#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 2.29 0.66 1.96 1.70 -1.26 -3.14 118.95 121.16 2c91 s ARG 5 Ca 0.00 1.59 -0.17 0.00 -0.47 0.00 0.00 55.73 56.68 2c91 s ARG 5 Cb 0.00 -1.87 -0.02 0.00 -0.57 0.00 0.00 34.95 32.50 2c91 s ARG 5 CO 0.00 -1.69 1.08 -2.30 -1.08 0.00 0.00 175.30 171.31 2c91 n PRO 6 N -2.76 0.83 -1.44 3.89 -0.02 -1.26 -4.32 135.00 129.92 2c91 n PRO 6 Ca 0.12 0.33 -0.29 0.00 -2.02 0.00 0.00 63.50 61.65 2c91 n PRO 6 Cb 0.51 -2.31 0.15 0.00 -0.02 0.00 0.00 33.50 31.84 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 -1.58 1.52 -0.10 3.55 0.00 -0.65 -4.83 121.76 119.67 2c91 s ALA 7 Ca 0.78 -0.55 0.02 0.00 0.00 0.00 0.00 51.96 52.21 2c91 s ALA 7 Cb -0.38 -3.03 0.01 0.00 0.00 0.00 0.00 23.12 19.72 2c91 s ALA 7 CO 0.45 -2.52 -0.16 0.99 0.00 0.00 0.00 175.76 174.53 2c91 s THR 8 N -3.22 1.54 -0.01 0.00 2.01 -1.26 -0.83 115.64 113.87 2c91 s THR 8 Ca 0.65 -0.68 0.05 0.00 0.31 0.00 0.00 61.69 62.02 2c91 s THR 8 Cb -0.15 -1.39 -0.03 0.00 0.01 0.00 0.00 72.50 70.94 2c91 s THR 8 CO 0.54 0.45 -0.15 -0.69 -0.69 0.00 0.00 174.62 174.08 2c91 s VAL 9 N 0.84 2.99 -0.27 3.82 1.01 -0.32 -4.45 120.40 124.02 2c91 s VAL 9 Ca -0.09 -0.91 -0.16 0.00 0.00 0.00 0.00 61.98 60.82 2c91 s VAL 9 Cb -0.15 -2.21 -0.03 0.00 0.00 0.00 0.00 36.38 33.98 2c91 s VAL 9 CO 0.01 0.48 0.41 -0.22 0.00 0.00 0.00 175.10 175.77 2c91 s LEU 10 N -1.06 4.06 0.17 3.92 2.96 -0.36 -0.80 118.68 127.57 2c91 s LEU 10 Ca 0.13 0.32 -0.30 0.00 -0.22 0.00 0.00 54.13 54.06 2c91 s LEU 10 Cb -0.11 -2.48 -0.07 0.00 0.50 0.00 0.00 46.19 44.03 2c91 s LEU 10 CO 0.03 -0.22 0.95 -0.83 -1.32 0.00 0.00 176.35 174.96 2c91 s GLY 11 N 1.62 3.06 -0.05 7.98 0.00 0.27 -0.74 107.32 119.47 2c91 s GLY 11 Ca 0.16 0.59 0.07 0.00 0.00 0.00 0.00 44.72 45.55 2c91 s GLY 11 CO 0.10 1.32 1.00 -1.30 0.00 0.00 0.00 173.10 174.22 2c91 n THR 12 N 2.15 1.14 0.28 0.90 -2.24 -0.76 -4.72 114.28 111.03 2c91 n THR 12 Ca 0.00 -1.28 0.12 0.00 -2.27 0.00 0.00 64.05 60.62 2c91 n THR 12 Cb 0.48 0.28 0.80 0.00 -2.10 0.00 0.00 70.33 69.79 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 -0.03 -0.78 1.85 -1.91 -2.52 114.93 111.54 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 0.80 0.00 0.00 0.00 0.43 0.00 0.00 31.60 32.83 2c91 h MET 13 CO 0.00 0.00 -0.00 0.39 -0.40 0.00 0.00 176.91 176.90 2c91 n GLU 14 N -4.15 2.21 -2.16 0.39 -0.58 -1.26 -4.65 120.64 110.44 2c91 n GLU 14 Ca -0.03 -1.76 -0.43 0.00 -0.42 0.00 0.00 57.16 54.52 2c91 n GLU 14 Cb 0.10 -1.46 -0.02 0.00 -0.57 0.00 0.00 31.44 29.48 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 -2.00 3.40 0.00 3.49 -1.94 -0.95 -1.24 119.30 120.06 2c91 s MET 15 Ca 0.30 1.16 0.00 0.00 -1.71 0.00 0.00 55.69 55.44 2c91 s MET 15 Cb 0.20 -4.13 0.00 0.00 2.01 0.00 0.00 34.83 32.91 2c91 s MET 15 CO 0.31 -1.78 0.00 0.41 -0.01 0.00 0.00 175.02 173.95 2c91 n GLY 16 N 5.29 0.58 0.00 -0.03 0.00 0.56 -2.66 105.19 108.93 2c91 n GLY 16 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 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 -1.26 0.00 0.18 1.61 0.63 -0.55 -4.86 116.66 112.41 2c91 n ARG 17 Ca 0.00 0.00 0.07 0.00 -0.92 0.00 0.00 57.85 57.00 2c91 n ARG 17 Cb 0.00 0.00 0.16 0.00 0.45 0.00 0.00 32.46 33.07 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 -5.09 -0.14 2.47 -1.81 -3.43 114.38 106.37 2c91 h ARG 18 Ca 0.00 0.00 -0.65 0.00 -1.26 0.00 0.00 59.98 58.07 2c91 h ARG 18 Cb 0.00 0.00 -0.26 0.00 -1.65 0.00 0.00 29.97 28.06 2c91 h ARG 18 CO 0.00 0.32 -0.70 -1.64 0.56 0.00 0.00 179.97 178.50 2c91 s MET 19 N -3.18 3.48 0.93 0.04 -1.94 -0.37 -4.93 119.30 113.34 2c91 s MET 19 Ca 0.04 -0.59 -0.16 0.00 -1.71 0.00 0.00 55.69 53.27 2c91 s MET 19 Cb 0.08 -2.99 0.22 0.00 2.01 0.00 0.00 34.83 34.14 2c91 s MET 19 CO 0.70 -0.06 1.22 -0.40 -0.01 0.00 0.00 175.02 176.47 2c91 n ASP 20 N 4.40 -0.09 -0.30 3.03 5.68 -1.26 -0.32 116.55 127.69 2c91 n ASP 20 Ca -0.18 -1.42 0.03 0.00 -0.50 0.00 0.00 54.79 52.73 2c91 n ASP 20 Cb 0.51 -0.94 0.23 0.00 -1.14 0.00 0.00 41.12 39.78 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 -1.88 1.49 -0.11 2.12 0.00 -1.98 -0.92 119.26 117.98 2c91 h ALA 21 Ca -0.40 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.43 2c91 h ALA 21 Cb 1.11 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.61 2c91 h ALA 21 CO 0.28 0.39 -0.13 1.03 0.00 0.00 0.00 179.25 180.82 2c91 h SER 22 N 1.05 0.31 -0.77 0.00 0.87 -1.99 -0.12 113.55 112.89 2c91 h SER 22 Ca 0.37 -0.50 0.01 0.00 -1.23 0.00 0.00 61.79 60.44 2c91 h SER 22 Cb 0.13 -0.09 -0.04 0.00 -0.44 0.00 0.00 62.40 61.97 2c91 h SER 22 CO -0.13 0.75 0.51 0.00 -0.53 0.00 0.00 176.83 177.43 2c91 h ALA 23 N 0.57 0.99 -0.47 6.23 0.00 -1.90 -1.96 119.26 122.72 2c91 h ALA 23 Ca 0.01 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 2c91 h ALA 23 Cb 0.67 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 2c91 h ALA 23 CO 0.03 0.38 0.18 0.77 0.00 0.00 0.00 179.25 180.62 2c91 h SER 24 N 1.04 0.65 -0.63 0.00 0.02 -1.05 -1.28 113.55 112.30 2c91 h SER 24 Ca 0.29 -0.17 0.04 0.00 -0.84 0.00 0.00 61.79 61.11 2c91 h SER 24 Cb -0.10 -0.17 -0.05 0.00 0.14 0.00 0.00 62.40 62.22 2c91 h SER 24 CO -0.07 0.64 0.36 0.00 -1.14 0.00 0.00 176.83 176.63 2c91 h ALA 25 N 1.03 0.82 -0.46 3.77 0.00 -0.78 -1.48 119.26 122.16 2c91 h ALA 25 Ca 0.16 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.97 2c91 h ALA 25 Cb 0.20 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 2c91 h ALA 25 CO -0.01 0.07 -0.11 0.00 0.00 0.00 0.00 179.25 179.20 2c91 h ALA 26 N 1.30 0.95 -0.14 0.00 0.00 -1.17 -1.81 119.26 118.40 2c91 h ALA 26 Ca 0.27 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 2c91 h ALA 26 Cb 0.10 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 2c91 h ALA 26 CO -0.14 0.62 0.03 0.77 0.00 0.00 0.00 179.25 180.53 2c91 h SER 27 N 0.75 0.21 -0.14 0.00 0.02 -0.98 -0.61 113.55 112.81 2c91 h SER 27 Ca 0.12 -0.23 -0.00 0.00 -0.84 0.00 0.00 61.79 60.84 2c91 h SER 27 Cb 0.61 -0.06 -0.01 0.00 0.14 0.00 0.00 62.40 63.09 2c91 h SER 27 CO 0.04 0.39 0.08 0.58 -1.14 0.00 0.00 176.83 176.78 2c91 h VAL 28 N 0.02 1.06 -0.38 2.27 2.07 -1.24 -0.08 116.25 119.97 2c91 h VAL 28 Ca 0.04 -0.15 0.08 0.00 0.82 0.00 0.00 66.70 67.49 2c91 h VAL 28 Cb 0.26 0.92 -0.07 0.00 -1.52 0.00 0.00 31.29 30.88 2c91 h VAL 28 CO 0.00 0.06 -0.09 0.03 0.02 0.00 0.00 177.57 177.59 2c91 h ARG 29 N 0.16 0.01 -0.73 1.57 3.08 -1.17 0.33 114.38 117.63 2c91 h ARG 29 Ca 0.05 -0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.06 2c91 h ARG 29 Cb 0.02 -0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.04 2c91 h ARG 29 CO -0.01 0.00 0.32 0.00 -1.07 0.00 0.00 179.97 179.21 2c91 h ALA 30 N 1.38 1.18 -0.18 0.04 0.00 -0.84 -1.29 119.26 119.55 2c91 h ALA 30 Ca 0.18 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 2c91 h ALA 30 Cb 0.28 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 2c91 h ALA 30 CO -0.39 0.60 0.09 0.35 0.00 0.00 0.00 179.25 179.91 2c91 h PHE 31 N 1.05 0.25 0.00 0.00 3.57 -0.19 -3.07 116.94 118.55 2c91 h PHE 31 Ca 0.25 -0.01 -0.13 0.00 3.53 0.00 0.00 57.97 61.61 2c91 h PHE 31 Cb 0.16 -0.08 -0.02 0.00 2.79 0.00 0.00 35.95 38.80 2c91 h PHE 31 CO 0.01 0.26 -0.63 -0.07 -2.23 0.00 0.00 178.31 175.65 2c91 h LEU 32 N 0.18 0.00 -1.10 0.59 3.38 -0.72 -2.69 115.31 114.95 2c91 h LEU 32 Ca 0.06 0.00 0.13 0.00 0.09 0.00 0.00 57.88 58.16 2c91 h LEU 32 Cb 0.09 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 40.76 2c91 h LEU 32 CO -0.01 0.63 0.61 -0.08 0.09 0.00 0.00 178.44 179.69 2c91 h GLU 33 N 0.00 0.86 0.00 1.13 4.57 -1.20 -1.37 114.58 118.57 2c91 h GLU 33 Ca -0.01 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 58.12 2c91 h GLU 33 Cb 1.17 -0.19 0.00 0.00 -0.16 0.00 0.00 28.75 29.56 2c91 h GLU 33 CO 0.08 0.57 0.00 0.54 -1.18 0.00 0.00 179.01 179.02 2c91 n ARG 34 N -4.61 0.36 -0.09 1.92 5.12 -1.02 -4.87 116.66 113.48 2c91 n ARG 34 Ca 0.19 0.07 0.00 0.00 -1.93 0.00 0.00 57.85 56.18 2c91 n ARG 34 Cb 0.40 -1.50 0.00 0.00 -1.16 0.00 0.00 32.46 30.20 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 0.56 0.70 3.90 -0.13 0.00 -0.52 -5.09 105.19 104.62 2c91 n GLY 35 Ca 0.11 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.85 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 -2.11 3.12 0.00 1.61 3.76 -1.22 -5.03 115.29 115.42 2c91 s HIS 36 Ca 0.00 0.79 0.00 0.00 -0.15 0.00 0.00 55.06 55.70 2c91 s HIS 36 Cb 0.00 -3.18 0.00 0.00 1.11 0.00 0.00 32.58 30.51 2c91 s HIS 36 CO 0.00 -1.36 0.00 -1.13 -0.85 0.00 0.00 174.74 171.40 2c91 n SER 37 N -3.03 0.00 -4.74 1.40 3.41 -1.26 -4.42 113.62 104.98 2c91 n SER 37 Ca 0.07 0.00 -0.36 0.00 -0.26 0.00 0.00 58.87 58.33 2c91 n SER 37 Cb 0.59 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 3.47 -0.02 4.33 2.02 -1.26 -1.14 118.70 126.10 2c91 s GLU 38 Ca 0.00 -0.28 0.08 0.00 0.02 0.00 0.00 54.97 54.79 2c91 s GLU 38 Cb 0.00 -3.08 -0.02 0.00 0.10 0.00 0.00 34.13 31.13 2c91 s GLU 38 CO 0.00 0.60 -0.25 -0.51 0.02 0.00 0.00 175.26 175.11 2c91 s LEU 39 N -0.54 2.05 -0.19 1.80 1.43 -0.58 -1.23 118.68 121.42 2c91 s LEU 39 Ca 0.11 -0.46 0.01 0.00 -1.03 0.00 0.00 54.13 52.76 2c91 s LEU 39 Cb -0.12 -1.31 0.02 0.00 0.03 0.00 0.00 46.19 44.82 2c91 s LEU 39 CO 0.02 0.31 -0.19 -0.62 0.23 0.00 0.00 176.35 176.10 2c91 s ASP 40 N -0.60 3.23 0.08 2.29 2.15 0.08 -0.65 116.67 123.25 2c91 s ASP 40 Ca 0.10 -0.71 0.01 0.00 0.43 0.00 0.00 52.55 52.38 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 -0.01 -0.02 0.05 1.07 -0.17 0.00 0.00 175.17 176.09 2c91 n THR 41 N 4.61 0.00 -3.58 1.71 5.66 -0.06 -1.83 114.28 120.79 2c91 n THR 41 Ca -0.20 -0.51 -0.17 0.00 -3.05 0.00 0.00 64.05 60.12 2c91 n THR 41 Cb 0.49 0.22 -0.06 0.00 -1.55 0.00 0.00 70.33 69.43 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 -2.26 -1.51 0.28 1.79 0.00 -1.26 -3.90 121.76 114.90 2c91 s ALA 42 Ca 0.07 1.03 0.01 0.00 0.00 0.00 0.00 51.96 53.06 2c91 s ALA 42 Cb 0.00 0.06 0.66 0.00 0.00 0.00 0.00 23.12 23.85 2c91 s ALA 42 CO 0.05 -0.36 1.67 0.35 0.00 0.00 0.00 175.76 177.46 2c91 h PHE 43 N 3.16 0.40 -0.19 0.00 3.57 -1.80 -2.54 116.94 119.54 2c91 h PHE 43 Ca -0.28 0.05 -0.07 0.00 3.53 0.00 0.00 57.97 61.20 2c91 h PHE 43 Cb 1.16 -0.04 -0.01 0.00 2.79 0.00 0.00 35.95 39.84 2c91 h PHE 43 CO 0.41 -0.15 -0.18 1.98 -2.23 0.00 0.00 178.31 178.15 2c91 h MET 44 N 0.26 0.32 -6.32 1.11 4.05 -1.96 -3.29 114.93 109.10 2c91 h MET 44 Ca 0.53 -0.09 -0.55 0.00 -0.28 0.00 0.00 59.70 59.31 2c91 h MET 44 Cb 1.02 -0.03 -0.00 0.00 -0.80 0.00 0.00 31.60 31.78 2c91 h MET 44 CO -0.60 0.50 0.99 0.71 0.23 0.00 0.00 176.91 178.74 2c91 s TYR 45 N -4.63 2.37 -1.47 1.39 2.02 -0.96 -2.58 117.35 113.50 2c91 s TYR 45 Ca -0.06 0.45 -0.08 0.00 -0.37 0.00 0.00 57.07 57.01 2c91 s TYR 45 Cb 0.15 -3.83 0.05 0.00 -0.40 0.00 0.00 41.96 37.94 2c91 s TYR 45 CO 0.75 -3.31 0.78 0.00 -1.57 0.00 0.00 175.55 172.20 2c91 n ASP 47 N -2.91 -4.73 0.00 0.00 2.03 -1.07 -0.81 116.55 109.06 2c91 n ASP 47 Ca -0.12 -0.09 0.00 0.00 0.52 0.00 0.00 54.79 55.10 2c91 n ASP 47 Cb 0.59 -3.93 0.00 0.00 -0.72 0.00 0.00 41.12 37.07 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 -1.10 0.54 0.10 0.27 0.00 -0.45 -4.97 105.19 99.58 2c91 n GLY 48 Ca -0.12 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.87 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 4.70 0.00 -0.22 1.61 1.08 -0.80 -1.77 115.11 119.70 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 0.78 0.13 1.03 -0.95 0.00 0.00 178.83 179.82 2c91 h SER 50 N 0.00 0.27 -0.59 1.46 0.87 -1.45 -0.67 113.55 113.45 2c91 h SER 50 Ca -0.01 -0.05 -0.03 0.00 -1.23 0.00 0.00 61.79 60.48 2c91 h SER 50 Cb 1.50 -0.07 -0.03 0.00 -0.44 0.00 0.00 62.40 63.37 2c91 h SER 50 CO 0.10 0.24 0.26 -0.33 -0.53 0.00 0.00 176.83 176.57 2c91 h GLU 51 N 0.27 0.86 -0.53 2.24 5.08 -1.79 -1.59 114.58 119.13 2c91 h GLU 51 Ca 0.08 -0.14 -0.05 0.00 -1.00 0.00 0.00 59.36 58.25 2c91 h GLU 51 Cb 0.02 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.10 2c91 h GLU 51 CO -0.01 0.72 0.15 -0.91 -1.00 0.00 0.00 179.01 177.95 2c91 h ASN 52 N 0.81 0.79 -0.11 1.42 -0.26 -1.15 -0.49 115.58 116.59 2c91 h ASN 52 Ca 0.20 -0.22 -0.00 0.00 -0.56 0.00 0.00 56.30 55.72 2c91 h ASN 52 Cb 0.15 -0.21 -0.01 0.00 -1.06 0.00 0.00 38.32 37.20 2c91 h ASN 52 CO -0.02 0.80 0.07 0.40 -1.06 0.00 0.00 177.43 177.61 2c91 h ILE 53 N 0.74 1.08 -0.94 2.81 2.04 -0.99 -2.10 117.51 120.15 2c91 h ILE 53 Ca 0.17 -0.20 -0.01 0.00 1.00 0.00 0.00 64.86 65.82 2c91 h ILE 53 Cb 0.30 1.00 -0.04 0.00 -0.74 0.00 0.00 36.82 37.34 2c91 h ILE 53 CO -0.00 0.07 0.55 -0.07 0.00 0.00 0.00 178.15 178.69 2c91 h LEU 54 N 0.11 1.14 -1.84 1.44 3.38 -1.15 -2.22 115.31 116.17 2c91 h LEU 54 Ca 0.04 -0.08 -0.03 0.00 0.09 0.00 0.00 57.88 57.90 2c91 h LEU 54 Cb 0.05 -0.29 -0.00 0.00 0.09 0.00 0.00 40.66 40.51 2c91 h LEU 54 CO -0.01 0.88 -0.13 1.23 0.09 0.00 0.00 178.44 180.50 2c91 h GLY 55 N 1.30 0.00 -0.14 0.83 0.00 -0.84 -2.77 103.07 101.45 2c91 h GLY 55 Ca 0.33 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.66 2c91 h GLY 55 CO -0.06 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.09 2c91 n GLY 56 N -0.98 -0.23 0.17 4.60 0.00 -0.81 -4.21 105.19 103.73 2c91 n GLY 56 Ca -0.02 -0.38 0.14 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.11 0.61 -1.25 0.99 4.77 -1.04 -4.89 117.00 116.08 2c91 n LEU 57 Ca 0.20 -0.11 -0.09 0.00 -0.03 0.00 0.00 56.01 55.97 2c91 n LEU 57 Cb 0.29 -0.11 0.01 0.00 -2.33 0.00 0.00 43.42 41.28 2c91 n LEU 57 CO 0.16 0.11 -0.06 0.61 -1.33 0.00 0.00 177.39 176.88 2c91 n GLY 58 N 1.21 0.08 0.04 -0.72 0.00 -1.26 -4.92 105.19 99.61 2c91 n GLY 58 Ca 0.17 -0.44 0.13 0.00 0.00 0.00 0.00 46.02 45.88 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 -1.61 0.39 -3.61 0.99 4.77 -1.26 -4.95 117.00 111.71 2c91 n LEU 59 Ca -0.08 0.12 -0.21 0.00 -0.03 0.00 0.00 56.01 55.81 2c91 n LEU 59 Cb 0.57 -0.30 0.06 0.00 -2.33 0.00 0.00 43.42 41.42 2c91 n LEU 59 CO 0.17 0.09 0.06 0.61 -1.33 0.00 0.00 177.39 176.98 2c91 n GLY 60 N 1.44 -0.37 3.76 -0.72 0.00 -1.26 -4.89 105.19 103.16 2c91 n GLY 60 Ca 0.08 0.14 -0.41 0.00 0.00 0.00 0.00 46.02 45.83 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 -6.71 4.35 0.00 0.99 1.43 -1.26 -2.81 118.68 114.66 2c91 s LEU 61 Ca 0.15 2.94 0.00 0.00 -1.03 0.00 0.00 54.13 56.19 2c91 s LEU 61 Cb -0.07 -3.65 0.00 0.00 0.03 0.00 0.00 46.19 42.50 2c91 s LEU 61 CO 0.77 -0.84 0.00 0.61 0.23 0.00 0.00 176.35 177.13 2c91 n GLY 62 N 1.30 0.53 2.85 -3.19 0.00 -1.26 -4.31 105.19 101.12 2c91 n GLY 62 Ca 0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 2c91 n GLY 62 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2c91 n SER 63 N -0.15 6.54 -2.02 1.61 3.41 -1.12 -4.42 113.62 117.47 2c91 n SER 63 Ca 0.00 -3.51 -0.26 0.00 -0.26 0.00 0.00 58.87 54.84 2c91 n SER 63 Cb 0.08 -1.19 -0.03 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 0.80 -0.26 0.10 5.00 0.00 -1.26 -3.31 105.19 106.27 2c91 n GLY 64 Ca 0.33 0.30 0.00 0.00 0.00 0.00 0.00 46.02 46.65 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 0.72 -0.08 -3.69 1.61 9.92 -1.26 -5.12 116.55 118.65 2c91 n ASP 65 Ca 0.09 0.00 -0.11 0.00 -0.53 0.00 0.00 54.79 54.24 2c91 n ASP 65 Cb 0.05 -0.03 -0.12 0.00 -0.64 0.00 0.00 41.12 40.39 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 5.94 1.10 -3.36 0.00 1.35 -1.92 -3.45 112.91 112.57 2c91 h THR 67 Ca -0.28 -2.73 -0.56 0.00 -0.55 0.00 0.00 66.41 62.29 2c91 h THR 67 Cb 1.14 2.75 -0.04 0.00 -1.73 0.00 0.00 68.15 70.27 2c91 h THR 67 CO 0.24 0.82 0.29 -0.69 -0.25 0.00 0.00 175.52 175.93 2c91 s VAL 68 N -2.61 4.93 -0.10 6.82 1.01 -1.26 -4.88 120.40 124.31 2c91 s VAL 68 Ca -0.10 1.76 -0.02 0.00 0.00 0.00 0.00 61.98 63.61 2c91 s VAL 68 Cb 0.07 -4.18 -0.03 0.00 0.00 0.00 0.00 36.38 32.23 2c91 s VAL 68 CO 0.85 0.15 -0.02 -0.54 0.00 0.00 0.00 175.10 175.55 2c91 s LYS 69 N 1.24 3.09 -0.07 2.72 -0.14 -0.29 -4.64 119.74 121.64 2c91 s LYS 69 Ca 0.44 -0.45 0.04 0.00 -1.36 0.00 0.00 55.97 54.64 2c91 s LYS 69 Cb -0.19 -2.79 -0.01 0.00 -1.68 0.00 0.00 37.83 33.16 2c91 s LYS 69 CO 0.21 0.60 -0.20 -1.50 -0.76 0.00 0.00 175.35 173.69 2c91 s ILE 70 N -0.61 2.46 -0.02 2.17 1.10 -1.26 -1.53 121.20 123.51 2c91 s ILE 70 Ca 0.10 -0.91 0.07 0.00 -0.51 0.00 0.00 60.65 59.39 2c91 s ILE 70 Cb -0.12 -1.94 -0.02 0.00 0.15 0.00 0.00 42.46 40.53 2c91 s ILE 70 CO 0.02 0.57 -0.23 0.00 -2.11 0.00 0.00 174.94 173.19 2c91 s ALA 71 N -0.16 2.31 0.31 1.50 0.00 0.18 -1.61 121.76 124.30 2c91 s ALA 71 Ca -0.03 -1.09 0.05 0.00 0.00 0.00 0.00 51.96 50.89 2c91 s ALA 71 Cb -0.14 -0.66 -0.03 0.00 0.00 0.00 0.00 23.12 22.29 2c91 s ALA 71 CO 0.04 0.54 0.29 -0.08 0.00 0.00 0.00 175.76 176.55 2c91 s THR 72 N -0.66 0.00 -0.06 0.00 -1.32 -0.67 -0.88 115.64 112.04 2c91 s THR 72 Ca 0.11 -1.93 -0.08 0.00 -1.21 0.00 0.00 61.69 58.57 2c91 s THR 72 Cb -0.10 -2.52 0.02 0.00 -1.51 0.00 0.00 72.50 68.39 2c91 s THR 72 CO -0.00 0.00 0.21 -0.54 -2.21 0.00 0.00 174.62 172.08 2c91 s LYS 73 N -3.49 0.34 -0.07 7.08 1.02 -1.25 -0.53 119.74 122.85 2c91 s LYS 73 Ca 0.39 0.11 -0.02 0.00 0.02 0.00 0.00 55.97 56.47 2c91 s LYS 73 Cb 0.03 0.15 -0.04 0.00 -0.52 0.00 0.00 37.83 37.45 2c91 s LYS 73 CO 0.24 -0.06 0.06 0.00 -0.92 0.00 0.00 175.35 174.67 2c91 s ALA 74 N -0.32 3.51 0.15 5.17 0.00 -0.40 -2.11 121.76 127.75 2c91 s ALA 74 Ca -0.04 -0.79 0.05 0.00 0.00 0.00 0.00 51.96 51.18 2c91 s ALA 74 Cb -0.03 -1.61 -0.04 0.00 0.00 0.00 0.00 23.12 21.43 2c91 s ALA 74 CO 0.01 0.63 -0.12 0.54 0.00 0.00 0.00 175.76 176.82 2c91 s ASN 75 N -1.19 1.98 0.00 0.00 2.20 -1.26 -1.29 114.94 115.38 2c91 s ASN 75 Ca 0.17 -0.97 0.29 0.00 -0.94 0.00 0.00 52.86 51.41 2c91 s ASN 75 Cb -0.12 -0.05 1.31 0.00 -2.00 0.00 0.00 41.25 40.40 2c91 s ASN 75 CO 0.06 -0.26 1.89 -0.81 -2.94 0.00 0.00 177.10 175.05 2c91 n PRO 76 N -0.08 1.36 -1.41 3.55 -0.04 -1.26 -4.42 135.00 132.70 2c91 n PRO 76 Ca -0.11 -0.60 -0.30 0.00 -0.04 0.00 0.00 63.50 62.44 2c91 n PRO 76 Cb 0.60 -1.49 0.09 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 -2.05 2.72 -1.46 0.54 0.51 -1.26 -1.21 118.94 116.73 2c91 s TRP 77 Ca 0.40 1.32 -0.07 0.00 -2.12 0.00 0.00 56.10 55.63 2c91 s TRP 77 Cb 0.21 -3.06 0.05 0.00 -0.81 0.00 0.00 33.47 29.86 2c91 s TRP 77 CO 0.36 -1.81 0.73 0.39 -0.51 0.00 0.00 176.95 176.11 2c91 n GLU 78 N -3.49 -4.44 -0.90 4.98 1.02 -1.26 -1.62 120.64 114.94 2c91 n GLU 78 Ca 0.08 0.52 0.00 0.00 -0.02 0.00 0.00 57.16 57.74 2c91 n GLU 78 Cb 0.55 -5.09 0.00 0.00 -0.02 0.00 0.00 31.44 26.87 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 -1.69 0.93 0.18 0.62 0.00 -1.25 -4.93 105.19 99.05 2c91 n GLY 79 Ca -0.14 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.68 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 3.13 0.62 -2.48 1.61 1.57 -1.19 -3.50 116.57 116.33 2c91 h LYS 80 Ca 0.00 -0.74 0.27 0.00 -1.87 0.00 0.00 60.65 58.31 2c91 h LYS 80 Cb 0.00 0.22 -0.12 0.00 0.08 0.00 0.00 32.23 32.42 2c91 h LYS 80 CO 0.00 1.32 -0.74 -1.13 -0.57 0.00 0.00 179.45 178.32 2c91 n SER 81 N -3.80 -6.13 -1.65 0.86 3.41 -0.35 -4.57 113.62 101.38 2c91 n SER 81 Ca -0.11 0.85 -0.11 0.00 -0.26 0.00 0.00 58.87 59.23 2c91 n SER 81 Cb 0.92 -3.47 0.21 0.00 -0.26 0.00 0.00 64.21 61.62 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 -3.79 5.35 -4.68 1.04 4.77 -1.26 -4.31 117.00 114.13 2c91 n LEU 82 Ca -0.04 -3.59 -0.35 0.00 -0.03 0.00 0.00 56.01 52.00 2c91 n LEU 82 Cb 0.49 -0.72 0.10 0.00 -2.33 0.00 0.00 43.42 40.96 2c91 n LEU 82 CO 0.02 1.08 0.73 0.29 -1.33 0.00 0.00 177.39 178.19 2c91 n LYS 83 N -0.96 0.51 -0.22 3.23 4.76 -1.26 -4.36 118.16 119.86 2c91 n LYS 83 Ca 0.43 0.24 -0.01 0.00 -2.87 0.00 0.00 58.31 56.11 2c91 n LYS 83 Cb 1.31 -2.40 0.06 0.00 -1.84 0.00 0.00 35.03 32.16 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 -0.37 -0.02 -0.77 1.97 0.11 -1.92 -0.77 132.00 130.24 2c91 h PRO 84 Ca -0.48 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.59 2c91 h PRO 84 Cb 1.32 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.40 2c91 h PRO 84 CO 0.48 -0.01 0.31 -0.44 -0.21 0.00 0.00 178.00 178.13 2c91 h ASP 85 N -0.02 1.04 0.06 -2.05 3.32 -1.98 -2.09 116.42 114.70 2c91 h ASP 85 Ca 0.31 -0.16 -0.00 0.00 0.02 0.00 0.00 57.03 57.20 2c91 h ASP 85 Cb 0.49 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 39.77 2c91 h ASP 85 CO -0.68 0.92 -0.03 -1.28 -1.72 0.00 0.00 179.24 176.45 2c91 h SER 86 N 1.11 -0.07 -0.68 6.45 0.87 -1.60 -0.23 113.55 119.40 2c91 h SER 86 Ca 0.26 -0.21 -0.00 0.00 -1.23 0.00 0.00 61.79 60.60 2c91 h SER 86 Cb 0.20 0.02 -0.03 0.00 -0.44 0.00 0.00 62.40 62.15 2c91 h SER 86 CO -0.02 0.17 0.41 0.16 -0.53 0.00 0.00 176.83 177.02 2c91 h ILE 87 N -0.32 1.19 -0.27 2.23 3.07 -1.09 -0.24 117.51 122.08 2c91 h ILE 87 Ca -0.01 -0.43 -0.02 0.00 1.55 0.00 0.00 64.86 65.95 2c91 h ILE 87 Cb 0.28 0.23 -0.01 0.00 -0.27 0.00 0.00 36.82 37.05 2c91 h ILE 87 CO 0.01 0.20 0.09 -0.09 -1.05 0.00 0.00 178.15 177.32 2c91 h ARG 88 N 0.95 0.42 -0.44 0.16 2.43 -1.29 -1.75 114.38 114.85 2c91 h ARG 88 Ca 0.25 -0.09 -0.01 0.00 -0.81 0.00 0.00 59.98 59.32 2c91 h ARG 88 Cb -0.03 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.43 2c91 h ARG 88 CO -0.05 0.47 0.23 1.03 -1.51 0.00 0.00 179.97 180.15 2c91 h SER 89 N 0.28 0.56 -0.17 -3.80 0.87 -0.56 -0.64 113.55 110.09 2c91 h SER 89 Ca 0.09 -0.10 -0.00 0.00 -1.23 0.00 0.00 61.79 60.54 2c91 h SER 89 Cb 0.22 -0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 62.03 2c91 h SER 89 CO -0.00 0.50 0.10 1.56 -0.53 0.00 0.00 176.83 178.46 2c91 h GLN 90 N 0.57 0.24 -0.46 2.24 4.20 -1.02 -0.59 115.11 120.28 2c91 h GLN 90 Ca 0.15 -0.02 -0.04 0.00 0.06 0.00 0.00 58.65 58.80 2c91 h GLN 90 Cb 0.08 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 27.79 2c91 h GLN 90 CO -0.02 0.21 0.14 1.25 -0.67 0.00 0.00 178.83 179.74 2c91 h LEU 91 N 0.19 0.67 -0.96 1.46 5.85 -1.19 0.12 115.31 121.46 2c91 h LEU 91 Ca 0.06 -0.21 -0.06 0.00 0.84 0.00 0.00 57.88 58.52 2c91 h LEU 91 Cb 0.04 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 40.87 2c91 h LEU 91 CO -0.01 0.70 0.12 -0.33 -0.34 0.00 0.00 178.44 178.58 2c91 h GLU 92 N 0.61 0.88 -0.19 1.25 5.08 -1.02 -0.39 114.58 120.80 2c91 h GLU 92 Ca 0.15 -0.19 -0.01 0.00 -1.00 0.00 0.00 59.36 58.31 2c91 h GLU 92 Cb 0.27 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.39 2c91 h GLU 92 CO -0.00 0.80 0.09 1.15 -1.00 0.00 0.00 179.01 180.05 2c91 h THR 93 N 0.84 1.13 -0.20 1.13 2.02 -0.91 -2.61 112.91 114.31 2c91 h THR 93 Ca 0.18 -0.36 0.04 0.00 0.77 0.00 0.00 66.41 67.04 2c91 h THR 93 Cb 0.33 1.03 -0.04 0.00 -1.74 0.00 0.00 68.15 67.73 2c91 h THR 93 CO 0.00 0.12 -0.05 0.28 0.37 0.00 0.00 175.52 176.24 2c91 h SER 94 N 0.18 -0.18 -0.87 4.18 0.02 -0.44 -1.37 113.55 115.07 2c91 h SER 94 Ca 0.06 0.06 0.12 0.00 -0.84 0.00 0.00 61.79 61.19 2c91 h SER 94 Cb 0.11 0.12 -0.08 0.00 0.14 0.00 0.00 62.40 62.69 2c91 h SER 94 CO -0.01 -0.06 0.50 -0.07 -1.14 0.00 0.00 176.83 176.04 2c91 h LEU 95 N 0.00 0.68 -0.03 5.07 3.38 -1.08 0.39 115.31 123.72 2c91 h LEU 95 Ca 0.10 0.06 -0.00 0.00 0.09 0.00 0.00 57.88 58.13 2c91 h LEU 95 Cb 0.15 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 40.83 2c91 h LEU 95 CO -0.21 0.36 0.01 0.50 0.09 0.00 0.00 178.44 179.19 2c91 h LYS 96 N 0.78 0.04 -0.43 1.13 3.64 -1.04 0.43 116.57 121.12 2c91 h LYS 96 Ca 0.44 -0.01 -0.09 0.00 -1.27 0.00 0.00 60.65 59.72 2c91 h LYS 96 Cb 0.48 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.28 2c91 h LYS 96 CO -0.29 0.15 -0.11 0.00 -2.27 0.00 0.00 179.45 176.93 2c91 h ARG 97 N -0.08 0.78 0.00 1.90 3.08 -0.14 -1.98 114.38 117.95 2c91 h ARG 97 Ca 0.01 -0.26 0.00 0.00 0.07 0.00 0.00 59.98 59.80 2c91 h ARG 97 Cb 0.12 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.11 2c91 h ARG 97 CO -0.00 0.86 0.00 1.28 -1.07 0.00 0.00 179.97 181.04 2c91 n LEU 98 N -4.16 0.00 -3.58 3.04 4.77 0.13 -3.88 117.00 113.31 2c91 n LEU 98 Ca 0.01 0.41 -0.20 0.00 -0.03 0.00 0.00 56.01 56.20 2c91 n LEU 98 Cb 0.37 -0.41 0.07 0.00 -2.33 0.00 0.00 43.42 41.12 2c91 n LEU 98 CO 0.43 -0.07 0.07 0.00 -1.33 0.00 0.00 177.39 176.50 2c91 n GLN 99 N -1.41 -6.20 -3.77 3.23 6.02 0.01 -4.31 117.38 110.95 2c91 n GLN 99 Ca 0.08 0.76 -0.13 0.00 -0.01 0.00 0.00 57.00 57.70 2c91 n GLN 99 Cb 0.25 -5.63 -0.11 0.00 1.02 0.00 0.00 30.24 25.77 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 5.60 0.00 -2.06 0.00 0.13 -1.82 -3.42 132.00 130.44 2c91 h PRO 101 Ca -0.26 0.00 0.09 0.00 -0.87 0.00 0.00 66.00 64.96 2c91 h PRO 101 Cb 1.19 0.00 -0.18 0.00 0.13 0.00 0.00 31.00 32.14 2c91 h PRO 101 CO 0.32 0.00 0.49 -0.98 -0.23 0.00 0.00 178.00 177.60 2c91 s ARG 102 N -3.14 0.77 0.10 0.86 1.70 -1.26 -4.62 118.95 113.36 2c91 s ARG 102 Ca 0.09 -0.14 0.01 0.00 -0.47 0.00 0.00 55.73 55.22 2c91 s ARG 102 Cb 0.11 0.36 -0.04 0.00 -0.57 0.00 0.00 34.95 34.81 2c91 s ARG 102 CO 0.63 -0.31 0.25 0.14 -1.08 0.00 0.00 175.30 174.94 2c91 s VAL 103 N -2.43 5.35 0.10 4.99 -7.23 -0.92 -3.98 120.40 116.29 2c91 s VAL 103 Ca 0.02 -0.48 0.12 0.00 -1.81 0.00 0.00 61.98 59.82 2c91 s VAL 103 Cb -0.01 -3.68 -0.04 0.00 0.56 0.00 0.00 36.38 33.21 2c91 s VAL 103 CO -0.05 0.03 1.48 0.44 -0.31 0.00 0.00 175.10 176.69 2c91 h ASP 104 N 2.67 0.00 -3.47 4.85 3.32 -1.64 -0.66 116.42 121.49 2c91 h ASP 104 Ca -0.46 0.00 -0.19 0.00 0.02 0.00 0.00 57.03 56.39 2c91 h ASP 104 Cb 1.17 0.00 -0.29 0.00 0.22 0.00 0.00 39.33 40.44 2c91 h ASP 104 CO 0.73 0.68 -0.49 -0.22 -1.72 0.00 0.00 179.24 178.23 2c91 s LEU 105 N -6.92 0.61 -0.14 1.55 2.96 -0.99 -1.20 118.68 114.56 2c91 s LEU 105 Ca 0.01 0.49 -0.00 0.00 -0.22 0.00 0.00 54.13 54.41 2c91 s LEU 105 Cb 0.10 0.72 0.03 0.00 0.50 0.00 0.00 46.19 47.54 2c91 s LEU 105 CO 0.76 -0.14 -0.10 0.12 -1.32 0.00 0.00 176.35 175.68 2c91 s PHE 106 N 0.97 1.82 0.02 5.38 5.36 -0.10 -1.67 117.98 129.75 2c91 s PHE 106 Ca -0.07 -1.02 0.00 0.00 -0.96 0.00 0.00 56.93 54.88 2c91 s PHE 106 Cb -0.08 -1.40 -0.04 0.00 -0.34 0.00 0.00 43.02 41.16 2c91 s PHE 106 CO -0.06 -0.60 0.10 0.71 -1.46 0.00 0.00 175.22 173.91 2c91 s TYR 107 N 1.60 3.32 -0.44 10.12 2.02 0.32 -0.91 117.35 133.37 2c91 s TYR 107 Ca 0.04 0.20 -0.28 0.00 -0.37 0.00 0.00 57.07 56.66 2c91 s TYR 107 Cb -0.13 -1.73 0.03 0.00 -0.40 0.00 0.00 41.96 39.73 2c91 s TYR 107 CO -0.09 0.56 1.07 -0.51 -1.57 0.00 0.00 175.55 175.01 2c91 s LEU 108 N -1.95 3.78 0.14 -1.29 1.43 -0.69 -1.28 118.68 118.82 2c91 s LEU 108 Ca 0.26 0.49 -0.09 0.00 -1.03 0.00 0.00 54.13 53.76 2c91 s LEU 108 Cb -0.12 -3.46 -0.04 0.00 0.03 0.00 0.00 46.19 42.60 2c91 s LEU 108 CO 0.17 -1.13 1.43 -0.74 0.23 0.00 0.00 176.35 176.31 2c91 h HIS 109 N 8.97 1.01 -2.56 0.29 2.76 -1.43 -0.58 115.15 123.62 2c91 h HIS 109 Ca -0.23 -0.36 -0.03 0.00 -2.20 0.00 0.00 60.37 57.56 2c91 h HIS 109 Cb 1.06 -0.19 -0.15 0.00 1.55 0.00 0.00 27.41 29.68 2c91 h HIS 109 CO 0.92 1.17 0.23 0.00 -1.30 0.00 0.00 177.93 178.95 2c91 s ALA 110 N -4.11 -1.68 0.46 5.26 0.00 -1.22 -4.27 121.76 116.20 2c91 s ALA 110 Ca -0.10 0.85 -0.25 0.00 0.00 0.00 0.00 51.96 52.46 2c91 s ALA 110 Cb 0.10 0.50 -0.08 0.00 0.00 0.00 0.00 23.12 23.64 2c91 s ALA 110 CO 0.88 -0.61 1.37 -2.30 0.00 0.00 0.00 175.76 175.10 2c91 n PRO 111 N 0.13 2.06 -3.48 0.00 -0.02 -1.26 -4.56 135.00 127.87 2c91 n PRO 111 Ca -0.17 0.74 -0.42 0.00 -2.02 0.00 0.00 63.50 61.62 2c91 n PRO 111 Cb 0.62 -2.54 -0.07 0.00 -0.02 0.00 0.00 33.50 31.49 2c91 n PRO 111 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2c91 s ASP 112 N -0.56 5.93 0.00 2.55 -1.08 -1.26 -4.87 116.67 117.38 2c91 s ASP 112 Ca 0.63 -2.12 0.18 0.00 -0.52 0.00 0.00 52.55 50.71 2c91 s ASP 112 Cb -0.46 -2.07 0.91 0.00 -1.46 0.00 0.00 42.92 39.84 2c91 s ASP 112 CO 0.56 -0.67 1.54 1.41 0.52 0.00 0.00 175.17 178.53 2c91 n HIS 113 N 4.67 0.00 1.04 -5.34 8.25 -1.26 -2.28 115.22 120.30 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 -0.28 0.10 0.00 1.12 0.00 0.00 29.99 31.35 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 -1.28 1.01 -4.19 0.41 7.64 -1.26 -4.84 113.62 111.12 2c91 n SER 114 Ca 0.09 -0.82 -0.34 0.00 1.01 0.00 0.00 58.87 58.81 2c91 n SER 114 Cb 0.14 0.54 -0.15 0.00 -1.01 0.00 0.00 64.21 63.72 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 -2.84 2.49 0.17 0.44 2.01 -0.96 -5.08 115.64 111.87 2c91 s THR 115 Ca 0.13 -0.79 -0.34 0.00 0.31 0.00 0.00 61.69 61.00 2c91 s THR 115 Cb 0.17 -2.08 -0.15 0.00 0.01 0.00 0.00 72.50 70.46 2c91 s THR 115 CO 0.71 0.50 1.42 -2.65 -0.69 0.00 0.00 174.62 173.91 2c91 n PRO 116 N 4.64 1.76 0.17 4.92 -0.02 -1.26 -4.84 135.00 140.37 2c91 n PRO 116 Ca -0.20 0.63 0.04 0.00 -2.02 0.00 0.00 63.50 61.95 2c91 n PRO 116 Cb 0.50 -2.30 0.46 0.00 -0.02 0.00 0.00 33.50 32.15 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 3.25 1.14 -0.29 -1.45 3.04 -1.98 -1.61 116.25 118.34 2c91 h VAL 117 Ca -0.45 -0.61 -0.02 0.00 -1.01 0.00 0.00 66.70 64.61 2c91 h VAL 117 Cb 1.29 1.21 -0.02 0.00 -2.01 0.00 0.00 31.29 31.77 2c91 h VAL 117 CO 0.80 0.18 0.11 -0.33 -1.01 0.00 0.00 177.57 177.32 2c91 h GLU 118 N 0.12 0.41 -0.06 4.17 3.07 -1.99 -0.19 114.58 120.11 2c91 h GLU 118 Ca 0.03 -0.05 -0.00 0.00 -0.50 0.00 0.00 59.36 58.84 2c91 h GLU 118 Cb 0.29 -0.08 -0.00 0.00 -0.84 0.00 0.00 28.75 28.12 2c91 h GLU 118 CO 0.02 0.35 0.03 0.93 -1.40 0.00 0.00 179.01 178.93 2c91 h GLU 119 N 0.41 0.09 -0.30 2.33 5.08 -1.66 -1.05 114.58 119.49 2c91 h GLU 119 Ca 0.10 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.44 2c91 h GLU 119 Cb 0.10 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 2c91 h GLU 119 CO -0.01 0.22 0.17 1.15 -1.00 0.00 0.00 179.01 179.53 2c91 h THR 120 N -0.05 1.13 -0.44 1.13 2.02 -1.45 -2.65 112.91 112.60 2c91 h THR 120 Ca 0.02 -0.35 -0.12 0.00 0.77 0.00 0.00 66.41 66.74 2c91 h THR 120 Cb 0.16 0.81 -0.02 0.00 -1.74 0.00 0.00 68.15 67.36 2c91 h THR 120 CO -0.00 0.13 -0.19 -0.07 0.37 0.00 0.00 175.52 175.76 2c91 h LEU 121 N 0.37 0.87 -0.62 2.58 3.38 -1.00 -1.19 115.31 119.71 2c91 h LEU 121 Ca 0.11 -0.31 0.03 0.00 0.09 0.00 0.00 57.88 57.81 2c91 h LEU 121 Cb 0.06 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.53 2c91 h LEU 121 CO -0.02 1.04 0.37 0.00 0.09 0.00 0.00 178.44 179.92 2c91 h ALA 123 N 1.28 0.70 -0.72 0.00 0.00 -1.08 -1.81 119.26 117.64 2c91 h ALA 123 Ca 0.26 -0.33 0.06 0.00 0.00 0.00 0.00 54.91 54.91 2c91 h ALA 123 Cb 0.06 -0.19 -0.06 0.00 0.00 0.00 0.00 17.79 17.60 2c91 h ALA 123 CO -0.12 0.58 0.41 0.00 0.00 0.00 0.00 179.25 180.12 2c91 h HIS 125 N 0.75 0.06 -0.38 0.00 6.17 -0.77 -1.47 115.15 119.51 2c91 h HIS 125 Ca 0.32 0.01 0.07 0.00 0.71 0.00 0.00 60.37 61.48 2c91 h HIS 125 Cb 0.20 -0.01 -0.06 0.00 2.52 0.00 0.00 27.41 30.06 2c91 h HIS 125 CO -0.07 0.03 0.01 0.37 0.71 0.00 0.00 177.93 178.99 2c91 h GLN 126 N 0.09 0.12 -0.61 5.26 5.75 -0.78 0.11 115.11 125.04 2c91 h GLN 126 Ca 0.05 -0.01 -0.01 0.00 -0.15 0.00 0.00 58.65 58.53 2c91 h GLN 126 Cb 0.03 -0.03 -0.03 0.00 1.07 0.00 0.00 27.48 28.53 2c91 h GLN 126 CO -0.06 0.08 0.34 -0.07 -2.65 0.00 0.00 178.83 176.47 2c91 h LEU 127 N 0.12 0.75 -0.25 -2.39 3.38 -0.84 -1.21 115.31 114.87 2c91 h LEU 127 Ca 0.19 -0.05 -0.03 0.00 0.09 0.00 0.00 57.88 58.08 2c91 h LEU 127 Cb 0.26 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 2c91 h LEU 127 CO -0.30 0.60 0.05 -0.74 0.09 0.00 0.00 178.44 178.15 2c91 h HIS 128 N 0.85 0.43 0.00 1.13 2.76 -0.48 -2.24 115.15 117.60 2c91 h HIS 128 Ca 0.22 -0.05 -0.01 0.00 -2.20 0.00 0.00 60.37 58.33 2c91 h HIS 128 Cb 0.02 -0.12 -0.00 0.00 1.55 0.00 0.00 27.41 28.86 2c91 h HIS 128 CO 0.00 0.51 -0.03 1.96 -1.30 0.00 0.00 177.93 179.07 2c91 h GLN 129 N 0.23 0.00 0.00 5.26 1.08 -0.06 0.60 115.11 122.23 2c91 h GLN 129 Ca 0.08 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.28 2c91 h GLN 129 Cb 0.30 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.73 2c91 h GLN 129 CO 0.00 0.03 0.00 0.39 -0.95 0.00 0.00 178.83 178.30 2c91 n GLU 130 N -4.41 0.61 -0.73 1.46 1.02 -0.53 -4.91 120.64 113.15 2c91 n GLU 130 Ca -0.03 0.02 0.00 0.00 -0.02 0.00 0.00 57.16 57.13 2c91 n GLU 130 Cb 0.12 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.04 2c91 n GLU 130 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2c91 n GLY 131 N 0.93 0.59 0.14 0.62 0.00 0.20 -4.95 105.19 102.72 2c91 n GLY 131 Ca 0.17 -0.36 0.12 0.00 0.00 0.00 0.00 46.02 45.95 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 1.00 0.00 -3.28 1.61 1.57 -1.58 -3.42 116.57 112.47 2c91 h LYS 132 Ca 0.00 0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.66 2c91 h LYS 132 Cb 0.00 0.00 -0.19 0.00 0.08 0.00 0.00 32.23 32.12 2c91 h LYS 132 CO 0.00 0.00 -0.34 -0.59 -0.57 0.00 0.00 179.45 177.95 2c91 s PHE 133 N -3.22 -0.08 -0.12 -1.35 -0.71 -1.26 -2.15 117.98 109.10 2c91 s PHE 133 Ca 0.06 0.02 -0.04 0.00 -1.04 0.00 0.00 56.93 55.93 2c91 s PHE 133 Cb 0.09 0.04 -0.02 0.00 -1.21 0.00 0.00 43.02 41.93 2c91 s PHE 133 CO 0.70 -0.40 -0.04 0.28 -1.34 0.00 0.00 175.22 174.41 2c91 h VAL 134 N 3.74 0.04 -4.09 -2.49 2.07 -1.19 -3.43 116.25 110.90 2c91 h VAL 134 Ca -0.31 -1.04 -0.69 0.00 0.82 0.00 0.00 66.70 65.49 2c91 h VAL 134 Cb 1.19 0.08 -0.24 0.00 -1.52 0.00 0.00 31.29 30.80 2c91 h VAL 134 CO 0.43 0.01 -0.85 -1.61 0.02 0.00 0.00 177.57 175.57 2c91 s GLU 135 N -1.80 1.81 0.04 1.57 2.02 -0.34 -5.00 118.70 116.99 2c91 s GLU 135 Ca -0.06 -1.12 -0.15 0.00 0.02 0.00 0.00 54.97 53.66 2c91 s GLU 135 Cb 0.01 -2.04 -0.06 0.00 0.10 0.00 0.00 34.13 32.14 2c91 s GLU 135 CO 0.09 0.51 0.46 -1.17 0.02 0.00 0.00 175.26 175.17 2c91 s LEU 136 N -1.51 4.46 0.22 1.80 2.96 -1.26 -0.92 118.68 124.42 2c91 s LEU 136 Ca 0.13 1.03 0.05 0.00 -0.22 0.00 0.00 54.13 55.13 2c91 s LEU 136 Cb -0.10 -2.78 -0.05 0.00 0.50 0.00 0.00 46.19 43.75 2c91 s LEU 136 CO 0.04 0.27 -0.07 -0.83 -1.32 0.00 0.00 176.35 174.44 2c91 s GLY 137 N -1.24 1.48 0.17 7.98 0.00 -0.09 -1.15 107.32 114.48 2c91 s GLY 137 Ca 0.28 -1.71 0.09 0.00 0.00 0.00 0.00 44.72 43.38 2c91 s GLY 137 CO 0.16 -1.71 -0.20 1.08 0.00 0.00 0.00 173.10 172.43 2c91 s LEU 138 N -3.31 2.43 -0.09 0.66 1.43 -0.16 -1.71 118.68 117.94 2c91 s LEU 138 Ca 0.25 -0.86 -0.08 0.00 -1.03 0.00 0.00 54.13 52.41 2c91 s LEU 138 Cb 0.03 -0.93 0.02 0.00 0.03 0.00 0.00 46.19 45.34 2c91 s LEU 138 CO 0.07 0.02 0.23 -0.55 0.23 0.00 0.00 176.35 176.35 2c91 s SER 139 N -2.65 -0.24 -0.80 2.29 0.15 -0.23 -0.84 113.70 111.38 2c91 s SER 139 Ca 0.17 0.47 0.00 0.00 0.70 0.00 0.00 55.95 57.29 2c91 s SER 139 Cb -0.07 0.47 0.00 0.00 -1.71 0.00 0.00 66.02 64.71 2c91 s SER 139 CO 0.08 -0.09 0.00 0.59 1.20 0.00 0.00 173.24 175.02 2c91 n ASN 140 N 3.08 -4.11 -4.87 5.45 3.02 -1.25 -3.46 115.26 113.11 2c91 n ASN 140 Ca -0.14 0.19 -0.33 0.00 -0.03 0.00 0.00 54.58 54.27 2c91 n ASN 140 Cb 0.58 -2.28 -0.05 0.00 -0.61 0.00 0.00 39.78 37.42 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 -2.21 3.50 0.54 3.10 1.51 -1.26 -0.85 117.35 121.68 2c91 s TYR 141 Ca 0.00 0.81 -0.19 0.00 -1.01 0.00 0.00 57.07 56.67 2c91 s TYR 141 Cb 0.00 -2.19 -0.06 0.00 -0.11 0.00 0.00 41.96 39.60 2c91 s TYR 141 CO 0.00 0.40 1.10 0.00 -1.11 0.00 0.00 175.55 175.94 2c91 s ALA 142 N -1.62 2.73 0.31 3.71 0.00 -1.26 -4.70 121.76 120.93 2c91 s ALA 142 Ca 0.41 0.74 0.07 0.00 0.00 0.00 0.00 51.96 53.18 2c91 s ALA 142 Cb -0.13 -3.33 0.80 0.00 0.00 0.00 0.00 23.12 20.46 2c91 s ALA 142 CO 0.21 -0.67 1.75 0.66 0.00 0.00 0.00 175.76 177.70 2c91 h SER 143 N 1.21 0.71 0.58 0.00 4.64 -1.93 0.45 113.55 119.20 2c91 h SER 143 Ca -0.50 0.12 -0.09 0.00 -0.47 0.00 0.00 61.79 60.85 2c91 h SER 143 Cb 1.25 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.33 2c91 h SER 143 CO 0.57 0.18 -0.43 4.11 -0.87 0.00 0.00 176.83 180.40 2c91 h TRP 144 N 0.66 0.00 -0.01 4.77 5.08 -1.94 -1.17 115.95 123.34 2c91 h TRP 144 Ca 0.60 0.00 -0.23 0.00 1.08 0.00 0.00 58.89 60.35 2c91 h TRP 144 Cb 1.04 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.21 2c91 h TRP 144 CO -0.01 0.43 -0.93 0.93 -1.28 0.00 0.00 178.44 177.57 2c91 h GLU 145 N 0.00 0.47 -0.45 0.12 5.08 -1.34 -2.51 114.58 115.94 2c91 h GLU 145 Ca -0.00 -0.48 0.02 0.00 -1.00 0.00 0.00 59.36 57.89 2c91 h GLU 145 Cb 0.83 0.13 -0.03 0.00 0.50 0.00 0.00 28.75 30.19 2c91 h GLU 145 CO 0.06 1.13 0.27 0.28 -1.00 0.00 0.00 179.01 179.75 2c91 h VAL 146 N 0.27 1.06 -0.66 3.13 2.07 -0.78 -1.81 116.25 119.53 2c91 h VAL 146 Ca -0.08 -0.19 0.01 0.00 0.82 0.00 0.00 66.70 67.26 2c91 h VAL 146 Cb 1.56 0.46 -0.03 0.00 -1.52 0.00 0.00 31.29 31.76 2c91 h VAL 146 CO 0.17 0.10 0.43 0.00 0.02 0.00 0.00 177.57 178.29 2c91 h ALA 147 N 1.20 0.83 -0.44 1.67 0.00 -1.24 -0.08 119.26 121.21 2c91 h ALA 147 Ca 0.18 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 2c91 h ALA 147 Cb 0.00 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 2c91 h ALA 147 CO -0.08 0.27 0.27 1.49 0.00 0.00 0.00 179.25 181.20 2c91 h GLU 148 N 0.89 0.59 -0.08 0.00 4.81 -1.25 -1.51 114.58 118.02 2c91 h GLU 148 Ca 0.24 -0.05 -0.00 0.00 -0.13 0.00 0.00 59.36 59.42 2c91 h GLU 148 Cb -0.09 -0.13 -0.00 0.00 0.63 0.00 0.00 28.75 29.16 2c91 h GLU 148 CO -0.05 0.42 0.03 0.82 -0.73 0.00 0.00 179.01 179.50 2c91 h ILE 149 N 0.59 1.13 -0.79 2.32 2.04 -0.86 -0.67 117.51 121.26 2c91 h ILE 149 Ca 0.16 -0.39 0.02 0.00 1.00 0.00 0.00 64.86 65.65 2c91 h ILE 149 Cb -0.02 1.24 -0.04 0.00 -0.74 0.00 0.00 36.82 37.26 2c91 h ILE 149 CO -0.03 0.11 0.52 0.00 0.00 0.00 0.00 178.15 178.75 2c91 h THR 151 N 1.04 1.26 -0.44 0.00 2.02 -1.11 -1.52 112.91 114.16 2c91 h THR 151 Ca 0.30 -1.06 -0.02 0.00 0.77 0.00 0.00 66.41 66.40 2c91 h THR 151 Cb -0.07 1.08 -0.02 0.00 -1.74 0.00 0.00 68.15 67.40 2c91 h THR 151 CO -0.08 0.36 0.21 -0.07 0.37 0.00 0.00 175.52 176.31 2c91 h LEU 152 N 0.62 0.58 -0.36 2.58 3.38 -0.90 -2.47 115.31 118.75 2c91 h LEU 152 Ca 0.12 -0.13 0.02 0.00 0.09 0.00 0.00 57.88 57.98 2c91 h LEU 152 Cb 0.51 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.09 2c91 h LEU 152 CO 0.03 0.55 0.19 0.00 0.09 0.00 0.00 178.44 179.30 2c91 h LYS 154 N 0.39 0.36 -0.19 0.00 3.64 -1.19 0.45 116.57 120.02 2c91 h LYS 154 Ca 0.15 -0.02 -0.09 0.00 -1.27 0.00 0.00 60.65 59.42 2c91 h LYS 154 Cb 0.04 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 31.77 2c91 h LYS 154 CO -0.09 0.24 -0.27 0.77 -2.27 0.00 0.00 179.45 177.83 2c91 h SER 155 N 0.37 0.36 -0.37 4.20 0.02 -1.27 -3.15 113.55 113.70 2c91 h SER 155 Ca 0.16 -0.12 0.00 0.00 -0.84 0.00 0.00 61.79 60.99 2c91 h SER 155 Cb 0.08 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 62.52 2c91 h SER 155 CO -0.12 0.63 0.00 0.59 -1.14 0.00 0.00 176.83 176.79 2c91 n ASN 156 N -4.13 3.35 -2.33 3.07 3.02 -0.49 -4.97 115.26 112.79 2c91 n ASN 156 Ca -0.01 -1.98 -0.19 0.00 -0.03 0.00 0.00 54.58 52.38 2c91 n ASN 156 Cb 0.40 -0.24 0.01 0.00 -0.61 0.00 0.00 39.78 39.34 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 1.49 -0.37 3.90 7.41 0.00 -0.13 -5.02 105.19 112.46 2c91 n GLY 157 Ca 0.19 -0.06 -0.32 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.99 3.48 0.19 1.61 0.51 -0.04 -5.04 118.94 116.65 2c91 s TRP 158 Ca 0.12 0.58 -0.33 0.00 -2.12 0.00 0.00 56.10 54.35 2c91 s TRP 158 Cb -0.05 -2.02 -0.14 0.00 -0.81 0.00 0.00 33.47 30.44 2c91 s TRP 158 CO 0.15 0.43 1.38 1.51 -0.51 0.00 0.00 176.95 179.90 2c91 n ILE 159 N 0.11 0.60 -2.81 2.03 3.06 -1.26 -4.50 119.36 116.59 2c91 n ILE 159 Ca -0.02 -0.15 -0.33 0.00 -2.50 0.00 0.00 62.75 59.74 2c91 n ILE 159 Cb 0.52 -1.25 -0.07 0.00 0.54 0.00 0.00 39.64 39.38 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 0.46 3.97 0.29 9.51 1.43 -1.26 -4.93 118.68 128.14 2c91 s LEU 160 Ca 0.74 1.71 -0.29 0.00 -1.03 0.00 0.00 54.13 55.26 2c91 s LEU 160 Cb -0.75 -4.50 -0.10 0.00 0.03 0.00 0.00 46.19 40.88 2c91 s LEU 160 CO 0.47 -0.35 1.23 -2.16 0.23 0.00 0.00 176.35 175.77 2c91 s PRO 161 N -3.09 4.47 0.00 1.29 0.04 -1.26 -4.47 135.00 131.97 2c91 s PRO 161 Ca 0.61 2.04 0.00 0.00 0.04 0.00 0.00 61.00 63.69 2c91 s PRO 161 Cb -0.10 -3.13 0.00 0.00 0.04 0.00 0.00 34.50 31.31 2c91 s PRO 161 CO 0.14 -0.04 0.21 0.25 0.04 0.00 0.00 177.00 177.60 2c91 n THR 162 N 1.20 0.00 -4.35 1.26 -2.24 -0.30 -4.74 114.28 105.11 2c91 n THR 162 Ca 0.00 -0.48 -0.18 0.00 -2.27 0.00 0.00 64.05 61.12 2c91 n THR 162 Cb 0.43 1.02 -0.15 0.00 -2.10 0.00 0.00 70.33 69.53 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 -0.54 0.68 -0.07 2.28 1.01 -1.22 -0.80 120.40 121.75 2c91 s VAL 163 Ca 0.00 -0.36 0.04 0.00 0.00 0.00 0.00 61.98 61.66 2c91 s VAL 163 Cb 0.00 -0.58 -0.00 0.00 0.00 0.00 0.00 36.38 35.80 2c91 s VAL 163 CO 0.00 0.20 -0.21 -0.47 0.00 0.00 0.00 175.10 174.62 2c91 s TYR 164 N -0.16 2.17 -0.26 5.22 6.14 -0.33 -0.99 117.35 129.14 2c91 s TYR 164 Ca 0.03 -0.77 -0.03 0.00 0.64 0.00 0.00 57.07 56.94 2c91 s TYR 164 Cb -0.04 -1.46 0.02 0.00 0.42 0.00 0.00 41.96 40.90 2c91 s TYR 164 CO -0.00 -0.29 -0.01 -1.14 0.64 0.00 0.00 175.55 174.74 2c91 s GLN 165 N 0.20 2.93 0.11 4.97 0.74 -0.02 -0.53 119.66 128.05 2c91 s GLN 165 Ca -0.11 -0.93 0.03 0.00 0.05 0.00 0.00 55.36 54.39 2c91 s GLN 165 Cb -0.15 -3.12 -0.04 0.00 1.10 0.00 0.00 33.01 30.80 2c91 s GLN 165 CO 0.05 -0.41 -0.08 0.20 -0.55 0.00 0.00 175.29 174.50 2c91 s GLY 166 N 1.39 0.84 -0.18 2.59 0.00 0.50 -3.81 107.32 108.65 2c91 s GLY 166 Ca 0.01 -1.31 -0.29 0.00 0.00 0.00 0.00 44.72 43.12 2c91 s GLY 166 CO -0.02 -1.41 1.40 -0.29 0.00 0.00 0.00 173.10 172.78 2c91 s MET 167 N -3.45 4.08 -0.26 2.90 1.75 -1.26 -0.32 119.30 122.74 2c91 s MET 167 Ca 0.10 1.67 -0.13 0.00 -1.25 0.00 0.00 55.69 56.08 2c91 s MET 167 Cb 0.02 -3.87 0.09 0.00 2.84 0.00 0.00 34.83 33.90 2c91 s MET 167 CO -0.02 -0.92 0.61 -0.47 -0.65 0.00 0.00 175.02 173.57 2c91 s TYR 168 N 4.07 -1.02 0.36 4.11 5.04 -1.02 -4.69 117.35 124.20 2c91 s TYR 168 Ca 0.61 1.98 -0.17 0.00 -2.44 0.00 0.00 57.07 57.05 2c91 s TYR 168 Cb -0.23 0.58 0.05 0.00 0.35 0.00 0.00 41.96 42.71 2c91 s TYR 168 CO 0.21 -0.52 0.78 0.54 -1.34 0.00 0.00 175.55 175.22 2c91 s ASN 169 N 1.96 -0.04 0.55 4.32 2.20 -0.73 -3.99 114.94 119.20 2c91 s ASN 169 Ca -0.08 -1.04 0.26 0.00 -0.94 0.00 0.00 52.86 51.05 2c91 s ASN 169 Cb -0.08 0.83 1.46 0.00 -2.00 0.00 0.00 41.25 41.46 2c91 s ASN 169 CO -0.18 -1.63 2.01 0.00 -2.94 0.00 0.00 177.10 174.37 2c91 h ALA 170 N 2.00 2.27 -0.20 3.54 0.00 -1.85 -0.56 119.26 124.46 2c91 h ALA 170 Ca -0.30 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.60 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 0.37 -0.55 0.00 0.25 0.00 0.00 0.00 179.25 179.33 2c91 n THR 171 N -4.16 0.71 -3.62 0.00 -2.24 -1.26 -4.47 114.28 99.23 2c91 n THR 171 Ca 0.07 -0.85 -0.29 0.00 -2.27 0.00 0.00 64.05 60.70 2c91 n THR 171 Cb 0.52 0.70 -0.14 0.00 -2.10 0.00 0.00 70.33 69.31 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 -0.93 0.49 -0.07 4.28 2.01 -0.22 -4.83 115.64 116.37 2c91 s THR 172 Ca 0.16 -1.33 0.10 0.00 0.31 0.00 0.00 61.69 60.93 2c91 s THR 172 Cb 0.09 -1.38 0.18 0.00 0.01 0.00 0.00 72.50 71.40 2c91 s THR 172 CO 0.12 -0.76 1.09 0.54 -0.69 0.00 0.00 174.62 174.92 2c91 n ARG 173 N 4.74 0.62 0.06 4.92 1.74 -1.26 -1.78 116.66 125.71 2c91 n ARG 173 Ca -0.00 -1.86 0.04 0.00 -0.77 0.00 0.00 57.85 55.26 2c91 n ARG 173 Cb 0.40 -0.94 0.46 0.00 -1.02 0.00 0.00 32.46 31.36 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 0.14 0.42 0.00 5.56 4.15 -1.89 -2.07 115.11 121.41 2c91 h GLN 174 Ca -0.02 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.37 2c91 h GLN 174 Cb 1.25 -0.09 0.00 0.00 0.21 0.00 0.00 27.48 28.85 2c91 h GLN 174 CO 0.01 0.30 0.00 -0.39 -1.93 0.00 0.00 178.83 176.82 2c91 h VAL 175 N 0.42 0.00 -0.41 2.39 -1.51 -1.87 -3.24 116.25 112.03 2c91 h VAL 175 Ca 0.11 -0.08 -0.11 0.00 -1.23 0.00 0.00 66.70 65.39 2c91 h VAL 175 Cb 0.00 0.86 -0.01 0.00 -2.13 0.00 0.00 31.29 30.02 2c91 h VAL 175 CO -0.02 0.00 -0.18 -0.33 -1.23 0.00 0.00 177.57 175.81 2c91 h GLU 176 N 0.00 0.84 -0.08 5.19 5.08 -1.76 -0.62 114.58 123.23 2c91 h GLU 176 Ca 0.00 -0.36 -0.01 0.00 -1.00 0.00 0.00 59.36 57.99 2c91 h GLU 176 Cb 0.09 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.31 2c91 h GLU 176 CO 0.00 1.00 0.02 0.00 -1.00 0.00 0.00 179.01 179.02 2c91 h ALA 177 N 0.82 0.11 0.00 3.43 0.00 -1.77 -3.39 119.26 118.47 2c91 h ALA 177 Ca 0.09 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2c91 h ALA 177 Cb 0.74 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.50 2c91 h ALA 177 CO 0.06 -0.24 -0.89 0.39 0.00 0.00 0.00 179.25 178.56 2c91 n GLU 178 N -4.87 0.00 0.15 0.00 1.02 -1.26 -4.72 120.64 110.96 2c91 n GLU 178 Ca -0.06 0.00 -0.14 0.00 -0.02 0.00 0.00 57.16 56.94 2c91 n GLU 178 Cb 0.16 -0.91 -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 -0.31 -0.18 -4.62 5.85 -1.77 -2.57 115.31 111.71 2c91 h LEU 179 Ca 0.00 -0.11 0.03 0.00 0.84 0.00 0.00 57.88 58.64 2c91 h LEU 179 Cb 0.89 0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.97 2c91 h LEU 179 CO 0.00 -0.07 -0.03 -0.07 -0.34 0.00 0.00 178.44 177.93 2c91 h LEU 180 N -0.54 -0.13 -1.05 2.25 4.07 -1.30 -0.57 115.31 118.03 2c91 h LEU 180 Ca -0.04 0.05 0.18 0.00 0.08 0.00 0.00 57.88 58.15 2c91 h LEU 180 Cb 0.40 0.10 -0.10 0.00 1.08 0.00 0.00 40.66 42.13 2c91 h LEU 180 CO 0.06 -0.04 0.62 -0.65 -1.08 0.00 0.00 178.44 177.35 2c91 h PRO 181 N 0.02 0.75 -0.19 1.13 0.11 -1.78 -1.01 132.00 131.03 2c91 h PRO 181 Ca 0.08 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 66.15 2c91 h PRO 181 Cb 0.12 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 31.05 2c91 h PRO 181 CO -0.17 0.49 0.11 0.00 -0.21 0.00 0.00 178.00 178.22 2c91 h LEU 183 N 0.21 0.97 -0.41 0.00 3.38 -0.44 -1.39 115.31 117.64 2c91 h LEU 183 Ca 0.07 -0.08 -0.11 0.00 0.09 0.00 0.00 57.88 57.85 2c91 h LEU 183 Cb 0.04 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 2c91 h LEU 183 CO -0.01 0.78 -0.17 0.03 0.09 0.00 0.00 178.44 179.16 2c91 h ARG 184 N 1.10 0.83 -0.56 1.13 -0.00 -1.05 0.31 114.38 116.14 2c91 h ARG 184 Ca 0.28 -0.35 -0.00 0.00 -0.50 0.00 0.00 59.98 59.41 2c91 h ARG 184 Cb 0.02 -0.03 -0.03 0.00 0.00 0.00 0.00 29.97 29.94 2c91 h ARG 184 CO -0.05 0.98 0.35 1.25 0.00 0.00 0.00 179.97 182.50 2c91 h HIS 185 N 0.64 0.72 -0.01 3.04 2.76 -0.78 -3.08 115.15 118.45 2c91 h HIS 185 Ca 0.09 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.27 2c91 h HIS 185 Cb 0.72 -0.24 0.00 0.00 1.55 0.00 0.00 27.41 29.44 2c91 h HIS 185 CO 0.06 0.48 -0.16 1.19 -1.30 0.00 0.00 177.93 178.20 2c91 n PHE 186 N -4.67 0.00 -1.40 5.26 3.72 -0.57 -4.97 117.46 114.84 2c91 n PHE 186 Ca 0.03 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.43 2c91 n PHE 186 Cb 0.04 -0.06 0.00 0.00 -0.94 0.00 0.00 39.48 38.52 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 1.28 0.97 3.69 1.37 0.00 0.78 -5.02 105.19 108.27 2c91 n GLY 187 Ca 0.15 -0.51 -0.35 0.00 0.00 0.00 0.00 46.02 45.31 2c91 n GLY 187 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2c91 s LEU 188 N -0.27 3.75 0.34 0.99 1.02 0.46 -4.78 118.68 120.19 2c91 s LEU 188 Ca 0.00 0.17 -0.07 0.00 0.02 0.00 0.00 54.13 54.25 2c91 s LEU 188 Cb 0.00 -1.89 -0.06 0.00 0.02 0.00 0.00 46.19 44.26 2c91 s LEU 188 CO 0.00 0.32 0.64 0.00 0.02 0.00 0.00 176.35 177.33 2c91 s ARG 189 N -0.54 3.69 -0.14 1.70 1.70 0.02 -4.45 118.95 120.93 2c91 s ARG 189 Ca 0.10 0.19 0.01 0.00 -0.47 0.00 0.00 55.73 55.56 2c91 s ARG 189 Cb -0.12 -2.54 -0.00 0.00 -0.57 0.00 0.00 34.95 31.71 2c91 s ARG 189 CO 0.02 0.11 -0.16 0.12 -1.08 0.00 0.00 175.30 174.31 2c91 s PHE 190 N -2.20 2.76 -0.18 5.89 5.36 -1.26 -1.18 117.98 127.17 2c91 s PHE 190 Ca 0.47 -0.97 -0.04 0.00 -0.96 0.00 0.00 56.93 55.43 2c91 s PHE 190 Cb -0.11 -1.85 -0.02 0.00 -0.34 0.00 0.00 43.02 40.70 2c91 s PHE 190 CO 0.30 -0.42 -0.02 0.71 -1.46 0.00 0.00 175.22 174.34 2c91 s TYR 191 N 0.66 3.02 -0.28 10.12 1.51 0.31 -1.52 117.35 131.17 2c91 s TYR 191 Ca -0.08 -0.41 -0.18 0.00 -1.01 0.00 0.00 57.07 55.39 2c91 s TYR 191 Cb -0.16 -2.02 -0.02 0.00 -0.11 0.00 0.00 41.96 39.65 2c91 s TYR 191 CO 0.02 -0.16 0.51 0.00 -1.11 0.00 0.00 175.55 174.81 2c91 s ALA 192 N 0.72 3.56 0.37 3.71 0.00 0.02 -0.37 121.76 129.77 2c91 s ALA 192 Ca -0.01 -0.69 0.05 0.00 0.00 0.00 0.00 51.96 51.31 2c91 s ALA 192 Cb -0.14 -2.91 -0.01 0.00 0.00 0.00 0.00 23.12 20.06 2c91 s ALA 192 CO 0.02 -0.84 0.52 1.52 0.00 0.00 0.00 175.76 176.98 2c91 s TYR 193 N 2.33 3.10 -1.51 0.00 -0.85 0.57 -0.64 117.35 120.35 2c91 s TYR 193 Ca 0.21 -0.14 -0.12 0.00 -0.52 0.00 0.00 57.07 56.49 2c91 s TYR 193 Cb -0.16 -2.11 0.08 0.00 0.38 0.00 0.00 41.96 40.15 2c91 s TYR 193 CO 0.10 -0.13 0.93 0.09 -1.52 0.00 0.00 175.55 175.02 2c91 n ASN 194 N -1.76 -4.23 0.01 -0.18 5.03 -1.26 -2.44 115.26 110.44 2c91 n ASN 194 Ca 0.01 -0.80 0.06 0.00 0.87 0.00 0.00 54.58 54.72 2c91 n ASN 194 Cb 0.58 -3.86 0.25 0.00 -1.02 0.00 0.00 39.78 35.73 2c91 n ASN 194 CO 0.00 0.00 0.00 -0.81 -1.83 0.00 0.00 177.26 174.62 2c91 n PRO 195 N -4.63 0.02 -0.36 3.52 -0.04 -1.26 -0.78 135.00 131.48 2c91 n PRO 195 Ca -0.01 0.34 0.07 0.00 -0.04 0.00 0.00 63.50 63.87 2c91 n PRO 195 Cb 0.55 -1.54 0.19 0.00 -0.04 0.00 0.00 33.50 32.65 2c91 n PRO 195 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2c91 n LEU 196 N -1.58 2.95 -3.79 1.53 4.77 -1.26 -4.65 117.00 114.97 2c91 n LEU 196 Ca 0.02 -3.35 -0.24 0.00 -0.03 0.00 0.00 56.01 52.42 2c91 n LEU 196 Cb 0.12 -0.50 0.02 0.00 -2.33 0.00 0.00 43.42 40.73 2c91 n LEU 196 CO 0.10 0.93 -0.07 0.00 -1.33 0.00 0.00 177.39 177.02 2c91 n ALA 197 N -1.15 -1.89 -1.13 -1.18 0.00 0.04 -0.78 120.51 114.42 2c91 n ALA 197 Ca 0.20 -0.13 -0.05 0.00 0.00 0.00 0.00 53.44 53.47 2c91 n ALA 197 Cb 0.75 -2.28 -0.02 0.00 0.00 0.00 0.00 19.45 17.91 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 -1.67 0.60 0.00 0.00 0.00 -1.26 -1.91 105.19 100.95 2c91 n GLY 198 Ca -0.24 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 45.64 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 -0.73 0.65 0.32 -0.02 0.00 0.04 -4.73 105.19 100.72 2c91 n GLY 199 Ca -0.05 0.00 0.02 0.00 0.00 0.00 0.00 46.02 45.99 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 0.79 -0.12 0.99 5.85 -0.48 -2.21 115.31 120.12 2c91 h LEU 200 Ca 0.00 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.75 2c91 h LEU 200 Cb 0.00 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 40.90 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 -4.66 0.10 0.07 2.25 4.77 -0.19 -1.46 117.00 117.87 2c91 n LEU 201 Ca 0.13 -0.05 0.13 0.00 -0.03 0.00 0.00 56.01 56.19 2c91 n LEU 201 Cb 0.23 -0.05 0.35 0.00 -2.33 0.00 0.00 43.42 41.62 2c91 n LEU 201 CO 0.29 0.02 0.71 0.35 -1.33 0.00 0.00 177.39 177.43 2c91 n THR 202 N -0.42 0.41 -1.08 -5.08 -2.24 -0.83 -3.62 114.28 101.42 2c91 n THR 202 Ca 0.00 -0.23 -0.03 0.00 -2.27 0.00 0.00 64.05 61.52 2c91 n THR 202 Cb 0.02 -0.38 -0.01 0.00 -2.10 0.00 0.00 70.33 67.86 2c91 n THR 202 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2c91 n GLY 203 N 1.35 0.50 0.00 3.38 0.00 -0.53 -4.27 105.19 105.62 2c91 n GLY 203 Ca 0.05 -0.14 0.14 0.00 0.00 0.00 0.00 46.02 46.06 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 -1.44 0.31 -4.21 1.61 2.85 -1.26 -4.83 118.16 111.18 2c91 n LYS 204 Ca -0.03 0.02 -0.24 0.00 -1.05 0.00 0.00 58.31 57.01 2c91 n LYS 204 Cb 0.28 -1.50 -0.07 0.00 -0.65 0.00 0.00 35.03 33.08 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 -2.67 2.63 0.04 5.58 2.02 -1.26 -5.14 117.35 118.55 2c91 s TYR 205 Ca 0.24 -0.44 0.05 0.00 -0.37 0.00 0.00 57.07 56.55 2c91 s TYR 205 Cb 0.19 -1.62 -0.02 0.00 -0.40 0.00 0.00 41.96 40.10 2c91 s TYR 205 CO 0.45 0.38 -0.16 0.15 -1.57 0.00 0.00 175.55 174.80 2c91 s LYS 206 N -3.80 1.02 0.30 -0.62 1.02 -1.26 -5.06 119.74 111.35 2c91 s LYS 206 Ca 0.37 -0.82 0.05 0.00 0.02 0.00 0.00 55.97 55.59 2c91 s LYS 206 Cb -0.00 -1.06 0.73 0.00 -0.52 0.00 0.00 37.83 36.97 2c91 s LYS 206 CO 0.21 0.26 1.77 -0.92 -0.92 0.00 0.00 175.35 175.76 2c91 h TYR 207 N 4.84 1.05 0.00 3.18 5.03 -1.98 -0.68 116.97 128.41 2c91 h TYR 207 Ca -0.39 0.03 0.00 0.00 2.58 0.00 0.00 58.73 60.95 2c91 h TYR 207 Cb 1.18 -0.31 0.00 0.00 1.55 0.00 0.00 36.73 39.14 2c91 h TYR 207 CO 0.54 0.23 0.00 -0.85 -1.32 0.00 0.00 178.16 176.75 2c91 n GLU 208 N -4.78 0.28 0.03 1.82 0.00 -1.26 -2.68 120.64 114.05 2c91 n GLU 208 Ca 0.23 0.08 0.22 0.00 0.00 0.00 0.00 57.16 57.68 2c91 n GLU 208 Cb 0.57 -1.50 0.73 0.00 0.00 0.00 0.00 31.44 31.24 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 0.27 -1.84 3.32 -1.52 -1.95 116.42 114.70 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 0.24 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.78 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 -1.73 0.16 116.57 120.66 2c91 h LYS 210 Ca 0.24 0.00 -0.21 0.00 -2.00 0.00 0.00 60.65 58.69 2c91 h LYS 210 Cb 1.15 0.00 -0.04 0.00 -0.90 0.00 0.00 32.23 32.44 2c91 h LYS 210 CO -0.00 0.23 -1.56 -0.25 -2.00 0.00 0.00 179.45 175.87 2c91 n ASP 211 N -4.15 0.80 0.00 7.07 8.00 -0.76 -4.80 116.55 122.71 2c91 n ASP 211 Ca -0.02 0.36 0.00 0.00 0.71 0.00 0.00 54.79 55.84 2c91 n ASP 211 Cb 0.30 0.18 0.00 0.00 -0.02 0.00 0.00 41.12 41.58 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 1.46 0.53 0.31 0.44 0.00 -1.06 -4.93 105.19 101.93 2c91 n GLY 212 Ca -0.13 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.84 2c91 n GLY 212 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2c91 h LYS 213 N 0.00 -0.16 -6.55 1.61 3.64 -1.77 -3.47 116.57 109.86 2c91 h LYS 213 Ca 0.00 0.01 -0.51 0.00 -1.27 0.00 0.00 60.65 58.88 2c91 h LYS 213 Cb 0.00 0.04 0.03 0.00 -0.41 0.00 0.00 32.23 31.89 2c91 h LYS 213 CO 0.00 -0.11 -0.97 1.04 -2.27 0.00 0.00 179.45 177.14 2c91 n GLN 214 N -5.42 -0.92 -2.10 1.90 6.02 0.53 -4.82 117.38 112.57 2c91 n GLN 214 Ca 0.03 0.29 -0.42 0.00 -0.01 0.00 0.00 57.00 56.89 2c91 n GLN 214 Cb 0.33 -3.47 -0.03 0.00 1.02 0.00 0.00 30.24 28.09 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 -6.65 4.29 0.32 -1.09 0.04 -1.26 -4.89 135.00 125.76 2c91 s PRO 215 Ca 0.45 2.16 -0.29 0.00 0.04 0.00 0.00 61.00 63.36 2c91 s PRO 215 Cb -0.20 -3.22 -0.11 0.00 0.04 0.00 0.00 34.50 31.01 2c91 s PRO 215 CO 0.91 -0.49 1.51 0.54 0.04 0.00 0.00 177.00 179.52 2c91 s VAL 216 N 1.11 2.17 -4.89 -0.36 0.11 -1.26 -4.20 120.40 113.08 2c91 s VAL 216 Ca 0.66 0.15 0.00 0.00 -2.93 0.00 0.00 61.98 59.87 2c91 s VAL 216 Cb -0.39 -3.10 0.00 0.00 -1.53 0.00 0.00 36.38 31.36 2c91 s VAL 216 CO 0.30 0.03 0.00 0.61 -3.33 0.00 0.00 175.10 172.72 2c91 n GLY 217 N 1.38 -0.49 0.36 6.54 0.00 -0.85 -4.92 105.19 107.20 2c91 n GLY 217 Ca 0.04 -0.93 0.13 0.00 0.00 0.00 0.00 46.02 45.27 2c91 n GLY 217 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2c91 h ARG 218 N 0.00 0.73 -0.01 1.61 9.65 -1.87 -2.98 114.38 121.52 2c91 h ARG 218 Ca 0.00 -0.04 0.00 0.00 -1.10 0.00 0.00 59.98 58.84 2c91 h ARG 218 Cb 0.00 -0.17 0.00 0.00 -1.39 0.00 0.00 29.97 28.41 2c91 h ARG 218 CO 0.00 0.49 -0.66 1.19 2.80 0.00 0.00 179.97 183.79 2c91 n PHE 219 N -4.74 0.00 -3.72 2.20 3.01 -1.26 -4.25 117.46 108.70 2c91 n PHE 219 Ca 0.23 0.00 -0.13 0.00 1.01 0.00 0.00 57.45 58.56 2c91 n PHE 219 Cb 0.57 -0.07 -0.13 0.00 -0.01 0.00 0.00 39.48 39.84 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 -2.79 -0.33 0.00 1.38 0.08 -1.13 -4.67 117.98 110.53 2c91 s PHE 220 Ca 0.14 0.78 0.00 0.00 0.12 0.00 0.00 56.93 57.97 2c91 s PHE 220 Cb 0.17 0.01 0.00 0.00 -0.57 0.00 0.00 43.02 42.64 2c91 s PHE 220 CO 0.71 -0.25 0.00 0.41 -0.10 0.00 0.00 175.22 175.99 2c91 n GLY 221 N 4.44 1.11 3.64 4.36 0.00 -1.26 -2.02 105.19 115.46 2c91 n GLY 221 Ca -0.22 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.52 2c91 n GLY 221 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2c91 s ASN 222 N -1.84 3.95 0.52 1.61 2.20 -1.26 -5.04 114.94 115.09 2c91 s ASN 222 Ca 0.00 -1.36 0.31 0.00 -0.94 0.00 0.00 52.86 50.87 2c91 s ASN 222 Cb 0.00 -0.34 1.30 0.00 -2.00 0.00 0.00 41.25 40.20 2c91 s ASN 222 CO 0.00 -0.49 1.97 0.78 -2.94 0.00 0.00 177.10 176.42 2c91 h ASN 223 N 1.70 0.00 -0.06 3.54 2.35 -1.97 -2.19 115.58 118.95 2c91 h ASN 223 Ca -0.44 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.31 2c91 h ASN 223 Cb 1.25 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.62 2c91 h ASN 223 CO 0.79 0.08 0.00 0.79 -1.65 0.00 0.00 177.43 177.45 2c91 n TRP 224 N -3.24 0.06 -0.17 1.19 7.02 -1.26 -4.63 117.44 116.40 2c91 n TRP 224 Ca -0.00 -0.03 -0.03 0.00 -1.02 0.00 0.00 57.50 56.42 2c91 n TRP 224 Cb 0.32 0.00 0.07 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 4.55 0.68 -0.54 6.99 0.00 -1.57 -0.67 119.26 128.70 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 0.82 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.56 2c91 h ALA 225 CO 0.00 -0.13 0.12 1.49 0.00 0.00 0.00 179.25 180.72 2c91 h GLU 226 N 0.46 0.84 -0.11 0.00 4.57 -1.82 0.12 114.58 118.64 2c91 h GLU 226 Ca 0.25 -0.18 -0.00 0.00 -1.18 0.00 0.00 59.36 58.24 2c91 h GLU 226 Cb 0.21 -0.12 -0.01 0.00 -0.16 0.00 0.00 28.75 28.67 2c91 h GLU 226 CO -0.21 0.77 0.05 1.15 -1.18 0.00 0.00 179.01 179.59 2c91 h THR 227 N 0.81 1.11 -0.87 0.32 2.02 -1.59 -0.74 112.91 113.97 2c91 h THR 227 Ca 0.18 -0.33 0.01 0.00 0.77 0.00 0.00 66.41 67.03 2c91 h THR 227 Cb 0.31 1.13 -0.04 0.00 -1.74 0.00 0.00 68.15 67.82 2c91 h THR 227 CO 0.00 0.10 0.57 1.88 0.37 0.00 0.00 175.52 178.44 2c91 h TYR 228 N 0.06 1.11 -0.36 3.16 -1.99 -0.67 0.29 116.97 118.57 2c91 h TYR 228 Ca 0.04 0.02 -0.03 0.00 2.00 0.00 0.00 58.73 60.75 2c91 h TYR 228 Cb 0.11 -0.37 -0.01 0.00 2.00 0.00 0.00 36.73 38.46 2c91 h TYR 228 CO -0.03 0.71 0.09 0.00 -0.00 0.00 0.00 178.16 178.93 2c91 h ARG 229 N 1.19 0.57 -0.74 4.88 3.08 -0.84 -0.56 114.38 121.97 2c91 h ARG 229 Ca 0.32 -0.14 0.06 0.00 0.07 0.00 0.00 59.98 60.29 2c91 h ARG 229 Cb -0.12 -0.08 -0.05 0.00 0.08 0.00 0.00 29.97 29.81 2c91 h ARG 229 CO -0.07 0.62 0.49 -0.91 -1.07 0.00 0.00 179.97 179.03 2c91 h ASN 230 N 0.43 0.71 -0.03 7.04 2.35 -0.93 0.61 115.58 125.76 2c91 h ASN 230 Ca 0.11 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.84 2c91 h ASN 230 Cb 0.30 -0.15 -0.00 0.00 0.05 0.00 0.00 38.32 38.52 2c91 h ASN 230 CO 0.00 0.47 -0.05 -0.09 -1.65 0.00 0.00 177.43 176.11 2c91 h ARG 231 N 0.82 0.09 0.00 0.81 2.43 -0.48 -3.43 114.38 114.62 2c91 h ARG 231 Ca 0.31 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.43 2c91 h ARG 231 Cb 0.19 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.75 2c91 h ARG 231 CO -0.10 0.62 -0.72 1.19 -1.51 0.00 0.00 179.97 179.45 2c91 n PHE 232 N -4.74 0.00 -2.73 2.20 0.99 -0.26 -4.49 117.46 108.43 2c91 n PHE 232 Ca -0.08 0.00 -0.43 0.00 -0.00 0.00 0.00 57.45 56.93 2c91 n PHE 232 Cb 0.31 0.00 -0.00 0.00 -1.00 0.00 0.00 39.48 38.79 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 -1.57 3.07 0.01 1.38 -0.11 0.20 -4.81 118.94 117.10 2c91 s TRP 233 Ca 0.00 -1.83 0.04 0.00 1.22 0.00 0.00 56.10 55.52 2c91 s TRP 233 Cb 0.00 -4.58 -0.01 0.00 -1.50 0.00 0.00 33.47 27.38 2c91 s TRP 233 CO 0.00 -1.64 -0.11 0.15 -4.62 0.00 0.00 176.95 170.72 2c91 s LYS 234 N 3.16 0.84 0.19 5.86 1.02 -1.26 -4.83 119.74 124.72 2c91 s LYS 234 Ca 0.49 -0.50 -0.14 0.00 0.02 0.00 0.00 55.97 55.84 2c91 s LYS 234 Cb 0.01 -0.81 0.18 0.00 -0.52 0.00 0.00 37.83 36.70 2c91 s LYS 234 CO 0.05 0.21 1.67 1.49 -0.92 0.00 0.00 175.35 177.85 2c91 h GLU 235 N 5.53 0.06 0.00 1.68 4.81 -1.99 0.80 114.58 125.48 2c91 h GLU 235 Ca -0.34 -0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 58.88 2c91 h GLU 235 Cb 1.18 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 30.54 2c91 h GLU 235 CO 0.47 0.04 -0.07 0.45 -0.73 0.00 0.00 179.01 179.17 2c91 h HIS 236 N 0.06 0.00 -0.20 0.92 3.86 -1.97 -1.07 115.15 116.76 2c91 h HIS 236 Ca 0.25 0.00 -0.11 0.00 -1.16 0.00 0.00 60.37 59.36 2c91 h HIS 236 Cb 0.39 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.85 2c91 h HIS 236 CO -0.36 0.07 -0.29 1.25 0.86 0.00 0.00 177.93 179.46 2c91 h HIS 237 N 0.00 0.68 -0.68 2.45 -0.00 -1.19 0.16 115.15 116.57 2c91 h HIS 237 Ca -0.00 -0.22 0.00 0.00 -0.00 0.00 0.00 60.37 60.15 2c91 h HIS 237 Cb 0.14 -0.13 -0.03 0.00 -0.00 0.00 0.00 27.41 27.38 2c91 h HIS 237 CO 0.00 0.94 0.45 0.74 -0.00 0.00 0.00 177.93 180.05 2c91 h PHE 238 N 0.22 0.87 -0.82 5.26 -1.00 -0.86 0.68 116.94 121.29 2c91 h PHE 238 Ca 0.02 0.02 -0.03 0.00 2.81 0.00 0.00 57.97 60.79 2c91 h PHE 238 Cb 0.86 -0.29 -0.04 0.00 3.61 0.00 0.00 35.95 40.09 2c91 h PHE 238 CO 0.09 0.55 0.41 0.93 -1.61 0.00 0.00 178.31 178.68 2c91 h GLU 239 N 0.93 1.16 -0.54 1.51 5.08 -1.08 -1.84 114.58 119.80 2c91 h GLU 239 Ca 0.25 -0.16 -0.02 0.00 -1.00 0.00 0.00 59.36 58.43 2c91 h GLU 239 Cb -0.09 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 28.92 2c91 h GLU 239 CO -0.05 0.89 0.26 0.00 -1.00 0.00 0.00 179.01 179.10 2c91 h ALA 240 N 1.22 0.70 -0.77 3.43 0.00 -0.37 -2.07 119.26 121.40 2c91 h ALA 240 Ca 0.28 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.06 2c91 h ALA 240 Cb 0.09 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.63 2c91 h ALA 240 CO -0.04 0.27 0.48 0.82 0.00 0.00 0.00 179.25 180.78 2c91 h ILE 241 N 0.73 1.21 -0.91 0.00 2.04 -0.51 -2.20 117.51 117.88 2c91 h ILE 241 Ca 0.19 -0.44 0.02 0.00 1.00 0.00 0.00 64.86 65.63 2c91 h ILE 241 Cb 0.12 0.11 -0.05 0.00 -0.74 0.00 0.00 36.82 36.27 2c91 h ILE 241 CO -0.02 0.21 0.60 0.00 0.00 0.00 0.00 178.15 178.94 2c91 h ALA 242 N 1.26 1.39 -0.73 1.87 0.00 -1.10 0.07 119.26 122.01 2c91 h ALA 242 Ca 0.28 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.15 2c91 h ALA 242 Cb -0.07 -0.35 -0.04 0.00 0.00 0.00 0.00 17.79 17.34 2c91 h ALA 242 CO -0.06 0.55 0.48 1.25 0.00 0.00 0.00 179.25 181.47 2c91 h LEU 243 N 1.19 0.82 -0.26 0.00 6.46 -0.76 -1.29 115.31 121.48 2c91 h LEU 243 Ca 0.35 -0.02 -0.15 0.00 -0.12 0.00 0.00 57.88 57.94 2c91 h LEU 243 Cb -0.06 -0.20 -0.00 0.00 -0.73 0.00 0.00 40.66 39.66 2c91 h LEU 243 CO -0.09 0.59 -0.44 0.58 -0.62 0.00 0.00 178.44 178.46 2c91 h VAL 244 N 0.97 1.30 -0.43 1.05 2.07 -1.09 -2.33 116.25 117.79 2c91 h VAL 244 Ca 0.27 -1.64 0.06 0.00 0.82 0.00 0.00 66.70 66.22 2c91 h VAL 244 Cb -0.09 1.70 -0.05 0.00 -1.52 0.00 0.00 31.29 31.33 2c91 h VAL 244 CO -0.07 0.52 0.11 -0.33 0.02 0.00 0.00 177.57 177.83 2c91 h GLU 245 N 0.49 0.25 -0.87 1.57 4.39 -0.81 -0.25 114.58 119.34 2c91 h GLU 245 Ca 0.02 -0.02 -0.02 0.00 0.34 0.00 0.00 59.36 59.69 2c91 h GLU 245 Cb 1.04 -0.06 -0.04 0.00 -0.10 0.00 0.00 28.75 29.59 2c91 h GLU 245 CO 0.10 0.17 0.48 -0.22 -1.16 0.00 0.00 179.01 178.38 2c91 h LYS 246 N 0.26 1.22 -0.27 2.33 3.64 -1.20 -2.04 116.57 120.51 2c91 h LYS 246 Ca 0.21 -0.14 -0.11 0.00 -1.27 0.00 0.00 60.65 59.34 2c91 h LYS 246 Cb 0.23 -0.24 -0.01 0.00 -0.41 0.00 0.00 32.23 31.80 2c91 h LYS 246 CO -0.25 0.89 -0.30 0.00 -2.27 0.00 0.00 179.45 177.52 2c91 h ALA 247 N 1.31 0.99 -0.44 5.00 0.00 -0.71 -1.20 119.26 124.21 2c91 h ALA 247 Ca 0.31 -0.38 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 2c91 h ALA 247 Cb 0.02 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 2c91 h ALA 247 CO -0.05 0.60 0.20 -0.07 0.00 0.00 0.00 179.25 179.92 2c91 h LEU 248 N 0.47 0.59 0.04 0.00 3.38 -0.60 -0.14 115.31 119.05 2c91 h LEU 248 Ca 0.06 -0.15 -0.00 0.00 0.09 0.00 0.00 57.88 57.88 2c91 h LEU 248 Cb 0.76 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.35 2c91 h LEU 248 CO 0.06 0.58 -0.02 1.56 0.09 0.00 0.00 178.44 180.71 2c91 h GLN 249 N 0.57 -0.05 -0.88 1.13 1.08 -1.23 0.02 115.11 115.75 2c91 h GLN 249 Ca 0.15 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.33 2c91 h GLN 249 Cb 0.16 0.01 -0.04 0.00 -0.05 0.00 0.00 27.48 27.56 2c91 h GLN 249 CO -0.02 0.09 0.45 1.15 -0.95 0.00 0.00 178.83 179.56 2c91 h THR 250 N -0.18 1.26 0.09 -0.54 2.02 -1.15 0.78 112.91 115.18 2c91 h THR 250 Ca -0.01 -0.69 -0.28 0.00 0.77 0.00 0.00 66.41 66.21 2c91 h THR 250 Cb 0.17 0.11 -0.01 0.00 -1.74 0.00 0.00 68.15 66.67 2c91 h THR 250 CO 0.01 0.30 -1.33 0.74 0.37 0.00 0.00 175.52 175.61 2c91 h THR 251 N 1.24 1.37 0.00 3.16 2.02 -0.94 -3.40 112.91 116.36 2c91 h THR 251 Ca 0.31 -3.01 0.00 0.00 0.77 0.00 0.00 66.41 64.47 2c91 h THR 251 Cb 0.07 2.83 0.00 0.00 -1.74 0.00 0.00 68.15 69.31 2c91 h THR 251 CO -0.04 0.86 -0.85 -1.22 0.37 0.00 0.00 175.52 174.63 2c91 n TYR 252 N -3.44 0.00 -0.21 3.16 4.01 -0.01 -5.08 117.16 115.58 2c91 n TYR 252 Ca -0.10 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.64 2c91 n TYR 252 Cb 1.02 -0.02 0.00 0.00 -0.31 0.00 0.00 39.34 40.03 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 2.15 2.27 0.23 2.72 0.00 0.26 -2.41 105.19 110.41 2c91 n GLY 253 Ca -0.00 -0.35 0.12 0.00 0.00 0.00 0.00 46.02 45.79 2c91 n GLY 253 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2c91 h THR 254 N 0.00 0.20 0.00 2.61 2.02 -1.94 -2.93 112.91 112.87 2c91 h THR 254 Ca 0.00 -1.04 0.00 0.00 0.77 0.00 0.00 66.41 66.14 2c91 h THR 254 Cb 0.00 1.88 0.00 0.00 -1.74 0.00 0.00 68.15 68.29 2c91 h THR 254 CO 0.00 0.10 0.00 0.59 0.37 0.00 0.00 175.52 176.58 2c91 n ASN 255 N -3.16 0.46 -4.70 4.18 3.02 -1.01 -4.93 115.26 109.12 2c91 n ASN 255 Ca 0.02 -1.86 -0.42 0.00 -0.03 0.00 0.00 54.58 52.29 2c91 n ASN 255 Cb 0.48 -0.23 -0.03 0.00 -0.61 0.00 0.00 39.78 39.39 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 -1.50 3.62 0.67 5.41 0.00 -1.11 -4.97 121.76 123.89 2c91 s ALA 256 Ca 0.00 1.07 -0.17 0.00 0.00 0.00 0.00 51.96 52.86 2c91 s ALA 256 Cb 0.00 -3.60 0.00 0.00 0.00 0.00 0.00 23.12 19.52 2c91 s ALA 256 CO 0.00 -0.84 1.25 -0.35 0.00 0.00 0.00 175.76 175.82 2c91 n PRO 257 N 4.81 0.94 -2.03 0.00 -0.04 -1.26 -4.99 135.00 132.43 2c91 n PRO 257 Ca 0.13 0.38 -0.35 0.00 -0.04 0.00 0.00 63.50 63.62 2c91 n PRO 257 Cb 0.42 -2.49 0.03 0.00 -0.04 0.00 0.00 33.50 31.42 2c91 n PRO 257 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2c91 s ARG 258 N -3.45 3.05 0.27 0.54 0.52 -1.26 -4.83 118.95 113.80 2c91 s ARG 258 Ca 0.81 1.63 0.00 0.00 -0.52 0.00 0.00 55.73 57.65 2c91 s ARG 258 Cb -0.37 -1.96 0.59 0.00 0.52 0.00 0.00 34.95 33.74 2c91 s ARG 258 CO 0.42 -1.10 1.74 0.52 0.02 0.00 0.00 175.30 176.91 2c91 h MET 259 N 0.76 0.52 -0.54 3.54 2.86 -1.87 -0.67 114.93 119.54 2c91 h MET 259 Ca -0.49 -0.03 0.09 0.00 -2.06 0.00 0.00 59.70 57.21 2c91 h MET 259 Cb 1.27 -0.12 -0.07 0.00 0.06 0.00 0.00 31.60 32.74 2c91 h MET 259 CO 0.55 0.35 0.13 1.15 1.06 0.00 0.00 176.91 180.15 2c91 h THR 260 N 0.54 0.71 -0.43 2.22 2.02 -1.74 0.75 112.91 116.99 2c91 h THR 260 Ca 0.49 -0.09 -0.06 0.00 0.77 0.00 0.00 66.41 67.52 2c91 h THR 260 Cb 0.79 0.41 -0.02 0.00 -1.74 0.00 0.00 68.15 67.60 2c91 h THR 260 CO -0.42 0.05 0.05 -1.28 0.37 0.00 0.00 175.52 174.29 2c91 h SER 261 N 0.27 0.70 -0.40 4.18 0.87 -1.53 -2.28 113.55 115.37 2c91 h SER 261 Ca 0.27 -0.28 -0.02 0.00 -1.23 0.00 0.00 61.79 60.53 2c91 h SER 261 Cb 0.37 -0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 62.13 2c91 h SER 261 CO -0.34 0.80 0.16 0.00 -0.53 0.00 0.00 176.83 176.92 2c91 h ALA 262 N 0.92 0.52 -0.62 6.23 0.00 -0.71 -0.53 119.26 125.07 2c91 h ALA 262 Ca 0.13 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 2c91 h ALA 262 Cb 0.41 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 2c91 h ALA 262 CO 0.01 0.13 0.38 0.00 0.00 0.00 0.00 179.25 179.77 2c91 h ALA 263 N 1.00 0.79 -0.26 0.00 0.00 -0.82 -0.94 119.26 119.03 2c91 h ALA 263 Ca 0.13 -0.07 -0.12 0.00 0.00 0.00 0.00 54.91 54.86 2c91 h ALA 263 Cb 0.20 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 2c91 h ALA 263 CO -0.01 0.26 -0.29 -0.07 0.00 0.00 0.00 179.25 179.14 2c91 h LEU 264 N 0.84 0.71 -1.66 0.00 3.38 -1.32 -2.88 115.31 114.40 2c91 h LEU 264 Ca 0.22 -0.48 -0.02 0.00 0.09 0.00 0.00 57.88 57.69 2c91 h LEU 264 Cb -0.04 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 2c91 h LEU 264 CO -0.04 1.05 -0.04 0.03 0.09 0.00 0.00 178.44 179.53 2c91 h ARG 265 N 0.39 0.16 -0.34 1.13 3.08 -0.95 -0.85 114.38 117.00 2c91 h ARG 265 Ca 0.04 -0.02 0.04 0.00 0.07 0.00 0.00 59.98 60.10 2c91 h ARG 265 Cb 0.87 -0.03 -0.04 0.00 0.08 0.00 0.00 29.97 30.85 2c91 h ARG 265 CO 0.07 0.22 0.12 2.35 -1.07 0.00 0.00 179.97 181.67 2c91 h TRP 266 N 0.16 0.22 -0.41 3.04 7.01 -1.03 -0.44 115.95 124.51 2c91 h TRP 266 Ca 0.04 0.02 0.04 0.00 2.11 0.00 0.00 58.89 61.09 2c91 h TRP 266 Cb 0.19 -0.05 -0.04 0.00 -2.10 0.00 0.00 29.16 27.16 2c91 h TRP 266 CO 0.00 0.09 0.19 0.52 -2.79 0.00 0.00 178.44 176.45 2c91 h MET 267 N 0.27 0.37 0.00 2.65 2.86 -0.96 0.26 114.93 120.38 2c91 h MET 267 Ca 0.15 -0.02 -0.14 0.00 -2.06 0.00 0.00 59.70 57.63 2c91 h MET 267 Cb 0.12 -0.08 -0.02 0.00 0.06 0.00 0.00 31.60 31.68 2c91 h MET 267 CO -0.15 0.25 -0.67 1.88 1.06 0.00 0.00 176.91 179.27 2c91 h TYR 268 N 0.38 0.00 0.00 -0.22 -1.99 -1.30 -3.36 116.97 110.49 2c91 h TYR 268 Ca 0.18 0.00 -0.03 0.00 2.00 0.00 0.00 58.73 60.89 2c91 h TYR 268 Cb 0.11 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 38.84 2c91 h TYR 268 CO -0.12 0.67 -1.18 0.72 -0.00 0.00 0.00 178.16 178.25 2c91 n HIS 269 N -3.41 0.00 -0.45 4.88 8.25 -0.18 -4.43 115.22 119.88 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 0.75 -0.11 0.00 0.00 1.12 0.00 0.00 29.99 31.74 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 -1.84 0.00 -2.92 4.41 8.25 0.84 -5.04 115.22 118.93 2c91 n HIS 270 Ca -0.03 -0.05 -0.20 0.00 -0.26 0.00 0.00 57.72 57.18 2c91 n HIS 270 Cb 0.31 -0.01 0.07 0.00 1.12 0.00 0.00 29.99 31.49 2c91 n HIS 270 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 2c91 s SER 271 N -0.10 4.98 0.00 0.41 1.04 -0.69 -4.96 113.70 114.37 2c91 s SER 271 Ca 0.00 -0.68 0.13 0.00 0.48 0.00 0.00 55.95 55.87 2c91 s SER 271 Cb 0.00 0.12 0.45 0.00 0.10 0.00 0.00 66.02 66.69 2c91 s SER 271 CO 0.00 -1.41 1.34 0.00 0.98 0.00 0.00 173.24 174.15 2c91 n GLN 272 N -2.35 1.61 -2.09 4.02 6.02 -1.26 -4.87 117.38 118.46 2c91 n GLN 272 Ca 0.15 -0.94 -0.41 0.00 -0.01 0.00 0.00 57.00 55.79 2c91 n GLN 272 Cb 0.61 -1.27 -0.02 0.00 1.02 0.00 0.00 30.24 30.58 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 -1.20 4.41 -0.27 1.08 1.43 -1.26 -5.02 118.68 117.85 2c91 s LEU 273 Ca 0.23 2.67 0.03 0.00 -1.03 0.00 0.00 54.13 56.03 2c91 s LEU 273 Cb 0.12 -3.64 0.06 0.00 0.03 0.00 0.00 46.19 42.76 2c91 s LEU 273 CO 0.17 -0.58 -0.08 -1.10 0.23 0.00 0.00 176.35 174.99 2c91 s GLN 274 N -1.35 2.19 0.35 1.70 -0.21 -1.26 -4.86 119.66 116.22 2c91 s GLN 274 Ca 0.52 -1.39 0.06 0.00 0.02 0.00 0.00 55.36 54.57 2c91 s GLN 274 Cb -0.40 -2.96 0.73 0.00 1.00 0.00 0.00 33.01 31.38 2c91 s GLN 274 CO 0.50 -0.61 1.93 0.78 -2.12 0.00 0.00 175.29 175.76 2c91 h GLY 275 N 7.78 1.08 2.00 3.09 0.00 -1.73 -1.65 103.07 113.64 2c91 h GLY 275 Ca -0.18 -0.32 -0.01 0.00 0.00 0.00 0.00 47.33 46.82 2c91 h GLY 275 CO 0.48 0.20 -0.04 -0.91 0.00 0.00 0.00 176.54 176.27 2c91 h THR 276 N 0.78 0.34 -0.01 4.70 1.35 -1.86 -0.07 112.91 118.14 2c91 h THR 276 Ca 0.36 -0.20 0.00 0.00 -0.55 0.00 0.00 66.41 66.02 2c91 h THR 276 Cb 0.38 1.14 0.00 0.00 -1.73 0.00 0.00 68.15 67.95 2c91 h THR 276 CO -0.14 0.03 -0.07 0.54 -0.25 0.00 0.00 175.52 175.63 2c91 n ARG 277 N -3.49 1.41 -0.69 4.72 1.74 -0.66 -4.94 116.66 114.75 2c91 n ARG 277 Ca -0.02 -0.81 0.00 0.00 -0.77 0.00 0.00 57.85 56.25 2c91 n ARG 277 Cb 0.14 -1.48 0.00 0.00 -1.02 0.00 0.00 32.46 30.10 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 1.22 0.71 3.71 -0.13 0.00 -0.04 -4.58 105.19 106.08 2c91 n GLY 278 Ca 0.17 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.85 2c91 n GLY 278 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2c91 s ASP 279 N -2.29 3.93 0.12 1.61 1.01 -1.00 -4.67 116.67 115.38 2c91 s ASP 279 Ca 0.00 2.39 -0.12 0.00 0.71 0.00 0.00 52.55 55.52 2c91 s ASP 279 Cb 0.00 -2.59 0.01 0.00 1.01 0.00 0.00 42.92 41.35 2c91 s ASP 279 CO 0.00 -2.44 0.31 0.00 0.21 0.00 0.00 175.17 173.24 2c91 s ALA 280 N -2.01 -0.54 -0.19 5.23 0.00 -0.57 -1.64 121.76 122.04 2c91 s ALA 280 Ca 0.75 -0.38 -0.07 0.00 0.00 0.00 0.00 51.96 52.25 2c91 s ALA 280 Cb -0.30 0.63 -0.04 0.00 0.00 0.00 0.00 23.12 23.41 2c91 s ALA 280 CO 0.47 -0.60 0.05 0.08 0.00 0.00 0.00 175.76 175.77 2c91 s VAL 281 N -3.85 4.62 -0.42 0.00 1.01 -0.01 -0.80 120.40 120.95 2c91 s VAL 281 Ca 0.05 -0.09 -0.19 0.00 0.00 0.00 0.00 61.98 61.76 2c91 s VAL 281 Cb 0.03 -3.09 0.02 0.00 0.00 0.00 0.00 36.38 33.35 2c91 s VAL 281 CO -0.10 0.45 0.53 -0.63 0.00 0.00 0.00 175.10 175.35 2c91 s ILE 282 N 0.51 4.97 0.33 2.22 1.01 0.19 -1.17 121.20 129.25 2c91 s ILE 282 Ca 0.02 -0.07 -0.27 0.00 0.00 0.00 0.00 60.65 60.33 2c91 s ILE 282 Cb -0.13 -4.10 -0.09 0.00 0.01 0.00 0.00 42.46 38.15 2c91 s ILE 282 CO 0.01 -0.47 1.09 -0.76 0.00 0.00 0.00 174.94 174.81 2c91 s LEU 283 N 2.46 4.40 0.18 2.97 1.43 0.02 -4.46 118.68 125.68 2c91 s LEU 283 Ca 0.17 2.20 0.10 0.00 -1.03 0.00 0.00 54.13 55.57 2c91 s LEU 283 Cb -0.16 -3.83 -0.04 0.00 0.03 0.00 0.00 46.19 42.19 2c91 s LEU 283 CO 0.16 -0.29 -0.13 -0.83 0.23 0.00 0.00 176.35 175.48 2c91 s GLY 284 N -1.11 1.72 -0.15 -3.19 0.00 -1.26 -0.56 107.32 102.77 2c91 s GLY 284 Ca 0.50 -1.52 -0.30 0.00 0.00 0.00 0.00 44.72 43.40 2c91 s GLY 284 CO 0.37 -1.54 1.00 -3.16 0.00 0.00 0.00 173.10 169.76 2c91 s MET 285 N -2.79 0.60 0.00 2.90 0.23 -1.26 -4.75 119.30 114.23 2c91 s MET 285 Ca 0.24 0.10 0.08 0.00 -1.03 0.00 0.00 55.69 55.08 2c91 s MET 285 Cb -0.09 0.28 0.07 0.00 -1.53 0.00 0.00 34.83 33.56 2c91 s MET 285 CO 0.14 -0.20 0.77 -1.13 -2.03 0.00 0.00 175.02 172.57 2c91 n SER 286 N 0.63 1.70 -3.82 -1.18 3.41 -1.26 -4.53 113.62 108.57 2c91 n SER 286 Ca -0.10 -1.35 -0.09 0.00 -0.26 0.00 0.00 58.87 57.07 2c91 n SER 286 Cb 0.58 -0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.46 2c91 n SER 286 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2c91 s SER 287 N -0.69 0.06 0.26 4.04 1.04 -1.26 -4.31 113.70 112.85 2c91 s SER 287 Ca 0.10 -0.58 -0.05 0.00 0.48 0.00 0.00 55.95 55.90 2c91 s SER 287 Cb 0.07 0.36 0.32 0.00 0.10 0.00 0.00 66.02 66.86 2c91 s SER 287 CO 0.10 -0.74 1.94 0.25 0.98 0.00 0.00 173.24 175.78 2c91 h LEU 288 N 2.74 1.10 -0.57 2.42 5.85 -1.96 -2.50 115.31 122.39 2c91 h LEU 288 Ca -0.34 -0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.33 2c91 h LEU 288 Cb 1.21 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.94 2c91 h LEU 288 CO 0.54 0.79 0.26 -0.33 -0.34 0.00 0.00 178.44 179.36 2c91 h GLU 289 N 1.29 0.83 -0.54 1.25 3.07 -1.99 0.01 114.58 118.50 2c91 h GLU 289 Ca 0.35 -0.13 0.01 0.00 -0.50 0.00 0.00 59.36 59.09 2c91 h GLU 289 Cb -0.14 -0.14 -0.03 0.00 -0.84 0.00 0.00 28.75 27.60 2c91 h GLU 289 CO -0.08 0.69 0.35 1.96 -1.40 0.00 0.00 179.01 180.53 2c91 h GLN 290 N 0.77 0.69 -0.37 2.33 4.20 -1.95 -2.59 115.11 118.20 2c91 h GLN 290 Ca 0.19 -0.04 -0.00 0.00 0.06 0.00 0.00 58.65 58.86 2c91 h GLN 290 Cb 0.14 -0.16 -0.02 0.00 0.30 0.00 0.00 27.48 27.75 2c91 h GLN 290 CO -0.02 0.46 0.22 1.25 -0.67 0.00 0.00 178.83 180.07 2c91 h LEU 291 N 0.72 0.44 -0.56 1.46 5.85 -1.11 -0.73 115.31 121.37 2c91 h LEU 291 Ca 0.20 -0.05 0.04 0.00 0.84 0.00 0.00 57.88 58.91 2c91 h LEU 291 Cb -0.07 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 40.81 2c91 h LEU 291 CO -0.05 0.36 0.32 -0.33 -0.34 0.00 0.00 178.44 178.39 2c91 h GLU 292 N 0.48 0.59 -0.66 1.25 4.39 -0.94 0.28 114.58 119.97 2c91 h GLU 292 Ca 0.13 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.80 2c91 h GLU 292 Cb -0.00 -0.13 -0.03 0.00 -0.10 0.00 0.00 28.75 28.48 2c91 h GLU 292 CO -0.03 0.39 0.43 0.37 -1.16 0.00 0.00 179.01 179.02 2c91 h GLN 293 N 0.61 0.87 -0.38 2.33 4.15 -1.19 -1.67 115.11 119.83 2c91 h GLN 293 Ca 0.24 -0.06 -0.11 0.00 0.77 0.00 0.00 58.65 59.49 2c91 h GLN 293 Cb 0.10 -0.19 -0.01 0.00 0.21 0.00 0.00 27.48 27.59 2c91 h GLN 293 CO -0.14 0.59 -0.19 -0.91 -1.93 0.00 0.00 178.83 176.24 2c91 h ASN 294 N 0.89 0.83 -0.74 -0.69 2.35 -0.47 -2.75 115.58 115.01 2c91 h ASN 294 Ca 0.24 -0.41 -0.00 0.00 -0.55 0.00 0.00 56.30 55.58 2c91 h ASN 294 Cb -0.09 -0.23 -0.04 0.00 0.05 0.00 0.00 38.32 38.01 2c91 h ASN 294 CO -0.05 1.06 0.45 -0.07 -1.65 0.00 0.00 177.43 177.17 2c91 h LEU 295 N 0.61 0.89 -0.41 1.61 3.38 -0.30 -2.38 115.31 118.71 2c91 h LEU 295 Ca 0.08 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.01 2c91 h LEU 295 Cb 0.75 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.26 2c91 h LEU 295 CO 0.06 0.68 0.26 0.00 0.09 0.00 0.00 178.44 179.53 2c91 h ALA 296 N 1.48 0.52 -0.16 1.53 0.00 -1.20 -3.07 119.26 118.36 2c91 h ALA 296 Ca 0.27 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.10 2c91 h ALA 296 Cb -0.05 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 2c91 h ALA 296 CO -0.05 -0.01 -0.06 0.00 0.00 0.00 0.00 179.25 179.13 2c91 h ALA 297 N 1.14 1.59 0.00 0.00 0.00 -1.18 -1.54 119.26 119.26 2c91 h ALA 297 Ca 0.15 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2c91 h ALA 297 Cb -0.04 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.67 2c91 h ALA 297 CO -0.03 0.30 0.00 1.79 0.00 0.00 0.00 179.25 181.31 2c91 h THR 298 N 0.24 0.00 -0.00 0.00 1.35 -1.34 -2.87 112.91 110.29 2c91 h THR 298 Ca 0.05 -0.55 0.00 0.00 -0.55 0.00 0.00 66.41 65.36 2c91 h THR 298 Cb 0.27 1.53 0.00 0.00 -1.73 0.00 0.00 68.15 68.22 2c91 h THR 298 CO 0.01 0.00 -0.72 -0.62 -0.25 0.00 0.00 175.52 173.94 2c91 n GLU 299 N -3.02 0.16 -1.10 4.72 1.02 -0.60 -4.95 120.64 116.87 2c91 n GLU 299 Ca 0.01 -0.12 -0.29 0.00 -0.02 0.00 0.00 57.16 56.75 2c91 n GLU 299 Cb 0.33 -1.50 0.19 0.00 -0.02 0.00 0.00 31.44 30.44 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 -2.92 0.11 0.00 3.49 2.02 -1.08 -5.07 118.70 115.24 2c91 s GLU 300 Ca 0.11 0.48 0.00 0.00 0.02 0.00 0.00 54.97 55.58 2c91 s GLU 300 Cb 0.17 -1.70 0.00 0.00 0.10 0.00 0.00 34.13 32.70 2c91 s GLU 300 CO 0.76 -2.94 0.00 0.41 0.02 0.00 0.00 175.26 173.51 2c91 n GLY 301 N -0.90 1.21 3.73 -1.39 0.00 -1.26 -5.03 105.19 101.55 2c91 n GLY 301 Ca 0.05 -2.01 -0.33 0.00 0.00 0.00 0.00 46.02 43.73 2c91 n GLY 301 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2c91 s PRO 302 N -1.87 2.17 0.51 1.61 0.02 -1.26 -4.94 135.00 131.24 2c91 s PRO 302 Ca 0.00 1.54 -0.05 0.00 0.02 0.00 0.00 61.00 62.51 2c91 s PRO 302 Cb 0.00 -1.86 -0.02 0.00 0.02 0.00 0.00 34.50 32.64 2c91 s PRO 302 CO 0.00 -1.76 0.80 -0.51 -0.33 0.00 0.00 177.00 175.20 2c91 s LEU 303 N -5.40 3.52 0.52 -5.54 1.43 -1.26 -5.06 118.68 106.89 2c91 s LEU 303 Ca 0.69 0.78 -0.21 0.00 -1.03 0.00 0.00 54.13 54.36 2c91 s LEU 303 Cb -0.24 -3.69 -0.06 0.00 0.03 0.00 0.00 46.19 42.23 2c91 s LEU 303 CO 0.48 -0.73 1.21 -1.61 0.23 0.00 0.00 176.35 175.92 2c91 s GLU 304 N -4.79 3.41 0.31 1.70 0.41 -1.26 -4.80 118.70 113.68 2c91 s GLU 304 Ca 0.49 1.86 0.08 0.00 -0.41 0.00 0.00 54.97 56.98 2c91 s GLU 304 Cb -0.10 -2.22 0.82 0.00 -1.78 0.00 0.00 34.13 30.85 2c91 s GLU 304 CO 0.44 -0.86 1.73 -1.35 -0.49 0.00 0.00 175.26 174.73 2c91 h PRO 305 N 1.56 0.57 -0.78 0.39 0.11 -1.99 -1.10 132.00 130.77 2c91 h PRO 305 Ca -0.50 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.58 2c91 h PRO 305 Cb 1.27 -0.13 -0.04 0.00 0.11 0.00 0.00 31.00 32.21 2c91 h PRO 305 CO 0.58 0.37 0.50 0.00 -0.21 0.00 0.00 178.00 179.24 2c91 h ALA 306 N 1.71 1.41 -0.06 -0.75 0.00 -1.97 0.20 119.26 119.79 2c91 h ALA 306 Ca 0.61 -0.07 -0.18 0.00 0.00 0.00 0.00 54.91 55.27 2c91 h ALA 306 Cb 1.12 -0.32 0.01 0.00 0.00 0.00 0.00 17.79 18.61 2c91 h ALA 306 CO -0.47 0.53 -0.67 0.28 0.00 0.00 0.00 179.25 178.93 2c91 h VAL 307 N 1.06 1.35 -0.82 0.00 2.07 -1.54 -1.67 116.25 116.71 2c91 h VAL 307 Ca 0.28 -1.99 0.08 0.00 0.82 0.00 0.00 66.70 65.89 2c91 h VAL 307 Cb -0.09 2.31 -0.07 0.00 -1.52 0.00 0.00 31.29 31.91 2c91 h VAL 307 CO -0.06 0.60 0.49 0.58 0.02 0.00 0.00 177.57 179.20 2c91 h VAL 308 N 0.17 0.96 -0.66 2.57 2.07 -1.09 -1.07 116.25 119.21 2c91 h VAL 308 Ca -0.07 -0.29 -0.08 0.00 0.82 0.00 0.00 66.70 67.08 2c91 h VAL 308 Cb 1.33 0.04 -0.03 0.00 -1.52 0.00 0.00 31.29 31.12 2c91 h VAL 308 CO 0.14 0.16 0.10 -0.08 0.02 0.00 0.00 177.57 177.90 2c91 h GLU 309 N 0.85 1.09 -0.88 1.57 4.57 -0.89 -2.46 114.58 118.43 2c91 h GLU 309 Ca 0.38 -0.29 -0.01 0.00 -1.18 0.00 0.00 59.36 58.26 2c91 h GLU 309 Cb 0.28 -0.13 -0.04 0.00 -0.16 0.00 0.00 28.75 28.70 2c91 h GLU 309 CO -0.21 1.00 0.50 0.00 -1.18 0.00 0.00 179.01 179.12 2c91 h ALA 310 N 1.08 1.24 -0.31 2.92 0.00 -0.54 -0.70 119.26 122.96 2c91 h ALA 310 Ca 0.20 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 2c91 h ALA 310 Cb 0.44 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 2c91 h ALA 310 CO 0.01 0.63 -0.02 0.74 0.00 0.00 0.00 179.25 180.62 2c91 h PHE 311 N 1.22 0.49 -0.27 0.00 0.04 -0.93 0.65 116.94 118.14 2c91 h PHE 311 Ca 0.31 -0.05 -0.19 0.00 2.80 0.00 0.00 57.97 60.84 2c91 h PHE 311 Cb -0.01 -0.14 0.00 0.00 2.20 0.00 0.00 35.95 38.00 2c91 h PHE 311 CO 0.01 0.50 -0.59 -0.44 -0.60 0.00 0.00 178.31 177.19 2c91 h ASP 312 N 0.46 0.98 -0.45 2.17 3.32 -0.78 -1.92 116.42 120.19 2c91 h ASP 312 Ca 0.10 -0.55 -0.06 0.00 0.02 0.00 0.00 57.03 56.54 2c91 h ASP 312 Cb 0.33 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.58 2c91 h ASP 312 CO 0.01 1.35 0.06 1.56 -1.72 0.00 0.00 179.24 180.51 2c91 h GLN 313 N 0.65 0.82 -0.13 3.56 4.20 -0.92 -1.09 115.11 122.19 2c91 h GLN 313 Ca 0.00 -0.19 -0.01 0.00 0.06 0.00 0.00 58.65 58.51 2c91 h GLN 313 Cb 1.21 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.87 2c91 h GLN 313 CO 0.13 0.78 0.06 0.00 -0.67 0.00 0.00 178.83 179.12 2c91 h ALA 314 N 1.29 0.17 -0.43 3.87 0.00 -0.76 -1.75 119.26 121.65 2c91 h ALA 314 Ca 0.16 -0.09 0.05 0.00 0.00 0.00 0.00 54.91 55.03 2c91 h ALA 314 Cb 0.38 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.07 2c91 h ALA 314 CO 0.01 -0.25 0.17 2.35 0.00 0.00 0.00 179.25 181.53 2c91 h TRP 315 N 0.07 0.30 -0.71 0.00 2.91 -1.23 -2.16 115.95 115.12 2c91 h TRP 315 Ca 0.04 0.02 0.15 0.00 1.13 0.00 0.00 58.89 60.23 2c91 h TRP 315 Cb 0.16 -0.07 -0.04 0.00 -0.51 0.00 0.00 29.16 28.70 2c91 h TRP 315 CO -0.02 0.12 0.48 -0.91 -1.03 0.00 0.00 178.44 177.08 2c91 h ASN 316 N 0.34 0.32 0.35 2.65 2.35 -0.76 0.51 115.58 121.34 2c91 h ASN 316 Ca 0.20 0.02 -0.12 0.00 -0.55 0.00 0.00 56.30 55.85 2c91 h ASN 316 Cb 0.17 -0.05 -0.01 0.00 0.05 0.00 0.00 38.32 38.48 2c91 h ASN 316 CO -0.19 0.16 -0.49 0.24 -1.65 0.00 0.00 177.43 175.51 2c91 h MET 317 N 0.34 0.17 0.00 0.81 2.86 -0.66 -3.30 114.93 115.15 2c91 h MET 317 Ca 0.35 -0.09 0.00 0.00 -2.06 0.00 0.00 59.70 57.89 2c91 h MET 317 Cb 0.87 0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.54 2c91 h MET 317 CO -0.09 0.62 -0.68 1.33 1.06 0.00 0.00 176.91 179.15 2c91 n VAL 318 N -3.96 0.00 -0.34 -2.22 0.24 -0.63 -4.69 118.33 106.73 2c91 n VAL 318 Ca -0.02 -0.18 0.16 0.00 -2.04 0.00 0.00 64.34 62.26 2c91 n VAL 318 Cb 0.53 0.97 0.38 0.00 -1.47 0.00 0.00 33.84 34.25 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 1.91 1.82 0.00 2.33 0.00 -1.02 0.48 119.26 124.77 2c91 h ALA 319 Ca 0.00 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2c91 h ALA 319 Cb 0.34 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2c91 h ALA 319 CO 0.00 -0.24 0.00 -2.39 0.00 0.00 0.00 179.25 176.62 2c91 n HIS 320 N -4.79 0.62 -1.66 0.00 1.44 -1.26 -2.76 115.22 106.81 2c91 n HIS 320 Ca 0.25 0.24 0.06 0.00 -2.01 0.00 0.00 57.72 56.26 2c91 n HIS 320 Cb 0.69 -0.89 0.14 0.00 0.12 0.00 0.00 29.99 30.05 2c91 n HIS 320 CO 0.00 0.00 0.00 -0.85 -2.81 0.00 0.00 176.34 172.68 2c91 n GLU 321 N -2.06 1.07 -1.77 -1.40 0.28 0.12 -5.08 120.64 111.80 2c91 n GLU 321 Ca 0.03 -2.66 -0.41 0.00 -0.16 0.00 0.00 57.16 53.95 2c91 n GLU 321 Cb 0.22 -1.19 -0.00 0.00 1.43 0.00 0.00 31.44 31.90 2c91 n GLU 321 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2c91 s PRO 323 N -1.70 3.85 0.11 0.00 0.04 -1.26 -4.99 135.00 131.05 2c91 s PRO 323 Ca 0.56 1.49 -0.30 0.00 0.04 0.00 0.00 61.00 62.78 2c91 s PRO 323 Cb -0.48 -2.26 -0.07 0.00 0.04 0.00 0.00 34.50 31.74 2c91 s PRO 323 CO 0.60 -0.41 1.23 -0.80 0.04 0.00 0.00 177.00 177.66 2c91 s ASN 324 N -1.75 7.03 0.42 6.66 0.01 -1.26 -4.86 114.94 121.19 2c91 s ASN 324 Ca 0.65 2.15 0.30 0.00 -0.71 0.00 0.00 52.86 55.24 2c91 s ASN 324 Cb -0.20 -2.59 1.31 0.00 0.41 0.00 0.00 41.25 40.17 2c91 s ASN 324 CO 0.25 -0.47 1.89 0.10 -1.51 0.00 0.00 177.10 177.35 2c91 h TYR 325 N 6.28 0.00 -3.40 2.20 -0.00 -1.94 -3.44 116.97 116.67 2c91 h TYR 325 Ca -0.43 0.00 -0.65 0.00 -0.00 0.00 0.00 58.73 57.65 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 0.65 0.00 -0.69 -0.59 -0.00 0.00 0.00 178.16 177.53 2c91 s PHE 326 N -3.57 2.87 0.00 0.10 -0.12 -1.26 -4.28 117.98 111.73 2c91 s PHE 326 Ca 0.01 -0.09 0.00 0.00 -0.05 0.00 0.00 56.93 56.81 2c91 s PHE 326 Cb 0.09 -1.48 0.00 0.00 -0.63 0.00 0.00 43.02 41.00 2c91 s PHE 326 CO 0.44 0.46 0.37 0.54 -0.05 0.00 0.00 175.22 176.97