#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d9t s SER 2 N 0.00 0.47 0.18 1.61 0.15 -1.26 -5.16 113.70 109.69 2d9t s SER 2 Ca 0.00 -0.05 -0.01 0.00 0.70 0.00 0.00 55.95 56.59 2d9t s SER 2 Cb 0.00 -0.18 -0.04 0.00 -1.71 0.00 0.00 66.02 64.09 2d9t s SER 2 CO 0.00 -0.04 0.09 -0.55 1.20 0.00 0.00 173.24 173.94 2d9t s SER 3 N 0.58 0.35 0.00 5.45 0.15 -1.26 -5.13 113.70 113.84 2d9t s SER 3 Ca -0.06 -1.31 0.00 0.00 0.70 0.00 0.00 55.95 55.28 2d9t s SER 3 Cb -0.09 0.32 0.00 0.00 -1.71 0.00 0.00 66.02 64.53 2d9t s SER 3 CO -0.01 -0.77 0.00 0.61 1.20 0.00 0.00 173.24 174.27 2d9t n GLY 4 N -0.22 -1.03 3.45 9.45 0.00 -1.26 -5.08 105.19 110.49 2d9t n GLY 4 Ca -0.01 -1.23 -0.44 0.00 0.00 0.00 0.00 46.02 44.34 2d9t n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2d9t s SER 5 N -4.00 6.18 -0.22 1.61 0.15 -1.26 -5.02 113.70 111.14 2d9t s SER 5 Ca 0.00 -0.93 -0.19 0.00 0.70 0.00 0.00 55.95 55.52 2d9t s SER 5 Cb 0.00 -2.22 0.06 0.00 -1.71 0.00 0.00 66.02 62.15 2d9t s SER 5 CO 0.00 -0.66 0.59 -0.55 1.20 0.00 0.00 173.24 173.82 2d9t s SER 6 N 2.21 -0.64 1.53 5.45 0.15 -1.26 -5.09 113.70 116.05 2d9t s SER 6 Ca 0.10 1.19 0.00 0.00 0.70 0.00 0.00 55.95 57.94 2d9t s SER 6 Cb -0.20 1.19 0.00 0.00 -1.71 0.00 0.00 66.02 65.30 2d9t s SER 6 CO 0.11 -0.21 0.00 0.61 1.20 0.00 0.00 173.24 174.95 2d9t n GLY 7 N 3.00 3.07 2.65 9.45 0.00 -1.26 -4.29 105.19 117.81 2d9t n GLY 7 Ca -0.15 0.28 -0.24 0.00 0.00 0.00 0.00 46.02 45.92 2d9t n GLY 7 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2d9t s LYS 8 N 0.00 0.06 -0.11 1.61 2.47 -1.26 -5.13 119.74 117.38 2d9t s LYS 8 Ca 0.00 0.10 -0.17 0.00 -1.56 0.00 0.00 55.97 54.33 2d9t s LYS 8 Cb 0.00 -1.27 -0.04 0.00 -1.46 0.00 0.00 37.83 35.06 2d9t s LYS 8 CO 0.00 -0.51 0.45 0.54 0.16 0.00 0.00 175.35 175.99 2d9t s VAL 9 N 2.13 5.18 0.55 4.02 0.11 -1.26 -5.08 120.40 126.05 2d9t s VAL 9 Ca 0.03 0.90 -0.00 0.00 -2.93 0.00 0.00 61.98 59.98 2d9t s VAL 9 Cb -0.14 -3.79 0.03 0.00 -1.53 0.00 0.00 36.38 30.95 2d9t s VAL 9 CO -0.06 0.36 0.79 0.26 -3.33 0.00 0.00 175.10 173.11 2d9t s TRP 10 N 0.45 2.96 0.03 1.54 0.52 -1.26 -5.12 118.94 118.06 2d9t s TRP 10 Ca 0.25 0.12 -0.17 0.00 0.02 0.00 0.00 56.10 56.32 2d9t s TRP 10 Cb -0.15 -2.71 0.03 0.00 -1.15 0.00 0.00 33.47 29.49 2d9t s TRP 10 CO 0.10 -0.82 0.37 -1.59 0.02 0.00 0.00 176.95 175.03 2d9t s LYS 11 N -4.78 0.85 -0.44 4.98 -2.85 -1.26 -5.03 119.74 111.20 2d9t s LYS 11 Ca 0.56 -0.35 -0.28 0.00 -1.00 0.00 0.00 55.97 54.89 2d9t s LYS 11 Cb -0.10 0.38 -0.01 0.00 -2.06 0.00 0.00 37.83 36.03 2d9t s LYS 11 CO 0.39 -0.28 1.76 -1.25 0.10 0.00 0.00 175.35 176.07 2d9t s PRO 12 N -2.26 3.13 0.00 1.78 0.04 -1.26 -3.07 135.00 133.35 2d9t s PRO 12 Ca -0.07 1.06 0.00 0.00 0.04 0.00 0.00 61.00 62.03 2d9t s PRO 12 Cb -0.02 -4.24 0.00 0.00 0.04 0.00 0.00 34.50 30.29 2d9t s PRO 12 CO -0.01 -2.12 0.00 0.41 0.04 0.00 0.00 177.00 175.32 2d9t n GLY 13 N 5.46 1.89 3.11 0.56 0.00 -0.60 -5.01 105.19 110.60 2d9t n GLY 13 Ca 0.21 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.91 2d9t n GLY 13 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2d9t s ASP 14 N -1.89 3.04 0.07 1.61 1.11 -1.18 -4.97 116.67 114.47 2d9t s ASP 14 Ca 0.00 -0.61 -0.31 0.00 0.18 0.00 0.00 52.55 51.81 2d9t s ASP 14 Cb 0.00 -1.41 -0.08 0.00 1.07 0.00 0.00 42.92 42.50 2d9t s ASP 14 CO 0.00 0.01 1.50 -1.83 1.18 0.00 0.00 175.17 176.03 2d9t s GLU 15 N 1.21 4.26 0.19 8.23 -1.05 -1.26 -1.26 118.70 129.02 2d9t s GLU 15 Ca 0.02 2.17 -0.11 0.00 -0.15 0.00 0.00 54.97 56.90 2d9t s GLU 15 Cb -0.14 -3.44 -0.00 0.00 -0.44 0.00 0.00 34.13 30.11 2d9t s GLU 15 CO -0.10 -0.59 0.36 0.00 0.95 0.00 0.00 175.26 175.87 2d9t s PHE 17 N -3.98 3.22 -0.22 0.00 0.40 -0.14 -0.50 117.98 116.77 2d9t s PHE 17 Ca 0.18 -0.16 -0.04 0.00 -0.60 0.00 0.00 56.93 56.32 2d9t s PHE 17 Cb 0.02 -2.53 -0.01 0.00 0.51 0.00 0.00 43.02 41.01 2d9t s PHE 17 CO 0.02 -0.38 -0.04 0.00 0.70 0.00 0.00 175.22 175.52 2d9t s ALA 18 N 1.81 2.82 0.24 5.36 0.00 -1.14 -1.79 121.76 129.06 2d9t s ALA 18 Ca 0.08 -1.16 -0.31 0.00 0.00 0.00 0.00 51.96 50.56 2d9t s ALA 18 Cb -0.17 -1.71 -0.13 0.00 0.00 0.00 0.00 23.12 21.11 2d9t s ALA 18 CO 0.11 -0.42 1.47 -0.11 0.00 0.00 0.00 175.76 176.81 2d9t n LEU 19 N 4.78 3.35 -4.65 0.00 7.94 -1.19 -3.79 117.00 123.44 2d9t n LEU 19 Ca -0.18 1.13 -0.29 0.00 -1.11 0.00 0.00 56.01 55.57 2d9t n LEU 19 Cb 0.51 -1.46 0.19 0.00 0.53 0.00 0.00 43.42 43.19 2d9t n LEU 19 CO 0.29 -0.33 0.62 -0.47 -1.11 0.00 0.00 177.39 176.39 2d9t s TYR 20 N 0.11 1.98 -1.56 1.96 5.04 -0.55 -4.87 117.35 119.47 2d9t s TYR 20 Ca 0.69 1.00 0.13 0.00 -2.44 0.00 0.00 57.07 56.45 2d9t s TYR 20 Cb -0.62 -3.24 0.15 0.00 0.35 0.00 0.00 41.96 38.59 2d9t s TYR 20 CO 0.47 -3.07 0.98 -2.67 -1.34 0.00 0.00 175.55 169.93 2d9t n TRP 21 N -4.30 0.09 -0.00 4.97 4.27 -1.26 -3.11 117.44 118.10 2d9t n TRP 21 Ca 0.05 -0.08 0.00 0.00 -3.89 0.00 0.00 57.50 53.58 2d9t n TRP 21 Cb 0.57 -0.00 0.00 0.00 -1.36 0.00 0.00 31.31 30.52 2d9t n TRP 21 CO 0.00 0.00 0.00 0.39 -2.29 0.00 0.00 177.69 175.79 2d9t n GLU 22 N 0.74 5.84 0.00 -2.67 -0.58 -1.26 -4.81 120.64 117.89 2d9t n GLU 22 Ca 0.09 -0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.83 2d9t n GLU 22 Cb 0.35 -0.42 0.00 0.00 -0.57 0.00 0.00 31.44 30.80 2d9t n GLU 22 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 2d9t n ASP 23 N -0.83 2.28 -0.55 1.62 -0.08 -1.26 -5.04 116.55 112.69 2d9t n ASP 23 Ca 0.00 0.00 -0.05 0.00 -1.51 0.00 0.00 54.79 53.23 2d9t n ASP 23 Cb 0.00 0.16 -0.01 0.00 2.34 0.00 0.00 41.12 43.61 2d9t n ASP 23 CO 0.00 0.00 0.00 0.59 0.12 0.00 0.00 177.20 177.91 2d9t n ASN 24 N -1.49 -2.61 -4.61 1.67 4.13 -1.18 -4.96 115.26 106.21 2d9t n ASN 24 Ca 0.00 0.03 -0.27 0.00 1.68 0.00 0.00 54.58 56.02 2d9t n ASN 24 Cb 0.24 -1.62 -0.09 0.00 -1.54 0.00 0.00 39.78 36.78 2d9t n ASN 24 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 2d9t s LYS 25 N -3.79 2.20 -0.22 3.52 -0.14 -1.26 -4.73 119.74 115.32 2d9t s LYS 25 Ca 0.00 -1.18 -0.28 0.00 -1.36 0.00 0.00 55.97 53.15 2d9t s LYS 25 Cb 0.00 -2.25 0.01 0.00 -1.68 0.00 0.00 37.83 33.90 2d9t s LYS 25 CO 0.00 0.45 1.01 -0.06 -0.76 0.00 0.00 175.35 175.99 2d9t s PHE 26 N -1.66 3.36 0.03 3.18 0.08 -1.26 -1.48 117.98 120.23 2d9t s PHE 26 Ca 0.25 1.44 0.04 0.00 0.12 0.00 0.00 56.93 58.79 2d9t s PHE 26 Cb -0.09 -3.23 -0.02 0.00 -0.57 0.00 0.00 43.02 39.11 2d9t s PHE 26 CO 0.16 -0.44 -0.13 0.71 -0.10 0.00 0.00 175.22 175.42 2d9t s TYR 27 N 3.01 1.15 0.44 0.36 2.02 -1.25 -4.96 117.35 118.12 2d9t s TYR 27 Ca 0.43 -0.32 -0.21 0.00 -0.37 0.00 0.00 57.07 56.61 2d9t s TYR 27 Cb -0.15 -0.70 -0.14 0.00 -0.40 0.00 0.00 41.96 40.57 2d9t s TYR 27 CO 0.08 0.02 0.20 0.54 -1.57 0.00 0.00 175.55 174.81 2d9t n ARG 28 N 2.10 0.17 -3.19 -0.62 1.74 -1.26 -2.88 116.66 112.72 2d9t n ARG 28 Ca -0.17 0.06 -0.00 0.00 -0.77 0.00 0.00 57.85 56.97 2d9t n ARG 28 Cb 0.55 -1.18 0.01 0.00 -1.02 0.00 0.00 32.46 30.82 2d9t n ARG 28 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2d9t n ALA 29 N -1.13 -2.10 -3.61 7.54 0.00 0.35 -1.22 120.51 120.35 2d9t n ALA 29 Ca 0.11 -0.64 -0.05 0.00 0.00 0.00 0.00 53.44 52.86 2d9t n ALA 29 Cb 0.42 0.28 -0.07 0.00 0.00 0.00 0.00 19.45 20.08 2d9t n ALA 29 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 2d9t s GLU 30 N -2.02 0.44 -0.38 0.00 2.12 0.14 0.23 118.70 119.22 2d9t s GLU 30 Ca 0.18 1.17 -0.43 0.00 0.36 0.00 0.00 54.97 56.25 2d9t s GLU 30 Cb -0.01 0.51 -0.17 0.00 0.26 0.00 0.00 34.13 34.72 2d9t s GLU 30 CO 0.02 -0.28 1.72 0.28 -0.54 0.00 0.00 175.26 176.47 2d9t n VAL 31 N 5.42 0.18 -0.10 3.70 0.31 -0.39 -2.27 118.33 125.18 2d9t n VAL 31 Ca -0.09 -0.04 -0.17 0.00 -0.01 0.00 0.00 64.34 64.03 2d9t n VAL 31 Cb 0.49 -0.93 -0.09 0.00 -0.91 0.00 0.00 33.84 32.40 2d9t n VAL 31 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 2d9t n GLU 32 N 5.04 0.53 -3.64 5.55 0.00 0.15 -1.56 120.64 126.71 2d9t n GLU 32 Ca 0.30 0.56 -0.09 0.00 0.00 0.00 0.00 57.16 57.93 2d9t n GLU 32 Cb 0.05 -1.73 -0.07 0.00 0.00 0.00 0.00 31.44 29.69 2d9t n GLU 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2d9t s ALA 33 N -2.47 -1.80 0.60 4.31 0.00 -0.29 -4.66 121.76 117.46 2d9t s ALA 33 Ca -0.25 2.26 -0.08 0.00 0.00 0.00 0.00 51.96 53.89 2d9t s ALA 33 Cb 0.05 -1.32 -0.01 0.00 0.00 0.00 0.00 23.12 21.84 2d9t s ALA 33 CO 0.49 -0.36 0.95 -0.51 0.00 0.00 0.00 175.76 176.32 2d9t s LEU 34 N 1.26 3.23 0.61 0.00 1.43 -1.26 -0.34 118.68 123.62 2d9t s LEU 34 Ca -0.07 0.96 0.00 0.00 -1.03 0.00 0.00 54.13 53.99 2d9t s LEU 34 Cb -0.05 -3.84 0.06 0.00 0.03 0.00 0.00 46.19 42.39 2d9t s LEU 34 CO -0.14 -1.01 0.86 -2.28 0.23 0.00 0.00 176.35 174.01 2d9t s HIS 35 N -3.06 2.48 -0.08 0.29 5.65 -1.12 -4.87 115.29 114.59 2d9t s HIS 35 Ca 0.54 -0.05 -0.04 0.00 0.25 0.00 0.00 55.06 55.75 2d9t s HIS 35 Cb -0.11 -2.86 -0.02 0.00 -1.18 0.00 0.00 32.58 28.41 2d9t s HIS 35 CO 0.48 -1.17 0.19 0.77 -0.65 0.00 0.00 174.74 174.36 2d9t h SER 36 N -0.16 -0.14 -0.50 9.88 0.02 -1.99 -3.36 113.55 117.31 2d9t h SER 36 Ca -0.40 0.00 0.10 0.00 -0.84 0.00 0.00 61.79 60.65 2d9t h SER 36 Cb 1.29 0.04 -0.10 0.00 0.14 0.00 0.00 62.40 63.77 2d9t h SER 36 CO 0.49 0.33 -0.17 0.28 -1.14 0.00 0.00 176.83 176.63 2d9t h SER 37 N -1.02 -0.59 0.00 3.07 0.02 -1.97 -3.47 113.55 109.59 2d9t h SER 37 Ca -0.02 0.16 0.00 0.00 -0.84 0.00 0.00 61.79 61.10 2d9t h SER 37 Cb 0.12 0.36 0.00 0.00 0.14 0.00 0.00 62.40 63.02 2d9t h SER 37 CO 0.03 -0.20 0.00 0.61 -1.14 0.00 0.00 176.83 176.12 2d9t n GLY 38 N -1.38 0.88 0.99 -3.77 0.00 -1.26 -5.04 105.19 95.60 2d9t n GLY 38 Ca 0.04 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.06 2d9t n GLY 38 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2d9t n MET 39 N 0.00 0.03 -4.21 1.61 2.81 -1.26 -4.99 117.12 111.11 2d9t n MET 39 Ca 0.00 0.01 -0.25 0.00 -1.81 0.00 0.00 57.70 55.65 2d9t n MET 39 Cb 0.00 -0.53 -0.08 0.00 -0.71 0.00 0.00 33.22 31.91 2d9t n MET 39 CO 0.00 0.00 0.00 0.95 1.51 0.00 0.00 175.97 178.43 2d9t s THR 40 N -1.99 2.32 -0.20 2.03 -4.23 -1.26 -1.90 115.64 110.41 2d9t s THR 40 Ca -0.02 -1.76 -0.19 0.00 -1.18 0.00 0.00 61.69 58.55 2d9t s THR 40 Cb 0.00 -2.98 0.05 0.00 1.34 0.00 0.00 72.50 70.91 2d9t s THR 40 CO 0.03 -0.02 0.54 0.00 -0.54 0.00 0.00 174.62 174.62 2d9t s ALA 41 N -2.60 -1.33 -0.29 3.99 0.00 -0.95 -2.78 121.76 117.81 2d9t s ALA 41 Ca 0.40 1.52 -0.29 0.00 0.00 0.00 0.00 51.96 53.59 2d9t s ALA 41 Cb 0.04 -0.88 -0.01 0.00 0.00 0.00 0.00 23.12 22.27 2d9t s ALA 41 CO 0.22 -0.26 1.48 0.08 0.00 0.00 0.00 175.76 177.28 2d9t s VAL 42 N 0.28 3.88 0.17 0.00 1.01 0.54 -3.37 120.40 122.91 2d9t s VAL 42 Ca -0.00 0.98 0.11 0.00 0.00 0.00 0.00 61.98 63.07 2d9t s VAL 42 Cb -0.04 -3.95 -0.04 0.00 0.00 0.00 0.00 36.38 32.35 2d9t s VAL 42 CO 0.01 -0.44 -0.24 0.68 0.00 0.00 0.00 175.10 175.11 2d9t s VAL 43 N 5.03 2.37 -0.12 2.92 -7.23 -0.90 0.32 120.40 122.79 2d9t s VAL 43 Ca 0.65 -1.90 0.02 0.00 -1.81 0.00 0.00 61.98 58.94 2d9t s VAL 43 Cb -0.20 -2.11 -0.00 0.00 0.56 0.00 0.00 36.38 34.63 2d9t s VAL 43 CO 0.28 -0.03 -0.20 -0.75 -0.31 0.00 0.00 175.10 174.08 2d9t s LYS 44 N -2.44 3.14 0.56 4.82 2.20 -0.96 -0.47 119.74 126.59 2d9t s LYS 44 Ca 0.18 -0.81 -0.18 0.00 -0.36 0.00 0.00 55.97 54.80 2d9t s LYS 44 Cb -0.09 -2.46 -0.05 0.00 -1.51 0.00 0.00 37.83 33.73 2d9t s LYS 44 CO 0.09 0.12 1.10 -0.06 -0.36 0.00 0.00 175.35 176.24 2d9t s PHE 45 N 0.53 2.75 -0.12 4.03 0.08 0.03 0.25 117.98 125.53 2d9t s PHE 45 Ca -0.12 1.55 0.22 0.00 0.12 0.00 0.00 56.93 58.70 2d9t s PHE 45 Cb -0.17 -3.20 -0.20 0.00 -0.57 0.00 0.00 43.02 38.88 2d9t s PHE 45 CO 0.04 -1.43 0.70 2.41 -0.10 0.00 0.00 175.22 176.85 2d9t n THR 46 N -1.57 0.24 -0.27 0.64 -1.04 -0.36 -2.09 114.28 109.84 2d9t n THR 46 Ca 0.11 -0.52 -0.03 0.00 -2.04 0.00 0.00 64.05 61.57 2d9t n THR 46 Cb 0.52 -0.13 0.08 0.00 -1.82 0.00 0.00 70.33 68.98 2d9t n THR 46 CO 0.00 0.00 0.00 0.44 -0.64 0.00 0.00 175.07 174.87 2d9t h ASP 47 N 0.00 0.82 0.00 8.00 3.32 -1.94 -3.39 116.42 123.23 2d9t h ASP 47 Ca 0.00 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.04 2d9t h ASP 47 Cb 1.00 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 40.36 2d9t h ASP 47 CO 0.00 0.57 -0.63 -1.22 -1.72 0.00 0.00 179.24 176.25 2d9t n TYR 48 N -4.60 0.00 0.00 4.55 4.01 -1.26 -5.07 117.16 114.79 2d9t n TYR 48 Ca 0.08 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.82 2d9t n TYR 48 Cb 0.06 0.10 0.00 0.00 -0.31 0.00 0.00 39.34 39.19 2d9t n TYR 48 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2d9t n GLY 49 N 2.59 1.33 3.70 2.72 0.00 -0.89 -5.06 105.19 109.57 2d9t n GLY 49 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 2d9t n GLY 49 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2d9t s ASN 50 N -2.00 5.18 0.33 1.61 4.22 -1.25 -4.81 114.94 118.22 2d9t s ASN 50 Ca 0.00 -0.02 -0.09 0.00 -2.14 0.00 0.00 52.86 50.61 2d9t s ASN 50 Cb 0.00 -1.35 -0.07 0.00 1.28 0.00 0.00 41.25 41.11 2d9t s ASN 50 CO 0.00 0.26 0.66 -0.31 -2.04 0.00 0.00 177.10 175.67 2d9t s TYR 51 N -1.14 3.45 -0.17 1.54 2.02 -1.26 -0.79 117.35 121.00 2d9t s TYR 51 Ca 0.21 0.92 -0.27 0.00 -0.37 0.00 0.00 57.07 57.56 2d9t s TYR 51 Cb -0.12 -2.32 0.07 0.00 -0.40 0.00 0.00 41.96 39.19 2d9t s TYR 51 CO 0.12 0.07 0.69 -1.21 -1.57 0.00 0.00 175.55 173.66 2d9t s GLU 52 N -3.44 0.93 -0.58 -0.62 0.41 0.38 -4.96 118.70 110.82 2d9t s GLU 52 Ca 0.49 0.65 -0.23 0.00 -0.41 0.00 0.00 54.97 55.47 2d9t s GLU 52 Cb -0.11 0.45 0.05 0.00 -1.78 0.00 0.00 34.13 32.75 2d9t s GLU 52 CO 0.27 -0.20 0.88 -2.00 -0.49 0.00 0.00 175.26 173.72 2d9t s GLU 53 N -0.35 3.22 0.15 1.61 2.12 -1.26 -2.13 118.70 122.06 2d9t s GLU 53 Ca -0.05 -0.58 0.11 0.00 0.36 0.00 0.00 54.97 54.81 2d9t s GLU 53 Cb -0.03 -4.12 -0.04 0.00 0.26 0.00 0.00 34.13 30.20 2d9t s GLU 53 CO 0.05 -1.53 -0.26 0.08 -0.54 0.00 0.00 175.26 173.06 2d9t s VAL 54 N 3.70 2.31 0.39 3.70 1.01 -1.22 -4.96 120.40 125.34 2d9t s VAL 54 Ca 0.25 -1.84 -0.25 0.00 0.00 0.00 0.00 61.98 60.13 2d9t s VAL 54 Cb -0.15 -2.05 -0.09 0.00 0.00 0.00 0.00 36.38 34.08 2d9t s VAL 54 CO 0.15 0.02 1.12 -0.76 0.00 0.00 0.00 175.10 175.63 2d9t s LEU 55 N -2.27 4.22 0.56 3.92 1.43 -1.26 -2.23 118.68 123.04 2d9t s LEU 55 Ca 0.16 2.23 0.27 0.00 -1.03 0.00 0.00 54.13 55.77 2d9t s LEU 55 Cb -0.09 -4.03 1.63 0.00 0.03 0.00 0.00 46.19 43.73 2d9t s LEU 55 CO 0.07 -0.55 2.18 -0.07 0.23 0.00 0.00 176.35 178.21 2d9t h LEU 56 N 2.73 0.00 0.00 1.79 3.38 -1.72 0.33 115.31 121.82 2d9t h LEU 56 Ca -0.48 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.49 2d9t h LEU 56 Cb 1.23 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.98 2d9t h LEU 56 CO 0.63 0.05 0.00 -0.24 0.09 0.00 0.00 178.44 178.97 2d9t n SER 57 N -3.83 0.00 -1.17 -0.43 2.88 -1.26 -2.95 113.62 106.85 2d9t n SER 57 Ca -0.03 0.36 0.07 0.00 -1.33 0.00 0.00 58.87 57.95 2d9t n SER 57 Cb 0.14 -0.45 0.29 0.00 -0.75 0.00 0.00 64.21 63.45 2d9t n SER 57 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 2d9t n ASN 58 N -1.45 4.32 -4.39 -3.46 3.02 0.10 -4.96 115.26 108.44 2d9t n ASN 58 Ca 0.08 -3.03 -0.32 0.00 -0.03 0.00 0.00 54.58 51.28 2d9t n ASN 58 Cb 0.30 -0.59 -0.15 0.00 -0.61 0.00 0.00 39.78 38.74 2d9t n ASN 58 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2d9t s ILE 59 N -2.84 2.55 -0.02 2.41 1.01 -1.15 -3.18 121.20 119.98 2d9t s ILE 59 Ca 0.46 -0.92 0.07 0.00 0.00 0.00 0.00 60.65 60.25 2d9t s ILE 59 Cb 0.37 -1.95 -0.02 0.00 0.01 0.00 0.00 42.46 40.87 2d9t s ILE 59 CO 0.10 0.59 -0.21 -0.54 0.00 0.00 0.00 174.94 174.88 2d9t s LYS 60 N -0.66 1.71 0.14 2.79 -0.14 -0.74 -4.94 119.74 117.90 2d9t s LYS 60 Ca 0.10 -0.76 -0.31 0.00 -1.36 0.00 0.00 55.97 53.65 2d9t s LYS 60 Cb -0.10 -1.66 -0.08 0.00 -1.68 0.00 0.00 37.83 34.31 2d9t s LYS 60 CO -0.00 0.46 1.34 -1.25 -0.76 0.00 0.00 175.35 175.14 2d9t s PRO 61 N -0.50 4.35 0.14 -1.68 0.04 -1.26 -0.97 135.00 135.13 2d9t s PRO 61 Ca 0.08 2.04 -0.30 0.00 0.04 0.00 0.00 61.00 62.86 2d9t s PRO 61 Cb -0.08 -3.24 -0.07 0.00 0.04 0.00 0.00 34.50 31.15 2d9t s PRO 61 CO -0.01 -0.36 0.97 0.08 0.04 0.00 0.00 177.00 177.73 2d9t s VAL 62 N 0.77 4.35 -0.15 -0.36 1.01 -1.23 -4.90 120.40 119.88 2d9t s VAL 62 Ca 0.61 2.02 -0.15 0.00 0.00 0.00 0.00 61.98 64.46 2d9t s VAL 62 Cb -0.36 -4.29 -0.04 0.00 0.00 0.00 0.00 36.38 31.68 2d9t s VAL 62 CO 0.33 0.35 0.35 -1.58 0.00 0.00 0.00 175.10 174.55 2d9t s GLN 63 N -0.26 4.28 -0.06 2.72 2.00 -1.26 -5.03 119.66 122.05 2d9t s GLN 63 Ca 0.46 0.21 -0.31 0.00 -2.00 0.00 0.00 55.36 53.71 2d9t s GLN 63 Cb -0.24 -3.44 0.12 0.00 0.80 0.00 0.00 33.01 30.25 2d9t s GLN 63 CO 0.31 0.19 1.24 -0.08 -0.50 0.00 0.00 175.29 176.45 2d9t s THR 64 N 0.58 0.00 -0.29 -0.34 -1.32 -1.26 -5.05 115.64 107.95 2d9t s THR 64 Ca 0.19 -0.18 0.08 0.00 -1.21 0.00 0.00 61.69 60.58 2d9t s THR 64 Cb -0.14 -1.67 0.46 0.00 -1.51 0.00 0.00 72.50 69.65 2d9t s THR 64 CO 0.06 0.00 1.18 -1.84 -2.21 0.00 0.00 174.62 171.81 2d9t n GLU 65 N -0.36 3.49 -0.74 7.08 0.00 -1.26 -4.85 120.64 124.01 2d9t n GLU 65 Ca -0.06 -4.13 -0.07 0.00 0.00 0.00 0.00 57.16 52.90 2d9t n GLU 65 Cb 0.61 -2.23 -0.03 0.00 0.00 0.00 0.00 31.44 29.79 2d9t n GLU 65 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2d9t n ALA 66 N -0.70 4.81 -1.77 -1.84 0.00 -1.26 -4.92 120.51 114.84 2d9t n ALA 66 Ca 0.41 -0.87 -0.38 0.00 0.00 0.00 0.00 53.44 52.60 2d9t n ALA 66 Cb 0.96 -1.38 -0.05 0.00 0.00 0.00 0.00 19.45 18.97 2d9t n ALA 66 CO 0.00 0.00 0.00 1.67 0.00 0.00 0.00 177.50 179.17 2d9t s TRP 67 N -0.33 3.62 -0.16 0.00 1.48 -1.26 -5.05 118.94 117.24 2d9t s TRP 67 Ca 0.22 1.76 -0.01 0.00 -1.06 0.00 0.00 56.10 57.01 2d9t s TRP 67 Cb 0.13 -3.07 -0.01 0.00 -1.16 0.00 0.00 33.47 29.37 2d9t s TRP 67 CO -0.01 -0.12 -0.13 0.08 -4.06 0.00 0.00 176.95 172.71 2d9t s VAL 68 N -1.44 2.93 0.00 -0.66 1.01 -1.26 -5.11 120.40 115.86 2d9t s VAL 68 Ca 0.49 -0.68 0.05 0.00 0.00 0.00 0.00 61.98 61.83 2d9t s VAL 68 Cb -0.24 -2.25 -0.01 0.00 0.00 0.00 0.00 36.38 33.88 2d9t s VAL 68 CO 0.30 0.50 -0.14 -0.60 0.00 0.00 0.00 175.10 175.16 2d9t s ARG 69 N 0.74 1.11 0.44 2.72 3.52 -1.26 -5.13 118.95 121.08 2d9t s ARG 69 Ca -0.05 -0.59 -0.24 0.00 -0.13 0.00 0.00 55.73 54.71 2d9t s ARG 69 Cb -0.15 -1.09 -0.08 0.00 -1.56 0.00 0.00 34.95 32.07 2d9t s ARG 69 CO 0.01 0.29 1.24 -0.51 -0.81 0.00 0.00 175.30 175.53 2d9t s ASP 70 N -0.56 6.19 1.22 -2.12 1.01 -1.26 -5.02 116.67 116.13 2d9t s ASP 70 Ca 0.05 2.51 -0.20 0.00 0.71 0.00 0.00 52.55 55.61 2d9t s ASP 70 Cb -0.06 -2.62 0.29 0.00 1.01 0.00 0.00 42.92 41.54 2d9t s ASP 70 CO -0.00 -0.92 1.11 -2.16 0.21 0.00 0.00 175.17 173.42 2d9t s PRO 71 N -2.45 -1.36 0.06 8.23 0.04 -1.26 -4.98 135.00 133.27 2d9t s PRO 71 Ca 0.60 -0.12 -0.34 0.00 0.04 0.00 0.00 61.00 61.19 2d9t s PRO 71 Cb -0.34 -1.58 -0.19 0.00 0.04 0.00 0.00 34.50 32.42 2d9t s PRO 71 CO 0.43 -3.79 1.53 -2.95 0.04 0.00 0.00 177.00 172.25 2d9t h ASN 72 N -2.64 -0.91 -6.37 6.66 -1.07 -1.96 -3.46 115.58 105.83 2d9t h ASN 72 Ca -0.44 0.02 -0.48 0.00 0.07 0.00 0.00 56.30 55.47 2d9t h ASN 72 Cb 1.29 0.24 -0.04 0.00 -2.07 0.00 0.00 38.32 37.74 2d9t h ASN 72 CO 0.32 -0.62 -0.84 -0.24 0.07 0.00 0.00 177.43 176.12 2d9t n SER 73 N -5.54 -1.82 0.00 6.14 2.88 -1.26 -4.89 113.62 109.13 2d9t n SER 73 Ca -0.15 -0.91 0.00 0.00 -1.33 0.00 0.00 58.87 56.49 2d9t n SER 73 Cb 0.43 -3.47 0.00 0.00 -0.75 0.00 0.00 64.21 60.42 2d9t n SER 73 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2d9t n GLY 74 N -1.73 1.48 0.00 0.46 0.00 -1.26 -4.97 105.19 99.17 2d9t n GLY 74 Ca -0.19 -0.97 0.07 0.00 0.00 0.00 0.00 46.02 44.93 2d9t n GLY 74 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2d9t n PRO 75 N -0.62 0.28 -1.44 1.61 -0.04 -1.26 -4.82 135.00 128.72 2d9t n PRO 75 Ca 0.00 0.11 -0.56 0.00 -0.04 0.00 0.00 63.50 63.01 2d9t n PRO 75 Cb 0.00 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 31.87 2d9t n PRO 75 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2d9t n SER 76 N -1.21 1.69 -4.29 3.54 7.64 -1.26 -4.92 113.62 114.81 2d9t n SER 76 Ca 0.08 0.64 -0.19 0.00 1.01 0.00 0.00 58.87 60.42 2d9t n SER 76 Cb 0.10 -1.11 -0.11 0.00 -1.01 0.00 0.00 64.21 62.09 2d9t n SER 76 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2d9t s SER 77 N 6.07 2.27 0.00 6.43 0.15 -1.26 -5.05 113.70 122.32 2d9t s SER 77 Ca 1.11 -0.88 0.00 0.00 0.70 0.00 0.00 55.95 56.88 2d9t s SER 77 Cb -1.13 -0.10 0.00 0.00 -1.71 0.00 0.00 66.02 63.08 2d9t s SER 77 CO 0.59 -0.13 0.00 0.61 1.20 0.00 0.00 173.24 175.51