#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 2.49 -2.72 1.61 7.64 -1.26 -4.98 113.62 116.40 2k6y n SER 2 Ca 0.00 0.00 -0.01 0.00 1.01 0.00 0.00 58.87 59.87 2k6y n SER 2 Cb 0.00 0.23 0.02 0.00 -1.01 0.00 0.00 64.21 63.45 2k6y n SER 2 CO 0.00 0.00 0.00 0.72 -3.01 0.00 0.00 175.04 172.75 2k6y s PHE 3 N -1.51 -0.43 0.00 1.43 -0.12 -1.26 -5.03 117.98 111.07 2k6y s PHE 3 Ca 0.00 -0.06 0.00 0.00 -0.05 0.00 0.00 56.93 56.82 2k6y s PHE 3 Cb 0.00 0.08 0.00 0.00 -0.63 0.00 0.00 43.02 42.47 2k6y s PHE 3 CO 0.00 -0.32 0.00 2.41 -0.05 0.00 0.00 175.22 177.26 2k6y n THR 4 N 3.07 0.00 -3.71 -4.49 -1.04 -1.26 -5.12 114.28 101.73 2k6y n THR 4 Ca 0.10 0.00 -0.04 0.00 -2.04 0.00 0.00 64.05 62.07 2k6y n THR 4 Cb 0.64 0.00 -0.01 0.00 -1.82 0.00 0.00 70.33 69.14 2k6y n THR 4 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2k6y n GLU 5 N -0.41 0.18 -4.02 -2.82 1.02 -1.26 -4.77 120.64 108.56 2k6y n GLU 5 Ca 0.00 -0.71 -0.10 0.00 -0.02 0.00 0.00 57.16 56.33 2k6y n GLU 5 Cb 0.00 0.68 -0.11 0.00 -0.02 0.00 0.00 31.44 31.99 2k6y n GLU 5 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 2k6y s GLY 6 N -1.55 0.34 0.01 0.62 0.00 -1.26 -0.54 107.32 104.94 2k6y s GLY 6 Ca 0.07 -0.73 -0.22 0.00 0.00 0.00 0.00 44.72 43.85 2k6y s GLY 6 CO 0.05 -0.80 0.49 0.66 0.00 0.00 0.00 173.10 173.50 2k6y s TRP 7 N -1.84 -0.39 -0.25 1.90 -2.14 -0.40 -4.32 118.94 111.50 2k6y s TRP 7 Ca -0.11 0.52 -0.09 0.00 2.66 0.00 0.00 56.10 59.08 2k6y s TRP 7 Cb -0.07 0.28 -0.04 0.00 -3.10 0.00 0.00 33.47 30.53 2k6y s TRP 7 CO -0.02 -0.57 0.13 0.08 -2.66 0.00 0.00 176.95 173.91 2k6y s VAL 8 N -1.94 4.96 -0.97 -0.66 1.01 -0.48 -1.75 120.40 120.57 2k6y s VAL 8 Ca -0.08 0.04 -0.20 0.00 0.00 0.00 0.00 61.98 61.75 2k6y s VAL 8 Cb -0.01 -3.32 0.11 0.00 0.00 0.00 0.00 36.38 33.16 2k6y s VAL 8 CO 0.02 0.33 1.22 -0.60 0.00 0.00 0.00 175.10 176.07 2k6y s ARG 9 N 1.36 3.62 0.32 2.72 3.00 0.29 -0.67 118.95 129.59 2k6y s ARG 9 Ca 0.06 -1.65 -0.29 0.00 -1.00 0.00 0.00 55.73 52.85 2k6y s ARG 9 Cb -0.15 -5.03 -0.10 0.00 0.00 0.00 0.00 34.95 29.67 2k6y s ARG 9 CO 0.06 -1.88 1.31 0.12 0.00 0.00 0.00 175.30 174.91 2k6y s PHE 10 N 3.19 3.07 0.06 5.12 5.36 0.06 -2.32 117.98 132.53 2k6y s PHE 10 Ca 0.36 1.38 0.00 0.00 -0.96 0.00 0.00 56.93 57.71 2k6y s PHE 10 Cb -0.03 -3.68 -0.04 0.00 -0.34 0.00 0.00 43.02 38.93 2k6y s PHE 10 CO -0.09 -1.90 -0.04 -1.12 -1.46 0.00 0.00 175.22 170.61 2k6y s SER 11 N -0.38 0.70 0.00 6.13 0.01 -1.26 -1.78 113.70 117.12 2k6y s SER 11 Ca 0.50 -0.92 0.00 0.00 1.31 0.00 0.00 55.95 56.84 2k6y s SER 11 Cb -0.40 0.15 0.00 0.00 0.21 0.00 0.00 66.02 65.98 2k6y s SER 11 CO 0.51 -0.50 0.53 -0.81 0.41 0.00 0.00 173.24 173.38 2k6y n PRO 12 N 0.30 0.59 0.00 12.44 -0.04 -1.26 -4.86 135.00 142.17 2k6y n PRO 12 Ca -0.15 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.31 2k6y n PRO 12 Cb 0.60 -1.22 0.00 0.00 -0.04 0.00 0.00 33.50 32.84 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 0.60 -0.39 0.00 0.55 0.00 -1.26 -4.96 105.19 99.73 2k6y n GLY 13 Ca 0.00 -1.74 0.13 0.00 0.00 0.00 0.00 46.02 44.41 2k6y n GLY 13 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2k6y n PRO 14 N -0.37 0.19 -4.29 1.61 -0.04 -1.26 -4.99 135.00 125.85 2k6y n PRO 14 Ca 0.00 0.03 -0.16 0.00 -0.04 0.00 0.00 63.50 63.33 2k6y n PRO 14 Cb 0.00 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 31.86 2k6y n PRO 14 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 2k6y s ASN 15 N -2.79 1.92 0.15 3.54 0.01 -1.26 -1.40 114.94 115.11 2k6y s ASN 15 Ca 0.19 -1.09 -0.04 0.00 -0.71 0.00 0.00 52.86 51.21 2k6y s ASN 15 Cb 0.18 -0.02 0.02 0.00 0.41 0.00 0.00 41.25 41.84 2k6y s ASN 15 CO 0.46 -0.37 0.28 0.00 -1.51 0.00 0.00 177.10 175.95 2k6y n ALA 16 N -0.30 -0.55 -2.60 0.60 0.00 0.02 -4.62 120.51 113.06 2k6y n ALA 16 Ca -0.08 -0.54 -0.09 0.00 0.00 0.00 0.00 53.44 52.73 2k6y n ALA 16 Cb 0.62 0.43 -0.07 0.00 0.00 0.00 0.00 19.45 20.43 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 -1.60 -0.15 -0.05 0.00 0.00 -0.98 -1.21 121.76 117.78 2k6y s ALA 17 Ca 0.08 -0.70 -0.13 0.00 0.00 0.00 0.00 51.96 51.20 2k6y s ALA 17 Cb -0.02 0.60 0.02 0.00 0.00 0.00 0.00 23.12 23.73 2k6y s ALA 17 CO 0.06 -0.55 0.30 0.00 0.00 0.00 0.00 175.76 175.57 2k6y s ALA 18 N -3.89 -0.76 0.06 0.00 0.00 -0.61 -0.55 121.76 116.01 2k6y s ALA 18 Ca 0.09 0.51 0.03 0.00 0.00 0.00 0.00 51.96 52.59 2k6y s ALA 18 Cb 0.04 -0.14 -0.03 0.00 0.00 0.00 0.00 23.12 23.00 2k6y s ALA 18 CO -0.08 -0.22 -0.10 0.71 0.00 0.00 0.00 175.76 176.08 2k6y s TYR 19 N -0.79 0.87 -0.22 0.00 2.02 -0.72 -1.64 117.35 116.86 2k6y s TYR 19 Ca -0.09 -0.53 -0.28 0.00 -0.37 0.00 0.00 57.07 55.81 2k6y s TYR 19 Cb -0.04 -0.50 0.13 0.00 -0.40 0.00 0.00 41.96 41.15 2k6y s TYR 19 CO 0.03 -0.04 1.05 -0.48 -1.57 0.00 0.00 175.55 174.54 2k6y s LEU 20 N -1.78 -0.37 0.27 -1.29 0.05 -1.25 -1.27 118.68 113.03 2k6y s LEU 20 Ca -0.05 0.56 -0.30 0.00 0.05 0.00 0.00 54.13 54.39 2k6y s LEU 20 Cb -0.09 1.80 -0.09 0.00 -2.05 0.00 0.00 46.19 45.76 2k6y s LEU 20 CO 0.01 -0.23 1.06 -0.89 -0.55 0.00 0.00 176.35 175.74 2k6y s THR 21 N -0.50 3.62 -0.08 5.48 2.01 0.30 -0.65 115.64 125.84 2k6y s THR 21 Ca 0.01 1.64 -0.05 0.00 0.31 0.00 0.00 61.69 63.60 2k6y s THR 21 Cb -0.03 -4.04 0.03 0.00 0.01 0.00 0.00 72.50 68.47 2k6y s THR 21 CO -0.03 0.39 0.19 -0.22 -0.69 0.00 0.00 174.62 174.26 2k6y s LEU 22 N -1.38 0.83 0.11 4.42 1.98 -0.44 -4.82 118.68 119.38 2k6y s LEU 22 Ca 0.44 0.39 0.04 0.00 -2.89 0.00 0.00 54.13 52.11 2k6y s LEU 22 Cb -0.31 0.57 -0.04 0.00 0.66 0.00 0.00 46.19 47.08 2k6y s LEU 22 CO 0.39 -0.12 -0.10 -1.83 -1.89 0.00 0.00 176.35 172.79 2k6y s GLU 23 N 0.82 0.92 -0.37 1.98 -1.05 -1.26 -1.17 118.70 118.57 2k6y s GLU 23 Ca -0.06 -1.25 0.01 0.00 -0.15 0.00 0.00 54.97 53.52 2k6y s GLU 23 Cb -0.08 -0.57 0.10 0.00 -0.44 0.00 0.00 34.13 33.15 2k6y s GLU 23 CO -0.05 0.08 0.12 1.21 0.95 0.00 0.00 175.26 177.58 2k6y s ASN 24 N -2.67 4.99 0.00 0.83 3.84 -0.25 -4.97 114.94 116.71 2k6y s ASN 24 Ca 0.09 -2.10 0.29 0.00 0.21 0.00 0.00 52.86 51.35 2k6y s ASN 24 Cb -0.01 -1.72 1.29 0.00 -0.55 0.00 0.00 41.25 40.25 2k6y s ASN 24 CO 0.00 -0.45 1.89 -0.81 -2.79 0.00 0.00 177.10 174.93 2k6y n PRO 25 N 4.41 0.91 0.00 0.43 -0.04 -1.26 -0.79 135.00 138.66 2k6y n PRO 25 Ca 0.01 -0.33 0.00 0.00 -0.04 0.00 0.00 63.50 63.14 2k6y n PRO 25 Cb 0.42 -1.49 0.00 0.00 -0.04 0.00 0.00 33.50 32.38 2k6y n PRO 25 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2k6y n GLY 26 N 1.22 0.80 0.40 0.55 0.00 -1.26 -4.76 105.19 102.13 2k6y n GLY 26 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 2k6y n GLY 26 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2k6y n ASP 27 N 0.00 0.00 -4.97 1.61 5.75 -1.26 -4.59 116.55 113.09 2k6y n ASP 27 Ca 0.00 0.00 -0.21 0.00 -0.01 0.00 0.00 54.79 54.57 2k6y n ASP 27 Cb 0.00 0.07 0.01 0.00 -1.03 0.00 0.00 41.12 40.17 2k6y n ASP 27 CO 0.00 0.00 0.00 -1.48 -0.11 0.00 0.00 177.20 175.61 2k6y s LEU 28 N -3.40 3.77 0.49 -2.12 0.05 -1.26 -4.72 118.68 111.49 2k6y s LEU 28 Ca 0.00 0.07 -0.10 0.00 0.05 0.00 0.00 54.13 54.15 2k6y s LEU 28 Cb 0.00 -2.97 -0.05 0.00 -2.05 0.00 0.00 46.19 41.12 2k6y s LEU 28 CO 0.00 -0.61 0.86 -2.16 -0.55 0.00 0.00 176.35 173.89 2k6y s PRO 29 N -4.40 3.69 0.19 1.48 0.04 -1.26 -4.20 135.00 130.54 2k6y s PRO 29 Ca 0.47 0.50 0.05 0.00 0.04 0.00 0.00 61.00 62.07 2k6y s PRO 29 Cb -0.10 -2.29 -0.04 0.00 0.04 0.00 0.00 34.50 32.12 2k6y s PRO 29 CO 0.35 -0.23 0.19 -0.51 0.04 0.00 0.00 177.00 176.84 2k6y s LEU 30 N -4.44 3.93 -0.28 -3.56 1.43 0.04 -4.98 118.68 110.82 2k6y s LEU 30 Ca 0.52 -0.10 -0.01 0.00 -1.03 0.00 0.00 54.13 53.51 2k6y s LEU 30 Cb -0.10 -2.51 0.13 0.00 0.03 0.00 0.00 46.19 43.74 2k6y s LEU 30 CO 0.40 0.03 0.28 -0.60 0.23 0.00 0.00 176.35 176.69 2k6y s ARG 31 N -3.39 0.30 -0.50 1.70 3.52 -1.26 -0.22 118.95 119.09 2k6y s ARG 31 Ca 0.32 -0.13 -0.25 0.00 -0.13 0.00 0.00 55.73 55.54 2k6y s ARG 31 Cb -0.10 -0.74 0.03 0.00 -1.56 0.00 0.00 34.95 32.59 2k6y s ARG 31 CO 0.25 -0.99 0.95 -1.17 -0.81 0.00 0.00 175.30 173.53 2k6y s LEU 32 N 2.34 3.99 -0.01 -0.88 2.96 0.52 -1.23 118.68 126.38 2k6y s LEU 32 Ca 0.09 -0.04 0.22 0.00 -0.22 0.00 0.00 54.13 54.18 2k6y s LEU 32 Cb -0.14 -3.07 -0.26 0.00 0.50 0.00 0.00 46.19 43.22 2k6y s LEU 32 CO -0.31 -1.15 0.69 1.33 -1.32 0.00 0.00 176.35 175.59 2k6y n VAL 33 N 6.37 0.03 -4.01 1.68 0.24 0.63 -0.77 118.33 122.51 2k6y n VAL 33 Ca 0.05 -0.31 0.01 0.00 -2.04 0.00 0.00 64.34 62.05 2k6y n VAL 33 Cb 0.48 0.35 0.00 0.00 -1.47 0.00 0.00 33.84 33.20 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 1.35 0.35 2.99 7.63 0.00 -1.17 -4.68 105.19 111.66 2k6y n GLY 34 Ca -0.01 -0.83 -0.19 0.00 0.00 0.00 0.00 46.02 44.99 2k6y n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k6y n ALA 35 N -2.74 0.64 -3.67 4.61 0.00 -1.26 -1.15 120.51 116.93 2k6y n ALA 35 Ca -0.01 -1.82 -0.09 0.00 0.00 0.00 0.00 53.44 51.51 2k6y n ALA 35 Cb 0.08 1.42 -0.09 0.00 0.00 0.00 0.00 19.45 20.86 2k6y n ALA 35 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 2k6y s ARG 36 N -3.29 0.48 0.01 0.00 3.52 -0.42 -4.85 118.95 114.41 2k6y s ARG 36 Ca 0.33 0.97 -0.10 0.00 -0.13 0.00 0.00 55.73 56.80 2k6y s ARG 36 Cb 0.02 0.09 0.01 0.00 -1.56 0.00 0.00 34.95 33.51 2k6y s ARG 36 CO 0.23 -0.17 0.19 -0.08 -0.81 0.00 0.00 175.30 174.67 2k6y s THR 37 N 1.65 0.08 0.08 4.11 -1.32 -1.26 -0.60 115.64 118.38 2k6y s THR 37 Ca -0.09 -0.70 0.25 0.00 -1.21 0.00 0.00 61.69 59.94 2k6y s THR 37 Cb -0.08 -0.61 0.26 0.00 -1.51 0.00 0.00 72.50 70.56 2k6y s THR 37 CO -0.15 -0.39 1.81 1.55 -2.21 0.00 0.00 174.62 175.24 2k6y h PRO 38 N 3.95 0.00 0.00 7.08 0.13 -2.00 -3.36 132.00 137.80 2k6y h PRO 38 Ca -0.31 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 2k6y h PRO 38 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2k6y h PRO 38 CO 0.43 0.19 0.00 1.33 -0.23 0.00 0.00 178.00 179.72 2k6y n VAL 39 N -3.31 0.54 -4.18 1.56 0.24 -1.26 -4.21 118.33 107.71 2k6y n VAL 39 Ca 0.01 -0.06 -0.17 0.00 -2.04 0.00 0.00 64.34 62.08 2k6y n VAL 39 Cb 0.43 -0.72 -0.11 0.00 -1.47 0.00 0.00 33.84 31.97 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 -3.11 1.18 0.08 2.33 0.00 -1.26 -2.33 121.76 118.65 2k6y s ALA 40 Ca 0.10 -1.09 -0.32 0.00 0.00 0.00 0.00 51.96 50.64 2k6y s ALA 40 Cb 0.13 -0.05 -0.18 0.00 0.00 0.00 0.00 23.12 23.03 2k6y s ALA 40 CO 0.51 0.09 1.63 1.49 0.00 0.00 0.00 175.76 179.47 2k6y h GLU 41 N 3.96 -0.81 -5.09 0.00 4.22 -0.84 -3.38 114.58 112.63 2k6y h GLU 41 Ca -0.39 0.06 -0.54 0.00 0.08 0.00 0.00 59.36 58.56 2k6y h GLU 41 Cb 1.19 0.18 -0.13 0.00 0.50 0.00 0.00 28.75 30.49 2k6y h GLU 41 CO 0.46 -0.54 -0.54 0.50 -2.18 0.00 0.00 179.01 176.71 2k6y s ARG 42 N -6.05 1.88 -0.21 1.92 3.52 -1.24 -4.99 118.95 113.78 2k6y s ARG 42 Ca -0.17 -2.13 -0.18 0.00 -0.13 0.00 0.00 55.73 53.12 2k6y s ARG 42 Cb 0.04 -0.73 0.06 0.00 -1.56 0.00 0.00 34.95 32.75 2k6y s ARG 42 CO 0.62 -0.40 0.55 0.54 -0.81 0.00 0.00 175.30 175.80 2k6y s VAL 43 N -3.21 -0.00 -0.04 7.11 0.11 -1.26 -3.17 120.40 119.94 2k6y s VAL 43 Ca 0.25 0.01 -0.03 0.00 -2.93 0.00 0.00 61.98 59.29 2k6y s VAL 43 Cb 0.04 -0.78 0.01 0.00 -1.53 0.00 0.00 36.38 34.13 2k6y s VAL 43 CO 0.14 0.01 0.09 -1.61 -3.33 0.00 0.00 175.10 170.39 2k6y s GLU 44 N 0.60 0.09 -0.09 1.54 2.02 -0.75 -4.81 118.70 117.30 2k6y s GLU 44 Ca -0.02 0.16 -0.27 0.00 0.02 0.00 0.00 54.97 54.86 2k6y s GLU 44 Cb -0.05 -0.01 -0.02 0.00 0.10 0.00 0.00 34.13 34.15 2k6y s GLU 44 CO -0.04 -0.05 0.90 -1.17 0.02 0.00 0.00 175.26 174.92 2k6y s LEU 45 N 0.32 4.27 0.21 1.80 0.20 -1.26 -0.71 118.68 123.51 2k6y s LEU 45 Ca -0.02 1.41 0.11 0.00 0.69 0.00 0.00 54.13 56.32 2k6y s LEU 45 Cb -0.03 -3.39 -0.05 0.00 -0.43 0.00 0.00 46.19 42.29 2k6y s LEU 45 CO -0.01 -0.33 -0.22 -1.00 -0.29 0.00 0.00 176.35 174.51 2k6y s HIS 46 N 1.57 2.34 0.49 5.38 3.76 -0.04 -0.79 115.29 128.00 2k6y s HIS 46 Ca 0.45 -0.34 -0.00 0.00 -0.15 0.00 0.00 55.06 55.02 2k6y s HIS 46 Cb -0.18 -1.13 0.01 0.00 1.11 0.00 0.00 32.58 32.39 2k6y s HIS 46 CO 0.19 0.54 0.72 -1.83 -0.85 0.00 0.00 174.74 173.52 2k6y s GLU 47 N -2.86 2.90 -0.10 1.40 -1.05 0.24 -0.84 118.70 118.39 2k6y s GLU 47 Ca 0.23 -0.53 0.03 0.00 -0.15 0.00 0.00 54.97 54.55 2k6y s GLU 47 Cb -0.07 -2.51 0.01 0.00 -0.44 0.00 0.00 34.13 31.11 2k6y s GLU 47 CO 0.11 -0.44 -0.18 0.99 0.95 0.00 0.00 175.26 176.69 2k6y s THR 48 N -2.66 1.67 0.40 1.83 2.01 -0.79 -2.43 115.64 115.67 2k6y s THR 48 Ca 0.51 -0.77 0.06 0.00 0.31 0.00 0.00 61.69 61.80 2k6y s THR 48 Cb -0.10 -1.49 -0.07 0.00 0.01 0.00 0.00 72.50 70.85 2k6y s THR 48 CO 0.39 0.47 0.03 0.72 -0.69 0.00 0.00 174.62 175.54 2k6y s PHE 49 N 0.70 2.30 -0.09 4.92 -0.12 -0.10 -4.60 117.98 120.98 2k6y s PHE 49 Ca -0.12 -0.79 0.02 0.00 -0.05 0.00 0.00 56.93 55.99 2k6y s PHE 49 Cb -0.16 -1.62 0.01 0.00 -0.63 0.00 0.00 43.02 40.62 2k6y s PHE 49 CO 0.03 0.29 -0.15 -1.64 -0.05 0.00 0.00 175.22 173.70 2k6y s MET 50 N -3.77 2.13 0.20 1.99 -1.94 -1.26 -2.91 119.30 113.75 2k6y s MET 50 Ca 0.33 -0.54 -0.15 0.00 -1.71 0.00 0.00 55.69 53.61 2k6y s MET 50 Cb 0.09 -1.78 0.01 0.00 2.01 0.00 0.00 34.83 35.16 2k6y s MET 50 CO 0.16 -0.01 0.47 1.03 -0.01 0.00 0.00 175.02 176.66 2k6y s ARG 51 N 0.84 1.37 0.58 2.03 3.00 -0.84 -5.00 118.95 120.93 2k6y s ARG 51 Ca -0.10 -0.99 -0.17 0.00 0.00 0.00 0.00 55.73 54.46 2k6y s ARG 51 Cb -0.15 0.49 -0.04 0.00 0.00 0.00 0.00 34.95 35.24 2k6y s ARG 51 CO 0.01 -0.57 1.09 -1.21 0.00 0.00 0.00 175.30 174.63 2k6y s GLU 52 N -3.92 3.25 0.00 3.54 8.01 -1.26 -0.14 118.70 128.18 2k6y s GLU 52 Ca 0.13 1.42 0.00 0.00 0.01 0.00 0.00 54.97 56.53 2k6y s GLU 52 Cb -0.00 -2.01 0.00 0.00 -4.31 0.00 0.00 34.13 27.81 2k6y s GLU 52 CO -0.00 -0.89 0.00 0.28 0.01 0.00 0.00 175.26 174.66 2k6y n VAL 53 N -1.73 0.00 -0.96 2.63 0.31 -0.18 -4.83 118.33 113.57 2k6y n VAL 53 Ca 0.10 0.00 -0.14 0.00 -0.01 0.00 0.00 64.34 64.29 2k6y n VAL 53 Cb 0.52 -0.01 -0.14 0.00 -0.91 0.00 0.00 33.84 33.30 2k6y n VAL 53 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 2k6y n GLU 54 N -0.36 2.05 0.00 5.55 2.13 -1.26 -4.63 120.64 124.13 2k6y n GLU 54 Ca 0.00 -1.07 0.00 0.00 0.66 0.00 0.00 57.16 56.75 2k6y n GLU 54 Cb 0.00 -2.06 0.00 0.00 0.27 0.00 0.00 31.44 29.65 2k6y n GLU 54 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2k6y n GLY 55 N 2.68 1.19 3.77 8.31 0.00 -1.26 -4.91 105.19 114.97 2k6y n GLY 55 Ca 0.44 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.23 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 0.00 2.75 0.26 1.61 1.02 -1.26 -4.98 119.74 119.14 2k6y s LYS 56 Ca 0.00 -1.13 -0.29 0.00 0.02 0.00 0.00 55.97 54.57 2k6y s LYS 56 Cb 0.00 -2.47 -0.09 0.00 -0.52 0.00 0.00 37.83 34.75 2k6y s LYS 56 CO 0.00 0.40 1.17 0.21 -0.92 0.00 0.00 175.35 176.21 2k6y s LYS 57 N -3.69 4.54 0.05 1.68 2.20 -1.26 -1.01 119.74 122.26 2k6y s LYS 57 Ca 0.32 1.90 0.01 0.00 -0.36 0.00 0.00 55.97 57.84 2k6y s LYS 57 Cb -0.08 -3.19 -0.03 0.00 -1.51 0.00 0.00 37.83 33.03 2k6y s LYS 57 CO 0.23 0.04 -0.05 0.08 -0.36 0.00 0.00 175.35 175.29 2k6y s VAL 58 N -0.79 0.42 -0.04 4.02 1.01 0.80 -4.91 120.40 120.90 2k6y s VAL 58 Ca 0.48 -1.42 0.05 0.00 0.00 0.00 0.00 61.98 61.08 2k6y s VAL 58 Cb -0.34 -1.01 -0.00 0.00 0.00 0.00 0.00 36.38 35.03 2k6y s VAL 58 CO 0.42 -0.67 -0.18 0.00 0.00 0.00 0.00 175.10 174.67 2k6y s MET 59 N -2.65 1.84 0.20 2.72 0.23 -1.26 -1.98 119.30 118.40 2k6y s MET 59 Ca -0.02 -0.64 -0.21 0.00 -1.03 0.00 0.00 55.69 53.79 2k6y s MET 59 Cb -0.02 -1.61 0.07 0.00 -1.53 0.00 0.00 34.83 31.75 2k6y s MET 59 CO -0.03 0.27 1.00 0.41 -2.03 0.00 0.00 175.02 174.63 2k6y n GLY 60 N 3.09 0.64 3.99 3.16 0.00 -1.14 -4.98 105.19 109.94 2k6y n GLY 60 Ca -0.18 -1.16 -0.19 0.00 0.00 0.00 0.00 46.02 44.49 2k6y n GLY 60 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2k6y s MET 61 N -2.05 3.01 -0.14 1.61 -1.94 -1.26 -0.93 119.30 117.59 2k6y s MET 61 Ca 0.22 -0.95 -0.31 0.00 -1.71 0.00 0.00 55.69 52.94 2k6y s MET 61 Cb -0.03 -2.74 0.13 0.00 2.01 0.00 0.00 34.83 34.20 2k6y s MET 61 CO 0.06 -0.12 1.07 -0.98 -0.01 0.00 0.00 175.02 175.04 2k6y s ARG 62 N -4.32 0.51 0.77 2.03 1.70 -1.02 -4.97 118.95 113.65 2k6y s ARG 62 Ca 0.48 -0.06 -0.13 0.00 -0.47 0.00 0.00 55.73 55.55 2k6y s ARG 62 Cb -0.10 0.24 0.06 0.00 -0.57 0.00 0.00 34.95 34.58 2k6y s ARG 62 CO 0.33 -0.20 1.15 -2.14 -1.08 0.00 0.00 175.30 173.36 2k6y s PRO 63 N -2.02 2.02 0.15 3.89 0.02 -1.26 -0.59 135.00 137.20 2k6y s PRO 63 Ca 0.05 1.51 0.05 0.00 0.02 0.00 0.00 61.00 62.62 2k6y s PRO 63 Cb -0.01 -1.84 -0.04 0.00 0.02 0.00 0.00 34.50 32.62 2k6y s PRO 63 CO -0.04 -1.88 -0.11 0.14 -0.33 0.00 0.00 177.00 174.78 2k6y s VAL 64 N -2.42 1.24 0.18 3.83 -7.23 0.03 -4.70 120.40 111.33 2k6y s VAL 64 Ca 0.68 -2.02 0.22 0.00 -1.81 0.00 0.00 61.98 59.06 2k6y s VAL 64 Cb -0.23 -1.81 0.21 0.00 0.56 0.00 0.00 36.38 35.11 2k6y s VAL 64 CO 0.50 -0.68 1.82 1.55 -0.31 0.00 0.00 175.10 177.98 2k6y h PRO 65 N 2.88 0.00 -1.17 4.82 0.13 -1.94 -3.43 132.00 133.30 2k6y h PRO 65 Ca -0.37 0.00 0.40 0.00 -0.87 0.00 0.00 66.00 65.15 2k6y h PRO 65 Cb 1.19 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.19 2k6y h PRO 65 CO 0.61 0.26 0.99 -0.59 -0.23 0.00 0.00 178.00 179.04 2k6y s PHE 66 N -3.71 -0.00 0.38 1.56 -0.12 -1.26 -4.77 117.98 110.06 2k6y s PHE 66 Ca -0.00 -0.01 0.08 0.00 -0.05 0.00 0.00 56.93 56.95 2k6y s PHE 66 Cb 0.11 0.50 -0.07 0.00 -0.63 0.00 0.00 43.02 42.93 2k6y s PHE 66 CO 0.65 -0.03 -0.01 -0.51 -0.05 0.00 0.00 175.22 175.27 2k6y s LEU 67 N -3.12 2.87 0.07 -1.99 1.43 0.05 -5.01 118.68 112.98 2k6y s LEU 67 Ca 0.17 -1.23 -0.19 0.00 -1.03 0.00 0.00 54.13 51.84 2k6y s LEU 67 Cb 0.07 -1.05 0.04 0.00 0.03 0.00 0.00 46.19 45.29 2k6y s LEU 67 CO -0.06 -0.35 0.46 -1.83 0.23 0.00 0.00 176.35 174.80 2k6y s GLU 68 N -3.70 1.02 -0.04 1.70 -1.05 -1.26 -0.36 118.70 115.02 2k6y s GLU 68 Ca 0.35 -0.42 -0.00 0.00 -0.15 0.00 0.00 54.97 54.75 2k6y s GLU 68 Cb 0.06 0.46 0.03 0.00 -0.44 0.00 0.00 34.13 34.23 2k6y s GLU 68 CO 0.18 -0.38 0.01 0.08 0.95 0.00 0.00 175.26 176.10 2k6y s VAL 69 N -2.90 0.19 0.72 1.83 1.01 0.69 -4.96 120.40 116.99 2k6y s VAL 69 Ca -0.03 0.12 -0.11 0.00 0.00 0.00 0.00 61.98 61.97 2k6y s VAL 69 Cb -0.00 -0.32 0.02 0.00 0.00 0.00 0.00 36.38 36.09 2k6y s VAL 69 CO -0.05 0.17 1.07 -2.16 0.00 0.00 0.00 175.10 174.13 2k6y s PRO 70 N 1.32 2.72 0.37 2.72 0.04 -1.26 -0.78 135.00 140.12 2k6y s PRO 70 Ca -0.06 0.97 -0.28 0.00 0.04 0.00 0.00 61.00 61.67 2k6y s PRO 70 Cb -0.13 -1.96 -0.11 0.00 0.04 0.00 0.00 34.50 32.34 2k6y s PRO 70 CO -0.02 -1.26 1.47 -1.25 0.04 0.00 0.00 177.00 175.97 2k6y s PRO 71 N -5.02 4.13 0.00 0.56 0.04 -1.26 -2.26 135.00 131.19 2k6y s PRO 71 Ca 0.59 2.54 0.00 0.00 0.04 0.00 0.00 61.00 64.17 2k6y s PRO 71 Cb -0.15 -2.98 0.00 0.00 0.04 0.00 0.00 34.50 31.41 2k6y s PRO 71 CO 0.55 -0.50 0.00 1.63 0.04 0.00 0.00 177.00 178.72 2k6y n LYS 72 N 0.49 0.00 -2.53 4.56 4.76 0.03 -4.98 118.16 120.50 2k6y n LYS 72 Ca 0.01 0.00 -0.16 0.00 -2.87 0.00 0.00 58.31 55.29 2k6y n LYS 72 Cb 0.39 -3.24 0.06 0.00 -1.84 0.00 0.00 35.03 30.40 2k6y n LYS 72 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2k6y n GLY 73 N -2.00 1.79 3.47 0.72 0.00 -0.96 -4.90 105.19 103.32 2k6y n GLY 73 Ca 0.00 -2.18 -0.13 0.00 0.00 0.00 0.00 46.02 43.71 2k6y n GLY 73 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2k6y s ARG 74 N -4.16 1.08 0.21 1.61 1.70 -1.26 -1.09 118.95 117.05 2k6y s ARG 74 Ca 0.49 -0.19 0.07 0.00 -0.47 0.00 0.00 55.73 55.64 2k6y s ARG 74 Cb -0.04 0.50 -0.05 0.00 -0.57 0.00 0.00 34.95 34.80 2k6y s ARG 74 CO 0.31 -0.43 -0.12 0.14 -1.08 0.00 0.00 175.30 174.12 2k6y s VAL 75 N -2.72 1.66 -0.04 4.99 -7.23 -0.31 -5.01 120.40 111.74 2k6y s VAL 75 Ca -0.02 -2.18 0.05 0.00 -1.81 0.00 0.00 61.98 58.02 2k6y s VAL 75 Cb -0.01 -2.11 -0.01 0.00 0.56 0.00 0.00 36.38 34.82 2k6y s VAL 75 CO -0.05 -0.55 -0.20 -0.70 -0.31 0.00 0.00 175.10 173.29 2k6y s GLU 76 N -3.67 2.04 -0.76 4.82 2.12 -1.26 -1.33 118.70 120.66 2k6y s GLU 76 Ca 0.23 -0.73 -0.07 0.00 0.36 0.00 0.00 54.97 54.77 2k6y s GLU 76 Cb 0.00 -1.78 -0.14 0.00 0.26 0.00 0.00 34.13 32.48 2k6y s GLU 76 CO 0.07 0.32 2.80 1.28 -0.54 0.00 0.00 175.26 179.19 2k6y n LEU 77 N 3.00 5.94 -4.61 2.70 4.32 0.18 -4.79 117.00 123.74 2k6y n LEU 77 Ca -0.17 -3.30 -0.49 0.00 -0.02 0.00 0.00 56.01 52.03 2k6y n LEU 77 Cb 0.53 -1.28 -0.05 0.00 -1.62 0.00 0.00 43.42 41.00 2k6y n LEU 77 CO 0.25 1.39 0.89 2.29 -1.22 0.00 0.00 177.39 180.99 2k6y n LYS 78 N 3.31 1.41 -0.20 3.23 2.85 -1.23 -3.95 118.16 123.58 2k6y n LYS 78 Ca 0.52 0.51 0.05 0.00 -1.05 0.00 0.00 58.31 58.33 2k6y n LYS 78 Cb 0.43 -2.12 0.31 0.00 -0.65 0.00 0.00 35.03 33.00 2k6y n LYS 78 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 177.40 176.35 2k6y h PRO 79 N 4.26 0.83 -2.19 -1.58 0.13 -1.93 -1.06 132.00 130.46 2k6y h PRO 79 Ca -0.45 -0.05 -0.42 0.00 -0.87 0.00 0.00 66.00 64.21 2k6y h PRO 79 Cb 1.32 -0.19 -0.10 0.00 0.13 0.00 0.00 31.00 32.16 2k6y h PRO 79 CO 0.76 0.55 0.72 0.41 -0.23 0.00 0.00 178.00 180.21 2k6y n GLY 80 N -1.43 3.88 0.00 1.56 0.00 -1.26 -4.80 105.19 103.14 2k6y n GLY 80 Ca 0.10 -1.58 0.00 0.00 0.00 0.00 0.00 46.02 44.54 2k6y n GLY 80 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k6y n GLY 81 N 1.96 1.38 3.77 -0.02 0.00 -0.40 -4.90 105.19 106.98 2k6y n GLY 81 Ca 0.52 -0.14 -0.40 0.00 0.00 0.00 0.00 46.02 46.00 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 -0.18 3.01 0.22 1.61 2.02 -1.23 -1.89 117.35 120.91 2k6y s TYR 82 Ca 0.00 1.47 -0.22 0.00 -0.37 0.00 0.00 57.07 57.94 2k6y s TYR 82 Cb 0.00 -3.59 0.04 0.00 -0.40 0.00 0.00 41.96 38.02 2k6y s TYR 82 CO 0.00 -1.73 0.68 -3.38 -1.57 0.00 0.00 175.55 169.55 2k6y s HIS 83 N -1.25 -0.33 -0.22 2.71 -3.43 -0.02 -3.55 115.29 109.21 2k6y s HIS 83 Ca 0.53 -0.02 -0.15 0.00 -0.80 0.00 0.00 55.06 54.63 2k6y s HIS 83 Cb -0.37 0.64 -0.04 0.00 -1.43 0.00 0.00 32.58 31.39 2k6y s HIS 83 CO 0.47 -1.06 0.35 -0.06 -2.00 0.00 0.00 174.74 172.45 2k6y s PHE 84 N -3.82 3.33 -0.23 0.38 0.08 -0.65 -0.86 117.98 116.21 2k6y s PHE 84 Ca 0.07 0.50 -0.11 0.00 0.12 0.00 0.00 56.93 57.51 2k6y s PHE 84 Cb -0.04 -2.49 -0.05 0.00 -0.57 0.00 0.00 43.02 39.87 2k6y s PHE 84 CO -0.01 -0.05 0.17 1.41 -0.10 0.00 0.00 175.22 176.64 2k6y s MET 85 N 1.45 4.10 -0.05 0.44 1.75 0.11 -1.57 119.30 125.54 2k6y s MET 85 Ca 0.16 -0.22 0.04 0.00 -1.25 0.00 0.00 55.69 54.42 2k6y s MET 85 Cb -0.15 -3.51 -0.03 0.00 2.84 0.00 0.00 34.83 33.98 2k6y s MET 85 CO 0.08 0.10 -0.15 -0.51 -0.65 0.00 0.00 175.02 173.89 2k6y s LEU 86 N 0.93 2.71 0.22 4.11 2.01 -0.35 -1.82 118.68 126.50 2k6y s LEU 86 Ca 0.09 -0.21 0.03 0.00 0.01 0.00 0.00 54.13 54.05 2k6y s LEU 86 Cb -0.13 -1.55 -0.05 0.00 0.01 0.00 0.00 46.19 44.47 2k6y s LEU 86 CO 0.04 0.34 0.02 -0.76 1.01 0.00 0.00 176.35 176.99 2k6y s LEU 87 N -0.71 2.08 -1.59 1.79 1.02 -1.19 -0.80 118.68 119.29 2k6y s LEU 87 Ca 0.11 -1.24 -0.14 0.00 0.02 0.00 0.00 54.13 52.88 2k6y s LEU 87 Cb -0.11 -0.17 0.11 0.00 0.02 0.00 0.00 46.19 46.04 2k6y s LEU 87 CO 0.01 -0.56 0.85 0.61 0.02 0.00 0.00 176.35 177.27 2k6y n GLY 88 N -0.39 -0.45 3.64 -3.19 0.00 -0.50 -0.60 105.19 103.71 2k6y n GLY 88 Ca -0.05 0.16 -0.50 0.00 0.00 0.00 0.00 46.02 45.63 2k6y n GLY 88 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2k6y n LEU 89 N -4.52 2.98 -0.21 0.99 4.77 -1.19 -3.30 117.00 116.52 2k6y n LEU 89 Ca 0.01 0.84 0.14 0.00 -0.03 0.00 0.00 56.01 56.97 2k6y n LEU 89 Cb 0.53 -1.31 0.58 0.00 -2.33 0.00 0.00 43.42 40.88 2k6y n LEU 89 CO 0.80 -0.29 0.85 2.29 -1.33 0.00 0.00 177.39 179.70 2k6y n LYS 90 N 6.84 0.98 -4.19 3.23 2.85 -0.99 -4.53 118.16 122.35 2k6y n LYS 90 Ca 0.27 -0.43 -0.30 0.00 -1.05 0.00 0.00 58.31 56.81 2k6y n LYS 90 Cb 0.26 -1.49 -0.09 0.00 -0.65 0.00 0.00 35.03 33.06 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 -2.32 2.28 0.05 -1.58 0.52 -0.98 -4.90 118.95 112.02 2k6y s ARG 91 Ca 0.32 -0.97 0.21 0.00 -0.52 0.00 0.00 55.73 54.77 2k6y s ARG 91 Cb 0.20 -2.38 0.88 0.00 0.52 0.00 0.00 34.95 34.17 2k6y s ARG 91 CO 0.44 0.51 1.67 -0.35 0.02 0.00 0.00 175.30 177.60 2k6y n PRO 92 N 0.58 0.04 -0.18 3.54 -0.04 -1.26 -4.87 135.00 132.81 2k6y n PRO 92 Ca -0.12 0.19 0.02 0.00 -0.04 0.00 0.00 63.50 63.55 2k6y n PRO 92 Cb 0.52 -1.57 -0.01 0.00 -0.04 0.00 0.00 33.50 32.41 2k6y n PRO 92 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2k6y n LEU 93 N -1.65 0.00 -3.37 1.53 4.32 -1.26 -4.91 117.00 111.66 2k6y n LEU 93 Ca 0.05 0.20 0.02 0.00 -0.02 0.00 0.00 56.01 56.25 2k6y n LEU 93 Cb 0.25 -0.55 -0.04 0.00 -1.62 0.00 0.00 43.42 41.47 2k6y n LEU 93 CO 0.20 -0.74 0.60 -0.75 -1.22 0.00 0.00 177.39 175.47 2k6y s LYS 94 N -0.48 0.29 0.09 3.23 2.47 -1.26 -5.08 119.74 119.00 2k6y s LYS 94 Ca 0.00 0.71 -0.31 0.00 -1.56 0.00 0.00 55.97 54.81 2k6y s LYS 94 Cb 0.00 0.42 -0.09 0.00 -1.46 0.00 0.00 37.83 36.70 2k6y s LYS 94 CO 0.00 -0.12 1.76 0.00 0.16 0.00 0.00 175.35 177.15 2k6y s ALA 95 N 2.50 3.71 -0.89 3.13 0.00 -1.26 -1.82 121.76 127.13 2k6y s ALA 95 Ca -0.02 1.33 -0.02 0.00 0.00 0.00 0.00 51.96 53.25 2k6y s ALA 95 Cb -0.07 -3.74 -0.03 0.00 0.00 0.00 0.00 23.12 19.29 2k6y s ALA 95 CO -0.17 -1.21 0.76 0.41 0.00 0.00 0.00 175.76 175.55 2k6y n GLY 96 N 4.16 -0.45 3.69 0.00 0.00 -1.16 -5.06 105.19 106.37 2k6y n GLY 96 Ca 0.17 0.18 -0.23 0.00 0.00 0.00 0.00 46.02 46.14 2k6y n GLY 96 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2k6y s GLU 97 N -4.61 2.33 -0.38 1.61 -1.05 -0.76 -5.00 118.70 110.84 2k6y s GLU 97 Ca 0.17 -1.51 -0.06 0.00 -0.15 0.00 0.00 54.97 53.42 2k6y s GLU 97 Cb -0.02 -2.15 0.07 0.00 -0.44 0.00 0.00 34.13 31.59 2k6y s GLU 97 CO 0.58 0.21 0.17 -1.21 0.95 0.00 0.00 175.26 175.96 2k6y s GLU 98 N -3.77 2.43 -0.40 -4.83 8.01 -1.26 -0.73 118.70 118.14 2k6y s GLU 98 Ca 0.35 -1.46 -0.24 0.00 0.01 0.00 0.00 54.97 53.63 2k6y s GLU 98 Cb -0.04 -3.56 0.02 0.00 -4.31 0.00 0.00 34.13 26.24 2k6y s GLU 98 CO 0.21 -0.87 0.82 0.08 0.01 0.00 0.00 175.26 175.52 2k6y s VAL 99 N 1.32 4.65 0.26 2.63 1.01 0.79 -4.85 120.40 126.22 2k6y s VAL 99 Ca 0.02 0.79 -0.29 0.00 0.00 0.00 0.00 61.98 62.49 2k6y s VAL 99 Cb -0.22 -4.29 -0.09 0.00 0.00 0.00 0.00 36.38 31.78 2k6y s VAL 99 CO 0.00 -0.58 1.22 -1.61 0.00 0.00 0.00 175.10 174.13 2k6y s GLU 100 N 3.30 4.48 -0.13 2.72 2.02 -1.26 -0.81 118.70 129.02 2k6y s GLU 100 Ca 0.33 1.99 -0.10 0.00 0.02 0.00 0.00 54.97 57.20 2k6y s GLU 100 Cb -0.12 -3.17 0.04 0.00 0.10 0.00 0.00 34.13 30.98 2k6y s GLU 100 CO 0.20 -0.06 0.34 -1.17 0.02 0.00 0.00 175.26 174.59 2k6y s LEU 101 N -1.02 0.44 -0.43 1.80 0.20 -0.17 -4.24 118.68 115.27 2k6y s LEU 101 Ca 0.50 0.70 -0.22 0.00 0.69 0.00 0.00 54.13 55.81 2k6y s LEU 101 Cb -0.35 1.12 0.02 0.00 -0.43 0.00 0.00 46.19 46.55 2k6y s LEU 101 CO 0.43 -0.15 0.70 -1.81 -0.29 0.00 0.00 176.35 175.23 2k6y s ASP 102 N 0.71 6.38 -0.27 3.68 1.01 0.23 -0.41 116.67 128.00 2k6y s ASP 102 Ca -0.04 -0.15 -0.29 0.00 0.71 0.00 0.00 52.55 52.78 2k6y s ASP 102 Cb -0.05 -2.35 0.01 0.00 1.01 0.00 0.00 42.92 41.54 2k6y s ASP 102 CO -0.05 -0.79 1.11 -0.76 0.21 0.00 0.00 175.17 174.89 2k6y s LEU 103 N 2.98 4.02 -0.24 1.23 1.43 -0.07 -1.30 118.68 126.72 2k6y s LEU 103 Ca 0.26 1.26 -0.18 0.00 -1.03 0.00 0.00 54.13 54.44 2k6y s LEU 103 Cb -0.13 -3.54 -0.03 0.00 0.03 0.00 0.00 46.19 42.51 2k6y s LEU 103 CO 0.19 -0.81 0.49 -0.76 0.23 0.00 0.00 176.35 175.70 2k6y s LEU 104 N 3.55 4.08 -0.17 1.79 1.43 -0.30 -2.09 118.68 126.97 2k6y s LEU 104 Ca 0.47 0.54 0.00 0.00 -1.03 0.00 0.00 54.13 54.11 2k6y s LEU 104 Cb -0.15 -2.64 0.01 0.00 0.03 0.00 0.00 46.19 43.44 2k6y s LEU 104 CO 0.13 -0.24 -0.17 -0.36 0.23 0.00 0.00 176.35 175.94 2k6y s PHE 105 N 2.05 2.79 -0.74 0.29 0.08 0.40 -0.26 117.98 122.59 2k6y s PHE 105 Ca 0.21 -1.38 0.00 0.00 0.12 0.00 0.00 56.93 55.88 2k6y s PHE 105 Cb -0.15 -1.92 0.00 0.00 -0.57 0.00 0.00 43.02 40.37 2k6y s PHE 105 CO 0.09 -0.68 0.00 0.00 -0.10 0.00 0.00 175.22 174.54 2k6y n ALA 106 N 4.45 -0.38 -0.81 5.36 0.00 -0.36 -1.96 120.51 126.80 2k6y n ALA 106 Ca -0.20 0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.34 2k6y n ALA 106 Cb 0.51 -0.97 0.00 0.00 0.00 0.00 0.00 19.45 18.99 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 -0.33 0.58 0.00 0.00 0.00 -1.26 -4.81 105.19 99.37 2k6y n GLY 107 Ca -0.08 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.85 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 -2.81 0.03 3.80 -0.02 0.00 -1.01 -5.10 105.19 100.08 2k6y n GLY 108 Ca 0.00 -0.01 -0.39 0.00 0.00 0.00 0.00 46.02 45.62 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 -1.00 4.22 -0.01 1.61 -0.14 -0.83 -5.01 119.74 118.58 2k6y s LYS 109 Ca 0.00 0.75 -0.02 0.00 -1.36 0.00 0.00 55.97 55.34 2k6y s LYS 109 Cb 0.00 -3.25 0.00 0.00 -1.68 0.00 0.00 37.83 32.90 2k6y s LYS 109 CO 0.00 0.61 0.04 0.54 -0.76 0.00 0.00 175.35 175.78 2k6y s VAL 110 N -1.02 0.01 -0.05 3.17 0.11 -1.26 -0.45 120.40 120.91 2k6y s VAL 110 Ca 0.29 -0.05 -0.02 0.00 -2.93 0.00 0.00 61.98 59.28 2k6y s VAL 110 Cb -0.19 -0.08 0.03 0.00 -1.53 0.00 0.00 36.38 34.61 2k6y s VAL 110 CO 0.19 -0.03 0.09 -0.76 -3.33 0.00 0.00 175.10 171.26 2k6y s LEU 111 N -0.06 0.33 0.19 2.54 1.43 -0.89 -4.97 118.68 117.26 2k6y s LEU 111 Ca -0.01 0.15 -0.26 0.00 -1.03 0.00 0.00 54.13 52.98 2k6y s LEU 111 Cb -0.01 0.02 -0.08 0.00 0.03 0.00 0.00 46.19 46.15 2k6y s LEU 111 CO 0.00 -0.21 0.82 -1.59 0.23 0.00 0.00 176.35 175.59 2k6y s LYS 112 N 1.88 4.62 0.33 1.70 -2.85 -1.26 -0.90 119.74 123.27 2k6y s LYS 112 Ca 0.00 1.23 0.08 0.00 -1.00 0.00 0.00 55.97 56.28 2k6y s LYS 112 Cb -0.12 -3.23 -0.06 0.00 -2.06 0.00 0.00 37.83 32.35 2k6y s LYS 112 CO -0.04 0.54 -0.07 0.14 0.10 0.00 0.00 175.35 176.03 2k6y s VAL 113 N -1.19 2.01 -0.02 1.79 -7.23 0.46 -4.95 120.40 111.26 2k6y s VAL 113 Ca 0.38 -2.15 0.08 0.00 -1.81 0.00 0.00 61.98 58.47 2k6y s VAL 113 Cb -0.23 -2.64 -0.02 0.00 0.56 0.00 0.00 36.38 34.05 2k6y s VAL 113 CO 0.27 -0.20 -0.26 0.54 -0.31 0.00 0.00 175.10 175.15 2k6y s VAL 114 N -2.76 2.04 -0.03 1.32 0.11 -1.26 -1.00 120.40 118.83 2k6y s VAL 114 Ca 0.32 -1.10 0.00 0.00 -2.93 0.00 0.00 61.98 58.27 2k6y s VAL 114 Cb 0.04 -1.70 0.03 0.00 -1.53 0.00 0.00 36.38 33.22 2k6y s VAL 114 CO 0.15 0.58 0.01 -0.76 -3.33 0.00 0.00 175.10 171.75 2k6y s LEU 115 N -0.55 1.16 0.39 2.54 1.43 0.01 -4.97 118.68 118.69 2k6y s LEU 115 Ca 0.08 -0.01 -0.25 0.00 -1.03 0.00 0.00 54.13 52.92 2k6y s LEU 115 Cb -0.10 -0.18 -0.09 0.00 0.03 0.00 0.00 46.19 45.85 2k6y s LEU 115 CO -0.00 -0.10 1.10 -2.16 0.23 0.00 0.00 176.35 175.41 2k6y s PRO 116 N 1.01 4.16 -0.26 1.29 0.04 -1.26 -0.15 135.00 139.83 2k6y s PRO 116 Ca -0.10 1.66 -0.29 0.00 0.04 0.00 0.00 61.00 62.31 2k6y s PRO 116 Cb -0.13 -2.65 0.01 0.00 0.04 0.00 0.00 34.50 31.77 2k6y s PRO 116 CO -0.02 -0.18 1.06 0.08 0.04 0.00 0.00 177.00 177.98 2k6y s VAL 117 N -1.52 4.61 -0.01 -0.36 1.01 0.09 -1.38 120.40 122.83 2k6y s VAL 117 Ca 0.56 1.91 -0.02 0.00 0.00 0.00 0.00 61.98 64.43 2k6y s VAL 117 Cb -0.26 -4.35 -0.04 0.00 0.00 0.00 0.00 36.38 31.73 2k6y s VAL 117 CO 0.33 -0.30 0.14 -0.70 0.00 0.00 0.00 175.10 174.57 2k6y s GLU 118 N 3.38 3.30 -0.30 2.72 -6.30 0.15 -2.98 118.70 118.68 2k6y s GLU 118 Ca 0.45 -0.37 -0.00 0.00 -2.50 0.00 0.00 54.97 52.54 2k6y s GLU 118 Cb -0.14 -3.01 0.09 0.00 0.00 0.00 0.00 34.13 31.07 2k6y s GLU 118 CO 0.10 0.67 0.07 0.00 0.02 0.00 0.00 175.26 176.12 2k6y s ALA 119 N -1.26 1.69 0.00 6.30 0.00 -1.26 -0.76 121.76 126.47 2k6y s ALA 119 Ca 0.25 -1.66 0.00 0.00 0.00 0.00 0.00 51.96 50.54 2k6y s ALA 119 Cb -0.12 -1.61 0.00 0.00 0.00 0.00 0.00 23.12 21.39 2k6y s ALA 119 CO 0.16 -1.59 0.00 0.54 0.00 0.00 0.00 175.76 174.88