#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 3.76 0.55 1.96 1.70 -1.26 -3.11 118.95 122.54 2c91 s ARG 5 Ca 0.00 1.18 -0.19 0.00 -0.47 0.00 0.00 55.73 56.26 2c91 s ARG 5 Cb 0.00 -2.10 -0.09 0.00 -0.57 0.00 0.00 34.95 32.19 2c91 s ARG 5 CO 0.00 -0.45 0.54 -2.30 -1.08 0.00 0.00 175.30 172.02 2c91 n PRO 6 N -1.38 0.54 -1.19 3.89 -0.02 -1.26 -4.33 135.00 131.25 2c91 n PRO 6 Ca 0.08 0.21 -0.29 0.00 -2.02 0.00 0.00 63.50 61.48 2c91 n PRO 6 Cb 0.53 -1.70 0.19 0.00 -0.02 0.00 0.00 33.50 32.51 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 -1.69 0.91 -0.11 3.55 0.00 -0.62 -4.82 121.76 118.98 2c91 s ALA 7 Ca 0.68 -0.54 0.02 0.00 0.00 0.00 0.00 51.96 52.12 2c91 s ALA 7 Cb -0.46 -3.05 0.01 0.00 0.00 0.00 0.00 23.12 19.63 2c91 s ALA 7 CO 0.55 -3.00 -0.17 0.99 0.00 0.00 0.00 175.76 174.13 2c91 s THR 8 N -3.02 1.59 -0.01 0.00 2.01 -1.26 -1.01 115.64 113.94 2c91 s THR 8 Ca 0.67 -0.71 0.08 0.00 0.31 0.00 0.00 61.69 62.04 2c91 s THR 8 Cb -0.16 -1.43 -0.02 0.00 0.01 0.00 0.00 72.50 70.90 2c91 s THR 8 CO 0.57 0.46 -0.24 -0.69 -0.69 0.00 0.00 174.62 174.02 2c91 s VAL 9 N 0.85 2.22 -0.26 3.82 1.01 -0.13 -4.44 120.40 123.47 2c91 s VAL 9 Ca -0.09 -1.13 -0.18 0.00 0.00 0.00 0.00 61.98 60.59 2c91 s VAL 9 Cb -0.15 -1.81 -0.03 0.00 0.00 0.00 0.00 36.38 34.39 2c91 s VAL 9 CO 0.00 0.53 0.51 -0.22 0.00 0.00 0.00 175.10 175.92 2c91 s LEU 10 N -0.79 4.05 0.21 3.92 2.96 -0.56 -0.98 118.68 127.50 2c91 s LEU 10 Ca 0.11 0.52 -0.30 0.00 -0.22 0.00 0.00 54.13 54.24 2c91 s LEU 10 Cb -0.10 -2.66 -0.08 0.00 0.50 0.00 0.00 46.19 43.85 2c91 s LEU 10 CO 0.00 -0.28 0.94 -0.83 -1.32 0.00 0.00 176.35 174.86 2c91 s GLY 11 N 1.53 3.09 -0.05 7.98 0.00 0.35 -0.26 107.32 119.96 2c91 s GLY 11 Ca 0.21 0.61 0.07 0.00 0.00 0.00 0.00 44.72 45.61 2c91 s GLY 11 CO 0.09 1.25 1.00 -1.30 0.00 0.00 0.00 173.10 174.14 2c91 n THR 12 N 1.81 1.08 0.14 0.90 -2.24 -0.77 -4.70 114.28 110.50 2c91 n THR 12 Ca -0.01 -1.23 0.15 0.00 -2.27 0.00 0.00 64.05 60.68 2c91 n THR 12 Cb 0.48 0.27 0.69 0.00 -2.10 0.00 0.00 70.33 69.67 2c91 n THR 12 CO 0.00 0.00 0.00 -0.03 -0.57 0.00 0.00 175.07 174.47 2c91 h MET 13 N 0.00 0.00 -0.01 -0.78 1.85 -1.92 -2.70 114.93 111.37 2c91 h MET 13 Ca 0.00 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 59.09 2c91 h MET 13 Cb 0.88 0.00 0.00 0.00 0.43 0.00 0.00 31.60 32.91 2c91 h MET 13 CO 0.00 0.00 -0.28 0.39 -0.40 0.00 0.00 176.91 176.62 2c91 n GLU 14 N -4.37 1.09 -2.11 0.39 -0.58 -1.26 -4.70 120.64 109.09 2c91 n GLU 14 Ca 0.03 -0.74 -0.43 0.00 -0.42 0.00 0.00 57.16 55.60 2c91 n GLU 14 Cb 0.35 -1.48 -0.02 0.00 -0.57 0.00 0.00 31.44 29.71 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 -2.42 3.43 0.00 3.49 -1.94 -1.02 -1.37 119.30 119.47 2c91 s MET 15 Ca 0.24 1.29 0.00 0.00 -1.71 0.00 0.00 55.69 55.52 2c91 s MET 15 Cb 0.19 -4.14 0.00 0.00 2.01 0.00 0.00 34.83 32.89 2c91 s MET 15 CO 0.51 -1.74 0.00 0.41 -0.01 0.00 0.00 175.02 174.19 2c91 n GLY 16 N 5.29 0.41 0.00 -0.03 0.00 0.40 -2.73 105.19 108.53 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 -1.57 0.00 0.19 1.61 0.63 -0.47 -4.87 116.66 112.18 2c91 n ARG 17 Ca 0.00 0.00 0.06 0.00 -0.92 0.00 0.00 57.85 56.99 2c91 n ARG 17 Cb 0.00 0.00 0.32 0.00 0.45 0.00 0.00 32.46 33.23 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 -5.21 -0.14 3.08 -1.79 -3.43 114.38 106.89 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 0.37 -0.72 -1.64 -1.07 0.00 0.00 179.97 176.90 2c91 s MET 19 N -3.54 3.47 0.55 0.04 -1.94 -0.57 -4.94 119.30 112.38 2c91 s MET 19 Ca 0.01 -0.62 -0.07 0.00 -1.71 0.00 0.00 55.69 53.30 2c91 s MET 19 Cb 0.10 -2.84 0.12 0.00 2.01 0.00 0.00 34.83 34.23 2c91 s MET 19 CO 0.69 0.09 0.75 -0.40 -0.01 0.00 0.00 175.02 176.13 2c91 n ASP 20 N 3.94 0.30 -0.03 3.03 5.68 -1.26 -0.45 116.55 127.75 2c91 n ASP 20 Ca -0.18 -1.42 -0.01 0.00 -0.50 0.00 0.00 54.79 52.68 2c91 n ASP 20 Cb 0.52 -0.55 0.26 0.00 -1.14 0.00 0.00 41.12 40.21 2c91 n ASP 20 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2c91 h ALA 21 N -1.46 1.30 -0.10 2.12 0.00 -1.98 -1.02 119.26 118.12 2c91 h ALA 21 Ca -0.24 -0.22 -0.08 0.00 0.00 0.00 0.00 54.91 54.37 2c91 h ALA 21 Cb 0.73 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.36 2c91 h ALA 21 CO 0.19 0.48 -0.23 1.03 0.00 0.00 0.00 179.25 180.72 2c91 h SER 22 N 0.57 0.37 -0.83 0.00 0.87 -1.99 -0.11 113.55 112.43 2c91 h SER 22 Ca 0.12 -0.58 -0.00 0.00 -1.23 0.00 0.00 61.79 60.10 2c91 h SER 22 Cb 0.36 -0.11 -0.04 0.00 -0.44 0.00 0.00 62.40 62.17 2c91 h SER 22 CO 0.01 0.89 0.51 0.00 -0.53 0.00 0.00 176.83 177.71 2c91 h ALA 23 N 0.50 1.33 -0.47 6.23 0.00 -1.88 -2.20 119.26 122.77 2c91 h ALA 23 Ca -0.00 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.77 2c91 h ALA 23 Cb 0.84 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 2c91 h ALA 23 CO 0.05 0.58 0.07 0.77 0.00 0.00 0.00 179.25 180.73 2c91 h SER 24 N 1.14 0.75 -0.58 0.00 0.02 -1.00 -1.47 113.55 112.41 2c91 h SER 24 Ca 0.30 -0.26 -0.01 0.00 -0.84 0.00 0.00 61.79 60.98 2c91 h SER 24 Cb -0.07 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 62.25 2c91 h SER 24 CO -0.06 0.82 0.34 0.00 -1.14 0.00 0.00 176.83 176.79 2c91 h ALA 25 N 0.95 0.74 -0.65 3.77 0.00 -0.84 -1.67 119.26 121.57 2c91 h ALA 25 Ca 0.14 -0.08 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 2c91 h ALA 25 Cb 0.39 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 2c91 h ALA 25 CO 0.01 0.23 0.17 0.00 0.00 0.00 0.00 179.25 179.66 2c91 h ALA 26 N 1.17 1.08 -0.32 0.00 0.00 -1.22 -1.79 119.26 118.16 2c91 h ALA 26 Ca 0.21 -0.23 -0.16 0.00 0.00 0.00 0.00 54.91 54.73 2c91 h ALA 26 Cb 0.00 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.54 2c91 h ALA 26 CO -0.04 0.62 -0.41 0.77 0.00 0.00 0.00 179.25 180.19 2c91 h SER 27 N 0.96 0.92 -0.37 0.00 0.02 -0.98 -0.25 113.55 113.86 2c91 h SER 27 Ca 0.21 -0.49 -0.02 0.00 -0.84 0.00 0.00 61.79 60.64 2c91 h SER 27 Cb 0.33 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.59 2c91 h SER 27 CO -0.00 1.23 0.15 0.58 -1.14 0.00 0.00 176.83 177.65 2c91 h VAL 28 N 0.64 1.19 -0.44 2.27 2.07 -1.22 -0.56 116.25 120.19 2c91 h VAL 28 Ca 0.04 -0.59 0.07 0.00 0.82 0.00 0.00 66.70 67.04 2c91 h VAL 28 Cb 1.01 0.89 -0.06 0.00 -1.52 0.00 0.00 31.29 31.61 2c91 h VAL 28 CO 0.10 0.21 0.08 0.03 0.02 0.00 0.00 177.57 178.01 2c91 h ARG 29 N 0.45 0.21 -0.89 1.57 3.08 -1.16 0.15 114.38 117.79 2c91 h ARG 29 Ca 0.12 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.15 2c91 h ARG 29 Cb 0.19 -0.05 -0.04 0.00 0.08 0.00 0.00 29.97 30.15 2c91 h ARG 29 CO -0.01 0.14 0.50 0.00 -1.07 0.00 0.00 179.97 179.53 2c91 h ALA 30 N 1.34 1.14 -0.24 0.04 0.00 -0.80 -0.59 119.26 120.14 2c91 h ALA 30 Ca 0.22 -0.12 -0.07 0.00 0.00 0.00 0.00 54.91 54.94 2c91 h ALA 30 Cb 0.27 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 2c91 h ALA 30 CO -0.29 0.64 -0.10 0.35 0.00 0.00 0.00 179.25 179.85 2c91 h PHE 31 N 1.24 0.57 -0.77 0.00 3.57 -0.03 -3.06 116.94 118.47 2c91 h PHE 31 Ca 0.32 -0.14 -0.05 0.00 3.53 0.00 0.00 57.97 61.62 2c91 h PHE 31 Cb 0.00 -0.13 -0.03 0.00 2.79 0.00 0.00 35.95 38.58 2c91 h PHE 31 CO 0.01 0.75 0.27 -0.07 -2.23 0.00 0.00 178.31 177.04 2c91 h LEU 32 N 0.23 1.09 -2.26 0.59 3.38 -0.65 -2.63 115.31 115.06 2c91 h LEU 32 Ca 0.06 -0.19 0.03 0.00 0.09 0.00 0.00 57.88 57.87 2c91 h LEU 32 Cb 0.59 -0.29 -0.00 0.00 0.09 0.00 0.00 40.66 41.06 2c91 h LEU 32 CO 0.03 0.99 0.12 -0.33 0.09 0.00 0.00 178.44 179.34 2c91 h GLU 33 N 1.13 0.00 -0.02 1.13 5.08 -1.01 0.59 114.58 121.49 2c91 h GLU 33 Ca 0.25 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.61 2c91 h GLU 33 Cb 0.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.52 2c91 h GLU 33 CO -0.01 0.00 0.00 0.54 -1.00 0.00 0.00 179.01 178.54 2c91 n ARG 34 N -3.96 1.11 -0.41 2.33 5.12 -0.99 -4.90 116.66 114.96 2c91 n ARG 34 Ca -0.00 -0.17 0.00 0.00 -1.93 0.00 0.00 57.85 55.75 2c91 n ARG 34 Cb 0.23 -1.37 0.00 0.00 -1.16 0.00 0.00 32.46 30.16 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 0.90 0.75 3.91 -0.13 0.00 0.20 -5.06 105.19 105.77 2c91 n GLY 35 Ca 0.17 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.92 2c91 n GLY 35 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2c91 s HIS 36 N -2.40 3.24 0.00 1.61 3.76 -1.22 -5.04 115.29 115.24 2c91 s HIS 36 Ca 0.00 0.68 0.00 0.00 -0.15 0.00 0.00 55.06 55.59 2c91 s HIS 36 Cb 0.00 -2.81 0.00 0.00 1.11 0.00 0.00 32.58 30.88 2c91 s HIS 36 CO 0.00 -0.90 0.00 -1.13 -0.85 0.00 0.00 174.74 171.86 2c91 n SER 37 N -2.66 0.00 -4.75 1.40 3.41 -1.26 -4.42 113.62 105.34 2c91 n SER 37 Ca 0.05 0.00 -0.36 0.00 -0.26 0.00 0.00 58.87 58.30 2c91 n SER 37 Cb 0.58 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 64.44 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 3.38 0.05 4.33 2.02 -1.26 -1.13 118.70 126.10 2c91 s GLU 38 Ca 0.00 -0.29 0.08 0.00 0.02 0.00 0.00 54.97 54.78 2c91 s GLU 38 Cb 0.00 -3.04 -0.03 0.00 0.10 0.00 0.00 34.13 31.16 2c91 s GLU 38 CO 0.00 0.64 -0.19 -0.51 0.02 0.00 0.00 175.26 175.21 2c91 s LEU 39 N -0.66 2.56 -0.14 1.80 1.43 -0.33 -1.49 118.68 121.85 2c91 s LEU 39 Ca 0.12 -0.47 0.01 0.00 -1.03 0.00 0.00 54.13 52.76 2c91 s LEU 39 Cb -0.12 -1.49 0.02 0.00 0.03 0.00 0.00 46.19 44.63 2c91 s LEU 39 CO 0.02 0.24 -0.16 -0.62 0.23 0.00 0.00 176.35 176.06 2c91 s ASP 40 N -1.53 2.72 0.09 2.29 2.15 0.64 -1.55 116.67 121.49 2c91 s ASP 40 Ca 0.15 -0.50 0.02 0.00 0.43 0.00 0.00 52.55 52.64 2c91 s ASP 40 Cb -0.10 -1.23 -0.01 0.00 -0.30 0.00 0.00 42.92 41.28 2c91 s ASP 40 CO 0.06 -0.01 0.06 1.07 -0.17 0.00 0.00 175.17 176.17 2c91 n THR 41 N 4.48 0.00 -3.51 1.71 5.66 -0.36 -1.85 114.28 120.40 2c91 n THR 41 Ca -0.18 -0.60 -0.17 0.00 -3.05 0.00 0.00 64.05 60.04 2c91 n THR 41 Cb 0.51 0.27 -0.06 0.00 -1.55 0.00 0.00 70.33 69.50 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 -2.31 -1.75 0.29 1.79 0.00 -1.26 -3.95 121.76 114.56 2c91 s ALA 42 Ca 0.08 1.23 0.03 0.00 0.00 0.00 0.00 51.96 53.31 2c91 s ALA 42 Cb 0.00 0.09 0.71 0.00 0.00 0.00 0.00 23.12 23.92 2c91 s ALA 42 CO 0.06 -0.41 1.71 0.35 0.00 0.00 0.00 175.76 177.47 2c91 h PHE 43 N 2.88 0.71 -0.47 0.00 3.57 -1.71 -2.79 116.94 119.14 2c91 h PHE 43 Ca -0.28 0.04 -0.04 0.00 3.53 0.00 0.00 57.97 61.22 2c91 h PHE 43 Cb 1.16 -0.17 -0.02 0.00 2.79 0.00 0.00 35.95 39.70 2c91 h PHE 43 CO 0.36 0.01 0.13 1.98 -2.23 0.00 0.00 178.31 178.56 2c91 h MET 44 N 0.46 0.70 -6.32 1.11 4.05 -1.96 -3.26 114.93 109.72 2c91 h MET 44 Ca 0.55 -0.12 -0.55 0.00 -0.28 0.00 0.00 59.70 59.30 2c91 h MET 44 Cb 1.00 -0.11 -0.01 0.00 -0.80 0.00 0.00 31.60 31.68 2c91 h MET 44 CO -0.49 0.63 0.94 0.71 0.23 0.00 0.00 176.91 178.92 2c91 s TYR 45 N -5.20 2.55 -1.44 1.39 2.02 -1.06 -2.80 117.35 112.81 2c91 s TYR 45 Ca -0.09 0.61 -0.11 0.00 -0.37 0.00 0.00 57.07 57.11 2c91 s TYR 45 Cb 0.16 -3.75 0.04 0.00 -0.40 0.00 0.00 41.96 38.02 2c91 s TYR 45 CO 0.78 -2.91 1.10 0.00 -1.57 0.00 0.00 175.55 172.95 2c91 n ASP 47 N -2.94 -5.46 0.00 0.00 2.03 -1.12 -1.17 116.55 107.90 2c91 n ASP 47 Ca 0.02 -0.17 0.00 0.00 0.52 0.00 0.00 54.79 55.16 2c91 n ASP 47 Cb 0.55 -4.48 0.00 0.00 -0.72 0.00 0.00 41.12 36.47 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 -1.25 0.81 0.16 0.27 0.00 -0.29 -4.97 105.19 99.92 2c91 n GLY 48 Ca -0.14 0.00 0.02 0.00 0.00 0.00 0.00 46.02 45.90 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 3.86 0.00 -0.21 1.61 1.08 -0.94 -1.73 115.11 118.78 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 -0.01 0.00 -0.05 0.00 0.00 27.48 27.42 2c91 h GLN 49 CO 0.00 0.51 0.14 1.03 -0.95 0.00 0.00 178.83 179.55 2c91 h SER 50 N 0.00 0.25 -0.59 1.46 0.87 -1.44 -0.98 113.55 113.12 2c91 h SER 50 Ca -0.01 -0.02 -0.05 0.00 -1.23 0.00 0.00 61.79 60.48 2c91 h SER 50 Cb 1.03 -0.06 -0.02 0.00 -0.44 0.00 0.00 62.40 62.90 2c91 h SER 50 CO 0.07 0.20 0.15 -0.33 -0.53 0.00 0.00 176.83 176.39 2c91 h GLU 51 N 0.28 0.93 -0.26 2.24 5.08 -1.76 -1.77 114.58 119.32 2c91 h GLU 51 Ca 0.08 -0.22 0.01 0.00 -1.00 0.00 0.00 59.36 58.23 2c91 h GLU 51 Cb -0.01 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.10 2c91 h GLU 51 CO -0.02 0.86 0.15 -0.91 -1.00 0.00 0.00 179.01 178.09 2c91 h ASN 52 N 0.84 0.25 -0.41 1.42 -0.26 -1.13 -0.36 115.58 115.93 2c91 h ASN 52 Ca 0.18 -0.00 -0.00 0.00 -0.56 0.00 0.00 56.30 55.92 2c91 h ASN 52 Cb 0.34 -0.05 -0.02 0.00 -1.06 0.00 0.00 38.32 37.52 2c91 h ASN 52 CO 0.00 0.19 0.25 0.40 -1.06 0.00 0.00 177.43 177.20 2c91 h ILE 53 N 0.32 1.13 -0.35 2.81 2.04 -1.03 -2.31 117.51 120.12 2c91 h ILE 53 Ca 0.10 -0.29 -0.10 0.00 1.00 0.00 0.00 64.86 65.57 2c91 h ILE 53 Cb -0.01 0.59 -0.02 0.00 -0.74 0.00 0.00 36.82 36.64 2c91 h ILE 53 CO -0.04 0.13 -0.18 -0.07 0.00 0.00 0.00 178.15 177.99 2c91 h LEU 54 N 0.54 0.66 -1.87 1.44 3.38 -1.15 -2.22 115.31 116.09 2c91 h LEU 54 Ca 0.15 -0.21 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 2c91 h LEU 54 Cb -0.00 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.56 2c91 h LEU 54 CO -0.03 0.84 0.02 1.23 0.09 0.00 0.00 178.44 180.59 2c91 h GLY 55 N 0.98 0.10 0.65 0.83 0.00 -0.79 -2.69 103.07 102.15 2c91 h GLY 55 Ca 0.09 -0.04 0.00 0.00 0.00 0.00 0.00 47.33 47.38 2c91 h GLY 55 CO 0.05 0.04 -0.04 0.61 0.00 0.00 0.00 176.54 177.19 2c91 n GLY 56 N -1.45 -0.76 0.04 4.60 0.00 -0.84 -4.27 105.19 102.51 2c91 n GLY 56 Ca -0.02 -0.28 0.15 0.00 0.00 0.00 0.00 46.02 45.87 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 -0.73 0.16 -0.90 0.99 4.77 -1.02 -4.89 117.00 115.39 2c91 n LEU 57 Ca 0.19 0.13 -0.07 0.00 -0.03 0.00 0.00 56.01 56.22 2c91 n LEU 57 Cb 0.24 -0.19 -0.00 0.00 -2.33 0.00 0.00 43.42 41.14 2c91 n LEU 57 CO 0.20 0.03 -0.08 0.61 -1.33 0.00 0.00 177.39 176.82 2c91 n GLY 58 N 1.21 0.09 0.19 -0.72 0.00 -1.26 -4.94 105.19 99.77 2c91 n GLY 58 Ca 0.17 -0.56 0.12 0.00 0.00 0.00 0.00 46.02 45.75 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 -1.13 1.01 -3.50 0.99 4.77 -1.26 -4.96 117.00 112.91 2c91 n LEU 59 Ca -0.08 -0.27 -0.19 0.00 -0.03 0.00 0.00 56.01 55.44 2c91 n LEU 59 Cb 0.56 -0.13 0.08 0.00 -2.33 0.00 0.00 43.42 41.60 2c91 n LEU 59 CO 0.11 0.20 0.12 0.61 -1.33 0.00 0.00 177.39 177.10 2c91 n GLY 60 N 1.40 -0.39 3.77 -0.72 0.00 -1.26 -4.88 105.19 103.10 2c91 n GLY 60 Ca 0.10 0.14 -0.39 0.00 0.00 0.00 0.00 46.02 45.86 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 -6.60 4.12 0.00 0.99 1.43 -1.26 -2.76 118.68 114.59 2c91 s LEU 61 Ca 0.13 2.61 0.00 0.00 -1.03 0.00 0.00 54.13 55.84 2c91 s LEU 61 Cb -0.06 -4.02 0.00 0.00 0.03 0.00 0.00 46.19 42.14 2c91 s LEU 61 CO 0.74 -0.98 0.00 0.61 0.23 0.00 0.00 176.35 176.95 2c91 n GLY 62 N 0.63 0.47 2.77 -3.19 0.00 -1.25 -4.30 105.19 100.33 2c91 n GLY 62 Ca 0.05 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.16 6.69 -2.08 1.61 3.41 -1.11 -4.39 113.62 117.58 2c91 n SER 63 Ca 0.00 -3.59 -0.26 0.00 -0.26 0.00 0.00 58.87 54.76 2c91 n SER 63 Cb 0.08 -1.14 -0.03 0.00 -0.26 0.00 0.00 64.21 62.86 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 0.43 -0.32 0.00 5.00 0.00 -1.26 -3.33 105.19 105.71 2c91 n GLY 64 Ca 0.38 0.30 0.00 0.00 0.00 0.00 0.00 46.02 46.70 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 0.76 0.00 -3.70 1.61 9.92 -1.26 -5.12 116.55 118.76 2c91 n ASP 65 Ca 0.09 0.00 -0.12 0.00 -0.53 0.00 0.00 54.79 54.23 2c91 n ASP 65 Cb 0.06 0.00 -0.12 0.00 -0.64 0.00 0.00 41.12 40.41 2c91 n ASP 65 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2c91 h THR 67 N 5.95 1.40 -3.56 0.00 2.02 -1.93 -3.45 112.91 113.35 2c91 h THR 67 Ca -0.31 -2.60 -0.52 0.00 0.77 0.00 0.00 66.41 63.75 2c91 h THR 67 Cb 1.15 3.10 -0.01 0.00 -1.74 0.00 0.00 68.15 70.64 2c91 h THR 67 CO 0.28 0.76 0.40 -0.69 0.37 0.00 0.00 175.52 176.64 2c91 s VAL 68 N -2.55 4.29 -0.04 3.16 1.01 -1.26 -4.88 120.40 120.13 2c91 s VAL 68 Ca -0.11 1.92 0.02 0.00 0.00 0.00 0.00 61.98 63.81 2c91 s VAL 68 Cb 0.03 -4.22 -0.03 0.00 0.00 0.00 0.00 36.38 32.15 2c91 s VAL 68 CO 0.89 0.30 -0.09 -0.54 0.00 0.00 0.00 175.10 175.67 2c91 s LYS 69 N -0.09 2.61 -0.06 2.72 1.02 -0.28 -4.70 119.74 120.96 2c91 s LYS 69 Ca 0.48 -0.65 0.05 0.00 0.02 0.00 0.00 55.97 55.87 2c91 s LYS 69 Cb -0.25 -2.51 -0.01 0.00 -0.52 0.00 0.00 37.83 34.54 2c91 s LYS 69 CO 0.31 0.63 -0.23 -1.50 -0.92 0.00 0.00 175.35 173.64 2c91 s ILE 70 N -0.86 1.92 0.02 2.17 1.10 -1.26 -1.19 121.20 123.10 2c91 s ILE 70 Ca 0.14 -0.98 0.09 0.00 -0.51 0.00 0.00 60.65 59.38 2c91 s ILE 70 Cb -0.11 -1.64 -0.03 0.00 0.15 0.00 0.00 42.46 40.84 2c91 s ILE 70 CO 0.03 0.54 -0.26 0.00 -2.11 0.00 0.00 174.94 173.14 2c91 s ALA 71 N -0.01 2.19 0.29 1.50 0.00 -0.60 -1.72 121.76 123.42 2c91 s ALA 71 Ca -0.07 -1.20 0.06 0.00 0.00 0.00 0.00 51.96 50.75 2c91 s ALA 71 Cb -0.14 -0.50 -0.02 0.00 0.00 0.00 0.00 23.12 22.46 2c91 s ALA 71 CO 0.04 0.53 0.22 -2.37 0.00 0.00 0.00 175.76 174.18 2c91 n THR 72 N 2.05 0.00 -3.75 0.00 5.66 -0.58 -1.23 114.28 116.43 2c91 n THR 72 Ca -0.17 -2.05 -0.13 0.00 -3.05 0.00 0.00 64.05 58.66 2c91 n THR 72 Cb 0.52 0.98 -0.10 0.00 -1.55 0.00 0.00 70.33 70.18 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 -3.17 0.55 -0.08 1.09 1.02 -1.25 -0.93 119.74 116.97 2c91 s LYS 73 Ca 0.31 0.16 -0.02 0.00 0.02 0.00 0.00 55.97 56.44 2c91 s LYS 73 Cb 0.02 0.25 -0.03 0.00 -0.52 0.00 0.00 37.83 37.54 2c91 s LYS 73 CO 0.22 -0.12 0.01 0.00 -0.92 0.00 0.00 175.35 174.54 2c91 s ALA 74 N -0.57 3.32 0.13 5.17 0.00 -0.24 -1.71 121.76 127.85 2c91 s ALA 74 Ca -0.07 -0.81 0.05 0.00 0.00 0.00 0.00 51.96 51.13 2c91 s ALA 74 Cb -0.04 -1.50 -0.04 0.00 0.00 0.00 0.00 23.12 21.55 2c91 s ALA 74 CO 0.02 0.60 -0.11 0.54 0.00 0.00 0.00 175.76 176.81 2c91 s ASN 75 N -0.94 1.78 0.00 0.00 2.20 -1.26 -0.52 114.94 116.19 2c91 s ASN 75 Ca 0.14 -0.90 0.23 0.00 -0.94 0.00 0.00 52.86 51.39 2c91 s ASN 75 Cb -0.11 -0.03 0.75 0.00 -2.00 0.00 0.00 41.25 39.86 2c91 s ASN 75 CO 0.03 -0.25 1.56 -0.81 -2.94 0.00 0.00 177.10 174.68 2c91 n PRO 76 N 0.22 1.83 -1.74 3.55 -0.04 -1.26 -4.51 135.00 133.05 2c91 n PRO 76 Ca -0.13 -1.24 -0.30 0.00 -0.04 0.00 0.00 63.50 61.79 2c91 n PRO 76 Cb 0.59 -1.43 0.07 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 -1.81 3.08 -1.49 0.54 0.51 -1.26 -1.51 118.94 117.00 2c91 s TRP 77 Ca 0.34 1.06 -0.12 0.00 -2.12 0.00 0.00 56.10 55.26 2c91 s TRP 77 Cb 0.19 -3.13 0.07 0.00 -0.81 0.00 0.00 33.47 29.79 2c91 s TRP 77 CO 0.28 -1.49 0.86 0.39 -0.51 0.00 0.00 176.95 176.48 2c91 n GLU 78 N -3.22 -5.11 -0.68 4.98 1.02 -1.26 -1.67 120.64 114.70 2c91 n GLU 78 Ca 0.07 0.61 0.00 0.00 -0.02 0.00 0.00 57.16 57.82 2c91 n GLU 78 Cb 0.57 -5.47 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 -1.58 0.82 0.24 0.62 0.00 -1.26 -4.95 105.19 99.07 2c91 n GLY 79 Ca 0.02 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.88 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 3.40 0.83 -2.16 1.61 1.57 -1.25 -3.50 116.57 117.07 2c91 h LYS 80 Ca 0.00 -0.58 0.24 0.00 -1.87 0.00 0.00 60.65 58.44 2c91 h LYS 80 Cb 0.00 0.09 -0.09 0.00 0.08 0.00 0.00 32.23 32.31 2c91 h LYS 80 CO 0.00 1.21 -0.58 -1.13 -0.57 0.00 0.00 179.45 178.37 2c91 n SER 81 N -4.00 -5.58 -1.32 0.86 3.41 -0.57 -4.58 113.62 101.84 2c91 n SER 81 Ca -0.06 0.66 -0.07 0.00 -0.26 0.00 0.00 58.87 59.15 2c91 n SER 81 Cb 0.66 -3.00 0.20 0.00 -0.26 0.00 0.00 64.21 61.81 2c91 n SER 81 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2c91 n LEU 82 N -3.66 4.51 -4.70 1.04 4.77 -1.26 -4.30 117.00 113.39 2c91 n LEU 82 Ca -0.03 -3.75 -0.34 0.00 -0.03 0.00 0.00 56.01 51.86 2c91 n LEU 82 Cb 0.43 -0.67 0.11 0.00 -2.33 0.00 0.00 43.42 40.97 2c91 n LEU 82 CO 0.02 1.23 0.81 -0.54 -1.33 0.00 0.00 177.39 177.57 2c91 s LYS 83 N -3.25 1.85 0.23 3.23 -0.14 -1.26 -4.37 119.74 116.02 2c91 s LYS 83 Ca 0.46 1.84 -0.15 0.00 -1.36 0.00 0.00 55.97 56.77 2c91 s LYS 83 Cb 0.42 -1.79 0.27 0.00 -1.68 0.00 0.00 37.83 35.04 2c91 s LYS 83 CO 0.01 -2.07 1.58 -1.35 -0.76 0.00 0.00 175.35 172.76 2c91 h PRO 84 N -0.55 -0.04 -0.33 -1.68 0.11 -1.91 -1.56 132.00 126.03 2c91 h PRO 84 Ca -0.47 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.59 2c91 h PRO 84 Cb 1.31 0.01 -0.02 0.00 0.11 0.00 0.00 31.00 32.41 2c91 h PRO 84 CO 0.48 -0.03 -0.02 -0.44 -0.21 0.00 0.00 178.00 177.78 2c91 h ASP 85 N -0.05 0.48 -0.12 -2.05 3.32 -1.98 -2.40 116.42 113.62 2c91 h ASP 85 Ca 0.34 -0.09 -0.05 0.00 0.02 0.00 0.00 57.03 57.25 2c91 h ASP 85 Cb 0.59 -0.13 -0.00 0.00 0.22 0.00 0.00 39.33 40.01 2c91 h ASP 85 CO -0.84 0.57 -0.10 -1.28 -1.72 0.00 0.00 179.24 175.87 2c91 h SER 86 N 0.49 0.30 -0.35 6.45 0.87 -1.64 -1.44 113.55 118.24 2c91 h SER 86 Ca 0.10 -0.46 0.05 0.00 -1.23 0.00 0.00 61.79 60.26 2c91 h SER 86 Cb 0.35 -0.08 -0.05 0.00 -0.44 0.00 0.00 62.40 62.18 2c91 h SER 86 CO 0.01 0.70 0.06 0.40 -0.53 0.00 0.00 176.83 177.47 2c91 h ILE 87 N -0.09 0.82 -0.05 2.23 1.08 -1.25 0.32 117.51 120.57 2c91 h ILE 87 Ca 0.02 -0.06 0.02 0.00 -0.39 0.00 0.00 64.86 64.45 2c91 h ILE 87 Cb 0.60 0.63 -0.02 0.00 -3.07 0.00 0.00 36.82 34.96 2c91 h ILE 87 CO 0.03 0.03 -0.06 -0.09 -0.69 0.00 0.00 178.15 177.37 2c91 h ARG 88 N 0.18 -0.07 -0.51 2.37 2.43 -1.48 -1.92 114.38 115.37 2c91 h ARG 88 Ca 0.16 0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.31 2c91 h ARG 88 Cb 0.19 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.74 2c91 h ARG 88 CO -0.22 -0.05 0.21 1.03 -1.51 0.00 0.00 179.97 179.43 2c91 h SER 89 N -0.08 0.71 -0.23 -3.80 0.87 -0.86 -0.75 113.55 109.41 2c91 h SER 89 Ca 0.04 -0.17 -0.01 0.00 -1.23 0.00 0.00 61.79 60.42 2c91 h SER 89 Cb 0.13 -0.18 -0.01 0.00 -0.44 0.00 0.00 62.40 61.90 2c91 h SER 89 CO -0.09 0.68 0.10 1.56 -0.53 0.00 0.00 176.83 178.55 2c91 h GLN 90 N 0.69 0.33 -0.37 2.24 4.20 -0.92 -1.21 115.11 120.06 2c91 h GLN 90 Ca 0.17 -0.05 -0.03 0.00 0.06 0.00 0.00 58.65 58.80 2c91 h GLN 90 Cb 0.19 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 27.90 2c91 h GLN 90 CO -0.01 0.35 0.12 1.25 -0.67 0.00 0.00 178.83 179.87 2c91 h LEU 91 N 0.23 0.55 -0.95 1.46 5.85 -1.03 0.30 115.31 121.70 2c91 h LEU 91 Ca 0.08 -0.21 -0.03 0.00 0.84 0.00 0.00 57.88 58.56 2c91 h LEU 91 Cb 0.14 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 40.99 2c91 h LEU 91 CO -0.01 0.61 0.34 -0.33 -0.34 0.00 0.00 178.44 178.71 2c91 h GLU 92 N 0.46 1.09 -0.27 1.25 5.08 -1.11 0.16 114.58 121.24 2c91 h GLU 92 Ca 0.12 -0.17 -0.00 0.00 -1.00 0.00 0.00 59.36 58.31 2c91 h GLU 92 Cb 0.26 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 2c91 h GLU 92 CO -0.00 0.86 0.15 1.15 -1.00 0.00 0.00 179.01 180.17 2c91 h THR 93 N 1.08 1.11 -0.29 1.13 2.02 -1.11 -2.45 112.91 114.41 2c91 h THR 93 Ca 0.26 -0.29 0.02 0.00 0.77 0.00 0.00 66.41 67.17 2c91 h THR 93 Cb 0.14 0.82 -0.03 0.00 -1.74 0.00 0.00 68.15 67.35 2c91 h THR 93 CO -0.03 0.11 0.13 0.28 0.37 0.00 0.00 175.52 176.38 2c91 h SER 94 N 0.32 0.17 -0.94 4.18 0.02 -0.06 -2.09 113.55 115.16 2c91 h SER 94 Ca 0.09 0.02 0.05 0.00 -0.84 0.00 0.00 61.79 61.11 2c91 h SER 94 Cb 0.05 -0.01 -0.06 0.00 0.14 0.00 0.00 62.40 62.52 2c91 h SER 94 CO -0.02 0.14 0.61 -0.07 -1.14 0.00 0.00 176.83 176.35 2c91 h LEU 95 N 0.27 1.00 -0.03 5.07 3.38 -0.70 0.84 115.31 125.14 2c91 h LEU 95 Ca 0.12 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.08 2c91 h LEU 95 Cb 0.06 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.59 2c91 h LEU 95 CO -0.10 0.67 0.01 0.50 0.09 0.00 0.00 178.44 179.60 2c91 h LYS 96 N 1.15 0.05 -0.87 1.13 3.64 -1.06 -1.68 116.57 118.92 2c91 h LYS 96 Ca 0.38 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.74 2c91 h LYS 96 Cb 0.07 -0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 31.84 2c91 h LYS 96 CO -0.13 0.29 0.53 0.00 -2.27 0.00 0.00 179.45 177.87 2c91 h ARG 97 N -0.20 1.19 0.00 1.90 3.08 -0.95 -1.72 114.38 117.68 2c91 h ARG 97 Ca 0.01 -0.11 0.00 0.00 0.07 0.00 0.00 59.98 59.95 2c91 h ARG 97 Cb 0.27 -0.25 0.00 0.00 0.08 0.00 0.00 29.97 30.07 2c91 h ARG 97 CO 0.00 0.83 0.00 1.28 -1.07 0.00 0.00 179.97 181.01 2c91 n LEU 98 N -4.41 0.00 -3.81 3.04 4.77 0.25 -3.96 117.00 112.88 2c91 n LEU 98 Ca 0.09 0.16 -0.24 0.00 -0.03 0.00 0.00 56.01 55.99 2c91 n LEU 98 Cb 0.06 -0.16 0.01 0.00 -2.33 0.00 0.00 43.42 41.00 2c91 n LEU 98 CO 0.38 -0.02 -0.11 0.00 -1.33 0.00 0.00 177.39 176.31 2c91 n GLN 99 N -1.16 -4.39 -3.85 3.23 6.02 -0.65 -4.37 117.38 112.22 2c91 n GLN 99 Ca 0.16 0.54 -0.12 0.00 -0.01 0.00 0.00 57.00 57.58 2c91 n GLN 99 Cb 0.16 -4.99 -0.10 0.00 1.02 0.00 0.00 30.24 26.33 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 4.46 0.00 -1.96 0.00 0.13 -1.82 -3.42 132.00 129.40 2c91 h PRO 101 Ca -0.30 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.82 2c91 h PRO 101 Cb 1.19 0.00 -0.22 0.00 0.13 0.00 0.00 31.00 32.11 2c91 h PRO 101 CO 0.40 0.00 0.13 0.50 -0.23 0.00 0.00 178.00 178.80 2c91 s ARG 102 N -3.13 0.76 0.16 0.86 3.52 -1.26 -4.57 118.95 115.30 2c91 s ARG 102 Ca 0.09 1.03 -0.04 0.00 -0.13 0.00 0.00 55.73 56.69 2c91 s ARG 102 Cb 0.12 0.30 -0.05 0.00 -1.56 0.00 0.00 34.95 33.76 2c91 s ARG 102 CO 0.63 -0.11 0.39 0.14 -0.81 0.00 0.00 175.30 175.53 2c91 s VAL 103 N 0.81 5.17 0.25 7.11 -7.23 -0.75 -3.83 120.40 121.93 2c91 s VAL 103 Ca -0.03 -0.06 0.09 0.00 -1.81 0.00 0.00 61.98 60.16 2c91 s VAL 103 Cb -0.05 -3.66 -0.05 0.00 0.56 0.00 0.00 36.38 33.19 2c91 s VAL 103 CO -0.07 -0.03 1.57 0.44 -0.31 0.00 0.00 175.10 176.70 2c91 h ASP 104 N 2.56 0.05 -3.31 4.85 3.32 -1.68 -0.98 116.42 121.23 2c91 h ASP 104 Ca -0.46 -0.03 -0.20 0.00 0.02 0.00 0.00 57.03 56.36 2c91 h ASP 104 Cb 1.17 -0.01 -0.30 0.00 0.22 0.00 0.00 39.33 40.41 2c91 h ASP 104 CO 0.71 0.69 -0.50 -0.22 -1.72 0.00 0.00 179.24 178.21 2c91 s LEU 105 N -7.57 0.36 -0.17 1.55 2.96 -1.01 -0.81 118.68 113.99 2c91 s LEU 105 Ca -0.02 0.51 0.01 0.00 -0.22 0.00 0.00 54.13 54.42 2c91 s LEU 105 Cb 0.12 0.70 0.02 0.00 0.50 0.00 0.00 46.19 47.54 2c91 s LEU 105 CO 0.77 -0.17 -0.16 0.12 -1.32 0.00 0.00 176.35 175.60 2c91 s PHE 106 N 1.37 2.45 0.05 5.38 5.36 0.11 -1.52 117.98 131.18 2c91 s PHE 106 Ca -0.08 -1.45 0.02 0.00 -0.96 0.00 0.00 56.93 54.46 2c91 s PHE 106 Cb -0.11 -1.73 -0.04 0.00 -0.34 0.00 0.00 43.02 40.81 2c91 s PHE 106 CO -0.08 -0.73 0.09 0.71 -1.46 0.00 0.00 175.22 173.74 2c91 s TYR 107 N 1.40 3.23 -0.42 10.12 2.02 -0.10 -0.25 117.35 133.35 2c91 s TYR 107 Ca 0.04 0.12 -0.28 0.00 -0.37 0.00 0.00 57.07 56.58 2c91 s TYR 107 Cb -0.13 -1.66 0.02 0.00 -0.40 0.00 0.00 41.96 39.79 2c91 s TYR 107 CO -0.11 0.53 1.06 -0.51 -1.57 0.00 0.00 175.55 174.96 2c91 s LEU 108 N -2.20 3.81 0.22 -1.29 1.43 -0.83 -1.08 118.68 118.74 2c91 s LEU 108 Ca 0.28 0.61 -0.03 0.00 -1.03 0.00 0.00 54.13 53.95 2c91 s LEU 108 Cb -0.12 -3.46 0.20 0.00 0.03 0.00 0.00 46.19 42.83 2c91 s LEU 108 CO 0.20 -1.07 1.62 -0.74 0.23 0.00 0.00 176.35 176.59 2c91 h HIS 109 N 8.78 0.81 -2.30 0.29 2.76 -1.05 -1.36 115.15 123.08 2c91 h HIS 109 Ca -0.22 -0.20 0.03 0.00 -2.20 0.00 0.00 60.37 57.77 2c91 h HIS 109 Cb 1.06 -0.19 -0.17 0.00 1.55 0.00 0.00 27.41 29.67 2c91 h HIS 109 CO 0.90 0.91 0.35 0.00 -1.30 0.00 0.00 177.93 178.79 2c91 s ALA 110 N -4.49 -1.77 0.60 5.26 0.00 -1.22 -4.20 121.76 115.94 2c91 s ALA 110 Ca -0.09 1.03 -0.19 0.00 0.00 0.00 0.00 51.96 52.71 2c91 s ALA 110 Cb 0.13 0.26 -0.03 0.00 0.00 0.00 0.00 23.12 23.48 2c91 s ALA 110 CO 0.83 -0.57 1.27 -2.14 0.00 0.00 0.00 175.76 175.15 2c91 s PRO 111 N -2.51 2.89 -0.49 0.00 0.02 -1.26 -4.59 135.00 129.06 2c91 s PRO 111 Ca -0.01 1.99 -0.07 0.00 0.02 0.00 0.00 61.00 62.93 2c91 s PRO 111 Cb -0.01 -1.98 0.13 0.00 0.02 0.00 0.00 34.50 32.66 2c91 s PRO 111 CO -0.04 -1.31 0.34 0.34 -0.33 0.00 0.00 177.00 175.99 2c91 s ASP 112 N -1.38 5.59 0.00 2.53 2.15 -1.26 -4.87 116.67 119.43 2c91 s ASP 112 Ca 0.78 -2.08 0.18 0.00 0.43 0.00 0.00 52.55 51.86 2c91 s ASP 112 Cb -0.35 -1.96 0.80 0.00 -0.30 0.00 0.00 42.92 41.11 2c91 s ASP 112 CO 0.38 -0.62 1.56 1.41 -0.17 0.00 0.00 175.17 177.73 2c91 n HIS 113 N 4.64 0.00 1.05 -5.34 8.25 -1.26 -2.22 115.22 120.34 2c91 n HIS 113 Ca -0.04 0.00 0.11 0.00 -0.26 0.00 0.00 57.72 57.53 2c91 n HIS 113 Cb 0.41 -0.44 0.07 0.00 1.12 0.00 0.00 29.99 31.15 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 -1.44 1.29 -4.15 0.41 7.64 -1.26 -4.81 113.62 111.31 2c91 n SER 114 Ca 0.06 -1.05 -0.33 0.00 1.01 0.00 0.00 58.87 58.55 2c91 n SER 114 Cb 0.19 0.55 -0.16 0.00 -1.01 0.00 0.00 64.21 63.78 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 -2.73 2.26 0.18 0.44 2.01 -0.94 -5.09 115.64 111.77 2c91 s THR 115 Ca 0.15 -0.90 -0.33 0.00 0.31 0.00 0.00 61.69 60.92 2c91 s THR 115 Cb 0.18 -1.97 -0.15 0.00 0.01 0.00 0.00 72.50 70.56 2c91 s THR 115 CO 0.68 0.50 1.29 -2.65 -0.69 0.00 0.00 174.62 173.75 2c91 n PRO 116 N 4.64 1.47 0.21 4.92 -0.02 -1.26 -4.85 135.00 140.11 2c91 n PRO 116 Ca -0.20 0.53 0.06 0.00 -2.02 0.00 0.00 63.50 61.86 2c91 n PRO 116 Cb 0.50 -2.11 0.45 0.00 -0.02 0.00 0.00 33.50 32.31 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 2.95 0.99 -1.00 -1.45 3.04 -1.97 -2.09 116.25 116.72 2c91 h VAL 117 Ca -0.44 -1.14 0.04 0.00 -1.01 0.00 0.00 66.70 64.14 2c91 h VAL 117 Cb 1.32 1.66 -0.06 0.00 -2.01 0.00 0.00 31.29 32.20 2c91 h VAL 117 CO 0.74 0.30 0.65 -0.33 -1.01 0.00 0.00 177.57 177.93 2c91 h GLU 118 N 0.00 1.23 0.12 4.17 3.07 -1.99 0.22 114.58 121.41 2c91 h GLU 118 Ca -0.00 -0.07 0.01 0.00 -0.50 0.00 0.00 59.36 58.79 2c91 h GLU 118 Cb 0.63 -0.28 -0.01 0.00 -0.84 0.00 0.00 28.75 28.25 2c91 h GLU 118 CO 0.04 0.81 -0.14 0.93 -1.40 0.00 0.00 179.01 179.25 2c91 h GLU 119 N 1.27 -0.29 -0.26 2.33 5.08 -1.74 -0.23 114.58 120.74 2c91 h GLU 119 Ca 0.39 0.02 0.01 0.00 -1.00 0.00 0.00 59.36 58.78 2c91 h GLU 119 Cb -0.01 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 2c91 h GLU 119 CO -0.12 -0.19 0.16 1.15 -1.00 0.00 0.00 179.01 179.01 2c91 h THR 120 N -0.30 1.05 -0.62 1.13 2.02 -1.43 -2.56 112.91 112.20 2c91 h THR 120 Ca 0.01 -0.12 -0.07 0.00 0.77 0.00 0.00 66.41 67.01 2c91 h THR 120 Cb 0.29 0.69 -0.03 0.00 -1.74 0.00 0.00 68.15 67.36 2c91 h THR 120 CO -0.05 0.06 0.12 -0.07 0.37 0.00 0.00 175.52 175.96 2c91 h LEU 121 N 0.34 0.94 -0.56 2.58 3.38 -0.41 -1.51 115.31 120.07 2c91 h LEU 121 Ca 0.10 -0.20 0.02 0.00 0.09 0.00 0.00 57.88 57.89 2c91 h LEU 121 Cb -0.03 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.44 2c91 h LEU 121 CO -0.03 0.93 0.35 0.00 0.09 0.00 0.00 178.44 179.77 2c91 h ALA 123 N 1.24 1.02 -0.65 0.00 0.00 -1.05 -1.91 119.26 117.90 2c91 h ALA 123 Ca 0.22 -0.21 0.04 0.00 0.00 0.00 0.00 54.91 54.96 2c91 h ALA 123 Cb -0.00 -0.30 -0.05 0.00 0.00 0.00 0.00 17.79 17.44 2c91 h ALA 123 CO -0.09 0.67 0.38 0.00 0.00 0.00 0.00 179.25 180.21 2c91 h HIS 125 N 0.71 0.23 -0.38 0.00 6.17 -0.80 -1.73 115.15 119.35 2c91 h HIS 125 Ca 0.28 0.01 0.05 0.00 0.71 0.00 0.00 60.37 61.41 2c91 h HIS 125 Cb 0.11 -0.08 -0.05 0.00 2.52 0.00 0.00 27.41 29.92 2c91 h HIS 125 CO -0.07 0.14 0.10 0.37 0.71 0.00 0.00 177.93 179.19 2c91 h GLN 126 N 0.25 0.24 -0.39 5.26 5.75 -1.09 -0.19 115.11 124.94 2c91 h GLN 126 Ca 0.07 -0.01 -0.03 0.00 -0.15 0.00 0.00 58.65 58.52 2c91 h GLN 126 Cb -0.02 -0.05 -0.02 0.00 1.07 0.00 0.00 27.48 28.45 2c91 h GLN 126 CO -0.02 0.16 0.11 -0.07 -2.65 0.00 0.00 178.83 176.35 2c91 h LEU 127 N 0.24 0.52 -0.07 -2.39 3.38 -1.07 -1.01 115.31 114.91 2c91 h LEU 127 Ca 0.18 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 58.08 2c91 h LEU 127 Cb 0.19 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.80 2c91 h LEU 127 CO -0.21 0.52 0.03 -0.74 0.09 0.00 0.00 178.44 178.13 2c91 h HIS 128 N 0.56 0.11 -0.22 1.13 2.76 -0.84 -2.16 115.15 116.50 2c91 h HIS 128 Ca 0.13 -0.01 0.02 0.00 -2.20 0.00 0.00 60.37 58.32 2c91 h HIS 128 Cb 0.20 -0.03 -0.01 0.00 1.55 0.00 0.00 27.41 29.11 2c91 h HIS 128 CO 0.01 0.20 0.15 1.96 -1.30 0.00 0.00 177.93 178.95 2c91 h GLN 129 N -0.02 0.19 0.00 5.26 1.08 -0.45 0.41 115.11 121.59 2c91 h GLN 129 Ca 0.03 -0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.21 2c91 h GLN 129 Cb 0.14 -0.04 0.00 0.00 -0.05 0.00 0.00 27.48 27.52 2c91 h GLN 129 CO -0.00 0.13 0.00 0.39 -0.95 0.00 0.00 178.83 178.39 2c91 n GLU 130 N -4.50 0.33 -0.84 1.46 1.02 -0.44 -4.89 120.64 112.78 2c91 n GLU 130 Ca 0.01 0.07 0.00 0.00 -0.02 0.00 0.00 57.16 57.22 2c91 n GLU 130 Cb 0.15 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.07 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 0.70 0.51 0.19 0.62 0.00 0.13 -4.96 105.19 102.38 2c91 n GLY 131 Ca 0.11 -0.62 0.11 0.00 0.00 0.00 0.00 46.02 45.62 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 0.48 0.00 -3.30 1.61 1.57 -1.57 -3.42 116.57 111.95 2c91 h LYS 132 Ca 0.00 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.68 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 0.04 -0.27 -0.59 -0.57 0.00 0.00 179.45 178.06 2c91 s PHE 133 N -3.22 -0.09 -0.11 -1.35 -0.71 -1.26 -1.80 117.98 109.43 2c91 s PHE 133 Ca 0.05 -0.02 -0.06 0.00 -1.04 0.00 0.00 56.93 55.86 2c91 s PHE 133 Cb 0.06 0.08 -0.02 0.00 -1.21 0.00 0.00 43.02 41.93 2c91 s PHE 133 CO 0.71 -0.48 -0.11 0.28 -1.34 0.00 0.00 175.22 174.28 2c91 h VAL 134 N 3.35 0.00 -3.57 -2.49 2.07 -1.25 -3.43 116.25 110.94 2c91 h VAL 134 Ca -0.31 -0.86 -0.67 0.00 0.82 0.00 0.00 66.70 65.68 2c91 h VAL 134 Cb 1.19 0.00 -0.16 0.00 -1.52 0.00 0.00 31.29 30.80 2c91 h VAL 134 CO 0.45 0.00 -0.72 -1.61 0.02 0.00 0.00 177.57 175.71 2c91 s GLU 135 N -1.89 2.34 -0.03 1.57 2.02 0.01 -5.01 118.70 117.70 2c91 s GLU 135 Ca -0.09 -0.89 -0.17 0.00 0.02 0.00 0.00 54.97 53.85 2c91 s GLU 135 Cb 0.01 -2.40 -0.05 0.00 0.10 0.00 0.00 34.13 31.79 2c91 s GLU 135 CO 0.13 0.55 0.45 -1.17 0.02 0.00 0.00 175.26 175.24 2c91 s LEU 136 N -1.89 4.41 0.22 1.80 2.96 -1.26 -0.71 118.68 124.20 2c91 s LEU 136 Ca 0.20 0.94 0.09 0.00 -0.22 0.00 0.00 54.13 55.15 2c91 s LEU 136 Cb -0.11 -2.66 -0.05 0.00 0.50 0.00 0.00 46.19 43.87 2c91 s LEU 136 CO 0.12 0.20 -0.17 -0.83 -1.32 0.00 0.00 176.35 174.35 2c91 s GLY 137 N -0.44 1.56 0.12 7.98 0.00 0.65 -0.96 107.32 116.22 2c91 s GLY 137 Ca 0.25 -1.70 0.09 0.00 0.00 0.00 0.00 44.72 43.36 2c91 s GLY 137 CO 0.13 -1.79 -0.23 1.08 0.00 0.00 0.00 173.10 172.30 2c91 s LEU 138 N -3.27 2.32 -0.02 0.66 1.43 -0.23 -1.96 118.68 117.60 2c91 s LEU 138 Ca 0.24 -0.72 -0.01 0.00 -1.03 0.00 0.00 54.13 52.60 2c91 s LEU 138 Cb -0.03 -0.99 0.01 0.00 0.03 0.00 0.00 46.19 45.21 2c91 s LEU 138 CO 0.09 0.09 0.04 -0.55 0.23 0.00 0.00 176.35 176.25 2c91 s SER 139 N -2.02 -0.03 -1.37 2.29 0.15 -0.51 -0.53 113.70 111.68 2c91 s SER 139 Ca 0.10 0.08 0.00 0.00 0.70 0.00 0.00 55.95 56.83 2c91 s SER 139 Cb -0.10 0.06 0.00 0.00 -1.71 0.00 0.00 66.02 64.28 2c91 s SER 139 CO 0.05 -0.03 0.00 0.59 1.20 0.00 0.00 173.24 175.05 2c91 n ASN 140 N 3.26 -4.67 -4.85 5.45 3.02 -1.25 -3.45 115.26 112.78 2c91 n ASN 140 Ca -0.15 0.32 -0.34 0.00 -0.03 0.00 0.00 54.58 54.38 2c91 n ASN 140 Cb 0.58 -3.30 -0.06 0.00 -0.61 0.00 0.00 39.78 36.39 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 -2.44 3.52 0.72 3.10 1.51 -1.26 -0.92 117.35 121.57 2c91 s TYR 141 Ca 0.00 1.01 -0.12 0.00 -1.01 0.00 0.00 57.07 56.95 2c91 s TYR 141 Cb 0.00 -2.35 0.03 0.00 -0.11 0.00 0.00 41.96 39.53 2c91 s TYR 141 CO 0.00 0.33 1.09 0.00 -1.11 0.00 0.00 175.55 175.86 2c91 s ALA 142 N -1.65 2.40 0.25 3.71 0.00 -1.26 -4.73 121.76 120.49 2c91 s ALA 142 Ca 0.43 0.32 -0.03 0.00 0.00 0.00 0.00 51.96 52.69 2c91 s ALA 142 Cb -0.13 -3.27 0.50 0.00 0.00 0.00 0.00 23.12 20.22 2c91 s ALA 142 CO 0.20 -1.50 1.74 0.66 0.00 0.00 0.00 175.76 176.86 2c91 h SER 143 N -0.66 0.38 0.41 0.00 4.64 -1.93 0.84 113.55 117.23 2c91 h SER 143 Ca -0.45 0.10 -0.07 0.00 -0.47 0.00 0.00 61.79 60.91 2c91 h SER 143 Cb 1.23 0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 63.37 2c91 h SER 143 CO 0.53 0.15 -0.33 4.11 -0.87 0.00 0.00 176.83 180.42 2c91 h TRP 144 N 0.51 0.00 0.02 4.77 5.08 -1.94 -1.28 115.95 123.12 2c91 h TRP 144 Ca 0.44 0.00 -0.23 0.00 1.08 0.00 0.00 58.89 60.18 2c91 h TRP 144 Cb 0.66 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.82 2c91 h TRP 144 CO -0.13 0.33 -0.98 0.93 -1.28 0.00 0.00 178.44 177.30 2c91 h GLU 145 N 0.00 0.36 -0.34 0.12 5.08 -1.27 -1.70 114.58 116.84 2c91 h GLU 145 Ca -0.00 -0.42 0.02 0.00 -1.00 0.00 0.00 59.36 57.96 2c91 h GLU 145 Cb 0.62 0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.97 2c91 h GLU 145 CO 0.04 1.10 0.18 0.28 -1.00 0.00 0.00 179.01 179.62 2c91 h VAL 146 N 0.19 1.00 -0.50 3.13 2.07 -0.74 -2.17 116.25 119.23 2c91 h VAL 146 Ca -0.08 -0.13 0.01 0.00 0.82 0.00 0.00 66.70 67.32 2c91 h VAL 146 Cb 1.63 0.60 -0.03 0.00 -1.52 0.00 0.00 31.29 31.98 2c91 h VAL 146 CO 0.17 0.07 0.33 0.00 0.02 0.00 0.00 177.57 178.15 2c91 h ALA 147 N 1.17 0.63 -0.79 1.67 0.00 -1.11 -0.64 119.26 120.19 2c91 h ALA 147 Ca 0.14 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 2c91 h ALA 147 Cb 0.03 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.59 2c91 h ALA 147 CO -0.08 0.06 0.44 1.49 0.00 0.00 0.00 179.25 181.16 2c91 h GLU 148 N 0.66 1.09 -0.04 0.00 4.81 -1.22 -0.93 114.58 118.94 2c91 h GLU 148 Ca 0.18 -0.12 -0.01 0.00 -0.13 0.00 0.00 59.36 59.29 2c91 h GLU 148 Cb -0.07 -0.22 -0.00 0.00 0.63 0.00 0.00 28.75 29.09 2c91 h GLU 148 CO -0.05 0.79 -0.00 0.82 -0.73 0.00 0.00 179.01 179.84 2c91 h ILE 149 N 1.08 1.26 -0.76 2.32 2.04 -0.97 -0.15 117.51 122.33 2c91 h ILE 149 Ca 0.28 -0.80 0.00 0.00 1.00 0.00 0.00 64.86 65.34 2c91 h ILE 149 Cb 0.01 1.72 -0.04 0.00 -0.74 0.00 0.00 36.82 37.77 2c91 h ILE 149 CO -0.05 0.22 0.48 0.00 0.00 0.00 0.00 178.15 178.80 2c91 h THR 151 N 1.03 1.25 -0.39 0.00 2.02 -1.07 -1.34 112.91 114.41 2c91 h THR 151 Ca 0.27 -0.90 -0.01 0.00 0.77 0.00 0.00 66.41 66.54 2c91 h THR 151 Cb -0.07 0.82 -0.02 0.00 -1.74 0.00 0.00 68.15 67.14 2c91 h THR 151 CO -0.06 0.33 0.22 -0.07 0.37 0.00 0.00 175.52 176.32 2c91 h LEU 152 N 0.75 0.48 -0.76 2.58 3.38 -0.73 -2.43 115.31 118.58 2c91 h LEU 152 Ca 0.16 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 2c91 h LEU 152 Cb 0.37 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 40.96 2c91 h LEU 152 CO 0.01 0.41 0.44 0.00 0.09 0.00 0.00 178.44 179.38 2c91 h LYS 154 N 1.04 0.14 0.00 0.00 3.64 -1.14 -0.47 116.57 119.77 2c91 h LYS 154 Ca 0.27 -0.01 -0.07 0.00 -1.27 0.00 0.00 60.65 59.57 2c91 h LYS 154 Cb -0.00 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 31.78 2c91 h LYS 154 CO -0.05 0.09 -0.33 0.66 -2.27 0.00 0.00 179.45 177.55 2c91 h SER 155 N 0.14 0.00 -0.31 4.20 4.64 -1.30 -3.11 113.55 117.81 2c91 h SER 155 Ca 0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 2c91 h SER 155 Cb 0.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.11 2c91 h SER 155 CO -0.05 0.33 0.00 0.59 -0.87 0.00 0.00 176.83 176.83 2c91 n ASN 156 N -3.50 3.25 -2.36 4.97 3.02 -0.54 -4.98 115.26 115.13 2c91 n ASN 156 Ca -0.00 -1.97 -0.19 0.00 -0.03 0.00 0.00 54.58 52.39 2c91 n ASN 156 Cb 0.49 -0.20 0.01 0.00 -0.61 0.00 0.00 39.78 39.48 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 1.46 -0.37 3.91 7.41 0.00 -0.67 -5.02 105.19 111.91 2c91 n GLY 157 Ca 0.18 -0.06 -0.29 0.00 0.00 0.00 0.00 46.02 45.86 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 -3.00 3.48 0.19 1.61 0.51 -0.28 -5.04 118.94 116.41 2c91 s TRP 158 Ca 0.13 0.45 -0.33 0.00 -2.12 0.00 0.00 56.10 54.23 2c91 s TRP 158 Cb -0.06 -1.93 -0.13 0.00 -0.81 0.00 0.00 33.47 30.54 2c91 s TRP 158 CO 0.16 0.38 1.60 1.51 -0.51 0.00 0.00 176.95 180.09 2c91 n ILE 159 N -0.39 0.17 -2.84 2.03 3.06 -1.26 -4.48 119.36 115.64 2c91 n ILE 159 Ca -0.03 -0.04 -0.33 0.00 -2.50 0.00 0.00 62.75 59.84 2c91 n ILE 159 Cb 0.53 -1.68 -0.07 0.00 0.54 0.00 0.00 39.64 38.97 2c91 n ILE 159 CO 0.00 0.00 0.00 -0.76 -2.50 0.00 0.00 176.55 173.29 2c91 s LEU 160 N 0.80 3.94 0.26 9.51 1.43 -1.26 -4.92 118.68 128.45 2c91 s LEU 160 Ca 0.76 1.62 -0.29 0.00 -1.03 0.00 0.00 54.13 55.19 2c91 s LEU 160 Cb -0.62 -4.47 -0.09 0.00 0.03 0.00 0.00 46.19 41.04 2c91 s LEU 160 CO 0.38 -0.35 1.22 -2.16 0.23 0.00 0.00 176.35 175.67 2c91 s PRO 161 N -3.20 4.48 0.00 1.29 0.04 -1.26 -4.47 135.00 131.87 2c91 s PRO 161 Ca 0.61 1.99 0.03 0.00 0.04 0.00 0.00 61.00 63.67 2c91 s PRO 161 Cb -0.09 -3.16 0.00 0.00 0.04 0.00 0.00 34.50 31.29 2c91 s PRO 161 CO 0.15 -0.05 0.38 0.25 0.04 0.00 0.00 177.00 177.77 2c91 n THR 162 N 1.56 0.00 -4.53 1.26 -2.24 -0.14 -4.76 114.28 105.44 2c91 n THR 162 Ca 0.02 -0.48 -0.21 0.00 -2.27 0.00 0.00 64.05 61.11 2c91 n THR 162 Cb 0.43 1.03 -0.15 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 -0.64 0.98 -0.11 2.28 1.01 -1.21 -1.24 120.40 121.47 2c91 s VAL 163 Ca 0.02 -0.57 0.04 0.00 0.00 0.00 0.00 61.98 61.47 2c91 s VAL 163 Cb 0.02 -0.83 0.00 0.00 0.00 0.00 0.00 36.38 35.58 2c91 s VAL 163 CO 0.06 0.24 -0.23 -0.47 0.00 0.00 0.00 175.10 174.70 2c91 s TYR 164 N -0.35 2.59 -0.29 5.22 6.14 -0.53 -1.07 117.35 129.07 2c91 s TYR 164 Ca 0.04 -1.12 -0.07 0.00 0.64 0.00 0.00 57.07 56.55 2c91 s TYR 164 Cb -0.05 -1.74 -0.00 0.00 0.42 0.00 0.00 41.96 40.59 2c91 s TYR 164 CO -0.00 -0.47 0.09 -1.14 0.64 0.00 0.00 175.55 174.67 2c91 s GLN 165 N 0.46 3.29 0.09 4.97 0.74 0.31 -0.17 119.66 129.36 2c91 s GLN 165 Ca -0.16 -0.73 0.03 0.00 0.05 0.00 0.00 55.36 54.55 2c91 s GLN 165 Cb -0.17 -3.39 -0.04 0.00 1.10 0.00 0.00 33.01 30.51 2c91 s GLN 165 CO 0.06 -0.37 -0.09 0.20 -0.55 0.00 0.00 175.29 174.54 2c91 s GLY 166 N 1.55 0.79 -0.12 2.59 0.00 -0.08 -3.78 107.32 108.27 2c91 s GLY 166 Ca 0.04 -1.20 -0.29 0.00 0.00 0.00 0.00 44.72 43.27 2c91 s GLY 166 CO 0.03 -1.28 1.52 -0.29 0.00 0.00 0.00 173.10 173.08 2c91 s MET 167 N -3.00 4.12 -0.25 2.90 1.75 -1.26 -0.68 119.30 122.89 2c91 s MET 167 Ca 0.06 1.91 -0.13 0.00 -1.25 0.00 0.00 55.69 56.28 2c91 s MET 167 Cb -0.01 -3.92 0.09 0.00 2.84 0.00 0.00 34.83 33.82 2c91 s MET 167 CO -0.01 -0.89 0.60 -0.47 -0.65 0.00 0.00 175.02 173.59 2c91 s TYR 168 N 4.09 -0.99 0.36 4.11 5.04 -1.05 -4.68 117.35 124.23 2c91 s TYR 168 Ca 0.67 1.93 -0.17 0.00 -2.44 0.00 0.00 57.07 57.07 2c91 s TYR 168 Cb -0.28 0.56 0.05 0.00 0.35 0.00 0.00 41.96 42.64 2c91 s TYR 168 CO 0.25 -0.51 0.76 0.54 -1.34 0.00 0.00 175.55 175.25 2c91 s ASN 169 N 1.91 -0.03 0.46 4.32 2.20 -0.87 -4.11 114.94 118.82 2c91 s ASN 169 Ca -0.08 -1.04 0.23 0.00 -0.94 0.00 0.00 52.86 51.03 2c91 s ASN 169 Cb -0.08 0.82 1.24 0.00 -2.00 0.00 0.00 41.25 41.23 2c91 s ASN 169 CO -0.18 -1.60 1.85 0.00 -2.94 0.00 0.00 177.10 174.23 2c91 h ALA 170 N 2.01 2.46 -0.27 3.54 0.00 -1.84 -1.41 119.26 123.75 2c91 h ALA 170 Ca -0.29 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.62 2c91 h ALA 170 Cb 1.25 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.06 2c91 h ALA 170 CO 0.37 -0.76 0.00 0.25 0.00 0.00 0.00 179.25 179.11 2c91 n THR 171 N -4.43 0.84 -3.49 0.00 -2.24 -1.26 -4.51 114.28 99.20 2c91 n THR 171 Ca 0.20 -0.92 -0.29 0.00 -2.27 0.00 0.00 64.05 60.77 2c91 n THR 171 Cb 0.83 0.61 -0.12 0.00 -2.10 0.00 0.00 70.33 69.55 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 -0.97 0.21 -0.08 4.28 2.01 -0.53 -4.83 115.64 115.72 2c91 s THR 172 Ca 0.19 -1.70 0.12 0.00 0.31 0.00 0.00 61.69 60.62 2c91 s THR 172 Cb 0.10 -1.17 0.19 0.00 0.01 0.00 0.00 72.50 71.64 2c91 s THR 172 CO 0.14 -0.96 1.10 0.54 -0.69 0.00 0.00 174.62 174.74 2c91 n ARG 173 N 4.10 0.80 0.05 4.92 1.74 -1.26 -2.06 116.66 124.95 2c91 n ARG 173 Ca 0.10 -2.02 0.09 0.00 -0.77 0.00 0.00 57.85 55.25 2c91 n ARG 173 Cb 0.37 -1.11 0.53 0.00 -1.02 0.00 0.00 32.46 31.23 2c91 n ARG 173 CO 0.00 0.00 0.00 0.37 -1.52 0.00 0.00 177.63 176.48 2c91 h GLN 174 N 0.05 0.30 -0.09 5.56 4.15 -1.89 -1.87 115.11 121.31 2c91 h GLN 174 Ca -0.00 -0.02 0.03 0.00 0.77 0.00 0.00 58.65 59.42 2c91 h GLN 174 Cb 1.16 -0.07 -0.00 0.00 0.21 0.00 0.00 27.48 28.78 2c91 h GLN 174 CO 0.00 0.20 0.14 -0.39 -1.93 0.00 0.00 178.83 176.85 2c91 h VAL 175 N 0.31 0.31 -0.68 2.39 -1.51 -1.87 -3.25 116.25 111.96 2c91 h VAL 175 Ca 0.15 0.00 -0.08 0.00 -1.23 0.00 0.00 66.70 65.54 2c91 h VAL 175 Cb 0.22 0.88 -0.03 0.00 -2.13 0.00 0.00 31.29 30.23 2c91 h VAL 175 CO -0.03 0.00 0.12 -0.33 -1.23 0.00 0.00 177.57 176.09 2c91 h GLU 176 N 0.00 1.12 -0.04 5.19 5.08 -1.73 -0.97 114.58 123.23 2c91 h GLU 176 Ca 0.04 -0.29 -0.00 0.00 -1.00 0.00 0.00 59.36 58.10 2c91 h GLU 176 Cb 0.33 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 29.44 2c91 h GLU 176 CO -0.00 1.01 0.01 0.00 -1.00 0.00 0.00 179.01 179.03 2c91 h ALA 177 N 1.07 0.05 0.00 3.43 0.00 -1.78 -3.39 119.26 118.64 2c91 h ALA 177 Ca 0.21 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2c91 h ALA 177 Cb 0.44 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.21 2c91 h ALA 177 CO 0.01 -0.32 -0.79 0.39 0.00 0.00 0.00 179.25 178.54 2c91 n GLU 178 N -4.93 0.46 0.15 0.00 1.02 -1.25 -4.73 120.64 111.36 2c91 n GLU 178 Ca -0.07 0.00 -0.14 0.00 -0.02 0.00 0.00 57.16 56.93 2c91 n GLU 178 Cb 0.15 -0.90 -0.08 0.00 -0.02 0.00 0.00 31.44 30.59 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 -0.30 -0.22 -4.62 5.85 -1.64 -2.60 115.31 111.77 2c91 h LEU 179 Ca 0.00 -0.12 0.05 0.00 0.84 0.00 0.00 57.88 58.65 2c91 h LEU 179 Cb 0.79 0.08 -0.05 0.00 0.37 0.00 0.00 40.66 41.86 2c91 h LEU 179 CO 0.00 -0.05 -0.09 -0.07 -0.34 0.00 0.00 178.44 177.89 2c91 h LEU 180 N -0.55 -0.30 -1.30 2.25 4.07 -1.39 -1.03 115.31 117.04 2c91 h LEU 180 Ca -0.04 0.08 0.05 0.00 0.08 0.00 0.00 57.88 58.06 2c91 h LEU 180 Cb 0.41 0.18 -0.05 0.00 1.08 0.00 0.00 40.66 42.28 2c91 h LEU 180 CO 0.06 -0.12 0.51 -0.65 -1.08 0.00 0.00 178.44 177.16 2c91 h PRO 181 N -0.05 0.84 -0.38 1.13 0.11 -1.77 -0.66 132.00 131.22 2c91 h PRO 181 Ca 0.12 -0.05 0.01 0.00 0.11 0.00 0.00 66.00 66.18 2c91 h PRO 181 Cb 0.23 -0.19 -0.02 0.00 0.11 0.00 0.00 31.00 31.13 2c91 h PRO 181 CO -0.26 0.56 0.24 0.00 -0.21 0.00 0.00 178.00 178.33 2c91 h LEU 183 N 0.49 0.62 -0.71 0.00 3.38 -0.35 -2.16 115.31 116.58 2c91 h LEU 183 Ca 0.14 -0.30 -0.03 0.00 0.09 0.00 0.00 57.88 57.79 2c91 h LEU 183 Cb -0.03 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.51 2c91 h LEU 183 CO -0.05 0.99 0.33 0.03 0.09 0.00 0.00 178.44 179.83 2c91 h ARG 184 N 0.46 1.04 -0.83 1.13 3.08 -0.91 0.87 114.38 119.23 2c91 h ARG 184 Ca 0.03 -0.16 -0.04 0.00 0.07 0.00 0.00 59.98 59.88 2c91 h ARG 184 Cb 0.98 -0.18 -0.04 0.00 0.08 0.00 0.00 29.97 30.81 2c91 h ARG 184 CO 0.09 0.83 0.38 1.25 -1.07 0.00 0.00 179.97 181.45 2c91 h HIS 185 N 1.00 1.22 -0.01 3.04 2.76 -0.94 -3.22 115.15 119.01 2c91 h HIS 185 Ca 0.24 -0.07 0.00 0.00 -2.20 0.00 0.00 60.37 58.35 2c91 h HIS 185 Cb 0.14 -0.37 0.00 0.00 1.55 0.00 0.00 27.41 28.73 2c91 h HIS 185 CO 0.01 0.89 -0.54 1.19 -1.30 0.00 0.00 177.93 178.17 2c91 n PHE 186 N -4.30 0.00 -1.59 5.26 3.72 -0.84 -4.99 117.46 114.72 2c91 n PHE 186 Ca 0.08 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.48 2c91 n PHE 186 Cb 0.15 -0.06 0.00 0.00 -0.94 0.00 0.00 39.48 38.63 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 1.43 0.97 3.72 1.37 0.00 0.15 -5.04 105.19 107.79 2c91 n GLY 187 Ca 0.08 -0.47 -0.35 0.00 0.00 0.00 0.00 46.02 45.29 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 -0.56 3.74 0.43 0.99 1.02 -0.34 -4.81 118.68 119.15 2c91 s LEU 188 Ca 0.00 0.20 -0.08 0.00 0.02 0.00 0.00 54.13 54.27 2c91 s LEU 188 Cb 0.00 -1.89 -0.05 0.00 0.02 0.00 0.00 46.19 44.27 2c91 s LEU 188 CO 0.00 0.38 0.77 0.00 0.02 0.00 0.00 176.35 177.51 2c91 s ARG 189 N -0.97 3.67 -0.14 1.70 1.70 -0.37 -4.51 118.95 120.03 2c91 s ARG 189 Ca 0.14 0.34 0.01 0.00 -0.47 0.00 0.00 55.73 55.75 2c91 s ARG 189 Cb -0.11 -2.39 -0.00 0.00 -0.57 0.00 0.00 34.95 31.87 2c91 s ARG 189 CO 0.03 -0.10 -0.16 0.12 -1.08 0.00 0.00 175.30 174.11 2c91 s PHE 190 N -2.52 2.75 -0.21 5.89 5.36 -1.26 -1.46 117.98 126.54 2c91 s PHE 190 Ca 0.49 -0.99 -0.05 0.00 -0.96 0.00 0.00 56.93 55.43 2c91 s PHE 190 Cb -0.10 -1.85 -0.02 0.00 -0.34 0.00 0.00 43.02 40.70 2c91 s PHE 190 CO 0.37 -0.43 0.00 0.71 -1.46 0.00 0.00 175.22 174.42 2c91 s TYR 191 N 0.66 3.03 -0.25 10.12 1.51 0.76 -1.07 117.35 132.12 2c91 s TYR 191 Ca -0.08 -0.50 -0.20 0.00 -1.01 0.00 0.00 57.07 55.27 2c91 s TYR 191 Cb -0.16 -2.10 -0.02 0.00 -0.11 0.00 0.00 41.96 39.57 2c91 s TYR 191 CO 0.02 -0.28 0.61 0.00 -1.11 0.00 0.00 175.55 174.79 2c91 s ALA 192 N 1.10 3.60 0.48 3.71 0.00 -0.37 -0.90 121.76 129.38 2c91 s ALA 192 Ca 0.02 -0.44 0.06 0.00 0.00 0.00 0.00 51.96 51.60 2c91 s ALA 192 Cb -0.14 -3.00 0.03 0.00 0.00 0.00 0.00 23.12 20.00 2c91 s ALA 192 CO 0.01 -0.77 0.66 1.52 0.00 0.00 0.00 175.76 177.19 2c91 s TYR 193 N 2.40 2.66 -1.46 0.00 -0.85 0.15 -1.07 117.35 119.18 2c91 s TYR 193 Ca 0.26 -0.31 -0.08 0.00 -0.52 0.00 0.00 57.07 56.42 2c91 s TYR 193 Cb -0.16 -2.50 0.05 0.00 0.38 0.00 0.00 41.96 39.74 2c91 s TYR 193 CO 0.09 -0.66 0.76 0.09 -1.52 0.00 0.00 175.55 174.31 2c91 n ASN 194 N -2.06 -2.62 0.09 -0.18 5.03 -1.26 -2.52 115.26 111.75 2c91 n ASN 194 Ca 0.09 -0.87 0.11 0.00 0.87 0.00 0.00 54.58 54.78 2c91 n ASN 194 Cb 0.59 -3.63 0.44 0.00 -1.02 0.00 0.00 39.78 36.17 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 -4.47 0.14 -0.43 3.52 -0.04 -1.26 -1.32 135.00 131.15 2c91 n PRO 195 Ca -0.13 0.37 0.06 0.00 -0.04 0.00 0.00 63.50 63.76 2c91 n PRO 195 Cb 0.60 -1.77 0.20 0.00 -0.04 0.00 0.00 33.50 32.49 2c91 n PRO 195 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2c91 n LEU 196 N -2.04 3.35 -3.80 1.53 4.77 -1.26 -4.65 117.00 114.90 2c91 n LEU 196 Ca 0.03 -3.30 -0.25 0.00 -0.03 0.00 0.00 56.01 52.45 2c91 n LEU 196 Cb 0.22 -0.53 0.03 0.00 -2.33 0.00 0.00 43.42 40.81 2c91 n LEU 196 CO 0.18 0.89 0.01 0.00 -1.33 0.00 0.00 177.39 177.15 2c91 n ALA 197 N -1.00 -1.68 -1.07 -1.18 0.00 -0.43 -0.55 120.51 114.59 2c91 n ALA 197 Ca 0.22 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.64 2c91 n ALA 197 Cb 0.83 -3.12 -0.01 0.00 0.00 0.00 0.00 19.45 17.15 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 -1.65 0.43 0.00 0.00 0.00 -1.26 -1.89 105.19 100.82 2c91 n GLY 198 Ca -0.15 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.91 0.69 0.32 -0.02 0.00 0.28 -4.72 105.19 100.84 2c91 n GLY 199 Ca -0.02 0.00 0.03 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 0.62 -0.66 0.99 5.85 -0.37 -2.19 115.31 119.54 2c91 h LEU 200 Ca 0.00 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.70 2c91 h LEU 200 Cb 0.00 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 40.88 2c91 h LEU 200 CO 0.00 0.45 0.00 0.18 -0.34 0.00 0.00 178.44 178.73 2c91 n LEU 201 N -4.46 0.92 0.15 2.25 4.77 -0.16 -2.12 117.00 118.36 2c91 n LEU 201 Ca 0.05 -0.46 0.13 0.00 -0.03 0.00 0.00 56.01 55.70 2c91 n LEU 201 Cb 0.05 -0.16 0.36 0.00 -2.33 0.00 0.00 43.42 41.34 2c91 n LEU 201 CO 0.36 0.21 0.87 0.71 -1.33 0.00 0.00 177.39 178.20 2c91 h THR 202 N 0.80 0.00 -0.20 -5.08 1.35 -1.61 -3.19 112.91 104.99 2c91 h THR 202 Ca 0.00 -0.61 -0.08 0.00 -0.55 0.00 0.00 66.41 65.17 2c91 h THR 202 Cb 0.28 1.58 -0.03 0.00 -1.73 0.00 0.00 68.15 68.24 2c91 h THR 202 CO 0.01 0.00 -0.08 0.61 -0.25 0.00 0.00 175.52 175.82 2c91 n GLY 203 N 1.02 0.59 0.00 5.82 0.00 -0.90 -4.08 105.19 107.63 2c91 n GLY 203 Ca 0.04 -0.16 0.12 0.00 0.00 0.00 0.00 46.02 46.03 2c91 n GLY 203 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2c91 n LYS 204 N -1.36 0.21 -4.40 1.61 2.85 -1.26 -4.86 118.16 110.95 2c91 n LYS 204 Ca -0.04 0.06 -0.26 0.00 -1.05 0.00 0.00 58.31 57.02 2c91 n LYS 204 Cb 0.33 -1.50 -0.09 0.00 -0.65 0.00 0.00 35.03 33.11 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 -2.75 2.55 0.02 5.58 2.02 -1.26 -5.14 117.35 118.37 2c91 s TYR 205 Ca 0.19 -0.60 -0.01 0.00 -0.37 0.00 0.00 57.07 56.28 2c91 s TYR 205 Cb 0.17 -1.80 -0.02 0.00 -0.40 0.00 0.00 41.96 39.91 2c91 s TYR 205 CO 0.41 0.36 -0.02 -1.59 -1.57 0.00 0.00 175.55 173.14 2c91 s LYS 206 N -3.78 0.36 0.39 -0.62 -2.85 -1.26 -5.06 119.74 106.93 2c91 s LYS 206 Ca 0.37 -0.69 0.15 0.00 -1.00 0.00 0.00 55.97 54.80 2c91 s LYS 206 Cb 0.06 0.13 1.00 0.00 -2.06 0.00 0.00 37.83 36.96 2c91 s LYS 206 CO 0.20 -0.06 1.85 -0.92 0.10 0.00 0.00 175.35 176.51 2c91 h TYR 207 N 4.41 0.65 0.00 1.78 5.03 -1.98 -1.04 116.97 125.82 2c91 h TYR 207 Ca -0.32 0.02 0.00 0.00 2.58 0.00 0.00 58.73 61.01 2c91 h TYR 207 Cb 1.20 -0.20 0.00 0.00 1.55 0.00 0.00 36.73 39.28 2c91 h TYR 207 CO 0.64 0.18 0.00 -0.85 -1.32 0.00 0.00 178.16 176.81 2c91 n GLU 208 N -4.55 0.14 -0.01 1.82 0.00 -1.26 -2.91 120.64 113.87 2c91 n GLU 208 Ca 0.19 0.00 0.24 0.00 0.00 0.00 0.00 57.16 57.59 2c91 n GLU 208 Cb 0.65 -1.50 0.70 0.00 0.00 0.00 0.00 31.44 31.29 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 0.59 -1.84 3.32 -1.57 -0.61 116.42 116.31 2c91 h ASP 209 Ca 0.00 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.00 2c91 h ASP 209 Cb 0.43 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.97 2c91 h ASP 209 CO 0.00 0.00 -0.23 0.07 -1.72 0.00 0.00 179.24 177.36 2c91 h LYS 210 N 0.00 0.00 0.00 3.56 2.10 -1.74 0.96 116.57 121.45 2c91 h LYS 210 Ca 0.29 0.00 -0.15 0.00 -2.00 0.00 0.00 60.65 58.79 2c91 h LYS 210 Cb 1.51 0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 32.81 2c91 h LYS 210 CO -0.00 0.23 -1.93 -0.25 -2.00 0.00 0.00 179.45 175.50 2c91 n ASP 211 N -3.62 0.25 0.00 7.07 8.00 -0.30 -4.81 116.55 123.14 2c91 n ASP 211 Ca -0.01 0.10 0.00 0.00 0.71 0.00 0.00 54.79 55.59 2c91 n ASP 211 Cb 0.36 1.18 0.00 0.00 -0.02 0.00 0.00 41.12 42.64 2c91 n ASP 211 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2c91 n GLY 212 N 1.44 0.66 0.28 0.44 0.00 -0.85 -4.92 105.19 102.24 2c91 n GLY 212 Ca -0.14 0.00 0.06 0.00 0.00 0.00 0.00 46.02 45.94 2c91 n GLY 212 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2c91 h LYS 213 N 0.00 0.34 -6.52 1.61 1.57 -1.80 -3.47 116.57 108.30 2c91 h LYS 213 Ca 0.00 -0.02 -0.50 0.00 -1.87 0.00 0.00 60.65 58.26 2c91 h LYS 213 Cb 0.00 -0.08 0.01 0.00 0.08 0.00 0.00 32.23 32.24 2c91 h LYS 213 CO 0.00 0.23 -0.95 1.04 -0.57 0.00 0.00 179.45 179.20 2c91 n GLN 214 N -5.08 -1.53 -1.90 3.15 6.02 0.32 -4.81 117.38 113.56 2c91 n GLN 214 Ca 0.15 0.33 -0.42 0.00 -0.01 0.00 0.00 57.00 57.05 2c91 n GLN 214 Cb 0.46 -3.82 -0.03 0.00 1.02 0.00 0.00 30.24 27.87 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 -6.57 4.19 0.29 -1.09 0.04 -1.26 -4.86 135.00 125.73 2c91 s PRO 215 Ca 0.32 2.38 -0.30 0.00 0.04 0.00 0.00 61.00 63.44 2c91 s PRO 215 Cb -0.14 -3.53 -0.13 0.00 0.04 0.00 0.00 34.50 30.74 2c91 s PRO 215 CO 0.90 -0.73 1.34 1.33 0.04 0.00 0.00 177.00 179.88 2c91 n VAL 216 N 4.62 1.46 -1.41 -0.36 0.24 -1.26 -4.21 118.33 117.42 2c91 n VAL 216 Ca 0.16 -0.37 0.00 0.00 -2.04 0.00 0.00 64.34 62.09 2c91 n VAL 216 Cb 0.40 -1.50 0.00 0.00 -1.47 0.00 0.00 33.84 31.26 2c91 n VAL 216 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2c91 n GLY 217 N 1.50 0.04 0.36 7.63 0.00 -0.95 -4.92 105.19 108.86 2c91 n GLY 217 Ca 0.08 -1.28 0.11 0.00 0.00 0.00 0.00 46.02 44.93 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 0.81 -0.01 1.61 9.65 -1.86 -2.64 114.38 121.94 2c91 h ARG 218 Ca 0.00 -0.05 0.00 0.00 -1.10 0.00 0.00 59.98 58.83 2c91 h ARG 218 Cb 0.00 -0.18 0.00 0.00 -1.39 0.00 0.00 29.97 28.40 2c91 h ARG 218 CO 0.00 0.54 -0.55 1.19 2.80 0.00 0.00 179.97 183.94 2c91 n PHE 219 N -4.66 0.00 -3.72 2.20 3.01 -1.26 -4.30 117.46 108.73 2c91 n PHE 219 Ca 0.21 0.00 -0.14 0.00 1.01 0.00 0.00 57.45 58.52 2c91 n PHE 219 Cb 0.48 -0.02 -0.14 0.00 -0.01 0.00 0.00 39.48 39.78 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 -2.59 -0.21 0.00 1.38 0.08 -1.00 -4.65 117.98 110.99 2c91 s PHE 220 Ca 0.17 0.59 0.00 0.00 0.12 0.00 0.00 56.93 57.81 2c91 s PHE 220 Cb 0.18 -0.11 0.00 0.00 -0.57 0.00 0.00 43.02 42.52 2c91 s PHE 220 CO 0.63 -0.22 0.00 0.41 -0.10 0.00 0.00 175.22 175.94 2c91 n GLY 221 N 4.58 0.58 3.74 4.36 0.00 -1.26 -2.23 105.19 114.95 2c91 n GLY 221 Ca -0.19 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.54 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 -1.91 4.23 0.51 1.61 2.20 -1.26 -5.04 114.94 115.28 2c91 s ASN 222 Ca 0.00 -1.35 0.30 0.00 -0.94 0.00 0.00 52.86 50.87 2c91 s ASN 222 Cb 0.00 -0.02 1.22 0.00 -2.00 0.00 0.00 41.25 40.44 2c91 s ASN 222 CO 0.00 -0.70 1.94 0.78 -2.94 0.00 0.00 177.10 176.18 2c91 h ASN 223 N 1.39 0.00 -0.05 3.54 4.21 -1.97 -2.24 115.58 120.45 2c91 h ASN 223 Ca -0.43 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.08 2c91 h ASN 223 Cb 1.28 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.48 2c91 h ASN 223 CO 0.72 0.09 0.00 0.79 -1.29 0.00 0.00 177.43 177.75 2c91 n TRP 224 N -3.24 0.03 -0.24 1.19 7.02 -1.26 -4.65 117.44 116.29 2c91 n TRP 224 Ca 0.00 -0.02 -0.01 0.00 -1.02 0.00 0.00 57.50 56.46 2c91 n TRP 224 Cb 0.34 0.00 0.11 0.00 -2.42 0.00 0.00 31.31 29.34 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 4.65 0.93 -0.68 6.99 0.00 -1.59 -1.12 119.26 128.44 2c91 h ALA 225 Ca 0.00 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 2c91 h ALA 225 Cb 0.93 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.57 2c91 h ALA 225 CO 0.00 0.05 0.32 1.49 0.00 0.00 0.00 179.25 181.11 2c91 h GLU 226 N 0.69 0.97 -0.40 0.00 4.57 -1.82 -0.56 114.58 118.03 2c91 h GLU 226 Ca 0.31 -0.13 -0.02 0.00 -1.18 0.00 0.00 59.36 58.34 2c91 h GLU 226 Cb 0.22 -0.18 -0.02 0.00 -0.16 0.00 0.00 28.75 28.61 2c91 h GLU 226 CO -0.20 0.76 0.18 1.15 -1.18 0.00 0.00 179.01 179.72 2c91 h THR 227 N 0.97 1.18 -0.93 0.32 2.02 -1.56 -1.40 112.91 113.50 2c91 h THR 227 Ca 0.24 -0.53 0.03 0.00 0.77 0.00 0.00 66.41 66.92 2c91 h THR 227 Cb 0.11 0.79 -0.05 0.00 -1.74 0.00 0.00 68.15 67.26 2c91 h THR 227 CO -0.03 0.20 0.61 1.88 0.37 0.00 0.00 175.52 178.55 2c91 h TYR 228 N 0.50 1.15 -0.43 3.16 -1.99 -0.97 -0.10 116.97 118.29 2c91 h TYR 228 Ca 0.14 0.03 -0.12 0.00 2.00 0.00 0.00 58.73 60.78 2c91 h TYR 228 Cb 0.14 -0.39 -0.01 0.00 2.00 0.00 0.00 36.73 38.47 2c91 h TYR 228 CO -0.01 0.69 -0.20 0.00 -0.00 0.00 0.00 178.16 178.64 2c91 h ARG 229 N 1.21 0.89 -0.01 4.88 3.08 -0.82 -1.44 114.38 122.17 2c91 h ARG 229 Ca 0.36 -0.39 -0.07 0.00 0.07 0.00 0.00 59.98 59.96 2c91 h ARG 229 Cb -0.05 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 29.96 2c91 h ARG 229 CO -0.10 1.03 -0.32 -0.91 -1.07 0.00 0.00 179.97 178.60 2c91 h ASN 230 N 0.72 0.01 -0.06 7.04 2.35 -1.06 0.17 115.58 124.75 2c91 h ASN 230 Ca 0.10 -0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.79 2c91 h ASN 230 Cb 0.76 -0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.13 2c91 h ASN 230 CO 0.06 0.33 -0.18 -0.09 -1.65 0.00 0.00 177.43 175.91 2c91 h ARG 231 N 0.01 0.22 0.00 0.81 2.43 -0.51 -3.43 114.38 113.92 2c91 h ARG 231 Ca -0.00 -0.16 0.00 0.00 -0.81 0.00 0.00 59.98 59.01 2c91 h ARG 231 Cb 0.57 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.15 2c91 h ARG 231 CO 0.04 0.78 -0.43 1.19 -1.51 0.00 0.00 179.97 180.04 2c91 n PHE 232 N -4.58 0.00 -2.86 2.20 0.99 -0.59 -4.38 117.46 108.25 2c91 n PHE 232 Ca -0.08 0.00 -0.44 0.00 -0.00 0.00 0.00 57.45 56.93 2c91 n PHE 232 Cb 0.41 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 -0.82 4.65 -4.71 1.38 -0.00 0.58 -4.82 117.44 113.70 2c91 n TRP 233 Ca 0.00 -3.27 -0.24 0.00 -0.00 0.00 0.00 57.50 53.99 2c91 n TRP 233 Cb 0.00 -2.14 -0.15 0.00 -0.00 0.00 0.00 31.31 29.02 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 1.32 1.28 0.23 5.87 1.02 -1.26 -4.84 119.74 123.36 2c91 s LYS 234 Ca 0.42 -0.63 -0.06 0.00 0.02 0.00 0.00 55.97 55.72 2c91 s LYS 234 Cb -0.01 -1.26 0.41 0.00 -0.52 0.00 0.00 37.83 36.45 2c91 s LYS 234 CO 0.00 0.34 1.71 1.49 -0.92 0.00 0.00 175.35 177.97 2c91 h GLU 235 N 5.56 0.32 0.00 1.68 4.81 -1.98 -0.74 114.58 124.23 2c91 h GLU 235 Ca -0.37 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 58.82 2c91 h GLU 235 Cb 1.16 -0.07 -0.00 0.00 0.63 0.00 0.00 28.75 30.46 2c91 h GLU 235 CO 0.48 0.21 -0.10 0.45 -0.73 0.00 0.00 179.01 179.32 2c91 h HIS 236 N 0.33 0.00 -0.27 0.92 3.86 -1.97 -1.17 115.15 116.85 2c91 h HIS 236 Ca 0.38 0.00 -0.09 0.00 -1.16 0.00 0.00 60.37 59.50 2c91 h HIS 236 Cb 0.60 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.07 2c91 h HIS 236 CO -0.22 0.10 -0.20 1.25 0.86 0.00 0.00 177.93 179.72 2c91 h HIS 237 N 0.00 0.72 -0.52 2.45 -0.00 -1.47 -0.48 115.15 115.85 2c91 h HIS 237 Ca -0.00 -0.20 -0.02 0.00 -0.00 0.00 0.00 60.37 60.15 2c91 h HIS 237 Cb 0.19 -0.16 -0.02 0.00 -0.00 0.00 0.00 27.41 27.41 2c91 h HIS 237 CO 0.00 0.89 0.26 0.74 -0.00 0.00 0.00 177.93 179.82 2c91 h PHE 238 N 0.35 0.74 -0.58 5.26 -1.00 -0.95 -0.44 116.94 120.32 2c91 h PHE 238 Ca 0.05 -0.03 0.06 0.00 2.81 0.00 0.00 57.97 60.86 2c91 h PHE 238 Cb 0.74 -0.23 -0.05 0.00 3.61 0.00 0.00 35.95 40.02 2c91 h PHE 238 CO 0.07 0.57 0.29 0.93 -1.61 0.00 0.00 178.31 178.56 2c91 h GLU 239 N 0.69 0.54 -0.83 1.51 5.08 -1.10 -0.94 114.58 119.53 2c91 h GLU 239 Ca 0.18 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 2c91 h GLU 239 Cb 0.10 -0.12 -0.04 0.00 0.50 0.00 0.00 28.75 29.18 2c91 h GLU 239 CO -0.02 0.36 0.52 0.00 -1.00 0.00 0.00 179.01 178.86 2c91 h ALA 240 N 1.32 1.06 -0.59 3.43 0.00 -0.66 -1.70 119.26 122.12 2c91 h ALA 240 Ca 0.26 -0.08 -0.08 0.00 0.00 0.00 0.00 54.91 55.02 2c91 h ALA 240 Cb 0.19 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 2c91 h ALA 240 CO -0.19 0.50 0.07 0.82 0.00 0.00 0.00 179.25 180.45 2c91 h ILE 241 N 1.13 1.26 -0.67 0.00 2.04 -0.30 -2.42 117.51 118.55 2c91 h ILE 241 Ca 0.30 -1.03 -0.01 0.00 1.00 0.00 0.00 64.86 65.13 2c91 h ILE 241 Cb -0.08 0.77 -0.03 0.00 -0.74 0.00 0.00 36.82 36.74 2c91 h ILE 241 CO -0.06 0.38 0.38 0.00 0.00 0.00 0.00 178.15 178.85 2c91 h ALA 242 N 1.00 1.42 -0.55 1.87 0.00 -0.64 -0.70 119.26 121.66 2c91 h ALA 242 Ca 0.18 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 55.01 2c91 h ALA 242 Cb 0.45 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 2c91 h ALA 242 CO 0.02 0.49 0.35 1.25 0.00 0.00 0.00 179.25 181.36 2c91 h LEU 243 N 0.92 0.60 -0.32 0.00 7.12 -1.08 -1.52 115.31 121.04 2c91 h LEU 243 Ca 0.24 -0.01 -0.11 0.00 0.13 0.00 0.00 57.88 58.13 2c91 h LEU 243 Cb -0.01 -0.14 -0.01 0.00 -0.53 0.00 0.00 40.66 39.98 2c91 h LEU 243 CO -0.04 0.43 -0.25 0.58 -0.13 0.00 0.00 178.44 179.03 2c91 h VAL 244 N 0.72 1.29 -0.42 1.05 2.07 -0.91 -2.22 116.25 117.83 2c91 h VAL 244 Ca 0.21 -1.40 -0.00 0.00 0.82 0.00 0.00 66.70 66.33 2c91 h VAL 244 Cb -0.05 1.49 -0.02 0.00 -1.52 0.00 0.00 31.29 31.19 2c91 h VAL 244 CO -0.06 0.45 0.25 -0.33 0.02 0.00 0.00 177.57 177.90 2c91 h GLU 245 N 0.49 0.57 -0.39 1.57 5.08 -0.88 -0.13 114.58 120.88 2c91 h GLU 245 Ca 0.06 -0.05 -0.14 0.00 -1.00 0.00 0.00 59.36 58.23 2c91 h GLU 245 Cb 0.81 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.92 2c91 h GLU 245 CO 0.06 0.41 -0.31 -0.22 -1.00 0.00 0.00 179.01 177.95 2c91 h LYS 246 N 0.58 0.86 -0.17 2.33 3.64 -1.17 -2.55 116.57 120.09 2c91 h LYS 246 Ca 0.15 -0.40 -0.09 0.00 -1.27 0.00 0.00 60.65 59.04 2c91 h LYS 246 Cb -0.01 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.79 2c91 h LYS 246 CO -0.03 1.05 -0.29 0.00 -2.27 0.00 0.00 179.45 177.91 2c91 h ALA 247 N 0.92 1.19 -0.24 5.00 0.00 -0.60 -1.12 119.26 124.41 2c91 h ALA 247 Ca 0.08 -0.34 -0.05 0.00 0.00 0.00 0.00 54.91 54.59 2c91 h ALA 247 Cb 0.87 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 2c91 h ALA 247 CO 0.08 0.53 -0.04 -0.07 0.00 0.00 0.00 179.25 179.74 2c91 h LEU 248 N 0.29 0.45 -0.45 0.00 3.38 -0.96 -1.06 115.31 116.97 2c91 h LEU 248 Ca 0.04 -0.35 -0.02 0.00 0.09 0.00 0.00 57.88 57.64 2c91 h LEU 248 Cb 0.67 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.27 2c91 h LEU 248 CO 0.05 0.70 0.21 -0.61 0.09 0.00 0.00 178.44 178.88 2c91 h GLN 249 N 0.20 0.65 -0.42 1.13 5.75 -1.29 -0.13 115.11 120.99 2c91 h GLN 249 Ca 0.06 -0.10 -0.03 0.00 -0.15 0.00 0.00 58.65 58.43 2c91 h GLN 249 Cb 0.50 -0.11 -0.02 0.00 1.07 0.00 0.00 27.48 28.91 2c91 h GLN 249 CO 0.02 0.56 0.13 1.15 -2.65 0.00 0.00 178.83 178.04 2c91 h THR 250 N 0.58 1.22 0.09 2.39 2.02 -1.22 -0.49 112.91 117.50 2c91 h THR 250 Ca 0.15 -0.73 -0.29 0.00 0.77 0.00 0.00 66.41 66.32 2c91 h THR 250 Cb 0.14 0.90 0.03 0.00 -1.74 0.00 0.00 68.15 67.47 2c91 h THR 250 CO -0.02 0.26 -1.20 0.74 0.37 0.00 0.00 175.52 175.67 2c91 h THR 251 N 0.54 1.29 0.00 3.16 2.02 -1.07 -3.39 112.91 115.45 2c91 h THR 251 Ca 0.14 -2.43 0.00 0.00 0.77 0.00 0.00 66.41 64.88 2c91 h THR 251 Cb 0.26 2.62 0.00 0.00 -1.74 0.00 0.00 68.15 69.30 2c91 h THR 251 CO -0.00 0.74 -0.99 -1.22 0.37 0.00 0.00 175.52 174.41 2c91 n TYR 252 N -3.79 0.00 0.00 3.16 4.01 -0.07 -5.08 117.16 115.38 2c91 n TYR 252 Ca -0.13 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.61 2c91 n TYR 252 Cb 0.96 -0.08 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 2.02 3.34 0.25 2.72 0.00 -0.19 -2.23 105.19 111.10 2c91 n GLY 253 Ca -0.00 -0.14 0.11 0.00 0.00 0.00 0.00 46.02 45.99 2c91 n GLY 253 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c91 h THR 254 N 0.00 0.69 -0.18 2.61 1.03 -1.94 -2.36 112.91 112.76 2c91 h THR 254 Ca 0.00 -0.61 0.00 0.00 -0.01 0.00 0.00 66.41 65.79 2c91 h THR 254 Cb 0.00 1.38 0.00 0.00 -1.07 0.00 0.00 68.15 68.46 2c91 h THR 254 CO 0.00 0.14 0.00 0.59 -0.01 0.00 0.00 175.52 176.24 2c91 n ASN 255 N -3.75 1.90 -4.74 0.00 3.02 -0.95 -4.97 115.26 105.77 2c91 n ASN 255 Ca -0.02 -2.17 -0.41 0.00 -0.03 0.00 0.00 54.58 51.95 2c91 n ASN 255 Cb 0.26 -0.41 -0.03 0.00 -0.61 0.00 0.00 39.78 38.99 2c91 n ASN 255 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2c91 s ALA 256 N -1.57 3.56 0.76 5.41 0.00 -0.89 -4.94 121.76 124.09 2c91 s ALA 256 Ca 0.15 1.19 -0.12 0.00 0.00 0.00 0.00 51.96 53.18 2c91 s ALA 256 Cb 0.10 -3.51 0.05 0.00 0.00 0.00 0.00 23.12 19.77 2c91 s ALA 256 CO 0.06 -0.61 1.12 -1.25 0.00 0.00 0.00 175.76 175.08 2c91 s PRO 257 N -0.33 2.16 0.60 0.00 0.04 -1.26 -5.01 135.00 131.21 2c91 s PRO 257 Ca 0.57 1.38 -0.17 0.00 0.04 0.00 0.00 61.00 62.81 2c91 s PRO 257 Cb -0.38 -1.87 -0.03 0.00 0.04 0.00 0.00 34.50 32.25 2c91 s PRO 257 CO 0.41 -1.74 1.13 1.03 0.04 0.00 0.00 177.00 177.86 2c91 s ARG 258 N -4.50 3.05 0.23 4.56 0.52 -1.26 -4.84 118.95 116.71 2c91 s ARG 258 Ca 0.65 1.53 -0.06 0.00 -0.52 0.00 0.00 55.73 57.34 2c91 s ARG 258 Cb -0.21 -1.97 0.36 0.00 0.52 0.00 0.00 34.95 33.65 2c91 s ARG 258 CO 0.51 -1.08 1.80 1.98 0.02 0.00 0.00 175.30 178.53 2c91 h MET 259 N 0.62 0.68 -0.57 3.54 -1.53 -1.86 0.70 114.93 116.50 2c91 h MET 259 Ca -0.49 -0.04 0.11 0.00 -3.44 0.00 0.00 59.70 55.84 2c91 h MET 259 Cb 1.26 -0.15 -0.09 0.00 -0.55 0.00 0.00 31.60 32.07 2c91 h MET 259 CO 0.55 0.45 0.08 1.15 0.14 0.00 0.00 176.91 179.29 2c91 h THR 260 N 0.70 0.62 -0.33 -0.77 2.02 -1.70 0.56 112.91 114.02 2c91 h THR 260 Ca 0.37 -0.07 -0.17 0.00 0.77 0.00 0.00 66.41 67.31 2c91 h THR 260 Cb 0.35 0.39 -0.00 0.00 -1.74 0.00 0.00 68.15 67.14 2c91 h THR 260 CO -0.25 0.04 -0.45 -1.28 0.37 0.00 0.00 175.52 173.95 2c91 h SER 261 N 0.21 0.94 -0.17 4.18 0.87 -1.39 -2.47 113.55 115.71 2c91 h SER 261 Ca 0.30 -0.46 0.02 0.00 -1.23 0.00 0.00 61.79 60.42 2c91 h SER 261 Cb 0.45 -0.27 -0.02 0.00 -0.44 0.00 0.00 62.40 62.13 2c91 h SER 261 CO -0.42 1.24 0.05 0.00 -0.53 0.00 0.00 176.83 177.18 2c91 h ALA 262 N 0.79 0.19 -0.78 6.23 0.00 -0.53 -1.77 119.26 123.39 2c91 h ALA 262 Ca 0.04 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 2c91 h ALA 262 Cb 1.04 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.80 2c91 h ALA 262 CO 0.10 -0.38 0.41 0.00 0.00 0.00 0.00 179.25 179.39 2c91 h ALA 263 N 1.11 1.27 -0.19 0.00 0.00 -0.77 0.11 119.26 120.79 2c91 h ALA 263 Ca 0.07 -0.12 -0.07 0.00 0.00 0.00 0.00 54.91 54.79 2c91 h ALA 263 Cb 0.05 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.52 2c91 h ALA 263 CO -0.08 0.59 -0.14 -0.07 0.00 0.00 0.00 179.25 179.55 2c91 h LEU 264 N 1.09 0.45 -1.52 0.00 3.38 -1.41 -3.00 115.31 114.30 2c91 h LEU 264 Ca 0.27 -0.45 -0.02 0.00 0.09 0.00 0.00 57.88 57.77 2c91 h LEU 264 Cb 0.04 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 2c91 h LEU 264 CO -0.04 0.80 0.08 0.03 0.09 0.00 0.00 178.44 179.40 2c91 h ARG 265 N 0.09 0.39 -0.54 1.13 3.08 -1.16 0.48 114.38 117.85 2c91 h ARG 265 Ca 0.04 -0.05 0.08 0.00 0.07 0.00 0.00 59.98 60.11 2c91 h ARG 265 Cb 0.66 -0.07 -0.07 0.00 0.08 0.00 0.00 29.97 30.57 2c91 h ARG 265 CO 0.04 0.36 0.18 2.35 -1.07 0.00 0.00 179.97 181.83 2c91 h TRP 266 N 0.39 0.31 -0.09 3.04 7.01 -0.90 -1.40 115.95 124.31 2c91 h TRP 266 Ca 0.10 0.03 0.02 0.00 2.11 0.00 0.00 58.89 61.14 2c91 h TRP 266 Cb 0.14 -0.06 -0.02 0.00 -2.10 0.00 0.00 29.16 27.12 2c91 h TRP 266 CO 0.00 0.08 -0.03 0.52 -2.79 0.00 0.00 178.44 176.22 2c91 h MET 267 N 0.35 -0.01 0.00 2.65 2.86 -0.79 0.36 114.93 120.34 2c91 h MET 267 Ca 0.27 0.00 -0.14 0.00 -2.06 0.00 0.00 59.70 57.77 2c91 h MET 267 Cb 0.32 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.96 2c91 h MET 267 CO -0.29 -0.01 -0.66 1.88 1.06 0.00 0.00 176.91 178.89 2c91 h TYR 268 N -0.01 0.00 0.00 -0.22 -1.99 -1.26 -3.36 116.97 110.13 2c91 h TYR 268 Ca 0.05 0.00 -0.00 0.00 2.00 0.00 0.00 58.73 60.78 2c91 h TYR 268 Cb 0.09 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 38.82 2c91 h TYR 268 CO -0.15 0.66 -1.01 0.72 -0.00 0.00 0.00 178.16 178.38 2c91 n HIS 269 N -3.49 0.00 -0.43 4.88 8.25 -0.54 -4.40 115.22 119.49 2c91 n HIS 269 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2c91 n HIS 269 Cb 0.72 -0.01 0.00 0.00 1.12 0.00 0.00 29.99 31.82 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 -1.57 0.00 -2.74 4.41 8.25 0.12 -5.04 115.22 118.64 2c91 n HIS 270 Ca -0.00 -0.14 -0.12 0.00 -0.26 0.00 0.00 57.72 57.19 2c91 n HIS 270 Cb 0.07 -0.01 0.05 0.00 1.12 0.00 0.00 29.99 31.22 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 -0.14 1.00 -0.54 0.41 3.41 -0.67 -4.96 113.62 112.14 2c91 n SER 271 Ca 0.00 -1.77 0.11 0.00 -0.26 0.00 0.00 58.87 56.95 2c91 n SER 271 Cb 0.23 -0.31 0.41 0.00 -0.26 0.00 0.00 64.21 64.28 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 -1.90 1.71 -2.03 4.33 6.02 -1.26 -4.89 117.38 119.35 2c91 n GLN 272 Ca 0.10 -1.07 -0.41 0.00 -0.01 0.00 0.00 57.00 55.61 2c91 n GLN 272 Cb 0.34 -1.41 -0.02 0.00 1.02 0.00 0.00 30.24 30.17 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 -1.66 4.40 -0.27 1.08 1.43 -1.26 -5.01 118.68 117.39 2c91 s LEU 273 Ca 0.34 2.71 0.03 0.00 -1.03 0.00 0.00 54.13 56.18 2c91 s LEU 273 Cb 0.18 -3.64 0.06 0.00 0.03 0.00 0.00 46.19 42.83 2c91 s LEU 273 CO 0.28 -0.65 -0.09 -1.10 0.23 0.00 0.00 176.35 175.02 2c91 s GLN 274 N -1.14 2.08 0.39 1.70 -0.21 -1.26 -4.82 119.66 116.41 2c91 s GLN 274 Ca 0.54 -1.36 0.12 0.00 0.02 0.00 0.00 55.36 54.68 2c91 s GLN 274 Cb -0.41 -2.88 0.93 0.00 1.00 0.00 0.00 33.01 31.65 2c91 s GLN 274 CO 0.49 -0.61 1.91 0.78 -2.12 0.00 0.00 175.29 175.74 2c91 h GLY 275 N 7.78 0.91 2.00 3.09 0.00 -1.73 -1.56 103.07 113.55 2c91 h GLY 275 Ca -0.17 -0.24 -0.01 0.00 0.00 0.00 0.00 47.33 46.91 2c91 h GLY 275 CO 0.46 0.09 -0.06 -0.91 0.00 0.00 0.00 176.54 176.12 2c91 h THR 276 N 0.55 0.25 -0.01 4.70 1.35 -1.87 -1.03 112.91 116.86 2c91 h THR 276 Ca 0.39 -0.43 0.00 0.00 -0.55 0.00 0.00 66.41 65.81 2c91 h THR 276 Cb 0.73 1.34 0.00 0.00 -1.73 0.00 0.00 68.15 68.49 2c91 h THR 276 CO -0.15 0.06 -0.18 0.54 -0.25 0.00 0.00 175.52 175.54 2c91 n ARG 277 N -3.32 0.73 -0.68 4.72 1.74 -0.63 -4.93 116.66 114.28 2c91 n ARG 277 Ca -0.01 -0.34 0.00 0.00 -0.77 0.00 0.00 57.85 56.73 2c91 n ARG 277 Cb 0.23 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.18 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 1.31 0.66 3.74 -0.13 0.00 -0.39 -4.58 105.19 105.80 2c91 n GLY 278 Ca 0.13 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.01 4.77 0.09 1.61 1.01 -0.92 -4.65 116.67 116.58 2c91 s ASP 279 Ca 0.00 2.58 -0.06 0.00 0.71 0.00 0.00 52.55 55.78 2c91 s ASP 279 Cb 0.00 -2.62 -0.01 0.00 1.01 0.00 0.00 42.92 41.30 2c91 s ASP 279 CO 0.00 -1.89 0.14 0.00 0.21 0.00 0.00 175.17 173.63 2c91 s ALA 280 N -1.43 0.06 -0.17 5.23 0.00 -0.23 -1.59 121.76 123.62 2c91 s ALA 280 Ca 0.81 -0.85 -0.05 0.00 0.00 0.00 0.00 51.96 51.86 2c91 s ALA 280 Cb -0.36 0.52 -0.03 0.00 0.00 0.00 0.00 23.12 23.24 2c91 s ALA 280 CO 0.39 -0.50 0.01 0.08 0.00 0.00 0.00 175.76 175.74 2c91 s VAL 281 N -3.90 4.28 -0.47 0.00 1.01 -0.18 -1.24 120.40 119.90 2c91 s VAL 281 Ca 0.09 -0.22 -0.18 0.00 0.00 0.00 0.00 61.98 61.66 2c91 s VAL 281 Cb 0.06 -2.90 0.04 0.00 0.00 0.00 0.00 36.38 33.58 2c91 s VAL 281 CO -0.08 0.48 0.55 -0.63 0.00 0.00 0.00 175.10 175.42 2c91 s ILE 282 N 0.39 4.96 0.47 2.22 1.01 -0.23 -0.96 121.20 129.06 2c91 s ILE 282 Ca -0.01 -0.42 -0.21 0.00 0.00 0.00 0.00 60.65 60.00 2c91 s ILE 282 Cb -0.13 -4.20 -0.08 0.00 0.01 0.00 0.00 42.46 38.06 2c91 s ILE 282 CO 0.02 -0.65 1.07 -0.76 0.00 0.00 0.00 174.94 174.62 2c91 s LEU 283 N 2.42 3.91 0.17 2.97 1.43 -0.15 -4.58 118.68 124.86 2c91 s LEU 283 Ca 0.14 2.05 0.10 0.00 -1.03 0.00 0.00 54.13 55.39 2c91 s LEU 283 Cb -0.18 -4.44 -0.04 0.00 0.03 0.00 0.00 46.19 41.55 2c91 s LEU 283 CO 0.13 -0.82 -0.19 -0.83 0.23 0.00 0.00 176.35 174.87 2c91 s GLY 284 N -1.77 1.71 0.02 -3.19 0.00 -1.26 -0.50 107.32 102.33 2c91 s GLY 284 Ca 0.66 -1.53 -0.27 0.00 0.00 0.00 0.00 44.72 43.57 2c91 s GLY 284 CO 0.25 -1.54 0.76 -3.16 0.00 0.00 0.00 173.10 169.40 2c91 s MET 285 N -2.60 1.00 0.00 2.90 0.23 -1.26 -4.76 119.30 114.81 2c91 s MET 285 Ca 0.21 -0.17 0.02 0.00 -1.03 0.00 0.00 55.69 54.72 2c91 s MET 285 Cb -0.09 0.46 0.03 0.00 -1.53 0.00 0.00 34.83 33.70 2c91 s MET 285 CO 0.11 -0.40 0.78 -1.13 -2.03 0.00 0.00 175.02 172.36 2c91 n SER 286 N 0.11 1.61 -3.74 -1.18 3.41 -1.26 -4.53 113.62 108.03 2c91 n SER 286 Ca -0.14 -1.51 -0.10 0.00 -0.26 0.00 0.00 58.87 56.86 2c91 n SER 286 Cb 0.61 -0.02 -0.05 0.00 -0.26 0.00 0.00 64.21 64.50 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 -0.54 -0.16 0.20 4.04 1.04 -1.26 -4.36 113.70 112.66 2c91 s SER 287 Ca 0.02 -0.49 -0.11 0.00 0.48 0.00 0.00 55.95 55.85 2c91 s SER 287 Cb 0.01 0.48 0.13 0.00 0.10 0.00 0.00 66.02 66.74 2c91 s SER 287 CO 0.02 -0.90 1.86 0.25 0.98 0.00 0.00 173.24 175.45 2c91 h LEU 288 N 2.39 0.80 -0.48 2.42 5.85 -1.96 -2.60 115.31 121.73 2c91 h LEU 288 Ca -0.32 -0.03 0.02 0.00 0.84 0.00 0.00 57.88 58.38 2c91 h LEU 288 Cb 1.25 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 42.05 2c91 h LEU 288 CO 0.46 0.59 0.29 -0.08 -0.34 0.00 0.00 178.44 179.36 2c91 h GLU 289 N 0.93 0.56 -0.58 1.25 4.81 -1.99 -0.02 114.58 119.54 2c91 h GLU 289 Ca 0.25 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.45 2c91 h GLU 289 Cb -0.08 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.14 2c91 h GLU 289 CO -0.05 0.37 0.38 1.96 -0.73 0.00 0.00 179.01 180.94 2c91 h GLN 290 N 0.58 0.77 -0.72 1.92 4.20 -1.96 -1.71 115.11 118.18 2c91 h GLN 290 Ca 0.19 -0.05 -0.07 0.00 0.06 0.00 0.00 58.65 58.78 2c91 h GLN 290 Cb 0.00 -0.17 -0.03 0.00 0.30 0.00 0.00 27.48 27.58 2c91 h GLN 290 CO -0.08 0.51 0.20 1.25 -0.67 0.00 0.00 178.83 180.04 2c91 h LEU 291 N 0.79 1.08 -0.51 1.46 5.85 -0.96 -0.55 115.31 122.47 2c91 h LEU 291 Ca 0.21 -0.22 -0.04 0.00 0.84 0.00 0.00 57.88 58.67 2c91 h LEU 291 Cb -0.08 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 40.64 2c91 h LEU 291 CO -0.04 1.02 0.16 -0.33 -0.34 0.00 0.00 178.44 178.90 2c91 h GLU 292 N 1.09 0.79 -0.49 1.25 5.08 -0.84 0.49 114.58 121.95 2c91 h GLU 292 Ca 0.23 -0.17 0.06 0.00 -1.00 0.00 0.00 59.36 58.48 2c91 h GLU 292 Cb 0.34 -0.11 -0.05 0.00 0.50 0.00 0.00 28.75 29.43 2c91 h GLU 292 CO -0.00 0.73 0.20 0.37 -1.00 0.00 0.00 179.01 179.31 2c91 h GLN 293 N 0.69 0.39 -0.45 2.33 4.15 -1.15 -1.79 115.11 119.27 2c91 h GLN 293 Ca 0.16 -0.02 -0.09 0.00 0.77 0.00 0.00 58.65 59.47 2c91 h GLN 293 Cb 0.28 -0.09 -0.01 0.00 0.21 0.00 0.00 27.48 27.86 2c91 h GLN 293 CO -0.00 0.26 -0.08 -0.91 -1.93 0.00 0.00 178.83 176.16 2c91 h ASN 294 N 0.40 0.86 -0.72 -0.69 4.21 -0.50 -2.57 115.58 116.57 2c91 h ASN 294 Ca 0.23 -0.35 0.04 0.00 1.21 0.00 0.00 56.30 57.43 2c91 h ASN 294 Cb 0.20 -0.23 -0.05 0.00 -1.12 0.00 0.00 38.32 37.12 2c91 h ASN 294 CO -0.20 1.00 0.44 -0.07 -1.29 0.00 0.00 177.43 177.31 2c91 h LEU 295 N 0.70 0.71 -0.58 1.61 3.38 0.16 -2.41 115.31 118.88 2c91 h LEU 295 Ca 0.12 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.07 2c91 h LEU 295 Cb 0.61 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.19 2c91 h LEU 295 CO 0.04 0.49 0.26 0.00 0.09 0.00 0.00 178.44 179.32 2c91 h ALA 296 N 1.32 0.75 -0.25 1.53 0.00 -1.06 -2.52 119.26 119.03 2c91 h ALA 296 Ca 0.30 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 2c91 h ALA 296 Cb 0.06 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 2c91 h ALA 296 CO -0.13 0.34 0.09 0.00 0.00 0.00 0.00 179.25 179.55 2c91 h ALA 297 N 1.10 1.69 0.00 0.00 0.00 -1.23 -1.99 119.26 118.84 2c91 h ALA 297 Ca 0.20 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 2c91 h ALA 297 Cb 0.15 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 2c91 h ALA 297 CO -0.02 0.24 -0.08 1.79 0.00 0.00 0.00 179.25 181.19 2c91 h THR 298 N 0.34 0.40 -0.01 0.00 1.35 -0.98 -2.34 112.91 111.67 2c91 h THR 298 Ca 0.09 -0.41 0.00 0.00 -0.55 0.00 0.00 66.41 65.54 2c91 h THR 298 Cb 0.09 1.29 0.00 0.00 -1.73 0.00 0.00 68.15 67.80 2c91 h THR 298 CO -0.01 0.07 -0.64 -0.62 -0.25 0.00 0.00 175.52 174.08 2c91 n GLU 299 N -3.49 0.74 -1.17 4.72 1.02 -0.76 -4.93 120.64 116.76 2c91 n GLU 299 Ca -0.02 -0.60 -0.30 0.00 -0.02 0.00 0.00 57.16 56.23 2c91 n GLU 299 Cb 0.21 -1.49 0.14 0.00 -0.02 0.00 0.00 31.44 30.28 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 -2.67 1.17 0.00 3.49 2.02 -0.88 -5.08 118.70 116.74 2c91 s GLU 300 Ca 0.15 0.84 0.00 0.00 0.02 0.00 0.00 54.97 55.98 2c91 s GLU 300 Cb 0.17 -1.80 0.00 0.00 0.10 0.00 0.00 34.13 32.61 2c91 s GLU 300 CO 0.67 -2.31 0.00 0.41 0.02 0.00 0.00 175.26 174.05 2c91 n GLY 301 N -1.02 0.93 3.67 -1.39 0.00 -1.26 -5.01 105.19 101.10 2c91 n GLY 301 Ca 0.07 -1.98 -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 -2.17 0.99 0.41 1.61 0.02 -1.26 -4.94 135.00 129.67 2c91 s PRO 302 Ca 0.00 1.40 -0.02 0.00 0.02 0.00 0.00 61.00 62.40 2c91 s PRO 302 Cb 0.00 -1.74 -0.03 0.00 0.02 0.00 0.00 34.50 32.75 2c91 s PRO 302 CO 0.00 -2.60 0.66 -0.51 -0.33 0.00 0.00 177.00 174.22 2c91 s LEU 303 N -6.56 3.81 0.51 -5.54 1.43 -1.26 -5.08 118.68 105.99 2c91 s LEU 303 Ca 0.66 0.61 -0.21 0.00 -1.03 0.00 0.00 54.13 54.16 2c91 s LEU 303 Cb -0.22 -3.51 -0.06 0.00 0.03 0.00 0.00 46.19 42.43 2c91 s LEU 303 CO 0.58 -0.46 1.21 -1.61 0.23 0.00 0.00 176.35 176.30 2c91 s GLU 304 N -4.52 3.42 0.33 1.70 0.41 -1.26 -4.79 118.70 113.99 2c91 s GLU 304 Ca 0.44 1.87 0.09 0.00 -0.41 0.00 0.00 54.97 56.96 2c91 s GLU 304 Cb -0.10 -2.23 0.86 0.00 -1.78 0.00 0.00 34.13 30.87 2c91 s GLU 304 CO 0.40 -0.86 1.76 -1.35 -0.49 0.00 0.00 175.26 174.72 2c91 h PRO 305 N 1.59 0.62 -0.45 0.39 0.11 -1.99 -0.24 132.00 132.03 2c91 h PRO 305 Ca -0.50 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.57 2c91 h PRO 305 Cb 1.27 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 32.22 2c91 h PRO 305 CO 0.58 0.41 0.26 0.00 -0.21 0.00 0.00 178.00 179.03 2c91 h ALA 306 N 1.67 1.60 0.19 -0.75 0.00 -1.97 -0.63 119.26 119.38 2c91 h ALA 306 Ca 0.60 -0.06 -0.33 0.00 0.00 0.00 0.00 54.91 55.12 2c91 h ALA 306 Cb 1.11 -0.18 0.02 0.00 0.00 0.00 0.00 17.79 18.74 2c91 h ALA 306 CO -0.40 0.34 -1.53 0.28 0.00 0.00 0.00 179.25 177.94 2c91 h VAL 307 N 0.62 1.20 -0.51 0.00 2.07 -1.37 -2.50 116.25 115.75 2c91 h VAL 307 Ca 0.16 -2.73 0.07 0.00 0.82 0.00 0.00 66.70 65.03 2c91 h VAL 307 Cb 0.00 2.90 -0.06 0.00 -1.52 0.00 0.00 31.29 32.62 2c91 h VAL 307 CO -0.03 0.84 0.18 0.58 0.02 0.00 0.00 177.57 179.16 2c91 h VAL 308 N 0.11 0.82 -0.58 2.57 2.07 -1.25 -1.57 116.25 118.42 2c91 h VAL 308 Ca -0.26 -0.12 -0.00 0.00 0.82 0.00 0.00 66.70 67.13 2c91 h VAL 308 Cb 2.10 0.43 -0.03 0.00 -1.52 0.00 0.00 31.29 32.27 2c91 h VAL 308 CO 0.22 0.07 0.35 -0.08 0.02 0.00 0.00 177.57 178.14 2c91 h GLU 309 N 0.36 0.79 -1.00 1.57 4.57 -1.15 -2.17 114.58 117.55 2c91 h GLU 309 Ca 0.25 -0.07 0.03 0.00 -1.18 0.00 0.00 59.36 58.38 2c91 h GLU 309 Cb 0.27 -0.17 -0.05 0.00 -0.16 0.00 0.00 28.75 28.64 2c91 h GLU 309 CO -0.25 0.57 0.66 0.00 -1.18 0.00 0.00 179.01 178.80 2c91 h ALA 310 N 1.18 1.33 -0.39 2.92 0.00 -1.07 -0.94 119.26 122.28 2c91 h ALA 310 Ca 0.21 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 55.03 2c91 h ALA 310 Cb -0.02 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 17.38 2c91 h ALA 310 CO -0.04 0.59 0.08 0.74 0.00 0.00 0.00 179.25 180.62 2c91 h PHE 311 N 1.30 0.58 -0.30 0.00 0.04 -0.72 -0.42 116.94 117.43 2c91 h PHE 311 Ca 0.39 -0.04 -0.09 0.00 2.80 0.00 0.00 57.97 61.03 2c91 h PHE 311 Cb -0.05 -0.18 -0.01 0.00 2.20 0.00 0.00 35.95 37.91 2c91 h PHE 311 CO -0.00 0.52 -0.16 -0.44 -0.60 0.00 0.00 178.31 177.63 2c91 h ASP 312 N 0.56 0.67 -0.91 2.17 3.32 -0.75 -1.70 116.42 119.78 2c91 h ASP 312 Ca 0.13 -0.42 0.02 0.00 0.02 0.00 0.00 57.03 56.78 2c91 h ASP 312 Cb 0.24 -0.18 -0.05 0.00 0.22 0.00 0.00 39.33 39.55 2c91 h ASP 312 CO -0.00 0.94 0.60 1.56 -1.72 0.00 0.00 179.24 180.62 2c91 h GLN 313 N 0.40 1.16 0.01 3.56 4.20 -1.04 -1.03 115.11 122.37 2c91 h GLN 313 Ca 0.07 -0.07 -0.00 0.00 0.06 0.00 0.00 58.65 58.71 2c91 h GLN 313 Cb 0.69 -0.26 0.00 0.00 0.30 0.00 0.00 27.48 28.21 2c91 h GLN 313 CO 0.05 0.77 -0.00 0.00 -0.67 0.00 0.00 178.83 178.97 2c91 h ALA 314 N 1.45 -0.01 -0.72 3.87 0.00 -0.92 -1.82 119.26 121.09 2c91 h ALA 314 Ca 0.35 -0.04 0.04 0.00 0.00 0.00 0.00 54.91 55.26 2c91 h ALA 314 Cb -0.07 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.68 2c91 h ALA 314 CO -0.09 -0.47 0.44 2.35 0.00 0.00 0.00 179.25 181.49 2c91 h TRP 315 N -0.09 0.82 -0.44 0.00 2.91 -1.10 -1.85 115.95 116.20 2c91 h TRP 315 Ca -0.00 0.02 0.07 0.00 1.13 0.00 0.00 58.89 60.12 2c91 h TRP 315 Cb 0.09 -0.27 -0.02 0.00 -0.51 0.00 0.00 29.16 28.45 2c91 h TRP 315 CO -0.05 0.45 0.30 -0.91 -1.03 0.00 0.00 178.44 177.20 2c91 h ASN 316 N 0.84 0.26 0.45 2.65 2.35 -0.91 0.32 115.58 121.54 2c91 h ASN 316 Ca 0.30 0.00 -0.12 0.00 -0.55 0.00 0.00 56.30 55.94 2c91 h ASN 316 Cb 0.08 -0.05 -0.01 0.00 0.05 0.00 0.00 38.32 38.38 2c91 h ASN 316 CO -0.14 0.17 -0.53 0.24 -1.65 0.00 0.00 177.43 175.52 2c91 h MET 317 N 0.29 0.09 0.00 0.81 2.86 -0.47 -3.30 114.93 115.20 2c91 h MET 317 Ca 0.20 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.79 2c91 h MET 317 Cb 0.41 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.08 2c91 h MET 317 CO -0.04 0.59 -1.15 1.33 1.06 0.00 0.00 176.91 178.70 2c91 n VAL 318 N -3.92 0.00 -0.35 -2.22 0.24 -0.71 -4.70 118.33 106.67 2c91 n VAL 318 Ca -0.02 -0.22 0.13 0.00 -2.04 0.00 0.00 64.34 62.20 2c91 n VAL 318 Cb 0.55 0.66 0.33 0.00 -1.47 0.00 0.00 33.84 33.91 2c91 n VAL 318 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2c91 h ALA 319 N 2.03 1.70 0.00 2.33 0.00 -0.49 0.18 119.26 125.01 2c91 h ALA 319 Ca 0.00 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2c91 h ALA 319 Cb 0.53 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.23 2c91 h ALA 319 CO 0.00 -0.05 0.00 1.12 0.00 0.00 0.00 179.25 180.32 2c91 h HIS 320 N 0.77 0.00 0.00 0.00 2.07 -1.84 -2.83 115.15 113.31 2c91 h HIS 320 Ca 0.56 0.00 -0.04 0.00 -2.85 0.00 0.00 60.37 58.04 2c91 h HIS 320 Cb 0.88 0.00 -0.09 0.00 2.57 0.00 0.00 27.41 30.77 2c91 h HIS 320 CO -0.00 0.00 -0.56 -0.85 -3.07 0.00 0.00 177.93 173.45 2c91 n GLU 321 N -2.76 1.09 -1.81 5.12 0.28 0.03 -5.06 120.64 117.53 2c91 n GLU 321 Ca -0.01 -2.78 -0.41 0.00 -0.16 0.00 0.00 57.16 53.80 2c91 n GLU 321 Cb 0.15 -1.16 -0.02 0.00 1.43 0.00 0.00 31.44 31.84 2c91 n GLU 321 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2c91 s PRO 323 N -0.61 3.11 0.05 0.00 0.04 -1.26 -4.97 135.00 131.36 2c91 s PRO 323 Ca 0.62 1.28 -0.31 0.00 0.04 0.00 0.00 61.00 62.63 2c91 s PRO 323 Cb -0.47 -2.00 -0.06 0.00 0.04 0.00 0.00 34.50 32.01 2c91 s PRO 323 CO 0.49 -0.98 1.33 -0.80 0.04 0.00 0.00 177.00 177.07 2c91 s ASN 324 N -2.70 6.92 0.22 6.66 0.01 -1.26 -4.87 114.94 119.91 2c91 s ASN 324 Ca 0.65 2.14 0.22 0.00 -0.71 0.00 0.00 52.86 55.16 2c91 s ASN 324 Cb -0.18 -2.57 0.92 0.00 0.41 0.00 0.00 41.25 39.83 2c91 s ASN 324 CO 0.39 -0.62 1.68 0.00 -1.51 0.00 0.00 177.10 177.04 2c91 n TYR 325 N 4.47 0.69 -4.32 2.20 4.11 -1.26 -4.79 117.16 118.26 2c91 n TYR 325 Ca 0.11 0.27 -0.28 0.00 -0.00 0.00 0.00 57.90 58.00 2c91 n TYR 325 Cb 0.44 -0.93 -0.10 0.00 -0.00 0.00 0.00 39.34 38.75 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 -3.26 2.53 0.00 -3.48 -0.12 -1.26 -4.28 117.98 108.11 2c91 s PHE 326 Ca 0.05 -0.26 0.00 0.00 -0.05 0.00 0.00 56.93 56.67 2c91 s PHE 326 Cb 0.10 -1.27 0.00 0.00 -0.63 0.00 0.00 43.02 41.22 2c91 s PHE 326 CO 0.39 0.47 0.20 0.54 -0.05 0.00 0.00 175.22 176.77