#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 3.83 0.49 1.96 1.70 -1.26 -3.50 118.95 122.17 2c91 s ARG 5 Ca 0.00 0.38 -0.21 0.00 -0.47 0.00 0.00 55.73 55.43 2c91 s ARG 5 Cb 0.00 -2.55 -0.11 0.00 -0.57 0.00 0.00 34.95 31.73 2c91 s ARG 5 CO 0.00 0.20 0.59 -2.30 -1.08 0.00 0.00 175.30 172.72 2c91 n PRO 6 N -0.49 0.64 -1.26 3.89 -0.02 -1.26 -4.46 135.00 132.04 2c91 n PRO 6 Ca 0.01 0.24 -0.29 0.00 -2.02 0.00 0.00 63.50 61.44 2c91 n PRO 6 Cb 0.53 -1.66 0.14 0.00 -0.02 0.00 0.00 33.50 32.49 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 -1.56 1.52 -0.13 3.55 0.00 -0.75 -4.82 121.76 119.56 2c91 s ALA 7 Ca 0.66 -0.18 0.01 0.00 0.00 0.00 0.00 51.96 52.45 2c91 s ALA 7 Cb -0.52 -3.15 0.02 0.00 0.00 0.00 0.00 23.12 19.46 2c91 s ALA 7 CO 0.56 -2.37 -0.16 0.99 0.00 0.00 0.00 175.76 174.78 2c91 s THR 8 N -2.99 1.62 -0.02 0.00 2.01 -1.26 -0.77 115.64 114.23 2c91 s THR 8 Ca 0.63 -0.69 0.03 0.00 0.31 0.00 0.00 61.69 61.98 2c91 s THR 8 Cb -0.17 -1.48 -0.03 0.00 0.01 0.00 0.00 72.50 70.82 2c91 s THR 8 CO 0.56 0.46 -0.09 -0.69 -0.69 0.00 0.00 174.62 174.18 2c91 s VAL 9 N 1.18 3.48 -0.27 3.82 1.01 -0.10 -4.48 120.40 125.04 2c91 s VAL 9 Ca -0.01 -0.74 -0.17 0.00 0.00 0.00 0.00 61.98 61.05 2c91 s VAL 9 Cb -0.14 -2.46 -0.03 0.00 0.00 0.00 0.00 36.38 33.75 2c91 s VAL 9 CO -0.06 0.46 0.47 -0.22 0.00 0.00 0.00 175.10 175.76 2c91 s LEU 10 N -1.18 4.07 0.17 3.92 0.20 -0.33 -0.64 118.68 124.89 2c91 s LEU 10 Ca 0.15 0.40 -0.30 0.00 0.69 0.00 0.00 54.13 55.07 2c91 s LEU 10 Cb -0.11 -2.58 -0.07 0.00 -0.43 0.00 0.00 46.19 43.00 2c91 s LEU 10 CO 0.05 -0.27 0.97 -0.83 -0.29 0.00 0.00 176.35 175.98 2c91 s GLY 11 N 1.59 3.03 -0.06 7.98 0.00 -0.17 -0.34 107.32 119.36 2c91 s GLY 11 Ca 0.19 0.63 0.09 0.00 0.00 0.00 0.00 44.72 45.62 2c91 s GLY 11 CO 0.10 1.39 1.05 -1.30 0.00 0.00 0.00 173.10 174.34 2c91 n THR 12 N 2.26 1.34 -0.16 0.90 -2.24 -0.64 -4.71 114.28 111.03 2c91 n THR 12 Ca 0.01 -1.52 0.17 0.00 -2.27 0.00 0.00 64.05 60.44 2c91 n THR 12 Cb 0.48 0.18 0.54 0.00 -2.10 0.00 0.00 70.33 69.42 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 0.34 -0.02 -0.78 1.85 -1.92 -2.41 114.93 111.99 2c91 h MET 13 Ca 0.00 -0.02 0.00 0.00 -0.61 0.00 0.00 59.70 59.07 2c91 h MET 13 Cb 0.78 -0.08 0.00 0.00 0.43 0.00 0.00 31.60 32.73 2c91 h MET 13 CO 0.00 0.22 -0.08 0.39 -0.40 0.00 0.00 176.91 177.04 2c91 n GLU 14 N -4.46 1.80 -2.30 0.39 -0.58 -1.26 -4.67 120.64 109.56 2c91 n GLU 14 Ca 0.15 -1.32 -0.43 0.00 -0.42 0.00 0.00 57.16 55.14 2c91 n GLU 14 Cb 0.58 -1.47 -0.02 0.00 -0.57 0.00 0.00 31.44 29.96 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 -2.11 3.76 0.00 3.49 -1.94 -0.91 -1.41 119.30 120.19 2c91 s MET 15 Ca 0.30 1.29 0.00 0.00 -1.71 0.00 0.00 55.69 55.57 2c91 s MET 15 Cb 0.20 -3.98 0.00 0.00 2.01 0.00 0.00 34.83 33.06 2c91 s MET 15 CO 0.37 -1.32 0.00 0.41 -0.01 0.00 0.00 175.02 174.47 2c91 n GLY 16 N 4.66 0.53 0.00 -0.03 0.00 0.33 -2.80 105.19 107.88 2c91 n GLY 16 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 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 -1.34 0.00 0.15 1.61 0.63 -0.50 -4.86 116.66 112.35 2c91 n ARG 17 Ca 0.00 0.00 0.06 0.00 -0.92 0.00 0.00 57.85 56.99 2c91 n ARG 17 Cb 0.00 0.00 0.06 0.00 0.45 0.00 0.00 32.46 32.97 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 -5.16 -0.14 2.47 -1.81 -3.44 114.38 106.29 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 -0.22 0.00 -1.65 0.00 0.00 29.97 28.10 2c91 h ARG 18 CO 0.00 0.25 -0.65 -1.64 0.56 0.00 0.00 179.97 178.50 2c91 s MET 19 N -3.09 3.68 0.76 0.04 -1.94 -0.61 -4.97 119.30 113.18 2c91 s MET 19 Ca 0.04 -0.49 -0.07 0.00 -1.71 0.00 0.00 55.69 53.46 2c91 s MET 19 Cb 0.07 -3.08 0.11 0.00 2.01 0.00 0.00 34.83 33.94 2c91 s MET 19 CO 0.73 0.08 1.06 0.16 -0.01 0.00 0.00 175.02 177.04 2c91 s ASP 20 N 0.84 4.33 0.37 3.03 1.47 -1.26 -0.51 116.67 124.93 2c91 s ASP 20 Ca 0.01 0.15 0.10 0.00 1.18 0.00 0.00 52.55 53.99 2c91 s ASP 20 Cb -0.14 -0.60 0.84 0.00 -0.34 0.00 0.00 42.92 42.68 2c91 s ASP 20 CO 0.02 -1.90 1.89 0.00 0.68 0.00 0.00 175.17 175.86 2c91 h ALA 21 N -0.77 1.86 0.18 2.11 0.00 -1.99 0.78 119.26 121.43 2c91 h ALA 21 Ca -0.42 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.49 2c91 h ALA 21 Cb 1.28 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.95 2c91 h ALA 21 CO 0.49 -0.08 -0.09 1.03 0.00 0.00 0.00 179.25 180.60 2c91 h SER 22 N 0.66 -0.21 -0.38 0.00 0.87 -1.99 -0.65 113.55 111.85 2c91 h SER 22 Ca 0.42 -0.25 -0.02 0.00 -1.23 0.00 0.00 61.79 60.71 2c91 h SER 22 Cb 0.69 0.05 -0.02 0.00 -0.44 0.00 0.00 62.40 62.68 2c91 h SER 22 CO -0.18 0.16 0.18 0.00 -0.53 0.00 0.00 176.83 176.46 2c91 h ALA 23 N 0.12 1.52 -0.16 6.23 0.00 -1.81 -1.78 119.26 123.38 2c91 h ALA 23 Ca -0.02 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.74 2c91 h ALA 23 Cb 0.45 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2c91 h ALA 23 CO 0.04 0.38 -0.03 0.77 0.00 0.00 0.00 179.25 180.41 2c91 h SER 24 N 0.60 0.30 -0.84 0.00 0.02 -0.82 -1.97 113.55 110.84 2c91 h SER 24 Ca 0.15 -0.35 0.03 0.00 -0.84 0.00 0.00 61.79 60.78 2c91 h SER 24 Cb 0.11 -0.08 -0.05 0.00 0.14 0.00 0.00 62.40 62.51 2c91 h SER 24 CO -0.02 0.58 0.54 0.00 -1.14 0.00 0.00 176.83 176.80 2c91 h ALA 25 N 0.73 1.11 -0.72 3.77 0.00 -0.87 -1.94 119.26 121.34 2c91 h ALA 25 Ca 0.04 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 2c91 h ALA 25 Cb 0.45 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 2c91 h ALA 25 CO 0.01 0.37 0.31 0.00 0.00 0.00 0.00 179.25 179.94 2c91 h ALA 26 N 1.35 0.93 -0.24 0.00 0.00 -1.29 -1.92 119.26 118.10 2c91 h ALA 26 Ca 0.34 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 55.01 2c91 h ALA 26 Cb 0.02 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 2c91 h ALA 26 CO -0.12 0.53 -0.12 0.77 0.00 0.00 0.00 179.25 180.31 2c91 h SER 27 N 1.02 0.52 -0.26 0.00 0.02 -0.95 -0.79 113.55 113.10 2c91 h SER 27 Ca 0.24 -0.41 0.00 0.00 -0.84 0.00 0.00 61.79 60.79 2c91 h SER 27 Cb 0.17 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.55 2c91 h SER 27 CO -0.02 0.81 0.17 0.58 -1.14 0.00 0.00 176.83 177.23 2c91 h VAL 28 N 0.22 1.07 -0.31 2.27 2.07 -1.35 -0.24 116.25 119.98 2c91 h VAL 28 Ca 0.05 -0.13 0.07 0.00 0.82 0.00 0.00 66.70 67.51 2c91 h VAL 28 Cb 0.62 0.69 -0.08 0.00 -1.52 0.00 0.00 31.29 31.00 2c91 h VAL 28 CO 0.04 0.07 -0.21 0.03 0.02 0.00 0.00 177.57 177.51 2c91 h ARG 29 N 0.36 -0.17 -0.67 1.57 3.08 -1.17 0.16 114.38 117.54 2c91 h ARG 29 Ca 0.10 0.01 0.03 0.00 0.07 0.00 0.00 59.98 60.19 2c91 h ARG 29 Cb -0.04 0.04 -0.04 0.00 0.08 0.00 0.00 29.97 30.01 2c91 h ARG 29 CO -0.02 -0.11 0.41 0.00 -1.07 0.00 0.00 179.97 179.17 2c91 h ALA 30 N 0.98 0.87 -0.22 0.04 0.00 -0.79 0.28 119.26 120.42 2c91 h ALA 30 Ca 0.16 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 2c91 h ALA 30 Cb 0.42 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 2c91 h ALA 30 CO -0.42 0.15 0.13 0.35 0.00 0.00 0.00 179.25 179.47 2c91 h PHE 31 N 0.79 0.30 -0.21 0.00 3.57 -0.28 -2.92 116.94 118.19 2c91 h PHE 31 Ca 0.27 -0.00 -0.12 0.00 3.53 0.00 0.00 57.97 61.65 2c91 h PHE 31 Cb 0.05 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 38.68 2c91 h PHE 31 CO -0.05 0.25 -0.37 -0.07 -2.23 0.00 0.00 178.31 175.84 2c91 h LEU 32 N 0.26 0.47 -2.10 0.59 3.38 -0.37 -2.76 115.31 114.78 2c91 h LEU 32 Ca 0.08 -0.19 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 2c91 h LEU 32 Cb 0.04 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.66 2c91 h LEU 32 CO -0.01 0.80 -0.04 -0.33 0.09 0.00 0.00 178.44 178.94 2c91 h GLU 33 N 0.38 0.00 -0.01 1.13 5.08 -0.77 -0.59 114.58 119.80 2c91 h GLU 33 Ca 0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 2c91 h GLU 33 Cb 0.82 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.07 2c91 h GLU 33 CO 0.07 0.04 0.00 0.54 -1.00 0.00 0.00 179.01 178.66 2c91 n ARG 34 N -4.16 1.07 -0.37 2.33 5.12 -1.05 -4.88 116.66 114.72 2c91 n ARG 34 Ca -0.03 -0.11 0.00 0.00 -1.93 0.00 0.00 57.85 55.78 2c91 n ARG 34 Cb 0.13 -1.41 0.00 0.00 -1.16 0.00 0.00 32.46 30.02 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 0.93 0.75 3.90 -0.13 0.00 -0.23 -5.07 105.19 105.35 2c91 n GLY 35 Ca 0.19 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.93 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 -2.35 3.13 0.00 1.61 3.76 -1.21 -5.04 115.29 115.20 2c91 s HIS 36 Ca 0.00 0.78 0.00 0.00 -0.15 0.00 0.00 55.06 55.69 2c91 s HIS 36 Cb 0.00 -3.16 0.00 0.00 1.11 0.00 0.00 32.58 30.53 2c91 s HIS 36 CO 0.00 -1.33 0.00 -1.13 -0.85 0.00 0.00 174.74 171.43 2c91 n SER 37 N -3.01 0.00 -4.78 1.40 3.41 -1.26 -4.40 113.62 104.98 2c91 n SER 37 Ca 0.07 0.00 -0.36 0.00 -0.26 0.00 0.00 58.87 58.32 2c91 n SER 37 Cb 0.59 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.47 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 3.80 -0.02 4.33 2.02 -1.26 -0.85 118.70 126.72 2c91 s GLU 38 Ca 0.00 -0.20 0.06 0.00 0.02 0.00 0.00 54.97 54.84 2c91 s GLU 38 Cb 0.00 -3.27 -0.03 0.00 0.10 0.00 0.00 34.13 30.93 2c91 s GLU 38 CO 0.00 0.52 -0.19 -0.51 0.02 0.00 0.00 175.26 175.10 2c91 s LEU 39 N -0.28 2.49 -0.19 1.80 1.43 -0.36 -1.19 118.68 122.38 2c91 s LEU 39 Ca 0.11 -0.33 -0.01 0.00 -1.03 0.00 0.00 54.13 52.87 2c91 s LEU 39 Cb -0.12 -1.47 0.01 0.00 0.03 0.00 0.00 46.19 44.64 2c91 s LEU 39 CO 0.01 0.32 -0.14 -0.62 0.23 0.00 0.00 176.35 176.14 2c91 s ASP 40 N -0.84 3.57 0.00 2.29 2.15 0.54 -1.08 116.67 123.30 2c91 s ASP 40 Ca 0.12 -0.55 0.00 0.00 0.43 0.00 0.00 52.55 52.55 2c91 s ASP 40 Cb -0.10 -1.57 0.00 0.00 -0.30 0.00 0.00 42.92 40.94 2c91 s ASP 40 CO 0.01 0.00 0.00 1.07 -0.17 0.00 0.00 175.17 176.08 2c91 n THR 41 N 4.62 0.00 -3.55 1.71 5.66 0.13 -1.62 114.28 121.22 2c91 n THR 41 Ca -0.20 0.00 -0.15 0.00 -3.05 0.00 0.00 64.05 60.66 2c91 n THR 41 Cb 0.50 0.00 -0.05 0.00 -1.55 0.00 0.00 70.33 69.23 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 -2.00 -1.43 0.29 1.79 0.00 -1.26 -3.91 121.76 115.25 2c91 s ALA 42 Ca 0.00 0.73 0.04 0.00 0.00 0.00 0.00 51.96 52.72 2c91 s ALA 42 Cb 0.00 0.34 0.72 0.00 0.00 0.00 0.00 23.12 24.18 2c91 s ALA 42 CO 0.00 -0.49 1.71 0.35 0.00 0.00 0.00 175.76 177.32 2c91 h PHE 43 N 2.79 0.70 -0.60 0.00 3.57 -1.79 -2.52 116.94 119.09 2c91 h PHE 43 Ca -0.30 0.04 -0.07 0.00 3.53 0.00 0.00 57.97 61.17 2c91 h PHE 43 Cb 1.21 -0.17 -0.03 0.00 2.79 0.00 0.00 35.95 39.75 2c91 h PHE 43 CO 0.36 -0.01 0.10 1.98 -2.23 0.00 0.00 178.31 178.52 2c91 h MET 44 N 0.45 0.97 -6.33 1.11 4.05 -1.96 -3.28 114.93 109.93 2c91 h MET 44 Ca 0.56 -0.24 -0.54 0.00 -0.28 0.00 0.00 59.70 59.19 2c91 h MET 44 Cb 1.03 -0.13 -0.00 0.00 -0.80 0.00 0.00 31.60 31.70 2c91 h MET 44 CO -0.50 0.89 0.98 0.71 0.23 0.00 0.00 176.91 179.22 2c91 s TYR 45 N -5.18 2.41 -1.43 1.39 2.02 -0.95 -2.61 117.35 113.00 2c91 s TYR 45 Ca -0.11 0.47 -0.10 0.00 -0.37 0.00 0.00 57.07 56.97 2c91 s TYR 45 Cb 0.15 -3.82 0.05 0.00 -0.40 0.00 0.00 41.96 37.94 2c91 s TYR 45 CO 0.83 -3.28 0.99 0.00 -1.57 0.00 0.00 175.55 172.52 2c91 n ASP 47 N -2.94 -5.26 0.00 0.00 2.03 -1.07 -0.90 116.55 108.42 2c91 n ASP 47 Ca -0.04 -0.12 0.00 0.00 0.52 0.00 0.00 54.79 55.14 2c91 n ASP 47 Cb 0.57 -4.33 0.00 0.00 -0.72 0.00 0.00 41.12 36.63 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 -1.18 0.43 0.12 0.27 0.00 -0.74 -4.97 105.19 99.12 2c91 n GLY 48 Ca -0.15 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.85 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 4.28 0.00 -0.09 1.61 1.08 -0.89 -1.89 115.11 119.21 2c91 h GLN 49 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2c91 h GLN 49 Cb 0.00 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.43 2c91 h GLN 49 CO 0.00 0.70 0.06 1.03 -0.95 0.00 0.00 178.83 179.66 2c91 h SER 50 N 0.00 0.10 -0.68 1.46 0.87 -1.44 0.11 113.55 113.98 2c91 h SER 50 Ca -0.01 -0.02 -0.04 0.00 -1.23 0.00 0.00 61.79 60.49 2c91 h SER 50 Cb 1.24 -0.03 -0.03 0.00 -0.44 0.00 0.00 62.40 63.14 2c91 h SER 50 CO 0.09 0.09 0.28 -0.33 -0.53 0.00 0.00 176.83 176.43 2c91 h GLU 51 N 0.10 1.01 -0.50 2.24 5.08 -1.77 -1.62 114.58 119.11 2c91 h GLU 51 Ca 0.03 -0.18 -0.02 0.00 -1.00 0.00 0.00 59.36 58.19 2c91 h GLU 51 Cb 0.01 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.07 2c91 h GLU 51 CO -0.01 0.83 0.23 -0.91 -1.00 0.00 0.00 179.01 178.15 2c91 h ASN 52 N 0.96 0.67 -0.22 1.42 -0.26 -1.07 0.47 115.58 117.54 2c91 h ASN 52 Ca 0.23 -0.14 0.01 0.00 -0.56 0.00 0.00 56.30 55.84 2c91 h ASN 52 Cb 0.20 -0.17 -0.02 0.00 -1.06 0.00 0.00 38.32 37.27 2c91 h ASN 52 CO -0.02 0.62 0.12 0.40 -1.06 0.00 0.00 177.43 177.49 2c91 h ILE 53 N 0.66 1.01 -0.69 2.81 2.04 -0.68 -2.19 117.51 120.48 2c91 h ILE 53 Ca 0.17 -0.08 -0.06 0.00 1.00 0.00 0.00 64.86 65.89 2c91 h ILE 53 Cb 0.14 0.74 -0.03 0.00 -0.74 0.00 0.00 36.82 36.94 2c91 h ILE 53 CO -0.02 0.04 0.19 -0.07 0.00 0.00 0.00 178.15 178.30 2c91 h LEU 54 N 0.25 1.00 -1.89 1.44 3.38 -1.00 -2.07 115.31 116.42 2c91 h LEU 54 Ca 0.09 -0.19 -0.02 0.00 0.09 0.00 0.00 57.88 57.84 2c91 h LEU 54 Cb 0.01 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.49 2c91 h LEU 54 CO -0.05 0.95 -0.11 1.23 0.09 0.00 0.00 178.44 180.54 2c91 h GLY 55 N 1.08 0.00 0.01 0.83 0.00 -0.67 -2.33 103.07 101.98 2c91 h GLY 55 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.55 2c91 h GLY 55 CO -0.00 0.00 -0.04 0.61 0.00 0.00 0.00 176.54 177.11 2c91 n GLY 56 N -0.60 -0.34 0.07 4.60 0.00 -0.79 -4.20 105.19 103.93 2c91 n GLY 56 Ca -0.02 -0.38 0.15 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.24 0.25 -2.67 0.99 4.77 -0.88 -4.90 117.00 114.31 2c91 n LEU 57 Ca 0.19 0.09 -0.18 0.00 -0.03 0.00 0.00 56.01 56.08 2c91 n LEU 57 Cb 0.30 -0.18 0.05 0.00 -2.33 0.00 0.00 43.42 41.26 2c91 n LEU 57 CO 0.19 0.05 0.12 0.61 -1.33 0.00 0.00 177.39 177.02 2c91 n GLY 58 N 1.23 -0.20 0.14 -0.72 0.00 -1.26 -4.92 105.19 99.45 2c91 n GLY 58 Ca 0.16 -0.01 0.13 0.00 0.00 0.00 0.00 46.02 46.31 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 -3.65 0.64 -3.61 0.99 4.77 -1.26 -4.95 117.00 109.94 2c91 n LEU 59 Ca -0.03 -0.06 -0.21 0.00 -0.03 0.00 0.00 56.01 55.69 2c91 n LEU 59 Cb 0.56 -0.19 0.06 0.00 -2.33 0.00 0.00 43.42 41.52 2c91 n LEU 59 CO 0.45 0.13 0.06 0.61 -1.33 0.00 0.00 177.39 177.30 2c91 n GLY 60 N 1.35 -0.37 3.77 -0.72 0.00 -1.26 -4.87 105.19 103.09 2c91 n GLY 60 Ca 0.12 0.14 -0.41 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 -6.70 4.25 0.00 0.99 1.43 -1.26 -2.76 118.68 114.63 2c91 s LEU 61 Ca 0.15 2.99 0.00 0.00 -1.03 0.00 0.00 54.13 56.24 2c91 s LEU 61 Cb -0.07 -3.76 0.00 0.00 0.03 0.00 0.00 46.19 42.39 2c91 s LEU 61 CO 0.77 -0.96 0.00 0.61 0.23 0.00 0.00 176.35 177.00 2c91 n GLY 62 N 0.51 0.69 2.86 -3.19 0.00 -1.25 -4.33 105.19 100.47 2c91 n GLY 62 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 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 -0.02 6.79 -1.70 1.61 3.41 -1.11 -4.46 113.62 118.14 2c91 n SER 63 Ca 0.00 -3.51 -0.21 0.00 -0.26 0.00 0.00 58.87 54.88 2c91 n SER 63 Cb 0.01 -1.24 -0.03 0.00 -0.26 0.00 0.00 64.21 62.70 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 0.83 -0.24 0.00 5.00 0.00 -1.26 -3.33 105.19 106.19 2c91 n GLY 64 Ca 0.34 0.25 0.00 0.00 0.00 0.00 0.00 46.02 46.61 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 0.61 0.00 -3.68 1.61 -0.08 -1.26 -5.12 116.55 108.63 2c91 n ASP 65 Ca 0.07 0.00 -0.10 0.00 -1.51 0.00 0.00 54.79 53.25 2c91 n ASP 65 Cb 0.05 0.00 -0.11 0.00 2.34 0.00 0.00 41.12 43.40 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 5.76 0.97 -3.45 0.00 1.35 -1.92 -3.46 112.91 112.16 2c91 h THR 67 Ca -0.30 -2.59 -0.53 0.00 -0.55 0.00 0.00 66.41 62.44 2c91 h THR 67 Cb 1.16 2.73 -0.02 0.00 -1.73 0.00 0.00 68.15 70.28 2c91 h THR 67 CO 0.24 0.84 0.37 -0.69 -0.25 0.00 0.00 175.52 176.03 2c91 s VAL 68 N -2.59 4.75 -0.03 6.82 1.01 -1.26 -4.88 120.40 124.21 2c91 s VAL 68 Ca -0.14 2.06 -0.01 0.00 0.00 0.00 0.00 61.98 63.89 2c91 s VAL 68 Cb 0.06 -4.32 -0.04 0.00 0.00 0.00 0.00 36.38 32.09 2c91 s VAL 68 CO 0.85 0.20 0.03 -0.54 0.00 0.00 0.00 175.10 175.64 2c91 s LYS 69 N 0.72 2.96 -0.05 2.72 -0.14 -0.03 -4.66 119.74 121.27 2c91 s LYS 69 Ca 0.51 -0.49 0.06 0.00 -1.36 0.00 0.00 55.97 54.69 2c91 s LYS 69 Cb -0.22 -2.79 -0.01 0.00 -1.68 0.00 0.00 37.83 33.13 2c91 s LYS 69 CO 0.29 0.66 -0.25 -1.50 -0.76 0.00 0.00 175.35 173.79 2c91 s ILE 70 N -1.06 2.02 -0.03 2.17 1.10 -1.26 -1.22 121.20 122.92 2c91 s ILE 70 Ca 0.18 -1.06 0.07 0.00 -0.51 0.00 0.00 60.65 59.34 2c91 s ILE 70 Cb -0.12 -1.70 -0.02 0.00 0.15 0.00 0.00 42.46 40.77 2c91 s ILE 70 CO 0.09 0.56 -0.24 0.00 -2.11 0.00 0.00 174.94 173.24 2c91 s ALA 71 N -0.26 2.22 0.29 1.50 0.00 -0.24 -1.50 121.76 123.77 2c91 s ALA 71 Ca -0.00 -1.09 0.04 0.00 0.00 0.00 0.00 51.96 50.91 2c91 s ALA 71 Cb -0.13 -0.63 -0.01 0.00 0.00 0.00 0.00 23.12 22.35 2c91 s ALA 71 CO 0.03 0.50 0.14 -2.37 0.00 0.00 0.00 175.76 174.06 2c91 n THR 72 N 2.56 0.00 -3.80 0.00 5.66 -0.59 -0.69 114.28 117.42 2c91 n THR 72 Ca -0.16 -1.82 -0.13 0.00 -3.05 0.00 0.00 64.05 58.89 2c91 n THR 72 Cb 0.51 0.73 -0.10 0.00 -1.55 0.00 0.00 70.33 69.92 2c91 n THR 72 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 175.07 171.48 2c91 s LYS 73 N -3.14 0.46 -0.09 1.09 1.02 -1.25 -0.70 119.74 117.13 2c91 s LYS 73 Ca 0.20 0.01 -0.01 0.00 0.02 0.00 0.00 55.97 56.19 2c91 s LYS 73 Cb 0.01 0.21 -0.03 0.00 -0.52 0.00 0.00 37.83 37.50 2c91 s LYS 73 CO 0.14 -0.10 -0.03 0.00 -0.92 0.00 0.00 175.35 174.44 2c91 s ALA 74 N -0.68 3.13 0.14 5.17 0.00 -0.03 -2.06 121.76 127.43 2c91 s ALA 74 Ca -0.08 -0.84 0.09 0.00 0.00 0.00 0.00 51.96 51.14 2c91 s ALA 74 Cb -0.04 -1.41 -0.04 0.00 0.00 0.00 0.00 23.12 21.63 2c91 s ALA 74 CO 0.02 0.51 -0.21 0.54 0.00 0.00 0.00 175.76 176.62 2c91 s ASN 75 N -0.62 2.82 0.00 0.00 2.20 -1.26 -1.15 114.94 116.93 2c91 s ASN 75 Ca 0.10 -0.78 0.25 0.00 -0.94 0.00 0.00 52.86 51.48 2c91 s ASN 75 Cb -0.12 -0.17 1.30 0.00 -2.00 0.00 0.00 41.25 40.26 2c91 s ASN 75 CO 0.02 0.05 1.86 -0.81 -2.94 0.00 0.00 177.10 175.28 2c91 n PRO 76 N 0.66 1.21 -1.80 3.55 -0.04 -1.26 -4.42 135.00 132.90 2c91 n PRO 76 Ca -0.16 -0.31 -0.29 0.00 -0.04 0.00 0.00 63.50 62.69 2c91 n PRO 76 Cb 0.55 -1.40 0.08 0.00 -0.04 0.00 0.00 33.50 32.69 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 -1.97 2.99 -1.53 0.54 0.51 -1.26 -1.28 118.94 116.94 2c91 s TRP 77 Ca 0.36 0.90 -0.13 0.00 -2.12 0.00 0.00 56.10 55.12 2c91 s TRP 77 Cb 0.18 -3.31 0.08 0.00 -0.81 0.00 0.00 33.47 29.61 2c91 s TRP 77 CO 0.29 -1.68 0.92 0.39 -0.51 0.00 0.00 176.95 176.36 2c91 n GLU 78 N -3.30 -5.15 -0.57 4.98 1.02 -1.26 -1.40 120.64 114.96 2c91 n GLU 78 Ca 0.07 0.57 0.00 0.00 -0.02 0.00 0.00 57.16 57.78 2c91 n GLU 78 Cb 0.59 -5.39 0.00 0.00 -0.02 0.00 0.00 31.44 26.62 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 -1.66 1.37 0.18 0.62 0.00 -1.26 -4.93 105.19 99.52 2c91 n GLY 79 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 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 3.07 0.51 -2.40 1.61 1.57 -1.14 -3.50 116.57 116.30 2c91 h LYS 80 Ca 0.00 -0.46 0.26 0.00 -1.87 0.00 0.00 60.65 58.58 2c91 h LYS 80 Cb 0.00 0.11 -0.11 0.00 0.08 0.00 0.00 32.23 32.31 2c91 h LYS 80 CO 0.00 1.10 -0.66 -1.13 -0.57 0.00 0.00 179.45 178.18 2c91 n SER 81 N -3.83 -6.14 -1.51 0.86 3.41 -0.40 -4.56 113.62 101.44 2c91 n SER 81 Ca -0.06 0.76 -0.12 0.00 -0.26 0.00 0.00 58.87 59.19 2c91 n SER 81 Cb 0.76 -3.34 0.18 0.00 -0.26 0.00 0.00 64.21 61.55 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 -3.78 4.93 -4.71 1.04 4.77 -1.26 -4.26 117.00 113.73 2c91 n LEU 82 Ca -0.03 -3.86 -0.34 0.00 -0.03 0.00 0.00 56.01 51.75 2c91 n LEU 82 Cb 0.48 -0.68 0.11 0.00 -2.33 0.00 0.00 43.42 41.00 2c91 n LEU 82 CO 0.02 1.31 0.79 -0.54 -1.33 0.00 0.00 177.39 177.64 2c91 s LYS 83 N -3.33 1.87 0.22 3.23 -0.14 -1.26 -4.32 119.74 116.00 2c91 s LYS 83 Ca 0.49 1.77 -0.10 0.00 -1.36 0.00 0.00 55.97 56.77 2c91 s LYS 83 Cb 0.43 -1.80 0.32 0.00 -1.68 0.00 0.00 37.83 35.10 2c91 s LYS 83 CO 0.02 -2.04 1.66 -1.35 -0.76 0.00 0.00 175.35 172.87 2c91 h PRO 84 N -0.61 0.11 -0.77 -1.68 0.11 -1.92 -1.36 132.00 125.88 2c91 h PRO 84 Ca -0.47 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.62 2c91 h PRO 84 Cb 1.30 -0.03 -0.04 0.00 0.11 0.00 0.00 31.00 32.35 2c91 h PRO 84 CO 0.48 0.07 0.41 -0.44 -0.21 0.00 0.00 178.00 178.31 2c91 h ASP 85 N 0.12 0.97 -0.07 -2.05 3.32 -1.98 -1.97 116.42 114.75 2c91 h ASP 85 Ca 0.34 -0.09 -0.01 0.00 0.02 0.00 0.00 57.03 57.29 2c91 h ASP 85 Cb 0.56 -0.25 -0.00 0.00 0.22 0.00 0.00 39.33 39.86 2c91 h ASP 85 CO -0.56 0.79 -0.01 -1.28 -1.72 0.00 0.00 179.24 176.46 2c91 h SER 86 N 1.08 0.13 -0.32 6.45 0.87 -1.59 -0.83 113.55 119.34 2c91 h SER 86 Ca 0.27 -0.36 0.06 0.00 -1.23 0.00 0.00 61.79 60.53 2c91 h SER 86 Cb 0.05 -0.03 -0.06 0.00 -0.44 0.00 0.00 62.40 61.91 2c91 h SER 86 CO -0.04 0.46 -0.08 0.40 -0.53 0.00 0.00 176.83 177.04 2c91 h ILE 87 N -0.21 0.68 -0.09 2.23 1.08 -1.20 -0.22 117.51 119.79 2c91 h ILE 87 Ca 0.02 0.00 0.01 0.00 -0.39 0.00 0.00 64.86 64.50 2c91 h ILE 87 Cb 0.40 0.68 -0.01 0.00 -3.07 0.00 0.00 36.82 34.82 2c91 h ILE 87 CO 0.01 0.00 0.01 -0.09 -0.69 0.00 0.00 178.15 177.39 2c91 h ARG 88 N -0.00 0.05 -0.39 2.37 2.43 -1.35 -1.53 114.38 115.95 2c91 h ARG 88 Ca 0.15 -0.00 0.01 0.00 -0.81 0.00 0.00 59.98 59.33 2c91 h ARG 88 Cb 0.23 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.75 2c91 h ARG 88 CO -0.33 0.03 0.25 1.03 -1.51 0.00 0.00 179.97 179.44 2c91 h SER 89 N 0.05 0.42 -0.23 -3.80 0.87 -0.68 -0.08 113.55 110.10 2c91 h SER 89 Ca 0.04 -0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.59 2c91 h SER 89 Cb 0.04 -0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 61.89 2c91 h SER 89 CO -0.06 0.30 0.14 1.56 -0.53 0.00 0.00 176.83 178.24 2c91 h GLN 90 N 0.50 0.31 -0.35 2.24 4.20 -0.96 -0.24 115.11 120.82 2c91 h GLN 90 Ca 0.15 -0.03 -0.03 0.00 0.06 0.00 0.00 58.65 58.80 2c91 h GLN 90 Cb -0.03 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 27.67 2c91 h GLN 90 CO -0.05 0.25 0.11 1.25 -0.67 0.00 0.00 178.83 179.72 2c91 h LEU 91 N 0.28 0.51 -1.20 1.46 5.85 -1.04 0.60 115.31 121.77 2c91 h LEU 91 Ca 0.08 -0.20 -0.02 0.00 0.84 0.00 0.00 57.88 58.57 2c91 h LEU 91 Cb 0.02 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 40.89 2c91 h LEU 91 CO -0.02 0.58 0.26 -0.33 -0.34 0.00 0.00 178.44 178.60 2c91 h GLU 92 N 0.42 0.82 -0.32 1.25 5.08 -0.87 0.41 114.58 121.37 2c91 h GLU 92 Ca 0.11 -0.11 -0.06 0.00 -1.00 0.00 0.00 59.36 58.31 2c91 h GLU 92 Cb 0.25 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 2c91 h GLU 92 CO -0.00 0.65 -0.02 1.15 -1.00 0.00 0.00 179.01 179.79 2c91 h THR 93 N 0.82 1.26 -0.24 1.13 2.02 -0.77 -2.63 112.91 114.50 2c91 h THR 93 Ca 0.20 -1.00 0.04 0.00 0.77 0.00 0.00 66.41 66.43 2c91 h THR 93 Cb 0.11 1.27 -0.04 0.00 -1.74 0.00 0.00 68.15 67.75 2c91 h THR 93 CO -0.02 0.33 -0.03 0.28 0.37 0.00 0.00 175.52 176.44 2c91 h SER 94 N 0.38 -0.15 -0.65 4.18 0.02 -0.21 -1.75 113.55 115.37 2c91 h SER 94 Ca 0.09 0.06 -0.01 0.00 -0.84 0.00 0.00 61.79 61.09 2c91 h SER 94 Cb 0.47 0.12 -0.03 0.00 0.14 0.00 0.00 62.40 63.10 2c91 h SER 94 CO 0.02 -0.05 0.37 -0.07 -1.14 0.00 0.00 176.83 175.96 2c91 h LEU 95 N 0.04 0.81 0.01 5.07 3.38 -0.92 0.77 115.31 124.48 2c91 h LEU 95 Ca 0.11 -0.06 -0.00 0.00 0.09 0.00 0.00 57.88 58.02 2c91 h LEU 95 Cb 0.16 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.70 2c91 h LEU 95 CO -0.21 0.65 -0.01 0.50 0.09 0.00 0.00 178.44 179.46 2c91 h LYS 96 N 0.93 -0.01 -0.65 1.13 3.64 -1.09 -0.82 116.57 119.69 2c91 h LYS 96 Ca 0.24 0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.54 2c91 h LYS 96 Cb 0.02 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 31.81 2c91 h LYS 96 CO -0.04 0.15 0.09 0.00 -2.27 0.00 0.00 179.45 177.38 2c91 h ARG 97 N -0.18 1.08 0.00 1.90 3.08 -0.90 -1.91 114.38 117.46 2c91 h ARG 97 Ca -0.00 -0.29 0.00 0.00 0.07 0.00 0.00 59.98 59.76 2c91 h ARG 97 Cb 0.17 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.09 2c91 h ARG 97 CO 0.00 1.00 0.00 1.28 -1.07 0.00 0.00 179.97 181.18 2c91 n LEU 98 N -4.21 0.02 -3.58 3.04 4.77 0.22 -3.89 117.00 113.38 2c91 n LEU 98 Ca 0.04 0.50 -0.20 0.00 -0.03 0.00 0.00 56.01 56.33 2c91 n LEU 98 Cb 0.30 -0.50 0.05 0.00 -2.33 0.00 0.00 43.42 40.94 2c91 n LEU 98 CO 0.43 -0.18 -0.00 0.00 -1.33 0.00 0.00 177.39 176.31 2c91 n GLN 99 N -1.52 -5.20 -3.88 3.23 6.02 -0.43 -4.26 117.38 111.34 2c91 n GLN 99 Ca 0.05 0.71 -0.10 0.00 -0.01 0.00 0.00 57.00 57.64 2c91 n GLN 99 Cb 0.23 -5.41 -0.09 0.00 1.02 0.00 0.00 30.24 25.99 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 3.52 0.00 -2.22 0.00 0.13 -1.83 -3.42 132.00 128.18 2c91 h PRO 101 Ca -0.32 0.00 0.06 0.00 -0.87 0.00 0.00 66.00 64.87 2c91 h PRO 101 Cb 1.19 0.00 -0.17 0.00 0.13 0.00 0.00 31.00 32.15 2c91 h PRO 101 CO 0.49 0.00 0.41 -0.98 -0.23 0.00 0.00 178.00 177.70 2c91 s ARG 102 N -3.19 0.89 0.14 0.86 1.70 -1.26 -4.62 118.95 113.46 2c91 s ARG 102 Ca 0.07 -0.16 0.03 0.00 -0.47 0.00 0.00 55.73 55.19 2c91 s ARG 102 Cb 0.10 0.41 -0.04 0.00 -0.57 0.00 0.00 34.95 34.86 2c91 s ARG 102 CO 0.69 -0.35 0.24 0.14 -1.08 0.00 0.00 175.30 174.93 2c91 s VAL 103 N -2.55 5.15 0.20 4.99 -7.23 -0.86 -3.92 120.40 116.19 2c91 s VAL 103 Ca 0.01 -0.73 0.05 0.00 -1.81 0.00 0.00 61.98 59.50 2c91 s VAL 103 Cb -0.01 -3.63 -0.11 0.00 0.56 0.00 0.00 36.38 33.20 2c91 s VAL 103 CO -0.05 -0.06 1.45 0.44 -0.31 0.00 0.00 175.10 176.57 2c91 h ASP 104 N 2.33 0.19 -3.25 4.85 3.32 -1.61 -1.16 116.42 121.08 2c91 h ASP 104 Ca -0.48 -0.14 -0.23 0.00 0.02 0.00 0.00 57.03 56.21 2c91 h ASP 104 Cb 1.19 -0.06 -0.32 0.00 0.22 0.00 0.00 39.33 40.37 2c91 h ASP 104 CO 0.68 0.89 -0.54 -0.22 -1.72 0.00 0.00 179.24 178.33 2c91 s LEU 105 N -7.51 0.31 -0.14 1.55 2.96 -0.98 -0.48 118.68 114.39 2c91 s LEU 105 Ca -0.02 0.45 0.01 0.00 -0.22 0.00 0.00 54.13 54.34 2c91 s LEU 105 Cb 0.11 0.57 0.02 0.00 0.50 0.00 0.00 46.19 47.39 2c91 s LEU 105 CO 0.81 -0.18 -0.15 0.12 -1.32 0.00 0.00 176.35 175.62 2c91 s PHE 106 N 1.57 2.19 0.03 5.38 5.36 -0.25 -1.54 117.98 130.71 2c91 s PHE 106 Ca -0.06 -1.20 0.00 0.00 -0.96 0.00 0.00 56.93 54.72 2c91 s PHE 106 Cb -0.11 -1.59 -0.04 0.00 -0.34 0.00 0.00 43.02 40.94 2c91 s PHE 106 CO -0.07 -0.64 0.11 0.71 -1.46 0.00 0.00 175.22 173.86 2c91 s TYR 107 N 1.36 3.32 -0.39 10.12 2.02 0.13 -0.39 117.35 133.51 2c91 s TYR 107 Ca 0.02 0.19 -0.27 0.00 -0.37 0.00 0.00 57.07 56.64 2c91 s TYR 107 Cb -0.13 -1.72 0.02 0.00 -0.40 0.00 0.00 41.96 39.73 2c91 s TYR 107 CO -0.09 0.56 1.01 -0.51 -1.57 0.00 0.00 175.55 174.95 2c91 s LEU 108 N -2.03 3.90 0.19 -1.29 1.43 -0.72 -0.85 118.68 119.31 2c91 s LEU 108 Ca 0.27 0.60 -0.02 0.00 -1.03 0.00 0.00 54.13 53.94 2c91 s LEU 108 Cb -0.12 -3.38 0.10 0.00 0.03 0.00 0.00 46.19 42.82 2c91 s LEU 108 CO 0.18 -0.97 1.49 -0.74 0.23 0.00 0.00 176.35 176.54 2c91 h HIS 109 N 8.63 0.64 -2.22 0.29 2.76 -1.37 -0.71 115.15 123.16 2c91 h HIS 109 Ca -0.23 -0.24 0.02 0.00 -2.20 0.00 0.00 60.37 57.72 2c91 h HIS 109 Cb 1.07 -0.11 -0.17 0.00 1.55 0.00 0.00 27.41 29.74 2c91 h HIS 109 CO 0.87 0.98 0.34 0.00 -1.30 0.00 0.00 177.93 178.81 2c91 s ALA 110 N -3.88 -1.77 0.50 5.26 0.00 -1.22 -4.27 121.76 116.38 2c91 s ALA 110 Ca -0.07 1.10 -0.23 0.00 0.00 0.00 0.00 51.96 52.77 2c91 s ALA 110 Cb 0.11 0.17 -0.07 0.00 0.00 0.00 0.00 23.12 23.32 2c91 s ALA 110 CO 0.84 -0.53 1.26 -2.30 0.00 0.00 0.00 175.76 175.03 2c91 n PRO 111 N 0.30 1.69 -3.64 0.00 -0.02 -1.26 -4.57 135.00 127.49 2c91 n PRO 111 Ca -0.14 0.61 -0.39 0.00 -2.02 0.00 0.00 63.50 61.56 2c91 n PRO 111 Cb 0.60 -2.42 -0.10 0.00 -0.02 0.00 0.00 33.50 31.56 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 -0.78 5.52 0.03 2.55 2.15 -1.26 -4.86 116.67 120.02 2c91 s ASP 112 Ca 0.67 -1.89 0.18 0.00 0.43 0.00 0.00 52.55 51.94 2c91 s ASP 112 Cb -0.46 -1.94 0.75 0.00 -0.30 0.00 0.00 42.92 40.97 2c91 s ASP 112 CO 0.53 -0.61 1.57 1.41 -0.17 0.00 0.00 175.17 177.89 2c91 n HIS 113 N 4.79 0.10 1.05 -5.34 8.25 -1.26 -2.64 115.22 120.17 2c91 n HIS 113 Ca -0.06 0.04 0.12 0.00 -0.26 0.00 0.00 57.72 57.55 2c91 n HIS 113 Cb 0.41 -0.56 0.16 0.00 1.12 0.00 0.00 29.99 31.12 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 -1.59 0.86 -4.19 0.41 7.64 -1.26 -4.79 113.62 110.70 2c91 n SER 114 Ca 0.04 -0.67 -0.34 0.00 1.01 0.00 0.00 58.87 58.91 2c91 n SER 114 Cb 0.21 0.44 -0.15 0.00 -1.01 0.00 0.00 64.21 63.69 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 -2.86 2.62 0.09 0.44 2.01 -1.08 -5.09 115.64 111.76 2c91 s THR 115 Ca 0.13 -0.86 -0.36 0.00 0.31 0.00 0.00 61.69 60.91 2c91 s THR 115 Cb 0.17 -2.20 -0.16 0.00 0.01 0.00 0.00 72.50 70.32 2c91 s THR 115 CO 0.70 0.40 1.39 -2.65 -0.69 0.00 0.00 174.62 173.78 2c91 n PRO 116 N 4.67 1.32 0.25 4.92 -0.02 -1.26 -4.83 135.00 140.05 2c91 n PRO 116 Ca -0.19 0.48 0.08 0.00 -2.02 0.00 0.00 63.50 61.84 2c91 n PRO 116 Cb 0.49 -2.14 0.61 0.00 -0.02 0.00 0.00 33.50 32.44 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 3.44 1.00 -0.98 -1.45 3.04 -1.97 -1.42 116.25 117.90 2c91 h VAL 117 Ca -0.47 -0.30 0.02 0.00 -1.01 0.00 0.00 66.70 64.95 2c91 h VAL 117 Cb 1.32 1.16 -0.05 0.00 -2.01 0.00 0.00 31.29 31.71 2c91 h VAL 117 CO 0.80 0.08 0.65 -0.33 -1.01 0.00 0.00 177.57 177.76 2c91 h GLU 118 N 0.00 1.25 -0.06 4.17 3.07 -1.99 0.69 114.58 121.71 2c91 h GLU 118 Ca -0.00 -0.07 0.01 0.00 -0.50 0.00 0.00 59.36 58.79 2c91 h GLU 118 Cb 0.16 -0.28 -0.01 0.00 -0.84 0.00 0.00 28.75 27.78 2c91 h GLU 118 CO 0.01 0.82 0.02 0.93 -1.40 0.00 0.00 179.01 179.39 2c91 h GLU 119 N 1.28 0.05 -0.07 2.33 5.08 -1.62 -0.78 114.58 120.85 2c91 h GLU 119 Ca 0.38 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.73 2c91 h GLU 119 Cb -0.07 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.17 2c91 h GLU 119 CO -0.10 0.03 0.04 1.15 -1.00 0.00 0.00 179.01 179.13 2c91 h THR 120 N 0.05 1.03 -0.37 1.13 2.02 -1.46 -2.61 112.91 112.70 2c91 h THR 120 Ca 0.02 -0.08 -0.09 0.00 0.77 0.00 0.00 66.41 67.03 2c91 h THR 120 Cb 0.01 0.96 -0.02 0.00 -1.74 0.00 0.00 68.15 67.37 2c91 h THR 120 CO -0.03 0.03 -0.15 -0.07 0.37 0.00 0.00 175.52 175.67 2c91 h LEU 121 N 0.08 0.67 -0.33 2.58 3.38 -0.66 -1.23 115.31 119.80 2c91 h LEU 121 Ca 0.03 -0.20 0.04 0.00 0.09 0.00 0.00 57.88 57.83 2c91 h LEU 121 Cb 0.01 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.55 2c91 h LEU 121 CO -0.01 0.84 0.12 0.00 0.09 0.00 0.00 178.44 179.48 2c91 h ALA 123 N 1.20 0.39 -0.86 0.00 0.00 -1.04 -1.38 119.26 117.57 2c91 h ALA 123 Ca 0.15 0.00 0.08 0.00 0.00 0.00 0.00 54.91 55.14 2c91 h ALA 123 Cb 0.11 -0.07 -0.07 0.00 0.00 0.00 0.00 17.79 17.77 2c91 h ALA 123 CO -0.15 -0.20 0.52 0.00 0.00 0.00 0.00 179.25 179.43 2c91 h HIS 125 N 0.92 0.28 -0.36 0.00 6.17 -0.78 -1.64 115.15 119.74 2c91 h HIS 125 Ca 0.39 0.00 0.07 0.00 0.71 0.00 0.00 60.37 61.55 2c91 h HIS 125 Cb 0.26 -0.09 -0.07 0.00 2.52 0.00 0.00 27.41 30.02 2c91 h HIS 125 CO -0.04 0.21 -0.11 0.37 0.71 0.00 0.00 177.93 179.07 2c91 h GLN 126 N 0.27 -0.03 -0.45 5.26 4.15 -0.48 -0.25 115.11 123.58 2c91 h GLN 126 Ca 0.08 0.00 -0.05 0.00 0.77 0.00 0.00 58.65 59.45 2c91 h GLN 126 Cb 0.01 0.01 -0.02 0.00 0.21 0.00 0.00 27.48 27.68 2c91 h GLN 126 CO -0.02 -0.02 0.07 -0.07 -1.93 0.00 0.00 178.83 176.86 2c91 h LEU 127 N -0.03 0.65 -0.34 -2.39 3.38 -1.04 -1.55 115.31 113.99 2c91 h LEU 127 Ca 0.18 -0.12 -0.03 0.00 0.09 0.00 0.00 57.88 58.00 2c91 h LEU 127 Cb 0.30 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 2c91 h LEU 127 CO -0.39 0.67 0.10 -0.74 0.09 0.00 0.00 178.44 178.17 2c91 h HIS 128 N 0.67 0.57 -0.47 1.13 2.76 -0.72 -1.69 115.15 117.40 2c91 h HIS 128 Ca 0.15 -0.06 0.09 0.00 -2.20 0.00 0.00 60.37 58.34 2c91 h HIS 128 Cb 0.31 -0.16 -0.03 0.00 1.55 0.00 0.00 27.41 29.08 2c91 h HIS 128 CO 0.01 0.57 0.32 1.96 -1.30 0.00 0.00 177.93 179.49 2c91 h GLN 129 N 0.40 0.23 0.00 5.26 1.08 -0.28 0.50 115.11 122.30 2c91 h GLN 129 Ca 0.11 -0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.30 2c91 h GLN 129 Cb 0.28 -0.05 0.00 0.00 -0.05 0.00 0.00 27.48 27.65 2c91 h GLN 129 CO -0.00 0.15 0.00 0.39 -0.95 0.00 0.00 178.83 178.42 2c91 n GLU 130 N -4.46 0.31 -0.68 1.46 1.02 -0.66 -4.91 120.64 112.73 2c91 n GLU 130 Ca 0.07 0.03 0.00 0.00 -0.02 0.00 0.00 57.16 57.24 2c91 n GLU 130 Cb 0.37 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.29 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 1.09 0.62 0.20 0.62 0.00 0.17 -4.96 105.19 102.93 2c91 n GLY 131 Ca 0.12 -0.39 0.11 0.00 0.00 0.00 0.00 46.02 45.86 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 0.94 0.00 -3.34 1.61 1.57 -1.48 -3.42 116.57 112.44 2c91 h LYS 132 Ca 0.00 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.70 2c91 h LYS 132 Cb 0.00 0.00 -0.16 0.00 0.08 0.00 0.00 32.23 32.15 2c91 h LYS 132 CO 0.00 0.04 -0.20 -0.59 -0.57 0.00 0.00 179.45 178.13 2c91 s PHE 133 N -3.21 -0.12 -0.16 -1.35 -0.71 -1.26 -2.02 117.98 109.15 2c91 s PHE 133 Ca 0.06 -0.08 -0.13 0.00 -1.04 0.00 0.00 56.93 55.73 2c91 s PHE 133 Cb 0.06 0.13 -0.08 0.00 -1.21 0.00 0.00 43.02 41.91 2c91 s PHE 133 CO 0.69 -0.56 -0.05 0.28 -1.34 0.00 0.00 175.22 174.24 2c91 n VAL 134 N 0.31 1.46 -4.39 -2.49 0.31 -0.44 -4.67 118.33 108.42 2c91 n VAL 134 Ca -0.18 0.13 -0.30 0.00 -0.01 0.00 0.00 64.34 63.98 2c91 n VAL 134 Cb 0.61 -2.27 -0.11 0.00 -0.91 0.00 0.00 33.84 31.16 2c91 n VAL 134 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 2c91 s GLU 135 N -2.29 2.11 -0.09 5.55 2.02 0.37 -5.01 118.70 121.38 2c91 s GLU 135 Ca -0.20 -1.00 -0.17 0.00 0.02 0.00 0.00 54.97 53.63 2c91 s GLU 135 Cb 0.03 -2.27 -0.05 0.00 0.10 0.00 0.00 34.13 31.95 2c91 s GLU 135 CO 0.35 0.53 0.44 -1.17 0.02 0.00 0.00 175.26 175.42 2c91 s LEU 136 N -1.87 4.33 0.24 1.80 2.96 -1.26 -1.09 118.68 123.78 2c91 s LEU 136 Ca 0.18 0.83 0.09 0.00 -0.22 0.00 0.00 54.13 55.01 2c91 s LEU 136 Cb -0.11 -2.63 -0.05 0.00 0.50 0.00 0.00 46.19 43.90 2c91 s LEU 136 CO 0.10 0.10 -0.16 -0.83 -1.32 0.00 0.00 176.35 174.24 2c91 s GLY 137 N 0.12 1.61 0.10 7.98 0.00 0.48 -0.18 107.32 117.43 2c91 s GLY 137 Ca 0.24 -1.75 0.10 0.00 0.00 0.00 0.00 44.72 43.32 2c91 s GLY 137 CO 0.11 -1.84 -0.27 1.08 0.00 0.00 0.00 173.10 172.18 2c91 s LEU 138 N -3.39 2.28 -0.04 0.66 1.43 -0.44 -1.75 118.68 117.42 2c91 s LEU 138 Ca 0.25 -0.70 -0.03 0.00 -1.03 0.00 0.00 54.13 52.63 2c91 s LEU 138 Cb -0.02 -1.24 0.02 0.00 0.03 0.00 0.00 46.19 44.98 2c91 s LEU 138 CO 0.10 0.20 0.10 -0.55 0.23 0.00 0.00 176.35 176.44 2c91 s SER 139 N -1.81 -0.08 -1.20 2.29 0.15 -0.27 -0.76 113.70 112.02 2c91 s SER 139 Ca 0.13 0.20 0.00 0.00 0.70 0.00 0.00 55.95 56.99 2c91 s SER 139 Cb -0.10 0.16 0.00 0.00 -1.71 0.00 0.00 66.02 64.37 2c91 s SER 139 CO 0.05 -0.07 0.00 0.59 1.20 0.00 0.00 173.24 175.00 2c91 n ASN 140 N 3.46 -4.33 -4.87 5.45 3.02 -1.24 -3.39 115.26 113.36 2c91 n ASN 140 Ca -0.18 0.26 -0.34 0.00 -0.03 0.00 0.00 54.58 54.30 2c91 n ASN 140 Cb 0.56 -2.88 -0.05 0.00 -0.61 0.00 0.00 39.78 36.80 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 -2.43 3.53 0.52 3.10 1.51 -1.26 -1.21 117.35 121.11 2c91 s TYR 141 Ca 0.00 0.85 -0.19 0.00 -1.01 0.00 0.00 57.07 56.72 2c91 s TYR 141 Cb 0.00 -2.22 -0.07 0.00 -0.11 0.00 0.00 41.96 39.56 2c91 s TYR 141 CO 0.00 0.42 1.08 0.00 -1.11 0.00 0.00 175.55 175.94 2c91 s ALA 142 N -1.55 2.78 0.27 3.71 0.00 -1.26 -4.72 121.76 120.98 2c91 s ALA 142 Ca 0.39 0.68 -0.01 0.00 0.00 0.00 0.00 51.96 53.02 2c91 s ALA 142 Cb -0.13 -3.30 0.60 0.00 0.00 0.00 0.00 23.12 20.29 2c91 s ALA 142 CO 0.20 -0.57 1.69 0.66 0.00 0.00 0.00 175.76 177.74 2c91 h SER 143 N 1.27 0.18 0.39 0.00 4.64 -1.93 0.15 113.55 118.24 2c91 h SER 143 Ca -0.49 0.15 -0.05 0.00 -0.47 0.00 0.00 61.79 60.92 2c91 h SER 143 Cb 1.24 0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 63.48 2c91 h SER 143 CO 0.58 -0.01 -0.25 4.11 -0.87 0.00 0.00 176.83 180.38 2c91 h TRP 144 N 0.35 0.00 -0.08 4.77 5.08 -1.94 -1.24 115.95 122.88 2c91 h TRP 144 Ca 0.49 0.00 -0.21 0.00 1.08 0.00 0.00 58.89 60.25 2c91 h TRP 144 Cb 0.88 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.04 2c91 h TRP 144 CO -0.20 0.25 -0.79 0.93 -1.28 0.00 0.00 178.44 177.35 2c91 h GLU 145 N 0.00 0.54 -0.39 0.12 5.08 -1.12 -2.03 114.58 116.77 2c91 h GLU 145 Ca -0.00 -0.46 -0.00 0.00 -1.00 0.00 0.00 59.36 57.89 2c91 h GLU 145 Cb 0.52 0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.85 2c91 h GLU 145 CO 0.03 1.09 0.23 0.28 -1.00 0.00 0.00 179.01 179.65 2c91 h VAL 146 N 0.35 1.13 -0.70 3.13 2.07 -0.84 -1.57 116.25 119.82 2c91 h VAL 146 Ca -0.05 -0.30 -0.02 0.00 0.82 0.00 0.00 66.70 67.15 2c91 h VAL 146 Cb 1.40 0.62 -0.03 0.00 -1.52 0.00 0.00 31.29 31.76 2c91 h VAL 146 CO 0.15 0.13 0.35 0.00 0.02 0.00 0.00 177.57 178.22 2c91 h ALA 147 N 1.10 0.90 -0.68 1.67 0.00 -1.19 -0.39 119.26 120.67 2c91 h ALA 147 Ca 0.14 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 2c91 h ALA 147 Cb 0.00 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.48 2c91 h ALA 147 CO -0.03 0.44 0.40 1.49 0.00 0.00 0.00 179.25 181.56 2c91 h GLU 148 N 0.97 0.92 -0.01 0.00 4.81 -1.29 -0.82 114.58 119.17 2c91 h GLU 148 Ca 0.24 -0.09 -0.00 0.00 -0.13 0.00 0.00 59.36 59.38 2c91 h GLU 148 Cb 0.09 -0.19 -0.00 0.00 0.63 0.00 0.00 28.75 29.28 2c91 h GLU 148 CO -0.03 0.66 0.00 0.82 -0.73 0.00 0.00 179.01 179.73 2c91 h ILE 149 N 0.92 1.20 -0.70 2.32 2.04 -0.87 -0.13 117.51 122.30 2c91 h ILE 149 Ca 0.24 -0.60 -0.01 0.00 1.00 0.00 0.00 64.86 65.49 2c91 h ILE 149 Cb -0.02 1.59 -0.03 0.00 -0.74 0.00 0.00 36.82 37.62 2c91 h ILE 149 CO -0.04 0.16 0.40 0.00 0.00 0.00 0.00 178.15 178.66 2c91 h THR 151 N 0.96 1.24 -0.36 0.00 2.02 -1.05 -1.80 112.91 113.91 2c91 h THR 151 Ca 0.25 -0.72 -0.03 0.00 0.77 0.00 0.00 66.41 66.67 2c91 h THR 151 Cb 0.01 0.47 -0.01 0.00 -1.74 0.00 0.00 68.15 66.88 2c91 h THR 151 CO -0.04 0.29 0.09 -0.07 0.37 0.00 0.00 175.52 176.16 2c91 h LEU 152 N 0.93 0.54 -0.26 2.58 3.38 -0.71 -2.47 115.31 119.31 2c91 h LEU 152 Ca 0.22 -0.22 0.02 0.00 0.09 0.00 0.00 57.88 57.99 2c91 h LEU 152 Cb 0.19 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 2c91 h LEU 152 CO -0.02 0.62 0.11 0.00 0.09 0.00 0.00 178.44 179.24 2c91 h LYS 154 N 0.24 -0.24 0.00 0.00 1.57 -1.27 -0.04 116.57 116.83 2c91 h LYS 154 Ca 0.11 0.02 -0.06 0.00 -1.87 0.00 0.00 60.65 58.85 2c91 h LYS 154 Cb 0.06 0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.41 2c91 h LYS 154 CO -0.09 -0.16 -0.28 0.66 -0.57 0.00 0.00 179.45 179.01 2c91 h SER 155 N -0.25 0.00 -0.36 0.86 4.64 -1.28 -3.13 113.55 114.03 2c91 h SER 155 Ca 0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 2c91 h SER 155 Cb 0.42 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.51 2c91 h SER 155 CO -0.31 0.28 0.00 0.59 -0.87 0.00 0.00 176.83 176.52 2c91 n ASN 156 N -3.63 3.43 -2.02 4.97 3.02 -0.31 -4.97 115.26 115.75 2c91 n ASN 156 Ca -0.01 -1.99 -0.18 0.00 -0.03 0.00 0.00 54.58 52.38 2c91 n ASN 156 Cb 0.40 -0.23 -0.01 0.00 -0.61 0.00 0.00 39.78 39.33 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 1.47 -0.33 3.90 7.41 0.00 -0.17 -5.02 105.19 112.45 2c91 n GLY 157 Ca 0.19 -0.14 -0.29 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.88 3.47 0.19 1.61 0.51 -0.38 -5.04 118.94 116.42 2c91 s TRP 158 Ca 0.00 0.65 -0.33 0.00 -2.12 0.00 0.00 56.10 54.30 2c91 s TRP 158 Cb 0.00 -2.10 -0.13 0.00 -0.81 0.00 0.00 33.47 30.43 2c91 s TRP 158 CO 0.00 0.23 1.59 1.51 -0.51 0.00 0.00 176.95 179.77 2c91 n ILE 159 N -0.69 0.16 -2.68 2.03 3.06 -1.26 -4.52 119.36 115.46 2c91 n ILE 159 Ca -0.02 -0.04 -0.36 0.00 -2.50 0.00 0.00 62.75 59.84 2c91 n ILE 159 Cb 0.53 -1.65 -0.05 0.00 0.54 0.00 0.00 39.64 39.01 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 0.80 4.15 0.43 9.51 2.01 -1.26 -4.94 118.68 129.38 2c91 s LEU 160 Ca 0.76 1.89 -0.24 0.00 0.01 0.00 0.00 54.13 56.55 2c91 s LEU 160 Cb -0.63 -4.22 -0.08 0.00 0.01 0.00 0.00 46.19 41.27 2c91 s LEU 160 CO 0.38 -0.34 1.21 -2.16 1.01 0.00 0.00 176.35 176.45 2c91 s PRO 161 N -2.54 3.87 0.00 1.29 0.04 -1.26 -4.47 135.00 131.93 2c91 s PRO 161 Ca 0.57 1.91 0.00 0.00 0.04 0.00 0.00 61.00 63.52 2c91 s PRO 161 Cb -0.18 -2.57 0.00 0.00 0.04 0.00 0.00 34.50 31.79 2c91 s PRO 161 CO 0.23 -0.50 0.17 0.25 0.04 0.00 0.00 177.00 177.19 2c91 n THR 162 N -0.19 0.00 -4.22 1.26 -2.24 0.74 -4.78 114.28 104.86 2c91 n THR 162 Ca 0.06 -0.45 -0.17 0.00 -2.27 0.00 0.00 64.05 61.22 2c91 n THR 162 Cb 0.46 1.04 -0.13 0.00 -2.10 0.00 0.00 70.33 69.60 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 -0.55 0.80 -0.09 2.28 1.01 -1.20 -1.30 120.40 121.35 2c91 s VAL 163 Ca 0.00 -0.88 0.02 0.00 0.00 0.00 0.00 61.98 61.12 2c91 s VAL 163 Cb 0.00 -0.76 0.01 0.00 0.00 0.00 0.00 36.38 35.63 2c91 s VAL 163 CO 0.00 -0.10 -0.16 -0.47 0.00 0.00 0.00 175.10 174.37 2c91 s TYR 164 N -0.88 1.87 -0.33 5.22 6.14 -0.13 -1.33 117.35 127.90 2c91 s TYR 164 Ca -0.02 -0.77 -0.08 0.00 0.64 0.00 0.00 57.07 56.84 2c91 s TYR 164 Cb -0.07 -1.32 0.02 0.00 0.42 0.00 0.00 41.96 41.01 2c91 s TYR 164 CO 0.01 -0.37 0.12 -1.14 0.64 0.00 0.00 175.55 174.81 2c91 s GLN 165 N 0.69 2.85 0.07 4.97 0.74 0.06 -0.95 119.66 128.09 2c91 s GLN 165 Ca -0.13 -1.03 0.03 0.00 0.05 0.00 0.00 55.36 54.28 2c91 s GLN 165 Cb -0.16 -3.50 -0.03 0.00 1.10 0.00 0.00 33.01 30.42 2c91 s GLN 165 CO 0.03 -0.59 -0.09 0.20 -0.55 0.00 0.00 175.29 174.29 2c91 s GLY 166 N 1.48 0.70 -0.18 2.59 0.00 -0.06 -3.69 107.32 108.17 2c91 s GLY 166 Ca 0.01 -1.03 -0.29 0.00 0.00 0.00 0.00 44.72 43.40 2c91 s GLY 166 CO 0.04 -1.10 1.59 -0.29 0.00 0.00 0.00 173.10 173.34 2c91 s MET 167 N -2.39 3.93 -0.24 2.90 1.75 -1.26 -1.15 119.30 122.84 2c91 s MET 167 Ca -0.00 1.78 -0.12 0.00 -1.25 0.00 0.00 55.69 56.09 2c91 s MET 167 Cb -0.05 -4.00 0.08 0.00 2.84 0.00 0.00 34.83 33.71 2c91 s MET 167 CO -0.00 -1.13 0.57 -0.47 -0.65 0.00 0.00 175.02 173.33 2c91 s TYR 168 N 4.76 -0.94 0.37 4.11 5.04 -0.96 -4.66 117.35 125.06 2c91 s TYR 168 Ca 0.70 1.85 -0.16 0.00 -2.44 0.00 0.00 57.07 57.02 2c91 s TYR 168 Cb -0.26 0.52 0.05 0.00 0.35 0.00 0.00 41.96 42.61 2c91 s TYR 168 CO 0.28 -0.49 0.77 0.54 -1.34 0.00 0.00 175.55 175.30 2c91 s ASN 169 N 1.86 0.01 0.56 4.32 2.20 -0.71 -4.00 114.94 119.18 2c91 s ASN 169 Ca -0.08 -1.10 0.24 0.00 -0.94 0.00 0.00 52.86 50.98 2c91 s ASN 169 Cb -0.08 0.83 1.54 0.00 -2.00 0.00 0.00 41.25 41.54 2c91 s ASN 169 CO -0.17 -1.63 2.16 0.00 -2.94 0.00 0.00 177.10 174.52 2c91 h ALA 170 N 2.01 1.85 -0.21 3.54 0.00 -1.85 -1.09 119.26 123.51 2c91 h ALA 170 Ca -0.30 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.60 2c91 h ALA 170 Cb 1.25 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.05 2c91 h ALA 170 CO 0.38 -0.12 0.00 0.25 0.00 0.00 0.00 179.25 179.77 2c91 n THR 171 N -4.15 1.27 -3.54 0.00 -2.24 -1.26 -4.47 114.28 99.89 2c91 n THR 171 Ca -0.01 -1.24 -0.29 0.00 -2.27 0.00 0.00 64.05 60.24 2c91 n THR 171 Cb 0.18 0.32 -0.15 0.00 -2.10 0.00 0.00 70.33 68.59 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 -1.43 -0.04 -0.03 4.28 2.01 -0.41 -4.82 115.64 115.19 2c91 s THR 172 Ca 0.20 -0.85 0.05 0.00 0.31 0.00 0.00 61.69 61.41 2c91 s THR 172 Cb 0.13 -1.00 0.07 0.00 0.01 0.00 0.00 72.50 71.72 2c91 s THR 172 CO 0.09 -0.75 0.96 0.54 -0.69 0.00 0.00 174.62 174.77 2c91 n ARG 173 N 5.14 0.53 -0.01 4.92 1.74 -1.26 -1.73 116.66 125.99 2c91 n ARG 173 Ca -0.04 -1.35 0.11 0.00 -0.77 0.00 0.00 57.85 55.79 2c91 n ARG 173 Cb 0.42 -0.78 0.53 0.00 -1.02 0.00 0.00 32.46 31.60 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 0.00 0.33 -0.08 5.56 4.15 -1.89 -1.31 115.11 121.86 2c91 h GLN 174 Ca 0.00 -0.02 0.02 0.00 0.77 0.00 0.00 58.65 59.42 2c91 h GLN 174 Cb 1.17 -0.07 -0.00 0.00 0.21 0.00 0.00 27.48 28.79 2c91 h GLN 174 CO 0.00 0.22 0.17 -0.39 -1.93 0.00 0.00 178.83 176.90 2c91 h VAL 175 N 0.34 0.22 -0.55 2.39 -1.51 -1.88 -3.22 116.25 112.05 2c91 h VAL 175 Ca 0.21 0.00 -0.11 0.00 -1.23 0.00 0.00 66.70 65.57 2c91 h VAL 175 Cb 0.40 0.84 -0.02 0.00 -2.13 0.00 0.00 31.29 30.39 2c91 h VAL 175 CO -0.05 0.00 -0.08 -0.33 -1.23 0.00 0.00 177.57 175.88 2c91 h GLU 176 N 0.00 1.01 -0.15 5.19 5.08 -1.63 -1.29 114.58 122.78 2c91 h GLU 176 Ca 0.04 -0.36 -0.08 0.00 -1.00 0.00 0.00 59.36 57.96 2c91 h GLU 176 Cb 0.38 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.56 2c91 h GLU 176 CO -0.00 1.04 -0.21 0.00 -1.00 0.00 0.00 179.01 178.84 2c91 h ALA 177 N 0.99 0.23 0.00 3.43 0.00 -1.77 -3.39 119.26 118.75 2c91 h ALA 177 Ca 0.15 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.69 2c91 h ALA 177 Cb 0.64 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.39 2c91 h ALA 177 CO 0.04 0.17 -0.81 0.39 0.00 0.00 0.00 179.25 179.05 2c91 n GLU 178 N -4.48 0.00 0.28 0.00 1.02 -1.25 -4.71 120.64 111.49 2c91 n GLU 178 Ca -0.06 0.00 -0.16 0.00 -0.02 0.00 0.00 57.16 56.92 2c91 n GLU 178 Cb 0.41 -0.81 -0.08 0.00 -0.02 0.00 0.00 31.44 30.94 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 -0.57 -0.32 -4.62 5.85 -1.73 -2.53 115.31 111.40 2c91 h LEU 179 Ca 0.00 -0.02 0.06 0.00 0.84 0.00 0.00 57.88 58.76 2c91 h LEU 179 Cb 0.81 0.15 -0.06 0.00 0.37 0.00 0.00 40.66 41.93 2c91 h LEU 179 CO 0.00 -0.34 -0.09 -0.07 -0.34 0.00 0.00 178.44 177.60 2c91 h LEU 180 N -0.76 -0.33 -1.54 2.25 4.07 -1.43 -0.43 115.31 117.14 2c91 h LEU 180 Ca -0.07 0.10 0.07 0.00 0.08 0.00 0.00 57.88 58.06 2c91 h LEU 180 Cb 0.56 0.21 -0.04 0.00 1.08 0.00 0.00 40.66 42.47 2c91 h LEU 180 CO 0.11 -0.12 0.41 -0.65 -1.08 0.00 0.00 178.44 177.11 2c91 h PRO 181 N -0.02 0.53 -0.29 1.13 0.11 -1.77 -0.70 132.00 130.99 2c91 h PRO 181 Ca 0.15 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 66.23 2c91 h PRO 181 Cb 0.25 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 31.23 2c91 h PRO 181 CO -0.33 0.35 0.16 0.00 -0.21 0.00 0.00 178.00 177.96 2c91 h LEU 183 N 0.35 0.77 -0.67 0.00 3.38 -0.39 -1.67 115.31 117.08 2c91 h LEU 183 Ca 0.10 -0.24 -0.11 0.00 0.09 0.00 0.00 57.88 57.73 2c91 h LEU 183 Cb 0.07 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 2c91 h LEU 183 CO -0.02 0.91 -0.14 0.03 0.09 0.00 0.00 178.44 179.32 2c91 h ARG 184 N 0.69 0.89 -0.64 1.13 2.47 -1.08 0.24 114.38 118.09 2c91 h ARG 184 Ca 0.11 -0.33 -0.02 0.00 -1.26 0.00 0.00 59.98 58.49 2c91 h ARG 184 Cb 0.62 -0.06 -0.03 0.00 -1.65 0.00 0.00 29.97 28.85 2c91 h ARG 184 CO 0.04 0.97 0.33 1.25 0.56 0.00 0.00 179.97 183.12 2c91 h HIS 185 N 0.79 0.89 -0.02 3.04 2.76 -0.86 -3.26 115.15 118.50 2c91 h HIS 185 Ca 0.12 -0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.26 2c91 h HIS 185 Cb 0.67 -0.28 0.00 0.00 1.55 0.00 0.00 27.41 29.34 2c91 h HIS 185 CO 0.04 0.65 -0.25 1.19 -1.30 0.00 0.00 177.93 178.27 2c91 n PHE 186 N -4.52 0.00 -1.27 5.26 3.72 -0.66 -4.97 117.46 115.01 2c91 n PHE 186 Ca 0.05 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.45 2c91 n PHE 186 Cb 0.10 -0.02 0.00 0.00 -0.94 0.00 0.00 39.48 38.62 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 1.35 1.01 3.89 1.37 0.00 0.05 -5.03 105.19 107.84 2c91 n GLY 187 Ca 0.12 -0.51 -0.36 0.00 0.00 0.00 0.00 46.02 45.28 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 -0.14 4.38 0.33 0.99 1.02 0.61 -4.85 118.68 121.03 2c91 s LEU 188 Ca 0.00 0.43 -0.04 0.00 0.02 0.00 0.00 54.13 54.54 2c91 s LEU 188 Cb 0.00 -2.27 -0.05 0.00 0.02 0.00 0.00 46.19 43.89 2c91 s LEU 188 CO 0.00 0.36 0.60 0.00 0.02 0.00 0.00 176.35 177.32 2c91 s ARG 189 N -1.36 3.59 -0.13 1.70 1.70 -0.42 -4.45 118.95 119.58 2c91 s ARG 189 Ca 0.20 -0.02 0.01 0.00 -0.47 0.00 0.00 55.73 55.45 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 0.09 0.13 -0.18 0.12 -1.08 0.00 0.00 175.30 174.39 2c91 s PHE 190 N -2.24 2.71 -0.20 5.89 5.36 -1.26 -0.96 117.98 127.28 2c91 s PHE 190 Ca 0.44 -0.91 -0.04 0.00 -0.96 0.00 0.00 56.93 55.46 2c91 s PHE 190 Cb -0.10 -1.81 -0.02 0.00 -0.34 0.00 0.00 43.02 40.75 2c91 s PHE 190 CO 0.33 -0.36 -0.03 0.71 -1.46 0.00 0.00 175.22 174.41 2c91 s TYR 191 N 0.48 2.98 -0.23 10.12 1.51 -0.13 -1.26 117.35 130.82 2c91 s TYR 191 Ca -0.12 -0.69 -0.18 0.00 -1.01 0.00 0.00 57.07 55.07 2c91 s TYR 191 Cb -0.16 -2.07 -0.03 0.00 -0.11 0.00 0.00 41.96 39.59 2c91 s TYR 191 CO 0.05 -0.38 0.50 0.00 -1.11 0.00 0.00 175.55 174.62 2c91 s ALA 192 N 1.15 3.56 0.41 3.71 0.00 -0.46 -0.88 121.76 129.27 2c91 s ALA 192 Ca 0.02 -0.50 0.08 0.00 0.00 0.00 0.00 51.96 51.56 2c91 s ALA 192 Cb -0.15 -2.83 -0.01 0.00 0.00 0.00 0.00 23.12 20.14 2c91 s ALA 192 CO -0.00 -0.55 0.42 1.52 0.00 0.00 0.00 175.76 177.15 2c91 s TYR 193 N 1.89 2.75 -1.50 0.00 -0.85 -0.30 -0.83 117.35 118.49 2c91 s TYR 193 Ca 0.22 -0.46 -0.13 0.00 -0.52 0.00 0.00 57.07 56.19 2c91 s TYR 193 Cb -0.15 -2.20 0.08 0.00 0.38 0.00 0.00 41.96 40.06 2c91 s TYR 193 CO 0.09 -0.18 0.94 0.09 -1.52 0.00 0.00 175.55 174.97 2c91 n ASN 194 N -1.61 -4.95 0.06 -0.18 5.03 -1.26 -2.28 115.26 110.08 2c91 n ASN 194 Ca 0.04 -0.70 0.07 0.00 0.87 0.00 0.00 54.58 54.86 2c91 n ASN 194 Cb 0.61 -3.95 0.31 0.00 -1.02 0.00 0.00 39.78 35.73 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 -4.59 0.07 -0.25 3.52 -0.04 -1.26 -0.25 135.00 132.20 2c91 n PRO 195 Ca 0.03 0.45 0.09 0.00 -0.04 0.00 0.00 63.50 64.02 2c91 n PRO 195 Cb 0.53 -1.68 0.18 0.00 -0.04 0.00 0.00 33.50 32.50 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 -1.82 2.90 -3.69 1.53 4.77 -1.26 -4.63 117.00 114.80 2c91 n LEU 196 Ca 0.01 -3.17 -0.21 0.00 -0.03 0.00 0.00 56.01 52.61 2c91 n LEU 196 Cb 0.10 -0.48 0.04 0.00 -2.33 0.00 0.00 43.42 40.74 2c91 n LEU 196 CO 0.10 0.78 -0.05 0.00 -1.33 0.00 0.00 177.39 176.89 2c91 n ALA 197 N -1.14 -1.98 -1.15 -1.18 0.00 0.65 -0.81 120.51 114.90 2c91 n ALA 197 Ca 0.19 -0.15 -0.05 0.00 0.00 0.00 0.00 53.44 53.43 2c91 n ALA 197 Cb 0.74 -2.07 -0.02 0.00 0.00 0.00 0.00 19.45 18.09 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 -1.56 0.59 0.00 0.00 0.00 -1.26 -1.66 105.19 101.30 2c91 n GLY 198 Ca -0.29 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.06 0.78 0.36 -0.02 0.00 0.01 -4.74 105.19 101.52 2c91 n GLY 199 Ca -0.05 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.00 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 0.95 -0.01 0.99 5.85 -0.34 -2.06 115.31 120.70 2c91 h LEU 200 Ca 0.00 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.74 2c91 h LEU 200 Cb 0.00 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 40.85 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 -4.57 0.01 0.12 2.25 4.77 -0.29 -1.62 117.00 117.66 2c91 n LEU 201 Ca 0.16 -0.00 0.12 0.00 -0.03 0.00 0.00 56.01 56.26 2c91 n LEU 201 Cb 0.23 -0.00 0.27 0.00 -2.33 0.00 0.00 43.42 41.59 2c91 n LEU 201 CO 0.30 0.00 0.70 0.71 -1.33 0.00 0.00 177.39 177.77 2c91 h THR 202 N 0.00 0.00 0.00 -5.08 1.35 -1.58 -3.26 112.91 104.34 2c91 h THR 202 Ca 0.00 -0.64 0.00 0.00 -0.55 0.00 0.00 66.41 65.22 2c91 h THR 202 Cb 0.00 1.51 0.00 0.00 -1.73 0.00 0.00 68.15 67.94 2c91 h THR 202 CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 2c91 n GLY 203 N 1.26 0.39 0.00 5.82 0.00 -0.64 -4.26 105.19 107.75 2c91 n GLY 203 Ca 0.04 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.20 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 -1.89 0.12 -4.24 1.61 2.85 -1.26 -4.84 118.16 110.50 2c91 n LYS 204 Ca 0.00 -0.01 -0.24 0.00 -1.05 0.00 0.00 58.31 57.02 2c91 n LYS 204 Cb 0.13 -1.50 -0.07 0.00 -0.65 0.00 0.00 35.03 32.94 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 -2.88 2.81 0.06 5.58 2.02 -1.26 -5.13 117.35 118.54 2c91 s TYR 205 Ca 0.18 -0.18 0.08 0.00 -0.37 0.00 0.00 57.07 56.78 2c91 s TYR 205 Cb 0.19 -1.28 -0.03 0.00 -0.40 0.00 0.00 41.96 40.43 2c91 s TYR 205 CO 0.52 0.57 -0.18 0.15 -1.57 0.00 0.00 175.55 175.04 2c91 s LYS 206 N -3.48 1.99 0.43 -0.62 -0.14 -1.26 -5.05 119.74 111.60 2c91 s LYS 206 Ca 0.30 -1.04 0.20 0.00 -1.36 0.00 0.00 55.97 54.07 2c91 s LYS 206 Cb -0.08 -2.17 1.14 0.00 -1.68 0.00 0.00 37.83 35.05 2c91 s LYS 206 CO 0.20 0.52 1.82 -0.92 -0.76 0.00 0.00 175.35 176.22 2c91 h TYR 207 N 4.30 0.52 -0.00 3.18 5.03 -1.98 -0.81 116.97 127.21 2c91 h TYR 207 Ca -0.48 0.02 0.00 0.00 2.58 0.00 0.00 58.73 60.84 2c91 h TYR 207 Cb 1.16 -0.15 0.00 0.00 1.55 0.00 0.00 36.73 39.28 2c91 h TYR 207 CO 0.55 0.10 -0.04 -0.85 -1.32 0.00 0.00 178.16 176.61 2c91 n GLU 208 N -4.52 0.41 0.12 1.82 0.00 -1.26 -2.86 120.64 114.36 2c91 n GLU 208 Ca 0.22 -0.04 0.20 0.00 0.00 0.00 0.00 57.16 57.53 2c91 n GLU 208 Cb 0.81 -1.50 0.74 0.00 0.00 0.00 0.00 31.44 31.49 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 0.11 0.00 0.58 -1.84 3.32 -1.54 -1.34 116.42 115.70 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 0.33 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.87 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 -1.74 0.13 116.57 120.62 2c91 h LYS 210 Ca 0.17 0.00 -0.20 0.00 -2.00 0.00 0.00 60.65 58.62 2c91 h LYS 210 Cb 1.08 0.00 -0.04 0.00 -0.90 0.00 0.00 32.23 32.38 2c91 h LYS 210 CO -0.00 0.34 -1.49 -0.25 -2.00 0.00 0.00 179.45 176.04 2c91 n ASP 211 N -3.76 0.88 0.00 7.07 8.00 -0.53 -4.80 116.55 123.41 2c91 n ASP 211 Ca -0.01 0.39 0.00 0.00 0.71 0.00 0.00 54.79 55.88 2c91 n ASP 211 Cb 0.43 0.08 0.00 0.00 -0.02 0.00 0.00 41.12 41.60 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 1.44 0.67 0.24 0.44 0.00 -1.05 -4.93 105.19 102.00 2c91 n GLY 212 Ca -0.12 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.85 2c91 n GLY 212 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2c91 h LYS 213 N 0.00 -0.09 -6.35 1.61 3.64 -1.79 -3.47 116.57 110.13 2c91 h LYS 213 Ca 0.00 0.01 -0.44 0.00 -1.27 0.00 0.00 60.65 58.94 2c91 h LYS 213 Cb 0.00 0.02 0.06 0.00 -0.41 0.00 0.00 32.23 31.90 2c91 h LYS 213 CO 0.00 -0.06 -0.92 1.04 -2.27 0.00 0.00 179.45 177.24 2c91 n GLN 214 N -5.37 -1.07 -2.03 1.90 6.02 0.46 -4.83 117.38 112.45 2c91 n GLN 214 Ca 0.03 0.47 -0.42 0.00 -0.01 0.00 0.00 57.00 57.06 2c91 n GLN 214 Cb 0.28 -3.78 -0.03 0.00 1.02 0.00 0.00 30.24 27.74 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 -6.00 4.22 0.28 -1.09 0.04 -1.26 -4.91 135.00 126.27 2c91 s PRO 215 Ca 0.42 2.20 -0.30 0.00 0.04 0.00 0.00 61.00 63.35 2c91 s PRO 215 Cb -0.17 -3.65 -0.13 0.00 0.04 0.00 0.00 34.50 30.59 2c91 s PRO 215 CO 0.88 -0.70 1.44 0.28 0.04 0.00 0.00 177.00 178.93 2c91 n VAL 216 N 4.83 1.18 -1.94 -0.36 0.31 -1.26 -4.20 118.33 116.89 2c91 n VAL 216 Ca 0.15 -0.30 0.00 0.00 -0.01 0.00 0.00 64.34 64.19 2c91 n VAL 216 Cb 0.42 -1.63 0.00 0.00 -0.91 0.00 0.00 33.84 31.72 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 1.87 0.00 0.36 2.92 0.00 -0.93 -4.91 105.19 104.50 2c91 n GLY 217 Ca 0.09 -1.30 0.17 0.00 0.00 0.00 0.00 46.02 44.98 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 0.60 -0.01 1.61 9.65 -1.87 -2.02 114.38 122.35 2c91 h ARG 218 Ca 0.00 -0.04 0.00 0.00 -1.10 0.00 0.00 59.98 58.84 2c91 h ARG 218 Cb 0.00 -0.13 0.00 0.00 -1.39 0.00 0.00 29.97 28.45 2c91 h ARG 218 CO 0.00 0.40 -0.59 1.19 2.80 0.00 0.00 179.97 183.77 2c91 n PHE 219 N -4.79 0.00 -3.72 2.20 3.01 -1.26 -4.31 117.46 108.59 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 0.70 -0.05 -0.14 0.00 -0.01 0.00 0.00 39.48 39.98 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 -2.69 -0.26 0.00 1.38 0.08 -0.76 -4.69 117.98 111.04 2c91 s PHE 220 Ca 0.16 0.68 0.00 0.00 0.12 0.00 0.00 56.93 57.88 2c91 s PHE 220 Cb 0.18 -0.04 0.00 0.00 -0.57 0.00 0.00 43.02 42.59 2c91 s PHE 220 CO 0.66 -0.22 0.00 0.41 -0.10 0.00 0.00 175.22 175.97 2c91 n GLY 221 N 4.43 2.20 3.76 4.36 0.00 -1.26 -2.20 105.19 116.49 2c91 n GLY 221 Ca -0.22 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.52 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 -1.65 4.30 0.43 1.61 2.20 -1.26 -5.04 114.94 115.53 2c91 s ASN 222 Ca 0.00 -1.34 0.21 0.00 -0.94 0.00 0.00 52.86 50.79 2c91 s ASN 222 Cb 0.00 0.04 0.97 0.00 -2.00 0.00 0.00 41.25 40.26 2c91 s ASN 222 CO 0.00 -0.75 1.87 0.78 -2.94 0.00 0.00 177.10 176.07 2c91 h ASN 223 N 1.31 0.00 -0.10 3.54 2.35 -1.97 -2.42 115.58 118.29 2c91 h ASN 223 Ca -0.42 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.33 2c91 h ASN 223 Cb 1.28 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.65 2c91 h ASN 223 CO 0.70 0.27 0.00 0.79 -1.65 0.00 0.00 177.43 177.54 2c91 n TRP 224 N -3.65 0.11 -0.09 1.19 7.02 -1.26 -4.57 117.44 116.18 2c91 n TRP 224 Ca -0.01 -0.05 -0.09 0.00 -1.02 0.00 0.00 57.50 56.32 2c91 n TRP 224 Cb 0.39 0.00 -0.02 0.00 -2.42 0.00 0.00 31.31 29.26 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 4.39 0.38 -0.86 6.99 0.00 -1.62 -1.13 119.26 127.41 2c91 h ALA 225 Ca 0.00 -0.06 0.06 0.00 0.00 0.00 0.00 54.91 54.91 2c91 h ALA 225 Cb 0.68 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 18.29 2c91 h ALA 225 CO 0.00 -0.10 0.53 1.49 0.00 0.00 0.00 179.25 181.17 2c91 h GLU 226 N 0.37 0.94 -0.42 0.00 4.57 -1.80 0.55 114.58 118.78 2c91 h GLU 226 Ca 0.11 -0.06 -0.01 0.00 -1.18 0.00 0.00 59.36 58.22 2c91 h GLU 226 Cb 0.04 -0.21 -0.02 0.00 -0.16 0.00 0.00 28.75 28.40 2c91 h GLU 226 CO -0.02 0.62 0.24 1.15 -1.18 0.00 0.00 179.01 179.83 2c91 h THR 227 N 0.96 1.14 -0.77 0.32 2.02 -1.70 0.64 112.91 115.53 2c91 h THR 227 Ca 0.38 -0.35 -0.03 0.00 0.77 0.00 0.00 66.41 67.17 2c91 h THR 227 Cb 0.19 0.61 -0.04 0.00 -1.74 0.00 0.00 68.15 67.18 2c91 h THR 227 CO -0.18 0.15 0.35 1.88 0.37 0.00 0.00 175.52 178.09 2c91 h TYR 228 N 0.55 1.12 -0.56 3.16 -1.99 -0.45 -0.38 116.97 118.42 2c91 h TYR 228 Ca 0.15 -0.06 -0.10 0.00 2.00 0.00 0.00 58.73 60.73 2c91 h TYR 228 Cb 0.03 -0.35 -0.02 0.00 2.00 0.00 0.00 36.73 38.39 2c91 h TYR 228 CO -0.03 0.82 -0.03 0.00 -0.00 0.00 0.00 178.16 178.92 2c91 h ARG 229 N 1.10 1.01 -0.44 4.88 3.08 -0.42 -0.85 114.38 122.75 2c91 h ARG 229 Ca 0.26 -0.34 -0.04 0.00 0.07 0.00 0.00 59.98 59.94 2c91 h ARG 229 Cb 0.14 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.08 2c91 h ARG 229 CO -0.03 1.02 0.12 -0.91 -1.07 0.00 0.00 179.97 179.09 2c91 h ASN 230 N 0.89 0.61 -0.05 7.04 2.35 -0.70 -0.55 115.58 125.17 2c91 h ASN 230 Ca 0.15 -0.09 -0.03 0.00 -0.55 0.00 0.00 56.30 55.78 2c91 h ASN 230 Cb 0.59 -0.16 -0.00 0.00 0.05 0.00 0.00 38.32 38.80 2c91 h ASN 230 CO 0.03 0.60 -0.08 -0.09 -1.65 0.00 0.00 177.43 176.24 2c91 h ARG 231 N 0.64 0.15 0.00 0.81 2.43 -0.42 -3.42 114.38 114.58 2c91 h ARG 231 Ca 0.15 -0.09 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 2c91 h ARG 231 Cb 0.23 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.79 2c91 h ARG 231 CO -0.00 0.64 -0.64 1.19 -1.51 0.00 0.00 179.97 179.65 2c91 n PHE 232 N -4.70 0.00 -2.50 2.20 0.99 -0.38 -4.40 117.46 108.67 2c91 n PHE 232 Ca -0.08 0.00 -0.43 0.00 -0.00 0.00 0.00 57.45 56.94 2c91 n PHE 232 Cb 0.33 0.00 0.00 0.00 -1.00 0.00 0.00 39.48 38.81 2c91 n PHE 232 CO 0.00 0.00 0.00 1.87 -0.00 0.00 0.00 176.76 178.63 2c91 n TRP 233 N -0.99 4.50 -4.47 1.38 -0.00 -0.22 -4.81 117.44 112.84 2c91 n TRP 233 Ca 0.00 -2.93 -0.20 0.00 -0.00 0.00 0.00 57.50 54.37 2c91 n TRP 233 Cb 0.02 -2.55 -0.14 0.00 -0.00 0.00 0.00 31.31 28.64 2c91 n TRP 233 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 177.69 177.84 2c91 s LYS 234 N 3.61 0.95 0.21 5.87 1.02 -1.26 -4.83 119.74 125.31 2c91 s LYS 234 Ca 0.51 -0.54 -0.11 0.00 0.02 0.00 0.00 55.97 55.85 2c91 s LYS 234 Cb 0.05 -0.93 0.27 0.00 -0.52 0.00 0.00 37.83 36.70 2c91 s LYS 234 CO 0.04 0.25 1.67 0.93 -0.92 0.00 0.00 175.35 177.32 2c91 h GLU 235 N 5.53 0.12 -0.26 1.68 5.08 -1.98 0.18 114.58 124.92 2c91 h GLU 235 Ca -0.34 -0.01 0.04 0.00 -1.00 0.00 0.00 59.36 58.05 2c91 h GLU 235 Cb 1.17 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.38 2c91 h GLU 235 CO 0.47 0.08 0.18 0.45 -1.00 0.00 0.00 179.01 179.20 2c91 h HIS 236 N 0.13 0.16 -0.30 4.33 3.86 -1.97 -1.07 115.15 120.29 2c91 h HIS 236 Ca 0.31 0.00 -0.07 0.00 -1.16 0.00 0.00 60.37 59.44 2c91 h HIS 236 Cb 0.48 -0.05 -0.01 0.00 1.06 0.00 0.00 27.41 28.89 2c91 h HIS 236 CO -0.35 0.09 -0.10 1.25 0.86 0.00 0.00 177.93 179.68 2c91 h HIS 237 N 0.16 0.69 -0.42 2.45 -0.00 -0.98 0.43 115.15 117.47 2c91 h HIS 237 Ca 0.12 -0.16 0.01 0.00 -0.00 0.00 0.00 60.37 60.34 2c91 h HIS 237 Cb 0.26 -0.16 -0.02 0.00 -0.00 0.00 0.00 27.41 27.48 2c91 h HIS 237 CO -0.00 0.81 0.27 0.74 -0.00 0.00 0.00 177.93 179.75 2c91 h PHE 238 N 0.37 0.52 -0.77 5.26 -1.00 -0.82 -0.73 116.94 119.77 2c91 h PHE 238 Ca 0.07 0.01 0.05 0.00 2.81 0.00 0.00 57.97 60.92 2c91 h PHE 238 Cb 0.61 -0.17 -0.05 0.00 3.61 0.00 0.00 35.95 39.94 2c91 h PHE 238 CO 0.05 0.32 0.47 0.93 -1.61 0.00 0.00 178.31 178.47 2c91 h GLU 239 N 0.56 0.85 -0.52 1.51 5.08 -1.05 -1.39 114.58 119.61 2c91 h GLU 239 Ca 0.16 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.45 2c91 h GLU 239 Cb -0.05 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 28.99 2c91 h GLU 239 CO -0.04 0.56 0.25 0.00 -1.00 0.00 0.00 179.01 178.78 2c91 h ALA 240 N 1.36 0.67 -0.62 3.43 0.00 -0.50 -1.80 119.26 121.81 2c91 h ALA 240 Ca 0.33 -0.12 -0.08 0.00 0.00 0.00 0.00 54.91 55.04 2c91 h ALA 240 Cb 0.13 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 2c91 h ALA 240 CO -0.16 0.24 0.09 0.82 0.00 0.00 0.00 179.25 180.24 2c91 h ILE 241 N 0.70 1.26 -0.53 0.00 2.04 -0.72 -2.78 117.51 117.48 2c91 h ILE 241 Ca 0.18 -1.03 -0.01 0.00 1.00 0.00 0.00 64.86 65.00 2c91 h ILE 241 Cb 0.12 0.72 -0.03 0.00 -0.74 0.00 0.00 36.82 36.89 2c91 h ILE 241 CO -0.02 0.38 0.28 0.00 0.00 0.00 0.00 178.15 178.78 2c91 h ALA 242 N 1.02 1.50 -0.29 1.87 0.00 -0.76 -0.44 119.26 122.15 2c91 h ALA 242 Ca 0.19 -0.09 0.02 0.00 0.00 0.00 0.00 54.91 55.02 2c91 h ALA 242 Cb 0.45 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 2c91 h ALA 242 CO 0.01 0.41 0.14 1.25 0.00 0.00 0.00 179.25 181.07 2c91 h LEU 243 N 0.73 0.20 -0.34 0.00 7.12 -1.10 -0.70 115.31 121.22 2c91 h LEU 243 Ca 0.19 0.01 -0.19 0.00 0.13 0.00 0.00 57.88 58.02 2c91 h LEU 243 Cb 0.04 -0.02 0.00 0.00 -0.53 0.00 0.00 40.66 40.15 2c91 h LEU 243 CO -0.03 0.15 -0.63 0.58 -0.13 0.00 0.00 178.44 178.38 2c91 h VAL 244 N 0.29 1.30 -1.00 1.05 2.07 -1.11 -1.97 116.25 116.89 2c91 h VAL 244 Ca 0.12 -1.86 0.01 0.00 0.82 0.00 0.00 66.70 65.79 2c91 h VAL 244 Cb 0.04 1.82 -0.05 0.00 -1.52 0.00 0.00 31.29 31.58 2c91 h VAL 244 CO -0.09 0.59 0.66 -0.33 0.02 0.00 0.00 177.57 178.42 2c91 h GLU 245 N 0.52 1.31 -0.68 1.57 5.08 -0.89 0.04 114.58 121.52 2c91 h GLU 245 Ca -0.01 -0.08 -0.07 0.00 -1.00 0.00 0.00 59.36 58.20 2c91 h GLU 245 Cb 1.22 -0.29 -0.03 0.00 0.50 0.00 0.00 28.75 30.15 2c91 h GLU 245 CO 0.13 0.86 0.16 -0.22 -1.00 0.00 0.00 179.01 178.94 2c91 h LYS 246 N 1.35 1.10 -0.37 2.33 3.64 -0.97 -2.26 116.57 121.39 2c91 h LYS 246 Ca 0.37 -0.27 -0.10 0.00 -1.27 0.00 0.00 60.65 59.38 2c91 h LYS 246 Cb -0.15 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.52 2c91 h LYS 246 CO -0.08 0.98 -0.20 0.00 -2.27 0.00 0.00 179.45 177.87 2c91 h ALA 247 N 1.07 0.96 -0.15 5.00 0.00 -0.59 -1.80 119.26 123.76 2c91 h ALA 247 Ca 0.21 -0.35 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 2c91 h ALA 247 Cb 0.38 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 2c91 h ALA 247 CO 0.00 0.60 0.05 -0.07 0.00 0.00 0.00 179.25 179.84 2c91 h LEU 248 N 0.62 0.21 -0.32 0.00 3.38 -0.86 0.64 115.31 118.98 2c91 h LEU 248 Ca 0.09 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 2c91 h LEU 248 Cb 0.68 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.36 2c91 h LEU 248 CO 0.05 0.34 0.15 1.56 0.09 0.00 0.00 178.44 180.63 2c91 h GLN 249 N 0.08 0.46 -0.61 1.13 1.08 -1.35 -0.11 115.11 115.79 2c91 h GLN 249 Ca 0.05 -0.07 -0.04 0.00 -1.45 0.00 0.00 58.65 57.14 2c91 h GLN 249 Cb 0.20 -0.08 -0.03 0.00 -0.05 0.00 0.00 27.48 27.52 2c91 h GLN 249 CO -0.00 0.44 0.24 1.15 -0.95 0.00 0.00 178.83 179.70 2c91 h THR 250 N 0.37 1.23 0.09 -0.54 2.02 -1.26 0.16 112.91 114.98 2c91 h THR 250 Ca 0.11 -0.73 -0.25 0.00 0.77 0.00 0.00 66.41 66.30 2c91 h THR 250 Cb 0.13 0.57 0.00 0.00 -1.74 0.00 0.00 68.15 67.12 2c91 h THR 250 CO -0.01 0.28 -1.14 0.74 0.37 0.00 0.00 175.52 175.77 2c91 h THR 251 N 0.85 1.50 0.00 3.16 2.02 -0.73 -3.39 112.91 116.31 2c91 h THR 251 Ca 0.20 -2.93 0.00 0.00 0.77 0.00 0.00 66.41 64.45 2c91 h THR 251 Cb 0.21 2.80 0.00 0.00 -1.74 0.00 0.00 68.15 69.42 2c91 h THR 251 CO -0.02 0.86 -0.72 -1.22 0.37 0.00 0.00 175.52 174.80 2c91 n TYR 252 N -3.57 0.00 0.00 3.16 4.01 -0.07 -5.08 117.16 115.60 2c91 n TYR 252 Ca -0.07 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.67 2c91 n TYR 252 Cb 0.96 -0.02 0.00 0.00 -0.31 0.00 0.00 39.34 39.97 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 1.95 3.43 0.21 2.72 0.00 0.56 -2.48 105.19 111.58 2c91 n GLY 253 Ca -0.00 -0.11 0.07 0.00 0.00 0.00 0.00 46.02 45.98 2c91 n GLY 253 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2c91 h THR 254 N 0.00 0.87 0.00 2.61 2.02 -1.95 -2.70 112.91 113.76 2c91 h THR 254 Ca 0.00 -1.15 0.00 0.00 0.77 0.00 0.00 66.41 66.03 2c91 h THR 254 Cb 0.00 1.69 0.00 0.00 -1.74 0.00 0.00 68.15 68.10 2c91 h THR 254 CO 0.00 0.29 0.00 0.59 0.37 0.00 0.00 175.52 176.77 2c91 n ASN 255 N -3.69 0.20 -4.70 4.18 3.02 -1.03 -4.93 115.26 108.30 2c91 n ASN 255 Ca -0.01 -1.84 -0.42 0.00 -0.03 0.00 0.00 54.58 52.28 2c91 n ASN 255 Cb 0.40 -0.10 -0.03 0.00 -0.61 0.00 0.00 39.78 39.44 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 -1.78 3.60 0.65 5.41 0.00 -1.02 -4.97 121.76 123.65 2c91 s ALA 256 Ca 0.00 1.03 -0.18 0.00 0.00 0.00 0.00 51.96 52.81 2c91 s ALA 256 Cb 0.00 -3.59 -0.01 0.00 0.00 0.00 0.00 23.12 19.52 2c91 s ALA 256 CO 0.00 -0.82 1.26 -0.35 0.00 0.00 0.00 175.76 175.85 2c91 n PRO 257 N 4.82 1.07 -1.61 0.00 -0.04 -1.26 -4.99 135.00 133.00 2c91 n PRO 257 Ca 0.13 0.42 -0.35 0.00 -0.04 0.00 0.00 63.50 63.66 2c91 n PRO 257 Cb 0.43 -2.50 0.08 0.00 -0.04 0.00 0.00 33.50 31.47 2c91 n PRO 257 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2c91 s ARG 258 N -3.33 2.38 0.24 0.54 3.00 -1.26 -4.80 118.95 115.72 2c91 s ARG 258 Ca 0.82 1.86 -0.06 0.00 0.00 0.00 0.00 55.73 58.35 2c91 s ARG 258 Cb -0.38 -1.85 0.42 0.00 0.00 0.00 0.00 34.95 33.14 2c91 s ARG 258 CO 0.41 -1.67 1.71 0.52 0.00 0.00 0.00 175.30 176.26 2c91 h MET 259 N 0.12 0.33 -0.53 3.54 2.86 -1.86 -0.23 114.93 119.15 2c91 h MET 259 Ca -0.49 -0.02 0.10 0.00 -2.06 0.00 0.00 59.70 57.23 2c91 h MET 259 Cb 1.31 -0.07 -0.09 0.00 0.06 0.00 0.00 31.60 32.81 2c91 h MET 259 CO 0.51 0.22 0.03 1.15 1.06 0.00 0.00 176.91 179.88 2c91 h THR 260 N 0.34 0.60 -0.38 2.22 2.02 -1.74 0.13 112.91 116.11 2c91 h THR 260 Ca 0.39 -0.05 -0.15 0.00 0.77 0.00 0.00 66.41 67.37 2c91 h THR 260 Cb 0.62 0.44 -0.01 0.00 -1.74 0.00 0.00 68.15 67.47 2c91 h THR 260 CO -0.44 0.03 -0.37 -1.28 0.37 0.00 0.00 175.52 173.83 2c91 h SER 261 N 0.15 0.94 -0.52 4.18 0.87 -1.61 -2.58 113.55 114.98 2c91 h SER 261 Ca 0.27 -0.42 -0.02 0.00 -1.23 0.00 0.00 61.79 60.39 2c91 h SER 261 Cb 0.41 -0.26 -0.02 0.00 -0.44 0.00 0.00 62.40 62.09 2c91 h SER 261 CO -0.42 1.20 0.23 0.00 -0.53 0.00 0.00 176.83 177.31 2c91 h ALA 262 N 0.84 0.67 -0.47 6.23 0.00 -0.15 -1.29 119.26 125.09 2c91 h ALA 262 Ca 0.06 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 2c91 h ALA 262 Cb 0.95 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 2c91 h ALA 262 CO 0.09 0.26 0.23 0.00 0.00 0.00 0.00 179.25 179.83 2c91 h ALA 263 N 1.07 0.60 -0.36 0.00 0.00 -0.73 -0.23 119.26 119.62 2c91 h ALA 263 Ca 0.18 -0.11 -0.13 0.00 0.00 0.00 0.00 54.91 54.85 2c91 h ALA 263 Cb 0.16 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2c91 h ALA 263 CO -0.02 0.16 -0.27 -0.07 0.00 0.00 0.00 179.25 179.05 2c91 h LEU 264 N 0.61 0.86 -1.16 0.00 3.38 -1.43 -2.85 115.31 114.73 2c91 h LEU 264 Ca 0.16 -0.44 -0.01 0.00 0.09 0.00 0.00 57.88 57.68 2c91 h LEU 264 Cb 0.10 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.58 2c91 h LEU 264 CO -0.02 1.12 0.45 0.03 0.09 0.00 0.00 178.44 180.10 2c91 h ARG 265 N 0.60 1.03 -0.61 1.13 3.08 -1.09 -1.49 114.38 117.03 2c91 h ARG 265 Ca 0.07 -0.09 0.10 0.00 0.07 0.00 0.00 59.98 60.13 2c91 h ARG 265 Cb 0.84 -0.22 -0.08 0.00 0.08 0.00 0.00 29.97 30.60 2c91 h ARG 265 CO 0.07 0.72 0.19 2.35 -1.07 0.00 0.00 179.97 182.23 2c91 h TRP 266 N 1.04 0.31 -0.14 3.04 7.01 -0.83 0.12 115.95 126.52 2c91 h TRP 266 Ca 0.27 0.03 0.02 0.00 2.11 0.00 0.00 58.89 61.32 2c91 h TRP 266 Cb -0.03 -0.05 -0.02 0.00 -2.10 0.00 0.00 29.16 26.96 2c91 h TRP 266 CO 0.00 0.04 0.04 0.52 -2.79 0.00 0.00 178.44 176.25 2c91 h MET 267 N 0.34 0.10 0.00 2.65 2.86 -1.06 0.47 114.93 120.28 2c91 h MET 267 Ca 0.32 -0.01 -0.15 0.00 -2.06 0.00 0.00 59.70 57.80 2c91 h MET 267 Cb 0.43 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.05 2c91 h MET 267 CO -0.35 0.06 -0.73 1.88 1.06 0.00 0.00 176.91 178.83 2c91 h TYR 268 N 0.10 0.00 0.00 -0.22 -1.99 -1.11 -3.35 116.97 110.40 2c91 h TYR 268 Ca 0.06 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.78 2c91 h TYR 268 Cb 0.05 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 38.77 2c91 h TYR 268 CO -0.12 0.73 -1.11 0.72 -0.00 0.00 0.00 178.16 178.38 2c91 n HIS 269 N -3.67 0.00 -0.50 4.88 8.25 0.00 -4.44 115.22 119.75 2c91 n HIS 269 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.45 2c91 n HIS 269 Cb 0.71 -0.06 0.00 0.00 1.12 0.00 0.00 29.99 31.76 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 -1.66 0.00 -2.84 4.41 8.25 0.15 -5.04 115.22 118.50 2c91 n HIS 270 Ca -0.01 -0.13 -0.18 0.00 -0.26 0.00 0.00 57.72 57.14 2c91 n HIS 270 Cb 0.14 -0.01 0.08 0.00 1.12 0.00 0.00 29.99 31.31 2c91 n HIS 270 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 2c91 n SER 271 N -0.13 1.59 -0.47 0.41 3.41 -0.58 -4.96 113.62 112.88 2c91 n SER 271 Ca 0.00 -2.21 0.10 0.00 -0.26 0.00 0.00 58.87 56.50 2c91 n SER 271 Cb 0.25 -0.46 0.41 0.00 -0.26 0.00 0.00 64.21 64.15 2c91 n SER 271 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2c91 n GLN 272 N -2.33 1.62 -2.01 4.33 6.02 -1.26 -4.89 117.38 118.87 2c91 n GLN 272 Ca 0.15 -0.93 -0.41 0.00 -0.01 0.00 0.00 57.00 55.80 2c91 n GLN 272 Cb 0.53 -1.38 -0.01 0.00 1.02 0.00 0.00 30.24 30.39 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 -1.58 4.36 -0.27 1.08 1.43 -1.26 -5.01 118.68 117.44 2c91 s LEU 273 Ca 0.32 2.80 0.03 0.00 -1.03 0.00 0.00 54.13 56.24 2c91 s LEU 273 Cb 0.17 -3.69 0.07 0.00 0.03 0.00 0.00 46.19 42.76 2c91 s LEU 273 CO 0.26 -0.69 -0.07 -1.10 0.23 0.00 0.00 176.35 174.98 2c91 s GLN 274 N -1.95 1.97 0.46 1.70 -0.21 -1.26 -4.87 119.66 115.50 2c91 s GLN 274 Ca 0.51 -1.35 0.17 0.00 0.02 0.00 0.00 55.36 54.71 2c91 s GLN 274 Cb -0.42 -2.86 1.13 0.00 1.00 0.00 0.00 33.01 31.86 2c91 s GLN 274 CO 0.56 -0.64 1.98 0.78 -2.12 0.00 0.00 175.29 175.85 2c91 h GLY 275 N 7.79 0.43 2.00 3.09 0.00 -1.78 -1.12 103.07 113.49 2c91 h GLY 275 Ca -0.16 -0.12 -0.03 0.00 0.00 0.00 0.00 47.33 47.01 2c91 h GLY 275 CO 0.46 0.07 -0.14 -0.91 0.00 0.00 0.00 176.54 176.01 2c91 h THR 276 N 0.30 0.70 -0.03 4.70 1.35 -1.88 -2.40 112.91 115.65 2c91 h THR 276 Ca 0.27 -0.59 0.00 0.00 -0.55 0.00 0.00 66.41 65.54 2c91 h THR 276 Cb 0.66 1.36 0.00 0.00 -1.73 0.00 0.00 68.15 68.44 2c91 h THR 276 CO -0.06 0.14 0.00 0.54 -0.25 0.00 0.00 175.52 175.89 2c91 n ARG 277 N -3.78 1.68 -0.61 4.72 1.74 -0.46 -4.93 116.66 115.02 2c91 n ARG 277 Ca -0.02 -0.99 0.00 0.00 -0.77 0.00 0.00 57.85 56.07 2c91 n ARG 277 Cb 0.25 -1.47 0.00 0.00 -1.02 0.00 0.00 32.46 30.22 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 1.18 0.71 3.74 -0.13 0.00 -0.90 -4.55 105.19 105.23 2c91 n GLY 278 Ca 0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.87 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 -2.17 4.41 0.10 1.61 1.01 -0.97 -4.65 116.67 116.01 2c91 s ASP 279 Ca 0.00 2.21 -0.11 0.00 0.71 0.00 0.00 52.55 55.36 2c91 s ASP 279 Cb 0.00 -2.57 0.01 0.00 1.01 0.00 0.00 42.92 41.37 2c91 s ASP 279 CO 0.00 -2.11 0.25 0.00 0.21 0.00 0.00 175.17 173.52 2c91 s ALA 280 N -2.18 -0.42 -0.13 5.23 0.00 -0.39 -1.81 121.76 122.06 2c91 s ALA 280 Ca 0.71 -0.46 -0.03 0.00 0.00 0.00 0.00 51.96 52.18 2c91 s ALA 280 Cb -0.25 0.54 -0.03 0.00 0.00 0.00 0.00 23.12 23.37 2c91 s ALA 280 CO 0.45 -0.54 -0.03 0.08 0.00 0.00 0.00 175.76 175.72 2c91 s VAL 281 N -3.82 3.95 -0.42 0.00 1.01 0.05 -1.35 120.40 119.82 2c91 s VAL 281 Ca 0.04 -0.35 -0.17 0.00 0.00 0.00 0.00 61.98 61.50 2c91 s VAL 281 Cb 0.04 -2.70 0.02 0.00 0.00 0.00 0.00 36.38 33.74 2c91 s VAL 281 CO -0.11 0.52 0.45 -0.63 0.00 0.00 0.00 175.10 175.33 2c91 s ILE 282 N 0.00 5.07 0.42 2.22 1.01 -0.01 -0.92 121.20 128.99 2c91 s ILE 282 Ca 0.01 -0.31 -0.24 0.00 0.00 0.00 0.00 60.65 60.11 2c91 s ILE 282 Cb -0.13 -4.04 -0.08 0.00 0.01 0.00 0.00 42.46 38.21 2c91 s ILE 282 CO 0.03 -0.42 1.13 -0.76 0.00 0.00 0.00 174.94 174.91 2c91 s LEU 283 N 2.17 4.13 0.24 2.97 1.43 0.19 -4.51 118.68 125.30 2c91 s LEU 283 Ca 0.13 2.24 0.12 0.00 -1.03 0.00 0.00 54.13 55.58 2c91 s LEU 283 Cb -0.17 -4.13 -0.05 0.00 0.03 0.00 0.00 46.19 41.87 2c91 s LEU 283 CO 0.14 -0.69 -0.21 -0.83 0.23 0.00 0.00 176.35 174.99 2c91 s GLY 284 N -1.33 1.80 -0.13 -3.19 0.00 -1.26 -1.00 107.32 102.22 2c91 s GLY 284 Ca 0.59 -1.77 -0.30 0.00 0.00 0.00 0.00 44.72 43.24 2c91 s GLY 284 CO 0.34 -1.83 0.98 -3.16 0.00 0.00 0.00 173.10 169.44 2c91 s MET 285 N -3.13 0.63 0.00 2.90 0.23 -1.26 -4.73 119.30 113.94 2c91 s MET 285 Ca 0.26 0.04 0.08 0.00 -1.03 0.00 0.00 55.69 55.04 2c91 s MET 285 Cb -0.06 0.29 0.14 0.00 -1.53 0.00 0.00 34.83 33.67 2c91 s MET 285 CO 0.13 -0.22 0.97 -1.13 -2.03 0.00 0.00 175.02 172.74 2c91 n SER 286 N 0.50 2.17 -3.72 -1.18 3.41 -1.26 -4.54 113.62 108.99 2c91 n SER 286 Ca -0.09 -1.66 -0.10 0.00 -0.26 0.00 0.00 58.87 56.75 2c91 n SER 286 Cb 0.59 -0.08 -0.06 0.00 -0.26 0.00 0.00 64.21 64.39 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 -0.84 -0.11 0.23 4.04 1.04 -1.26 -4.39 113.70 112.41 2c91 s SER 287 Ca 0.13 -0.39 -0.08 0.00 0.48 0.00 0.00 55.95 56.10 2c91 s SER 287 Cb 0.08 0.41 0.25 0.00 0.10 0.00 0.00 66.02 66.86 2c91 s SER 287 CO 0.11 -0.77 1.87 0.25 0.98 0.00 0.00 173.24 175.68 2c91 h LEU 288 N 2.65 0.85 -0.52 2.42 5.85 -1.96 -2.66 115.31 121.95 2c91 h LEU 288 Ca -0.33 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.39 2c91 h LEU 288 Cb 1.23 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 42.05 2c91 h LEU 288 CO 0.50 0.58 0.34 -0.08 -0.34 0.00 0.00 178.44 179.43 2c91 h GLU 289 N 1.00 0.69 -0.50 1.25 4.81 -1.99 -0.83 114.58 119.01 2c91 h GLU 289 Ca 0.33 -0.05 0.02 0.00 -0.13 0.00 0.00 59.36 59.53 2c91 h GLU 289 Cb 0.03 -0.15 -0.03 0.00 0.63 0.00 0.00 28.75 29.23 2c91 h GLU 289 CO -0.12 0.46 0.31 1.96 -0.73 0.00 0.00 179.01 180.89 2c91 h GLN 290 N 0.70 0.60 -0.50 1.92 4.20 -1.96 -2.44 115.11 117.63 2c91 h GLN 290 Ca 0.19 -0.04 -0.01 0.00 0.06 0.00 0.00 58.65 58.86 2c91 h GLN 290 Cb -0.07 -0.13 -0.02 0.00 0.30 0.00 0.00 27.48 27.55 2c91 h GLN 290 CO -0.04 0.39 0.28 1.25 -0.67 0.00 0.00 178.83 180.05 2c91 h LEU 291 N 0.61 0.62 -0.68 1.46 5.85 -1.11 0.11 115.31 122.17 2c91 h LEU 291 Ca 0.20 -0.08 0.01 0.00 0.84 0.00 0.00 57.88 58.85 2c91 h LEU 291 Cb -0.00 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 40.84 2c91 h LEU 291 CO -0.08 0.51 0.45 -0.33 -0.34 0.00 0.00 178.44 178.65 2c91 h GLU 292 N 0.67 0.90 -0.24 1.25 5.08 -1.07 0.34 114.58 121.50 2c91 h GLU 292 Ca 0.18 -0.06 0.01 0.00 -1.00 0.00 0.00 59.36 58.49 2c91 h GLU 292 Cb 0.03 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.06 2c91 h GLU 292 CO -0.03 0.60 0.12 0.37 -1.00 0.00 0.00 179.01 179.07 2c91 h GLN 293 N 0.92 0.26 -0.40 2.33 4.15 -1.19 -1.46 115.11 119.72 2c91 h GLN 293 Ca 0.25 -0.02 -0.02 0.00 0.77 0.00 0.00 58.65 59.64 2c91 h GLN 293 Cb -0.10 -0.06 -0.02 0.00 0.21 0.00 0.00 27.48 27.51 2c91 h GLN 293 CO -0.05 0.17 0.19 -0.91 -1.93 0.00 0.00 178.83 176.29 2c91 h ASN 294 N 0.26 0.52 -0.92 -0.69 2.35 0.27 -2.40 115.58 114.97 2c91 h ASN 294 Ca 0.09 -0.13 0.03 0.00 -0.55 0.00 0.00 56.30 55.74 2c91 h ASN 294 Cb 0.01 -0.13 -0.05 0.00 0.05 0.00 0.00 38.32 38.20 2c91 h ASN 294 CO -0.06 0.51 0.61 -0.07 -1.65 0.00 0.00 177.43 176.77 2c91 h LEU 295 N 0.50 1.02 -0.49 1.61 3.38 -0.29 -1.65 115.31 119.38 2c91 h LEU 295 Ca 0.14 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.09 2c91 h LEU 295 Cb 0.13 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 2c91 h LEU 295 CO -0.02 0.71 0.31 0.00 0.09 0.00 0.00 178.44 179.54 2c91 h ALA 296 N 1.45 0.63 -0.24 1.53 0.00 -0.92 -2.76 119.26 118.95 2c91 h ALA 296 Ca 0.35 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 55.17 2c91 h ALA 296 Cb -0.05 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 2c91 h ALA 296 CO -0.10 0.10 -0.03 0.00 0.00 0.00 0.00 179.25 179.23 2c91 h ALA 297 N 1.16 1.52 0.00 0.00 0.00 -0.84 -2.44 119.26 118.66 2c91 h ALA 297 Ca 0.18 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 2c91 h ALA 297 Cb -0.04 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 2c91 h ALA 297 CO -0.04 0.35 -0.03 1.79 0.00 0.00 0.00 179.25 181.32 2c91 h THR 298 N 0.35 0.09 -0.02 0.00 1.35 -1.05 -2.53 112.91 111.10 2c91 h THR 298 Ca 0.08 -0.41 0.00 0.00 -0.55 0.00 0.00 66.41 65.53 2c91 h THR 298 Cb 0.28 1.37 0.00 0.00 -1.73 0.00 0.00 68.15 68.07 2c91 h THR 298 CO 0.01 0.02 -0.36 -0.62 -0.25 0.00 0.00 175.52 174.32 2c91 n GLU 299 N -3.16 1.47 -1.14 4.72 1.02 -0.93 -4.94 120.64 117.67 2c91 n GLU 299 Ca -0.01 -1.12 -0.29 0.00 -0.02 0.00 0.00 57.16 55.72 2c91 n GLU 299 Cb 0.24 -1.43 0.17 0.00 -0.02 0.00 0.00 31.44 30.40 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 -2.26 0.54 0.00 3.49 2.02 -0.95 -5.08 118.70 116.46 2c91 s GLU 300 Ca 0.19 0.60 0.00 0.00 0.02 0.00 0.00 54.97 55.78 2c91 s GLU 300 Cb 0.17 -1.74 0.00 0.00 0.10 0.00 0.00 34.13 32.66 2c91 s GLU 300 CO 0.49 -2.67 0.00 0.41 0.02 0.00 0.00 175.26 173.50 2c91 n GLY 301 N -1.00 1.07 3.72 -1.39 0.00 -1.26 -5.03 105.19 101.30 2c91 n GLY 301 Ca 0.06 -1.95 -0.31 0.00 0.00 0.00 0.00 46.02 43.82 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 0.06 1.52 0.48 1.61 0.02 -1.26 -4.93 135.00 132.50 2c91 s PRO 302 Ca 0.00 1.17 -0.04 0.00 0.02 0.00 0.00 61.00 62.15 2c91 s PRO 302 Cb 0.00 -1.81 -0.02 0.00 0.02 0.00 0.00 34.50 32.69 2c91 s PRO 302 CO 0.00 -2.16 0.76 -0.51 -0.33 0.00 0.00 177.00 174.76 2c91 s LEU 303 N -6.25 3.60 0.54 -5.54 1.43 -1.26 -5.08 118.68 106.12 2c91 s LEU 303 Ca 0.64 0.74 -0.20 0.00 -1.03 0.00 0.00 54.13 54.27 2c91 s LEU 303 Cb -0.19 -3.64 -0.06 0.00 0.03 0.00 0.00 46.19 42.33 2c91 s LEU 303 CO 0.57 -0.65 1.15 -1.61 0.23 0.00 0.00 176.35 176.04 2c91 s GLU 304 N -4.71 3.35 0.39 1.70 0.41 -1.26 -4.84 118.70 113.74 2c91 s GLU 304 Ca 0.48 1.69 0.11 0.00 -0.41 0.00 0.00 54.97 56.84 2c91 s GLU 304 Cb -0.10 -2.06 0.92 0.00 -1.78 0.00 0.00 34.13 31.11 2c91 s GLU 304 CO 0.43 -0.87 1.92 -1.35 -0.49 0.00 0.00 175.26 174.90 2c91 h PRO 305 N 1.28 0.55 -0.52 0.39 0.11 -1.99 -1.68 132.00 130.14 2c91 h PRO 305 Ca -0.50 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 65.56 2c91 h PRO 305 Cb 1.27 -0.12 -0.03 0.00 0.11 0.00 0.00 31.00 32.23 2c91 h PRO 305 CO 0.57 0.36 0.23 0.00 -0.21 0.00 0.00 178.00 178.96 2c91 h ALA 306 N 1.63 1.44 0.21 -0.75 0.00 -1.98 0.66 119.26 120.47 2c91 h ALA 306 Ca 0.37 -0.12 -0.32 0.00 0.00 0.00 0.00 54.91 54.83 2c91 h ALA 306 Cb 0.65 -0.21 0.03 0.00 0.00 0.00 0.00 17.79 18.26 2c91 h ALA 306 CO -0.13 0.44 -1.40 0.28 0.00 0.00 0.00 179.25 178.43 2c91 h VAL 307 N 0.73 1.29 -0.68 0.00 2.07 -1.64 -1.69 116.25 116.34 2c91 h VAL 307 Ca 0.18 -2.65 0.01 0.00 0.82 0.00 0.00 66.70 65.06 2c91 h VAL 307 Cb 0.10 2.94 -0.04 0.00 -1.52 0.00 0.00 31.29 32.77 2c91 h VAL 307 CO -0.02 0.80 0.45 0.58 0.02 0.00 0.00 177.57 179.39 2c91 h VAL 308 N 0.18 1.16 -0.82 2.57 2.07 -1.21 -1.55 116.25 118.66 2c91 h VAL 308 Ca -0.23 -0.31 0.00 0.00 0.82 0.00 0.00 66.70 66.98 2c91 h VAL 308 Cb 2.09 0.17 -0.04 0.00 -1.52 0.00 0.00 31.29 31.99 2c91 h VAL 308 CO 0.26 0.17 0.51 -0.08 0.02 0.00 0.00 177.57 178.45 2c91 h GLU 309 N 0.91 1.10 -0.35 1.57 4.57 -0.86 -2.01 114.58 119.51 2c91 h GLU 309 Ca 0.25 -0.08 -0.05 0.00 -1.18 0.00 0.00 59.36 58.30 2c91 h GLU 309 Cb -0.09 -0.24 -0.02 0.00 -0.16 0.00 0.00 28.75 28.24 2c91 h GLU 309 CO -0.06 0.75 0.01 0.00 -1.18 0.00 0.00 179.01 178.53 2c91 h ALA 310 N 1.45 1.36 -0.14 2.92 0.00 -0.80 -1.11 119.26 122.94 2c91 h ALA 310 Ca 0.30 -0.20 -0.09 0.00 0.00 0.00 0.00 54.91 54.92 2c91 h ALA 310 Cb -0.08 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 2c91 h ALA 310 CO -0.06 0.44 -0.30 0.74 0.00 0.00 0.00 179.25 180.08 2c91 h PHE 311 N 0.52 0.30 -0.22 0.00 0.04 -0.73 -1.03 116.94 115.82 2c91 h PHE 311 Ca 0.11 -0.06 -0.12 0.00 2.80 0.00 0.00 57.97 60.70 2c91 h PHE 311 Cb 0.33 -0.07 -0.00 0.00 2.20 0.00 0.00 35.95 38.40 2c91 h PHE 311 CO 0.01 0.55 -0.32 -0.44 -0.60 0.00 0.00 178.31 177.51 2c91 h ASP 312 N 0.24 0.65 -0.68 2.17 5.19 -0.67 -2.24 116.42 121.09 2c91 h ASP 312 Ca 0.03 -0.52 -0.00 0.00 -0.62 0.00 0.00 57.03 55.93 2c91 h ASP 312 Cb 0.65 -0.19 -0.03 0.00 0.18 0.00 0.00 39.33 39.94 2c91 h ASP 312 CO 0.05 1.04 0.42 1.56 -3.12 0.00 0.00 179.24 179.19 2c91 h GLN 313 N 0.29 0.92 -0.19 3.56 4.20 -1.09 -1.15 115.11 121.65 2c91 h GLN 313 Ca 0.02 -0.07 -0.03 0.00 0.06 0.00 0.00 58.65 58.63 2c91 h GLN 313 Cb 0.90 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 28.47 2c91 h GLN 313 CO 0.07 0.64 0.01 0.00 -0.67 0.00 0.00 178.83 178.88 2c91 h ALA 314 N 1.52 0.25 -0.54 3.87 0.00 -1.15 -2.36 119.26 120.86 2c91 h ALA 314 Ca 0.25 -0.20 0.05 0.00 0.00 0.00 0.00 54.91 55.01 2c91 h ALA 314 Cb -0.05 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 17.62 2c91 h ALA 314 CO -0.05 -0.05 0.28 2.35 0.00 0.00 0.00 179.25 181.79 2c91 h TRP 315 N 0.09 0.52 -0.45 0.00 -0.00 -1.14 -2.46 115.95 112.50 2c91 h TRP 315 Ca 0.05 0.02 0.06 0.00 -0.00 0.00 0.00 58.89 59.02 2c91 h TRP 315 Cb 0.37 -0.15 -0.03 0.00 -0.00 0.00 0.00 29.16 29.35 2c91 h TRP 315 CO 0.03 0.25 0.31 -0.91 -0.00 0.00 0.00 178.44 178.12 2c91 h ASN 316 N 0.54 0.32 0.05 2.65 2.35 -1.03 0.14 115.58 120.61 2c91 h ASN 316 Ca 0.24 0.00 -0.09 0.00 -0.55 0.00 0.00 56.30 55.89 2c91 h ASN 316 Cb 0.13 -0.07 -0.01 0.00 0.05 0.00 0.00 38.32 38.42 2c91 h ASN 316 CO -0.16 0.21 -0.28 0.24 -1.65 0.00 0.00 177.43 175.79 2c91 h MET 317 N 0.37 0.36 0.00 0.81 2.86 -0.94 -3.30 114.93 115.10 2c91 h MET 317 Ca 0.20 -0.14 0.00 0.00 -2.06 0.00 0.00 59.70 57.70 2c91 h MET 317 Cb 0.32 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.95 2c91 h MET 317 CO -0.05 0.62 -0.91 1.33 1.06 0.00 0.00 176.91 178.96 2c91 n VAL 318 N -4.12 0.00 -0.33 -2.22 0.24 -0.52 -4.69 118.33 106.70 2c91 n VAL 318 Ca -0.01 -0.18 0.15 0.00 -2.04 0.00 0.00 64.34 62.26 2c91 n VAL 318 Cb 0.41 0.83 0.34 0.00 -1.47 0.00 0.00 33.84 33.95 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 2.01 1.62 0.00 2.33 0.00 -0.85 0.10 119.26 124.47 2c91 h ALA 319 Ca 0.00 0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2c91 h ALA 319 Cb 0.43 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.28 2c91 h ALA 319 CO 0.00 -0.28 0.00 1.12 0.00 0.00 0.00 179.25 180.09 2c91 h HIS 320 N 0.51 0.00 0.00 0.00 2.07 -1.84 -2.80 115.15 113.10 2c91 h HIS 320 Ca 0.60 0.00 -0.01 0.00 -2.85 0.00 0.00 60.37 58.11 2c91 h HIS 320 Cb 1.12 0.00 -0.03 0.00 2.57 0.00 0.00 27.41 31.07 2c91 h HIS 320 CO -0.06 0.00 -0.33 -0.85 -3.07 0.00 0.00 177.93 173.62 2c91 n GLU 321 N -2.87 1.22 -1.71 5.12 0.28 0.31 -5.06 120.64 117.93 2c91 n GLU 321 Ca -0.01 -2.72 -0.43 0.00 -0.16 0.00 0.00 57.16 53.84 2c91 n GLU 321 Cb 0.18 -1.36 -0.02 0.00 1.43 0.00 0.00 31.44 31.67 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 -0.34 2.91 0.13 0.00 0.04 -1.26 -4.99 135.00 131.49 2c91 s PRO 323 Ca 0.67 1.45 -0.30 0.00 0.04 0.00 0.00 61.00 62.86 2c91 s PRO 323 Cb -0.57 -1.96 -0.07 0.00 0.04 0.00 0.00 34.50 31.94 2c91 s PRO 323 CO 0.48 -1.18 1.16 -0.80 0.04 0.00 0.00 177.00 176.70 2c91 s ASN 324 N -2.38 7.15 0.48 6.66 0.01 -1.26 -4.88 114.94 120.72 2c91 s ASN 324 Ca 0.68 2.09 0.32 0.00 -0.71 0.00 0.00 52.86 55.24 2c91 s ASN 324 Cb -0.22 -2.59 1.31 0.00 0.41 0.00 0.00 41.25 40.16 2c91 s ASN 324 CO 0.38 -0.36 1.93 0.10 -1.51 0.00 0.00 177.10 177.65 2c91 h TYR 325 N 5.83 0.00 -2.89 2.20 -0.00 -1.94 -3.45 116.97 116.72 2c91 h TYR 325 Ca -0.43 0.00 -0.61 0.00 -0.00 0.00 0.00 58.73 57.69 2c91 h TYR 325 Cb 1.21 0.00 -0.12 0.00 -0.00 0.00 0.00 36.73 37.82 2c91 h TYR 325 CO 0.64 0.00 -0.68 -0.59 -0.00 0.00 0.00 178.16 177.53 2c91 s PHE 326 N -3.60 2.76 0.00 0.10 -0.12 -1.26 -4.27 117.98 111.58 2c91 s PHE 326 Ca 0.02 -0.17 0.00 0.00 -0.05 0.00 0.00 56.93 56.72 2c91 s PHE 326 Cb 0.09 -1.33 0.00 0.00 -0.63 0.00 0.00 43.02 41.15 2c91 s PHE 326 CO 0.50 0.52 0.23 0.54 -0.05 0.00 0.00 175.22 176.96