#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mke s LEU 2 N 0.00 4.30 0.81 0.64 1.43 -1.26 -5.02 118.68 119.59 1mke s LEU 2 Ca 0.00 1.90 -0.12 0.00 -1.03 0.00 0.00 54.13 54.89 1mke s LEU 2 Cb 0.00 -3.56 0.08 0.00 0.03 0.00 0.00 46.19 42.74 1mke s LEU 2 CO 0.00 -0.58 1.10 -2.16 0.23 0.00 0.00 176.35 174.94 1mke s PRO 3 N 1.98 1.95 0.19 1.29 0.04 -1.26 -5.01 135.00 134.18 1mke s PRO 3 Ca 0.58 0.59 -0.30 0.00 0.04 0.00 0.00 61.00 61.91 1mke s PRO 3 Cb -0.27 -1.91 -0.08 0.00 0.04 0.00 0.00 34.50 32.29 1mke s PRO 3 CO 0.24 -1.71 1.11 -1.25 0.04 0.00 0.00 177.00 175.44 1mke s PRO 4 N -5.17 4.59 0.14 0.56 0.04 -1.26 -4.96 135.00 128.93 1mke s PRO 4 Ca 0.61 1.75 -0.30 0.00 0.04 0.00 0.00 61.00 63.10 1mke s PRO 4 Cb -0.14 -3.26 -0.07 0.00 0.04 0.00 0.00 34.50 31.06 1mke s PRO 4 CO 0.54 0.07 1.13 -1.25 0.04 0.00 0.00 177.00 177.53 1mke s PRO 5 N -0.47 4.53 0.07 0.56 0.04 -1.26 -5.04 135.00 133.43 1mke s PRO 5 Ca 0.49 1.74 0.02 0.00 0.04 0.00 0.00 61.00 63.29 1mke s PRO 5 Cb -0.30 -3.30 -0.04 0.00 0.04 0.00 0.00 34.50 30.90 1mke s PRO 5 CO 0.36 -0.05 0.11 -1.21 0.04 0.00 0.00 177.00 176.25 1mke s GLU 6 N 0.12 3.03 -0.18 4.56 2.02 -1.26 -5.07 118.70 121.93 1mke s GLU 6 Ca 0.53 -0.61 -0.29 0.00 0.02 0.00 0.00 54.97 54.61 1mke s GLU 6 Cb -0.29 -2.82 -0.01 0.00 0.10 0.00 0.00 34.13 31.11 1mke s GLU 6 CO 0.33 0.59 1.28 -1.25 0.02 0.00 0.00 175.26 176.23 1mke s PRO 7 N -2.35 4.20 -0.08 0.39 0.04 -1.26 -5.01 135.00 130.93 1mke s PRO 7 Ca 0.30 1.64 -0.17 0.00 0.04 0.00 0.00 61.00 62.80 1mke s PRO 7 Cb -0.12 -3.78 -0.05 0.00 0.04 0.00 0.00 34.50 30.59 1mke s PRO 7 CO 0.23 -0.75 0.46 -0.47 0.04 0.00 0.00 177.00 176.51 1mke s TYR 8 N 3.61 3.57 -0.03 0.56 5.04 -1.26 -5.07 117.35 123.77 1mke s TYR 8 Ca 0.55 0.93 0.04 0.00 -2.44 0.00 0.00 57.07 56.15 1mke s TYR 8 Cb -0.22 -2.49 -0.00 0.00 0.35 0.00 0.00 41.96 39.60 1mke s TYR 8 CO 0.16 0.29 -0.14 0.54 -1.34 0.00 0.00 175.55 175.06 1mke s VAL 9 N 0.17 1.19 -0.05 3.14 0.11 -1.26 -5.00 120.40 118.70 1mke s VAL 9 Ca 0.25 -0.59 -0.31 0.00 -2.93 0.00 0.00 61.98 58.40 1mke s VAL 9 Cb -0.16 -1.03 0.13 0.00 -1.53 0.00 0.00 36.38 33.79 1mke s VAL 9 CO 0.11 0.35 1.29 -1.10 -3.33 0.00 0.00 175.10 172.42 1mke s GLN 10 N 0.03 0.35 0.01 1.54 -1.52 -1.26 -5.08 119.66 113.73 1mke s GLN 10 Ca -0.02 -0.19 0.00 0.00 -1.95 0.00 0.00 55.36 53.20 1mke s GLN 10 Cb -0.10 0.12 0.00 0.00 -0.22 0.00 0.00 33.01 32.82 1mke s GLN 10 CO 0.01 -0.16 0.00 -2.37 -0.25 0.00 0.00 175.29 172.52 1mke n THR 11 N -0.43 0.11 -3.64 -0.19 5.66 -1.26 -5.10 114.28 109.43 1mke n THR 11 Ca -0.07 0.04 -0.07 0.00 -3.05 0.00 0.00 64.05 60.90 1mke n THR 11 Cb 0.62 -1.50 -0.07 0.00 -1.55 0.00 0.00 70.33 67.83 1mke n THR 11 CO 0.00 0.00 0.00 0.28 -3.05 0.00 0.00 175.07 172.30 1mke s THR 12 N -2.00 0.00 0.30 1.09 -1.32 -1.26 -5.07 115.64 107.38 1mke s THR 12 Ca 0.00 0.00 0.07 0.00 -1.21 0.00 0.00 61.69 60.55 1mke s THR 12 Cb 0.00 -1.00 -0.03 0.00 -1.51 0.00 0.00 72.50 69.96 1mke s THR 12 CO 0.00 0.00 0.22 -0.54 -2.21 0.00 0.00 174.62 172.09 1mke s LYS 13 N 0.11 2.74 -0.04 7.08 3.01 -1.26 -5.13 119.74 126.25 1mke s LYS 13 Ca 0.05 -1.23 0.06 0.00 -1.01 0.00 0.00 55.97 53.83 1mke s LYS 13 Cb -0.05 -2.46 -0.02 0.00 -1.01 0.00 0.00 37.83 34.29 1mke s LYS 13 CO -0.10 0.23 -0.21 -1.12 0.51 0.00 0.00 175.35 174.66 1mke s SER 14 N -3.90 3.49 0.03 2.83 0.01 -1.26 -5.13 113.70 109.76 1mke s SER 14 Ca 0.37 -0.35 0.04 0.00 1.31 0.00 0.00 55.95 57.32 1mke s SER 14 Cb -0.06 -0.60 -0.04 0.00 0.21 0.00 0.00 66.02 65.53 1mke s SER 14 CO 0.25 0.33 -0.04 -0.31 0.41 0.00 0.00 173.24 173.87 1mke s TYR 15 N -0.63 2.93 0.01 2.43 1.51 -1.26 -4.20 117.35 118.13 1mke s TYR 15 Ca 0.10 -0.02 -0.20 0.00 -1.01 0.00 0.00 57.07 55.94 1mke s TYR 15 Cb -0.10 -1.59 -0.22 0.00 -0.11 0.00 0.00 41.96 39.94 1mke s TYR 15 CO -0.00 0.42 1.13 -1.00 -1.11 0.00 0.00 175.55 174.99 1mke h PRO 16 N 4.20 0.41 -0.52 -1.71 0.13 -1.91 -2.02 132.00 130.59 1mke h PRO 16 Ca -0.48 -0.40 -0.00 0.00 -0.87 0.00 0.00 66.00 64.24 1mke h PRO 16 Cb 1.17 0.10 -0.03 0.00 0.13 0.00 0.00 31.00 32.38 1mke h PRO 16 CO 0.55 1.06 0.31 0.66 -0.23 0.00 0.00 178.00 180.36 1mke h SER 17 N -0.08 0.61 -1.86 1.44 4.64 -1.90 -2.70 113.55 113.70 1mke h SER 17 Ca -0.06 -0.03 -0.62 0.00 -0.47 0.00 0.00 61.79 60.61 1mke h SER 17 Cb 1.22 -0.15 -0.39 0.00 -0.31 0.00 0.00 62.40 62.76 1mke h SER 17 CO 0.11 0.46 -0.40 1.17 -0.87 0.00 0.00 176.83 177.30 1mke n LYS 18 N -4.43 3.43 -0.01 4.77 4.81 -1.22 -4.61 118.16 120.90 1mke n LYS 18 Ca 0.05 -4.53 0.09 0.00 -0.87 0.00 0.00 58.31 53.04 1mke n LYS 18 Cb 0.07 -2.26 -0.14 0.00 0.02 0.00 0.00 35.03 32.72 1mke n LYS 18 CO 0.00 0.00 0.00 -0.11 1.17 0.00 0.00 177.40 178.46 1mke n LEU 19 N -0.39 0.05 -0.63 3.14 0.00 -0.76 -4.46 117.00 113.95 1mke n LEU 19 Ca 0.39 -0.03 -0.08 0.00 0.00 0.00 0.00 56.01 56.28 1mke n LEU 19 Cb 0.50 0.00 -0.04 0.00 0.00 0.00 0.00 43.42 43.89 1mke n LEU 19 CO 0.36 0.01 -0.08 0.00 0.00 0.00 0.00 177.39 177.69 1mke n ALA 20 N -2.07 -0.12 -1.40 1.96 0.00 -1.26 -4.68 120.51 112.93 1mke n ALA 20 Ca -0.03 0.13 0.03 0.00 0.00 0.00 0.00 53.44 53.57 1mke n ALA 20 Cb 0.45 -1.19 -0.02 0.00 0.00 0.00 0.00 19.45 18.70 1mke n ALA 20 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1mke n ARG 21 N -2.22 -3.61 -3.41 0.00 3.00 -1.26 -4.95 116.66 104.21 1mke n ARG 21 Ca -0.08 2.82 -0.22 0.00 -0.01 0.00 0.00 57.85 60.36 1mke n ARG 21 Cb 0.34 -3.61 -0.10 0.00 0.00 0.00 0.00 32.46 29.09 1mke n ARG 21 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.63 178.84 1mke s ASN 22 N -5.48 2.01 -0.26 0.55 3.84 -1.26 -5.12 114.94 109.22 1mke s ASN 22 Ca 0.00 -1.63 -0.33 0.00 0.21 0.00 0.00 52.86 51.11 1mke s ASN 22 Cb 0.00 0.17 0.17 0.00 -0.55 0.00 0.00 41.25 41.04 1mke s ASN 22 CO 0.00 -0.31 1.32 -0.70 -2.79 0.00 0.00 177.10 174.62 1mke s GLU 23 N 1.50 0.13 0.29 0.43 2.12 -1.26 -5.19 118.70 116.73 1mke s GLU 23 Ca 0.16 -0.01 0.03 0.00 0.36 0.00 0.00 54.97 55.50 1mke s GLU 23 Cb -0.18 0.06 -0.04 0.00 0.26 0.00 0.00 34.13 34.23 1mke s GLU 23 CO -0.09 -0.05 0.14 0.45 -0.54 0.00 0.00 175.26 175.17 1mke s SER 24 N -1.51 1.46 0.51 -1.70 0.15 -1.26 -5.09 113.70 106.26 1mke s SER 24 Ca 0.09 -1.51 0.00 0.00 0.70 0.00 0.00 55.95 55.24 1mke s SER 24 Cb -0.01 0.32 0.00 0.00 -1.71 0.00 0.00 66.02 64.62 1mke s SER 24 CO -0.05 -0.84 0.00 0.54 1.20 0.00 0.00 173.24 174.09 1mke n ARG 25 N -0.55 -4.32 0.00 5.44 1.74 -1.26 -4.99 116.66 112.71 1mke n ARG 25 Ca 0.00 3.23 0.00 0.00 -0.77 0.00 0.00 57.85 60.32 1mke n ARG 25 Cb 0.65 -3.67 0.00 0.00 -1.02 0.00 0.00 32.46 28.43 1mke n ARG 25 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1mke n GLY 26 N -1.03 0.32 1.01 -0.13 0.00 -1.26 -5.11 105.19 98.99 1mke n GLY 26 Ca 0.00 -1.80 0.12 0.00 0.00 0.00 0.00 46.02 44.34 1mke n GLY 26 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1mke n SER 27 N 0.00 -5.47 0.00 1.61 2.88 -1.26 -5.04 113.62 106.34 1mke n SER 27 Ca 0.00 1.02 0.00 0.00 -1.33 0.00 0.00 58.87 58.56 1mke n SER 27 Cb 0.00 -3.47 0.00 0.00 -0.75 0.00 0.00 64.21 59.99 1mke n SER 27 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1mke n GLY 28 N -3.64 -1.79 0.00 0.46 0.00 -1.26 -5.16 105.19 93.81 1mke n GLY 28 Ca -0.07 0.67 0.00 0.00 0.00 0.00 0.00 46.02 46.62 1mke n GLY 28 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1mke n SER 29 N 0.00 0.00 -3.58 1.61 2.88 -1.26 -5.06 113.62 108.21 1mke n SER 29 Ca 0.00 0.00 -0.41 0.00 -1.33 0.00 0.00 58.87 57.13 1mke n SER 29 Cb 0.00 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.45 1mke n SER 29 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1mke n GLY 30 N 0.00 4.63 3.16 0.46 0.00 -1.26 -4.69 105.19 107.49 1mke n GLY 30 Ca 0.00 -1.78 -0.18 0.00 0.00 0.00 0.00 46.02 44.06 1mke n GLY 30 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1mke n SER 31 N 3.91 -6.73 -2.59 1.61 7.64 -1.26 -4.92 113.62 111.28 1mke n SER 31 Ca 0.59 0.35 -0.27 0.00 1.01 0.00 0.00 58.87 60.55 1mke n SER 31 Cb 0.31 -3.20 -0.01 0.00 -1.01 0.00 0.00 64.21 60.30 1mke n SER 31 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1mke n LEU 32 N 0.16 4.69 -3.15 -3.43 4.32 -1.26 -4.92 117.00 113.41 1mke n LEU 32 Ca -0.00 -5.32 0.04 0.00 -0.02 0.00 0.00 56.01 50.71 1mke n LEU 32 Cb 0.50 -0.49 -0.00 0.00 -1.62 0.00 0.00 43.42 41.81 1mke n LEU 32 CO 0.42 2.26 0.18 0.12 -1.22 0.00 0.00 177.39 179.15 1mke s PHE 33 N -3.53 -1.61 -0.98 -1.77 2.19 -1.26 -5.08 117.98 105.93 1mke s PHE 33 Ca 0.48 1.08 -0.04 0.00 0.33 0.00 0.00 56.93 58.78 1mke s PHE 33 Cb 0.37 0.33 0.24 0.00 -1.31 0.00 0.00 43.02 42.66 1mke s PHE 33 CO -0.18 -0.93 0.92 0.45 1.83 0.00 0.00 175.22 177.31 1mke n SER 34 N 5.39 4.71 -0.13 6.13 2.88 -1.26 -4.78 113.62 126.56 1mke n SER 34 Ca 0.04 -3.10 -0.24 0.00 -1.33 0.00 0.00 58.87 54.23 1mke n SER 34 Cb 0.54 -1.17 -0.08 0.00 -0.75 0.00 0.00 64.21 62.75 1mke n SER 34 CO 0.00 0.00 0.00 0.33 -1.23 0.00 0.00 175.04 174.14 1mke n PHE 35 N 2.41 0.04 -2.07 0.66 7.35 -1.26 -5.10 117.46 119.49 1mke n PHE 35 Ca 0.23 0.02 -0.01 0.00 -0.76 0.00 0.00 57.45 56.93 1mke n PHE 35 Cb 0.38 -0.87 -0.00 0.00 0.35 0.00 0.00 39.48 39.33 1mke n PHE 35 CO 0.00 0.00 0.00 -0.11 -0.76 0.00 0.00 176.76 175.89 1mke n LEU 36 N -4.31 -5.52 -4.16 -2.13 7.94 -1.26 -4.76 117.00 102.79 1mke n LEU 36 Ca -0.43 2.14 -0.56 0.00 -1.11 0.00 0.00 56.01 56.05 1mke n LEU 36 Cb 0.78 -2.73 -0.08 0.00 0.53 0.00 0.00 43.42 41.92 1mke n LEU 36 CO 0.08 -2.35 0.70 0.61 -1.11 0.00 0.00 177.39 175.32 1mke n GLY 37 N 1.39 -0.11 0.38 -3.96 0.00 -1.26 -4.83 105.19 96.81 1mke n GLY 37 Ca -0.04 0.77 -0.13 0.00 0.00 0.00 0.00 46.02 46.62 1mke n GLY 37 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1mke h LYS 38 N 3.35 -0.56 -1.40 1.61 3.64 -2.05 -3.46 116.57 117.70 1mke h LYS 38 Ca -0.44 0.04 0.12 0.00 -1.27 0.00 0.00 60.65 59.10 1mke h LYS 38 Cb 1.28 0.13 -0.26 0.00 -0.41 0.00 0.00 32.23 32.97 1mke h LYS 38 CO 0.69 -0.37 0.65 0.15 -2.27 0.00 0.00 179.45 178.31 1mke s LYS 39 N -5.18 0.40 0.41 1.90 -0.14 -1.26 -5.14 119.74 110.72 1mke s LYS 39 Ca -0.13 0.20 -0.26 0.00 -1.36 0.00 0.00 55.97 54.41 1mke s LYS 39 Cb 0.05 0.19 -0.09 0.00 -1.68 0.00 0.00 37.83 36.30 1mke s LYS 39 CO 0.48 -0.11 1.41 0.00 -0.76 0.00 0.00 175.35 176.38 1mke s VAL 41 N -1.18 5.00 -0.07 0.00 -7.23 -0.98 -4.92 120.40 111.01 1mke s VAL 41 Ca 0.57 0.21 0.01 0.00 -1.81 0.00 0.00 61.98 60.95 1mke s VAL 41 Cb -0.43 -3.68 -0.03 0.00 0.56 0.00 0.00 36.38 32.80 1mke s VAL 41 CO 0.57 -0.21 -0.07 -0.89 -0.31 0.00 0.00 175.10 174.18 1mke s THR 42 N -1.96 3.68 0.00 5.32 2.01 -1.26 -1.28 115.64 122.14 1mke s THR 42 Ca 0.45 -0.49 0.00 0.00 0.31 0.00 0.00 61.69 61.96 1mke s THR 42 Cb -0.11 -2.51 0.00 0.00 0.01 0.00 0.00 72.50 69.89 1mke s THR 42 CO 0.27 0.59 0.00 0.80 -0.69 0.00 0.00 174.62 175.59 1mke n MET 43 N 2.31 0.00 -4.03 4.92 1.56 0.16 -4.99 117.12 117.04 1mke n MET 43 Ca -0.18 0.21 -0.10 0.00 -0.27 0.00 0.00 57.70 57.36 1mke n MET 43 Cb 0.53 -0.67 -0.07 0.00 2.15 0.00 0.00 33.22 35.16 1mke n MET 43 CO 0.00 0.00 0.00 0.45 -0.73 0.00 0.00 175.97 175.69 1mke s SER 44 N -3.18 -0.01 -0.07 6.12 0.15 -1.25 -4.97 113.70 110.48 1mke s SER 44 Ca 0.00 -1.01 -0.01 0.00 0.70 0.00 0.00 55.95 55.63 1mke s SER 44 Cb 0.00 0.51 0.03 0.00 -1.71 0.00 0.00 66.02 64.84 1mke s SER 44 CO 0.00 -1.02 -0.01 -0.94 1.20 0.00 0.00 173.24 172.48 1mke s SER 45 N -3.04 1.50 -0.05 5.45 1.04 -1.26 -0.72 113.70 116.63 1mke s SER 45 Ca 0.25 -0.09 -0.02 0.00 0.48 0.00 0.00 55.95 56.57 1mke s SER 45 Cb 0.02 -0.45 0.04 0.00 0.10 0.00 0.00 66.02 65.73 1mke s SER 45 CO 0.07 -0.17 0.09 0.00 0.98 0.00 0.00 173.24 174.21 1mke s ALA 46 N 1.83 -0.07 -0.03 5.32 0.00 0.81 -4.98 121.76 124.64 1mke s ALA 46 Ca 0.03 0.47 -0.30 0.00 0.00 0.00 0.00 51.96 52.17 1mke s ALA 46 Cb -0.12 -0.42 -0.06 0.00 0.00 0.00 0.00 23.12 22.51 1mke s ALA 46 CO -0.05 -0.21 1.74 0.08 0.00 0.00 0.00 175.76 177.32 1mke s VAL 47 N 1.34 3.44 0.25 0.00 1.01 -1.26 -2.97 120.40 122.20 1mke s VAL 47 Ca -0.07 0.53 0.05 0.00 0.00 0.00 0.00 61.98 62.49 1mke s VAL 47 Cb -0.12 -3.34 -0.05 0.00 0.00 0.00 0.00 36.38 32.86 1mke s VAL 47 CO -0.04 -0.05 -0.03 0.68 0.00 0.00 0.00 175.10 175.66 1mke s VAL 48 N 4.17 1.32 -0.19 2.92 -7.23 -1.02 0.14 120.40 120.52 1mke s VAL 48 Ca 0.77 -2.07 -0.00 0.00 -1.81 0.00 0.00 61.98 58.87 1mke s VAL 48 Cb -0.36 -2.39 0.01 0.00 0.56 0.00 0.00 36.38 34.20 1mke s VAL 48 CO 0.33 -0.31 -0.15 -1.10 -0.31 0.00 0.00 175.10 173.55 1mke s GLN 49 N -3.80 3.13 -0.18 4.82 -0.21 0.54 -2.62 119.66 121.33 1mke s GLN 49 Ca 0.29 -0.76 -0.28 0.00 0.02 0.00 0.00 55.36 54.62 1mke s GLN 49 Cb 0.05 -2.69 -0.00 0.00 1.00 0.00 0.00 33.01 31.36 1mke s GLN 49 CO 0.10 -0.17 0.97 -1.17 -2.12 0.00 0.00 175.29 172.90 1mke s LEU 50 N 1.26 4.15 0.04 2.90 1.98 -1.26 -1.67 118.68 126.08 1mke s LEU 50 Ca 0.03 1.35 0.01 0.00 -2.89 0.00 0.00 54.13 52.63 1mke s LEU 50 Cb -0.14 -3.45 -0.03 0.00 0.66 0.00 0.00 46.19 43.24 1mke s LEU 50 CO -0.08 -0.54 -0.05 -0.31 -1.89 0.00 0.00 176.35 173.48 1mke s TYR 51 N 2.62 0.47 -0.04 5.38 1.51 -0.66 -2.27 117.35 124.36 1mke s TYR 51 Ca 0.43 -0.61 0.04 0.00 -1.01 0.00 0.00 57.07 55.92 1mke s TYR 51 Cb -0.16 -0.31 -0.00 0.00 -0.11 0.00 0.00 41.96 41.38 1mke s TYR 51 CO 0.11 -0.17 -0.17 0.00 -1.11 0.00 0.00 175.55 174.20 1mke s ALA 52 N -1.88 1.54 -0.92 3.71 0.00 -0.54 0.12 121.76 123.79 1mke s ALA 52 Ca -0.09 -0.71 -0.24 0.00 0.00 0.00 0.00 51.96 50.91 1mke s ALA 52 Cb -0.07 -0.50 -0.06 0.00 0.00 0.00 0.00 23.12 22.50 1mke s ALA 52 CO -0.02 0.29 1.98 0.00 0.00 0.00 0.00 175.76 178.01 1mke s ALA 53 N -0.01 1.60 0.37 0.00 0.00 -1.09 0.19 121.76 122.82 1mke s ALA 53 Ca -0.03 -1.52 -0.20 0.00 0.00 0.00 0.00 51.96 50.21 1mke s ALA 53 Cb -0.11 -4.57 -0.15 0.00 0.00 0.00 0.00 23.12 18.29 1mke s ALA 53 CO 0.02 -4.94 0.09 -3.47 0.00 0.00 0.00 175.76 167.46 1mke n ASP 54 N 14.36 -2.66 0.29 0.00 -0.08 0.09 -4.62 116.55 123.92 1mke n ASP 54 Ca 0.41 0.77 0.15 0.00 -1.51 0.00 0.00 54.79 54.61 1mke n ASP 54 Cb 0.47 -0.83 0.81 0.00 2.34 0.00 0.00 41.12 43.91 1mke n ASP 54 CO 0.00 0.00 0.00 0.08 0.12 0.00 0.00 177.20 177.40 1mke h ARG 55 N 0.32 0.00 -1.01 -0.67 0.11 -1.91 0.47 114.38 111.69 1mke h ARG 55 Ca -0.34 0.00 -0.47 0.00 0.10 0.00 0.00 59.98 59.26 1mke h ARG 55 Cb 1.36 0.00 -0.27 0.00 1.11 0.00 0.00 29.97 32.17 1mke h ARG 55 CO 0.44 0.00 0.60 0.09 0.10 0.00 0.00 179.97 181.20 1mke n ASN 56 N -2.71 4.07 -3.02 0.08 4.13 -1.26 -4.94 115.26 111.62 1mke n ASN 56 Ca -0.02 -3.44 -0.04 0.00 1.68 0.00 0.00 54.58 52.76 1mke n ASN 56 Cb 0.25 -0.82 0.00 0.00 -1.54 0.00 0.00 39.78 37.67 1mke n ASN 56 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1mke n MET 58 N 0.82 0.00 -1.32 0.00 2.00 -1.21 -4.89 117.12 112.52 1mke n MET 58 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 57.70 57.28 1mke n MET 58 Cb 0.32 0.00 -0.00 0.00 0.00 0.00 0.00 33.22 33.54 1mke n MET 58 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 175.97 176.88 1mke n TRP 59 N 0.00 -1.95 -3.84 2.03 7.02 -1.25 -0.73 117.44 118.72 1mke n TRP 59 Ca 0.00 0.61 -0.25 0.00 -1.02 0.00 0.00 57.50 56.84 1mke n TRP 59 Cb 0.00 -1.80 -0.17 0.00 -2.42 0.00 0.00 31.31 26.92 1mke n TRP 59 CO 0.00 0.00 0.00 -1.12 -2.02 0.00 0.00 177.69 174.55 1mke s SER 60 N -1.00 1.98 0.16 -0.99 0.01 0.49 -4.63 113.70 109.72 1mke s SER 60 Ca 0.60 -0.25 -0.32 0.00 1.31 0.00 0.00 55.95 57.30 1mke s SER 60 Cb -0.63 -0.65 -0.10 0.00 0.21 0.00 0.00 66.02 64.85 1mke s SER 60 CO 0.62 -0.17 1.59 -1.59 0.41 0.00 0.00 173.24 174.10 1mke s LYS 61 N 1.83 4.21 -0.14 12.44 0.00 -1.26 -1.47 119.74 135.35 1mke s LYS 61 Ca 0.04 2.38 -0.01 0.00 0.00 0.00 0.00 55.97 58.39 1mke s LYS 61 Cb -0.13 -3.18 -0.08 0.00 0.00 0.00 0.00 37.83 34.44 1mke s LYS 61 CO -0.07 -0.63 -0.13 1.17 0.00 0.00 0.00 175.35 175.69 1mke n LYS 62 N 4.08 0.33 0.00 1.78 0.00 -0.96 -4.97 118.16 118.42 1mke n LYS 62 Ca 0.14 0.09 0.00 0.00 0.00 0.00 0.00 58.31 58.54 1mke n LYS 62 Cb 0.38 -1.22 0.00 0.00 0.00 0.00 0.00 35.03 34.19 1mke n LYS 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1mke s SER 64 N 0.00 4.95 0.00 0.00 0.01 -1.26 -4.20 113.70 113.20 1mke s SER 64 Ca 0.00 -0.40 0.00 0.00 1.31 0.00 0.00 55.95 56.86 1mke s SER 64 Cb 0.00 -0.25 0.00 0.00 0.21 0.00 0.00 66.02 65.98 1mke s SER 64 CO 0.00 -1.40 0.00 0.61 0.41 0.00 0.00 173.24 172.86 1mke n GLY 65 N -2.43 -0.56 3.66 3.44 0.00 -1.08 -4.67 105.19 103.56 1mke n GLY 65 Ca 0.12 -0.72 -0.40 0.00 0.00 0.00 0.00 46.02 45.02 1mke n GLY 65 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1mke s VAL 66 N -3.72 5.02 0.06 1.61 1.01 0.24 -2.42 120.40 122.19 1mke s VAL 66 Ca 0.00 1.21 0.07 0.00 0.00 0.00 0.00 61.98 63.27 1mke s VAL 66 Cb 0.00 -3.96 -0.03 0.00 0.00 0.00 0.00 36.38 32.39 1mke s VAL 66 CO 0.00 0.11 -0.17 0.00 0.00 0.00 0.00 175.10 175.04 1mke s ALA 67 N 1.86 2.64 0.01 5.51 0.00 -1.16 -0.13 121.76 130.49 1mke s ALA 67 Ca 0.29 -1.22 -0.05 0.00 0.00 0.00 0.00 51.96 50.98 1mke s ALA 67 Cb -0.16 -0.74 -0.00 0.00 0.00 0.00 0.00 23.12 22.22 1mke s ALA 67 CO 0.11 0.58 0.10 0.00 0.00 0.00 0.00 175.76 176.54 1mke s LEU 69 N -1.34 4.79 -0.09 0.00 0.20 0.10 -3.79 118.68 118.55 1mke s LEU 69 Ca -0.14 -0.64 -0.01 0.00 0.69 0.00 0.00 54.13 54.03 1mke s LEU 69 Cb -0.08 -2.50 -0.03 0.00 -0.43 0.00 0.00 46.19 43.15 1mke s LEU 69 CO 0.01 -0.72 -0.03 -0.69 -0.29 0.00 0.00 176.35 174.63 1mke s VAL 70 N 2.46 4.03 -0.06 1.68 1.01 -0.63 0.37 120.40 129.26 1mke s VAL 70 Ca 0.16 -0.35 -0.02 0.00 0.00 0.00 0.00 61.98 61.77 1mke s VAL 70 Cb -0.17 -2.69 0.03 0.00 0.00 0.00 0.00 36.38 33.56 1mke s VAL 70 CO 0.15 0.59 0.04 -0.75 0.00 0.00 0.00 175.10 175.13 1mke s LYS 71 N -0.69 0.15 -0.66 2.72 2.36 -0.41 0.93 119.74 124.15 1mke s LYS 71 Ca 0.11 0.26 -0.22 0.00 -2.55 0.00 0.00 55.97 53.56 1mke s LYS 71 Cb -0.12 -0.75 0.08 0.00 -1.05 0.00 0.00 37.83 35.99 1mke s LYS 71 CO 0.02 -0.35 0.94 0.16 1.55 0.00 0.00 175.35 177.67 1mke s ASP 72 N 2.10 6.18 0.53 1.43 -4.77 -0.92 -2.31 116.67 118.91 1mke s ASP 72 Ca 0.05 -1.06 0.00 0.00 -3.30 0.00 0.00 52.55 48.23 1mke s ASP 72 Cb -0.12 -2.41 0.00 0.00 -1.09 0.00 0.00 42.92 39.30 1mke s ASP 72 CO -0.04 -1.40 0.00 0.59 0.70 0.00 0.00 175.17 175.02 1mke n ASN 73 N 7.54 -8.34 0.00 2.11 3.02 -1.26 -3.27 115.26 115.06 1mke n ASN 73 Ca -0.04 1.39 0.11 0.00 -0.03 0.00 0.00 54.58 56.01 1mke n ASN 73 Cb 0.45 -4.72 0.63 0.00 -0.61 0.00 0.00 39.78 35.53 1mke n ASN 73 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 1mke n PRO 74 N -1.38 0.52 -0.09 3.52 -0.04 -1.26 -3.37 135.00 132.90 1mke n PRO 74 Ca 0.00 0.04 -0.10 0.00 -0.04 0.00 0.00 63.50 63.40 1mke n PRO 74 Cb 0.13 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.06 1mke n PRO 74 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1mke n GLN 75 N -1.15 0.51 0.00 0.54 3.00 -1.26 -4.74 117.38 114.28 1mke n GLN 75 Ca 0.14 0.35 0.00 0.00 -0.01 0.00 0.00 57.00 57.48 1mke n GLN 75 Cb 0.13 -1.55 0.00 0.00 0.00 0.00 0.00 30.24 28.83 1mke n GLN 75 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.06 177.60 1mke n ARG 76 N -4.50 0.00 -3.54 -1.09 1.74 -1.23 -5.00 116.66 103.03 1mke n ARG 76 Ca -0.15 0.34 0.00 0.00 -0.77 0.00 0.00 57.85 57.27 1mke n ARG 76 Cb 0.46 -1.05 0.00 0.00 -1.02 0.00 0.00 32.46 30.86 1mke n ARG 76 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1mke n SER 77 N -0.96 0.00 -4.94 0.55 2.88 -1.20 -4.62 113.62 105.32 1mke n SER 77 Ca 0.00 0.00 -0.19 0.00 -1.33 0.00 0.00 58.87 57.35 1mke n SER 77 Cb 0.00 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.45 1mke n SER 77 CO 0.00 0.00 0.00 -0.31 -1.23 0.00 0.00 175.04 173.50 1mke s TYR 78 N -2.20 2.76 -0.15 0.66 1.51 -1.26 -2.17 117.35 116.50 1mke s TYR 78 Ca 0.00 -0.44 -0.14 0.00 -1.01 0.00 0.00 57.07 55.48 1mke s TYR 78 Cb 0.00 -2.27 0.04 0.00 -0.11 0.00 0.00 41.96 39.62 1mke s TYR 78 CO 0.00 -0.26 0.40 -0.06 -1.11 0.00 0.00 175.55 174.52 1mke s PHE 79 N -2.41 -0.46 -0.14 2.71 0.40 0.27 -3.06 117.98 115.29 1mke s PHE 79 Ca 0.51 1.10 0.02 0.00 -0.60 0.00 0.00 56.93 57.96 1mke s PHE 79 Cb -0.07 0.16 0.00 0.00 0.51 0.00 0.00 43.02 43.63 1mke s PHE 79 CO 0.30 -0.23 -0.20 -1.17 0.70 0.00 0.00 175.22 174.63 1mke s LEU 80 N 0.33 2.22 0.08 -0.37 2.96 0.08 -1.60 118.68 122.37 1mke s LEU 80 Ca -0.01 -0.56 0.02 0.00 -0.22 0.00 0.00 54.13 53.36 1mke s LEU 80 Cb -0.03 -1.48 -0.04 0.00 0.50 0.00 0.00 46.19 45.15 1mke s LEU 80 CO -0.01 0.10 -0.07 -0.13 -1.32 0.00 0.00 176.35 174.92 1mke s ARG 81 N 0.73 0.71 -0.02 1.98 1.81 -1.25 0.21 118.95 123.12 1mke s ARG 81 Ca -0.08 -1.14 0.03 0.00 -1.72 0.00 0.00 55.73 52.82 1mke s ARG 81 Cb -0.16 -0.19 -0.00 0.00 -0.45 0.00 0.00 34.95 34.15 1mke s ARG 81 CO 0.00 -0.01 -0.12 0.42 -0.68 0.00 0.00 175.30 174.91 1mke s ILE 82 N -2.94 1.02 0.07 1.52 1.01 0.13 -3.18 121.20 118.83 1mke s ILE 82 Ca 0.04 -0.52 0.09 0.00 0.00 0.00 0.00 60.65 60.27 1mke s ILE 82 Cb 0.01 -0.88 -0.03 0.00 0.01 0.00 0.00 42.46 41.57 1mke s ILE 82 CO -0.04 0.30 -0.24 0.72 0.00 0.00 0.00 174.94 175.68 1mke s PHE 83 N -0.04 2.11 0.75 3.97 -0.71 0.81 -0.97 117.98 123.90 1mke s PHE 83 Ca 0.00 -0.40 -0.11 0.00 -1.04 0.00 0.00 56.93 55.38 1mke s PHE 83 Cb -0.08 -1.23 0.04 0.00 -1.21 0.00 0.00 43.02 40.55 1mke s PHE 83 CO 0.00 0.17 1.08 0.34 -1.34 0.00 0.00 175.22 175.47 1mke s ASP 84 N -1.47 4.91 -0.00 1.98 -1.08 0.11 0.80 116.67 121.91 1mke s ASP 84 Ca 0.10 1.53 0.15 0.00 -0.52 0.00 0.00 52.55 53.81 1mke s ASP 84 Cb -0.10 -2.33 -0.17 0.00 -1.46 0.00 0.00 42.92 38.86 1mke s ASP 84 CO 0.03 -1.74 0.59 0.00 0.52 0.00 0.00 175.17 174.57 1mke n ILE 85 N -3.31 0.00 -0.06 4.11 3.06 -1.26 -2.92 119.36 118.98 1mke n ILE 85 Ca 0.07 -0.18 -0.09 0.00 -2.50 0.00 0.00 62.75 60.06 1mke n ILE 85 Cb 0.54 0.89 -0.05 0.00 0.54 0.00 0.00 39.64 41.56 1mke n ILE 85 CO 0.00 0.00 0.00 0.29 -2.50 0.00 0.00 176.55 174.34 1mke n LYS 86 N -1.44 0.28 0.02 9.51 5.02 -1.26 -4.59 118.16 125.70 1mke n LYS 86 Ca 0.02 0.08 0.11 0.00 -2.02 0.00 0.00 58.31 56.50 1mke n LYS 86 Cb 0.25 -1.16 0.05 0.00 -0.02 0.00 0.00 35.03 34.15 1mke n LYS 86 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1mke n ASP 87 N -3.00 0.65 -4.17 4.39 8.00 -1.26 -4.97 116.55 116.19 1mke n ASP 87 Ca -0.21 -0.36 -0.29 0.00 0.71 0.00 0.00 54.79 54.64 1mke n ASP 87 Cb 0.71 0.72 -0.07 0.00 -0.02 0.00 0.00 41.12 42.45 1mke n ASP 87 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1mke n GLY 88 N 1.42 -0.17 3.26 0.44 0.00 -1.15 -4.90 105.19 104.09 1mke n GLY 88 Ca 0.03 0.17 -0.15 0.00 0.00 0.00 0.00 46.02 46.07 1mke n GLY 88 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1mke s LYS 89 N -7.05 1.34 0.00 1.61 1.02 -1.26 -4.78 119.74 110.63 1mke s LYS 89 Ca 0.02 -1.73 -0.30 0.00 0.02 0.00 0.00 55.97 53.98 1mke s LYS 89 Cb -0.01 0.05 -0.06 0.00 -0.52 0.00 0.00 37.83 37.30 1mke s LYS 89 CO 0.95 -0.38 1.42 -0.51 -0.92 0.00 0.00 175.35 175.92 1mke s LEU 90 N -3.25 4.32 -0.01 3.17 2.01 -1.26 0.04 118.68 123.70 1mke s LEU 90 Ca 0.38 2.14 0.09 0.00 0.01 0.00 0.00 54.13 56.75 1mke s LEU 90 Cb 0.07 -3.56 -0.13 0.00 0.01 0.00 0.00 46.19 42.58 1mke s LEU 90 CO 0.14 -0.74 0.19 0.18 1.01 0.00 0.00 176.35 177.13 1mke n LEU 91 N 5.43 0.00 -3.57 1.79 4.77 -0.14 -4.91 117.00 120.37 1mke n LEU 91 Ca 0.13 -0.00 -0.15 0.00 -0.03 0.00 0.00 56.01 55.96 1mke n LEU 91 Cb 0.43 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.46 1mke n LEU 91 CO 0.59 0.00 0.48 0.86 -1.33 0.00 0.00 177.39 177.99 1mke s TRP 92 N -2.59 -0.67 -0.13 -1.77 -0.00 -1.21 -4.89 118.94 107.69 1mke s TRP 92 Ca -0.03 1.37 -0.08 0.00 -0.00 0.00 0.00 56.10 57.36 1mke s TRP 92 Cb 0.05 0.36 0.05 0.00 -0.00 0.00 0.00 33.47 33.93 1mke s TRP 92 CO 0.36 -0.48 0.31 -1.83 -0.00 0.00 0.00 176.95 175.31 1mke s GLU 93 N -0.53 0.30 -0.04 5.86 -1.05 -1.26 0.18 118.70 122.16 1mke s GLU 93 Ca -0.05 0.59 0.04 0.00 -0.15 0.00 0.00 54.97 55.39 1mke s GLU 93 Cb -0.02 -0.02 -0.00 0.00 -0.44 0.00 0.00 34.13 33.65 1mke s GLU 93 CO 0.05 -0.13 -0.14 -1.14 0.95 0.00 0.00 175.26 174.84 1mke s GLN 94 N 1.03 1.50 -1.08 -4.83 -0.44 0.56 -4.98 119.66 111.41 1mke s GLN 94 Ca -0.07 -0.51 -0.11 0.00 -2.50 0.00 0.00 55.36 52.17 1mke s GLN 94 Cb -0.08 -1.33 0.25 0.00 -1.64 0.00 0.00 33.01 30.21 1mke s GLN 94 CO -0.08 0.21 1.12 -1.21 0.50 0.00 0.00 175.29 175.83 1mke s GLU 95 N 0.07 4.08 0.01 1.67 2.02 -1.26 -0.74 118.70 124.55 1mke s GLU 95 Ca -0.03 -2.95 -0.39 0.00 0.02 0.00 0.00 54.97 51.62 1mke s GLU 95 Cb -0.10 -4.64 -0.20 0.00 0.10 0.00 0.00 34.13 29.29 1mke s GLU 95 CO 0.01 -1.36 1.02 1.28 0.02 0.00 0.00 175.26 176.24 1mke n LEU 96 N 3.52 -0.09 -4.43 1.80 4.77 -1.17 -4.94 117.00 116.46 1mke n LEU 96 Ca 0.25 1.15 -0.22 0.00 -0.03 0.00 0.00 56.01 57.15 1mke n LEU 96 Cb 0.41 -0.91 -0.10 0.00 -2.33 0.00 0.00 43.42 40.49 1mke n LEU 96 CO 0.47 -1.96 -0.43 -0.72 -1.33 0.00 0.00 177.39 173.43 1mke s TYR 97 N -0.06 2.05 0.65 -1.77 -0.85 -1.26 -4.39 117.35 111.72 1mke s TYR 97 Ca 0.88 -0.50 -0.17 0.00 -0.52 0.00 0.00 57.07 56.76 1mke s TYR 97 Cb -1.23 -1.00 -0.03 0.00 0.38 0.00 0.00 41.96 40.07 1mke s TYR 97 CO 0.56 0.50 0.90 -1.71 -1.52 0.00 0.00 175.55 174.28 1mke n ASN 98 N -0.56 0.39 -2.19 -0.18 2.85 -1.26 -3.20 115.26 111.11 1mke n ASN 98 Ca -0.06 0.73 -0.10 0.00 -0.11 0.00 0.00 54.58 55.04 1mke n ASN 98 Cb 0.61 -1.37 0.04 0.00 1.24 0.00 0.00 39.78 40.31 1mke n ASN 98 CO 0.00 0.00 0.00 -3.20 -2.11 0.00 0.00 177.26 171.95 1mke n ASN 99 N -0.98 -2.76 -4.67 1.20 2.85 -1.26 -4.90 115.26 104.74 1mke n ASN 99 Ca 0.13 -0.30 -0.35 0.00 -0.11 0.00 0.00 54.58 53.95 1mke n ASN 99 Cb 0.48 -2.85 -0.09 0.00 1.24 0.00 0.00 39.78 38.56 1mke n ASN 99 CO 0.00 0.00 0.00 0.12 -2.11 0.00 0.00 177.26 175.27 1mke s PHE 100 N -3.18 3.29 0.19 1.20 2.19 -1.19 -5.10 117.98 115.38 1mke s PHE 100 Ca 0.10 0.15 0.08 0.00 0.33 0.00 0.00 56.93 57.60 1mke s PHE 100 Cb -0.04 -2.05 -0.04 0.00 -1.31 0.00 0.00 43.02 39.58 1mke s PHE 100 CO 0.37 0.26 -0.17 0.54 1.83 0.00 0.00 175.22 178.05 1mke s VAL 101 N 0.11 1.81 -0.20 3.12 0.11 -1.26 -5.07 120.40 119.03 1mke s VAL 101 Ca 0.06 -2.06 0.01 0.00 -2.93 0.00 0.00 61.98 57.06 1mke s VAL 101 Cb -0.12 -1.94 0.03 0.00 -1.53 0.00 0.00 36.38 32.82 1mke s VAL 101 CO 0.00 -0.44 -0.18 -0.47 -3.33 0.00 0.00 175.10 170.69 1mke s TYR 102 N -2.44 2.86 -0.14 1.54 5.04 -1.26 -5.04 117.35 117.91 1mke s TYR 102 Ca 0.19 -1.77 -0.14 0.00 -2.44 0.00 0.00 57.07 52.91 1mke s TYR 102 Cb -0.04 -1.91 -0.05 0.00 0.35 0.00 0.00 41.96 40.31 1mke s TYR 102 CO 0.07 -0.82 0.30 1.21 -1.34 0.00 0.00 175.55 174.97 1mke s ASN 103 N 1.26 6.48 -0.42 4.32 3.84 -1.26 -5.00 114.94 124.17 1mke s ASN 103 Ca 0.02 0.57 0.09 0.00 0.21 0.00 0.00 52.86 53.75 1mke s ASN 103 Cb -0.14 -2.19 0.30 0.00 -0.55 0.00 0.00 41.25 38.67 1mke s ASN 103 CO -0.11 0.14 0.80 -1.54 -2.79 0.00 0.00 177.10 173.60 1mke n SER 104 N 3.26 -0.68 0.00 -4.21 3.41 -1.26 -2.09 113.62 112.05 1mke n SER 104 Ca -0.12 -3.16 0.12 0.00 -0.26 0.00 0.00 58.87 55.45 1mke n SER 104 Cb 0.52 0.38 0.70 0.00 -0.26 0.00 0.00 64.21 65.55 1mke n SER 104 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 1mke n PRO 105 N 0.77 0.70 -0.05 4.33 -0.04 -1.26 -2.92 135.00 136.53 1mke n PRO 105 Ca 0.17 0.01 -0.06 0.00 -0.04 0.00 0.00 63.50 63.58 1mke n PRO 105 Cb 0.64 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.54 1mke n PRO 105 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1mke n ARG 106 N -1.03 1.34 0.00 0.54 3.00 -1.26 -5.05 116.66 114.20 1mke n ARG 106 Ca 0.17 0.03 0.00 0.00 -0.01 0.00 0.00 57.85 58.04 1mke n ARG 106 Cb 0.09 -1.23 0.00 0.00 0.00 0.00 0.00 32.46 31.33 1mke n ARG 106 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1mke n GLY 107 N 2.73 2.95 0.89 -0.13 0.00 -1.15 -4.66 105.19 105.82 1mke n GLY 107 Ca -0.17 -0.78 0.09 0.00 0.00 0.00 0.00 46.02 45.15 1mke n GLY 107 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 1mke n TYR 108 N 0.00 0.47 -3.62 1.61 4.11 -1.26 -4.24 117.16 114.23 1mke n TYR 108 Ca 0.00 -0.33 -0.28 0.00 -0.00 0.00 0.00 57.90 57.29 1mke n TYR 108 Cb 0.00 -0.01 -0.16 0.00 -0.00 0.00 0.00 39.34 39.17 1mke n TYR 108 CO 0.00 0.00 0.00 0.12 -0.00 0.00 0.00 176.86 176.98 1mke s PHE 109 N -1.15 0.60 0.01 -3.48 2.19 -1.26 -3.47 117.98 111.42 1mke s PHE 109 Ca 0.30 -0.82 -0.02 0.00 0.33 0.00 0.00 56.93 56.72 1mke s PHE 109 Cb 0.17 -0.97 -0.04 0.00 -1.31 0.00 0.00 43.02 40.87 1mke s PHE 109 CO 0.23 -0.70 0.19 -1.01 1.83 0.00 0.00 175.22 175.77 1mke s HIS 110 N 2.00 3.54 -0.01 10.12 3.76 -1.05 -4.03 115.29 129.63 1mke s HIS 110 Ca 0.05 0.34 0.02 0.00 -0.15 0.00 0.00 55.06 55.32 1mke s HIS 110 Cb -0.16 -1.82 -0.03 0.00 1.11 0.00 0.00 32.58 31.67 1mke s HIS 110 CO -0.22 0.63 -0.03 0.95 -0.85 0.00 0.00 174.74 175.23 1mke s THR 111 N -1.37 3.94 0.22 1.30 -4.23 -0.89 -1.10 115.64 113.51 1mke s THR 111 Ca 0.29 -0.65 0.01 0.00 -1.18 0.00 0.00 61.69 60.16 1mke s THR 111 Cb -0.13 -2.73 -0.05 0.00 1.34 0.00 0.00 72.50 70.94 1mke s THR 111 CO 0.21 0.40 0.07 0.12 -0.54 0.00 0.00 174.62 174.88 1mke s PHE 112 N -1.03 1.36 -0.13 3.99 5.36 0.49 -4.04 117.98 123.98 1mke s PHE 112 Ca 0.18 -1.17 -0.01 0.00 -0.96 0.00 0.00 56.93 54.97 1mke s PHE 112 Cb -0.11 -0.77 0.03 0.00 -0.34 0.00 0.00 43.02 41.83 1mke s PHE 112 CO 0.08 -0.36 -0.05 0.00 -1.46 0.00 0.00 175.22 173.44 1mke s ALA 113 N -3.81 1.29 0.92 11.12 0.00 -1.26 -1.76 121.76 128.26 1mke s ALA 113 Ca 0.34 -0.62 0.00 0.00 0.00 0.00 0.00 51.96 51.68 1mke s ALA 113 Cb 0.07 -0.99 0.00 0.00 0.00 0.00 0.00 23.12 22.20 1mke s ALA 113 CO 0.10 -0.62 0.00 0.41 0.00 0.00 0.00 175.76 175.65 1mke n GLY 114 N 4.95 -0.55 0.25 0.00 0.00 0.37 -4.93 105.19 105.27 1mke n GLY 114 Ca -0.11 -1.67 -0.07 0.00 0.00 0.00 0.00 46.02 44.17 1mke n GLY 114 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1mke h ASP 115 N 0.00 -1.25 0.00 1.61 3.32 -2.01 -3.35 116.42 114.74 1mke h ASP 115 Ca 0.00 0.19 0.00 0.00 0.02 0.00 0.00 57.03 57.24 1mke h ASP 115 Cb 0.00 0.55 0.00 0.00 0.22 0.00 0.00 39.33 40.10 1mke h ASP 115 CO 0.00 -0.15 -0.26 1.07 -1.72 0.00 0.00 179.24 178.17 1mke n THR 116 N -4.32 0.00 -4.65 0.35 5.66 -1.26 -4.86 114.28 105.20 1mke n THR 116 Ca 0.01 0.00 -0.25 0.00 -3.05 0.00 0.00 64.05 60.76 1mke n THR 116 Cb 0.16 0.37 -0.16 0.00 -1.55 0.00 0.00 70.33 69.14 1mke n THR 116 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1mke s GLN 118 N 0.47 4.30 0.07 0.00 2.00 -1.26 -0.48 119.66 124.76 1mke s GLN 118 Ca -0.11 1.24 0.07 0.00 -2.00 0.00 0.00 55.36 54.55 1mke s GLN 118 Cb -0.14 -3.60 -0.03 0.00 0.80 0.00 0.00 33.01 30.04 1mke s GLN 118 CO 0.03 -0.47 -0.18 0.14 -0.50 0.00 0.00 175.29 174.32 1mke s VAL 119 N 2.61 1.45 0.36 1.34 -7.23 -0.72 -2.65 120.40 115.55 1mke s VAL 119 Ca 0.43 -1.29 0.09 0.00 -1.81 0.00 0.00 61.98 59.40 1mke s VAL 119 Cb -0.16 -1.31 -0.05 0.00 0.56 0.00 0.00 36.38 35.41 1mke s VAL 119 CO 0.11 -0.01 0.05 0.00 -0.31 0.00 0.00 175.10 174.93 1mke s ALA 120 N -1.02 3.28 -0.04 1.32 0.00 0.32 -0.38 121.76 125.24 1mke s ALA 120 Ca 0.04 -2.00 0.02 0.00 0.00 0.00 0.00 51.96 50.02 1mke s ALA 120 Cb -0.09 -0.36 0.01 0.00 0.00 0.00 0.00 23.12 22.68 1mke s ALA 120 CO 0.03 0.01 -0.09 -0.48 0.00 0.00 0.00 175.76 175.23 1mke s LEU 121 N -3.75 1.63 -0.18 0.00 2.34 -0.26 -1.66 118.68 116.80 1mke s LEU 121 Ca 0.36 -0.20 0.01 0.00 0.06 0.00 0.00 54.13 54.36 1mke s LEU 121 Cb 0.01 -0.59 0.03 0.00 -0.56 0.00 0.00 46.19 45.08 1mke s LEU 121 CO 0.20 0.03 -0.15 0.20 -1.06 0.00 0.00 176.35 175.56 1mke s ASN 122 N 0.50 3.20 0.66 1.48 0.02 -0.67 -2.53 114.94 117.59 1mke s ASN 122 Ca -0.08 -0.73 -0.12 0.00 -1.02 0.00 0.00 52.86 50.91 1mke s ASN 122 Cb -0.12 -1.35 -0.01 0.00 0.02 0.00 0.00 41.25 39.79 1mke s ASN 122 CO 0.01 -0.07 1.05 -0.36 0.02 0.00 0.00 177.10 177.76 1mke s PHE 123 N 1.35 3.22 0.09 2.20 0.08 -1.23 0.20 117.98 123.89 1mke s PHE 123 Ca 0.02 1.41 -0.15 0.00 0.12 0.00 0.00 56.93 58.33 1mke s PHE 123 Cb -0.14 -2.86 -0.14 0.00 -0.57 0.00 0.00 43.02 39.31 1mke s PHE 123 CO -0.10 -1.06 1.32 0.00 -0.10 0.00 0.00 175.22 175.27 1mke h ALA 124 N -0.42 0.32 -2.15 5.36 0.00 0.83 -3.46 119.26 119.75 1mke h ALA 124 Ca -0.44 -0.51 -0.59 0.00 0.00 0.00 0.00 54.91 53.37 1mke h ALA 124 Cb 1.21 -0.04 -0.12 0.00 0.00 0.00 0.00 17.79 18.83 1mke h ALA 124 CO 0.58 0.53 -0.70 -0.80 0.00 0.00 0.00 179.25 178.86 1mke s ASN 125 N -6.81 3.97 -0.09 0.00 0.01 -1.26 -5.06 114.94 105.70 1mke s ASN 125 Ca -0.12 -0.92 -0.25 0.00 -0.71 0.00 0.00 52.86 50.86 1mke s ASN 125 Cb 0.08 -0.50 -0.21 0.00 0.41 0.00 0.00 41.25 41.03 1mke s ASN 125 CO 0.86 -0.03 0.89 -0.08 -1.51 0.00 0.00 177.10 177.23 1mke h GLU 126 N 2.07 -0.04 -0.40 -0.60 4.81 -1.94 -3.10 114.58 115.39 1mke h GLU 126 Ca -0.42 0.00 0.08 0.00 -0.13 0.00 0.00 59.36 58.89 1mke h GLU 126 Cb 1.25 0.01 -0.07 0.00 0.63 0.00 0.00 28.75 30.57 1mke h GLU 126 CO 0.62 0.66 -0.05 1.49 -0.73 0.00 0.00 179.01 181.00 1mke h GLU 127 N -0.83 0.05 -0.45 1.92 4.22 -1.97 0.33 114.58 117.86 1mke h GLU 127 Ca -0.00 -0.00 0.13 0.00 0.08 0.00 0.00 59.36 59.56 1mke h GLU 127 Cb 0.71 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.94 1mke h GLU 127 CO 0.01 0.03 0.36 0.93 -2.18 0.00 0.00 179.01 178.16 1mke h GLU 128 N 0.05 0.00 0.14 1.92 5.08 -1.99 0.40 114.58 120.18 1mke h GLU 128 Ca 0.19 0.00 -0.30 0.00 -1.00 0.00 0.00 59.36 58.26 1mke h GLU 128 Cb 0.29 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.56 1mke h GLU 128 CO -0.37 0.00 -1.28 0.00 -1.00 0.00 0.00 179.01 176.37 1mke h ALA 129 N 1.70 0.01 -0.24 3.43 0.00 -0.38 -1.66 119.26 122.11 1mke h ALA 129 Ca 0.21 -0.81 -0.03 0.00 0.00 0.00 0.00 54.91 54.28 1mke h ALA 129 Cb 0.93 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 1mke h ALA 129 CO -0.00 0.76 0.02 0.87 0.00 0.00 0.00 179.25 180.89 1mke h LYS 130 N 0.20 0.41 0.00 0.00 6.56 0.17 -2.15 116.57 121.76 1mke h LYS 130 Ca -0.18 -0.12 -0.05 0.00 -1.06 0.00 0.00 60.65 59.23 1mke h LYS 130 Cb 1.96 -0.04 -0.01 0.00 -0.57 0.00 0.00 32.23 33.57 1mke h LYS 130 CO 0.23 0.57 -0.25 1.57 -2.06 0.00 0.00 179.45 179.51 1mke h LYS 131 N 0.20 0.00 0.58 3.15 5.09 -0.47 -1.34 116.57 123.79 1mke h LYS 131 Ca 0.07 0.00 -0.03 0.00 0.09 0.00 0.00 60.65 60.78 1mke h LYS 131 Cb 0.37 0.00 0.01 0.00 0.10 0.00 0.00 32.23 32.71 1mke h LYS 131 CO 0.01 0.25 -0.28 0.35 -2.09 0.00 0.00 179.45 177.69 1mke h PHE 132 N 0.00 -0.73 -0.32 0.07 3.57 -0.76 0.30 116.94 119.07 1mke h PHE 132 Ca -0.00 -0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.41 1mke h PHE 132 Cb 0.56 0.24 -0.02 0.00 2.79 0.00 0.00 35.95 39.52 1mke h PHE 132 CO 0.00 -0.41 -0.09 -0.09 -2.23 0.00 0.00 178.31 175.49 1mke h ARG 133 N -0.92 0.53 -0.56 1.11 2.43 -1.31 -0.79 114.38 114.87 1mke h ARG 133 Ca -0.08 -0.14 -0.06 0.00 -0.81 0.00 0.00 59.98 58.89 1mke h ARG 133 Cb 0.65 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.11 1mke h ARG 133 CO 0.13 0.62 0.12 -0.22 -1.51 0.00 0.00 179.97 179.11 1mke h LYS 134 N 0.49 0.90 -0.02 0.20 3.11 -1.11 0.66 116.57 120.80 1mke h LYS 134 Ca 0.09 -0.23 -0.00 0.00 -2.81 0.00 0.00 60.65 57.71 1mke h LYS 134 Cb 0.46 -0.11 -0.00 0.00 -1.00 0.00 0.00 32.23 31.57 1mke h LYS 134 CO 0.02 0.85 0.01 0.00 -2.81 0.00 0.00 179.45 177.52 1mke h ALA 135 N 1.01 0.03 0.15 5.00 0.00 0.06 0.29 119.26 125.80 1mke h ALA 135 Ca 0.17 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 54.99 1mke h ALA 135 Cb 0.37 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.11 1mke h ALA 135 CO 0.01 -0.36 -0.33 0.28 0.00 0.00 0.00 179.25 178.85 1mke h VAL 136 N -0.18 0.30 -0.43 0.00 2.07 -0.99 0.37 116.25 117.40 1mke h VAL 136 Ca 0.01 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.58 1mke h VAL 136 Cb 0.22 0.30 -0.05 0.00 -1.52 0.00 0.00 31.29 30.24 1mke h VAL 136 CO -0.00 0.00 0.14 0.71 0.02 0.00 0.00 177.57 178.44 1mke h THR 137 N -0.58 0.85 -0.81 2.57 1.35 -0.80 0.90 112.91 116.39 1mke h THR 137 Ca 0.02 -0.10 0.08 0.00 -0.55 0.00 0.00 66.41 65.87 1mke h THR 137 Cb 0.59 0.53 -0.05 0.00 -1.73 0.00 0.00 68.15 67.49 1mke h THR 137 CO -0.18 0.05 0.53 0.44 -0.25 0.00 0.00 175.52 176.11 1mke h ASP 138 N 0.30 0.72 -0.03 5.36 3.32 0.23 1.47 116.42 127.78 1mke h ASP 138 Ca 0.20 0.01 -0.08 0.00 0.02 0.00 0.00 57.03 57.18 1mke h ASP 138 Cb 0.20 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.62 1mke h ASP 138 CO -0.22 0.44 -0.29 -0.07 -1.72 0.00 0.00 179.24 177.38 1mke h LEU 139 N 0.80 0.31 -1.34 1.55 4.07 0.16 -1.77 115.31 119.10 1mke h LEU 139 Ca 0.36 -0.70 -0.03 0.00 0.08 0.00 0.00 57.88 57.60 1mke h LEU 139 Cb 0.36 -0.09 -0.02 0.00 1.08 0.00 0.00 40.66 41.99 1mke h LEU 139 CO -0.14 0.97 0.14 -0.07 -1.08 0.00 0.00 178.44 178.25 1mke h LEU 140 N -0.31 0.53 -0.16 1.67 4.07 0.17 0.44 115.31 121.72 1mke h LEU 140 Ca -0.03 -0.06 -0.03 0.00 0.08 0.00 0.00 57.88 57.84 1mke h LEU 140 Cb 0.98 -0.14 -0.01 0.00 1.08 0.00 0.00 40.66 42.58 1mke h LEU 140 CO 0.06 0.51 -0.02 1.23 -1.08 0.00 0.00 178.44 179.13 1mke h GLY 141 N 0.77 0.33 0.89 0.83 0.00 0.20 -3.20 103.07 102.89 1mke h GLY 141 Ca 0.14 -0.26 -0.08 0.00 0.00 0.00 0.00 47.33 47.13 1mke h GLY 141 CO -0.01 0.24 -0.14 3.21 0.00 0.00 0.00 176.54 179.83 1mke h ARG 142 N 0.02 0.58 -6.28 4.80 3.08 -0.91 -3.44 114.38 112.23 1mke h ARG 142 Ca 0.04 -0.26 -0.65 0.00 0.07 0.00 0.00 59.98 59.18 1mke h ARG 142 Cb 0.44 -0.01 0.09 0.00 0.08 0.00 0.00 29.97 30.56 1mke h ARG 142 CO 0.01 0.83 0.08 0.54 -1.07 0.00 0.00 179.97 180.36 1mke n ARG 143 N -4.43 0.91 0.00 0.04 5.12 0.15 -5.10 116.66 113.36 1mke n ARG 143 Ca -0.04 0.32 0.00 0.00 -1.93 0.00 0.00 57.85 56.21 1mke n ARG 143 Cb 0.37 -1.70 0.00 0.00 -1.16 0.00 0.00 32.46 29.97 1mke n ARG 143 CO 0.00 0.00 0.00 0.94 -1.93 0.00 0.00 177.63 176.64