#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1npz s PRO 2 N 0.00 2.09 0.47 3.23 0.04 -1.26 -4.91 135.00 134.66 1npz s PRO 2 Ca 0.00 1.32 0.25 0.00 0.04 0.00 0.00 61.00 62.61 1npz s PRO 2 Cb 0.00 -1.87 1.12 0.00 0.04 0.00 0.00 34.50 33.79 1npz s PRO 2 CO 0.00 -1.79 1.92 -0.44 0.04 0.00 0.00 177.00 176.73 1npz h ASP 3 N -1.03 0.00 -4.63 6.66 3.32 -2.03 -3.45 116.42 115.27 1npz h ASP 3 Ca -0.44 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.60 1npz h ASP 3 Cb 1.25 0.00 -0.21 0.00 0.22 0.00 0.00 39.33 40.59 1npz h ASP 3 CO 0.50 0.20 0.31 -0.94 -1.72 0.00 0.00 179.24 177.58 1npz s SER 4 N -6.21 -0.57 0.01 6.45 1.04 -1.26 -4.32 113.70 108.84 1npz s SER 4 Ca -0.01 0.66 -0.00 0.00 0.48 0.00 0.00 55.95 57.08 1npz s SER 4 Cb 0.12 0.52 -0.01 0.00 0.10 0.00 0.00 66.02 66.74 1npz s SER 4 CO 0.62 -0.50 -0.01 0.68 0.98 0.00 0.00 173.24 175.01 1npz s VAL 5 N -1.05 0.07 -0.30 5.02 -7.23 -0.73 -4.97 120.40 111.21 1npz s VAL 5 Ca -0.07 -0.56 -0.02 0.00 -1.81 0.00 0.00 61.98 59.51 1npz s VAL 5 Cb -0.01 -0.18 0.12 0.00 0.56 0.00 0.00 36.38 36.88 1npz s VAL 5 CO 0.06 -0.31 0.21 -0.62 -0.31 0.00 0.00 175.10 174.13 1npz s ASP 6 N -0.91 2.72 0.29 4.85 -1.08 -1.26 -1.27 116.67 120.01 1npz s ASP 6 Ca -0.10 -1.21 0.20 0.00 -0.52 0.00 0.00 52.55 50.92 1npz s ASP 6 Cb -0.06 -0.01 1.06 0.00 -1.46 0.00 0.00 42.92 42.45 1npz s ASP 6 CO -0.01 -0.40 1.60 0.79 0.52 0.00 0.00 175.17 177.67 1npz n TRP 7 N 5.10 0.66 0.22 -5.34 7.02 -0.51 -0.81 117.44 123.79 1npz n TRP 7 Ca -0.02 0.35 0.08 0.00 -1.02 0.00 0.00 57.50 56.88 1npz n TRP 7 Cb 0.43 -1.05 0.52 0.00 -2.42 0.00 0.00 31.31 28.79 1npz n TRP 7 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1npz h ARG 8 N 0.00 0.00 0.00 -0.99 3.08 -1.93 -2.24 114.38 112.30 1npz h ARG 8 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1npz h ARG 8 Cb 0.02 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.07 1npz h ARG 8 CO 0.00 0.25 0.00 0.93 -1.07 0.00 0.00 179.97 180.08 1npz h GLU 9 N 0.00 0.00 -0.43 0.04 5.08 -1.38 -2.80 114.58 115.09 1npz h GLU 9 Ca -0.00 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.26 1npz h GLU 9 Cb 0.54 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.73 1npz h GLU 9 CO 0.03 0.00 0.06 1.63 -1.00 0.00 0.00 179.01 179.73 1npz n LYS 10 N -2.90 3.01 -2.27 2.33 5.02 -0.88 -4.95 118.16 117.53 1npz n LYS 10 Ca 0.02 -3.00 -0.19 0.00 -2.02 0.00 0.00 58.31 53.12 1npz n LYS 10 Cb 0.34 -1.96 -0.02 0.00 -0.02 0.00 0.00 35.03 33.37 1npz n LYS 10 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1npz n GLY 11 N -0.49 -0.12 1.14 0.72 0.00 -1.05 -4.88 105.19 100.51 1npz n GLY 11 Ca 0.30 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.43 1npz n GLY 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1npz s VAL 13 N -1.47 1.51 0.93 0.00 1.01 -1.26 -3.62 120.40 117.51 1npz s VAL 13 Ca 0.39 -0.68 -0.15 0.00 0.00 0.00 0.00 61.98 61.54 1npz s VAL 13 Cb 0.23 -1.36 0.18 0.00 0.00 0.00 0.00 36.38 35.43 1npz s VAL 13 CO 0.32 0.44 1.29 0.42 0.00 0.00 0.00 175.10 177.57 1npz s THR 14 N 0.72 2.01 0.62 3.92 -4.23 -1.26 -4.96 115.64 112.45 1npz s THR 14 Ca -0.12 -0.03 -0.17 0.00 -1.18 0.00 0.00 61.69 60.18 1npz s THR 14 Cb -0.16 -2.98 -0.02 0.00 1.34 0.00 0.00 72.50 70.68 1npz s THR 14 CO 0.03 0.00 1.17 -1.61 -0.54 0.00 0.00 174.62 173.67 1npz s GLU 15 N -5.82 2.88 0.22 3.99 2.02 -1.26 -4.95 118.70 115.79 1npz s GLU 15 Ca 0.72 1.67 -0.31 0.00 0.02 0.00 0.00 54.97 57.07 1npz s GLU 15 Cb -0.05 -1.94 -0.11 0.00 0.10 0.00 0.00 34.13 32.14 1npz s GLU 15 CO 0.52 -1.24 1.55 0.08 0.02 0.00 0.00 175.26 176.20 1npz s VAL 16 N -1.87 2.43 0.36 2.63 1.01 -1.26 -5.02 120.40 118.68 1npz s VAL 16 Ca 0.73 0.33 0.07 0.00 0.00 0.00 0.00 61.98 63.12 1npz s VAL 16 Cb -0.26 -3.21 -0.00 0.00 0.00 0.00 0.00 36.38 32.90 1npz s VAL 16 CO 0.36 0.04 0.50 -0.54 0.00 0.00 0.00 175.10 175.45 1npz s LYS 17 N 0.31 3.05 -0.30 2.72 -0.14 -1.26 -4.73 119.74 119.40 1npz s LYS 17 Ca 0.66 -1.06 0.02 0.00 -1.36 0.00 0.00 55.97 54.24 1npz s LYS 17 Cb -0.45 -2.80 0.08 0.00 -1.68 0.00 0.00 37.83 32.98 1npz s LYS 17 CO 0.39 -0.02 0.00 -0.47 -0.76 0.00 0.00 175.35 174.49 1npz s TYR 18 N -2.22 3.11 0.35 3.18 5.04 -1.26 -1.35 117.35 124.20 1npz s TYR 18 Ca 0.47 -2.45 0.38 0.00 -2.44 0.00 0.00 57.07 53.03 1npz s TYR 18 Cb -0.10 -2.29 1.80 0.00 0.35 0.00 0.00 41.96 41.72 1npz s TYR 18 CO 0.32 -0.89 2.15 -0.56 -1.34 0.00 0.00 175.55 175.22 1npz h GLN 19 N 7.78 0.00 0.00 4.97 3.07 -1.66 -3.47 115.11 125.79 1npz h GLN 19 Ca -0.11 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.63 1npz h GLN 19 Cb 1.03 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.59 1npz h GLN 19 CO 0.48 0.01 0.00 0.41 0.09 0.00 0.00 178.83 179.82 1npz n GLY 20 N -0.46 0.16 2.46 0.06 0.00 -1.26 -3.79 105.19 102.36 1npz n GLY 20 Ca -0.01 -0.98 -0.40 0.00 0.00 0.00 0.00 46.02 44.63 1npz n GLY 20 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1npz n SER 21 N -2.10 8.12 -3.66 1.61 3.41 -1.26 -4.74 113.62 114.99 1npz n SER 21 Ca 0.00 -3.08 -0.15 0.00 -0.26 0.00 0.00 58.87 55.39 1npz n SER 21 Cb 0.00 -1.38 -0.14 0.00 -0.26 0.00 0.00 64.21 62.43 1npz n SER 21 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1npz n GLY 23 N 5.33 2.92 1.52 0.00 0.00 -0.15 -4.55 105.19 110.27 1npz n GLY 23 Ca -0.06 -1.01 -0.06 0.00 0.00 0.00 0.00 46.02 44.89 1npz n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1npz n ALA 24 N 3.04 3.84 -0.35 4.61 0.00 -1.26 -3.55 120.51 126.83 1npz n ALA 24 Ca 0.43 -1.40 0.11 0.00 0.00 0.00 0.00 53.44 52.57 1npz n ALA 24 Cb 0.54 -1.18 0.30 0.00 0.00 0.00 0.00 19.45 19.11 1npz n ALA 24 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1npz h TRP 26 N 0.85 0.72 -0.23 0.00 5.08 -1.79 -1.26 115.95 119.33 1npz h TRP 26 Ca 0.53 -0.05 -0.08 0.00 1.08 0.00 0.00 58.89 60.38 1npz h TRP 26 Cb 0.72 -0.22 -0.00 0.00 -3.00 0.00 0.00 29.16 26.66 1npz h TRP 26 CO -0.00 0.59 -0.17 0.00 -1.28 0.00 0.00 178.44 177.58 1npz h ALA 27 N 1.47 0.33 -0.38 0.11 0.00 -1.48 -1.76 119.26 117.55 1npz h ALA 27 Ca 0.16 -0.34 -0.05 0.00 0.00 0.00 0.00 54.91 54.68 1npz h ALA 27 Cb 0.20 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1npz h ALA 27 CO -0.01 0.24 0.04 0.74 0.00 0.00 0.00 179.25 180.26 1npz h PHE 28 N 0.22 0.69 -0.98 0.00 0.04 -1.30 -1.22 116.94 114.39 1npz h PHE 28 Ca 0.04 -0.11 0.06 0.00 2.80 0.00 0.00 57.97 60.77 1npz h PHE 28 Cb 0.71 -0.19 -0.06 0.00 2.20 0.00 0.00 35.95 38.61 1npz h PHE 28 CO 0.07 0.71 0.63 1.03 -0.60 0.00 0.00 178.31 180.15 1npz h SER 29 N 0.48 1.02 0.08 2.17 0.87 -1.23 -0.10 113.55 116.84 1npz h SER 29 Ca 0.11 0.01 -0.00 0.00 -1.23 0.00 0.00 61.79 60.68 1npz h SER 29 Cb 0.41 -0.21 0.00 0.00 -0.44 0.00 0.00 62.40 62.16 1npz h SER 29 CO 0.01 0.66 -0.04 0.00 -0.53 0.00 0.00 176.83 176.93 1npz h ALA 30 N 1.44 -0.11 -0.69 6.23 0.00 -1.00 -2.62 119.26 122.51 1npz h ALA 30 Ca 0.42 -0.20 -0.07 0.00 0.00 0.00 0.00 54.91 55.06 1npz h ALA 30 Cb 0.14 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 1npz h ALA 30 CO -0.17 -0.36 0.16 -0.39 0.00 0.00 0.00 179.25 178.49 1npz h VAL 31 N -0.51 1.26 -0.88 0.00 -1.51 -1.09 -2.29 116.25 111.23 1npz h VAL 31 Ca -0.01 -0.97 0.12 0.00 -1.23 0.00 0.00 66.70 64.61 1npz h VAL 31 Cb 0.43 0.56 -0.07 0.00 -2.13 0.00 0.00 31.29 30.09 1npz h VAL 31 CO 0.02 0.37 0.57 1.23 -1.23 0.00 0.00 177.57 178.53 1npz h GLY 32 N 1.07 1.23 1.40 5.19 0.00 -1.03 0.42 103.07 111.35 1npz h GLY 32 Ca 0.22 -0.33 -0.21 0.00 0.00 0.00 0.00 47.33 47.01 1npz h GLY 32 CO 0.00 0.15 -0.77 0.00 0.00 0.00 0.00 176.54 175.93 1npz h ALA 33 N 1.58 0.45 -0.05 3.60 0.00 -1.05 -3.21 119.26 120.57 1npz h ALA 33 Ca 0.42 -0.61 -0.18 0.00 0.00 0.00 0.00 54.91 54.54 1npz h ALA 33 Cb 0.54 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 1npz h ALA 33 CO -0.19 0.73 -0.74 1.25 0.00 0.00 0.00 179.25 180.30 1npz h LEU 34 N 0.40 0.39 -0.91 0.00 5.85 -0.63 -3.21 115.31 117.20 1npz h LEU 34 Ca -0.04 -0.26 0.12 0.00 0.84 0.00 0.00 57.88 58.53 1npz h LEU 34 Cb 1.37 -0.12 -0.08 0.00 0.37 0.00 0.00 40.66 42.20 1npz h LEU 34 CO 0.14 1.00 0.53 -0.33 -0.34 0.00 0.00 178.44 179.45 1npz h GLU 35 N 0.22 0.81 -0.33 1.25 5.08 -0.24 -1.30 114.58 120.07 1npz h GLU 35 Ca -0.03 -0.05 -0.11 0.00 -1.00 0.00 0.00 59.36 58.17 1npz h GLU 35 Cb 1.32 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 30.37 1npz h GLU 35 CO 0.12 0.54 -0.27 0.00 -1.00 0.00 0.00 179.01 178.40 1npz h ALA 36 N 1.52 0.92 -0.39 3.43 0.00 -1.57 -2.51 119.26 120.65 1npz h ALA 36 Ca 0.46 -0.38 -0.12 0.00 0.00 0.00 0.00 54.91 54.87 1npz h ALA 36 Cb 0.49 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1npz h ALA 36 CO -0.28 0.62 -0.23 1.96 0.00 0.00 0.00 179.25 181.31 1npz h GLN 37 N 0.58 0.78 0.07 0.00 1.08 -1.40 -1.56 115.11 114.66 1npz h GLN 37 Ca 0.08 -0.32 -0.00 0.00 -1.45 0.00 0.00 58.65 56.95 1npz h GLN 37 Cb 0.76 -0.03 0.00 0.00 -0.05 0.00 0.00 27.48 28.15 1npz h GLN 37 CO 0.06 0.94 -0.03 1.25 -0.95 0.00 0.00 178.83 180.10 1npz h LEU 38 N 0.68 -0.08 0.05 1.46 5.85 -1.12 -1.18 115.31 120.96 1npz h LEU 38 Ca 0.09 -0.03 0.02 0.00 0.84 0.00 0.00 57.88 58.80 1npz h LEU 38 Cb 0.75 0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.78 1npz h LEU 38 CO 0.06 -0.02 -0.14 0.50 -0.34 0.00 0.00 178.44 178.50 1npz h LYS 39 N -0.13 -0.24 -0.16 1.25 1.63 -1.22 0.11 116.57 117.82 1npz h LYS 39 Ca -0.01 0.02 0.05 0.00 -0.85 0.00 0.00 60.65 59.85 1npz h LYS 39 Cb 0.10 0.06 -0.01 0.00 -0.60 0.00 0.00 32.23 31.78 1npz h LYS 39 CO 0.02 -0.16 0.13 -0.07 -3.45 0.00 0.00 179.45 175.91 1npz h LEU 40 N -0.25 0.00 0.00 5.20 3.38 -1.07 0.52 115.31 123.08 1npz h LEU 40 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1npz h LEU 40 Cb 0.29 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.04 1npz h LEU 40 CO -0.10 0.00 -1.86 1.17 0.09 0.00 0.00 178.44 177.75 1npz n LYS 41 N -4.20 0.64 0.00 1.13 4.81 -0.46 -4.53 118.16 115.54 1npz n LYS 41 Ca 0.01 -0.16 0.00 0.00 -0.87 0.00 0.00 58.31 57.29 1npz n LYS 41 Cb 0.26 -1.56 0.00 0.00 0.02 0.00 0.00 35.03 33.75 1npz n LYS 41 CO 0.00 0.00 0.00 0.25 1.17 0.00 0.00 177.40 178.82 1npz n THR 42 N -2.30 0.00 -0.61 3.15 -2.24 0.34 -4.99 114.28 107.63 1npz n THR 42 Ca -0.03 -0.33 0.00 0.00 -2.27 0.00 0.00 64.05 61.41 1npz n THR 42 Cb 0.56 1.33 0.00 0.00 -2.10 0.00 0.00 70.33 70.12 1npz n THR 42 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1npz n GLY 43 N 0.01 0.89 3.53 3.38 0.00 0.18 -4.99 105.19 108.19 1npz n GLY 43 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 1npz n GLY 43 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1npz s LYS 44 N -0.31 2.53 -0.29 1.61 1.02 -1.24 -4.96 119.74 118.11 1npz s LYS 44 Ca 0.00 -0.69 -0.05 0.00 0.02 0.00 0.00 55.97 55.24 1npz s LYS 44 Cb 0.00 -2.44 0.02 0.00 -0.52 0.00 0.00 37.83 34.89 1npz s LYS 44 CO 0.00 0.62 0.05 -1.17 -0.92 0.00 0.00 175.35 173.93 1npz s LEU 45 N -0.97 3.76 -0.03 3.17 2.96 -1.26 -2.66 118.68 123.65 1npz s LEU 45 Ca 0.13 -0.80 0.02 0.00 -0.22 0.00 0.00 54.13 53.26 1npz s LEU 45 Cb -0.11 -1.83 0.00 0.00 0.50 0.00 0.00 46.19 44.76 1npz s LEU 45 CO 0.03 -0.19 -0.08 -0.69 -1.32 0.00 0.00 176.35 174.09 1npz s VAL 46 N 1.44 0.71 0.06 1.68 1.01 -1.26 -5.09 120.40 118.96 1npz s VAL 46 Ca 0.01 -0.32 -0.30 0.00 0.00 0.00 0.00 61.98 61.38 1npz s VAL 46 Cb -0.17 -0.65 -0.05 0.00 0.00 0.00 0.00 36.38 35.51 1npz s VAL 46 CO 0.01 0.23 1.09 0.42 0.00 0.00 0.00 175.10 176.85 1npz s THR 47 N 0.25 4.34 0.50 3.92 -4.23 -1.26 -4.82 115.64 114.33 1npz s THR 47 Ca -0.04 1.74 -0.03 0.00 -1.18 0.00 0.00 61.69 62.18 1npz s THR 47 Cb -0.09 -4.11 -0.01 0.00 1.34 0.00 0.00 72.50 69.63 1npz s THR 47 CO 0.00 0.17 0.77 -0.76 -0.54 0.00 0.00 174.62 174.26 1npz s LEU 48 N 0.74 3.54 -0.53 4.79 1.43 -1.26 -1.17 118.68 126.21 1npz s LEU 48 Ca 0.54 0.60 -0.28 0.00 -1.03 0.00 0.00 54.13 53.96 1npz s LEU 48 Cb -0.26 -3.48 0.02 0.00 0.03 0.00 0.00 46.19 42.50 1npz s LEU 48 CO 0.30 -0.76 1.31 -0.55 0.23 0.00 0.00 176.35 176.88 1npz s SER 49 N -4.20 6.33 0.24 2.29 0.15 -0.40 -4.06 113.70 114.04 1npz s SER 49 Ca 0.49 0.36 0.07 0.00 0.70 0.00 0.00 55.95 57.57 1npz s SER 49 Cb -0.10 -2.55 0.24 0.00 -1.71 0.00 0.00 66.02 61.90 1npz s SER 49 CO 0.42 -1.53 1.55 0.00 1.20 0.00 0.00 173.24 174.88 1npz h ALA 50 N 10.30 0.84 -0.33 5.45 0.00 -1.88 -2.92 119.26 130.72 1npz h ALA 50 Ca -0.26 -0.59 -0.01 0.00 0.00 0.00 0.00 54.91 54.06 1npz h ALA 50 Cb 1.08 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.76 1npz h ALA 50 CO 1.16 0.79 0.17 0.37 0.00 0.00 0.00 179.25 181.73 1npz h GLN 51 N 0.09 0.45 0.10 0.00 5.75 -1.84 -1.37 115.11 118.29 1npz h GLN 51 Ca -0.01 -0.04 0.01 0.00 -0.15 0.00 0.00 58.65 58.46 1npz h GLN 51 Cb 1.18 -0.09 -0.02 0.00 1.07 0.00 0.00 27.48 29.62 1npz h GLN 51 CO 0.09 0.34 -0.14 -0.97 -2.65 0.00 0.00 178.83 175.51 1npz h ASN 52 N 0.46 -0.37 -0.52 -0.69 -0.00 -1.76 -0.99 115.58 111.71 1npz h ASN 52 Ca 0.12 0.04 -0.00 0.00 -0.00 0.00 0.00 56.30 56.46 1npz h ASN 52 Cb 0.04 0.14 -0.03 0.00 -0.00 0.00 0.00 38.32 38.47 1npz h ASN 52 CO -0.02 -0.20 0.32 -0.07 -0.00 0.00 0.00 177.43 177.45 1npz h LEU 53 N -0.28 0.62 -0.76 0.34 3.38 -1.45 0.13 115.31 117.29 1npz h LEU 53 Ca 0.01 -0.05 0.02 0.00 0.09 0.00 0.00 57.88 57.95 1npz h LEU 53 Cb 0.29 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 40.84 1npz h LEU 53 CO -0.06 0.49 0.50 0.58 0.09 0.00 0.00 178.44 180.03 1npz h VAL 54 N 0.69 1.17 0.13 1.22 2.07 -1.04 -1.09 116.25 119.41 1npz h VAL 54 Ca 0.19 -0.34 -0.30 0.00 0.82 0.00 0.00 66.70 67.06 1npz h VAL 54 Cb -0.02 0.08 -0.00 0.00 -1.52 0.00 0.00 31.29 29.83 1npz h VAL 54 CO -0.04 0.18 -1.44 0.44 0.02 0.00 0.00 177.57 176.73 1npz h ASP 55 N 1.00 0.43 0.00 0.57 3.32 -1.05 -3.39 116.42 117.30 1npz h ASP 55 Ca 0.29 -0.54 -0.30 0.00 0.02 0.00 0.00 57.03 56.49 1npz h ASP 55 Cb -0.08 -0.14 -0.06 0.00 0.22 0.00 0.00 39.33 39.28 1npz h ASP 55 CO -0.08 1.44 -2.22 0.00 -1.72 0.00 0.00 179.24 176.67 1npz s SER 57 N -5.15 7.07 0.00 0.00 0.15 -0.42 -4.93 113.70 110.43 1npz s SER 57 Ca -0.09 -3.05 0.00 0.00 0.70 0.00 0.00 55.95 53.51 1npz s SER 57 Cb 0.06 -2.31 0.00 0.00 -1.71 0.00 0.00 66.02 62.06 1npz s SER 57 CO 0.76 -0.60 0.00 0.35 1.20 0.00 0.00 173.24 174.95 1npz n THR 58 N 3.96 0.00 -0.28 6.45 -2.24 -1.26 -4.51 114.28 116.40 1npz n THR 58 Ca 0.28 0.00 -0.00 0.00 -2.27 0.00 0.00 64.05 62.05 1npz n THR 58 Cb 0.43 0.00 0.07 0.00 -2.10 0.00 0.00 70.33 68.72 1npz n THR 58 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 1npz h GLU 59 N 0.00 -0.04 -0.89 -0.78 4.57 -1.91 0.88 114.58 116.41 1npz h GLU 59 Ca 0.00 0.00 0.23 0.00 -1.18 0.00 0.00 59.36 58.42 1npz h GLU 59 Cb 0.00 0.01 -0.05 0.00 -0.16 0.00 0.00 28.75 28.55 1npz h GLU 59 CO 0.00 -0.03 0.62 -0.22 -1.18 0.00 0.00 179.01 178.20 1npz h LYS 60 N -0.04 0.18 -0.63 1.92 3.64 -1.94 0.16 116.57 119.86 1npz h LYS 60 Ca 0.34 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.71 1npz h LYS 60 Cb 0.59 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.37 1npz h LYS 60 CO -0.83 0.12 0.00 0.66 -2.27 0.00 0.00 179.45 177.13 1npz n TYR 61 N -4.39 0.84 -1.08 1.91 4.02 0.19 -4.93 117.16 113.71 1npz n TYR 61 Ca 0.19 -0.43 -0.03 0.00 -0.01 0.00 0.00 57.90 57.62 1npz n TYR 61 Cb 0.84 -0.00 -0.01 0.00 -0.02 0.00 0.00 39.34 40.15 1npz n TYR 61 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1npz n GLY 62 N 1.57 0.52 3.91 2.72 0.00 0.58 -4.82 105.19 109.67 1npz n GLY 62 Ca 0.23 -0.19 -0.29 0.00 0.00 0.00 0.00 46.02 45.77 1npz n GLY 62 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1npz s ASN 63 N -2.27 6.45 -0.23 1.61 0.01 -0.51 -4.83 114.94 115.17 1npz s ASN 63 Ca 0.00 0.55 0.13 0.00 -0.71 0.00 0.00 52.86 52.83 1npz s ASN 63 Cb 0.00 -2.07 0.45 0.00 0.41 0.00 0.00 41.25 40.04 1npz s ASN 63 CO 0.00 -0.03 1.18 0.29 -1.51 0.00 0.00 177.10 177.03 1npz n LYS 64 N -0.38 2.30 0.00 -0.60 5.02 0.24 -3.31 118.16 121.42 1npz n LYS 64 Ca -0.03 -3.56 0.00 0.00 -2.02 0.00 0.00 58.31 52.70 1npz n LYS 64 Cb 0.53 -1.71 0.00 0.00 -0.02 0.00 0.00 35.03 33.83 1npz n LYS 64 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1npz n GLY 65 N -0.67 3.46 0.00 0.72 0.00 -1.23 -0.19 105.19 107.27 1npz n GLY 65 Ca 0.26 0.23 0.06 0.00 0.00 0.00 0.00 46.02 46.57 1npz n GLY 65 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1npz n ASN 67 N -1.33 3.62 0.00 0.00 3.02 0.73 -0.97 115.26 120.33 1npz n ASN 67 Ca 0.05 -1.99 0.00 0.00 -0.03 0.00 0.00 54.58 52.61 1npz n ASN 67 Cb 0.11 -0.39 0.00 0.00 -0.61 0.00 0.00 39.78 38.89 1npz n ASN 67 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1npz n GLY 68 N 1.34 3.15 0.00 7.41 0.00 -0.90 -4.81 105.19 111.38 1npz n GLY 68 Ca 0.21 -1.94 0.00 0.00 0.00 0.00 0.00 46.02 44.28 1npz n GLY 68 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1npz n GLY 69 N -0.67 1.47 3.08 -0.02 0.00 -1.26 0.79 105.19 108.58 1npz n GLY 69 Ca 0.00 -0.83 -0.21 0.00 0.00 0.00 0.00 46.02 44.98 1npz n GLY 69 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1npz s PHE 70 N -4.58 1.08 0.16 1.61 0.08 -1.26 -4.83 117.98 110.24 1npz s PHE 70 Ca 0.00 -0.22 -0.09 0.00 0.12 0.00 0.00 56.93 56.75 1npz s PHE 70 Cb 0.00 -0.69 0.00 0.00 -0.57 0.00 0.00 43.02 41.76 1npz s PHE 70 CO 0.00 -0.02 1.47 0.52 -0.10 0.00 0.00 175.22 177.10 1npz h MET 71 N 5.77 0.82 -0.40 0.44 2.86 -1.98 -2.42 114.93 120.01 1npz h MET 71 Ca -0.33 -0.47 0.04 0.00 -2.06 0.00 0.00 59.70 56.88 1npz h MET 71 Cb 1.17 0.03 -0.04 0.00 0.06 0.00 0.00 31.60 32.83 1npz h MET 71 CO 0.49 1.10 0.18 1.79 1.06 0.00 0.00 176.91 181.53 1npz h THR 72 N 0.65 0.94 0.00 2.22 1.35 -1.96 -1.70 112.91 114.41 1npz h THR 72 Ca 0.04 -0.13 0.00 0.00 -0.55 0.00 0.00 66.41 65.77 1npz h THR 72 Cb 1.05 0.54 0.00 0.00 -1.73 0.00 0.00 68.15 68.00 1npz h THR 72 CO 0.10 0.07 0.00 0.71 -0.25 0.00 0.00 175.52 176.15 1npz h THR 73 N 0.37 0.00 -0.04 6.82 1.35 -1.87 -2.45 112.91 117.10 1npz h THR 73 Ca 0.18 -0.48 -0.23 0.00 -0.55 0.00 0.00 66.41 65.33 1npz h THR 73 Cb 0.12 1.44 0.01 0.00 -1.73 0.00 0.00 68.15 67.98 1npz h THR 73 CO -0.15 0.00 -0.90 0.00 -0.25 0.00 0.00 175.52 174.22 1npz h ALA 74 N 2.44 0.35 -0.56 6.62 0.00 -0.89 -1.90 119.26 125.32 1npz h ALA 74 Ca 0.00 -0.67 -0.04 0.00 0.00 0.00 0.00 54.91 54.19 1npz h ALA 74 Cb 0.70 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 1npz h ALA 74 CO 0.00 0.76 0.17 0.74 0.00 0.00 0.00 179.25 180.92 1npz h PHE 75 N 0.32 0.90 -0.89 0.00 0.04 -1.06 -2.64 116.94 113.61 1npz h PHE 75 Ca -0.08 -0.09 0.05 0.00 2.80 0.00 0.00 57.97 60.65 1npz h PHE 75 Cb 1.53 -0.26 -0.05 0.00 2.20 0.00 0.00 35.95 39.37 1npz h PHE 75 CO 0.07 0.76 0.58 0.37 -0.60 0.00 0.00 178.31 179.49 1npz h GLN 76 N 0.78 1.03 -0.44 1.51 5.75 -1.32 -0.89 115.11 121.52 1npz h GLN 76 Ca 0.18 -0.06 -0.06 0.00 -0.15 0.00 0.00 58.65 58.56 1npz h GLN 76 Cb 0.28 -0.23 -0.02 0.00 1.07 0.00 0.00 27.48 28.58 1npz h GLN 76 CO -0.01 0.68 0.03 -0.92 -2.65 0.00 0.00 178.83 175.97 1npz h TYR 77 N 1.06 0.74 -0.22 3.99 3.20 -1.00 -0.67 116.97 124.08 1npz h TYR 77 Ca 0.37 -0.08 -0.17 0.00 3.14 0.00 0.00 58.73 61.98 1npz h TYR 77 Cb 0.10 -0.21 -0.00 0.00 1.54 0.00 0.00 36.73 38.16 1npz h TYR 77 CO -0.00 0.68 -0.56 0.82 -1.64 0.00 0.00 178.16 177.46 1npz h ILE 78 N 0.67 1.31 -0.62 1.81 2.04 -0.95 0.14 117.51 121.91 1npz h ILE 78 Ca 0.14 -1.79 -0.08 0.00 1.00 0.00 0.00 64.86 64.13 1npz h ILE 78 Cb 0.37 1.73 -0.02 0.00 -0.74 0.00 0.00 36.82 38.16 1npz h ILE 78 CO 0.01 0.56 0.06 0.40 0.00 0.00 0.00 178.15 179.18 1npz h ILE 79 N 0.51 1.26 -0.12 -0.67 2.04 -1.03 -1.17 117.51 118.33 1npz h ILE 79 Ca 0.01 -1.08 -0.07 0.00 1.00 0.00 0.00 64.86 64.72 1npz h ILE 79 Cb 1.13 0.75 -0.00 0.00 -0.74 0.00 0.00 36.82 37.96 1npz h ILE 79 CO 0.11 0.40 -0.20 0.44 0.00 0.00 0.00 178.15 178.90 1npz h ASP 80 N 0.96 0.39 0.70 1.72 3.32 -0.95 -3.17 116.42 119.39 1npz h ASP 80 Ca 0.18 -0.54 0.00 0.00 0.02 0.00 0.00 57.03 56.69 1npz h ASP 80 Cb 0.49 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.93 1npz h ASP 80 CO 0.02 0.85 0.00 -3.20 -1.72 0.00 0.00 179.24 175.19 1npz n ASN 81 N -4.51 0.31 -1.09 6.45 5.15 0.48 -4.87 115.26 117.18 1npz n ASN 81 Ca -0.07 0.57 -0.13 0.00 -0.60 0.00 0.00 54.58 54.35 1npz n ASN 81 Cb 0.41 -0.64 -0.04 0.00 -0.53 0.00 0.00 39.78 38.98 1npz n ASN 81 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 1npz n LYS 82 N -1.83 -0.92 0.00 1.20 5.02 -0.54 -4.91 118.16 116.18 1npz n LYS 82 Ca 0.03 0.88 0.00 0.00 -2.02 0.00 0.00 58.31 57.21 1npz n LYS 82 Cb 0.23 -4.96 0.00 0.00 -0.02 0.00 0.00 35.03 30.27 1npz n LYS 82 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1npz n GLY 83 N -1.32 2.65 2.97 0.72 0.00 -0.65 -4.84 105.19 104.73 1npz n GLY 83 Ca -0.13 -1.19 -0.12 0.00 0.00 0.00 0.00 46.02 44.57 1npz n GLY 83 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1npz s ILE 84 N -2.00 0.00 0.78 -0.61 2.07 -0.60 -4.75 121.20 116.09 1npz s ILE 84 Ca 0.00 -0.04 -0.12 0.00 -1.41 0.00 0.00 60.65 59.09 1npz s ILE 84 Cb 0.00 -0.15 0.06 0.00 0.13 0.00 0.00 42.46 42.50 1npz s ILE 84 CO 0.00 -0.02 1.11 -1.81 -1.91 0.00 0.00 174.94 172.31 1npz s ASP 85 N -0.02 4.70 0.58 4.50 1.01 -1.26 -0.95 116.67 125.23 1npz s ASP 85 Ca -0.01 1.17 -0.13 0.00 0.71 0.00 0.00 52.55 54.29 1npz s ASP 85 Cb -0.01 -1.88 -0.05 0.00 1.01 0.00 0.00 42.92 41.98 1npz s ASP 85 CO 0.00 -1.82 1.01 -0.94 0.21 0.00 0.00 175.17 173.64 1npz s SER 86 N -4.13 6.37 0.23 0.27 1.04 -1.18 -1.28 113.70 115.02 1npz s SER 86 Ca 0.60 1.48 -0.07 0.00 0.48 0.00 0.00 55.95 58.45 1npz s SER 86 Cb -0.13 -2.48 0.22 0.00 0.10 0.00 0.00 66.02 63.72 1npz s SER 86 CO 0.53 -0.77 1.85 -0.78 0.98 0.00 0.00 173.24 175.04 1npz h ASP 87 N 0.13 1.12 -0.91 7.02 3.58 -1.29 -1.80 116.42 124.27 1npz h ASP 87 Ca -0.45 -0.11 0.09 0.00 0.42 0.00 0.00 57.03 56.98 1npz h ASP 87 Cb 1.19 -0.29 -0.07 0.00 1.72 0.00 0.00 39.33 41.88 1npz h ASP 87 CO 0.62 0.91 0.55 0.00 -2.88 0.00 0.00 179.24 178.44 1npz h ALA 88 N 1.27 1.31 0.00 -0.78 0.00 -1.93 -1.44 119.26 117.68 1npz h ALA 88 Ca 0.31 0.01 -0.11 0.00 0.00 0.00 0.00 54.91 55.12 1npz h ALA 88 Cb 0.06 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 1npz h ALA 88 CO -0.05 0.22 -0.78 0.66 0.00 0.00 0.00 179.25 179.30 1npz h SER 89 N 0.94 0.00 -2.45 0.00 4.64 -1.86 -3.40 113.55 111.42 1npz h SER 89 Ca 0.43 0.00 -0.59 0.00 -0.47 0.00 0.00 61.79 61.16 1npz h SER 89 Cb 0.34 0.00 -0.39 0.00 -0.31 0.00 0.00 62.40 62.04 1npz h SER 89 CO -0.23 0.46 -0.90 0.00 -0.87 0.00 0.00 176.83 175.29 1npz n TYR 90 N -3.08 0.20 -1.39 4.77 4.19 -0.71 -5.02 117.16 116.13 1npz n TYR 90 Ca -0.02 -3.58 -0.34 0.00 3.31 0.00 0.00 57.90 57.27 1npz n TYR 90 Cb 0.74 -0.04 0.10 0.00 0.49 0.00 0.00 39.34 40.63 1npz n TYR 90 CO 0.00 0.00 0.00 -2.14 0.91 0.00 0.00 176.86 175.63 1npz s PRO 91 N -0.54 2.07 -0.13 2.98 0.02 -0.60 -4.50 135.00 134.30 1npz s PRO 91 Ca 0.32 1.77 -0.28 0.00 0.02 0.00 0.00 61.00 62.83 1npz s PRO 91 Cb 0.05 -1.82 -0.01 0.00 0.02 0.00 0.00 34.50 32.73 1npz s PRO 91 CO -0.17 -1.89 0.94 -0.47 -0.33 0.00 0.00 177.00 175.07 1npz s TYR 92 N -1.98 3.48 -0.61 6.54 5.04 -1.26 -4.70 117.35 123.86 1npz s TYR 92 Ca 0.74 1.47 0.11 0.00 -2.44 0.00 0.00 57.07 56.95 1npz s TYR 92 Cb -0.29 -3.12 -0.10 0.00 0.35 0.00 0.00 41.96 38.80 1npz s TYR 92 CO 0.46 -0.22 0.50 1.63 -1.34 0.00 0.00 175.55 176.58 1npz n LYS 93 N 5.05 3.16 -3.01 4.97 4.76 -1.26 -5.00 118.16 126.84 1npz n LYS 93 Ca 0.07 -0.12 -0.22 0.00 -2.87 0.00 0.00 58.31 55.16 1npz n LYS 93 Cb 0.49 -1.03 0.03 0.00 -1.84 0.00 0.00 35.03 32.68 1npz n LYS 93 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1npz n ALA 94 N -1.06 -0.97 -2.64 7.82 0.00 -1.26 -4.98 120.51 117.43 1npz n ALA 94 Ca 0.03 0.27 -0.09 0.00 0.00 0.00 0.00 53.44 53.65 1npz n ALA 94 Cb 0.18 -3.76 -0.07 0.00 0.00 0.00 0.00 19.45 15.80 1npz n ALA 94 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1npz s MET 95 N -5.69 0.85 -0.18 0.00 -1.94 -1.26 -4.50 119.30 106.57 1npz s MET 95 Ca 0.30 -0.89 -0.25 0.00 -1.71 0.00 0.00 55.69 53.14 1npz s MET 95 Cb -0.13 0.35 -0.01 0.00 2.01 0.00 0.00 34.83 37.04 1npz s MET 95 CO 0.37 -0.27 0.82 -0.51 -0.01 0.00 0.00 175.02 175.41 1npz s ASP 96 N -2.75 6.93 0.46 3.03 1.01 -1.26 -4.90 116.67 119.19 1npz s ASP 96 Ca 0.03 1.14 0.03 0.00 0.71 0.00 0.00 52.55 54.46 1npz s ASP 96 Cb 0.04 -2.45 -0.02 0.00 1.01 0.00 0.00 42.92 41.50 1npz s ASP 96 CO -0.10 -0.40 0.05 -1.10 0.21 0.00 0.00 175.17 173.83 1npz s GLN 97 N 2.21 2.07 0.36 8.23 -0.21 -1.26 -5.09 119.66 125.97 1npz s GLN 97 Ca 0.37 -2.29 -0.25 0.00 0.02 0.00 0.00 55.36 53.22 1npz s GLN 97 Cb -0.16 -1.16 -0.10 0.00 1.00 0.00 0.00 33.01 32.59 1npz s GLN 97 CO 0.12 -0.39 0.97 0.15 -2.12 0.00 0.00 175.29 174.02 1npz s LYS 98 N -3.80 4.43 -0.03 2.91 1.02 -1.26 -4.61 119.74 118.40 1npz s LYS 98 Ca 0.15 1.33 -0.30 0.00 0.02 0.00 0.00 55.97 57.17 1npz s LYS 98 Cb 0.03 -2.63 -0.08 0.00 -0.52 0.00 0.00 37.83 34.63 1npz s LYS 98 CO 0.09 0.13 1.99 0.00 -0.92 0.00 0.00 175.35 176.64 1npz n GLN 100 N 7.78 3.15 -2.03 0.00 -0.06 -1.26 -5.02 117.38 119.93 1npz n GLN 100 Ca 0.22 -4.13 -0.41 0.00 -2.00 0.00 0.00 57.00 50.67 1npz n GLN 100 Cb 0.42 -2.11 -0.02 0.00 -4.06 0.00 0.00 30.24 24.47 1npz n GLN 100 CO 0.00 0.00 0.00 -0.47 -0.20 0.00 0.00 177.06 176.39 1npz s TYR 101 N -3.57 3.00 -0.19 3.69 5.04 -1.26 -5.02 117.35 119.04 1npz s TYR 101 Ca 0.45 1.17 -0.01 0.00 -2.44 0.00 0.00 57.07 56.25 1npz s TYR 101 Cb 0.40 -3.79 0.05 0.00 0.35 0.00 0.00 41.96 38.97 1npz s TYR 101 CO -0.04 -2.41 -0.04 0.34 -1.34 0.00 0.00 175.55 172.06 1npz s ASP 102 N 0.04 3.09 0.58 4.32 -1.08 -1.26 -4.99 116.67 117.38 1npz s ASP 102 Ca 0.55 -0.82 0.28 0.00 -0.52 0.00 0.00 52.55 52.04 1npz s ASP 102 Cb -0.41 -0.92 1.58 0.00 -1.46 0.00 0.00 42.92 41.71 1npz s ASP 102 CO 0.48 -0.22 2.05 0.77 0.52 0.00 0.00 175.17 178.77 1npz h SER 103 N 8.10 0.00 -0.14 -0.34 4.64 -1.99 -0.58 113.55 123.24 1npz h SER 103 Ca -0.21 0.00 0.04 0.00 -0.47 0.00 0.00 61.79 61.15 1npz h SER 103 Cb 1.10 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.19 1npz h SER 103 CO 0.39 0.00 0.12 0.11 -0.87 0.00 0.00 176.83 176.58 1npz h LYS 104 N 0.00 0.00 -0.44 4.77 1.57 -2.03 -1.82 116.57 118.62 1npz h LYS 104 Ca 0.12 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.90 1npz h LYS 104 Cb 0.65 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.96 1npz h LYS 104 CO -0.00 0.00 0.00 0.66 -0.57 0.00 0.00 179.45 179.54 1npz n TYR 105 N -4.29 1.47 -1.68 -1.35 4.01 -0.23 -5.00 117.16 110.10 1npz n TYR 105 Ca 0.01 -0.77 -0.45 0.00 -0.16 0.00 0.00 57.90 56.53 1npz n TYR 105 Cb 0.24 -0.38 -0.04 0.00 -0.31 0.00 0.00 39.34 38.85 1npz n TYR 105 CO 0.00 0.00 0.00 -2.13 -0.46 0.00 0.00 176.86 174.27 1npz n ARG 106 N 0.21 2.40 -0.00 -0.72 0.63 -0.69 -3.12 116.66 115.37 1npz n ARG 106 Ca 0.24 0.87 0.05 0.00 -0.92 0.00 0.00 57.85 58.09 1npz n ARG 106 Cb 1.00 -2.69 -0.06 0.00 0.45 0.00 0.00 32.46 31.16 1npz n ARG 106 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1npz n ALA 107 N 4.49 3.34 -3.54 5.13 0.00 -0.13 -4.87 120.51 124.93 1npz n ALA 107 Ca 0.18 -0.30 -0.07 0.00 0.00 0.00 0.00 53.44 53.25 1npz n ALA 107 Cb 0.32 -0.38 -0.02 0.00 0.00 0.00 0.00 19.45 19.37 1npz n ALA 107 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1npz s ALA 108 N -2.02 -1.82 0.33 0.00 0.00 -1.13 -4.98 121.76 112.14 1npz s ALA 108 Ca 0.04 0.92 0.03 0.00 0.00 0.00 0.00 51.96 52.95 1npz s ALA 108 Cb 0.08 0.41 -0.05 0.00 0.00 0.00 0.00 23.12 23.56 1npz s ALA 108 CO 0.43 -0.74 0.08 0.95 0.00 0.00 0.00 175.76 176.49 1npz s THR 109 N -3.09 0.95 -0.05 0.00 -4.23 -1.26 -1.55 115.64 106.41 1npz s THR 109 Ca 0.06 -2.00 -0.02 0.00 -1.18 0.00 0.00 61.69 58.55 1npz s THR 109 Cb -0.01 -2.67 0.03 0.00 1.34 0.00 0.00 72.50 71.20 1npz s THR 109 CO -0.07 0.00 0.11 0.00 -0.54 0.00 0.00 174.62 174.12 1npz n SER 111 N 4.05 0.05 -3.32 0.00 3.41 0.14 -4.19 113.62 113.76 1npz n SER 111 Ca -0.25 0.02 -0.02 0.00 -0.26 0.00 0.00 58.87 58.36 1npz n SER 111 Cb 0.52 1.36 0.02 0.00 -0.26 0.00 0.00 64.21 65.85 1npz n SER 111 CO 0.00 0.00 0.00 2.29 -0.16 0.00 0.00 175.04 177.17 1npz n LYS 112 N -2.56 0.58 -3.72 4.33 2.85 -1.08 -5.02 118.16 113.54 1npz n LYS 112 Ca -0.20 -1.37 -0.14 0.00 -1.05 0.00 0.00 58.31 55.56 1npz n LYS 112 Cb 0.90 1.88 -0.08 0.00 -0.65 0.00 0.00 35.03 37.08 1npz n LYS 112 CO 0.00 0.00 0.00 1.52 -0.05 0.00 0.00 177.40 178.87 1npz s TYR 113 N -2.16 -0.29 -0.06 5.58 1.13 -1.26 -1.04 117.35 119.25 1npz s TYR 113 Ca 0.23 0.52 0.03 0.00 -1.41 0.00 0.00 57.07 56.44 1npz s TYR 113 Cb -0.03 0.15 -0.03 0.00 -1.10 0.00 0.00 41.96 40.96 1npz s TYR 113 CO 0.05 -0.39 -0.13 0.99 -2.51 0.00 0.00 175.55 173.56 1npz s THR 114 N -1.06 3.19 -0.14 -3.49 2.01 0.08 -4.96 115.64 111.27 1npz s THR 114 Ca -0.11 -0.67 -0.03 0.00 0.31 0.00 0.00 61.69 61.18 1npz s THR 114 Cb -0.04 -2.26 -0.03 0.00 0.01 0.00 0.00 72.50 70.18 1npz s THR 114 CO 0.04 0.59 -0.03 -1.61 -0.69 0.00 0.00 174.62 172.93 1npz s GLU 115 N -0.70 3.51 0.35 4.92 2.02 -1.26 -1.69 118.70 125.86 1npz s GLU 115 Ca 0.11 -0.49 -0.07 0.00 0.02 0.00 0.00 54.97 54.53 1npz s GLU 115 Cb -0.11 -2.89 -0.05 0.00 0.10 0.00 0.00 34.13 31.18 1npz s GLU 115 CO 0.01 0.35 0.66 -0.51 0.02 0.00 0.00 175.26 175.79 1npz s LEU 116 N 0.07 3.93 0.24 1.80 1.43 -0.01 -5.00 118.68 121.15 1npz s LEU 116 Ca 0.00 0.89 -0.31 0.00 -1.03 0.00 0.00 54.13 53.68 1npz s LEU 116 Cb -0.13 -3.75 -0.12 0.00 0.03 0.00 0.00 46.19 42.22 1npz s LEU 116 CO 0.02 -0.31 1.63 -2.65 0.23 0.00 0.00 176.35 175.27 1npz n PRO 117 N -1.21 2.63 -1.63 1.29 -0.02 -1.26 -4.57 135.00 130.23 1npz n PRO 117 Ca 0.00 0.94 -0.51 0.00 -2.02 0.00 0.00 63.50 61.92 1npz n PRO 117 Cb 0.54 -2.74 -0.06 0.00 -0.02 0.00 0.00 33.50 31.23 1npz n PRO 117 CO 0.00 0.00 0.00 0.98 1.98 0.00 0.00 175.50 178.46 1npz n TYR 118 N 2.94 1.85 -0.88 6.00 9.36 -1.26 -2.65 117.16 132.52 1npz n TYR 118 Ca 0.12 0.47 0.00 0.00 3.32 0.00 0.00 57.90 61.82 1npz n TYR 118 Cb 0.35 -2.43 0.00 0.00 -0.63 0.00 0.00 39.34 36.63 1npz n TYR 118 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1npz n GLY 119 N 3.12 0.29 3.45 2.98 0.00 0.62 -4.96 105.19 110.69 1npz n GLY 119 Ca 0.19 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.78 1npz n GLY 119 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1npz s ARG 120 N -0.94 3.54 0.53 1.61 1.81 -1.08 -4.76 118.95 119.66 1npz s ARG 120 Ca 0.00 -1.66 0.32 0.00 -1.72 0.00 0.00 55.73 52.66 1npz s ARG 120 Cb 0.00 -4.84 1.35 0.00 -0.45 0.00 0.00 34.95 31.00 1npz s ARG 120 CO 0.00 -1.78 1.98 0.93 -0.68 0.00 0.00 175.30 175.76 1npz h GLU 121 N 8.92 0.00 -0.19 3.54 5.08 -1.90 -2.17 114.58 127.85 1npz h GLU 121 Ca 0.11 0.00 -0.19 0.00 -1.00 0.00 0.00 59.36 58.28 1npz h GLU 121 Cb 1.03 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.28 1npz h GLU 121 CO 1.12 0.06 -0.65 0.38 -1.00 0.00 0.00 179.01 178.92 1npz h ASP 122 N 0.00 0.81 0.14 1.42 2.03 -1.99 -1.55 116.42 117.28 1npz h ASP 122 Ca -0.00 -0.48 -0.17 0.00 -0.73 0.00 0.00 57.03 55.65 1npz h ASP 122 Cb 0.52 -0.24 -0.01 0.00 -0.83 0.00 0.00 39.33 38.77 1npz h ASP 122 CO 0.01 1.25 -0.61 0.58 -1.03 0.00 0.00 179.24 179.44 1npz h VAL 123 N 0.52 1.34 -0.78 4.15 2.07 -1.85 -2.61 116.25 119.09 1npz h VAL 123 Ca -0.01 -1.92 -0.04 0.00 0.82 0.00 0.00 66.70 65.55 1npz h VAL 123 Cb 1.24 1.91 -0.04 0.00 -1.52 0.00 0.00 31.29 32.89 1npz h VAL 123 CO 0.13 0.59 0.34 0.25 0.02 0.00 0.00 177.57 178.90 1npz h LEU 124 N 0.35 1.04 -0.24 2.57 5.85 -1.31 -2.14 115.31 121.43 1npz h LEU 124 Ca -0.01 -0.14 0.02 0.00 0.84 0.00 0.00 57.88 58.59 1npz h LEU 124 Cb 1.16 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.90 1npz h LEU 124 CO 0.11 0.90 0.10 0.50 -0.34 0.00 0.00 178.44 179.71 1npz h LYS 125 N 1.12 0.22 -0.43 1.25 3.64 -1.05 0.55 116.57 121.88 1npz h LYS 125 Ca 0.27 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.62 1npz h LYS 125 Cb 0.16 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 31.91 1npz h LYS 125 CO -0.03 0.15 0.24 0.93 -2.27 0.00 0.00 179.45 178.47 1npz h GLU 126 N 0.23 0.59 -0.54 1.90 5.08 -1.10 -1.68 114.58 119.07 1npz h GLU 126 Ca 0.10 -0.07 0.01 0.00 -1.00 0.00 0.00 59.36 58.40 1npz h GLU 126 Cb 0.04 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.15 1npz h GLU 126 CO -0.08 0.47 0.35 0.00 -1.00 0.00 0.00 179.01 178.75 1npz h ALA 127 N 1.09 0.69 -0.40 3.43 0.00 -1.14 0.35 119.26 123.27 1npz h ALA 127 Ca 0.15 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.95 1npz h ALA 127 Cb 0.05 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 1npz h ALA 127 CO -0.02 0.09 -0.07 0.28 0.00 0.00 0.00 179.25 179.52 1npz h VAL 128 N 0.70 1.24 0.09 0.00 2.07 -0.71 0.38 116.25 120.02 1npz h VAL 128 Ca 0.21 -1.06 -0.29 0.00 0.82 0.00 0.00 66.70 66.37 1npz h VAL 128 Cb -0.04 1.02 0.03 0.00 -1.52 0.00 0.00 31.29 30.77 1npz h VAL 128 CO -0.06 0.36 -1.20 0.00 0.02 0.00 0.00 177.57 176.69 1npz h ALA 129 N 1.28 0.02 0.09 1.67 0.00 -0.82 -3.33 119.26 118.18 1npz h ALA 129 Ca 0.12 -0.75 -0.36 0.00 0.00 0.00 0.00 54.91 53.91 1npz h ALA 129 Cb 0.51 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.37 1npz h ALA 129 CO 0.03 0.69 -2.03 0.09 0.00 0.00 0.00 179.25 178.02 1npz n ASN 130 N -3.81 1.85 -0.13 0.00 5.03 0.12 -4.77 115.26 113.55 1npz n ASN 130 Ca -0.13 0.19 -0.27 0.00 0.87 0.00 0.00 54.58 55.24 1npz n ASN 130 Cb 0.96 -0.62 -0.10 0.00 -1.02 0.00 0.00 39.78 39.00 1npz n ASN 130 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 1npz n LYS 131 N -3.36 0.58 -2.00 3.52 4.76 0.13 -5.05 118.16 116.74 1npz n LYS 131 Ca -0.32 0.37 0.00 0.00 -2.87 0.00 0.00 58.31 55.49 1npz n LYS 131 Cb 1.04 -1.58 0.00 0.00 -1.84 0.00 0.00 35.03 32.66 1npz n LYS 131 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1npz n GLY 132 N 1.32 -0.19 3.74 0.72 0.00 -0.90 -4.97 105.19 104.90 1npz n GLY 132 Ca -0.46 -1.57 -0.41 0.00 0.00 0.00 0.00 46.02 43.58 1npz n GLY 132 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1npz n PRO 133 N 0.00 2.24 -5.13 1.61 -0.02 -1.26 -4.11 135.00 128.34 1npz n PRO 133 Ca 0.00 0.79 -0.32 0.00 -2.02 0.00 0.00 63.50 61.96 1npz n PRO 133 Cb 0.00 -2.53 -0.15 0.00 -0.02 0.00 0.00 33.50 30.80 1npz n PRO 133 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1npz s VAL 134 N -1.16 2.44 0.13 -1.45 1.01 -0.59 -4.82 120.40 115.96 1npz s VAL 134 Ca 0.58 -0.94 -0.30 0.00 0.00 0.00 0.00 61.98 61.32 1npz s VAL 134 Cb -0.49 -1.91 -0.06 0.00 0.00 0.00 0.00 36.38 33.92 1npz s VAL 134 CO 0.60 0.58 0.98 -0.44 0.00 0.00 0.00 175.10 176.81 1npz s SER 135 N -0.44 7.49 0.14 3.32 0.01 -0.04 -0.42 113.70 123.76 1npz s SER 135 Ca 0.05 1.84 -0.04 0.00 1.31 0.00 0.00 55.95 59.11 1npz s SER 135 Cb -0.12 -2.59 -0.03 0.00 0.21 0.00 0.00 66.02 63.49 1npz s SER 135 CO 0.01 -0.06 0.13 0.68 0.41 0.00 0.00 173.24 174.41 1npz s VAL 136 N -0.12 0.09 0.05 3.43 -7.23 -0.73 -1.48 120.40 114.40 1npz s VAL 136 Ca 0.47 -1.75 0.05 0.00 -1.81 0.00 0.00 61.98 58.94 1npz s VAL 136 Cb -0.24 -1.99 -0.04 0.00 0.56 0.00 0.00 36.38 34.67 1npz s VAL 136 CO 0.31 -0.40 -0.09 -0.83 -0.31 0.00 0.00 175.10 173.77 1npz s GLY 137 N -3.03 1.74 0.05 2.32 0.00 -1.22 -1.77 107.32 105.42 1npz s GLY 137 Ca 0.22 -1.13 -0.02 0.00 0.00 0.00 0.00 44.72 43.80 1npz s GLY 137 CO 0.02 -1.04 -0.01 -1.34 0.00 0.00 0.00 173.10 170.73 1npz s VAL 138 N -1.07 0.21 -0.47 1.40 -7.23 -0.37 -3.95 120.40 108.91 1npz s VAL 138 Ca 0.19 -1.69 -0.26 0.00 -1.81 0.00 0.00 61.98 58.41 1npz s VAL 138 Cb -0.11 -1.41 0.03 0.00 0.56 0.00 0.00 36.38 35.45 1npz s VAL 138 CO 0.10 -0.94 0.95 -0.62 -0.31 0.00 0.00 175.10 174.28 1npz s ASP 139 N -2.80 6.49 -0.19 4.85 2.15 -0.18 -1.46 116.67 125.52 1npz s ASP 139 Ca 0.05 0.09 0.14 0.00 0.43 0.00 0.00 52.55 53.26 1npz s ASP 139 Cb 0.06 -2.46 0.40 0.00 -0.30 0.00 0.00 42.92 40.62 1npz s ASP 139 CO -0.09 -1.09 1.25 0.00 -0.17 0.00 0.00 175.17 175.06 1npz n ALA 140 N 7.27 3.17 -0.05 3.66 0.00 -1.26 -4.82 120.51 128.48 1npz n ALA 140 Ca 0.06 -2.93 -0.09 0.00 0.00 0.00 0.00 53.44 50.47 1npz n ALA 140 Cb 0.48 -0.45 0.05 0.00 0.00 0.00 0.00 19.45 19.53 1npz n ALA 140 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1npz n ARG 141 N -1.18 1.47 -4.67 0.00 1.74 -1.26 -4.74 116.66 108.02 1npz n ARG 141 Ca 0.20 -1.07 -0.23 0.00 -0.77 0.00 0.00 57.85 55.99 1npz n ARG 141 Cb 0.74 -1.42 -0.15 0.00 -1.02 0.00 0.00 32.46 30.61 1npz n ARG 141 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 1npz s HIS 142 N -1.19 1.32 0.55 -1.55 3.76 -1.26 -5.02 115.29 111.89 1npz s HIS 142 Ca 0.20 -0.26 0.31 0.00 -0.15 0.00 0.00 55.06 55.16 1npz s HIS 142 Cb 0.17 -0.85 1.47 0.00 1.11 0.00 0.00 32.58 34.48 1npz s HIS 142 CO 0.03 -0.04 1.89 -1.00 -0.85 0.00 0.00 174.74 174.77 1npz h PRO 143 N 5.84 0.00 -0.08 8.40 0.13 -2.00 -0.29 132.00 144.01 1npz h PRO 143 Ca -0.34 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.76 1npz h PRO 143 Cb 1.16 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.28 1npz h PRO 143 CO 0.49 0.00 -0.07 0.66 -0.23 0.00 0.00 178.00 178.84 1npz h SER 144 N 0.00 0.11 -0.04 1.44 4.64 -1.96 0.68 113.55 118.41 1npz h SER 144 Ca 0.39 -0.01 -0.14 0.00 -0.47 0.00 0.00 61.79 61.56 1npz h SER 144 Cb 1.63 -0.03 0.01 0.00 -0.31 0.00 0.00 62.40 63.70 1npz h SER 144 CO -0.00 0.20 -0.51 0.15 -0.87 0.00 0.00 176.83 175.80 1npz h PHE 145 N 0.12 0.60 -0.98 4.77 3.04 -1.38 -1.67 116.94 121.44 1npz h PHE 145 Ca 0.03 -0.29 0.01 0.00 3.98 0.00 0.00 57.97 61.69 1npz h PHE 145 Cb 0.21 -0.08 -0.05 0.00 2.56 0.00 0.00 35.95 38.59 1npz h PHE 145 CO 0.00 1.09 0.65 0.35 -2.02 0.00 0.00 178.31 178.38 1npz h PHE 146 N -0.06 1.23 -0.08 0.41 3.57 -1.36 -2.83 116.94 117.81 1npz h PHE 146 Ca -0.05 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.48 1npz h PHE 146 Cb 1.20 -0.41 0.00 0.00 2.79 0.00 0.00 35.95 39.52 1npz h PHE 146 CO 0.14 0.77 0.00 1.28 -2.23 0.00 0.00 178.31 178.26 1npz n LEU 147 N -4.39 1.50 -4.65 0.59 4.77 0.19 -4.91 117.00 110.10 1npz n LEU 147 Ca 0.12 -0.57 -0.48 0.00 -0.03 0.00 0.00 56.01 55.06 1npz n LEU 147 Cb 0.02 -0.05 -0.05 0.00 -2.33 0.00 0.00 43.42 41.02 1npz n LEU 147 CO 0.37 0.28 1.15 0.00 -1.33 0.00 0.00 177.39 177.86 1npz n TYR 148 N 0.19 2.11 -0.03 -1.77 4.19 -0.64 -4.93 117.16 116.29 1npz n TYR 148 Ca 0.18 0.34 -0.07 0.00 3.31 0.00 0.00 57.90 61.65 1npz n TYR 148 Cb 0.33 -2.50 -0.02 0.00 0.49 0.00 0.00 39.34 37.63 1npz n TYR 148 CO 0.00 0.00 0.00 0.54 0.91 0.00 0.00 176.86 178.31 1npz n ARG 149 N 3.42 0.14 -3.73 2.98 1.74 -1.26 -2.81 116.66 117.15 1npz n ARG 149 Ca 0.18 0.06 -0.05 0.00 -0.77 0.00 0.00 57.85 57.27 1npz n ARG 149 Cb 0.26 -0.74 -0.02 0.00 -1.02 0.00 0.00 32.46 30.95 1npz n ARG 149 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1npz s SER 150 N -5.61 -0.24 0.00 0.55 1.04 -1.26 -3.59 113.70 104.60 1npz s SER 150 Ca -0.09 -0.38 0.00 0.00 0.48 0.00 0.00 55.95 55.96 1npz s SER 150 Cb 0.04 0.53 0.00 0.00 0.10 0.00 0.00 66.02 66.69 1npz s SER 150 CO 0.12 -0.97 0.00 0.61 0.98 0.00 0.00 173.24 173.98 1npz n GLY 151 N -0.44 -1.80 3.54 7.32 0.00 -1.26 -4.85 105.19 107.70 1npz n GLY 151 Ca -0.07 -1.84 -0.40 0.00 0.00 0.00 0.00 46.02 43.72 1npz n GLY 151 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1npz s VAL 152 N 0.00 5.28 -0.04 1.61 1.01 -1.26 -4.19 120.40 122.80 1npz s VAL 152 Ca 0.00 -0.13 -0.30 0.00 0.00 0.00 0.00 61.98 61.55 1npz s VAL 152 Cb 0.00 -3.70 -0.03 0.00 0.00 0.00 0.00 36.38 32.65 1npz s VAL 152 CO 0.00 0.02 1.13 -0.47 0.00 0.00 0.00 175.10 175.78 1npz s TYR 153 N 1.76 3.37 -0.08 5.22 5.04 0.16 -4.83 117.35 127.98 1npz s TYR 153 Ca 0.07 1.38 -0.03 0.00 -2.44 0.00 0.00 57.07 56.04 1npz s TYR 153 Cb -0.17 -3.33 0.05 0.00 0.35 0.00 0.00 41.96 38.86 1npz s TYR 153 CO 0.11 -0.89 0.16 -0.47 -1.34 0.00 0.00 175.55 173.12 1npz s TYR 154 N 1.82 -0.19 -0.28 4.97 5.04 -1.26 -1.27 117.35 126.17 1npz s TYR 154 Ca 0.54 0.60 0.02 0.00 -2.44 0.00 0.00 57.07 55.79 1npz s TYR 154 Cb -0.24 -0.19 0.08 0.00 0.35 0.00 0.00 41.96 41.96 1npz s TYR 154 CO 0.23 -0.24 -0.03 -2.00 -1.34 0.00 0.00 175.55 172.16 1npz s GLU 155 N 1.95 1.74 0.63 4.97 2.56 -1.26 -4.99 118.70 124.30 1npz s GLU 155 Ca -0.01 -1.41 0.33 0.00 0.00 0.00 0.00 54.97 53.89 1npz s GLU 155 Cb -0.12 -2.85 1.83 0.00 2.00 0.00 0.00 34.13 35.00 1npz s GLU 155 CO -0.06 -0.72 2.11 -1.00 -0.56 0.00 0.00 175.26 175.02 1npz h PRO 156 N 7.79 0.00 -0.01 4.30 0.13 -2.05 0.40 132.00 142.56 1npz h PRO 156 Ca -0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.99 1npz h PRO 156 Cb 1.04 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.17 1npz h PRO 156 CO 0.47 0.00 -0.01 0.43 -0.23 0.00 0.00 178.00 178.66 1npz n SER 157 N -3.36 0.66 -4.74 1.44 7.64 -1.26 -4.93 113.62 109.07 1npz n SER 157 Ca -0.00 -1.17 -0.36 0.00 1.01 0.00 0.00 58.87 58.35 1npz n SER 157 Cb 0.29 -0.01 0.07 0.00 -1.01 0.00 0.00 64.21 63.55 1npz n SER 157 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1npz s THR 159 N -1.70 1.00 -0.82 0.00 -4.23 -1.26 -4.77 115.64 103.86 1npz s THR 159 Ca 0.78 -2.00 0.26 0.00 -1.18 0.00 0.00 61.69 59.55 1npz s THR 159 Cb -0.32 -2.51 0.17 0.00 1.34 0.00 0.00 72.50 71.19 1npz s THR 159 CO 0.40 0.00 1.65 1.67 -0.54 0.00 0.00 174.62 177.80 1npz n GLN 160 N -0.91 0.16 -2.21 3.99 -0.06 -1.26 -3.15 117.38 113.94 1npz n GLN 160 Ca -0.07 0.09 -0.35 0.00 -2.00 0.00 0.00 57.00 54.67 1npz n GLN 160 Cb 0.66 -1.65 -0.04 0.00 -4.06 0.00 0.00 30.24 25.15 1npz n GLN 160 CO 0.00 0.00 0.00 -0.80 -0.20 0.00 0.00 177.06 176.06 1npz s ASN 161 N -3.82 5.57 0.48 1.69 0.01 -1.26 -4.60 114.94 113.01 1npz s ASN 161 Ca 0.10 -0.47 -0.20 0.00 -0.71 0.00 0.00 52.86 51.58 1npz s ASN 161 Cb 0.15 -2.55 -0.09 0.00 0.41 0.00 0.00 41.25 39.17 1npz s ASN 161 CO 0.63 -2.28 1.02 0.68 -1.51 0.00 0.00 177.10 175.64 1npz s VAL 162 N 8.23 3.92 0.00 1.60 -7.23 -1.26 -4.37 120.40 121.29 1npz s VAL 162 Ca 0.60 1.18 0.00 0.00 -1.81 0.00 0.00 61.98 61.95 1npz s VAL 162 Cb -0.07 -3.48 0.00 0.00 0.56 0.00 0.00 36.38 33.38 1npz s VAL 162 CO 0.06 -0.27 0.12 -0.46 -0.31 0.00 0.00 175.10 174.25 1npz n ASN 163 N -0.93 0.00 -3.86 4.85 0.23 -0.54 -4.89 115.26 110.13 1npz n ASN 163 Ca 0.09 -1.00 -0.19 0.00 -0.53 0.00 0.00 54.58 52.95 1npz n ASN 163 Cb 0.53 0.00 -0.16 0.00 -2.08 0.00 0.00 39.78 38.07 1npz n ASN 163 CO 0.00 0.00 0.00 -2.28 -0.93 0.00 0.00 177.26 174.05 1npz s HIS 164 N 0.00 0.54 -0.23 -2.53 5.04 -0.61 -4.93 115.29 112.57 1npz s HIS 164 Ca 0.00 -0.11 -0.13 0.00 -1.54 0.00 0.00 55.06 53.28 1npz s HIS 164 Cb 0.00 -0.54 -0.04 0.00 0.04 0.00 0.00 32.58 32.04 1npz s HIS 164 CO 0.00 -0.16 0.29 0.20 -2.34 0.00 0.00 174.74 172.73 1npz s GLY 165 N 0.96 2.01 0.09 1.59 0.00 -1.26 -1.24 107.32 109.46 1npz s GLY 165 Ca -0.11 -0.74 0.01 0.00 0.00 0.00 0.00 44.72 43.89 1npz s GLY 165 CO -0.01 0.67 0.05 3.33 0.00 0.00 0.00 173.10 177.15 1npz n VAL 166 N 4.49 0.00 -4.29 1.40 0.24 -0.73 -4.29 118.33 115.15 1npz n VAL 166 Ca -0.11 -0.57 -0.24 0.00 -2.04 0.00 0.00 64.34 61.38 1npz n VAL 166 Cb 0.51 0.25 -0.17 0.00 -1.47 0.00 0.00 33.84 32.97 1npz n VAL 166 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 1npz s LEU 167 N 0.00 1.41 -0.39 1.34 2.96 -1.02 -1.77 118.68 121.22 1npz s LEU 167 Ca 0.08 -0.25 -0.22 0.00 -0.22 0.00 0.00 54.13 53.52 1npz s LEU 167 Cb 0.00 -0.72 0.01 0.00 0.50 0.00 0.00 46.19 45.98 1npz s LEU 167 CO 0.05 -0.03 0.70 -0.69 -1.32 0.00 0.00 176.35 175.06 1npz s VAL 168 N 1.03 4.80 -1.77 1.68 1.01 0.44 -0.19 120.40 127.40 1npz s VAL 168 Ca -0.08 0.55 0.17 0.00 0.00 0.00 0.00 61.98 62.62 1npz s VAL 168 Cb -0.15 -4.17 0.33 0.00 0.00 0.00 0.00 36.38 32.40 1npz s VAL 168 CO -0.00 -0.45 1.25 1.33 0.00 0.00 0.00 175.10 177.22 1npz n VAL 169 N 5.77 0.56 -2.24 2.92 0.24 0.02 -1.55 118.33 124.05 1npz n VAL 169 Ca 0.00 -0.78 0.00 0.00 -2.04 0.00 0.00 64.34 61.52 1npz n VAL 169 Cb 0.48 0.88 0.00 0.00 -1.47 0.00 0.00 33.84 33.73 1npz n VAL 169 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1npz n GLY 170 N 1.04 -1.47 3.71 7.63 0.00 -1.18 -1.42 105.19 113.49 1npz n GLY 170 Ca 0.15 -1.02 -0.09 0.00 0.00 0.00 0.00 46.02 45.06 1npz n GLY 170 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1npz s TYR 171 N -2.66 -0.31 -2.48 1.61 -0.85 -0.39 -0.66 117.35 111.61 1npz s TYR 171 Ca 0.00 -0.06 0.00 0.00 -0.52 0.00 0.00 57.07 56.49 1npz s TYR 171 Cb 0.00 0.66 0.00 0.00 0.38 0.00 0.00 41.96 43.00 1npz s TYR 171 CO 0.00 -1.10 0.00 0.41 -1.52 0.00 0.00 175.55 173.34 1npz n GLY 172 N -0.43 -0.57 3.00 5.49 0.00 -1.11 -1.77 105.19 109.79 1npz n GLY 172 Ca -0.08 -0.72 -0.09 0.00 0.00 0.00 0.00 46.02 45.12 1npz n GLY 172 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1npz s ASP 173 N -4.00 0.24 -0.33 1.61 -4.77 -1.26 -1.66 116.67 106.50 1npz s ASP 173 Ca 0.00 -0.51 0.03 0.00 -3.30 0.00 0.00 52.55 48.77 1npz s ASP 173 Cb 0.00 0.11 0.10 0.00 -1.09 0.00 0.00 42.92 42.04 1npz s ASP 173 CO 0.00 -0.32 0.05 -0.22 0.70 0.00 0.00 175.17 175.38 1npz s LEU 174 N -1.55 4.36 -1.44 2.11 2.96 -0.30 -4.63 118.68 120.20 1npz s LEU 174 Ca -0.14 -2.06 -0.07 0.00 -0.22 0.00 0.00 54.13 51.63 1npz s LEU 174 Cb -0.09 -1.51 0.04 0.00 0.50 0.00 0.00 46.19 45.13 1npz s LEU 174 CO -0.01 -0.38 0.77 0.59 -1.32 0.00 0.00 176.35 175.99 1npz n ASN 175 N 4.34 -2.55 0.00 3.68 3.02 -1.26 -1.82 115.26 120.68 1npz n ASN 175 Ca 0.03 -0.85 0.00 0.00 -0.03 0.00 0.00 54.58 53.73 1npz n ASN 175 Cb 0.42 -3.73 0.00 0.00 -0.61 0.00 0.00 39.78 35.86 1npz n ASN 175 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1npz n GLY 176 N -1.68 2.94 3.64 7.41 0.00 -1.26 -5.04 105.19 111.20 1npz n GLY 176 Ca -0.15 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.45 1npz n GLY 176 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1npz s LYS 177 N -0.10 3.89 0.22 1.61 -0.14 -0.75 -4.93 119.74 119.54 1npz s LYS 177 Ca 0.00 1.71 -0.30 0.00 -1.36 0.00 0.00 55.97 56.02 1npz s LYS 177 Cb 0.00 -4.00 -0.08 0.00 -1.68 0.00 0.00 37.83 32.07 1npz s LYS 177 CO 0.00 -1.18 1.06 -1.21 -0.76 0.00 0.00 175.35 173.26 1npz s GLU 178 N 4.46 4.67 0.20 1.68 2.02 -1.26 -1.15 118.70 129.31 1npz s GLU 178 Ca 0.69 1.69 -0.06 0.00 0.02 0.00 0.00 54.97 57.31 1npz s GLU 178 Cb -0.25 -3.25 -0.02 0.00 0.10 0.00 0.00 34.13 30.70 1npz s GLU 178 CO 0.28 0.22 0.25 1.52 0.02 0.00 0.00 175.26 177.54 1npz s TYR 179 N -0.72 0.74 -0.12 1.61 -0.85 -0.66 -1.93 117.35 115.41 1npz s TYR 179 Ca 0.46 -1.05 -0.02 0.00 -0.52 0.00 0.00 57.07 55.95 1npz s TYR 179 Cb -0.29 -0.23 -0.03 0.00 0.38 0.00 0.00 41.96 41.79 1npz s TYR 179 CO 0.36 -0.74 -0.06 -1.58 -1.52 0.00 0.00 175.55 172.01 1npz s TRP 180 N -4.07 2.97 -0.26 -3.49 0.52 0.19 -2.73 118.94 112.08 1npz s TRP 180 Ca 0.28 -0.22 -0.23 0.00 0.02 0.00 0.00 56.10 55.96 1npz s TRP 180 Cb 0.04 -1.85 -0.01 0.00 -1.15 0.00 0.00 33.47 30.50 1npz s TRP 180 CO 0.07 0.09 0.74 -1.17 0.02 0.00 0.00 176.95 176.70 1npz s LEU 181 N -0.08 4.08 -0.15 2.99 2.96 0.17 -1.18 118.68 127.47 1npz s LEU 181 Ca 0.01 0.81 0.02 0.00 -0.22 0.00 0.00 54.13 54.75 1npz s LEU 181 Cb -0.13 -3.03 0.01 0.00 0.50 0.00 0.00 46.19 43.54 1npz s LEU 181 CO 0.03 -0.49 -0.21 -0.69 -1.32 0.00 0.00 176.35 173.67 1npz s VAL 182 N 2.75 2.01 -0.21 1.68 1.01 -0.28 -0.80 120.40 126.56 1npz s VAL 182 Ca 0.31 -0.94 -0.25 0.00 0.00 0.00 0.00 61.98 61.10 1npz s VAL 182 Cb -0.15 -1.79 -0.01 0.00 0.00 0.00 0.00 36.38 34.43 1npz s VAL 182 CO 0.09 0.54 0.84 -0.75 0.00 0.00 0.00 175.10 175.82 1npz s LYS 183 N 0.95 4.24 0.56 2.72 2.20 0.73 -1.02 119.74 130.11 1npz s LYS 183 Ca -0.04 0.99 0.09 0.00 -0.36 0.00 0.00 55.97 56.65 1npz s LYS 183 Cb -0.15 -3.61 0.08 0.00 -1.51 0.00 0.00 37.83 32.64 1npz s LYS 183 CO -0.05 -0.43 0.77 1.21 -0.36 0.00 0.00 175.35 176.49 1npz s ASN 184 N 1.24 5.15 -0.32 1.43 2.47 -0.79 -2.42 114.94 121.70 1npz s ASN 184 Ca 0.37 -0.75 0.12 0.00 0.42 0.00 0.00 52.86 53.02 1npz s ASN 184 Cb -0.16 0.12 0.46 0.00 -1.45 0.00 0.00 41.25 40.22 1npz s ASN 184 CO 0.10 -1.28 1.13 -1.54 -3.72 0.00 0.00 177.10 171.79 1npz n SER 185 N -2.21 3.71 -0.60 -4.21 3.41 -1.26 -4.55 113.62 107.91 1npz n SER 185 Ca 0.14 -3.22 0.05 0.00 -0.26 0.00 0.00 58.87 55.58 1npz n SER 185 Cb 0.61 -0.42 0.20 0.00 -0.26 0.00 0.00 64.21 64.34 1npz n SER 185 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 1npz n TRP 186 N -0.56 0.19 0.00 7.33 8.01 -1.20 -1.65 117.44 129.56 1npz n TRP 186 Ca 0.30 -1.41 0.00 0.00 -1.31 0.00 0.00 57.50 55.09 1npz n TRP 186 Cb 0.85 -0.27 0.00 0.00 -2.01 0.00 0.00 31.31 29.88 1npz n TRP 186 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1npz n GLY 187 N -1.16 -0.72 0.26 6.99 0.00 -0.46 -4.33 105.19 105.77 1npz n GLY 187 Ca 0.21 -1.68 0.13 0.00 0.00 0.00 0.00 46.02 44.67 1npz n GLY 187 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 1npz h HIS 188 N 0.00 0.00 0.00 1.61 3.86 -1.84 -3.13 115.15 115.65 1npz h HIS 188 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1npz h HIS 188 Cb 0.00 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.47 1npz h HIS 188 CO 0.00 0.13 0.00 0.09 0.86 0.00 0.00 177.93 179.01 1npz n ASN 189 N -3.46 0.00 -4.80 2.45 3.02 -1.26 -2.57 115.26 108.63 1npz n ASN 189 Ca -0.01 0.03 -0.39 0.00 -0.03 0.00 0.00 54.58 54.19 1npz n ASN 189 Cb 0.30 -0.34 -0.06 0.00 -0.61 0.00 0.00 39.78 39.07 1npz n ASN 189 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 1npz s PHE 190 N -2.67 3.82 0.00 3.10 5.36 -1.18 -4.90 117.98 121.50 1npz s PHE 190 Ca 0.23 1.37 0.00 0.00 -0.96 0.00 0.00 56.93 57.57 1npz s PHE 190 Cb 0.18 -2.57 0.00 0.00 -0.34 0.00 0.00 43.02 40.29 1npz s PHE 190 CO 0.44 0.55 0.00 0.41 -1.46 0.00 0.00 175.22 175.16 1npz n GLY 191 N 1.58 2.16 3.46 13.12 0.00 -1.12 0.56 105.19 124.95 1npz n GLY 191 Ca -0.08 -0.09 -0.44 0.00 0.00 0.00 0.00 46.02 45.41 1npz n GLY 191 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1npz s GLU 192 N 0.00 3.71 -1.48 1.61 2.02 0.25 -4.36 118.70 120.45 1npz s GLU 192 Ca 0.00 -1.91 -0.12 0.00 0.02 0.00 0.00 54.97 52.96 1npz s GLU 192 Cb 0.00 -4.99 0.06 0.00 0.10 0.00 0.00 34.13 29.31 1npz s GLU 192 CO 0.00 -1.81 0.91 0.39 0.02 0.00 0.00 175.26 174.78 1npz n GLU 193 N 6.52 -5.59 0.00 1.61 1.02 -1.23 -1.81 120.64 121.17 1npz n GLU 193 Ca 0.28 0.66 0.00 0.00 -0.02 0.00 0.00 57.16 58.07 1npz n GLU 193 Cb 0.48 -5.55 0.00 0.00 -0.02 0.00 0.00 31.44 26.35 1npz n GLU 193 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1npz n GLY 194 N -1.66 0.54 3.83 0.62 0.00 0.19 -4.70 105.19 104.00 1npz n GLY 194 Ca 0.01 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.82 1npz n GLY 194 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1npz s TYR 195 N -2.15 2.93 -0.02 1.61 1.51 -0.75 -1.89 117.35 118.59 1npz s TYR 195 Ca 0.00 -0.26 -0.02 0.00 -1.01 0.00 0.00 57.07 55.79 1npz s TYR 195 Cb 0.00 -1.66 0.01 0.00 -0.11 0.00 0.00 41.96 40.20 1npz s TYR 195 CO 0.00 0.30 0.05 -1.50 -1.11 0.00 0.00 175.55 173.29 1npz s ILE 196 N -2.27 -0.01 -0.38 2.71 2.07 -0.19 -0.58 121.20 122.54 1npz s ILE 196 Ca 0.38 0.04 -0.13 0.00 -1.41 0.00 0.00 60.65 59.53 1npz s ILE 196 Cb -0.06 -0.09 0.02 0.00 0.13 0.00 0.00 42.46 42.46 1npz s ILE 196 CO 0.26 0.02 0.25 -0.13 -1.91 0.00 0.00 174.94 173.42 1npz s ARG 197 N 0.24 3.01 0.06 3.50 0.52 -1.26 -1.13 118.95 123.89 1npz s ARG 197 Ca -0.02 -0.97 -0.04 0.00 -0.52 0.00 0.00 55.73 54.18 1npz s ARG 197 Cb -0.03 -3.83 -0.05 0.00 0.52 0.00 0.00 34.95 31.56 1npz s ARG 197 CO -0.01 -0.67 0.27 -1.64 0.02 0.00 0.00 175.30 173.28 1npz s MET 198 N 1.63 3.54 0.19 3.54 -1.94 -0.33 0.37 119.30 126.30 1npz s MET 198 Ca 0.04 -0.22 -0.33 0.00 -1.71 0.00 0.00 55.69 53.48 1npz s MET 198 Cb -0.19 -3.00 -0.13 0.00 2.01 0.00 0.00 34.83 33.52 1npz s MET 198 CO 0.08 0.58 1.60 0.00 -0.01 0.00 0.00 175.02 177.28 1npz n ALA 199 N 0.53 1.85 -2.56 3.03 0.00 -0.40 0.58 120.51 123.54 1npz n ALA 199 Ca -0.07 0.42 -0.32 0.00 0.00 0.00 0.00 53.44 53.48 1npz n ALA 199 Cb 0.52 -2.40 -0.11 0.00 0.00 0.00 0.00 19.45 17.46 1npz n ALA 199 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1npz s ARG 200 N 0.75 2.42 -1.31 0.00 3.52 -0.81 -4.66 118.95 118.86 1npz s ARG 200 Ca 0.76 -0.80 -0.02 0.00 -0.13 0.00 0.00 55.73 55.54 1npz s ARG 200 Cb -0.61 -2.42 0.00 0.00 -1.56 0.00 0.00 34.95 30.36 1npz s ARG 200 CO 0.38 0.58 0.21 0.09 -0.81 0.00 0.00 175.30 175.75 1npz n ASN 201 N 1.51 -4.95 -2.68 -2.12 3.02 -1.26 -4.70 115.26 104.07 1npz n ASN 201 Ca -0.15 -0.11 -0.24 0.00 -0.03 0.00 0.00 54.58 54.05 1npz n ASN 201 Cb 0.52 -3.95 -0.01 0.00 -0.61 0.00 0.00 39.78 35.73 1npz n ASN 201 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1npz n LYS 202 N -2.88 2.96 -3.25 3.52 4.76 -1.26 -4.94 118.16 117.07 1npz n LYS 202 Ca -0.15 -4.40 -0.16 0.00 -2.87 0.00 0.00 58.31 50.73 1npz n LYS 202 Cb 0.62 -2.10 0.06 0.00 -1.84 0.00 0.00 35.03 31.78 1npz n LYS 202 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1npz n GLY 203 N -0.32 -0.19 3.44 0.72 0.00 -1.26 -3.31 105.19 104.28 1npz n GLY 203 Ca 0.32 0.01 -0.17 0.00 0.00 0.00 0.00 46.02 46.18 1npz n GLY 203 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1npz n ASN 204 N -2.25 -2.01 -4.68 1.61 5.15 -1.26 -4.87 115.26 106.94 1npz n ASN 204 Ca -0.09 -0.63 -0.45 0.00 -0.60 0.00 0.00 54.58 52.81 1npz n ASN 204 Cb 0.58 -5.08 -0.04 0.00 -0.53 0.00 0.00 39.78 34.71 1npz n ASN 204 CO 0.00 0.00 0.00 1.57 1.40 0.00 0.00 177.26 180.23 1npz n HIS 205 N -4.14 2.39 -1.81 1.20 -0.00 -1.21 -1.59 115.22 110.07 1npz n HIS 205 Ca -0.29 0.17 -0.18 0.00 -0.00 0.00 0.00 57.72 57.42 1npz n HIS 205 Cb 0.67 -2.59 -0.06 0.00 -0.00 0.00 0.00 29.99 28.01 1npz n HIS 205 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1npz n GLY 207 N -0.53 0.80 0.35 0.00 0.00 -0.62 -1.01 105.19 104.17 1npz n GLY 207 Ca -0.20 -0.26 0.23 0.00 0.00 0.00 0.00 46.02 45.80 1npz n GLY 207 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1npz h ILE 208 N 0.00 0.37 -0.50 -0.61 6.09 -1.57 0.29 117.51 121.58 1npz h ILE 208 Ca -0.13 -0.13 0.00 0.00 -1.37 0.00 0.00 64.86 63.23 1npz h ILE 208 Cb 0.68 -0.05 0.00 0.00 0.47 0.00 0.00 36.82 37.92 1npz h ILE 208 CO 0.19 0.07 0.00 0.00 -3.07 0.00 0.00 178.15 175.34 1npz n ALA 209 N -2.32 3.34 0.01 0.18 0.00 -1.26 -4.51 120.51 115.94 1npz n ALA 209 Ca 0.30 -1.89 -0.12 0.00 0.00 0.00 0.00 53.44 51.74 1npz n ALA 209 Cb 0.94 -0.95 0.01 0.00 0.00 0.00 0.00 19.45 19.45 1npz n ALA 209 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1npz h SER 210 N 3.36 0.67 -1.78 0.00 0.02 -0.69 0.18 113.55 115.31 1npz h SER 210 Ca 0.00 -0.40 -0.51 0.00 -0.84 0.00 0.00 61.79 60.04 1npz h SER 210 Cb 1.63 -0.20 -0.35 0.00 0.14 0.00 0.00 62.40 63.63 1npz h SER 210 CO 0.33 1.15 -1.00 0.33 -1.14 0.00 0.00 176.83 176.50 1npz n PHE 211 N -3.92 -0.93 -4.11 3.45 7.35 -1.26 -4.54 117.46 113.50 1npz n PHE 211 Ca -0.04 -3.23 -0.35 0.00 -0.76 0.00 0.00 57.45 53.06 1npz n PHE 211 Cb 0.67 0.04 -0.07 0.00 0.35 0.00 0.00 39.48 40.46 1npz n PHE 211 CO 0.00 0.00 0.00 -1.25 -0.76 0.00 0.00 176.76 174.75 1npz s PRO 212 N -0.70 3.17 0.10 -7.13 0.04 -1.26 -3.42 135.00 125.80 1npz s PRO 212 Ca 0.34 -0.35 -0.16 0.00 0.04 0.00 0.00 61.00 60.87 1npz s PRO 212 Cb 0.15 -2.95 0.03 0.00 0.04 0.00 0.00 34.50 31.78 1npz s PRO 212 CO -0.14 0.71 0.40 -1.54 0.04 0.00 0.00 177.00 176.46 1npz s SER 213 N -1.28 -0.23 -0.06 6.66 1.04 -0.55 -0.83 113.70 118.45 1npz s SER 213 Ca 0.18 -0.25 -0.12 0.00 0.48 0.00 0.00 55.95 56.24 1npz s SER 213 Cb -0.12 0.46 0.02 0.00 0.10 0.00 0.00 66.02 66.48 1npz s SER 213 CO 0.08 -0.80 0.29 -0.72 0.98 0.00 0.00 173.24 173.06 1npz s TYR 214 N -3.48 -0.22 0.62 5.02 1.13 -0.68 -0.86 117.35 118.89 1npz s TYR 214 Ca 0.01 0.46 -0.03 0.00 -1.41 0.00 0.00 57.07 56.10 1npz s TYR 214 Cb 0.01 0.09 0.04 0.00 -1.10 0.00 0.00 41.96 41.01 1npz s TYR 214 CO -0.10 -0.28 0.89 -1.25 -2.51 0.00 0.00 175.55 172.31 1npz s PRO 215 N -0.69 2.40 -0.09 -3.49 0.04 -1.26 -0.74 135.00 131.17 1npz s PRO 215 Ca -0.08 -0.49 -0.04 0.00 0.04 0.00 0.00 61.00 60.43 1npz s PRO 215 Cb -0.04 -2.33 0.05 0.00 0.04 0.00 0.00 34.50 32.22 1npz s PRO 215 CO 0.02 -0.96 0.19 -1.21 0.04 0.00 0.00 177.00 175.09 1npz s GLU 216 N -5.00 0.12 0.00 4.56 2.02 -0.21 -4.90 118.70 115.29 1npz s GLU 216 Ca 0.58 0.49 0.27 0.00 0.02 0.00 0.00 54.97 56.33 1npz s GLU 216 Cb -0.11 -0.16 1.58 0.00 0.10 0.00 0.00 34.13 35.55 1npz s GLU 216 CO 0.42 -0.20 1.93 -0.89 0.02 0.00 0.00 175.26 176.54