#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ntk s TYR 2 N 0.00 3.09 -1.72 2.03 5.04 -1.26 -1.56 117.35 122.97 2ntk s TYR 2 Ca 0.00 0.03 0.22 0.00 -2.44 0.00 0.00 57.07 54.87 2ntk s TYR 2 Cb 0.00 -3.26 -0.08 0.00 0.35 0.00 0.00 41.96 38.97 2ntk s TYR 2 CO 0.00 -0.80 1.02 1.28 -1.34 0.00 0.00 175.55 175.72 2ntk n LEU 3 N 6.16 1.72 0.00 6.97 4.32 -1.26 -4.64 117.00 130.27 2ntk n LEU 3 Ca -0.02 -0.68 0.00 0.00 -0.02 0.00 0.00 56.01 55.29 2ntk n LEU 3 Cb 0.48 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.28 2ntk n LEU 3 CO 0.52 0.34 0.00 0.61 -1.22 0.00 0.00 177.39 177.64 2ntk n GLY 4 N 1.44 1.27 3.76 -0.72 0.00 -1.26 -1.49 105.19 108.18 2ntk n GLY 4 Ca 0.08 -0.60 -0.40 0.00 0.00 0.00 0.00 46.02 45.10 2ntk n GLY 4 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2ntk s ARG 5 N 0.00 4.54 0.03 1.61 3.00 -1.26 -3.12 118.95 123.74 2ntk s ARG 5 Ca 0.00 1.13 0.06 0.00 0.00 0.00 0.00 55.73 56.91 2ntk s ARG 5 Cb 0.00 -3.32 -0.02 0.00 0.00 0.00 0.00 34.95 31.61 2ntk s ARG 5 CO 0.00 0.41 -0.17 0.42 0.00 0.00 0.00 175.30 175.96 2ntk s ILE 6 N -0.55 1.35 0.03 1.52 1.01 -0.52 -1.60 121.20 122.45 2ntk s ILE 6 Ca 0.38 -0.98 0.02 0.00 0.00 0.00 0.00 60.65 60.06 2ntk s ILE 6 Cb -0.22 -1.18 -0.02 0.00 0.01 0.00 0.00 42.46 41.05 2ntk s ILE 6 CO 0.25 0.17 -0.07 -1.48 0.00 0.00 0.00 174.94 173.81 2ntk s LEU 7 N -0.94 2.23 0.06 2.97 0.05 -0.56 -0.76 118.68 121.73 2ntk s LEU 7 Ca 0.05 -0.49 0.04 0.00 0.05 0.00 0.00 54.13 53.78 2ntk s LEU 7 Cb -0.08 -0.13 -0.03 0.00 -2.05 0.00 0.00 46.19 43.90 2ntk s LEU 7 CO 0.01 -0.19 -0.11 0.00 -0.55 0.00 0.00 176.35 175.51 2ntk s ALA 8 N -1.25 0.95 -0.06 1.48 0.00 -0.08 -1.35 121.76 121.45 2ntk s ALA 8 Ca -0.10 -0.93 -0.19 0.00 0.00 0.00 0.00 51.96 50.74 2ntk s ALA 8 Cb -0.09 -0.03 0.04 0.00 0.00 0.00 0.00 23.12 23.04 2ntk s ALA 8 CO 0.00 0.08 0.44 0.54 0.00 0.00 0.00 175.76 176.82 2ntk s VAL 9 N -1.43 0.03 -5.00 0.00 0.11 -0.30 -0.50 120.40 113.31 2ntk s VAL 9 Ca -0.04 -0.25 0.00 0.00 -2.93 0.00 0.00 61.98 58.76 2ntk s VAL 9 Cb -0.09 -0.72 0.00 0.00 -1.53 0.00 0.00 36.38 34.04 2ntk s VAL 9 CO 0.01 -0.14 0.00 0.61 -3.33 0.00 0.00 175.10 172.26 2ntk n GLY 10 N 1.54 -0.08 3.04 6.54 0.00 -0.85 -1.49 105.19 113.88 2ntk n GLY 10 Ca -0.19 -1.42 -0.12 0.00 0.00 0.00 0.00 46.02 44.29 2ntk n GLY 10 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2ntk s ARG 11 N -2.00 0.46 0.22 1.61 0.52 -1.26 -0.97 118.95 117.53 2ntk s ARG 11 Ca 0.00 -0.70 0.04 0.00 -0.52 0.00 0.00 55.73 54.54 2ntk s ARG 11 Cb 0.00 -0.17 -0.01 0.00 0.52 0.00 0.00 34.95 35.28 2ntk s ARG 11 CO 0.00 0.02 0.13 0.27 0.02 0.00 0.00 175.30 175.74 2ntk n ASN 12 N 1.53 0.31 0.33 0.23 0.23 -0.01 -4.43 115.26 113.44 2ntk n ASN 12 Ca -0.23 -2.28 0.21 0.00 -0.53 0.00 0.00 54.58 51.74 2ntk n ASN 12 Cb 0.55 0.81 1.13 0.00 -2.08 0.00 0.00 39.78 40.19 2ntk n ASN 12 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 2ntk h SER 13 N 1.09 0.00 0.85 0.53 4.64 -1.94 -2.38 113.55 116.33 2ntk h SER 13 Ca -0.16 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.13 2ntk h SER 13 Cb 0.71 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.80 2ntk h SER 13 CO 0.25 0.00 -1.17 0.59 -0.87 0.00 0.00 176.83 175.63 2ntk n ASN 14 N -3.22 0.77 0.00 4.97 3.02 -1.26 -5.07 115.26 114.46 2ntk n ASN 14 Ca -0.03 0.30 0.00 0.00 -0.03 0.00 0.00 54.58 54.83 2ntk n ASN 14 Cb 0.10 0.55 0.00 0.00 -0.61 0.00 0.00 39.78 39.82 2ntk n ASN 14 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2ntk n GLY 15 N 1.22 -0.36 3.73 7.41 0.00 -0.90 -4.48 105.19 111.81 2ntk n GLY 15 Ca -0.02 -1.38 -0.25 0.00 0.00 0.00 0.00 46.02 44.37 2ntk n GLY 15 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2ntk s SER 16 N -4.00 5.11 0.20 1.61 1.04 -0.59 -0.83 113.70 116.24 2ntk s SER 16 Ca 0.00 -0.33 -0.24 0.00 0.48 0.00 0.00 55.95 55.86 2ntk s SER 16 Cb 0.00 -1.19 0.05 0.00 0.10 0.00 0.00 66.02 64.98 2ntk s SER 16 CO 0.00 0.04 0.87 0.72 0.98 0.00 0.00 173.24 175.85 2ntk s PHE 17 N -1.93 -0.16 0.00 5.02 -0.12 -0.14 -0.72 117.98 119.93 2ntk s PHE 17 Ca 0.30 -0.20 0.00 0.00 -0.05 0.00 0.00 56.93 56.99 2ntk s PHE 17 Cb -0.09 0.66 -0.00 0.00 -0.63 0.00 0.00 43.02 42.96 2ntk s PHE 17 CO 0.22 -0.97 -0.02 0.14 -0.05 0.00 0.00 175.22 174.54 2ntk s VAL 18 N -3.52 0.11 0.03 -2.49 -7.23 -0.87 -2.01 120.40 104.42 2ntk s VAL 18 Ca 0.12 -0.17 0.02 0.00 -1.81 0.00 0.00 61.98 60.14 2ntk s VAL 18 Cb -0.03 -0.12 -0.02 0.00 0.56 0.00 0.00 36.38 36.77 2ntk s VAL 18 CO 0.04 -0.04 -0.07 0.00 -0.31 0.00 0.00 175.10 174.71 2ntk s ALA 19 N -0.22 0.54 0.00 1.32 0.00 0.34 -1.35 121.76 122.39 2ntk s ALA 19 Ca -0.02 -0.66 0.01 0.00 0.00 0.00 0.00 51.96 51.29 2ntk s ALA 19 Cb -0.02 0.02 -0.00 0.00 0.00 0.00 0.00 23.12 23.12 2ntk s ALA 19 CO -0.00 0.00 -0.02 -0.47 0.00 0.00 0.00 175.76 175.27 2ntk s TYR 20 N -1.14 0.21 -0.02 0.00 5.04 0.71 -0.90 117.35 121.26 2ntk s TYR 20 Ca -0.08 -0.09 0.00 0.00 -2.44 0.00 0.00 57.07 54.46 2ntk s TYR 20 Cb -0.08 -0.14 0.03 0.00 0.35 0.00 0.00 41.96 42.11 2ntk s TYR 20 CO 0.00 -0.02 0.03 0.50 -1.34 0.00 0.00 175.55 174.72 2ntk s ARG 21 N -0.22 -0.02 -0.21 4.97 3.52 0.06 -0.73 118.95 126.32 2ntk s ARG 21 Ca -0.01 0.17 -0.16 0.00 -0.13 0.00 0.00 55.73 55.61 2ntk s ARG 21 Cb -0.02 -0.24 -0.04 0.00 -1.56 0.00 0.00 34.95 33.09 2ntk s ARG 21 CO -0.00 -0.16 0.39 0.08 -0.81 0.00 0.00 175.30 174.80 2ntk s VAL 22 N 1.00 5.20 -0.04 7.11 1.01 0.11 -1.44 120.40 133.35 2ntk s VAL 22 Ca -0.08 0.67 0.06 0.00 0.00 0.00 0.00 61.98 62.63 2ntk s VAL 22 Cb -0.12 -3.72 -0.02 0.00 0.00 0.00 0.00 36.38 32.53 2ntk s VAL 22 CO -0.03 0.24 -0.24 -0.44 0.00 0.00 0.00 175.10 174.63 2ntk s SER 23 N 1.11 3.15 -0.17 3.32 0.01 -1.18 -0.68 113.70 119.26 2ntk s SER 23 Ca 0.18 -0.47 -0.25 0.00 1.31 0.00 0.00 55.95 56.72 2ntk s SER 23 Cb -0.15 -0.68 0.06 0.00 0.21 0.00 0.00 66.02 65.47 2ntk s SER 23 CO 0.08 0.28 0.63 -0.55 0.41 0.00 0.00 173.24 174.09 2ntk s SER 24 N -0.35 -0.63 -0.23 2.44 0.15 -0.63 -4.22 113.70 110.22 2ntk s SER 24 Ca 0.02 1.03 -0.11 0.00 0.70 0.00 0.00 55.95 57.59 2ntk s SER 24 Cb -0.12 1.00 -0.10 0.00 -1.71 0.00 0.00 66.02 65.09 2ntk s SER 24 CO 0.02 -0.36 -0.29 0.54 1.20 0.00 0.00 173.24 174.34 2ntk n ARG 25 N 2.06 0.49 0.06 5.44 1.74 -1.26 -4.50 116.66 120.68 2ntk n ARG 25 Ca -0.16 0.21 0.12 0.00 -0.77 0.00 0.00 57.85 57.25 2ntk n ARG 25 Cb 0.56 -1.32 0.23 0.00 -1.02 0.00 0.00 32.46 30.91 2ntk n ARG 25 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 2ntk n SER 26 N -4.00 0.67 -3.18 0.55 3.41 -1.26 -4.41 113.62 105.39 2ntk n SER 26 Ca -0.45 0.16 -0.21 0.00 -0.26 0.00 0.00 58.87 58.11 2ntk n SER 26 Cb 0.82 0.01 -0.05 0.00 -0.26 0.00 0.00 64.21 64.74 2ntk n SER 26 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 2ntk n PHE 27 N -2.05 0.44 0.94 7.33 3.01 -1.26 -4.93 117.46 120.94 2ntk n PHE 27 Ca 0.04 -3.76 0.14 0.00 1.01 0.00 0.00 57.45 54.88 2ntk n PHE 27 Cb 0.42 -0.41 0.56 0.00 -0.01 0.00 0.00 39.48 40.04 2ntk n PHE 27 CO 0.00 0.00 0.00 -0.35 1.01 0.00 0.00 176.76 177.42 2ntk n PRO 28 N 0.67 0.04 -1.63 -1.08 -0.04 -1.26 -4.38 135.00 127.32 2ntk n PRO 28 Ca 0.24 0.03 -0.35 0.00 -0.04 0.00 0.00 63.50 63.39 2ntk n PRO 28 Cb 0.58 -1.55 -0.04 0.00 -0.04 0.00 0.00 33.50 32.46 2ntk n PRO 28 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2ntk n ASN 29 N -1.63 7.73 -4.17 3.54 5.03 -1.26 -4.89 115.26 119.62 2ntk n ASN 29 Ca 0.07 -2.94 -0.11 0.00 0.87 0.00 0.00 54.58 52.47 2ntk n ASN 29 Cb 0.36 -1.40 -0.10 0.00 -1.02 0.00 0.00 39.78 37.61 2ntk n ASN 29 CO 0.00 0.00 0.00 -0.13 -1.83 0.00 0.00 177.26 175.30 2ntk s ARG 30 N -0.15 0.83 0.27 3.52 0.52 -1.26 -1.80 118.95 120.87 2ntk s ARG 30 Ca 0.60 -1.27 0.01 0.00 -0.52 0.00 0.00 55.73 54.55 2ntk s ARG 30 Cb 0.23 -0.28 -0.03 0.00 0.52 0.00 0.00 34.95 35.39 2ntk s ARG 30 CO -0.10 0.01 0.26 -0.08 0.02 0.00 0.00 175.30 175.41 2ntk s THR 31 N -3.27 0.00 0.00 0.02 -1.32 -0.02 -4.69 115.64 106.36 2ntk s THR 31 Ca 0.10 -1.89 0.02 0.00 -1.21 0.00 0.00 61.69 58.70 2ntk s THR 31 Cb 0.03 -2.49 -0.04 0.00 -1.51 0.00 0.00 72.50 68.49 2ntk s THR 31 CO -0.03 0.00 0.00 0.42 -2.21 0.00 0.00 174.62 172.80 2ntk s THR 32 N -3.75 4.15 -0.06 5.08 -4.23 -1.26 -1.36 115.64 114.21 2ntk s THR 32 Ca 0.37 -0.61 0.02 0.00 -1.18 0.00 0.00 61.69 60.28 2ntk s THR 32 Cb 0.04 -2.85 0.02 0.00 1.34 0.00 0.00 72.50 71.04 2ntk s THR 32 CO 0.18 0.37 -0.08 -0.55 -0.54 0.00 0.00 174.62 174.00 2ntk s SER 33 N -1.57 1.35 -0.13 3.99 0.15 0.82 -4.95 113.70 113.36 2ntk s SER 33 Ca 0.20 -0.21 -0.19 0.00 0.70 0.00 0.00 55.95 56.45 2ntk s SER 33 Cb -0.12 -0.62 -0.04 0.00 -1.71 0.00 0.00 66.02 63.53 2ntk s SER 33 CO 0.10 -0.02 0.51 -0.63 1.20 0.00 0.00 173.24 174.40 2ntk s ILE 34 N 0.84 5.16 0.24 6.45 1.01 -1.26 -0.16 121.20 133.47 2ntk s ILE 34 Ca -0.12 1.00 0.03 0.00 0.00 0.00 0.00 60.65 61.56 2ntk s ILE 34 Cb -0.15 -3.84 -0.01 0.00 0.01 0.00 0.00 42.46 38.47 2ntk s ILE 34 CO 0.01 0.29 0.11 0.00 0.00 0.00 0.00 174.94 175.35 2ntk n GLN 35 N 3.90 0.60 -1.59 2.79 1.13 0.00 -5.00 117.38 119.21 2ntk n GLN 35 Ca -0.06 -2.08 -0.45 0.00 -1.94 0.00 0.00 57.00 52.47 2ntk n GLN 35 Cb 0.51 1.27 -0.04 0.00 0.11 0.00 0.00 30.24 32.10 2ntk n GLN 35 CO 0.00 0.00 0.00 -1.91 -1.44 0.00 0.00 177.06 173.71 2ntk n GLU 36 N -0.52 1.99 -2.12 -1.09 2.13 -1.26 -2.18 120.64 117.59 2ntk n GLU 36 Ca -0.02 0.61 -0.18 0.00 0.66 0.00 0.00 57.16 58.23 2ntk n GLU 36 Cb 0.37 -3.01 -0.03 0.00 0.27 0.00 0.00 31.44 29.04 2ntk n GLU 36 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 2ntk n GLU 37 N 8.25 -1.70 -3.43 5.31 -0.58 -1.26 -4.94 120.64 122.28 2ntk n GLU 37 Ca 0.29 0.95 -0.11 0.00 -0.42 0.00 0.00 57.16 57.87 2ntk n GLU 37 Cb 0.39 -5.50 -0.02 0.00 -0.57 0.00 0.00 31.44 25.74 2ntk n GLU 37 CO 0.00 0.00 0.00 -0.98 -0.48 0.00 0.00 177.13 175.67 2ntk s ARG 38 N -4.54 1.21 -0.09 3.49 1.70 -0.93 -0.53 118.95 119.26 2ntk s ARG 38 Ca 0.00 -0.44 0.01 0.00 -0.47 0.00 0.00 55.73 54.83 2ntk s ARG 38 Cb 0.00 0.56 0.02 0.00 -0.57 0.00 0.00 34.95 34.95 2ntk s ARG 38 CO 0.00 -0.53 -0.11 0.08 -1.08 0.00 0.00 175.30 173.66 2ntk s VAL 39 N -3.65 1.16 0.05 4.99 1.01 -0.32 -0.82 120.40 122.83 2ntk s VAL 39 Ca 0.02 -0.45 0.05 0.00 0.00 0.00 0.00 61.98 61.60 2ntk s VAL 39 Cb -0.01 -1.09 -0.04 0.00 0.00 0.00 0.00 36.38 35.24 2ntk s VAL 39 CO -0.12 0.37 -0.06 0.00 0.00 0.00 0.00 175.10 175.29 2ntk s ALA 40 N 1.02 3.06 -0.28 5.51 0.00 0.77 -0.60 121.76 131.24 2ntk s ALA 40 Ca -0.07 -1.11 -0.13 0.00 0.00 0.00 0.00 51.96 50.65 2ntk s ALA 40 Cb -0.15 -1.07 -0.04 0.00 0.00 0.00 0.00 23.12 21.86 2ntk s ALA 40 CO -0.01 0.64 0.27 0.08 0.00 0.00 0.00 175.76 176.74 2ntk s VAL 41 N -1.14 5.25 0.07 0.00 1.01 0.13 -0.12 120.40 125.61 2ntk s VAL 41 Ca 0.20 0.28 -0.00 0.00 0.00 0.00 0.00 61.98 62.46 2ntk s VAL 41 Cb -0.11 -3.62 -0.04 0.00 0.00 0.00 0.00 36.38 32.61 2ntk s VAL 41 CO 0.12 0.18 -0.03 0.68 0.00 0.00 0.00 175.10 176.05 2ntk s VAL 42 N 1.89 0.35 0.60 2.92 -7.23 -0.46 -1.78 120.40 116.68 2ntk s VAL 42 Ca 0.10 -1.86 -0.18 0.00 -1.81 0.00 0.00 61.98 58.24 2ntk s VAL 42 Cb -0.16 -1.63 -0.03 0.00 0.56 0.00 0.00 36.38 35.12 2ntk s VAL 42 CO 0.11 -0.90 1.13 -2.84 -0.31 0.00 0.00 175.10 172.29 2ntk s PRO 43 N -3.91 3.07 0.65 4.82 0.02 -1.26 -0.84 135.00 137.56 2ntk s PRO 43 Ca 0.10 1.56 -0.11 0.00 0.02 0.00 0.00 61.00 62.58 2ntk s PRO 43 Cb 0.07 -1.97 -0.02 0.00 0.02 0.00 0.00 34.50 32.60 2ntk s PRO 43 CO -0.07 -1.06 1.05 0.14 -0.33 0.00 0.00 177.00 176.72 2ntk s VAL 44 N -1.96 4.32 0.17 3.83 -7.23 -0.74 -4.71 120.40 114.08 2ntk s VAL 44 Ca 0.71 0.75 -0.33 0.00 -1.81 0.00 0.00 61.98 61.31 2ntk s VAL 44 Cb -0.24 -3.71 -0.16 0.00 0.56 0.00 0.00 36.38 32.83 2ntk s VAL 44 CO 0.33 -0.98 1.18 1.21 -0.31 0.00 0.00 175.10 176.52 2ntk n GLU 45 N -2.86 1.18 -0.22 4.82 2.13 -1.26 -1.73 120.64 122.70 2ntk n GLU 45 Ca 0.06 0.42 0.00 0.00 0.66 0.00 0.00 57.16 58.31 2ntk n GLU 45 Cb 0.55 -1.93 0.00 0.00 0.27 0.00 0.00 31.44 30.33 2ntk n GLU 45 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2ntk n GLY 46 N 2.04 0.75 0.16 8.31 0.00 -1.26 -4.88 105.19 110.30 2ntk n GLY 46 Ca 0.15 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.20 2ntk n GLY 46 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2ntk n HIS 47 N -2.00 0.00 -0.34 1.61 8.25 -0.71 -4.85 115.22 117.19 2ntk n HIS 47 Ca 0.00 -0.43 0.20 0.00 -0.26 0.00 0.00 57.72 57.23 2ntk n HIS 47 Cb 0.00 -0.07 0.43 0.00 1.12 0.00 0.00 29.99 31.47 2ntk n HIS 47 CO 0.00 0.00 0.00 0.93 0.64 0.00 0.00 176.34 177.91 2ntk h GLU 48 N 0.00 0.49 0.00 -0.41 3.07 -1.88 -0.52 114.58 115.33 2ntk h GLU 48 Ca 0.00 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.83 2ntk h GLU 48 Cb 1.01 -0.11 0.00 0.00 -0.84 0.00 0.00 28.75 28.81 2ntk h GLU 48 CO 0.00 0.32 0.00 0.54 -1.40 0.00 0.00 179.01 178.47 2ntk n ARG 49 N -4.82 0.06 0.23 2.33 1.74 -1.26 -2.72 116.66 112.23 2ntk n ARG 49 Ca 0.27 0.28 0.07 0.00 -0.77 0.00 0.00 57.85 57.70 2ntk n ARG 49 Cb 0.81 -1.50 0.56 0.00 -1.02 0.00 0.00 32.46 31.31 2ntk n ARG 49 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 2ntk h ASP 50 N 0.00 0.00 0.25 0.55 3.32 -1.49 -1.87 116.42 117.19 2ntk h ASP 50 Ca 0.00 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.05 2ntk h ASP 50 Cb 0.11 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.66 2ntk h ASP 50 CO 0.00 0.18 -0.02 -0.37 -1.72 0.00 0.00 179.24 177.30 2ntk h VAL 51 N 0.00 0.17 -0.00 -1.35 -1.51 -1.74 0.48 116.25 112.29 2ntk h VAL 51 Ca -0.00 -0.19 0.00 0.00 -1.23 0.00 0.00 66.70 65.28 2ntk h VAL 51 Cb 0.34 1.15 0.00 0.00 -2.13 0.00 0.00 31.29 30.65 2ntk h VAL 51 CO 0.02 0.02 -0.39 0.49 -1.23 0.00 0.00 177.57 176.48 2ntk n PHE 52 N -3.28 0.00 -0.06 5.19 3.01 -0.70 -3.93 117.46 117.69 2ntk n PHE 52 Ca -0.02 0.00 -0.12 0.00 1.01 0.00 0.00 57.45 58.32 2ntk n PHE 52 Cb 0.14 -0.21 -0.15 0.00 -0.01 0.00 0.00 39.48 39.26 2ntk n PHE 52 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 2ntk n ARG 53 N -1.19 0.67 -3.68 -1.08 1.74 0.11 -4.89 116.66 108.34 2ntk n ARG 53 Ca 0.08 0.17 -0.15 0.00 -0.77 0.00 0.00 57.85 57.19 2ntk n ARG 53 Cb 0.34 -1.66 -0.14 0.00 -1.02 0.00 0.00 32.46 29.97 2ntk n ARG 53 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 2ntk s ASN 54 N -6.04 0.35 0.00 0.55 3.84 -0.88 -5.04 114.94 107.72 2ntk s ASN 54 Ca -0.12 0.46 0.25 0.00 0.21 0.00 0.00 52.86 53.66 2ntk s ASN 54 Cb 0.07 0.45 1.47 0.00 -0.55 0.00 0.00 41.25 42.69 2ntk s ASN 54 CO 0.80 -0.22 1.87 -0.81 -2.79 0.00 0.00 177.10 175.95 2ntk n PRO 55 N 5.05 0.87 -0.18 0.43 -0.04 -1.26 -3.66 135.00 136.21 2ntk n PRO 55 Ca -0.11 0.00 0.06 0.00 -0.04 0.00 0.00 63.50 63.41 2ntk n PRO 55 Cb 0.50 -1.44 0.16 0.00 -0.04 0.00 0.00 33.50 32.68 2ntk n PRO 55 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2ntk n TYR 56 N -0.94 0.47 0.45 0.54 0.53 -1.26 -4.66 117.16 112.28 2ntk n TYR 56 Ca 0.18 -0.48 0.11 0.00 -1.02 0.00 0.00 57.90 56.69 2ntk n TYR 56 Cb 0.08 -0.02 -0.13 0.00 -1.03 0.00 0.00 39.34 38.24 2ntk n TYR 56 CO 0.00 0.00 0.00 0.44 -1.02 0.00 0.00 176.86 176.28 2ntk n ILE 57 N 0.56 0.02 -4.97 -0.72 -5.35 -1.24 -4.89 119.36 102.77 2ntk n ILE 57 Ca 0.12 -0.28 -0.29 0.00 -0.27 0.00 0.00 62.75 62.03 2ntk n ILE 57 Cb 0.43 0.42 -0.17 0.00 -1.74 0.00 0.00 39.64 38.58 2ntk n ILE 57 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2ntk s ALA 58 N -3.28 1.81 -0.11 -1.28 0.00 -1.26 -4.64 121.76 113.00 2ntk s ALA 58 Ca -0.00 -0.75 -0.33 0.00 0.00 0.00 0.00 51.96 50.87 2ntk s ALA 58 Cb 0.15 -0.71 0.14 0.00 0.00 0.00 0.00 23.12 22.69 2ntk s ALA 58 CO 0.88 0.22 1.36 1.52 0.00 0.00 0.00 175.76 179.74 2ntk s TYR 59 N 0.46 -0.03 -0.11 0.00 -0.85 -0.73 -4.86 117.35 111.23 2ntk s TYR 59 Ca -0.17 -0.01 -0.27 0.00 -0.52 0.00 0.00 57.07 56.10 2ntk s TYR 59 Cb -0.17 0.52 -0.02 0.00 0.38 0.00 0.00 41.96 42.67 2ntk s TYR 59 CO 0.07 -0.12 0.89 -0.80 -1.52 0.00 0.00 175.55 174.07 2ntk s ASN 60 N -2.74 7.12 0.04 -0.18 0.01 -1.26 0.23 114.94 118.14 2ntk s ASN 60 Ca 0.14 1.37 0.22 0.00 -0.71 0.00 0.00 52.86 53.88 2ntk s ASN 60 Cb 0.04 -2.50 -0.17 0.00 0.41 0.00 0.00 41.25 39.04 2ntk s ASN 60 CO -0.05 -0.35 0.76 0.00 -1.51 0.00 0.00 177.10 175.96 2ntk s ILE 62 N -3.36 -0.03 -0.01 0.00 1.01 -1.05 -1.43 121.20 116.33 2ntk s ILE 62 Ca -0.02 0.10 0.02 0.00 0.00 0.00 0.00 60.65 60.75 2ntk s ILE 62 Cb 0.13 -0.11 0.00 0.00 0.01 0.00 0.00 42.46 42.50 2ntk s ILE 62 CO 0.86 0.04 -0.06 -0.13 0.00 0.00 0.00 174.94 175.64 2ntk s ARG 63 N 0.56 0.60 -0.19 2.79 1.81 -0.35 -1.18 118.95 123.00 2ntk s ARG 63 Ca -0.04 -0.21 -0.02 0.00 -1.72 0.00 0.00 55.73 53.74 2ntk s ARG 63 Cb -0.06 -0.59 -0.00 0.00 -0.45 0.00 0.00 34.95 33.84 2ntk s ARG 63 CO -0.02 0.10 -0.10 0.42 -0.68 0.00 0.00 175.30 175.02 2ntk s ILE 64 N 0.07 2.98 -0.29 1.52 -1.09 0.31 -0.88 121.20 123.82 2ntk s ILE 64 Ca -0.01 -0.64 0.02 0.00 -2.23 0.00 0.00 60.65 57.79 2ntk s ILE 64 Cb -0.05 -2.31 0.08 0.00 -1.58 0.00 0.00 42.46 38.60 2ntk s ILE 64 CO -0.00 0.48 0.02 0.68 -1.23 0.00 0.00 174.94 174.88 2ntk s VAL 65 N 1.16 1.64 0.00 2.92 -7.23 0.09 -4.89 120.40 114.08 2ntk s VAL 65 Ca 0.01 -1.65 0.00 0.00 -1.81 0.00 0.00 61.98 58.53 2ntk s VAL 65 Cb -0.14 -2.08 0.00 0.00 0.56 0.00 0.00 36.38 34.72 2ntk s VAL 65 CO -0.03 -0.41 0.00 0.61 -0.31 0.00 0.00 175.10 174.96 2ntk n GLY 66 N 4.57 4.07 0.31 2.32 0.00 -1.26 -0.54 105.19 114.66 2ntk n GLY 66 Ca -0.04 0.09 0.12 0.00 0.00 0.00 0.00 46.02 46.19 2ntk n GLY 66 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2ntk n ASP 67 N 7.45 0.96 -4.64 1.61 5.75 -1.26 -4.88 116.55 121.55 2ntk n ASP 67 Ca 0.00 -1.46 -0.35 0.00 -0.01 0.00 0.00 54.79 52.97 2ntk n ASP 67 Cb 0.00 -0.03 -0.10 0.00 -1.03 0.00 0.00 41.12 39.95 2ntk n ASP 67 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 2ntk s THR 68 N -1.93 4.17 -0.14 2.12 2.01 0.30 -4.15 115.64 118.03 2ntk s THR 68 Ca 0.36 -0.29 -0.01 0.00 0.31 0.00 0.00 61.69 62.05 2ntk s THR 68 Cb 0.18 -2.76 -0.02 0.00 0.01 0.00 0.00 72.50 69.91 2ntk s THR 68 CO 0.29 0.58 -0.10 0.00 -0.69 0.00 0.00 174.62 174.71 2ntk s ALA 69 N -0.63 2.76 -0.06 7.40 0.00 -0.02 -0.73 121.76 130.47 2ntk s ALA 69 Ca 0.10 -0.86 0.05 0.00 0.00 0.00 0.00 51.96 51.25 2ntk s ALA 69 Cb -0.12 -1.33 -0.01 0.00 0.00 0.00 0.00 23.12 21.66 2ntk s ALA 69 CO 0.02 0.24 -0.22 0.08 0.00 0.00 0.00 175.76 175.89 2ntk s VAL 70 N 0.34 2.34 -0.00 0.00 1.01 -0.06 -0.99 120.40 123.03 2ntk s VAL 70 Ca -0.08 -0.96 0.02 0.00 0.00 0.00 0.00 61.98 60.95 2ntk s VAL 70 Cb -0.15 -1.88 -0.01 0.00 0.00 0.00 0.00 36.38 34.34 2ntk s VAL 70 CO 0.05 0.57 -0.07 0.54 0.00 0.00 0.00 175.10 176.19 2ntk s VAL 71 N -0.22 0.54 0.17 2.92 0.11 -0.19 -1.21 120.40 122.52 2ntk s VAL 71 Ca -0.01 -0.34 -0.24 0.00 -2.93 0.00 0.00 61.98 58.46 2ntk s VAL 71 Cb -0.13 -0.47 0.06 0.00 -1.53 0.00 0.00 36.38 34.31 2ntk s VAL 71 CO 0.03 0.13 0.85 -0.94 -3.33 0.00 0.00 175.10 171.84 2ntk s SER 72 N -0.24 -0.26 -0.13 3.54 1.04 -0.52 -0.73 113.70 116.41 2ntk s SER 72 Ca 0.02 -0.38 0.12 0.00 0.48 0.00 0.00 55.95 56.18 2ntk s SER 72 Cb -0.03 0.56 0.57 0.00 0.10 0.00 0.00 66.02 67.22 2ntk s SER 72 CO -0.00 -1.01 1.41 -0.46 0.98 0.00 0.00 173.24 174.16 2ntk n ASN 73 N -0.43 4.07 -0.96 7.02 6.94 -1.13 -4.41 115.26 126.36 2ntk n ASN 73 Ca -0.07 -2.51 0.00 0.00 -0.02 0.00 0.00 54.58 51.98 2ntk n ASN 73 Cb 0.61 -0.57 0.00 0.00 -2.36 0.00 0.00 39.78 37.46 2ntk n ASN 73 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2ntk n GLY 74 N 0.68 1.88 0.00 4.83 0.00 -1.26 -4.97 105.19 106.35 2ntk n GLY 74 Ca 0.20 -0.98 0.05 0.00 0.00 0.00 0.00 46.02 45.29 2ntk n GLY 74 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2ntk n SER 75 N -0.87 0.00 0.00 1.61 3.41 -1.26 -2.07 113.62 114.44 2ntk n SER 75 Ca 0.00 0.50 0.07 0.00 -0.26 0.00 0.00 58.87 59.17 2ntk n SER 75 Cb 0.00 -0.50 0.33 0.00 -0.26 0.00 0.00 64.21 63.78 2ntk n SER 75 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ntk n HIS 76 N -1.50 0.00 -0.24 7.33 1.44 -1.26 -1.91 115.22 119.09 2ntk n HIS 76 Ca 0.03 0.00 -0.07 0.00 -2.01 0.00 0.00 57.72 55.67 2ntk n HIS 76 Cb 0.12 -0.35 0.04 0.00 0.12 0.00 0.00 29.99 29.92 2ntk n HIS 76 CO 0.00 0.00 0.00 1.15 -2.81 0.00 0.00 176.34 174.68 2ntk h THR 77 N 0.00 1.23 -0.17 0.61 2.02 -1.65 -0.78 112.91 114.17 2ntk h THR 77 Ca 0.00 -0.67 -0.21 0.00 0.77 0.00 0.00 66.41 66.30 2ntk h THR 77 Cb 0.16 0.46 0.00 0.00 -1.74 0.00 0.00 68.15 67.03 2ntk h THR 77 CO 0.00 0.27 -0.71 0.44 0.37 0.00 0.00 175.52 175.89 2ntk h ASP 78 N 0.91 0.84 -0.48 4.18 3.32 -1.64 -0.99 116.42 122.57 2ntk h ASP 78 Ca 0.22 -0.53 0.02 0.00 0.02 0.00 0.00 57.03 56.76 2ntk h ASP 78 Cb 0.15 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.43 2ntk h ASP 78 CO -0.02 1.31 0.30 0.74 -1.72 0.00 0.00 179.24 179.84 2ntk h THR 79 N 0.51 1.08 -0.06 0.35 2.02 -1.47 0.65 112.91 115.99 2ntk h THR 79 Ca -0.03 -0.21 -0.03 0.00 0.77 0.00 0.00 66.41 66.91 2ntk h THR 79 Cb 1.32 0.42 -0.00 0.00 -1.74 0.00 0.00 68.15 68.16 2ntk h THR 79 CO 0.14 0.11 -0.07 0.40 0.37 0.00 0.00 175.52 176.47 2ntk h ILE 80 N 0.60 1.39 -0.91 3.11 2.04 -1.15 -2.92 117.51 119.67 2ntk h ILE 80 Ca 0.19 -1.28 0.00 0.00 1.00 0.00 0.00 64.86 64.77 2ntk h ILE 80 Cb -0.02 2.12 -0.04 0.00 -0.74 0.00 0.00 36.82 38.13 2ntk h ILE 80 CO -0.07 0.35 0.59 0.00 0.00 0.00 0.00 178.15 179.02 2ntk h ALA 81 N 0.52 1.32 -0.65 1.87 0.00 -1.07 -1.51 119.26 119.74 2ntk h ALA 81 Ca 0.01 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 2ntk h ALA 81 Cb 0.60 -0.37 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 2ntk h ALA 81 CO 0.02 0.62 0.29 -0.44 0.00 0.00 0.00 179.25 179.73 2ntk h ASP 82 N 1.24 0.88 -0.61 0.00 3.32 -0.89 -0.17 116.42 120.18 2ntk h ASP 82 Ca 0.33 -0.15 -0.09 0.00 0.02 0.00 0.00 57.03 57.14 2ntk h ASP 82 Cb -0.11 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.19 2ntk h ASP 82 CO -0.07 0.78 0.05 0.11 -1.72 0.00 0.00 179.24 178.39 2ntk h LYS 83 N 0.91 1.05 -0.57 3.56 1.79 -1.23 -0.97 116.57 121.11 2ntk h LYS 83 Ca 0.22 -0.31 -0.02 0.00 -2.18 0.00 0.00 60.65 58.36 2ntk h LYS 83 Cb 0.16 -0.11 -0.03 0.00 -1.58 0.00 0.00 32.23 30.68 2ntk h LYS 83 CO -0.02 1.01 0.29 0.28 -1.08 0.00 0.00 179.45 179.93 2ntk h VAL 84 N 0.96 1.20 -0.78 0.50 2.07 -0.94 -1.50 116.25 117.75 2ntk h VAL 84 Ca 0.18 -0.52 -0.01 0.00 0.82 0.00 0.00 66.70 67.17 2ntk h VAL 84 Cb 0.50 0.50 -0.04 0.00 -1.52 0.00 0.00 31.29 30.73 2ntk h VAL 84 CO 0.02 0.22 0.46 0.00 0.02 0.00 0.00 177.57 178.29 2ntk h ALA 85 N 1.13 1.34 -0.09 1.67 0.00 -0.70 -2.01 119.26 120.59 2ntk h ALA 85 Ca 0.20 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2ntk h ALA 85 Cb 0.08 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.55 2ntk h ALA 85 CO -0.03 0.56 0.00 1.28 0.00 0.00 0.00 179.25 181.06 2ntk n LEU 86 N -4.37 1.00 -0.50 0.00 4.77 -0.40 -4.95 117.00 112.55 2ntk n LEU 86 Ca 0.08 -0.41 0.00 0.00 -0.03 0.00 0.00 56.01 55.65 2ntk n LEU 86 Cb 0.07 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.10 2ntk n LEU 86 CO 0.37 0.21 0.00 0.61 -1.33 0.00 0.00 177.39 177.25 2ntk n GLY 87 N 1.00 -1.06 3.64 -0.72 0.00 -0.61 -5.05 105.19 102.40 2ntk n GLY 87 Ca 0.16 -0.59 -0.05 0.00 0.00 0.00 0.00 46.02 45.54 2ntk n GLY 87 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2ntk s MET 88 N -0.05 0.52 0.82 1.61 0.00 -1.12 -4.90 119.30 116.18 2ntk s MET 88 Ca 0.00 0.87 -0.13 0.00 0.00 0.00 0.00 55.69 56.44 2ntk s MET 88 Cb 0.00 0.11 0.09 0.00 0.00 0.00 0.00 34.83 35.04 2ntk s MET 88 CO 0.00 -0.11 1.19 0.54 0.00 0.00 0.00 175.02 176.65 2ntk s ASN 89 N 1.38 3.51 0.21 1.11 2.20 -1.26 -4.40 114.94 117.69 2ntk s ASN 89 Ca -0.09 2.32 -0.10 0.00 -0.94 0.00 0.00 52.86 54.06 2ntk s ASN 89 Cb -0.04 -2.58 0.21 0.00 -2.00 0.00 0.00 41.25 36.83 2ntk s ASN 89 CO -0.16 -2.72 1.84 -0.07 -2.94 0.00 0.00 177.10 173.05 2ntk h LEU 90 N -1.06 0.68 -0.16 3.54 3.38 -1.99 -1.53 115.31 118.17 2ntk h LEU 90 Ca -0.46 0.01 0.01 0.00 0.09 0.00 0.00 57.88 57.53 2ntk h LEU 90 Cb 1.29 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.89 2ntk h LEU 90 CO 0.45 0.46 0.09 -0.09 0.09 0.00 0.00 178.44 179.45 2ntk h ARG 91 N 0.82 0.19 -0.15 1.13 2.43 -1.97 -1.80 114.38 115.02 2ntk h ARG 91 Ca 0.29 -0.01 -0.14 0.00 -0.81 0.00 0.00 59.98 59.31 2ntk h ARG 91 Cb 0.07 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.56 2ntk h ARG 91 CO -0.13 0.12 -0.49 -0.44 -1.51 0.00 0.00 179.97 177.53 2ntk h ASP 92 N 0.19 0.43 -0.40 -3.80 3.32 -1.90 0.69 116.42 114.95 2ntk h ASP 92 Ca 0.06 -0.21 -0.02 0.00 0.02 0.00 0.00 57.03 56.88 2ntk h ASP 92 Cb -0.00 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.41 2ntk h ASP 92 CO -0.03 0.85 0.16 0.00 -1.72 0.00 0.00 179.24 178.50 2ntk h ALA 93 N 1.17 0.52 -0.07 3.45 0.00 -1.07 0.19 119.26 123.44 2ntk h ALA 93 Ca 0.02 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 2ntk h ALA 93 Cb 0.97 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.60 2ntk h ALA 93 CO 0.08 0.12 -0.11 0.82 0.00 0.00 0.00 179.25 180.16 2ntk h ILE 94 N 0.50 1.40 -0.35 0.00 2.04 -1.27 -2.67 117.51 117.15 2ntk h ILE 94 Ca 0.13 -1.37 0.05 0.00 1.00 0.00 0.00 64.86 64.67 2ntk h ILE 94 Cb 0.18 2.15 -0.05 0.00 -0.74 0.00 0.00 36.82 38.37 2ntk h ILE 94 CO -0.01 0.38 0.07 1.23 0.00 0.00 0.00 178.15 179.82 2ntk h GLY 95 N -0.28 0.41 0.93 5.37 0.00 -0.72 -0.97 103.07 107.82 2ntk h GLY 95 Ca 0.01 -0.02 -0.06 0.00 0.00 0.00 0.00 47.33 47.25 2ntk h GLY 95 CO 0.03 -0.02 0.01 -2.00 0.00 0.00 0.00 176.54 174.55 2ntk h LEU 96 N 0.19 0.65 -0.53 3.11 5.85 -0.70 -1.48 115.31 122.40 2ntk h LEU 96 Ca 0.17 -0.30 -0.03 0.00 0.84 0.00 0.00 57.88 58.55 2ntk h LEU 96 Cb 0.19 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.02 2ntk h LEU 96 CO -0.22 0.79 0.21 0.28 -0.34 0.00 0.00 178.44 179.16 2ntk h SER 97 N 0.49 0.73 0.01 1.25 0.02 -1.29 -1.66 113.55 113.10 2ntk h SER 97 Ca 0.11 -0.17 -0.17 0.00 -0.84 0.00 0.00 61.79 60.71 2ntk h SER 97 Cb 0.46 -0.19 -0.00 0.00 0.14 0.00 0.00 62.40 62.80 2ntk h SER 97 CO 0.02 0.71 -0.60 -0.07 -1.14 0.00 0.00 176.83 175.74 2ntk h LEU 98 N 0.72 0.67 -0.35 5.07 3.38 -1.15 -0.81 115.31 122.84 2ntk h LEU 98 Ca 0.18 -0.38 -0.01 0.00 0.09 0.00 0.00 57.88 57.76 2ntk h LEU 98 Cb 0.21 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 2ntk h LEU 98 CO -0.01 1.12 0.20 0.25 0.09 0.00 0.00 178.44 180.08 2ntk h LEU 99 N 0.44 0.43 0.12 1.67 5.85 -1.17 0.11 115.31 122.76 2ntk h LEU 99 Ca -0.00 -0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.63 2ntk h LEU 99 Cb 1.17 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 42.09 2ntk h LEU 99 CO 0.12 0.38 -0.06 0.00 -0.34 0.00 0.00 178.44 178.54 2ntk h ALA 100 N 1.07 -0.16 -0.07 1.25 0.00 -1.24 -3.34 119.26 116.77 2ntk h ALA 100 Ca 0.12 -0.22 -0.18 0.00 0.00 0.00 0.00 54.91 54.63 2ntk h ALA 100 Cb 0.04 0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 2ntk h ALA 100 CO -0.02 -0.35 -0.74 0.52 0.00 0.00 0.00 179.25 178.66 2ntk h MET 101 N -0.64 0.40 0.00 0.00 2.86 -1.18 -3.50 114.93 112.87 2ntk h MET 101 Ca -0.02 -0.33 0.23 0.00 -2.06 0.00 0.00 59.70 57.52 2ntk h MET 101 Cb 0.49 0.07 -0.06 0.00 0.06 0.00 0.00 31.60 32.16 2ntk h MET 101 CO 0.03 0.97 -0.30 -3.47 1.06 0.00 0.00 176.91 175.19 2ntk n ASP 102 N -3.83 -5.61 -4.75 1.22 4.64 0.37 -4.84 116.55 103.75 2ntk n ASP 102 Ca -0.04 0.90 -0.31 0.00 -1.38 0.00 0.00 54.79 53.96 2ntk n ASP 102 Cb 0.71 -2.53 0.11 0.00 -1.04 0.00 0.00 41.12 38.36 2ntk n ASP 102 CO 0.00 0.00 0.00 -0.72 -0.82 0.00 0.00 177.20 175.66 2ntk s TYR 103 N -1.55 2.37 0.32 -0.67 -0.85 -1.26 -4.60 117.35 111.11 2ntk s TYR 103 Ca 0.00 1.61 -0.28 0.00 -0.52 0.00 0.00 57.07 57.88 2ntk s TYR 103 Cb 0.00 -3.11 -0.09 0.00 0.38 0.00 0.00 41.96 39.14 2ntk s TYR 103 CO 0.00 -2.02 1.05 -1.21 -1.52 0.00 0.00 175.55 171.85 2ntk s GLU 104 N -4.85 4.51 -1.28 -3.49 2.02 0.89 -4.96 118.70 111.55 2ntk s GLU 104 Ca 0.62 1.64 -0.07 0.00 0.02 0.00 0.00 54.97 57.18 2ntk s GLU 104 Cb -0.18 -2.97 0.16 0.00 0.10 0.00 0.00 34.13 31.24 2ntk s GLU 104 CO 0.56 0.14 2.07 1.63 0.02 0.00 0.00 175.26 179.69 2ntk n LYS 105 N 0.78 4.17 -1.18 1.61 4.76 -1.26 -3.35 118.16 123.68 2ntk n LYS 105 Ca 0.01 -3.61 0.00 0.00 -2.87 0.00 0.00 58.31 51.84 2ntk n LYS 105 Cb 0.47 -2.75 0.00 0.00 -1.84 0.00 0.00 35.03 30.91 2ntk n LYS 105 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 2ntk n ASP 106 N 2.62 1.55 0.26 4.39 5.68 -1.26 -4.98 116.55 124.80 2ntk n ASP 106 Ca 0.49 -0.67 0.17 0.00 -0.50 0.00 0.00 54.79 54.28 2ntk n ASP 106 Cb 0.31 0.00 0.78 0.00 -1.14 0.00 0.00 41.12 41.07 2ntk n ASP 106 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 2ntk h GLU 107 N 0.00 0.00 -0.16 0.11 5.08 -2.02 -3.05 114.58 114.54 2ntk h GLU 107 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2ntk h GLU 107 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2ntk h GLU 107 CO 0.00 0.00 0.00 1.28 -1.00 0.00 0.00 179.01 179.29 2ntk n LEU 108 N -2.85 2.31 -3.93 1.33 4.77 -1.26 -4.97 117.00 112.40 2ntk n LEU 108 Ca -0.00 -1.78 -0.30 0.00 -0.03 0.00 0.00 56.01 53.89 2ntk n LEU 108 Cb 0.20 -0.10 0.02 0.00 -2.33 0.00 0.00 43.42 41.21 2ntk n LEU 108 CO 0.22 0.56 0.09 0.59 -1.33 0.00 0.00 177.39 177.53 2ntk n ASN 109 N 0.14 -4.57 -4.68 -1.43 3.02 -1.15 -4.78 115.26 101.81 2ntk n ASN 109 Ca 0.06 -0.80 -0.56 0.00 -0.03 0.00 0.00 54.58 53.25 2ntk n ASN 109 Cb 0.31 -3.80 -0.07 0.00 -0.61 0.00 0.00 39.78 35.61 2ntk n ASN 109 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 2ntk n THR 110 N -4.65 0.22 -0.91 3.41 -1.04 -1.21 -4.51 114.28 105.58 2ntk n THR 110 Ca 0.03 -0.04 -0.31 0.00 -2.04 0.00 0.00 64.05 61.70 2ntk n THR 110 Cb 0.53 -1.09 0.14 0.00 -1.82 0.00 0.00 70.33 68.10 2ntk n THR 110 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 2ntk s PRO 111 N 2.68 1.35 -0.18 -2.82 0.02 -1.26 -0.07 135.00 134.71 2ntk s PRO 111 Ca 0.95 1.34 -0.05 0.00 0.02 0.00 0.00 61.00 63.26 2ntk s PRO 111 Cb -1.05 -1.78 -0.03 0.00 0.02 0.00 0.00 34.50 31.66 2ntk s PRO 111 CO 0.61 -2.33 0.00 1.03 -0.33 0.00 0.00 177.00 175.98 2ntk s ARG 112 N -4.74 3.72 0.22 5.54 0.52 -1.01 -4.70 118.95 118.51 2ntk s ARG 112 Ca 0.65 -0.48 0.11 0.00 -0.52 0.00 0.00 55.73 55.49 2ntk s ARG 112 Cb -0.21 -3.05 -0.05 0.00 0.52 0.00 0.00 34.95 32.17 2ntk s ARG 112 CO 0.58 0.16 -0.18 0.96 0.02 0.00 0.00 175.30 176.84 2ntk s ILE 113 N 0.60 2.65 0.09 1.52 -4.36 -1.26 -1.83 121.20 118.62 2ntk s ILE 113 Ca -0.01 -2.07 -0.26 0.00 -0.26 0.00 0.00 60.65 58.06 2ntk s ILE 113 Cb -0.14 -2.33 0.08 0.00 1.25 0.00 0.00 42.46 41.31 2ntk s ILE 113 CO 0.02 -0.23 0.85 0.00 0.24 0.00 0.00 174.94 175.82 2ntk s ALA 114 N -2.00 -1.69 0.10 2.27 0.00 -0.38 -2.83 121.76 117.24 2ntk s ALA 114 Ca 0.25 0.54 -0.21 0.00 0.00 0.00 0.00 51.96 52.55 2ntk s ALA 114 Cb -0.07 0.60 0.05 0.00 0.00 0.00 0.00 23.12 23.70 2ntk s ALA 114 CO 0.13 -0.84 0.50 0.00 0.00 0.00 0.00 175.76 175.56 2ntk s ALA 115 N -3.34 -1.27 -0.10 0.00 0.00 0.09 -0.17 121.76 116.98 2ntk s ALA 115 Ca 0.07 0.37 -0.14 0.00 0.00 0.00 0.00 51.96 52.25 2ntk s ALA 115 Cb -0.02 0.61 0.03 0.00 0.00 0.00 0.00 23.12 23.75 2ntk s ALA 115 CO -0.05 -0.62 0.36 0.00 0.00 0.00 0.00 175.76 175.46 2ntk s ALA 116 N -3.22 -0.91 -0.10 0.00 0.00 -0.65 -1.02 121.76 115.87 2ntk s ALA 116 Ca -0.01 0.83 -0.08 0.00 0.00 0.00 0.00 51.96 52.70 2ntk s ALA 116 Cb 0.00 -0.38 0.03 0.00 0.00 0.00 0.00 23.12 22.77 2ntk s ALA 116 CO -0.08 -0.21 0.25 -1.50 0.00 0.00 0.00 175.76 174.23 2ntk s ILE 117 N -0.33 -0.01 0.00 0.00 2.07 -0.17 -1.49 121.20 121.28 2ntk s ILE 117 Ca -0.05 0.04 0.00 0.00 -1.41 0.00 0.00 60.65 59.23 2ntk s ILE 117 Cb -0.03 -0.37 0.00 0.00 0.13 0.00 0.00 42.46 42.19 2ntk s ILE 117 CO 0.02 0.02 0.00 -0.46 -1.91 0.00 0.00 174.94 172.61 2ntk n ASN 118 N 3.28 1.28 0.27 4.50 0.23 -0.47 -0.84 115.26 123.52 2ntk n ASN 118 Ca -0.16 -0.68 0.13 0.00 -0.53 0.00 0.00 54.58 53.34 2ntk n ASN 118 Cb 0.57 0.00 0.78 0.00 -2.08 0.00 0.00 39.78 39.05 2ntk n ASN 118 CO 0.00 0.00 0.00 1.23 -0.93 0.00 0.00 177.26 177.56 2ntk h GLY 119 N 0.00 0.00 0.00 4.83 0.00 -2.03 -3.31 103.07 102.56 2ntk h GLY 119 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.29 2ntk h GLY 119 CO 0.00 0.00 -1.36 -1.14 0.00 0.00 0.00 176.54 174.04 2ntk n SER 120 N -3.73 3.40 -3.93 0.19 3.41 -1.26 -5.09 113.62 106.60 2ntk n SER 120 Ca -0.02 0.00 -0.09 0.00 -0.26 0.00 0.00 58.87 58.50 2ntk n SER 120 Cb 0.19 1.09 -0.05 0.00 -0.26 0.00 0.00 64.21 65.19 2ntk n SER 120 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 175.04 173.05 2ntk s GLU 121 N -2.37 1.55 -0.03 4.33 -1.05 -1.25 -5.14 118.70 114.74 2ntk s GLU 121 Ca -0.03 -1.14 -0.10 0.00 -0.15 0.00 0.00 54.97 53.54 2ntk s GLU 121 Cb 0.04 0.50 0.02 0.00 -0.44 0.00 0.00 34.13 34.24 2ntk s GLU 121 CO 0.28 -0.66 0.23 0.00 0.95 0.00 0.00 175.26 176.07 2ntk s ALA 122 N -3.98 -0.57 0.07 -0.84 0.00 -1.26 -1.37 121.76 113.81 2ntk s ALA 122 Ca 0.18 0.24 0.03 0.00 0.00 0.00 0.00 51.96 52.41 2ntk s ALA 122 Cb -0.01 -0.03 -0.03 0.00 0.00 0.00 0.00 23.12 23.04 2ntk s ALA 122 CO 0.06 -0.21 -0.09 -0.06 0.00 0.00 0.00 175.76 175.47 2ntk s PHE 123 N -1.00 0.87 0.01 0.00 0.40 -0.56 -0.76 117.98 116.94 2ntk s PHE 123 Ca -0.11 -0.63 0.03 0.00 -0.60 0.00 0.00 56.93 55.63 2ntk s PHE 123 Cb -0.05 -0.50 -0.01 0.00 0.51 0.00 0.00 43.02 42.97 2ntk s PHE 123 CO 0.02 -0.06 -0.10 -1.50 0.70 0.00 0.00 175.22 174.28 2ntk s ILE 124 N -2.13 0.74 0.12 0.64 2.07 -0.24 -1.63 121.20 120.76 2ntk s ILE 124 Ca -0.01 -0.64 -0.08 0.00 -1.41 0.00 0.00 60.65 58.51 2ntk s ILE 124 Cb -0.05 -0.67 -0.01 0.00 0.13 0.00 0.00 42.46 41.87 2ntk s ILE 124 CO -0.01 0.03 0.21 -0.83 -1.91 0.00 0.00 174.94 172.44 2ntk s GLY 125 N -0.68 0.28 -0.09 1.50 0.00 0.76 -0.71 107.32 108.38 2ntk s GLY 125 Ca 0.00 -0.77 -0.20 0.00 0.00 0.00 0.00 44.72 43.76 2ntk s GLY 125 CO 0.00 -0.85 0.47 -1.50 0.00 0.00 0.00 173.10 171.22 2ntk s ILE 126 N -3.91 0.02 -0.06 0.90 2.07 0.07 -1.25 121.20 119.05 2ntk s ILE 126 Ca 0.10 -0.17 0.01 0.00 -1.41 0.00 0.00 60.65 59.18 2ntk s ILE 126 Cb 0.04 -0.74 0.02 0.00 0.13 0.00 0.00 42.46 41.91 2ntk s ILE 126 CO -0.06 -0.10 -0.06 0.54 -1.91 0.00 0.00 174.94 173.35 2ntk s VAL 127 N -0.68 0.67 0.23 4.00 0.11 -0.76 -0.89 120.40 123.07 2ntk s VAL 127 Ca -0.08 -0.18 0.02 0.00 -2.93 0.00 0.00 61.98 58.81 2ntk s VAL 127 Cb -0.03 -0.68 -0.01 0.00 -1.53 0.00 0.00 36.38 34.13 2ntk s VAL 127 CO 0.04 0.26 0.06 0.35 -3.33 0.00 0.00 175.10 172.49 2ntk n THR 128 N 4.17 0.00 0.53 5.04 -2.24 0.19 -2.40 114.28 119.57 2ntk n THR 128 Ca -0.22 -1.26 0.10 0.00 -2.27 0.00 0.00 64.05 60.40 2ntk n THR 128 Cb 0.51 0.42 0.42 0.00 -2.10 0.00 0.00 70.33 69.58 2ntk n THR 128 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2ntk n ALA 129 N -2.00 1.79 0.73 6.98 0.00 -1.26 -2.72 120.51 124.02 2ntk n ALA 129 Ca -0.09 -0.01 0.08 0.00 0.00 0.00 0.00 53.44 53.43 2ntk n ALA 129 Cb 0.33 -1.34 0.03 0.00 0.00 0.00 0.00 19.45 18.47 2ntk n ALA 129 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2ntk n ASP 130 N -1.83 1.98 0.00 0.00 8.00 -1.26 -5.09 116.55 118.36 2ntk n ASP 130 Ca 0.04 -1.49 0.00 0.00 0.71 0.00 0.00 54.79 54.04 2ntk n ASP 130 Cb 0.23 0.27 0.00 0.00 -0.02 0.00 0.00 41.12 41.60 2ntk n ASP 130 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2ntk n GLY 131 N 1.08 -1.20 2.80 0.44 0.00 -1.10 -5.13 105.19 102.08 2ntk n GLY 131 Ca 0.08 -1.16 -0.14 0.00 0.00 0.00 0.00 46.02 44.80 2ntk n GLY 131 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2ntk s LEU 132 N 0.00 1.23 -0.06 0.99 2.96 -1.26 -0.64 118.68 121.90 2ntk s LEU 132 Ca 0.00 0.05 -0.02 0.00 -0.22 0.00 0.00 54.13 53.94 2ntk s LEU 132 Cb 0.00 -0.02 0.04 0.00 0.50 0.00 0.00 46.19 46.71 2ntk s LEU 132 CO 0.00 -0.11 0.12 -0.32 -1.32 0.00 0.00 176.35 174.72 2ntk s MET 133 N 0.87 0.05 -0.07 1.98 -2.45 -0.07 -5.02 119.30 114.59 2ntk s MET 133 Ca -0.07 0.36 -0.00 0.00 -1.25 0.00 0.00 55.69 54.73 2ntk s MET 133 Cb -0.10 -0.23 0.02 0.00 1.25 0.00 0.00 34.83 35.77 2ntk s MET 133 CO -0.03 -0.20 -0.04 0.08 1.05 0.00 0.00 175.02 175.88 2ntk s VAL 134 N 1.38 0.65 0.03 10.11 1.01 -1.26 -0.75 120.40 131.57 2ntk s VAL 134 Ca -0.07 -0.11 0.00 0.00 0.00 0.00 0.00 61.98 61.81 2ntk s VAL 134 Cb -0.12 -0.71 -0.02 0.00 0.00 0.00 0.00 36.38 35.53 2ntk s VAL 134 CO -0.05 0.28 -0.04 -0.94 0.00 0.00 0.00 175.10 174.36 2ntk s SER 135 N 1.44 0.34 0.25 3.32 1.04 0.11 -4.96 113.70 115.24 2ntk s SER 135 Ca -0.02 -0.56 -0.30 0.00 0.48 0.00 0.00 55.95 55.55 2ntk s SER 135 Cb -0.13 0.10 -0.10 0.00 0.10 0.00 0.00 66.02 65.99 2ntk s SER 135 CO -0.03 -0.32 1.44 -0.60 0.98 0.00 0.00 173.24 174.70 2ntk s ARG 136 N -1.76 4.27 -0.02 4.02 3.52 -1.26 -1.08 118.95 126.64 2ntk s ARG 136 Ca -0.13 2.30 -0.30 0.00 -0.13 0.00 0.00 55.73 57.47 2ntk s ARG 136 Cb -0.08 -3.11 -0.03 0.00 -1.56 0.00 0.00 34.95 30.17 2ntk s ARG 136 CO -0.02 -0.41 1.09 0.08 -0.81 0.00 0.00 175.30 175.23 2ntk s VAL 137 N -0.05 4.51 0.12 7.11 1.01 0.06 -4.87 120.40 128.29 2ntk s VAL 137 Ca 0.59 1.80 -0.35 0.00 0.00 0.00 0.00 61.98 64.02 2ntk s VAL 137 Cb -0.42 -4.16 -0.15 0.00 0.00 0.00 0.00 36.38 31.66 2ntk s VAL 137 CO 0.44 0.08 1.52 -2.65 0.00 0.00 0.00 175.10 174.49 2ntk n PRO 138 N 4.43 1.81 0.22 2.72 -0.02 -1.26 -4.74 135.00 138.16 2ntk n PRO 138 Ca 0.08 0.66 0.05 0.00 -2.02 0.00 0.00 63.50 62.27 2ntk n PRO 138 Cb 0.48 -2.39 0.48 0.00 -0.02 0.00 0.00 33.50 32.06 2ntk n PRO 138 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2ntk h GLU 139 N 5.66 0.00 0.00 -0.52 4.81 -1.98 -2.85 114.58 119.70 2ntk h GLU 139 Ca -0.46 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.77 2ntk h GLU 139 Cb 1.28 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.66 2ntk h GLU 139 CO 0.86 0.23 0.00 -0.85 -0.73 0.00 0.00 179.01 178.51 2ntk n GLU 140 N -4.20 0.06 -3.61 1.92 0.00 -1.26 -4.87 120.64 108.68 2ntk n GLU 140 Ca -0.02 0.06 -0.14 0.00 0.00 0.00 0.00 57.16 57.05 2ntk n GLU 140 Cb 0.29 -1.57 -0.07 0.00 0.00 0.00 0.00 31.44 30.09 2ntk n GLU 140 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.13 177.05 2ntk s THR 141 N -3.03 0.00 0.68 3.84 -1.32 -1.08 -5.09 115.64 109.65 2ntk s THR 141 Ca 0.13 0.00 -0.14 0.00 -1.21 0.00 0.00 61.69 60.47 2ntk s THR 141 Cb 0.17 -1.00 0.01 0.00 -1.51 0.00 0.00 72.50 70.17 2ntk s THR 141 CO 0.54 0.00 1.09 -2.84 -2.21 0.00 0.00 174.62 171.21 2ntk s PRO 142 N 0.05 2.75 0.17 7.08 0.02 -1.25 -4.32 135.00 139.50 2ntk s PRO 142 Ca -0.02 1.28 0.00 0.00 0.02 0.00 0.00 61.00 62.28 2ntk s PRO 142 Cb -0.04 -1.95 -0.04 0.00 0.02 0.00 0.00 34.50 32.48 2ntk s PRO 142 CO 0.02 -1.27 0.05 0.14 -0.33 0.00 0.00 177.00 175.61 2ntk s VAL 143 N -2.55 0.35 0.10 3.83 -7.23 -0.56 -1.52 120.40 112.82 2ntk s VAL 143 Ca 0.64 -1.96 -0.02 0.00 -1.81 0.00 0.00 61.98 58.83 2ntk s VAL 143 Cb -0.19 -2.21 -0.03 0.00 0.56 0.00 0.00 36.38 34.51 2ntk s VAL 143 CO 0.45 -0.35 0.05 -0.72 -0.31 0.00 0.00 175.10 174.23 2ntk s TYR 144 N -3.89 0.66 0.05 2.82 -0.85 -0.20 -1.15 117.35 114.79 2ntk s TYR 144 Ca 0.28 -1.10 -0.18 0.00 -0.52 0.00 0.00 57.07 55.55 2ntk s TYR 144 Cb 0.07 -0.39 0.04 0.00 0.38 0.00 0.00 41.96 42.06 2ntk s TYR 144 CO 0.05 -0.49 0.41 -1.50 -1.52 0.00 0.00 175.55 172.50 2ntk s ILE 145 N -3.98 0.06 0.26 -3.49 2.07 -0.46 -1.26 121.20 114.39 2ntk s ILE 145 Ca 0.16 -0.48 0.01 0.00 -1.41 0.00 0.00 60.65 58.94 2ntk s ILE 145 Cb 0.07 -0.98 -0.05 0.00 0.13 0.00 0.00 42.46 41.64 2ntk s ILE 145 CO -0.03 -0.26 0.12 -0.94 -1.91 0.00 0.00 174.94 171.91 2ntk s SER 146 N -2.10 1.08 0.19 4.50 1.04 -0.46 -1.49 113.70 116.45 2ntk s SER 146 Ca -0.04 -1.43 0.10 0.00 0.48 0.00 0.00 55.95 55.06 2ntk s SER 146 Cb -0.00 0.26 -0.08 0.00 0.10 0.00 0.00 66.02 66.29 2ntk s SER 146 CO -0.03 -0.79 1.36 0.71 0.98 0.00 0.00 173.24 175.46 2ntk h THR 147 N 2.39 1.40 -4.33 2.02 1.35 -1.21 -3.35 112.91 111.18 2ntk h THR 147 Ca -0.37 -2.93 -0.61 0.00 -0.55 0.00 0.00 66.41 61.95 2ntk h THR 147 Cb 1.25 2.66 -0.28 0.00 -1.73 0.00 0.00 68.15 70.05 2ntk h THR 147 CO 0.57 0.79 -0.85 -0.31 -0.25 0.00 0.00 175.52 175.46 2ntk s TYR 148 N -2.84 1.92 0.00 4.73 4.12 -0.55 -4.48 117.35 120.24 2ntk s TYR 148 Ca 0.02 -0.37 0.00 0.00 0.02 0.00 0.00 57.07 56.74 2ntk s TYR 148 Cb 0.09 -1.19 0.00 0.00 -1.52 0.00 0.00 41.96 39.34 2ntk s TYR 148 CO 0.79 0.03 0.00 0.39 0.02 0.00 0.00 175.55 176.78 2ntk n GLU 149 N 2.20 0.00 -1.68 -0.62 -0.58 -1.26 -4.40 120.64 114.30 2ntk n GLU 149 Ca -0.16 0.00 -0.39 0.00 -0.42 0.00 0.00 57.16 56.19 2ntk n GLU 149 Cb 0.53 0.00 -0.02 0.00 -0.57 0.00 0.00 31.44 31.38 2ntk n GLU 149 CO 0.00 0.00 0.00 0.94 -0.48 0.00 0.00 177.13 177.59 2ntk n GLN 150 N 0.00 4.13 -0.11 3.49 -0.06 -1.26 -4.69 117.38 118.88 2ntk n GLN 150 Ca 0.00 -2.87 -0.02 0.00 -2.00 0.00 0.00 57.00 52.11 2ntk n GLN 150 Cb 0.00 -2.67 0.02 0.00 -4.06 0.00 0.00 30.24 23.53 2ntk n GLN 150 CO 0.00 0.00 0.00 0.25 -0.20 0.00 0.00 177.06 177.11 2ntk n THR 151 N 2.46 1.02 -3.82 1.69 -2.24 -1.26 -1.36 114.28 110.77 2ntk n THR 151 Ca 0.68 -0.17 -0.12 0.00 -2.27 0.00 0.00 64.05 62.17 2ntk n THR 151 Cb 0.26 -0.86 -0.12 0.00 -2.10 0.00 0.00 70.33 67.51 2ntk n THR 151 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 2ntk s GLU 152 N -0.47 0.26 0.34 -0.78 2.12 -1.26 -4.97 118.70 113.94 2ntk s GLU 152 Ca 0.05 0.15 -0.28 0.00 0.36 0.00 0.00 54.97 55.25 2ntk s GLU 152 Cb 0.04 0.12 -0.12 0.00 0.26 0.00 0.00 34.13 34.44 2ntk s GLU 152 CO 0.01 -0.04 1.37 -2.30 -0.54 0.00 0.00 175.26 173.76 2ntk n PRO 153 N 2.72 2.30 -4.29 4.30 -0.02 -1.26 -4.71 135.00 134.04 2ntk n PRO 153 Ca -0.14 0.81 -0.18 0.00 -2.02 0.00 0.00 63.50 61.97 2ntk n PRO 153 Cb 0.58 -2.45 -0.15 0.00 -0.02 0.00 0.00 33.50 31.46 2ntk n PRO 153 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2ntk s ALA 154 N -0.90 0.66 0.49 3.55 0.00 -0.39 -4.94 121.76 120.23 2ntk s ALA 154 Ca 0.57 -0.30 -0.23 0.00 0.00 0.00 0.00 51.96 52.00 2ntk s ALA 154 Cb -0.55 -0.20 -0.06 0.00 0.00 0.00 0.00 23.12 22.31 2ntk s ALA 154 CO 0.60 0.14 1.25 0.00 0.00 0.00 0.00 175.76 177.75 2ntk s ALA 155 N -0.05 2.93 -0.15 0.00 0.00 -1.26 -1.04 121.76 122.19 2ntk s ALA 155 Ca 0.01 1.11 -0.10 0.00 0.00 0.00 0.00 51.96 52.98 2ntk s ALA 155 Cb -0.05 -3.46 0.05 0.00 0.00 0.00 0.00 23.12 19.66 2ntk s ALA 155 CO -0.00 -0.96 0.38 -0.08 0.00 0.00 0.00 175.76 175.10 2ntk s THR 156 N -1.43 -0.02 -1.09 0.00 -1.32 -0.58 -4.85 115.64 106.35 2ntk s THR 156 Ca 0.66 0.06 -0.19 0.00 -1.21 0.00 0.00 61.69 61.02 2ntk s THR 156 Cb -0.34 -0.55 0.10 0.00 -1.51 0.00 0.00 72.50 70.21 2ntk s THR 156 CO 0.41 0.02 1.42 -0.70 -2.21 0.00 0.00 174.62 173.56 2ntk s GLU 157 N 0.88 3.79 -0.54 7.08 2.12 -1.26 -3.92 118.70 126.84 2ntk s GLU 157 Ca -0.05 -1.80 -0.25 0.00 0.36 0.00 0.00 54.97 53.22 2ntk s GLU 157 Cb -0.06 -5.21 0.04 0.00 0.26 0.00 0.00 34.13 29.15 2ntk s GLU 157 CO -0.07 -2.00 0.98 0.12 -0.54 0.00 0.00 175.26 173.75 2ntk s PHE 158 N 3.45 2.78 -0.13 5.30 5.36 -1.26 -5.02 117.98 128.46 2ntk s PHE 158 Ca 0.43 0.11 -0.14 0.00 -0.96 0.00 0.00 56.93 56.37 2ntk s PHE 158 Cb -0.01 -4.12 -0.05 0.00 -0.34 0.00 0.00 43.02 38.50 2ntk s PHE 158 CO -0.04 -1.35 0.32 -1.59 -1.46 0.00 0.00 175.22 171.10 2ntk s LYS 159 N 4.07 4.17 0.00 10.12 -2.85 -1.26 -4.85 119.74 129.14 2ntk s LYS 159 Ca 0.33 0.15 0.00 0.00 -1.00 0.00 0.00 55.97 55.46 2ntk s LYS 159 Cb -0.11 -3.39 0.00 0.00 -2.06 0.00 0.00 37.83 32.27 2ntk s LYS 159 CO 0.21 0.32 0.00 0.00 0.10 0.00 0.00 175.35 175.98 2ntk n ALA 160 N 3.28 0.00 -0.19 0.59 0.00 -1.26 -4.72 120.51 118.21 2ntk n ALA 160 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.32 2ntk n ALA 160 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.97 2ntk n ALA 160 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ntk n GLY 161 N -0.02 1.10 3.66 0.00 0.00 -1.26 -4.64 105.19 104.03 2ntk n GLY 161 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 2ntk n GLY 161 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2ntk s SER 162 N -0.60 -0.39 0.37 1.61 1.04 -1.26 -4.96 113.70 109.51 2ntk s SER 162 Ca 0.00 -0.34 0.10 0.00 0.48 0.00 0.00 55.95 56.19 2ntk s SER 162 Cb 0.00 0.67 0.72 0.00 0.10 0.00 0.00 66.02 67.51 2ntk s SER 162 CO 0.00 -1.18 1.86 1.55 0.98 0.00 0.00 173.24 176.45 2ntk h PRO 163 N 2.01 0.17 -0.19 4.02 0.13 -1.88 -1.35 132.00 134.91 2ntk h PRO 163 Ca -0.26 -0.05 -0.00 0.00 -0.87 0.00 0.00 66.00 64.82 2ntk h PRO 163 Cb 1.28 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 32.38 2ntk h PRO 163 CO 0.30 0.41 0.10 0.93 -0.23 0.00 0.00 178.00 179.51 2ntk h GLU 164 N 0.15 0.27 -0.62 0.86 3.07 -1.90 -0.90 114.58 115.51 2ntk h GLU 164 Ca 0.03 -0.03 -0.09 0.00 -0.50 0.00 0.00 59.36 58.76 2ntk h GLU 164 Cb 0.52 -0.05 -0.02 0.00 -0.84 0.00 0.00 28.75 28.35 2ntk h GLU 164 CO 0.04 0.27 0.02 0.93 -1.40 0.00 0.00 179.01 178.86 2ntk h GLU 165 N 0.20 1.08 -0.43 2.33 5.08 -1.90 -2.13 114.58 118.82 2ntk h GLU 165 Ca 0.07 -0.33 -0.02 0.00 -1.00 0.00 0.00 59.36 58.07 2ntk h GLU 165 Cb 0.08 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.21 2ntk h GLU 165 CO -0.01 1.04 0.20 0.00 -1.00 0.00 0.00 179.01 179.24 2ntk h ALA 166 N 1.01 0.55 -0.57 3.43 0.00 -1.05 -0.27 119.26 122.37 2ntk h ALA 166 Ca 0.18 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 2ntk h ALA 166 Cb 0.54 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 2ntk h ALA 166 CO 0.03 0.12 0.28 0.00 0.00 0.00 0.00 179.25 179.68 2ntk h ALA 167 N 1.04 0.73 -0.52 0.00 0.00 -1.05 -2.52 119.26 116.93 2ntk h ALA 167 Ca 0.15 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 2ntk h ALA 167 Cb 0.14 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 2ntk h ALA 167 CO -0.02 0.28 0.24 0.93 0.00 0.00 0.00 179.25 180.69 2ntk h GLU 168 N 0.77 0.76 -0.31 0.00 4.39 -1.16 -2.35 114.58 116.67 2ntk h GLU 168 Ca 0.20 -0.12 -0.00 0.00 0.34 0.00 0.00 59.36 59.77 2ntk h GLU 168 Cb 0.10 -0.13 -0.02 0.00 -0.10 0.00 0.00 28.75 28.61 2ntk h GLU 168 CO -0.03 0.64 0.19 0.35 -1.16 0.00 0.00 179.01 179.01 2ntk h PHE 169 N 0.70 0.41 0.00 4.33 3.57 -0.86 0.23 116.94 125.32 2ntk h PHE 169 Ca 0.18 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.68 2ntk h PHE 169 Cb 0.14 -0.14 -0.00 0.00 2.79 0.00 0.00 35.95 38.75 2ntk h PHE 169 CO -0.00 0.29 -0.00 0.97 -2.23 0.00 0.00 178.31 177.34 2ntk h ILE 170 N 0.41 0.01 0.01 1.41 2.10 -1.40 0.40 117.51 120.44 2ntk h ILE 170 Ca 0.11 -0.53 -0.09 0.00 1.08 0.00 0.00 64.86 65.44 2ntk h ILE 170 Cb -0.00 1.52 -0.01 0.00 -1.09 0.00 0.00 36.82 37.23 2ntk h ILE 170 CO -0.02 0.00 -0.49 0.25 -1.08 0.00 0.00 178.15 176.82 2ntk h LEU 171 N 0.00 0.03 -0.25 2.19 5.85 -0.80 -3.44 115.31 118.88 2ntk h LEU 171 Ca -0.00 -0.83 0.00 0.00 0.84 0.00 0.00 57.88 57.89 2ntk h LEU 171 Cb 0.52 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.54 2ntk h LEU 171 CO 0.00 1.19 0.00 0.29 -0.34 0.00 0.00 178.44 179.58 2ntk n LYS 172 N -4.52 0.42 -2.62 1.25 5.02 0.74 -4.68 118.16 113.77 2ntk n LYS 172 Ca -0.18 -0.13 -0.25 0.00 -2.02 0.00 0.00 58.31 55.74 2ntk n LYS 172 Cb 0.57 -0.54 0.03 0.00 -0.02 0.00 0.00 35.03 35.07 2ntk n LYS 172 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 2ntk s GLY 173 N -0.10 1.61 0.00 0.72 0.00 0.14 -4.11 107.32 105.58 2ntk s GLY 173 Ca 0.00 -0.88 0.00 0.00 0.00 0.00 0.00 44.72 43.84 2ntk s GLY 173 CO 0.00 -0.64 0.00 0.61 0.00 0.00 0.00 173.10 173.07 2ntk n GLY 174 N -2.40 2.19 0.18 0.20 0.00 -1.26 -1.08 105.19 103.03 2ntk n GLY 174 Ca 0.04 -0.06 0.14 0.00 0.00 0.00 0.00 46.02 46.13 2ntk n GLY 174 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 2ntk h GLU 175 N 0.00 0.00 0.00 1.61 9.09 -1.93 -2.80 114.58 120.55 2ntk h GLU 175 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 2ntk h GLU 175 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.10 2ntk h GLU 175 CO 0.00 0.00 0.00 0.74 0.05 0.00 0.00 179.01 179.80 2ntk h PHE 176 N 0.00 0.00 0.00 2.06 -1.00 -1.38 -2.87 116.94 113.75 2ntk h PHE 176 Ca 0.00 0.00 -0.01 0.00 2.81 0.00 0.00 57.97 60.77 2ntk h PHE 176 Cb 0.43 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 39.99 2ntk h PHE 176 CO 0.00 0.00 -0.05 0.00 -1.61 0.00 0.00 178.31 176.65 2ntk h ALA 177 N 2.10 1.74 0.00 2.45 0.00 -1.20 -2.23 119.26 122.12 2ntk h ALA 177 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2ntk h ALA 177 Cb 0.57 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.35 2ntk h ALA 177 CO 0.00 0.06 -0.14 0.00 0.00 0.00 0.00 179.25 179.17 2ntk h ALA 178 N 1.95 0.91 -2.28 0.00 0.00 -1.73 -3.44 119.26 114.67 2ntk h ALA 178 Ca -0.00 0.00 -0.58 0.00 0.00 0.00 0.00 54.91 54.33 2ntk h ALA 178 Cb 0.10 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 17.82 2ntk h ALA 178 CO 0.01 0.00 0.51 -0.06 0.00 0.00 0.00 179.25 179.71 2ntk s PHE 179 N -3.13 3.39 0.77 0.00 0.08 -0.84 -4.86 117.98 113.39 2ntk s PHE 179 Ca 0.09 1.30 -0.11 0.00 0.12 0.00 0.00 56.93 58.33 2ntk s PHE 179 Cb 0.12 -3.09 0.05 0.00 -0.57 0.00 0.00 43.02 39.53 2ntk s PHE 179 CO 0.63 -0.33 1.10 0.95 -0.10 0.00 0.00 175.22 177.47 2ntk s THR 180 N 2.53 3.16 -1.17 0.64 -4.23 -0.60 -4.51 115.64 111.44 2ntk s THR 180 Ca 0.40 0.38 -0.07 0.00 -1.18 0.00 0.00 61.69 61.21 2ntk s THR 180 Cb -0.16 -3.21 0.01 0.00 1.34 0.00 0.00 72.50 70.48 2ntk s THR 180 CO 0.10 -0.49 1.02 1.41 -0.54 0.00 0.00 174.62 176.12 2ntk n HIS 181 N -3.29 -2.47 -1.99 3.99 8.25 -1.26 -4.67 115.22 113.77 2ntk n HIS 181 Ca 0.07 0.88 -0.40 0.00 -0.26 0.00 0.00 57.72 58.01 2ntk n HIS 181 Cb 0.57 -4.53 -0.00 0.00 1.12 0.00 0.00 29.99 27.14 2ntk n HIS 181 CO 0.00 0.00 0.00 -2.14 0.64 0.00 0.00 176.34 174.84 2ntk s PRO 182 N -6.07 3.95 0.12 -0.41 0.02 -1.26 -1.61 135.00 129.75 2ntk s PRO 182 Ca 0.47 2.24 0.00 0.00 0.02 0.00 0.00 61.00 63.73 2ntk s PRO 182 Cb -0.21 -2.78 0.00 0.00 0.02 0.00 0.00 34.50 31.54 2ntk s PRO 182 CO 0.63 -0.53 0.00 0.28 -0.33 0.00 0.00 177.00 177.05 2ntk n VAL 183 N 0.14 1.04 -3.63 3.83 0.31 0.15 -4.86 118.33 115.31 2ntk n VAL 183 Ca 0.03 0.34 -0.12 0.00 -0.01 0.00 0.00 64.34 64.59 2ntk n VAL 183 Cb 0.43 -1.42 -0.05 0.00 -0.91 0.00 0.00 33.84 31.88 2ntk n VAL 183 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 2ntk s THR 184 N -1.97 0.05 0.08 2.52 -1.32 -1.16 -4.03 115.64 109.81 2ntk s THR 184 Ca 0.00 -0.45 -0.02 0.00 -1.21 0.00 0.00 61.69 60.01 2ntk s THR 184 Cb 0.00 -1.05 -0.04 0.00 -1.51 0.00 0.00 72.50 69.90 2ntk s THR 184 CO 0.00 -0.25 0.02 0.00 -2.21 0.00 0.00 174.62 172.18 2ntk s ALA 185 N -3.10 0.53 0.15 11.08 0.00 -0.50 0.04 121.76 129.96 2ntk s ALA 185 Ca -0.01 -1.22 -0.13 0.00 0.00 0.00 0.00 51.96 50.60 2ntk s ALA 185 Cb 0.00 0.45 0.01 0.00 0.00 0.00 0.00 23.12 23.59 2ntk s ALA 185 CO -0.07 -0.42 0.35 0.00 0.00 0.00 0.00 175.76 175.62 2ntk s ALA 186 N -3.95 -0.48 0.15 0.00 0.00 0.10 -1.07 121.76 116.51 2ntk s ALA 186 Ca 0.11 -0.49 -0.23 0.00 0.00 0.00 0.00 51.96 51.35 2ntk s ALA 186 Cb 0.08 0.75 0.07 0.00 0.00 0.00 0.00 23.12 24.02 2ntk s ALA 186 CO -0.07 -0.66 0.63 0.00 0.00 0.00 0.00 175.76 175.66 2ntk s ALA 187 N -3.89 -1.61 -0.04 0.00 0.00 -0.39 -0.21 121.76 115.63 2ntk s ALA 187 Ca 0.10 0.51 0.04 0.00 0.00 0.00 0.00 51.96 52.60 2ntk s ALA 187 Cb 0.02 0.85 -0.00 0.00 0.00 0.00 0.00 23.12 23.99 2ntk s ALA 187 CO -0.05 -0.77 -0.15 0.00 0.00 0.00 0.00 175.76 174.79 2ntk s ALA 188 N -3.70 1.32 -0.00 0.00 0.00 -0.46 -1.85 121.76 117.08 2ntk s ALA 188 Ca 0.02 -0.57 0.03 0.00 0.00 0.00 0.00 51.96 51.44 2ntk s ALA 188 Cb -0.01 -0.46 -0.01 0.00 0.00 0.00 0.00 23.12 22.64 2ntk s ALA 188 CO -0.12 0.23 -0.10 0.12 0.00 0.00 0.00 175.76 175.89 2ntk s PHE 189 N 0.13 0.87 -0.24 0.00 5.36 0.08 -2.06 117.98 122.13 2ntk s PHE 189 Ca -0.05 -0.19 -0.01 0.00 -0.96 0.00 0.00 56.93 55.73 2ntk s PHE 189 Cb -0.11 -0.55 0.07 0.00 -0.34 0.00 0.00 43.02 42.09 2ntk s PHE 189 CO 0.02 -0.01 0.01 1.21 -1.46 0.00 0.00 175.22 174.99 2ntk s ASN 190 N -0.37 3.58 0.00 6.13 3.84 0.10 -1.04 114.94 127.19 2ntk s ASN 190 Ca 0.03 -1.18 0.14 0.00 0.21 0.00 0.00 52.86 52.06 2ntk s ASN 190 Cb -0.04 -0.92 0.52 0.00 -0.55 0.00 0.00 41.25 40.26 2ntk s ASN 190 CO -0.00 -0.30 1.39 -0.90 -2.79 0.00 0.00 177.10 174.49 2ntk n ASP 191 N 4.83 1.45 0.00 -4.21 5.68 -1.26 -1.54 116.55 121.50 2ntk n ASP 191 Ca -0.08 -1.83 0.00 0.00 -0.50 0.00 0.00 54.79 52.37 2ntk n ASP 191 Cb 0.45 -0.14 0.00 0.00 -1.14 0.00 0.00 41.12 40.28 2ntk n ASP 191 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2ntk n GLY 192 N 1.01 2.08 0.99 6.12 0.00 -1.26 -4.89 105.19 109.24 2ntk n GLY 192 Ca 0.13 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.22 2ntk n GLY 192 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2ntk n GLU 193 N -0.21 3.16 0.00 1.61 1.02 -1.26 -5.07 120.64 119.89 2ntk n GLU 193 Ca 0.00 -2.62 0.00 0.00 -0.02 0.00 0.00 57.16 54.52 2ntk n GLU 193 Cb 0.00 -1.69 0.00 0.00 -0.02 0.00 0.00 31.44 29.73 2ntk n GLU 193 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2ntk n GLY 194 N 0.16 3.37 3.69 0.62 0.00 -1.26 -5.05 105.19 106.72 2ntk n GLY 194 Ca 0.19 -1.93 -0.42 0.00 0.00 0.00 0.00 46.02 43.86 2ntk n GLY 194 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2ntk s TRP 195 N -2.87 3.55 0.05 1.61 0.52 -1.26 -4.25 118.94 116.30 2ntk s TRP 195 Ca 0.00 1.61 0.09 0.00 0.02 0.00 0.00 56.10 57.82 2ntk s TRP 195 Cb 0.00 -3.18 -0.03 0.00 -1.15 0.00 0.00 33.47 29.11 2ntk s TRP 195 CO 0.00 -0.20 -0.24 -0.80 0.02 0.00 0.00 176.95 175.73 2ntk s ASN 196 N 1.08 3.36 0.22 2.95 0.01 -0.20 -4.92 114.94 117.44 2ntk s ASN 196 Ca 0.50 -0.56 0.09 0.00 -0.71 0.00 0.00 52.86 52.17 2ntk s ASN 196 Cb -0.19 -0.37 -0.04 0.00 0.41 0.00 0.00 41.25 41.05 2ntk s ASN 196 CO 0.21 0.25 -0.00 -0.76 -1.51 0.00 0.00 177.10 175.29 2ntk s LEU 197 N -1.38 3.24 0.08 0.60 1.43 -1.26 -0.74 118.68 120.65 2ntk s LEU 197 Ca 0.13 -0.53 -0.26 0.00 -1.03 0.00 0.00 54.13 52.44 2ntk s LEU 197 Cb -0.10 -1.83 0.08 0.00 0.03 0.00 0.00 46.19 44.37 2ntk s LEU 197 CO 0.03 0.04 0.69 0.00 0.23 0.00 0.00 176.35 177.34 2ntk s ALA 198 N -2.03 -1.69 0.12 4.21 0.00 -0.77 -4.85 121.76 116.75 2ntk s ALA 198 Ca 0.29 0.76 0.04 0.00 0.00 0.00 0.00 51.96 53.05 2ntk s ALA 198 Cb -0.08 0.60 -0.04 0.00 0.00 0.00 0.00 23.12 23.60 2ntk s ALA 198 CO 0.19 -0.68 -0.10 0.95 0.00 0.00 0.00 175.76 176.13 2ntk s THR 199 N -3.15 1.01 -0.03 0.00 -4.23 -1.26 -1.26 115.64 106.71 2ntk s THR 199 Ca 0.00 -1.86 -0.04 0.00 -1.18 0.00 0.00 61.69 58.61 2ntk s THR 199 Cb -0.01 -1.62 0.01 0.00 1.34 0.00 0.00 72.50 72.22 2ntk s THR 199 CO -0.08 -0.68 0.11 -0.13 -0.54 0.00 0.00 174.62 173.30 2ntk s ARG 200 N -3.34 0.18 0.31 3.99 1.81 -0.23 -4.96 118.95 116.71 2ntk s ARG 200 Ca 0.11 0.06 0.09 0.00 -1.72 0.00 0.00 55.73 54.27 2ntk s ARG 200 Cb 0.01 0.08 -0.05 0.00 -0.45 0.00 0.00 34.95 34.54 2ntk s ARG 200 CO -0.00 -0.03 -0.01 -1.21 -0.68 0.00 0.00 175.30 173.37 2ntk s GLU 201 N -0.18 2.10 0.00 3.54 0.41 -1.26 -1.41 118.70 121.90 2ntk s GLU 201 Ca -0.02 -1.66 0.09 0.00 -0.41 0.00 0.00 54.97 52.97 2ntk s GLU 201 Cb -0.02 -1.98 0.51 0.00 -1.78 0.00 0.00 34.13 30.86 2ntk s GLU 201 CO 0.00 0.21 0.96 -1.33 -0.49 0.00 0.00 175.26 174.62