#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ub1 s PRO 73 N 0.00 3.85 -0.25 0.00 0.04 -1.26 -5.04 135.00 132.34 1ub1 s PRO 73 Ca 0.00 1.38 0.01 0.00 0.04 0.00 0.00 61.00 62.43 1ub1 s PRO 73 Cb 0.00 -2.15 0.04 0.00 0.04 0.00 0.00 34.50 32.43 1ub1 s PRO 73 CO 0.00 -0.39 -0.10 0.00 0.04 0.00 0.00 177.00 176.55 1ub1 s ALA 74 N -1.94 2.59 -0.60 8.56 0.00 -1.26 -5.05 121.76 124.07 1ub1 s ALA 74 Ca 0.66 -1.57 0.04 0.00 0.00 0.00 0.00 51.96 51.09 1ub1 s ALA 74 Cb -0.17 -1.58 0.15 0.00 0.00 0.00 0.00 23.12 21.52 1ub1 s ALA 74 CO 0.21 -0.93 0.37 0.08 0.00 0.00 0.00 175.76 175.49 1ub1 s VAL 75 N 1.22 2.62 0.16 0.00 1.01 -1.26 -5.09 120.40 119.07 1ub1 s VAL 75 Ca -0.03 -3.70 -0.30 0.00 0.00 0.00 0.00 61.98 57.95 1ub1 s VAL 75 Cb -0.18 -2.77 -0.07 0.00 0.00 0.00 0.00 36.38 33.36 1ub1 s VAL 75 CO -0.06 -0.91 1.13 -2.16 0.00 0.00 0.00 175.10 173.10 1ub1 s PRO 76 N -0.78 4.55 0.36 2.72 0.04 -1.26 -4.99 135.00 135.65 1ub1 s PRO 76 Ca 0.21 1.75 -0.28 0.00 0.04 0.00 0.00 61.00 62.71 1ub1 s PRO 76 Cb -0.16 -3.28 -0.11 0.00 0.04 0.00 0.00 34.50 31.00 1ub1 s PRO 76 CO -0.08 0.00 1.40 -2.00 0.04 0.00 0.00 177.00 176.37 1ub1 s GLU 77 N -0.17 4.21 0.88 4.56 2.56 -1.26 -5.00 118.70 124.48 1ub1 s GLU 77 Ca 0.51 2.40 -0.13 0.00 0.00 0.00 0.00 54.97 57.75 1ub1 s GLU 77 Cb -0.30 -3.01 0.13 0.00 2.00 0.00 0.00 34.13 32.95 1ub1 s GLU 77 CO 0.34 -0.38 1.21 0.00 -0.56 0.00 0.00 175.26 175.87 1ub1 s ALA 78 N -1.13 2.34 -0.08 6.30 0.00 -1.26 -5.07 121.76 122.86 1ub1 s ALA 78 Ca 0.51 -0.78 0.00 0.00 0.00 0.00 0.00 51.96 51.70 1ub1 s ALA 78 Cb -0.43 -2.92 -0.03 0.00 0.00 0.00 0.00 23.12 19.73 1ub1 s ALA 78 CO 0.58 -2.03 -0.06 0.45 0.00 0.00 0.00 175.76 174.71 1ub1 s SER 79 N -4.55 4.75 0.24 0.00 0.15 -1.26 -5.12 113.70 107.91 1ub1 s SER 79 Ca 0.66 -0.00 0.00 0.00 0.70 0.00 0.00 55.95 57.30 1ub1 s SER 79 Cb -0.10 -1.27 0.00 0.00 -1.71 0.00 0.00 66.02 62.95 1ub1 s SER 79 CO 0.51 0.35 0.01 0.00 1.20 0.00 0.00 173.24 175.31 1ub1 n ALA 80 N 2.31 0.21 -3.32 5.45 0.00 -1.26 -5.17 120.51 118.73 1ub1 n ALA 80 Ca -0.18 -1.07 -0.15 0.00 0.00 0.00 0.00 53.44 52.04 1ub1 n ALA 80 Cb 0.53 0.58 -0.07 0.00 0.00 0.00 0.00 19.45 20.49 1ub1 n ALA 80 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1ub1 s SER 81 N -2.32 -0.35 0.36 0.00 0.15 -1.26 -5.18 113.70 105.10 1ub1 s SER 81 Ca 0.01 0.28 0.00 0.00 0.70 0.00 0.00 55.95 56.93 1ub1 s SER 81 Cb -0.00 0.40 0.00 0.00 -1.71 0.00 0.00 66.02 64.71 1ub1 s SER 81 CO 0.00 -0.53 0.00 -0.81 1.20 0.00 0.00 173.24 173.10 1ub1 n PRO 82 N 1.06 0.46 -0.91 5.44 -0.04 -1.26 -5.08 135.00 134.67 1ub1 n PRO 82 Ca -0.20 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.17 1ub1 n PRO 82 Cb 0.57 0.00 0.06 0.00 -0.04 0.00 0.00 33.50 34.09 1ub1 n PRO 82 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1ub1 n LYS 83 N -0.45 -0.10 -0.09 0.54 4.01 -1.26 -5.04 118.16 115.76 1ub1 n LYS 83 Ca 0.00 -0.79 -0.23 0.00 -0.51 0.00 0.00 58.31 56.78 1ub1 n LYS 83 Cb 0.00 -0.37 -0.12 0.00 -0.51 0.00 0.00 35.03 34.04 1ub1 n LYS 83 CO 0.00 0.00 0.00 1.04 -1.11 0.00 0.00 177.40 177.33 1ub1 n GLN 84 N -1.82 0.61 -2.04 1.97 3.00 -1.26 -4.98 117.38 112.86 1ub1 n GLN 84 Ca 0.06 0.45 -0.16 0.00 -0.01 0.00 0.00 57.00 57.34 1ub1 n GLN 84 Cb 0.20 -1.69 -0.03 0.00 0.00 0.00 0.00 30.24 28.72 1ub1 n GLN 84 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.06 177.60 1ub1 n ARG 85 N -4.18 -1.19 -3.12 -1.09 3.00 -1.26 -4.98 116.66 103.83 1ub1 n ARG 85 Ca -0.36 0.84 -0.29 0.00 -0.01 0.00 0.00 57.85 58.03 1ub1 n ARG 85 Cb 0.80 -5.14 -0.03 0.00 0.00 0.00 0.00 32.46 28.08 1ub1 n ARG 85 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.63 178.13 1ub1 s ARG 86 N -4.33 3.70 0.18 5.56 6.06 -1.26 -4.91 118.95 123.95 1ub1 s ARG 86 Ca 0.00 0.21 0.00 0.00 -2.50 0.00 0.00 55.73 53.44 1ub1 s ARG 86 Cb 0.00 -2.53 0.00 0.00 0.06 0.00 0.00 34.95 32.48 1ub1 s ARG 86 CO 0.00 0.10 0.00 0.43 -2.50 0.00 0.00 175.30 173.33 1ub1 n SER 87 N -1.09 -1.65 -1.53 -2.12 7.64 -1.26 -5.17 113.62 108.45 1ub1 n SER 87 Ca 0.00 0.46 0.00 0.00 1.01 0.00 0.00 58.87 60.34 1ub1 n SER 87 Cb 0.54 1.76 0.00 0.00 -1.01 0.00 0.00 64.21 65.50 1ub1 n SER 87 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 1ub1 n ILE 88 N -2.90 -2.89 -2.37 0.44 -0.00 -1.26 -4.95 119.36 105.43 1ub1 n ILE 88 Ca 0.00 1.44 0.13 0.00 -0.00 0.00 0.00 62.75 64.31 1ub1 n ILE 88 Cb 0.00 -2.38 -0.03 0.00 -0.00 0.00 0.00 39.64 37.23 1ub1 n ILE 88 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1ub1 n ILE 89 N -2.54 0.00 -3.01 1.39 0.00 -1.26 -5.05 119.36 108.89 1ub1 n ILE 89 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62.75 62.75 1ub1 n ILE 89 Cb 0.46 -0.31 0.00 0.00 0.00 0.00 0.00 39.64 39.78 1ub1 n ILE 89 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 176.55 175.41 1ub1 n ARG 90 N -3.30 0.00 -2.36 9.51 0.63 -1.26 -5.17 116.66 114.70 1ub1 n ARG 90 Ca 0.01 0.00 -0.24 0.00 -0.92 0.00 0.00 57.85 56.69 1ub1 n ARG 90 Cb 0.42 0.00 0.07 0.00 0.45 0.00 0.00 32.46 33.40 1ub1 n ARG 90 CO 0.00 0.00 0.00 0.16 -2.51 0.00 0.00 177.63 175.28 1ub1 s ASP 91 N 0.09 4.80 0.10 6.15 -4.77 -1.26 -5.11 116.67 116.67 1ub1 s ASP 91 Ca 0.00 0.21 0.00 0.00 -3.30 0.00 0.00 52.55 49.46 1ub1 s ASP 91 Cb 0.00 -0.87 -0.00 0.00 -1.09 0.00 0.00 42.92 40.96 1ub1 s ASP 91 CO 0.00 -1.56 0.00 0.54 0.70 0.00 0.00 175.17 174.85 1ub1 n ARG 92 N -2.79 1.73 -3.15 2.11 3.00 -1.26 -5.15 116.66 111.16 1ub1 n ARG 92 Ca 0.09 -0.70 0.04 0.00 -0.01 0.00 0.00 57.85 57.27 1ub1 n ARG 92 Cb 0.60 0.20 -0.00 0.00 0.00 0.00 0.00 32.46 33.26 1ub1 n ARG 92 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.63 177.83 1ub1 s GLY 93 N -1.53 -1.23 0.83 -0.13 0.00 -1.26 -5.17 107.32 98.83 1ub1 s GLY 93 Ca 0.00 1.17 -0.14 0.00 0.00 0.00 0.00 44.72 45.75 1ub1 s GLY 93 CO 0.00 3.67 0.91 -1.55 0.00 0.00 0.00 173.10 176.13 1ub1 n PRO 94 N 5.41 -1.78 0.00 2.90 -0.04 -1.26 -5.01 135.00 135.22 1ub1 n PRO 94 Ca 0.04 -1.43 0.03 0.00 -0.04 0.00 0.00 63.50 62.10 1ub1 n PRO 94 Cb 0.54 -1.13 0.02 0.00 -0.04 0.00 0.00 33.50 32.89 1ub1 n PRO 94 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ub1 n MET 95 N -3.56 0.00 -0.03 0.54 0.00 -1.26 -4.74 117.12 108.08 1ub1 n MET 95 Ca 0.12 -0.79 -0.00 0.00 0.00 0.00 0.00 57.70 57.02 1ub1 n MET 95 Cb 0.44 -1.09 -0.00 0.00 0.00 0.00 0.00 33.22 32.57 1ub1 n MET 95 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 175.97 177.85 1ub1 h TYR 96 N 1.03 0.00 0.00 3.17 0.05 -1.95 -3.48 116.97 115.78 1ub1 h TYR 96 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1ub1 h TYR 96 Cb 0.22 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.96 1ub1 h TYR 96 CO 0.00 0.00 0.00 -0.25 -1.05 0.00 0.00 178.16 176.86 1ub1 n ASP 97 N -3.38 0.00 -3.53 3.88 10.43 -1.26 -4.84 116.55 117.85 1ub1 n ASP 97 Ca -0.01 0.00 -0.27 0.00 2.57 0.00 0.00 54.79 57.09 1ub1 n ASP 97 Cb 0.02 0.00 -0.09 0.00 1.84 0.00 0.00 41.12 42.89 1ub1 n ASP 97 CO 0.00 0.00 0.00 -0.67 -1.07 0.00 0.00 177.20 175.46 1ub1 n ASP 98 N 3.00 2.92 0.00 -2.24 -0.08 -1.26 -4.96 116.55 113.93 1ub1 n ASP 98 Ca 0.00 -3.24 0.00 0.00 -1.51 0.00 0.00 54.79 50.04 1ub1 n ASP 98 Cb 0.00 -0.69 0.00 0.00 2.34 0.00 0.00 41.12 42.77 1ub1 n ASP 98 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 1ub1 n PRO 99 N 1.33 0.00 -3.97 -0.67 -0.04 -1.26 -4.89 135.00 125.49 1ub1 n PRO 99 Ca 0.26 0.10 -0.29 0.00 -0.04 0.00 0.00 63.50 63.53 1ub1 n PRO 99 Cb 0.41 -0.73 -0.05 0.00 -0.04 0.00 0.00 33.50 33.10 1ub1 n PRO 99 CO 0.00 0.00 0.00 -2.37 -0.04 0.00 0.00 175.50 173.09 1ub1 n THR 100 N -0.80 -1.25 -1.77 0.52 5.66 -1.26 -4.71 114.28 110.66 1ub1 n THR 100 Ca 0.00 -0.42 -0.43 0.00 -3.05 0.00 0.00 64.05 60.15 1ub1 n THR 100 Cb 0.00 -1.14 -0.03 0.00 -1.55 0.00 0.00 70.33 67.61 1ub1 n THR 100 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 175.07 171.26 1ub1 s LEU 101 N -6.68 3.66 -0.03 1.09 1.43 -1.26 -4.82 118.68 112.07 1ub1 s LEU 101 Ca 0.14 1.84 -0.05 0.00 -1.03 0.00 0.00 54.13 55.04 1ub1 s LEU 101 Cb -0.08 -3.52 -0.20 0.00 0.03 0.00 0.00 46.19 42.42 1ub1 s LEU 101 CO 0.79 -1.68 2.84 -0.81 0.23 0.00 0.00 176.35 177.72 1ub1 n PRO 102 N 8.36 1.53 0.00 1.29 -0.04 -1.26 -3.19 135.00 141.69 1ub1 n PRO 102 Ca 0.25 -0.77 0.00 0.00 -0.04 0.00 0.00 63.50 62.94 1ub1 n PRO 102 Cb 0.45 -1.89 0.00 0.00 -0.04 0.00 0.00 33.50 32.02 1ub1 n PRO 102 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 1ub1 n GLU 103 N 2.65 0.00 0.00 0.54 0.28 -1.26 -5.05 120.64 117.80 1ub1 n GLU 103 Ca 0.33 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.33 1ub1 n GLU 103 Cb 0.68 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.55 1ub1 n GLU 103 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1ub1 n GLY 104 N 0.00 2.40 0.00 -1.84 0.00 -1.19 -4.80 105.19 99.75 1ub1 n GLY 104 Ca 0.00 -1.89 0.00 0.00 0.00 0.00 0.00 46.02 44.13 1ub1 n GLY 104 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65 1ub1 n TRP 105 N 0.00 0.00 -3.96 1.61 4.27 -1.26 -3.53 117.44 114.56 1ub1 n TRP 105 Ca 0.00 0.00 -0.09 0.00 -3.89 0.00 0.00 57.50 53.52 1ub1 n TRP 105 Cb 0.00 0.00 -0.05 0.00 -1.36 0.00 0.00 31.31 29.90 1ub1 n TRP 105 CO 0.00 0.00 0.00 0.95 -2.29 0.00 0.00 177.69 176.35 1ub1 s THR 106 N -2.00 0.01 -0.27 -1.67 -4.23 -1.25 -4.99 115.64 101.24 1ub1 s THR 106 Ca 0.00 -1.32 -0.15 0.00 -1.18 0.00 0.00 61.69 59.04 1ub1 s THR 106 Cb 0.00 -2.11 -0.04 0.00 1.34 0.00 0.00 72.50 71.70 1ub1 s THR 106 CO 0.00 -0.03 0.37 0.00 -0.54 0.00 0.00 174.62 174.42 1ub1 s ARG 107 N -3.99 4.02 -0.10 3.99 1.70 -1.26 -1.35 118.95 121.96 1ub1 s ARG 107 Ca 0.20 0.03 -0.02 0.00 -0.47 0.00 0.00 55.73 55.48 1ub1 s ARG 107 Cb -0.01 -3.65 -0.03 0.00 -0.57 0.00 0.00 34.95 30.69 1ub1 s ARG 107 CO 0.07 -0.26 -0.02 0.15 -1.08 0.00 0.00 175.30 174.16 1ub1 s LYS 108 N 2.03 3.08 0.03 3.89 3.01 1.28 -4.87 119.74 128.19 1ub1 s LYS 108 Ca 0.15 -0.45 -0.10 0.00 -1.01 0.00 0.00 55.97 54.55 1ub1 s LYS 108 Cb -0.16 -2.79 -0.05 0.00 -1.01 0.00 0.00 37.83 33.82 1ub1 s LYS 108 CO 0.10 0.61 0.36 -1.17 0.51 0.00 0.00 175.35 175.76 1ub1 s LEU 109 N -0.63 4.39 0.25 3.17 0.20 -1.26 0.35 118.68 125.16 1ub1 s LEU 109 Ca 0.10 0.77 0.03 0.00 0.69 0.00 0.00 54.13 55.72 1ub1 s LEU 109 Cb -0.12 -2.76 -0.05 0.00 -0.43 0.00 0.00 46.19 42.83 1ub1 s LEU 109 CO 0.02 0.24 0.04 -1.59 -0.29 0.00 0.00 176.35 174.78 1ub1 s LYS 110 N -1.61 1.41 -0.09 1.98 -2.85 0.55 -4.21 119.74 114.92 1ub1 s LYS 110 Ca 0.28 -1.74 -0.14 0.00 -1.00 0.00 0.00 55.97 53.38 1ub1 s LYS 110 Cb -0.14 -0.52 -0.05 0.00 -2.06 0.00 0.00 37.83 35.05 1ub1 s LYS 110 CO 0.16 -0.18 0.33 -1.14 0.10 0.00 0.00 175.35 174.61 1ub1 s GLN 111 N -3.93 4.00 0.00 1.78 0.74 -1.26 0.30 119.66 121.29 1ub1 s GLN 111 Ca 0.33 0.22 0.00 0.00 0.05 0.00 0.00 55.36 55.96 1ub1 s GLN 111 Cb 0.07 -3.31 0.00 0.00 1.10 0.00 0.00 33.01 30.87 1ub1 s GLN 111 CO 0.11 0.49 0.00 0.54 -0.55 0.00 0.00 175.29 175.89 1ub1 n ARG 112 N 2.65 0.00 0.00 1.67 1.74 -1.25 -4.71 116.66 116.75 1ub1 n ARG 112 Ca -0.13 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.95 1ub1 n ARG 112 Cb 0.52 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.96 1ub1 n ARG 112 CO 0.00 0.00 0.00 1.17 -1.52 0.00 0.00 177.63 177.28 1ub1 n LYS 113 N -0.44 0.00 -1.23 5.56 3.00 -1.25 -3.83 118.16 119.97 1ub1 n LYS 113 Ca 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 58.31 58.31 1ub1 n LYS 113 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.03 1ub1 n LYS 113 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 1ub1 n SER 114 N -1.32 -0.06 -0.16 3.14 2.88 -1.26 -5.05 113.62 111.79 1ub1 n SER 114 Ca 0.00 -0.75 0.00 0.00 -1.33 0.00 0.00 58.87 56.79 1ub1 n SER 114 Cb 0.00 0.03 0.00 0.00 -0.75 0.00 0.00 64.21 63.49 1ub1 n SER 114 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1ub1 n GLY 115 N -0.05 -0.06 5.09 0.46 0.00 -1.26 -4.52 105.19 104.85 1ub1 n GLY 115 Ca -0.01 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.73 1ub1 n GLY 115 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ub1 n ARG 116 N -0.31 0.00 -2.68 1.61 3.00 -1.26 -2.28 116.66 114.74 1ub1 n ARG 116 Ca 0.00 0.00 -0.17 0.00 -0.01 0.00 0.00 57.85 57.67 1ub1 n ARG 116 Cb 0.00 0.00 0.01 0.00 0.00 0.00 0.00 32.46 32.47 1ub1 n ARG 116 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 1ub1 n SER 117 N 1.20 2.60 0.00 0.55 2.88 -1.26 -5.02 113.62 114.57 1ub1 n SER 117 Ca 0.00 -3.12 0.00 0.00 -1.33 0.00 0.00 58.87 54.42 1ub1 n SER 117 Cb 0.00 -0.52 0.00 0.00 -0.75 0.00 0.00 64.21 62.94 1ub1 n SER 117 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1ub1 n ALA 118 N -0.17 0.00 0.00 -1.46 0.00 -0.97 -4.80 120.51 113.12 1ub1 n ALA 118 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.66 1ub1 n ALA 118 Cb 0.72 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.17 1ub1 n ALA 118 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ub1 n GLY 119 N 0.00 2.32 3.77 0.00 0.00 -1.26 -4.93 105.19 105.10 1ub1 n GLY 119 Ca 0.00 -0.44 -0.38 0.00 0.00 0.00 0.00 46.02 45.20 1ub1 n GLY 119 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ub1 s LYS 120 N 0.00 4.27 0.25 1.61 3.01 -1.26 -5.00 119.74 122.62 1ub1 s LYS 120 Ca 0.00 1.63 0.04 0.00 -1.01 0.00 0.00 55.97 56.63 1ub1 s LYS 120 Cb 0.00 -2.73 0.04 0.00 -1.01 0.00 0.00 37.83 34.13 1ub1 s LYS 120 CO 0.00 -0.07 0.31 0.66 0.51 0.00 0.00 175.35 176.76 1ub1 n TYR 121 N 0.28 -2.38 -4.41 3.18 4.02 -1.26 -3.92 117.16 112.66 1ub1 n TYR 121 Ca 0.03 -0.92 -0.26 0.00 -0.01 0.00 0.00 57.90 56.74 1ub1 n TYR 121 Cb 0.48 -0.23 -0.11 0.00 -0.02 0.00 0.00 39.34 39.46 1ub1 n TYR 121 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 1ub1 s ASP 122 N -2.51 3.62 0.05 7.72 1.01 0.87 -4.61 116.67 122.83 1ub1 s ASP 122 Ca 0.24 -0.86 0.00 0.00 0.71 0.00 0.00 52.55 52.64 1ub1 s ASP 122 Cb -0.02 -0.35 -0.04 0.00 1.01 0.00 0.00 42.92 43.52 1ub1 s ASP 122 CO 0.15 0.09 0.18 -0.69 0.21 0.00 0.00 175.17 175.11 1ub1 s VAL 123 N -1.91 5.21 -0.06 -1.27 1.01 -1.26 0.21 120.40 122.32 1ub1 s VAL 123 Ca 0.24 -0.44 -0.01 0.00 0.00 0.00 0.00 61.98 61.77 1ub1 s VAL 123 Cb -0.07 -3.52 0.03 0.00 0.00 0.00 0.00 36.38 32.81 1ub1 s VAL 123 CO 0.12 0.16 0.01 -0.47 0.00 0.00 0.00 175.10 174.93 1ub1 s TYR 124 N -1.46 0.54 -0.29 5.22 5.04 1.10 -4.30 117.35 123.19 1ub1 s TYR 124 Ca 0.33 -0.08 -0.09 0.00 -2.44 0.00 0.00 57.07 54.79 1ub1 s TYR 124 Cb -0.13 -0.72 -0.01 0.00 0.35 0.00 0.00 41.96 41.45 1ub1 s TYR 124 CO 0.25 -0.29 0.12 -0.51 -1.34 0.00 0.00 175.55 173.78 1ub1 s LEU 125 N 1.96 3.90 0.20 6.97 1.43 0.17 0.39 118.68 133.70 1ub1 s LEU 125 Ca 0.04 -0.47 -0.09 0.00 -1.03 0.00 0.00 54.13 52.58 1ub1 s LEU 125 Cb -0.12 -1.96 -0.07 0.00 0.03 0.00 0.00 46.19 44.07 1ub1 s LEU 125 CO -0.05 -0.15 0.50 -0.63 0.23 0.00 0.00 176.35 176.25 1ub1 s ILE 126 N 1.60 4.99 0.56 -0.59 1.01 -0.46 0.33 121.20 128.65 1ub1 s ILE 126 Ca 0.05 0.39 0.08 0.00 0.00 0.00 0.00 60.65 61.18 1ub1 s ILE 126 Cb -0.17 -3.63 0.07 0.00 0.01 0.00 0.00 42.46 38.75 1ub1 s ILE 126 CO 0.05 -0.01 0.68 0.20 0.00 0.00 0.00 174.94 175.86 1ub1 s ASN 127 N -2.30 4.97 0.00 3.58 -0.87 0.68 -3.93 114.94 117.07 1ub1 s ASN 127 Ca 0.45 -0.96 -0.02 0.00 -1.57 0.00 0.00 52.86 50.76 1ub1 s ASN 127 Cb -0.12 0.32 -0.10 0.00 -0.02 0.00 0.00 41.25 41.34 1ub1 s ASN 127 CO 0.22 -1.27 2.15 -0.81 -2.57 0.00 0.00 177.10 174.82 1ub1 n PRO 128 N -2.10 1.11 0.00 -0.60 -0.04 -1.23 -2.84 135.00 129.30 1ub1 n PRO 128 Ca 0.11 -0.36 0.00 0.00 -0.04 0.00 0.00 63.50 63.21 1ub1 n PRO 128 Cb 0.62 -1.49 0.00 0.00 -0.04 0.00 0.00 33.50 32.60 1ub1 n PRO 128 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1ub1 n GLN 129 N 2.11 0.00 0.00 0.54 6.02 -1.26 -4.57 117.38 120.22 1ub1 n GLN 129 Ca 0.16 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.15 1ub1 n GLN 129 Cb 0.53 -0.15 0.00 0.00 1.02 0.00 0.00 30.24 31.63 1ub1 n GLN 129 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1ub1 n GLY 130 N 0.62 0.64 3.77 1.08 0.00 -1.13 -4.81 105.19 105.36 1ub1 n GLY 130 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 1ub1 n GLY 130 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1ub1 s LYS 131 N 0.00 3.62 -0.08 1.61 2.20 -1.26 -4.69 119.74 121.14 1ub1 s LYS 131 Ca 0.00 1.82 0.04 0.00 -0.36 0.00 0.00 55.97 57.47 1ub1 s LYS 131 Cb 0.00 -2.34 0.00 0.00 -1.51 0.00 0.00 37.83 33.98 1ub1 s LYS 131 CO 0.00 -0.68 -0.21 0.00 -0.36 0.00 0.00 175.35 174.10 1ub1 s ALA 132 N -1.53 1.94 -0.22 3.13 0.00 -1.26 -0.23 121.76 123.59 1ub1 s ALA 132 Ca 0.66 -0.85 -0.14 0.00 0.00 0.00 0.00 51.96 51.63 1ub1 s ALA 132 Cb -0.30 -0.72 -0.04 0.00 0.00 0.00 0.00 23.12 22.06 1ub1 s ALA 132 CO 0.36 0.27 0.31 -0.06 0.00 0.00 0.00 175.76 176.63 1ub1 s PHE 133 N 0.32 3.35 -0.41 0.00 0.08 1.01 -4.79 117.98 117.54 1ub1 s PHE 133 Ca -0.15 0.46 0.23 0.00 0.12 0.00 0.00 56.93 57.59 1ub1 s PHE 133 Cb -0.17 -2.43 0.28 0.00 -0.57 0.00 0.00 43.02 40.14 1ub1 s PHE 133 CO 0.07 0.01 1.51 0.00 -0.10 0.00 0.00 175.22 176.70 1ub1 h ARG 134 N 7.45 0.00 -3.71 0.44 3.08 -1.86 0.50 114.38 120.28 1ub1 h ARG 134 Ca -0.37 0.00 -0.14 0.00 0.07 0.00 0.00 59.98 59.54 1ub1 h ARG 134 Cb 1.16 0.00 -0.20 0.00 0.08 0.00 0.00 29.97 31.02 1ub1 h ARG 134 CO 0.69 0.00 -0.55 0.45 -1.07 0.00 0.00 179.97 179.49 1ub1 s SER 135 N -6.01 0.13 0.52 7.04 0.15 -1.26 -4.57 113.70 109.69 1ub1 s SER 135 Ca 0.06 -0.38 0.26 0.00 0.70 0.00 0.00 55.95 56.58 1ub1 s SER 135 Cb 0.06 0.19 1.42 0.00 -1.71 0.00 0.00 66.02 65.98 1ub1 s SER 135 CO 0.69 -0.40 2.08 0.50 1.20 0.00 0.00 173.24 177.31 1ub1 h LYS 136 N 4.14 0.00 -0.41 5.44 3.64 -1.89 -2.20 116.57 125.30 1ub1 h LYS 136 Ca -0.32 0.00 0.03 0.00 -1.27 0.00 0.00 60.65 59.10 1ub1 h LYS 136 Cb 1.19 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.98 1ub1 h LYS 136 CO 0.44 0.12 0.20 -0.24 -2.27 0.00 0.00 179.45 177.70 1ub1 h VAL 137 N 0.00 0.97 -0.07 2.00 3.04 -1.99 0.83 116.25 121.02 1ub1 h VAL 137 Ca -0.00 -0.14 0.02 0.00 -1.01 0.00 0.00 66.70 65.57 1ub1 h VAL 137 Cb 0.30 0.53 -0.00 0.00 -2.01 0.00 0.00 31.29 30.10 1ub1 h VAL 137 CO 0.02 0.07 0.11 -0.08 -1.01 0.00 0.00 177.57 176.68 1ub1 h GLU 138 N 0.41 0.00 -0.14 4.17 4.57 -1.82 -1.18 114.58 120.59 1ub1 h GLU 138 Ca 0.17 0.00 0.01 0.00 -1.18 0.00 0.00 59.36 58.36 1ub1 h GLU 138 Cb 0.09 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.66 1ub1 h GLU 138 CO -0.13 0.00 0.06 1.25 -1.18 0.00 0.00 179.01 179.02 1ub1 h LEU 139 N 0.00 0.09 -0.37 1.64 5.85 -0.86 -2.25 115.31 119.41 1ub1 h LEU 139 Ca 0.03 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.76 1ub1 h LEU 139 Cb 0.25 -0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.26 1ub1 h LEU 139 CO -0.00 0.07 0.23 -0.29 -0.34 0.00 0.00 178.44 178.12 1ub1 h ILE 140 N 0.14 1.11 -0.84 4.05 2.10 -1.20 0.87 117.51 123.74 1ub1 h ILE 140 Ca 0.06 -0.22 0.20 0.00 1.08 0.00 0.00 64.86 65.98 1ub1 h ILE 140 Cb 0.02 0.59 -0.15 0.00 -1.09 0.00 0.00 36.82 36.19 1ub1 h ILE 140 CO -0.05 0.10 -0.03 0.00 -1.08 0.00 0.00 178.15 177.10 1ub1 h ALA 141 N 1.12 0.85 0.00 0.18 0.00 -1.25 7.33 119.26 127.49 1ub1 h ALA 141 Ca 0.13 0.28 -0.21 0.00 0.00 0.00 0.00 54.91 55.12 1ub1 h ALA 141 Cb -0.03 0.51 -0.03 0.00 0.00 0.00 0.00 17.79 18.23 1ub1 h ALA 141 CO -0.03 -0.45 -1.09 -0.92 0.00 0.00 0.00 179.25 176.76 1ub1 h TYR 142 N 0.06 0.00 0.00 0.00 3.20 -0.85 -3.26 116.97 116.12 1ub1 h TYR 142 Ca 0.46 0.00 -0.03 0.00 3.14 0.00 0.00 58.73 62.30 1ub1 h TYR 142 Cb 0.84 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 39.11 1ub1 h TYR 142 CO -0.49 0.91 -0.28 0.35 -1.64 0.00 0.00 178.16 177.02 1ub1 h PHE 143 N 0.00 0.00 -0.36 -3.82 3.04 0.57 -2.63 116.94 113.74 1ub1 h PHE 143 Ca -0.07 0.00 0.08 0.00 3.98 0.00 0.00 57.97 61.96 1ub1 h PHE 143 Cb 1.76 0.00 -0.08 0.00 2.56 0.00 0.00 35.95 40.18 1ub1 h PHE 143 CO 0.00 0.16 -0.23 1.49 -2.02 0.00 0.00 178.31 177.71 1ub1 h GLU 144 N 0.00 -0.17 0.00 1.11 4.22 1.51 -3.42 114.58 117.83 1ub1 h GLU 144 Ca -0.01 0.01 0.00 0.00 0.08 0.00 0.00 59.36 59.44 1ub1 h GLU 144 Cb 1.13 0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.41 1ub1 h GLU 144 CO 0.02 -0.11 0.00 0.36 -2.18 0.00 0.00 179.01 177.10 1ub1 n LYS 145 N -5.38 0.00 -0.00 1.92 2.85 -1.25 -5.01 118.16 111.29 1ub1 n LYS 145 Ca 0.01 0.00 0.07 0.00 -1.05 0.00 0.00 58.31 57.34 1ub1 n LYS 145 Cb 0.30 0.00 -0.09 0.00 -0.65 0.00 0.00 35.03 34.59 1ub1 n LYS 145 CO 0.00 0.00 0.00 1.55 -0.05 0.00 0.00 177.40 178.90 1ub1 n VAL 146 N 0.00 0.00 -0.79 0.58 3.14 -0.99 -4.99 118.33 115.28 1ub1 n VAL 146 Ca 0.00 -0.18 0.00 0.00 -2.96 0.00 0.00 64.34 61.20 1ub1 n VAL 146 Cb 0.00 0.86 0.00 0.00 -1.06 0.00 0.00 33.84 33.64 1ub1 n VAL 146 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1ub1 n GLY 147 N 1.39 0.73 3.91 7.55 0.00 -1.26 -5.09 105.19 112.43 1ub1 n GLY 147 Ca 0.02 -0.20 -0.21 0.00 0.00 0.00 0.00 46.02 45.62 1ub1 n GLY 147 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ub1 s ASP 148 N -2.03 5.89 -0.29 1.61 2.15 -1.26 -5.10 116.67 117.64 1ub1 s ASP 148 Ca 0.00 -0.13 0.01 0.00 0.43 0.00 0.00 52.55 52.86 1ub1 s ASP 148 Cb 0.00 -1.53 0.19 0.00 -0.30 0.00 0.00 42.92 41.29 1ub1 s ASP 148 CO 0.00 -0.14 0.67 0.28 -0.17 0.00 0.00 175.17 175.82 1ub1 s THR 149 N -2.09 -0.88 0.00 1.71 -1.32 -1.26 -5.03 115.64 106.77 1ub1 s THR 149 Ca 0.36 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.84 1ub1 s THR 149 Cb -0.08 -0.91 0.00 0.00 -1.51 0.00 0.00 72.50 69.99 1ub1 s THR 149 CO 0.28 0.00 0.00 -0.24 -2.21 0.00 0.00 174.62 172.45 1ub1 n SER 150 N 5.39 0.00 -4.80 8.08 2.88 -1.26 -4.87 113.62 119.03 1ub1 n SER 150 Ca 0.03 0.00 -0.36 0.00 -1.33 0.00 0.00 58.87 57.21 1ub1 n SER 150 Cb 0.54 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.93 1ub1 n SER 150 CO 0.00 0.00 0.00 -1.48 -1.23 0.00 0.00 175.04 172.33 1ub1 s LEU 151 N 0.00 4.31 0.41 2.46 2.34 -1.26 -5.07 118.68 121.87 1ub1 s LEU 151 Ca 0.00 0.43 0.04 0.00 0.06 0.00 0.00 54.13 54.66 1ub1 s LEU 151 Cb 0.00 -2.17 -0.05 0.00 -0.56 0.00 0.00 46.19 43.41 1ub1 s LEU 151 CO 0.00 0.27 0.05 -1.81 -1.06 0.00 0.00 176.35 173.80 1ub1 s ASP 152 N -0.32 3.26 0.00 1.48 -0.00 -1.26 -4.96 116.67 114.87 1ub1 s ASP 152 Ca 0.14 -1.50 0.23 0.00 -0.00 0.00 0.00 52.55 51.42 1ub1 s ASP 152 Cb -0.12 0.09 1.27 0.00 -0.00 0.00 0.00 42.92 44.15 1ub1 s ASP 152 CO 0.03 -0.69 1.76 -0.81 -0.00 0.00 0.00 175.17 175.46 1ub1 n PRO 153 N -0.94 0.51 0.00 8.23 -0.04 -1.26 0.11 135.00 141.61 1ub1 n PRO 153 Ca -0.08 0.04 0.11 0.00 -0.04 0.00 0.00 63.50 63.53 1ub1 n PRO 153 Cb 0.66 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.61 1ub1 n PRO 153 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1ub1 n ASN 154 N -1.16 1.91 -1.63 3.54 5.15 -1.26 -4.41 115.26 117.39 1ub1 n ASN 154 Ca 0.14 -1.46 -0.04 0.00 -0.60 0.00 0.00 54.58 52.62 1ub1 n ASN 154 Cb 0.14 0.53 0.00 0.00 -0.53 0.00 0.00 39.78 39.92 1ub1 n ASN 154 CO 0.00 0.00 0.00 -0.67 1.40 0.00 0.00 177.26 177.99 1ub1 n ASP 155 N -0.16 -0.86 -3.43 1.20 2.03 -0.77 -5.13 116.55 109.42 1ub1 n ASP 155 Ca 0.09 -2.07 0.00 0.00 0.52 0.00 0.00 54.79 53.33 1ub1 n ASP 155 Cb 0.45 0.33 0.00 0.00 -0.72 0.00 0.00 41.12 41.18 1ub1 n ASP 155 CO 0.00 0.00 0.00 2.22 -1.92 0.00 0.00 177.20 177.50 1ub1 n PHE 156 N -0.46 -0.52 -3.90 -0.67 -1.74 0.30 -4.44 117.46 106.03 1ub1 n PHE 156 Ca -0.20 0.00 -0.09 0.00 -0.56 0.00 0.00 57.45 56.60 1ub1 n PHE 156 Cb 0.80 0.00 -0.08 0.00 1.52 0.00 0.00 39.48 41.72 1ub1 n PHE 156 CO 0.00 0.00 0.00 -0.51 -0.56 0.00 0.00 176.76 175.69 1ub1 s ASP 157 N -1.46 0.16 0.00 5.98 1.11 -1.26 -5.00 116.67 116.20 1ub1 s ASP 157 Ca 0.00 -0.73 0.00 0.00 0.18 0.00 0.00 52.55 52.00 1ub1 s ASP 157 Cb 0.00 0.33 0.00 0.00 1.07 0.00 0.00 42.92 44.32 1ub1 s ASP 157 CO 0.00 -0.73 0.00 2.22 1.18 0.00 0.00 175.17 177.84 1ub1 n PHE 158 N -0.06 0.00 0.00 4.23 -1.74 -1.26 -4.82 117.46 113.81 1ub1 n PHE 158 Ca -0.14 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.75 1ub1 n PHE 158 Cb 0.62 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.62 1ub1 n PHE 158 CO 0.00 0.00 0.00 0.25 -0.56 0.00 0.00 176.76 176.45 1ub1 n THR 159 N 0.00 0.00 0.24 1.97 -2.24 -1.26 -2.96 114.28 110.03 1ub1 n THR 159 Ca 0.00 0.00 0.14 0.00 -2.27 0.00 0.00 64.05 61.92 1ub1 n THR 159 Cb 0.00 -0.25 0.59 0.00 -2.10 0.00 0.00 70.33 68.56 1ub1 n THR 159 CO 0.00 0.00 0.00 1.62 -0.57 0.00 0.00 175.07 176.12 1ub1 h VAL 160 N 0.00 0.07 -0.06 2.28 3.04 -1.89 2.33 116.25 122.02 1ub1 h VAL 160 Ca 0.00 0.00 -0.00 0.00 -1.01 0.00 0.00 66.70 65.69 1ub1 h VAL 160 Cb 0.00 0.45 -0.00 0.00 -2.01 0.00 0.00 31.29 29.73 1ub1 h VAL 160 CO 0.00 0.00 -0.01 1.07 -1.01 0.00 0.00 177.57 177.62 1ub1 n THR 161 N -2.99 1.99 0.00 3.17 5.66 -1.26 -4.73 114.28 116.11 1ub1 n THR 161 Ca 0.03 -2.19 0.00 0.00 -3.05 0.00 0.00 64.05 58.83 1ub1 n THR 161 Cb 0.67 -0.24 0.00 0.00 -1.55 0.00 0.00 70.33 69.21 1ub1 n THR 161 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1ub1 n GLY 162 N -1.23 5.06 0.04 1.09 0.00 0.78 -4.92 105.19 106.02 1ub1 n GLY 162 Ca 0.17 -0.78 0.13 0.00 0.00 0.00 0.00 46.02 45.54 1ub1 n GLY 162 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1ub1 n ARG 163 N 0.00 0.09 -1.19 1.61 0.00 -1.15 -4.19 116.66 111.83 1ub1 n ARG 163 Ca 0.00 0.12 -0.35 0.00 -0.00 0.00 0.00 57.85 57.62 1ub1 n ARG 163 Cb 0.00 -1.62 -0.03 0.00 0.00 0.00 0.00 32.46 30.81 1ub1 n ARG 163 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1ub1 n GLY 164 N 1.18 4.00 3.59 5.14 0.00 -0.91 -4.89 105.19 113.30 1ub1 n GLY 164 Ca 0.06 -1.36 -0.41 0.00 0.00 0.00 0.00 46.02 44.31 1ub1 n GLY 164 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ub1 s SER 165 N 2.44 6.50 0.28 1.61 1.04 -1.26 -3.55 113.70 120.76 1ub1 s SER 165 Ca 0.63 0.37 0.13 0.00 0.48 0.00 0.00 55.95 57.57 1ub1 s SER 165 Cb 0.16 -2.34 0.31 0.00 0.10 0.00 0.00 66.02 64.25 1ub1 s SER 165 CO -0.05 -0.54 1.56 1.55 0.98 0.00 0.00 173.24 176.73 1ub1 h PRO 166 N 8.28 0.00 -5.29 4.02 0.13 -1.94 -3.46 132.00 133.74 1ub1 h PRO 166 Ca -0.26 0.00 -0.65 0.00 -0.87 0.00 0.00 66.00 64.22 1ub1 h PRO 166 Cb 1.11 0.00 0.07 0.00 0.13 0.00 0.00 31.00 32.31 1ub1 h PRO 166 CO 0.83 0.59 -0.18 -1.13 -0.23 0.00 0.00 178.00 177.88 1ub1 n SER 167 N -3.53 -0.50 -2.64 1.44 3.41 -1.26 -4.92 113.62 105.61 1ub1 n SER 167 Ca -0.00 1.01 0.00 0.00 -0.26 0.00 0.00 58.87 59.62 1ub1 n SER 167 Cb 0.66 -0.82 0.00 0.00 -0.26 0.00 0.00 64.21 63.79 1ub1 n SER 167 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1ub1 n ARG 168 N 1.12 -0.17 -3.91 4.33 1.74 -1.26 -5.10 116.66 113.42 1ub1 n ARG 168 Ca 0.17 0.00 0.04 0.00 -0.77 0.00 0.00 57.85 57.29 1ub1 n ARG 168 Cb 0.14 0.00 0.01 0.00 -1.02 0.00 0.00 32.46 31.59 1ub1 n ARG 168 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 1ub1 s ARG 169 N -2.09 0.13 0.12 5.56 1.81 -1.26 -5.15 118.95 118.08 1ub1 s ARG 169 Ca 0.00 -0.08 0.00 0.00 -1.72 0.00 0.00 55.73 53.93 1ub1 s ARG 169 Cb 0.00 0.04 0.00 0.00 -0.45 0.00 0.00 34.95 34.54 1ub1 s ARG 169 CO 0.00 -0.06 0.00 0.39 -0.68 0.00 0.00 175.30 174.95 1ub1 n GLU 170 N -0.84 -2.34 -4.05 3.54 1.02 -1.26 -5.07 120.64 111.64 1ub1 n GLU 170 Ca 0.02 1.83 -0.14 0.00 -0.02 0.00 0.00 57.16 58.84 1ub1 n GLU 170 Cb 0.60 -1.81 -0.14 0.00 -0.02 0.00 0.00 31.44 30.07 1ub1 n GLU 170 CO 0.00 0.00 0.00 -1.14 1.18 0.00 0.00 177.13 177.17 1ub1 s GLN 171 N -2.53 0.29 -0.34 3.49 2.00 -1.26 -5.12 119.66 116.20 1ub1 s GLN 171 Ca 0.00 -0.19 -0.01 0.00 -2.00 0.00 0.00 55.36 53.16 1ub1 s GLN 171 Cb 0.00 -0.25 0.12 0.00 0.80 0.00 0.00 33.01 33.68 1ub1 s GLN 171 CO 0.00 0.06 0.17 0.50 -0.50 0.00 0.00 175.29 175.52 1ub1 s ARG 172 N -0.25 0.58 0.63 1.67 3.52 -1.26 -5.13 118.95 118.71 1ub1 s ARG 172 Ca -0.00 -1.14 -0.14 0.00 -0.13 0.00 0.00 55.73 54.32 1ub1 s ARG 172 Cb -0.02 -1.55 -0.02 0.00 -1.56 0.00 0.00 34.95 31.80 1ub1 s ARG 172 CO -0.00 -1.10 1.05 -1.25 -0.81 0.00 0.00 175.30 173.19 1ub1 s PRO 173 N 1.38 3.20 1.02 5.12 0.04 -1.26 -5.05 135.00 139.44 1ub1 s PRO 173 Ca 0.14 1.07 -0.16 0.00 0.04 0.00 0.00 61.00 62.10 1ub1 s PRO 173 Cb -0.20 -2.02 0.20 0.00 0.04 0.00 0.00 34.50 32.52 1ub1 s PRO 173 CO -0.16 -0.90 1.19 -1.25 0.04 0.00 0.00 177.00 175.93 1ub1 s PRO 174 N -4.50 0.26 -0.10 0.56 0.04 -1.26 -5.10 135.00 124.91 1ub1 s PRO 174 Ca 0.61 -0.04 -0.30 0.00 0.04 0.00 0.00 61.00 61.30 1ub1 s PRO 174 Cb -0.15 -1.77 0.12 0.00 0.04 0.00 0.00 34.50 32.74 1ub1 s PRO 174 CO 0.44 -2.73 0.97 -1.59 0.04 0.00 0.00 177.00 174.14 1ub1 s LYS 175 N -5.51 0.66 0.00 4.56 0.00 -1.26 -5.12 119.74 113.07 1ub1 s LYS 175 Ca 0.69 -0.07 0.00 0.00 0.00 0.00 0.00 55.97 56.59 1ub1 s LYS 175 Cb -0.10 0.31 0.00 0.00 0.00 0.00 0.00 37.83 38.04 1ub1 s LYS 175 CO 0.54 -0.26 0.00 1.17 0.00 0.00 0.00 175.35 176.80 1ub1 n LYS 176 N 0.23 0.00 -1.05 1.78 3.00 -1.26 -5.17 118.16 115.69 1ub1 n LYS 176 Ca -0.09 0.00 0.13 0.00 -0.00 0.00 0.00 58.31 58.36 1ub1 n LYS 176 Cb 0.60 0.00 -0.05 0.00 0.00 0.00 0.00 35.03 35.57 1ub1 n LYS 176 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1ub1 n ALA 177 N -1.26 -2.74 -0.28 3.14 0.00 -1.26 -5.05 120.51 113.06 1ub1 n ALA 177 Ca 0.00 0.55 0.00 0.00 0.00 0.00 0.00 53.44 53.99 1ub1 n ALA 177 Cb 0.00 -1.07 0.00 0.00 0.00 0.00 0.00 19.45 18.38 1ub1 n ALA 177 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1ub1 n LYS 178 N -3.79 -0.75 -3.84 0.00 4.81 -1.26 -5.07 118.16 108.25 1ub1 n LYS 178 Ca -0.04 0.58 -0.12 0.00 -0.87 0.00 0.00 58.31 57.86 1ub1 n LYS 178 Cb 0.49 -0.69 -0.10 0.00 0.02 0.00 0.00 35.03 34.75 1ub1 n LYS 178 CO 0.00 0.00 0.00 -1.12 1.17 0.00 0.00 177.40 177.45 1ub1 s SER 179 N -2.96 -0.04 -0.06 3.14 0.01 -1.26 -5.08 113.70 107.45 1ub1 s SER 179 Ca 0.00 -0.10 -0.09 0.00 1.31 0.00 0.00 55.95 57.07 1ub1 s SER 179 Cb 0.00 0.24 -0.05 0.00 0.21 0.00 0.00 66.02 66.42 1ub1 s SER 179 CO 0.00 -0.37 0.38 1.55 0.41 0.00 0.00 173.24 175.21 1ub1 h PRO 180 N 4.27 -0.31 0.00 12.44 0.13 -2.07 -3.49 132.00 142.98 1ub1 h PRO 180 Ca -0.30 0.02 0.03 0.00 -0.87 0.00 0.00 66.00 64.88 1ub1 h PRO 180 Cb 1.19 0.07 -0.01 0.00 0.13 0.00 0.00 31.00 32.38 1ub1 h PRO 180 CO 0.40 -0.21 -0.04 0.36 -0.23 0.00 0.00 178.00 178.29 1ub1 n LYS 181 N -4.85 -0.22 0.00 0.86 2.85 -1.26 -5.01 118.16 110.54 1ub1 n LYS 181 Ca -0.04 0.14 0.00 0.00 -1.05 0.00 0.00 58.31 57.36 1ub1 n LYS 181 Cb 0.13 -0.27 0.00 0.00 -0.65 0.00 0.00 35.03 34.24 1ub1 n LYS 181 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 177.40 177.78 1ub1 n SER 182 N -3.82 0.00 -2.52 -5.58 7.64 -1.26 -5.18 113.62 102.91 1ub1 n SER 182 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1ub1 n SER 182 Cb 0.05 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.25 1ub1 n SER 182 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 1ub1 n PRO 183 N -0.49 -0.09 0.00 1.43 -0.04 -1.26 -5.10 135.00 129.45 1ub1 n PRO 183 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1ub1 n PRO 183 Cb 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 1ub1 n PRO 183 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1ub1 n GLY 184 N 3.75 2.11 3.54 0.55 0.00 -1.26 -5.19 105.19 108.69 1ub1 n GLY 184 Ca 0.00 0.36 -0.08 0.00 0.00 0.00 0.00 46.02 46.29 1ub1 n GLY 184 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ub1 s SER 185 N 0.00 -0.38 0.00 1.61 1.04 -1.26 -5.18 113.70 109.53 1ub1 s SER 185 Ca 0.00 -0.09 0.00 0.00 0.48 0.00 0.00 55.95 56.34 1ub1 s SER 185 Cb 0.00 0.47 0.00 0.00 0.10 0.00 0.00 66.02 66.59 1ub1 s SER 185 CO 0.00 -0.78 0.00 0.61 0.98 0.00 0.00 173.24 174.05 1ub1 n GLY 186 N -0.32 1.75 3.76 7.32 0.00 -1.26 -5.19 105.19 111.25 1ub1 n GLY 186 Ca -0.10 -1.03 -0.01 0.00 0.00 0.00 0.00 46.02 44.89 1ub1 n GLY 186 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1ub1 s ARG 187 N -2.00 0.85 -0.29 1.61 1.70 -1.26 -5.15 118.95 114.41 1ub1 s ARG 187 Ca 0.00 -0.50 0.01 0.00 -0.47 0.00 0.00 55.73 54.77 1ub1 s ARG 187 Cb 0.00 0.27 0.19 0.00 -0.57 0.00 0.00 34.95 34.84 1ub1 s ARG 187 CO 0.00 -0.39 0.58 0.20 -1.08 0.00 0.00 175.30 174.60 1ub1 s GLY 188 N -3.15 -1.04 0.00 3.88 0.00 -1.26 -4.99 107.32 100.76 1ub1 s GLY 188 Ca 0.17 1.46 0.07 0.00 0.00 0.00 0.00 44.72 46.42 1ub1 s GLY 188 CO 0.00 3.42 0.37 -2.13 0.00 0.00 0.00 173.10 174.76 1ub1 n ARG 189 N 5.42 4.02 -1.29 2.90 3.00 -1.26 -5.03 116.66 124.42 1ub1 n ARG 189 Ca 0.01 -0.14 -0.29 0.00 -0.00 0.00 0.00 57.85 57.43 1ub1 n ARG 189 Cb 0.52 -0.88 0.19 0.00 0.00 0.00 0.00 32.46 32.29 1ub1 n ARG 189 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.63 177.83 1ub1 s GLY 190 N -1.53 1.59 0.00 5.14 0.00 -1.26 -4.86 107.32 106.40 1ub1 s GLY 190 Ca 0.04 -0.69 0.00 0.00 0.00 0.00 0.00 44.72 44.07 1ub1 s GLY 190 CO 0.27 0.03 0.00 0.54 0.00 0.00 0.00 173.10 173.93 1ub1 n ARG 191 N -4.27 0.00 -2.32 2.90 1.74 -1.26 -5.09 116.66 108.36 1ub1 n ARG 191 Ca 0.09 0.00 -0.41 0.00 -0.77 0.00 0.00 57.85 56.76 1ub1 n ARG 191 Cb 0.59 0.00 -0.03 0.00 -1.02 0.00 0.00 32.46 32.00 1ub1 n ARG 191 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1ub1 s PRO 192 N 0.00 3.17 -0.30 5.56 0.04 -1.26 -4.89 135.00 137.31 1ub1 s PRO 192 Ca 0.00 0.47 -0.16 0.00 0.04 0.00 0.00 61.00 61.34 1ub1 s PRO 192 Cb 0.00 -4.18 0.17 0.00 0.04 0.00 0.00 34.50 30.53 1ub1 s PRO 192 CO 0.00 -2.10 1.07 -1.59 0.04 0.00 0.00 177.00 174.42 1ub1 s LYS 193 N 5.82 0.23 0.00 4.56 0.00 -1.26 -5.15 119.74 123.94 1ub1 s LYS 193 Ca 0.55 0.53 0.00 0.00 0.00 0.00 0.00 55.97 57.05 1ub1 s LYS 193 Cb -0.11 0.25 0.00 0.00 0.00 0.00 0.00 37.83 37.97 1ub1 s LYS 193 CO 0.24 -0.07 0.00 0.41 0.00 0.00 0.00 175.35 175.93 1ub1 n GLY 194 N 4.48 1.70 3.04 0.59 0.00 -1.26 -5.11 105.19 108.63 1ub1 n GLY 194 Ca -0.11 0.42 -0.34 0.00 0.00 0.00 0.00 46.02 45.99 1ub1 n GLY 194 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ub1 s SER 195 N 0.00 4.90 0.00 1.61 1.04 -1.26 -5.32 113.70 114.67 1ub1 s SER 195 Ca 0.00 -2.78 0.00 0.00 0.48 0.00 0.00 55.95 53.65 1ub1 s SER 195 Cb 0.00 -1.76 0.00 0.00 0.10 0.00 0.00 66.02 64.36 1ub1 s SER 195 CO 0.00 -0.34 0.00 0.61 0.98 0.00 0.00 173.24 174.49