#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k6y n SER 2 N 0.00 0.00 -2.33 1.61 2.88 -1.26 -5.17 113.62 109.35 2k6y n SER 2 Ca 0.00 0.00 -0.03 0.00 -1.33 0.00 0.00 58.87 57.51 2k6y n SER 2 Cb 0.00 0.00 0.01 0.00 -0.75 0.00 0.00 64.21 63.47 2k6y n SER 2 CO 0.00 0.00 0.00 0.49 -1.23 0.00 0.00 175.04 174.30 2k6y n PHE 3 N 2.85 -3.14 -3.06 0.66 3.72 -1.26 -5.04 117.46 112.19 2k6y n PHE 3 Ca 0.00 -0.23 -0.45 0.00 -0.05 0.00 0.00 57.45 56.72 2k6y n PHE 3 Cb 0.00 -0.08 -0.02 0.00 -0.94 0.00 0.00 39.48 38.45 2k6y n PHE 3 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 2k6y s THR 4 N 0.17 5.12 -0.64 4.37 -4.23 -1.26 -4.86 115.64 114.30 2k6y s THR 4 Ca 0.08 -2.22 -0.28 0.00 -1.18 0.00 0.00 61.69 58.10 2k6y s THR 4 Cb -0.01 -4.73 0.02 0.00 1.34 0.00 0.00 72.50 69.13 2k6y s THR 4 CO 0.05 -1.41 1.31 -1.61 -0.54 0.00 0.00 174.62 172.43 2k6y s GLU 5 N 1.48 3.29 0.29 3.99 0.41 -1.24 -4.74 118.70 122.19 2k6y s GLU 5 Ca 0.32 0.12 0.02 0.00 -0.41 0.00 0.00 54.97 55.02 2k6y s GLU 5 Cb -0.06 -4.12 -0.03 0.00 -1.78 0.00 0.00 34.13 28.14 2k6y s GLU 5 CO -0.07 -1.98 0.28 0.20 -0.49 0.00 0.00 175.26 173.19 2k6y s GLY 6 N 3.86 1.83 0.17 -1.39 0.00 -1.26 -0.14 107.32 110.39 2k6y s GLY 6 Ca 0.43 -1.81 -0.18 0.00 0.00 0.00 0.00 44.72 43.16 2k6y s GLY 6 CO 0.21 -1.33 0.50 0.66 0.00 0.00 0.00 173.10 173.14 2k6y s TRP 7 N -3.63 -0.21 -0.13 1.90 -2.14 -1.03 -4.67 118.94 109.04 2k6y s TRP 7 Ca 0.38 -0.11 -0.01 0.00 2.66 0.00 0.00 56.10 59.02 2k6y s TRP 7 Cb 0.03 0.38 0.03 0.00 -3.10 0.00 0.00 33.47 30.82 2k6y s TRP 7 CO 0.21 -0.85 -0.04 0.08 -2.66 0.00 0.00 176.95 173.69 2k6y s VAL 8 N -3.84 0.86 -0.72 -0.66 1.01 -0.95 -2.54 120.40 113.56 2k6y s VAL 8 Ca 0.06 -0.32 -0.18 0.00 0.00 0.00 0.00 61.98 61.54 2k6y s VAL 8 Cb -0.00 -1.00 0.13 0.00 0.00 0.00 0.00 36.38 35.51 2k6y s VAL 8 CO -0.07 0.22 0.82 -0.60 0.00 0.00 0.00 175.10 175.48 2k6y s ARG 9 N 1.76 3.29 0.50 2.72 6.06 -0.74 -0.66 118.95 131.88 2k6y s ARG 9 Ca 0.03 -1.65 -0.23 0.00 -2.50 0.00 0.00 55.73 51.38 2k6y s ARG 9 Cb -0.14 -4.45 -0.06 0.00 0.06 0.00 0.00 34.95 30.36 2k6y s ARG 9 CO -0.07 -1.55 1.30 0.12 -2.50 0.00 0.00 175.30 172.59 2k6y s PHE 10 N 2.19 2.52 0.00 5.12 5.36 0.34 -3.07 117.98 130.44 2k6y s PHE 10 Ca 0.18 1.42 -0.04 0.00 -0.96 0.00 0.00 56.93 57.53 2k6y s PHE 10 Cb -0.17 -3.66 -0.00 0.00 -0.34 0.00 0.00 43.02 38.85 2k6y s PHE 10 CO -0.01 -2.40 0.07 0.45 -1.46 0.00 0.00 175.22 171.87 2k6y s SER 11 N -1.04 0.08 0.00 6.13 0.15 -1.26 -3.88 113.70 113.88 2k6y s SER 11 Ca 0.67 -0.24 -0.03 0.00 0.70 0.00 0.00 55.95 57.05 2k6y s SER 11 Cb -0.37 0.16 -0.15 0.00 -1.71 0.00 0.00 66.02 63.96 2k6y s SER 11 CO 0.44 -0.28 2.41 -0.81 1.20 0.00 0.00 173.24 176.20 2k6y n PRO 12 N 1.81 1.24 -0.01 5.44 -0.04 -1.26 -4.83 135.00 137.35 2k6y n PRO 12 Ca -0.21 -0.56 0.00 0.00 -0.04 0.00 0.00 63.50 62.69 2k6y n PRO 12 Cb 0.56 -1.72 -0.00 0.00 -0.04 0.00 0.00 33.50 32.30 2k6y n PRO 12 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2k6y n GLY 13 N 2.49 -2.14 0.27 0.55 0.00 -1.26 -4.95 105.19 100.15 2k6y n GLY 13 Ca 0.24 -1.45 0.16 0.00 0.00 0.00 0.00 46.02 44.97 2k6y n GLY 13 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2k6y h PRO 14 N 0.00 0.00 -5.76 1.61 0.13 -1.96 -3.45 132.00 122.57 2k6y h PRO 14 Ca 0.00 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.55 2k6y h PRO 14 Cb 0.01 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 31.00 2k6y h PRO 14 CO 0.00 0.06 -0.67 0.54 -0.23 0.00 0.00 178.00 177.70 2k6y s ASN 15 N -5.78 3.44 0.35 1.44 2.20 -1.26 -3.27 114.94 112.06 2k6y s ASN 15 Ca -0.00 -1.22 -0.09 0.00 -0.94 0.00 0.00 52.86 50.60 2k6y s ASN 15 Cb 0.10 -0.30 0.04 0.00 -2.00 0.00 0.00 41.25 39.09 2k6y s ASN 15 CO 0.55 -0.29 0.62 0.00 -2.94 0.00 0.00 177.10 175.05 2k6y n ALA 16 N -0.75 -1.10 -2.50 3.54 0.00 -0.69 -4.53 120.51 114.48 2k6y n ALA 16 Ca -0.05 -1.33 -0.10 0.00 0.00 0.00 0.00 53.44 51.97 2k6y n ALA 16 Cb 0.64 1.06 -0.11 0.00 0.00 0.00 0.00 19.45 21.05 2k6y n ALA 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2k6y s ALA 17 N -2.30 0.54 0.04 0.00 0.00 -1.18 -0.94 121.76 117.94 2k6y s ALA 17 Ca 0.20 -1.00 -0.03 0.00 0.00 0.00 0.00 51.96 51.13 2k6y s ALA 17 Cb -0.03 0.16 -0.02 0.00 0.00 0.00 0.00 23.12 23.23 2k6y s ALA 17 CO 0.15 -0.21 0.04 0.00 0.00 0.00 0.00 175.76 175.74 2k6y s ALA 18 N -2.69 0.11 0.10 0.00 0.00 -0.69 -1.80 121.76 116.80 2k6y s ALA 18 Ca -0.01 -0.73 -0.20 0.00 0.00 0.00 0.00 51.96 51.02 2k6y s ALA 18 Cb -0.01 0.25 0.05 0.00 0.00 0.00 0.00 23.12 23.41 2k6y s ALA 18 CO -0.04 -0.31 0.49 0.71 0.00 0.00 0.00 175.76 176.61 2k6y s TYR 19 N -2.78 -0.36 0.00 0.00 2.02 -1.05 -1.18 117.35 113.98 2k6y s TYR 19 Ca -0.04 0.21 0.00 0.00 -0.37 0.00 0.00 57.07 56.88 2k6y s TYR 19 Cb -0.00 0.36 0.00 0.00 -0.40 0.00 0.00 41.96 41.92 2k6y s TYR 19 CO -0.06 -0.71 0.00 1.47 -1.57 0.00 0.00 175.55 174.68 2k6y n LEU 20 N -0.01 0.00 -4.75 -1.29 -0.00 -1.21 -2.45 117.00 107.29 2k6y n LEU 20 Ca -0.17 0.00 -0.40 0.00 -0.00 0.00 0.00 56.01 55.44 2k6y n LEU 20 Cb 0.63 0.00 -0.05 0.00 -0.00 0.00 0.00 43.42 44.00 2k6y n LEU 20 CO 0.17 0.00 0.45 -0.89 -0.00 0.00 0.00 177.39 177.12 2k6y s THR 21 N -1.91 4.71 0.06 1.47 2.01 0.80 -0.75 115.64 122.03 2k6y s THR 21 Ca 0.00 1.61 0.02 0.00 0.31 0.00 0.00 61.69 63.63 2k6y s THR 21 Cb 0.00 -4.10 -0.03 0.00 0.01 0.00 0.00 72.50 68.38 2k6y s THR 21 CO 0.00 0.38 -0.07 -0.22 -0.69 0.00 0.00 174.62 174.02 2k6y s LEU 22 N -0.16 2.34 -0.03 4.42 2.96 -0.61 -3.62 118.68 123.97 2k6y s LEU 22 Ca 0.38 -0.69 -0.02 0.00 -0.22 0.00 0.00 54.13 53.58 2k6y s LEU 22 Cb -0.21 -0.11 0.02 0.00 0.50 0.00 0.00 46.19 46.39 2k6y s LEU 22 CO 0.23 -0.30 0.07 -1.83 -1.32 0.00 0.00 176.35 173.20 2k6y s GLU 23 N -2.29 0.04 -0.37 1.98 -1.05 -1.26 -0.30 118.70 115.44 2k6y s GLU 23 Ca -0.04 0.19 -0.28 0.00 -0.15 0.00 0.00 54.97 54.69 2k6y s GLU 23 Cb -0.05 -0.11 0.02 0.00 -0.44 0.00 0.00 34.13 33.54 2k6y s GLU 23 CO -0.01 -0.10 1.07 1.21 0.95 0.00 0.00 175.26 178.37 2k6y s ASN 24 N 0.67 6.81 0.23 0.83 2.47 -0.61 -4.94 114.94 120.39 2k6y s ASN 24 Ca -0.05 0.81 0.26 0.00 0.42 0.00 0.00 52.86 54.30 2k6y s ASN 24 Cb -0.07 -2.53 0.72 0.00 -1.45 0.00 0.00 41.25 37.92 2k6y s ASN 24 CO -0.02 -0.97 1.72 1.55 -3.72 0.00 0.00 177.10 175.65 2k6y h PRO 25 N 8.46 0.00 -7.42 0.43 0.13 -1.92 -0.55 132.00 131.13 2k6y h PRO 25 Ca -0.22 0.00 -0.48 0.00 -0.87 0.00 0.00 66.00 64.43 2k6y h PRO 25 Cb 1.06 0.00 0.12 0.00 0.13 0.00 0.00 31.00 32.31 2k6y h PRO 25 CO 1.05 0.00 0.32 0.20 -0.23 0.00 0.00 178.00 179.34 2k6y s GLY 26 N -3.65 1.61 0.36 1.56 0.00 -1.26 -4.61 107.32 101.32 2k6y s GLY 26 Ca 0.10 -0.27 0.26 0.00 0.00 0.00 0.00 44.72 44.80 2k6y s GLY 26 CO 0.61 0.19 1.73 1.29 0.00 0.00 0.00 173.10 176.92 2k6y h ASP 27 N -1.22 0.00 -3.80 1.64 2.03 -1.94 -2.93 116.42 110.20 2k6y h ASP 27 Ca -0.48 0.00 -0.49 0.00 -0.73 0.00 0.00 57.03 55.33 2k6y h ASP 27 Cb 1.28 0.00 0.02 0.00 -0.83 0.00 0.00 39.33 39.80 2k6y h ASP 27 CO 0.60 0.00 0.18 -0.76 -1.03 0.00 0.00 179.24 178.22 2k6y s LEU 28 N -5.44 3.72 0.41 0.15 1.43 -1.26 -4.70 118.68 112.98 2k6y s LEU 28 Ca 0.07 1.18 -0.10 0.00 -1.03 0.00 0.00 54.13 54.26 2k6y s LEU 28 Cb 0.09 -4.10 -0.06 0.00 0.03 0.00 0.00 46.19 42.15 2k6y s LEU 28 CO 0.60 -0.49 0.76 -2.16 0.23 0.00 0.00 176.35 175.29 2k6y s PRO 29 N -4.14 3.75 0.05 1.29 0.04 -1.26 -3.81 135.00 130.92 2k6y s PRO 29 Ca 0.52 0.42 0.07 0.00 0.04 0.00 0.00 61.00 62.05 2k6y s PRO 29 Cb -0.10 -2.40 -0.03 0.00 0.04 0.00 0.00 34.50 32.01 2k6y s PRO 29 CO 0.35 -0.04 -0.20 -0.51 0.04 0.00 0.00 177.00 176.65 2k6y s LEU 30 N -3.92 2.19 -0.20 -3.56 1.02 0.03 -4.99 118.68 109.25 2k6y s LEU 30 Ca 0.50 -0.53 -0.04 0.00 0.02 0.00 0.00 54.13 54.08 2k6y s LEU 30 Cb -0.10 -0.89 0.08 0.00 0.02 0.00 0.00 46.19 45.29 2k6y s LEU 30 CO 0.33 0.12 0.16 -0.60 0.02 0.00 0.00 176.35 176.37 2k6y s ARG 31 N -1.27 0.13 -0.35 1.70 3.52 -1.26 -0.30 118.95 121.12 2k6y s ARG 31 Ca 0.06 0.01 -0.18 0.00 -0.13 0.00 0.00 55.73 55.49 2k6y s ARG 31 Cb -0.09 -1.48 -0.00 0.00 -1.56 0.00 0.00 34.95 31.82 2k6y s ARG 31 CO 0.02 -0.70 0.49 -1.17 -0.81 0.00 0.00 175.30 173.13 2k6y s LEU 32 N 2.22 4.39 -0.00 -0.88 2.96 0.47 -0.84 118.68 126.99 2k6y s LEU 32 Ca 0.05 -0.09 0.15 0.00 -0.22 0.00 0.00 54.13 54.01 2k6y s LEU 32 Cb -0.16 -2.54 -0.17 0.00 0.50 0.00 0.00 46.19 43.83 2k6y s LEU 32 CO -0.13 -0.46 0.57 1.33 -1.32 0.00 0.00 176.35 176.34 2k6y n VAL 33 N 5.40 0.00 -3.21 1.68 0.24 0.25 -0.69 118.33 122.00 2k6y n VAL 33 Ca -0.06 -0.19 0.00 0.00 -2.04 0.00 0.00 64.34 62.06 2k6y n VAL 33 Cb 0.49 0.86 0.00 0.00 -1.47 0.00 0.00 33.84 33.72 2k6y n VAL 33 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2k6y n GLY 34 N 1.39 -1.10 3.33 7.63 0.00 -1.18 -4.77 105.19 110.50 2k6y n GLY 34 Ca 0.02 -0.85 -0.14 0.00 0.00 0.00 0.00 46.02 45.05 2k6y n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k6y s ALA 35 N -1.00 -1.08 -0.14 4.61 0.00 -1.26 -0.60 121.76 122.30 2k6y s ALA 35 Ca 0.00 0.51 -0.02 0.00 0.00 0.00 0.00 51.96 52.46 2k6y s ALA 35 Cb 0.00 0.19 -0.02 0.00 0.00 0.00 0.00 23.12 23.28 2k6y s ALA 35 CO 0.00 -0.37 -0.07 0.50 0.00 0.00 0.00 175.76 175.82 2k6y s ARG 36 N -1.82 3.46 0.02 0.00 3.52 0.28 -4.75 118.95 119.66 2k6y s ARG 36 Ca -0.09 -0.58 0.00 0.00 -0.13 0.00 0.00 55.73 54.93 2k6y s ARG 36 Cb -0.02 -2.78 -0.02 0.00 -1.56 0.00 0.00 34.95 30.57 2k6y s ARG 36 CO 0.02 0.29 -0.04 -0.08 -0.81 0.00 0.00 175.30 174.68 2k6y s THR 37 N 0.21 0.17 -0.04 4.11 -1.32 -1.26 -0.45 115.64 117.06 2k6y s THR 37 Ca -0.04 -0.90 0.28 0.00 -1.21 0.00 0.00 61.69 59.81 2k6y s THR 37 Cb -0.14 -0.31 0.32 0.00 -1.51 0.00 0.00 72.50 70.87 2k6y s THR 37 CO 0.04 -0.46 1.82 1.55 -2.21 0.00 0.00 174.62 175.36 2k6y h PRO 38 N 4.69 0.00 -0.40 7.08 0.13 -1.98 -3.30 132.00 138.22 2k6y h PRO 38 Ca -0.32 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.81 2k6y h PRO 38 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2k6y h PRO 38 CO 0.41 0.08 0.00 1.33 -0.23 0.00 0.00 178.00 179.59 2k6y n VAL 39 N -3.17 0.53 -3.92 1.56 0.24 -1.26 -4.28 118.33 108.03 2k6y n VAL 39 Ca 0.01 -0.54 -0.09 0.00 -2.04 0.00 0.00 64.34 61.69 2k6y n VAL 39 Cb 0.41 0.28 -0.05 0.00 -1.47 0.00 0.00 33.84 33.02 2k6y n VAL 39 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2k6y s ALA 40 N -1.47 -0.41 0.00 2.33 0.00 -1.24 -4.15 121.76 116.81 2k6y s ALA 40 Ca 0.28 -0.69 0.00 0.00 0.00 0.00 0.00 51.96 51.55 2k6y s ALA 40 Cb 0.14 0.96 0.00 0.00 0.00 0.00 0.00 23.12 24.23 2k6y s ALA 40 CO 0.19 -0.81 0.00 -1.91 0.00 0.00 0.00 175.76 173.23 2k6y n GLU 41 N -0.34 0.00 -2.35 0.00 4.07 0.11 -4.69 120.64 117.44 2k6y n GLU 41 Ca -0.05 0.00 -0.42 0.00 -0.06 0.00 0.00 57.16 56.64 2k6y n GLU 41 Cb 0.62 -0.09 -0.03 0.00 -0.06 0.00 0.00 31.44 31.89 2k6y n GLU 41 CO 0.00 0.00 0.00 0.50 -0.06 0.00 0.00 177.13 177.57 2k6y s ARG 42 N -0.28 3.28 0.30 5.31 3.52 0.22 -4.92 118.95 126.37 2k6y s ARG 42 Ca 0.00 0.53 -0.27 0.00 -0.13 0.00 0.00 55.73 55.86 2k6y s ARG 42 Cb 0.00 -4.14 -0.10 0.00 -1.56 0.00 0.00 34.95 29.16 2k6y s ARG 42 CO 0.00 -1.96 0.95 0.54 -0.81 0.00 0.00 175.30 174.02 2k6y s VAL 43 N 6.23 4.12 -0.02 7.11 0.11 -1.26 -0.79 120.40 135.90 2k6y s VAL 43 Ca 0.55 1.86 0.01 0.00 -2.93 0.00 0.00 61.98 61.47 2k6y s VAL 43 Cb -0.11 -4.08 0.01 0.00 -1.53 0.00 0.00 36.38 30.67 2k6y s VAL 43 CO 0.25 0.24 -0.03 -1.61 -3.33 0.00 0.00 175.10 170.62 2k6y s GLU 44 N -1.83 0.47 -0.16 1.54 2.02 -0.36 -5.00 118.70 115.39 2k6y s GLU 44 Ca 0.48 -0.08 -0.23 0.00 0.02 0.00 0.00 54.97 55.16 2k6y s GLU 44 Cb -0.21 -0.52 -0.02 0.00 0.10 0.00 0.00 34.13 33.47 2k6y s GLU 44 CO 0.27 -0.02 0.74 -1.17 0.02 0.00 0.00 175.26 175.10 2k6y s LEU 45 N 0.50 4.19 0.34 1.80 0.20 -1.26 -0.45 118.68 123.99 2k6y s LEU 45 Ca -0.06 1.06 0.09 0.00 0.69 0.00 0.00 54.13 55.92 2k6y s LEU 45 Cb -0.09 -3.09 -0.05 0.00 -0.43 0.00 0.00 46.19 42.53 2k6y s LEU 45 CO -0.01 -0.30 0.01 -1.00 -0.29 0.00 0.00 176.35 174.76 2k6y s HIS 46 N 1.81 2.54 0.25 5.38 3.76 0.43 -0.76 115.29 128.70 2k6y s HIS 46 Ca 0.35 -0.43 0.01 0.00 -0.15 0.00 0.00 55.06 54.84 2k6y s HIS 46 Cb -0.17 -1.48 0.01 0.00 1.11 0.00 0.00 32.58 32.06 2k6y s HIS 46 CO 0.13 0.49 0.10 -0.85 -0.85 0.00 0.00 174.74 173.75 2k6y n GLU 47 N -0.95 1.25 -3.68 1.40 0.28 -0.27 -1.39 120.64 117.29 2k6y n GLU 47 Ca -0.04 -1.69 -0.24 0.00 -0.16 0.00 0.00 57.16 55.03 2k6y n GLU 47 Cb 0.62 0.31 -0.17 0.00 1.43 0.00 0.00 31.44 33.63 2k6y n GLU 47 CO 0.00 0.00 0.00 0.99 -0.16 0.00 0.00 177.13 177.96 2k6y s THR 48 N -1.56 0.10 0.42 3.84 2.01 -0.82 -3.68 115.64 115.94 2k6y s THR 48 Ca 0.08 -0.02 -0.02 0.00 0.31 0.00 0.00 61.69 62.03 2k6y s THR 48 Cb -0.01 -0.53 -0.03 0.00 0.01 0.00 0.00 72.50 71.94 2k6y s THR 48 CO 0.05 -0.05 0.67 0.72 -0.69 0.00 0.00 174.62 175.32 2k6y s PHE 49 N 2.07 3.53 0.18 4.92 -0.12 0.04 -4.62 117.98 123.98 2k6y s PHE 49 Ca 0.03 0.58 -0.09 0.00 -0.05 0.00 0.00 56.93 57.40 2k6y s PHE 49 Cb -0.14 -2.10 -0.07 0.00 -0.63 0.00 0.00 43.02 40.08 2k6y s PHE 49 CO -0.07 -0.08 0.50 -1.64 -0.05 0.00 0.00 175.22 173.88 2k6y s MET 50 N -4.53 3.79 -0.28 1.99 -1.94 -1.26 -1.97 119.30 115.09 2k6y s MET 50 Ca 0.44 0.23 -0.10 0.00 -1.71 0.00 0.00 55.69 54.54 2k6y s MET 50 Cb -0.10 -2.78 0.12 0.00 2.01 0.00 0.00 34.83 34.08 2k6y s MET 50 CO 0.41 0.41 0.62 0.50 -0.01 0.00 0.00 175.02 176.94 2k6y s ARG 51 N -2.52 0.56 0.17 2.03 3.52 -0.23 -4.96 118.95 117.52 2k6y s ARG 51 Ca 0.43 1.39 -0.02 0.00 -0.13 0.00 0.00 55.73 57.39 2k6y s ARG 51 Cb -0.12 0.75 -0.05 0.00 -1.56 0.00 0.00 34.95 33.97 2k6y s ARG 51 CO 0.21 -0.20 0.37 -1.21 -0.81 0.00 0.00 175.30 173.66 2k6y s GLU 52 N 2.76 3.55 -0.13 5.12 8.01 -1.26 -1.88 118.70 134.88 2k6y s GLU 52 Ca -0.06 -0.24 -0.04 0.00 0.01 0.00 0.00 54.97 54.65 2k6y s GLU 52 Cb -0.11 -2.86 0.06 0.00 -4.31 0.00 0.00 34.13 26.91 2k6y s GLU 52 CO -0.18 0.44 0.19 0.08 0.01 0.00 0.00 175.26 175.80 2k6y s VAL 53 N -1.76 -0.29 -1.61 2.63 1.01 -0.35 -4.75 120.40 115.29 2k6y s VAL 53 Ca 0.39 0.19 0.00 0.00 0.00 0.00 0.00 61.98 62.56 2k6y s VAL 53 Cb -0.12 -0.44 0.00 0.00 0.00 0.00 0.00 36.38 35.83 2k6y s VAL 53 CO 0.27 0.02 0.00 -0.62 0.00 0.00 0.00 175.10 174.78 2k6y n GLU 54 N 5.33 -1.43 -0.12 2.72 1.02 -1.26 -1.09 120.64 125.81 2k6y n GLU 54 Ca -0.05 1.02 0.00 0.00 -0.02 0.00 0.00 57.16 58.11 2k6y n GLU 54 Cb 0.50 -5.34 0.00 0.00 -0.02 0.00 0.00 31.44 26.57 2k6y n GLU 54 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2k6y n GLY 55 N -0.37 1.88 3.74 0.62 0.00 -1.26 -5.05 105.19 104.76 2k6y n GLY 55 Ca -0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.46 2k6y n GLY 55 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k6y s LYS 56 N -0.30 4.69 0.31 1.61 1.02 -0.25 -5.00 119.74 121.82 2k6y s LYS 56 Ca 0.00 1.61 -0.29 0.00 0.02 0.00 0.00 55.97 57.31 2k6y s LYS 56 Cb 0.00 -3.29 -0.11 0.00 -0.52 0.00 0.00 37.83 33.92 2k6y s LYS 56 CO 0.00 0.23 1.43 0.15 -0.92 0.00 0.00 175.35 176.25 2k6y s LYS 57 N -0.63 4.23 0.08 1.68 -0.14 -1.26 -1.21 119.74 122.49 2k6y s LYS 57 Ca 0.46 2.38 -0.06 0.00 -1.36 0.00 0.00 55.97 57.39 2k6y s LYS 57 Cb -0.28 -3.05 -0.02 0.00 -1.68 0.00 0.00 37.83 32.81 2k6y s LYS 57 CO 0.34 -0.41 0.11 0.08 -0.76 0.00 0.00 175.35 174.71 2k6y s VAL 58 N -0.59 0.17 0.10 3.17 1.01 -0.79 -4.89 120.40 118.58 2k6y s VAL 58 Ca 0.55 -1.41 0.03 0.00 0.00 0.00 0.00 61.98 61.15 2k6y s VAL 58 Cb -0.43 -1.42 -0.04 0.00 0.00 0.00 0.00 36.38 34.49 2k6y s VAL 58 CO 0.51 -0.76 -0.09 -0.04 0.00 0.00 0.00 175.10 174.72 2k6y s MET 59 N -3.89 0.83 0.20 2.72 -1.94 -1.26 -1.06 119.30 114.90 2k6y s MET 59 Ca 0.06 -1.19 -0.22 0.00 -1.71 0.00 0.00 55.69 52.64 2k6y s MET 59 Cb 0.06 -0.44 0.05 0.00 2.01 0.00 0.00 34.83 36.51 2k6y s MET 59 CO -0.10 0.06 0.62 0.20 -0.01 0.00 0.00 175.02 175.79 2k6y s GLY 60 N -2.57 -0.40 0.37 -0.03 0.00 -0.83 -4.96 107.32 98.91 2k6y s GLY 60 Ca 0.06 0.16 0.07 0.00 0.00 0.00 0.00 44.72 45.02 2k6y s GLY 60 CO -0.01 0.03 0.41 1.06 0.00 0.00 0.00 173.10 174.58 2k6y s MET 61 N -3.82 2.81 -0.24 2.90 -1.94 -1.26 -0.78 119.30 116.97 2k6y s MET 61 Ca 0.05 -1.26 -0.32 0.00 -1.71 0.00 0.00 55.69 52.45 2k6y s MET 61 Cb -0.02 -2.60 0.16 0.00 2.01 0.00 0.00 34.83 34.38 2k6y s MET 61 CO -0.06 -0.04 1.27 -0.98 -0.01 0.00 0.00 175.02 175.20 2k6y s ARG 62 N -4.13 0.20 0.61 2.03 1.70 -1.24 -4.96 118.95 113.16 2k6y s ARG 62 Ca 0.46 -0.01 -0.16 0.00 -0.47 0.00 0.00 55.73 55.55 2k6y s ARG 62 Cb -0.07 0.09 -0.02 0.00 -0.57 0.00 0.00 34.95 34.38 2k6y s ARG 62 CO 0.29 -0.07 1.10 -1.25 -1.08 0.00 0.00 175.30 174.29 2k6y s PRO 63 N -1.56 3.07 0.22 3.89 0.05 -1.26 -1.11 135.00 138.30 2k6y s PRO 63 Ca 0.08 1.39 0.11 0.00 0.05 0.00 0.00 61.00 62.63 2k6y s PRO 63 Cb -0.01 -1.99 -0.05 0.00 0.05 0.00 0.00 34.50 32.51 2k6y s PRO 63 CO -0.05 -1.04 -0.21 0.14 0.05 0.00 0.00 177.00 175.90 2k6y s VAL 64 N -2.24 2.50 0.18 -0.36 -7.23 0.06 -4.86 120.40 108.44 2k6y s VAL 64 Ca 0.67 -2.12 0.34 0.00 -1.81 0.00 0.00 61.98 59.06 2k6y s VAL 64 Cb -0.20 -2.24 0.38 0.00 0.56 0.00 0.00 36.38 34.88 2k6y s VAL 64 CO 0.37 -0.21 2.01 1.55 -0.31 0.00 0.00 175.10 178.51 2k6y h PRO 65 N 2.84 0.00 -1.36 4.82 0.13 -1.98 -3.43 132.00 133.03 2k6y h PRO 65 Ca -0.44 0.00 0.34 0.00 -0.87 0.00 0.00 66.00 65.02 2k6y h PRO 65 Cb 1.23 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.23 2k6y h PRO 65 CO 0.53 0.03 0.86 -0.59 -0.23 0.00 0.00 178.00 178.59 2k6y s PHE 66 N -3.74 -0.04 0.42 1.56 -0.12 -1.26 -4.84 117.98 109.96 2k6y s PHE 66 Ca 0.00 -0.04 0.07 0.00 -0.05 0.00 0.00 56.93 56.91 2k6y s PHE 66 Cb 0.10 0.54 -0.03 0.00 -0.63 0.00 0.00 43.02 42.99 2k6y s PHE 66 CO 0.54 -0.22 0.28 -0.51 -0.05 0.00 0.00 175.22 175.26 2k6y s LEU 67 N -2.94 3.21 0.16 -1.99 1.43 0.14 -4.99 118.68 113.69 2k6y s LEU 67 Ca 0.14 -0.95 -0.01 0.00 -1.03 0.00 0.00 54.13 52.29 2k6y s LEU 67 Cb 0.05 -1.69 -0.04 0.00 0.03 0.00 0.00 46.19 44.54 2k6y s LEU 67 CO -0.04 -0.63 0.07 -1.83 0.23 0.00 0.00 176.35 174.15 2k6y s GLU 68 N -4.02 1.05 -0.12 1.70 -1.05 -1.26 -0.40 118.70 114.59 2k6y s GLU 68 Ca 0.44 -1.52 -0.05 0.00 -0.15 0.00 0.00 54.97 53.69 2k6y s GLU 68 Cb 0.00 0.17 0.06 0.00 -0.44 0.00 0.00 34.13 33.93 2k6y s GLU 68 CO 0.25 -0.29 0.25 0.08 0.95 0.00 0.00 175.26 176.50 2k6y s VAL 69 N -4.03 -0.38 0.80 1.83 1.01 0.58 -4.91 120.40 115.31 2k6y s VAL 69 Ca 0.29 0.28 -0.11 0.00 0.00 0.00 0.00 61.98 62.43 2k6y s VAL 69 Cb 0.07 -0.43 0.07 0.00 0.00 0.00 0.00 36.38 36.10 2k6y s VAL 69 CO 0.05 0.12 1.10 -2.16 0.00 0.00 0.00 175.10 174.21 2k6y s PRO 70 N 2.34 2.07 0.34 2.72 0.04 -1.26 -0.79 135.00 140.46 2k6y s PRO 70 Ca 0.01 0.64 -0.29 0.00 0.04 0.00 0.00 61.00 61.40 2k6y s PRO 70 Cb -0.12 -1.92 -0.11 0.00 0.04 0.00 0.00 34.50 32.40 2k6y s PRO 70 CO -0.08 -1.63 1.47 -1.25 0.04 0.00 0.00 177.00 175.55 2k6y s PRO 71 N -5.15 4.17 0.00 0.56 0.04 -1.25 -1.69 135.00 131.68 2k6y s PRO 71 Ca 0.61 2.48 0.00 0.00 0.04 0.00 0.00 61.00 64.13 2k6y s PRO 71 Cb -0.14 -3.01 0.00 0.00 0.04 0.00 0.00 34.50 31.38 2k6y s PRO 71 CO 0.54 -0.48 0.00 1.63 0.04 0.00 0.00 177.00 178.73 2k6y n LYS 72 N 1.08 0.00 -2.62 4.56 4.76 -0.22 -4.96 118.16 120.76 2k6y n LYS 72 Ca 0.03 0.00 -0.43 0.00 -2.87 0.00 0.00 58.31 55.04 2k6y n LYS 72 Cb 0.39 -3.77 -0.02 0.00 -1.84 0.00 0.00 35.03 29.79 2k6y n LYS 72 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 2k6y s GLY 73 N -2.00 1.58 0.08 0.72 0.00 -0.68 -4.74 107.32 102.28 2k6y s GLY 73 Ca 0.00 0.03 -0.30 0.00 0.00 0.00 0.00 44.72 44.45 2k6y s GLY 73 CO 0.00 2.28 0.98 -1.60 0.00 0.00 0.00 173.10 174.75 2k6y s ARG 74 N 3.56 4.65 0.25 2.90 3.52 -1.26 -1.57 118.95 131.00 2k6y s ARG 74 Ca 0.46 1.46 0.04 0.00 -0.13 0.00 0.00 55.73 57.56 2k6y s ARG 74 Cb -0.13 -3.40 -0.05 0.00 -1.56 0.00 0.00 34.95 29.80 2k6y s ARG 74 CO 0.13 0.12 -0.00 0.14 -0.81 0.00 0.00 175.30 174.88 2k6y s VAL 75 N 0.33 1.15 -0.29 7.11 -7.23 0.59 -4.98 120.40 117.07 2k6y s VAL 75 Ca 0.49 -2.04 -0.02 0.00 -1.81 0.00 0.00 61.98 58.60 2k6y s VAL 75 Cb -0.23 -2.44 0.18 0.00 0.56 0.00 0.00 36.38 34.45 2k6y s VAL 75 CO 0.29 -0.26 0.55 -1.83 -0.31 0.00 0.00 175.10 173.54 2k6y s GLU 76 N -3.85 0.52 -1.22 4.82 -1.05 -1.26 -1.57 118.70 115.09 2k6y s GLU 76 Ca 0.30 0.93 -0.19 0.00 -0.15 0.00 0.00 54.97 55.86 2k6y s GLU 76 Cb 0.06 0.35 -0.01 0.00 -0.44 0.00 0.00 34.13 34.09 2k6y s GLU 76 CO 0.10 -0.61 1.94 1.28 0.95 0.00 0.00 175.26 178.93 2k6y n LEU 77 N 5.42 4.88 -4.77 1.83 4.32 0.07 -4.68 117.00 124.07 2k6y n LEU 77 Ca -0.02 -3.63 -0.34 0.00 -0.02 0.00 0.00 56.01 52.00 2k6y n LEU 77 Cb 0.51 -1.61 0.03 0.00 -1.62 0.00 0.00 43.42 40.73 2k6y n LEU 77 CO 0.03 -0.12 0.76 -1.59 -1.22 0.00 0.00 177.39 175.25 2k6y s LYS 78 N 4.58 2.96 0.18 3.23 -2.85 -1.18 -3.32 119.74 123.34 2k6y s LYS 78 Ca 0.56 1.49 -0.11 0.00 -1.00 0.00 0.00 55.97 56.91 2k6y s LYS 78 Cb 0.07 -1.96 0.09 0.00 -2.06 0.00 0.00 37.83 33.97 2k6y s LYS 78 CO 0.06 -1.14 1.73 -1.00 0.10 0.00 0.00 175.35 175.10 2k6y h PRO 79 N 0.42 0.97 -5.21 1.78 0.13 -1.93 -3.25 132.00 124.89 2k6y h PRO 79 Ca -0.48 -0.18 -0.61 0.00 -0.87 0.00 0.00 66.00 63.86 2k6y h PRO 79 Cb 1.25 -0.15 -0.14 0.00 0.13 0.00 0.00 31.00 32.09 2k6y h PRO 79 CO 0.55 0.82 -0.52 0.20 -0.23 0.00 0.00 178.00 178.82 2k6y s GLY 80 N -3.21 1.98 0.00 1.56 0.00 -1.26 -4.96 107.32 101.43 2k6y s GLY 80 Ca -0.13 -0.78 0.00 0.00 0.00 0.00 0.00 44.72 43.82 2k6y s GLY 80 CO 0.81 0.20 0.00 0.61 0.00 0.00 0.00 173.10 174.72 2k6y n GLY 81 N 3.78 0.35 3.75 0.20 0.00 -1.23 -4.97 105.19 107.08 2k6y n GLY 81 Ca -0.16 -1.63 -0.41 0.00 0.00 0.00 0.00 46.02 43.82 2k6y n GLY 81 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2k6y s TYR 82 N -2.22 3.49 0.10 1.61 2.02 -1.26 -1.95 117.35 119.15 2k6y s TYR 82 Ca 0.00 1.60 -0.25 0.00 -0.37 0.00 0.00 57.07 58.05 2k6y s TYR 82 Cb 0.00 -3.36 0.08 0.00 -0.40 0.00 0.00 41.96 38.28 2k6y s TYR 82 CO 0.00 -0.84 0.66 -3.38 -1.57 0.00 0.00 175.55 170.43 2k6y s HIS 83 N -0.87 -0.52 0.02 2.71 -3.43 -0.49 -3.12 115.29 109.59 2k6y s HIS 83 Ca 0.47 0.44 -0.22 0.00 -0.80 0.00 0.00 55.06 54.95 2k6y s HIS 83 Cb -0.33 0.53 -0.05 0.00 -1.43 0.00 0.00 32.58 31.30 2k6y s HIS 83 CO 0.41 -0.76 0.65 -0.06 -2.00 0.00 0.00 174.74 172.98 2k6y s PHE 84 N -3.22 3.71 -0.25 0.38 0.08 -0.33 -0.43 117.98 117.92 2k6y s PHE 84 Ca -0.00 1.29 -0.08 0.00 0.12 0.00 0.00 56.93 58.26 2k6y s PHE 84 Cb -0.01 -2.67 -0.03 0.00 -0.57 0.00 0.00 43.02 39.74 2k6y s PHE 84 CO -0.09 0.34 0.10 1.41 -0.10 0.00 0.00 175.22 176.89 2k6y s MET 85 N -0.22 3.74 -0.04 0.44 1.75 0.40 -1.71 119.30 123.66 2k6y s MET 85 Ca 0.33 -0.43 -0.01 0.00 -1.25 0.00 0.00 55.69 54.33 2k6y s MET 85 Cb -0.19 -3.40 -0.04 0.00 2.84 0.00 0.00 34.83 34.04 2k6y s MET 85 CO 0.19 -0.17 0.02 -0.51 -0.65 0.00 0.00 175.02 173.90 2k6y s LEU 86 N 1.61 3.63 -0.08 4.11 2.01 -0.11 -1.22 118.68 128.63 2k6y s LEU 86 Ca 0.06 0.10 -0.06 0.00 0.01 0.00 0.00 54.13 54.24 2k6y s LEU 86 Cb -0.15 -1.98 0.03 0.00 0.01 0.00 0.00 46.19 44.10 2k6y s LEU 86 CO 0.05 0.32 0.20 -0.76 1.01 0.00 0.00 176.35 177.18 2k6y s LEU 87 N -1.28 0.95 -0.06 1.79 1.43 0.03 -1.70 118.68 119.84 2k6y s LEU 87 Ca 0.17 0.41 -0.02 0.00 -1.03 0.00 0.00 54.13 53.66 2k6y s LEU 87 Cb -0.12 0.63 0.00 0.00 0.03 0.00 0.00 46.19 46.74 2k6y s LEU 87 CO 0.07 -0.11 0.07 0.61 0.23 0.00 0.00 176.35 177.23 2k6y n GLY 88 N 3.51 -1.20 3.45 -3.19 0.00 -1.20 -0.61 105.19 105.94 2k6y n GLY 88 Ca -0.18 0.05 -0.43 0.00 0.00 0.00 0.00 46.02 45.45 2k6y n GLY 88 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2k6y s LEU 89 N -1.05 4.53 -0.00 0.99 1.43 -1.26 -0.71 118.68 122.60 2k6y s LEU 89 Ca 0.03 -0.99 0.08 0.00 -1.03 0.00 0.00 54.13 52.21 2k6y s LEU 89 Cb -0.01 -2.44 0.23 0.00 0.03 0.00 0.00 46.19 44.00 2k6y s LEU 89 CO 0.11 -1.35 1.17 2.29 0.23 0.00 0.00 176.35 178.80 2k6y n LYS 90 N 7.42 1.62 -4.04 1.70 2.85 -1.26 -4.77 118.16 121.68 2k6y n LYS 90 Ca -0.04 -0.92 -0.10 0.00 -1.05 0.00 0.00 58.31 56.20 2k6y n LYS 90 Cb 0.45 -1.22 -0.08 0.00 -0.65 0.00 0.00 35.03 33.53 2k6y n LYS 90 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 177.40 178.38 2k6y s ARG 91 N -1.66 1.14 0.89 -1.58 0.52 -1.26 -5.00 118.95 111.99 2k6y s ARG 91 Ca 0.17 -1.30 -0.15 0.00 -0.52 0.00 0.00 55.73 53.93 2k6y s ARG 91 Cb 0.09 0.34 0.22 0.00 0.52 0.00 0.00 34.95 36.12 2k6y s ARG 91 CO 0.11 -0.40 0.71 -0.35 0.02 0.00 0.00 175.30 175.39 2k6y n PRO 92 N -0.21 -2.89 -2.66 3.54 -0.04 -1.26 -4.91 135.00 126.58 2k6y n PRO 92 Ca -0.05 -1.15 -0.03 0.00 -0.04 0.00 0.00 63.50 62.23 2k6y n PRO 92 Cb 0.63 -1.17 0.10 0.00 -0.04 0.00 0.00 33.50 33.03 2k6y n PRO 92 CO 0.00 0.00 0.00 1.47 -0.04 0.00 0.00 175.50 176.93 2k6y n LEU 93 N 0.00 -1.23 -4.73 1.53 -0.00 -1.26 -4.81 117.00 106.51 2k6y n LEU 93 Ca 0.10 -1.88 -0.36 0.00 -0.00 0.00 0.00 56.01 53.87 2k6y n LEU 93 Cb 0.41 0.98 0.08 0.00 -0.00 0.00 0.00 43.42 44.88 2k6y n LEU 93 CO 0.28 1.56 0.87 -0.54 -0.00 0.00 0.00 177.39 179.56 2k6y s LYS 94 N 0.05 2.42 0.00 1.47 1.02 -1.26 -4.79 119.74 118.64 2k6y s LYS 94 Ca 0.19 1.97 -0.31 0.00 0.02 0.00 0.00 55.97 57.84 2k6y s LYS 94 Cb 0.28 -1.84 -0.10 0.00 -0.52 0.00 0.00 37.83 35.65 2k6y s LYS 94 CO -0.18 -1.68 1.94 0.00 -0.92 0.00 0.00 175.35 174.51 2k6y n ALA 95 N -2.15 1.38 -0.39 5.17 0.00 -1.26 -1.17 120.51 122.09 2k6y n ALA 95 Ca 0.15 0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.83 2k6y n ALA 95 Cb 0.49 -2.62 0.00 0.00 0.00 0.00 0.00 19.45 17.31 2k6y n ALA 95 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k6y n GLY 96 N 4.50 0.77 3.99 0.00 0.00 -1.22 -5.06 105.19 108.17 2k6y n GLY 96 Ca 0.21 -0.32 -0.19 0.00 0.00 0.00 0.00 46.02 45.72 2k6y n GLY 96 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2k6y s GLU 97 N -0.74 2.96 0.08 1.61 2.02 -0.32 -5.02 118.70 119.30 2k6y s GLU 97 Ca 0.00 -1.03 0.08 0.00 0.02 0.00 0.00 54.97 54.04 2k6y s GLU 97 Cb 0.00 -2.75 -0.04 0.00 0.10 0.00 0.00 34.13 31.45 2k6y s GLU 97 CO 0.00 -0.15 -0.18 -1.21 0.02 0.00 0.00 175.26 173.74 2k6y s GLU 98 N -4.32 1.93 -0.28 1.61 2.02 -1.26 -1.26 118.70 117.14 2k6y s GLU 98 Ca 0.50 -1.08 -0.08 0.00 0.02 0.00 0.00 54.97 54.34 2k6y s GLU 98 Cb -0.10 -2.15 -0.01 0.00 0.10 0.00 0.00 34.13 31.97 2k6y s GLU 98 CO 0.33 0.51 0.09 0.08 0.02 0.00 0.00 175.26 176.29 2k6y s VAL 99 N -1.03 4.21 0.14 2.63 1.01 0.10 -4.93 120.40 122.53 2k6y s VAL 99 Ca 0.16 -0.45 -0.31 0.00 0.00 0.00 0.00 61.98 61.37 2k6y s VAL 99 Cb -0.11 -3.09 -0.09 0.00 0.00 0.00 0.00 36.38 33.09 2k6y s VAL 99 CO 0.08 0.17 1.54 -0.70 0.00 0.00 0.00 175.10 176.19 2k6y s GLU 100 N 1.56 4.23 -0.09 2.72 2.12 -1.26 -1.39 118.70 126.59 2k6y s GLU 100 Ca 0.04 2.30 0.02 0.00 0.36 0.00 0.00 54.97 57.69 2k6y s GLU 100 Cb -0.16 -3.23 0.02 0.00 0.26 0.00 0.00 34.13 31.01 2k6y s GLU 100 CO 0.03 -0.59 -0.13 -0.51 -0.54 0.00 0.00 175.26 173.53 2k6y s LEU 101 N 1.32 1.60 -0.66 2.70 1.43 -0.21 -4.05 118.68 120.81 2k6y s LEU 101 Ca 0.69 -0.35 -0.11 0.00 -1.03 0.00 0.00 54.13 53.33 2k6y s LEU 101 Cb -0.42 -0.94 0.17 0.00 0.03 0.00 0.00 46.19 45.03 2k6y s LEU 101 CO 0.31 0.00 0.56 -1.81 0.23 0.00 0.00 176.35 175.65 2k6y s ASP 102 N 0.96 6.13 -0.04 2.29 1.11 0.40 -0.42 116.67 127.10 2k6y s ASP 102 Ca -0.08 -2.39 -0.30 0.00 0.18 0.00 0.00 52.55 49.96 2k6y s ASP 102 Cb -0.15 -2.10 -0.07 0.00 1.07 0.00 0.00 42.92 41.68 2k6y s ASP 102 CO -0.00 -0.61 1.85 -0.76 1.18 0.00 0.00 175.17 176.83 2k6y s LEU 103 N 0.64 4.25 -0.16 1.23 1.43 0.01 -0.56 118.68 125.52 2k6y s LEU 103 Ca 0.12 2.35 -0.18 0.00 -1.03 0.00 0.00 54.13 55.40 2k6y s LEU 103 Cb -0.19 -3.53 -0.04 0.00 0.03 0.00 0.00 46.19 42.46 2k6y s LEU 103 CO -0.04 -1.11 0.47 -0.76 0.23 0.00 0.00 176.35 175.13 2k6y s LEU 104 N 4.75 4.22 -0.05 1.79 1.43 0.23 -1.37 118.68 129.69 2k6y s LEU 104 Ca 0.83 0.71 0.04 0.00 -1.03 0.00 0.00 54.13 54.68 2k6y s LEU 104 Cb -0.37 -2.65 0.00 0.00 0.03 0.00 0.00 46.19 43.20 2k6y s LEU 104 CO 0.36 -0.06 -0.15 -0.36 0.23 0.00 0.00 176.35 176.37 2k6y s PHE 105 N 1.00 1.60 -0.62 0.29 0.40 -1.01 -0.58 117.98 119.05 2k6y s PHE 105 Ca 0.24 -0.50 -0.07 0.00 -0.60 0.00 0.00 56.93 56.00 2k6y s PHE 105 Cb -0.15 -1.10 -0.15 0.00 0.51 0.00 0.00 43.02 42.13 2k6y s PHE 105 CO 0.09 -0.20 3.25 0.00 0.70 0.00 0.00 175.22 179.06 2k6y n ALA 106 N 3.35 6.77 -2.14 5.36 0.00 -0.02 -3.40 120.51 130.42 2k6y n ALA 106 Ca -0.19 -2.63 -0.02 0.00 0.00 0.00 0.00 53.44 50.60 2k6y n ALA 106 Cb 0.53 -2.64 -0.02 0.00 0.00 0.00 0.00 19.45 17.32 2k6y n ALA 106 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k6y n GLY 107 N 2.55 0.74 2.59 0.00 0.00 -1.26 -4.81 105.19 104.99 2k6y n GLY 107 Ca 0.55 -0.23 -0.11 0.00 0.00 0.00 0.00 46.02 46.23 2k6y n GLY 107 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k6y n GLY 108 N 0.14 -0.10 3.27 -0.02 0.00 -1.24 -5.04 105.19 102.19 2k6y n GLY 108 Ca -0.09 -0.08 -0.09 0.00 0.00 0.00 0.00 46.02 45.76 2k6y n GLY 108 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k6y s LYS 109 N -4.83 0.97 -0.28 1.61 -0.14 -1.22 -5.10 119.74 110.75 2k6y s LYS 109 Ca 0.02 -0.88 -0.17 0.00 -1.36 0.00 0.00 55.97 53.58 2k6y s LYS 109 Cb -0.00 0.40 0.10 0.00 -1.68 0.00 0.00 37.83 36.64 2k6y s LYS 109 CO 0.48 -0.34 0.78 0.54 -0.76 0.00 0.00 175.35 176.04 2k6y s VAL 110 N -3.85 0.00 -0.16 3.17 0.11 -1.26 -2.41 120.40 116.01 2k6y s VAL 110 Ca 0.05 0.00 0.01 0.00 -2.93 0.00 0.00 61.98 59.11 2k6y s VAL 110 Cb 0.03 -1.00 0.02 0.00 -1.53 0.00 0.00 36.38 33.90 2k6y s VAL 110 CO -0.10 0.00 -0.18 -0.76 -3.33 0.00 0.00 175.10 170.73 2k6y s LEU 111 N 1.48 1.94 -0.06 2.54 2.01 -0.47 -4.96 118.68 121.17 2k6y s LEU 111 Ca -0.09 -0.57 -0.17 0.00 0.01 0.00 0.00 54.13 53.31 2k6y s LEU 111 Cb -0.05 -1.34 -0.05 0.00 0.01 0.00 0.00 46.19 44.76 2k6y s LEU 111 CO -0.17 -0.01 0.46 -1.59 1.01 0.00 0.00 176.35 176.05 2k6y s LYS 112 N 1.28 4.18 0.33 1.70 -2.85 -1.26 -0.81 119.74 122.30 2k6y s LYS 112 Ca 0.03 0.46 0.10 0.00 -1.00 0.00 0.00 55.97 55.56 2k6y s LYS 112 Cb -0.13 -3.34 -0.06 0.00 -2.06 0.00 0.00 37.83 32.24 2k6y s LYS 112 CO -0.10 0.40 -0.11 0.14 0.10 0.00 0.00 175.35 175.78 2k6y s VAL 113 N -0.16 2.34 -0.04 1.79 -7.23 0.44 -5.00 120.40 112.54 2k6y s VAL 113 Ca 0.25 -2.24 0.04 0.00 -1.81 0.00 0.00 61.98 58.23 2k6y s VAL 113 Cb -0.16 -2.58 -0.00 0.00 0.56 0.00 0.00 36.38 34.20 2k6y s VAL 113 CO 0.12 -0.25 -0.16 0.54 -0.31 0.00 0.00 175.10 175.04 2k6y s VAL 114 N -2.57 1.32 0.03 1.32 0.11 -1.26 -1.05 120.40 118.30 2k6y s VAL 114 Ca 0.32 -0.65 0.02 0.00 -2.93 0.00 0.00 61.98 58.75 2k6y s VAL 114 Cb 0.00 -1.14 -0.02 0.00 -1.53 0.00 0.00 36.38 33.69 2k6y s VAL 114 CO 0.16 0.38 -0.08 -0.76 -3.33 0.00 0.00 175.10 171.48 2k6y s LEU 115 N 0.12 2.21 0.90 2.54 1.43 -0.49 -4.99 118.68 120.40 2k6y s LEU 115 Ca -0.05 -0.46 -0.11 0.00 -1.03 0.00 0.00 54.13 52.48 2k6y s LEU 115 Cb -0.11 -0.21 0.13 0.00 0.03 0.00 0.00 46.19 46.03 2k6y s LEU 115 CO 0.02 -0.14 1.10 -2.16 0.23 0.00 0.00 176.35 175.39 2k6y s PRO 116 N -1.30 1.19 -0.28 1.29 0.04 -1.26 0.01 135.00 134.68 2k6y s PRO 116 Ca -0.07 1.05 -0.10 0.00 0.04 0.00 0.00 61.00 61.92 2k6y s PRO 116 Cb -0.08 -1.78 -0.03 0.00 0.04 0.00 0.00 34.50 32.64 2k6y s PRO 116 CO 0.00 -2.35 0.16 0.08 0.04 0.00 0.00 177.00 174.93 2k6y s VAL 117 N -2.81 4.94 -0.03 -0.36 1.01 -0.39 -2.25 120.40 120.52 2k6y s VAL 117 Ca 0.64 -0.06 -0.12 0.00 0.00 0.00 0.00 61.98 62.44 2k6y s VAL 117 Cb -0.20 -3.39 -0.05 0.00 0.00 0.00 0.00 36.38 32.74 2k6y s VAL 117 CO 0.58 0.21 0.33 -1.61 0.00 0.00 0.00 175.10 174.61 2k6y s GLU 118 N 1.70 3.76 0.66 2.72 8.01 0.16 -3.39 118.70 132.32 2k6y s GLU 118 Ca 0.06 0.23 -0.11 0.00 0.01 0.00 0.00 54.97 55.16 2k6y s GLU 118 Cb -0.16 -3.19 0.15 0.00 -4.31 0.00 0.00 34.13 26.62 2k6y s GLU 118 CO 0.08 0.70 0.90 0.00 0.01 0.00 0.00 175.26 176.95 2k6y n ALA 119 N 1.75 -0.99 0.00 5.21 0.00 -1.26 -0.50 120.51 124.71 2k6y n ALA 119 Ca -0.15 -1.19 0.00 0.00 0.00 0.00 0.00 53.44 52.10 2k6y n ALA 119 Cb 0.53 -0.05 0.00 0.00 0.00 0.00 0.00 19.45 19.93 2k6y n ALA 119 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04