#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c91 n ARG 5 N 0.00 1.58 -1.14 1.47 -4.01 -1.26 -2.82 116.66 110.47 2c91 n ARG 5 Ca 0.00 0.57 -0.35 0.00 -1.04 0.00 0.00 57.85 57.03 2c91 n ARG 5 Cb 0.00 -2.28 0.10 0.00 -3.04 0.00 0.00 32.46 27.24 2c91 n ARG 5 CO 0.00 0.00 0.00 -2.30 -3.04 0.00 0.00 177.63 172.29 2c91 n PRO 6 N -0.24 0.19 -1.39 2.89 -0.02 -1.26 -4.39 135.00 130.78 2c91 n PRO 6 Ca 0.09 0.12 -0.29 0.00 -2.02 0.00 0.00 63.50 61.40 2c91 n PRO 6 Cb 0.41 -2.10 0.14 0.00 -0.02 0.00 0.00 33.50 31.94 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 -2.05 1.53 -0.15 3.55 0.00 -0.50 -4.81 121.76 119.33 2c91 s ALA 7 Ca 0.68 -0.41 0.01 0.00 0.00 0.00 0.00 51.96 52.24 2c91 s ALA 7 Cb -0.31 -3.08 0.02 0.00 0.00 0.00 0.00 23.12 19.75 2c91 s ALA 7 CO 0.56 -2.42 -0.18 0.99 0.00 0.00 0.00 175.76 174.71 2c91 s THR 8 N -3.14 1.79 -0.00 0.00 2.01 -1.26 -0.75 115.64 114.29 2c91 s THR 8 Ca 0.64 -0.79 0.02 0.00 0.31 0.00 0.00 61.69 61.87 2c91 s THR 8 Cb -0.16 -1.63 -0.03 0.00 0.01 0.00 0.00 72.50 70.69 2c91 s THR 8 CO 0.55 0.50 -0.03 -0.69 -0.69 0.00 0.00 174.62 174.26 2c91 s VAL 9 N 1.18 3.93 -0.28 3.82 1.01 -0.31 -4.46 120.40 125.30 2c91 s VAL 9 Ca -0.00 -0.67 -0.15 0.00 0.00 0.00 0.00 61.98 61.16 2c91 s VAL 9 Cb -0.14 -2.73 -0.03 0.00 0.00 0.00 0.00 36.38 33.48 2c91 s VAL 9 CO -0.07 0.39 0.39 -0.22 0.00 0.00 0.00 175.10 175.59 2c91 s LEU 10 N -1.47 4.09 0.24 3.92 2.96 -0.52 -0.43 118.68 127.47 2c91 s LEU 10 Ca 0.18 0.24 -0.30 0.00 -0.22 0.00 0.00 54.13 54.03 2c91 s LEU 10 Cb -0.11 -2.45 -0.09 0.00 0.50 0.00 0.00 46.19 44.04 2c91 s LEU 10 CO 0.09 -0.23 0.94 -0.83 -1.32 0.00 0.00 176.35 175.00 2c91 s GLY 11 N 1.65 3.11 -0.09 7.98 0.00 -0.15 -0.81 107.32 119.02 2c91 s GLY 11 Ca 0.15 0.62 0.13 0.00 0.00 0.00 0.00 44.72 45.63 2c91 s GLY 11 CO 0.10 1.20 1.09 -1.30 0.00 0.00 0.00 173.10 174.20 2c91 n THR 12 N 1.54 1.52 -0.17 0.90 -2.24 -0.62 -4.72 114.28 110.49 2c91 n THR 12 Ca -0.02 -1.78 0.14 0.00 -2.27 0.00 0.00 64.05 60.12 2c91 n THR 12 Cb 0.47 0.01 0.47 0.00 -2.10 0.00 0.00 70.33 69.18 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 0.47 -0.10 -0.78 -1.53 -1.92 -2.47 114.93 108.59 2c91 h MET 13 Ca 0.00 -0.03 0.00 0.00 -3.44 0.00 0.00 59.70 56.23 2c91 h MET 13 Cb 0.92 -0.11 0.00 0.00 -0.55 0.00 0.00 31.60 31.86 2c91 h MET 13 CO 0.00 0.31 0.00 0.39 0.14 0.00 0.00 176.91 177.75 2c91 n GLU 14 N -4.49 2.09 -2.25 0.39 -0.58 -1.26 -4.67 120.64 109.86 2c91 n GLU 14 Ca 0.14 -1.60 -0.42 0.00 -0.42 0.00 0.00 57.16 54.86 2c91 n GLU 14 Cb 0.49 -1.47 -0.02 0.00 -0.57 0.00 0.00 31.44 29.86 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 -1.89 3.40 0.00 3.49 -1.94 -0.93 -1.01 119.30 120.41 2c91 s MET 15 Ca 0.33 0.93 0.00 0.00 -1.71 0.00 0.00 55.69 55.24 2c91 s MET 15 Cb 0.20 -4.11 0.00 0.00 2.01 0.00 0.00 34.83 32.93 2c91 s MET 15 CO 0.31 -1.79 0.00 0.41 -0.01 0.00 0.00 175.02 173.94 2c91 n GLY 16 N 5.24 0.61 0.00 -0.03 0.00 0.25 -2.58 105.19 108.69 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 -1.19 0.00 0.22 1.61 0.63 -0.65 -4.85 116.66 112.43 2c91 n ARG 17 Ca 0.00 0.00 0.12 0.00 -0.92 0.00 0.00 57.85 57.05 2c91 n ARG 17 Cb 0.00 0.00 0.30 0.00 0.45 0.00 0.00 32.46 33.21 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 -5.20 -0.14 3.08 -1.83 -3.44 114.38 106.84 2c91 h ARG 18 Ca 0.00 0.00 -0.65 0.00 0.07 0.00 0.00 59.98 59.40 2c91 h ARG 18 Cb 0.00 0.00 -0.26 0.00 0.08 0.00 0.00 29.97 29.79 2c91 h ARG 18 CO 0.00 0.08 -0.72 -1.64 -1.07 0.00 0.00 179.97 176.62 2c91 s MET 19 N -3.32 3.47 0.88 0.04 -1.94 -0.18 -4.93 119.30 113.31 2c91 s MET 19 Ca 0.05 -0.62 -0.11 0.00 -1.71 0.00 0.00 55.69 53.30 2c91 s MET 19 Cb 0.07 -2.84 0.18 0.00 2.01 0.00 0.00 34.83 34.24 2c91 s MET 19 CO 0.65 0.08 1.21 0.16 -0.01 0.00 0.00 175.02 177.11 2c91 s ASP 20 N 0.73 3.54 0.36 3.03 1.47 -1.26 -0.59 116.67 123.95 2c91 s ASP 20 Ca -0.03 0.04 0.05 0.00 1.18 0.00 0.00 52.55 53.79 2c91 s ASP 20 Cb -0.15 -0.19 0.72 0.00 -0.34 0.00 0.00 42.92 42.96 2c91 s ASP 20 CO 0.02 -2.44 1.95 0.00 0.68 0.00 0.00 175.17 175.39 2c91 h ALA 21 N -1.26 1.68 0.23 2.11 0.00 -1.98 0.31 119.26 120.36 2c91 h ALA 21 Ca -0.41 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.46 2c91 h ALA 21 Cb 1.25 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.84 2c91 h ALA 21 CO 0.39 0.20 -0.11 1.03 0.00 0.00 0.00 179.25 180.75 2c91 h SER 22 N 0.78 -0.27 -0.30 0.00 0.87 -1.99 -1.28 113.55 111.37 2c91 h SER 22 Ca 0.32 -0.20 -0.06 0.00 -1.23 0.00 0.00 61.79 60.62 2c91 h SER 22 Cb 0.26 0.07 -0.02 0.00 -0.44 0.00 0.00 62.40 62.26 2c91 h SER 22 CO -0.11 0.07 0.00 0.00 -0.53 0.00 0.00 176.83 176.27 2c91 h ALA 23 N 0.04 1.27 -0.17 6.23 0.00 -1.87 -1.59 119.26 123.18 2c91 h ALA 23 Ca -0.03 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 2c91 h ALA 23 Cb 0.45 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 2c91 h ALA 23 CO 0.05 0.49 0.07 0.77 0.00 0.00 0.00 179.25 180.64 2c91 h SER 24 N 0.60 0.23 -0.65 0.00 0.02 -0.94 -1.57 113.55 111.24 2c91 h SER 24 Ca 0.12 -0.15 0.02 0.00 -0.84 0.00 0.00 61.79 60.95 2c91 h SER 24 Cb 0.37 -0.06 -0.04 0.00 0.14 0.00 0.00 62.40 62.81 2c91 h SER 24 CO 0.01 0.32 0.41 0.00 -1.14 0.00 0.00 176.83 176.43 2c91 h ALA 25 N 0.92 0.84 -0.92 3.77 0.00 -1.01 -1.60 119.26 121.27 2c91 h ALA 25 Ca 0.06 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.95 2c91 h ALA 25 Cb 0.16 -0.21 -0.05 0.00 0.00 0.00 0.00 17.79 17.69 2c91 h ALA 25 CO -0.01 0.17 0.61 0.00 0.00 0.00 0.00 179.25 180.02 2c91 h ALA 26 N 1.27 1.16 -0.25 0.00 0.00 -1.25 -0.76 119.26 119.44 2c91 h ALA 26 Ca 0.26 -0.07 -0.10 0.00 0.00 0.00 0.00 54.91 55.00 2c91 h ALA 26 Cb -0.00 -0.37 -0.00 0.00 0.00 0.00 0.00 17.79 17.41 2c91 h ALA 26 CO -0.09 0.56 -0.23 0.77 0.00 0.00 0.00 179.25 180.26 2c91 h SER 27 N 1.24 0.64 -0.24 0.00 0.02 -0.87 -1.11 113.55 113.23 2c91 h SER 27 Ca 0.34 -0.47 -0.01 0.00 -0.84 0.00 0.00 61.79 60.81 2c91 h SER 27 Cb -0.14 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 62.21 2c91 h SER 27 CO -0.07 0.97 0.11 0.58 -1.14 0.00 0.00 176.83 177.28 2c91 h VAL 28 N 0.31 1.14 -0.44 2.27 2.07 -1.22 -0.60 116.25 119.79 2c91 h VAL 28 Ca 0.04 -0.41 0.09 0.00 0.82 0.00 0.00 66.70 67.24 2c91 h VAL 28 Cb 0.79 0.98 -0.09 0.00 -1.52 0.00 0.00 31.29 31.44 2c91 h VAL 28 CO 0.06 0.14 -0.21 0.03 0.02 0.00 0.00 177.57 177.61 2c91 h ARG 29 N 0.25 -0.12 -0.51 1.57 3.08 -1.07 0.16 114.38 117.74 2c91 h ARG 29 Ca 0.08 0.01 -0.07 0.00 0.07 0.00 0.00 59.98 60.07 2c91 h ARG 29 Cb 0.12 0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.18 2c91 h ARG 29 CO -0.01 -0.08 0.05 0.00 -1.07 0.00 0.00 179.97 178.86 2c91 h ALA 30 N 1.18 1.12 -0.26 0.04 0.00 -0.91 -0.90 119.26 119.53 2c91 h ALA 30 Ca 0.21 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 2c91 h ALA 30 Cb 0.45 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 2c91 h ALA 30 CO -0.52 0.57 0.02 0.35 0.00 0.00 0.00 179.25 179.67 2c91 h PHE 31 N 0.78 0.48 -0.41 0.00 3.57 -0.38 -3.10 116.94 117.89 2c91 h PHE 31 Ca 0.16 -0.07 -0.10 0.00 3.53 0.00 0.00 57.97 61.49 2c91 h PHE 31 Cb 0.40 -0.13 -0.02 0.00 2.79 0.00 0.00 35.95 39.00 2c91 h PHE 31 CO 0.02 0.58 -0.15 -0.07 -2.23 0.00 0.00 178.31 176.46 2c91 h LEU 32 N 0.25 0.75 -1.84 0.59 3.38 -0.48 -2.77 115.31 115.19 2c91 h LEU 32 Ca 0.08 -0.24 0.10 0.00 0.09 0.00 0.00 57.88 57.91 2c91 h LEU 32 Cb 0.37 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 2c91 h LEU 32 CO 0.01 0.91 0.32 -0.33 0.09 0.00 0.00 178.44 179.43 2c91 h GLU 33 N 0.67 0.18 0.00 1.13 5.08 -1.12 -0.48 114.58 120.04 2c91 h GLU 33 Ca 0.11 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 2c91 h GLU 33 Cb 0.63 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.84 2c91 h GLU 33 CO 0.04 0.12 0.00 0.54 -1.00 0.00 0.00 179.01 178.71 2c91 n ARG 34 N -4.45 0.98 -0.38 2.33 5.12 -1.05 -4.89 116.66 114.32 2c91 n ARG 34 Ca 0.07 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.99 2c91 n ARG 34 Cb 0.40 -1.42 0.00 0.00 -1.16 0.00 0.00 32.46 30.28 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 0.88 0.75 3.91 -0.13 0.00 -0.19 -5.07 105.19 105.35 2c91 n GLY 35 Ca 0.20 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.94 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 -2.37 3.22 0.00 1.61 3.76 -1.22 -5.04 115.29 115.26 2c91 s HIS 36 Ca 0.00 0.71 0.00 0.00 -0.15 0.00 0.00 55.06 55.62 2c91 s HIS 36 Cb 0.00 -2.89 0.00 0.00 1.11 0.00 0.00 32.58 30.80 2c91 s HIS 36 CO 0.00 -1.00 0.00 -1.13 -0.85 0.00 0.00 174.74 171.76 2c91 n SER 37 N -2.74 0.00 -4.78 1.40 3.41 -1.26 -4.42 113.62 105.23 2c91 n SER 37 Ca 0.06 0.00 -0.36 0.00 -0.26 0.00 0.00 58.87 58.31 2c91 n SER 37 Cb 0.58 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 64.45 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 3.46 -0.01 4.33 2.02 -1.26 -0.79 118.70 126.45 2c91 s GLU 38 Ca 0.00 -0.24 0.07 0.00 0.02 0.00 0.00 54.97 54.82 2c91 s GLU 38 Cb 0.00 -3.11 -0.02 0.00 0.10 0.00 0.00 34.13 31.10 2c91 s GLU 38 CO 0.00 0.65 -0.24 -0.51 0.02 0.00 0.00 175.26 175.18 2c91 s LEU 39 N -0.67 2.05 -0.18 1.80 1.43 -0.26 -1.44 118.68 121.41 2c91 s LEU 39 Ca 0.12 -0.44 0.00 0.00 -1.03 0.00 0.00 54.13 52.78 2c91 s LEU 39 Cb -0.12 -1.24 0.01 0.00 0.03 0.00 0.00 46.19 44.88 2c91 s LEU 39 CO 0.02 0.29 -0.16 -0.62 0.23 0.00 0.00 176.35 176.11 2c91 s ASP 40 N -0.61 3.42 0.09 2.29 2.15 0.01 -0.78 116.67 123.25 2c91 s ASP 40 Ca 0.09 -0.58 0.02 0.00 0.43 0.00 0.00 52.55 52.52 2c91 s ASP 40 Cb -0.09 -1.54 -0.01 0.00 -0.30 0.00 0.00 42.92 40.98 2c91 s ASP 40 CO -0.01 0.01 0.07 1.07 -0.17 0.00 0.00 175.17 176.14 2c91 n THR 41 N 4.57 0.00 -3.52 1.71 5.66 -0.04 -1.58 114.28 121.07 2c91 n THR 41 Ca -0.20 -0.65 -0.18 0.00 -3.05 0.00 0.00 64.05 59.97 2c91 n THR 41 Cb 0.50 0.31 -0.06 0.00 -1.55 0.00 0.00 70.33 69.53 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 -2.35 -1.76 0.31 1.79 0.00 -1.26 -3.90 121.76 114.59 2c91 s ALA 42 Ca 0.10 1.31 0.08 0.00 0.00 0.00 0.00 51.96 53.45 2c91 s ALA 42 Cb 0.00 -0.00 0.84 0.00 0.00 0.00 0.00 23.12 23.96 2c91 s ALA 42 CO 0.07 -0.37 1.74 0.35 0.00 0.00 0.00 175.76 177.55 2c91 h PHE 43 N 3.02 1.01 -0.50 0.00 3.57 -1.81 -2.47 116.94 119.76 2c91 h PHE 43 Ca -0.27 0.04 -0.06 0.00 3.53 0.00 0.00 57.97 61.21 2c91 h PHE 43 Cb 1.14 -0.29 -0.02 0.00 2.79 0.00 0.00 35.95 39.57 2c91 h PHE 43 CO 0.38 0.10 0.08 1.98 -2.23 0.00 0.00 178.31 178.62 2c91 h MET 44 N 0.62 0.78 -6.35 1.11 4.05 -1.96 -3.31 114.93 109.88 2c91 h MET 44 Ca 0.62 -0.17 -0.54 0.00 -0.28 0.00 0.00 59.70 59.33 2c91 h MET 44 Cb 1.13 -0.11 0.00 0.00 -0.80 0.00 0.00 31.60 31.82 2c91 h MET 44 CO -0.45 0.74 0.96 0.71 0.23 0.00 0.00 176.91 179.10 2c91 s TYR 45 N -5.12 2.45 -1.45 1.39 2.02 -0.93 -2.59 117.35 113.12 2c91 s TYR 45 Ca -0.09 0.49 -0.08 0.00 -0.37 0.00 0.00 57.07 57.01 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 0.80 -3.26 0.81 0.00 -1.57 0.00 0.00 175.55 172.33 2c91 n ASP 47 N -2.92 -4.40 0.00 0.00 2.03 -1.07 -0.63 116.55 109.56 2c91 n ASP 47 Ca -0.11 -0.17 0.00 0.00 0.52 0.00 0.00 54.79 55.03 2c91 n ASP 47 Cb 0.59 -3.64 0.00 0.00 -0.72 0.00 0.00 41.12 37.35 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 -1.13 0.17 0.13 0.27 0.00 -0.63 -4.98 105.19 99.02 2c91 n GLY 48 Ca -0.09 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.91 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 3.70 0.01 -0.07 1.61 1.08 -0.72 -1.65 115.11 119.06 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 0.65 0.05 1.03 -0.95 0.00 0.00 178.83 179.61 2c91 h SER 50 N 0.00 0.09 -0.62 1.46 0.87 -1.45 0.91 113.55 114.81 2c91 h SER 50 Ca -0.01 -0.01 -0.05 0.00 -1.23 0.00 0.00 61.79 60.50 2c91 h SER 50 Cb 1.14 -0.02 -0.03 0.00 -0.44 0.00 0.00 62.40 63.05 2c91 h SER 50 CO 0.08 0.07 0.19 -0.33 -0.53 0.00 0.00 176.83 176.31 2c91 h GLU 51 N 0.10 0.97 -0.41 2.24 5.08 -1.76 -1.40 114.58 119.40 2c91 h GLU 51 Ca 0.03 -0.21 -0.02 0.00 -1.00 0.00 0.00 59.36 58.16 2c91 h GLU 51 Cb -0.01 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.09 2c91 h GLU 51 CO -0.01 0.85 0.17 -0.91 -1.00 0.00 0.00 179.01 178.12 2c91 h ASN 52 N 0.89 0.56 -0.12 1.42 2.35 -1.05 0.05 115.58 119.68 2c91 h ASN 52 Ca 0.20 -0.16 0.01 0.00 -0.55 0.00 0.00 56.30 55.80 2c91 h ASN 52 Cb 0.29 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 38.50 2c91 h ASN 52 CO -0.01 0.57 0.03 0.40 -1.65 0.00 0.00 177.43 176.77 2c91 h ILE 53 N 0.52 0.96 -0.52 2.81 2.04 -0.68 -2.20 117.51 120.44 2c91 h ILE 53 Ca 0.14 -0.03 -0.05 0.00 1.00 0.00 0.00 64.86 65.92 2c91 h ILE 53 Cb 0.18 0.87 -0.02 0.00 -0.74 0.00 0.00 36.82 37.10 2c91 h ILE 53 CO -0.01 0.02 0.12 -0.07 0.00 0.00 0.00 178.15 178.21 2c91 h LEU 54 N 0.08 0.75 -1.69 1.44 3.38 -1.06 -1.95 115.31 116.26 2c91 h LEU 54 Ca 0.05 -0.13 -0.04 0.00 0.09 0.00 0.00 57.88 57.85 2c91 h LEU 54 Cb 0.04 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 2c91 h LEU 54 CO -0.06 0.74 -0.17 1.23 0.09 0.00 0.00 178.44 180.27 2c91 h GLY 55 N 0.95 0.00 1.44 0.83 0.00 -0.70 -2.55 103.07 103.04 2c91 h GLY 55 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.50 2c91 h GLY 55 CO -0.00 0.00 -0.09 0.61 0.00 0.00 0.00 176.54 177.05 2c91 n GLY 56 N -0.53 -1.25 0.00 4.60 0.00 -0.74 -4.18 105.19 103.10 2c91 n GLY 56 Ca -0.01 -0.19 0.15 0.00 0.00 0.00 0.00 46.02 45.96 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 -1.28 0.00 -2.54 0.99 4.77 -0.96 -4.89 117.00 113.08 2c91 n LEU 57 Ca 0.11 0.23 -0.17 0.00 -0.03 0.00 0.00 56.01 56.15 2c91 n LEU 57 Cb 0.29 -0.23 0.04 0.00 -2.33 0.00 0.00 43.42 41.19 2c91 n LEU 57 CO 0.26 -0.00 0.07 0.61 -1.33 0.00 0.00 177.39 177.00 2c91 n GLY 58 N 1.21 -0.21 0.18 -0.72 0.00 -1.26 -4.92 105.19 99.46 2c91 n GLY 58 Ca 0.16 -0.04 0.13 0.00 0.00 0.00 0.00 46.02 46.27 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 -3.43 0.83 -3.57 0.99 4.77 -1.26 -4.96 117.00 110.36 2c91 n LEU 59 Ca -0.05 -0.16 -0.21 0.00 -0.03 0.00 0.00 56.01 55.57 2c91 n LEU 59 Cb 0.57 -0.16 0.07 0.00 -2.33 0.00 0.00 43.42 41.57 2c91 n LEU 59 CO 0.41 0.16 0.09 0.61 -1.33 0.00 0.00 177.39 177.33 2c91 n GLY 60 N 1.36 -0.39 3.77 -0.72 0.00 -1.26 -4.87 105.19 103.08 2c91 n GLY 60 Ca 0.11 0.14 -0.40 0.00 0.00 0.00 0.00 46.02 45.88 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 -2.72 118.68 114.67 2c91 s LEU 61 Ca 0.17 2.79 0.00 0.00 -1.03 0.00 0.00 54.13 56.05 2c91 s LEU 61 Cb -0.08 -3.82 0.00 0.00 0.03 0.00 0.00 46.19 42.32 2c91 s LEU 61 CO 0.76 -0.87 0.00 0.61 0.23 0.00 0.00 176.35 177.08 2c91 n GLY 62 N 0.63 0.73 2.76 -3.19 0.00 -1.25 -4.32 105.19 100.55 2c91 n GLY 62 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 2c91 n GLY 62 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2c91 n SER 63 N -0.01 6.98 -1.90 1.61 7.64 -1.10 -4.48 113.62 122.36 2c91 n SER 63 Ca 0.00 -3.52 -0.25 0.00 1.01 0.00 0.00 58.87 56.12 2c91 n SER 63 Cb 0.01 -1.24 -0.03 0.00 -1.01 0.00 0.00 64.21 61.94 2c91 n SER 63 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2c91 n GLY 64 N 0.72 -0.16 0.00 0.23 0.00 -1.26 -3.40 105.19 101.31 2c91 n GLY 64 Ca 0.41 0.31 0.00 0.00 0.00 0.00 0.00 46.02 46.73 2c91 n GLY 64 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2c91 n ASP 65 N 0.65 0.00 -3.67 1.61 8.00 -1.26 -5.12 116.55 116.76 2c91 n ASP 65 Ca 0.08 0.00 -0.09 0.00 0.71 0.00 0.00 54.79 55.49 2c91 n ASP 65 Cb 0.04 0.00 -0.10 0.00 -0.02 0.00 0.00 41.12 41.04 2c91 n ASP 65 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2c91 h THR 67 N 5.95 0.93 -3.50 0.00 1.35 -1.92 -3.46 112.91 112.26 2c91 h THR 67 Ca -0.23 -2.64 -0.53 0.00 -0.55 0.00 0.00 66.41 62.47 2c91 h THR 67 Cb 1.13 2.62 -0.02 0.00 -1.73 0.00 0.00 68.15 70.15 2c91 h THR 67 CO 0.18 0.77 0.32 -0.69 -0.25 0.00 0.00 175.52 175.85 2c91 s VAL 68 N -2.60 4.64 -0.07 6.82 1.01 -1.26 -4.87 120.40 124.07 2c91 s VAL 68 Ca -0.12 1.98 0.01 0.00 0.00 0.00 0.00 61.98 63.85 2c91 s VAL 68 Cb 0.07 -4.28 -0.03 0.00 0.00 0.00 0.00 36.38 32.14 2c91 s VAL 68 CO 0.82 0.29 -0.08 -0.54 0.00 0.00 0.00 175.10 175.59 2c91 s LYS 69 N 0.23 2.73 -0.07 2.72 -0.14 0.03 -4.66 119.74 120.58 2c91 s LYS 69 Ca 0.46 -0.58 0.05 0.00 -1.36 0.00 0.00 55.97 54.54 2c91 s LYS 69 Cb -0.22 -2.55 -0.00 0.00 -1.68 0.00 0.00 37.83 33.37 2c91 s LYS 69 CO 0.28 0.64 -0.23 -1.50 -0.76 0.00 0.00 175.35 173.78 2c91 s ILE 70 N -0.75 1.91 -0.06 2.17 1.10 -1.26 -1.10 121.20 123.21 2c91 s ILE 70 Ca 0.11 -0.97 0.04 0.00 -0.51 0.00 0.00 60.65 59.33 2c91 s ILE 70 Cb -0.11 -1.64 -0.02 0.00 0.15 0.00 0.00 42.46 40.84 2c91 s ILE 70 CO 0.01 0.53 -0.18 0.00 -2.11 0.00 0.00 174.94 173.19 2c91 s ALA 71 N 0.07 2.48 0.30 1.50 0.00 0.04 -1.40 121.76 124.75 2c91 s ALA 71 Ca -0.09 -1.00 0.04 0.00 0.00 0.00 0.00 51.96 50.91 2c91 s ALA 71 Cb -0.15 -0.89 -0.01 0.00 0.00 0.00 0.00 23.12 22.07 2c91 s ALA 71 CO 0.05 0.47 0.14 -2.37 0.00 0.00 0.00 175.76 174.05 2c91 n THR 72 N 2.66 0.00 -3.77 0.00 5.66 -0.63 -0.86 114.28 117.34 2c91 n THR 72 Ca -0.17 -1.83 -0.13 0.00 -3.05 0.00 0.00 64.05 58.87 2c91 n THR 72 Cb 0.52 0.72 -0.11 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 -3.15 0.42 -0.06 1.09 1.02 -1.25 -0.75 119.74 117.05 2c91 s LYS 73 Ca 0.20 0.34 -0.01 0.00 0.02 0.00 0.00 55.97 56.52 2c91 s LYS 73 Cb 0.01 0.20 -0.03 0.00 -0.52 0.00 0.00 37.83 37.49 2c91 s LYS 73 CO 0.14 -0.06 -0.01 0.00 -0.92 0.00 0.00 175.35 174.49 2c91 s ALA 74 N -0.07 3.22 0.15 5.17 0.00 -0.14 -2.17 121.76 127.91 2c91 s ALA 74 Ca -0.02 -0.85 0.08 0.00 0.00 0.00 0.00 51.96 51.16 2c91 s ALA 74 Cb -0.03 -1.39 -0.04 0.00 0.00 0.00 0.00 23.12 21.66 2c91 s ALA 74 CO 0.01 0.60 -0.16 0.54 0.00 0.00 0.00 175.76 176.74 2c91 s ASN 75 N -1.00 2.44 0.00 0.00 2.20 -1.26 -0.77 114.94 116.55 2c91 s ASN 75 Ca 0.14 -0.86 0.27 0.00 -0.94 0.00 0.00 52.86 51.47 2c91 s ASN 75 Cb -0.11 -0.12 1.15 0.00 -2.00 0.00 0.00 41.25 40.16 2c91 s ASN 75 CO 0.04 -0.09 1.79 -0.81 -2.94 0.00 0.00 177.10 175.09 2c91 n PRO 76 N 0.31 1.54 -1.30 3.55 -0.04 -1.26 -4.44 135.00 133.36 2c91 n PRO 76 Ca -0.13 -0.79 -0.30 0.00 -0.04 0.00 0.00 63.50 62.23 2c91 n PRO 76 Cb 0.57 -1.46 0.12 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 2.48 -1.53 0.54 0.51 -1.26 -1.53 118.94 116.18 2c91 s TRP 77 Ca 0.38 1.26 -0.13 0.00 -2.12 0.00 0.00 56.10 55.49 2c91 s TRP 77 Cb 0.20 -3.14 0.09 0.00 -0.81 0.00 0.00 33.47 29.81 2c91 s TRP 77 CO 0.33 -2.17 0.96 0.39 -0.51 0.00 0.00 176.95 175.95 2c91 n GLU 78 N -3.73 -5.41 -0.75 4.98 1.02 -1.26 -1.56 120.64 113.94 2c91 n GLU 78 Ca 0.07 0.59 0.00 0.00 -0.02 0.00 0.00 57.16 57.80 2c91 n GLU 78 Cb 0.55 -5.46 0.00 0.00 -0.02 0.00 0.00 31.44 26.52 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 -1.68 1.00 0.23 0.62 0.00 -1.25 -4.93 105.19 99.18 2c91 n GLY 79 Ca 0.03 0.00 -0.16 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 3.33 0.81 -2.42 1.61 1.57 -1.12 -3.50 116.57 116.85 2c91 h LYS 80 Ca 0.00 -0.61 0.26 0.00 -1.87 0.00 0.00 60.65 58.43 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 1.22 -0.72 -1.13 -0.57 0.00 0.00 179.45 178.25 2c91 n SER 81 N -3.96 -5.98 -1.68 0.86 3.41 -0.58 -4.57 113.62 101.12 2c91 n SER 81 Ca -0.06 0.82 -0.13 0.00 -0.26 0.00 0.00 58.87 59.24 2c91 n SER 81 Cb 0.71 -3.38 0.20 0.00 -0.26 0.00 0.00 64.21 61.48 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 -3.75 5.40 -4.67 1.04 4.77 -1.26 -4.36 117.00 114.17 2c91 n LEU 82 Ca -0.04 -3.66 -0.34 0.00 -0.03 0.00 0.00 56.01 51.94 2c91 n LEU 82 Cb 0.48 -0.73 0.12 0.00 -2.33 0.00 0.00 43.42 40.95 2c91 n LEU 82 CO 0.02 1.13 0.72 0.29 -1.33 0.00 0.00 177.39 178.22 2c91 n LYS 83 N -1.07 0.31 -0.23 3.23 4.76 -1.26 -4.35 118.16 119.55 2c91 n LYS 83 Ca 0.45 0.18 -0.01 0.00 -2.87 0.00 0.00 58.31 56.06 2c91 n LYS 83 Cb 1.34 -2.40 0.06 0.00 -1.84 0.00 0.00 35.03 32.19 2c91 n LYS 83 CO 0.00 0.00 0.00 -1.35 -1.37 0.00 0.00 177.40 174.68 2c91 h PRO 84 N -0.68 -0.05 -0.97 1.97 0.11 -1.92 -1.01 132.00 129.46 2c91 h PRO 84 Ca -0.47 0.00 0.04 0.00 0.11 0.00 0.00 66.00 65.68 2c91 h PRO 84 Cb 1.31 0.01 -0.06 0.00 0.11 0.00 0.00 31.00 32.37 2c91 h PRO 84 CO 0.46 -0.03 0.63 -0.44 -0.21 0.00 0.00 178.00 178.41 2c91 h ASP 85 N -0.05 1.05 -0.19 -2.05 3.32 -1.98 -2.05 116.42 114.47 2c91 h ASP 85 Ca 0.31 -0.01 -0.06 0.00 0.02 0.00 0.00 57.03 57.29 2c91 h ASP 85 Cb 0.53 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 39.84 2c91 h ASP 85 CO -0.72 0.71 -0.13 -1.28 -1.72 0.00 0.00 179.24 176.10 2c91 h SER 86 N 1.21 0.45 -0.48 6.45 0.87 -1.53 -1.38 113.55 119.14 2c91 h SER 86 Ca 0.39 -0.44 0.03 0.00 -1.23 0.00 0.00 61.79 60.54 2c91 h SER 86 Cb 0.02 -0.12 -0.04 0.00 -0.44 0.00 0.00 62.40 61.82 2c91 h SER 86 CO -0.13 0.79 0.27 0.40 -0.53 0.00 0.00 176.83 177.63 2c91 h ILE 87 N 0.10 1.02 0.17 2.23 2.04 -1.13 -1.14 117.51 120.80 2c91 h ILE 87 Ca 0.04 -0.18 -0.00 0.00 1.00 0.00 0.00 64.86 65.71 2c91 h ILE 87 Cb 0.64 0.44 -0.01 0.00 -0.74 0.00 0.00 36.82 37.15 2c91 h ILE 87 CO 0.04 0.10 -0.12 -0.09 0.00 0.00 0.00 178.15 178.07 2c91 h ARG 88 N 0.53 -0.29 -0.27 2.37 2.43 -1.35 -1.40 114.38 116.40 2c91 h ARG 88 Ca 0.20 0.02 0.04 0.00 -0.81 0.00 0.00 59.98 59.43 2c91 h ARG 88 Cb 0.05 0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 29.63 2c91 h ARG 88 CO -0.11 -0.19 0.01 1.03 -1.51 0.00 0.00 179.97 179.20 2c91 h SER 89 N -0.30 -0.08 -0.20 -3.80 0.87 -1.00 0.74 113.55 109.78 2c91 h SER 89 Ca -0.01 0.06 0.00 0.00 -1.23 0.00 0.00 61.79 60.61 2c91 h SER 89 Cb 0.26 0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 62.31 2c91 h SER 89 CO -0.01 -0.01 0.13 1.56 -0.53 0.00 0.00 176.83 177.97 2c91 h GLN 90 N 0.10 0.26 -0.35 2.24 4.20 -1.18 0.07 115.11 120.44 2c91 h GLN 90 Ca 0.13 -0.02 -0.02 0.00 0.06 0.00 0.00 58.65 58.80 2c91 h GLN 90 Cb 0.16 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 27.87 2c91 h GLN 90 CO -0.20 0.18 0.14 1.25 -0.67 0.00 0.00 178.83 179.52 2c91 h LEU 91 N 0.26 0.49 -1.03 1.46 5.85 -0.98 0.02 115.31 121.37 2c91 h LEU 91 Ca 0.07 -0.17 -0.03 0.00 0.84 0.00 0.00 57.88 58.59 2c91 h LEU 91 Cb -0.02 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 40.85 2c91 h LEU 91 CO -0.02 0.53 0.27 -0.33 -0.34 0.00 0.00 178.44 178.55 2c91 h GLU 92 N 0.42 0.97 -0.34 1.25 5.08 -0.68 -0.86 114.58 120.41 2c91 h GLU 92 Ca 0.12 -0.15 -0.02 0.00 -1.00 0.00 0.00 59.36 58.30 2c91 h GLU 92 Cb 0.19 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.26 2c91 h GLU 92 CO -0.01 0.78 0.12 1.15 -1.00 0.00 0.00 179.01 180.05 2c91 h THR 93 N 0.95 1.20 -0.37 1.13 2.02 -0.77 -2.58 112.91 114.49 2c91 h THR 93 Ca 0.23 -0.63 0.03 0.00 0.77 0.00 0.00 66.41 66.81 2c91 h THR 93 Cb 0.17 0.97 -0.03 0.00 -1.74 0.00 0.00 68.15 67.52 2c91 h THR 93 CO -0.02 0.22 0.17 0.28 0.37 0.00 0.00 175.52 176.54 2c91 h SER 94 N 0.40 0.24 -0.73 4.18 0.02 -0.25 -1.75 113.55 115.66 2c91 h SER 94 Ca 0.11 0.02 -0.00 0.00 -0.84 0.00 0.00 61.79 61.08 2c91 h SER 94 Cb 0.22 -0.02 -0.04 0.00 0.14 0.00 0.00 62.40 62.71 2c91 h SER 94 CO -0.01 0.18 0.44 -0.07 -1.14 0.00 0.00 176.83 176.24 2c91 h LEU 95 N 0.36 0.89 -0.14 5.07 3.38 -1.13 0.27 115.31 124.01 2c91 h LEU 95 Ca 0.16 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 2c91 h LEU 95 Cb 0.09 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 2c91 h LEU 95 CO -0.13 0.68 0.05 0.50 0.09 0.00 0.00 178.44 179.64 2c91 h LYS 96 N 1.02 0.21 -0.33 1.13 3.64 -1.04 -0.34 116.57 120.87 2c91 h LYS 96 Ca 0.27 -0.04 -0.13 0.00 -1.27 0.00 0.00 60.65 59.48 2c91 h LYS 96 Cb -0.04 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 31.74 2c91 h LYS 96 CO -0.05 0.32 -0.32 0.00 -2.27 0.00 0.00 179.45 177.13 2c91 h ARG 97 N 0.06 0.72 0.00 1.90 3.08 -0.62 -2.51 114.38 117.01 2c91 h ARG 97 Ca 0.05 -0.33 0.00 0.00 0.07 0.00 0.00 59.98 59.76 2c91 h ARG 97 Cb 0.19 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.23 2c91 h ARG 97 CO -0.00 0.94 0.00 1.28 -1.07 0.00 0.00 179.97 181.12 2c91 n LEU 98 N -4.07 0.06 -3.54 3.04 4.77 0.90 -3.88 117.00 114.28 2c91 n LEU 98 Ca -0.01 0.51 -0.19 0.00 -0.03 0.00 0.00 56.01 56.29 2c91 n LEU 98 Cb 0.48 -0.50 0.06 0.00 -2.33 0.00 0.00 43.42 41.14 2c91 n LEU 98 CO 0.45 -0.17 0.03 0.00 -1.33 0.00 0.00 177.39 176.37 2c91 n GLN 99 N -1.57 -5.79 -3.84 3.23 6.02 -0.28 -4.28 117.38 110.88 2c91 n GLN 99 Ca 0.05 0.75 -0.11 0.00 -0.01 0.00 0.00 57.00 57.67 2c91 n GLN 99 Cb 0.25 -5.56 -0.09 0.00 1.02 0.00 0.00 30.24 25.85 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 4.00 0.00 -2.10 0.00 0.13 -1.84 -3.42 132.00 128.77 2c91 h PRO 101 Ca -0.31 0.00 0.02 0.00 -0.87 0.00 0.00 66.00 64.84 2c91 h PRO 101 Cb 1.19 0.00 -0.18 0.00 0.13 0.00 0.00 31.00 32.14 2c91 h PRO 101 CO 0.42 0.00 0.35 -0.98 -0.23 0.00 0.00 178.00 177.56 2c91 s ARG 102 N -3.19 0.92 0.11 0.86 1.04 -1.26 -4.62 118.95 112.81 2c91 s ARG 102 Ca 0.07 -0.00 0.02 0.00 -1.04 0.00 0.00 55.73 54.77 2c91 s ARG 102 Cb 0.10 0.43 -0.04 0.00 -2.04 0.00 0.00 34.95 33.40 2c91 s ARG 102 CO 0.67 -0.33 0.22 0.14 -0.04 0.00 0.00 175.30 175.96 2c91 s VAL 103 N -1.97 5.18 0.20 4.99 -7.23 -0.78 -3.92 120.40 116.86 2c91 s VAL 103 Ca -0.03 -0.63 0.08 0.00 -1.81 0.00 0.00 61.98 59.58 2c91 s VAL 103 Cb -0.00 -3.60 -0.12 0.00 0.56 0.00 0.00 36.38 33.22 2c91 s VAL 103 CO 0.00 0.01 1.45 0.44 -0.31 0.00 0.00 175.10 176.68 2c91 h ASP 104 N 2.60 0.06 -3.21 4.85 3.32 -1.57 -1.14 116.42 121.33 2c91 h ASP 104 Ca -0.47 -0.04 -0.26 0.00 0.02 0.00 0.00 57.03 56.27 2c91 h ASP 104 Cb 1.18 -0.02 -0.34 0.00 0.22 0.00 0.00 39.33 40.38 2c91 h ASP 104 CO 0.70 0.84 -0.61 -0.22 -1.72 0.00 0.00 179.24 178.23 2c91 s LEU 105 N -7.26 0.22 -0.18 1.55 2.96 -1.05 -0.50 118.68 114.42 2c91 s LEU 105 Ca -0.01 0.35 0.01 0.00 -0.22 0.00 0.00 54.13 54.26 2c91 s LEU 105 Cb 0.11 0.37 0.03 0.00 0.50 0.00 0.00 46.19 47.20 2c91 s LEU 105 CO 0.80 -0.21 -0.16 0.12 -1.32 0.00 0.00 176.35 175.58 2c91 s PHE 106 N 1.84 2.59 0.01 5.38 5.36 0.18 -1.61 117.98 131.74 2c91 s PHE 106 Ca -0.02 -1.58 -0.00 0.00 -0.96 0.00 0.00 56.93 54.36 2c91 s PHE 106 Cb -0.12 -1.78 -0.04 0.00 -0.34 0.00 0.00 43.02 40.74 2c91 s PHE 106 CO -0.06 -0.77 0.12 0.71 -1.46 0.00 0.00 175.22 173.76 2c91 s TYR 107 N 1.35 3.36 -0.40 10.12 2.02 0.07 -0.90 117.35 132.98 2c91 s TYR 107 Ca 0.03 0.23 -0.29 0.00 -0.37 0.00 0.00 57.07 56.67 2c91 s TYR 107 Cb -0.14 -1.75 0.02 0.00 -0.40 0.00 0.00 41.96 39.70 2c91 s TYR 107 CO -0.11 0.57 1.13 -0.51 -1.57 0.00 0.00 175.55 175.07 2c91 s LEU 108 N -1.96 3.77 0.22 -1.29 1.43 -0.85 -0.97 118.68 119.04 2c91 s LEU 108 Ca 0.26 0.77 -0.00 0.00 -1.03 0.00 0.00 54.13 54.13 2c91 s LEU 108 Cb -0.12 -3.55 0.20 0.00 0.03 0.00 0.00 46.19 42.75 2c91 s LEU 108 CO 0.18 -1.09 1.56 -0.74 0.23 0.00 0.00 176.35 176.49 2c91 h HIS 109 N 8.80 0.58 -1.65 0.29 2.76 -1.19 -0.95 115.15 123.78 2c91 h HIS 109 Ca -0.22 -0.19 0.08 0.00 -2.20 0.00 0.00 60.37 57.84 2c91 h HIS 109 Cb 1.06 -0.11 -0.22 0.00 1.55 0.00 0.00 27.41 29.69 2c91 h HIS 109 CO 0.91 0.88 0.54 0.00 -1.30 0.00 0.00 177.93 178.95 2c91 s ALA 110 N -4.05 -1.92 0.54 5.26 0.00 -1.20 -4.23 121.76 116.15 2c91 s ALA 110 Ca -0.06 1.52 -0.22 0.00 0.00 0.00 0.00 51.96 53.19 2c91 s ALA 110 Cb 0.12 -0.55 -0.05 0.00 0.00 0.00 0.00 23.12 22.64 2c91 s ALA 110 CO 0.82 -0.36 1.37 -2.30 0.00 0.00 0.00 175.76 175.29 2c91 n PRO 111 N 0.60 1.77 -3.53 0.00 -0.02 -1.26 -4.56 135.00 128.00 2c91 n PRO 111 Ca -0.10 0.65 -0.41 0.00 -2.02 0.00 0.00 63.50 61.61 2c91 n PRO 111 Cb 0.58 -2.59 -0.08 0.00 -0.02 0.00 0.00 33.50 31.40 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 -0.85 5.74 0.00 2.55 2.15 -1.26 -4.87 116.67 120.13 2c91 s ASP 112 Ca 0.70 -1.88 0.23 0.00 0.43 0.00 0.00 52.55 52.03 2c91 s ASP 112 Cb -0.42 -2.03 1.15 0.00 -0.30 0.00 0.00 42.92 41.32 2c91 s ASP 112 CO 0.50 -0.70 1.76 1.41 -0.17 0.00 0.00 175.17 177.97 2c91 n HIS 113 N 4.94 0.00 1.04 -5.34 8.25 -1.26 -2.41 115.22 120.44 2c91 n HIS 113 Ca -0.08 0.00 0.11 0.00 -0.26 0.00 0.00 57.72 57.49 2c91 n HIS 113 Cb 0.41 -0.31 0.08 0.00 1.12 0.00 0.00 29.99 31.29 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 -1.31 1.11 -4.11 0.41 7.64 -1.26 -4.81 113.62 111.28 2c91 n SER 114 Ca 0.10 -0.91 -0.33 0.00 1.01 0.00 0.00 58.87 58.75 2c91 n SER 114 Cb 0.20 0.55 -0.16 0.00 -1.01 0.00 0.00 64.21 63.79 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 -2.80 2.01 0.11 0.44 2.01 -1.01 -5.09 115.64 111.30 2c91 s THR 115 Ca 0.14 -0.95 -0.36 0.00 0.31 0.00 0.00 61.69 60.83 2c91 s THR 115 Cb 0.17 -1.84 -0.16 0.00 0.01 0.00 0.00 72.50 70.68 2c91 s THR 115 CO 0.70 0.49 1.34 -2.65 -0.69 0.00 0.00 174.62 173.82 2c91 n PRO 116 N 4.63 1.28 0.18 4.92 -0.02 -1.26 -4.83 135.00 139.91 2c91 n PRO 116 Ca -0.20 0.46 0.05 0.00 -2.02 0.00 0.00 63.50 61.79 2c91 n PRO 116 Cb 0.50 -2.10 0.48 0.00 -0.02 0.00 0.00 33.50 32.36 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 3.26 1.13 -0.98 -1.45 3.04 -1.98 -1.53 116.25 117.74 2c91 h VAL 117 Ca -0.47 -0.58 0.07 0.00 -1.01 0.00 0.00 66.70 64.72 2c91 h VAL 117 Cb 1.33 1.22 -0.07 0.00 -2.01 0.00 0.00 31.29 31.75 2c91 h VAL 117 CO 0.78 0.17 0.62 -0.33 -1.01 0.00 0.00 177.57 177.81 2c91 h GLU 118 N 0.10 1.07 -0.26 4.17 3.07 -1.99 0.63 114.58 121.37 2c91 h GLU 118 Ca 0.02 -0.06 -0.02 0.00 -0.50 0.00 0.00 59.36 58.80 2c91 h GLU 118 Cb 0.28 -0.24 -0.01 0.00 -0.84 0.00 0.00 28.75 27.94 2c91 h GLU 118 CO 0.02 0.71 0.08 0.93 -1.40 0.00 0.00 179.01 179.35 2c91 h GLU 119 N 1.10 0.40 -0.10 2.33 5.08 -1.65 -1.58 114.58 120.17 2c91 h GLU 119 Ca 0.43 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.71 2c91 h GLU 119 Cb 0.23 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.41 2c91 h GLU 119 CO -0.19 0.46 0.06 1.15 -1.00 0.00 0.00 179.01 179.49 2c91 h THR 120 N 0.25 1.04 -0.27 1.13 2.02 -1.39 -2.65 112.91 113.04 2c91 h THR 120 Ca 0.08 -0.10 -0.12 0.00 0.77 0.00 0.00 66.41 67.04 2c91 h THR 120 Cb 0.23 0.93 -0.01 0.00 -1.74 0.00 0.00 68.15 67.56 2c91 h THR 120 CO -0.00 0.04 -0.35 -0.07 0.37 0.00 0.00 175.52 175.51 2c91 h LEU 121 N 0.12 0.62 -0.32 2.58 3.38 -0.77 -1.56 115.31 119.36 2c91 h LEU 121 Ca 0.04 -0.25 0.02 0.00 0.09 0.00 0.00 57.88 57.77 2c91 h LEU 121 Cb 0.01 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.56 2c91 h LEU 121 CO -0.01 0.92 0.16 0.00 0.09 0.00 0.00 178.44 179.60 2c91 h ALA 123 N 1.16 0.65 -0.95 0.00 0.00 -1.09 -1.19 119.26 117.84 2c91 h ALA 123 Ca 0.13 -0.00 0.03 0.00 0.00 0.00 0.00 54.91 55.07 2c91 h ALA 123 Cb 0.04 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 17.65 2c91 h ALA 123 CO -0.09 -0.01 0.63 0.00 0.00 0.00 0.00 179.25 179.77 2c91 h HIS 125 N 1.23 0.34 -0.42 0.00 6.17 -0.61 -1.97 115.15 119.90 2c91 h HIS 125 Ca 0.37 -0.02 0.08 0.00 0.71 0.00 0.00 60.37 61.51 2c91 h HIS 125 Cb -0.05 -0.10 -0.07 0.00 2.52 0.00 0.00 27.41 29.71 2c91 h HIS 125 CO -0.00 0.34 -0.00 1.96 0.71 0.00 0.00 177.93 180.94 2c91 h GLN 126 N 0.24 0.10 -0.58 5.26 4.20 -0.72 0.13 115.11 123.73 2c91 h GLN 126 Ca 0.08 -0.01 -0.06 0.00 0.06 0.00 0.00 58.65 58.72 2c91 h GLN 126 Cb 0.14 -0.02 -0.03 0.00 0.30 0.00 0.00 27.48 27.87 2c91 h GLN 126 CO -0.01 0.07 0.11 -0.07 -0.67 0.00 0.00 178.83 178.26 2c91 h LEU 127 N 0.10 0.86 -0.44 1.46 3.38 -1.17 -1.15 115.31 118.36 2c91 h LEU 127 Ca 0.21 -0.18 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 2c91 h LEU 127 Cb 0.30 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 2c91 h LEU 127 CO -0.35 0.86 0.19 -0.74 0.09 0.00 0.00 178.44 178.49 2c91 h HIS 128 N 0.87 0.66 -0.63 1.13 2.76 -0.84 -1.98 115.15 117.12 2c91 h HIS 128 Ca 0.18 -0.04 0.07 0.00 -2.20 0.00 0.00 60.37 58.38 2c91 h HIS 128 Cb 0.36 -0.20 -0.04 0.00 1.55 0.00 0.00 27.41 29.08 2c91 h HIS 128 CO 0.02 0.56 0.42 1.96 -1.30 0.00 0.00 177.93 179.59 2c91 h GLN 129 N 0.56 0.57 0.00 5.26 1.08 -0.40 0.24 115.11 122.42 2c91 h GLN 129 Ca 0.15 -0.03 0.00 0.00 -1.45 0.00 0.00 58.65 57.31 2c91 h GLN 129 Cb 0.17 -0.13 0.00 0.00 -0.05 0.00 0.00 27.48 27.47 2c91 h GLN 129 CO -0.01 0.37 0.00 0.39 -0.95 0.00 0.00 178.83 178.63 2c91 n GLU 130 N -4.48 0.26 -0.74 1.46 1.02 -0.49 -4.91 120.64 112.76 2c91 n GLU 130 Ca 0.09 0.05 0.00 0.00 -0.02 0.00 0.00 57.16 57.29 2c91 n GLU 130 Cb 0.27 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.19 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 0.93 0.56 0.16 0.62 0.00 0.07 -4.96 105.19 102.57 2c91 n GLY 131 Ca 0.10 -0.67 0.12 0.00 0.00 0.00 0.00 46.02 45.57 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 0.31 0.00 -2.93 1.61 1.57 -1.54 -3.42 116.57 112.17 2c91 h LYS 132 Ca 0.00 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.71 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 -0.06 -0.59 -0.57 0.00 0.00 179.45 178.23 2c91 s PHE 133 N -3.20 -0.32 -0.14 -1.35 -0.71 -1.26 -1.87 117.98 109.12 2c91 s PHE 133 Ca 0.07 0.32 -0.10 0.00 -1.04 0.00 0.00 56.93 56.18 2c91 s PHE 133 Cb 0.08 0.26 -0.06 0.00 -1.21 0.00 0.00 43.02 42.09 2c91 s PHE 133 CO 0.67 -0.59 -0.04 0.28 -1.34 0.00 0.00 175.22 174.20 2c91 h VAL 134 N 2.96 0.23 -3.82 -2.49 2.07 -1.25 -3.42 116.25 110.52 2c91 h VAL 134 Ca -0.31 -1.25 -0.68 0.00 0.82 0.00 0.00 66.70 65.28 2c91 h VAL 134 Cb 1.21 0.51 -0.20 0.00 -1.52 0.00 0.00 31.29 31.28 2c91 h VAL 134 CO 0.43 0.08 -0.75 -1.61 0.02 0.00 0.00 177.57 175.73 2c91 s GLU 135 N -2.13 2.40 -0.04 1.57 2.02 0.35 -5.01 118.70 117.85 2c91 s GLU 135 Ca -0.15 -0.79 -0.19 0.00 0.02 0.00 0.00 54.97 53.87 2c91 s GLU 135 Cb 0.02 -2.38 -0.05 0.00 0.10 0.00 0.00 34.13 31.82 2c91 s GLU 135 CO 0.26 0.59 0.52 -1.17 0.02 0.00 0.00 175.26 175.48 2c91 s LEU 136 N -1.24 4.38 0.23 1.80 2.96 -1.26 -0.65 118.68 124.90 2c91 s LEU 136 Ca 0.15 1.00 0.07 0.00 -0.22 0.00 0.00 54.13 55.12 2c91 s LEU 136 Cb -0.11 -2.77 -0.05 0.00 0.50 0.00 0.00 46.19 43.76 2c91 s LEU 136 CO 0.05 0.11 -0.09 -0.83 -1.32 0.00 0.00 176.35 174.27 2c91 s GLY 137 N -0.08 1.55 0.07 7.98 0.00 -0.07 -0.51 107.32 116.25 2c91 s GLY 137 Ca 0.28 -1.74 0.08 0.00 0.00 0.00 0.00 44.72 43.33 2c91 s GLY 137 CO 0.14 -1.76 -0.21 1.08 0.00 0.00 0.00 173.10 172.35 2c91 s LEU 138 N -3.35 2.22 -0.03 0.66 1.43 -0.41 -2.00 118.68 117.20 2c91 s LEU 138 Ca 0.25 -0.58 -0.02 0.00 -1.03 0.00 0.00 54.13 52.75 2c91 s LEU 138 Cb 0.02 -0.95 0.02 0.00 0.03 0.00 0.00 46.19 45.31 2c91 s LEU 138 CO 0.08 0.13 0.07 -0.55 0.23 0.00 0.00 176.35 176.31 2c91 s SER 139 N -1.45 -0.05 -0.89 2.29 0.15 -0.36 -0.67 113.70 112.72 2c91 s SER 139 Ca 0.07 0.15 0.00 0.00 0.70 0.00 0.00 55.95 56.87 2c91 s SER 139 Cb -0.09 0.10 0.00 0.00 -1.71 0.00 0.00 66.02 64.32 2c91 s SER 139 CO 0.03 -0.07 0.00 0.59 1.20 0.00 0.00 173.24 174.99 2c91 n ASN 140 N 3.50 -4.14 -4.88 5.45 3.02 -1.24 -3.27 115.26 113.70 2c91 n ASN 140 Ca -0.18 0.21 -0.32 0.00 -0.03 0.00 0.00 54.58 54.25 2c91 n ASN 140 Cb 0.56 -2.37 -0.05 0.00 -0.61 0.00 0.00 39.78 37.31 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 -2.27 3.49 0.53 3.10 1.51 -1.26 -1.14 117.35 121.31 2c91 s TYR 141 Ca 0.00 0.69 -0.18 0.00 -1.01 0.00 0.00 57.07 56.57 2c91 s TYR 141 Cb 0.00 -2.11 -0.06 0.00 -0.11 0.00 0.00 41.96 39.68 2c91 s TYR 141 CO 0.00 0.41 1.04 0.00 -1.11 0.00 0.00 175.55 175.89 2c91 s ALA 142 N -1.64 2.83 0.31 3.71 0.00 -1.26 -4.72 121.76 120.99 2c91 s ALA 142 Ca 0.41 0.47 0.07 0.00 0.00 0.00 0.00 51.96 52.91 2c91 s ALA 142 Cb -0.12 -3.23 0.79 0.00 0.00 0.00 0.00 23.12 20.56 2c91 s ALA 142 CO 0.22 -0.52 1.75 0.66 0.00 0.00 0.00 175.76 177.88 2c91 h SER 143 N 1.01 0.71 0.67 0.00 4.64 -1.93 0.40 113.55 119.06 2c91 h SER 143 Ca -0.48 0.12 -0.06 0.00 -0.47 0.00 0.00 61.79 60.90 2c91 h SER 143 Cb 1.22 -0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.30 2c91 h SER 143 CO 0.59 0.19 -0.27 4.11 -0.87 0.00 0.00 176.83 180.58 2c91 h TRP 144 N 0.67 0.00 0.06 4.77 5.08 -1.93 -1.32 115.95 123.28 2c91 h TRP 144 Ca 0.60 0.00 -0.25 0.00 1.08 0.00 0.00 58.89 60.33 2c91 h TRP 144 Cb 1.04 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.20 2c91 h TRP 144 CO -0.01 0.27 -1.08 0.93 -1.28 0.00 0.00 178.44 177.27 2c91 h GLU 145 N 0.00 0.33 -0.24 0.12 5.08 -0.62 -2.36 114.58 116.89 2c91 h GLU 145 Ca -0.00 -0.44 0.00 0.00 -1.00 0.00 0.00 59.36 57.92 2c91 h GLU 145 Cb 0.68 0.15 -0.01 0.00 0.50 0.00 0.00 28.75 30.06 2c91 h GLU 145 CO 0.03 1.15 0.16 0.28 -1.00 0.00 0.00 179.01 179.63 2c91 h VAL 146 N 0.15 1.06 -0.85 3.13 2.07 -0.92 -1.28 116.25 119.61 2c91 h VAL 146 Ca -0.10 -0.11 -0.01 0.00 0.82 0.00 0.00 66.70 67.29 2c91 h VAL 146 Cb 1.75 0.71 -0.04 0.00 -1.52 0.00 0.00 31.29 32.19 2c91 h VAL 146 CO 0.18 0.06 0.48 0.00 0.02 0.00 0.00 177.57 178.31 2c91 h ALA 147 N 1.09 1.09 -0.69 1.67 0.00 -1.25 0.47 119.26 121.65 2c91 h ALA 147 Ca 0.09 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 2c91 h ALA 147 Cb -0.04 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.38 2c91 h ALA 147 CO -0.02 0.59 0.34 1.49 0.00 0.00 0.00 179.25 181.65 2c91 h GLU 148 N 1.18 0.99 0.17 0.00 4.81 -1.28 -1.71 114.58 118.74 2c91 h GLU 148 Ca 0.30 -0.14 -0.01 0.00 -0.13 0.00 0.00 59.36 59.38 2c91 h GLU 148 Cb 0.01 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.21 2c91 h GLU 148 CO -0.05 0.77 -0.08 0.82 -0.73 0.00 0.00 179.01 179.74 2c91 h ILE 149 N 0.96 0.95 -0.88 2.32 2.04 -0.38 -0.14 117.51 122.37 2c91 h ILE 149 Ca 0.24 -0.61 0.03 0.00 1.00 0.00 0.00 64.86 65.52 2c91 h ILE 149 Cb 0.11 1.31 -0.05 0.00 -0.74 0.00 0.00 36.82 37.45 2c91 h ILE 149 CO -0.03 0.14 0.57 0.00 0.00 0.00 0.00 178.15 178.83 2c91 h THR 151 N 1.13 1.26 -0.32 0.00 2.02 -1.19 -1.84 112.91 113.97 2c91 h THR 151 Ca 0.35 -0.94 -0.09 0.00 0.77 0.00 0.00 66.41 66.50 2c91 h THR 151 Cb -0.03 0.49 -0.01 0.00 -1.74 0.00 0.00 68.15 66.87 2c91 h THR 151 CO -0.11 0.36 -0.16 -0.07 0.37 0.00 0.00 175.52 175.91 2c91 h LEU 152 N 1.08 0.69 -0.26 2.58 3.38 -0.56 -2.72 115.31 119.50 2c91 h LEU 152 Ca 0.23 -0.41 0.00 0.00 0.09 0.00 0.00 57.88 57.79 2c91 h LEU 152 Cb 0.34 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 2c91 h LEU 152 CO -0.00 0.95 0.16 0.00 0.09 0.00 0.00 178.44 179.64 2c91 h LYS 154 N 0.33 -0.26 0.00 0.00 1.57 -1.34 -0.35 116.57 116.52 2c91 h LYS 154 Ca 0.09 0.02 -0.03 0.00 -1.87 0.00 0.00 60.65 58.86 2c91 h LYS 154 Cb -0.01 0.06 -0.00 0.00 0.08 0.00 0.00 32.23 32.36 2c91 h LYS 154 CO -0.02 -0.18 -0.14 0.66 -0.57 0.00 0.00 179.45 179.20 2c91 h SER 155 N -0.27 0.00 -0.29 0.86 4.64 -1.35 -3.17 113.55 113.97 2c91 h SER 155 Ca 0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 2c91 h SER 155 Cb 0.49 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.58 2c91 h SER 155 CO -0.41 0.14 0.00 0.59 -0.87 0.00 0.00 176.83 176.28 2c91 n ASN 156 N -3.34 3.07 -2.84 4.97 3.02 -0.52 -4.98 115.26 114.63 2c91 n ASN 156 Ca -0.00 -1.89 -0.21 0.00 -0.03 0.00 0.00 54.58 52.44 2c91 n ASN 156 Cb 0.36 -0.18 0.03 0.00 -0.61 0.00 0.00 39.78 39.38 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 1.17 -0.45 3.90 7.41 0.00 -0.28 -5.02 105.19 111.91 2c91 n GLY 157 Ca 0.15 0.08 -0.30 0.00 0.00 0.00 0.00 46.02 45.95 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 -3.15 3.47 0.16 1.61 0.51 -0.40 -5.04 118.94 116.09 2c91 s TRP 158 Ca 0.28 0.58 -0.34 0.00 -2.12 0.00 0.00 56.10 54.50 2c91 s TRP 158 Cb -0.12 -2.03 -0.14 0.00 -0.81 0.00 0.00 33.47 30.36 2c91 s TRP 158 CO 0.35 0.34 1.57 1.51 -0.51 0.00 0.00 176.95 180.21 2c91 n ILE 159 N -0.30 0.00 -2.59 2.03 3.06 -1.26 -4.52 119.36 115.78 2c91 n ILE 159 Ca -0.02 -0.00 -0.34 0.00 -2.50 0.00 0.00 62.75 59.88 2c91 n ILE 159 Cb 0.53 -1.51 -0.04 0.00 0.54 0.00 0.00 39.64 39.16 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 0.91 3.93 0.32 9.51 2.01 -1.26 -4.93 118.68 129.18 2c91 s LEU 160 Ca 0.79 1.92 -0.28 0.00 0.01 0.00 0.00 54.13 56.57 2c91 s LEU 160 Cb -0.69 -4.47 -0.09 0.00 0.01 0.00 0.00 46.19 40.95 2c91 s LEU 160 CO 0.38 -0.65 1.16 -2.16 1.01 0.00 0.00 176.35 176.10 2c91 s PRO 161 N -3.05 4.42 0.00 1.29 0.04 -1.26 -4.42 135.00 132.02 2c91 s PRO 161 Ca 0.64 1.90 0.00 0.00 0.04 0.00 0.00 61.00 63.59 2c91 s PRO 161 Cb -0.17 -3.02 0.00 0.00 0.04 0.00 0.00 34.50 31.36 2c91 s PRO 161 CO 0.21 -0.02 0.21 0.25 0.04 0.00 0.00 177.00 177.68 2c91 n THR 162 N 0.79 0.00 -4.31 1.26 -2.24 0.33 -4.78 114.28 105.32 2c91 n THR 162 Ca 0.01 -0.48 -0.18 0.00 -2.27 0.00 0.00 64.05 61.13 2c91 n THR 162 Cb 0.45 1.02 -0.14 0.00 -2.10 0.00 0.00 70.33 69.55 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 0.75 -0.09 2.28 1.01 -1.21 -1.32 120.40 121.26 2c91 s VAL 163 Ca 0.00 -0.59 0.03 0.00 0.00 0.00 0.00 61.98 61.42 2c91 s VAL 163 Cb 0.00 -0.67 0.01 0.00 0.00 0.00 0.00 36.38 35.72 2c91 s VAL 163 CO 0.00 0.08 -0.18 -0.47 0.00 0.00 0.00 175.10 174.53 2c91 s TYR 164 N -0.49 2.08 -0.30 5.22 6.14 -0.13 -1.29 117.35 128.59 2c91 s TYR 164 Ca 0.01 -0.88 -0.07 0.00 0.64 0.00 0.00 57.07 56.77 2c91 s TYR 164 Cb -0.05 -1.45 0.00 0.00 0.42 0.00 0.00 41.96 40.88 2c91 s TYR 164 CO 0.00 -0.40 0.09 -1.14 0.64 0.00 0.00 175.55 174.75 2c91 s GLN 165 N 0.61 3.17 0.08 4.97 0.74 0.15 -0.68 119.66 128.71 2c91 s GLN 165 Ca -0.14 -0.81 0.02 0.00 0.05 0.00 0.00 55.36 54.48 2c91 s GLN 165 Cb -0.16 -3.41 -0.03 0.00 1.10 0.00 0.00 33.01 30.50 2c91 s GLN 165 CO 0.04 -0.42 -0.08 0.20 -0.55 0.00 0.00 175.29 174.48 2c91 s GLY 166 N 1.53 0.71 -0.25 2.59 0.00 0.39 -3.68 107.32 108.62 2c91 s GLY 166 Ca 0.03 -1.12 -0.29 0.00 0.00 0.00 0.00 44.72 43.34 2c91 s GLY 166 CO 0.03 -1.20 1.53 -0.29 0.00 0.00 0.00 173.10 173.18 2c91 s MET 167 N -2.82 3.81 -0.23 2.90 1.75 -1.26 -0.41 119.30 123.05 2c91 s MET 167 Ca 0.03 1.54 -0.11 0.00 -1.25 0.00 0.00 55.69 55.90 2c91 s MET 167 Cb -0.02 -4.00 0.08 0.00 2.84 0.00 0.00 34.83 33.74 2c91 s MET 167 CO -0.02 -1.26 0.54 -0.47 -0.65 0.00 0.00 175.02 173.16 2c91 s TYR 168 N 5.02 -0.91 0.34 4.11 5.04 -0.91 -4.68 117.35 125.37 2c91 s TYR 168 Ca 0.67 1.77 -0.15 0.00 -2.44 0.00 0.00 57.07 56.92 2c91 s TYR 168 Cb -0.23 0.48 0.03 0.00 0.35 0.00 0.00 41.96 42.60 2c91 s TYR 168 CO 0.28 -0.48 0.71 0.54 -1.34 0.00 0.00 175.55 175.25 2c91 s ASN 169 N 1.96 0.03 0.60 4.32 2.20 -0.83 -3.95 114.94 119.27 2c91 s ASN 169 Ca -0.08 -1.03 0.31 0.00 -0.94 0.00 0.00 52.86 51.13 2c91 s ASN 169 Cb -0.09 0.78 1.81 0.00 -2.00 0.00 0.00 41.25 41.75 2c91 s ASN 169 CO -0.16 -1.51 2.18 0.00 -2.94 0.00 0.00 177.10 174.67 2c91 h ALA 170 N 2.03 1.58 -0.16 3.54 0.00 -1.86 -0.97 119.26 123.43 2c91 h ALA 170 Ca -0.28 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.63 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 0.35 -0.16 0.00 0.25 0.00 0.00 0.00 179.25 179.69 2c91 n THR 171 N -3.67 1.38 -3.51 0.00 -2.24 -1.26 -4.42 114.28 100.56 2c91 n THR 171 Ca -0.01 -1.37 -0.27 0.00 -2.27 0.00 0.00 64.05 60.13 2c91 n THR 171 Cb 0.22 0.24 -0.14 0.00 -2.10 0.00 0.00 70.33 68.55 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 -1.64 -0.09 -0.04 4.28 2.01 -0.37 -4.83 115.64 114.95 2c91 s THR 172 Ca 0.21 -0.85 0.06 0.00 0.31 0.00 0.00 61.69 61.42 2c91 s THR 172 Cb 0.15 -0.99 0.09 0.00 0.01 0.00 0.00 72.50 71.76 2c91 s THR 172 CO 0.07 -0.73 1.03 0.54 -0.69 0.00 0.00 174.62 174.84 2c91 n ARG 173 N 5.09 0.47 -0.10 4.92 1.74 -1.26 -1.97 116.66 125.54 2c91 n ARG 173 Ca -0.03 -1.49 0.09 0.00 -0.77 0.00 0.00 57.85 55.66 2c91 n ARG 173 Cb 0.42 -0.83 0.45 0.00 -1.02 0.00 0.00 32.46 31.49 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 0.50 0.00 5.56 4.15 -1.89 -1.43 115.11 122.00 2c91 h GLN 174 Ca 0.00 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.39 2c91 h GLN 174 Cb 1.24 -0.11 0.00 0.00 0.21 0.00 0.00 27.48 28.82 2c91 h GLN 174 CO 0.00 0.33 0.09 -0.39 -1.93 0.00 0.00 178.83 176.93 2c91 h VAL 175 N 0.51 0.00 -0.32 2.39 -1.51 -1.87 -3.23 116.25 112.22 2c91 h VAL 175 Ca 0.27 0.00 -0.13 0.00 -1.23 0.00 0.00 66.70 65.61 2c91 h VAL 175 Cb 0.39 0.86 -0.01 0.00 -2.13 0.00 0.00 31.29 30.41 2c91 h VAL 175 CO -0.08 0.00 -0.30 -0.33 -1.23 0.00 0.00 177.57 175.63 2c91 h GLU 176 N 0.00 0.76 -0.33 5.19 5.08 -1.65 -1.09 114.58 122.54 2c91 h GLU 176 Ca 0.00 -0.40 -0.09 0.00 -1.00 0.00 0.00 59.36 57.88 2c91 h GLU 176 Cb 0.17 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.42 2c91 h GLU 176 CO 0.00 1.02 -0.13 0.00 -1.00 0.00 0.00 179.01 178.90 2c91 h ALA 177 N 0.73 0.46 0.00 3.43 0.00 -1.77 -3.39 119.26 118.72 2c91 h ALA 177 Ca 0.05 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.64 2c91 h ALA 177 Cb 0.87 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.55 2c91 h ALA 177 CO 0.08 0.35 -0.76 0.39 0.00 0.00 0.00 179.25 179.30 2c91 n GLU 178 N -4.38 0.00 0.26 0.00 1.02 -1.25 -4.72 120.64 111.56 2c91 n GLU 178 Ca -0.03 0.00 -0.15 0.00 -0.02 0.00 0.00 57.16 56.97 2c91 n GLU 178 Cb 0.37 -0.82 -0.08 0.00 -0.02 0.00 0.00 31.44 30.89 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 -0.55 -0.39 -4.62 5.85 -1.73 -2.87 115.31 111.00 2c91 h LEU 179 Ca 0.00 -0.07 0.08 0.00 0.84 0.00 0.00 57.88 58.73 2c91 h LEU 179 Cb 0.76 0.14 -0.09 0.00 0.37 0.00 0.00 40.66 41.84 2c91 h LEU 179 CO 0.00 -0.24 -0.26 -0.07 -0.34 0.00 0.00 178.44 177.53 2c91 h LEU 180 N -0.87 -0.87 -1.15 2.25 4.07 -1.39 -0.77 115.31 116.57 2c91 h LEU 180 Ca -0.07 0.17 0.13 0.00 0.08 0.00 0.00 57.88 58.20 2c91 h LEU 180 Cb 0.58 0.43 -0.08 0.00 1.08 0.00 0.00 40.66 42.68 2c91 h LEU 180 CO 0.11 -0.28 0.60 -0.65 -1.08 0.00 0.00 178.44 177.14 2c91 h PRO 181 N -0.20 0.81 -0.48 1.13 0.11 -1.78 -1.31 132.00 130.28 2c91 h PRO 181 Ca 0.18 -0.05 -0.05 0.00 0.11 0.00 0.00 66.00 66.20 2c91 h PRO 181 Cb 0.49 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 31.40 2c91 h PRO 181 CO -0.50 0.54 0.12 0.00 -0.21 0.00 0.00 178.00 177.95 2c91 h LEU 183 N 0.66 0.76 -0.58 0.00 3.38 -0.47 -1.68 115.31 117.37 2c91 h LEU 183 Ca 0.15 -0.21 -0.05 0.00 0.09 0.00 0.00 57.88 57.86 2c91 h LEU 183 Cb 0.32 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 2c91 h LEU 183 CO 0.00 0.87 0.16 0.03 0.09 0.00 0.00 178.44 179.59 2c91 h ARG 184 N 0.72 0.92 -0.51 1.13 -0.00 -1.09 0.28 114.38 115.82 2c91 h ARG 184 Ca 0.13 -0.21 -0.02 0.00 -0.50 0.00 0.00 59.98 59.38 2c91 h ARG 184 Cb 0.53 -0.13 -0.02 0.00 0.00 0.00 0.00 29.97 30.35 2c91 h ARG 184 CO 0.03 0.84 0.24 1.25 0.00 0.00 0.00 179.97 182.33 2c91 h HIS 185 N 0.84 0.74 -0.02 3.04 2.76 -0.97 -3.22 115.15 118.31 2c91 h HIS 185 Ca 0.19 -0.04 0.00 0.00 -2.20 0.00 0.00 60.37 58.32 2c91 h HIS 185 Cb 0.32 -0.23 0.00 0.00 1.55 0.00 0.00 27.41 29.05 2c91 h HIS 185 CO 0.02 0.58 -0.14 1.19 -1.30 0.00 0.00 177.93 178.29 2c91 n PHE 186 N -4.59 0.00 -1.63 5.26 3.72 -0.66 -4.97 117.46 114.59 2c91 n PHE 186 Ca 0.02 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.42 2c91 n PHE 186 Cb 0.12 -0.03 0.00 0.00 -0.94 0.00 0.00 39.48 38.64 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 1.30 0.85 3.82 1.37 0.00 0.71 -5.01 105.19 108.23 2c91 n GLY 187 Ca 0.14 -0.61 -0.35 0.00 0.00 0.00 0.00 46.02 45.20 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 -0.27 4.12 0.31 0.99 1.02 0.33 -4.85 118.68 120.33 2c91 s LEU 188 Ca 0.00 0.33 -0.03 0.00 0.02 0.00 0.00 54.13 54.44 2c91 s LEU 188 Cb 0.00 -2.11 -0.04 0.00 0.02 0.00 0.00 46.19 44.05 2c91 s LEU 188 CO 0.00 0.36 0.56 0.00 0.02 0.00 0.00 176.35 177.29 2c91 s ARG 189 N -1.22 3.58 -0.12 1.70 1.70 -0.44 -4.47 118.95 119.67 2c91 s ARG 189 Ca 0.17 -0.09 0.02 0.00 -0.47 0.00 0.00 55.73 55.36 2c91 s ARG 189 Cb -0.12 -2.64 -0.00 0.00 -0.57 0.00 0.00 34.95 31.62 2c91 s ARG 189 CO 0.07 0.17 -0.19 0.12 -1.08 0.00 0.00 175.30 174.39 2c91 s PHE 190 N -2.19 2.69 -0.20 5.89 5.36 -1.26 -0.96 117.98 127.31 2c91 s PHE 190 Ca 0.43 -0.98 -0.04 0.00 -0.96 0.00 0.00 56.93 55.38 2c91 s PHE 190 Cb -0.10 -1.80 -0.02 0.00 -0.34 0.00 0.00 43.02 40.76 2c91 s PHE 190 CO 0.33 -0.40 -0.04 0.71 -1.46 0.00 0.00 175.22 174.35 2c91 s TYR 191 N 0.51 2.97 -0.23 10.12 1.51 0.14 -1.06 117.35 131.31 2c91 s TYR 191 Ca -0.12 -0.68 -0.17 0.00 -1.01 0.00 0.00 57.07 55.09 2c91 s TYR 191 Cb -0.17 -2.05 -0.03 0.00 -0.11 0.00 0.00 41.96 39.60 2c91 s TYR 191 CO 0.05 -0.36 0.45 0.00 -1.11 0.00 0.00 175.55 174.58 2c91 s ALA 192 N 1.07 3.57 0.38 3.71 0.00 -0.29 -0.46 121.76 129.75 2c91 s ALA 192 Ca 0.01 -0.59 0.07 0.00 0.00 0.00 0.00 51.96 51.46 2c91 s ALA 192 Cb -0.15 -2.76 -0.01 0.00 0.00 0.00 0.00 23.12 20.20 2c91 s ALA 192 CO 0.00 -0.54 0.46 1.52 0.00 0.00 0.00 175.76 177.21 2c91 s TYR 193 N 1.84 2.88 -1.44 0.00 -0.85 0.46 -0.93 117.35 119.30 2c91 s TYR 193 Ca 0.20 -0.36 -0.07 0.00 -0.52 0.00 0.00 57.07 56.32 2c91 s TYR 193 Cb -0.15 -2.15 0.05 0.00 0.38 0.00 0.00 41.96 40.09 2c91 s TYR 193 CO 0.09 -0.16 0.77 0.09 -1.52 0.00 0.00 175.55 174.82 2c91 n ASN 194 N -1.66 -2.57 0.08 -0.18 5.03 -1.26 -2.13 115.26 112.56 2c91 n ASN 194 Ca 0.03 -0.85 0.09 0.00 0.87 0.00 0.00 54.58 54.72 2c91 n ASN 194 Cb 0.59 -3.71 0.39 0.00 -1.02 0.00 0.00 39.78 36.04 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 -4.46 0.10 -0.35 3.52 -0.04 -1.25 -1.20 135.00 131.32 2c91 n PRO 195 Ca -0.14 0.39 0.07 0.00 -0.04 0.00 0.00 63.50 63.78 2c91 n PRO 195 Cb 0.61 -1.72 0.19 0.00 -0.04 0.00 0.00 33.50 32.54 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 -1.91 3.10 -3.86 1.53 4.77 -1.26 -4.64 117.00 114.72 2c91 n LEU 196 Ca 0.02 -3.26 -0.25 0.00 -0.03 0.00 0.00 56.01 52.49 2c91 n LEU 196 Cb 0.17 -0.50 0.00 0.00 -2.33 0.00 0.00 43.42 40.75 2c91 n LEU 196 CO 0.15 0.86 -0.12 0.00 -1.33 0.00 0.00 177.39 176.94 2c91 n ALA 197 N -1.08 -1.89 -1.07 -1.18 0.00 -0.34 -0.49 120.51 114.46 2c91 n ALA 197 Ca 0.20 -0.17 -0.02 0.00 0.00 0.00 0.00 53.44 53.45 2c91 n ALA 197 Cb 0.78 -2.09 -0.01 0.00 0.00 0.00 0.00 19.45 18.13 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 -1.76 0.39 0.00 0.00 0.00 -1.26 -1.96 105.19 100.61 2c91 n GLY 198 Ca -0.25 -0.07 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 -0.57 0.56 0.37 -0.02 0.00 0.36 -4.74 105.19 101.15 2c91 n GLY 199 Ca -0.02 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.02 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 1.05 0.00 0.99 5.85 -0.68 -2.48 115.31 120.04 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 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 40.81 2c91 h LEU 200 CO 0.00 0.68 0.00 0.18 -0.34 0.00 0.00 178.44 178.96 2c91 n LEU 201 N -4.48 0.00 0.12 2.25 4.77 -0.38 -1.76 117.00 117.52 2c91 n LEU 201 Ca 0.15 0.00 0.13 0.00 -0.03 0.00 0.00 56.01 56.26 2c91 n LEU 201 Cb 0.16 0.00 0.36 0.00 -2.33 0.00 0.00 43.42 41.61 2c91 n LEU 201 CO 0.33 0.00 0.85 0.71 -1.33 0.00 0.00 177.39 177.94 2c91 h THR 202 N 0.00 0.00 0.00 -5.08 1.35 -1.66 -3.23 112.91 104.29 2c91 h THR 202 Ca 0.00 -0.55 0.00 0.00 -0.55 0.00 0.00 66.41 65.31 2c91 h THR 202 Cb 0.00 1.53 0.00 0.00 -1.73 0.00 0.00 68.15 67.95 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 1.28 0.41 0.00 5.82 0.00 -0.72 -4.22 105.19 107.75 2c91 n GLY 203 Ca 0.05 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.21 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 -1.86 0.35 -4.26 1.61 2.85 -1.26 -4.85 118.16 110.74 2c91 n LYS 204 Ca 0.00 0.01 -0.25 0.00 -1.05 0.00 0.00 58.31 57.02 2c91 n LYS 204 Cb 0.12 -1.50 -0.08 0.00 -0.65 0.00 0.00 35.03 32.92 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 -2.64 2.59 0.02 5.58 2.02 -1.26 -5.14 117.35 118.51 2c91 s TYR 205 Ca 0.25 -0.51 0.03 0.00 -0.37 0.00 0.00 57.07 56.48 2c91 s TYR 205 Cb 0.19 -1.70 -0.01 0.00 -0.40 0.00 0.00 41.96 40.04 2c91 s TYR 205 CO 0.46 0.35 -0.10 -1.59 -1.57 0.00 0.00 175.55 173.10 2c91 s LYS 206 N -3.80 0.74 0.35 -0.62 -2.85 -1.26 -5.05 119.74 107.25 2c91 s LYS 206 Ca 0.37 -0.53 0.11 0.00 -1.00 0.00 0.00 55.97 54.92 2c91 s LYS 206 Cb 0.02 -0.70 0.90 0.00 -2.06 0.00 0.00 37.83 36.00 2c91 s LYS 206 CO 0.21 0.18 1.78 -0.92 0.10 0.00 0.00 175.35 176.70 2c91 h TYR 207 N 5.35 0.88 0.00 1.78 5.03 -1.98 -1.07 116.97 126.96 2c91 h TYR 207 Ca -0.34 0.03 0.00 0.00 2.58 0.00 0.00 58.73 61.00 2c91 h TYR 207 Cb 1.18 -0.26 0.00 0.00 1.55 0.00 0.00 36.73 39.20 2c91 h TYR 207 CO 0.49 0.16 0.00 -0.85 -1.32 0.00 0.00 178.16 176.63 2c91 n GLU 208 N -4.71 0.49 0.02 1.82 0.00 -1.26 -2.67 120.64 114.33 2c91 n GLU 208 Ca 0.24 0.01 0.22 0.00 0.00 0.00 0.00 57.16 57.63 2c91 n GLU 208 Cb 0.69 -1.50 0.73 0.00 0.00 0.00 0.00 31.44 31.36 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 0.00 0.00 0.54 -1.84 3.32 -1.59 -1.70 116.42 115.15 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 0.23 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.77 2c91 h ASP 209 CO 0.00 0.00 -0.33 0.07 -1.72 0.00 0.00 179.24 177.26 2c91 h LYS 210 N 0.00 0.00 0.00 3.56 2.10 -1.72 0.87 116.57 121.38 2c91 h LYS 210 Ca 0.26 0.00 -0.21 0.00 -2.00 0.00 0.00 60.65 58.70 2c91 h LYS 210 Cb 1.27 0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 32.57 2c91 h LYS 210 CO -0.00 0.33 -1.37 -0.44 -2.00 0.00 0.00 179.45 175.97 2c91 h ASP 211 N 0.00 0.00 0.00 7.07 3.32 -1.57 -3.45 116.42 121.80 2c91 h ASP 211 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2c91 h ASP 211 Cb 0.69 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.24 2c91 h ASP 211 CO 0.04 0.75 0.00 0.61 -1.72 0.00 0.00 179.24 178.92 2c91 n GLY 212 N 1.42 0.72 0.28 2.75 0.00 -1.07 -4.93 105.19 104.36 2c91 n GLY 212 Ca -0.10 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.86 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 -0.17 -6.37 1.61 3.64 -1.79 -3.47 116.57 110.02 2c91 h LYS 213 Ca 0.00 0.01 -0.47 0.00 -1.27 0.00 0.00 60.65 58.92 2c91 h LYS 213 Cb 0.00 0.04 0.07 0.00 -0.41 0.00 0.00 32.23 31.92 2c91 h LYS 213 CO 0.00 -0.11 -0.96 1.04 -2.27 0.00 0.00 179.45 177.15 2c91 n GLN 214 N -5.40 -1.04 -1.82 1.90 6.02 0.29 -4.82 117.38 112.51 2c91 n GLN 214 Ca 0.02 0.38 -0.42 0.00 -0.01 0.00 0.00 57.00 56.97 2c91 n GLN 214 Cb 0.31 -3.80 -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 -6.28 4.17 0.27 -1.09 0.04 -1.26 -4.89 135.00 125.96 2c91 s PRO 215 Ca 0.48 2.46 -0.30 0.00 0.04 0.00 0.00 61.00 63.68 2c91 s PRO 215 Cb -0.19 -3.57 -0.12 0.00 0.04 0.00 0.00 34.50 30.66 2c91 s PRO 215 CO 0.88 -0.78 1.51 0.28 0.04 0.00 0.00 177.00 178.93 2c91 n VAL 216 N 4.69 1.03 -2.95 -0.36 0.31 -1.26 -4.27 118.33 115.52 2c91 n VAL 216 Ca 0.17 -0.26 0.00 0.00 -0.01 0.00 0.00 64.34 64.24 2c91 n VAL 216 Cb 0.39 -1.74 0.00 0.00 -0.91 0.00 0.00 33.84 31.58 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 2.10 -0.17 0.33 2.92 0.00 -0.95 -4.94 105.19 104.49 2c91 n GLY 217 Ca 0.10 -1.33 0.20 0.00 0.00 0.00 0.00 46.02 44.99 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 0.20 0.37 -0.02 1.61 9.65 -1.87 -2.00 114.38 122.32 2c91 h ARG 218 Ca 0.00 -0.02 0.00 0.00 -1.10 0.00 0.00 59.98 58.86 2c91 h ARG 218 Cb 0.00 -0.08 0.00 0.00 -1.39 0.00 0.00 29.97 28.50 2c91 h ARG 218 CO 0.00 0.24 -0.29 1.19 2.80 0.00 0.00 179.97 183.91 2c91 n PHE 219 N -5.03 0.00 -3.71 2.20 3.01 -1.26 -4.24 117.46 108.43 2c91 n PHE 219 Ca 0.28 0.00 -0.12 0.00 1.01 0.00 0.00 57.45 58.63 2c91 n PHE 219 Cb 0.86 -0.04 -0.12 0.00 -0.01 0.00 0.00 39.48 40.17 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 -2.37 -0.42 0.00 1.38 0.08 -0.75 -4.72 117.98 111.18 2c91 s PHE 220 Ca 0.24 0.95 0.00 0.00 0.12 0.00 0.00 56.93 58.24 2c91 s PHE 220 Cb 0.19 0.11 0.00 0.00 -0.57 0.00 0.00 43.02 42.75 2c91 s PHE 220 CO 0.49 -0.27 0.00 0.41 -0.10 0.00 0.00 175.22 175.75 2c91 n GLY 221 N 4.29 1.57 3.72 4.36 0.00 -1.26 -2.25 105.19 115.63 2c91 n GLY 221 Ca -0.24 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.51 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 -1.69 4.22 0.55 1.61 2.20 -1.26 -5.04 114.94 115.52 2c91 s ASN 222 Ca 0.00 -1.30 0.33 0.00 -0.94 0.00 0.00 52.86 50.96 2c91 s ASN 222 Cb 0.00 -0.18 1.42 0.00 -2.00 0.00 0.00 41.25 40.49 2c91 s ASN 222 CO 0.00 -0.63 2.01 0.78 -2.94 0.00 0.00 177.10 176.32 2c91 h ASN 223 N 1.45 0.00 -0.20 3.54 2.35 -1.97 -2.19 115.58 118.56 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 1.27 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.64 2c91 h ASN 223 CO 0.73 0.03 0.00 0.79 -1.65 0.00 0.00 177.43 177.33 2c91 n TRP 224 N -3.16 0.24 -0.14 1.19 7.02 -1.26 -4.63 117.44 116.71 2c91 n TRP 224 Ca 0.00 -0.12 -0.07 0.00 -1.02 0.00 0.00 57.50 56.29 2c91 n TRP 224 Cb 0.30 0.00 0.01 0.00 -2.42 0.00 0.00 31.31 29.20 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 4.58 0.55 -0.99 6.99 0.00 -1.57 -1.28 119.26 127.54 2c91 h ALA 225 Ca 0.00 -0.02 0.04 0.00 0.00 0.00 0.00 54.91 54.93 2c91 h ALA 225 Cb 0.95 -0.15 -0.06 0.00 0.00 0.00 0.00 17.79 18.53 2c91 h ALA 225 CO 0.00 -0.03 0.64 1.49 0.00 0.00 0.00 179.25 181.35 2c91 h GLU 226 N 0.55 1.19 -0.51 0.00 4.57 -1.82 0.17 114.58 118.72 2c91 h GLU 226 Ca 0.16 -0.07 -0.02 0.00 -1.18 0.00 0.00 59.36 58.26 2c91 h GLU 226 Cb -0.03 -0.27 -0.02 0.00 -0.16 0.00 0.00 28.75 28.27 2c91 h GLU 226 CO -0.05 0.78 0.26 1.15 -1.18 0.00 0.00 179.01 179.97 2c91 h THR 227 N 1.22 1.19 -0.65 0.32 2.02 -1.66 -0.28 112.91 115.06 2c91 h THR 227 Ca 0.40 -0.51 -0.07 0.00 0.77 0.00 0.00 66.41 67.00 2c91 h THR 227 Cb 0.05 0.58 -0.03 0.00 -1.74 0.00 0.00 68.15 67.01 2c91 h THR 227 CO -0.14 0.21 0.13 1.88 0.37 0.00 0.00 175.52 177.97 2c91 h TYR 228 N 0.68 1.10 -0.52 3.16 -1.99 -0.46 -1.10 116.97 117.84 2c91 h TYR 228 Ca 0.18 -0.13 -0.04 0.00 2.00 0.00 0.00 58.73 60.73 2c91 h TYR 228 Cb 0.09 -0.31 -0.02 0.00 2.00 0.00 0.00 36.73 38.49 2c91 h TYR 228 CO -0.01 0.91 0.16 0.00 -0.00 0.00 0.00 178.16 179.22 2c91 h ARG 229 N 0.99 0.82 -0.38 4.88 3.08 -0.40 -1.31 114.38 122.05 2c91 h ARG 229 Ca 0.20 -0.18 -0.00 0.00 0.07 0.00 0.00 59.98 60.07 2c91 h ARG 229 Cb 0.39 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.30 2c91 h ARG 229 CO 0.01 0.76 0.22 -0.91 -1.07 0.00 0.00 179.97 178.98 2c91 h ASN 230 N 0.72 0.45 -0.03 7.04 2.35 -0.87 0.15 115.58 125.39 2c91 h ASN 230 Ca 0.17 -0.02 -0.05 0.00 -0.55 0.00 0.00 56.30 55.85 2c91 h ASN 230 Cb 0.29 -0.11 0.00 0.00 0.05 0.00 0.00 38.32 38.54 2c91 h ASN 230 CO -0.00 0.36 -0.15 -0.09 -1.65 0.00 0.00 177.43 175.89 2c91 h ARG 231 N 0.52 0.17 0.00 0.81 2.43 -0.58 -3.42 114.38 114.31 2c91 h ARG 231 Ca 0.14 -0.13 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 2c91 h ARG 231 Cb -0.01 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.57 2c91 h ARG 231 CO -0.03 0.78 -0.48 1.19 -1.51 0.00 0.00 179.97 179.93 2c91 n PHE 232 N -4.60 0.00 -2.65 2.20 0.99 -0.55 -4.40 117.46 108.45 2c91 n PHE 232 Ca -0.09 0.00 -0.43 0.00 -0.00 0.00 0.00 57.45 56.93 2c91 n PHE 232 Cb 0.41 0.00 0.00 0.00 -1.00 0.00 0.00 39.48 38.89 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 -0.81 4.49 -4.45 1.38 -0.00 0.53 -4.83 117.44 113.75 2c91 n TRP 233 Ca 0.00 -3.09 -0.20 0.00 -0.00 0.00 0.00 57.50 54.21 2c91 n TRP 233 Cb 0.00 -2.33 -0.15 0.00 -0.00 0.00 0.00 31.31 28.84 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 2.36 0.89 0.21 5.87 1.02 -1.26 -4.84 119.74 123.99 2c91 s LYS 234 Ca 0.46 -0.45 -0.11 0.00 0.02 0.00 0.00 55.97 55.89 2c91 s LYS 234 Cb 0.02 -0.86 0.27 0.00 -0.52 0.00 0.00 37.83 36.75 2c91 s LYS 234 CO 0.02 0.23 1.67 0.93 -0.92 0.00 0.00 175.35 177.28 2c91 h GLU 235 N 5.72 0.12 -0.24 1.68 5.08 -1.99 0.72 114.58 125.68 2c91 h GLU 235 Ca -0.33 -0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.06 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 0.48 0.08 0.16 0.45 -1.00 0.00 0.00 179.01 179.19 2c91 h HIS 236 N 0.12 0.17 -0.27 4.33 3.86 -1.97 -1.27 115.15 120.12 2c91 h HIS 236 Ca 0.31 0.00 -0.12 0.00 -1.16 0.00 0.00 60.37 59.41 2c91 h HIS 236 Cb 0.49 -0.06 -0.00 0.00 1.06 0.00 0.00 27.41 28.90 2c91 h HIS 236 CO -0.35 0.10 -0.29 1.25 0.86 0.00 0.00 177.93 179.50 2c91 h HIS 237 N 0.18 0.81 -0.59 2.45 -0.00 -1.19 0.13 115.15 116.94 2c91 h HIS 237 Ca 0.10 -0.25 -0.02 0.00 -0.00 0.00 0.00 60.37 60.21 2c91 h HIS 237 Cb 0.19 -0.17 -0.03 0.00 -0.00 0.00 0.00 27.41 27.40 2c91 h HIS 237 CO -0.00 0.99 0.29 0.74 -0.00 0.00 0.00 177.93 179.95 2c91 h PHE 238 N 0.41 0.84 -0.99 5.26 -1.00 -0.83 -0.78 116.94 119.86 2c91 h PHE 238 Ca 0.04 -0.04 0.02 0.00 2.81 0.00 0.00 57.97 60.81 2c91 h PHE 238 Cb 0.85 -0.26 -0.05 0.00 3.61 0.00 0.00 35.95 40.10 2c91 h PHE 238 CO 0.07 0.63 0.65 0.93 -1.61 0.00 0.00 178.31 178.99 2c91 h GLU 239 N 0.80 1.27 -0.45 1.51 5.08 -1.06 -0.70 114.58 121.02 2c91 h GLU 239 Ca 0.20 -0.08 -0.02 0.00 -1.00 0.00 0.00 59.36 58.46 2c91 h GLU 239 Cb 0.10 -0.29 -0.02 0.00 0.50 0.00 0.00 28.75 29.05 2c91 h GLU 239 CO -0.03 0.84 0.19 0.00 -1.00 0.00 0.00 179.01 179.01 2c91 h ALA 240 N 1.40 0.58 -0.41 3.43 0.00 -0.35 -1.93 119.26 121.99 2c91 h ALA 240 Ca 0.37 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 55.13 2c91 h ALA 240 Cb -0.10 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 2c91 h ALA 240 CO -0.09 0.17 0.19 0.82 0.00 0.00 0.00 179.25 180.34 2c91 h ILE 241 N 0.58 1.18 -0.53 0.00 2.04 -0.73 -2.80 117.51 117.25 2c91 h ILE 241 Ca 0.15 -0.51 0.01 0.00 1.00 0.00 0.00 64.86 65.51 2c91 h ILE 241 Cb 0.17 0.76 -0.03 0.00 -0.74 0.00 0.00 36.82 36.99 2c91 h ILE 241 CO -0.01 0.19 0.35 0.00 0.00 0.00 0.00 178.15 178.68 2c91 h ALA 242 N 1.04 1.65 -0.53 1.87 0.00 -0.79 -0.88 119.26 121.62 2c91 h ALA 242 Ca 0.14 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.02 2c91 h ALA 242 Cb 0.13 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 2c91 h ALA 242 CO -0.02 0.32 0.35 1.25 0.00 0.00 0.00 179.25 181.15 2c91 h LEU 243 N 0.70 0.60 -0.32 0.00 7.12 -1.15 -0.71 115.31 121.56 2c91 h LEU 243 Ca 0.20 -0.02 -0.19 0.00 0.13 0.00 0.00 57.88 58.00 2c91 h LEU 243 Cb -0.04 -0.15 0.00 0.00 -0.53 0.00 0.00 40.66 39.94 2c91 h LEU 243 CO -0.05 0.44 -0.64 0.58 -0.13 0.00 0.00 178.44 178.64 2c91 h VAL 244 N 0.71 1.30 -0.90 1.05 2.07 -1.04 -2.20 116.25 117.24 2c91 h VAL 244 Ca 0.19 -1.86 0.02 0.00 0.82 0.00 0.00 66.70 65.87 2c91 h VAL 244 Cb -0.08 1.82 -0.05 0.00 -1.52 0.00 0.00 31.29 31.46 2c91 h VAL 244 CO -0.04 0.59 0.59 -0.33 0.02 0.00 0.00 177.57 178.40 2c91 h GLU 245 N 0.54 1.16 -0.66 1.57 5.08 -0.99 0.28 114.58 121.56 2c91 h GLU 245 Ca -0.01 -0.07 -0.04 0.00 -1.00 0.00 0.00 59.36 58.24 2c91 h GLU 245 Cb 1.23 -0.26 -0.03 0.00 0.50 0.00 0.00 28.75 30.19 2c91 h GLU 245 CO 0.13 0.76 0.25 -0.22 -1.00 0.00 0.00 179.01 178.94 2c91 h LYS 246 N 1.19 0.99 -0.45 2.33 3.64 -1.04 -2.23 116.57 121.00 2c91 h LYS 246 Ca 0.34 -0.19 -0.09 0.00 -1.27 0.00 0.00 60.65 59.44 2c91 h LYS 246 Cb -0.10 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 31.55 2c91 h LYS 246 CO -0.09 0.84 -0.09 0.00 -2.27 0.00 0.00 179.45 177.85 2c91 h ALA 247 N 1.11 1.01 0.15 5.00 0.00 -0.74 -1.23 119.26 124.56 2c91 h ALA 247 Ca 0.22 -0.31 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 2c91 h ALA 247 Cb 0.23 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 2c91 h ALA 247 CO -0.02 0.60 -0.09 -0.07 0.00 0.00 0.00 179.25 179.67 2c91 h LEU 248 N 0.72 -0.22 -0.49 0.00 3.38 -0.76 0.42 115.31 118.36 2c91 h LEU 248 Ca 0.13 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.08 2c91 h LEU 248 Cb 0.56 0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.36 2c91 h LEU 248 CO 0.03 -0.15 0.19 1.56 0.09 0.00 0.00 178.44 180.17 2c91 h GLN 249 N -0.23 0.73 -0.51 1.13 1.08 -1.26 0.34 115.11 116.39 2c91 h GLN 249 Ca -0.01 -0.14 -0.00 0.00 -1.45 0.00 0.00 58.65 57.04 2c91 h GLN 249 Cb 0.19 -0.12 -0.02 0.00 -0.05 0.00 0.00 27.48 27.48 2c91 h GLN 249 CO 0.02 0.66 0.30 1.15 -0.95 0.00 0.00 178.83 180.01 2c91 h THR 250 N 0.65 1.16 0.13 -0.54 2.02 -1.18 0.35 112.91 115.49 2c91 h THR 250 Ca 0.16 -0.37 -0.28 0.00 0.77 0.00 0.00 66.41 66.69 2c91 h THR 250 Cb 0.21 0.48 0.02 0.00 -1.74 0.00 0.00 68.15 67.11 2c91 h THR 250 CO -0.01 0.17 -1.23 0.74 0.37 0.00 0.00 175.52 175.55 2c91 h THR 251 N 0.68 1.39 0.00 3.16 2.02 -0.65 -3.40 112.91 116.12 2c91 h THR 251 Ca 0.18 -2.74 0.00 0.00 0.77 0.00 0.00 66.41 64.62 2c91 h THR 251 Cb 0.00 2.80 0.00 0.00 -1.74 0.00 0.00 68.15 69.22 2c91 h THR 251 CO -0.03 0.81 -1.14 -1.22 0.37 0.00 0.00 175.52 174.31 2c91 n TYR 252 N -3.67 0.00 -0.10 3.16 4.01 0.09 -5.09 117.16 115.56 2c91 n TYR 252 Ca -0.11 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.63 2c91 n TYR 252 Cb 0.99 -0.11 0.00 0.00 -0.31 0.00 0.00 39.34 39.91 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 2.06 2.98 0.24 2.72 0.00 0.11 -2.61 105.19 110.69 2c91 n GLY 253 Ca -0.01 -0.22 0.11 0.00 0.00 0.00 0.00 46.02 45.91 2c91 n GLY 253 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2c91 h THR 254 N 0.00 0.55 0.00 2.61 1.35 -1.95 -2.22 112.91 113.25 2c91 h THR 254 Ca 0.00 -0.86 0.00 0.00 -0.55 0.00 0.00 66.41 65.00 2c91 h THR 254 Cb 0.00 1.58 0.00 0.00 -1.73 0.00 0.00 68.15 68.00 2c91 h THR 254 CO 0.00 0.17 0.00 0.59 -0.25 0.00 0.00 175.52 176.03 2c91 n ASN 255 N -3.48 0.00 -4.72 5.36 3.02 -1.07 -4.95 115.26 109.42 2c91 n ASN 255 Ca -0.01 -1.75 -0.42 0.00 -0.03 0.00 0.00 54.58 52.37 2c91 n ASN 255 Cb 0.34 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.48 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 -2.00 3.68 0.69 5.41 0.00 -0.84 -4.97 121.76 123.73 2c91 s ALA 256 Ca 0.02 1.23 -0.17 0.00 0.00 0.00 0.00 51.96 53.05 2c91 s ALA 256 Cb 0.01 -3.58 0.02 0.00 0.00 0.00 0.00 23.12 19.56 2c91 s ALA 256 CO 0.02 -0.71 1.27 -1.25 0.00 0.00 0.00 175.76 175.09 2c91 s PRO 257 N 1.19 2.30 0.58 0.00 0.04 -1.26 -4.99 135.00 132.86 2c91 s PRO 257 Ca 0.67 1.98 -0.19 0.00 0.04 0.00 0.00 61.00 63.50 2c91 s PRO 257 Cb -0.40 -1.83 -0.04 0.00 0.04 0.00 0.00 34.50 32.27 2c91 s PRO 257 CO 0.31 -1.77 1.20 1.03 0.04 0.00 0.00 177.00 177.81 2c91 s ARG 258 N -3.59 3.04 0.25 4.56 0.52 -1.26 -4.81 118.95 117.66 2c91 s ARG 258 Ca 0.80 1.82 -0.03 0.00 -0.52 0.00 0.00 55.73 57.80 2c91 s ARG 258 Cb -0.35 -1.96 0.52 0.00 0.52 0.00 0.00 34.95 33.68 2c91 s ARG 258 CO 0.43 -1.15 1.70 1.98 0.02 0.00 0.00 175.30 178.28 2c91 h MET 259 N 0.97 0.35 -0.62 3.54 1.85 -1.86 0.11 114.93 119.27 2c91 h MET 259 Ca -0.50 -0.02 0.11 0.00 -0.61 0.00 0.00 59.70 58.67 2c91 h MET 259 Cb 1.29 -0.08 -0.08 0.00 0.43 0.00 0.00 31.60 33.16 2c91 h MET 259 CO 0.55 0.23 0.18 1.15 -0.40 0.00 0.00 176.91 178.63 2c91 h THR 260 N 0.36 0.68 -0.07 -0.77 2.02 -1.73 0.87 112.91 114.28 2c91 h THR 260 Ca 0.45 -0.11 -0.22 0.00 0.77 0.00 0.00 66.41 67.30 2c91 h THR 260 Cb 0.76 0.33 0.00 0.00 -1.74 0.00 0.00 68.15 67.50 2c91 h THR 260 CO -0.48 0.06 -0.84 0.77 0.37 0.00 0.00 175.52 175.40 2c91 h SER 261 N 0.33 0.69 -0.47 4.18 4.64 -1.23 -2.48 113.55 119.20 2c91 h SER 261 Ca 0.32 -0.49 0.00 0.00 -0.47 0.00 0.00 61.79 61.16 2c91 h SER 261 Cb 0.46 -0.21 -0.02 0.00 -0.31 0.00 0.00 62.40 62.32 2c91 h SER 261 CO -0.37 1.27 0.31 0.00 -0.87 0.00 0.00 176.83 177.17 2c91 h ALA 262 N 0.71 0.60 -0.47 5.18 0.00 -0.44 -0.91 119.26 123.92 2c91 h ALA 262 Ca -0.06 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.76 2c91 h ALA 262 Cb 1.45 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 19.03 2c91 h ALA 262 CO 0.16 0.05 0.09 0.00 0.00 0.00 0.00 179.25 179.55 2c91 h ALA 263 N 1.17 0.62 -0.36 0.00 0.00 -0.81 -1.00 119.26 118.88 2c91 h ALA 263 Ca 0.17 -0.22 -0.11 0.00 0.00 0.00 0.00 54.91 54.76 2c91 h ALA 263 Cb -0.07 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 2c91 h ALA 263 CO -0.04 0.33 -0.19 -0.07 0.00 0.00 0.00 179.25 179.29 2c91 h LEU 264 N 0.64 0.79 -1.55 0.00 3.38 -1.35 -2.78 115.31 114.43 2c91 h LEU 264 Ca 0.14 -0.41 0.02 0.00 0.09 0.00 0.00 57.88 57.73 2c91 h LEU 264 Cb 0.37 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.87 2c91 h LEU 264 CO 0.01 1.02 0.33 0.03 0.09 0.00 0.00 178.44 179.92 2c91 h ARG 265 N 0.55 0.58 -0.54 1.13 3.08 -1.05 -0.22 114.38 117.90 2c91 h ARG 265 Ca 0.08 -0.03 0.06 0.00 0.07 0.00 0.00 59.98 60.15 2c91 h ARG 265 Cb 0.73 -0.13 -0.05 0.00 0.08 0.00 0.00 29.97 30.60 2c91 h ARG 265 CO 0.06 0.38 0.25 2.35 -1.07 0.00 0.00 179.97 181.93 2c91 h TRP 266 N 0.59 0.45 -0.28 3.04 7.01 -0.92 -0.69 115.95 125.15 2c91 h TRP 266 Ca 0.20 0.02 0.01 0.00 2.11 0.00 0.00 58.89 61.23 2c91 h TRP 266 Cb 0.05 -0.12 -0.02 0.00 -2.10 0.00 0.00 29.16 26.97 2c91 h TRP 266 CO -0.00 0.19 0.17 0.52 -2.79 0.00 0.00 178.44 176.52 2c91 h MET 267 N 0.47 0.33 0.00 2.65 2.86 -0.85 0.23 114.93 120.62 2c91 h MET 267 Ca 0.25 -0.02 -0.16 0.00 -2.06 0.00 0.00 59.70 57.71 2c91 h MET 267 Cb 0.21 -0.07 -0.02 0.00 0.06 0.00 0.00 31.60 31.77 2c91 h MET 267 CO -0.20 0.22 -0.74 1.88 1.06 0.00 0.00 176.91 179.12 2c91 h TYR 268 N 0.34 0.00 0.00 -0.22 -1.99 -1.27 -3.35 116.97 110.48 2c91 h TYR 268 Ca 0.11 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.83 2c91 h TYR 268 Cb -0.00 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 38.72 2c91 h TYR 268 CO -0.08 0.74 -1.15 0.72 -0.00 0.00 0.00 178.16 178.40 2c91 n HIS 269 N -3.59 0.00 -0.53 4.88 8.25 -0.28 -4.46 115.22 119.49 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 0.74 -0.08 0.00 0.00 1.12 0.00 0.00 29.99 31.77 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 -1.69 0.00 -2.76 4.41 8.25 0.68 -5.05 115.22 119.07 2c91 n HIS 270 Ca -0.01 -0.11 -0.11 0.00 -0.26 0.00 0.00 57.72 57.23 2c91 n HIS 270 Cb 0.17 -0.01 0.05 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 -0.11 0.94 -0.75 0.41 3.41 -0.52 -4.95 113.62 112.05 2c91 n SER 271 Ca 0.00 -1.72 0.10 0.00 -0.26 0.00 0.00 58.87 56.99 2c91 n SER 271 Cb 0.25 -0.28 0.29 0.00 -0.26 0.00 0.00 64.21 64.21 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 -1.80 1.97 -1.89 4.33 6.02 -1.26 -4.91 117.38 119.83 2c91 n GLN 272 Ca 0.09 -1.47 -0.41 0.00 -0.01 0.00 0.00 57.00 55.20 2c91 n GLN 272 Cb 0.31 -1.40 -0.01 0.00 1.02 0.00 0.00 30.24 30.16 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 -1.38 4.36 -0.24 1.08 1.43 -1.26 -5.00 118.68 117.65 2c91 s LEU 273 Ca 0.33 2.90 0.02 0.00 -1.03 0.00 0.00 54.13 56.35 2c91 s LEU 273 Cb 0.18 -3.65 0.05 0.00 0.03 0.00 0.00 46.19 42.80 2c91 s LEU 273 CO 0.25 -0.79 -0.12 -1.10 0.23 0.00 0.00 176.35 174.82 2c91 s GLN 274 N -1.43 2.31 0.40 1.70 -0.21 -1.26 -4.87 119.66 116.30 2c91 s GLN 274 Ca 0.55 -1.23 0.11 0.00 0.02 0.00 0.00 55.36 54.82 2c91 s GLN 274 Cb -0.45 -2.80 0.92 0.00 1.00 0.00 0.00 33.01 31.68 2c91 s GLN 274 CO 0.55 -0.51 1.93 0.78 -2.12 0.00 0.00 175.29 175.92 2c91 h GLY 275 N 7.82 0.85 2.00 3.09 0.00 -1.73 -1.41 103.07 113.69 2c91 h GLY 275 Ca -0.23 -0.23 -0.02 0.00 0.00 0.00 0.00 47.33 46.84 2c91 h GLY 275 CO 0.49 0.12 -0.11 -0.91 0.00 0.00 0.00 176.54 176.13 2c91 h THR 276 N 0.56 0.77 -0.01 4.70 1.35 -1.87 -1.10 112.91 117.30 2c91 h THR 276 Ca 0.35 -0.42 0.00 0.00 -0.55 0.00 0.00 66.41 65.79 2c91 h THR 276 Cb 0.60 1.25 0.00 0.00 -1.73 0.00 0.00 68.15 68.27 2c91 h THR 276 CO -0.12 0.11 -0.04 0.54 -0.25 0.00 0.00 175.52 175.75 2c91 n ARG 277 N -3.96 1.32 -0.85 4.72 1.74 -0.58 -4.92 116.66 114.13 2c91 n ARG 277 Ca -0.02 -0.63 0.00 0.00 -0.77 0.00 0.00 57.85 56.42 2c91 n ARG 277 Cb 0.20 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.15 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 1.17 0.54 3.73 -0.13 0.00 -0.42 -4.56 105.19 105.53 2c91 n GLY 278 Ca 0.19 -0.32 -0.35 0.00 0.00 0.00 0.00 46.02 45.54 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 -2.29 4.50 0.07 1.61 1.01 -0.91 -4.64 116.67 116.02 2c91 s ASP 279 Ca 0.00 2.37 -0.13 0.00 0.71 0.00 0.00 52.55 55.50 2c91 s ASP 279 Cb 0.00 -2.59 0.02 0.00 1.01 0.00 0.00 42.92 41.36 2c91 s ASP 279 CO 0.00 -2.06 0.30 0.00 0.21 0.00 0.00 175.17 173.62 2c91 s ALA 280 N -1.86 -0.64 -0.19 5.23 0.00 -0.22 -1.41 121.76 122.67 2c91 s ALA 280 Ca 0.75 -0.15 -0.06 0.00 0.00 0.00 0.00 51.96 52.51 2c91 s ALA 280 Cb -0.30 0.44 -0.03 0.00 0.00 0.00 0.00 23.12 23.23 2c91 s ALA 280 CO 0.42 -0.49 0.02 0.08 0.00 0.00 0.00 175.76 175.80 2c91 s VAL 281 N -3.13 4.32 -0.47 0.00 1.01 0.07 -1.14 120.40 121.07 2c91 s VAL 281 Ca -0.01 -0.19 -0.20 0.00 0.00 0.00 0.00 61.98 61.57 2c91 s VAL 281 Cb 0.01 -2.94 0.04 0.00 0.00 0.00 0.00 36.38 33.48 2c91 s VAL 281 CO -0.07 0.45 0.65 -0.63 0.00 0.00 0.00 175.10 175.50 2c91 s ILE 282 N 0.63 4.82 0.48 2.22 1.01 -0.11 -1.16 121.20 129.10 2c91 s ILE 282 Ca 0.01 -0.10 -0.22 0.00 0.00 0.00 0.00 60.65 60.35 2c91 s ILE 282 Cb -0.14 -4.25 -0.07 0.00 0.01 0.00 0.00 42.46 38.01 2c91 s ILE 282 CO 0.02 -0.69 1.11 -0.76 0.00 0.00 0.00 174.94 174.62 2c91 s LEU 283 N 2.81 3.92 0.21 2.97 1.43 0.43 -4.55 118.68 125.90 2c91 s LEU 283 Ca 0.20 2.15 0.10 0.00 -1.03 0.00 0.00 54.13 55.56 2c91 s LEU 283 Cb -0.16 -4.40 -0.05 0.00 0.03 0.00 0.00 46.19 41.62 2c91 s LEU 283 CO 0.16 -0.91 -0.21 -0.83 0.23 0.00 0.00 176.35 174.80 2c91 s GLY 284 N -1.64 1.64 -0.10 -3.19 0.00 -1.26 -0.98 107.32 101.79 2c91 s GLY 284 Ca 0.66 -1.66 -0.30 0.00 0.00 0.00 0.00 44.72 43.42 2c91 s GLY 284 CO 0.28 -1.72 0.93 -3.16 0.00 0.00 0.00 173.10 169.44 2c91 s MET 285 N -3.00 0.70 0.00 2.90 0.23 -1.26 -4.73 119.30 114.14 2c91 s MET 285 Ca 0.22 0.02 0.05 0.00 -1.03 0.00 0.00 55.69 54.95 2c91 s MET 285 Cb -0.06 0.33 0.11 0.00 -1.53 0.00 0.00 34.83 33.68 2c91 s MET 285 CO 0.10 -0.25 1.03 -1.13 -2.03 0.00 0.00 175.02 172.73 2c91 n SER 286 N 0.45 2.21 -3.63 -1.18 3.41 -1.26 -4.53 113.62 109.09 2c91 n SER 286 Ca -0.11 -1.85 -0.10 0.00 -0.26 0.00 0.00 58.87 56.55 2c91 n SER 286 Cb 0.59 -0.08 -0.04 0.00 -0.26 0.00 0.00 64.21 64.41 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 -0.89 -0.25 0.23 4.04 1.04 -1.26 -4.44 113.70 112.17 2c91 s SER 287 Ca 0.09 -0.31 -0.06 0.00 0.48 0.00 0.00 55.95 56.15 2c91 s SER 287 Cb 0.05 0.48 0.22 0.00 0.10 0.00 0.00 66.02 66.87 2c91 s SER 287 CO 0.07 -0.86 1.81 0.25 0.98 0.00 0.00 173.24 175.48 2c91 h LEU 288 N 2.35 1.05 -0.48 2.42 5.85 -1.96 -2.68 115.31 121.86 2c91 h LEU 288 Ca -0.34 -0.15 0.01 0.00 0.84 0.00 0.00 57.88 58.23 2c91 h LEU 288 Cb 1.26 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.99 2c91 h LEU 288 CO 0.47 0.92 0.31 -0.08 -0.34 0.00 0.00 178.44 179.72 2c91 h GLU 289 N 1.12 0.62 -0.40 1.25 4.81 -1.99 -0.66 114.58 119.33 2c91 h GLU 289 Ca 0.26 -0.04 0.01 0.00 -0.13 0.00 0.00 59.36 59.46 2c91 h GLU 289 Cb 0.19 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.41 2c91 h GLU 289 CO -0.02 0.41 0.25 1.96 -0.73 0.00 0.00 179.01 180.88 2c91 h GLN 290 N 0.64 0.49 -0.61 1.92 4.20 -1.96 -2.44 115.11 117.35 2c91 h GLN 290 Ca 0.18 -0.03 -0.00 0.00 0.06 0.00 0.00 58.65 58.85 2c91 h GLN 290 Cb -0.06 -0.11 -0.03 0.00 0.30 0.00 0.00 27.48 27.58 2c91 h GLN 290 CO -0.05 0.33 0.36 1.25 -0.67 0.00 0.00 178.83 180.05 2c91 h LEU 291 N 0.51 0.73 -0.63 1.46 5.85 -1.16 0.33 115.31 122.40 2c91 h LEU 291 Ca 0.15 -0.07 -0.03 0.00 0.84 0.00 0.00 57.88 58.78 2c91 h LEU 291 Cb -0.02 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 40.79 2c91 h LEU 291 CO -0.05 0.58 0.26 -0.33 -0.34 0.00 0.00 178.44 178.56 2c91 h GLU 292 N 0.82 0.93 -0.35 1.25 5.08 -1.04 0.29 114.58 121.55 2c91 h GLU 292 Ca 0.22 -0.16 0.03 0.00 -1.00 0.00 0.00 59.36 58.45 2c91 h GLU 292 Cb -0.01 -0.15 -0.03 0.00 0.50 0.00 0.00 28.75 29.05 2c91 h GLU 292 CO -0.04 0.77 0.17 0.37 -1.00 0.00 0.00 179.01 179.28 2c91 h GLN 293 N 0.87 0.33 -0.42 2.33 4.15 -1.20 -1.56 115.11 119.61 2c91 h GLN 293 Ca 0.21 -0.02 -0.04 0.00 0.77 0.00 0.00 58.65 59.57 2c91 h GLN 293 Cb 0.18 -0.08 -0.02 0.00 0.21 0.00 0.00 27.48 27.78 2c91 h GLN 293 CO -0.02 0.22 0.11 -0.91 -1.93 0.00 0.00 178.83 176.30 2c91 h ASN 294 N 0.34 0.64 -0.71 -0.69 2.35 -0.20 -2.18 115.58 115.13 2c91 h ASN 294 Ca 0.15 -0.23 0.01 0.00 -0.55 0.00 0.00 56.30 55.69 2c91 h ASN 294 Cb 0.08 -0.17 -0.04 0.00 0.05 0.00 0.00 38.32 38.24 2c91 h ASN 294 CO -0.12 0.70 0.47 -0.07 -1.65 0.00 0.00 177.43 176.76 2c91 h LEU 295 N 0.55 0.80 -0.57 1.61 3.38 -0.35 -1.86 115.31 118.86 2c91 h LEU 295 Ca 0.13 -0.02 -0.07 0.00 0.09 0.00 0.00 57.88 58.02 2c91 h LEU 295 Cb 0.30 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 2c91 h LEU 295 CO 0.00 0.57 0.09 0.00 0.09 0.00 0.00 178.44 179.18 2c91 h ALA 296 N 1.57 0.76 -0.45 1.53 0.00 -0.90 -2.91 119.26 118.85 2c91 h ALA 296 Ca 0.27 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 2c91 h ALA 296 Cb -0.06 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 2c91 h ALA 296 CO -0.06 0.52 0.17 0.00 0.00 0.00 0.00 179.25 179.87 2c91 h ALA 297 N 1.00 1.45 0.00 0.00 0.00 -0.85 -2.29 119.26 118.57 2c91 h ALA 297 Ca 0.17 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2c91 h ALA 297 Cb 0.43 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.03 2c91 h ALA 297 CO 0.01 0.42 0.00 1.79 0.00 0.00 0.00 179.25 181.47 2c91 h THR 298 N 0.64 0.00 -0.01 0.00 1.35 -1.15 -2.54 112.91 111.21 2c91 h THR 298 Ca 0.16 -0.35 0.00 0.00 -0.55 0.00 0.00 66.41 65.66 2c91 h THR 298 Cb 0.15 1.29 0.00 0.00 -1.73 0.00 0.00 68.15 67.86 2c91 h THR 298 CO -0.01 0.00 -0.79 -0.62 -0.25 0.00 0.00 175.52 173.85 2c91 n GLU 299 N -2.93 0.45 -1.01 4.72 1.02 -0.88 -4.94 120.64 117.06 2c91 n GLU 299 Ca 0.00 -0.37 -0.29 0.00 -0.02 0.00 0.00 57.16 56.48 2c91 n GLU 299 Cb 0.24 -1.49 0.18 0.00 -0.02 0.00 0.00 31.44 30.34 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 -2.80 0.44 0.00 3.49 2.02 -0.96 -5.08 118.70 115.82 2c91 s GLU 300 Ca 0.12 0.76 0.00 0.00 0.02 0.00 0.00 54.97 55.87 2c91 s GLU 300 Cb 0.17 -1.72 0.00 0.00 0.10 0.00 0.00 34.13 32.68 2c91 s GLU 300 CO 0.75 -2.78 0.00 0.41 0.02 0.00 0.00 175.26 173.66 2c91 n GLY 301 N -0.61 0.93 3.73 -1.39 0.00 -1.26 -5.02 105.19 101.57 2c91 n GLY 301 Ca 0.06 -1.96 -0.31 0.00 0.00 0.00 0.00 46.02 43.81 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 -1.30 1.79 0.45 1.61 0.02 -1.26 -4.92 135.00 131.39 2c91 s PRO 302 Ca 0.00 1.31 -0.03 0.00 0.02 0.00 0.00 61.00 62.30 2c91 s PRO 302 Cb 0.00 -1.83 -0.03 0.00 0.02 0.00 0.00 34.50 32.65 2c91 s PRO 302 CO 0.00 -2.01 0.72 -0.51 -0.33 0.00 0.00 177.00 174.87 2c91 s LEU 303 N -6.18 3.71 0.44 -5.54 1.43 -1.26 -5.07 118.68 106.21 2c91 s LEU 303 Ca 0.63 0.77 -0.25 0.00 -1.03 0.00 0.00 54.13 54.25 2c91 s LEU 303 Cb -0.19 -3.69 -0.08 0.00 0.03 0.00 0.00 46.19 42.26 2c91 s LEU 303 CO 0.57 -0.53 1.28 -1.61 0.23 0.00 0.00 176.35 176.29 2c91 s GLU 304 N -4.63 3.81 0.30 1.70 0.41 -1.26 -4.82 118.70 114.21 2c91 s GLU 304 Ca 0.46 2.10 0.06 0.00 -0.41 0.00 0.00 54.97 57.17 2c91 s GLU 304 Cb -0.10 -2.62 0.80 0.00 -1.78 0.00 0.00 34.13 30.42 2c91 s GLU 304 CO 0.42 -0.60 1.71 -1.00 -0.49 0.00 0.00 175.26 175.30 2c91 h PRO 305 N 2.39 0.45 -0.71 0.39 0.13 -1.99 -1.18 132.00 131.48 2c91 h PRO 305 Ca -0.50 -0.03 0.09 0.00 -0.87 0.00 0.00 66.00 64.70 2c91 h PRO 305 Cb 1.25 -0.10 -0.05 0.00 0.13 0.00 0.00 31.00 32.24 2c91 h PRO 305 CO 0.61 0.30 0.47 0.00 -0.23 0.00 0.00 178.00 179.15 2c91 h ALA 306 N 1.72 1.85 0.19 -0.56 0.00 -1.98 0.13 119.26 120.61 2c91 h ALA 306 Ca 0.60 -0.01 -0.31 0.00 0.00 0.00 0.00 54.91 55.18 2c91 h ALA 306 Cb 1.14 -0.14 0.02 0.00 0.00 0.00 0.00 17.79 18.81 2c91 h ALA 306 CO -0.51 0.00 -1.42 0.28 0.00 0.00 0.00 179.25 177.60 2c91 h VAL 307 N 0.61 1.32 -0.75 0.00 2.07 -1.55 -2.24 116.25 115.71 2c91 h VAL 307 Ca 0.33 -2.84 0.02 0.00 0.82 0.00 0.00 66.70 65.02 2c91 h VAL 307 Cb 0.46 2.96 -0.04 0.00 -1.52 0.00 0.00 31.29 33.14 2c91 h VAL 307 CO -0.11 0.85 0.49 0.58 0.02 0.00 0.00 177.57 179.39 2c91 h VAL 308 N 0.11 1.16 -0.66 2.57 2.07 -0.77 -1.28 116.25 119.45 2c91 h VAL 308 Ca -0.22 -0.34 -0.08 0.00 0.82 0.00 0.00 66.70 66.89 2c91 h VAL 308 Cb 2.08 0.09 -0.03 0.00 -1.52 0.00 0.00 31.29 31.91 2c91 h VAL 308 CO 0.23 0.18 0.10 -0.08 0.02 0.00 0.00 177.57 178.02 2c91 h GLU 309 N 0.98 1.10 -0.74 1.57 4.57 -0.80 -1.99 114.58 119.26 2c91 h GLU 309 Ca 0.29 -0.30 0.01 0.00 -1.18 0.00 0.00 59.36 58.17 2c91 h GLU 309 Cb -0.06 -0.13 -0.04 0.00 -0.16 0.00 0.00 28.75 28.37 2c91 h GLU 309 CO -0.08 1.01 0.49 0.00 -1.18 0.00 0.00 179.01 179.25 2c91 h ALA 310 N 1.04 1.46 -0.31 2.92 0.00 -1.04 -0.32 119.26 123.02 2c91 h ALA 310 Ca 0.20 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 2c91 h ALA 310 Cb 0.45 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 2c91 h ALA 310 CO 0.01 0.50 -0.03 0.74 0.00 0.00 0.00 179.25 180.47 2c91 h PHE 311 N 1.01 0.51 -0.20 0.00 0.04 -0.84 -1.42 116.94 116.03 2c91 h PHE 311 Ca 0.27 -0.05 -0.14 0.00 2.80 0.00 0.00 57.97 60.85 2c91 h PHE 311 Cb -0.11 -0.15 0.00 0.00 2.20 0.00 0.00 35.95 37.90 2c91 h PHE 311 CO 0.00 0.52 -0.42 -0.44 -0.60 0.00 0.00 178.31 177.37 2c91 h ASP 312 N 0.47 0.72 -1.00 2.17 3.32 -0.51 -2.47 116.42 119.11 2c91 h ASP 312 Ca 0.10 -0.55 0.08 0.00 0.02 0.00 0.00 57.03 56.68 2c91 h ASP 312 Cb 0.35 -0.21 -0.07 0.00 0.22 0.00 0.00 39.33 39.62 2c91 h ASP 312 CO 0.01 1.14 0.64 1.56 -1.72 0.00 0.00 179.24 180.88 2c91 h GLN 313 N 0.33 1.08 -0.18 3.56 4.20 -0.95 -0.45 115.11 122.70 2c91 h GLN 313 Ca 0.00 -0.07 -0.05 0.00 0.06 0.00 0.00 58.65 58.60 2c91 h GLN 313 Cb 1.02 -0.24 -0.00 0.00 0.30 0.00 0.00 27.48 28.55 2c91 h GLN 313 CO 0.09 0.72 -0.08 0.00 -0.67 0.00 0.00 178.83 178.89 2c91 h ALA 314 N 1.48 0.25 -0.49 3.87 0.00 -1.20 -2.14 119.26 121.04 2c91 h ALA 314 Ca 0.45 -0.28 0.06 0.00 0.00 0.00 0.00 54.91 55.14 2c91 h ALA 314 Cb 0.27 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 17.95 2c91 h ALA 314 CO -0.20 0.07 0.19 2.35 0.00 0.00 0.00 179.25 181.66 2c91 h TRP 315 N 0.06 0.35 -0.83 0.00 -0.00 -1.25 -2.36 115.95 111.91 2c91 h TRP 315 Ca 0.04 0.02 0.14 0.00 -0.00 0.00 0.00 58.89 59.10 2c91 h TRP 315 Cb 0.56 -0.08 -0.06 0.00 -0.00 0.00 0.00 29.16 29.58 2c91 h TRP 315 CO 0.06 0.13 0.54 -0.91 -0.00 0.00 0.00 178.44 178.27 2c91 h ASN 316 N 0.38 0.54 0.27 2.65 2.35 -0.73 0.20 115.58 121.24 2c91 h ASN 316 Ca 0.23 0.03 -0.09 0.00 -0.55 0.00 0.00 56.30 55.92 2c91 h ASN 316 Cb 0.22 -0.08 -0.01 0.00 0.05 0.00 0.00 38.32 38.50 2c91 h ASN 316 CO -0.22 0.28 -0.37 0.24 -1.65 0.00 0.00 177.43 175.72 2c91 h MET 317 N 0.58 0.14 0.00 0.81 2.86 -0.85 -3.30 114.93 115.18 2c91 h MET 317 Ca 0.41 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.99 2c91 h MET 317 Cb 0.76 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.42 2c91 h MET 317 CO -0.17 0.49 -0.87 1.33 1.06 0.00 0.00 176.91 178.76 2c91 n VAL 318 N -4.08 0.00 -0.31 -2.22 0.24 -0.55 -4.70 118.33 106.71 2c91 n VAL 318 Ca -0.01 -0.21 0.15 0.00 -2.04 0.00 0.00 64.34 62.23 2c91 n VAL 318 Cb 0.43 0.82 0.33 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 1.81 1.52 0.00 2.33 0.00 -0.74 1.00 119.26 125.18 2c91 h ALA 319 Ca 0.00 0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2c91 h ALA 319 Cb 0.40 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.34 2c91 h ALA 319 CO 0.00 -0.38 0.00 1.12 0.00 0.00 0.00 179.25 179.99 2c91 h HIS 320 N 0.38 0.00 0.00 0.00 2.07 -1.84 -2.89 115.15 112.88 2c91 h HIS 320 Ca 0.59 0.00 -0.01 0.00 -2.85 0.00 0.00 60.37 58.10 2c91 h HIS 320 Cb 1.16 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 31.13 2c91 h HIS 320 CO -0.12 0.00 -0.49 -0.85 -3.07 0.00 0.00 177.93 173.39 2c91 n GLU 321 N -2.85 1.51 -1.86 5.12 0.28 0.29 -5.06 120.64 118.07 2c91 n GLU 321 Ca 0.00 -3.21 -0.41 0.00 -0.16 0.00 0.00 57.16 53.38 2c91 n GLU 321 Cb 0.23 -1.55 -0.01 0.00 1.43 0.00 0.00 31.44 31.54 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 -1.09 3.20 0.13 0.00 0.04 -1.26 -4.99 135.00 131.03 2c91 s PRO 323 Ca 0.58 1.29 -0.30 0.00 0.04 0.00 0.00 61.00 62.60 2c91 s PRO 323 Cb -0.46 -2.01 -0.06 0.00 0.04 0.00 0.00 34.50 32.01 2c91 s PRO 323 CO 0.52 -0.92 1.03 -0.80 0.04 0.00 0.00 177.00 176.88 2c91 s ASN 324 N -2.64 7.38 0.27 6.66 0.01 -1.26 -4.88 114.94 120.48 2c91 s ASN 324 Ca 0.65 1.92 0.24 0.00 -0.71 0.00 0.00 52.86 54.97 2c91 s ASN 324 Cb -0.18 -2.59 0.97 0.00 0.41 0.00 0.00 41.25 39.86 2c91 s ASN 324 CO 0.37 -0.16 1.74 0.00 -1.51 0.00 0.00 177.10 177.54 2c91 n TYR 325 N 2.73 0.88 -4.28 2.20 4.11 -1.26 -4.79 117.16 116.76 2c91 n TYR 325 Ca 0.03 0.33 -0.26 0.00 -0.00 0.00 0.00 57.90 58.00 2c91 n TYR 325 Cb 0.48 -1.04 -0.09 0.00 -0.00 0.00 0.00 39.34 38.69 2c91 n TYR 325 CO 0.00 0.00 0.00 -0.59 -0.00 0.00 0.00 176.86 176.27 2c91 s PHE 326 N -3.30 2.67 0.00 -3.48 -0.12 -1.26 -4.29 117.98 108.20 2c91 s PHE 326 Ca 0.05 -0.21 0.00 0.00 -0.05 0.00 0.00 56.93 56.72 2c91 s PHE 326 Cb 0.10 -1.29 0.00 0.00 -0.63 0.00 0.00 43.02 41.19 2c91 s PHE 326 CO 0.43 0.52 0.22 0.54 -0.05 0.00 0.00 175.22 176.88