#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sr3 n ARG 31 N 0.00 -1.60 -3.64 1.96 0.00 -1.26 -5.08 116.66 107.05 1sr3 n ARG 31 Ca 0.00 -0.42 -0.10 0.00 -0.00 0.00 0.00 57.85 57.33 1sr3 n ARG 31 Cb 0.00 -2.19 -0.07 0.00 -0.00 0.00 0.00 32.46 30.20 1sr3 n ARG 31 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.63 176.51 1sr3 s SER 32 N -2.42 -0.86 0.00 2.89 0.01 -1.26 -5.08 113.70 106.98 1sr3 s SER 32 Ca 0.67 1.48 0.00 0.00 1.31 0.00 0.00 55.95 59.40 1sr3 s SER 32 Cb -0.23 1.42 0.00 0.00 0.21 0.00 0.00 66.02 67.41 1sr3 s SER 32 CO 0.63 -0.24 0.26 -3.20 0.41 0.00 0.00 173.24 171.09 1sr3 n ASN 33 N 3.59 0.11 -0.01 2.44 5.15 -1.26 -5.04 115.26 120.25 1sr3 n ASN 33 Ca -0.17 -1.03 0.00 0.00 -0.60 0.00 0.00 54.58 52.77 1sr3 n ASN 33 Cb 0.57 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.82 1sr3 n ASN 33 CO 0.00 0.00 0.00 -0.38 1.40 0.00 0.00 177.26 178.28 1sr3 n ILE 34 N -0.02 0.00 -1.99 -1.44 2.08 -1.26 -5.11 119.36 111.62 1sr3 n ILE 34 Ca 0.00 0.00 -0.29 0.00 0.56 0.00 0.00 62.75 63.02 1sr3 n ILE 34 Cb 0.34 0.00 0.12 0.00 -0.75 0.00 0.00 39.64 39.35 1sr3 n ILE 34 CO 0.00 0.00 0.00 -0.62 0.56 0.00 0.00 176.55 176.49 1sr3 s ASP 35 N -1.00 4.07 0.75 4.38 -1.08 -1.26 -5.11 116.67 117.42 1sr3 s ASP 35 Ca 0.00 0.50 -0.01 0.00 -0.52 0.00 0.00 52.55 52.53 1sr3 s ASP 35 Cb 0.00 -0.86 0.15 0.00 -1.46 0.00 0.00 42.92 40.75 1sr3 s ASP 35 CO 0.00 -2.14 1.03 -1.48 0.52 0.00 0.00 175.17 173.11 1sr3 s LEU 36 N -5.61 2.92 -0.22 -1.34 0.05 -1.26 -5.07 118.68 108.14 1sr3 s LEU 36 Ca 0.66 -0.50 -0.28 0.00 0.05 0.00 0.00 54.13 54.06 1sr3 s LEU 36 Cb -0.08 -1.71 0.13 0.00 -2.05 0.00 0.00 46.19 42.48 1sr3 s LEU 36 CO 0.49 -2.02 1.06 0.12 -0.55 0.00 0.00 176.35 175.45 1sr3 s PHE 37 N -3.20 -0.38 0.13 3.48 2.19 -1.26 -4.35 117.98 114.59 1sr3 s PHE 37 Ca 0.68 0.78 0.02 0.00 0.33 0.00 0.00 56.93 58.74 1sr3 s PHE 37 Cb -0.04 0.42 -0.01 0.00 -1.31 0.00 0.00 43.02 42.08 1sr3 s PHE 37 CO 0.45 -0.26 0.13 0.66 1.83 0.00 0.00 175.22 178.03 1sr3 n TYR 38 N 1.36 -0.45 -4.31 10.12 4.02 0.21 -4.94 117.16 123.17 1sr3 n TYR 38 Ca -0.11 -1.06 -0.17 0.00 -0.01 0.00 0.00 57.90 56.56 1sr3 n TYR 38 Cb 0.57 0.14 -0.10 0.00 -0.02 0.00 0.00 39.34 39.93 1sr3 n TYR 38 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 176.86 176.80 1sr3 s THR 39 N -2.55 0.44 -1.04 -0.72 -4.23 -1.26 -1.90 115.64 104.38 1sr3 s THR 39 Ca 0.15 -2.00 -0.19 0.00 -1.18 0.00 0.00 61.69 58.46 1sr3 s THR 39 Cb 0.00 -2.59 -0.08 0.00 1.34 0.00 0.00 72.50 71.17 1sr3 s THR 39 CO 0.10 0.00 2.01 -0.81 -0.54 0.00 0.00 174.62 175.38 1sr3 n PRO 40 N -0.48 2.00 0.00 3.99 -0.04 -1.26 -2.10 135.00 137.12 1sr3 n PRO 40 Ca 0.00 -2.19 0.00 0.00 -0.04 0.00 0.00 63.50 61.27 1sr3 n PRO 40 Cb 0.66 -3.12 0.00 0.00 -0.04 0.00 0.00 33.50 31.00 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 4.54 -1.65 0.00 0.55 0.00 -1.26 -2.27 105.19 105.10 1sr3 n GLY 41 Ca 0.50 0.58 0.09 0.00 0.00 0.00 0.00 46.02 47.19 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 0.00 0.36 -0.03 1.61 -0.58 -0.89 -1.44 120.64 119.67 1sr3 n GLU 42 Ca 0.00 0.08 -0.21 0.00 -0.42 0.00 0.00 57.16 56.60 1sr3 n GLU 42 Cb 0.00 -1.50 -0.13 0.00 -0.57 0.00 0.00 31.44 29.24 1sr3 n GLU 42 CO 0.00 0.00 0.00 -0.89 -0.48 0.00 0.00 177.13 175.76 1sr3 n ILE 43 N -1.19 1.71 0.01 -3.67 5.41 -1.13 -3.79 119.36 116.72 1sr3 n ILE 43 Ca 0.10 -0.54 -0.21 0.00 1.00 0.00 0.00 62.75 63.10 1sr3 n ILE 43 Cb 0.11 -1.76 -0.14 0.00 -0.71 0.00 0.00 39.64 37.15 1sr3 n ILE 43 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 1sr3 h LEU 44 N -0.15 0.39 -2.14 1.39 -0.00 -1.53 -3.37 115.31 109.90 1sr3 h LEU 44 Ca -0.44 -0.86 0.00 0.00 -0.00 0.00 0.00 57.88 56.58 1sr3 h LEU 44 Cb 1.89 -0.13 0.00 0.00 -0.00 0.00 0.00 40.66 42.42 1sr3 h LEU 44 CO 0.00 1.62 0.00 -1.22 -0.00 0.00 0.00 178.44 178.85 1sr3 n TYR 45 N -3.91 0.29 0.00 1.13 4.01 -0.54 -5.08 117.16 113.07 1sr3 n TYR 45 Ca -0.25 -0.17 0.00 0.00 -0.16 0.00 0.00 57.90 57.33 1sr3 n TYR 45 Cb 0.91 -0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.94 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 1.27 0.17 3.69 2.72 0.00 -1.26 -5.01 105.19 106.78 1sr3 n GLY 46 Ca 0.16 -1.77 -0.30 0.00 0.00 0.00 0.00 46.02 44.10 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 -2.40 1.16 0.22 1.61 2.47 -1.25 -4.23 119.74 117.32 1sr3 s LYS 47 Ca 0.00 1.04 0.12 0.00 -1.56 0.00 0.00 55.97 55.57 1sr3 s LYS 47 Cb 0.00 -1.78 0.66 0.00 -1.46 0.00 0.00 37.83 35.24 1sr3 s LYS 47 CO 0.00 -2.37 1.31 0.54 0.16 0.00 0.00 175.35 174.99 1sr3 n ARG 48 N -4.00 0.08 0.00 4.03 1.74 -1.26 -3.14 116.66 114.10 1sr3 n ARG 48 Ca 0.08 0.54 0.00 0.00 -0.77 0.00 0.00 57.85 57.70 1sr3 n ARG 48 Cb 0.54 -1.87 0.00 0.00 -1.02 0.00 0.00 32.46 30.11 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 -1.92 0.00 -0.84 5.56 1.02 -1.26 -5.04 120.64 118.17 1sr3 n GLU 49 Ca -0.01 0.00 -0.04 0.00 -0.02 0.00 0.00 57.16 57.09 1sr3 n GLU 49 Cb 0.13 0.00 -0.04 0.00 -0.02 0.00 0.00 31.44 31.51 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 -1.61 0.00 -0.10 2.62 5.66 -1.19 -5.01 114.28 114.64 1sr3 n THR 50 Ca 0.00 -0.03 -0.10 0.00 -3.05 0.00 0.00 64.05 60.87 1sr3 n THR 50 Cb 0.00 0.34 -0.03 0.00 -1.55 0.00 0.00 70.33 69.10 1sr3 n THR 50 CO 0.00 0.00 0.00 1.56 -3.05 0.00 0.00 175.07 173.58 1sr3 h GLN 51 N 0.03 0.51 0.00 1.09 4.20 -1.97 -3.47 115.11 115.50 1sr3 h GLN 51 Ca -0.36 -0.13 0.00 0.00 0.06 0.00 0.00 58.65 58.23 1sr3 h GLN 51 Cb 1.28 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 29.00 1sr3 h GLN 51 CO -0.17 0.58 0.00 0.00 -0.67 0.00 0.00 178.83 178.57 1sr3 n GLN 52 N -4.64 0.00 -1.60 1.46 0.00 -1.26 -5.06 117.38 106.27 1sr3 n GLN 52 Ca -0.02 0.00 -0.31 0.00 0.00 0.00 0.00 57.00 56.67 1sr3 n GLN 52 Cb 0.20 0.00 0.06 0.00 0.00 0.00 0.00 30.24 30.50 1sr3 n GLN 52 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.06 175.42 1sr3 s MET 53 N -1.53 2.65 0.63 2.61 -1.94 -1.26 -4.07 119.30 116.39 1sr3 s MET 53 Ca 0.00 0.79 -0.12 0.00 -1.71 0.00 0.00 55.69 54.65 1sr3 s MET 53 Cb 0.00 -1.97 -0.03 0.00 2.01 0.00 0.00 34.83 34.84 1sr3 s MET 53 CO 0.00 -1.26 1.04 -1.25 -0.01 0.00 0.00 175.02 173.54 1sr3 s PRO 54 N -5.12 3.37 0.59 2.03 0.04 -1.26 -5.06 135.00 129.59 1sr3 s PRO 54 Ca 0.59 0.90 -0.13 0.00 0.04 0.00 0.00 61.00 62.40 1sr3 s PRO 54 Cb -0.14 -2.05 -0.05 0.00 0.04 0.00 0.00 34.50 32.31 1sr3 s PRO 54 CO 0.54 -0.75 1.02 -2.00 0.04 0.00 0.00 177.00 175.85 1sr3 s GLU 55 N -4.86 3.63 0.00 4.56 2.12 -1.26 -4.99 118.70 117.90 1sr3 s GLU 55 Ca 0.58 0.87 0.26 0.00 0.36 0.00 0.00 54.97 57.04 1sr3 s GLU 55 Cb -0.13 -2.09 0.73 0.00 0.26 0.00 0.00 34.13 32.91 1sr3 s GLU 55 CO 0.50 -0.54 1.56 1.55 -0.54 0.00 0.00 175.26 177.79 1sr3 n VAL 56 N -2.34 0.02 -2.77 3.70 3.14 -1.26 -3.50 118.33 115.31 1sr3 n VAL 56 Ca 0.07 -0.35 -0.25 0.00 -2.96 0.00 0.00 64.34 60.85 1sr3 n VAL 56 Cb 0.54 0.85 -0.02 0.00 -1.06 0.00 0.00 33.84 34.15 1sr3 n VAL 56 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1sr3 n GLY 57 N 1.24 5.32 3.34 7.55 0.00 -1.26 -4.16 105.19 117.22 1sr3 n GLY 57 Ca 0.17 -2.59 -0.10 0.00 0.00 0.00 0.00 46.02 43.50 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 -3.39 1.28 -0.11 1.61 -2.07 -1.23 -5.02 119.66 110.73 1sr3 s GLN 58 Ca 0.46 -1.42 -0.20 0.00 -1.82 0.00 0.00 55.36 52.39 1sr3 s GLN 58 Cb 0.34 0.35 -0.04 0.00 -1.09 0.00 0.00 33.01 32.57 1sr3 s GLN 58 CO -0.14 -0.46 0.54 -0.98 -1.32 0.00 0.00 175.29 172.93 1sr3 s ARG 59 N -4.08 4.36 0.27 9.60 3.03 -1.26 -2.32 118.95 128.55 1sr3 s ARG 59 Ca 0.29 0.56 0.05 0.00 2.03 0.00 0.00 55.73 58.66 1sr3 s ARG 59 Cb 0.04 -3.45 -0.02 0.00 -1.03 0.00 0.00 34.95 30.50 1sr3 s ARG 59 CO 0.08 0.11 0.17 1.47 -1.13 0.00 0.00 175.30 176.00 1sr3 n LEU 60 N 3.78 0.00 -4.17 -1.89 -0.00 -1.16 -4.97 117.00 108.59 1sr3 n LEU 60 Ca -0.05 -2.31 -0.23 0.00 -0.00 0.00 0.00 56.01 53.41 1sr3 n LEU 60 Cb 0.51 1.04 -0.14 0.00 -0.00 0.00 0.00 43.42 44.83 1sr3 n LEU 60 CO 0.44 -0.37 -0.49 -0.13 -0.00 0.00 0.00 177.39 176.84 1sr3 s ARG 61 N -3.05 1.21 -0.10 1.47 0.52 -1.26 -2.65 118.95 115.09 1sr3 s ARG 61 Ca 0.24 -0.70 0.01 0.00 -0.52 0.00 0.00 55.73 54.75 1sr3 s ARG 61 Cb 0.01 -1.22 0.02 0.00 0.52 0.00 0.00 34.95 34.28 1sr3 s ARG 61 CO 0.17 0.32 -0.11 0.08 0.02 0.00 0.00 175.30 175.78 1sr3 s VAL 62 N -0.60 1.17 -0.10 3.52 1.01 -0.14 -0.62 120.40 124.64 1sr3 s VAL 62 Ca 0.05 -0.44 -0.01 0.00 0.00 0.00 0.00 61.98 61.59 1sr3 s VAL 62 Cb -0.07 -1.12 -0.03 0.00 0.00 0.00 0.00 36.38 35.16 1sr3 s VAL 62 CO 0.00 0.38 -0.06 -0.83 0.00 0.00 0.00 175.10 174.59 1sr3 s GLY 63 N 1.18 1.69 -0.07 4.51 0.00 -0.80 -0.31 107.32 113.52 1sr3 s GLY 63 Ca -0.04 -0.86 -0.31 0.00 0.00 0.00 0.00 44.72 43.50 1sr3 s GLY 63 CO -0.03 -0.41 1.37 -0.32 0.00 0.00 0.00 173.10 173.72 1sr3 s GLY 64 N -0.29 -0.35 -0.20 0.20 0.00 -1.02 -4.02 107.32 101.64 1sr3 s GLY 64 Ca 0.04 0.54 -0.14 0.00 0.00 0.00 0.00 44.72 45.16 1sr3 s GLY 64 CO 0.02 2.99 0.33 -0.29 0.00 0.00 0.00 173.10 176.16 1sr3 s MET 65 N -2.08 4.17 0.12 2.90 1.75 0.55 -1.27 119.30 125.44 1sr3 s MET 65 Ca 0.22 0.09 -0.31 0.00 -1.25 0.00 0.00 55.69 54.44 1sr3 s MET 65 Cb 0.04 -3.51 -0.09 0.00 2.84 0.00 0.00 34.83 34.10 1sr3 s MET 65 CO -0.04 0.04 1.64 0.08 -0.65 0.00 0.00 175.02 176.08 1sr3 s VAL 66 N 1.09 2.78 0.17 10.11 1.01 -0.70 -0.60 120.40 134.25 1sr3 s VAL 66 Ca 0.16 0.41 -0.32 0.00 0.00 0.00 0.00 61.98 62.24 1sr3 s VAL 66 Cb -0.14 -3.26 -0.11 0.00 0.00 0.00 0.00 36.38 32.86 1sr3 s VAL 66 CO 0.06 0.01 1.79 0.23 0.00 0.00 0.00 175.10 177.20 1sr3 n MET 67 N 4.87 2.81 -1.87 2.72 2.81 -0.10 -2.54 117.12 125.82 1sr3 n MET 67 Ca 0.15 1.02 -0.43 0.00 -1.81 0.00 0.00 57.70 56.63 1sr3 n MET 67 Cb 0.39 -2.89 -0.03 0.00 -0.71 0.00 0.00 33.22 29.98 1sr3 n MET 67 CO 0.00 0.00 0.00 -1.25 1.51 0.00 0.00 175.97 176.23 1sr3 s PRO 68 N 2.00 3.60 0.00 0.03 0.04 -1.26 -1.67 135.00 137.74 1sr3 s PRO 68 Ca 0.79 1.90 0.00 0.00 0.04 0.00 0.00 61.00 63.73 1sr3 s PRO 68 Cb -0.49 -4.18 0.00 0.00 0.04 0.00 0.00 34.50 29.88 1sr3 s PRO 68 CO 0.35 -1.55 0.00 0.41 0.04 0.00 0.00 177.00 176.25 1sr3 n GLY 69 N 5.07 2.31 0.27 0.56 0.00 -1.26 -4.98 105.19 107.16 1sr3 n GLY 69 Ca 0.23 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.42 1sr3 n GLY 69 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1sr3 h SER 70 N 0.00 0.00 -0.82 1.61 4.64 -1.68 -3.41 113.55 113.89 1sr3 h SER 70 Ca 0.00 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 60.78 1sr3 h SER 70 Cb 0.00 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.02 1sr3 h SER 70 CO 0.00 0.00 1.64 -0.69 -0.87 0.00 0.00 176.83 176.91 1sr3 s VAL 71 N -3.68 3.88 0.07 0.95 1.01 -1.26 -4.17 120.40 117.19 1sr3 s VAL 71 Ca 0.01 -1.26 -0.35 0.00 0.00 0.00 0.00 61.98 60.38 1sr3 s VAL 71 Cb 0.09 -4.90 -0.20 0.00 0.00 0.00 0.00 36.38 31.37 1sr3 s VAL 71 CO 0.52 -1.67 1.60 1.56 0.00 0.00 0.00 175.10 177.11 1sr3 h GLN 72 N 8.97 -1.08 -2.85 2.72 4.20 -1.30 -3.48 115.11 122.29 1sr3 h GLN 72 Ca 0.30 0.07 0.00 0.00 0.06 0.00 0.00 58.65 59.09 1sr3 h GLN 72 Cb 0.93 0.25 0.00 0.00 0.30 0.00 0.00 27.48 28.96 1sr3 h GLN 72 CO 1.38 -0.72 -0.66 0.54 -0.67 0.00 0.00 178.83 178.70 1sr3 n ARG 73 N -5.57 -3.61 -2.09 1.46 1.74 -1.26 -4.88 116.66 102.45 1sr3 n ARG 73 Ca -0.15 2.61 -0.43 0.00 -0.77 0.00 0.00 57.85 59.12 1sr3 n ARG 73 Cb 0.45 -2.86 -0.03 0.00 -1.02 0.00 0.00 32.46 29.00 1sr3 n ARG 73 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1sr3 s ASP 74 N -1.61 6.54 0.25 0.55 -1.08 -0.11 -4.88 116.67 116.33 1sr3 s ASP 74 Ca 0.00 1.90 0.18 0.00 -0.52 0.00 0.00 52.55 54.11 1sr3 s ASP 74 Cb 0.00 -2.53 0.93 0.00 -1.46 0.00 0.00 42.92 39.86 1sr3 s ASP 74 CO 0.00 -1.08 1.55 -0.81 0.52 0.00 0.00 175.17 175.35 1sr3 n PRO 75 N 7.35 0.12 -0.00 4.34 -0.04 -1.26 -1.97 135.00 143.54 1sr3 n PRO 75 Ca 0.18 0.57 0.06 0.00 -0.04 0.00 0.00 63.50 64.27 1sr3 n PRO 75 Cb 0.44 -1.86 -0.07 0.00 -0.04 0.00 0.00 33.50 31.97 1sr3 n PRO 75 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1sr3 n ASN 76 N -2.10 0.62 0.00 3.54 3.02 -1.26 -5.05 115.26 114.02 1sr3 n ASN 76 Ca -0.00 -0.79 0.00 0.00 -0.03 0.00 0.00 54.58 53.75 1sr3 n ASN 76 Cb 0.06 1.01 0.00 0.00 -0.61 0.00 0.00 39.78 40.24 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 -1.31 0.24 0.00 6.41 2.88 -0.83 -5.05 113.62 115.95 1sr3 n SER 77 Ca 0.02 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.56 1sr3 n SER 77 Cb 0.20 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.66 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 0.96 -4.69 2.46 4.32 -1.26 -4.66 117.00 114.12 1sr3 n LEU 78 Ca 0.00 -0.96 -0.42 0.00 -0.02 0.00 0.00 56.01 54.61 1sr3 n LEU 78 Cb 0.00 0.00 -0.00 0.00 -1.62 0.00 0.00 43.42 41.80 1sr3 n LEU 78 CO 0.00 0.24 0.86 1.17 -1.22 0.00 0.00 177.39 178.44 1sr3 n LYS 79 N -0.19 2.00 -4.34 3.23 3.00 -1.26 -0.59 118.16 120.01 1sr3 n LYS 79 Ca 0.00 0.70 -0.21 0.00 -0.00 0.00 0.00 58.31 58.81 1sr3 n LYS 79 Cb 0.26 -2.29 -0.11 0.00 0.00 0.00 0.00 35.03 32.89 1sr3 n LYS 79 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 1sr3 s VAL 80 N -1.12 1.82 -0.00 3.15 1.01 -0.21 -0.94 120.40 124.11 1sr3 s VAL 80 Ca 0.57 -2.02 0.06 0.00 0.00 0.00 0.00 61.98 60.59 1sr3 s VAL 80 Cb -0.56 -1.91 -0.02 0.00 0.00 0.00 0.00 36.38 33.89 1sr3 s VAL 80 CO 0.61 -0.40 -0.18 0.42 0.00 0.00 0.00 175.10 175.55 1sr3 s THR 81 N -2.32 1.42 0.22 3.92 -4.23 -1.26 -1.47 115.64 111.92 1sr3 s THR 81 Ca 0.18 -0.83 -0.04 0.00 -1.18 0.00 0.00 61.69 59.82 1sr3 s THR 81 Cb -0.04 -1.19 -0.03 0.00 1.34 0.00 0.00 72.50 72.58 1sr3 s THR 81 CO 0.07 0.34 0.25 0.72 -0.54 0.00 0.00 174.62 175.46 1sr3 s PHE 82 N -0.50 0.95 0.01 3.99 -0.71 -0.66 -0.97 117.98 120.10 1sr3 s PHE 82 Ca 0.07 -1.20 0.04 0.00 -1.04 0.00 0.00 56.93 54.80 1sr3 s PHE 82 Cb -0.07 -0.33 -0.03 0.00 -1.21 0.00 0.00 43.02 41.37 1sr3 s PHE 82 CO -0.00 -0.77 -0.10 0.99 -1.34 0.00 0.00 175.22 174.00 1sr3 s THR 83 N -4.06 3.39 0.02 -4.49 2.01 -1.26 -0.95 115.64 110.31 1sr3 s THR 83 Ca 0.34 -0.90 0.08 0.00 0.31 0.00 0.00 61.69 61.53 1sr3 s THR 83 Cb 0.04 -2.46 -0.02 0.00 0.01 0.00 0.00 72.50 70.07 1sr3 s THR 83 CO 0.12 0.38 -0.25 0.27 -0.69 0.00 0.00 174.62 174.45 1sr3 s ILE 84 N -0.98 1.97 0.27 1.82 -4.36 -0.44 -0.93 121.20 118.56 1sr3 s ILE 84 Ca 0.16 -1.24 0.02 0.00 -0.26 0.00 0.00 60.65 59.34 1sr3 s ILE 84 Cb -0.11 -1.67 -0.04 0.00 1.25 0.00 0.00 42.46 41.89 1sr3 s ILE 84 CO 0.07 0.39 0.16 -0.72 0.24 0.00 0.00 174.94 175.08 1sr3 s TYR 85 N -0.73 1.50 0.00 1.37 1.13 0.23 -0.74 117.35 120.11 1sr3 s TYR 85 Ca 0.10 -1.40 0.00 0.00 -1.41 0.00 0.00 57.07 54.36 1sr3 s TYR 85 Cb -0.10 -0.76 0.00 0.00 -1.10 0.00 0.00 41.96 40.01 1sr3 s TYR 85 CO 0.01 -0.59 0.00 -3.47 -2.51 0.00 0.00 175.55 168.99 1sr3 n ASP 86 N -0.79 0.00 -0.18 -0.18 -0.08 -0.98 -0.33 116.55 114.00 1sr3 n ASP 86 Ca 0.02 -0.25 0.00 0.00 -1.51 0.00 0.00 54.79 53.05 1sr3 n ASP 86 Cb 0.65 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.11 1sr3 n ASP 86 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1sr3 n ALA 87 N -3.00 1.62 -0.65 -1.67 0.00 -1.26 -3.95 120.51 111.60 1sr3 n ALA 87 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1sr3 n ALA 87 Cb 0.00 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.45 1sr3 n ALA 87 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1sr3 n GLU 88 N -0.18 0.00 0.00 0.00 -0.58 -1.26 -5.15 120.64 113.47 1sr3 n GLU 88 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 1sr3 n GLU 88 Cb 0.02 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 30.89 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 3.01 4.53 3.34 0.62 0.00 -0.96 -4.99 105.19 110.74 1sr3 n GLY 89 Ca 0.00 -0.89 -0.10 0.00 0.00 0.00 0.00 46.02 45.03 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 1.43 0.07 0.07 1.61 1.04 -1.23 -2.32 113.70 114.37 1sr3 s SER 90 Ca 0.00 -1.01 -0.09 0.00 0.48 0.00 0.00 55.95 55.33 1sr3 s SER 90 Cb 0.00 0.44 -0.00 0.00 0.10 0.00 0.00 66.02 66.56 1sr3 s SER 90 CO 0.00 -0.91 0.18 0.54 0.98 0.00 0.00 173.24 174.04 1sr3 s VAL 91 N -4.02 0.13 0.19 5.02 0.11 0.08 -4.75 120.40 117.16 1sr3 s VAL 91 Ca 0.23 -1.08 -0.06 0.00 -2.93 0.00 0.00 61.98 58.14 1sr3 s VAL 91 Cb 0.04 -1.17 -0.06 0.00 -1.53 0.00 0.00 36.38 33.66 1sr3 s VAL 91 CO 0.04 -0.60 0.45 -1.81 -3.33 0.00 0.00 175.10 169.85 1sr3 s ASP 92 N -2.54 6.51 -0.26 3.54 1.11 -1.04 -1.32 116.67 122.66 1sr3 s ASP 92 Ca 0.01 0.67 -0.03 0.00 0.18 0.00 0.00 52.55 53.38 1sr3 s ASP 92 Cb 0.03 -2.12 0.10 0.00 1.07 0.00 0.00 42.92 41.99 1sr3 s ASP 92 CO -0.08 -0.02 0.18 -0.69 1.18 0.00 0.00 175.17 175.73 1sr3 s VAL 93 N -1.78 -0.19 -0.19 -1.27 1.01 -0.12 -0.73 120.40 117.12 1sr3 s VAL 93 Ca 0.43 -0.49 -0.29 0.00 0.00 0.00 0.00 61.98 61.63 1sr3 s VAL 93 Cb -0.12 -0.86 -0.00 0.00 0.00 0.00 0.00 36.38 35.40 1sr3 s VAL 93 CO 0.25 -0.51 1.11 -0.44 0.00 0.00 0.00 175.10 175.51 1sr3 s SER 94 N 2.21 7.07 0.43 3.32 0.01 -0.79 -1.65 113.70 124.30 1sr3 s SER 94 Ca 0.08 1.50 0.06 0.00 1.31 0.00 0.00 55.95 58.90 1sr3 s SER 94 Cb -0.15 -2.54 -0.05 0.00 0.21 0.00 0.00 66.02 63.48 1sr3 s SER 94 CO -0.27 -0.67 0.12 -0.47 0.41 0.00 0.00 173.24 172.35 1sr3 s TYR 95 N 3.15 2.43 -0.28 2.43 5.04 -0.54 -0.23 117.35 129.35 1sr3 s TYR 95 Ca 0.48 -0.67 -0.04 0.00 -2.44 0.00 0.00 57.07 54.40 1sr3 s TYR 95 Cb -0.18 -1.86 0.10 0.00 0.35 0.00 0.00 41.96 40.38 1sr3 s TYR 95 CO 0.10 0.24 0.14 -2.00 -1.34 0.00 0.00 175.55 172.69 1sr3 s GLU 96 N -3.86 0.19 0.00 4.97 2.12 -1.26 -1.05 118.70 119.81 1sr3 s GLU 96 Ca 0.34 -0.43 0.00 0.00 0.36 0.00 0.00 54.97 55.25 1sr3 s GLU 96 Cb 0.05 -1.18 0.00 0.00 0.26 0.00 0.00 34.13 33.27 1sr3 s GLU 96 CO 0.19 -0.98 0.00 0.41 -0.54 0.00 0.00 175.26 174.34 1sr3 n GLY 97 N 5.26 1.86 0.18 -1.50 0.00 0.24 -4.90 105.19 106.33 1sr3 n GLY 97 Ca -0.06 -1.06 0.05 0.00 0.00 0.00 0.00 46.02 44.95 1sr3 n GLY 97 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1sr3 h ILE 98 N 0.87 0.88 0.00 -0.61 6.09 -1.98 -3.45 117.51 119.31 1sr3 h ILE 98 Ca 0.00 -1.67 0.00 0.00 -1.37 0.00 0.00 64.86 61.82 1sr3 h ILE 98 Cb 0.00 2.03 0.00 0.00 0.47 0.00 0.00 36.82 39.32 1sr3 h ILE 98 CO 0.00 0.39 0.00 0.18 -3.07 0.00 0.00 178.15 175.65 1sr3 n LEU 99 N -3.46 0.00 -4.68 2.19 4.77 -1.26 -4.95 117.00 109.61 1sr3 n LEU 99 Ca 0.00 0.00 -0.41 0.00 -0.03 0.00 0.00 56.01 55.58 1sr3 n LEU 99 Cb 0.55 0.22 0.02 0.00 -2.33 0.00 0.00 43.42 41.88 1sr3 n LEU 99 CO 0.37 0.00 0.81 -2.65 -1.33 0.00 0.00 177.39 174.59 1sr3 n PRO 100 N -0.39 1.72 -0.15 3.23 -0.02 -1.26 -4.89 135.00 133.23 1sr3 n PRO 100 Ca 0.00 0.62 -0.01 0.00 -2.02 0.00 0.00 63.50 62.08 1sr3 n PRO 100 Cb 0.00 -2.32 0.22 0.00 -0.02 0.00 0.00 33.50 31.39 1sr3 n PRO 100 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 1sr3 h ASP 101 N 1.81 0.79 0.14 2.55 3.58 -2.01 -2.21 116.42 121.07 1sr3 h ASP 101 Ca -0.47 -0.09 -0.00 0.00 0.42 0.00 0.00 57.03 56.89 1sr3 h ASP 101 Cb 1.31 -0.20 -0.00 0.00 1.72 0.00 0.00 39.33 42.16 1sr3 h ASP 101 CO 0.58 0.69 -0.00 -0.07 -2.88 0.00 0.00 179.24 177.56 1sr3 h LEU 102 N 0.87 0.00 -9.45 2.28 4.07 -1.97 -3.43 115.31 107.68 1sr3 h LEU 102 Ca 0.21 0.00 -0.53 0.00 0.08 0.00 0.00 57.88 57.64 1sr3 h LEU 102 Cb 0.13 0.00 0.02 0.00 1.08 0.00 0.00 40.66 41.89 1sr3 h LEU 102 CO -0.02 0.00 1.01 0.12 -1.08 0.00 0.00 178.44 178.47 1sr3 s PHE 103 N -4.10 2.39 0.20 1.13 2.19 -0.83 -4.96 117.98 114.01 1sr3 s PHE 103 Ca -0.04 0.29 0.07 0.00 0.33 0.00 0.00 56.93 57.58 1sr3 s PHE 103 Cb 0.12 -3.98 -0.05 0.00 -1.31 0.00 0.00 43.02 37.80 1sr3 s PHE 103 CO 0.43 -3.96 -0.14 1.03 1.83 0.00 0.00 175.22 174.42 1sr3 s ARG 104 N 2.66 1.32 -0.61 10.12 1.81 -1.26 -4.95 118.95 128.03 1sr3 s ARG 104 Ca 0.75 -1.59 -0.27 0.00 -1.72 0.00 0.00 55.73 52.89 1sr3 s ARG 104 Cb -0.40 -1.08 0.03 0.00 -0.45 0.00 0.00 34.95 33.05 1sr3 s ARG 104 CO 0.33 0.17 1.16 -1.21 -0.68 0.00 0.00 175.30 175.07 1sr3 s GLU 105 N -3.66 3.42 0.00 3.54 2.02 -1.26 -3.66 118.70 119.09 1sr3 s GLU 105 Ca 0.22 0.05 0.00 0.00 0.02 0.00 0.00 54.97 55.26 1sr3 s GLU 105 Cb -0.00 -4.06 0.00 0.00 0.10 0.00 0.00 34.13 30.17 1sr3 s GLU 105 CO 0.07 -1.74 0.00 0.41 0.02 0.00 0.00 175.26 174.02 1sr3 n GLY 106 N 5.13 1.63 3.35 -1.39 0.00 -1.05 -4.78 105.19 108.08 1sr3 n GLY 106 Ca 0.06 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.90 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 0.00 1.41 0.30 1.61 -2.07 -1.24 -4.90 119.66 114.77 1sr3 s GLN 107 Ca 0.00 -1.73 -0.29 0.00 -1.82 0.00 0.00 55.36 51.52 1sr3 s GLN 107 Cb 0.00 -0.63 -0.10 0.00 -1.09 0.00 0.00 33.01 31.20 1sr3 s GLN 107 CO 0.00 -0.14 1.17 0.20 -1.32 0.00 0.00 175.29 175.21 1sr3 s GLY 108 N -3.34 3.04 0.23 2.60 0.00 -1.26 -1.73 107.32 106.87 1sr3 s GLY 108 Ca 0.31 1.03 0.00 0.00 0.00 0.00 0.00 44.72 46.06 1sr3 s GLY 108 CO 0.11 1.65 0.11 -1.34 0.00 0.00 0.00 173.10 173.63 1sr3 s VAL 109 N -1.14 0.31 -0.24 1.40 -7.23 -0.40 -4.50 120.40 108.59 1sr3 s VAL 109 Ca 0.46 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.64 1sr3 s VAL 109 Cb -0.35 -2.58 0.06 0.00 0.56 0.00 0.00 36.38 34.08 1sr3 s VAL 109 CO 0.45 0.00 -0.04 -0.69 -0.31 0.00 0.00 175.10 174.51 1sr3 s VAL 110 N -3.93 1.56 0.56 1.32 1.01 0.19 -2.44 120.40 118.67 1sr3 s VAL 110 Ca 0.38 -1.30 -0.12 0.00 0.00 0.00 0.00 61.98 60.94 1sr3 s VAL 110 Cb 0.07 -1.85 -0.05 0.00 0.00 0.00 0.00 36.38 34.55 1sr3 s VAL 110 CO 0.13 -0.15 0.97 -0.69 0.00 0.00 0.00 175.10 175.36 1sr3 s VAL 111 N 1.37 4.69 0.00 2.92 1.01 0.58 -0.72 120.40 130.25 1sr3 s VAL 111 Ca -0.04 0.88 -0.20 0.00 0.00 0.00 0.00 61.98 62.62 1sr3 s VAL 111 Cb -0.19 -3.82 0.04 0.00 0.00 0.00 0.00 36.38 32.41 1sr3 s VAL 111 CO -0.07 -0.95 0.43 -1.58 0.00 0.00 0.00 175.10 172.92 1sr3 s GLN 112 N -4.75 0.86 0.00 2.72 0.74 -1.26 -0.97 119.66 117.00 1sr3 s GLN 112 Ca 0.55 -0.18 0.00 0.00 0.05 0.00 0.00 55.36 55.78 1sr3 s GLN 112 Cb -0.11 0.39 0.00 0.00 1.10 0.00 0.00 33.01 34.39 1sr3 s GLN 112 CO 0.46 -0.27 0.00 0.41 -0.55 0.00 0.00 175.29 175.33 1sr3 n GLY 113 N 0.86 -0.66 3.28 2.59 0.00 -1.08 0.17 105.19 110.34 1sr3 n GLY 113 Ca -0.20 0.21 -0.15 0.00 0.00 0.00 0.00 46.02 45.88 1sr3 n GLY 113 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1sr3 s GLU 114 N 0.00 1.14 0.33 1.61 2.56 -0.02 -2.98 118.70 121.34 1sr3 s GLU 114 Ca 0.00 -1.50 -0.27 0.00 0.00 0.00 0.00 54.97 53.20 1sr3 s GLU 114 Cb 0.00 -0.70 -0.09 0.00 2.00 0.00 0.00 34.13 35.34 1sr3 s GLU 114 CO 0.00 0.07 1.08 -1.17 -0.56 0.00 0.00 175.26 174.67 1sr3 s LEU 115 N -3.21 4.37 0.00 2.70 0.20 -0.98 -0.66 118.68 121.11 1sr3 s LEU 115 Ca 0.19 2.17 0.00 0.00 0.69 0.00 0.00 54.13 57.18 1sr3 s LEU 115 Cb 0.03 -3.87 0.00 0.00 -0.43 0.00 0.00 46.19 41.92 1sr3 s LEU 115 CO 0.03 -0.30 0.00 1.21 -0.29 0.00 0.00 176.35 177.00 1sr3 n GLU 116 N 0.64 0.00 -3.56 1.98 2.13 0.84 -4.55 120.64 118.12 1sr3 n GLU 116 Ca 0.02 0.00 -0.07 0.00 0.66 0.00 0.00 57.16 57.77 1sr3 n GLU 116 Cb 0.47 -0.00 -0.03 0.00 0.27 0.00 0.00 31.44 32.15 1sr3 n GLU 116 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 1sr3 s LYS 117 N 0.00 0.53 -1.28 5.31 -0.14 -1.25 -4.75 119.74 118.16 1sr3 s LYS 117 Ca 0.00 -0.12 0.00 0.00 -1.36 0.00 0.00 55.97 54.49 1sr3 s LYS 117 Cb 0.00 0.24 0.00 0.00 -1.68 0.00 0.00 37.83 36.39 1sr3 s LYS 117 CO 0.00 -0.22 0.00 0.41 -0.76 0.00 0.00 175.35 174.78 1sr3 n GLY 118 N 0.06 0.53 3.08 -3.33 0.00 -1.26 -2.99 105.19 101.28 1sr3 n GLY 118 Ca -0.05 -0.35 -0.03 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.40 -7.63 -3.82 1.61 5.03 -1.26 -4.94 115.26 103.84 1sr3 n ASN 119 Ca -0.15 -0.04 -0.13 0.00 0.87 0.00 0.00 54.58 55.13 1sr3 n ASN 119 Cb 0.54 -5.08 -0.14 0.00 -1.02 0.00 0.00 39.78 34.08 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 -2.93 -0.04 -0.17 3.10 2.46 -1.16 -2.51 115.29 114.03 1sr3 s HIS 120 Ca 0.04 0.16 -0.06 0.00 0.47 0.00 0.00 55.06 55.67 1sr3 s HIS 120 Cb -0.01 -0.06 -0.04 0.00 -0.13 0.00 0.00 32.58 32.35 1sr3 s HIS 120 CO 0.76 -0.06 0.02 0.42 -2.47 0.00 0.00 174.74 173.42 1sr3 s ILE 121 N 0.41 4.46 -0.43 0.89 -1.09 0.09 -0.11 121.20 125.42 1sr3 s ILE 121 Ca -0.03 -0.15 -0.29 0.00 -2.23 0.00 0.00 60.65 57.94 1sr3 s ILE 121 Cb -0.05 -2.99 0.02 0.00 -1.58 0.00 0.00 42.46 37.87 1sr3 s ILE 121 CO -0.01 0.48 1.19 -0.76 -1.23 0.00 0.00 174.94 174.60 1sr3 s LEU 122 N 0.33 3.69 0.12 2.97 2.01 0.17 -1.88 118.68 126.09 1sr3 s LEU 122 Ca 0.01 0.68 -0.30 0.00 0.01 0.00 0.00 54.13 54.53 1sr3 s LEU 122 Cb -0.13 -3.55 -0.06 0.00 0.01 0.00 0.00 46.19 42.46 1sr3 s LEU 122 CO 0.01 -1.21 1.01 0.00 1.01 0.00 0.00 176.35 177.17 1sr3 s ALA 123 N 4.48 3.28 -0.04 4.21 0.00 0.68 -0.84 121.76 133.53 1sr3 s ALA 123 Ca 0.50 0.65 0.08 0.00 0.00 0.00 0.00 51.96 53.19 1sr3 s ALA 123 Cb -0.10 -3.31 -0.11 0.00 0.00 0.00 0.00 23.12 19.60 1sr3 s ALA 123 CO 0.29 -0.11 0.11 0.36 0.00 0.00 0.00 175.76 176.41 1sr3 n LYS 124 N 2.80 1.41 0.00 0.00 -0.00 0.13 -4.39 118.16 118.11 1sr3 n LYS 124 Ca 0.03 -0.04 0.00 0.00 -0.00 0.00 0.00 58.31 58.30 1sr3 n LYS 124 Cb 0.48 -1.19 0.00 0.00 -0.00 0.00 0.00 35.03 34.32 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 -2.01 0.00 -1.83 -1.58 0.28 -1.25 -4.98 120.64 109.27 1sr3 n GLU 125 Ca -0.07 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.93 1sr3 n GLU 125 Cb 0.46 -0.11 0.00 0.00 1.43 0.00 0.00 31.44 33.22 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 -2.25 -5.89 -4.20 3.84 0.31 -1.26 -4.88 118.33 103.99 1sr3 n VAL 126 Ca 0.00 2.62 -0.13 0.00 -0.01 0.00 0.00 64.34 66.82 1sr3 n VAL 126 Cb 0.00 -3.47 -0.10 0.00 -0.91 0.00 0.00 33.84 29.36 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 -1.94 2.50 -0.46 7.52 1.43 0.10 -4.70 118.68 123.12 1sr3 s LEU 127 Ca 0.00 -0.97 0.08 0.00 -1.03 0.00 0.00 54.13 52.21 1sr3 s LEU 127 Cb 0.00 -0.21 0.39 0.00 0.03 0.00 0.00 46.19 46.40 1sr3 s LEU 127 CO 0.00 -0.38 0.97 0.00 0.23 0.00 0.00 176.35 177.17 1sr3 n ALA 128 N 0.03 4.22 -0.93 4.21 0.00 -1.26 -0.64 120.51 126.15 1sr3 n ALA 128 Ca -0.12 -4.14 -0.06 0.00 0.00 0.00 0.00 53.44 49.12 1sr3 n ALA 128 Cb 0.60 -0.73 -0.02 0.00 0.00 0.00 0.00 19.45 19.30 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 -0.22 -1.60 -1.09 0.00 4.76 -1.26 -4.82 118.16 113.93 1sr3 n LYS 129 Ca 0.30 0.45 -0.32 0.00 -2.87 0.00 0.00 58.31 55.87 1sr3 n LYS 129 Cb 0.59 -4.33 -0.03 0.00 -1.84 0.00 0.00 35.03 29.42 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 -1.38 2.00 -1.80 2.13 1.44 -1.26 -4.52 115.22 111.83 1sr3 n HIS 130 Ca -0.06 -2.66 -0.16 0.00 -2.01 0.00 0.00 57.72 52.83 1sr3 n HIS 130 Cb 0.31 -2.18 -0.05 0.00 0.12 0.00 0.00 29.99 28.19 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 3.81 -4.95 -4.63 4.39 -0.08 -1.26 -4.94 116.55 108.88 1sr3 n ASP 131 Ca 0.66 0.24 -0.43 0.00 -1.51 0.00 0.00 54.79 53.75 1sr3 n ASP 131 Cb 0.20 -3.96 -0.02 0.00 2.34 0.00 0.00 41.12 39.67 1sr3 n ASP 131 CO 0.00 0.00 0.00 -1.61 0.12 0.00 0.00 177.20 175.71 1sr3 s GLU 132 N -3.95 4.04 0.00 -0.67 0.41 -1.26 -4.81 118.70 112.46 1sr3 s GLU 132 Ca 0.00 1.02 0.00 0.00 -0.41 0.00 0.00 54.97 55.58 1sr3 s GLU 132 Cb 0.00 -3.75 0.00 0.00 -1.78 0.00 0.00 34.13 28.60 1sr3 s GLU 132 CO 0.00 -0.92 0.00 -1.71 -0.49 0.00 0.00 175.26 172.14 1sr3 n ASN 133 N 6.89 0.40 -3.49 -0.19 5.15 -1.26 -5.01 115.26 117.74 1sr3 n ASN 133 Ca 0.12 0.00 -0.16 0.00 -0.60 0.00 0.00 54.58 53.93 1sr3 n ASN 133 Cb 0.47 0.00 -0.12 0.00 -0.53 0.00 0.00 39.78 39.60 1sr3 n ASN 133 CO 0.00 0.00 0.00 -0.47 1.40 0.00 0.00 177.26 178.19 1sr3 s TYR 134 N -1.62 -0.37 -0.15 1.20 6.14 -1.26 -5.14 117.35 116.14 1sr3 s TYR 134 Ca 0.00 0.40 -0.14 0.00 0.64 0.00 0.00 57.07 57.97 1sr3 s TYR 134 Cb 0.00 -0.27 -0.05 0.00 0.42 0.00 0.00 41.96 42.06 1sr3 s TYR 134 CO 0.00 -0.59 0.30 0.99 0.64 0.00 0.00 175.55 176.89 1sr3 s THR 135 N 2.37 5.29 1.35 4.34 2.01 -1.26 -5.10 115.64 124.64 1sr3 s THR 135 Ca 0.07 0.57 -0.22 0.00 0.31 0.00 0.00 61.69 62.43 1sr3 s THR 135 Cb -0.15 -3.64 0.34 0.00 0.01 0.00 0.00 72.50 69.06 1sr3 s THR 135 CO -0.12 0.40 0.99 -2.84 -0.69 0.00 0.00 174.62 172.36 1sr3 s PRO 136 N 0.34 -2.37 0.45 4.92 0.02 -1.26 -5.06 135.00 132.04 1sr3 s PRO 136 Ca 0.17 0.07 -0.08 0.00 0.02 0.00 0.00 61.00 61.19 1sr3 s PRO 136 Cb -0.13 -1.45 0.11 0.00 0.02 0.00 0.00 34.50 33.05 1sr3 s PRO 136 CO 0.05 -4.49 0.52 -0.35 -0.33 0.00 0.00 177.00 172.39 1sr3 n PRO 137 N -5.35 -1.05 -3.83 5.54 -0.04 -1.26 -4.53 135.00 124.49 1sr3 n PRO 137 Ca 0.13 -0.81 -0.31 0.00 -0.04 0.00 0.00 63.50 62.47 1sr3 n PRO 137 Cb 0.60 -0.61 0.02 0.00 -0.04 0.00 0.00 33.50 33.46 1sr3 n PRO 137 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1sr3 n GLU 138 N -2.45 -1.95 0.00 0.54 1.02 -1.26 -4.77 120.64 111.77 1sr3 n GLU 138 Ca 0.07 0.40 0.00 0.00 -0.02 0.00 0.00 57.16 57.61 1sr3 n GLU 138 Cb 0.24 -4.13 0.00 0.00 -0.02 0.00 0.00 31.44 27.54 1sr3 n GLU 138 CO 0.00 0.00 0.00 1.55 1.18 0.00 0.00 177.13 179.86 1sr3 n VAL 139 N -4.36 0.00 0.05 2.62 3.14 -1.26 -4.54 118.33 113.98 1sr3 n VAL 139 Ca -0.18 0.00 -0.12 0.00 -2.96 0.00 0.00 64.34 61.08 1sr3 n VAL 139 Cb 0.63 0.00 -0.06 0.00 -1.06 0.00 0.00 33.84 33.35 1sr3 n VAL 139 CO 0.00 0.00 0.00 -0.08 -6.46 0.00 0.00 176.83 170.29 1sr3 h GLU 140 N 0.00 -0.49 -1.55 1.45 4.81 -1.86 -3.35 114.58 113.58 1sr3 h GLU 140 Ca 0.00 0.03 -0.30 0.00 -0.13 0.00 0.00 59.36 58.96 1sr3 h GLU 140 Cb 0.00 0.11 -0.25 0.00 0.63 0.00 0.00 28.75 29.24 1sr3 h GLU 140 CO 0.00 -0.33 -0.65 0.21 -0.73 0.00 0.00 179.01 177.51 1sr3 s LYS 141 N -5.95 0.91 0.00 1.92 2.36 -1.26 -4.97 119.74 112.74 1sr3 s LYS 141 Ca -0.16 -1.19 0.00 0.00 -2.55 0.00 0.00 55.97 52.08 1sr3 s LYS 141 Cb 0.09 -0.53 0.00 0.00 -1.05 0.00 0.00 37.83 36.34 1sr3 s LYS 141 CO 0.65 -1.30 0.00 0.00 1.55 0.00 0.00 175.35 176.25 1sr3 n ALA 142 N 3.39 0.00 1.63 3.13 0.00 -1.26 -5.01 120.51 122.39 1sr3 n ALA 142 Ca 0.19 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.76 1sr3 n ALA 142 Cb 0.52 0.00 0.78 0.00 0.00 0.00 0.00 19.45 20.74 1sr3 n ALA 142 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17