#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 3.21 0.59 1.96 1.70 -1.26 -3.29 118.95 121.86 2c91 s ARG 5 Ca 0.00 1.34 -0.18 0.00 -0.47 0.00 0.00 55.73 56.42 2c91 s ARG 5 Cb 0.00 -2.01 -0.08 0.00 -0.57 0.00 0.00 34.95 32.29 2c91 s ARG 5 CO 0.00 -0.92 0.55 -2.30 -1.08 0.00 0.00 175.30 171.56 2c91 n PRO 6 N -1.93 0.51 -1.41 3.89 -0.02 -1.26 -4.35 135.00 130.43 2c91 n PRO 6 Ca 0.10 0.20 -0.30 0.00 -2.02 0.00 0.00 63.50 61.48 2c91 n PRO 6 Cb 0.52 -1.75 0.12 0.00 -0.02 0.00 0.00 33.50 32.37 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 -1.73 1.85 -0.11 3.55 0.00 -0.71 -4.83 121.76 119.78 2c91 s ALA 7 Ca 0.69 -0.22 0.03 0.00 0.00 0.00 0.00 51.96 52.46 2c91 s ALA 7 Cb -0.43 -3.12 0.00 0.00 0.00 0.00 0.00 23.12 19.57 2c91 s ALA 7 CO 0.54 -2.10 -0.23 0.99 0.00 0.00 0.00 175.76 174.96 2c91 s THR 8 N -3.09 1.99 0.05 0.00 2.01 -1.26 -0.80 115.64 114.54 2c91 s THR 8 Ca 0.62 -0.97 0.09 0.00 0.31 0.00 0.00 61.69 61.75 2c91 s THR 8 Cb -0.16 -1.73 -0.03 0.00 0.01 0.00 0.00 72.50 70.59 2c91 s THR 8 CO 0.55 0.54 -0.24 -0.69 -0.69 0.00 0.00 174.62 174.09 2c91 s VAL 9 N 0.50 2.35 -0.27 3.82 1.01 -0.15 -4.49 120.40 123.18 2c91 s VAL 9 Ca -0.15 -1.38 -0.13 0.00 0.00 0.00 0.00 61.98 60.32 2c91 s VAL 9 Cb -0.17 -1.96 -0.04 0.00 0.00 0.00 0.00 36.38 34.21 2c91 s VAL 9 CO 0.06 0.32 0.29 -0.22 0.00 0.00 0.00 175.10 175.55 2c91 s LEU 10 N -1.40 4.04 0.20 3.92 2.96 -0.47 -1.05 118.68 126.88 2c91 s LEU 10 Ca 0.13 0.18 -0.29 0.00 -0.22 0.00 0.00 54.13 53.93 2c91 s LEU 10 Cb -0.10 -2.30 -0.08 0.00 0.50 0.00 0.00 46.19 44.21 2c91 s LEU 10 CO 0.04 -0.11 0.91 -0.83 -1.32 0.00 0.00 176.35 175.03 2c91 s GLY 11 N 1.62 3.06 -0.11 7.98 0.00 -0.02 -0.66 107.32 119.19 2c91 s GLY 11 Ca 0.12 0.56 0.15 0.00 0.00 0.00 0.00 44.72 45.55 2c91 s GLY 11 CO 0.10 1.19 1.13 -1.30 0.00 0.00 0.00 173.10 174.22 2c91 n THR 12 N 1.80 1.51 0.24 0.90 -2.24 -0.76 -4.74 114.28 110.99 2c91 n THR 12 Ca -0.02 -1.89 0.07 0.00 -2.27 0.00 0.00 64.05 59.95 2c91 n THR 12 Cb 0.48 -0.07 0.59 0.00 -2.10 0.00 0.00 70.33 69.23 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 0.11 0.02 -0.02 -0.78 1.85 -1.91 -2.49 114.93 111.71 2c91 h MET 13 Ca -0.01 -0.00 0.00 0.00 -0.61 0.00 0.00 59.70 59.08 2c91 h MET 13 Cb 1.10 -0.00 0.00 0.00 0.43 0.00 0.00 31.60 33.12 2c91 h MET 13 CO 0.00 0.07 -0.02 0.39 -0.40 0.00 0.00 176.91 176.95 2c91 n GLU 14 N -4.48 1.67 -2.37 0.39 -0.58 -1.26 -4.65 120.64 109.37 2c91 n GLU 14 Ca -0.03 -1.03 -0.43 0.00 -0.42 0.00 0.00 57.16 55.25 2c91 n GLU 14 Cb 0.13 -1.48 -0.02 0.00 -0.57 0.00 0.00 31.44 29.50 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 -2.04 3.81 0.00 3.49 -1.94 -0.94 -1.66 119.30 120.03 2c91 s MET 15 Ca 0.36 1.20 0.00 0.00 -1.71 0.00 0.00 55.69 55.54 2c91 s MET 15 Cb 0.21 -3.93 0.00 0.00 2.01 0.00 0.00 34.83 33.11 2c91 s MET 15 CO 0.35 -1.26 0.00 0.41 -0.01 0.00 0.00 175.02 174.51 2c91 n GLY 16 N 4.55 0.39 0.00 -0.03 0.00 0.31 -2.51 105.19 107.90 2c91 n GLY 16 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 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 -1.58 0.00 0.19 1.61 0.63 -0.75 -4.85 116.66 111.90 2c91 n ARG 17 Ca 0.00 0.00 0.05 0.00 -0.92 0.00 0.00 57.85 56.98 2c91 n ARG 17 Cb 0.00 0.00 0.34 0.00 0.45 0.00 0.00 32.46 33.25 2c91 n ARG 17 CO 0.00 0.00 0.00 -0.09 -2.51 0.00 0.00 177.63 175.03 2c91 h ARG 18 N 0.00 0.00 -5.10 -0.14 2.43 -1.86 -3.43 114.38 106.28 2c91 h ARG 18 Ca 0.00 0.00 -0.64 0.00 -0.81 0.00 0.00 59.98 58.53 2c91 h ARG 18 Cb 0.00 0.00 -0.22 0.00 -0.42 0.00 0.00 29.97 29.33 2c91 h ARG 18 CO 0.00 0.39 -0.65 -1.64 -1.51 0.00 0.00 179.97 176.56 2c91 s MET 19 N -3.69 3.65 0.64 0.20 -1.94 -0.66 -4.97 119.30 112.52 2c91 s MET 19 Ca -0.00 -0.50 -0.10 0.00 -1.71 0.00 0.00 55.69 53.37 2c91 s MET 19 Cb 0.12 -3.14 0.15 0.00 2.01 0.00 0.00 34.83 33.96 2c91 s MET 19 CO 0.69 -0.01 0.87 -0.40 -0.01 0.00 0.00 175.02 176.15 2c91 n ASP 20 N 4.35 0.10 -0.08 3.03 5.75 -1.26 -0.53 116.55 127.90 2c91 n ASP 20 Ca -0.17 -1.34 0.01 0.00 -0.01 0.00 0.00 54.79 53.29 2c91 n ASP 20 Cb 0.52 -0.66 0.31 0.00 -1.03 0.00 0.00 41.12 40.26 2c91 n ASP 20 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2c91 h ALA 21 N -1.80 1.49 -0.11 2.12 0.00 -1.98 -0.01 119.26 118.97 2c91 h ALA 21 Ca -0.28 -0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.48 2c91 h ALA 21 Cb 0.78 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.36 2c91 h ALA 21 CO 0.20 0.41 -0.14 0.66 0.00 0.00 0.00 179.25 180.39 2c91 h SER 22 N 0.72 0.31 -0.68 0.00 4.64 -1.99 0.67 113.55 117.22 2c91 h SER 22 Ca 0.18 -0.51 -0.02 0.00 -0.47 0.00 0.00 61.79 60.98 2c91 h SER 22 Cb 0.05 -0.09 -0.03 0.00 -0.31 0.00 0.00 62.40 62.02 2c91 h SER 22 CO -0.03 0.76 0.36 0.00 -0.87 0.00 0.00 176.83 177.05 2c91 h ALA 23 N 0.56 1.33 -0.15 5.18 0.00 -1.89 -1.34 119.26 122.95 2c91 h ALA 23 Ca 0.01 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 2c91 h ALA 23 Cb 0.68 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 2c91 h ALA 23 CO 0.03 0.54 0.04 0.77 0.00 0.00 0.00 179.25 180.63 2c91 h SER 24 N 0.97 0.22 -0.58 0.00 0.02 -0.87 -1.75 113.55 111.57 2c91 h SER 24 Ca 0.24 -0.22 0.01 0.00 -0.84 0.00 0.00 61.79 60.98 2c91 h SER 24 Cb 0.05 -0.06 -0.03 0.00 0.14 0.00 0.00 62.40 62.51 2c91 h SER 24 CO -0.04 0.39 0.38 0.00 -1.14 0.00 0.00 176.83 176.42 2c91 h ALA 25 N 0.84 0.73 -0.90 3.77 0.00 -0.59 -1.34 119.26 121.78 2c91 h ALA 25 Ca 0.05 -0.04 0.03 0.00 0.00 0.00 0.00 54.91 54.95 2c91 h ALA 25 Cb 0.25 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 17.76 2c91 h ALA 25 CO 0.00 0.16 0.59 0.00 0.00 0.00 0.00 179.25 180.00 2c91 h ALA 26 N 1.22 1.42 -0.13 0.00 0.00 -1.17 -0.63 119.26 119.97 2c91 h ALA 26 Ca 0.21 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.05 2c91 h ALA 26 Cb -0.08 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.38 2c91 h ALA 26 CO -0.05 0.51 -0.03 0.77 0.00 0.00 0.00 179.25 180.45 2c91 h SER 27 N 1.14 0.25 -0.33 0.00 0.02 -0.89 -0.76 113.55 112.98 2c91 h SER 27 Ca 0.35 -0.36 -0.01 0.00 -0.84 0.00 0.00 61.79 60.93 2c91 h SER 27 Cb -0.02 -0.07 -0.02 0.00 0.14 0.00 0.00 62.40 62.44 2c91 h SER 27 CO -0.10 0.55 0.18 0.58 -1.14 0.00 0.00 176.83 176.90 2c91 h VAL 28 N -0.06 1.14 -0.39 2.27 2.07 -1.10 0.43 116.25 120.61 2c91 h VAL 28 Ca 0.03 -0.39 0.08 0.00 0.82 0.00 0.00 66.70 67.24 2c91 h VAL 28 Cb 0.44 0.79 -0.07 0.00 -1.52 0.00 0.00 31.29 30.93 2c91 h VAL 28 CO 0.01 0.15 -0.07 -0.09 0.02 0.00 0.00 177.57 177.59 2c91 h ARG 29 N 0.41 0.03 -0.84 1.57 2.43 -1.04 0.12 114.38 117.06 2c91 h ARG 29 Ca 0.12 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.29 2c91 h ARG 29 Cb 0.08 -0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 29.58 2c91 h ARG 29 CO -0.02 0.02 0.54 0.00 -1.51 0.00 0.00 179.97 179.00 2c91 h ALA 30 N 1.38 1.07 -0.25 2.80 0.00 -0.87 -0.36 119.26 123.04 2c91 h ALA 30 Ca 0.19 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 2c91 h ALA 30 Cb 0.29 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2c91 h ALA 30 CO -0.38 0.51 0.02 0.35 0.00 0.00 0.00 179.25 179.74 2c91 h PHE 31 N 1.15 0.46 -0.27 0.00 3.57 -0.17 -2.94 116.94 118.74 2c91 h PHE 31 Ca 0.31 -0.07 -0.12 0.00 3.53 0.00 0.00 57.97 61.61 2c91 h PHE 31 Cb -0.09 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 38.51 2c91 h PHE 31 CO -0.01 0.57 -0.34 -0.07 -2.23 0.00 0.00 178.31 176.23 2c91 h LEU 32 N 0.22 0.60 -1.89 0.59 3.38 -0.59 -2.78 115.31 114.83 2c91 h LEU 32 Ca 0.07 -0.24 0.10 0.00 0.09 0.00 0.00 57.88 57.90 2c91 h LEU 32 Cb 0.37 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 2c91 h LEU 32 CO 0.01 0.89 0.29 -0.08 0.09 0.00 0.00 178.44 179.64 2c91 h GLU 33 N 0.49 0.12 -0.08 1.13 4.22 -0.98 0.16 114.58 119.63 2c91 h GLU 33 Ca 0.05 -0.01 0.00 0.00 0.08 0.00 0.00 59.36 59.49 2c91 h GLU 33 Cb 0.82 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.04 2c91 h GLU 33 CO 0.07 0.08 0.00 0.54 -2.18 0.00 0.00 179.01 177.52 2c91 n ARG 34 N -4.45 1.27 -0.34 1.92 5.12 -1.05 -4.88 116.66 114.26 2c91 n ARG 34 Ca 0.06 -0.42 0.00 0.00 -1.93 0.00 0.00 57.85 55.57 2c91 n ARG 34 Cb 0.40 -1.26 0.00 0.00 -1.16 0.00 0.00 32.46 30.44 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 0.85 0.77 3.92 -0.13 0.00 0.56 -5.07 105.19 106.09 2c91 n GLY 35 Ca 0.11 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.87 2c91 n GLY 35 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2c91 s HIS 36 N -2.26 3.03 0.00 1.61 3.76 -1.22 -5.04 115.29 115.17 2c91 s HIS 36 Ca 0.00 0.54 0.00 0.00 -0.15 0.00 0.00 55.06 55.45 2c91 s HIS 36 Cb 0.00 -3.07 0.00 0.00 1.11 0.00 0.00 32.58 30.62 2c91 s HIS 36 CO 0.00 -1.25 0.00 -1.13 -0.85 0.00 0.00 174.74 171.51 2c91 n SER 37 N -2.85 0.00 -4.73 1.40 3.41 -1.26 -4.47 113.62 105.12 2c91 n SER 37 Ca 0.07 0.00 -0.35 0.00 -0.26 0.00 0.00 58.87 58.33 2c91 n SER 37 Cb 0.60 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 64.46 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 3.45 0.04 4.33 2.02 -1.26 -0.78 118.70 126.50 2c91 s GLU 38 Ca 0.00 -0.30 0.09 0.00 0.02 0.00 0.00 54.97 54.78 2c91 s GLU 38 Cb 0.00 -3.05 -0.03 0.00 0.10 0.00 0.00 34.13 31.15 2c91 s GLU 38 CO 0.00 0.59 -0.24 -0.51 0.02 0.00 0.00 175.26 175.12 2c91 s LEU 39 N -0.53 2.28 -0.18 1.80 1.43 -0.37 -1.36 118.68 121.74 2c91 s LEU 39 Ca 0.11 -0.55 0.01 0.00 -1.03 0.00 0.00 54.13 52.66 2c91 s LEU 39 Cb -0.12 -1.34 0.02 0.00 0.03 0.00 0.00 46.19 44.78 2c91 s LEU 39 CO 0.02 0.26 -0.20 -0.62 0.23 0.00 0.00 176.35 176.04 2c91 s ASP 40 N -1.30 3.11 0.00 2.29 2.15 0.16 -1.30 116.67 121.78 2c91 s ASP 40 Ca 0.12 -0.64 0.00 0.00 0.43 0.00 0.00 52.55 52.46 2c91 s ASP 40 Cb -0.10 -1.47 0.00 0.00 -0.30 0.00 0.00 42.92 41.05 2c91 s ASP 40 CO 0.03 0.00 0.00 1.07 -0.17 0.00 0.00 175.17 176.10 2c91 n THR 41 N 4.59 0.00 -3.50 1.71 5.66 0.10 -1.83 114.28 121.01 2c91 n THR 41 Ca -0.21 0.00 -0.15 0.00 -3.05 0.00 0.00 64.05 60.65 2c91 n THR 41 Cb 0.50 0.00 -0.04 0.00 -1.55 0.00 0.00 70.33 69.24 2c91 n THR 41 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2c91 s ALA 42 N -2.00 -1.75 0.31 1.79 0.00 -1.26 -3.87 121.76 114.98 2c91 s ALA 42 Ca 0.00 1.10 0.07 0.00 0.00 0.00 0.00 51.96 53.13 2c91 s ALA 42 Cb 0.00 0.20 0.81 0.00 0.00 0.00 0.00 23.12 24.13 2c91 s ALA 42 CO 0.00 -0.50 1.72 0.35 0.00 0.00 0.00 175.76 177.33 2c91 h PHE 43 N 2.58 0.90 -0.51 0.00 3.57 -1.76 -2.81 116.94 118.91 2c91 h PHE 43 Ca -0.27 0.04 -0.06 0.00 3.53 0.00 0.00 57.97 61.20 2c91 h PHE 43 Cb 1.20 -0.25 -0.02 0.00 2.79 0.00 0.00 35.95 39.67 2c91 h PHE 43 CO 0.32 0.05 0.07 1.98 -2.23 0.00 0.00 178.31 178.50 2c91 h MET 44 N 0.54 0.81 -6.26 1.11 4.05 -1.96 -3.28 114.93 109.94 2c91 h MET 44 Ca 0.61 -0.19 -0.55 0.00 -0.28 0.00 0.00 59.70 59.29 2c91 h MET 44 Cb 1.12 -0.11 -0.00 0.00 -0.80 0.00 0.00 31.60 31.81 2c91 h MET 44 CO -0.48 0.77 1.17 0.71 0.23 0.00 0.00 176.91 179.31 2c91 s TYR 45 N -5.11 1.76 -1.39 1.39 2.02 -1.06 -2.64 117.35 112.32 2c91 s TYR 45 Ca -0.10 0.14 -0.08 0.00 -0.37 0.00 0.00 57.07 56.66 2c91 s TYR 45 Cb 0.15 -4.01 0.03 0.00 -0.40 0.00 0.00 41.96 37.73 2c91 s TYR 45 CO 0.80 -4.11 0.99 0.00 -1.57 0.00 0.00 175.55 171.66 2c91 n ASP 47 N -2.97 -5.44 0.00 0.00 2.03 -1.08 -1.04 116.55 108.04 2c91 n ASP 47 Ca -0.08 -0.08 0.00 0.00 0.52 0.00 0.00 54.79 55.15 2c91 n ASP 47 Cb 0.59 -4.50 0.00 0.00 -0.72 0.00 0.00 41.12 36.49 2c91 n ASP 47 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2c91 n GLY 48 N -1.13 0.74 0.14 0.27 0.00 -0.78 -4.98 105.19 99.45 2c91 n GLY 48 Ca -0.18 0.00 0.01 0.00 0.00 0.00 0.00 46.02 45.85 2c91 n GLY 48 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2c91 h GLN 49 N 4.13 0.00 -0.17 1.61 1.08 -0.94 -1.47 115.11 119.35 2c91 h GLN 49 Ca 0.00 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.19 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 0.58 0.06 1.03 -0.95 0.00 0.00 178.83 179.55 2c91 h SER 50 N 0.00 0.24 -0.69 1.46 0.87 -1.37 0.04 113.55 114.10 2c91 h SER 50 Ca -0.01 -0.18 -0.05 0.00 -1.23 0.00 0.00 61.79 60.32 2c91 h SER 50 Cb 1.14 -0.06 -0.03 0.00 -0.44 0.00 0.00 62.40 63.01 2c91 h SER 50 CO 0.07 0.36 0.25 -0.33 -0.53 0.00 0.00 176.83 176.65 2c91 h GLU 51 N 0.10 1.05 -0.18 2.24 5.08 -1.77 -2.29 114.58 118.81 2c91 h GLU 51 Ca 0.06 -0.21 -0.00 0.00 -1.00 0.00 0.00 59.36 58.21 2c91 h GLU 51 Cb 0.20 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 2c91 h GLU 51 CO -0.00 0.89 0.10 -0.91 -1.00 0.00 0.00 179.01 178.09 2c91 h ASN 52 N 0.99 0.22 -0.21 1.42 -0.26 -1.09 -0.46 115.58 116.19 2c91 h ASN 52 Ca 0.23 -0.06 0.05 0.00 -0.56 0.00 0.00 56.30 55.95 2c91 h ASN 52 Cb 0.25 -0.06 -0.05 0.00 -1.06 0.00 0.00 38.32 37.41 2c91 h ASN 52 CO -0.01 0.22 -0.10 0.40 -1.06 0.00 0.00 177.43 176.88 2c91 h ILE 53 N 0.20 0.69 -0.79 2.81 2.04 -0.95 -2.16 117.51 119.36 2c91 h ILE 53 Ca 0.06 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.91 2c91 h ILE 53 Cb 0.04 0.69 -0.04 0.00 -0.74 0.00 0.00 36.82 36.78 2c91 h ILE 53 CO -0.01 0.00 0.45 -0.07 0.00 0.00 0.00 178.15 178.52 2c91 h LEU 54 N -0.07 0.97 -1.58 1.44 3.38 -1.25 -2.20 115.31 115.99 2c91 h LEU 54 Ca 0.11 -0.07 -0.05 0.00 0.09 0.00 0.00 57.88 57.96 2c91 h LEU 54 Cb 0.24 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 2c91 h LEU 54 CO -0.25 0.76 -0.22 1.23 0.09 0.00 0.00 178.44 180.05 2c91 h GLY 55 N 1.12 0.00 1.16 0.83 0.00 -0.71 -2.90 103.07 102.57 2c91 h GLY 55 Ca 0.28 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.61 2c91 h GLY 55 CO -0.05 0.00 -0.12 0.61 0.00 0.00 0.00 176.54 176.98 2c91 n GLY 56 N -0.66 -1.10 0.00 4.60 0.00 -0.84 -4.04 105.19 103.15 2c91 n GLY 56 Ca -0.02 -0.24 0.14 0.00 0.00 0.00 0.00 46.02 45.91 2c91 n GLY 56 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2c91 n LEU 57 N -1.14 0.00 -3.18 0.99 4.77 -1.09 -4.90 117.00 112.45 2c91 n LEU 57 Ca 0.12 0.24 -0.19 0.00 -0.03 0.00 0.00 56.01 56.15 2c91 n LEU 57 Cb 0.29 -0.24 0.07 0.00 -2.33 0.00 0.00 43.42 41.21 2c91 n LEU 57 CO 0.25 -0.01 0.19 0.61 -1.33 0.00 0.00 177.39 177.10 2c91 n GLY 58 N 1.09 -0.33 0.65 -0.72 0.00 -1.26 -4.93 105.19 99.70 2c91 n GLY 58 Ca 0.15 0.11 0.13 0.00 0.00 0.00 0.00 46.02 46.41 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 -4.25 2.00 -3.67 0.99 4.77 -1.26 -4.97 117.00 110.61 2c91 n LEU 59 Ca -0.06 -0.70 -0.21 0.00 -0.03 0.00 0.00 56.01 55.02 2c91 n LEU 59 Cb 0.58 -0.02 0.04 0.00 -2.33 0.00 0.00 43.42 41.69 2c91 n LEU 59 CO 0.56 0.35 -0.05 0.61 -1.33 0.00 0.00 177.39 177.53 2c91 n GLY 60 N 1.23 -0.30 3.77 -0.72 0.00 -1.26 -4.84 105.19 103.07 2c91 n GLY 60 Ca 0.17 0.12 -0.39 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 -6.64 4.18 0.00 0.99 1.43 -1.26 -3.02 118.68 114.36 2c91 s LEU 61 Ca 0.00 2.67 0.00 0.00 -1.03 0.00 0.00 54.13 55.77 2c91 s LEU 61 Cb -0.00 -3.93 0.00 0.00 0.03 0.00 0.00 46.19 42.28 2c91 s LEU 61 CO 0.80 -0.91 0.00 0.61 0.23 0.00 0.00 176.35 177.08 2c91 n GLY 62 N 0.65 0.38 2.80 -3.19 0.00 -1.25 -4.34 105.19 100.23 2c91 n GLY 62 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 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 -0.22 6.94 -1.37 1.61 3.41 -1.17 -4.46 113.62 118.36 2c91 n SER 63 Ca 0.00 -3.55 -0.18 0.00 -0.26 0.00 0.00 58.87 54.88 2c91 n SER 63 Cb 0.11 -1.22 -0.02 0.00 -0.26 0.00 0.00 64.21 62.81 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 0.63 -0.07 0.00 5.00 0.00 -1.26 -3.39 105.19 106.10 2c91 n GLY 64 Ca 0.38 0.24 0.00 0.00 0.00 0.00 0.00 46.02 46.64 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 0.54 0.00 -3.68 1.61 8.00 -1.26 -5.12 116.55 116.63 2c91 n ASP 65 Ca 0.06 0.00 -0.11 0.00 0.71 0.00 0.00 54.79 55.45 2c91 n ASP 65 Cb 0.02 0.00 -0.12 0.00 -0.02 0.00 0.00 41.12 41.00 2c91 n ASP 65 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2c91 h THR 67 N 6.03 0.86 -3.46 0.00 1.03 -1.92 -3.45 112.91 112.00 2c91 h THR 67 Ca -0.24 -2.52 -0.53 0.00 -0.01 0.00 0.00 66.41 63.11 2c91 h THR 67 Cb 1.13 2.66 -0.02 0.00 -1.07 0.00 0.00 68.15 70.85 2c91 h THR 67 CO 0.21 0.84 0.35 -0.69 -0.01 0.00 0.00 175.52 176.22 2c91 s VAL 68 N -2.58 4.76 -0.09 0.00 1.01 -1.26 -4.88 120.40 117.36 2c91 s VAL 68 Ca -0.16 2.03 -0.02 0.00 0.00 0.00 0.00 61.98 63.82 2c91 s VAL 68 Cb 0.06 -4.30 -0.03 0.00 0.00 0.00 0.00 36.38 32.11 2c91 s VAL 68 CO 0.82 0.22 0.00 -0.54 0.00 0.00 0.00 175.10 175.60 2c91 s LYS 69 N 0.65 3.03 -0.06 2.72 -0.14 0.04 -4.66 119.74 121.31 2c91 s LYS 69 Ca 0.49 -0.41 0.05 0.00 -1.36 0.00 0.00 55.97 54.75 2c91 s LYS 69 Cb -0.22 -2.80 -0.01 0.00 -1.68 0.00 0.00 37.83 33.12 2c91 s LYS 69 CO 0.28 0.68 -0.23 -1.50 -0.76 0.00 0.00 175.35 173.82 2c91 s ILE 70 N -0.81 2.26 -0.04 2.17 1.10 -1.26 -1.24 121.20 123.38 2c91 s ILE 70 Ca 0.12 -0.99 0.05 0.00 -0.51 0.00 0.00 60.65 59.32 2c91 s ILE 70 Cb -0.11 -1.84 -0.02 0.00 0.15 0.00 0.00 42.46 40.63 2c91 s ILE 70 CO 0.02 0.57 -0.19 0.00 -2.11 0.00 0.00 174.94 173.23 2c91 s ALA 71 N -0.19 2.47 0.28 1.50 0.00 -0.42 -1.46 121.76 123.94 2c91 s ALA 71 Ca -0.02 -1.03 0.04 0.00 0.00 0.00 0.00 51.96 50.95 2c91 s ALA 71 Cb -0.14 -0.82 -0.01 0.00 0.00 0.00 0.00 23.12 22.15 2c91 s ALA 71 CO 0.03 0.53 0.13 -2.37 0.00 0.00 0.00 175.76 174.09 2c91 n THR 72 N 2.42 0.00 -3.74 0.00 5.66 -0.71 -0.72 114.28 117.19 2c91 n THR 72 Ca -0.17 -1.71 -0.13 0.00 -3.05 0.00 0.00 64.05 58.98 2c91 n THR 72 Cb 0.52 0.69 -0.09 0.00 -1.55 0.00 0.00 70.33 69.89 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 -3.07 0.59 -0.08 1.09 1.02 -1.25 -0.83 119.74 117.22 2c91 s LYS 73 Ca 0.19 0.14 -0.02 0.00 0.02 0.00 0.00 55.97 56.30 2c91 s LYS 73 Cb 0.01 0.27 -0.04 0.00 -0.52 0.00 0.00 37.83 37.56 2c91 s LYS 73 CO 0.13 -0.13 0.04 0.00 -0.92 0.00 0.00 175.35 174.46 2c91 s ALA 74 N -0.66 3.42 0.14 5.17 0.00 -0.43 -1.93 121.76 127.47 2c91 s ALA 74 Ca -0.08 -0.79 0.06 0.00 0.00 0.00 0.00 51.96 51.15 2c91 s ALA 74 Cb -0.04 -1.57 -0.04 0.00 0.00 0.00 0.00 23.12 21.47 2c91 s ALA 74 CO 0.03 0.61 -0.13 0.54 0.00 0.00 0.00 175.76 176.80 2c91 s ASN 75 N -1.05 2.05 0.00 0.00 2.20 -1.26 -0.81 114.94 116.07 2c91 s ASN 75 Ca 0.15 -0.87 0.29 0.00 -0.94 0.00 0.00 52.86 51.48 2c91 s ASN 75 Cb -0.12 -0.07 1.19 0.00 -2.00 0.00 0.00 41.25 40.25 2c91 s ASN 75 CO 0.04 -0.18 1.82 -0.81 -2.94 0.00 0.00 177.10 175.04 2c91 n PRO 76 N 0.28 1.42 -1.39 3.55 -0.04 -1.26 -4.40 135.00 133.16 2c91 n PRO 76 Ca -0.14 -0.71 -0.30 0.00 -0.04 0.00 0.00 63.50 62.31 2c91 n PRO 76 Cb 0.58 -1.49 0.11 0.00 -0.04 0.00 0.00 33.50 32.66 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 -2.07 2.61 -1.53 0.54 0.51 -1.26 -1.28 118.94 116.46 2c91 s TRP 77 Ca 0.38 1.23 -0.14 0.00 -2.12 0.00 0.00 56.10 55.46 2c91 s TRP 77 Cb 0.21 -3.12 0.09 0.00 -0.81 0.00 0.00 33.47 29.84 2c91 s TRP 77 CO 0.36 -2.01 0.91 0.39 -0.51 0.00 0.00 176.95 176.10 2c91 n GLU 78 N -3.61 -5.10 -0.46 4.98 1.02 -1.26 -1.60 120.64 114.61 2c91 n GLU 78 Ca 0.07 0.58 0.00 0.00 -0.02 0.00 0.00 57.16 57.79 2c91 n GLU 78 Cb 0.55 -5.44 0.00 0.00 -0.02 0.00 0.00 31.44 26.53 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 -1.61 0.75 0.19 0.62 0.00 -1.25 -4.96 105.19 98.93 2c91 n GLY 79 Ca 0.04 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.86 2c91 n GLY 79 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2c91 h LYS 80 N 4.03 0.68 -1.85 1.61 1.57 -0.96 -3.50 116.57 118.15 2c91 h LYS 80 Ca 0.00 -0.73 0.20 0.00 -1.87 0.00 0.00 60.65 58.25 2c91 h LYS 80 Cb 0.00 0.21 -0.08 0.00 0.08 0.00 0.00 32.23 32.43 2c91 h LYS 80 CO 0.00 1.31 -0.53 -1.13 -0.57 0.00 0.00 179.45 178.53 2c91 n SER 81 N -3.84 -4.67 -1.79 0.86 3.41 -0.41 -4.58 113.62 102.60 2c91 n SER 81 Ca -0.11 0.60 -0.07 0.00 -0.26 0.00 0.00 58.87 59.03 2c91 n SER 81 Cb 0.88 -2.58 0.26 0.00 -0.26 0.00 0.00 64.21 62.51 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 -3.46 5.67 -4.65 1.04 4.77 -1.26 -4.30 117.00 114.81 2c91 n LEU 82 Ca -0.03 -3.36 -0.35 0.00 -0.03 0.00 0.00 56.01 52.25 2c91 n LEU 82 Cb 0.37 -0.72 0.10 0.00 -2.33 0.00 0.00 43.42 40.83 2c91 n LEU 82 CO 0.02 0.91 0.65 0.29 -1.33 0.00 0.00 177.39 177.92 2c91 n LYS 83 N -0.53 0.46 -0.28 3.23 4.76 -1.26 -4.32 118.16 120.22 2c91 n LYS 83 Ca 0.41 0.22 0.08 0.00 -2.87 0.00 0.00 58.31 56.15 2c91 n LYS 83 Cb 1.33 -2.33 0.21 0.00 -1.84 0.00 0.00 35.03 32.40 2c91 n LYS 83 CO 0.00 0.00 0.00 -1.35 -1.37 0.00 0.00 177.40 174.68 2c91 h PRO 84 N -0.40 0.11 -0.37 1.97 0.11 -1.92 -1.32 132.00 130.18 2c91 h PRO 84 Ca -0.47 -0.01 -0.08 0.00 0.11 0.00 0.00 66.00 65.55 2c91 h PRO 84 Cb 1.32 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 32.39 2c91 h PRO 84 CO 0.47 0.07 -0.11 -0.44 -0.21 0.00 0.00 178.00 177.78 2c91 h ASP 85 N 0.11 0.63 0.04 -2.05 3.32 -1.98 -2.24 116.42 114.26 2c91 h ASP 85 Ca 0.47 -0.18 -0.00 0.00 0.02 0.00 0.00 57.03 57.34 2c91 h ASP 85 Cb 0.88 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 40.27 2c91 h ASP 85 CO -0.71 0.78 -0.02 -1.28 -1.72 0.00 0.00 179.24 176.28 2c91 h SER 86 N 0.59 -0.05 -0.89 6.45 0.87 -1.63 -0.88 113.55 118.01 2c91 h SER 86 Ca 0.11 -0.34 -0.01 0.00 -1.23 0.00 0.00 61.79 60.31 2c91 h SER 86 Cb 0.54 0.01 -0.04 0.00 -0.44 0.00 0.00 62.40 62.47 2c91 h SER 86 CO 0.03 0.31 0.50 0.16 -0.53 0.00 0.00 176.83 177.31 2c91 h ILE 87 N -0.42 1.26 -0.31 2.23 3.07 -1.23 -1.29 117.51 120.81 2c91 h ILE 87 Ca -0.01 -0.62 0.02 0.00 1.55 0.00 0.00 64.86 65.81 2c91 h ILE 87 Cb 0.38 0.04 -0.03 0.00 -0.27 0.00 0.00 36.82 36.95 2c91 h ILE 87 CO 0.01 0.28 0.15 -0.09 -1.05 0.00 0.00 178.15 177.45 2c91 h ARG 88 N 1.24 0.30 -0.29 0.16 2.43 -1.38 -0.59 114.38 116.25 2c91 h ARG 88 Ca 0.31 -0.02 0.01 0.00 -0.81 0.00 0.00 59.98 59.47 2c91 h ARG 88 Cb 0.01 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.48 2c91 h ARG 88 CO -0.05 0.20 0.18 1.03 -1.51 0.00 0.00 179.97 179.81 2c91 h SER 89 N 0.31 0.30 0.02 -3.80 0.87 -0.73 0.13 113.55 110.65 2c91 h SER 89 Ca 0.13 -0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.69 2c91 h SER 89 Cb 0.06 -0.07 0.00 0.00 -0.44 0.00 0.00 62.40 61.95 2c91 h SER 89 CO -0.10 0.22 -0.01 1.56 -0.53 0.00 0.00 176.83 177.97 2c91 h GLN 90 N 0.36 -0.02 -0.21 2.24 4.20 -1.12 0.39 115.11 120.95 2c91 h GLN 90 Ca 0.11 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.82 2c91 h GLN 90 Cb -0.02 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.75 2c91 h GLN 90 CO -0.04 0.10 0.13 1.25 -0.67 0.00 0.00 178.83 179.60 2c91 h LEU 91 N -0.14 0.25 -0.98 1.46 5.85 -0.94 0.16 115.31 120.96 2c91 h LEU 91 Ca -0.00 -0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.67 2c91 h LEU 91 Cb 0.13 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 41.06 2c91 h LEU 91 CO 0.00 0.21 0.49 -0.33 -0.34 0.00 0.00 178.44 178.48 2c91 h GLU 92 N 0.26 1.20 -0.12 1.25 5.08 -0.92 0.03 114.58 121.36 2c91 h GLU 92 Ca 0.07 -0.13 -0.00 0.00 -1.00 0.00 0.00 59.36 58.30 2c91 h GLU 92 Cb 0.01 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.01 2c91 h GLU 92 CO -0.01 0.87 0.07 1.15 -1.00 0.00 0.00 179.01 180.09 2c91 h THR 93 N 1.21 1.07 -0.43 1.13 2.02 -0.59 -2.22 112.91 115.11 2c91 h THR 93 Ca 0.31 -0.19 0.06 0.00 0.77 0.00 0.00 66.41 67.36 2c91 h THR 93 Cb 0.00 0.98 -0.05 0.00 -1.74 0.00 0.00 68.15 67.34 2c91 h THR 93 CO -0.05 0.07 0.12 0.28 0.37 0.00 0.00 175.52 176.30 2c91 h SER 94 N 0.12 0.08 -0.93 4.18 0.02 -0.07 -1.80 113.55 115.16 2c91 h SER 94 Ca 0.04 0.06 0.09 0.00 -0.84 0.00 0.00 61.79 61.14 2c91 h SER 94 Cb 0.05 0.07 -0.07 0.00 0.14 0.00 0.00 62.40 62.59 2c91 h SER 94 CO -0.01 0.08 0.60 -0.07 -1.14 0.00 0.00 176.83 176.29 2c91 h LEU 95 N 0.27 0.88 -0.18 5.07 3.38 -0.90 0.22 115.31 124.03 2c91 h LEU 95 Ca 0.21 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.18 2c91 h LEU 95 Cb 0.23 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 2c91 h LEU 95 CO -0.24 0.53 0.05 0.50 0.09 0.00 0.00 178.44 179.37 2c91 h LYS 96 N 0.97 0.29 -0.38 1.13 3.64 -0.82 -0.51 116.57 120.88 2c91 h LYS 96 Ca 0.42 -0.07 -0.12 0.00 -1.27 0.00 0.00 60.65 59.61 2c91 h LYS 96 Cb 0.34 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.11 2c91 h LYS 96 CO -0.18 0.41 -0.26 0.00 -2.27 0.00 0.00 179.45 177.15 2c91 h ARG 97 N 0.11 0.79 0.00 1.90 3.08 -0.67 -1.82 114.38 117.77 2c91 h ARG 97 Ca 0.06 -0.34 0.00 0.00 0.07 0.00 0.00 59.98 59.77 2c91 h ARG 97 Cb 0.25 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.27 2c91 h ARG 97 CO -0.00 0.96 0.00 1.28 -1.07 0.00 0.00 179.97 181.14 2c91 n LEU 98 N -4.10 0.00 -3.77 3.04 4.77 0.71 -3.91 117.00 113.74 2c91 n LEU 98 Ca -0.00 0.33 -0.23 0.00 -0.03 0.00 0.00 56.01 56.08 2c91 n LEU 98 Cb 0.45 -0.33 0.02 0.00 -2.33 0.00 0.00 43.42 41.23 2c91 n LEU 98 CO 0.45 -0.09 -0.11 0.00 -1.33 0.00 0.00 177.39 176.32 2c91 n GLN 99 N -1.33 -4.49 -3.94 3.23 6.02 -0.68 -4.36 117.38 111.83 2c91 n GLN 99 Ca 0.09 0.56 -0.09 0.00 -0.01 0.00 0.00 57.00 57.55 2c91 n GLN 99 Cb 0.19 -5.01 -0.10 0.00 1.02 0.00 0.00 30.24 26.34 2c91 n GLN 99 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2c91 h PRO 101 N 3.82 0.00 -1.66 0.00 0.13 -1.82 -3.42 132.00 129.05 2c91 h PRO 101 Ca -0.32 0.00 0.14 0.00 -0.87 0.00 0.00 66.00 64.95 2c91 h PRO 101 Cb 1.19 0.00 -0.21 0.00 0.13 0.00 0.00 31.00 32.11 2c91 h PRO 101 CO 0.49 0.00 0.64 -0.98 -0.23 0.00 0.00 178.00 177.92 2c91 s ARG 102 N -3.16 0.53 0.13 0.86 1.70 -1.26 -4.65 118.95 113.08 2c91 s ARG 102 Ca 0.09 -0.03 0.03 0.00 -0.47 0.00 0.00 55.73 55.34 2c91 s ARG 102 Cb 0.09 0.24 -0.04 0.00 -0.57 0.00 0.00 34.95 34.68 2c91 s ARG 102 CO 0.63 -0.20 0.19 0.14 -1.08 0.00 0.00 175.30 174.98 2c91 s VAL 103 N -1.87 4.97 0.20 4.99 -7.23 -0.87 -3.87 120.40 116.72 2c91 s VAL 103 Ca 0.03 -0.76 0.09 0.00 -1.81 0.00 0.00 61.98 59.53 2c91 s VAL 103 Cb -0.01 -3.50 -0.11 0.00 0.56 0.00 0.00 36.38 33.32 2c91 s VAL 103 CO -0.03 -0.02 1.46 0.44 -0.31 0.00 0.00 175.10 176.64 2c91 h ASP 104 N 2.58 0.00 -3.32 4.85 3.32 -1.59 -1.02 116.42 121.24 2c91 h ASP 104 Ca -0.47 0.00 -0.25 0.00 0.02 0.00 0.00 57.03 56.32 2c91 h ASP 104 Cb 1.18 0.00 -0.33 0.00 0.22 0.00 0.00 39.33 40.41 2c91 h ASP 104 CO 0.68 0.79 -0.60 -0.22 -1.72 0.00 0.00 179.24 178.17 2c91 s LEU 105 N -7.20 0.46 -0.16 1.55 2.96 -0.95 -0.88 118.68 114.45 2c91 s LEU 105 Ca -0.00 0.33 0.00 0.00 -0.22 0.00 0.00 54.13 54.24 2c91 s LEU 105 Cb 0.11 0.37 0.03 0.00 0.50 0.00 0.00 46.19 47.20 2c91 s LEU 105 CO 0.79 -0.18 -0.14 0.12 -1.32 0.00 0.00 176.35 175.62 2c91 s PHE 106 N 1.52 2.27 0.04 5.38 5.36 -0.10 -1.74 117.98 130.72 2c91 s PHE 106 Ca -0.06 -1.33 0.01 0.00 -0.96 0.00 0.00 56.93 54.60 2c91 s PHE 106 Cb -0.12 -1.64 -0.04 0.00 -0.34 0.00 0.00 43.02 40.89 2c91 s PHE 106 CO -0.06 -0.70 0.10 0.71 -1.46 0.00 0.00 175.22 173.81 2c91 s TYR 107 N 1.45 3.27 -0.35 10.12 2.02 -0.01 -1.24 117.35 132.61 2c91 s TYR 107 Ca 0.04 0.15 -0.29 0.00 -0.37 0.00 0.00 57.07 56.60 2c91 s TYR 107 Cb -0.13 -1.68 0.02 0.00 -0.40 0.00 0.00 41.96 39.76 2c91 s TYR 107 CO -0.10 0.54 1.07 -0.51 -1.57 0.00 0.00 175.55 174.97 2c91 s LEU 108 N -2.15 3.89 0.13 -1.29 1.43 -0.70 -1.32 118.68 118.68 2c91 s LEU 108 Ca 0.28 0.91 -0.11 0.00 -1.03 0.00 0.00 54.13 54.18 2c91 s LEU 108 Cb -0.12 -3.51 -0.07 0.00 0.03 0.00 0.00 46.19 42.52 2c91 s LEU 108 CO 0.20 -0.93 1.41 -0.74 0.23 0.00 0.00 176.35 176.52 2c91 h HIS 109 N 8.30 1.08 -2.50 0.29 2.76 -1.22 -1.67 115.15 122.19 2c91 h HIS 109 Ca -0.21 -0.38 -0.05 0.00 -2.20 0.00 0.00 60.37 57.53 2c91 h HIS 109 Cb 1.06 -0.20 -0.16 0.00 1.55 0.00 0.00 27.41 29.66 2c91 h HIS 109 CO 0.85 1.21 0.17 0.00 -1.30 0.00 0.00 177.93 178.86 2c91 s ALA 110 N -4.12 -1.63 0.55 5.26 0.00 -1.23 -4.27 121.76 116.31 2c91 s ALA 110 Ca -0.10 0.89 -0.21 0.00 0.00 0.00 0.00 51.96 52.54 2c91 s ALA 110 Cb 0.10 0.39 -0.05 0.00 0.00 0.00 0.00 23.12 23.57 2c91 s ALA 110 CO 0.89 -0.54 1.28 -2.14 0.00 0.00 0.00 175.76 175.25 2c91 s PRO 111 N -2.35 3.18 -0.45 0.00 0.02 -1.26 -4.59 135.00 129.56 2c91 s PRO 111 Ca -0.06 2.04 -0.05 0.00 0.02 0.00 0.00 61.00 62.96 2c91 s PRO 111 Cb -0.00 -2.18 0.12 0.00 0.02 0.00 0.00 34.50 32.45 2c91 s PRO 111 CO -0.00 -1.10 0.27 0.34 -0.33 0.00 0.00 177.00 176.17 2c91 s ASP 112 N -1.21 5.40 0.00 2.53 2.15 -1.26 -4.87 116.67 119.41 2c91 s ASP 112 Ca 0.72 -2.06 0.23 0.00 0.43 0.00 0.00 52.55 51.87 2c91 s ASP 112 Cb -0.36 -1.89 1.16 0.00 -0.30 0.00 0.00 42.92 41.53 2c91 s ASP 112 CO 0.41 -0.58 1.76 1.41 -0.17 0.00 0.00 175.17 178.01 2c91 n HIS 113 N 4.60 0.00 1.07 -5.34 8.25 -1.26 -2.04 115.22 120.50 2c91 n HIS 113 Ca -0.03 0.00 0.12 0.00 -0.26 0.00 0.00 57.72 57.55 2c91 n HIS 113 Cb 0.41 -0.30 0.12 0.00 1.12 0.00 0.00 29.99 31.34 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 -1.30 1.23 -4.18 0.41 7.64 -1.26 -4.84 113.62 111.31 2c91 n SER 114 Ca 0.11 -0.98 -0.33 0.00 1.01 0.00 0.00 58.87 58.67 2c91 n SER 114 Cb 0.19 0.46 -0.16 0.00 -1.01 0.00 0.00 64.21 63.69 2c91 n SER 114 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2c91 s THR 115 N -2.70 2.31 0.11 0.44 2.01 -0.86 -5.09 115.64 111.86 2c91 s THR 115 Ca 0.16 -0.88 -0.35 0.00 0.31 0.00 0.00 61.69 60.94 2c91 s THR 115 Cb 0.18 -1.97 -0.15 0.00 0.01 0.00 0.00 72.50 70.57 2c91 s THR 115 CO 0.65 0.53 1.50 -2.65 -0.69 0.00 0.00 174.62 173.95 2c91 n PRO 116 N 4.34 1.73 0.24 4.92 -0.02 -1.26 -4.83 135.00 140.11 2c91 n PRO 116 Ca -0.20 0.62 0.07 0.00 -2.02 0.00 0.00 63.50 61.97 2c91 n PRO 116 Cb 0.51 -2.34 0.56 0.00 -0.02 0.00 0.00 33.50 32.21 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 3.61 1.07 -0.91 -1.45 3.04 -1.98 -1.61 116.25 118.01 2c91 h VAL 117 Ca -0.46 -0.35 0.02 0.00 -1.01 0.00 0.00 66.70 64.89 2c91 h VAL 117 Cb 1.29 1.19 -0.05 0.00 -2.01 0.00 0.00 31.29 31.71 2c91 h VAL 117 CO 0.85 0.10 0.60 -0.33 -1.01 0.00 0.00 177.57 177.78 2c91 h GLU 118 N 0.00 1.16 0.20 4.17 3.07 -1.99 0.99 114.58 122.18 2c91 h GLU 118 Ca -0.00 -0.07 -0.01 0.00 -0.50 0.00 0.00 59.36 58.78 2c91 h GLU 118 Cb 0.18 -0.26 -0.00 0.00 -0.84 0.00 0.00 28.75 27.83 2c91 h GLU 118 CO 0.01 0.77 -0.11 0.93 -1.40 0.00 0.00 179.01 179.21 2c91 h GLU 119 N 1.20 -0.28 -0.27 2.33 5.08 -1.66 -0.71 114.58 120.26 2c91 h GLU 119 Ca 0.35 0.02 0.02 0.00 -1.00 0.00 0.00 59.36 58.75 2c91 h GLU 119 Cb -0.07 0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.22 2c91 h GLU 119 CO -0.09 -0.19 0.12 1.15 -1.00 0.00 0.00 179.01 179.00 2c91 h THR 120 N -0.29 0.96 -0.56 1.13 2.02 -1.47 -2.16 112.91 112.55 2c91 h THR 120 Ca -0.02 -0.09 -0.03 0.00 0.77 0.00 0.00 66.41 67.04 2c91 h THR 120 Cb 0.23 0.69 -0.02 0.00 -1.74 0.00 0.00 68.15 67.31 2c91 h THR 120 CO 0.03 0.05 0.23 -0.07 0.37 0.00 0.00 175.52 176.13 2c91 h LEU 121 N 0.25 0.76 -0.44 2.58 3.38 -0.66 -0.71 115.31 120.48 2c91 h LEU 121 Ca 0.12 -0.17 0.05 0.00 0.09 0.00 0.00 57.88 57.97 2c91 h LEU 121 Cb 0.06 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 40.56 2c91 h LEU 121 CO -0.10 0.72 0.17 0.00 0.09 0.00 0.00 178.44 179.32 2c91 h ALA 123 N 1.28 0.62 -0.86 0.00 0.00 -0.93 -1.68 119.26 117.70 2c91 h ALA 123 Ca 0.20 -0.09 0.07 0.00 0.00 0.00 0.00 54.91 55.10 2c91 h ALA 123 Cb 0.19 -0.19 -0.07 0.00 0.00 0.00 0.00 17.79 17.72 2c91 h ALA 123 CO -0.20 0.15 0.52 0.00 0.00 0.00 0.00 179.25 179.72 2c91 h HIS 125 N 0.93 0.78 -0.29 0.00 6.17 -0.33 -1.37 115.15 121.04 2c91 h HIS 125 Ca 0.39 -0.06 0.05 0.00 0.71 0.00 0.00 60.37 61.46 2c91 h HIS 125 Cb 0.23 -0.24 -0.05 0.00 2.52 0.00 0.00 27.41 29.88 2c91 h HIS 125 CO -0.04 0.64 -0.01 0.37 0.71 0.00 0.00 177.93 179.60 2c91 h GLN 126 N 0.70 0.07 -0.73 5.26 4.15 -0.74 0.03 115.11 123.84 2c91 h GLN 126 Ca 0.17 -0.00 -0.04 0.00 0.77 0.00 0.00 58.65 59.55 2c91 h GLN 126 Cb 0.18 -0.01 -0.03 0.00 0.21 0.00 0.00 27.48 27.82 2c91 h GLN 126 CO -0.02 0.04 0.28 -0.07 -1.93 0.00 0.00 178.83 177.14 2c91 h LEU 127 N 0.07 1.00 -0.37 -2.39 3.38 -1.01 -1.78 115.31 114.21 2c91 h LEU 127 Ca 0.14 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 2c91 h LEU 127 Cb 0.19 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 2c91 h LEU 127 CO -0.25 0.89 0.21 -0.74 0.09 0.00 0.00 178.44 178.64 2c91 h HIS 128 N 1.06 0.50 -0.50 1.13 2.76 -0.84 -1.84 115.15 117.42 2c91 h HIS 128 Ca 0.24 -0.01 0.06 0.00 -2.20 0.00 0.00 60.37 58.46 2c91 h HIS 128 Cb 0.21 -0.16 -0.03 0.00 1.55 0.00 0.00 27.41 28.98 2c91 h HIS 128 CO 0.02 0.38 0.34 1.96 -1.30 0.00 0.00 177.93 179.32 2c91 h GLN 129 N 0.47 0.43 0.00 5.26 1.08 -0.37 0.42 115.11 122.41 2c91 h GLN 129 Ca 0.13 -0.03 0.00 0.00 -1.45 0.00 0.00 58.65 57.30 2c91 h GLN 129 Cb 0.04 -0.10 0.00 0.00 -0.05 0.00 0.00 27.48 27.37 2c91 h GLN 129 CO -0.02 0.29 0.00 0.39 -0.95 0.00 0.00 178.83 178.53 2c91 n GLU 130 N -4.47 0.18 -0.42 1.46 1.02 -0.73 -4.90 120.64 112.78 2c91 n GLU 130 Ca 0.07 0.10 0.00 0.00 -0.02 0.00 0.00 57.16 57.30 2c91 n GLU 130 Cb 0.24 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.16 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 0.68 0.78 0.20 0.62 0.00 0.14 -4.97 105.19 102.65 2c91 n GLY 131 Ca 0.08 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.22 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 2.80 0.00 -3.28 1.61 1.57 -1.50 -3.43 116.57 114.35 2c91 h LYS 132 Ca 0.00 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.69 2c91 h LYS 132 Cb 0.00 0.00 -0.17 0.00 0.08 0.00 0.00 32.23 32.14 2c91 h LYS 132 CO 0.00 0.00 -0.24 -0.59 -0.57 0.00 0.00 179.45 178.05 2c91 s PHE 133 N -3.20 -0.12 -0.15 -1.35 -0.71 -1.26 -2.04 117.98 109.15 2c91 s PHE 133 Ca 0.07 -0.01 -0.11 0.00 -1.04 0.00 0.00 56.93 55.85 2c91 s PHE 133 Cb 0.06 0.11 -0.07 0.00 -1.21 0.00 0.00 43.02 41.91 2c91 s PHE 133 CO 0.67 -0.51 -0.02 0.28 -1.34 0.00 0.00 175.22 174.30 2c91 h VAL 134 N 3.21 0.27 -3.73 -2.49 2.07 -1.25 -3.43 116.25 110.91 2c91 h VAL 134 Ca -0.32 -1.30 -0.68 0.00 0.82 0.00 0.00 66.70 65.23 2c91 h VAL 134 Cb 1.20 0.61 -0.18 0.00 -1.52 0.00 0.00 31.29 31.39 2c91 h VAL 134 CO 0.46 0.09 -0.77 -1.61 0.02 0.00 0.00 177.57 175.75 2c91 s GLU 135 N -2.14 2.02 -0.04 1.57 2.02 -0.06 -5.00 118.70 117.06 2c91 s GLU 135 Ca -0.15 -1.04 -0.09 0.00 0.02 0.00 0.00 54.97 53.70 2c91 s GLU 135 Cb 0.02 -2.22 -0.05 0.00 0.10 0.00 0.00 34.13 31.98 2c91 s GLU 135 CO 0.28 0.51 0.27 -1.17 0.02 0.00 0.00 175.26 175.17 2c91 s LEU 136 N -1.92 4.41 0.13 1.80 2.96 -1.26 -0.92 118.68 123.87 2c91 s LEU 136 Ca 0.18 0.66 0.04 0.00 -0.22 0.00 0.00 54.13 54.79 2c91 s LEU 136 Cb -0.11 -2.42 -0.04 0.00 0.50 0.00 0.00 46.19 44.12 2c91 s LEU 136 CO 0.10 0.34 -0.10 -0.83 -1.32 0.00 0.00 176.35 174.54 2c91 s GLY 137 N -1.24 0.99 0.15 7.98 0.00 -0.38 -0.70 107.32 114.12 2c91 s GLY 137 Ca 0.22 -1.43 0.10 0.00 0.00 0.00 0.00 44.72 43.61 2c91 s GLY 137 CO 0.10 -1.52 -0.24 1.08 0.00 0.00 0.00 173.10 172.53 2c91 s LEU 138 N -3.04 2.37 -0.04 0.66 1.43 -0.14 -1.72 118.68 118.20 2c91 s LEU 138 Ca 0.14 -0.79 -0.02 0.00 -1.03 0.00 0.00 54.13 52.43 2c91 s LEU 138 Cb 0.02 -1.09 0.02 0.00 0.03 0.00 0.00 46.19 45.18 2c91 s LEU 138 CO -0.00 0.11 0.09 -0.55 0.23 0.00 0.00 176.35 176.22 2c91 s SER 139 N -2.32 -0.06 -0.68 2.29 0.15 -0.63 -0.57 113.70 111.88 2c91 s SER 139 Ca 0.15 0.18 0.00 0.00 0.70 0.00 0.00 55.95 56.98 2c91 s SER 139 Cb -0.09 0.12 0.00 0.00 -1.71 0.00 0.00 66.02 64.35 2c91 s SER 139 CO 0.07 -0.08 0.00 0.59 1.20 0.00 0.00 173.24 175.02 2c91 n ASN 140 N 3.62 -3.97 -4.87 5.45 3.02 -1.24 -3.54 115.26 113.73 2c91 n ASN 140 Ca -0.20 0.16 -0.35 0.00 -0.03 0.00 0.00 54.58 54.16 2c91 n ASN 140 Cb 0.55 -2.04 -0.06 0.00 -0.61 0.00 0.00 39.78 37.63 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 -2.17 3.61 0.53 3.10 1.51 -1.26 -0.51 117.35 122.16 2c91 s TYR 141 Ca 0.00 0.75 -0.20 0.00 -1.01 0.00 0.00 57.07 56.62 2c91 s TYR 141 Cb 0.00 -2.12 -0.06 0.00 -0.11 0.00 0.00 41.96 39.66 2c91 s TYR 141 CO 0.00 0.58 1.10 0.00 -1.11 0.00 0.00 175.55 176.13 2c91 s ALA 142 N -1.29 2.74 0.27 3.71 0.00 -1.26 -4.73 121.76 121.20 2c91 s ALA 142 Ca 0.29 0.76 -0.03 0.00 0.00 0.00 0.00 51.96 52.97 2c91 s ALA 142 Cb -0.14 -3.33 0.57 0.00 0.00 0.00 0.00 23.12 20.21 2c91 s ALA 142 CO 0.16 -0.65 1.63 0.66 0.00 0.00 0.00 175.76 177.55 2c91 h SER 143 N 1.27 -0.26 0.29 0.00 4.64 -1.93 0.22 113.55 117.78 2c91 h SER 143 Ca -0.50 0.21 -0.09 0.00 -0.47 0.00 0.00 61.79 60.94 2c91 h SER 143 Cb 1.25 0.34 -0.01 0.00 -0.31 0.00 0.00 62.40 63.67 2c91 h SER 143 CO 0.57 -0.20 -0.39 4.11 -0.87 0.00 0.00 176.83 180.06 2c91 h TRP 144 N 0.12 0.16 -0.37 4.77 5.08 -1.94 -0.44 115.95 123.34 2c91 h TRP 144 Ca 0.48 -0.04 -0.14 0.00 1.08 0.00 0.00 58.89 60.27 2c91 h TRP 144 Cb 0.91 -0.04 -0.01 0.00 -3.00 0.00 0.00 29.16 27.03 2c91 h TRP 144 CO -0.39 0.52 -0.33 0.93 -1.28 0.00 0.00 178.44 177.89 2c91 h GLU 145 N 0.12 0.82 -0.15 0.12 5.08 -0.98 -1.86 114.58 117.74 2c91 h GLU 145 Ca 0.01 -0.40 0.01 0.00 -1.00 0.00 0.00 59.36 57.98 2c91 h GLU 145 Cb 0.75 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.98 2c91 h GLU 145 CO 0.06 1.03 0.08 0.28 -1.00 0.00 0.00 179.01 179.45 2c91 h VAL 146 N 0.69 1.00 -0.45 3.13 2.07 -0.57 -1.26 116.25 120.86 2c91 h VAL 146 Ca 0.07 -0.06 0.03 0.00 0.82 0.00 0.00 66.70 67.57 2c91 h VAL 146 Cb 0.88 0.83 -0.04 0.00 -1.52 0.00 0.00 31.29 31.45 2c91 h VAL 146 CO 0.08 0.03 0.24 0.00 0.02 0.00 0.00 177.57 177.94 2c91 h ALA 147 N 1.07 0.57 -0.64 1.67 0.00 -0.94 -0.09 119.26 120.91 2c91 h ALA 147 Ca 0.06 0.01 0.05 0.00 0.00 0.00 0.00 54.91 55.02 2c91 h ALA 147 Cb 0.01 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 17.66 2c91 h ALA 147 CO -0.04 -0.10 0.37 1.49 0.00 0.00 0.00 179.25 180.97 2c91 h GLU 148 N 0.48 0.68 0.23 0.00 4.81 -1.19 -1.30 114.58 118.28 2c91 h GLU 148 Ca 0.19 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.37 2c91 h GLU 148 Cb 0.07 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 29.30 2c91 h GLU 148 CO -0.12 0.45 -0.11 0.82 -0.73 0.00 0.00 179.01 179.32 2c91 h ILE 149 N 0.70 0.84 -0.90 2.32 2.04 -0.56 -0.55 117.51 121.39 2c91 h ILE 149 Ca 0.27 -0.37 -0.00 0.00 1.00 0.00 0.00 64.86 65.76 2c91 h ILE 149 Cb 0.12 1.05 -0.04 0.00 -0.74 0.00 0.00 36.82 37.20 2c91 h ILE 149 CO -0.15 0.08 0.56 0.00 0.00 0.00 0.00 178.15 178.64 2c91 h THR 151 N 1.24 1.19 -0.59 0.00 2.02 -1.20 -1.35 112.91 114.22 2c91 h THR 151 Ca 0.33 -0.54 -0.04 0.00 0.77 0.00 0.00 66.41 66.93 2c91 h THR 151 Cb -0.08 0.67 -0.03 0.00 -1.74 0.00 0.00 68.15 66.98 2c91 h THR 151 CO -0.06 0.21 0.22 -0.07 0.37 0.00 0.00 175.52 176.19 2c91 h LEU 152 N 0.63 0.82 -0.32 2.58 3.38 -0.40 -2.66 115.31 119.34 2c91 h LEU 152 Ca 0.16 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2c91 h LEU 152 Cb 0.12 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 2c91 h LEU 152 CO -0.02 0.78 0.21 0.00 0.09 0.00 0.00 178.44 179.50 2c91 h LYS 154 N 0.44 -0.38 0.00 0.00 6.56 -1.09 -0.43 116.57 121.67 2c91 h LYS 154 Ca 0.12 0.03 -0.05 0.00 -1.06 0.00 0.00 60.65 59.68 2c91 h LYS 154 Cb -0.05 0.09 -0.01 0.00 -0.57 0.00 0.00 32.23 31.69 2c91 h LYS 154 CO -0.03 -0.25 -0.25 0.66 -2.06 0.00 0.00 179.45 177.53 2c91 h SER 155 N -0.39 0.00 -0.31 0.86 4.64 -1.38 -2.94 113.55 114.04 2c91 h SER 155 Ca 0.07 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 2c91 h SER 155 Cb 0.48 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.57 2c91 h SER 155 CO -0.24 0.25 0.00 0.59 -0.87 0.00 0.00 176.83 176.56 2c91 n ASN 156 N -3.51 3.29 -1.88 4.97 3.02 -0.44 -4.98 115.26 115.72 2c91 n ASN 156 Ca -0.00 -1.98 -0.16 0.00 -0.03 0.00 0.00 54.58 52.40 2c91 n ASN 156 Cb 0.41 -0.19 -0.01 0.00 -0.61 0.00 0.00 39.78 39.38 2c91 n ASN 156 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2c91 n GLY 157 N 1.46 -0.31 3.90 7.41 0.00 -0.42 -5.03 105.19 112.20 2c91 n GLY 157 Ca 0.18 -0.19 -0.30 0.00 0.00 0.00 0.00 46.02 45.71 2c91 n GLY 157 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2c91 s TRP 158 N -2.82 3.46 0.18 1.61 0.51 -0.30 -5.04 118.94 116.54 2c91 s TRP 158 Ca 0.00 0.64 -0.33 0.00 -2.12 0.00 0.00 56.10 54.29 2c91 s TRP 158 Cb -0.00 -2.09 -0.13 0.00 -0.81 0.00 0.00 33.47 30.44 2c91 s TRP 158 CO 0.00 0.30 1.57 1.51 -0.51 0.00 0.00 176.95 179.83 2c91 n ILE 159 N -0.39 0.17 -2.79 2.03 3.06 -1.26 -4.46 119.36 115.71 2c91 n ILE 159 Ca -0.02 -0.04 -0.34 0.00 -2.50 0.00 0.00 62.75 59.85 2c91 n ILE 159 Cb 0.53 -1.60 -0.07 0.00 0.54 0.00 0.00 39.64 39.04 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 0.77 4.06 0.30 9.51 2.01 -1.26 -4.93 118.68 129.14 2c91 s LEU 160 Ca 0.76 1.75 -0.29 0.00 0.01 0.00 0.00 54.13 56.36 2c91 s LEU 160 Cb -0.65 -4.38 -0.10 0.00 0.01 0.00 0.00 46.19 41.08 2c91 s LEU 160 CO 0.39 -0.29 1.26 -2.16 1.01 0.00 0.00 176.35 176.56 2c91 s PRO 161 N -2.83 4.43 0.00 1.29 0.04 -1.26 -4.46 135.00 132.20 2c91 s PRO 161 Ca 0.59 2.09 0.07 0.00 0.04 0.00 0.00 61.00 63.79 2c91 s PRO 161 Cb -0.12 -3.12 -0.04 0.00 0.04 0.00 0.00 34.50 31.25 2c91 s PRO 161 CO 0.17 -0.10 0.38 0.25 0.04 0.00 0.00 177.00 177.73 2c91 n THR 162 N 1.20 0.00 -4.33 1.26 -2.24 0.12 -4.75 114.28 105.54 2c91 n THR 162 Ca 0.01 -0.38 -0.19 0.00 -2.27 0.00 0.00 64.05 61.22 2c91 n THR 162 Cb 0.43 1.03 -0.15 0.00 -2.10 0.00 0.00 70.33 69.54 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 -1.40 0.68 -0.10 2.28 1.01 -1.21 -0.61 120.40 121.04 2c91 s VAL 163 Ca 0.04 -0.33 0.04 0.00 0.00 0.00 0.00 61.98 61.73 2c91 s VAL 163 Cb 0.05 -0.59 -0.00 0.00 0.00 0.00 0.00 36.38 35.84 2c91 s VAL 163 CO 0.23 0.21 -0.23 -0.47 0.00 0.00 0.00 175.10 174.84 2c91 s TYR 164 N 0.06 2.57 -0.30 5.22 6.14 -0.02 -0.97 117.35 130.05 2c91 s TYR 164 Ca -0.01 -0.98 -0.08 0.00 0.64 0.00 0.00 57.07 56.64 2c91 s TYR 164 Cb -0.06 -1.71 -0.00 0.00 0.42 0.00 0.00 41.96 40.61 2c91 s TYR 164 CO 0.00 -0.38 0.11 -1.14 0.64 0.00 0.00 175.55 174.78 2c91 s GLN 165 N 0.28 3.27 0.11 4.97 0.74 0.27 -1.21 119.66 128.09 2c91 s GLN 165 Ca -0.17 -0.75 0.05 0.00 0.05 0.00 0.00 55.36 54.54 2c91 s GLN 165 Cb -0.17 -3.45 -0.04 0.00 1.10 0.00 0.00 33.01 30.45 2c91 s GLN 165 CO 0.08 -0.40 -0.11 0.20 -0.55 0.00 0.00 175.29 174.51 2c91 s GLY 166 N 1.56 0.96 -0.21 2.59 0.00 0.02 -3.73 107.32 108.52 2c91 s GLY 166 Ca 0.04 -1.28 -0.29 0.00 0.00 0.00 0.00 44.72 43.19 2c91 s GLY 166 CO 0.04 -1.35 1.51 -0.29 0.00 0.00 0.00 173.10 173.01 2c91 s MET 167 N -2.92 3.92 -0.21 2.90 1.75 -1.26 -0.33 119.30 123.14 2c91 s MET 167 Ca 0.09 1.63 -0.10 0.00 -1.25 0.00 0.00 55.69 56.06 2c91 s MET 167 Cb -0.03 -3.96 0.08 0.00 2.84 0.00 0.00 34.83 33.76 2c91 s MET 167 CO 0.01 -1.14 0.49 -0.47 -0.65 0.00 0.00 175.02 173.27 2c91 s TYR 168 N 4.69 -0.84 0.32 4.11 5.04 -0.77 -4.69 117.35 125.21 2c91 s TYR 168 Ca 0.66 1.64 -0.17 0.00 -2.44 0.00 0.00 57.07 56.77 2c91 s TYR 168 Cb -0.24 0.41 0.03 0.00 0.35 0.00 0.00 41.96 42.51 2c91 s TYR 168 CO 0.26 -0.46 0.69 0.54 -1.34 0.00 0.00 175.55 175.24 2c91 s ASN 169 N 2.00 -0.05 0.52 4.32 2.20 -0.75 -4.07 114.94 119.11 2c91 s ASN 169 Ca -0.07 -0.91 0.24 0.00 -0.94 0.00 0.00 52.86 51.19 2c91 s ASN 169 Cb -0.09 0.75 1.37 0.00 -2.00 0.00 0.00 41.25 41.27 2c91 s ASN 169 CO -0.15 -1.43 2.00 0.00 -2.94 0.00 0.00 177.10 174.58 2c91 h ALA 170 N 2.05 2.45 -0.34 3.54 0.00 -1.85 -0.84 119.26 124.26 2c91 h ALA 170 Ca -0.25 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.64 2c91 h ALA 170 Cb 1.25 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.07 2c91 h ALA 170 CO 0.32 -0.59 0.00 0.25 0.00 0.00 0.00 179.25 179.23 2c91 n THR 171 N -4.39 1.39 -3.44 0.00 -2.24 -1.26 -4.50 114.28 99.84 2c91 n THR 171 Ca 0.09 -1.25 -0.26 0.00 -2.27 0.00 0.00 64.05 60.37 2c91 n THR 171 Cb 0.57 0.28 -0.11 0.00 -2.10 0.00 0.00 70.33 68.96 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 -1.54 -0.01 -0.07 4.28 2.01 -0.32 -4.83 115.64 115.16 2c91 s THR 172 Ca 0.30 -1.42 0.10 0.00 0.31 0.00 0.00 61.69 60.98 2c91 s THR 172 Cb 0.19 -0.99 0.16 0.00 0.01 0.00 0.00 72.50 71.87 2c91 s THR 172 CO 0.14 -0.86 1.06 0.54 -0.69 0.00 0.00 174.62 174.82 2c91 n ARG 173 N 4.22 0.94 -0.07 4.92 1.74 -1.26 -1.81 116.66 125.34 2c91 n ARG 173 Ca 0.10 -1.89 0.07 0.00 -0.77 0.00 0.00 57.85 55.36 2c91 n ARG 173 Cb 0.40 -1.09 0.42 0.00 -1.02 0.00 0.00 32.46 31.17 2c91 n ARG 173 CO 0.00 0.00 0.00 0.37 -1.52 0.00 0.00 177.63 176.48 2c91 h GLN 174 N 0.00 0.56 -0.02 5.56 4.15 -1.89 -1.34 115.11 122.14 2c91 h GLN 174 Ca 0.00 -0.03 0.01 0.00 0.77 0.00 0.00 58.65 59.39 2c91 h GLN 174 Cb 1.09 -0.13 -0.00 0.00 0.21 0.00 0.00 27.48 28.65 2c91 h GLN 174 CO 0.00 0.37 0.24 -0.39 -1.93 0.00 0.00 178.83 177.13 2c91 h VAL 175 N 0.58 0.03 -0.41 2.39 -1.51 -1.87 -3.15 116.25 112.31 2c91 h VAL 175 Ca 0.23 0.00 -0.15 0.00 -1.23 0.00 0.00 66.70 65.54 2c91 h VAL 175 Cb 0.18 0.76 -0.01 0.00 -2.13 0.00 0.00 31.29 30.09 2c91 h VAL 175 CO -0.06 0.00 -0.35 -0.33 -1.23 0.00 0.00 177.57 175.60 2c91 h GLU 176 N 0.00 0.96 -0.29 5.19 5.08 -1.63 -1.81 114.58 122.07 2c91 h GLU 176 Ca 0.01 -0.48 -0.05 0.00 -1.00 0.00 0.00 59.36 57.84 2c91 h GLU 176 Cb 0.49 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 2c91 h GLU 176 CO -0.00 1.14 -0.02 0.00 -1.00 0.00 0.00 179.01 179.13 2c91 h ALA 177 N 0.80 0.40 0.00 3.43 0.00 -1.76 -3.39 119.26 118.75 2c91 h ALA 177 Ca 0.07 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.74 2c91 h ALA 177 Cb 0.94 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.62 2c91 h ALA 177 CO 0.09 0.16 -0.79 0.39 0.00 0.00 0.00 179.25 179.10 2c91 n GLU 178 N -4.55 0.90 0.16 0.00 1.02 -1.25 -4.73 120.64 112.18 2c91 n GLU 178 Ca -0.03 0.00 -0.14 0.00 -0.02 0.00 0.00 57.16 56.97 2c91 n GLU 178 Cb 0.27 -0.90 -0.08 0.00 -0.02 0.00 0.00 31.44 30.71 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 -0.33 -0.63 -4.62 5.85 -1.73 -2.62 115.31 111.23 2c91 h LEU 179 Ca 0.00 -0.14 0.04 0.00 0.84 0.00 0.00 57.88 58.62 2c91 h LEU 179 Cb 0.79 0.09 -0.05 0.00 0.37 0.00 0.00 40.66 41.87 2c91 h LEU 179 CO 0.00 -0.04 0.37 -0.07 -0.34 0.00 0.00 178.44 178.37 2c91 h LEU 180 N -0.65 0.58 -1.41 2.25 4.07 -1.52 0.64 115.31 119.27 2c91 h LEU 180 Ca -0.04 0.01 -0.00 0.00 0.08 0.00 0.00 57.88 57.93 2c91 h LEU 180 Cb 0.46 -0.11 -0.03 0.00 1.08 0.00 0.00 40.66 42.06 2c91 h LEU 180 CO 0.07 0.40 0.34 -0.65 -1.08 0.00 0.00 178.44 177.52 2c91 h PRO 181 N 0.71 0.74 -0.38 1.13 0.11 -1.77 -0.10 132.00 132.44 2c91 h PRO 181 Ca 0.26 -0.05 -0.06 0.00 0.11 0.00 0.00 66.00 66.26 2c91 h PRO 181 Cb 0.08 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.02 2c91 h PRO 181 CO -0.13 0.51 0.01 0.00 -0.21 0.00 0.00 178.00 178.18 2c91 h LEU 183 N 0.49 0.77 -0.60 0.00 3.38 -0.35 -1.85 115.31 117.15 2c91 h LEU 183 Ca 0.11 -0.15 -0.10 0.00 0.09 0.00 0.00 57.88 57.83 2c91 h LEU 183 Cb 0.45 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 2c91 h LEU 183 CO 0.02 0.78 -0.02 0.03 0.09 0.00 0.00 178.44 179.34 2c91 h ARG 184 N 0.78 1.08 -0.63 1.13 2.47 -0.95 0.92 114.38 119.19 2c91 h ARG 184 Ca 0.17 -0.35 -0.01 0.00 -1.26 0.00 0.00 59.98 58.52 2c91 h ARG 184 Cb 0.34 -0.09 -0.03 0.00 -1.65 0.00 0.00 29.97 28.54 2c91 h ARG 184 CO 0.00 1.06 0.34 1.25 0.56 0.00 0.00 179.97 183.19 2c91 h HIS 185 N 0.98 0.86 -0.02 3.04 2.76 -1.14 -3.17 115.15 118.46 2c91 h HIS 185 Ca 0.17 -0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.32 2c91 h HIS 185 Cb 0.58 -0.27 0.00 0.00 1.55 0.00 0.00 27.41 29.27 2c91 h HIS 185 CO 0.04 0.62 -0.19 1.19 -1.30 0.00 0.00 177.93 178.29 2c91 n PHE 186 N -4.55 0.00 -1.66 5.26 3.72 -0.71 -4.98 117.46 114.53 2c91 n PHE 186 Ca 0.04 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.44 2c91 n PHE 186 Cb 0.09 -0.03 0.00 0.00 -0.94 0.00 0.00 39.48 38.60 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 1.33 0.73 3.87 1.37 0.00 0.19 -5.03 105.19 107.65 2c91 n GLY 187 Ca 0.13 -0.69 -0.36 0.00 0.00 0.00 0.00 46.02 45.10 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 -0.12 4.40 0.42 0.99 1.02 -0.42 -4.82 118.68 120.16 2c91 s LEU 188 Ca 0.00 0.60 -0.05 0.00 0.02 0.00 0.00 54.13 54.70 2c91 s LEU 188 Cb 0.00 -2.37 -0.04 0.00 0.02 0.00 0.00 46.19 43.80 2c91 s LEU 188 CO 0.00 0.34 0.71 0.00 0.02 0.00 0.00 176.35 177.43 2c91 s ARG 189 N -1.28 3.58 -0.13 1.70 1.70 0.22 -4.55 118.95 120.20 2c91 s ARG 189 Ca 0.21 0.13 0.02 0.00 -0.47 0.00 0.00 55.73 55.62 2c91 s ARG 189 Cb -0.13 -2.46 0.00 0.00 -0.57 0.00 0.00 34.95 31.79 2c91 s ARG 189 CO 0.10 -0.07 -0.20 0.12 -1.08 0.00 0.00 175.30 174.17 2c91 s PHE 190 N -2.53 2.67 -0.18 5.89 5.36 -1.26 -0.84 117.98 127.09 2c91 s PHE 190 Ca 0.46 -1.11 -0.04 0.00 -0.96 0.00 0.00 56.93 55.29 2c91 s PHE 190 Cb -0.10 -1.80 -0.02 0.00 -0.34 0.00 0.00 43.02 40.76 2c91 s PHE 190 CO 0.39 -0.48 -0.03 0.71 -1.46 0.00 0.00 175.22 174.35 2c91 s TYR 191 N 0.61 3.00 -0.22 10.12 1.51 -0.35 -1.18 117.35 130.83 2c91 s TYR 191 Ca -0.11 -0.48 -0.16 0.00 -1.01 0.00 0.00 57.07 55.31 2c91 s TYR 191 Cb -0.16 -2.01 -0.04 0.00 -0.11 0.00 0.00 41.96 39.64 2c91 s TYR 191 CO 0.03 -0.20 0.43 0.00 -1.11 0.00 0.00 175.55 174.70 2c91 s ALA 192 N 0.75 3.56 0.36 3.71 0.00 -0.00 -0.80 121.76 129.35 2c91 s ALA 192 Ca -0.01 -0.57 0.07 0.00 0.00 0.00 0.00 51.96 51.45 2c91 s ALA 192 Cb -0.14 -2.71 -0.01 0.00 0.00 0.00 0.00 23.12 20.25 2c91 s ALA 192 CO 0.02 -0.45 0.41 1.52 0.00 0.00 0.00 175.76 177.26 2c91 s TYR 193 N 1.63 2.91 -1.42 0.00 -0.85 0.55 -0.66 117.35 119.51 2c91 s TYR 193 Ca 0.19 -0.33 -0.06 0.00 -0.52 0.00 0.00 57.07 56.35 2c91 s TYR 193 Cb -0.15 -2.02 0.04 0.00 0.38 0.00 0.00 41.96 40.21 2c91 s TYR 193 CO 0.09 -0.03 0.79 0.09 -1.52 0.00 0.00 175.55 174.97 2c91 n ASN 194 N -1.56 -2.66 0.17 -0.18 5.03 -1.26 -1.84 115.26 112.96 2c91 n ASN 194 Ca 0.01 -0.83 0.13 0.00 0.87 0.00 0.00 54.58 54.77 2c91 n ASN 194 Cb 0.60 -3.86 0.59 0.00 -1.02 0.00 0.00 39.78 36.09 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 -1.95 0.00 -0.02 3.52 0.13 -1.79 -0.58 132.00 131.30 2c91 h PRO 195 Ca -0.60 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.52 2c91 h PRO 195 Cb 1.37 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.49 2c91 h PRO 195 CO 0.62 0.00 -0.21 1.28 -0.23 0.00 0.00 178.00 179.46 2c91 n LEU 196 N -2.41 2.61 -3.80 1.56 4.77 -1.26 -4.60 117.00 113.87 2c91 n LEU 196 Ca 0.01 -3.45 -0.26 0.00 -0.03 0.00 0.00 56.01 52.28 2c91 n LEU 196 Cb 0.18 -0.48 0.03 0.00 -2.33 0.00 0.00 43.42 40.81 2c91 n LEU 196 CO 0.18 1.02 0.02 0.00 -1.33 0.00 0.00 177.39 177.28 2c91 n ALA 197 N -1.27 -1.66 -1.09 -1.18 0.00 -0.23 -0.81 120.51 114.28 2c91 n ALA 197 Ca 0.18 0.02 -0.03 0.00 0.00 0.00 0.00 53.44 53.61 2c91 n ALA 197 Cb 0.68 -3.22 -0.01 0.00 0.00 0.00 0.00 19.45 16.90 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 0.47 0.00 0.00 0.00 -1.26 -2.33 105.19 100.41 2c91 n GLY 198 Ca -0.13 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.69 0.78 0.36 -0.02 0.00 0.01 -4.74 105.19 100.88 2c91 n GLY 199 Ca -0.03 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.04 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 0.74 0.00 0.99 5.85 -0.97 -2.24 115.31 119.69 2c91 h LEU 200 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2c91 h LEU 200 Cb 0.00 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 40.87 2c91 h LEU 200 CO 0.00 0.48 0.00 0.18 -0.34 0.00 0.00 178.44 178.76 2c91 n LEU 201 N -4.48 0.00 0.23 2.25 4.77 -0.53 -1.85 117.00 117.39 2c91 n LEU 201 Ca 0.11 0.00 0.13 0.00 -0.03 0.00 0.00 56.01 56.22 2c91 n LEU 201 Cb 0.21 0.00 0.23 0.00 -2.33 0.00 0.00 43.42 41.52 2c91 n LEU 201 CO 0.34 0.00 0.83 0.71 -1.33 0.00 0.00 177.39 177.93 2c91 h THR 202 N 0.00 0.01 0.00 -5.08 1.35 -1.62 -3.25 112.91 104.32 2c91 h THR 202 Ca 0.00 -0.96 0.00 0.00 -0.55 0.00 0.00 66.41 64.90 2c91 h THR 202 Cb 0.00 1.95 0.00 0.00 -1.73 0.00 0.00 68.15 68.37 2c91 h THR 202 CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 2c91 n GLY 203 N 0.98 0.49 0.00 5.82 0.00 -0.77 -4.11 105.19 107.59 2c91 n GLY 203 Ca 0.04 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.14 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 -2.22 0.05 -4.32 1.61 2.85 -1.26 -4.85 118.16 110.02 2c91 n LYS 204 Ca 0.00 0.20 -0.25 0.00 -1.05 0.00 0.00 58.31 57.21 2c91 n LYS 204 Cb 0.07 -1.50 -0.09 0.00 -0.65 0.00 0.00 35.03 32.87 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 -2.92 2.56 0.07 5.58 2.02 -1.26 -5.14 117.35 118.26 2c91 s TYR 205 Ca 0.10 -0.51 0.04 0.00 -0.37 0.00 0.00 57.07 56.33 2c91 s TYR 205 Cb 0.11 -1.66 -0.03 0.00 -0.40 0.00 0.00 41.96 39.98 2c91 s TYR 205 CO 0.30 0.39 -0.11 -1.59 -1.57 0.00 0.00 175.55 172.97 2c91 s LYS 206 N -3.77 0.75 0.33 -0.62 -2.85 -1.26 -5.04 119.74 107.28 2c91 s LYS 206 Ca 0.37 -0.97 0.10 0.00 -1.00 0.00 0.00 55.97 54.47 2c91 s LYS 206 Cb 0.02 -0.61 0.87 0.00 -2.06 0.00 0.00 37.83 36.06 2c91 s LYS 206 CO 0.20 0.12 1.77 -0.92 0.10 0.00 0.00 175.35 176.62 2c91 h TYR 207 N 4.12 0.94 -0.00 1.78 5.03 -1.98 -0.82 116.97 126.04 2c91 h TYR 207 Ca -0.38 0.03 0.00 0.00 2.58 0.00 0.00 58.73 60.96 2c91 h TYR 207 Cb 1.19 -0.28 0.00 0.00 1.55 0.00 0.00 36.73 39.19 2c91 h TYR 207 CO 0.64 0.16 -0.01 -0.85 -1.32 0.00 0.00 178.16 176.78 2c91 n GLU 208 N -4.74 0.71 0.20 1.82 0.00 -1.26 -2.92 120.64 114.45 2c91 n GLU 208 Ca 0.24 -0.03 0.18 0.00 0.00 0.00 0.00 57.16 57.55 2c91 n GLU 208 Cb 0.67 -1.50 0.82 0.00 0.00 0.00 0.00 31.44 31.44 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 0.08 0.00 0.65 -1.84 3.32 -1.54 -1.12 116.42 115.97 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 0.17 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.72 2c91 h ASP 209 CO 0.00 0.00 -0.26 0.07 -1.72 0.00 0.00 179.24 177.33 2c91 h LYS 210 N 0.00 0.00 0.00 3.56 2.10 -1.74 0.80 116.57 121.29 2c91 h LYS 210 Ca 0.10 0.00 -0.03 0.00 -2.00 0.00 0.00 60.65 58.72 2c91 h LYS 210 Cb 0.69 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.02 2c91 h LYS 210 CO -0.00 0.26 -1.65 -0.25 -2.00 0.00 0.00 179.45 175.81 2c91 n ASP 211 N -3.61 0.34 0.00 7.07 8.00 -0.47 -4.80 116.55 123.08 2c91 n ASP 211 Ca -0.01 0.13 0.00 0.00 0.71 0.00 0.00 54.79 55.63 2c91 n ASP 211 Cb 0.39 1.31 0.00 0.00 -0.02 0.00 0.00 41.12 42.80 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 1.27 0.71 0.22 0.44 0.00 -0.90 -4.92 105.19 102.00 2c91 n GLY 212 Ca -0.05 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.97 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 0.09 -6.39 1.61 1.57 -1.80 -3.46 116.57 108.19 2c91 h LYS 213 Ca 0.00 -0.01 -0.47 0.00 -1.87 0.00 0.00 60.65 58.30 2c91 h LYS 213 Cb 0.00 -0.02 0.02 0.00 0.08 0.00 0.00 32.23 32.31 2c91 h LYS 213 CO 0.00 0.06 -0.92 1.04 -0.57 0.00 0.00 179.45 179.06 2c91 n GLN 214 N -5.28 -2.14 -1.76 3.15 6.02 0.26 -4.82 117.38 112.81 2c91 n GLN 214 Ca 0.07 0.41 -0.42 0.00 -0.01 0.00 0.00 57.00 57.05 2c91 n GLN 214 Cb 0.31 -4.21 -0.03 0.00 1.02 0.00 0.00 30.24 27.33 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 -6.33 4.15 0.20 -1.09 0.04 -1.26 -4.88 135.00 125.83 2c91 s PRO 215 Ca 0.26 2.53 -0.32 0.00 0.04 0.00 0.00 61.00 63.51 2c91 s PRO 215 Cb -0.10 -3.75 -0.13 0.00 0.04 0.00 0.00 34.50 30.56 2c91 s PRO 215 CO 0.88 -0.85 1.60 0.28 0.04 0.00 0.00 177.00 178.95 2c91 n VAL 216 N 4.97 0.25 -2.06 -0.36 0.31 -1.26 -4.20 118.33 115.98 2c91 n VAL 216 Ca 0.18 -0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.45 2c91 n VAL 216 Cb 0.39 -1.72 0.00 0.00 -0.91 0.00 0.00 33.84 31.61 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 3.26 -0.50 0.33 2.92 0.00 -0.77 -4.93 105.19 105.50 2c91 n GLY 217 Ca 0.15 -0.93 0.16 0.00 0.00 0.00 0.00 46.02 45.40 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 0.52 -0.01 1.61 9.65 -1.87 -2.92 114.38 121.35 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 -0.12 0.00 0.00 -1.39 0.00 0.00 29.97 28.46 2c91 h ARG 218 CO 0.00 0.34 -0.48 1.19 2.80 0.00 0.00 179.97 183.83 2c91 n PHE 219 N -4.93 0.00 -3.72 2.20 3.01 -1.26 -4.28 117.46 108.48 2c91 n PHE 219 Ca 0.25 0.00 -0.12 0.00 1.01 0.00 0.00 57.45 58.59 2c91 n PHE 219 Cb 0.70 -0.08 -0.12 0.00 -0.01 0.00 0.00 39.48 39.97 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 -2.64 -0.45 0.00 1.38 0.08 -1.10 -4.66 117.98 110.59 2c91 s PHE 220 Ca 0.18 1.01 0.00 0.00 0.12 0.00 0.00 56.93 58.24 2c91 s PHE 220 Cb 0.18 0.15 0.00 0.00 -0.57 0.00 0.00 43.02 42.78 2c91 s PHE 220 CO 0.61 -0.27 0.00 0.41 -0.10 0.00 0.00 175.22 175.87 2c91 n GLY 221 N 4.09 2.71 3.76 4.36 0.00 -1.26 -1.84 105.19 117.01 2c91 n GLY 221 Ca -0.23 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.47 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 -1.52 4.17 0.14 1.61 2.20 -1.26 -5.04 114.94 115.24 2c91 s ASN 222 Ca 0.00 -1.56 0.26 0.00 -0.94 0.00 0.00 52.86 50.62 2c91 s ASN 222 Cb 0.00 0.38 0.94 0.00 -2.00 0.00 0.00 41.25 40.57 2c91 s ASN 222 CO 0.00 -0.83 1.79 0.59 -2.94 0.00 0.00 177.10 175.71 2c91 n ASN 223 N -1.29 0.50 -0.97 3.54 3.02 -1.26 -2.34 115.26 116.47 2c91 n ASN 223 Ca -0.15 0.56 0.12 0.00 -0.03 0.00 0.00 54.58 55.08 2c91 n ASN 223 Cb 0.67 -0.69 0.14 0.00 -0.61 0.00 0.00 39.78 39.29 2c91 n ASN 223 CO 0.00 0.00 0.00 0.79 -2.62 0.00 0.00 177.26 175.43 2c91 n TRP 224 N -1.99 0.08 -0.13 3.10 7.02 -1.26 -4.71 117.44 119.56 2c91 n TRP 224 Ca 0.05 -0.04 -0.05 0.00 -1.02 0.00 0.00 57.50 56.44 2c91 n TRP 224 Cb 0.36 0.00 0.03 0.00 -2.42 0.00 0.00 31.31 29.28 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 4.66 0.49 -0.78 6.99 0.00 -1.65 -0.62 119.26 128.34 2c91 h ALA 225 Ca 0.00 0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 2c91 h ALA 225 Cb 0.97 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.73 2c91 h ALA 225 CO 0.00 -0.23 0.30 1.49 0.00 0.00 0.00 179.25 180.81 2c91 h GLU 226 N 0.33 1.18 -0.59 0.00 4.57 -1.83 0.99 114.58 119.24 2c91 h GLU 226 Ca 0.19 -0.22 -0.01 0.00 -1.18 0.00 0.00 59.36 58.13 2c91 h GLU 226 Cb 0.15 -0.19 -0.03 0.00 -0.16 0.00 0.00 28.75 28.53 2c91 h GLU 226 CO -0.18 0.97 0.31 1.15 -1.18 0.00 0.00 179.01 180.08 2c91 h THR 227 N 1.15 1.20 -0.64 0.32 2.02 -1.71 0.33 112.91 115.57 2c91 h THR 227 Ca 0.26 -0.51 -0.02 0.00 0.77 0.00 0.00 66.41 66.91 2c91 h THR 227 Cb 0.24 0.46 -0.03 0.00 -1.74 0.00 0.00 68.15 67.08 2c91 h THR 227 CO -0.02 0.21 0.30 1.88 0.37 0.00 0.00 175.52 178.27 2c91 h TYR 228 N 0.79 0.92 -0.65 3.16 -1.99 -0.79 -2.04 116.97 116.38 2c91 h TYR 228 Ca 0.21 -0.05 -0.04 0.00 2.00 0.00 0.00 58.73 60.85 2c91 h TYR 228 Cb 0.06 -0.29 -0.03 0.00 2.00 0.00 0.00 36.73 38.48 2c91 h TYR 228 CO -0.01 0.70 0.27 0.00 -0.00 0.00 0.00 178.16 179.12 2c91 h ARG 229 N 0.88 0.97 0.00 4.88 3.08 -0.39 -1.40 114.38 122.39 2c91 h ARG 229 Ca 0.22 -0.17 -0.04 0.00 0.07 0.00 0.00 59.98 60.06 2c91 h ARG 229 Cb 0.13 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.01 2c91 h ARG 229 CO -0.03 0.81 -0.17 -0.91 -1.07 0.00 0.00 179.97 178.60 2c91 h ASN 230 N 0.91 0.00 -0.01 7.04 2.35 -0.83 0.67 115.58 125.72 2c91 h ASN 230 Ca 0.22 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.95 2c91 h ASN 230 Cb 0.20 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.57 2c91 h ASN 230 CO -0.02 0.17 -0.06 -0.09 -1.65 0.00 0.00 177.43 175.79 2c91 h ARG 231 N 0.00 0.06 0.00 0.81 2.43 -0.65 -3.42 114.38 113.60 2c91 h ARG 231 Ca -0.00 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 2c91 h ARG 231 Cb 0.32 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.88 2c91 h ARG 231 CO 0.02 0.72 -0.77 1.19 -1.51 0.00 0.00 179.97 179.62 2c91 n PHE 232 N -4.70 0.00 -2.83 2.20 0.99 -0.60 -4.37 117.46 108.15 2c91 n PHE 232 Ca -0.09 0.00 -0.44 0.00 -0.00 0.00 0.00 57.45 56.92 2c91 n PHE 232 Cb 0.37 0.00 -0.00 0.00 -1.00 0.00 0.00 39.48 38.85 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 -1.60 3.27 -0.01 1.38 -0.11 0.22 -4.80 118.94 117.29 2c91 s TRP 233 Ca 0.00 -1.96 0.04 0.00 1.22 0.00 0.00 56.10 55.40 2c91 s TRP 233 Cb 0.00 -4.45 -0.01 0.00 -1.50 0.00 0.00 33.47 27.51 2c91 s TRP 233 CO 0.00 -1.53 -0.13 0.15 -4.62 0.00 0.00 176.95 170.82 2c91 s LYS 234 N 2.44 1.06 0.29 5.86 1.02 -1.26 -4.84 119.74 124.31 2c91 s LYS 234 Ca 0.46 -0.47 0.04 0.00 0.02 0.00 0.00 55.97 56.02 2c91 s LYS 234 Cb -0.01 -1.03 0.70 0.00 -0.52 0.00 0.00 37.83 36.98 2c91 s LYS 234 CO 0.02 0.28 1.72 1.49 -0.92 0.00 0.00 175.35 177.94 2c91 h GLU 235 N 5.82 0.48 0.00 1.68 4.81 -1.98 0.30 114.58 125.69 2c91 h GLU 235 Ca -0.34 -0.03 -0.05 0.00 -0.13 0.00 0.00 59.36 58.82 2c91 h GLU 235 Cb 1.16 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 30.43 2c91 h GLU 235 CO 0.49 0.32 -0.23 0.45 -0.73 0.00 0.00 179.01 179.31 2c91 h HIS 236 N 0.50 0.00 -0.19 0.92 3.86 -1.97 -1.89 115.15 116.38 2c91 h HIS 236 Ca 0.55 0.00 -0.17 0.00 -1.16 0.00 0.00 60.37 59.59 2c91 h HIS 236 Cb 0.98 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.45 2c91 h HIS 236 CO -0.10 0.23 -0.53 1.25 0.86 0.00 0.00 177.93 179.64 2c91 h HIS 237 N 0.00 0.90 -0.35 2.45 -0.00 -0.75 -0.48 115.15 116.92 2c91 h HIS 237 Ca -0.00 -0.35 0.01 0.00 -0.00 0.00 0.00 60.37 60.03 2c91 h HIS 237 Cb 0.46 -0.16 -0.02 0.00 -0.00 0.00 0.00 27.41 27.69 2c91 h HIS 237 CO 0.00 1.15 0.21 0.74 -0.00 0.00 0.00 177.93 180.03 2c91 h PHE 238 N 0.40 0.39 -0.68 5.26 -1.00 -1.19 -0.70 116.94 119.43 2c91 h PHE 238 Ca -0.01 0.01 0.09 0.00 2.81 0.00 0.00 57.97 60.87 2c91 h PHE 238 Cb 1.15 -0.13 -0.07 0.00 3.61 0.00 0.00 35.95 40.51 2c91 h PHE 238 CO 0.09 0.23 0.33 0.93 -1.61 0.00 0.00 178.31 178.28 2c91 h GLU 239 N 0.43 0.55 -0.63 1.51 5.08 -1.30 -0.76 114.58 119.46 2c91 h GLU 239 Ca 0.14 -0.03 -0.06 0.00 -1.00 0.00 0.00 59.36 58.40 2c91 h GLU 239 Cb -0.00 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.10 2c91 h GLU 239 CO -0.06 0.36 0.16 0.00 -1.00 0.00 0.00 179.01 178.47 2c91 h ALA 240 N 1.41 0.83 -0.50 3.43 0.00 -0.68 -2.31 119.26 121.44 2c91 h ALA 240 Ca 0.33 -0.23 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 2c91 h ALA 240 Cb 0.35 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 2c91 h ALA 240 CO -0.26 0.54 0.16 0.82 0.00 0.00 0.00 179.25 180.50 2c91 h ILE 241 N 0.92 1.23 -0.53 0.00 2.04 -0.69 -2.49 117.51 118.00 2c91 h ILE 241 Ca 0.20 -0.77 0.04 0.00 1.00 0.00 0.00 64.86 65.33 2c91 h ILE 241 Cb 0.35 0.78 -0.03 0.00 -0.74 0.00 0.00 36.82 37.19 2c91 h ILE 241 CO 0.00 0.28 0.35 0.00 0.00 0.00 0.00 178.15 178.78 2c91 h ALA 242 N 1.01 1.79 -0.65 1.87 0.00 -1.00 -0.43 119.26 121.86 2c91 h ALA 242 Ca 0.16 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.06 2c91 h ALA 242 Cb 0.27 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 2c91 h ALA 242 CO -0.00 0.14 0.43 1.25 0.00 0.00 0.00 179.25 181.06 2c91 h LEU 243 N 0.55 0.75 -0.36 0.00 7.12 -1.04 -1.22 115.31 121.11 2c91 h LEU 243 Ca 0.22 -0.02 -0.19 0.00 0.13 0.00 0.00 57.88 58.02 2c91 h LEU 243 Cb 0.17 -0.19 -0.00 0.00 -0.53 0.00 0.00 40.66 40.11 2c91 h LEU 243 CO -0.06 0.54 -0.76 0.58 -0.13 0.00 0.00 178.44 178.62 2c91 h VAL 244 N 0.88 1.38 -0.46 1.05 2.07 -0.89 -2.34 116.25 117.94 2c91 h VAL 244 Ca 0.24 -2.17 -0.08 0.00 0.82 0.00 0.00 66.70 65.51 2c91 h VAL 244 Cb -0.10 2.14 -0.02 0.00 -1.52 0.00 0.00 31.29 31.79 2c91 h VAL 244 CO -0.05 0.65 -0.05 -0.33 0.02 0.00 0.00 177.57 177.81 2c91 h GLU 245 N 0.29 0.78 -0.37 1.57 4.39 -0.87 -0.89 114.58 119.48 2c91 h GLU 245 Ca -0.04 -0.23 -0.04 0.00 0.34 0.00 0.00 59.36 59.39 2c91 h GLU 245 Cb 1.34 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 29.90 2c91 h GLU 245 CO 0.13 0.82 0.06 -0.22 -1.16 0.00 0.00 179.01 178.65 2c91 h LYS 246 N 0.72 0.61 -0.51 2.33 3.64 -1.17 -2.13 116.57 120.07 2c91 h LYS 246 Ca 0.13 -0.16 -0.04 0.00 -1.27 0.00 0.00 60.65 59.31 2c91 h LYS 246 Cb 0.51 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.24 2c91 h LYS 246 CO 0.03 0.68 0.14 0.00 -2.27 0.00 0.00 179.45 178.02 2c91 h ALA 247 N 0.91 1.30 -0.45 5.00 0.00 -1.15 -0.45 119.26 124.41 2c91 h ALA 247 Ca 0.11 -0.18 -0.09 0.00 0.00 0.00 0.00 54.91 54.75 2c91 h ALA 247 Cb 0.36 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 2c91 h ALA 247 CO 0.01 0.50 -0.07 -0.07 0.00 0.00 0.00 179.25 179.62 2c91 h LEU 248 N 0.74 0.84 -0.10 0.00 3.38 -0.93 -0.92 115.31 118.32 2c91 h LEU 248 Ca 0.17 -0.34 -0.01 0.00 0.09 0.00 0.00 57.88 57.78 2c91 h LEU 248 Cb 0.25 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.77 2c91 h LEU 248 CO -0.01 0.99 0.01 -0.61 0.09 0.00 0.00 178.44 178.91 2c91 h GLN 249 N 0.68 0.17 -0.58 1.13 5.75 -1.05 -1.72 115.11 119.48 2c91 h GLN 249 Ca 0.12 -0.05 -0.01 0.00 -0.15 0.00 0.00 58.65 58.56 2c91 h GLN 249 Cb 0.60 -0.02 -0.03 0.00 1.07 0.00 0.00 27.48 29.10 2c91 h GLN 249 CO 0.04 0.40 0.34 1.15 -2.65 0.00 0.00 178.83 178.10 2c91 h THR 250 N -0.08 1.18 -0.05 2.39 2.02 -1.06 0.15 112.91 117.46 2c91 h THR 250 Ca 0.03 -0.44 -0.22 0.00 0.77 0.00 0.00 66.41 66.55 2c91 h THR 250 Cb 0.31 0.41 0.01 0.00 -1.74 0.00 0.00 68.15 67.14 2c91 h THR 250 CO 0.00 0.19 -0.87 0.74 0.37 0.00 0.00 175.52 175.95 2c91 h THR 251 N 0.79 1.35 0.00 3.16 2.02 -1.19 -3.39 112.91 115.65 2c91 h THR 251 Ca 0.21 -2.24 0.00 0.00 0.77 0.00 0.00 66.41 65.15 2c91 h THR 251 Cb 0.01 2.25 0.00 0.00 -1.74 0.00 0.00 68.15 68.67 2c91 h THR 251 CO -0.04 0.68 -0.60 -1.22 0.37 0.00 0.00 175.52 174.72 2c91 n TYR 252 N -3.83 0.00 -2.96 3.16 4.01 -0.65 -5.07 117.16 111.82 2c91 n TYR 252 Ca -0.07 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.67 2c91 n TYR 252 Cb 0.79 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.82 2c91 n TYR 252 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2c91 n GLY 253 N 1.87 3.23 0.30 2.72 0.00 0.53 -2.04 105.19 111.81 2c91 n GLY 253 Ca 0.00 -0.26 0.19 0.00 0.00 0.00 0.00 46.02 45.95 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 0.15 -0.12 2.61 1.03 -1.94 -1.43 112.91 113.20 2c91 h THR 254 Ca 0.00 -0.25 0.00 0.00 -0.01 0.00 0.00 66.41 66.15 2c91 h THR 254 Cb 0.00 1.22 0.00 0.00 -1.07 0.00 0.00 68.15 68.30 2c91 h THR 254 CO 0.00 0.02 0.00 0.59 -0.01 0.00 0.00 175.52 176.12 2c91 n ASN 255 N -3.24 0.94 -4.73 0.00 3.02 -0.86 -4.95 115.26 105.44 2c91 n ASN 255 Ca -0.02 -2.04 -0.42 0.00 -0.03 0.00 0.00 54.58 52.08 2c91 n ASN 255 Cb 0.17 -0.19 -0.03 0.00 -0.61 0.00 0.00 39.78 39.13 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 -1.71 3.73 0.70 5.41 0.00 -0.54 -4.97 121.76 124.38 2c91 s ALA 256 Ca 0.09 1.39 -0.15 0.00 0.00 0.00 0.00 51.96 53.28 2c91 s ALA 256 Cb 0.05 -3.60 0.02 0.00 0.00 0.00 0.00 23.12 19.59 2c91 s ALA 256 CO 0.05 -0.79 1.17 -1.25 0.00 0.00 0.00 175.76 174.94 2c91 s PRO 257 N 0.43 2.41 0.58 0.00 0.05 -1.26 -5.00 135.00 132.21 2c91 s PRO 257 Ca 0.66 1.64 -0.19 0.00 0.05 0.00 0.00 61.00 63.16 2c91 s PRO 257 Cb -0.44 -1.88 -0.04 0.00 0.05 0.00 0.00 34.50 32.19 2c91 s PRO 257 CO 0.37 -1.60 1.18 1.03 0.05 0.00 0.00 177.00 178.03 2c91 s ARG 258 N -3.93 3.06 0.27 4.56 0.52 -1.26 -4.80 118.95 117.37 2c91 s ARG 258 Ca 0.72 1.76 0.00 0.00 -0.52 0.00 0.00 55.73 57.69 2c91 s ARG 258 Cb -0.26 -1.95 0.55 0.00 0.52 0.00 0.00 34.95 33.81 2c91 s ARG 258 CO 0.43 -1.12 1.80 1.98 0.02 0.00 0.00 175.30 178.42 2c91 h MET 259 N 0.93 0.81 -0.39 3.54 1.85 -1.87 0.10 114.93 119.91 2c91 h MET 259 Ca -0.50 -0.05 0.07 0.00 -0.61 0.00 0.00 59.70 58.60 2c91 h MET 259 Cb 1.29 -0.18 -0.06 0.00 0.43 0.00 0.00 31.60 33.08 2c91 h MET 259 CO 0.55 0.54 0.04 1.15 -0.40 0.00 0.00 176.91 178.79 2c91 h THR 260 N 0.83 0.75 -0.21 -0.77 2.02 -1.71 -0.24 112.91 113.59 2c91 h THR 260 Ca 0.48 -0.05 -0.16 0.00 0.77 0.00 0.00 66.41 67.45 2c91 h THR 260 Cb 0.57 0.59 -0.01 0.00 -1.74 0.00 0.00 68.15 67.56 2c91 h THR 260 CO -0.30 0.03 -0.53 -1.28 0.37 0.00 0.00 175.52 173.81 2c91 h SER 261 N 0.15 0.67 -0.21 4.18 0.87 -1.41 -2.70 113.55 115.10 2c91 h SER 261 Ca 0.19 -0.35 0.01 0.00 -1.23 0.00 0.00 61.79 60.41 2c91 h SER 261 Cb 0.25 -0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 62.00 2c91 h SER 261 CO -0.28 1.08 0.11 0.00 -0.53 0.00 0.00 176.83 177.20 2c91 h ALA 262 N 0.94 0.25 -0.69 6.23 0.00 -0.39 -1.47 119.26 124.14 2c91 h ALA 262 Ca 0.01 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 2c91 h ALA 262 Cb 1.08 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.79 2c91 h ALA 262 CO 0.10 -0.30 0.37 0.00 0.00 0.00 0.00 179.25 179.43 2c91 h ALA 263 N 1.10 1.36 -0.14 0.00 0.00 -0.98 -0.10 119.26 120.50 2c91 h ALA 263 Ca 0.08 -0.11 -0.22 0.00 0.00 0.00 0.00 54.91 54.66 2c91 h ALA 263 Cb 0.01 -0.28 0.01 0.00 0.00 0.00 0.00 17.79 17.53 2c91 h ALA 263 CO -0.05 0.52 -0.78 -0.07 0.00 0.00 0.00 179.25 178.87 2c91 h LEU 264 N 0.96 0.91 -1.27 0.00 3.38 -1.36 -3.06 115.31 114.87 2c91 h LEU 264 Ca 0.24 -0.60 -0.04 0.00 0.09 0.00 0.00 57.88 57.57 2c91 h LEU 264 Cb 0.03 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.49 2c91 h LEU 264 CO -0.04 1.39 0.03 0.03 0.09 0.00 0.00 178.44 179.95 2c91 h ARG 265 N 0.52 0.53 -0.31 1.13 3.08 -0.98 -1.60 114.38 116.75 2c91 h ARG 265 Ca -0.05 -0.10 0.06 0.00 0.07 0.00 0.00 59.98 59.96 2c91 h ARG 265 Cb 1.41 -0.08 -0.06 0.00 0.08 0.00 0.00 29.97 31.31 2c91 h ARG 265 CO 0.16 0.53 -0.09 2.35 -1.07 0.00 0.00 179.97 181.85 2c91 h TRP 266 N 0.51 -0.21 -0.34 3.04 7.01 -1.03 -0.98 115.95 123.95 2c91 h TRP 266 Ca 0.11 0.03 0.06 0.00 2.11 0.00 0.00 58.89 61.20 2c91 h TRP 266 Cb 0.28 0.14 -0.06 0.00 -2.10 0.00 0.00 29.16 27.42 2c91 h TRP 266 CO 0.01 -0.15 -0.01 0.52 -2.79 0.00 0.00 178.44 176.02 2c91 h MET 267 N -0.02 0.08 0.00 2.65 2.86 -1.22 0.38 114.93 119.65 2c91 h MET 267 Ca 0.15 -0.00 -0.12 0.00 -2.06 0.00 0.00 59.70 57.66 2c91 h MET 267 Cb 0.25 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 31.88 2c91 h MET 267 CO -0.33 0.05 -0.59 1.88 1.06 0.00 0.00 176.91 178.98 2c91 h TYR 268 N 0.08 0.00 0.00 -0.22 -1.99 -1.13 -3.37 116.97 110.35 2c91 h TYR 268 Ca 0.16 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.89 2c91 h TYR 268 Cb 0.23 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.96 2c91 h TYR 268 CO -0.25 0.59 -0.93 0.72 -0.00 0.00 0.00 178.16 178.30 2c91 n HIS 269 N -3.36 0.00 -0.33 4.88 8.25 -0.39 -4.43 115.22 119.84 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 -1.50 0.00 -3.06 4.41 8.25 0.13 -5.04 115.22 118.41 2c91 n HIS 270 Ca 0.00 -0.16 -0.16 0.00 -0.26 0.00 0.00 57.72 57.14 2c91 n HIS 270 Cb 0.10 -0.02 0.06 0.00 1.12 0.00 0.00 29.99 31.25 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 -0.16 1.79 -0.52 0.41 3.41 -0.79 -4.96 113.62 112.80 2c91 n SER 271 Ca 0.00 -2.30 0.10 0.00 -0.26 0.00 0.00 58.87 56.41 2c91 n SER 271 Cb 0.20 -0.35 0.38 0.00 -0.26 0.00 0.00 64.21 64.18 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 -2.05 1.68 -2.06 4.33 6.02 -1.26 -4.89 117.38 119.15 2c91 n GLN 272 Ca 0.13 -1.02 -0.41 0.00 -0.01 0.00 0.00 57.00 55.69 2c91 n GLN 272 Cb 0.50 -1.38 -0.02 0.00 1.02 0.00 0.00 30.24 30.36 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 -1.56 4.40 -0.24 1.08 1.43 -1.26 -5.01 118.68 117.52 2c91 s LEU 273 Ca 0.32 2.65 0.02 0.00 -1.03 0.00 0.00 54.13 56.09 2c91 s LEU 273 Cb 0.17 -3.63 0.05 0.00 0.03 0.00 0.00 46.19 42.81 2c91 s LEU 273 CO 0.26 -0.63 -0.12 -1.10 0.23 0.00 0.00 176.35 174.99 2c91 s GLN 274 N -0.83 2.26 0.40 1.70 -0.21 -1.26 -4.82 119.66 116.89 2c91 s GLN 274 Ca 0.55 -1.20 0.08 0.00 0.02 0.00 0.00 55.36 54.82 2c91 s GLN 274 Cb -0.41 -2.77 0.86 0.00 1.00 0.00 0.00 33.01 31.69 2c91 s GLN 274 CO 0.46 -0.51 1.99 0.78 -2.12 0.00 0.00 175.29 175.89 2c91 h GLY 275 N 7.83 0.74 2.00 3.09 0.00 -1.75 -1.71 103.07 113.27 2c91 h GLY 275 Ca -0.23 -0.24 -0.02 0.00 0.00 0.00 0.00 47.33 46.84 2c91 h GLY 275 CO 0.48 0.19 -0.08 -0.91 0.00 0.00 0.00 176.54 176.22 2c91 h THR 276 N 0.60 0.56 -0.01 4.70 1.35 -1.87 -1.30 112.91 116.94 2c91 h THR 276 Ca 0.25 -0.33 0.00 0.00 -0.55 0.00 0.00 66.41 65.78 2c91 h THR 276 Cb 0.24 1.21 0.00 0.00 -1.73 0.00 0.00 68.15 67.88 2c91 h THR 276 CO -0.07 0.07 -0.10 0.54 -0.25 0.00 0.00 175.52 175.71 2c91 n ARG 277 N -3.73 1.11 -0.54 4.72 1.74 -0.69 -4.92 116.66 114.36 2c91 n ARG 277 Ca -0.02 -0.54 0.00 0.00 -0.77 0.00 0.00 57.85 56.52 2c91 n ARG 277 Cb 0.18 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.13 2c91 n ARG 277 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2c91 n GLY 278 N 1.23 0.73 3.73 -0.13 0.00 -0.49 -4.61 105.19 105.64 2c91 n GLY 278 Ca 0.17 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.84 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 -2.08 4.31 0.10 1.61 1.01 -0.94 -4.68 116.67 116.00 2c91 s ASP 279 Ca 0.00 2.36 -0.09 0.00 0.71 0.00 0.00 52.55 55.53 2c91 s ASP 279 Cb 0.00 -2.59 0.00 0.00 1.01 0.00 0.00 42.92 41.34 2c91 s ASP 279 CO 0.00 -2.19 0.22 0.00 0.21 0.00 0.00 175.17 173.41 2c91 s ALA 280 N -1.94 -0.29 -0.16 5.23 0.00 -0.33 -1.74 121.76 122.54 2c91 s ALA 280 Ca 0.75 -0.57 -0.05 0.00 0.00 0.00 0.00 51.96 52.08 2c91 s ALA 280 Cb -0.29 0.53 -0.03 0.00 0.00 0.00 0.00 23.12 23.32 2c91 s ALA 280 CO 0.44 -0.53 0.01 0.08 0.00 0.00 0.00 175.76 175.76 2c91 s VAL 281 N -3.86 4.30 -0.45 0.00 1.01 0.02 -0.82 120.40 120.59 2c91 s VAL 281 Ca 0.05 -0.22 -0.18 0.00 0.00 0.00 0.00 61.98 61.64 2c91 s VAL 281 Cb 0.04 -2.90 0.04 0.00 0.00 0.00 0.00 36.38 33.56 2c91 s VAL 281 CO -0.11 0.49 0.49 -0.63 0.00 0.00 0.00 175.10 175.35 2c91 s ILE 282 N 0.24 5.04 0.39 2.22 1.01 0.16 -0.98 121.20 129.29 2c91 s ILE 282 Ca 0.00 -0.43 -0.26 0.00 0.00 0.00 0.00 60.65 59.96 2c91 s ILE 282 Cb -0.13 -4.12 -0.09 0.00 0.01 0.00 0.00 42.46 38.13 2c91 s ILE 282 CO 0.02 -0.54 1.22 -0.76 0.00 0.00 0.00 174.94 174.88 2c91 s LEU 283 N 2.24 4.24 0.24 2.97 1.43 -0.21 -4.50 118.68 125.08 2c91 s LEU 283 Ca 0.13 2.48 0.11 0.00 -1.03 0.00 0.00 54.13 55.81 2c91 s LEU 283 Cb -0.18 -3.93 -0.05 0.00 0.03 0.00 0.00 46.19 42.06 2c91 s LEU 283 CO 0.13 -0.70 -0.20 -0.83 0.23 0.00 0.00 176.35 174.98 2c91 s GLY 284 N -0.93 1.72 -0.14 -3.19 0.00 -1.26 -0.84 107.32 102.69 2c91 s GLY 284 Ca 0.56 -1.75 -0.30 0.00 0.00 0.00 0.00 44.72 43.22 2c91 s GLY 284 CO 0.43 -1.82 1.03 -3.16 0.00 0.00 0.00 173.10 169.58 2c91 s MET 285 N -3.27 0.56 0.00 2.90 0.23 -1.26 -4.78 119.30 113.68 2c91 s MET 285 Ca 0.25 -0.01 0.02 0.00 -1.03 0.00 0.00 55.69 54.92 2c91 s MET 285 Cb -0.05 0.26 0.04 0.00 -1.53 0.00 0.00 34.83 33.55 2c91 s MET 285 CO 0.12 -0.21 0.84 -1.13 -2.03 0.00 0.00 175.02 172.61 2c91 n SER 286 N 0.35 1.75 -3.69 -1.18 3.41 -1.26 -4.53 113.62 108.47 2c91 n SER 286 Ca -0.07 -1.61 -0.10 0.00 -0.26 0.00 0.00 58.87 56.83 2c91 n SER 286 Cb 0.59 -0.03 -0.05 0.00 -0.26 0.00 0.00 64.21 64.47 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 -0.65 -0.18 0.23 4.04 1.04 -1.26 -4.41 113.70 112.51 2c91 s SER 287 Ca 0.04 -0.41 -0.08 0.00 0.48 0.00 0.00 55.95 55.98 2c91 s SER 287 Cb 0.02 0.47 0.20 0.00 0.10 0.00 0.00 66.02 66.81 2c91 s SER 287 CO 0.03 -0.87 1.87 0.25 0.98 0.00 0.00 173.24 175.50 2c91 h LEU 288 N 2.40 1.05 -0.50 2.42 5.85 -1.97 -2.58 115.31 121.99 2c91 h LEU 288 Ca -0.33 -0.07 -0.04 0.00 0.84 0.00 0.00 57.88 58.28 2c91 h LEU 288 Cb 1.25 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.99 2c91 h LEU 288 CO 0.47 0.82 0.16 -0.08 -0.34 0.00 0.00 178.44 179.47 2c91 h GLU 289 N 1.20 0.77 -0.45 1.25 4.81 -1.99 -0.66 114.58 119.51 2c91 h GLU 289 Ca 0.31 -0.16 0.01 0.00 -0.13 0.00 0.00 59.36 59.39 2c91 h GLU 289 Cb -0.03 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.21 2c91 h GLU 289 CO -0.06 0.71 0.28 1.96 -0.73 0.00 0.00 179.01 181.18 2c91 h GLN 290 N 0.67 0.56 -0.72 1.92 4.20 -1.96 -2.17 115.11 117.62 2c91 h GLN 290 Ca 0.16 -0.03 -0.02 0.00 0.06 0.00 0.00 58.65 58.82 2c91 h GLN 290 Cb 0.26 -0.13 -0.03 0.00 0.30 0.00 0.00 27.48 27.88 2c91 h GLN 290 CO -0.01 0.37 0.39 1.25 -0.67 0.00 0.00 178.83 180.16 2c91 h LEU 291 N 0.58 0.90 -0.39 1.46 5.85 -0.98 -1.28 115.31 121.44 2c91 h LEU 291 Ca 0.17 -0.10 -0.03 0.00 0.84 0.00 0.00 57.88 58.76 2c91 h LEU 291 Cb -0.04 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 40.74 2c91 h LEU 291 CO -0.05 0.74 0.13 -0.33 -0.34 0.00 0.00 178.44 178.59 2c91 h GLU 292 N 0.99 0.61 -0.34 1.25 4.39 -0.98 0.61 114.58 121.10 2c91 h GLU 292 Ca 0.25 -0.13 0.07 0.00 0.34 0.00 0.00 59.36 59.90 2c91 h GLU 292 Cb 0.05 -0.09 -0.07 0.00 -0.10 0.00 0.00 28.75 28.53 2c91 h GLU 292 CO -0.04 0.60 -0.14 0.37 -1.16 0.00 0.00 179.01 178.64 2c91 h GLN 293 N 0.49 -0.08 -0.51 2.33 4.15 -1.26 -1.78 115.11 118.45 2c91 h GLN 293 Ca 0.13 0.01 -0.06 0.00 0.77 0.00 0.00 58.65 59.49 2c91 h GLN 293 Cb 0.24 0.02 -0.02 0.00 0.21 0.00 0.00 27.48 27.93 2c91 h GLN 293 CO -0.01 -0.05 0.08 -0.91 -1.93 0.00 0.00 178.83 176.01 2c91 h ASN 294 N -0.08 0.81 -0.94 -0.69 2.35 -0.32 -2.00 115.58 114.71 2c91 h ASN 294 Ca 0.17 -0.26 0.05 0.00 -0.55 0.00 0.00 56.30 55.71 2c91 h ASN 294 Cb 0.35 -0.22 -0.06 0.00 0.05 0.00 0.00 38.32 38.44 2c91 h ASN 294 CO -0.40 0.87 0.62 -0.07 -1.65 0.00 0.00 177.43 176.79 2c91 h LEU 295 N 0.73 1.00 -0.58 1.61 3.38 0.36 -1.89 115.31 119.92 2c91 h LEU 295 Ca 0.16 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.08 2c91 h LEU 295 Cb 0.40 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 2c91 h LEU 295 CO 0.01 0.67 0.19 0.00 0.09 0.00 0.00 178.44 179.41 2c91 h ALA 296 N 1.46 0.75 -0.48 1.53 0.00 -0.93 -2.79 119.26 118.81 2c91 h ALA 296 Ca 0.38 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 2c91 h ALA 296 Cb 0.07 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 2c91 h ALA 296 CO -0.13 0.41 0.25 0.00 0.00 0.00 0.00 179.25 179.78 2c91 h ALA 297 N 1.06 1.54 0.00 0.00 0.00 -0.79 -1.33 119.26 119.74 2c91 h ALA 297 Ca 0.19 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2c91 h ALA 297 Cb 0.26 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.86 2c91 h ALA 297 CO -0.01 0.38 0.00 1.79 0.00 0.00 0.00 179.25 181.41 2c91 h THR 298 N 0.67 0.00 -0.01 0.00 1.35 -1.08 -2.12 112.91 111.72 2c91 h THR 298 Ca 0.17 -0.18 0.00 0.00 -0.55 0.00 0.00 66.41 65.85 2c91 h THR 298 Cb 0.04 1.14 0.00 0.00 -1.73 0.00 0.00 68.15 67.61 2c91 h THR 298 CO -0.03 0.00 -0.68 -0.62 -0.25 0.00 0.00 175.52 173.94 2c91 n GLU 299 N -3.02 0.89 -1.25 4.72 1.02 -0.51 -4.95 120.64 117.54 2c91 n GLU 299 Ca -0.02 -0.51 -0.29 0.00 -0.02 0.00 0.00 57.16 56.33 2c91 n GLU 299 Cb 0.15 -1.44 0.16 0.00 -0.02 0.00 0.00 31.44 30.30 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 -2.60 0.67 0.00 3.49 2.02 -0.80 -5.07 118.70 116.41 2c91 s GLU 300 Ca 0.13 0.50 0.00 0.00 0.02 0.00 0.00 54.97 55.62 2c91 s GLU 300 Cb 0.16 -1.77 0.00 0.00 0.10 0.00 0.00 34.13 32.62 2c91 s GLU 300 CO 0.67 -2.56 0.00 0.41 0.02 0.00 0.00 175.26 173.80 2c91 n GLY 301 N -1.33 1.24 3.62 -1.39 0.00 -1.26 -5.03 105.19 101.05 2c91 n GLY 301 Ca 0.06 -2.00 -0.33 0.00 0.00 0.00 0.00 46.02 43.74 2c91 n GLY 301 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2c91 n PRO 302 N -0.71 0.07 -2.99 1.61 -0.02 -1.26 -4.93 135.00 126.76 2c91 n PRO 302 Ca 0.00 0.09 -0.25 0.00 -2.02 0.00 0.00 63.50 61.32 2c91 n PRO 302 Cb 0.00 -2.28 -0.00 0.00 -0.02 0.00 0.00 33.50 31.20 2c91 n PRO 302 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2c91 s LEU 303 N -4.46 3.76 0.43 2.45 1.43 -1.26 -5.07 118.68 115.95 2c91 s LEU 303 Ca 0.70 0.58 -0.24 0.00 -1.03 0.00 0.00 54.13 54.13 2c91 s LEU 303 Cb -0.28 -3.47 -0.08 0.00 0.03 0.00 0.00 46.19 42.39 2c91 s LEU 303 CO 0.55 -0.53 1.17 -1.61 0.23 0.00 0.00 176.35 176.16 2c91 s GLU 304 N -4.55 3.89 0.29 1.70 0.41 -1.26 -4.80 118.70 114.38 2c91 s GLU 304 Ca 0.45 1.82 0.01 0.00 -0.41 0.00 0.00 54.97 56.83 2c91 s GLU 304 Cb -0.10 -2.53 0.69 0.00 -1.78 0.00 0.00 34.13 30.41 2c91 s GLU 304 CO 0.40 -0.46 1.61 -1.35 -0.49 0.00 0.00 175.26 174.97 2c91 h PRO 305 N 2.31 0.09 -0.21 0.39 0.11 -1.99 0.12 132.00 132.82 2c91 h PRO 305 Ca -0.49 -0.01 0.02 0.00 0.11 0.00 0.00 66.00 65.63 2c91 h PRO 305 Cb 1.24 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.32 2c91 h PRO 305 CO 0.61 0.06 0.14 0.00 -0.21 0.00 0.00 178.00 178.61 2c91 h ALA 306 N 1.86 1.94 0.21 -0.75 0.00 -1.98 0.20 119.26 120.74 2c91 h ALA 306 Ca 0.55 -0.01 -0.32 0.00 0.00 0.00 0.00 54.91 55.13 2c91 h ALA 306 Cb 1.11 -0.06 0.02 0.00 0.00 0.00 0.00 17.79 18.87 2c91 h ALA 306 CO -0.77 0.03 -1.42 0.28 0.00 0.00 0.00 179.25 177.37 2c91 h VAL 307 N 0.21 1.34 -0.56 0.00 2.07 -1.10 -2.17 116.25 116.04 2c91 h VAL 307 Ca 0.09 -2.82 0.02 0.00 0.82 0.00 0.00 66.70 64.81 2c91 h VAL 307 Cb 0.09 2.99 -0.04 0.00 -1.52 0.00 0.00 31.29 32.82 2c91 h VAL 307 CO -0.02 0.84 0.34 0.58 0.02 0.00 0.00 177.57 179.33 2c91 h VAL 308 N 0.12 1.06 -0.75 2.57 2.07 -0.89 -0.89 116.25 119.55 2c91 h VAL 308 Ca -0.22 -0.23 -0.02 0.00 0.82 0.00 0.00 66.70 67.05 2c91 h VAL 308 Cb 2.10 0.34 -0.03 0.00 -1.52 0.00 0.00 31.29 32.17 2c91 h VAL 308 CO 0.24 0.12 0.37 -0.08 0.02 0.00 0.00 177.57 178.25 2c91 h GLU 309 N 0.67 1.08 -0.84 1.57 4.57 -0.97 -2.00 114.58 118.65 2c91 h GLU 309 Ca 0.22 -0.15 0.01 0.00 -1.18 0.00 0.00 59.36 58.26 2c91 h GLU 309 Cb 0.02 -0.20 -0.04 0.00 -0.16 0.00 0.00 28.75 28.37 2c91 h GLU 309 CO -0.10 0.83 0.55 0.00 -1.18 0.00 0.00 179.01 179.12 2c91 h ALA 310 N 1.19 1.07 -0.64 2.92 0.00 -0.87 0.07 119.26 123.00 2c91 h ALA 310 Ca 0.26 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 2c91 h ALA 310 Cb 0.10 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.52 2c91 h ALA 310 CO -0.03 0.48 0.37 0.74 0.00 0.00 0.00 179.25 180.81 2c91 h PHE 311 N 1.15 0.84 -0.50 0.00 0.04 -0.66 -0.44 116.94 117.38 2c91 h PHE 311 Ca 0.31 -0.00 -0.07 0.00 2.80 0.00 0.00 57.97 61.00 2c91 h PHE 311 Cb -0.12 -0.28 -0.02 0.00 2.20 0.00 0.00 35.95 37.73 2c91 h PHE 311 CO -0.01 0.57 0.02 -0.44 -0.60 0.00 0.00 178.31 177.85 2c91 h ASP 312 N 0.88 0.84 -0.82 2.17 3.32 -0.60 -1.13 116.42 121.08 2c91 h ASP 312 Ca 0.23 -0.29 -0.01 0.00 0.02 0.00 0.00 57.03 56.98 2c91 h ASP 312 Cb -0.02 -0.22 -0.04 0.00 0.22 0.00 0.00 39.33 39.27 2c91 h ASP 312 CO -0.04 0.93 0.48 1.56 -1.72 0.00 0.00 179.24 180.44 2c91 h GLN 313 N 0.72 1.13 -0.13 3.56 4.20 -0.63 -1.14 115.11 122.82 2c91 h GLN 313 Ca 0.14 -0.11 -0.01 0.00 0.06 0.00 0.00 58.65 58.73 2c91 h GLN 313 Cb 0.48 -0.23 -0.01 0.00 0.30 0.00 0.00 27.48 28.02 2c91 h GLN 313 CO 0.02 0.81 0.05 0.00 -0.67 0.00 0.00 178.83 179.04 2c91 h ALA 314 N 1.38 0.17 -0.41 3.87 0.00 -0.86 -2.07 119.26 121.34 2c91 h ALA 314 Ca 0.30 -0.11 0.06 0.00 0.00 0.00 0.00 54.91 55.15 2c91 h ALA 314 Cb -0.02 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 17.67 2c91 h ALA 314 CO -0.05 -0.22 0.10 2.35 0.00 0.00 0.00 179.25 181.42 2c91 h TRP 315 N 0.05 0.17 -0.33 0.00 -0.00 -0.97 -2.16 115.95 112.70 2c91 h TRP 315 Ca 0.04 0.02 0.09 0.00 -0.00 0.00 0.00 58.89 59.05 2c91 h TRP 315 Cb 0.20 -0.01 -0.01 0.00 -0.00 0.00 0.00 29.16 29.33 2c91 h TRP 315 CO -0.01 0.03 0.23 -0.91 -0.00 0.00 0.00 178.44 177.79 2c91 h ASN 316 N 0.24 0.02 0.74 2.65 2.35 -0.86 0.16 115.58 120.88 2c91 h ASN 316 Ca 0.20 0.00 -0.14 0.00 -0.55 0.00 0.00 56.30 55.81 2c91 h ASN 316 Cb 0.23 -0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.58 2c91 h ASN 316 CO -0.25 0.01 -0.66 0.24 -1.65 0.00 0.00 177.43 175.13 2c91 h MET 317 N 0.02 0.00 0.00 0.81 2.86 -0.71 -3.34 114.93 114.57 2c91 h MET 317 Ca 0.15 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.79 2c91 h MET 317 Cb 0.59 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.25 2c91 h MET 317 CO -0.01 0.66 -1.17 1.33 1.06 0.00 0.00 176.91 178.78 2c91 n VAL 318 N -3.67 0.00 -0.34 -2.22 0.24 -0.58 -4.70 118.33 107.05 2c91 n VAL 318 Ca -0.01 -0.24 0.14 0.00 -2.04 0.00 0.00 64.34 62.20 2c91 n VAL 318 Cb 0.67 0.62 0.34 0.00 -1.47 0.00 0.00 33.84 34.00 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 1.86 1.74 0.00 2.33 0.00 -0.87 0.12 119.26 124.44 2c91 h ALA 319 Ca 0.00 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2c91 h ALA 319 Cb 0.53 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2c91 h ALA 319 CO 0.00 -0.11 0.00 1.12 0.00 0.00 0.00 179.25 180.26 2c91 h HIS 320 N 0.72 0.00 0.00 0.00 2.07 -1.84 -2.65 115.15 113.45 2c91 h HIS 320 Ca 0.58 0.00 -0.02 0.00 -2.85 0.00 0.00 60.37 58.08 2c91 h HIS 320 Cb 0.96 0.00 -0.05 0.00 2.57 0.00 0.00 27.41 30.90 2c91 h HIS 320 CO -0.00 0.00 -0.45 -0.85 -3.07 0.00 0.00 177.93 173.56 2c91 n GLU 321 N -2.57 1.26 -1.89 5.12 0.28 0.38 -5.06 120.64 118.16 2c91 n GLU 321 Ca -0.00 -2.89 -0.41 0.00 -0.16 0.00 0.00 57.16 53.70 2c91 n GLU 321 Cb 0.17 -1.35 -0.02 0.00 1.43 0.00 0.00 31.44 31.67 2c91 n GLU 321 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2c91 s PRO 323 N -0.83 3.17 0.07 0.00 0.04 -1.26 -4.98 135.00 131.21 2c91 s PRO 323 Ca 0.59 1.22 -0.30 0.00 0.04 0.00 0.00 61.00 62.55 2c91 s PRO 323 Cb -0.45 -2.01 -0.06 0.00 0.04 0.00 0.00 34.50 32.02 2c91 s PRO 323 CO 0.49 -0.93 1.15 -0.80 0.04 0.00 0.00 177.00 176.95 2c91 s ASN 324 N -2.83 7.15 0.31 6.66 0.01 -1.26 -4.86 114.94 120.12 2c91 s ASN 324 Ca 0.64 1.98 0.26 0.00 -0.71 0.00 0.00 52.86 55.02 2c91 s ASN 324 Cb -0.17 -2.58 1.04 0.00 0.41 0.00 0.00 41.25 39.95 2c91 s ASN 324 CO 0.39 -0.40 1.77 0.10 -1.51 0.00 0.00 177.10 177.45 2c91 h TYR 325 N 6.52 0.00 -3.00 2.20 -0.00 -1.93 -3.45 116.97 117.32 2c91 h TYR 325 Ca -0.42 0.00 -0.62 0.00 -0.00 0.00 0.00 58.73 57.69 2c91 h TYR 325 Cb 1.21 0.00 -0.13 0.00 -0.00 0.00 0.00 36.73 37.81 2c91 h TYR 325 CO 0.66 0.00 -0.70 -0.59 -0.00 0.00 0.00 178.16 177.53 2c91 s PHE 326 N -3.37 2.71 0.00 0.10 -0.12 -1.26 -4.29 117.98 111.75 2c91 s PHE 326 Ca 0.04 -0.19 0.00 0.00 -0.05 0.00 0.00 56.93 56.73 2c91 s PHE 326 Cb 0.09 -1.33 0.00 0.00 -0.63 0.00 0.00 43.02 41.16 2c91 s PHE 326 CO 0.44 0.51 0.19 0.54 -0.05 0.00 0.00 175.22 176.84