#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 3.40 0.00 1.61 7.64 -1.26 -4.55 113.62 120.46 2k6y n SER 2 Ca 0.00 -2.70 0.00 0.00 1.01 0.00 0.00 58.87 57.18 2k6y n SER 2 Cb 0.00 -0.65 0.00 0.00 -1.01 0.00 0.00 64.21 62.55 2k6y n SER 2 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 2k6y n PHE 3 N -0.10 0.00 -2.84 1.43 3.72 -1.26 -5.02 117.46 113.39 2k6y n PHE 3 Ca 0.25 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 57.21 2k6y n PHE 3 Cb 0.97 -0.13 -0.02 0.00 -0.94 0.00 0.00 39.48 39.37 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 -2.69 4.64 -0.01 4.37 -4.23 -1.26 -4.97 115.64 111.49 2k6y s THR 4 Ca 0.00 -1.83 0.05 0.00 -1.18 0.00 0.00 61.69 58.72 2k6y s THR 4 Cb 0.00 -4.91 -0.03 0.00 1.34 0.00 0.00 72.50 68.90 2k6y s THR 4 CO 0.00 -1.66 -0.13 -1.61 -0.54 0.00 0.00 174.62 170.67 2k6y s GLU 5 N 2.84 2.38 0.11 3.99 0.41 -1.23 -3.13 118.70 124.07 2k6y s GLU 5 Ca 0.40 -0.79 -0.08 0.00 -0.41 0.00 0.00 54.97 54.10 2k6y s GLU 5 Cb -0.03 -2.35 0.03 0.00 -1.78 0.00 0.00 34.13 30.00 2k6y s GLU 5 CO -0.05 0.59 0.38 0.41 -0.49 0.00 0.00 175.26 176.10 2k6y n GLY 6 N 1.89 1.23 3.44 -1.39 0.00 -1.26 0.14 105.19 109.24 2k6y n GLY 6 Ca -0.16 -1.05 -0.14 0.00 0.00 0.00 0.00 46.02 44.67 2k6y n GLY 6 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 2k6y s TRP 7 N -5.12 -0.59 -0.09 1.61 -2.14 -0.11 -4.24 118.94 108.26 2k6y s TRP 7 Ca 0.08 1.41 -0.12 0.00 2.66 0.00 0.00 56.10 60.13 2k6y s TRP 7 Cb -0.01 0.21 -0.05 0.00 -3.10 0.00 0.00 33.47 30.52 2k6y s TRP 7 CO 0.03 -0.31 0.30 0.08 -2.66 0.00 0.00 176.95 174.39 2k6y s VAL 8 N 0.15 5.26 -0.18 -0.66 1.01 0.07 -1.56 120.40 124.50 2k6y s VAL 8 Ca -0.01 0.57 0.17 0.00 0.00 0.00 0.00 61.98 62.71 2k6y s VAL 8 Cb -0.04 -3.60 0.03 0.00 0.00 0.00 0.00 36.38 32.77 2k6y s VAL 8 CO 0.01 0.52 1.26 -0.09 0.00 0.00 0.00 175.10 176.81 2k6y h ARG 9 N 5.49 0.00 -2.13 2.72 1.12 -0.97 0.07 114.38 120.67 2k6y h ARG 9 Ca -0.49 0.00 0.25 0.00 -1.11 0.00 0.00 59.98 58.63 2k6y h ARG 9 Cb 1.20 0.00 -0.08 0.00 -0.01 0.00 0.00 29.97 31.08 2k6y h ARG 9 CO 0.66 0.37 -0.48 0.34 -3.11 0.00 0.00 179.97 177.74 2k6y n PHE 10 N -3.09 -2.39 -3.79 2.20 -0.00 -1.22 -2.12 117.46 107.05 2k6y n PHE 10 Ca -0.01 1.23 0.01 0.00 -0.00 0.00 0.00 57.45 58.68 2k6y n PHE 10 Cb 0.73 -2.17 0.00 0.00 -0.00 0.00 0.00 39.48 38.05 2k6y n PHE 10 CO 0.00 0.00 0.00 -1.12 -0.00 0.00 0.00 176.76 175.64 2k6y s SER 11 N -5.97 -0.03 0.52 -2.13 0.01 -1.26 -4.36 113.70 100.48 2k6y s SER 11 Ca 0.00 -0.23 0.31 0.00 1.31 0.00 0.00 55.95 57.33 2k6y s SER 11 Cb 0.00 0.21 1.32 0.00 0.21 0.00 0.00 66.02 67.76 2k6y s SER 11 CO 0.00 -0.40 1.98 1.55 0.41 0.00 0.00 173.24 176.77 2k6y h PRO 12 N 2.00 0.00 0.00 12.44 0.13 -1.86 -3.30 132.00 141.41 2k6y h PRO 12 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 2k6y h PRO 12 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2k6y h PRO 12 CO 0.30 0.08 0.00 0.41 -0.23 0.00 0.00 178.00 178.57 2k6y n GLY 13 N -0.10 2.17 0.03 1.56 0.00 -1.26 -4.36 105.19 103.23 2k6y n GLY 13 Ca -0.00 -1.97 0.14 0.00 0.00 0.00 0.00 46.02 44.18 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 -1.61 0.08 -4.55 1.61 -0.04 -1.26 -5.00 135.00 124.23 2k6y n PRO 14 Ca 0.00 0.06 -0.26 0.00 -0.04 0.00 0.00 63.50 63.27 2k6y n PRO 14 Cb 0.00 -1.59 -0.11 0.00 -0.04 0.00 0.00 33.50 31.76 2k6y n PRO 14 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2k6y s ASN 15 N -3.47 3.43 0.19 3.54 2.20 -1.26 -1.46 114.94 118.11 2k6y s ASN 15 Ca 0.13 -1.33 -0.10 0.00 -0.94 0.00 0.00 52.86 50.62 2k6y s ASN 15 Cb 0.17 -0.30 0.04 0.00 -2.00 0.00 0.00 41.25 39.15 2k6y s ASN 15 CO 0.56 -0.44 0.50 0.00 -2.94 0.00 0.00 177.10 174.79 2k6y n ALA 16 N -0.85 -1.19 -2.27 3.54 0.00 -0.10 -4.40 120.51 115.25 2k6y n ALA 16 Ca -0.04 -0.69 -0.15 0.00 0.00 0.00 0.00 53.44 52.56 2k6y n ALA 16 Cb 0.66 0.51 -0.10 0.00 0.00 0.00 0.00 19.45 20.52 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 -1.62 1.49 0.11 0.00 0.00 -1.26 -0.64 121.76 119.84 2k6y s ALA 17 Ca 0.10 -1.79 -0.19 0.00 0.00 0.00 0.00 51.96 50.09 2k6y s ALA 17 Cb -0.02 1.13 0.04 0.00 0.00 0.00 0.00 23.12 24.27 2k6y s ALA 17 CO 0.06 -0.50 0.46 0.00 0.00 0.00 0.00 175.76 175.78 2k6y s ALA 18 N -3.90 -1.13 0.03 0.00 0.00 -0.44 -0.58 121.76 115.75 2k6y s ALA 18 Ca 0.37 0.21 -0.10 0.00 0.00 0.00 0.00 51.96 52.44 2k6y s ALA 18 Cb 0.07 0.63 0.01 0.00 0.00 0.00 0.00 23.12 23.83 2k6y s ALA 18 CO 0.12 -0.62 0.21 0.71 0.00 0.00 0.00 175.76 176.19 2k6y s TYR 19 N -3.37 0.01 -0.09 0.00 2.02 -0.60 -1.74 117.35 113.58 2k6y s TYR 19 Ca 0.00 -0.19 -0.32 0.00 -0.37 0.00 0.00 57.07 56.19 2k6y s TYR 19 Cb 0.01 -0.00 0.12 0.00 -0.40 0.00 0.00 41.96 41.68 2k6y s TYR 19 CO -0.09 -0.43 1.06 -0.48 -1.57 0.00 0.00 175.55 174.04 2k6y s LEU 20 N -1.98 -0.24 -0.52 -1.29 2.34 -1.26 -0.93 118.68 114.79 2k6y s LEU 20 Ca -0.06 -0.02 -0.21 0.00 0.06 0.00 0.00 54.13 53.90 2k6y s LEU 20 Cb -0.02 1.70 0.05 0.00 -0.56 0.00 0.00 46.19 47.37 2k6y s LEU 20 CO -0.03 -0.43 0.73 -0.89 -1.06 0.00 0.00 176.35 174.67 2k6y s THR 21 N -2.77 4.72 0.10 5.48 2.01 0.12 -0.83 115.64 124.47 2k6y s THR 21 Ca 0.08 -0.27 -0.17 0.00 0.31 0.00 0.00 61.69 61.64 2k6y s THR 21 Cb -0.01 -4.38 -0.07 0.00 0.01 0.00 0.00 72.50 68.05 2k6y s THR 21 CO -0.06 -0.92 0.56 -0.22 -0.69 0.00 0.00 174.62 173.29 2k6y s LEU 22 N 3.06 4.45 0.19 4.42 0.20 -0.07 -3.46 118.68 127.46 2k6y s LEU 22 Ca 0.20 1.19 0.07 0.00 0.69 0.00 0.00 54.13 56.28 2k6y s LEU 22 Cb -0.17 -3.05 -0.04 0.00 -0.43 0.00 0.00 46.19 42.49 2k6y s LEU 22 CO 0.14 0.20 0.05 -1.83 -0.29 0.00 0.00 176.35 174.62 2k6y s GLU 23 N -1.46 2.56 -0.20 1.98 -1.05 -1.26 -0.25 118.70 119.03 2k6y s GLU 23 Ca 0.33 -1.08 -0.03 0.00 -0.15 0.00 0.00 54.97 54.04 2k6y s GLU 23 Cb -0.18 -2.43 0.06 0.00 -0.44 0.00 0.00 34.13 31.15 2k6y s GLU 23 CO 0.19 0.45 0.03 1.21 0.95 0.00 0.00 175.26 178.09 2k6y s ASN 24 N -3.14 2.96 0.00 0.83 3.84 -0.66 -4.91 114.94 113.85 2k6y s ASN 24 Ca 0.29 -0.84 0.25 0.00 0.21 0.00 0.00 52.86 52.77 2k6y s ASN 24 Cb -0.09 -0.63 0.52 0.00 -0.55 0.00 0.00 41.25 40.50 2k6y s ASN 24 CO 0.20 -0.30 1.42 -0.81 -2.79 0.00 0.00 177.10 174.82 2k6y n PRO 25 N 5.03 0.53 -2.23 0.43 -0.04 -1.26 -1.96 135.00 135.50 2k6y n PRO 25 Ca -0.09 -0.34 -0.26 0.00 -0.04 0.00 0.00 63.50 62.77 2k6y n PRO 25 Cb 0.47 -1.49 0.06 0.00 -0.04 0.00 0.00 33.50 32.50 2k6y n PRO 25 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2k6y s GLY 26 N -2.70 1.68 0.00 0.55 0.00 -1.26 -4.63 107.32 100.95 2k6y s GLY 26 Ca 0.18 -0.89 0.18 0.00 0.00 0.00 0.00 44.72 44.18 2k6y s GLY 26 CO 0.61 -0.51 1.53 1.22 0.00 0.00 0.00 173.10 175.96 2k6y n ASP 27 N -2.86 1.04 -4.89 1.64 8.00 -1.26 -1.69 116.55 116.52 2k6y n ASP 27 Ca 0.07 -1.67 -0.25 0.00 0.71 0.00 0.00 54.79 53.66 2k6y n ASP 27 Cb 0.60 -0.08 -0.04 0.00 -0.02 0.00 0.00 41.12 41.58 2k6y n ASP 27 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2k6y s LEU 28 N -1.47 4.11 0.56 0.64 1.43 -1.26 -4.80 118.68 117.89 2k6y s LEU 28 Ca 0.28 0.01 -0.13 0.00 -1.03 0.00 0.00 54.13 53.25 2k6y s LEU 28 Cb 0.14 -2.68 -0.06 0.00 0.03 0.00 0.00 46.19 43.62 2k6y s LEU 28 CO 0.22 0.03 1.00 -2.16 0.23 0.00 0.00 176.35 175.67 2k6y s PRO 29 N -3.37 3.76 -0.08 1.29 0.04 -1.26 -3.73 135.00 131.65 2k6y s PRO 29 Ca 0.33 0.83 0.04 0.00 0.04 0.00 0.00 61.00 62.24 2k6y s PRO 29 Cb -0.10 -2.12 -0.01 0.00 0.04 0.00 0.00 34.50 32.31 2k6y s PRO 29 CO 0.27 -0.41 -0.19 -1.17 0.04 0.00 0.00 177.00 175.53 2k6y s LEU 30 N -4.63 2.41 -0.22 -3.56 2.96 -0.25 -4.92 118.68 110.47 2k6y s LEU 30 Ca 0.57 -0.39 0.00 0.00 -0.22 0.00 0.00 54.13 54.09 2k6y s LEU 30 Cb -0.10 -1.49 0.06 0.00 0.50 0.00 0.00 46.19 45.15 2k6y s LEU 30 CO 0.43 0.24 -0.05 -0.60 -1.32 0.00 0.00 176.35 175.04 2k6y s ARG 31 N -0.10 1.58 0.01 1.98 3.52 -1.26 -0.16 118.95 124.51 2k6y s ARG 31 Ca -0.04 -0.88 -0.19 0.00 -0.13 0.00 0.00 55.73 54.49 2k6y s ARG 31 Cb -0.14 -2.47 -0.06 0.00 -1.56 0.00 0.00 34.95 30.72 2k6y s ARG 31 CO 0.04 -0.57 0.54 -1.17 -0.81 0.00 0.00 175.30 173.34 2k6y s LEU 32 N 1.45 4.45 0.00 -0.88 2.96 0.17 -1.69 118.68 125.14 2k6y s LEU 32 Ca -0.04 1.12 0.00 0.00 -0.22 0.00 0.00 54.13 54.99 2k6y s LEU 32 Cb -0.18 -2.83 0.00 0.00 0.50 0.00 0.00 46.19 43.68 2k6y s LEU 32 CO -0.07 0.18 0.00 1.33 -1.32 0.00 0.00 176.35 176.47 2k6y n VAL 33 N 2.37 0.00 -3.24 1.68 0.24 0.81 -0.76 118.33 119.43 2k6y n VAL 33 Ca -0.09 -0.40 0.00 0.00 -2.04 0.00 0.00 64.34 61.81 2k6y n VAL 33 Cb 0.51 0.98 0.00 0.00 -1.47 0.00 0.00 33.84 33.86 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 0.86 -0.88 2.28 7.63 0.00 -1.14 -4.77 105.19 109.17 2k6y n GLY 34 Ca 0.00 -0.80 -0.12 0.00 0.00 0.00 0.00 46.02 45.10 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 0.00 0.10 -3.03 4.61 0.00 -1.26 -0.76 120.51 120.17 2k6y n ALA 35 Ca 0.00 -1.23 -0.11 0.00 0.00 0.00 0.00 53.44 52.11 2k6y n ALA 35 Cb 0.00 0.99 -0.11 0.00 0.00 0.00 0.00 19.45 20.33 2k6y n ALA 35 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2k6y s ARG 36 N -2.73 0.33 0.04 0.00 0.52 -0.05 -4.82 118.95 112.24 2k6y s ARG 36 Ca 0.24 -0.33 -0.04 0.00 -0.52 0.00 0.00 55.73 55.08 2k6y s ARG 36 Cb 0.00 0.13 -0.01 0.00 0.52 0.00 0.00 34.95 35.59 2k6y s ARG 36 CO 0.17 -0.07 0.07 -0.08 0.02 0.00 0.00 175.30 175.41 2k6y s THR 37 N -1.02 0.14 0.03 0.02 -1.32 -1.26 -0.56 115.64 111.66 2k6y s THR 37 Ca -0.11 -1.13 0.32 0.00 -1.21 0.00 0.00 61.69 59.57 2k6y s THR 37 Cb -0.07 -0.85 0.39 0.00 -1.51 0.00 0.00 72.50 70.46 2k6y s THR 37 CO 0.00 -0.62 1.94 1.55 -2.21 0.00 0.00 174.62 175.28 2k6y h PRO 38 N 3.77 0.00 -0.63 7.08 0.13 -1.98 -3.26 132.00 137.10 2k6y h PRO 38 Ca -0.33 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.80 2k6y h PRO 38 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2k6y h PRO 38 CO 0.50 0.00 0.00 1.33 -0.23 0.00 0.00 178.00 179.60 2k6y n VAL 39 N -3.09 1.32 -3.73 1.56 0.24 -1.26 -4.40 118.33 108.96 2k6y n VAL 39 Ca 0.01 -0.80 -0.09 0.00 -2.04 0.00 0.00 64.34 61.42 2k6y n VAL 39 Cb 0.33 -0.08 -0.03 0.00 -1.47 0.00 0.00 33.84 32.59 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 -1.82 -1.08 0.00 2.33 0.00 -1.23 -4.29 121.76 115.67 2k6y s ALA 40 Ca 0.34 -0.17 0.00 0.00 0.00 0.00 0.00 51.96 52.13 2k6y s ALA 40 Cb 0.23 0.87 0.00 0.00 0.00 0.00 0.00 23.12 24.22 2k6y s ALA 40 CO 0.15 -0.86 0.00 -1.91 0.00 0.00 0.00 175.76 173.14 2k6y n GLU 41 N -0.38 0.00 -2.53 0.00 4.07 -0.32 -4.60 120.64 116.88 2k6y n GLU 41 Ca -0.09 0.00 -0.42 0.00 -0.06 0.00 0.00 57.16 56.59 2k6y n GLU 41 Cb 0.62 -0.19 -0.03 0.00 -0.06 0.00 0.00 31.44 31.79 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 -0.82 3.35 0.35 5.31 3.52 -0.16 -4.95 118.95 125.56 2k6y s ARG 42 Ca 0.00 0.13 -0.26 0.00 -0.13 0.00 0.00 55.73 55.46 2k6y s ARG 42 Cb 0.00 -4.10 -0.09 0.00 -1.56 0.00 0.00 34.95 29.20 2k6y s ARG 42 CO 0.00 -1.90 1.07 0.54 -0.81 0.00 0.00 175.30 174.19 2k6y s VAL 43 N 5.48 3.63 -0.09 7.11 0.11 -1.26 -1.09 120.40 134.29 2k6y s VAL 43 Ca 0.42 1.40 -0.03 0.00 -2.93 0.00 0.00 61.98 60.84 2k6y s VAL 43 Cb -0.08 -3.80 0.05 0.00 -1.53 0.00 0.00 36.38 31.01 2k6y s VAL 43 CO 0.22 0.16 0.11 -1.61 -3.33 0.00 0.00 175.10 170.65 2k6y s GLU 44 N -2.05 0.00 -0.22 1.54 2.02 -0.47 -4.99 118.70 114.52 2k6y s GLU 44 Ca 0.52 0.32 -0.27 0.00 0.02 0.00 0.00 54.97 55.55 2k6y s GLU 44 Cb -0.26 -0.79 0.00 0.00 0.10 0.00 0.00 34.13 33.18 2k6y s GLU 44 CO 0.33 -0.42 0.96 -1.17 0.02 0.00 0.00 175.26 174.98 2k6y s LEU 45 N 2.21 4.11 0.11 1.80 0.20 -1.26 -0.40 118.68 125.45 2k6y s LEU 45 Ca 0.04 1.27 0.04 0.00 0.69 0.00 0.00 54.13 56.17 2k6y s LEU 45 Cb -0.13 -3.42 -0.04 0.00 -0.43 0.00 0.00 46.19 42.17 2k6y s LEU 45 CO -0.06 -0.60 0.11 -1.00 -0.29 0.00 0.00 176.35 174.52 2k6y s HIS 46 N 2.97 3.19 0.73 5.38 3.76 0.32 -0.49 115.29 131.15 2k6y s HIS 46 Ca 0.41 0.05 -0.06 0.00 -0.15 0.00 0.00 55.06 55.31 2k6y s HIS 46 Cb -0.15 -1.59 0.09 0.00 1.11 0.00 0.00 32.58 32.04 2k6y s HIS 46 CO 0.07 0.52 1.03 -1.83 -0.85 0.00 0.00 174.74 173.69 2k6y s GLU 47 N -2.69 1.96 -0.24 1.40 -1.05 -0.07 -1.17 118.70 116.85 2k6y s GLU 47 Ca 0.30 -0.45 -0.03 0.00 -0.15 0.00 0.00 54.97 54.64 2k6y s GLU 47 Cb -0.11 -2.18 0.13 0.00 -0.44 0.00 0.00 34.13 31.52 2k6y s GLU 47 CO 0.23 -1.37 0.39 0.99 0.95 0.00 0.00 175.26 176.45 2k6y s THR 48 N -3.27 -0.62 0.18 1.83 2.01 0.40 -3.35 115.64 112.82 2k6y s THR 48 Ca 0.62 -0.02 0.06 0.00 0.31 0.00 0.00 61.69 62.66 2k6y s THR 48 Cb -0.09 -0.79 -0.05 0.00 0.01 0.00 0.00 72.50 71.59 2k6y s THR 48 CO 0.45 -0.08 -0.12 0.72 -0.69 0.00 0.00 174.62 174.90 2k6y s PHE 49 N 2.57 1.49 -0.00 4.92 -0.12 -0.53 -3.24 117.98 123.06 2k6y s PHE 49 Ca 0.10 -0.67 -0.07 0.00 -0.05 0.00 0.00 56.93 56.25 2k6y s PHE 49 Cb -0.15 -0.72 -0.05 0.00 -0.63 0.00 0.00 43.02 41.48 2k6y s PHE 49 CO -0.15 0.22 0.27 0.00 -0.05 0.00 0.00 175.22 175.50 2k6y s MET 50 N -3.70 3.59 -0.11 1.99 0.23 -1.26 -1.64 119.30 118.39 2k6y s MET 50 Ca 0.20 -0.05 -0.21 0.00 -1.03 0.00 0.00 55.69 54.59 2k6y s MET 50 Cb 0.01 -3.10 0.05 0.00 -1.53 0.00 0.00 34.83 30.26 2k6y s MET 50 CO 0.04 0.66 0.53 0.50 -2.03 0.00 0.00 175.02 174.72 2k6y s ARG 51 N -1.65 0.77 0.56 3.16 3.52 -0.64 -4.98 118.95 119.68 2k6y s ARG 51 Ca 0.26 0.38 -0.20 0.00 -0.13 0.00 0.00 55.73 56.04 2k6y s ARG 51 Cb -0.13 0.36 -0.04 0.00 -1.56 0.00 0.00 34.95 33.58 2k6y s ARG 51 CO 0.15 -0.18 1.25 -1.21 -0.81 0.00 0.00 175.30 174.50 2k6y s GLU 52 N -0.54 3.11 0.00 5.12 8.01 -1.26 -0.25 118.70 132.89 2k6y s GLU 52 Ca -0.07 1.94 0.00 0.00 0.01 0.00 0.00 54.97 56.86 2k6y s GLU 52 Cb -0.03 -2.08 0.00 0.00 -4.31 0.00 0.00 34.13 27.71 2k6y s GLU 52 CO 0.04 -1.13 0.00 0.28 0.01 0.00 0.00 175.26 174.47 2k6y n VAL 53 N -1.29 0.00 -0.67 2.63 0.31 -0.20 -4.86 118.33 114.24 2k6y n VAL 53 Ca 0.12 0.00 -0.05 0.00 -0.01 0.00 0.00 64.34 64.40 2k6y n VAL 53 Cb 0.48 -0.00 -0.08 0.00 -0.91 0.00 0.00 33.84 33.33 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 -0.18 1.33 0.00 5.55 2.13 -1.26 -4.71 120.64 123.50 2k6y n GLU 54 Ca 0.00 -0.44 0.00 0.00 0.66 0.00 0.00 57.16 57.38 2k6y n GLU 54 Cb 0.00 -1.50 0.00 0.00 0.27 0.00 0.00 31.44 30.21 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 2.05 0.77 3.82 8.31 0.00 -1.26 -4.92 105.19 113.96 2k6y n GLY 55 Ca 0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.88 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 4.08 0.15 1.61 1.02 -1.26 -4.80 119.74 120.54 2k6y s LYS 56 Ca 0.00 1.15 -0.19 0.00 0.02 0.00 0.00 55.97 56.95 2k6y s LYS 56 Cb 0.00 -2.15 -0.07 0.00 -0.52 0.00 0.00 37.83 35.08 2k6y s LYS 56 CO 0.00 -0.16 0.64 -1.59 -0.92 0.00 0.00 175.35 173.32 2k6y s LYS 57 N -3.32 4.22 0.11 1.68 -2.85 -1.26 -1.04 119.74 117.29 2k6y s LYS 57 Ca 0.63 0.78 0.09 0.00 -1.00 0.00 0.00 55.97 56.47 2k6y s LYS 57 Cb -0.11 -3.07 -0.04 0.00 -2.06 0.00 0.00 37.83 32.56 2k6y s LYS 57 CO 0.17 0.52 -0.22 0.08 0.10 0.00 0.00 175.35 176.01 2k6y s VAL 58 N -1.32 1.82 -0.08 1.79 1.01 0.65 -4.92 120.40 119.35 2k6y s VAL 58 Ca 0.36 -1.62 -0.16 0.00 0.00 0.00 0.00 61.98 60.56 2k6y s VAL 58 Cb -0.18 -1.66 -0.05 0.00 0.00 0.00 0.00 36.38 34.49 2k6y s VAL 58 CO 0.21 -0.06 0.40 -0.04 0.00 0.00 0.00 175.10 175.61 2k6y s MET 59 N -2.03 4.15 0.19 2.72 1.00 -1.26 -1.63 119.30 122.43 2k6y s MET 59 Ca 0.09 0.34 -0.00 0.00 0.00 0.00 0.00 55.69 56.12 2k6y s MET 59 Cb -0.10 -3.35 -0.04 0.00 0.00 0.00 0.00 34.83 31.34 2k6y s MET 59 CO 0.05 0.39 0.08 0.20 0.00 0.00 0.00 175.02 175.74 2k6y s GLY 60 N -0.08 1.32 -0.01 -0.03 0.00 -0.65 -5.00 107.32 102.88 2k6y s GLY 60 Ca 0.23 -1.64 0.00 0.00 0.00 0.00 0.00 44.72 43.30 2k6y s GLY 60 CO 0.10 -1.45 0.00 1.06 0.00 0.00 0.00 173.10 172.81 2k6y s MET 61 N -4.06 0.02 -0.08 2.90 -1.94 -1.26 -1.45 119.30 113.44 2k6y s MET 61 Ca 0.32 0.03 -0.14 0.00 -1.71 0.00 0.00 55.69 54.18 2k6y s MET 61 Cb 0.07 -0.09 0.03 0.00 2.01 0.00 0.00 34.83 36.86 2k6y s MET 61 CO 0.08 -0.03 0.35 1.03 -0.01 0.00 0.00 175.02 176.44 2k6y s ARG 62 N 0.25 0.56 0.40 2.03 0.52 -1.21 -5.00 118.95 116.50 2k6y s ARG 62 Ca -0.02 0.19 -0.26 0.00 -0.52 0.00 0.00 55.73 55.11 2k6y s ARG 62 Cb -0.03 0.26 -0.09 0.00 0.52 0.00 0.00 34.95 35.61 2k6y s ARG 62 CO -0.01 -0.12 1.31 -1.25 0.02 0.00 0.00 175.30 175.25 2k6y s PRO 63 N -0.54 4.00 0.18 3.54 0.04 -1.26 -0.89 135.00 140.07 2k6y s PRO 63 Ca -0.07 2.17 0.09 0.00 0.04 0.00 0.00 61.00 63.24 2k6y s PRO 63 Cb -0.04 -2.78 -0.04 0.00 0.04 0.00 0.00 34.50 31.68 2k6y s PRO 63 CO 0.03 -0.47 -0.12 0.14 0.04 0.00 0.00 177.00 176.61 2k6y s VAL 64 N -1.25 3.04 -1.07 -0.36 -7.23 0.35 -4.84 120.40 109.05 2k6y s VAL 64 Ca 0.56 -1.72 0.19 0.00 -1.81 0.00 0.00 61.98 59.20 2k6y s VAL 64 Cb -0.38 -2.50 0.19 0.00 0.56 0.00 0.00 36.38 34.24 2k6y s VAL 64 CO 0.50 -0.11 1.60 -0.81 -0.31 0.00 0.00 175.10 175.97 2k6y n PRO 65 N 0.08 0.04 -3.63 4.82 -0.04 -1.26 -4.61 135.00 130.40 2k6y n PRO 65 Ca -0.11 0.16 0.02 0.00 -0.04 0.00 0.00 63.50 63.53 2k6y n PRO 65 Cb 0.56 -1.50 -0.00 0.00 -0.04 0.00 0.00 33.50 32.51 2k6y n PRO 65 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 2k6y s PHE 66 N -2.93 -0.04 0.29 0.54 -0.12 -1.26 -4.81 117.98 109.65 2k6y s PHE 66 Ca 0.11 -0.06 0.06 0.00 -0.05 0.00 0.00 56.93 56.98 2k6y s PHE 66 Cb 0.12 0.55 -0.06 0.00 -0.63 0.00 0.00 43.02 43.00 2k6y s PHE 66 CO 0.34 -0.28 -0.02 -1.17 -0.05 0.00 0.00 175.22 174.03 2k6y s LEU 67 N -3.01 2.41 0.15 -1.99 0.20 0.06 -5.00 118.68 111.50 2k6y s LEU 67 Ca 0.15 -1.24 -0.18 0.00 0.69 0.00 0.00 54.13 53.55 2k6y s LEU 67 Cb 0.05 -0.56 0.04 0.00 -0.43 0.00 0.00 46.19 45.28 2k6y s LEU 67 CO -0.04 -0.42 0.48 -1.83 -0.29 0.00 0.00 176.35 174.25 2k6y s GLU 68 N -3.77 1.21 -0.08 1.98 -1.05 -1.26 -0.66 118.70 115.06 2k6y s GLU 68 Ca 0.31 -0.71 -0.11 0.00 -0.15 0.00 0.00 54.97 54.31 2k6y s GLU 68 Cb 0.05 0.51 0.03 0.00 -0.44 0.00 0.00 34.13 34.28 2k6y s GLU 68 CO 0.13 -0.50 0.29 0.08 0.95 0.00 0.00 175.26 176.21 2k6y s VAL 69 N -3.82 0.02 1.03 1.83 1.01 0.77 -4.99 120.40 116.26 2k6y s VAL 69 Ca 0.05 -0.14 -0.13 0.00 0.00 0.00 0.00 61.98 61.76 2k6y s VAL 69 Cb 0.00 -0.46 0.21 0.00 0.00 0.00 0.00 36.38 36.13 2k6y s VAL 69 CO -0.09 -0.08 1.08 -2.16 0.00 0.00 0.00 175.10 173.85 2k6y s PRO 70 N -0.24 0.15 0.60 2.72 0.04 -1.26 -1.09 135.00 135.92 2k6y s PRO 70 Ca -0.04 0.53 -0.20 0.00 0.04 0.00 0.00 61.00 61.34 2k6y s PRO 70 Cb -0.03 -1.70 -0.03 0.00 0.04 0.00 0.00 34.50 32.77 2k6y s PRO 70 CO 0.01 -2.92 1.29 -0.35 0.04 0.00 0.00 177.00 175.07 2k6y n PRO 71 N -4.31 1.33 -0.61 0.56 -0.04 -1.24 -3.16 135.00 127.53 2k6y n PRO 71 Ca 0.05 0.51 0.00 0.00 -0.04 0.00 0.00 63.50 64.01 2k6y n PRO 71 Cb 0.57 -2.51 0.00 0.00 -0.04 0.00 0.00 33.50 31.52 2k6y n PRO 71 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2k6y n LYS 72 N -1.43 0.00 -2.93 0.54 4.76 -0.68 -4.94 118.16 113.47 2k6y n LYS 72 Ca 0.13 0.00 -0.43 0.00 -2.87 0.00 0.00 58.31 55.15 2k6y n LYS 72 Cb 0.46 -3.99 -0.05 0.00 -1.84 0.00 0.00 35.03 29.61 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 1.59 -0.25 0.72 0.00 -1.09 -4.81 107.32 101.48 2k6y s GLY 73 Ca 0.00 -0.87 -0.10 0.00 0.00 0.00 0.00 44.72 43.75 2k6y s GLY 73 CO 0.00 1.83 0.16 -1.60 0.00 0.00 0.00 173.10 173.49 2k6y s ARG 74 N 3.33 4.01 -0.04 2.90 3.00 -1.26 -1.66 118.95 129.22 2k6y s ARG 74 Ca 0.32 -0.30 -0.07 0.00 -1.00 0.00 0.00 55.73 54.67 2k6y s ARG 74 Cb -0.12 -3.55 0.01 0.00 0.00 0.00 0.00 34.95 31.29 2k6y s ARG 74 CO 0.22 -0.02 0.18 0.14 0.00 0.00 0.00 175.30 175.82 2k6y s VAL 75 N 1.27 0.03 0.16 7.11 -7.23 0.66 -4.98 120.40 117.42 2k6y s VAL 75 Ca 0.07 -0.26 -0.16 0.00 -1.81 0.00 0.00 61.98 59.82 2k6y s VAL 75 Cb -0.14 -0.35 -0.07 0.00 0.56 0.00 0.00 36.38 36.38 2k6y s VAL 75 CO 0.06 -0.14 0.60 -1.61 -0.31 0.00 0.00 175.10 173.70 2k6y s GLU 76 N -0.47 4.08 -1.16 4.82 8.01 -1.26 -0.89 118.70 131.82 2k6y s GLU 76 Ca -0.06 0.62 -0.19 0.00 0.01 0.00 0.00 54.97 55.36 2k6y s GLU 76 Cb -0.04 -2.95 -0.04 0.00 -4.31 0.00 0.00 34.13 26.80 2k6y s GLU 76 CO 0.01 0.47 1.98 1.28 0.01 0.00 0.00 175.26 179.02 2k6y n LEU 77 N 0.88 4.95 -4.72 1.80 4.32 -0.01 -4.95 117.00 119.25 2k6y n LEU 77 Ca -0.05 -3.54 -0.42 0.00 -0.02 0.00 0.00 56.01 51.98 2k6y n LEU 77 Cb 0.51 -1.52 -0.03 0.00 -1.62 0.00 0.00 43.42 40.77 2k6y n LEU 77 CO 0.42 -0.06 1.32 2.29 -1.22 0.00 0.00 177.39 180.14 2k6y n LYS 78 N 7.23 2.72 0.08 3.23 0.00 -1.24 -4.41 118.16 125.76 2k6y n LYS 78 Ca 0.49 0.98 0.04 0.00 -0.00 0.00 0.00 58.31 59.82 2k6y n LYS 78 Cb 0.42 -2.80 0.44 0.00 -0.00 0.00 0.00 35.03 33.10 2k6y n LYS 78 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.40 176.40 2k6y h PRO 79 N 6.04 0.37 -2.17 -1.58 0.13 -1.95 0.35 132.00 133.19 2k6y h PRO 79 Ca -0.44 -0.04 -0.30 0.00 -0.87 0.00 0.00 66.00 64.34 2k6y h PRO 79 Cb 1.21 -0.07 -0.07 0.00 0.13 0.00 0.00 31.00 32.20 2k6y h PRO 79 CO 0.90 0.32 0.41 0.41 -0.23 0.00 0.00 178.00 179.80 2k6y n GLY 80 N -1.28 3.36 0.10 1.56 0.00 -1.26 -4.23 105.19 103.44 2k6y n GLY 80 Ca 0.01 -1.33 0.00 0.00 0.00 0.00 0.00 46.02 44.69 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 2.51 -0.97 3.45 -0.02 0.00 -0.67 -4.94 105.19 104.55 2k6y n GLY 81 Ca 0.50 0.40 -0.14 0.00 0.00 0.00 0.00 46.02 46.78 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 -2.00 -0.59 0.29 1.61 2.02 0.03 -0.45 117.35 118.25 2k6y s TYR 82 Ca 0.00 1.37 -0.19 0.00 -0.37 0.00 0.00 57.07 57.88 2k6y s TYR 82 Cb 0.00 0.22 0.06 0.00 -0.40 0.00 0.00 41.96 41.84 2k6y s TYR 82 CO 0.00 -0.33 0.87 -3.38 -1.57 0.00 0.00 175.55 171.14 2k6y s HIS 83 N 0.04 0.03 -0.15 2.71 -3.43 -0.31 -3.61 115.29 110.57 2k6y s HIS 83 Ca -0.02 -0.55 -0.04 0.00 -0.80 0.00 0.00 55.06 53.65 2k6y s HIS 83 Cb -0.04 0.76 -0.03 0.00 -1.43 0.00 0.00 32.58 31.84 2k6y s HIS 83 CO 0.02 -1.25 -0.03 -0.06 -2.00 0.00 0.00 174.74 171.42 2k6y s PHE 84 N -2.65 3.05 0.23 0.38 0.08 -0.71 -0.52 117.98 117.84 2k6y s PHE 84 Ca 0.16 -0.21 -0.20 0.00 0.12 0.00 0.00 56.93 56.80 2k6y s PHE 84 Cb -0.04 -1.95 -0.08 0.00 -0.57 0.00 0.00 43.02 40.38 2k6y s PHE 84 CO 0.08 0.03 0.74 -1.64 -0.10 0.00 0.00 175.22 174.33 2k6y s MET 85 N 0.22 4.27 -0.09 0.44 -1.94 0.46 -1.32 119.30 121.34 2k6y s MET 85 Ca -0.02 0.90 0.03 0.00 -1.71 0.00 0.00 55.69 54.89 2k6y s MET 85 Cb -0.14 -2.87 0.01 0.00 2.01 0.00 0.00 34.83 33.84 2k6y s MET 85 CO 0.03 0.39 -0.18 -0.51 -0.01 0.00 0.00 175.02 174.73 2k6y s LEU 86 N -1.99 1.87 -0.02 -0.03 1.43 0.19 -1.37 118.68 118.76 2k6y s LEU 86 Ca 0.43 -0.44 0.02 0.00 -1.03 0.00 0.00 54.13 53.11 2k6y s LEU 86 Cb -0.17 -1.15 0.00 0.00 0.03 0.00 0.00 46.19 44.91 2k6y s LEU 86 CO 0.21 0.09 -0.07 -0.76 0.23 0.00 0.00 176.35 176.04 2k6y s LEU 87 N 0.59 1.80 -0.13 1.79 1.43 -0.25 -0.92 118.68 122.99 2k6y s LEU 87 Ca -0.15 -0.15 -0.02 0.00 -1.03 0.00 0.00 54.13 52.78 2k6y s LEU 87 Cb -0.17 -0.45 0.00 0.00 0.03 0.00 0.00 46.19 45.61 2k6y s LEU 87 CO 0.05 0.05 0.15 0.61 0.23 0.00 0.00 176.35 177.44 2k6y n GLY 88 N 3.25 -0.71 3.73 -3.19 0.00 -0.53 -0.98 105.19 106.76 2k6y n GLY 88 Ca -0.17 0.11 -0.41 0.00 0.00 0.00 0.00 46.02 45.55 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 -1.81 4.50 0.00 0.99 1.43 -1.22 -1.17 118.68 121.40 2k6y s LEU 89 Ca 0.03 1.92 0.32 0.00 -1.03 0.00 0.00 54.13 55.37 2k6y s LEU 89 Cb -0.01 -3.60 1.85 0.00 0.03 0.00 0.00 46.19 44.46 2k6y s LEU 89 CO 0.18 -0.12 2.20 0.29 0.23 0.00 0.00 176.35 179.12 2k6y n LYS 90 N 2.59 1.00 -3.58 1.70 5.02 -1.26 -4.86 118.16 118.77 2k6y n LYS 90 Ca 0.02 -0.05 -0.05 0.00 -2.02 0.00 0.00 58.31 56.22 2k6y n LYS 90 Cb 0.48 -1.50 -0.02 0.00 -0.02 0.00 0.00 35.03 33.97 2k6y n LYS 90 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 2k6y s ARG 91 N -2.03 0.37 0.46 1.97 1.70 -1.26 -5.12 118.95 115.03 2k6y s ARG 91 Ca 0.46 -0.14 -0.23 0.00 -0.47 0.00 0.00 55.73 55.36 2k6y s ARG 91 Cb 0.22 0.17 -0.07 0.00 -0.57 0.00 0.00 34.95 34.69 2k6y s ARG 91 CO 0.37 -0.16 1.14 -1.25 -1.08 0.00 0.00 175.30 174.32 2k6y s PRO 92 N -2.51 3.78 0.39 3.89 0.04 -1.26 -4.86 135.00 134.48 2k6y s PRO 92 Ca 0.09 1.71 0.08 0.00 0.04 0.00 0.00 61.00 62.92 2k6y s PRO 92 Cb -0.01 -2.38 -0.05 0.00 0.04 0.00 0.00 34.50 32.10 2k6y s PRO 92 CO -0.05 -0.52 0.18 -0.51 0.04 0.00 0.00 177.00 176.14 2k6y s LEU 93 N -3.05 3.16 -0.12 -3.56 1.43 -1.25 -5.05 118.68 110.25 2k6y s LEU 93 Ca 0.64 -0.98 -0.10 0.00 -1.03 0.00 0.00 54.13 52.66 2k6y s LEU 93 Cb -0.27 -1.55 0.03 0.00 0.03 0.00 0.00 46.19 44.43 2k6y s LEU 93 CO 0.33 -0.48 0.30 -0.75 0.23 0.00 0.00 176.35 175.98 2k6y s LYS 94 N -3.90 0.33 0.19 1.70 2.36 -1.26 -4.78 119.74 114.38 2k6y s LYS 94 Ca 0.40 0.47 -0.32 0.00 -2.55 0.00 0.00 55.97 53.98 2k6y s LYS 94 Cb 0.02 0.11 -0.11 0.00 -1.05 0.00 0.00 37.83 36.79 2k6y s LYS 94 CO 0.23 -0.07 1.71 0.00 1.55 0.00 0.00 175.35 178.77 2k6y s ALA 95 N 0.45 3.90 0.00 3.13 0.00 -1.26 -2.94 121.76 125.04 2k6y s ALA 95 Ca -0.02 1.54 0.00 0.00 0.00 0.00 0.00 51.96 53.48 2k6y s ALA 95 Cb -0.04 -3.69 0.00 0.00 0.00 0.00 0.00 23.12 19.39 2k6y s ALA 95 CO -0.02 -0.94 0.00 0.41 0.00 0.00 0.00 175.76 175.21 2k6y n GLY 96 N 3.97 0.55 3.36 0.00 0.00 -0.75 -4.98 105.19 107.35 2k6y n GLY 96 Ca 0.16 -0.38 -0.19 0.00 0.00 0.00 0.00 46.02 45.61 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 -2.86 1.41 0.20 1.61 2.02 -1.15 -5.01 118.70 114.93 2k6y s GLU 97 Ca 0.00 -1.71 0.01 0.00 0.02 0.00 0.00 54.97 53.29 2k6y s GLU 97 Cb 0.00 -0.83 -0.04 0.00 0.10 0.00 0.00 34.13 33.36 2k6y s GLU 97 CO 0.00 -0.04 0.38 -1.83 0.02 0.00 0.00 175.26 173.79 2k6y s GLU 98 N -3.80 3.49 -0.09 1.61 1.03 -1.26 0.05 118.70 119.73 2k6y s GLU 98 Ca 0.28 -0.44 0.01 0.00 0.03 0.00 0.00 54.97 54.85 2k6y s GLU 98 Cb 0.05 -2.86 0.02 0.00 -0.80 0.00 0.00 34.13 30.54 2k6y s GLU 98 CO 0.10 0.41 -0.08 0.08 -1.33 0.00 0.00 175.26 174.43 2k6y s VAL 99 N -1.89 0.98 -0.05 1.83 1.01 0.92 -4.81 120.40 118.39 2k6y s VAL 99 Ca 0.37 -0.31 -0.30 0.00 0.00 0.00 0.00 61.98 61.74 2k6y s VAL 99 Cb -0.11 -0.97 -0.03 0.00 0.00 0.00 0.00 36.38 35.27 2k6y s VAL 99 CO 0.29 0.34 1.19 -0.70 0.00 0.00 0.00 175.10 176.23 2k6y s GLU 100 N 1.32 4.36 -0.10 2.72 2.56 -1.26 -1.09 118.70 127.21 2k6y s GLU 100 Ca -0.03 1.66 0.01 0.00 0.00 0.00 0.00 54.97 56.62 2k6y s GLU 100 Cb -0.14 -3.54 0.02 0.00 2.00 0.00 0.00 34.13 32.47 2k6y s GLU 100 CO -0.04 -0.42 -0.13 -0.51 -0.56 0.00 0.00 175.26 173.60 2k6y s LEU 101 N 2.10 1.62 -0.63 2.70 1.43 0.02 -3.93 118.68 121.99 2k6y s LEU 101 Ca 0.56 -0.38 -0.10 0.00 -1.03 0.00 0.00 54.13 53.17 2k6y s LEU 101 Cb -0.25 -1.00 0.16 0.00 0.03 0.00 0.00 46.19 45.14 2k6y s LEU 101 CO 0.22 -0.00 0.52 -1.81 0.23 0.00 0.00 176.35 175.51 2k6y s ASP 102 N 1.04 6.00 0.03 2.29 1.11 0.27 0.06 116.67 127.47 2k6y s ASP 102 Ca -0.06 -2.36 -0.30 0.00 0.18 0.00 0.00 52.55 50.01 2k6y s ASP 102 Cb -0.15 -2.06 -0.07 0.00 1.07 0.00 0.00 42.92 41.71 2k6y s ASP 102 CO -0.02 -0.60 1.65 -0.76 1.18 0.00 0.00 175.17 176.62 2k6y s LEU 103 N 0.69 4.35 -0.16 1.23 1.43 0.39 -0.87 118.68 125.74 2k6y s LEU 103 Ca 0.12 2.39 -0.12 0.00 -1.03 0.00 0.00 54.13 55.49 2k6y s LEU 103 Cb -0.20 -3.55 -0.05 0.00 0.03 0.00 0.00 46.19 42.42 2k6y s LEU 103 CO -0.03 -0.89 0.24 -0.76 0.23 0.00 0.00 176.35 175.13 2k6y s LEU 104 N 3.11 4.26 0.31 1.79 1.43 0.06 -1.11 118.68 128.53 2k6y s LEU 104 Ca 0.74 0.45 0.06 0.00 -1.03 0.00 0.00 54.13 54.34 2k6y s LEU 104 Cb -0.37 -2.28 -0.06 0.00 0.03 0.00 0.00 46.19 43.51 2k6y s LEU 104 CO 0.31 0.16 -0.01 -0.36 0.23 0.00 0.00 176.35 176.68 2k6y s PHE 105 N 0.24 2.03 1.00 0.29 0.40 -0.08 -0.14 117.98 121.73 2k6y s PHE 105 Ca 0.14 -0.77 -0.12 0.00 -0.60 0.00 0.00 56.93 55.58 2k6y s PHE 105 Cb -0.12 -1.26 0.19 0.00 0.51 0.00 0.00 43.02 42.34 2k6y s PHE 105 CO 0.03 0.22 1.08 0.00 0.70 0.00 0.00 175.22 177.24 2k6y s ALA 106 N -3.06 0.78 -0.34 5.36 0.00 -0.68 -3.98 121.76 119.84 2k6y s ALA 106 Ca 0.32 -0.05 0.00 0.00 0.00 0.00 0.00 51.96 52.24 2k6y s ALA 106 Cb 0.06 -3.23 0.00 0.00 0.00 0.00 0.00 23.12 19.95 2k6y s ALA 106 CO 0.14 -2.97 0.00 0.41 0.00 0.00 0.00 175.76 173.33 2k6y n GLY 107 N -0.33 0.62 2.19 0.00 0.00 -1.26 -2.96 105.19 103.45 2k6y n GLY 107 Ca 0.06 -0.43 0.00 0.00 0.00 0.00 0.00 46.02 45.65 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 -2.09 0.70 3.74 -0.02 0.00 -1.26 -5.04 105.19 101.22 2k6y n GLY 108 Ca -0.03 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.58 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 -0.08 4.79 0.05 1.61 -0.14 -1.16 -5.00 119.74 119.81 2k6y s LYS 109 Ca 0.00 1.52 0.04 0.00 -1.36 0.00 0.00 55.97 56.17 2k6y s LYS 109 Cb 0.00 -3.30 -0.02 0.00 -1.68 0.00 0.00 37.83 32.83 2k6y s LYS 109 CO 0.00 0.39 -0.11 0.54 -0.76 0.00 0.00 175.35 175.41 2k6y s VAL 110 N -0.82 0.83 -0.12 3.17 0.11 -1.26 -0.90 120.40 121.41 2k6y s VAL 110 Ca 0.43 -1.11 0.02 0.00 -2.93 0.00 0.00 61.98 58.39 2k6y s VAL 110 Cb -0.26 -0.83 0.01 0.00 -1.53 0.00 0.00 36.38 33.78 2k6y s VAL 110 CO 0.32 -0.25 -0.17 -0.76 -3.33 0.00 0.00 175.10 170.92 2k6y s LEU 111 N -1.51 1.80 -0.02 2.54 1.43 -0.27 -4.99 118.68 117.66 2k6y s LEU 111 Ca -0.05 -0.47 -0.22 0.00 -1.03 0.00 0.00 54.13 52.37 2k6y s LEU 111 Cb -0.09 -1.16 -0.05 0.00 0.03 0.00 0.00 46.19 44.91 2k6y s LEU 111 CO 0.01 0.03 0.65 -0.75 0.23 0.00 0.00 176.35 176.52 2k6y s LYS 112 N 0.96 4.38 -0.11 1.70 2.20 -1.26 -0.46 119.74 127.15 2k6y s LYS 112 Ca -0.07 0.82 -0.05 0.00 -0.36 0.00 0.00 55.97 56.31 2k6y s LYS 112 Cb -0.15 -3.38 0.05 0.00 -1.51 0.00 0.00 37.83 32.84 2k6y s LYS 112 CO -0.02 0.26 0.24 0.14 -0.36 0.00 0.00 175.35 175.61 2k6y s VAL 113 N 0.14 -0.13 0.09 4.02 -7.23 0.11 -4.99 120.40 112.40 2k6y s VAL 113 Ca 0.34 0.19 -0.27 0.00 -1.81 0.00 0.00 61.98 60.43 2k6y s VAL 113 Cb -0.18 -0.38 -0.06 0.00 0.56 0.00 0.00 36.38 36.31 2k6y s VAL 113 CO 0.18 0.08 0.84 0.54 -0.31 0.00 0.00 175.10 176.43 2k6y s VAL 114 N 1.55 4.58 0.08 1.32 0.11 -1.26 -0.80 120.40 125.97 2k6y s VAL 114 Ca -0.07 1.81 -0.05 0.00 -2.93 0.00 0.00 61.98 60.74 2k6y s VAL 114 Cb -0.11 -4.20 -0.02 0.00 -1.53 0.00 0.00 36.38 30.52 2k6y s VAL 114 CO -0.08 0.37 0.10 -0.76 -3.33 0.00 0.00 175.10 171.40 2k6y s LEU 115 N -0.22 1.84 0.47 2.54 1.43 -0.25 -3.47 118.68 121.03 2k6y s LEU 115 Ca 0.41 -0.84 -0.10 0.00 -1.03 0.00 0.00 54.13 52.57 2k6y s LEU 115 Cb -0.22 0.66 -0.05 0.00 0.03 0.00 0.00 46.19 46.61 2k6y s LEU 115 CO 0.26 -0.69 0.84 -2.16 0.23 0.00 0.00 176.35 174.83 2k6y s PRO 116 N -3.90 3.70 -0.22 1.29 0.04 -1.26 -0.05 135.00 134.59 2k6y s PRO 116 Ca 0.08 0.48 -0.16 0.00 0.04 0.00 0.00 61.00 61.44 2k6y s PRO 116 Cb 0.06 -2.31 -0.04 0.00 0.04 0.00 0.00 34.50 32.25 2k6y s PRO 116 CO -0.09 -0.20 0.41 0.08 0.04 0.00 0.00 177.00 177.24 2k6y s VAL 117 N -2.64 5.18 0.18 -0.36 1.01 0.11 -0.75 120.40 123.13 2k6y s VAL 117 Ca 0.51 0.71 0.05 0.00 0.00 0.00 0.00 61.98 63.25 2k6y s VAL 117 Cb -0.10 -3.73 -0.04 0.00 0.00 0.00 0.00 36.38 32.50 2k6y s VAL 117 CO 0.39 0.22 0.16 -1.61 0.00 0.00 0.00 175.10 174.26 2k6y s GLU 118 N 1.50 2.94 -1.14 2.72 2.02 0.01 -1.81 118.70 124.95 2k6y s GLU 118 Ca 0.19 -0.89 -0.13 0.00 0.02 0.00 0.00 54.97 54.15 2k6y s GLU 118 Cb -0.15 -2.65 0.20 0.00 0.10 0.00 0.00 34.13 31.63 2k6y s GLU 118 CO 0.08 0.47 1.29 0.00 0.02 0.00 0.00 175.26 177.12 2k6y s ALA 119 N -1.84 4.15 -2.10 5.21 0.00 -1.26 -3.42 121.76 122.50 2k6y s ALA 119 Ca 0.32 -3.44 0.31 0.00 0.00 0.00 0.00 51.96 49.15 2k6y s ALA 119 Cb -0.10 -3.95 1.73 0.00 0.00 0.00 0.00 23.12 20.81 2k6y s ALA 119 CO 0.24 -2.62 2.13 0.54 0.00 0.00 0.00 175.76 176.05