#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 2.28 0.12 0.00 0.04 -1.26 -5.08 135.00 131.11 1ub1 s PRO 73 Ca 0.00 0.71 0.09 0.00 0.04 0.00 0.00 61.00 61.84 1ub1 s PRO 73 Cb 0.00 -1.93 -0.04 0.00 0.04 0.00 0.00 34.50 32.57 1ub1 s PRO 73 CO 0.00 -1.50 -0.21 0.00 0.04 0.00 0.00 177.00 175.33 1ub1 s ALA 74 N -3.13 1.92 -0.98 8.56 0.00 -1.26 -5.03 121.76 121.85 1ub1 s ALA 74 Ca 0.60 -1.34 -0.30 0.00 0.00 0.00 0.00 51.96 50.92 1ub1 s ALA 74 Cb -0.14 -0.24 -0.22 0.00 0.00 0.00 0.00 23.12 22.52 1ub1 s ALA 74 CO 0.54 0.34 2.64 0.28 0.00 0.00 0.00 175.76 179.57 1ub1 n VAL 75 N 0.83 0.00 0.01 0.00 0.31 -1.26 -4.75 118.33 113.47 1ub1 n VAL 75 Ca -0.17 -0.00 -0.10 0.00 -0.01 0.00 0.00 64.34 64.05 1ub1 n VAL 75 Cb 0.54 -0.49 -0.08 0.00 -0.91 0.00 0.00 33.84 32.91 1ub1 n VAL 75 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 1ub1 h PRO 76 N 11.74 -0.13 -6.43 5.55 0.13 -2.05 -3.49 132.00 137.33 1ub1 h PRO 76 Ca -0.05 0.01 -0.12 0.00 -0.87 0.00 0.00 66.00 64.97 1ub1 h PRO 76 Cb 1.28 0.03 0.01 0.00 0.13 0.00 0.00 31.00 32.45 1ub1 h PRO 76 CO 1.36 0.37 -1.07 -1.91 -0.23 0.00 0.00 178.00 176.52 1ub1 n GLU 77 N -4.84 -0.77 -3.00 0.86 2.13 -1.26 -4.95 120.64 108.81 1ub1 n GLU 77 Ca -0.07 0.97 -0.14 0.00 0.66 0.00 0.00 57.16 58.57 1ub1 n GLU 77 Cb 0.28 -1.30 0.01 0.00 0.27 0.00 0.00 31.44 30.70 1ub1 n GLU 77 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1ub1 n ALA 78 N 0.84 1.21 -2.79 4.31 0.00 -1.26 -5.00 120.51 117.82 1ub1 n ALA 78 Ca -0.03 -2.73 -0.03 0.00 0.00 0.00 0.00 53.44 50.66 1ub1 n ALA 78 Cb 0.56 -1.00 0.01 0.00 0.00 0.00 0.00 19.45 19.02 1ub1 n ALA 78 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1ub1 s SER 79 N -2.08 -0.99 -0.48 0.00 0.15 -1.26 -5.07 113.70 103.98 1ub1 s SER 79 Ca 0.33 -1.02 0.06 0.00 0.70 0.00 0.00 55.95 56.02 1ub1 s SER 79 Cb 0.34 1.28 0.21 0.00 -1.71 0.00 0.00 66.02 66.14 1ub1 s SER 79 CO -0.06 -0.05 0.69 0.00 1.20 0.00 0.00 173.24 175.02 1ub1 n ALA 80 N 3.09 -0.52 -2.66 5.45 0.00 -1.26 -5.02 120.51 119.60 1ub1 n ALA 80 Ca 0.14 -1.73 -0.04 0.00 0.00 0.00 0.00 53.44 51.81 1ub1 n ALA 80 Cb 0.60 -1.26 0.07 0.00 0.00 0.00 0.00 19.45 18.86 1ub1 n ALA 80 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1ub1 n SER 81 N 2.36 -1.16 -3.39 0.00 7.64 -1.26 -5.05 113.62 112.75 1ub1 n SER 81 Ca 0.17 -1.40 -0.34 0.00 1.01 0.00 0.00 58.87 58.31 1ub1 n SER 81 Cb 0.57 0.60 -0.03 0.00 -1.01 0.00 0.00 64.21 64.34 1ub1 n SER 81 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 1ub1 n PRO 82 N 1.77 2.54 -0.83 1.43 -0.04 -1.26 -4.88 135.00 133.73 1ub1 n PRO 82 Ca 0.03 -1.92 0.11 0.00 -0.04 0.00 0.00 63.50 61.68 1ub1 n PRO 82 Cb 0.70 -2.78 -0.03 0.00 -0.04 0.00 0.00 33.50 31.35 1ub1 n PRO 82 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 1ub1 n LYS 83 N 4.90 -1.66 -2.04 0.54 3.00 -1.26 -4.33 118.16 117.31 1ub1 n LYS 83 Ca 0.56 1.10 -0.42 0.00 -0.00 0.00 0.00 58.31 59.55 1ub1 n LYS 83 Cb 0.25 -2.03 -0.03 0.00 0.00 0.00 0.00 35.03 33.23 1ub1 n LYS 83 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.40 176.75 1ub1 s GLN 84 N -1.50 3.23 0.22 1.64 -1.52 -1.26 -4.86 119.66 115.60 1ub1 s GLN 84 Ca 0.00 1.23 -0.12 0.00 -1.95 0.00 0.00 55.36 54.52 1ub1 s GLN 84 Cb 0.00 -4.22 0.29 0.00 -0.22 0.00 0.00 33.01 28.87 1ub1 s GLN 84 CO 0.00 -1.99 1.38 -2.13 -0.25 0.00 0.00 175.29 172.30 1ub1 n ARG 85 N 8.53 -0.16 -2.34 2.91 0.63 -1.26 -4.82 116.66 120.14 1ub1 n ARG 85 Ca 0.22 1.38 -0.03 0.00 -0.92 0.00 0.00 57.85 58.49 1ub1 n ARG 85 Cb 0.48 -2.05 0.00 0.00 0.45 0.00 0.00 32.46 31.34 1ub1 n ARG 85 CO 0.00 0.00 0.00 -2.13 -2.51 0.00 0.00 177.63 172.99 1ub1 n ARG 86 N -5.37 -0.30 0.00 -0.14 0.63 -1.26 -4.96 116.66 105.26 1ub1 n ARG 86 Ca 0.11 0.56 0.00 0.00 -0.92 0.00 0.00 57.85 57.60 1ub1 n ARG 86 Cb 0.39 -0.73 0.00 0.00 0.45 0.00 0.00 32.46 32.57 1ub1 n ARG 86 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 1ub1 n SER 87 N 1.22 0.00 -0.01 6.15 2.88 -1.26 -5.07 113.62 117.54 1ub1 n SER 87 Ca -0.01 0.00 -0.03 0.00 -1.33 0.00 0.00 58.87 57.51 1ub1 n SER 87 Cb 0.35 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.80 1ub1 n SER 87 CO 0.00 0.00 0.00 -0.38 -1.23 0.00 0.00 175.04 173.43 1ub1 n ILE 88 N 0.00 0.31 -0.70 2.46 5.41 -1.26 -5.06 119.36 120.51 1ub1 n ILE 88 Ca 0.00 0.03 -0.08 0.00 1.00 0.00 0.00 62.75 63.70 1ub1 n ILE 88 Cb 0.00 -1.55 0.07 0.00 -0.71 0.00 0.00 39.64 37.44 1ub1 n ILE 88 CO 0.00 0.00 0.00 2.30 0.00 0.00 0.00 176.55 178.85 1ub1 n ILE 89 N -3.19 0.00 -1.31 1.39 -5.35 -1.26 -5.01 119.36 104.63 1ub1 n ILE 89 Ca -0.05 -0.14 -0.30 0.00 -0.27 0.00 0.00 62.75 61.99 1ub1 n ILE 89 Cb 0.46 -1.13 0.11 0.00 -1.74 0.00 0.00 39.64 37.34 1ub1 n ILE 89 CO 0.00 0.00 0.00 -0.13 -1.76 0.00 0.00 176.55 174.66 1ub1 s ARG 90 N -3.68 1.87 -0.49 6.28 1.81 -1.26 -5.02 118.95 118.46 1ub1 s ARG 90 Ca 0.19 0.92 0.06 0.00 -1.72 0.00 0.00 55.73 55.18 1ub1 s ARG 90 Cb -0.02 -1.87 0.22 0.00 -0.45 0.00 0.00 34.95 32.83 1ub1 s ARG 90 CO 0.15 -1.84 0.51 -0.40 -0.68 0.00 0.00 175.30 173.04 1ub1 n ASP 91 N -3.63 1.13 -2.52 0.23 5.75 -1.26 -5.00 116.55 111.25 1ub1 n ASP 91 Ca 0.08 -2.83 -0.04 0.00 -0.01 0.00 0.00 54.79 51.99 1ub1 n ASP 91 Cb 0.54 -0.64 -0.03 0.00 -1.03 0.00 0.00 41.12 39.96 1ub1 n ASP 91 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1ub1 n ARG 92 N 1.77 -4.84 0.00 0.11 1.74 -1.26 -5.06 116.66 109.11 1ub1 n ARG 92 Ca 0.25 3.59 0.00 0.00 -0.77 0.00 0.00 57.85 60.92 1ub1 n ARG 92 Cb 0.47 -4.96 0.00 0.00 -1.02 0.00 0.00 32.46 26.95 1ub1 n ARG 92 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1ub1 n GLY 93 N 1.78 0.23 0.00 -0.13 0.00 -1.26 -5.10 105.19 100.71 1ub1 n GLY 93 Ca -0.29 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.73 1ub1 n GLY 93 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1ub1 n PRO 94 N -0.30 -0.22 0.00 1.61 -0.04 -1.26 -4.93 135.00 129.86 1ub1 n PRO 94 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1ub1 n PRO 94 Cb 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 1ub1 n PRO 94 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 1ub1 n MET 95 N -1.02 0.00 -0.92 0.54 2.81 -1.26 -4.81 117.12 112.46 1ub1 n MET 95 Ca 0.00 0.00 -0.37 0.00 -1.81 0.00 0.00 57.70 55.52 1ub1 n MET 95 Cb 0.00 0.00 0.07 0.00 -0.71 0.00 0.00 33.22 32.58 1ub1 n MET 95 CO 0.00 0.00 0.00 2.48 1.51 0.00 0.00 175.97 179.96 1ub1 n TYR 96 N -1.44 -2.09 -0.03 2.03 0.18 -1.26 -4.81 117.16 109.73 1ub1 n TYR 96 Ca 0.00 0.40 0.00 0.00 1.88 0.00 0.00 57.90 60.18 1ub1 n TYR 96 Cb 0.00 -1.45 0.00 0.00 -0.38 0.00 0.00 39.34 37.51 1ub1 n TYR 96 CO 0.00 0.00 0.00 -3.47 -2.08 0.00 0.00 176.86 171.31 1ub1 n ASP 97 N 2.16 -1.48 0.00 9.48 2.03 -1.26 -4.90 116.55 122.58 1ub1 n ASP 97 Ca -0.01 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.30 1ub1 n ASP 97 Cb 0.68 0.61 0.00 0.00 -0.72 0.00 0.00 41.12 41.69 1ub1 n ASP 97 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 1ub1 n ASP 98 N -0.34 0.00 0.00 1.67 -0.08 -1.26 -4.97 116.55 111.57 1ub1 n ASP 98 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 1ub1 n ASP 98 Cb 0.00 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.46 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 0.00 0.00 0.00 -0.67 -0.04 -1.26 -4.63 135.00 128.40 1ub1 n PRO 99 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1ub1 n PRO 99 Cb 0.00 -0.62 0.00 0.00 -0.04 0.00 0.00 33.50 32.84 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 -0.50 0.00 -0.33 0.52 5.66 -1.26 -4.17 114.28 114.21 1ub1 n THR 100 Ca 0.00 0.00 0.02 0.00 -3.05 0.00 0.00 64.05 61.02 1ub1 n THR 100 Cb 0.00 0.00 0.08 0.00 -1.55 0.00 0.00 70.33 68.86 1ub1 n THR 100 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 175.07 172.20 1ub1 n LEU 101 N 0.00 -0.45 -4.47 1.09 4.32 -1.25 -1.44 117.00 114.79 1ub1 n LEU 101 Ca 0.00 1.52 -0.37 0.00 -0.02 0.00 0.00 56.01 57.14 1ub1 n LEU 101 Cb 0.00 -0.40 -0.03 0.00 -1.62 0.00 0.00 43.42 41.37 1ub1 n LEU 101 CO 0.00 -1.41 1.83 -0.81 -1.22 0.00 0.00 177.39 175.78 1ub1 n PRO 102 N -5.36 2.40 -2.83 3.23 -0.04 -1.26 -4.58 135.00 126.56 1ub1 n PRO 102 Ca 0.11 -2.81 0.00 0.00 -0.04 0.00 0.00 63.50 60.76 1ub1 n PRO 102 Cb 0.39 -3.55 0.00 0.00 -0.04 0.00 0.00 33.50 30.30 1ub1 n PRO 102 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1ub1 n GLU 103 N 8.13 -0.42 0.00 0.54 4.71 -1.02 -4.71 120.64 127.87 1ub1 n GLU 103 Ca 0.47 0.76 0.00 0.00 -0.01 0.00 0.00 57.16 58.39 1ub1 n GLU 103 Cb 0.45 -0.82 0.00 0.00 -1.01 0.00 0.00 31.44 30.06 1ub1 n GLU 103 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1ub1 n GLY 104 N 1.45 0.04 2.62 0.62 0.00 -0.52 -4.66 105.19 104.73 1ub1 n GLY 104 Ca 0.00 0.48 -0.01 0.00 0.00 0.00 0.00 46.02 46.49 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 -3.83 -3.83 1.61 4.27 -1.25 -4.77 117.44 109.64 1ub1 n TRP 105 Ca 0.00 1.79 -0.07 0.00 -3.89 0.00 0.00 57.50 55.32 1ub1 n TRP 105 Cb 0.00 -3.85 0.02 0.00 -1.36 0.00 0.00 31.31 26.12 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 -1.39 0.00 -0.11 -1.67 -4.23 -1.24 -4.99 115.64 102.01 1ub1 s THR 106 Ca -0.04 -0.90 -0.22 0.00 -1.18 0.00 0.00 61.69 59.35 1ub1 s THR 106 Cb 0.00 -2.91 -0.03 0.00 1.34 0.00 0.00 72.50 70.90 1ub1 s THR 106 CO 0.74 0.00 0.64 0.00 -0.54 0.00 0.00 174.62 175.46 1ub1 s ARG 107 N -2.23 4.36 -0.14 3.99 3.03 -1.25 -1.86 118.95 124.84 1ub1 s ARG 107 Ca 0.17 0.74 -0.02 0.00 2.03 0.00 0.00 55.73 58.65 1ub1 s ARG 107 Cb -0.04 -3.48 -0.02 0.00 -1.03 0.00 0.00 34.95 30.37 1ub1 s ARG 107 CO 0.10 -0.01 -0.08 0.15 -1.13 0.00 0.00 175.30 174.33 1ub1 s LYS 108 N 1.09 3.54 -0.07 3.89 3.01 0.96 -4.80 119.74 127.35 1ub1 s LYS 108 Ca 0.33 -0.60 -0.04 0.00 -1.01 0.00 0.00 55.97 54.66 1ub1 s LYS 108 Cb -0.17 -2.78 -0.04 0.00 -1.01 0.00 0.00 37.83 33.83 1ub1 s LYS 108 CO 0.14 0.23 0.12 -1.17 0.51 0.00 0.00 175.35 175.19 1ub1 s LEU 109 N 0.34 4.19 0.00 3.17 0.20 -1.26 0.47 118.68 125.79 1ub1 s LEU 109 Ca -0.07 0.34 -0.02 0.00 0.69 0.00 0.00 54.13 55.06 1ub1 s LEU 109 Cb -0.15 -2.21 0.01 0.00 -0.43 0.00 0.00 46.19 43.41 1ub1 s LEU 109 CO 0.04 0.34 0.27 0.29 -0.29 0.00 0.00 176.35 177.00 1ub1 n LYS 110 N 1.59 0.39 -3.59 1.98 5.02 0.55 -4.86 118.16 119.23 1ub1 n LYS 110 Ca -0.16 -1.28 -0.38 0.00 -2.02 0.00 0.00 58.31 54.47 1ub1 n LYS 110 Cb 0.54 1.31 -0.06 0.00 -0.02 0.00 0.00 35.03 36.79 1ub1 n LYS 110 CO 0.00 0.00 0.00 -1.14 -0.52 0.00 0.00 177.40 175.74 1ub1 s GLN 111 N -2.31 3.85 0.36 1.97 0.74 -1.26 0.27 119.66 123.29 1ub1 s GLN 111 Ca 0.13 0.25 0.03 0.00 0.05 0.00 0.00 55.36 55.82 1ub1 s GLN 111 Cb -0.01 -3.24 0.03 0.00 1.10 0.00 0.00 33.01 30.89 1ub1 s GLN 111 CO 0.09 0.65 0.25 2.89 -0.55 0.00 0.00 175.29 178.61 1ub1 n ARG 112 N 2.11 0.97 -3.87 1.67 -4.01 -1.26 -4.81 116.66 107.46 1ub1 n ARG 112 Ca -0.15 -2.31 -0.02 0.00 -1.04 0.00 0.00 57.85 54.34 1ub1 n ARG 112 Cb 0.53 0.29 0.01 0.00 -3.04 0.00 0.00 32.46 30.25 1ub1 n ARG 112 CO 0.00 0.00 0.00 0.21 -3.04 0.00 0.00 177.63 174.80 1ub1 s LYS 113 N -3.47 1.02 -1.18 2.89 2.47 -1.26 -4.77 119.74 115.44 1ub1 s LYS 113 Ca 0.19 -0.65 -0.26 0.00 -1.56 0.00 0.00 55.97 53.69 1ub1 s LYS 113 Cb -0.01 0.30 0.04 0.00 -1.46 0.00 0.00 37.83 36.69 1ub1 s LYS 113 CO 0.12 -0.48 0.50 0.43 0.16 0.00 0.00 175.35 176.08 1ub1 n SER 114 N -1.05 -2.81 -2.86 1.43 7.64 -1.26 -4.87 113.62 109.84 1ub1 n SER 114 Ca -0.02 -1.20 -0.17 0.00 1.01 0.00 0.00 58.87 58.49 1ub1 n SER 114 Cb 0.60 -1.45 -0.00 0.00 -1.01 0.00 0.00 64.21 62.34 1ub1 n SER 114 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ub1 n GLY 115 N -2.11 3.37 5.14 0.23 0.00 -1.26 -5.01 105.19 105.55 1ub1 n GLY 115 Ca -0.14 -1.82 0.00 0.00 0.00 0.00 0.00 46.02 44.06 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 -0.02 0.00 -2.77 1.61 5.12 -1.26 -3.07 116.66 116.28 1ub1 n ARG 116 Ca 0.21 0.00 -0.25 0.00 -1.93 0.00 0.00 57.85 55.89 1ub1 n ARG 116 Cb 0.69 0.00 -0.02 0.00 -1.16 0.00 0.00 32.46 31.97 1ub1 n ARG 116 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 1ub1 n SER 117 N 1.54 3.98 -4.43 0.55 2.88 -1.26 -5.09 113.62 111.80 1ub1 n SER 117 Ca 0.00 -3.56 -0.34 0.00 -1.33 0.00 0.00 58.87 53.64 1ub1 n SER 117 Cb 0.00 -0.53 0.10 0.00 -0.75 0.00 0.00 64.21 63.03 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 -0.27 -2.21 0.00 -1.46 0.00 -1.17 -4.71 120.51 110.69 1ub1 n ALA 118 Ca 0.32 -0.45 0.00 0.00 0.00 0.00 0.00 53.44 53.30 1ub1 n ALA 118 Cb 0.55 -1.81 0.00 0.00 0.00 0.00 0.00 19.45 18.20 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 1.61 -0.23 3.77 0.00 0.00 -1.26 -5.02 105.19 104.07 1ub1 n GLY 119 Ca 0.08 0.27 -0.38 0.00 0.00 0.00 0.00 46.02 45.99 1ub1 n GLY 119 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ub1 s LYS 120 N 0.00 4.64 0.12 1.61 0.00 -1.26 -4.94 119.74 119.90 1ub1 s LYS 120 Ca 0.00 1.33 -0.02 0.00 0.00 0.00 0.00 55.97 57.28 1ub1 s LYS 120 Cb 0.00 -2.98 0.03 0.00 0.00 0.00 0.00 37.83 34.88 1ub1 s LYS 120 CO 0.00 0.38 0.06 0.66 0.00 0.00 0.00 175.35 176.45 1ub1 n TYR 121 N 0.92 -1.44 -3.99 1.78 4.01 -1.26 -4.48 117.16 112.70 1ub1 n TYR 121 Ca -0.00 -0.03 -0.09 0.00 -0.16 0.00 0.00 57.90 57.62 1ub1 n TYR 121 Cb 0.49 -0.14 -0.10 0.00 -0.31 0.00 0.00 39.34 39.28 1ub1 n TYR 121 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 1ub1 s ASP 122 N -1.71 0.27 0.09 7.72 2.15 0.76 -4.67 116.67 121.29 1ub1 s ASP 122 Ca 0.05 -0.60 0.04 0.00 0.43 0.00 0.00 52.55 52.47 1ub1 s ASP 122 Cb -0.01 0.15 -0.04 0.00 -0.30 0.00 0.00 42.92 42.72 1ub1 s ASP 122 CO 0.04 -0.41 0.04 -0.69 -0.17 0.00 0.00 175.17 173.97 1ub1 s VAL 123 N -2.23 4.24 -0.08 1.11 1.01 -1.26 0.20 120.40 123.39 1ub1 s VAL 123 Ca -0.09 -0.91 0.01 0.00 0.00 0.00 0.00 61.98 60.99 1ub1 s VAL 123 Cb -0.04 -3.03 0.02 0.00 0.00 0.00 0.00 36.38 33.33 1ub1 s VAL 123 CO -0.04 0.11 -0.08 -0.47 0.00 0.00 0.00 175.10 174.63 1ub1 s TYR 124 N -1.36 1.30 -0.37 5.22 6.14 1.71 -4.52 117.35 125.47 1ub1 s TYR 124 Ca 0.27 -0.55 -0.17 0.00 0.64 0.00 0.00 57.07 57.26 1ub1 s TYR 124 Cb -0.12 -1.07 0.00 0.00 0.42 0.00 0.00 41.96 41.20 1ub1 s TYR 124 CO 0.20 -0.38 0.45 -0.51 0.64 0.00 0.00 175.55 175.95 1ub1 s LEU 125 N 1.29 4.51 -0.24 6.97 1.43 0.10 0.32 118.68 133.05 1ub1 s LEU 125 Ca -0.03 -0.27 -0.14 0.00 -1.03 0.00 0.00 54.13 52.65 1ub1 s LEU 125 Cb -0.14 -2.46 -0.04 0.00 0.03 0.00 0.00 46.19 43.58 1ub1 s LEU 125 CO -0.03 -0.47 0.33 -0.63 0.23 0.00 0.00 176.35 175.78 1ub1 s ILE 126 N 2.22 5.22 1.16 -0.59 1.01 -0.78 0.18 121.20 129.63 1ub1 s ILE 126 Ca 0.15 0.52 -0.19 0.00 0.00 0.00 0.00 60.65 61.13 1ub1 s ILE 126 Cb -0.16 -3.66 0.28 0.00 0.01 0.00 0.00 42.46 38.92 1ub1 s ILE 126 CO 0.13 0.22 1.19 0.20 0.00 0.00 0.00 174.94 176.69 1ub1 s ASN 127 N 1.37 1.30 0.00 3.58 -0.87 0.37 -3.65 114.94 117.03 1ub1 s ASN 127 Ca 0.14 0.39 0.20 0.00 -1.57 0.00 0.00 52.86 52.02 1ub1 s ASN 127 Cb -0.15 -0.47 1.17 0.00 -0.02 0.00 0.00 41.25 41.78 1ub1 s ASN 127 CO 0.08 -3.87 1.60 -0.81 -2.57 0.00 0.00 177.10 171.54 1ub1 n PRO 128 N -4.55 0.75 -0.08 -0.60 -0.04 -1.26 -2.38 135.00 126.85 1ub1 n PRO 128 Ca 0.16 0.00 -0.04 0.00 -0.04 0.00 0.00 63.50 63.57 1ub1 n PRO 128 Cb 0.60 -1.41 -0.16 0.00 -0.04 0.00 0.00 33.50 32.49 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 -0.91 0.71 0.00 0.54 6.02 -1.26 -3.94 117.38 118.55 1ub1 n GLN 129 Ca 0.15 -0.06 0.00 0.00 -0.01 0.00 0.00 57.00 57.08 1ub1 n GLN 129 Cb 0.07 -1.51 0.00 0.00 1.02 0.00 0.00 30.24 29.81 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 1.64 1.04 3.73 1.08 0.00 -1.00 -4.86 105.19 106.83 1ub1 n GLY 130 Ca -0.25 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.37 1ub1 n GLY 130 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ub1 s LYS 131 N -0.09 4.49 -0.05 1.61 0.00 -1.26 -4.78 119.74 119.66 1ub1 s LYS 131 Ca 0.00 1.07 -0.02 0.00 0.00 0.00 0.00 55.97 57.02 1ub1 s LYS 131 Cb 0.00 -3.39 -0.04 0.00 0.00 0.00 0.00 37.83 34.40 1ub1 s LYS 131 CO 0.00 0.19 0.08 0.00 0.00 0.00 0.00 175.35 175.62 1ub1 s ALA 132 N 0.26 3.59 -0.16 0.59 0.00 -1.25 0.14 121.76 124.93 1ub1 s ALA 132 Ca 0.40 -0.80 -0.01 0.00 0.00 0.00 0.00 51.96 51.55 1ub1 s ALA 132 Cb -0.20 -1.65 -0.01 0.00 0.00 0.00 0.00 23.12 21.26 1ub1 s ALA 132 CO 0.22 0.65 -0.12 -0.06 0.00 0.00 0.00 175.76 176.46 1ub1 s PHE 133 N -1.09 2.83 -1.97 0.00 0.08 0.47 -4.84 117.98 113.47 1ub1 s PHE 133 Ca 0.19 -0.89 0.25 0.00 0.12 0.00 0.00 56.93 56.61 1ub1 s PHE 133 Cb -0.12 -1.92 0.57 0.00 -0.57 0.00 0.00 43.02 40.98 1ub1 s PHE 133 CO 0.09 -0.40 1.45 0.54 -0.10 0.00 0.00 175.22 176.80 1ub1 n ARG 134 N 4.03 1.10 -3.93 0.44 1.74 -1.26 -0.72 116.66 118.05 1ub1 n ARG 134 Ca -0.19 -0.74 -0.10 0.00 -0.77 0.00 0.00 57.85 56.05 1ub1 n ARG 134 Cb 0.52 -1.48 -0.12 0.00 -1.02 0.00 0.00 32.46 30.35 1ub1 n ARG 134 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1ub1 s SER 135 N -2.42 0.13 0.38 0.55 0.15 -1.26 -4.89 113.70 106.34 1ub1 s SER 135 Ca 0.25 -0.27 0.16 0.00 0.70 0.00 0.00 55.95 56.79 1ub1 s SER 135 Cb 0.19 0.08 0.75 0.00 -1.71 0.00 0.00 66.02 65.33 1ub1 s SER 135 CO 0.50 -0.19 1.79 0.50 1.20 0.00 0.00 173.24 177.04 1ub1 h LYS 136 N 5.19 0.00 -0.88 5.44 3.64 -1.93 -2.70 116.57 125.33 1ub1 h LYS 136 Ca -0.29 0.00 0.02 0.00 -1.27 0.00 0.00 60.65 59.11 1ub1 h LYS 136 Cb 1.21 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 32.98 1ub1 h LYS 136 CO 0.44 0.38 0.58 -0.24 -2.27 0.00 0.00 179.45 178.34 1ub1 h VAL 137 N 0.00 1.19 0.00 2.00 3.04 -2.00 0.61 116.25 121.09 1ub1 h VAL 137 Ca -0.00 -0.40 -0.01 0.00 -1.01 0.00 0.00 66.70 65.28 1ub1 h VAL 137 Cb 0.76 -0.07 -0.00 0.00 -2.01 0.00 0.00 31.29 29.97 1ub1 h VAL 137 CO 0.05 0.21 -0.04 -0.08 -1.01 0.00 0.00 177.57 176.70 1ub1 h GLU 138 N 1.16 0.00 -0.18 4.17 4.57 -1.90 -1.99 114.58 120.41 1ub1 h GLU 138 Ca 0.33 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.52 1ub1 h GLU 138 Cb -0.08 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.50 1ub1 h GLU 138 CO -0.09 0.04 0.11 1.25 -1.18 0.00 0.00 179.01 179.14 1ub1 h LEU 139 N 0.00 0.21 -0.43 1.64 5.85 -0.91 -2.38 115.31 119.30 1ub1 h LEU 139 Ca -0.00 -0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.68 1ub1 h LEU 139 Cb 0.13 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.09 1ub1 h LEU 139 CO 0.00 0.17 0.24 -0.29 -0.34 0.00 0.00 178.44 178.22 1ub1 h ILE 140 N 0.23 1.15 -0.80 4.05 2.10 -1.36 2.11 117.51 124.99 1ub1 h ILE 140 Ca 0.06 -0.40 0.17 0.00 1.08 0.00 0.00 64.86 65.78 1ub1 h ILE 140 Cb -0.00 0.64 -0.15 0.00 -1.09 0.00 0.00 36.82 36.22 1ub1 h ILE 140 CO -0.01 0.16 -0.13 0.00 -1.08 0.00 0.00 178.15 177.09 1ub1 h ALA 141 N 1.09 0.64 0.00 0.18 0.00 -1.24 8.28 119.26 128.21 1ub1 h ALA 141 Ca 0.15 0.30 -0.23 0.00 0.00 0.00 0.00 54.91 55.12 1ub1 h ALA 141 Cb 0.05 0.56 -0.04 0.00 0.00 0.00 0.00 17.79 18.36 1ub1 h ALA 141 CO -0.02 -0.42 -1.40 1.88 0.00 0.00 0.00 179.25 179.29 1ub1 h TYR 142 N 0.03 0.00 0.00 0.00 -1.99 -0.97 -3.31 116.97 110.72 1ub1 h TYR 142 Ca 0.41 0.00 -0.00 0.00 2.00 0.00 0.00 58.73 61.13 1ub1 h TYR 142 Cb 0.67 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.40 1ub1 h TYR 142 CO -0.57 0.87 -0.07 0.35 -0.00 0.00 0.00 178.16 178.75 1ub1 h PHE 143 N 0.00 0.00 -0.55 4.88 3.57 0.62 -2.35 116.94 123.11 1ub1 h PHE 143 Ca -0.18 0.00 0.11 0.00 3.53 0.00 0.00 57.97 61.43 1ub1 h PHE 143 Cb 1.82 0.00 -0.11 0.00 2.79 0.00 0.00 35.95 40.45 1ub1 h PHE 143 CO 0.00 0.02 -0.16 1.49 -2.23 0.00 0.00 178.31 177.43 1ub1 h GLU 144 N 0.00 -0.02 0.00 1.11 4.22 1.75 -3.42 114.58 118.22 1ub1 h GLU 144 Ca -0.00 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.44 1ub1 h GLU 144 Cb 1.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.27 1ub1 h GLU 144 CO 0.00 -0.01 0.00 0.36 -2.18 0.00 0.00 179.01 177.18 1ub1 n LYS 145 N -5.40 0.00 0.01 1.92 2.85 -1.25 -5.00 118.16 111.30 1ub1 n LYS 145 Ca 0.06 0.00 0.12 0.00 -1.05 0.00 0.00 58.31 57.44 1ub1 n LYS 145 Cb 0.30 0.00 0.31 0.00 -0.65 0.00 0.00 35.03 34.98 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 0.08 0.00 0.58 3.14 -0.88 -4.90 118.33 116.35 1ub1 n VAL 146 Ca 0.00 -0.06 0.00 0.00 -2.96 0.00 0.00 64.34 61.32 1ub1 n VAL 146 Cb 0.00 0.03 0.00 0.00 -1.06 0.00 0.00 33.84 32.81 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 1.47 3.68 1.26 7.55 0.00 -1.26 -5.08 105.19 112.80 1ub1 n GLY 147 Ca 0.05 -0.54 0.15 0.00 0.00 0.00 0.00 46.02 45.68 1ub1 n GLY 147 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1ub1 n ASP 148 N 0.00 -6.77 0.00 1.61 2.03 -1.26 -5.03 116.55 107.13 1ub1 n ASP 148 Ca 0.00 0.87 0.00 0.00 0.52 0.00 0.00 54.79 56.18 1ub1 n ASP 148 Cb 0.00 -4.08 0.00 0.00 -0.72 0.00 0.00 41.12 36.32 1ub1 n ASP 148 CO 0.00 0.00 0.00 0.41 -1.92 0.00 0.00 177.20 175.69 1ub1 n THR 149 N -3.86 0.00 -2.28 5.18 -1.04 -1.26 -5.02 114.28 106.00 1ub1 n THR 149 Ca -0.04 0.00 -0.05 0.00 -2.04 0.00 0.00 64.05 61.92 1ub1 n THR 149 Cb 0.63 0.00 0.01 0.00 -1.82 0.00 0.00 70.33 69.16 1ub1 n THR 149 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 1ub1 n SER 150 N -2.18 -1.20 -3.65 8.00 2.88 -1.26 -5.09 113.62 111.13 1ub1 n SER 150 Ca 0.00 -2.09 -0.25 0.00 -1.33 0.00 0.00 58.87 55.20 1ub1 n SER 150 Cb 0.00 0.46 -0.17 0.00 -0.75 0.00 0.00 64.21 63.75 1ub1 n SER 150 CO 0.00 0.00 0.00 -0.22 -1.23 0.00 0.00 175.04 173.59 1ub1 s LEU 151 N -1.75 0.45 0.34 2.46 2.96 -1.26 -5.04 118.68 116.84 1ub1 s LEU 151 Ca 0.04 -0.48 0.05 0.00 -0.22 0.00 0.00 54.13 53.52 1ub1 s LEU 151 Cb 0.19 -0.29 -0.07 0.00 0.50 0.00 0.00 46.19 46.52 1ub1 s LEU 151 CO -0.06 -0.31 0.02 -1.81 -1.32 0.00 0.00 176.35 172.87 1ub1 s ASP 152 N 2.09 2.89 0.00 3.68 -0.00 -1.26 -4.89 116.67 119.19 1ub1 s ASP 152 Ca 0.02 -1.33 0.23 0.00 -0.00 0.00 0.00 52.55 51.47 1ub1 s ASP 152 Cb -0.15 -0.19 1.13 0.00 -0.00 0.00 0.00 42.92 43.70 1ub1 s ASP 152 CO -0.07 -0.50 1.74 -0.81 -0.00 0.00 0.00 175.17 175.52 1ub1 n PRO 153 N -0.74 0.30 -0.00 8.23 -0.04 -1.26 0.97 135.00 142.45 1ub1 n PRO 153 Ca -0.04 0.08 0.10 0.00 -0.04 0.00 0.00 63.50 63.60 1ub1 n PRO 153 Cb 0.66 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.49 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 -1.30 0.72 -0.30 3.54 2.85 -1.26 -4.28 115.26 115.22 1ub1 n ASN 154 Ca 0.10 -0.66 0.03 0.00 -0.11 0.00 0.00 54.58 53.94 1ub1 n ASN 154 Cb 0.19 1.31 0.04 0.00 1.24 0.00 0.00 39.78 42.56 1ub1 n ASN 154 CO 0.00 0.00 0.00 -0.67 -2.11 0.00 0.00 177.26 174.48 1ub1 n ASP 155 N -1.72 0.80 -3.10 1.20 4.64 -0.86 -5.09 116.55 112.42 1ub1 n ASP 155 Ca 0.01 -2.23 -0.07 0.00 -1.38 0.00 0.00 54.79 51.12 1ub1 n ASP 155 Cb 0.39 -0.24 0.07 0.00 -1.04 0.00 0.00 41.12 40.30 1ub1 n ASP 155 CO 0.00 0.00 0.00 2.22 -0.82 0.00 0.00 177.20 178.60 1ub1 n PHE 156 N -0.45 -2.04 -0.23 -0.67 1.16 0.27 -4.61 117.46 110.89 1ub1 n PHE 156 Ca 0.05 -0.14 0.00 0.00 -1.87 0.00 0.00 57.45 55.49 1ub1 n PHE 156 Cb 0.64 -0.37 0.00 0.00 -1.61 0.00 0.00 39.48 38.14 1ub1 n PHE 156 CO 0.00 0.00 0.00 -0.25 -1.87 0.00 0.00 176.76 174.64 1ub1 n ASP 157 N -2.78 0.81 -4.05 5.98 8.00 -1.26 -5.01 116.55 118.23 1ub1 n ASP 157 Ca 0.03 -1.03 -0.44 0.00 0.71 0.00 0.00 54.79 54.06 1ub1 n ASP 157 Cb 0.14 0.00 -0.13 0.00 -0.02 0.00 0.00 41.12 41.11 1ub1 n ASP 157 CO 0.00 0.00 0.00 2.22 -0.39 0.00 0.00 177.20 179.03 1ub1 n PHE 158 N -0.02 0.72 0.00 1.24 -1.74 -1.26 -4.78 117.46 111.62 1ub1 n PHE 158 Ca 0.00 0.48 0.00 0.00 -0.56 0.00 0.00 57.45 57.37 1ub1 n PHE 158 Cb 0.07 -2.15 0.00 0.00 1.52 0.00 0.00 39.48 38.91 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 6.55 0.00 -0.34 1.97 -2.24 -1.26 -3.61 114.28 115.35 1ub1 n THR 159 Ca 0.57 0.00 0.18 0.00 -2.27 0.00 0.00 64.05 62.53 1ub1 n THR 159 Cb 0.00 -0.13 0.41 0.00 -2.10 0.00 0.00 70.33 68.52 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 0.58 0.00 2.28 3.04 -1.91 0.96 116.25 121.21 1ub1 h VAL 160 Ca 0.00 -0.19 -0.12 0.00 -1.01 0.00 0.00 66.70 65.38 1ub1 h VAL 160 Cb 0.00 -0.03 -0.02 0.00 -2.01 0.00 0.00 31.29 29.23 1ub1 h VAL 160 CO 0.00 0.10 -1.40 1.07 -1.01 0.00 0.00 177.57 176.33 1ub1 n THR 161 N -4.76 0.95 -0.09 3.17 5.66 -1.26 -3.27 114.28 114.69 1ub1 n THR 161 Ca 0.25 -0.65 -0.14 0.00 -3.05 0.00 0.00 64.05 60.47 1ub1 n THR 161 Cb 0.74 -0.56 -0.04 0.00 -1.55 0.00 0.00 70.33 68.92 1ub1 n THR 161 CO 0.00 0.00 0.00 1.23 -3.05 0.00 0.00 175.07 173.25 1ub1 h GLY 162 N 3.83 0.81 2.00 1.09 0.00 -0.38 -3.02 103.07 107.40 1ub1 h GLY 162 Ca -0.13 -0.88 -0.07 0.00 0.00 0.00 0.00 47.33 46.25 1ub1 h GLY 162 CO 0.03 0.79 -0.34 -0.09 0.00 0.00 0.00 176.54 176.93 1ub1 h ARG 163 N 0.49 0.00 0.00 4.80 9.65 0.56 -3.47 114.38 126.41 1ub1 h ARG 163 Ca 0.03 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.91 1ub1 h ARG 163 Cb 0.95 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.53 1ub1 h ARG 163 CO 0.09 0.34 0.00 0.41 2.80 0.00 0.00 179.97 183.61 1ub1 n GLY 164 N 0.75 2.41 3.26 2.80 0.00 -1.14 -4.72 105.19 108.55 1ub1 n GLY 164 Ca 0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.68 1ub1 n GLY 164 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ub1 s SER 165 N -3.49 4.56 0.00 1.61 0.01 -1.26 -4.83 113.70 110.30 1ub1 s SER 165 Ca 0.00 -0.74 0.00 0.00 1.31 0.00 0.00 55.95 56.52 1ub1 s SER 165 Cb 0.00 -1.74 0.00 0.00 0.21 0.00 0.00 66.02 64.49 1ub1 s SER 165 CO 0.00 -0.13 0.00 -0.81 0.41 0.00 0.00 173.24 172.71 1ub1 n PRO 166 N 4.75 1.33 0.00 12.44 -0.04 -1.26 -5.01 135.00 147.21 1ub1 n PRO 166 Ca -0.16 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.30 1ub1 n PRO 166 Cb 0.48 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.94 1ub1 n PRO 166 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1ub1 n SER 167 N 0.00 0.00 -2.01 3.54 7.64 -1.26 -4.99 113.62 116.53 1ub1 n SER 167 Ca 0.00 0.00 -0.16 0.00 1.01 0.00 0.00 58.87 59.72 1ub1 n SER 167 Cb 0.00 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.17 1ub1 n SER 167 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 1ub1 n ARG 168 N 0.00 -1.73 -4.55 1.43 0.63 -1.26 -4.93 116.66 106.25 1ub1 n ARG 168 Ca 0.00 0.84 -0.28 0.00 -0.92 0.00 0.00 57.85 57.49 1ub1 n ARG 168 Cb 0.00 -5.32 -0.10 0.00 0.45 0.00 0.00 32.46 27.49 1ub1 n ARG 168 CO 0.00 0.00 0.00 0.50 -2.51 0.00 0.00 177.63 175.62 1ub1 s ARG 169 N -4.31 2.01 -0.02 -0.14 3.52 -1.26 -5.15 118.95 113.60 1ub1 s ARG 169 Ca 0.00 -2.08 0.04 0.00 -0.13 0.00 0.00 55.73 53.56 1ub1 s ARG 169 Cb 0.00 -1.69 -0.00 0.00 -1.56 0.00 0.00 34.95 31.70 1ub1 s ARG 169 CO 0.00 -0.08 -0.13 -2.00 -0.81 0.00 0.00 175.30 172.28 1ub1 s GLU 170 N -3.75 1.24 0.00 5.12 2.56 -1.26 -5.08 118.70 117.53 1ub1 s GLU 170 Ca 0.35 -0.46 0.00 0.00 0.00 0.00 0.00 54.97 54.86 1ub1 s GLU 170 Cb 0.09 -1.14 0.00 0.00 2.00 0.00 0.00 34.13 35.07 1ub1 s GLU 170 CO 0.18 0.22 0.00 0.94 -0.56 0.00 0.00 175.26 176.04 1ub1 n GLN 171 N 3.03 0.00 -2.26 4.30 7.27 -1.26 -5.09 117.38 123.37 1ub1 n GLN 171 Ca -0.17 0.00 -0.01 0.00 0.07 0.00 0.00 57.00 56.90 1ub1 n GLN 171 Cb 0.54 -0.15 -0.01 0.00 2.41 0.00 0.00 30.24 33.04 1ub1 n GLN 171 CO 0.00 0.00 0.00 -2.13 0.07 0.00 0.00 177.06 175.00 1ub1 n ARG 172 N -1.25 -2.36 -1.71 3.69 3.00 -1.26 -5.01 116.66 111.76 1ub1 n ARG 172 Ca 0.00 2.04 -0.31 0.00 -0.00 0.00 0.00 57.85 59.58 1ub1 n ARG 172 Cb 0.00 -3.77 0.04 0.00 0.00 0.00 0.00 32.46 28.73 1ub1 n ARG 172 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.63 176.38 1ub1 s PRO 173 N -1.00 3.07 0.00 -0.14 0.04 -1.26 -5.07 135.00 130.65 1ub1 s PRO 173 Ca -0.03 1.01 0.00 0.00 0.04 0.00 0.00 61.00 62.02 1ub1 s PRO 173 Cb 0.00 -2.01 0.00 0.00 0.04 0.00 0.00 34.50 32.54 1ub1 s PRO 173 CO 0.50 -1.00 0.00 -0.35 0.04 0.00 0.00 177.00 176.20 1ub1 n PRO 174 N -2.81 0.24 -0.68 0.56 -0.04 -1.26 -5.11 135.00 125.91 1ub1 n PRO 174 Ca 0.08 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.54 1ub1 n PRO 174 Cb 0.53 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.99 1ub1 n PRO 174 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 1ub1 n LYS 175 N -0.63 2.57 -4.03 0.54 2.85 -1.26 -5.16 118.16 113.04 1ub1 n LYS 175 Ca 0.00 0.00 -0.10 0.00 -1.05 0.00 0.00 58.31 57.16 1ub1 n LYS 175 Cb 0.00 0.00 -0.08 0.00 -0.65 0.00 0.00 35.03 34.30 1ub1 n LYS 175 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 177.40 177.56 1ub1 s LYS 176 N 0.19 1.16 0.08 -1.58 2.36 -1.26 -5.18 119.74 115.51 1ub1 s LYS 176 Ca 0.00 -1.28 -0.02 0.00 -2.55 0.00 0.00 55.97 52.12 1ub1 s LYS 176 Cb 0.00 0.35 0.01 0.00 -1.05 0.00 0.00 37.83 37.14 1ub1 s LYS 176 CO 0.00 -0.41 0.13 0.00 1.55 0.00 0.00 175.35 176.62 1ub1 n ALA 177 N -0.22 -0.21 -3.64 3.13 0.00 -1.26 -5.18 120.51 113.14 1ub1 n ALA 177 Ca -0.05 -0.29 -0.09 0.00 0.00 0.00 0.00 53.44 53.01 1ub1 n ALA 177 Cb 0.63 0.23 -0.07 0.00 0.00 0.00 0.00 19.45 20.25 1ub1 n ALA 177 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1ub1 s LYS 178 N -2.09 0.71 -0.21 0.00 2.20 -1.26 -5.15 119.74 113.94 1ub1 s LYS 178 Ca 0.05 1.09 -0.06 0.00 -0.36 0.00 0.00 55.97 56.68 1ub1 s LYS 178 Cb -0.01 0.22 -0.03 0.00 -1.51 0.00 0.00 37.83 36.51 1ub1 s LYS 178 CO 0.03 -0.13 0.02 0.45 -0.36 0.00 0.00 175.35 175.37 1ub1 s SER 179 N 1.18 4.95 0.52 1.43 0.15 -1.26 -5.09 113.70 115.58 1ub1 s SER 179 Ca -0.06 -0.18 -0.19 0.00 0.70 0.00 0.00 55.95 56.22 1ub1 s SER 179 Cb -0.05 -1.86 -0.07 0.00 -1.71 0.00 0.00 66.02 62.34 1ub1 s SER 179 CO -0.13 0.05 1.04 -2.16 1.20 0.00 0.00 173.24 173.24 1ub1 s PRO 180 N 1.09 3.65 -0.30 5.44 0.04 -1.26 -5.05 135.00 138.61 1ub1 s PRO 180 Ca 0.03 1.29 -0.19 0.00 0.04 0.00 0.00 61.00 62.17 1ub1 s PRO 180 Cb -0.14 -2.08 0.18 0.00 0.04 0.00 0.00 34.50 32.50 1ub1 s PRO 180 CO 0.02 -0.55 1.22 0.21 0.04 0.00 0.00 177.00 177.95 1ub1 s LYS 181 N -3.55 0.16 -0.10 4.56 2.47 -1.26 -5.18 119.74 116.85 1ub1 s LYS 181 Ca 0.66 0.25 -0.14 0.00 -1.56 0.00 0.00 55.97 55.17 1ub1 s LYS 181 Cb -0.16 0.05 0.03 0.00 -1.46 0.00 0.00 37.83 36.29 1ub1 s LYS 181 CO 0.26 -0.03 0.35 -1.12 0.16 0.00 0.00 175.35 174.97 1ub1 s SER 182 N 0.78 -0.32 0.72 1.43 0.01 -1.26 -5.17 113.70 109.89 1ub1 s SER 182 Ca -0.04 0.53 0.00 0.00 1.31 0.00 0.00 55.95 57.75 1ub1 s SER 182 Cb -0.03 0.60 0.00 0.00 0.21 0.00 0.00 66.02 66.80 1ub1 s SER 182 CO -0.12 -0.24 0.00 -0.81 0.41 0.00 0.00 173.24 172.48 1ub1 n PRO 183 N 2.32 -0.08 -3.42 12.44 -0.04 -1.26 -5.11 135.00 139.85 1ub1 n PRO 183 Ca -0.16 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.18 1ub1 n PRO 183 Cb 0.57 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 34.00 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 3.76 2.56 3.81 0.55 0.00 -1.26 -5.19 105.19 109.42 1ub1 n GLY 184 Ca 0.00 -1.62 -0.05 0.00 0.00 0.00 0.00 46.02 44.35 1ub1 n GLY 184 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ub1 s SER 185 N -2.63 -0.16 -0.29 1.61 0.01 -1.26 -5.09 113.70 105.89 1ub1 s SER 185 Ca 0.23 -0.58 0.03 0.00 1.31 0.00 0.00 55.95 56.94 1ub1 s SER 185 Cb -0.00 0.60 0.12 0.00 0.21 0.00 0.00 66.02 66.95 1ub1 s SER 185 CO 0.17 -1.13 1.06 0.61 0.41 0.00 0.00 173.24 174.36 1ub1 n GLY 186 N -0.50 -0.31 3.51 3.44 0.00 -1.26 -5.16 105.19 104.92 1ub1 n GLY 186 Ca -0.05 -0.04 -0.08 0.00 0.00 0.00 0.00 46.02 45.85 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 0.06 0.79 0.00 1.61 1.70 -1.26 -5.08 118.95 116.77 1ub1 s ARG 187 Ca 0.06 -0.28 0.00 0.00 -0.47 0.00 0.00 55.73 55.04 1ub1 s ARG 187 Cb 0.12 0.36 0.00 0.00 -0.57 0.00 0.00 34.95 34.87 1ub1 s ARG 187 CO -0.03 -0.34 0.00 0.41 -1.08 0.00 0.00 175.30 174.26 1ub1 n GLY 188 N -0.22 -2.21 0.00 3.88 0.00 -1.26 -4.97 105.19 100.41 1ub1 n GLY 188 Ca -0.08 0.70 0.04 0.00 0.00 0.00 0.00 46.02 46.67 1ub1 n GLY 188 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1ub1 n ARG 189 N -0.75 2.19 0.00 1.61 0.00 -1.26 -5.09 116.66 113.36 1ub1 n ARG 189 Ca 0.00 -0.04 0.00 0.00 -0.00 0.00 0.00 57.85 57.81 1ub1 n ARG 189 Cb 0.00 -1.03 0.00 0.00 -0.00 0.00 0.00 32.46 31.43 1ub1 n ARG 189 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1ub1 n GLY 190 N 1.66 2.15 2.67 2.89 0.00 -1.26 -4.76 105.19 108.55 1ub1 n GLY 190 Ca -0.00 -0.48 0.01 0.00 0.00 0.00 0.00 46.02 45.54 1ub1 n GLY 190 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1ub1 s ARG 191 N 0.00 0.05 0.00 1.61 6.06 -1.26 -5.09 118.95 120.31 1ub1 s ARG 191 Ca 0.00 -0.02 0.00 0.00 -2.50 0.00 0.00 55.73 53.21 1ub1 s ARG 191 Cb 0.00 0.00 0.00 0.00 0.06 0.00 0.00 34.95 35.01 1ub1 s ARG 191 CO 0.00 -0.07 0.20 -0.35 -2.50 0.00 0.00 175.30 172.59 1ub1 n PRO 192 N 3.29 0.00 -3.82 5.12 -0.04 -1.26 -5.06 135.00 133.23 1ub1 n PRO 192 Ca 0.06 0.31 -0.05 0.00 -0.04 0.00 0.00 63.50 63.78 1ub1 n PRO 192 Cb 0.65 -0.93 0.00 0.00 -0.04 0.00 0.00 33.50 33.18 1ub1 n PRO 192 CO 0.00 0.00 0.00 -1.59 -0.04 0.00 0.00 175.50 173.87 1ub1 s LYS 193 N -1.02 1.56 -0.59 0.54 -2.85 -1.26 -5.06 119.74 111.06 1ub1 s LYS 193 Ca 0.00 -0.93 0.02 0.00 -1.00 0.00 0.00 55.97 54.06 1ub1 s LYS 193 Cb 0.00 0.48 0.40 0.00 -2.06 0.00 0.00 37.83 36.65 1ub1 s LYS 193 CO 0.00 -0.72 1.49 0.41 0.10 0.00 0.00 175.35 176.62 1ub1 n GLY 194 N -0.54 5.85 0.88 0.59 0.00 -1.26 -4.89 105.19 105.82 1ub1 n GLY 194 Ca -0.05 -2.64 0.00 0.00 0.00 0.00 0.00 46.02 43.32 1ub1 n GLY 194 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1ub1 n SER 195 N -0.53 -1.17 0.00 1.61 2.88 -1.26 -5.36 113.62 109.79 1ub1 n SER 195 Ca 0.46 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 58.00 1ub1 n SER 195 Cb 0.52 -0.59 0.00 0.00 -0.75 0.00 0.00 64.21 63.39 1ub1 n SER 195 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42