#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 -0.33 -2.38 1.61 -0.04 -1.26 -4.88 135.00 127.72 1r5s n PRO 2 Ca 0.00 0.00 -0.05 0.00 -0.04 0.00 0.00 63.50 63.41 1r5s n PRO 2 Cb 0.00 0.00 -0.04 0.00 -0.04 0.00 0.00 33.50 33.42 1r5s n PRO 2 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 1r5s n LEU 3 N 0.00 -5.37 0.00 1.53 0.00 -1.26 -4.93 117.00 106.97 1r5s n LEU 3 Ca 0.00 1.91 0.00 0.00 0.00 0.00 0.00 56.01 57.92 1r5s n LEU 3 Cb 0.00 -2.87 0.00 0.00 0.00 0.00 0.00 43.42 40.55 1r5s n LEU 3 CO 0.00 -3.30 0.00 0.61 0.00 0.00 0.00 177.39 174.70 1r5s n GLY 4 N 1.40 0.62 2.43 -3.96 0.00 -1.26 -5.05 105.19 99.36 1r5s n GLY 4 Ca -0.35 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.45 1r5s n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1r5s n SER 5 N 0.00 -0.96 -1.17 1.61 3.41 -1.26 -4.98 113.62 110.27 1r5s n SER 5 Ca 0.00 -2.57 -0.03 0.00 -0.26 0.00 0.00 58.87 56.02 1r5s n SER 5 Cb 0.00 -0.08 0.10 0.00 -0.26 0.00 0.00 64.21 63.97 1r5s n SER 5 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 1r5s n PRO 6 N 2.52 1.87 -0.01 4.33 -0.04 -1.26 -3.71 135.00 138.70 1r5s n PRO 6 Ca 0.25 -1.01 0.10 0.00 -0.04 0.00 0.00 63.50 62.81 1r5s n PRO 6 Cb 0.51 -1.58 -0.15 0.00 -0.04 0.00 0.00 33.50 32.24 1r5s n PRO 6 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1r5s n SER 7 N 0.09 0.37 -2.85 3.54 2.88 -1.26 -5.02 113.62 111.37 1r5s n SER 7 Ca 0.14 -0.30 -0.09 0.00 -1.33 0.00 0.00 58.87 57.29 1r5s n SER 7 Cb 0.72 1.68 0.04 0.00 -0.75 0.00 0.00 64.21 65.90 1r5s n SER 7 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1r5s n LYS 8 N -2.01 -1.62 -1.52 -1.46 4.76 -1.24 -4.74 118.16 110.32 1r5s n LYS 8 Ca -0.02 0.82 -0.30 0.00 -2.87 0.00 0.00 58.31 55.94 1r5s n LYS 8 Cb 0.49 -4.92 -0.14 0.00 -1.84 0.00 0.00 35.03 28.61 1r5s n LYS 8 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 1r5s n ASP 9 N -2.60 0.32 -0.07 4.39 5.75 -1.26 -4.75 116.55 118.32 1r5s n ASP 9 Ca -0.04 -0.40 -0.14 0.00 -0.01 0.00 0.00 54.79 54.19 1r5s n ASP 9 Cb 0.57 -1.02 -0.13 0.00 -1.03 0.00 0.00 41.12 39.52 1r5s n ASP 9 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1r5s n GLY 11 N 1.60 0.68 3.16 0.00 0.00 -1.26 -5.09 105.19 104.27 1r5s n GLY 11 Ca -0.11 -0.82 -0.39 0.00 0.00 0.00 0.00 46.02 44.70 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 -1.15 5.53 0.18 1.61 0.01 -1.26 -4.97 113.70 113.64 1r5s s SER 12 Ca 0.00 -2.35 -0.19 0.00 1.31 0.00 0.00 55.95 54.72 1r5s s SER 12 Cb 0.00 -1.93 0.11 0.00 0.21 0.00 0.00 66.02 64.41 1r5s s SER 12 CO 0.00 -0.53 1.62 -0.65 0.41 0.00 0.00 173.24 174.09 1r5s h PRO 13 N 7.79 -0.14 -0.86 12.44 0.11 -2.04 -3.40 132.00 145.90 1r5s h PRO 13 Ca -0.09 0.01 -0.12 0.00 0.11 0.00 0.00 66.00 65.91 1r5s h PRO 13 Cb 1.02 0.03 -0.16 0.00 0.11 0.00 0.00 31.00 32.00 1r5s h PRO 13 CO 0.76 -0.10 -0.43 0.21 -0.21 0.00 0.00 178.00 178.24 1r5s s LYS 14 N -6.10 0.92 0.00 1.05 2.47 -1.26 -5.05 119.74 111.77 1r5s s LYS 14 Ca -0.14 -0.88 0.00 0.00 -1.56 0.00 0.00 55.97 53.39 1r5s s LYS 14 Cb 0.15 -0.03 0.00 0.00 -1.46 0.00 0.00 37.83 36.49 1r5s s LYS 14 CO 0.70 -1.14 0.00 0.98 0.16 0.00 0.00 175.35 176.05 1r5s n TYR 15 N 2.97 -0.01 -2.96 4.03 4.19 -1.26 -5.11 117.16 119.01 1r5s n TYR 15 Ca 0.16 0.00 -0.11 0.00 3.31 0.00 0.00 57.90 61.27 1r5s n TYR 15 Cb 0.58 0.00 0.01 0.00 0.49 0.00 0.00 39.34 40.42 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 -0.71 -1.95 -1.52 2.98 0.00 -1.26 -4.93 120.51 113.12 1r5s n ALA 16 Ca 0.00 0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.53 1r5s n ALA 16 Cb 0.00 -0.89 0.00 0.00 0.00 0.00 0.00 19.45 18.56 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 0.79 0.00 0.07 0.00 4.01 -1.26 -4.88 117.16 115.89 1r5s n TYR 17 Ca -0.02 0.00 0.20 0.00 -0.16 0.00 0.00 57.90 57.92 1r5s n TYR 17 Cb 0.49 0.07 0.65 0.00 -0.31 0.00 0.00 39.34 40.24 1r5s n TYR 17 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 1r5s h PHE 18 N 0.00 0.00 -2.78 -0.72 -0.00 -2.06 -3.44 116.94 107.93 1r5s h PHE 18 Ca 0.00 0.00 -0.24 0.00 -0.00 0.00 0.00 57.97 57.73 1r5s h PHE 18 Cb 0.97 0.00 0.03 0.00 -0.00 0.00 0.00 35.95 36.95 1r5s h PHE 18 CO 0.00 0.00 -0.36 0.09 -0.00 0.00 0.00 178.31 178.04 1r5s n ASN 19 N -3.40 -4.25 -2.18 -0.68 3.02 -1.26 -4.95 115.26 101.56 1r5s n ASN 19 Ca 0.09 -0.16 -0.22 0.00 -0.03 0.00 0.00 54.58 54.26 1r5s n ASN 19 Cb 0.81 -3.14 0.02 0.00 -0.61 0.00 0.00 39.78 36.86 1r5s n ASN 19 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1r5s n GLY 20 N -1.20 5.81 3.82 7.41 0.00 -1.26 -5.04 105.19 114.73 1r5s n GLY 20 Ca -0.07 -2.51 -0.36 0.00 0.00 0.00 0.00 46.02 43.08 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 5.53 -0.99 -1.75 0.00 0.87 -2.00 -3.38 113.55 111.83 1r5s h SER 22 Ca -0.50 0.09 -0.51 0.00 -1.23 0.00 0.00 61.79 59.64 1r5s h SER 22 Cb 1.20 0.35 -0.36 0.00 -0.44 0.00 0.00 62.40 63.15 1r5s h SER 22 CO 0.64 -0.40 -1.04 -1.20 -0.53 0.00 0.00 176.83 174.30 1r5s n SER 23 N -4.43 -0.17 0.22 6.23 7.64 -1.26 -4.94 113.62 116.90 1r5s n SER 23 Ca -0.07 -2.79 0.15 0.00 1.01 0.00 0.00 58.87 57.17 1r5s n SER 23 Cb 0.29 -0.32 0.70 0.00 -1.01 0.00 0.00 64.21 63.86 1r5s n SER 23 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 1r5s h PRO 24 N 3.92 0.00 -4.57 1.43 0.13 -2.00 -3.36 132.00 127.54 1r5s h PRO 24 Ca 0.04 0.00 -0.65 0.00 -0.87 0.00 0.00 66.00 64.53 1r5s h PRO 24 Cb 0.91 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.02 1r5s h PRO 24 CO 0.44 0.00 2.50 2.41 -0.23 0.00 0.00 178.00 183.13 1r5s n THR 25 N -2.66 2.78 -0.20 1.56 -1.04 -1.26 -4.77 114.28 108.70 1r5s n THR 25 Ca 0.00 -2.55 0.00 0.00 -2.04 0.00 0.00 64.05 59.46 1r5s n THR 25 Cb 0.19 -2.43 0.09 0.00 -1.82 0.00 0.00 70.33 66.37 1r5s n THR 25 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1r5s h ALA 26 N 7.26 0.56 -3.00 2.41 0.00 -2.04 -3.41 119.26 121.04 1r5s h ALA 26 Ca 0.47 0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.57 1r5s h ALA 26 Cb 0.71 0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1r5s h ALA 26 CO 1.79 -0.40 0.00 -2.30 0.00 0.00 0.00 179.25 178.34 1r5s n PRO 27 N -5.30 1.71 0.00 0.00 -0.02 -1.26 -5.04 135.00 125.09 1r5s n PRO 27 Ca 0.08 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.56 1r5s n PRO 27 Cb 0.34 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.82 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 0.60 -4.51 2.45 -0.00 -1.26 -5.02 117.00 109.26 1r5s n LEU 28 Ca 0.00 0.00 -0.43 0.00 -0.00 0.00 0.00 56.01 55.58 1r5s n LEU 28 Cb 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 43.42 43.35 1r5s n LEU 28 CO 0.00 -0.03 0.28 -0.94 -0.00 0.00 0.00 177.39 176.70 1r5s s SER 29 N -4.01 6.28 0.63 1.45 1.04 -1.26 -4.93 113.70 112.90 1r5s s SER 29 Ca 0.00 -0.44 0.31 0.00 0.48 0.00 0.00 55.95 56.30 1r5s s SER 29 Cb 0.00 -2.29 1.70 0.00 0.10 0.00 0.00 66.02 65.53 1r5s s SER 29 CO 0.00 -0.70 2.01 -0.65 0.98 0.00 0.00 173.24 174.88 1r5s h PRO 30 N 8.81 0.00 -7.16 4.02 0.11 -2.00 -3.43 132.00 132.34 1r5s h PRO 30 Ca -0.26 0.00 -0.51 0.00 0.11 0.00 0.00 66.00 65.34 1r5s h PRO 30 Cb 1.10 0.00 0.21 0.00 0.11 0.00 0.00 31.00 32.42 1r5s h PRO 30 CO 0.85 0.00 0.04 0.00 -0.21 0.00 0.00 178.00 178.69 1r5s n MET 31 N -3.31 -0.67 -3.13 1.05 0.00 -1.26 -4.94 117.12 104.86 1r5s n MET 31 Ca 0.01 -0.14 -0.45 0.00 0.00 0.00 0.00 57.70 57.12 1r5s n MET 31 Cb 0.39 -2.26 -0.03 0.00 0.00 0.00 0.00 33.22 31.32 1r5s n MET 31 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 175.97 174.43 1r5s s SER 32 N -2.50 6.46 0.14 3.17 1.04 -1.26 -4.95 113.70 115.80 1r5s s SER 32 Ca 0.65 -1.95 -0.30 0.00 0.48 0.00 0.00 55.95 54.84 1r5s s SER 32 Cb -0.23 -2.30 -0.06 0.00 0.10 0.00 0.00 66.02 63.54 1r5s s SER 32 CO 0.60 -0.95 1.56 1.55 0.98 0.00 0.00 173.24 176.99 1r5s h PRO 33 N 8.70 -0.38 -3.61 4.02 0.13 -1.92 -2.92 132.00 136.03 1r5s h PRO 33 Ca -0.07 0.03 -0.44 0.00 -0.87 0.00 0.00 66.00 64.65 1r5s h PRO 33 Cb 1.06 0.09 0.02 0.00 0.13 0.00 0.00 31.00 32.30 1r5s h PRO 33 CO 1.01 -0.25 2.61 -0.35 -0.23 0.00 0.00 178.00 180.78 1r5s n PRO 34 N -5.40 2.05 0.36 1.56 -0.04 -1.26 -4.66 135.00 127.60 1r5s n PRO 34 Ca -0.02 -1.57 -0.18 0.00 -0.04 0.00 0.00 63.50 61.69 1r5s n PRO 34 Cb 0.35 -2.56 -0.09 0.00 -0.04 0.00 0.00 33.50 31.17 1r5s n PRO 34 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 1r5s h GLY 35 N 9.24 -1.03 -3.51 0.55 0.00 -1.96 -3.46 103.07 102.90 1r5s h GLY 35 Ca 0.50 0.42 -0.41 0.00 0.00 0.00 0.00 47.33 47.83 1r5s h GLY 35 CO 1.55 -0.37 -0.56 -1.72 0.00 0.00 0.00 176.54 175.44 1r5s n TYR 36 N -5.52 -1.33 -0.83 5.60 4.01 -1.26 -4.87 117.16 112.96 1r5s n TYR 36 Ca -0.13 0.17 -0.09 0.00 -0.16 0.00 0.00 57.90 57.69 1r5s n TYR 36 Cb 0.41 -4.15 0.25 0.00 -0.31 0.00 0.00 39.34 35.54 1r5s n TYR 36 CO 0.00 0.00 0.00 0.36 -0.46 0.00 0.00 176.86 176.76 1r5s n LYS 37 N -3.36 3.16 -0.09 -0.72 -0.00 -1.26 -4.13 118.16 111.77 1r5s n LYS 37 Ca -0.20 -2.71 -0.10 0.00 -0.00 0.00 0.00 58.31 55.29 1r5s n LYS 37 Cb 0.67 -2.10 -0.15 0.00 -0.00 0.00 0.00 35.03 33.44 1r5s n LYS 37 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.40 177.29 1r5s n LEU 38 N -0.27 0.33 -0.59 -5.58 7.94 -1.26 -4.47 117.00 113.10 1r5s n LEU 38 Ca 0.40 0.05 0.06 0.00 -1.11 0.00 0.00 56.01 55.41 1r5s n LEU 38 Cb 1.34 0.35 0.17 0.00 0.53 0.00 0.00 43.42 45.81 1r5s n LEU 38 CO 0.43 0.52 0.36 1.33 -1.11 0.00 0.00 177.39 178.92 1r5s n VAL 39 N -2.83 1.82 -1.63 1.96 0.24 -1.26 -4.41 118.33 112.22 1r5s n VAL 39 Ca -0.32 -2.69 -0.36 0.00 -2.04 0.00 0.00 64.34 58.94 1r5s n VAL 39 Cb 1.13 -0.08 -0.03 0.00 -1.47 0.00 0.00 33.84 33.40 1r5s n VAL 39 CO 0.00 0.00 0.00 0.41 -2.14 0.00 0.00 176.83 175.10 1r5s n THR 40 N -0.96 4.54 0.00 3.34 -1.04 -1.26 -4.37 114.28 114.53 1r5s n THR 40 Ca 0.16 -3.38 0.00 0.00 -2.04 0.00 0.00 64.05 58.79 1r5s n THR 40 Cb 0.73 -2.18 0.00 0.00 -1.82 0.00 0.00 70.33 67.06 1r5s n THR 40 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1r5s n GLY 41 N 2.27 2.58 0.22 3.41 0.00 -1.26 -4.92 105.19 107.48 1r5s n GLY 41 Ca 0.64 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.59 1r5s n GLY 41 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1r5s h ASP 42 N 0.00 0.57 -2.81 1.61 5.19 -1.80 -3.43 116.42 115.75 1r5s h ASP 42 Ca 0.00 -0.28 -0.54 0.00 -0.62 0.00 0.00 57.03 55.59 1r5s h ASP 42 Cb 0.00 -0.16 0.00 0.00 0.18 0.00 0.00 39.33 39.35 1r5s h ASP 42 CO 0.00 0.96 0.92 -0.13 -3.12 0.00 0.00 179.24 177.87 1r5s s ARG 43 N -4.11 4.24 0.00 3.56 1.81 -1.26 -4.10 118.95 119.09 1r5s s ARG 43 Ca -0.07 2.09 0.00 0.00 -1.72 0.00 0.00 55.73 56.03 1r5s s ARG 43 Cb 0.12 -3.64 0.00 0.00 -0.45 0.00 0.00 34.95 30.98 1r5s s ARG 43 CO 0.83 -0.66 0.00 0.27 -0.68 0.00 0.00 175.30 175.06 1r5s n ASN 44 N 5.71 0.00 -0.03 0.23 0.23 -1.26 -4.97 115.26 115.16 1r5s n ASN 44 Ca 0.14 0.00 -0.06 0.00 -0.53 0.00 0.00 54.58 54.14 1r5s n ASN 44 Cb 0.43 0.00 -0.03 0.00 -2.08 0.00 0.00 39.78 38.10 1r5s n ASN 44 CO 0.00 0.00 0.00 -0.46 -0.93 0.00 0.00 177.26 175.87 1r5s n ASN 45 N 0.00 2.54 -1.70 0.53 0.23 -1.26 -5.02 115.26 110.58 1r5s n ASN 45 Ca 0.00 0.00 -0.13 0.00 -0.53 0.00 0.00 54.58 53.92 1r5s n ASN 45 Cb 0.00 -0.14 0.01 0.00 -2.08 0.00 0.00 39.78 37.57 1r5s n ASN 45 CO 0.00 0.00 0.00 -0.24 -0.93 0.00 0.00 177.26 176.09 1r5s n SER 46 N -2.89 -4.15 -2.59 0.53 2.88 -1.26 -5.01 113.62 101.12 1r5s n SER 46 Ca -0.12 -0.10 -0.04 0.00 -1.33 0.00 0.00 58.87 57.27 1r5s n SER 46 Cb 0.62 -3.17 0.02 0.00 -0.75 0.00 0.00 64.21 60.93 1r5s n SER 46 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1r5s n SER 47 N -0.63 0.39 0.00 -3.46 2.88 -1.26 -5.02 113.62 106.51 1r5s n SER 47 Ca -0.10 -1.30 0.00 0.00 -1.33 0.00 0.00 58.87 56.14 1r5s n SER 47 Cb 0.59 -0.11 0.00 0.00 -0.75 0.00 0.00 64.21 63.94 1r5s n SER 47 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1r5s h ARG 49 N 0.00 0.00 -0.03 0.00 2.47 -2.04 -1.01 114.38 113.77 1r5s h ARG 49 Ca 0.00 0.00 -0.02 0.00 -1.26 0.00 0.00 59.98 58.70 1r5s h ARG 49 Cb 0.00 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.32 1r5s h ARG 49 CO 0.00 0.00 -0.06 -0.91 0.56 0.00 0.00 179.97 179.56 1r5s h ASN 50 N 0.00 0.03 -4.66 7.04 4.21 -2.02 -3.48 115.58 116.70 1r5s h ASN 50 Ca 0.02 -0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.53 1r5s h ASN 50 Cb 0.08 -0.01 -0.04 0.00 -1.12 0.00 0.00 38.32 37.23 1r5s h ASN 50 CO -0.00 0.10 -1.10 -1.22 -1.29 0.00 0.00 177.43 173.92 1r5s n TYR 51 N -4.45 -4.33 0.09 1.19 4.01 -0.38 -4.95 117.16 108.34 1r5s n TYR 51 Ca -0.02 2.56 -0.22 0.00 -0.16 0.00 0.00 57.90 60.05 1r5s n TYR 51 Cb 0.15 -3.71 -0.15 0.00 -0.31 0.00 0.00 39.34 35.32 1r5s n TYR 51 CO 0.00 0.00 0.00 -2.95 -0.46 0.00 0.00 176.86 173.45 1r5s h ASN 52 N 3.85 0.64 -6.51 7.72 -1.07 -1.93 -3.48 115.58 114.79 1r5s h ASN 52 Ca -0.18 -0.84 -0.51 0.00 0.07 0.00 0.00 56.30 54.83 1r5s h ASN 52 Cb 0.41 -0.21 -0.11 0.00 -2.07 0.00 0.00 38.32 36.34 1r5s h ASN 52 CO 0.00 1.69 -0.80 0.29 0.07 0.00 0.00 177.43 178.69 1r5s n LYS 53 N -3.60 -4.39 -3.00 4.14 5.02 -1.26 -4.88 118.16 110.18 1r5s n LYS 53 Ca -0.21 0.49 -0.14 0.00 -2.02 0.00 0.00 58.31 56.43 1r5s n LYS 53 Cb 1.08 -5.28 0.02 0.00 -0.02 0.00 0.00 35.03 30.82 1r5s n LYS 53 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1r5s n GLN 54 N -4.54 0.98 -3.59 1.97 10.64 -1.26 -5.03 117.38 116.55 1r5s n GLN 54 Ca 0.04 -2.77 -0.35 0.00 -1.83 0.00 0.00 57.00 52.09 1r5s n GLN 54 Cb 0.52 -1.43 -0.06 0.00 -0.86 0.00 0.00 30.24 28.41 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 0.36 3.91 -0.03 2.61 0.00 -1.26 -4.76 120.51 121.33 1r5s n ALA 55 Ca 0.17 -4.63 0.02 0.00 0.00 0.00 0.00 53.44 49.01 1r5s n ALA 55 Cb 0.67 -1.63 -0.12 0.00 0.00 0.00 0.00 19.45 18.37 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 2.06 1.42 0.00 0.00 2.88 -1.26 -5.01 113.62 113.72 1r5s n SER 56 Ca 0.23 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.77 1r5s n SER 56 Cb 0.37 1.39 0.00 0.00 -0.75 0.00 0.00 64.21 65.22 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 -2.23 0.00 -2.05 -1.46 -0.58 -1.26 -4.69 120.64 108.37 1r5s n GLU 57 Ca -0.11 0.00 -0.15 0.00 -0.42 0.00 0.00 57.16 56.48 1r5s n GLU 57 Cb 0.62 0.00 -0.03 0.00 -0.57 0.00 0.00 31.44 31.46 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 -1.78 -2.53 3.49 1.13 -1.26 -4.82 117.38 111.62 1r5s n GLN 58 Ca 0.00 0.78 -0.11 0.00 -1.94 0.00 0.00 57.00 55.73 1r5s n GLN 58 Cb 0.00 -5.27 0.03 0.00 0.11 0.00 0.00 30.24 25.11 1r5s n GLN 58 CO 0.00 0.00 0.00 0.27 -1.44 0.00 0.00 177.06 175.89 1r5s n ASN 59 N -1.42 2.89 -0.04 1.08 0.23 -1.26 -4.51 115.26 112.23 1r5s n ASN 59 Ca -0.17 -2.80 -0.06 0.00 -0.53 0.00 0.00 54.58 51.03 1r5s n ASN 59 Cb 0.58 -0.44 -0.04 0.00 -2.08 0.00 0.00 39.78 37.80 1r5s n ASN 59 CO 0.00 0.00 0.00 -2.67 -0.93 0.00 0.00 177.26 173.66 1r5s n TRP 60 N -0.56 0.00 -0.01 -2.53 4.27 -1.26 -4.85 117.44 112.51 1r5s n TRP 60 Ca 0.22 0.00 -0.01 0.00 -3.89 0.00 0.00 57.50 53.82 1r5s n TRP 60 Cb 0.85 -0.32 -0.01 0.00 -1.36 0.00 0.00 31.31 30.46 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 -2.70 1.97 -1.56 -1.67 0.00 -1.26 -5.01 120.51 110.28 1r5s n ALA 61 Ca -0.14 -0.08 -0.19 0.00 0.00 0.00 0.00 53.44 53.03 1r5s n ALA 61 Cb 0.66 0.28 -0.08 0.00 0.00 0.00 0.00 19.45 20.31 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 -2.17 -5.56 0.00 0.00 4.13 -1.26 -3.52 115.26 106.89 1r5s n ASN 62 Ca -0.02 0.48 0.00 0.00 1.68 0.00 0.00 54.58 56.71 1r5s n ASN 62 Cb 0.54 -4.75 0.00 0.00 -1.54 0.00 0.00 39.78 34.03 1r5s n ASN 62 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 1r5s n TYR 63 N -2.36 0.00 -2.38 3.10 4.02 -1.26 -4.31 117.16 113.97 1r5s n TYR 63 Ca -0.19 0.00 -0.14 0.00 -0.01 0.00 0.00 57.90 57.56 1r5s n TYR 63 Cb 0.67 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.99 1r5s n TYR 63 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 176.86 176.28 1r5s n SER 64 N 1.13 -4.37 0.05 7.72 7.64 -1.23 -4.79 113.62 119.77 1r5s n SER 64 Ca 0.00 -0.05 0.00 0.00 1.01 0.00 0.00 58.87 59.83 1r5s n SER 64 Cb 0.00 -3.47 0.00 0.00 -1.01 0.00 0.00 64.21 59.73 1r5s n SER 64 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1r5s n ALA 65 N -1.97 2.14 -1.53 -0.43 0.00 -1.26 -5.02 120.51 112.44 1r5s n ALA 65 Ca -0.15 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.11 1r5s n ALA 65 Cb 0.62 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.99 1r5s n ALA 65 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1r5s n GLU 66 N -2.80 -1.45 0.04 0.00 1.02 -1.26 -4.85 120.64 111.33 1r5s n GLU 66 Ca 0.00 1.11 -0.11 0.00 -0.02 0.00 0.00 57.16 58.13 1r5s n GLU 66 Cb 0.00 -5.47 -0.06 0.00 -0.02 0.00 0.00 31.44 25.89 1r5s n GLU 66 CO 0.00 0.00 0.00 1.96 1.18 0.00 0.00 177.13 180.27 1r5s h GLN 67 N 0.00 -0.04 -0.84 3.49 4.20 -1.98 0.34 115.11 120.28 1r5s h GLN 67 Ca -0.38 0.00 0.11 0.00 0.06 0.00 0.00 58.65 58.45 1r5s h GLN 67 Cb 1.25 0.01 -0.08 0.00 0.30 0.00 0.00 27.48 28.95 1r5s h GLN 67 CO 0.55 -0.03 0.46 -0.91 -0.67 0.00 0.00 178.83 178.23 1r5s h ASN 68 N -0.04 0.63 -0.23 1.46 2.35 -1.99 0.67 115.58 118.42 1r5s h ASN 68 Ca 0.02 0.06 -0.00 0.00 -0.55 0.00 0.00 56.30 55.83 1r5s h ASN 68 Cb 0.07 -0.05 -0.01 0.00 0.05 0.00 0.00 38.32 38.38 1r5s h ASN 68 CO -0.04 0.33 0.13 0.03 -1.65 0.00 0.00 177.43 176.23 1r5s h ARG 69 N 0.73 0.32 -0.14 0.81 3.08 -1.74 -1.48 114.38 115.96 1r5s h ARG 69 Ca 0.42 -0.03 -0.02 0.00 0.07 0.00 0.00 59.98 60.42 1r5s h ARG 69 Cb 0.47 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.45 1r5s h ARG 69 CO -0.29 0.27 -0.01 0.52 -1.07 0.00 0.00 179.97 179.39 1r5s h MET 70 N 0.28 0.20 -0.13 0.04 2.86 0.18 -0.80 114.93 117.55 1r5s h MET 70 Ca 0.08 -0.03 -0.00 0.00 -2.06 0.00 0.00 59.70 57.69 1r5s h MET 70 Cb 0.04 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.65 1r5s h MET 70 CO -0.01 0.23 0.07 0.78 1.06 0.00 0.00 176.91 179.03 1r5s h GLY 71 N 0.44 0.19 0.70 8.32 0.00 0.12 -0.58 103.07 112.25 1r5s h GLY 71 Ca 0.05 -0.09 -0.03 0.00 0.00 0.00 0.00 47.33 47.26 1r5s h GLY 71 CO 0.00 0.08 -0.33 1.46 0.00 0.00 0.00 176.54 177.75 1r5s h GLN 72 N 0.11 -0.90 -1.00 4.80 4.20 -0.64 -1.01 115.11 120.67 1r5s h GLN 72 Ca 0.04 0.06 0.40 0.00 0.06 0.00 0.00 58.65 59.22 1r5s h GLN 72 Cb 0.07 0.20 -0.18 0.00 0.30 0.00 0.00 27.48 27.88 1r5s h GLN 72 CO -0.01 -0.60 0.51 0.00 -0.67 0.00 0.00 178.83 178.06 1r5s h ALA 73 N -1.57 2.09 -0.06 3.87 0.00 -1.14 0.97 119.26 123.43 1r5s h ALA 73 Ca -0.10 0.27 -0.21 0.00 0.00 0.00 0.00 54.91 54.88 1r5s h ALA 73 Cb 0.72 0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1r5s h ALA 73 CO 0.16 -0.91 -0.82 0.78 0.00 0.00 0.00 179.25 178.46 1r5s h GLY 74 N 0.02 0.51 1.47 0.00 0.00 -0.84 -3.20 103.07 101.03 1r5s h GLY 74 Ca 0.83 -0.79 -0.11 0.00 0.00 0.00 0.00 47.33 47.26 1r5s h GLY 74 CO -0.77 0.70 -0.28 0.23 0.00 0.00 0.00 176.54 176.42 1r5s h SER 75 N 0.30 0.62 -6.55 0.19 0.87 0.22 -3.47 113.55 105.73 1r5s h SER 75 Ca -0.05 -0.23 -0.52 0.00 -1.23 0.00 0.00 61.79 59.76 1r5s h SER 75 Cb 1.43 -0.17 -0.13 0.00 -0.44 0.00 0.00 62.40 63.09 1r5s h SER 75 CO 0.15 0.87 -0.81 0.35 -0.53 0.00 0.00 176.83 176.85 1r5s n THR 76 N -4.10 -1.69 -1.54 2.23 -2.24 0.12 -4.75 114.28 102.30 1r5s n THR 76 Ca -0.00 -0.08 -0.29 0.00 -2.27 0.00 0.00 64.05 61.40 1r5s n THR 76 Cb 0.44 -2.24 -0.07 0.00 -2.10 0.00 0.00 70.33 66.36 1r5s n THR 76 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 1r5s n ILE 77 N -4.49 -0.05 0.00 2.28 2.08 -1.26 -3.84 119.36 114.09 1r5s n ILE 77 Ca 0.01 -0.59 0.00 0.00 0.56 0.00 0.00 62.75 62.73 1r5s n ILE 77 Cb 0.53 -2.06 0.00 0.00 -0.75 0.00 0.00 39.64 37.36 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 15.21 0.00 -2.88 4.38 7.64 -1.26 -4.99 113.62 131.71 1r5s n SER 78 Ca 0.46 0.00 -0.27 0.00 1.01 0.00 0.00 58.87 60.07 1r5s n SER 78 Cb 0.41 0.00 -0.07 0.00 -1.01 0.00 0.00 64.21 63.55 1r5s n SER 78 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 1r5s n ASN 79 N -0.78 6.84 0.00 6.43 0.23 -1.25 -3.46 115.26 123.27 1r5s n ASN 79 Ca 0.00 -2.47 0.00 0.00 -0.53 0.00 0.00 54.58 51.58 1r5s n ASN 79 Cb 0.00 -1.39 0.00 0.00 -2.08 0.00 0.00 39.78 36.31 1r5s n ASN 79 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 1r5s n SER 80 N 3.35 0.00 0.00 0.53 3.41 -1.26 -5.15 113.62 114.51 1r5s n SER 80 Ca 0.60 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 59.21 1r5s n SER 80 Cb 0.40 0.04 0.00 0.00 -0.26 0.00 0.00 64.21 64.39 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 -1.81 0.00 -1.90 7.33 1.44 -1.22 -5.04 115.22 114.01 1r5s n HIS 81 Ca 0.00 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.71 1r5s n HIS 81 Cb 0.00 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.11 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 -3.00 0.00 -0.12 1.59 0.00 -1.26 -5.01 120.51 112.71 1r5s n ALA 82 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.19 1r5s n ALA 82 Cb 0.00 -0.41 -0.10 0.00 0.00 0.00 0.00 19.45 18.94 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 -0.59 0.57 -0.35 0.00 6.02 -1.26 -4.36 117.38 117.41 1r5s n GLN 83 Ca 0.00 0.43 0.05 0.00 -0.01 0.00 0.00 57.00 57.47 1r5s n GLN 83 Cb 0.41 -1.62 0.20 0.00 1.02 0.00 0.00 30.24 30.24 1r5s n GLN 83 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 177.06 175.70 1r5s n PRO 84 N -4.36 2.54 0.00 -1.09 -0.04 -1.26 -4.86 135.00 125.94 1r5s n PRO 84 Ca -0.41 -1.56 0.00 0.00 -0.04 0.00 0.00 63.50 61.49 1r5s n PRO 84 Cb 0.76 -1.63 0.00 0.00 -0.04 0.00 0.00 33.50 32.59 1r5s n PRO 84 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1r5s n PHE 85 N 0.48 0.00 -3.01 0.54 3.72 -1.26 -4.07 117.46 113.86 1r5s n PHE 85 Ca 0.14 0.00 -0.22 0.00 -0.05 0.00 0.00 57.45 57.32 1r5s n PHE 85 Cb 0.56 0.00 0.03 0.00 -0.94 0.00 0.00 39.48 39.13 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 0.00 -6.02 -3.35 4.37 -0.08 -1.26 -4.94 116.55 105.27 1r5s n ASP 86 Ca 0.00 -0.28 -0.26 0.00 -1.51 0.00 0.00 54.79 52.74 1r5s n ASP 86 Cb 0.00 -4.87 -0.08 0.00 2.34 0.00 0.00 41.12 38.51 1r5s n ASP 86 CO 0.00 0.00 0.00 0.49 0.12 0.00 0.00 177.20 177.81 1r5s n PHE 87 N -4.47 1.60 0.21 -0.67 3.72 -1.26 -4.97 117.46 111.62 1r5s n PHE 87 Ca -0.12 -3.86 -0.08 0.00 -0.05 0.00 0.00 57.45 53.35 1r5s n PHE 87 Cb 0.62 -0.42 -0.04 0.00 -0.94 0.00 0.00 39.48 38.70 1r5s n PHE 87 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 176.76 175.36 1r5s h PRO 88 N 4.28 -0.52 -0.44 -1.08 0.11 -1.92 -3.32 132.00 129.12 1r5s h PRO 88 Ca 0.15 0.04 -0.22 0.00 0.11 0.00 0.00 66.00 66.08 1r5s h PRO 88 Cb 0.78 0.12 -0.13 0.00 0.11 0.00 0.00 31.00 31.88 1r5s h PRO 88 CO 0.64 -0.34 0.03 -0.25 -0.21 0.00 0.00 178.00 177.86 1r5s n ASP 89 N -3.57 2.77 -4.27 -2.05 8.00 -1.26 -4.93 116.55 111.23 1r5s n ASP 89 Ca -0.07 -3.70 -0.37 0.00 0.71 0.00 0.00 54.79 51.36 1r5s n ASP 89 Cb 0.21 -0.66 -0.13 0.00 -0.02 0.00 0.00 41.12 40.53 1r5s n ASP 89 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 1r5s s ASP 90 N -2.31 5.26 0.00 -2.24 1.01 -1.25 -4.89 116.67 112.25 1r5s s ASP 90 Ca 0.46 -1.11 0.00 0.00 0.71 0.00 0.00 52.55 52.62 1r5s s ASP 90 Cb 0.41 -1.86 0.00 0.00 1.01 0.00 0.00 42.92 42.49 1r5s s ASP 90 CO 0.02 -0.31 0.00 -0.46 0.21 0.00 0.00 175.17 174.63 1r5s n ASN 91 N 4.80 2.72 0.23 0.27 0.23 -1.26 -4.46 115.26 117.78 1r5s n ASN 91 Ca -0.13 0.00 -0.13 0.00 -0.53 0.00 0.00 54.58 53.79 1r5s n ASN 91 Cb 0.45 0.00 -0.07 0.00 -2.08 0.00 0.00 39.78 38.08 1r5s n ASN 91 CO 0.00 0.00 0.00 1.56 -0.93 0.00 0.00 177.26 177.89 1r5s h GLN 92 N 0.00 -0.58 0.00 -3.83 4.20 -1.98 0.28 115.11 113.19 1r5s h GLN 92 Ca 0.00 0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.75 1r5s h GLN 92 Cb 0.91 0.13 0.00 0.00 0.30 0.00 0.00 27.48 28.82 1r5s h GLN 92 CO 0.00 -0.27 0.00 -2.95 -0.67 0.00 0.00 178.83 174.94 1r5s h ASN 93 N -0.96 0.00 0.73 1.46 7.08 -1.97 -1.53 115.58 120.39 1r5s h ASN 93 Ca -0.06 0.00 -0.02 0.00 -3.08 0.00 0.00 56.30 53.14 1r5s h ASN 93 Cb 0.57 0.00 -0.00 0.00 -2.08 0.00 0.00 38.32 36.81 1r5s h ASN 93 CO 0.10 0.00 -1.29 0.00 -2.08 0.00 0.00 177.43 174.17 1r5s n ALA 94 N -1.99 2.53 -0.02 4.14 0.00 -1.15 -3.83 120.51 120.20 1r5s n ALA 94 Ca 0.00 -0.34 -0.22 0.00 0.00 0.00 0.00 53.44 52.89 1r5s n ALA 94 Cb 0.22 -1.00 -0.13 0.00 0.00 0.00 0.00 19.45 18.54 1r5s n ALA 94 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 1r5s n LYS 95 N -2.60 0.71 0.00 0.00 2.85 0.96 -2.54 118.16 117.54 1r5s n LYS 95 Ca -0.02 0.35 0.12 0.00 -1.05 0.00 0.00 58.31 57.70 1r5s n LYS 95 Cb 0.58 -1.72 0.68 0.00 -0.65 0.00 0.00 35.03 33.93 1r5s n LYS 95 CO 0.00 0.00 0.00 0.36 -0.05 0.00 0.00 177.40 177.71 1r5s n LYS 96 N -3.75 0.69 -0.01 -1.58 2.85 -0.63 -3.00 118.16 112.74 1r5s n LYS 96 Ca -0.32 0.01 0.00 0.00 -1.05 0.00 0.00 58.31 56.95 1r5s n LYS 96 Cb 0.95 -1.50 -0.03 0.00 -0.65 0.00 0.00 35.03 33.80 1r5s n LYS 96 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 177.40 177.63 1r5s n VAL 97 N -1.03 0.13 1.53 0.58 0.31 -1.25 -4.58 118.33 114.03 1r5s n VAL 97 Ca 0.17 -0.12 0.09 0.00 -0.01 0.00 0.00 64.34 64.46 1r5s n VAL 97 Cb 0.09 -0.26 0.40 0.00 -0.91 0.00 0.00 33.84 33.16 1r5s n VAL 97 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1r5s n ALA 98 N -1.89 2.55 -1.26 3.52 0.00 -1.05 -3.39 120.51 118.98 1r5s n ALA 98 Ca -0.03 -0.35 -0.23 0.00 0.00 0.00 0.00 53.44 52.83 1r5s n ALA 98 Cb 0.37 -1.15 -0.03 0.00 0.00 0.00 0.00 19.45 18.64 1r5s n ALA 98 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1r5s n ALA 99 N -0.12 5.99 0.00 0.00 0.00 -1.21 -4.28 120.51 120.88 1r5s n ALA 99 Ca 0.14 -2.51 0.00 0.00 0.00 0.00 0.00 53.44 51.07 1r5s n ALA 99 Cb 0.21 -1.88 0.00 0.00 0.00 0.00 0.00 19.45 17.78 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 0.76 0.72 0.00 0.00 0.00 -1.26 -4.97 105.19 100.44 1r5s n GLY 100 Ca 0.42 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.59 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 0.08 1.61 -0.00 -1.22 -3.17 115.22 112.52 1r5s n HIS 101 Ca 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 57.72 57.68 1r5s n HIS 101 Cb 0.00 -0.11 -0.07 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 0.00 0.00 0.00 1.57 5.08 -1.84 -3.48 114.58 115.92 1r5s h GLU 102 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1r5s h GLU 102 Cb 0.10 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.35 1r5s h GLU 102 CO 0.00 0.76 0.00 -0.11 -1.00 0.00 0.00 179.01 178.66 1r5s n LEU 103 N -3.26 0.00 -3.36 1.33 -0.00 -1.19 -4.54 117.00 105.98 1r5s n LEU 103 Ca -0.01 0.00 -0.13 0.00 -0.00 0.00 0.00 56.01 55.86 1r5s n LEU 103 Cb 0.88 0.00 -0.08 0.00 -0.00 0.00 0.00 43.42 44.22 1r5s n LEU 103 CO 0.45 0.00 -0.13 -1.58 -0.00 0.00 0.00 177.39 176.13 1r5s s GLN 104 N 0.00 0.36 0.27 1.96 2.00 -1.26 -5.04 119.66 117.95 1r5s s GLN 104 Ca 0.00 0.01 -0.06 0.00 -2.00 0.00 0.00 55.36 53.32 1r5s s GLN 104 Cb 0.00 -0.52 0.50 0.00 0.80 0.00 0.00 33.01 33.79 1r5s s GLN 104 CO 0.00 -1.00 1.59 -1.35 -0.50 0.00 0.00 175.29 174.03 1r5s h PRO 105 N 8.22 0.03 0.00 1.67 0.11 -1.99 -3.42 132.00 136.62 1r5s h PRO 105 Ca -0.12 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.99 1r5s h PRO 105 Cb 1.10 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1r5s h PRO 105 CO 0.30 0.02 0.00 1.47 -0.21 0.00 0.00 178.00 179.58 1r5s n LEU 106 N -5.48 0.00 0.00 2.35 -0.00 -1.26 -5.02 117.00 107.59 1r5s n LEU 106 Ca 0.16 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.17 1r5s n LEU 106 Cb 0.54 0.08 0.00 0.00 -0.00 0.00 0.00 43.42 44.04 1r5s n LEU 106 CO -0.03 -0.08 0.00 0.00 -0.00 0.00 0.00 177.39 177.27 1r5s n ALA 107 N -1.62 0.00 -1.32 1.47 0.00 -1.26 -3.50 120.51 114.28 1r5s n ALA 107 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.34 1r5s n ALA 107 Cb 0.00 -0.05 -0.04 0.00 0.00 0.00 0.00 19.45 19.36 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 -2.00 -0.02 -2.69 0.00 2.08 -1.26 -4.87 119.36 110.60 1r5s n ILE 108 Ca 0.00 0.00 -0.08 0.00 0.56 0.00 0.00 62.75 63.23 1r5s n ILE 108 Cb 0.00 -1.21 0.10 0.00 -0.75 0.00 0.00 39.64 37.78 1r5s n ILE 108 CO 0.00 0.00 0.00 0.52 0.56 0.00 0.00 176.55 177.63 1r5s n VAL 109 N -2.78 0.26 0.08 1.39 0.31 -1.23 -4.94 118.33 111.41 1r5s n VAL 109 Ca -0.10 -1.91 -0.15 0.00 -0.01 0.00 0.00 64.34 62.18 1r5s n VAL 109 Cb 0.33 0.91 -0.14 0.00 -0.91 0.00 0.00 33.84 34.04 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 2.27 0.35 -0.40 4.52 3.04 -1.90 -3.32 116.42 120.98 1r5s h ASP 110 Ca -0.23 -0.42 0.04 0.00 -3.24 0.00 0.00 57.03 53.18 1r5s h ASP 110 Cb 1.27 -0.12 -0.04 0.00 -1.04 0.00 0.00 39.33 39.40 1r5s h ASP 110 CO 0.08 1.34 0.18 1.56 -2.04 0.00 0.00 179.24 180.36 1r5s h GLN 111 N 0.06 0.36 0.00 4.15 4.20 -1.93 -3.47 115.11 118.48 1r5s h GLN 111 Ca -0.16 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.53 1r5s h GLN 111 Cb 1.97 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 29.67 1r5s h GLN 111 CO 0.18 0.24 0.00 0.54 -0.67 0.00 0.00 178.83 179.12 1r5s n ARG 112 N -4.95 0.00 0.11 1.46 5.12 -1.25 -4.92 116.66 112.22 1r5s n ARG 112 Ca 0.02 0.00 -0.09 0.00 -1.93 0.00 0.00 57.85 55.85 1r5s n ARG 112 Cb 0.12 0.00 -0.05 0.00 -1.16 0.00 0.00 32.46 31.37 1r5s n ARG 112 CO 0.00 0.00 0.00 -1.35 -1.93 0.00 0.00 177.63 174.35 1r5s h PRO 113 N 0.00 -0.43 0.00 5.56 0.11 -1.91 -3.45 132.00 131.87 1r5s h PRO 113 Ca 0.00 0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.14 1r5s h PRO 113 Cb 0.00 0.10 0.00 0.00 0.11 0.00 0.00 31.00 31.21 1r5s h PRO 113 CO 0.00 -0.29 0.00 0.45 -0.21 0.00 0.00 178.00 177.95 1r5s n SER 114 N -3.93 -5.12 0.00 -2.05 2.88 -1.26 -4.34 113.62 99.80 1r5s n SER 114 Ca -0.05 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.49 1r5s n SER 114 Cb 0.22 -2.98 0.00 0.00 -0.75 0.00 0.00 64.21 60.70 1r5s n SER 114 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1r5s n SER 115 N -0.78 0.00 -1.84 -3.46 2.88 -1.26 -5.14 113.62 104.01 1r5s n SER 115 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1r5s n SER 115 Cb 0.39 0.22 0.00 0.00 -0.75 0.00 0.00 64.21 64.08 1r5s n SER 115 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1r5s n ARG 116 N -2.09 0.91 -0.95 -1.46 3.00 -1.26 -4.40 116.66 110.41 1r5s n ARG 116 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.84 1r5s n ARG 116 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.46 1r5s n ARG 116 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1r5s n ALA 117 N -3.00 0.00 -2.05 7.54 0.00 -1.26 -4.62 120.51 117.12 1r5s n ALA 117 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.44 1r5s n ALA 117 Cb 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 19.45 19.18 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 -0.12 -0.13 -0.21 0.00 2.88 -1.26 -4.97 113.62 109.81 1r5s n SER 118 Ca 0.00 -0.69 0.08 0.00 -1.33 0.00 0.00 58.87 56.94 1r5s n SER 118 Cb 0.06 0.05 0.41 0.00 -0.75 0.00 0.00 64.21 63.98 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 -0.09 0.62 -0.04 -3.46 2.88 -1.26 -3.40 113.62 108.87 1r5s n SER 119 Ca -0.02 -1.61 -0.01 0.00 -1.33 0.00 0.00 58.87 55.90 1r5s n SER 119 Cb 0.42 -0.05 -0.11 0.00 -0.75 0.00 0.00 64.21 63.73 1r5s n SER 119 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1r5s n ARG 120 N -0.34 1.30 -0.06 -1.46 1.74 -1.26 -4.67 116.66 111.90 1r5s n ARG 120 Ca 0.13 -0.05 -0.14 0.00 -0.77 0.00 0.00 57.85 57.02 1r5s n ARG 120 Cb 0.15 -1.33 -0.09 0.00 -1.02 0.00 0.00 32.46 30.16 1r5s n ARG 120 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1r5s h ALA 121 N 0.90 -0.81 -3.15 7.54 0.00 -1.87 -3.46 119.26 118.40 1r5s h ALA 121 Ca -0.21 -0.03 -0.35 0.00 0.00 0.00 0.00 54.91 54.32 1r5s h ALA 121 Cb 1.34 1.04 0.02 0.00 0.00 0.00 0.00 17.79 20.19 1r5s h ALA 121 CO 0.01 -1.03 -0.48 0.45 0.00 0.00 0.00 179.25 178.20 1r5s n SER 122 N -5.21 -5.28 -2.09 0.00 2.88 -1.26 -2.13 113.62 100.54 1r5s n SER 122 Ca -0.05 -0.13 -0.11 0.00 -1.33 0.00 0.00 58.87 57.26 1r5s n SER 122 Cb 0.34 -4.24 -0.02 0.00 -0.75 0.00 0.00 64.21 59.54 1r5s n SER 122 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1r5s n SER 123 N -1.59 -3.41 -3.66 -3.46 3.41 -1.26 -4.90 113.62 98.75 1r5s n SER 123 Ca -0.15 0.24 -0.06 0.00 -0.26 0.00 0.00 58.87 58.63 1r5s n SER 123 Cb 0.63 -3.02 -0.07 0.00 -0.26 0.00 0.00 64.21 61.49 1r5s n SER 123 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1r5s s ARG 124 N -4.36 0.54 0.00 4.33 0.52 -0.90 -4.99 118.95 114.09 1r5s s ARG 124 Ca 0.00 1.17 0.00 0.00 -0.52 0.00 0.00 55.73 56.38 1r5s s ARG 124 Cb 0.00 0.34 0.00 0.00 0.52 0.00 0.00 34.95 35.81 1r5s s ARG 124 CO 0.00 -0.18 0.42 -0.35 0.02 0.00 0.00 175.30 175.20 1r5s n PRO 125 N 4.80 0.00 0.00 3.54 -0.04 -1.26 -4.81 135.00 137.23 1r5s n PRO 125 Ca -0.17 0.08 0.00 0.00 -0.04 0.00 0.00 63.50 63.38 1r5s n PRO 125 Cb 0.54 -0.92 0.00 0.00 -0.04 0.00 0.00 33.50 33.08 1r5s n PRO 125 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1r5s n ARG 126 N -0.50 0.00 -1.64 0.54 1.74 -1.26 -4.97 116.66 110.56 1r5s n ARG 126 Ca 0.00 0.00 -0.42 0.00 -0.77 0.00 0.00 57.85 56.66 1r5s n ARG 126 Cb 0.00 -0.00 -0.01 0.00 -1.02 0.00 0.00 32.46 31.43 1r5s n ARG 126 CO 0.00 0.00 0.00 -2.30 -1.52 0.00 0.00 177.63 173.81 1r5s n PRO 127 N -2.41 2.61 -2.62 5.56 -0.02 -1.26 -4.44 135.00 132.42 1r5s n PRO 127 Ca 0.00 -2.48 -0.11 0.00 -2.02 0.00 0.00 63.50 58.89 1r5s n PRO 127 Cb 0.00 -3.23 -0.01 0.00 -0.02 0.00 0.00 33.50 30.25 1r5s n PRO 127 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1r5s n ASP 128 N 6.42 -3.10 -2.19 2.55 9.92 -1.26 0.11 116.55 129.00 1r5s n ASP 128 Ca 0.51 0.17 -0.21 0.00 -0.53 0.00 0.00 54.79 54.74 1r5s n ASP 128 Cb 0.39 -2.66 -0.03 0.00 -0.64 0.00 0.00 41.12 38.18 1r5s n ASP 128 CO 0.00 0.00 0.00 -0.67 0.13 0.00 0.00 177.20 176.66 1r5s n ASP 129 N -1.80 -5.80 0.00 -2.24 2.03 -1.26 -3.98 116.55 103.49 1r5s n ASP 129 Ca -0.09 0.12 0.00 0.00 0.52 0.00 0.00 54.79 55.35 1r5s n ASP 129 Cb 0.57 -4.91 0.00 0.00 -0.72 0.00 0.00 41.12 36.06 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 -2.85 0.00 -0.41 -2.67 4.77 0.29 -4.62 117.00 111.51 1r5s n LEU 130 Ca -0.24 0.00 -0.02 0.00 -0.03 0.00 0.00 56.01 55.73 1r5s n LEU 130 Cb 0.69 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.77 1r5s n LEU 130 CO 0.30 0.00 -0.02 -1.84 -1.33 0.00 0.00 177.39 174.50 1r5s n GLU 131 N 0.00 -1.67 -0.70 3.23 0.28 -1.26 -5.11 120.64 115.42 1r5s n GLU 131 Ca 0.00 0.17 0.00 0.00 -0.16 0.00 0.00 57.16 57.17 1r5s n GLU 131 Cb 0.00 -3.52 0.00 0.00 1.43 0.00 0.00 31.44 29.35 1r5s n GLU 131 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 177.13 176.08