#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 3.23 0.63 1.96 1.70 -1.26 -3.39 118.95 121.82 2c91 s ARG 5 Ca 0.00 0.80 -0.18 0.00 -0.47 0.00 0.00 55.73 55.88 2c91 s ARG 5 Cb 0.00 -2.03 -0.04 0.00 -0.57 0.00 0.00 34.95 32.31 2c91 s ARG 5 CO 0.00 -0.85 0.99 -2.30 -1.08 0.00 0.00 175.30 172.06 2c91 n PRO 6 N -2.94 0.83 -0.95 3.89 -0.02 -1.26 -4.38 135.00 130.17 2c91 n PRO 6 Ca 0.07 0.33 -0.28 0.00 -2.02 0.00 0.00 63.50 61.59 2c91 n PRO 6 Cb 0.54 -2.21 0.21 0.00 -0.02 0.00 0.00 33.50 32.02 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 -1.55 0.35 -0.10 3.55 0.00 -0.50 -4.80 121.76 118.71 2c91 s ALA 7 Ca 0.77 -0.33 0.03 0.00 0.00 0.00 0.00 51.96 52.42 2c91 s ALA 7 Cb -0.40 -3.14 0.01 0.00 0.00 0.00 0.00 23.12 19.59 2c91 s ALA 7 CO 0.46 -3.28 -0.18 0.99 0.00 0.00 0.00 175.76 173.75 2c91 s THR 8 N -2.79 1.67 0.04 0.00 2.01 -1.26 -1.08 115.64 114.22 2c91 s THR 8 Ca 0.67 -0.77 0.08 0.00 0.31 0.00 0.00 61.69 61.97 2c91 s THR 8 Cb -0.21 -1.48 -0.03 0.00 0.01 0.00 0.00 72.50 70.79 2c91 s THR 8 CO 0.60 0.47 -0.20 -0.69 -0.69 0.00 0.00 174.62 174.11 2c91 s VAL 9 N 0.68 2.60 -0.28 3.82 1.01 0.10 -4.46 120.40 123.88 2c91 s VAL 9 Ca -0.13 -1.22 -0.15 0.00 0.00 0.00 0.00 61.98 60.49 2c91 s VAL 9 Cb -0.16 -2.06 -0.04 0.00 0.00 0.00 0.00 36.38 34.12 2c91 s VAL 9 CO 0.03 0.37 0.36 -0.22 0.00 0.00 0.00 175.10 175.64 2c91 s LEU 10 N -1.32 4.07 0.19 3.92 2.96 -0.44 -0.88 118.68 127.18 2c91 s LEU 10 Ca 0.13 0.23 -0.30 0.00 -0.22 0.00 0.00 54.13 53.97 2c91 s LEU 10 Cb -0.10 -2.40 -0.08 0.00 0.50 0.00 0.00 46.19 44.11 2c91 s LEU 10 CO 0.04 -0.19 1.08 -0.83 -1.32 0.00 0.00 176.35 175.12 2c91 s GLY 11 N 1.66 2.91 -0.06 7.98 0.00 0.28 -0.59 107.32 119.50 2c91 s GLY 11 Ca 0.14 0.79 0.09 0.00 0.00 0.00 0.00 44.72 45.74 2c91 s GLY 11 CO 0.10 1.58 1.05 -1.30 0.00 0.00 0.00 173.10 174.53 2c91 n THR 12 N 2.17 1.32 -0.04 0.90 -2.24 -0.74 -4.71 114.28 110.94 2c91 n THR 12 Ca 0.02 -1.49 0.10 0.00 -2.27 0.00 0.00 64.05 60.41 2c91 n THR 12 Cb 0.46 0.18 0.50 0.00 -2.10 0.00 0.00 70.33 69.38 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 0.39 -0.02 -0.78 -1.53 -1.91 -2.42 114.93 108.66 2c91 h MET 13 Ca 0.00 -0.02 0.00 0.00 -3.44 0.00 0.00 59.70 56.24 2c91 h MET 13 Cb 0.79 -0.09 0.00 0.00 -0.55 0.00 0.00 31.60 31.75 2c91 h MET 13 CO 0.00 0.26 -0.08 0.39 0.14 0.00 0.00 176.91 177.62 2c91 n GLU 14 N -4.47 1.72 -2.12 0.39 -0.58 -1.26 -4.67 120.64 109.65 2c91 n GLU 14 Ca 0.08 -1.21 -0.43 0.00 -0.42 0.00 0.00 57.16 55.18 2c91 n GLU 14 Cb 0.30 -1.47 -0.02 0.00 -0.57 0.00 0.00 31.44 29.67 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 3.44 0.00 3.49 -1.94 -0.91 -1.56 119.30 119.71 2c91 s MET 15 Ca 0.31 1.28 0.00 0.00 -1.71 0.00 0.00 55.69 55.57 2c91 s MET 15 Cb 0.20 -4.13 0.00 0.00 2.01 0.00 0.00 34.83 32.91 2c91 s MET 15 CO 0.37 -1.73 0.00 0.41 -0.01 0.00 0.00 175.02 174.06 2c91 n GLY 16 N 5.28 0.41 0.00 -0.03 0.00 0.14 -2.63 105.19 108.36 2c91 n GLY 16 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.23 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 -1.48 0.00 -0.09 1.61 0.63 -0.74 -4.87 116.66 111.71 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 0.24 0.00 0.45 0.00 0.00 32.46 33.15 2c91 n ARG 17 CO 0.00 0.00 0.00 2.89 -2.51 0.00 0.00 177.63 178.01 2c91 n ARG 18 N -0.67 2.24 -4.56 -0.14 1.85 -1.10 -4.75 116.66 109.53 2c91 n ARG 18 Ca 0.00 -1.84 -0.31 0.00 -1.00 0.00 0.00 57.85 54.69 2c91 n ARG 18 Cb 0.00 -1.47 -0.17 0.00 -1.05 0.00 0.00 32.46 29.77 2c91 n ARG 18 CO 0.00 0.00 0.00 -1.64 -0.01 0.00 0.00 177.63 175.98 2c91 s MET 19 N -1.76 2.72 0.90 2.89 -1.94 -0.60 -4.80 119.30 116.71 2c91 s MET 19 Ca 0.34 -0.74 -0.11 0.00 -1.71 0.00 0.00 55.69 53.47 2c91 s MET 19 Cb 0.21 -2.24 0.19 0.00 2.01 0.00 0.00 34.83 35.00 2c91 s MET 19 CO 0.30 -0.04 1.23 0.16 -0.01 0.00 0.00 175.02 176.66 2c91 s ASP 20 N 0.91 3.36 0.43 3.03 -4.77 -1.26 0.23 116.67 118.60 2c91 s ASP 20 Ca -0.06 -0.07 0.10 0.00 -3.30 0.00 0.00 52.55 49.22 2c91 s ASP 20 Cb -0.15 -0.01 0.95 0.00 -1.09 0.00 0.00 42.92 42.62 2c91 s ASP 20 CO -0.02 -2.55 2.04 0.00 0.70 0.00 0.00 175.17 175.34 2c91 h ALA 21 N -1.33 1.73 0.06 2.11 0.00 -1.98 -1.15 119.26 118.71 2c91 h ALA 21 Ca -0.41 -0.07 -0.23 0.00 0.00 0.00 0.00 54.91 54.20 2c91 h ALA 21 Cb 1.23 -0.10 0.02 0.00 0.00 0.00 0.00 17.79 18.95 2c91 h ALA 21 CO 0.34 0.22 -0.95 1.03 0.00 0.00 0.00 179.25 179.89 2c91 h SER 22 N 0.31 0.72 -0.44 0.00 0.87 -1.99 -0.94 113.55 112.08 2c91 h SER 22 Ca 0.08 -0.81 -0.04 0.00 -1.23 0.00 0.00 61.79 59.79 2c91 h SER 22 Cb 0.08 -0.23 -0.02 0.00 -0.44 0.00 0.00 62.40 61.79 2c91 h SER 22 CO -0.01 1.45 0.15 0.00 -0.53 0.00 0.00 176.83 177.89 2c91 h ALA 23 N 0.29 1.33 -0.17 6.23 0.00 -1.88 -2.01 119.26 123.05 2c91 h ALA 23 Ca -0.14 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.58 2c91 h ALA 23 Cb 1.65 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 19.23 2c91 h ALA 23 CO 0.18 0.49 -0.01 0.77 0.00 0.00 0.00 179.25 180.68 2c91 h SER 24 N 0.73 0.29 -0.45 0.00 0.02 -1.14 -1.46 113.55 111.53 2c91 h SER 24 Ca 0.17 -0.32 -0.03 0.00 -0.84 0.00 0.00 61.79 60.77 2c91 h SER 24 Cb 0.22 -0.08 -0.02 0.00 0.14 0.00 0.00 62.40 62.66 2c91 h SER 24 CO -0.01 0.54 0.18 0.00 -1.14 0.00 0.00 176.83 176.40 2c91 h ALA 25 N 0.76 1.36 -0.49 3.77 0.00 -1.03 -1.53 119.26 122.11 2c91 h ALA 25 Ca 0.05 -0.15 -0.09 0.00 0.00 0.00 0.00 54.91 54.71 2c91 h ALA 25 Cb 0.39 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 2c91 h ALA 25 CO 0.01 0.47 -0.06 0.00 0.00 0.00 0.00 179.25 179.67 2c91 h ALA 26 N 1.47 0.97 -0.24 0.00 0.00 -1.24 -1.94 119.26 118.28 2c91 h ALA 26 Ca 0.17 -0.31 -0.14 0.00 0.00 0.00 0.00 54.91 54.64 2c91 h ALA 26 Cb 0.19 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 2c91 h ALA 26 CO -0.01 0.62 -0.38 0.77 0.00 0.00 0.00 179.25 180.24 2c91 h SER 27 N 0.79 0.75 -0.32 0.00 0.02 -0.76 -1.41 113.55 112.63 2c91 h SER 27 Ca 0.14 -0.52 -0.01 0.00 -0.84 0.00 0.00 61.79 60.56 2c91 h SER 27 Cb 0.56 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.87 2c91 h SER 27 CO 0.03 1.13 0.17 0.58 -1.14 0.00 0.00 176.83 177.60 2c91 h VAL 28 N 0.39 1.14 -0.53 2.27 2.07 -1.24 -0.96 116.25 119.40 2c91 h VAL 28 Ca 0.02 -0.37 0.06 0.00 0.82 0.00 0.00 66.70 67.23 2c91 h VAL 28 Cb 0.97 0.81 -0.05 0.00 -1.52 0.00 0.00 31.29 31.49 2c91 h VAL 28 CO 0.09 0.14 0.22 -0.09 0.02 0.00 0.00 177.57 177.95 2c91 h ARG 29 N 0.39 0.41 -0.74 1.57 2.43 -1.27 0.53 114.38 117.70 2c91 h ARG 29 Ca 0.11 -0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 59.21 2c91 h ARG 29 Cb 0.07 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 29.50 2c91 h ARG 29 CO -0.02 0.27 0.30 0.00 -1.51 0.00 0.00 179.97 179.01 2c91 h ALA 30 N 1.33 0.96 -0.23 2.80 0.00 -1.12 -0.31 119.26 122.69 2c91 h ALA 30 Ca 0.25 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 2c91 h ALA 30 Cb 0.23 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 2c91 h ALA 30 CO -0.22 0.59 0.04 0.35 0.00 0.00 0.00 179.25 180.00 2c91 h PHE 31 N 1.07 0.40 -0.12 0.00 3.57 -0.44 -2.96 116.94 118.45 2c91 h PHE 31 Ca 0.25 -0.06 -0.12 0.00 3.53 0.00 0.00 57.97 61.57 2c91 h PHE 31 Cb 0.21 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 38.83 2c91 h PHE 31 CO 0.02 0.51 -0.46 -0.07 -2.23 0.00 0.00 178.31 176.08 2c91 h LEU 32 N 0.18 0.31 -2.00 0.59 3.38 -0.81 -2.45 115.31 114.52 2c91 h LEU 32 Ca 0.07 -0.14 0.03 0.00 0.09 0.00 0.00 57.88 57.92 2c91 h LEU 32 Cb 0.32 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 40.98 2c91 h LEU 32 CO 0.00 0.73 0.07 -0.33 0.09 0.00 0.00 178.44 179.01 2c91 h GLU 33 N 0.24 0.01 0.00 1.13 5.08 -0.97 0.60 114.58 120.67 2c91 h GLU 33 Ca 0.02 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 2c91 h GLU 33 Cb 0.90 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.15 2c91 h GLU 33 CO 0.07 0.00 0.00 0.54 -1.00 0.00 0.00 179.01 178.63 2c91 n ARG 34 N -4.51 0.93 -0.37 2.33 5.12 -0.92 -4.87 116.66 114.37 2c91 n ARG 34 Ca -0.01 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.91 2c91 n ARG 34 Cb 0.18 -1.47 0.00 0.00 -1.16 0.00 0.00 32.46 30.01 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 0.84 0.76 3.91 -0.13 0.00 0.20 -5.07 105.19 105.70 2c91 n GLY 35 Ca 0.21 0.00 -0.29 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 -2.33 2.48 0.00 1.61 3.76 -1.22 -5.03 115.29 114.56 2c91 s HIS 36 Ca 0.00 0.59 0.00 0.00 -0.15 0.00 0.00 55.06 55.50 2c91 s HIS 36 Cb 0.00 -3.70 0.00 0.00 1.11 0.00 0.00 32.58 29.99 2c91 s HIS 36 CO 0.00 -2.06 0.00 -1.13 -0.85 0.00 0.00 174.74 170.70 2c91 n SER 37 N -3.45 0.00 -4.78 1.40 3.41 -1.26 -4.49 113.62 104.45 2c91 n SER 37 Ca 0.10 -0.09 -0.36 0.00 -0.26 0.00 0.00 58.87 58.27 2c91 n SER 37 Cb 0.60 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 64.48 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 3.44 -0.00 4.33 2.02 -1.26 -0.60 118.70 126.63 2c91 s GLU 38 Ca 0.00 -0.25 0.08 0.00 0.02 0.00 0.00 54.97 54.82 2c91 s GLU 38 Cb 0.00 -3.09 -0.02 0.00 0.10 0.00 0.00 34.13 31.11 2c91 s GLU 38 CO 0.00 0.65 -0.26 -0.51 0.02 0.00 0.00 175.26 175.16 2c91 s LEU 39 N -0.68 2.10 -0.20 1.80 1.43 -0.24 -1.33 118.68 121.56 2c91 s LEU 39 Ca 0.12 -0.50 0.01 0.00 -1.03 0.00 0.00 54.13 52.74 2c91 s LEU 39 Cb -0.12 -1.33 0.04 0.00 0.03 0.00 0.00 46.19 44.81 2c91 s LEU 39 CO 0.02 0.30 -0.15 -0.62 0.23 0.00 0.00 176.35 176.13 2c91 s ASP 40 N -0.80 3.52 0.06 2.29 2.15 0.24 -1.26 116.67 122.87 2c91 s ASP 40 Ca 0.11 -0.89 0.01 0.00 0.43 0.00 0.00 52.55 52.20 2c91 s ASP 40 Cb -0.10 -1.44 -0.00 0.00 -0.30 0.00 0.00 42.92 41.08 2c91 s ASP 40 CO -0.00 -0.08 0.02 1.07 -0.17 0.00 0.00 175.17 176.01 2c91 n THR 41 N 4.59 0.00 -3.64 1.71 5.66 -0.27 -1.78 114.28 120.54 2c91 n THR 41 Ca -0.18 -0.33 -0.15 0.00 -3.05 0.00 0.00 64.05 60.34 2c91 n THR 41 Cb 0.47 0.12 -0.08 0.00 -1.55 0.00 0.00 70.33 69.30 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 -2.16 -1.36 0.34 1.79 0.00 -1.26 -3.76 121.76 115.35 2c91 s ALA 42 Ca 0.03 1.14 0.12 0.00 0.00 0.00 0.00 51.96 53.25 2c91 s ALA 42 Cb 0.00 -0.30 0.97 0.00 0.00 0.00 0.00 23.12 23.79 2c91 s ALA 42 CO 0.02 -0.30 1.72 0.35 0.00 0.00 0.00 175.76 177.54 2c91 h PHE 43 N 4.04 0.95 -0.36 0.00 3.57 -1.85 -2.37 116.94 120.91 2c91 h PHE 43 Ca -0.28 0.03 -0.07 0.00 3.53 0.00 0.00 57.97 61.18 2c91 h PHE 43 Cb 1.16 -0.27 -0.02 0.00 2.79 0.00 0.00 35.95 39.62 2c91 h PHE 43 CO 0.43 0.00 -0.07 1.98 -2.23 0.00 0.00 178.31 178.42 2c91 h MET 44 N 0.49 0.60 -6.23 1.11 4.05 -1.96 -3.30 114.93 109.69 2c91 h MET 44 Ca 0.67 -0.16 -0.55 0.00 -0.28 0.00 0.00 59.70 59.37 2c91 h MET 44 Cb 1.39 -0.07 -0.02 0.00 -0.80 0.00 0.00 31.60 32.11 2c91 h MET 44 CO -0.49 0.67 1.04 0.71 0.23 0.00 0.00 176.91 179.07 2c91 s TYR 45 N -4.85 2.21 -1.32 1.39 2.02 -0.89 -2.91 117.35 113.01 2c91 s TYR 45 Ca -0.08 0.41 -0.07 0.00 -0.37 0.00 0.00 57.07 56.96 2c91 s TYR 45 Cb 0.15 -3.81 0.01 0.00 -0.40 0.00 0.00 41.96 37.91 2c91 s TYR 45 CO 0.79 -3.28 0.93 0.00 -1.57 0.00 0.00 175.55 172.42 2c91 n ASP 47 N -2.52 -5.50 0.00 0.00 2.03 -1.15 -1.27 116.55 108.14 2c91 n ASP 47 Ca -0.03 0.10 0.00 0.00 0.52 0.00 0.00 54.79 55.39 2c91 n ASP 47 Cb 0.57 -4.64 0.00 0.00 -0.72 0.00 0.00 41.12 36.33 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 -0.87 0.26 0.16 0.27 0.00 -0.77 -4.99 105.19 99.25 2c91 n GLY 48 Ca -0.22 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.75 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 4.13 0.18 -0.16 1.61 1.08 -1.05 -1.77 115.11 119.13 2c91 h GLN 49 Ca 0.00 -0.13 0.02 0.00 -1.45 0.00 0.00 58.65 57.09 2c91 h GLN 49 Cb 0.00 0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 27.43 2c91 h GLN 49 CO 0.00 0.75 0.02 1.03 -0.95 0.00 0.00 178.83 179.69 2c91 h SER 50 N 0.13 -0.01 -0.59 1.46 0.87 -1.47 0.38 113.55 114.32 2c91 h SER 50 Ca -0.01 0.03 -0.06 0.00 -1.23 0.00 0.00 61.79 60.52 2c91 h SER 50 Cb 1.15 0.04 -0.02 0.00 -0.44 0.00 0.00 62.40 63.13 2c91 h SER 50 CO 0.09 0.02 0.14 -0.33 -0.53 0.00 0.00 176.83 176.23 2c91 h GLU 51 N 0.08 0.94 -0.46 2.24 5.08 -1.75 -1.89 114.58 118.83 2c91 h GLU 51 Ca 0.07 -0.23 -0.01 0.00 -1.00 0.00 0.00 59.36 58.19 2c91 h GLU 51 Cb 0.07 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.17 2c91 h GLU 51 CO -0.10 0.87 0.25 -0.91 -1.00 0.00 0.00 179.01 178.12 2c91 h ASN 52 N 0.85 0.57 -0.42 1.42 -0.26 -1.00 0.17 115.58 116.92 2c91 h ASN 52 Ca 0.18 -0.10 0.02 0.00 -0.56 0.00 0.00 56.30 55.85 2c91 h ASN 52 Cb 0.35 -0.15 -0.03 0.00 -1.06 0.00 0.00 38.32 37.44 2c91 h ASN 52 CO 0.00 0.50 0.25 0.40 -1.06 0.00 0.00 177.43 177.53 2c91 h ILE 53 N 0.60 1.05 -0.57 2.81 2.04 -0.84 -2.51 117.51 120.09 2c91 h ILE 53 Ca 0.16 -0.17 -0.08 0.00 1.00 0.00 0.00 64.86 65.76 2c91 h ILE 53 Cb 0.06 0.50 -0.02 0.00 -0.74 0.00 0.00 36.82 36.62 2c91 h ILE 53 CO -0.02 0.09 0.03 -0.07 0.00 0.00 0.00 178.15 178.18 2c91 h LEU 54 N 0.51 0.95 -2.22 1.44 3.38 -1.01 -2.92 115.31 115.44 2c91 h LEU 54 Ca 0.17 -0.29 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 2c91 h LEU 54 Cb 0.00 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.50 2c91 h LEU 54 CO -0.07 1.01 -0.06 1.23 0.09 0.00 0.00 178.44 180.64 2c91 h GLY 55 N 0.87 0.00 -0.80 0.83 0.00 -0.53 -2.30 103.07 101.14 2c91 h GLY 55 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.49 2c91 h GLY 55 CO 0.02 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.17 2c91 n GLY 56 N -1.00 0.27 0.06 4.60 0.00 -0.96 -4.33 105.19 103.83 2c91 n GLY 56 Ca -0.02 -0.47 0.15 0.00 0.00 0.00 0.00 46.02 45.68 2c91 n GLY 56 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2c91 n LEU 57 N 0.38 0.21 -1.68 0.99 4.77 -0.87 -4.91 117.00 115.90 2c91 n LEU 57 Ca 0.18 0.06 -0.12 0.00 -0.03 0.00 0.00 56.01 56.09 2c91 n LEU 57 Cb 0.38 -0.13 0.01 0.00 -2.33 0.00 0.00 43.42 41.35 2c91 n LEU 57 CO 0.15 0.04 -0.03 0.61 -1.33 0.00 0.00 177.39 176.82 2c91 n GLY 58 N 1.16 -0.02 0.19 -0.72 0.00 -1.26 -4.92 105.19 99.63 2c91 n GLY 58 Ca 0.18 -0.30 0.13 0.00 0.00 0.00 0.00 46.02 46.03 2c91 n GLY 58 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2c91 n LEU 59 N -2.19 0.89 -3.54 0.99 4.77 -1.26 -4.95 117.00 111.70 2c91 n LEU 59 Ca -0.08 -0.19 -0.21 0.00 -0.03 0.00 0.00 56.01 55.49 2c91 n LEU 59 Cb 0.58 -0.15 0.08 0.00 -2.33 0.00 0.00 43.42 41.60 2c91 n LEU 59 CO 0.24 0.17 0.18 0.61 -1.33 0.00 0.00 177.39 177.26 2c91 n GLY 60 N 1.36 -0.46 3.77 -0.72 0.00 -1.26 -4.88 105.19 103.00 2c91 n GLY 60 Ca 0.11 0.19 -0.40 0.00 0.00 0.00 0.00 46.02 45.92 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 -6.90 4.22 0.00 0.99 1.43 -1.26 -2.62 118.68 114.54 2c91 s LEU 61 Ca 0.33 2.94 0.00 0.00 -1.03 0.00 0.00 54.13 56.37 2c91 s LEU 61 Cb -0.15 -3.81 0.00 0.00 0.03 0.00 0.00 46.19 42.26 2c91 s LEU 61 CO 0.74 -1.00 0.00 0.61 0.23 0.00 0.00 176.35 176.93 2c91 n GLY 62 N 0.55 0.56 2.84 -3.19 0.00 -1.25 -4.35 105.19 100.34 2c91 n GLY 62 Ca 0.03 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.65 2c91 n GLY 62 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2c91 n SER 63 N -0.12 6.16 -1.53 1.61 3.41 -1.08 -4.45 113.62 117.62 2c91 n SER 63 Ca 0.00 -3.49 -0.20 0.00 -0.26 0.00 0.00 58.87 54.92 2c91 n SER 63 Cb 0.06 -1.13 -0.03 0.00 -0.26 0.00 0.00 64.21 62.85 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 0.90 -0.13 0.00 5.00 0.00 -1.26 -3.40 105.19 106.30 2c91 n GLY 64 Ca 0.31 0.25 0.00 0.00 0.00 0.00 0.00 46.02 46.58 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 0.52 0.00 -3.68 1.61 2.03 -1.26 -5.12 116.55 110.65 2c91 n ASP 65 Ca 0.07 0.00 -0.11 0.00 0.52 0.00 0.00 54.79 55.27 2c91 n ASP 65 Cb 0.03 0.00 -0.11 0.00 -0.72 0.00 0.00 41.12 40.32 2c91 n ASP 65 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2c91 h THR 67 N 5.96 0.99 -3.39 0.00 1.03 -1.92 -3.46 112.91 112.11 2c91 h THR 67 Ca -0.26 -2.57 -0.54 0.00 -0.01 0.00 0.00 66.41 63.03 2c91 h THR 67 Cb 1.14 2.78 -0.03 0.00 -1.07 0.00 0.00 68.15 70.97 2c91 h THR 67 CO 0.22 0.85 0.33 -0.69 -0.01 0.00 0.00 175.52 176.21 2c91 s VAL 68 N -2.59 4.90 -0.08 0.00 1.01 -1.26 -4.87 120.40 117.51 2c91 s VAL 68 Ca -0.14 1.95 -0.02 0.00 0.00 0.00 0.00 61.98 63.76 2c91 s VAL 68 Cb 0.06 -4.27 -0.03 0.00 0.00 0.00 0.00 36.38 32.13 2c91 s VAL 68 CO 0.86 0.17 0.01 -0.54 0.00 0.00 0.00 175.10 175.60 2c91 s LYS 69 N 1.03 3.00 -0.05 2.72 -0.14 0.23 -4.66 119.74 121.87 2c91 s LYS 69 Ca 0.49 -0.40 0.06 0.00 -1.36 0.00 0.00 55.97 54.76 2c91 s LYS 69 Cb -0.20 -2.81 -0.01 0.00 -1.68 0.00 0.00 37.83 33.12 2c91 s LYS 69 CO 0.26 0.70 -0.25 -1.50 -0.76 0.00 0.00 175.35 173.80 2c91 s ILE 70 N -0.91 2.01 -0.06 2.17 1.10 -1.26 -1.08 121.20 123.17 2c91 s ILE 70 Ca 0.14 -1.05 0.05 0.00 -0.51 0.00 0.00 60.65 59.28 2c91 s ILE 70 Cb -0.11 -1.69 -0.01 0.00 0.15 0.00 0.00 42.46 40.79 2c91 s ILE 70 CO 0.03 0.56 -0.22 0.00 -2.11 0.00 0.00 174.94 173.20 2c91 s ALA 71 N -0.25 2.29 0.44 1.50 0.00 -0.39 -1.48 121.76 123.87 2c91 s ALA 71 Ca -0.01 -1.03 0.03 0.00 0.00 0.00 0.00 51.96 50.95 2c91 s ALA 71 Cb -0.13 -0.76 -0.01 0.00 0.00 0.00 0.00 23.12 22.23 2c91 s ALA 71 CO 0.03 0.44 0.11 -2.37 0.00 0.00 0.00 175.76 173.97 2c91 n THR 72 N 2.82 0.00 -3.83 0.00 5.66 -0.57 -1.11 114.28 117.25 2c91 n THR 72 Ca -0.17 -2.41 -0.12 0.00 -3.05 0.00 0.00 64.05 58.29 2c91 n THR 72 Cb 0.52 0.78 -0.11 0.00 -1.55 0.00 0.00 70.33 69.96 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 -3.64 0.31 -0.07 1.09 1.02 -1.25 -0.98 119.74 116.23 2c91 s LYS 73 Ca 0.16 0.05 -0.02 0.00 0.02 0.00 0.00 55.97 56.18 2c91 s LYS 73 Cb 0.01 0.14 -0.04 0.00 -0.52 0.00 0.00 37.83 37.42 2c91 s LYS 73 CO 0.11 -0.06 0.04 0.00 -0.92 0.00 0.00 175.35 174.52 2c91 s ALA 74 N -0.38 3.43 0.13 5.17 0.00 -0.50 -2.47 121.76 127.14 2c91 s ALA 74 Ca -0.05 -0.80 0.05 0.00 0.00 0.00 0.00 51.96 51.16 2c91 s ALA 74 Cb -0.03 -1.56 -0.04 0.00 0.00 0.00 0.00 23.12 21.48 2c91 s ALA 74 CO 0.01 0.62 -0.11 0.54 0.00 0.00 0.00 175.76 176.81 2c91 s ASN 75 N -1.10 1.77 0.00 0.00 2.20 -1.26 -0.92 114.94 115.62 2c91 s ASN 75 Ca 0.16 -0.91 0.22 0.00 -0.94 0.00 0.00 52.86 51.39 2c91 s ASN 75 Cb -0.12 -0.02 0.75 0.00 -2.00 0.00 0.00 41.25 39.86 2c91 s ASN 75 CO 0.05 -0.27 1.56 -0.81 -2.94 0.00 0.00 177.10 174.69 2c91 n PRO 76 N 0.16 1.82 -1.41 3.55 -0.04 -1.26 -4.48 135.00 133.35 2c91 n PRO 76 Ca -0.13 -1.23 -0.30 0.00 -0.04 0.00 0.00 63.50 61.80 2c91 n PRO 76 Cb 0.59 -1.42 0.11 0.00 -0.04 0.00 0.00 33.50 32.73 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 -1.81 2.64 -1.47 0.54 0.51 -1.26 -1.56 118.94 116.53 2c91 s TRP 77 Ca 0.34 1.23 -0.07 0.00 -2.12 0.00 0.00 56.10 55.47 2c91 s TRP 77 Cb 0.19 -3.12 0.03 0.00 -0.81 0.00 0.00 33.47 29.75 2c91 s TRP 77 CO 0.28 -1.97 0.78 0.39 -0.51 0.00 0.00 176.95 175.92 2c91 n GLU 78 N -3.59 -5.55 -0.60 4.98 1.02 -1.26 -1.45 120.64 114.20 2c91 n GLU 78 Ca 0.07 0.80 0.00 0.00 -0.02 0.00 0.00 57.16 58.01 2c91 n GLU 78 Cb 0.56 -5.69 0.00 0.00 -0.02 0.00 0.00 31.44 26.28 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 -1.62 1.22 0.26 0.62 0.00 -1.25 -4.94 105.19 99.47 2c91 n GLY 79 Ca -0.05 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.83 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 3.22 0.90 -1.75 1.61 1.57 -1.12 -3.50 116.57 117.51 2c91 h LYS 80 Ca 0.00 -0.50 0.19 0.00 -1.87 0.00 0.00 60.65 58.47 2c91 h LYS 80 Cb 0.00 0.03 -0.08 0.00 0.08 0.00 0.00 32.23 32.26 2c91 h LYS 80 CO 0.00 1.15 -0.48 -1.13 -0.57 0.00 0.00 179.45 178.42 2c91 n SER 81 N -4.07 -4.47 -1.59 0.86 3.41 -0.60 -4.58 113.62 102.58 2c91 n SER 81 Ca -0.03 0.55 -0.11 0.00 -0.26 0.00 0.00 58.87 59.02 2c91 n SER 81 Cb 0.56 -2.43 0.21 0.00 -0.26 0.00 0.00 64.21 62.29 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 -3.43 5.20 -4.72 1.04 4.77 -1.26 -4.27 117.00 114.34 2c91 n LEU 82 Ca -0.02 -3.63 -0.33 0.00 -0.03 0.00 0.00 56.01 51.99 2c91 n LEU 82 Cb 0.35 -0.71 0.10 0.00 -2.33 0.00 0.00 43.42 40.83 2c91 n LEU 82 CO 0.02 1.12 0.77 -0.54 -1.33 0.00 0.00 177.39 177.42 2c91 s LYS 83 N -3.22 1.97 0.23 3.23 -0.14 -1.26 -4.39 119.74 116.15 2c91 s LYS 83 Ca 0.50 1.66 -0.10 0.00 -1.36 0.00 0.00 55.97 56.68 2c91 s LYS 83 Cb 0.43 -1.82 0.35 0.00 -1.68 0.00 0.00 37.83 35.10 2c91 s LYS 83 CO 0.05 -1.95 1.65 -1.35 -0.76 0.00 0.00 175.35 172.99 2c91 h PRO 84 N -0.63 0.09 -0.21 -1.68 0.11 -1.92 -1.05 132.00 126.71 2c91 h PRO 84 Ca -0.46 -0.01 -0.07 0.00 0.11 0.00 0.00 66.00 65.57 2c91 h PRO 84 Cb 1.28 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.36 2c91 h PRO 84 CO 0.48 0.06 -0.16 -0.44 -0.21 0.00 0.00 178.00 177.74 2c91 h ASP 85 N 0.10 0.34 -0.16 -2.05 3.32 -1.98 -1.62 116.42 114.37 2c91 h ASP 85 Ca 0.36 -0.09 -0.04 0.00 0.02 0.00 0.00 57.03 57.28 2c91 h ASP 85 Cb 0.60 -0.09 -0.00 0.00 0.22 0.00 0.00 39.33 40.05 2c91 h ASP 85 CO -0.60 0.53 -0.08 -1.28 -1.72 0.00 0.00 179.24 176.09 2c91 h SER 86 N 0.33 0.34 -0.31 6.45 0.87 -1.53 -1.66 113.55 118.04 2c91 h SER 86 Ca 0.06 -0.41 0.04 0.00 -1.23 0.00 0.00 61.79 60.25 2c91 h SER 86 Cb 0.48 -0.09 -0.04 0.00 -0.44 0.00 0.00 62.40 62.31 2c91 h SER 86 CO 0.03 0.68 0.07 0.40 -0.53 0.00 0.00 176.83 177.48 2c91 h ILE 87 N 0.00 0.86 0.06 2.23 1.08 -1.19 -1.16 117.51 119.39 2c91 h ILE 87 Ca 0.04 -0.06 0.00 0.00 -0.39 0.00 0.00 64.86 64.44 2c91 h ILE 87 Cb 0.55 0.66 -0.00 0.00 -3.07 0.00 0.00 36.82 34.95 2c91 h ILE 87 CO 0.02 0.03 -0.05 -0.09 -0.69 0.00 0.00 178.15 177.38 2c91 h ARG 88 N 0.18 -0.11 -0.39 2.37 2.43 -1.27 -1.45 114.38 116.14 2c91 h ARG 88 Ca 0.15 0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.33 2c91 h ARG 88 Cb 0.15 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.71 2c91 h ARG 88 CO -0.19 -0.07 0.25 1.03 -1.51 0.00 0.00 179.97 179.48 2c91 h SER 89 N -0.12 0.43 -0.39 -3.80 0.87 -1.12 0.48 113.55 109.90 2c91 h SER 89 Ca -0.00 -0.01 -0.02 0.00 -1.23 0.00 0.00 61.79 60.53 2c91 h SER 89 Cb 0.11 -0.10 -0.02 0.00 -0.44 0.00 0.00 62.40 61.94 2c91 h SER 89 CO -0.01 0.31 0.18 1.56 -0.53 0.00 0.00 176.83 178.35 2c91 h GLN 90 N 0.51 0.56 -0.26 2.24 4.20 -1.13 -0.30 115.11 120.93 2c91 h GLN 90 Ca 0.14 -0.09 -0.02 0.00 0.06 0.00 0.00 58.65 58.74 2c91 h GLN 90 Cb -0.05 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 27.62 2c91 h GLN 90 CO -0.04 0.50 0.07 1.25 -0.67 0.00 0.00 178.83 179.95 2c91 h LEU 91 N 0.48 0.39 -1.09 1.46 5.85 -0.97 -0.29 115.31 121.14 2c91 h LEU 91 Ca 0.13 -0.22 0.01 0.00 0.84 0.00 0.00 57.88 58.64 2c91 h LEU 91 Cb 0.13 -0.10 -0.04 0.00 0.37 0.00 0.00 40.66 41.01 2c91 h LEU 91 CO -0.02 0.51 0.60 -0.33 -0.34 0.00 0.00 178.44 178.86 2c91 h GLU 92 N 0.26 1.20 -0.54 1.25 5.08 -0.81 0.24 114.58 121.26 2c91 h GLU 92 Ca 0.08 -0.08 -0.06 0.00 -1.00 0.00 0.00 59.36 58.31 2c91 h GLU 92 Cb 0.27 -0.27 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 2c91 h GLU 92 CO -0.00 0.80 0.10 1.15 -1.00 0.00 0.00 179.01 180.06 2c91 h THR 93 N 1.24 1.25 -0.23 1.13 2.02 -0.87 -2.44 112.91 115.01 2c91 h THR 93 Ca 0.33 -0.93 0.00 0.00 0.77 0.00 0.00 66.41 66.58 2c91 h THR 93 Cb -0.13 0.82 -0.01 0.00 -1.74 0.00 0.00 68.15 67.08 2c91 h THR 93 CO -0.07 0.34 0.15 0.28 0.37 0.00 0.00 175.52 176.59 2c91 h SER 94 N 0.77 0.27 -0.75 4.18 0.02 -0.38 -1.35 113.55 116.30 2c91 h SER 94 Ca 0.16 -0.01 0.06 0.00 -0.84 0.00 0.00 61.79 61.17 2c91 h SER 94 Cb 0.39 -0.07 -0.06 0.00 0.14 0.00 0.00 62.40 62.80 2c91 h SER 94 CO 0.01 0.20 0.44 -0.07 -1.14 0.00 0.00 176.83 176.27 2c91 h LEU 95 N 0.31 0.67 -0.18 5.07 3.38 -0.87 0.83 115.31 124.52 2c91 h LEU 95 Ca 0.08 0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.08 2c91 h LEU 95 Cb -0.03 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 2c91 h LEU 95 CO -0.02 0.43 0.10 0.50 0.09 0.00 0.00 178.44 179.54 2c91 h LYS 96 N 0.80 0.25 -0.63 1.13 3.64 -1.17 -0.39 116.57 120.20 2c91 h LYS 96 Ca 0.34 -0.03 -0.09 0.00 -1.27 0.00 0.00 60.65 59.60 2c91 h LYS 96 Cb 0.20 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 31.94 2c91 h LYS 96 CO -0.18 0.23 0.04 0.00 -2.27 0.00 0.00 179.45 177.27 2c91 h ARG 97 N 0.20 1.08 0.00 1.90 3.08 -0.56 -2.20 114.38 117.88 2c91 h ARG 97 Ca 0.06 -0.32 0.00 0.00 0.07 0.00 0.00 59.98 59.80 2c91 h ARG 97 Cb 0.05 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 29.99 2c91 h ARG 97 CO -0.01 1.02 0.00 1.28 -1.07 0.00 0.00 179.97 181.19 2c91 n LEU 98 N -4.19 0.00 -3.61 3.04 4.77 0.22 -3.91 117.00 113.32 2c91 n LEU 98 Ca 0.04 0.48 -0.20 0.00 -0.03 0.00 0.00 56.01 56.29 2c91 n LEU 98 Cb 0.33 -0.48 0.05 0.00 -2.33 0.00 0.00 43.42 40.99 2c91 n LEU 98 CO 0.44 -0.16 0.02 0.00 -1.33 0.00 0.00 177.39 176.36 2c91 n GLN 99 N -1.48 -5.67 -3.89 3.23 6.02 -0.25 -4.30 117.38 111.04 2c91 n GLN 99 Ca 0.05 0.71 -0.11 0.00 -0.01 0.00 0.00 57.00 57.64 2c91 n GLN 99 Cb 0.22 -5.47 -0.10 0.00 1.02 0.00 0.00 30.24 25.92 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 4.21 0.00 -1.71 0.00 0.13 -1.81 -3.42 132.00 129.39 2c91 h PRO 101 Ca -0.31 0.00 0.03 0.00 -0.87 0.00 0.00 66.00 64.85 2c91 h PRO 101 Cb 1.19 0.00 -0.24 0.00 0.13 0.00 0.00 31.00 32.09 2c91 h PRO 101 CO 0.42 0.00 0.38 0.50 -0.23 0.00 0.00 178.00 179.07 2c91 s ARG 102 N -3.19 0.64 0.07 0.86 3.52 -1.26 -4.61 118.95 114.99 2c91 s ARG 102 Ca 0.08 0.56 0.01 0.00 -0.13 0.00 0.00 55.73 56.25 2c91 s ARG 102 Cb 0.08 0.31 -0.04 0.00 -1.56 0.00 0.00 34.95 33.74 2c91 s ARG 102 CO 0.63 -0.12 0.21 0.14 -0.81 0.00 0.00 175.30 175.35 2c91 s VAL 103 N -0.12 5.29 0.21 7.11 -7.23 -0.92 -3.93 120.40 120.81 2c91 s VAL 103 Ca 0.00 -0.47 0.05 0.00 -1.81 0.00 0.00 61.98 59.75 2c91 s VAL 103 Cb -0.04 -3.60 -0.09 0.00 0.56 0.00 0.00 36.38 33.22 2c91 s VAL 103 CO -0.02 0.11 1.49 0.44 -0.31 0.00 0.00 175.10 176.80 2c91 h ASP 104 N 2.98 0.19 -3.48 4.85 3.32 -1.60 -0.55 116.42 122.12 2c91 h ASP 104 Ca -0.46 -0.13 -0.28 0.00 0.02 0.00 0.00 57.03 56.18 2c91 h ASP 104 Cb 1.17 -0.06 -0.33 0.00 0.22 0.00 0.00 39.33 40.33 2c91 h ASP 104 CO 0.74 0.85 -0.68 -0.22 -1.72 0.00 0.00 179.24 178.21 2c91 s LEU 105 N -7.59 0.91 -0.16 1.55 2.96 -1.01 -0.93 118.68 114.42 2c91 s LEU 105 Ca -0.03 0.14 0.00 0.00 -0.22 0.00 0.00 54.13 54.03 2c91 s LEU 105 Cb 0.11 0.09 0.02 0.00 0.50 0.00 0.00 46.19 46.92 2c91 s LEU 105 CO 0.80 -0.14 -0.14 0.12 -1.32 0.00 0.00 176.35 175.67 2c91 s PHE 106 N 1.15 2.28 0.06 5.38 5.36 0.04 -1.51 117.98 130.74 2c91 s PHE 106 Ca -0.09 -1.33 0.02 0.00 -0.96 0.00 0.00 56.93 54.57 2c91 s PHE 106 Cb -0.12 -1.64 -0.04 0.00 -0.34 0.00 0.00 43.02 40.87 2c91 s PHE 106 CO -0.04 -0.70 0.11 0.71 -1.46 0.00 0.00 175.22 173.84 2c91 s TYR 107 N 1.45 3.29 -0.43 10.12 2.02 -0.15 -0.61 117.35 133.05 2c91 s TYR 107 Ca 0.04 0.15 -0.28 0.00 -0.37 0.00 0.00 57.07 56.61 2c91 s TYR 107 Cb -0.13 -1.68 0.02 0.00 -0.40 0.00 0.00 41.96 39.77 2c91 s TYR 107 CO -0.11 0.55 1.04 -0.51 -1.57 0.00 0.00 175.55 174.95 2c91 s LEU 108 N -2.27 3.83 0.22 -1.29 1.43 -0.76 -1.41 118.68 118.43 2c91 s LEU 108 Ca 0.29 0.52 -0.02 0.00 -1.03 0.00 0.00 54.13 53.89 2c91 s LEU 108 Cb -0.12 -3.42 0.21 0.00 0.03 0.00 0.00 46.19 42.89 2c91 s LEU 108 CO 0.22 -1.07 1.60 -0.74 0.23 0.00 0.00 176.35 176.58 2c91 h HIS 109 N 8.86 0.69 -1.96 0.29 2.76 -1.27 -1.13 115.15 123.38 2c91 h HIS 109 Ca -0.23 -0.19 0.05 0.00 -2.20 0.00 0.00 60.37 57.80 2c91 h HIS 109 Cb 1.07 -0.15 -0.19 0.00 1.55 0.00 0.00 27.41 29.68 2c91 h HIS 109 CO 0.90 0.88 0.43 0.00 -1.30 0.00 0.00 177.93 178.84 2c91 s ALA 110 N -4.29 -1.84 0.51 5.26 0.00 -1.22 -4.30 121.76 115.88 2c91 s ALA 110 Ca -0.08 1.29 -0.23 0.00 0.00 0.00 0.00 51.96 52.94 2c91 s ALA 110 Cb 0.12 -0.12 -0.06 0.00 0.00 0.00 0.00 23.12 23.06 2c91 s ALA 110 CO 0.82 -0.46 1.37 -2.14 0.00 0.00 0.00 175.76 175.35 2c91 s PRO 111 N -1.87 3.38 -0.46 0.00 0.02 -1.26 -4.57 135.00 130.23 2c91 s PRO 111 Ca -0.02 2.26 -0.07 0.00 0.02 0.00 0.00 61.00 63.20 2c91 s PRO 111 Cb -0.01 -2.41 0.12 0.00 0.02 0.00 0.00 34.50 32.22 2c91 s PRO 111 CO -0.00 -1.01 0.30 0.34 -0.33 0.00 0.00 177.00 176.30 2c91 s ASP 112 N -0.83 5.54 0.00 2.53 2.15 -1.26 -4.89 116.67 119.90 2c91 s ASP 112 Ca 0.67 -2.01 0.23 0.00 0.43 0.00 0.00 52.55 51.87 2c91 s ASP 112 Cb -0.41 -1.94 1.20 0.00 -0.30 0.00 0.00 42.92 41.47 2c91 s ASP 112 CO 0.50 -0.63 1.74 1.41 -0.17 0.00 0.00 175.17 178.02 2c91 n HIS 113 N 4.72 0.00 0.72 -5.34 8.25 -1.26 -2.42 115.22 119.89 2c91 n HIS 113 Ca -0.05 0.00 0.11 0.00 -0.26 0.00 0.00 57.72 57.52 2c91 n HIS 113 Cb 0.41 -0.21 0.06 0.00 1.12 0.00 0.00 29.99 31.36 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 -1.21 0.64 -4.20 0.41 7.64 -1.26 -4.85 113.62 110.79 2c91 n SER 114 Ca 0.12 -0.32 -0.34 0.00 1.01 0.00 0.00 58.87 59.35 2c91 n SER 114 Cb 0.15 0.69 -0.15 0.00 -1.01 0.00 0.00 64.21 63.89 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 -3.13 2.64 0.16 0.44 2.01 -1.01 -5.09 115.64 111.66 2c91 s THR 115 Ca 0.06 -0.76 -0.34 0.00 0.31 0.00 0.00 61.69 60.96 2c91 s THR 115 Cb 0.15 -2.17 -0.15 0.00 0.01 0.00 0.00 72.50 70.35 2c91 s THR 115 CO 0.79 0.47 1.38 -2.65 -0.69 0.00 0.00 174.62 173.92 2c91 n PRO 116 N 4.69 1.63 0.21 4.92 -0.02 -1.26 -4.83 135.00 140.34 2c91 n PRO 116 Ca -0.20 0.58 0.06 0.00 -2.02 0.00 0.00 63.50 61.92 2c91 n PRO 116 Cb 0.50 -2.23 0.52 0.00 -0.02 0.00 0.00 33.50 32.27 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 3.20 1.10 -0.44 -1.45 3.04 -1.98 -1.44 116.25 118.28 2c91 h VAL 117 Ca -0.45 -0.46 -0.02 0.00 -1.01 0.00 0.00 66.70 64.76 2c91 h VAL 117 Cb 1.30 1.19 -0.02 0.00 -2.01 0.00 0.00 31.29 31.75 2c91 h VAL 117 CO 0.79 0.14 0.17 -0.33 -1.01 0.00 0.00 177.57 177.32 2c91 h GLU 118 N 0.06 0.62 0.04 4.17 3.07 -1.99 0.92 114.58 121.47 2c91 h GLU 118 Ca 0.01 -0.08 0.00 0.00 -0.50 0.00 0.00 59.36 58.79 2c91 h GLU 118 Cb 0.22 -0.12 -0.00 0.00 -0.84 0.00 0.00 28.75 28.01 2c91 h GLU 118 CO 0.01 0.52 -0.03 0.93 -1.40 0.00 0.00 179.01 179.04 2c91 h GLU 119 N 0.62 -0.08 -0.23 2.33 5.08 -1.62 -0.87 114.58 119.81 2c91 h GLU 119 Ca 0.15 0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.50 2c91 h GLU 119 Cb 0.13 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.39 2c91 h GLU 119 CO -0.01 -0.05 0.08 1.15 -1.00 0.00 0.00 179.01 179.17 2c91 h THR 120 N -0.08 1.19 -0.66 1.13 2.02 -1.49 -2.40 112.91 112.61 2c91 h THR 120 Ca 0.00 -0.58 -0.07 0.00 0.77 0.00 0.00 66.41 66.53 2c91 h THR 120 Cb 0.08 1.13 -0.03 0.00 -1.74 0.00 0.00 68.15 67.59 2c91 h THR 120 CO -0.01 0.19 0.13 -0.07 0.37 0.00 0.00 175.52 176.13 2c91 h LEU 121 N 0.21 1.02 -0.57 2.58 3.38 -0.74 -1.16 115.31 120.03 2c91 h LEU 121 Ca 0.08 -0.25 0.04 0.00 0.09 0.00 0.00 57.88 57.84 2c91 h LEU 121 Cb 0.22 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.65 2c91 h LEU 121 CO -0.00 1.01 0.33 0.00 0.09 0.00 0.00 178.44 179.86 2c91 h ALA 123 N 1.28 0.76 -0.59 0.00 0.00 -1.17 -1.94 119.26 117.58 2c91 h ALA 123 Ca 0.24 -0.26 0.08 0.00 0.00 0.00 0.00 54.91 54.97 2c91 h ALA 123 Cb 0.09 -0.21 -0.07 0.00 0.00 0.00 0.00 17.79 17.60 2c91 h ALA 123 CO -0.13 0.52 0.25 0.00 0.00 0.00 0.00 179.25 179.88 2c91 h HIS 125 N 0.45 0.48 -0.37 0.00 6.17 -0.71 -1.57 115.15 119.59 2c91 h HIS 125 Ca 0.29 0.00 0.07 0.00 0.71 0.00 0.00 60.37 61.45 2c91 h HIS 125 Cb 0.32 -0.16 -0.07 0.00 2.52 0.00 0.00 27.41 30.02 2c91 h HIS 125 CO -0.15 0.33 -0.08 0.37 0.71 0.00 0.00 177.93 179.11 2c91 h GLN 126 N 0.49 0.01 -0.40 5.26 5.75 -1.00 0.31 115.11 125.54 2c91 h GLN 126 Ca 0.13 -0.00 -0.07 0.00 -0.15 0.00 0.00 58.65 58.57 2c91 h GLN 126 Cb -0.02 -0.00 -0.02 0.00 1.07 0.00 0.00 27.48 28.51 2c91 h GLN 126 CO -0.03 0.01 -0.03 -0.07 -2.65 0.00 0.00 178.83 176.06 2c91 h LEU 127 N 0.01 0.64 -0.33 -2.39 3.38 -1.02 -1.38 115.31 114.22 2c91 h LEU 127 Ca 0.18 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 2c91 h LEU 127 Cb 0.27 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 2c91 h LEU 127 CO -0.37 0.73 0.14 -0.74 0.09 0.00 0.00 178.44 178.29 2c91 h HIS 128 N 0.62 0.50 -0.30 1.13 2.76 -0.69 -1.67 115.15 117.51 2c91 h HIS 128 Ca 0.12 -0.03 0.06 0.00 -2.20 0.00 0.00 60.37 58.31 2c91 h HIS 128 Cb 0.44 -0.15 -0.01 0.00 1.55 0.00 0.00 27.41 29.23 2c91 h HIS 128 CO 0.02 0.46 0.21 1.96 -1.30 0.00 0.00 177.93 179.27 2c91 h GLN 129 N 0.39 0.15 0.00 5.26 1.08 -0.36 0.54 115.11 122.17 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 0.16 -0.03 0.00 0.00 -0.05 0.00 0.00 27.48 27.56 2c91 h GLN 129 CO -0.01 0.10 0.00 0.39 -0.95 0.00 0.00 178.83 178.36 2c91 n GLU 130 N -4.48 0.13 -0.66 1.46 1.02 -0.57 -4.92 120.64 112.62 2c91 n GLU 130 Ca 0.03 0.04 0.00 0.00 -0.02 0.00 0.00 57.16 57.22 2c91 n GLU 130 Cb 0.26 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.18 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 1.13 0.61 0.11 0.62 0.00 0.18 -4.97 105.19 102.87 2c91 n GLY 131 Ca 0.08 -0.57 0.12 0.00 0.00 0.00 0.00 46.02 45.65 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 0.43 0.00 -3.09 1.61 1.57 -1.47 -3.42 116.57 112.19 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 -0.16 0.00 0.08 0.00 0.00 32.23 32.15 2c91 h LYS 132 CO 0.00 0.00 -0.09 -0.59 -0.57 0.00 0.00 179.45 178.20 2c91 s PHE 133 N -3.16 -0.26 -0.12 -1.35 -0.71 -1.26 -2.16 117.98 108.95 2c91 s PHE 133 Ca 0.08 0.17 -0.06 0.00 -1.04 0.00 0.00 56.93 56.07 2c91 s PHE 133 Cb 0.11 0.23 -0.02 0.00 -1.21 0.00 0.00 43.02 42.13 2c91 s PHE 133 CO 0.67 -0.60 -0.13 0.28 -1.34 0.00 0.00 175.22 174.10 2c91 h VAL 134 N 2.87 0.00 -3.68 -2.49 2.07 -1.15 -3.43 116.25 110.45 2c91 h VAL 134 Ca -0.32 -0.96 -0.67 0.00 0.82 0.00 0.00 66.70 65.57 2c91 h VAL 134 Cb 1.22 0.00 -0.18 0.00 -1.52 0.00 0.00 31.29 30.81 2c91 h VAL 134 CO 0.44 0.00 -0.75 -1.61 0.02 0.00 0.00 177.57 175.67 2c91 s GLU 135 N -2.02 2.18 -0.01 1.57 2.02 -0.11 -5.01 118.70 117.32 2c91 s GLU 135 Ca -0.10 -0.96 -0.17 0.00 0.02 0.00 0.00 54.97 53.75 2c91 s GLU 135 Cb 0.01 -2.31 -0.05 0.00 0.10 0.00 0.00 34.13 31.88 2c91 s GLU 135 CO 0.15 0.53 0.49 -1.17 0.02 0.00 0.00 175.26 175.29 2c91 s LEU 136 N -1.85 4.43 0.19 1.80 2.96 -1.26 -0.78 118.68 124.17 2c91 s LEU 136 Ca 0.19 1.02 0.06 0.00 -0.22 0.00 0.00 54.13 55.18 2c91 s LEU 136 Cb -0.11 -2.73 -0.05 0.00 0.50 0.00 0.00 46.19 43.80 2c91 s LEU 136 CO 0.10 0.20 -0.11 -0.83 -1.32 0.00 0.00 176.35 174.39 2c91 s GLY 137 N -0.52 1.35 0.14 7.98 0.00 0.22 -1.09 107.32 115.41 2c91 s GLY 137 Ca 0.26 -1.64 0.11 0.00 0.00 0.00 0.00 44.72 43.46 2c91 s GLY 137 CO 0.14 -1.70 -0.26 1.08 0.00 0.00 0.00 173.10 172.37 2c91 s LEU 138 N -3.28 2.34 -0.04 0.66 1.43 -0.29 -1.82 118.68 117.69 2c91 s LEU 138 Ca 0.22 -0.77 -0.03 0.00 -1.03 0.00 0.00 54.13 52.52 2c91 s LEU 138 Cb 0.01 -1.18 0.01 0.00 0.03 0.00 0.00 46.19 45.07 2c91 s LEU 138 CO 0.05 0.16 0.10 -0.55 0.23 0.00 0.00 176.35 176.34 2c91 s SER 139 N -2.18 -0.10 -1.31 2.29 0.15 -0.43 -0.59 113.70 111.54 2c91 s SER 139 Ca 0.15 0.21 0.00 0.00 0.70 0.00 0.00 55.95 57.00 2c91 s SER 139 Cb -0.10 0.19 0.00 0.00 -1.71 0.00 0.00 66.02 64.40 2c91 s SER 139 CO 0.07 -0.06 0.00 0.59 1.20 0.00 0.00 173.24 175.04 2c91 n ASN 140 N 3.26 -4.43 -4.87 5.45 3.02 -1.25 -3.45 115.26 113.00 2c91 n ASN 140 Ca -0.15 0.23 -0.36 0.00 -0.03 0.00 0.00 54.58 54.28 2c91 n ASN 140 Cb 0.58 -3.22 -0.06 0.00 -0.61 0.00 0.00 39.78 36.47 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 -2.53 3.61 0.65 3.10 1.51 -1.26 -1.08 117.35 121.36 2c91 s TYR 141 Ca 0.00 0.75 -0.15 0.00 -1.01 0.00 0.00 57.07 56.65 2c91 s TYR 141 Cb 0.00 -2.12 -0.01 0.00 -0.11 0.00 0.00 41.96 39.72 2c91 s TYR 141 CO 0.00 0.59 1.11 0.00 -1.11 0.00 0.00 175.55 176.14 2c91 s ALA 142 N -1.27 2.49 0.26 3.71 0.00 -1.26 -4.75 121.76 120.94 2c91 s ALA 142 Ca 0.28 0.58 -0.02 0.00 0.00 0.00 0.00 51.96 52.80 2c91 s ALA 142 Cb -0.14 -3.32 0.52 0.00 0.00 0.00 0.00 23.12 20.18 2c91 s ALA 142 CO 0.15 -1.23 1.72 0.66 0.00 0.00 0.00 175.76 177.07 2c91 h SER 143 N 0.14 0.30 0.21 0.00 4.64 -1.93 0.40 113.55 117.32 2c91 h SER 143 Ca -0.47 0.12 -0.06 0.00 -0.47 0.00 0.00 61.79 60.90 2c91 h SER 143 Cb 1.25 0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 63.42 2c91 h SER 143 CO 0.54 0.09 -0.26 4.11 -0.87 0.00 0.00 176.83 180.44 2c91 h TRP 144 N 0.45 0.10 -0.15 4.77 5.08 -1.94 -0.61 115.95 123.65 2c91 h TRP 144 Ca 0.45 -0.02 -0.20 0.00 1.08 0.00 0.00 58.89 60.20 2c91 h TRP 144 Cb 0.72 -0.03 0.00 0.00 -3.00 0.00 0.00 29.16 26.86 2c91 h TRP 144 CO -0.16 0.35 -0.71 0.93 -1.28 0.00 0.00 178.44 177.57 2c91 h GLU 145 N 0.09 0.66 -0.64 0.12 5.08 -1.36 -1.82 114.58 116.71 2c91 h GLU 145 Ca 0.01 -0.51 0.02 0.00 -1.00 0.00 0.00 59.36 57.88 2c91 h GLU 145 Cb 0.51 0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.83 2c91 h GLU 145 CO 0.04 1.13 0.41 0.28 -1.00 0.00 0.00 179.01 179.86 2c91 h VAL 146 N 0.46 1.13 -0.56 3.13 2.07 -0.60 -1.23 116.25 120.65 2c91 h VAL 146 Ca -0.03 -0.28 -0.03 0.00 0.82 0.00 0.00 66.70 67.18 2c91 h VAL 146 Cb 1.31 0.23 -0.03 0.00 -1.52 0.00 0.00 31.29 31.29 2c91 h VAL 146 CO 0.14 0.15 0.25 0.00 0.02 0.00 0.00 177.57 178.13 2c91 h ALA 147 N 1.25 0.72 -0.16 1.67 0.00 -0.97 -1.05 119.26 120.73 2c91 h ALA 147 Ca 0.24 -0.14 0.04 0.00 0.00 0.00 0.00 54.91 55.05 2c91 h ALA 147 Cb -0.05 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.48 2c91 h ALA 147 CO -0.07 0.30 -0.07 1.49 0.00 0.00 0.00 179.25 180.90 2c91 h GLU 148 N 0.75 -0.05 0.21 0.00 4.81 -1.14 -1.18 114.58 117.98 2c91 h GLU 148 Ca 0.19 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.42 2c91 h GLU 148 Cb 0.16 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.54 2c91 h GLU 148 CO -0.02 -0.04 -0.16 0.82 -0.73 0.00 0.00 179.01 178.89 2c91 h ILE 149 N -0.06 0.66 -0.91 2.32 2.04 -0.93 0.12 117.51 120.75 2c91 h ILE 149 Ca 0.09 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.95 2c91 h ILE 149 Cb 0.19 0.66 -0.04 0.00 -0.74 0.00 0.00 36.82 36.88 2c91 h ILE 149 CO -0.19 0.00 0.57 0.00 0.00 0.00 0.00 178.15 178.53 2c91 h THR 151 N 1.25 1.25 -0.48 0.00 2.02 -0.82 -2.02 112.91 114.11 2c91 h THR 151 Ca 0.33 -0.96 -0.05 0.00 0.77 0.00 0.00 66.41 66.50 2c91 h THR 151 Cb -0.09 0.96 -0.02 0.00 -1.74 0.00 0.00 68.15 67.26 2c91 h THR 151 CO -0.07 0.34 0.09 -0.07 0.37 0.00 0.00 175.52 176.18 2c91 h LEU 152 N 0.66 0.74 -0.41 2.58 3.38 -0.22 -2.17 115.31 119.87 2c91 h LEU 152 Ca 0.14 -0.25 0.05 0.00 0.09 0.00 0.00 57.88 57.91 2c91 h LEU 152 Cb 0.42 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 40.93 2c91 h LEU 152 CO 0.01 0.80 0.13 0.00 0.09 0.00 0.00 178.44 179.47 2c91 h LYS 154 N 0.28 0.73 -0.30 0.00 3.64 -1.09 -0.54 116.57 119.29 2c91 h LYS 154 Ca 0.19 -0.08 -0.05 0.00 -1.27 0.00 0.00 60.65 59.44 2c91 h LYS 154 Cb 0.19 -0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 31.85 2c91 h LYS 154 CO -0.21 0.55 -0.04 0.77 -2.27 0.00 0.00 179.45 178.25 2c91 h SER 155 N 0.70 0.45 -0.16 4.20 0.02 -1.12 -3.17 113.55 114.47 2c91 h SER 155 Ca 0.19 -0.09 0.00 0.00 -0.84 0.00 0.00 61.79 61.05 2c91 h SER 155 Cb 0.03 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 62.45 2c91 h SER 155 CO -0.03 0.55 0.00 0.59 -1.14 0.00 0.00 176.83 176.80 2c91 n ASN 156 N -4.27 2.83 -3.02 3.07 3.02 -0.20 -4.96 115.26 111.73 2c91 n ASN 156 Ca 0.01 -1.91 -0.22 0.00 -0.03 0.00 0.00 54.58 52.43 2c91 n ASN 156 Cb 0.26 -0.10 0.03 0.00 -0.61 0.00 0.00 39.78 39.37 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 1.36 -0.52 3.91 7.41 0.00 -0.41 -5.02 105.19 111.91 2c91 n GLY 157 Ca 0.17 0.13 -0.29 0.00 0.00 0.00 0.00 46.02 46.02 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 -3.17 3.47 0.19 1.61 0.51 -0.34 -5.04 118.94 116.16 2c91 s TRP 158 Ca 0.30 0.56 -0.33 0.00 -2.12 0.00 0.00 56.10 54.51 2c91 s TRP 158 Cb -0.14 -2.02 -0.14 0.00 -0.81 0.00 0.00 33.47 30.36 2c91 s TRP 158 CO 0.37 0.32 1.46 1.51 -0.51 0.00 0.00 176.95 180.10 2c91 n ILE 159 N -0.48 0.44 -3.04 2.03 3.06 -1.26 -4.52 119.36 115.59 2c91 n ILE 159 Ca -0.02 -0.11 -0.34 0.00 -2.50 0.00 0.00 62.75 59.77 2c91 n ILE 159 Cb 0.53 -1.41 -0.06 0.00 0.54 0.00 0.00 39.64 39.24 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 0.51 4.16 0.35 9.51 2.01 -1.26 -4.93 118.68 129.04 2c91 s LEU 160 Ca 0.75 1.44 -0.28 0.00 0.01 0.00 0.00 54.13 56.05 2c91 s LEU 160 Cb -0.70 -3.98 -0.10 0.00 0.01 0.00 0.00 46.19 41.42 2c91 s LEU 160 CO 0.44 -0.14 1.24 -2.16 1.01 0.00 0.00 176.35 176.75 2c91 s PRO 161 N -2.59 4.28 0.00 1.29 0.04 -1.26 -4.50 135.00 132.26 2c91 s PRO 161 Ca 0.51 2.05 0.03 0.00 0.04 0.00 0.00 61.00 63.63 2c91 s PRO 161 Cb -0.13 -2.96 0.02 0.00 0.04 0.00 0.00 34.50 31.47 2c91 s PRO 161 CO 0.19 -0.19 0.52 0.25 0.04 0.00 0.00 177.00 177.81 2c91 n THR 162 N 0.61 0.00 -4.15 1.26 -2.24 -0.25 -4.78 114.28 104.73 2c91 n THR 162 Ca 0.01 -0.49 -0.16 0.00 -2.27 0.00 0.00 64.05 61.14 2c91 n THR 162 Cb 0.44 1.05 -0.15 0.00 -2.10 0.00 0.00 70.33 69.57 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 -0.37 0.41 -0.09 2.28 1.01 -1.22 -1.54 120.40 120.87 2c91 s VAL 163 Ca 0.03 -0.21 0.03 0.00 0.00 0.00 0.00 61.98 61.83 2c91 s VAL 163 Cb 0.02 -0.35 -0.01 0.00 0.00 0.00 0.00 36.38 36.04 2c91 s VAL 163 CO 0.04 0.12 -0.19 -0.47 0.00 0.00 0.00 175.10 174.60 2c91 s TYR 164 N -0.06 2.62 -0.26 5.22 6.14 -0.05 -1.13 117.35 129.83 2c91 s TYR 164 Ca 0.01 -0.68 -0.05 0.00 0.64 0.00 0.00 57.07 57.00 2c91 s TYR 164 Cb -0.03 -1.70 0.01 0.00 0.42 0.00 0.00 41.96 40.66 2c91 s TYR 164 CO -0.00 -0.19 0.01 -1.14 0.64 0.00 0.00 175.55 174.87 2c91 s GLN 165 N 0.01 3.10 0.08 4.97 0.74 0.25 -0.88 119.66 127.92 2c91 s GLN 165 Ca -0.07 -0.83 0.02 0.00 0.05 0.00 0.00 55.36 54.53 2c91 s GLN 165 Cb -0.15 -3.18 -0.04 0.00 1.10 0.00 0.00 33.01 30.74 2c91 s GLN 165 CO 0.05 -0.37 -0.06 0.20 -0.55 0.00 0.00 175.29 174.56 2c91 s GLY 166 N 1.45 0.69 -0.15 2.59 0.00 -0.08 -3.78 107.32 108.04 2c91 s GLY 166 Ca 0.03 -1.24 -0.29 0.00 0.00 0.00 0.00 44.72 43.22 2c91 s GLY 166 CO -0.01 -1.33 1.30 -0.29 0.00 0.00 0.00 173.10 172.77 2c91 s MET 167 N -3.45 4.23 -0.22 2.90 1.75 -1.26 -0.50 119.30 122.75 2c91 s MET 167 Ca 0.08 1.71 -0.11 0.00 -1.25 0.00 0.00 55.69 56.12 2c91 s MET 167 Cb 0.03 -3.78 0.08 0.00 2.84 0.00 0.00 34.83 34.00 2c91 s MET 167 CO -0.04 -0.71 0.52 -0.47 -0.65 0.00 0.00 175.02 173.66 2c91 s TYR 168 N 3.51 -0.85 0.38 4.11 5.04 -0.90 -4.70 117.35 123.94 2c91 s TYR 168 Ca 0.56 1.69 -0.13 0.00 -2.44 0.00 0.00 57.07 56.75 2c91 s TYR 168 Cb -0.23 0.44 0.05 0.00 0.35 0.00 0.00 41.96 42.57 2c91 s TYR 168 CO 0.16 -0.46 0.74 0.54 -1.34 0.00 0.00 175.55 175.20 2c91 s ASN 169 N 1.87 0.16 0.51 4.32 2.20 -0.81 -3.97 114.94 119.23 2c91 s ASN 169 Ca -0.08 -1.21 0.17 0.00 -0.94 0.00 0.00 52.86 50.80 2c91 s ASN 169 Cb -0.09 0.83 1.25 0.00 -2.00 0.00 0.00 41.25 41.24 2c91 s ASN 169 CO -0.15 -1.64 2.10 0.00 -2.94 0.00 0.00 177.10 174.47 2c91 h ALA 170 N 2.01 2.08 -0.32 3.54 0.00 -1.85 -1.97 119.26 122.76 2c91 h ALA 170 Ca -0.32 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.59 2c91 h ALA 170 Cb 1.25 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.03 2c91 h ALA 170 CO 0.41 -0.12 0.00 0.25 0.00 0.00 0.00 179.25 179.78 2c91 n THR 171 N -4.50 1.43 -3.50 0.00 -2.24 -1.26 -4.49 114.28 99.72 2c91 n THR 171 Ca 0.01 -1.29 -0.29 0.00 -2.27 0.00 0.00 64.05 60.21 2c91 n THR 171 Cb 0.21 0.25 -0.13 0.00 -2.10 0.00 0.00 70.33 68.56 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 -1.61 0.08 -0.09 4.28 2.01 -0.74 -4.83 115.64 114.74 2c91 s THR 172 Ca 0.30 -1.33 0.13 0.00 0.31 0.00 0.00 61.69 61.10 2c91 s THR 172 Cb 0.19 -1.08 0.24 0.00 0.01 0.00 0.00 72.50 71.86 2c91 s THR 172 CO 0.13 -0.88 1.12 0.54 -0.69 0.00 0.00 174.62 174.84 2c91 n ARG 173 N 4.54 0.84 0.21 4.92 1.74 -1.26 -1.92 116.66 125.73 2c91 n ARG 173 Ca 0.04 -2.17 0.07 0.00 -0.77 0.00 0.00 57.85 55.02 2c91 n ARG 173 Cb 0.39 -1.09 0.60 0.00 -1.02 0.00 0.00 32.46 31.34 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 0.24 0.10 -0.02 5.56 4.15 -1.89 -1.66 115.11 121.59 2c91 h GLN 174 Ca -0.02 -0.01 0.01 0.00 0.77 0.00 0.00 58.65 59.40 2c91 h GLN 174 Cb 1.20 -0.02 -0.00 0.00 0.21 0.00 0.00 27.48 28.86 2c91 h GLN 174 CO 0.01 0.07 0.05 -0.39 -1.93 0.00 0.00 178.83 176.63 2c91 h VAL 175 N 0.10 0.23 -0.51 2.39 -1.51 -1.87 -3.29 116.25 111.80 2c91 h VAL 175 Ca 0.03 0.00 -0.10 0.00 -1.23 0.00 0.00 66.70 65.40 2c91 h VAL 175 Cb -0.01 0.96 -0.02 0.00 -2.13 0.00 0.00 31.29 30.09 2c91 h VAL 175 CO -0.01 0.00 -0.08 -0.33 -1.23 0.00 0.00 177.57 175.92 2c91 h GLU 176 N 0.00 0.95 -0.32 5.19 5.08 -1.69 -0.86 114.58 122.92 2c91 h GLU 176 Ca 0.01 -0.35 -0.05 0.00 -1.00 0.00 0.00 59.36 57.97 2c91 h GLU 176 Cb 0.10 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 2c91 h GLU 176 CO -0.00 1.01 -0.01 0.00 -1.00 0.00 0.00 179.01 179.01 2c91 h ALA 177 N 0.91 0.43 0.00 3.43 0.00 -1.77 -3.39 119.26 118.87 2c91 h ALA 177 Ca 0.13 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2c91 h ALA 177 Cb 0.64 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.31 2c91 h ALA 177 CO 0.04 0.19 -0.77 0.39 0.00 0.00 0.00 179.25 179.10 2c91 n GLU 178 N -4.54 0.00 0.30 0.00 1.02 -1.25 -4.76 120.64 111.42 2c91 n GLU 178 Ca -0.02 0.00 -0.17 0.00 -0.02 0.00 0.00 57.16 56.95 2c91 n GLU 178 Cb 0.27 -0.72 -0.08 0.00 -0.02 0.00 0.00 31.44 30.88 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 -0.73 -0.08 -4.62 5.85 -1.71 -2.58 115.31 111.45 2c91 h LEU 179 Ca 0.00 0.04 0.04 0.00 0.84 0.00 0.00 57.88 58.80 2c91 h LEU 179 Cb 0.77 0.21 -0.05 0.00 0.37 0.00 0.00 40.66 41.96 2c91 h LEU 179 CO 0.00 -0.48 -0.27 -0.07 -0.34 0.00 0.00 178.44 177.28 2c91 h LEU 180 N -0.77 -0.83 -1.21 2.25 4.07 -1.36 -1.20 115.31 116.25 2c91 h LEU 180 Ca -0.07 0.12 0.18 0.00 0.08 0.00 0.00 57.88 58.19 2c91 h LEU 180 Cb 0.62 0.35 -0.08 0.00 1.08 0.00 0.00 40.66 42.62 2c91 h LEU 180 CO 0.09 -0.33 0.60 -0.65 -1.08 0.00 0.00 178.44 177.08 2c91 h PRO 181 N -0.37 0.66 -0.56 1.13 0.11 -1.77 -1.27 132.00 129.93 2c91 h PRO 181 Ca 0.09 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 66.11 2c91 h PRO 181 Cb 0.50 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 31.43 2c91 h PRO 181 CO -0.29 0.44 0.18 0.00 -0.21 0.00 0.00 178.00 178.11 2c91 h LEU 183 N 0.77 0.48 -0.51 0.00 3.38 -0.17 -1.62 115.31 117.65 2c91 h LEU 183 Ca 0.18 -0.23 -0.14 0.00 0.09 0.00 0.00 57.88 57.78 2c91 h LEU 183 Cb 0.28 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 2c91 h LEU 183 CO -0.01 0.88 -0.26 0.03 0.09 0.00 0.00 178.44 179.17 2c91 h ARG 184 N 0.36 0.94 -0.62 1.13 -0.00 -1.25 0.18 114.38 115.11 2c91 h ARG 184 Ca 0.02 -0.42 -0.07 0.00 -0.50 0.00 0.00 59.98 59.01 2c91 h ARG 184 Cb 0.95 -0.02 -0.02 0.00 0.00 0.00 0.00 29.97 30.88 2c91 h ARG 184 CO 0.08 1.08 0.11 1.25 0.00 0.00 0.00 179.97 182.49 2c91 h HIS 185 N 0.80 1.08 -0.01 3.04 2.76 -1.09 -3.24 115.15 118.48 2c91 h HIS 185 Ca 0.10 -0.15 0.00 0.00 -2.20 0.00 0.00 60.37 58.12 2c91 h HIS 185 Cb 0.83 -0.30 0.00 0.00 1.55 0.00 0.00 27.41 29.49 2c91 h HIS 185 CO 0.05 0.92 -0.25 1.19 -1.30 0.00 0.00 177.93 178.54 2c91 n PHE 186 N -4.29 0.00 -0.84 5.26 3.72 -0.63 -4.99 117.46 115.70 2c91 n PHE 186 Ca 0.03 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.43 2c91 n PHE 186 Cb 0.27 -0.06 0.00 0.00 -0.94 0.00 0.00 39.48 38.76 2c91 n PHE 186 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2c91 n GLY 187 N 1.34 0.88 3.85 1.37 0.00 -0.07 -5.04 105.19 107.52 2c91 n GLY 187 Ca 0.13 -0.55 -0.37 0.00 0.00 0.00 0.00 46.02 45.23 2c91 n GLY 187 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2c91 s LEU 188 N 0.00 4.43 0.38 0.99 1.02 0.42 -4.86 118.68 121.06 2c91 s LEU 188 Ca 0.00 0.81 -0.04 0.00 0.02 0.00 0.00 54.13 54.92 2c91 s LEU 188 Cb 0.00 -2.57 -0.04 0.00 0.02 0.00 0.00 46.19 43.60 2c91 s LEU 188 CO 0.00 0.31 0.65 0.00 0.02 0.00 0.00 176.35 177.33 2c91 s ARG 189 N -1.28 3.59 -0.15 1.70 1.70 -0.59 -4.48 118.95 119.44 2c91 s ARG 189 Ca 0.24 0.05 0.01 0.00 -0.47 0.00 0.00 55.73 55.56 2c91 s ARG 189 Cb -0.15 -2.53 0.01 0.00 -0.57 0.00 0.00 34.95 31.71 2c91 s ARG 189 CO 0.13 0.03 -0.19 0.12 -1.08 0.00 0.00 175.30 174.31 2c91 s PHE 190 N -2.38 2.73 -0.22 5.89 5.36 -1.26 -0.87 117.98 127.22 2c91 s PHE 190 Ca 0.45 -1.29 -0.06 0.00 -0.96 0.00 0.00 56.93 55.08 2c91 s PHE 190 Cb -0.10 -1.86 -0.02 0.00 -0.34 0.00 0.00 43.02 40.70 2c91 s PHE 190 CO 0.36 -0.60 0.02 0.71 -1.46 0.00 0.00 175.22 174.25 2c91 s TYR 191 N 0.90 3.04 -0.26 10.12 1.51 -0.06 -1.35 117.35 131.24 2c91 s TYR 191 Ca -0.04 -0.56 -0.21 0.00 -1.01 0.00 0.00 57.07 55.24 2c91 s TYR 191 Cb -0.15 -2.15 -0.01 0.00 -0.11 0.00 0.00 41.96 39.54 2c91 s TYR 191 CO -0.03 -0.36 0.67 0.00 -1.11 0.00 0.00 175.55 174.72 2c91 s ALA 192 N 1.36 3.60 0.44 3.71 0.00 -0.35 -0.91 121.76 129.61 2c91 s ALA 192 Ca 0.05 -0.41 0.08 0.00 0.00 0.00 0.00 51.96 51.67 2c91 s ALA 192 Cb -0.15 -3.10 0.02 0.00 0.00 0.00 0.00 23.12 19.89 2c91 s ALA 192 CO 0.01 -0.89 0.58 1.52 0.00 0.00 0.00 175.76 176.98 2c91 s TYR 193 N 2.61 2.66 -1.46 0.00 -0.85 0.35 -0.83 117.35 119.82 2c91 s TYR 193 Ca 0.28 -0.44 -0.10 0.00 -0.52 0.00 0.00 57.07 56.29 2c91 s TYR 193 Cb -0.15 -2.35 0.05 0.00 0.38 0.00 0.00 41.96 39.88 2c91 s TYR 193 CO 0.09 -0.48 0.85 0.09 -1.52 0.00 0.00 175.55 174.57 2c91 n ASN 194 N -1.88 -5.28 0.18 -0.18 5.03 -1.26 -2.12 115.26 109.75 2c91 n ASN 194 Ca 0.09 -0.54 0.13 0.00 0.87 0.00 0.00 54.58 55.13 2c91 n ASN 194 Cb 0.59 -4.24 0.65 0.00 -1.02 0.00 0.00 39.78 35.77 2c91 n ASN 194 CO 0.00 0.00 0.00 1.55 -1.83 0.00 0.00 177.26 176.98 2c91 h PRO 195 N -1.84 0.00 -0.19 3.52 0.13 -1.80 0.14 132.00 131.95 2c91 h PRO 195 Ca -0.54 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.59 2c91 h PRO 195 Cb 1.36 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.49 2c91 h PRO 195 CO 0.60 0.00 0.00 1.28 -0.23 0.00 0.00 178.00 179.65 2c91 n LEU 196 N -2.40 3.34 -3.79 1.56 4.77 -1.26 -4.58 117.00 114.64 2c91 n LEU 196 Ca -0.01 -2.91 -0.23 0.00 -0.03 0.00 0.00 56.01 52.83 2c91 n LEU 196 Cb 0.10 -0.47 0.02 0.00 -2.33 0.00 0.00 43.42 40.74 2c91 n LEU 196 CO 0.14 0.68 -0.10 0.00 -1.33 0.00 0.00 177.39 176.79 2c91 n ALA 197 N -0.65 -1.94 -1.06 -1.18 0.00 0.49 -0.92 120.51 115.25 2c91 n ALA 197 Ca 0.18 -0.16 -0.02 0.00 0.00 0.00 0.00 53.44 53.44 2c91 n ALA 197 Cb 0.76 -2.06 -0.01 0.00 0.00 0.00 0.00 19.45 18.14 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 -1.69 0.42 0.00 0.00 0.00 -1.26 -2.03 105.19 100.63 2c91 n GLY 198 Ca -0.27 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.88 0.84 0.33 -0.02 0.00 -0.48 -4.72 105.19 100.25 2c91 n GLY 199 Ca -0.02 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.01 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 0.77 0.00 0.99 5.85 -0.72 -2.39 115.31 119.82 2c91 h LEU 200 Ca 0.00 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.69 2c91 h LEU 200 Cb 0.00 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 40.84 2c91 h LEU 200 CO 0.00 0.58 0.00 0.18 -0.34 0.00 0.00 178.44 178.86 2c91 n LEU 201 N -4.41 0.00 0.04 2.25 4.77 -0.09 -2.24 117.00 117.31 2c91 n LEU 201 Ca 0.07 0.00 0.13 0.00 -0.03 0.00 0.00 56.01 56.18 2c91 n LEU 201 Cb 0.06 0.00 0.43 0.00 -2.33 0.00 0.00 43.42 41.58 2c91 n LEU 201 CO 0.37 0.00 0.76 0.35 -1.33 0.00 0.00 177.39 177.53 2c91 n THR 202 N -0.52 0.20 -0.95 -5.08 -2.24 -0.90 -3.53 114.28 101.25 2c91 n THR 202 Ca 0.01 -0.11 0.00 0.00 -2.27 0.00 0.00 64.05 61.68 2c91 n THR 202 Cb 0.00 -0.32 0.00 0.00 -2.10 0.00 0.00 70.33 67.91 2c91 n THR 202 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2c91 n GLY 203 N 1.43 0.53 0.00 3.38 0.00 -0.95 -4.30 105.19 105.28 2c91 n GLY 203 Ca 0.06 0.00 0.13 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 -2.04 0.14 -4.29 1.61 2.85 -1.26 -4.85 118.16 110.32 2c91 n LYS 204 Ca 0.00 0.05 -0.23 0.00 -1.05 0.00 0.00 58.31 57.08 2c91 n LYS 204 Cb 0.07 -1.50 -0.07 0.00 -0.65 0.00 0.00 35.03 32.88 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 -2.84 2.69 0.00 5.58 2.02 -1.26 -5.14 117.35 118.40 2c91 s TYR 205 Ca 0.17 -0.23 0.07 0.00 -0.37 0.00 0.00 57.07 56.71 2c91 s TYR 205 Cb 0.17 -1.21 -0.02 0.00 -0.40 0.00 0.00 41.96 40.51 2c91 s TYR 205 CO 0.44 0.61 -0.21 0.15 -1.57 0.00 0.00 175.55 174.97 2c91 s LYS 206 N -3.68 1.64 0.31 -0.62 1.02 -1.26 -5.05 119.74 112.10 2c91 s LYS 206 Ca 0.32 -0.81 0.07 0.00 0.02 0.00 0.00 55.97 55.56 2c91 s LYS 206 Cb -0.06 -1.63 0.86 0.00 -0.52 0.00 0.00 37.83 36.48 2c91 s LYS 206 CO 0.20 0.44 1.66 -0.92 -0.92 0.00 0.00 175.35 175.81 2c91 h TYR 207 N 5.40 0.63 0.00 3.18 5.03 -1.98 0.24 116.97 129.48 2c91 h TYR 207 Ca -0.40 0.04 0.00 0.00 2.58 0.00 0.00 58.73 60.95 2c91 h TYR 207 Cb 1.14 -0.13 0.00 0.00 1.55 0.00 0.00 36.73 39.29 2c91 h TYR 207 CO 0.42 -0.16 0.00 -0.85 -1.32 0.00 0.00 178.16 176.25 2c91 n GLU 208 N -5.12 0.32 -0.37 1.82 0.00 -1.26 -2.50 120.64 113.53 2c91 n GLU 208 Ca 0.26 0.00 0.36 0.00 0.00 0.00 0.00 57.16 57.78 2c91 n GLU 208 Cb 0.79 -1.50 0.74 0.00 0.00 0.00 0.00 31.44 31.47 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 0.04 -0.10 -1.84 5.19 -1.34 -1.35 116.42 117.02 2c91 h ASP 209 Ca 0.00 0.01 -0.03 0.00 -0.62 0.00 0.00 57.03 56.39 2c91 h ASP 209 Cb 0.34 0.01 -0.01 0.00 0.18 0.00 0.00 39.33 39.84 2c91 h ASP 209 CO 0.00 0.00 -0.02 0.07 -3.12 0.00 0.00 179.24 176.17 2c91 h LYS 210 N 0.03 0.31 0.00 3.56 2.10 -1.69 0.14 116.57 121.02 2c91 h LYS 210 Ca 0.62 -0.05 -0.18 0.00 -2.00 0.00 0.00 60.65 59.03 2c91 h LYS 210 Cb 2.39 -0.05 -0.03 0.00 -0.90 0.00 0.00 32.23 33.64 2c91 h LYS 210 CO -0.04 0.36 -1.34 -0.44 -2.00 0.00 0.00 179.45 175.98 2c91 h ASP 211 N 0.30 0.00 0.00 7.07 3.32 -1.51 -3.44 116.42 122.15 2c91 h ASP 211 Ca 0.07 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.12 2c91 h ASP 211 Cb 0.25 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.80 2c91 h ASP 211 CO 0.01 0.66 0.00 0.61 -1.72 0.00 0.00 179.24 178.80 2c91 n GLY 212 N 1.40 0.63 0.21 2.75 0.00 -1.02 -4.92 105.19 104.24 2c91 n GLY 212 Ca -0.09 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.92 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 0.12 -6.47 1.61 3.64 -1.78 -3.47 116.57 110.22 2c91 h LYS 213 Ca 0.00 -0.01 -0.49 0.00 -1.27 0.00 0.00 60.65 58.88 2c91 h LYS 213 Cb 0.00 -0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 31.79 2c91 h LYS 213 CO 0.00 0.08 -0.93 1.04 -2.27 0.00 0.00 179.45 177.37 2c91 n GLN 214 N -5.25 -2.01 -2.00 1.90 6.02 0.03 -4.82 117.38 111.25 2c91 n GLN 214 Ca 0.07 0.37 -0.42 0.00 -0.01 0.00 0.00 57.00 57.01 2c91 n GLN 214 Cb 0.31 -4.08 -0.03 0.00 1.02 0.00 0.00 30.24 27.46 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 -6.48 4.22 0.23 -1.09 0.04 -1.26 -4.88 135.00 125.79 2c91 s PRO 215 Ca 0.25 2.26 -0.32 0.00 0.04 0.00 0.00 61.00 63.23 2c91 s PRO 215 Cb -0.10 -3.51 -0.13 0.00 0.04 0.00 0.00 34.50 30.81 2c91 s PRO 215 CO 0.89 -0.67 1.54 0.28 0.04 0.00 0.00 177.00 179.08 2c91 n VAL 216 N 4.55 0.64 -1.97 -0.36 0.31 -1.26 -4.20 118.33 116.05 2c91 n VAL 216 Ca 0.15 -0.16 0.00 0.00 -0.01 0.00 0.00 64.34 64.32 2c91 n VAL 216 Cb 0.41 -1.69 0.00 0.00 -0.91 0.00 0.00 33.84 31.65 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 2.66 -0.37 0.38 2.92 0.00 -0.96 -4.92 105.19 104.90 2c91 n GLY 217 Ca 0.12 -1.03 0.16 0.00 0.00 0.00 0.00 46.02 45.27 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 0.51 -0.01 1.61 9.65 -1.87 -2.68 114.38 121.59 2c91 h ARG 218 Ca 0.00 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.85 2c91 h ARG 218 Cb 0.00 -0.11 0.00 0.00 -1.39 0.00 0.00 29.97 28.47 2c91 h ARG 218 CO 0.00 0.34 -0.69 1.19 2.80 0.00 0.00 179.97 183.60 2c91 n PHE 219 N -4.54 0.00 -3.76 2.20 3.01 -1.26 -4.31 117.46 108.80 2c91 n PHE 219 Ca 0.18 0.00 -0.13 0.00 1.01 0.00 0.00 57.45 58.51 2c91 n PHE 219 Cb 0.59 -0.01 -0.14 0.00 -0.01 0.00 0.00 39.48 39.91 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 -2.70 -0.16 0.00 1.38 0.08 -1.01 -4.65 117.98 110.91 2c91 s PHE 220 Ca 0.14 0.46 0.00 0.00 0.12 0.00 0.00 56.93 57.66 2c91 s PHE 220 Cb 0.17 -0.07 0.00 0.00 -0.57 0.00 0.00 43.02 42.55 2c91 s PHE 220 CO 0.70 -0.15 0.00 0.41 -0.10 0.00 0.00 175.22 176.07 2c91 n GLY 221 N 4.05 0.20 3.60 4.36 0.00 -1.26 -2.26 105.19 113.87 2c91 n GLY 221 Ca -0.25 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.50 2c91 n GLY 221 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2c91 s ASN 222 N -2.38 3.37 0.44 1.61 2.20 -1.26 -5.05 114.94 113.88 2c91 s ASN 222 Ca 0.00 -1.53 0.29 0.00 -0.94 0.00 0.00 52.86 50.68 2c91 s ASN 222 Cb 0.00 0.15 1.00 0.00 -2.00 0.00 0.00 41.25 40.41 2c91 s ASN 222 CO 0.00 -0.72 1.83 0.78 -2.94 0.00 0.00 177.10 176.05 2c91 h ASN 223 N 1.72 0.00 -0.18 3.54 2.35 -1.97 -2.56 115.58 118.48 2c91 h ASN 223 Ca -0.41 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.34 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 0.71 0.00 0.00 0.79 -1.65 0.00 0.00 177.43 177.28 2c91 n TRP 224 N -2.85 0.22 -0.16 1.19 7.02 -1.26 -4.62 117.44 116.97 2c91 n TRP 224 Ca 0.02 -0.11 -0.08 0.00 -1.02 0.00 0.00 57.50 56.32 2c91 n TRP 224 Cb 0.36 0.00 0.01 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 4.47 0.62 -0.73 6.99 0.00 -1.64 -0.56 119.26 128.41 2c91 h ALA 225 Ca 0.00 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 2c91 h ALA 225 Cb 0.83 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 18.39 2c91 h ALA 225 CO 0.00 0.13 0.42 1.49 0.00 0.00 0.00 179.25 181.29 2c91 h GLU 226 N 0.64 1.00 -0.44 0.00 4.57 -1.82 0.14 114.58 118.67 2c91 h GLU 226 Ca 0.17 -0.10 -0.02 0.00 -1.18 0.00 0.00 59.36 58.23 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 -0.03 0.72 0.19 1.15 -1.18 0.00 0.00 179.01 179.86 2c91 h THR 227 N 1.01 1.19 -0.70 0.32 2.02 -1.69 0.47 112.91 115.53 2c91 h THR 227 Ca 0.26 -0.57 -0.07 0.00 0.77 0.00 0.00 66.41 66.80 2c91 h THR 227 Cb -0.00 0.75 -0.03 0.00 -1.74 0.00 0.00 68.15 67.13 2c91 h THR 227 CO -0.05 0.21 0.16 1.88 0.37 0.00 0.00 175.52 178.10 2c91 h TYR 228 N 0.56 1.19 -0.37 3.16 -1.99 -0.59 -0.40 116.97 118.53 2c91 h TYR 228 Ca 0.15 -0.14 -0.03 0.00 2.00 0.00 0.00 58.73 60.71 2c91 h TYR 228 Cb 0.16 -0.33 -0.02 0.00 2.00 0.00 0.00 36.73 38.54 2c91 h TYR 228 CO -0.00 0.97 0.12 0.00 -0.00 0.00 0.00 178.16 179.24 2c91 h ARG 229 N 1.07 0.57 -0.75 4.88 3.08 -0.35 -1.20 114.38 121.68 2c91 h ARG 229 Ca 0.22 -0.12 0.02 0.00 0.07 0.00 0.00 59.98 60.17 2c91 h ARG 229 Cb 0.38 -0.08 -0.04 0.00 0.08 0.00 0.00 29.97 30.31 2c91 h ARG 229 CO 0.00 0.58 0.49 -0.91 -1.07 0.00 0.00 179.97 179.07 2c91 h ASN 230 N 0.45 0.81 -0.12 7.04 2.35 -0.78 0.14 115.58 125.46 2c91 h ASN 230 Ca 0.12 -0.01 -0.04 0.00 -0.55 0.00 0.00 56.30 55.82 2c91 h ASN 230 Cb 0.25 -0.19 -0.00 0.00 0.05 0.00 0.00 38.32 38.42 2c91 h ASN 230 CO -0.00 0.57 -0.08 -0.09 -1.65 0.00 0.00 177.43 176.18 2c91 h ARG 231 N 0.95 0.27 0.00 0.81 2.43 -0.70 -3.42 114.38 114.72 2c91 h ARG 231 Ca 0.29 -0.13 0.00 0.00 -0.81 0.00 0.00 59.98 59.33 2c91 h ARG 231 Cb -0.01 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.54 2c91 h ARG 231 CO -0.08 0.63 -0.64 1.19 -1.51 0.00 0.00 179.97 179.57 2c91 n PHE 232 N -4.66 0.00 -2.71 2.20 0.99 -0.49 -4.42 117.46 108.37 2c91 n PHE 232 Ca -0.06 0.00 -0.43 0.00 -0.00 0.00 0.00 57.45 56.96 2c91 n PHE 232 Cb 0.30 0.00 -0.01 0.00 -1.00 0.00 0.00 39.48 38.77 2c91 n PHE 232 CO 0.00 0.00 0.00 -0.46 -0.00 0.00 0.00 176.76 176.30 2c91 s TRP 233 N -1.34 2.97 -0.01 1.38 -0.11 0.47 -4.81 118.94 117.49 2c91 s TRP 233 Ca 0.00 -1.61 0.03 0.00 1.22 0.00 0.00 56.10 55.74 2c91 s TRP 233 Cb 0.00 -4.58 -0.00 0.00 -1.50 0.00 0.00 33.47 27.39 2c91 s TRP 233 CO 0.00 -1.69 -0.08 0.15 -4.62 0.00 0.00 176.95 170.71 2c91 s LYS 234 N 3.49 0.76 0.24 5.86 1.02 -1.26 -4.80 119.74 125.05 2c91 s LYS 234 Ca 0.47 -0.30 -0.04 0.00 0.02 0.00 0.00 55.97 56.12 2c91 s LYS 234 Cb 0.01 -0.73 0.47 0.00 -0.52 0.00 0.00 37.83 37.05 2c91 s LYS 234 CO 0.01 0.16 1.70 0.93 -0.92 0.00 0.00 175.35 177.23 2c91 h GLU 235 N 6.09 0.32 -0.08 1.68 5.08 -1.99 0.18 114.58 125.86 2c91 h GLU 235 Ca -0.31 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.01 2c91 h GLU 235 Cb 1.18 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 30.35 2c91 h GLU 235 CO 0.49 0.21 -0.03 0.45 -1.00 0.00 0.00 179.01 179.14 2c91 h HIS 236 N 0.33 0.11 -0.37 4.33 3.86 -1.97 -0.52 115.15 120.93 2c91 h HIS 236 Ca 0.42 -0.00 -0.13 0.00 -1.16 0.00 0.00 60.37 59.50 2c91 h HIS 236 Cb 0.69 -0.04 -0.01 0.00 1.06 0.00 0.00 27.41 29.12 2c91 h HIS 236 CO -0.22 0.15 -0.26 1.25 0.86 0.00 0.00 177.93 179.70 2c91 h HIS 237 N 0.11 0.97 -0.69 2.45 -0.00 -0.99 0.24 115.15 117.24 2c91 h HIS 237 Ca 0.03 -0.27 -0.04 0.00 -0.00 0.00 0.00 60.37 60.09 2c91 h HIS 237 Cb 0.13 -0.21 -0.03 0.00 -0.00 0.00 0.00 27.41 27.30 2c91 h HIS 237 CO 0.00 1.04 0.26 0.74 -0.00 0.00 0.00 177.93 179.98 2c91 h PHE 238 N 0.62 1.06 -0.58 5.26 -1.00 -0.68 -0.32 116.94 121.30 2c91 h PHE 238 Ca 0.07 -0.08 0.01 0.00 2.81 0.00 0.00 57.97 60.78 2c91 h PHE 238 Cb 0.83 -0.32 -0.03 0.00 3.61 0.00 0.00 35.95 40.05 2c91 h PHE 238 CO 0.06 0.83 0.38 0.93 -1.61 0.00 0.00 178.31 178.90 2c91 h GLU 239 N 0.98 0.74 -0.69 1.51 5.08 -0.99 -1.78 114.58 119.43 2c91 h GLU 239 Ca 0.23 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.52 2c91 h GLU 239 Cb 0.23 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 29.28 2c91 h GLU 239 CO -0.02 0.49 0.33 0.00 -1.00 0.00 0.00 179.01 178.81 2c91 h ALA 240 N 1.23 0.89 -0.49 3.43 0.00 -0.52 -1.83 119.26 121.97 2c91 h ALA 240 Ca 0.22 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 2c91 h ALA 240 Cb -0.06 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.44 2c91 h ALA 240 CO -0.06 0.46 0.17 0.82 0.00 0.00 0.00 179.25 180.64 2c91 h ILE 241 N 0.96 1.22 -0.50 0.00 2.04 -0.87 -2.74 117.51 117.63 2c91 h ILE 241 Ca 0.24 -0.73 0.01 0.00 1.00 0.00 0.00 64.86 65.38 2c91 h ILE 241 Cb 0.13 0.77 -0.03 0.00 -0.74 0.00 0.00 36.82 36.95 2c91 h ILE 241 CO -0.03 0.27 0.33 0.00 0.00 0.00 0.00 178.15 178.72 2c91 h ALA 242 N 1.02 1.66 -0.83 1.87 0.00 -0.89 -0.82 119.26 121.27 2c91 h ALA 242 Ca 0.16 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 2c91 h ALA 242 Cb 0.25 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.80 2c91 h ALA 242 CO -0.01 0.31 0.48 1.25 0.00 0.00 0.00 179.25 181.28 2c91 h LEU 243 N 0.66 1.03 -0.14 0.00 7.12 -1.11 -1.26 115.31 121.60 2c91 h LEU 243 Ca 0.19 -0.09 -0.23 0.00 0.13 0.00 0.00 57.88 57.88 2c91 h LEU 243 Cb -0.05 -0.26 0.01 0.00 -0.53 0.00 0.00 40.66 39.83 2c91 h LEU 243 CO -0.04 0.81 -0.85 0.58 -0.13 0.00 0.00 178.44 178.81 2c91 h VAL 244 N 1.15 1.29 -0.69 1.05 2.07 -0.95 -2.60 116.25 117.58 2c91 h VAL 244 Ca 0.30 -2.09 0.00 0.00 0.82 0.00 0.00 66.70 65.73 2c91 h VAL 244 Cb -0.00 2.12 -0.03 0.00 -1.52 0.00 0.00 31.29 31.86 2c91 h VAL 244 CO -0.05 0.65 0.43 -0.33 0.02 0.00 0.00 177.57 178.29 2c91 h GLU 245 N 0.46 0.92 -0.85 1.57 5.08 -1.07 -0.09 114.58 120.61 2c91 h GLU 245 Ca -0.07 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.21 2c91 h GLU 245 Cb 1.49 -0.20 -0.04 0.00 0.50 0.00 0.00 28.75 30.50 2c91 h GLU 245 CO 0.17 0.64 0.53 -0.22 -1.00 0.00 0.00 179.01 179.13 2c91 h LYS 246 N 0.93 1.13 -0.11 2.33 3.64 -1.23 -1.80 116.57 121.47 2c91 h LYS 246 Ca 0.25 -0.09 -0.12 0.00 -1.27 0.00 0.00 60.65 59.42 2c91 h LYS 246 Cb -0.06 -0.25 -0.01 0.00 -0.41 0.00 0.00 32.23 31.50 2c91 h LYS 246 CO -0.05 0.78 -0.47 0.00 -2.27 0.00 0.00 179.45 177.44 2c91 h ALA 247 N 1.29 0.99 -0.15 5.00 0.00 -0.95 -1.38 119.26 124.07 2c91 h ALA 247 Ca 0.31 -0.46 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 2c91 h ALA 247 Cb -0.08 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 2c91 h ALA 247 CO -0.06 0.64 0.06 -0.07 0.00 0.00 0.00 179.25 179.82 2c91 h LEU 248 N 0.23 0.20 -0.00 0.00 3.38 -0.65 -0.16 115.31 118.30 2c91 h LEU 248 Ca 0.01 -0.16 -0.00 0.00 0.09 0.00 0.00 57.88 57.82 2c91 h LEU 248 Cb 0.92 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.62 2c91 h LEU 248 CO 0.08 0.31 0.00 -0.61 0.09 0.00 0.00 178.44 178.30 2c91 h GLN 249 N 0.08 0.00 -0.63 1.13 5.75 -1.23 0.20 115.11 120.41 2c91 h GLN 249 Ca 0.05 -0.00 -0.00 0.00 -0.15 0.00 0.00 58.65 58.55 2c91 h GLN 249 Cb 0.17 -0.00 -0.03 0.00 1.07 0.00 0.00 27.48 28.69 2c91 h GLN 249 CO -0.00 0.04 0.39 1.15 -2.65 0.00 0.00 178.83 177.75 2c91 h THR 250 N -0.03 1.18 0.13 2.39 2.02 -1.22 0.16 112.91 117.54 2c91 h THR 250 Ca 0.00 -0.37 -0.28 0.00 0.77 0.00 0.00 66.41 66.53 2c91 h THR 250 Cb 0.03 0.30 0.01 0.00 -1.74 0.00 0.00 68.15 66.75 2c91 h THR 250 CO -0.00 0.18 -1.29 0.74 0.37 0.00 0.00 175.52 175.52 2c91 h THR 251 N 0.85 1.45 0.00 3.16 2.02 -0.79 -3.40 112.91 116.20 2c91 h THR 251 Ca 0.23 -3.02 0.00 0.00 0.77 0.00 0.00 66.41 64.39 2c91 h THR 251 Cb -0.05 2.93 0.00 0.00 -1.74 0.00 0.00 68.15 69.29 2c91 h THR 251 CO -0.04 0.88 -1.21 -1.22 0.37 0.00 0.00 175.52 174.30 2c91 n TYR 252 N -3.53 0.00 -0.55 3.16 4.01 0.67 -5.08 117.16 115.83 2c91 n TYR 252 Ca -0.10 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.64 2c91 n TYR 252 Cb 1.03 -0.13 0.00 0.00 -0.31 0.00 0.00 39.34 39.93 2c91 n TYR 252 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2c91 n GLY 253 N 2.05 2.25 0.25 2.72 0.00 0.04 -2.84 105.19 109.66 2c91 n GLY 253 Ca -0.01 -0.37 0.14 0.00 0.00 0.00 0.00 46.02 45.78 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 0.17 0.00 2.61 1.35 -1.94 -2.57 112.91 112.54 2c91 h THR 254 Ca 0.00 -0.84 0.00 0.00 -0.55 0.00 0.00 66.41 65.02 2c91 h THR 254 Cb 0.00 1.72 0.00 0.00 -1.73 0.00 0.00 68.15 68.14 2c91 h THR 254 CO 0.00 0.07 0.00 0.59 -0.25 0.00 0.00 175.52 175.93 2c91 n ASN 255 N -3.17 0.00 -4.70 5.36 3.02 -1.13 -4.94 115.26 109.69 2c91 n ASN 255 Ca 0.01 -1.14 -0.42 0.00 -0.03 0.00 0.00 54.58 53.00 2c91 n ASN 255 Cb 0.40 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.54 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 3.69 0.58 5.41 0.00 -0.97 -4.95 121.76 123.53 2c91 s ALA 256 Ca 0.14 1.22 -0.19 0.00 0.00 0.00 0.00 51.96 53.13 2c91 s ALA 256 Cb 0.06 -3.64 -0.06 0.00 0.00 0.00 0.00 23.12 19.48 2c91 s ALA 256 CO 0.11 -0.91 0.88 -0.35 0.00 0.00 0.00 175.76 175.48 2c91 n PRO 257 N 4.82 0.86 -1.68 0.00 -0.04 -1.26 -4.99 135.00 132.70 2c91 n PRO 257 Ca 0.14 0.33 -0.33 0.00 -0.04 0.00 0.00 63.50 63.60 2c91 n PRO 257 Cb 0.40 -2.06 0.06 0.00 -0.04 0.00 0.00 33.50 31.86 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 -2.55 2.62 0.25 0.54 3.00 -1.26 -4.83 118.95 116.72 2c91 s ARG 258 Ca 0.73 1.52 -0.03 0.00 0.00 0.00 0.00 55.73 57.95 2c91 s ARG 258 Cb -0.44 -1.92 0.49 0.00 0.00 0.00 0.00 34.95 33.09 2c91 s ARG 258 CO 0.49 -1.41 1.74 0.52 0.00 0.00 0.00 175.30 176.64 2c91 h MET 259 N -0.01 0.48 -0.60 3.54 2.86 -1.86 -0.28 114.93 119.05 2c91 h MET 259 Ca -0.47 -0.03 0.10 0.00 -2.06 0.00 0.00 59.70 57.24 2c91 h MET 259 Cb 1.26 -0.11 -0.07 0.00 0.06 0.00 0.00 31.60 32.74 2c91 h MET 259 CO 0.53 0.32 0.21 1.15 1.06 0.00 0.00 176.91 180.18 2c91 h THR 260 N 0.49 0.75 -0.40 2.22 2.02 -1.74 0.13 112.91 116.38 2c91 h THR 260 Ca 0.44 -0.13 -0.12 0.00 0.77 0.00 0.00 66.41 67.36 2c91 h THR 260 Cb 0.66 0.34 -0.01 0.00 -1.74 0.00 0.00 68.15 67.40 2c91 h THR 260 CO -0.40 0.07 -0.22 -1.28 0.37 0.00 0.00 175.52 174.06 2c91 h SER 261 N 0.38 0.89 -0.46 4.18 0.87 -1.53 -2.15 113.55 115.74 2c91 h SER 261 Ca 0.31 -0.41 -0.02 0.00 -1.23 0.00 0.00 61.79 60.43 2c91 h SER 261 Cb 0.39 -0.25 -0.02 0.00 -0.44 0.00 0.00 62.40 62.08 2c91 h SER 261 CO -0.32 1.11 0.21 0.00 -0.53 0.00 0.00 176.83 177.30 2c91 h ALA 262 N 0.81 0.60 -0.59 6.23 0.00 -0.62 -0.33 119.26 125.35 2c91 h ALA 262 Ca 0.09 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.79 2c91 h ALA 262 Cb 0.78 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 2c91 h ALA 262 CO 0.06 0.18 0.08 0.00 0.00 0.00 0.00 179.25 179.57 2c91 h ALA 263 N 1.05 1.02 -0.24 0.00 0.00 -0.70 -1.17 119.26 119.22 2c91 h ALA 263 Ca 0.16 -0.26 -0.18 0.00 0.00 0.00 0.00 54.91 54.62 2c91 h ALA 263 Cb 0.15 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.71 2c91 h ALA 263 CO -0.02 0.62 -0.56 -0.07 0.00 0.00 0.00 179.25 179.22 2c91 h LEU 264 N 0.91 0.91 -1.20 0.00 3.38 -1.27 -3.03 115.31 115.01 2c91 h LEU 264 Ca 0.18 -0.56 -0.05 0.00 0.09 0.00 0.00 57.88 57.54 2c91 h LEU 264 Cb 0.43 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 2c91 h LEU 264 CO 0.01 1.30 -0.04 0.03 0.09 0.00 0.00 178.44 179.84 2c91 h ARG 265 N 0.55 0.51 -0.80 1.13 3.08 -0.97 -0.29 114.38 117.60 2c91 h ARG 265 Ca -0.00 -0.12 0.09 0.00 0.07 0.00 0.00 59.98 60.02 2c91 h ARG 265 Cb 1.18 -0.07 -0.07 0.00 0.08 0.00 0.00 29.97 31.08 2c91 h ARG 265 CO 0.12 0.56 0.45 2.35 -1.07 0.00 0.00 179.97 182.38 2c91 h TRP 266 N 0.48 0.81 -0.38 3.04 7.01 -1.18 -0.63 115.95 125.11 2c91 h TRP 266 Ca 0.10 0.03 -0.00 0.00 2.11 0.00 0.00 58.89 61.13 2c91 h TRP 266 Cb 0.37 -0.24 -0.02 0.00 -2.10 0.00 0.00 29.16 27.17 2c91 h TRP 266 CO 0.01 0.33 0.23 0.52 -2.79 0.00 0.00 178.44 176.75 2c91 h MET 267 N 0.76 0.52 0.00 2.65 2.86 -0.94 0.70 114.93 121.47 2c91 h MET 267 Ca 0.38 -0.05 -0.13 0.00 -2.06 0.00 0.00 59.70 57.85 2c91 h MET 267 Cb 0.35 -0.11 -0.02 0.00 0.06 0.00 0.00 31.60 31.88 2c91 h MET 267 CO -0.24 0.39 -0.60 1.88 1.06 0.00 0.00 176.91 179.40 2c91 h TYR 268 N 0.50 0.00 0.00 -0.22 -1.99 -1.14 -3.37 116.97 110.76 2c91 h TYR 268 Ca 0.14 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.87 2c91 h TYR 268 Cb 0.00 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.73 2c91 h TYR 268 CO -0.04 0.60 -0.91 0.72 -0.00 0.00 0.00 178.16 178.53 2c91 n HIS 269 N -3.36 0.00 -0.42 4.88 8.25 -0.27 -4.39 115.22 119.92 2c91 n HIS 269 Ca 0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.47 2c91 n HIS 269 Cb 0.72 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.83 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 -1.41 0.00 -2.71 4.41 8.25 0.16 -5.04 115.22 118.88 2c91 n HIS 270 Ca 0.00 -0.01 -0.19 0.00 -0.26 0.00 0.00 57.72 57.26 2c91 n HIS 270 Cb 0.00 -0.00 0.09 0.00 1.12 0.00 0.00 29.99 31.20 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 -0.01 1.39 -0.31 0.41 3.41 -0.72 -4.98 113.62 112.80 2c91 n SER 271 Ca 0.00 -2.11 0.13 0.00 -0.26 0.00 0.00 58.87 56.63 2c91 n SER 271 Cb 0.11 -0.51 0.57 0.00 -0.26 0.00 0.00 64.21 64.13 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 -2.47 1.42 -2.14 4.33 6.02 -1.26 -4.89 117.38 118.39 2c91 n GLN 272 Ca 0.14 -0.62 -0.41 0.00 -0.01 0.00 0.00 57.00 56.10 2c91 n GLN 272 Cb 0.52 -1.42 -0.02 0.00 1.02 0.00 0.00 30.24 30.33 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 -1.80 4.43 -0.24 1.08 1.43 -1.26 -5.01 118.68 117.31 2c91 s LEU 273 Ca 0.37 2.62 0.01 0.00 -1.03 0.00 0.00 54.13 56.10 2c91 s LEU 273 Cb 0.19 -3.64 0.04 0.00 0.03 0.00 0.00 46.19 42.81 2c91 s LEU 273 CO 0.30 -0.52 -0.11 -1.10 0.23 0.00 0.00 176.35 175.14 2c91 s GLN 274 N -1.40 2.53 0.36 1.70 -0.21 -1.26 -4.82 119.66 116.55 2c91 s GLN 274 Ca 0.51 -1.16 0.06 0.00 0.02 0.00 0.00 55.36 54.79 2c91 s GLN 274 Cb -0.39 -2.85 0.75 0.00 1.00 0.00 0.00 33.01 31.52 2c91 s GLN 274 CO 0.49 -0.46 1.93 0.78 -2.12 0.00 0.00 175.29 175.91 2c91 h GLY 275 N 7.87 1.05 2.00 3.09 0.00 -1.76 -1.40 103.07 113.92 2c91 h GLY 275 Ca -0.28 -0.31 -0.01 0.00 0.00 0.00 0.00 47.33 46.73 2c91 h GLY 275 CO 0.53 0.19 -0.06 -0.91 0.00 0.00 0.00 176.54 176.29 2c91 h THR 276 N 0.76 0.37 -0.00 4.70 1.35 -1.87 -1.35 112.91 116.85 2c91 h THR 276 Ca 0.36 -0.35 0.00 0.00 -0.55 0.00 0.00 66.41 65.87 2c91 h THR 276 Cb 0.39 1.25 0.00 0.00 -1.73 0.00 0.00 68.15 68.06 2c91 h THR 276 CO -0.13 0.06 -0.17 0.54 -0.25 0.00 0.00 175.52 175.57 2c91 n ARG 277 N -3.47 0.57 -0.56 4.72 1.74 -0.57 -4.92 116.66 114.16 2c91 n ARG 277 Ca -0.02 -0.23 0.00 0.00 -0.77 0.00 0.00 57.85 56.84 2c91 n ARG 277 Cb 0.19 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.14 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 1.34 0.73 3.75 -0.13 0.00 -0.51 -4.57 105.19 105.79 2c91 n GLY 278 Ca 0.12 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.11 5.00 0.09 1.61 1.01 -0.97 -4.69 116.67 116.62 2c91 s ASP 279 Ca 0.00 2.36 -0.12 0.00 0.71 0.00 0.00 52.55 55.50 2c91 s ASP 279 Cb 0.00 -2.59 0.01 0.00 1.01 0.00 0.00 42.92 41.35 2c91 s ASP 279 CO 0.00 -1.72 0.28 0.00 0.21 0.00 0.00 175.17 173.94 2c91 s ALA 280 N -1.71 -0.53 -0.20 5.23 0.00 -0.46 -1.42 121.76 122.68 2c91 s ALA 280 Ca 0.76 -0.32 -0.07 0.00 0.00 0.00 0.00 51.96 52.33 2c91 s ALA 280 Cb -0.30 0.52 -0.04 0.00 0.00 0.00 0.00 23.12 23.30 2c91 s ALA 280 CO 0.36 -0.53 0.07 0.08 0.00 0.00 0.00 175.76 175.73 2c91 s VAL 281 N -3.58 4.72 -0.49 0.00 1.01 -0.24 -1.21 120.40 120.60 2c91 s VAL 281 Ca 0.02 -0.05 -0.20 0.00 0.00 0.00 0.00 61.98 61.75 2c91 s VAL 281 Cb 0.03 -3.14 0.05 0.00 0.00 0.00 0.00 36.38 33.31 2c91 s VAL 281 CO -0.10 0.43 0.63 -0.63 0.00 0.00 0.00 175.10 175.43 2c91 s ILE 282 N 0.64 4.86 0.47 2.22 1.01 -0.01 -0.72 121.20 129.66 2c91 s ILE 282 Ca 0.03 -0.31 -0.22 0.00 0.00 0.00 0.00 60.65 60.16 2c91 s ILE 282 Cb -0.13 -4.27 -0.08 0.00 0.01 0.00 0.00 42.46 38.00 2c91 s ILE 282 CO 0.01 -0.74 1.10 -0.76 0.00 0.00 0.00 174.94 174.55 2c91 s LEU 283 N 2.69 3.94 0.22 2.97 1.43 -0.06 -4.54 118.68 125.33 2c91 s LEU 283 Ca 0.17 2.12 0.10 0.00 -1.03 0.00 0.00 54.13 55.49 2c91 s LEU 283 Cb -0.18 -4.39 -0.05 0.00 0.03 0.00 0.00 46.19 41.61 2c91 s LEU 283 CO 0.14 -0.85 -0.19 -0.83 0.23 0.00 0.00 176.35 174.85 2c91 s GLY 284 N -1.66 1.63 -0.17 -3.19 0.00 -1.26 -0.55 107.32 102.12 2c91 s GLY 284 Ca 0.65 -1.69 -0.30 0.00 0.00 0.00 0.00 44.72 43.39 2c91 s GLY 284 CO 0.27 -1.76 1.01 -3.16 0.00 0.00 0.00 173.10 169.47 2c91 s MET 285 N -3.18 0.57 0.00 2.90 0.23 -1.26 -4.77 119.30 113.78 2c91 s MET 285 Ca 0.23 0.14 0.08 0.00 -1.03 0.00 0.00 55.69 55.11 2c91 s MET 285 Cb -0.05 0.27 0.08 0.00 -1.53 0.00 0.00 34.83 33.60 2c91 s MET 285 CO 0.10 -0.18 0.80 -1.13 -2.03 0.00 0.00 175.02 172.58 2c91 n SER 286 N 0.73 1.77 -3.58 -1.18 3.41 -1.26 -4.52 113.62 108.99 2c91 n SER 286 Ca -0.10 -1.40 -0.13 0.00 -0.26 0.00 0.00 58.87 56.98 2c91 n SER 286 Cb 0.58 -0.02 -0.05 0.00 -0.26 0.00 0.00 64.21 64.46 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 -0.70 -0.40 0.30 4.04 1.04 -1.26 -4.37 113.70 112.36 2c91 s SER 287 Ca 0.10 0.07 -0.00 0.00 0.48 0.00 0.00 55.95 56.59 2c91 s SER 287 Cb 0.07 0.49 0.47 0.00 0.10 0.00 0.00 66.02 67.15 2c91 s SER 287 CO 0.10 -0.75 1.89 0.25 0.98 0.00 0.00 173.24 175.71 2c91 h LEU 288 N 2.70 0.77 -0.34 2.42 5.85 -1.97 -2.30 115.31 122.44 2c91 h LEU 288 Ca -0.32 -0.09 -0.00 0.00 0.84 0.00 0.00 57.88 58.31 2c91 h LEU 288 Cb 1.23 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 42.04 2c91 h LEU 288 CO 0.42 0.68 0.20 -0.08 -0.34 0.00 0.00 178.44 179.32 2c91 h GLU 289 N 0.84 0.46 -0.52 1.25 4.81 -1.99 -1.50 114.58 117.92 2c91 h GLU 289 Ca 0.20 -0.04 0.01 0.00 -0.13 0.00 0.00 59.36 59.40 2c91 h GLU 289 Cb 0.15 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.41 2c91 h GLU 289 CO -0.02 0.36 0.34 1.96 -0.73 0.00 0.00 179.01 180.91 2c91 h GLN 290 N 0.43 0.67 -0.41 1.92 4.20 -1.93 -1.89 115.11 118.10 2c91 h GLN 290 Ca 0.12 -0.04 0.03 0.00 0.06 0.00 0.00 58.65 58.82 2c91 h GLN 290 Cb 0.02 -0.15 -0.03 0.00 0.30 0.00 0.00 27.48 27.61 2c91 h GLN 290 CO -0.02 0.44 0.21 1.25 -0.67 0.00 0.00 178.83 180.04 2c91 h LEU 291 N 0.69 0.31 -0.70 1.46 5.85 -1.25 0.67 115.31 122.34 2c91 h LEU 291 Ca 0.19 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.92 2c91 h LEU 291 Cb -0.06 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 40.89 2c91 h LEU 291 CO -0.05 0.22 0.40 -0.33 -0.34 0.00 0.00 178.44 178.34 2c91 h GLU 292 N 0.42 0.97 -0.50 1.25 4.39 -1.07 0.21 114.58 120.26 2c91 h GLU 292 Ca 0.17 -0.11 -0.00 0.00 0.34 0.00 0.00 59.36 59.77 2c91 h GLU 292 Cb 0.07 -0.19 -0.02 0.00 -0.10 0.00 0.00 28.75 28.51 2c91 h GLU 292 CO -0.12 0.71 0.30 0.37 -1.16 0.00 0.00 179.01 179.12 2c91 h GLN 293 N 0.96 0.67 -0.43 2.33 4.15 -1.04 -1.59 115.11 120.16 2c91 h GLN 293 Ca 0.25 -0.06 -0.05 0.00 0.77 0.00 0.00 58.65 59.56 2c91 h GLN 293 Cb 0.02 -0.14 -0.02 0.00 0.21 0.00 0.00 27.48 27.55 2c91 h GLN 293 CO -0.04 0.49 0.09 -0.91 -1.93 0.00 0.00 178.83 176.53 2c91 h ASN 294 N 0.67 0.67 -0.70 -0.69 2.35 -0.30 -2.48 115.58 115.10 2c91 h ASN 294 Ca 0.18 -0.24 -0.00 0.00 -0.55 0.00 0.00 56.30 55.68 2c91 h ASN 294 Cb -0.01 -0.18 -0.03 0.00 0.05 0.00 0.00 38.32 38.14 2c91 h ASN 294 CO -0.03 0.74 0.42 -0.07 -1.65 0.00 0.00 177.43 176.84 2c91 h LEU 295 N 0.57 0.84 -0.40 1.61 3.38 -0.52 -1.74 115.31 119.05 2c91 h LEU 295 Ca 0.13 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 58.05 2c91 h LEU 295 Cb 0.34 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 2c91 h LEU 295 CO 0.00 0.65 0.24 0.00 0.09 0.00 0.00 178.44 179.42 2c91 h ALA 296 N 1.49 0.52 0.00 1.53 0.00 -1.07 -2.82 119.26 118.90 2c91 h ALA 296 Ca 0.25 -0.07 -0.05 0.00 0.00 0.00 0.00 54.91 55.04 2c91 h ALA 296 Cb -0.03 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 2c91 h ALA 296 CO -0.05 0.02 -0.26 0.00 0.00 0.00 0.00 179.25 178.97 2c91 h ALA 297 N 1.10 1.57 0.00 0.00 0.00 -0.89 -2.03 119.26 119.01 2c91 h ALA 297 Ca 0.14 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 2c91 h ALA 297 Cb 0.02 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 2c91 h ALA 297 CO -0.03 0.32 -0.07 1.79 0.00 0.00 0.00 179.25 181.26 2c91 h THR 298 N 0.00 0.35 0.00 0.00 1.35 -1.09 -2.49 112.91 111.03 2c91 h THR 298 Ca -0.00 -0.43 0.00 0.00 -0.55 0.00 0.00 66.41 65.42 2c91 h THR 298 Cb 0.45 1.32 0.00 0.00 -1.73 0.00 0.00 68.15 68.19 2c91 h THR 298 CO 0.03 0.07 -0.84 -0.62 -0.25 0.00 0.00 175.52 173.92 2c91 n GLU 299 N -3.43 0.05 -0.96 4.72 4.71 -0.77 -4.93 120.64 120.03 2c91 n GLU 299 Ca -0.02 -0.00 -0.29 0.00 -0.01 0.00 0.00 57.16 56.84 2c91 n GLU 299 Cb 0.22 -1.51 0.20 0.00 -1.01 0.00 0.00 31.44 29.34 2c91 n GLU 299 CO 0.00 0.00 0.00 -1.21 0.09 0.00 0.00 177.13 176.01 2c91 s GLU 300 N -3.04 0.03 0.00 3.49 2.02 -0.94 -5.06 118.70 115.20 2c91 s GLU 300 Ca 0.08 0.65 0.00 0.00 0.02 0.00 0.00 54.97 55.73 2c91 s GLU 300 Cb 0.16 -1.68 0.00 0.00 0.10 0.00 0.00 34.13 32.71 2c91 s GLU 300 CO 0.80 -3.03 0.00 0.41 0.02 0.00 0.00 175.26 173.45 2c91 n GLY 301 N -0.46 1.07 3.74 -1.39 0.00 -1.26 -5.03 105.19 101.86 2c91 n GLY 301 Ca 0.05 -1.95 -0.32 0.00 0.00 0.00 0.00 46.02 43.79 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 0.13 2.17 0.44 1.61 0.02 -1.26 -4.93 135.00 133.18 2c91 s PRO 302 Ca 0.00 1.46 -0.06 0.00 0.02 0.00 0.00 61.00 62.42 2c91 s PRO 302 Cb 0.00 -1.87 -0.04 0.00 0.02 0.00 0.00 34.50 32.61 2c91 s PRO 302 CO 0.00 -1.75 0.75 -0.51 -0.33 0.00 0.00 177.00 175.16 2c91 s LEU 303 N -5.52 3.74 0.56 -5.54 1.43 -1.26 -5.06 118.68 107.03 2c91 s LEU 303 Ca 0.67 0.93 -0.20 0.00 -1.03 0.00 0.00 54.13 54.51 2c91 s LEU 303 Cb -0.22 -3.85 -0.05 0.00 0.03 0.00 0.00 46.19 42.10 2c91 s LEU 303 CO 0.49 -0.48 1.21 -1.61 0.23 0.00 0.00 176.35 176.19 2c91 s GLU 304 N -4.38 3.17 0.27 1.70 0.41 -1.26 -4.82 118.70 113.80 2c91 s GLU 304 Ca 0.48 1.86 0.00 0.00 -0.41 0.00 0.00 54.97 56.89 2c91 s GLU 304 Cb -0.10 -2.07 0.61 0.00 -1.78 0.00 0.00 34.13 30.79 2c91 s GLU 304 CO 0.39 -1.05 1.70 -1.35 -0.49 0.00 0.00 175.26 174.46 2c91 h PRO 305 N 1.21 0.37 -0.42 0.39 0.11 -1.99 -1.64 132.00 130.04 2c91 h PRO 305 Ca -0.50 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.58 2c91 h PRO 305 Cb 1.29 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 32.29 2c91 h PRO 305 CO 0.56 0.25 0.23 0.00 -0.21 0.00 0.00 178.00 178.83 2c91 h ALA 306 N 1.66 1.62 0.16 -0.75 0.00 -1.97 0.05 119.26 120.02 2c91 h ALA 306 Ca 0.50 -0.07 -0.31 0.00 0.00 0.00 0.00 54.91 55.03 2c91 h ALA 306 Cb 0.88 -0.17 0.03 0.00 0.00 0.00 0.00 17.79 18.53 2c91 h ALA 306 CO -0.50 0.32 -1.31 0.28 0.00 0.00 0.00 179.25 178.04 2c91 h VAL 307 N 0.58 1.28 -0.70 0.00 2.07 -1.63 -1.60 116.25 116.24 2c91 h VAL 307 Ca 0.15 -2.53 0.03 0.00 0.82 0.00 0.00 66.70 65.17 2c91 h VAL 307 Cb 0.01 2.79 -0.04 0.00 -1.52 0.00 0.00 31.29 32.52 2c91 h VAL 307 CO -0.03 0.77 0.44 0.58 0.02 0.00 0.00 177.57 179.35 2c91 h VAL 308 N 0.24 1.09 -0.85 2.57 2.07 -0.92 -1.30 116.25 119.16 2c91 h VAL 308 Ca -0.21 -0.30 -0.03 0.00 0.82 0.00 0.00 66.70 66.99 2c91 h VAL 308 Cb 1.99 0.16 -0.04 0.00 -1.52 0.00 0.00 31.29 31.88 2c91 h VAL 308 CO 0.25 0.16 0.41 -0.08 0.02 0.00 0.00 177.57 178.33 2c91 h GLU 309 N 0.86 1.22 -0.53 1.57 4.57 -0.96 -2.03 114.58 119.29 2c91 h GLU 309 Ca 0.28 -0.18 -0.03 0.00 -1.18 0.00 0.00 59.36 58.25 2c91 h GLU 309 Cb 0.02 -0.22 -0.03 0.00 -0.16 0.00 0.00 28.75 28.37 2c91 h GLU 309 CO -0.11 0.93 0.20 0.00 -1.18 0.00 0.00 179.01 178.85 2c91 h ALA 310 N 1.24 1.35 -0.73 2.92 0.00 -0.58 -0.46 119.26 123.00 2c91 h ALA 310 Ca 0.29 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 2c91 h ALA 310 Cb 0.11 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 2c91 h ALA 310 CO -0.04 0.48 0.38 0.74 0.00 0.00 0.00 179.25 180.81 2c91 h PHE 311 N 0.76 1.01 -0.30 0.00 0.04 -0.66 -0.14 116.94 117.66 2c91 h PHE 311 Ca 0.18 -0.03 -0.08 0.00 2.80 0.00 0.00 57.97 60.85 2c91 h PHE 311 Cb 0.18 -0.32 -0.01 0.00 2.20 0.00 0.00 35.95 38.00 2c91 h PHE 311 CO 0.01 0.72 -0.11 -0.44 -0.60 0.00 0.00 178.31 177.89 2c91 h ASP 312 N 1.03 0.62 -0.22 2.17 3.32 -0.59 -0.82 116.42 121.92 2c91 h ASP 312 Ca 0.26 -0.39 -0.02 0.00 0.02 0.00 0.00 57.03 56.90 2c91 h ASP 312 Cb 0.06 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.43 2c91 h ASP 312 CO -0.04 0.87 0.09 1.56 -1.72 0.00 0.00 179.24 180.00 2c91 h GLN 313 N 0.37 0.39 -0.09 3.56 4.20 -0.85 -0.91 115.11 121.77 2c91 h GLN 313 Ca 0.07 -0.05 -0.02 0.00 0.06 0.00 0.00 58.65 58.71 2c91 h GLN 313 Cb 0.61 -0.08 -0.00 0.00 0.30 0.00 0.00 27.48 28.32 2c91 h GLN 313 CO 0.04 0.35 -0.02 0.00 -0.67 0.00 0.00 178.83 178.52 2c91 h ALA 314 N 1.71 0.13 -0.86 3.87 0.00 -0.70 -2.29 119.26 121.13 2c91 h ALA 314 Ca 0.10 -0.21 0.03 0.00 0.00 0.00 0.00 54.91 54.82 2c91 h ALA 314 Cb 0.11 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.82 2c91 h ALA 314 CO -0.01 -0.15 0.55 2.35 0.00 0.00 0.00 179.25 182.00 2c91 h TRP 315 N -0.15 1.04 -0.74 0.00 -0.00 -0.84 -2.15 115.95 113.12 2c91 h TRP 315 Ca 0.02 0.03 0.06 0.00 -0.00 0.00 0.00 58.89 59.00 2c91 h TRP 315 Cb 0.42 -0.35 -0.04 0.00 -0.00 0.00 0.00 29.16 29.19 2c91 h TRP 315 CO 0.05 0.61 0.49 -0.91 -0.00 0.00 0.00 178.44 178.67 2c91 h ASN 316 N 1.09 0.71 0.50 2.65 2.35 -1.03 0.16 115.58 122.01 2c91 h ASN 316 Ca 0.34 0.00 -0.08 0.00 -0.55 0.00 0.00 56.30 56.01 2c91 h ASN 316 Cb -0.02 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 38.19 2c91 h ASN 316 CO -0.11 0.47 -0.38 0.24 -1.65 0.00 0.00 177.43 176.00 2c91 h MET 317 N 0.81 0.00 0.00 0.81 2.86 -0.80 -3.25 114.93 115.36 2c91 h MET 317 Ca 0.31 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.95 2c91 h MET 317 Cb 0.19 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.85 2c91 h MET 317 CO -0.10 0.38 -1.07 1.33 1.06 0.00 0.00 176.91 178.51 2c91 n VAL 318 N -3.88 0.00 -0.30 -2.22 0.24 -0.78 -4.68 118.33 106.70 2c91 n VAL 318 Ca -0.01 -0.22 0.14 0.00 -2.04 0.00 0.00 64.34 62.21 2c91 n VAL 318 Cb 0.44 0.70 0.32 0.00 -1.47 0.00 0.00 33.84 33.82 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 1.89 1.41 0.00 2.33 0.00 -0.75 0.14 119.26 124.27 2c91 h ALA 319 Ca 0.00 0.20 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 2c91 h ALA 319 Cb 0.48 0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.51 2c91 h ALA 319 CO 0.00 -0.43 -0.01 1.12 0.00 0.00 0.00 179.25 179.93 2c91 h HIS 320 N 0.29 0.00 -0.01 0.00 2.07 -1.83 -2.28 115.15 113.39 2c91 h HIS 320 Ca 0.57 0.00 -0.00 0.00 -2.85 0.00 0.00 60.37 58.09 2c91 h HIS 320 Cb 1.15 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 31.13 2c91 h HIS 320 CO -0.19 0.01 -0.24 -0.85 -3.07 0.00 0.00 177.93 173.59 2c91 n GLU 321 N -3.14 1.47 -1.84 5.12 0.28 0.44 -5.05 120.64 117.91 2c91 n GLU 321 Ca -0.02 -2.95 -0.41 0.00 -0.16 0.00 0.00 57.16 53.62 2c91 n GLU 321 Cb 0.17 -1.57 -0.01 0.00 1.43 0.00 0.00 31.44 31.46 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 -1.42 3.29 -0.01 0.00 0.04 -1.26 -4.97 135.00 130.66 2c91 s PRO 323 Ca 0.56 1.16 -0.30 0.00 0.04 0.00 0.00 61.00 62.46 2c91 s PRO 323 Cb -0.46 -2.03 -0.04 0.00 0.04 0.00 0.00 34.50 32.01 2c91 s PRO 323 CO 0.56 -0.83 1.19 -0.80 0.04 0.00 0.00 177.00 177.16 2c91 s ASN 324 N -2.94 7.08 0.37 6.66 0.01 -1.26 -4.86 114.94 120.00 2c91 s ASN 324 Ca 0.63 1.87 0.27 0.00 -0.71 0.00 0.00 52.86 54.92 2c91 s ASN 324 Cb -0.15 -2.57 1.21 0.00 0.41 0.00 0.00 41.25 40.15 2c91 s ASN 324 CO 0.39 -0.53 1.82 0.10 -1.51 0.00 0.00 177.10 177.37 2c91 h TYR 325 N 7.22 0.00 -2.96 2.20 -0.00 -1.93 -3.44 116.97 118.05 2c91 h TYR 325 Ca -0.37 0.00 -0.63 0.00 -0.00 0.00 0.00 58.73 57.73 2c91 h TYR 325 Cb 1.18 0.00 -0.15 0.00 -0.00 0.00 0.00 36.73 37.76 2c91 h TYR 325 CO 0.71 0.00 -0.74 -0.59 -0.00 0.00 0.00 178.16 177.54 2c91 s PHE 326 N -3.50 2.56 0.00 0.10 -0.12 -1.26 -4.30 117.98 111.45 2c91 s PHE 326 Ca 0.02 -0.25 0.00 0.00 -0.05 0.00 0.00 56.93 56.64 2c91 s PHE 326 Cb 0.09 -1.24 0.00 0.00 -0.63 0.00 0.00 43.02 41.24 2c91 s PHE 326 CO 0.40 0.52 0.08 0.54 -0.05 0.00 0.00 175.22 176.71