#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2e4j s SER 24 N 0.00 5.45 -0.73 1.61 0.15 -1.26 -5.03 113.70 113.90 2e4j s SER 24 Ca 0.00 -1.62 -0.26 0.00 0.70 0.00 0.00 55.95 54.78 2e4j s SER 24 Cb 0.00 -1.92 -0.09 0.00 -1.71 0.00 0.00 66.02 62.30 2e4j s SER 24 CO 0.00 -0.51 2.25 -1.58 1.20 0.00 0.00 173.24 174.60 2e4j s GLN 25 N 1.33 2.02 0.00 5.44 0.74 -1.26 -4.65 119.66 123.28 2e4j s GLN 25 Ca 0.03 0.53 0.00 0.00 0.05 0.00 0.00 55.36 55.98 2e4j s GLN 25 Cb -0.23 -4.76 0.00 0.00 1.10 0.00 0.00 33.01 29.12 2e4j s GLN 25 CO 0.00 -3.78 0.00 0.41 -0.55 0.00 0.00 175.29 171.37 2e4j n GLY 26 N 6.53 4.07 3.14 2.59 0.00 -1.26 -5.15 105.19 115.10 2e4j n GLY 26 Ca 0.40 -0.57 -0.27 0.00 0.00 0.00 0.00 46.02 45.58 2e4j n GLY 26 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2e4j s HIS 27 N 0.00 1.78 -1.83 1.61 3.76 -1.26 -5.01 115.29 114.34 2e4j s HIS 27 Ca 0.00 -0.55 0.31 0.00 -0.15 0.00 0.00 55.06 54.68 2e4j s HIS 27 Cb 0.00 -1.21 1.74 0.00 1.11 0.00 0.00 32.58 34.22 2e4j s HIS 27 CO 0.00 -0.20 2.15 -3.47 -0.85 0.00 0.00 174.74 172.37 2e4j n ASP 28 N 3.24 0.07 -3.16 1.40 2.03 -1.26 -4.86 116.55 114.01 2e4j n ASP 28 Ca -0.19 -0.75 0.00 0.00 0.52 0.00 0.00 54.79 54.38 2e4j n ASP 28 Cb 0.53 -0.09 0.00 0.00 -0.72 0.00 0.00 41.12 40.84 2e4j n ASP 28 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 2e4j n THR 29 N -1.04 0.00 -4.06 5.18 -2.24 -1.26 -4.99 114.28 105.86 2e4j n THR 29 Ca 0.21 0.00 -0.30 0.00 -2.27 0.00 0.00 64.05 61.68 2e4j n THR 29 Cb 0.16 0.00 -0.07 0.00 -2.10 0.00 0.00 70.33 68.33 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 -0.83 4.44 -0.25 2.28 -7.23 -1.26 -4.71 120.40 112.85 2e4j s VAL 30 Ca 0.00 -0.80 -0.29 0.00 -1.81 0.00 0.00 61.98 59.09 2e4j s VAL 30 Cb 0.00 -3.14 -0.03 0.00 0.56 0.00 0.00 36.38 33.77 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 -2.36 3.48 0.95 4.82 -0.44 -1.12 -4.97 119.66 120.02 2e4j s GLN 31 Ca 0.29 1.69 -0.11 0.00 -2.50 0.00 0.00 55.36 54.73 2e4j s GLN 31 Cb -0.12 -4.18 0.13 0.00 -1.64 0.00 0.00 33.01 27.20 2e4j s GLN 31 CO 0.21 -1.69 0.97 -2.30 0.50 0.00 0.00 175.29 172.98 2e4j n PRO 32 N 8.22 -0.58 -2.79 1.67 -0.02 -1.26 -4.29 135.00 135.95 2e4j n PRO 32 Ca 0.23 -0.11 -0.00 0.00 -2.02 0.00 0.00 63.50 61.60 2e4j n PRO 32 Cb 0.46 -2.25 0.00 0.00 -0.02 0.00 0.00 33.50 31.69 2e4j n PRO 32 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2e4j n ASN 33 N -3.65 -6.82 -4.35 2.55 3.02 -1.26 -5.04 115.26 99.70 2e4j n ASN 33 Ca 0.10 -0.06 -0.31 0.00 -0.03 0.00 0.00 54.58 54.28 2e4j n ASN 33 Cb 0.53 -4.58 -0.15 0.00 -0.61 0.00 0.00 39.78 34.96 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 -3.00 2.39 -0.33 3.10 2.19 -1.26 -5.11 117.98 115.96 2e4j s PHE 34 Ca 0.00 -0.39 0.00 0.00 0.33 0.00 0.00 56.93 56.88 2e4j s PHE 34 Cb -0.00 -1.47 0.10 0.00 -1.31 0.00 0.00 43.02 40.34 2e4j s PHE 34 CO 0.62 0.07 0.10 -0.65 1.83 0.00 0.00 175.22 177.19 2e4j s GLN 35 N -0.91 0.89 0.36 10.12 1.11 -1.26 -4.99 119.66 124.98 2e4j s GLN 35 Ca 0.11 -1.29 0.12 0.00 0.01 0.00 0.00 55.36 54.31 2e4j s GLN 35 Cb -0.10 -2.23 0.92 0.00 -1.01 0.00 0.00 33.01 30.59 2e4j s GLN 35 CO 0.01 -0.99 1.80 -0.56 0.01 0.00 0.00 175.29 175.56 2e4j h GLN 36 N 7.89 0.56 0.00 2.91 3.07 -1.99 0.39 115.11 127.94 2e4j h GLN 36 Ca -0.11 -0.03 -0.01 0.00 0.09 0.00 0.00 58.65 58.58 2e4j h GLN 36 Cb 1.01 -0.13 -0.00 0.00 0.08 0.00 0.00 27.48 28.44 2e4j h GLN 36 CO 0.48 0.37 -0.06 -0.44 0.09 0.00 0.00 178.83 179.27 2e4j h ASP 37 N 0.58 0.00 1.20 0.06 3.32 -1.96 0.89 116.42 120.51 2e4j h ASP 37 Ca 0.55 0.00 -0.16 0.00 0.02 0.00 0.00 57.03 57.44 2e4j h ASP 37 Cb 1.10 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.63 2e4j h ASP 37 CO -0.30 0.06 -0.82 0.11 -1.72 0.00 0.00 179.24 176.58 2e4j h LYS 38 N 0.00 0.00 -0.34 3.56 1.57 -0.66 -3.27 116.57 117.43 2e4j h LYS 38 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2e4j h LYS 38 Cb 0.15 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.46 2e4j h LYS 38 CO 0.01 0.69 0.00 1.19 -0.57 0.00 0.00 179.45 180.77 2e4j n PHE 39 N -3.25 0.57 -1.51 -1.35 3.01 -0.48 -5.00 117.46 109.46 2e4j n PHE 39 Ca -0.00 -0.57 -0.29 0.00 1.01 0.00 0.00 57.45 57.60 2e4j n PHE 39 Cb 0.84 -0.08 0.15 0.00 -0.01 0.00 0.00 39.48 40.37 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 -1.35 1.93 0.00 4.37 0.20 0.30 -4.85 118.68 119.29 2e4j s LEU 40 Ca 0.27 0.90 0.00 0.00 0.69 0.00 0.00 54.13 55.99 2e4j s LEU 40 Cb 0.17 -3.15 0.00 0.00 -0.43 0.00 0.00 46.19 42.77 2e4j s LEU 40 CO 0.15 -2.72 0.00 0.61 -0.29 0.00 0.00 176.35 174.10 2e4j n GLY 41 N -2.16 0.91 3.43 7.98 0.00 -1.23 -4.95 105.19 109.17 2e4j n GLY 41 Ca 0.08 -1.56 -0.32 0.00 0.00 0.00 0.00 46.02 44.21 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 2.54 0.06 1.61 1.04 -1.26 -0.86 118.95 122.08 2e4j s ARG 42 Ca 0.00 -0.74 0.05 0.00 -1.04 0.00 0.00 55.73 53.99 2e4j s ARG 42 Cb 0.00 -2.34 -0.03 0.00 -2.04 0.00 0.00 34.95 30.54 2e4j s ARG 42 CO 0.00 0.55 -0.13 -1.58 -0.04 0.00 0.00 175.30 174.10 2e4j s TRP 43 N -0.56 1.12 0.48 5.89 0.52 -0.10 -5.02 118.94 121.27 2e4j s TRP 43 Ca 0.08 -0.44 -0.09 0.00 0.02 0.00 0.00 56.10 55.67 2e4j s TRP 43 Cb -0.11 -0.64 -0.05 0.00 -1.15 0.00 0.00 33.47 31.51 2e4j s TRP 43 CO 0.01 0.03 0.83 0.71 0.02 0.00 0.00 176.95 178.55 2e4j s TYR 44 N -1.18 3.53 0.09 -1.98 1.51 -1.25 -2.10 117.35 115.97 2e4j s TYR 44 Ca -0.02 1.01 0.07 0.00 -1.01 0.00 0.00 57.07 57.12 2e4j s TYR 44 Cb -0.09 -2.45 -0.03 0.00 -0.11 0.00 0.00 41.96 39.28 2e4j s TYR 44 CO 0.02 -0.29 -0.19 -1.12 -1.11 0.00 0.00 175.55 172.86 2e4j s SER 45 N -3.71 2.34 0.00 2.29 0.01 -0.94 0.65 113.70 114.34 2e4j s SER 45 Ca 0.51 -0.66 0.00 0.00 1.31 0.00 0.00 55.95 57.11 2e4j s SER 45 Cb -0.10 -0.12 0.00 0.00 0.21 0.00 0.00 66.02 66.00 2e4j s SER 45 CO 0.41 0.04 0.00 0.00 0.41 0.00 0.00 173.24 174.09 2e4j n ALA 46 N 1.19 0.00 -3.33 1.44 0.00 -1.19 -4.56 120.51 114.06 2e4j n ALA 46 Ca -0.20 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.27 2e4j n ALA 46 Cb 0.54 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.94 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 0.00 0.30 -0.24 0.00 0.00 -1.13 -4.46 107.32 101.78 2e4j s GLY 47 Ca 0.00 3.61 -0.19 0.00 0.00 0.00 0.00 44.72 48.15 2e4j s GLY 47 CO 0.00 3.20 0.62 -2.27 0.00 0.00 0.00 173.10 174.65 2e4j s LEU 48 N 1.85 -0.53 -0.18 0.66 0.20 0.75 0.16 118.68 121.58 2e4j s LEU 48 Ca -0.02 1.30 0.00 0.00 0.69 0.00 0.00 54.13 56.10 2e4j s LEU 48 Cb -0.02 2.13 0.01 0.00 -0.43 0.00 0.00 46.19 47.88 2e4j s LEU 48 CO -0.15 -0.22 -0.16 0.00 -0.29 0.00 0.00 176.35 175.53 2e4j s ALA 49 N 0.85 2.44 -0.21 5.97 0.00 0.24 0.23 121.76 131.28 2e4j s ALA 49 Ca -0.04 -1.17 -0.19 0.00 0.00 0.00 0.00 51.96 50.56 2e4j s ALA 49 Cb -0.05 -1.27 0.06 0.00 0.00 0.00 0.00 23.12 21.85 2e4j s ALA 49 CO -0.07 -0.29 0.57 0.45 0.00 0.00 0.00 175.76 176.42 2e4j s SER 50 N 1.21 -0.61 -0.54 0.00 0.15 -0.85 0.13 113.70 113.19 2e4j s SER 50 Ca 0.02 1.15 -0.06 0.00 0.70 0.00 0.00 55.95 57.77 2e4j s SER 50 Cb -0.14 1.15 -0.07 0.00 -1.71 0.00 0.00 66.02 65.25 2e4j s SER 50 CO -0.08 -0.20 3.07 -3.20 1.20 0.00 0.00 173.24 174.03 2e4j n ASN 51 N 2.92 6.50 -3.68 5.45 2.85 -1.26 -4.02 115.26 124.03 2e4j n ASN 51 Ca -0.14 -2.85 -0.26 0.00 -0.11 0.00 0.00 54.58 51.22 2e4j n ASN 51 Cb 0.56 -1.36 0.22 0.00 1.24 0.00 0.00 39.78 40.44 2e4j n ASN 51 CO 0.00 0.00 0.00 -0.24 -2.11 0.00 0.00 177.26 174.91 2e4j n SER 52 N 1.93 -3.21 0.01 1.20 2.88 -1.26 -5.03 113.62 110.13 2e4j n SER 52 Ca 0.52 -0.51 -0.00 0.00 -1.33 0.00 0.00 58.87 57.55 2e4j n SER 52 Cb 0.61 -0.95 -0.00 0.00 -0.75 0.00 0.00 64.21 63.12 2e4j n SER 52 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2e4j n SER 53 N -3.54 0.31 -4.37 -3.46 2.88 -1.26 -4.92 113.62 99.27 2e4j n SER 53 Ca 0.07 0.04 -0.46 0.00 -1.33 0.00 0.00 58.87 57.20 2e4j n SER 53 Cb 0.51 -0.18 -0.02 0.00 -0.75 0.00 0.00 64.21 63.77 2e4j n SER 53 CO 0.00 0.00 0.00 0.26 -1.23 0.00 0.00 175.04 174.07 2e4j s TRP 54 N -1.29 3.69 0.32 0.66 0.51 -1.26 -4.86 118.94 116.71 2e4j s TRP 54 Ca -0.01 -1.99 0.04 0.00 -2.12 0.00 0.00 56.10 52.02 2e4j s TRP 54 Cb 0.00 -3.97 0.54 0.00 -0.81 0.00 0.00 33.47 29.23 2e4j s TRP 54 CO 0.02 -1.13 1.80 0.74 -0.51 0.00 0.00 176.95 177.88 2e4j h PHE 55 N 7.77 0.48 -0.63 -1.98 0.04 -2.00 -2.70 116.94 117.92 2e4j h PHE 55 Ca 0.15 -0.08 0.03 0.00 2.80 0.00 0.00 57.97 60.87 2e4j h PHE 55 Cb 0.99 -0.13 -0.03 0.00 2.20 0.00 0.00 35.95 38.98 2e4j h PHE 55 CO 1.02 0.58 0.41 -0.09 -0.60 0.00 0.00 178.31 179.64 2e4j h ARG 56 N 0.41 0.74 0.00 1.51 1.12 -1.96 0.74 114.38 116.94 2e4j h ARG 56 Ca 0.07 -0.04 0.00 0.00 -1.11 0.00 0.00 59.98 58.90 2e4j h ARG 56 Cb 0.51 -0.17 0.00 0.00 -0.01 0.00 0.00 29.97 30.30 2e4j h ARG 56 CO 0.03 0.49 0.00 0.39 -3.11 0.00 0.00 179.97 177.77 2e4j n GLU 57 N -4.46 0.17 -0.05 0.20 -0.58 -1.02 -1.54 120.64 113.36 2e4j n GLU 57 Ca 0.07 0.41 -0.10 0.00 -0.42 0.00 0.00 57.16 57.12 2e4j n GLU 57 Cb 0.11 -1.83 -0.04 0.00 -0.57 0.00 0.00 31.44 29.11 2e4j n GLU 57 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 2e4j n LYS 58 N -2.15 0.24 0.28 3.49 4.76 -0.17 -4.61 118.16 119.99 2e4j n LYS 58 Ca 0.02 0.09 0.17 0.00 -2.87 0.00 0.00 58.31 55.72 2e4j n LYS 58 Cb 0.22 -0.98 0.73 0.00 -1.84 0.00 0.00 35.03 33.16 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 -0.28 0.00 -0.49 1.97 2.10 0.32 -2.86 116.57 117.33 2e4j h LYS 59 Ca -0.27 0.00 0.14 0.00 -2.00 0.00 0.00 60.65 58.53 2e4j h LYS 59 Cb 1.28 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 32.59 2e4j h LYS 59 CO -0.13 0.04 0.51 0.00 -2.00 0.00 0.00 179.45 177.86 2e4j h ALA 60 N 1.96 2.24 -0.06 0.07 0.00 -1.45 0.28 119.26 122.31 2e4j h ALA 60 Ca -0.00 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.80 2e4j h ALA 60 Cb 0.46 0.04 -0.15 0.00 0.00 0.00 0.00 17.79 18.14 2e4j h ALA 60 CO 0.00 -0.76 -0.69 1.33 0.00 0.00 0.00 179.25 179.14 2e4j n VAL 61 N -3.74 1.60 -1.44 0.00 0.24 -1.08 -5.06 118.33 108.85 2e4j n VAL 61 Ca 0.09 -2.69 -0.52 0.00 -2.04 0.00 0.00 64.34 59.18 2e4j n VAL 61 Cb 0.70 0.08 -0.08 0.00 -1.47 0.00 0.00 33.84 33.08 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 -0.64 1.98 -4.72 1.34 -0.00 0.99 -4.93 117.00 111.02 2e4j n LEU 62 Ca 0.17 0.50 -0.24 0.00 -0.00 0.00 0.00 56.01 56.44 2e4j n LEU 62 Cb 0.84 -1.21 -0.07 0.00 -0.00 0.00 0.00 43.42 42.98 2e4j n LEU 62 CO -0.01 -0.71 -0.20 -0.72 -0.00 0.00 0.00 177.39 175.76 2e4j s TYR 63 N 6.83 2.66 1.17 1.47 -0.85 -1.26 -4.82 117.35 122.55 2e4j s TYR 63 Ca 1.10 -0.43 -0.14 0.00 -0.52 0.00 0.00 57.07 57.08 2e4j s TYR 63 Cb -0.96 -1.70 0.28 0.00 0.38 0.00 0.00 41.96 39.97 2e4j s TYR 63 CO 0.52 0.32 1.03 -1.64 -1.52 0.00 0.00 175.55 174.26 2e4j s MET 64 N -3.85 -0.96 -0.10 -3.49 -1.94 0.12 -4.19 119.30 104.89 2e4j s MET 64 Ca 0.38 0.65 -0.03 0.00 -1.71 0.00 0.00 55.69 54.98 2e4j s MET 64 Cb -0.01 -1.56 0.04 0.00 2.01 0.00 0.00 34.83 35.31 2e4j s MET 64 CO 0.22 -3.70 0.04 0.00 -0.01 0.00 0.00 175.02 171.58 2e4j s LYS 66 N 2.05 0.34 0.02 0.00 2.20 -0.97 -2.23 119.74 121.15 2e4j s LYS 66 Ca 0.03 -0.72 -0.17 0.00 -0.36 0.00 0.00 55.97 54.76 2e4j s LYS 66 Cb -0.14 -1.37 -0.06 0.00 -1.51 0.00 0.00 37.83 34.75 2e4j s LYS 66 CO -0.06 -1.03 0.47 0.99 -0.36 0.00 0.00 175.35 175.37 2e4j s THR 67 N 1.91 4.94 -0.01 3.43 2.01 -0.89 -2.54 115.64 124.48 2e4j s THR 67 Ca 0.10 0.99 0.05 0.00 0.31 0.00 0.00 61.69 63.14 2e4j s THR 67 Cb -0.17 -3.79 -0.03 0.00 0.01 0.00 0.00 72.50 68.52 2e4j s THR 67 CO -0.32 0.55 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.31 2e4j s VAL 68 N -0.94 2.93 -0.08 3.82 1.01 -0.33 -0.93 120.40 125.88 2e4j s VAL 68 Ca 0.26 -0.94 0.03 0.00 0.00 0.00 0.00 61.98 61.32 2e4j s VAL 68 Cb -0.18 -2.18 -0.02 0.00 0.00 0.00 0.00 36.38 34.00 2e4j s VAL 68 CO 0.15 0.47 -0.16 0.68 0.00 0.00 0.00 175.10 176.24 2e4j s VAL 69 N -0.83 2.82 -0.23 2.92 -7.23 -0.04 -1.10 120.40 116.71 2e4j s VAL 69 Ca 0.13 -0.79 -0.25 0.00 -1.81 0.00 0.00 61.98 59.27 2e4j s VAL 69 Cb -0.11 -2.12 0.07 0.00 0.56 0.00 0.00 36.38 34.79 2e4j s VAL 69 CO 0.03 0.56 0.68 0.00 -0.31 0.00 0.00 175.10 176.07 2e4j s ALA 70 N -0.25 -1.70 0.71 1.32 0.00 -1.07 -3.48 121.76 117.29 2e4j s ALA 70 Ca 0.01 1.86 -0.16 0.00 0.00 0.00 0.00 51.96 53.66 2e4j s ALA 70 Cb -0.13 -1.00 0.02 0.00 0.00 0.00 0.00 23.12 22.01 2e4j s ALA 70 CO 0.03 -0.33 1.23 -2.30 0.00 0.00 0.00 175.76 174.39 2e4j n PRO 71 N 2.51 0.74 -3.50 0.00 -0.02 -1.26 0.12 135.00 133.59 2e4j n PRO 71 Ca -0.15 0.32 -0.23 0.00 -2.02 0.00 0.00 63.50 61.42 2e4j n PRO 71 Cb 0.55 -2.47 0.01 0.00 -0.02 0.00 0.00 33.50 31.57 2e4j n PRO 71 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2e4j n SER 72 N -2.35 2.50 -4.77 2.55 2.88 0.24 -4.30 113.62 110.37 2e4j n SER 72 Ca 0.15 -2.68 -0.29 0.00 -1.33 0.00 0.00 58.87 54.72 2e4j n SER 72 Cb 0.49 -0.10 0.14 0.00 -0.75 0.00 0.00 64.21 63.99 2e4j n SER 72 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 2e4j s THR 73 N -2.48 2.03 0.00 2.46 -4.23 -1.26 -4.00 115.64 108.17 2e4j s THR 73 Ca 0.34 0.01 0.00 0.00 -1.18 0.00 0.00 61.69 60.86 2e4j s THR 73 Cb -0.03 -2.72 0.00 0.00 1.34 0.00 0.00 72.50 71.09 2e4j s THR 73 CO 0.21 -0.01 0.00 -0.62 -0.54 0.00 0.00 174.62 173.66 2e4j n GLU 74 N -3.83 0.00 0.00 3.99 1.02 -1.26 -2.69 120.64 117.88 2e4j n GLU 74 Ca 0.06 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.20 2e4j n GLU 74 Cb 0.59 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 32.01 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 0.00 0.00 0.00 0.62 0.00 -1.26 -5.17 105.19 99.38 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 5.88 3.24 -0.02 0.00 -1.09 -4.33 105.19 108.87 2e4j n GLY 76 Ca 0.00 -1.57 -0.14 0.00 0.00 0.00 0.00 46.02 44.30 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 2.51 -0.25 0.99 0.20 0.44 0.82 118.68 123.39 2e4j s LEU 77 Ca 0.00 -0.98 -0.03 0.00 0.69 0.00 0.00 54.13 53.81 2e4j s LEU 77 Cb 0.00 -0.36 0.10 0.00 -0.43 0.00 0.00 46.19 45.51 2e4j s LEU 77 CO 0.00 -0.31 0.20 0.21 -0.29 0.00 0.00 176.35 176.16 2e4j s ASN 78 N -3.07 2.18 -0.18 3.68 2.47 0.33 -0.18 114.94 120.18 2e4j s ASN 78 Ca 0.15 -0.73 -0.08 0.00 0.42 0.00 0.00 52.86 52.63 2e4j s ASN 78 Cb 0.02 0.14 -0.04 0.00 -1.45 0.00 0.00 41.25 39.91 2e4j s ASN 78 CO 0.01 -0.38 0.09 -1.48 -3.72 0.00 0.00 177.10 171.62 2e4j s LEU 79 N 2.25 4.00 -0.34 3.21 2.34 0.31 -2.59 118.68 127.86 2e4j s LEU 79 Ca 0.08 0.17 -0.14 0.00 0.06 0.00 0.00 54.13 54.30 2e4j s LEU 79 Cb -0.15 -2.01 -0.02 0.00 -0.56 0.00 0.00 46.19 43.45 2e4j s LEU 79 CO -0.25 0.21 0.30 -0.89 -1.06 0.00 0.00 176.35 174.65 2e4j s THR 80 N 0.18 5.23 -0.25 5.48 2.01 -0.26 -0.67 115.64 127.36 2e4j s THR 80 Ca 0.06 -0.09 -0.13 0.00 0.31 0.00 0.00 61.69 61.85 2e4j s THR 80 Cb -0.12 -3.76 -0.04 0.00 0.01 0.00 0.00 72.50 68.59 2e4j s THR 80 CO -0.00 -0.04 0.26 -0.44 -0.69 0.00 0.00 174.62 173.71 2e4j s SER 81 N 1.73 6.18 -0.08 3.53 0.01 0.59 -1.18 113.70 124.47 2e4j s SER 81 Ca 0.09 0.20 0.03 0.00 1.31 0.00 0.00 55.95 57.58 2e4j s SER 81 Cb -0.17 -2.16 -0.01 0.00 0.21 0.00 0.00 66.02 63.89 2e4j s SER 81 CO 0.11 -0.05 -0.19 0.28 0.41 0.00 0.00 173.24 173.81 2e4j s THR 82 N 1.51 2.61 -0.03 1.44 -1.32 -1.05 -0.14 115.64 118.66 2e4j s THR 82 Ca 0.11 -0.85 0.04 0.00 -1.21 0.00 0.00 61.69 59.78 2e4j s THR 82 Cb -0.15 -2.03 -0.03 0.00 -1.51 0.00 0.00 72.50 68.79 2e4j s THR 82 CO 0.08 0.56 -0.15 0.72 -2.21 0.00 0.00 174.62 173.62 2e4j s PHE 83 N -0.08 2.68 -0.31 9.09 -0.71 -1.04 -2.30 117.98 125.31 2e4j s PHE 83 Ca -0.04 -0.17 -0.06 0.00 -1.04 0.00 0.00 56.93 55.62 2e4j s PHE 83 Cb -0.14 -1.60 0.03 0.00 -1.21 0.00 0.00 43.02 40.10 2e4j s PHE 83 CO 0.04 0.21 0.07 -1.17 -1.34 0.00 0.00 175.22 173.03 2e4j s LEU 84 N -0.90 4.04 0.40 -1.99 1.98 -1.13 0.10 118.68 121.19 2e4j s LEU 84 Ca 0.12 -1.00 0.04 0.00 -2.89 0.00 0.00 54.13 50.41 2e4j s LEU 84 Cb -0.11 -1.84 -0.02 0.00 0.66 0.00 0.00 46.19 44.88 2e4j s LEU 84 CO 0.02 -0.26 0.16 -0.60 -1.89 0.00 0.00 176.35 173.78 2e4j s ARG 85 N 1.41 1.93 0.63 1.98 3.52 -0.76 0.11 118.95 127.77 2e4j s ARG 85 Ca -0.01 -2.18 0.27 0.00 -0.13 0.00 0.00 55.73 53.69 2e4j s ARG 85 Cb -0.19 -0.43 1.42 0.00 -1.56 0.00 0.00 34.95 34.19 2e4j s ARG 85 CO 0.02 -0.53 1.82 0.87 -0.81 0.00 0.00 175.30 176.66 2e4j h LYS 86 N 1.81 0.00 -1.26 5.12 1.57 -1.95 0.18 116.57 122.05 2e4j h LYS 86 Ca -0.33 0.00 -0.41 0.00 -1.87 0.00 0.00 60.65 58.04 2e4j h LYS 86 Cb 1.27 0.00 -0.19 0.00 0.08 0.00 0.00 32.23 33.39 2e4j h LYS 86 CO 0.52 0.00 0.53 -1.71 -0.57 0.00 0.00 179.45 178.22 2e4j n ASN 87 N -3.24 5.96 -0.32 0.86 5.15 -1.26 -5.02 115.26 117.38 2e4j n ASN 87 Ca 0.04 -3.23 0.00 0.00 -0.60 0.00 0.00 54.58 50.79 2e4j n ASN 87 Cb 0.60 -0.95 0.00 0.00 -0.53 0.00 0.00 39.78 38.90 2e4j n ASN 87 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2e4j n GLN 88 N -0.20 0.00 -3.29 1.20 6.02 0.64 -4.77 117.38 116.98 2e4j n GLN 88 Ca 0.40 0.00 -0.37 0.00 -0.01 0.00 0.00 57.00 57.02 2e4j n GLN 88 Cb 0.78 0.00 -0.06 0.00 1.02 0.00 0.00 30.24 31.98 2e4j n GLN 88 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2e4j s ALA 89 N -1.75 3.57 0.17 -1.58 0.00 -1.26 -1.83 121.76 119.09 2e4j s ALA 89 Ca 0.00 -0.01 0.07 0.00 0.00 0.00 0.00 51.96 52.01 2e4j s ALA 89 Cb 0.00 -2.61 -0.04 0.00 0.00 0.00 0.00 23.12 20.47 2e4j s ALA 89 CO 0.00 0.41 0.03 -1.21 0.00 0.00 0.00 175.76 175.00 2e4j s GLU 90 N -1.49 2.53 -0.24 0.00 8.01 0.12 -4.92 118.70 122.70 2e4j s GLU 90 Ca 0.33 -1.05 0.01 0.00 0.01 0.00 0.00 54.97 54.28 2e4j s GLU 90 Cb -0.18 -2.43 0.04 0.00 -4.31 0.00 0.00 34.13 27.26 2e4j s GLU 90 CO 0.19 0.46 -0.12 0.99 0.01 0.00 0.00 175.26 176.80 2e4j s THR 91 N -1.74 2.32 0.02 3.63 2.01 -1.26 -2.49 115.64 118.13 2e4j s THR 91 Ca 0.28 -1.32 0.08 0.00 0.31 0.00 0.00 61.69 61.04 2e4j s THR 91 Cb -0.09 -2.23 -0.03 0.00 0.01 0.00 0.00 72.50 70.16 2e4j s THR 91 CO 0.20 0.16 -0.23 -0.75 -0.69 0.00 0.00 174.62 173.31 2e4j s LYS 92 N 1.20 2.01 -0.12 4.92 2.36 0.79 -5.00 119.74 125.90 2e4j s LYS 92 Ca -0.03 -1.00 -0.03 0.00 -2.55 0.00 0.00 55.97 52.36 2e4j s LYS 92 Cb -0.17 -2.09 -0.03 0.00 -1.05 0.00 0.00 37.83 34.48 2e4j s LYS 92 CO -0.07 0.54 0.00 0.42 1.55 0.00 0.00 175.35 177.79 2e4j s ILE 93 N -0.80 4.28 -0.09 5.43 1.09 -1.26 -0.30 121.20 129.55 2e4j s ILE 93 Ca 0.12 -0.24 -0.02 0.00 -1.10 0.00 0.00 60.65 59.41 2e4j s ILE 93 Cb -0.10 -2.84 0.04 0.00 -1.06 0.00 0.00 42.46 38.50 2e4j s ILE 93 CO 0.02 0.56 0.05 -0.04 -0.10 0.00 0.00 174.94 175.43 2e4j s MET 94 N -0.38 0.20 -0.15 2.79 -1.94 0.15 -4.94 119.30 115.04 2e4j s MET 94 Ca 0.07 0.14 -0.05 0.00 -1.71 0.00 0.00 55.69 54.14 2e4j s MET 94 Cb -0.12 -1.04 -0.03 0.00 2.01 0.00 0.00 34.83 35.64 2e4j s MET 94 CO 0.02 -0.42 0.02 0.54 -0.01 0.00 0.00 175.02 175.17 2e4j s VAL 95 N 2.08 4.44 -0.12 -6.03 0.11 -1.26 0.11 120.40 119.74 2e4j s VAL 95 Ca 0.04 -0.17 0.03 0.00 -2.93 0.00 0.00 61.98 58.95 2e4j s VAL 95 Cb -0.13 -2.95 -0.00 0.00 -1.53 0.00 0.00 36.38 31.76 2e4j s VAL 95 CO -0.05 0.51 -0.21 -0.76 -3.33 0.00 0.00 175.10 171.25 2e4j s LEU 96 N 0.04 2.21 -0.23 2.54 2.01 0.75 -4.94 118.68 121.06 2e4j s LEU 96 Ca 0.03 -0.53 -0.08 0.00 0.01 0.00 0.00 54.13 53.56 2e4j s LEU 96 Cb -0.13 -1.46 -0.04 0.00 0.01 0.00 0.00 46.19 44.58 2e4j s LEU 96 CO 0.02 0.14 0.10 -1.10 1.01 0.00 0.00 176.35 176.51 2e4j s GLN 97 N 0.47 3.84 0.08 1.70 -0.21 -1.26 0.17 119.66 124.45 2e4j s GLN 97 Ca -0.15 -0.39 -0.35 0.00 0.02 0.00 0.00 55.36 54.49 2e4j s GLN 97 Cb -0.17 -3.37 -0.15 0.00 1.00 0.00 0.00 33.01 30.32 2e4j s GLN 97 CO 0.06 -0.02 1.55 -0.35 -2.12 0.00 0.00 175.29 174.41 2e4j n PRO 98 N 4.46 1.78 0.08 2.91 -0.04 -1.26 -2.92 135.00 140.01 2e4j n PRO 98 Ca -0.16 0.64 -0.23 0.00 -0.04 0.00 0.00 63.50 63.72 2e4j n PRO 98 Cb 0.52 -2.38 -0.15 0.00 -0.04 0.00 0.00 33.50 31.45 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 0.01 0.00 0.55 0.00 0.75 -3.46 119.26 123.09 2e4j h ALA 99 Ca -0.46 -0.97 0.00 0.00 0.00 0.00 0.00 54.91 53.48 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 0.78 0.00 0.41 0.00 0.00 0.00 179.25 181.30 2e4j n GLY 100 N 1.77 1.59 3.72 0.00 0.00 -1.24 -5.02 105.19 106.02 2e4j n GLY 100 Ca -0.21 -0.13 -0.35 0.00 0.00 0.00 0.00 46.02 45.33 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 0.00 3.45 -0.89 4.61 0.00 -1.26 -5.00 121.76 122.66 2e4j s ALA 101 Ca 0.00 -0.76 -0.17 0.00 0.00 0.00 0.00 51.96 51.04 2e4j s ALA 101 Cb 0.00 -1.66 -0.24 0.00 0.00 0.00 0.00 23.12 21.22 2e4j s ALA 101 CO 0.00 0.54 2.24 -2.30 0.00 0.00 0.00 175.76 176.25 2e4j n PRO 102 N 2.29 0.25 0.00 0.00 -0.02 -1.26 -0.43 135.00 135.84 2e4j n PRO 102 Ca -0.19 -0.40 0.00 0.00 -2.02 0.00 0.00 63.50 60.89 2e4j n PRO 102 Cb 0.54 -2.23 0.00 0.00 -0.02 0.00 0.00 33.50 31.78 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 6.07 1.93 2.75 -1.23 0.00 -1.26 -4.79 105.19 108.65 2e4j n GLY 103 Ca 0.57 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.34 2e4j n GLY 103 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2e4j s HIS 104 N -2.00 0.77 0.32 1.61 5.04 0.43 -0.89 115.29 120.57 2e4j s HIS 104 Ca 0.00 -0.44 0.03 0.00 -1.54 0.00 0.00 55.06 53.11 2e4j s HIS 104 Cb 0.00 -0.88 -0.04 0.00 0.04 0.00 0.00 32.58 31.70 2e4j s HIS 104 CO 0.00 -0.45 0.16 0.71 -2.34 0.00 0.00 174.74 172.82 2e4j s TYR 105 N 1.94 1.63 -0.12 3.88 2.02 -1.15 0.13 117.35 125.68 2e4j s TYR 105 Ca 0.03 -1.38 0.01 0.00 -0.37 0.00 0.00 57.07 55.36 2e4j s TYR 105 Cb -0.14 -0.88 0.02 0.00 -0.40 0.00 0.00 41.96 40.55 2e4j s TYR 105 CO -0.07 -0.52 -0.13 0.99 -1.57 0.00 0.00 175.55 174.26 2e4j s THR 106 N -3.56 1.40 -0.68 -0.71 2.01 -1.15 -3.73 115.64 109.22 2e4j s THR 106 Ca 0.35 -0.56 0.05 0.00 0.31 0.00 0.00 61.69 61.84 2e4j s THR 106 Cb 0.05 -1.31 0.18 0.00 0.01 0.00 0.00 72.50 71.42 2e4j s THR 106 CO 0.18 0.43 0.52 0.00 -0.69 0.00 0.00 174.62 175.05 2e4j n TYR 107 N 4.50 3.05 -4.27 4.92 9.36 0.32 -4.29 117.16 130.76 2e4j n TYR 107 Ca -0.17 -4.24 -0.34 0.00 3.32 0.00 0.00 57.90 56.47 2e4j n TYR 107 Cb 0.51 -0.57 -0.10 0.00 -0.63 0.00 0.00 39.34 38.55 2e4j n TYR 107 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 2e4j s SER 108 N -1.52 5.25 0.70 2.98 0.15 -1.24 -2.46 113.70 117.57 2e4j s SER 108 Ca 0.27 0.06 -0.10 0.00 0.70 0.00 0.00 55.95 56.88 2e4j s SER 108 Cb -0.01 -1.72 0.03 0.00 -1.71 0.00 0.00 66.02 62.61 2e4j s SER 108 CO -0.15 0.26 1.07 -0.44 1.20 0.00 0.00 173.24 175.18 2e4j s SER 109 N -0.19 5.26 1.18 5.45 0.01 0.69 -4.97 113.70 121.13 2e4j s SER 109 Ca 0.05 0.94 -0.14 0.00 1.31 0.00 0.00 55.95 58.12 2e4j s SER 109 Cb -0.12 -1.71 0.21 0.00 0.21 0.00 0.00 66.02 64.61 2e4j s SER 109 CO 0.02 -1.41 0.48 -0.81 0.41 0.00 0.00 173.24 171.93 2e4j n PRO 110 N -2.98 -3.06 -1.32 12.44 -0.04 -1.26 -4.73 135.00 134.06 2e4j n PRO 110 Ca 0.07 -0.81 0.08 0.00 -0.04 0.00 0.00 63.50 62.79 2e4j n PRO 110 Cb 0.58 -1.15 -0.04 0.00 -0.04 0.00 0.00 33.50 32.84 2e4j n PRO 110 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 2e4j n HIS 111 N -4.54 -3.57 -1.68 0.54 8.25 -1.26 -4.71 115.22 108.25 2e4j n HIS 111 Ca 0.08 1.96 -0.42 0.00 -0.26 0.00 0.00 57.72 59.07 2e4j n HIS 111 Cb 0.34 -3.16 -0.03 0.00 1.12 0.00 0.00 29.99 28.26 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 -3.28 4.09 0.00 0.41 3.41 -1.26 -4.57 113.62 112.42 2e4j n SER 112 Ca -0.04 0.95 0.00 0.00 -0.26 0.00 0.00 58.87 59.51 2e4j n SER 112 Cb 0.51 -1.53 0.00 0.00 -0.26 0.00 0.00 64.21 62.93 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 4.39 1.08 3.95 5.00 0.00 -1.26 -4.77 105.19 113.58 2e4j n GLY 113 Ca 0.19 -1.62 -0.39 0.00 0.00 0.00 0.00 46.02 44.20 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 0.08 -4.02 -4.71 1.61 2.88 -1.12 -4.56 113.62 103.78 2e4j n SER 114 Ca 0.00 -1.18 -0.34 0.00 -1.33 0.00 0.00 58.87 56.01 2e4j n SER 114 Cb 0.00 -2.35 -0.09 0.00 -0.75 0.00 0.00 64.21 61.02 2e4j n SER 114 CO 0.00 0.00 0.00 -0.51 -1.23 0.00 0.00 175.04 173.30 2e4j s ILE 115 N -3.58 4.41 -0.26 2.46 2.07 -1.16 -0.22 121.20 124.92 2e4j s ILE 115 Ca 0.43 -0.29 -0.17 0.00 -1.41 0.00 0.00 60.65 59.21 2e4j s ILE 115 Cb -0.20 -2.89 0.07 0.00 0.13 0.00 0.00 42.46 39.56 2e4j s ILE 115 CO 0.93 0.54 0.64 -2.28 -1.91 0.00 0.00 174.94 172.87 2e4j s HIS 116 N -0.96 -0.91 -0.01 3.50 2.46 -1.03 -2.83 115.29 115.51 2e4j s HIS 116 Ca 0.15 1.92 0.03 0.00 0.47 0.00 0.00 55.06 57.63 2e4j s HIS 116 Cb -0.11 0.48 -0.01 0.00 -0.13 0.00 0.00 32.58 32.81 2e4j s HIS 116 CO 0.05 -0.46 -0.10 -1.12 -2.47 0.00 0.00 174.74 170.64 2e4j s SER 117 N 1.27 1.23 0.05 9.88 0.01 -1.17 0.12 113.70 125.09 2e4j s SER 117 Ca -0.07 -0.19 0.09 0.00 1.31 0.00 0.00 55.95 57.08 2e4j s SER 117 Cb -0.05 -0.18 -0.03 0.00 0.21 0.00 0.00 66.02 65.97 2e4j s SER 117 CO -0.13 0.12 -0.24 0.54 0.41 0.00 0.00 173.24 173.94 2e4j s VAL 118 N -0.16 2.38 0.09 3.43 0.11 -1.24 -2.17 120.40 122.83 2e4j s VAL 118 Ca 0.03 -1.34 0.02 0.00 -2.93 0.00 0.00 61.98 57.75 2e4j s VAL 118 Cb -0.05 -1.96 -0.04 0.00 -1.53 0.00 0.00 36.38 32.80 2e4j s VAL 118 CO -0.00 0.34 -0.07 -0.44 -3.33 0.00 0.00 175.10 171.59 2e4j s SER 119 N -1.37 1.11 -0.10 3.54 0.01 0.19 -2.96 113.70 114.12 2e4j s SER 119 Ca 0.13 -0.89 -0.26 0.00 1.31 0.00 0.00 55.95 56.24 2e4j s SER 119 Cb -0.10 0.07 -0.02 0.00 0.21 0.00 0.00 66.02 66.18 2e4j s SER 119 CO 0.03 -0.39 0.83 -0.69 0.41 0.00 0.00 173.24 173.43 2e4j s VAL 120 N -3.01 4.93 -0.14 3.43 1.01 -0.07 0.92 120.40 127.46 2e4j s VAL 120 Ca 0.06 1.67 -0.11 0.00 0.00 0.00 0.00 61.98 63.61 2e4j s VAL 120 Cb 0.01 -4.15 -0.07 0.00 0.00 0.00 0.00 36.38 32.17 2e4j s VAL 120 CO -0.03 0.12 0.02 0.58 0.00 0.00 0.00 175.10 175.79 2e4j h VAL 121 N 4.98 0.32 -1.32 2.92 2.07 0.55 -2.96 116.25 122.80 2e4j h VAL 121 Ca -0.35 -1.33 0.24 0.00 0.82 0.00 0.00 66.70 66.08 2e4j h VAL 121 Cb 1.17 0.69 -0.22 0.00 -1.52 0.00 0.00 31.29 31.41 2e4j h VAL 121 CO 0.80 0.11 0.84 -1.83 0.02 0.00 0.00 177.57 177.50 2e4j s GLU 122 N -2.08 0.24 0.19 1.57 -1.05 -1.01 -2.81 118.70 113.75 2e4j s GLU 122 Ca -0.14 -0.04 0.05 0.00 -0.15 0.00 0.00 54.97 54.70 2e4j s GLU 122 Cb 0.02 0.11 -0.05 0.00 -0.44 0.00 0.00 34.13 33.77 2e4j s GLU 122 CO 0.27 -0.09 -0.07 0.00 0.95 0.00 0.00 175.26 176.31 2e4j s ALA 123 N -1.83 1.71 -0.15 -0.84 0.00 -1.26 -2.66 121.76 116.74 2e4j s ALA 123 Ca 0.08 -1.63 -0.00 0.00 0.00 0.00 0.00 51.96 50.41 2e4j s ALA 123 Cb -0.01 0.17 0.03 0.00 0.00 0.00 0.00 23.12 23.32 2e4j s ALA 123 CO -0.05 -0.12 -0.09 1.21 0.00 0.00 0.00 175.76 176.72 2e4j s ASN 124 N -3.25 2.62 -1.50 0.00 2.47 -0.43 -4.81 114.94 110.04 2e4j s ASN 124 Ca 0.22 -0.52 -0.06 0.00 0.42 0.00 0.00 52.86 52.92 2e4j s ASN 124 Cb 0.03 -0.98 0.05 0.00 -1.45 0.00 0.00 41.25 38.90 2e4j s ASN 124 CO 0.05 -0.13 0.55 -1.22 -3.72 0.00 0.00 177.10 172.63 2e4j n TYR 125 N 4.86 -1.71 -3.65 0.43 4.02 -1.26 -0.81 117.16 119.03 2e4j n TYR 125 Ca -0.13 0.77 -0.23 0.00 -0.01 0.00 0.00 57.90 58.30 2e4j n TYR 125 Cb 0.49 -3.53 0.06 0.00 -0.02 0.00 0.00 39.34 36.34 2e4j n TYR 125 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 176.86 172.38 2e4j n ASP 126 N -2.88 -3.44 -3.32 7.72 -0.08 -1.26 -4.97 116.55 108.32 2e4j n ASP 126 Ca -0.18 -0.69 -0.07 0.00 -1.51 0.00 0.00 54.79 52.33 2e4j n ASP 126 Cb 0.62 -4.53 0.01 0.00 2.34 0.00 0.00 41.12 39.55 2e4j n ASP 126 CO 0.00 0.00 0.00 -1.61 0.12 0.00 0.00 177.20 175.71 2e4j s GLU 127 N -6.04 1.95 -0.16 -0.67 2.02 0.01 -4.97 118.70 110.84 2e4j s GLU 127 Ca 0.29 -1.20 -0.07 0.00 0.02 0.00 0.00 54.97 54.01 2e4j s GLU 127 Cb -0.13 0.59 0.01 0.00 0.10 0.00 0.00 34.13 34.69 2e4j s GLU 127 CO 0.78 -0.91 0.14 0.66 0.02 0.00 0.00 175.26 175.95 2e4j n TYR 128 N -0.52 -1.44 -3.12 1.61 4.01 -1.26 -1.31 117.16 115.14 2e4j n TYR 128 Ca -0.06 0.62 -0.39 0.00 -0.16 0.00 0.00 57.90 57.90 2e4j n TYR 128 Cb 0.60 -1.90 -0.06 0.00 -0.31 0.00 0.00 39.34 37.67 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 -1.29 3.48 -0.20 -0.72 0.00 -1.02 -3.90 121.76 118.12 2e4j s ALA 129 Ca 0.08 0.17 -0.01 0.00 0.00 0.00 0.00 51.96 52.20 2e4j s ALA 129 Cb -0.01 -2.82 0.06 0.00 0.00 0.00 0.00 23.12 20.35 2e4j s ALA 129 CO 0.34 0.25 -0.00 -0.51 0.00 0.00 0.00 175.76 175.84 2e4j s LEU 130 N -0.70 1.60 0.21 0.00 1.02 -1.09 0.58 118.68 120.31 2e4j s LEU 130 Ca 0.33 -0.86 0.10 0.00 0.02 0.00 0.00 54.13 53.72 2e4j s LEU 130 Cb -0.20 -0.80 -0.04 0.00 0.02 0.00 0.00 46.19 45.16 2e4j s LEU 130 CO 0.21 -0.26 -0.14 -0.76 0.02 0.00 0.00 176.35 175.43 2e4j s LEU 131 N 1.70 2.81 -0.05 1.79 2.01 0.29 0.11 118.68 127.35 2e4j s LEU 131 Ca -0.02 -0.73 0.04 0.00 0.01 0.00 0.00 54.13 53.43 2e4j s LEU 131 Cb -0.17 -1.46 0.00 0.00 0.01 0.00 0.00 46.19 44.57 2e4j s LEU 131 CO -0.07 0.08 -0.16 0.12 1.01 0.00 0.00 176.35 177.33 2e4j s PHE 132 N -1.91 1.61 0.05 0.29 2.19 0.26 -0.69 117.98 119.78 2e4j s PHE 132 Ca 0.26 -0.49 0.01 0.00 0.33 0.00 0.00 56.93 57.04 2e4j s PHE 132 Cb -0.08 -1.10 -0.03 0.00 -1.31 0.00 0.00 43.02 40.50 2e4j s PHE 132 CO 0.14 -0.18 -0.05 0.45 1.83 0.00 0.00 175.22 177.41 2e4j s SER 133 N 0.16 0.62 0.00 6.13 0.15 -0.38 0.54 113.70 120.92 2e4j s SER 133 Ca -0.06 -0.71 -0.28 0.00 0.70 0.00 0.00 55.95 55.59 2e4j s SER 133 Cb -0.12 0.10 0.10 0.00 -1.71 0.00 0.00 66.02 64.40 2e4j s SER 133 CO 0.02 -0.37 1.27 0.00 1.20 0.00 0.00 173.24 175.36 2e4j s ARG 134 N -2.45 0.47 0.00 5.44 1.70 -0.92 -0.77 118.95 122.42 2e4j s ARG 134 Ca -0.04 -0.29 0.00 0.00 -0.47 0.00 0.00 55.73 54.93 2e4j s ARG 134 Cb -0.03 0.14 0.00 0.00 -0.57 0.00 0.00 34.95 34.48 2e4j s ARG 134 CO -0.03 -0.22 0.00 0.41 -1.08 0.00 0.00 175.30 174.38 2e4j n GLY 135 N -0.76 -0.21 3.15 3.88 0.00 -0.35 -3.05 105.19 107.85 2e4j n GLY 135 Ca -0.01 -0.29 0.05 0.00 0.00 0.00 0.00 46.02 45.78 2e4j n GLY 135 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2e4j s THR 136 N 0.00 -0.35 0.73 2.61 -1.32 -1.13 -2.58 115.64 113.61 2e4j s THR 136 Ca 0.00 0.00 -0.06 0.00 -1.21 0.00 0.00 61.69 60.42 2e4j s THR 136 Cb 0.00 -0.68 0.10 0.00 -1.51 0.00 0.00 72.50 70.41 2e4j s THR 136 CO 0.00 0.00 1.03 -0.54 -2.21 0.00 0.00 174.62 172.90 2e4j s LYS 137 N 2.95 1.83 5.21 7.08 3.01 -1.21 -3.01 119.74 135.58 2e4j s LYS 137 Ca 0.12 -0.59 0.00 0.00 -1.01 0.00 0.00 55.97 54.50 2e4j s LYS 137 Cb -0.07 -2.20 0.00 0.00 -1.01 0.00 0.00 37.83 34.55 2e4j s LYS 137 CO -0.17 -1.43 0.00 0.41 0.51 0.00 0.00 175.35 174.67 2e4j n GLY 138 N -2.97 2.68 0.32 -3.33 0.00 -1.26 -3.46 105.19 97.18 2e4j n GLY 138 Ca 0.11 -0.37 -0.16 0.00 0.00 0.00 0.00 46.02 45.60 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 -0.74 0.00 1.61 0.13 -1.91 -2.97 132.00 128.11 2e4j h PRO 139 Ca 0.00 0.05 0.00 0.00 -0.87 0.00 0.00 66.00 65.18 2e4j h PRO 139 Cb 0.00 0.17 0.00 0.00 0.13 0.00 0.00 31.00 31.30 2e4j h PRO 139 CO 0.00 -0.45 0.00 0.41 -0.23 0.00 0.00 178.00 177.73 2e4j n GLY 140 N -1.00 -1.71 0.00 1.56 0.00 -1.22 -4.95 105.19 97.86 2e4j n GLY 140 Ca -0.12 0.92 0.00 0.00 0.00 0.00 0.00 46.02 46.82 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 3.88 -3.31 1.61 -0.06 -1.24 -5.03 117.38 113.23 2e4j n GLN 141 Ca 0.00 0.00 -0.25 0.00 -2.00 0.00 0.00 57.00 54.75 2e4j n GLN 141 Cb 0.00 0.00 -0.09 0.00 -4.06 0.00 0.00 30.24 26.09 2e4j n GLN 141 CO 0.00 0.00 0.00 -0.40 -0.20 0.00 0.00 177.06 176.46 2e4j n ASP 142 N 0.00 -0.68 -4.86 1.69 5.75 -1.26 -4.66 116.55 112.53 2e4j n ASP 142 Ca 0.00 -2.46 -0.32 0.00 -0.01 0.00 0.00 54.79 52.00 2e4j n ASP 142 Cb 0.00 -0.36 -0.05 0.00 -1.03 0.00 0.00 41.12 39.68 2e4j n ASP 142 CO 0.00 0.00 0.00 -0.36 -0.11 0.00 0.00 177.20 176.73 2e4j s PHE 143 N -0.02 3.41 -0.30 2.11 0.40 -1.07 -4.96 117.98 117.55 2e4j s PHE 143 Ca 0.33 1.07 -0.14 0.00 -0.60 0.00 0.00 56.93 57.59 2e4j s PHE 143 Cb 0.05 -2.43 0.18 0.00 0.51 0.00 0.00 43.02 41.34 2e4j s PHE 143 CO -0.18 0.09 1.14 0.50 0.70 0.00 0.00 175.22 177.47 2e4j s ARG 144 N -3.17 0.06 0.11 0.44 3.00 -1.26 -1.21 118.95 116.92 2e4j s ARG 144 Ca 0.51 0.04 0.06 0.00 -1.00 0.00 0.00 55.73 55.35 2e4j s ARG 144 Cb -0.10 0.02 -0.04 0.00 0.00 0.00 0.00 34.95 34.83 2e4j s ARG 144 CO 0.22 -0.10 -0.14 0.00 0.00 0.00 0.00 175.30 175.28 2e4j s MET 145 N 2.88 0.99 -0.01 5.12 0.23 0.05 -4.58 119.30 123.97 2e4j s MET 145 Ca 0.30 -1.20 0.01 0.00 -1.03 0.00 0.00 55.69 53.77 2e4j s MET 145 Cb 0.00 -0.88 -0.04 0.00 -1.53 0.00 0.00 34.83 32.39 2e4j s MET 145 CO -0.22 0.17 0.02 0.00 -2.03 0.00 0.00 175.02 172.96 2e4j s ALA 146 N -2.04 3.34 -0.14 3.16 0.00 0.34 -1.25 121.76 125.18 2e4j s ALA 146 Ca 0.07 -0.92 -0.01 0.00 0.00 0.00 0.00 51.96 51.11 2e4j s ALA 146 Cb -0.05 -1.40 -0.01 0.00 0.00 0.00 0.00 23.12 21.65 2e4j s ALA 146 CO 0.03 0.65 -0.12 0.99 0.00 0.00 0.00 175.76 177.30 2e4j s THR 147 N -1.08 3.11 -0.03 0.00 2.01 0.14 -0.59 115.64 119.20 2e4j s THR 147 Ca 0.19 -0.64 0.02 0.00 0.31 0.00 0.00 61.69 61.57 2e4j s THR 147 Cb -0.12 -2.32 0.01 0.00 0.01 0.00 0.00 72.50 70.09 2e4j s THR 147 CO 0.10 0.52 -0.06 -0.22 -0.69 0.00 0.00 174.62 174.26 2e4j s LEU 148 N 0.42 1.61 0.01 4.42 2.96 0.42 0.10 118.68 128.62 2e4j s LEU 148 Ca -0.09 -0.15 0.04 0.00 -0.22 0.00 0.00 54.13 53.71 2e4j s LEU 148 Cb -0.16 -0.46 -0.03 0.00 0.50 0.00 0.00 46.19 46.04 2e4j s LEU 148 CO 0.05 0.01 -0.10 -0.31 -1.32 0.00 0.00 176.35 174.68 2e4j s TYR 149 N 0.47 2.80 0.67 5.38 2.02 0.20 -2.86 117.35 126.03 2e4j s TYR 149 Ca -0.07 -0.10 -0.05 0.00 -0.37 0.00 0.00 57.07 56.48 2e4j s TYR 149 Cb -0.10 -1.58 0.14 0.00 -0.40 0.00 0.00 41.96 40.02 2e4j s TYR 149 CO 0.00 0.33 0.91 0.43 -1.57 0.00 0.00 175.55 175.66 2e4j n SER 150 N 1.62 0.74 0.00 2.29 7.64 0.21 -2.43 113.62 123.70 2e4j n SER 150 Ca -0.16 -1.74 0.00 0.00 1.01 0.00 0.00 58.87 57.98 2e4j n SER 150 Cb 0.52 -0.64 0.00 0.00 -1.01 0.00 0.00 64.21 63.09 2e4j n SER 150 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 2e4j n ARG 151 N -2.79 0.00 -4.08 1.43 0.63 -1.26 -3.82 116.66 106.77 2e4j n ARG 151 Ca 0.14 0.00 -0.12 0.00 -0.92 0.00 0.00 57.85 56.95 2e4j n ARG 151 Cb 0.48 -0.14 -0.06 0.00 0.45 0.00 0.00 32.46 33.19 2e4j n ARG 151 CO 0.00 0.00 0.00 0.95 -2.51 0.00 0.00 177.63 176.07 2e4j s THR 152 N 0.00 0.00 0.00 5.15 -4.23 -1.26 -4.37 115.64 110.93 2e4j s THR 152 Ca 0.00 -1.63 0.00 0.00 -1.18 0.00 0.00 61.69 58.88 2e4j s THR 152 Cb 0.00 -2.42 0.00 0.00 1.34 0.00 0.00 72.50 71.42 2e4j s THR 152 CO 0.00 0.00 0.00 0.00 -0.54 0.00 0.00 174.62 174.08 2e4j n GLN 153 N -0.41 0.00 -1.37 3.99 1.13 -1.26 -4.48 117.38 114.97 2e4j n GLN 153 Ca 0.00 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.06 2e4j n GLN 153 Cb 0.63 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.98 2e4j n GLN 153 CO 0.00 0.00 0.00 2.41 -1.44 0.00 0.00 177.06 178.03 2e4j n THR 154 N 0.00 0.00 -3.22 5.09 -1.04 -1.26 -4.52 114.28 109.33 2e4j n THR 154 Ca 0.00 0.00 -0.30 0.00 -2.04 0.00 0.00 64.05 61.71 2e4j n THR 154 Cb 0.00 -0.41 -0.04 0.00 -1.82 0.00 0.00 70.33 68.06 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 4.01 -0.18 -4.42 0.05 -1.26 -4.34 118.68 112.53 2e4j s LEU 155 Ca 0.00 0.86 -0.15 0.00 0.05 0.00 0.00 54.13 54.90 2e4j s LEU 155 Cb 0.00 -3.69 -0.04 0.00 -2.05 0.00 0.00 46.19 40.41 2e4j s LEU 155 CO 0.00 -0.23 0.35 -0.54 -0.55 0.00 0.00 176.35 175.37 2e4j s LYS 156 N -3.52 4.21 0.22 1.48 3.01 -1.26 -4.98 119.74 118.90 2e4j s LYS 156 Ca 0.47 0.14 -0.04 0.00 -1.01 0.00 0.00 55.97 55.53 2e4j s LYS 156 Cb -0.11 -3.49 0.21 0.00 -1.01 0.00 0.00 37.83 33.43 2e4j s LYS 156 CO 0.29 0.08 1.64 -0.44 0.51 0.00 0.00 175.35 177.43 2e4j h ASP 157 N 7.10 0.75 -0.54 2.83 5.19 -1.97 -1.27 116.42 128.51 2e4j h ASP 157 Ca -0.38 -0.27 0.10 0.00 -0.62 0.00 0.00 57.03 55.86 2e4j h ASP 157 Cb 1.16 -0.21 -0.08 0.00 0.18 0.00 0.00 39.33 40.38 2e4j h ASP 157 CO 0.73 0.96 0.04 -0.33 -3.12 0.00 0.00 179.24 177.52 2e4j h GLU 158 N 0.65 0.16 -0.01 3.56 3.07 -1.99 0.84 114.58 120.86 2e4j h GLU 158 Ca 0.09 -0.01 -0.15 0.00 -0.50 0.00 0.00 59.36 58.79 2e4j h GLU 158 Cb 0.73 -0.04 -0.02 0.00 -0.84 0.00 0.00 28.75 28.59 2e4j h GLU 158 CO 0.06 0.11 -0.71 1.37 -1.40 0.00 0.00 179.01 178.43 2e4j h LEU 159 N 0.16 0.07 -0.49 1.33 8.10 -1.96 -0.58 115.31 121.96 2e4j h LEU 159 Ca 0.28 -0.05 -0.00 0.00 0.11 0.00 0.00 57.88 58.21 2e4j h LEU 159 Cb 0.41 -0.02 -0.02 0.00 -0.44 0.00 0.00 40.66 40.59 2e4j h LEU 159 CO -0.41 0.76 0.29 0.50 -4.11 0.00 0.00 178.44 175.47 2e4j h LYS 160 N 0.04 0.66 -0.03 0.17 3.11 0.68 0.39 116.57 121.60 2e4j h LYS 160 Ca -0.01 -0.06 -0.08 0.00 -2.81 0.00 0.00 60.65 57.68 2e4j h LYS 160 Cb 1.26 -0.14 0.01 0.00 -1.00 0.00 0.00 32.23 32.36 2e4j h LYS 160 CO 0.10 0.49 -0.30 1.05 -2.81 0.00 0.00 179.45 177.98 2e4j h GLU 161 N 0.65 0.25 -0.10 1.90 4.11 0.56 -2.32 114.58 119.65 2e4j h GLU 161 Ca 0.17 -0.23 -0.04 0.00 0.07 0.00 0.00 59.36 59.33 2e4j h GLU 161 Cb -0.00 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 2e4j h GLU 161 CO -0.03 0.91 -0.12 -0.22 0.07 0.00 0.00 179.01 179.62 2e4j h LYS 162 N -0.32 0.15 0.05 1.06 1.63 -1.00 1.04 116.57 119.17 2e4j h LYS 162 Ca -0.03 -0.03 -0.25 0.00 -0.85 0.00 0.00 60.65 59.49 2e4j h LYS 162 Cb 1.00 -0.02 0.02 0.00 -0.60 0.00 0.00 32.23 32.63 2e4j h LYS 162 CO 0.06 0.28 -1.00 0.35 -3.45 0.00 0.00 179.45 175.68 2e4j h PHE 163 N 0.14 0.92 0.04 1.91 3.04 -0.25 -2.24 116.94 120.51 2e4j h PHE 163 Ca 0.03 -0.54 -0.06 0.00 3.98 0.00 0.00 57.97 61.38 2e4j h PHE 163 Cb 0.31 -0.09 0.01 0.00 2.56 0.00 0.00 35.95 38.73 2e4j h PHE 163 CO 0.00 1.37 -0.27 0.00 -2.02 0.00 0.00 178.31 177.40 2e4j h THR 164 N 0.21 1.67 -1.00 4.41 1.03 -1.11 -2.62 112.91 115.51 2e4j h THR 164 Ca -0.14 -2.31 0.01 0.00 -0.01 0.00 0.00 66.41 63.97 2e4j h THR 164 Cb 1.68 3.21 -0.05 0.00 -1.07 0.00 0.00 68.15 71.92 2e4j h THR 164 CO 0.20 0.62 0.66 0.74 -0.01 0.00 0.00 175.52 177.73 2e4j h THR 165 N -0.73 1.26 -0.14 0.00 2.02 0.99 1.06 112.91 117.37 2e4j h THR 165 Ca -0.04 -0.46 -0.01 0.00 0.77 0.00 0.00 66.41 66.66 2e4j h THR 165 Cb 1.17 -0.21 -0.01 0.00 -1.74 0.00 0.00 68.15 67.36 2e4j h THR 165 CO 0.05 0.25 0.06 0.15 0.37 0.00 0.00 175.52 176.40 2e4j h PHE 166 N 1.35 0.21 -0.26 3.16 3.04 -1.50 0.72 116.94 123.66 2e4j h PHE 166 Ca 0.37 -0.01 -0.13 0.00 3.98 0.00 0.00 57.97 62.17 2e4j h PHE 166 Cb -0.16 -0.06 -0.00 0.00 2.56 0.00 0.00 35.95 38.29 2e4j h PHE 166 CO -0.00 0.28 -0.34 0.77 -2.02 0.00 0.00 178.31 177.00 2e4j h SER 167 N 0.08 0.75 0.17 0.41 0.02 -1.03 -3.02 113.55 110.92 2e4j h SER 167 Ca 0.05 -0.50 -0.17 0.00 -0.84 0.00 0.00 61.79 60.32 2e4j h SER 167 Cb 0.16 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.48 2e4j h SER 167 CO -0.00 1.10 -0.64 0.07 -1.14 0.00 0.00 176.83 176.22 2e4j h LYS 168 N 0.41 0.45 -0.04 3.45 5.09 0.12 -3.07 116.57 122.98 2e4j h LYS 168 Ca 0.03 -0.32 -0.03 0.00 0.09 0.00 0.00 60.65 60.42 2e4j h LYS 168 Cb 0.93 0.05 -0.01 0.00 0.10 0.00 0.00 32.23 33.30 2e4j h LYS 168 CO 0.08 0.94 -0.10 0.00 -2.09 0.00 0.00 179.45 178.29 2e4j h ALA 169 N 0.98 1.76 -0.38 0.07 0.00 0.43 -0.68 119.26 121.43 2e4j h ALA 169 Ca -0.01 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2e4j h ALA 169 Cb 1.19 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.95 2e4j h ALA 169 CO 0.11 0.18 0.00 0.94 0.00 0.00 0.00 179.25 180.49 2e4j n GLN 170 N -4.39 2.94 0.00 0.00 7.27 -1.14 -4.87 117.38 117.19 2e4j n GLN 170 Ca -0.02 -1.81 0.00 0.00 0.07 0.00 0.00 57.00 55.24 2e4j n GLN 170 Cb 0.19 -1.77 0.00 0.00 2.41 0.00 0.00 30.24 31.07 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 0.64 0.76 3.79 1.69 0.00 -0.33 -5.07 105.19 106.68 2e4j n GLY 171 Ca 0.16 -0.69 0.01 0.00 0.00 0.00 0.00 46.02 45.50 2e4j n GLY 171 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2e4j n LEU 172 N 0.00 0.00 0.00 0.99 7.94 -0.79 -4.84 117.00 120.30 2e4j n LEU 172 Ca 0.00 -0.67 0.00 0.00 -1.11 0.00 0.00 56.01 54.23 2e4j n LEU 172 Cb 0.00 2.04 0.00 0.00 0.53 0.00 0.00 43.42 45.99 2e4j n LEU 172 CO 0.00 -0.22 0.00 0.41 -1.11 0.00 0.00 177.39 176.47 2e4j n THR 173 N -0.83 0.00 -0.02 1.96 -1.04 -1.26 -4.32 114.28 108.76 2e4j n THR 173 Ca 0.03 0.00 0.24 0.00 -2.04 0.00 0.00 64.05 62.27 2e4j n THR 173 Cb 0.56 0.00 0.71 0.00 -1.82 0.00 0.00 70.33 69.78 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 -1.96 0.41 114.58 114.32 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 0.05 1.49 0.07 0.00 0.00 179.01 180.62 2e4j h GLU 175 N 0.00 0.00 -0.79 1.06 4.57 -1.94 -2.13 114.58 115.35 2e4j h GLU 175 Ca 0.30 0.00 -0.48 0.00 -1.18 0.00 0.00 59.36 58.00 2e4j h GLU 175 Cb 1.44 0.00 -0.42 0.00 -0.16 0.00 0.00 28.75 29.61 2e4j h GLU 175 CO -0.00 0.00 -0.89 -3.47 -1.18 0.00 0.00 179.01 173.47 2e4j n ASP 176 N -2.79 4.01 -3.75 1.04 -0.08 0.14 -4.20 116.55 110.91 2e4j n ASP 176 Ca -0.02 -3.32 -0.15 0.00 -1.51 0.00 0.00 54.79 49.78 2e4j n ASP 176 Cb 0.11 -0.40 -0.16 0.00 2.34 0.00 0.00 41.12 43.01 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 -4.48 -0.07 -0.11 5.18 1.01 -0.80 -2.00 121.20 119.93 2e4j s ILE 177 Ca 0.44 0.24 -0.04 0.00 0.00 0.00 0.00 60.65 61.30 2e4j s ILE 177 Cb 0.39 -0.12 0.06 0.00 0.01 0.00 0.00 42.46 42.79 2e4j s ILE 177 CO -0.01 0.10 0.21 0.54 0.00 0.00 0.00 174.94 175.79 2e4j s VAL 178 N 1.27 -0.33 -0.08 2.92 0.11 0.61 -4.89 120.40 120.02 2e4j s VAL 178 Ca -0.07 0.31 -0.03 0.00 -2.93 0.00 0.00 61.98 59.26 2e4j s VAL 178 Cb -0.13 -0.37 -0.04 0.00 -1.53 0.00 0.00 36.38 34.32 2e4j s VAL 178 CO -0.04 0.13 0.07 -0.36 -3.33 0.00 0.00 175.10 171.58 2e4j s PHE 179 N 2.31 3.36 0.24 1.54 0.40 -1.26 -0.18 117.98 124.39 2e4j s PHE 179 Ca 0.02 0.32 -0.04 0.00 -0.60 0.00 0.00 56.93 56.63 2e4j s PHE 179 Cb -0.12 -1.83 -0.05 0.00 0.51 0.00 0.00 43.02 41.53 2e4j s PHE 179 CO -0.07 0.59 0.49 -0.51 0.70 0.00 0.00 175.22 176.42 2e4j s LEU 180 N -1.16 4.14 0.87 -0.37 1.43 -1.26 -4.86 118.68 117.47 2e4j s LEU 180 Ca 0.16 0.63 -0.11 0.00 -1.03 0.00 0.00 54.13 53.79 2e4j s LEU 180 Cb -0.12 -3.42 0.11 0.00 0.03 0.00 0.00 46.19 42.79 2e4j s LEU 180 CO 0.06 -0.11 1.09 -2.84 0.23 0.00 0.00 176.35 174.78 2e4j s PRO 181 N -3.32 1.49 0.98 1.29 0.02 -1.26 -4.13 135.00 130.07 2e4j s PRO 181 Ca 0.42 0.98 -0.17 0.00 0.02 0.00 0.00 61.00 62.25 2e4j s PRO 181 Cb -0.11 -1.82 0.04 0.00 0.02 0.00 0.00 34.50 32.63 2e4j s PRO 181 CO 0.28 -2.12 -0.29 0.00 -0.33 0.00 0.00 177.00 174.54 2e4j n GLN 182 N -3.82 -1.24 -0.86 5.54 10.64 -1.26 -2.70 117.38 123.67 2e4j n GLN 182 Ca 0.08 -0.36 -0.36 0.00 -1.83 0.00 0.00 57.00 54.53 2e4j n GLN 182 Cb 0.54 -1.36 0.09 0.00 -0.86 0.00 0.00 30.24 28.65 2e4j n GLN 182 CO 0.00 0.00 0.00 -0.35 -1.83 0.00 0.00 177.06 174.88 2e4j n PRO 183 N -0.33 -0.67 -0.57 2.61 -0.04 -1.26 -3.43 135.00 131.32 2e4j n PRO 183 Ca 0.02 -0.19 0.00 0.00 -0.04 0.00 0.00 63.50 63.29 2e4j n PRO 183 Cb 0.49 -1.30 0.00 0.00 -0.04 0.00 0.00 33.50 32.65 2e4j n PRO 183 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2e4j n ASP 184 N 1.29 0.00 -4.55 3.54 9.92 -1.26 -4.69 116.55 120.80 2e4j n ASP 184 Ca -0.01 -0.90 -0.46 0.00 -0.53 0.00 0.00 54.79 52.89 2e4j n ASP 184 Cb 0.69 0.00 -0.04 0.00 -0.64 0.00 0.00 41.12 41.13 2e4j n ASP 184 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 2e4j n LYS 185 N -0.90 1.66 0.06 -1.24 4.76 -1.26 -4.82 118.16 116.42 2e4j n LYS 185 Ca 0.00 0.45 0.14 0.00 -2.87 0.00 0.00 58.31 56.04 2e4j n LYS 185 Cb 0.00 -2.96 0.63 0.00 -1.84 0.00 0.00 35.03 30.85 2e4j n LYS 185 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2e4j h ALA 186 N 14.07 2.22 -4.18 7.82 0.00 -2.04 -3.41 119.26 133.75 2e4j h ALA 186 Ca -0.36 -0.01 -0.56 0.00 0.00 0.00 0.00 54.91 53.98 2e4j h ALA 186 Cb 1.27 -0.00 -0.28 0.00 0.00 0.00 0.00 17.79 18.78 2e4j h ALA 186 CO 0.98 -0.32 -0.83 0.96 0.00 0.00 0.00 179.25 180.03 2e4j s ILE 187 N -5.13 1.49 0.50 0.00 -4.36 -1.26 -5.15 121.20 107.28 2e4j s ILE 187 Ca -0.06 -0.95 0.06 0.00 -0.26 0.00 0.00 60.65 59.44 2e4j s ILE 187 Cb 0.19 -1.27 0.04 0.00 1.25 0.00 0.00 42.46 42.67 2e4j s ILE 187 CO 0.72 0.29 0.68 0.00 0.24 0.00 0.00 174.94 176.87 2e4j s GLN 188 N -0.77 2.59 0.00 0.37 1.03 -1.26 -5.04 119.66 116.58 2e4j s GLN 188 Ca 0.07 -1.21 0.00 0.00 0.04 0.00 0.00 55.36 54.25 2e4j s GLN 188 Cb -0.08 -2.65 0.00 0.00 0.03 0.00 0.00 33.01 30.31 2e4j s GLN 188 CO 0.00 -0.55 0.34 0.39 -2.54 0.00 0.00 175.29 172.93