#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 -0.57 -2.54 1.61 -0.04 -1.26 -4.38 135.00 127.82 1r5s n PRO 2 Ca 0.00 0.00 -0.20 0.00 -0.04 0.00 0.00 63.50 63.26 1r5s n PRO 2 Cb 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 1r5s n PRO 2 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1r5s n LEU 3 N 0.00 -2.11 0.00 1.53 4.77 -1.26 -4.67 117.00 115.27 1r5s n LEU 3 Ca 0.00 -0.09 0.00 0.00 -0.03 0.00 0.00 56.01 55.89 1r5s n LEU 3 Cb 0.00 -2.84 0.00 0.00 -2.33 0.00 0.00 43.42 38.25 1r5s n LEU 3 CO 0.00 -0.09 0.00 0.61 -1.33 0.00 0.00 177.39 176.58 1r5s n GLY 4 N -1.15 -0.12 2.35 -0.72 0.00 -1.26 -5.01 105.19 99.28 1r5s n GLY 4 Ca -0.20 -0.06 -0.15 0.00 0.00 0.00 0.00 46.02 45.61 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 -1.92 1.07 -0.03 1.61 3.41 -1.26 -4.91 113.62 111.59 1r5s n SER 5 Ca 0.00 -2.92 0.08 0.00 -0.26 0.00 0.00 58.87 55.77 1r5s n SER 5 Cb 0.00 -0.59 0.47 0.00 -0.26 0.00 0.00 64.21 63.83 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 0.16 1.03 -0.42 4.33 -0.04 -1.26 -3.23 135.00 135.58 1r5s n PRO 6 Ca 0.20 -0.05 0.10 0.00 -0.04 0.00 0.00 63.50 63.71 1r5s n PRO 6 Cb 0.71 -1.25 0.30 0.00 -0.04 0.00 0.00 33.50 33.22 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 -0.70 4.06 0.00 3.54 7.64 -1.26 -4.99 113.62 121.91 1r5s n SER 7 Ca 0.12 -2.18 0.00 0.00 1.01 0.00 0.00 58.87 57.82 1r5s n SER 7 Cb 0.07 -0.48 0.00 0.00 -1.01 0.00 0.00 64.21 62.79 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 1.21 0.00 -3.73 1.43 4.01 -1.20 -4.47 118.16 115.41 1r5s n LYS 8 Ca 0.23 0.00 -0.12 0.00 -0.51 0.00 0.00 58.31 57.91 1r5s n LYS 8 Cb 0.69 0.00 -0.12 0.00 -0.51 0.00 0.00 35.03 35.09 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 -2.34 -0.31 -0.05 4.39 -4.77 -1.26 -5.07 116.67 107.25 1r5s s ASP 9 Ca 0.00 0.59 -0.15 0.00 -3.30 0.00 0.00 52.55 49.69 1r5s s ASP 9 Cb 0.00 0.50 -0.09 0.00 -1.09 0.00 0.00 42.92 42.23 1r5s s ASP 9 CO 0.00 -0.16 0.61 0.00 0.70 0.00 0.00 175.17 176.32 1r5s n GLY 11 N 0.65 -1.83 2.94 0.00 0.00 -1.26 -5.10 105.19 100.59 1r5s n GLY 11 Ca -0.06 0.82 -0.30 0.00 0.00 0.00 0.00 46.02 46.49 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 5.06 0.07 1.61 0.01 -1.26 -4.98 113.70 114.21 1r5s s SER 12 Ca 0.00 -3.82 -0.21 0.00 1.31 0.00 0.00 55.95 53.23 1r5s s SER 12 Cb 0.00 -1.69 -0.08 0.00 0.21 0.00 0.00 66.02 64.45 1r5s s SER 12 CO 0.00 -0.11 1.34 -0.65 0.41 0.00 0.00 173.24 174.24 1r5s h PRO 13 N 5.54 -0.37 -1.43 12.44 0.11 -1.98 -3.42 132.00 142.89 1r5s h PRO 13 Ca 0.14 0.03 -0.12 0.00 0.11 0.00 0.00 66.00 66.16 1r5s h PRO 13 Cb 0.77 0.08 -0.25 0.00 0.11 0.00 0.00 31.00 31.71 1r5s h PRO 13 CO 0.75 -0.25 -0.49 0.15 -0.21 0.00 0.00 178.00 177.95 1r5s s LYS 14 N -4.68 0.53 0.05 1.05 -0.14 -1.26 -5.00 119.74 110.28 1r5s s LYS 14 Ca -0.10 0.12 0.00 0.00 -1.36 0.00 0.00 55.97 54.63 1r5s s LYS 14 Cb 0.04 -0.12 0.00 0.00 -1.68 0.00 0.00 37.83 36.07 1r5s s LYS 14 CO 0.38 -1.07 0.00 0.98 -0.76 0.00 0.00 175.35 174.87 1r5s n TYR 15 N 5.16 -1.99 -1.84 3.18 4.19 -1.26 -5.09 117.16 119.51 1r5s n TYR 15 Ca 0.04 0.17 -0.39 0.00 3.31 0.00 0.00 57.90 61.03 1r5s n TYR 15 Cb 0.51 0.72 -0.03 0.00 0.49 0.00 0.00 39.34 41.04 1r5s n TYR 15 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 1r5s s ALA 16 N -1.65 2.24 0.00 2.98 0.00 -1.26 -4.56 121.76 119.51 1r5s s ALA 16 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 51.96 51.89 1r5s s ALA 16 Cb 0.00 -4.22 0.00 0.00 0.00 0.00 0.00 23.12 18.90 1r5s s ALA 16 CO 0.00 -3.64 0.26 0.66 0.00 0.00 0.00 175.76 173.04 1r5s n TYR 17 N 12.99 0.00 0.04 0.00 4.01 -1.26 -4.91 117.16 128.03 1r5s n TYR 17 Ca 0.27 0.00 0.22 0.00 -0.16 0.00 0.00 57.90 58.23 1r5s n TYR 17 Cb 0.51 0.14 0.70 0.00 -0.31 0.00 0.00 39.34 40.38 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 0.00 -0.72 -0.00 -1.86 -3.45 116.94 110.92 1r5s h PHE 18 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.97 1r5s h PHE 18 Cb 1.03 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 36.98 1r5s h PHE 18 CO -0.07 0.00 0.00 0.09 -0.00 0.00 0.00 178.31 178.33 1r5s n ASN 19 N -3.63 0.00 0.00 -0.68 3.02 -1.26 -2.36 115.26 110.35 1r5s n ASN 19 Ca 0.10 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.65 1r5s n ASN 19 Cb 0.77 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.94 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 0.00 -0.04 2.58 7.41 0.00 -1.26 -5.00 105.19 108.88 1r5s n GLY 20 Ca 0.00 -0.02 -0.10 0.00 0.00 0.00 0.00 46.02 45.90 1r5s n GLY 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r5s n SER 22 N -0.01 0.00 -4.40 0.00 7.64 -1.00 -4.86 113.62 110.99 1r5s n SER 22 Ca 0.09 0.00 -0.49 0.00 1.01 0.00 0.00 58.87 59.48 1r5s n SER 22 Cb 0.76 0.00 -0.12 0.00 -1.01 0.00 0.00 64.21 63.84 1r5s n SER 22 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1r5s n SER 23 N 1.62 0.86 -3.26 6.43 7.64 -1.26 -4.73 113.62 120.91 1r5s n SER 23 Ca 0.00 0.34 -0.23 0.00 1.01 0.00 0.00 58.87 59.99 1r5s n SER 23 Cb 0.00 -1.01 -0.03 0.00 -1.01 0.00 0.00 64.21 62.16 1r5s n SER 23 CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 1r5s n PRO 24 N 8.13 1.15 -0.04 1.43 -0.02 -1.26 -4.31 135.00 140.08 1r5s n PRO 24 Ca 0.56 -1.22 -0.12 0.00 -2.02 0.00 0.00 63.50 60.70 1r5s n PRO 24 Cb 0.07 -2.43 -0.14 0.00 -0.02 0.00 0.00 33.50 30.97 1r5s n PRO 24 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 1r5s n THR 25 N 5.14 1.60 -3.47 3.45 -1.04 -1.26 -5.02 114.28 113.68 1r5s n THR 25 Ca 0.34 -0.76 -0.21 0.00 -2.04 0.00 0.00 64.05 61.37 1r5s n THR 25 Cb 0.19 -1.11 0.06 0.00 -1.82 0.00 0.00 70.33 67.64 1r5s n THR 25 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1r5s n ALA 26 N -2.74 -2.40 -1.09 2.41 0.00 -1.26 -4.98 120.51 110.46 1r5s n ALA 26 Ca -0.25 -0.04 -0.29 0.00 0.00 0.00 0.00 53.44 52.86 1r5s n ALA 26 Cb 1.07 -4.44 0.20 0.00 0.00 0.00 0.00 19.45 16.27 1r5s n ALA 26 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1r5s s PRO 27 N -5.21 0.01 0.05 0.00 0.04 -1.26 -5.04 135.00 123.60 1r5s s PRO 27 Ca 0.36 0.46 -0.02 0.00 0.04 0.00 0.00 61.00 61.84 1r5s s PRO 27 Cb -0.08 -1.69 -0.01 0.00 0.04 0.00 0.00 34.50 32.76 1r5s s PRO 27 CO 0.79 -3.00 -0.04 1.28 0.04 0.00 0.00 177.00 176.06 1r5s n LEU 28 N -4.36 1.06 0.00 -3.56 7.99 -1.26 -5.10 117.00 111.78 1r5s n LEU 28 Ca 0.05 0.14 0.00 0.00 -0.01 0.00 0.00 56.01 56.20 1r5s n LEU 28 Cb 0.57 -0.35 0.00 0.00 -0.11 0.00 0.00 43.42 43.53 1r5s n LEU 28 CO 0.56 -0.67 0.00 -0.24 -1.51 0.00 0.00 177.39 175.53 1r5s n SER 29 N -3.48 0.00 0.00 -1.43 2.88 -1.26 -4.95 113.62 105.38 1r5s n SER 29 Ca -0.02 0.00 0.06 0.00 -1.33 0.00 0.00 58.87 57.59 1r5s n SER 29 Cb 0.06 0.00 0.36 0.00 -0.75 0.00 0.00 64.21 63.88 1r5s n SER 29 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1r5s n PRO 30 N 0.00 0.40 -3.89 -1.46 -0.04 -1.26 -4.53 135.00 124.22 1r5s n PRO 30 Ca 0.00 0.00 -0.35 0.00 -0.04 0.00 0.00 63.50 63.11 1r5s n PRO 30 Cb 0.00 -1.48 -0.14 0.00 -0.04 0.00 0.00 33.50 31.85 1r5s n PRO 30 CO 0.00 0.00 0.00 1.41 -0.04 0.00 0.00 175.50 176.87 1r5s s MET 31 N -2.00 3.14 -0.39 0.54 0.00 -1.26 -5.04 119.30 114.29 1r5s s MET 31 Ca 0.18 -0.79 0.04 0.00 0.00 0.00 0.00 55.69 55.12 1r5s s MET 31 Cb 0.08 -3.08 0.16 0.00 0.00 0.00 0.00 34.83 31.99 1r5s s MET 31 CO 0.14 -0.32 0.41 0.45 0.00 0.00 0.00 175.02 175.70 1r5s s SER 32 N 1.44 0.95 1.15 1.11 0.15 -1.26 -4.75 113.70 112.48 1r5s s SER 32 Ca 0.03 -1.84 -0.18 0.00 0.70 0.00 0.00 55.95 54.67 1r5s s SER 32 Cb -0.16 0.54 0.17 0.00 -1.71 0.00 0.00 66.02 64.86 1r5s s SER 32 CO -0.02 -0.22 0.27 -2.65 1.20 0.00 0.00 173.24 171.81 1r5s n PRO 33 N 3.89 -2.17 -1.49 5.44 -0.02 -1.26 -4.63 135.00 134.76 1r5s n PRO 33 Ca 0.15 -0.62 -0.14 0.00 -2.02 0.00 0.00 63.50 60.87 1r5s n PRO 33 Cb 0.46 -1.75 -0.11 0.00 -0.02 0.00 0.00 33.50 32.08 1r5s n PRO 33 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1r5s n PRO 34 N -2.81 0.27 -1.11 0.52 -0.04 -1.26 -4.67 135.00 125.91 1r5s n PRO 34 Ca 0.03 -0.73 -0.05 0.00 -0.04 0.00 0.00 63.50 62.70 1r5s n PRO 34 Cb 0.57 -2.83 0.14 0.00 -0.04 0.00 0.00 33.50 31.34 1r5s n PRO 34 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1r5s n GLY 35 N 6.13 5.59 3.15 0.55 0.00 -1.26 -4.91 105.19 114.44 1r5s n GLY 35 Ca 0.46 -1.79 -0.23 0.00 0.00 0.00 0.00 46.02 44.46 1r5s n GLY 35 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1r5s s TYR 36 N -3.37 1.40 0.00 1.61 2.02 -1.26 -4.93 117.35 112.82 1r5s s TYR 36 Ca 0.43 -0.30 0.00 0.00 -0.37 0.00 0.00 57.07 56.83 1r5s s TYR 36 Cb 0.39 -0.87 0.00 0.00 -0.40 0.00 0.00 41.96 41.08 1r5s s TYR 36 CO -0.03 0.01 0.00 0.36 -1.57 0.00 0.00 175.55 174.32 1r5s n LYS 37 N 2.36 0.00 -1.41 -0.62 0.00 -1.26 -5.16 118.16 112.07 1r5s n LYS 37 Ca -0.16 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.15 1r5s n LYS 37 Cb 0.54 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.57 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 -0.88 -1.63 -2.85 -5.58 7.94 -1.26 -4.89 117.00 107.85 1r5s n LEU 38 Ca 0.00 2.59 -0.13 0.00 -1.11 0.00 0.00 56.01 57.37 1r5s n LEU 38 Cb 0.00 -2.67 0.07 0.00 0.53 0.00 0.00 43.42 41.35 1r5s n LEU 38 CO 0.00 -0.47 0.07 0.52 -1.11 0.00 0.00 177.39 176.40 1r5s n VAL 39 N -2.13 -5.19 -2.75 1.96 0.31 -1.26 -4.96 118.33 104.31 1r5s n VAL 39 Ca 0.00 -0.53 -0.01 0.00 -0.01 0.00 0.00 64.34 63.79 1r5s n VAL 39 Cb 0.33 -4.70 0.09 0.00 -0.91 0.00 0.00 33.84 28.65 1r5s n VAL 39 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 1r5s n THR 40 N -3.27 0.62 0.00 2.52 -1.04 -1.26 -4.93 114.28 106.92 1r5s n THR 40 Ca -0.18 -1.94 0.00 0.00 -2.04 0.00 0.00 64.05 59.89 1r5s n THR 40 Cb 0.62 1.15 0.00 0.00 -1.82 0.00 0.00 70.33 70.28 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 -1.09 1.25 0.68 3.41 0.00 -1.26 -4.98 105.19 103.20 1r5s n GLY 41 Ca -0.06 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.03 1r5s n GLY 41 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1r5s n ASP 42 N 0.00 2.74 -0.57 1.61 9.92 -1.26 -4.94 116.55 124.05 1r5s n ASP 42 Ca 0.00 -1.83 -0.07 0.00 -0.53 0.00 0.00 54.79 52.35 1r5s n ASP 42 Cb 0.00 -0.17 -0.03 0.00 -0.64 0.00 0.00 41.12 40.27 1r5s n ASP 42 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 1r5s n ARG 43 N 0.73 -1.44 0.00 -1.24 1.74 -1.26 -2.37 116.66 112.82 1r5s n ARG 43 Ca 0.12 0.71 0.00 0.00 -0.77 0.00 0.00 57.85 57.91 1r5s n ARG 43 Cb 0.41 -4.94 0.00 0.00 -1.02 0.00 0.00 32.46 26.92 1r5s n ARG 43 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1r5s n ASN 44 N -0.80 0.00 -0.04 0.55 3.02 -1.26 -4.36 115.26 112.37 1r5s n ASN 44 Ca -0.07 0.00 -0.09 0.00 -0.03 0.00 0.00 54.58 54.38 1r5s n ASN 44 Cb 0.48 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.58 1r5s n ASN 44 CO 0.00 0.00 0.00 0.78 -2.62 0.00 0.00 177.26 175.42 1r5s h ASN 45 N 0.00 -1.13 0.00 6.41 2.35 -2.04 -3.46 115.58 117.70 1r5s h ASN 45 Ca 0.00 0.14 0.00 0.00 -0.55 0.00 0.00 56.30 55.89 1r5s h ASN 45 Cb 0.00 0.45 0.00 0.00 0.05 0.00 0.00 38.32 38.82 1r5s h ASN 45 CO 0.00 -0.29 0.00 -1.54 -1.65 0.00 0.00 177.43 173.95 1r5s n SER 46 N -4.39 0.00 -2.53 5.81 3.41 -1.18 -5.11 113.62 109.63 1r5s n SER 46 Ca -0.03 0.00 -0.03 0.00 -0.26 0.00 0.00 58.87 58.55 1r5s n SER 46 Cb 0.23 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.16 1r5s n SER 46 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1r5s n SER 47 N 0.00 -4.30 -3.28 4.04 3.41 -1.00 -4.62 113.62 107.87 1r5s n SER 47 Ca 0.00 1.44 -0.26 0.00 -0.26 0.00 0.00 58.87 59.79 1r5s n SER 47 Cb 0.00 -4.40 -0.03 0.00 -0.26 0.00 0.00 64.21 59.52 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 5.07 0.00 0.00 0.00 5.12 -1.26 -5.05 116.66 120.54 1r5s n ARG 49 Ca 0.42 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 56.34 1r5s n ARG 49 Cb 0.20 -0.14 0.00 0.00 -1.16 0.00 0.00 32.46 31.35 1r5s n ARG 49 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 1r5s n ASN 50 N -1.92 0.00 0.00 0.55 3.02 -1.16 -4.84 115.26 110.91 1r5s n ASN 50 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 1r5s n ASN 50 Cb 0.00 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.17 1r5s n ASN 50 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1r5s n TYR 51 N 0.00 0.00 0.00 3.10 4.02 -1.26 -3.48 117.16 119.54 1r5s n TYR 51 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.89 1r5s n TYR 51 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.32 1r5s n TYR 51 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 176.86 176.12 1r5s n ASN 52 N 1.57 0.00 -2.19 7.72 6.94 -1.26 -5.02 115.26 123.02 1r5s n ASN 52 Ca 0.00 0.00 -0.21 0.00 -0.02 0.00 0.00 54.58 54.35 1r5s n ASN 52 Cb 0.00 0.14 -0.03 0.00 -2.36 0.00 0.00 39.78 37.53 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 -1.68 -1.61 -2.95 -3.83 5.02 -1.23 -4.97 118.16 106.91 1r5s n LYS 53 Ca 0.00 1.05 -0.15 0.00 -2.02 0.00 0.00 58.31 57.20 1r5s n LYS 53 Cb 0.00 -5.64 -0.01 0.00 -0.02 0.00 0.00 35.03 29.35 1r5s n LYS 53 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1r5s n GLN 54 N -2.86 1.19 -2.95 1.97 1.13 -1.26 -4.84 117.38 109.77 1r5s n GLN 54 Ca -0.24 -1.81 -0.40 0.00 -1.94 0.00 0.00 57.00 52.61 1r5s n GLN 54 Cb 0.69 0.31 0.00 0.00 0.11 0.00 0.00 30.24 31.35 1r5s n GLN 54 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1r5s n ALA 55 N -2.32 5.29 0.00 -1.58 0.00 -1.26 -4.46 120.51 116.18 1r5s n ALA 55 Ca -0.10 -4.75 0.00 0.00 0.00 0.00 0.00 53.44 48.59 1r5s n ALA 55 Cb 0.32 -2.08 0.00 0.00 0.00 0.00 0.00 19.45 17.69 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 0.82 1.67 -3.64 0.00 2.88 -1.26 -5.08 113.62 109.01 1r5s n SER 56 Ca 0.32 0.00 -0.20 0.00 -1.33 0.00 0.00 58.87 57.66 1r5s n SER 56 Cb 0.32 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.79 1r5s n SER 56 CO 0.00 0.00 0.00 -1.84 -1.23 0.00 0.00 175.04 171.97 1r5s n GLU 57 N -1.90 -1.46 -1.09 -1.46 0.28 -1.26 -4.92 120.64 108.83 1r5s n GLU 57 Ca 0.00 0.89 0.05 0.00 -0.16 0.00 0.00 57.16 57.94 1r5s n GLU 57 Cb 0.21 -3.08 0.09 0.00 1.43 0.00 0.00 31.44 30.09 1r5s n GLU 57 CO 0.00 0.00 0.00 1.04 -0.16 0.00 0.00 177.13 178.01 1r5s n GLN 58 N -2.54 0.62 -0.19 3.44 1.13 -1.26 -4.71 117.38 113.88 1r5s n GLN 58 Ca -0.24 -2.45 0.09 0.00 -1.94 0.00 0.00 57.00 52.46 1r5s n GLN 58 Cb 0.65 -0.65 0.14 0.00 0.11 0.00 0.00 30.24 30.49 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 -0.17 2.12 0.01 1.08 3.02 -1.26 -4.72 115.26 115.35 1r5s n ASN 59 Ca 0.11 -3.15 0.00 0.00 -0.03 0.00 0.00 54.58 51.51 1r5s n ASN 59 Cb 0.95 -0.43 0.00 0.00 -0.61 0.00 0.00 39.78 39.69 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 -1.30 -0.15 0.00 3.10 4.27 -1.26 -5.05 117.44 117.05 1r5s n TRP 60 Ca 0.16 0.03 0.00 0.00 -3.89 0.00 0.00 57.50 53.79 1r5s n TRP 60 Cb 0.66 0.22 0.00 0.00 -1.36 0.00 0.00 31.31 30.83 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 -2.87 0.00 -1.00 -1.67 0.00 -1.26 -5.16 120.51 108.54 1r5s n ALA 61 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1r5s n ALA 61 Cb 0.24 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.69 1r5s n ALA 61 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1r5s n ASN 62 N 0.00 0.00 -0.17 0.00 0.23 -1.26 -4.96 115.26 109.10 1r5s n ASN 62 Ca 0.00 0.00 0.03 0.00 -0.53 0.00 0.00 54.58 54.08 1r5s n ASN 62 Cb 0.00 0.00 0.05 0.00 -2.08 0.00 0.00 39.78 37.75 1r5s n ASN 62 CO 0.00 0.00 0.00 -1.22 -0.93 0.00 0.00 177.26 175.11 1r5s n TYR 63 N -0.19 0.00 -3.41 -2.53 4.02 -1.26 -4.98 117.16 108.81 1r5s n TYR 63 Ca 0.00 -0.43 -0.25 0.00 -0.01 0.00 0.00 57.90 57.21 1r5s n TYR 63 Cb 0.00 -0.07 0.02 0.00 -0.02 0.00 0.00 39.34 39.26 1r5s n TYR 63 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 1r5s n SER 64 N -0.58 -4.84 -3.51 7.72 3.41 -1.26 -2.41 113.62 112.16 1r5s n SER 64 Ca 0.05 -0.47 -0.24 0.00 -0.26 0.00 0.00 58.87 57.96 1r5s n SER 64 Cb 0.55 -3.92 0.05 0.00 -0.26 0.00 0.00 64.21 60.63 1r5s n SER 64 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1r5s n ALA 65 N -3.90 -2.54 -0.11 7.33 0.00 -1.26 -4.94 120.51 115.09 1r5s n ALA 65 Ca -0.03 -0.10 -0.14 0.00 0.00 0.00 0.00 53.44 53.17 1r5s n ALA 65 Cb 0.56 -4.37 -0.13 0.00 0.00 0.00 0.00 19.45 15.51 1r5s n ALA 65 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1r5s n GLU 66 N -3.66 0.71 -0.03 0.00 0.28 -1.01 -4.08 120.64 112.85 1r5s n GLU 66 Ca -0.09 0.08 -0.11 0.00 -0.16 0.00 0.00 57.16 56.88 1r5s n GLU 66 Cb 0.60 -1.50 -0.06 0.00 1.43 0.00 0.00 31.44 31.91 1r5s n GLU 66 CO 0.00 0.00 0.00 1.96 -0.16 0.00 0.00 177.13 178.93 1r5s h GLN 67 N 0.00 0.21 -0.96 3.44 1.08 -1.92 -1.45 115.11 115.50 1r5s h GLN 67 Ca -0.55 -0.04 0.07 0.00 -1.45 0.00 0.00 58.65 56.69 1r5s h GLN 67 Cb 2.01 -0.03 -0.07 0.00 -0.05 0.00 0.00 27.48 29.35 1r5s h GLN 67 CO -0.04 0.33 0.62 -0.91 -0.95 0.00 0.00 178.83 177.88 1r5s h ASN 68 N 0.05 0.97 -0.43 1.46 2.35 -1.99 0.58 115.58 118.57 1r5s h ASN 68 Ca 0.04 0.01 0.01 0.00 -0.55 0.00 0.00 56.30 55.82 1r5s h ASN 68 Cb 0.20 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.36 1r5s h ASN 68 CO -0.00 0.60 0.27 0.03 -1.65 0.00 0.00 177.43 176.68 1r5s h ARG 69 N 1.09 0.54 0.00 0.81 3.08 -1.61 -1.62 114.38 116.66 1r5s h ARG 69 Ca 0.42 -0.03 -0.13 0.00 0.07 0.00 0.00 59.98 60.32 1r5s h ARG 69 Cb 0.23 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.14 1r5s h ARG 69 CO -0.17 0.36 -0.60 0.00 -1.07 0.00 0.00 179.97 178.49 1r5s h MET 70 N 0.55 0.00 -0.25 0.04 -0.00 -0.11 0.29 114.93 115.45 1r5s h MET 70 Ca 0.16 0.00 0.01 0.00 -0.00 0.00 0.00 59.70 59.87 1r5s h MET 70 Cb -0.03 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 31.55 1r5s h MET 70 CO -0.05 0.60 0.15 0.78 -0.00 0.00 0.00 176.91 178.38 1r5s h GLY 71 N 2.23 0.34 0.21 -3.00 0.00 0.77 0.34 103.07 103.97 1r5s h GLY 71 Ca -0.01 -0.12 -0.01 0.00 0.00 0.00 0.00 47.33 47.20 1r5s h GLY 71 CO 0.08 0.11 -0.10 1.46 0.00 0.00 0.00 176.54 178.08 1r5s h GLN 72 N 0.31 -0.28 -1.08 4.80 4.20 -1.26 -0.40 115.11 121.40 1r5s h GLN 72 Ca 0.09 0.02 0.43 0.00 0.06 0.00 0.00 58.65 59.26 1r5s h GLN 72 Cb -0.02 0.06 -0.17 0.00 0.30 0.00 0.00 27.48 27.66 1r5s h GLN 72 CO -0.04 -0.18 0.61 0.00 -0.67 0.00 0.00 178.83 178.55 1r5s n ALA 73 N -2.42 1.10 0.06 3.87 0.00 0.08 0.11 120.51 123.31 1r5s n ALA 73 Ca -0.04 0.99 -0.14 0.00 0.00 0.00 0.00 53.44 54.26 1r5s n ALA 73 Cb 0.11 -1.03 -0.14 0.00 0.00 0.00 0.00 19.45 18.40 1r5s n ALA 73 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1r5s h GLY 74 N 0.00 0.20 2.00 0.00 0.00 -0.37 -3.29 103.07 101.61 1r5s h GLY 74 Ca 0.86 -0.51 -0.02 0.00 0.00 0.00 0.00 47.33 47.65 1r5s h GLY 74 CO -0.71 0.45 -0.12 0.23 0.00 0.00 0.00 176.54 176.39 1r5s h SER 75 N 0.05 0.00 0.00 0.19 0.87 0.25 -3.45 113.55 111.46 1r5s h SER 75 Ca -0.18 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.38 1r5s h SER 75 Cb 1.96 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.92 1r5s h SER 75 CO 0.15 0.12 0.00 0.35 -0.53 0.00 0.00 176.83 176.92 1r5s n THR 76 N -4.21 0.00 -2.24 2.23 -2.24 -0.30 -4.78 114.28 102.75 1r5s n THR 76 Ca -0.03 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 61.73 1r5s n THR 76 Cb 0.20 0.00 -0.02 0.00 -2.10 0.00 0.00 70.33 68.41 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 0.00 -9.01 0.00 2.28 2.08 -1.26 -5.01 119.36 108.45 1r5s n ILE 77 Ca 0.00 1.53 0.00 0.00 0.56 0.00 0.00 62.75 64.84 1r5s n ILE 77 Cb 0.00 -5.68 0.00 0.00 -0.75 0.00 0.00 39.64 33.21 1r5s n ILE 77 CO 0.00 0.00 0.00 -0.24 0.56 0.00 0.00 176.55 176.87 1r5s n SER 78 N 0.80 0.00 -0.00 4.38 2.88 -1.26 -5.01 113.62 115.40 1r5s n SER 78 Ca -0.15 0.00 -0.04 0.00 -1.33 0.00 0.00 58.87 57.35 1r5s n SER 78 Cb 0.23 0.11 -0.01 0.00 -0.75 0.00 0.00 64.21 63.79 1r5s n SER 78 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 1r5s n ASN 79 N -1.83 0.92 -1.68 -3.46 2.85 -1.26 -5.05 115.26 105.76 1r5s n ASN 79 Ca 0.00 0.14 -0.10 0.00 -0.11 0.00 0.00 54.58 54.50 1r5s n ASN 79 Cb 0.00 -0.32 0.03 0.00 1.24 0.00 0.00 39.78 40.73 1r5s n ASN 79 CO 0.00 0.00 0.00 -1.20 -2.11 0.00 0.00 177.26 173.95 1r5s n SER 80 N -3.52 -3.76 -0.05 1.20 7.64 -1.26 -4.96 113.62 108.91 1r5s n SER 80 Ca -0.07 -0.19 -0.14 0.00 1.01 0.00 0.00 58.87 59.48 1r5s n SER 80 Cb 0.32 -2.47 -0.08 0.00 -1.01 0.00 0.00 64.21 60.97 1r5s n SER 80 CO 0.00 0.00 0.00 1.12 -3.01 0.00 0.00 175.04 173.15 1r5s h HIS 81 N -0.93 0.50 -3.76 1.43 2.07 -2.04 -3.46 115.15 108.95 1r5s h HIS 81 Ca -0.24 -0.18 -0.10 0.00 -2.85 0.00 0.00 60.37 57.00 1r5s h HIS 81 Cb 1.16 -0.09 -0.01 0.00 2.57 0.00 0.00 27.41 31.03 1r5s h HIS 81 CO 0.22 0.86 -0.11 0.00 -3.07 0.00 0.00 177.93 175.83 1r5s n ALA 82 N -2.47 -0.68 -0.08 6.11 0.00 -1.26 -4.78 120.51 117.35 1r5s n ALA 82 Ca -0.07 0.05 -0.21 0.00 0.00 0.00 0.00 53.44 53.21 1r5s n ALA 82 Cb 0.44 -0.82 -0.12 0.00 0.00 0.00 0.00 19.45 18.94 1r5s n ALA 82 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1r5s h GLN 83 N 0.00 0.05 0.00 0.00 4.20 -2.03 -3.38 115.11 113.95 1r5s h GLN 83 Ca -0.11 -0.09 0.00 0.00 0.06 0.00 0.00 58.65 58.51 1r5s h GLN 83 Cb 0.87 0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.68 1r5s h GLN 83 CO 0.14 1.04 -0.56 -0.35 -0.67 0.00 0.00 178.83 178.43 1r5s n PRO 84 N -4.27 0.18 0.00 1.46 -0.05 -1.26 -4.94 135.00 126.12 1r5s n PRO 84 Ca -0.31 0.05 0.00 0.00 -0.05 0.00 0.00 63.50 63.19 1r5s n PRO 84 Cb 0.74 -1.61 0.00 0.00 -0.05 0.00 0.00 33.50 32.58 1r5s n PRO 84 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 175.50 176.64 1r5s n PHE 85 N -1.88 0.00 -2.23 0.54 3.72 -1.26 -4.39 117.46 111.96 1r5s n PHE 85 Ca 0.04 0.00 -0.04 0.00 -0.05 0.00 0.00 57.45 57.40 1r5s n PHE 85 Cb 0.40 0.00 -0.00 0.00 -0.94 0.00 0.00 39.48 38.94 1r5s n PHE 85 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 1r5s n ASP 86 N 0.00 -1.80 -0.02 4.37 5.75 -1.26 -4.80 116.55 118.79 1r5s n ASP 86 Ca 0.00 0.34 -0.12 0.00 -0.01 0.00 0.00 54.79 55.00 1r5s n ASP 86 Cb 0.00 -1.69 -0.08 0.00 -1.03 0.00 0.00 41.12 38.32 1r5s n ASP 86 CO 0.00 0.00 0.00 -0.26 -0.11 0.00 0.00 177.20 176.83 1r5s h PHE 87 N 0.00 0.14 -2.90 2.11 0.04 -1.96 -3.44 116.94 110.93 1r5s h PHE 87 Ca -0.09 -0.03 -0.21 0.00 2.80 0.00 0.00 57.97 60.43 1r5s h PHE 87 Cb 0.92 -0.03 0.09 0.00 2.20 0.00 0.00 35.95 39.13 1r5s h PHE 87 CO 0.70 0.45 0.20 -0.35 -0.60 0.00 0.00 178.31 178.71 1r5s n PRO 88 N -4.82 -0.70 -2.14 1.51 -0.04 -1.26 -4.17 135.00 123.38 1r5s n PRO 88 Ca -0.07 -1.02 -0.08 0.00 -0.04 0.00 0.00 63.50 62.29 1r5s n PRO 88 Cb 0.22 -0.69 -0.01 0.00 -0.04 0.00 0.00 33.50 32.98 1r5s n PRO 88 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1r5s n ASP 89 N -3.45 -2.68 -2.83 3.54 9.92 -1.26 -4.81 116.55 114.98 1r5s n ASP 89 Ca 0.08 0.27 -0.08 0.00 -0.53 0.00 0.00 54.79 54.54 1r5s n ASP 89 Cb 0.29 -2.42 0.01 0.00 -0.64 0.00 0.00 41.12 38.36 1r5s n ASP 89 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 1r5s n ASP 90 N -1.22 -2.91 0.00 -2.24 8.00 -1.26 -4.90 116.55 112.02 1r5s n ASP 90 Ca -0.09 -2.96 0.00 0.00 0.71 0.00 0.00 54.79 52.45 1r5s n ASP 90 Cb 0.49 1.47 0.00 0.00 -0.02 0.00 0.00 41.12 43.06 1r5s n ASP 90 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1r5s n ASN 91 N 2.55 0.00 0.19 -2.24 5.15 -1.26 -4.92 115.26 114.73 1r5s n ASN 91 Ca 0.17 0.00 -0.13 0.00 -0.60 0.00 0.00 54.58 54.02 1r5s n ASN 91 Cb 0.57 0.04 -0.08 0.00 -0.53 0.00 0.00 39.78 39.78 1r5s n ASN 91 CO 0.00 0.00 0.00 1.56 1.40 0.00 0.00 177.26 180.22 1r5s h GLN 92 N 0.00 -0.49 0.00 1.20 4.20 -1.98 0.25 115.11 118.29 1r5s h GLN 92 Ca 0.00 0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.74 1r5s h GLN 92 Cb 0.00 0.11 0.00 0.00 0.30 0.00 0.00 27.48 27.89 1r5s h GLN 92 CO 0.00 -0.18 0.00 0.27 -0.67 0.00 0.00 178.83 178.25 1r5s n ASN 93 N -5.18 0.59 0.00 1.46 0.23 -1.26 -1.62 115.26 109.49 1r5s n ASN 93 Ca -0.10 0.68 0.08 0.00 -0.53 0.00 0.00 54.58 54.72 1r5s n ASN 93 Cb 0.28 -0.80 -0.14 0.00 -2.08 0.00 0.00 39.78 37.05 1r5s n ASN 93 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1r5s n ALA 94 N -1.76 2.57 0.01 -2.53 0.00 -1.11 -4.02 120.51 113.67 1r5s n ALA 94 Ca 0.01 -0.56 -0.22 0.00 0.00 0.00 0.00 53.44 52.67 1r5s n ALA 94 Cb 0.16 -0.76 -0.14 0.00 0.00 0.00 0.00 19.45 18.71 1r5s n ALA 94 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 1r5s h LYS 95 N 0.00 0.27 0.00 0.00 2.10 0.13 -2.42 116.57 116.65 1r5s h LYS 95 Ca -0.07 -0.46 0.00 0.00 -2.00 0.00 0.00 60.65 58.12 1r5s h LYS 95 Cb 1.17 0.17 0.00 0.00 -0.90 0.00 0.00 32.23 32.67 1r5s h LYS 95 CO 0.01 1.22 0.00 0.36 -2.00 0.00 0.00 179.45 179.04 1r5s n LYS 96 N -3.65 0.81 -0.03 0.07 2.85 -0.64 -2.09 118.16 115.48 1r5s n LYS 96 Ca -0.30 0.00 -0.03 0.00 -1.05 0.00 0.00 58.31 56.93 1r5s n LYS 96 Cb 1.00 -1.47 -0.03 0.00 -0.65 0.00 0.00 35.03 33.89 1r5s n LYS 96 CO 0.00 0.00 0.00 1.55 -0.05 0.00 0.00 177.40 178.90 1r5s n VAL 97 N -0.97 0.31 0.15 0.58 3.14 -1.25 -4.66 118.33 115.64 1r5s n VAL 97 Ca 0.18 -0.13 0.02 0.00 -2.96 0.00 0.00 64.34 61.45 1r5s n VAL 97 Cb 0.08 -0.73 0.16 0.00 -1.06 0.00 0.00 33.84 32.29 1r5s n VAL 97 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1r5s h ALA 98 N 0.04 0.80 -0.14 1.55 0.00 -1.44 -2.80 119.26 117.27 1r5s h ALA 98 Ca -0.12 -0.48 -0.60 0.00 0.00 0.00 0.00 54.91 53.71 1r5s h ALA 98 Cb 1.21 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.89 1r5s h ALA 98 CO -0.01 0.65 2.77 0.00 0.00 0.00 0.00 179.25 182.66 1r5s n ALA 99 N -2.29 7.21 0.00 0.00 0.00 -0.89 -3.61 120.51 120.93 1r5s n ALA 99 Ca 0.00 -3.33 0.00 0.00 0.00 0.00 0.00 53.44 50.12 1r5s n ALA 99 Cb 0.65 -3.05 0.00 0.00 0.00 0.00 0.00 19.45 17.06 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 2.96 0.90 0.07 0.00 0.00 -1.25 -4.96 105.19 102.92 1r5s n GLY 100 Ca 0.69 -0.05 0.10 0.00 0.00 0.00 0.00 46.02 46.76 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 0.47 0.03 1.61 -0.00 -1.06 -2.53 115.22 113.74 1r5s n HIS 101 Ca 0.00 0.18 -0.19 0.00 -0.00 0.00 0.00 57.72 57.71 1r5s n HIS 101 Cb 0.00 -0.79 -0.14 0.00 -0.00 0.00 0.00 29.99 29.06 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 0.26 -5.70 1.57 5.08 -1.84 -3.50 114.58 110.45 1r5s h GLU 102 Ca 0.00 -0.44 -0.13 0.00 -1.00 0.00 0.00 59.36 57.79 1r5s h GLU 102 Cb 0.35 0.17 0.01 0.00 0.50 0.00 0.00 28.75 29.77 1r5s h GLU 102 CO 0.00 1.12 -0.73 1.28 -1.00 0.00 0.00 179.01 179.68 1r5s n LEU 103 N -3.44 -6.19 -3.70 1.33 4.77 -1.05 -5.05 117.00 103.67 1r5s n LEU 103 Ca -0.25 0.31 -0.12 0.00 -0.03 0.00 0.00 56.01 55.92 1r5s n LEU 103 Cb 1.05 -2.83 -0.09 0.00 -2.33 0.00 0.00 43.42 39.22 1r5s n LEU 103 CO 0.47 -1.60 0.16 -1.58 -1.33 0.00 0.00 177.39 173.50 1r5s s GLN 104 N -2.57 0.54 0.20 3.23 0.74 -1.26 -5.06 119.66 115.48 1r5s s GLN 104 Ca 0.29 0.75 -0.11 0.00 0.05 0.00 0.00 55.36 56.34 1r5s s GLN 104 Cb -0.06 0.19 0.13 0.00 1.10 0.00 0.00 33.01 34.38 1r5s s GLN 104 CO 0.81 -0.10 1.86 -1.00 -0.55 0.00 0.00 175.29 176.31 1r5s h PRO 105 N 5.93 0.87 0.00 1.67 0.13 -2.00 -3.33 132.00 135.28 1r5s h PRO 105 Ca -0.30 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.78 1r5s h PRO 105 Cb 1.18 -0.20 0.00 0.00 0.13 0.00 0.00 31.00 32.11 1r5s h PRO 105 CO 0.22 0.58 0.00 1.28 -0.23 0.00 0.00 178.00 179.85 1r5s n LEU 106 N -4.63 0.77 0.00 1.56 4.32 -1.26 -4.55 117.00 113.21 1r5s n LEU 106 Ca 0.06 0.44 0.00 0.00 -0.02 0.00 0.00 56.01 56.49 1r5s n LEU 106 Cb 0.03 -0.34 0.00 0.00 -1.62 0.00 0.00 43.42 41.49 1r5s n LEU 106 CO 0.35 -0.34 0.00 0.00 -1.22 0.00 0.00 177.39 176.19 1r5s n ALA 107 N -1.51 0.00 -1.30 -1.18 0.00 -1.25 -1.43 120.51 113.84 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 -0.78 -0.04 0.00 0.00 0.00 0.00 19.45 18.63 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 -2.46 0.00 0.00 0.00 2.08 -1.26 -4.78 119.36 112.94 1r5s n ILE 108 Ca 0.00 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.31 1r5s n ILE 108 Cb 0.25 -1.23 0.00 0.00 -0.75 0.00 0.00 39.64 37.91 1r5s n ILE 108 CO 0.00 0.00 0.00 1.33 0.56 0.00 0.00 176.55 178.44 1r5s n VAL 109 N -2.69 0.00 0.00 1.39 0.24 -1.04 -5.00 118.33 111.23 1r5s n VAL 109 Ca -0.10 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.20 1r5s n VAL 109 Cb 0.35 -0.12 0.00 0.00 -1.47 0.00 0.00 33.84 32.60 1r5s n VAL 109 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 1r5s n ASP 110 N -0.70 0.00 -0.04 -1.34 9.92 -0.52 -2.85 116.55 121.03 1r5s n ASP 110 Ca 0.00 0.00 -0.05 0.00 -0.53 0.00 0.00 54.79 54.21 1r5s n ASP 110 Cb 0.08 0.00 -0.06 0.00 -0.64 0.00 0.00 41.12 40.50 1r5s n ASP 110 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1r5s n GLN 111 N 0.00 2.24 0.00 -1.24 1.13 -1.26 -4.95 117.38 113.30 1r5s n GLN 111 Ca 0.00 0.01 0.00 0.00 -1.94 0.00 0.00 57.00 55.07 1r5s n GLN 111 Cb 0.00 -1.20 0.00 0.00 0.11 0.00 0.00 30.24 29.15 1r5s n GLN 111 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 1r5s n ARG 112 N -2.39 0.00 -0.07 -1.09 3.00 -1.13 -4.86 116.66 110.12 1r5s n ARG 112 Ca -0.14 0.00 -0.14 0.00 -0.01 0.00 0.00 57.85 57.56 1r5s n ARG 112 Cb 0.75 0.00 -0.10 0.00 0.00 0.00 0.00 32.46 33.11 1r5s n ARG 112 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.63 176.28 1r5s h PRO 113 N 0.00 -0.47 0.00 5.56 0.11 -1.97 -3.45 132.00 131.78 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 0.11 0.00 0.00 0.11 0.00 0.00 31.00 31.22 1r5s h PRO 113 CO 0.00 -0.31 0.00 0.43 -0.21 0.00 0.00 178.00 177.91 1r5s n SER 114 N -5.34 0.00 -0.21 -2.05 7.64 -1.26 -4.61 113.62 107.79 1r5s n SER 114 Ca -0.05 0.00 0.04 0.00 1.01 0.00 0.00 58.87 59.87 1r5s n SER 114 Cb 0.35 0.00 0.01 0.00 -1.01 0.00 0.00 64.21 63.56 1r5s n SER 114 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1r5s n SER 115 N 0.15 1.20 -2.07 6.43 2.88 -1.26 -5.08 113.62 115.86 1r5s n SER 115 Ca 0.00 -1.10 -0.00 0.00 -1.33 0.00 0.00 58.87 56.44 1r5s n SER 115 Cb 0.00 0.37 -0.00 0.00 -0.75 0.00 0.00 64.21 63.83 1r5s n SER 115 CO 0.00 0.00 0.00 -1.14 -1.23 0.00 0.00 175.04 172.67 1r5s n ARG 116 N -0.14 -4.12 0.00 -1.46 3.00 -1.26 -4.99 116.66 107.69 1r5s n ARG 116 Ca 0.04 3.09 0.00 0.00 -0.00 0.00 0.00 57.85 60.98 1r5s n ARG 116 Cb 0.17 -3.85 0.00 0.00 0.00 0.00 0.00 32.46 28.78 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 1.45 1.85 -2.60 5.13 0.00 -1.26 -4.75 120.51 120.33 1r5s n ALA 117 Ca -0.00 -0.53 -0.13 0.00 0.00 0.00 0.00 53.44 52.78 1r5s n ALA 117 Cb 0.00 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.48 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 2.48 0.00 0.00 2.88 -1.26 -4.83 113.62 112.77 1r5s n SER 118 Ca 0.00 -2.90 0.14 0.00 -1.33 0.00 0.00 58.87 54.77 1r5s n SER 118 Cb 0.14 -0.49 0.74 0.00 -0.75 0.00 0.00 64.21 63.85 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 -0.30 0.00 -0.04 -3.46 2.88 -1.26 -3.16 113.62 108.28 1r5s n SER 119 Ca 0.18 -0.43 -0.02 0.00 -1.33 0.00 0.00 58.87 57.27 1r5s n SER 119 Cb 0.79 -0.16 -0.08 0.00 -0.75 0.00 0.00 64.21 64.01 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 -1.16 1.77 0.00 -1.46 1.74 -1.26 -5.01 116.66 111.27 1r5s n ARG 120 Ca 0.16 -0.03 0.00 0.00 -0.77 0.00 0.00 57.85 57.21 1r5s n ARG 120 Cb 0.16 -1.27 0.00 0.00 -1.02 0.00 0.00 32.46 30.34 1r5s n ARG 120 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1r5s n ALA 121 N -2.25 0.00 -0.13 7.54 0.00 -1.19 -4.52 120.51 119.96 1r5s n ALA 121 Ca -0.13 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.23 1r5s n ALA 121 Cb 0.69 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 20.14 1r5s n ALA 121 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1r5s h SER 122 N 0.00 0.50 -3.75 0.00 0.87 -1.95 -3.47 113.55 105.75 1r5s h SER 122 Ca 0.00 -0.07 -0.38 0.00 -1.23 0.00 0.00 61.79 60.10 1r5s h SER 122 Cb 0.00 -0.13 0.03 0.00 -0.44 0.00 0.00 62.40 61.87 1r5s h SER 122 CO 0.00 0.42 -0.55 -0.24 -0.53 0.00 0.00 176.83 175.94 1r5s n SER 123 N -4.75 -5.77 -3.57 6.23 2.88 -1.26 -4.97 113.62 102.41 1r5s n SER 123 Ca 0.00 -0.19 -0.29 0.00 -1.33 0.00 0.00 58.87 57.06 1r5s n SER 123 Cb 0.07 -4.66 -0.12 0.00 -0.75 0.00 0.00 64.21 58.74 1r5s n SER 123 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 1r5s s ARG 124 N -5.42 0.91 0.09 -1.46 0.52 -1.26 -4.70 118.95 107.63 1r5s s ARG 124 Ca 0.20 -1.69 -0.23 0.00 -0.52 0.00 0.00 55.73 53.49 1r5s s ARG 124 Cb -0.09 -1.78 -0.07 0.00 0.52 0.00 0.00 34.95 33.53 1r5s s ARG 124 CO 0.24 -1.20 1.38 -1.35 0.02 0.00 0.00 175.30 174.40 1r5s h PRO 125 N 6.80 -0.24 0.00 3.54 0.11 -1.95 -3.46 132.00 136.79 1r5s h PRO 125 Ca 0.04 0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.17 1r5s h PRO 125 Cb 0.95 0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.11 1r5s h PRO 125 CO 0.37 -0.16 0.00 -2.13 -0.21 0.00 0.00 178.00 175.87 1r5s n ARG 126 N -4.57 0.00 -1.05 1.05 0.63 -1.26 -4.98 116.66 106.48 1r5s n ARG 126 Ca -0.02 0.00 -0.18 0.00 -0.92 0.00 0.00 57.85 56.73 1r5s n ARG 126 Cb 0.23 0.00 -0.02 0.00 0.45 0.00 0.00 32.46 33.13 1r5s n ARG 126 CO 0.00 0.00 0.00 -0.35 -2.51 0.00 0.00 177.63 174.77 1r5s n PRO 127 N -2.39 1.92 -3.56 -0.14 -0.05 -1.26 -4.77 135.00 124.75 1r5s n PRO 127 Ca 0.00 -1.58 -0.21 0.00 -0.05 0.00 0.00 63.50 61.66 1r5s n PRO 127 Cb 0.00 -1.75 0.05 0.00 -0.05 0.00 0.00 33.50 31.75 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 0.86 -3.06 -1.89 3.54 -0.08 -1.26 -2.02 116.55 112.64 1r5s n ASP 128 Ca 0.34 -0.79 -0.13 0.00 -1.51 0.00 0.00 54.79 52.69 1r5s n ASP 128 Cb 0.60 -4.37 0.02 0.00 2.34 0.00 0.00 41.12 39.71 1r5s n ASP 128 CO 0.00 0.00 0.00 -0.67 0.12 0.00 0.00 177.20 176.65 1r5s n ASP 129 N -3.04 -4.29 -1.70 1.67 2.03 -1.26 -2.72 116.55 107.23 1r5s n ASP 129 Ca -0.22 -0.17 -0.09 0.00 0.52 0.00 0.00 54.79 54.83 1r5s n ASP 129 Cb 0.65 -3.19 -0.03 0.00 -0.72 0.00 0.00 41.12 37.84 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 -2.49 -0.72 0.26 -2.67 4.32 -0.86 -4.77 117.00 110.08 1r5s n LEU 130 Ca -0.07 0.24 0.12 0.00 -0.02 0.00 0.00 56.01 56.28 1r5s n LEU 130 Cb 0.57 -1.63 0.72 0.00 -1.62 0.00 0.00 43.42 41.47 1r5s n LEU 130 CO 0.28 -0.33 1.00 1.05 -1.22 0.00 0.00 177.39 178.17 1r5s h GLU 131 N 0.00 0.00 0.00 3.23 4.11 -1.42 -3.50 114.58 117.00 1r5s h GLU 131 Ca -0.19 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.24 1r5s h GLU 131 Cb 0.79 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.04 1r5s h GLU 131 CO 0.26 0.10 0.00 0.44 0.07 0.00 0.00 179.01 179.88