#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qqk s ILE 2 N 0.00 3.77 -0.18 5.18 1.01 -1.26 -5.02 121.20 124.70 2qqk s ILE 2 Ca 0.00 1.11 -0.09 0.00 0.00 0.00 0.00 60.65 61.67 2qqk s ILE 2 Cb 0.00 -3.72 -0.05 0.00 0.01 0.00 0.00 42.46 38.71 2qqk s ILE 2 CO 0.00 -0.02 0.14 -1.10 0.00 0.00 0.00 174.94 173.96 2qqk s GLN 3 N 2.64 4.00 -0.11 2.79 1.11 -1.26 -4.72 119.66 124.11 2qqk s GLN 3 Ca 0.64 -0.18 -0.02 0.00 0.01 0.00 0.00 55.36 55.81 2qqk s GLN 3 Cb -0.30 -3.36 -0.03 0.00 -1.01 0.00 0.00 33.01 28.30 2qqk s GLN 3 CO 0.26 0.42 -0.03 -1.64 0.01 0.00 0.00 175.29 174.31 2qqk s MET 4 N 0.00 3.16 -0.13 2.91 -1.94 -1.26 -1.44 119.30 120.60 2qqk s MET 4 Ca 0.10 -0.48 -0.02 0.00 -1.71 0.00 0.00 55.69 53.59 2qqk s MET 4 Cb -0.11 -2.79 0.04 0.00 2.01 0.00 0.00 34.83 33.98 2qqk s MET 4 CO -0.00 0.54 0.02 0.99 -0.01 0.00 0.00 175.02 176.56 2qqk s THR 5 N -0.45 0.40 0.05 2.05 2.01 -0.66 -4.23 115.64 114.81 2qqk s THR 5 Ca 0.07 -0.18 -0.00 0.00 0.31 0.00 0.00 61.69 61.90 2qqk s THR 5 Cb -0.12 -0.74 -0.04 0.00 0.01 0.00 0.00 72.50 71.61 2qqk s THR 5 CO 0.02 0.03 0.19 -1.10 -0.69 0.00 0.00 174.62 173.07 2qqk s GLN 6 N 1.94 3.40 -0.15 4.92 -0.21 -1.26 -0.89 119.66 127.40 2qqk s GLN 6 Ca 0.02 -0.43 -0.18 0.00 0.02 0.00 0.00 55.36 54.79 2qqk s GLN 6 Cb -0.14 -3.03 0.05 0.00 1.00 0.00 0.00 33.01 30.88 2qqk s GLN 6 CO -0.07 0.62 0.49 0.45 -2.12 0.00 0.00 175.29 174.67 2qqk s SER 7 N -2.39 -0.49 1.04 5.90 0.15 -0.24 -4.43 113.70 113.24 2qqk s SER 7 Ca 0.33 0.86 -0.14 0.00 0.70 0.00 0.00 55.95 57.71 2qqk s SER 7 Cb -0.13 0.89 0.21 0.00 -1.71 0.00 0.00 66.02 65.28 2qqk s SER 7 CO 0.26 -0.25 1.10 -2.16 1.20 0.00 0.00 173.24 173.39 2qqk s PRO 8 N -0.07 0.07 0.25 5.44 0.04 -1.26 0.27 135.00 139.75 2qqk s PRO 8 Ca -0.03 0.35 0.21 0.00 0.04 0.00 0.00 61.00 61.57 2qqk s PRO 8 Cb -0.03 -1.71 0.08 0.00 0.04 0.00 0.00 34.50 32.87 2qqk s PRO 8 CO 0.02 -2.93 1.19 0.66 0.04 0.00 0.00 177.00 175.98 2qqk h SER 9 N -2.03 0.00 -5.02 6.66 4.64 -1.84 -3.43 113.55 112.53 2qqk h SER 9 Ca -0.53 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 60.72 2qqk h SER 9 Cb 1.33 0.00 -0.17 0.00 -0.31 0.00 0.00 62.40 63.25 2qqk h SER 9 CO 0.53 0.12 -0.05 -0.94 -0.87 0.00 0.00 176.83 175.62 2qqk s SER 10 N -5.73 -0.36 0.09 4.97 1.04 -1.26 -1.43 113.70 111.01 2qqk s SER 10 Ca 0.01 0.13 -0.18 0.00 0.48 0.00 0.00 55.95 56.39 2qqk s SER 10 Cb 0.08 0.45 0.04 0.00 0.10 0.00 0.00 66.02 66.69 2qqk s SER 10 CO 0.76 -0.66 0.44 -1.48 0.98 0.00 0.00 173.24 173.28 2qqk s LEU 11 N -1.86 0.26 0.06 2.42 0.05 -0.29 -4.93 118.68 114.39 2qqk s LEU 11 Ca -0.07 -0.11 0.06 0.00 0.05 0.00 0.00 54.13 54.07 2qqk s LEU 11 Cb -0.01 1.90 -0.03 0.00 -2.05 0.00 0.00 46.19 46.00 2qqk s LEU 11 CO -0.00 -0.77 -0.16 -0.94 -0.55 0.00 0.00 176.35 173.93 2qqk s SER 12 N -2.38 1.88 0.26 1.48 1.04 -1.26 -1.39 113.70 113.33 2qqk s SER 12 Ca -0.01 -0.54 -0.17 0.00 0.48 0.00 0.00 55.95 55.71 2qqk s SER 12 Cb 0.00 -0.11 0.01 0.00 0.10 0.00 0.00 66.02 66.03 2qqk s SER 12 CO -0.07 0.02 0.59 0.00 0.98 0.00 0.00 173.24 174.76 2qqk s ALA 13 N -1.01 -0.73 0.04 5.32 0.00 -1.14 -4.86 121.76 119.37 2qqk s ALA 13 Ca 0.02 -0.57 -0.05 0.00 0.00 0.00 0.00 51.96 51.36 2qqk s ALA 13 Cb -0.09 0.95 -0.05 0.00 0.00 0.00 0.00 23.12 23.94 2qqk s ALA 13 CO 0.02 -0.93 0.27 -1.12 0.00 0.00 0.00 175.76 174.00 2qqk s SER 14 N -2.96 6.46 0.07 0.00 0.01 -1.26 0.92 113.70 116.94 2qqk s SER 14 Ca 0.16 0.50 -0.35 0.00 1.31 0.00 0.00 55.95 57.57 2qqk s SER 14 Cb -0.03 -2.06 -0.14 0.00 0.21 0.00 0.00 66.02 64.00 2qqk s SER 14 CO 0.07 0.21 1.60 0.52 0.41 0.00 0.00 173.24 176.05 2qqk n VAL 15 N 0.80 0.13 0.00 3.43 0.31 -1.26 -1.29 118.33 120.45 2qqk n VAL 15 Ca -0.09 -0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.22 2qqk n VAL 15 Cb 0.52 -1.46 0.00 0.00 -0.91 0.00 0.00 33.84 32.00 2qqk n VAL 15 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2qqk n GLY 16 N 3.49 1.64 3.71 2.92 0.00 -0.61 -4.92 105.19 111.42 2qqk n GLY 16 Ca 0.19 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.90 2qqk n GLY 16 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2qqk s ASP 17 N -0.69 3.56 -0.32 1.61 1.01 -0.41 -4.39 116.67 117.03 2qqk s ASP 17 Ca 0.00 2.07 -0.09 0.00 0.71 0.00 0.00 52.55 55.24 2qqk s ASP 17 Cb 0.00 -2.55 0.01 0.00 1.01 0.00 0.00 42.92 41.38 2qqk s ASP 17 CO 0.00 -2.68 0.14 -0.60 0.21 0.00 0.00 175.17 172.24 2qqk s ARG 18 N -4.71 3.14 0.07 8.23 3.52 -1.26 -0.93 118.95 127.01 2qqk s ARG 18 Ca 0.65 -0.85 0.03 0.00 -0.13 0.00 0.00 55.73 55.44 2qqk s ARG 18 Cb -0.21 -3.54 -0.04 0.00 -1.56 0.00 0.00 34.95 29.60 2qqk s ARG 18 CO 0.57 -0.49 0.04 0.08 -0.81 0.00 0.00 175.30 174.69 2qqk s VAL 19 N 1.56 4.30 -0.02 7.11 1.01 0.85 -4.97 120.40 130.24 2qqk s VAL 19 Ca 0.03 -0.80 0.00 0.00 0.00 0.00 0.00 61.98 61.21 2qqk s VAL 19 Cb -0.18 -3.04 0.03 0.00 0.00 0.00 0.00 36.38 33.19 2qqk s VAL 19 CO 0.05 0.17 0.02 -0.89 0.00 0.00 0.00 175.10 174.45 2qqk s THR 20 N -1.31 0.02 0.05 3.92 2.01 -1.26 -0.96 115.64 118.11 2qqk s THR 20 Ca 0.26 0.16 0.04 0.00 0.31 0.00 0.00 61.69 62.46 2qqk s THR 20 Cb -0.12 -0.14 -0.02 0.00 0.01 0.00 0.00 72.50 72.23 2qqk s THR 20 CO 0.19 0.10 -0.12 0.27 -0.69 0.00 0.00 174.62 174.37 2qqk s ILE 21 N 0.96 0.91 0.18 1.82 -4.36 0.00 -4.82 121.20 115.90 2qqk s ILE 21 Ca -0.09 -1.04 0.11 0.00 -0.26 0.00 0.00 60.65 59.37 2qqk s ILE 21 Cb -0.12 -0.87 -0.04 0.00 1.25 0.00 0.00 42.46 42.67 2qqk s ILE 21 CO -0.02 -0.14 -0.22 -0.89 0.24 0.00 0.00 174.94 173.90 2qqk s THR 22 N -1.04 2.46 -0.11 8.37 2.01 0.14 -1.21 115.64 126.27 2qqk s THR 22 Ca -0.02 -1.94 -0.05 0.00 0.31 0.00 0.00 61.69 59.99 2qqk s THR 22 Cb -0.08 -2.17 0.05 0.00 0.01 0.00 0.00 72.50 70.30 2qqk s THR 22 CO 0.01 -0.08 0.24 0.00 -0.69 0.00 0.00 174.62 174.10 2qqk s ARG 24 N 1.42 1.77 0.41 0.00 0.52 -0.07 -0.42 118.95 122.57 2qqk s ARG 24 Ca -0.08 -1.10 -0.25 0.00 -0.52 0.00 0.00 55.73 53.78 2qqk s ARG 24 Cb -0.11 -2.67 -0.08 0.00 0.52 0.00 0.00 34.95 32.61 2qqk s ARG 24 CO -0.08 -0.60 1.16 0.00 0.02 0.00 0.00 175.30 175.79 2qqk s ALA 25 N 1.31 3.13 -2.17 2.13 0.00 -0.72 -1.66 121.76 123.78 2qqk s ALA 25 Ca -0.06 0.94 0.31 0.00 0.00 0.00 0.00 51.96 53.14 2qqk s ALA 25 Cb -0.19 -3.37 1.59 0.00 0.00 0.00 0.00 23.12 21.15 2qqk s ALA 25 CO -0.06 -0.51 2.05 -1.13 0.00 0.00 0.00 175.76 176.11 2qqk n SER 26 N 0.00 0.54 -3.52 0.00 3.41 -0.52 -4.82 113.62 108.71 2qqk n SER 26 Ca 0.05 -1.16 -0.10 0.00 -0.26 0.00 0.00 58.87 57.40 2qqk n SER 26 Cb 0.47 -0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.40 2qqk n SER 26 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2qqk s GLN 27 N -2.01 1.17 0.05 4.33 -2.07 -1.26 -4.94 119.66 114.92 2qqk s GLN 27 Ca 0.44 -0.48 -0.35 0.00 -1.82 0.00 0.00 55.36 53.15 2qqk s GLN 27 Cb 0.22 0.51 -0.14 0.00 -1.09 0.00 0.00 33.01 32.50 2qqk s GLN 27 CO 0.36 -0.52 1.60 -3.47 -1.32 0.00 0.00 175.29 171.94 2qqk n ASP 28 N -0.35 2.76 -0.20 12.60 -0.08 -1.26 -4.78 116.55 125.24 2qqk n ASP 28 Ca -0.12 1.07 0.03 0.00 -1.51 0.00 0.00 54.79 54.25 2qqk n ASP 28 Cb 0.63 -1.33 0.04 0.00 2.34 0.00 0.00 41.12 42.80 2qqk n ASP 28 CO 0.00 0.00 0.00 0.55 0.12 0.00 0.00 177.20 177.87 2qqk n VAL 29 N 3.68 0.68 0.00 5.18 3.14 0.13 -5.02 118.33 126.12 2qqk n VAL 29 Ca 0.19 -0.79 0.00 0.00 -2.96 0.00 0.00 64.34 60.79 2qqk n VAL 29 Cb 0.25 0.40 0.00 0.00 -1.06 0.00 0.00 33.84 33.43 2qqk n VAL 29 CO 0.00 0.00 0.00 -0.24 -6.46 0.00 0.00 176.83 170.13 2qqk n SER 30 N -0.48 0.00 -0.65 6.55 2.88 -1.23 -1.95 113.62 118.73 2qqk n SER 30 Ca 0.04 0.00 0.06 0.00 -1.33 0.00 0.00 58.87 57.64 2qqk n SER 30 Cb 0.57 0.00 0.20 0.00 -0.75 0.00 0.00 64.21 64.23 2qqk n SER 30 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 2qqk n THR 31 N 0.00 2.21 -2.42 2.46 -2.24 -1.26 -0.69 114.28 112.34 2qqk n THR 31 Ca 0.00 -2.34 -0.43 0.00 -2.27 0.00 0.00 64.05 59.01 2qqk n THR 31 Cb 0.00 -0.26 0.00 0.00 -2.10 0.00 0.00 70.33 67.97 2qqk n THR 31 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2qqk n ALA 32 N -1.01 5.09 -2.89 6.98 0.00 -0.82 -2.40 120.51 125.45 2qqk n ALA 32 Ca 0.22 -4.28 -0.22 0.00 0.00 0.00 0.00 53.44 49.16 2qqk n ALA 32 Cb 0.82 -3.03 -0.15 0.00 0.00 0.00 0.00 19.45 17.09 2qqk n ALA 32 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2qqk s VAL 33 N 0.79 1.01 0.17 0.00 1.01 -1.26 -1.47 120.40 120.65 2qqk s VAL 33 Ca 0.41 -0.50 0.10 0.00 0.00 0.00 0.00 61.98 61.99 2qqk s VAL 33 Cb 0.08 -0.87 -0.04 0.00 0.00 0.00 0.00 36.38 35.54 2qqk s VAL 33 CO 0.00 0.30 -0.19 0.00 0.00 0.00 0.00 175.10 175.21 2qqk s ALA 34 N 0.03 2.67 -0.05 5.51 0.00 -0.49 0.12 121.76 129.55 2qqk s ALA 34 Ca -0.01 -1.54 0.06 0.00 0.00 0.00 0.00 51.96 50.47 2qqk s ALA 34 Cb -0.08 -0.50 -0.01 0.00 0.00 0.00 0.00 23.12 22.52 2qqk s ALA 34 CO 0.01 0.47 -0.24 -1.58 0.00 0.00 0.00 175.76 174.41 2qqk s TRP 35 N -1.57 2.33 0.16 0.00 0.52 0.21 -0.20 118.94 120.39 2qqk s TRP 35 Ca 0.21 -0.64 0.10 0.00 0.02 0.00 0.00 56.10 55.79 2qqk s TRP 35 Cb -0.09 -1.52 -0.04 0.00 -1.15 0.00 0.00 33.47 30.67 2qqk s TRP 35 CO 0.11 -0.17 -0.21 0.71 0.02 0.00 0.00 176.95 177.40 2qqk s TYR 36 N -0.24 2.01 -0.16 -1.98 2.02 -0.04 -0.02 117.35 118.94 2qqk s TYR 36 Ca -0.01 -0.42 0.00 0.00 -0.37 0.00 0.00 57.07 56.28 2qqk s TYR 36 Cb -0.13 -1.02 0.00 0.00 -0.40 0.00 0.00 41.96 40.41 2qqk s TYR 36 CO 0.03 0.36 -0.15 -1.14 -1.57 0.00 0.00 175.55 173.07 2qqk s GLN 37 N -2.53 3.19 -0.26 -0.62 0.74 0.48 -1.46 119.66 119.20 2qqk s GLN 37 Ca 0.15 -0.76 -0.01 0.00 0.05 0.00 0.00 55.36 54.80 2qqk s GLN 37 Cb -0.08 -2.63 0.04 0.00 1.10 0.00 0.00 33.01 31.44 2qqk s GLN 37 CO 0.07 -0.03 -0.06 -1.14 -0.55 0.00 0.00 175.29 173.59 2qqk s GLN 38 N 0.91 2.60 0.40 1.67 0.74 0.14 -0.21 119.66 125.92 2qqk s GLN 38 Ca -0.03 -1.13 -0.10 0.00 0.05 0.00 0.00 55.36 54.15 2qqk s GLN 38 Cb -0.15 -3.01 -0.06 0.00 1.10 0.00 0.00 33.01 30.89 2qqk s GLN 38 CO -0.02 -0.49 0.75 0.15 -0.55 0.00 0.00 175.29 175.13 2qqk s LYS 39 N 1.26 3.75 0.18 1.67 1.02 -1.26 -0.59 119.74 125.76 2qqk s LYS 39 Ca -0.03 0.41 -0.32 0.00 0.02 0.00 0.00 55.97 56.05 2qqk s LYS 39 Cb -0.18 -2.41 -0.12 0.00 -0.52 0.00 0.00 37.83 34.60 2qqk s LYS 39 CO -0.04 -0.03 1.75 -2.30 -0.92 0.00 0.00 175.35 173.81 2qqk n PRO 40 N -1.34 2.73 -1.35 -1.68 -0.02 -1.26 -1.35 135.00 130.73 2qqk n PRO 40 Ca 0.02 0.99 -0.12 0.00 -2.02 0.00 0.00 63.50 62.36 2qqk n PRO 40 Cb 0.54 -2.84 -0.05 0.00 -0.02 0.00 0.00 33.50 31.13 2qqk n PRO 40 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2qqk n GLY 41 N 4.01 1.28 3.48 -1.23 0.00 -1.26 -5.00 105.19 106.47 2qqk n GLY 41 Ca 0.17 -0.29 -0.23 0.00 0.00 0.00 0.00 46.02 45.67 2qqk n GLY 41 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qqk s LYS 42 N -2.93 1.68 0.39 1.61 -0.14 -0.45 -5.13 119.74 114.76 2qqk s LYS 42 Ca 0.00 -1.91 -0.15 0.00 -1.36 0.00 0.00 55.97 52.55 2qqk s LYS 42 Cb 0.00 -1.12 -0.09 0.00 -1.68 0.00 0.00 37.83 34.94 2qqk s LYS 42 CO 0.00 -0.08 0.82 0.00 -0.76 0.00 0.00 175.35 175.32 2qqk s ALA 43 N -3.08 3.24 0.63 5.17 0.00 -1.26 -4.60 121.76 121.86 2qqk s ALA 43 Ca 0.34 0.06 -0.16 0.00 0.00 0.00 0.00 51.96 52.20 2qqk s ALA 43 Cb 0.07 -2.87 -0.02 0.00 0.00 0.00 0.00 23.12 20.31 2qqk s ALA 43 CO 0.15 0.13 1.12 -1.25 0.00 0.00 0.00 175.76 175.91 2qqk s PRO 44 N -3.38 2.93 -0.04 0.00 0.04 -1.26 -4.63 135.00 128.66 2qqk s PRO 44 Ca 0.55 1.48 0.07 0.00 0.04 0.00 0.00 61.00 63.13 2qqk s PRO 44 Cb -0.10 -1.96 -0.01 0.00 0.04 0.00 0.00 34.50 32.47 2qqk s PRO 44 CO 0.22 -1.16 -0.24 0.15 0.04 0.00 0.00 177.00 176.01 2qqk s LYS 45 N -3.85 2.23 0.15 4.56 1.02 0.71 -4.91 119.74 119.66 2qqk s LYS 45 Ca 0.69 -0.86 -0.31 0.00 0.02 0.00 0.00 55.97 55.51 2qqk s LYS 45 Cb -0.22 -2.00 -0.08 0.00 -0.52 0.00 0.00 37.83 35.01 2qqk s LYS 45 CO 0.37 0.43 1.37 -1.17 -0.92 0.00 0.00 175.35 175.43 2qqk s LEU 46 N -0.32 4.39 -0.17 3.17 2.96 -1.26 -0.39 118.68 127.06 2qqk s LEU 46 Ca 0.02 2.37 -0.11 0.00 -0.22 0.00 0.00 54.13 56.19 2qqk s LEU 46 Cb -0.12 -3.60 -0.07 0.00 0.50 0.00 0.00 46.19 42.90 2qqk s LEU 46 CO 0.02 -0.61 -0.26 0.18 -1.32 0.00 0.00 176.35 174.35 2qqk n LEU 47 N 3.41 1.52 -3.94 -0.68 4.77 0.98 -4.81 117.00 118.25 2qqk n LEU 47 Ca 0.09 0.26 -0.18 0.00 -0.03 0.00 0.00 56.01 56.15 2qqk n LEU 47 Cb 0.42 -0.61 -0.15 0.00 -2.33 0.00 0.00 43.42 40.75 2qqk n LEU 47 CO 0.58 0.15 -0.41 -0.63 -1.33 0.00 0.00 177.39 175.75 2qqk s ILE 48 N -2.47 0.53 0.26 -0.08 -1.09 -0.98 -1.25 121.20 116.12 2qqk s ILE 48 Ca -0.26 -0.21 0.07 0.00 -2.23 0.00 0.00 60.65 58.02 2qqk s ILE 48 Cb 0.08 -0.50 -0.05 0.00 -1.58 0.00 0.00 42.46 40.41 2qqk s ILE 48 CO 0.34 0.18 -0.08 -0.72 -1.23 0.00 0.00 174.94 173.43 2qqk s TYR 49 N 0.34 1.93 -1.55 3.97 1.13 -0.44 -0.62 117.35 122.10 2qqk s TYR 49 Ca -0.04 -0.65 -0.04 0.00 -1.41 0.00 0.00 57.07 54.93 2qqk s TYR 49 Cb -0.08 -1.04 0.04 0.00 -1.10 0.00 0.00 41.96 39.77 2qqk s TYR 49 CO -0.00 0.32 0.28 0.45 -2.51 0.00 0.00 175.55 174.09 2qqk n SER 50 N -0.55 -0.16 0.00 -0.18 2.88 -1.07 -1.42 113.62 113.12 2qqk n SER 50 Ca -0.06 -1.16 0.00 0.00 -1.33 0.00 0.00 58.87 56.32 2qqk n SER 50 Cb 0.63 -2.19 0.00 0.00 -0.75 0.00 0.00 64.21 61.89 2qqk n SER 50 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2qqk n ALA 51 N -4.45 0.00 -0.93 -1.46 0.00 0.12 -4.09 120.51 109.69 2qqk n ALA 51 Ca -0.24 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.20 2qqk n ALA 51 Cb 0.65 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.10 2qqk n ALA 51 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2qqk n SER 52 N 1.69 0.13 -4.69 0.00 3.41 -1.19 -2.44 113.62 110.52 2qqk n SER 52 Ca 0.00 -1.06 -0.36 0.00 -0.26 0.00 0.00 58.87 57.20 2qqk n SER 52 Cb 0.00 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 63.86 2qqk n SER 52 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 2qqk s PHE 53 N -0.06 3.35 0.26 7.33 0.40 -0.51 -4.62 117.98 124.14 2qqk s PHE 53 Ca 0.00 0.25 -0.30 0.00 -0.60 0.00 0.00 56.93 56.28 2qqk s PHE 53 Cb 0.00 -2.20 -0.09 0.00 0.51 0.00 0.00 43.02 41.24 2qqk s PHE 53 CO 0.00 0.17 1.05 -1.17 0.70 0.00 0.00 175.22 175.97 2qqk s LEU 54 N 0.69 4.58 0.43 -0.37 2.96 -1.26 -1.33 118.68 124.38 2qqk s LEU 54 Ca 0.07 2.16 -0.06 0.00 -0.22 0.00 0.00 54.13 56.08 2qqk s LEU 54 Cb -0.12 -3.62 -0.04 0.00 0.50 0.00 0.00 46.19 42.90 2qqk s LEU 54 CO 0.01 -0.05 0.73 -0.47 -1.32 0.00 0.00 176.35 175.25 2qqk s TYR 55 N -1.11 3.53 0.31 5.38 5.04 -0.38 -4.90 117.35 125.22 2qqk s TYR 55 Ca 0.44 0.79 -0.30 0.00 -2.44 0.00 0.00 57.07 55.56 2qqk s TYR 55 Cb -0.30 -2.26 -0.12 0.00 0.35 0.00 0.00 41.96 39.63 2qqk s TYR 55 CO 0.38 -0.15 1.58 0.43 -1.34 0.00 0.00 175.55 176.45 2qqk n SER 56 N -1.87 3.85 0.00 4.32 7.64 -1.26 -2.27 113.62 124.03 2qqk n SER 56 Ca 0.00 1.16 0.00 0.00 1.01 0.00 0.00 58.87 61.04 2qqk n SER 56 Cb 0.55 -1.60 0.00 0.00 -1.01 0.00 0.00 64.21 62.15 2qqk n SER 56 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2qqk n GLY 57 N 1.91 1.40 3.68 0.23 0.00 -1.26 -5.02 105.19 106.13 2qqk n GLY 57 Ca 0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.69 2qqk n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qqk s VAL 58 N -2.68 4.96 0.59 1.61 1.01 -0.96 -5.02 120.40 119.91 2qqk s VAL 58 Ca 0.00 1.47 -0.19 0.00 0.00 0.00 0.00 61.98 63.25 2qqk s VAL 58 Cb 0.00 -4.06 -0.03 0.00 0.00 0.00 0.00 36.38 32.28 2qqk s VAL 58 CO 0.00 0.10 1.24 -2.16 0.00 0.00 0.00 175.10 174.28 2qqk s PRO 59 N 1.77 2.95 0.01 2.72 0.04 -1.26 -4.87 135.00 136.36 2qqk s PRO 59 Ca 0.35 1.93 0.07 0.00 0.04 0.00 0.00 61.00 63.39 2qqk s PRO 59 Cb -0.17 -1.98 0.32 0.00 0.04 0.00 0.00 34.50 32.72 2qqk s PRO 59 CO 0.13 -1.25 1.24 -1.13 0.04 0.00 0.00 177.00 176.03 2qqk n SER 60 N -1.53 0.03 0.14 6.66 3.41 -1.26 -1.91 113.62 119.16 2qqk n SER 60 Ca 0.13 0.51 0.12 0.00 -0.26 0.00 0.00 58.87 59.37 2qqk n SER 60 Cb 0.49 -0.51 0.51 0.00 -0.26 0.00 0.00 64.21 64.43 2qqk n SER 60 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 2qqk n ARG 61 N -1.53 0.18 -3.52 4.33 1.85 -1.26 -4.69 116.66 112.01 2qqk n ARG 61 Ca 0.02 0.48 -0.35 0.00 -1.00 0.00 0.00 57.85 57.00 2qqk n ARG 61 Cb 0.08 -1.89 -0.05 0.00 -1.05 0.00 0.00 32.46 29.55 2qqk n ARG 61 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 2qqk s PHE 62 N -3.37 3.58 0.09 2.89 0.08 -0.80 -1.69 117.98 118.75 2qqk s PHE 62 Ca 0.03 0.85 -0.25 0.00 0.12 0.00 0.00 56.93 57.67 2qqk s PHE 62 Cb 0.08 -2.21 0.08 0.00 -0.57 0.00 0.00 43.02 40.41 2qqk s PHE 62 CO 0.34 0.48 0.71 -1.54 -0.10 0.00 0.00 175.22 175.11 2qqk s SER 63 N -1.81 -0.50 0.12 1.36 1.04 -0.51 -4.99 113.70 108.42 2qqk s SER 63 Ca 0.35 0.03 -0.03 0.00 0.48 0.00 0.00 55.95 56.78 2qqk s SER 63 Cb -0.14 0.52 -0.03 0.00 0.10 0.00 0.00 66.02 66.46 2qqk s SER 63 CO 0.19 -0.82 0.09 -0.83 0.98 0.00 0.00 173.24 172.85 2qqk s GLY 64 N -2.58 0.79 0.19 7.32 0.00 -1.26 0.09 107.32 111.88 2qqk s GLY 64 Ca 0.02 -1.30 -0.23 0.00 0.00 0.00 0.00 44.72 43.21 2qqk s GLY 64 CO -0.11 -1.24 0.70 -0.45 0.00 0.00 0.00 173.10 172.00 2qqk s SER 65 N -3.01 -0.40 0.00 1.64 0.15 -0.15 -4.35 113.70 107.58 2qqk s SER 65 Ca 0.20 -0.27 0.00 0.00 0.70 0.00 0.00 55.95 56.58 2qqk s SER 65 Cb 0.07 0.62 0.00 0.00 -1.71 0.00 0.00 66.02 65.00 2qqk s SER 65 CO -0.01 -1.08 0.00 0.61 1.20 0.00 0.00 173.24 173.96 2qqk n GLY 66 N -0.41 2.31 3.71 9.45 0.00 -1.26 -0.99 105.19 118.00 2qqk n GLY 66 Ca -0.10 -2.08 -0.05 0.00 0.00 0.00 0.00 46.02 43.79 2qqk n GLY 66 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2qqk s SER 67 N 0.00 -0.24 0.24 1.61 1.04 -1.11 -4.81 113.70 110.44 2qqk s SER 67 Ca 0.00 -0.34 0.00 0.00 0.48 0.00 0.00 55.95 56.09 2qqk s SER 67 Cb 0.00 0.51 0.00 0.00 0.10 0.00 0.00 66.02 66.63 2qqk s SER 67 CO 0.00 -0.92 0.00 0.61 0.98 0.00 0.00 173.24 173.91 2qqk n GLY 68 N -0.43 1.31 0.00 7.32 0.00 0.14 -2.97 105.19 110.56 2qqk n GLY 68 Ca -0.07 0.26 0.00 0.00 0.00 0.00 0.00 46.02 46.21 2qqk n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2qqk n THR 69 N 0.00 0.00 -4.24 2.61 -2.24 -1.26 -0.69 114.28 108.45 2qqk n THR 69 Ca 0.00 -0.22 -0.34 0.00 -2.27 0.00 0.00 64.05 61.22 2qqk n THR 69 Cb 0.00 1.09 -0.15 0.00 -2.10 0.00 0.00 70.33 69.17 2qqk n THR 69 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2qqk s ASP 70 N -0.37 3.91 0.01 3.42 1.11 -1.16 -1.76 116.67 121.83 2qqk s ASP 70 Ca 0.00 -0.44 0.04 0.00 0.18 0.00 0.00 52.55 52.33 2qqk s ASP 70 Cb 0.00 -1.63 -0.01 0.00 1.07 0.00 0.00 42.92 42.34 2qqk s ASP 70 CO 0.00 0.04 -0.12 -0.36 1.18 0.00 0.00 175.17 175.92 2qqk s PHE 71 N 1.08 1.03 0.02 4.23 0.40 0.44 -2.74 117.98 122.44 2qqk s PHE 71 Ca 0.00 -0.25 0.05 0.00 -0.60 0.00 0.00 56.93 56.13 2qqk s PHE 71 Cb -0.15 -0.65 -0.02 0.00 0.51 0.00 0.00 43.02 42.72 2qqk s PHE 71 CO -0.03 -0.01 -0.14 0.95 0.70 0.00 0.00 175.22 176.70 2qqk s THR 72 N -0.47 1.12 -0.17 0.64 -4.23 -0.16 -0.46 115.64 111.91 2qqk s THR 72 Ca 0.03 -0.81 -0.01 0.00 -1.18 0.00 0.00 61.69 59.71 2qqk s THR 72 Cb -0.05 -0.98 -0.01 0.00 1.34 0.00 0.00 72.50 72.80 2qqk s THR 72 CO 0.00 0.15 -0.11 -0.22 -0.54 0.00 0.00 174.62 173.91 2qqk s LEU 73 N -0.76 2.73 -0.08 4.79 2.96 -0.35 -0.97 118.68 126.99 2qqk s LEU 73 Ca 0.04 -0.38 0.03 0.00 -0.22 0.00 0.00 54.13 53.59 2qqk s LEU 73 Cb -0.07 -1.64 -0.02 0.00 0.50 0.00 0.00 46.19 44.96 2qqk s LEU 73 CO 0.00 0.09 -0.15 -0.89 -1.32 0.00 0.00 176.35 174.08 2qqk s THR 74 N 0.83 2.96 -0.23 3.68 2.01 0.11 -0.82 115.64 124.18 2qqk s THR 74 Ca -0.04 -0.74 -0.08 0.00 0.31 0.00 0.00 61.69 61.14 2qqk s THR 74 Cb -0.15 -2.18 -0.04 0.00 0.01 0.00 0.00 72.50 70.14 2qqk s THR 74 CO 0.01 0.57 0.10 -0.63 -0.69 0.00 0.00 174.62 173.97 2qqk s ILE 75 N -0.30 4.79 -0.64 1.82 1.01 -0.13 -1.43 121.20 126.32 2qqk s ILE 75 Ca 0.02 -0.02 0.25 0.00 0.00 0.00 0.00 60.65 60.90 2qqk s ILE 75 Cb -0.13 -3.22 0.23 0.00 0.01 0.00 0.00 42.46 39.35 2qqk s ILE 75 CO 0.03 0.37 1.62 0.77 0.00 0.00 0.00 174.94 177.72 2qqk h SER 76 N 7.62 0.00 -0.67 3.58 4.64 -1.59 0.24 113.55 127.38 2qqk h SER 76 Ca -0.37 -0.05 -0.03 0.00 -0.47 0.00 0.00 61.79 60.87 2qqk h SER 76 Cb 1.17 0.00 -0.17 0.00 -0.31 0.00 0.00 62.40 63.09 2qqk h SER 76 CO 0.63 0.02 -0.32 -0.55 -0.87 0.00 0.00 176.83 175.73 2qqk s SER 77 N -4.79 -1.00 0.20 4.97 0.15 -1.15 -4.08 113.70 107.99 2qqk s SER 77 Ca 0.09 -0.85 -0.33 0.00 0.70 0.00 0.00 55.95 55.56 2qqk s SER 77 Cb 0.11 1.30 -0.14 0.00 -1.71 0.00 0.00 66.02 65.58 2qqk s SER 77 CO 0.64 -0.07 1.44 -0.11 1.20 0.00 0.00 173.24 176.34 2qqk n LEU 78 N 3.45 2.86 -4.68 3.45 7.94 -0.11 -4.64 117.00 125.27 2qqk n LEU 78 Ca 0.12 1.12 -0.23 0.00 -1.11 0.00 0.00 56.01 55.91 2qqk n LEU 78 Cb 0.60 -1.39 -0.07 0.00 0.53 0.00 0.00 43.42 43.09 2qqk n LEU 78 CO -0.05 -0.53 -0.30 -1.10 -1.11 0.00 0.00 177.39 174.30 2qqk s GLN 79 N 0.11 2.42 0.40 1.96 -1.52 -1.26 -1.58 119.66 120.18 2qqk s GLN 79 Ca 0.73 -1.34 0.11 0.00 -1.95 0.00 0.00 55.36 52.92 2qqk s GLN 79 Cb -0.70 -2.24 0.92 0.00 -0.22 0.00 0.00 33.01 30.77 2qqk s GLN 79 CO 0.46 0.38 1.94 -1.35 -0.25 0.00 0.00 175.29 176.46 2qqk h PRO 80 N 1.85 0.54 -0.20 2.91 0.11 -1.89 0.27 132.00 135.59 2qqk h PRO 80 Ca -0.45 -0.03 0.06 0.00 0.11 0.00 0.00 66.00 65.68 2qqk h PRO 80 Cb 1.25 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 2qqk h PRO 80 CO 0.60 0.35 0.22 1.05 -0.21 0.00 0.00 178.00 180.02 2qqk h GLU 81 N 0.55 0.00 -0.00 1.05 9.09 -1.85 -2.90 114.58 120.52 2qqk h GLU 81 Ca 0.34 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.75 2qqk h GLU 81 Cb 0.56 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.66 2qqk h GLU 81 CO -0.11 0.00 -0.02 -0.25 0.05 0.00 0.00 179.01 178.68 2qqk n ASP 82 N -3.77 0.06 -4.67 3.06 8.00 0.09 -4.78 116.55 114.54 2qqk n ASP 82 Ca 0.02 -0.29 -0.46 0.00 0.71 0.00 0.00 54.79 54.76 2qqk n ASP 82 Cb 0.35 -0.23 -0.04 0.00 -0.02 0.00 0.00 41.12 41.18 2qqk n ASP 82 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 2qqk n PHE 83 N -1.21 2.28 0.00 1.24 7.35 -1.10 -4.87 117.46 121.15 2qqk n PHE 83 Ca 0.15 0.21 0.00 0.00 -0.76 0.00 0.00 57.45 57.06 2qqk n PHE 83 Cb 0.23 -2.57 0.00 0.00 0.35 0.00 0.00 39.48 37.50 2qqk n PHE 83 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2qqk n ALA 84 N 4.07 0.00 -2.80 3.13 0.00 -1.22 -4.76 120.51 118.93 2qqk n ALA 84 Ca 0.18 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.27 2qqk n ALA 84 Cb 0.29 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.65 2qqk n ALA 84 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2qqk s THR 85 N -2.00 4.93 -0.16 0.00 2.01 0.24 -1.70 115.64 118.96 2qqk s THR 85 Ca 0.00 0.01 -0.05 0.00 0.31 0.00 0.00 61.69 61.96 2qqk s THR 85 Cb 0.00 -3.21 -0.03 0.00 0.01 0.00 0.00 72.50 69.26 2qqk s THR 85 CO 0.00 0.48 0.01 -0.31 -0.69 0.00 0.00 174.62 174.11 2qqk s TYR 86 N 0.17 3.15 -0.05 4.92 1.51 -0.55 -0.68 117.35 125.82 2qqk s TYR 86 Ca 0.05 -0.07 0.06 0.00 -1.01 0.00 0.00 57.07 56.11 2qqk s TYR 86 Cb -0.12 -2.00 -0.02 0.00 -0.11 0.00 0.00 41.96 39.72 2qqk s TYR 86 CO 0.00 0.11 -0.24 0.71 -1.11 0.00 0.00 175.55 175.01 2qqk s TYR 87 N 0.24 2.43 0.17 2.71 2.02 -0.53 -0.84 117.35 123.55 2qqk s TYR 87 Ca 0.01 -0.58 -0.07 0.00 -0.37 0.00 0.00 57.07 56.05 2qqk s TYR 87 Cb -0.13 -1.57 -0.06 0.00 -0.40 0.00 0.00 41.96 39.79 2qqk s TYR 87 CO 0.02 -0.13 0.44 0.00 -1.57 0.00 0.00 175.55 174.31 2qqk s GLN 89 N -2.63 1.30 -0.02 0.00 0.74 0.72 0.56 119.66 120.34 2qqk s GLN 89 Ca 0.42 -0.86 -0.18 0.00 0.05 0.00 0.00 55.36 54.79 2qqk s GLN 89 Cb -0.12 -1.38 -0.05 0.00 1.10 0.00 0.00 33.01 32.56 2qqk s GLN 89 CO 0.23 0.35 0.50 1.14 -0.55 0.00 0.00 175.29 176.96 2qqk s GLN 90 N -1.07 4.18 -0.36 1.67 1.03 -0.70 -1.39 119.66 123.03 2qqk s GLN 90 Ca 0.06 0.56 0.06 0.00 0.04 0.00 0.00 55.36 56.08 2qqk s GLN 90 Cb -0.08 -3.31 0.45 0.00 0.03 0.00 0.00 33.01 30.10 2qqk s GLN 90 CO 0.01 0.47 1.28 0.00 -2.54 0.00 0.00 175.29 174.52 2qqk n ALA 91 N 2.48 5.19 -0.07 2.60 0.00 -0.54 -3.86 120.51 126.31 2qqk n ALA 91 Ca -0.10 -3.83 -0.15 0.00 0.00 0.00 0.00 53.44 49.37 2qqk n ALA 91 Cb 0.51 -0.53 -0.05 0.00 0.00 0.00 0.00 19.45 19.39 2qqk n ALA 91 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.50 179.37 2qqk n TRP 92 N -0.70 0.00 -1.47 0.00 -0.00 -1.26 -4.90 117.44 109.11 2qqk n TRP 92 Ca 0.46 0.00 -0.29 0.00 -0.00 0.00 0.00 57.50 57.66 2qqk n TRP 92 Cb 0.89 -0.51 0.17 0.00 -0.00 0.00 0.00 31.31 31.86 2qqk n TRP 92 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 2qqk s ALA 93 N -2.29 1.52 0.32 5.87 0.00 -1.26 -4.95 121.76 120.97 2qqk s ALA 93 Ca -0.20 -0.71 0.04 0.00 0.00 0.00 0.00 51.96 51.09 2qqk s ALA 93 Cb 0.07 -2.97 0.56 0.00 0.00 0.00 0.00 23.12 20.78 2qqk s ALA 93 CO 0.26 -2.64 1.83 1.88 0.00 0.00 0.00 175.76 177.09 2qqk h TYR 94 N -1.79 0.52 -3.61 0.00 0.05 -1.99 -3.39 116.97 106.76 2qqk h TYR 94 Ca -0.49 -0.07 -0.68 0.00 0.05 0.00 0.00 58.73 57.55 2qqk h TYR 94 Cb 1.31 -0.15 -0.25 0.00 1.01 0.00 0.00 36.73 38.65 2qqk h TYR 94 CO -0.44 0.57 -0.61 -0.51 -1.05 0.00 0.00 178.16 176.12 2qqk s LEU 95 N -8.93 3.92 0.53 3.88 1.43 -1.26 -5.10 118.68 113.16 2qqk s LEU 95 Ca -0.07 -0.68 -0.22 0.00 -1.03 0.00 0.00 54.13 52.13 2qqk s LEU 95 Cb 0.15 -1.91 -0.06 0.00 0.03 0.00 0.00 46.19 44.41 2qqk s LEU 95 CO 0.77 -0.20 1.26 -2.65 0.23 0.00 0.00 176.35 175.76 2qqk n PRO 96 N 4.89 1.55 -3.89 1.29 -0.02 -1.26 -4.84 135.00 132.73 2qqk n PRO 96 Ca -0.14 0.57 -0.11 0.00 -2.02 0.00 0.00 63.50 61.80 2qqk n PRO 96 Cb 0.48 -2.45 -0.13 0.00 -0.02 0.00 0.00 33.50 31.38 2qqk n PRO 96 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 2qqk s THR 97 N -1.31 0.03 0.07 3.45 -4.23 -1.25 -5.04 115.64 107.35 2qqk s THR 97 Ca 0.71 -0.24 0.02 0.00 -1.18 0.00 0.00 61.69 61.00 2qqk s THR 97 Cb -0.44 -0.11 -0.04 0.00 1.34 0.00 0.00 72.50 73.26 2qqk s THR 97 CO 0.50 -0.13 0.10 -0.36 -0.54 0.00 0.00 174.62 174.20 2qqk s PHE 98 N -0.38 3.26 1.07 3.99 0.40 -1.26 -1.72 117.98 123.34 2qqk s PHE 98 Ca -0.04 0.12 -0.12 0.00 -0.60 0.00 0.00 56.93 56.29 2qqk s PHE 98 Cb -0.03 -1.66 0.23 0.00 0.51 0.00 0.00 43.02 42.07 2qqk s PHE 98 CO -0.00 0.54 1.06 0.20 0.70 0.00 0.00 175.22 177.72 2qqk s GLY 99 N -2.34 1.56 0.00 4.36 0.00 0.19 -4.59 107.32 106.50 2qqk s GLY 99 Ca 0.30 -0.21 0.23 0.00 0.00 0.00 0.00 44.72 45.03 2qqk s GLY 99 CO 0.22 0.44 1.74 0.61 0.00 0.00 0.00 173.10 176.11 2qqk n GLN 100 N -4.51 0.13 0.00 2.90 0.00 -1.26 -4.74 117.38 109.90 2qqk n GLN 100 Ca 0.04 0.10 0.00 0.00 0.00 0.00 0.00 57.00 57.14 2qqk n GLN 100 Cb 0.56 -1.50 0.00 0.00 0.00 0.00 0.00 30.24 29.30 2qqk n GLN 100 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2qqk n GLY 101 N 0.77 1.65 2.92 2.61 0.00 -1.26 -5.04 105.19 106.85 2qqk n GLY 101 Ca 0.08 -1.66 -0.29 0.00 0.00 0.00 0.00 46.02 44.15 2qqk n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2qqk s THR 102 N -1.99 1.27 -0.21 2.61 2.01 -0.02 -4.69 115.64 114.62 2qqk s THR 102 Ca 0.00 -0.77 -0.28 0.00 0.31 0.00 0.00 61.69 60.95 2qqk s THR 102 Cb 0.00 -1.43 0.00 0.00 0.01 0.00 0.00 72.50 71.08 2qqk s THR 102 CO 0.00 0.12 0.98 -0.75 -0.69 0.00 0.00 174.62 174.28 2qqk s LYS 103 N 1.56 4.27 -0.45 4.92 2.20 -0.52 -1.48 119.74 130.24 2qqk s LYS 103 Ca -0.00 1.26 -0.10 0.00 -0.36 0.00 0.00 55.97 56.77 2qqk s LYS 103 Cb -0.16 -3.62 0.10 0.00 -1.51 0.00 0.00 37.83 32.64 2qqk s LYS 103 CO -0.08 -0.55 0.32 0.08 -0.36 0.00 0.00 175.35 174.77 2qqk s VAL 104 N 2.91 4.32 0.68 4.02 1.01 -0.69 -1.14 120.40 131.52 2qqk s VAL 104 Ca 0.42 -1.57 -0.06 0.00 0.00 0.00 0.00 61.98 60.77 2qqk s VAL 104 Cb -0.16 -3.75 0.05 0.00 0.00 0.00 0.00 36.38 32.53 2qqk s VAL 104 CO 0.08 -0.66 0.99 -1.61 0.00 0.00 0.00 175.10 173.91 2qqk s GLU 105 N 1.41 2.31 -0.05 2.72 2.02 -0.48 -3.39 118.70 123.24 2qqk s GLU 105 Ca 0.04 -0.23 0.06 0.00 0.02 0.00 0.00 54.97 54.86 2qqk s GLU 105 Cb -0.25 -2.19 -0.01 0.00 0.10 0.00 0.00 34.13 31.78 2qqk s GLU 105 CO 0.01 -1.15 -0.24 0.42 0.02 0.00 0.00 175.26 174.32 2qqk s ILE 106 N -3.20 1.93 0.01 -1.63 -1.09 -1.26 -2.88 121.20 113.08 2qqk s ILE 106 Ca 0.59 -1.01 -0.15 0.00 -2.23 0.00 0.00 60.65 57.86 2qqk s ILE 106 Cb -0.11 -1.63 -0.06 0.00 -1.58 0.00 0.00 42.46 39.09 2qqk s ILE 106 CO 0.45 0.54 0.41 -0.75 -1.23 0.00 0.00 174.94 174.36 2qqk s LYS 107 N -0.21 3.91 0.28 2.79 2.47 0.26 -4.81 119.74 124.44 2qqk s LYS 107 Ca -0.01 0.41 -0.08 0.00 -1.56 0.00 0.00 55.97 54.73 2qqk s LYS 107 Cb -0.13 -3.21 0.03 0.00 -1.46 0.00 0.00 37.83 33.07 2qqk s LYS 107 CO 0.03 0.69 0.52 2.89 0.16 0.00 0.00 175.35 179.63 2qqk n ARG 108 N 1.78 0.74 -1.94 4.03 -4.01 -1.26 -4.14 116.66 111.86 2qqk n ARG 108 Ca -0.14 -1.76 -0.30 0.00 -1.04 0.00 0.00 57.85 54.62 2qqk n ARG 108 Cb 0.52 2.02 0.04 0.00 -3.04 0.00 0.00 32.46 32.01 2qqk n ARG 108 CO 0.00 0.00 0.00 0.95 -3.04 0.00 0.00 177.63 175.54 2qqk s THR 109 N -2.45 3.62 0.27 8.89 -4.23 -1.26 -4.96 115.64 115.51 2qqk s THR 109 Ca 0.14 0.47 -0.30 0.00 -1.18 0.00 0.00 61.69 60.82 2qqk s THR 109 Cb -0.03 -3.51 -0.10 0.00 1.34 0.00 0.00 72.50 70.20 2qqk s THR 109 CO 0.11 -0.66 1.43 0.54 -0.54 0.00 0.00 174.62 175.49 2qqk s VAL 110 N -3.30 2.61 -0.02 2.29 0.11 -1.26 -4.81 120.40 116.02 2qqk s VAL 110 Ca 0.57 0.54 0.03 0.00 -2.93 0.00 0.00 61.98 60.19 2qqk s VAL 110 Cb -0.11 -3.34 -0.00 0.00 -1.53 0.00 0.00 36.38 31.40 2qqk s VAL 110 CO 0.51 0.10 -0.10 0.00 -3.33 0.00 0.00 175.10 172.28 2qqk s ALA 111 N -0.26 0.84 0.15 1.54 0.00 -0.40 -4.95 121.76 118.68 2qqk s ALA 111 Ca 0.57 -0.38 -0.15 0.00 0.00 0.00 0.00 51.96 51.99 2qqk s ALA 111 Cb -0.42 -0.26 -0.07 0.00 0.00 0.00 0.00 23.12 22.37 2qqk s ALA 111 CO 0.46 0.17 0.57 0.00 0.00 0.00 0.00 175.76 176.96 2qqk s ALA 112 N -0.04 3.56 0.25 0.00 0.00 -1.26 -1.23 121.76 123.04 2qqk s ALA 112 Ca 0.01 -0.08 -0.24 0.00 0.00 0.00 0.00 51.96 51.64 2qqk s ALA 112 Cb -0.06 -2.56 -0.09 0.00 0.00 0.00 0.00 23.12 20.41 2qqk s ALA 112 CO -0.00 0.44 0.84 -1.25 0.00 0.00 0.00 175.76 175.79 2qqk s PRO 113 N -1.87 4.49 -0.14 0.00 0.04 -1.26 -4.56 135.00 131.70 2qqk s PRO 113 Ca 0.37 1.16 -0.22 0.00 0.04 0.00 0.00 61.00 62.35 2qqk s PRO 113 Cb -0.16 -2.95 -0.03 0.00 0.04 0.00 0.00 34.50 31.41 2qqk s PRO 113 CO 0.19 0.39 0.68 -1.12 0.04 0.00 0.00 177.00 177.18 2qqk s SER 114 N -1.51 6.83 -0.08 6.66 0.01 -0.60 -4.85 113.70 120.17 2qqk s SER 114 Ca 0.44 1.01 -0.03 0.00 1.31 0.00 0.00 55.95 58.69 2qqk s SER 114 Cb -0.19 -2.38 -0.04 0.00 0.21 0.00 0.00 66.02 63.62 2qqk s SER 114 CO 0.24 -0.22 0.05 -0.69 0.41 0.00 0.00 173.24 173.03 2qqk s VAL 115 N 1.49 4.70 0.00 3.43 1.01 -1.26 0.71 120.40 130.49 2qqk s VAL 115 Ca 0.33 -0.17 0.00 0.00 0.00 0.00 0.00 61.98 62.14 2qqk s VAL 115 Cb -0.16 -3.03 -0.00 0.00 0.00 0.00 0.00 36.38 33.18 2qqk s VAL 115 CO 0.13 0.56 -0.01 -0.36 0.00 0.00 0.00 175.10 175.42 2qqk s PHE 116 N -0.99 0.07 0.02 5.22 0.08 0.39 -4.99 117.98 117.79 2qqk s PHE 116 Ca 0.16 -0.13 0.05 0.00 0.12 0.00 0.00 56.93 57.13 2qqk s PHE 116 Cb -0.12 -0.05 -0.03 0.00 -0.57 0.00 0.00 43.02 42.25 2qqk s PHE 116 CO 0.05 -0.05 -0.13 -1.50 -0.10 0.00 0.00 175.22 173.50 2qqk s ILE 117 N -0.36 3.18 -0.11 0.64 2.07 -1.26 0.51 121.20 125.88 2qqk s ILE 117 Ca -0.04 -0.99 0.00 0.00 -1.41 0.00 0.00 60.65 58.22 2qqk s ILE 117 Cb -0.02 -2.36 0.02 0.00 0.13 0.00 0.00 42.46 40.23 2qqk s ILE 117 CO -0.00 0.37 -0.10 -0.36 -1.91 0.00 0.00 174.94 172.94 2qqk s PHE 118 N -0.95 1.59 0.56 3.50 0.08 0.36 -5.00 117.98 118.12 2qqk s PHE 118 Ca 0.16 -0.76 -0.12 0.00 0.12 0.00 0.00 56.93 56.32 2qqk s PHE 118 Cb -0.11 -1.25 -0.05 0.00 -0.57 0.00 0.00 43.02 41.04 2qqk s PHE 118 CO 0.06 -0.48 0.97 -1.25 -0.10 0.00 0.00 175.22 174.43 2qqk s PRO 119 N 1.39 3.71 0.05 0.24 0.04 -1.26 -2.35 135.00 136.82 2qqk s PRO 119 Ca -0.00 0.73 -0.31 0.00 0.04 0.00 0.00 61.00 61.46 2qqk s PRO 119 Cb -0.13 -2.15 -0.06 0.00 0.04 0.00 0.00 34.50 32.20 2qqk s PRO 119 CO -0.05 -0.40 1.24 -1.25 0.04 0.00 0.00 177.00 176.57 2qqk s PRO 120 N -4.71 4.40 0.10 0.56 0.04 -1.25 -4.91 135.00 129.21 2qqk s PRO 120 Ca 0.55 1.82 -0.30 0.00 0.04 0.00 0.00 61.00 63.10 2qqk s PRO 120 Cb -0.11 -3.37 -0.06 0.00 0.04 0.00 0.00 34.50 31.00 2qqk s PRO 120 CO 0.45 -0.33 1.17 -1.54 0.04 0.00 0.00 177.00 176.79 2qqk s SER 121 N 1.17 7.12 0.11 6.66 1.04 -1.26 -4.86 113.70 123.68 2qqk s SER 121 Ca 0.60 2.04 -0.06 0.00 0.48 0.00 0.00 55.95 59.01 2qqk s SER 121 Cb -0.30 -2.59 0.14 0.00 0.10 0.00 0.00 66.02 63.37 2qqk s SER 121 CO 0.28 -0.41 0.68 0.47 0.98 0.00 0.00 173.24 175.25 2qqk n ASP 122 N 3.47 -0.24 -0.31 7.02 9.92 -1.26 0.20 116.55 135.35 2qqk n ASP 122 Ca 0.07 0.76 0.15 0.00 -0.53 0.00 0.00 54.79 55.25 2qqk n ASP 122 Cb 0.46 -0.19 0.30 0.00 -0.64 0.00 0.00 41.12 41.05 2qqk n ASP 122 CO 0.00 0.00 0.00 1.21 0.13 0.00 0.00 177.20 178.54 2qqk n GLU 123 N -4.67 -0.07 -0.03 -1.24 2.13 -1.26 0.02 120.64 115.52 2qqk n GLU 123 Ca 0.05 1.33 -0.15 0.00 0.66 0.00 0.00 57.16 59.06 2qqk n GLU 123 Cb 0.19 -2.15 -0.10 0.00 0.27 0.00 0.00 31.44 29.66 2qqk n GLU 123 CO 0.00 0.00 0.00 0.37 -0.41 0.00 0.00 177.13 177.09 2qqk h GLN 124 N 0.00 0.27 -1.12 5.31 4.15 -0.62 -3.27 115.11 119.83 2qqk h GLN 124 Ca 0.57 -0.21 0.34 0.00 0.77 0.00 0.00 58.65 60.12 2qqk h GLN 124 Cb 1.24 0.04 -0.12 0.00 0.21 0.00 0.00 27.48 28.85 2qqk h GLN 124 CO -0.82 0.85 0.70 -0.07 -1.93 0.00 0.00 178.83 177.55 2qqk h LEU 125 N -0.25 0.41 -0.92 -2.39 4.07 -0.36 0.64 115.31 116.51 2qqk h LEU 125 Ca -0.01 0.14 0.10 0.00 0.08 0.00 0.00 57.88 58.19 2qqk h LEU 125 Cb 0.89 0.09 -0.08 0.00 1.08 0.00 0.00 40.66 42.64 2qqk h LEU 125 CO 0.05 -0.07 0.56 0.11 -1.08 0.00 0.00 178.44 178.00 2qqk h LYS 126 N 0.27 0.89 0.00 1.13 1.57 -1.50 -2.76 116.57 116.17 2qqk h LYS 126 Ca 0.71 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 59.44 2qqk h LYS 126 Cb 1.90 -0.20 0.00 0.00 0.08 0.00 0.00 32.23 34.01 2qqk h LYS 126 CO -0.44 0.59 0.00 -1.13 -0.57 0.00 0.00 179.45 177.90 2qqk n SER 127 N -4.67 0.00 0.00 0.86 3.41 0.22 -4.92 113.62 108.52 2qqk n SER 127 Ca 0.16 0.25 0.00 0.00 -0.26 0.00 0.00 58.87 59.02 2qqk n SER 127 Cb 0.30 -0.39 0.00 0.00 -0.26 0.00 0.00 64.21 63.87 2qqk n SER 127 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2qqk n GLY 128 N 0.22 2.59 3.82 5.00 0.00 -1.04 -5.06 105.19 110.71 2qqk n GLY 128 Ca 0.06 -0.76 -0.30 0.00 0.00 0.00 0.00 46.02 45.02 2qqk n GLY 128 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2qqk s THR 129 N 0.00 3.18 -0.04 2.61 -4.23 -1.26 -0.68 115.64 115.23 2qqk s THR 129 Ca 0.00 0.38 -0.01 0.00 -1.18 0.00 0.00 61.69 60.88 2qqk s THR 129 Cb 0.00 -3.17 0.03 0.00 1.34 0.00 0.00 72.50 70.71 2qqk s THR 129 CO 0.00 -0.50 0.07 0.00 -0.54 0.00 0.00 174.62 173.65 2qqk s ALA 130 N -3.18 -0.01 -0.25 3.99 0.00 0.12 -4.30 121.76 118.11 2qqk s ALA 130 Ca 0.60 0.41 0.02 0.00 0.00 0.00 0.00 51.96 53.00 2qqk s ALA 130 Cb -0.14 -0.35 0.05 0.00 0.00 0.00 0.00 23.12 22.69 2qqk s ALA 130 CO 0.54 -0.16 -0.11 -1.12 0.00 0.00 0.00 175.76 174.91 2qqk s SER 131 N 1.21 4.33 -0.22 0.00 0.01 -1.26 -1.06 113.70 116.71 2qqk s SER 131 Ca -0.08 -1.27 -0.12 0.00 1.31 0.00 0.00 55.95 55.79 2qqk s SER 131 Cb -0.13 -1.56 -0.05 0.00 0.21 0.00 0.00 66.02 64.49 2qqk s SER 131 CO -0.04 -0.17 0.22 -0.69 0.41 0.00 0.00 173.24 172.97 2qqk s VAL 132 N 1.15 5.32 -0.07 3.43 1.01 -0.62 -3.93 120.40 126.70 2qqk s VAL 132 Ca -0.07 0.33 0.02 0.00 0.00 0.00 0.00 61.98 62.26 2qqk s VAL 132 Cb -0.19 -3.56 -0.02 0.00 0.00 0.00 0.00 36.38 32.61 2qqk s VAL 132 CO -0.05 0.33 -0.13 -0.69 0.00 0.00 0.00 175.10 174.56 2qqk s VAL 133 N 1.02 3.14 -0.17 2.92 1.01 -0.99 -1.36 120.40 125.97 2qqk s VAL 133 Ca 0.11 -0.68 -0.02 0.00 0.00 0.00 0.00 61.98 61.39 2qqk s VAL 133 Cb -0.14 -2.26 -0.01 0.00 0.00 0.00 0.00 36.38 33.97 2qqk s VAL 133 CO 0.05 0.58 -0.09 0.00 0.00 0.00 0.00 175.10 175.64 2qqk s LEU 135 N 0.82 3.06 -0.34 0.00 0.20 0.18 -1.00 118.68 121.60 2qqk s LEU 135 Ca -0.03 -0.28 -0.05 0.00 0.69 0.00 0.00 54.13 54.46 2qqk s LEU 135 Cb -0.15 -1.76 0.05 0.00 -0.43 0.00 0.00 46.19 43.90 2qqk s LEU 135 CO 0.01 0.06 0.09 -0.76 -0.29 0.00 0.00 176.35 175.46 2qqk s LEU 136 N 1.02 4.32 -0.21 -0.68 1.02 -0.39 -0.46 118.68 123.30 2qqk s LEU 136 Ca 0.01 -1.26 -0.10 0.00 0.02 0.00 0.00 54.13 52.80 2qqk s LEU 136 Cb -0.15 -1.83 -0.05 0.00 0.02 0.00 0.00 46.19 44.18 2qqk s LEU 136 CO 0.01 -0.34 0.15 0.21 0.02 0.00 0.00 176.35 176.40 2qqk s ASN 137 N 1.44 6.20 -0.93 2.29 2.47 0.22 -1.76 114.94 124.88 2qqk s ASN 137 Ca -0.02 0.22 -0.05 0.00 0.42 0.00 0.00 52.86 53.43 2qqk s ASN 137 Cb -0.20 -2.10 -0.06 0.00 -1.45 0.00 0.00 41.25 37.44 2qqk s ASN 137 CO 0.01 0.15 0.81 0.59 -3.72 0.00 0.00 177.10 174.94 2qqk n ASN 138 N 3.70 -6.09 -4.62 -4.21 4.13 -0.85 -1.56 115.26 105.76 2qqk n ASN 138 Ca -0.16 -0.63 -0.28 0.00 1.68 0.00 0.00 54.58 55.20 2qqk n ASN 138 Cb 0.52 -4.67 -0.11 0.00 -1.54 0.00 0.00 39.78 33.98 2qqk n ASN 138 CO 0.00 0.00 0.00 0.72 0.28 0.00 0.00 177.26 178.26 2qqk s PHE 139 N -3.34 2.43 -0.24 3.10 -0.71 0.08 -4.58 117.98 114.72 2qqk s PHE 139 Ca 0.40 -0.71 -0.26 0.00 -1.04 0.00 0.00 56.93 55.32 2qqk s PHE 139 Cb -0.05 -1.73 0.10 0.00 -1.21 0.00 0.00 43.02 40.12 2qqk s PHE 139 CO 0.65 0.40 0.86 -0.47 -1.34 0.00 0.00 175.22 175.32 2qqk s TYR 140 N -2.77 -0.61 0.15 3.49 6.14 -0.37 -0.54 117.35 122.85 2qqk s TYR 140 Ca 0.33 1.40 -0.03 0.00 0.64 0.00 0.00 57.07 59.42 2qqk s TYR 140 Cb 0.09 0.34 0.03 0.00 0.42 0.00 0.00 41.96 42.85 2qqk s TYR 140 CO 0.17 -0.35 0.20 -0.35 0.64 0.00 0.00 175.55 175.86 2qqk n PRO 141 N 2.08 -0.23 0.25 4.97 -0.04 -1.26 -1.27 135.00 139.50 2qqk n PRO 141 Ca -0.14 -0.31 0.15 0.00 -0.04 0.00 0.00 63.50 63.16 2qqk n PRO 141 Cb 0.56 -0.21 0.44 0.00 -0.04 0.00 0.00 33.50 34.25 2qqk n PRO 141 CO 0.00 0.00 0.00 -0.09 -0.04 0.00 0.00 175.50 175.37 2qqk h ARG 142 N 0.00 0.00 -6.63 0.54 9.65 -2.00 -3.45 114.38 112.50 2qqk h ARG 142 Ca -0.07 0.00 -0.53 0.00 -1.10 0.00 0.00 59.98 58.29 2qqk h ARG 142 Cb 0.18 0.00 0.03 0.00 -1.39 0.00 0.00 29.97 28.79 2qqk h ARG 142 CO 0.05 0.00 0.70 -1.21 2.80 0.00 0.00 179.97 182.31 2qqk s GLU 143 N -3.44 4.34 -0.29 0.20 8.01 -1.26 -4.98 118.70 121.28 2qqk s GLU 143 Ca 0.04 2.10 -0.16 0.00 0.01 0.00 0.00 54.97 56.95 2qqk s GLU 143 Cb 0.07 -3.21 0.18 0.00 -4.31 0.00 0.00 34.13 26.86 2qqk s GLU 143 CO 0.60 -0.36 1.14 0.00 0.01 0.00 0.00 175.26 176.65 2qqk s ALA 144 N 0.55 -2.48 -0.13 5.21 0.00 -1.26 -4.67 121.76 118.98 2qqk s ALA 144 Ca 0.61 2.07 -0.09 0.00 0.00 0.00 0.00 51.96 54.55 2qqk s ALA 144 Cb -0.37 -1.86 -0.04 0.00 0.00 0.00 0.00 23.12 20.85 2qqk s ALA 144 CO 0.35 -0.32 0.17 0.21 0.00 0.00 0.00 175.76 176.17 2qqk s LYS 145 N 1.12 3.68 -0.42 0.00 2.20 -0.86 -4.97 119.74 120.49 2qqk s LYS 145 Ca -0.08 -0.09 0.02 0.00 -0.36 0.00 0.00 55.97 55.46 2qqk s LYS 145 Cb -0.03 -3.25 0.14 0.00 -1.51 0.00 0.00 37.83 33.18 2qqk s LYS 145 CO -0.12 0.64 0.24 0.08 -0.36 0.00 0.00 175.35 175.84 2qqk s VAL 146 N -0.66 1.09 -0.13 4.02 1.01 -1.26 -1.53 120.40 122.94 2qqk s VAL 146 Ca 0.14 -2.40 -0.20 0.00 0.00 0.00 0.00 61.98 59.52 2qqk s VAL 146 Cb -0.12 -1.77 -0.03 0.00 0.00 0.00 0.00 36.38 34.46 2qqk s VAL 146 CO 0.04 -0.94 0.59 -1.10 0.00 0.00 0.00 175.10 173.68 2qqk s GLN 147 N 0.46 4.32 0.32 2.72 -0.21 -0.94 -4.93 119.66 121.40 2qqk s GLN 147 Ca 0.19 0.62 -0.14 0.00 0.02 0.00 0.00 55.36 56.04 2qqk s GLN 147 Cb -0.22 -3.49 -0.09 0.00 1.00 0.00 0.00 33.01 30.21 2qqk s GLN 147 CO -0.01 -0.00 0.71 -1.58 -2.12 0.00 0.00 175.29 172.29 2qqk s TRP 148 N 1.12 3.38 -0.14 0.91 0.52 -1.26 -1.24 118.94 122.23 2qqk s TRP 148 Ca 0.30 1.16 -0.04 0.00 0.02 0.00 0.00 56.10 57.54 2qqk s TRP 148 Cb -0.16 -2.49 0.06 0.00 -1.15 0.00 0.00 33.47 29.72 2qqk s TRP 148 CO 0.12 0.11 0.12 0.15 0.02 0.00 0.00 176.95 177.47 2qqk s LYS 149 N -3.01 0.05 -0.34 4.98 1.02 0.30 -2.35 119.74 120.39 2qqk s LYS 149 Ca 0.53 0.16 -0.13 0.00 0.02 0.00 0.00 55.97 56.56 2qqk s LYS 149 Cb -0.10 -1.22 -0.01 0.00 -0.52 0.00 0.00 37.83 35.98 2qqk s LYS 149 CO 0.19 -0.54 0.23 0.08 -0.92 0.00 0.00 175.35 174.38 2qqk s VAL 150 N 2.20 5.16 -1.33 3.17 1.01 -0.77 -0.76 120.40 129.08 2qqk s VAL 150 Ca 0.04 -0.31 -0.03 0.00 0.00 0.00 0.00 61.98 61.68 2qqk s VAL 150 Cb -0.15 -3.68 -0.00 0.00 0.00 0.00 0.00 36.38 32.56 2qqk s VAL 150 CO -0.08 -0.03 0.57 0.47 0.00 0.00 0.00 175.10 176.03 2qqk n ASP 151 N 5.09 -1.31 -1.45 3.32 8.00 0.10 -1.78 116.55 128.52 2qqk n ASP 151 Ca -0.13 -0.94 -0.18 0.00 0.71 0.00 0.00 54.79 54.25 2qqk n ASP 151 Cb 0.49 -3.48 -0.08 0.00 -0.02 0.00 0.00 41.12 38.04 2qqk n ASP 151 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 2qqk n ASN 152 N -2.97 -5.23 -4.32 -2.24 5.15 -1.26 -4.98 115.26 99.40 2qqk n ASN 152 Ca -0.28 0.43 -0.34 0.00 -0.60 0.00 0.00 54.58 53.80 2qqk n ASN 152 Cb 0.67 -4.35 -0.14 0.00 -0.53 0.00 0.00 39.78 35.43 2qqk n ASN 152 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2qqk s ALA 153 N -2.70 2.72 0.24 5.20 0.00 -0.73 -5.06 121.76 121.42 2qqk s ALA 153 Ca 0.00 -1.06 -0.31 0.00 0.00 0.00 0.00 51.96 50.59 2qqk s ALA 153 Cb 0.00 -1.48 -0.11 0.00 0.00 0.00 0.00 23.12 21.52 2qqk s ALA 153 CO 0.00 -0.15 1.65 -0.51 0.00 0.00 0.00 175.76 176.75 2qqk s LEU 154 N 1.01 4.36 0.38 0.00 1.02 -1.26 -1.85 118.68 122.35 2qqk s LEU 154 Ca -0.00 2.88 0.07 0.00 0.02 0.00 0.00 54.13 57.10 2qqk s LEU 154 Cb -0.15 -3.61 -0.01 0.00 0.02 0.00 0.00 46.19 42.44 2qqk s LEU 154 CO -0.01 -0.93 0.45 -1.10 0.02 0.00 0.00 176.35 174.78 2qqk s GLN 155 N 0.47 2.81 0.00 1.70 -1.52 -0.99 -4.94 119.66 117.19 2qqk s GLN 155 Ca 0.69 -1.27 0.00 0.00 -1.95 0.00 0.00 55.36 52.84 2qqk s GLN 155 Cb -0.48 -2.63 0.00 0.00 -0.22 0.00 0.00 33.01 29.68 2qqk s GLN 155 CO 0.39 -0.10 0.00 -1.13 -0.25 0.00 0.00 175.29 174.19 2qqk n SER 156 N -1.64 0.00 -1.30 5.90 3.41 -1.26 -4.83 113.62 113.90 2qqk n SER 156 Ca 0.03 0.00 -0.03 0.00 -0.26 0.00 0.00 58.87 58.61 2qqk n SER 156 Cb 0.60 0.00 0.12 0.00 -0.26 0.00 0.00 64.21 64.67 2qqk n SER 156 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2qqk n GLY 157 N 5.00 2.58 0.44 5.00 0.00 -1.26 -3.96 105.19 112.99 2qqk n GLY 157 Ca 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 46.02 45.60 2qqk n GLY 157 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2qqk n ASN 158 N 0.04 0.95 -4.71 1.61 6.94 -1.26 -4.79 115.26 114.04 2qqk n ASN 158 Ca 0.18 -2.03 -0.23 0.00 -0.02 0.00 0.00 54.58 52.49 2qqk n ASN 158 Cb 0.82 -0.39 -0.06 0.00 -2.36 0.00 0.00 39.78 37.79 2qqk n ASN 158 CO 0.00 0.00 0.00 -0.94 -1.03 0.00 0.00 177.26 175.29 2qqk s SER 159 N -0.26 4.90 -0.02 0.53 1.04 -1.25 -3.39 113.70 115.25 2qqk s SER 159 Ca 0.02 -0.49 0.01 0.00 0.48 0.00 0.00 55.95 55.97 2qqk s SER 159 Cb 0.02 -1.05 0.02 0.00 0.10 0.00 0.00 66.02 65.10 2qqk s SER 159 CO 0.01 -0.01 -0.02 -1.10 0.98 0.00 0.00 173.24 173.10 2qqk s GLN 160 N -3.69 0.37 -0.01 4.02 -0.21 0.10 -4.96 119.66 115.30 2qqk s GLN 160 Ca 0.32 -0.03 -0.00 0.00 0.02 0.00 0.00 55.36 55.67 2qqk s GLN 160 Cb -0.07 -0.46 -0.04 0.00 1.00 0.00 0.00 33.01 33.44 2qqk s GLN 160 CO 0.22 -0.05 0.06 -1.21 -2.12 0.00 0.00 175.29 172.19 2qqk s GLU 161 N 0.60 3.00 0.00 2.91 2.02 -1.26 -0.41 118.70 125.56 2qqk s GLU 161 Ca -0.06 -0.51 0.02 0.00 0.02 0.00 0.00 54.97 54.44 2qqk s GLU 161 Cb -0.09 -2.81 -0.01 0.00 0.10 0.00 0.00 34.13 31.31 2qqk s GLU 161 CO -0.01 0.65 -0.06 0.45 0.02 0.00 0.00 175.26 176.30 2qqk s SER 162 N -1.65 0.74 0.11 -0.19 0.15 0.35 -4.99 113.70 108.22 2qqk s SER 162 Ca 0.22 -0.18 0.09 0.00 0.70 0.00 0.00 55.95 56.77 2qqk s SER 162 Cb -0.12 -0.06 -0.04 0.00 -1.71 0.00 0.00 66.02 64.10 2qqk s SER 162 CO 0.12 0.03 -0.21 -0.69 1.20 0.00 0.00 173.24 173.69 2qqk s VAL 163 N -0.35 1.78 0.45 4.45 1.01 -1.26 -0.38 120.40 126.10 2qqk s VAL 163 Ca 0.00 -1.62 0.01 0.00 0.00 0.00 0.00 61.98 60.38 2qqk s VAL 163 Cb -0.04 -1.64 -0.00 0.00 0.00 0.00 0.00 36.38 34.71 2qqk s VAL 163 CO -0.00 -0.08 0.67 0.42 0.00 0.00 0.00 175.10 176.11 2qqk s THR 164 N -1.27 3.92 0.90 3.92 -4.23 0.15 -4.99 115.64 114.03 2qqk s THR 164 Ca 0.08 -0.53 -0.12 0.00 -1.18 0.00 0.00 61.69 59.94 2qqk s THR 164 Cb -0.09 -3.44 0.13 0.00 1.34 0.00 0.00 72.50 70.43 2qqk s THR 164 CO 0.05 -0.30 1.13 -1.61 -0.54 0.00 0.00 174.62 173.35 2qqk s GLU 165 N -4.55 1.26 0.25 3.99 0.41 -1.26 -4.59 118.70 114.21 2qqk s GLU 165 Ca 0.49 0.33 -0.31 0.00 -0.41 0.00 0.00 54.97 55.07 2qqk s GLU 165 Cb -0.10 -1.85 -0.12 0.00 -1.78 0.00 0.00 34.13 30.28 2qqk s GLU 165 CO 0.38 -2.12 1.60 1.04 -0.49 0.00 0.00 175.26 175.67 2qqk n GLN 166 N -3.72 2.59 -1.86 1.61 6.02 -1.26 -4.72 117.38 116.03 2qqk n GLN 166 Ca 0.07 0.93 -0.41 0.00 -0.01 0.00 0.00 57.00 57.57 2qqk n GLN 166 Cb 0.59 -2.71 -0.01 0.00 1.02 0.00 0.00 30.24 29.13 2qqk n GLN 166 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 2qqk s ASP 167 N 0.68 6.45 0.00 1.08 2.15 -0.05 -4.88 116.67 122.10 2qqk s ASP 167 Ca 0.69 2.90 0.21 0.00 0.43 0.00 0.00 52.55 56.77 2qqk s ASP 167 Cb -0.53 -2.64 1.01 0.00 -0.30 0.00 0.00 42.92 40.45 2qqk s ASP 167 CO 0.43 -0.83 1.66 -1.54 -0.17 0.00 0.00 175.17 174.72 2qqk n SER 168 N 1.64 0.00 -0.08 -0.34 3.41 -1.26 -1.03 113.62 115.96 2qqk n SER 168 Ca 0.05 0.10 -0.16 0.00 -0.26 0.00 0.00 58.87 58.60 2qqk n SER 168 Cb 0.39 -0.33 -0.05 0.00 -0.26 0.00 0.00 64.21 63.95 2qqk n SER 168 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2qqk n LYS 169 N -1.33 0.37 -0.03 4.33 5.02 -1.26 -2.55 118.16 122.71 2qqk n LYS 169 Ca 0.09 0.16 0.07 0.00 -2.02 0.00 0.00 58.31 56.60 2qqk n LYS 169 Cb 0.18 -1.14 0.07 0.00 -0.02 0.00 0.00 35.03 34.13 2qqk n LYS 169 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 2qqk n ASP 170 N -3.90 2.24 -1.05 4.39 5.68 -1.25 -4.86 116.55 117.81 2qqk n ASP 170 Ca -0.29 -1.61 -0.14 0.00 -0.50 0.00 0.00 54.79 52.25 2qqk n ASP 170 Cb 0.64 -0.04 -0.06 0.00 -1.14 0.00 0.00 41.12 40.53 2qqk n ASP 170 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 2qqk n SER 171 N 0.74 -5.22 -4.77 -1.12 7.64 -0.19 -4.94 113.62 105.75 2qqk n SER 171 Ca 0.09 0.34 -0.23 0.00 1.01 0.00 0.00 58.87 60.07 2qqk n SER 171 Cb 0.35 -3.93 0.09 0.00 -1.01 0.00 0.00 64.21 59.71 2qqk n SER 171 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2qqk s THR 172 N -2.32 2.29 0.22 0.44 -4.23 -1.26 -4.49 115.64 106.30 2qqk s THR 172 Ca 0.00 -0.58 0.09 0.00 -1.18 0.00 0.00 61.69 60.02 2qqk s THR 172 Cb 0.00 -2.72 -0.04 0.00 1.34 0.00 0.00 72.50 71.08 2qqk s THR 172 CO 0.00 0.00 -0.06 -0.31 -0.54 0.00 0.00 174.62 173.71 2qqk s TYR 173 N -3.05 2.65 0.12 3.99 1.51 0.30 -0.87 117.35 122.00 2qqk s TYR 173 Ca 0.63 -0.22 0.05 0.00 -1.01 0.00 0.00 57.07 56.52 2qqk s TYR 173 Cb -0.07 -1.24 -0.04 0.00 -0.11 0.00 0.00 41.96 40.50 2qqk s TYR 173 CO 0.43 0.57 -0.11 -1.12 -1.11 0.00 0.00 175.55 174.20 2qqk s SER 174 N -3.21 1.72 -0.03 2.29 0.01 -1.26 -0.74 113.70 112.47 2qqk s SER 174 Ca 0.28 -0.87 -0.02 0.00 1.31 0.00 0.00 55.95 56.65 2qqk s SER 174 Cb -0.08 -0.02 0.01 0.00 0.21 0.00 0.00 66.02 66.15 2qqk s SER 174 CO 0.17 -0.24 0.07 -0.22 0.41 0.00 0.00 173.24 173.43 2qqk s LEU 175 N -2.65 1.52 -0.01 2.44 0.20 -0.72 -0.67 118.68 118.79 2qqk s LEU 175 Ca 0.10 0.15 0.07 0.00 0.69 0.00 0.00 54.13 55.13 2qqk s LEU 175 Cb -0.02 0.22 -0.03 0.00 -0.43 0.00 0.00 46.19 45.93 2qqk s LEU 175 CO 0.01 -0.05 -0.21 -0.94 -0.29 0.00 0.00 176.35 174.86 2qqk s SER 176 N 0.32 3.47 -0.12 3.68 1.04 0.48 -1.26 113.70 121.32 2qqk s SER 176 Ca -0.02 -0.41 0.01 0.00 0.48 0.00 0.00 55.95 56.01 2qqk s SER 176 Cb -0.04 -0.52 0.02 0.00 0.10 0.00 0.00 66.02 65.58 2qqk s SER 176 CO -0.01 0.30 -0.14 -0.55 0.98 0.00 0.00 173.24 173.83 2qqk s SER 177 N -0.90 2.42 -0.11 7.02 0.15 -0.17 -0.50 113.70 121.60 2qqk s SER 177 Ca 0.12 -0.42 0.02 0.00 0.70 0.00 0.00 55.95 56.37 2qqk s SER 177 Cb -0.10 -1.06 -0.01 0.00 -1.71 0.00 0.00 66.02 63.13 2qqk s SER 177 CO 0.01 -0.02 -0.16 -0.89 1.20 0.00 0.00 173.24 173.38 2qqk s THR 178 N 1.17 2.79 -0.19 6.45 2.01 0.45 -0.21 115.64 128.11 2qqk s THR 178 Ca -0.03 -0.77 -0.03 0.00 0.31 0.00 0.00 61.69 61.17 2qqk s THR 178 Cb -0.14 -2.13 -0.01 0.00 0.01 0.00 0.00 72.50 70.23 2qqk s THR 178 CO -0.04 0.54 -0.07 -0.22 -0.69 0.00 0.00 174.62 174.14 2qqk s LEU 179 N 0.13 2.83 -0.14 4.42 2.96 -0.47 0.00 118.68 128.43 2qqk s LEU 179 Ca -0.08 -0.37 -0.03 0.00 -0.22 0.00 0.00 54.13 53.42 2qqk s LEU 179 Cb -0.15 -1.70 -0.03 0.00 0.50 0.00 0.00 46.19 44.81 2qqk s LEU 179 CO 0.05 0.04 -0.03 -0.89 -1.32 0.00 0.00 176.35 174.20 2qqk s THR 180 N 1.13 4.01 0.25 3.68 2.01 -1.22 -1.59 115.64 123.91 2qqk s THR 180 Ca 0.01 -0.33 0.01 0.00 0.31 0.00 0.00 61.69 61.69 2qqk s THR 180 Cb -0.15 -2.74 -0.05 0.00 0.01 0.00 0.00 72.50 69.58 2qqk s THR 180 CO -0.01 0.52 0.10 -0.76 -0.69 0.00 0.00 174.62 173.77 2qqk s LEU 181 N 0.02 1.60 0.78 4.42 1.02 -0.22 -4.96 118.68 121.34 2qqk s LEU 181 Ca 0.01 -1.38 -0.09 0.00 0.02 0.00 0.00 54.13 52.69 2qqk s LEU 181 Cb -0.13 0.06 0.09 0.00 0.02 0.00 0.00 46.19 46.23 2qqk s LEU 181 CO 0.02 -0.74 1.11 -0.94 0.02 0.00 0.00 176.35 175.83 2qqk s SER 182 N -3.29 4.43 0.09 2.29 1.04 -1.26 0.11 113.70 117.11 2qqk s SER 182 Ca 0.37 0.48 -0.25 0.00 0.48 0.00 0.00 55.95 57.04 2qqk s SER 182 Cb 0.08 -0.97 -0.09 0.00 0.10 0.00 0.00 66.02 65.14 2qqk s SER 182 CO 0.13 -1.88 1.41 0.50 0.98 0.00 0.00 173.24 174.37 2qqk h LYS 183 N -0.90 -0.32 -0.34 4.02 3.11 -1.22 -2.04 116.57 118.89 2qqk h LYS 183 Ca -0.44 0.02 0.05 0.00 -2.81 0.00 0.00 60.65 57.46 2qqk h LYS 183 Cb 1.31 0.07 -0.02 0.00 -1.00 0.00 0.00 32.23 32.59 2qqk h LYS 183 CO 0.57 -0.21 0.23 0.00 -2.81 0.00 0.00 179.45 177.23 2qqk h ALA 184 N -0.42 1.99 0.04 5.00 0.00 -1.94 -1.30 119.26 122.62 2qqk h ALA 184 Ca 0.05 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 2qqk h ALA 184 Cb 0.46 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 18.19 2qqk h ALA 184 CO -0.41 -0.05 -0.29 -0.44 0.00 0.00 0.00 179.25 178.06 2qqk h ASP 185 N 0.26 0.18 -0.36 0.00 3.32 -1.89 -3.09 116.42 114.83 2qqk h ASP 185 Ca 0.15 -0.94 -0.12 0.00 0.02 0.00 0.00 57.03 56.13 2qqk h ASP 185 Cb 0.25 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.74 2qqk h ASP 185 CO -0.03 1.11 -0.26 0.22 -1.72 0.00 0.00 179.24 178.56 2qqk h TYR 186 N -0.72 0.96 -0.72 4.55 5.03 -1.11 -3.13 116.97 121.83 2qqk h TYR 186 Ca -0.05 -0.26 -0.04 0.00 2.58 0.00 0.00 58.73 60.95 2qqk h TYR 186 Cb 1.19 -0.21 -0.03 0.00 1.55 0.00 0.00 36.73 39.22 2qqk h TYR 186 CO 0.24 1.04 0.28 0.93 -1.32 0.00 0.00 178.16 179.32 2qqk h GLU 187 N 0.61 1.08 0.00 1.82 4.39 -1.40 -3.15 114.58 117.93 2qqk h GLU 187 Ca 0.07 -0.19 0.00 0.00 0.34 0.00 0.00 59.36 59.58 2qqk h GLU 187 Cb 0.83 -0.18 0.00 0.00 -0.10 0.00 0.00 28.75 29.30 2qqk h GLU 187 CO 0.07 0.88 0.00 0.87 -1.16 0.00 0.00 179.01 179.67 2qqk h LYS 188 N 1.05 0.00 -5.67 2.33 1.79 -1.48 -3.46 116.57 111.13 2qqk h LYS 188 Ca 0.24 0.00 -0.59 0.00 -2.18 0.00 0.00 60.65 58.13 2qqk h LYS 188 Cb 0.22 0.00 -0.13 0.00 -1.58 0.00 0.00 32.23 30.73 2qqk h LYS 188 CO -0.02 0.00 -0.64 -1.01 -1.08 0.00 0.00 179.45 176.70 2qqk s HIS 189 N -3.32 2.32 0.00 -1.35 3.76 -1.19 -5.09 115.29 110.42 2qqk s HIS 189 Ca 0.06 -0.65 0.00 0.00 -0.15 0.00 0.00 55.06 54.31 2qqk s HIS 189 Cb 0.09 -1.48 0.00 0.00 1.11 0.00 0.00 32.58 32.30 2qqk s HIS 189 CO 0.51 0.41 0.00 1.17 -0.85 0.00 0.00 174.74 175.99 2qqk n LYS 190 N -0.81 0.00 -2.83 1.40 4.81 -1.26 -4.88 118.16 114.58 2qqk n LYS 190 Ca -0.05 0.00 -0.43 0.00 -0.87 0.00 0.00 58.31 56.96 2qqk n LYS 190 Cb 0.65 -0.63 -0.04 0.00 0.02 0.00 0.00 35.03 35.03 2qqk n LYS 190 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 2qqk s VAL 191 N -1.80 4.42 -0.24 3.15 1.01 -1.26 -4.18 120.40 121.50 2qqk s VAL 191 Ca 0.00 0.43 0.02 0.00 0.00 0.00 0.00 61.98 62.44 2qqk s VAL 191 Cb 0.00 -4.50 0.05 0.00 0.00 0.00 0.00 36.38 31.93 2qqk s VAL 191 CO 0.00 -1.02 -0.13 -0.31 0.00 0.00 0.00 175.10 173.64 2qqk s TYR 192 N 3.88 3.14 -0.02 5.22 1.51 -1.11 0.02 117.35 129.99 2qqk s TYR 192 Ca 0.32 -2.14 0.07 0.00 -1.01 0.00 0.00 57.07 54.32 2qqk s TYR 192 Cb -0.12 -1.93 -0.02 0.00 -0.11 0.00 0.00 41.96 39.79 2qqk s TYR 192 CO 0.22 -0.86 -0.22 0.00 -1.11 0.00 0.00 175.55 173.57 2qqk s ALA 193 N 1.15 1.87 -0.27 3.71 0.00 0.06 -2.09 121.76 126.18 2qqk s ALA 193 Ca -0.05 -0.96 -0.04 0.00 0.00 0.00 0.00 51.96 50.90 2qqk s ALA 193 Cb -0.18 -0.48 0.02 0.00 0.00 0.00 0.00 23.12 22.47 2qqk s ALA 193 CO -0.07 0.45 0.01 0.00 0.00 0.00 0.00 175.76 176.15 2qqk s GLU 195 N 1.42 2.95 -0.11 0.00 2.12 -0.38 -0.75 118.70 123.96 2qqk s GLU 195 Ca 0.01 -0.95 -0.11 0.00 0.36 0.00 0.00 54.97 54.29 2qqk s GLU 195 Cb -0.17 -3.38 -0.05 0.00 0.26 0.00 0.00 34.13 30.80 2qqk s GLU 195 CO -0.01 -0.50 0.24 0.08 -0.54 0.00 0.00 175.26 174.53 2qqk s VAL 196 N 1.47 5.33 -0.01 3.70 1.01 0.10 -2.22 120.40 129.77 2qqk s VAL 196 Ca 0.01 0.44 0.05 0.00 0.00 0.00 0.00 61.98 62.49 2qqk s VAL 196 Cb -0.18 -3.54 -0.01 0.00 0.00 0.00 0.00 36.38 32.65 2qqk s VAL 196 CO 0.02 0.54 -0.18 -0.89 0.00 0.00 0.00 175.10 174.60 2qqk s THR 197 N -0.58 1.40 -0.23 3.92 2.01 -0.58 -2.22 115.64 119.35 2qqk s THR 197 Ca 0.17 -0.77 -0.27 0.00 0.31 0.00 0.00 61.69 61.12 2qqk s THR 197 Cb -0.13 -1.17 0.13 0.00 0.01 0.00 0.00 72.50 71.34 2qqk s THR 197 CO 0.06 0.38 1.03 -2.28 -0.69 0.00 0.00 174.62 173.12 2qqk s HIS 198 N -0.43 -0.42 0.20 4.92 5.04 -1.26 -2.03 115.29 121.31 2qqk s HIS 198 Ca 0.07 0.91 -0.14 0.00 -1.54 0.00 0.00 55.06 54.35 2qqk s HIS 198 Cb -0.07 0.40 0.21 0.00 0.04 0.00 0.00 32.58 33.16 2qqk s HIS 198 CO -0.01 -0.27 1.63 0.37 -2.34 0.00 0.00 174.74 174.13 2qqk h GLN 199 N 3.51 -0.01 0.00 2.88 4.15 -1.93 -0.70 115.11 123.01 2qqk h GLN 199 Ca -0.24 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.18 2qqk h GLN 199 Cb 1.17 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.86 2qqk h GLN 199 CO 0.19 -0.01 0.00 0.41 -1.93 0.00 0.00 178.83 177.49 2qqk n GLY 200 N -1.41 -0.71 3.68 2.39 0.00 -1.26 -4.59 105.19 103.29 2qqk n GLY 200 Ca 0.06 -0.03 -0.36 0.00 0.00 0.00 0.00 46.02 45.70 2qqk n GLY 200 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qqk s LEU 201 N -2.93 4.14 0.27 0.99 1.02 -0.27 -4.66 118.68 117.24 2qqk s LEU 201 Ca 0.04 0.17 0.01 0.00 0.02 0.00 0.00 54.13 54.37 2qqk s LEU 201 Cb 0.05 -2.13 0.38 0.00 0.02 0.00 0.00 46.19 44.50 2qqk s LEU 201 CO 0.12 0.08 1.73 0.77 0.02 0.00 0.00 176.35 179.08 2qqk h SER 202 N 7.30 0.59 -4.88 2.29 4.64 -1.83 -3.44 113.55 118.22 2qqk h SER 202 Ca -0.39 -0.18 -0.21 0.00 -0.47 0.00 0.00 61.79 60.54 2qqk h SER 202 Cb 1.16 -0.16 -0.20 0.00 -0.31 0.00 0.00 62.40 62.90 2qqk h SER 202 CO 0.69 0.77 -0.71 -0.94 -0.87 0.00 0.00 176.83 175.77 2qqk s SER 203 N -6.76 0.62 0.08 4.97 1.04 -1.26 -5.13 113.70 107.27 2qqk s SER 203 Ca -0.08 -0.65 -0.37 0.00 0.48 0.00 0.00 55.95 55.34 2qqk s SER 203 Cb 0.14 0.09 -0.17 0.00 0.10 0.00 0.00 66.02 66.18 2qqk s SER 203 CO 0.80 -0.32 1.33 -2.65 0.98 0.00 0.00 173.24 173.38 2qqk n PRO 204 N 1.15 1.10 -3.84 4.02 -0.02 -1.26 -4.97 135.00 131.18 2qqk n PRO 204 Ca -0.21 0.40 -0.37 0.00 -2.02 0.00 0.00 63.50 61.30 2qqk n PRO 204 Cb 0.56 -2.03 -0.06 0.00 -0.02 0.00 0.00 33.50 31.95 2qqk n PRO 204 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2qqk s VAL 205 N 0.50 5.48 -0.10 -1.45 1.01 -0.94 -4.96 120.40 119.93 2qqk s VAL 205 Ca 0.85 0.23 0.04 0.00 0.00 0.00 0.00 61.98 63.09 2qqk s VAL 205 Cb -0.97 -3.42 0.00 0.00 0.00 0.00 0.00 36.38 31.99 2qqk s VAL 205 CO 0.47 0.59 -0.23 -0.89 0.00 0.00 0.00 175.10 175.05 2qqk s THR 206 N -0.80 1.98 -0.09 3.92 2.01 -1.26 -0.72 115.64 120.68 2qqk s THR 206 Ca 0.14 -0.97 0.04 0.00 0.31 0.00 0.00 61.69 61.22 2qqk s THR 206 Cb -0.12 -1.72 -0.00 0.00 0.01 0.00 0.00 72.50 70.67 2qqk s THR 206 CO 0.03 0.54 -0.24 -0.54 -0.69 0.00 0.00 174.62 173.73 2qqk s LYS 207 N 0.41 2.93 0.24 4.92 3.01 0.07 -4.99 119.74 126.32 2qqk s LYS 207 Ca -0.18 -0.88 -0.08 0.00 -1.01 0.00 0.00 55.97 53.82 2qqk s LYS 207 Cb -0.18 -2.28 -0.02 0.00 -1.01 0.00 0.00 37.83 34.35 2qqk s LYS 207 CO 0.08 0.24 0.37 -1.54 0.51 0.00 0.00 175.35 175.00 2qqk s SER 208 N 0.20 0.07 0.29 2.83 1.04 -1.26 -0.41 113.70 116.45 2qqk s SER 208 Ca -0.14 -1.12 -0.17 0.00 0.48 0.00 0.00 55.95 55.00 2qqk s SER 208 Cb -0.17 0.53 0.02 0.00 0.10 0.00 0.00 66.02 66.50 2qqk s SER 208 CO 0.07 -1.06 0.64 0.72 0.98 0.00 0.00 173.24 174.59 2qqk s PHE 209 N -3.99 0.10 0.14 5.02 -0.12 -0.89 -5.02 117.98 113.22 2qqk s PHE 209 Ca 0.28 -0.54 0.04 0.00 -0.05 0.00 0.00 56.93 56.66 2qqk s PHE 209 Cb 0.02 0.51 -0.04 0.00 -0.63 0.00 0.00 43.02 42.88 2qqk s PHE 209 CO 0.11 -1.20 -0.10 -0.80 -0.05 0.00 0.00 175.22 173.18 2qqk s ASN 210 N -2.99 1.76 0.00 1.98 0.02 -1.26 -2.76 114.94 111.69 2qqk s ASN 210 Ca 0.16 -1.01 0.32 0.00 -1.02 0.00 0.00 52.86 51.32 2qqk s ASN 210 Cb -0.04 -0.01 1.91 0.00 0.02 0.00 0.00 41.25 43.14 2qqk s ASN 210 CO 0.09 -0.33 2.23 0.54 0.02 0.00 0.00 177.10 179.65