#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 3.88 -1.48 7.54 0.00 -1.26 -5.03 120.51 124.15 2ger n ALA 0 Ca 0.00 -3.20 -0.31 0.00 0.00 0.00 0.00 53.44 49.94 2ger n ALA 0 Cb 0.00 -0.52 0.07 0.00 0.00 0.00 0.00 19.45 19.00 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 -3.22 2.52 -0.14 0.00 0.00 -1.26 -5.08 119.30 112.12 2ger s MET 1 Ca 0.41 0.93 -0.13 0.00 0.00 0.00 0.00 55.69 56.89 2ger s MET 1 Cb 0.38 -1.95 0.04 0.00 0.00 0.00 0.00 34.83 33.30 2ger s MET 1 CO -0.04 -1.39 0.38 -1.12 0.00 0.00 0.00 175.02 172.86 2ger s SER 2 N -3.71 -0.40 -0.01 1.11 0.01 -1.26 -5.03 113.70 104.41 2ger s SER 2 Ca 0.60 0.77 0.07 0.00 1.31 0.00 0.00 55.95 58.69 2ger s SER 2 Cb -0.15 0.77 -0.02 0.00 0.21 0.00 0.00 66.02 66.84 2ger s SER 2 CO 0.55 -0.14 -0.21 -0.69 0.41 0.00 0.00 173.24 173.16 2ger s VAL 3 N 0.27 1.69 0.06 3.43 1.01 -1.09 -1.36 120.40 124.42 2ger s VAL 3 Ca -0.01 -0.94 0.04 0.00 0.00 0.00 0.00 61.98 61.07 2ger s VAL 3 Cb -0.03 -1.41 -0.03 0.00 0.00 0.00 0.00 36.38 34.91 2ger s VAL 3 CO -0.00 0.45 -0.12 -0.83 0.00 0.00 0.00 175.10 174.60 2ger s GLY 4 N -0.57 0.76 -0.06 4.51 0.00 -1.09 -0.20 107.32 110.68 2ger s GLY 4 Ca 0.08 -0.94 0.04 0.00 0.00 0.00 0.00 44.72 43.90 2ger s GLY 4 CO -0.01 -0.98 -0.18 -1.36 0.00 0.00 0.00 173.10 170.57 2ger s PHE 5 N -1.36 1.88 -0.34 1.90 0.40 0.44 0.54 117.98 121.44 2ger s PHE 5 Ca -0.04 -0.61 -0.20 0.00 -0.60 0.00 0.00 56.93 55.48 2ger s PHE 5 Cb -0.10 -1.28 -0.00 0.00 0.51 0.00 0.00 43.02 42.15 2ger s PHE 5 CO 0.02 -0.23 0.62 0.42 0.70 0.00 0.00 175.22 176.74 2ger s ILE 6 N 0.17 4.92 0.00 0.64 1.01 0.66 -1.45 121.20 127.15 2ger s ILE 6 Ca -0.08 0.62 0.00 0.00 0.00 0.00 0.00 60.65 61.19 2ger s ILE 6 Cb -0.14 -4.04 0.00 0.00 0.01 0.00 0.00 42.46 38.30 2ger s ILE 6 CO 0.04 -0.25 0.00 0.61 0.00 0.00 0.00 174.94 175.33 2ger n GLY 7 N 4.62 -0.77 0.00 6.18 0.00 -0.63 -3.08 105.19 111.52 2ger n GLY 7 Ca -0.02 -1.40 0.00 0.00 0.00 0.00 0.00 46.02 44.60 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 0.13 0.00 0.00 4.61 0.00 -1.01 -4.43 120.51 119.81 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 5.00 2.67 0.12 0.00 0.00 -1.26 -4.27 105.19 107.45 2ger n GLY 9 Ca 0.00 -2.00 -0.04 0.00 0.00 0.00 0.00 46.02 43.97 2ger n GLY 9 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2ger h GLN 10 N 0.00 -0.20 0.00 1.61 7.50 -1.99 0.77 115.11 122.81 2ger h GLN 10 Ca 0.00 0.01 0.00 0.00 0.50 0.00 0.00 58.65 59.16 2ger h GLN 10 Cb 0.00 0.05 0.00 0.00 0.05 0.00 0.00 27.48 27.58 2ger h GLN 10 CO 0.00 -0.13 0.32 1.25 -1.50 0.00 0.00 178.83 178.77 2ger h LEU 11 N -0.21 0.00 0.09 1.46 5.85 -1.97 0.40 115.31 120.93 2ger h LEU 11 Ca -0.01 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.71 2ger h LEU 11 Cb 0.20 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.23 2ger h LEU 11 CO -0.05 0.00 -0.04 0.00 -0.34 0.00 0.00 178.44 178.00 2ger h ALA 12 N 1.24 -0.12 -0.94 1.25 0.00 -1.16 -2.70 119.26 116.84 2ger h ALA 12 Ca 0.00 -0.07 0.15 0.00 0.00 0.00 0.00 54.91 55.00 2ger h ALA 12 Cb 0.64 0.05 -0.08 0.00 0.00 0.00 0.00 17.79 18.40 2ger h ALA 12 CO 0.00 -0.11 0.60 0.35 0.00 0.00 0.00 179.25 180.08 2ger h PHE 13 N -1.02 0.90 0.00 0.00 3.57 0.13 1.52 116.94 122.04 2ger h PHE 13 Ca -0.01 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.51 2ger h PHE 13 Cb 0.17 -0.28 0.00 0.00 2.79 0.00 0.00 35.95 38.63 2ger h PHE 13 CO 0.02 0.30 0.00 0.00 -2.23 0.00 0.00 178.31 176.41 2ger n ALA 14 N -2.41 -0.47 0.02 2.41 0.00 0.11 -0.18 120.51 120.00 2ger n ALA 14 Ca 0.19 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.74 2ger n ALA 14 Cb 0.49 0.02 0.55 0.00 0.00 0.00 0.00 19.45 20.51 2ger n ALA 14 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2ger h LEU 15 N 0.00 0.25 -0.16 0.00 3.38 -1.16 0.15 115.31 117.77 2ger h LEU 15 Ca 0.00 0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.01 2ger h LEU 15 Cb 0.00 -0.05 -0.04 0.00 0.09 0.00 0.00 40.66 40.65 2ger h LEU 15 CO 0.00 0.16 -0.11 0.00 0.09 0.00 0.00 178.44 178.59 2ger h ALA 16 N 1.78 0.02 -0.11 1.53 0.00 0.24 -2.42 119.26 120.30 2ger h ALA 16 Ca 0.19 0.06 -0.22 0.00 0.00 0.00 0.00 54.91 54.94 2ger h ALA 16 Cb 0.39 0.24 0.01 0.00 0.00 0.00 0.00 17.79 18.43 2ger h ALA 16 CO -0.04 -0.55 -0.81 -0.22 0.00 0.00 0.00 179.25 177.64 2ger h LYS 17 N -0.11 0.75 -0.76 0.00 3.64 0.14 -2.85 116.57 117.38 2ger h LYS 17 Ca 0.10 -0.65 0.06 0.00 -1.27 0.00 0.00 60.65 58.88 2ger h LYS 17 Cb 0.25 0.15 -0.06 0.00 -0.41 0.00 0.00 32.23 32.16 2ger h LYS 17 CO -0.23 1.25 0.46 0.78 -2.27 0.00 0.00 179.45 179.45 2ger h GLY 18 N 0.46 1.13 0.95 5.01 0.00 -0.66 0.24 103.07 110.19 2ger h GLY 18 Ca -0.07 -0.33 -0.11 0.00 0.00 0.00 0.00 47.33 46.82 2ger h GLY 18 CO 0.16 0.23 -0.27 0.74 0.00 0.00 0.00 176.54 177.40 2ger h PHE 19 N 0.85 0.80 -0.35 5.60 0.05 -1.53 0.23 116.94 122.60 2ger h PHE 19 Ca 0.33 -0.24 0.07 0.00 3.82 0.00 0.00 57.97 61.95 2ger h PHE 19 Cb 0.15 -0.17 -0.09 0.00 2.00 0.00 0.00 35.95 37.84 2ger h PHE 19 CO -0.05 0.98 -0.33 1.15 -0.18 0.00 0.00 178.31 179.88 2ger h THR 20 N 0.40 0.23 -0.67 -1.55 2.02 -1.08 -1.94 112.91 110.32 2ger h THR 20 Ca 0.04 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.17 2ger h THR 20 Cb 0.84 0.23 -0.03 0.00 -1.74 0.00 0.00 68.15 67.46 2ger h THR 20 CO 0.07 0.00 0.23 0.00 0.37 0.00 0.00 175.52 176.19 2ger h ALA 21 N 0.67 0.88 0.00 6.16 0.00 -0.43 -2.51 119.26 124.02 2ger h ALA 21 Ca 0.15 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2ger h ALA 21 Cb 0.54 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.07 2ger h ALA 21 CO -0.50 0.53 0.00 0.00 0.00 0.00 0.00 179.25 179.28 2ger h ALA 22 N 1.10 1.00 0.00 0.00 0.00 0.18 -3.45 119.26 118.09 2ger h ALA 22 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.13 2ger h ALA 22 Cb 0.27 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.06 2ger h ALA 22 CO -0.01 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.65 2ger n GLY 23 N -0.58 0.57 0.31 0.00 0.00 -0.84 -4.96 105.19 99.70 2ger n GLY 23 Ca -0.00 -0.31 -0.17 0.00 0.00 0.00 0.00 46.02 45.55 2ger n GLY 23 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2ger h VAL 24 N 0.00 0.44 -3.65 1.61 2.07 -1.71 -3.46 116.25 111.55 2ger h VAL 24 Ca 0.00 0.00 -0.11 0.00 0.82 0.00 0.00 66.70 67.41 2ger h VAL 24 Cb 0.00 0.44 -0.02 0.00 -1.52 0.00 0.00 31.29 30.19 2ger h VAL 24 CO 0.00 0.00 -0.09 0.18 0.02 0.00 0.00 177.57 177.68 2ger n LEU 25 N -5.41 0.00 -4.86 2.57 4.77 -1.26 -5.04 117.00 107.77 2ger n LEU 25 Ca -0.12 -0.58 -0.21 0.00 -0.03 0.00 0.00 56.01 55.07 2ger n LEU 25 Cb 0.31 0.14 -0.03 0.00 -2.33 0.00 0.00 43.42 41.51 2ger n LEU 25 CO 0.36 -0.09 -0.08 0.00 -1.33 0.00 0.00 177.39 176.25 2ger s ALA 26 N -2.19 3.84 0.12 -1.18 0.00 -1.26 -4.76 121.76 116.34 2ger s ALA 26 Ca 0.02 -1.60 -0.18 0.00 0.00 0.00 0.00 51.96 50.20 2ger s ALA 26 Cb 0.00 -1.24 -0.04 0.00 0.00 0.00 0.00 23.12 21.84 2ger s ALA 26 CO 0.02 0.04 1.73 0.00 0.00 0.00 0.00 175.76 177.54 2ger h ALA 27 N 1.25 0.38 0.00 0.00 0.00 -1.89 -2.94 119.26 116.06 2ger h ALA 27 Ca -0.45 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.39 2ger h ALA 27 Cb 1.25 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.92 2ger h ALA 27 CO 0.58 -0.10 0.00 -2.39 0.00 0.00 0.00 179.25 177.34 2ger n HIS 28 N -4.82 0.00 -1.65 0.00 -0.00 -1.20 -3.08 115.22 104.47 2ger n HIS 28 Ca -0.02 -0.36 0.01 0.00 -0.00 0.00 0.00 57.72 57.35 2ger n HIS 28 Cb 0.07 -0.22 0.01 0.00 -0.00 0.00 0.00 29.99 29.86 2ger n HIS 28 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.34 177.97 2ger n LYS 29 N 0.75 0.16 -5.02 -1.40 4.76 -1.11 -4.99 118.16 111.31 2ger n LYS 29 Ca 0.00 -1.00 -0.28 0.00 -2.87 0.00 0.00 58.31 54.15 2ger n LYS 29 Cb 0.33 -0.58 -0.15 0.00 -1.84 0.00 0.00 35.03 32.79 2ger n LYS 29 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 2ger s ILE 30 N -0.22 1.83 -0.05 -0.18 1.01 -1.18 -2.69 121.20 119.73 2ger s ILE 30 Ca 0.02 -1.08 0.06 0.00 0.00 0.00 0.00 60.65 59.65 2ger s ILE 30 Cb 0.02 -1.54 -0.01 0.00 0.01 0.00 0.00 42.46 40.94 2ger s ILE 30 CO 0.00 0.44 -0.23 -0.32 0.00 0.00 0.00 174.94 174.83 2ger s MET 31 N -0.76 2.27 -0.02 2.79 1.75 0.72 0.46 119.30 126.51 2ger s MET 31 Ca 0.09 -0.83 0.01 0.00 -1.25 0.00 0.00 55.69 53.70 2ger s MET 31 Cb -0.09 -1.98 0.02 0.00 2.84 0.00 0.00 34.83 35.62 2ger s MET 31 CO 0.00 0.38 -0.02 0.00 -0.65 0.00 0.00 175.02 174.74 2ger s ALA 32 N -0.21 0.36 -0.33 4.11 0.00 0.11 0.17 121.76 125.97 2ger s ALA 32 Ca -0.01 0.05 -0.23 0.00 0.00 0.00 0.00 51.96 51.77 2ger s ALA 32 Cb -0.12 -0.26 0.00 0.00 0.00 0.00 0.00 23.12 22.74 2ger s ALA 32 CO 0.02 -0.02 0.77 -1.12 0.00 0.00 0.00 175.76 175.42 2ger s SER 33 N 0.69 6.60 -1.02 0.00 0.01 -0.53 -0.94 113.70 118.51 2ger s SER 33 Ca -0.07 0.51 -0.13 0.00 1.31 0.00 0.00 55.95 57.57 2ger s SER 33 Cb -0.10 -2.40 0.22 0.00 0.21 0.00 0.00 66.02 63.95 2ger s SER 33 CO -0.01 -0.65 1.07 -0.94 0.41 0.00 0.00 173.24 173.12 2ger s SER 34 N 1.72 7.03 0.37 2.44 1.04 -0.99 -1.60 113.70 123.70 2ger s SER 34 Ca 0.31 -3.02 0.25 0.00 0.48 0.00 0.00 55.95 53.97 2ger s SER 34 Cb -0.14 -2.27 1.35 0.00 0.10 0.00 0.00 66.02 65.06 2ger s SER 34 CO 0.14 -0.55 1.77 1.55 0.98 0.00 0.00 173.24 177.13 2ger h PRO 35 N 7.36 0.00 0.00 4.02 0.13 -1.88 -3.41 132.00 138.22 2ger h PRO 35 Ca 0.18 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.31 2ger h PRO 35 Cb 0.94 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.07 2ger h PRO 35 CO 0.99 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.51 2ger n ASP 36 N -2.39 0.00 -2.97 1.44 8.00 -1.26 -5.12 116.55 114.25 2ger n ASP 36 Ca -0.01 -0.46 -0.12 0.00 0.71 0.00 0.00 54.79 54.90 2ger n ASP 36 Cb 0.06 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.13 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 0.46 -3.17 -1.24 2.81 -1.26 -4.94 117.12 109.78 2ger n MET 37 Ca 0.00 -2.42 -0.43 0.00 -1.81 0.00 0.00 57.70 53.04 2ger n MET 37 Cb 0.00 -1.52 -0.07 0.00 -0.71 0.00 0.00 33.22 30.92 2ger n MET 37 CO 0.00 0.00 0.00 0.16 1.51 0.00 0.00 175.97 177.64 2ger s ASP 38 N 0.31 6.25 0.00 7.83 -4.77 -1.26 -4.87 116.67 120.15 2ger s ASP 38 Ca 0.31 -0.70 0.00 0.00 -3.30 0.00 0.00 52.55 48.86 2ger s ASP 38 Cb 0.04 -2.29 0.00 0.00 -1.09 0.00 0.00 42.92 39.58 2ger s ASP 38 CO -0.12 -0.81 0.00 0.18 0.70 0.00 0.00 175.17 175.12 2ger n LEU 39 N 6.12 0.00 0.00 2.11 4.77 -1.26 -1.46 117.00 127.27 2ger n LEU 39 Ca -0.05 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.93 2ger n LEU 39 Cb 0.46 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.55 2ger n LEU 39 CO 0.53 0.00 0.00 0.00 -1.33 0.00 0.00 177.39 176.59 2ger n ALA 40 N -3.10 0.00 -1.00 -1.18 0.00 -1.26 -1.86 120.51 112.11 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 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 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 0.00 0.00 -0.29 0.00 -1.04 -0.54 -1.87 114.28 110.54 2ger n THR 41 Ca 0.00 0.80 -0.04 0.00 -2.04 0.00 0.00 64.05 62.77 2ger n THR 41 Cb 0.00 -1.64 -0.01 0.00 -1.82 0.00 0.00 70.33 66.85 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 -0.44 -0.43 -0.10 12.58 0.31 -1.10 -1.54 118.33 127.61 2ger n VAL 42 Ca 0.00 1.71 -0.12 0.00 -0.01 0.00 0.00 64.34 65.92 2ger n VAL 42 Cb 0.00 -2.19 0.01 0.00 -0.91 0.00 0.00 33.84 30.75 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 0.93 0.10 4.52 0.87 -1.49 -3.21 113.55 115.27 2ger h SER 43 Ca 0.19 -0.41 0.01 0.00 -1.23 0.00 0.00 61.79 60.36 2ger h SER 43 Cb 0.37 -0.26 -0.02 0.00 -0.44 0.00 0.00 62.40 62.05 2ger h SER 43 CO -0.70 1.18 -0.19 0.00 -0.53 0.00 0.00 176.83 176.60 2ger h ALA 44 N 0.86 -0.31 -0.50 6.23 0.00 -0.53 -2.73 119.26 122.29 2ger h ALA 44 Ca 0.07 -0.03 0.09 0.00 0.00 0.00 0.00 54.91 55.03 2ger h ALA 44 Cb 0.93 0.29 -0.10 0.00 0.00 0.00 0.00 17.79 18.91 2ger h ALA 44 CO 0.09 -0.71 -0.39 -0.07 0.00 0.00 0.00 179.25 178.17 2ger h LEU 45 N -0.36 -1.31 -0.85 0.00 3.38 -1.53 0.28 115.31 114.91 2ger h LEU 45 Ca 0.02 0.22 0.28 0.00 0.09 0.00 0.00 57.88 58.50 2ger h LEU 45 Cb 0.38 0.60 -0.16 0.00 0.09 0.00 0.00 40.66 41.57 2ger h LEU 45 CO -0.10 -0.33 0.19 0.54 0.09 0.00 0.00 178.44 178.82 2ger n ARG 46 N -5.42 -0.06 0.01 1.13 1.74 -1.04 0.15 116.66 113.18 2ger n ARG 46 Ca 0.02 1.24 -0.13 0.00 -0.77 0.00 0.00 57.85 58.21 2ger n ARG 46 Cb 0.35 -2.07 -0.10 0.00 -1.02 0.00 0.00 32.46 29.63 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 -0.07 -1.04 5.56 1.57 -0.46 -3.18 116.57 118.94 2ger h LYS 47 Ca 0.60 0.01 0.30 0.00 -1.87 0.00 0.00 60.65 59.68 2ger h LYS 47 Cb 1.40 0.02 -0.13 0.00 0.08 0.00 0.00 32.23 33.60 2ger h LYS 47 CO -0.75 0.43 0.63 1.98 -0.57 0.00 0.00 179.45 181.17 2ger h MET 48 N -0.62 0.39 0.00 3.15 4.05 0.30 -3.44 114.93 118.76 2ger h MET 48 Ca -0.01 -0.02 0.00 0.00 -0.28 0.00 0.00 59.70 59.39 2ger h MET 48 Cb 0.54 -0.09 0.00 0.00 -0.80 0.00 0.00 31.60 31.25 2ger h MET 48 CO 0.01 0.26 0.00 0.41 0.23 0.00 0.00 176.91 177.82 2ger n GLY 49 N -1.36 0.50 3.71 1.39 0.00 -0.14 -4.86 105.19 104.43 2ger n GLY 49 Ca 0.29 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 46.01 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 -1.46 2.63 -0.24 1.61 1.01 -1.20 -3.24 120.40 119.51 2ger s VAL 50 Ca 0.00 0.21 -0.07 0.00 0.00 0.00 0.00 61.98 62.12 2ger s VAL 50 Cb 0.00 -2.45 -0.03 0.00 0.00 0.00 0.00 36.38 33.91 2ger s VAL 50 CO 0.00 -0.27 0.05 -0.54 0.00 0.00 0.00 175.10 174.34 2ger s LYS 51 N -4.77 3.64 -0.16 2.72 1.02 0.17 -4.57 119.74 117.80 2ger s LYS 51 Ca 0.64 -0.49 -0.03 0.00 0.02 0.00 0.00 55.97 56.11 2ger s LYS 51 Cb -0.20 -3.26 -0.02 0.00 -0.52 0.00 0.00 37.83 33.83 2ger s LYS 51 CO 0.57 -0.14 -0.05 -0.51 -0.92 0.00 0.00 175.35 174.30 2ger s LEU 52 N 1.45 3.14 -0.05 3.17 1.43 -1.26 0.05 118.68 126.61 2ger s LEU 52 Ca 0.05 -0.18 -0.00 0.00 -1.03 0.00 0.00 54.13 52.97 2ger s LEU 52 Cb -0.15 -1.75 0.03 0.00 0.03 0.00 0.00 46.19 44.35 2ger s LEU 52 CO 0.03 0.16 -0.01 -0.89 0.23 0.00 0.00 176.35 175.86 2ger s THR 53 N 0.43 0.37 0.52 5.49 2.01 -0.12 -4.95 115.64 119.39 2ger s THR 53 Ca -0.05 0.05 0.26 0.00 0.31 0.00 0.00 61.69 62.27 2ger s THR 53 Cb -0.15 -0.48 0.31 0.00 0.01 0.00 0.00 72.50 72.20 2ger s THR 53 CO 0.03 0.23 2.17 1.55 -0.69 0.00 0.00 174.62 177.90 2ger h PRO 54 N 7.79 0.00 -5.95 4.92 0.13 -1.83 -2.63 132.00 134.43 2ger h PRO 54 Ca -0.29 0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.25 2ger h PRO 54 Cb 1.13 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 32.18 2ger h PRO 54 CO 0.36 0.05 0.56 -1.01 -0.23 0.00 0.00 178.00 177.73 2ger s HIS 55 N -4.53 3.21 0.23 1.56 3.76 -1.26 -4.43 115.29 113.82 2ger s HIS 55 Ca -0.04 1.01 -0.06 0.00 -0.15 0.00 0.00 55.06 55.82 2ger s HIS 55 Cb 0.15 -3.33 0.22 0.00 1.11 0.00 0.00 32.58 30.72 2ger s HIS 55 CO 0.58 -0.60 1.75 -0.91 -0.85 0.00 0.00 174.74 174.72 2ger h ASN 56 N 8.01 0.97 -0.29 1.40 2.35 -1.97 -3.28 115.58 122.76 2ger h ASN 56 Ca -0.23 -0.20 0.05 0.00 -0.55 0.00 0.00 56.30 55.37 2ger h ASN 56 Cb 1.08 -0.25 -0.04 0.00 0.05 0.00 0.00 38.32 39.15 2ger h ASN 56 CO 0.93 0.94 0.01 0.11 -1.65 0.00 0.00 177.43 177.77 2ger h LYS 57 N 0.97 0.09 -0.90 0.81 1.57 -1.94 -2.02 116.57 115.16 2ger h LYS 57 Ca 0.20 -0.01 0.25 0.00 -1.87 0.00 0.00 60.65 59.23 2ger h LYS 57 Cb 0.36 -0.02 -0.15 0.00 0.08 0.00 0.00 32.23 32.51 2ger h LYS 57 CO 0.00 0.06 0.27 0.93 -0.57 0.00 0.00 179.45 180.15 2ger h GLU 58 N 0.10 0.20 0.00 3.15 5.08 -1.97 0.17 114.58 121.31 2ger h GLU 58 Ca 0.14 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 2ger h GLU 58 Cb 0.18 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.38 2ger h GLU 58 CO -0.22 0.13 -0.00 1.15 -1.00 0.00 0.00 179.01 179.07 2ger h THR 59 N 0.21 0.00 -0.98 1.13 2.02 -1.50 0.36 112.91 114.14 2ger h THR 59 Ca 0.58 0.00 0.30 0.00 0.77 0.00 0.00 66.41 68.06 2ger h THR 59 Cb 1.21 0.00 -0.18 0.00 -1.74 0.00 0.00 68.15 67.44 2ger h THR 59 CO -0.67 0.00 0.12 0.52 0.37 0.00 0.00 175.52 175.87 2ger n VAL 60 N -2.43 -0.41 0.45 3.16 0.31 0.43 0.37 118.33 120.21 2ger n VAL 60 Ca -0.00 2.13 0.12 0.00 -0.01 0.00 0.00 64.34 66.58 2ger n VAL 60 Cb 0.00 -3.18 0.47 0.00 -0.91 0.00 0.00 33.84 30.22 2ger n VAL 60 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2ger n GLN 61 N -5.42 0.20 -0.18 5.55 6.02 -0.21 -2.15 117.38 121.18 2ger n GLN 61 Ca 0.26 0.37 0.11 0.00 -0.01 0.00 0.00 57.00 57.73 2ger n GLN 61 Cb 0.86 -1.84 0.20 0.00 1.02 0.00 0.00 30.24 30.47 2ger n GLN 61 CO 0.00 0.00 0.00 1.58 -1.01 0.00 0.00 177.06 177.63 2ger n HIS 62 N -2.21 0.47 -4.23 1.08 -0.00 1.17 -4.94 115.22 106.56 2ger n HIS 62 Ca 0.03 -0.27 -0.20 0.00 0.46 0.00 0.00 57.72 57.74 2ger n HIS 62 Cb 0.27 -0.00 -0.16 0.00 -0.12 0.00 0.00 29.99 29.97 2ger n HIS 62 CO 0.00 0.00 0.00 -1.54 0.46 0.00 0.00 176.34 175.26 2ger s SER 63 N -1.35 1.00 0.03 0.26 1.04 -0.47 -4.38 113.70 109.83 2ger s SER 63 Ca 0.35 -0.15 -0.14 0.00 0.48 0.00 0.00 55.95 56.50 2ger s SER 63 Cb 0.20 -0.46 -0.34 0.00 0.10 0.00 0.00 66.02 65.52 2ger s SER 63 CO 0.28 -0.03 0.98 0.44 0.98 0.00 0.00 173.24 175.89 2ger h ASP 64 N 7.02 0.77 -3.32 7.02 5.19 -1.50 -3.44 116.42 128.16 2ger h ASP 64 Ca -0.37 -0.85 -0.68 0.00 -0.62 0.00 0.00 57.03 54.51 2ger h ASP 64 Cb 1.16 -0.25 -0.32 0.00 0.18 0.00 0.00 39.33 40.10 2ger h ASP 64 CO 0.48 1.67 -0.87 0.54 -3.12 0.00 0.00 179.24 177.95 2ger s VAL 65 N -2.61 2.18 -0.03 -1.35 0.11 -1.18 -0.46 120.40 117.06 2ger s VAL 65 Ca -0.09 -0.97 0.05 0.00 -2.93 0.00 0.00 61.98 58.03 2ger s VAL 65 Cb 0.05 -1.84 -0.01 0.00 -1.53 0.00 0.00 36.38 33.04 2ger s VAL 65 CO 0.93 0.55 -0.17 -0.22 -3.33 0.00 0.00 175.10 172.86 2ger s LEU 66 N 0.40 1.98 0.07 2.54 2.96 -0.13 -2.66 118.68 123.83 2ger s LEU 66 Ca -0.17 -0.34 0.01 0.00 -0.22 0.00 0.00 54.13 53.42 2ger s LEU 66 Cb -0.17 -0.94 -0.04 0.00 0.50 0.00 0.00 46.19 45.53 2ger s LEU 66 CO 0.07 0.19 0.15 -0.36 -1.32 0.00 0.00 176.35 175.08 2ger s PHE 67 N -0.20 3.36 -0.80 5.38 0.40 0.19 -2.70 117.98 123.61 2ger s PHE 67 Ca 0.02 0.17 0.02 0.00 -0.60 0.00 0.00 56.93 56.54 2ger s PHE 67 Cb -0.09 -1.69 0.32 0.00 0.51 0.00 0.00 43.02 42.06 2ger s PHE 67 CO 0.01 0.56 1.31 1.28 0.70 0.00 0.00 175.22 179.07 2ger n LEU 68 N 0.37 5.68 -2.18 -0.37 4.77 -1.14 -0.25 117.00 123.88 2ger n LEU 68 Ca -0.07 -5.50 -0.05 0.00 -0.03 0.00 0.00 56.01 50.36 2ger n LEU 68 Cb 0.51 -0.87 -0.07 0.00 -2.33 0.00 0.00 43.42 40.66 2ger n LEU 68 CO 0.48 2.14 0.98 0.00 -1.33 0.00 0.00 177.39 179.67 2ger n ALA 69 N 0.11 3.56 -2.45 -1.18 0.00 -1.18 -3.99 120.51 115.38 2ger n ALA 69 Ca 0.36 -0.79 -0.31 0.00 0.00 0.00 0.00 53.44 52.70 2ger n ALA 69 Cb 0.34 -2.18 -0.15 0.00 0.00 0.00 0.00 19.45 17.46 2ger n ALA 69 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2ger s VAL 70 N 1.86 2.28 0.11 0.00 1.01 -1.25 -4.53 120.40 119.89 2ger s VAL 70 Ca 0.29 -1.01 -0.30 0.00 0.00 0.00 0.00 61.98 60.96 2ger s VAL 70 Cb 0.14 -1.82 -0.16 0.00 0.00 0.00 0.00 36.38 34.53 2ger s VAL 70 CO 0.00 0.58 0.67 0.29 0.00 0.00 0.00 175.10 176.64 2ger n LYS 71 N 2.54 0.00 -0.54 2.72 5.02 -1.26 -4.62 118.16 122.02 2ger n LYS 71 Ca -0.17 0.00 0.46 0.00 -2.02 0.00 0.00 58.31 56.58 2ger n LYS 71 Cb 0.51 -1.09 0.76 0.00 -0.02 0.00 0.00 35.03 35.20 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 1.64 0.00 -0.01 1.97 0.11 -1.90 0.03 132.00 133.84 2ger h PRO 72 Ca -0.34 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.77 2ger h PRO 72 Cb 1.30 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.41 2ger h PRO 72 CO 0.55 0.00 -0.41 -2.39 -0.21 0.00 0.00 178.00 175.53 2ger n HIS 73 N -3.91 0.00 -0.03 0.65 1.44 -1.26 -4.02 115.22 108.09 2ger n HIS 73 Ca 0.37 0.00 -0.13 0.00 -2.01 0.00 0.00 57.72 55.94 2ger n HIS 73 Cb 1.75 -0.14 -0.14 0.00 0.12 0.00 0.00 29.99 31.58 2ger n HIS 73 CO 0.00 0.00 0.00 -0.89 -2.81 0.00 0.00 176.34 172.64 2ger n ILE 74 N -0.93 1.63 -0.40 0.61 5.41 -0.01 -4.23 119.36 121.43 2ger n ILE 74 Ca 0.09 -0.75 -0.08 0.00 1.00 0.00 0.00 62.75 63.02 2ger n ILE 74 Cb 0.35 -1.20 -0.05 0.00 -0.71 0.00 0.00 39.64 38.03 2ger n ILE 74 CO 0.00 0.00 0.00 0.40 0.00 0.00 0.00 176.55 176.95 2ger h ILE 75 N 0.02 0.00 -1.68 1.39 2.04 -1.68 1.30 117.51 118.91 2ger h ILE 75 Ca -0.38 0.00 0.52 0.00 1.00 0.00 0.00 64.86 66.00 2ger h ILE 75 Cb 2.04 0.00 -0.10 0.00 -0.74 0.00 0.00 36.82 38.02 2ger h ILE 75 CO 0.06 0.00 1.16 -2.65 0.00 0.00 0.00 178.15 176.72 2ger n PRO 76 N -5.33 -0.02 0.00 2.37 -0.02 -1.26 0.81 135.00 131.55 2ger n PRO 76 Ca 0.05 1.13 0.00 0.00 -2.02 0.00 0.00 63.50 62.66 2ger n PRO 76 Cb 0.31 -2.43 0.00 0.00 -0.02 0.00 0.00 33.50 31.36 2ger n PRO 76 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 2ger n PHE 77 N -4.22 0.00 -0.32 6.00 3.01 0.44 -4.08 117.46 118.29 2ger n PHE 77 Ca 0.42 0.00 0.04 0.00 1.01 0.00 0.00 57.45 58.92 2ger n PHE 77 Cb 1.78 -0.30 0.11 0.00 -0.01 0.00 0.00 39.48 41.06 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 -1.40 -0.38 -0.20 4.37 5.41 -0.63 0.14 119.36 126.68 2ger n ILE 78 Ca 0.00 2.01 0.30 0.00 1.00 0.00 0.00 62.75 66.06 2ger n ILE 78 Cb 0.00 -2.76 0.61 0.00 -0.71 0.00 0.00 39.64 36.77 2ger n ILE 78 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 176.55 176.80 2ger h LEU 79 N 0.00 0.00 0.00 1.39 5.85 0.23 -2.70 115.31 120.08 2ger h LEU 79 Ca 0.40 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.12 2ger h LEU 79 Cb 0.62 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.65 2ger h LEU 79 CO -0.90 0.00 0.00 0.47 -0.34 0.00 0.00 178.44 177.67 2ger n ASP 80 N -3.55 0.00 -0.01 1.25 8.00 0.38 -2.92 116.55 119.70 2ger n ASP 80 Ca 0.22 0.00 0.02 0.00 0.71 0.00 0.00 54.79 55.73 2ger n ASP 80 Cb 1.30 0.00 0.03 0.00 -0.02 0.00 0.00 41.12 42.43 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 -0.64 0.00 0.00 -1.24 2.13 -1.04 0.95 120.64 120.80 2ger n GLU 81 Ca 0.00 0.09 0.00 0.00 0.66 0.00 0.00 57.16 57.91 2ger n GLU 81 Cb 0.00 -0.24 0.00 0.00 0.27 0.00 0.00 31.44 31.47 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 -1.24 0.00 0.04 6.31 5.41 -1.09 -4.60 119.36 124.19 2ger n ILE 82 Ca 0.02 -0.07 0.20 0.00 1.00 0.00 0.00 62.75 63.90 2ger n ILE 82 Cb 0.13 0.52 0.56 0.00 -0.71 0.00 0.00 39.64 40.15 2ger n ILE 82 CO 0.00 0.00 0.00 1.23 0.00 0.00 0.00 176.55 177.78 2ger h GLY 83 N 0.00 0.00 1.33 7.39 0.00 0.71 2.03 103.07 114.53 2ger h GLY 83 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 47.33 47.09 2ger h GLY 83 CO 0.00 0.00 -0.93 0.00 0.00 0.00 0.00 176.54 175.61 2ger h ALA 84 N 0.96 0.28 -0.01 3.60 0.00 -1.82 -3.24 119.26 119.03 2ger h ALA 84 Ca 0.25 -0.67 0.00 0.00 0.00 0.00 0.00 54.91 54.49 2ger h ALA 84 Cb 1.80 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.60 2ger h ALA 84 CO -0.00 0.73 -0.03 -0.25 0.00 0.00 0.00 179.25 179.69 2ger n ASP 85 N -3.84 1.12 -4.75 0.00 8.00 0.67 -4.86 116.55 112.88 2ger n ASP 85 Ca -0.08 -1.28 -0.40 0.00 0.71 0.00 0.00 54.79 53.73 2ger n ASP 85 Cb 0.82 0.01 -0.04 0.00 -0.02 0.00 0.00 41.12 41.89 2ger n ASP 85 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 2ger s ILE 86 N -2.09 3.47 0.00 0.53 2.07 -0.08 -4.84 121.20 120.26 2ger s ILE 86 Ca 0.38 1.43 0.00 0.00 -1.41 0.00 0.00 60.65 61.04 2ger s ILE 86 Cb 0.21 -3.91 0.00 0.00 0.13 0.00 0.00 42.46 38.89 2ger s ILE 86 CO 0.37 0.32 0.00 -0.62 -1.91 0.00 0.00 174.94 173.10 2ger n GLU 87 N 1.43 3.70 -0.07 3.50 1.02 -1.26 -4.87 120.64 124.10 2ger n GLU 87 Ca -0.00 0.00 -0.04 0.00 -0.02 0.00 0.00 57.16 57.10 2ger n GLU 87 Cb 0.45 0.00 -0.01 0.00 -0.02 0.00 0.00 31.44 31.85 2ger n GLU 87 CO 0.00 0.00 0.00 -0.44 1.18 0.00 0.00 177.13 177.87 2ger h ASP 88 N 0.00 0.00 -0.25 1.62 3.32 -2.00 -3.41 116.42 115.70 2ger h ASP 88 Ca 0.00 0.00 0.03 0.00 0.02 0.00 0.00 57.03 57.08 2ger h ASP 88 Cb 0.00 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 39.49 2ger h ASP 88 CO 0.00 0.72 -0.41 0.08 -1.72 0.00 0.00 179.24 177.90 2ger h ARG 89 N -0.97 -0.32 0.00 3.56 0.11 -1.99 -3.45 114.38 111.33 2ger h ARG 89 Ca 0.00 0.02 0.00 0.00 0.10 0.00 0.00 59.98 60.10 2ger h ARG 89 Cb 0.47 0.07 0.00 0.00 1.11 0.00 0.00 29.97 31.62 2ger h ARG 89 CO 0.00 -0.22 0.00 0.72 0.10 0.00 0.00 179.97 180.57 2ger n HIS 90 N -4.69 0.00 -4.77 4.08 8.25 -1.19 -4.95 115.22 111.95 2ger n HIS 90 Ca -0.03 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.10 2ger n HIS 90 Cb 0.26 0.00 -0.12 0.00 1.12 0.00 0.00 29.99 31.25 2ger n HIS 90 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2ger s ILE 91 N 0.00 3.34 -0.43 1.59 1.01 0.39 -4.48 121.20 122.62 2ger s ILE 91 Ca 0.00 -0.62 -0.01 0.00 0.00 0.00 0.00 60.65 60.03 2ger s ILE 91 Cb 0.00 -2.34 0.12 0.00 0.01 0.00 0.00 42.46 40.25 2ger s ILE 91 CO 0.00 0.59 0.21 -0.69 0.00 0.00 0.00 174.94 175.05 2ger s VAL 92 N -0.76 3.04 -0.09 2.92 1.01 0.48 -0.96 120.40 126.03 2ger s VAL 92 Ca 0.12 -2.38 -0.14 0.00 0.00 0.00 0.00 61.98 59.58 2ger s VAL 92 Cb -0.11 -3.10 -0.05 0.00 0.00 0.00 0.00 36.38 33.12 2ger s VAL 92 CO 0.01 -0.71 0.33 0.68 0.00 0.00 0.00 175.10 175.42 2ger s VAL 93 N 0.77 5.22 -0.04 2.92 -7.23 -1.10 -1.54 120.40 119.41 2ger s VAL 93 Ca 0.11 0.65 0.03 0.00 -1.81 0.00 0.00 61.98 60.97 2ger s VAL 93 Cb -0.22 -3.65 0.00 0.00 0.56 0.00 0.00 36.38 33.07 2ger s VAL 93 CO -0.05 0.48 -0.13 -0.55 -0.31 0.00 0.00 175.10 174.54 2ger s SER 94 N -0.26 1.72 -0.05 4.85 0.15 -1.08 -2.86 113.70 116.17 2ger s SER 94 Ca 0.20 -0.28 0.02 0.00 0.70 0.00 0.00 55.95 56.59 2ger s SER 94 Cb -0.14 -0.48 0.01 0.00 -1.71 0.00 0.00 66.02 63.70 2ger s SER 94 CO 0.08 0.11 -0.10 0.00 1.20 0.00 0.00 173.24 174.53 2ger n ALA 96 N 3.76 0.00 -1.55 0.00 0.00 -1.26 -4.47 120.51 116.99 2ger n ALA 96 Ca -0.23 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 52.78 2ger n ALA 96 Cb 0.52 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.96 2ger n ALA 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2ger n ALA 97 N -0.15 -0.59 -0.11 0.00 0.00 -1.26 -3.76 120.51 114.65 2ger n ALA 97 Ca 0.00 0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.74 2ger n ALA 97 Cb 0.00 -1.95 0.00 0.00 0.00 0.00 0.00 19.45 17.50 2ger n ALA 97 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ger n GLY 98 N 1.39 1.23 0.00 0.00 0.00 -1.26 -4.77 105.19 101.78 2ger n GLY 98 Ca 0.11 0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.21 2ger n GLY 98 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2ger n VAL 99 N 0.00 0.00 -0.83 1.61 0.31 -1.25 -4.81 118.33 113.36 2ger n VAL 99 Ca 0.00 0.00 -0.30 0.00 -0.01 0.00 0.00 64.34 64.03 2ger n VAL 99 Cb 0.00 0.00 0.17 0.00 -0.91 0.00 0.00 33.84 33.10 2ger n VAL 99 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 2ger s THR 100 N 0.00 2.33 -0.10 2.52 2.01 -1.26 -4.90 115.64 116.25 2ger s THR 100 Ca 0.00 0.11 -0.17 0.00 0.31 0.00 0.00 61.69 61.94 2ger s THR 100 Cb 0.00 -2.28 -0.14 0.00 0.01 0.00 0.00 72.50 70.08 2ger s THR 100 CO 0.00 -0.14 0.56 0.40 -0.69 0.00 0.00 174.62 174.75 2ger h ILE 101 N -1.89 0.90 -0.71 1.82 2.04 -1.97 -2.19 117.51 115.50 2ger h ILE 101 Ca -0.49 -1.50 0.06 0.00 1.00 0.00 0.00 64.86 63.94 2ger h ILE 101 Cb 1.28 1.64 -0.09 0.00 -0.74 0.00 0.00 36.82 38.92 2ger h ILE 101 CO 0.47 0.28 -0.43 -1.28 0.00 0.00 0.00 178.15 177.19 2ger h SER 102 N -0.96 -1.58 -0.35 1.72 0.87 -1.98 0.26 113.55 111.54 2ger h SER 102 Ca -0.01 0.24 0.06 0.00 -1.23 0.00 0.00 61.79 60.85 2ger h SER 102 Cb 0.53 0.70 -0.08 0.00 -0.44 0.00 0.00 62.40 63.10 2ger h SER 102 CO 0.01 -0.17 -0.44 0.77 -0.53 0.00 0.00 176.83 176.47 2ger h SER 103 N -0.01 -1.44 -0.33 6.23 4.64 -1.95 0.24 113.55 120.93 2ger h SER 103 Ca 0.11 0.21 0.10 0.00 -0.47 0.00 0.00 61.79 61.74 2ger h SER 103 Cb 0.30 0.62 -0.01 0.00 -0.31 0.00 0.00 62.40 63.00 2ger h SER 103 CO -0.68 -0.38 0.32 0.40 -0.87 0.00 0.00 176.83 175.62 2ger h ILE 104 N -0.37 0.52 0.10 0.95 2.04 -0.32 -2.79 117.51 117.65 2ger h ILE 104 Ca 0.12 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.97 2ger h ILE 104 Cb 0.59 0.76 0.00 0.00 -0.74 0.00 0.00 36.82 37.43 2ger h ILE 104 CO -0.54 0.00 -0.05 -0.33 0.00 0.00 0.00 178.15 177.23 2ger h GLU 105 N 0.00 -0.13 -2.38 2.37 5.08 0.27 -3.29 114.58 116.50 2ger h GLU 105 Ca 0.16 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.53 2ger h GLU 105 Cb 0.79 0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.07 2ger h GLU 105 CO -0.00 0.17 0.17 1.63 -1.00 0.00 0.00 179.01 179.98 2ger n LYS 106 N -4.84 0.00 0.10 2.33 5.02 -0.49 0.54 118.16 120.82 2ger n LYS 106 Ca -0.05 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.24 2ger n LYS 106 Cb 0.18 -1.39 0.00 0.00 -0.02 0.00 0.00 35.03 33.80 2ger n LYS 106 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2ger n LYS 107 N 2.25 0.00 0.17 1.97 4.76 -1.26 -4.75 118.16 121.30 2ger n LYS 107 Ca 0.00 0.00 0.13 0.00 -2.87 0.00 0.00 58.31 55.57 2ger n LYS 107 Cb 0.00 0.00 0.52 0.00 -1.84 0.00 0.00 35.03 33.71 2ger n LYS 107 CO 0.00 0.00 0.00 -0.07 -1.37 0.00 0.00 177.40 175.96 2ger h LEU 108 N 0.00 0.00 -1.12 -0.35 3.38 -0.44 -0.12 115.31 116.67 2ger h LEU 108 Ca 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 2ger h LEU 108 Cb 0.00 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.71 2ger h LEU 108 CO 0.00 0.00 0.52 0.28 0.09 0.00 0.00 178.44 179.33 2ger h SER 109 N 0.00 0.98 0.00 -0.43 0.02 -0.16 0.51 113.55 114.48 2ger h SER 109 Ca 0.00 -0.05 0.00 0.00 -0.84 0.00 0.00 61.79 60.90 2ger h SER 109 Cb 0.47 -0.25 0.00 0.00 0.14 0.00 0.00 62.40 62.76 2ger h SER 109 CO 0.00 0.74 0.00 0.00 -1.14 0.00 0.00 176.83 176.43 2ger n ALA 110 N -2.41 1.61 -3.00 3.77 0.00 -0.06 -4.58 120.51 115.85 2ger n ALA 110 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.53 2ger n ALA 110 Cb 0.05 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.50 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 0.51 0.00 -0.14 0.00 3.01 0.17 -4.93 117.46 116.08 2ger n PHE 111 Ca 0.00 0.00 -0.06 0.00 1.01 0.00 0.00 57.45 58.40 2ger n PHE 111 Cb 0.11 0.00 -0.01 0.00 -0.01 0.00 0.00 39.48 39.57 2ger n PHE 111 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 2ger n ARG 112 N 0.00 0.00 -0.35 -1.08 5.12 -1.25 -4.79 116.66 114.32 2ger n ARG 112 Ca 0.00 0.00 -0.09 0.00 -1.93 0.00 0.00 57.85 55.83 2ger n ARG 112 Cb 0.00 -0.14 -0.08 0.00 -1.16 0.00 0.00 32.46 31.08 2ger n ARG 112 CO 0.00 0.00 0.00 -2.30 -1.93 0.00 0.00 177.63 173.40 2ger n PRO 113 N 0.14 -0.36 -3.70 5.56 -0.02 -1.26 -4.04 135.00 131.32 2ger n PRO 113 Ca 0.02 1.28 -0.29 0.00 -2.02 0.00 0.00 63.50 62.48 2ger n PRO 113 Cb 0.01 -1.88 -0.13 0.00 -0.02 0.00 0.00 33.50 31.48 2ger n PRO 113 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2ger s ALA 114 N -5.36 2.22 0.60 3.55 0.00 -1.26 -4.92 121.76 116.59 2ger s ALA 114 Ca -0.10 -2.68 -0.19 0.00 0.00 0.00 0.00 51.96 48.99 2ger s ALA 114 Cb 0.09 -1.89 -0.03 0.00 0.00 0.00 0.00 23.12 21.29 2ger s ALA 114 CO 0.51 -2.06 1.25 -2.14 0.00 0.00 0.00 175.76 173.32 2ger s PRO 115 N 0.18 2.89 -0.49 0.00 0.02 -1.26 -4.86 135.00 131.48 2ger s PRO 115 Ca 0.20 1.93 -0.18 0.00 0.02 0.00 0.00 61.00 62.96 2ger s PRO 115 Cb -0.20 -1.95 0.06 0.00 0.02 0.00 0.00 34.50 32.43 2ger s PRO 115 CO -0.03 -1.30 0.56 1.03 -0.33 0.00 0.00 177.00 176.94 2ger s ARG 116 N -3.28 3.09 -0.11 5.54 0.52 -1.26 -3.95 118.95 119.50 2ger s ARG 116 Ca 0.78 -0.97 -0.01 0.00 -0.52 0.00 0.00 55.73 55.01 2ger s ARG 116 Cb -0.33 -4.09 0.03 0.00 0.52 0.00 0.00 34.95 31.07 2ger s ARG 116 CO 0.36 -1.15 -0.05 0.08 0.02 0.00 0.00 175.30 174.57 2ger s VAL 117 N 2.38 0.84 -0.20 3.52 1.01 -1.26 -0.39 120.40 126.30 2ger s VAL 117 Ca 0.13 -0.24 -0.02 0.00 0.00 0.00 0.00 61.98 61.84 2ger s VAL 117 Cb -0.20 -0.94 0.00 0.00 0.00 0.00 0.00 36.38 35.24 2ger s VAL 117 CO 0.11 0.27 -0.11 0.27 0.00 0.00 0.00 175.10 175.64 2ger s ILE 118 N 1.78 2.78 0.20 2.22 -4.36 -0.59 -0.61 121.20 122.61 2ger s ILE 118 Ca 0.04 -0.70 -0.30 0.00 -0.26 0.00 0.00 60.65 59.44 2ger s ILE 118 Cb -0.13 -2.23 -0.08 0.00 1.25 0.00 0.00 42.46 41.27 2ger s ILE 118 CO -0.07 0.48 1.20 -0.60 0.24 0.00 0.00 174.94 176.18 2ger s ARG 119 N 1.37 4.50 0.17 0.37 3.52 0.80 -2.65 118.95 127.03 2ger s ARG 119 Ca 0.05 1.89 0.07 0.00 -0.13 0.00 0.00 55.73 57.61 2ger s ARG 119 Cb -0.14 -3.23 -0.04 0.00 -1.56 0.00 0.00 34.95 29.98 2ger s ARG 119 CO -0.07 -0.07 -0.15 0.00 -0.81 0.00 0.00 175.30 174.20 2ger s MET 121 N -3.18 0.40 0.00 0.00 0.00 -0.34 -4.23 119.30 111.95 2ger s MET 121 Ca 0.17 0.69 0.00 0.00 0.00 0.00 0.00 55.69 56.55 2ger s MET 121 Cb -0.03 -0.18 0.00 0.00 0.00 0.00 0.00 34.83 34.62 2ger s MET 121 CO 0.05 -0.60 0.00 0.25 0.00 0.00 0.00 175.02 174.72 2ger n THR 122 N 5.38 0.00 -3.67 10.11 -2.24 -1.26 -0.42 114.28 122.18 2ger n THR 122 Ca -0.04 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 61.73 2ger n THR 122 Cb 0.50 0.00 -0.01 0.00 -2.10 0.00 0.00 70.33 68.72 2ger n THR 122 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2ger s ASN 123 N 1.00 -0.14 0.25 3.42 2.20 -1.26 -4.46 114.94 115.95 2ger s ASN 123 Ca 0.00 -0.23 -0.04 0.00 -0.94 0.00 0.00 52.86 51.65 2ger s ASN 123 Cb 0.00 0.32 0.39 0.00 -2.00 0.00 0.00 41.25 39.96 2ger s ASN 123 CO 0.00 -0.58 1.83 0.71 -2.94 0.00 0.00 177.10 176.12 2ger h THR 124 N 2.00 0.96 -0.34 0.54 1.35 -1.93 -3.01 112.91 112.49 2ger h THR 124 Ca -0.25 -0.30 0.10 0.00 -0.55 0.00 0.00 66.41 65.40 2ger h THR 124 Cb 1.22 -0.01 -0.01 0.00 -1.73 0.00 0.00 68.15 67.62 2ger h THR 124 CO 0.27 0.16 0.89 -2.65 -0.25 0.00 0.00 175.52 173.94 2ger n PRO 125 N -4.68 0.02 -0.33 4.72 -0.02 -1.26 -0.02 135.00 133.43 2ger n PRO 125 Ca 0.14 0.80 0.24 0.00 -2.02 0.00 0.00 63.50 62.66 2ger n PRO 125 Cb 0.25 -2.08 0.47 0.00 -0.02 0.00 0.00 33.50 32.12 2ger n PRO 125 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2ger h VAL 126 N 0.00 0.25 -0.98 -1.45 2.07 -1.79 0.11 116.25 114.46 2ger h VAL 126 Ca 0.16 -0.09 0.28 0.00 0.82 0.00 0.00 66.70 67.87 2ger h VAL 126 Cb 1.93 -0.03 -0.04 0.00 -1.52 0.00 0.00 31.29 31.63 2ger h VAL 126 CO -0.00 0.05 0.77 0.58 0.02 0.00 0.00 177.57 178.99 2ger h VAL 127 N 0.26 0.39 0.06 2.57 2.07 -0.63 -0.04 116.25 120.93 2ger h VAL 127 Ca 0.74 0.00 -0.38 0.00 0.82 0.00 0.00 66.70 67.88 2ger h VAL 127 Cb 1.71 0.44 -0.04 0.00 -1.52 0.00 0.00 31.29 31.88 2ger h VAL 127 CO -0.64 0.00 -2.22 0.55 0.02 0.00 0.00 177.57 175.28 2ger n VAL 128 N -4.02 1.64 0.00 2.57 3.14 0.38 -4.48 118.33 117.56 2ger n VAL 128 Ca 0.21 -0.61 0.00 0.00 -2.96 0.00 0.00 64.34 60.98 2ger n VAL 128 Cb 1.10 -1.60 0.00 0.00 -1.06 0.00 0.00 33.84 32.29 2ger n VAL 128 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91 2ger n ARG 129 N -3.40 0.00 -1.00 1.45 1.74 -0.03 -4.97 116.66 110.45 2ger n ARG 129 Ca -0.39 0.00 0.05 0.00 -0.77 0.00 0.00 57.85 56.74 2ger n ARG 129 Cb 1.01 0.00 0.09 0.00 -1.02 0.00 0.00 32.46 32.55 2ger n ARG 129 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2ger n GLU 130 N -0.07 0.65 -1.17 5.56 -0.58 -1.14 -2.23 120.64 121.66 2ger n GLU 130 Ca 0.00 -2.42 -0.29 0.00 -0.42 0.00 0.00 57.16 54.03 2ger n GLU 130 Cb 0.00 -0.72 0.18 0.00 -0.57 0.00 0.00 31.44 30.34 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 -2.41 1.56 -0.31 0.62 0.00 -1.22 -4.66 107.32 100.90 2ger s GLY 131 Ca 0.32 -0.44 -0.01 0.00 0.00 0.00 0.00 44.72 44.59 2ger s GLY 131 CO -0.11 0.20 0.10 0.00 0.00 0.00 0.00 173.10 173.30 2ger s ALA 132 N -2.98 1.43 0.10 3.20 0.00 -1.26 -0.92 121.76 121.32 2ger s ALA 132 Ca 0.66 -1.61 0.10 0.00 0.00 0.00 0.00 51.96 51.11 2ger s ALA 132 Cb -0.18 -1.60 -0.04 0.00 0.00 0.00 0.00 23.12 21.31 2ger s ALA 132 CO 0.57 -1.67 -0.24 -0.08 0.00 0.00 0.00 175.76 174.34 2ger s THR 133 N 1.66 2.41 0.01 0.00 -1.32 0.11 -4.40 115.64 114.11 2ger s THR 133 Ca 0.10 -1.58 0.03 0.00 -1.21 0.00 0.00 61.69 59.03 2ger s THR 133 Cb -0.17 -2.05 -0.01 0.00 -1.51 0.00 0.00 72.50 68.76 2ger s THR 133 CO -0.26 0.17 -0.10 0.54 -2.21 0.00 0.00 174.62 172.76 2ger s VAL 134 N -1.01 0.77 0.08 5.08 0.11 0.44 -2.93 120.40 122.93 2ger s VAL 134 Ca 0.14 -0.55 0.06 0.00 -2.93 0.00 0.00 61.98 58.70 2ger s VAL 134 Cb -0.10 -0.67 -0.03 0.00 -1.53 0.00 0.00 36.38 34.04 2ger s VAL 134 CO 0.06 0.12 -0.16 -0.72 -3.33 0.00 0.00 175.10 171.07 2ger s TYR 135 N -0.42 1.37 -0.16 1.54 -0.85 -0.58 -1.20 117.35 117.05 2ger s TYR 135 Ca 0.02 -0.44 0.01 0.00 -0.52 0.00 0.00 57.07 56.14 2ger s TYR 135 Cb -0.05 -0.77 0.00 0.00 0.38 0.00 0.00 41.96 41.53 2ger s TYR 135 CO -0.00 0.09 -0.17 0.00 -1.52 0.00 0.00 175.55 173.95 2ger s ALA 136 N -1.22 2.42 -0.02 9.51 0.00 0.94 -0.01 121.76 133.38 2ger s ALA 136 Ca 0.00 -1.08 -0.30 0.00 0.00 0.00 0.00 51.96 50.59 2ger s ALA 136 Cb -0.10 -1.17 -0.04 0.00 0.00 0.00 0.00 23.12 21.81 2ger s ALA 136 CO 0.03 -0.07 1.14 -0.08 0.00 0.00 0.00 175.76 176.77 2ger s THR 137 N 0.88 4.37 0.09 0.00 -1.32 -1.26 -0.14 115.64 118.25 2ger s THR 137 Ca -0.05 1.69 -0.02 0.00 -1.21 0.00 0.00 61.69 62.11 2ger s THR 137 Cb -0.15 -4.08 0.02 0.00 -1.51 0.00 0.00 72.50 66.78 2ger s THR 137 CO -0.02 0.06 0.07 0.61 -2.21 0.00 0.00 174.62 173.13 2ger n GLY 138 N 3.22 -2.94 0.15 6.08 0.00 0.22 -4.92 105.19 106.98 2ger n GLY 138 Ca 0.09 -1.37 -0.21 0.00 0.00 0.00 0.00 46.02 44.54 2ger n GLY 138 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2ger h THR 139 N -1.79 1.39 -2.22 2.61 2.02 -1.88 -3.35 112.91 109.69 2ger h THR 139 Ca -0.03 -2.40 -0.74 0.00 0.77 0.00 0.00 66.41 64.02 2ger h THR 139 Cb 0.09 2.84 -0.32 0.00 -1.74 0.00 0.00 68.15 69.02 2ger h THR 139 CO 0.02 0.71 0.53 1.41 0.37 0.00 0.00 175.52 178.55 2ger n HIS 140 N -4.00 3.16 -4.10 3.16 8.25 -1.25 -4.94 115.22 115.50 2ger n HIS 140 Ca -0.13 -2.95 -0.29 0.00 -0.26 0.00 0.00 57.72 54.09 2ger n HIS 140 Cb 0.86 -0.97 -0.17 0.00 1.12 0.00 0.00 29.99 30.84 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 -4.06 1.70 1.00 -1.41 0.00 -1.26 -4.02 121.76 113.72 2ger s ALA 141 Ca 0.43 -0.79 0.00 0.00 0.00 0.00 0.00 51.96 51.60 2ger s ALA 141 Cb 0.24 -0.97 0.00 0.00 0.00 0.00 0.00 23.12 22.39 2ger s ALA 141 CO -0.16 -0.31 0.00 1.04 0.00 0.00 0.00 175.76 176.33 2ger n GLN 142 N 4.67 -0.38 0.00 0.00 6.02 -1.26 -4.92 117.38 121.51 2ger n GLN 142 Ca -0.17 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.82 2ger n GLN 142 Cb 0.50 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.76 2ger n GLN 142 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 2ger n VAL 143 N -1.90 0.00 0.00 5.09 0.31 -1.26 -3.59 118.33 116.98 2ger n VAL 143 Ca 0.00 0.50 0.00 0.00 -0.01 0.00 0.00 64.34 64.83 2ger n VAL 143 Cb 0.00 -1.49 0.00 0.00 -0.91 0.00 0.00 33.84 31.44 2ger n VAL 143 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 2ger n GLU 144 N -2.02 0.00 0.07 5.55 0.00 -1.26 0.10 120.64 123.08 2ger n GLU 144 Ca 0.00 0.21 -0.12 0.00 0.00 0.00 0.00 57.16 57.26 2ger n GLU 144 Cb 0.00 -1.56 -0.08 0.00 0.00 0.00 0.00 31.44 29.80 2ger n GLU 144 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.13 177.35 2ger h ASP 145 N 0.00 -0.20 -0.00 4.31 3.58 -1.93 -2.94 116.42 119.23 2ger h ASP 145 Ca 0.00 -0.33 -0.06 0.00 0.42 0.00 0.00 57.03 57.07 2ger h ASP 145 Cb 0.12 0.05 0.00 0.00 1.72 0.00 0.00 39.33 41.22 2ger h ASP 145 CO 0.00 0.29 -0.22 1.23 -2.88 0.00 0.00 179.24 177.65 2ger h GLY 146 N -0.77 0.17 -0.79 -0.78 0.00 -0.39 -3.20 103.07 97.31 2ger h GLY 146 Ca -0.02 -0.30 0.39 0.00 0.00 0.00 0.00 47.33 47.39 2ger h GLY 146 CO 0.04 0.26 0.89 3.21 0.00 0.00 0.00 176.54 180.95 2ger h ARG 147 N -0.53 0.12 -0.03 4.80 3.08 -1.47 2.67 114.38 123.02 2ger h ARG 147 Ca -0.03 -0.01 -0.15 0.00 0.07 0.00 0.00 59.98 59.87 2ger h ARG 147 Cb 0.98 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.99 2ger h ARG 147 CO 0.04 0.08 -0.67 1.25 -1.07 0.00 0.00 179.97 179.60 2ger h LEU 148 N 0.12 0.15 0.14 3.04 5.85 -1.53 -2.89 115.31 120.19 2ger h LEU 148 Ca 0.71 -0.09 -0.01 0.00 0.84 0.00 0.00 57.88 59.33 2ger h LEU 148 Cb 2.41 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 43.40 2ger h LEU 148 CO -0.21 0.77 -0.07 -0.03 -0.34 0.00 0.00 178.44 178.57 2ger h MET 149 N 0.09 -0.18 0.00 1.25 4.05 0.46 -2.82 114.93 117.78 2ger h MET 149 Ca -0.01 0.01 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 2ger h MET 149 Cb 1.19 0.04 0.00 0.00 -0.80 0.00 0.00 31.60 32.03 2ger h MET 149 CO 0.10 0.13 0.00 -1.91 0.23 0.00 0.00 176.91 175.45 2ger n GLU 150 N -5.03 0.23 0.05 0.39 2.13 -0.49 -1.07 120.64 116.85 2ger n GLU 150 Ca -0.09 0.13 0.09 0.00 0.66 0.00 0.00 57.16 57.95 2ger n GLU 150 Cb 0.21 -1.50 -0.07 0.00 0.27 0.00 0.00 31.44 30.35 2ger n GLU 150 CO 0.00 0.00 0.00 1.04 -0.41 0.00 0.00 177.13 177.76 2ger n GLN 151 N -1.20 0.63 -0.07 5.31 6.02 -1.08 -3.72 117.38 123.26 2ger n GLN 151 Ca 0.06 0.03 -0.10 0.00 -0.01 0.00 0.00 57.00 56.98 2ger n GLN 151 Cb 0.08 -1.72 -0.08 0.00 1.02 0.00 0.00 30.24 29.53 2ger n GLN 151 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 2ger h LEU 152 N 0.00 0.00 -0.11 1.08 3.38 -0.96 -3.28 115.31 115.41 2ger h LEU 152 Ca -0.04 -0.58 0.00 0.00 0.09 0.00 0.00 57.88 57.35 2ger h LEU 152 Cb 1.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.87 2ger h LEU 152 CO 0.01 0.90 0.00 0.18 0.09 0.00 0.00 178.44 179.62 2ger n LEU 153 N -4.64 0.10 -0.06 1.67 4.77 -1.08 -1.86 117.00 115.90 2ger n LEU 153 Ca -0.10 -0.05 -0.04 0.00 -0.03 0.00 0.00 56.01 55.79 2ger n LEU 153 Cb 0.35 -0.05 -0.12 0.00 -2.33 0.00 0.00 43.42 41.27 2ger n LEU 153 CO 0.21 0.03 -0.92 -1.20 -1.33 0.00 0.00 177.39 174.17 2ger n SER 154 N -0.44 1.26 0.00 -1.43 7.64 -1.24 -3.88 113.62 115.53 2ger n SER 154 Ca 0.00 0.00 0.08 0.00 1.01 0.00 0.00 58.87 59.96 2ger n SER 154 Cb 0.03 1.07 0.43 0.00 -1.01 0.00 0.00 64.21 64.73 2ger n SER 154 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2ger n SER 155 N -2.45 0.00 -3.02 6.43 3.41 -0.78 -2.90 113.62 114.31 2ger n SER 155 Ca -0.20 -0.11 -0.15 0.00 -0.26 0.00 0.00 58.87 58.15 2ger n SER 155 Cb 0.86 -0.20 0.01 0.00 -0.26 0.00 0.00 64.21 64.62 2ger n SER 155 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 2ger n VAL 156 N -1.20 -0.07 0.00 -3.33 0.31 -1.24 -4.64 118.33 108.15 2ger n VAL 156 Ca 0.09 -3.51 0.00 0.00 -0.01 0.00 0.00 64.34 60.91 2ger n VAL 156 Cb 0.11 0.35 0.00 0.00 -0.91 0.00 0.00 33.84 33.39 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 0.28 0.21 3.89 2.92 0.00 -0.95 -3.68 105.19 107.86 2ger n GLY 157 Ca 0.18 -2.08 -0.34 0.00 0.00 0.00 0.00 46.02 43.78 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 3.57 -0.18 1.61 5.36 -0.10 -4.38 117.98 123.86 2ger s PHE 158 Ca 0.00 0.46 -0.12 0.00 -0.96 0.00 0.00 56.93 56.31 2ger s PHE 158 Cb 0.00 -1.91 0.06 0.00 -0.34 0.00 0.00 43.02 40.83 2ger s PHE 158 CO 0.00 0.64 0.45 0.00 -1.46 0.00 0.00 175.22 174.85 2ger s THR 160 N 0.98 0.01 0.27 0.00 -1.32 -1.15 -5.00 115.64 109.43 2ger s THR 160 Ca -0.06 -0.12 -0.23 0.00 -1.21 0.00 0.00 61.69 60.07 2ger s THR 160 Cb -0.06 -0.97 -0.09 0.00 -1.51 0.00 0.00 72.50 69.87 2ger s THR 160 CO -0.08 -0.07 0.83 -0.70 -2.21 0.00 0.00 174.62 172.39 2ger s GLU 161 N -2.07 4.41 -0.00 7.08 2.12 -1.26 -1.52 118.70 127.45 2ger s GLU 161 Ca -0.07 1.09 -0.09 0.00 0.36 0.00 0.00 54.97 56.25 2ger s GLU 161 Cb -0.01 -2.84 0.01 0.00 0.26 0.00 0.00 34.13 31.55 2ger s GLU 161 CO 0.02 0.34 0.19 0.08 -0.54 0.00 0.00 175.26 175.34 2ger s VAL 162 N -1.57 0.07 -0.32 3.70 1.01 0.98 -4.87 120.40 119.41 2ger s VAL 162 Ca 0.46 -0.61 -0.29 0.00 0.00 0.00 0.00 61.98 61.54 2ger s VAL 162 Cb -0.18 -0.48 -0.00 0.00 0.00 0.00 0.00 36.38 35.72 2ger s VAL 162 CO 0.22 -0.34 1.40 -1.61 0.00 0.00 0.00 175.10 174.78 2ger s GLU 163 N -1.33 3.77 0.03 2.72 2.02 -1.26 -4.00 118.70 120.65 2ger s GLU 163 Ca -0.14 1.23 -0.01 0.00 0.02 0.00 0.00 54.97 56.07 2ger s GLU 163 Cb -0.07 -3.96 0.05 0.00 0.10 0.00 0.00 34.13 30.25 2ger s GLU 163 CO 0.02 -1.31 0.16 -1.91 0.02 0.00 0.00 175.26 172.25 2ger n GLU 164 N 7.64 -0.01 -0.21 1.61 2.13 -1.26 0.18 120.64 130.72 2ger n GLU 164 Ca 0.16 0.16 0.31 0.00 0.66 0.00 0.00 57.16 58.45 2ger n GLU 164 Cb 0.47 -0.24 0.69 0.00 0.27 0.00 0.00 31.44 32.63 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 0.00 0.00 4.31 -0.00 -2.03 -1.11 116.42 117.59 2ger h ASP 165 Ca 0.05 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.08 2ger h ASP 165 Cb 0.07 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.40 2ger h ASP 165 CO -0.11 0.00 0.00 0.18 -0.00 0.00 0.00 179.24 179.31 2ger n LEU 166 N -3.82 0.74 0.00 0.15 4.77 0.13 -4.12 117.00 114.86 2ger n LEU 166 Ca 0.21 0.50 0.00 0.00 -0.03 0.00 0.00 56.01 56.69 2ger n LEU 166 Cb 1.19 -0.23 0.00 0.00 -2.33 0.00 0.00 43.42 42.05 2ger n LEU 166 CO 0.33 -0.23 0.00 -0.38 -1.33 0.00 0.00 177.39 175.79 2ger n ILE 167 N -1.18 0.00 -0.28 -0.08 2.08 -0.42 0.14 119.36 119.62 2ger n ILE 167 Ca 0.00 0.00 0.08 0.00 0.56 0.00 0.00 62.75 63.39 2ger n ILE 167 Cb 0.00 0.00 0.23 0.00 -0.75 0.00 0.00 39.64 39.12 2ger n ILE 167 CO 0.00 0.00 0.00 0.44 0.56 0.00 0.00 176.55 177.55 2ger h ASP 168 N 0.00 0.32 -0.10 4.38 5.19 -1.72 -2.06 116.42 122.43 2ger h ASP 168 Ca 0.00 0.12 -0.08 0.00 -0.62 0.00 0.00 57.03 56.45 2ger h ASP 168 Cb 0.00 0.10 0.00 0.00 0.18 0.00 0.00 39.33 39.61 2ger h ASP 168 CO 0.00 0.08 -0.27 0.00 -3.12 0.00 0.00 179.24 175.93 2ger h ALA 169 N 1.61 0.16 0.00 3.45 0.00 0.10 -3.10 119.26 121.48 2ger h ALA 169 Ca 0.47 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2ger h ALA 169 Cb 0.79 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.56 2ger h ALA 169 CO -0.45 0.16 0.00 0.28 0.00 0.00 0.00 179.25 179.24 2ger n VAL 170 N -4.46 0.02 -0.02 0.00 0.31 -0.78 -1.10 118.33 112.29 2ger n VAL 170 Ca -0.08 0.00 -0.04 0.00 -0.01 0.00 0.00 64.34 64.22 2ger n VAL 170 Cb 0.46 -0.14 -0.02 0.00 -0.91 0.00 0.00 33.84 33.23 2ger n VAL 170 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 2ger n THR 171 N 0.58 0.23 -0.05 2.52 -1.04 -1.17 -2.97 114.28 112.37 2ger n THR 171 Ca 0.00 -0.07 0.02 0.00 -2.04 0.00 0.00 64.05 61.97 2ger n THR 171 Cb 0.02 -1.23 0.36 0.00 -1.82 0.00 0.00 70.33 67.67 2ger n THR 171 CO 0.00 0.00 0.00 1.23 -0.64 0.00 0.00 175.07 175.66 2ger h GLY 172 N 0.01 0.68 0.00 3.41 0.00 -1.22 0.58 103.07 106.53 2ger h GLY 172 Ca -0.10 -0.28 0.00 0.00 0.00 0.00 0.00 47.33 46.95 2ger h GLY 172 CO -0.05 0.27 0.00 -0.10 0.00 0.00 0.00 176.54 176.66 2ger n LEU 173 N -4.43 0.77 0.32 3.11 0.00 -1.02 -4.02 117.00 111.73 2ger n LEU 173 Ca 0.04 0.00 0.19 0.00 0.00 0.00 0.00 56.01 56.24 2ger n LEU 173 Cb 0.09 0.00 1.07 0.00 0.00 0.00 0.00 43.42 44.57 2ger n LEU 173 CO 0.36 0.00 1.15 -1.28 0.00 0.00 0.00 177.39 177.62 2ger h SER 174 N 0.00 0.00 0.00 1.96 0.87 -1.71 -1.15 113.55 113.53 2ger h SER 174 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2ger h SER 174 Cb 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.96 2ger h SER 174 CO 0.00 0.01 0.00 0.61 -0.53 0.00 0.00 176.83 176.92 2ger n GLY 175 N -1.12 0.71 0.98 5.77 0.00 -0.04 -4.08 105.19 107.41 2ger n GLY 175 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.99 2ger n GLY 175 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2ger n SER 176 N -0.43 2.47 -0.06 1.61 7.64 0.18 -4.27 113.62 120.76 2ger n SER 176 Ca 0.00 -1.70 -0.05 0.00 1.01 0.00 0.00 58.87 58.13 2ger n SER 176 Cb 0.00 -0.43 -0.03 0.00 -1.01 0.00 0.00 64.21 62.74 2ger n SER 176 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 2ger h GLY 177 N 3.73 0.00 1.14 0.23 0.00 -1.35 -2.99 103.07 103.84 2ger h GLY 177 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 47.33 47.44 2ger h GLY 177 CO 0.00 0.00 0.33 -2.55 0.00 0.00 0.00 176.54 174.32 2ger h PRO 178 N -1.00 0.00 0.01 4.80 0.11 -1.83 0.23 132.00 134.31 2ger h PRO 178 Ca -0.02 0.00 0.02 0.00 0.11 0.00 0.00 66.00 66.11 2ger h PRO 178 Cb 0.37 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.46 2ger h PRO 178 CO -0.01 0.00 -0.14 0.00 -0.21 0.00 0.00 178.00 177.64 2ger h ALA 179 N 1.69 -0.16 -0.35 -0.75 0.00 -1.82 0.76 119.26 118.63 2ger h ALA 179 Ca 0.17 0.01 -0.06 0.00 0.00 0.00 0.00 54.91 55.03 2ger h ALA 179 Cb 0.82 0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.84 2ger h ALA 179 CO -0.00 -0.63 -0.00 1.88 0.00 0.00 0.00 179.25 180.50 2ger h TYR 180 N -0.23 0.67 -0.03 0.00 0.99 -0.48 -3.18 116.97 114.71 2ger h TYR 180 Ca 0.05 -0.12 0.04 0.00 2.00 0.00 0.00 58.73 60.69 2ger h TYR 180 Cb 0.29 -0.17 -0.05 0.00 1.00 0.00 0.00 36.73 37.79 2ger h TYR 180 CO -0.19 0.73 -0.31 0.00 -0.00 0.00 0.00 178.16 178.39 2ger h ALA 181 N 0.86 -0.42 -0.39 3.88 0.00 -0.52 -1.00 119.26 121.67 2ger h ALA 181 Ca 0.10 -0.00 0.11 0.00 0.00 0.00 0.00 54.91 55.12 2ger h ALA 181 Cb 0.46 0.55 -0.02 0.00 0.00 0.00 0.00 17.79 18.79 2ger h ALA 181 CO 0.02 -0.81 0.34 0.74 0.00 0.00 0.00 179.25 179.54 2ger h PHE 182 N -0.44 0.00 0.00 0.00 0.05 -0.85 0.86 116.94 116.56 2ger h PHE 182 Ca 0.07 0.00 -0.13 0.00 3.82 0.00 0.00 57.97 61.73 2ger h PHE 182 Cb 0.54 0.00 -0.02 0.00 2.00 0.00 0.00 35.95 38.47 2ger h PHE 182 CO -0.35 0.00 -0.64 1.15 -0.18 0.00 0.00 178.31 178.29 2ger h THR 183 N 0.00 1.18 0.10 -1.55 2.02 -1.21 -3.10 112.91 110.35 2ger h THR 183 Ca 0.19 -2.44 -0.16 0.00 0.77 0.00 0.00 66.41 64.77 2ger h THR 183 Cb 0.86 2.43 0.02 0.00 -1.74 0.00 0.00 68.15 69.72 2ger h THR 183 CO -0.00 0.63 -0.70 0.00 0.37 0.00 0.00 175.52 175.81 2ger h ALA 184 N 1.36 -0.05 0.00 6.16 0.00 0.16 -3.04 119.26 123.86 2ger h ALA 184 Ca -0.01 -0.65 0.00 0.00 0.00 0.00 0.00 54.91 54.25 2ger h ALA 184 Cb 1.37 0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.24 2ger h ALA 184 CO 0.08 0.34 0.00 1.28 0.00 0.00 0.00 179.25 180.95 2ger n LEU 185 N -4.19 0.03 -0.00 0.00 4.77 0.19 -1.60 117.00 116.20 2ger n LEU 185 Ca -0.13 0.51 -0.21 0.00 -0.03 0.00 0.00 56.01 56.15 2ger n LEU 185 Cb 0.76 -0.51 -0.14 0.00 -2.33 0.00 0.00 43.42 41.21 2ger n LEU 185 CO 0.47 -0.34 -0.84 -0.67 -1.33 0.00 0.00 177.39 174.68 2ger n ASP 186 N -1.53 2.11 -0.20 -1.43 2.03 -1.17 -2.92 116.55 113.44 2ger n ASP 186 Ca 0.02 0.19 -0.04 0.00 0.52 0.00 0.00 54.79 55.48 2ger n ASP 186 Cb 0.12 -0.83 0.13 0.00 -0.72 0.00 0.00 41.12 39.82 2ger n ASP 186 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2ger h ALA 187 N 0.07 1.12 0.18 -1.67 0.00 -1.29 0.17 119.26 117.84 2ger h ALA 187 Ca -0.43 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.26 2ger h ALA 187 Cb 2.03 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 19.56 2ger h ALA 187 CO 0.08 0.60 -0.09 -0.07 0.00 0.00 0.00 179.25 179.78 2ger h LEU 188 N 0.96 -0.20 -1.99 0.00 3.38 -1.44 0.28 115.31 116.29 2ger h LEU 188 Ca 0.21 -0.25 0.19 0.00 0.09 0.00 0.00 57.88 58.12 2ger h LEU 188 Cb 0.28 0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.06 2ger h LEU 188 CO -0.01 0.15 0.47 0.00 0.09 0.00 0.00 178.44 179.14 2ger h ALA 189 N 0.15 2.60 0.25 1.53 0.00 -1.39 1.17 119.26 123.57 2ger h ALA 189 Ca -0.02 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 2ger h ALA 189 Cb 0.44 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.27 2ger h ALA 189 CO 0.04 -0.78 -0.12 -0.44 0.00 0.00 0.00 179.25 177.95 2ger h ASP 190 N 0.01 -0.29 0.07 0.00 5.19 -0.22 -2.10 116.42 119.08 2ger h ASP 190 Ca 0.31 -0.24 0.01 0.00 -0.62 0.00 0.00 57.03 56.49 2ger h ASP 190 Cb 1.22 0.07 -0.02 0.00 0.18 0.00 0.00 39.33 40.78 2ger h ASP 190 CO -0.01 0.19 -0.15 1.23 -3.12 0.00 0.00 179.24 177.39 2ger h GLY 191 N -0.89 -0.25 -0.49 2.75 0.00 0.65 -0.63 103.07 104.21 2ger h GLY 191 Ca -0.03 0.18 0.24 0.00 0.00 0.00 0.00 47.33 47.71 2ger h GLY 191 CO 0.06 -0.15 0.22 -1.33 0.00 0.00 0.00 176.54 175.34 2ger h GLY 192 N -0.29 1.36 0.76 4.60 0.00 0.13 0.71 103.07 110.34 2ger h GLY 192 Ca 0.03 -0.02 -0.04 0.00 0.00 0.00 0.00 47.33 47.30 2ger h GLY 192 CO -0.10 -0.39 -0.07 -2.08 0.00 0.00 0.00 176.54 173.91 2ger h VAL 193 N 0.19 1.31 0.00 4.60 2.07 -0.57 -2.00 116.25 121.84 2ger h VAL 193 Ca 0.56 -1.10 0.00 0.00 0.82 0.00 0.00 66.70 66.98 2ger h VAL 193 Cb 1.14 1.71 0.00 0.00 -1.52 0.00 0.00 31.29 32.61 2ger h VAL 193 CO -0.68 0.32 0.05 1.17 0.02 0.00 0.00 177.57 178.46 2ger n LYS 194 N -4.64 0.00 -0.58 1.57 4.81 0.19 0.82 118.16 120.33 2ger n LYS 194 Ca -0.06 0.33 0.05 0.00 -0.87 0.00 0.00 58.31 57.76 2ger n LYS 194 Cb 0.29 -1.55 0.26 0.00 0.02 0.00 0.00 35.03 34.05 2ger n LYS 194 CO 0.00 0.00 0.00 -1.33 1.17 0.00 0.00 177.40 177.24 2ger n MET 195 N -1.31 2.88 -0.65 1.64 2.81 -0.83 -4.93 117.12 116.72 2ger n MET 195 Ca 0.00 -2.94 0.00 0.00 -1.81 0.00 0.00 57.70 52.95 2ger n MET 195 Cb 0.05 -1.89 0.00 0.00 -0.71 0.00 0.00 33.22 30.67 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 -0.55 0.79 3.74 3.03 0.00 0.24 -5.05 105.19 107.38 2ger n GLY 196 Ca 0.26 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.87 2ger n GLY 196 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ger s LEU 197 N 0.00 4.50 0.24 0.99 1.43 -0.81 -4.99 118.68 120.03 2ger s LEU 197 Ca 0.00 2.04 -0.30 0.00 -1.03 0.00 0.00 54.13 54.84 2ger s LEU 197 Cb 0.00 -3.60 -0.09 0.00 0.03 0.00 0.00 46.19 42.53 2ger s LEU 197 CO 0.00 -0.19 1.14 -2.16 0.23 0.00 0.00 176.35 175.38 2ger s PRO 198 N -0.34 4.57 0.00 1.29 0.04 -1.26 -4.09 135.00 135.21 2ger s PRO 198 Ca 0.49 1.84 0.00 0.00 0.04 0.00 0.00 61.00 63.37 2ger s PRO 198 Cb -0.28 -3.21 0.00 0.00 0.04 0.00 0.00 34.50 31.05 2ger s PRO 198 CO 0.34 0.07 0.46 -2.13 0.04 0.00 0.00 177.00 175.78 2ger n ARG 199 N 1.77 0.00 -0.17 4.56 3.00 -1.26 -1.37 116.66 123.19 2ger n ARG 199 Ca 0.01 0.46 0.07 0.00 -0.00 0.00 0.00 57.85 58.40 2ger n ARG 199 Cb 0.45 -0.95 0.14 0.00 0.00 0.00 0.00 32.46 32.10 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 -0.94 -0.04 0.36 -0.14 5.12 -1.26 0.57 116.66 120.33 2ger n ARG 200 Ca 0.00 0.76 -0.14 0.00 -1.93 0.00 0.00 57.85 56.53 2ger n ARG 200 Cb 0.00 -1.20 -0.07 0.00 -1.16 0.00 0.00 32.46 30.03 2ger n ARG 200 CO 0.00 0.00 0.00 1.25 -1.93 0.00 0.00 177.63 176.95 2ger h LEU 201 N 0.00 -0.80 -0.93 0.55 5.85 -1.73 -2.09 115.31 116.17 2ger h LEU 201 Ca 0.30 0.03 0.27 0.00 0.84 0.00 0.00 57.88 59.32 2ger h LEU 201 Cb 0.62 0.21 -0.15 0.00 0.37 0.00 0.00 40.66 41.70 2ger h LEU 201 CO -0.48 -0.47 0.29 0.00 -0.34 0.00 0.00 178.44 177.44 2ger h ALA 202 N -1.36 1.45 -0.11 1.25 0.00 0.14 0.82 119.26 121.45 2ger h ALA 202 Ca -0.10 0.24 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 2ger h ALA 202 Cb 0.72 0.34 -0.00 0.00 0.00 0.00 0.00 17.79 18.84 2ger h ALA 202 CO 0.16 -0.55 -0.01 -0.24 0.00 0.00 0.00 179.25 178.62 2ger h VAL 203 N 0.18 1.26 0.00 0.00 3.04 -1.07 -0.78 116.25 118.88 2ger h VAL 203 Ca 0.62 -0.85 -0.05 0.00 -1.01 0.00 0.00 66.70 65.41 2ger h VAL 203 Cb 1.33 1.61 -0.01 0.00 -2.01 0.00 0.00 31.29 32.21 2ger h VAL 203 CO -0.70 0.24 -0.21 0.03 -1.01 0.00 0.00 177.57 175.92 2ger h ARG 204 N -0.08 0.00 -0.01 4.17 3.08 -0.21 -1.79 114.38 119.54 2ger h ARG 204 Ca 0.03 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.04 2ger h ARG 204 Cb 0.38 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.43 2ger h ARG 204 CO 0.01 0.21 -0.15 -0.07 -1.07 0.00 0.00 179.97 178.90 2ger h LEU 205 N 0.00 0.15 -0.87 3.04 3.38 -0.93 -1.48 115.31 118.59 2ger h LEU 205 Ca -0.00 -0.75 0.12 0.00 0.09 0.00 0.00 57.88 57.34 2ger h LEU 205 Cb 0.68 -0.04 -0.08 0.00 0.09 0.00 0.00 40.66 41.31 2ger h LEU 205 CO 0.03 0.87 0.50 1.23 0.09 0.00 0.00 178.44 181.16 2ger h GLY 206 N -0.57 1.40 0.55 0.83 0.00 -1.05 0.32 103.07 104.55 2ger h GLY 206 Ca -0.02 -0.32 -0.03 0.00 0.00 0.00 0.00 47.33 46.97 2ger h GLY 206 CO 0.03 0.08 -0.26 0.00 0.00 0.00 0.00 176.54 176.39 2ger h ALA 207 N 1.51 -0.95 -0.77 3.60 0.00 -1.30 -2.50 119.26 118.86 2ger h ALA 207 Ca 0.44 -0.16 0.22 0.00 0.00 0.00 0.00 54.91 55.41 2ger h ALA 207 Cb 0.49 0.29 -0.03 0.00 0.00 0.00 0.00 17.79 18.53 2ger h ALA 207 CO -0.29 -0.89 0.66 0.37 0.00 0.00 0.00 179.25 179.10 2ger h GLN 208 N -0.92 0.00 0.22 0.00 -0.00 -1.05 0.98 115.11 114.34 2ger h GLN 208 Ca -0.08 0.00 -0.01 0.00 -0.00 0.00 0.00 58.65 58.56 2ger h GLN 208 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 27.48 28.05 2ger h GLN 208 CO 0.12 0.00 -0.10 0.00 0.00 0.00 0.00 178.83 178.85 2ger h ALA 209 N 1.40 -0.29 0.59 3.38 0.00 -0.13 -1.81 119.26 122.40 2ger h ALA 209 Ca 0.37 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 55.06 2ger h ALA 209 Cb 1.68 0.11 0.01 0.00 0.00 0.00 0.00 17.79 19.59 2ger h ALA 209 CO -0.00 -0.48 -0.28 -0.07 0.00 0.00 0.00 179.25 178.41 2ger h LEU 210 N -0.65 -0.67 -1.04 0.00 3.38 -0.44 -1.70 115.31 114.19 2ger h LEU 210 Ca -0.03 0.02 0.40 0.00 0.09 0.00 0.00 57.88 58.36 2ger h LEU 210 Cb 0.46 0.17 -0.14 0.00 0.09 0.00 0.00 40.66 41.24 2ger h LEU 210 CO 0.05 -0.34 0.61 -0.11 0.09 0.00 0.00 178.44 178.74 2ger n LEU 211 N -4.90 0.26 0.32 1.67 7.94 -0.18 0.11 117.00 122.21 2ger n LEU 211 Ca -0.10 1.37 -0.13 0.00 -1.11 0.00 0.00 56.01 56.04 2ger n LEU 211 Cb 0.31 -0.67 -0.06 0.00 0.53 0.00 0.00 43.42 43.53 2ger n LEU 211 CO 0.24 -1.52 0.36 1.23 -1.11 0.00 0.00 177.39 176.59 2ger h GLY 212 N 0.00 -0.87 0.47 -3.96 0.00 -0.89 -1.80 103.07 96.02 2ger h GLY 212 Ca 0.77 0.32 0.20 0.00 0.00 0.00 0.00 47.33 48.62 2ger h GLY 212 CO -0.57 -0.32 0.55 0.00 0.00 0.00 0.00 176.54 176.21 2ger h ALA 213 N -1.33 2.45 -1.08 3.60 0.00 0.59 0.22 119.26 123.71 2ger h ALA 213 Ca -0.09 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2ger h ALA 213 Cb 0.64 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.44 2ger h ALA 213 CO 0.14 -0.69 0.00 0.00 0.00 0.00 0.00 179.25 178.70 2ger n ALA 214 N -2.60 -0.22 -0.33 0.00 0.00 0.88 -0.91 120.51 117.33 2ger n ALA 214 Ca 0.16 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.61 2ger n ALA 214 Cb 0.73 0.00 0.06 0.00 0.00 0.00 0.00 19.45 20.25 2ger n ALA 214 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2ger n LYS 215 N -1.46 -0.16 -0.24 0.00 3.00 -0.68 0.11 118.16 118.72 2ger n LYS 215 Ca 0.00 1.34 0.04 0.00 -0.00 0.00 0.00 58.31 59.69 2ger n LYS 215 Cb 0.00 -1.99 0.15 0.00 0.00 0.00 0.00 35.03 33.19 2ger n LYS 215 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 177.40 179.38 2ger h MET 216 N 0.00 0.18 -0.08 1.64 4.05 -0.57 0.04 114.93 120.19 2ger h MET 216 Ca 0.34 -0.01 -0.09 0.00 -0.28 0.00 0.00 59.70 59.66 2ger h MET 216 Cb 0.56 -0.04 0.00 0.00 -0.80 0.00 0.00 31.60 31.32 2ger h MET 216 CO -0.87 0.12 -0.29 1.25 0.23 0.00 0.00 176.91 177.35 2ger h LEU 217 N 0.19 0.39 -0.96 3.39 5.85 0.26 -3.27 115.31 121.17 2ger h LEU 217 Ca 0.39 -0.62 0.12 0.00 0.84 0.00 0.00 57.88 58.61 2ger h LEU 217 Cb 0.66 -0.11 -0.09 0.00 0.37 0.00 0.00 40.66 41.49 2ger h LEU 217 CO -0.55 0.95 0.58 -0.07 -0.34 0.00 0.00 178.44 179.01 2ger h LEU 218 N -0.14 0.84 -4.00 2.25 3.38 0.97 -2.60 115.31 116.01 2ger h LEU 218 Ca -0.01 0.06 -0.43 0.00 0.09 0.00 0.00 57.88 57.58 2ger h LEU 218 Cb 0.92 -0.11 -0.17 0.00 0.09 0.00 0.00 40.66 41.39 2ger h LEU 218 CO 0.06 0.43 0.44 1.41 0.09 0.00 0.00 178.44 180.87 2ger n HIS 219 N -4.67 1.68 -3.39 1.13 8.25 -0.13 -4.79 115.22 113.30 2ger n HIS 219 Ca 0.18 -2.03 0.02 0.00 -0.26 0.00 0.00 57.72 55.63 2ger n HIS 219 Cb 0.36 -1.18 -0.05 0.00 1.12 0.00 0.00 29.99 30.24 2ger n HIS 219 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 2ger s SER 220 N 0.12 -0.24 -0.11 0.41 1.04 -0.98 -5.00 113.70 108.93 2ger s SER 220 Ca 0.46 0.35 -0.01 0.00 0.48 0.00 0.00 55.95 57.23 2ger s SER 220 Cb 0.33 1.23 0.04 0.00 0.10 0.00 0.00 66.02 67.71 2ger s SER 220 CO -0.11 -0.05 2.21 -1.84 0.98 0.00 0.00 173.24 174.44 2ger n GLU 221 N 4.25 1.40 0.25 4.02 0.28 -1.26 -4.54 120.64 125.04 2ger n GLU 221 Ca -0.11 -0.66 -0.16 0.00 -0.16 0.00 0.00 57.16 56.07 2ger n GLU 221 Cb 0.55 -1.33 -0.08 0.00 1.43 0.00 0.00 31.44 32.00 2ger n GLU 221 CO 0.00 0.00 0.00 1.96 -0.16 0.00 0.00 177.13 178.93 2ger h GLN 222 N 1.44 -0.56 0.00 3.44 1.08 -1.95 -3.50 115.11 115.05 2ger h GLN 222 Ca 0.12 0.04 0.00 0.00 -1.45 0.00 0.00 58.65 57.36 2ger h GLN 222 Cb 1.02 0.13 0.00 0.00 -0.05 0.00 0.00 27.48 28.57 2ger h GLN 222 CO 0.28 -0.37 0.00 1.58 -0.95 0.00 0.00 178.83 179.37 2ger n HIS 223 N -5.34 0.00 0.00 2.96 -0.00 -1.26 -4.75 115.22 106.82 2ger n HIS 223 Ca -0.11 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.61 2ger n HIS 223 Cb 0.25 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.24 2ger n HIS 223 CO 0.00 0.00 0.00 -2.30 -0.00 0.00 0.00 176.34 174.04 2ger n PRO 224 N 1.66 0.00 -0.32 1.57 -0.02 -1.26 -1.90 135.00 134.73 2ger n PRO 224 Ca 0.00 0.74 0.29 0.00 -2.02 0.00 0.00 63.50 62.51 2ger n PRO 224 Cb 0.00 -1.27 0.49 0.00 -0.02 0.00 0.00 33.50 32.71 2ger n PRO 224 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ger n GLY 225 N -0.99 -0.62 0.00 -1.23 0.00 -1.26 -1.96 105.19 99.13 2ger n GLY 225 Ca 0.00 0.59 0.00 0.00 0.00 0.00 0.00 46.02 46.61 2ger n GLY 225 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2ger n GLN 226 N -4.39 0.00 -0.34 1.61 -0.06 -0.80 -1.86 117.38 111.54 2ger n GLN 226 Ca 0.30 0.34 0.30 0.00 -2.00 0.00 0.00 57.00 55.94 2ger n GLN 226 Cb 1.13 -1.30 0.63 0.00 -4.06 0.00 0.00 30.24 26.64 2ger n GLN 226 CO 0.00 0.00 0.00 -0.07 -0.20 0.00 0.00 177.06 176.79 2ger h LEU 227 N 0.00 0.23 0.34 1.69 3.38 -1.44 0.44 115.31 119.96 2ger h LEU 227 Ca 0.00 0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 2ger h LEU 227 Cb 0.00 0.02 -0.03 0.00 0.09 0.00 0.00 40.66 40.74 2ger h LEU 227 CO 0.00 0.02 -0.45 0.50 0.09 0.00 0.00 178.44 178.60 2ger h LYS 228 N 0.19 -0.79 -0.75 1.13 3.64 -1.34 -2.42 116.57 116.23 2ger h LYS 228 Ca 0.61 0.05 0.11 0.00 -1.27 0.00 0.00 60.65 60.15 2ger h LYS 228 Cb 1.97 0.18 -0.13 0.00 -0.41 0.00 0.00 32.23 33.84 2ger h LYS 228 CO -0.18 -0.53 -0.42 -0.44 -2.27 0.00 0.00 179.45 175.61 2ger h ASP 229 N -0.82 -1.49 -0.34 4.20 3.32 0.59 0.38 116.42 122.26 2ger h ASP 229 Ca -0.04 0.27 0.10 0.00 0.02 0.00 0.00 57.03 57.38 2ger h ASP 229 Cb 0.74 0.72 -0.01 0.00 0.22 0.00 0.00 39.33 40.99 2ger h ASP 229 CO -0.11 -0.30 0.74 0.78 -1.72 0.00 0.00 179.24 178.62 2ger h ASN 230 N -0.12 0.00 -0.57 6.45 4.21 -0.84 0.95 115.58 125.66 2ger h ASN 230 Ca 0.24 0.00 -0.14 0.00 1.21 0.00 0.00 56.30 57.60 2ger h ASN 230 Cb 0.55 0.00 -0.09 0.00 -1.12 0.00 0.00 38.32 37.67 2ger h ASN 230 CO -0.81 0.00 0.14 0.52 -1.29 0.00 0.00 177.43 176.00 2ger n VAL 231 N -3.06 2.73 -3.68 2.81 0.31 0.13 -4.86 118.33 112.71 2ger n VAL 231 Ca 0.07 -1.83 -0.30 0.00 -0.01 0.00 0.00 64.34 62.27 2ger n VAL 231 Cb 0.87 -0.32 -0.14 0.00 -0.91 0.00 0.00 33.84 33.33 2ger n VAL 231 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 2ger s SER 232 N -1.43 3.77 0.15 4.52 0.01 0.33 -4.84 113.70 116.20 2ger s SER 232 Ca 0.51 -1.98 -0.31 0.00 1.31 0.00 0.00 55.95 55.48 2ger s SER 232 Cb 0.41 -0.83 -0.10 0.00 0.21 0.00 0.00 66.02 65.71 2ger s SER 232 CO 0.11 -0.36 1.59 -0.94 0.41 0.00 0.00 173.24 174.04 2ger s SER 233 N 1.21 6.59 0.62 2.44 1.04 -1.26 -4.82 113.70 119.51 2ger s SER 233 Ca 0.13 2.60 0.00 0.00 0.48 0.00 0.00 55.95 59.16 2ger s SER 233 Cb -0.20 -2.59 0.00 0.00 0.10 0.00 0.00 66.02 63.33 2ger s SER 233 CO -0.15 -0.84 0.96 -2.65 0.98 0.00 0.00 173.24 171.54 2ger n PRO 234 N 4.27 0.03 0.00 4.02 -0.02 -1.26 -2.24 135.00 139.80 2ger n PRO 234 Ca 0.14 0.89 0.00 0.00 -2.02 0.00 0.00 63.50 62.51 2ger n PRO 234 Cb 0.39 -2.51 0.00 0.00 -0.02 0.00 0.00 33.50 31.36 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 -1.46 -1.54 0.00 -1.23 0.00 -1.26 -5.07 105.19 94.63 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 0.31 -0.65 5.33 -0.02 0.00 -0.95 -4.91 105.19 104.30 2ger n GLY 236 Ca 0.00 0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.14 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 0.00 0.00 0.18 4.61 0.00 -1.26 -3.64 120.51 120.39 2ger n ALA 237 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.35 2ger n ALA 237 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.41 2ger n ALA 237 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2ger h THR 238 N 0.00 0.00 -0.98 0.00 2.02 -1.93 -2.47 112.91 109.55 2ger h THR 238 Ca 0.00 0.00 0.17 0.00 0.77 0.00 0.00 66.41 67.35 2ger h THR 238 Cb 0.00 0.00 -0.09 0.00 -1.74 0.00 0.00 68.15 66.32 2ger h THR 238 CO 0.00 0.00 0.61 0.40 0.37 0.00 0.00 175.52 176.90 2ger h ILE 239 N -0.52 0.77 -0.95 3.11 5.03 -1.89 0.66 117.51 123.73 2ger h ILE 239 Ca -0.04 -0.27 0.01 0.00 -0.12 0.00 0.00 64.86 64.44 2ger h ILE 239 Cb 0.43 -0.07 -0.05 0.00 -3.03 0.00 0.00 36.82 34.10 2ger h ILE 239 CO 0.02 0.14 0.63 0.45 -0.68 0.00 0.00 178.15 178.71 2ger h HIS 240 N 0.77 1.19 0.47 1.37 3.86 -1.80 0.30 115.15 121.31 2ger h HIS 240 Ca 0.53 0.03 -0.02 0.00 -1.16 0.00 0.00 60.37 59.75 2ger h HIS 240 Cb 0.81 -0.40 0.00 0.00 1.06 0.00 0.00 27.41 28.89 2ger h HIS 240 CO -0.00 0.75 -0.22 0.00 0.86 0.00 0.00 177.93 179.31 2ger h ALA 241 N 1.41 -1.12 -0.94 2.45 0.00 0.69 -2.67 119.26 119.07 2ger h ALA 241 Ca 0.35 -0.14 0.21 0.00 0.00 0.00 0.00 54.91 55.33 2ger h ALA 241 Cb -0.14 0.24 -0.18 0.00 0.00 0.00 0.00 17.79 17.71 2ger h ALA 241 CO -0.08 -1.07 -0.16 1.28 0.00 0.00 0.00 179.25 179.23 2ger n LEU 242 N -3.75 -0.27 0.29 0.00 4.77 0.31 0.30 117.00 118.65 2ger n LEU 242 Ca -0.08 1.62 0.17 0.00 -0.03 0.00 0.00 56.01 57.69 2ger n LEU 242 Cb 0.25 -0.52 0.87 0.00 -2.33 0.00 0.00 43.42 41.69 2ger n LEU 242 CO 0.19 -1.58 1.05 -0.74 -1.33 0.00 0.00 177.39 174.98 2ger h HIS 243 N 0.00 0.00 0.21 -1.77 2.76 -0.37 0.66 115.15 116.64 2ger h HIS 243 Ca 0.49 0.00 -0.31 0.00 -2.20 0.00 0.00 60.37 58.35 2ger h HIS 243 Cb 0.84 0.00 0.03 0.00 1.55 0.00 0.00 27.41 29.83 2ger h HIS 243 CO -0.65 0.05 -1.41 -0.24 -1.30 0.00 0.00 177.93 174.38 2ger h VAL 244 N 0.00 1.24 0.13 5.26 3.04 0.50 -1.17 116.25 125.25 2ger h VAL 244 Ca -0.00 -2.61 -0.01 0.00 -1.01 0.00 0.00 66.70 63.08 2ger h VAL 244 Cb 0.27 3.00 0.00 0.00 -2.01 0.00 0.00 31.29 32.55 2ger h VAL 244 CO 0.01 0.79 -0.06 -0.07 -1.01 0.00 0.00 177.57 177.23 2ger h LEU 245 N 0.00 -0.15 -1.01 3.16 3.38 -0.81 -1.98 115.31 117.90 2ger h LEU 245 Ca -0.26 -0.13 0.27 0.00 0.09 0.00 0.00 57.88 57.86 2ger h LEU 245 Cb 2.03 0.04 -0.13 0.00 0.09 0.00 0.00 40.66 42.68 2ger h LEU 245 CO 0.22 0.04 0.59 -0.08 0.09 0.00 0.00 178.44 179.29 2ger h GLU 246 N -0.34 0.48 0.00 1.13 4.57 0.29 0.20 114.58 120.91 2ger h GLU 246 Ca -0.02 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.13 2ger h GLU 246 Cb 0.27 -0.11 0.00 0.00 -0.16 0.00 0.00 28.75 28.75 2ger h GLU 246 CO 0.03 0.32 0.00 0.43 -1.18 0.00 0.00 179.01 178.61 2ger n SER 247 N -4.93 0.00 -0.59 1.04 7.64 -0.44 -2.19 113.62 114.15 2ger n SER 247 Ca 0.28 -0.18 0.08 0.00 1.01 0.00 0.00 58.87 60.07 2ger n SER 247 Cb 0.83 -0.22 0.05 0.00 -1.01 0.00 0.00 64.21 63.86 2ger n SER 247 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ger n GLY 248 N 0.50 0.20 2.17 0.23 0.00 0.69 -4.95 105.19 104.03 2ger n GLY 248 Ca 0.12 -0.49 -0.08 0.00 0.00 0.00 0.00 46.02 45.57 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 1.03 0.21 0.41 -0.02 0.00 -0.93 -4.91 105.19 100.98 2ger n GLY 249 Ca 0.09 -0.50 0.23 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.36 0.61 0.11 1.61 3.57 -1.74 -0.71 116.94 120.04 2ger h PHE 250 Ca -0.18 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.33 2ger h PHE 250 Cb 1.13 -0.18 0.00 0.00 2.79 0.00 0.00 35.95 39.69 2ger h PHE 250 CO 0.19 0.07 -0.05 0.00 -2.23 0.00 0.00 178.31 176.29 2ger h ARG 251 N 0.38 -0.15 0.43 1.11 3.08 -1.90 -3.08 114.38 114.25 2ger h ARG 251 Ca 0.57 0.01 -0.02 0.00 0.07 0.00 0.00 59.98 60.62 2ger h ARG 251 Cb 1.48 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 31.55 2ger h ARG 251 CO -0.26 0.01 -0.37 0.66 -1.07 0.00 0.00 179.97 178.94 2ger h SER 252 N -0.28 -1.00 -1.39 7.04 4.64 -1.53 -2.09 113.55 118.93 2ger h SER 252 Ca -0.02 0.07 0.40 0.00 -0.47 0.00 0.00 61.79 61.78 2ger h SER 252 Cb 0.23 0.32 -0.06 0.00 -0.31 0.00 0.00 62.40 62.58 2ger h SER 252 CO 0.03 -0.51 1.20 0.18 -0.87 0.00 0.00 176.83 176.85 2ger n LEU 253 N -4.67 0.00 0.03 5.97 4.77 -0.95 0.26 117.00 122.41 2ger n LEU 253 Ca -0.09 0.79 -0.11 0.00 -0.03 0.00 0.00 56.01 56.57 2ger n LEU 253 Cb 0.35 -0.35 -0.13 0.00 -2.33 0.00 0.00 43.42 40.96 2ger n LEU 253 CO 0.21 -0.79 -0.24 -0.07 -1.33 0.00 0.00 177.39 175.17 2ger h LEU 254 N 0.00 0.13 0.08 2.23 3.38 -1.30 -2.47 115.31 117.36 2ger h LEU 254 Ca 0.66 -0.18 -0.00 0.00 0.09 0.00 0.00 57.88 58.44 2ger h LEU 254 Cb 3.05 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 43.76 2ger h LEU 254 CO -0.01 1.15 -0.04 0.40 0.09 0.00 0.00 178.44 180.04 2ger h ILE 255 N 0.02 0.00 -0.36 1.22 2.04 0.39 -2.40 117.51 118.42 2ger h ILE 255 Ca -0.18 -0.09 0.12 0.00 1.00 0.00 0.00 64.86 65.71 2ger h ILE 255 Cb 1.93 0.00 -0.07 0.00 -0.74 0.00 0.00 36.82 37.94 2ger h ILE 255 CO 0.12 0.00 0.08 0.59 0.00 0.00 0.00 178.15 178.94 2ger n ASN 256 N -2.55 0.02 0.01 1.72 4.13 0.30 0.57 115.26 119.45 2ger n ASN 256 Ca -0.01 0.60 -0.00 0.00 1.68 0.00 0.00 54.58 56.85 2ger n ASN 256 Cb 0.04 -0.25 -0.00 0.00 -1.54 0.00 0.00 39.78 38.03 2ger n ASN 256 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2ger h ALA 257 N 0.72 -0.76 -0.40 5.41 0.00 -1.36 -1.46 119.26 121.41 2ger h ALA 257 Ca 0.25 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 55.20 2ger h ALA 257 Cb 0.59 0.01 -0.07 0.00 0.00 0.00 0.00 17.79 18.32 2ger h ALA 257 CO -0.31 -0.76 -0.41 0.28 0.00 0.00 0.00 179.25 178.05 2ger h VAL 258 N -0.03 0.00 -0.06 0.00 2.07 0.66 -1.04 116.25 117.84 2ger h VAL 258 Ca -0.00 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.52 2ger h VAL 258 Cb 0.02 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 29.78 2ger h VAL 258 CO 0.00 0.00 -0.04 1.21 0.02 0.00 0.00 177.57 178.77 2ger n GLU 259 N -4.62 -0.03 -0.26 1.57 2.13 0.65 -0.80 120.64 119.29 2ger n GLU 259 Ca -0.02 1.00 0.25 0.00 0.66 0.00 0.00 57.16 59.06 2ger n GLU 259 Cb 0.23 -1.50 0.60 0.00 0.27 0.00 0.00 31.44 31.04 2ger n GLU 259 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2ger h ALA 260 N -0.88 2.51 -0.36 4.31 0.00 -0.80 0.31 119.26 124.36 2ger h ALA 260 Ca 0.01 0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.83 2ger h ALA 260 Cb 0.03 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 2ger h ALA 260 CO -0.06 -0.83 -0.20 1.03 0.00 0.00 0.00 179.25 179.19 2ger h SER 261 N 0.24 0.69 0.11 0.00 0.87 0.36 -2.19 113.55 113.63 2ger h SER 261 Ca 0.51 -0.23 -0.01 0.00 -1.23 0.00 0.00 61.79 60.83 2ger h SER 261 Cb 1.56 -0.19 0.00 0.00 -0.44 0.00 0.00 62.40 63.34 2ger h SER 261 CO -0.14 0.89 -0.05 0.00 -0.53 0.00 0.00 176.83 176.99 2ger h ILE 263 N -0.49 1.02 -0.37 0.00 2.04 -1.20 -0.92 117.51 117.59 2ger h ILE 263 Ca -0.02 -0.35 -0.12 0.00 1.00 0.00 0.00 64.86 65.38 2ger h ILE 263 Cb 0.40 -0.08 -0.01 0.00 -0.74 0.00 0.00 36.82 36.39 2ger h ILE 263 CO 0.03 0.18 -0.27 -0.09 0.00 0.00 0.00 178.15 178.00 2ger h ARG 264 N 1.01 0.77 0.00 2.37 9.65 -1.35 0.11 114.38 126.93 2ger h ARG 264 Ca 0.42 -0.33 0.00 0.00 -1.10 0.00 0.00 59.98 58.97 2ger h ARG 264 Cb 0.30 -0.02 0.00 0.00 -1.39 0.00 0.00 29.97 28.86 2ger h ARG 264 CO -0.18 0.95 0.00 1.15 2.80 0.00 0.00 179.97 184.69 2ger h THR 265 N 0.66 0.00 0.00 0.20 2.02 -0.42 0.14 112.91 115.51 2ger h THR 265 Ca 0.08 -0.49 0.00 0.00 0.77 0.00 0.00 66.41 66.78 2ger h THR 265 Cb 0.79 1.43 0.00 0.00 -1.74 0.00 0.00 68.15 68.63 2ger h THR 265 CO 0.07 0.00 -0.11 0.03 0.37 0.00 0.00 175.52 175.88 2ger h ARG 266 N 0.00 0.00 0.00 6.66 3.08 -0.68 -3.20 114.38 120.24 2ger h ARG 266 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2ger h ARG 266 Cb 0.52 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.57 2ger h ARG 266 CO 0.00 0.00 0.68 0.93 -1.07 0.00 0.00 179.97 180.51 2ger h GLU 267 N -0.42 0.00 0.18 0.04 5.08 -0.77 1.95 114.58 120.64 2ger h GLU 267 Ca 0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 2ger h GLU 267 Cb 0.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.36 2ger h GLU 267 CO 0.00 0.00 -0.09 1.25 -1.00 0.00 0.00 179.01 179.17 2ger h LEU 268 N 0.00 -0.21 -1.04 1.33 5.85 -1.06 -3.34 115.31 116.83 2ger h LEU 268 Ca 0.00 0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.68 2ger h LEU 268 Cb 1.36 0.05 -0.01 0.00 0.37 0.00 0.00 40.66 42.44 2ger h LEU 268 CO 0.00 0.01 -0.22 -0.61 -0.34 0.00 0.00 178.44 177.28 2ger h GLN 269 N -0.57 0.00 -0.75 1.25 5.75 -0.26 -3.19 115.11 117.34 2ger h GLN 269 Ca -0.03 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.47 2ger h GLN 269 Cb 0.19 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.74 2ger h GLN 269 CO 0.04 0.22 0.00 0.43 -2.65 0.00 0.00 178.83 176.87 2ger n SER 270 N -3.36 0.84 -0.18 -0.69 7.64 0.62 -0.77 113.62 117.72 2ger n SER 270 Ca 0.00 -1.28 0.00 0.00 1.01 0.00 0.00 58.87 58.60 2ger n SER 270 Cb 0.44 -0.32 0.00 0.00 -1.01 0.00 0.00 64.21 63.32 2ger n SER 270 CO 0.00 0.00 0.00 1.15 -3.01 0.00 0.00 175.04 173.18 2ger n MET 271 N 0.26 0.00 -0.07 1.43 0.00 -1.21 -4.86 117.12 112.67 2ger n MET 271 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 57.70 57.82 2ger n MET 271 Cb 0.19 0.00 0.15 0.00 0.00 0.00 0.00 33.22 33.56 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 0.00 2.45 0.00 3.17 0.00 0.05 -3.75 120.51 122.43 2ger n ALA 272 Ca 0.00 -0.79 0.00 0.00 0.00 0.00 0.00 53.44 52.65 2ger n ALA 272 Cb 0.40 -0.84 0.00 0.00 0.00 0.00 0.00 19.45 19.01 2ger n ALA 272 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2ger n ASP 273 N 1.37 3.12 0.00 0.00 5.68 -1.25 -4.95 116.55 120.53 2ger n ASP 273 Ca 0.16 -0.08 0.00 0.00 -0.50 0.00 0.00 54.79 54.37 2ger n ASP 273 Cb 0.60 0.78 0.00 0.00 -1.14 0.00 0.00 41.12 41.35 2ger n ASP 273 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2ger n GLN 274 N -1.09 0.00 0.00 0.11 6.02 -1.26 -5.19 117.38 115.97 2ger n GLN 274 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 2ger n GLN 274 Cb 0.00 -0.01 0.00 0.00 1.02 0.00 0.00 30.24 31.25 2ger n GLN 274 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44