -1.74 -0.03 0.00 0.50 0.00 0.00 46.19 44.84 3dgg s LEU 77 CO 0.01 0.03 -0.05 0.20 -1.32 0.00 0.00 176.35 175.23 3dgg s ASN 78 N 1.16 4.71 -0.15 3.68 0.01 0.03 -1.16 114.94 123.22 3dgg s ASN 78 Ca 0.02 -0.09 0.02 0.00 -0.71 0.00 0.00 52.86 52.10 3dgg s ASN 78 Cb -0.14 -1.54 0.01 0.00 0.41 0.00 0.00 41.25 39.98 3dgg s ASN 78 CO -0.01 0.25 -0.21 -0.63 -1.51 0.00 0.00 177.10 174.99 3dgg s ILE 79 N -0.12 2.01 -0.30 0.60 1.01 -0.60 -1.58 121.20 122.22 3dgg s ILE 79 Ca 0.02 -0.94 -0.12 0.00 0.00 0.00 0.00 60.65 59.61 3dgg s ILE 79 Cb -0.13 -1.79 0.17 0.00 0.01 0.00 0.00 42.46 40.72 3dgg s ILE 79 CO 0.03 0.54 0.89 -2.28 0.00 0.00 0.00 174.94 174.11 3dgg s HIS 80 N 0.93 -0.89 0.47 3.97 5.65 -0.77 -0.82 115.29 123.82 3dgg s HIS 80 Ca -0.04 1.33 -0.20 0.00 0.25 0.00 0.00 55.06 56.40 3dgg s HIS 80 Cb -0.15 0.45 -0.09 0.00 -1.18 0.00 0.00 32.58 31.61 3dgg s HIS 80 CO -0.04 -0.46 0.99 -1.25 -0.65 0.00 0.00 174.74 173.33 3dgg s PRO 81 N 2.68 4.00 0.09 2.88 0.05 -1.26 -4.50 135.00 138.94 3dgg s PRO 81 Ca 0.01 1.19 -0.30 0.00 0.05 0.00 0.00 61.00 61.95 3dgg s PRO 81 Cb -0.09 -2.14 -0.05 0.00 0.05 0.00 0.00 34.50 32.27 3dgg s PRO 81 CO -0.17 -0.24 0.95 0.08 0.05 0.00 0.00 177.00 177.67 3dgg s VAL 82 N -2.18 4.58 0.29 -0.36 1.01 -0.79 -4.88 120.40 118.07 3dgg s VAL 82 Ca 0.63 2.04 0.09 0.00 0.00 0.00 0.00 61.98 64.74 3dgg s VAL 82 Cb -0.12 -4.31 -0.04 0.00 0.00 0.00 0.00 36.38 31.91 3dgg s VAL 82 CO 0.19 0.29 0.10 -1.61 0.00 0.00 0.00 175.10 174.07 3dgg s GLU 83 N 0.16 2.46 0.44 2.72 8.01 -1.26 -1.63 118.70 129.60 3dgg s GLU 83 Ca 0.47 -1.39 0.13 0.00 0.01 0.00 0.00 54.97 54.19 3dgg s GLU 83 Cb -0.23 -2.26 1.03 0.00 -4.31 0.00 0.00 34.13 28.36 3dgg s GLU 83 CO 0.29 0.27 2.01 0.93 0.01 0.00 0.00 175.26 178.76 3dgg h GLU 84 N 1.66 0.39 0.00 1.61 3.07 -1.89 -1.72 114.58 117.70 3dgg h GLU 84 Ca -0.45 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.39 3dgg h GLU 84 Cb 1.25 -0.09 0.00 0.00 -0.84 0.00 0.00 28.75 29.07 3dgg h GLU 84 CO 0.61 0.26 0.00 -0.85 -1.40 0.00 0.00 179.01 177.63 3dgg n GLU 85 N -4.47 0.10 0.00 2.33 0.28 -1.18 -3.17 120.64 114.54 3dgg n GLU 85 Ca 0.08 0.34 0.14 0.00 -0.16 0.00 0.00 57.16 57.56 3dgg n GLU 85 Cb 0.30 -1.69 0.71 0.00 1.43 0.00 0.00 31.44 32.19 3dgg n GLU 85 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 3dgg n ASP 86 N -1.88 0.00 -4.57 -1.84 10.43 -0.65 -4.76 116.55 113.29 3dgg n ASP 86 Ca 0.03 0.00 -0.48 0.00 2.57 0.00 0.00 54.79 56.91 3dgg n ASP 86 Cb 0.20 -0.33 -0.05 0.00 1.84 0.00 0.00 41.12 42.78 3dgg n ASP 86 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 3dgg n ALA 87 N -1.33 1.23 -3.85 2.24 0.00 -1.19 -4.81 120.51 112.80 3dgg n ALA 87 Ca 0.12 -0.01 0.04 0.00 0.00 0.00 0.00 53.44 53.59 3dgg n ALA 87 Cb 0.25 -2.65 0.01 0.00 0.00 0.00 0.00 19.45 17.06 3dgg n ALA 87 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3dgg s ALA 88 N 6.58 -2.57 -0.14 0.00 0.00 -1.12 -4.89 121.76 119.61 3dgg s ALA 88 Ca 1.01 0.41 -0.06 0.00 0.00 0.00 0.00 51.96 53.32 3dgg s ALA 88 Cb -0.64 0.68 -0.04 0.00 0.00 0.00 0.00 23.12 23.11 3dgg s ALA 88 CO 0.46 -1.13 0.07 0.99 0.00 0.00 0.00 175.76 176.15 3dgg s THR 89 N -2.07 4.84 -0.06 0.00 2.01 -0.22 0.01 115.64 120.15 3dgg s THR 89 Ca 0.25 -0.03 0.03 0.00 0.31 0.00 0.00 61.69 62.24 3dgg s THR 89 Cb 0.03 -3.13 -0.03 0.00 0.01 0.00 0.00 72.50 69.38 3dgg s THR 89 CO -0.03 0.54 -0.13 -0.31 -0.69 0.00 0.00 174.62 173.99 3dgg s TYR 90 N -0.31 2.75 -0.03 4.92 2.02 0.05 -0.22 117.35 126.54 3dgg s TYR 90 Ca 0.09 -0.19 0.04 0.00 -0.37 0.00 0.00 57.07 56.63 3dgg s TYR 90 Cb -0.12 -1.67 -0.00 0.00 -0.40 0.00 0.00 41.96 39.76 3dgg s TYR 90 CO 0.02 0.16 -0.15 0.71 -1.57 0.00 0.00 175.55 174.71 3dgg s TYR 91 N -0.59 1.44 0.45 2.71 2.02 -0.13 -0.98 117.35 122.27 3dgg s TYR 91 Ca 0.09 -0.36 -0.01 0.00 -0.37 0.00 0.00 57.07 56.42 3dgg s TYR 91 Cb -0.11 -0.96 -0.01 0.00 -0.40 0.00 0.00 41.96 40.47 3dgg s TYR 91 CO 0.01 -0.10 0.69 0.00 -1.57 0.00 0.00 175.55 174.58 3dgg s GLN 93 N -4.59 0.65 0.03 0.00 0.74 -0.54 -0.98 119.66 114.98 3dgg s GLN 93 Ca 0.47 0.81 0.03 0.00 0.05 0.00 0.00 55.36 56.72 3dgg s GLN 93 Cb -0.10 0.30 -0.02 0.00 1.10 0.00 0.00 33.01 34.29 3dgg s GLN 93 CO 0.39 -0.09 -0.09 -1.58 -0.55 0.00 0.00 175.29 173.38 3dgg s HIS 94 N 0.42 0.76 0.00 1.67 5.65 -0.73 -1.41 115.29 121.65 3dgg s HIS 94 Ca -0.01 -0.35 0.00 0.00 0.25 0.00 0.00 55.06 54.95 3dgg s HIS 94 Cb -0.04 -0.46 0.00 0.00 -1.18 0.00 0.00 32.58 30.90 3dgg s HIS 94 CO -0.01 -0.03 0.00 -1.13 -0.65 0.00 0.00 174.74 172.92 3dgg n SER 95 N 1.99 0.00 0.00 9.88 3.41 -1.26 -0.98 113.62 126.66 3dgg n SER 95 Ca -0.19 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.42 3dgg n SER 95 Cb 0.56 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.51 3dgg n SER 95 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 3dgg n ARG 96 N 0.00 0.00 0.00 4.33 3.00 -1.26 -3.08 116.66 119.65 3dgg n ARG 96 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 3dgg n ARG 96 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.46 3dgg n ARG 96 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.63 176.78 3dgg n GLU 97 N 0.00 0.00 -4.23 -0.14 0.28 -1.26 -4.96 120.64 110.33 3dgg n GLU 97 Ca 0.00 0.00 -0.34 0.00 -0.16 0.00 0.00 57.16 56.66 3dgg n GLU 97 Cb 0.00 -0.12 -0.15 0.00 1.43 0.00 0.00 31.44 32.60 3dgg n GLU 97 CO 0.00 0.00 0.00 -1.17 -0.16 0.00 0.00 177.13 175.80 3dgg s LEU 98 N -4.15 2.49 0.16 -1.84 2.96 -1.18 -5.08 118.68 112.05 3dgg s LEU 98 Ca 0.00 -0.50 -0.32 0.00 -0.22 0.00 0.00 54.13 53.09 3dgg s LEU 98 Cb 0.00 -1.59 -0.10 0.00 0.50 0.00 0.00 46.19 45.00 3dgg s LEU 98 CO 0.00 0.03 1.58 -0.22 -1.32 0.00 0.00 176.35 176.42 3dgg s LEU 99 N 1.14 4.37 -0.01 -0.68 2.96 -1.25 -4.62 118.68 120.59 3dgg s LEU 99 Ca 0.01 2.62 0.00 0.00 -0.22 0.00 0.00 54.13 56.55 3dgg s LEU 99 Cb -0.14 -3.59 0.01 0.00 0.50 0.00 0.00 46.19 42.97 3dgg s LEU 99 CO -0.05 -0.83 0.00 0.28 -1.32 0.00 0.00 176.35 174.43 3dgg s THR 100 N 1.18 0.05 -0.03 3.68 -1.32 -0.15 -5.01 115.64 114.05 3dgg s THR 100 Ca 0.70 0.05 -0.02 0.00 -1.21 0.00 0.00 61.69 61.22 3dgg s THR 100 Cb -0.44 -0.10 -0.04 0.00 -1.51 0.00 0.00 72.50 70.41 3dgg s THR 100 CO 0.31 0.06 0.10 -0.36 -2.21 0.00 0.00 174.62 172.52 3dgg s PHE 101 N 0.43 3.36 0.97 9.09 0.40 -1.26 -1.78 117.98 129.19 3dgg s PHE 101 Ca -0.04 0.27 -0.11 0.00 -0.60 0.00 0.00 56.93 56.45 3dgg s PHE 101 Cb -0.06 -1.78 0.17 0.00 0.51 0.00 0.00 43.02 41.86 3dgg s PHE 101 CO -0.01 0.58 1.09 0.20 0.70 0.00 0.00 175.22 177.78 3dgg s GLY 102 N -1.61 1.62 0.29 4.36 0.00 -0.15 -4.92 107.32 106.91 3dgg s GLY 102 Ca 0.22 0.12 0.25 0.00 0.00 0.00 0.00 44.72 45.31 3dgg s GLY 102 CO 0.12 0.65 1.75 0.00 0.00 0.00 0.00 173.10 175.62 3dgg h ALA 103 N -1.91 1.00 0.00 3.20 0.00 -1.88 -3.44 119.26 116.22 3dgg h ALA 103 Ca -0.51 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.40 3dgg h ALA 103 Cb 1.29 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.08 3dgg h ALA 103 CO 0.50 0.00 0.00 0.41 0.00 0.00 0.00 179.25 180.16 3dgg n GLY 104 N 0.24 0.48 3.11 0.00 0.00 -1.26 -5.03 105.19 102.73 3dgg n GLY 104 Ca 0.03 -1.55 -0.31 0.00 0.00 0.00 0.00 46.02 44.18 3dgg n GLY 104 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3dgg s THR 105 N -2.34 1.86 -0.30 2.61 2.01 -0.15 -4.53 115.64 114.80 3dgg s THR 105 Ca 0.00 -0.84 -0.23 0.00 0.31 0.00 0.00 61.69 60.93 3dgg s THR 105 Cb 0.00 -1.68 -0.00 0.00 0.01 0.00 0.00 72.50 70.83 3dgg s THR 105 CO 0.00 0.51 0.76 -0.75 -0.69 0.00 0.00 174.62 174.45 3dgg s LYS 106 N 1.06 3.96 -0.19 4.92 2.20 -0.18 -0.77 119.74 130.75 3dgg s LYS 106 Ca -0.02 0.56 -0.18 0.00 -0.36 0.00 0.00 55.97 55.96 3dgg s LYS 106 Cb -0.14 -3.72 -0.03 0.00 -1.51 0.00 0.00 37.83 32.42 3dgg s LYS 106 CO -0.06 -0.65 0.51 -1.17 -0.36 0.00 0.00 175.35 173.62 3dgg s LEU 107 N 2.90 4.17 0.06 5.43 0.20 0.10 -1.80 118.68 129.74 3dgg s LEU 107 Ca 0.31 0.70 0.08 0.00 0.69 0.00 0.00 54.13 55.91 3dgg s LEU 107 Cb -0.14 -2.71 -0.03 0.00 -0.43 0.00 0.00 46.19 42.88 3dgg s LEU 107 CO 0.12 -0.15 -0.20 -1.61 -0.29 0.00 0.00 176.35 174.23 3dgg s GLU 108 N 1.47 1.96 0.07 1.98 2.02 0.55 -2.79 118.70 123.97 3dgg s GLU 108 Ca 0.24 -1.04 -0.10 0.00 0.02 0.00 0.00 54.97 54.09 3dgg s GLU 108 Cb -0.15 -2.14 -0.06 0.00 0.10 0.00 0.00 34.13 31.88 3dgg s GLU 108 CO 0.10 0.52 0.39 -0.51 0.02 0.00 0.00 175.26 175.78 3dgg s LEU 109 N -1.54 4.35 0.20 1.80 1.02 -1.26 -1.62 118.68 121.64 3dgg s LEU 109 Ca 0.15 0.78 -0.09 0.00 0.02 0.00 0.00 54.13 54.99 3dgg s LEU 109 Cb -0.10 -2.95 -0.07 0.00 0.02 0.00 0.00 46.19 43.09 3dgg s LEU 109 CO 0.06 0.18 0.50 -0.54 0.02 0.00 0.00 176.35 176.57 3dgg s LYS 110 N -1.88 3.76 0.28 1.70 1.02 -0.41 -4.81 119.74 119.40 3dgg s LYS 110 Ca 0.32 0.19 -0.19 0.00 0.02 0.00 0.00 55.97 56.31 3dgg s LYS 110 Cb -0.14 -2.71 0.07 0.00 -0.52 0.00 0.00 37.83 34.52 3dgg s LYS 110 CO 0.18 0.36 0.92 -0.98 -0.92 0.00 0.00 175.35 174.91 3dgg s ARG 111 N -2.73 1.75 0.50 1.68 1.70 -1.26 -4.28 118.95 116.31 3dgg s ARG 111 Ca 0.45 -1.13 -0.23 0.00 -0.47 0.00 0.00 55.73 54.36 3dgg s ARG 111 Cb -0.12 0.49 -0.06 0.00 -0.57 0.00 0.00 34.95 34.69 3dgg s ARG 111 CO 0.22 -0.82 1.30 0.00 -1.08 0.00 0.00 175.30 174.92 3dgg s ALA 112 N -2.25 2.94 0.37 7.88 0.00 -1.26 -4.96 121.76 124.48 3dgg s ALA 112 Ca 0.19 1.22 -0.27 0.00 0.00 0.00 0.00 51.96 53.10 3dgg s ALA 112 Cb -0.04 -3.51 -0.09 0.00 0.00 0.00 0.00 23.12 19.48 3dgg s ALA 112 CO 0.08 -1.11 1.29 -0.51 0.00 0.00 0.00 175.76 175.52 3dgg s ASP 113 N -1.01 6.53 -0.05 0.00 1.11 -1.26 -4.75 116.67 117.24 3dgg s ASP 113 Ca 0.67 2.64 -0.02 0.00 0.18 0.00 0.00 52.55 56.02 3dgg s ASP 113 Cb -0.37 -2.64 0.04 0.00 1.07 0.00 0.00 42.92 41.01 3dgg s ASP 113 CO 0.45 -0.70 0.11 0.00 1.18 0.00 0.00 175.17 176.20 3dgg s ALA 114 N -1.22 -0.08 0.49 5.23 0.00 0.01 -4.91 121.76 121.27 3dgg s ALA 114 Ca 0.53 0.49 -0.22 0.00 0.00 0.00 0.00 51.96 52.77 3dgg s ALA 114 Cb -0.38 -0.49 -0.07 0.00 0.00 0.00 0.00 23.12 22.18 3dgg s ALA 114 CO 0.50 -0.27 1.14 0.00 0.00 0.00 0.00 175.76 177.13 3dgg s ALA 115 N 1.50 2.88 0.41 0.00 0.00 -1.26 -1.54 121.76 123.75 3dgg s ALA 115 Ca -0.05 0.87 -0.25 0.00 0.00 0.00 0.00 51.96 52.53 3dgg s ALA 115 Cb -0.12 -3.36 -0.08 0.00 0.00 0.00 0.00 23.12 19.55 3dgg s ALA 115 CO -0.05 -0.66 1.20 -1.25 0.00 0.00 0.00 175.76 175.00 3dgg s PRO 116 N -2.92 3.99 -0.47 0.00 0.04 -1.26 -4.53 135.00 129.86 3dgg s PRO 116 Ca 0.67 1.90 -0.24 0.00 0.04 0.00 0.00 61.00 63.37 3dgg s PRO 116 Cb -0.26 -2.66 0.03 0.00 0.04 0.00 0.00 34.50 31.65 3dgg s PRO 116 CO 0.31 -0.39 0.86 0.99 0.04 0.00 0.00 177.00 178.81 3dgg s THR 117 N -1.39 4.54 -0.19 1.26 2.01 -0.30 -4.83 115.64 116.74 3dgg s THR 117 Ca 0.58 0.53 -0.11 0.00 0.31 0.00 0.00 61.69 63.00 3dgg s THR 117 Cb -0.32 -4.40 -0.05 0.00 0.01 0.00 0.00 72.50 67.74 3dgg s THR 117 CO 0.40 -0.82 0.17 -0.69 -0.69 0.00 0.00 174.62 172.99 3dgg s VAL 118 N 3.56 5.39 -0.01 3.82 1.01 -1.26 -1.65 120.40 131.26 3dgg s VAL 118 Ca 0.33 0.27 0.02 0.00 0.00 0.00 0.00 61.98 62.59 3dgg s VAL 118 Cb -0.11 -3.51 -0.00 0.00 0.00 0.00 0.00 36.38 32.76 3dgg s VAL 118 CO 0.24 0.43 -0.05 -0.94 0.00 0.00 0.00 175.10 174.77 3dgg s SER 119 N 0.40 0.59 -0.02 3.32 1.04 -0.41 -4.95 113.70 113.68 3dgg s SER 119 Ca 0.10 -0.09 0.06 0.00 0.48 0.00 0.00 55.95 56.50 3dgg s SER 119 Cb -0.11 -0.08 -0.01 0.00 0.10 0.00 0.00 66.02 65.91 3dgg s SER 119 CO -0.01 0.05 -0.19 -0.51 0.98 0.00 0.00 173.24 173.56 3dgg s ILE 120 N -0.06 1.54 -0.09 -1.02 2.07 -1.26 -0.81 121.20 121.57 3dgg s ILE 120 Ca 0.01 -0.83 0.01 0.00 -1.41 0.00 0.00 60.65 58.43 3dgg s ILE 120 Cb -0.03 -1.28 0.02 0.00 0.13 0.00 0.00 42.46 41.30 3dgg s ILE 120 CO -0.00 0.44 -0.10 -0.36 -1.91 0.00 0.00 174.94 173.00 3dgg s PHE 121 N -0.43 1.47 0.84 3.50 0.08 0.49 -5.01 117.98 118.91 3dgg s PHE 121 Ca 0.07 -0.63 -0.11 0.00 0.12 0.00 0.00 56.93 56.38 3dgg s PHE 121 Cb -0.08 -1.14 0.09 0.00 -0.57 0.00 0.00 43.02 41.33 3dgg s PHE 121 CO -0.01 -0.38 1.09 -2.14 -0.10 0.00 0.00 175.22 173.69 3dgg s PRO 122 N 1.10 1.73 0.47 0.24 0.02 -1.26 -2.19 135.00 135.11 3dgg s PRO 122 Ca -0.06 1.06 -0.25 0.00 0.02 0.00 0.00 61.00 61.77 3dgg s PRO 122 Cb -0.14 -1.85 -0.08 0.00 0.02 0.00 0.00 34.50 32.45 3dgg s PRO 122 CO -0.01 -1.98 1.40 -1.25 -0.33 0.00 0.00 177.00 174.82 3dgg s PRO 123 N -4.89 3.61 0.61 5.54 0.04 -1.21 -4.82 135.00 133.87 3dgg s PRO 123 Ca 0.62 2.34 -0.17 0.00 0.04 0.00 0.00 61.00 63.84 3dgg s PRO 123 Cb -0.18 -2.58 -0.03 0.00 0.04 0.00 0.00 34.50 31.75 3dgg s PRO 123 CO 0.57 -0.85 1.10 -1.54 0.04 0.00 0.00 177.00 176.32 3dgg s SER 124 N -0.64 5.46 0.27 6.66 1.04 -1.26 -4.91 113.70 120.33 3dgg s SER 124 Ca 0.63 2.02 -0.04 0.00 0.48 0.00 0.00 55.95 59.04 3dgg s SER 124 Cb -0.42 -2.56 0.35 0.00 0.10 0.00 0.00 66.02 63.49 3dgg s SER 124 CO 0.53 -1.39 1.95 -1.28 0.98 0.00 0.00 173.24 174.03 3dgg h SER 125 N 0.52 1.06 -0.78 7.02 0.87 -1.99 -1.55 113.55 118.70 3dgg h SER 125 Ca -0.48 -0.03 0.10 0.00 -1.23 0.00 0.00 61.79 60.16 3dgg h SER 125 Cb 1.25 -0.26 -0.05 0.00 -0.44 0.00 0.00 62.40 62.89 3dgg h SER 125 CO 0.56 0.77 0.51 -0.33 -0.53 0.00 0.00 176.83 177.81 3dgg h GLU 126 N 1.26 0.66 -0.05 2.24 5.08 -1.99 -2.50 114.58 119.27 3dgg h GLU 126 Ca 0.34 -0.04 -0.12 0.00 -1.00 0.00 0.00 59.36 58.54 3dgg h GLU 126 Cb -0.14 -0.15 0.01 0.00 0.50 0.00 0.00 28.75 28.97 3dgg h GLU 126 CO -0.08 0.44 -0.43 0.37 -1.00 0.00 0.00 179.01 178.32 3dgg h GLN 127 N 0.68 0.38 -0.89 2.33 4.15 -1.60 -3.20 115.11 116.96 3dgg h GLN 127 Ca 0.36 -0.34 0.10 0.00 0.77 0.00 0.00 58.65 59.55 3dgg h GLN 127 Cb 0.50 0.08 -0.07 0.00 0.21 0.00 0.00 27.48 28.20 3dgg h GLN 127 CO -0.14 0.99 0.58 -0.07 -1.93 0.00 0.00 178.83 178.26 3dgg h LEU 128 N -0.11 0.79 -0.01 -2.39 -0.00 -1.23 -1.40 115.31 110.95 3dgg h LEU 128 Ca -0.04 0.02 0.00 0.00 -0.00 0.00 0.00 57.88 57.87 3dgg h LEU 128 Cb 1.10 -0.14 0.00 0.00 -0.00 0.00 0.00 40.66 41.62 3dgg h LEU 128 CO 0.09 0.46 -0.02 0.35 -0.00 0.00 0.00 178.44 179.32 3dgg n THR 129 N -4.53 0.00 0.78 0.22 -2.24 -0.96 -1.66 114.28 105.89 3dgg n THR 129 Ca 0.15 -0.00 0.12 0.00 -2.27 0.00 0.00 64.05 62.05 3dgg n THR 129 Cb 0.32 -0.46 0.16 0.00 -2.10 0.00 0.00 70.33 68.25 3dgg n THR 129 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 3dgg n SER 130 N -1.33 3.08 0.00 3.42 7.64 -0.57 -4.97 113.62 120.88 3dgg n SER 130 Ca 0.12 -1.97 0.00 0.00 1.01 0.00 0.00 58.87 58.03 3dgg n SER 130 Cb 0.27 -0.09 0.00 0.00 -1.01 0.00 0.00 64.21 63.38 3dgg n SER 130 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3dgg n GLY 131 N 1.40 0.63 3.68 0.23 0.00 -0.66 -5.07 105.19 105.40 3dgg n GLY 131 Ca 0.16 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.93 3dgg n GLY 131 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3dgg s GLY 132 N -1.26 2.22 -0.27 -0.02 0.00 -0.96 -1.68 107.32 105.34 3dgg s GLY 132 Ca 0.00 -2.05 0.00 0.00 0.00 0.00 0.00 44.72 42.67 3dgg s GLY 132 CO 0.00 -1.91 0.44 0.00 0.00 0.00 0.00 173.10 171.62 3dgg s ALA 133 N -2.56 -1.40 -0.20 3.20 0.00 -0.37 -2.83 121.76 117.60 3dgg s ALA 133 Ca 0.38 0.77 -0.05 0.00 0.00 0.00 0.00 51.96 53.06 3dgg s ALA 133 Cb 0.02 -1.97 -0.02 0.00 0.00 0.00 0.00 23.12 21.15 3dgg s ALA 133 CO 0.21 -1.52 -0.01 -1.12 0.00 0.00 0.00 175.76 173.33 3dgg s SER 134 N 2.61 4.78 -0.27 0.00 0.01 -1.26 -0.28 113.70 119.29 3dgg s SER 134 Ca 0.12 -0.21 -0.10 0.00 1.31 0.00 0.00 55.95 57.07 3dgg s SER 134 Cb -0.14 -1.81 -0.05 0.00 0.21 0.00 0.00 66.02 64.23 3dgg s SER 134 CO -0.23 0.06 0.16 -0.69 0.41 0.00 0.00 173.24 172.95 3dgg s VAL 135 N 0.99 5.08 -0.12 3.43 1.01 0.37 -3.33 120.40 127.84 3dgg s VAL 135 Ca 0.01 0.09 -0.03 0.00 0.00 0.00 0.00 61.98 62.05 3dgg s VAL 135 Cb -0.14 -3.41 -0.03 0.00 0.00 0.00 0.00 36.38 32.79 3dgg s VAL 135 CO 0.02 0.28 0.01 -0.69 0.00 0.00 0.00 175.10 174.71 3dgg s VAL 136 N 1.69 4.34 -0.12 2.92 1.01 -0.93 -1.07 120.40 128.24 3dgg s VAL 136 Ca 0.07 -0.22 -0.00 0.00 0.00 0.00 0.00 61.98 61.83 3dgg s VAL 136 Cb -0.16 -2.86 0.02 0.00 0.00 0.00 0.00 36.38 33.38 3dgg s VAL 136 CO 0.09 0.56 -0.09 0.00 0.00 0.00 0.00 175.10 175.66 3dgg s PHE 138 N 1.57 3.48 -0.41 0.00 0.40 0.01 -0.55 117.98 122.48 3dgg s PHE 138 Ca 0.03 0.41 0.03 0.00 -0.60 0.00 0.00 56.93 56.81 3dgg s PHE 138 Cb -0.13 -2.08 0.11 0.00 0.51 0.00 0.00 43.02 41.44 3dgg s PHE 138 CO -0.08 0.46 0.15 -0.51 0.70 0.00 0.00 175.22 175.94 3dgg s LEU 139 N -0.17 4.07 0.02 -0.37 1.02 0.94 -1.29 118.68 122.90 3dgg s LEU 139 Ca 0.11 -2.43 0.03 0.00 0.02 0.00 0.00 54.13 51.86 3dgg s LEU 139 Cb -0.11 -1.47 -0.04 0.00 0.02 0.00 0.00 46.19 44.59 3dgg s LEU 139 CO 0.00 -0.32 -0.05 0.20 0.02 0.00 0.00 176.35 176.21 3dgg s ASN 140 N 0.53 4.77 -1.15 2.29 0.01 -0.66 -0.93 114.94 119.80 3dgg s ASN 140 Ca 0.14 -0.13 -0.03 0.00 -0.71 0.00 0.00 52.86 52.12 3dgg s ASN 140 Cb -0.22 -1.14 -0.03 0.00 0.41 0.00 0.00 41.25 40.28 3dgg s ASN 140 CO -0.06 0.27 0.93 0.59 -1.51 0.00 0.00 177.10 177.31 3dgg n ASN 141 N 1.38 -3.84 -4.62 -1.22 5.03 -0.75 -1.15 115.26 110.09 3dgg n ASN 141 Ca -0.15 -0.70 -0.24 0.00 0.87 0.00 0.00 54.58 54.37 3dgg n ASN 141 Cb 0.52 -4.96 -0.08 0.00 -1.02 0.00 0.00 39.78 34.24 3dgg n ASN 141 CO 0.00 0.00 0.00 0.72 -1.83 0.00 0.00 177.26 176.15 3dgg s PHE 142 N -3.41 2.56 -0.22 3.10 -0.71 0.44 -4.67 117.98 115.07 3dgg s PHE 142 Ca 0.20 -0.37 -0.20 0.00 -1.04 0.00 0.00 56.93 55.52 3dgg s PHE 142 Cb -0.03 -1.36 0.06 0.00 -1.21 0.00 0.00 43.02 40.48 3dgg s PHE 142 CO 0.75 0.54 0.59 -0.47 -1.34 0.00 0.00 175.22 175.29 3dgg s TYR 143 N -2.47 -0.68 1.06 3.49 6.14 -0.59 -0.22 117.35 124.09 3dgg s TYR 143 Ca 0.33 1.62 -0.18 0.00 0.64 0.00 0.00 57.07 59.48 3dgg s TYR 143 Cb -0.02 0.25 0.25 0.00 0.42 0.00 0.00 41.96 42.86 3dgg s TYR 143 CO 0.19 -0.33 1.22 -0.35 0.64 0.00 0.00 175.55 176.92 3dgg n PRO 144 N 2.91 -2.02 0.01 4.97 -0.04 -1.26 -0.81 135.00 138.76 3dgg n PRO 144 Ca -0.14 -1.90 0.01 0.00 -0.04 0.00 0.00 63.50 61.42 3dgg n PRO 144 Cb 0.56 -1.46 0.33 0.00 -0.04 0.00 0.00 33.50 32.89 3dgg n PRO 144 CO 0.00 0.00 0.00 1.57 -0.04 0.00 0.00 175.50 177.03 3dgg h LYS 145 N 0.00 0.50 -6.58 0.54 2.10 -1.98 -3.44 116.57 107.71 3dgg h LYS 145 Ca -0.42 -0.09 -0.53 0.00 -2.00 0.00 0.00 60.65 57.61 3dgg h LYS 145 Cb 1.20 -0.08 0.02 0.00 -0.90 0.00 0.00 32.23 32.47 3dgg h LYS 145 CO 0.29 0.50 0.69 -0.51 -2.00 0.00 0.00 179.45 178.42 3dgg s ASP 146 N -6.74 6.87 -0.20 7.07 1.11 -1.26 -5.00 116.67 118.52 3dgg s ASP 146 Ca -0.07 2.32 -0.27 0.00 0.18 0.00 0.00 52.55 54.70 3dgg s ASP 146 Cb 0.16 -2.59 0.08 0.00 1.07 0.00 0.00 42.92 41.63 3dgg s ASP 146 CO 0.76 -0.60 0.74 -0.51 1.18 0.00 0.00 175.17 176.74 3dgg s ILE 147 N 0.80 0.00 -0.14 0.77 2.07 -1.26 -4.61 121.20 118.83 3dgg s ILE 147 Ca 0.62 0.00 -0.01 0.00 -1.41 0.00 0.00 60.65 59.85 3dgg s ILE 147 Cb -0.36 -1.00 -0.01 0.00 0.13 0.00 0.00 42.46 41.22 3dgg s ILE 147 CO 0.32 0.00 -0.12 0.20 -1.91 0.00 0.00 174.94 173.43 3dgg s ASN 148 N -0.14 3.99 -0.11 4.50 0.01 -0.47 -4.98 114.94 117.75 3dgg s ASN 148 Ca -0.03 -0.35 -0.01 0.00 -0.71 0.00 0.00 52.86 51.76 3dgg s ASN 148 Cb -0.03 -1.62 -0.03 0.00 0.41 0.00 0.00 41.25 39.98 3dgg s ASN 148 CO 0.03 0.13 -0.06 -0.69 -1.51 0.00 0.00 177.10 175.00 3dgg s VAL 149 N 0.54 3.71 0.02 1.60 1.01 -1.26 0.00 120.40 126.03 3dgg s VAL 149 Ca -0.08 -0.45 0.07 0.00 0.00 0.00 0.00 61.98 61.52 3dgg s VAL 149 Cb -0.16 -2.56 -0.02 0.00 0.00 0.00 0.00 36.38 33.64 3dgg s VAL 149 CO 0.04 0.55 -0.22 -0.75 0.00 0.00 0.00 175.10 174.72 3dgg s LYS 150 N -0.25 1.57 -0.08 2.72 2.20 0.02 -4.97 119.74 120.95 3dgg s LYS 150 Ca 0.04 -0.90 -0.01 0.00 -0.36 0.00 0.00 55.97 54.73 3dgg s LYS 150 Cb -0.13 -1.63 -0.03 0.00 -1.51 0.00 0.00 37.83 34.53 3dgg s LYS 150 CO 0.03 0.43 -0.03 -1.58 -0.36 0.00 0.00 175.35 173.83 3dgg s TRP 151 N -0.70 3.05 -0.01 4.03 0.52 -1.26 -0.98 118.94 123.60 3dgg s TRP 151 Ca 0.08 0.09 0.03 0.00 0.02 0.00 0.00 56.10 56.32 3dgg s TRP 151 Cb -0.09 -1.77 -0.01 0.00 -1.15 0.00 0.00 33.47 30.46 3dgg s TRP 151 CO 0.01 0.38 -0.11 0.15 0.02 0.00 0.00 176.95 177.40 3dgg s LYS 152 N -0.77 0.88 -0.07 4.98 1.02 0.62 -1.43 119.74 124.97 3dgg s LYS 152 Ca 0.12 -0.38 0.05 0.00 0.02 0.00 0.00 55.97 55.78 3dgg s LYS 152 Cb -0.11 -0.85 -0.01 0.00 -0.52 0.00 0.00 37.83 36.34 3dgg s LYS 152 CO 0.02 0.22 -0.24 0.42 -0.92 0.00 0.00 175.35 174.85 3dgg s ILE 153 N -0.22 1.98 -1.75 2.17 1.01 -0.30 -1.02 121.20 123.07 3dgg s ILE 153 Ca 0.04 -1.01 -0.14 0.00 0.00 0.00 0.00 60.65 59.53 3dgg s ILE 153 Cb -0.04 -1.68 0.14 0.00 0.01 0.00 0.00 42.46 40.89 3dgg s ILE 153 CO -0.00 0.55 0.36 0.47 0.00 0.00 0.00 174.94 176.31 3dgg n ASP 154 N 3.13 -0.71 0.00 3.58 8.00 -0.23 -1.00 116.55 129.32 3dgg n ASP 154 Ca -0.18 -1.26 0.00 0.00 0.71 0.00 0.00 54.79 54.06 3dgg n ASP 154 Cb 0.52 -1.59 0.00 0.00 -0.02 0.00 0.00 41.12 40.03 3dgg n ASP 154 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3dgg n GLY 155 N -1.67 0.49 2.95 0.44 0.00 -1.26 -5.03 105.19 101.12 3dgg n GLY 155 Ca -0.06 -0.14 -0.15 0.00 0.00 0.00 0.00 46.02 45.67 3dgg n GLY 155 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3dgg s SER 156 N -2.12 0.54 0.14 1.61 0.15 -0.17 -5.08 113.70 108.77 3dgg s SER 156 Ca 0.00 -0.11 -0.31 0.00 0.70 0.00 0.00 55.95 56.22 3dgg s SER 156 Cb 0.00 -0.05 -0.09 0.00 -1.71 0.00 0.00 66.02 64.16 3dgg s SER 156 CO 0.00 0.04 1.53 -0.70 1.20 0.00 0.00 173.24 175.31 3dgg s GLU 157 N -0.20 4.24 0.07 5.44 2.12 -1.26 -1.15 118.70 127.95 3dgg s GLU 157 Ca 0.01 2.29 0.06 0.00 0.36 0.00 0.00 54.97 57.69 3dgg s GLU 157 Cb -0.02 -3.22 -0.04 0.00 0.26 0.00 0.00 34.13 31.11 3dgg s GLU 157 CO -0.00 -0.58 -0.10 1.03 -0.54 0.00 0.00 175.26 175.07 3dgg s ARG 158 N 1.28 2.26 0.00 4.30 3.00 -0.52 -4.91 118.95 124.37 3dgg s ARG 158 Ca 0.69 -0.92 0.00 0.00 0.00 0.00 0.00 55.73 55.50 3dgg s ARG 158 Cb -0.42 -2.36 0.00 0.00 0.00 0.00 0.00 34.95 32.18 3dgg s ARG 158 CO 0.31 0.54 0.00 1.04 0.00 0.00 0.00 175.30 177.19 3dgg n GLN 159 N 1.07 2.37 -2.30 3.54 6.02 -1.26 -4.18 117.38 122.64 3dgg n GLN 159 Ca -0.14 0.00 -0.38 0.00 -0.01 0.00 0.00 57.00 56.47 3dgg n GLN 159 Cb 0.52 -0.77 -0.02 0.00 1.02 0.00 0.00 30.24 30.99 3dgg n GLN 159 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 3dgg s ASN 160 N -1.74 6.54 -0.80 1.08 0.02 -1.26 -3.71 114.94 115.06 3dgg s ASN 160 Ca 0.00 2.35 0.00 0.00 -1.02 0.00 0.00 52.86 54.19 3dgg s ASN 160 Cb 0.00 -2.61 0.00 0.00 0.02 0.00 0.00 41.25 38.66 3dgg s ASN 160 CO 0.00 -0.67 0.00 0.61 0.02 0.00 0.00 177.10 177.06 3dgg n GLY 161 N 0.63 0.63 3.59 0.66 0.00 -1.26 -4.73 105.19 104.71 3dgg n GLY 161 Ca 0.04 -0.62 -0.35 0.00 0.00 0.00 0.00 46.02 45.09 3dgg n GLY 161 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3dgg s VAL 162 N -2.35 4.74 -0.09 1.61 1.01 -1.24 -0.25 120.40 123.83 3dgg s VAL 162 Ca 0.00 -0.04 0.03 0.00 0.00 0.00 0.00 61.98 61.97 3dgg s VAL 162 Cb 0.00 -3.16 0.01 0.00 0.00 0.00 0.00 36.38 33.22 3dgg s VAL 162 CO 0.00 0.42 -0.18 -0.76 0.00 0.00 0.00 175.10 174.58 3dgg s LEU 163 N 0.73 1.87 0.06 3.92 1.43 -0.01 -4.97 118.68 121.70 3dgg s LEU 163 Ca 0.04 -0.45 0.08 0.00 -1.03 0.00 0.00 54.13 52.77 3dgg s LEU 163 Cb -0.13 -1.15 -0.03 0.00 0.03 0.00 0.00 46.19 44.91 3dgg s LEU 163 CO 0.02 0.08 -0.19 0.20 0.23 0.00 0.00 176.35 176.69 3dgg s ASN 164 N 0.60 3.73 -0.08 2.29 0.01 -1.26 -0.53 114.94 119.70 3dgg s ASN 164 Ca -0.15 -0.48 -0.05 0.00 -0.71 0.00 0.00 52.86 51.47 3dgg s ASN 164 Cb -0.17 -0.55 0.03 0.00 0.41 0.00 0.00 41.25 40.97 3dgg s ASN 164 CO 0.05 0.24 0.20 -0.55 -1.51 0.00 0.00 177.10 175.52 3dgg s SER 165 N -1.55 -0.20 0.00 -1.22 0.15 -0.55 -5.01 113.70 105.32 3dgg s SER 165 Ca 0.15 0.41 0.07 0.00 0.70 0.00 0.00 55.95 57.27 3dgg s SER 165 Cb -0.10 0.35 -0.03 0.00 -1.71 0.00 0.00 66.02 64.53 3dgg s SER 165 CO 0.06 -0.11 -0.21 0.26 1.20 0.00 0.00 173.24 174.43 3dgg s TRP 166 N 0.66 2.47 0.52 3.44 0.51 -1.26 -1.03 118.94 124.25 3dgg s TRP 166 Ca -0.05 -0.33 -0.07 0.00 -2.12 0.00 0.00 56.10 53.54 3dgg s TRP 166 Cb -0.06 -1.49 -0.04 0.00 -0.81 0.00 0.00 33.47 31.07 3dgg s TRP 166 CO -0.04 0.12 0.86 0.95 -0.51 0.00 0.00 176.95 178.34 3dgg s THR 167 N -0.76 4.85 1.02 2.01 -4.23 -0.81 -5.01 115.64 112.70 3dgg s THR 167 Ca 0.12 0.41 -0.13 0.00 -1.18 0.00 0.00 61.69 60.91 3dgg s THR 167 Cb -0.10 -3.87 0.20 0.00 1.34 0.00 0.00 72.50 70.07 3dgg s THR 167 CO 0.02 -0.94 1.10 -1.81 -0.54 0.00 0.00 174.62 172.44 3dgg s ASP 168 N -4.12 2.49 0.24 3.99 1.11 -1.26 -4.59 116.67 114.52 3dgg s ASP 168 Ca 0.50 1.12 -0.30 0.00 0.18 0.00 0.00 52.55 54.05 3dgg s ASP 168 Cb -0.10 -1.77 -0.10 0.00 1.07 0.00 0.00 42.92 42.02 3dgg s ASP 168 CO 0.48 -3.21 1.50 -1.58 1.18 0.00 0.00 175.17 173.54 3dgg s GLN 169 N -5.00 4.23 0.26 8.23 0.74 -1.26 -4.73 119.66 122.13 3dgg s GLN 169 Ca 0.66 2.37 -0.30 0.00 0.05 0.00 0.00 55.36 58.13 3dgg s GLN 169 Cb -0.18 -3.10 -0.11 0.00 1.10 0.00 0.00 33.01 30.72 3dgg s GLN 169 CO 0.57 -0.50 1.53 0.34 -0.55 0.00 0.00 175.29 176.68 3dgg s ASP 170 N 0.58 6.51 0.38 6.67 2.15 0.06 -4.93 116.67 128.09 3dgg s ASP 170 Ca 0.63 2.80 0.09 0.00 0.43 0.00 0.00 52.55 56.50 3dgg s ASP 170 Cb -0.43 -2.63 0.75 0.00 -0.30 0.00 0.00 42.92 40.31 3dgg s ASP 170 CO 0.41 -0.82 1.90 0.28 -0.17 0.00 0.00 175.17 176.77 3dgg h SER 171 N 5.12 0.23 0.00 -0.34 0.02 -1.91 -2.25 113.55 114.43 3dgg h SER 171 Ca -0.46 -0.05 -0.32 0.00 -0.84 0.00 0.00 61.79 60.12 3dgg h SER 171 Cb 1.22 -0.06 -0.05 0.00 0.14 0.00 0.00 62.40 63.65 3dgg h SER 171 CO 0.80 0.41 -1.73 0.29 -1.14 0.00 0.00 176.83 175.46 3dgg n LYS 172 N -4.25 0.58 0.00 3.45 5.02 -1.26 -3.07 118.16 118.62 3dgg n LYS 172 Ca -0.01 0.46 0.03 0.00 -2.02 0.00 0.00 58.31 56.77 3dgg n LYS 172 Cb 0.29 -1.66 0.02 0.00 -0.02 0.00 0.00 35.03 33.65 3dgg n LYS 172 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 3dgg n ASP 173 N -4.34 1.29 -0.88 4.39 5.68 -1.26 -4.86 116.55 116.58 3dgg n ASP 173 Ca -0.40 -1.15 -0.11 0.00 -0.50 0.00 0.00 54.79 52.63 3dgg n ASP 173 Cb 0.76 0.17 -0.04 0.00 -1.14 0.00 0.00 41.12 40.87 3dgg n ASP 173 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 3dgg n SER 174 N 0.09 -4.27 -4.98 -1.12 7.64 -0.84 -4.98 113.62 105.16 3dgg n SER 174 Ca 0.03 0.25 -0.20 0.00 1.01 0.00 0.00 58.87 59.96 3dgg n SER 174 Cb 0.14 -2.80 0.03 0.00 -1.01 0.00 0.00 64.21 60.57 3dgg n SER 174 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 3dgg s THR 175 N -2.42 2.73 0.26 0.44 -4.23 -1.26 -4.65 115.64 106.51 3dgg s THR 175 Ca 0.00 -0.73 0.11 0.00 -1.18 0.00 0.00 61.69 59.89 3dgg s THR 175 Cb 0.00 -3.00 -0.05 0.00 1.34 0.00 0.00 72.50 70.79 3dgg s THR 175 CO 0.00 0.00 -0.13 -0.31 -0.54 0.00 0.00 174.62 173.64 3dgg s TYR 176 N -2.68 2.46 0.08 3.99 1.51 0.69 -0.76 117.35 122.64 3dgg s TYR 176 Ca 0.57 -0.29 0.00 0.00 -1.01 0.00 0.00 57.07 56.35 3dgg s TYR 176 Cb -0.10 -1.09 -0.04 0.00 -0.11 0.00 0.00 41.96 40.61 3dgg s TYR 176 CO 0.37 0.66 -0.04 -1.12 -1.11 0.00 0.00 175.55 174.31 3dgg s SER 177 N -3.46 0.78 -0.10 2.29 0.01 -1.26 -0.42 113.70 111.54 3dgg s SER 177 Ca 0.30 -1.02 -0.17 0.00 1.31 0.00 0.00 55.95 56.37 3dgg s SER 177 Cb -0.06 0.16 0.04 0.00 0.21 0.00 0.00 66.02 66.37 3dgg s SER 177 CO 0.16 -0.55 0.42 -0.32 0.41 0.00 0.00 173.24 173.36 3dgg s MET 178 N -3.89 0.63 0.01 12.44 0.00 -0.11 -1.92 119.30 126.46 3dgg s MET 178 Ca 0.10 0.27 0.08 0.00 0.00 0.00 0.00 55.69 56.15 3dgg s MET 178 Cb 0.07 0.30 -0.02 0.00 0.00 0.00 0.00 34.83 35.17 3dgg s MET 178 CO -0.07 -0.14 -0.26 -1.54 0.00 0.00 0.00 175.02 173.02 3dgg s SER 179 N -0.51 3.15 -0.08 1.11 1.04 -0.20 -0.04 113.70 118.17 3dgg s SER 179 Ca -0.06 -0.51 0.03 0.00 0.48 0.00 0.00 55.95 55.89 3dgg s SER 179 Cb -0.03 -0.34 0.01 0.00 0.10 0.00 0.00 66.02 65.75 3dgg s SER 179 CO 0.03 0.29 -0.15 -0.55 0.98 0.00 0.00 173.24 173.84 3dgg s SER 180 N -0.89 2.21 -0.14 7.02 0.15 0.29 -1.48 113.70 120.87 3dgg s SER 180 Ca 0.11 -0.38 0.01 0.00 0.70 0.00 0.00 55.95 56.38 3dgg s SER 180 Cb -0.10 -1.01 0.02 0.00 -1.71 0.00 0.00 66.02 63.22 3dgg s SER 180 CO 0.00 0.06 -0.15 -0.89 1.20 0.00 0.00 173.24 173.46 3dgg s THR 181 N 0.66 1.61 -0.36 6.45 2.01 0.32 -0.48 115.64 125.84 3dgg s THR 181 Ca -0.14 -0.67 -0.14 0.00 0.31 0.00 0.00 61.69 61.04 3dgg s THR 181 Cb -0.16 -1.49 -0.01 0.00 0.01 0.00 0.00 72.50 70.86 3dgg s THR 181 CO 0.04 0.46 0.31 -0.22 -0.69 0.00 0.00 174.62 174.52 3dgg s LEU 182 N 1.28 4.62 -0.22 4.42 2.96 -0.23 -0.83 118.68 130.67 3dgg s LEU 182 Ca 0.01 -0.46 -0.07 0.00 -0.22 0.00 0.00 54.13 53.39 3dgg s LEU 182 Cb -0.14 -2.23 -0.03 0.00 0.50 0.00 0.00 46.19 44.29 3dgg s LEU 182 CO -0.07 -0.33 0.06 -0.89 -1.32 0.00 0.00 176.35 173.79 3dgg s THR 183 N 1.85 4.35 0.39 3.68 2.01 0.65 -0.48 115.64 128.09 3dgg s THR 183 Ca 0.08 -0.17 0.04 0.00 0.31 0.00 0.00 61.69 61.96 3dgg s THR 183 Cb -0.17 -3.01 -0.03 0.00 0.01 0.00 0.00 72.50 69.30 3dgg s THR 183 CO 0.11 0.38 0.15 -1.48 -0.69 0.00 0.00 174.62 173.09 3dgg s LEU 184 N 1.21 1.93 0.57 4.42 2.34 0.62 -4.60 118.68 125.18 3dgg s LEU 184 Ca 0.04 -1.67 -0.16 0.00 0.06 0.00 0.00 54.13 52.40 3dgg s LEU 184 Cb -0.14 0.00 -0.05 0.00 -0.56 0.00 0.00 46.19 45.44 3dgg s LEU 184 CO 0.03 -0.94 1.03 0.42 -1.06 0.00 0.00 176.35 175.83 3dgg s THR 185 N -3.28 4.06 0.18 5.48 -4.23 -1.26 -1.24 115.64 115.36 3dgg s THR 185 Ca 0.27 0.98 -0.15 0.00 -1.18 0.00 0.00 61.69 61.61 3dgg s THR 185 Cb 0.03 -3.50 0.15 0.00 1.34 0.00 0.00 72.50 70.51 3dgg s THR 185 CO 0.16 -0.57 1.66 0.50 -0.54 0.00 0.00 174.62 175.83 3dgg h LYS 186 N 0.59 0.02 -0.81 3.99 3.11 -1.48 -0.19 116.57 121.81 3dgg h LYS 186 Ca -0.47 -0.00 0.04 0.00 -2.81 0.00 0.00 60.65 57.41 3dgg h LYS 186 Cb 1.21 -0.00 -0.05 0.00 -1.00 0.00 0.00 32.23 32.38 3dgg h LYS 186 CO 0.59 0.01 0.51 -0.44 -2.81 0.00 0.00 179.45 177.31 3dgg h ASP 187 N 0.02 0.83 -0.19 4.20 5.19 -1.93 -2.03 116.42 122.50 3dgg h ASP 187 Ca 0.24 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.65 3dgg h ASP 187 Cb 0.37 -0.17 -0.01 0.00 0.18 0.00 0.00 39.33 39.70 3dgg h ASP 187 CO -0.49 0.56 0.10 -0.33 -3.12 0.00 0.00 179.24 175.95 3dgg h GLU 188 N 0.97 0.28 -0.65 3.56 5.08 -1.72 -3.04 114.58 119.06 3dgg h GLU 188 Ca 0.33 -0.04 0.10 0.00 -1.00 0.00 0.00 59.36 58.75 3dgg h GLU 188 Cb 0.06 -0.05 -0.07 0.00 0.50 0.00 0.00 28.75 29.19 3dgg h GLU 188 CO -0.13 0.29 0.28 -0.92 -1.00 0.00 0.00 179.01 177.53 3dgg h TYR 189 N 0.19 0.49 0.00 4.33 3.20 -0.69 -1.99 116.97 122.50 3dgg h TYR 189 Ca 0.07 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.97 3dgg h TYR 189 Cb 0.10 -0.12 0.00 0.00 1.54 0.00 0.00 36.73 38.25 3dgg h TYR 189 CO -0.03 0.14 0.00 0.39 -1.64 0.00 0.00 178.16 177.03 3dgg n GLU 190 N -4.95 0.27 0.00 1.82 -0.58 -0.80 -2.71 120.64 113.70 3dgg n GLU 190 Ca 0.10 0.07 0.13 0.00 -0.42 0.00 0.00 57.16 57.04 3dgg n GLU 190 Cb 0.28 -1.50 0.49 0.00 -0.57 0.00 0.00 31.44 30.13 3dgg n GLU 190 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 3dgg n ARG 191 N -1.33 0.14 -4.38 3.49 1.74 -0.75 -4.91 116.66 110.66 3dgg n ARG 191 Ca 0.10 -0.05 -0.21 0.00 -0.77 0.00 0.00 57.85 56.93 3dgg n ARG 191 Cb 0.21 -1.50 -0.10 0.00 -1.02 0.00 0.00 32.46 30.05 3dgg n ARG 191 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 3dgg s HIS 192 N -2.89 1.92 -0.19 -1.55 3.76 -1.10 -5.08 115.29 110.16 3dgg s HIS 192 Ca 0.16 -0.48 0.03 0.00 -0.15 0.00 0.00 55.06 54.62 3dgg s HIS 192 Cb 0.19 -0.88 -0.14 0.00 1.11 0.00 0.00 32.58 32.86 3dgg s HIS 192 CO 0.58 0.47 -0.15 0.09 -0.85 0.00 0.00 174.74 174.87 3dgg n ASN 193 N -0.32 2.33 -4.27 1.40 5.03 -1.26 -4.81 115.26 113.35 3dgg n ASN 193 Ca -0.08 -0.10 -0.32 0.00 0.87 0.00 0.00 54.58 54.95 3dgg n ASN 193 Cb 0.60 -0.19 -0.16 0.00 -1.02 0.00 0.00 39.78 39.00 3dgg n ASN 193 CO 0.00 0.00 0.00 -0.55 -1.83 0.00 0.00 177.26 174.88 3dgg s SER 194 N -5.82 3.24 -0.05 6.41 0.15 -1.26 -0.70 113.70 115.67 3dgg s SER 194 Ca -0.25 -0.49 0.04 0.00 0.70 0.00 0.00 55.95 55.95 3dgg s SER 194 Cb 0.07 -1.15 -0.00 0.00 -1.71 0.00 0.00 66.02 63.22 3dgg s SER 194 CO 0.48 0.21 -0.18 -0.31 1.20 0.00 0.00 173.24 174.64 3dgg s TYR 195 N 0.06 1.78 -0.05 3.44 1.51 -0.77 -1.07 117.35 122.26 3dgg s TYR 195 Ca -0.10 -0.54 -0.02 0.00 -1.01 0.00 0.00 57.07 55.41 3dgg s TYR 195 Cb -0.15 -1.20 0.04 0.00 -0.11 0.00 0.00 41.96 40.53 3dgg s TYR 195 CO 0.06 -0.19 0.10 0.99 -1.11 0.00 0.00 175.55 175.39 3dgg s THR 196 N 0.11 -0.09 -0.10 -0.71 2.01 -0.19 -1.40 115.64 115.27 3dgg s THR 196 Ca -0.06 0.24 -0.00 0.00 0.31 0.00 0.00 61.69 62.19 3dgg s THR 196 Cb -0.12 -0.18 -0.03 0.00 0.01 0.00 0.00 72.50 72.18 3dgg s THR 196 CO 0.03 0.10 -0.08 0.00 -0.69 0.00 0.00 174.62 173.98 3dgg s GLU 198 N -0.33 0.99 -0.19 0.00 -1.05 -0.15 -1.68 118.70 116.29 3dgg s GLU 198 Ca 0.04 -0.34 -0.08 0.00 -0.15 0.00 0.00 54.97 54.45 3dgg s GLU 198 Cb -0.13 -0.92 -0.04 0.00 -0.44 0.00 0.00 34.13 32.60 3dgg s GLU 198 CO 0.02 0.15 0.07 0.00 0.95 0.00 0.00 175.26 176.45 3dgg s ALA 199 N 0.09 3.40 -0.31 -0.84 0.00 1.00 -0.80 121.76 124.29 3dgg s ALA 199 Ca -0.02 -0.78 -0.11 0.00 0.00 0.00 0.00 51.96 51.06 3dgg s ALA 199 Cb -0.08 -1.95 -0.02 0.00 0.00 0.00 0.00 23.12 21.08 3dgg s ALA 199 CO 0.00 0.12 0.18 0.99 0.00 0.00 0.00 175.76 177.05 3dgg s THR 200 N 0.48 4.89 0.22 0.00 2.01 0.10 -0.70 115.64 122.65 3dgg s THR 200 Ca 0.03 -0.24 0.03 0.00 0.31 0.00 0.00 61.69 61.82 3dgg s THR 200 Cb -0.13 -3.45 -0.05 0.00 0.01 0.00 0.00 72.50 68.88 3dgg s THR 200 CO 0.01 0.10 0.02 -2.28 -0.69 0.00 0.00 174.62 171.78 3dgg s HIS 201 N 1.67 1.47 -0.09 4.92 5.04 -1.26 -1.37 115.29 125.67 3dgg s HIS 201 Ca 0.06 -1.00 0.30 0.00 -1.54 0.00 0.00 55.06 52.87 3dgg s HIS 201 Cb -0.17 -0.85 0.99 0.00 0.04 0.00 0.00 32.58 32.59 3dgg s HIS 201 CO 0.08 -0.15 1.85 0.87 -2.34 0.00 0.00 174.74 175.05 3dgg h LYS 202 N 2.51 0.00 0.15 2.88 6.56 -1.91 -3.33 116.57 123.43 3dgg h LYS 202 Ca -0.38 0.00 -0.01 0.00 -1.06 0.00 0.00 60.65 59.20 3dgg h LYS 202 Cb 1.22 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.88 3dgg h LYS 202 CO 0.63 0.01 -0.07 1.79 -2.06 0.00 0.00 179.45 179.75 3dgg h THR 203 N 0.00 0.98 -2.76 -0.16 1.35 -1.91 -3.45 112.91 106.95 3dgg h THR 203 Ca -0.00 -1.04 -0.56 0.00 -0.55 0.00 0.00 66.41 64.26 3dgg h THR 203 Cb 0.69 1.57 -0.03 0.00 -1.73 0.00 0.00 68.15 68.66 3dgg h THR 203 CO 0.00 0.23 -0.43 -0.55 -0.25 0.00 0.00 175.52 174.52 3dgg s SER 204 N -5.46 6.37 0.10 5.36 0.15 -1.25 -5.01 113.70 113.96 3dgg s SER 204 Ca -0.14 0.29 -0.13 0.00 0.70 0.00 0.00 55.95 56.67 3dgg s SER 204 Cb 0.01 -1.96 -0.17 0.00 -1.71 0.00 0.00 66.02 62.19 3dgg s SER 204 CO 0.55 0.06 1.29 0.74 1.20 0.00 0.00 173.24 177.07 3dgg h THR 205 N 1.75 1.28 -3.31 6.45 2.02 -1.88 -3.43 112.91 115.78 3dgg h THR 205 Ca -0.47 -2.00 -0.56 0.00 0.77 0.00 0.00 66.41 64.15 3dgg h THR 205 Cb 1.18 2.03 -0.03 0.00 -1.74 0.00 0.00 68.15 69.59 3dgg h THR 205 CO 0.71 0.63 -0.21 -0.44 0.37 0.00 0.00 175.52 176.58 3dgg s SER 206 N -7.12 6.56 0.53 4.18 0.01 -1.26 -5.04 113.70 111.56 3dgg s SER 206 Ca -0.10 0.76 -0.19 0.00 1.31 0.00 0.00 55.95 57.73 3dgg s SER 206 Cb 0.08 -2.16 -0.06 0.00 0.21 0.00 0.00 66.02 64.09 3dgg s SER 206 CO 0.91 -0.02 1.06 -2.16 0.41 0.00 0.00 173.24 173.45 3dgg s PRO 207 N -2.75 3.56 -0.23 12.44 0.04 -1.26 -4.84 135.00 141.95 3dgg s PRO 207 Ca 0.44 1.38 -0.23 0.00 0.04 0.00 0.00 61.00 62.63 3dgg s PRO 207 Cb -0.12 -2.06 -0.01 0.00 0.04 0.00 0.00 34.50 32.36 3dgg s PRO 207 CO 0.23 -0.64 0.75 0.42 0.04 0.00 0.00 177.00 177.81 3dgg s ILE 208 N -2.05 4.90 0.00 0.56 1.01 0.13 -4.87 121.20 120.87 3dgg s ILE 208 Ca 0.68 1.42 0.08 0.00 0.00 0.00 0.00 60.65 62.82 3dgg s ILE 208 Cb -0.18 -4.05 -0.02 0.00 0.01 0.00 0.00 42.46 38.22 3dgg s ILE 208 CO 0.26 -0.01 -0.24 0.68 0.00 0.00 0.00 174.94 175.63 3dgg s VAL 209 N 2.57 1.90 -0.03 2.92 -7.23 -1.26 -0.00 120.40 119.27 3dgg s VAL 209 Ca 0.32 -1.11 0.04 0.00 -1.81 0.00 0.00 61.98 59.42 3dgg s VAL 209 Cb -0.16 -1.60 -0.00 0.00 0.56 0.00 0.00 36.38 35.18 3dgg s VAL 209 CO 0.09 0.46 -0.14 -0.75 -0.31 0.00 0.00 175.10 174.44 3dgg s LYS 210 N -0.77 1.35 0.12 4.82 2.47 -0.67 -5.02 119.74 122.04 3dgg s LYS 210 Ca 0.09 -0.50 -0.02 0.00 -1.56 0.00 0.00 55.97 53.98 3dgg s LYS 210 Cb -0.09 -1.24 -0.03 0.00 -1.46 0.00 0.00 37.83 35.00 3dgg s LYS 210 CO 0.00 0.24 0.07 -1.54 0.16 0.00 0.00 175.35 174.28 3dgg s SER 211 N -0.08 0.30 0.10 1.43 1.04 -1.26 -1.90 113.70 113.33 3dgg s SER 211 Ca 0.00 -1.11 -0.07 0.00 0.48 0.00 0.00 55.95 55.25 3dgg s SER 211 Cb -0.08 0.30 -0.01 0.00 0.10 0.00 0.00 66.02 66.32 3dgg s SER 211 CO 0.01 -0.73 0.16 0.72 0.98 0.00 0.00 173.24 174.38 3dgg s PHE 212 N -4.01 0.29 -0.26 5.02 -0.12 -0.49 -5.01 117.98 113.40 3dgg s PHE 212 Ca 0.20 -0.73 -0.08 0.00 -0.05 0.00 0.00 56.93 56.27 3dgg s PHE 212 Cb 0.07 -0.14 -0.03 0.00 -0.63 0.00 0.00 43.02 42.30 3dgg s PHE 212 CO -0.01 -0.54 0.08 -0.80 -0.05 0.00 0.00 175.22 173.90 3dgg s ASN 213 N -2.90 5.20 0.29 1.98 0.01 -1.26 -1.84 114.94 116.43 3dgg s ASN 213 Ca 0.08 -0.24 0.05 0.00 -0.71 0.00 0.00 52.86 52.04 3dgg s ASN 213 Cb 0.05 -1.94 0.75 0.00 0.41 0.00 0.00 41.25 40.53 3dgg s ASN 213 CO -0.08 -0.05 1.70 -0.09 -1.51 0.00 0.00 177.10 177.06 3dgg h ARG 214 N 8.25 0.40 -1.22 -0.60 2.43 -1.23 -2.41 114.38 120.00 3dgg h ARG 214 Ca -0.37 -0.02 -0.21 0.00 -0.81 0.00 0.00 59.98 58.56 3dgg h ARG 214 Cb 1.17 -0.09 -0.11 0.00 -0.42 0.00 0.00 29.97 30.52 3dgg h ARG 214 CO 0.58 0.26 0.27 0.27 -1.51 0.00 0.00 179.97 179.84 3dgg n ASN 215 N -5.04 4.26 -0.00 -3.80 2.04 -1.26 -4.36 115.26 107.10 3dgg n ASN 215 Ca 0.23 -2.69 -0.11 0.00 -0.44 0.00 0.00 54.58 51.57 3dgg n ASN 215 Cb 0.67 -0.78 -0.09 0.00 -2.53 0.00 0.00 39.78 37.06 3dgg n ASN 215 CO 0.00 0.00 0.00 -0.33 -0.44 0.00 0.00 177.26 176.49 3dgg h GLU 216 N 0.70 -0.10 -0.01 -3.83 4.39 -1.84 -3.55 114.58 110.34 3dgg h GLU 216 Ca 0.23 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.93 3dgg h GLU 216 Cb 1.43 0.02 0.00 0.00 -0.10 0.00 0.00 28.75 30.10 3dgg h GLU 216 CO 0.46 0.45 0.00 0.00 -1.16 0.00 0.00 179.01 178.76