#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ddm n GLN 68 N 0.00 0.00 0.23 1.57 7.27 -1.26 -4.91 117.38 120.28 1ddm n GLN 68 Ca 0.00 0.00 0.11 0.00 0.07 0.00 0.00 57.00 57.18 1ddm n GLN 68 Cb 0.00 0.00 0.45 0.00 2.41 0.00 0.00 30.24 33.10 1ddm n GLN 68 CO 0.00 0.00 0.00 2.35 0.07 0.00 0.00 177.06 179.48 1ddm h TRP 69 N 0.00 0.00 0.00 3.69 7.01 -2.04 -2.36 115.95 122.25 1ddm h TRP 69 Ca 0.00 0.00 -0.03 0.00 2.11 0.00 0.00 58.89 60.97 1ddm h TRP 69 Cb 0.00 0.00 -0.00 0.00 -2.10 0.00 0.00 29.16 27.06 1ddm h TRP 69 CO 0.00 0.17 -0.15 1.96 -2.79 0.00 0.00 178.44 177.63 1ddm h GLN 70 N 0.00 0.00 0.00 2.65 4.20 -1.99 0.12 115.11 120.09 1ddm h GLN 70 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1ddm h GLN 70 Cb 0.76 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.54 1ddm h GLN 70 CO 0.02 0.15 -1.46 0.00 -0.67 0.00 0.00 178.83 176.87 1ddm n ALA 71 N -2.22 2.89 0.05 3.87 0.00 -0.95 -3.36 120.51 120.80 1ddm n ALA 71 Ca -0.01 -0.41 -0.03 0.00 0.00 0.00 0.00 53.44 53.00 1ddm n ALA 71 Cb 0.32 -0.91 -0.07 0.00 0.00 0.00 0.00 19.45 18.79 1ddm n ALA 71 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1ddm h ASP 72 N 0.00 0.00 1.03 0.00 5.19 -0.91 -2.62 116.42 119.12 1ddm h ASP 72 Ca 0.00 0.00 -0.10 0.00 -0.62 0.00 0.00 57.03 56.31 1ddm h ASP 72 Cb 0.93 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 40.43 1ddm h ASP 72 CO 0.00 0.73 -1.02 -0.08 -3.12 0.00 0.00 179.24 175.75 1ddm h GLU 73 N 0.00 0.00 0.00 3.56 4.81 -1.15 -3.30 114.58 118.50 1ddm h GLU 73 Ca -0.11 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.12 1ddm h GLU 73 Cb 1.66 0.00 0.00 0.00 0.63 0.00 0.00 28.75 31.04 1ddm h GLU 73 CO 0.07 0.24 -0.79 0.39 -0.73 0.00 0.00 179.01 178.19 1ddm n GLU 74 N -2.92 0.31 0.01 1.92 1.02 -1.21 -4.14 120.64 115.63 1ddm n GLU 74 Ca -0.04 0.06 -0.12 0.00 -0.02 0.00 0.00 57.16 57.04 1ddm n GLU 74 Cb 0.72 -1.66 -0.06 0.00 -0.02 0.00 0.00 31.44 30.42 1ddm n GLU 74 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1ddm h ALA 75 N 2.49 0.07 -0.88 0.62 0.00 -1.54 -2.13 119.26 117.88 1ddm h ALA 75 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1ddm h ALA 75 Cb 0.76 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.48 1ddm h ALA 75 CO 0.00 -0.41 0.55 0.28 0.00 0.00 0.00 179.25 179.67 1ddm h VAL 76 N 0.03 1.24 -0.63 0.00 2.07 -1.74 -1.39 116.25 115.82 1ddm h VAL 76 Ca 0.02 -0.48 0.10 0.00 0.82 0.00 0.00 66.70 67.16 1ddm h VAL 76 Cb 0.04 -0.02 -0.04 0.00 -1.52 0.00 0.00 31.29 29.75 1ddm h VAL 76 CO -0.00 0.24 0.42 0.03 0.02 0.00 0.00 177.57 178.28 1ddm h ARG 77 N 1.20 0.42 0.00 1.57 3.08 -1.63 -3.00 114.38 116.02 1ddm h ARG 77 Ca 0.32 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.34 1ddm h ARG 77 Cb -0.09 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 29.87 1ddm h ARG 77 CO -0.06 0.28 0.00 0.43 -1.07 0.00 0.00 179.97 179.54 1ddm n SER 78 N -4.47 0.00 -0.92 7.04 7.64 -0.58 -4.91 113.62 117.42 1ddm n SER 78 Ca 0.11 0.00 -0.00 0.00 1.01 0.00 0.00 58.87 59.98 1ddm n SER 78 Cb 0.39 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.59 1ddm n SER 78 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ddm n ALA 79 N -3.00 -1.36 -3.09 -0.43 0.00 -0.89 -4.71 120.51 107.03 1ddm n ALA 79 Ca 0.00 -0.05 0.05 0.00 0.00 0.00 0.00 53.44 53.43 1ddm n ALA 79 Cb 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 19.45 19.10 1ddm n ALA 79 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 1ddm s THR 80 N 0.00 -0.38 -0.49 0.00 -1.32 -1.07 -4.29 115.64 108.09 1ddm s THR 80 Ca 0.00 0.00 0.08 0.00 -1.21 0.00 0.00 61.69 60.56 1ddm s THR 80 Cb 0.01 -0.31 0.33 0.00 -1.51 0.00 0.00 72.50 71.03 1ddm s THR 80 CO -0.00 0.00 0.83 0.00 -2.21 0.00 0.00 174.62 173.24 1ddm n SER 82 N 0.11 0.00 -1.10 0.00 2.88 -1.24 -4.06 113.62 110.20 1ddm n SER 82 Ca 0.28 0.00 -0.01 0.00 -1.33 0.00 0.00 58.87 57.81 1ddm n SER 82 Cb 0.51 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.97 1ddm n SER 82 CO 0.00 0.00 0.00 0.49 -1.23 0.00 0.00 175.04 174.30 1ddm n PHE 83 N 0.00 -0.88 -1.59 0.66 3.72 -1.03 -4.89 117.46 113.45 1ddm n PHE 83 Ca 0.00 -0.11 -0.43 0.00 -0.05 0.00 0.00 57.45 56.86 1ddm n PHE 83 Cb 0.00 0.04 -0.00 0.00 -0.94 0.00 0.00 39.48 38.58 1ddm n PHE 83 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 1ddm n SER 84 N -1.40 1.24 -2.53 4.37 7.64 -1.26 -1.46 113.62 120.22 1ddm n SER 84 Ca -0.00 1.11 -0.13 0.00 1.01 0.00 0.00 58.87 60.86 1ddm n SER 84 Cb 0.03 -1.31 -0.04 0.00 -1.01 0.00 0.00 64.21 61.88 1ddm n SER 84 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 1ddm n VAL 85 N -0.11 0.00 -3.37 0.44 0.24 -0.98 -1.60 118.33 112.95 1ddm n VAL 85 Ca 0.09 -1.39 -0.26 0.00 -2.04 0.00 0.00 64.34 60.75 1ddm n VAL 85 Cb 0.35 0.61 -0.09 0.00 -1.47 0.00 0.00 33.84 33.25 1ddm n VAL 85 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 1ddm n LYS 86 N -0.44 1.03 -1.66 7.34 5.02 -0.11 -3.13 118.16 126.22 1ddm n LYS 86 Ca 0.01 -3.62 -0.42 0.00 -2.02 0.00 0.00 58.31 52.26 1ddm n LYS 86 Cb 0.35 -1.66 -0.03 0.00 -0.02 0.00 0.00 35.03 33.68 1ddm n LYS 86 CO 0.00 0.00 0.00 -0.47 -0.52 0.00 0.00 177.40 176.41 1ddm s TYR 87 N -1.12 1.24 0.06 2.13 5.04 -1.22 -3.38 117.35 120.10 1ddm s TYR 87 Ca 0.34 0.74 -0.08 0.00 -2.44 0.00 0.00 57.07 55.63 1ddm s TYR 87 Cb 0.11 -3.89 -0.31 0.00 0.35 0.00 0.00 41.96 38.21 1ddm s TYR 87 CO -0.12 -3.62 1.08 -0.07 -1.34 0.00 0.00 175.55 171.48 1ddm h LEU 88 N 15.75 0.56 0.00 6.97 3.38 -1.64 -1.64 115.31 138.68 1ddm h LEU 88 Ca -0.37 -0.60 0.00 0.00 0.09 0.00 0.00 57.88 57.00 1ddm h LEU 88 Cb 1.23 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.80 1ddm h LEU 88 CO 1.01 1.47 0.00 0.61 0.09 0.00 0.00 178.44 181.62 1ddm n GLY 89 N 1.60 0.44 3.64 0.83 0.00 -1.24 -3.18 105.19 107.28 1ddm n GLY 89 Ca -0.11 -0.76 -0.05 0.00 0.00 0.00 0.00 46.02 45.10 1ddm n GLY 89 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ddm s VAL 91 N 1.48 3.13 0.08 0.00 -7.23 0.47 -4.95 120.40 113.38 1ddm s VAL 91 Ca -0.09 -1.16 -0.31 0.00 -1.81 0.00 0.00 61.98 58.61 1ddm s VAL 91 Cb -0.04 -2.38 -0.06 0.00 0.56 0.00 0.00 36.38 34.45 1ddm s VAL 91 CO -0.17 0.26 1.27 -0.70 -0.31 0.00 0.00 175.10 175.44 1ddm s GLU 92 N -1.73 4.39 0.48 4.82 2.12 -1.26 -1.44 118.70 126.08 1ddm s GLU 92 Ca 0.17 1.87 0.02 0.00 0.36 0.00 0.00 54.97 57.40 1ddm s GLU 92 Cb -0.11 -3.32 -0.03 0.00 0.26 0.00 0.00 34.13 30.94 1ddm s GLU 92 CO 0.09 -0.32 0.02 0.14 -0.54 0.00 0.00 175.26 174.65 1ddm s VAL 93 N 1.10 1.21 -0.37 3.70 -7.23 -1.18 -4.90 120.40 112.73 1ddm s VAL 93 Ca 0.61 -2.00 0.12 0.00 -1.81 0.00 0.00 61.98 58.89 1ddm s VAL 93 Cb -0.32 -2.34 0.35 0.00 0.56 0.00 0.00 36.38 34.64 1ddm s VAL 93 CO 0.29 0.00 0.76 0.33 -0.31 0.00 0.00 175.10 176.18 1ddm n PHE 94 N -1.15 0.01 0.15 2.82 -0.00 -1.26 -4.71 117.46 113.32 1ddm n PHE 94 Ca -0.15 -3.68 0.00 0.00 -0.00 0.00 0.00 57.45 53.62 1ddm n PHE 94 Cb 0.67 -0.28 0.00 0.00 -0.00 0.00 0.00 39.48 39.86 1ddm n PHE 94 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 176.76 177.15 1ddm n GLU 95 N 0.28 0.00 -3.10 -4.13 1.02 -1.26 -5.03 120.64 108.42 1ddm n GLU 95 Ca 0.23 0.00 -0.21 0.00 -0.02 0.00 0.00 57.16 57.16 1ddm n GLU 95 Cb 0.67 0.00 0.01 0.00 -0.02 0.00 0.00 31.44 32.09 1ddm n GLU 95 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 1ddm n SER 96 N -3.11 -4.52 -3.80 1.62 7.64 -1.26 -4.95 113.62 105.23 1ddm n SER 96 Ca 0.00 -0.26 -0.12 0.00 1.01 0.00 0.00 58.87 59.50 1ddm n SER 96 Cb 0.00 -3.72 -0.11 0.00 -1.01 0.00 0.00 64.21 59.36 1ddm n SER 96 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ddm s ARG 97 N -5.75 0.31 0.25 1.43 1.70 -1.26 -4.94 118.95 110.69 1ddm s ARG 97 Ca 0.30 0.19 0.00 0.00 -0.47 0.00 0.00 55.73 55.75 1ddm s ARG 97 Cb -0.15 0.14 0.00 0.00 -0.57 0.00 0.00 34.95 34.37 1ddm s ARG 97 CO 0.37 -0.05 0.00 0.41 -1.08 0.00 0.00 175.30 174.95 1ddm n GLY 98 N 2.68 1.06 0.00 3.88 0.00 -1.26 -4.62 105.19 106.93 1ddm n GLY 98 Ca -0.14 -1.58 0.00 0.00 0.00 0.00 0.00 46.02 44.30 1ddm n GLY 98 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1ddm n MET 99 N 0.73 0.00 0.28 1.61 0.00 -1.26 -4.85 117.12 113.63 1ddm n MET 99 Ca 0.00 0.00 0.19 0.00 -0.00 0.00 0.00 57.70 57.89 1ddm n MET 99 Cb 0.00 -0.34 0.90 0.00 0.00 0.00 0.00 33.22 33.78 1ddm n MET 99 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 175.97 177.93 1ddm h GLN 100 N 0.00 0.00 -0.84 2.12 4.20 -1.98 -2.54 115.11 116.07 1ddm h GLN 100 Ca 0.00 0.00 0.10 0.00 0.06 0.00 0.00 58.65 58.81 1ddm h GLN 100 Cb 0.00 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 27.72 1ddm h GLN 100 CO 0.00 0.00 0.54 -0.39 -0.67 0.00 0.00 178.83 178.31 1ddm h VAL 101 N 0.00 0.96 0.00 -0.54 -1.51 -1.89 0.80 116.25 114.07 1ddm h VAL 101 Ca 0.00 -0.27 -0.08 0.00 -1.23 0.00 0.00 66.70 65.11 1ddm h VAL 101 Cb 0.20 0.09 -0.01 0.00 -2.13 0.00 0.00 31.29 29.44 1ddm h VAL 101 CO 0.00 0.15 -0.40 0.00 -1.23 0.00 0.00 177.57 176.09 1ddm h GLU 103 N 0.00 0.00 0.00 0.00 4.81 -0.98 -2.12 114.58 116.29 1ddm h GLU 103 Ca -0.00 0.00 -0.13 0.00 -0.13 0.00 0.00 59.36 59.10 1ddm h GLU 103 Cb 0.77 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.13 1ddm h GLU 103 CO 0.05 0.14 -0.79 0.93 -0.73 0.00 0.00 179.01 178.62 1ddm h GLU 104 N 0.00 0.00 -0.16 1.92 4.39 -0.98 -3.32 114.58 116.43 1ddm h GLU 104 Ca -0.00 0.00 0.02 0.00 0.34 0.00 0.00 59.36 59.72 1ddm h GLU 104 Cb 0.74 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.37 1ddm h GLU 104 CO 0.02 0.74 0.04 0.00 -1.16 0.00 0.00 179.01 178.65 1ddm h ALA 105 N -0.53 0.16 -0.69 3.43 0.00 -1.43 -1.64 119.26 118.57 1ddm h ALA 105 Ca -0.19 0.03 0.19 0.00 0.00 0.00 0.00 54.91 54.93 1ddm h ALA 105 Cb 1.00 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.79 1ddm h ALA 105 CO -0.12 -0.40 0.49 1.25 0.00 0.00 0.00 179.25 180.47 1ddm h LEU 106 N 0.11 0.07 -0.34 0.00 5.85 -1.58 0.14 115.31 119.57 1ddm h LEU 106 Ca 0.07 0.01 -0.19 0.00 0.84 0.00 0.00 57.88 58.60 1ddm h LEU 106 Cb 0.06 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.08 1ddm h LEU 106 CO -0.09 0.03 -0.71 0.50 -0.34 0.00 0.00 178.44 177.83 1ddm h LYS 107 N 0.07 0.58 -0.18 1.25 1.63 -1.41 -2.44 116.57 116.07 1ddm h LYS 107 Ca 0.33 -0.45 -0.00 0.00 -0.85 0.00 0.00 60.65 59.68 1ddm h LYS 107 Cb 1.21 0.09 -0.01 0.00 -0.60 0.00 0.00 32.23 32.92 1ddm h LYS 107 CO -0.03 1.07 0.11 0.28 -3.45 0.00 0.00 179.45 177.44 1ddm h VAL 108 N 0.40 1.08 0.00 2.00 2.07 -0.29 -1.20 116.25 120.31 1ddm h VAL 108 Ca -0.03 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 67.30 1ddm h VAL 108 Cb 1.30 0.87 0.00 0.00 -1.52 0.00 0.00 31.29 31.94 1ddm h VAL 108 CO 0.13 0.07 0.00 -0.07 0.02 0.00 0.00 177.57 177.73 1ddm h LEU 109 N 0.22 0.00 -0.02 2.57 4.07 -1.48 -1.88 115.31 118.79 1ddm h LEU 109 Ca 0.07 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.03 1ddm h LEU 109 Cb 0.02 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.76 1ddm h LEU 109 CO -0.01 0.00 -0.36 -1.14 -1.08 0.00 0.00 178.44 175.85 1ddm n ARG 110 N -2.64 0.05 -0.03 1.13 0.63 -0.62 -4.25 116.66 110.93 1ddm n ARG 110 Ca 0.02 -0.02 -0.00 0.00 -0.92 0.00 0.00 57.85 56.92 1ddm n ARG 110 Cb 0.27 -1.50 -0.00 0.00 0.45 0.00 0.00 32.46 31.68 1ddm n ARG 110 CO 0.00 0.00 0.00 1.96 -2.51 0.00 0.00 177.63 177.08 1ddm h GLN 111 N 0.06 0.00 0.00 -0.14 4.20 -0.39 -3.50 115.11 115.33 1ddm h GLN 111 Ca 0.00 0.00 0.13 0.00 0.06 0.00 0.00 58.65 58.84 1ddm h GLN 111 Cb 0.50 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.25 1ddm h GLN 111 CO 0.00 0.00 0.41 0.45 -0.67 0.00 0.00 178.83 179.02 1ddm n SER 112 N -3.71 -0.87 0.00 1.46 2.88 -1.23 -5.03 113.62 107.12 1ddm n SER 112 Ca -0.00 -1.37 0.00 0.00 -1.33 0.00 0.00 58.87 56.17 1ddm n SER 112 Cb 0.01 1.40 0.00 0.00 -0.75 0.00 0.00 64.21 64.87 1ddm n SER 112 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1ddm n ARG 113 N -0.46 0.00 -1.94 -1.46 3.00 -1.26 -4.71 116.66 109.82 1ddm n ARG 113 Ca 0.00 0.00 -0.43 0.00 -0.01 0.00 0.00 57.85 57.41 1ddm n ARG 113 Cb 0.33 0.00 -0.03 0.00 0.00 0.00 0.00 32.46 32.77 1ddm n ARG 113 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.63 178.66 1ddm s ARG 114 N 0.00 3.37 -0.06 5.56 1.81 -1.26 -4.98 118.95 123.38 1ddm s ARG 114 Ca 0.00 1.57 -0.06 0.00 -1.72 0.00 0.00 55.73 55.52 1ddm s ARG 114 Cb 0.00 -4.21 -0.04 0.00 -0.45 0.00 0.00 34.95 30.25 1ddm s ARG 114 CO 0.00 -1.82 0.18 1.03 -0.68 0.00 0.00 175.30 174.01 1ddm s ARG 115 N 5.64 3.47 0.41 3.54 0.52 -1.19 -4.76 118.95 126.57 1ddm s ARG 115 Ca 0.82 -0.18 -0.22 0.00 -0.52 0.00 0.00 55.73 55.64 1ddm s ARG 115 Cb -0.25 -3.15 -0.10 0.00 0.52 0.00 0.00 34.95 31.97 1ddm s ARG 115 CO 0.34 0.73 0.96 -1.25 0.02 0.00 0.00 175.30 176.09 1ddm s PRO 116 N -1.43 4.27 -0.19 3.54 0.04 -1.25 -4.25 135.00 135.73 1ddm s PRO 116 Ca 0.21 1.20 0.01 0.00 0.04 0.00 0.00 61.00 62.46 1ddm s PRO 116 Cb -0.12 -2.32 0.03 0.00 0.04 0.00 0.00 34.50 32.13 1ddm s PRO 116 CO 0.11 -0.00 -0.16 0.08 0.04 0.00 0.00 177.00 177.06 1ddm s VAL 117 N -2.03 1.95 -0.61 -0.36 1.01 -0.62 -4.86 120.40 114.88 1ddm s VAL 117 Ca 0.60 -1.03 -0.26 0.00 0.00 0.00 0.00 61.98 61.28 1ddm s VAL 117 Cb -0.12 -1.86 -0.05 0.00 0.00 0.00 0.00 36.38 34.34 1ddm s VAL 117 CO 0.16 0.37 2.13 -0.60 0.00 0.00 0.00 175.10 177.17 1ddm s ARG 118 N 1.30 2.31 0.00 2.72 3.52 -1.26 -3.43 118.95 124.11 1ddm s ARG 118 Ca 0.02 0.81 0.00 0.00 -0.13 0.00 0.00 55.73 56.42 1ddm s ARG 118 Cb -0.15 -4.57 0.00 0.00 -1.56 0.00 0.00 34.95 28.67 1ddm s ARG 118 CO -0.11 -3.18 0.00 0.41 -0.81 0.00 0.00 175.30 171.61 1ddm n GLY 119 N 6.05 6.47 2.90 8.12 0.00 -1.18 -2.05 105.19 125.49 1ddm n GLY 119 Ca 0.31 -1.83 -0.27 0.00 0.00 0.00 0.00 46.02 44.22 1ddm n GLY 119 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ddm s LEU 120 N 0.00 1.39 -0.09 0.99 1.98 0.02 -2.31 118.68 120.67 1ddm s LEU 120 Ca 0.00 -0.48 -0.20 0.00 -2.89 0.00 0.00 54.13 50.56 1ddm s LEU 120 Cb 0.00 -0.88 -0.04 0.00 0.66 0.00 0.00 46.19 45.93 1ddm s LEU 120 CO 0.00 -0.15 0.56 -0.22 -1.89 0.00 0.00 176.35 174.65 1ddm s LEU 121 N 1.67 4.31 -0.49 -0.68 2.96 -0.53 -1.71 118.68 124.20 1ddm s LEU 121 Ca 0.03 0.97 0.02 0.00 -0.22 0.00 0.00 54.13 54.94 1ddm s LEU 121 Cb -0.14 -2.84 0.13 0.00 0.50 0.00 0.00 46.19 43.84 1ddm s LEU 121 CO -0.08 -0.02 0.24 -1.00 -1.32 0.00 0.00 176.35 174.17 1ddm s HIS 122 N 0.56 3.39 -0.72 5.38 3.76 -0.57 -2.48 115.29 124.61 1ddm s HIS 122 Ca 0.30 -3.01 -0.26 0.00 -0.15 0.00 0.00 55.06 51.95 1ddm s HIS 122 Cb -0.16 -2.94 -0.06 0.00 1.11 0.00 0.00 32.58 30.52 1ddm s HIS 122 CO 0.14 -0.82 2.10 0.08 -0.85 0.00 0.00 174.74 175.38 1ddm s VAL 123 N 0.13 3.25 -0.15 -0.90 1.01 -1.26 -3.24 120.40 119.25 1ddm s VAL 123 Ca 0.15 -0.07 -0.09 0.00 0.00 0.00 0.00 61.98 61.97 1ddm s VAL 123 Cb -0.23 -3.61 -0.04 0.00 0.00 0.00 0.00 36.38 32.49 1ddm s VAL 123 CO -0.03 -0.59 0.16 -0.94 0.00 0.00 0.00 175.10 173.71 1ddm s SER 124 N 9.37 6.35 0.00 3.32 1.04 -1.25 -0.49 113.70 132.04 1ddm s SER 124 Ca 0.79 0.41 0.00 0.00 0.48 0.00 0.00 55.95 57.62 1ddm s SER 124 Cb -0.11 -2.09 0.00 0.00 0.10 0.00 0.00 66.02 63.91 1ddm s SER 124 CO 0.12 0.30 0.93 0.61 0.98 0.00 0.00 173.24 176.18 1ddm n GLY 125 N 2.63 -0.43 1.31 7.32 0.00 -1.13 -0.90 105.19 113.99 1ddm n GLY 125 Ca -0.18 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.76 1ddm n GLY 125 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1ddm n ASP 126 N -1.43 3.16 0.00 1.61 2.03 -1.26 -4.77 116.55 115.89 1ddm n ASP 126 Ca 0.00 -3.81 0.00 0.00 0.52 0.00 0.00 54.79 51.50 1ddm n ASP 126 Cb 0.05 -0.58 0.00 0.00 -0.72 0.00 0.00 41.12 39.87 1ddm n ASP 126 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1ddm n GLY 127 N -1.03 2.96 3.59 0.27 0.00 -0.08 -4.85 105.19 106.05 1ddm n GLY 127 Ca 0.35 -1.45 -0.29 0.00 0.00 0.00 0.00 46.02 44.64 1ddm n GLY 127 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ddm s LEU 128 N 0.00 1.08 -0.30 0.99 1.43 -1.17 -3.75 118.68 116.96 1ddm s LEU 128 Ca 0.00 1.18 -0.08 0.00 -1.03 0.00 0.00 54.13 54.20 1ddm s LEU 128 Cb 0.00 -3.18 0.18 0.00 0.03 0.00 0.00 46.19 43.22 1ddm s LEU 128 CO 0.00 -3.70 0.85 -0.60 0.23 0.00 0.00 176.35 173.12 1ddm s ARG 129 N -4.87 0.36 -0.31 1.70 3.52 -1.20 -4.20 118.95 113.96 1ddm s ARG 129 Ca 0.67 0.66 -0.08 0.00 -0.13 0.00 0.00 55.73 56.85 1ddm s ARG 129 Cb -0.19 0.37 0.00 0.00 -1.56 0.00 0.00 34.95 33.57 1ddm s ARG 129 CO 0.60 -0.38 0.12 0.08 -0.81 0.00 0.00 175.30 174.91 1ddm s VAL 130 N 2.89 4.28 -0.24 7.11 1.01 -0.60 -1.52 120.40 133.33 1ddm s VAL 130 Ca 0.08 -0.59 -0.07 0.00 0.00 0.00 0.00 61.98 61.40 1ddm s VAL 130 Cb -0.12 -3.21 -0.03 0.00 0.00 0.00 0.00 36.38 33.02 1ddm s VAL 130 CO -0.16 0.05 0.06 -0.69 0.00 0.00 0.00 175.10 174.36 1ddm s VAL 131 N 1.55 4.22 0.70 2.92 1.01 -0.70 -2.28 120.40 127.83 1ddm s VAL 131 Ca 0.03 -0.20 -0.16 0.00 0.00 0.00 0.00 61.98 61.65 1ddm s VAL 131 Cb -0.17 -2.97 -0.04 0.00 0.00 0.00 0.00 36.38 33.21 1ddm s VAL 131 CO 0.04 0.35 0.64 0.47 0.00 0.00 0.00 175.10 176.61 1ddm n ASP 132 N 4.86 -0.74 -0.77 3.32 8.00 -1.06 -0.80 116.55 129.37 1ddm n ASP 132 Ca -0.16 0.63 0.09 0.00 0.71 0.00 0.00 54.79 56.06 1ddm n ASP 132 Cb 0.51 -1.26 0.11 0.00 -0.02 0.00 0.00 41.12 40.47 1ddm n ASP 132 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1ddm n ASP 133 N -0.51 2.70 -0.00 -2.24 -0.08 -0.87 -2.26 116.55 113.29 1ddm n ASP 133 Ca 0.11 -1.79 0.00 0.00 -1.51 0.00 0.00 54.79 51.60 1ddm n ASP 133 Cb 0.49 -0.09 -0.00 0.00 2.34 0.00 0.00 41.12 43.86 1ddm n ASP 133 CO 0.00 0.00 0.00 1.21 0.12 0.00 0.00 177.20 178.53 1ddm n GLU 134 N 1.00 1.86 0.00 -0.67 0.00 -1.26 -4.76 120.64 116.81 1ddm n GLU 134 Ca 0.12 -0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.28 1ddm n GLU 134 Cb 0.46 -1.02 0.00 0.00 0.00 0.00 0.00 31.44 30.88 1ddm n GLU 134 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.13 177.38 1ddm n THR 135 N -1.76 0.00 -2.06 6.31 -2.24 -1.26 -5.00 114.28 108.27 1ddm n THR 135 Ca -0.01 -0.28 -0.15 0.00 -2.27 0.00 0.00 64.05 61.34 1ddm n THR 135 Cb 0.25 0.96 -0.03 0.00 -2.10 0.00 0.00 70.33 69.42 1ddm n THR 135 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1ddm n LYS 136 N -0.61 -1.79 -3.31 -0.78 4.76 -0.96 -4.93 118.16 110.54 1ddm n LYS 136 Ca 0.00 0.77 -0.38 0.00 -2.87 0.00 0.00 58.31 55.83 1ddm n LYS 136 Cb 0.00 -5.26 -0.06 0.00 -1.84 0.00 0.00 35.03 27.87 1ddm n LYS 136 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 1ddm s GLY 137 N -2.11 2.54 -0.37 0.72 0.00 -1.26 -4.59 107.32 102.25 1ddm s GLY 137 Ca 0.00 -0.08 -0.28 0.00 0.00 0.00 0.00 44.72 44.36 1ddm s GLY 137 CO 0.00 0.57 1.84 -2.27 0.00 0.00 0.00 173.10 173.24 1ddm s LEU 138 N -0.35 3.47 -0.11 0.66 2.96 -1.26 -2.56 118.68 121.49 1ddm s LEU 138 Ca 0.28 1.19 0.20 0.00 -0.22 0.00 0.00 54.13 55.57 1ddm s LEU 138 Cb -0.17 -3.34 -0.28 0.00 0.50 0.00 0.00 46.19 42.89 1ddm s LEU 138 CO 0.15 -1.85 0.30 2.30 -1.32 0.00 0.00 176.35 175.93 1ddm n ILE 139 N 7.42 0.75 -3.66 6.68 -5.35 -0.96 -4.85 119.36 119.38 1ddm n ILE 139 Ca 0.23 -0.69 -0.28 0.00 -0.27 0.00 0.00 62.75 61.75 1ddm n ILE 139 Cb 0.48 -0.27 -0.16 0.00 -1.74 0.00 0.00 39.64 37.95 1ddm n ILE 139 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 1ddm s VAL 140 N -2.98 0.30 -0.22 7.28 1.01 -1.23 -4.97 120.40 119.58 1ddm s VAL 140 Ca -0.09 -0.64 0.12 0.00 0.00 0.00 0.00 61.98 61.37 1ddm s VAL 140 Cb 0.10 -1.01 0.44 0.00 0.00 0.00 0.00 36.38 35.90 1ddm s VAL 140 CO 0.86 -0.42 1.30 -0.90 0.00 0.00 0.00 175.10 175.95 1ddm n ASP 141 N 5.12 2.17 -2.83 3.32 5.68 -1.26 -1.56 116.55 127.18 1ddm n ASP 141 Ca -0.07 -3.70 -0.09 0.00 -0.50 0.00 0.00 54.79 50.43 1ddm n ASP 141 Cb 0.46 -0.55 0.08 0.00 -1.14 0.00 0.00 41.12 39.96 1ddm n ASP 141 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1ddm n GLN 142 N -1.13 -1.63 -4.31 0.11 1.13 -1.26 -4.92 117.38 105.37 1ddm n GLN 142 Ca 0.23 -0.55 -0.16 0.00 -1.94 0.00 0.00 57.00 54.58 1ddm n GLN 142 Cb 0.81 -0.51 -0.10 0.00 0.11 0.00 0.00 30.24 30.54 1ddm n GLN 142 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 1ddm s THR 143 N -1.63 1.03 0.13 5.09 2.01 -1.26 -3.05 115.64 117.96 1ddm s THR 143 Ca 0.22 -2.04 0.00 0.00 0.31 0.00 0.00 61.69 60.19 1ddm s THR 143 Cb -0.02 -2.26 -0.20 0.00 0.01 0.00 0.00 72.50 70.03 1ddm s THR 143 CO 0.17 -0.39 1.29 0.40 -0.69 0.00 0.00 174.62 175.40 1ddm h ILE 144 N 2.53 1.51 0.00 1.82 2.04 -1.89 -2.93 117.51 120.58 1ddm h ILE 144 Ca -0.38 -2.82 0.00 0.00 1.00 0.00 0.00 64.86 62.66 1ddm h ILE 144 Cb 1.22 2.64 0.00 0.00 -0.74 0.00 0.00 36.82 39.94 1ddm h ILE 144 CO 0.64 0.82 -0.32 -0.62 0.00 0.00 0.00 178.15 178.67 1ddm n GLU 145 N -3.60 0.05 0.09 2.37 1.02 -1.26 -3.74 120.64 115.57 1ddm n GLU 145 Ca -0.05 0.02 -0.20 0.00 -0.02 0.00 0.00 57.16 56.91 1ddm n GLU 145 Cb 0.89 -1.54 -0.15 0.00 -0.02 0.00 0.00 31.44 30.62 1ddm n GLU 145 CO 0.00 0.00 0.00 -0.22 1.18 0.00 0.00 177.13 178.09 1ddm h LYS 146 N 0.00 0.35 -6.72 3.49 3.64 -1.95 -3.46 116.57 111.93 1ddm h LYS 146 Ca 0.00 -0.61 -0.50 0.00 -1.27 0.00 0.00 60.65 58.27 1ddm h LYS 146 Cb 0.54 0.23 -0.01 0.00 -0.41 0.00 0.00 32.23 32.58 1ddm h LYS 146 CO 0.00 1.25 0.41 0.14 -2.27 0.00 0.00 179.45 178.98 1ddm s VAL 147 N -2.60 3.95 0.01 2.00 -7.23 -1.11 -4.86 120.40 110.54 1ddm s VAL 147 Ca -0.11 1.84 -0.05 0.00 -1.81 0.00 0.00 61.98 61.85 1ddm s VAL 147 Cb 0.06 -4.17 -0.03 0.00 0.56 0.00 0.00 36.38 32.80 1ddm s VAL 147 CO 0.87 0.39 1.05 -1.28 -0.31 0.00 0.00 175.10 175.83 1ddm h SER 148 N 4.47 -0.16 -3.65 4.85 0.87 -1.66 -3.46 113.55 114.81 1ddm h SER 148 Ca -0.45 0.01 -0.24 0.00 -1.23 0.00 0.00 61.79 59.88 1ddm h SER 148 Cb 1.21 0.04 -0.30 0.00 -0.44 0.00 0.00 62.40 62.91 1ddm h SER 148 CO 0.69 -0.11 -0.67 -0.36 -0.53 0.00 0.00 176.83 175.84 1ddm s PHE 149 N -3.37 -0.04 -0.75 2.24 0.40 -1.26 -5.05 117.98 110.15 1ddm s PHE 149 Ca -0.03 0.17 -0.15 0.00 -0.60 0.00 0.00 56.93 56.31 1ddm s PHE 149 Cb 0.00 -0.06 0.18 0.00 0.51 0.00 0.00 43.02 43.66 1ddm s PHE 149 CO 0.08 -0.06 0.74 0.00 0.70 0.00 0.00 175.22 176.69 1ddm s ALA 151 N 1.00 3.60 0.00 0.00 0.00 -0.97 -4.94 121.76 120.46 1ddm s ALA 151 Ca 0.16 -1.13 0.00 0.00 0.00 0.00 0.00 51.96 50.99 1ddm s ALA 151 Cb -0.15 -1.43 0.00 0.00 0.00 0.00 0.00 23.12 21.54 1ddm s ALA 151 CO -0.05 0.60 0.00 -0.35 0.00 0.00 0.00 175.76 175.96 1ddm n PRO 152 N -0.08 0.00 0.00 0.00 -0.04 -1.26 -0.34 135.00 133.28 1ddm n PRO 152 Ca -0.08 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.38 1ddm n PRO 152 Cb 0.53 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.99 1ddm n PRO 152 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1ddm n ASP 153 N 0.00 0.00 -1.63 3.54 5.75 -0.99 -4.20 116.55 119.02 1ddm n ASP 153 Ca 0.00 -0.60 -0.06 0.00 -0.01 0.00 0.00 54.79 54.12 1ddm n ASP 153 Cb 0.00 0.00 -0.02 0.00 -1.03 0.00 0.00 41.12 40.07 1ddm n ASP 153 CO 0.00 0.00 0.00 -2.11 -0.11 0.00 0.00 177.20 174.98 1ddm n ARG 154 N 0.00 -1.66 -0.08 0.11 1.85 -1.26 -4.71 116.66 110.90 1ddm n ARG 154 Ca 0.00 0.31 -0.14 0.00 -1.00 0.00 0.00 57.85 57.02 1ddm n ARG 154 Cb 0.15 -4.58 -0.05 0.00 -1.05 0.00 0.00 32.46 26.94 1ddm n ARG 154 CO 0.00 0.00 0.00 -1.71 -0.01 0.00 0.00 177.63 175.91 1ddm n ASN 155 N -0.35 1.70 0.00 2.89 5.15 -1.26 -4.87 115.26 118.52 1ddm n ASN 155 Ca -0.06 0.29 0.00 0.00 -0.60 0.00 0.00 54.58 54.21 1ddm n ASN 155 Cb 0.32 -0.66 0.00 0.00 -0.53 0.00 0.00 39.78 38.90 1ddm n ASN 155 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1ddm n HIS 156 N -4.17 0.00 -2.48 1.20 1.44 -1.26 -5.01 115.22 104.94 1ddm n HIS 156 Ca -0.25 0.00 -0.21 0.00 -2.01 0.00 0.00 57.72 55.26 1ddm n HIS 156 Cb 0.58 0.01 -0.00 0.00 0.12 0.00 0.00 29.99 30.70 1ddm n HIS 156 CO 0.00 0.00 0.00 0.39 -2.81 0.00 0.00 176.34 173.92 1ddm n GLU 157 N 0.00 -2.09 -0.04 -1.40 4.71 -1.26 -4.85 120.64 115.70 1ddm n GLU 157 Ca 0.00 0.97 0.02 0.00 -0.01 0.00 0.00 57.16 58.14 1ddm n GLU 157 Cb 0.32 -5.64 0.04 0.00 -1.01 0.00 0.00 31.44 25.16 1ddm n GLU 157 CO 0.00 0.00 0.00 0.54 0.09 0.00 0.00 177.13 177.76 1ddm n ARG 158 N -3.10 2.06 -3.63 3.49 1.74 -1.26 -3.76 116.66 112.20 1ddm n ARG 158 Ca -0.22 -1.44 -0.11 0.00 -0.77 0.00 0.00 57.85 55.31 1ddm n ARG 158 Cb 0.67 -1.09 -0.11 0.00 -1.02 0.00 0.00 32.46 30.92 1ddm n ARG 158 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1ddm s GLY 159 N -0.82 -0.26 0.53 -0.13 0.00 -1.26 -2.24 107.32 103.14 1ddm s GLY 159 Ca 0.07 1.21 0.04 0.00 0.00 0.00 0.00 44.72 46.04 1ddm s GLY 159 CO 0.05 2.25 0.34 0.69 0.00 0.00 0.00 173.10 176.44 1ddm n PHE 160 N 5.37 -0.35 -3.76 1.90 3.72 -0.08 -2.35 117.46 121.91 1ddm n PHE 160 Ca -0.07 -2.29 -0.04 0.00 -0.05 0.00 0.00 57.45 55.01 1ddm n PHE 160 Cb 0.50 -0.42 -0.01 0.00 -0.94 0.00 0.00 39.48 38.60 1ddm n PHE 160 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 1ddm s SER 161 N -4.07 -0.18 -0.07 4.37 1.04 0.54 -2.00 113.70 113.32 1ddm s SER 161 Ca 0.26 -0.41 -0.15 0.00 0.48 0.00 0.00 55.95 56.13 1ddm s SER 161 Cb -0.02 0.49 0.03 0.00 0.10 0.00 0.00 66.02 66.63 1ddm s SER 161 CO 0.16 -0.91 0.36 -0.72 0.98 0.00 0.00 173.24 173.11 1ddm s TYR 162 N -3.30 -0.31 0.23 5.02 1.13 -0.99 -2.28 117.35 116.85 1ddm s TYR 162 Ca 0.12 0.65 0.11 0.00 -1.41 0.00 0.00 57.07 56.54 1ddm s TYR 162 Cb -0.01 0.13 -0.05 0.00 -1.10 0.00 0.00 41.96 40.93 1ddm s TYR 162 CO 0.02 -0.32 -0.14 0.42 -2.51 0.00 0.00 175.55 173.02 1ddm s ILE 163 N -0.64 2.84 0.20 -3.49 1.09 -1.24 -0.93 121.20 119.02 1ddm s ILE 163 Ca -0.07 -2.01 -0.06 0.00 -1.10 0.00 0.00 60.65 57.40 1ddm s ILE 163 Cb -0.04 -2.45 0.02 0.00 -1.06 0.00 0.00 42.46 38.94 1ddm s ILE 163 CO 0.03 -0.25 0.37 0.00 -0.10 0.00 0.00 174.94 174.99 1ddm n ARG 165 N -0.27 2.43 0.00 0.00 3.00 -1.26 -2.19 116.66 118.36 1ddm n ARG 165 Ca -0.03 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.81 1ddm n ARG 165 Cb 0.30 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.76 1ddm n ARG 165 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 1ddm n ASP 166 N 0.00 -0.61 0.00 0.55 9.92 -0.98 -4.37 116.55 121.06 1ddm n ASP 166 Ca 0.00 -0.07 0.00 0.00 -0.53 0.00 0.00 54.79 54.19 1ddm n ASP 166 Cb 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.48 1ddm n ASP 166 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1ddm n GLY 167 N 0.89 2.29 0.00 0.44 0.00 -1.26 -4.49 105.19 103.05 1ddm n GLY 167 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1ddm n GLY 167 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1ddm n THR 168 N -2.00 0.00 0.00 2.61 5.66 -1.26 -4.92 114.28 114.37 1ddm n THR 168 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 1ddm n THR 168 Cb 0.00 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.78 1ddm n THR 168 CO 0.00 0.00 0.00 0.41 -3.05 0.00 0.00 175.07 172.43 1ddm n THR 169 N 0.00 0.00 -1.55 1.09 -1.04 -1.26 -5.01 114.28 106.51 1ddm n THR 169 Ca 0.00 -0.15 -0.19 0.00 -2.04 0.00 0.00 64.05 61.67 1ddm n THR 169 Cb 0.09 0.81 -0.08 0.00 -1.82 0.00 0.00 70.33 69.33 1ddm n THR 169 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1ddm n ARG 170 N -0.44 -1.43 -3.75 -2.82 1.74 -1.26 -4.88 116.66 103.82 1ddm n ARG 170 Ca 0.00 1.17 -0.01 0.00 -0.77 0.00 0.00 57.85 58.24 1ddm n ARG 170 Cb 0.00 -5.53 -0.00 0.00 -1.02 0.00 0.00 32.46 25.91 1ddm n ARG 170 CO 0.00 0.00 0.00 -0.98 -1.52 0.00 0.00 177.63 175.13 1ddm s ARG 171 N -3.60 0.78 -0.35 5.56 1.70 -1.26 -4.81 118.95 116.97 1ddm s ARG 171 Ca 0.00 -0.46 -0.28 0.00 -0.47 0.00 0.00 55.73 54.53 1ddm s ARG 171 Cb 0.00 0.25 0.02 0.00 -0.57 0.00 0.00 34.95 34.65 1ddm s ARG 171 CO 0.00 -0.36 1.01 1.67 -1.08 0.00 0.00 175.30 176.54 1ddm s TRP 172 N -2.57 3.10 0.04 5.89 -2.14 -1.26 -2.33 118.94 119.67 1ddm s TRP 172 Ca 0.17 1.00 0.04 0.00 2.66 0.00 0.00 56.10 59.97 1ddm s TRP 172 Cb 0.01 -3.70 -0.02 0.00 -3.10 0.00 0.00 33.47 26.66 1ddm s TRP 172 CO -0.00 -0.81 -0.13 -1.64 -2.66 0.00 0.00 176.95 171.71 1ddm s MET 173 N 3.61 0.84 0.02 3.25 -1.94 -0.93 -3.07 119.30 121.07 1ddm s MET 173 Ca 0.42 -0.72 0.08 0.00 -1.71 0.00 0.00 55.69 53.77 1ddm s MET 173 Cb -0.12 -0.81 -0.03 0.00 2.01 0.00 0.00 34.83 35.88 1ddm s MET 173 CO 0.17 0.20 -0.24 0.00 -0.01 0.00 0.00 175.02 175.14 1ddm s HIS 175 N -0.76 2.75 0.02 0.00 3.76 -0.11 -0.40 115.29 120.56 1ddm s HIS 175 Ca 0.12 -0.18 0.01 0.00 -0.15 0.00 0.00 55.06 54.85 1ddm s HIS 175 Cb -0.10 -1.29 -0.02 0.00 1.11 0.00 0.00 32.58 32.28 1ddm s HIS 175 CO 0.02 0.55 -0.05 0.20 -0.85 0.00 0.00 174.74 174.61 1ddm s GLY 176 N -3.20 0.30 0.07 -2.22 0.00 -1.23 -2.35 107.32 98.69 1ddm s GLY 176 Ca 0.28 -0.50 -0.26 0.00 0.00 0.00 0.00 44.72 44.24 1ddm s GLY 176 CO 0.18 -0.53 0.80 -0.11 0.00 0.00 0.00 173.10 173.44 1ddm s PHE 177 N -0.98 -0.38 0.31 1.90 -0.71 -0.85 -2.36 117.98 114.91 1ddm s PHE 177 Ca -0.08 0.20 0.04 0.00 -1.04 0.00 0.00 56.93 56.05 1ddm s PHE 177 Cb -0.07 0.56 -0.06 0.00 -1.21 0.00 0.00 43.02 42.24 1ddm s PHE 177 CO -0.00 -0.68 0.03 -0.51 -1.34 0.00 0.00 175.22 172.72 1ddm s LEU 178 N -2.61 2.24 -0.24 -1.99 1.02 -1.22 -0.91 118.68 114.98 1ddm s LEU 178 Ca 0.04 -1.33 -0.11 0.00 0.02 0.00 0.00 54.13 52.76 1ddm s LEU 178 Cb -0.01 -0.42 -0.05 0.00 0.02 0.00 0.00 46.19 45.73 1ddm s LEU 178 CO -0.09 -0.55 0.16 0.00 0.02 0.00 0.00 176.35 175.89 1ddm s ALA 179 N -3.25 3.61 -0.42 4.21 0.00 -0.95 -0.94 121.76 124.03 1ddm s ALA 179 Ca 0.34 -0.87 0.19 0.00 0.00 0.00 0.00 51.96 51.63 1ddm s ALA 179 Cb 0.08 -2.32 0.95 0.00 0.00 0.00 0.00 23.12 21.83 1ddm s ALA 179 CO 0.14 -0.17 1.59 0.00 0.00 0.00 0.00 175.76 177.31 1ddm h LYS 181 N 0.00 0.00 -5.32 0.00 1.79 -1.93 -3.48 116.57 107.64 1ddm h LYS 181 Ca 0.00 0.00 -0.41 0.00 -2.18 0.00 0.00 60.65 58.06 1ddm h LYS 181 Cb 0.12 0.00 0.03 0.00 -1.58 0.00 0.00 32.23 30.79 1ddm h LYS 181 CO 0.00 0.83 -0.64 -0.25 -1.08 0.00 0.00 179.45 178.31 1ddm n ASP 182 N -3.29 -5.42 0.00 0.86 8.00 -0.42 -4.84 116.55 111.44 1ddm n ASP 182 Ca -0.01 -0.46 0.00 0.00 0.71 0.00 0.00 54.79 55.04 1ddm n ASP 182 Cb 0.89 -4.36 0.00 0.00 -0.02 0.00 0.00 41.12 37.63 1ddm n ASP 182 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 1ddm n SER 183 N -2.63 1.99 -0.15 -2.24 2.88 -1.26 -4.93 113.62 107.29 1ddm n SER 183 Ca -0.04 0.00 -0.01 0.00 -1.33 0.00 0.00 58.87 57.49 1ddm n SER 183 Cb 0.57 0.00 -0.00 0.00 -0.75 0.00 0.00 64.21 64.03 1ddm n SER 183 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1ddm n GLY 184 N 3.07 0.40 0.00 0.46 0.00 -1.25 -4.88 105.19 102.99 1ddm n GLY 184 Ca 0.00 -0.83 0.00 0.00 0.00 0.00 0.00 46.02 45.19 1ddm n GLY 184 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1ddm n GLU 185 N -1.03 2.39 0.00 1.61 4.71 -1.26 -3.63 120.64 123.43 1ddm n GLU 185 Ca -0.01 0.00 0.12 0.00 -0.01 0.00 0.00 57.16 57.27 1ddm n GLU 185 Cb 0.51 -0.80 0.33 0.00 -1.01 0.00 0.00 31.44 30.47 1ddm n GLU 185 CO 0.00 0.00 0.00 0.54 0.09 0.00 0.00 177.13 177.76 1ddm n ARG 186 N -1.42 0.17 0.05 3.49 5.12 -1.26 -3.98 116.66 118.83 1ddm n ARG 186 Ca 0.00 -0.09 0.00 0.00 -1.93 0.00 0.00 57.85 55.83 1ddm n ARG 186 Cb 0.30 -1.50 0.00 0.00 -1.16 0.00 0.00 32.46 30.10 1ddm n ARG 186 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 1ddm n LEU 187 N -1.34 0.38 0.36 0.55 4.32 -1.26 -4.14 117.00 115.87 1ddm n LEU 187 Ca 0.07 0.16 -0.14 0.00 -0.02 0.00 0.00 56.01 56.09 1ddm n LEU 187 Cb 0.33 -0.03 -0.07 0.00 -1.62 0.00 0.00 43.42 42.03 1ddm n LEU 187 CO 0.32 -0.54 0.52 -1.28 -1.22 0.00 0.00 177.39 175.20 1ddm h SER 188 N 0.00 -0.77 0.00 -1.43 0.87 -1.80 -0.06 113.55 110.37 1ddm h SER 188 Ca 0.00 0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.59 1ddm h SER 188 Cb 0.25 0.20 0.00 0.00 -0.44 0.00 0.00 62.40 62.41 1ddm h SER 188 CO 0.00 -0.55 0.00 -0.74 -0.53 0.00 0.00 176.83 175.02 1ddm h HIS 189 N -0.91 0.00 0.13 2.24 6.17 -1.69 -2.03 115.15 119.07 1ddm h HIS 189 Ca -0.09 0.00 -0.18 0.00 0.71 0.00 0.00 60.37 60.81 1ddm h HIS 189 Cb 0.69 0.00 0.02 0.00 2.52 0.00 0.00 27.41 30.64 1ddm h HIS 189 CO 0.08 0.00 -0.80 0.00 0.71 0.00 0.00 177.93 177.92 1ddm h ALA 190 N 1.99 -0.08 -0.20 5.26 0.00 -1.60 -3.30 119.26 121.33 1ddm h ALA 190 Ca 0.00 -0.69 -0.04 0.00 0.00 0.00 0.00 54.91 54.18 1ddm h ALA 190 Cb 0.00 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1ddm h ALA 190 CO 0.00 0.37 -0.07 0.28 0.00 0.00 0.00 179.25 179.83 1ddm h VAL 191 N -0.36 1.17 0.00 0.00 2.07 -0.31 -1.64 116.25 117.18 1ddm h VAL 191 Ca -0.14 -0.71 0.00 0.00 0.82 0.00 0.00 66.70 66.67 1ddm h VAL 191 Cb 1.62 1.10 0.00 0.00 -1.52 0.00 0.00 31.29 32.50 1ddm h VAL 191 CO 0.15 0.23 0.00 0.61 0.02 0.00 0.00 177.57 178.58 1ddm n GLY 192 N -0.94 -0.63 0.00 2.17 0.00 -0.95 -1.51 105.19 103.33 1ddm n GLY 192 Ca -0.00 -0.03 0.06 0.00 0.00 0.00 0.00 46.02 46.04 1ddm n GLY 192 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ddm h ALA 194 N 1.16 0.83 0.00 0.00 0.00 -1.09 -1.51 119.26 118.64 1ddm h ALA 194 Ca 0.00 0.04 -0.15 0.00 0.00 0.00 0.00 54.91 54.80 1ddm h ALA 194 Cb 0.45 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 1ddm h ALA 194 CO 0.00 -0.06 -0.72 0.27 0.00 0.00 0.00 179.25 178.73 1ddm h PHE 195 N 0.56 0.00 0.00 0.00 -0.00 -1.81 -2.71 116.94 112.97 1ddm h PHE 195 Ca 0.29 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 58.26 1ddm h PHE 195 Cb 0.26 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 36.21 1ddm h PHE 195 CO -0.11 0.72 0.00 0.00 -0.00 0.00 0.00 178.31 178.92 1ddm h ALA 196 N 1.28 1.00 0.00 12.09 0.00 -1.49 -1.68 119.26 130.45 1ddm h ALA 196 Ca -0.01 0.00 -0.19 0.00 0.00 0.00 0.00 54.91 54.71 1ddm h ALA 196 Cb 1.30 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 19.06 1ddm h ALA 196 CO 0.09 0.00 -1.86 0.28 0.00 0.00 0.00 179.25 177.77 1ddm n VAL 197 N -2.63 0.71 1.20 0.00 0.31 -1.11 -4.38 118.33 112.44 1ddm n VAL 197 Ca -0.02 -0.51 0.12 0.00 -0.01 0.00 0.00 64.34 63.91 1ddm n VAL 197 Cb 0.05 -0.46 0.62 0.00 -0.91 0.00 0.00 33.84 33.14 1ddm n VAL 197 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1ddm n LEU 199 N -1.22 0.03 -0.10 0.00 4.77 -0.91 -3.40 117.00 116.17 1ddm n LEU 199 Ca 0.13 0.51 -0.08 0.00 -0.03 0.00 0.00 56.01 56.53 1ddm n LEU 199 Cb 0.16 -0.50 -0.00 0.00 -2.33 0.00 0.00 43.42 40.75 1ddm n LEU 199 CO 0.17 -0.17 1.00 -0.33 -1.33 0.00 0.00 177.39 176.73 1ddm h GLU 200 N 0.00 0.40 -0.01 3.23 5.08 -1.83 -3.53 114.58 117.92 1ddm h GLU 200 Ca 0.00 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1ddm h GLU 200 Cb 0.35 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.51 1ddm h GLU 200 CO 0.00 0.27 0.00 0.54 -1.00 0.00 0.00 179.01 178.82