#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k6y s SER 2 N 0.00 1.04 0.21 1.61 0.01 -1.26 -5.17 113.70 110.14 2k6y s SER 2 Ca 0.00 -1.13 0.10 0.00 1.31 0.00 0.00 55.95 56.23 2k6y s SER 2 Cb 0.00 0.14 -0.04 0.00 0.21 0.00 0.00 66.02 66.33 2k6y s SER 2 CO 0.00 -0.57 -0.13 -0.36 0.41 0.00 0.00 173.24 172.59 2k6y s PHE 3 N -3.71 2.52 0.26 2.43 0.08 -1.26 -5.15 117.98 113.14 2k6y s PHE 3 Ca 0.21 -0.27 -0.18 0.00 0.12 0.00 0.00 56.93 56.81 2k6y s PHE 3 Cb 0.06 -1.20 0.01 0.00 -0.57 0.00 0.00 43.02 41.32 2k6y s PHE 3 CO 0.01 0.55 0.62 -0.08 -0.10 0.00 0.00 175.22 176.22 2k6y s THR 4 N -1.89 0.00 -0.27 0.64 -1.32 -1.26 -5.10 115.64 106.45 2k6y s THR 4 Ca 0.25 -1.08 -0.06 0.00 -1.21 0.00 0.00 61.69 59.60 2k6y s THR 4 Cb -0.08 -1.99 -0.00 0.00 -1.51 0.00 0.00 72.50 68.92 2k6y s THR 4 CO 0.15 -0.01 0.05 -0.70 -2.21 0.00 0.00 174.62 171.89 2k6y s GLU 5 N -3.94 3.28 0.16 7.08 2.56 -1.26 -4.98 118.70 121.60 2k6y s GLU 5 Ca 0.14 -0.72 -0.25 0.00 0.00 0.00 0.00 54.97 54.15 2k6y s GLU 5 Cb -0.04 -3.27 0.06 0.00 2.00 0.00 0.00 34.13 32.88 2k6y s GLU 5 CO 0.06 -0.33 0.93 0.20 -0.56 0.00 0.00 175.26 175.56 2k6y s GLY 6 N 1.52 -0.23 -0.01 -1.50 0.00 -1.26 -0.22 107.32 105.62 2k6y s GLY 6 Ca 0.04 0.11 -0.29 0.00 0.00 0.00 0.00 44.72 44.57 2k6y s GLY 6 CO 0.01 0.00 0.68 0.66 0.00 0.00 0.00 173.10 174.45 2k6y s TRP 7 N -3.35 -0.62 -0.22 1.90 -2.14 -0.81 -4.03 118.94 109.66 2k6y s TRP 7 Ca 0.12 0.94 -0.15 0.00 2.66 0.00 0.00 56.10 59.67 2k6y s TRP 7 Cb -0.02 0.44 -0.04 0.00 -3.10 0.00 0.00 33.47 30.75 2k6y s TRP 7 CO 0.02 -0.65 0.34 0.08 -2.66 0.00 0.00 176.95 174.09 2k6y s VAL 8 N -1.74 5.23 -0.49 -0.66 1.01 -0.44 -1.59 120.40 121.73 2k6y s VAL 8 Ca -0.08 0.57 -0.27 0.00 0.00 0.00 0.00 61.98 62.21 2k6y s VAL 8 Cb -0.00 -3.68 0.03 0.00 0.00 0.00 0.00 36.38 32.73 2k6y s VAL 8 CO 0.05 0.25 1.01 -0.13 0.00 0.00 0.00 175.10 176.28 2k6y s ARG 9 N 1.41 3.56 1.28 2.72 1.81 0.15 -0.45 118.95 129.42 2k6y s ARG 9 Ca 0.16 0.23 -0.21 0.00 -1.72 0.00 0.00 55.73 54.19 2k6y s ARG 9 Cb -0.15 -3.94 0.33 0.00 -0.45 0.00 0.00 34.95 30.73 2k6y s ARG 9 CO 0.08 -1.34 0.93 1.97 -0.68 0.00 0.00 175.30 176.26 2k6y n PHE 10 N 7.51 -3.79 -3.68 -0.53 -1.74 0.02 -2.55 117.46 112.71 2k6y n PHE 10 Ca 0.07 -0.86 -0.04 0.00 -0.56 0.00 0.00 57.45 56.07 2k6y n PHE 10 Cb 0.49 -1.13 -0.01 0.00 1.52 0.00 0.00 39.48 40.34 2k6y n PHE 10 CO 0.00 0.00 0.00 -1.12 -0.56 0.00 0.00 176.76 175.08 2k6y s SER 11 N -3.70 -0.19 0.29 5.98 0.01 -1.26 -4.66 113.70 110.17 2k6y s SER 11 Ca 0.65 -0.27 0.15 0.00 1.31 0.00 0.00 55.95 57.80 2k6y s SER 11 Cb -0.09 0.40 0.29 0.00 0.21 0.00 0.00 66.02 66.84 2k6y s SER 11 CO 0.52 -0.72 1.55 1.55 0.41 0.00 0.00 173.24 176.55 2k6y h PRO 12 N 2.00 0.00 0.00 12.44 0.13 -1.96 -3.39 132.00 141.22 2k6y h PRO 12 Ca -0.24 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.89 2k6y h PRO 12 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 2k6y h PRO 12 CO 0.27 0.55 0.00 0.41 -0.23 0.00 0.00 178.00 179.00 2k6y n GLY 13 N 0.76 1.45 0.15 1.56 0.00 -1.26 -4.87 105.19 102.98 2k6y n GLY 13 Ca 0.00 -1.94 0.13 0.00 0.00 0.00 0.00 46.02 44.21 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 -5.24 1.61 0.13 -1.97 -3.48 132.00 123.05 2k6y h PRO 14 Ca 0.00 0.00 -0.42 0.00 -0.87 0.00 0.00 66.00 64.71 2k6y h PRO 14 Cb 0.00 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 30.99 2k6y h PRO 14 CO 0.00 0.00 -0.67 0.54 -0.23 0.00 0.00 178.00 177.64 2k6y s ASN 15 N -4.68 2.17 0.13 1.44 2.20 -1.26 -3.24 114.94 111.71 2k6y s ASN 15 Ca 0.06 -1.20 0.01 0.00 -0.94 0.00 0.00 52.86 50.79 2k6y s ASN 15 Cb 0.10 -0.06 -0.04 0.00 -2.00 0.00 0.00 41.25 39.25 2k6y s ASN 15 CO 0.50 -0.44 0.00 0.00 -2.94 0.00 0.00 177.10 174.22 2k6y s ALA 16 N -3.26 1.06 0.02 3.54 0.00 -0.56 -4.64 121.76 117.93 2k6y s ALA 16 Ca 0.28 -1.48 0.04 0.00 0.00 0.00 0.00 51.96 50.80 2k6y s ALA 16 Cb 0.05 0.54 -0.04 0.00 0.00 0.00 0.00 23.12 23.67 2k6y s ALA 16 CO 0.09 -0.36 -0.07 0.00 0.00 0.00 0.00 175.76 175.43 2k6y s ALA 17 N -3.79 3.03 0.06 0.00 0.00 -1.06 -1.26 121.76 118.76 2k6y s ALA 17 Ca 0.20 -1.06 0.02 0.00 0.00 0.00 0.00 51.96 51.12 2k6y s ALA 17 Cb 0.07 -1.11 -0.03 0.00 0.00 0.00 0.00 23.12 22.05 2k6y s ALA 17 CO 0.00 0.63 -0.07 0.00 0.00 0.00 0.00 175.76 176.32 2k6y s ALA 18 N -1.05 0.70 0.07 0.00 0.00 -0.71 -0.67 121.76 120.09 2k6y s ALA 18 Ca 0.18 -1.02 -0.08 0.00 0.00 0.00 0.00 51.96 51.05 2k6y s ALA 18 Cb -0.11 0.11 -0.01 0.00 0.00 0.00 0.00 23.12 23.12 2k6y s ALA 18 CO 0.09 -0.14 0.16 0.71 0.00 0.00 0.00 175.76 176.58 2k6y s TYR 19 N -2.46 0.18 -0.06 0.00 2.02 -0.62 -1.83 117.35 114.58 2k6y s TYR 19 Ca -0.01 -0.57 -0.30 0.00 -0.37 0.00 0.00 57.07 55.83 2k6y s TYR 19 Cb -0.03 -0.10 0.09 0.00 -0.40 0.00 0.00 41.96 41.53 2k6y s TYR 19 CO -0.03 -0.48 0.80 -0.48 -1.57 0.00 0.00 175.55 173.79 2k6y s LEU 20 N -2.64 -0.52 0.43 -1.29 2.34 -1.26 -1.93 118.68 113.81 2k6y s LEU 20 Ca 0.02 0.45 -0.21 0.00 0.06 0.00 0.00 54.13 54.45 2k6y s LEU 20 Cb 0.03 2.27 -0.11 0.00 -0.56 0.00 0.00 46.19 47.82 2k6y s LEU 20 CO -0.09 -0.56 0.96 -0.89 -1.06 0.00 0.00 176.35 174.70 2k6y s THR 21 N -1.68 4.33 -0.22 5.48 2.01 0.69 -0.97 115.64 125.28 2k6y s THR 21 Ca -0.05 1.47 -0.16 0.00 0.31 0.00 0.00 61.69 63.27 2k6y s THR 21 Cb -0.00 -3.61 0.06 0.00 0.01 0.00 0.00 72.50 68.96 2k6y s THR 21 CO 0.02 -0.29 0.56 -0.22 -0.69 0.00 0.00 174.62 174.00 2k6y s LEU 22 N -3.15 -0.36 -0.16 4.42 1.98 -0.29 -4.59 118.68 116.53 2k6y s LEU 22 Ca 0.62 1.17 0.00 0.00 -2.89 0.00 0.00 54.13 53.04 2k6y s LEU 22 Cb -0.10 1.90 0.03 0.00 0.66 0.00 0.00 46.19 48.67 2k6y s LEU 22 CO 0.14 -0.21 -0.13 -1.83 -1.89 0.00 0.00 176.35 172.43 2k6y s GLU 23 N 0.98 2.23 -0.27 1.98 1.03 -1.26 -0.32 118.70 123.07 2k6y s GLU 23 Ca -0.05 -0.60 -0.29 0.00 0.03 0.00 0.00 54.97 54.06 2k6y s GLU 23 Cb -0.05 -2.15 0.00 0.00 -0.80 0.00 0.00 34.13 31.13 2k6y s GLU 23 CO -0.09 -0.27 1.20 1.21 -1.33 0.00 0.00 175.26 175.98 2k6y s ASN 24 N 1.48 6.85 0.04 0.83 2.47 -0.35 -4.94 114.94 121.32 2k6y s ASN 24 Ca 0.04 1.28 0.27 0.00 0.42 0.00 0.00 52.86 54.87 2k6y s ASN 24 Cb -0.13 -2.54 0.84 0.00 -1.45 0.00 0.00 41.25 37.97 2k6y s ASN 24 CO -0.10 -0.91 1.67 -0.81 -3.72 0.00 0.00 177.10 173.23 2k6y n PRO 25 N 6.93 0.06 -1.47 0.43 -0.04 -1.26 -1.97 135.00 137.67 2k6y n PRO 25 Ca 0.13 0.03 -0.30 0.00 -0.04 0.00 0.00 63.50 63.33 2k6y n PRO 25 Cb 0.46 -1.56 0.09 0.00 -0.04 0.00 0.00 33.50 32.46 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 -3.14 1.63 0.00 0.55 0.00 -1.26 -4.56 107.32 100.54 2k6y s GLY 26 Ca 0.12 -0.11 0.27 0.00 0.00 0.00 0.00 44.72 44.99 2k6y s GLY 26 CO 0.62 0.30 1.60 1.22 0.00 0.00 0.00 173.10 176.84 2k6y n ASP 27 N -3.48 1.58 -4.54 1.64 9.92 -1.26 -1.92 116.55 118.49 2k6y n ASP 27 Ca 0.07 -1.39 -0.24 0.00 -0.53 0.00 0.00 54.79 52.71 2k6y n ASP 27 Cb 0.56 0.07 -0.09 0.00 -0.64 0.00 0.00 41.12 41.01 2k6y n ASP 27 CO 0.00 0.00 0.00 -1.48 0.13 0.00 0.00 177.20 175.85 2k6y s LEU 28 N -2.17 2.82 0.60 0.64 0.05 -1.26 -4.80 118.68 114.56 2k6y s LEU 28 Ca 0.32 -0.87 -0.12 0.00 0.05 0.00 0.00 54.13 53.51 2k6y s LEU 28 Cb 0.20 -1.34 -0.05 0.00 -2.05 0.00 0.00 46.19 42.95 2k6y s LEU 28 CO 0.40 0.03 1.02 -2.16 -0.55 0.00 0.00 176.35 175.09 2k6y s PRO 29 N -3.54 3.66 0.18 1.48 0.04 -1.26 -3.94 135.00 131.62 2k6y s PRO 29 Ca 0.30 0.78 0.04 0.00 0.04 0.00 0.00 61.00 62.16 2k6y s PRO 29 Cb -0.06 -2.09 -0.03 0.00 0.04 0.00 0.00 34.50 32.36 2k6y s PRO 29 CO 0.17 -0.52 0.26 -0.51 0.04 0.00 0.00 177.00 176.44 2k6y s LEU 30 N -5.00 4.18 -0.11 -3.56 1.43 0.18 -4.92 118.68 110.87 2k6y s LEU 30 Ca 0.56 0.05 -0.00 0.00 -1.03 0.00 0.00 54.13 53.70 2k6y s LEU 30 Cb -0.11 -2.74 0.02 0.00 0.03 0.00 0.00 46.19 43.39 2k6y s LEU 30 CO 0.50 0.02 -0.08 -0.60 0.23 0.00 0.00 176.35 176.43 2k6y s ARG 31 N -3.42 1.53 -0.29 1.70 3.52 -1.26 -0.34 118.95 120.38 2k6y s ARG 31 Ca 0.33 -0.26 -0.11 0.00 -0.13 0.00 0.00 55.73 55.57 2k6y s ARG 31 Cb -0.10 -1.58 -0.04 0.00 -1.56 0.00 0.00 34.95 31.67 2k6y s ARG 31 CO 0.27 -0.26 0.18 -1.17 -0.81 0.00 0.00 175.30 173.52 2k6y s LEU 32 N 1.68 4.07 -0.00 -0.88 2.96 0.38 -0.19 118.68 126.70 2k6y s LEU 32 Ca 0.04 -0.18 0.11 0.00 -0.22 0.00 0.00 54.13 53.88 2k6y s LEU 32 Cb -0.13 -2.09 -0.12 0.00 0.50 0.00 0.00 46.19 44.35 2k6y s LEU 32 CO -0.08 -0.10 0.43 1.33 -1.32 0.00 0.00 176.35 176.61 2k6y n VAL 33 N 5.05 0.00 -3.14 1.68 0.24 0.65 -0.83 118.33 121.98 2k6y n VAL 33 Ca -0.14 -0.25 0.00 0.00 -2.04 0.00 0.00 64.34 61.92 2k6y n VAL 33 Cb 0.51 0.91 0.00 0.00 -1.47 0.00 0.00 33.84 33.79 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 1.33 -1.34 3.40 7.63 0.00 -1.17 -4.82 105.19 110.22 2k6y n GLY 34 Ca 0.02 -0.99 -0.16 0.00 0.00 0.00 0.00 46.02 44.89 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 -1.08 -1.36 -0.03 4.61 0.00 -1.26 -0.74 121.76 121.90 2k6y s ALA 35 Ca 0.00 0.91 0.07 0.00 0.00 0.00 0.00 51.96 52.93 2k6y s ALA 35 Cb 0.00 0.03 -0.02 0.00 0.00 0.00 0.00 23.12 23.13 2k6y s ALA 35 CO 0.00 -0.32 -0.23 1.03 0.00 0.00 0.00 175.76 176.24 2k6y s ARG 36 N -1.25 2.25 0.03 0.00 1.81 -0.35 -4.63 118.95 116.80 2k6y s ARG 36 Ca -0.12 -0.86 -0.02 0.00 -1.72 0.00 0.00 55.73 53.01 2k6y s ARG 36 Cb -0.02 -2.14 -0.02 0.00 -0.45 0.00 0.00 34.95 32.31 2k6y s ARG 36 CO 0.08 0.57 0.00 -0.08 -0.68 0.00 0.00 175.30 175.19 2k6y s THR 37 N -0.62 0.13 0.55 0.02 -1.32 -1.26 -0.60 115.64 112.53 2k6y s THR 37 Ca 0.10 -1.06 0.25 0.00 -1.21 0.00 0.00 61.69 59.77 2k6y s THR 37 Cb -0.10 -0.56 0.32 0.00 -1.51 0.00 0.00 72.50 70.64 2k6y s THR 37 CO -0.00 -0.58 2.20 1.55 -2.21 0.00 0.00 174.62 175.57 2k6y h PRO 38 N 4.24 0.00 -0.00 7.08 0.13 -1.99 -3.17 132.00 138.29 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 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2k6y h PRO 38 CO 0.46 0.02 -0.33 1.33 -0.23 0.00 0.00 178.00 179.25 2k6y n VAL 39 N -4.03 0.00 -4.03 1.56 0.24 -1.26 -4.86 118.33 105.96 2k6y n VAL 39 Ca -0.03 -0.04 -0.10 0.00 -2.04 0.00 0.00 64.34 62.13 2k6y n VAL 39 Cb 0.11 0.17 -0.07 0.00 -1.47 0.00 0.00 33.84 32.58 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 -2.79 0.09 0.00 2.33 0.00 -1.20 -2.97 121.76 117.22 2k6y s ALA 40 Ca 0.17 -1.04 0.00 0.00 0.00 0.00 0.00 51.96 51.09 2k6y s ALA 40 Cb 0.18 1.09 0.00 0.00 0.00 0.00 0.00 23.12 24.40 2k6y s ALA 40 CO 0.60 -0.76 0.00 -1.91 0.00 0.00 0.00 175.76 173.70 2k6y n GLU 41 N -0.32 0.00 -2.19 0.00 4.07 -0.66 -4.51 120.64 117.03 2k6y n GLU 41 Ca -0.02 0.00 -0.41 0.00 -0.06 0.00 0.00 57.16 56.67 2k6y n GLU 41 Cb 0.63 -0.05 -0.03 0.00 -0.06 0.00 0.00 31.44 31.94 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 -0.61 4.41 -0.03 5.31 3.52 0.06 -4.91 118.95 126.69 2k6y s ARG 42 Ca 0.00 2.13 0.06 0.00 -0.13 0.00 0.00 55.73 57.80 2k6y s ARG 42 Cb 0.00 -3.10 -0.02 0.00 -1.56 0.00 0.00 34.95 30.27 2k6y s ARG 42 CO 0.00 -0.11 -0.21 0.54 -0.81 0.00 0.00 175.30 174.71 2k6y s VAL 43 N -1.12 2.47 -0.14 7.11 0.11 -1.26 -0.92 120.40 126.66 2k6y s VAL 43 Ca 0.48 -0.95 -0.01 0.00 -2.93 0.00 0.00 61.98 58.58 2k6y s VAL 43 Cb -0.38 -1.91 0.03 0.00 -1.53 0.00 0.00 36.38 32.59 2k6y s VAL 43 CO 0.50 0.58 -0.05 -1.61 -3.33 0.00 0.00 175.10 171.19 2k6y s GLU 44 N -0.65 1.38 -0.17 1.54 2.02 -0.24 -4.94 118.70 117.64 2k6y s GLU 44 Ca 0.10 -0.36 -0.29 0.00 0.02 0.00 0.00 54.97 54.44 2k6y s GLU 44 Cb -0.10 -1.76 -0.01 0.00 0.10 0.00 0.00 34.13 32.36 2k6y s GLU 44 CO -0.00 -0.36 1.16 -1.17 0.02 0.00 0.00 175.26 174.91 2k6y s LEU 45 N 1.70 4.17 0.10 1.80 0.20 -1.26 -0.78 118.68 124.60 2k6y s LEU 45 Ca 0.03 1.59 0.04 0.00 0.69 0.00 0.00 54.13 56.47 2k6y s LEU 45 Cb -0.14 -3.54 -0.04 0.00 -0.43 0.00 0.00 46.19 42.04 2k6y s LEU 45 CO -0.08 -0.69 0.06 -1.00 -0.29 0.00 0.00 176.35 174.35 2k6y s HIS 46 N 3.18 3.10 0.33 5.38 3.76 0.33 -0.92 115.29 130.45 2k6y s HIS 46 Ca 0.51 0.02 0.02 0.00 -0.15 0.00 0.00 55.06 55.45 2k6y s HIS 46 Cb -0.19 -1.56 -0.03 0.00 1.11 0.00 0.00 32.58 31.90 2k6y s HIS 46 CO 0.13 0.51 0.51 -1.83 -0.85 0.00 0.00 174.74 173.21 2k6y s GLU 47 N -2.51 3.42 -0.22 1.40 -1.05 0.43 -1.18 118.70 118.99 2k6y s GLU 47 Ca 0.28 -0.47 -0.01 0.00 -0.15 0.00 0.00 54.97 54.62 2k6y s GLU 47 Cb -0.12 -2.71 0.07 0.00 -0.44 0.00 0.00 34.13 30.93 2k6y s GLU 47 CO 0.21 0.17 0.02 0.99 0.95 0.00 0.00 175.26 177.60 2k6y s THR 48 N -2.26 0.88 0.26 1.83 2.01 0.65 -2.45 115.64 116.57 2k6y s THR 48 Ca 0.40 -0.88 0.08 0.00 0.31 0.00 0.00 61.69 61.60 2k6y s THR 48 Cb -0.09 -1.35 -0.04 0.00 0.01 0.00 0.00 72.50 71.02 2k6y s THR 48 CO 0.34 -0.24 0.09 0.72 -0.69 0.00 0.00 174.62 174.85 2k6y s PHE 49 N 1.68 2.87 -0.06 4.92 -0.12 -0.10 -3.47 117.98 123.70 2k6y s PHE 49 Ca -0.01 -0.18 0.03 0.00 -0.05 0.00 0.00 56.93 56.71 2k6y s PHE 49 Cb -0.18 -1.31 -0.03 0.00 -0.63 0.00 0.00 43.02 40.88 2k6y s PHE 49 CO -0.09 0.56 -0.12 0.00 -0.05 0.00 0.00 175.22 175.51 2k6y s MET 50 N -3.76 2.63 -0.01 1.99 0.23 -1.26 -1.86 119.30 117.26 2k6y s MET 50 Ca 0.32 -0.65 -0.18 0.00 -1.03 0.00 0.00 55.69 54.16 2k6y s MET 50 Cb -0.07 -2.46 0.03 0.00 -1.53 0.00 0.00 34.83 30.81 2k6y s MET 50 CO 0.22 0.61 0.38 1.03 -2.03 0.00 0.00 175.02 175.23 2k6y s ARG 51 N -0.68 0.77 0.49 3.16 0.52 -0.56 -5.00 118.95 117.65 2k6y s ARG 51 Ca 0.10 -0.17 -0.24 0.00 -0.52 0.00 0.00 55.73 54.90 2k6y s ARG 51 Cb -0.11 0.34 -0.07 0.00 0.52 0.00 0.00 34.95 35.64 2k6y s ARG 51 CO 0.01 -0.23 1.40 -1.21 0.02 0.00 0.00 175.30 175.29 2k6y s GLU 52 N -1.54 3.45 0.00 3.54 8.01 -1.26 -0.41 118.70 130.49 2k6y s GLU 52 Ca -0.12 2.34 0.00 0.00 0.01 0.00 0.00 54.97 57.20 2k6y s GLU 52 Cb -0.04 -2.49 0.00 0.00 -4.31 0.00 0.00 34.13 27.30 2k6y s GLU 52 CO 0.04 -0.98 0.00 1.55 0.01 0.00 0.00 175.26 175.88 2k6y n VAL 53 N -0.55 0.00 -1.70 2.63 3.14 -0.82 -4.90 118.33 116.13 2k6y n VAL 53 Ca 0.07 0.00 -0.24 0.00 -2.96 0.00 0.00 64.34 61.21 2k6y n VAL 53 Cb 0.43 0.00 0.07 0.00 -1.06 0.00 0.00 33.84 33.28 2k6y n VAL 53 CO 0.00 0.00 0.00 1.21 -6.46 0.00 0.00 176.83 171.58 2k6y n GLU 54 N -1.43 3.01 0.00 1.45 0.00 -1.26 -4.90 120.64 117.50 2k6y n GLU 54 Ca 0.00 -3.72 0.00 0.00 0.00 0.00 0.00 57.16 53.44 2k6y n GLU 54 Cb 0.00 -2.20 0.00 0.00 0.00 0.00 0.00 31.44 29.24 2k6y n GLU 54 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2k6y n GLY 55 N -0.85 1.02 3.93 8.31 0.00 -1.26 -4.92 105.19 111.42 2k6y n GLY 55 Ca 0.48 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.26 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 3.48 0.33 1.61 1.02 -1.26 -4.89 119.74 120.02 2k6y s LYS 56 Ca 0.00 -0.22 -0.27 0.00 0.02 0.00 0.00 55.97 55.50 2k6y s LYS 56 Cb 0.00 -2.59 -0.09 0.00 -0.52 0.00 0.00 37.83 34.63 2k6y s LYS 56 CO 0.00 0.05 1.09 0.15 -0.92 0.00 0.00 175.35 175.72 2k6y s LYS 57 N -4.43 4.43 0.05 1.68 1.02 -1.26 -1.94 119.74 119.29 2k6y s LYS 57 Ca 0.42 1.71 -0.02 0.00 0.02 0.00 0.00 55.97 58.11 2k6y s LYS 57 Cb -0.10 -2.94 -0.03 0.00 -0.52 0.00 0.00 37.83 34.24 2k6y s LYS 57 CO 0.38 0.05 -0.01 0.08 -0.92 0.00 0.00 175.35 174.93 2k6y s VAL 58 N -1.34 0.19 0.14 3.17 1.01 0.45 -4.93 120.40 119.10 2k6y s VAL 58 Ca 0.50 -1.58 0.07 0.00 0.00 0.00 0.00 61.98 60.96 2k6y s VAL 58 Cb -0.29 -1.26 -0.04 0.00 0.00 0.00 0.00 36.38 34.79 2k6y s VAL 58 CO 0.36 -0.87 -0.03 -0.04 0.00 0.00 0.00 175.10 174.52 2k6y s MET 59 N -3.43 2.35 0.23 2.72 -1.94 -1.26 -1.49 119.30 116.48 2k6y s MET 59 Ca 0.02 -1.05 -0.21 0.00 -1.71 0.00 0.00 55.69 52.74 2k6y s MET 59 Cb 0.04 -2.37 0.07 0.00 2.01 0.00 0.00 34.83 34.58 2k6y s MET 59 CO -0.08 0.48 0.96 0.20 -0.01 0.00 0.00 175.02 176.56 2k6y s GLY 60 N -2.67 0.11 0.24 -0.03 0.00 -0.78 -5.02 107.32 99.18 2k6y s GLY 60 Ca 0.26 -0.36 0.09 0.00 0.00 0.00 0.00 44.72 44.71 2k6y s GLY 60 CO 0.17 1.29 -0.14 1.06 0.00 0.00 0.00 173.10 175.48 2k6y s MET 61 N -2.44 1.48 -0.01 2.90 -1.94 -1.26 -0.92 119.30 117.10 2k6y s MET 61 Ca 0.18 -1.68 -0.28 0.00 -1.71 0.00 0.00 55.69 52.20 2k6y s MET 61 Cb -0.03 -1.32 0.06 0.00 2.01 0.00 0.00 34.83 35.56 2k6y s MET 61 CO 0.06 0.20 0.62 1.03 -0.01 0.00 0.00 175.02 176.92 2k6y s ARG 62 N -3.62 1.05 0.40 2.03 0.52 -1.03 -5.00 118.95 113.29 2k6y s ARG 62 Ca 0.26 0.08 -0.26 0.00 -0.52 0.00 0.00 55.73 55.29 2k6y s ARG 62 Cb -0.01 0.49 -0.09 0.00 0.52 0.00 0.00 34.95 35.86 2k6y s ARG 62 CO 0.10 -0.35 1.31 -1.25 0.02 0.00 0.00 175.30 175.14 2k6y s PRO 63 N -1.63 3.99 0.17 3.54 0.04 -1.26 -0.43 135.00 139.42 2k6y s PRO 63 Ca -0.09 2.18 0.05 0.00 0.04 0.00 0.00 61.00 63.17 2k6y s PRO 63 Cb -0.01 -2.78 -0.04 0.00 0.04 0.00 0.00 34.50 31.72 2k6y s PRO 63 CO 0.06 -0.48 0.18 0.14 0.04 0.00 0.00 177.00 176.94 2k6y s VAL 64 N -1.25 4.70 0.25 -0.36 -7.23 -0.10 -4.84 120.40 111.58 2k6y s VAL 64 Ca 0.56 -1.00 0.37 0.00 -1.81 0.00 0.00 61.98 60.09 2k6y s VAL 64 Cb -0.38 -3.42 0.40 0.00 0.56 0.00 0.00 36.38 33.54 2k6y s VAL 64 CO 0.50 -0.12 2.10 1.55 -0.31 0.00 0.00 175.10 178.81 2k6y h PRO 65 N 2.27 0.00 -1.24 4.82 0.13 -1.97 -3.43 132.00 132.57 2k6y h PRO 65 Ca -0.48 0.00 0.33 0.00 -0.87 0.00 0.00 66.00 64.98 2k6y h PRO 65 Cb 1.20 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 32.17 2k6y h PRO 65 CO 0.64 0.00 0.91 -0.59 -0.23 0.00 0.00 178.00 178.73 2k6y s PHE 66 N -3.81 -0.04 0.43 1.56 -0.12 -1.26 -4.85 117.98 109.88 2k6y s PHE 66 Ca -0.01 -0.00 0.08 0.00 -0.05 0.00 0.00 56.93 56.95 2k6y s PHE 66 Cb 0.10 0.52 -0.01 0.00 -0.63 0.00 0.00 43.02 43.00 2k6y s PHE 66 CO 0.47 -0.13 0.41 -0.51 -0.05 0.00 0.00 175.22 175.42 2k6y s LEU 67 N -2.59 3.39 0.21 -1.99 1.43 -0.01 -5.00 118.68 114.12 2k6y s LEU 67 Ca 0.13 -0.73 -0.04 0.00 -1.03 0.00 0.00 54.13 52.46 2k6y s LEU 67 Cb 0.03 -2.09 -0.03 0.00 0.03 0.00 0.00 46.19 44.13 2k6y s LEU 67 CO -0.04 -0.70 0.22 -1.83 0.23 0.00 0.00 176.35 174.22 2k6y s GLU 68 N -4.18 1.27 -0.10 1.70 -1.05 -1.26 -0.47 118.70 114.61 2k6y s GLU 68 Ca 0.49 -1.52 -0.07 0.00 -0.15 0.00 0.00 54.97 53.72 2k6y s GLU 68 Cb -0.04 0.32 0.04 0.00 -0.44 0.00 0.00 34.13 34.01 2k6y s GLU 68 CO 0.29 -0.45 0.25 0.08 0.95 0.00 0.00 175.26 176.38 2k6y s VAL 69 N -4.12 -0.03 0.93 1.83 1.01 0.53 -4.90 120.40 115.66 2k6y s VAL 69 Ca 0.34 0.10 -0.12 0.00 0.00 0.00 0.00 61.98 62.30 2k6y s VAL 69 Cb 0.05 -0.38 0.15 0.00 0.00 0.00 0.00 36.38 36.20 2k6y s VAL 69 CO 0.11 0.04 1.10 -2.16 0.00 0.00 0.00 175.10 174.19 2k6y s PRO 70 N 0.91 0.96 0.39 2.72 0.04 -1.26 -0.65 135.00 138.12 2k6y s PRO 70 Ca -0.06 0.60 -0.27 0.00 0.04 0.00 0.00 61.00 61.30 2k6y s PRO 70 Cb -0.08 -1.79 -0.10 0.00 0.04 0.00 0.00 34.50 32.57 2k6y s PRO 70 CO -0.06 -2.39 1.43 -1.25 0.04 0.00 0.00 177.00 174.77 2k6y s PRO 71 N -5.02 4.02 0.00 0.56 0.04 -1.25 -2.20 135.00 131.15 2k6y s PRO 71 Ca 0.64 2.44 0.00 0.00 0.04 0.00 0.00 61.00 64.12 2k6y s PRO 71 Cb -0.17 -2.88 0.00 0.00 0.04 0.00 0.00 34.50 31.48 2k6y s PRO 71 CO 0.56 -0.55 0.00 1.63 0.04 0.00 0.00 177.00 178.68 2k6y n LYS 72 N 0.31 -0.56 -2.47 4.56 4.76 -0.81 -4.93 118.16 119.02 2k6y n LYS 72 Ca 0.02 0.14 -0.43 0.00 -2.87 0.00 0.00 58.31 55.17 2k6y n LYS 72 Cb 0.41 -4.09 -0.02 0.00 -1.84 0.00 0.00 35.03 29.48 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 1.37 0.09 0.72 0.00 -0.94 -4.74 107.32 101.82 2k6y s GLY 73 Ca 0.00 -0.02 -0.30 0.00 0.00 0.00 0.00 44.72 44.40 2k6y s GLY 73 CO 0.00 2.54 1.12 -1.60 0.00 0.00 0.00 173.10 175.16 2k6y s ARG 74 N 4.22 4.52 0.12 2.90 6.06 -1.26 -1.22 118.95 134.29 2k6y s ARG 74 Ca 0.54 1.68 -0.01 0.00 -2.50 0.00 0.00 55.73 55.44 2k6y s ARG 74 Cb -0.14 -3.34 -0.04 0.00 0.06 0.00 0.00 34.95 31.48 2k6y s ARG 74 CO 0.24 -0.09 0.05 0.14 -2.50 0.00 0.00 175.30 173.14 2k6y s VAL 75 N 0.57 0.12 -0.30 7.11 -7.23 0.57 -4.99 120.40 116.24 2k6y s VAL 75 Ca 0.54 -1.90 -0.12 0.00 -1.81 0.00 0.00 61.98 58.68 2k6y s VAL 75 Cb -0.28 -2.00 0.16 0.00 0.56 0.00 0.00 36.38 34.82 2k6y s VAL 75 CO 0.31 -0.51 0.88 -1.83 -0.31 0.00 0.00 175.10 173.64 2k6y s GLU 76 N -4.04 0.38 -1.16 4.82 -1.05 -1.26 -1.14 118.70 115.24 2k6y s GLU 76 Ca 0.23 0.89 -0.12 0.00 -0.15 0.00 0.00 54.97 55.82 2k6y s GLU 76 Cb 0.07 0.53 -0.07 0.00 -0.44 0.00 0.00 34.13 34.23 2k6y s GLU 76 CO 0.01 -0.19 2.30 1.28 0.95 0.00 0.00 175.26 179.61 2k6y n LEU 77 N 5.19 6.06 -4.74 1.83 4.32 -0.15 -4.85 117.00 124.67 2k6y n LEU 77 Ca -0.09 -3.50 -0.42 0.00 -0.02 0.00 0.00 56.01 51.99 2k6y n LEU 77 Cb 0.52 -1.32 -0.02 0.00 -1.62 0.00 0.00 43.42 40.97 2k6y n LEU 77 CO -0.04 0.85 1.19 -1.59 -1.22 0.00 0.00 177.39 176.58 2k6y s LYS 78 N 3.43 4.20 0.60 3.23 -2.85 -1.23 -4.52 119.74 122.60 2k6y s LYS 78 Ca 0.52 2.41 0.38 0.00 -1.00 0.00 0.00 55.97 58.28 2k6y s LYS 78 Cb 0.14 -3.10 1.88 0.00 -2.06 0.00 0.00 37.83 34.69 2k6y s LYS 78 CO -0.02 -0.55 2.18 -1.00 0.10 0.00 0.00 175.35 176.07 2k6y h PRO 79 N 5.58 0.00 -2.53 1.78 0.13 -1.93 0.42 132.00 135.45 2k6y h PRO 79 Ca -0.45 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.15 2k6y h PRO 79 Cb 1.21 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.29 2k6y h PRO 79 CO 0.83 0.02 1.98 0.41 -0.23 0.00 0.00 178.00 181.01 2k6y n GLY 80 N -0.62 4.09 0.00 1.56 0.00 -1.26 -4.44 105.19 104.53 2k6y n GLY 80 Ca -0.02 -1.57 0.00 0.00 0.00 0.00 0.00 46.02 44.44 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 2.60 -1.33 3.38 -0.02 0.00 -0.55 -4.97 105.19 104.29 2k6y n GLY 81 Ca 0.62 0.51 -0.14 0.00 0.00 0.00 0.00 46.02 47.01 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 0.00 -0.46 0.07 1.61 2.02 0.03 -0.26 117.35 120.36 2k6y s TYR 82 Ca 0.00 0.98 -0.27 0.00 -0.37 0.00 0.00 57.07 57.41 2k6y s TYR 82 Cb 0.00 0.21 0.08 0.00 -0.40 0.00 0.00 41.96 41.85 2k6y s TYR 82 CO 0.00 -0.37 0.88 -3.38 -1.57 0.00 0.00 175.55 171.11 2k6y s HIS 83 N -0.51 -0.29 -0.19 2.71 -3.43 -0.32 -3.52 115.29 109.75 2k6y s HIS 83 Ca -0.06 0.07 -0.05 0.00 -0.80 0.00 0.00 55.06 54.22 2k6y s HIS 83 Cb -0.03 0.58 -0.03 0.00 -1.43 0.00 0.00 32.58 31.67 2k6y s HIS 83 CO 0.04 -0.69 0.00 -0.06 -2.00 0.00 0.00 174.74 172.03 2k6y s PHE 84 N -3.26 3.07 -0.47 0.38 0.08 -0.76 -0.51 117.98 116.50 2k6y s PHE 84 Ca 0.07 -0.31 -0.21 0.00 0.12 0.00 0.00 56.93 56.60 2k6y s PHE 84 Cb -0.01 -2.05 0.03 0.00 -0.57 0.00 0.00 43.02 40.42 2k6y s PHE 84 CO -0.05 -0.11 0.72 -1.64 -0.10 0.00 0.00 175.22 174.04 2k6y s MET 85 N 0.72 3.28 -0.11 0.44 -1.94 0.04 -1.74 119.30 119.98 2k6y s MET 85 Ca 0.00 -0.40 -0.17 0.00 -1.71 0.00 0.00 55.69 53.40 2k6y s MET 85 Cb -0.14 -3.99 -0.04 0.00 2.01 0.00 0.00 34.83 32.66 2k6y s MET 85 CO 0.02 -1.15 0.45 -0.51 -0.01 0.00 0.00 175.02 173.82 2k6y s LEU 86 N 3.07 4.29 0.06 -0.03 2.01 -0.39 -1.08 118.68 126.61 2k6y s LEU 86 Ca 0.24 0.79 0.03 0.00 0.01 0.00 0.00 54.13 55.21 2k6y s LEU 86 Cb -0.14 -2.65 -0.03 0.00 0.01 0.00 0.00 46.19 43.38 2k6y s LEU 86 CO 0.18 0.04 -0.10 -0.76 1.01 0.00 0.00 176.35 176.72 2k6y s LEU 87 N 0.48 2.28 -0.15 1.79 1.43 -0.09 -1.49 118.68 122.92 2k6y s LEU 87 Ca 0.25 -0.60 -0.00 0.00 -1.03 0.00 0.00 54.13 52.74 2k6y s LEU 87 Cb -0.15 -0.30 -0.00 0.00 0.03 0.00 0.00 46.19 45.77 2k6y s LEU 87 CO 0.10 -0.17 0.13 0.61 0.23 0.00 0.00 176.35 177.25 2k6y n GLY 88 N 1.29 0.44 3.62 -3.19 0.00 -1.20 -0.76 105.19 105.39 2k6y n GLY 88 Ca -0.21 -0.32 -0.43 0.00 0.00 0.00 0.00 46.02 45.05 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 -2.82 3.83 0.00 0.99 1.43 -1.25 -2.52 118.68 118.34 2k6y s LEU 89 Ca 0.02 1.60 0.24 0.00 -1.03 0.00 0.00 54.13 54.96 2k6y s LEU 89 Cb -0.00 -3.53 0.28 0.00 0.03 0.00 0.00 46.19 42.96 2k6y s LEU 89 CO 0.10 -1.35 1.31 2.29 0.23 0.00 0.00 176.35 178.93 2k6y n LYS 90 N 7.82 2.24 -3.60 1.70 2.85 -1.16 -4.90 118.16 123.11 2k6y n LYS 90 Ca 0.20 -1.81 -0.16 0.00 -1.05 0.00 0.00 58.31 55.48 2k6y n LYS 90 Cb 0.45 -1.46 -0.07 0.00 -0.65 0.00 0.00 35.03 33.30 2k6y n LYS 90 CO 0.00 0.00 0.00 -0.98 -0.05 0.00 0.00 177.40 176.37 2k6y s ARG 91 N -2.01 0.92 0.65 -1.58 1.70 -1.26 -5.08 118.95 112.30 2k6y s ARG 91 Ca 0.29 0.21 -0.14 0.00 -0.47 0.00 0.00 55.73 55.62 2k6y s ARG 91 Cb 0.20 0.43 -0.01 0.00 -0.57 0.00 0.00 34.95 35.01 2k6y s ARG 91 CO 0.31 -0.26 1.08 -1.25 -1.08 0.00 0.00 175.30 174.09 2k6y s PRO 92 N -1.05 2.96 0.17 3.89 0.04 -1.26 -4.96 135.00 134.79 2k6y s PRO 92 Ca -0.10 1.21 0.04 0.00 0.04 0.00 0.00 61.00 62.19 2k6y s PRO 92 Cb -0.02 -1.98 -0.04 0.00 0.04 0.00 0.00 34.50 32.50 2k6y s PRO 92 CO 0.07 -1.10 0.21 -0.51 0.04 0.00 0.00 177.00 175.72 2k6y s LEU 93 N -4.97 4.05 -0.15 -3.56 1.02 -1.26 -5.10 118.68 108.70 2k6y s LEU 93 Ca 0.63 -0.01 0.02 0.00 0.02 0.00 0.00 54.13 54.80 2k6y s LEU 93 Cb -0.17 -2.63 0.01 0.00 0.02 0.00 0.00 46.19 43.42 2k6y s LEU 93 CO 0.44 0.05 -0.21 -0.75 0.02 0.00 0.00 176.35 175.90 2k6y s LYS 94 N -3.26 2.93 0.22 1.70 2.36 -1.26 -5.03 119.74 117.39 2k6y s LYS 94 Ca 0.33 -0.82 -0.32 0.00 -2.55 0.00 0.00 55.97 52.61 2k6y s LYS 94 Cb -0.10 -2.42 -0.13 0.00 -1.05 0.00 0.00 37.83 34.13 2k6y s LYS 94 CO 0.26 -0.08 1.62 0.00 1.55 0.00 0.00 175.35 178.70 2k6y n ALA 95 N 4.24 2.15 -3.03 3.13 0.00 -1.26 -2.05 120.51 123.69 2k6y n ALA 95 Ca -0.20 0.41 -0.13 0.00 0.00 0.00 0.00 53.44 53.52 2k6y n ALA 95 Cb 0.51 -2.43 0.05 0.00 0.00 0.00 0.00 19.45 17.58 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 3.24 0.02 3.20 0.00 0.00 -1.24 -5.08 105.19 105.32 2k6y n GLY 96 Ca 0.14 -0.13 -0.19 0.00 0.00 0.00 0.00 46.02 45.84 2k6y n GLY 96 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2k6y n GLU 97 N -3.06 0.76 -4.35 1.61 0.28 -0.87 -5.00 120.64 110.00 2k6y n GLU 97 Ca -0.07 -2.76 -0.19 0.00 -0.16 0.00 0.00 57.16 53.99 2k6y n GLU 97 Cb 0.56 0.11 -0.10 0.00 1.43 0.00 0.00 31.44 33.44 2k6y n GLU 97 CO 0.00 0.00 0.00 -1.21 -0.16 0.00 0.00 177.13 175.76 2k6y s GLU 98 N -4.00 1.36 -0.13 3.44 2.02 -1.26 -0.47 118.70 119.65 2k6y s GLU 98 Ca 0.36 -1.62 0.00 0.00 0.02 0.00 0.00 54.97 53.73 2k6y s GLU 98 Cb -0.03 -1.06 0.02 0.00 0.10 0.00 0.00 34.13 33.16 2k6y s GLU 98 CO 0.23 0.13 -0.12 0.08 0.02 0.00 0.00 175.26 175.60 2k6y s VAL 99 N -3.03 1.39 -0.10 2.63 1.01 0.61 -4.84 120.40 118.06 2k6y s VAL 99 Ca 0.24 -0.52 -0.29 0.00 0.00 0.00 0.00 61.98 61.40 2k6y s VAL 99 Cb 0.01 -1.32 -0.04 0.00 0.00 0.00 0.00 36.38 35.02 2k6y s VAL 99 CO 0.07 0.43 1.58 -1.61 0.00 0.00 0.00 175.10 175.57 2k6y s GLU 100 N 1.49 4.13 -0.19 2.72 2.02 -1.26 -2.47 118.70 125.13 2k6y s GLU 100 Ca 0.03 2.01 -0.01 0.00 0.02 0.00 0.00 54.97 57.02 2k6y s GLU 100 Cb -0.13 -3.95 0.00 0.00 0.10 0.00 0.00 34.13 30.15 2k6y s GLU 100 CO -0.09 -0.89 -0.13 -0.51 0.02 0.00 0.00 175.26 173.67 2k6y s LEU 101 N 4.12 2.51 -0.86 1.80 1.43 -0.33 -4.08 118.68 123.28 2k6y s LEU 101 Ca 0.70 -0.51 -0.22 0.00 -1.03 0.00 0.00 54.13 53.07 2k6y s LEU 101 Cb -0.30 -1.60 0.09 0.00 0.03 0.00 0.00 46.19 44.40 2k6y s LEU 101 CO 0.27 0.00 1.18 -1.81 0.23 0.00 0.00 176.35 176.22 2k6y s ASP 102 N 1.30 6.43 -0.06 2.29 1.01 0.23 -0.50 116.67 127.37 2k6y s ASP 102 Ca 0.04 -1.46 -0.30 0.00 0.71 0.00 0.00 52.55 51.54 2k6y s ASP 102 Cb -0.14 -2.46 -0.06 0.00 1.01 0.00 0.00 42.92 41.27 2k6y s ASP 102 CO -0.07 -1.35 1.71 -0.76 0.21 0.00 0.00 175.17 174.91 2k6y s LEU 103 N 3.91 4.29 -0.25 1.23 1.43 -0.03 -1.21 118.68 128.04 2k6y s LEU 103 Ca 0.33 2.25 -0.19 0.00 -1.03 0.00 0.00 54.13 55.49 2k6y s LEU 103 Cb -0.07 -3.53 -0.02 0.00 0.03 0.00 0.00 46.19 42.59 2k6y s LEU 103 CO -0.02 -0.99 0.57 -0.76 0.23 0.00 0.00 176.35 175.39 2k6y s LEU 104 N 4.26 4.07 -0.11 1.79 1.43 0.08 -2.06 118.68 128.14 2k6y s LEU 104 Ca 0.76 0.64 0.02 0.00 -1.03 0.00 0.00 54.13 54.51 2k6y s LEU 104 Cb -0.34 -2.76 -0.01 0.00 0.03 0.00 0.00 46.19 43.10 2k6y s LEU 104 CO 0.31 -0.31 -0.17 -0.36 0.23 0.00 0.00 176.35 176.05 2k6y s PHE 105 N 2.31 2.71 0.00 0.29 0.08 0.67 -0.25 117.98 123.78 2k6y s PHE 105 Ca 0.24 -0.72 0.00 0.00 0.12 0.00 0.00 56.93 56.57 2k6y s PHE 105 Cb -0.16 -1.77 0.00 0.00 -0.57 0.00 0.00 43.02 40.52 2k6y s PHE 105 CO 0.09 -0.24 0.00 0.00 -0.10 0.00 0.00 175.22 174.97 2k6y n ALA 106 N 3.38 0.00 0.00 5.36 0.00 0.74 -1.31 120.51 128.68 2k6y n ALA 106 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.26 2k6y n ALA 106 Cb 0.53 -0.06 0.00 0.00 0.00 0.00 0.00 19.45 19.92 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 -0.95 0.43 0.00 0.00 0.00 -1.26 -4.99 105.19 98.42 2k6y n GLY 107 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 0.00 1.00 3.56 -0.02 0.00 -0.97 -5.06 105.19 103.70 2k6y n GLY 108 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 2k6y n GLY 108 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2k6y s LYS 109 N 0.00 3.23 -0.00 1.61 2.36 -0.43 -4.86 119.74 121.65 2k6y s LYS 109 Ca 0.00 -0.14 -0.16 0.00 -2.55 0.00 0.00 55.97 53.12 2k6y s LYS 109 Cb 0.00 -4.16 -0.06 0.00 -1.05 0.00 0.00 37.83 32.56 2k6y s LYS 109 CO 0.00 -2.09 0.45 0.54 1.55 0.00 0.00 175.35 175.80 2k6y s VAL 110 N 5.70 4.99 -0.01 4.02 0.11 -1.26 -0.24 120.40 133.70 2k6y s VAL 110 Ca 0.37 0.94 -0.01 0.00 -2.93 0.00 0.00 61.98 60.35 2k6y s VAL 110 Cb -0.08 -3.77 0.01 0.00 -1.53 0.00 0.00 36.38 31.01 2k6y s VAL 110 CO 0.17 0.54 0.03 -0.76 -3.33 0.00 0.00 175.10 171.74 2k6y s LEU 111 N -0.82 1.61 0.06 2.54 1.43 -0.88 -4.96 118.68 117.66 2k6y s LEU 111 Ca 0.25 0.05 -0.31 0.00 -1.03 0.00 0.00 54.13 53.10 2k6y s LEU 111 Cb -0.17 0.04 -0.08 0.00 0.03 0.00 0.00 46.19 46.01 2k6y s LEU 111 CO 0.14 -0.05 1.57 -0.54 0.23 0.00 0.00 176.35 177.71 2k6y s LYS 112 N 0.38 4.22 0.14 1.70 3.01 -1.26 -0.85 119.74 127.09 2k6y s LYS 112 Ca -0.03 2.23 0.03 0.00 -1.01 0.00 0.00 55.97 57.18 2k6y s LYS 112 Cb -0.05 -3.56 -0.04 0.00 -1.01 0.00 0.00 37.83 33.17 2k6y s LYS 112 CO -0.01 -0.68 0.23 0.14 0.51 0.00 0.00 175.35 175.54 2k6y s VAL 113 N 2.47 5.11 -0.03 3.17 -7.23 0.34 -4.97 120.40 119.27 2k6y s VAL 113 Ca 0.71 -0.75 0.07 0.00 -1.81 0.00 0.00 61.98 60.20 2k6y s VAL 113 Cb -0.38 -3.60 -0.02 0.00 0.56 0.00 0.00 36.38 32.94 2k6y s VAL 113 CO 0.31 -0.06 -0.24 0.54 -0.31 0.00 0.00 175.10 175.33 2k6y s VAL 114 N -1.70 2.23 0.02 1.32 0.11 -1.26 -1.18 120.40 119.93 2k6y s VAL 114 Ca 0.34 -1.04 -0.28 0.00 -2.93 0.00 0.00 61.98 58.07 2k6y s VAL 114 Cb -0.11 -1.79 0.08 0.00 -1.53 0.00 0.00 36.38 33.04 2k6y s VAL 114 CO 0.27 0.58 0.73 -1.48 -3.33 0.00 0.00 175.10 171.87 2k6y s LEU 115 N -0.61 -0.53 0.67 2.54 0.05 -1.03 -4.99 118.68 114.77 2k6y s LEU 115 Ca 0.10 0.28 -0.11 0.00 0.05 0.00 0.00 54.13 54.45 2k6y s LEU 115 Cb -0.10 2.37 -0.01 0.00 -2.05 0.00 0.00 46.19 46.40 2k6y s LEU 115 CO -0.01 -0.71 1.05 -2.16 -0.55 0.00 0.00 176.35 173.98 2k6y s PRO 116 N -2.48 3.17 -0.20 1.48 0.04 -1.26 -0.29 135.00 135.47 2k6y s PRO 116 Ca -0.02 0.87 -0.22 0.00 0.04 0.00 0.00 61.00 61.66 2k6y s PRO 116 Cb -0.01 -2.02 -0.02 0.00 0.04 0.00 0.00 34.50 32.49 2k6y s PRO 116 CO -0.03 -0.91 0.70 0.08 0.04 0.00 0.00 177.00 176.88 2k6y s VAL 117 N -3.10 4.96 -0.11 -0.36 1.01 0.38 -1.32 120.40 121.85 2k6y s VAL 117 Ca 0.57 1.33 -0.17 0.00 0.00 0.00 0.00 61.98 63.71 2k6y s VAL 117 Cb -0.13 -4.01 -0.04 0.00 0.00 0.00 0.00 36.38 32.20 2k6y s VAL 117 CO 0.55 0.06 0.44 -0.70 0.00 0.00 0.00 175.10 175.44 2k6y s GLU 118 N 2.16 4.28 -0.21 2.72 -6.30 0.40 -3.68 118.70 118.08 2k6y s GLU 118 Ca 0.31 0.39 -0.05 0.00 -2.50 0.00 0.00 54.97 53.13 2k6y s GLU 118 Cb -0.16 -3.41 0.10 0.00 0.00 0.00 0.00 34.13 30.67 2k6y s GLU 118 CO 0.10 0.23 0.39 0.00 0.02 0.00 0.00 175.26 176.00 2k6y s ALA 119 N 0.40 -1.06 0.00 6.30 0.00 -1.26 -0.80 121.76 125.34 2k6y s ALA 119 Ca 0.24 1.21 0.00 0.00 0.00 0.00 0.00 51.96 53.41 2k6y s ALA 119 Cb -0.15 -1.42 0.00 0.00 0.00 0.00 0.00 23.12 21.55 2k6y s ALA 119 CO 0.10 -0.94 0.00 0.54 0.00 0.00 0.00 175.76 175.46