#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wgt n GLY 4 N -0.83 0.88 0.31 0.00 0.00 -0.50 -1.93 105.19 103.12 1wgt n GLY 4 Ca -0.04 -0.76 -0.02 0.00 0.00 0.00 0.00 46.02 45.19 1wgt n GLY 4 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1wgt h GLU 5 N 0.00 0.87 0.00 1.61 4.22 -1.93 0.16 114.58 119.50 1wgt h GLU 5 Ca 0.00 -0.15 0.00 0.00 0.08 0.00 0.00 59.36 59.29 1wgt h GLU 5 Cb 0.00 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.10 1wgt h GLU 5 CO 0.00 0.73 0.00 1.96 -2.18 0.00 0.00 179.01 179.52 1wgt h GLN 6 N 0.85 0.00 -0.04 1.92 7.50 -1.89 -2.82 115.11 120.63 1wgt h GLN 6 Ca 0.20 0.00 -0.01 0.00 0.50 0.00 0.00 58.65 59.34 1wgt h GLN 6 Cb 0.20 0.00 -0.01 0.00 0.05 0.00 0.00 27.48 27.73 1wgt h GLN 6 CO -0.01 0.00 -0.19 0.41 -1.50 0.00 0.00 178.83 177.53 1wgt n GLY 7 N -0.18 4.94 2.29 3.46 0.00 -0.26 -4.66 105.19 110.77 1wgt n GLY 7 Ca 0.00 -1.20 -0.14 0.00 0.00 0.00 0.00 46.02 44.68 1wgt n GLY 7 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1wgt n SER 8 N -1.25 -4.42 0.00 1.61 7.64 -0.46 -2.54 113.62 114.21 1wgt n SER 8 Ca 0.18 0.02 0.00 0.00 1.01 0.00 0.00 58.87 60.09 1wgt n SER 8 Cb 0.70 -3.53 0.00 0.00 -1.01 0.00 0.00 64.21 60.36 1wgt n SER 8 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wgt n GLY 9 N -1.04 1.86 3.48 0.23 0.00 0.39 -4.98 105.19 105.14 1wgt n GLY 9 Ca -0.17 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.40 1wgt n GLY 9 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1wgt n MET 10 N -2.00 0.65 -4.39 1.61 2.81 -1.05 -4.52 117.12 110.22 1wgt n MET 10 Ca 0.00 0.23 -0.30 0.00 -1.81 0.00 0.00 57.70 55.82 1wgt n MET 10 Cb 0.00 -1.44 -0.11 0.00 -0.71 0.00 0.00 33.22 30.96 1wgt n MET 10 CO 0.00 0.00 0.00 -1.21 1.51 0.00 0.00 175.97 176.27 1wgt s GLU 11 N -1.36 2.05 0.71 0.03 2.02 -1.26 -1.41 118.70 119.48 1wgt s GLU 11 Ca 0.62 -1.03 -0.11 0.00 0.02 0.00 0.00 54.97 54.47 1wgt s GLU 11 Cb -0.75 -2.23 0.02 0.00 0.10 0.00 0.00 34.13 31.26 1wgt s GLU 11 CO 0.58 0.52 1.07 0.00 0.02 0.00 0.00 175.26 177.45 1wgt s PRO 13 N -5.01 3.13 -1.61 0.00 0.04 -1.26 -4.28 135.00 126.01 1wgt s PRO 13 Ca 0.59 1.06 -0.11 0.00 0.04 0.00 0.00 61.00 62.57 1wgt s PRO 13 Cb -0.15 -2.01 0.10 0.00 0.04 0.00 0.00 34.50 32.48 1wgt s PRO 13 CO 0.55 -0.96 0.58 0.09 0.04 0.00 0.00 177.00 177.31 1wgt n ASN 14 N -2.63 -1.88 -0.21 6.66 4.13 -1.26 -1.29 115.26 118.79 1wgt n ASN 14 Ca 0.08 -1.05 -0.03 0.00 1.68 0.00 0.00 54.58 55.26 1wgt n ASN 14 Cb 0.53 -2.67 -0.01 0.00 -1.54 0.00 0.00 39.78 36.09 1wgt n ASN 14 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 1wgt n ASN 15 N -2.77 -5.67 -4.71 6.41 3.02 -1.26 -4.96 115.26 105.32 1wgt n ASN 15 Ca -0.08 0.07 -0.42 0.00 -0.03 0.00 0.00 54.58 54.11 1wgt n ASN 15 Cb 0.57 -3.41 -0.00 0.00 -0.61 0.00 0.00 39.78 36.33 1wgt n ASN 15 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1wgt n LEU 16 N -0.31 3.79 -4.76 3.41 4.32 -0.41 -0.76 117.00 122.28 1wgt n LEU 16 Ca -0.03 1.19 -0.40 0.00 -0.02 0.00 0.00 56.01 56.75 1wgt n LEU 16 Cb 0.48 -1.50 -0.05 0.00 -1.62 0.00 0.00 43.42 40.73 1wgt n LEU 16 CO 0.04 -0.44 0.75 0.00 -1.22 0.00 0.00 177.39 176.52 1wgt s SER 19 N 2.32 0.66 0.20 0.00 1.04 -0.45 -0.57 113.70 116.91 1wgt s SER 19 Ca 0.16 1.41 0.18 0.00 0.48 0.00 0.00 55.95 58.17 1wgt s SER 19 Cb -0.18 -2.17 0.83 0.00 0.10 0.00 0.00 66.02 64.60 1wgt s SER 19 CO 0.14 -4.38 1.54 0.00 0.98 0.00 0.00 173.24 171.51 1wgt n GLN 20 N -5.03 0.11 0.00 4.02 10.64 -0.82 -1.81 117.38 124.50 1wgt n GLN 20 Ca 0.03 0.49 0.12 0.00 -1.83 0.00 0.00 57.00 55.81 1wgt n GLN 20 Cb 0.55 -1.79 0.15 0.00 -0.86 0.00 0.00 30.24 28.29 1wgt n GLN 20 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 1wgt n TYR 21 N -2.01 0.00 -1.46 2.61 4.01 -1.26 -4.98 117.16 114.07 1wgt n TYR 21 Ca 0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.75 1wgt n TYR 21 Cb 0.11 -0.02 0.00 0.00 -0.31 0.00 0.00 39.34 39.12 1wgt n TYR 21 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1wgt n GLY 22 N 1.36 0.89 3.51 2.72 0.00 -0.75 -4.94 105.19 107.99 1wgt n GLY 22 Ca 0.12 -0.59 -0.25 0.00 0.00 0.00 0.00 46.02 45.30 1wgt n GLY 22 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1wgt s TYR 23 N -2.13 2.36 -0.17 1.61 2.02 -1.26 -1.39 117.35 118.39 1wgt s TYR 23 Ca 0.00 -0.41 -0.05 0.00 -0.37 0.00 0.00 57.07 56.24 1wgt s TYR 23 Cb 0.00 -1.19 -0.03 0.00 -0.40 0.00 0.00 41.96 40.33 1wgt s TYR 23 CO 0.00 0.65 0.01 0.00 -1.57 0.00 0.00 175.55 174.64 1wgt n GLY 25 N 3.61 2.21 3.03 0.00 0.00 -0.86 -4.99 105.19 108.19 1wgt n GLY 25 Ca -0.17 -0.51 -0.12 0.00 0.00 0.00 0.00 46.02 45.22 1wgt n GLY 25 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1wgt s MET 26 N 1.55 0.23 0.00 1.61 1.75 -1.26 -2.10 119.30 121.09 1wgt s MET 26 Ca 0.00 -0.00 0.00 0.00 -1.25 0.00 0.00 55.69 54.44 1wgt s MET 26 Cb 0.00 0.10 0.00 0.00 2.84 0.00 0.00 34.83 37.77 1wgt s MET 26 CO 0.00 -0.04 0.00 0.41 -0.65 0.00 0.00 175.02 174.74 1wgt n GLY 27 N 2.57 1.95 0.31 2.11 0.00 -1.26 -4.77 105.19 106.09 1wgt n GLY 27 Ca -0.15 -1.98 0.14 0.00 0.00 0.00 0.00 46.02 44.02 1wgt n GLY 27 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1wgt h GLY 28 N 0.00 0.00 1.90 -0.02 0.00 -2.00 -0.29 103.07 102.65 1wgt h GLY 28 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1wgt h GLY 28 CO 0.00 0.00 -0.08 1.22 0.00 0.00 0.00 176.54 177.68 1wgt n ASP 29 N -4.13 0.75 -0.07 0.19 8.00 -1.26 -1.93 116.55 118.10 1wgt n ASP 29 Ca -0.00 0.51 -0.15 0.00 0.71 0.00 0.00 54.79 55.86 1wgt n ASP 29 Cb 0.22 -0.66 -0.05 0.00 -0.02 0.00 0.00 41.12 40.60 1wgt n ASP 29 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 1wgt n TYR 30 N -2.20 0.00 0.26 1.24 4.02 -0.81 -4.71 117.16 114.97 1wgt n TYR 30 Ca 0.05 0.00 0.12 0.00 -0.01 0.00 0.00 57.90 58.06 1wgt n TYR 30 Cb 0.43 -0.50 0.19 0.00 -0.02 0.00 0.00 39.34 39.43 1wgt n TYR 30 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1wgt n GLY 32 N 1.13 -2.01 3.61 0.00 0.00 -0.81 -1.66 105.19 105.46 1wgt n GLY 32 Ca 0.04 -1.10 -0.47 0.00 0.00 0.00 0.00 46.02 44.49 1wgt n GLY 32 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1wgt n LYS 33 N 0.00 1.51 -1.12 1.61 3.00 -1.26 -2.21 118.16 119.69 1wgt n LYS 33 Ca 0.00 0.54 -0.04 0.00 -0.00 0.00 0.00 58.31 58.81 1wgt n LYS 33 Cb 0.00 -2.11 -0.02 0.00 0.00 0.00 0.00 35.03 32.91 1wgt n LYS 33 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1wgt n GLY 34 N 2.12 0.68 3.71 3.14 0.00 -1.26 -4.57 105.19 109.00 1wgt n GLY 34 Ca 0.14 -0.46 -0.42 0.00 0.00 0.00 0.00 46.02 45.28 1wgt n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wgt n GLN 36 N 4.76 0.67 -3.91 0.00 6.02 0.26 -4.93 117.38 120.25 1wgt n GLN 36 Ca 0.17 0.22 -0.03 0.00 -0.01 0.00 0.00 57.00 57.34 1wgt n GLN 36 Cb 0.37 -1.70 0.02 0.00 1.02 0.00 0.00 30.24 29.95 1wgt n GLN 36 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1wgt s ASN 37 N -6.14 0.02 0.00 1.08 6.03 -1.25 -4.98 114.94 109.69 1wgt s ASN 37 Ca -0.11 -0.67 0.00 0.00 -1.03 0.00 0.00 52.86 51.05 1wgt s ASN 37 Cb 0.07 0.48 0.00 0.00 -3.03 0.00 0.00 41.25 38.77 1wgt s ASN 37 CO 0.80 -0.96 0.00 0.61 -2.03 0.00 0.00 177.10 175.52 1wgt n GLY 38 N -0.74 -1.16 2.52 0.45 0.00 -1.26 -1.13 105.19 103.86 1wgt n GLY 38 Ca -0.02 -1.52 -0.40 0.00 0.00 0.00 0.00 46.02 44.08 1wgt n GLY 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wgt n ALA 39 N 1.85 6.58 -1.79 4.61 0.00 0.06 -4.90 120.51 126.92 1wgt n ALA 39 Ca 0.00 -3.72 -0.41 0.00 0.00 0.00 0.00 53.44 49.31 1wgt n ALA 39 Cb 0.00 -3.43 -0.01 0.00 0.00 0.00 0.00 19.45 16.00 1wgt n ALA 39 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wgt h TRP 41 N 3.55 0.64 -3.48 0.00 4.06 -1.61 -3.31 115.95 115.80 1wgt h TRP 41 Ca -0.49 0.02 -0.66 0.00 2.06 0.00 0.00 58.89 59.82 1wgt h TRP 41 Cb 1.23 -0.20 -0.16 0.00 -1.00 0.00 0.00 29.16 29.03 1wgt h TRP 41 CO 0.56 0.34 0.09 0.99 -3.56 0.00 0.00 178.44 176.86 1wgt s THR 42 N -6.12 4.84 0.38 1.49 2.01 -1.26 -5.02 115.64 111.95 1wgt s THR 42 Ca -0.13 -0.09 -0.28 0.00 0.31 0.00 0.00 61.69 61.51 1wgt s THR 42 Cb 0.14 -4.23 -0.10 0.00 0.01 0.00 0.00 72.50 68.32 1wgt s THR 42 CO 0.75 -0.66 1.42 -0.44 -0.69 0.00 0.00 174.62 174.99 1wgt s SER 43 N 2.20 6.39 0.54 3.53 0.01 -1.25 -4.97 113.70 120.15 1wgt s SER 43 Ca 0.20 2.90 -0.20 0.00 1.31 0.00 0.00 55.95 60.16 1wgt s SER 43 Cb -0.16 -2.66 -0.05 0.00 0.21 0.00 0.00 66.02 63.36 1wgt s SER 43 CO 0.17 -0.83 1.18 -0.54 0.41 0.00 0.00 173.24 173.63 1wgt s LYS 44 N -2.08 3.30 0.45 12.44 1.02 -1.26 -4.71 119.74 128.89 1wgt s LYS 44 Ca 0.53 1.77 -0.18 0.00 0.02 0.00 0.00 55.97 58.10 1wgt s LYS 44 Cb -0.44 -2.09 -0.10 0.00 -0.52 0.00 0.00 37.83 34.69 1wgt s LYS 44 CO 0.58 -0.92 0.93 1.03 -0.92 0.00 0.00 175.35 176.05 1wgt s ARG 45 N -3.14 4.09 0.32 1.68 1.81 -1.26 -0.01 118.95 122.44 1wgt s ARG 45 Ca 0.72 0.98 -0.19 0.00 -1.72 0.00 0.00 55.73 55.53 1wgt s ARG 45 Cb -0.28 -2.20 0.04 0.00 -0.45 0.00 0.00 34.95 32.05 1wgt s ARG 45 CO 0.32 -0.09 0.76 0.00 -0.68 0.00 0.00 175.30 175.61 1wgt n GLY 47 N -0.49 -0.43 0.31 0.00 0.00 -0.51 -3.12 105.19 100.95 1wgt n GLY 47 Ca -0.06 -1.08 0.07 0.00 0.00 0.00 0.00 46.02 44.96 1wgt n GLY 47 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1wgt h SER 48 N 3.65 0.34 0.98 1.61 4.64 -1.95 0.20 113.55 123.02 1wgt h SER 48 Ca 0.00 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1wgt h SER 48 Cb 0.00 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.01 1wgt h SER 48 CO 0.00 0.23 0.00 0.00 -0.87 0.00 0.00 176.83 176.19 1wgt n GLN 49 N -4.48 0.21 -2.38 4.77 3.00 -1.25 -3.34 117.38 113.91 1wgt n GLN 49 Ca 0.04 0.34 -0.18 0.00 -0.01 0.00 0.00 57.00 57.19 1wgt n GLN 49 Cb 0.17 -1.83 0.02 0.00 0.00 0.00 0.00 30.24 28.59 1wgt n GLN 49 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1wgt n ALA 50 N -1.77 4.37 -2.97 -1.58 0.00 0.19 -4.87 120.51 113.88 1wgt n ALA 50 Ca 0.03 -3.65 -0.19 0.00 0.00 0.00 0.00 53.44 49.64 1wgt n ALA 50 Cb 0.30 -0.56 0.00 0.00 0.00 0.00 0.00 19.45 19.19 1wgt n ALA 50 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wgt n GLY 51 N -0.55 -0.50 2.07 0.00 0.00 -1.05 -0.87 105.19 104.29 1wgt n GLY 51 Ca 0.31 0.06 -0.01 0.00 0.00 0.00 0.00 46.02 46.38 1wgt n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wgt n GLY 52 N -1.07 0.51 3.76 -0.02 0.00 0.46 -5.00 105.19 103.82 1wgt n GLY 52 Ca -0.08 -0.70 -0.41 0.00 0.00 0.00 0.00 46.02 44.84 1wgt n GLY 52 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wgt s LYS 53 N -1.59 4.37 0.48 1.61 1.02 -0.05 -4.73 119.74 120.85 1wgt s LYS 53 Ca 0.00 2.16 -0.08 0.00 0.02 0.00 0.00 55.97 58.07 1wgt s LYS 53 Cb 0.00 -3.12 -0.04 0.00 -0.52 0.00 0.00 37.83 34.15 1wgt s LYS 53 CO 0.00 -0.21 0.82 0.99 -0.92 0.00 0.00 175.35 176.03 1wgt s THR 54 N -0.64 4.84 0.13 2.17 2.01 -1.26 -1.42 115.64 121.47 1wgt s THR 54 Ca 0.52 0.43 -0.30 0.00 0.31 0.00 0.00 61.69 62.65 1wgt s THR 54 Cb -0.39 -3.83 -0.06 0.00 0.01 0.00 0.00 72.50 68.23 1wgt s THR 54 CO 0.47 -0.81 0.95 0.00 -0.69 0.00 0.00 174.62 174.54 1wgt s PRO 56 N -0.22 0.66 -1.39 0.00 0.02 -1.26 -4.13 135.00 128.68 1wgt s PRO 56 Ca 0.46 1.05 -0.02 0.00 0.02 0.00 0.00 61.00 62.51 1wgt s PRO 56 Cb -0.24 -1.72 0.01 0.00 0.02 0.00 0.00 34.50 32.57 1wgt s PRO 56 CO 0.30 -2.72 0.15 0.09 -0.33 0.00 0.00 177.00 174.49 1wgt n ASN 57 N -4.24 -4.87 -3.90 2.53 4.13 -1.26 -2.91 115.26 104.74 1wgt n ASN 57 Ca 0.07 -0.01 -0.29 0.00 1.68 0.00 0.00 54.58 56.03 1wgt n ASN 57 Cb 0.54 -4.06 0.03 0.00 -1.54 0.00 0.00 39.78 34.75 1wgt n ASN 57 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 1wgt n ASN 58 N -2.04 -4.29 -4.88 6.41 3.02 -1.26 -4.98 115.26 107.25 1wgt n ASN 58 Ca -0.16 -0.79 -0.30 0.00 -0.03 0.00 0.00 54.58 53.30 1wgt n ASN 58 Cb 0.63 -3.88 -0.03 0.00 -0.61 0.00 0.00 39.78 35.89 1wgt n ASN 58 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 1wgt s HIS 59 N -3.36 3.47 0.19 3.10 3.76 -1.15 -4.38 115.29 116.93 1wgt s HIS 59 Ca 0.58 0.98 -0.17 0.00 -0.15 0.00 0.00 55.06 56.30 1wgt s HIS 59 Cb -0.29 -2.39 -0.08 0.00 1.11 0.00 0.00 32.58 30.94 1wgt s HIS 59 CO 0.83 -0.05 0.65 0.00 -0.85 0.00 0.00 174.74 175.32 1wgt s SER 62 N 2.37 1.54 0.09 0.00 1.04 -0.69 -0.45 113.70 117.61 1wgt s SER 62 Ca 0.10 1.57 0.23 0.00 0.48 0.00 0.00 55.95 58.32 1wgt s SER 62 Cb -0.21 -2.28 0.93 0.00 0.10 0.00 0.00 66.02 64.56 1wgt s SER 62 CO 0.10 -3.86 1.73 0.00 0.98 0.00 0.00 173.24 172.19 1wgt n GLN 63 N -4.69 0.09 0.00 4.02 -0.00 -1.23 -1.15 117.38 114.41 1wgt n GLN 63 Ca 0.05 0.19 0.16 0.00 -0.00 0.00 0.00 57.00 57.39 1wgt n GLN 63 Cb 0.54 -1.63 0.88 0.00 -0.00 0.00 0.00 30.24 30.04 1wgt n GLN 63 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72 1wgt n TYR 64 N -1.79 0.00 -2.11 2.61 4.01 -1.26 -4.92 117.16 113.71 1wgt n TYR 64 Ca 0.05 0.00 -0.02 0.00 -0.16 0.00 0.00 57.90 57.77 1wgt n TYR 64 Cb 0.29 -0.06 0.01 0.00 -0.31 0.00 0.00 39.34 39.27 1wgt n TYR 64 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1wgt n GLY 65 N 1.07 0.39 2.97 2.72 0.00 -0.30 -4.94 105.19 107.10 1wgt n GLY 65 Ca 0.22 -0.40 -0.15 0.00 0.00 0.00 0.00 46.02 45.69 1wgt n GLY 65 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1wgt s HIS 66 N -3.04 0.47 0.01 1.61 3.76 -1.26 -2.39 115.29 114.46 1wgt s HIS 66 Ca 0.00 -0.18 -0.12 0.00 -0.15 0.00 0.00 55.06 54.62 1wgt s HIS 66 Cb -0.00 -0.29 -0.06 0.00 1.11 0.00 0.00 32.58 33.34 1wgt s HIS 66 CO 0.08 -0.03 0.38 0.00 -0.85 0.00 0.00 174.74 174.32 1wgt n GLY 68 N 1.52 -0.80 3.28 0.00 0.00 0.16 -4.55 105.19 104.80 1wgt n GLY 68 Ca -0.13 -0.74 -0.15 0.00 0.00 0.00 0.00 46.02 45.01 1wgt n GLY 68 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1wgt s PHE 69 N -3.00 1.41 0.00 1.61 0.08 -1.26 -0.48 117.98 116.34 1wgt s PHE 69 Ca 0.00 -1.25 0.00 0.00 0.12 0.00 0.00 56.93 55.80 1wgt s PHE 69 Cb 0.00 -0.78 0.00 0.00 -0.57 0.00 0.00 43.02 41.67 1wgt s PHE 69 CO 0.00 -0.44 0.00 0.41 -0.10 0.00 0.00 175.22 175.09 1wgt n GLY 70 N -0.40 0.27 0.36 4.36 0.00 -1.26 -4.52 105.19 104.00 1wgt n GLY 70 Ca 0.01 -1.87 0.08 0.00 0.00 0.00 0.00 46.02 44.24 1wgt n GLY 70 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wgt h ALA 71 N 0.00 1.77 0.00 4.61 0.00 -2.00 -0.40 119.26 123.23 1wgt h ALA 71 Ca 0.00 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 1wgt h ALA 71 Cb 0.00 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 1wgt h ALA 71 CO 0.00 0.08 -0.14 0.93 0.00 0.00 0.00 179.25 180.12 1wgt h GLU 72 N 0.71 0.00 0.00 0.00 3.07 -1.97 -0.53 114.58 115.86 1wgt h GLU 72 Ca 0.35 0.00 -0.24 0.00 -0.50 0.00 0.00 59.36 58.97 1wgt h GLU 72 Cb 0.41 0.00 -0.04 0.00 -0.84 0.00 0.00 28.75 28.29 1wgt h GLU 72 CO -0.13 0.14 -1.76 0.66 -1.40 0.00 0.00 179.01 176.53 1wgt n TYR 73 N -4.07 0.06 0.16 4.33 4.01 -0.38 -4.61 117.16 116.66 1wgt n TYR 73 Ca -0.02 0.02 0.05 0.00 -0.16 0.00 0.00 57.90 57.79 1wgt n TYR 73 Cb 0.23 -0.77 0.08 0.00 -0.31 0.00 0.00 39.34 38.56 1wgt n TYR 73 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1wgt n GLY 75 N 1.15 -1.92 3.72 0.00 0.00 -0.21 -1.11 105.19 106.83 1wgt n GLY 75 Ca 0.02 -0.83 -0.42 0.00 0.00 0.00 0.00 46.02 44.79 1wgt n GLY 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wgt s ALA 76 N -2.72 3.87 0.00 4.61 0.00 -1.26 -2.01 121.76 124.25 1wgt s ALA 76 Ca 0.00 1.50 0.00 0.00 0.00 0.00 0.00 51.96 53.46 1wgt s ALA 76 Cb 0.00 -3.67 0.00 0.00 0.00 0.00 0.00 23.12 19.45 1wgt s ALA 76 CO 0.00 -0.88 0.00 0.41 0.00 0.00 0.00 175.76 175.29 1wgt n GLY 77 N 3.91 1.61 3.62 0.00 0.00 -1.26 -4.65 105.19 108.42 1wgt n GLY 77 Ca 0.15 0.00 -0.52 0.00 0.00 0.00 0.00 46.02 45.66 1wgt n GLY 77 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wgt n GLN 79 N 3.14 1.59 0.00 0.00 6.02 0.41 -4.97 117.38 123.57 1wgt n GLN 79 Ca 0.19 -1.31 0.00 0.00 -0.01 0.00 0.00 57.00 55.87 1wgt n GLN 79 Cb 0.20 -1.47 0.00 0.00 1.02 0.00 0.00 30.24 29.99 1wgt n GLN 79 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1wgt n GLY 80 N 1.40 1.71 1.06 1.08 0.00 -1.25 -4.95 105.19 104.23 1wgt n GLY 80 Ca 0.11 -0.82 0.00 0.00 0.00 0.00 0.00 46.02 45.31 1wgt n GLY 80 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wgt n GLY 81 N -0.50 -2.83 3.00 -0.02 0.00 -1.26 -0.85 105.19 102.72 1wgt n GLY 81 Ca 0.00 -1.90 -0.25 0.00 0.00 0.00 0.00 46.02 43.87 1wgt n GLY 81 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1wgt n PRO 82 N -0.17 0.98 -1.91 1.61 -0.04 -1.26 -4.92 135.00 129.29 1wgt n PRO 82 Ca 0.00 -1.20 -0.39 0.00 -0.04 0.00 0.00 63.50 61.87 1wgt n PRO 82 Cb 0.00 -2.44 0.01 0.00 -0.04 0.00 0.00 33.50 31.03 1wgt n PRO 82 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1wgt h ARG 84 N 2.19 0.00 -6.89 0.00 3.08 -1.39 -3.42 114.38 107.95 1wgt h ARG 84 Ca -0.50 0.00 -0.49 0.00 0.07 0.00 0.00 59.98 59.06 1wgt h ARG 84 Cb 1.27 0.00 0.02 0.00 0.08 0.00 0.00 29.97 31.33 1wgt h ARG 84 CO 0.60 0.24 0.43 0.00 -1.07 0.00 0.00 179.97 180.18 1wgt s ALA 85 N -4.38 3.23 0.39 0.04 0.00 -1.26 -5.01 121.76 114.77 1wgt s ALA 85 Ca -0.03 0.77 -0.25 0.00 0.00 0.00 0.00 51.96 52.45 1wgt s ALA 85 Cb 0.15 -3.29 -0.09 0.00 0.00 0.00 0.00 23.12 19.89 1wgt s ALA 85 CO 0.69 -0.16 1.12 -0.51 0.00 0.00 0.00 175.76 176.90 1wgt s ASP 86 N -1.27 6.66 -0.24 0.00 1.01 -1.26 -5.00 116.67 116.57 1wgt s ASP 86 Ca 0.51 2.23 -0.03 0.00 0.71 0.00 0.00 52.55 55.98 1wgt s ASP 86 Cb -0.26 -2.61 0.01 0.00 1.01 0.00 0.00 42.92 41.07 1wgt s ASP 86 CO 0.33 -0.57 -0.05 -0.63 0.21 0.00 0.00 175.17 174.46 1wgt s ILE 87 N -1.47 3.15 0.52 0.77 -1.09 -1.26 -5.03 121.20 116.78 1wgt s ILE 87 Ca 0.56 -0.76 -0.19 0.00 -2.23 0.00 0.00 60.65 58.03 1wgt s ILE 87 Cb -0.28 -2.52 -0.07 0.00 -1.58 0.00 0.00 42.46 38.01 1wgt s ILE 87 CO 0.35 0.30 1.03 -0.54 -1.23 0.00 0.00 174.94 174.85 1wgt s LYS 88 N 1.41 3.71 0.27 2.79 1.02 -1.26 -0.23 119.74 127.45 1wgt s LYS 88 Ca 0.03 1.25 -0.20 0.00 0.02 0.00 0.00 55.97 57.07 1wgt s LYS 88 Cb -0.15 -2.09 0.06 0.00 -0.52 0.00 0.00 37.83 35.13 1wgt s LYS 88 CO -0.04 -0.49 0.88 0.00 -0.92 0.00 0.00 175.35 174.79 1wgt n GLY 90 N -0.56 -0.98 0.29 0.00 0.00 -0.39 -3.00 105.19 100.55 1wgt n GLY 90 Ca -0.06 -1.21 0.03 0.00 0.00 0.00 0.00 46.02 44.79 1wgt n GLY 90 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1wgt h SER 91 N 0.00 0.52 -0.41 1.61 4.64 -1.90 0.53 113.55 118.54 1wgt h SER 91 Ca 0.00 0.07 0.12 0.00 -0.47 0.00 0.00 61.79 61.50 1wgt h SER 91 Cb 0.00 -0.02 -0.02 0.00 -0.31 0.00 0.00 62.40 62.05 1wgt h SER 91 CO 0.00 0.28 0.33 1.56 -0.87 0.00 0.00 176.83 178.13 1wgt h GLN 92 N 0.65 0.00 -0.76 4.77 7.50 -1.94 -2.18 115.11 123.15 1wgt h GLN 92 Ca 0.39 0.00 -0.53 0.00 0.50 0.00 0.00 58.65 59.01 1wgt h GLN 92 Cb 0.43 0.00 -0.43 0.00 0.05 0.00 0.00 27.48 27.53 1wgt h GLN 92 CO -0.29 0.00 -0.84 0.00 -1.50 0.00 0.00 178.83 176.21 1wgt n ALA 93 N -2.53 4.85 -2.34 3.87 0.00 0.95 -4.94 120.51 120.38 1wgt n ALA 93 Ca 0.07 -3.74 -0.14 0.00 0.00 0.00 0.00 53.44 49.63 1wgt n ALA 93 Cb 0.52 -0.37 -0.00 0.00 0.00 0.00 0.00 19.45 19.59 1wgt n ALA 93 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wgt n GLY 94 N -0.69 -0.18 2.12 0.00 0.00 -0.82 -3.06 105.19 102.56 1wgt n GLY 94 Ca 0.41 -0.29 0.00 0.00 0.00 0.00 0.00 46.02 46.14 1wgt n GLY 94 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wgt n GLY 95 N -1.05 0.51 3.64 -0.02 0.00 0.15 -4.95 105.19 103.47 1wgt n GLY 95 Ca -0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.46 1wgt n GLY 95 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1wgt n LYS 96 N -2.76 1.55 -3.73 1.61 4.81 -1.17 -4.59 118.16 113.88 1wgt n LYS 96 Ca 0.00 0.55 -0.35 0.00 -0.87 0.00 0.00 58.31 57.64 1wgt n LYS 96 Cb 0.02 -2.17 -0.05 0.00 0.02 0.00 0.00 35.03 32.85 1wgt n LYS 96 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 1wgt s LEU 97 N -1.02 4.38 0.34 3.14 1.43 -1.26 -1.26 118.68 124.43 1wgt s LEU 97 Ca 0.63 0.61 -0.29 0.00 -1.03 0.00 0.00 54.13 54.05 1wgt s LEU 97 Cb -0.54 -2.61 -0.11 0.00 0.03 0.00 0.00 46.19 42.97 1wgt s LEU 97 CO 0.57 0.27 1.42 0.00 0.23 0.00 0.00 176.35 178.84 1wgt s PRO 99 N -1.67 1.72 -1.38 0.00 0.04 -1.26 -4.05 135.00 128.40 1wgt s PRO 99 Ca 0.53 1.48 -0.06 0.00 0.04 0.00 0.00 61.00 62.99 1wgt s PRO 99 Cb -0.43 -1.81 0.04 0.00 0.04 0.00 0.00 34.50 32.33 1wgt s PRO 99 CO 0.56 -2.10 0.46 0.09 0.04 0.00 0.00 177.00 176.05 1wgt n ASN 100 N -3.58 -4.72 -2.17 6.66 4.13 -1.26 -1.52 115.26 112.80 1wgt n ASN 100 Ca 0.11 -0.27 -0.17 0.00 1.68 0.00 0.00 54.58 55.93 1wgt n ASN 100 Cb 0.52 -3.87 -0.03 0.00 -1.54 0.00 0.00 39.78 34.86 1wgt n ASN 100 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 1wgt n ASN 101 N -2.31 -4.98 -4.78 6.41 3.02 -1.26 -4.98 115.26 106.38 1wgt n ASN 101 Ca -0.07 0.17 -0.34 0.00 -0.03 0.00 0.00 54.58 54.30 1wgt n ASN 101 Cb 0.58 -4.25 0.00 0.00 -0.61 0.00 0.00 39.78 35.51 1wgt n ASN 101 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1wgt s LEU 102 N -5.45 3.67 0.07 3.41 2.01 -0.58 -2.15 118.68 119.66 1wgt s LEU 102 Ca 0.00 2.04 -0.24 0.00 0.01 0.00 0.00 54.13 55.95 1wgt s LEU 102 Cb 0.00 -4.56 -0.06 0.00 0.01 0.00 0.00 46.19 41.57 1wgt s LEU 102 CO 0.00 -1.20 0.72 0.00 1.01 0.00 0.00 176.35 176.88 1wgt n SER 105 N 6.02 -1.71 0.27 0.00 3.41 -0.37 0.21 113.62 121.45 1wgt n SER 105 Ca -0.02 0.05 0.13 0.00 -0.26 0.00 0.00 58.87 58.78 1wgt n SER 105 Cb 0.49 -1.18 0.75 0.00 -0.26 0.00 0.00 64.21 64.01 1wgt n SER 105 CO 0.00 0.00 0.00 0.06 -0.16 0.00 0.00 175.04 174.94 1wgt h GLN 106 N -2.12 0.00 -0.00 4.33 3.07 -1.81 -2.38 115.11 116.20 1wgt h GLN 106 Ca -0.52 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.22 1wgt h GLN 106 Cb 1.32 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.88 1wgt h GLN 106 CO 0.41 0.10 -0.15 0.91 0.09 0.00 0.00 178.83 180.19 1wgt n TRP 107 N -3.61 0.00 -0.52 0.06 5.03 -1.26 -4.94 117.44 112.20 1wgt n TRP 107 Ca -0.02 0.00 0.00 0.00 3.03 0.00 0.00 57.50 60.51 1wgt n TRP 107 Cb 0.22 -0.29 0.00 0.00 -1.03 0.00 0.00 31.31 30.21 1wgt n TRP 107 CO 0.00 0.00 0.00 0.41 -0.03 0.00 0.00 177.69 178.07 1wgt n GLY 108 N 1.38 1.22 2.99 6.99 0.00 -0.89 -4.96 105.19 111.92 1wgt n GLY 108 Ca 0.11 -0.17 -0.12 0.00 0.00 0.00 0.00 46.02 45.84 1wgt n GLY 108 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1wgt s TYR 109 N -2.14 0.38 -0.01 1.61 2.02 -1.26 -1.92 117.35 116.03 1wgt s TYR 109 Ca 0.00 -0.38 -0.27 0.00 -0.37 0.00 0.00 57.07 56.05 1wgt s TYR 109 Cb 0.00 -0.25 -0.04 0.00 -0.40 0.00 0.00 41.96 41.28 1wgt s TYR 109 CO 0.00 -0.10 0.85 0.00 -1.57 0.00 0.00 175.55 174.73 1wgt n GLY 111 N 2.84 1.33 3.22 0.00 0.00 -0.63 -4.73 105.19 107.22 1wgt n GLY 111 Ca 0.02 -0.85 -0.13 0.00 0.00 0.00 0.00 46.02 45.06 1wgt n GLY 111 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wgt s LEU 112 N 0.00 0.86 0.00 0.99 1.43 -1.26 -1.45 118.68 119.24 1wgt s LEU 112 Ca 0.00 0.33 0.00 0.00 -1.03 0.00 0.00 54.13 53.43 1wgt s LEU 112 Cb 0.00 1.16 0.00 0.00 0.03 0.00 0.00 46.19 47.38 1wgt s LEU 112 CO 0.00 -0.29 0.00 0.61 0.23 0.00 0.00 176.35 176.90 1wgt n GLY 113 N 2.03 2.47 0.30 -3.19 0.00 -1.26 -4.81 105.19 100.72 1wgt n GLY 113 Ca -0.18 -2.05 0.15 0.00 0.00 0.00 0.00 46.02 43.94 1wgt n GLY 113 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1wgt h SER 114 N 0.00 0.00 1.03 1.61 4.64 -2.00 -0.41 113.55 118.42 1wgt h SER 114 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1wgt h SER 114 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1wgt h SER 114 CO 0.00 0.00 0.00 -0.33 -0.87 0.00 0.00 176.83 175.63 1wgt h GLU 115 N 0.00 0.00 0.00 4.77 3.07 -1.96 -0.27 114.58 120.19 1wgt h GLU 115 Ca 0.02 0.00 -0.10 0.00 -0.50 0.00 0.00 59.36 58.79 1wgt h GLU 115 Cb 0.13 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.02 1wgt h GLU 115 CO -0.00 0.00 -1.35 1.19 -1.40 0.00 0.00 179.01 177.45 1wgt n PHE 116 N -2.40 0.00 0.20 4.33 3.01 -0.61 -4.76 117.46 117.24 1wgt n PHE 116 Ca 0.03 0.00 0.12 0.00 1.01 0.00 0.00 57.45 58.61 1wgt n PHE 116 Cb 0.31 -0.23 0.08 0.00 -0.01 0.00 0.00 39.48 39.62 1wgt n PHE 116 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1wgt n GLY 118 N 1.18 -0.36 3.68 0.00 0.00 -0.11 -1.18 105.19 108.40 1wgt n GLY 118 Ca 0.02 -1.31 -0.60 0.00 0.00 0.00 0.00 46.02 44.13 1wgt n GLY 118 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1wgt n GLU 119 N 0.00 0.65 -0.22 1.61 0.00 -1.26 -1.38 120.64 120.04 1wgt n GLU 119 Ca 0.00 0.24 0.00 0.00 0.00 0.00 0.00 57.16 57.40 1wgt n GLU 119 Cb 0.00 -1.83 0.00 0.00 0.00 0.00 0.00 31.44 29.61 1wgt n GLU 119 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1wgt n GLY 120 N 3.53 1.28 3.56 8.31 0.00 -1.26 -4.62 105.19 115.98 1wgt n GLY 120 Ca 0.26 0.00 -0.54 0.00 0.00 0.00 0.00 46.02 45.74 1wgt n GLY 120 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wgt n GLN 122 N 2.08 0.66 -3.62 0.00 6.02 0.13 -4.92 117.38 117.73 1wgt n GLN 122 Ca 0.18 -0.12 -0.01 0.00 -0.01 0.00 0.00 57.00 57.05 1wgt n GLN 122 Cb 0.16 -1.57 -0.01 0.00 1.02 0.00 0.00 30.24 29.84 1wgt n GLN 122 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1wgt s ASN 123 N -4.80 -0.10 0.00 1.08 2.20 -1.26 -4.97 114.94 107.09 1wgt s ASN 123 Ca -0.07 -0.11 0.00 0.00 -0.94 0.00 0.00 52.86 51.74 1wgt s ASN 123 Cb 0.12 0.19 0.00 0.00 -2.00 0.00 0.00 41.25 39.56 1wgt s ASN 123 CO 0.88 -0.33 0.00 0.61 -2.94 0.00 0.00 177.10 175.32 1wgt n GLY 124 N -0.37 -1.13 2.27 0.45 0.00 -1.26 -2.14 105.19 103.01 1wgt n GLY 124 Ca -0.06 -1.38 -0.32 0.00 0.00 0.00 0.00 46.02 44.26 1wgt n GLY 124 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wgt n ALA 125 N 2.46 7.10 -1.80 4.61 0.00 -0.91 -4.89 120.51 127.08 1wgt n ALA 125 Ca 0.00 -3.06 -0.41 0.00 0.00 0.00 0.00 53.44 49.97 1wgt n ALA 125 Cb 0.00 -3.13 -0.02 0.00 0.00 0.00 0.00 19.45 16.29 1wgt n ALA 125 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wgt n SER 127 N 1.14 0.01 -4.64 0.00 7.64 -0.32 -4.78 113.62 112.67 1wgt n SER 127 Ca 0.01 0.50 -0.43 0.00 1.01 0.00 0.00 58.87 59.96 1wgt n SER 127 Cb 0.42 -0.50 -0.02 0.00 -1.01 0.00 0.00 64.21 63.09 1wgt n SER 127 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1wgt s THR 128 N -3.00 4.27 -1.39 0.44 -4.23 -1.26 -4.90 115.64 105.57 1wgt s THR 128 Ca 0.10 1.46 -0.14 0.00 -1.18 0.00 0.00 61.69 61.92 1wgt s THR 128 Cb 0.14 -4.20 0.07 0.00 1.34 0.00 0.00 72.50 69.84 1wgt s THR 128 CO 0.38 -0.42 2.02 -0.67 -0.54 0.00 0.00 174.62 175.40 1wgt n ASP 129 N 7.25 4.35 -4.67 3.99 -0.08 -1.26 -4.92 116.55 121.21 1wgt n ASP 129 Ca 0.14 -2.90 -0.42 0.00 -1.51 0.00 0.00 54.79 50.10 1wgt n ASP 129 Cb 0.46 -1.66 -0.03 0.00 2.34 0.00 0.00 41.12 42.24 1wgt n ASP 129 CO 0.00 0.00 0.00 -0.54 0.12 0.00 0.00 177.20 176.78 1wgt s LYS 130 N 3.07 4.21 0.45 -0.67 1.02 -1.26 -4.97 119.74 121.58 1wgt s LYS 130 Ca 0.48 2.07 -0.23 0.00 0.02 0.00 0.00 55.97 58.31 1wgt s LYS 130 Cb 0.10 -3.86 -0.08 0.00 -0.52 0.00 0.00 37.83 33.47 1wgt s LYS 130 CO -0.03 -0.77 1.09 -1.25 -0.92 0.00 0.00 175.35 173.47 1wgt s PRO 131 N 3.61 3.90 0.31 -1.68 0.04 -1.26 -4.32 135.00 135.59 1wgt s PRO 131 Ca 0.69 1.58 0.03 0.00 0.04 0.00 0.00 61.00 63.33 1wgt s PRO 131 Cb -0.31 -2.37 -0.06 0.00 0.04 0.00 0.00 34.50 31.80 1wgt s PRO 131 CO 0.26 -0.39 0.06 0.00 0.04 0.00 0.00 177.00 176.98 1wgt n GLY 133 N -0.63 -1.87 0.30 0.00 0.00 -0.46 -4.16 105.19 98.37 1wgt n GLY 133 Ca -0.02 -1.92 0.07 0.00 0.00 0.00 0.00 46.02 44.15 1wgt n GLY 133 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1wgt h LYS 134 N 0.00 0.31 0.00 1.61 5.09 -1.90 0.12 116.57 121.80 1wgt h LYS 134 Ca 0.00 -0.02 0.00 0.00 0.09 0.00 0.00 60.65 60.72 1wgt h LYS 134 Cb 0.00 -0.07 0.00 0.00 0.10 0.00 0.00 32.23 32.26 1wgt h LYS 134 CO 0.00 0.20 0.00 -0.25 -2.09 0.00 0.00 179.45 177.31 1wgt n ASP 135 N -4.49 0.61 -2.90 7.07 9.92 -1.26 -4.19 116.55 121.31 1wgt n ASP 135 Ca 0.02 0.61 -0.21 0.00 -0.53 0.00 0.00 54.79 54.68 1wgt n ASP 135 Cb 0.15 -0.75 -0.02 0.00 -0.64 0.00 0.00 41.12 39.86 1wgt n ASP 135 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1wgt n ALA 136 N -1.73 3.64 -1.22 2.24 0.00 -0.47 -4.94 120.51 118.03 1wgt n ALA 136 Ca 0.04 -3.95 -0.07 0.00 0.00 0.00 0.00 53.44 49.46 1wgt n ALA 136 Cb 0.30 -0.80 -0.03 0.00 0.00 0.00 0.00 19.45 18.92 1wgt n ALA 136 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wgt n GLY 137 N -0.08 0.80 2.46 0.00 0.00 -1.23 -2.61 105.19 104.53 1wgt n GLY 137 Ca 0.27 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 46.18 1wgt n GLY 137 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wgt n GLY 138 N -0.38 0.84 3.75 -0.02 0.00 0.31 -5.00 105.19 104.70 1wgt n GLY 138 Ca -0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.53 1wgt n GLY 138 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1wgt s ARG 139 N -0.10 4.31 0.32 1.61 1.70 -1.07 -4.59 118.95 121.12 1wgt s ARG 139 Ca 0.00 2.24 0.02 0.00 -0.47 0.00 0.00 55.73 57.52 1wgt s ARG 139 Cb 0.00 -3.12 -0.03 0.00 -0.57 0.00 0.00 34.95 31.23 1wgt s ARG 139 CO 0.00 -0.35 0.50 0.14 -1.08 0.00 0.00 175.30 174.52 1wgt s VAL 140 N -0.19 5.12 0.94 4.99 -7.23 -1.26 -1.36 120.40 121.41 1wgt s VAL 140 Ca 0.57 -0.61 -0.13 0.00 -1.81 0.00 0.00 61.98 60.00 1wgt s VAL 140 Cb -0.40 -3.85 0.16 0.00 0.56 0.00 0.00 36.38 32.84 1wgt s VAL 140 CO 0.44 -0.49 1.14 0.00 -0.31 0.00 0.00 175.10 175.88 1wgt s THR 142 N -3.26 5.01 -1.48 0.00 -4.23 -1.26 -4.40 115.64 106.02 1wgt s THR 142 Ca 0.65 -0.11 0.00 0.00 -1.18 0.00 0.00 61.69 61.04 1wgt s THR 142 Cb -0.14 -3.86 0.00 0.00 1.34 0.00 0.00 72.50 69.84 1wgt s THR 142 CO 0.54 -0.69 0.00 0.59 -0.54 0.00 0.00 174.62 174.52 1wgt n ASN 143 N -1.97 -4.93 -3.09 3.99 4.13 -1.26 -2.06 115.26 110.07 1wgt n ASN 143 Ca -0.02 0.06 -0.16 0.00 1.68 0.00 0.00 54.58 56.13 1wgt n ASN 143 Cb 0.56 -4.01 -0.01 0.00 -1.54 0.00 0.00 39.78 34.77 1wgt n ASN 143 CO 0.00 0.00 0.00 -3.20 0.28 0.00 0.00 177.26 174.34 1wgt n ASN 144 N -1.08 -2.56 -4.77 6.41 5.15 -1.26 -4.92 115.26 112.23 1wgt n ASN 144 Ca -0.19 -0.12 -0.35 0.00 -0.60 0.00 0.00 54.58 53.32 1wgt n ASN 144 Cb 0.63 -2.20 0.01 0.00 -0.53 0.00 0.00 39.78 37.69 1wgt n ASN 144 CO 0.00 0.00 0.00 -0.31 1.40 0.00 0.00 177.26 178.35 1wgt s TYR 145 N -2.61 2.64 0.17 1.20 2.02 -0.88 -1.26 117.35 118.63 1wgt s TYR 145 Ca 0.26 1.54 -0.30 0.00 -0.37 0.00 0.00 57.07 58.20 1wgt s TYR 145 Cb -0.14 -3.33 -0.07 0.00 -0.40 0.00 0.00 41.96 38.01 1wgt s TYR 145 CO 0.32 -1.69 1.06 0.00 -1.57 0.00 0.00 175.55 173.67 1wgt s SER 148 N 1.83 2.14 0.34 0.00 1.04 -0.35 -0.66 113.70 118.04 1wgt s SER 148 Ca 0.18 1.13 0.07 0.00 0.48 0.00 0.00 55.95 57.82 1wgt s SER 148 Cb -0.16 -1.77 0.76 0.00 0.10 0.00 0.00 66.02 64.95 1wgt s SER 148 CO 0.15 -3.43 1.88 0.50 0.98 0.00 0.00 173.24 173.32 1wgt h LYS 149 N -2.10 0.73 -0.47 4.02 3.64 -1.60 -0.95 116.57 119.85 1wgt h LYS 149 Ca -0.55 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 58.79 1wgt h LYS 149 Cb 1.33 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.99 1wgt h LYS 149 CO 0.55 0.48 0.00 -2.67 -2.27 0.00 0.00 179.45 175.54 1wgt n TRP 150 N -4.56 0.58 -3.03 1.91 2.14 -1.26 -4.92 117.44 108.30 1wgt n TRP 150 Ca 0.17 -0.25 -0.12 0.00 2.07 0.00 0.00 57.50 59.37 1wgt n TRP 150 Cb 0.42 -0.09 0.04 0.00 -0.81 0.00 0.00 31.31 30.87 1wgt n TRP 150 CO 0.00 0.00 0.00 0.41 2.07 0.00 0.00 177.69 180.17 1wgt n GLY 151 N 0.79 0.21 3.30 -1.67 0.00 -0.36 -4.97 105.19 102.48 1wgt n GLY 151 Ca 0.11 -0.21 -0.26 0.00 0.00 0.00 0.00 46.02 45.66 1wgt n GLY 151 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wgt s SER 152 N -3.18 2.68 0.17 1.61 0.01 -1.26 -1.83 113.70 111.90 1wgt s SER 152 Ca 0.28 -0.64 -0.24 0.00 1.31 0.00 0.00 55.95 56.66 1wgt s SER 152 Cb -0.12 -0.18 -0.08 0.00 0.21 0.00 0.00 66.02 65.85 1wgt s SER 152 CO 0.36 0.12 0.75 0.00 0.41 0.00 0.00 173.24 174.88 1wgt n GLY 154 N 1.45 0.62 3.14 0.00 0.00 -0.26 -4.96 105.19 105.19 1wgt n GLY 154 Ca -0.05 -0.73 -0.13 0.00 0.00 0.00 0.00 46.02 45.10 1wgt n GLY 154 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1wgt s ILE 155 N -2.06 -0.01 0.00 -0.61 1.01 -1.26 -0.63 121.20 117.64 1wgt s ILE 155 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 60.65 60.68 1wgt s ILE 155 Cb 0.00 -0.39 0.00 0.00 0.01 0.00 0.00 42.46 42.08 1wgt s ILE 155 CO 0.00 0.01 0.00 0.61 0.00 0.00 0.00 174.94 175.56 1wgt n GLY 156 N 3.23 1.76 0.26 6.18 0.00 -1.26 -4.80 105.19 110.55 1wgt n GLY 156 Ca -0.16 -1.98 -0.03 0.00 0.00 0.00 0.00 46.02 43.85 1wgt n GLY 156 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wgt h PRO 157 N 0.00 0.59 -0.30 1.61 0.13 -2.00 -0.38 132.00 131.65 1wgt h PRO 157 Ca 0.00 -0.19 -0.05 0.00 -0.87 0.00 0.00 66.00 64.89 1wgt h PRO 157 Cb 0.00 -0.05 -0.02 0.00 0.13 0.00 0.00 31.00 31.06 1wgt h PRO 157 CO 0.00 0.72 -0.02 0.78 -0.23 0.00 0.00 178.00 179.25 1wgt h GLY 158 N 0.97 0.50 0.68 1.56 0.00 -1.97 0.01 103.07 104.81 1wgt h GLY 158 Ca 0.09 -0.29 -0.36 0.00 0.00 0.00 0.00 47.33 46.78 1wgt h GLY 158 CO 0.04 0.27 -1.94 -0.97 0.00 0.00 0.00 176.54 173.93 1wgt h TYR 159 N 0.44 0.48 -0.01 5.60 0.05 -1.74 -3.40 116.97 118.39 1wgt h TYR 159 Ca 0.10 -0.35 0.00 0.00 0.05 0.00 0.00 58.73 58.53 1wgt h TYR 159 Cb 0.33 -0.02 0.00 0.00 1.01 0.00 0.00 36.73 38.05 1wgt h TYR 159 CO 0.01 1.72 -0.42 0.00 -1.05 0.00 0.00 178.16 178.42 1wgt n GLY 161 N 1.40 1.19 3.67 0.00 0.00 -0.02 -1.18 105.19 110.24 1wgt n GLY 161 Ca 0.10 -1.49 -0.44 0.00 0.00 0.00 0.00 46.02 44.19 1wgt n GLY 161 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wgt n ALA 162 N -3.00 1.60 -0.41 4.61 0.00 -1.26 -1.43 120.51 120.62 1wgt n ALA 162 Ca 0.00 0.27 0.00 0.00 0.00 0.00 0.00 53.44 53.71 1wgt n ALA 162 Cb 0.00 -2.60 0.00 0.00 0.00 0.00 0.00 19.45 16.85 1wgt n ALA 162 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wgt n GLY 163 N 4.38 0.78 3.70 0.00 0.00 -1.26 -4.63 105.19 108.17 1wgt n GLY 163 Ca 0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 1wgt n GLY 163 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wgt n GLN 165 N 4.92 0.66 -3.76 0.00 6.02 0.16 -4.94 117.38 120.44 1wgt n GLN 165 Ca 0.16 0.10 -0.03 0.00 -0.01 0.00 0.00 57.00 57.22 1wgt n GLN 165 Cb 0.39 -1.63 -0.01 0.00 1.02 0.00 0.00 30.24 30.00 1wgt n GLN 165 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 1wgt s SER 166 N -5.66 -0.15 0.00 1.08 1.04 -1.25 -5.00 113.70 103.76 1wgt s SER 166 Ca -0.08 -0.43 0.00 0.00 0.48 0.00 0.00 55.95 55.93 1wgt s SER 166 Cb 0.07 0.48 0.00 0.00 0.10 0.00 0.00 66.02 66.67 1wgt s SER 166 CO 0.83 -0.89 0.00 0.61 0.98 0.00 0.00 173.24 174.77 1wgt n GLY 167 N -0.50 -0.88 2.38 7.32 0.00 -1.26 -0.56 105.19 111.69 1wgt n GLY 167 Ca -0.06 -1.91 -0.38 0.00 0.00 0.00 0.00 46.02 43.67 1wgt n GLY 167 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wgt n GLY 168 N 0.00 4.64 3.77 -0.02 0.00 -0.39 -4.89 105.19 108.30 1wgt n GLY 168 Ca 0.00 -1.76 -0.41 0.00 0.00 0.00 0.00 46.02 43.86 1wgt n GLY 168 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wgt s ASP 170 N -0.36 6.18 0.00 0.00 1.01 -0.33 -5.07 116.67 118.11 1wgt s ASP 170 Ca 0.50 2.63 0.26 0.00 0.71 0.00 0.00 52.55 56.65 1wgt s ASP 170 Cb -0.41 -2.63 0.53 0.00 1.01 0.00 0.00 42.92 41.42 1wgt s ASP 170 CO 0.54 -0.94 1.45 0.61 0.21 0.00 0.00 175.17 177.05