#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k6y h SER 2 N 0.00 0.34 -5.29 1.61 4.64 -2.07 -3.45 113.55 109.34 2k6y h SER 2 Ca 0.00 -0.02 -0.14 0.00 -0.47 0.00 0.00 61.79 61.16 2k6y h SER 2 Cb 0.00 -0.09 -0.06 0.00 -0.31 0.00 0.00 62.40 61.95 2k6y h SER 2 CO 0.00 0.28 -0.02 0.72 -0.87 0.00 0.00 176.83 176.94 2k6y s PHE 3 N -5.29 0.58 0.00 4.77 -0.71 -1.26 -5.08 117.98 110.99 2k6y s PHE 3 Ca -0.07 -0.98 0.00 0.00 -1.04 0.00 0.00 56.93 54.84 2k6y s PHE 3 Cb 0.17 0.28 0.00 0.00 -1.21 0.00 0.00 43.02 42.26 2k6y s PHE 3 CO 0.72 -1.23 0.00 2.41 -1.34 0.00 0.00 175.22 175.78 2k6y n THR 4 N -0.51 0.00 -3.70 -4.49 -1.04 -1.26 -5.20 114.28 98.08 2k6y n THR 4 Ca -0.02 0.00 -0.10 0.00 -2.04 0.00 0.00 64.05 61.89 2k6y n THR 4 Cb 0.61 0.00 -0.04 0.00 -1.82 0.00 0.00 70.33 69.08 2k6y n THR 4 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 2k6y s GLU 5 N 4.59 1.30 0.30 -2.82 2.12 -1.26 -4.96 118.70 117.97 2k6y s GLU 5 Ca 0.00 -0.82 -0.03 0.00 0.36 0.00 0.00 54.97 54.48 2k6y s GLU 5 Cb 0.00 0.51 -0.05 0.00 0.26 0.00 0.00 34.13 34.85 2k6y s GLU 5 CO 0.00 -0.54 0.54 0.20 -0.54 0.00 0.00 175.26 174.91 2k6y s GLY 6 N -2.85 1.72 -0.08 -1.50 0.00 -1.26 -4.26 107.32 99.08 2k6y s GLY 6 Ca 0.08 -0.68 -0.22 0.00 0.00 0.00 0.00 44.72 43.90 2k6y s GLY 6 CO -0.05 -0.59 0.50 0.66 0.00 0.00 0.00 173.10 173.62 2k6y s TRP 7 N -2.13 -0.46 -0.24 1.90 -2.14 -0.75 -4.26 118.94 110.86 2k6y s TRP 7 Ca 0.42 0.89 -0.03 0.00 2.66 0.00 0.00 56.10 60.04 2k6y s TRP 7 Cb -0.10 0.24 0.01 0.00 -3.10 0.00 0.00 33.47 30.52 2k6y s TRP 7 CO 0.32 -0.44 -0.04 0.08 -2.66 0.00 0.00 176.95 174.20 2k6y s VAL 8 N -0.85 3.14 -0.64 -0.66 1.01 -0.36 -1.75 120.40 120.29 2k6y s VAL 8 Ca -0.09 -0.80 -0.27 0.00 0.00 0.00 0.00 61.98 60.82 2k6y s VAL 8 Cb -0.03 -2.53 0.04 0.00 0.00 0.00 0.00 36.38 33.85 2k6y s VAL 8 CO 0.05 0.27 1.17 -0.60 0.00 0.00 0.00 175.10 176.00 2k6y s ARG 9 N 1.40 3.33 0.85 2.72 3.52 0.12 -0.47 118.95 130.42 2k6y s ARG 9 Ca 0.03 -0.10 -0.12 0.00 -0.13 0.00 0.00 55.73 55.41 2k6y s ARG 9 Cb -0.16 -4.10 0.10 0.00 -1.56 0.00 0.00 34.95 29.23 2k6y s ARG 9 CO -0.04 -1.84 1.10 0.12 -0.81 0.00 0.00 175.30 173.83 2k6y s PHE 10 N 5.03 2.58 0.02 5.12 5.36 0.12 -2.72 117.98 133.49 2k6y s PHE 10 Ca 0.36 1.19 -0.28 0.00 -0.96 0.00 0.00 56.93 57.24 2k6y s PHE 10 Cb -0.09 -3.15 0.08 0.00 -0.34 0.00 0.00 43.02 39.52 2k6y s PHE 10 CO 0.19 -2.08 0.69 -1.12 -1.46 0.00 0.00 175.22 171.45 2k6y s SER 11 N -3.68 -0.59 0.00 6.13 0.01 -1.26 -4.42 113.70 109.89 2k6y s SER 11 Ca 0.62 0.40 0.00 0.00 1.31 0.00 0.00 55.95 58.28 2k6y s SER 11 Cb -0.16 0.53 0.00 0.00 0.21 0.00 0.00 66.02 66.60 2k6y s SER 11 CO 0.55 -0.71 0.67 -0.81 0.41 0.00 0.00 173.24 173.36 2k6y n PRO 12 N 0.38 0.76 0.00 12.44 -0.04 -1.26 -4.88 135.00 142.41 2k6y n PRO 12 Ca -0.17 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.29 2k6y n PRO 12 Cb 0.60 -1.18 0.00 0.00 -0.04 0.00 0.00 33.50 32.88 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 0.50 -0.18 0.00 0.55 0.00 -1.26 -4.95 105.19 99.85 2k6y n GLY 13 Ca 0.00 -1.76 0.12 0.00 0.00 0.00 0.00 46.02 44.38 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 -0.08 0.36 -3.91 1.61 -0.04 -1.26 -4.98 135.00 126.70 2k6y n PRO 14 Ca 0.00 0.05 -0.09 0.00 -0.04 0.00 0.00 63.50 63.42 2k6y n PRO 14 Cb 0.00 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 31.88 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 -2.56 0.18 0.24 3.54 6.03 -1.26 -2.42 114.94 118.69 2k6y s ASN 15 Ca 0.23 -0.62 -0.06 0.00 -1.03 0.00 0.00 52.86 51.38 2k6y s ASN 15 Cb 0.16 0.28 0.02 0.00 -3.03 0.00 0.00 41.25 38.69 2k6y s ASN 15 CO 0.37 -0.62 0.42 0.00 -2.03 0.00 0.00 177.10 175.24 2k6y n ALA 16 N 0.33 -0.74 -3.72 3.54 0.00 -0.22 -4.55 120.51 115.15 2k6y n ALA 16 Ca -0.17 -0.90 -0.12 0.00 0.00 0.00 0.00 53.44 52.25 2k6y n ALA 16 Cb 0.60 0.72 -0.13 0.00 0.00 0.00 0.00 19.45 20.65 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 -1.96 -0.65 -0.09 0.00 0.00 -1.10 -0.82 121.76 117.14 2k6y s ALA 17 Ca 0.14 1.09 -0.01 0.00 0.00 0.00 0.00 51.96 53.17 2k6y s ALA 17 Cb -0.02 -0.72 -0.03 0.00 0.00 0.00 0.00 23.12 22.34 2k6y s ALA 17 CO 0.10 -0.25 -0.02 0.00 0.00 0.00 0.00 175.76 175.58 2k6y s ALA 18 N 1.40 3.15 0.12 0.00 0.00 -0.43 -0.70 121.76 125.30 2k6y s ALA 18 Ca -0.08 -0.83 0.08 0.00 0.00 0.00 0.00 51.96 51.13 2k6y s ALA 18 Cb -0.10 -1.42 -0.04 0.00 0.00 0.00 0.00 23.12 21.56 2k6y s ALA 18 CO -0.09 0.52 -0.20 0.71 0.00 0.00 0.00 175.76 176.70 2k6y s TYR 19 N -0.66 1.82 -0.06 0.00 2.02 -0.72 -1.87 117.35 117.88 2k6y s TYR 19 Ca 0.10 -0.43 -0.31 0.00 -0.37 0.00 0.00 57.07 56.07 2k6y s TYR 19 Cb -0.12 -0.97 0.08 0.00 -0.40 0.00 0.00 41.96 40.55 2k6y s TYR 19 CO 0.02 0.24 0.72 -0.48 -1.57 0.00 0.00 175.55 174.48 2k6y s LEU 20 N -2.11 -0.63 -0.38 -1.29 0.05 -1.26 -1.80 118.68 111.27 2k6y s LEU 20 Ca 0.09 0.68 -0.22 0.00 0.05 0.00 0.00 54.13 54.73 2k6y s LEU 20 Cb -0.09 2.46 0.01 0.00 -2.05 0.00 0.00 46.19 46.52 2k6y s LEU 20 CO 0.05 -0.58 0.70 -0.89 -0.55 0.00 0.00 176.35 175.08 2k6y s THR 21 N -1.21 4.80 0.20 5.48 2.01 -1.26 -0.55 115.64 125.12 2k6y s THR 21 Ca -0.10 0.63 0.08 0.00 0.31 0.00 0.00 61.69 62.61 2k6y s THR 21 Cb -0.00 -4.16 -0.04 0.00 0.01 0.00 0.00 72.50 68.31 2k6y s THR 21 CO 0.09 -0.43 0.02 -0.22 -0.69 0.00 0.00 174.62 173.39 2k6y s LEU 22 N 2.92 3.34 0.07 4.42 0.20 -0.04 -4.77 118.68 124.81 2k6y s LEU 22 Ca 0.27 -0.44 -0.11 0.00 0.69 0.00 0.00 54.13 54.54 2k6y s LEU 22 Cb -0.14 -1.95 0.01 0.00 -0.43 0.00 0.00 46.19 43.68 2k6y s LEU 22 CO 0.17 0.05 0.24 -1.83 -0.29 0.00 0.00 176.35 174.69 2k6y s GLU 23 N -3.22 0.81 -0.43 1.98 -1.05 -1.26 -0.38 118.70 115.15 2k6y s GLU 23 Ca 0.29 -0.75 -0.18 0.00 -0.15 0.00 0.00 54.97 54.19 2k6y s GLU 23 Cb -0.08 0.34 0.02 0.00 -0.44 0.00 0.00 34.13 33.97 2k6y s GLU 23 CO 0.20 -0.26 0.46 1.21 0.95 0.00 0.00 175.26 177.81 2k6y s ASN 24 N -2.47 6.20 0.00 0.83 2.47 -0.64 -4.96 114.94 116.37 2k6y s ASN 24 Ca -0.00 -0.67 0.30 0.00 0.42 0.00 0.00 52.86 52.90 2k6y s ASN 24 Cb 0.02 -2.23 1.40 0.00 -1.45 0.00 0.00 41.25 38.99 2k6y s ASN 24 CO -0.07 -0.61 1.96 -0.81 -3.72 0.00 0.00 177.10 173.84 2k6y n PRO 25 N 5.66 0.90 -2.44 0.43 -0.04 -1.26 -1.01 135.00 137.24 2k6y n PRO 25 Ca -0.07 -0.27 -0.23 0.00 -0.04 0.00 0.00 63.50 62.89 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 -2.28 1.76 0.00 0.55 0.00 -1.26 -4.78 107.32 101.32 2k6y s GLY 26 Ca 0.35 -1.22 0.26 0.00 0.00 0.00 0.00 44.72 44.11 2k6y s GLY 26 CO 0.42 -0.84 1.47 1.22 0.00 0.00 0.00 173.10 175.38 2k6y n ASP 27 N -2.67 2.35 -4.51 1.64 8.00 -1.26 -2.70 116.55 117.39 2k6y n ASP 27 Ca 0.09 -1.78 -0.27 0.00 0.71 0.00 0.00 54.79 53.54 2k6y n ASP 27 Cb 0.60 -0.01 -0.10 0.00 -0.02 0.00 0.00 41.12 41.59 2k6y n ASP 27 CO 0.00 0.00 0.00 -1.48 -0.39 0.00 0.00 177.20 175.33 2k6y s LEU 28 N -1.99 2.74 0.62 0.64 0.05 -1.26 -4.78 118.68 114.70 2k6y s LEU 28 Ca 0.33 -0.71 -0.12 0.00 0.05 0.00 0.00 54.13 53.67 2k6y s LEU 28 Cb 0.20 -1.44 -0.04 0.00 -2.05 0.00 0.00 46.19 42.87 2k6y s LEU 28 CO 0.31 0.11 1.03 -2.16 -0.55 0.00 0.00 176.35 175.09 2k6y s PRO 29 N -2.80 3.52 0.12 1.48 0.04 -1.26 -4.41 135.00 131.69 2k6y s PRO 29 Ca 0.23 0.83 0.04 0.00 0.04 0.00 0.00 61.00 62.15 2k6y s PRO 29 Cb -0.08 -2.07 -0.04 0.00 0.04 0.00 0.00 34.50 32.35 2k6y s PRO 29 CO 0.13 -0.63 0.08 -0.51 0.04 0.00 0.00 177.00 176.11 2k6y s LEU 30 N -5.07 3.70 -0.19 -3.56 1.43 -0.18 -4.97 118.68 109.85 2k6y s LEU 30 Ca 0.56 -0.12 -0.01 0.00 -1.03 0.00 0.00 54.13 53.54 2k6y s LEU 30 Cb -0.12 -2.36 0.05 0.00 0.03 0.00 0.00 46.19 43.79 2k6y s LEU 30 CO 0.50 0.13 -0.02 -0.60 0.23 0.00 0.00 176.35 176.60 2k6y s ARG 31 N -2.69 1.13 -0.39 1.70 3.52 -1.26 -0.39 118.95 120.56 2k6y s ARG 31 Ca 0.29 -0.56 -0.18 0.00 -0.13 0.00 0.00 55.73 55.16 2k6y s ARG 31 Cb -0.11 -2.13 0.01 0.00 -1.56 0.00 0.00 34.95 31.16 2k6y s ARG 31 CO 0.22 -0.55 0.49 -1.17 -0.81 0.00 0.00 175.30 173.48 2k6y s LEU 32 N 1.68 4.57 -0.00 -0.88 2.96 0.69 -1.20 118.68 126.50 2k6y s LEU 32 Ca -0.01 -0.34 0.11 0.00 -0.22 0.00 0.00 54.13 53.66 2k6y s LEU 32 Cb -0.17 -2.51 -0.13 0.00 0.50 0.00 0.00 46.19 43.88 2k6y s LEU 32 CO -0.07 -0.56 0.42 1.33 -1.32 0.00 0.00 176.35 176.15 2k6y n VAL 33 N 5.49 0.00 -3.31 1.68 0.24 0.57 -0.44 118.33 122.56 2k6y n VAL 33 Ca -0.06 -0.25 0.00 0.00 -2.04 0.00 0.00 64.34 62.00 2k6y n VAL 33 Cb 0.48 0.86 0.00 0.00 -1.47 0.00 0.00 33.84 33.71 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 1.37 -1.13 3.42 7.63 0.00 -1.19 -4.71 105.19 110.58 2k6y n GLY 34 Ca 0.01 -0.90 -0.14 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 0.00 -0.46 -3.10 4.61 0.00 -1.26 -0.96 120.51 119.35 2k6y n ALA 35 Ca 0.00 -1.61 -0.12 0.00 0.00 0.00 0.00 53.44 51.71 2k6y n ALA 35 Cb 0.00 1.29 -0.11 0.00 0.00 0.00 0.00 19.45 20.63 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 -2.75 0.30 -0.01 0.00 1.81 -0.50 -4.91 118.95 112.90 2k6y s ARG 36 Ca 0.28 0.14 -0.21 0.00 -1.72 0.00 0.00 55.73 54.22 2k6y s ARG 36 Cb -0.01 0.14 0.04 0.00 -0.45 0.00 0.00 34.95 34.67 2k6y s ARG 36 CO 0.20 -0.05 0.46 -0.08 -0.68 0.00 0.00 175.30 175.15 2k6y s THR 37 N -0.22 0.04 -0.12 0.02 -1.32 -1.26 -0.80 115.64 111.98 2k6y s THR 37 Ca -0.03 -0.31 0.30 0.00 -1.21 0.00 0.00 61.69 60.44 2k6y s THR 37 Cb -0.03 -0.82 0.34 0.00 -1.51 0.00 0.00 72.50 70.48 2k6y s THR 37 CO 0.01 -0.17 1.88 1.55 -2.21 0.00 0.00 174.62 175.68 2k6y h PRO 38 N 3.38 0.00 -0.64 7.08 0.13 -1.96 -3.21 132.00 136.78 2k6y h PRO 38 Ca -0.29 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 2k6y h PRO 38 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 2k6y h PRO 38 CO 0.40 0.00 0.00 1.33 -0.23 0.00 0.00 178.00 179.50 2k6y n VAL 39 N -2.74 1.01 -3.67 1.56 0.24 -1.26 -3.57 118.33 109.89 2k6y n VAL 39 Ca 0.01 -0.88 -0.14 0.00 -2.04 0.00 0.00 64.34 61.28 2k6y n VAL 39 Cb 0.27 0.34 -0.08 0.00 -1.47 0.00 0.00 33.84 32.90 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 -1.30 -1.30 -0.00 2.33 0.00 -1.22 -4.38 121.76 115.89 2k6y s ALA 40 Ca 0.43 1.21 -0.00 0.00 0.00 0.00 0.00 51.96 53.60 2k6y s ALA 40 Cb 0.23 -0.48 -0.00 0.00 0.00 0.00 0.00 23.12 22.87 2k6y s ALA 40 CO 0.27 -0.28 -0.01 -1.91 0.00 0.00 0.00 175.76 173.84 2k6y n GLU 41 N 2.06 0.01 -2.29 0.00 4.07 -0.90 -4.25 120.64 119.35 2k6y n GLU 41 Ca -0.16 0.01 -0.43 0.00 -0.06 0.00 0.00 57.16 56.51 2k6y n GLU 41 Cb 0.56 -0.52 -0.02 0.00 -0.06 0.00 0.00 31.44 31.40 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 -1.03 3.52 -0.10 5.31 3.52 -0.74 -4.96 118.95 124.47 2k6y s ARG 42 Ca -0.01 1.01 0.04 0.00 -0.13 0.00 0.00 55.73 56.64 2k6y s ARG 42 Cb 0.00 -4.06 0.00 0.00 -1.56 0.00 0.00 34.95 29.33 2k6y s ARG 42 CO 0.01 -1.63 -0.22 0.54 -0.81 0.00 0.00 175.30 173.18 2k6y s VAL 43 N 5.72 1.93 -0.02 7.11 0.11 -1.26 -0.31 120.40 133.69 2k6y s VAL 43 Ca 0.64 -0.94 0.00 0.00 -2.93 0.00 0.00 61.98 58.76 2k6y s VAL 43 Cb -0.15 -1.69 0.02 0.00 -1.53 0.00 0.00 36.38 33.04 2k6y s VAL 43 CO 0.33 0.53 0.00 -1.61 -3.33 0.00 0.00 175.10 171.02 2k6y s GLU 44 N 0.46 0.21 -0.19 1.54 2.02 -0.72 -4.82 118.70 117.21 2k6y s GLU 44 Ca -0.16 0.06 -0.27 0.00 0.02 0.00 0.00 54.97 54.62 2k6y s GLU 44 Cb -0.17 -0.38 -0.00 0.00 0.10 0.00 0.00 34.13 33.68 2k6y s GLU 44 CO 0.07 -0.10 0.94 -1.17 0.02 0.00 0.00 175.26 175.01 2k6y s LEU 45 N 0.81 4.15 0.25 1.80 0.20 -1.26 -0.54 118.68 124.09 2k6y s LEU 45 Ca -0.08 1.30 0.09 0.00 0.69 0.00 0.00 54.13 56.13 2k6y s LEU 45 Cb -0.11 -3.40 -0.04 0.00 -0.43 0.00 0.00 46.19 42.21 2k6y s LEU 45 CO -0.02 -0.52 0.00 -1.00 -0.29 0.00 0.00 176.35 174.53 2k6y s HIS 46 N 2.59 2.73 0.40 5.38 3.76 0.20 -0.75 115.29 129.61 2k6y s HIS 46 Ca 0.42 -0.21 0.02 0.00 -0.15 0.00 0.00 55.06 55.14 2k6y s HIS 46 Cb -0.16 -1.22 0.02 0.00 1.11 0.00 0.00 32.58 32.33 2k6y s HIS 46 CO 0.10 0.60 0.17 -0.85 -0.85 0.00 0.00 174.74 173.92 2k6y n GLU 47 N -0.80 0.96 -3.71 1.40 0.28 0.10 -1.25 120.64 117.62 2k6y n GLU 47 Ca -0.07 -2.70 -0.24 0.00 -0.16 0.00 0.00 57.16 53.99 2k6y n GLU 47 Cb 0.58 0.49 -0.17 0.00 1.43 0.00 0.00 31.44 33.77 2k6y n GLU 47 CO 0.00 0.00 0.00 0.99 -0.16 0.00 0.00 177.13 177.96 2k6y s THR 48 N -2.21 0.21 0.35 3.84 2.01 0.78 -3.17 115.64 117.45 2k6y s THR 48 Ca 0.13 0.01 0.03 0.00 0.31 0.00 0.00 61.69 62.17 2k6y s THR 48 Cb -0.01 -0.55 -0.02 0.00 0.01 0.00 0.00 72.50 71.93 2k6y s THR 48 CO 0.08 0.05 0.52 0.72 -0.69 0.00 0.00 174.62 175.31 2k6y s PHE 49 N 2.02 3.32 -0.01 4.92 -0.12 -0.28 -4.58 117.98 123.26 2k6y s PHE 49 Ca 0.03 0.09 0.04 0.00 -0.05 0.00 0.00 56.93 57.04 2k6y s PHE 49 Cb -0.14 -1.96 -0.03 0.00 -0.63 0.00 0.00 43.02 40.26 2k6y s PHE 49 CO -0.06 0.03 -0.10 0.00 -0.05 0.00 0.00 175.22 175.04 2k6y s MET 50 N -4.27 2.48 0.12 1.99 0.23 -1.26 -1.78 119.30 116.81 2k6y s MET 50 Ca 0.42 -0.74 -0.16 0.00 -1.03 0.00 0.00 55.69 54.18 2k6y s MET 50 Cb -0.10 -2.44 0.04 0.00 -1.53 0.00 0.00 34.83 30.80 2k6y s MET 50 CO 0.34 0.60 0.41 1.03 -2.03 0.00 0.00 175.02 175.37 2k6y s ARG 51 N -1.23 1.06 0.27 3.16 0.52 -0.44 -5.01 118.95 117.28 2k6y s ARG 51 Ca 0.15 -0.68 -0.29 0.00 -0.52 0.00 0.00 55.73 54.39 2k6y s ARG 51 Cb -0.11 0.47 -0.09 0.00 0.52 0.00 0.00 34.95 35.74 2k6y s ARG 51 CO 0.05 -0.41 0.96 -1.21 0.02 0.00 0.00 175.30 174.70 2k6y s GLU 52 N -3.72 4.75 0.00 3.54 8.01 -1.26 -0.23 118.70 129.79 2k6y s GLU 52 Ca 0.02 1.47 0.00 0.00 0.01 0.00 0.00 54.97 56.47 2k6y s GLU 52 Cb 0.02 -3.12 0.00 0.00 -4.31 0.00 0.00 34.13 26.71 2k6y s GLU 52 CO -0.11 0.42 0.00 1.55 0.01 0.00 0.00 175.26 177.12 2k6y n VAL 53 N 1.17 0.00 -2.69 2.63 3.14 -1.04 -4.91 118.33 116.63 2k6y n VAL 53 Ca -0.01 0.00 -0.05 0.00 -2.96 0.00 0.00 64.34 61.32 2k6y n VAL 53 Cb 0.48 0.88 0.12 0.00 -1.06 0.00 0.00 33.84 34.25 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 0.00 1.28 0.00 1.45 2.13 -1.26 -4.95 120.64 119.28 2k6y n GLU 54 Ca 0.00 -1.73 0.00 0.00 0.66 0.00 0.00 57.16 56.09 2k6y n GLU 54 Cb 0.05 0.02 0.00 0.00 0.27 0.00 0.00 31.44 31.78 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 -0.92 1.36 3.94 8.31 0.00 -1.26 -4.93 105.19 111.68 2k6y n GLY 55 Ca -0.08 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.67 2k6y n GLY 55 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2k6y s LYS 56 N 0.00 3.45 0.31 1.61 -2.85 -1.26 -4.98 119.74 116.01 2k6y s LYS 56 Ca 0.00 -0.53 -0.29 0.00 -1.00 0.00 0.00 55.97 54.14 2k6y s LYS 56 Cb 0.00 -2.98 -0.11 0.00 -2.06 0.00 0.00 37.83 32.68 2k6y s LYS 56 CO 0.00 0.54 1.53 0.15 0.10 0.00 0.00 175.35 177.67 2k6y s LYS 57 N -3.03 4.15 0.02 1.78 3.01 -1.26 -2.49 119.74 121.93 2k6y s LYS 57 Ca 0.35 2.51 -0.00 0.00 -1.01 0.00 0.00 55.97 57.82 2k6y s LYS 57 Cb -0.12 -3.03 -0.02 0.00 -1.01 0.00 0.00 37.83 33.66 2k6y s LYS 57 CO 0.28 -0.55 -0.03 0.08 0.51 0.00 0.00 175.35 175.64 2k6y s VAL 58 N -0.33 0.12 0.01 3.17 1.01 0.68 -4.94 120.40 120.11 2k6y s VAL 58 Ca 0.59 -0.95 0.04 0.00 0.00 0.00 0.00 61.98 61.66 2k6y s VAL 58 Cb -0.46 -0.32 -0.03 0.00 0.00 0.00 0.00 36.38 35.57 2k6y s VAL 58 CO 0.51 -0.52 -0.08 -0.04 0.00 0.00 0.00 175.10 174.97 2k6y s MET 59 N -1.57 2.49 0.10 2.72 -1.94 -1.26 -1.33 119.30 118.51 2k6y s MET 59 Ca -0.15 -0.76 -0.19 0.00 -1.71 0.00 0.00 55.69 52.88 2k6y s MET 59 Cb -0.09 -2.46 0.05 0.00 2.01 0.00 0.00 34.83 34.33 2k6y s MET 59 CO -0.01 0.59 0.47 0.20 -0.01 0.00 0.00 175.02 176.26 2k6y s GLY 60 N -1.44 -0.38 0.37 -0.03 0.00 -0.74 -5.00 107.32 100.10 2k6y s GLY 60 Ca 0.17 0.26 0.05 0.00 0.00 0.00 0.00 44.72 45.20 2k6y s GLY 60 CO 0.07 -0.02 0.52 1.06 0.00 0.00 0.00 173.10 174.73 2k6y s MET 61 N -3.29 3.07 -0.14 2.90 -1.94 -1.26 -1.12 119.30 117.52 2k6y s MET 61 Ca -0.00 -0.93 -0.31 0.00 -1.71 0.00 0.00 55.69 52.73 2k6y s MET 61 Cb 0.00 -2.76 0.13 0.00 2.01 0.00 0.00 34.83 34.21 2k6y s MET 61 CO -0.08 -0.04 1.06 -0.98 -0.01 0.00 0.00 175.02 174.97 2k6y s ARG 62 N -4.27 0.52 0.60 2.03 1.70 -1.19 -4.96 118.95 113.38 2k6y s ARG 62 Ca 0.47 -0.06 -0.17 0.00 -0.47 0.00 0.00 55.73 55.50 2k6y s ARG 62 Cb -0.10 0.24 -0.03 0.00 -0.57 0.00 0.00 34.95 34.49 2k6y s ARG 62 CO 0.33 -0.20 1.12 -1.25 -1.08 0.00 0.00 175.30 174.22 2k6y s PRO 63 N -1.98 3.10 0.24 3.89 0.05 -1.26 -0.72 135.00 138.32 2k6y s PRO 63 Ca 0.04 1.51 0.10 0.00 0.05 0.00 0.00 61.00 62.70 2k6y s PRO 63 Cb -0.01 -1.98 -0.04 0.00 0.05 0.00 0.00 34.50 32.52 2k6y s PRO 63 CO -0.04 -1.03 -0.08 0.14 0.05 0.00 0.00 177.00 176.03 2k6y s VAL 64 N -2.03 3.12 0.18 -0.36 -7.23 0.07 -4.82 120.40 109.32 2k6y s VAL 64 Ca 0.70 -1.94 0.31 0.00 -1.81 0.00 0.00 61.98 59.25 2k6y s VAL 64 Cb -0.22 -2.62 0.35 0.00 0.56 0.00 0.00 36.38 34.45 2k6y s VAL 64 CO 0.34 -0.28 1.98 1.55 -0.31 0.00 0.00 175.10 178.37 2k6y h PRO 65 N 2.35 0.00 -1.21 4.82 0.13 -1.95 -3.43 132.00 132.71 2k6y h PRO 65 Ca -0.44 0.00 0.31 0.00 -0.87 0.00 0.00 66.00 65.00 2k6y h PRO 65 Cb 1.24 0.00 -0.19 0.00 0.13 0.00 0.00 31.00 32.17 2k6y h PRO 65 CO 0.58 0.07 0.92 -0.59 -0.23 0.00 0.00 178.00 178.74 2k6y s PHE 66 N -3.75 -0.05 0.49 1.56 -0.12 -1.26 -4.76 117.98 110.09 2k6y s PHE 66 Ca 0.00 0.03 0.07 0.00 -0.05 0.00 0.00 56.93 56.98 2k6y s PHE 66 Cb 0.10 0.51 0.02 0.00 -0.63 0.00 0.00 43.02 43.01 2k6y s PHE 66 CO 0.56 -0.09 0.41 -0.51 -0.05 0.00 0.00 175.22 175.54 2k6y s LEU 67 N -2.19 3.01 0.19 -1.99 1.43 0.42 -4.99 118.68 114.55 2k6y s LEU 67 Ca 0.11 -1.03 -0.14 0.00 -1.03 0.00 0.00 54.13 52.05 2k6y s LEU 67 Cb -0.00 -1.55 0.01 0.00 0.03 0.00 0.00 46.19 44.69 2k6y s LEU 67 CO -0.03 -0.93 0.43 -1.83 0.23 0.00 0.00 176.35 174.22 2k6y s GLU 68 N -4.24 1.30 -0.10 1.70 -1.05 -1.26 -0.22 118.70 114.83 2k6y s GLU 68 Ca 0.42 -0.99 -0.05 0.00 -0.15 0.00 0.00 54.97 54.20 2k6y s GLU 68 Cb -0.02 0.47 0.04 0.00 -0.44 0.00 0.00 34.13 34.18 2k6y s GLU 68 CO 0.25 -0.53 0.23 0.08 0.95 0.00 0.00 175.26 176.24 2k6y s VAL 69 N -3.91 -0.04 0.87 1.83 1.01 0.47 -4.93 120.40 115.69 2k6y s VAL 69 Ca 0.12 0.15 -0.11 0.00 0.00 0.00 0.00 61.98 62.14 2k6y s VAL 69 Cb 0.01 -0.36 0.11 0.00 0.00 0.00 0.00 36.38 36.14 2k6y s VAL 69 CO -0.01 0.06 1.09 -2.16 0.00 0.00 0.00 175.10 174.08 2k6y s PRO 70 N 1.23 1.50 0.32 2.72 0.04 -1.26 -1.01 135.00 138.54 2k6y s PRO 70 Ca -0.09 0.78 -0.29 0.00 0.04 0.00 0.00 61.00 61.44 2k6y s PRO 70 Cb -0.10 -1.84 -0.12 0.00 0.04 0.00 0.00 34.50 32.48 2k6y s PRO 70 CO -0.08 -2.06 1.54 -0.35 0.04 0.00 0.00 177.00 176.09 2k6y n PRO 71 N -3.75 2.65 -1.06 0.56 -0.04 -1.26 -2.20 135.00 129.90 2k6y n PRO 71 Ca 0.07 0.94 -0.02 0.00 -0.04 0.00 0.00 63.50 64.45 2k6y n PRO 71 Cb 0.55 -2.69 -0.01 0.00 -0.04 0.00 0.00 33.50 31.31 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 1.49 -1.55 -2.85 0.54 4.76 -0.18 -4.96 118.16 115.41 2k6y n LYS 72 Ca 0.06 0.48 -0.42 0.00 -2.87 0.00 0.00 58.31 55.56 2k6y n LYS 72 Cb 0.37 -4.68 -0.04 0.00 -1.84 0.00 0.00 35.03 28.85 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 -2.09 1.75 0.20 0.72 0.00 -0.93 -4.89 107.32 102.07 2k6y s GLY 73 Ca 0.00 -0.08 -0.21 0.00 0.00 0.00 0.00 44.72 44.43 2k6y s GLY 73 CO 0.00 1.87 0.73 0.50 0.00 0.00 0.00 173.10 176.21 2k6y s ARG 74 N 2.89 4.34 0.03 2.90 0.52 -1.26 -1.62 118.95 126.75 2k6y s ARG 74 Ca 0.37 0.95 0.02 0.00 -0.52 0.00 0.00 55.73 56.54 2k6y s ARG 74 Cb -0.15 -3.01 -0.02 0.00 0.52 0.00 0.00 34.95 32.29 2k6y s ARG 74 CO 0.07 0.46 -0.06 0.14 0.02 0.00 0.00 175.30 175.93 2k6y s VAL 75 N -1.39 0.41 -0.17 3.52 -7.23 0.48 -4.99 120.40 111.04 2k6y s VAL 75 Ca 0.40 -0.89 -0.01 0.00 -1.81 0.00 0.00 61.98 59.67 2k6y s VAL 75 Cb -0.19 -0.48 0.04 0.00 0.56 0.00 0.00 36.38 36.32 2k6y s VAL 75 CO 0.22 -0.33 -0.04 -1.61 -0.31 0.00 0.00 175.10 173.04 2k6y s GLU 76 N -1.31 1.30 -1.18 4.82 2.02 -1.26 -0.87 118.70 122.23 2k6y s GLU 76 Ca -0.09 -0.50 -0.16 0.00 0.02 0.00 0.00 54.97 54.24 2k6y s GLU 76 Cb -0.09 -2.00 -0.05 0.00 0.10 0.00 0.00 34.13 32.09 2k6y s GLU 76 CO 0.00 -0.46 2.19 1.28 0.02 0.00 0.00 175.26 178.29 2k6y n LEU 77 N 4.90 5.89 -4.64 1.80 4.32 0.29 -4.89 117.00 124.67 2k6y n LEU 77 Ca -0.11 -3.60 -0.46 0.00 -0.02 0.00 0.00 56.01 51.82 2k6y n LEU 77 Cb 0.48 -1.40 -0.03 0.00 -1.62 0.00 0.00 43.42 40.84 2k6y n LEU 77 CO 0.16 0.64 0.94 2.29 -1.22 0.00 0.00 177.39 180.19 2k6y n LYS 78 N 5.97 1.74 0.05 3.23 2.85 -1.18 -4.07 118.16 126.75 2k6y n LYS 78 Ca 0.53 0.62 -0.11 0.00 -1.05 0.00 0.00 58.31 58.30 2k6y n LYS 78 Cb 0.35 -2.24 -0.04 0.00 -0.65 0.00 0.00 35.03 32.45 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 4.15 -0.27 -5.99 -1.58 0.13 -1.93 -0.28 132.00 126.24 2k6y h PRO 79 Ca -0.45 0.02 -0.53 0.00 -0.87 0.00 0.00 66.00 64.18 2k6y h PRO 79 Cb 1.30 0.06 -0.09 0.00 0.13 0.00 0.00 31.00 32.40 2k6y h PRO 79 CO 0.75 -0.18 1.35 0.20 -0.23 0.00 0.00 178.00 179.90 2k6y s GLY 80 N -2.50 1.00 0.00 1.56 0.00 -1.26 -4.05 107.32 102.07 2k6y s GLY 80 Ca -0.15 -2.12 0.00 0.00 0.00 0.00 0.00 44.72 42.45 2k6y s GLY 80 CO 0.67 2.90 0.00 0.61 0.00 0.00 0.00 173.10 177.28 2k6y n GLY 81 N 6.76 0.89 3.44 0.20 0.00 -1.18 -4.97 105.19 110.32 2k6y n GLY 81 Ca 0.36 -0.09 -0.10 0.00 0.00 0.00 0.00 46.02 46.19 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 -0.77 0.22 1.61 2.02 -0.12 -0.16 117.35 120.14 2k6y s TYR 82 Ca 0.00 1.64 -0.19 0.00 -0.37 0.00 0.00 57.07 58.15 2k6y s TYR 82 Cb 0.00 0.39 0.03 0.00 -0.40 0.00 0.00 41.96 41.98 2k6y s TYR 82 CO 0.00 -0.40 0.58 -3.38 -1.57 0.00 0.00 175.55 170.78 2k6y s HIS 83 N 1.24 -0.14 -0.36 2.71 -3.43 -0.38 -3.07 115.29 111.85 2k6y s HIS 83 Ca -0.08 -0.22 -0.14 0.00 -0.80 0.00 0.00 55.06 53.83 2k6y s HIS 83 Cb -0.06 0.47 -0.00 0.00 -1.43 0.00 0.00 32.58 31.55 2k6y s HIS 83 CO -0.12 -1.00 0.29 -0.06 -2.00 0.00 0.00 174.74 171.85 2k6y s PHE 84 N -3.88 3.22 -0.15 0.38 0.08 -0.78 -0.62 117.98 116.22 2k6y s PHE 84 Ca 0.10 -0.28 -0.24 0.00 0.12 0.00 0.00 56.93 56.63 2k6y s PHE 84 Cb -0.02 -2.57 -0.02 0.00 -0.57 0.00 0.00 43.02 39.84 2k6y s PHE 84 CO -0.00 -0.45 0.74 1.41 -0.10 0.00 0.00 175.22 176.82 2k6y s MET 85 N 1.79 4.31 -0.08 0.44 1.75 0.30 -1.32 119.30 126.49 2k6y s MET 85 Ca 0.07 0.87 0.02 0.00 -1.25 0.00 0.00 55.69 55.40 2k6y s MET 85 Cb -0.18 -3.54 -0.02 0.00 2.84 0.00 0.00 34.83 33.93 2k6y s MET 85 CO 0.11 -0.21 -0.13 -0.51 -0.65 0.00 0.00 175.02 173.63 2k6y s LEU 86 N 1.75 2.78 0.04 4.11 1.43 0.00 -1.76 118.68 127.03 2k6y s LEU 86 Ca 0.35 -0.23 -0.09 0.00 -1.03 0.00 0.00 54.13 53.13 2k6y s LEU 86 Cb -0.17 -1.59 0.00 0.00 0.03 0.00 0.00 46.19 44.46 2k6y s LEU 86 CO 0.13 0.27 0.19 -0.76 0.23 0.00 0.00 176.35 176.42 2k6y s LEU 87 N -0.30 1.37 0.00 1.79 1.43 0.58 -1.05 118.68 122.50 2k6y s LEU 87 Ca 0.03 -0.36 0.00 0.00 -1.03 0.00 0.00 54.13 52.76 2k6y s LEU 87 Cb -0.13 0.95 0.00 0.00 0.03 0.00 0.00 46.19 47.04 2k6y s LEU 87 CO 0.03 -0.55 0.00 0.61 0.23 0.00 0.00 176.35 176.66 2k6y n GLY 88 N 0.71 1.47 1.77 -3.19 0.00 -1.02 -1.79 105.19 103.14 2k6y n GLY 88 Ca -0.19 -0.01 -0.01 0.00 0.00 0.00 0.00 46.02 45.81 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 0.00 -4.29 -0.30 0.99 4.77 -1.26 -4.86 117.00 112.04 2k6y n LEU 89 Ca 0.00 1.38 0.01 0.00 -0.03 0.00 0.00 56.01 57.37 2k6y n LEU 89 Cb 0.00 -2.15 0.02 0.00 -2.33 0.00 0.00 43.42 38.97 2k6y n LEU 89 CO 0.00 -1.63 0.42 2.29 -1.33 0.00 0.00 177.39 177.14 2k6y n LYS 90 N 0.91 1.16 -3.50 3.23 2.85 -1.26 -4.72 118.16 116.84 2k6y n LYS 90 Ca -0.05 -0.17 -0.15 0.00 -1.05 0.00 0.00 58.31 56.89 2k6y n LYS 90 Cb 0.08 -1.26 -0.04 0.00 -0.65 0.00 0.00 35.03 33.16 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 -1.58 1.03 0.28 -1.58 1.70 -1.23 -4.95 118.95 112.63 2k6y s ARG 91 Ca 0.03 0.00 -0.29 0.00 -0.47 0.00 0.00 55.73 55.00 2k6y s ARG 91 Cb 0.02 0.48 -0.09 0.00 -0.57 0.00 0.00 34.95 34.79 2k6y s ARG 91 CO 0.02 -0.37 1.06 -1.25 -1.08 0.00 0.00 175.30 173.67 2k6y s PRO 92 N -2.02 4.64 0.16 3.89 0.04 -1.26 -4.94 135.00 135.50 2k6y s PRO 92 Ca -0.05 1.70 0.09 0.00 0.04 0.00 0.00 61.00 62.78 2k6y s PRO 92 Cb -0.00 -3.14 -0.04 0.00 0.04 0.00 0.00 34.50 31.35 2k6y s PRO 92 CO 0.01 0.25 -0.14 -0.51 0.04 0.00 0.00 177.00 176.65 2k6y s LEU 93 N -1.51 2.83 0.00 -3.56 1.43 -1.26 -5.06 118.68 111.55 2k6y s LEU 93 Ca 0.45 -0.59 0.00 0.00 -1.03 0.00 0.00 54.13 52.96 2k6y s LEU 93 Cb -0.30 -1.57 0.00 0.00 0.03 0.00 0.00 46.19 44.35 2k6y s LEU 93 CO 0.38 0.13 0.29 2.29 0.23 0.00 0.00 176.35 179.68 2k6y n LYS 94 N 0.35 0.00 -1.18 1.70 -0.00 -1.26 -4.92 118.16 112.86 2k6y n LYS 94 Ca -0.13 -0.29 0.15 0.00 -0.00 0.00 0.00 58.31 58.04 2k6y n LYS 94 Cb 0.54 -0.31 -0.05 0.00 -0.00 0.00 0.00 35.03 35.22 2k6y n LYS 94 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2k6y n ALA 95 N 0.00 -3.07 -3.40 0.58 0.00 -1.26 -4.98 120.51 108.38 2k6y n ALA 95 Ca 0.00 0.52 -0.17 0.00 0.00 0.00 0.00 53.44 53.79 2k6y n ALA 95 Cb 0.49 -1.14 0.08 0.00 0.00 0.00 0.00 19.45 18.88 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 -3.89 -0.56 3.41 0.00 0.00 -1.26 -5.02 105.19 97.87 2k6y n GLY 96 Ca -0.02 0.22 -0.10 0.00 0.00 0.00 0.00 46.02 46.12 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 -5.17 1.22 -0.25 1.61 -1.05 -1.26 -5.07 118.70 108.74 2k6y s GLU 97 Ca 0.11 -0.95 -0.10 0.00 -0.15 0.00 0.00 54.97 53.88 2k6y s GLU 97 Cb -0.02 0.45 -0.05 0.00 -0.44 0.00 0.00 34.13 34.08 2k6y s GLU 97 CO 0.74 -0.48 0.14 -1.21 0.95 0.00 0.00 175.26 175.40 2k6y s GLU 98 N -3.89 3.95 -0.56 -4.83 8.01 -1.26 -0.94 118.70 119.17 2k6y s GLU 98 Ca 0.11 -0.33 -0.26 0.00 0.01 0.00 0.00 54.97 54.50 2k6y s GLU 98 Cb 0.01 -3.50 0.04 0.00 -4.31 0.00 0.00 34.13 26.37 2k6y s GLU 98 CO -0.04 -0.04 1.04 0.08 0.01 0.00 0.00 175.26 176.32 2k6y s VAL 99 N 1.30 4.24 0.34 2.63 1.01 0.13 -4.90 120.40 125.15 2k6y s VAL 99 Ca 0.07 0.56 -0.27 0.00 0.00 0.00 0.00 61.98 62.34 2k6y s VAL 99 Cb -0.14 -4.61 -0.09 0.00 0.00 0.00 0.00 36.38 31.53 2k6y s VAL 99 CO 0.06 -1.20 1.06 -0.70 0.00 0.00 0.00 175.10 174.32 2k6y s GLU 100 N 4.36 4.41 -0.25 2.72 -6.30 -1.26 -1.28 118.70 121.09 2k6y s GLU 100 Ca 0.36 1.62 -0.06 0.00 -2.50 0.00 0.00 54.97 54.39 2k6y s GLU 100 Cb -0.10 -2.85 0.13 0.00 0.00 0.00 0.00 34.13 31.30 2k6y s GLU 100 CO 0.22 0.06 0.50 -0.51 0.02 0.00 0.00 175.26 175.55 2k6y s LEU 101 N -2.06 -0.90 -0.66 2.70 1.43 -0.32 -3.96 118.68 114.91 2k6y s LEU 101 Ca 0.51 0.98 -0.23 0.00 -1.03 0.00 0.00 54.13 54.36 2k6y s LEU 101 Cb -0.26 1.69 0.06 0.00 0.03 0.00 0.00 46.19 47.71 2k6y s LEU 101 CO 0.33 -0.25 1.00 -1.81 0.23 0.00 0.00 176.35 175.86 2k6y s ASP 102 N 2.72 6.19 -0.24 2.29 1.01 0.02 -0.43 116.67 128.23 2k6y s ASP 102 Ca 0.04 -0.86 -0.29 0.00 0.71 0.00 0.00 52.55 52.16 2k6y s ASP 102 Cb -0.13 -2.44 0.01 0.00 1.01 0.00 0.00 42.92 41.37 2k6y s ASP 102 CO -0.16 -1.47 1.02 -0.76 0.21 0.00 0.00 175.17 174.00 2k6y s LEU 103 N 4.27 4.08 -0.14 1.23 1.43 -0.35 -1.41 118.68 127.80 2k6y s LEU 103 Ca 0.25 1.31 -0.16 0.00 -1.03 0.00 0.00 54.13 54.49 2k6y s LEU 103 Cb -0.15 -3.50 -0.04 0.00 0.03 0.00 0.00 46.19 42.52 2k6y s LEU 103 CO 0.12 -0.67 0.40 -0.76 0.23 0.00 0.00 176.35 175.66 2k6y s LEU 104 N 3.21 4.26 -0.10 1.79 1.43 -0.13 -1.62 118.68 127.52 2k6y s LEU 104 Ca 0.43 0.69 0.00 0.00 -1.03 0.00 0.00 54.13 54.22 2k6y s LEU 104 Cb -0.15 -2.56 0.02 0.00 0.03 0.00 0.00 46.19 43.53 2k6y s LEU 104 CO 0.07 0.04 -0.07 -0.36 0.23 0.00 0.00 176.35 176.25 2k6y s PHE 105 N 0.58 1.34 -0.33 0.29 0.08 -0.21 -0.32 117.98 119.40 2k6y s PHE 105 Ca 0.22 -0.60 0.00 0.00 0.12 0.00 0.00 56.93 56.67 2k6y s PHE 105 Cb -0.14 -1.12 0.00 0.00 -0.57 0.00 0.00 43.02 41.19 2k6y s PHE 105 CO 0.08 -0.43 0.00 0.00 -0.10 0.00 0.00 175.22 174.77 2k6y n ALA 106 N 4.70 -0.05 0.00 5.36 0.00 -0.34 -1.31 120.51 128.88 2k6y n ALA 106 Ca -0.15 0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.34 2k6y n ALA 106 Cb 0.50 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 18.94 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 0.39 0.94 0.00 0.00 0.00 -1.26 -4.72 105.19 100.55 2k6y n GLY 107 Ca -0.03 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.06 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 -0.79 3.29 -0.02 0.00 -1.13 -4.78 105.19 101.76 2k6y n GLY 108 Ca 0.00 -0.08 -0.13 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.00 0.82 -0.09 1.61 3.01 -0.42 -5.07 119.74 117.60 2k6y s LYS 109 Ca 0.20 -0.30 -0.09 0.00 -1.01 0.00 0.00 55.97 54.78 2k6y s LYS 109 Cb 0.09 0.36 0.02 0.00 -1.01 0.00 0.00 37.83 37.30 2k6y s LYS 109 CO 0.16 -0.26 0.25 0.54 0.51 0.00 0.00 175.35 176.54 2k6y s VAL 110 N -2.02 0.00 -0.04 3.17 0.11 -1.26 -1.05 120.40 119.32 2k6y s VAL 110 Ca -0.08 -0.04 -0.01 0.00 -2.93 0.00 0.00 61.98 58.92 2k6y s VAL 110 Cb -0.02 -0.36 0.03 0.00 -1.53 0.00 0.00 36.38 34.50 2k6y s VAL 110 CO 0.01 -0.02 0.04 -0.76 -3.33 0.00 0.00 175.10 171.03 2k6y s LEU 111 N 0.03 0.59 0.18 2.54 1.43 -0.64 -4.98 118.68 117.83 2k6y s LEU 111 Ca -0.01 0.03 -0.05 0.00 -1.03 0.00 0.00 54.13 53.07 2k6y s LEU 111 Cb -0.02 -0.18 -0.06 0.00 0.03 0.00 0.00 46.19 45.97 2k6y s LEU 111 CO 0.01 -0.19 0.42 -1.59 0.23 0.00 0.00 176.35 175.23 2k6y s LYS 112 N 1.69 3.65 0.02 1.70 -2.85 -1.26 -1.22 119.74 121.47 2k6y s LYS 112 Ca -0.01 -0.03 0.02 0.00 -1.00 0.00 0.00 55.97 54.96 2k6y s LYS 112 Cb -0.13 -2.79 -0.02 0.00 -2.06 0.00 0.00 37.83 32.84 2k6y s LYS 112 CO -0.03 0.41 -0.08 0.14 0.10 0.00 0.00 175.35 175.89 2k6y s VAL 113 N -1.74 0.59 -0.17 1.79 -7.23 0.43 -4.95 120.40 109.12 2k6y s VAL 113 Ca 0.42 -0.72 -0.05 0.00 -1.81 0.00 0.00 61.98 59.82 2k6y s VAL 113 Cb -0.12 -0.58 -0.03 0.00 0.56 0.00 0.00 36.38 36.21 2k6y s VAL 113 CO 0.25 -0.11 0.00 0.54 -0.31 0.00 0.00 175.10 175.47 2k6y s VAL 114 N -0.78 4.26 0.02 1.32 0.11 -1.26 -1.18 120.40 122.89 2k6y s VAL 114 Ca -0.03 -0.22 -0.01 0.00 -2.93 0.00 0.00 61.98 58.78 2k6y s VAL 114 Cb -0.06 -2.89 -0.02 0.00 -1.53 0.00 0.00 36.38 31.87 2k6y s VAL 114 CO 0.00 0.48 -0.01 -0.76 -3.33 0.00 0.00 175.10 171.49 2k6y s LEU 115 N 0.38 2.15 0.42 2.54 1.43 -0.41 -4.99 118.68 120.21 2k6y s LEU 115 Ca -0.01 -0.49 -0.23 0.00 -1.03 0.00 0.00 54.13 52.37 2k6y s LEU 115 Cb -0.13 0.19 -0.09 0.00 0.03 0.00 0.00 46.19 46.19 2k6y s LEU 115 CO 0.02 -0.33 1.07 -2.16 0.23 0.00 0.00 176.35 175.18 2k6y s PRO 116 N -1.58 4.04 0.28 1.29 0.04 -1.26 0.19 135.00 138.00 2k6y s PRO 116 Ca -0.15 1.55 -0.29 0.00 0.04 0.00 0.00 61.00 62.15 2k6y s PRO 116 Cb -0.09 -2.47 -0.10 0.00 0.04 0.00 0.00 34.50 31.89 2k6y s PRO 116 CO -0.01 -0.26 1.16 0.08 0.04 0.00 0.00 177.00 178.01 2k6y s VAL 117 N -1.67 3.30 0.15 -0.36 1.01 -0.12 -1.22 120.40 121.48 2k6y s VAL 117 Ca 0.60 1.28 0.11 0.00 0.00 0.00 0.00 61.98 63.97 2k6y s VAL 117 Cb -0.23 -3.82 -0.04 0.00 0.00 0.00 0.00 36.38 32.29 2k6y s VAL 117 CO 0.28 0.30 -0.25 -0.70 0.00 0.00 0.00 175.10 174.72 2k6y s GLU 118 N -1.39 1.41 -0.45 2.72 2.56 0.38 -4.57 118.70 119.35 2k6y s GLU 118 Ca 0.47 -1.39 0.06 0.00 0.00 0.00 0.00 54.97 54.11 2k6y s GLU 118 Cb -0.34 -1.83 0.22 0.00 2.00 0.00 0.00 34.13 34.19 2k6y s GLU 118 CO 0.43 0.42 0.51 0.00 -0.56 0.00 0.00 175.26 176.06 2k6y n ALA 119 N 0.72 2.85 -1.67 6.30 0.00 -1.26 -0.71 120.51 126.75 2k6y n ALA 119 Ca -0.16 -3.60 0.00 0.00 0.00 0.00 0.00 53.44 49.67 2k6y n ALA 119 Cb 0.54 -0.82 0.00 0.00 0.00 0.00 0.00 19.45 19.17 2k6y n ALA 119 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04