#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r5s n PRO 2 N 0.00 1.14 -3.70 1.61 -0.02 -1.26 -5.02 135.00 127.76 1r5s n PRO 2 Ca 0.00 0.42 -0.12 0.00 -2.02 0.00 0.00 63.50 61.78 1r5s n PRO 2 Cb 0.00 -1.99 -0.12 0.00 -0.02 0.00 0.00 33.50 31.37 1r5s n PRO 2 CO 0.00 0.00 0.00 -0.48 1.98 0.00 0.00 175.50 177.00 1r5s s LEU 3 N -0.47 0.05 0.00 2.45 2.34 -1.26 -4.86 118.68 116.93 1r5s s LEU 3 Ca 0.66 0.70 0.00 0.00 0.06 0.00 0.00 54.13 55.55 1r5s s LEU 3 Cb -0.53 1.00 0.00 0.00 -0.56 0.00 0.00 46.19 46.10 1r5s s LEU 3 CO 0.55 -0.19 0.00 0.61 -1.06 0.00 0.00 176.35 176.26 1r5s n GLY 4 N 4.49 1.33 0.11 -3.48 0.00 -1.26 -4.87 105.19 101.51 1r5s n GLY 4 Ca -0.21 -0.35 -0.14 0.00 0.00 0.00 0.00 46.02 45.32 1r5s n GLY 4 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1r5s h SER 5 N 0.00 0.37 -0.35 1.61 4.64 -1.95 -3.27 113.55 114.61 1r5s h SER 5 Ca 0.00 -0.38 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 1r5s h SER 5 Cb 0.00 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 61.97 1r5s h SER 5 CO 0.00 1.27 0.00 -0.81 -0.87 0.00 0.00 176.83 176.42 1r5s n PRO 6 N -3.55 1.97 -0.31 4.77 -0.04 -1.26 -3.77 135.00 132.82 1r5s n PRO 6 Ca -0.07 -1.31 0.10 0.00 -0.04 0.00 0.00 63.50 62.18 1r5s n PRO 6 Cb 0.97 -1.36 0.27 0.00 -0.04 0.00 0.00 33.50 33.34 1r5s n PRO 6 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1r5s n SER 7 N 0.51 3.64 0.00 3.54 7.64 -1.23 -5.00 113.62 122.72 1r5s n SER 7 Ca 0.12 -1.99 0.00 0.00 1.01 0.00 0.00 58.87 58.01 1r5s n SER 7 Cb 0.36 -0.40 0.00 0.00 -1.01 0.00 0.00 64.21 63.16 1r5s n SER 7 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1r5s n LYS 8 N 1.34 0.00 -3.56 1.43 4.01 -1.25 -4.58 118.16 115.56 1r5s n LYS 8 Ca 0.21 0.00 -0.12 0.00 -0.51 0.00 0.00 58.31 57.89 1r5s n LYS 8 Cb 0.57 0.00 -0.05 0.00 -0.51 0.00 0.00 35.03 35.04 1r5s n LYS 8 CO 0.00 0.00 0.00 0.16 -1.11 0.00 0.00 177.40 176.45 1r5s s ASP 9 N -3.84 -0.43 -0.10 4.39 1.47 -1.26 -5.00 116.67 111.89 1r5s s ASP 9 Ca 0.00 0.44 -0.11 0.00 1.18 0.00 0.00 52.55 54.06 1r5s s ASP 9 Cb 0.00 0.36 -0.27 0.00 -0.34 0.00 0.00 42.92 42.66 1r5s s ASP 9 CO 0.00 -0.42 0.49 0.00 0.68 0.00 0.00 175.17 175.93 1r5s n GLY 11 N 1.86 0.00 3.56 0.00 0.00 -1.26 -5.13 105.19 104.22 1r5s n GLY 11 Ca -0.28 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.31 1r5s n GLY 11 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1r5s s SER 12 N 0.00 6.45 0.03 1.61 0.01 -1.26 -4.98 113.70 115.57 1r5s s SER 12 Ca 0.00 0.07 -0.15 0.00 1.31 0.00 0.00 55.95 57.18 1r5s s SER 12 Cb 0.00 -2.37 -0.07 0.00 0.21 0.00 0.00 66.02 63.78 1r5s s SER 12 CO 0.00 -0.79 1.23 -0.65 0.41 0.00 0.00 173.24 173.44 1r5s h PRO 13 N 8.72 -0.43 -0.31 12.44 0.11 -2.02 -3.28 132.00 147.23 1r5s h PRO 13 Ca -0.25 0.03 -0.07 0.00 0.11 0.00 0.00 66.00 65.82 1r5s h PRO 13 Cb 1.09 0.10 -0.04 0.00 0.11 0.00 0.00 31.00 32.26 1r5s h PRO 13 CO 0.92 -0.29 0.01 1.17 -0.21 0.00 0.00 178.00 179.60 1r5s n LYS 14 N -3.58 2.64 -2.43 1.05 3.00 -1.26 -5.04 118.16 112.54 1r5s n LYS 14 Ca -0.05 -2.94 -0.02 0.00 -0.00 0.00 0.00 58.31 55.30 1r5s n LYS 14 Cb 0.20 -1.86 -0.01 0.00 0.00 0.00 0.00 35.03 33.36 1r5s n LYS 14 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.40 178.38 1r5s n TYR 15 N -0.68 -4.19 -3.57 5.64 4.19 -1.24 -4.98 117.16 112.32 1r5s n TYR 15 Ca 0.26 2.48 -0.27 0.00 3.31 0.00 0.00 57.90 63.68 1r5s n TYR 15 Cb 0.96 -3.53 -0.10 0.00 0.49 0.00 0.00 39.34 37.16 1r5s n TYR 15 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 1r5s n ALA 16 N 1.86 3.16 -0.01 2.98 0.00 -1.26 -4.85 120.51 122.41 1r5s n ALA 16 Ca -0.12 -3.87 0.01 0.00 0.00 0.00 0.00 53.44 49.46 1r5s n ALA 16 Cb 0.18 -0.88 -0.04 0.00 0.00 0.00 0.00 19.45 18.71 1r5s n ALA 16 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1r5s n TYR 17 N 2.13 0.00 -0.59 0.00 4.01 -1.26 -4.62 117.16 116.83 1r5s n TYR 17 Ca 0.25 0.00 0.46 0.00 -0.16 0.00 0.00 57.90 58.45 1r5s n TYR 17 Cb 0.43 -0.15 0.73 0.00 -0.31 0.00 0.00 39.34 40.04 1r5s n TYR 17 CO 0.00 0.00 0.00 1.97 -0.46 0.00 0.00 176.86 178.37 1r5s n PHE 18 N -1.84 0.29 0.00 -0.72 1.16 -1.26 -4.63 117.46 110.46 1r5s n PHE 18 Ca -0.03 0.29 0.00 0.00 -1.87 0.00 0.00 57.45 55.84 1r5s n PHE 18 Cb 0.30 -0.75 0.00 0.00 -1.61 0.00 0.00 39.48 37.42 1r5s n PHE 18 CO 0.00 0.00 0.00 0.27 -1.87 0.00 0.00 176.76 175.16 1r5s n ASN 19 N -4.18 0.00 0.00 5.98 0.23 -1.26 -5.08 115.26 110.95 1r5s n ASN 19 Ca 0.41 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.46 1r5s n ASN 19 Cb 1.76 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 39.46 1r5s n ASN 19 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1r5s n GLY 20 N 0.00 0.90 3.70 4.83 0.00 -1.26 -4.94 105.19 108.41 1r5s n GLY 20 Ca 0.00 -1.05 -0.41 0.00 0.00 0.00 0.00 46.02 44.56 1r5s n GLY 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r5s h SER 22 N 7.01 0.07 -1.51 0.00 0.02 -2.01 -3.41 113.55 113.71 1r5s h SER 22 Ca -0.36 -0.00 -0.60 0.00 -0.84 0.00 0.00 61.79 59.99 1r5s h SER 22 Cb 1.17 -0.02 -0.01 0.00 0.14 0.00 0.00 62.40 63.69 1r5s h SER 22 CO 0.79 0.05 1.50 -1.20 -1.14 0.00 0.00 176.83 176.82 1r5s n SER 23 N -4.48 2.59 0.25 3.07 7.64 -1.26 -4.79 113.62 116.64 1r5s n SER 23 Ca 0.02 0.18 0.15 0.00 1.01 0.00 0.00 58.87 60.24 1r5s n SER 23 Cb 0.26 -1.42 0.81 0.00 -1.01 0.00 0.00 64.21 62.84 1r5s n SER 23 CO 0.00 0.00 0.00 -0.65 -3.01 0.00 0.00 175.04 171.38 1r5s h PRO 24 N 14.56 0.00 -5.05 1.43 0.11 -2.04 -3.38 132.00 137.63 1r5s h PRO 24 Ca -0.32 0.00 -0.20 0.00 0.11 0.00 0.00 66.00 65.59 1r5s h PRO 24 Cb 1.28 0.00 0.05 0.00 0.11 0.00 0.00 31.00 32.44 1r5s h PRO 24 CO 1.02 0.00 0.46 0.25 -0.21 0.00 0.00 178.00 179.53 1r5s n THR 25 N -2.60 0.00 0.07 -1.15 -2.24 -1.26 -4.71 114.28 102.39 1r5s n THR 25 Ca -0.02 -0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.63 1r5s n THR 25 Cb 0.14 -1.98 -0.07 0.00 -2.10 0.00 0.00 70.33 66.31 1r5s n THR 25 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1r5s h ALA 26 N 11.11 -0.09 -3.00 6.98 0.00 -1.99 -3.44 119.26 128.82 1r5s h ALA 26 Ca 0.09 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1r5s h ALA 26 Cb 0.90 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.73 1r5s h ALA 26 CO 1.35 -0.54 0.00 -2.30 0.00 0.00 0.00 179.25 177.76 1r5s n PRO 27 N -5.12 1.63 0.00 0.00 -0.02 -1.26 -5.04 135.00 125.18 1r5s n PRO 27 Ca -0.08 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.40 1r5s n PRO 27 Cb 0.08 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.56 1r5s n PRO 27 CO 0.00 0.00 0.00 1.47 1.98 0.00 0.00 175.50 178.95 1r5s n LEU 28 N 0.00 0.00 -4.24 2.45 -0.00 -1.26 -5.05 117.00 108.90 1r5s n LEU 28 Ca 0.00 0.00 -0.37 0.00 -0.00 0.00 0.00 56.01 55.64 1r5s n LEU 28 Cb 0.00 0.01 -0.12 0.00 -0.00 0.00 0.00 43.42 43.31 1r5s n LEU 28 CO 0.00 -0.31 -0.26 -0.55 -0.00 0.00 0.00 177.39 176.27 1r5s s SER 29 N -4.11 5.24 0.52 1.45 0.15 -1.26 -4.97 113.70 110.72 1r5s s SER 29 Ca 0.00 -1.25 0.21 0.00 0.70 0.00 0.00 55.95 55.61 1r5s s SER 29 Cb 0.00 -1.84 1.36 0.00 -1.71 0.00 0.00 66.02 63.83 1r5s s SER 29 CO 0.00 -0.34 2.12 1.55 1.20 0.00 0.00 173.24 177.77 1r5s h PRO 30 N 8.17 0.00 -2.96 5.44 0.13 -2.03 -3.48 132.00 137.26 1r5s h PRO 30 Ca -0.22 0.00 0.30 0.00 -0.87 0.00 0.00 66.00 65.21 1r5s h PRO 30 Cb 1.08 0.00 -0.12 0.00 0.13 0.00 0.00 31.00 32.08 1r5s h PRO 30 CO 0.60 0.07 -0.76 -1.33 -0.23 0.00 0.00 178.00 176.36 1r5s n MET 31 N -4.17 -2.57 -2.85 0.86 2.81 -1.26 -4.79 117.12 105.15 1r5s n MET 31 Ca -0.03 1.93 -0.16 0.00 -1.81 0.00 0.00 57.70 57.63 1r5s n MET 31 Cb 0.15 -3.17 -0.00 0.00 -0.71 0.00 0.00 33.22 29.49 1r5s n MET 31 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 1r5s n SER 32 N -4.28 1.95 -4.30 7.83 3.41 -1.26 -5.12 113.62 111.85 1r5s n SER 32 Ca -0.03 -3.04 -0.29 0.00 -0.26 0.00 0.00 58.87 55.24 1r5s n SER 32 Cb 0.65 -0.56 0.19 0.00 -0.26 0.00 0.00 64.21 64.23 1r5s n SER 32 CO 0.00 0.00 0.00 -2.16 -0.16 0.00 0.00 175.04 172.72 1r5s s PRO 33 N -2.97 0.09 0.63 4.33 0.04 -1.26 -4.87 135.00 130.99 1r5s s PRO 33 Ca 0.36 0.06 0.22 0.00 0.04 0.00 0.00 61.00 61.68 1r5s s PRO 33 Cb 0.40 -1.74 1.20 0.00 0.04 0.00 0.00 34.50 34.40 1r5s s PRO 33 CO -0.05 -2.86 1.66 -1.00 0.04 0.00 0.00 177.00 174.79 1r5s h PRO 34 N -1.97 0.00 -0.23 0.56 0.13 -2.03 -3.44 132.00 125.03 1r5s h PRO 34 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1r5s h PRO 34 Cb 1.30 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.43 1r5s h PRO 34 CO 0.47 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.65 1r5s n GLY 35 N -1.28 0.97 2.34 1.56 0.00 -1.26 -4.86 105.19 102.65 1r5s n GLY 35 Ca -0.01 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.86 1r5s n GLY 35 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1r5s n TYR 36 N -0.52 -4.74 -2.21 1.61 4.02 -1.26 -4.96 117.16 109.11 1r5s n TYR 36 Ca 0.00 2.82 -0.19 0.00 -0.01 0.00 0.00 57.90 60.52 1r5s n TYR 36 Cb 0.11 -3.77 0.03 0.00 -0.02 0.00 0.00 39.34 35.69 1r5s n TYR 36 CO 0.00 0.00 0.00 0.36 -1.01 0.00 0.00 176.86 176.21 1r5s n LYS 37 N 1.87 3.20 0.09 -0.72 2.85 -1.26 -4.71 118.16 119.48 1r5s n LYS 37 Ca 0.00 -4.03 -0.17 0.00 -1.05 0.00 0.00 58.31 53.06 1r5s n LYS 37 Cb 0.00 -2.13 -0.11 0.00 -0.65 0.00 0.00 35.03 32.14 1r5s n LYS 37 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 177.40 178.60 1r5s h LEU 38 N 2.28 0.61 0.00 -5.58 7.12 -2.02 -3.41 115.31 114.30 1r5s h LEU 38 Ca 0.26 -0.57 -0.07 0.00 0.13 0.00 0.00 57.88 57.62 1r5s h LEU 38 Cb 1.47 -0.19 -0.01 0.00 -0.53 0.00 0.00 40.66 41.40 1r5s h LEU 38 CO 0.63 1.41 -0.89 0.52 -0.13 0.00 0.00 178.44 179.98 1r5s n VAL 39 N -3.68 0.83 -2.27 1.05 0.31 -1.26 -5.00 118.33 108.32 1r5s n VAL 39 Ca -0.10 0.10 -0.11 0.00 -0.01 0.00 0.00 64.34 64.22 1r5s n VAL 39 Cb 0.96 -1.69 -0.01 0.00 -0.91 0.00 0.00 33.84 32.19 1r5s n VAL 39 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 1r5s n THR 40 N -3.54 -0.42 0.24 2.52 -2.24 -1.26 -4.80 114.28 104.78 1r5s n THR 40 Ca -0.10 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 61.79 1r5s n THR 40 Cb 0.39 -1.42 0.57 0.00 -2.10 0.00 0.00 70.33 67.77 1r5s n THR 40 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1r5s h GLY 41 N 0.00 0.00 -5.43 3.38 0.00 -1.98 -3.47 103.07 95.57 1r5s h GLY 41 Ca -0.24 0.00 -0.36 0.00 0.00 0.00 0.00 47.33 46.72 1r5s h GLY 41 CO 0.30 0.00 -0.62 1.34 0.00 0.00 0.00 176.54 177.56 1r5s n ASP 42 N -3.55 -5.96 -0.04 0.19 2.03 -1.26 -4.90 116.55 103.06 1r5s n ASP 42 Ca -0.01 -0.49 -0.04 0.00 0.52 0.00 0.00 54.79 54.76 1r5s n ASP 42 Cb 0.34 -4.65 -0.05 0.00 -0.72 0.00 0.00 41.12 36.04 1r5s n ASP 42 CO 0.00 0.00 0.00 -2.11 -1.92 0.00 0.00 177.20 173.17 1r5s n ARG 43 N -4.62 2.20 0.34 -0.67 1.85 -1.26 -4.12 116.66 110.38 1r5s n ARG 43 Ca 0.00 0.01 -0.13 0.00 -1.00 0.00 0.00 57.85 56.73 1r5s n ARG 43 Cb 0.56 -1.19 -0.06 0.00 -1.05 0.00 0.00 32.46 30.72 1r5s n ARG 43 CO 0.00 0.00 0.00 -0.91 -0.01 0.00 0.00 177.63 176.71 1r5s h ASN 44 N 0.00 -0.74 -0.34 2.89 2.35 -2.01 -3.26 115.58 114.47 1r5s h ASN 44 Ca -0.20 0.03 -0.05 0.00 -0.55 0.00 0.00 56.30 55.53 1r5s h ASN 44 Cb 1.42 0.19 -0.01 0.00 0.05 0.00 0.00 38.32 39.96 1r5s h ASN 44 CO 0.00 -0.52 0.03 0.78 -1.65 0.00 0.00 177.43 176.07 1r5s h ASN 45 N -0.89 0.57 0.00 5.81 2.35 -2.00 -3.47 115.58 117.96 1r5s h ASN 45 Ca -0.09 -0.29 0.00 0.00 -0.55 0.00 0.00 56.30 55.37 1r5s h ASN 45 Cb 0.67 -0.15 0.00 0.00 0.05 0.00 0.00 38.32 38.89 1r5s h ASN 45 CO 0.15 0.72 0.00 -1.20 -1.65 0.00 0.00 177.43 175.44 1r5s n SER 46 N -4.55 0.00 -2.37 5.81 7.64 -1.23 -4.58 113.62 114.35 1r5s n SER 46 Ca -0.02 0.00 -0.13 0.00 1.01 0.00 0.00 58.87 59.74 1r5s n SER 46 Cb 0.25 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.44 1r5s n SER 46 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1r5s n SER 47 N 1.66 -3.95 -0.03 6.43 3.41 -1.26 -4.78 113.62 115.10 1r5s n SER 47 Ca 0.00 0.20 0.00 0.00 -0.26 0.00 0.00 58.87 58.81 1r5s n SER 47 Cb 0.00 -3.37 -0.08 0.00 -0.26 0.00 0.00 64.21 60.50 1r5s n SER 47 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1r5s n ARG 49 N -2.12 0.00 -3.01 0.00 1.85 -1.26 -5.12 116.66 107.00 1r5s n ARG 49 Ca -0.09 0.00 -0.01 0.00 -1.00 0.00 0.00 57.85 56.75 1r5s n ARG 49 Cb 0.55 -0.00 -0.01 0.00 -1.05 0.00 0.00 32.46 31.95 1r5s n ARG 49 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 1r5s n ASN 50 N -2.14 -6.42 -4.55 2.89 4.13 -1.26 -4.74 115.26 103.16 1r5s n ASN 50 Ca 0.00 0.85 -0.38 0.00 1.68 0.00 0.00 54.58 56.73 1r5s n ASN 50 Cb 0.00 -2.69 -0.03 0.00 -1.54 0.00 0.00 39.78 35.52 1r5s n ASN 50 CO 0.00 0.00 0.00 -0.31 0.28 0.00 0.00 177.26 177.23 1r5s s TYR 51 N -0.82 1.78 -0.51 3.10 2.02 -1.26 -4.86 117.35 116.80 1r5s s TYR 51 Ca -0.03 0.61 0.07 0.00 -0.37 0.00 0.00 57.07 57.35 1r5s s TYR 51 Cb 0.00 -4.18 0.29 0.00 -0.40 0.00 0.00 41.96 37.67 1r5s s TYR 51 CO 0.24 -2.21 0.73 0.27 -1.57 0.00 0.00 175.55 173.00 1r5s n ASN 52 N 12.28 2.47 -2.26 2.29 6.94 -1.26 -4.94 115.26 130.78 1r5s n ASN 52 Ca 0.20 -3.22 -0.21 0.00 -0.02 0.00 0.00 54.58 51.32 1r5s n ASN 52 Cb 0.51 -0.63 -0.07 0.00 -2.36 0.00 0.00 39.78 37.23 1r5s n ASN 52 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 1r5s n LYS 53 N 0.66 2.18 -0.55 -3.83 4.01 -1.26 -4.26 118.16 115.11 1r5s n LYS 53 Ca 0.27 -1.83 0.05 0.00 -0.51 0.00 0.00 58.31 56.29 1r5s n LYS 53 Cb 0.48 -2.00 0.20 0.00 -0.51 0.00 0.00 35.03 33.20 1r5s n LYS 53 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1r5s n GLN 54 N 1.24 1.65 -3.22 1.97 10.64 -1.26 -4.86 117.38 123.55 1r5s n GLN 54 Ca 0.43 -3.13 -0.39 0.00 -1.83 0.00 0.00 57.00 52.08 1r5s n GLN 54 Cb 0.65 -1.65 -0.02 0.00 -0.86 0.00 0.00 30.24 28.35 1r5s n GLN 54 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1r5s n ALA 55 N -1.15 4.65 0.00 2.61 0.00 -1.26 -4.35 120.51 121.01 1r5s n ALA 55 Ca 0.22 -4.76 0.00 0.00 0.00 0.00 0.00 53.44 48.90 1r5s n ALA 55 Cb 0.77 -1.98 0.00 0.00 0.00 0.00 0.00 19.45 18.24 1r5s n ALA 55 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1r5s n SER 56 N 1.53 0.00 0.00 0.00 2.88 -1.26 -5.07 113.62 111.69 1r5s n SER 56 Ca 0.26 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.80 1r5s n SER 56 Cb 0.36 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.82 1r5s n SER 56 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1r5s n GLU 57 N -0.24 0.00 -2.95 -1.46 -0.58 -1.26 -4.69 120.64 109.45 1r5s n GLU 57 Ca 0.00 0.00 -0.16 0.00 -0.42 0.00 0.00 57.16 56.58 1r5s n GLU 57 Cb 0.00 0.00 0.04 0.00 -0.57 0.00 0.00 31.44 30.91 1r5s n GLU 57 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 1r5s n GLN 58 N 0.00 -4.22 -0.62 3.49 1.13 -1.26 -4.88 117.38 111.02 1r5s n GLN 58 Ca 0.00 0.64 -0.12 0.00 -1.94 0.00 0.00 57.00 55.58 1r5s n GLN 58 Cb 0.00 -4.97 0.09 0.00 0.11 0.00 0.00 30.24 25.47 1r5s n GLN 58 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 1r5s n ASN 59 N -1.45 3.38 0.04 1.08 3.02 -1.26 -4.15 115.26 115.91 1r5s n ASN 59 Ca -0.05 -2.80 0.00 0.00 -0.03 0.00 0.00 54.58 51.69 1r5s n ASN 59 Cb 0.57 -0.67 0.00 0.00 -0.61 0.00 0.00 39.78 39.07 1r5s n ASN 59 CO 0.00 0.00 0.00 -2.67 -2.62 0.00 0.00 177.26 171.97 1r5s n TRP 60 N -0.31 -2.18 -3.00 3.10 4.27 -1.26 -5.11 117.44 112.95 1r5s n TRP 60 Ca 0.30 0.22 -0.15 0.00 -3.89 0.00 0.00 57.50 53.98 1r5s n TRP 60 Cb 1.08 0.94 0.02 0.00 -1.36 0.00 0.00 31.31 31.99 1r5s n TRP 60 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1r5s n ALA 61 N -2.66 -2.86 -0.55 -1.67 0.00 -1.26 -5.00 120.51 106.52 1r5s n ALA 61 Ca 0.00 1.00 0.00 0.00 0.00 0.00 0.00 53.44 54.44 1r5s n ALA 61 Cb 0.00 -3.47 0.00 0.00 0.00 0.00 0.00 19.45 15.98 1r5s n ALA 61 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1r5s n ASN 62 N -0.27 0.00 -1.43 0.00 3.02 -1.26 -4.91 115.26 110.41 1r5s n ASN 62 Ca 0.07 0.00 -0.01 0.00 -0.03 0.00 0.00 54.58 54.61 1r5s n ASN 62 Cb 0.51 0.05 0.19 0.00 -0.61 0.00 0.00 39.78 39.92 1r5s n ASN 62 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1r5s n TYR 63 N -1.68 1.37 -0.03 3.10 4.11 -1.26 -3.74 117.16 119.03 1r5s n TYR 63 Ca 0.00 -0.68 0.01 0.00 -0.00 0.00 0.00 57.90 57.23 1r5s n TYR 63 Cb 0.00 -0.43 -0.11 0.00 -0.00 0.00 0.00 39.34 38.80 1r5s n TYR 63 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.86 177.31 1r5s n SER 64 N 0.11 1.68 0.26 9.48 2.88 -1.26 -4.20 113.62 122.58 1r5s n SER 64 Ca 0.22 0.00 0.16 0.00 -1.33 0.00 0.00 58.87 57.92 1r5s n SER 64 Cb 0.91 1.28 0.61 0.00 -0.75 0.00 0.00 64.21 66.26 1r5s n SER 64 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1r5s h ALA 65 N 1.02 1.00 0.00 -1.46 0.00 -1.93 -2.92 119.26 114.96 1r5s h ALA 65 Ca -0.17 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 1r5s h ALA 65 Cb 1.21 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.00 1r5s h ALA 65 CO 0.01 0.00 -1.53 0.39 0.00 0.00 0.00 179.25 178.12 1r5s n GLU 66 N -3.03 0.63 0.20 0.00 -0.58 -1.26 -4.29 120.64 112.31 1r5s n GLU 66 Ca 0.01 -0.04 -0.15 0.00 -0.42 0.00 0.00 57.16 56.56 1r5s n GLU 66 Cb 0.33 -1.67 -0.08 0.00 -0.57 0.00 0.00 31.44 29.45 1r5s n GLU 66 CO 0.00 0.00 0.00 1.96 -0.48 0.00 0.00 177.13 178.61 1r5s h GLN 67 N 0.00 -0.45 -0.88 3.49 4.20 -1.68 -1.41 115.11 118.38 1r5s h GLN 67 Ca -0.01 0.03 0.15 0.00 0.06 0.00 0.00 58.65 58.88 1r5s h GLN 67 Cb 1.01 0.10 -0.09 0.00 0.30 0.00 0.00 27.48 28.80 1r5s h GLN 67 CO 0.00 -0.23 0.47 -0.91 -0.67 0.00 0.00 178.83 177.49 1r5s h ASN 68 N -0.58 0.60 -0.62 1.46 2.35 -1.77 0.62 115.58 117.64 1r5s h ASN 68 Ca -0.05 0.09 0.00 0.00 -0.55 0.00 0.00 56.30 55.79 1r5s h ASN 68 Cb 0.42 -0.01 -0.03 0.00 0.05 0.00 0.00 38.32 38.75 1r5s h ASN 68 CO 0.08 0.25 0.39 0.03 -1.65 0.00 0.00 177.43 176.53 1r5s h ARG 69 N 0.67 0.84 0.00 0.81 -0.00 -1.69 -1.66 114.38 113.36 1r5s h ARG 69 Ca 0.48 -0.07 -0.12 0.00 -0.50 0.00 0.00 59.98 59.77 1r5s h ARG 69 Cb 0.66 -0.18 -0.02 0.00 0.00 0.00 0.00 29.97 30.43 1r5s h ARG 69 CO -0.35 0.58 -0.57 0.00 0.00 0.00 0.00 179.97 179.63 1r5s h MET 70 N 0.85 0.00 -0.21 0.04 -0.00 0.17 0.29 114.93 116.06 1r5s h MET 70 Ca 0.23 0.00 -0.01 0.00 -0.00 0.00 0.00 59.70 59.92 1r5s h MET 70 Cb -0.05 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 31.54 1r5s h MET 70 CO -0.05 0.57 0.11 0.78 -0.00 0.00 0.00 176.91 178.33 1r5s h GLY 71 N 2.50 0.32 0.15 -3.00 0.00 0.74 0.37 103.07 104.15 1r5s h GLY 71 Ca -0.01 -0.15 -0.01 0.00 0.00 0.00 0.00 47.33 47.16 1r5s h GLY 71 CO 0.07 0.15 -0.07 1.46 0.00 0.00 0.00 176.54 178.15 1r5s h GLN 72 N 0.23 -0.20 -1.61 4.80 4.20 -1.28 0.15 115.11 121.40 1r5s h GLN 72 Ca 0.07 0.01 0.48 0.00 0.06 0.00 0.00 58.65 59.28 1r5s h GLN 72 Cb 0.09 0.04 -0.09 0.00 0.30 0.00 0.00 27.48 27.83 1r5s h GLN 72 CO -0.01 -0.13 1.13 0.00 -0.67 0.00 0.00 178.83 179.15 1r5s h ALA 73 N -1.48 3.36 0.00 3.87 0.00 -0.49 0.66 119.26 125.19 1r5s h ALA 73 Ca -0.02 -0.01 -0.31 0.00 0.00 0.00 0.00 54.91 54.57 1r5s h ALA 73 Cb 0.16 0.15 -0.06 0.00 0.00 0.00 0.00 17.79 18.04 1r5s h ALA 73 CO 0.03 -1.90 -1.90 0.41 0.00 0.00 0.00 179.25 175.90 1r5s n GLY 74 N -1.77 -1.00 0.14 0.00 0.00 0.13 -4.18 105.19 98.50 1r5s n GLY 74 Ca 0.38 -0.13 0.01 0.00 0.00 0.00 0.00 46.02 46.29 1r5s n GLY 74 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1r5s h SER 75 N 0.00 0.00 -0.23 1.61 4.64 0.22 -3.20 113.55 116.59 1r5s h SER 75 Ca -0.36 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 60.95 1r5s h SER 75 Cb 2.07 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 64.14 1r5s h SER 75 CO 0.06 0.58 0.11 0.71 -0.87 0.00 0.00 176.83 177.42 1r5s h THR 76 N 0.00 1.12 -4.99 2.95 1.35 -0.47 -3.48 112.91 109.38 1r5s h THR 76 Ca -0.01 -0.38 0.01 0.00 -0.55 0.00 0.00 66.41 65.48 1r5s h THR 76 Cb 1.33 0.79 -0.09 0.00 -1.73 0.00 0.00 68.15 68.45 1r5s h THR 76 CO 0.08 0.14 -1.27 -0.38 -0.25 0.00 0.00 175.52 173.83 1r5s n ILE 77 N -4.41-11.79 0.00 6.82 2.08 -1.21 -5.01 119.36 105.84 1r5s n ILE 77 Ca 0.01 2.61 0.00 0.00 0.56 0.00 0.00 62.75 65.94 1r5s n ILE 77 Cb 0.14 -5.97 0.00 0.00 -0.75 0.00 0.00 39.64 33.06 1r5s n ILE 77 CO 0.00 0.00 0.00 -1.20 0.56 0.00 0.00 176.55 175.91 1r5s n SER 78 N 1.84 0.00 0.13 4.38 7.64 -1.26 -4.98 113.62 121.38 1r5s n SER 78 Ca -0.27 0.00 -0.13 0.00 1.01 0.00 0.00 58.87 59.48 1r5s n SER 78 Cb 0.42 0.11 -0.06 0.00 -1.01 0.00 0.00 64.21 63.67 1r5s n SER 78 CO 0.00 0.00 0.00 -1.13 -3.01 0.00 0.00 175.04 170.90 1r5s h ASN 79 N 0.00 -0.63 -4.34 6.43 -0.73 -1.95 -3.47 115.58 110.89 1r5s h ASN 79 Ca 0.00 0.07 -0.22 0.00 1.87 0.00 0.00 56.30 58.02 1r5s h ASN 79 Cb 0.00 0.23 0.11 0.00 0.27 0.00 0.00 38.32 38.93 1r5s h ASN 79 CO 0.00 -0.33 -0.49 -1.54 -0.37 0.00 0.00 177.43 174.70 1r5s n SER 80 N -5.35 -2.28 -2.84 1.15 3.41 -1.26 -4.92 113.62 101.53 1r5s n SER 80 Ca -0.07 -0.40 -0.31 0.00 -0.26 0.00 0.00 58.87 57.84 1r5s n SER 80 Cb 0.26 -3.49 -0.05 0.00 -0.26 0.00 0.00 64.21 60.67 1r5s n SER 80 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1r5s n HIS 81 N -3.12 1.80 -1.18 7.33 1.44 -1.26 -4.80 115.22 115.43 1r5s n HIS 81 Ca -0.17 -2.29 -0.32 0.00 -2.01 0.00 0.00 57.72 52.93 1r5s n HIS 81 Cb 0.60 -1.66 -0.05 0.00 0.12 0.00 0.00 29.99 29.00 1r5s n HIS 81 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1r5s n ALA 82 N 1.62 6.97 -0.07 1.59 0.00 -1.26 -4.15 120.51 125.20 1r5s n ALA 82 Ca 0.55 -3.03 -0.15 0.00 0.00 0.00 0.00 53.44 50.81 1r5s n ALA 82 Cb 0.47 -3.15 -0.05 0.00 0.00 0.00 0.00 19.45 16.71 1r5s n ALA 82 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1r5s n GLN 83 N 3.48 0.30 0.17 0.00 6.02 -1.26 -2.90 117.38 123.19 1r5s n GLN 83 Ca 0.68 0.13 0.02 0.00 -0.01 0.00 0.00 57.00 57.82 1r5s n GLN 83 Cb 0.32 -1.00 0.36 0.00 1.02 0.00 0.00 30.24 30.94 1r5s n GLN 83 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 177.06 174.70 1r5s h PRO 84 N -0.51 0.06 0.00 -1.09 0.11 -2.02 -3.35 132.00 125.21 1r5s h PRO 84 Ca -0.36 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.73 1r5s h PRO 84 Cb 1.30 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.41 1r5s h PRO 84 CO -0.22 0.39 -0.97 1.19 -0.21 0.00 0.00 178.00 178.18 1r5s n PHE 85 N -4.13 0.00 -4.03 0.65 3.72 -1.26 -5.03 117.46 107.38 1r5s n PHE 85 Ca -0.02 0.00 -0.30 0.00 -0.05 0.00 0.00 57.45 57.09 1r5s n PHE 85 Cb 0.38 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 38.91 1r5s n PHE 85 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 1r5s n ASP 86 N -2.29 -2.17 -2.63 4.37 2.03 -1.14 -4.89 116.55 109.82 1r5s n ASP 86 Ca 0.00 -0.96 -0.27 0.00 0.52 0.00 0.00 54.79 54.08 1r5s n ASP 86 Cb 0.49 -3.15 -0.01 0.00 -0.72 0.00 0.00 41.12 37.72 1r5s n ASP 86 CO 0.00 0.00 0.00 2.22 -1.92 0.00 0.00 177.20 177.50 1r5s n PHE 87 N -4.44 3.61 0.21 -0.67 1.16 -1.26 -4.82 117.46 111.24 1r5s n PHE 87 Ca -0.12 -3.41 0.08 0.00 -1.87 0.00 0.00 57.45 52.13 1r5s n PHE 87 Cb 0.59 -0.22 0.40 0.00 -1.61 0.00 0.00 39.48 38.65 1r5s n PHE 87 CO 0.00 0.00 0.00 -1.00 -1.87 0.00 0.00 176.76 173.89 1r5s h PRO 88 N 2.71 0.00 -1.09 3.97 0.13 -1.93 -3.08 132.00 132.72 1r5s h PRO 88 Ca 0.24 0.00 -0.52 0.00 -0.87 0.00 0.00 66.00 64.86 1r5s h PRO 88 Cb 0.78 0.00 -0.25 0.00 0.13 0.00 0.00 31.00 31.66 1r5s h PRO 88 CO 0.84 0.30 0.66 -0.40 -0.23 0.00 0.00 178.00 179.17 1r5s n ASP 89 N -3.49 5.75 -3.39 1.44 5.68 -1.26 -4.63 116.55 116.65 1r5s n ASP 89 Ca -0.00 -3.48 -0.26 0.00 -0.50 0.00 0.00 54.79 50.55 1r5s n ASP 89 Cb 0.46 -0.91 -0.08 0.00 -1.14 0.00 0.00 41.12 39.45 1r5s n ASP 89 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 1r5s n ASP 90 N -0.69 2.19 0.00 -1.12 9.92 -1.17 -4.79 116.55 120.89 1r5s n ASP 90 Ca 0.52 -3.09 0.00 0.00 -0.53 0.00 0.00 54.79 51.69 1r5s n ASP 90 Cb 1.00 -0.66 0.00 0.00 -0.64 0.00 0.00 41.12 40.82 1r5s n ASP 90 CO 0.00 0.00 0.00 -0.46 0.13 0.00 0.00 177.20 176.87 1r5s n ASN 91 N 1.29 0.00 -0.23 -2.24 6.94 -1.26 -4.81 115.26 114.95 1r5s n ASN 91 Ca 0.26 0.00 -0.06 0.00 -0.02 0.00 0.00 54.58 54.76 1r5s n ASN 91 Cb 0.45 0.16 0.04 0.00 -2.36 0.00 0.00 39.78 38.07 1r5s n ASN 91 CO 0.00 0.00 0.00 1.56 -1.03 0.00 0.00 177.26 177.79 1r5s h GLN 92 N 0.00 0.91 0.00 -3.83 4.20 -1.94 0.62 115.11 115.08 1r5s h GLN 92 Ca 0.00 -0.12 -0.04 0.00 0.06 0.00 0.00 58.65 58.56 1r5s h GLN 92 Cb 0.00 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 27.60 1r5s h GLN 92 CO 0.00 0.70 -0.19 -2.95 -0.67 0.00 0.00 178.83 175.72 1r5s h ASN 93 N 0.89 0.00 0.64 1.46 7.08 -1.91 -1.52 115.58 122.22 1r5s h ASN 93 Ca 0.23 0.00 -0.27 0.00 -3.08 0.00 0.00 56.30 53.17 1r5s h ASN 93 Cb 0.07 0.00 -0.01 0.00 -2.08 0.00 0.00 38.32 36.30 1r5s h ASN 93 CO -0.03 0.19 -1.31 0.00 -2.08 0.00 0.00 177.43 174.19 1r5s h ALA 94 N 1.81 0.25 0.10 4.14 0.00 -1.66 -3.22 119.26 120.68 1r5s h ALA 94 Ca -0.00 -1.00 -0.22 0.00 0.00 0.00 0.00 54.91 53.69 1r5s h ALA 94 Cb 0.71 0.09 0.02 0.00 0.00 0.00 0.00 17.79 18.61 1r5s h ALA 94 CO 0.02 1.12 -0.91 1.57 0.00 0.00 0.00 179.25 181.06 1r5s h LYS 95 N 0.05 0.44 0.00 0.00 2.10 -0.76 0.84 116.57 119.24 1r5s h LYS 95 Ca -0.15 -0.61 0.00 0.00 -2.00 0.00 0.00 60.65 57.89 1r5s h LYS 95 Cb 1.95 0.20 0.00 0.00 -0.90 0.00 0.00 32.23 33.48 1r5s h LYS 95 CO 0.17 1.25 0.00 1.63 -2.00 0.00 0.00 179.45 180.50 1r5s n LYS 96 N -4.04 0.07 0.00 0.07 5.02 -0.58 0.48 118.16 119.18 1r5s n LYS 96 Ca -0.13 0.26 0.00 0.00 -2.02 0.00 0.00 58.31 56.42 1r5s n LYS 96 Cb 0.84 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 34.35 1r5s n LYS 96 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1r5s n VAL 97 N -1.39 0.00 0.01 -0.18 0.31 -1.20 -4.80 118.33 111.07 1r5s n VAL 97 Ca 0.04 0.00 -0.16 0.00 -0.01 0.00 0.00 64.34 64.21 1r5s n VAL 97 Cb 0.10 -0.58 -0.14 0.00 -0.91 0.00 0.00 33.84 32.31 1r5s n VAL 97 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1r5s h ALA 98 N 0.00 0.53 -0.12 3.52 0.00 0.74 -3.07 119.26 120.87 1r5s h ALA 98 Ca 0.00 -1.36 -0.68 0.00 0.00 0.00 0.00 54.91 52.86 1r5s h ALA 98 Cb 0.99 0.54 0.00 0.00 0.00 0.00 0.00 17.79 19.32 1r5s h ALA 98 CO 0.00 1.38 3.59 0.00 0.00 0.00 0.00 179.25 184.23 1r5s n ALA 99 N -2.76 7.41 0.00 0.00 0.00 0.18 -3.43 120.51 121.90 1r5s n ALA 99 Ca -0.23 -3.64 0.00 0.00 0.00 0.00 0.00 53.44 49.57 1r5s n ALA 99 Cb 1.05 -3.27 0.00 0.00 0.00 0.00 0.00 19.45 17.22 1r5s n ALA 99 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1r5s n GLY 100 N 3.26 0.32 0.01 0.00 0.00 -1.26 -4.78 105.19 102.74 1r5s n GLY 100 Ca 0.75 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.93 1r5s n GLY 100 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1r5s n HIS 101 N 0.00 0.00 0.03 1.61 -0.00 -1.16 -2.76 115.22 112.95 1r5s n HIS 101 Ca 0.00 0.00 -0.10 0.00 -0.00 0.00 0.00 57.72 57.62 1r5s n HIS 101 Cb 0.00 -0.05 -0.13 0.00 -0.00 0.00 0.00 29.99 29.81 1r5s n HIS 101 CO 0.00 0.00 0.00 0.93 -0.00 0.00 0.00 176.34 177.27 1r5s h GLU 102 N 0.04 0.05 0.00 1.57 5.08 -1.85 -3.47 114.58 116.01 1r5s h GLU 102 Ca 0.00 -0.09 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 1r5s h GLU 102 Cb 0.06 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.34 1r5s h GLU 102 CO 0.00 0.86 0.00 1.47 -1.00 0.00 0.00 179.01 180.34 1r5s n LEU 103 N -3.27 0.00 -1.39 1.33 -0.00 -1.21 -5.16 117.00 107.30 1r5s n LEU 103 Ca -0.09 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 55.92 1r5s n LEU 103 Cb 1.00 0.02 0.00 0.00 -0.00 0.00 0.00 43.42 44.44 1r5s n LEU 103 CO 0.47 -0.02 -0.40 1.67 -0.00 0.00 0.00 177.39 179.11 1r5s n GLN 104 N -1.01 -4.00 -1.33 1.47 -0.06 -1.11 -4.61 117.38 106.74 1r5s n GLN 104 Ca 0.00 2.97 -0.22 0.00 -2.00 0.00 0.00 57.00 57.75 1r5s n GLN 104 Cb 0.00 -3.34 -0.10 0.00 -4.06 0.00 0.00 30.24 22.74 1r5s n GLN 104 CO 0.00 0.00 0.00 -0.35 -0.20 0.00 0.00 177.06 176.51 1r5s n PRO 105 N -0.83 2.36 -0.06 3.69 -0.04 -1.26 -4.16 135.00 134.71 1r5s n PRO 105 Ca 0.00 -1.90 -0.11 0.00 -0.04 0.00 0.00 63.50 61.45 1r5s n PRO 105 Cb 0.00 -2.12 -0.04 0.00 -0.04 0.00 0.00 33.50 31.30 1r5s n PRO 105 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 1r5s n LEU 106 N 1.54 1.14 -2.17 1.53 7.94 -1.26 -4.96 117.00 120.76 1r5s n LEU 106 Ca 0.48 0.11 -0.17 0.00 -1.11 0.00 0.00 56.01 55.31 1r5s n LEU 106 Cb 0.67 -0.34 -0.03 0.00 0.53 0.00 0.00 43.42 44.25 1r5s n LEU 106 CO 0.28 0.30 -0.20 0.00 -1.11 0.00 0.00 177.39 176.66 1r5s n ALA 107 N -3.40 -0.57 -3.09 1.96 0.00 -1.26 -0.95 120.51 113.20 1r5s n ALA 107 Ca -0.22 0.18 -0.13 0.00 0.00 0.00 0.00 53.44 53.27 1r5s n ALA 107 Cb 0.66 -1.85 0.05 0.00 0.00 0.00 0.00 19.45 18.31 1r5s n ALA 107 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1r5s n ILE 108 N -3.31 -2.01 -2.17 0.00 -0.00 -1.26 -4.18 119.36 106.44 1r5s n ILE 108 Ca -0.20 -0.04 -0.03 0.00 -0.00 0.00 0.00 62.75 62.48 1r5s n ILE 108 Cb 0.63 -3.10 0.00 0.00 -0.00 0.00 0.00 39.64 37.17 1r5s n ILE 108 CO 0.00 0.00 0.00 0.52 -0.00 0.00 0.00 176.55 177.07 1r5s n VAL 109 N -3.79 -6.21 0.04 1.39 0.31 -0.13 -4.98 118.33 104.95 1r5s n VAL 109 Ca -0.02 0.32 -0.09 0.00 -0.01 0.00 0.00 64.34 64.54 1r5s n VAL 109 Cb 0.54 -5.51 -0.13 0.00 -0.91 0.00 0.00 33.84 27.83 1r5s n VAL 109 CO 0.00 0.00 0.00 -2.24 -1.32 0.00 0.00 176.83 173.27 1r5s h ASP 110 N 0.81 0.07 1.77 4.52 2.03 -1.57 -3.30 116.42 120.74 1r5s h ASP 110 Ca 0.00 -0.09 -0.04 0.00 -0.73 0.00 0.00 57.03 56.17 1r5s h ASP 110 Cb 0.59 -0.02 -0.01 0.00 -0.83 0.00 0.00 39.33 39.07 1r5s h ASP 110 CO 0.11 1.07 -0.23 1.56 -1.03 0.00 0.00 179.24 180.72 1r5s h GLN 111 N 0.01 0.00 -6.06 4.15 1.08 -1.94 -3.48 115.11 108.87 1r5s h GLN 111 Ca -0.13 0.00 -0.42 0.00 -1.45 0.00 0.00 58.65 56.65 1r5s h GLN 111 Cb 1.88 0.00 0.05 0.00 -0.05 0.00 0.00 27.48 29.37 1r5s h GLN 111 CO 0.12 0.17 -0.77 0.54 -0.95 0.00 0.00 178.83 177.94 1r5s n ARG 112 N -3.12 -5.86 -0.00 1.46 3.00 -1.24 -4.91 116.66 105.99 1r5s n ARG 112 Ca 0.03 0.68 -0.13 0.00 -0.01 0.00 0.00 57.85 58.41 1r5s n ARG 112 Cb 0.61 -5.49 -0.14 0.00 0.00 0.00 0.00 32.46 27.44 1r5s n ARG 112 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.63 176.63 1r5s h PRO 113 N -2.09 0.11 0.00 5.56 0.13 -1.92 -3.48 132.00 130.31 1r5s h PRO 113 Ca -0.59 -0.18 0.00 0.00 -0.87 0.00 0.00 66.00 64.35 1r5s h PRO 113 Cb 1.36 0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.56 1r5s h PRO 113 CO 0.59 0.79 0.00 0.43 -0.23 0.00 0.00 178.00 179.58 1r5s n SER 114 N -3.23 -1.38 -1.62 1.44 7.64 -1.26 -1.47 113.62 113.74 1r5s n SER 114 Ca -0.21 0.00 -0.11 0.00 1.01 0.00 0.00 58.87 59.55 1r5s n SER 114 Cb 1.05 -2.35 0.02 0.00 -1.01 0.00 0.00 64.21 61.92 1r5s n SER 114 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1r5s n SER 115 N -0.21 -3.85 -0.01 6.43 7.64 -1.26 -4.90 113.62 117.45 1r5s n SER 115 Ca 0.00 -0.13 0.00 0.00 1.01 0.00 0.00 58.87 59.75 1r5s n SER 115 Cb 0.11 -2.78 -0.00 0.00 -1.01 0.00 0.00 64.21 60.52 1r5s n SER 115 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1r5s n ARG 116 N -2.38 4.58 0.02 1.43 1.74 -0.54 -4.20 116.66 117.31 1r5s n ARG 116 Ca -0.07 -0.16 0.01 0.00 -0.77 0.00 0.00 57.85 56.87 1r5s n ARG 116 Cb 0.57 -0.67 0.05 0.00 -1.02 0.00 0.00 32.46 31.39 1r5s n ARG 116 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1r5s n ALA 117 N -0.71 0.98 -2.53 7.54 0.00 -1.25 -3.26 120.51 121.27 1r5s n ALA 117 Ca 0.00 0.02 -0.01 0.00 0.00 0.00 0.00 53.44 53.45 1r5s n ALA 117 Cb 0.01 -1.00 0.06 0.00 0.00 0.00 0.00 19.45 18.52 1r5s n ALA 117 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1r5s n SER 118 N -1.56 -0.71 0.00 0.00 2.88 -1.26 -4.96 113.62 108.01 1r5s n SER 118 Ca -0.00 -1.57 0.08 0.00 -1.33 0.00 0.00 58.87 56.05 1r5s n SER 118 Cb 0.02 0.33 0.36 0.00 -0.75 0.00 0.00 64.21 64.17 1r5s n SER 118 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1r5s n SER 119 N -0.73 0.00 0.00 -3.46 2.88 -1.20 -2.65 113.62 108.47 1r5s n SER 119 Ca -0.09 0.39 -0.09 0.00 -1.33 0.00 0.00 58.87 57.75 1r5s n SER 119 Cb 0.68 -0.45 0.07 0.00 -0.75 0.00 0.00 64.21 63.76 1r5s n SER 119 CO 0.00 0.00 0.00 0.08 -1.23 0.00 0.00 175.04 173.89 1r5s h ARG 120 N 0.00 0.55 0.00 -1.46 0.11 -1.93 -3.47 114.38 108.18 1r5s h ARG 120 Ca 0.00 -0.33 0.00 0.00 0.10 0.00 0.00 59.98 59.75 1r5s h ARG 120 Cb 0.25 0.03 0.00 0.00 1.11 0.00 0.00 29.97 31.36 1r5s h ARG 120 CO 0.00 0.93 0.00 0.00 0.10 0.00 0.00 179.97 181.00 1r5s n ALA 121 N -2.51 0.00 -2.39 0.08 0.00 -1.08 -3.50 120.51 111.09 1r5s n ALA 121 Ca -0.03 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.39 1r5s n ALA 121 Cb 0.58 0.00 0.05 0.00 0.00 0.00 0.00 19.45 20.08 1r5s n ALA 121 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1r5s n SER 122 N 3.65 -0.98 -4.09 0.00 7.64 -1.26 -5.05 113.62 113.53 1r5s n SER 122 Ca 0.00 -1.77 -0.37 0.00 1.01 0.00 0.00 58.87 57.74 1r5s n SER 122 Cb 0.00 0.42 -0.05 0.00 -1.01 0.00 0.00 64.21 63.57 1r5s n SER 122 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1r5s n SER 123 N -0.80 2.97 -3.41 6.43 7.64 -1.23 -4.73 113.62 120.49 1r5s n SER 123 Ca -0.16 -2.71 -0.26 0.00 1.01 0.00 0.00 58.87 56.75 1r5s n SER 123 Cb 0.72 -1.44 -0.08 0.00 -1.01 0.00 0.00 64.21 62.40 1r5s n SER 123 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1r5s n ARG 124 N 7.59 1.62 -1.87 1.43 1.74 -1.26 -5.10 116.66 120.80 1r5s n ARG 124 Ca 0.48 -4.03 -0.41 0.00 -0.77 0.00 0.00 57.85 53.11 1r5s n ARG 124 Cb 0.43 -1.87 -0.02 0.00 -1.02 0.00 0.00 32.46 29.98 1r5s n ARG 124 CO 0.00 0.00 0.00 -2.14 -1.52 0.00 0.00 177.63 173.97 1r5s s PRO 125 N -1.67 4.18 0.12 5.56 0.02 -1.26 -4.78 135.00 137.18 1r5s s PRO 125 Ca 0.36 2.46 0.00 0.00 0.02 0.00 0.00 61.00 63.84 1r5s s PRO 125 Cb 0.12 -3.06 0.00 0.00 0.02 0.00 0.00 34.50 31.57 1r5s s PRO 125 CO -0.08 -0.55 0.00 -2.13 -0.33 0.00 0.00 177.00 173.90 1r5s n ARG 126 N 2.36 0.00 -1.53 5.54 0.00 -1.26 -4.91 116.66 116.86 1r5s n ARG 126 Ca 0.08 0.00 -0.38 0.00 -0.00 0.00 0.00 57.85 57.55 1r5s n ARG 126 Cb 0.38 0.00 -0.03 0.00 0.00 0.00 0.00 32.46 32.82 1r5s n ARG 126 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.63 177.28 1r5s n PRO 127 N -2.72 3.92 -2.61 -0.14 -0.05 -1.26 -4.49 135.00 127.66 1r5s n PRO 127 Ca 0.00 -2.58 -0.17 0.00 -0.05 0.00 0.00 63.50 60.70 1r5s n PRO 127 Cb 0.00 -2.70 0.01 0.00 -0.05 0.00 0.00 33.50 30.76 1r5s n PRO 127 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 175.50 171.98 1r5s n ASP 128 N 2.85 -4.94 -0.23 3.54 2.03 -1.26 -2.25 116.55 116.29 1r5s n ASP 128 Ca 0.71 -0.13 -0.02 0.00 0.52 0.00 0.00 54.79 55.88 1r5s n ASP 128 Cb 0.27 -3.91 -0.00 0.00 -0.72 0.00 0.00 41.12 36.76 1r5s n ASP 128 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 1r5s n ASP 129 N -1.31 -1.46 0.00 1.67 2.03 -1.26 -3.45 116.55 112.77 1r5s n ASP 129 Ca -0.13 -0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.17 1r5s n ASP 129 Cb 0.62 -0.86 0.00 0.00 -0.72 0.00 0.00 41.12 40.15 1r5s n ASP 129 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1r5s n LEU 130 N -0.28 0.80 0.19 -2.67 4.77 -0.95 -4.80 117.00 114.05 1r5s n LEU 130 Ca -0.02 0.00 0.14 0.00 -0.03 0.00 0.00 56.01 56.10 1r5s n LEU 130 Cb 0.51 -1.70 0.65 0.00 -2.33 0.00 0.00 43.42 40.55 1r5s n LEU 130 CO 0.03 -0.62 0.91 1.05 -1.33 0.00 0.00 177.39 177.43 1r5s h GLU 131 N 0.38 0.00 -0.02 3.23 4.11 -1.62 -3.50 114.58 117.17 1r5s h GLU 131 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1r5s h GLU 131 Cb 0.45 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.70 1r5s h GLU 131 CO 0.00 0.00 0.00 -0.89 0.07 0.00 0.00 179.01 178.19