#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ger n ALA 0 N 0.00 2.45 -1.77 7.54 0.00 -1.26 -4.93 120.51 122.54 2ger n ALA 0 Ca 0.00 -0.79 -0.38 0.00 0.00 0.00 0.00 53.44 52.28 2ger n ALA 0 Cb 0.00 -0.98 0.00 0.00 0.00 0.00 0.00 19.45 18.47 2ger n ALA 0 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 2ger s MET 1 N -1.48 3.63 -0.14 0.00 0.00 -1.26 -5.04 119.30 115.01 2ger s MET 1 Ca 0.33 1.92 -0.09 0.00 0.00 0.00 0.00 55.69 57.85 2ger s MET 1 Cb 0.18 -2.41 0.05 0.00 0.00 0.00 0.00 34.83 32.65 2ger s MET 1 CO 0.24 -0.69 0.35 -1.12 0.00 0.00 0.00 175.02 173.80 2ger s SER 2 N -1.21 -0.41 0.42 1.11 0.01 -1.26 -5.02 113.70 107.33 2ger s SER 2 Ca 0.65 0.75 0.08 0.00 1.31 0.00 0.00 55.95 58.73 2ger s SER 2 Cb -0.32 0.66 -0.02 0.00 0.21 0.00 0.00 66.02 66.54 2ger s SER 2 CO 0.39 -0.17 0.35 -0.69 0.41 0.00 0.00 173.24 173.53 2ger s VAL 3 N 1.11 2.59 -0.04 3.43 1.01 -1.20 -0.02 120.40 127.28 2ger s VAL 3 Ca -0.08 -1.39 -0.23 0.00 0.00 0.00 0.00 61.98 60.28 2ger s VAL 3 Cb -0.08 -2.98 0.05 0.00 0.00 0.00 0.00 36.38 33.37 2ger s VAL 3 CO -0.09 0.00 0.51 -0.83 0.00 0.00 0.00 175.10 174.69 2ger s GLY 4 N -4.10 -0.38 -0.14 4.51 0.00 -1.18 -0.82 107.32 105.20 2ger s GLY 4 Ca 0.47 0.87 0.01 0.00 0.00 0.00 0.00 44.72 46.07 2ger s GLY 4 CO 0.27 0.58 -0.16 -1.36 0.00 0.00 0.00 173.10 172.43 2ger s PHE 5 N -1.22 2.27 -1.30 1.90 0.40 0.75 0.49 117.98 121.27 2ger s PHE 5 Ca -0.12 -1.23 0.22 0.00 -0.60 0.00 0.00 56.93 55.20 2ger s PHE 5 Cb -0.02 -1.63 1.05 0.00 0.51 0.00 0.00 43.02 42.93 2ger s PHE 5 CO 0.07 -0.64 1.70 -0.89 0.70 0.00 0.00 175.22 176.16 2ger n ILE 6 N 4.55 0.38 0.00 0.64 5.41 0.54 -2.34 119.36 128.53 2ger n ILE 6 Ca -0.18 0.09 0.00 0.00 1.00 0.00 0.00 62.75 63.66 2ger n ILE 6 Cb 0.50 -0.73 0.00 0.00 -0.71 0.00 0.00 39.64 38.70 2ger n ILE 6 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2ger n GLY 7 N 0.62 0.78 0.00 7.39 0.00 -1.26 -4.19 105.19 108.52 2ger n GLY 7 Ca 0.09 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.94 2ger n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ger n ALA 8 N -3.00 0.00 -0.98 4.61 0.00 -1.25 -3.24 120.51 116.65 2ger n ALA 8 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2ger n ALA 8 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2ger n ALA 8 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ger n GLY 9 N 0.00 0.97 0.00 0.00 0.00 -1.26 -2.61 105.19 102.29 2ger n GLY 9 Ca 0.00 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.32 2ger n GLY 9 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2ger n GLN 10 N 0.00 0.00 0.00 1.61 1.13 -1.26 -3.07 117.38 115.79 2ger n GLN 10 Ca 0.00 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.06 2ger n GLN 10 Cb 0.00 -0.39 0.00 0.00 0.11 0.00 0.00 30.24 29.96 2ger n GLN 10 CO 0.00 0.00 0.00 -0.11 -1.44 0.00 0.00 177.06 175.51 2ger n LEU 11 N 0.00 0.00 0.08 1.08 0.00 -1.26 0.20 117.00 117.10 2ger n LEU 11 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 56.01 55.93 2ger n LEU 11 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 43.42 43.37 2ger n LEU 11 CO 0.00 0.00 0.51 0.00 0.00 0.00 0.00 177.39 177.90 2ger h ALA 12 N 0.00 -0.83 -0.96 1.96 0.00 -1.60 0.14 119.26 117.97 2ger h ALA 12 Ca 0.00 -0.07 0.25 0.00 0.00 0.00 0.00 54.91 55.10 2ger h ALA 12 Cb 0.00 0.62 -0.06 0.00 0.00 0.00 0.00 17.79 18.35 2ger h ALA 12 CO 0.00 -0.87 0.66 0.35 0.00 0.00 0.00 179.25 179.39 2ger h PHE 13 N -0.41 0.30 0.46 0.00 3.57 0.23 1.87 116.94 122.96 2ger h PHE 13 Ca -0.01 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.48 2ger h PHE 13 Cb 0.39 -0.09 0.00 0.00 2.79 0.00 0.00 35.95 39.04 2ger h PHE 13 CO -0.31 0.06 -0.22 0.00 -2.23 0.00 0.00 178.31 175.61 2ger h ALA 14 N 1.57 -1.01 0.42 2.41 0.00 -0.26 0.11 119.26 122.49 2ger h ALA 14 Ca 0.49 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.25 2ger h ALA 14 Cb 1.57 0.24 -0.01 0.00 0.00 0.00 0.00 17.79 19.59 2ger h ALA 14 CO -0.12 -0.97 -0.27 -0.07 0.00 0.00 0.00 179.25 177.82 2ger h LEU 15 N -0.69 -0.68 -0.95 0.00 3.38 0.25 -0.45 115.31 116.18 2ger h LEU 15 Ca -0.06 0.04 0.13 0.00 0.09 0.00 0.00 57.88 58.08 2ger h LEU 15 Cb 0.47 0.20 -0.14 0.00 0.09 0.00 0.00 40.66 41.28 2ger h LEU 15 CO 0.10 -0.42 -0.46 0.00 0.09 0.00 0.00 178.44 177.75 2ger h ALA 16 N -0.13 -0.12 -0.44 1.53 0.00 0.28 0.54 119.26 120.92 2ger h ALA 16 Ca -0.04 0.21 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 2ger h ALA 16 Cb 0.55 1.12 -0.02 0.00 0.00 0.00 0.00 17.79 19.44 2ger h ALA 16 CO 0.04 -0.76 0.22 -0.22 0.00 0.00 0.00 179.25 178.53 2ger h LYS 17 N -0.03 0.63 -0.56 0.00 1.63 -0.45 -2.05 116.57 115.74 2ger h LYS 17 Ca 0.27 -0.09 -0.08 0.00 -0.85 0.00 0.00 60.65 59.90 2ger h LYS 17 Cb 0.53 -0.12 -0.02 0.00 -0.60 0.00 0.00 32.23 32.03 2ger h LYS 17 CO -0.94 0.53 0.02 0.78 -3.45 0.00 0.00 179.45 176.39 2ger h GLY 18 N 0.57 1.02 0.84 5.01 0.00 0.16 -2.02 103.07 108.65 2ger h GLY 18 Ca 0.15 -0.70 -0.02 0.00 0.00 0.00 0.00 47.33 46.76 2ger h GLY 18 CO -0.02 0.65 0.04 0.74 0.00 0.00 0.00 176.54 177.95 2ger h PHE 19 N 0.88 0.28 0.18 5.60 0.05 -0.85 0.23 116.94 123.30 2ger h PHE 19 Ca 0.17 -0.03 -0.01 0.00 3.82 0.00 0.00 57.97 61.92 2ger h PHE 19 Cb 0.49 -0.08 -0.01 0.00 2.00 0.00 0.00 35.95 38.35 2ger h PHE 19 CO 0.03 0.40 -0.16 1.79 -0.18 0.00 0.00 178.31 180.19 2ger h THR 20 N 0.08 0.00 -0.43 -1.55 1.35 -1.28 -2.15 112.91 108.93 2ger h THR 20 Ca 0.05 0.00 0.12 0.00 -0.55 0.00 0.00 66.41 66.04 2ger h THR 20 Cb 0.26 0.00 -0.02 0.00 -1.73 0.00 0.00 68.15 66.66 2ger h THR 20 CO 0.00 0.00 0.50 0.00 -0.25 0.00 0.00 175.52 175.77 2ger h ALA 21 N -1.53 2.13 0.00 6.62 0.00 -1.39 0.53 119.26 125.62 2ger h ALA 21 Ca -0.02 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2ger h ALA 21 Cb 0.28 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2ger h ALA 21 CO -0.01 -0.73 0.00 0.00 0.00 0.00 0.00 179.25 178.52 2ger n ALA 22 N -2.29 1.96 -1.28 0.00 0.00 0.79 -4.84 120.51 114.85 2ger n ALA 22 Ca 0.08 -0.08 -0.10 0.00 0.00 0.00 0.00 53.44 53.34 2ger n ALA 22 Cb 0.68 -1.31 -0.04 0.00 0.00 0.00 0.00 19.45 18.78 2ger n ALA 22 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ger n GLY 23 N 0.40 1.09 0.00 0.00 0.00 0.19 -4.94 105.19 101.93 2ger n GLY 23 Ca 0.07 -0.37 0.00 0.00 0.00 0.00 0.00 46.02 45.72 2ger n GLY 23 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2ger n VAL 24 N -2.60 0.00 0.00 1.61 0.31 -1.13 -4.98 118.33 111.55 2ger n VAL 24 Ca -0.10 0.10 0.00 0.00 -0.01 0.00 0.00 64.34 64.34 2ger n VAL 24 Cb 0.38 -0.44 0.00 0.00 -0.91 0.00 0.00 33.84 32.87 2ger n VAL 24 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 2ger n LEU 25 N -0.95 0.00 -3.31 7.52 7.94 -1.25 -5.07 117.00 121.87 2ger n LEU 25 Ca 0.00 0.00 0.03 0.00 -1.11 0.00 0.00 56.01 54.93 2ger n LEU 25 Cb 0.00 0.00 -0.03 0.00 0.53 0.00 0.00 43.42 43.92 2ger n LEU 25 CO 0.00 0.00 0.61 0.00 -1.11 0.00 0.00 177.39 176.89 2ger s ALA 26 N -3.84 -2.91 0.00 1.96 0.00 -1.26 -4.94 121.76 110.77 2ger s ALA 26 Ca 0.00 1.87 -0.01 0.00 0.00 0.00 0.00 51.96 53.82 2ger s ALA 26 Cb 0.00 -2.19 -0.00 0.00 0.00 0.00 0.00 23.12 20.93 2ger s ALA 26 CO 0.00 -1.09 0.06 0.00 0.00 0.00 0.00 175.76 174.73 2ger n ALA 27 N 5.08 -0.02 -0.21 0.00 0.00 -1.26 0.22 120.51 124.32 2ger n ALA 27 Ca -0.08 0.02 0.07 0.00 0.00 0.00 0.00 53.44 53.46 2ger n ALA 27 Cb 0.53 0.00 0.35 0.00 0.00 0.00 0.00 19.45 20.33 2ger n ALA 27 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 177.50 178.62 2ger h HIS 28 N 0.00 0.80 0.00 0.00 2.07 -1.03 -2.10 115.15 114.89 2ger h HIS 28 Ca 0.00 0.02 -0.09 0.00 -2.85 0.00 0.00 60.37 57.45 2ger h HIS 28 Cb 0.01 -0.26 -0.03 0.00 2.57 0.00 0.00 27.41 29.70 2ger h HIS 28 CO -0.04 0.40 -0.17 1.63 -3.07 0.00 0.00 177.93 176.67 2ger n LYS 29 N -4.49 1.43 -3.78 5.12 5.02 0.60 -4.46 118.16 117.59 2ger n LYS 29 Ca 0.12 -0.48 -0.12 0.00 -2.02 0.00 0.00 58.31 55.82 2ger n LYS 29 Cb 0.28 -1.50 -0.08 0.00 -0.02 0.00 0.00 35.03 33.70 2ger n LYS 29 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2ger s ILE 30 N 0.60 0.08 -0.19 -0.18 1.01 -0.79 -3.27 121.20 118.46 2ger s ILE 30 Ca 0.32 -0.68 -0.14 0.00 0.00 0.00 0.00 60.65 60.15 2ger s ILE 30 Cb 0.15 -0.83 0.06 0.00 0.01 0.00 0.00 42.46 41.85 2ger s ILE 30 CO 0.00 -0.38 0.49 -0.32 0.00 0.00 0.00 174.94 174.73 2ger s MET 31 N -2.22 0.52 0.04 2.79 1.75 -0.00 -0.80 119.30 121.38 2ger s MET 31 Ca -0.07 0.81 0.02 0.00 -1.25 0.00 0.00 55.69 55.19 2ger s MET 31 Cb -0.02 0.13 -0.02 0.00 2.84 0.00 0.00 34.83 37.75 2ger s MET 31 CO -0.01 -0.12 -0.06 0.00 -0.65 0.00 0.00 175.02 174.17 2ger s ALA 32 N 0.96 0.48 -0.11 4.11 0.00 0.19 -0.18 121.76 127.21 2ger s ALA 32 Ca -0.06 -0.76 -0.12 0.00 0.00 0.00 0.00 51.96 51.02 2ger s ALA 32 Cb -0.06 0.08 -0.05 0.00 0.00 0.00 0.00 23.12 23.10 2ger s ALA 32 CO -0.08 -0.07 0.28 -1.54 0.00 0.00 0.00 175.76 174.35 2ger s SER 33 N -1.65 6.51 -1.11 0.00 1.04 -0.99 -1.82 113.70 115.68 2ger s SER 33 Ca -0.10 0.60 -0.09 0.00 0.48 0.00 0.00 55.95 56.84 2ger s SER 33 Cb -0.09 -2.17 0.28 0.00 0.10 0.00 0.00 66.02 64.14 2ger s SER 33 CO -0.00 0.23 1.11 -1.54 0.98 0.00 0.00 173.24 174.02 2ger n SER 34 N 2.77 5.49 -4.57 7.02 3.41 -0.87 -4.47 113.62 122.41 2ger n SER 34 Ca -0.14 -3.04 -0.41 0.00 -0.26 0.00 0.00 58.87 55.01 2ger n SER 34 Cb 0.53 -1.37 -0.03 0.00 -0.26 0.00 0.00 64.21 63.08 2ger n SER 34 CO 0.00 0.00 0.00 -2.84 -0.16 0.00 0.00 175.04 172.04 2ger s PRO 35 N -1.31 3.09 0.00 4.33 0.02 -1.26 -4.11 135.00 135.76 2ger s PRO 35 Ca 0.31 0.67 0.00 0.00 0.02 0.00 0.00 61.00 62.00 2ger s PRO 35 Cb -0.10 -4.22 0.00 0.00 0.02 0.00 0.00 34.50 30.20 2ger s PRO 35 CO -0.08 -2.18 0.00 -0.25 -0.33 0.00 0.00 177.00 174.16 2ger n ASP 36 N 10.72 0.00 0.00 2.53 8.00 -1.26 -4.90 116.55 131.63 2ger n ASP 36 Ca 0.17 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.67 2ger n ASP 36 Cb 0.50 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.60 2ger n ASP 36 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 2ger n MET 37 N 0.00 0.00 -2.85 -1.24 2.81 -1.26 -5.07 117.12 109.51 2ger n MET 37 Ca 0.00 0.00 -0.44 0.00 -1.81 0.00 0.00 57.70 55.45 2ger n MET 37 Cb 0.00 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 32.51 2ger n MET 37 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 2ger n ASP 38 N 0.00 5.29 0.00 7.83 8.00 -1.26 -4.95 116.55 131.46 2ger n ASP 38 Ca 0.00 -3.04 0.00 0.00 0.71 0.00 0.00 54.79 52.46 2ger n ASP 38 Cb 0.00 -1.51 0.00 0.00 -0.02 0.00 0.00 41.12 39.59 2ger n ASP 38 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2ger n LEU 39 N 4.69 0.00 0.00 0.64 4.77 -1.26 -0.86 117.00 124.98 2ger n LEU 39 Ca 0.36 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.34 2ger n LEU 39 Cb 0.40 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.49 2ger n LEU 39 CO 0.66 0.00 0.08 0.00 -1.33 0.00 0.00 177.39 176.80 2ger n ALA 40 N 0.00 0.00 -1.00 -1.18 0.00 -1.26 0.90 120.51 117.97 2ger n ALA 40 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2ger n ALA 40 Cb 0.00 0.08 0.00 0.00 0.00 0.00 0.00 19.45 19.53 2ger n ALA 40 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2ger n THR 41 N -0.47 0.00 0.00 0.00 -1.04 -0.04 0.71 114.28 113.44 2ger n THR 41 Ca 0.00 0.47 0.00 0.00 -2.04 0.00 0.00 64.05 62.48 2ger n THR 41 Cb 0.00 -1.13 0.00 0.00 -1.82 0.00 0.00 70.33 67.38 2ger n THR 41 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 2ger n VAL 42 N 0.00 0.00 -0.37 12.58 0.31 -1.21 0.85 118.33 130.49 2ger n VAL 42 Ca 0.00 0.69 0.31 0.00 -0.01 0.00 0.00 64.34 65.32 2ger n VAL 42 Cb 0.00 -0.99 0.62 0.00 -0.91 0.00 0.00 33.84 32.56 2ger n VAL 42 CO 0.00 0.00 0.00 -1.28 -1.32 0.00 0.00 176.83 174.23 2ger h SER 43 N 0.00 0.27 0.00 4.52 0.87 0.43 -1.05 113.55 118.58 2ger h SER 43 Ca 0.00 0.07 0.00 0.00 -1.23 0.00 0.00 61.79 60.63 2ger h SER 43 Cb 0.00 0.04 0.00 0.00 -0.44 0.00 0.00 62.40 62.00 2ger h SER 43 CO 0.00 -0.01 0.00 0.00 -0.53 0.00 0.00 176.83 176.29 2ger n ALA 44 N -2.58 -0.36 -0.24 6.23 0.00 0.25 -2.67 120.51 121.14 2ger n ALA 44 Ca 0.29 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.79 2ger n ALA 44 Cb 1.16 0.05 0.13 0.00 0.00 0.00 0.00 19.45 20.79 2ger n ALA 44 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2ger n LEU 45 N -1.83 -0.19 -0.30 0.00 4.77 -0.43 0.21 117.00 119.23 2ger n LEU 45 Ca 0.00 1.15 0.05 0.00 -0.03 0.00 0.00 56.01 57.18 2ger n LEU 45 Cb 0.00 -0.37 0.11 0.00 -2.33 0.00 0.00 43.42 40.83 2ger n LEU 45 CO 0.00 -1.12 0.55 0.54 -1.33 0.00 0.00 177.39 176.03 2ger n ARG 46 N -5.03 -0.08 -0.03 3.23 1.74 -0.82 0.97 116.66 116.65 2ger n ARG 46 Ca 0.12 1.30 -0.13 0.00 -0.77 0.00 0.00 57.85 58.37 2ger n ARG 46 Cb 0.39 -1.94 -0.09 0.00 -1.02 0.00 0.00 32.46 29.80 2ger n ARG 46 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 2ger h LYS 47 N 0.00 0.12 -0.93 5.56 1.57 -0.29 -3.29 116.57 119.31 2ger h LYS 47 Ca 0.40 -0.08 0.13 0.00 -1.87 0.00 0.00 60.65 59.23 2ger h LYS 47 Cb 0.60 0.01 -0.14 0.00 0.08 0.00 0.00 32.23 32.78 2ger h LYS 47 CO -0.86 0.64 -0.44 1.98 -0.57 0.00 0.00 179.45 180.21 2ger h MET 48 N -0.38 -0.03 0.00 3.15 4.05 0.81 -3.45 114.93 119.08 2ger h MET 48 Ca 0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.43 2ger h MET 48 Cb 0.63 0.01 0.00 0.00 -0.80 0.00 0.00 31.60 31.44 2ger h MET 48 CO 0.02 -0.02 0.00 0.41 0.23 0.00 0.00 176.91 177.54 2ger n GLY 49 N -1.41 0.96 3.85 1.39 0.00 -0.31 -4.94 105.19 104.73 2ger n GLY 49 Ca 0.07 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.77 2ger n GLY 49 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ger s VAL 50 N -0.96 5.06 -0.24 1.61 1.01 -1.23 -0.30 120.40 125.35 2ger s VAL 50 Ca 0.00 -0.39 -0.29 0.00 0.00 0.00 0.00 61.98 61.30 2ger s VAL 50 Cb 0.00 -3.39 0.00 0.00 0.00 0.00 0.00 36.38 32.99 2ger s VAL 50 CO 0.00 0.25 1.16 -0.54 0.00 0.00 0.00 175.10 175.98 2ger s LYS 51 N -2.09 4.16 -0.13 2.72 1.02 0.02 -4.68 119.74 120.76 2ger s LYS 51 Ca 0.28 1.39 0.01 0.00 0.02 0.00 0.00 55.97 57.67 2ger s LYS 51 Cb -0.12 -3.74 -0.01 0.00 -0.52 0.00 0.00 37.83 33.44 2ger s LYS 51 CO 0.20 -0.79 -0.16 -0.51 -0.92 0.00 0.00 175.35 173.17 2ger s LEU 52 N 3.58 2.51 -0.03 3.17 1.43 -1.26 -0.64 118.68 127.45 2ger s LEU 52 Ca 0.50 -0.42 0.04 0.00 -1.03 0.00 0.00 54.13 53.22 2ger s LEU 52 Cb -0.17 -1.55 -0.00 0.00 0.03 0.00 0.00 46.19 44.49 2ger s LEU 52 CO 0.13 0.14 -0.13 0.28 0.23 0.00 0.00 176.35 177.00 2ger s THR 53 N 0.49 1.09 0.39 5.49 -1.32 -0.75 -4.96 115.64 116.07 2ger s THR 53 Ca -0.11 -0.55 0.06 0.00 -1.21 0.00 0.00 61.69 59.88 2ger s THR 53 Cb -0.16 -0.94 0.27 0.00 -1.51 0.00 0.00 72.50 70.16 2ger s THR 53 CO 0.05 0.32 2.03 1.55 -2.21 0.00 0.00 174.62 176.36 2ger h PRO 54 N 6.13 0.64 -6.06 7.08 0.13 -1.88 -2.30 132.00 135.73 2ger h PRO 54 Ca -0.33 -0.04 -0.58 0.00 -0.87 0.00 0.00 66.00 64.18 2ger h PRO 54 Cb 1.17 -0.15 -0.10 0.00 0.13 0.00 0.00 31.00 32.05 2ger h PRO 54 CO 0.48 0.43 0.80 -1.01 -0.23 0.00 0.00 178.00 178.47 2ger s HIS 55 N -5.58 2.56 0.00 1.56 3.76 -1.26 -4.17 115.29 112.16 2ger s HIS 55 Ca -0.09 -0.07 0.00 0.00 -0.15 0.00 0.00 55.06 54.75 2ger s HIS 55 Cb 0.18 -4.39 0.00 0.00 1.11 0.00 0.00 32.58 29.48 2ger s HIS 55 CO 0.75 -1.70 0.80 0.27 -0.85 0.00 0.00 174.74 174.01 2ger n ASN 56 N 8.32 2.24 0.00 1.40 6.94 -1.26 -1.66 115.26 131.24 2ger n ASN 56 Ca 0.02 -1.41 0.00 0.00 -0.02 0.00 0.00 54.58 53.17 2ger n ASN 56 Cb 0.48 -0.44 0.00 0.00 -2.36 0.00 0.00 39.78 37.46 2ger n ASN 56 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 2ger n LYS 57 N 1.21 0.00 0.18 -3.83 5.02 -1.26 -4.31 118.16 115.17 2ger n LYS 57 Ca 0.00 0.00 0.06 0.00 -2.02 0.00 0.00 58.31 56.35 2ger n LYS 57 Cb 0.27 -0.94 0.55 0.00 -0.02 0.00 0.00 35.03 34.89 2ger n LYS 57 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 2ger h GLU 58 N 0.00 0.16 0.00 1.97 5.08 -1.72 -1.79 114.58 118.28 2ger h GLU 58 Ca 0.00 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2ger h GLU 58 Cb 0.94 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.16 2ger h GLU 58 CO 0.00 0.14 0.00 2.41 -1.00 0.00 0.00 179.01 180.56 2ger n THR 59 N -4.48 0.00 -0.12 1.13 -1.04 -1.23 -1.68 114.28 106.86 2ger n THR 59 Ca -0.01 1.46 0.12 0.00 -2.04 0.00 0.00 64.05 63.57 2ger n THR 59 Cb 0.11 -2.34 0.22 0.00 -1.82 0.00 0.00 70.33 66.50 2ger n THR 59 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 2ger n VAL 60 N -2.09 -0.16 0.02 12.58 0.31 -0.68 0.69 118.33 128.99 2ger n VAL 60 Ca 0.00 0.77 -0.02 0.00 -0.01 0.00 0.00 64.34 65.09 2ger n VAL 60 Cb 0.00 -1.25 -0.01 0.00 -0.91 0.00 0.00 33.84 31.67 2ger n VAL 60 CO 0.00 0.00 0.00 1.56 -1.32 0.00 0.00 176.83 177.07 2ger h GLN 61 N 0.00 -0.10 -0.25 5.55 4.20 -1.41 -3.30 115.11 119.80 2ger h GLN 61 Ca 0.32 0.01 0.07 0.00 0.06 0.00 0.00 58.65 59.10 2ger h GLN 61 Cb 0.82 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.62 2ger h GLN 61 CO -0.30 -0.07 1.04 1.25 -0.67 0.00 0.00 178.83 180.08 2ger h HIS 62 N -0.61 0.00 -3.36 2.96 2.76 0.12 -3.41 115.15 113.61 2ger h HIS 62 Ca -0.01 0.00 -0.66 0.00 -2.20 0.00 0.00 60.37 57.49 2ger h HIS 62 Cb 0.08 0.00 -0.14 0.00 1.55 0.00 0.00 27.41 28.91 2ger h HIS 62 CO 0.01 0.00 -0.64 -1.54 -1.30 0.00 0.00 177.93 174.46 2ger s SER 63 N -3.14 5.11 -0.10 3.26 1.04 -0.67 -4.64 113.70 114.56 2ger s SER 63 Ca -0.01 -0.02 0.18 0.00 0.48 0.00 0.00 55.95 56.59 2ger s SER 63 Cb 0.04 -1.33 -0.27 0.00 0.10 0.00 0.00 66.02 64.56 2ger s SER 63 CO 0.12 0.27 0.25 0.47 0.98 0.00 0.00 173.24 175.34 2ger n ASP 64 N 1.34 0.43 -3.97 7.02 8.00 0.97 -4.84 116.55 125.49 2ger n ASP 64 Ca -0.14 0.00 -0.28 0.00 0.71 0.00 0.00 54.79 55.07 2ger n ASP 64 Cb 0.53 1.44 -0.17 0.00 -0.02 0.00 0.00 41.12 42.90 2ger n ASP 64 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2ger s VAL 65 N -2.93 1.32 -0.10 2.53 1.01 -1.25 -2.88 120.40 118.11 2ger s VAL 65 Ca -0.08 -0.48 -0.03 0.00 0.00 0.00 0.00 61.98 61.38 2ger s VAL 65 Cb 0.09 -1.27 -0.03 0.00 0.00 0.00 0.00 36.38 35.16 2ger s VAL 65 CO 0.80 0.42 0.03 -0.22 0.00 0.00 0.00 175.10 176.13 2ger s LEU 66 N 1.53 3.76 -0.19 3.92 2.96 0.22 -3.10 118.68 127.79 2ger s LEU 66 Ca 0.04 0.20 -0.04 0.00 -0.22 0.00 0.00 54.13 54.11 2ger s LEU 66 Cb -0.13 -1.88 -0.02 0.00 0.50 0.00 0.00 46.19 44.66 2ger s LEU 66 CO -0.09 0.36 -0.04 -0.36 -1.32 0.00 0.00 176.35 174.90 2ger s PHE 67 N -0.78 2.97 -0.53 5.38 2.99 0.18 0.35 117.98 128.54 2ger s PHE 67 Ca 0.12 -0.64 -0.14 0.00 0.00 0.00 0.00 56.93 56.27 2ger s PHE 67 Cb -0.12 -2.04 0.13 0.00 0.00 0.00 0.00 43.02 41.00 2ger s PHE 67 CO 0.02 -0.32 0.47 -0.51 -0.00 0.00 0.00 175.22 174.88 2ger s LEU 68 N 0.99 6.07 -0.55 -0.37 1.43 -0.26 -0.34 118.68 125.65 2ger s LEU 68 Ca 0.00 -1.87 0.04 0.00 -1.03 0.00 0.00 54.13 51.28 2ger s LEU 68 Cb -0.15 -2.15 0.38 0.00 0.03 0.00 0.00 46.19 44.31 2ger s LEU 68 CO 0.01 -0.80 1.18 0.00 0.23 0.00 0.00 176.35 176.97 2ger n ALA 69 N 5.09 5.13 -2.50 4.21 0.00 -1.26 -1.02 120.51 130.16 2ger n ALA 69 Ca -0.11 -4.44 -0.24 0.00 0.00 0.00 0.00 53.44 48.65 2ger n ALA 69 Cb 0.40 -0.81 -0.11 0.00 0.00 0.00 0.00 19.45 18.94 2ger n ALA 69 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2ger s VAL 70 N -5.11 1.86 0.74 0.00 -7.23 -1.26 -3.92 120.40 105.48 2ger s VAL 70 Ca 0.48 -2.12 -0.16 0.00 -1.81 0.00 0.00 61.98 58.37 2ger s VAL 70 Cb 0.36 -2.63 -0.06 0.00 0.56 0.00 0.00 36.38 34.61 2ger s VAL 70 CO -0.19 -0.19 0.32 0.29 -0.31 0.00 0.00 175.10 175.02 2ger n LYS 71 N -0.72 0.19 0.27 4.82 5.02 -1.26 -4.43 118.16 122.05 2ger n LYS 71 Ca -0.05 0.10 0.17 0.00 -2.02 0.00 0.00 58.31 56.51 2ger n LYS 71 Cb 0.64 -1.66 0.69 0.00 -0.02 0.00 0.00 35.03 34.68 2ger n LYS 71 CO 0.00 0.00 0.00 -1.35 -0.52 0.00 0.00 177.40 175.53 2ger h PRO 72 N -0.48 0.00 0.00 1.97 0.11 -1.95 -2.68 132.00 128.97 2ger h PRO 72 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2ger h PRO 72 Cb 1.35 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.46 2ger h PRO 72 CO 0.40 0.00 -1.59 -2.39 -0.21 0.00 0.00 178.00 174.21 2ger n HIS 73 N -3.05 0.24 0.08 0.65 1.44 -1.26 -4.15 115.22 109.15 2ger n HIS 73 Ca 0.01 0.07 -0.04 0.00 -2.01 0.00 0.00 57.72 55.75 2ger n HIS 73 Cb 0.30 -0.55 -0.08 0.00 0.12 0.00 0.00 29.99 29.78 2ger n HIS 73 CO 0.00 0.00 0.00 0.82 -2.81 0.00 0.00 176.34 174.35 2ger h ILE 74 N 0.00 1.33 -0.96 0.61 2.04 -1.88 -3.32 117.51 115.34 2ger h ILE 74 Ca 0.00 -2.94 0.19 0.00 1.00 0.00 0.00 64.86 63.12 2ger h ILE 74 Cb 0.93 2.65 -0.09 0.00 -0.74 0.00 0.00 36.82 39.57 2ger h ILE 74 CO 0.00 0.76 0.61 -0.29 0.00 0.00 0.00 178.15 179.23 2ger h ILE 75 N 0.00 0.70 -0.41 -0.67 2.10 -1.64 -1.45 117.51 116.15 2ger h ILE 75 Ca -0.04 -0.21 -0.03 0.00 1.08 0.00 0.00 64.86 65.66 2ger h ILE 75 Cb 1.67 0.03 -0.02 0.00 -1.09 0.00 0.00 36.82 37.41 2ger h ILE 75 CO 0.10 0.11 0.15 -0.65 -1.08 0.00 0.00 178.15 176.78 2ger h PRO 76 N 0.62 0.62 0.00 2.19 0.11 -1.81 -2.24 132.00 131.48 2ger h PRO 76 Ca 0.53 -0.12 0.00 0.00 0.11 0.00 0.00 66.00 66.52 2ger h PRO 76 Cb 1.01 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.03 2ger h PRO 76 CO -0.28 0.60 0.00 1.19 -0.21 0.00 0.00 178.00 179.30 2ger n PHE 77 N -4.62 0.00 -0.05 0.65 3.01 -0.55 -2.68 117.46 113.22 2ger n PHE 77 Ca -0.00 0.00 -0.10 0.00 1.01 0.00 0.00 57.45 58.35 2ger n PHE 77 Cb 0.16 0.00 -0.04 0.00 -0.01 0.00 0.00 39.48 39.59 2ger n PHE 77 CO 0.00 0.00 0.00 -0.89 1.01 0.00 0.00 176.76 176.88 2ger n ILE 78 N -0.97 0.58 0.25 4.37 5.41 -1.02 -4.26 119.36 123.73 2ger n ILE 78 Ca 0.07 -0.17 0.08 0.00 1.00 0.00 0.00 62.75 63.73 2ger n ILE 78 Cb 0.03 -1.46 0.42 0.00 -0.71 0.00 0.00 39.64 37.93 2ger n ILE 78 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 2ger h LEU 79 N -0.29 0.00 -3.05 1.39 3.38 -1.19 0.86 115.31 116.40 2ger h LEU 79 Ca -0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.71 2ger h LEU 79 Cb 1.26 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.01 2ger h LEU 79 CO -0.13 0.00 0.00 0.47 0.09 0.00 0.00 178.44 178.87 2ger n ASP 80 N -2.39 3.00 -0.00 -0.43 8.00 -1.20 -2.00 116.55 121.52 2ger n ASP 80 Ca -0.01 -2.54 0.01 0.00 0.71 0.00 0.00 54.79 52.96 2ger n ASP 80 Cb 0.50 -0.33 -0.02 0.00 -0.02 0.00 0.00 41.12 41.26 2ger n ASP 80 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02 2ger n GLU 81 N -0.35 0.50 0.00 -1.24 2.13 0.28 -4.74 120.64 117.23 2ger n GLU 81 Ca 0.14 -0.02 0.00 0.00 0.66 0.00 0.00 57.16 57.94 2ger n GLU 81 Cb 0.59 -1.05 0.00 0.00 0.27 0.00 0.00 31.44 31.26 2ger n GLU 81 CO 0.00 0.00 0.00 -0.89 -0.41 0.00 0.00 177.13 175.83 2ger n ILE 82 N -1.63 0.00 -0.32 6.31 5.41 -0.37 -4.75 119.36 124.01 2ger n ILE 82 Ca -0.01 -0.22 0.12 0.00 1.00 0.00 0.00 62.75 63.64 2ger n ILE 82 Cb 0.11 0.92 0.24 0.00 -0.71 0.00 0.00 39.64 40.20 2ger n ILE 82 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2ger n GLY 83 N 0.56 -1.30 0.29 7.39 0.00 -0.85 0.37 105.19 111.66 2ger n GLY 83 Ca 0.00 0.91 -0.11 0.00 0.00 0.00 0.00 46.02 46.82 2ger n GLY 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ger h ALA 84 N 1.82 -1.09 0.00 4.61 0.00 -1.86 -2.63 119.26 120.11 2ger h ALA 84 Ca 0.53 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.30 2ger h ALA 84 Cb 1.04 0.41 0.00 0.00 0.00 0.00 0.00 17.79 19.24 2ger h ALA 84 CO -0.87 -1.07 0.00 -0.25 0.00 0.00 0.00 179.25 177.05 2ger n ASP 85 N -4.09 0.00 -4.35 0.00 10.43 0.16 -4.60 116.55 114.10 2ger n ASP 85 Ca -0.08 0.00 -0.44 0.00 2.57 0.00 0.00 54.79 56.84 2ger n ASP 85 Cb 0.28 0.00 -0.08 0.00 1.84 0.00 0.00 41.12 43.16 2ger n ASP 85 CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 2ger s ILE 86 N -1.19 5.01 0.44 0.53 1.01 -0.73 -4.84 121.20 121.43 2ger s ILE 86 Ca 0.00 -1.21 -0.07 0.00 0.00 0.00 0.00 60.65 59.37 2ger s ILE 86 Cb 0.00 -4.04 0.11 0.00 0.01 0.00 0.00 42.46 38.53 2ger s ILE 86 CO 0.00 -0.61 0.46 -0.62 0.00 0.00 0.00 174.94 174.18 2ger n GLU 87 N 5.15 -1.29 0.00 2.79 1.02 -1.26 -4.94 120.64 122.10 2ger n GLU 87 Ca -0.12 -0.73 0.08 0.00 -0.02 0.00 0.00 57.16 56.37 2ger n GLU 87 Cb 0.43 -0.60 -0.00 0.00 -0.02 0.00 0.00 31.44 31.25 2ger n GLU 87 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 2ger n ASP 88 N -3.57 1.60 0.07 1.62 -0.08 -1.26 -4.39 116.55 110.55 2ger n ASP 88 Ca 0.06 -1.30 -0.02 0.00 -1.51 0.00 0.00 54.79 52.02 2ger n ASP 88 Cb 0.23 0.47 0.22 0.00 2.34 0.00 0.00 41.12 44.38 2ger n ASP 88 CO 0.00 0.00 0.00 0.08 0.12 0.00 0.00 177.20 177.40 2ger h ARG 89 N 1.75 0.31 -6.16 -0.67 0.11 -1.94 -3.46 114.38 104.33 2ger h ARG 89 Ca 0.00 -0.14 -0.50 0.00 0.10 0.00 0.00 59.98 59.44 2ger h ARG 89 Cb 0.54 -0.01 -0.03 0.00 1.11 0.00 0.00 29.97 31.58 2ger h ARG 89 CO 0.00 0.63 -0.47 -3.38 0.10 0.00 0.00 179.97 176.85 2ger s HIS 90 N -4.25 3.36 0.12 4.08 -3.43 -1.25 -4.95 115.29 108.96 2ger s HIS 90 Ca -0.05 -0.00 0.05 0.00 -0.80 0.00 0.00 55.06 54.25 2ger s HIS 90 Cb 0.13 -1.55 -0.04 0.00 -1.43 0.00 0.00 32.58 29.69 2ger s HIS 90 CO 0.78 0.48 0.06 0.42 -2.00 0.00 0.00 174.74 174.49 2ger s ILE 91 N -1.92 4.27 -0.20 -5.38 1.09 -1.14 -4.58 121.20 113.34 2ger s ILE 91 Ca 0.34 -1.01 -0.02 0.00 -1.10 0.00 0.00 60.65 58.86 2ger s ILE 91 Cb -0.09 -3.10 0.00 0.00 -1.06 0.00 0.00 42.46 38.21 2ger s ILE 91 CO 0.27 0.02 -0.11 -0.69 -0.10 0.00 0.00 174.94 174.34 2ger s VAL 92 N -1.52 2.86 -0.29 2.92 1.01 0.23 0.70 120.40 126.30 2ger s VAL 92 Ca 0.29 -0.67 -0.06 0.00 0.00 0.00 0.00 61.98 61.54 2ger s VAL 92 Cb -0.11 -2.27 0.01 0.00 0.00 0.00 0.00 36.38 34.02 2ger s VAL 92 CO 0.21 0.47 0.06 -0.69 0.00 0.00 0.00 175.10 175.15 2ger s VAL 93 N 1.37 3.79 -0.20 2.92 1.01 0.16 0.76 120.40 130.21 2ger s VAL 93 Ca 0.05 -0.75 -0.10 0.00 0.00 0.00 0.00 61.98 61.18 2ger s VAL 93 Cb -0.14 -2.95 -0.05 0.00 0.00 0.00 0.00 36.38 33.24 2ger s VAL 93 CO -0.07 0.10 0.13 -0.55 0.00 0.00 0.00 175.10 174.71 2ger s SER 94 N 1.47 6.20 0.00 3.32 0.15 -0.20 -1.10 113.70 123.54 2ger s SER 94 Ca 0.02 0.23 0.05 0.00 0.70 0.00 0.00 55.95 56.96 2ger s SER 94 Cb -0.17 -2.09 -0.00 0.00 -1.71 0.00 0.00 66.02 62.05 2ger s SER 94 CO 0.01 0.19 0.46 0.00 1.20 0.00 0.00 173.24 175.09 2ger n ALA 96 N -0.37 -1.70 -1.75 0.00 0.00 -1.23 -4.78 120.51 110.66 2ger n ALA 96 Ca 0.02 0.46 -0.37 0.00 0.00 0.00 0.00 53.44 53.55 2ger n ALA 96 Cb 0.11 -1.86 0.03 0.00 0.00 0.00 0.00 19.45 17.73 2ger n ALA 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2ger s ALA 97 N -0.62 2.72 0.00 0.00 0.00 -1.26 -3.71 121.76 118.89 2ger s ALA 97 Ca 0.69 1.11 0.00 0.00 0.00 0.00 0.00 51.96 53.77 2ger s ALA 97 Cb -0.90 -3.48 0.00 0.00 0.00 0.00 0.00 23.12 18.74 2ger s ALA 97 CO 0.56 -1.15 0.00 0.41 0.00 0.00 0.00 175.76 175.58 2ger n GLY 98 N 0.59 0.00 3.66 0.00 0.00 -1.26 -4.78 105.19 103.40 2ger n GLY 98 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 2ger n GLY 98 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ger s VAL 99 N 0.00 3.25 0.46 1.61 1.01 -1.24 -4.72 120.40 120.76 2ger s VAL 99 Ca 0.00 0.32 -0.22 0.00 0.00 0.00 0.00 61.98 62.08 2ger s VAL 99 Cb 0.00 -3.21 -0.08 0.00 0.00 0.00 0.00 36.38 33.09 2ger s VAL 99 CO 0.00 -0.03 1.06 -0.89 0.00 0.00 0.00 175.10 175.24 2ger s THR 100 N 4.20 3.66 0.00 3.92 2.01 -1.26 -4.94 115.64 123.24 2ger s THR 100 Ca 0.82 1.12 0.00 0.00 0.31 0.00 0.00 61.69 63.94 2ger s THR 100 Cb -0.39 -3.50 0.00 0.00 0.01 0.00 0.00 72.50 68.62 2ger s THR 100 CO 0.36 -0.14 0.99 -0.38 -0.69 0.00 0.00 174.62 174.76 2ger n ILE 101 N -0.68 0.00 0.00 1.82 5.41 -1.26 -2.25 119.36 122.39 2ger n ILE 101 Ca 0.08 1.49 0.00 0.00 1.00 0.00 0.00 62.75 65.32 2ger n ILE 101 Cb 0.51 -2.35 0.00 0.00 -0.71 0.00 0.00 39.64 37.09 2ger n ILE 101 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 176.55 176.31 2ger n SER 102 N -2.23 0.00 -0.19 4.38 2.88 -1.26 0.23 113.62 117.43 2ger n SER 102 Ca 0.00 0.17 0.12 0.00 -1.33 0.00 0.00 58.87 57.83 2ger n SER 102 Cb 0.00 -0.02 0.23 0.00 -0.75 0.00 0.00 64.21 63.67 2ger n SER 102 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2ger n SER 103 N -0.87 0.03 0.00 -3.46 3.41 -1.18 0.15 113.62 111.69 2ger n SER 103 Ca 0.00 0.96 0.00 0.00 -0.26 0.00 0.00 58.87 59.57 2ger n SER 103 Cb 0.00 -0.39 0.00 0.00 -0.26 0.00 0.00 64.21 63.56 2ger n SER 103 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 2ger n ILE 104 N -4.57 0.00 0.00 -1.33 2.08 0.64 -4.06 119.36 112.12 2ger n ILE 104 Ca 0.16 0.92 0.00 0.00 0.56 0.00 0.00 62.75 64.39 2ger n ILE 104 Cb 0.54 -1.76 0.00 0.00 -0.75 0.00 0.00 39.64 37.68 2ger n ILE 104 CO 0.00 0.00 0.00 -0.62 0.56 0.00 0.00 176.55 176.49 2ger n GLU 105 N -1.29 0.00 -0.39 0.38 1.02 0.74 -1.26 120.64 119.84 2ger n GLU 105 Ca 0.00 0.34 -0.18 0.00 -0.02 0.00 0.00 57.16 57.30 2ger n GLU 105 Cb 0.00 -0.73 -0.05 0.00 -0.02 0.00 0.00 31.44 30.64 2ger n GLU 105 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2ger n LYS 106 N -0.78 0.00 0.00 3.49 5.02 0.12 0.15 118.16 126.17 2ger n LYS 106 Ca 0.00 -0.59 0.00 0.00 -2.02 0.00 0.00 58.31 55.70 2ger n LYS 106 Cb 0.00 -1.97 0.00 0.00 -0.02 0.00 0.00 35.03 33.04 2ger n LYS 106 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 2ger n LYS 107 N 5.76 0.00 0.02 1.97 0.00 -1.11 -4.74 118.16 120.06 2ger n LYS 107 Ca 0.19 0.00 0.11 0.00 0.00 0.00 0.00 58.31 58.61 2ger n LYS 107 Cb 0.20 0.00 -0.07 0.00 0.00 0.00 0.00 35.03 35.16 2ger n LYS 107 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.40 177.29 2ger n LEU 108 N 0.00 0.47 0.05 3.14 7.94 0.40 -3.85 117.00 125.15 2ger n LEU 108 Ca 0.00 -0.05 0.13 0.00 -1.11 0.00 0.00 56.01 54.99 2ger n LEU 108 Cb 0.00 -0.04 0.47 0.00 0.53 0.00 0.00 43.42 44.38 2ger n LEU 108 CO 0.00 0.03 0.85 -1.54 -1.11 0.00 0.00 177.39 175.62 2ger n SER 109 N -2.09 0.41 -1.22 1.96 3.41 0.63 -3.49 113.62 113.23 2ger n SER 109 Ca -0.00 0.44 0.00 0.00 -0.26 0.00 0.00 58.87 59.05 2ger n SER 109 Cb 0.48 -0.51 0.00 0.00 -0.26 0.00 0.00 64.21 63.93 2ger n SER 109 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ger n ALA 110 N -1.64 2.31 -1.67 7.33 0.00 -1.25 -1.33 120.51 124.26 2ger n ALA 110 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.50 2ger n ALA 110 Cb 0.38 -1.13 0.00 0.00 0.00 0.00 0.00 19.45 18.70 2ger n ALA 110 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2ger n PHE 111 N 1.02 0.00 -3.60 0.00 3.01 -1.23 -4.92 117.46 111.75 2ger n PHE 111 Ca 0.00 0.00 -0.02 0.00 1.01 0.00 0.00 57.45 58.44 2ger n PHE 111 Cb 0.28 0.08 -0.06 0.00 -0.01 0.00 0.00 39.48 39.77 2ger n PHE 111 CO 0.00 0.00 0.00 0.50 1.01 0.00 0.00 176.76 178.27 2ger s ARG 112 N 0.00 0.37 0.21 -1.08 6.06 -0.44 -4.82 118.95 119.24 2ger s ARG 112 Ca 0.00 0.69 -0.17 0.00 -2.50 0.00 0.00 55.73 53.75 2ger s ARG 112 Cb 0.00 0.16 0.20 0.00 0.06 0.00 0.00 34.95 35.37 2ger s ARG 112 CO 0.00 -0.09 1.59 -1.35 -2.50 0.00 0.00 175.30 172.96 2ger h PRO 113 N 6.39 -0.09 -2.44 5.12 0.11 -1.96 -3.37 132.00 135.76 2ger h PRO 113 Ca -0.25 0.01 -0.50 0.00 0.11 0.00 0.00 66.00 65.36 2ger h PRO 113 Cb 1.18 0.02 -0.37 0.00 0.11 0.00 0.00 31.00 31.94 2ger h PRO 113 CO 0.17 -0.06 -0.78 0.00 -0.21 0.00 0.00 178.00 177.12 2ger s ALA 114 N -6.10 0.45 0.53 -0.75 0.00 -1.26 -5.04 121.76 109.59 2ger s ALA 114 Ca -0.14 -1.41 -0.16 0.00 0.00 0.00 0.00 51.96 50.25 2ger s ALA 114 Cb 0.18 -1.68 -0.07 0.00 0.00 0.00 0.00 23.12 21.55 2ger s ALA 114 CO 0.72 -2.01 1.00 -1.25 0.00 0.00 0.00 175.76 174.21 2ger s PRO 115 N 1.43 3.85 -0.31 0.00 0.04 -1.26 -5.00 135.00 133.75 2ger s PRO 115 Ca 0.16 0.96 -0.06 0.00 0.04 0.00 0.00 61.00 62.10 2ger s PRO 115 Cb -0.19 -2.12 0.03 0.00 0.04 0.00 0.00 34.50 32.25 2ger s PRO 115 CO -0.09 -0.35 0.08 1.03 0.04 0.00 0.00 177.00 177.71 2ger s ARG 116 N -4.16 2.80 0.01 4.56 0.52 -1.25 -4.28 118.95 117.15 2ger s ARG 116 Ca 0.59 -1.05 0.01 0.00 -0.52 0.00 0.00 55.73 54.76 2ger s ARG 116 Cb -0.11 -3.38 -0.01 0.00 0.52 0.00 0.00 34.95 31.98 2ger s ARG 116 CO 0.34 -0.56 -0.03 0.54 0.02 0.00 0.00 175.30 175.61 2ger s VAL 117 N 1.43 0.18 -0.05 3.52 0.11 -1.26 -0.60 120.40 123.72 2ger s VAL 117 Ca -0.00 -0.32 0.03 0.00 -2.93 0.00 0.00 61.98 58.76 2ger s VAL 117 Cb -0.18 -0.20 0.00 0.00 -1.53 0.00 0.00 36.38 34.47 2ger s VAL 117 CO 0.02 -0.09 -0.14 0.27 -3.33 0.00 0.00 175.10 171.83 2ger s ILE 118 N -0.41 1.20 0.11 7.04 -4.36 0.23 -0.80 121.20 124.21 2ger s ILE 118 Ca -0.03 -0.56 -0.23 0.00 -0.26 0.00 0.00 60.65 59.57 2ger s ILE 118 Cb -0.03 -1.06 -0.07 0.00 1.25 0.00 0.00 42.46 42.55 2ger s ILE 118 CO -0.00 0.36 0.69 -0.60 0.24 0.00 0.00 174.94 175.62 2ger s ARG 119 N 0.29 4.41 0.07 0.37 3.52 -0.30 -1.04 118.95 126.27 2ger s ARG 119 Ca -0.08 0.97 0.06 0.00 -0.13 0.00 0.00 55.73 56.55 2ger s ARG 119 Cb -0.12 -3.26 -0.03 0.00 -1.56 0.00 0.00 34.95 29.97 2ger s ARG 119 CO 0.02 0.57 -0.15 0.00 -0.81 0.00 0.00 175.30 174.93 2ger s MET 121 N -1.73 0.15 0.24 0.00 1.75 0.51 -4.32 119.30 115.90 2ger s MET 121 Ca -0.01 -0.10 0.01 0.00 -1.25 0.00 0.00 55.69 54.35 2ger s MET 121 Cb -0.10 -1.76 -0.04 0.00 2.84 0.00 0.00 34.83 35.77 2ger s MET 121 CO 0.02 -0.63 0.16 0.99 -0.65 0.00 0.00 175.02 174.91 2ger s THR 122 N 2.10 0.08 0.14 10.11 2.01 -1.26 -0.47 115.64 128.36 2ger s THR 122 Ca 0.02 -2.00 0.04 0.00 0.31 0.00 0.00 61.69 60.06 2ger s THR 122 Cb -0.16 -2.51 -0.04 0.00 0.01 0.00 0.00 72.50 69.80 2ger s THR 122 CO -0.08 0.00 -0.10 0.54 -0.69 0.00 0.00 174.62 174.29 2ger s ASN 123 N -3.24 1.77 0.30 3.53 6.03 -1.25 -4.81 114.94 117.27 2ger s ASN 123 Ca 0.39 -1.01 0.05 0.00 -1.03 0.00 0.00 52.86 51.26 2ger s ASN 123 Cb 0.06 -0.01 0.78 0.00 -3.03 0.00 0.00 41.25 39.05 2ger s ASN 123 CO 0.16 -0.33 1.66 0.71 -2.03 0.00 0.00 177.10 177.27 2ger h THR 124 N 2.80 0.34 0.00 0.54 1.35 -1.93 -2.47 112.91 113.54 2ger h THR 124 Ca -0.37 -0.09 0.00 0.00 -0.55 0.00 0.00 66.41 65.41 2ger h THR 124 Cb 1.19 0.05 0.00 0.00 -1.73 0.00 0.00 68.15 67.66 2ger h THR 124 CO 0.63 0.05 0.12 -0.81 -0.25 0.00 0.00 175.52 175.26 2ger n PRO 125 N -5.17 0.00 -0.20 4.72 -0.04 -1.26 -0.18 135.00 132.87 2ger n PRO 125 Ca 0.23 0.09 0.01 0.00 -0.04 0.00 0.00 63.50 63.79 2ger n PRO 125 Cb 0.73 -1.62 0.25 0.00 -0.04 0.00 0.00 33.50 32.82 2ger n PRO 125 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2ger h VAL 126 N 0.00 1.19 0.00 0.52 2.07 -1.70 -2.23 116.25 116.10 2ger h VAL 126 Ca 0.00 -0.36 0.00 0.00 0.82 0.00 0.00 66.70 67.16 2ger h VAL 126 Cb 0.24 0.13 0.00 0.00 -1.52 0.00 0.00 31.29 30.13 2ger h VAL 126 CO 0.00 0.19 0.27 0.52 0.02 0.00 0.00 177.57 178.57 2ger n VAL 127 N -4.42 0.53 0.00 2.57 0.31 0.75 -2.90 118.33 115.18 2ger n VAL 127 Ca 0.08 0.41 0.00 0.00 -0.01 0.00 0.00 64.34 64.81 2ger n VAL 127 Cb 0.04 -1.41 0.00 0.00 -0.91 0.00 0.00 33.84 31.56 2ger n VAL 127 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 2ger n VAL 128 N -1.07 0.00 -0.69 2.52 0.31 -0.86 -4.30 118.33 114.24 2ger n VAL 128 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 2ger n VAL 128 Cb 0.27 -0.25 0.00 0.00 -0.91 0.00 0.00 33.84 32.95 2ger n VAL 128 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 2ger n ARG 129 N -0.40 0.00 -0.61 5.55 0.63 -1.14 -4.81 116.66 115.88 2ger n ARG 129 Ca 0.00 0.00 0.06 0.00 -0.92 0.00 0.00 57.85 56.99 2ger n ARG 129 Cb 0.00 0.00 0.19 0.00 0.45 0.00 0.00 32.46 33.10 2ger n ARG 129 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 2ger n GLU 130 N 0.00 1.48 -1.28 -0.14 -0.58 -1.09 -3.09 120.64 115.94 2ger n GLU 130 Ca 0.00 -3.18 -0.30 0.00 -0.42 0.00 0.00 57.16 53.26 2ger n GLU 130 Cb 0.11 -1.52 0.12 0.00 -0.57 0.00 0.00 31.44 29.58 2ger n GLU 130 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 2ger s GLY 131 N -3.14 1.63 -0.27 0.62 0.00 -1.11 -4.65 107.32 100.39 2ger s GLY 131 Ca 0.37 -0.05 0.00 0.00 0.00 0.00 0.00 44.72 45.04 2ger s GLY 131 CO -0.07 0.41 -0.06 0.00 0.00 0.00 0.00 173.10 173.38 2ger s ALA 132 N -2.97 2.69 0.02 3.20 0.00 -1.26 -2.70 121.76 120.73 2ger s ALA 132 Ca 0.63 -1.70 0.04 0.00 0.00 0.00 0.00 51.96 50.92 2ger s ALA 132 Cb -0.17 -1.75 -0.03 0.00 0.00 0.00 0.00 23.12 21.16 2ger s ALA 132 CO 0.56 -1.15 -0.09 0.99 0.00 0.00 0.00 175.76 176.07 2ger s THR 133 N 1.21 3.47 0.07 0.00 2.01 0.53 -3.82 115.64 119.11 2ger s THR 133 Ca -0.06 -0.88 0.00 0.00 0.31 0.00 0.00 61.69 61.07 2ger s THR 133 Cb -0.19 -2.51 -0.04 0.00 0.01 0.00 0.00 72.50 69.77 2ger s THR 133 CO -0.03 0.37 -0.05 -0.69 -0.69 0.00 0.00 174.62 173.53 2ger s VAL 134 N -0.99 0.44 0.11 3.82 1.01 0.38 -3.30 120.40 121.87 2ger s VAL 134 Ca 0.17 -1.76 -0.25 0.00 0.00 0.00 0.00 61.98 60.14 2ger s VAL 134 Cb -0.11 -1.45 0.08 0.00 0.00 0.00 0.00 36.38 34.90 2ger s VAL 134 CO 0.07 -0.87 0.66 -0.72 0.00 0.00 0.00 175.10 174.24 2ger s TYR 135 N -3.47 -0.52 -0.02 5.22 -0.85 -0.68 -0.37 117.35 116.66 2ger s TYR 135 Ca 0.06 0.39 0.02 0.00 -0.52 0.00 0.00 57.07 57.03 2ger s TYR 135 Cb 0.04 0.54 0.01 0.00 0.38 0.00 0.00 41.96 42.93 2ger s TYR 135 CO -0.07 -0.77 -0.06 0.00 -1.52 0.00 0.00 175.55 173.13 2ger s ALA 136 N -3.38 0.66 0.23 9.51 0.00 -0.38 -0.77 121.76 127.63 2ger s ALA 136 Ca 0.00 -0.21 -0.30 0.00 0.00 0.00 0.00 51.96 51.45 2ger s ALA 136 Cb -0.01 -0.28 -0.09 0.00 0.00 0.00 0.00 23.12 22.75 2ger s ALA 136 CO -0.10 0.09 1.05 0.95 0.00 0.00 0.00 175.76 177.75 2ger s THR 137 N 0.28 3.84 0.00 0.00 -4.23 -1.26 -1.16 115.64 113.11 2ger s THR 137 Ca -0.04 1.74 0.00 0.00 -1.18 0.00 0.00 61.69 62.21 2ger s THR 137 Cb -0.08 -4.11 0.00 0.00 1.34 0.00 0.00 72.50 69.65 2ger s THR 137 CO 0.00 0.37 0.00 0.61 -0.54 0.00 0.00 174.62 175.06 2ger n GLY 138 N 1.61 -2.32 0.13 3.99 0.00 0.02 -4.93 105.19 103.68 2ger n GLY 138 Ca 0.00 -1.44 -0.22 0.00 0.00 0.00 0.00 46.02 44.36 2ger n GLY 138 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2ger h THR 139 N -1.20 0.84 -1.31 2.61 1.35 -1.91 -3.37 112.91 109.92 2ger h THR 139 Ca 0.00 -2.36 -0.75 0.00 -0.55 0.00 0.00 66.41 62.75 2ger h THR 139 Cb 0.00 2.57 -0.14 0.00 -1.73 0.00 0.00 68.15 68.84 2ger h THR 139 CO 0.00 0.75 2.22 1.41 -0.25 0.00 0.00 175.52 179.65 2ger n HIS 140 N -3.77 2.63 -3.75 4.73 8.25 -1.26 -4.87 115.22 117.18 2ger n HIS 140 Ca -0.29 -2.79 -0.28 0.00 -0.26 0.00 0.00 57.72 54.11 2ger n HIS 140 Cb 0.96 -1.75 -0.16 0.00 1.12 0.00 0.00 29.99 30.15 2ger n HIS 140 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2ger s ALA 141 N -1.58 1.05 0.81 -1.41 0.00 -1.26 -3.89 121.76 115.48 2ger s ALA 141 Ca 0.52 -0.72 -0.11 0.00 0.00 0.00 0.00 51.96 51.65 2ger s ALA 141 Cb 0.18 -1.18 0.08 0.00 0.00 0.00 0.00 23.12 22.20 2ger s ALA 141 CO -0.10 -1.15 1.09 -0.65 0.00 0.00 0.00 175.76 174.94 2ger s GLN 142 N 1.84 2.00 -0.01 0.00 -0.21 -1.26 -4.89 119.66 117.12 2ger s GLN 142 Ca -0.01 0.90 0.02 0.00 0.02 0.00 0.00 55.36 56.29 2ger s GLN 142 Cb -0.17 -1.89 0.08 0.00 1.00 0.00 0.00 33.01 32.04 2ger s GLN 142 CO -0.08 -1.75 0.84 0.28 -2.12 0.00 0.00 175.29 172.46 2ger n VAL 143 N -3.56 0.22 0.68 1.09 0.31 -1.26 -2.75 118.33 113.06 2ger n VAL 143 Ca 0.08 -0.14 0.07 0.00 -0.01 0.00 0.00 64.34 64.34 2ger n VAL 143 Cb 0.55 -0.23 -0.07 0.00 -0.91 0.00 0.00 33.84 33.18 2ger n VAL 143 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2ger n GLU 144 N -0.08 2.20 -0.05 5.55 4.71 -1.26 -4.00 120.64 127.71 2ger n GLU 144 Ca 0.03 -0.10 -0.21 0.00 -0.01 0.00 0.00 57.16 56.87 2ger n GLU 144 Cb 0.22 -1.19 -0.13 0.00 -1.01 0.00 0.00 31.44 29.34 2ger n GLU 144 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 2ger n ASP 145 N -1.18 2.05 0.00 1.62 8.00 -1.11 -2.85 116.55 123.07 2ger n ASP 145 Ca 0.03 0.18 0.09 0.00 0.71 0.00 0.00 54.79 55.80 2ger n ASP 145 Cb 0.24 -0.79 0.45 0.00 -0.02 0.00 0.00 41.12 41.00 2ger n ASP 145 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2ger n GLY 146 N 1.92 -0.86 0.12 0.44 0.00 -1.23 -0.83 105.19 104.74 2ger n GLY 146 Ca -0.36 -0.09 -0.24 0.00 0.00 0.00 0.00 46.02 45.33 2ger n GLY 146 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2ger n ARG 147 N -1.27 0.57 -0.22 1.61 0.63 -1.25 -2.63 116.66 114.11 2ger n ARG 147 Ca 0.09 0.47 -0.04 0.00 -0.92 0.00 0.00 57.85 57.45 2ger n ARG 147 Cb 0.14 -1.66 0.06 0.00 0.45 0.00 0.00 32.46 31.45 2ger n ARG 147 CO 0.00 0.00 0.00 1.25 -2.51 0.00 0.00 177.63 176.37 2ger h LEU 148 N -1.00 0.63 0.27 6.15 6.46 -1.30 0.21 115.31 126.73 2ger h LEU 148 Ca -0.46 0.00 -0.01 0.00 -0.12 0.00 0.00 57.88 57.30 2ger h LEU 148 Cb 1.39 -0.13 -0.00 0.00 -0.73 0.00 0.00 40.66 41.19 2ger h LEU 148 CO -0.28 0.44 -0.17 -0.03 -0.62 0.00 0.00 178.44 177.79 2ger h MET 149 N 0.76 -0.39 -1.21 1.25 4.05 -1.16 1.90 114.93 120.14 2ger h MET 149 Ca 0.26 0.03 0.35 0.00 -0.28 0.00 0.00 59.70 60.05 2ger h MET 149 Cb 0.03 0.09 -0.05 0.00 -0.80 0.00 0.00 31.60 30.87 2ger h MET 149 CO -0.11 -0.26 0.91 1.49 0.23 0.00 0.00 176.91 179.18 2ger h GLU 150 N -0.41 0.00 0.04 0.39 4.22 -1.31 0.50 114.58 118.02 2ger h GLU 150 Ca -0.04 0.00 -0.35 0.00 0.08 0.00 0.00 59.36 59.06 2ger h GLU 150 Cb 0.32 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.53 2ger h GLU 150 CO 0.04 0.00 -2.05 0.94 -2.18 0.00 0.00 179.01 175.76 2ger n GLN 151 N -4.04 0.69 0.18 1.92 7.27 0.73 -3.21 117.38 120.91 2ger n GLN 151 Ca 0.26 0.21 0.04 0.00 0.07 0.00 0.00 57.00 57.58 2ger n GLN 151 Cb 1.31 -1.67 0.47 0.00 2.41 0.00 0.00 30.24 32.75 2ger n GLN 151 CO 0.00 0.00 0.00 1.25 0.07 0.00 0.00 177.06 178.38 2ger h LEU 152 N 0.02 0.10 0.09 1.69 5.85 0.51 -3.16 115.31 120.41 2ger h LEU 152 Ca -0.42 -0.02 -0.33 0.00 0.84 0.00 0.00 57.88 57.95 2ger h LEU 152 Cb 2.05 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 43.03 2ger h LEU 152 CO 0.05 0.25 -1.81 -0.07 -0.34 0.00 0.00 178.44 176.51 2ger h LEU 153 N 0.10 0.30 -1.07 2.25 3.38 -1.34 -3.29 115.31 115.64 2ger h LEU 153 Ca 0.02 -0.60 0.00 0.00 0.09 0.00 0.00 57.88 57.39 2ger h LEU 153 Cb 0.30 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.95 2ger h LEU 153 CO 0.02 1.53 0.07 -1.20 0.09 0.00 0.00 178.44 178.95 2ger n SER 154 N -3.35 0.42 -0.24 -0.43 7.64 -1.20 0.13 113.62 116.59 2ger n SER 154 Ca -0.24 0.67 -0.05 0.00 1.01 0.00 0.00 58.87 60.25 2ger n SER 154 Cb 1.05 -0.70 0.10 0.00 -1.01 0.00 0.00 64.21 63.65 2ger n SER 154 CO 0.00 0.00 0.00 -1.28 -3.01 0.00 0.00 175.04 170.75 2ger h SER 155 N 0.00 1.01 -0.17 6.43 0.87 -1.62 -3.24 113.55 116.84 2ger h SER 155 Ca 0.00 -0.18 0.00 0.00 -1.23 0.00 0.00 61.79 60.38 2ger h SER 155 Cb 0.14 -0.26 0.00 0.00 -0.44 0.00 0.00 62.40 61.84 2ger h SER 155 CO 0.00 0.93 0.00 0.52 -0.53 0.00 0.00 176.83 177.75 2ger n VAL 156 N -4.26 1.20 0.00 2.23 0.31 0.35 -4.88 118.33 113.28 2ger n VAL 156 Ca 0.06 -1.19 0.00 0.00 -0.01 0.00 0.00 64.34 63.19 2ger n VAL 156 Cb 0.22 0.36 0.00 0.00 -0.91 0.00 0.00 33.84 33.51 2ger n VAL 156 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2ger n GLY 157 N -0.16 -0.64 2.87 2.92 0.00 -0.59 -3.04 105.19 106.54 2ger n GLY 157 Ca 0.08 0.53 -0.14 0.00 0.00 0.00 0.00 46.02 46.49 2ger n GLY 157 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2ger s PHE 158 N 0.00 0.16 0.17 1.61 5.36 -1.10 -4.75 117.98 119.42 2ger s PHE 158 Ca 0.00 -0.00 0.04 0.00 -0.96 0.00 0.00 56.93 56.00 2ger s PHE 158 Cb 0.00 -0.16 -0.05 0.00 -0.34 0.00 0.00 43.02 42.47 2ger s PHE 158 CO 0.00 -0.03 -0.06 0.00 -1.46 0.00 0.00 175.22 173.66 2ger s THR 160 N -3.42 0.00 0.32 0.00 2.01 -1.21 -5.00 115.64 108.34 2ger s THR 160 Ca 0.20 0.00 -0.22 0.00 0.31 0.00 0.00 61.69 61.98 2ger s THR 160 Cb 0.04 -1.00 -0.10 0.00 0.01 0.00 0.00 72.50 71.45 2ger s THR 160 CO 0.02 0.00 0.86 -1.61 -0.69 0.00 0.00 174.62 173.20 2ger s GLU 161 N -1.09 4.35 -0.18 4.92 2.02 -1.26 -1.69 118.70 125.77 2ger s GLU 161 Ca 0.07 1.08 -0.16 0.00 0.02 0.00 0.00 54.97 55.99 2ger s GLU 161 Cb -0.01 -2.64 0.05 0.00 0.10 0.00 0.00 34.13 31.63 2ger s GLU 161 CO -0.06 0.23 0.48 0.08 0.02 0.00 0.00 175.26 176.00 2ger s VAL 162 N -1.76 -0.00 -0.24 2.63 1.01 0.05 -4.88 120.40 117.21 2ger s VAL 162 Ca 0.51 0.01 -0.29 0.00 0.00 0.00 0.00 61.98 62.22 2ger s VAL 162 Cb -0.15 -0.67 -0.03 0.00 0.00 0.00 0.00 36.38 35.53 2ger s VAL 162 CO 0.20 0.00 1.81 -1.61 0.00 0.00 0.00 175.10 175.50 2ger s GLU 163 N 0.44 3.55 0.00 2.72 2.02 -1.26 -4.08 118.70 122.09 2ger s GLU 163 Ca -0.02 1.73 0.00 0.00 0.02 0.00 0.00 54.97 56.70 2ger s GLU 163 Cb -0.04 -4.16 0.00 0.00 0.10 0.00 0.00 34.13 30.03 2ger s GLU 163 CO -0.02 -1.60 0.00 -1.91 0.02 0.00 0.00 175.26 171.76 2ger n GLU 164 N 8.10 0.00 -0.32 1.61 2.13 -1.26 -0.79 120.64 130.11 2ger n GLU 164 Ca 0.22 0.00 0.19 0.00 0.66 0.00 0.00 57.16 58.24 2ger n GLU 164 Cb 0.45 0.00 0.40 0.00 0.27 0.00 0.00 31.44 32.57 2ger n GLU 164 CO 0.00 0.00 0.00 0.38 -0.41 0.00 0.00 177.13 177.10 2ger h ASP 165 N 0.00 0.40 0.31 4.31 -0.00 -2.03 0.53 116.42 119.94 2ger h ASP 165 Ca 0.00 0.18 -0.04 0.00 -0.00 0.00 0.00 57.03 57.18 2ger h ASP 165 Cb 0.00 0.15 -0.01 0.00 -0.00 0.00 0.00 39.33 39.48 2ger h ASP 165 CO 0.00 -0.10 -0.18 -0.07 -0.00 0.00 0.00 179.24 178.90 2ger h LEU 166 N 0.34 0.00 -2.40 0.15 3.38 -1.33 -3.08 115.31 112.37 2ger h LEU 166 Ca 0.66 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.63 2ger h LEU 166 Cb 1.42 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.17 2ger h LEU 166 CO -0.59 0.18 0.06 0.40 0.09 0.00 0.00 178.44 178.57 2ger h ILE 167 N 0.00 0.00 -0.01 1.22 2.04 -0.07 -0.53 117.51 120.16 2ger h ILE 167 Ca -0.00 0.00 -0.25 0.00 1.00 0.00 0.00 64.86 65.61 2ger h ILE 167 Cb 0.38 0.80 0.01 0.00 -0.74 0.00 0.00 36.82 37.27 2ger h ILE 167 CO 0.02 0.00 -0.99 0.44 0.00 0.00 0.00 178.15 177.62 2ger h ASP 168 N 0.00 0.77 0.26 1.72 3.32 -1.67 -2.49 116.42 118.32 2ger h ASP 168 Ca 0.00 -0.61 -0.01 0.00 0.02 0.00 0.00 57.03 56.43 2ger h ASP 168 Cb 0.11 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.43 2ger h ASP 168 CO 0.00 1.41 -0.13 0.00 -1.72 0.00 0.00 179.24 178.80 2ger h ALA 169 N 0.54 -0.35 -0.83 3.45 0.00 -1.34 -3.17 119.26 117.55 2ger h ALA 169 Ca -0.11 -0.18 0.21 0.00 0.00 0.00 0.00 54.91 54.83 2ger h ALA 169 Cb 1.64 0.14 -0.13 0.00 0.00 0.00 0.00 17.79 19.43 2ger h ALA 169 CO 0.19 -0.53 0.18 0.28 0.00 0.00 0.00 179.25 179.36 2ger h VAL 170 N -0.68 0.35 -0.30 0.00 2.07 -1.33 0.91 116.25 117.27 2ger h VAL 170 Ca -0.04 -0.07 0.05 0.00 0.82 0.00 0.00 66.70 67.47 2ger h VAL 170 Cb 0.47 0.13 -0.02 0.00 -1.52 0.00 0.00 31.29 30.36 2ger h VAL 170 CO 0.06 0.04 0.21 0.71 0.02 0.00 0.00 177.57 178.60 2ger h THR 171 N 0.20 0.95 0.67 2.57 1.35 -1.42 -2.18 112.91 115.05 2ger h THR 171 Ca 0.50 -0.06 -0.03 0.00 -0.55 0.00 0.00 66.41 66.26 2ger h THR 171 Cb 0.96 0.74 0.01 0.00 -1.73 0.00 0.00 68.15 68.13 2ger h THR 171 CO -0.64 0.03 -0.32 1.23 -0.25 0.00 0.00 175.52 175.57 2ger h GLY 172 N 0.19 -0.94 0.00 5.82 0.00 0.87 -1.97 103.07 107.03 2ger h GLY 172 Ca 0.13 0.35 0.00 0.00 0.00 0.00 0.00 47.33 47.81 2ger h GLY 172 CO -0.02 -0.34 0.00 -0.10 0.00 0.00 0.00 176.54 176.08 2ger n LEU 173 N -4.70 0.00 -0.24 3.11 7.94 -0.87 -3.24 117.00 118.99 2ger n LEU 173 Ca -0.11 0.00 0.32 0.00 -1.11 0.00 0.00 56.01 55.11 2ger n LEU 173 Cb 0.35 0.00 0.66 0.00 0.53 0.00 0.00 43.42 44.96 2ger n LEU 173 CO 0.27 0.00 1.29 0.77 -1.11 0.00 0.00 177.39 178.61 2ger h SER 174 N 0.00 0.00 -0.01 1.96 4.64 -1.63 0.29 113.55 118.80 2ger h SER 174 Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 2ger h SER 174 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2ger h SER 174 CO 0.00 0.00 -0.05 1.23 -0.87 0.00 0.00 176.83 177.14 2ger h GLY 175 N 0.00 0.05 0.84 -0.77 0.00 -1.26 -3.37 103.07 98.56 2ger h GLY 175 Ca 0.51 -0.07 -0.33 0.00 0.00 0.00 0.00 47.33 47.43 2ger h GLY 175 CO -0.01 0.07 -1.82 1.76 0.00 0.00 0.00 176.54 176.54 2ger h SER 176 N -0.61 0.30 -0.48 0.19 0.02 -0.92 -3.40 113.55 108.65 2ger h SER 176 Ca -0.00 -0.61 0.11 0.00 -0.84 0.00 0.00 61.79 60.45 2ger h SER 176 Cb 0.73 -0.10 -0.09 0.00 0.14 0.00 0.00 62.40 63.08 2ger h SER 176 CO 0.01 1.54 -0.05 0.61 -1.14 0.00 0.00 176.83 177.79 2ger n GLY 177 N 1.81 -0.73 0.33 -3.77 0.00 0.97 0.28 105.19 104.08 2ger n GLY 177 Ca -0.24 0.49 0.17 0.00 0.00 0.00 0.00 46.02 46.43 2ger n GLY 177 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2ger h PRO 178 N 0.00 0.41 0.00 1.61 0.11 -1.77 0.16 132.00 132.52 2ger h PRO 178 Ca 0.26 -0.02 -0.09 0.00 0.11 0.00 0.00 66.00 66.25 2ger h PRO 178 Cb 0.47 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 31.48 2ger h PRO 178 CO -0.47 0.27 -0.43 0.00 -0.21 0.00 0.00 178.00 177.16 2ger h ALA 179 N 1.75 0.98 -0.23 -0.75 0.00 0.38 -2.24 119.26 119.15 2ger h ALA 179 Ca 0.62 -0.39 -0.13 0.00 0.00 0.00 0.00 54.91 55.02 2ger h ALA 179 Cb 1.25 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 2ger h ALA 179 CO -0.54 0.54 -0.39 1.88 0.00 0.00 0.00 179.25 180.74 2ger h TYR 180 N 0.00 0.63 0.40 0.00 0.99 -0.69 -2.61 116.97 115.69 2ger h TYR 180 Ca -0.00 -0.18 -0.02 0.00 2.00 0.00 0.00 58.73 60.53 2ger h TYR 180 Cb 0.95 -0.14 0.00 0.00 1.00 0.00 0.00 36.73 38.55 2ger h TYR 180 CO 0.00 0.84 -0.19 0.00 -0.00 0.00 0.00 178.16 178.81 2ger h ALA 181 N 1.13 -0.53 -0.72 3.88 0.00 -0.81 -1.15 119.26 121.06 2ger h ALA 181 Ca 0.04 -0.15 0.13 0.00 0.00 0.00 0.00 54.91 54.93 2ger h ALA 181 Cb 0.88 0.21 -0.05 0.00 0.00 0.00 0.00 17.79 18.83 2ger h ALA 181 CO 0.07 -0.74 0.48 0.74 0.00 0.00 0.00 179.25 179.81 2ger h PHE 182 N -0.65 0.51 -0.13 0.00 0.05 -1.30 0.16 116.94 115.57 2ger h PHE 182 Ca -0.05 0.01 -0.09 0.00 3.82 0.00 0.00 57.97 61.66 2ger h PHE 182 Cb 0.48 -0.16 0.00 0.00 2.00 0.00 0.00 35.95 38.26 2ger h PHE 182 CO -0.02 0.21 -0.26 1.15 -0.18 0.00 0.00 178.31 179.21 2ger h THR 183 N 0.45 1.37 -0.38 -1.55 2.02 -1.25 -1.98 112.91 111.59 2ger h THR 183 Ca 0.35 -1.52 0.04 0.00 0.77 0.00 0.00 66.41 66.05 2ger h THR 183 Cb 0.72 2.02 -0.07 0.00 -1.74 0.00 0.00 68.15 69.09 2ger h THR 183 CO -0.11 0.45 -0.44 0.00 0.37 0.00 0.00 175.52 175.79 2ger h ALA 184 N 0.55 -0.65 0.31 6.16 0.00 0.53 -1.87 119.26 124.28 2ger h ALA 184 Ca 0.01 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 2ger h ALA 184 Cb 0.85 1.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.70 2ger h ALA 184 CO 0.06 -0.88 -0.21 -0.07 0.00 0.00 0.00 179.25 178.15 2ger h LEU 185 N -0.27 -0.53 -0.94 0.00 3.38 -1.12 -0.64 115.31 115.18 2ger h LEU 185 Ca 0.07 0.04 0.27 0.00 0.09 0.00 0.00 57.88 58.34 2ger h LEU 185 Cb 0.45 0.16 -0.14 0.00 0.09 0.00 0.00 40.66 41.22 2ger h LEU 185 CO -0.50 -0.33 0.43 -0.78 0.09 0.00 0.00 178.44 177.35 2ger h ASP 186 N -0.51 0.33 0.07 -0.43 3.58 -1.18 0.79 116.42 119.07 2ger h ASP 186 Ca -0.03 0.18 -0.00 0.00 0.42 0.00 0.00 57.03 57.60 2ger h ASP 186 Cb 0.43 0.17 0.00 0.00 1.72 0.00 0.00 39.33 41.65 2ger h ASP 186 CO 0.01 -0.10 -0.03 0.00 -2.88 0.00 0.00 179.24 176.25 2ger h ALA 187 N 1.79 -1.01 -0.97 -0.78 0.00 -0.68 -2.20 119.26 115.42 2ger h ALA 187 Ca 0.63 -0.02 0.29 0.00 0.00 0.00 0.00 54.91 55.82 2ger h ALA 187 Cb 1.34 0.06 -0.17 0.00 0.00 0.00 0.00 17.79 19.01 2ger h ALA 187 CO -0.60 -1.00 0.17 -0.07 0.00 0.00 0.00 179.25 177.75 2ger h LEU 188 N -0.09 -0.23 -0.49 0.00 3.38 0.51 1.23 115.31 119.62 2ger h LEU 188 Ca -0.01 0.26 0.08 0.00 0.09 0.00 0.00 57.88 58.30 2ger h LEU 188 Cb 0.07 0.40 -0.06 0.00 0.09 0.00 0.00 40.66 41.16 2ger h LEU 188 CO 0.01 -0.33 0.13 0.00 0.09 0.00 0.00 178.44 178.34 2ger h ALA 189 N 1.95 0.58 0.02 1.53 0.00 0.60 1.86 119.26 125.80 2ger h ALA 189 Ca 0.64 0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.64 2ger h ALA 189 Cb 1.41 0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.30 2ger h ALA 189 CO -0.84 -0.27 -0.01 -0.44 0.00 0.00 0.00 179.25 177.69 2ger h ASP 190 N 0.28 -0.03 0.24 0.00 3.32 0.21 0.44 116.42 120.88 2ger h ASP 190 Ca 0.24 -0.17 -0.04 0.00 0.02 0.00 0.00 57.03 57.09 2ger h ASP 190 Cb 0.30 0.01 -0.01 0.00 0.22 0.00 0.00 39.33 39.85 2ger h ASP 190 CO -0.29 0.15 -0.17 1.23 -1.72 0.00 0.00 179.24 178.44 2ger h GLY 191 N -0.21 0.00 0.70 2.75 0.00 -0.50 0.95 103.07 106.75 2ger h GLY 191 Ca -0.00 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.29 2ger h GLY 191 CO 0.01 0.00 -0.33 -1.33 0.00 0.00 0.00 176.54 174.88 2ger h GLY 192 N 0.65 -0.98 0.79 4.60 0.00 0.37 -2.79 103.07 105.72 2ger h GLY 192 Ca -0.00 0.36 0.16 0.00 0.00 0.00 0.00 47.33 47.85 2ger h GLY 192 CO 0.02 -0.35 0.45 -2.08 0.00 0.00 0.00 176.54 174.58 2ger h VAL 193 N -1.18 0.75 0.00 4.60 2.07 0.65 -0.54 116.25 122.60 2ger h VAL 193 Ca -0.10 -0.06 0.00 0.00 0.82 0.00 0.00 66.70 67.36 2ger h VAL 193 Cb 0.72 0.56 0.00 0.00 -1.52 0.00 0.00 31.29 31.04 2ger h VAL 193 CO 0.16 0.03 0.00 1.17 0.02 0.00 0.00 177.57 178.95 2ger n LYS 194 N -4.41 0.73 0.00 1.57 0.00 0.32 -1.80 118.16 114.57 2ger n LYS 194 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.43 2ger n LYS 194 Cb 0.59 -1.33 0.00 0.00 0.00 0.00 0.00 35.03 34.30 2ger n LYS 194 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.40 176.07 2ger n MET 195 N 0.21 3.15 0.00 1.64 2.81 -0.21 -5.02 117.12 119.70 2ger n MET 195 Ca 0.00 -0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.89 2ger n MET 195 Cb 0.21 -0.23 0.00 0.00 -0.71 0.00 0.00 33.22 32.49 2ger n MET 195 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2ger n GLY 196 N 0.45 3.92 3.38 3.03 0.00 -0.74 -5.11 105.19 110.12 2ger n GLY 196 Ca 0.00 -0.79 -0.43 0.00 0.00 0.00 0.00 46.02 44.81 2ger n GLY 196 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2ger n LEU 197 N 0.00 -1.47 -4.89 0.99 4.77 -1.25 -4.90 117.00 110.25 2ger n LEU 197 Ca 0.00 0.90 -0.29 0.00 -0.03 0.00 0.00 56.01 56.59 2ger n LEU 197 Cb 0.00 -0.99 0.10 0.00 -2.33 0.00 0.00 43.42 40.20 2ger n LEU 197 CO 0.00 -3.47 0.79 -2.16 -1.33 0.00 0.00 177.39 171.22 2ger s PRO 198 N -1.23 1.81 0.00 3.23 0.04 -1.26 -3.92 135.00 133.67 2ger s PRO 198 Ca 0.61 0.09 0.00 0.00 0.04 0.00 0.00 61.00 61.74 2ger s PRO 198 Cb -0.67 -1.93 0.00 0.00 0.04 0.00 0.00 34.50 31.94 2ger s PRO 198 CO 0.60 -1.70 0.85 -2.13 0.04 0.00 0.00 177.00 174.66 2ger n ARG 199 N -3.38 0.00 -0.36 4.56 3.00 -1.26 -1.23 116.66 117.99 2ger n ARG 199 Ca 0.08 0.46 0.01 0.00 -0.00 0.00 0.00 57.85 58.40 2ger n ARG 199 Cb 0.61 -1.40 0.06 0.00 0.00 0.00 0.00 32.46 31.73 2ger n ARG 199 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 2ger n ARG 200 N -1.88 -0.18 0.22 -0.14 1.74 -1.26 -1.71 116.66 113.44 2ger n ARG 200 Ca 0.00 1.45 -0.13 0.00 -0.77 0.00 0.00 57.85 58.40 2ger n ARG 200 Cb 0.00 -2.16 -0.07 0.00 -1.02 0.00 0.00 32.46 29.21 2ger n ARG 200 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 2ger h LEU 201 N 0.00 -0.97 -0.60 0.55 5.85 -1.95 -2.03 115.31 116.16 2ger h LEU 201 Ca 0.36 0.08 0.12 0.00 0.84 0.00 0.00 57.88 59.27 2ger h LEU 201 Cb 0.60 0.32 -0.12 0.00 0.37 0.00 0.00 40.66 41.82 2ger h LEU 201 CO -0.94 -0.47 -0.19 0.00 -0.34 0.00 0.00 178.44 176.49 2ger h ALA 202 N -1.18 0.31 0.04 1.25 0.00 -0.27 -1.36 119.26 118.04 2ger h ALA 202 Ca -0.05 0.22 0.01 0.00 0.00 0.00 0.00 54.91 55.10 2ger h ALA 202 Cb 0.62 0.53 -0.04 0.00 0.00 0.00 0.00 17.79 18.90 2ger h ALA 202 CO -0.03 -0.48 -0.40 0.28 0.00 0.00 0.00 179.25 178.61 2ger h VAL 203 N -0.04 0.00 -0.85 0.00 2.07 -1.31 0.19 116.25 116.30 2ger h VAL 203 Ca 0.28 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.85 2ger h VAL 203 Cb 0.48 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 30.19 2ger h VAL 203 CO -0.64 0.00 0.53 0.03 0.02 0.00 0.00 177.57 177.51 2ger h ARG 204 N -0.53 0.97 -0.32 1.57 3.08 -0.85 0.13 114.38 118.42 2ger h ARG 204 Ca 0.00 -0.06 -0.14 0.00 0.07 0.00 0.00 59.98 59.85 2ger h ARG 204 Cb 0.55 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 30.38 2ger h ARG 204 CO -0.25 0.64 -0.37 -0.07 -1.07 0.00 0.00 179.97 178.85 2ger h LEU 205 N 1.00 0.80 -0.96 3.04 3.38 -1.10 0.23 115.31 121.71 2ger h LEU 205 Ca 0.36 -0.35 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 2ger h LEU 205 Cb 0.11 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.60 2ger h LEU 205 CO -0.15 1.08 0.36 1.23 0.09 0.00 0.00 178.44 181.05 2ger h GLY 206 N 0.93 1.19 0.40 0.83 0.00 -0.10 1.15 103.07 107.47 2ger h GLY 206 Ca 0.06 -0.59 -0.02 0.00 0.00 0.00 0.00 47.33 46.78 2ger h GLY 206 CO 0.08 0.56 -0.19 0.00 0.00 0.00 0.00 176.54 176.99 2ger h ALA 207 N 1.30 -0.93 -1.08 3.60 0.00 -0.47 -2.24 119.26 119.45 2ger h ALA 207 Ca 0.26 -0.12 0.29 0.00 0.00 0.00 0.00 54.91 55.35 2ger h ALA 207 Cb 0.12 0.21 -0.10 0.00 0.00 0.00 0.00 17.79 18.02 2ger h ALA 207 CO -0.03 -0.89 0.69 1.96 0.00 0.00 0.00 179.25 180.97 2ger h GLN 208 N -0.64 0.34 0.40 0.00 1.08 -0.33 0.29 115.11 116.25 2ger h GLN 208 Ca -0.05 -0.02 -0.01 0.00 -1.45 0.00 0.00 58.65 57.12 2ger h GLN 208 Cb 0.41 -0.08 -0.02 0.00 -0.05 0.00 0.00 27.48 27.74 2ger h GLN 208 CO 0.09 0.22 -0.47 0.00 -0.95 0.00 0.00 178.83 177.72 2ger h ALA 209 N 1.63 -1.10 -0.13 3.87 0.00 0.15 -1.63 119.26 122.06 2ger h ALA 209 Ca 0.63 -0.16 0.03 0.00 0.00 0.00 0.00 54.91 55.41 2ger h ALA 209 Cb 1.66 0.73 -0.06 0.00 0.00 0.00 0.00 17.79 20.12 2ger h ALA 209 CO -0.32 -1.14 -0.54 -0.07 0.00 0.00 0.00 179.25 177.17 2ger h LEU 210 N -0.89 -1.73 -0.69 0.00 3.38 0.16 -2.25 115.31 113.31 2ger h LEU 210 Ca -0.05 0.20 0.06 0.00 0.09 0.00 0.00 57.88 58.19 2ger h LEU 210 Cb 0.79 0.67 -0.08 0.00 0.09 0.00 0.00 40.66 42.13 2ger h LEU 210 CO -0.10 -0.48 -0.41 -0.11 0.09 0.00 0.00 178.44 177.43 2ger n LEU 211 N -5.42 -0.73 -0.23 1.67 -0.00 -0.63 -0.54 117.00 111.12 2ger n LEU 211 Ca -0.06 1.44 -0.04 0.00 -0.00 0.00 0.00 56.01 57.35 2ger n LEU 211 Cb 0.38 -0.27 0.02 0.00 -0.00 0.00 0.00 43.42 43.55 2ger n LEU 211 CO 0.08 -1.10 0.63 1.23 -0.00 0.00 0.00 177.39 178.23 2ger h GLY 212 N 0.00 -0.03 0.23 -3.96 0.00 -0.85 -1.66 103.07 96.80 2ger h GLY 212 Ca 0.11 0.43 0.06 0.00 0.00 0.00 0.00 47.33 47.93 2ger h GLY 212 CO -0.65 -0.21 -0.17 0.00 0.00 0.00 0.00 176.54 175.51 2ger h ALA 213 N 1.11 0.02 -0.28 3.60 0.00 -0.25 -2.62 119.26 120.85 2ger h ALA 213 Ca 0.26 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.27 2ger h ALA 213 Cb 0.56 0.39 0.00 0.00 0.00 0.00 0.00 17.79 18.74 2ger h ALA 213 CO -0.73 -0.58 0.00 0.00 0.00 0.00 0.00 179.25 177.94 2ger n ALA 214 N -2.72 -0.13 -0.35 0.00 0.00 -0.52 -1.56 120.51 115.23 2ger n ALA 214 Ca -0.00 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.39 2ger n ALA 214 Cb 0.25 0.34 -0.03 0.00 0.00 0.00 0.00 19.45 20.02 2ger n ALA 214 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2ger n LYS 215 N -2.55 -0.29 -0.31 0.00 4.76 -1.07 0.84 118.16 119.55 2ger n LYS 215 Ca 0.00 1.34 0.09 0.00 -2.87 0.00 0.00 58.31 56.87 2ger n LYS 215 Cb 0.00 -1.98 0.26 0.00 -1.84 0.00 0.00 35.03 31.47 2ger n LYS 215 CO 0.00 0.00 0.00 0.52 -1.37 0.00 0.00 177.40 176.55 2ger h MET 216 N 0.00 0.60 -0.12 1.97 2.86 -1.07 0.69 114.93 119.86 2ger h MET 216 Ca 0.22 -0.04 -0.16 0.00 -2.06 0.00 0.00 59.70 57.67 2ger h MET 216 Cb 0.44 -0.14 -0.01 0.00 0.06 0.00 0.00 31.60 31.96 2ger h MET 216 CO -0.85 0.40 -0.61 1.25 1.06 0.00 0.00 176.91 178.16 2ger h LEU 217 N 0.62 0.46 0.02 1.22 5.85 0.15 -3.29 115.31 120.35 2ger h LEU 217 Ca 0.51 -0.27 -0.00 0.00 0.84 0.00 0.00 57.88 58.96 2ger h LEU 217 Cb 0.78 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.67 2ger h LEU 217 CO -0.39 0.96 -0.01 -0.07 -0.34 0.00 0.00 178.44 178.59 2ger h LEU 218 N 0.30 -0.03 -3.80 2.25 3.38 0.18 -3.31 115.31 114.30 2ger h LEU 218 Ca -0.01 -0.50 -0.13 0.00 0.09 0.00 0.00 57.88 57.34 2ger h LEU 218 Cb 1.15 0.01 -0.05 0.00 0.09 0.00 0.00 40.66 41.86 2ger h LEU 218 CO 0.11 0.49 -0.24 1.41 0.09 0.00 0.00 178.44 180.30 2ger n HIS 219 N -4.86 0.00 0.00 1.13 8.25 0.12 -4.76 115.22 115.10 2ger n HIS 219 Ca -0.09 -1.27 0.00 0.00 -0.26 0.00 0.00 57.72 56.11 2ger n HIS 219 Cb 0.27 -1.23 0.00 0.00 1.12 0.00 0.00 29.99 30.14 2ger n HIS 219 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 2ger n SER 220 N 2.26 0.00 0.00 0.41 3.41 -1.24 -4.96 113.62 113.50 2ger n SER 220 Ca 0.29 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.90 2ger n SER 220 Cb 0.75 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.70 2ger n SER 220 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2ger n GLU 221 N -0.53 0.00 0.00 4.33 4.71 -1.26 -4.87 120.64 123.02 2ger n GLU 221 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.15 2ger n GLU 221 Cb 0.00 -0.20 0.00 0.00 -1.01 0.00 0.00 31.44 30.23 2ger n GLU 221 CO 0.00 0.00 0.00 1.04 0.09 0.00 0.00 177.13 178.26 2ger n GLN 222 N -1.97 0.00 0.00 3.49 1.13 -1.26 -4.57 117.38 114.20 2ger n GLN 222 Ca 0.00 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.06 2ger n GLN 222 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.35 2ger n GLN 222 CO 0.00 0.00 0.00 1.58 -1.44 0.00 0.00 177.06 177.20 2ger n HIS 223 N 0.00 0.00 -0.14 1.08 -0.00 -1.26 -4.47 115.22 110.43 2ger n HIS 223 Ca 0.00 0.00 0.25 0.00 -0.00 0.00 0.00 57.72 57.97 2ger n HIS 223 Cb 0.00 0.00 0.69 0.00 -0.00 0.00 0.00 29.99 30.68 2ger n HIS 223 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.34 174.99 2ger h PRO 224 N 0.00 0.06 0.29 1.57 0.11 -1.97 -2.24 132.00 129.82 2ger h PRO 224 Ca 0.00 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.10 2ger h PRO 224 Cb 0.00 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 31.09 2ger h PRO 224 CO 0.00 0.04 -0.19 0.78 -0.21 0.00 0.00 178.00 178.41 2ger h GLY 225 N 0.06 -0.49 1.28 -0.55 0.00 -1.97 -2.67 103.07 98.74 2ger h GLY 225 Ca 0.38 0.22 -0.11 0.00 0.00 0.00 0.00 47.33 47.82 2ger h GLY 225 CO -0.03 -0.19 -0.15 -1.61 0.00 0.00 0.00 176.54 174.55 2ger h GLN 226 N -0.47 0.84 0.00 4.80 4.15 -1.63 -2.24 115.11 120.55 2ger h GLN 226 Ca -0.02 -0.31 -0.01 0.00 0.77 0.00 0.00 58.65 59.07 2ger h GLN 226 Cb 0.40 -0.05 -0.00 0.00 0.21 0.00 0.00 27.48 28.04 2ger h GLN 226 CO 0.01 0.93 -0.07 -0.07 -1.93 0.00 0.00 178.83 177.71 2ger h LEU 227 N 0.74 0.00 -0.44 -2.39 3.38 -1.52 -0.13 115.31 114.96 2ger h LEU 227 Ca 0.11 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.99 2ger h LEU 227 Cb 0.67 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.40 2ger h LEU 227 CO 0.05 0.07 -0.10 0.50 0.09 0.00 0.00 178.44 179.04 2ger h LYS 228 N 0.00 0.84 -0.67 1.13 3.64 -1.04 -2.86 116.57 117.60 2ger h LYS 228 Ca -0.00 -0.32 -0.05 0.00 -1.27 0.00 0.00 60.65 59.01 2ger h LYS 228 Cb 0.36 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.11 2ger h LYS 228 CO 0.01 0.95 0.24 -0.44 -2.27 0.00 0.00 179.45 177.94 2ger h ASP 229 N 0.67 0.95 0.31 4.20 5.19 -0.92 -2.42 116.42 124.39 2ger h ASP 229 Ca 0.11 -0.19 0.00 0.00 -0.62 0.00 0.00 57.03 56.33 2ger h ASP 229 Cb 0.64 -0.25 0.00 0.00 0.18 0.00 0.00 39.33 39.90 2ger h ASP 229 CO 0.04 0.89 0.00 0.59 -3.12 0.00 0.00 179.24 177.64 2ger n ASN 230 N -4.36 0.50 -0.00 6.45 3.02 -0.58 -2.82 115.26 117.47 2ger n ASN 230 Ca 0.05 0.68 0.06 0.00 -0.03 0.00 0.00 54.58 55.34 2ger n ASN 230 Cb 0.20 -0.77 -0.08 0.00 -0.61 0.00 0.00 39.78 38.51 2ger n ASN 230 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 2ger n VAL 231 N -2.12 0.00 -3.53 2.41 0.31 -0.93 -4.90 118.33 109.58 2ger n VAL 231 Ca 0.00 -0.22 -0.41 0.00 -0.01 0.00 0.00 64.34 63.69 2ger n VAL 231 Cb 0.11 0.76 -0.08 0.00 -0.91 0.00 0.00 33.84 33.72 2ger n VAL 231 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 2ger s SER 232 N -2.64 5.77 0.03 4.52 1.04 -1.12 -4.89 113.70 116.40 2ger s SER 232 Ca 0.02 -1.76 -0.30 0.00 0.48 0.00 0.00 55.95 54.38 2ger s SER 232 Cb 0.10 -2.04 -0.06 0.00 0.10 0.00 0.00 66.02 64.12 2ger s SER 232 CO 0.55 -0.67 1.40 -0.94 0.98 0.00 0.00 173.24 174.56 2ger s SER 233 N 2.63 6.84 0.23 7.02 1.04 -1.26 -4.81 113.70 125.39 2ger s SER 233 Ca 0.05 2.17 0.00 0.00 0.48 0.00 0.00 55.95 58.65 2ger s SER 233 Cb -0.26 -2.57 0.00 0.00 0.10 0.00 0.00 66.02 63.30 2ger s SER 233 CO 0.01 -0.70 0.47 -2.65 0.98 0.00 0.00 173.24 171.34 2ger n PRO 234 N 5.05 0.01 0.00 4.02 -0.02 -1.26 -2.07 135.00 140.73 2ger n PRO 234 Ca 0.13 0.33 0.00 0.00 -2.02 0.00 0.00 63.50 61.94 2ger n PRO 234 Cb 0.43 -1.39 0.00 0.00 -0.02 0.00 0.00 33.50 32.53 2ger n PRO 234 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ger n GLY 235 N -0.89 0.47 0.00 -1.23 0.00 -1.26 -5.10 105.19 97.19 2ger n GLY 235 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2ger n GLY 235 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ger n GLY 236 N 1.99 1.30 4.45 -0.02 0.00 -0.88 -4.93 105.19 107.10 2ger n GLY 236 Ca 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.75 2ger n GLY 236 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ger n ALA 237 N -3.00 0.00 -0.04 4.61 0.00 -1.26 -4.35 120.51 116.46 2ger n ALA 237 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.39 2ger n ALA 237 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 2ger n ALA 237 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2ger n THR 238 N 0.00 0.90 0.01 0.00 -1.04 -1.26 -3.72 114.28 109.16 2ger n THR 238 Ca 0.00 0.28 0.23 0.00 -2.04 0.00 0.00 64.05 62.51 2ger n THR 238 Cb 0.00 -1.93 0.70 0.00 -1.82 0.00 0.00 70.33 67.28 2ger n THR 238 CO 0.00 0.00 0.00 -0.29 -0.64 0.00 0.00 175.07 174.14 2ger h ILE 239 N -0.53 0.32 0.01 12.58 2.10 -1.89 0.72 117.51 130.82 2ger h ILE 239 Ca 0.00 0.00 -0.00 0.00 1.08 0.00 0.00 64.86 65.94 2ger h ILE 239 Cb 0.53 0.53 0.00 0.00 -1.09 0.00 0.00 36.82 36.78 2ger h ILE 239 CO 0.00 0.00 -0.01 0.45 -1.08 0.00 0.00 178.15 177.51 2ger h HIS 240 N 0.00 -0.02 -0.85 2.19 3.86 -1.85 -0.81 115.15 117.67 2ger h HIS 240 Ca 0.27 -0.00 0.09 0.00 -1.16 0.00 0.00 60.37 59.57 2ger h HIS 240 Cb 1.47 0.01 -0.07 0.00 1.06 0.00 0.00 27.41 29.87 2ger h HIS 240 CO 0.00 0.54 0.51 0.00 0.86 0.00 0.00 177.93 179.83 2ger h ALA 241 N 0.39 1.21 0.20 2.45 0.00 0.23 -2.39 119.26 121.36 2ger h ALA 241 Ca -0.00 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 2ger h ALA 241 Cb 0.56 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 2ger h ALA 241 CO 0.00 0.17 -0.32 -0.07 0.00 0.00 0.00 179.25 179.03 2ger h LEU 242 N 0.87 -0.93 -0.57 0.00 3.38 -0.71 -2.23 115.31 115.11 2ger h LEU 242 Ca 0.40 0.09 0.10 0.00 0.09 0.00 0.00 57.88 58.55 2ger h LEU 242 Cb 0.32 0.33 -0.10 0.00 0.09 0.00 0.00 40.66 41.30 2ger h LEU 242 CO -0.23 -0.38 -0.20 1.57 0.09 0.00 0.00 178.44 179.29 2ger n HIS 243 N -4.31 0.07 0.02 1.13 -0.00 -0.32 0.79 115.22 112.60 2ger n HIS 243 Ca -0.06 0.70 -0.10 0.00 0.46 0.00 0.00 57.72 58.71 2ger n HIS 243 Cb 0.27 -0.74 -0.05 0.00 -0.12 0.00 0.00 29.99 29.35 2ger n HIS 243 CO 0.00 0.00 0.00 -0.39 0.46 0.00 0.00 176.34 176.41 2ger h VAL 244 N 0.00 0.82 0.15 3.57 -1.51 -1.32 0.25 116.25 118.22 2ger h VAL 244 Ca 0.22 0.00 0.02 0.00 -1.23 0.00 0.00 66.70 65.70 2ger h VAL 244 Cb 0.36 0.82 -0.03 0.00 -2.13 0.00 0.00 31.29 30.31 2ger h VAL 244 CO -0.57 0.00 -0.30 -0.07 -1.23 0.00 0.00 177.57 175.39 2ger h LEU 245 N -0.07 -0.87 -1.44 4.19 3.38 0.72 0.12 115.31 121.34 2ger h LEU 245 Ca 0.05 0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.12 2ger h LEU 245 Cb 0.14 0.32 0.00 0.00 0.09 0.00 0.00 40.66 41.22 2ger h LEU 245 CO -0.11 -0.40 0.08 -0.08 0.09 0.00 0.00 178.44 178.01 2ger h GLU 246 N -0.54 0.00 -0.43 1.13 4.57 0.57 0.92 114.58 120.80 2ger h GLU 246 Ca 0.02 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.20 2ger h GLU 246 Cb 0.56 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.15 2ger h GLU 246 CO -0.16 0.00 0.00 0.45 -1.18 0.00 0.00 179.01 178.12 2ger n SER 247 N -2.29 3.44 -0.17 1.04 2.88 0.80 -4.01 113.62 115.31 2ger n SER 247 Ca -0.01 -1.97 0.05 0.00 -1.33 0.00 0.00 58.87 55.61 2ger n SER 247 Cb 0.11 -0.28 0.07 0.00 -0.75 0.00 0.00 64.21 63.36 2ger n SER 247 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2ger n GLY 248 N 1.39 2.66 2.78 0.46 0.00 0.29 -4.99 105.19 107.78 2ger n GLY 248 Ca 0.19 -0.54 -0.22 0.00 0.00 0.00 0.00 46.02 45.45 2ger n GLY 248 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ger n GLY 249 N -0.76 -0.52 0.26 -0.02 0.00 -1.14 -4.86 105.19 98.16 2ger n GLY 249 Ca 0.08 0.08 0.02 0.00 0.00 0.00 0.00 46.02 46.20 2ger n GLY 249 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2ger h PHE 250 N -0.85 -0.18 0.55 1.61 3.57 -1.79 0.15 116.94 120.01 2ger h PHE 250 Ca -0.52 0.06 -0.02 0.00 3.53 0.00 0.00 57.97 61.01 2ger h PHE 250 Cb 1.37 0.19 -0.00 0.00 2.79 0.00 0.00 35.95 40.30 2ger h PHE 250 CO 0.54 -0.25 -0.34 0.00 -2.23 0.00 0.00 178.31 176.03 2ger h ARG 251 N 0.06 -0.81 0.00 1.11 3.08 -1.91 -3.19 114.38 112.72 2ger h ARG 251 Ca 0.36 0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.47 2ger h ARG 251 Cb 0.60 0.18 0.00 0.00 0.08 0.00 0.00 29.97 30.84 2ger h ARG 251 CO -0.66 -0.54 0.00 0.45 -1.07 0.00 0.00 179.97 178.15 2ger n SER 252 N -5.47 0.00 0.00 7.04 2.88 0.32 -0.17 113.62 118.21 2ger n SER 252 Ca -0.12 0.84 0.00 0.00 -1.33 0.00 0.00 58.87 58.25 2ger n SER 252 Cb 0.37 -0.34 0.00 0.00 -0.75 0.00 0.00 64.21 63.49 2ger n SER 252 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2ger n LEU 253 N -2.24 0.00 -0.07 2.46 4.77 0.06 0.24 117.00 122.22 2ger n LEU 253 Ca 0.00 0.00 -0.08 0.00 -0.03 0.00 0.00 56.01 55.90 2ger n LEU 253 Cb 0.00 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.00 2ger n LEU 253 CO 0.00 0.00 -0.95 0.18 -1.33 0.00 0.00 177.39 175.29 2ger n LEU 254 N -0.46 0.72 0.28 2.23 4.77 0.75 -3.95 117.00 121.34 2ger n LEU 254 Ca 0.00 -0.02 -0.12 0.00 -0.03 0.00 0.00 56.01 55.84 2ger n LEU 254 Cb 0.00 0.10 -0.05 0.00 -2.33 0.00 0.00 43.42 41.14 2ger n LEU 254 CO 0.00 0.43 0.32 0.40 -1.33 0.00 0.00 177.39 177.21 2ger h ILE 255 N 0.00 0.00 -0.92 -0.08 2.04 -0.00 -1.56 117.51 116.99 2ger h ILE 255 Ca -0.35 -0.36 0.27 0.00 1.00 0.00 0.00 64.86 65.42 2ger h ILE 255 Cb 1.74 0.00 -0.04 0.00 -0.74 0.00 0.00 36.82 37.78 2ger h ILE 255 CO 0.00 0.00 0.95 0.78 0.00 0.00 0.00 178.15 179.88 2ger h ASN 256 N -1.11 0.00 0.60 1.72 4.21 -1.72 1.08 115.58 120.36 2ger h ASN 256 Ca -0.08 0.00 -0.28 0.00 1.21 0.00 0.00 56.30 57.15 2ger h ASN 256 Cb 0.58 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.77 2ger h ASN 256 CO 0.13 0.00 -1.35 0.00 -1.29 0.00 0.00 177.43 174.92 2ger h ALA 257 N 0.96 0.23 0.48 -0.83 0.00 -1.58 -1.64 119.26 116.88 2ger h ALA 257 Ca 0.43 -1.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.31 2ger h ALA 257 Cb 2.33 0.12 0.00 0.00 0.00 0.00 0.00 17.79 20.24 2ger h ALA 257 CO -0.00 1.11 -0.23 0.28 0.00 0.00 0.00 179.25 180.40 2ger h VAL 258 N 0.06 0.20 -0.63 0.00 2.07 0.21 -1.21 116.25 116.94 2ger h VAL 258 Ca -0.17 -0.53 0.13 0.00 0.82 0.00 0.00 66.70 66.95 2ger h VAL 258 Cb 1.97 0.30 -0.11 0.00 -1.52 0.00 0.00 31.29 31.92 2ger h VAL 258 CO 0.17 0.04 -0.09 -0.08 0.02 0.00 0.00 177.57 177.63 2ger h GLU 259 N -1.10 0.04 0.18 1.57 4.81 -0.83 0.28 114.58 119.54 2ger h GLU 259 Ca -0.07 -0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.15 2ger h GLU 259 Cb 0.56 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.93 2ger h GLU 259 CO 0.11 0.03 -0.09 0.00 -0.73 0.00 0.00 179.01 178.33 2ger h ALA 260 N 1.61 -0.24 -0.15 2.92 0.00 -1.36 0.31 119.26 122.33 2ger h ALA 260 Ca 0.32 -0.10 0.05 0.00 0.00 0.00 0.00 54.91 55.17 2ger h ALA 260 Cb 0.50 0.09 -0.06 0.00 0.00 0.00 0.00 17.79 18.33 2ger h ALA 260 CO -0.61 -0.57 -0.25 1.03 0.00 0.00 0.00 179.25 178.85 2ger h SER 261 N -0.37 -0.78 0.05 0.00 0.87 0.11 0.11 113.55 113.54 2ger h SER 261 Ca -0.02 0.13 0.00 0.00 -1.23 0.00 0.00 61.79 60.66 2ger h SER 261 Cb 0.29 0.35 -0.01 0.00 -0.44 0.00 0.00 62.40 62.59 2ger h SER 261 CO 0.04 -0.30 -0.12 0.00 -0.53 0.00 0.00 176.83 175.93 2ger h ILE 263 N -0.19 0.27 -0.29 0.00 2.04 -0.13 0.52 117.51 119.74 2ger h ILE 263 Ca -0.01 -0.07 -0.06 0.00 1.00 0.00 0.00 64.86 65.73 2ger h ILE 263 Cb 0.18 0.04 -0.01 0.00 -0.74 0.00 0.00 36.82 36.28 2ger h ILE 263 CO -0.05 0.04 -0.04 -0.09 0.00 0.00 0.00 178.15 178.01 2ger h ARG 264 N 0.22 0.53 -0.69 2.37 9.65 -0.51 -2.29 114.38 123.67 2ger h ARG 264 Ca 0.74 -0.19 0.03 0.00 -1.10 0.00 0.00 59.98 59.46 2ger h ARG 264 Cb 2.08 -0.04 -0.04 0.00 -1.39 0.00 0.00 29.97 30.58 2ger h ARG 264 CO -0.42 0.71 0.43 1.15 2.80 0.00 0.00 179.97 184.64 2ger h THR 265 N 0.30 1.10 0.16 0.20 2.02 0.47 -0.49 112.91 116.67 2ger h THR 265 Ca 0.08 -0.29 0.01 0.00 0.77 0.00 0.00 66.41 66.98 2ger h THR 265 Cb 0.49 0.18 -0.05 0.00 -1.74 0.00 0.00 68.15 67.04 2ger h THR 265 CO 0.02 0.16 -0.49 0.03 0.37 0.00 0.00 175.52 175.61 2ger h ARG 266 N 0.85 -0.72 0.01 6.66 3.08 -0.97 -2.86 114.38 120.44 2ger h ARG 266 Ca 0.27 0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.37 2ger h ARG 266 Cb -0.00 0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.20 2ger h ARG 266 CO -0.10 -0.48 -0.11 0.93 -1.07 0.00 0.00 179.97 179.15 2ger h GLU 267 N -0.75 -0.14 -0.64 0.04 5.08 -0.82 0.35 114.58 117.70 2ger h GLU 267 Ca -0.00 0.01 0.21 0.00 -1.00 0.00 0.00 59.36 58.58 2ger h GLU 267 Cb 0.75 0.03 -0.12 0.00 0.50 0.00 0.00 28.75 29.91 2ger h GLU 267 CO -0.25 -0.09 0.13 1.28 -1.00 0.00 0.00 179.01 179.08 2ger n LEU 268 N -3.07 0.03 -0.08 1.33 4.77 -0.25 -0.98 117.00 118.76 2ger n LEU 268 Ca -0.02 1.08 -0.15 0.00 -0.03 0.00 0.00 56.01 56.90 2ger n LEU 268 Cb 0.08 -0.44 -0.11 0.00 -2.33 0.00 0.00 43.42 40.62 2ger n LEU 268 CO 0.03 -1.14 0.08 0.06 -1.33 0.00 0.00 177.39 175.09 2ger h GLN 269 N 0.00 0.00 -1.61 3.23 3.07 -1.22 -2.99 115.11 115.59 2ger h GLN 269 Ca 0.45 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.19 2ger h GLN 269 Cb 1.03 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.59 2ger h GLN 269 CO -0.57 0.89 0.00 0.43 0.09 0.00 0.00 178.83 179.67 2ger n SER 270 N -4.57 2.36 0.00 0.06 7.64 0.07 -0.08 113.62 119.09 2ger n SER 270 Ca -0.15 -1.46 0.00 0.00 1.01 0.00 0.00 58.87 58.27 2ger n SER 270 Cb 0.49 -0.45 0.00 0.00 -1.01 0.00 0.00 64.21 63.25 2ger n SER 270 CO 0.00 0.00 0.00 0.80 -3.01 0.00 0.00 175.04 172.83 2ger n MET 271 N 1.06 0.52 0.00 1.43 0.00 -0.54 -4.70 117.12 114.89 2ger n MET 271 Ca 0.00 0.00 0.14 0.00 -0.00 0.00 0.00 57.70 57.84 2ger n MET 271 Cb 0.31 -0.46 0.51 0.00 0.00 0.00 0.00 33.22 33.58 2ger n MET 271 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2ger n ALA 272 N -0.45 2.79 -0.01 -5.12 0.00 0.88 -3.58 120.51 115.03 2ger n ALA 272 Ca 0.00 -0.38 -0.15 0.00 0.00 0.00 0.00 53.44 52.91 2ger n ALA 272 Cb 0.00 -1.21 -0.03 0.00 0.00 0.00 0.00 19.45 18.21 2ger n ALA 272 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2ger h ASP 273 N 1.49 0.82 0.00 0.00 3.32 -1.63 -3.41 116.42 117.01 2ger h ASP 273 Ca 0.00 -0.51 0.00 0.00 0.02 0.00 0.00 57.03 56.54 2ger h ASP 273 Cb 0.45 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.75 2ger h ASP 273 CO 0.00 1.29 0.00 0.00 -1.72 0.00 0.00 179.24 178.81 2ger n GLN 274 N -3.93 0.00 0.00 3.56 6.02 -1.25 -5.14 117.38 116.64 2ger n GLN 274 Ca -0.06 0.00 0.15 0.00 -0.01 0.00 0.00 57.00 57.09 2ger n GLN 274 Cb 0.70 -0.02 0.83 0.00 1.02 0.00 0.00 30.24 32.77 2ger n GLN 274 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 177.06 174.14