#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nzj s ALA 79 N 0.00 -1.86 -0.03 -5.12 0.00 -1.26 -5.01 121.76 108.48 2nzj s ALA 79 Ca 0.00 0.45 0.02 0.00 0.00 0.00 0.00 51.96 52.44 2nzj s ALA 79 Cb 0.00 0.50 0.01 0.00 0.00 0.00 0.00 23.12 23.63 2nzj s ALA 79 CO 0.00 -0.99 -0.10 -1.17 0.00 0.00 0.00 175.76 173.51 2nzj s LEU 80 N -2.87 1.73 0.02 0.00 0.20 -1.26 -1.00 118.68 115.52 2nzj s LEU 80 Ca 0.12 -0.21 0.03 0.00 0.69 0.00 0.00 54.13 54.76 2nzj s LEU 80 Cb 0.00 -0.61 -0.02 0.00 -0.43 0.00 0.00 46.19 45.14 2nzj s LEU 80 CO -0.01 0.06 -0.09 -0.31 -0.29 0.00 0.00 176.35 175.71 2nzj s TYR 81 N 0.31 0.77 -0.28 5.38 1.51 -0.58 -5.00 117.35 119.46 2nzj s TYR 81 Ca -0.05 -0.32 -0.14 0.00 -1.01 0.00 0.00 57.07 55.55 2nzj s TYR 81 Cb -0.10 -0.47 -0.04 0.00 -0.11 0.00 0.00 41.96 41.24 2nzj s TYR 81 CO 0.01 -0.02 0.34 0.50 -1.11 0.00 0.00 175.55 175.26 2nzj s ARG 82 N -0.95 3.94 -0.19 -0.62 3.52 -1.26 -0.85 118.95 122.54 2nzj s ARG 82 Ca -0.03 -0.09 -0.02 0.00 -0.13 0.00 0.00 55.73 55.46 2nzj s ARG 82 Cb -0.07 -3.68 -0.01 0.00 -1.56 0.00 0.00 34.95 29.64 2nzj s ARG 82 CO 0.00 -0.30 -0.08 0.08 -0.81 0.00 0.00 175.30 174.20 2nzj s VAL 83 N 2.01 3.20 -0.20 7.11 1.01 0.23 -0.07 120.40 133.69 2nzj s VAL 83 Ca 0.13 -0.57 -0.06 0.00 0.00 0.00 0.00 61.98 61.48 2nzj s VAL 83 Cb -0.16 -2.42 -0.03 0.00 0.00 0.00 0.00 36.38 33.77 2nzj s VAL 83 CO 0.10 0.46 0.03 -0.69 0.00 0.00 0.00 175.10 175.01 2nzj s VAL 84 N 1.11 4.31 -0.26 2.92 1.01 -0.37 -0.45 120.40 128.67 2nzj s VAL 84 Ca 0.01 -0.19 -0.20 0.00 0.00 0.00 0.00 61.98 61.60 2nzj s VAL 84 Cb -0.15 -2.96 -0.02 0.00 0.00 0.00 0.00 36.38 33.26 2nzj s VAL 84 CO -0.02 0.43 0.60 -0.76 0.00 0.00 0.00 175.10 175.35 2nzj s LEU 85 N 0.83 4.07 0.26 3.92 1.43 -0.31 -0.91 118.68 127.97 2nzj s LEU 85 Ca 0.02 0.62 0.11 0.00 -1.03 0.00 0.00 54.13 53.85 2nzj s LEU 85 Cb -0.14 -2.80 -0.05 0.00 0.03 0.00 0.00 46.19 43.23 2nzj s LEU 85 CO 0.02 -0.36 -0.16 -0.76 0.23 0.00 0.00 176.35 175.32 2nzj s LEU 86 N 2.47 2.72 0.00 1.79 1.43 0.08 -4.43 118.68 122.73 2nzj s LEU 86 Ca 0.25 -0.89 0.00 0.00 -1.03 0.00 0.00 54.13 52.45 2nzj s LEU 86 Cb -0.15 -1.28 0.00 0.00 0.03 0.00 0.00 46.19 44.79 2nzj s LEU 86 CO 0.09 0.05 0.00 0.61 0.23 0.00 0.00 176.35 177.33 2nzj n GLY 87 N -0.49 4.00 3.64 -3.19 0.00 -1.26 -0.34 105.19 107.55 2nzj n GLY 87 Ca -0.07 -1.43 -0.33 0.00 0.00 0.00 0.00 46.02 44.18 2nzj n GLY 87 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2nzj n ASP 88 N 0.00 0.41 -4.77 1.61 8.00 -1.26 -4.94 116.55 115.59 2nzj n ASP 88 Ca 0.00 0.54 -0.40 0.00 0.71 0.00 0.00 54.79 55.64 2nzj n ASP 88 Cb 0.00 -1.44 0.01 0.00 -0.02 0.00 0.00 41.12 39.66 2nzj n ASP 88 CO 0.00 0.00 0.00 -2.84 -0.39 0.00 0.00 177.20 173.97 2nzj s PRO 89 N -3.97 3.89 0.00 -0.24 0.02 -1.26 -3.34 135.00 130.10 2nzj s PRO 89 Ca 0.70 2.48 0.00 0.00 0.02 0.00 0.00 61.00 64.21 2nzj s PRO 89 Cb -0.28 -2.80 0.00 0.00 0.02 0.00 0.00 34.50 31.43 2nzj s PRO 89 CO 0.54 -0.68 0.00 0.41 -0.33 0.00 0.00 177.00 176.94 2nzj n GLY 90 N 0.53 0.87 0.15 0.52 0.00 -1.26 -4.93 105.19 101.07 2nzj n GLY 90 Ca 0.03 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.18 2nzj n GLY 90 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 2nzj h VAL 91 N 0.00 0.00 0.00 1.61 -1.51 -1.93 -3.47 116.25 110.95 2nzj h VAL 91 Ca 0.00 -0.69 0.00 0.00 -1.23 0.00 0.00 66.70 64.78 2nzj h VAL 91 Cb 0.00 1.69 0.00 0.00 -2.13 0.00 0.00 31.29 30.85 2nzj h VAL 91 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 176.95 2nzj n GLY 92 N 1.20 1.77 0.11 5.19 0.00 -1.26 -4.57 105.19 107.62 2nzj n GLY 92 Ca 0.05 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.94 2nzj n GLY 92 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2nzj h LYS 93 N 0.00 -0.16 -0.50 1.61 1.57 -1.91 -1.65 116.57 115.52 2nzj h LYS 93 Ca 0.00 0.01 -0.04 0.00 -1.87 0.00 0.00 60.65 58.75 2nzj h LYS 93 Cb 0.00 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.32 2nzj h LYS 93 CO 0.00 0.01 0.14 1.15 -0.57 0.00 0.00 179.45 180.18 2nzj h THR 94 N -0.31 1.21 -0.30 -0.16 2.02 -1.96 -1.59 112.91 111.82 2nzj h THR 94 Ca -0.02 -0.71 -0.02 0.00 0.77 0.00 0.00 66.41 66.43 2nzj h THR 94 Cb 0.25 0.67 -0.01 0.00 -1.74 0.00 0.00 68.15 67.32 2nzj h THR 94 CO 0.03 0.27 0.11 0.28 0.37 0.00 0.00 175.52 176.57 2nzj h SER 95 N 0.73 0.42 -0.87 4.18 0.02 -1.94 -0.72 113.55 115.36 2nzj h SER 95 Ca 0.17 -0.18 -0.00 0.00 -0.84 0.00 0.00 61.79 60.93 2nzj h SER 95 Cb 0.23 -0.11 -0.04 0.00 0.14 0.00 0.00 62.40 62.62 2nzj h SER 95 CO -0.01 0.48 0.53 -0.07 -1.14 0.00 0.00 176.83 176.63 2nzj h LEU 96 N 0.32 1.04 -0.72 5.07 3.38 -1.08 -2.03 115.31 121.31 2nzj h LEU 96 Ca 0.10 -0.06 -0.08 0.00 0.09 0.00 0.00 57.88 57.92 2nzj h LEU 96 Cb 0.20 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 2nzj h LEU 96 CO -0.01 0.80 0.04 0.00 0.09 0.00 0.00 178.44 179.36 2nzj h ALA 97 N 1.29 0.93 -0.45 1.53 0.00 -1.02 -1.71 119.26 119.82 2nzj h ALA 97 Ca 0.31 -0.29 -0.11 0.00 0.00 0.00 0.00 54.91 54.82 2nzj h ALA 97 Cb -0.06 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 2nzj h ALA 97 CO -0.06 0.65 -0.17 0.77 0.00 0.00 0.00 179.25 180.44 2nzj h SER 98 N 0.95 0.89 -0.58 0.00 0.02 -0.76 0.11 113.55 114.18 2nzj h SER 98 Ca 0.18 -0.30 -0.07 0.00 -0.84 0.00 0.00 61.79 60.75 2nzj h SER 98 Cb 0.49 -0.24 -0.03 0.00 0.14 0.00 0.00 62.40 62.76 2nzj h SER 98 CO 0.02 1.04 0.10 -0.07 -1.14 0.00 0.00 176.83 176.78 2nzj h LEU 99 N 0.77 0.95 -0.65 5.07 3.38 -1.29 -1.59 115.31 121.95 2nzj h LEU 99 Ca 0.11 -0.21 -0.04 0.00 0.09 0.00 0.00 57.88 57.83 2nzj h LEU 99 Cb 0.70 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.17 2nzj h LEU 99 CO 0.05 0.95 0.25 0.15 0.09 0.00 0.00 178.44 179.94 2nzj h PHE 100 N 0.94 1.00 0.00 1.13 3.57 -0.78 -2.59 116.94 120.22 2nzj h PHE 100 Ca 0.19 -0.08 -0.05 0.00 3.53 0.00 0.00 57.97 61.56 2nzj h PHE 100 Cb 0.41 -0.30 -0.01 0.00 2.79 0.00 0.00 35.95 38.84 2nzj h PHE 100 CO 0.03 0.79 -0.25 0.00 -2.23 0.00 0.00 178.31 176.65 2nzj h ALA 101 N 1.11 1.58 0.00 2.41 0.00 -0.53 -3.46 119.26 120.37 2nzj h ALA 101 Ca 0.22 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2nzj h ALA 101 Cb 0.22 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2nzj h ALA 101 CO -0.02 0.31 0.00 0.41 0.00 0.00 0.00 179.25 179.96 2nzj n GLY 102 N -0.81 -2.15 1.06 0.00 0.00 -0.62 -4.97 105.19 97.70 2nzj n GLY 102 Ca -0.02 -1.46 0.00 0.00 0.00 0.00 0.00 46.02 44.54 2nzj n GLY 102 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2nzj n LYS 103 N -0.26 0.00 0.00 1.61 2.85 -1.26 -4.87 118.16 116.23 2nzj n LYS 103 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 2nzj n LYS 103 Cb 0.00 -1.09 0.00 0.00 -0.65 0.00 0.00 35.03 33.29 2nzj n LYS 103 CO 0.00 0.00 0.00 1.58 -0.05 0.00 0.00 177.40 178.93 2nzj n HIS 109 N 0.74 0.00 0.32 5.58 -0.00 -1.26 -5.22 115.22 115.38 2nzj n HIS 109 Ca 0.00 0.00 0.14 0.00 -0.00 0.00 0.00 57.72 57.86 2nzj n HIS 109 Cb 0.00 0.00 0.48 0.00 -0.00 0.00 0.00 29.99 30.47 2nzj n HIS 109 CO 0.00 0.00 0.00 1.05 -0.00 0.00 0.00 176.34 177.39 2nzj h GLU 110 N 0.00 0.00 -6.28 1.57 9.09 -2.08 -3.45 114.58 113.43 2nzj h GLU 110 Ca 0.00 0.00 -0.55 0.00 0.05 0.00 0.00 59.36 58.86 2nzj h GLU 110 Cb 0.00 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.10 2nzj h GLU 110 CO 0.00 0.00 1.18 -0.65 0.05 0.00 0.00 179.01 179.59 2nzj s GLN 111 N -3.42 4.03 -0.10 1.06 -0.21 -1.26 -4.96 119.66 114.80 2nzj s GLN 111 Ca 0.04 2.25 -0.30 0.00 0.02 0.00 0.00 55.36 57.38 2nzj s GLN 111 Cb 0.08 -4.09 -0.04 0.00 1.00 0.00 0.00 33.01 29.97 2nzj s GLN 111 CO 0.56 -1.05 1.51 -1.17 -2.12 0.00 0.00 175.29 173.02 2nzj s LEU 112 N 4.69 4.27 0.00 2.90 2.96 -1.26 -4.75 118.68 127.48 2nzj s LEU 112 Ca 0.81 2.03 0.00 0.00 -0.22 0.00 0.00 54.13 56.75 2nzj s LEU 112 Cb -0.35 -3.54 0.00 0.00 0.50 0.00 0.00 46.19 42.80 2nzj s LEU 112 CO 0.34 -0.86 0.00 0.61 -1.32 0.00 0.00 176.35 175.12 2nzj n GLY 113 N 3.93 -2.24 0.01 7.98 0.00 -1.26 -5.03 105.19 108.58 2nzj n GLY 113 Ca 0.16 -1.41 -0.00 0.00 0.00 0.00 0.00 46.02 44.77 2nzj n GLY 113 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2nzj n GLU 114 N -1.37 3.19 -2.17 1.61 1.02 -1.26 -4.79 120.64 116.87 2nzj n GLU 114 Ca 0.00 -0.00 -0.34 0.00 -0.02 0.00 0.00 57.16 56.80 2nzj n GLU 114 Cb 0.00 -1.03 0.02 0.00 -0.02 0.00 0.00 31.44 30.41 2nzj n GLU 114 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2nzj n ASP 115 N -1.97 6.21 -3.86 1.62 8.00 -1.26 -4.93 116.55 120.35 2nzj n ASP 115 Ca -0.02 -3.78 -0.22 0.00 0.71 0.00 0.00 54.79 51.48 2nzj n ASP 115 Cb 0.46 -0.78 -0.17 0.00 -0.02 0.00 0.00 41.12 40.62 2nzj n ASP 115 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2nzj s VAL 116 N -5.29 0.56 -0.06 2.53 1.01 -1.26 -0.98 120.40 116.92 2nzj s VAL 116 Ca 0.50 -0.08 0.04 0.00 0.00 0.00 0.00 61.98 62.44 2nzj s VAL 116 Cb 0.42 -0.62 0.00 0.00 0.00 0.00 0.00 36.38 36.18 2nzj s VAL 116 CO -0.30 0.25 -0.17 -0.31 0.00 0.00 0.00 175.10 174.57 2nzj s TYR 117 N 1.28 1.78 -0.06 5.22 1.51 -0.42 -4.98 117.35 121.68 2nzj s TYR 117 Ca -0.05 -0.58 0.03 0.00 -1.01 0.00 0.00 57.07 55.46 2nzj s TYR 117 Cb -0.14 -1.22 0.00 0.00 -0.11 0.00 0.00 41.96 40.50 2nzj s TYR 117 CO -0.02 -0.23 -0.15 -1.21 -1.11 0.00 0.00 175.55 172.83 2nzj s GLU 118 N 0.23 1.80 -0.14 -0.62 0.41 -1.26 0.36 118.70 119.48 2nzj s GLU 118 Ca -0.09 -0.53 -0.23 0.00 -0.41 0.00 0.00 54.97 53.72 2nzj s GLU 118 Cb -0.13 -1.51 0.06 0.00 -1.78 0.00 0.00 34.13 30.76 2nzj s GLU 118 CO 0.04 0.14 0.57 0.50 -0.49 0.00 0.00 175.26 176.02 2nzj s ARG 119 N 0.33 0.80 -0.28 1.61 3.52 -0.82 -4.90 118.95 119.21 2nzj s ARG 119 Ca -0.10 0.48 -0.12 0.00 -0.13 0.00 0.00 55.73 55.86 2nzj s ARG 119 Cb -0.14 0.38 -0.04 0.00 -1.56 0.00 0.00 34.95 33.59 2nzj s ARG 119 CO 0.03 -0.18 0.26 0.99 -0.81 0.00 0.00 175.30 175.59 2nzj s THR 120 N -0.42 5.26 -0.06 4.11 2.01 -1.26 -1.53 115.64 123.76 2nzj s THR 120 Ca -0.06 0.25 -0.00 0.00 0.31 0.00 0.00 61.69 62.19 2nzj s THR 120 Cb -0.03 -3.61 -0.03 0.00 0.01 0.00 0.00 72.50 68.84 2nzj s THR 120 CO 0.04 0.19 -0.01 -0.76 -0.69 0.00 0.00 174.62 173.39 2nzj s LEU 121 N 1.86 3.50 -0.33 4.42 1.43 0.10 -4.87 118.68 124.79 2nzj s LEU 121 Ca 0.10 0.07 -0.15 0.00 -1.03 0.00 0.00 54.13 53.12 2nzj s LEU 121 Cb -0.16 -1.86 -0.02 0.00 0.03 0.00 0.00 46.19 44.18 2nzj s LEU 121 CO 0.11 0.35 0.36 -0.89 0.23 0.00 0.00 176.35 176.50 2nzj s THR 122 N -0.93 5.17 -0.02 5.49 2.01 -1.26 -0.86 115.64 125.24 2nzj s THR 122 Ca 0.15 0.12 0.01 0.00 0.31 0.00 0.00 61.69 62.29 2nzj s THR 122 Cb -0.11 -3.80 0.01 0.00 0.01 0.00 0.00 72.50 68.61 2nzj s THR 122 CO 0.05 -0.05 -0.05 -0.69 -0.69 0.00 0.00 174.62 173.19 2nzj s VAL 123 N 2.02 0.45 -1.62 3.82 1.01 -0.26 -4.79 120.40 121.03 2nzj s VAL 123 Ca 0.12 -0.16 -0.09 0.00 0.00 0.00 0.00 61.98 61.86 2nzj s VAL 123 Cb -0.16 -0.44 0.08 0.00 0.00 0.00 0.00 36.38 35.86 2nzj s VAL 123 CO 0.11 0.17 0.36 0.47 0.00 0.00 0.00 175.10 176.21 2nzj n ASP 124 N 3.49 -0.65 -0.10 3.32 8.00 -1.26 -0.92 116.55 128.43 2nzj n ASP 124 Ca -0.20 -1.17 -0.01 0.00 0.71 0.00 0.00 54.79 54.12 2nzj n ASP 124 Cb 0.54 -2.10 -0.01 0.00 -0.02 0.00 0.00 41.12 39.53 2nzj n ASP 124 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2nzj n GLY 125 N -1.92 0.42 2.96 0.44 0.00 -1.26 -4.99 105.19 100.83 2nzj n GLY 125 Ca -0.16 -0.11 -0.19 0.00 0.00 0.00 0.00 46.02 45.56 2nzj n GLY 125 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2nzj s GLU 126 N -1.07 0.76 0.19 1.61 2.12 -0.10 -5.12 118.70 117.09 2nzj s GLU 126 Ca 0.00 -0.21 -0.18 0.00 0.36 0.00 0.00 54.97 54.95 2nzj s GLU 126 Cb 0.00 -0.74 -0.08 0.00 0.26 0.00 0.00 34.13 33.57 2nzj s GLU 126 CO 0.00 0.06 0.65 -0.51 -0.54 0.00 0.00 175.26 174.91 2nzj s ASP 127 N 0.32 6.97 -0.16 -1.70 -0.00 -1.26 -1.10 116.67 119.74 2nzj s ASP 127 Ca -0.04 1.28 -0.12 0.00 -0.00 0.00 0.00 52.55 53.67 2nzj s ASP 127 Cb -0.09 -2.37 0.05 0.00 -0.00 0.00 0.00 42.92 40.52 2nzj s ASP 127 CO 0.00 0.07 0.40 -0.89 -0.00 0.00 0.00 175.17 174.76 2nzj s THR 128 N -1.48 -0.01 -0.14 -1.27 2.01 -0.04 -3.07 115.64 111.65 2nzj s THR 128 Ca 0.40 0.05 -0.13 0.00 0.31 0.00 0.00 61.69 62.32 2nzj s THR 128 Cb -0.16 -0.58 -0.05 0.00 0.01 0.00 0.00 72.50 71.72 2nzj s THR 128 CO 0.20 0.02 0.28 -0.89 -0.69 0.00 0.00 174.62 173.54 2nzj s THR 129 N 0.80 5.30 -0.06 -0.82 2.01 -0.17 0.01 115.64 122.71 2nzj s THR 129 Ca -0.05 0.53 0.03 0.00 0.31 0.00 0.00 61.69 62.51 2nzj s THR 129 Cb -0.06 -3.61 -0.02 0.00 0.01 0.00 0.00 72.50 68.82 2nzj s THR 129 CO -0.06 0.44 -0.13 -0.76 -0.69 0.00 0.00 174.62 173.42 2nzj s LEU 130 N 0.14 2.80 -0.31 4.42 1.43 -0.58 -1.53 118.68 125.04 2nzj s LEU 130 Ca 0.17 -0.19 -0.08 0.00 -1.03 0.00 0.00 54.13 53.00 2nzj s LEU 130 Cb -0.13 -1.58 0.01 0.00 0.03 0.00 0.00 46.19 44.52 2nzj s LEU 130 CO 0.05 0.32 0.11 -0.69 0.23 0.00 0.00 176.35 176.37 2nzj s VAL 131 N -0.58 4.12 -0.28 -1.59 1.01 -0.03 -1.94 120.40 121.11 2nzj s VAL 131 Ca 0.08 -0.73 -0.12 0.00 0.00 0.00 0.00 61.98 61.21 2nzj s VAL 131 Cb -0.11 -3.17 -0.05 0.00 0.00 0.00 0.00 36.38 33.05 2nzj s VAL 131 CO 0.01 0.00 0.22 -0.69 0.00 0.00 0.00 175.10 174.65 2nzj s VAL 132 N 1.51 5.29 -0.19 2.92 1.01 0.16 -0.61 120.40 130.49 2nzj s VAL 132 Ca 0.02 0.25 -0.10 0.00 0.00 0.00 0.00 61.98 62.15 2nzj s VAL 132 Cb -0.18 -3.56 -0.05 0.00 0.00 0.00 0.00 36.38 32.59 2nzj s VAL 132 CO 0.04 0.24 0.15 -0.69 0.00 0.00 0.00 175.10 174.84 2nzj s VAL 133 N 1.78 5.40 -0.45 2.92 1.01 0.40 -1.31 120.40 130.16 2nzj s VAL 133 Ca 0.09 0.24 0.09 0.00 0.00 0.00 0.00 61.98 62.40 2nzj s VAL 133 Cb -0.16 -3.49 0.36 0.00 0.00 0.00 0.00 36.38 33.10 2nzj s VAL 133 CO 0.10 0.45 0.87 -0.67 0.00 0.00 0.00 175.10 175.85 2nzj n ASP 134 N 3.39 2.59 -0.06 3.32 2.03 -0.15 -1.16 116.55 126.50 2nzj n ASP 134 Ca -0.16 -3.29 0.01 0.00 0.52 0.00 0.00 54.79 51.86 2nzj n ASP 134 Cb 0.52 -0.58 0.01 0.00 -0.72 0.00 0.00 41.12 40.36 2nzj n ASP 134 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 2nzj n THR 135 N -0.02 0.68 -2.02 5.18 -2.24 -1.26 -4.82 114.28 109.78 2nzj n THR 135 Ca 0.27 -0.84 -0.39 0.00 -2.27 0.00 0.00 64.05 60.81 2nzj n THR 135 Cb 0.58 0.67 -0.03 0.00 -2.10 0.00 0.00 70.33 69.44 2nzj n THR 135 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 2nzj s TRP 136 N -0.71 1.69 0.00 4.78 -0.11 -1.26 -5.07 118.94 118.25 2nzj s TRP 136 Ca 0.02 0.79 0.00 0.00 1.22 0.00 0.00 56.10 58.13 2nzj s TRP 136 Cb 0.01 -4.08 0.00 0.00 -1.50 0.00 0.00 33.47 27.90 2nzj s TRP 136 CO 0.02 -2.43 0.00 0.45 -4.62 0.00 0.00 176.95 170.37 2nzj n SER 144 N 12.29 -0.27 -0.22 5.86 2.88 -1.26 -4.95 113.62 127.96 2nzj n SER 144 Ca 0.21 0.00 -0.08 0.00 -1.33 0.00 0.00 58.87 57.67 2nzj n SER 144 Cb 0.51 0.13 0.03 0.00 -0.75 0.00 0.00 64.21 64.13 2nzj n SER 144 CO 0.00 0.00 0.00 -0.25 -1.23 0.00 0.00 175.04 173.56 2nzj h TRP 145 N 0.00 1.07 -0.21 0.66 7.01 -2.05 -1.14 115.95 121.29 2nzj h TRP 145 Ca 0.00 -0.15 -0.14 0.00 2.11 0.00 0.00 58.89 60.71 2nzj h TRP 145 Cb 0.00 -0.29 -0.01 0.00 -2.10 0.00 0.00 29.16 26.76 2nzj h TRP 145 CO 0.00 0.92 -0.45 0.66 -2.79 0.00 0.00 178.44 176.77 2nzj h SER 146 N 0.91 0.57 -0.50 2.65 4.64 -2.04 -0.59 113.55 119.18 2nzj h SER 146 Ca 0.19 -0.27 -0.06 0.00 -0.47 0.00 0.00 61.79 61.17 2nzj h SER 146 Cb 0.42 -0.16 -0.02 0.00 -0.31 0.00 0.00 62.40 62.33 2nzj h SER 146 CO 0.01 0.94 0.07 1.56 -0.87 0.00 0.00 176.83 178.54 2nzj h GLN 147 N 0.43 0.84 -0.16 4.77 4.20 -1.94 -0.51 115.11 122.74 2nzj h GLN 147 Ca 0.03 -0.23 -0.02 0.00 0.06 0.00 0.00 58.65 58.49 2nzj h GLN 147 Cb 0.96 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.64 2nzj h GLN 147 CO 0.09 0.84 0.03 0.93 -0.67 0.00 0.00 178.83 180.05 2nzj h GLU 148 N 0.72 0.26 0.00 1.46 3.07 -1.09 -3.22 114.58 115.79 2nzj h GLU 148 Ca 0.15 -0.07 -0.03 0.00 -0.50 0.00 0.00 59.36 58.92 2nzj h GLU 148 Cb 0.41 -0.03 -0.00 0.00 -0.84 0.00 0.00 28.75 28.29 2nzj h GLU 148 CO 0.01 0.42 -0.13 0.66 -1.40 0.00 0.00 179.01 178.57 2nzj h SER 149 N 0.06 0.00 -0.86 1.42 4.64 -1.04 -3.36 113.55 114.40 2nzj h SER 149 Ca 0.05 0.00 0.21 0.00 -0.47 0.00 0.00 61.79 61.58 2nzj h SER 149 Cb 0.28 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 62.25 2nzj h SER 149 CO 0.00 0.13 0.33 0.00 -0.87 0.00 0.00 176.83 176.42 2nzj n LEU 151 N -5.09 1.45 -0.01 0.00 4.77 -1.26 -3.91 117.00 112.96 2nzj n LEU 151 Ca 0.20 -0.58 0.03 0.00 -0.03 0.00 0.00 56.01 55.63 2nzj n LEU 151 Cb 0.61 -0.08 -0.06 0.00 -2.33 0.00 0.00 43.42 41.57 2nzj n LEU 151 CO 0.12 0.29 -0.60 0.00 -1.33 0.00 0.00 177.39 175.87 2nzj n GLN 152 N 0.17 0.57 0.03 3.23 6.02 -0.13 -4.73 117.38 122.54 2nzj n GLN 152 Ca 0.17 -0.06 0.12 0.00 -0.01 0.00 0.00 57.00 57.22 2nzj n GLN 152 Cb 0.30 -1.17 0.21 0.00 1.02 0.00 0.00 30.24 30.60 2nzj n GLN 152 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2nzj n GLY 153 N 2.16 -1.35 3.76 1.08 0.00 -0.80 -4.96 105.19 105.08 2nzj n GLY 153 Ca -0.03 -0.29 -0.39 0.00 0.00 0.00 0.00 46.02 45.32 2nzj n GLY 153 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2nzj s GLY 154 N -3.40 3.00 0.17 -0.02 0.00 -1.26 -4.89 107.32 100.93 2nzj s GLY 154 Ca 0.08 0.72 0.08 0.00 0.00 0.00 0.00 44.72 45.60 2nzj s GLY 154 CO 0.71 1.26 1.38 1.76 0.00 0.00 0.00 173.10 178.21 2nzj h SER 155 N 3.65 0.01 -5.02 1.64 0.02 -0.85 -3.47 113.55 109.52 2nzj h SER 155 Ca -0.46 -0.01 -0.08 0.00 -0.84 0.00 0.00 61.79 60.39 2nzj h SER 155 Cb 1.20 -0.00 -0.18 0.00 0.14 0.00 0.00 62.40 63.57 2nzj h SER 155 CO 0.66 0.89 -0.12 0.00 -1.14 0.00 0.00 176.83 177.12 2nzj s ALA 156 N -2.99 -1.03 -0.07 3.77 0.00 -1.04 -4.15 121.76 116.26 2nzj s ALA 156 Ca 0.00 0.40 0.04 0.00 0.00 0.00 0.00 51.96 52.40 2nzj s ALA 156 Cb 0.11 0.25 0.00 0.00 0.00 0.00 0.00 23.12 23.48 2nzj s ALA 156 CO 0.80 -0.40 -0.18 0.71 0.00 0.00 0.00 175.76 176.69 2nzj s TYR 157 N -2.10 1.91 -0.37 0.00 1.51 -0.78 -1.24 117.35 116.27 2nzj s TYR 157 Ca -0.08 -0.68 -0.06 0.00 -1.01 0.00 0.00 57.07 55.24 2nzj s TYR 157 Cb -0.02 -1.31 0.07 0.00 -0.11 0.00 0.00 41.96 40.59 2nzj s TYR 157 CO 0.00 -0.28 0.16 0.08 -1.11 0.00 0.00 175.55 174.40 2nzj s VAL 158 N 0.33 3.72 -0.42 0.71 1.01 -0.09 -1.05 120.40 124.61 2nzj s VAL 158 Ca -0.12 -1.43 -0.20 0.00 0.00 0.00 0.00 61.98 60.23 2nzj s VAL 158 Cb -0.15 -3.25 0.02 0.00 0.00 0.00 0.00 36.38 33.00 2nzj s VAL 158 CO 0.05 -0.38 0.61 -0.63 0.00 0.00 0.00 175.10 174.76 2nzj s ILE 159 N 1.34 4.87 -0.14 2.22 1.01 -0.22 -0.74 121.20 129.54 2nzj s ILE 159 Ca 0.01 0.14 -0.06 0.00 0.00 0.00 0.00 60.65 60.74 2nzj s ILE 159 Cb -0.21 -4.16 -0.04 0.00 0.01 0.00 0.00 42.46 38.06 2nzj s ILE 159 CO 0.01 -0.52 0.08 -0.69 0.00 0.00 0.00 174.94 173.82 2nzj s VAL 160 N 2.71 4.97 0.28 2.92 1.01 0.54 -0.75 120.40 132.08 2nzj s VAL 160 Ca 0.22 0.02 0.04 0.00 0.00 0.00 0.00 61.98 62.25 2nzj s VAL 160 Cb -0.14 -3.18 -0.06 0.00 0.00 0.00 0.00 36.38 32.99 2nzj s VAL 160 CO 0.18 0.54 0.03 -0.72 0.00 0.00 0.00 175.10 175.13 2nzj s TYR 161 N -0.36 1.76 -0.22 5.22 1.13 0.11 -4.33 117.35 120.66 2nzj s TYR 161 Ca 0.10 -0.96 -0.10 0.00 -1.41 0.00 0.00 57.07 54.70 2nzj s TYR 161 Cb -0.12 -1.08 -0.05 0.00 -1.10 0.00 0.00 41.96 39.61 2nzj s TYR 161 CO 0.02 -0.04 0.14 0.45 -2.51 0.00 0.00 175.55 173.61 2nzj s SER 162 N -3.40 6.14 0.41 -0.18 0.15 -1.26 -0.20 113.70 115.37 2nzj s SER 162 Ca 0.33 0.17 0.28 0.00 0.70 0.00 0.00 55.95 57.43 2nzj s SER 162 Cb 0.07 -2.09 1.48 0.00 -1.71 0.00 0.00 66.02 63.77 2nzj s SER 162 CO 0.13 0.13 1.85 0.16 1.20 0.00 0.00 173.24 176.71 2nzj h ILE 163 N 4.83 0.00 -0.24 6.45 3.07 -1.63 -1.58 117.51 128.42 2nzj h ILE 163 Ca -0.40 -0.03 0.00 0.00 1.55 0.00 0.00 64.86 65.98 2nzj h ILE 163 Cb 1.16 0.67 0.00 0.00 -0.27 0.00 0.00 36.82 38.38 2nzj h ILE 163 CO 0.71 0.00 0.00 0.00 -1.05 0.00 0.00 178.15 177.81 2nzj n ALA 164 N -1.86 2.48 -3.49 0.16 0.00 -1.26 -0.37 120.51 116.17 2nzj n ALA 164 Ca -0.01 -0.70 -0.28 0.00 0.00 0.00 0.00 53.44 52.45 2nzj n ALA 164 Cb 0.07 -1.00 -0.13 0.00 0.00 0.00 0.00 19.45 18.38 2nzj n ALA 164 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2nzj s ASP 165 N -1.56 3.08 0.27 0.00 2.15 -0.59 -4.61 116.67 115.41 2nzj s ASP 165 Ca 0.34 -1.71 -0.04 0.00 0.43 0.00 0.00 52.55 51.58 2nzj s ASP 165 Cb 0.19 -0.30 0.55 0.00 -0.30 0.00 0.00 42.92 43.06 2nzj s ASP 165 CO 0.28 -0.37 1.63 -0.09 -0.17 0.00 0.00 175.17 176.45 2nzj h ARG 166 N 7.68 0.11 -0.83 4.34 9.65 -1.87 -1.49 114.38 131.98 2nzj h ARG 166 Ca -0.06 -0.01 0.16 0.00 -1.10 0.00 0.00 59.98 58.97 2nzj h ARG 166 Cb 1.00 -0.03 -0.10 0.00 -1.39 0.00 0.00 29.97 29.45 2nzj h ARG 166 CO 0.34 0.07 0.38 0.78 2.80 0.00 0.00 179.97 184.35 2nzj h GLY 167 N 0.12 1.33 1.69 2.80 0.00 -1.95 -0.93 103.07 106.13 2nzj h GLY 167 Ca 0.47 -0.20 -0.10 0.00 0.00 0.00 0.00 47.33 47.50 2nzj h GLY 167 CO -0.71 -0.10 -0.33 1.48 0.00 0.00 0.00 176.54 176.88 2nzj h SER 168 N 0.52 0.36 -0.32 0.19 4.64 -1.60 -1.66 113.55 115.68 2nzj h SER 168 Ca 0.47 -0.14 -0.12 0.00 -0.47 0.00 0.00 61.79 61.53 2nzj h SER 168 Cb 0.73 -0.10 -0.01 0.00 -0.31 0.00 0.00 62.40 62.71 2nzj h SER 168 CO -0.41 0.68 -0.28 0.15 -0.87 0.00 0.00 176.83 176.10 2nzj h PHE 169 N 0.31 0.90 -0.51 4.77 3.57 -1.17 -1.68 116.94 123.12 2nzj h PHE 169 Ca 0.04 -0.26 0.00 0.00 3.53 0.00 0.00 57.97 61.28 2nzj h PHE 169 Cb 0.74 -0.19 -0.02 0.00 2.79 0.00 0.00 35.95 39.26 2nzj h PHE 169 CO 0.02 1.02 0.33 0.93 -2.23 0.00 0.00 178.31 178.37 2nzj h GLU 170 N 0.52 0.67 0.00 1.11 5.08 -0.93 -2.22 114.58 118.81 2nzj h GLU 170 Ca 0.06 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 2nzj h GLU 170 Cb 0.85 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.95 2nzj h GLU 170 CO 0.07 0.46 0.00 0.66 -1.00 0.00 0.00 179.01 179.20 2nzj h SER 171 N 0.68 0.00 0.18 1.42 4.64 -1.27 -2.39 113.55 116.82 2nzj h SER 171 Ca 0.18 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 61.51 2nzj h SER 171 Cb -0.06 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.01 2nzj h SER 171 CO -0.04 0.00 -0.22 0.00 -0.87 0.00 0.00 176.83 175.71 2nzj h ALA 172 N 2.24 -0.42 -0.90 5.18 0.00 -0.67 -2.17 119.26 122.52 2nzj h ALA 172 Ca 0.00 -0.05 0.17 0.00 0.00 0.00 0.00 54.91 55.03 2nzj h ALA 172 Cb 0.67 0.32 -0.10 0.00 0.00 0.00 0.00 17.79 18.68 2nzj h ALA 172 CO 0.00 -0.77 0.47 0.77 0.00 0.00 0.00 179.25 179.73 2nzj h SER 173 N -0.45 0.55 -0.31 0.00 0.02 -1.28 -0.43 113.55 111.65 2nzj h SER 173 Ca 0.01 0.11 -0.03 0.00 -0.84 0.00 0.00 61.79 61.03 2nzj h SER 173 Cb 0.43 0.02 -0.02 0.00 0.14 0.00 0.00 62.40 62.97 2nzj h SER 173 CO -0.07 0.19 0.11 -0.08 -1.14 0.00 0.00 176.83 175.83 2nzj h GLU 174 N 0.61 0.55 -0.18 3.45 4.81 -1.32 -2.88 114.58 119.63 2nzj h GLU 174 Ca 0.52 -0.09 -0.12 0.00 -0.13 0.00 0.00 59.36 59.54 2nzj h GLU 174 Cb 0.81 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 30.08 2nzj h GLU 174 CO -0.40 0.50 -0.42 -0.07 -0.73 0.00 0.00 179.01 177.89 2nzj h LEU 175 N 0.55 0.45 -0.72 1.64 3.38 -0.44 -2.10 115.31 118.07 2nzj h LEU 175 Ca 0.13 -0.20 -0.06 0.00 0.09 0.00 0.00 57.88 57.85 2nzj h LEU 175 Cb 0.19 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.78 2nzj h LEU 175 CO -0.01 0.82 0.23 -0.09 0.09 0.00 0.00 178.44 179.48 2nzj h ARG 176 N 0.35 1.11 -0.56 1.13 9.65 -1.28 -1.21 114.38 123.57 2nzj h ARG 176 Ca 0.03 -0.23 -0.09 0.00 -1.10 0.00 0.00 59.98 58.59 2nzj h ARG 176 Cb 0.88 -0.16 -0.02 0.00 -1.39 0.00 0.00 29.97 29.28 2nzj h ARG 176 CO 0.07 0.95 -0.01 0.82 2.80 0.00 0.00 179.97 184.60 2nzj h ILE 177 N 1.06 1.26 -0.10 1.20 2.04 -1.46 0.20 117.51 121.70 2nzj h ILE 177 Ca 0.23 -1.12 0.00 0.00 1.00 0.00 0.00 64.86 64.97 2nzj h ILE 177 Cb 0.29 0.84 -0.01 0.00 -0.74 0.00 0.00 36.82 37.20 2nzj h ILE 177 CO -0.01 0.40 0.06 1.56 0.00 0.00 0.00 178.15 180.17 2nzj h GLN 178 N 0.89 0.13 -1.00 2.37 4.20 -0.97 -1.52 115.11 119.21 2nzj h GLN 178 Ca 0.16 -0.01 0.10 0.00 0.06 0.00 0.00 58.65 58.96 2nzj h GLN 178 Cb 0.54 -0.03 -0.08 0.00 0.30 0.00 0.00 27.48 28.21 2nzj h GLN 178 CO 0.03 0.08 0.64 -0.07 -0.67 0.00 0.00 178.83 178.84 2nzj h LEU 179 N 0.13 0.96 0.40 1.46 3.38 -0.81 -2.62 115.31 118.22 2nzj h LEU 179 Ca 0.04 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 2nzj h LEU 179 Cb -0.01 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.58 2nzj h LEU 179 CO -0.02 0.56 -0.19 -0.09 0.09 0.00 0.00 178.44 178.79 2nzj h ARG 180 N 1.06 -0.52 -0.74 1.13 2.43 -0.53 -3.09 114.38 114.12 2nzj h ARG 180 Ca 0.47 0.04 0.22 0.00 -0.81 0.00 0.00 59.98 59.89 2nzj h ARG 180 Cb 0.36 0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 30.00 2nzj h ARG 180 CO -0.22 -0.29 0.64 0.00 -1.51 0.00 0.00 179.97 178.59 2nzj h ARG 181 N -0.64 0.00 0.07 0.20 3.08 -0.91 -3.51 114.38 112.66 2nzj h ARG 181 Ca -0.05 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 59.99 2nzj h ARG 181 Cb 0.47 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.52 2nzj h ARG 181 CO 0.09 0.00 -0.03 1.79 -1.07 0.00 0.00 179.97 180.75 2nzj h THR 182 N 0.00 0.00 -2.51 2.04 1.35 -1.44 -3.52 112.91 108.83 2nzj h THR 182 Ca 0.35 -0.44 -0.32 0.00 -0.55 0.00 0.00 66.41 65.46 2nzj h THR 182 Cb 1.62 0.00 -0.00 0.00 -1.73 0.00 0.00 68.15 68.04 2nzj h THR 182 CO -0.00 0.00 -0.42 0.00 -0.25 0.00 0.00 175.52 174.85 2nzj n HIS 187 N -3.45 -0.90 -3.78 4.73 1.44 -1.26 -5.02 115.22 106.97 2nzj n HIS 187 Ca -0.01 0.08 -0.14 0.00 -2.01 0.00 0.00 57.72 55.64 2nzj n HIS 187 Cb 0.04 -3.35 -0.15 0.00 0.12 0.00 0.00 29.99 26.65 2nzj n HIS 187 CO 0.00 0.00 0.00 0.54 -2.81 0.00 0.00 176.34 174.07 2nzj s VAL 188 N -2.84 -0.04 0.28 0.61 0.11 -1.26 -5.11 120.40 112.14 2nzj s VAL 188 Ca 0.05 0.16 -0.30 0.00 -2.93 0.00 0.00 61.98 58.95 2nzj s VAL 188 Cb -0.02 -0.15 -0.12 0.00 -1.53 0.00 0.00 36.38 34.56 2nzj s VAL 188 CO 0.06 0.06 1.60 -2.65 -3.33 0.00 0.00 175.10 170.84 2nzj n PRO 189 N 3.96 2.66 -4.42 1.54 -0.02 -1.26 -4.91 135.00 132.56 2nzj n PRO 189 Ca -0.24 0.95 -0.28 0.00 -2.02 0.00 0.00 63.50 61.91 2nzj n PRO 189 Cb 0.53 -2.73 -0.17 0.00 -0.02 0.00 0.00 33.50 31.11 2nzj n PRO 189 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2nzj s ILE 190 N 0.15 1.39 -0.20 4.25 1.01 -1.26 -1.87 121.20 124.67 2nzj s ILE 190 Ca 0.66 -0.58 -0.04 0.00 0.00 0.00 0.00 60.65 60.69 2nzj s ILE 190 Cb -0.51 -1.28 -0.02 0.00 0.01 0.00 0.00 42.46 40.66 2nzj s ILE 190 CO 0.46 0.42 -0.02 -0.63 0.00 0.00 0.00 174.94 175.17 2nzj s ILE 191 N 1.01 3.76 -0.23 2.92 -1.09 -0.22 -2.02 121.20 125.33 2nzj s ILE 191 Ca -0.07 -0.38 -0.20 0.00 -2.23 0.00 0.00 60.65 57.78 2nzj s ILE 191 Cb -0.15 -2.69 -0.03 0.00 -1.58 0.00 0.00 42.46 38.02 2nzj s ILE 191 CO -0.01 0.44 0.58 -0.22 -1.23 0.00 0.00 174.94 174.50 2nzj s LEU 192 N 1.02 4.10 -0.17 2.97 2.96 0.34 -1.05 118.68 128.85 2nzj s LEU 192 Ca 0.01 0.70 0.00 0.00 -0.22 0.00 0.00 54.13 54.63 2nzj s LEU 192 Cb -0.14 -2.80 0.00 0.00 0.50 0.00 0.00 46.19 43.75 2nzj s LEU 192 CO 0.01 -0.28 -0.15 -0.69 -1.32 0.00 0.00 176.35 173.91 2nzj s VAL 193 N 2.10 2.58 -0.64 1.68 1.01 0.07 -2.26 120.40 124.94 2nzj s VAL 193 Ca 0.26 -0.79 -0.18 0.00 0.00 0.00 0.00 61.98 61.27 2nzj s VAL 193 Cb -0.16 -2.10 0.12 0.00 0.00 0.00 0.00 36.38 34.25 2nzj s VAL 193 CO 0.09 0.51 0.72 -0.83 0.00 0.00 0.00 175.10 175.60 2nzj s GLY 194 N 0.98 1.90 0.58 4.51 0.00 -0.36 -0.72 107.32 114.22 2nzj s GLY 194 Ca -0.02 -2.41 -0.02 0.00 0.00 0.00 0.00 44.72 42.27 2nzj s GLY 194 CO -0.03 1.55 0.84 0.21 0.00 0.00 0.00 173.10 175.66 2nzj s ASN 195 N 3.49 5.26 -1.03 1.64 2.47 0.72 -1.21 114.94 126.28 2nzj s ASN 195 Ca 0.13 0.23 -0.02 0.00 0.42 0.00 0.00 52.86 53.61 2nzj s ASN 195 Cb -0.22 -1.11 0.00 0.00 -1.45 0.00 0.00 41.25 38.47 2nzj s ASN 195 CO 0.03 -1.20 0.28 0.29 -3.72 0.00 0.00 177.10 172.79 2nzj n LYS 196 N -2.49 -2.57 0.18 0.43 5.02 -0.96 -1.75 118.16 116.03 2nzj n LYS 196 Ca 0.07 0.60 0.18 0.00 -2.02 0.00 0.00 58.31 57.14 2nzj n LYS 196 Cb 0.59 -4.80 0.81 0.00 -0.02 0.00 0.00 35.03 31.62 2nzj n LYS 196 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2nzj h ALA 197 N 0.64 1.87 0.00 7.82 0.00 -1.50 -1.23 119.26 126.85 2nzj h ALA 197 Ca -0.33 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.57 2nzj h ALA 197 Cb 1.23 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.04 2nzj h ALA 197 CO 0.37 -0.39 0.00 0.38 0.00 0.00 0.00 179.25 179.61 2nzj h ASP 198 N 0.00 0.00 -0.44 0.00 3.04 -1.91 -3.21 116.42 113.89 2nzj h ASP 198 Ca 0.11 0.00 -0.31 0.00 -3.24 0.00 0.00 57.03 53.59 2nzj h ASP 198 Cb 0.65 0.00 -0.11 0.00 -1.04 0.00 0.00 39.33 38.82 2nzj h ASP 198 CO -0.00 0.00 -0.04 0.18 -2.04 0.00 0.00 179.24 177.34 2nzj n LEU 199 N -2.98 5.78 0.29 0.15 4.77 -0.47 -4.63 117.00 119.90 2nzj n LEU 199 Ca 0.00 -3.51 0.19 0.00 -0.03 0.00 0.00 56.01 52.66 2nzj n LEU 199 Cb 0.26 -1.32 0.90 0.00 -2.33 0.00 0.00 43.42 40.92 2nzj n LEU 199 CO 0.25 1.67 1.06 0.00 -1.33 0.00 0.00 177.39 179.04 2nzj h ALA 200 N 2.88 1.00 0.00 -1.18 0.00 -1.80 -0.01 119.26 120.15 2nzj h ALA 200 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.18 2nzj h ALA 200 Cb 1.16 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.95 2nzj h ALA 200 CO 0.50 0.00 -0.62 0.07 0.00 0.00 0.00 179.25 179.20 2nzj h ARG 201 N 0.00 0.00 -0.01 0.00 -0.00 -1.91 -3.35 114.38 109.11 2nzj h ARG 201 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.98 59.98 2nzj h ARG 201 Cb 0.25 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 30.22 2nzj h ARG 201 CO 0.00 0.00 -0.65 0.00 -0.00 0.00 0.00 179.97 179.32 2nzj n ARG 203 N -0.95 0.00 -0.01 0.00 0.63 -0.97 -4.55 116.66 110.81 2nzj n ARG 203 Ca 0.07 0.00 0.04 0.00 -0.92 0.00 0.00 57.85 57.04 2nzj n ARG 203 Cb 0.37 -0.69 -0.08 0.00 0.45 0.00 0.00 32.46 32.51 2nzj n ARG 203 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 2nzj n GLU 204 N 2.51 0.57 -4.09 -0.14 1.02 0.50 -4.95 120.64 116.06 2nzj n GLU 204 Ca 0.19 -0.09 -0.33 0.00 -0.02 0.00 0.00 57.16 56.90 2nzj n GLU 204 Cb -0.02 -1.26 -0.16 0.00 -0.02 0.00 0.00 31.44 29.98 2nzj n GLU 204 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2nzj s VAL 205 N -2.70 2.39 0.78 2.62 1.01 -0.47 -4.85 120.40 119.18 2nzj s VAL 205 Ca -0.04 -0.83 -0.11 0.00 0.00 0.00 0.00 61.98 61.00 2nzj s VAL 205 Cb 0.07 -2.03 0.06 0.00 0.00 0.00 0.00 36.38 34.48 2nzj s VAL 205 CO 0.45 0.51 1.08 -0.94 0.00 0.00 0.00 175.10 176.21 2nzj s SER 206 N 1.32 4.53 0.22 3.32 1.04 -1.26 -4.90 113.70 117.98 2nzj s SER 206 Ca 0.05 1.65 -0.08 0.00 0.48 0.00 0.00 55.95 58.05 2nzj s SER 206 Cb -0.13 -2.39 0.22 0.00 0.10 0.00 0.00 66.02 63.81 2nzj s SER 206 CO -0.10 -1.99 1.88 0.58 0.98 0.00 0.00 173.24 174.59 2nzj h VAL 207 N -1.10 1.16 -0.38 5.02 2.07 -1.99 -2.25 116.25 118.77 2nzj h VAL 207 Ca -0.45 -0.36 -0.04 0.00 0.82 0.00 0.00 66.70 66.67 2nzj h VAL 207 Cb 1.24 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.99 2nzj h VAL 207 CO 0.54 0.19 0.09 -0.33 0.02 0.00 0.00 177.57 178.08 2nzj h GLU 208 N 1.06 0.56 -0.32 1.57 3.07 -1.99 -0.80 114.58 117.73 2nzj h GLU 208 Ca 0.32 -0.09 -0.15 0.00 -0.50 0.00 0.00 59.36 58.93 2nzj h GLU 208 Cb -0.04 -0.09 -0.00 0.00 -0.84 0.00 0.00 28.75 27.77 2nzj h GLU 208 CO -0.10 0.52 -0.40 0.93 -1.40 0.00 0.00 179.01 178.57 2nzj h GLU 209 N 0.55 0.83 -0.61 2.33 5.08 -1.81 -0.99 114.58 119.95 2nzj h GLU 209 Ca 0.13 -0.47 -0.00 0.00 -1.00 0.00 0.00 59.36 58.01 2nzj h GLU 209 Cb 0.22 0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.47 2nzj h GLU 209 CO -0.00 1.10 0.37 0.78 -1.00 0.00 0.00 179.01 180.26 2nzj h GLY 210 N 0.61 0.89 0.84 -3.84 0.00 -1.02 -2.32 103.07 98.23 2nzj h GLY 210 Ca 0.04 -0.38 -0.01 0.00 0.00 0.00 0.00 47.33 46.98 2nzj h GLY 210 CO 0.09 0.36 0.04 3.21 0.00 0.00 0.00 176.54 180.25 2nzj h ARG 211 N 0.83 0.25 -1.00 4.80 3.08 -1.02 -2.54 114.38 118.77 2nzj h ARG 211 Ca 0.22 -0.06 0.13 0.00 0.07 0.00 0.00 59.98 60.34 2nzj h ARG 211 Cb -0.01 -0.03 -0.09 0.00 0.08 0.00 0.00 29.97 29.92 2nzj h ARG 211 CO -0.04 0.39 0.63 0.00 -1.07 0.00 0.00 179.97 179.88 2nzj h ALA 212 N 0.85 1.53 -0.40 0.04 0.00 -1.13 -1.41 119.26 118.74 2nzj h ALA 212 Ca 0.05 0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.88 2nzj h ALA 212 Cb 0.25 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 2nzj h ALA 212 CO -0.00 0.20 -0.17 0.00 0.00 0.00 0.00 179.25 179.28 2nzj h ALA 214 N 1.13 0.67 -0.69 0.00 0.00 -0.94 0.67 119.26 120.10 2nzj h ALA 214 Ca 0.10 -0.31 0.04 0.00 0.00 0.00 0.00 54.91 54.75 2nzj h ALA 214 Cb 0.66 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 18.22 2nzj h ALA 214 CO 0.05 0.52 0.42 0.28 0.00 0.00 0.00 179.25 180.52 2nzj h VAL 215 N 0.76 1.06 -0.09 0.00 2.07 -0.67 0.48 116.25 119.87 2nzj h VAL 215 Ca 0.14 -0.28 -0.17 0.00 0.82 0.00 0.00 66.70 67.20 2nzj h VAL 215 Cb 0.57 0.18 -0.01 0.00 -1.52 0.00 0.00 31.29 30.51 2nzj h VAL 215 CO 0.03 0.15 -0.69 0.58 0.02 0.00 0.00 177.57 177.67 2nzj h VAL 216 N 0.81 1.37 0.00 2.57 2.07 -0.55 -2.82 116.25 119.71 2nzj h VAL 216 Ca 0.29 -2.07 0.00 0.00 0.82 0.00 0.00 66.70 65.73 2nzj h VAL 216 Cb 0.06 2.05 0.00 0.00 -1.52 0.00 0.00 31.29 31.88 2nzj h VAL 216 CO -0.13 0.62 -0.02 0.49 0.02 0.00 0.00 177.57 178.56 2nzj n PHE 217 N -3.86 0.46 -3.40 1.57 3.72 0.21 -4.97 117.46 111.20 2nzj n PHE 217 Ca -0.04 0.13 -0.17 0.00 -0.05 0.00 0.00 57.45 57.32 2nzj n PHE 217 Cb 0.68 -0.71 0.08 0.00 -0.94 0.00 0.00 39.48 38.58 2nzj n PHE 217 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 2nzj n ASP 218 N -1.88 -3.69 -2.08 4.37 5.68 0.16 -5.02 116.55 114.09 2nzj n ASP 218 Ca 0.06 -0.69 -0.08 0.00 -0.50 0.00 0.00 54.79 53.58 2nzj n ASP 218 Cb 0.39 -4.99 -0.02 0.00 -1.14 0.00 0.00 41.12 35.36 2nzj n ASP 218 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2nzj s LYS 220 N -2.49 3.46 -0.01 0.00 -0.14 -0.86 -4.63 119.74 115.06 2nzj s LYS 220 Ca 0.17 -0.62 0.00 0.00 -1.36 0.00 0.00 55.97 54.16 2nzj s LYS 220 Cb -0.00 -2.87 0.01 0.00 -1.68 0.00 0.00 37.83 33.29 2nzj s LYS 220 CO 0.12 0.41 -0.00 0.12 -0.76 0.00 0.00 175.35 175.23 2nzj s PHE 221 N -1.97 0.18 0.01 3.18 5.36 -1.26 -0.51 117.98 122.98 2nzj s PHE 221 Ca 0.35 0.01 -0.16 0.00 -0.96 0.00 0.00 56.93 56.17 2nzj s PHE 221 Cb -0.10 -0.21 0.03 0.00 -0.34 0.00 0.00 43.02 42.40 2nzj s PHE 221 CO 0.30 -0.05 0.36 -1.50 -1.46 0.00 0.00 175.22 172.86 2nzj s ILE 222 N 0.46 0.06 -0.11 3.12 2.07 -0.96 -5.00 121.20 120.84 2nzj s ILE 222 Ca -0.04 -0.50 -0.02 0.00 -1.41 0.00 0.00 60.65 58.68 2nzj s ILE 222 Cb -0.07 -0.82 -0.03 0.00 0.13 0.00 0.00 42.46 41.67 2nzj s ILE 222 CO -0.01 -0.27 -0.04 -1.61 -1.91 0.00 0.00 174.94 171.09 2nzj s GLU 223 N -1.96 3.24 0.32 3.50 2.02 -1.26 -1.22 118.70 123.33 2nzj s GLU 223 Ca -0.09 -0.51 0.04 0.00 0.02 0.00 0.00 54.97 54.43 2nzj s GLU 223 Cb -0.02 -2.78 -0.06 0.00 0.10 0.00 0.00 34.13 31.36 2nzj s GLU 223 CO 0.01 0.46 0.05 0.95 0.02 0.00 0.00 175.26 176.75 2nzj s THR 224 N -0.24 1.19 -0.04 3.63 -4.23 -0.35 -4.70 115.64 110.89 2nzj s THR 224 Ca 0.04 -2.01 -0.02 0.00 -1.18 0.00 0.00 61.69 58.52 2nzj s THR 224 Cb -0.13 -2.76 0.03 0.00 1.34 0.00 0.00 72.50 70.99 2nzj s THR 224 CO 0.02 -0.03 0.07 -0.55 -0.54 0.00 0.00 174.62 173.60 2nzj s SER 225 N -3.47 0.94 0.25 3.99 0.15 -0.42 -1.60 113.70 113.54 2nzj s SER 225 Ca 0.36 0.12 0.10 0.00 0.70 0.00 0.00 55.95 57.23 2nzj s SER 225 Cb 0.08 -0.06 0.28 0.00 -1.71 0.00 0.00 66.02 64.61 2nzj s SER 225 CO 0.15 -0.23 1.57 0.00 1.20 0.00 0.00 173.24 175.92 2nzj h ALA 226 N 8.28 0.89 0.00 5.45 0.00 -1.95 0.35 119.26 132.28 2nzj h ALA 226 Ca -0.16 -0.61 -0.20 0.00 0.00 0.00 0.00 54.91 53.94 2nzj h ALA 226 Cb 1.12 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.77 2nzj h ALA 226 CO 0.19 0.84 -0.94 1.79 0.00 0.00 0.00 179.25 181.12 2nzj h THR 227 N 0.00 1.63 -0.01 0.00 1.35 -1.96 -3.09 112.91 110.84 2nzj h THR 227 Ca -0.01 -3.28 0.00 0.00 -0.55 0.00 0.00 66.41 62.57 2nzj h THR 227 Cb 1.19 2.79 0.00 0.00 -1.73 0.00 0.00 68.15 70.40 2nzj h THR 227 CO 0.09 0.93 -0.35 0.18 -0.25 0.00 0.00 175.52 176.12 2nzj n LEU 228 N -3.35 1.12 -3.62 3.87 4.77 -1.24 -4.98 117.00 113.57 2nzj n LEU 228 Ca 0.00 -0.32 -0.22 0.00 -0.03 0.00 0.00 56.01 55.45 2nzj n LEU 228 Cb 0.91 -0.11 0.04 0.00 -2.33 0.00 0.00 43.42 41.93 2nzj n LEU 228 CO 0.46 0.22 -0.04 0.00 -1.33 0.00 0.00 177.39 176.70 2nzj n GLN 229 N -0.68 -4.22 -4.47 3.23 6.02 -0.63 -4.99 117.38 111.64 2nzj n GLN 229 Ca 0.11 0.65 -0.33 0.00 -0.01 0.00 0.00 57.00 57.41 2nzj n GLN 229 Cb 0.36 -5.18 -0.15 0.00 1.02 0.00 0.00 30.24 26.30 2nzj n GLN 229 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 2nzj s HIS 230 N -3.58 2.84 -0.73 1.08 2.46 0.02 -4.63 115.29 112.75 2nzj s HIS 230 Ca 0.12 -0.85 0.00 0.00 0.47 0.00 0.00 55.06 54.80 2nzj s HIS 230 Cb -0.03 -1.92 0.00 0.00 -0.13 0.00 0.00 32.58 30.50 2nzj s HIS 230 CO 0.80 -0.38 0.00 0.09 -2.47 0.00 0.00 174.74 172.78 2nzj n ASN 231 N 4.00 -5.04 -0.05 9.88 3.02 -1.26 -1.30 115.26 124.51 2nzj n ASN 231 Ca -0.18 0.17 -0.11 0.00 -0.03 0.00 0.00 54.58 54.42 2nzj n ASN 231 Cb 0.52 -3.15 -0.10 0.00 -0.61 0.00 0.00 39.78 36.44 2nzj n ASN 231 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 2nzj h VAL 232 N 0.00 1.35 -0.70 2.41 2.07 -1.86 -0.52 116.25 118.99 2nzj h VAL 232 Ca -0.14 -1.86 0.09 0.00 0.82 0.00 0.00 66.70 65.61 2nzj h VAL 232 Cb 0.85 2.48 -0.07 0.00 -1.52 0.00 0.00 31.29 33.03 2nzj h VAL 232 CO 0.21 0.43 0.35 0.00 0.02 0.00 0.00 177.57 178.58 2nzj h ALA 233 N -0.15 0.96 -0.18 1.67 0.00 -1.91 -1.89 119.26 117.76 2nzj h ALA 233 Ca -0.00 0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 2nzj h ALA 233 Cb 0.73 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 2nzj h ALA 233 CO 0.00 -0.04 -0.08 0.93 0.00 0.00 0.00 179.25 180.06 2nzj h GLU 234 N 0.60 0.27 0.45 0.00 3.07 -1.95 -0.15 114.58 116.86 2nzj h GLU 234 Ca 0.34 -0.05 -0.02 0.00 -0.50 0.00 0.00 59.36 59.13 2nzj h GLU 234 Cb 0.35 -0.04 0.00 0.00 -0.84 0.00 0.00 28.75 28.22 2nzj h GLU 234 CO -0.26 0.37 -0.21 1.25 -1.40 0.00 0.00 179.01 178.75 2nzj h LEU 235 N 0.26 -0.51 -0.56 1.33 5.85 -0.28 -1.15 115.31 120.26 2nzj h LEU 235 Ca 0.06 -0.03 -0.15 0.00 0.84 0.00 0.00 57.88 58.60 2nzj h LEU 235 Cb 0.32 0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.47 2nzj h LEU 235 CO 0.02 -0.30 -0.51 -0.26 -0.34 0.00 0.00 178.44 177.05 2nzj h PHE 236 N -0.68 0.70 -0.44 1.25 0.04 -1.16 -1.05 116.94 115.59 2nzj h PHE 236 Ca -0.06 -0.23 -0.04 0.00 2.80 0.00 0.00 57.97 60.44 2nzj h PHE 236 Cb 0.50 -0.14 -0.02 0.00 2.20 0.00 0.00 35.95 38.49 2nzj h PHE 236 CO -0.03 0.96 0.12 0.93 -0.60 0.00 0.00 178.31 179.69 2nzj h GLU 237 N 0.44 0.65 -0.46 1.51 5.08 -1.07 -2.15 114.58 118.58 2nzj h GLU 237 Ca 0.02 -0.11 -0.08 0.00 -1.00 0.00 0.00 59.36 58.19 2nzj h GLU 237 Cb 1.04 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 30.16 2nzj h GLU 237 CO 0.10 0.58 -0.03 0.78 -1.00 0.00 0.00 179.01 179.44 2nzj h GLY 238 N 0.84 0.90 0.64 -3.84 0.00 -0.83 -2.21 103.07 98.57 2nzj h GLY 238 Ca 0.15 -0.69 0.04 0.00 0.00 0.00 0.00 47.33 46.84 2nzj h GLY 238 CO -0.01 0.63 0.07 -2.08 0.00 0.00 0.00 176.54 175.16 2nzj h VAL 239 N 0.68 0.86 -0.27 4.60 2.07 -0.85 -1.01 116.25 122.33 2nzj h VAL 239 Ca 0.13 -0.06 0.06 0.00 0.82 0.00 0.00 66.70 67.64 2nzj h VAL 239 Cb 0.55 0.65 -0.06 0.00 -1.52 0.00 0.00 31.29 30.91 2nzj h VAL 239 CO 0.03 0.03 -0.11 0.58 0.02 0.00 0.00 177.57 178.13 2nzj h VAL 240 N 0.19 0.64 -0.61 2.57 2.07 -1.24 -0.81 116.25 119.05 2nzj h VAL 240 Ca 0.15 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.69 2nzj h VAL 240 Cb 0.16 0.64 -0.04 0.00 -1.52 0.00 0.00 31.29 30.53 2nzj h VAL 240 CO -0.19 0.00 0.38 0.03 0.02 0.00 0.00 177.57 177.81 2nzj h ARG 241 N -0.06 0.74 -0.75 1.57 3.08 -0.94 -1.19 114.38 116.83 2nzj h ARG 241 Ca 0.14 -0.04 -0.05 0.00 0.07 0.00 0.00 59.98 60.10 2nzj h ARG 241 Cb 0.27 -0.17 -0.03 0.00 0.08 0.00 0.00 29.97 30.12 2nzj h ARG 241 CO -0.31 0.49 0.28 1.96 -1.07 0.00 0.00 179.97 181.32 2nzj h GLN 242 N 0.76 1.13 -0.55 0.04 1.08 -0.85 -2.29 115.11 114.43 2nzj h GLN 242 Ca 0.24 -0.21 -0.04 0.00 -1.45 0.00 0.00 58.65 57.19 2nzj h GLN 242 Cb 0.00 -0.18 -0.03 0.00 -0.05 0.00 0.00 27.48 27.22 2nzj h GLN 242 CO -0.09 0.93 0.18 -0.07 -0.95 0.00 0.00 178.83 178.82 2nzj h LEU 243 N 1.10 0.75 -1.10 1.46 3.38 -0.55 -2.67 115.31 117.68 2nzj h LEU 243 Ca 0.25 -0.11 -0.07 0.00 0.09 0.00 0.00 57.88 58.04 2nzj h LEU 243 Cb 0.23 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 2nzj h LEU 243 CO -0.02 0.71 -0.31 0.03 0.09 0.00 0.00 178.44 178.94 2nzj h ARG 244 N 0.80 0.00 0.00 1.13 3.08 -0.78 -2.57 114.38 116.04 2nzj h ARG 244 Ca 0.18 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 60.14 2nzj h ARG 244 Cb 0.22 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.26 2nzj h ARG 244 CO -0.01 0.31 -0.46 -0.07 -1.07 0.00 0.00 179.97 178.67 2nzj h LEU 245 N 0.00 0.00 0.52 3.04 3.38 -1.08 -2.68 115.31 118.50 2nzj h LEU 245 Ca -0.00 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 2nzj h LEU 245 Cb 0.79 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.53 2nzj h LEU 245 CO 0.04 0.46 -0.36 0.03 0.09 0.00 0.00 178.44 178.70 2nzj h ARG 246 N 0.00 -0.81 -0.88 1.13 3.08 -1.32 -3.21 114.38 112.37 2nzj h ARG 246 Ca -0.00 0.06 0.17 0.00 0.07 0.00 0.00 59.98 60.27 2nzj h ARG 246 Cb 0.94 0.19 -0.07 0.00 0.08 0.00 0.00 29.97 31.11 2nzj h ARG 246 CO 0.06 -0.54 0.57 0.07 -1.07 0.00 0.00 179.97 179.06 2nzj h ARG 247 N -0.85 0.51 -0.01 0.04 -0.00 -1.53 -3.52 114.38 109.02 2nzj h ARG 247 Ca -0.07 -0.03 0.00 0.00 -0.00 0.00 0.00 59.98 59.88 2nzj h ARG 247 Cb 0.69 -0.11 0.00 0.00 -0.00 0.00 0.00 29.97 30.55 2nzj h ARG 247 CO 0.04 0.33 0.00 -2.13 -0.00 0.00 0.00 179.97 178.22