#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c91 s ARG 5 N 0.00 2.70 0.66 1.96 0.52 -1.26 -3.36 118.95 120.18 2c91 s ARG 5 Ca 0.00 1.59 -0.17 0.00 -0.52 0.00 0.00 55.73 56.63 2c91 s ARG 5 Cb 0.00 -1.92 -0.04 0.00 0.52 0.00 0.00 34.95 33.51 2c91 s ARG 5 CO 0.00 -1.36 0.77 -2.30 0.02 0.00 0.00 175.30 172.43 2c91 n PRO 6 N -2.24 0.56 -1.43 3.54 -0.02 -1.26 -4.34 135.00 129.80 2c91 n PRO 6 Ca 0.12 0.23 -0.29 0.00 -2.02 0.00 0.00 63.50 61.55 2c91 n PRO 6 Cb 0.51 -2.01 0.15 0.00 -0.02 0.00 0.00 33.50 32.13 2c91 n PRO 6 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2c91 s ALA 7 N -1.74 1.52 -0.10 3.55 0.00 -0.65 -4.81 121.76 119.53 2c91 s ALA 7 Ca 0.72 -0.49 0.03 0.00 0.00 0.00 0.00 51.96 52.21 2c91 s ALA 7 Cb -0.38 -3.05 0.01 0.00 0.00 0.00 0.00 23.12 19.69 2c91 s ALA 7 CO 0.52 -2.46 -0.21 0.99 0.00 0.00 0.00 175.76 174.60 2c91 s THR 8 N -3.19 1.84 0.04 0.00 2.01 -1.26 -0.59 115.64 114.48 2c91 s THR 8 Ca 0.64 -0.88 0.08 0.00 0.31 0.00 0.00 61.69 61.85 2c91 s THR 8 Cb -0.16 -1.62 -0.03 0.00 0.01 0.00 0.00 72.50 70.70 2c91 s THR 8 CO 0.54 0.51 -0.22 -0.69 -0.69 0.00 0.00 174.62 174.07 2c91 s VAL 9 N 0.57 2.48 -0.25 3.82 1.01 -0.30 -4.43 120.40 123.31 2c91 s VAL 9 Ca -0.14 -1.27 -0.17 0.00 0.00 0.00 0.00 61.98 60.40 2c91 s VAL 9 Cb -0.17 -2.00 -0.03 0.00 0.00 0.00 0.00 36.38 34.18 2c91 s VAL 9 CO 0.05 0.36 0.45 -0.22 0.00 0.00 0.00 175.10 175.74 2c91 s LEU 10 N -1.32 4.07 0.20 3.92 2.96 -0.44 -0.84 118.68 127.23 2c91 s LEU 10 Ca 0.13 0.47 -0.25 0.00 -0.22 0.00 0.00 54.13 54.26 2c91 s LEU 10 Cb -0.10 -2.57 -0.08 0.00 0.50 0.00 0.00 46.19 43.93 2c91 s LEU 10 CO 0.03 -0.21 0.80 -0.83 -1.32 0.00 0.00 176.35 174.82 2c91 s GLY 11 N 1.45 2.88 -0.06 7.98 0.00 -0.04 -0.18 107.32 119.36 2c91 s GLY 11 Ca 0.19 0.37 0.09 0.00 0.00 0.00 0.00 44.72 45.37 2c91 s GLY 11 CO 0.09 0.86 1.02 -1.30 0.00 0.00 0.00 173.10 173.77 2c91 n THR 12 N 1.36 1.13 0.17 0.90 -2.24 -0.81 -4.70 114.28 110.09 2c91 n THR 12 Ca -0.04 -1.30 0.13 0.00 -2.27 0.00 0.00 64.05 60.57 2c91 n THR 12 Cb 0.49 0.21 0.69 0.00 -2.10 0.00 0.00 70.33 69.62 2c91 n THR 12 CO 0.00 0.00 0.00 -0.03 -0.57 0.00 0.00 175.07 174.47 2c91 h MET 13 N 0.00 0.00 -0.02 -0.78 1.85 -1.91 -2.55 114.93 111.52 2c91 h MET 13 Ca 0.00 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 59.09 2c91 h MET 13 Cb 0.94 0.00 0.00 0.00 0.43 0.00 0.00 31.60 32.97 2c91 h MET 13 CO 0.00 0.00 -0.14 0.39 -0.40 0.00 0.00 176.91 176.76 2c91 n GLU 14 N -4.39 1.70 -2.19 0.39 -0.58 -1.26 -4.67 120.64 109.64 2c91 n GLU 14 Ca 0.02 -1.27 -0.42 0.00 -0.42 0.00 0.00 57.16 55.07 2c91 n GLU 14 Cb 0.29 -1.47 -0.03 0.00 -0.57 0.00 0.00 31.44 29.66 2c91 n GLU 14 CO 0.00 0.00 0.00 -1.64 -0.48 0.00 0.00 177.13 175.01 2c91 s MET 15 N -2.18 3.26 0.00 3.49 -1.94 -0.96 -1.42 119.30 119.56 2c91 s MET 15 Ca 0.28 0.93 0.00 0.00 -1.71 0.00 0.00 55.69 55.19 2c91 s MET 15 Cb 0.20 -4.17 0.00 0.00 2.01 0.00 0.00 34.83 32.87 2c91 s MET 15 CO 0.40 -1.96 0.00 0.41 -0.01 0.00 0.00 175.02 173.86 2c91 n GLY 16 N 5.34 0.67 0.00 -0.03 0.00 0.29 -2.31 105.19 109.15 2c91 n GLY 16 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 2c91 n GLY 16 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2c91 n ARG 17 N -1.11 0.00 0.13 1.61 0.63 -0.79 -4.86 116.66 112.27 2c91 n ARG 17 Ca 0.00 0.00 -0.01 0.00 -0.92 0.00 0.00 57.85 56.92 2c91 n ARG 17 Cb 0.00 0.00 0.11 0.00 0.45 0.00 0.00 32.46 33.02 2c91 n ARG 17 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2c91 h ARG 18 N 0.00 0.00 -5.05 -0.14 2.47 -1.83 -3.43 114.38 106.40 2c91 h ARG 18 Ca 0.00 0.00 -0.64 0.00 -1.26 0.00 0.00 59.98 58.08 2c91 h ARG 18 Cb 0.00 0.00 -0.21 0.00 -1.65 0.00 0.00 29.97 28.11 2c91 h ARG 18 CO 0.00 0.65 -0.62 -1.64 0.56 0.00 0.00 179.97 178.92 2c91 s MET 19 N -3.25 3.71 0.71 0.04 -1.94 -0.50 -4.97 119.30 113.09 2c91 s MET 19 Ca 0.01 -0.46 -0.09 0.00 -1.71 0.00 0.00 55.69 53.43 2c91 s MET 19 Cb 0.11 -3.26 0.16 0.00 2.01 0.00 0.00 34.83 33.85 2c91 s MET 19 CO 0.76 -0.06 0.97 -0.40 -0.01 0.00 0.00 175.02 176.27 2c91 n ASP 20 N 4.53 0.37 0.09 3.03 5.68 -1.26 -0.55 116.55 128.45 2c91 n ASP 20 Ca -0.16 -1.53 0.01 0.00 -0.50 0.00 0.00 54.79 52.61 2c91 n ASP 20 Cb 0.52 -0.71 0.35 0.00 -1.14 0.00 0.00 41.12 40.14 2c91 n ASP 20 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2c91 h ALA 21 N -1.46 1.43 -0.11 2.12 0.00 -1.98 -0.83 119.26 118.42 2c91 h ALA 21 Ca -0.31 -0.23 -0.11 0.00 0.00 0.00 0.00 54.91 54.26 2c91 h ALA 21 Cb 0.94 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.63 2c91 h ALA 21 CO 0.25 0.40 -0.34 1.03 0.00 0.00 0.00 179.25 180.59 2c91 h SER 22 N 0.27 0.49 -0.65 0.00 0.87 -1.99 -0.68 113.55 111.86 2c91 h SER 22 Ca 0.05 -0.61 -0.03 0.00 -1.23 0.00 0.00 61.79 59.98 2c91 h SER 22 Cb 0.43 -0.14 -0.03 0.00 -0.44 0.00 0.00 62.40 62.21 2c91 h SER 22 CO 0.03 1.01 0.30 0.00 -0.53 0.00 0.00 176.83 177.64 2c91 h ALA 23 N 0.49 1.26 -0.38 6.23 0.00 -1.83 -1.84 119.26 123.19 2c91 h ALA 23 Ca -0.01 -0.15 -0.08 0.00 0.00 0.00 0.00 54.91 54.67 2c91 h ALA 23 Cb 0.97 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 2c91 h ALA 23 CO 0.07 0.56 -0.07 0.77 0.00 0.00 0.00 179.25 180.58 2c91 h SER 24 N 0.96 0.71 -0.65 0.00 0.02 -1.10 -0.94 113.55 112.55 2c91 h SER 24 Ca 0.23 -0.35 -0.04 0.00 -0.84 0.00 0.00 61.79 60.79 2c91 h SER 24 Cb 0.14 -0.19 -0.03 0.00 0.14 0.00 0.00 62.40 62.45 2c91 h SER 24 CO -0.03 0.90 0.26 0.00 -1.14 0.00 0.00 176.83 176.82 2c91 h ALA 25 N 0.84 0.85 -0.85 3.77 0.00 -0.89 -1.36 119.26 121.61 2c91 h ALA 25 Ca 0.10 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2c91 h ALA 25 Cb 0.57 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 18.06 2c91 h ALA 25 CO 0.03 0.47 0.55 0.00 0.00 0.00 0.00 179.25 180.29 2c91 h ALA 26 N 1.11 1.09 -0.32 0.00 0.00 -1.18 -1.92 119.26 118.03 2c91 h ALA 26 Ca 0.22 -0.07 -0.13 0.00 0.00 0.00 0.00 54.91 54.93 2c91 h ALA 26 Cb 0.20 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 2c91 h ALA 26 CO -0.02 0.51 -0.29 0.77 0.00 0.00 0.00 179.25 180.22 2c91 h SER 27 N 1.16 0.82 -0.48 0.00 0.02 -0.89 -0.70 113.55 113.48 2c91 h SER 27 Ca 0.31 -0.46 -0.00 0.00 -0.84 0.00 0.00 61.79 60.80 2c91 h SER 27 Cb -0.10 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.19 2c91 h SER 27 CO -0.06 1.11 0.29 0.58 -1.14 0.00 0.00 176.83 177.60 2c91 h VAL 28 N 0.54 1.15 -0.24 2.27 2.07 -1.15 -0.60 116.25 120.29 2c91 h VAL 28 Ca 0.06 -0.33 0.04 0.00 0.82 0.00 0.00 66.70 67.29 2c91 h VAL 28 Cb 0.86 0.50 -0.04 0.00 -1.52 0.00 0.00 31.29 31.10 2c91 h VAL 28 CO 0.07 0.15 -0.03 0.03 0.02 0.00 0.00 177.57 177.81 2c91 h ARG 29 N 0.64 0.04 -0.81 1.57 3.08 -1.17 0.74 114.38 118.47 2c91 h ARG 29 Ca 0.17 -0.00 0.05 0.00 0.07 0.00 0.00 59.98 60.27 2c91 h ARG 29 Cb -0.01 -0.01 -0.05 0.00 0.08 0.00 0.00 29.97 29.98 2c91 h ARG 29 CO -0.03 0.02 0.50 0.00 -1.07 0.00 0.00 179.97 179.39 2c91 h ALA 30 N 1.22 1.08 -0.29 0.04 0.00 -0.89 0.54 119.26 120.97 2c91 h ALA 30 Ca 0.11 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 2c91 h ALA 30 Cb 0.16 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 2c91 h ALA 30 CO -0.22 0.27 -0.01 0.35 0.00 0.00 0.00 179.25 179.65 2c91 h PHE 31 N 0.95 0.57 -0.40 0.00 3.57 -0.47 -3.04 116.94 118.12 2c91 h PHE 31 Ca 0.34 -0.10 -0.11 0.00 3.53 0.00 0.00 57.97 61.63 2c91 h PHE 31 Cb 0.09 -0.15 -0.02 0.00 2.79 0.00 0.00 35.95 38.67 2c91 h PHE 31 CO -0.04 0.67 -0.18 -0.07 -2.23 0.00 0.00 178.31 176.46 2c91 h LEU 32 N 0.30 0.77 -2.16 0.59 3.38 -0.62 -2.80 115.31 114.78 2c91 h LEU 32 Ca 0.08 -0.26 0.06 0.00 0.09 0.00 0.00 57.88 57.85 2c91 h LEU 32 Cb 0.45 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 2c91 h LEU 32 CO 0.02 0.95 0.18 -0.33 0.09 0.00 0.00 178.44 179.34 2c91 h GLU 33 N 0.68 0.00 -0.03 1.13 5.08 -0.82 0.12 114.58 120.74 2c91 h GLU 33 Ca 0.10 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 2c91 h GLU 33 Cb 0.68 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.93 2c91 h GLU 33 CO 0.05 0.00 0.00 0.54 -1.00 0.00 0.00 179.01 178.60 2c91 n ARG 34 N -4.07 1.20 -0.52 2.33 5.12 -1.06 -4.90 116.66 114.76 2c91 n ARG 34 Ca 0.02 -0.30 0.00 0.00 -1.93 0.00 0.00 57.85 55.64 2c91 n ARG 34 Cb 0.31 -1.37 0.00 0.00 -1.16 0.00 0.00 32.46 30.23 2c91 n ARG 34 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2c91 n GLY 35 N 0.94 0.74 3.92 -0.13 0.00 0.42 -5.06 105.19 106.01 2c91 n GLY 35 Ca 0.17 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.92 2c91 n GLY 35 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2c91 s HIS 36 N -2.26 3.22 0.00 1.61 3.76 -1.22 -5.05 115.29 115.35 2c91 s HIS 36 Ca 0.00 0.66 0.00 0.00 -0.15 0.00 0.00 55.06 55.57 2c91 s HIS 36 Cb 0.00 -2.82 0.00 0.00 1.11 0.00 0.00 32.58 30.87 2c91 s HIS 36 CO 0.00 -0.92 0.00 -1.13 -0.85 0.00 0.00 174.74 171.84 2c91 n SER 37 N -2.66 0.00 -4.68 1.40 3.41 -1.26 -4.41 113.62 105.42 2c91 n SER 37 Ca 0.05 0.00 -0.35 0.00 -0.26 0.00 0.00 58.87 58.31 2c91 n SER 37 Cb 0.58 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 64.43 2c91 n SER 37 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 2c91 s GLU 38 N 0.00 3.27 0.01 4.33 2.02 -1.26 -1.15 118.70 125.92 2c91 s GLU 38 Ca 0.00 -0.38 0.06 0.00 0.02 0.00 0.00 54.97 54.68 2c91 s GLU 38 Cb 0.00 -2.92 -0.03 0.00 0.10 0.00 0.00 34.13 31.28 2c91 s GLU 38 CO 0.00 0.59 -0.19 -0.51 0.02 0.00 0.00 175.26 175.17 2c91 s LEU 39 N -0.56 2.52 -0.17 1.80 1.43 -0.14 -1.32 118.68 122.23 2c91 s LEU 39 Ca 0.10 -0.38 0.01 0.00 -1.03 0.00 0.00 54.13 52.82 2c91 s LEU 39 Cb -0.12 -1.48 0.02 0.00 0.03 0.00 0.00 46.19 44.64 2c91 s LEU 39 CO 0.02 0.29 -0.19 -0.62 0.23 0.00 0.00 176.35 176.08 2c91 s ASP 40 N -1.10 3.05 0.10 2.29 2.15 0.75 -1.60 116.67 122.31 2c91 s ASP 40 Ca 0.13 -0.62 0.01 0.00 0.43 0.00 0.00 52.55 52.50 2c91 s ASP 40 Cb -0.10 -1.43 -0.00 0.00 -0.30 0.00 0.00 42.92 41.09 2c91 s ASP 40 CO 0.03 -0.00 0.04 1.07 -0.17 0.00 0.00 175.17 176.14 2c91 n THR 41 N 4.61 0.00 -3.53 1.71 5.66 -0.38 -1.92 114.28 120.43 2c91 n THR 41 Ca -0.20 -0.59 -0.17 0.00 -3.05 0.00 0.00 64.05 60.03 2c91 n THR 41 Cb 0.50 0.23 -0.06 0.00 -1.55 0.00 0.00 70.33 69.45 2c91 n THR 41 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2c91 s ALA 42 N -2.29 -1.67 0.29 1.79 0.00 -1.26 -3.85 121.76 114.76 2c91 s ALA 42 Ca 0.06 1.18 0.03 0.00 0.00 0.00 0.00 51.96 53.23 2c91 s ALA 42 Cb 0.00 0.07 0.70 0.00 0.00 0.00 0.00 23.12 23.89 2c91 s ALA 42 CO 0.04 -0.39 1.71 0.35 0.00 0.00 0.00 175.76 177.48 2c91 h PHE 43 N 3.00 0.72 -0.47 0.00 3.57 -1.82 -2.58 116.94 119.36 2c91 h PHE 43 Ca -0.28 0.04 -0.03 0.00 3.53 0.00 0.00 57.97 61.23 2c91 h PHE 43 Cb 1.15 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 39.69 2c91 h PHE 43 CO 0.38 0.02 0.15 1.98 -2.23 0.00 0.00 178.31 178.61 2c91 h MET 44 N 0.47 0.68 -6.36 1.11 4.05 -1.96 -3.28 114.93 109.65 2c91 h MET 44 Ca 0.55 -0.11 -0.54 0.00 -0.28 0.00 0.00 59.70 59.32 2c91 h MET 44 Cb 0.99 -0.12 0.01 0.00 -0.80 0.00 0.00 31.60 31.68 2c91 h MET 44 CO -0.49 0.59 1.03 0.71 0.23 0.00 0.00 176.91 178.98 2c91 s TYR 45 N -5.25 2.23 -1.47 1.39 2.02 -0.97 -2.72 117.35 112.58 2c91 s TYR 45 Ca -0.09 0.29 -0.12 0.00 -0.37 0.00 0.00 57.07 56.78 2c91 s TYR 45 Cb 0.16 -3.92 0.06 0.00 -0.40 0.00 0.00 41.96 37.86 2c91 s TYR 45 CO 0.77 -3.78 1.04 0.00 -1.57 0.00 0.00 175.55 172.01 2c91 n ASP 47 N -2.90 -5.14 0.00 0.00 2.03 -1.10 -1.26 116.55 108.17 2c91 n ASP 47 Ca 0.01 -0.15 0.00 0.00 0.52 0.00 0.00 54.79 55.18 2c91 n ASP 47 Cb 0.54 -4.23 0.00 0.00 -0.72 0.00 0.00 41.12 36.71 2c91 n ASP 47 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2c91 n GLY 48 N -1.19 0.40 0.12 0.27 0.00 -0.16 -4.98 105.19 99.65 2c91 n GLY 48 Ca -0.13 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.82 2c91 n GLY 48 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2c91 h GLN 49 N 4.25 0.13 -0.22 1.61 1.08 -0.96 -1.87 115.11 119.12 2c91 h GLN 49 Ca 0.00 -0.14 0.04 0.00 -1.45 0.00 0.00 58.65 57.09 2c91 h GLN 49 Cb 0.00 0.04 -0.03 0.00 -0.05 0.00 0.00 27.48 27.44 2c91 h GLN 49 CO 0.00 0.91 0.00 1.03 -0.95 0.00 0.00 178.83 179.82 2c91 h SER 50 N 0.07 -0.07 -0.82 1.46 0.87 -1.47 0.02 113.55 113.61 2c91 h SER 50 Ca -0.03 0.05 -0.01 0.00 -1.23 0.00 0.00 61.79 60.56 2c91 h SER 50 Cb 1.48 0.08 -0.04 0.00 -0.44 0.00 0.00 62.40 63.49 2c91 h SER 50 CO 0.12 -0.01 0.46 -0.33 -0.53 0.00 0.00 176.83 176.55 2c91 h GLU 51 N 0.07 1.14 -0.23 2.24 5.08 -1.78 -1.57 114.58 119.54 2c91 h GLU 51 Ca 0.10 -0.12 -0.01 0.00 -1.00 0.00 0.00 59.36 58.32 2c91 h GLU 51 Cb 0.12 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.14 2c91 h GLU 51 CO -0.17 0.83 0.08 -0.91 -1.00 0.00 0.00 179.01 177.85 2c91 h ASN 52 N 1.14 0.32 -0.09 1.42 -0.26 -1.02 -0.78 115.58 116.31 2c91 h ASN 52 Ca 0.29 -0.18 0.00 0.00 -0.56 0.00 0.00 56.30 55.86 2c91 h ASN 52 Cb 0.01 -0.08 -0.01 0.00 -1.06 0.00 0.00 38.32 37.18 2c91 h ASN 52 CO -0.05 0.41 0.05 0.40 -1.06 0.00 0.00 177.43 177.18 2c91 h ILE 53 N 0.21 1.01 -0.49 2.81 2.04 -0.88 -2.03 117.51 120.17 2c91 h ILE 53 Ca 0.08 -0.04 -0.06 0.00 1.00 0.00 0.00 64.86 65.84 2c91 h ILE 53 Cb 0.20 0.89 -0.02 0.00 -0.74 0.00 0.00 36.82 37.15 2c91 h ILE 53 CO -0.00 0.02 0.07 -0.07 0.00 0.00 0.00 178.15 178.17 2c91 h LEU 54 N 0.11 0.73 -1.96 1.44 3.38 -1.20 -2.22 115.31 115.59 2c91 h LEU 54 Ca 0.04 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 2c91 h LEU 54 Cb -0.00 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.55 2c91 h LEU 54 CO -0.02 0.75 -0.05 1.23 0.09 0.00 0.00 178.44 180.44 2c91 h GLY 55 N 0.95 0.00 0.22 0.83 0.00 -0.90 -2.43 103.07 101.74 2c91 h GLY 55 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.49 2c91 h GLY 55 CO 0.01 0.00 -0.01 0.61 0.00 0.00 0.00 176.54 177.14 2c91 n GLY 56 N -1.34 -0.47 0.00 4.60 0.00 -0.78 -4.23 105.19 102.96 2c91 n GLY 56 Ca -0.03 -0.34 0.13 0.00 0.00 0.00 0.00 46.02 45.79 2c91 n GLY 56 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2c91 n LEU 57 N -0.38 0.00 -1.67 0.99 4.77 -0.91 -4.90 117.00 114.90 2c91 n LEU 57 Ca 0.20 0.37 -0.12 0.00 -0.03 0.00 0.00 56.01 56.44 2c91 n LEU 57 Cb 0.25 -0.37 0.01 0.00 -2.33 0.00 0.00 43.42 40.98 2c91 n LEU 57 CO 0.18 -0.03 -0.03 0.61 -1.33 0.00 0.00 177.39 176.78 2c91 n GLY 58 N 1.15 -0.01 0.13 -0.72 0.00 -1.26 -4.93 105.19 99.55 2c91 n GLY 58 Ca 0.10 -0.31 0.13 0.00 0.00 0.00 0.00 46.02 45.94 2c91 n GLY 58 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2c91 n LEU 59 N -2.18 0.71 -3.59 0.99 4.77 -1.26 -4.97 117.00 111.47 2c91 n LEU 59 Ca -0.08 -0.09 -0.21 0.00 -0.03 0.00 0.00 56.01 55.60 2c91 n LEU 59 Cb 0.58 -0.19 0.07 0.00 -2.33 0.00 0.00 43.42 41.54 2c91 n LEU 59 CO 0.24 0.14 0.08 0.61 -1.33 0.00 0.00 177.39 177.13 2c91 n GLY 60 N 1.39 -0.39 3.77 -0.72 0.00 -1.26 -4.88 105.19 103.10 2c91 n GLY 60 Ca 0.10 0.15 -0.40 0.00 0.00 0.00 0.00 46.02 45.87 2c91 n GLY 60 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2c91 s LEU 61 N -6.72 4.20 0.00 0.99 1.43 -1.26 -2.74 118.68 114.59 2c91 s LEU 61 Ca 0.17 2.74 0.00 0.00 -1.03 0.00 0.00 54.13 56.01 2c91 s LEU 61 Cb -0.08 -3.89 0.00 0.00 0.03 0.00 0.00 46.19 42.25 2c91 s LEU 61 CO 0.76 -0.92 0.00 0.61 0.23 0.00 0.00 176.35 177.04 2c91 n GLY 62 N 0.64 0.63 2.87 -3.19 0.00 -1.26 -4.33 105.19 100.55 2c91 n GLY 62 Ca 0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 2c91 n GLY 62 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2c91 n SER 63 N -0.08 6.44 -2.81 1.61 3.41 -1.11 -4.42 113.62 116.66 2c91 n SER 63 Ca 0.00 -3.50 -0.37 0.00 -0.26 0.00 0.00 58.87 54.75 2c91 n SER 63 Cb 0.04 -1.18 -0.05 0.00 -0.26 0.00 0.00 64.21 62.75 2c91 n SER 63 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2c91 n GLY 64 N 0.89 -0.19 0.00 5.00 0.00 -1.26 -3.06 105.19 106.57 2c91 n GLY 64 Ca 0.32 0.47 0.00 0.00 0.00 0.00 0.00 46.02 46.81 2c91 n GLY 64 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2c91 n ASP 65 N 0.94 0.00 -3.70 1.61 -0.08 -1.26 -5.12 116.55 108.95 2c91 n ASP 65 Ca 0.12 0.00 -0.13 0.00 -1.51 0.00 0.00 54.79 53.27 2c91 n ASP 65 Cb 0.05 0.00 -0.13 0.00 2.34 0.00 0.00 41.12 43.38 2c91 n ASP 65 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2c91 h THR 67 N 6.07 1.14 -3.40 0.00 1.35 -1.92 -3.46 112.91 112.70 2c91 h THR 67 Ca -0.28 -2.71 -0.54 0.00 -0.55 0.00 0.00 66.41 62.32 2c91 h THR 67 Cb 1.14 2.83 -0.03 0.00 -1.73 0.00 0.00 68.15 70.36 2c91 h THR 67 CO 0.26 0.84 0.30 -0.69 -0.25 0.00 0.00 175.52 175.98 2c91 s VAL 68 N -2.61 4.90 -0.06 6.82 1.01 -1.26 -4.88 120.40 124.32 2c91 s VAL 68 Ca -0.11 1.91 -0.02 0.00 0.00 0.00 0.00 61.98 63.77 2c91 s VAL 68 Cb 0.06 -4.25 -0.04 0.00 0.00 0.00 0.00 36.38 32.15 2c91 s VAL 68 CO 0.87 0.19 0.04 -0.54 0.00 0.00 0.00 175.10 175.66 2c91 s LYS 69 N 0.93 3.04 -0.06 2.72 -0.14 -0.30 -4.67 119.74 121.27 2c91 s LYS 69 Ca 0.48 -0.41 0.06 0.00 -1.36 0.00 0.00 55.97 54.74 2c91 s LYS 69 Cb -0.20 -2.85 -0.01 0.00 -1.68 0.00 0.00 37.83 33.09 2c91 s LYS 69 CO 0.26 0.69 -0.23 -1.50 -0.76 0.00 0.00 175.35 173.81 2c91 s ILE 70 N -0.99 1.90 0.03 2.17 1.10 -1.26 -0.96 121.20 123.18 2c91 s ILE 70 Ca 0.16 -0.98 0.09 0.00 -0.51 0.00 0.00 60.65 59.41 2c91 s ILE 70 Cb -0.12 -1.61 -0.03 0.00 0.15 0.00 0.00 42.46 40.85 2c91 s ILE 70 CO 0.06 0.53 -0.26 0.00 -2.11 0.00 0.00 174.94 173.16 2c91 s ALA 71 N -0.08 2.21 0.37 1.50 0.00 -0.63 -1.74 121.76 123.40 2c91 s ALA 71 Ca -0.05 -1.22 0.06 0.00 0.00 0.00 0.00 51.96 50.75 2c91 s ALA 71 Cb -0.13 -0.49 -0.03 0.00 0.00 0.00 0.00 23.12 22.47 2c91 s ALA 71 CO 0.04 0.53 0.21 -0.08 0.00 0.00 0.00 175.76 176.46 2c91 s THR 72 N -0.75 0.24 -0.04 0.00 -1.32 -0.68 -1.25 115.64 111.84 2c91 s THR 72 Ca 0.11 -2.00 -0.07 0.00 -1.21 0.00 0.00 61.69 58.52 2c91 s THR 72 Cb -0.10 -2.41 0.01 0.00 -1.51 0.00 0.00 72.50 68.49 2c91 s THR 72 CO 0.01 0.00 0.16 -0.54 -2.21 0.00 0.00 174.62 172.05 2c91 s LYS 73 N -3.56 0.31 -0.07 7.08 1.02 -1.25 -0.88 119.74 122.39 2c91 s LYS 73 Ca 0.32 0.01 -0.02 0.00 0.02 0.00 0.00 55.97 56.31 2c91 s LYS 73 Cb 0.02 0.14 -0.03 0.00 -0.52 0.00 0.00 37.83 37.44 2c91 s LYS 73 CO 0.22 -0.06 0.02 0.00 -0.92 0.00 0.00 175.35 174.60 2c91 s ALA 74 N -0.45 3.34 0.12 5.17 0.00 -0.19 -2.23 121.76 127.53 2c91 s ALA 74 Ca -0.05 -0.82 0.05 0.00 0.00 0.00 0.00 51.96 51.14 2c91 s ALA 74 Cb -0.04 -1.50 -0.04 0.00 0.00 0.00 0.00 23.12 21.55 2c91 s ALA 74 CO 0.01 0.60 -0.13 0.54 0.00 0.00 0.00 175.76 176.78 2c91 s ASN 75 N -1.03 1.88 0.00 0.00 2.20 -1.26 -1.05 114.94 115.68 2c91 s ASN 75 Ca 0.15 -0.82 0.29 0.00 -0.94 0.00 0.00 52.86 51.54 2c91 s ASN 75 Cb -0.11 -0.05 1.38 0.00 -2.00 0.00 0.00 41.25 40.47 2c91 s ASN 75 CO 0.04 -0.18 1.93 -0.81 -2.94 0.00 0.00 177.10 175.15 2c91 n PRO 76 N 0.50 1.39 -1.47 3.55 -0.04 -1.26 -4.47 135.00 133.20 2c91 n PRO 76 Ca -0.15 -0.56 -0.30 0.00 -0.04 0.00 0.00 63.50 62.44 2c91 n PRO 76 Cb 0.57 -1.48 0.09 0.00 -0.04 0.00 0.00 33.50 32.64 2c91 n PRO 76 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 2c91 s TRP 77 N -1.99 2.77 -1.39 0.54 0.51 -1.26 -1.35 118.94 116.77 2c91 s TRP 77 Ca 0.42 1.26 -0.09 0.00 -2.12 0.00 0.00 56.10 55.56 2c91 s TRP 77 Cb 0.21 -3.08 0.03 0.00 -0.81 0.00 0.00 33.47 29.82 2c91 s TRP 77 CO 0.34 -1.78 1.11 0.39 -0.51 0.00 0.00 176.95 176.50 2c91 n GLU 78 N -3.46 -7.19 -0.99 4.98 1.02 -1.26 -1.76 120.64 111.97 2c91 n GLU 78 Ca 0.07 0.77 0.00 0.00 -0.02 0.00 0.00 57.16 57.98 2c91 n GLU 78 Cb 0.55 -5.77 0.00 0.00 -0.02 0.00 0.00 31.44 26.20 2c91 n GLU 78 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2c91 n GLY 79 N -1.85 0.85 0.19 0.62 0.00 -1.26 -4.95 105.19 98.79 2c91 n GLY 79 Ca -0.02 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.86 2c91 n GLY 79 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2c91 h LYS 80 N 2.42 0.61 -2.19 1.61 1.57 -1.21 -3.50 116.57 115.88 2c91 h LYS 80 Ca 0.00 -0.38 0.24 0.00 -1.87 0.00 0.00 60.65 58.64 2c91 h LYS 80 Cb 0.01 0.04 -0.10 0.00 0.08 0.00 0.00 32.23 32.26 2c91 h LYS 80 CO 0.00 0.99 -0.62 -1.13 -0.57 0.00 0.00 179.45 178.13 2c91 n SER 81 N -4.27 -5.57 -1.46 0.86 3.41 -0.46 -4.62 113.62 101.52 2c91 n SER 81 Ca -0.06 0.70 -0.07 0.00 -0.26 0.00 0.00 58.87 59.19 2c91 n SER 81 Cb 0.51 -3.05 0.22 0.00 -0.26 0.00 0.00 64.21 61.63 2c91 n SER 81 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2c91 n LEU 82 N -3.66 4.90 -4.71 1.04 4.77 -1.26 -4.31 117.00 113.77 2c91 n LEU 82 Ca -0.03 -3.55 -0.35 0.00 -0.03 0.00 0.00 56.01 52.05 2c91 n LEU 82 Cb 0.44 -0.68 0.10 0.00 -2.33 0.00 0.00 43.42 40.95 2c91 n LEU 82 CO 0.02 1.06 0.84 -0.54 -1.33 0.00 0.00 177.39 177.45 2c91 s LYS 83 N -3.16 2.08 0.22 3.23 -0.14 -1.26 -4.37 119.74 116.33 2c91 s LYS 83 Ca 0.48 1.92 -0.13 0.00 -1.36 0.00 0.00 55.97 56.88 2c91 s LYS 83 Cb 0.42 -1.81 0.27 0.00 -1.68 0.00 0.00 37.83 35.03 2c91 s LYS 83 CO 0.05 -1.92 1.61 -1.35 -0.76 0.00 0.00 175.35 172.98 2c91 h PRO 84 N -0.18 -0.02 -0.32 -1.68 0.11 -1.92 -1.05 132.00 126.95 2c91 h PRO 84 Ca -0.49 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.55 2c91 h PRO 84 Cb 1.32 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.42 2c91 h PRO 84 CO 0.50 -0.01 -0.13 -0.44 -0.21 0.00 0.00 178.00 177.70 2c91 h ASP 85 N -0.02 0.53 -0.13 -2.05 3.32 -1.99 -2.19 116.42 113.89 2c91 h ASP 85 Ca 0.33 -0.15 -0.02 0.00 0.02 0.00 0.00 57.03 57.21 2c91 h ASP 85 Cb 0.53 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 39.93 2c91 h ASP 85 CO -0.73 0.70 -0.01 -1.28 -1.72 0.00 0.00 179.24 176.19 2c91 h SER 86 N 0.50 0.24 -0.65 6.45 0.87 -1.57 -0.93 113.55 118.46 2c91 h SER 86 Ca 0.09 -0.33 0.05 0.00 -1.23 0.00 0.00 61.79 60.37 2c91 h SER 86 Cb 0.53 -0.06 -0.05 0.00 -0.44 0.00 0.00 62.40 62.37 2c91 h SER 86 CO 0.03 0.51 0.36 0.40 -0.53 0.00 0.00 176.83 177.60 2c91 h ILE 87 N -0.04 0.98 -0.05 2.23 2.04 -1.17 0.12 117.51 121.61 2c91 h ILE 87 Ca 0.04 -0.23 -0.00 0.00 1.00 0.00 0.00 64.86 65.66 2c91 h ILE 87 Cb 0.39 0.25 -0.00 0.00 -0.74 0.00 0.00 36.82 36.72 2c91 h ILE 87 CO 0.01 0.12 0.03 -0.09 0.00 0.00 0.00 178.15 178.22 2c91 h ARG 88 N 0.67 0.07 -0.42 2.37 2.43 -1.41 -2.02 114.38 116.08 2c91 h ARG 88 Ca 0.29 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.45 2c91 h ARG 88 Cb 0.16 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.68 2c91 h ARG 88 CO -0.17 0.09 0.26 1.03 -1.51 0.00 0.00 179.97 179.66 2c91 h SER 89 N 0.04 0.49 -0.41 -3.80 0.87 -0.77 -0.71 113.55 109.27 2c91 h SER 89 Ca 0.02 -0.05 -0.00 0.00 -1.23 0.00 0.00 61.79 60.53 2c91 h SER 89 Cb 0.03 -0.12 -0.02 0.00 -0.44 0.00 0.00 62.40 61.85 2c91 h SER 89 CO -0.00 0.39 0.25 1.56 -0.53 0.00 0.00 176.83 178.50 2c91 h GLN 90 N 0.55 0.56 -0.33 2.24 4.20 -0.73 -1.37 115.11 120.23 2c91 h GLN 90 Ca 0.15 -0.05 -0.07 0.00 0.06 0.00 0.00 58.65 58.74 2c91 h GLN 90 Cb -0.01 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 27.64 2c91 h GLN 90 CO -0.03 0.40 -0.08 1.25 -0.67 0.00 0.00 178.83 179.71 2c91 h LEU 91 N 0.55 0.63 -0.81 1.46 5.85 -1.21 0.17 115.31 121.95 2c91 h LEU 91 Ca 0.15 -0.36 -0.07 0.00 0.84 0.00 0.00 57.88 58.44 2c91 h LEU 91 Cb -0.01 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 40.82 2c91 h LEU 91 CO -0.03 0.85 0.14 -0.33 -0.34 0.00 0.00 178.44 178.73 2c91 h GLU 92 N 0.41 1.03 -0.37 1.25 5.08 -0.98 0.12 114.58 121.12 2c91 h GLU 92 Ca 0.08 -0.25 -0.02 0.00 -1.00 0.00 0.00 59.36 58.18 2c91 h GLU 92 Cb 0.57 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.67 2c91 h GLU 92 CO 0.03 0.93 0.17 1.15 -1.00 0.00 0.00 179.01 180.29 2c91 h THR 93 N 0.98 1.17 -0.51 1.13 2.02 -1.20 -2.63 112.91 113.87 2c91 h THR 93 Ca 0.20 -0.50 0.05 0.00 0.77 0.00 0.00 66.41 66.93 2c91 h THR 93 Cb 0.37 0.81 -0.05 0.00 -1.74 0.00 0.00 68.15 67.55 2c91 h THR 93 CO 0.00 0.19 0.25 0.28 0.37 0.00 0.00 175.52 176.61 2c91 h SER 94 N 0.46 0.34 -0.55 4.18 0.02 -0.42 -1.69 113.55 115.89 2c91 h SER 94 Ca 0.13 0.03 -0.03 0.00 -0.84 0.00 0.00 61.79 61.08 2c91 h SER 94 Cb 0.13 -0.03 -0.03 0.00 0.14 0.00 0.00 62.40 62.62 2c91 h SER 94 CO -0.02 0.24 0.24 -0.07 -1.14 0.00 0.00 176.83 176.08 2c91 h LEU 95 N 0.48 0.78 -0.09 5.07 3.38 -0.69 0.04 115.31 124.28 2c91 h LEU 95 Ca 0.23 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 58.08 2c91 h LEU 95 Cb 0.16 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.71 2c91 h LEU 95 CO -0.17 0.70 -0.01 0.50 0.09 0.00 0.00 178.44 179.54 2c91 h LYS 96 N 0.85 0.17 -0.62 1.13 3.64 -1.07 -1.62 116.57 119.04 2c91 h LYS 96 Ca 0.20 -0.06 -0.06 0.00 -1.27 0.00 0.00 60.65 59.46 2c91 h LYS 96 Cb 0.16 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 31.94 2c91 h LYS 96 CO -0.02 0.46 0.15 0.00 -2.27 0.00 0.00 179.45 177.77 2c91 h ARG 97 N -0.13 0.97 0.00 1.90 3.08 -1.14 -1.48 114.38 117.58 2c91 h ARG 97 Ca 0.02 -0.22 0.00 0.00 0.07 0.00 0.00 59.98 59.86 2c91 h ARG 97 Cb 0.39 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.30 2c91 h ARG 97 CO 0.01 0.87 0.00 1.28 -1.07 0.00 0.00 179.97 181.05 2c91 n LEU 98 N -4.25 0.00 -3.78 3.04 4.77 -0.01 -3.89 117.00 112.88 2c91 n LEU 98 Ca 0.05 0.30 -0.24 0.00 -0.03 0.00 0.00 56.01 56.08 2c91 n LEU 98 Cb 0.24 -0.30 0.01 0.00 -2.33 0.00 0.00 43.42 41.05 2c91 n LEU 98 CO 0.41 -0.06 -0.13 0.00 -1.33 0.00 0.00 177.39 176.28 2c91 n GLN 99 N -1.30 -3.65 -3.78 3.23 6.02 -0.56 -4.38 117.38 112.96 2c91 n GLN 99 Ca 0.11 0.52 -0.13 0.00 -0.01 0.00 0.00 57.00 57.49 2c91 n GLN 99 Cb 0.20 -4.78 -0.10 0.00 1.02 0.00 0.00 30.24 26.58 2c91 n GLN 99 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2c91 h PRO 101 N 4.66 0.00 -1.95 0.00 0.13 -1.82 -3.41 132.00 129.61 2c91 h PRO 101 Ca -0.28 0.00 0.10 0.00 -0.87 0.00 0.00 66.00 64.94 2c91 h PRO 101 Cb 1.18 0.00 -0.19 0.00 0.13 0.00 0.00 31.00 32.13 2c91 h PRO 101 CO 0.37 0.00 0.51 -0.98 -0.23 0.00 0.00 178.00 177.67 2c91 s ARG 102 N -3.12 0.72 0.09 0.86 1.70 -1.26 -4.56 118.95 113.38 2c91 s ARG 102 Ca 0.10 -0.09 -0.01 0.00 -0.47 0.00 0.00 55.73 55.26 2c91 s ARG 102 Cb 0.12 0.34 -0.04 0.00 -0.57 0.00 0.00 34.95 34.79 2c91 s ARG 102 CO 0.62 -0.28 0.27 0.14 -1.08 0.00 0.00 175.30 174.98 2c91 s VAL 103 N -2.19 5.31 0.27 4.99 -7.23 -0.81 -3.98 120.40 116.76 2c91 s VAL 103 Ca 0.02 -0.28 0.08 0.00 -1.81 0.00 0.00 61.98 59.98 2c91 s VAL 103 Cb -0.01 -3.64 -0.01 0.00 0.56 0.00 0.00 36.38 33.28 2c91 s VAL 103 CO -0.04 0.09 1.62 0.44 -0.31 0.00 0.00 175.10 176.90 2c91 h ASP 104 N 2.92 0.15 -3.38 4.85 3.32 -1.68 -1.14 116.42 121.45 2c91 h ASP 104 Ca -0.46 -0.08 -0.24 0.00 0.02 0.00 0.00 57.03 56.28 2c91 h ASP 104 Cb 1.16 -0.04 -0.32 0.00 0.22 0.00 0.00 39.33 40.36 2c91 h ASP 104 CO 0.74 0.68 -0.57 -0.22 -1.72 0.00 0.00 179.24 178.15 2c91 s LEU 105 N -7.89 0.57 -0.13 1.55 2.96 -0.96 -0.90 118.68 113.88 2c91 s LEU 105 Ca -0.03 0.36 0.01 0.00 -0.22 0.00 0.00 54.13 54.25 2c91 s LEU 105 Cb 0.13 0.45 0.02 0.00 0.50 0.00 0.00 46.19 47.28 2c91 s LEU 105 CO 0.77 -0.16 -0.15 0.12 -1.32 0.00 0.00 176.35 175.62 2c91 s PHE 106 N 1.29 2.11 0.05 5.38 5.36 -0.37 -1.69 117.98 130.11 2c91 s PHE 106 Ca -0.08 -1.12 0.02 0.00 -0.96 0.00 0.00 56.93 54.79 2c91 s PHE 106 Cb -0.11 -1.54 -0.04 0.00 -0.34 0.00 0.00 43.02 40.99 2c91 s PHE 106 CO -0.07 -0.60 0.05 0.71 -1.46 0.00 0.00 175.22 173.86 2c91 s TYR 107 N 1.29 3.16 -0.38 10.12 2.02 -0.06 -0.76 117.35 132.74 2c91 s TYR 107 Ca 0.00 0.09 -0.29 0.00 -0.37 0.00 0.00 57.07 56.50 2c91 s TYR 107 Cb -0.14 -1.64 0.01 0.00 -0.40 0.00 0.00 41.96 39.80 2c91 s TYR 107 CO -0.07 0.51 1.25 -0.51 -1.57 0.00 0.00 175.55 175.16 2c91 s LEU 108 N -2.10 3.75 0.17 -1.29 1.43 -0.91 -1.02 118.68 118.72 2c91 s LEU 108 Ca 0.26 0.90 -0.05 0.00 -1.03 0.00 0.00 54.13 54.20 2c91 s LEU 108 Cb -0.12 -3.54 0.06 0.00 0.03 0.00 0.00 46.19 42.62 2c91 s LEU 108 CO 0.18 -1.18 1.49 -0.74 0.23 0.00 0.00 176.35 176.32 2c91 h HIS 109 N 9.44 0.82 -1.91 0.29 2.76 -1.33 -1.56 115.15 123.66 2c91 h HIS 109 Ca -0.25 -0.28 -0.01 0.00 -2.20 0.00 0.00 60.37 57.63 2c91 h HIS 109 Cb 1.08 -0.16 -0.20 0.00 1.55 0.00 0.00 27.41 29.69 2c91 h HIS 109 CO 0.92 1.04 0.30 0.00 -1.30 0.00 0.00 177.93 178.90 2c91 s ALA 110 N -4.07 -1.81 0.62 5.26 0.00 -1.22 -4.30 121.76 116.24 2c91 s ALA 110 Ca -0.08 1.36 -0.18 0.00 0.00 0.00 0.00 51.96 53.06 2c91 s ALA 110 Cb 0.11 -0.17 -0.03 0.00 0.00 0.00 0.00 23.12 23.03 2c91 s ALA 110 CO 0.85 -0.37 1.18 -2.30 0.00 0.00 0.00 175.76 175.12 2c91 n PRO 111 N 0.79 1.08 -3.66 0.00 -0.02 -1.26 -4.57 135.00 127.35 2c91 n PRO 111 Ca -0.16 0.42 -0.39 0.00 -2.02 0.00 0.00 63.50 61.35 2c91 n PRO 111 Cb 0.58 -2.40 -0.10 0.00 -0.02 0.00 0.00 33.50 31.55 2c91 n PRO 111 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2c91 s ASP 112 N -1.30 5.48 0.00 2.55 -1.08 -1.26 -4.85 116.67 116.21 2c91 s ASP 112 Ca 0.79 -1.97 0.19 0.00 -0.52 0.00 0.00 52.55 51.04 2c91 s ASP 112 Cb -0.40 -1.92 0.90 0.00 -1.46 0.00 0.00 42.92 40.04 2c91 s ASP 112 CO 0.43 -0.62 1.59 1.41 0.52 0.00 0.00 175.17 178.51 2c91 n HIS 113 N 4.75 0.00 0.97 -5.34 8.25 -1.26 -2.50 115.22 120.09 2c91 n HIS 113 Ca -0.05 0.00 0.10 0.00 -0.26 0.00 0.00 57.72 57.51 2c91 n HIS 113 Cb 0.41 -0.37 -0.06 0.00 1.12 0.00 0.00 29.99 31.09 2c91 n HIS 113 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 2c91 n SER 114 N -1.37 1.52 -4.16 0.41 7.64 -1.26 -4.86 113.62 111.55 2c91 n SER 114 Ca 0.07 -1.26 -0.33 0.00 1.01 0.00 0.00 58.87 58.36 2c91 n SER 114 Cb 0.18 0.73 -0.16 0.00 -1.01 0.00 0.00 64.21 63.94 2c91 n SER 114 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2c91 s THR 115 N -2.67 2.21 0.17 0.44 2.01 -1.04 -5.10 115.64 111.66 2c91 s THR 115 Ca 0.13 -0.90 -0.34 0.00 0.31 0.00 0.00 61.69 60.90 2c91 s THR 115 Cb 0.17 -1.93 -0.14 0.00 0.01 0.00 0.00 72.50 70.61 2c91 s THR 115 CO 0.70 0.53 1.54 -2.65 -0.69 0.00 0.00 174.62 174.05 2c91 n PRO 116 N 4.46 2.08 0.22 4.92 -0.02 -1.26 -4.85 135.00 140.56 2c91 n PRO 116 Ca -0.20 0.75 0.07 0.00 -2.02 0.00 0.00 63.50 62.09 2c91 n PRO 116 Cb 0.51 -2.50 0.52 0.00 -0.02 0.00 0.00 33.50 32.01 2c91 n PRO 116 CO 0.00 0.00 0.00 -0.24 1.98 0.00 0.00 175.50 177.24 2c91 h VAL 117 N 3.53 0.98 -0.86 -1.45 3.04 -1.98 -1.49 116.25 118.01 2c91 h VAL 117 Ca -0.45 -0.84 0.13 0.00 -1.01 0.00 0.00 66.70 64.53 2c91 h VAL 117 Cb 1.26 1.48 -0.09 0.00 -2.01 0.00 0.00 31.29 31.93 2c91 h VAL 117 CO 0.87 0.23 0.47 -0.33 -1.01 0.00 0.00 177.57 177.80 2c91 h GLU 118 N 0.00 0.70 -0.03 4.17 3.07 -1.98 0.86 114.58 121.36 2c91 h GLU 118 Ca -0.00 -0.04 -0.00 0.00 -0.50 0.00 0.00 59.36 58.81 2c91 h GLU 118 Cb 0.46 -0.16 -0.00 0.00 -0.84 0.00 0.00 28.75 28.21 2c91 h GLU 118 CO 0.03 0.46 0.02 0.93 -1.40 0.00 0.00 179.01 179.05 2c91 h GLU 119 N 0.72 0.05 -0.47 2.33 5.08 -1.63 0.61 114.58 121.26 2c91 h GLU 119 Ca 0.45 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.80 2c91 h GLU 119 Cb 0.56 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.78 2c91 h GLU 119 CO -0.32 0.15 0.28 1.15 -1.00 0.00 0.00 179.01 179.28 2c91 h THR 120 N -0.07 1.14 -0.27 1.13 2.02 -1.45 -2.42 112.91 113.00 2c91 h THR 120 Ca 0.01 -0.32 -0.13 0.00 0.77 0.00 0.00 66.41 66.74 2c91 h THR 120 Cb 0.12 0.51 -0.01 0.00 -1.74 0.00 0.00 68.15 67.03 2c91 h THR 120 CO -0.00 0.15 -0.37 -0.07 0.37 0.00 0.00 175.52 175.59 2c91 h LEU 121 N 0.62 0.66 -0.18 2.58 3.38 -0.68 -1.82 115.31 119.87 2c91 h LEU 121 Ca 0.17 -0.28 0.02 0.00 0.09 0.00 0.00 57.88 57.88 2c91 h LEU 121 Cb -0.01 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 2c91 h LEU 121 CO -0.03 0.96 0.04 0.00 0.09 0.00 0.00 178.44 179.50 2c91 h ALA 123 N 1.13 1.29 -0.62 0.00 0.00 -1.16 -1.77 119.26 118.12 2c91 h ALA 123 Ca 0.08 -0.07 0.02 0.00 0.00 0.00 0.00 54.91 54.94 2c91 h ALA 123 Cb 0.07 -0.40 -0.03 0.00 0.00 0.00 0.00 17.79 17.42 2c91 h ALA 123 CO -0.10 0.66 0.40 0.00 0.00 0.00 0.00 179.25 180.21 2c91 h HIS 125 N 0.81 0.30 -0.50 0.00 6.17 -0.83 -1.79 115.15 119.31 2c91 h HIS 125 Ca 0.24 0.01 0.09 0.00 0.71 0.00 0.00 60.37 61.41 2c91 h HIS 125 Cb -0.05 -0.10 -0.08 0.00 2.52 0.00 0.00 27.41 29.71 2c91 h HIS 125 CO -0.04 0.20 0.06 0.37 0.71 0.00 0.00 177.93 179.23 2c91 h GLN 126 N 0.32 0.18 -0.02 5.26 5.75 -1.04 0.64 115.11 126.20 2c91 h GLN 126 Ca 0.09 -0.01 -0.09 0.00 -0.15 0.00 0.00 58.65 58.48 2c91 h GLN 126 Cb -0.03 -0.04 -0.01 0.00 1.07 0.00 0.00 27.48 28.47 2c91 h GLN 126 CO -0.02 0.12 -0.42 -0.07 -2.65 0.00 0.00 178.83 175.79 2c91 h LEU 127 N 0.18 0.05 -0.13 -2.39 3.38 -1.06 -1.17 115.31 114.17 2c91 h LEU 127 Ca 0.25 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.19 2c91 h LEU 127 Cb 0.36 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 2c91 h LEU 127 CO -0.37 0.47 0.01 -0.74 0.09 0.00 0.00 178.44 177.90 2c91 h HIS 128 N 0.04 0.24 -0.65 1.13 2.76 -0.75 -1.92 115.15 116.00 2c91 h HIS 128 Ca 0.00 -0.04 0.09 0.00 -2.20 0.00 0.00 60.37 58.22 2c91 h HIS 128 Cb 0.76 -0.06 -0.04 0.00 1.55 0.00 0.00 27.41 29.62 2c91 h HIS 128 CO 0.00 0.42 0.43 1.96 -1.30 0.00 0.00 177.93 179.45 2c91 h GLN 129 N -0.02 0.52 0.00 5.26 1.08 -0.26 0.40 115.11 122.09 2c91 h GLN 129 Ca 0.04 -0.03 0.00 0.00 -1.45 0.00 0.00 58.65 57.21 2c91 h GLN 129 Cb 0.32 -0.12 0.00 0.00 -0.05 0.00 0.00 27.48 27.63 2c91 h GLN 129 CO 0.00 0.34 0.00 0.39 -0.95 0.00 0.00 178.83 178.62 2c91 n GLU 130 N -4.48 0.24 -0.76 1.46 1.02 -0.50 -4.90 120.64 112.73 2c91 n GLU 130 Ca 0.10 0.10 0.00 0.00 -0.02 0.00 0.00 57.16 57.34 2c91 n GLU 130 Cb 0.33 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.25 2c91 n GLU 130 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2c91 n GLY 131 N 0.53 0.57 0.17 0.62 0.00 0.13 -4.96 105.19 102.24 2c91 n GLY 131 Ca 0.09 -0.49 0.12 0.00 0.00 0.00 0.00 46.02 45.74 2c91 n GLY 131 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2c91 h LYS 132 N 0.70 0.00 -3.09 1.61 1.57 -1.52 -3.42 116.57 112.43 2c91 h LYS 132 Ca 0.00 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.69 2c91 h LYS 132 Cb 0.00 0.00 -0.17 0.00 0.08 0.00 0.00 32.23 32.14 2c91 h LYS 132 CO 0.00 0.00 -0.16 -0.59 -0.57 0.00 0.00 179.45 178.13 2c91 s PHE 133 N -3.24 -0.22 -0.14 -1.35 -0.71 -1.26 -1.93 117.98 109.13 2c91 s PHE 133 Ca 0.05 0.17 -0.09 0.00 -1.04 0.00 0.00 56.93 56.02 2c91 s PHE 133 Cb 0.08 0.18 -0.04 0.00 -1.21 0.00 0.00 43.02 42.03 2c91 s PHE 133 CO 0.70 -0.54 -0.15 0.28 -1.34 0.00 0.00 175.22 174.17 2c91 h VAL 134 N 3.15 0.04 -3.74 -2.49 2.07 -1.28 -3.42 116.25 110.58 2c91 h VAL 134 Ca -0.31 -1.05 -0.68 0.00 0.82 0.00 0.00 66.70 65.48 2c91 h VAL 134 Cb 1.20 0.10 -0.19 0.00 -1.52 0.00 0.00 31.29 30.88 2c91 h VAL 134 CO 0.44 0.01 -0.77 -1.61 0.02 0.00 0.00 177.57 175.66 2c91 s GLU 135 N -2.20 2.12 -0.07 1.57 2.02 -0.08 -5.01 118.70 117.05 2c91 s GLU 135 Ca -0.14 -0.98 -0.13 0.00 0.02 0.00 0.00 54.97 53.73 2c91 s GLU 135 Cb 0.02 -2.26 -0.05 0.00 0.10 0.00 0.00 34.13 31.94 2c91 s GLU 135 CO 0.22 0.53 0.32 -1.17 0.02 0.00 0.00 175.26 175.18 2c91 s LEU 136 N -1.79 4.39 0.21 1.80 2.96 -1.26 -1.24 118.68 123.75 2c91 s LEU 136 Ca 0.18 0.74 0.06 0.00 -0.22 0.00 0.00 54.13 54.88 2c91 s LEU 136 Cb -0.11 -2.42 -0.05 0.00 0.50 0.00 0.00 46.19 44.12 2c91 s LEU 136 CO 0.09 0.28 -0.10 -0.83 -1.32 0.00 0.00 176.35 174.47 2c91 s GLY 137 N -0.64 1.44 0.15 7.98 0.00 0.06 -0.46 107.32 115.85 2c91 s GLY 137 Ca 0.20 -1.68 0.09 0.00 0.00 0.00 0.00 44.72 43.33 2c91 s GLY 137 CO 0.09 -1.73 -0.21 1.08 0.00 0.00 0.00 173.10 172.33 2c91 s LEU 138 N -3.31 2.39 -0.06 0.66 1.43 -0.44 -2.15 118.68 117.21 2c91 s LEU 138 Ca 0.23 -0.80 -0.03 0.00 -1.03 0.00 0.00 54.13 52.50 2c91 s LEU 138 Cb 0.02 -0.93 0.03 0.00 0.03 0.00 0.00 46.19 45.34 2c91 s LEU 138 CO 0.07 0.03 0.13 -0.55 0.23 0.00 0.00 176.35 176.26 2c91 s SER 139 N -2.40 -0.10 -0.55 2.29 0.15 -0.59 -0.70 113.70 111.81 2c91 s SER 139 Ca 0.14 0.26 0.00 0.00 0.70 0.00 0.00 55.95 57.05 2c91 s SER 139 Cb -0.08 0.19 0.00 0.00 -1.71 0.00 0.00 66.02 64.42 2c91 s SER 139 CO 0.06 -0.11 0.00 0.59 1.20 0.00 0.00 173.24 174.98 2c91 n ASN 140 N 3.81 -3.92 -4.82 5.45 3.02 -1.25 -3.45 115.26 114.11 2c91 n ASN 140 Ca -0.22 0.13 -0.37 0.00 -0.03 0.00 0.00 54.58 54.09 2c91 n ASN 140 Cb 0.54 -1.87 -0.06 0.00 -0.61 0.00 0.00 39.78 37.78 2c91 n ASN 140 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 2c91 s TYR 141 N -2.09 3.72 0.63 3.10 1.51 -1.26 -0.64 117.35 122.32 2c91 s TYR 141 Ca 0.00 1.22 -0.15 0.00 -1.01 0.00 0.00 57.07 57.13 2c91 s TYR 141 Cb 0.00 -2.47 -0.01 0.00 -0.11 0.00 0.00 41.96 39.37 2c91 s TYR 141 CO 0.00 0.51 1.08 0.00 -1.11 0.00 0.00 175.55 176.03 2c91 s ALA 142 N -1.28 2.60 0.29 3.71 0.00 -1.26 -4.73 121.76 121.09 2c91 s ALA 142 Ca 0.34 0.44 0.03 0.00 0.00 0.00 0.00 51.96 52.77 2c91 s ALA 142 Cb -0.18 -3.27 0.64 0.00 0.00 0.00 0.00 23.12 20.31 2c91 s ALA 142 CO 0.19 -1.07 1.78 0.66 0.00 0.00 0.00 175.76 177.32 2c91 h SER 143 N 0.15 0.72 0.36 0.00 4.64 -1.93 0.12 113.55 117.60 2c91 h SER 143 Ca -0.47 0.09 -0.10 0.00 -0.47 0.00 0.00 61.79 60.84 2c91 h SER 143 Cb 1.23 -0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 63.27 2c91 h SER 143 CO 0.56 0.29 -0.43 4.11 -0.87 0.00 0.00 176.83 180.49 2c91 h TRP 144 N 0.76 0.12 -0.17 4.77 5.08 -1.94 -1.42 115.95 123.14 2c91 h TRP 144 Ca 0.53 -0.03 -0.19 0.00 1.08 0.00 0.00 58.89 60.27 2c91 h TRP 144 Cb 0.75 -0.03 0.00 0.00 -3.00 0.00 0.00 29.16 26.89 2c91 h TRP 144 CO -0.03 0.52 -0.67 0.93 -1.28 0.00 0.00 178.44 177.90 2c91 h GLU 145 N 0.08 0.68 -0.38 0.12 5.08 -1.18 -1.79 114.58 117.20 2c91 h GLU 145 Ca 0.01 -0.50 0.02 0.00 -1.00 0.00 0.00 59.36 57.88 2c91 h GLU 145 Cb 0.80 0.09 -0.03 0.00 0.50 0.00 0.00 28.75 30.11 2c91 h GLU 145 CO 0.06 1.12 0.21 0.28 -1.00 0.00 0.00 179.01 179.68 2c91 h VAL 146 N 0.49 1.03 -0.74 3.13 2.07 -0.89 -1.50 116.25 119.84 2c91 h VAL 146 Ca -0.02 -0.15 0.02 0.00 0.82 0.00 0.00 66.70 67.37 2c91 h VAL 146 Cb 1.26 0.55 -0.04 0.00 -1.52 0.00 0.00 31.29 31.55 2c91 h VAL 146 CO 0.13 0.08 0.48 0.00 0.02 0.00 0.00 177.57 178.28 2c91 h ALA 147 N 1.17 0.96 -0.68 1.67 0.00 -1.13 0.03 119.26 121.28 2c91 h ALA 147 Ca 0.15 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 2c91 h ALA 147 Cb 0.01 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.51 2c91 h ALA 147 CO -0.08 0.30 0.30 1.49 0.00 0.00 0.00 179.25 181.27 2c91 h GLU 148 N 0.95 1.00 0.10 0.00 4.81 -1.10 -0.83 114.58 119.52 2c91 h GLU 148 Ca 0.29 -0.16 -0.00 0.00 -0.13 0.00 0.00 59.36 59.35 2c91 h GLU 148 Cb -0.04 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.17 2c91 h GLU 148 CO -0.09 0.81 -0.05 0.82 -0.73 0.00 0.00 179.01 179.77 2c91 h ILE 149 N 0.96 1.05 -0.87 2.32 2.04 -0.85 -0.31 117.51 121.84 2c91 h ILE 149 Ca 0.23 -0.57 0.00 0.00 1.00 0.00 0.00 64.86 65.53 2c91 h ILE 149 Cb 0.16 1.41 -0.04 0.00 -0.74 0.00 0.00 36.82 37.61 2c91 h ILE 149 CO -0.02 0.14 0.56 0.00 0.00 0.00 0.00 178.15 178.83 2c91 h THR 151 N 1.19 1.21 -0.49 0.00 2.02 -1.00 -1.70 112.91 114.13 2c91 h THR 151 Ca 0.32 -0.67 -0.03 0.00 0.77 0.00 0.00 66.41 66.79 2c91 h THR 151 Cb -0.11 0.81 -0.02 0.00 -1.74 0.00 0.00 68.15 67.09 2c91 h THR 151 CO -0.07 0.25 0.18 -0.07 0.37 0.00 0.00 175.52 176.18 2c91 h LEU 152 N 0.59 0.70 -0.43 2.58 3.38 -0.72 -2.41 115.31 118.98 2c91 h LEU 152 Ca 0.15 -0.18 0.02 0.00 0.09 0.00 0.00 57.88 57.96 2c91 h LEU 152 Cb 0.22 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.76 2c91 h LEU 152 CO -0.01 0.69 0.25 0.00 0.09 0.00 0.00 178.44 179.46 2c91 h LYS 154 N 0.51 0.01 0.00 0.00 3.64 -1.20 0.23 116.57 119.77 2c91 h LYS 154 Ca 0.17 -0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.49 2c91 h LYS 154 Cb 0.01 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.82 2c91 h LYS 154 CO -0.08 0.01 -0.32 0.66 -2.27 0.00 0.00 179.45 177.45 2c91 h SER 155 N 0.01 0.00 -0.47 4.20 4.64 -1.37 -3.08 113.55 117.49 2c91 h SER 155 Ca 0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 2c91 h SER 155 Cb 0.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.15 2c91 h SER 155 CO -0.09 0.32 0.00 0.59 -0.87 0.00 0.00 176.83 176.78 2c91 n ASN 156 N -3.93 3.50 -2.71 4.97 3.02 -0.59 -4.98 115.26 114.54 2c91 n ASN 156 Ca -0.02 -1.99 -0.22 0.00 -0.03 0.00 0.00 54.58 52.33 2c91 n ASN 156 Cb 0.39 -0.30 0.01 0.00 -0.61 0.00 0.00 39.78 39.27 2c91 n ASN 156 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2c91 n GLY 157 N 1.53 -0.51 3.91 7.41 0.00 -0.54 -5.01 105.19 111.99 2c91 n GLY 157 Ca 0.20 0.07 -0.28 0.00 0.00 0.00 0.00 46.02 46.01 2c91 n GLY 157 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2c91 s TRP 158 N -3.12 3.48 0.16 1.61 0.51 -0.04 -5.03 118.94 116.50 2c91 s TRP 158 Ca 0.16 0.48 -0.34 0.00 -2.12 0.00 0.00 56.10 54.28 2c91 s TRP 158 Cb -0.07 -1.96 -0.14 0.00 -0.81 0.00 0.00 33.47 30.49 2c91 s TRP 158 CO 0.20 0.32 1.55 1.51 -0.51 0.00 0.00 176.95 180.02 2c91 n ILE 159 N -0.62 0.04 -2.85 2.03 3.06 -1.26 -4.49 119.36 115.26 2c91 n ILE 159 Ca -0.03 -0.01 -0.34 0.00 -2.50 0.00 0.00 62.75 59.87 2c91 n ILE 159 Cb 0.53 -1.47 -0.07 0.00 0.54 0.00 0.00 39.64 39.18 2c91 n ILE 159 CO 0.00 0.00 0.00 -0.76 -2.50 0.00 0.00 176.55 173.29 2c91 s LEU 160 N 0.83 4.04 0.33 9.51 1.43 -1.26 -4.92 118.68 128.64 2c91 s LEU 160 Ca 0.79 1.67 -0.28 0.00 -1.03 0.00 0.00 54.13 55.27 2c91 s LEU 160 Cb -0.70 -4.37 -0.10 0.00 0.03 0.00 0.00 46.19 41.05 2c91 s LEU 160 CO 0.39 -0.28 1.19 -2.16 0.23 0.00 0.00 176.35 175.73 2c91 s PRO 161 N -2.91 4.40 0.00 1.29 0.04 -1.26 -4.50 135.00 132.06 2c91 s PRO 161 Ca 0.58 1.97 0.03 0.00 0.04 0.00 0.00 61.00 63.62 2c91 s PRO 161 Cb -0.11 -3.03 0.00 0.00 0.04 0.00 0.00 34.50 31.40 2c91 s PRO 161 CO 0.16 -0.06 0.39 0.25 0.04 0.00 0.00 177.00 177.79 2c91 n THR 162 N 0.80 0.00 -4.26 1.26 -2.24 0.39 -4.77 114.28 105.45 2c91 n THR 162 Ca 0.00 -0.48 -0.18 0.00 -2.27 0.00 0.00 64.05 61.13 2c91 n THR 162 Cb 0.44 1.04 -0.15 0.00 -2.10 0.00 0.00 70.33 69.56 2c91 n THR 162 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2c91 s VAL 163 N -0.64 0.57 -0.11 2.28 1.01 -1.21 -1.46 120.40 120.84 2c91 s VAL 163 Ca 0.02 -0.28 0.03 0.00 0.00 0.00 0.00 61.98 61.75 2c91 s VAL 163 Cb 0.02 -0.50 -0.00 0.00 0.00 0.00 0.00 36.38 35.90 2c91 s VAL 163 CO 0.06 0.18 -0.22 -0.47 0.00 0.00 0.00 175.10 174.65 2c91 s TYR 164 N 0.03 2.62 -0.30 5.22 6.14 -0.26 -1.32 117.35 129.48 2c91 s TYR 164 Ca -0.00 -1.02 -0.06 0.00 0.64 0.00 0.00 57.07 56.62 2c91 s TYR 164 Cb -0.05 -1.75 0.02 0.00 0.42 0.00 0.00 41.96 40.59 2c91 s TYR 164 CO -0.00 -0.41 0.08 -1.14 0.64 0.00 0.00 175.55 174.71 2c91 s GLN 165 N 0.42 2.97 0.10 4.97 0.74 0.12 -0.97 119.66 128.03 2c91 s GLN 165 Ca -0.16 -0.93 0.03 0.00 0.05 0.00 0.00 55.36 54.35 2c91 s GLN 165 Cb -0.17 -3.37 -0.04 0.00 1.10 0.00 0.00 33.01 30.53 2c91 s GLN 165 CO 0.07 -0.49 -0.08 0.20 -0.55 0.00 0.00 175.29 174.43 2c91 s GLY 166 N 1.47 0.84 -0.04 2.59 0.00 0.20 -3.83 107.32 108.54 2c91 s GLY 166 Ca 0.02 -1.29 -0.30 0.00 0.00 0.00 0.00 44.72 43.14 2c91 s GLY 166 CO 0.02 -1.38 1.51 -0.29 0.00 0.00 0.00 173.10 172.96 2c91 s MET 167 N -3.35 4.22 -0.28 2.90 1.75 -1.26 -1.01 119.30 122.27 2c91 s MET 167 Ca 0.09 2.05 -0.15 0.00 -1.25 0.00 0.00 55.69 56.43 2c91 s MET 167 Cb 0.01 -3.78 0.10 0.00 2.84 0.00 0.00 34.83 34.00 2c91 s MET 167 CO -0.02 -0.73 0.72 -0.47 -0.65 0.00 0.00 175.02 173.88 2c91 s TYR 168 N 3.29 -1.05 0.37 4.11 5.04 -0.98 -4.67 117.35 123.46 2c91 s TYR 168 Ca 0.67 2.04 -0.13 0.00 -2.44 0.00 0.00 57.07 57.22 2c91 s TYR 168 Cb -0.31 0.63 0.04 0.00 0.35 0.00 0.00 41.96 42.67 2c91 s TYR 168 CO 0.26 -0.52 0.72 0.54 -1.34 0.00 0.00 175.55 175.21 2c91 s ASN 169 N 1.81 0.19 0.54 4.32 2.20 -0.94 -4.12 114.94 118.93 2c91 s ASN 169 Ca -0.09 -1.19 0.26 0.00 -0.94 0.00 0.00 52.86 50.90 2c91 s ASN 169 Cb -0.06 0.80 1.43 0.00 -2.00 0.00 0.00 41.25 41.42 2c91 s ASN 169 CO -0.19 -1.59 1.99 0.00 -2.94 0.00 0.00 177.10 174.37 2c91 h ALA 170 N 2.03 2.44 -0.32 3.54 0.00 -1.85 -0.88 119.26 124.21 2c91 h ALA 170 Ca -0.31 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.59 2c91 h ALA 170 Cb 1.25 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.08 2c91 h ALA 170 CO 0.39 -0.66 0.00 0.25 0.00 0.00 0.00 179.25 179.24 2c91 n THR 171 N -4.27 0.92 -3.51 0.00 -2.24 -1.26 -4.44 114.28 99.47 2c91 n THR 171 Ca 0.09 -0.96 -0.29 0.00 -2.27 0.00 0.00 64.05 60.62 2c91 n THR 171 Cb 0.61 0.56 -0.13 0.00 -2.10 0.00 0.00 70.33 69.26 2c91 n THR 171 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 2c91 s THR 172 N -0.99 0.17 -0.06 4.28 2.01 -0.34 -4.84 115.64 115.87 2c91 s THR 172 Ca 0.22 -1.41 0.08 0.00 0.31 0.00 0.00 61.69 60.90 2c91 s THR 172 Cb 0.12 -1.14 0.14 0.00 0.01 0.00 0.00 72.50 71.62 2c91 s THR 172 CO 0.16 -0.88 1.07 0.54 -0.69 0.00 0.00 174.62 174.81 2c91 n ARG 173 N 4.47 0.53 -0.10 4.92 1.74 -1.26 -2.22 116.66 124.74 2c91 n ARG 173 Ca 0.05 -1.70 0.11 0.00 -0.77 0.00 0.00 57.85 55.54 2c91 n ARG 173 Cb 0.39 -0.90 0.48 0.00 -1.02 0.00 0.00 32.46 31.40 2c91 n ARG 173 CO 0.00 0.00 0.00 0.37 -1.52 0.00 0.00 177.63 176.48 2c91 h GLN 174 N 0.05 0.45 -0.21 5.56 4.15 -1.89 -2.05 115.11 121.18 2c91 h GLN 174 Ca -0.01 -0.03 0.06 0.00 0.77 0.00 0.00 58.65 59.45 2c91 h GLN 174 Cb 1.25 -0.10 -0.01 0.00 0.21 0.00 0.00 27.48 28.83 2c91 h GLN 174 CO 0.00 0.30 0.30 -0.39 -1.93 0.00 0.00 178.83 177.11 2c91 h VAL 175 N 0.46 0.31 -0.40 2.39 -1.51 -1.87 -3.23 116.25 112.40 2c91 h VAL 175 Ca 0.28 0.00 -0.03 0.00 -1.23 0.00 0.00 66.70 65.73 2c91 h VAL 175 Cb 0.50 0.75 -0.02 0.00 -2.13 0.00 0.00 31.29 30.39 2c91 h VAL 175 CO -0.08 0.00 0.15 -0.33 -1.23 0.00 0.00 177.57 176.08 2c91 h GLU 176 N 0.00 0.60 -0.26 5.19 5.08 -1.76 -1.22 114.58 122.20 2c91 h GLU 176 Ca 0.10 -0.11 -0.02 0.00 -1.00 0.00 0.00 59.36 58.33 2c91 h GLU 176 Cb 0.69 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.83 2c91 h GLU 176 CO -0.00 0.58 0.10 0.00 -1.00 0.00 0.00 179.01 178.68 2c91 h ALA 177 N 0.99 0.34 0.00 3.43 0.00 -1.78 -3.38 119.26 118.86 2c91 h ALA 177 Ca 0.13 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2c91 h ALA 177 Cb 0.21 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.90 2c91 h ALA 177 CO -0.01 -0.06 -0.80 0.39 0.00 0.00 0.00 179.25 178.77 2c91 n GLU 178 N -4.76 0.56 0.14 0.00 1.02 -1.25 -4.74 120.64 111.61 2c91 n GLU 178 Ca -0.03 0.00 -0.13 0.00 -0.02 0.00 0.00 57.16 56.98 2c91 n GLU 178 Cb 0.14 -0.90 -0.08 0.00 -0.02 0.00 0.00 31.44 30.58 2c91 n GLU 178 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 2c91 h LEU 179 N 0.00 -0.31 -0.34 -4.62 5.85 -1.63 -2.46 115.31 111.81 2c91 h LEU 179 Ca 0.00 -0.18 0.04 0.00 0.84 0.00 0.00 57.88 58.58 2c91 h LEU 179 Cb 0.80 0.08 -0.04 0.00 0.37 0.00 0.00 40.66 41.87 2c91 h LEU 179 CO 0.00 0.03 0.12 -0.07 -0.34 0.00 0.00 178.44 178.17 2c91 h LEU 180 N -0.66 0.12 -1.56 2.25 4.07 -1.42 -0.39 115.31 117.73 2c91 h LEU 180 Ca -0.04 0.04 0.04 0.00 0.08 0.00 0.00 57.88 58.00 2c91 h LEU 180 Cb 0.46 0.02 -0.03 0.00 1.08 0.00 0.00 40.66 42.20 2c91 h LEU 180 CO 0.06 0.11 0.36 -0.65 -1.08 0.00 0.00 178.44 177.24 2c91 h PRO 181 N 0.26 0.55 -0.51 1.13 0.11 -1.76 -0.63 132.00 131.16 2c91 h PRO 181 Ca 0.15 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 66.20 2c91 h PRO 181 Cb 0.13 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 31.09 2c91 h PRO 181 CO -0.16 0.36 0.19 0.00 -0.21 0.00 0.00 178.00 178.18 2c91 h LEU 183 N 0.68 0.58 -0.90 0.00 3.38 -0.44 -2.19 115.31 116.43 2c91 h LEU 183 Ca 0.17 -0.30 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 2c91 h LEU 183 Cb 0.22 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 40.76 2c91 h LEU 183 CO -0.01 0.99 0.51 0.03 0.09 0.00 0.00 178.44 180.06 2c91 h ARG 184 N 0.42 1.23 -0.49 1.13 -0.00 -1.05 0.89 114.38 116.51 2c91 h ARG 184 Ca 0.02 -0.13 -0.11 0.00 -0.50 0.00 0.00 59.98 59.26 2c91 h ARG 184 Cb 1.04 -0.25 -0.01 0.00 0.00 0.00 0.00 29.97 30.74 2c91 h ARG 184 CO 0.10 0.89 -0.13 1.25 0.00 0.00 0.00 179.97 182.08 2c91 h HIS 185 N 1.24 1.07 -0.01 3.04 2.76 -1.09 -3.28 115.15 118.89 2c91 h HIS 185 Ca 0.32 -0.23 0.00 0.00 -2.20 0.00 0.00 60.37 58.26 2c91 h HIS 185 Cb -0.01 -0.26 0.00 0.00 1.55 0.00 0.00 27.41 28.69 2c91 h HIS 185 CO 0.01 1.03 -0.27 1.19 -1.30 0.00 0.00 177.93 178.58 2c91 n PHE 186 N -4.20 0.00 -1.47 5.26 3.72 -0.85 -4.98 117.46 114.94 2c91 n PHE 186 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 2c91 n PHE 186 Cb 0.40 -0.07 0.00 0.00 -0.94 0.00 0.00 39.48 38.88 2c91 n PHE 186 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2c91 n GLY 187 N 1.34 0.93 3.83 1.37 0.00 0.09 -5.04 105.19 107.72 2c91 n GLY 187 Ca 0.12 -0.55 -0.36 0.00 0.00 0.00 0.00 46.02 45.23 2c91 n GLY 187 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2c91 s LEU 188 N -0.24 4.19 0.29 0.99 1.02 0.02 -4.82 118.68 120.14 2c91 s LEU 188 Ca 0.00 0.39 -0.07 0.00 0.02 0.00 0.00 54.13 54.47 2c91 s LEU 188 Cb 0.00 -2.03 -0.06 0.00 0.02 0.00 0.00 46.19 44.13 2c91 s LEU 188 CO 0.00 0.40 0.59 0.00 0.02 0.00 0.00 176.35 177.36 2c91 s ARG 189 N -1.02 3.70 -0.13 1.70 1.70 -0.53 -4.47 118.95 119.89 2c91 s ARG 189 Ca 0.15 0.15 0.01 0.00 -0.47 0.00 0.00 55.73 55.57 2c91 s ARG 189 Cb -0.12 -2.60 -0.01 0.00 -0.57 0.00 0.00 34.95 31.65 2c91 s ARG 189 CO 0.04 0.20 -0.17 0.12 -1.08 0.00 0.00 175.30 174.41 2c91 s PHE 190 N -2.06 2.74 -0.20 5.89 5.36 -1.26 -1.10 117.98 127.34 2c91 s PHE 190 Ca 0.46 -0.91 -0.03 0.00 -0.96 0.00 0.00 56.93 55.50 2c91 s PHE 190 Cb -0.11 -1.83 -0.01 0.00 -0.34 0.00 0.00 43.02 40.73 2c91 s PHE 190 CO 0.28 -0.37 -0.07 0.71 -1.46 0.00 0.00 175.22 174.31 2c91 s TYR 191 N 0.54 2.93 -0.22 10.12 1.51 -0.14 -1.36 117.35 130.72 2c91 s TYR 191 Ca -0.11 -0.90 -0.17 0.00 -1.01 0.00 0.00 57.07 54.88 2c91 s TYR 191 Cb -0.16 -2.04 -0.03 0.00 -0.11 0.00 0.00 41.96 39.61 2c91 s TYR 191 CO 0.04 -0.48 0.47 0.00 -1.11 0.00 0.00 175.55 174.47 2c91 s ALA 192 N 1.22 3.56 0.40 3.71 0.00 -0.32 -0.63 121.76 129.70 2c91 s ALA 192 Ca 0.02 -0.52 0.08 0.00 0.00 0.00 0.00 51.96 51.55 2c91 s ALA 192 Cb -0.14 -2.78 0.01 0.00 0.00 0.00 0.00 23.12 20.21 2c91 s ALA 192 CO -0.02 -0.49 0.54 1.52 0.00 0.00 0.00 175.76 177.31 2c91 s TYR 193 N 1.75 2.86 -1.43 0.00 -0.85 -0.18 -1.05 117.35 118.44 2c91 s TYR 193 Ca 0.21 -0.37 -0.10 0.00 -0.52 0.00 0.00 57.07 56.29 2c91 s TYR 193 Cb -0.15 -2.30 0.04 0.00 0.38 0.00 0.00 41.96 39.93 2c91 s TYR 193 CO 0.09 -0.33 1.04 0.09 -1.52 0.00 0.00 175.55 174.92 2c91 n ASN 194 N -1.80 -4.96 0.11 -0.18 5.03 -1.26 -2.33 115.26 109.88 2c91 n ASN 194 Ca 0.06 -0.68 0.10 0.00 0.87 0.00 0.00 54.58 54.94 2c91 n ASN 194 Cb 0.59 -4.41 0.46 0.00 -1.02 0.00 0.00 39.78 35.40 2c91 n ASN 194 CO 0.00 0.00 0.00 -0.81 -1.83 0.00 0.00 177.26 174.62 2c91 n PRO 195 N -4.75 0.15 -0.26 3.52 -0.04 -1.26 -1.52 135.00 130.84 2c91 n PRO 195 Ca -0.02 0.46 0.09 0.00 -0.04 0.00 0.00 63.50 63.99 2c91 n PRO 195 Cb 0.56 -1.83 0.20 0.00 -0.04 0.00 0.00 33.50 32.39 2c91 n PRO 195 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2c91 n LEU 196 N -2.11 3.13 -3.76 1.53 4.77 -1.26 -4.62 117.00 114.68 2c91 n LEU 196 Ca 0.01 -3.01 -0.24 0.00 -0.03 0.00 0.00 56.01 52.74 2c91 n LEU 196 Cb 0.16 -0.48 0.04 0.00 -2.33 0.00 0.00 43.42 40.81 2c91 n LEU 196 CO 0.15 0.69 0.01 0.00 -1.33 0.00 0.00 177.39 176.92 2c91 n ALA 197 N -0.91 -1.74 -1.07 -1.18 0.00 -0.57 -0.82 120.51 114.22 2c91 n ALA 197 Ca 0.18 -0.01 -0.02 0.00 0.00 0.00 0.00 53.44 53.59 2c91 n ALA 197 Cb 0.76 -2.99 -0.01 0.00 0.00 0.00 0.00 19.45 17.20 2c91 n ALA 197 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2c91 n GLY 198 N -1.62 0.49 0.00 0.00 0.00 -1.26 -2.38 105.19 100.41 2c91 n GLY 198 Ca -0.17 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.70 2c91 n GLY 198 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2c91 n GLY 199 N -1.32 1.94 0.36 -0.02 0.00 -0.47 -4.71 105.19 100.97 2c91 n GLY 199 Ca -0.02 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.03 2c91 n GLY 199 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2c91 h LEU 200 N 0.00 0.90 -0.45 0.99 5.85 -0.94 -1.39 115.31 120.27 2c91 h LEU 200 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2c91 h LEU 200 Cb 0.00 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 40.84 2c91 h LEU 200 CO 0.00 0.58 0.00 0.18 -0.34 0.00 0.00 178.44 178.86 2c91 n LEU 201 N -4.48 0.57 0.16 2.25 4.77 0.00 -1.82 117.00 118.45 2c91 n LEU 201 Ca 0.13 -0.29 0.13 0.00 -0.03 0.00 0.00 56.01 55.95 2c91 n LEU 201 Cb 0.19 -0.15 0.34 0.00 -2.33 0.00 0.00 43.42 41.47 2c91 n LEU 201 CO 0.33 0.13 0.86 0.71 -1.33 0.00 0.00 177.39 178.09 2c91 h THR 202 N 0.35 0.00 -0.13 -5.08 1.35 -1.46 -3.21 112.91 104.73 2c91 h THR 202 Ca 0.00 -0.65 -0.06 0.00 -0.55 0.00 0.00 66.41 65.15 2c91 h THR 202 Cb 0.21 1.64 -0.02 0.00 -1.73 0.00 0.00 68.15 68.24 2c91 h THR 202 CO 0.01 0.00 -0.05 0.61 -0.25 0.00 0.00 175.52 175.84 2c91 n GLY 203 N 1.10 0.51 0.00 5.82 0.00 -0.76 -4.05 105.19 107.81 2c91 n GLY 203 Ca 0.05 -0.16 0.12 0.00 0.00 0.00 0.00 46.02 46.03 2c91 n GLY 203 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2c91 n LYS 204 N -1.53 0.24 -4.46 1.61 2.85 -1.26 -4.85 118.16 110.76 2c91 n LYS 204 Ca -0.03 0.06 -0.29 0.00 -1.05 0.00 0.00 58.31 57.01 2c91 n LYS 204 Cb 0.27 -1.50 -0.07 0.00 -0.65 0.00 0.00 35.03 33.07 2c91 n LYS 204 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 177.40 178.06 2c91 s TYR 205 N -2.71 2.15 0.03 5.58 2.02 -1.26 -5.15 117.35 118.01 2c91 s TYR 205 Ca 0.20 -0.79 -0.05 0.00 -0.37 0.00 0.00 57.07 56.05 2c91 s TYR 205 Cb 0.16 -1.77 -0.01 0.00 -0.40 0.00 0.00 41.96 39.94 2c91 s TYR 205 CO 0.40 0.17 0.09 -1.59 -1.57 0.00 0.00 175.55 173.05 2c91 s LYS 206 N -3.90 0.56 0.32 -0.62 -2.85 -1.26 -5.05 119.74 106.94 2c91 s LYS 206 Ca 0.25 -0.71 0.08 0.00 -1.00 0.00 0.00 55.97 54.58 2c91 s LYS 206 Cb 0.04 0.22 0.78 0.00 -2.06 0.00 0.00 37.83 36.81 2c91 s LYS 206 CO 0.14 -0.14 1.80 -0.92 0.10 0.00 0.00 175.35 176.33 2c91 h TYR 207 N 3.77 0.98 -0.00 1.78 5.03 -1.98 -1.22 116.97 125.33 2c91 h TYR 207 Ca -0.32 0.03 0.00 0.00 2.58 0.00 0.00 58.73 61.02 2c91 h TYR 207 Cb 1.19 -0.30 0.00 0.00 1.55 0.00 0.00 36.73 39.17 2c91 h TYR 207 CO 0.55 0.25 -0.05 -0.85 -1.32 0.00 0.00 178.16 176.75 2c91 n GLU 208 N -4.69 0.59 0.13 1.82 0.00 -1.26 -2.83 120.64 114.40 2c91 n GLU 208 Ca 0.22 -0.10 0.19 0.00 0.00 0.00 0.00 57.16 57.47 2c91 n GLU 208 Cb 0.56 -1.50 0.72 0.00 0.00 0.00 0.00 31.44 31.23 2c91 n GLU 208 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.13 176.69 2c91 h ASP 209 N 0.24 0.00 0.58 -1.84 3.32 -1.61 -1.22 116.42 115.89 2c91 h ASP 209 Ca 0.00 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 56.98 2c91 h ASP 209 Cb 0.29 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.83 2c91 h ASP 209 CO 0.00 0.00 -0.34 0.07 -1.72 0.00 0.00 179.24 177.25 2c91 h LYS 210 N 0.00 0.00 0.00 3.56 2.10 -1.73 -0.04 116.57 120.45 2c91 h LYS 210 Ca 0.17 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.80 2c91 h LYS 210 Cb 1.15 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.47 2c91 h LYS 210 CO -0.00 0.34 -1.52 -0.25 -2.00 0.00 0.00 179.45 176.02 2c91 n ASP 211 N -3.75 0.44 0.00 7.07 8.00 -0.51 -4.81 116.55 122.99 2c91 n ASP 211 Ca -0.01 0.17 0.00 0.00 0.71 0.00 0.00 54.79 55.66 2c91 n ASP 211 Cb 0.43 1.14 0.00 0.00 -0.02 0.00 0.00 41.12 42.67 2c91 n ASP 211 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2c91 n GLY 212 N 1.25 0.82 0.27 0.44 0.00 -0.93 -4.93 105.19 102.11 2c91 n GLY 212 Ca -0.03 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.02 2c91 n GLY 212 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2c91 h LYS 213 N 0.00 0.52 -6.40 1.61 1.57 -1.80 -3.47 116.57 108.61 2c91 h LYS 213 Ca 0.00 -0.03 -0.48 0.00 -1.87 0.00 0.00 60.65 58.27 2c91 h LYS 213 Cb 0.00 -0.12 0.01 0.00 0.08 0.00 0.00 32.23 32.20 2c91 h LYS 213 CO 0.00 0.35 -0.92 1.04 -0.57 0.00 0.00 179.45 179.35 2c91 n GLN 214 N -4.92 -2.26 -1.89 3.15 6.02 -0.04 -4.82 117.38 112.62 2c91 n GLN 214 Ca 0.12 0.41 -0.42 0.00 -0.01 0.00 0.00 57.00 57.10 2c91 n GLN 214 Cb 0.33 -4.24 -0.03 0.00 1.02 0.00 0.00 30.24 27.32 2c91 n GLN 214 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 2c91 s PRO 215 N -6.35 4.19 0.31 -1.09 0.04 -1.26 -4.88 135.00 125.96 2c91 s PRO 215 Ca 0.24 2.39 -0.29 0.00 0.04 0.00 0.00 61.00 63.38 2c91 s PRO 215 Cb -0.09 -3.41 -0.13 0.00 0.04 0.00 0.00 34.50 30.91 2c91 s PRO 215 CO 0.88 -0.70 1.34 0.28 0.04 0.00 0.00 177.00 178.84 2c91 n VAL 216 N 4.42 1.64 -1.87 -0.36 0.31 -1.26 -4.18 118.33 117.03 2c91 n VAL 216 Ca 0.15 -0.41 0.00 0.00 -0.01 0.00 0.00 64.34 64.07 2c91 n VAL 216 Cb 0.39 -1.57 0.00 0.00 -0.91 0.00 0.00 33.84 31.75 2c91 n VAL 216 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2c91 n GLY 217 N 1.25 -0.01 0.33 2.92 0.00 -1.03 -4.92 105.19 103.74 2c91 n GLY 217 Ca 0.07 -1.29 0.16 0.00 0.00 0.00 0.00 46.02 44.96 2c91 n GLY 217 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2c91 h ARG 218 N 0.00 0.50 -0.01 1.61 9.65 -1.87 -2.53 114.38 121.73 2c91 h ARG 218 Ca 0.00 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.85 2c91 h ARG 218 Cb 0.00 -0.11 0.00 0.00 -1.39 0.00 0.00 29.97 28.47 2c91 h ARG 218 CO 0.00 0.33 -0.47 1.19 2.80 0.00 0.00 179.97 183.82 2c91 n PHE 219 N -4.94 0.00 -3.69 2.20 3.01 -1.26 -4.26 117.46 108.52 2c91 n PHE 219 Ca 0.25 0.00 -0.13 0.00 1.01 0.00 0.00 57.45 58.58 2c91 n PHE 219 Cb 0.71 -0.01 -0.13 0.00 -0.01 0.00 0.00 39.48 40.03 2c91 n PHE 219 CO 0.00 0.00 0.00 -0.06 1.01 0.00 0.00 176.76 177.71 2c91 s PHE 220 N -2.49 -0.37 0.00 1.38 0.08 -0.95 -4.71 117.98 110.92 2c91 s PHE 220 Ca 0.19 0.87 0.00 0.00 0.12 0.00 0.00 56.93 58.10 2c91 s PHE 220 Cb 0.18 -0.01 0.00 0.00 -0.57 0.00 0.00 43.02 42.62 2c91 s PHE 220 CO 0.57 -0.30 0.00 0.41 -0.10 0.00 0.00 175.22 175.81 2c91 n GLY 221 N 4.85 0.50 3.61 4.36 0.00 -1.26 -2.45 105.19 114.79 2c91 n GLY 221 Ca -0.15 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.60 2c91 n GLY 221 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2c91 s ASN 222 N -2.00 3.52 0.48 1.61 2.20 -1.26 -5.05 114.94 114.43 2c91 s ASN 222 Ca 0.00 -1.46 0.27 0.00 -0.94 0.00 0.00 52.86 50.73 2c91 s ASN 222 Cb 0.00 -0.05 0.93 0.00 -2.00 0.00 0.00 41.25 40.13 2c91 s ASN 222 CO 0.00 -0.61 1.82 0.78 -2.94 0.00 0.00 177.10 176.15 2c91 h ASN 223 N 1.75 0.00 -0.03 3.54 2.35 -1.97 -2.19 115.58 119.04 2c91 h ASN 223 Ca -0.43 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.32 2c91 h ASN 223 Cb 1.26 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.63 2c91 h ASN 223 CO 0.75 0.11 0.00 0.79 -1.65 0.00 0.00 177.43 177.43 2c91 n TRP 224 N -3.20 0.00 -0.19 1.19 7.02 -1.26 -4.63 117.44 116.38 2c91 n TRP 224 Ca 0.01 -0.00 -0.04 0.00 -1.02 0.00 0.00 57.50 56.45 2c91 n TRP 224 Cb 0.42 0.00 0.06 0.00 -2.42 0.00 0.00 31.31 29.37 2c91 n TRP 224 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2c91 h ALA 225 N 4.53 0.72 -0.73 6.99 0.00 -1.57 -1.76 119.26 127.43 2c91 h ALA 225 Ca 0.00 0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 2c91 h ALA 225 Cb 0.75 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.39 2c91 h ALA 225 CO 0.00 -0.00 0.29 1.49 0.00 0.00 0.00 179.25 181.03 2c91 h GLU 226 N 0.60 1.08 -0.44 0.00 4.57 -1.82 0.19 114.58 118.76 2c91 h GLU 226 Ca 0.24 -0.19 0.00 0.00 -1.18 0.00 0.00 59.36 58.23 2c91 h GLU 226 Cb 0.09 -0.18 -0.02 0.00 -0.16 0.00 0.00 28.75 28.48 2c91 h GLU 226 CO -0.13 0.88 0.29 1.15 -1.18 0.00 0.00 179.01 180.02 2c91 h THR 227 N 1.06 1.11 -0.53 0.32 2.02 -1.68 -0.95 112.91 114.25 2c91 h THR 227 Ca 0.24 -0.21 -0.04 0.00 0.77 0.00 0.00 66.41 67.18 2c91 h THR 227 Cb 0.20 0.46 -0.02 0.00 -1.74 0.00 0.00 68.15 67.05 2c91 h THR 227 CO -0.02 0.11 0.19 1.88 0.37 0.00 0.00 175.52 178.05 2c91 h TYR 228 N 0.60 0.83 -0.60 3.16 -1.99 -0.73 -1.05 116.97 117.19 2c91 h TYR 228 Ca 0.16 -0.07 -0.05 0.00 2.00 0.00 0.00 58.73 60.77 2c91 h TYR 228 Cb -0.07 -0.25 -0.03 0.00 2.00 0.00 0.00 36.73 38.39 2c91 h TYR 228 CO -0.05 0.69 0.17 0.00 -0.00 0.00 0.00 178.16 178.98 2c91 h ARG 229 N 0.73 0.94 -0.67 4.88 3.08 -0.47 -1.17 114.38 121.70 2c91 h ARG 229 Ca 0.18 -0.21 0.02 0.00 0.07 0.00 0.00 59.98 60.03 2c91 h ARG 229 Cb 0.23 -0.13 -0.04 0.00 0.08 0.00 0.00 29.97 30.11 2c91 h ARG 229 CO -0.01 0.85 0.45 -0.91 -1.07 0.00 0.00 179.97 179.27 2c91 h ASN 230 N 0.86 0.74 -0.05 7.04 2.35 -1.06 0.28 115.58 125.73 2c91 h ASN 230 Ca 0.19 -0.01 -0.03 0.00 -0.55 0.00 0.00 56.30 55.89 2c91 h ASN 230 Cb 0.31 -0.18 0.00 0.00 0.05 0.00 0.00 38.32 38.50 2c91 h ASN 230 CO -0.00 0.52 -0.10 -0.09 -1.65 0.00 0.00 177.43 176.11 2c91 h ARG 231 N 0.86 0.16 0.00 0.81 2.43 -0.59 -3.42 114.38 114.64 2c91 h ARG 231 Ca 0.26 -0.10 0.00 0.00 -0.81 0.00 0.00 59.98 59.33 2c91 h ARG 231 Cb -0.03 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.54 2c91 h ARG 231 CO -0.06 0.67 -0.63 1.19 -1.51 0.00 0.00 179.97 179.63 2c91 n PHE 232 N -4.68 0.00 -2.87 2.20 0.99 -0.50 -4.40 117.46 108.21 2c91 n PHE 232 Ca -0.08 0.00 -0.44 0.00 -0.00 0.00 0.00 57.45 56.93 2c91 n PHE 232 Cb 0.34 0.00 -0.00 0.00 -1.00 0.00 0.00 39.48 38.82 2c91 n PHE 232 CO 0.00 0.00 0.00 -0.46 -0.00 0.00 0.00 176.76 176.30 2c91 s TRP 233 N -1.42 3.33 0.02 1.38 -0.11 0.08 -4.83 118.94 117.40 2c91 s TRP 233 Ca 0.00 -2.00 0.04 0.00 1.22 0.00 0.00 56.10 55.36 2c91 s TRP 233 Cb 0.00 -4.41 -0.02 0.00 -1.50 0.00 0.00 33.47 27.54 2c91 s TRP 233 CO 0.00 -1.49 -0.12 0.15 -4.62 0.00 0.00 176.95 170.87 2c91 s LYS 234 N 2.20 0.85 0.17 5.86 1.02 -1.26 -4.83 119.74 123.75 2c91 s LYS 234 Ca 0.45 -0.60 -0.15 0.00 0.02 0.00 0.00 55.97 55.69 2c91 s LYS 234 Cb -0.01 -0.83 0.13 0.00 -0.52 0.00 0.00 37.83 36.60 2c91 s LYS 234 CO 0.01 0.21 1.69 0.93 -0.92 0.00 0.00 175.35 177.28 2c91 h GLU 235 N 5.29 0.10 -0.16 1.68 5.08 -1.98 -1.29 114.58 123.29 2c91 h GLU 235 Ca -0.35 -0.01 0.05 0.00 -1.00 0.00 0.00 59.36 58.05 2c91 h GLU 235 Cb 1.18 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.40 2c91 h GLU 235 CO 0.46 0.07 0.12 0.45 -1.00 0.00 0.00 179.01 179.10 2c91 h HIS 236 N 0.10 0.01 -0.22 4.33 3.86 -1.97 -1.03 115.15 120.23 2c91 h HIS 236 Ca 0.21 0.00 -0.16 0.00 -1.16 0.00 0.00 60.37 59.26 2c91 h HIS 236 Cb 0.30 -0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.77 2c91 h HIS 236 CO -0.28 0.00 -0.48 1.25 0.86 0.00 0.00 177.93 179.28 2c91 h HIS 237 N 0.01 0.91 -0.51 2.45 -0.00 -1.58 -0.61 115.15 115.80 2c91 h HIS 237 Ca 0.08 -0.34 0.01 0.00 -0.00 0.00 0.00 60.37 60.12 2c91 h HIS 237 Cb 0.30 -0.16 -0.03 0.00 -0.00 0.00 0.00 27.41 27.52 2c91 h HIS 237 CO -0.00 1.13 0.33 0.74 -0.00 0.00 0.00 177.93 180.13 2c91 h PHE 238 N 0.43 0.63 -0.55 5.26 -1.00 -0.76 -1.10 116.94 119.84 2c91 h PHE 238 Ca 0.00 0.02 0.06 0.00 2.81 0.00 0.00 57.97 60.86 2c91 h PHE 238 Cb 1.09 -0.21 -0.05 0.00 3.61 0.00 0.00 35.95 40.39 2c91 h PHE 238 CO 0.09 0.38 0.26 0.93 -1.61 0.00 0.00 178.31 178.36 2c91 h GLU 239 N 0.67 0.48 -0.82 1.51 5.08 -1.12 -0.82 114.58 119.56 2c91 h GLU 239 Ca 0.19 -0.03 0.01 0.00 -1.00 0.00 0.00 59.36 58.53 2c91 h GLU 239 Cb -0.05 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 29.05 2c91 h GLU 239 CO -0.06 0.32 0.53 0.00 -1.00 0.00 0.00 179.01 178.81 2c91 h ALA 240 N 1.32 1.05 -0.62 3.43 0.00 -0.83 -1.44 119.26 122.17 2c91 h ALA 240 Ca 0.25 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 55.02 2c91 h ALA 240 Cb 0.20 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 2c91 h ALA 240 CO -0.20 0.47 0.10 0.82 0.00 0.00 0.00 179.25 180.44 2c91 h ILE 241 N 1.12 1.26 -0.95 0.00 2.04 -0.56 -2.37 117.51 118.05 2c91 h ILE 241 Ca 0.30 -1.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.15 2c91 h ILE 241 Cb -0.11 0.71 -0.05 0.00 -0.74 0.00 0.00 36.82 36.64 2c91 h ILE 241 CO -0.06 0.37 0.58 0.00 0.00 0.00 0.00 178.15 179.04 2c91 h ALA 242 N 1.02 1.22 -0.29 1.87 0.00 -0.83 -0.23 119.26 122.03 2c91 h ALA 242 Ca 0.19 -0.10 0.06 0.00 0.00 0.00 0.00 54.91 55.05 2c91 h ALA 242 Cb 0.43 -0.38 -0.05 0.00 0.00 0.00 0.00 17.79 17.78 2c91 h ALA 242 CO 0.01 0.67 -0.05 1.25 0.00 0.00 0.00 179.25 181.13 2c91 h LEU 243 N 1.31 -0.22 -0.61 0.00 7.12 -0.85 -1.18 115.31 120.88 2c91 h LEU 243 Ca 0.34 0.08 -0.12 0.00 0.13 0.00 0.00 57.88 58.31 2c91 h LEU 243 Cb -0.06 0.16 -0.01 0.00 -0.53 0.00 0.00 40.66 40.21 2c91 h LEU 243 CO -0.07 -0.07 -0.19 0.58 -0.13 0.00 0.00 178.44 178.56 2c91 h VAL 244 N 0.03 1.27 -0.89 1.05 2.07 -1.00 -2.21 116.25 116.58 2c91 h VAL 244 Ca 0.14 -1.33 0.01 0.00 0.82 0.00 0.00 66.70 66.34 2c91 h VAL 244 Cb 0.21 1.13 -0.04 0.00 -1.52 0.00 0.00 31.29 31.06 2c91 h VAL 244 CO -0.28 0.45 0.59 -0.33 0.02 0.00 0.00 177.57 178.02 2c91 h GLU 245 N 0.78 1.17 -0.33 1.57 4.39 -0.62 -0.53 114.58 121.00 2c91 h GLU 245 Ca 0.11 -0.07 -0.13 0.00 0.34 0.00 0.00 59.36 59.61 2c91 h GLU 245 Cb 0.74 -0.26 -0.01 0.00 -0.10 0.00 0.00 28.75 29.11 2c91 h GLU 245 CO 0.06 0.77 -0.31 -0.22 -1.16 0.00 0.00 179.01 178.15 2c91 h LYS 246 N 1.20 0.71 -0.06 2.33 3.64 -1.04 -2.41 116.57 120.95 2c91 h LYS 246 Ca 0.32 -0.32 -0.13 0.00 -1.27 0.00 0.00 60.65 59.25 2c91 h LYS 246 Cb -0.14 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.66 2c91 h LYS 246 CO -0.07 0.93 -0.54 0.00 -2.27 0.00 0.00 179.45 177.50 2c91 h ALA 247 N 1.05 0.98 -0.22 5.00 0.00 -0.75 -1.20 119.26 124.12 2c91 h ALA 247 Ca 0.07 -0.50 -0.02 0.00 0.00 0.00 0.00 54.91 54.46 2c91 h ALA 247 Cb 0.83 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 2c91 h ALA 247 CO 0.07 0.68 0.04 -0.07 0.00 0.00 0.00 179.25 179.97 2c91 h LEU 248 N 0.14 0.34 -0.28 0.00 3.38 -0.96 -1.39 115.31 116.54 2c91 h LEU 248 Ca 0.00 -0.25 -0.01 0.00 0.09 0.00 0.00 57.88 57.71 2c91 h LEU 248 Cb 1.00 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.64 2c91 h LEU 248 CO 0.08 0.51 0.14 -0.61 0.09 0.00 0.00 178.44 178.64 2c91 h GLN 249 N 0.17 0.40 -0.40 1.13 5.75 -1.27 -0.75 115.11 120.13 2c91 h GLN 249 Ca 0.07 -0.06 -0.01 0.00 -0.15 0.00 0.00 58.65 58.49 2c91 h GLN 249 Cb 0.31 -0.07 -0.02 0.00 1.07 0.00 0.00 27.48 28.76 2c91 h GLN 249 CO 0.00 0.39 0.20 1.15 -2.65 0.00 0.00 178.83 177.92 2c91 h THR 250 N 0.32 1.17 0.00 2.39 2.02 -1.23 0.07 112.91 117.65 2c91 h THR 250 Ca 0.10 -0.48 -0.25 0.00 0.77 0.00 0.00 66.41 66.55 2c91 h THR 250 Cb 0.12 0.75 0.01 0.00 -1.74 0.00 0.00 68.15 67.28 2c91 h THR 250 CO -0.01 0.18 -1.00 0.74 0.37 0.00 0.00 175.52 175.80 2c91 h THR 251 N 0.51 1.34 0.00 3.16 2.02 -1.15 -3.39 112.91 115.40 2c91 h THR 251 Ca 0.14 -2.35 0.00 0.00 0.77 0.00 0.00 66.41 64.96 2c91 h THR 251 Cb 0.11 2.41 0.00 0.00 -1.74 0.00 0.00 68.15 68.92 2c91 h THR 251 CO -0.02 0.72 -0.91 -1.22 0.37 0.00 0.00 175.52 174.45 2c91 n TYR 252 N -3.80 0.00 -0.57 3.16 4.01 -0.30 -5.09 117.16 114.58 2c91 n TYR 252 Ca -0.09 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.65 2c91 n TYR 252 Cb 0.86 -0.05 0.00 0.00 -0.31 0.00 0.00 39.34 39.84 2c91 n TYR 252 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2c91 n GLY 253 N 2.05 2.48 0.26 2.72 0.00 0.01 -2.40 105.19 110.32 2c91 n GLY 253 Ca -0.00 -0.33 0.14 0.00 0.00 0.00 0.00 46.02 45.83 2c91 n GLY 253 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c91 h THR 254 N 0.00 0.46 -0.19 2.61 1.03 -1.94 -2.61 112.91 112.27 2c91 h THR 254 Ca 0.00 -0.58 0.00 0.00 -0.01 0.00 0.00 66.41 65.82 2c91 h THR 254 Cb 0.00 1.40 0.00 0.00 -1.07 0.00 0.00 68.15 68.48 2c91 h THR 254 CO 0.00 0.11 0.00 0.59 -0.01 0.00 0.00 175.52 176.21 2c91 n ASN 255 N -3.50 1.81 -4.73 0.00 3.02 -1.01 -4.97 115.26 105.88 2c91 n ASN 255 Ca -0.01 -2.14 -0.41 0.00 -0.03 0.00 0.00 54.58 51.98 2c91 n ASN 255 Cb 0.26 -0.36 -0.03 0.00 -0.61 0.00 0.00 39.78 39.04 2c91 n ASN 255 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2c91 s ALA 256 N -1.61 3.54 0.70 5.41 0.00 -0.98 -4.96 121.76 123.86 2c91 s ALA 256 Ca 0.15 1.11 -0.15 0.00 0.00 0.00 0.00 51.96 53.08 2c91 s ALA 256 Cb 0.10 -3.50 0.02 0.00 0.00 0.00 0.00 23.12 19.75 2c91 s ALA 256 CO 0.07 -0.56 1.15 -1.25 0.00 0.00 0.00 175.76 175.17 2c91 s PRO 257 N 0.15 2.42 0.59 0.00 0.04 -1.26 -4.99 135.00 131.96 2c91 s PRO 257 Ca 0.58 1.54 -0.19 0.00 0.04 0.00 0.00 61.00 62.98 2c91 s PRO 257 Cb -0.37 -1.89 -0.03 0.00 0.04 0.00 0.00 34.50 32.25 2c91 s PRO 257 CO 0.37 -1.57 1.24 1.03 0.04 0.00 0.00 177.00 178.11 2c91 s ARG 258 N -4.07 2.94 0.28 4.56 0.52 -1.26 -4.83 118.95 117.10 2c91 s ARG 258 Ca 0.70 1.92 0.01 0.00 -0.52 0.00 0.00 55.73 57.84 2c91 s ARG 258 Cb -0.24 -1.97 0.53 0.00 0.52 0.00 0.00 34.95 33.79 2c91 s ARG 258 CO 0.44 -1.26 1.86 1.98 0.02 0.00 0.00 175.30 178.35 2c91 h MET 259 N 0.94 1.00 -0.42 3.54 1.85 -1.87 0.06 114.93 120.03 2c91 h MET 259 Ca -0.51 -0.06 0.08 0.00 -0.61 0.00 0.00 59.70 58.60 2c91 h MET 259 Cb 1.30 -0.23 -0.07 0.00 0.43 0.00 0.00 31.60 33.04 2c91 h MET 259 CO 0.55 0.66 -0.03 1.15 -0.40 0.00 0.00 176.91 178.85 2c91 h THR 260 N 1.03 0.65 -0.46 -0.77 2.02 -1.69 -0.36 112.91 113.33 2c91 h THR 260 Ca 0.47 -0.03 -0.14 0.00 0.77 0.00 0.00 66.41 67.48 2c91 h THR 260 Cb 0.39 0.57 -0.01 0.00 -1.74 0.00 0.00 68.15 67.36 2c91 h THR 260 CO -0.23 0.01 -0.26 -1.28 0.37 0.00 0.00 175.52 174.14 2c91 h SER 261 N 0.08 1.02 -0.33 4.18 0.87 -1.39 -2.14 113.55 115.84 2c91 h SER 261 Ca 0.21 -0.42 0.00 0.00 -1.23 0.00 0.00 61.79 60.35 2c91 h SER 261 Cb 0.30 -0.28 -0.02 0.00 -0.44 0.00 0.00 62.40 61.96 2c91 h SER 261 CO -0.37 1.22 0.22 0.00 -0.53 0.00 0.00 176.83 177.37 2c91 h ALA 262 N 0.84 0.42 -0.74 6.23 0.00 -0.92 -0.75 119.26 124.34 2c91 h ALA 262 Ca 0.10 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 2c91 h ALA 262 Cb 0.85 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.47 2c91 h ALA 262 CO 0.08 -0.11 0.41 0.00 0.00 0.00 0.00 179.25 179.62 2c91 h ALA 263 N 1.12 0.95 -0.17 0.00 0.00 -0.88 -0.53 119.26 119.74 2c91 h ALA 263 Ca 0.12 -0.12 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 2c91 h ALA 263 Cb -0.05 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.44 2c91 h ALA 263 CO -0.03 0.46 -0.18 -0.07 0.00 0.00 0.00 179.25 179.44 2c91 h LEU 264 N 1.02 0.46 -1.74 0.00 3.38 -1.31 -2.98 115.31 114.14 2c91 h LEU 264 Ca 0.26 -0.48 0.03 0.00 0.09 0.00 0.00 57.88 57.78 2c91 h LEU 264 Cb 0.03 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 2c91 h LEU 264 CO -0.04 0.85 0.22 0.03 0.09 0.00 0.00 178.44 179.59 2c91 h ARG 265 N 0.08 0.33 -0.54 1.13 3.08 -1.05 0.97 114.38 118.37 2c91 h ARG 265 Ca 0.03 -0.02 0.07 0.00 0.07 0.00 0.00 59.98 60.12 2c91 h ARG 265 Cb 0.72 -0.07 -0.06 0.00 0.08 0.00 0.00 29.97 30.64 2c91 h ARG 265 CO 0.04 0.22 0.23 2.35 -1.07 0.00 0.00 179.97 181.75 2c91 h TRP 266 N 0.34 0.42 -0.33 3.04 7.01 -1.03 -1.09 115.95 124.31 2c91 h TRP 266 Ca 0.13 0.02 0.02 0.00 2.11 0.00 0.00 58.89 61.18 2c91 h TRP 266 Cb 0.12 -0.11 -0.02 0.00 -2.10 0.00 0.00 29.16 27.05 2c91 h TRP 266 CO -0.00 0.16 0.18 0.52 -2.79 0.00 0.00 178.44 176.51 2c91 h MET 267 N 0.44 0.37 0.00 2.65 2.86 -0.68 0.18 114.93 120.76 2c91 h MET 267 Ca 0.26 -0.02 -0.13 0.00 -2.06 0.00 0.00 59.70 57.74 2c91 h MET 267 Cb 0.24 -0.08 -0.02 0.00 0.06 0.00 0.00 31.60 31.80 2c91 h MET 267 CO -0.23 0.24 -0.62 1.88 1.06 0.00 0.00 176.91 179.25 2c91 h TYR 268 N 0.38 0.00 0.00 -0.22 -1.99 -1.23 -3.35 116.97 110.55 2c91 h TYR 268 Ca 0.13 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.84 2c91 h TYR 268 Cb 0.02 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 38.74 2c91 h TYR 268 CO -0.08 0.62 -1.12 0.72 -0.00 0.00 0.00 178.16 178.30 2c91 n HIS 269 N -3.42 0.00 -0.50 4.88 8.25 -0.43 -4.38 115.22 119.61 2c91 n HIS 269 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2c91 n HIS 269 Cb 0.71 -0.08 0.00 0.00 1.12 0.00 0.00 29.99 31.75 2c91 n HIS 269 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2c91 n HIS 270 N -1.88 0.00 -2.67 4.41 8.25 0.50 -5.05 115.22 118.78 2c91 n HIS 270 Ca -0.02 -0.16 -0.23 0.00 -0.26 0.00 0.00 57.72 57.05 2c91 n HIS 270 Cb 0.37 -0.02 0.11 0.00 1.12 0.00 0.00 29.99 31.58 2c91 n HIS 270 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 2c91 s SER 271 N -0.32 4.31 0.00 0.41 1.04 -0.37 -4.95 113.70 113.82 2c91 s SER 271 Ca 0.00 -0.54 0.17 0.00 0.48 0.00 0.00 55.95 56.06 2c91 s SER 271 Cb 0.00 0.23 0.67 0.00 0.10 0.00 0.00 66.02 67.01 2c91 s SER 271 CO 0.00 -1.90 1.48 0.00 0.98 0.00 0.00 173.24 173.79 2c91 n GLN 272 N -2.81 1.57 -2.01 4.02 6.02 -1.26 -4.87 117.38 118.04 2c91 n GLN 272 Ca 0.17 -0.86 -0.41 0.00 -0.01 0.00 0.00 57.00 55.88 2c91 n GLN 272 Cb 0.61 -1.32 -0.02 0.00 1.02 0.00 0.00 30.24 30.53 2c91 n GLN 272 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2c91 s LEU 273 N -1.41 4.39 -0.27 1.08 1.43 -1.26 -5.01 118.68 117.62 2c91 s LEU 273 Ca 0.27 2.71 0.02 0.00 -1.03 0.00 0.00 54.13 56.11 2c91 s LEU 273 Cb 0.14 -3.63 0.06 0.00 0.03 0.00 0.00 46.19 42.79 2c91 s LEU 273 CO 0.21 -0.69 -0.08 -1.10 0.23 0.00 0.00 176.35 174.92 2c91 s GLN 274 N -0.77 2.22 0.38 1.70 -0.21 -1.26 -4.82 119.66 116.89 2c91 s GLN 274 Ca 0.57 -1.37 0.12 0.00 0.02 0.00 0.00 55.36 54.69 2c91 s GLN 274 Cb -0.42 -2.95 0.91 0.00 1.00 0.00 0.00 33.01 31.55 2c91 s GLN 274 CO 0.47 -0.60 1.88 0.78 -2.12 0.00 0.00 175.29 175.70 2c91 h GLY 275 N 7.79 1.04 2.00 3.09 0.00 -1.75 -1.25 103.07 113.99 2c91 h GLY 275 Ca -0.18 -0.26 -0.02 0.00 0.00 0.00 0.00 47.33 46.87 2c91 h GLY 275 CO 0.47 0.07 -0.11 -0.91 0.00 0.00 0.00 176.54 176.06 2c91 h THR 276 N 0.59 0.40 -0.00 4.70 1.35 -1.87 -1.15 112.91 116.92 2c91 h THR 276 Ca 0.43 -0.64 0.00 0.00 -0.55 0.00 0.00 66.41 65.65 2c91 h THR 276 Cb 0.80 1.46 0.00 0.00 -1.73 0.00 0.00 68.15 68.68 2c91 h THR 276 CO -0.18 0.11 -0.08 0.54 -0.25 0.00 0.00 175.52 175.66 2c91 n ARG 277 N -3.41 0.82 -0.58 4.72 1.74 -0.49 -4.92 116.66 114.54 2c91 n ARG 277 Ca -0.01 -0.27 0.00 0.00 -0.77 0.00 0.00 57.85 56.80 2c91 n ARG 277 Cb 0.29 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.23 2c91 n ARG 277 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2c91 n GLY 278 N 1.23 0.75 3.73 -0.13 0.00 -0.43 -4.60 105.19 105.74 2c91 n GLY 278 Ca 0.16 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.83 2c91 n GLY 278 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2c91 s ASP 279 N -2.46 4.54 0.10 1.61 1.01 -1.09 -4.68 116.67 115.69 2c91 s ASP 279 Ca 0.00 2.40 -0.13 0.00 0.71 0.00 0.00 52.55 55.53 2c91 s ASP 279 Cb 0.00 -2.59 0.02 0.00 1.01 0.00 0.00 42.92 41.35 2c91 s ASP 279 CO 0.00 -2.03 0.31 0.00 0.21 0.00 0.00 175.17 173.65 2c91 s ALA 280 N -1.81 -0.62 -0.19 5.23 0.00 -0.47 -1.64 121.76 122.27 2c91 s ALA 280 Ca 0.76 -0.25 -0.05 0.00 0.00 0.00 0.00 51.96 52.41 2c91 s ALA 280 Cb -0.31 0.55 -0.03 0.00 0.00 0.00 0.00 23.12 23.34 2c91 s ALA 280 CO 0.41 -0.55 0.01 0.08 0.00 0.00 0.00 175.76 175.71 2c91 s VAL 281 N -3.62 4.19 -0.52 0.00 1.01 0.24 -1.18 120.40 120.51 2c91 s VAL 281 Ca 0.02 -0.24 -0.20 0.00 0.00 0.00 0.00 61.98 61.56 2c91 s VAL 281 Cb 0.03 -2.88 0.06 0.00 0.00 0.00 0.00 36.38 33.58 2c91 s VAL 281 CO -0.10 0.45 0.71 -0.63 0.00 0.00 0.00 175.10 175.53 2c91 s ILE 282 N 0.69 4.74 0.47 2.22 1.01 -0.22 -1.15 121.20 128.97 2c91 s ILE 282 Ca 0.01 -0.32 -0.23 0.00 0.00 0.00 0.00 60.65 60.10 2c91 s ILE 282 Cb -0.14 -4.38 -0.07 0.00 0.01 0.00 0.00 42.46 37.88 2c91 s ILE 282 CO 0.02 -0.91 1.19 -0.76 0.00 0.00 0.00 174.94 174.48 2c91 s LEU 283 N 2.99 4.00 0.22 2.97 1.43 -0.02 -4.54 118.68 125.72 2c91 s LEU 283 Ca 0.19 2.36 0.11 0.00 -1.03 0.00 0.00 54.13 55.76 2c91 s LEU 283 Cb -0.18 -4.24 -0.05 0.00 0.03 0.00 0.00 46.19 41.76 2c91 s LEU 283 CO 0.13 -0.98 -0.22 -0.83 0.23 0.00 0.00 176.35 174.69 2c91 s GLY 284 N -1.31 1.72 -0.06 -3.19 0.00 -1.26 -0.86 107.32 102.36 2c91 s GLY 284 Ca 0.64 -1.70 -0.30 0.00 0.00 0.00 0.00 44.72 43.37 2c91 s GLY 284 CO 0.36 -1.75 0.92 -3.16 0.00 0.00 0.00 173.10 169.47 2c91 s MET 285 N -3.00 0.74 0.00 2.90 0.23 -1.26 -4.75 119.30 114.17 2c91 s MET 285 Ca 0.23 -0.11 0.05 0.00 -1.03 0.00 0.00 55.69 54.83 2c91 s MET 285 Cb -0.06 0.35 0.09 0.00 -1.53 0.00 0.00 34.83 33.67 2c91 s MET 285 CO 0.11 -0.29 0.89 -1.13 -2.03 0.00 0.00 175.02 172.56 2c91 n SER 286 N 0.16 1.92 -3.67 -1.18 3.41 -1.26 -4.54 113.62 108.46 2c91 n SER 286 Ca -0.10 -1.60 -0.10 0.00 -0.26 0.00 0.00 58.87 56.82 2c91 n SER 286 Cb 0.60 -0.05 -0.04 0.00 -0.26 0.00 0.00 64.21 64.45 2c91 n SER 286 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2c91 s SER 287 N -0.71 -0.23 0.20 4.04 1.04 -1.26 -4.36 113.70 112.42 2c91 s SER 287 Ca 0.08 -0.37 -0.08 0.00 0.48 0.00 0.00 55.95 56.06 2c91 s SER 287 Cb 0.05 0.50 0.13 0.00 0.10 0.00 0.00 66.02 66.79 2c91 s SER 287 CO 0.07 -0.90 1.74 0.25 0.98 0.00 0.00 173.24 175.38 2c91 h LEU 288 N 2.33 1.08 -0.34 2.42 5.85 -1.97 -2.50 115.31 122.18 2c91 h LEU 288 Ca -0.33 -0.21 0.04 0.00 0.84 0.00 0.00 57.88 58.22 2c91 h LEU 288 Cb 1.26 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 41.97 2c91 h LEU 288 CO 0.45 1.00 0.12 -0.08 -0.34 0.00 0.00 178.44 179.59 2c91 h GLU 289 N 1.10 0.25 -0.25 1.25 4.81 -1.99 -0.39 114.58 119.37 2c91 h GLU 289 Ca 0.24 -0.02 0.02 0.00 -0.13 0.00 0.00 59.36 59.47 2c91 h GLU 289 Cb 0.31 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.61 2c91 h GLU 289 CO -0.01 0.17 0.12 1.96 -0.73 0.00 0.00 179.01 180.52 2c91 h GLN 290 N 0.26 0.25 -0.89 1.92 4.20 -1.96 -2.02 115.11 116.87 2c91 h GLN 290 Ca 0.16 -0.01 0.01 0.00 0.06 0.00 0.00 58.65 58.86 2c91 h GLN 290 Cb 0.13 -0.06 -0.04 0.00 0.30 0.00 0.00 27.48 27.81 2c91 h GLN 290 CO -0.16 0.16 0.58 1.25 -0.67 0.00 0.00 178.83 180.00 2c91 h LEU 291 N 0.25 1.03 -0.50 1.46 5.85 -1.07 0.40 115.31 122.74 2c91 h LEU 291 Ca 0.10 -0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.78 2c91 h LEU 291 Cb 0.03 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 40.78 2c91 h LEU 291 CO -0.07 0.75 0.26 -0.33 -0.34 0.00 0.00 178.44 178.72 2c91 h GLU 292 N 1.21 0.70 -0.31 1.25 5.08 -0.89 0.33 114.58 121.95 2c91 h GLU 292 Ca 0.33 -0.09 0.06 0.00 -1.00 0.00 0.00 59.36 58.66 2c91 h GLU 292 Cb -0.13 -0.13 -0.06 0.00 0.50 0.00 0.00 28.75 28.93 2c91 h GLU 292 CO -0.07 0.56 -0.05 0.37 -1.00 0.00 0.00 179.01 178.82 2c91 h GLN 293 N 0.66 0.03 -0.57 2.33 4.15 -1.01 -1.96 115.11 118.74 2c91 h GLN 293 Ca 0.17 -0.00 -0.10 0.00 0.77 0.00 0.00 58.65 59.49 2c91 h GLN 293 Cb 0.07 -0.01 -0.02 0.00 0.21 0.00 0.00 27.48 27.73 2c91 h GLN 293 CO -0.03 0.02 -0.04 -0.91 -1.93 0.00 0.00 178.83 175.94 2c91 h ASN 294 N 0.03 1.01 -0.76 -0.69 2.35 -0.42 -2.33 115.58 114.77 2c91 h ASN 294 Ca 0.15 -0.30 -0.05 0.00 -0.55 0.00 0.00 56.30 55.55 2c91 h ASN 294 Cb 0.22 -0.27 -0.03 0.00 0.05 0.00 0.00 38.32 38.28 2c91 h ASN 294 CO -0.29 1.09 0.28 -0.07 -1.65 0.00 0.00 177.43 176.79 2c91 h LEU 295 N 0.93 1.07 -0.49 1.61 3.38 -0.19 -2.03 115.31 119.60 2c91 h LEU 295 Ca 0.16 -0.18 -0.02 0.00 0.09 0.00 0.00 57.88 57.93 2c91 h LEU 295 Cb 0.60 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.05 2c91 h LEU 295 CO 0.04 0.96 0.21 0.00 0.09 0.00 0.00 178.44 179.74 2c91 h ALA 296 N 1.18 0.63 -0.31 1.53 0.00 -0.93 -2.70 119.26 118.67 2c91 h ALA 296 Ca 0.25 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 2c91 h ALA 296 Cb 0.24 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 2c91 h ALA 296 CO -0.02 0.22 0.15 0.00 0.00 0.00 0.00 179.25 179.60 2c91 h ALA 297 N 1.05 1.69 0.00 0.00 0.00 -1.25 -1.88 119.26 118.87 2c91 h ALA 297 Ca 0.16 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 2c91 h ALA 297 Cb 0.17 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 2c91 h ALA 297 CO -0.02 0.26 -0.03 1.79 0.00 0.00 0.00 179.25 181.25 2c91 h THR 298 N 0.42 0.17 -0.01 0.00 1.35 -1.02 -2.46 112.91 111.36 2c91 h THR 298 Ca 0.11 -0.28 0.00 0.00 -0.55 0.00 0.00 66.41 65.69 2c91 h THR 298 Cb 0.04 1.23 0.00 0.00 -1.73 0.00 0.00 68.15 67.69 2c91 h THR 298 CO -0.02 0.03 -0.67 -0.62 -0.25 0.00 0.00 175.52 174.00 2c91 n GLU 299 N -3.26 0.45 -1.15 4.72 1.02 -0.72 -4.93 120.64 116.77 2c91 n GLU 299 Ca -0.02 -0.35 -0.29 0.00 -0.02 0.00 0.00 57.16 56.48 2c91 n GLU 299 Cb 0.18 -1.49 0.17 0.00 -0.02 0.00 0.00 31.44 30.27 2c91 n GLU 299 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2c91 s GLU 300 N -2.79 0.64 0.00 3.49 2.02 -0.93 -5.07 118.70 116.07 2c91 s GLU 300 Ca 0.14 0.63 0.00 0.00 0.02 0.00 0.00 54.97 55.76 2c91 s GLU 300 Cb 0.17 -1.75 0.00 0.00 0.10 0.00 0.00 34.13 32.65 2c91 s GLU 300 CO 0.71 -2.62 0.00 0.41 0.02 0.00 0.00 175.26 173.78 2c91 n GLY 301 N -1.02 1.42 3.72 -1.39 0.00 -1.26 -5.02 105.19 101.63 2c91 n GLY 301 Ca 0.06 -2.04 -0.32 0.00 0.00 0.00 0.00 46.02 43.71 2c91 n GLY 301 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2c91 s PRO 302 N -1.65 1.78 0.54 1.61 0.02 -1.26 -4.95 135.00 131.10 2c91 s PRO 302 Ca 0.00 1.51 -0.07 0.00 0.02 0.00 0.00 61.00 62.46 2c91 s PRO 302 Cb 0.00 -1.82 -0.03 0.00 0.02 0.00 0.00 34.50 32.67 2c91 s PRO 302 CO 0.00 -2.05 0.88 -0.51 -0.33 0.00 0.00 177.00 174.99 2c91 s LEU 303 N -5.88 3.44 0.49 -5.54 1.43 -1.26 -5.07 118.68 106.30 2c91 s LEU 303 Ca 0.68 1.06 -0.22 0.00 -1.03 0.00 0.00 54.13 54.62 2c91 s LEU 303 Cb -0.23 -4.03 -0.06 0.00 0.03 0.00 0.00 46.19 41.90 2c91 s LEU 303 CO 0.52 -0.74 1.23 -1.61 0.23 0.00 0.00 176.35 175.98 2c91 s GLU 304 N -4.92 3.53 0.29 1.70 0.41 -1.26 -4.84 118.70 113.61 2c91 s GLU 304 Ca 0.51 1.92 0.02 0.00 -0.41 0.00 0.00 54.97 57.00 2c91 s GLU 304 Cb -0.11 -2.33 0.71 0.00 -1.78 0.00 0.00 34.13 30.62 2c91 s GLU 304 CO 0.48 -0.78 1.64 -1.35 -0.49 0.00 0.00 175.26 174.76 2c91 h PRO 305 N 1.81 0.19 -0.86 0.39 0.11 -1.99 -0.90 132.00 130.74 2c91 h PRO 305 Ca -0.50 -0.01 0.06 0.00 0.11 0.00 0.00 66.00 65.66 2c91 h PRO 305 Cb 1.27 -0.04 -0.06 0.00 0.11 0.00 0.00 31.00 32.28 2c91 h PRO 305 CO 0.59 0.13 0.56 0.00 -0.21 0.00 0.00 178.00 179.07 2c91 h ALA 306 N 1.79 1.56 -0.00 -0.75 0.00 -1.97 -1.22 119.26 118.66 2c91 h ALA 306 Ca 0.55 -0.02 -0.26 0.00 0.00 0.00 0.00 54.91 55.18 2c91 h ALA 306 Cb 1.11 -0.25 0.02 0.00 0.00 0.00 0.00 17.79 18.67 2c91 h ALA 306 CO -0.66 0.32 -1.03 0.28 0.00 0.00 0.00 179.25 178.15 2c91 h VAL 307 N 0.97 1.30 -0.78 0.00 2.07 -1.48 -2.35 116.25 115.97 2c91 h VAL 307 Ca 0.37 -2.27 0.08 0.00 0.82 0.00 0.00 66.70 65.70 2c91 h VAL 307 Cb 0.21 2.38 -0.07 0.00 -1.52 0.00 0.00 31.29 32.29 2c91 h VAL 307 CO -0.13 0.70 0.44 0.58 0.02 0.00 0.00 177.57 179.17 2c91 h VAL 308 N 0.37 0.92 -0.48 2.57 2.07 -1.11 -1.48 116.25 119.12 2c91 h VAL 308 Ca -0.12 -0.26 -0.13 0.00 0.82 0.00 0.00 66.70 67.01 2c91 h VAL 308 Cb 1.68 0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 31.54 2c91 h VAL 308 CO 0.20 0.14 -0.21 -0.08 0.02 0.00 0.00 177.57 177.64 2c91 h GLU 309 N 0.76 0.98 -0.63 1.57 4.22 -1.25 -1.53 114.58 118.70 2c91 h GLU 309 Ca 0.37 -0.41 -0.01 0.00 0.08 0.00 0.00 59.36 59.38 2c91 h GLU 309 Cb 0.31 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.49 2c91 h GLU 309 CO -0.23 1.08 0.34 0.00 -2.18 0.00 0.00 179.01 178.03 2c91 h ALA 310 N 0.90 1.42 -0.20 2.92 0.00 -0.98 -0.24 119.26 123.08 2c91 h ALA 310 Ca 0.11 -0.10 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 2c91 h ALA 310 Cb 0.78 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 2c91 h ALA 310 CO 0.06 0.48 -0.20 0.74 0.00 0.00 0.00 179.25 180.34 2c91 h PHE 311 N 0.88 0.38 -0.31 0.00 0.04 -0.76 0.48 116.94 117.65 2c91 h PHE 311 Ca 0.22 -0.06 -0.08 0.00 2.80 0.00 0.00 57.97 60.85 2c91 h PHE 311 Cb 0.03 -0.10 -0.01 0.00 2.20 0.00 0.00 35.95 38.07 2c91 h PHE 311 CO 0.01 0.53 -0.12 -0.44 -0.60 0.00 0.00 178.31 177.69 2c91 h ASP 312 N 0.32 0.65 -0.83 2.17 3.32 -0.66 -1.53 116.42 119.85 2c91 h ASP 312 Ca 0.06 -0.39 -0.02 0.00 0.02 0.00 0.00 57.03 56.70 2c91 h ASP 312 Cb 0.53 -0.18 -0.04 0.00 0.22 0.00 0.00 39.33 39.87 2c91 h ASP 312 CO 0.04 0.89 0.46 1.56 -1.72 0.00 0.00 179.24 180.47 2c91 h GLN 313 N 0.40 1.17 0.20 3.56 4.20 -0.84 -1.76 115.11 122.04 2c91 h GLN 313 Ca 0.07 -0.13 -0.01 0.00 0.06 0.00 0.00 58.65 58.64 2c91 h GLN 313 Cb 0.63 -0.23 -0.00 0.00 0.30 0.00 0.00 27.48 28.18 2c91 h GLN 313 CO 0.04 0.85 -0.11 0.00 -0.67 0.00 0.00 178.83 178.94 2c91 h ALA 314 N 1.33 -0.29 -0.96 3.87 0.00 -0.80 -2.25 119.26 120.17 2c91 h ALA 314 Ca 0.30 -0.06 0.09 0.00 0.00 0.00 0.00 54.91 55.24 2c91 h ALA 314 Cb 0.02 0.13 -0.08 0.00 0.00 0.00 0.00 17.79 17.87 2c91 h ALA 314 CO -0.05 -0.66 0.60 2.35 0.00 0.00 0.00 179.25 181.48 2c91 h TRP 315 N -0.29 1.09 -0.01 0.00 2.91 -1.07 -2.27 115.95 116.31 2c91 h TRP 315 Ca -0.02 0.03 -0.04 0.00 1.13 0.00 0.00 58.89 59.99 2c91 h TRP 315 Cb 0.23 -0.35 -0.01 0.00 -0.51 0.00 0.00 29.16 28.53 2c91 h TRP 315 CO -0.07 0.48 -0.17 -0.91 -1.03 0.00 0.00 178.44 176.74 2c91 h ASN 316 N 1.00 0.01 0.43 2.65 2.35 -0.95 0.20 115.58 121.27 2c91 h ASN 316 Ca 0.45 -0.00 -0.11 0.00 -0.55 0.00 0.00 56.30 56.08 2c91 h ASN 316 Cb 0.35 -0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.70 2c91 h ASN 316 CO -0.23 0.19 -0.50 0.24 -1.65 0.00 0.00 177.43 175.48 2c91 h MET 317 N 0.02 0.09 0.00 0.81 2.86 -0.83 -3.32 114.93 114.55 2c91 h MET 317 Ca 0.00 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.59 2c91 h MET 317 Cb 0.31 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.97 2c91 h MET 317 CO 0.02 0.57 -0.98 1.33 1.06 0.00 0.00 176.91 178.92 2c91 n VAL 318 N -3.94 0.00 -0.35 -2.22 0.24 -0.71 -4.67 118.33 106.68 2c91 n VAL 318 Ca -0.02 -0.21 0.13 0.00 -2.04 0.00 0.00 64.34 62.20 2c91 n VAL 318 Cb 0.53 0.75 0.32 0.00 -1.47 0.00 0.00 33.84 33.97 2c91 n VAL 318 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2c91 h ALA 319 N 1.84 1.65 0.00 2.33 0.00 -0.75 0.10 119.26 124.43 2c91 h ALA 319 Ca 0.00 0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2c91 h ALA 319 Cb 0.44 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.17 2c91 h ALA 319 CO 0.00 -0.08 0.00 1.12 0.00 0.00 0.00 179.25 180.29 2c91 h HIS 320 N 0.72 0.00 0.00 0.00 2.07 -1.83 -2.79 115.15 113.32 2c91 h HIS 320 Ca 0.58 0.00 -0.04 0.00 -2.85 0.00 0.00 60.37 58.05 2c91 h HIS 320 Cb 0.92 0.00 -0.10 0.00 2.57 0.00 0.00 27.41 30.80 2c91 h HIS 320 CO -0.02 0.00 -0.61 -0.85 -3.07 0.00 0.00 177.93 173.38 2c91 n GLU 321 N -2.77 1.16 -1.94 5.12 0.28 0.33 -5.06 120.64 117.76 2c91 n GLU 321 Ca -0.01 -2.92 -0.41 0.00 -0.16 0.00 0.00 57.16 53.66 2c91 n GLU 321 Cb 0.16 -1.20 -0.02 0.00 1.43 0.00 0.00 31.44 31.82 2c91 n GLU 321 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2c91 s PRO 323 N -0.74 3.27 0.08 0.00 0.04 -1.26 -4.97 135.00 131.41 2c91 s PRO 323 Ca 0.58 1.35 -0.31 0.00 0.04 0.00 0.00 61.00 62.66 2c91 s PRO 323 Cb -0.44 -2.02 -0.06 0.00 0.04 0.00 0.00 34.50 32.02 2c91 s PRO 323 CO 0.48 -0.87 1.26 -0.80 0.04 0.00 0.00 177.00 177.11 2c91 s ASN 324 N -2.43 6.99 0.34 6.66 0.01 -1.26 -4.88 114.94 120.38 2c91 s ASN 324 Ca 0.67 2.12 0.27 0.00 -0.71 0.00 0.00 52.86 55.20 2c91 s ASN 324 Cb -0.19 -2.58 1.08 0.00 0.41 0.00 0.00 41.25 39.97 2c91 s ASN 324 CO 0.34 -0.53 1.79 0.10 -1.51 0.00 0.00 177.10 177.29 2c91 h TYR 325 N 6.79 0.00 -3.00 2.20 -0.00 -1.93 -3.45 116.97 117.58 2c91 h TYR 325 Ca -0.42 0.00 -0.61 0.00 -0.00 0.00 0.00 58.73 57.70 2c91 h TYR 325 Cb 1.21 0.00 -0.11 0.00 -0.00 0.00 0.00 36.73 37.83 2c91 h TYR 325 CO 0.66 0.00 -0.66 -0.59 -0.00 0.00 0.00 178.16 177.58 2c91 s PHE 326 N -3.41 2.88 0.00 0.10 -0.12 -1.26 -4.32 117.98 111.86 2c91 s PHE 326 Ca 0.04 -0.11 0.00 0.00 -0.05 0.00 0.00 56.93 56.81 2c91 s PHE 326 Cb 0.09 -1.42 0.00 0.00 -0.63 0.00 0.00 43.02 41.06 2c91 s PHE 326 CO 0.45 0.50 0.28 0.54 -0.05 0.00 0.00 175.22 176.94