#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2e4j n SER 24 N 0.00 -4.31 -3.91 1.61 7.64 -1.26 -5.03 113.62 108.35 2e4j n SER 24 Ca 0.00 -0.64 -0.11 0.00 1.01 0.00 0.00 58.87 59.13 2e4j n SER 24 Cb 0.00 -4.98 -0.13 0.00 -1.01 0.00 0.00 64.21 58.09 2e4j n SER 24 CO 0.00 0.00 0.00 -1.58 -3.01 0.00 0.00 175.04 170.45 2e4j s GLN 25 N -4.80 0.13 0.17 1.43 2.00 -1.26 -5.03 119.66 112.30 2e4j s GLN 25 Ca 0.23 -0.24 0.00 0.00 -2.00 0.00 0.00 55.36 53.34 2e4j s GLN 25 Cb -0.03 0.05 0.00 0.00 0.80 0.00 0.00 33.01 33.83 2e4j s GLN 25 CO 0.70 -0.02 0.00 0.41 -0.50 0.00 0.00 175.29 175.88 2e4j n GLY 26 N 2.47 -1.02 1.51 2.59 0.00 -1.26 -5.01 105.19 104.47 2e4j n GLY 26 Ca -0.17 0.16 -0.04 0.00 0.00 0.00 0.00 46.02 45.97 2e4j n GLY 26 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2e4j n HIS 27 N -2.85 -0.67 0.68 1.61 -0.00 -1.26 -4.95 115.22 107.78 2e4j n HIS 27 Ca 0.00 -0.79 0.12 0.00 0.46 0.00 0.00 57.72 57.51 2e4j n HIS 27 Cb 0.00 0.82 0.47 0.00 -0.12 0.00 0.00 29.99 31.16 2e4j n HIS 27 CO 0.00 0.00 0.00 -0.40 0.46 0.00 0.00 176.34 176.40 2e4j n ASP 28 N -0.50 0.32 -3.03 0.26 5.68 -1.26 -4.83 116.55 113.20 2e4j n ASP 28 Ca -0.19 0.55 0.00 0.00 -0.50 0.00 0.00 54.79 54.65 2e4j n ASP 28 Cb 0.69 -0.63 0.00 0.00 -1.14 0.00 0.00 41.12 40.04 2e4j n ASP 28 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 2e4j n THR 29 N -1.82 0.00 -4.07 2.12 -2.24 -1.26 -5.01 114.28 102.00 2e4j n THR 29 Ca 0.05 0.00 -0.30 0.00 -2.27 0.00 0.00 64.05 61.53 2e4j n THR 29 Cb 0.30 0.00 -0.07 0.00 -2.10 0.00 0.00 70.33 68.46 2e4j n THR 29 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 2e4j s VAL 30 N -0.79 4.40 -0.30 2.28 -7.23 -1.26 -4.82 120.40 112.68 2e4j s VAL 30 Ca 0.00 -0.82 -0.28 0.00 -1.81 0.00 0.00 61.98 59.07 2e4j s VAL 30 Cb 0.00 -3.11 -0.02 0.00 0.56 0.00 0.00 36.38 33.80 2e4j s VAL 30 CO 0.00 0.13 1.84 -1.58 -0.31 0.00 0.00 175.10 175.18 2e4j s GLN 31 N -2.35 3.36 0.87 4.82 -0.44 -1.13 -4.97 119.66 119.82 2e4j s GLN 31 Ca 0.28 1.55 -0.10 0.00 -2.50 0.00 0.00 55.36 54.59 2e4j s GLN 31 Cb -0.12 -4.21 0.12 0.00 -1.64 0.00 0.00 33.01 27.16 2e4j s GLN 31 CO 0.21 -1.83 1.12 -2.14 0.50 0.00 0.00 175.29 173.16 2e4j s PRO 32 N 5.64 1.37 -0.89 1.67 0.02 -1.26 -4.21 135.00 137.35 2e4j s PRO 32 Ca 0.82 1.39 -0.03 0.00 0.02 0.00 0.00 61.00 63.19 2e4j s PRO 32 Cb -0.24 -1.78 -0.03 0.00 0.02 0.00 0.00 34.50 32.47 2e4j s PRO 32 CO 0.34 -2.33 0.79 0.09 -0.33 0.00 0.00 177.00 175.56 2e4j n ASN 33 N -4.02 -7.17 -4.53 2.53 3.02 -1.26 -4.99 115.26 98.84 2e4j n ASN 33 Ca 0.11 -0.40 -0.35 0.00 -0.03 0.00 0.00 54.58 53.91 2e4j n ASN 33 Cb 0.52 -5.12 -0.11 0.00 -0.61 0.00 0.00 39.78 34.46 2e4j n ASN 33 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 2e4j s PHE 34 N -3.18 3.15 -0.37 3.10 2.19 -1.26 -5.06 117.98 116.54 2e4j s PHE 34 Ca 0.21 -0.18 0.03 0.00 0.33 0.00 0.00 56.93 57.32 2e4j s PHE 34 Cb -0.03 -2.14 0.11 0.00 -1.31 0.00 0.00 43.02 39.64 2e4j s PHE 34 CO 0.75 -0.10 0.10 -0.65 1.83 0.00 0.00 175.22 177.15 2e4j s GLN 35 N 0.96 1.44 0.44 10.12 -0.21 -1.26 -4.86 119.66 126.29 2e4j s GLN 35 Ca 0.04 -1.89 0.12 0.00 0.02 0.00 0.00 55.36 53.64 2e4j s GLN 35 Cb -0.14 -3.01 1.00 0.00 1.00 0.00 0.00 33.01 31.86 2e4j s GLN 35 CO 0.03 -0.99 2.02 -0.56 -2.12 0.00 0.00 175.29 173.67 2e4j h GLN 36 N 7.45 0.40 0.00 2.91 3.07 -1.96 0.24 115.11 127.22 2e4j h GLN 36 Ca -0.06 -0.02 -0.01 0.00 0.09 0.00 0.00 58.65 58.64 2e4j h GLN 36 Cb 0.99 -0.09 -0.00 0.00 0.08 0.00 0.00 27.48 28.46 2e4j h GLN 36 CO 0.54 0.27 -0.06 -0.44 0.09 0.00 0.00 178.83 179.23 2e4j h ASP 37 N 0.42 0.00 1.30 0.06 3.32 -1.96 0.64 116.42 120.19 2e4j h ASP 37 Ca 0.21 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 57.17 2e4j h ASP 37 Cb 0.31 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.84 2e4j h ASP 37 CO -0.05 0.06 -0.73 0.50 -1.72 0.00 0.00 179.24 177.29 2e4j h LYS 38 N 0.00 0.00 -0.25 3.56 3.11 -1.37 -3.30 116.57 118.32 2e4j h LYS 38 Ca -0.00 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.84 2e4j h LYS 38 Cb 0.20 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.43 2e4j h LYS 38 CO 0.01 0.29 0.00 1.19 -2.81 0.00 0.00 179.45 178.12 2e4j n PHE 39 N -3.03 0.34 -0.88 1.91 3.01 -0.50 -5.04 117.46 113.27 2e4j n PHE 39 Ca -0.01 -0.46 -0.31 0.00 1.01 0.00 0.00 57.45 57.68 2e4j n PHE 39 Cb 0.70 -0.03 0.15 0.00 -0.01 0.00 0.00 39.48 40.29 2e4j n PHE 39 CO 0.00 0.00 0.00 -1.17 1.01 0.00 0.00 176.76 176.60 2e4j s LEU 40 N -0.98 2.81 0.00 4.37 2.96 0.21 -4.84 118.68 123.22 2e4j s LEU 40 Ca 0.18 2.03 0.00 0.00 -0.22 0.00 0.00 54.13 56.12 2e4j s LEU 40 Cb 0.09 -4.49 0.00 0.00 0.50 0.00 0.00 46.19 42.29 2e4j s LEU 40 CO 0.12 -2.81 0.00 0.61 -1.32 0.00 0.00 176.35 172.95 2e4j n GLY 41 N -0.24 0.23 3.85 7.98 0.00 -1.25 -5.01 105.19 110.74 2e4j n GLY 41 Ca 0.11 -2.03 -0.37 0.00 0.00 0.00 0.00 46.02 43.73 2e4j n GLY 41 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2e4j s ARG 42 N 0.00 3.58 -0.02 1.61 1.04 -1.26 -2.46 118.95 121.44 2e4j s ARG 42 Ca 0.00 -0.15 -0.00 0.00 -1.04 0.00 0.00 55.73 54.53 2e4j s ARG 42 Cb 0.00 -3.22 0.03 0.00 -2.04 0.00 0.00 34.95 29.72 2e4j s ARG 42 CO 0.00 0.68 0.03 -1.58 -0.04 0.00 0.00 175.30 174.39 2e4j s TRP 43 N -0.75 0.04 0.64 5.89 0.52 -0.61 -5.03 118.94 119.64 2e4j s TRP 43 Ca 0.14 0.13 -0.13 0.00 0.02 0.00 0.00 56.10 56.26 2e4j s TRP 43 Cb -0.12 -0.26 -0.02 0.00 -1.15 0.00 0.00 33.47 31.93 2e4j s TRP 43 CO 0.03 -0.10 1.05 0.71 0.02 0.00 0.00 176.95 178.66 2e4j s TYR 44 N 1.13 3.18 0.13 -1.98 2.02 -1.26 -2.20 117.35 118.38 2e4j s TYR 44 Ca -0.08 1.43 0.10 0.00 -0.37 0.00 0.00 57.07 58.15 2e4j s TYR 44 Cb -0.13 -2.88 -0.04 0.00 -0.40 0.00 0.00 41.96 38.50 2e4j s TYR 44 CO -0.03 -1.05 -0.21 0.45 -1.57 0.00 0.00 175.55 173.14 2e4j s SER 45 N -3.50 3.69 -0.16 2.29 0.15 -0.48 0.20 113.70 115.88 2e4j s SER 45 Ca 0.59 -0.65 0.00 0.00 0.70 0.00 0.00 55.95 56.60 2e4j s SER 45 Cb -0.14 -0.42 0.01 0.00 -1.71 0.00 0.00 66.02 63.76 2e4j s SER 45 CO 0.48 0.17 0.78 0.00 1.20 0.00 0.00 173.24 175.87 2e4j n ALA 46 N 0.74 -2.42 -3.25 5.45 0.00 -1.17 -4.48 120.51 115.38 2e4j n ALA 46 Ca -0.16 -0.17 0.03 0.00 0.00 0.00 0.00 53.44 53.14 2e4j n ALA 46 Cb 0.53 -0.78 -0.04 0.00 0.00 0.00 0.00 19.45 19.16 2e4j n ALA 46 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2e4j s GLY 47 N -0.03 0.24 -0.24 0.00 0.00 -0.99 -4.50 107.32 101.80 2e4j s GLY 47 Ca 0.00 3.59 -0.17 0.00 0.00 0.00 0.00 44.72 48.14 2e4j s GLY 47 CO -0.00 3.32 0.61 -2.27 0.00 0.00 0.00 173.10 174.75 2e4j s LEU 48 N 2.03 -0.55 -0.18 0.66 0.20 0.17 0.17 118.68 121.18 2e4j s LEU 48 Ca -0.01 1.29 -0.00 0.00 0.69 0.00 0.00 54.13 56.10 2e4j s LEU 48 Cb -0.02 2.08 0.01 0.00 -0.43 0.00 0.00 46.19 47.83 2e4j s LEU 48 CO -0.16 -0.22 -0.16 0.00 -0.29 0.00 0.00 176.35 175.52 2e4j s ALA 49 N 1.07 2.46 -0.23 5.97 0.00 0.04 0.21 121.76 131.27 2e4j s ALA 49 Ca -0.06 -1.18 -0.21 0.00 0.00 0.00 0.00 51.96 50.51 2e4j s ALA 49 Cb -0.05 -1.30 0.06 0.00 0.00 0.00 0.00 23.12 21.83 2e4j s ALA 49 CO -0.10 -0.31 0.62 -1.54 0.00 0.00 0.00 175.76 174.42 2e4j s SER 50 N 1.25 -0.64 -0.46 0.00 1.04 -1.04 0.11 113.70 113.96 2e4j s SER 50 Ca 0.03 1.24 -0.04 0.00 0.48 0.00 0.00 55.95 57.66 2e4j s SER 50 Cb -0.14 1.26 0.06 0.00 0.10 0.00 0.00 66.02 67.30 2e4j s SER 50 CO -0.08 -0.21 2.77 -3.20 0.98 0.00 0.00 173.24 173.49 2e4j n ASN 51 N 2.77 6.48 -4.95 7.02 5.15 -1.26 -4.12 115.26 126.35 2e4j n ASN 51 Ca -0.14 -3.21 -0.23 0.00 -0.60 0.00 0.00 54.58 50.40 2e4j n ASN 51 Cb 0.56 -1.23 0.04 0.00 -0.53 0.00 0.00 39.78 38.61 2e4j n ASN 51 CO 0.00 0.00 0.00 -0.44 1.40 0.00 0.00 177.26 178.22 2e4j s SER 52 N 0.35 5.34 -0.01 1.20 0.01 -1.26 -5.03 113.70 114.30 2e4j s SER 52 Ca 0.59 0.21 0.04 0.00 1.31 0.00 0.00 55.95 58.10 2e4j s SER 52 Cb 0.38 -1.14 0.06 0.00 0.21 0.00 0.00 66.02 65.53 2e4j s SER 52 CO -0.22 -1.12 1.03 -0.24 0.41 0.00 0.00 173.24 173.09 2e4j n SER 53 N -2.42 0.23 0.00 2.44 2.88 -1.26 -4.79 113.62 110.70 2e4j n SER 53 Ca 0.06 -2.06 0.00 0.00 -1.33 0.00 0.00 58.87 55.54 2e4j n SER 53 Cb 0.59 -0.22 0.00 0.00 -0.75 0.00 0.00 64.21 63.83 2e4j n SER 53 CO 0.00 0.00 0.00 1.87 -1.23 0.00 0.00 175.04 175.68 2e4j n TRP 54 N -0.02 0.00 0.03 0.66 -0.00 -1.26 -4.71 117.44 112.13 2e4j n TRP 54 Ca 0.02 -0.00 -0.01 0.00 -0.00 0.00 0.00 57.50 57.50 2e4j n TRP 54 Cb 0.74 -0.00 0.27 0.00 -0.00 0.00 0.00 31.31 32.33 2e4j n TRP 54 CO 0.00 0.00 0.00 0.35 -0.00 0.00 0.00 177.69 178.04 2e4j h PHE 55 N 0.00 0.47 -1.05 5.87 3.57 -2.00 -2.88 116.94 120.92 2e4j h PHE 55 Ca 0.00 -0.07 0.28 0.00 3.53 0.00 0.00 57.97 61.71 2e4j h PHE 55 Cb 0.10 -0.13 -0.08 0.00 2.79 0.00 0.00 35.95 38.64 2e4j h PHE 55 CO 0.00 0.57 0.70 0.07 -2.23 0.00 0.00 178.31 177.42 2e4j h ARG 56 N 0.41 0.29 0.00 1.11 -0.00 -1.96 1.19 114.38 115.42 2e4j h ARG 56 Ca 0.07 -0.02 0.00 0.00 -0.00 0.00 0.00 59.98 60.04 2e4j h ARG 56 Cb 0.50 -0.06 0.00 0.00 -0.00 0.00 0.00 29.97 30.40 2e4j h ARG 56 CO 0.03 0.19 0.00 0.39 -0.00 0.00 0.00 179.97 180.58 2e4j n GLU 57 N -4.52 0.08 -0.02 0.08 1.02 -1.09 -2.98 120.64 113.22 2e4j n GLU 57 Ca 0.25 0.20 -0.03 0.00 -0.02 0.00 0.00 57.16 57.56 2e4j n GLU 57 Cb 0.95 -1.63 -0.03 0.00 -0.02 0.00 0.00 31.44 30.71 2e4j n GLU 57 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2e4j n LYS 58 N -1.78 2.35 0.27 3.49 4.76 0.31 -4.59 118.16 122.98 2e4j n LYS 58 Ca 0.05 0.01 0.16 0.00 -2.87 0.00 0.00 58.31 55.66 2e4j n LYS 58 Cb 0.28 -1.10 0.73 0.00 -1.84 0.00 0.00 35.03 33.10 2e4j n LYS 58 CO 0.00 0.00 0.00 1.57 -1.37 0.00 0.00 177.40 177.60 2e4j h LYS 59 N 0.00 0.00 -0.40 1.97 5.09 0.89 -2.78 116.57 121.34 2e4j h LYS 59 Ca -0.11 0.00 0.11 0.00 0.09 0.00 0.00 60.65 60.74 2e4j h LYS 59 Cb 1.23 0.00 -0.02 0.00 0.10 0.00 0.00 32.23 33.54 2e4j h LYS 59 CO -0.00 0.06 0.46 0.00 -2.09 0.00 0.00 179.45 177.88 2e4j h ALA 60 N 1.94 2.08 -0.07 0.07 0.00 -1.74 0.14 119.26 121.68 2e4j h ALA 60 Ca -0.00 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.79 2e4j h ALA 60 Cb 0.45 0.03 -0.17 0.00 0.00 0.00 0.00 17.79 18.10 2e4j h ALA 60 CO 0.01 -0.67 -0.72 1.33 0.00 0.00 0.00 179.25 179.20 2e4j n VAL 61 N -3.62 1.48 -1.50 0.00 0.24 -1.05 -5.09 118.33 108.78 2e4j n VAL 61 Ca 0.07 -2.58 -0.55 0.00 -2.04 0.00 0.00 64.34 59.24 2e4j n VAL 61 Cb 0.63 0.16 -0.06 0.00 -1.47 0.00 0.00 33.84 33.10 2e4j n VAL 61 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2e4j n LEU 62 N -0.54 0.19 -4.36 1.34 -0.00 0.50 -4.97 117.00 109.16 2e4j n LEU 62 Ca 0.16 1.15 -0.30 0.00 -0.00 0.00 0.00 56.01 57.02 2e4j n LEU 62 Cb 0.86 -1.00 -0.14 0.00 -0.00 0.00 0.00 43.42 43.14 2e4j n LEU 62 CO -0.00 -1.91 -0.57 -0.72 -0.00 0.00 0.00 177.39 174.19 2e4j s TYR 63 N -0.15 2.31 -0.13 1.47 -0.85 -1.26 -4.85 117.35 113.89 2e4j s TYR 63 Ca 0.83 -0.40 -0.31 0.00 -0.52 0.00 0.00 57.07 56.67 2e4j s TYR 63 Cb -1.11 -1.34 -0.08 0.00 0.38 0.00 0.00 41.96 39.81 2e4j s TYR 63 CO 0.55 0.19 2.09 -0.12 -1.52 0.00 0.00 175.55 176.73 2e4j n MET 64 N 1.52 2.19 -2.65 -3.49 0.00 0.16 -4.50 117.12 110.35 2e4j n MET 64 Ca -0.17 0.72 -0.42 0.00 -0.00 0.00 0.00 57.70 57.82 2e4j n MET 64 Cb 0.52 -2.98 -0.03 0.00 0.00 0.00 0.00 33.22 30.73 2e4j n MET 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2e4j s LYS 66 N 4.98 3.23 0.15 0.00 2.20 -0.17 -1.38 119.74 128.76 2e4j s LYS 66 Ca 0.35 -2.76 -0.26 0.00 -0.36 0.00 0.00 55.97 52.94 2e4j s LYS 66 Cb -0.10 -4.09 -0.08 0.00 -1.51 0.00 0.00 37.83 32.05 2e4j s LYS 66 CO 0.18 -1.24 0.81 0.99 -0.36 0.00 0.00 175.35 175.73 2e4j s THR 67 N -0.42 4.39 -0.18 3.43 2.01 -0.93 -2.59 115.64 121.35 2e4j s THR 67 Ca 0.21 1.76 0.01 0.00 0.31 0.00 0.00 61.69 63.99 2e4j s THR 67 Cb -0.13 -4.17 0.03 0.00 0.01 0.00 0.00 72.50 68.24 2e4j s THR 67 CO -0.08 0.48 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.50 2e4j s VAL 68 N -0.91 1.82 0.01 3.82 1.01 -0.94 -1.57 120.40 123.64 2e4j s VAL 68 Ca 0.37 -0.94 -0.21 0.00 0.00 0.00 0.00 61.98 61.20 2e4j s VAL 68 Cb -0.23 -1.76 -0.06 0.00 0.00 0.00 0.00 36.38 34.34 2e4j s VAL 68 CO 0.27 0.36 0.62 -0.69 0.00 0.00 0.00 175.10 175.65 2e4j s VAL 69 N 1.35 4.86 0.03 2.92 1.01 -1.03 -1.27 120.40 128.27 2e4j s VAL 69 Ca 0.02 1.31 -0.24 0.00 0.00 0.00 0.00 61.98 63.06 2e4j s VAL 69 Cb -0.15 -3.96 0.06 0.00 0.00 0.00 0.00 36.38 32.33 2e4j s VAL 69 CO -0.10 0.43 0.56 0.00 0.00 0.00 0.00 175.10 175.99 2e4j s ALA 70 N -0.28 -1.46 0.39 5.51 0.00 -1.11 -3.80 121.76 121.01 2e4j s ALA 70 Ca 0.32 0.78 -0.26 0.00 0.00 0.00 0.00 51.96 52.80 2e4j s ALA 70 Cb -0.19 0.32 -0.09 0.00 0.00 0.00 0.00 23.12 23.17 2e4j s ALA 70 CO 0.18 -0.49 1.18 -1.25 0.00 0.00 0.00 175.76 175.39 2e4j s PRO 71 N -2.19 4.09 0.87 0.00 0.04 -1.26 0.15 135.00 136.71 2e4j s PRO 71 Ca -0.07 1.87 -0.12 0.00 0.04 0.00 0.00 61.00 62.73 2e4j s PRO 71 Cb -0.01 -2.72 0.15 0.00 0.04 0.00 0.00 34.50 31.96 2e4j s PRO 71 CO 0.01 -0.29 1.21 0.45 0.04 0.00 0.00 177.00 178.41 2e4j s SER 72 N -1.07 3.73 -0.56 6.66 0.15 0.10 -4.29 113.70 118.41 2e4j s SER 72 Ca 0.56 0.26 0.03 0.00 0.70 0.00 0.00 55.95 57.50 2e4j s SER 72 Cb -0.31 -0.50 0.40 0.00 -1.71 0.00 0.00 66.02 63.89 2e4j s SER 72 CO 0.40 -2.33 1.33 0.35 1.20 0.00 0.00 173.24 174.18 2e4j n THR 73 N -3.44 2.81 0.00 6.45 -2.24 -1.26 -4.56 114.28 112.03 2e4j n THR 73 Ca 0.13 -4.87 0.00 0.00 -2.27 0.00 0.00 64.05 57.04 2e4j n THR 73 Cb 0.60 -1.28 0.00 0.00 -2.10 0.00 0.00 70.33 67.55 2e4j n THR 73 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2e4j n GLU 74 N -0.46 0.00 0.00 -0.78 1.02 -1.26 -5.04 120.64 114.12 2e4j n GLU 74 Ca 0.42 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.56 2e4j n GLU 74 Cb 0.53 -0.06 0.00 0.00 -0.02 0.00 0.00 31.44 31.89 2e4j n GLU 74 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2e4j n GLY 75 N -0.39 0.00 0.00 0.62 0.00 -1.26 -5.16 105.19 99.00 2e4j n GLY 75 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2e4j n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2e4j n GLY 76 N 0.00 3.29 3.48 -0.02 0.00 -1.26 -4.57 105.19 106.10 2e4j n GLY 76 Ca 0.00 -0.25 -0.27 0.00 0.00 0.00 0.00 46.02 45.49 2e4j n GLY 76 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2e4j s LEU 77 N 0.00 2.63 -0.25 0.99 0.20 0.51 0.01 118.68 122.77 2e4j s LEU 77 Ca 0.00 -0.74 -0.03 0.00 0.69 0.00 0.00 54.13 54.05 2e4j s LEU 77 Cb 0.00 -1.36 0.11 0.00 -0.43 0.00 0.00 46.19 44.50 2e4j s LEU 77 CO 0.00 0.12 0.20 0.21 -0.29 0.00 0.00 176.35 176.60 2e4j s ASN 78 N -2.66 2.20 -0.15 3.68 2.47 0.40 -1.26 114.94 119.63 2e4j s ASN 78 Ca 0.22 -0.74 -0.05 0.00 0.42 0.00 0.00 52.86 52.71 2e4j s ASN 78 Cb -0.08 0.14 -0.03 0.00 -1.45 0.00 0.00 41.25 39.82 2e4j s ASN 78 CO 0.11 -0.38 0.00 -1.48 -3.72 0.00 0.00 177.10 171.63 2e4j s LEU 79 N 2.25 3.49 -0.34 3.21 2.34 0.30 -2.76 118.68 127.18 2e4j s LEU 79 Ca 0.08 -0.01 -0.14 0.00 0.06 0.00 0.00 54.13 54.11 2e4j s LEU 79 Cb -0.15 -1.85 -0.01 0.00 -0.56 0.00 0.00 46.19 43.62 2e4j s LEU 79 CO -0.26 0.21 0.32 -0.89 -1.06 0.00 0.00 176.35 174.67 2e4j s THR 80 N 0.13 5.21 0.12 5.48 2.01 -0.40 -2.10 115.64 126.09 2e4j s THR 80 Ca 0.01 -0.04 -0.07 0.00 0.31 0.00 0.00 61.69 61.90 2e4j s THR 80 Cb -0.13 -3.78 -0.06 0.00 0.01 0.00 0.00 72.50 68.54 2e4j s THR 80 CO 0.02 -0.06 0.39 -0.55 -0.69 0.00 0.00 174.62 173.73 2e4j s SER 81 N 1.73 6.56 -0.09 3.53 0.15 -0.63 -2.21 113.70 122.74 2e4j s SER 81 Ca 0.10 0.68 -0.04 0.00 0.70 0.00 0.00 55.95 57.39 2e4j s SER 81 Cb -0.17 -2.13 0.05 0.00 -1.71 0.00 0.00 66.02 62.06 2e4j s SER 81 CO 0.11 0.10 0.19 0.28 1.20 0.00 0.00 173.24 175.13 2e4j s THR 82 N -1.55 -0.14 -0.48 6.45 -1.32 -1.07 0.16 115.64 117.69 2e4j s THR 82 Ca 0.37 0.22 -0.17 0.00 -1.21 0.00 0.00 61.69 60.90 2e4j s THR 82 Cb -0.13 -0.32 0.06 0.00 -1.51 0.00 0.00 72.50 70.60 2e4j s THR 82 CO 0.21 0.09 0.51 -0.36 -2.21 0.00 0.00 174.62 172.87 2e4j s PHE 83 N 1.61 3.14 -0.43 9.09 0.08 0.35 -1.00 117.98 130.82 2e4j s PHE 83 Ca -0.05 -0.68 -0.19 0.00 0.12 0.00 0.00 56.93 56.13 2e4j s PHE 83 Cb -0.11 -3.33 0.02 0.00 -0.57 0.00 0.00 43.02 39.03 2e4j s PHE 83 CO -0.07 -0.91 0.52 -1.17 -0.10 0.00 0.00 175.22 173.49 2e4j s LEU 84 N 2.18 4.73 0.40 -0.37 0.20 0.88 -1.42 118.68 125.29 2e4j s LEU 84 Ca 0.10 -0.55 0.05 0.00 0.69 0.00 0.00 54.13 54.42 2e4j s LEU 84 Cb -0.21 -2.52 -0.02 0.00 -0.43 0.00 0.00 46.19 43.01 2e4j s LEU 84 CO 0.10 -0.66 0.17 0.00 -0.29 0.00 0.00 176.35 175.67 2e4j s ARG 85 N 2.40 1.93 0.66 1.98 1.70 -0.33 -0.66 118.95 126.62 2e4j s ARG 85 Ca 0.16 -2.17 0.36 0.00 -0.47 0.00 0.00 55.73 53.61 2e4j s ARG 85 Cb -0.16 -0.38 1.97 0.00 -0.57 0.00 0.00 34.95 35.82 2e4j s ARG 85 CO 0.16 -0.55 2.13 0.87 -1.08 0.00 0.00 175.30 176.83 2e4j h LYS 86 N 1.83 0.00 -1.11 3.89 1.57 -1.96 -0.76 116.57 120.03 2e4j h LYS 86 Ca -0.32 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 57.93 2e4j h LYS 86 Cb 1.27 0.00 -0.25 0.00 0.08 0.00 0.00 32.23 33.33 2e4j h LYS 86 CO 0.51 0.00 0.68 -1.71 -0.57 0.00 0.00 179.45 178.36 2e4j n ASN 87 N -3.06 6.19 -0.05 0.86 5.15 -1.26 -5.03 115.26 118.07 2e4j n ASN 87 Ca -0.02 -3.50 0.00 0.00 -0.60 0.00 0.00 54.58 50.46 2e4j n ASN 87 Cb 0.25 -0.94 0.00 0.00 -0.53 0.00 0.00 39.78 38.56 2e4j n ASN 87 CO 0.00 0.00 0.00 1.67 1.40 0.00 0.00 177.26 180.33 2e4j n GLN 88 N -0.64 0.00 -4.38 1.20 -0.06 -0.29 -4.91 117.38 108.30 2e4j n GLN 88 Ca 0.52 0.00 -0.31 0.00 -2.00 0.00 0.00 57.00 55.21 2e4j n GLN 88 Cb 0.90 0.00 -0.11 0.00 -4.06 0.00 0.00 30.24 26.97 2e4j n GLN 88 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 2e4j s ALA 89 N -1.09 2.90 -0.19 1.69 0.00 -1.26 -1.18 121.76 122.63 2e4j s ALA 89 Ca 0.00 -1.17 0.00 0.00 0.00 0.00 0.00 51.96 50.79 2e4j s ALA 89 Cb 0.00 -0.93 0.04 0.00 0.00 0.00 0.00 23.12 22.23 2e4j s ALA 89 CO 0.00 0.62 -0.09 -1.21 0.00 0.00 0.00 175.76 175.08 2e4j s GLU 90 N -1.84 1.86 -0.14 0.00 2.02 -0.51 -4.92 118.70 115.18 2e4j s GLU 90 Ca 0.19 -0.75 -0.26 0.00 0.02 0.00 0.00 54.97 54.17 2e4j s GLU 90 Cb -0.11 -2.30 -0.02 0.00 0.10 0.00 0.00 34.13 31.81 2e4j s GLU 90 CO 0.10 -0.43 0.85 -0.08 0.02 0.00 0.00 175.26 175.73 2e4j s THR 91 N 1.47 4.89 0.27 3.63 -1.32 -1.26 -0.50 115.64 122.82 2e4j s THR 91 Ca -0.01 1.69 0.11 0.00 -1.21 0.00 0.00 61.69 62.27 2e4j s THR 91 Cb -0.16 -4.16 -0.05 0.00 -1.51 0.00 0.00 72.50 66.62 2e4j s THR 91 CO -0.08 0.06 -0.12 -0.75 -2.21 0.00 0.00 174.62 171.51 2e4j s LYS 92 N 1.92 1.93 -0.19 7.08 2.20 0.43 -4.97 119.74 128.14 2e4j s LYS 92 Ca 0.40 -1.63 -0.05 0.00 -0.36 0.00 0.00 55.97 54.34 2e4j s LYS 92 Cb -0.17 -1.93 -0.03 0.00 -1.51 0.00 0.00 37.83 34.19 2e4j s LYS 92 CO 0.15 0.34 0.00 0.42 -0.36 0.00 0.00 175.35 175.90 2e4j s ILE 93 N -2.43 4.08 -0.09 5.43 1.01 -1.26 -1.60 121.20 126.33 2e4j s ILE 93 Ca 0.31 -0.28 -0.02 0.00 0.00 0.00 0.00 60.65 60.65 2e4j s ILE 93 Cb -0.06 -2.83 0.04 0.00 0.01 0.00 0.00 42.46 39.62 2e4j s ILE 93 CO 0.17 0.45 0.04 -0.04 0.00 0.00 0.00 174.94 175.56 2e4j s MET 94 N 0.74 0.25 -0.08 2.79 -1.94 -0.89 -4.94 119.30 115.23 2e4j s MET 94 Ca 0.00 0.13 0.02 0.00 -1.71 0.00 0.00 55.69 54.13 2e4j s MET 94 Cb -0.14 -1.06 -0.02 0.00 2.01 0.00 0.00 34.83 35.62 2e4j s MET 94 CO 0.02 -0.41 -0.12 0.54 -0.01 0.00 0.00 175.02 175.04 2e4j s VAL 95 N 2.07 3.24 -0.07 -6.03 0.11 -1.26 -0.54 120.40 117.91 2e4j s VAL 95 Ca 0.04 -0.64 0.03 0.00 -2.93 0.00 0.00 61.98 58.48 2e4j s VAL 95 Cb -0.13 -2.31 0.01 0.00 -1.53 0.00 0.00 36.38 32.41 2e4j s VAL 95 CO -0.05 0.57 -0.16 -0.76 -3.33 0.00 0.00 175.10 171.36 2e4j s LEU 96 N -0.42 1.81 -0.15 2.54 1.43 -0.39 -4.96 118.68 118.54 2e4j s LEU 96 Ca 0.05 -0.38 -0.01 0.00 -1.03 0.00 0.00 54.13 52.76 2e4j s LEU 96 Cb -0.12 -1.02 -0.01 0.00 0.03 0.00 0.00 46.19 45.06 2e4j s LEU 96 CO 0.02 0.09 -0.11 -1.10 0.23 0.00 0.00 176.35 175.48 2e4j s GLN 97 N 0.48 3.40 0.08 1.70 -0.21 -1.26 0.19 119.66 124.04 2e4j s GLN 97 Ca -0.14 -0.66 -0.35 0.00 0.02 0.00 0.00 55.36 54.22 2e4j s GLN 97 Cb -0.16 -2.74 -0.15 0.00 1.00 0.00 0.00 33.01 30.97 2e4j s GLN 97 CO 0.05 0.12 1.55 -0.35 -2.12 0.00 0.00 175.29 174.54 2e4j n PRO 98 N 3.81 1.78 0.01 2.91 -0.04 -1.26 -2.98 135.00 139.23 2e4j n PRO 98 Ca -0.18 0.64 -0.20 0.00 -0.04 0.00 0.00 63.50 63.72 2e4j n PRO 98 Cb 0.52 -2.38 -0.14 0.00 -0.04 0.00 0.00 33.50 31.47 2e4j n PRO 98 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2e4j h ALA 99 N 5.99 0.07 0.00 0.55 0.00 0.11 -3.46 119.26 122.52 2e4j h ALA 99 Ca -0.46 -0.91 0.00 0.00 0.00 0.00 0.00 54.91 53.54 2e4j h ALA 99 Cb 1.29 0.32 0.00 0.00 0.00 0.00 0.00 17.79 19.39 2e4j h ALA 99 CO 0.87 0.59 0.00 0.41 0.00 0.00 0.00 179.25 181.12 2e4j n GLY 100 N 1.69 -1.57 3.73 0.00 0.00 -1.20 -5.01 105.19 102.84 2e4j n GLY 100 Ca -0.20 0.47 -0.34 0.00 0.00 0.00 0.00 46.02 45.95 2e4j n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2e4j s ALA 101 N -2.00 3.44 -0.92 4.61 0.00 -1.26 -5.00 121.76 120.63 2e4j s ALA 101 Ca 0.00 -0.85 -0.15 0.00 0.00 0.00 0.00 51.96 50.96 2e4j s ALA 101 Cb 0.00 -1.52 -0.27 0.00 0.00 0.00 0.00 23.12 21.33 2e4j s ALA 101 CO 0.00 0.64 2.26 -2.30 0.00 0.00 0.00 175.76 176.36 2e4j n PRO 102 N 1.62 0.21 0.00 0.00 -0.02 -1.26 -0.62 135.00 134.93 2e4j n PRO 102 Ca -0.16 -0.31 0.00 0.00 -2.02 0.00 0.00 63.50 61.01 2e4j n PRO 102 Cb 0.53 -1.99 0.00 0.00 -0.02 0.00 0.00 33.50 32.02 2e4j n PRO 102 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2e4j n GLY 103 N 5.99 0.01 2.83 -1.23 0.00 -1.26 -4.56 105.19 106.96 2e4j n GLY 103 Ca 0.60 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 46.36 2e4j n GLY 103 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2e4j s HIS 104 N -0.82 1.28 0.32 1.61 3.76 0.21 -1.96 115.29 119.69 2e4j s HIS 104 Ca 0.00 -0.80 0.03 0.00 -0.15 0.00 0.00 55.06 54.14 2e4j s HIS 104 Cb 0.00 -1.12 -0.05 0.00 1.11 0.00 0.00 32.58 32.52 2e4j s HIS 104 CO 0.00 -0.54 0.09 0.71 -0.85 0.00 0.00 174.74 174.15 2e4j s TYR 105 N 1.77 1.76 -0.19 1.40 2.02 -1.16 0.15 117.35 123.10 2e4j s TYR 105 Ca 0.02 -1.13 -0.02 0.00 -0.37 0.00 0.00 57.07 55.56 2e4j s TYR 105 Cb -0.15 -1.10 -0.01 0.00 -0.40 0.00 0.00 41.96 40.31 2e4j s TYR 105 CO -0.07 -0.21 -0.08 0.95 -1.57 0.00 0.00 175.55 174.57 2e4j s THR 106 N -3.46 3.20 -0.49 -0.71 -4.23 -1.16 -3.66 115.64 105.13 2e4j s THR 106 Ca 0.35 -0.57 0.05 0.00 -1.18 0.00 0.00 61.69 60.34 2e4j s THR 106 Cb 0.07 -2.42 0.39 0.00 1.34 0.00 0.00 72.50 71.88 2e4j s THR 106 CO 0.15 0.46 1.05 0.00 -0.54 0.00 0.00 174.62 175.74 2e4j n TYR 107 N 4.37 3.67 -3.85 3.99 9.36 0.21 -4.46 117.16 130.44 2e4j n TYR 107 Ca -0.18 -3.46 -0.24 0.00 3.32 0.00 0.00 57.90 57.33 2e4j n TYR 107 Cb 0.51 -0.24 -0.03 0.00 -0.63 0.00 0.00 39.34 38.95 2e4j n TYR 107 CO 0.00 0.00 0.00 -1.54 0.22 0.00 0.00 176.86 175.54 2e4j s SER 108 N -3.52 4.70 0.03 2.98 1.04 -1.19 -3.34 113.70 114.40 2e4j s SER 108 Ca 0.48 -1.05 0.02 0.00 0.48 0.00 0.00 55.95 55.88 2e4j s SER 108 Cb 0.35 -0.13 -0.02 0.00 0.10 0.00 0.00 66.02 66.32 2e4j s SER 108 CO -0.17 -0.81 -0.06 -0.44 0.98 0.00 0.00 173.24 172.74 2e4j s SER 109 N -4.13 0.69 -0.72 7.02 0.01 -1.03 -4.95 113.70 110.59 2e4j s SER 109 Ca 0.40 -0.40 -0.27 0.00 1.31 0.00 0.00 55.95 56.99 2e4j s SER 109 Cb -0.01 0.01 -0.25 0.00 0.21 0.00 0.00 66.02 65.98 2e4j s SER 109 CO 0.23 -0.13 1.90 -2.65 0.41 0.00 0.00 173.24 173.00 2e4j n PRO 110 N 1.94 0.43 -0.11 12.44 -0.02 -1.26 -4.16 135.00 144.26 2e4j n PRO 110 Ca -0.20 -1.61 0.00 0.00 -2.02 0.00 0.00 63.50 59.67 2e4j n PRO 110 Cb 0.56 -3.35 0.00 0.00 -0.02 0.00 0.00 33.50 30.69 2e4j n PRO 110 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 2e4j n HIS 111 N 14.41 0.00 -3.16 6.00 8.25 -1.26 -5.08 115.22 134.38 2e4j n HIS 111 Ca 0.44 0.00 -0.16 0.00 -0.26 0.00 0.00 57.72 57.74 2e4j n HIS 111 Cb 0.45 -0.00 0.02 0.00 1.12 0.00 0.00 29.99 31.57 2e4j n HIS 111 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 2e4j n SER 112 N 0.00 -6.72 0.00 0.41 3.41 -1.26 -4.39 113.62 105.08 2e4j n SER 112 Ca 0.00 0.39 0.00 0.00 -0.26 0.00 0.00 58.87 59.00 2e4j n SER 112 Cb 0.54 -3.03 0.00 0.00 -0.26 0.00 0.00 64.21 61.47 2e4j n SER 112 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2e4j n GLY 113 N 0.32 2.98 3.39 5.00 0.00 -1.26 -4.87 105.19 110.76 2e4j n GLY 113 Ca -0.01 -0.64 -0.35 0.00 0.00 0.00 0.00 46.02 45.02 2e4j n GLY 113 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2e4j n SER 114 N 0.00 2.17 -4.00 1.61 2.88 -1.26 -2.92 113.62 112.11 2e4j n SER 114 Ca 0.00 -2.62 -0.25 0.00 -1.33 0.00 0.00 58.87 54.67 2e4j n SER 114 Cb 0.00 -1.25 -0.17 0.00 -0.75 0.00 0.00 64.21 62.04 2e4j n SER 114 CO 0.00 0.00 0.00 0.27 -1.23 0.00 0.00 175.04 174.08 2e4j s ILE 115 N 9.00 1.12 0.03 2.46 -5.25 -1.24 -2.47 121.20 124.85 2e4j s ILE 115 Ca 0.67 -0.44 0.02 0.00 -0.99 0.00 0.00 60.65 59.91 2e4j s ILE 115 Cb 0.07 -1.05 -0.02 0.00 2.95 0.00 0.00 42.46 44.42 2e4j s ILE 115 CO 0.18 0.36 -0.07 -2.28 -1.79 0.00 0.00 174.94 171.35 2e4j s HIS 116 N 0.92 0.57 0.04 1.37 2.46 -1.21 -2.89 115.29 116.56 2e4j s HIS 116 Ca -0.10 -0.44 0.03 0.00 0.47 0.00 0.00 55.06 55.03 2e4j s HIS 116 Cb -0.15 -0.35 -0.02 0.00 -0.13 0.00 0.00 32.58 31.93 2e4j s HIS 116 CO 0.01 -0.09 -0.10 -1.12 -2.47 0.00 0.00 174.74 170.97 2e4j s SER 117 N -1.34 1.19 0.09 9.88 0.01 -1.07 -0.62 113.70 121.83 2e4j s SER 117 Ca -0.09 -0.50 0.07 0.00 1.31 0.00 0.00 55.95 56.75 2e4j s SER 117 Cb -0.09 -0.02 -0.03 0.00 0.21 0.00 0.00 66.02 66.09 2e4j s SER 117 CO 0.00 -0.10 -0.19 0.54 0.41 0.00 0.00 173.24 173.90 2e4j s VAL 118 N -1.11 1.56 0.22 3.43 0.11 -1.24 -2.06 120.40 121.31 2e4j s VAL 118 Ca -0.04 -1.44 0.01 0.00 -2.93 0.00 0.00 61.98 57.57 2e4j s VAL 118 Cb -0.09 -1.42 -0.05 0.00 -1.53 0.00 0.00 36.38 33.29 2e4j s VAL 118 CO 0.01 -0.07 0.08 -0.44 -3.33 0.00 0.00 175.10 171.35 2e4j s SER 119 N -1.78 0.98 -0.11 3.54 0.01 0.10 -3.00 113.70 113.44 2e4j s SER 119 Ca 0.05 -1.32 -0.22 0.00 1.31 0.00 0.00 55.95 55.76 2e4j s SER 119 Cb -0.10 0.19 -0.03 0.00 0.21 0.00 0.00 66.02 66.29 2e4j s SER 119 CO 0.03 -0.71 0.67 0.68 0.41 0.00 0.00 173.24 174.32 2e4j s VAL 120 N -3.81 5.05 -0.16 3.43 -7.23 -0.83 0.96 120.40 117.81 2e4j s VAL 120 Ca 0.34 1.34 -0.12 0.00 -1.81 0.00 0.00 61.98 61.73 2e4j s VAL 120 Cb 0.07 -4.00 -0.07 0.00 0.56 0.00 0.00 36.38 32.95 2e4j s VAL 120 CO 0.10 0.21 -0.08 0.58 -0.31 0.00 0.00 175.10 175.61 2e4j h VAL 121 N 4.88 0.22 -1.30 1.32 2.07 0.35 -3.01 116.25 120.78 2e4j h VAL 121 Ca -0.38 -1.28 0.24 0.00 0.82 0.00 0.00 66.70 66.10 2e4j h VAL 121 Cb 1.18 0.54 -0.22 0.00 -1.52 0.00 0.00 31.29 31.26 2e4j h VAL 121 CO 0.77 0.08 0.85 -1.83 0.02 0.00 0.00 177.57 177.45 2e4j s GLU 122 N -2.24 0.23 -0.02 1.57 -1.05 -1.10 -2.85 118.70 113.24 2e4j s GLU 122 Ca -0.18 -0.03 0.04 0.00 -0.15 0.00 0.00 54.97 54.65 2e4j s GLU 122 Cb 0.03 0.11 -0.01 0.00 -0.44 0.00 0.00 34.13 33.82 2e4j s GLU 122 CO 0.30 -0.09 -0.12 0.00 0.95 0.00 0.00 175.26 176.30 2e4j s ALA 123 N -1.75 1.08 -1.34 -0.84 0.00 -1.26 -1.47 121.76 116.17 2e4j s ALA 123 Ca 0.08 -0.51 -0.17 0.00 0.00 0.00 0.00 51.96 51.36 2e4j s ALA 123 Cb -0.01 -0.32 0.04 0.00 0.00 0.00 0.00 23.12 22.83 2e4j s ALA 123 CO -0.05 0.23 1.94 -1.71 0.00 0.00 0.00 175.76 176.17 2e4j n ASN 124 N 2.98 4.37 0.00 0.00 2.85 0.53 -4.74 115.26 121.24 2e4j n ASN 124 Ca -0.16 -2.87 0.00 0.00 -0.11 0.00 0.00 54.58 51.44 2e4j n ASN 124 Cb 0.55 -1.69 0.00 0.00 1.24 0.00 0.00 39.78 39.87 2e4j n ASN 124 CO 0.00 0.00 0.00 -1.22 -2.11 0.00 0.00 177.26 173.93 2e4j n TYR 125 N 7.75 0.00 -2.43 1.20 4.01 -1.26 -1.77 117.16 124.66 2e4j n TYR 125 Ca 0.50 0.00 -0.00 0.00 -0.16 0.00 0.00 57.90 58.24 2e4j n TYR 125 Cb 0.43 0.00 0.01 0.00 -0.31 0.00 0.00 39.34 39.47 2e4j n TYR 125 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 2e4j n ASP 126 N 1.45 0.35 -3.70 7.72 9.92 -1.26 -5.07 116.55 125.95 2e4j n ASP 126 Ca 0.00 -2.02 -0.06 0.00 -0.53 0.00 0.00 54.79 52.18 2e4j n ASP 126 Cb 0.00 -0.09 -0.02 0.00 -0.64 0.00 0.00 41.12 40.38 2e4j n ASP 126 CO 0.00 0.00 0.00 -1.83 0.13 0.00 0.00 177.20 175.50 2e4j s GLU 127 N -0.54 1.32 -0.34 -1.24 1.03 -0.73 -5.06 118.70 113.14 2e4j s GLU 127 Ca 0.22 -0.67 -0.09 0.00 0.03 0.00 0.00 54.97 54.46 2e4j s GLU 127 Cb 0.28 0.49 0.01 0.00 -0.80 0.00 0.00 34.13 34.11 2e4j s GLU 127 CO -0.10 -0.60 0.28 0.66 -1.33 0.00 0.00 175.26 174.17 2e4j n TYR 128 N -0.42 -3.37 -3.18 4.83 4.01 -1.26 -0.35 117.16 117.43 2e4j n TYR 128 Ca -0.07 1.43 -0.39 0.00 -0.16 0.00 0.00 57.90 58.71 2e4j n TYR 128 Cb 0.61 -3.61 -0.06 0.00 -0.31 0.00 0.00 39.34 35.97 2e4j n TYR 128 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2e4j s ALA 129 N -1.94 3.51 -0.08 -0.72 0.00 -1.09 -3.04 121.76 118.41 2e4j s ALA 129 Ca 0.13 0.10 0.03 0.00 0.00 0.00 0.00 51.96 52.22 2e4j s ALA 129 Cb -0.03 -2.76 0.01 0.00 0.00 0.00 0.00 23.12 20.34 2e4j s ALA 129 CO 0.72 0.27 -0.17 -0.51 0.00 0.00 0.00 175.76 176.07 2e4j s LEU 130 N -0.68 1.83 0.09 0.00 2.01 -0.54 0.56 118.68 121.94 2e4j s LEU 130 Ca 0.32 -0.40 0.05 0.00 0.01 0.00 0.00 54.13 54.11 2e4j s LEU 130 Cb -0.20 -1.05 -0.03 0.00 0.01 0.00 0.00 46.19 44.92 2e4j s LEU 130 CO 0.20 0.09 -0.14 -0.76 1.01 0.00 0.00 176.35 176.75 2e4j s LEU 131 N 0.50 2.33 -0.17 1.79 1.02 0.29 1.00 118.68 125.44 2e4j s LEU 131 Ca -0.16 -0.69 -0.02 0.00 0.02 0.00 0.00 54.13 53.29 2e4j s LEU 131 Cb -0.16 -0.51 -0.01 0.00 0.02 0.00 0.00 46.19 45.52 2e4j s LEU 131 CO 0.06 -0.11 -0.09 0.12 0.02 0.00 0.00 176.35 176.34 2e4j s PHE 132 N -1.63 2.89 -0.11 0.29 2.19 0.27 -0.51 117.98 121.37 2e4j s PHE 132 Ca 0.02 -0.76 0.01 0.00 0.33 0.00 0.00 56.93 56.52 2e4j s PHE 132 Cb -0.08 -1.95 -0.02 0.00 -1.31 0.00 0.00 43.02 39.66 2e4j s PHE 132 CO 0.02 -0.34 -0.13 -1.54 1.83 0.00 0.00 175.22 175.06 2e4j s SER 133 N 0.79 4.08 0.16 6.13 1.04 0.19 0.01 113.70 126.11 2e4j s SER 133 Ca -0.03 -0.27 -0.23 0.00 0.48 0.00 0.00 55.95 55.89 2e4j s SER 133 Cb -0.15 -1.42 0.07 0.00 0.10 0.00 0.00 66.02 64.62 2e4j s SER 133 CO 0.01 0.22 0.63 -0.13 0.98 0.00 0.00 173.24 174.95 2e4j s ARG 134 N 0.04 1.31 0.00 4.02 0.52 -0.87 -0.53 118.95 123.43 2e4j s ARG 134 Ca -0.04 -0.52 0.00 0.00 -0.52 0.00 0.00 55.73 54.65 2e4j s ARG 134 Cb -0.14 0.58 0.00 0.00 0.52 0.00 0.00 34.95 35.90 2e4j s ARG 134 CO 0.04 -0.58 0.00 0.41 0.02 0.00 0.00 175.30 175.19 2e4j n GLY 135 N -0.38 -0.18 3.15 -3.53 0.00 -0.82 -2.61 105.19 100.82 2e4j n GLY 135 Ca -0.15 -0.90 0.04 0.00 0.00 0.00 0.00 46.02 45.01 2e4j n GLY 135 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2e4j s THR 136 N -4.00 -1.00 0.71 2.61 -4.23 -1.14 -1.95 115.64 106.64 2e4j s THR 136 Ca 0.00 0.00 -0.05 0.00 -1.18 0.00 0.00 61.69 60.46 2e4j s THR 136 Cb 0.00 -1.00 0.09 0.00 1.34 0.00 0.00 72.50 72.93 2e4j s THR 136 CO 0.00 0.00 1.00 -0.54 -0.54 0.00 0.00 174.62 174.54 2e4j s LYS 137 N 2.83 1.95 2.12 3.99 3.01 -1.23 -3.69 119.74 128.71 2e4j s LYS 137 Ca 0.10 -0.58 0.00 0.00 -1.01 0.00 0.00 55.97 54.48 2e4j s LYS 137 Cb -0.10 -2.23 0.00 0.00 -1.01 0.00 0.00 37.83 34.49 2e4j s LYS 137 CO -0.26 -1.33 0.00 0.41 0.51 0.00 0.00 175.35 174.68 2e4j n GLY 138 N -2.89 2.75 0.15 -3.33 0.00 -1.15 -0.81 105.19 99.91 2e4j n GLY 138 Ca 0.10 0.19 -0.07 0.00 0.00 0.00 0.00 46.02 46.24 2e4j n GLY 138 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2e4j h PRO 139 N 0.00 0.24 0.00 1.61 0.13 -1.90 -3.35 132.00 128.73 2e4j h PRO 139 Ca 0.00 -0.21 0.00 0.00 -0.87 0.00 0.00 66.00 64.92 2e4j h PRO 139 Cb 0.00 0.05 0.00 0.00 0.13 0.00 0.00 31.00 31.18 2e4j h PRO 139 CO 0.00 0.88 0.00 0.41 -0.23 0.00 0.00 178.00 179.06 2e4j n GLY 140 N 0.58 1.38 0.54 1.56 0.00 0.01 -5.05 105.19 104.21 2e4j n GLY 140 Ca -0.03 -0.66 0.08 0.00 0.00 0.00 0.00 46.02 45.41 2e4j n GLY 140 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2e4j n GLN 141 N 0.00 2.44 -3.02 1.61 -0.06 -1.26 -5.00 117.38 112.09 2e4j n GLN 141 Ca 0.00 -2.55 -0.12 0.00 -2.00 0.00 0.00 57.00 52.33 2e4j n GLN 141 Cb 0.00 -1.60 0.01 0.00 -4.06 0.00 0.00 30.24 24.59 2e4j n GLN 141 CO 0.00 0.00 0.00 -0.25 -0.20 0.00 0.00 177.06 176.61 2e4j n ASP 142 N -0.65 -7.21 -4.83 1.69 8.00 -1.26 -4.96 116.55 107.33 2e4j n ASP 142 Ca 0.17 0.59 -0.38 0.00 0.71 0.00 0.00 54.79 55.88 2e4j n ASP 142 Cb 0.71 -3.94 -0.06 0.00 -0.02 0.00 0.00 41.12 37.80 2e4j n ASP 142 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2e4j s PHE 143 N -1.85 3.73 -0.28 1.24 0.08 -0.82 -4.97 117.98 115.11 2e4j s PHE 143 Ca 0.18 1.03 -0.03 0.00 0.12 0.00 0.00 56.93 58.23 2e4j s PHE 143 Cb -0.03 -2.33 0.11 0.00 -0.57 0.00 0.00 43.02 40.20 2e4j s PHE 143 CO 0.68 0.62 0.21 -0.98 -0.10 0.00 0.00 175.22 175.65 2e4j s ARG 144 N -1.02 0.24 0.16 0.44 1.70 -1.26 -1.94 118.95 117.27 2e4j s ARG 144 Ca 0.24 -0.27 0.09 0.00 -0.47 0.00 0.00 55.73 55.33 2e4j s ARG 144 Cb -0.17 -0.98 -0.04 0.00 -0.57 0.00 0.00 34.95 33.19 2e4j s ARG 144 CO 0.14 -0.97 -0.20 -1.64 -1.08 0.00 0.00 175.30 171.55 2e4j s MET 145 N 2.24 1.30 0.01 3.89 1.00 0.31 -4.58 119.30 123.46 2e4j s MET 145 Ca 0.09 -1.40 0.06 0.00 0.00 0.00 0.00 55.69 54.44 2e4j s MET 145 Cb -0.15 -1.45 -0.03 0.00 0.00 0.00 0.00 34.83 33.20 2e4j s MET 145 CO -0.32 0.30 -0.16 0.00 0.00 0.00 0.00 175.02 174.85 2e4j s ALA 146 N -1.84 2.66 -0.13 3.03 0.00 0.31 0.56 121.76 126.34 2e4j s ALA 146 Ca 0.15 -1.11 0.00 0.00 0.00 0.00 0.00 51.96 51.00 2e4j s ALA 146 Cb -0.07 -0.85 -0.01 0.00 0.00 0.00 0.00 23.12 22.19 2e4j s ALA 146 CO 0.07 0.57 -0.14 0.99 0.00 0.00 0.00 175.76 177.25 2e4j s THR 147 N -0.88 2.92 -0.05 0.00 2.01 0.34 -0.78 115.64 119.19 2e4j s THR 147 Ca 0.14 -0.70 0.01 0.00 0.31 0.00 0.00 61.69 61.45 2e4j s THR 147 Cb -0.11 -2.22 0.02 0.00 0.01 0.00 0.00 72.50 70.20 2e4j s THR 147 CO 0.04 0.52 -0.04 -0.22 -0.69 0.00 0.00 174.62 174.24 2e4j s LEU 148 N 0.46 1.19 0.03 4.42 2.96 0.46 0.11 118.68 128.31 2e4j s LEU 148 Ca -0.10 -0.13 0.01 0.00 -0.22 0.00 0.00 54.13 53.68 2e4j s LEU 148 Cb -0.16 -0.47 -0.04 0.00 0.50 0.00 0.00 46.19 46.02 2e4j s LEU 148 CO 0.05 -0.08 0.10 -0.31 -1.32 0.00 0.00 176.35 174.78 2e4j s TYR 149 N 1.14 3.29 0.62 5.38 2.02 0.19 -2.35 117.35 127.64 2e4j s TYR 149 Ca -0.07 0.17 -0.04 0.00 -0.37 0.00 0.00 57.07 56.75 2e4j s TYR 149 Cb -0.14 -1.70 0.13 0.00 -0.40 0.00 0.00 41.96 39.85 2e4j s TYR 149 CO -0.01 0.55 0.85 0.43 -1.57 0.00 0.00 175.55 175.80 2e4j n SER 150 N 0.82 0.71 -1.17 2.29 7.64 0.54 -2.67 113.62 121.78 2e4j n SER 150 Ca -0.11 -1.70 -0.02 0.00 1.01 0.00 0.00 58.87 58.06 2e4j n SER 150 Cb 0.52 -0.59 0.00 0.00 -1.01 0.00 0.00 64.21 63.13 2e4j n SER 150 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2e4j n ARG 151 N -2.67 0.19 -3.64 1.43 5.12 -1.26 -4.10 116.66 111.73 2e4j n ARG 151 Ca 0.13 -0.36 -0.10 0.00 -1.93 0.00 0.00 57.85 55.58 2e4j n ARG 151 Cb 0.45 0.35 -0.05 0.00 -1.16 0.00 0.00 32.46 32.05 2e4j n ARG 151 CO 0.00 0.00 0.00 0.99 -1.93 0.00 0.00 177.63 176.69 2e4j s THR 152 N 0.02 0.07 0.25 0.55 2.01 -1.26 -4.92 115.64 112.36 2e4j s THR 152 Ca 0.01 -0.59 -0.05 0.00 0.31 0.00 0.00 61.69 61.38 2e4j s THR 152 Cb 0.06 -1.16 0.26 0.00 0.01 0.00 0.00 72.50 71.67 2e4j s THR 152 CO -0.02 -0.33 1.66 1.56 -0.69 0.00 0.00 174.62 176.81 2e4j h GLN 153 N 2.42 0.19 0.00 4.92 7.50 -2.03 -3.42 115.11 124.68 2e4j h GLN 153 Ca -0.34 -0.01 0.00 0.00 0.50 0.00 0.00 58.65 58.80 2e4j h GLN 153 Cb 1.25 -0.04 0.00 0.00 0.05 0.00 0.00 27.48 28.74 2e4j h GLN 153 CO 0.47 0.12 0.00 2.41 -1.50 0.00 0.00 178.83 180.33 2e4j n THR 154 N -5.24 0.00 -2.37 -0.54 -1.04 -1.26 -4.30 114.28 99.53 2e4j n THR 154 Ca 0.15 0.00 -0.39 0.00 -2.04 0.00 0.00 64.05 61.77 2e4j n THR 154 Cb 0.50 -0.28 -0.03 0.00 -1.82 0.00 0.00 70.33 68.70 2e4j n THR 154 CO 0.00 0.00 0.00 -1.48 -0.64 0.00 0.00 175.07 172.95 2e4j s LEU 155 N 0.00 4.36 -0.23 -4.42 0.05 -1.26 -4.79 118.68 112.39 2e4j s LEU 155 Ca 0.00 2.33 -0.11 0.00 0.05 0.00 0.00 54.13 56.40 2e4j s LEU 155 Cb 0.00 -3.84 -0.05 0.00 -2.05 0.00 0.00 46.19 40.26 2e4j s LEU 155 CO 0.00 -0.42 0.16 -0.54 -0.55 0.00 0.00 176.35 175.00 2e4j s LYS 156 N -1.92 4.11 0.24 1.48 3.01 -1.26 -4.98 119.74 120.42 2e4j s LYS 156 Ca 0.51 -0.24 -0.01 0.00 -1.01 0.00 0.00 55.97 55.22 2e4j s LYS 156 Cb -0.31 -3.51 0.28 0.00 -1.01 0.00 0.00 37.83 33.28 2e4j s LYS 156 CO 0.40 0.12 1.65 -0.44 0.51 0.00 0.00 175.35 177.60 2e4j h ASP 157 N 7.28 0.62 -0.65 2.83 5.19 -1.97 -1.92 116.42 127.80 2e4j h ASP 157 Ca -0.39 -0.23 0.12 0.00 -0.62 0.00 0.00 57.03 55.91 2e4j h ASP 157 Cb 1.16 -0.17 -0.09 0.00 0.18 0.00 0.00 39.33 40.41 2e4j h ASP 157 CO 0.69 0.87 0.17 -0.33 -3.12 0.00 0.00 179.24 177.52 2e4j h GLU 158 N 0.52 0.29 -0.05 3.56 5.08 -1.99 1.14 114.58 123.14 2e4j h GLU 158 Ca 0.07 -0.02 -0.24 0.00 -1.00 0.00 0.00 59.36 58.17 2e4j h GLU 158 Cb 0.76 -0.07 0.01 0.00 0.50 0.00 0.00 28.75 29.96 2e4j h GLU 158 CO 0.06 0.19 -0.93 1.37 -1.00 0.00 0.00 179.01 178.70 2e4j h LEU 159 N 0.30 0.81 -1.33 1.33 8.10 -1.96 -1.47 115.31 121.09 2e4j h LEU 159 Ca 0.35 -0.61 0.03 0.00 0.11 0.00 0.00 57.88 57.75 2e4j h LEU 159 Cb 0.53 -0.25 -0.04 0.00 -0.44 0.00 0.00 40.66 40.46 2e4j h LEU 159 CO -0.42 1.41 0.47 0.50 -4.11 0.00 0.00 178.44 176.29 2e4j h LYS 160 N 0.39 0.86 0.11 0.17 1.63 -0.23 0.47 116.57 119.97 2e4j h LYS 160 Ca -0.09 -0.05 -0.01 0.00 -0.85 0.00 0.00 60.65 59.65 2e4j h LYS 160 Cb 1.57 -0.19 0.00 0.00 -0.60 0.00 0.00 32.23 33.01 2e4j h LYS 160 CO 0.18 0.57 -0.05 1.49 -3.45 0.00 0.00 179.45 178.19 2e4j h GLU 161 N 0.89 -0.14 -0.12 1.90 4.81 0.13 -2.39 114.58 119.67 2e4j h GLU 161 Ca 0.27 0.01 -0.10 0.00 -0.13 0.00 0.00 59.36 59.41 2e4j h GLU 161 Cb 0.00 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.40 2e4j h GLU 161 CO -0.07 0.36 -0.38 -0.22 -0.73 0.00 0.00 179.01 177.96 2e4j h LYS 162 N -0.88 0.25 0.08 1.92 1.63 -1.11 0.83 116.57 119.29 2e4j h LYS 162 Ca -0.01 -0.11 -0.26 0.00 -0.85 0.00 0.00 60.65 59.41 2e4j h LYS 162 Cb 0.55 -0.01 0.03 0.00 -0.60 0.00 0.00 32.23 32.20 2e4j h LYS 162 CO 0.02 0.60 -1.08 0.35 -3.45 0.00 0.00 179.45 175.89 2e4j h PHE 163 N 0.21 0.93 0.02 1.91 3.04 -0.18 -2.25 116.94 120.62 2e4j h PHE 163 Ca 0.02 -0.56 -0.05 0.00 3.98 0.00 0.00 57.97 61.36 2e4j h PHE 163 Cb 0.77 -0.08 0.00 0.00 2.56 0.00 0.00 35.95 39.21 2e4j h PHE 163 CO 0.01 1.41 -0.20 1.15 -2.02 0.00 0.00 178.31 178.66 2e4j h THR 164 N 0.19 1.66 -0.97 4.41 2.02 -1.37 -2.58 112.91 116.28 2e4j h THR 164 Ca -0.16 -2.21 0.01 0.00 0.77 0.00 0.00 66.41 64.82 2e4j h THR 164 Cb 1.77 3.14 -0.05 0.00 -1.74 0.00 0.00 68.15 71.27 2e4j h THR 164 CO 0.21 0.59 0.63 0.74 0.37 0.00 0.00 175.52 178.06 2e4j h THR 165 N -0.74 1.25 -0.35 3.16 2.02 0.55 0.87 112.91 119.67 2e4j h THR 165 Ca -0.03 -0.47 -0.01 0.00 0.77 0.00 0.00 66.41 66.67 2e4j h THR 165 Cb 1.08 -0.17 -0.02 0.00 -1.74 0.00 0.00 68.15 67.31 2e4j h THR 165 CO 0.04 0.24 0.17 0.15 0.37 0.00 0.00 175.52 176.49 2e4j h PHE 166 N 1.31 0.51 -0.15 3.16 3.04 -1.50 0.73 116.94 124.05 2e4j h PHE 166 Ca 0.35 -0.03 -0.10 0.00 3.98 0.00 0.00 57.97 62.17 2e4j h PHE 166 Cb -0.14 -0.16 0.00 0.00 2.56 0.00 0.00 35.95 38.21 2e4j h PHE 166 CO -0.00 0.45 -0.30 0.66 -2.02 0.00 0.00 178.31 177.09 2e4j h SER 167 N 0.43 0.52 -0.10 0.41 4.64 -0.98 -3.04 113.55 115.43 2e4j h SER 167 Ca 0.12 -0.56 -0.19 0.00 -0.47 0.00 0.00 61.79 60.69 2e4j h SER 167 Cb 0.13 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 62.07 2e4j h SER 167 CO -0.01 0.98 -0.64 0.07 -0.87 0.00 0.00 176.83 176.36 2e4j h LYS 168 N 0.09 0.72 0.00 4.77 5.09 0.82 -3.05 116.57 125.00 2e4j h LYS 168 Ca 0.00 -0.51 -0.00 0.00 0.09 0.00 0.00 60.65 60.23 2e4j h LYS 168 Cb 0.90 0.08 -0.00 0.00 0.10 0.00 0.00 32.23 33.31 2e4j h LYS 168 CO 0.07 1.13 -0.01 0.00 -2.09 0.00 0.00 179.45 178.55 2e4j h ALA 169 N 0.75 1.83 -0.48 0.07 0.00 0.41 0.09 119.26 121.92 2e4j h ALA 169 Ca -0.01 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.83 2e4j h ALA 169 Cb 1.24 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.99 2e4j h ALA 169 CO 0.13 0.01 0.08 0.94 0.00 0.00 0.00 179.25 180.41 2e4j n GLN 170 N -4.29 3.59 -0.40 0.00 7.27 -1.15 -4.88 117.38 117.53 2e4j n GLN 170 Ca -0.03 -2.34 0.00 0.00 0.07 0.00 0.00 57.00 54.70 2e4j n GLN 170 Cb 0.09 -2.04 0.00 0.00 2.41 0.00 0.00 30.24 30.70 2e4j n GLN 170 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2e4j n GLY 171 N 0.27 0.45 3.90 1.69 0.00 -0.06 -5.06 105.19 106.38 2e4j n GLY 171 Ca 0.25 -0.56 0.00 0.00 0.00 0.00 0.00 46.02 45.71 2e4j n GLY 171 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2e4j s LEU 172 N -0.43 -0.01 0.00 0.99 2.96 -0.75 -4.85 118.68 116.60 2e4j s LEU 172 Ca 0.00 -0.39 0.00 0.00 -0.22 0.00 0.00 54.13 53.52 2e4j s LEU 172 Cb 0.00 1.65 0.00 0.00 0.50 0.00 0.00 46.19 48.34 2e4j s LEU 172 CO 0.00 -0.59 0.00 0.41 -1.32 0.00 0.00 176.35 174.85 2e4j n THR 173 N -0.76 0.00 0.07 3.68 -1.04 -1.26 -4.28 114.28 110.69 2e4j n THR 173 Ca -0.01 0.00 0.21 0.00 -2.04 0.00 0.00 64.05 62.21 2e4j n THR 173 Cb 0.59 0.00 0.70 0.00 -1.82 0.00 0.00 70.33 69.81 2e4j n THR 173 CO 0.00 0.00 0.00 1.05 -0.64 0.00 0.00 175.07 175.48 2e4j h GLU 174 N 0.00 0.00 0.00 -2.82 4.11 -1.97 0.42 114.58 114.33 2e4j h GLU 174 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2e4j h GLU 174 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2e4j h GLU 174 CO 0.00 0.00 0.00 -1.91 0.07 0.00 0.00 179.01 177.17 2e4j n GLU 175 N -3.57 0.10 -2.42 1.06 2.13 -1.26 -2.17 120.64 114.51 2e4j n GLU 175 Ca 0.09 0.59 -0.16 0.00 0.66 0.00 0.00 57.16 58.34 2e4j n GLU 175 Cb 0.74 -1.83 0.03 0.00 0.27 0.00 0.00 31.44 30.64 2e4j n GLU 175 CO 0.00 0.00 0.00 -3.47 -0.41 0.00 0.00 177.13 173.25 2e4j n ASP 176 N -2.05 3.52 -3.74 4.31 -0.08 0.15 -4.18 116.55 114.48 2e4j n ASP 176 Ca -0.01 -3.15 -0.13 0.00 -1.51 0.00 0.00 54.79 49.99 2e4j n ASP 176 Cb 0.03 -0.43 -0.14 0.00 2.34 0.00 0.00 41.12 42.93 2e4j n ASP 176 CO 0.00 0.00 0.00 -0.63 0.12 0.00 0.00 177.20 176.69 2e4j s ILE 177 N -4.38 -0.06 -0.11 5.18 1.09 -0.92 -2.49 121.20 119.50 2e4j s ILE 177 Ca 0.41 0.18 -0.04 0.00 -1.10 0.00 0.00 60.65 60.10 2e4j s ILE 177 Cb 0.39 -0.30 0.06 0.00 -1.06 0.00 0.00 42.46 41.55 2e4j s ILE 177 CO -0.03 0.07 0.21 0.54 -0.10 0.00 0.00 174.94 175.64 2e4j s VAL 178 N 1.28 -0.34 -0.10 2.92 0.11 0.56 -4.91 120.40 119.92 2e4j s VAL 178 Ca -0.08 0.30 -0.04 0.00 -2.93 0.00 0.00 61.98 59.23 2e4j s VAL 178 Cb -0.11 -0.38 -0.04 0.00 -1.53 0.00 0.00 36.38 34.32 2e4j s VAL 178 CO -0.07 0.12 0.05 -0.36 -3.33 0.00 0.00 175.10 171.51 2e4j s PHE 179 N 2.36 3.30 0.40 1.54 0.40 -1.26 -0.66 117.98 124.06 2e4j s PHE 179 Ca 0.02 0.30 -0.09 0.00 -0.60 0.00 0.00 56.93 56.56 2e4j s PHE 179 Cb -0.12 -1.84 -0.06 0.00 0.51 0.00 0.00 43.02 41.51 2e4j s PHE 179 CO -0.07 0.55 0.74 -0.51 0.70 0.00 0.00 175.22 176.63 2e4j s LEU 180 N -0.91 3.83 1.00 -0.37 1.02 -1.26 -4.87 118.68 117.12 2e4j s LEU 180 Ca 0.14 1.04 -0.12 0.00 0.02 0.00 0.00 54.13 55.21 2e4j s LEU 180 Cb -0.12 -3.93 0.16 0.00 0.02 0.00 0.00 46.19 42.33 2e4j s LEU 180 CO 0.03 -0.40 0.89 -0.81 0.02 0.00 0.00 176.35 176.08 2e4j n PRO 181 N -1.40 -1.01 -1.99 1.29 -0.04 -1.26 -4.38 135.00 126.21 2e4j n PRO 181 Ca 0.02 -0.25 -0.29 0.00 -0.04 0.00 0.00 63.50 62.94 2e4j n PRO 181 Cb 0.54 -2.18 0.19 0.00 -0.04 0.00 0.00 33.50 32.01 2e4j n PRO 181 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 2e4j s GLN 182 N -4.30 0.59 0.27 0.54 1.11 -1.26 -4.45 119.66 112.15 2e4j s GLN 182 Ca 0.65 -0.53 -0.26 0.00 0.01 0.00 0.00 55.36 55.23 2e4j s GLN 182 Cb -0.22 -1.87 -0.16 0.00 -1.01 0.00 0.00 33.01 29.74 2e4j s GLN 182 CO 0.62 -2.42 0.52 -2.30 0.01 0.00 0.00 175.29 171.72 2e4j n PRO 183 N -3.74 0.26 -4.38 2.91 -0.02 -1.26 -4.58 135.00 124.20 2e4j n PRO 183 Ca 0.16 0.09 -0.26 0.00 -2.02 0.00 0.00 63.50 61.47 2e4j n PRO 183 Cb 0.59 -1.18 -0.09 0.00 -0.02 0.00 0.00 33.50 32.80 2e4j n PRO 183 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2e4j s ASP 184 N -0.93 4.13 -0.87 2.55 2.15 -1.26 -4.84 116.67 117.61 2e4j s ASP 184 Ca 0.62 -1.18 -0.04 0.00 0.43 0.00 0.00 52.55 52.38 2e4j s ASP 184 Cb -0.81 -0.45 0.00 0.00 -0.30 0.00 0.00 42.92 41.36 2e4j s ASP 184 CO 0.58 -0.43 0.62 1.17 -0.17 0.00 0.00 175.17 176.93 2e4j n LYS 185 N -1.06 -1.40 -0.10 4.34 0.00 -1.26 -4.85 118.16 113.83 2e4j n LYS 185 Ca -0.03 0.73 -0.03 0.00 0.00 0.00 0.00 58.31 58.97 2e4j n LYS 185 Cb 0.65 -2.53 0.19 0.00 0.00 0.00 0.00 35.03 33.33 2e4j n LYS 185 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2e4j h ALA 186 N 1.26 1.17 -2.34 3.14 0.00 -2.01 -3.43 119.26 117.05 2e4j h ALA 186 Ca -0.61 -0.24 -0.51 0.00 0.00 0.00 0.00 54.91 53.55 2e4j h ALA 186 Cb 1.38 -0.19 0.10 0.00 0.00 0.00 0.00 17.79 19.07 2e4j h ALA 186 CO 0.38 0.55 0.36 0.42 0.00 0.00 0.00 179.25 180.96 2e4j s ILE 187 N -5.04 3.79 -0.21 0.00 -1.09 -1.26 -5.08 121.20 112.31 2e4j s ILE 187 Ca -0.09 0.63 -0.19 0.00 -2.23 0.00 0.00 60.65 58.77 2e4j s ILE 187 Cb 0.15 -3.26 0.05 0.00 -1.58 0.00 0.00 42.46 37.82 2e4j s ILE 187 CO 0.80 -0.71 0.55 -1.58 -1.23 0.00 0.00 174.94 172.78 2e4j s GLN 188 N -4.82 0.64 0.00 2.79 0.74 -1.26 -5.19 119.66 112.57 2e4j s GLN 188 Ca 0.60 0.78 0.00 0.00 0.05 0.00 0.00 55.36 56.79 2e4j s GLN 188 Cb -0.15 0.31 0.00 0.00 1.10 0.00 0.00 33.01 34.26 2e4j s GLN 188 CO 0.52 -0.08 0.00 -0.85 -0.55 0.00 0.00 175.29 174.33