#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2e6s n SER 2 N 0.00 -7.83 0.02 1.61 2.88 -1.26 -4.99 113.62 104.05 2e6s n SER 2 Ca 0.00 0.49 0.00 0.00 -1.33 0.00 0.00 58.87 58.03 2e6s n SER 2 Cb 0.00 -5.19 0.00 0.00 -0.75 0.00 0.00 64.21 58.27 2e6s n SER 2 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2e6s n SER 3 N -0.31 -0.11 -0.16 -3.46 2.88 -1.26 -5.14 113.62 106.06 2e6s n SER 3 Ca 0.11 0.07 0.00 0.00 -1.33 0.00 0.00 58.87 57.71 2e6s n SER 3 Cb 0.47 0.20 0.00 0.00 -0.75 0.00 0.00 64.21 64.14 2e6s n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2e6s n GLY 4 N 0.96 4.27 3.56 0.46 0.00 -1.26 -4.82 105.19 108.36 2e6s n GLY 4 Ca 0.00 -2.05 -0.19 0.00 0.00 0.00 0.00 46.02 43.78 2e6s n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2e6s n SER 5 N -0.18 -2.00 -4.77 1.61 7.64 -1.26 -4.94 113.62 109.73 2e6s n SER 5 Ca 0.00 -0.70 -0.38 0.00 1.01 0.00 0.00 58.87 58.80 2e6s n SER 5 Cb 0.00 -4.68 -0.02 0.00 -1.01 0.00 0.00 64.21 58.50 2e6s n SER 5 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2e6s s SER 6 N -4.28 6.48 0.00 6.43 0.01 -1.26 -4.96 113.70 116.13 2e6s s SER 6 Ca 0.05 2.37 0.00 0.00 1.31 0.00 0.00 55.95 59.68 2e6s s SER 6 Cb -0.02 -2.62 0.00 0.00 0.21 0.00 0.00 66.02 63.59 2e6s s SER 6 CO 0.76 -0.70 0.00 0.61 0.41 0.00 0.00 173.24 174.32 2e6s n GLY 7 N 0.62 -1.42 2.64 3.44 0.00 -1.26 -5.15 105.19 104.06 2e6s n GLY 7 Ca 0.04 0.75 -0.28 0.00 0.00 0.00 0.00 46.02 46.54 2e6s n GLY 7 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2e6s s ARG 8 N 0.00 0.32 -0.28 1.61 3.52 -1.26 -5.12 118.95 117.74 2e6s s ARG 8 Ca 0.00 -0.39 -0.24 0.00 -0.13 0.00 0.00 55.73 54.97 2e6s s ARG 8 Cb 0.00 -1.74 0.10 0.00 -1.56 0.00 0.00 34.95 31.75 2e6s s ARG 8 CO 0.00 -0.79 0.90 1.21 -0.81 0.00 0.00 175.30 175.81 2e6s s ASN 9 N 2.00 -0.59 -0.07 -2.12 3.84 -1.26 -5.18 114.94 111.56 2e6s s ASN 9 Ca 0.04 1.11 -0.31 0.00 0.21 0.00 0.00 52.86 53.91 2e6s s ASN 9 Cb -0.16 1.14 0.12 0.00 -0.55 0.00 0.00 41.25 41.80 2e6s s ASN 9 CO -0.18 -0.19 1.10 1.51 -2.79 0.00 0.00 177.10 176.56 2e6s s ASP 10 N 0.44 -0.19 -0.09 -4.21 1.47 -1.26 -5.16 116.67 107.66 2e6s s ASP 10 Ca 0.01 -0.07 -0.03 0.00 1.18 0.00 0.00 52.55 53.64 2e6s s ASP 10 Cb -0.05 0.25 0.04 0.00 -0.34 0.00 0.00 42.92 42.82 2e6s s ASP 10 CO -0.05 -0.43 0.06 0.42 0.68 0.00 0.00 175.17 175.85 2e6s s THR 11 N -2.71 0.01 0.43 2.11 -4.23 -1.26 -5.15 115.64 104.85 2e6s s THR 11 Ca 0.09 0.14 0.03 0.00 -1.18 0.00 0.00 61.69 60.78 2e6s s THR 11 Cb -0.00 -0.39 -0.03 0.00 1.34 0.00 0.00 72.50 73.42 2e6s s THR 11 CO -0.05 0.03 0.08 -1.83 -0.54 0.00 0.00 174.62 172.31 2e6s s GLU 12 N 2.11 1.99 -0.17 3.99 -1.05 -1.26 -5.15 118.70 119.17 2e6s s GLU 12 Ca 0.04 -2.22 -0.01 0.00 -0.15 0.00 0.00 54.97 52.62 2e6s s GLU 12 Cb -0.14 -0.93 -0.01 0.00 -0.44 0.00 0.00 34.13 32.62 2e6s s GLU 12 CO -0.05 -0.41 -0.12 0.00 0.95 0.00 0.00 175.26 175.63 2e6s n ASP 14 N 4.15 0.72 -0.35 0.00 8.00 -1.26 -0.93 116.55 126.87 2e6s n ASP 14 Ca -0.19 0.32 0.10 0.00 0.71 0.00 0.00 54.79 55.74 2e6s n ASP 14 Cb 0.52 0.31 0.28 0.00 -0.02 0.00 0.00 41.12 42.21 2e6s n ASP 14 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 2e6s h LEU 15 N 0.00 0.79 0.00 0.64 4.07 -1.98 -3.29 115.31 115.53 2e6s h LEU 15 Ca -0.23 0.08 0.00 0.00 0.08 0.00 0.00 57.88 57.82 2e6s h LEU 15 Cb 1.72 -0.06 0.00 0.00 1.08 0.00 0.00 40.66 43.40 2e6s h LEU 15 CO 0.05 0.33 -0.99 0.00 -1.08 0.00 0.00 178.44 176.75 2e6s n GLY 17 N 3.23 2.42 0.00 0.00 0.00 -0.11 -4.68 105.19 106.05 2e6s n GLY 17 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2e6s n GLY 17 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2e6s n GLY 18 N -0.52 0.67 3.42 -0.02 0.00 -1.25 -4.65 105.19 102.84 2e6s n GLY 18 Ca 0.00 -0.75 -0.14 0.00 0.00 0.00 0.00 46.02 45.12 2e6s n GLY 18 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2e6s s ASP 19 N -0.90 -0.50 0.01 1.61 1.11 -1.26 -5.07 116.67 111.66 2e6s s ASP 19 Ca 0.00 0.25 -0.23 0.00 0.18 0.00 0.00 52.55 52.75 2e6s s ASP 19 Cb 0.00 0.52 -0.17 0.00 1.07 0.00 0.00 42.92 44.34 2e6s s ASP 19 CO 0.00 -0.74 1.31 1.55 1.18 0.00 0.00 175.17 178.46 2e6s h PRO 20 N 2.68 0.18 0.59 8.23 0.13 -2.02 -3.32 132.00 138.47 2e6s h PRO 20 Ca -0.31 -0.09 -0.03 0.00 -0.87 0.00 0.00 66.00 64.70 2e6s h PRO 20 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 2e6s h PRO 20 CO 0.40 0.62 -0.32 0.93 -0.23 0.00 0.00 178.00 179.40 2e6s h GLU 21 N -0.25 -0.81 -5.62 0.86 5.08 -2.01 -3.40 114.58 108.43 2e6s h GLU 21 Ca 0.01 0.06 -0.52 0.00 -1.00 0.00 0.00 59.36 57.90 2e6s h GLU 21 Cb 0.58 0.18 -0.01 0.00 0.50 0.00 0.00 28.75 30.00 2e6s h GLU 21 CO 0.02 -0.54 1.60 1.63 -1.00 0.00 0.00 179.01 180.72 2e6s n LYS 22 N -5.46 0.99 -1.94 2.33 5.02 -1.25 -4.90 118.16 112.95 2e6s n LYS 22 Ca -0.13 0.12 -0.38 0.00 -2.02 0.00 0.00 58.31 55.90 2e6s n LYS 22 Cb 0.36 -2.90 0.02 0.00 -0.02 0.00 0.00 35.03 32.48 2e6s n LYS 22 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 2e6s s LYS 23 N 7.77 3.43 0.05 1.97 2.20 -1.26 -4.71 119.74 129.19 2e6s s LYS 23 Ca 1.07 2.11 0.00 0.00 -0.36 0.00 0.00 55.97 58.79 2e6s s LYS 23 Cb -0.51 -2.37 -0.03 0.00 -1.51 0.00 0.00 37.83 33.41 2e6s s LYS 23 CO 0.36 -0.92 -0.04 0.00 -0.36 0.00 0.00 175.35 174.38 2e6s n HIS 25 N 0.78 0.41 -0.07 0.00 8.25 -1.26 -3.88 115.22 119.44 2e6s n HIS 25 Ca -0.18 0.14 -0.09 0.00 -0.26 0.00 0.00 57.72 57.33 2e6s n HIS 25 Cb 0.58 -0.97 -0.05 0.00 1.12 0.00 0.00 29.99 30.67 2e6s n HIS 25 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 2e6s h SER 26 N 0.00 0.00 -0.37 0.41 0.87 -1.94 -3.02 113.55 109.50 2e6s h SER 26 Ca -0.31 -0.27 0.11 0.00 -1.23 0.00 0.00 61.79 60.09 2e6s h SER 26 Cb 1.83 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.77 2e6s h SER 26 CO 0.04 0.91 0.35 0.00 -0.53 0.00 0.00 176.83 177.59 2e6s n SER 28 N -3.94 1.28 -4.65 0.00 3.41 -1.25 -4.46 113.62 104.00 2e6s n SER 28 Ca 0.06 -1.00 -0.49 0.00 -0.26 0.00 0.00 58.87 57.18 2e6s n SER 28 Cb 0.52 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.42 2e6s n SER 28 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2e6s n ARG 30 N 3.95 0.58 0.00 0.00 0.63 -1.14 -2.76 116.66 117.92 2e6s n ARG 30 Ca 0.19 -0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.12 2e6s n ARG 30 Cb 0.25 -1.69 0.00 0.00 0.45 0.00 0.00 32.46 31.46 2e6s n ARG 30 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 2e6s n VAL 31 N -2.44 0.00 0.14 5.15 0.31 -1.26 -4.23 118.33 116.00 2e6s n VAL 31 Ca -0.01 0.83 0.02 0.00 -0.01 0.00 0.00 64.34 65.17 2e6s n VAL 31 Cb 0.54 -1.66 0.03 0.00 -0.91 0.00 0.00 33.84 31.85 2e6s n VAL 31 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2e6s n GLY 33 N 1.17 0.91 3.84 0.00 0.00 -1.11 -5.07 105.19 104.93 2e6s n GLY 33 Ca 0.02 -0.57 -0.31 0.00 0.00 0.00 0.00 46.02 45.16 2e6s n GLY 33 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2e6s s GLY 34 N -2.77 2.09 -0.35 -0.02 0.00 -1.22 -4.94 107.32 100.12 2e6s s GLY 34 Ca 0.00 -0.94 0.08 0.00 0.00 0.00 0.00 44.72 43.86 2e6s s GLY 34 CO 0.00 -0.92 1.14 1.17 0.00 0.00 0.00 173.10 174.49 2e6s n LYS 35 N 0.39 3.34 -4.44 2.90 4.81 -1.26 -2.11 118.16 121.79 2e6s n LYS 35 Ca -0.07 -4.23 -0.21 0.00 -0.87 0.00 0.00 58.31 52.92 2e6s n LYS 35 Cb 0.51 -2.19 -0.10 0.00 0.02 0.00 0.00 35.03 33.27 2e6s n LYS 35 CO 0.00 0.00 0.00 -3.38 1.17 0.00 0.00 177.40 175.19 2e6s s HIS 36 N -3.57 1.83 -0.93 5.64 -3.43 -1.26 -4.91 115.29 108.66 2e6s s HIS 36 Ca 0.48 -1.08 -0.07 0.00 -0.80 0.00 0.00 55.06 53.58 2e6s s HIS 36 Cb 0.40 -1.17 -0.02 0.00 -1.43 0.00 0.00 32.58 30.36 2e6s s HIS 36 CO -0.06 -0.14 0.76 0.39 -2.00 0.00 0.00 174.74 173.70 2e6s n GLU 37 N -0.70 -1.53 0.19 -0.38 1.02 -1.26 -4.87 120.64 113.11 2e6s n GLU 37 Ca -0.03 0.96 0.14 0.00 -0.02 0.00 0.00 57.16 58.22 2e6s n GLU 37 Cb 0.66 -4.83 0.59 0.00 -0.02 0.00 0.00 31.44 27.83 2e6s n GLU 37 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 2e6s h PRO 38 N -0.66 0.00 0.00 3.49 0.13 -1.97 -2.75 132.00 130.25 2e6s h PRO 38 Ca -0.41 0.00 -0.20 0.00 -0.87 0.00 0.00 66.00 64.52 2e6s h PRO 38 Cb 1.23 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.33 2e6s h PRO 38 CO 0.39 0.00 -0.94 -2.95 -0.23 0.00 0.00 178.00 174.27 2e6s h ASN 39 N 0.00 0.00 -0.85 1.44 -1.07 -2.04 -3.23 115.58 109.84 2e6s h ASN 39 Ca 0.00 0.00 -0.34 0.00 0.07 0.00 0.00 56.30 56.03 2e6s h ASN 39 Cb 0.41 0.00 -0.20 0.00 -2.07 0.00 0.00 38.32 36.46 2e6s h ASN 39 CO 0.00 0.94 0.43 0.23 0.07 0.00 0.00 177.43 179.10 2e6s n MET 40 N -3.34 3.18 -4.12 4.14 2.81 -1.04 -4.92 117.12 113.84 2e6s n MET 40 Ca 0.00 -3.05 -0.34 0.00 -1.81 0.00 0.00 57.70 52.50 2e6s n MET 40 Cb 0.92 -2.21 -0.10 0.00 -0.71 0.00 0.00 33.22 31.11 2e6s n MET 40 CO 0.00 0.00 0.00 -0.65 1.51 0.00 0.00 175.97 176.83 2e6s s GLN 41 N -3.10 3.89 -0.25 0.03 -0.21 -1.22 -3.26 119.66 115.54 2e6s s GLN 41 Ca 0.56 -0.39 -0.11 0.00 0.02 0.00 0.00 55.36 55.44 2e6s s GLN 41 Cb 0.46 -3.13 -0.05 0.00 1.00 0.00 0.00 33.01 31.29 2e6s s GLN 41 CO 0.13 0.26 0.18 -0.51 -2.12 0.00 0.00 175.29 173.23 2e6s s LEU 42 N 0.37 4.09 0.01 2.90 1.43 0.62 -4.84 118.68 123.27 2e6s s LEU 42 Ca 0.01 0.10 -0.11 0.00 -1.03 0.00 0.00 54.13 53.10 2e6s s LEU 42 Cb -0.13 -2.13 -0.05 0.00 0.03 0.00 0.00 46.19 43.90 2e6s s LEU 42 CO 0.01 0.03 0.35 -0.22 0.23 0.00 0.00 176.35 176.74 2e6s s LEU 43 N 1.26 4.41 0.23 1.79 1.98 -1.26 -1.02 118.68 126.07 2e6s s LEU 43 Ca 0.08 0.79 -0.20 0.00 -2.89 0.00 0.00 54.13 51.91 2e6s s LEU 43 Cb -0.14 -2.64 -0.08 0.00 0.66 0.00 0.00 46.19 43.99 2e6s s LEU 43 CO 0.06 0.28 0.73 0.00 -1.89 0.00 0.00 176.35 175.54 2e6s n ASP 45 N 0.69 3.83 0.11 0.00 2.03 -1.25 -2.79 116.55 119.17 2e6s n ASP 45 Ca -0.02 -3.18 0.00 0.00 0.52 0.00 0.00 54.79 52.11 2e6s n ASP 45 Cb 0.51 -0.75 0.00 0.00 -0.72 0.00 0.00 41.12 40.16 2e6s n ASP 45 CO 0.00 0.00 0.00 1.21 -1.92 0.00 0.00 177.20 176.49 2e6s n GLU 46 N -0.56 0.00 -0.00 -0.67 4.07 -1.26 -4.90 120.64 117.31 2e6s n GLU 46 Ca 0.43 0.00 0.09 0.00 -0.06 0.00 0.00 57.16 57.62 2e6s n GLU 46 Cb 1.36 -0.04 -0.12 0.00 -0.06 0.00 0.00 31.44 32.58 2e6s n GLU 46 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2e6s n ASN 48 N -1.68 -6.26 -4.24 0.00 3.02 -1.12 -4.99 115.26 99.99 2e6s n ASN 48 Ca 0.01 -0.34 -0.29 0.00 -0.03 0.00 0.00 54.58 53.93 2e6s n ASN 48 Cb 0.37 -4.45 -0.16 0.00 -0.61 0.00 0.00 39.78 34.92 2e6s n ASN 48 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2e6s s VAL 49 N -3.17 1.82 -0.19 2.41 0.11 -1.26 -4.80 120.40 115.32 2e6s s VAL 49 Ca 0.20 -0.96 -0.19 0.00 -2.93 0.00 0.00 61.98 58.11 2e6s s VAL 49 Cb -0.03 -1.53 -0.03 0.00 -1.53 0.00 0.00 36.38 33.26 2e6s s VAL 49 CO 0.61 0.51 0.54 0.00 -3.33 0.00 0.00 175.10 173.44 2e6s s ALA 50 N -0.29 3.53 -0.02 1.54 0.00 -1.18 -2.01 121.76 123.34 2e6s s ALA 50 Ca 0.02 -0.34 0.03 0.00 0.00 0.00 0.00 51.96 51.66 2e6s s ALA 50 Cb -0.11 -2.84 -0.00 0.00 0.00 0.00 0.00 23.12 20.17 2e6s s ALA 50 CO 0.01 -0.42 -0.09 0.71 0.00 0.00 0.00 175.76 175.97 2e6s s TYR 51 N 1.60 0.94 0.82 0.00 2.02 -0.19 -2.54 117.35 120.00 2e6s s TYR 51 Ca 0.26 -0.22 -0.11 0.00 -0.37 0.00 0.00 57.07 56.63 2e6s s TYR 51 Cb -0.16 -0.65 0.09 0.00 -0.40 0.00 0.00 41.96 40.84 2e6s s TYR 51 CO 0.10 -0.07 1.10 -1.01 -1.57 0.00 0.00 175.55 174.09 2e6s s HIS 52 N 0.07 2.39 -0.74 2.71 3.76 -1.26 -0.27 115.29 121.94 2e6s s HIS 52 Ca -0.01 1.52 0.26 0.00 -0.15 0.00 0.00 55.06 56.68 2e6s s HIS 52 Cb -0.07 -3.11 0.80 0.00 1.11 0.00 0.00 32.58 31.31 2e6s s HIS 52 CO 0.00 -2.07 1.75 0.44 -0.85 0.00 0.00 174.74 174.01 2e6s n ILE 53 N -3.71 0.55 -1.32 0.60 -5.35 -1.20 -3.34 119.36 105.59 2e6s n ILE 53 Ca 0.09 -0.27 0.03 0.00 -0.27 0.00 0.00 62.75 62.33 2e6s n ILE 53 Cb 0.53 -0.55 0.20 0.00 -1.74 0.00 0.00 39.64 38.09 2e6s n ILE 53 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2e6s n TYR 54 N -2.21 0.63 -1.87 4.28 0.18 -1.26 -0.05 117.16 116.86 2e6s n TYR 54 Ca 0.05 -1.33 0.02 0.00 1.88 0.00 0.00 57.90 58.53 2e6s n TYR 54 Cb 0.43 -0.34 0.03 0.00 -0.38 0.00 0.00 39.34 39.07 2e6s n TYR 54 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 2e6s n LEU 56 N -0.22 0.00 -3.37 0.00 4.77 -1.26 -4.81 117.00 112.11 2e6s n LEU 56 Ca 0.03 -1.70 -0.16 0.00 -0.03 0.00 0.00 56.01 54.15 2e6s n LEU 56 Cb 0.72 -0.54 -0.08 0.00 -2.33 0.00 0.00 43.42 41.19 2e6s n LEU 56 CO -0.00 -0.92 -0.15 0.21 -1.33 0.00 0.00 177.39 175.20 2e6s s ASN 57 N -4.36 1.29 0.98 -1.43 3.84 -1.26 -2.79 114.94 111.22 2e6s s ASN 57 Ca 0.55 -1.07 -0.12 0.00 0.21 0.00 0.00 52.86 52.42 2e6s s ASN 57 Cb -0.03 0.61 0.18 0.00 -0.55 0.00 0.00 41.25 41.46 2e6s s ASN 57 CO 0.36 -0.33 1.09 -2.16 -2.79 0.00 0.00 177.10 173.28 2e6s s PRO 58 N 1.98 0.55 0.78 0.43 0.04 -1.26 -4.97 135.00 132.54 2e6s s PRO 58 Ca 0.13 0.56 -0.13 0.00 0.04 0.00 0.00 61.00 61.60 2e6s s PRO 58 Cb -0.14 -1.75 0.19 0.00 0.04 0.00 0.00 34.50 32.84 2e6s s PRO 58 CO -0.20 -2.66 0.69 -0.35 0.04 0.00 0.00 177.00 174.52 2e6s n PRO 59 N -4.13 -2.37 -3.81 0.56 -0.04 -1.12 -4.99 135.00 119.08 2e6s n PRO 59 Ca 0.05 -1.10 -0.24 0.00 -0.04 0.00 0.00 63.50 62.17 2e6s n PRO 59 Cb 0.57 -1.04 -0.17 0.00 -0.04 0.00 0.00 33.50 32.82 2e6s n PRO 59 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2e6s s LEU 60 N 0.00 0.79 0.56 1.53 1.43 0.93 -4.87 118.68 119.05 2e6s s LEU 60 Ca 0.45 -0.17 0.28 0.00 -1.03 0.00 0.00 54.13 53.66 2e6s s LEU 60 Cb -0.04 -0.57 1.47 0.00 0.03 0.00 0.00 46.19 47.07 2e6s s LEU 60 CO 0.34 -0.17 1.96 0.44 0.23 0.00 0.00 176.35 179.16 2e6s h ASP 61 N 8.28 0.00 -0.96 2.29 5.19 -1.98 -3.37 116.42 125.87 2e6s h ASP 61 Ca -0.23 0.00 0.01 0.00 -0.62 0.00 0.00 57.03 56.19 2e6s h ASP 61 Cb 1.13 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 40.63 2e6s h ASP 61 CO 0.31 0.00 0.05 2.29 -3.12 0.00 0.00 179.24 178.77 2e6s n LYS 62 N -4.08 0.09 -2.77 3.56 2.85 -1.26 -5.04 118.16 111.52 2e6s n LYS 62 Ca 0.09 -0.19 -0.41 0.00 -1.05 0.00 0.00 58.31 56.76 2e6s n LYS 62 Cb 0.64 0.25 -0.04 0.00 -0.65 0.00 0.00 35.03 35.22 2e6s n LYS 62 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 177.40 177.43 2e6s s VAL 63 N -2.68 4.56 1.14 0.58 1.01 -1.26 -4.93 120.40 118.82 2e6s s VAL 63 Ca 0.02 2.00 -0.17 0.00 0.00 0.00 0.00 61.98 63.84 2e6s s VAL 63 Cb -0.00 -4.29 0.26 0.00 0.00 0.00 0.00 36.38 32.34 2e6s s VAL 63 CO 0.01 0.31 1.10 -2.16 0.00 0.00 0.00 175.10 174.37 2e6s s PRO 64 N 0.06 -0.71 0.00 2.72 0.04 -1.26 -5.02 135.00 130.82 2e6s s PRO 64 Ca 0.46 0.11 0.05 0.00 0.04 0.00 0.00 61.00 61.67 2e6s s PRO 64 Cb -0.23 -1.64 0.09 0.00 0.04 0.00 0.00 34.50 32.76 2e6s s PRO 64 CO 0.29 -3.41 0.90 0.39 0.04 0.00 0.00 177.00 175.20 2e6s n GLU 65 N -4.58 0.00 -0.15 4.56 1.02 -1.26 -5.13 120.64 115.10 2e6s n GLU 65 Ca 0.10 -0.93 0.00 0.00 -0.02 0.00 0.00 57.16 56.31 2e6s n GLU 65 Cb 0.59 0.11 0.00 0.00 -0.02 0.00 0.00 31.44 32.11 2e6s n GLU 65 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2e6s n GLU 66 N 0.10 0.17 0.06 3.49 1.02 -1.26 -4.98 120.64 119.25 2e6s n GLU 66 Ca -0.09 0.00 -0.13 0.00 -0.02 0.00 0.00 57.16 56.92 2e6s n GLU 66 Cb 0.74 0.00 -0.06 0.00 -0.02 0.00 0.00 31.44 32.09 2e6s n GLU 66 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 2e6s h GLU 67 N 0.00 -0.53 -3.81 3.49 5.08 -2.08 -3.45 114.58 113.28 2e6s h GLU 67 Ca 0.00 0.04 -0.09 0.00 -1.00 0.00 0.00 59.36 58.31 2e6s h GLU 67 Cb 0.00 0.12 -0.11 0.00 0.50 0.00 0.00 28.75 29.26 2e6s h GLU 67 CO 0.00 -0.35 -0.22 1.52 -1.00 0.00 0.00 179.01 178.96 2e6s s TYR 68 N -5.93 0.46 -0.08 4.33 -0.85 -1.26 -5.16 117.35 108.85 2e6s s TYR 68 Ca -0.16 -0.80 0.01 0.00 -0.52 0.00 0.00 57.07 55.60 2e6s s TYR 68 Cb 0.09 0.05 0.02 0.00 0.38 0.00 0.00 41.96 42.49 2e6s s TYR 68 CO 0.64 -0.89 -0.09 -0.46 -1.52 0.00 0.00 175.55 173.23 2e6s s TRP 69 N -4.02 1.33 -0.11 -3.49 -0.00 -1.26 -5.03 118.94 106.35 2e6s s TRP 69 Ca 0.23 -0.56 0.03 0.00 -0.00 0.00 0.00 56.10 55.81 2e6s s TRP 69 Cb 0.01 -1.07 -0.00 0.00 -0.00 0.00 0.00 33.47 32.41 2e6s s TRP 69 CO 0.07 -0.37 -0.22 0.71 -0.00 0.00 0.00 176.95 177.15 2e6s s TYR 70 N 1.20 2.62 0.78 5.86 1.51 -1.26 -3.76 117.35 124.30 2e6s s TYR 70 Ca -0.05 -1.00 -0.15 0.00 -1.01 0.00 0.00 57.07 54.85 2e6s s TYR 70 Cb -0.14 -1.75 -0.02 0.00 -0.11 0.00 0.00 41.96 39.94 2e6s s TYR 70 CO -0.02 -0.40 0.48 0.00 -1.11 0.00 0.00 175.55 174.50 2e6s n PRO 72 N -0.90 0.06 0.08 0.00 -0.04 -1.26 -2.08 135.00 130.86 2e6s n PRO 72 Ca 0.09 0.22 0.12 0.00 -0.04 0.00 0.00 63.50 63.89 2e6s n PRO 72 Cb 0.51 -1.50 0.13 0.00 -0.04 0.00 0.00 33.50 32.60 2e6s n PRO 72 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 2e6s h SER 73 N 0.00 0.00 0.00 3.54 0.02 -1.98 -3.39 113.55 111.74 2e6s h SER 73 Ca 0.00 -0.15 -0.30 0.00 -0.84 0.00 0.00 61.79 60.50 2e6s h SER 73 Cb 0.21 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 62.71 2e6s h SER 73 CO 0.00 0.08 -1.95 0.00 -1.14 0.00 0.00 176.83 173.81 2e6s n LYS 75 N -4.09 1.06 -1.04 0.00 4.81 -0.89 -4.78 118.16 113.23 2e6s n LYS 75 Ca -0.38 0.27 0.04 0.00 -0.87 0.00 0.00 58.31 57.37 2e6s n LYS 75 Cb 0.73 -2.51 0.13 0.00 0.02 0.00 0.00 35.03 33.40 2e6s n LYS 75 CO 0.00 0.00 0.00 0.25 1.17 0.00 0.00 177.40 178.82 2e6s n THR 76 N 7.30 1.37 -0.42 3.15 -2.24 -1.26 -4.92 114.28 117.26 2e6s n THR 76 Ca 0.42 -2.43 0.00 0.00 -2.27 0.00 0.00 64.05 59.77 2e6s n THR 76 Cb 0.25 0.23 0.00 0.00 -2.10 0.00 0.00 70.33 68.71 2e6s n THR 76 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97