#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sr3 s ARG 31 N 0.00 0.20 0.32 1.96 0.52 -1.26 -5.15 118.95 115.54 1sr3 s ARG 31 Ca 0.00 0.41 -0.16 0.00 -0.52 0.00 0.00 55.73 55.46 1sr3 s ARG 31 Cb 0.00 -0.75 0.03 0.00 0.52 0.00 0.00 34.95 34.75 1sr3 s ARG 31 CO 0.00 -0.54 0.69 -1.54 0.02 0.00 0.00 175.30 173.93 1sr3 s SER 32 N 2.38 -0.01 0.49 0.23 1.04 -1.26 -5.13 113.70 111.44 1sr3 s SER 32 Ca 0.06 -0.96 0.00 0.00 0.48 0.00 0.00 55.95 55.53 1sr3 s SER 32 Cb -0.15 0.75 0.00 0.00 0.10 0.00 0.00 66.02 66.73 1sr3 s SER 32 CO -0.12 -1.45 0.00 -3.20 0.98 0.00 0.00 173.24 169.45 1sr3 n ASN 33 N -0.93 -4.35 -3.41 7.02 5.15 -1.26 -5.14 115.26 112.34 1sr3 n ASN 33 Ca -0.05 0.94 0.00 0.00 -0.60 0.00 0.00 54.58 54.87 1sr3 n ASN 33 Cb 0.60 4.02 0.00 0.00 -0.53 0.00 0.00 39.78 43.87 1sr3 n ASN 33 CO 0.00 0.00 0.00 2.30 1.40 0.00 0.00 177.26 180.96 1sr3 n ILE 34 N -3.49 0.00 -0.96 -1.44 -5.35 -1.26 -5.01 119.36 101.85 1sr3 n ILE 34 Ca 0.00 0.00 -0.35 0.00 -0.27 0.00 0.00 62.75 62.13 1sr3 n ILE 34 Cb 0.00 -0.61 0.08 0.00 -1.74 0.00 0.00 39.64 37.37 1sr3 n ILE 34 CO 0.00 0.00 0.00 -0.67 -1.76 0.00 0.00 176.55 174.12 1sr3 n ASP 35 N 0.00 -3.35 -3.36 7.28 2.03 -1.26 -5.05 116.55 112.84 1sr3 n ASP 35 Ca 0.00 0.34 -0.16 0.00 0.52 0.00 0.00 54.79 55.49 1sr3 n ASP 35 Cb 0.00 -1.04 0.10 0.00 -0.72 0.00 0.00 41.12 39.46 1sr3 n ASP 35 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1sr3 n LEU 36 N 0.62 0.00 -3.46 -2.67 -0.00 -1.26 -5.08 117.00 105.15 1sr3 n LEU 36 Ca 0.04 -1.10 -0.13 0.00 -0.00 0.00 0.00 56.01 54.83 1sr3 n LEU 36 Cb 0.53 -0.50 -0.03 0.00 -0.00 0.00 0.00 43.42 43.42 1sr3 n LEU 36 CO 0.51 -0.93 0.39 0.12 -0.00 0.00 0.00 177.39 177.48 1sr3 s PHE 37 N -2.26 -0.54 0.32 1.47 5.36 -1.26 -4.61 117.98 116.46 1sr3 s PHE 37 Ca 0.43 0.48 0.02 0.00 -0.96 0.00 0.00 56.93 56.90 1sr3 s PHE 37 Cb -0.02 0.50 -0.02 0.00 -0.34 0.00 0.00 43.02 43.14 1sr3 s PHE 37 CO 0.29 -0.78 0.34 0.71 -1.46 0.00 0.00 175.22 174.33 1sr3 s TYR 38 N -3.14 1.40 0.30 10.12 1.51 0.13 -4.94 117.35 122.72 1sr3 s TYR 38 Ca -0.02 -1.48 0.02 0.00 -1.01 0.00 0.00 57.07 54.59 1sr3 s TYR 38 Cb -0.01 -0.44 -0.05 0.00 -0.11 0.00 0.00 41.96 41.36 1sr3 s TYR 38 CO -0.07 -0.95 0.10 0.95 -1.11 0.00 0.00 175.55 174.46 1sr3 s THR 39 N -3.37 0.68 -2.00 -0.71 -4.23 -1.26 -2.45 115.64 102.29 1sr3 s THR 39 Ca 0.36 -2.00 0.01 0.00 -1.18 0.00 0.00 61.69 58.88 1sr3 s THR 39 Cb 0.02 -2.63 0.03 0.00 1.34 0.00 0.00 72.50 71.25 1sr3 s THR 39 CO 0.23 0.00 0.55 -0.81 -0.54 0.00 0.00 174.62 174.05 1sr3 n PRO 40 N -0.58 0.03 -0.36 3.99 -0.04 -1.26 -1.25 135.00 135.53 1sr3 n PRO 40 Ca -0.01 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 63.53 1sr3 n PRO 40 Cb 0.66 -1.50 0.18 0.00 -0.04 0.00 0.00 33.50 32.80 1sr3 n PRO 40 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1sr3 n GLY 41 N -0.94 5.02 0.19 0.55 0.00 -1.26 -3.21 105.19 105.54 1sr3 n GLY 41 Ca 0.01 -1.23 0.00 0.00 0.00 0.00 0.00 46.02 44.80 1sr3 n GLY 41 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1sr3 n GLU 42 N -1.26 0.00 0.29 1.61 1.02 -0.38 -4.29 120.64 117.62 1sr3 n GLU 42 Ca 0.18 0.00 0.16 0.00 -0.02 0.00 0.00 57.16 57.48 1sr3 n GLU 42 Cb 0.67 -0.63 0.87 0.00 -0.02 0.00 0.00 31.44 32.33 1sr3 n GLU 42 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 1sr3 h ILE 43 N 0.00 0.39 0.00 -3.67 2.04 -1.72 -1.47 117.51 113.08 1sr3 h ILE 43 Ca 0.00 -0.29 -0.21 0.00 1.00 0.00 0.00 64.86 65.36 1sr3 h ILE 43 Cb 0.38 1.21 -0.03 0.00 -0.74 0.00 0.00 36.82 37.63 1sr3 h ILE 43 CO 0.00 0.05 -1.59 0.00 0.00 0.00 0.00 178.15 176.61 1sr3 n LEU 44 N -3.53 1.54 -0.82 1.44 -0.00 -1.26 -4.76 117.00 109.61 1sr3 n LEU 44 Ca -0.02 0.26 0.04 0.00 -0.00 0.00 0.00 56.01 56.29 1sr3 n LEU 44 Cb 0.17 -0.61 0.15 0.00 -0.00 0.00 0.00 43.42 43.13 1sr3 n LEU 44 CO 0.27 0.10 0.57 -1.22 -0.00 0.00 0.00 177.39 177.11 1sr3 n TYR 45 N -4.03 0.64 -0.11 1.47 4.01 -1.20 -4.96 117.16 112.98 1sr3 n TYR 45 Ca -0.29 -0.26 0.00 0.00 -0.16 0.00 0.00 57.90 57.20 1sr3 n TYR 45 Cb 0.63 -0.13 0.00 0.00 -0.31 0.00 0.00 39.34 39.52 1sr3 n TYR 45 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1sr3 n GLY 46 N 0.65 -0.58 3.74 2.72 0.00 -0.56 -4.83 105.19 106.32 1sr3 n GLY 46 Ca 0.11 -1.11 -0.37 0.00 0.00 0.00 0.00 46.02 44.65 1sr3 n GLY 46 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1sr3 s LYS 47 N -3.74 2.84 0.00 1.61 2.20 -1.17 -4.41 119.74 117.07 1sr3 s LYS 47 Ca 0.00 1.99 0.00 0.00 -0.36 0.00 0.00 55.97 57.60 1sr3 s LYS 47 Cb 0.00 -1.95 0.00 0.00 -1.51 0.00 0.00 37.83 34.37 1sr3 s LYS 47 CO 0.00 -1.35 0.00 0.54 -0.36 0.00 0.00 175.35 174.18 1sr3 n ARG 48 N -1.61 0.00 0.00 4.03 1.74 -1.26 -1.45 116.66 118.11 1sr3 n ARG 48 Ca 0.14 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.22 1sr3 n ARG 48 Cb 0.48 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.92 1sr3 n ARG 48 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1sr3 n GLU 49 N -2.83 0.00 -0.55 5.56 1.02 -1.26 -5.05 120.64 117.53 1sr3 n GLU 49 Ca 0.00 0.00 -0.02 0.00 -0.02 0.00 0.00 57.16 57.12 1sr3 n GLU 49 Cb 0.00 0.00 -0.02 0.00 -0.02 0.00 0.00 31.44 31.40 1sr3 n GLU 49 CO 0.00 0.00 0.00 -2.37 1.18 0.00 0.00 177.13 175.94 1sr3 n THR 50 N -2.06 0.00 -0.01 2.62 5.66 -0.53 -4.85 114.28 115.11 1sr3 n THR 50 Ca 0.00 0.00 -0.10 0.00 -3.05 0.00 0.00 64.05 60.90 1sr3 n THR 50 Cb 0.00 0.12 -0.04 0.00 -1.55 0.00 0.00 70.33 68.86 1sr3 n THR 50 CO 0.00 0.00 0.00 0.06 -3.05 0.00 0.00 175.07 172.08 1sr3 h GLN 51 N 0.00 0.09 -1.85 1.09 -0.00 -1.96 -3.48 115.11 109.01 1sr3 h GLN 51 Ca -0.14 -0.01 0.34 0.00 -0.00 0.00 0.00 58.65 58.85 1sr3 h GLN 51 Cb 0.91 -0.02 -0.09 0.00 -0.00 0.00 0.00 27.48 28.29 1sr3 h GLN 51 CO -0.07 0.06 0.89 1.14 -0.00 0.00 0.00 178.83 180.84 1sr3 s GLN 52 N -6.19 0.36 0.25 0.06 1.03 -1.26 -5.10 119.66 108.80 1sr3 s GLN 52 Ca -0.13 -0.22 0.10 0.00 0.04 0.00 0.00 55.36 55.15 1sr3 s GLN 52 Cb 0.08 0.11 -0.04 0.00 0.03 0.00 0.00 33.01 33.18 1sr3 s GLN 52 CO 0.68 -0.17 -0.06 -1.64 -2.54 0.00 0.00 175.29 171.56 1sr3 s MET 53 N -2.14 2.13 0.50 9.60 -1.94 -1.26 -3.84 119.30 122.35 1sr3 s MET 53 Ca 0.24 -1.44 -0.21 0.00 -1.71 0.00 0.00 55.69 52.57 1sr3 s MET 53 Cb 0.02 -2.09 -0.07 0.00 2.01 0.00 0.00 34.83 34.70 1sr3 s MET 53 CO -0.02 0.38 1.14 -1.25 -0.01 0.00 0.00 175.02 175.26 1sr3 s PRO 54 N -3.43 3.57 0.38 2.03 0.04 -1.26 -5.02 135.00 131.31 1sr3 s PRO 54 Ca 0.29 1.68 -0.24 0.00 0.04 0.00 0.00 61.00 62.77 1sr3 s PRO 54 Cb -0.07 -2.20 -0.10 0.00 0.04 0.00 0.00 34.50 32.17 1sr3 s PRO 54 CO 0.18 -0.68 0.97 -1.21 0.04 0.00 0.00 177.00 176.30 1sr3 s GLU 55 N -3.00 4.36 0.00 4.56 2.02 -1.26 -4.95 118.70 120.44 1sr3 s GLU 55 Ca 0.68 1.30 0.22 0.00 0.02 0.00 0.00 54.97 57.20 1sr3 s GLU 55 Cb -0.26 -2.53 1.33 0.00 0.10 0.00 0.00 34.13 32.78 1sr3 s GLU 55 CO 0.30 0.07 1.76 0.28 0.02 0.00 0.00 175.26 177.69 1sr3 n VAL 56 N 0.01 0.00 -2.74 2.63 0.31 -1.26 -2.62 118.33 114.65 1sr3 n VAL 56 Ca 0.04 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.37 1sr3 n VAL 56 Cb 0.51 -0.51 0.05 0.00 -0.91 0.00 0.00 33.84 32.99 1sr3 n VAL 56 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1sr3 n GLY 57 N 0.60 1.68 3.78 2.92 0.00 -1.26 -4.31 105.19 108.60 1sr3 n GLY 57 Ca 0.17 -0.87 -0.23 0.00 0.00 0.00 0.00 46.02 45.09 1sr3 n GLY 57 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1sr3 s GLN 58 N -2.60 2.38 0.48 1.61 -2.07 -1.08 -4.97 119.66 113.41 1sr3 s GLN 58 Ca 0.24 -1.64 -0.19 0.00 -1.82 0.00 0.00 55.36 51.96 1sr3 s GLN 58 Cb 0.34 -2.18 -0.09 0.00 -1.09 0.00 0.00 33.01 29.99 1sr3 s GLN 58 CO -0.07 -0.06 0.97 -0.98 -1.32 0.00 0.00 175.29 173.83 1sr3 s ARG 59 N -3.96 4.07 0.24 9.60 1.70 -1.26 -2.34 118.95 127.01 1sr3 s ARG 59 Ca 0.42 1.04 -0.17 0.00 -0.47 0.00 0.00 55.73 56.55 1sr3 s ARG 59 Cb -0.00 -2.15 0.01 0.00 -0.57 0.00 0.00 34.95 32.23 1sr3 s ARG 59 CO 0.24 -0.17 0.57 -0.48 -1.08 0.00 0.00 175.30 174.39 1sr3 s LEU 60 N -3.66 0.05 -0.08 -1.89 -0.00 0.34 -4.93 118.68 108.51 1sr3 s LEU 60 Ca 0.60 -0.69 0.02 0.00 -0.00 0.00 0.00 54.13 54.07 1sr3 s LEU 60 Cb -0.10 2.20 -0.02 0.00 -0.00 0.00 0.00 46.19 48.27 1sr3 s LEU 60 CO 0.23 -1.18 -0.14 -0.60 -0.00 0.00 0.00 176.35 174.65 1sr3 s ARG 61 N -3.94 2.80 0.13 1.48 3.52 -1.26 -1.85 118.95 119.83 1sr3 s ARG 61 Ca 0.15 -0.70 0.09 0.00 -0.13 0.00 0.00 55.73 55.13 1sr3 s ARG 61 Cb -0.03 -2.45 -0.04 0.00 -1.56 0.00 0.00 34.95 30.87 1sr3 s ARG 61 CO 0.05 0.48 -0.21 0.08 -0.81 0.00 0.00 175.30 174.88 1sr3 s VAL 62 N -0.35 1.87 0.09 7.11 1.01 0.60 -0.70 120.40 130.03 1sr3 s VAL 62 Ca 0.03 -1.72 0.07 0.00 0.00 0.00 0.00 61.98 60.36 1sr3 s VAL 62 Cb -0.13 -1.75 -0.03 0.00 0.00 0.00 0.00 36.38 34.48 1sr3 s VAL 62 CO 0.02 -0.12 -0.18 -0.83 0.00 0.00 0.00 175.10 173.99 1sr3 s GLY 63 N -2.22 1.08 -0.09 4.51 0.00 -1.03 -0.78 107.32 108.80 1sr3 s GLY 63 Ca 0.11 -1.13 -0.31 0.00 0.00 0.00 0.00 44.72 43.39 1sr3 s GLY 63 CO 0.06 -1.14 1.37 -0.32 0.00 0.00 0.00 173.10 173.06 1sr3 s GLY 64 N -1.79 -0.23 -0.17 0.20 0.00 -0.73 -4.13 107.32 100.47 1sr3 s GLY 64 Ca 0.03 0.20 -0.19 0.00 0.00 0.00 0.00 44.72 44.76 1sr3 s GLY 64 CO 0.03 6.37 0.53 -0.29 0.00 0.00 0.00 173.10 179.75 1sr3 s MET 65 N -2.01 4.25 0.13 2.90 1.75 0.82 -0.68 119.30 126.46 1sr3 s MET 65 Ca 0.31 0.48 -0.31 0.00 -1.25 0.00 0.00 55.69 54.92 1sr3 s MET 65 Cb 0.00 -3.52 -0.08 0.00 2.84 0.00 0.00 34.83 34.07 1sr3 s MET 65 CO -0.03 -0.06 1.44 0.08 -0.65 0.00 0.00 175.02 175.80 1sr3 s VAL 66 N 1.33 3.12 0.35 10.11 1.01 -0.38 -0.34 120.40 135.60 1sr3 s VAL 66 Ca 0.26 0.81 -0.29 0.00 0.00 0.00 0.00 61.98 62.76 1sr3 s VAL 66 Cb -0.15 -3.52 -0.11 0.00 0.00 0.00 0.00 36.38 32.60 1sr3 s VAL 66 CO 0.10 0.06 1.44 -0.04 0.00 0.00 0.00 175.10 176.66 1sr3 s MET 67 N 1.10 4.20 0.47 2.72 -1.94 0.05 -1.15 119.30 124.75 1sr3 s MET 67 Ca 0.66 2.44 -0.23 0.00 -1.71 0.00 0.00 55.69 56.85 1sr3 s MET 67 Cb -0.39 -3.02 -0.07 0.00 2.01 0.00 0.00 34.83 33.37 1sr3 s MET 67 CO 0.31 -0.42 1.16 -1.25 -0.01 0.00 0.00 175.02 174.80 1sr3 s PRO 68 N -1.73 3.72 -1.18 2.03 0.04 -1.26 -3.52 135.00 133.10 1sr3 s PRO 68 Ca 0.53 1.75 0.00 0.00 0.04 0.00 0.00 61.00 63.32 1sr3 s PRO 68 Cb -0.44 -2.36 0.00 0.00 0.04 0.00 0.00 34.50 31.74 1sr3 s PRO 68 CO 0.57 -0.58 0.00 0.41 0.04 0.00 0.00 177.00 177.44 1sr3 n GLY 69 N 0.41 1.12 0.00 0.56 0.00 -1.26 -4.85 105.19 101.17 1sr3 n GLY 69 Ca 0.08 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.60 1sr3 n GLY 69 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1sr3 n SER 70 N 0.14 4.94 -4.56 1.61 7.64 -1.23 -4.93 113.62 117.24 1sr3 n SER 70 Ca -0.12 0.00 -0.23 0.00 1.01 0.00 0.00 58.87 59.53 1sr3 n SER 70 Cb 0.39 0.68 -0.05 0.00 -1.01 0.00 0.00 64.21 64.22 1sr3 n SER 70 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1sr3 s VAL 71 N -1.98 3.04 -0.02 0.44 1.01 -1.26 -3.91 120.40 117.73 1sr3 s VAL 71 Ca 0.00 -0.02 -0.05 0.00 0.00 0.00 0.00 61.98 61.91 1sr3 s VAL 71 Cb 0.00 -3.11 -0.03 0.00 0.00 0.00 0.00 36.38 33.25 1sr3 s VAL 71 CO 0.00 -0.10 0.41 1.56 0.00 0.00 0.00 175.10 176.97 1sr3 h GLN 72 N 15.19 -0.17 -2.63 2.72 4.20 -1.43 -3.49 115.11 129.50 1sr3 h GLN 72 Ca -0.09 0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.63 1sr3 h GLN 72 Cb 1.10 0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.92 1sr3 h GLN 72 CO 1.08 -0.12 -0.63 0.54 -0.67 0.00 0.00 178.83 179.04 1sr3 n ARG 73 N -3.20 -3.30 -2.34 1.46 1.74 -1.26 -4.89 116.66 104.88 1sr3 n ARG 73 Ca -0.02 2.41 -0.42 0.00 -0.77 0.00 0.00 57.85 59.05 1sr3 n ARG 73 Cb 0.07 -2.68 -0.03 0.00 -1.02 0.00 0.00 32.46 28.80 1sr3 n ARG 73 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1sr3 s ASP 74 N -2.27 6.95 0.39 0.55 1.11 -0.24 -4.90 116.67 118.27 1sr3 s ASP 74 Ca 0.00 1.97 0.28 0.00 0.18 0.00 0.00 52.55 54.98 1sr3 s ASP 74 Cb 0.00 -2.56 1.33 0.00 1.07 0.00 0.00 42.92 42.76 1sr3 s ASP 74 CO 0.00 -0.65 1.85 1.55 1.18 0.00 0.00 175.17 179.10 1sr3 h PRO 75 N 7.64 0.00 0.00 8.23 0.13 -1.91 -2.57 132.00 143.51 1sr3 h PRO 75 Ca -0.36 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.77 1sr3 h PRO 75 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1sr3 h PRO 75 CO 0.89 0.00 -1.49 0.09 -0.23 0.00 0.00 178.00 177.26 1sr3 n ASN 76 N -2.53 0.40 -2.13 1.44 3.02 -1.26 -5.07 115.26 109.13 1sr3 n ASN 76 Ca -0.00 0.00 -0.06 0.00 -0.03 0.00 0.00 54.58 54.49 1sr3 n ASN 76 Cb 0.16 1.30 0.01 0.00 -0.61 0.00 0.00 39.78 40.64 1sr3 n ASN 76 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 1sr3 n SER 77 N -2.28 -1.27 -0.85 6.41 2.88 -0.97 -5.06 113.62 112.47 1sr3 n SER 77 Ca -0.01 -2.03 0.12 0.00 -1.33 0.00 0.00 58.87 55.61 1sr3 n SER 77 Cb 0.53 2.16 0.09 0.00 -0.75 0.00 0.00 64.21 66.24 1sr3 n SER 77 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1sr3 n LEU 78 N 0.00 2.77 -4.77 2.46 4.32 -1.26 -4.08 117.00 116.43 1sr3 n LEU 78 Ca -0.04 -0.94 -0.41 0.00 -0.02 0.00 0.00 56.01 54.60 1sr3 n LEU 78 Cb 0.37 -0.00 -0.00 0.00 -1.62 0.00 0.00 43.42 42.16 1sr3 n LEU 78 CO 0.17 0.47 1.16 -0.54 -1.22 0.00 0.00 177.39 177.44 1sr3 s LYS 79 N -2.10 4.10 0.18 3.23 -0.14 -1.26 -2.47 119.74 121.28 1sr3 s LYS 79 Ca 0.26 2.59 0.08 0.00 -1.36 0.00 0.00 55.97 57.53 1sr3 s LYS 79 Cb 0.20 -2.97 -0.04 0.00 -1.68 0.00 0.00 37.83 33.33 1sr3 s LYS 79 CO 0.36 -0.56 -0.15 0.08 -0.76 0.00 0.00 175.35 174.32 1sr3 s VAL 80 N -0.93 1.69 -0.01 3.17 1.01 0.68 -1.07 120.40 124.94 1sr3 s VAL 80 Ca 0.55 -2.09 0.05 0.00 0.00 0.00 0.00 61.98 60.49 1sr3 s VAL 80 Cb -0.47 -1.93 -0.01 0.00 0.00 0.00 0.00 36.38 33.96 1sr3 s VAL 80 CO 0.61 -0.52 -0.17 0.42 0.00 0.00 0.00 175.10 175.44 1sr3 s THR 81 N -2.69 1.31 0.31 3.92 -4.23 -1.26 -1.33 115.64 111.67 1sr3 s THR 81 Ca 0.19 -0.75 0.06 0.00 -1.18 0.00 0.00 61.69 60.02 1sr3 s THR 81 Cb -0.02 -1.10 -0.02 0.00 1.34 0.00 0.00 72.50 72.70 1sr3 s THR 81 CO 0.06 0.34 0.29 2.22 -0.54 0.00 0.00 174.62 176.98 1sr3 n PHE 82 N 2.58 -0.82 -4.18 3.99 -1.74 -0.78 -1.01 117.46 115.50 1sr3 n PHE 82 Ca -0.15 -2.58 -0.18 0.00 -0.56 0.00 0.00 57.45 53.98 1sr3 n PHE 82 Cb 0.54 0.30 -0.12 0.00 1.52 0.00 0.00 39.48 41.73 1sr3 n PHE 82 CO 0.00 0.00 0.00 0.99 -0.56 0.00 0.00 176.76 177.19 1sr3 s THR 83 N -3.21 1.11 -0.06 1.97 2.01 -1.26 -0.44 115.64 115.76 1sr3 s THR 83 Ca 0.36 -1.40 0.02 0.00 0.31 0.00 0.00 61.69 60.98 1sr3 s THR 83 Cb 0.02 -1.16 0.02 0.00 0.01 0.00 0.00 72.50 71.38 1sr3 s THR 83 CO 0.26 -0.29 -0.10 -0.63 -0.69 0.00 0.00 174.62 173.16 1sr3 s ILE 84 N -1.53 0.96 0.41 1.82 1.01 0.10 -0.77 121.20 123.20 1sr3 s ILE 84 Ca 0.00 -0.37 0.01 0.00 0.00 0.00 0.00 60.65 60.29 1sr3 s ILE 84 Cb -0.08 -0.91 0.01 0.00 0.01 0.00 0.00 42.46 41.49 1sr3 s ILE 84 CO 0.02 0.32 0.11 0.00 0.00 0.00 0.00 174.94 175.39 1sr3 n TYR 85 N 3.91 0.35 -0.21 3.97 4.11 0.54 -0.30 117.16 129.53 1sr3 n TYR 85 Ca -0.23 -1.91 0.00 0.00 -0.00 0.00 0.00 57.90 55.76 1sr3 n TYR 85 Cb 0.51 -0.29 0.00 0.00 -0.00 0.00 0.00 39.34 39.56 1sr3 n TYR 85 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 176.86 173.39 1sr3 n ASP 86 N -1.45 3.16 0.27 9.48 2.03 -1.09 -0.12 116.55 128.83 1sr3 n ASP 86 Ca -0.12 0.00 0.18 0.00 0.52 0.00 0.00 54.79 55.38 1sr3 n ASP 86 Cb 0.50 0.00 0.88 0.00 -0.72 0.00 0.00 41.12 41.78 1sr3 n ASP 86 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1sr3 h ALA 87 N 1.76 1.00 0.00 -1.67 0.00 -2.00 -3.40 119.26 114.95 1sr3 h ALA 87 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1sr3 h ALA 87 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1sr3 h ALA 87 CO 0.00 0.00 -0.02 0.39 0.00 0.00 0.00 179.25 179.62 1sr3 n GLU 88 N -2.89 0.01 0.00 0.00 -0.58 -1.26 -5.10 120.64 110.82 1sr3 n GLU 88 Ca -0.01 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.73 1sr3 n GLU 88 Cb 0.16 -0.36 0.00 0.00 -0.57 0.00 0.00 31.44 30.68 1sr3 n GLU 88 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1sr3 n GLY 89 N 2.17 5.08 3.29 0.62 0.00 -1.20 -4.97 105.19 110.19 1sr3 n GLY 89 Ca -0.00 -1.15 -0.09 0.00 0.00 0.00 0.00 46.02 44.77 1sr3 n GLY 89 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1sr3 s SER 90 N 1.13 0.07 -0.00 1.61 1.04 -1.24 -2.66 113.70 113.65 1sr3 s SER 90 Ca 0.00 -0.80 0.00 0.00 0.48 0.00 0.00 55.95 55.63 1sr3 s SER 90 Cb 0.00 0.40 0.00 0.00 0.10 0.00 0.00 66.02 66.53 1sr3 s SER 90 CO 0.00 -0.84 0.00 0.68 0.98 0.00 0.00 173.24 174.07 1sr3 s VAL 91 N -3.93 -0.00 0.49 5.02 -7.23 0.60 -4.94 120.40 110.41 1sr3 s VAL 91 Ca 0.13 0.03 -0.20 0.00 -1.81 0.00 0.00 61.98 60.13 1sr3 s VAL 91 Cb 0.04 -0.03 -0.08 0.00 0.56 0.00 0.00 36.38 36.87 1sr3 s VAL 91 CO -0.04 0.02 1.03 -1.81 -0.31 0.00 0.00 175.10 173.99 1sr3 s ASP 92 N 0.15 6.35 0.12 4.85 1.11 -1.26 -0.72 116.67 127.27 1sr3 s ASP 92 Ca -0.01 1.87 0.07 0.00 0.18 0.00 0.00 52.55 54.66 1sr3 s ASP 92 Cb -0.02 -2.55 -0.04 0.00 1.07 0.00 0.00 42.92 41.38 1sr3 s ASP 92 CO -0.00 -0.77 -0.17 0.68 1.18 0.00 0.00 175.17 176.08 1sr3 s VAL 93 N -2.09 1.53 -0.09 -1.27 -7.23 0.42 -0.93 120.40 110.75 1sr3 s VAL 93 Ca 0.66 -1.66 0.02 0.00 -1.81 0.00 0.00 61.98 59.20 1sr3 s VAL 93 Cb -0.15 -1.55 0.01 0.00 0.56 0.00 0.00 36.38 35.25 1sr3 s VAL 93 CO 0.22 -0.26 -0.15 -0.94 -0.31 0.00 0.00 175.10 173.65 1sr3 s SER 94 N -2.24 2.24 0.36 4.85 1.04 -0.38 -1.86 113.70 117.70 1sr3 s SER 94 Ca 0.08 -0.39 0.05 0.00 0.48 0.00 0.00 55.95 56.17 1sr3 s SER 94 Cb -0.07 -1.02 -0.06 0.00 0.10 0.00 0.00 66.02 64.96 1sr3 s SER 94 CO 0.04 0.05 0.05 -0.47 0.98 0.00 0.00 173.24 173.89 1sr3 s TYR 95 N 0.72 2.10 -0.29 5.02 5.04 -0.44 -0.66 117.35 128.84 1sr3 s TYR 95 Ca -0.13 -0.90 0.00 0.00 -2.44 0.00 0.00 57.07 53.61 1sr3 s TYR 95 Cb -0.16 -1.42 0.18 0.00 0.35 0.00 0.00 41.96 40.92 1sr3 s TYR 95 CO 0.03 0.12 0.57 -2.00 -1.34 0.00 0.00 175.55 172.92 1sr3 s GLU 96 N -3.84 0.54 0.00 4.97 2.12 -1.26 -0.23 118.70 121.00 1sr3 s GLU 96 Ca 0.35 0.83 0.00 0.00 0.36 0.00 0.00 54.97 56.50 1sr3 s GLU 96 Cb 0.09 0.35 0.00 0.00 0.26 0.00 0.00 34.13 34.83 1sr3 s GLU 96 CO 0.16 -0.73 0.00 0.41 -0.54 0.00 0.00 175.26 174.56 1sr3 n GLY 97 N 5.42 0.00 1.63 -1.50 0.00 -1.03 -4.92 105.19 104.79 1sr3 n GLY 97 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1sr3 n GLY 97 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1sr3 n ILE 98 N 0.00 -4.24 -2.99 -0.61 0.00 -1.26 -5.03 119.36 105.23 1sr3 n ILE 98 Ca 0.00 1.99 -0.24 0.00 0.00 0.00 0.00 62.75 64.50 1sr3 n ILE 98 Cb 0.00 -2.89 0.01 0.00 0.00 0.00 0.00 39.64 36.75 1sr3 n ILE 98 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 1sr3 s LEU 99 N -4.21 3.70 0.58 9.51 1.43 -1.26 -5.05 118.68 123.39 1sr3 s LEU 99 Ca 0.00 0.46 -0.20 0.00 -1.03 0.00 0.00 54.13 53.36 1sr3 s LEU 99 Cb 0.00 -3.34 -0.04 0.00 0.03 0.00 0.00 46.19 42.84 1sr3 s LEU 99 CO 0.00 -0.61 1.23 -2.65 0.23 0.00 0.00 176.35 174.55 1sr3 n PRO 100 N -2.07 1.34 0.25 1.29 -0.02 -1.26 -4.88 135.00 129.64 1sr3 n PRO 100 Ca -0.00 0.50 0.17 0.00 -2.02 0.00 0.00 63.50 62.15 1sr3 n PRO 100 Cb 0.57 -2.44 0.77 0.00 -0.02 0.00 0.00 33.50 32.38 1sr3 n PRO 100 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1sr3 h ASP 101 N 0.98 0.00 0.58 2.55 3.32 -2.00 -2.67 116.42 119.17 1sr3 h ASP 101 Ca -0.50 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 56.40 1sr3 h ASP 101 Cb 1.33 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.86 1sr3 h ASP 101 CO 0.54 0.00 -0.68 -0.07 -1.72 0.00 0.00 179.24 177.31 1sr3 h LEU 102 N 0.00 0.11 -9.87 1.55 4.07 -1.99 -3.45 115.31 105.73 1sr3 h LEU 102 Ca 0.00 -0.07 -0.53 0.00 0.08 0.00 0.00 57.88 57.36 1sr3 h LEU 102 Cb 0.28 -0.03 0.09 0.00 1.08 0.00 0.00 40.66 42.07 1sr3 h LEU 102 CO 0.00 0.76 0.79 0.12 -1.08 0.00 0.00 178.44 179.03 1sr3 s PHE 103 N -3.52 2.75 0.19 1.13 2.19 -1.01 -5.02 117.98 114.69 1sr3 s PHE 103 Ca -0.02 1.06 -0.04 0.00 0.33 0.00 0.00 56.93 58.27 1sr3 s PHE 103 Cb 0.12 -3.97 -0.03 0.00 -1.31 0.00 0.00 43.02 37.83 1sr3 s PHE 103 CO 0.79 -3.00 0.19 1.03 1.83 0.00 0.00 175.22 176.06 1sr3 s ARG 104 N -1.36 1.21 0.23 10.12 1.81 -1.26 -4.96 118.95 124.74 1sr3 s ARG 104 Ca 0.56 -1.50 -0.31 0.00 -1.72 0.00 0.00 55.73 52.76 1sr3 s ARG 104 Cb -0.45 0.31 -0.11 0.00 -0.45 0.00 0.00 34.95 34.25 1sr3 s ARG 104 CO 0.55 -0.42 1.56 -1.21 -0.68 0.00 0.00 175.30 175.10 1sr3 s GLU 105 N -4.11 4.19 0.00 3.54 2.02 -1.26 -3.86 118.70 119.22 1sr3 s GLU 105 Ca 0.32 2.43 0.00 0.00 0.02 0.00 0.00 54.97 57.75 1sr3 s GLU 105 Cb 0.06 -3.10 0.00 0.00 0.10 0.00 0.00 34.13 31.19 1sr3 s GLU 105 CO 0.09 -0.58 0.00 0.41 0.02 0.00 0.00 175.26 175.20 1sr3 n GLY 106 N 2.91 0.74 3.50 -1.39 0.00 -0.30 -4.90 105.19 105.74 1sr3 n GLY 106 Ca 0.11 -0.28 -0.24 0.00 0.00 0.00 0.00 46.02 45.60 1sr3 n GLY 106 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1sr3 s GLN 107 N -0.75 1.72 -0.04 1.61 -2.07 -1.25 -4.83 119.66 114.05 1sr3 s GLN 107 Ca 0.00 -1.86 -0.30 0.00 -1.82 0.00 0.00 55.36 51.38 1sr3 s GLN 107 Cb 0.00 -1.60 -0.05 0.00 -1.09 0.00 0.00 33.01 30.27 1sr3 s GLN 107 CO 0.00 0.17 1.36 0.20 -1.32 0.00 0.00 175.29 175.70 1sr3 s GLY 108 N -3.55 1.85 0.21 2.60 0.00 -1.26 -1.25 107.32 105.93 1sr3 s GLY 108 Ca 0.31 0.78 0.06 0.00 0.00 0.00 0.00 44.72 45.87 1sr3 s GLY 108 CO 0.15 2.50 -0.08 -1.34 0.00 0.00 0.00 173.10 174.33 1sr3 s VAL 109 N 2.64 1.39 -0.11 1.40 -7.23 0.14 -4.13 120.40 114.51 1sr3 s VAL 109 Ca 0.62 -2.11 -0.00 0.00 -1.81 0.00 0.00 61.98 58.68 1sr3 s VAL 109 Cb -0.29 -2.15 -0.02 0.00 0.56 0.00 0.00 36.38 34.47 1sr3 s VAL 109 CO 0.24 -0.51 -0.10 -0.69 -0.31 0.00 0.00 175.10 173.74 1sr3 s VAL 110 N -3.18 3.42 0.26 1.32 1.01 0.64 -1.77 120.40 122.09 1sr3 s VAL 110 Ca 0.24 -0.56 0.08 0.00 0.00 0.00 0.00 61.98 61.74 1sr3 s VAL 110 Cb 0.03 -2.42 -0.04 0.00 0.00 0.00 0.00 36.38 33.95 1sr3 s VAL 110 CO 0.07 0.55 0.15 -0.69 0.00 0.00 0.00 175.10 175.18 1sr3 s VAL 111 N -0.14 4.10 -0.02 2.92 1.01 0.04 -0.48 120.40 127.83 1sr3 s VAL 111 Ca 0.01 -1.53 -0.28 0.00 0.00 0.00 0.00 61.98 60.17 1sr3 s VAL 111 Cb -0.13 -3.24 0.06 0.00 0.00 0.00 0.00 36.38 33.07 1sr3 s VAL 111 CO 0.03 -0.34 0.62 -1.58 0.00 0.00 0.00 175.10 173.84 1sr3 s GLN 112 N -3.81 1.03 0.00 2.72 0.74 -1.26 -0.29 119.66 118.79 1sr3 s GLN 112 Ca 0.33 0.12 0.00 0.00 0.05 0.00 0.00 55.36 55.87 1sr3 s GLN 112 Cb -0.07 0.48 0.00 0.00 1.10 0.00 0.00 33.01 34.52 1sr3 s GLN 112 CO 0.24 -0.33 0.00 0.41 -0.55 0.00 0.00 175.29 175.05 1sr3 n GLY 113 N 0.82 -0.27 3.36 2.59 0.00 -0.77 -0.18 105.19 110.73 1sr3 n GLY 113 Ca -0.19 -0.78 -0.21 0.00 0.00 0.00 0.00 46.02 44.84 1sr3 n GLY 113 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1sr3 s GLU 114 N -2.00 1.35 0.10 1.61 2.02 -0.48 -0.51 118.70 120.79 1sr3 s GLU 114 Ca 0.00 -1.53 -0.25 0.00 0.02 0.00 0.00 54.97 53.21 1sr3 s GLU 114 Cb 0.00 -1.30 -0.07 0.00 0.10 0.00 0.00 34.13 32.86 1sr3 s GLU 114 CO 0.00 0.24 0.77 -1.17 0.02 0.00 0.00 175.26 175.12 1sr3 s LEU 115 N -3.06 4.52 -0.05 1.80 2.96 -0.99 0.24 118.68 124.10 1sr3 s LEU 115 Ca 0.21 1.53 -0.02 0.00 -0.22 0.00 0.00 54.13 55.63 1sr3 s LEU 115 Cb -0.04 -3.25 -0.01 0.00 0.50 0.00 0.00 46.19 43.40 1sr3 s LEU 115 CO 0.08 0.11 -0.04 -0.08 -1.32 0.00 0.00 176.35 175.10 1sr3 h GLU 116 N 5.05 0.00 -2.19 1.98 4.22 -1.13 -3.37 114.58 119.13 1sr3 h GLU 116 Ca -0.45 0.00 0.03 0.00 0.08 0.00 0.00 59.36 59.01 1sr3 h GLU 116 Cb 1.21 0.00 -0.17 0.00 0.50 0.00 0.00 28.75 30.28 1sr3 h GLU 116 CO 0.68 0.00 0.36 0.15 -2.18 0.00 0.00 179.01 178.02 1sr3 s LYS 117 N -1.37 0.94 3.69 1.92 1.02 -1.26 -4.82 119.74 119.86 1sr3 s LYS 117 Ca -0.03 -0.08 0.00 0.00 0.02 0.00 0.00 55.97 55.88 1sr3 s LYS 117 Cb 0.00 0.44 0.00 0.00 -0.52 0.00 0.00 37.83 37.75 1sr3 s LYS 117 CO 0.05 -0.36 0.00 0.41 -0.92 0.00 0.00 175.35 174.53 1sr3 n GLY 118 N 0.28 0.55 0.00 -3.33 0.00 -1.26 -2.14 105.19 99.29 1sr3 n GLY 118 Ca -0.14 0.55 0.00 0.00 0.00 0.00 0.00 46.02 46.43 1sr3 n GLY 118 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1sr3 n ASN 119 N 7.16 0.11 -4.69 1.61 5.03 -1.26 -4.87 115.26 118.36 1sr3 n ASN 119 Ca 0.00 -1.02 -0.42 0.00 0.87 0.00 0.00 54.58 54.01 1sr3 n ASN 119 Cb 0.00 0.00 -0.03 0.00 -1.02 0.00 0.00 39.78 38.73 1sr3 n ASN 119 CO 0.00 0.00 0.00 -2.28 -1.83 0.00 0.00 177.26 173.15 1sr3 s HIS 120 N -0.02 2.81 -0.25 3.10 2.46 -0.91 -4.23 115.29 118.25 1sr3 s HIS 120 Ca 0.00 0.80 -0.12 0.00 0.47 0.00 0.00 55.06 56.21 1sr3 s HIS 120 Cb 0.00 -3.67 -0.05 0.00 -0.13 0.00 0.00 32.58 28.74 1sr3 s HIS 120 CO 0.00 -2.47 0.25 0.42 -2.47 0.00 0.00 174.74 170.47 1sr3 s ILE 121 N 2.54 5.28 -1.24 0.89 -1.09 -0.11 -0.75 121.20 126.72 1sr3 s ILE 121 Ca 0.64 0.34 -0.19 0.00 -2.23 0.00 0.00 60.65 59.20 1sr3 s ILE 121 Cb -0.31 -3.58 0.05 0.00 -1.58 0.00 0.00 42.46 37.04 1sr3 s ILE 121 CO 0.26 0.26 1.72 -0.76 -1.23 0.00 0.00 174.94 175.19 1sr3 s LEU 122 N 1.52 3.71 0.19 2.97 2.01 0.14 -1.25 118.68 127.97 1sr3 s LEU 122 Ca 0.11 -2.20 -0.33 0.00 0.01 0.00 0.00 54.13 51.71 1sr3 s LEU 122 Cb -0.15 -2.58 -0.15 0.00 0.01 0.00 0.00 46.19 43.32 1sr3 s LEU 122 CO 0.08 -1.42 1.33 0.00 1.01 0.00 0.00 176.35 177.35 1sr3 n ALA 123 N 9.10 0.17 -0.03 4.21 0.00 0.16 -1.38 120.51 132.74 1sr3 n ALA 123 Ca 0.46 0.45 -0.00 0.00 0.00 0.00 0.00 53.44 54.35 1sr3 n ALA 123 Cb 0.47 -2.17 -0.09 0.00 0.00 0.00 0.00 19.45 17.67 1sr3 n ALA 123 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 1sr3 n LYS 124 N 2.15 1.35 0.00 0.00 -0.00 0.74 -4.27 118.16 118.13 1sr3 n LYS 124 Ca 0.14 -0.05 0.00 0.00 -0.00 0.00 0.00 58.31 58.40 1sr3 n LYS 124 Cb 0.27 -1.27 0.00 0.00 -0.00 0.00 0.00 35.03 34.03 1sr3 n LYS 124 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.40 176.55 1sr3 n GLU 125 N -2.16 0.03 -2.10 -1.58 0.28 -1.21 -4.88 120.64 109.02 1sr3 n GLU 125 Ca -0.10 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.90 1sr3 n GLU 125 Cb 0.59 -0.51 0.00 0.00 1.43 0.00 0.00 31.44 32.94 1sr3 n GLU 125 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 177.13 177.25 1sr3 n VAL 126 N -1.27 -8.46 -4.24 3.84 0.31 -1.26 -4.94 118.33 102.31 1sr3 n VAL 126 Ca 0.00 2.06 -0.18 0.00 -0.01 0.00 0.00 64.34 66.21 1sr3 n VAL 126 Cb 0.01 -4.10 -0.11 0.00 -0.91 0.00 0.00 33.84 28.73 1sr3 n VAL 126 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1sr3 s LEU 127 N -0.36 2.39 -0.30 7.52 1.43 0.37 -4.63 118.68 125.12 1sr3 s LEU 127 Ca 0.00 -0.80 0.07 0.00 -1.03 0.00 0.00 54.13 52.38 1sr3 s LEU 127 Cb 0.00 -0.55 0.45 0.00 0.03 0.00 0.00 46.19 46.13 1sr3 s LEU 127 CO 0.00 -0.14 1.27 0.00 0.23 0.00 0.00 176.35 177.71 1sr3 n ALA 128 N 0.58 4.77 -4.40 4.21 0.00 -1.26 -0.26 120.51 124.16 1sr3 n ALA 128 Ca -0.16 -3.62 -0.38 0.00 0.00 0.00 0.00 53.44 49.28 1sr3 n ALA 128 Cb 0.57 -0.45 -0.07 0.00 0.00 0.00 0.00 19.45 19.49 1sr3 n ALA 128 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1sr3 n LYS 129 N -0.84 -1.43 -1.16 0.00 4.76 -1.26 -4.79 118.16 113.44 1sr3 n LYS 129 Ca 0.39 0.19 -0.28 0.00 -2.87 0.00 0.00 58.31 55.75 1sr3 n LYS 129 Cb 0.90 -4.54 0.08 0.00 -1.84 0.00 0.00 35.03 29.62 1sr3 n LYS 129 CO 0.00 0.00 0.00 -2.39 -1.37 0.00 0.00 177.40 173.64 1sr3 n HIS 130 N -4.26 2.64 -2.97 2.13 1.44 -1.26 -4.87 115.22 108.06 1sr3 n HIS 130 Ca -0.01 -2.54 -0.03 0.00 -2.01 0.00 0.00 57.72 53.13 1sr3 n HIS 130 Cb 0.53 -1.23 0.01 0.00 0.12 0.00 0.00 29.99 29.42 1sr3 n HIS 130 CO 0.00 0.00 0.00 -3.47 -2.81 0.00 0.00 176.34 170.06 1sr3 n ASP 131 N -0.53 -7.16 -4.41 4.39 2.03 -1.26 -5.06 116.55 104.55 1sr3 n ASP 131 Ca 0.51 -0.18 -0.27 0.00 0.52 0.00 0.00 54.79 55.38 1sr3 n ASP 131 Cb 0.73 -4.96 -0.09 0.00 -0.72 0.00 0.00 41.12 36.08 1sr3 n ASP 131 CO 0.00 0.00 0.00 -1.83 -1.92 0.00 0.00 177.20 173.45 1sr3 s GLU 132 N -3.24 1.94 0.00 -0.67 4.04 -1.26 -5.06 118.70 114.45 1sr3 s GLU 132 Ca 0.08 -2.17 0.00 0.00 0.04 0.00 0.00 54.97 52.92 1sr3 s GLU 132 Cb -0.01 -1.01 0.00 0.00 0.02 0.00 0.00 34.13 33.13 1sr3 s GLU 132 CO 0.69 -0.34 0.00 -1.71 -1.84 0.00 0.00 175.26 172.06 1sr3 n ASN 133 N -1.13 0.00 -3.65 0.83 4.05 -1.26 -5.14 115.26 108.97 1sr3 n ASN 133 Ca -0.09 0.00 -0.13 0.00 0.45 0.00 0.00 54.58 54.82 1sr3 n ASN 133 Cb 0.66 0.10 -0.12 0.00 1.23 0.00 0.00 39.78 41.64 1sr3 n ASN 133 CO 0.00 0.00 0.00 -0.47 -3.05 0.00 0.00 177.26 173.74 1sr3 s TYR 134 N -1.25 -0.48 -0.05 1.20 6.14 -1.26 -5.14 117.35 116.50 1sr3 s TYR 134 Ca 0.00 1.02 -0.17 0.00 0.64 0.00 0.00 57.07 58.55 1sr3 s TYR 134 Cb 0.00 0.00 -0.05 0.00 0.42 0.00 0.00 41.96 42.33 1sr3 s TYR 134 CO 0.00 -0.40 0.47 0.99 0.64 0.00 0.00 175.55 177.26 1sr3 s THR 135 N 2.45 5.07 1.09 4.34 2.01 -1.26 -5.11 115.64 124.23 1sr3 s THR 135 Ca 0.01 0.97 -0.17 0.00 0.31 0.00 0.00 61.69 62.81 1sr3 s THR 135 Cb -0.12 -3.80 0.24 0.00 0.01 0.00 0.00 72.50 68.83 1sr3 s THR 135 CO -0.09 0.44 1.17 -2.16 -0.69 0.00 0.00 174.62 173.29 1sr3 s PRO 136 N -0.16 -0.35 -0.00 4.92 0.04 -1.26 -5.03 135.00 133.16 1sr3 s PRO 136 Ca 0.26 -0.10 -0.04 0.00 0.04 0.00 0.00 61.00 61.16 1sr3 s PRO 136 Cb -0.16 -1.70 -0.28 0.00 0.04 0.00 0.00 34.50 32.39 1sr3 s PRO 136 CO 0.13 -3.13 0.83 -1.00 0.04 0.00 0.00 177.00 173.87 1sr3 h PRO 137 N -2.16 0.27 -1.63 0.56 0.13 -2.00 -3.40 132.00 123.76 1sr3 h PRO 137 Ca -0.46 -0.46 -0.12 0.00 -0.87 0.00 0.00 66.00 64.09 1sr3 h PRO 137 Cb 1.28 0.17 -0.06 0.00 0.13 0.00 0.00 31.00 32.53 1sr3 h PRO 137 CO 0.39 1.14 0.16 -1.91 -0.23 0.00 0.00 178.00 177.55 1sr3 n GLU 138 N -3.47 1.30 0.00 0.86 2.13 -1.26 -2.86 120.64 117.34 1sr3 n GLU 138 Ca -0.17 -0.61 0.00 0.00 0.66 0.00 0.00 57.16 57.03 1sr3 n GLU 138 Cb 1.05 -1.24 0.00 0.00 0.27 0.00 0.00 31.44 31.52 1sr3 n GLU 138 CO 0.00 0.00 0.00 1.33 -0.41 0.00 0.00 177.13 178.05 1sr3 n VAL 139 N 0.85 0.00 -0.03 6.31 0.24 -1.26 -4.46 118.33 119.98 1sr3 n VAL 139 Ca 0.12 0.00 -0.13 0.00 -2.04 0.00 0.00 64.34 62.29 1sr3 n VAL 139 Cb 0.57 0.00 -0.11 0.00 -1.47 0.00 0.00 33.84 32.83 1sr3 n VAL 139 CO 0.00 0.00 0.00 1.05 -2.14 0.00 0.00 176.83 175.74 1sr3 h GLU 140 N 0.00 -0.01 -0.54 7.34 4.11 -1.74 -3.45 114.58 120.28 1sr3 h GLU 140 Ca 0.00 0.00 0.08 0.00 0.07 0.00 0.00 59.36 59.51 1sr3 h GLU 140 Cb 0.00 0.00 -0.19 0.00 0.50 0.00 0.00 28.75 29.07 1sr3 h GLU 140 CO 0.00 0.69 -0.22 0.21 0.07 0.00 0.00 179.01 179.76 1sr3 s LYS 141 N -3.28 0.40 0.00 1.06 2.36 -1.26 -4.98 119.74 114.04 1sr3 s LYS 141 Ca -0.17 -0.01 0.00 0.00 -2.55 0.00 0.00 55.97 53.24 1sr3 s LYS 141 Cb -0.01 0.08 0.00 0.00 -1.05 0.00 0.00 37.83 36.85 1sr3 s LYS 141 CO 0.66 -0.62 0.00 0.00 1.55 0.00 0.00 175.35 176.94 1sr3 n ALA 142 N 4.38 0.00 0.00 3.13 0.00 -1.26 -4.97 120.51 121.78 1sr3 n ALA 142 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.52 1sr3 n ALA 142 Cb 0.59 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.04 1sr3 n ALA 142 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17