#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oxn n GLY 72 N 0.00 0.00 3.72 0.00 0.00 -1.26 -5.13 105.19 102.52 1oxn n GLY 72 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1oxn n GLY 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oxn s ALA 73 N 0.00 3.63 0.14 4.61 0.00 -1.26 -5.00 121.76 123.88 1oxn s ALA 73 Ca 0.00 1.19 0.03 0.00 0.00 0.00 0.00 51.96 53.18 1oxn s ALA 73 Cb 0.00 -3.55 -0.04 0.00 0.00 0.00 0.00 23.12 19.53 1oxn s ALA 73 CO 0.00 -0.65 0.23 0.95 0.00 0.00 0.00 175.76 176.29 1oxn s THR 74 N 0.94 5.10 0.16 0.00 -4.23 -1.26 -5.08 115.64 111.28 1oxn s THR 74 Ca 0.65 -0.75 -0.31 0.00 -1.18 0.00 0.00 61.69 60.09 1oxn s THR 74 Cb -0.39 -3.60 -0.09 0.00 1.34 0.00 0.00 72.50 69.76 1oxn s THR 74 CO 0.32 -0.07 1.40 -0.22 -0.54 0.00 0.00 174.62 175.51 1oxn s LEU 75 N -3.10 4.38 0.37 4.79 2.96 -1.26 -5.00 118.68 121.82 1oxn s LEU 75 Ca 0.34 2.43 -0.27 0.00 -0.22 0.00 0.00 54.13 56.40 1oxn s LEU 75 Cb -0.11 -3.60 -0.09 0.00 0.50 0.00 0.00 46.19 42.89 1oxn s LEU 75 CO 0.27 -0.65 1.27 -0.44 -1.32 0.00 0.00 176.35 175.48 1oxn s SER 76 N 0.81 6.60 0.00 3.68 0.01 -1.26 -4.94 113.70 118.59 1oxn s SER 76 Ca 0.62 2.59 0.26 0.00 1.31 0.00 0.00 55.95 60.73 1oxn s SER 76 Cb -0.38 -2.64 0.58 0.00 0.21 0.00 0.00 66.02 63.79 1oxn s SER 76 CO 0.34 -0.64 1.46 0.54 0.41 0.00 0.00 173.24 175.35 1oxn n ARG 77 N 0.46 1.03 -2.75 12.44 1.74 -1.26 -4.90 116.66 123.42 1oxn n ARG 77 Ca 0.02 -0.69 -0.42 0.00 -0.77 0.00 0.00 57.85 55.99 1oxn n ARG 77 Cb 0.43 -1.49 -0.03 0.00 -1.02 0.00 0.00 32.46 30.36 1oxn n ARG 77 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1oxn s GLY 78 N -2.44 2.72 0.42 -0.13 0.00 -1.26 -5.02 107.32 101.61 1oxn s GLY 78 Ca 0.24 0.43 -0.26 0.00 0.00 0.00 0.00 44.72 45.13 1oxn s GLY 78 CO 0.51 1.68 1.43 -4.14 0.00 0.00 0.00 173.10 172.59 1oxn s PRO 79 N 1.25 3.88 0.32 2.90 0.02 -1.26 -4.89 135.00 137.22 1oxn s PRO 79 Ca 0.49 2.45 0.04 0.00 0.02 0.00 0.00 61.00 63.99 1oxn s PRO 79 Cb -0.20 -2.79 0.64 0.00 0.02 0.00 0.00 34.50 32.18 1oxn s PRO 79 CO 0.24 -0.67 1.90 0.00 -0.33 0.00 0.00 177.00 178.13 1oxn h ALA 80 N 2.62 1.63 -2.50 -1.55 0.00 -0.60 -3.35 119.26 115.52 1oxn h ALA 80 Ca -0.51 -0.01 -0.60 0.00 0.00 0.00 0.00 54.91 53.80 1oxn h ALA 80 Cb 1.25 -0.21 -0.39 0.00 0.00 0.00 0.00 17.79 18.45 1oxn h ALA 80 CO 0.62 0.19 -0.90 0.12 0.00 0.00 0.00 179.25 179.29 1oxn s PHE 81 N -5.81 1.54 0.34 0.00 2.19 0.38 -5.00 117.98 111.61 1oxn s PHE 81 Ca -0.11 -2.51 0.08 0.00 0.33 0.00 0.00 56.93 54.72 1oxn s PHE 81 Cb 0.21 -1.25 0.78 0.00 -1.31 0.00 0.00 43.02 41.44 1oxn s PHE 81 CO 0.79 -0.78 1.84 -1.35 1.83 0.00 0.00 175.22 177.56 1oxn h PRO 82 N 5.60 0.72 0.00 10.12 0.11 -1.80 -1.47 132.00 145.28 1oxn h PRO 82 Ca 0.24 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 66.27 1oxn h PRO 82 Cb 0.88 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.82 1oxn h PRO 82 CO 0.43 0.48 -0.20 0.78 -0.21 0.00 0.00 178.00 179.28 1oxn h GLY 83 N 0.74 0.00 -0.92 -0.55 0.00 -1.95 -1.06 103.07 99.33 1oxn h GLY 83 Ca 0.49 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.82 1oxn h GLY 83 CO -0.25 0.00 0.00 1.03 0.00 0.00 0.00 176.54 177.32 1oxn n MET 84 N -3.78 1.57 0.28 4.80 2.81 -0.56 -3.43 117.12 118.81 1oxn n MET 84 Ca -0.02 -0.71 0.17 0.00 -1.81 0.00 0.00 57.70 55.32 1oxn n MET 84 Cb 0.30 -1.28 0.73 0.00 -0.71 0.00 0.00 33.22 32.27 1oxn n MET 84 CO 0.00 0.00 0.00 0.78 1.51 0.00 0.00 175.97 178.26 1oxn h GLY 85 N 5.39 0.00 -5.10 3.03 0.00 -1.26 -3.42 103.07 101.72 1oxn h GLY 85 Ca 0.00 0.00 -0.57 0.00 0.00 0.00 0.00 47.33 46.76 1oxn h GLY 85 CO 0.03 0.00 0.84 -0.45 0.00 0.00 0.00 176.54 176.96 1oxn s SER 86 N -5.74 7.04 0.27 0.19 0.15 -1.22 -4.92 113.70 109.47 1oxn s SER 86 Ca -0.00 1.51 -0.04 0.00 0.70 0.00 0.00 55.95 58.12 1oxn s SER 86 Cb 0.10 -2.54 0.36 0.00 -1.71 0.00 0.00 66.02 62.23 1oxn s SER 86 CO 0.54 -0.70 1.94 -0.08 1.20 0.00 0.00 173.24 176.14 1oxn h GLU 87 N 7.75 1.21 -0.52 5.44 4.81 -1.89 -0.88 114.58 130.50 1oxn h GLU 87 Ca -0.22 -0.07 0.07 0.00 -0.13 0.00 0.00 59.36 59.01 1oxn h GLU 87 Cb 1.08 -0.27 -0.06 0.00 0.63 0.00 0.00 28.75 30.13 1oxn h GLU 87 CO 0.97 0.80 0.19 1.49 -0.73 0.00 0.00 179.01 181.73 1oxn h GLU 88 N 1.24 0.36 -0.29 1.92 4.81 -1.95 0.12 114.58 120.81 1oxn h GLU 88 Ca 0.36 -0.02 -0.16 0.00 -0.13 0.00 0.00 59.36 59.40 1oxn h GLU 88 Cb -0.08 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.21 1oxn h GLU 88 CO -0.09 0.24 -0.47 -0.07 -0.73 0.00 0.00 179.01 177.89 1oxn h LEU 89 N 0.38 0.83 -0.32 1.64 3.38 -1.80 -1.74 115.31 117.68 1oxn h LEU 89 Ca 0.25 -0.41 0.01 0.00 0.09 0.00 0.00 57.88 57.83 1oxn h LEU 89 Cb 0.27 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 1oxn h LEU 89 CO -0.25 1.16 0.19 0.03 0.09 0.00 0.00 178.44 179.66 1oxn h ARG 90 N 0.61 0.37 -0.46 1.13 3.08 -0.60 -2.08 114.38 116.43 1oxn h ARG 90 Ca 0.03 -0.02 -0.00 0.00 0.07 0.00 0.00 59.98 60.06 1oxn h ARG 90 Cb 1.03 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.98 1oxn h ARG 90 CO 0.10 0.24 0.28 1.25 -1.07 0.00 0.00 179.97 180.78 1oxn h LEU 91 N 0.38 0.54 -1.77 3.04 6.46 -0.65 -1.93 115.31 121.38 1oxn h LEU 91 Ca 0.12 -0.04 0.08 0.00 -0.12 0.00 0.00 57.88 57.92 1oxn h LEU 91 Cb -0.00 -0.14 -0.02 0.00 -0.73 0.00 0.00 40.66 39.77 1oxn h LEU 91 CO -0.06 0.42 0.31 0.00 -0.62 0.00 0.00 178.44 178.50 1oxn h ALA 92 N 1.14 2.08 0.00 1.25 0.00 -1.11 -0.71 119.26 121.91 1oxn h ALA 92 Ca 0.16 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1oxn h ALA 92 Cb -0.03 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.71 1oxn h ALA 92 CO -0.03 -0.18 0.00 0.66 0.00 0.00 0.00 179.25 179.70 1oxn h SER 93 N 0.27 0.00 -0.46 0.00 4.64 -0.63 -2.78 113.55 114.59 1oxn h SER 93 Ca 0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.53 1oxn h SER 93 Cb 0.47 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.56 1oxn h SER 93 CO -0.04 0.00 0.00 0.49 -0.87 0.00 0.00 176.83 176.41 1oxn n PHE 94 N -2.62 0.82 -0.23 4.77 3.01 -0.27 -4.40 117.46 118.53 1oxn n PHE 94 Ca -0.01 -0.36 0.18 0.00 1.01 0.00 0.00 57.45 58.26 1oxn n PHE 94 Cb 0.10 -0.09 0.49 0.00 -0.01 0.00 0.00 39.48 39.97 1oxn n PHE 94 CO 0.00 0.00 0.00 0.10 1.01 0.00 0.00 176.76 177.87 1oxn h TYR 95 N 2.76 0.57 -0.64 1.38 -0.00 -1.66 0.96 116.97 120.34 1oxn h TYR 95 Ca 0.00 0.02 -0.19 0.00 -0.00 0.00 0.00 58.73 58.56 1oxn h TYR 95 Cb 0.85 -0.18 -0.11 0.00 -0.00 0.00 0.00 36.73 37.29 1oxn h TYR 95 CO 0.42 0.17 0.20 -0.40 -0.00 0.00 0.00 178.16 178.56 1oxn n ASP 96 N -4.52 4.50 -4.72 0.10 5.75 -1.26 -4.99 116.55 111.41 1oxn n ASP 96 Ca 0.18 -3.25 -0.42 0.00 -0.01 0.00 0.00 54.79 51.29 1oxn n ASP 96 Cb 0.64 -0.71 -0.01 0.00 -1.03 0.00 0.00 41.12 40.01 1oxn n ASP 96 CO 0.00 0.00 0.00 1.87 -0.11 0.00 0.00 177.20 178.96 1oxn n TRP 97 N -0.30 2.56 -1.86 2.11 -0.00 0.33 -4.90 117.44 115.38 1oxn n TRP 97 Ca 0.38 0.46 -0.40 0.00 -0.00 0.00 0.00 57.50 57.94 1oxn n TRP 97 Cb 1.30 -2.48 0.00 0.00 -0.00 0.00 0.00 31.31 30.13 1oxn n TRP 97 CO 0.00 0.00 0.00 -2.14 -0.00 0.00 0.00 177.69 175.55 1oxn s PRO 98 N -1.56 3.99 0.28 5.87 0.02 -1.26 -4.88 135.00 137.45 1oxn s PRO 98 Ca 0.58 2.44 0.25 0.00 0.02 0.00 0.00 61.00 64.28 1oxn s PRO 98 Cb -0.54 -2.86 1.00 0.00 0.02 0.00 0.00 34.50 32.12 1oxn s PRO 98 CO 0.59 -0.58 1.74 -0.07 -0.33 0.00 0.00 177.00 178.35 1oxn h LEU 99 N 2.79 0.00 0.00 -5.54 3.38 -1.99 -2.08 115.31 111.87 1oxn h LEU 99 Ca -0.50 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.47 1oxn h LEU 99 Cb 1.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.00 1oxn h LEU 99 CO 0.63 0.00 -0.24 0.35 0.09 0.00 0.00 178.44 179.27 1oxn n THR 100 N -2.33 0.10 -0.93 0.22 -2.24 -1.26 -4.96 114.28 102.89 1oxn n THR 100 Ca 0.02 -0.06 -0.31 0.00 -2.27 0.00 0.00 64.05 61.43 1oxn n THR 100 Cb 0.25 -0.21 0.14 0.00 -2.10 0.00 0.00 70.33 68.41 1oxn n THR 100 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1oxn s ALA 101 N -3.03 1.78 0.00 6.98 0.00 -0.78 -4.97 121.76 121.73 1oxn s ALA 101 Ca 0.12 0.49 0.00 0.00 0.00 0.00 0.00 51.96 52.57 1oxn s ALA 101 Cb 0.17 -3.39 0.00 0.00 0.00 0.00 0.00 23.12 19.90 1oxn s ALA 101 CO 0.62 -2.38 0.18 0.39 0.00 0.00 0.00 175.76 174.58 1oxn n GLU 102 N -3.92 2.87 -4.78 0.00 1.02 -1.26 -4.97 120.64 109.61 1oxn n GLU 102 Ca 0.11 -0.18 -0.26 0.00 -0.02 0.00 0.00 57.16 56.80 1oxn n GLU 102 Cb 0.52 -0.64 -0.16 0.00 -0.02 0.00 0.00 31.44 31.14 1oxn n GLU 102 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1oxn s VAL 103 N -0.46 1.39 0.33 2.62 1.01 -1.26 -4.17 120.40 119.85 1oxn s VAL 103 Ca 0.00 -0.65 -0.27 0.00 0.00 0.00 0.00 61.98 61.06 1oxn s VAL 103 Cb 0.00 -1.23 -0.09 0.00 0.00 0.00 0.00 36.38 35.06 1oxn s VAL 103 CO 0.00 0.41 1.07 -2.16 0.00 0.00 0.00 175.10 174.42 1oxn s PRO 104 N 0.40 4.45 0.29 2.72 0.04 -1.26 -4.94 135.00 136.69 1oxn s PRO 104 Ca -0.12 1.68 0.02 0.00 0.04 0.00 0.00 61.00 62.62 1oxn s PRO 104 Cb -0.15 -2.93 0.70 0.00 0.04 0.00 0.00 34.50 32.16 1oxn s PRO 104 CO 0.04 0.07 1.67 -1.35 0.04 0.00 0.00 177.00 177.48 1oxn h PRO 105 N 3.29 0.29 -0.85 0.56 0.11 -1.97 -2.23 132.00 131.20 1oxn h PRO 105 Ca -0.47 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1oxn h PRO 105 Cb 1.21 -0.07 -0.04 0.00 0.11 0.00 0.00 31.00 32.21 1oxn h PRO 105 CO 0.65 0.19 0.55 1.49 -0.21 0.00 0.00 178.00 180.67 1oxn h GLU 106 N 0.30 1.13 -0.31 1.05 4.22 -1.94 0.22 114.58 119.25 1oxn h GLU 106 Ca 0.54 -0.08 -0.18 0.00 0.08 0.00 0.00 59.36 59.73 1oxn h GLU 106 Cb 1.06 -0.25 -0.00 0.00 0.50 0.00 0.00 28.75 30.06 1oxn h GLU 106 CO -0.58 0.76 -0.49 -0.07 -2.18 0.00 0.00 179.01 176.45 1oxn h LEU 107 N 1.16 0.98 -0.22 1.64 4.07 -1.84 -1.89 115.31 119.20 1oxn h LEU 107 Ca 0.31 -0.51 -0.01 0.00 0.08 0.00 0.00 57.88 57.74 1oxn h LEU 107 Cb -0.11 -0.28 -0.01 0.00 1.08 0.00 0.00 40.66 41.34 1oxn h LEU 107 CO -0.06 1.30 0.09 -0.07 -1.08 0.00 0.00 178.44 178.62 1oxn h LEU 108 N 0.68 0.30 -0.91 1.67 3.38 -0.78 -2.36 115.31 117.28 1oxn h LEU 108 Ca 0.03 -0.15 -0.09 0.00 0.09 0.00 0.00 57.88 57.75 1oxn h LEU 108 Cb 1.10 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.75 1oxn h LEU 108 CO 0.11 0.37 -0.17 0.00 0.09 0.00 0.00 178.44 178.85 1oxn h ALA 109 N 0.94 1.08 -0.53 1.53 0.00 -0.59 -1.62 119.26 120.08 1oxn h ALA 109 Ca 0.07 -0.32 -0.02 0.00 0.00 0.00 0.00 54.91 54.64 1oxn h ALA 109 Cb 0.16 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 1oxn h ALA 109 CO -0.01 0.56 0.23 0.00 0.00 0.00 0.00 179.25 180.04 1oxn h ALA 110 N 1.27 1.41 -0.18 0.00 0.00 -1.21 -2.27 119.26 118.28 1oxn h ALA 110 Ca 0.09 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1oxn h ALA 110 Cb 0.60 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1oxn h ALA 110 CO 0.04 0.46 0.00 0.00 0.00 0.00 0.00 179.25 179.75 1oxn n ALA 111 N -2.46 2.49 -0.05 0.00 0.00 -0.69 -4.86 120.51 114.94 1oxn n ALA 111 Ca 0.04 -0.33 0.00 0.00 0.00 0.00 0.00 53.44 53.15 1oxn n ALA 111 Cb 0.14 -0.99 0.00 0.00 0.00 0.00 0.00 19.45 18.61 1oxn n ALA 111 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1oxn n GLY 112 N 0.77 0.53 3.83 0.00 0.00 -0.85 -4.85 105.19 104.61 1oxn n GLY 112 Ca 0.06 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.70 1oxn n GLY 112 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1oxn s PHE 113 N -2.09 3.74 0.22 1.61 0.08 -0.72 -0.78 117.98 120.04 1oxn s PHE 113 Ca 0.00 1.12 0.11 0.00 0.12 0.00 0.00 56.93 58.28 1oxn s PHE 113 Cb 0.00 -2.39 -0.05 0.00 -0.57 0.00 0.00 43.02 40.02 1oxn s PHE 113 CO 0.00 0.59 -0.17 -0.59 -0.10 0.00 0.00 175.22 174.95 1oxn s PHE 114 N -1.15 2.43 0.10 0.36 -0.12 0.84 -3.65 117.98 116.77 1oxn s PHE 114 Ca 0.28 -0.30 -0.29 0.00 -0.05 0.00 0.00 56.93 56.57 1oxn s PHE 114 Cb -0.18 -1.14 -0.06 0.00 -0.63 0.00 0.00 43.02 41.02 1oxn s PHE 114 CO 0.17 0.58 0.93 -1.58 -0.05 0.00 0.00 175.22 175.26 1oxn s HIS 115 N -1.99 3.80 -0.30 3.49 5.65 -1.26 -1.23 115.29 123.44 1oxn s HIS 115 Ca 0.26 1.74 0.25 0.00 0.25 0.00 0.00 55.06 57.56 1oxn s HIS 115 Cb -0.07 -3.02 0.57 0.00 -1.18 0.00 0.00 32.58 28.88 1oxn s HIS 115 CO 0.14 0.21 1.69 1.79 -0.65 0.00 0.00 174.74 177.92 1oxn h THR 116 N 4.07 0.04 0.00 0.89 1.35 -1.73 -3.46 112.91 114.06 1oxn h THR 116 Ca -0.43 -0.93 0.00 0.00 -0.55 0.00 0.00 66.41 64.50 1oxn h THR 116 Cb 1.21 1.90 0.00 0.00 -1.73 0.00 0.00 68.15 69.53 1oxn h THR 116 CO 0.72 0.02 0.00 0.61 -0.25 0.00 0.00 175.52 176.62 1oxn n GLY 117 N 0.86 0.84 2.98 5.82 0.00 -1.26 -5.06 105.19 109.36 1oxn n GLY 117 Ca 0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.75 1oxn n GLY 117 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1oxn s HIS 118 N -2.01 2.44 0.00 1.61 3.76 -1.26 -5.06 115.29 114.77 1oxn s HIS 118 Ca 0.00 -1.67 0.00 0.00 -0.15 0.00 0.00 55.06 53.24 1oxn s HIS 118 Cb 0.00 -1.63 0.00 0.00 1.11 0.00 0.00 32.58 32.06 1oxn s HIS 118 CO 0.00 -0.76 0.00 1.04 -0.85 0.00 0.00 174.74 174.17 1oxn n GLN 119 N 4.67 0.00 -1.09 1.40 3.00 -1.26 -1.53 117.38 122.57 1oxn n GLN 119 Ca -0.14 0.00 -0.17 0.00 -0.01 0.00 0.00 57.00 56.69 1oxn n GLN 119 Cb 0.46 0.00 0.18 0.00 0.00 0.00 0.00 30.24 30.87 1oxn n GLN 119 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.06 176.66 1oxn n ASP 120 N 0.61 3.47 -4.73 1.08 5.75 -1.26 -4.43 116.55 117.05 1oxn n ASP 120 Ca 0.00 -3.71 -0.41 0.00 -0.01 0.00 0.00 54.79 50.66 1oxn n ASP 120 Cb 0.00 -0.75 -0.04 0.00 -1.03 0.00 0.00 41.12 39.30 1oxn n ASP 120 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 1oxn s LYS 121 N -3.32 4.54 0.14 0.11 1.02 -0.58 -4.43 119.74 117.21 1oxn s LYS 121 Ca 0.52 1.69 0.05 0.00 0.02 0.00 0.00 55.97 58.26 1oxn s LYS 121 Cb 0.45 -3.32 -0.04 0.00 -0.52 0.00 0.00 37.83 34.39 1oxn s LYS 121 CO 0.05 -0.05 -0.12 0.14 -0.92 0.00 0.00 175.35 174.45 1oxn s VAL 122 N 0.35 1.28 0.03 3.17 -7.23 0.53 -2.01 120.40 116.53 1oxn s VAL 122 Ca 0.53 -1.93 0.03 0.00 -1.81 0.00 0.00 61.98 58.80 1oxn s VAL 122 Cb -0.28 -1.72 -0.02 0.00 0.56 0.00 0.00 36.38 34.92 1oxn s VAL 122 CO 0.32 -0.60 -0.10 -0.13 -0.31 0.00 0.00 175.10 174.28 1oxn s ARG 123 N -3.28 0.67 0.20 4.82 0.52 -0.36 -1.05 118.95 120.47 1oxn s ARG 123 Ca 0.14 -0.66 -0.30 0.00 -0.52 0.00 0.00 55.73 54.39 1oxn s ARG 123 Cb -0.01 -0.58 -0.08 0.00 0.52 0.00 0.00 34.95 34.80 1oxn s ARG 123 CO 0.02 0.14 1.00 0.00 0.02 0.00 0.00 175.30 176.47 1oxn h PHE 125 N 4.64 0.14 0.00 0.00 -0.00 -1.25 -0.68 116.94 119.79 1oxn h PHE 125 Ca -0.45 -0.01 0.00 0.00 -0.00 0.00 0.00 57.97 57.51 1oxn h PHE 125 Cb 1.21 -0.04 0.00 0.00 -0.00 0.00 0.00 35.95 37.11 1oxn h PHE 125 CO 0.62 0.23 -0.07 0.35 -0.00 0.00 0.00 178.31 179.45 1oxn h PHE 126 N 0.14 0.00 0.00 6.09 3.04 -1.85 0.12 116.94 124.47 1oxn h PHE 126 Ca 0.03 0.00 0.00 0.00 3.98 0.00 0.00 57.97 61.98 1oxn h PHE 126 Cb 0.25 0.00 0.00 0.00 2.56 0.00 0.00 35.95 38.76 1oxn h PHE 126 CO 0.00 0.00 -0.41 0.00 -2.02 0.00 0.00 178.31 175.88 1oxn n TYR 128 N -1.56 0.00 -1.70 0.00 9.36 -0.26 -4.94 117.16 118.06 1oxn n TYR 128 Ca 0.06 0.00 -0.43 0.00 3.32 0.00 0.00 57.90 60.85 1oxn n TYR 128 Cb 0.35 -2.10 -0.03 0.00 -0.63 0.00 0.00 39.34 36.92 1oxn n TYR 128 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1oxn n GLY 129 N -0.46 1.57 3.55 2.98 0.00 -1.26 -4.50 105.19 107.06 1oxn n GLY 129 Ca -0.07 0.68 -0.35 0.00 0.00 0.00 0.00 46.02 46.28 1oxn n GLY 129 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1oxn s GLY 130 N 2.04 1.82 0.08 -0.02 0.00 -1.26 -1.30 107.32 108.68 1oxn s GLY 130 Ca 0.80 -0.88 0.05 0.00 0.00 0.00 0.00 44.72 44.68 1oxn s GLY 130 CO 0.36 0.18 -0.14 1.08 0.00 0.00 0.00 173.10 174.58 1oxn s LEU 131 N 0.75 2.29 0.00 0.66 1.43 -0.22 -4.97 118.68 118.63 1oxn s LEU 131 Ca 0.02 -0.64 -0.04 0.00 -1.03 0.00 0.00 54.13 52.44 1oxn s LEU 131 Cb -0.14 -0.51 0.02 0.00 0.03 0.00 0.00 46.19 45.60 1oxn s LEU 131 CO 0.02 -0.09 0.45 0.00 0.23 0.00 0.00 176.35 176.96 1oxn n GLN 132 N 1.20 0.65 -3.57 1.70 10.64 -1.26 -0.35 117.38 126.39 1oxn n GLN 132 Ca -0.21 -2.08 -0.21 0.00 -1.83 0.00 0.00 57.00 52.68 1oxn n GLN 132 Cb 0.54 2.15 0.05 0.00 -0.86 0.00 0.00 30.24 32.12 1oxn n GLN 132 CO 0.00 0.00 0.00 0.43 -1.83 0.00 0.00 177.06 175.66 1oxn n SER 133 N -1.64 -2.63 -4.73 2.61 7.64 -1.26 -4.92 113.62 108.69 1oxn n SER 133 Ca -0.02 -0.78 -0.41 0.00 1.01 0.00 0.00 58.87 58.67 1oxn n SER 133 Cb 0.46 -4.39 -0.03 0.00 -1.01 0.00 0.00 64.21 59.24 1oxn n SER 133 CO 0.00 0.00 0.00 0.26 -3.01 0.00 0.00 175.04 172.29 1oxn s TRP 134 N -3.54 3.40 0.15 1.43 0.52 -1.26 -5.03 118.94 114.61 1oxn s TRP 134 Ca 0.12 1.35 0.07 0.00 0.02 0.00 0.00 56.10 57.66 1oxn s TRP 134 Cb -0.03 -3.47 -0.04 0.00 -1.15 0.00 0.00 33.47 28.78 1oxn s TRP 134 CO 0.79 -1.38 -0.03 0.15 0.02 0.00 0.00 176.95 176.50 1oxn s LYS 135 N 0.06 2.33 0.16 4.98 1.02 -1.26 -4.23 119.74 122.80 1oxn s LYS 135 Ca 0.55 -1.08 -0.34 0.00 0.02 0.00 0.00 55.97 55.12 1oxn s LYS 135 Cb -0.33 -2.35 -0.15 0.00 -0.52 0.00 0.00 37.83 34.49 1oxn s LYS 135 CO 0.35 0.47 1.39 -2.13 -0.92 0.00 0.00 175.35 174.51 1oxn n ARG 136 N 0.11 1.64 -0.08 1.68 0.63 -1.26 -0.46 116.66 118.92 1oxn n ARG 136 Ca -0.11 0.59 0.00 0.00 -0.92 0.00 0.00 57.85 57.41 1oxn n ARG 136 Cb 0.54 -2.24 0.00 0.00 0.45 0.00 0.00 32.46 31.22 1oxn n ARG 136 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1oxn n GLY 137 N 2.58 2.26 3.72 5.14 0.00 -1.26 -5.01 105.19 112.62 1oxn n GLY 137 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 1oxn n GLY 137 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1oxn n ASP 138 N 0.00 3.82 -4.49 1.61 9.92 0.39 -4.96 116.55 122.84 1oxn n ASP 138 Ca 0.00 1.09 -0.41 0.00 -0.53 0.00 0.00 54.79 54.95 1oxn n ASP 138 Cb 0.00 -1.56 -0.11 0.00 -0.64 0.00 0.00 41.12 38.81 1oxn n ASP 138 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 1oxn s ASP 139 N 0.90 6.00 0.24 -2.24 2.15 -1.26 -4.96 116.67 117.49 1oxn s ASP 139 Ca 0.72 -0.58 -0.05 0.00 0.43 0.00 0.00 52.55 53.07 1oxn s ASP 139 Cb -0.53 -2.12 0.43 0.00 -0.30 0.00 0.00 42.92 40.40 1oxn s ASP 139 CO 0.39 -0.29 1.74 -0.65 -0.17 0.00 0.00 175.17 176.19 1oxn h PRO 140 N 8.50 0.46 -0.47 4.34 0.11 -1.93 -0.28 132.00 142.74 1oxn h PRO 140 Ca -0.30 -0.03 0.05 0.00 0.11 0.00 0.00 66.00 65.84 1oxn h PRO 140 Cb 1.14 -0.10 -0.05 0.00 0.11 0.00 0.00 31.00 32.10 1oxn h PRO 140 CO 0.66 0.31 0.19 -1.49 -0.21 0.00 0.00 178.00 177.46 1oxn h TRP 141 N 0.48 0.35 -0.45 0.65 -0.00 -1.88 0.13 115.95 115.22 1oxn h TRP 141 Ca 0.40 0.02 -0.04 0.00 -0.00 0.00 0.00 58.89 59.27 1oxn h TRP 141 Cb 0.57 -0.09 -0.02 0.00 -0.00 0.00 0.00 29.16 29.63 1oxn h TRP 141 CO -0.15 0.14 0.13 1.15 -0.00 0.00 0.00 178.44 179.71 1oxn h THR 142 N 0.39 1.23 -0.64 1.49 2.02 -1.71 -0.43 112.91 115.25 1oxn h THR 142 Ca 0.22 -0.77 -0.03 0.00 0.77 0.00 0.00 66.41 66.59 1oxn h THR 142 Cb 0.19 0.87 -0.03 0.00 -1.74 0.00 0.00 68.15 67.44 1oxn h THR 142 CO -0.20 0.28 0.27 -0.33 0.37 0.00 0.00 175.52 175.91 1oxn h GLU 143 N 0.60 0.96 -0.73 6.66 4.39 -0.86 0.22 114.58 125.81 1oxn h GLU 143 Ca 0.14 -0.17 0.06 0.00 0.34 0.00 0.00 59.36 59.73 1oxn h GLU 143 Cb 0.29 -0.16 -0.06 0.00 -0.10 0.00 0.00 28.75 28.73 1oxn h GLU 143 CO -0.00 0.80 0.43 1.25 -1.16 0.00 0.00 179.01 180.33 1oxn h HIS 144 N 0.90 0.80 -0.21 4.33 2.76 -0.33 -1.67 115.15 121.74 1oxn h HIS 144 Ca 0.22 0.03 -0.20 0.00 -2.20 0.00 0.00 60.37 58.21 1oxn h HIS 144 Cb 0.19 -0.25 0.00 0.00 1.55 0.00 0.00 27.41 28.90 1oxn h HIS 144 CO 0.01 0.40 -0.67 0.00 -1.30 0.00 0.00 177.93 176.37 1oxn h ALA 145 N 1.36 0.41 -0.92 5.26 0.00 -0.53 -0.27 119.26 124.56 1oxn h ALA 145 Ca 0.32 -0.56 0.03 0.00 0.00 0.00 0.00 54.91 54.70 1oxn h ALA 145 Cb 0.16 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 17.85 1oxn h ALA 145 CO -0.17 0.69 0.60 -0.22 0.00 0.00 0.00 179.25 180.15 1oxn h LYS 146 N 0.58 1.15 0.00 0.00 3.64 -0.27 -3.25 116.57 118.42 1oxn h LYS 146 Ca -0.02 -0.07 -0.34 0.00 -1.27 0.00 0.00 60.65 58.95 1oxn h LYS 146 Cb 1.29 -0.26 -0.06 0.00 -0.41 0.00 0.00 32.23 32.78 1oxn h LYS 146 CO 0.14 0.76 -2.30 0.91 -2.27 0.00 0.00 179.45 176.69 1oxn n TRP 147 N -4.49 0.00 -3.13 1.91 7.02 -0.65 -4.70 117.44 113.39 1oxn n TRP 147 Ca 0.12 0.00 -0.23 0.00 -1.02 0.00 0.00 57.50 56.37 1oxn n TRP 147 Cb 0.07 -0.92 -0.04 0.00 -2.42 0.00 0.00 31.31 28.00 1oxn n TRP 147 CO 0.00 0.00 0.00 1.19 -2.02 0.00 0.00 177.69 176.86 1oxn n PHE 148 N -2.80 1.76 0.29 -5.99 3.72 -0.12 -4.95 117.46 109.38 1oxn n PHE 148 Ca -0.33 -3.88 0.15 0.00 -0.05 0.00 0.00 57.45 53.34 1oxn n PHE 148 Cb 1.07 -0.45 0.92 0.00 -0.94 0.00 0.00 39.48 40.08 1oxn n PHE 148 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1oxn h PRO 149 N 3.25 0.00 -0.02 -1.08 0.13 -1.71 -1.68 132.00 130.89 1oxn h PRO 149 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 1oxn h PRO 149 Cb 0.77 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.90 1oxn h PRO 149 CO 0.64 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 177.28 1oxn n SER 150 N -3.82 1.42 -4.67 1.44 3.41 -1.26 -4.82 113.62 105.32 1oxn n SER 150 Ca -0.03 -1.48 -0.44 0.00 -0.26 0.00 0.00 58.87 56.66 1oxn n SER 150 Cb 0.10 -0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.01 1oxn n SER 150 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1oxn h GLN 152 N 9.54 0.00 -0.12 0.00 4.20 -1.90 0.85 115.11 127.68 1oxn h GLN 152 Ca -0.49 0.00 -0.06 0.00 0.06 0.00 0.00 58.65 58.16 1oxn h GLN 152 Cb 1.25 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 29.03 1oxn h GLN 152 CO 0.94 0.45 -0.16 0.35 -0.67 0.00 0.00 178.83 179.74 1oxn h PHE 153 N 0.00 0.39 -0.06 2.96 3.57 -1.96 0.90 116.94 122.74 1oxn h PHE 153 Ca -0.00 -0.13 0.04 0.00 3.53 0.00 0.00 57.97 61.40 1oxn h PHE 153 Cb 1.02 -0.08 -0.05 0.00 2.79 0.00 0.00 35.95 39.63 1oxn h PHE 153 CO 0.00 0.76 -0.23 1.25 -2.23 0.00 0.00 178.31 177.86 1oxn h LEU 154 N -0.10 -0.69 -0.39 0.59 5.85 -1.86 -1.31 115.31 117.40 1oxn h LEU 154 Ca 0.01 0.10 0.02 0.00 0.84 0.00 0.00 57.88 58.85 1oxn h LEU 154 Cb 0.72 0.30 -0.03 0.00 0.37 0.00 0.00 40.66 42.02 1oxn h LEU 154 CO 0.04 -0.29 0.23 -0.07 -0.34 0.00 0.00 178.44 178.01 1oxn h LEU 155 N -0.33 0.37 -0.92 2.25 3.38 -0.77 0.32 115.31 119.61 1oxn h LEU 155 Ca 0.08 0.00 0.01 0.00 0.09 0.00 0.00 57.88 58.06 1oxn h LEU 155 Cb 0.44 -0.08 -0.05 0.00 0.09 0.00 0.00 40.66 41.07 1oxn h LEU 155 CO -0.25 0.27 0.61 0.03 0.09 0.00 0.00 178.44 179.19 1oxn h ARG 156 N 0.47 1.22 0.02 1.13 3.08 -0.73 0.21 114.38 119.78 1oxn h ARG 156 Ca 0.15 -0.08 -0.03 0.00 0.07 0.00 0.00 59.98 60.09 1oxn h ARG 156 Cb 0.00 -0.27 0.00 0.00 0.08 0.00 0.00 29.97 29.78 1oxn h ARG 156 CO -0.07 0.81 -0.13 0.77 -1.07 0.00 0.00 179.97 180.28 1oxn h SER 157 N 1.25 0.09 0.00 7.04 0.02 -0.67 -3.39 113.55 117.89 1oxn h SER 157 Ca 0.34 -0.92 0.00 0.00 -0.84 0.00 0.00 61.79 60.37 1oxn h SER 157 Cb -0.14 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 62.38 1oxn h SER 157 CO -0.07 1.00 -1.44 0.29 -1.14 0.00 0.00 176.83 175.47 1oxn n LYS 158 N -4.56 0.87 0.00 3.45 4.76 0.11 -5.09 118.16 117.70 1oxn n LYS 158 Ca -0.10 -0.10 0.00 0.00 -2.87 0.00 0.00 58.31 55.23 1oxn n LYS 158 Cb 0.51 -1.36 0.00 0.00 -1.84 0.00 0.00 35.03 32.34 1oxn n LYS 158 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1oxn n GLY 159 N 1.49 -0.89 0.29 0.72 0.00 0.74 -4.15 105.19 103.40 1oxn n GLY 159 Ca -0.01 -1.56 0.00 0.00 0.00 0.00 0.00 46.02 44.46 1oxn n GLY 159 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1oxn h ARG 160 N 0.00 0.60 -0.28 1.61 2.43 -1.93 -3.02 114.38 113.80 1oxn h ARG 160 Ca 0.00 -0.10 -0.00 0.00 -0.81 0.00 0.00 59.98 59.07 1oxn h ARG 160 Cb 0.00 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.43 1oxn h ARG 160 CO 0.00 0.54 0.16 -0.44 -1.51 0.00 0.00 179.97 178.72 1oxn h ASP 161 N 0.59 0.34 -0.30 -3.80 5.19 -1.96 0.85 116.42 117.33 1oxn h ASP 161 Ca 0.14 -0.06 0.02 0.00 -0.62 0.00 0.00 57.03 56.51 1oxn h ASP 161 Cb 0.20 -0.09 -0.02 0.00 0.18 0.00 0.00 39.33 39.61 1oxn h ASP 161 CO -0.01 0.30 0.16 0.15 -3.12 0.00 0.00 179.24 176.72 1oxn h PHE 162 N 0.35 0.29 -0.40 4.55 3.57 -1.69 0.34 116.94 123.95 1oxn h PHE 162 Ca 0.10 0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.56 1oxn h PHE 162 Cb 0.03 -0.09 -0.02 0.00 2.79 0.00 0.00 35.95 38.66 1oxn h PHE 162 CO -0.04 0.16 0.07 0.28 -2.23 0.00 0.00 178.31 176.55 1oxn h VAL 163 N 0.32 1.24 -0.57 1.41 2.07 -1.38 -1.13 116.25 118.22 1oxn h VAL 163 Ca 0.12 -0.86 0.02 0.00 0.82 0.00 0.00 66.70 66.81 1oxn h VAL 163 Cb 0.03 1.03 -0.04 0.00 -1.52 0.00 0.00 31.29 30.80 1oxn h VAL 163 CO -0.08 0.29 0.35 -0.74 0.02 0.00 0.00 177.57 177.42 1oxn h HIS 164 N 0.51 0.66 -0.68 1.57 -0.00 -0.63 0.15 115.15 116.73 1oxn h HIS 164 Ca 0.12 0.02 -0.07 0.00 -0.00 0.00 0.00 60.37 60.44 1oxn h HIS 164 Cb 0.36 -0.21 -0.03 0.00 -0.00 0.00 0.00 27.41 27.53 1oxn h HIS 164 CO 0.02 0.38 0.13 0.66 -0.00 0.00 0.00 177.93 179.13 1oxn h SER 165 N 0.70 1.05 -0.57 3.26 4.64 -0.62 -1.72 113.55 120.29 1oxn h SER 165 Ca 0.23 -0.24 -0.11 0.00 -0.47 0.00 0.00 61.79 61.20 1oxn h SER 165 Cb 0.01 -0.28 -0.02 0.00 -0.31 0.00 0.00 62.40 61.80 1oxn h SER 165 CO -0.09 1.02 -0.08 0.58 -0.87 0.00 0.00 176.83 177.39 1oxn h VAL 166 N 1.03 1.27 0.00 0.95 2.07 -0.85 -2.84 116.25 117.88 1oxn h VAL 166 Ca 0.21 -1.24 -0.05 0.00 0.82 0.00 0.00 66.70 66.43 1oxn h VAL 166 Cb 0.41 0.91 -0.01 0.00 -1.52 0.00 0.00 31.29 31.08 1oxn h VAL 166 CO 0.01 0.44 -0.25 1.56 0.02 0.00 0.00 177.57 179.35 1oxn h GLN 167 N 0.94 0.00 0.00 1.57 1.08 -0.30 -2.96 115.11 115.44 1oxn h GLN 167 Ca 0.15 0.00 -0.21 0.00 -1.45 0.00 0.00 58.65 57.14 1oxn h GLN 167 Cb 0.65 0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 28.05 1oxn h GLN 167 CO 0.04 0.25 -1.10 0.93 -0.95 0.00 0.00 178.83 178.00 1oxn h GLU 168 N 0.00 0.00 -3.06 1.46 5.08 -1.21 -3.27 114.58 113.57 1oxn h GLU 168 Ca -0.00 0.00 -0.68 0.00 -1.00 0.00 0.00 59.36 57.68 1oxn h GLU 168 Cb 0.46 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.73 1oxn h GLU 168 CO 0.03 0.82 3.73 0.25 -1.00 0.00 0.00 179.01 182.84 1oxn n THR 169 N -3.26 4.30 0.00 1.13 -2.24 -1.08 -5.12 114.28 108.02 1oxn n THR 169 Ca -0.03 -2.71 0.00 0.00 -2.27 0.00 0.00 64.05 59.04 1oxn n THR 169 Cb 0.94 -2.59 0.00 0.00 -2.10 0.00 0.00 70.33 66.58 1oxn n THR 169 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50