#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 0.15 -0.12 3.23 0.52 -1.26 -5.14 118.95 116.32 1sr3 s ARG 31 Ca 0.00 0.35 -0.04 0.00 -0.52 0.00 0.00 55.73 55.52 1sr3 s ARG 31 Cb 0.00 -0.08 0.06 0.00 0.52 0.00 0.00 34.95 35.46 1sr3 s ARG 31 CO 0.00 -0.12 0.22 -1.12 0.02 0.00 0.00 175.30 174.30 1sr3 s SER 32 N 0.82 0.67 0.16 0.23 0.01 -1.26 -5.16 113.70 109.18 1sr3 s SER 32 Ca -0.06 0.36 0.09 0.00 1.31 0.00 0.00 55.95 57.65 1sr3 s SER 32 Cb -0.08 0.49 -0.04 0.00 0.21 0.00 0.00 66.02 66.60 1sr3 s SER 32 CO -0.04 -0.26 -0.13 0.20 0.41 0.00 0.00 173.24 173.42 1sr3 s ASN 33 N 2.36 4.10 0.40 2.44 -0.87 -1.26 -5.07 114.94 117.04 1sr3 s ASN 33 Ca 0.03 -0.59 0.00 0.00 -1.57 0.00 0.00 52.86 50.73 1sr3 s ASN 33 Cb -0.13 -0.65 0.00 0.00 -0.02 0.00 0.00 41.25 40.46 1sr3 s ASN 33 CO -0.08 0.13 0.00 -0.38 -2.57 0.00 0.00 177.10 174.20 1sr3 n ILE 34 N 0.29 0.00 -1.57 0.60 5.41 -1.26 -4.86 119.36 117.97 1sr3 n ILE 34 Ca -0.12 0.33 -0.38 0.00 1.00 0.00 0.00 62.75 63.58 1sr3 n ILE 34 Cb 0.55 -0.76 0.04 0.00 -0.71 0.00 0.00 39.64 38.76 1sr3 n ILE 34 CO 0.00 0.00 0.00 0.47 0.00 0.00 0.00 176.55 177.02 1sr3 n ASP 35 N -4.04 0.32 -4.19 4.38 9.92 -1.26 -4.99 116.55 116.69 1sr3 n ASP 35 Ca -0.02 0.81 -0.30 0.00 -0.53 0.00 0.00 54.79 54.75 1sr3 n ASP 35 Cb 0.59 -1.32 0.18 0.00 -0.64 0.00 0.00 41.12 39.93 1sr3 n ASP 35 CO 0.00 0.00 0.00 -1.48 0.13 0.00 0.00 177.20 175.85 1sr3 s LEU 36 N -1.09 2.37 -0.05 0.64 0.05 -1.26 -5.10 118.68 114.23 1sr3 s LEU 36 Ca 0.72 0.40 -0.24 0.00 0.05 0.00 0.00 54.13 55.07 1sr3 s LEU 36 Cb -0.44 -2.46 0.05 0.00 -2.05 0.00 0.00 46.19 41.29 1sr3 s LEU 36 CO 0.50 -2.85 0.53 0.12 -0.55 0.00 0.00 176.35 174.10 1sr3 s PHE 37 N -3.70 -0.47 0.37 3.48 2.19 -1.26 -4.54 117.98 114.04 1sr3 s PHE 37 Ca 0.72 0.83 0.07 0.00 0.33 0.00 0.00 56.93 58.88 1sr3 s PHE 37 Cb -0.06 0.27 -0.03 0.00 -1.31 0.00 0.00 43.02 41.90 1sr3 s PHE 37 CO 0.53 -0.50 0.24 0.66 1.83 0.00 0.00 175.22 177.99 1sr3 n TYR 38 N 1.22 -0.49 -3.98 10.12 4.02 -0.30 -4.94 117.16 122.81 1sr3 n TYR 38 Ca -0.20 -2.82 -0.09 0.00 -0.01 0.00 0.00 57.90 54.79 1sr3 n TYR 38 Cb 0.57 0.19 -0.08 0.00 -0.02 0.00 0.00 39.34 40.00 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 -3.30 0.09 -1.13 -0.72 -4.23 -1.26 -2.08 115.64 103.00 1sr3 s THR 39 Ca 0.34 -1.45 -0.12 0.00 -1.18 0.00 0.00 61.69 59.28 1sr3 s THR 39 Cb 0.02 -1.79 -0.07 0.00 1.34 0.00 0.00 72.50 72.00 1sr3 s THR 39 CO 0.24 -0.39 2.27 -0.81 -0.54 0.00 0.00 174.62 175.39 1sr3 n PRO 40 N -0.16 2.42 0.00 3.99 -0.04 -1.25 -2.06 135.00 137.89 1sr3 n PRO 40 Ca -0.08 -1.92 0.00 0.00 -0.04 0.00 0.00 63.50 61.46 1sr3 n PRO 40 Cb 0.63 -2.79 0.00 0.00 -0.04 0.00 0.00 33.50 31.30 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 3.98 -0.09 0.00 0.55 0.00 -1.26 -1.23 105.19 107.14 1sr3 n GLY 41 Ca 0.54 0.01 0.12 0.00 0.00 0.00 0.00 46.02 46.70 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 -2.06 0.52 -0.05 1.61 4.71 -0.87 -0.07 120.64 124.42 1sr3 n GLU 42 Ca 0.00 0.03 -0.14 0.00 -0.01 0.00 0.00 57.16 57.05 1sr3 n GLU 42 Cb 0.00 -1.50 -0.14 0.00 -1.01 0.00 0.00 31.44 28.79 1sr3 n GLU 42 CO 0.00 0.00 0.00 -0.89 0.09 0.00 0.00 177.13 176.33 1sr3 n ILE 43 N -1.18 1.58 -0.07 -3.67 5.41 -0.98 -1.50 119.36 118.95 1sr3 n ILE 43 Ca 0.15 -0.74 -0.06 0.00 1.00 0.00 0.00 62.75 63.09 1sr3 n ILE 43 Cb 0.16 -1.13 -0.03 0.00 -0.71 0.00 0.00 39.64 37.92 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 0.02 0.00 0.00 1.39 4.07 -1.32 -3.39 115.31 116.08 1sr3 h LEU 44 Ca -0.44 -0.17 -0.20 0.00 0.08 0.00 0.00 57.88 57.15 1sr3 h LEU 44 Cb 2.06 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 43.77 1sr3 h LEU 44 CO 0.04 0.79 -1.21 1.88 -1.08 0.00 0.00 178.44 178.86 1sr3 h TYR 45 N -1.00 0.00 0.00 1.13 -1.99 -0.78 -3.51 116.97 110.83 1sr3 h TYR 45 Ca -0.05 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.68 1sr3 h TYR 45 Cb 0.49 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.22 1sr3 h TYR 45 CO -0.05 0.80 0.00 0.41 -0.00 0.00 0.00 178.16 179.32 1sr3 n GLY 46 N 1.40 3.08 3.65 3.88 0.00 -1.08 -5.00 105.19 111.11 1sr3 n GLY 46 Ca -0.07 -1.93 -0.55 0.00 0.00 0.00 0.00 46.02 43.46 1sr3 n GLY 46 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1sr3 n LYS 47 N -0.45 1.12 0.24 1.61 3.00 -0.56 -4.31 118.16 118.81 1sr3 n LYS 47 Ca 0.00 0.41 0.08 0.00 -0.00 0.00 0.00 58.31 58.79 1sr3 n LYS 47 Cb 0.00 -2.07 0.59 0.00 0.00 0.00 0.00 35.03 33.55 1sr3 n LYS 47 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.40 177.47 1sr3 h ARG 48 N 5.94 0.00 -0.16 1.64 0.11 -1.96 0.46 114.38 120.41 1sr3 h ARG 48 Ca -0.47 0.00 -0.14 0.00 0.10 0.00 0.00 59.98 59.47 1sr3 h ARG 48 Cb 1.33 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.40 1sr3 h ARG 48 CO 0.87 0.14 -0.52 0.93 0.10 0.00 0.00 179.97 181.50 1sr3 h GLU 49 N 0.00 0.44 0.00 0.08 4.39 -2.00 -3.42 114.58 114.06 1sr3 h GLU 49 Ca -0.00 -0.26 0.00 0.00 0.34 0.00 0.00 59.36 59.44 1sr3 h GLU 49 Cb 0.26 0.02 0.00 0.00 -0.10 0.00 0.00 28.75 28.94 1sr3 h GLU 49 CO 0.02 0.85 0.00 -2.37 -1.16 0.00 0.00 179.01 176.35 1sr3 n THR 50 N -3.96 0.00 -2.91 1.13 5.66 -0.98 -5.06 114.28 108.16 1sr3 n THR 50 Ca -0.02 0.00 -0.13 0.00 -3.05 0.00 0.00 64.05 60.84 1sr3 n THR 50 Cb 0.57 0.00 -0.01 0.00 -1.55 0.00 0.00 70.33 69.34 1sr3 n THR 50 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1sr3 n GLN 51 N 0.00 -2.66 0.00 1.09 0.00 0.16 -4.81 117.38 111.16 1sr3 n GLN 51 Ca 0.00 0.29 0.08 0.00 0.00 0.00 0.00 57.00 57.37 1sr3 n GLN 51 Cb 0.07 -4.88 0.41 0.00 0.00 0.00 0.00 30.24 25.84 1sr3 n GLN 51 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.06 178.10 1sr3 n GLN 52 N -3.04 0.27 -1.49 2.61 6.02 -1.26 -4.54 117.38 115.95 1sr3 n GLN 52 Ca -0.03 0.11 0.16 0.00 -0.01 0.00 0.00 57.00 57.23 1sr3 n GLN 52 Cb 0.54 -1.50 -0.09 0.00 1.02 0.00 0.00 30.24 30.21 1sr3 n GLN 52 CO 0.00 0.00 0.00 -1.33 -1.01 0.00 0.00 177.06 174.72 1sr3 n MET 53 N -1.23 -3.49 -1.68 -1.09 2.81 -1.26 -4.91 117.12 106.26 1sr3 n MET 53 Ca 0.08 2.85 -0.31 0.00 -1.81 0.00 0.00 57.70 58.51 1sr3 n MET 53 Cb 0.11 -4.00 0.05 0.00 -0.71 0.00 0.00 33.22 28.68 1sr3 n MET 53 CO 0.00 0.00 0.00 -1.25 1.51 0.00 0.00 175.97 176.23 1sr3 s PRO 54 N -4.49 2.80 0.49 0.03 0.04 -1.26 -4.96 135.00 127.64 1sr3 s PRO 54 Ca 0.00 0.73 -0.18 0.00 0.04 0.00 0.00 61.00 61.59 1sr3 s PRO 54 Cb 0.00 -1.99 -0.09 0.00 0.04 0.00 0.00 34.50 32.46 1sr3 s PRO 54 CO 0.00 -1.14 0.98 -1.21 0.04 0.00 0.00 177.00 175.67 1sr3 s GLU 55 N -5.16 4.01 0.00 4.56 2.02 -1.26 -4.99 118.70 117.88 1sr3 s GLU 55 Ca 0.58 1.04 0.27 0.00 0.02 0.00 0.00 54.97 56.88 1sr3 s GLU 55 Cb -0.13 -2.15 0.95 0.00 0.10 0.00 0.00 34.13 32.91 1sr3 s GLU 55 CO 0.54 -0.22 1.69 0.28 0.02 0.00 0.00 175.26 177.57 1sr3 n VAL 56 N -1.26 0.03 -3.13 2.63 0.31 -1.26 -3.58 118.33 112.07 1sr3 n VAL 56 Ca 0.07 -0.28 -0.22 0.00 -0.01 0.00 0.00 64.34 63.90 1sr3 n VAL 56 Cb 0.54 0.55 -0.04 0.00 -0.91 0.00 0.00 33.84 33.98 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 1.18 4.15 3.25 2.92 0.00 -1.26 -3.25 105.19 112.19 1sr3 n GLY 57 Ca 0.18 -2.04 -0.17 0.00 0.00 0.00 0.00 46.02 44.00 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 -2.59 1.57 -0.03 1.61 -2.07 -1.24 -4.99 119.66 111.92 1sr3 s GLN 58 Ca 0.42 -1.89 -0.18 0.00 -1.82 0.00 0.00 55.36 51.89 1sr3 s GLN 58 Cb 0.30 0.31 -0.05 0.00 -1.09 0.00 0.00 33.01 32.48 1sr3 s GLN 58 CO -0.10 -0.56 0.52 -0.98 -1.32 0.00 0.00 175.29 172.85 1sr3 s ARG 59 N -3.69 4.22 0.34 9.60 1.70 -1.26 -1.40 118.95 128.46 1sr3 s ARG 59 Ca 0.40 0.58 -0.16 0.00 -0.47 0.00 0.00 55.73 56.08 1sr3 s ARG 59 Cb 0.04 -3.33 0.04 0.00 -0.57 0.00 0.00 34.95 31.13 1sr3 s ARG 59 CO 0.22 0.41 0.72 -0.48 -1.08 0.00 0.00 175.30 175.10 1sr3 s LEU 60 N -0.27 0.03 0.09 -1.89 -0.00 0.00 -4.94 118.68 111.71 1sr3 s LEU 60 Ca 0.28 -1.01 0.08 0.00 -0.00 0.00 0.00 54.13 53.47 1sr3 s LEU 60 Cb -0.17 2.63 -0.04 0.00 -0.00 0.00 0.00 46.19 48.61 1sr3 s LEU 60 CO 0.15 -1.53 -0.14 -0.13 -0.00 0.00 0.00 176.35 174.70 1sr3 s ARG 61 N -2.94 2.01 -0.03 1.48 0.52 -1.26 -1.16 118.95 117.57 1sr3 s ARG 61 Ca 0.16 -1.06 0.02 0.00 -0.52 0.00 0.00 55.73 54.33 1sr3 s ARG 61 Cb -0.05 -2.23 0.01 0.00 0.52 0.00 0.00 34.95 33.20 1sr3 s ARG 61 CO 0.11 0.51 -0.08 0.08 0.02 0.00 0.00 175.30 175.93 1sr3 s VAL 62 N -1.14 0.74 -0.02 3.52 1.01 -0.20 -1.15 120.40 123.16 1sr3 s VAL 62 Ca 0.19 -0.32 0.01 0.00 0.00 0.00 0.00 61.98 61.86 1sr3 s VAL 62 Cb -0.11 -0.67 -0.03 0.00 0.00 0.00 0.00 36.38 35.57 1sr3 s VAL 62 CO 0.11 0.24 -0.01 -0.83 0.00 0.00 0.00 175.10 174.61 1sr3 s GLY 63 N 0.32 1.86 -0.10 4.51 0.00 -0.89 -0.27 107.32 112.76 1sr3 s GLY 63 Ca -0.05 -0.93 -0.33 0.00 0.00 0.00 0.00 44.72 43.41 1sr3 s GLY 63 CO 0.01 -0.77 1.36 -0.32 0.00 0.00 0.00 173.10 173.38 1sr3 s GLY 64 N -1.40 -0.42 -0.24 0.20 0.00 -0.84 -3.96 107.32 100.67 1sr3 s GLY 64 Ca 0.18 1.05 -0.17 0.00 0.00 0.00 0.00 44.72 45.78 1sr3 s GLY 64 CO 0.08 0.25 0.44 -0.29 0.00 0.00 0.00 173.10 173.58 1sr3 s MET 65 N -2.19 4.10 0.30 2.90 1.75 0.71 -0.53 119.30 126.33 1sr3 s MET 65 Ca 0.14 0.22 -0.29 0.00 -1.25 0.00 0.00 55.69 54.51 1sr3 s MET 65 Cb 0.05 -3.61 -0.10 0.00 2.84 0.00 0.00 34.83 34.01 1sr3 s MET 65 CO -0.05 -0.22 1.36 0.54 -0.65 0.00 0.00 175.02 176.00 1sr3 s VAL 66 N 1.90 2.69 0.47 10.11 0.11 -0.08 -0.51 120.40 135.09 1sr3 s VAL 66 Ca 0.19 0.65 -0.24 0.00 -2.93 0.00 0.00 61.98 59.65 1sr3 s VAL 66 Cb -0.15 -3.41 -0.07 0.00 -1.53 0.00 0.00 36.38 31.21 1sr3 s VAL 66 CO 0.09 0.13 1.36 -0.04 -3.33 0.00 0.00 175.10 173.32 1sr3 s MET 67 N -1.23 3.60 -1.58 1.54 -1.94 -0.51 -1.73 119.30 117.44 1sr3 s MET 67 Ca 0.53 2.27 -0.11 0.00 -1.71 0.00 0.00 55.69 56.67 1sr3 s MET 67 Cb -0.41 -2.55 -0.07 0.00 2.01 0.00 0.00 34.83 33.82 1sr3 s MET 67 CO 0.49 -0.84 2.83 -0.35 -0.01 0.00 0.00 175.02 177.14 1sr3 n PRO 68 N -0.38 3.52 0.00 2.03 -0.04 -1.26 -3.86 135.00 135.01 1sr3 n PRO 68 Ca 0.06 -2.24 0.00 0.00 -0.04 0.00 0.00 63.50 61.29 1sr3 n PRO 68 Cb 0.43 -2.86 0.00 0.00 -0.04 0.00 0.00 33.50 31.03 1sr3 n PRO 68 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1sr3 n GLY 69 N 3.67 -0.64 0.00 0.55 0.00 -1.26 -5.08 105.19 102.43 1sr3 n GLY 69 Ca 0.74 0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.78 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 0.00 0.00 -4.55 1.61 7.64 -1.25 -5.01 113.62 112.06 1sr3 n SER 70 Ca 0.00 0.00 -0.38 0.00 1.01 0.00 0.00 58.87 59.50 1sr3 n SER 70 Cb 0.00 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.17 1sr3 n SER 70 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1sr3 s VAL 71 N -0.37 3.31 -1.23 0.44 0.11 -1.26 -4.23 120.40 117.17 1sr3 s VAL 71 Ca 0.00 0.18 -0.17 0.00 -2.93 0.00 0.00 61.98 59.06 1sr3 s VAL 71 Cb 0.00 -3.82 0.10 0.00 -1.53 0.00 0.00 36.38 31.13 1sr3 s VAL 71 CO 0.00 -0.79 1.61 -1.10 -3.33 0.00 0.00 175.10 171.49 1sr3 s GLN 72 N 7.17 3.96 0.26 1.54 -0.21 0.20 -4.95 119.66 127.63 1sr3 s GLN 72 Ca 0.71 -2.05 -0.30 0.00 0.02 0.00 0.00 55.36 53.74 1sr3 s GLN 72 Cb -0.13 -5.37 -0.09 0.00 1.00 0.00 0.00 33.01 28.41 1sr3 s GLN 72 CO 0.22 -2.11 1.02 1.03 -2.12 0.00 0.00 175.29 173.33 1sr3 s ARG 73 N 3.55 4.74 0.26 2.91 0.52 -1.26 -1.25 118.95 128.42 1sr3 s ARG 73 Ca 0.49 1.65 -0.30 0.00 -0.52 0.00 0.00 55.73 57.06 1sr3 s ARG 73 Cb 0.01 -3.22 -0.09 0.00 0.52 0.00 0.00 34.95 32.17 1sr3 s ARG 73 CO 0.03 0.36 1.22 0.34 0.02 0.00 0.00 175.30 177.27 1sr3 s ASP 74 N -1.04 7.03 0.54 0.23 -1.08 -0.66 -4.92 116.67 116.77 1sr3 s ASP 74 Ca 0.43 2.39 0.33 0.00 -0.52 0.00 0.00 52.55 55.18 1sr3 s ASP 74 Cb -0.29 -2.62 1.38 0.00 -1.46 0.00 0.00 42.92 39.93 1sr3 s ASP 74 CO 0.36 -0.37 1.99 1.55 0.52 0.00 0.00 175.17 179.23 1sr3 h PRO 75 N 4.34 0.00 0.00 4.34 0.13 -1.94 -3.32 132.00 135.55 1sr3 h PRO 75 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1sr3 h PRO 75 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1sr3 h PRO 75 CO 0.70 0.04 -0.10 0.09 -0.23 0.00 0.00 178.00 178.50 1sr3 n ASN 76 N -3.16 1.14 -2.21 1.44 3.02 -1.26 -5.07 115.26 109.17 1sr3 n ASN 76 Ca 0.00 -1.96 -0.08 0.00 -0.03 0.00 0.00 54.58 52.51 1sr3 n ASN 76 Cb 0.30 -0.13 -0.00 0.00 -0.61 0.00 0.00 39.78 39.34 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 -0.47 -1.09 -0.83 6.41 2.88 -1.25 -5.01 113.62 114.26 1sr3 n SER 77 Ca 0.04 -2.12 0.07 0.00 -1.33 0.00 0.00 58.87 55.53 1sr3 n SER 77 Cb 0.49 1.93 0.19 0.00 -0.75 0.00 0.00 64.21 66.07 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 3.12 -4.54 2.46 7.99 -1.26 -4.33 117.00 120.45 1sr3 n LEU 78 Ca -0.02 -1.88 -0.41 0.00 -0.01 0.00 0.00 56.01 53.69 1sr3 n LEU 78 Cb 0.37 -0.27 0.01 0.00 -0.11 0.00 0.00 43.42 43.42 1sr3 n LEU 78 CO 0.18 0.76 0.34 1.17 -1.51 0.00 0.00 177.39 178.33 1sr3 n LYS 79 N 0.86 0.94 -4.29 3.23 0.00 -1.26 -1.65 118.16 115.99 1sr3 n LYS 79 Ca 0.15 0.34 -0.15 0.00 0.00 0.00 0.00 58.31 58.64 1sr3 n LYS 79 Cb 0.47 -1.81 -0.10 0.00 0.00 0.00 0.00 35.03 33.60 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 -1.39 0.71 -0.16 3.15 1.01 0.54 -1.66 120.40 122.61 1sr3 s VAL 80 Ca 0.65 -2.00 -0.04 0.00 0.00 0.00 0.00 61.98 60.58 1sr3 s VAL 80 Cb -0.56 -2.36 0.08 0.00 0.00 0.00 0.00 36.38 33.53 1sr3 s VAL 80 CO 0.56 -0.26 0.26 -0.89 0.00 0.00 0.00 175.10 174.77 1sr3 s THR 81 N -3.64 -0.40 0.43 3.92 2.01 -0.38 -3.03 115.64 114.55 1sr3 s THR 81 Ca 0.30 0.14 0.03 0.00 0.31 0.00 0.00 61.69 62.47 1sr3 s THR 81 Cb 0.07 -0.54 -0.03 0.00 0.01 0.00 0.00 72.50 72.00 1sr3 s THR 81 CO 0.09 0.00 0.06 0.72 -0.69 0.00 0.00 174.62 174.80 1sr3 s PHE 82 N 2.40 1.93 0.05 4.92 -0.71 -0.33 0.62 117.98 126.86 1sr3 s PHE 82 Ca 0.04 -1.04 0.07 0.00 -1.04 0.00 0.00 56.93 54.96 1sr3 s PHE 82 Cb -0.13 -1.41 -0.03 0.00 -1.21 0.00 0.00 43.02 40.24 1sr3 s PHE 82 CO -0.10 0.02 -0.21 0.99 -1.34 0.00 0.00 175.22 174.59 1sr3 s THR 83 N -3.05 1.67 -0.02 -4.49 2.01 -1.26 -0.02 115.64 110.48 1sr3 s THR 83 Ca 0.21 -1.24 0.04 0.00 0.31 0.00 0.00 61.69 61.00 1sr3 s THR 83 Cb 0.04 -1.46 -0.01 0.00 0.01 0.00 0.00 72.50 71.09 1sr3 s THR 83 CO 0.11 0.17 -0.12 0.27 -0.69 0.00 0.00 174.62 174.36 1sr3 s ILE 84 N -0.85 0.97 0.36 1.82 -4.36 -0.09 -1.43 121.20 117.63 1sr3 s ILE 84 Ca 0.07 -0.50 0.03 0.00 -0.26 0.00 0.00 60.65 59.99 1sr3 s ILE 84 Cb -0.09 -0.82 -0.04 0.00 1.25 0.00 0.00 42.46 42.76 1sr3 s ILE 84 CO 0.02 0.28 0.11 -0.72 0.24 0.00 0.00 174.94 174.87 1sr3 s TYR 85 N -0.13 1.81 0.00 1.37 1.13 0.34 -0.52 117.35 121.35 1sr3 s TYR 85 Ca 0.02 -1.18 0.00 0.00 -1.41 0.00 0.00 57.07 54.50 1sr3 s TYR 85 Cb -0.06 -1.16 0.00 0.00 -1.10 0.00 0.00 41.96 39.64 1sr3 s TYR 85 CO 0.00 -0.22 0.00 -3.47 -2.51 0.00 0.00 175.55 169.35 1sr3 n ASP 86 N -1.02 0.00 0.00 -0.18 -0.08 -0.85 -0.21 116.55 114.21 1sr3 n ASP 86 Ca -0.04 -0.38 0.01 0.00 -1.51 0.00 0.00 54.79 52.87 1sr3 n ASP 86 Cb 0.66 0.00 0.06 0.00 2.34 0.00 0.00 41.12 44.18 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 1.42 -0.98 -1.67 0.00 -1.26 -3.83 120.51 111.19 1sr3 n ALA 87 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1sr3 n ALA 87 Cb 0.00 -1.04 0.00 0.00 0.00 0.00 0.00 19.45 18.41 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 -1.17 0.00 0.00 0.00 -0.58 -1.26 -5.14 120.64 112.49 1sr3 n GLU 88 Ca 0.01 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.75 1sr3 n GLU 88 Cb 0.01 -0.00 0.00 0.00 -0.57 0.00 0.00 31.44 30.88 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 3.90 5.80 3.25 0.62 0.00 -0.36 -5.00 105.19 113.39 1sr3 n GLY 89 Ca 0.00 -1.55 -0.09 0.00 0.00 0.00 0.00 46.02 44.38 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 1.00 0.10 -0.01 1.61 1.04 -1.25 -2.01 113.70 114.18 1sr3 s SER 90 Ca 0.00 -0.75 -0.04 0.00 0.48 0.00 0.00 55.95 55.64 1sr3 s SER 90 Cb 0.00 0.37 0.00 0.00 0.10 0.00 0.00 66.02 66.49 1sr3 s SER 90 CO 0.00 -0.79 0.09 0.68 0.98 0.00 0.00 173.24 174.20 1sr3 s VAL 91 N -3.91 0.05 0.59 5.02 -7.23 0.33 -4.95 120.40 110.30 1sr3 s VAL 91 Ca 0.10 -0.41 -0.10 0.00 -1.81 0.00 0.00 61.98 59.76 1sr3 s VAL 91 Cb 0.04 -0.27 -0.04 0.00 0.56 0.00 0.00 36.38 36.67 1sr3 s VAL 91 CO -0.07 -0.22 0.98 -1.81 -0.31 0.00 0.00 175.10 173.67 1sr3 s ASP 92 N -0.72 6.25 -0.01 4.85 1.11 -0.74 -0.91 116.67 126.50 1sr3 s ASP 92 Ca -0.08 1.33 0.01 0.00 0.18 0.00 0.00 52.55 53.99 1sr3 s ASP 92 Cb -0.05 -2.43 0.00 0.00 1.07 0.00 0.00 42.92 41.52 1sr3 s ASP 92 CO 0.00 -0.80 -0.04 0.68 1.18 0.00 0.00 175.17 176.19 1sr3 s VAL 93 N -3.07 0.38 -0.39 -1.27 -7.23 0.97 -0.85 120.40 108.95 1sr3 s VAL 93 Ca 0.54 -0.18 -0.08 0.00 -1.81 0.00 0.00 61.98 60.45 1sr3 s VAL 93 Cb -0.11 -0.34 0.06 0.00 0.56 0.00 0.00 36.38 36.56 1sr3 s VAL 93 CO 0.51 0.12 0.19 -0.44 -0.31 0.00 0.00 175.10 175.17 1sr3 s SER 94 N 0.04 5.50 0.35 4.85 0.01 -0.07 -1.19 113.70 123.19 1sr3 s SER 94 Ca -0.00 -1.38 0.07 0.00 1.31 0.00 0.00 55.95 55.96 1sr3 s SER 94 Cb -0.04 -1.93 -0.02 0.00 0.21 0.00 0.00 66.02 64.24 1sr3 s SER 94 CO -0.00 -0.45 0.36 -0.47 0.41 0.00 0.00 173.24 173.09 1sr3 s TYR 95 N 1.40 2.93 -0.27 2.43 5.04 -1.17 -0.59 117.35 127.12 1sr3 s TYR 95 Ca 0.02 -0.31 -0.07 0.00 -2.44 0.00 0.00 57.07 54.27 1sr3 s TYR 95 Cb -0.21 -1.92 0.13 0.00 0.35 0.00 0.00 41.96 40.30 1sr3 s TYR 95 CO 0.02 0.07 0.55 -2.00 -1.34 0.00 0.00 175.55 172.85 1sr3 s GLU 96 N -4.08 0.49 0.00 4.97 2.12 -1.26 -0.33 118.70 120.61 1sr3 s GLU 96 Ca 0.44 1.18 0.00 0.00 0.36 0.00 0.00 54.97 56.95 1sr3 s GLU 96 Cb -0.07 0.56 0.00 0.00 0.26 0.00 0.00 34.13 34.88 1sr3 s GLU 96 CO 0.28 -0.33 0.00 0.41 -0.54 0.00 0.00 175.26 175.08 1sr3 n GLY 97 N 5.42 -1.50 2.39 -1.50 0.00 -0.66 -4.90 105.19 104.44 1sr3 n GLY 97 Ca -0.08 0.56 -0.18 0.00 0.00 0.00 0.00 46.02 46.32 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 -0.43 -1.60 -0.61 0.13 -1.26 -4.79 119.36 110.80 1sr3 n ILE 98 Ca 0.00 -3.13 -0.48 0.00 -1.10 0.00 0.00 62.75 58.04 1sr3 n ILE 98 Cb 0.00 -0.66 -0.03 0.00 -0.84 0.00 0.00 39.64 38.11 1sr3 n ILE 98 CO 0.00 0.00 0.00 -0.11 2.80 0.00 0.00 176.55 179.24 1sr3 n LEU 99 N 1.43 1.87 -4.77 9.51 7.94 -1.26 -4.88 117.00 126.83 1sr3 n LEU 99 Ca 0.17 1.15 -0.41 0.00 -1.11 0.00 0.00 56.01 55.80 1sr3 n LEU 99 Cb 0.57 -1.27 -0.01 0.00 0.53 0.00 0.00 43.42 43.24 1sr3 n LEU 99 CO 0.13 -1.15 1.09 -2.84 -1.11 0.00 0.00 177.39 173.51 1sr3 s PRO 100 N -0.50 4.21 0.30 1.96 0.02 -1.26 -4.86 135.00 134.86 1sr3 s PRO 100 Ca 0.71 2.42 0.23 0.00 0.02 0.00 0.00 61.00 64.37 1sr3 s PRO 100 Cb -0.80 -3.03 1.10 0.00 0.02 0.00 0.00 34.50 31.80 1sr3 s PRO 100 CO 0.52 -0.41 1.69 -0.25 -0.33 0.00 0.00 177.00 178.22 1sr3 n ASP 101 N 1.00 0.62 0.17 2.53 8.00 -1.26 -1.37 116.55 126.25 1sr3 n ASP 101 Ca 0.02 0.72 0.06 0.00 0.71 0.00 0.00 54.79 56.31 1sr3 n ASP 101 Cb 0.40 -0.83 0.15 0.00 -0.02 0.00 0.00 41.12 40.82 1sr3 n ASP 101 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1sr3 h LEU 102 N 0.00 0.00 -9.41 0.64 4.07 -2.00 -3.44 115.31 105.16 1sr3 h LEU 102 Ca 0.00 0.00 -0.55 0.00 0.08 0.00 0.00 57.88 57.41 1sr3 h LEU 102 Cb 0.16 0.00 0.03 0.00 1.08 0.00 0.00 40.66 41.93 1sr3 h LEU 102 CO 0.00 0.34 1.14 0.33 -1.08 0.00 0.00 178.44 179.17 1sr3 n PHE 103 N -3.24 2.51 -4.40 1.13 -0.00 -0.47 -4.98 117.46 108.02 1sr3 n PHE 103 Ca 0.02 -0.18 -0.27 0.00 -0.00 0.00 0.00 57.45 57.02 1sr3 n PHE 103 Cb 0.63 -2.74 -0.12 0.00 -0.00 0.00 0.00 39.48 37.25 1sr3 n PHE 103 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.76 177.79 1sr3 s ARG 104 N 3.49 1.46 -0.24 -4.13 1.81 -1.26 -4.98 118.95 115.10 1sr3 s ARG 104 Ca 0.86 -1.47 -0.29 0.00 -1.72 0.00 0.00 55.73 53.11 1sr3 s ARG 104 Cb -0.51 -1.79 -0.00 0.00 -0.45 0.00 0.00 34.95 32.19 1sr3 s ARG 104 CO 0.42 0.39 1.25 -1.21 -0.68 0.00 0.00 175.30 175.48 1sr3 s GLU 105 N -2.54 4.08 0.00 3.54 8.01 -1.26 -3.56 118.70 126.97 1sr3 s GLU 105 Ca 0.19 1.41 0.00 0.00 0.01 0.00 0.00 54.97 56.58 1sr3 s GLU 105 Cb -0.08 -3.81 0.00 0.00 -4.31 0.00 0.00 34.13 25.93 1sr3 s GLU 105 CO 0.09 -0.91 0.00 0.41 0.01 0.00 0.00 175.26 174.86 1sr3 n GLY 106 N 3.93 1.18 3.31 -1.39 0.00 -0.71 -4.77 105.19 106.74 1sr3 n GLY 106 Ca 0.14 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.00 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 1.33 -1.22 1.61 1.03 -1.23 -4.61 119.66 116.57 1sr3 s GLN 107 Ca 0.00 -1.69 -0.18 0.00 0.04 0.00 0.00 55.36 53.53 1sr3 s GLN 107 Cb 0.00 -0.36 0.09 0.00 0.03 0.00 0.00 33.01 32.77 1sr3 s GLN 107 CO 0.00 -0.21 1.60 0.20 -2.54 0.00 0.00 175.29 174.34 1sr3 s GLY 108 N -3.28 1.78 0.81 2.60 0.00 -1.26 -0.90 107.32 107.06 1sr3 s GLY 108 Ca 0.32 -2.92 -0.12 0.00 0.00 0.00 0.00 44.72 42.00 1sr3 s GLY 108 CO 0.10 2.53 1.16 -1.34 0.00 0.00 0.00 173.10 175.56 1sr3 s VAL 109 N 3.65 2.28 -0.17 1.40 -7.23 0.31 -4.01 120.40 116.63 1sr3 s VAL 109 Ca 0.49 0.09 -0.00 0.00 -1.81 0.00 0.00 61.98 60.75 1sr3 s VAL 109 Cb 0.01 -3.05 0.04 0.00 0.56 0.00 0.00 36.38 33.95 1sr3 s VAL 109 CO 0.03 -0.12 -0.06 -0.69 -0.31 0.00 0.00 175.10 173.95 1sr3 s VAL 110 N -3.49 1.16 0.19 1.32 1.01 0.70 -1.98 120.40 119.31 1sr3 s VAL 110 Ca 0.62 -0.64 0.06 0.00 0.00 0.00 0.00 61.98 62.01 1sr3 s VAL 110 Cb -0.12 -1.31 -0.04 0.00 0.00 0.00 0.00 36.38 34.92 1sr3 s VAL 110 CO 0.50 0.15 0.17 -0.69 0.00 0.00 0.00 175.10 175.23 1sr3 s VAL 111 N 1.61 4.53 -0.20 2.92 1.01 0.63 -0.65 120.40 130.26 1sr3 s VAL 111 Ca 0.01 -1.17 -0.18 0.00 0.00 0.00 0.00 61.98 60.65 1sr3 s VAL 111 Cb -0.15 -3.36 0.05 0.00 0.00 0.00 0.00 36.38 32.92 1sr3 s VAL 111 CO -0.08 -0.19 0.52 -1.58 0.00 0.00 0.00 175.10 173.77 1sr3 s GLN 112 N -3.38 0.60 0.00 2.72 0.74 -1.26 -1.03 119.66 118.05 1sr3 s GLN 112 Ca 0.32 0.75 0.00 0.00 0.05 0.00 0.00 55.36 56.48 1sr3 s GLN 112 Cb -0.09 0.27 0.00 0.00 1.10 0.00 0.00 33.01 34.29 1sr3 s GLN 112 CO 0.24 -0.08 0.00 0.41 -0.55 0.00 0.00 175.29 175.31 1sr3 n GLY 113 N 2.95 -0.76 3.08 2.59 0.00 -0.31 0.12 105.19 112.87 1sr3 n GLY 113 Ca -0.14 0.35 -0.08 0.00 0.00 0.00 0.00 46.02 46.15 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 0.00 0.57 0.30 1.61 2.02 -0.52 -0.82 118.70 121.86 1sr3 s GLU 114 Ca 0.00 -1.04 -0.06 0.00 0.02 0.00 0.00 54.97 53.89 1sr3 s GLU 114 Cb 0.00 0.20 -0.05 0.00 0.10 0.00 0.00 34.13 34.38 1sr3 s GLU 114 CO 0.00 -0.11 0.58 -1.17 0.02 0.00 0.00 175.26 174.58 1sr3 s LEU 115 N -2.57 4.03 0.00 1.80 0.20 -0.49 -0.03 118.68 121.61 1sr3 s LEU 115 Ca 0.02 0.77 0.00 0.00 0.69 0.00 0.00 54.13 55.60 1sr3 s LEU 115 Cb 0.04 -3.59 0.00 0.00 -0.43 0.00 0.00 46.19 42.20 1sr3 s LEU 115 CO -0.08 -0.22 0.00 1.21 -0.29 0.00 0.00 176.35 176.97 1sr3 n GLU 116 N -0.99 0.00 -3.58 1.98 0.00 0.37 -4.38 120.64 114.04 1sr3 n GLU 116 Ca -0.01 0.00 0.02 0.00 0.00 0.00 0.00 57.16 57.17 1sr3 n GLU 116 Cb 0.54 -0.00 -0.00 0.00 0.00 0.00 0.00 31.44 31.97 1sr3 n GLU 116 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.13 177.28 1sr3 s LYS 117 N -0.09 0.15 -2.12 5.31 -0.14 -1.26 -4.73 119.74 116.86 1sr3 s LYS 117 Ca 0.00 -0.08 0.00 0.00 -1.36 0.00 0.00 55.97 54.53 1sr3 s LYS 117 Cb 0.00 0.05 0.00 0.00 -1.68 0.00 0.00 37.83 36.20 1sr3 s LYS 117 CO 0.00 -0.07 0.00 0.41 -0.76 0.00 0.00 175.35 174.93 1sr3 n GLY 118 N -0.45 1.71 3.30 -3.33 0.00 -1.26 -1.56 105.19 103.61 1sr3 n GLY 118 Ca -0.08 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.84 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 -1.38 -6.80 -3.99 1.61 4.13 -1.26 -4.79 115.26 102.77 1sr3 n ASN 119 Ca -0.21 -0.42 -0.22 0.00 1.68 0.00 0.00 54.58 55.41 1sr3 n ASN 119 Cb 0.67 -4.31 -0.16 0.00 -1.54 0.00 0.00 39.78 34.44 1sr3 n ASN 119 CO 0.00 0.00 0.00 -2.28 0.28 0.00 0.00 177.26 175.26 1sr3 s HIS 120 N -3.08 1.12 -0.15 3.10 2.46 -0.60 -1.80 115.29 116.34 1sr3 s HIS 120 Ca 0.09 -0.34 -0.05 0.00 0.47 0.00 0.00 55.06 55.23 1sr3 s HIS 120 Cb -0.02 -0.83 -0.04 0.00 -0.13 0.00 0.00 32.58 31.56 1sr3 s HIS 120 CO 0.79 -0.18 0.03 0.42 -2.47 0.00 0.00 174.74 173.34 1sr3 s ILE 121 N 0.49 4.57 -0.48 0.89 -1.09 -0.03 -0.48 121.20 125.07 1sr3 s ILE 121 Ca -0.09 -0.13 -0.29 0.00 -2.23 0.00 0.00 60.65 57.92 1sr3 s ILE 121 Cb -0.12 -3.01 0.03 0.00 -1.58 0.00 0.00 42.46 37.77 1sr3 s ILE 121 CO 0.02 0.52 1.20 -0.76 -1.23 0.00 0.00 174.94 174.68 1sr3 s LEU 122 N -0.09 3.60 0.18 2.97 2.01 0.95 -0.89 118.68 127.41 1sr3 s LEU 122 Ca 0.05 0.50 -0.27 0.00 0.01 0.00 0.00 54.13 54.42 1sr3 s LEU 122 Cb -0.12 -3.51 -0.08 0.00 0.01 0.00 0.00 46.19 42.48 1sr3 s LEU 122 CO 0.01 -1.31 0.84 0.00 1.01 0.00 0.00 176.35 176.90 1sr3 s ALA 123 N 4.70 3.39 -0.11 4.21 0.00 0.24 -1.44 121.76 132.75 1sr3 s ALA 123 Ca 0.50 0.46 0.12 0.00 0.00 0.00 0.00 51.96 53.04 1sr3 s ALA 123 Cb -0.08 -3.07 -0.18 0.00 0.00 0.00 0.00 23.12 19.79 1sr3 s ALA 123 CO 0.32 0.22 0.31 0.36 0.00 0.00 0.00 175.76 176.97 1sr3 n LYS 124 N 1.74 0.85 0.00 0.00 -0.00 0.12 -4.26 118.16 116.61 1sr3 n LYS 124 Ca -0.04 -0.09 0.00 0.00 -0.00 0.00 0.00 58.31 58.18 1sr3 n LYS 124 Cb 0.48 -1.25 0.00 0.00 -0.00 0.00 0.00 35.03 34.26 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 -1.81 0.00 -2.31 -1.58 0.28 -1.25 -4.93 120.64 109.04 1sr3 n GLU 125 Ca -0.01 0.00 -0.00 0.00 -0.16 0.00 0.00 57.16 56.98 1sr3 n GLU 125 Cb 0.29 -0.32 -0.00 0.00 1.43 0.00 0.00 31.44 32.84 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 -1.93 -9.08 -4.33 3.84 0.31 -1.26 -4.89 118.33 101.00 1sr3 n VAL 126 Ca 0.00 2.12 -0.24 0.00 -0.01 0.00 0.00 64.34 66.21 1sr3 n VAL 126 Cb 0.02 -4.68 -0.12 0.00 -0.91 0.00 0.00 33.84 28.15 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 -0.41 2.37 -0.25 7.52 1.43 0.18 -4.49 118.68 125.02 1sr3 s LEU 127 Ca -0.02 -0.78 0.11 0.00 -1.03 0.00 0.00 54.13 52.41 1sr3 s LEU 127 Cb 0.00 -0.92 0.48 0.00 0.03 0.00 0.00 46.19 45.78 1sr3 s LEU 127 CO 0.06 0.04 1.40 0.00 0.23 0.00 0.00 176.35 178.09 1sr3 n ALA 128 N 0.69 3.89 -4.12 4.21 0.00 -1.26 -0.22 120.51 123.70 1sr3 n ALA 128 Ca -0.16 -3.01 -0.28 0.00 0.00 0.00 0.00 53.44 49.98 1sr3 n ALA 128 Cb 0.55 -0.65 -0.06 0.00 0.00 0.00 0.00 19.45 19.29 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 -1.06 -2.24 0.00 0.00 4.76 -1.26 -4.76 118.16 113.60 1sr3 n LYS 129 Ca 0.28 0.26 0.00 0.00 -2.87 0.00 0.00 58.31 55.99 1sr3 n LYS 129 Cb 0.94 -4.13 0.00 0.00 -1.84 0.00 0.00 35.03 30.00 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 -4.48 0.00 0.14 2.13 1.44 -1.26 -5.06 115.22 108.13 1sr3 n HIS 130 Ca -0.31 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.40 1sr3 n HIS 130 Cb 0.69 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.80 1sr3 n HIS 130 CO 0.00 0.00 0.00 -0.25 -2.81 0.00 0.00 176.34 173.28 1sr3 n ASP 131 N 0.00 -0.08 -3.30 4.39 8.00 -1.26 -5.09 116.55 119.21 1sr3 n ASP 131 Ca 0.00 0.47 -0.18 0.00 0.71 0.00 0.00 54.79 55.79 1sr3 n ASP 131 Cb 0.00 0.36 0.01 0.00 -0.02 0.00 0.00 41.12 41.47 1sr3 n ASP 131 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1sr3 n GLU 132 N -3.49 -1.80 -1.65 -1.24 -0.58 -1.26 -5.01 120.64 105.61 1sr3 n GLU 132 Ca 0.00 1.46 -0.32 0.00 -0.42 0.00 0.00 57.16 57.87 1sr3 n GLU 132 Cb 0.00 -3.95 0.06 0.00 -0.57 0.00 0.00 31.44 26.97 1sr3 n GLU 132 CO 0.00 0.00 0.00 1.21 -0.48 0.00 0.00 177.13 177.86 1sr3 s ASN 133 N -2.52 5.03 0.88 1.62 2.47 -1.26 -5.08 114.94 116.09 1sr3 s ASN 133 Ca 0.16 1.93 -0.13 0.00 0.42 0.00 0.00 52.86 55.24 1sr3 s ASN 133 Cb -0.03 -2.54 0.13 0.00 -1.45 0.00 0.00 41.25 37.36 1sr3 s ASN 133 CO 0.82 -1.68 1.17 -0.47 -3.72 0.00 0.00 177.10 173.22 1sr3 s TYR 134 N -2.52 2.53 -0.04 0.43 5.04 -1.26 -5.12 117.35 116.42 1sr3 s TYR 134 Ca 0.65 0.75 0.01 0.00 -2.44 0.00 0.00 57.07 56.04 1sr3 s TYR 134 Cb -0.19 -3.51 0.02 0.00 0.35 0.00 0.00 41.96 38.63 1sr3 s TYR 134 CO 0.45 -2.21 -0.06 0.99 -1.34 0.00 0.00 175.55 173.39 1sr3 s THR 135 N -3.45 0.63 1.21 4.34 2.01 -1.26 -5.17 115.64 113.95 1sr3 s THR 135 Ca 0.64 -0.20 -0.17 0.00 0.31 0.00 0.00 61.69 62.27 1sr3 s THR 135 Cb -0.12 -0.62 0.29 0.00 0.01 0.00 0.00 72.50 72.05 1sr3 s THR 135 CO 0.52 0.24 1.05 -2.16 -0.69 0.00 0.00 174.62 173.57 1sr3 s PRO 136 N 0.75 -1.25 0.21 4.92 0.04 -1.26 -4.96 135.00 133.45 1sr3 s PRO 136 Ca -0.11 0.26 0.04 0.00 0.04 0.00 0.00 61.00 61.23 1sr3 s PRO 136 Cb -0.14 -1.56 0.14 0.00 0.04 0.00 0.00 34.50 32.98 1sr3 s PRO 136 CO 0.01 -3.80 1.48 -1.00 0.04 0.00 0.00 177.00 173.73 1sr3 h PRO 137 N -2.65 0.19 -2.35 0.56 0.13 -1.99 -3.31 132.00 122.58 1sr3 h PRO 137 Ca -0.50 -0.16 -0.05 0.00 -0.87 0.00 0.00 66.00 64.42 1sr3 h PRO 137 Cb 1.32 0.04 -0.02 0.00 0.13 0.00 0.00 31.00 32.47 1sr3 h PRO 137 CO 0.41 0.84 0.08 0.39 -0.23 0.00 0.00 178.00 179.49 1sr3 n GLU 138 N -3.76 0.67 0.00 0.86 4.71 -1.26 -1.91 120.64 119.95 1sr3 n GLU 138 Ca -0.03 -0.25 0.00 0.00 -0.01 0.00 0.00 57.16 56.87 1sr3 n GLU 138 Cb 0.70 -1.54 0.00 0.00 -1.01 0.00 0.00 31.44 29.59 1sr3 n GLU 138 CO 0.00 0.00 0.00 1.55 0.09 0.00 0.00 177.13 178.77 1sr3 n VAL 139 N 2.39 0.00 0.32 2.62 3.14 -1.25 -4.86 118.33 120.69 1sr3 n VAL 139 Ca 0.11 0.00 0.21 0.00 -2.96 0.00 0.00 64.34 61.70 1sr3 n VAL 139 Cb 0.31 0.00 1.06 0.00 -1.06 0.00 0.00 33.84 34.15 1sr3 n VAL 139 CO 0.00 0.00 0.00 -0.33 -6.46 0.00 0.00 176.83 170.04 1sr3 h GLU 140 N 0.00 0.00 -4.74 1.45 4.39 -1.46 -2.88 114.58 111.33 1sr3 h GLU 140 Ca 0.00 0.00 -0.49 0.00 0.34 0.00 0.00 59.36 59.21 1sr3 h GLU 140 Cb 0.00 0.00 -0.32 0.00 -0.10 0.00 0.00 28.75 28.33 1sr3 h GLU 140 CO 0.00 0.00 -0.81 0.21 -1.16 0.00 0.00 179.01 177.26 1sr3 s LYS 141 N -4.04 1.37 -0.43 2.33 2.36 -1.16 -4.92 119.74 115.25 1sr3 s LYS 141 Ca -0.03 -0.40 -0.20 0.00 -2.55 0.00 0.00 55.97 52.79 1sr3 s LYS 141 Cb 0.12 -1.20 0.03 0.00 -1.05 0.00 0.00 37.83 35.72 1sr3 s LYS 141 CO 0.46 0.12 0.61 0.00 1.55 0.00 0.00 175.35 178.08 1sr3 n ALA 142 N 3.42 -2.90 0.05 3.13 0.00 -1.24 -4.69 120.51 118.28 1sr3 n ALA 142 Ca -0.20 1.04 0.00 0.00 0.00 0.00 0.00 53.44 54.29 1sr3 n ALA 142 Cb 0.53 -3.54 0.02 0.00 0.00 0.00 0.00 19.45 16.47 1sr3 n ALA 142 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17