#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 0.88 0.08 1.96 3.00 -1.26 -5.19 118.95 118.43 1sr3 s ARG 31 Ca 0.00 0.82 -0.12 0.00 0.00 0.00 0.00 55.73 56.44 1sr3 s ARG 31 Cb 0.00 0.43 0.01 0.00 0.00 0.00 0.00 34.95 35.39 1sr3 s ARG 31 CO 0.00 -0.15 0.27 -1.12 0.00 0.00 0.00 175.30 174.30 1sr3 s SER 32 N 0.02 -0.03 0.30 0.23 0.01 -1.26 -5.19 113.70 107.78 1sr3 s SER 32 Ca -0.02 -0.43 -0.19 0.00 1.31 0.00 0.00 55.95 56.61 1sr3 s SER 32 Cb -0.04 0.37 0.05 0.00 0.21 0.00 0.00 66.02 66.62 1sr3 s SER 32 CO 0.03 -0.72 0.85 0.21 0.41 0.00 0.00 173.24 174.02 1sr3 s ASN 33 N -2.59 -0.06 0.00 2.44 2.47 -1.26 -5.17 114.94 110.77 1sr3 s ASN 33 Ca 0.01 -0.87 0.00 0.00 0.42 0.00 0.00 52.86 52.42 1sr3 s ASN 33 Cb 0.02 0.72 0.00 0.00 -1.45 0.00 0.00 41.25 40.54 1sr3 s ASN 33 CO -0.09 -1.40 0.00 -0.38 -3.72 0.00 0.00 177.10 171.51 1sr3 n ILE 34 N -0.55 0.00 -2.49 -5.21 2.08 -1.26 -5.03 119.36 106.90 1sr3 n ILE 34 Ca -0.06 0.00 -0.35 0.00 0.56 0.00 0.00 62.75 62.90 1sr3 n ILE 34 Cb 0.60 -0.85 -0.03 0.00 -0.75 0.00 0.00 39.64 38.61 1sr3 n ILE 34 CO 0.00 0.00 0.00 1.51 0.56 0.00 0.00 176.55 178.62 1sr3 s ASP 35 N -1.03 6.31 0.25 4.38 1.47 -1.26 -5.07 116.67 121.72 1sr3 s ASP 35 Ca 0.00 2.00 0.03 0.00 1.18 0.00 0.00 52.55 55.76 1sr3 s ASP 35 Cb 0.00 -2.57 0.03 0.00 -0.34 0.00 0.00 42.92 40.05 1sr3 s ASP 35 CO 0.00 -0.80 0.29 0.00 0.68 0.00 0.00 175.17 175.33 1sr3 n LEU 36 N -0.85 0.00 -3.68 2.11 -0.00 -1.26 -4.93 117.00 108.38 1sr3 n LEU 36 Ca 0.09 -1.15 -0.19 0.00 -0.00 0.00 0.00 56.01 54.76 1sr3 n LEU 36 Cb 0.52 -0.12 -0.17 0.00 -0.00 0.00 0.00 43.42 43.64 1sr3 n LEU 36 CO 0.41 -0.52 -0.32 0.12 -0.00 0.00 0.00 177.39 177.08 1sr3 s PHE 37 N -0.80 0.01 0.54 1.47 2.19 -1.26 -1.52 117.98 118.62 1sr3 s PHE 37 Ca 0.22 0.31 0.05 0.00 0.33 0.00 0.00 56.93 57.84 1sr3 s PHE 37 Cb -0.02 -0.40 0.05 0.00 -1.31 0.00 0.00 43.02 41.34 1sr3 s PHE 37 CO 0.14 -0.19 0.39 0.66 1.83 0.00 0.00 175.22 178.05 1sr3 n TYR 38 N 5.15 -0.53 -3.89 10.12 4.02 0.48 -4.94 117.16 127.57 1sr3 n TYR 38 Ca -0.07 -2.30 -0.09 0.00 -0.01 0.00 0.00 57.90 55.43 1sr3 n TYR 38 Cb 0.50 -0.44 -0.07 0.00 -0.02 0.00 0.00 39.34 39.31 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 -2.70 0.11 -1.47 -0.72 -4.23 -1.26 -1.35 115.64 104.02 1sr3 s THR 39 Ca 0.30 -1.24 -0.13 0.00 -1.18 0.00 0.00 61.69 59.44 1sr3 s THR 39 Cb -0.02 -1.55 -0.01 0.00 1.34 0.00 0.00 72.50 72.25 1sr3 s THR 39 CO 0.19 -0.48 2.45 -0.81 -0.54 0.00 0.00 174.62 175.43 1sr3 n PRO 40 N -0.14 3.05 0.03 3.99 -0.04 -1.25 -1.93 135.00 138.72 1sr3 n PRO 40 Ca -0.12 -2.41 0.00 0.00 -0.04 0.00 0.00 63.50 60.94 1sr3 n PRO 40 Cb 0.63 -3.09 0.00 0.00 -0.04 0.00 0.00 33.50 30.99 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 3.94 -0.72 0.00 0.55 0.00 -1.26 -1.08 105.19 106.62 1sr3 n GLY 41 Ca 0.60 0.15 0.12 0.00 0.00 0.00 0.00 46.02 46.89 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 -2.52 0.66 -0.05 1.61 4.71 -0.81 -0.64 120.64 123.60 1sr3 n GLU 42 Ca 0.00 0.02 -0.10 0.00 -0.01 0.00 0.00 57.16 57.07 1sr3 n GLU 42 Cb 0.00 -1.50 -0.15 0.00 -1.01 0.00 0.00 31.44 28.78 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 -1.08 1.55 -0.12 -3.67 5.41 -1.05 -2.80 119.36 117.59 1sr3 n ILE 43 Ca 0.17 -0.80 -0.25 0.00 1.00 0.00 0.00 62.75 62.86 1sr3 n ILE 43 Cb 0.12 -0.91 -0.11 0.00 -0.71 0.00 0.00 39.64 38.02 1sr3 n ILE 43 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 1sr3 n LEU 44 N -2.99 2.24 0.07 1.39 7.99 -0.30 -4.60 117.00 120.79 1sr3 n LEU 44 Ca -0.24 0.23 -0.18 0.00 -0.01 0.00 0.00 56.01 55.81 1sr3 n LEU 44 Cb 1.08 -0.88 -0.14 0.00 -0.11 0.00 0.00 43.42 43.37 1sr3 n LEU 44 CO 0.44 0.64 -0.37 1.88 -1.51 0.00 0.00 177.39 178.47 1sr3 h TYR 45 N -0.69 0.51 0.00 -1.77 -1.99 -1.16 -3.50 116.97 108.37 1sr3 h TYR 45 Ca -0.61 -0.37 0.00 0.00 2.00 0.00 0.00 58.73 59.75 1sr3 h TYR 45 Cb 1.67 -0.02 0.00 0.00 2.00 0.00 0.00 36.73 40.38 1sr3 h TYR 45 CO -0.02 1.43 0.00 0.41 -0.00 0.00 0.00 178.16 179.98 1sr3 n GLY 46 N 1.70 4.44 3.72 3.88 0.00 -1.26 -5.06 105.19 112.60 1sr3 n GLY 46 Ca -0.18 -0.87 -0.42 0.00 0.00 0.00 0.00 46.02 44.55 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 -4.56 4.17 0.36 1.61 2.47 -1.12 -4.46 119.74 118.22 1sr3 s LYS 47 Ca 0.00 2.49 0.18 0.00 -1.56 0.00 0.00 55.97 57.08 1sr3 s LYS 47 Cb 0.00 -3.15 0.64 0.00 -1.46 0.00 0.00 37.83 33.86 1sr3 s LYS 47 CO 0.00 -0.69 1.72 0.00 0.16 0.00 0.00 175.35 176.54 1sr3 h ARG 48 N 6.95 0.00 0.00 4.03 3.08 -1.92 -1.76 114.38 124.76 1sr3 h ARG 48 Ca -0.43 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.62 1sr3 h ARG 48 Cb 1.20 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.25 1sr3 h ARG 48 CO 0.94 0.40 0.00 0.39 -1.07 0.00 0.00 179.97 180.63 1sr3 n GLU 49 N -3.58 0.00 -2.69 0.04 4.71 -1.26 -4.57 120.64 113.29 1sr3 n GLU 49 Ca -0.00 0.43 -0.07 0.00 -0.01 0.00 0.00 57.16 57.51 1sr3 n GLU 49 Cb 0.52 -1.33 0.09 0.00 -1.01 0.00 0.00 31.44 29.70 1sr3 n GLU 49 CO 0.00 0.00 0.00 -2.37 0.09 0.00 0.00 177.13 174.85 1sr3 n THR 50 N -1.67 0.41 -3.49 2.62 5.66 -1.25 -5.07 114.28 111.49 1sr3 n THR 50 Ca 0.00 -2.05 -0.15 0.00 -3.05 0.00 0.00 64.05 58.80 1sr3 n THR 50 Cb 0.00 0.91 0.00 0.00 -1.55 0.00 0.00 70.33 69.70 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 -0.53 -1.49 -4.32 1.09 3.00 -0.66 -5.02 117.38 109.45 1sr3 n GLN 51 Ca 0.00 1.08 -0.19 0.00 -0.01 0.00 0.00 57.00 57.88 1sr3 n GLN 51 Cb 0.84 -3.66 -0.13 0.00 0.00 0.00 0.00 30.24 27.29 1sr3 n GLN 51 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.06 178.20 1sr3 s GLN 52 N -4.09 0.88 0.53 -1.09 0.00 -1.26 -4.90 119.66 109.74 1sr3 s GLN 52 Ca 0.02 -0.74 -0.07 0.00 -0.00 0.00 0.00 55.36 54.57 1sr3 s GLN 52 Cb -0.00 -0.87 -0.03 0.00 0.00 0.00 0.00 33.01 32.10 1sr3 s GLN 52 CO 0.84 0.21 0.87 -1.64 0.00 0.00 0.00 175.29 175.57 1sr3 s MET 53 N -1.13 3.49 0.46 9.60 -1.94 -1.26 -3.37 119.30 125.15 1sr3 s MET 53 Ca 0.01 0.34 -0.21 0.00 -1.71 0.00 0.00 55.69 54.11 1sr3 s MET 53 Cb -0.08 -2.28 -0.08 0.00 2.01 0.00 0.00 34.83 34.40 1sr3 s MET 53 CO 0.01 -0.37 1.05 -1.25 -0.01 0.00 0.00 175.02 174.45 1sr3 s PRO 54 N -4.90 3.89 0.19 2.03 0.04 -1.26 -5.05 135.00 129.93 1sr3 s PRO 54 Ca 0.50 1.43 -0.30 0.00 0.04 0.00 0.00 61.00 62.67 1sr3 s PRO 54 Cb -0.11 -2.23 -0.08 0.00 0.04 0.00 0.00 34.50 32.13 1sr3 s PRO 54 CO 0.48 -0.37 0.97 -2.00 0.04 0.00 0.00 177.00 176.11 1sr3 s GLU 55 N -3.00 4.78 0.00 4.56 2.12 -1.26 -4.94 118.70 120.96 1sr3 s GLU 55 Ca 0.65 1.51 0.10 0.00 0.36 0.00 0.00 54.97 57.58 1sr3 s GLU 55 Cb -0.19 -3.31 0.46 0.00 0.26 0.00 0.00 34.13 31.35 1sr3 s GLU 55 CO 0.23 0.37 1.27 0.28 -0.54 0.00 0.00 175.26 176.87 1sr3 n VAL 56 N 2.00 1.09 -1.99 3.70 0.31 -1.26 -2.40 118.33 119.77 1sr3 n VAL 56 Ca -0.00 0.27 -0.11 0.00 -0.01 0.00 0.00 64.34 64.50 1sr3 n VAL 56 Cb 0.48 -1.10 0.08 0.00 -0.91 0.00 0.00 33.84 32.38 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 -0.46 5.25 3.21 2.92 0.00 -1.26 -4.52 105.19 110.33 1sr3 n GLY 57 Ca 0.03 -1.98 -0.12 0.00 0.00 0.00 0.00 46.02 43.95 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 -3.30 1.03 0.47 1.61 -2.07 -1.01 -5.06 119.66 111.32 1sr3 s GLN 58 Ca 0.44 -1.48 -0.20 0.00 -1.82 0.00 0.00 55.36 52.29 1sr3 s GLN 58 Cb 0.39 -0.16 -0.09 0.00 -1.09 0.00 0.00 33.01 32.06 1sr3 s GLN 58 CO -0.01 -0.14 1.00 -0.98 -1.32 0.00 0.00 175.29 173.83 1sr3 s ARG 59 N -3.93 3.99 0.20 9.60 1.70 -1.26 -2.85 118.95 126.40 1sr3 s ARG 59 Ca 0.22 1.23 -0.23 0.00 -0.47 0.00 0.00 55.73 56.48 1sr3 s ARG 59 Cb 0.06 -2.13 0.05 0.00 -0.57 0.00 0.00 34.95 32.36 1sr3 s ARG 59 CO 0.02 -0.25 0.68 -0.48 -1.08 0.00 0.00 175.30 174.19 1sr3 s LEU 60 N -3.41 -0.41 0.17 -1.89 -0.00 -0.73 -4.87 118.68 107.54 1sr3 s LEU 60 Ca 0.64 -0.28 0.05 0.00 -0.00 0.00 0.00 54.13 54.55 1sr3 s LEU 60 Cb -0.13 2.60 -0.04 0.00 -0.00 0.00 0.00 46.19 48.63 1sr3 s LEU 60 CO 0.18 -1.11 0.12 -0.60 -0.00 0.00 0.00 176.35 174.94 1sr3 s ARG 61 N -3.76 2.82 0.03 1.48 3.52 -0.58 -1.64 118.95 120.83 1sr3 s ARG 61 Ca 0.06 -0.91 -0.00 0.00 -0.13 0.00 0.00 55.73 54.74 1sr3 s ARG 61 Cb -0.03 -2.60 -0.03 0.00 -1.56 0.00 0.00 34.95 30.73 1sr3 s ARG 61 CO -0.04 0.48 -0.03 0.08 -0.81 0.00 0.00 175.30 174.98 1sr3 s VAL 62 N -1.76 0.15 -0.01 7.11 1.01 0.25 -0.39 120.40 126.76 1sr3 s VAL 62 Ca 0.30 -1.26 0.03 0.00 0.00 0.00 0.00 61.98 61.05 1sr3 s VAL 62 Cb -0.10 -0.76 -0.01 0.00 0.00 0.00 0.00 36.38 35.52 1sr3 s VAL 62 CO 0.23 -0.70 -0.10 -0.83 0.00 0.00 0.00 175.10 173.70 1sr3 s GLY 63 N -2.03 0.48 0.13 4.51 0.00 -0.45 -0.99 107.32 108.96 1sr3 s GLY 63 Ca -0.07 -0.41 -0.25 0.00 0.00 0.00 0.00 44.72 43.99 1sr3 s GLY 63 CO -0.05 -0.33 1.06 -0.32 0.00 0.00 0.00 173.10 173.47 1sr3 s GLY 64 N -0.19 -0.13 -0.20 0.20 0.00 -0.25 -3.78 107.32 102.96 1sr3 s GLY 64 Ca 0.03 0.05 -0.05 0.00 0.00 0.00 0.00 44.72 44.75 1sr3 s GLY 64 CO -0.00 1.13 -0.01 -0.29 0.00 0.00 0.00 173.10 173.93 1sr3 s MET 65 N -2.68 3.58 0.13 2.90 1.75 0.49 -0.31 119.30 125.16 1sr3 s MET 65 Ca 0.17 -0.54 -0.31 0.00 -1.25 0.00 0.00 55.69 53.76 1sr3 s MET 65 Cb -0.01 -3.07 -0.09 0.00 2.84 0.00 0.00 34.83 34.50 1sr3 s MET 65 CO 0.02 -0.03 1.50 0.54 -0.65 0.00 0.00 175.02 176.41 1sr3 s VAL 66 N 1.09 2.94 0.36 10.11 0.11 0.15 -0.15 120.40 135.00 1sr3 s VAL 66 Ca 0.02 0.65 -0.28 0.00 -2.93 0.00 0.00 61.98 59.44 1sr3 s VAL 66 Cb -0.14 -3.41 -0.11 0.00 -1.53 0.00 0.00 36.38 31.18 1sr3 s VAL 66 CO 0.01 0.04 1.43 -0.04 -3.33 0.00 0.00 175.10 173.22 1sr3 s MET 67 N 1.29 4.19 0.37 1.54 -1.94 -0.66 -1.53 119.30 122.56 1sr3 s MET 67 Ca 0.68 2.45 -0.28 0.00 -1.71 0.00 0.00 55.69 56.83 1sr3 s MET 67 Cb -0.41 -3.01 -0.10 0.00 2.01 0.00 0.00 34.83 33.33 1sr3 s MET 67 CO 0.31 -0.42 1.42 -1.25 -0.01 0.00 0.00 175.02 175.06 1sr3 s PRO 68 N -1.93 4.14 -0.89 2.03 0.04 -1.26 -3.39 135.00 133.73 1sr3 s PRO 68 Ca 0.52 2.43 -0.04 0.00 0.04 0.00 0.00 61.00 63.94 1sr3 s PRO 68 Cb -0.44 -2.96 0.00 0.00 0.04 0.00 0.00 34.50 31.15 1sr3 s PRO 68 CO 0.59 -0.45 0.77 0.41 0.04 0.00 0.00 177.00 178.36 1sr3 n GLY 69 N 0.58 -0.09 0.00 0.56 0.00 -1.26 -4.97 105.19 100.01 1sr3 n GLY 69 Ca 0.01 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.98 1sr3 n GLY 69 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1sr3 n SER 70 N -1.90 0.00 -0.56 1.61 3.41 -1.22 -5.06 113.62 109.90 1sr3 n SER 70 Ca -0.07 0.00 -0.04 0.00 -0.26 0.00 0.00 58.87 58.50 1sr3 n SER 70 Cb 0.57 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.49 1sr3 n SER 70 CO 0.00 0.00 0.00 0.55 -0.16 0.00 0.00 175.04 175.43 1sr3 n VAL 71 N -0.61 0.00 -3.03 -3.33 3.14 -1.26 -4.89 118.33 108.35 1sr3 n VAL 71 Ca 0.00 -0.03 -0.45 0.00 -2.96 0.00 0.00 64.34 60.91 1sr3 n VAL 71 Cb 0.00 -0.03 -0.03 0.00 -1.06 0.00 0.00 33.84 32.72 1sr3 n VAL 71 CO 0.00 0.00 0.00 -1.10 -6.46 0.00 0.00 176.83 169.27 1sr3 s GLN 72 N 1.01 3.55 0.19 1.45 -0.21 0.24 -4.96 119.66 120.92 1sr3 s GLN 72 Ca 0.17 -1.86 -0.11 0.00 0.02 0.00 0.00 55.36 53.57 1sr3 s GLN 72 Cb -0.13 -4.74 -0.07 0.00 1.00 0.00 0.00 33.01 29.07 1sr3 s GLN 72 CO 0.07 -1.65 0.54 1.03 -2.12 0.00 0.00 175.29 173.16 1sr3 s ARG 73 N 2.15 3.86 -0.16 2.91 0.52 -1.26 -1.11 118.95 125.85 1sr3 s ARG 73 Ca 0.28 0.34 -0.29 0.00 -0.52 0.00 0.00 55.73 55.53 1sr3 s ARG 73 Cb -0.08 -2.77 -0.01 0.00 0.52 0.00 0.00 34.95 32.61 1sr3 s ARG 73 CO -0.08 0.39 1.21 0.34 0.02 0.00 0.00 175.30 177.18 1sr3 s ASP 74 N -2.10 7.00 0.00 0.23 -1.08 0.44 -4.91 116.67 116.25 1sr3 s ASP 74 Ca 0.43 1.64 0.18 0.00 -0.52 0.00 0.00 52.55 54.28 1sr3 s ASP 74 Cb -0.13 -2.54 0.81 0.00 -1.46 0.00 0.00 42.92 39.61 1sr3 s ASP 74 CO 0.20 -0.71 1.57 -0.81 0.52 0.00 0.00 175.17 175.94 1sr3 n PRO 75 N 6.34 0.08 -0.01 4.34 -0.04 -1.26 -3.31 135.00 141.14 1sr3 n PRO 75 Ca 0.13 0.17 0.02 0.00 -0.04 0.00 0.00 63.50 63.78 1sr3 n PRO 75 Cb 0.45 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.35 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 -1.44 3.25 -0.06 3.54 3.02 -1.26 -5.08 115.26 117.23 1sr3 n ASN 76 Ca 0.06 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.61 1sr3 n ASN 76 Cb 0.19 1.18 0.00 0.00 -0.61 0.00 0.00 39.78 40.54 1sr3 n ASN 76 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1sr3 n SER 77 N -1.89 0.04 -0.12 6.41 7.64 -1.21 -5.09 113.62 119.40 1sr3 n SER 77 Ca -0.04 -0.06 0.04 0.00 1.01 0.00 0.00 58.87 59.82 1sr3 n SER 77 Cb 0.34 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.52 1sr3 n SER 77 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1sr3 n LEU 78 N 0.00 0.84 -4.69 -3.43 4.77 -1.26 -4.50 117.00 108.73 1sr3 n LEU 78 Ca 0.00 -0.69 -0.43 0.00 -0.03 0.00 0.00 56.01 54.86 1sr3 n LEU 78 Cb 0.00 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.08 1sr3 n LEU 78 CO 0.00 0.18 0.88 0.29 -1.33 0.00 0.00 177.39 177.41 1sr3 n LYS 79 N -0.55 2.05 -3.65 3.23 4.76 -1.26 -1.54 118.16 121.20 1sr3 n LYS 79 Ca 0.03 0.72 -0.07 0.00 -2.87 0.00 0.00 58.31 56.12 1sr3 n LYS 79 Cb 0.14 -2.29 -0.07 0.00 -1.84 0.00 0.00 35.03 30.97 1sr3 n LYS 79 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1sr3 s VAL 80 N -0.99 -0.22 0.01 -0.18 0.11 -0.52 -0.42 120.40 118.18 1sr3 s VAL 80 Ca 0.57 0.03 -0.01 0.00 -2.93 0.00 0.00 61.98 59.64 1sr3 s VAL 80 Cb -0.59 -0.92 -0.04 0.00 -1.53 0.00 0.00 36.38 33.31 1sr3 s VAL 80 CO 0.61 0.01 0.13 -0.89 -3.33 0.00 0.00 175.10 171.63 1sr3 s THR 81 N 1.88 5.03 0.26 5.04 2.01 -0.27 -0.22 115.64 129.38 1sr3 s THR 81 Ca -0.09 -0.35 -0.05 0.00 0.31 0.00 0.00 61.69 61.51 1sr3 s THR 81 Cb -0.07 -3.35 -0.02 0.00 0.01 0.00 0.00 72.50 69.08 1sr3 s THR 81 CO -0.18 0.30 0.35 0.72 -0.69 0.00 0.00 174.62 175.12 1sr3 s PHE 82 N -1.29 0.88 0.04 4.92 -0.71 -0.37 -0.59 117.98 120.86 1sr3 s PHE 82 Ca 0.26 -1.14 0.07 0.00 -1.04 0.00 0.00 56.93 55.08 1sr3 s PHE 82 Cb -0.12 -0.18 -0.03 0.00 -1.21 0.00 0.00 43.02 41.47 1sr3 s PHE 82 CO 0.18 -0.90 -0.17 0.99 -1.34 0.00 0.00 175.22 173.98 1sr3 s THR 83 N -3.81 2.89 -0.07 -4.49 2.01 -1.26 -0.48 115.64 110.43 1sr3 s THR 83 Ca 0.31 -1.16 0.01 0.00 0.31 0.00 0.00 61.69 61.15 1sr3 s THR 83 Cb 0.02 -2.23 0.02 0.00 0.01 0.00 0.00 72.50 70.32 1sr3 s THR 83 CO 0.14 0.33 -0.08 0.27 -0.69 0.00 0.00 174.62 174.59 1sr3 s ILE 84 N -0.95 0.86 0.46 1.82 -4.36 -0.35 -1.66 121.20 117.03 1sr3 s ILE 84 Ca 0.15 -0.27 0.05 0.00 -0.26 0.00 0.00 60.65 60.32 1sr3 s ILE 84 Cb -0.11 -0.85 -0.04 0.00 1.25 0.00 0.00 42.46 42.71 1sr3 s ILE 84 CO 0.06 0.31 0.10 -0.72 0.24 0.00 0.00 174.94 174.93 1sr3 s TYR 85 N 1.13 2.21 0.00 1.37 1.13 0.79 -0.89 117.35 123.09 1sr3 s TYR 85 Ca -0.07 -0.77 0.00 0.00 -1.41 0.00 0.00 57.07 54.83 1sr3 s TYR 85 Cb -0.14 -1.78 0.00 0.00 -1.10 0.00 0.00 41.96 38.94 1sr3 s TYR 85 CO -0.01 0.20 0.00 -3.47 -2.51 0.00 0.00 175.55 169.76 1sr3 n ASP 86 N -1.23 0.00 0.00 -0.18 2.03 -0.51 -0.38 116.55 116.28 1sr3 n ASP 86 Ca -0.08 -0.45 0.04 0.00 0.52 0.00 0.00 54.79 54.82 1sr3 n ASP 86 Cb 0.66 0.00 0.22 0.00 -0.72 0.00 0.00 41.12 41.28 1sr3 n ASP 86 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1sr3 n ALA 87 N -3.00 1.57 -0.57 -1.67 0.00 -1.26 -4.07 120.51 111.51 1sr3 n ALA 87 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.40 1sr3 n ALA 87 Cb 0.00 -1.14 0.00 0.00 0.00 0.00 0.00 19.45 18.31 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 -1.31 0.00 -0.47 0.00 -0.58 -1.26 -5.14 120.64 111.88 1sr3 n GLU 88 Ca 0.04 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.78 1sr3 n GLU 88 Cb 0.07 -0.04 0.00 0.00 -0.57 0.00 0.00 31.44 30.90 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 3.44 6.19 3.18 0.62 0.00 -0.24 -4.98 105.19 113.40 1sr3 n GLY 89 Ca 0.00 -1.84 -0.08 0.00 0.00 0.00 0.00 46.02 44.10 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 0.53 0.22 0.02 1.61 1.04 -1.24 -1.43 113.70 114.45 1sr3 s SER 90 Ca 0.00 -0.77 0.01 0.00 0.48 0.00 0.00 55.95 55.66 1sr3 s SER 90 Cb 0.00 0.31 -0.01 0.00 0.10 0.00 0.00 66.02 66.41 1sr3 s SER 90 CO 0.00 -0.70 -0.04 0.68 0.98 0.00 0.00 173.24 174.16 1sr3 s VAL 91 N -3.89 0.27 0.50 5.02 -7.23 -0.07 -4.92 120.40 110.08 1sr3 s VAL 91 Ca 0.07 -0.58 -0.19 0.00 -1.81 0.00 0.00 61.98 59.47 1sr3 s VAL 91 Cb 0.06 -0.31 -0.08 0.00 0.56 0.00 0.00 36.38 36.60 1sr3 s VAL 91 CO -0.10 -0.21 1.01 -1.81 -0.31 0.00 0.00 175.10 173.69 1sr3 s ASP 92 N -0.84 6.41 0.00 4.85 1.01 -1.13 -1.21 116.67 125.77 1sr3 s ASP 92 Ca -0.06 1.78 0.03 0.00 0.71 0.00 0.00 52.55 55.01 1sr3 s ASP 92 Cb -0.06 -2.54 -0.01 0.00 1.01 0.00 0.00 42.92 41.32 1sr3 s ASP 92 CO -0.00 -0.73 -0.11 0.68 0.21 0.00 0.00 175.17 175.22 1sr3 s VAL 93 N -2.26 0.87 -0.16 -1.27 -7.23 0.37 -1.76 120.40 108.97 1sr3 s VAL 93 Ca 0.64 -0.58 -0.06 0.00 -1.81 0.00 0.00 61.98 60.17 1sr3 s VAL 93 Cb -0.13 -0.75 -0.04 0.00 0.56 0.00 0.00 36.38 36.02 1sr3 s VAL 93 CO 0.24 0.17 0.05 -0.55 -0.31 0.00 0.00 175.10 174.70 1sr3 s SER 94 N -0.47 5.55 0.26 4.85 0.15 -0.03 -1.23 113.70 122.77 1sr3 s SER 94 Ca 0.03 0.11 0.02 0.00 0.70 0.00 0.00 55.95 56.81 1sr3 s SER 94 Cb -0.05 -1.87 -0.05 0.00 -1.71 0.00 0.00 66.02 62.34 1sr3 s SER 94 CO -0.00 0.23 0.06 -0.47 1.20 0.00 0.00 173.24 174.26 1sr3 s TYR 95 N 0.01 1.59 -0.28 3.44 5.04 0.69 -0.44 117.35 127.41 1sr3 s TYR 95 Ca 0.05 -1.07 -0.00 0.00 -2.44 0.00 0.00 57.07 53.62 1sr3 s TYR 95 Cb -0.12 -0.95 0.17 0.00 0.35 0.00 0.00 41.96 41.40 1sr3 s TYR 95 CO 0.01 -0.19 0.50 -2.00 -1.34 0.00 0.00 175.55 172.53 1sr3 s GLU 96 N -3.96 0.47 0.00 4.97 2.12 -1.26 -1.44 118.70 119.60 1sr3 s GLU 96 Ca 0.34 0.66 0.00 0.00 0.36 0.00 0.00 54.97 56.33 1sr3 s GLU 96 Cb 0.07 0.06 0.00 0.00 0.26 0.00 0.00 34.13 34.52 1sr3 s GLU 96 CO 0.12 -0.75 0.00 0.41 -0.54 0.00 0.00 175.26 174.50 1sr3 n GLY 97 N 5.40 0.00 2.18 -1.50 0.00 -0.59 -4.88 105.19 105.81 1sr3 n GLY 97 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 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 0.00-13.53 -2.50 -0.61 3.06 -1.23 -4.97 119.36 99.58 1sr3 n ILE 98 Ca 0.00 3.38 -0.35 0.00 -2.50 0.00 0.00 62.75 63.27 1sr3 n ILE 98 Cb 0.00 -5.66 -0.03 0.00 0.54 0.00 0.00 39.64 34.49 1sr3 n ILE 98 CO 0.00 0.00 0.00 -0.76 -2.50 0.00 0.00 176.55 173.29 1sr3 s LEU 99 N -0.54 3.96 0.82 9.51 1.43 -1.26 -5.00 118.68 127.60 1sr3 s LEU 99 Ca 0.00 2.01 -0.13 0.00 -1.03 0.00 0.00 54.13 54.99 1sr3 s LEU 99 Cb 0.00 -4.40 0.09 0.00 0.03 0.00 0.00 46.19 41.91 1sr3 s LEU 99 CO 0.00 -0.71 1.19 -2.16 0.23 0.00 0.00 176.35 174.90 1sr3 s PRO 100 N -2.93 1.55 0.21 1.29 0.04 -1.26 -4.89 135.00 129.02 1sr3 s PRO 100 Ca 0.64 1.71 -0.09 0.00 0.04 0.00 0.00 61.00 63.30 1sr3 s PRO 100 Cb -0.20 -1.77 0.17 0.00 0.04 0.00 0.00 34.50 32.74 1sr3 s PRO 100 CO 0.24 -2.27 1.83 0.22 0.04 0.00 0.00 177.00 177.06 1sr3 h ASP 101 N -1.06 1.02 -0.14 6.66 3.58 -2.03 -1.30 116.42 123.15 1sr3 h ASP 101 Ca -0.46 -0.11 0.04 0.00 0.42 0.00 0.00 57.03 56.92 1sr3 h ASP 101 Cb 1.29 -0.26 -0.01 0.00 1.72 0.00 0.00 39.33 42.07 1sr3 h ASP 101 CO 0.46 0.84 0.12 -0.07 -2.88 0.00 0.00 179.24 177.71 1sr3 h LEU 102 N 1.13 0.00 -9.51 2.28 4.07 -1.95 -3.42 115.31 107.91 1sr3 h LEU 102 Ca 0.28 0.00 -0.58 0.00 0.08 0.00 0.00 57.88 57.66 1sr3 h LEU 102 Cb 0.06 0.00 0.06 0.00 1.08 0.00 0.00 40.66 41.86 1sr3 h LEU 102 CO -0.04 0.00 0.81 0.33 -1.08 0.00 0.00 178.44 178.46 1sr3 n PHE 103 N -4.18 2.30 -3.42 1.13 -0.00 -0.49 -4.99 117.46 107.80 1sr3 n PHE 103 Ca 0.01 0.25 0.00 0.00 -0.00 0.00 0.00 57.45 57.71 1sr3 n PHE 103 Cb 0.24 -2.55 0.00 0.00 -0.00 0.00 0.00 39.48 37.17 1sr3 n PHE 103 CO 0.00 0.00 0.00 2.89 -0.00 0.00 0.00 176.76 179.65 1sr3 n ARG 104 N 3.51 1.91 -3.93 -4.13 1.85 -1.26 -4.94 116.66 109.67 1sr3 n ARG 104 Ca 0.17 0.00 -0.35 0.00 -1.00 0.00 0.00 57.85 56.67 1sr3 n ARG 104 Cb 0.29 0.00 -0.10 0.00 -1.05 0.00 0.00 32.46 31.60 1sr3 n ARG 104 CO 0.00 0.00 0.00 -1.21 -0.01 0.00 0.00 177.63 176.41 1sr3 s GLU 105 N -0.27 4.00 0.00 2.89 2.02 -1.26 -4.59 118.70 121.49 1sr3 s GLU 105 Ca 0.00 -0.33 0.00 0.00 0.02 0.00 0.00 54.97 54.66 1sr3 s GLU 105 Cb 0.00 -3.27 0.00 0.00 0.10 0.00 0.00 34.13 30.96 1sr3 s GLU 105 CO 0.00 0.24 0.00 0.41 0.02 0.00 0.00 175.26 175.93 1sr3 n GLY 106 N 3.64 0.89 3.98 -1.39 0.00 -0.58 -4.86 105.19 106.87 1sr3 n GLY 106 Ca -0.16 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.87 3.09 0.19 1.61 -2.07 -1.26 -4.71 119.66 115.64 1sr3 s GLN 107 Ca 0.00 -0.92 -0.30 0.00 -1.82 0.00 0.00 55.36 52.32 1sr3 s GLN 107 Cb 0.00 -2.77 -0.09 0.00 -1.09 0.00 0.00 33.01 29.07 1sr3 s GLN 107 CO 0.00 -0.02 1.33 0.20 -1.32 0.00 0.00 175.29 175.48 1sr3 s GLY 108 N -4.19 2.40 0.19 2.60 0.00 -1.26 -0.68 107.32 106.37 1sr3 s GLY 108 Ca 0.46 1.13 0.05 0.00 0.00 0.00 0.00 44.72 46.35 1sr3 s GLY 108 CO 0.32 2.12 -0.07 -1.34 0.00 0.00 0.00 173.10 174.13 1sr3 s VAL 109 N 0.21 1.22 -0.04 1.40 -7.23 0.57 -4.37 120.40 112.16 1sr3 s VAL 109 Ca 0.58 -2.07 0.06 0.00 -1.81 0.00 0.00 61.98 58.73 1sr3 s VAL 109 Cb -0.37 -2.05 -0.02 0.00 0.56 0.00 0.00 36.38 34.50 1sr3 s VAL 109 CO 0.38 -0.58 -0.23 -0.69 -0.31 0.00 0.00 175.10 173.68 1sr3 s VAL 110 N -3.30 2.32 0.36 1.32 1.01 0.38 -1.09 120.40 121.40 1sr3 s VAL 110 Ca 0.22 -0.99 0.09 0.00 0.00 0.00 0.00 61.98 61.29 1sr3 s VAL 110 Cb 0.03 -1.85 -0.06 0.00 0.00 0.00 0.00 36.38 34.51 1sr3 s VAL 110 CO 0.04 0.58 0.01 0.68 0.00 0.00 0.00 175.10 176.41 1sr3 s VAL 111 N -0.50 2.44 -0.12 2.92 -7.23 -0.16 -0.56 120.40 117.19 1sr3 s VAL 111 Ca 0.06 -1.99 -0.27 0.00 -1.81 0.00 0.00 61.98 57.98 1sr3 s VAL 111 Cb -0.11 -2.81 0.06 0.00 0.56 0.00 0.00 36.38 34.08 1sr3 s VAL 111 CO 0.01 -0.16 0.64 -1.58 -0.31 0.00 0.00 175.10 173.70 1sr3 s GLN 112 N -3.71 0.92 0.00 4.82 0.74 -1.26 -0.59 119.66 120.58 1sr3 s GLN 112 Ca 0.35 0.46 0.00 0.00 0.05 0.00 0.00 55.36 56.22 1sr3 s GLN 112 Cb 0.02 0.44 0.00 0.00 1.10 0.00 0.00 33.01 34.57 1sr3 s GLN 112 CO 0.19 -0.23 0.00 0.41 -0.55 0.00 0.00 175.29 175.11 1sr3 n GLY 113 N 1.61 -0.09 3.23 2.59 0.00 -0.65 0.38 105.19 112.26 1sr3 n GLY 113 Ca -0.17 -0.09 -0.13 0.00 0.00 0.00 0.00 46.02 45.63 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 1.06 0.06 1.61 2.12 -1.20 -1.78 118.70 120.57 1sr3 s GLU 114 Ca 0.00 -1.49 -0.27 0.00 0.36 0.00 0.00 54.97 53.57 1sr3 s GLU 114 Cb 0.00 -0.32 -0.05 0.00 0.26 0.00 0.00 34.13 34.02 1sr3 s GLU 114 CO 0.00 -0.08 0.86 -1.17 -0.54 0.00 0.00 175.26 174.33 1sr3 s LEU 115 N -3.15 4.45 -0.03 2.70 2.96 -1.13 -0.83 118.68 123.65 1sr3 s LEU 115 Ca 0.21 1.59 -0.00 0.00 -0.22 0.00 0.00 54.13 55.71 1sr3 s LEU 115 Cb 0.05 -3.40 -0.00 0.00 0.50 0.00 0.00 46.19 43.34 1sr3 s LEU 115 CO 0.02 -0.05 -0.00 -0.08 -1.32 0.00 0.00 176.35 174.91 1sr3 h GLU 116 N 5.79 0.00 0.00 1.98 4.22 -0.86 -3.42 114.58 122.30 1sr3 h GLU 116 Ca -0.43 0.00 0.03 0.00 0.08 0.00 0.00 59.36 59.04 1sr3 h GLU 116 Cb 1.21 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.45 1sr3 h GLU 116 CO 0.72 0.00 0.11 1.63 -2.18 0.00 0.00 179.01 179.29 1sr3 n LYS 117 N -2.94 0.13 0.00 1.92 5.02 -1.26 -4.93 118.16 116.10 1sr3 n LYS 117 Ca -0.00 -0.29 0.00 0.00 -2.02 0.00 0.00 58.31 56.00 1sr3 n LYS 117 Cb 0.01 0.39 0.00 0.00 -0.02 0.00 0.00 35.03 35.40 1sr3 n LYS 117 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1sr3 n GLY 118 N -0.14 0.00 3.05 0.72 0.00 -1.26 -1.34 105.19 106.22 1sr3 n GLY 118 Ca -0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 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 0.00 -6.00 -4.10 1.61 5.03 -1.26 -4.96 115.26 105.57 1sr3 n ASN 119 Ca 0.00 -0.30 -0.26 0.00 0.87 0.00 0.00 54.58 54.89 1sr3 n ASN 119 Cb 0.00 -4.85 -0.16 0.00 -1.02 0.00 0.00 39.78 33.74 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 -3.17 1.70 -0.19 3.10 2.46 -0.45 -2.83 115.29 115.93 1sr3 s HIS 120 Ca 0.31 -0.57 -0.03 0.00 0.47 0.00 0.00 55.06 55.24 1sr3 s HIS 120 Cb -0.14 -1.18 -0.02 0.00 -0.13 0.00 0.00 32.58 31.11 1sr3 s HIS 120 CO 0.39 -0.24 -0.05 0.42 -2.47 0.00 0.00 174.74 172.79 1sr3 s ILE 121 N 0.31 3.55 -1.39 0.89 -1.09 -0.72 -0.25 121.20 122.50 1sr3 s ILE 121 Ca -0.10 -0.46 -0.16 0.00 -2.23 0.00 0.00 60.65 57.71 1sr3 s ILE 121 Cb -0.14 -2.58 0.05 0.00 -1.58 0.00 0.00 42.46 38.21 1sr3 s ILE 121 CO 0.04 0.46 2.05 0.18 -1.23 0.00 0.00 174.94 176.43 1sr3 n LEU 122 N 4.17 6.10 -4.57 2.97 7.99 -0.01 -0.85 117.00 132.79 1sr3 n LEU 122 Ca -0.18 -4.03 -0.58 0.00 -0.01 0.00 0.00 56.01 51.22 1sr3 n LEU 122 Cb 0.52 -1.68 -0.08 0.00 -0.11 0.00 0.00 43.42 42.07 1sr3 n LEU 122 CO 0.31 0.71 0.80 0.00 -1.51 0.00 0.00 177.39 177.70 1sr3 n ALA 123 N 7.02 -2.29 -0.07 -1.18 0.00 0.42 -3.24 120.51 121.18 1sr3 n ALA 123 Ca 0.51 0.55 -0.03 0.00 0.00 0.00 0.00 53.44 54.46 1sr3 n ALA 123 Cb 0.42 -1.91 -0.15 0.00 0.00 0.00 0.00 19.45 17.80 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 2.41 0.85 0.00 0.00 -0.00 0.16 -4.29 118.16 117.29 1sr3 n LYS 124 Ca 0.21 -0.06 0.00 0.00 -0.00 0.00 0.00 58.31 58.46 1sr3 n LYS 124 Cb 0.10 -1.48 0.00 0.00 -0.00 0.00 0.00 35.03 33.65 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 -2.54 0.00 -1.60 -1.58 0.28 -1.26 -4.90 120.64 109.04 1sr3 n GLU 125 Ca -0.22 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.78 1sr3 n GLU 125 Cb 0.93 -0.48 0.00 0.00 1.43 0.00 0.00 31.44 33.32 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 -1.85 -3.98 -4.10 3.84 0.31 -1.26 -4.92 118.33 106.37 1sr3 n VAL 126 Ca 0.00 1.87 -0.08 0.00 -0.01 0.00 0.00 64.34 66.13 1sr3 n VAL 126 Cb 0.08 -2.74 -0.10 0.00 -0.91 0.00 0.00 33.84 30.17 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 -4.25 2.49 -0.28 7.52 1.43 0.27 -4.89 118.68 120.97 1sr3 s LEU 127 Ca 0.00 -1.00 0.10 0.00 -1.03 0.00 0.00 54.13 52.20 1sr3 s LEU 127 Cb 0.00 0.15 0.47 0.00 0.03 0.00 0.00 46.19 46.83 1sr3 s LEU 127 CO 0.00 -0.57 1.18 0.00 0.23 0.00 0.00 176.35 177.19 1sr3 n ALA 128 N 0.10 4.59 -2.89 4.21 0.00 -1.26 -0.47 120.51 124.78 1sr3 n ALA 128 Ca -0.14 -3.61 0.00 0.00 0.00 0.00 0.00 53.44 49.70 1sr3 n ALA 128 Cb 0.61 -0.41 0.00 0.00 0.00 0.00 0.00 19.45 19.65 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 -0.70 -0.56 0.22 0.00 5.02 -1.26 -4.81 118.16 116.07 1sr3 n LYS 129 Ca 0.37 -0.28 0.15 0.00 -2.02 0.00 0.00 58.31 56.54 1sr3 n LYS 129 Cb 0.94 0.50 0.69 0.00 -0.02 0.00 0.00 35.03 37.14 1sr3 n LYS 129 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1sr3 h HIS 130 N 2.02 0.00 0.00 2.13 3.86 -1.96 -3.46 115.15 117.75 1sr3 h HIS 130 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1sr3 h HIS 130 Cb 0.00 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.47 1sr3 h HIS 130 CO 0.00 0.00 0.00 -3.47 0.86 0.00 0.00 177.93 175.32 1sr3 n ASP 131 N -2.65 0.00 -4.62 2.45 2.03 -1.26 -5.08 116.55 107.41 1sr3 n ASP 131 Ca 0.00 0.00 -0.50 0.00 0.52 0.00 0.00 54.79 54.81 1sr3 n ASP 131 Cb 0.19 0.00 -0.05 0.00 -0.72 0.00 0.00 41.12 40.54 1sr3 n ASP 131 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1sr3 n GLU 132 N -1.63 1.54 -0.02 -0.67 -0.58 -1.26 -4.91 120.64 113.11 1sr3 n GLU 132 Ca 0.00 0.55 -0.01 0.00 -0.42 0.00 0.00 57.16 57.29 1sr3 n GLU 132 Cb 0.00 -2.25 -0.05 0.00 -0.57 0.00 0.00 31.44 28.58 1sr3 n GLU 132 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 1sr3 n ASN 133 N 2.89 3.61 -3.36 1.62 5.15 -1.26 -5.07 115.26 118.83 1sr3 n ASN 133 Ca 0.18 0.00 -0.20 0.00 -0.60 0.00 0.00 54.58 53.96 1sr3 n ASN 133 Cb 0.23 0.86 -0.06 0.00 -0.53 0.00 0.00 39.78 40.28 1sr3 n ASN 133 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1sr3 n TYR 134 N -2.03 0.07 -3.53 1.20 4.11 -1.26 -5.12 117.16 110.59 1sr3 n TYR 134 Ca -0.06 -2.11 -0.42 0.00 -0.00 0.00 0.00 57.90 55.31 1sr3 n TYR 134 Cb 0.50 0.01 -0.09 0.00 -0.00 0.00 0.00 39.34 39.76 1sr3 n TYR 134 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 176.86 177.85 1sr3 s THR 135 N -2.80 4.60 1.18 -3.48 2.01 -1.26 -5.10 115.64 110.79 1sr3 s THR 135 Ca 0.18 -1.24 -0.17 0.00 0.31 0.00 0.00 61.69 60.77 1sr3 s THR 135 Cb 0.01 -3.77 0.27 0.00 0.01 0.00 0.00 72.50 69.03 1sr3 s THR 135 CO 0.12 -0.51 1.07 -2.16 -0.69 0.00 0.00 174.62 172.46 1sr3 s PRO 136 N 1.51 -1.03 0.15 4.92 0.04 -1.26 -4.99 135.00 134.34 1sr3 s PRO 136 Ca 0.03 0.21 -0.09 0.00 0.04 0.00 0.00 61.00 61.19 1sr3 s PRO 136 Cb -0.23 -1.59 -0.02 0.00 0.04 0.00 0.00 34.50 32.70 1sr3 s PRO 136 CO 0.04 -3.64 1.44 -1.00 0.04 0.00 0.00 177.00 173.88 1sr3 h PRO 137 N -2.54 0.78 -1.45 0.56 0.13 -2.02 -3.36 132.00 124.10 1sr3 h PRO 137 Ca -0.49 -0.49 0.00 0.00 -0.87 0.00 0.00 66.00 64.14 1sr3 h PRO 137 Cb 1.32 0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.50 1sr3 h PRO 137 CO 0.42 1.12 0.00 -1.91 -0.23 0.00 0.00 178.00 177.40 1sr3 n GLU 138 N -3.99 0.77 0.00 0.86 2.13 -1.26 -1.95 120.64 117.20 1sr3 n GLU 138 Ca -0.04 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.78 1sr3 n GLU 138 Cb 0.62 -1.11 0.00 0.00 0.27 0.00 0.00 31.44 31.21 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 0.90 0.00 -0.20 6.31 0.24 -1.26 -4.57 118.33 119.75 1sr3 n VAL 139 Ca 0.00 0.00 -0.08 0.00 -2.04 0.00 0.00 64.34 62.22 1sr3 n VAL 139 Cb 0.39 0.00 0.02 0.00 -1.47 0.00 0.00 33.84 32.78 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 0.87 -0.00 7.34 4.11 -1.54 -3.39 114.58 121.97 1sr3 h GLU 140 Ca 0.00 -0.19 -0.14 0.00 0.07 0.00 0.00 59.36 59.10 1sr3 h GLU 140 Cb 0.00 -0.12 -0.14 0.00 0.50 0.00 0.00 28.75 28.99 1sr3 h GLU 140 CO 0.00 0.79 -0.26 1.17 0.07 0.00 0.00 179.01 180.78 1sr3 n LYS 141 N -4.44 0.44 -0.46 1.06 0.00 -1.26 -5.05 118.16 108.46 1sr3 n LYS 141 Ca 0.03 -1.19 0.00 0.00 0.00 0.00 0.00 58.31 57.14 1sr3 n LYS 141 Cb 0.21 -0.83 0.00 0.00 0.00 0.00 0.00 35.03 34.41 1sr3 n LYS 141 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1sr3 n ALA 142 N 1.59 1.92 -0.29 3.14 0.00 -1.26 -5.06 120.51 120.54 1sr3 n ALA 142 Ca 0.05 -0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.26 1sr3 n ALA 142 Cb 0.67 -0.11 0.00 0.00 0.00 0.00 0.00 19.45 20.01 1sr3 n ALA 142 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17