#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gt3 s GLU 4 N 0.00 0.74 -0.01 5.31 1.03 -1.26 -5.16 118.70 119.35 1gt3 s GLU 4 Ca 0.00 -0.31 0.03 0.00 0.03 0.00 0.00 54.97 54.72 1gt3 s GLU 4 Cb 0.00 0.33 -0.00 0.00 -0.80 0.00 0.00 34.13 33.65 1gt3 s GLU 4 CO 0.00 -0.22 -0.10 -1.21 -1.33 0.00 0.00 175.26 172.40 1gt3 s GLU 5 N -1.84 0.85 0.60 -4.83 2.02 -1.26 -5.13 118.70 109.11 1gt3 s GLU 5 Ca -0.10 -0.34 -0.19 0.00 0.02 0.00 0.00 54.97 54.36 1gt3 s GLU 5 Cb -0.03 -0.82 -0.05 0.00 0.10 0.00 0.00 34.13 33.33 1gt3 s GLU 5 CO 0.01 0.18 1.01 0.00 0.02 0.00 0.00 175.26 176.49 1gt3 n ALA 6 N 2.98 0.33 -1.78 5.21 0.00 -1.26 -4.90 120.51 121.09 1gt3 n ALA 6 Ca -0.15 0.02 -0.41 0.00 0.00 0.00 0.00 53.44 52.90 1gt3 n ALA 6 Cb 0.56 -2.14 -0.01 0.00 0.00 0.00 0.00 19.45 17.86 1gt3 n ALA 6 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1gt3 s GLU 7 N -2.78 4.24 -0.24 0.00 2.12 -1.26 -4.93 118.70 115.86 1gt3 s GLU 7 Ca 0.76 2.38 -0.29 0.00 0.36 0.00 0.00 54.97 58.17 1gt3 s GLU 7 Cb -0.42 -3.03 -0.01 0.00 0.26 0.00 0.00 34.13 30.93 1gt3 s GLU 7 CO 0.47 -0.36 1.34 -0.65 -0.54 0.00 0.00 175.26 175.52 1gt3 s GLN 8 N -1.82 4.01 0.02 4.30 -0.21 -1.26 -4.95 119.66 119.76 1gt3 s GLN 8 Ca 0.51 1.47 0.02 0.00 0.02 0.00 0.00 55.36 57.38 1gt3 s GLN 8 Cb -0.43 -3.86 -0.02 0.00 1.00 0.00 0.00 33.01 29.70 1gt3 s GLN 8 CO 0.57 -1.00 -0.06 -0.80 -2.12 0.00 0.00 175.29 171.88 1gt3 s ASN 9 N 2.72 0.72 0.37 5.90 0.01 -1.26 -5.03 114.94 118.36 1gt3 s ASN 9 Ca 0.58 -0.35 0.06 0.00 -0.71 0.00 0.00 52.86 52.45 1gt3 s ASN 9 Cb -0.20 -0.01 0.73 0.00 0.41 0.00 0.00 41.25 42.18 1gt3 s ASN 9 CO 0.21 -0.09 1.94 0.25 -1.51 0.00 0.00 177.10 177.90 1gt3 h LEU 10 N 5.17 0.42 -0.98 0.60 5.85 -1.96 -0.16 115.31 124.24 1gt3 h LEU 10 Ca -0.32 -0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.34 1gt3 h LEU 10 Cb 1.20 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 42.12 1gt3 h LEU 10 CO 0.45 0.45 0.00 0.28 -0.34 0.00 0.00 178.44 179.28 1gt3 h SER 11 N 0.45 0.00 1.08 1.25 0.02 -1.96 -1.96 113.55 112.43 1gt3 h SER 11 Ca 0.11 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.06 1gt3 h SER 11 Cb 0.22 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.76 1gt3 h SER 11 CO 0.00 0.00 0.00 -0.08 -1.14 0.00 0.00 176.83 175.61 1gt3 h GLU 12 N 0.00 0.00 0.00 3.45 4.57 -1.38 -2.60 114.58 118.63 1gt3 h GLU 12 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1gt3 h GLU 12 Cb 0.51 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.10 1gt3 h GLU 12 CO 0.00 0.00 -0.05 -0.07 -1.18 0.00 0.00 179.01 177.71 1gt3 h LEU 13 N 0.00 0.00-10.07 1.64 4.07 -1.36 -3.46 115.31 106.13 1gt3 h LEU 13 Ca 0.00 -0.01 -0.53 0.00 0.08 0.00 0.00 57.88 57.42 1gt3 h LEU 13 Cb 0.54 0.00 0.11 0.00 1.08 0.00 0.00 40.66 42.39 1gt3 h LEU 13 CO 0.00 0.00 0.51 -0.44 -1.08 0.00 0.00 178.44 177.44 1gt3 s SER 14 N -5.06 5.32 0.00 -0.43 0.01 -0.98 -4.89 113.70 107.68 1gt3 s SER 14 Ca 0.09 2.49 0.00 0.00 1.31 0.00 0.00 55.95 59.84 1gt3 s SER 14 Cb 0.10 -2.61 0.00 0.00 0.21 0.00 0.00 66.02 63.72 1gt3 s SER 14 CO 0.63 -1.51 0.00 0.61 0.41 0.00 0.00 173.24 173.38 1gt3 n GLY 15 N 0.59 0.97 3.71 3.44 0.00 -0.24 -4.99 105.19 108.67 1gt3 n GLY 15 Ca 0.12 -1.90 -0.42 0.00 0.00 0.00 0.00 46.02 43.82 1gt3 n GLY 15 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1gt3 s PRO 16 N -1.93 4.36 0.09 1.61 0.04 -1.26 -1.80 135.00 136.11 1gt3 s PRO 16 Ca 0.00 1.93 0.05 0.00 0.04 0.00 0.00 61.00 63.01 1gt3 s PRO 16 Cb 0.00 -3.34 -0.03 0.00 0.04 0.00 0.00 34.50 31.17 1gt3 s PRO 16 CO 0.00 -0.38 -0.13 -1.58 0.04 0.00 0.00 177.00 174.95 1gt3 s TRP 17 N 1.28 1.22 0.04 0.56 0.52 -0.85 -1.40 118.94 120.31 1gt3 s TRP 17 Ca 0.62 -0.53 0.04 0.00 0.02 0.00 0.00 56.10 56.25 1gt3 s TRP 17 Cb -0.33 -0.67 -0.02 0.00 -1.15 0.00 0.00 33.47 31.30 1gt3 s TRP 17 CO 0.29 0.07 -0.13 1.03 0.02 0.00 0.00 176.95 178.23 1gt3 s ARG 18 N -2.24 0.82 0.16 4.98 1.81 0.99 -3.40 118.95 122.09 1gt3 s ARG 18 Ca 0.03 -0.74 -0.29 0.00 -1.72 0.00 0.00 55.73 53.00 1gt3 s ARG 18 Cb -0.07 -0.80 -0.07 0.00 -0.45 0.00 0.00 34.95 33.56 1gt3 s ARG 18 CO 0.02 0.19 0.92 0.99 -0.68 0.00 0.00 175.30 176.74 1gt3 s THR 19 N -0.92 4.33 -0.06 0.02 2.01 -1.26 -0.96 115.64 118.79 1gt3 s THR 19 Ca -0.00 2.02 -0.09 0.00 0.31 0.00 0.00 61.69 63.92 1gt3 s THR 19 Cb -0.08 -4.30 -0.04 0.00 0.01 0.00 0.00 72.50 68.10 1gt3 s THR 19 CO 0.01 0.42 -0.19 0.52 -0.69 0.00 0.00 174.62 174.69 1gt3 n VAL 20 N 2.14 1.29 -4.07 3.82 0.31 0.12 -4.91 118.33 117.03 1gt3 n VAL 20 Ca -0.01 0.19 -0.13 0.00 -0.01 0.00 0.00 64.34 64.39 1gt3 n VAL 20 Cb 0.48 -1.95 -0.12 0.00 -0.91 0.00 0.00 33.84 31.34 1gt3 n VAL 20 CO 0.00 0.00 0.00 -0.31 -1.32 0.00 0.00 176.83 175.20 1gt3 s TYR 21 N -2.45 0.59 -0.05 3.52 2.02 -1.10 -4.99 117.35 114.88 1gt3 s TYR 21 Ca -0.16 -0.41 -0.02 0.00 -0.37 0.00 0.00 57.07 56.11 1gt3 s TYR 21 Cb 0.03 -0.36 0.04 0.00 -0.40 0.00 0.00 41.96 41.27 1gt3 s TYR 21 CO 0.23 -0.07 0.10 0.42 -1.57 0.00 0.00 175.55 174.66 1gt3 s ILE 22 N -1.11 -0.09 0.18 2.71 1.01 -1.26 -0.92 121.20 121.73 1gt3 s ILE 22 Ca -0.08 0.24 0.09 0.00 0.00 0.00 0.00 60.65 60.90 1gt3 s ILE 22 Cb -0.08 -0.19 -0.04 0.00 0.01 0.00 0.00 42.46 42.16 1gt3 s ILE 22 CO 0.00 0.10 -0.13 -0.83 0.00 0.00 0.00 174.94 174.08 1gt3 s GLY 23 N 1.37 1.73 -0.04 6.18 0.00 0.46 -4.96 107.32 112.06 1gt3 s GLY 23 Ca -0.06 -1.51 -0.06 0.00 0.00 0.00 0.00 44.72 43.09 1gt3 s GLY 23 CO -0.05 -1.53 0.14 -0.45 0.00 0.00 0.00 173.10 171.22 1gt3 s SER 24 N -2.79 -0.10 0.46 1.64 0.15 -1.26 -1.58 113.70 110.21 1gt3 s SER 24 Ca 0.24 0.15 0.25 0.00 0.70 0.00 0.00 55.95 57.29 1gt3 s SER 24 Cb -0.09 0.28 0.92 0.00 -1.71 0.00 0.00 66.02 65.42 1gt3 s SER 24 CO 0.14 -0.15 1.82 0.71 1.20 0.00 0.00 173.24 176.96 1gt3 h THR 25 N 4.72 0.41 -3.71 6.45 1.35 -1.65 -3.37 112.91 117.12 1gt3 h THR 25 Ca -0.27 -1.04 -0.67 0.00 -0.55 0.00 0.00 66.41 63.88 1gt3 h THR 25 Cb 1.20 1.77 -0.39 0.00 -1.73 0.00 0.00 68.15 69.00 1gt3 h THR 25 CO 0.41 0.17 -0.72 0.21 -0.25 0.00 0.00 175.52 175.34 1gt3 s ASN 26 N -6.10 4.76 0.45 5.36 3.84 -1.26 -5.00 114.94 116.99 1gt3 s ASN 26 Ca 0.01 -1.98 0.21 0.00 0.21 0.00 0.00 52.86 51.31 1gt3 s ASN 26 Cb 0.09 -1.63 1.18 0.00 -0.55 0.00 0.00 41.25 40.34 1gt3 s ASN 26 CO 0.62 -0.36 1.87 1.55 -2.79 0.00 0.00 177.10 177.99 1gt3 h PRO 27 N 7.69 0.30 -0.15 0.43 0.13 -2.00 -2.01 132.00 136.39 1gt3 h PRO 27 Ca -0.08 -0.02 0.04 0.00 -0.87 0.00 0.00 66.00 65.07 1gt3 h PRO 27 Cb 1.03 -0.07 -0.01 0.00 0.13 0.00 0.00 31.00 32.08 1gt3 h PRO 27 CO 0.52 0.20 0.11 1.05 -0.23 0.00 0.00 178.00 179.65 1gt3 h GLU 28 N 0.31 0.00 0.00 0.86 4.11 -1.95 -1.86 114.58 116.04 1gt3 h GLU 28 Ca 0.45 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.87 1gt3 h GLU 28 Cb 1.28 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.53 1gt3 h GLU 28 CO -0.14 0.00 -0.05 0.87 0.07 0.00 0.00 179.01 179.76 1gt3 h LYS 29 N 0.00 0.00 -0.01 1.06 1.79 -1.76 -3.21 116.57 114.44 1gt3 h LYS 29 Ca 0.07 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.54 1gt3 h LYS 29 Cb 0.28 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.93 1gt3 h LYS 29 CO -0.00 0.05 0.00 0.44 -1.08 0.00 0.00 179.45 178.86 1gt3 n ILE 30 N -3.19 0.64 -1.66 1.86 -5.35 -0.75 -0.98 119.36 109.93 1gt3 n ILE 30 Ca 0.00 -0.82 -0.29 0.00 -0.27 0.00 0.00 62.75 61.37 1gt3 n ILE 30 Cb 0.30 0.69 0.11 0.00 -1.74 0.00 0.00 39.64 39.00 1gt3 n ILE 30 CO 0.00 0.00 0.00 -1.10 -1.76 0.00 0.00 176.55 173.69 1gt3 s GLN 31 N -0.65 1.65 0.20 6.28 -0.21 -0.93 -4.62 119.66 121.39 1gt3 s GLN 31 Ca 0.01 0.32 -0.32 0.00 0.02 0.00 0.00 55.36 55.39 1gt3 s GLN 31 Cb 0.00 -1.90 -0.15 0.00 1.00 0.00 0.00 33.01 31.97 1gt3 s GLN 31 CO 0.01 -1.85 1.19 -1.91 -2.12 0.00 0.00 175.29 170.61 1gt3 n GLU 32 N -3.53 1.37 -0.97 2.91 2.13 -1.26 0.75 120.64 122.03 1gt3 n GLU 32 Ca 0.07 0.49 0.00 0.00 0.66 0.00 0.00 57.16 58.38 1gt3 n GLU 32 Cb 0.59 -2.00 0.00 0.00 0.27 0.00 0.00 31.44 30.30 1gt3 n GLU 32 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1gt3 n ASN 33 N 1.94 -3.42 -4.79 4.31 3.02 -1.25 -5.01 115.26 110.06 1gt3 n ASN 33 Ca 0.14 0.00 -0.36 0.00 -0.03 0.00 0.00 54.58 54.32 1gt3 n ASN 33 Cb 0.27 -1.43 -0.06 0.00 -0.61 0.00 0.00 39.78 37.95 1gt3 n ASN 33 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1gt3 s GLY 34 N -2.00 2.70 0.56 7.41 0.00 0.23 -4.86 107.32 111.36 1gt3 s GLY 34 Ca 0.00 0.46 0.37 0.00 0.00 0.00 0.00 44.72 45.54 1gt3 s GLY 34 CO 0.00 0.86 2.10 -0.56 0.00 0.00 0.00 173.10 175.50 1gt3 h PRO 35 N 2.96 0.00 -0.43 2.90 0.13 -1.82 -3.08 132.00 132.66 1gt3 h PRO 35 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1gt3 h PRO 35 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1gt3 h PRO 35 CO 0.64 0.00 0.00 1.19 -0.23 0.00 0.00 178.00 179.60 1gt3 n PHE 36 N -2.97 1.07 -2.21 1.56 3.01 -0.15 -4.64 117.46 113.13 1gt3 n PHE 36 Ca -0.01 -0.68 -0.42 0.00 1.01 0.00 0.00 57.45 57.36 1gt3 n PHE 36 Cb 0.19 -0.23 0.00 0.00 -0.01 0.00 0.00 39.48 39.44 1gt3 n PHE 36 CO 0.00 0.00 0.00 -2.13 1.01 0.00 0.00 176.76 175.64 1gt3 n ARG 37 N 0.38 3.86 -3.34 -1.08 0.63 -1.16 -4.81 116.66 111.14 1gt3 n ARG 37 Ca 0.21 -3.45 -0.38 0.00 -0.92 0.00 0.00 57.85 53.30 1gt3 n ARG 37 Cb 0.79 -2.85 -0.07 0.00 0.45 0.00 0.00 32.46 30.77 1gt3 n ARG 37 CO 0.00 0.00 0.00 0.95 -2.51 0.00 0.00 177.63 176.07 1gt3 s THR 38 N 0.09 5.17 -0.46 5.15 -4.23 -1.26 -4.58 115.64 115.52 1gt3 s THR 38 Ca 0.44 0.80 -0.18 0.00 -1.18 0.00 0.00 61.69 61.58 1gt3 s THR 38 Cb 0.12 -3.77 0.05 0.00 1.34 0.00 0.00 72.50 70.24 1gt3 s THR 38 CO -0.02 0.23 0.50 -0.31 -0.54 0.00 0.00 174.62 174.48 1gt3 s TYR 39 N 1.38 3.14 0.57 3.99 1.51 -0.30 -4.80 117.35 122.84 1gt3 s TYR 39 Ca 0.21 -0.56 -0.19 0.00 -1.01 0.00 0.00 57.07 55.52 1gt3 s TYR 39 Cb -0.15 -3.20 -0.05 0.00 -0.11 0.00 0.00 41.96 38.46 1gt3 s TYR 39 CO 0.09 -0.85 1.19 -0.06 -1.11 0.00 0.00 175.55 174.81 1gt3 s PHE 40 N 2.21 2.49 0.07 2.71 2.99 -1.26 -1.16 117.98 126.03 1gt3 s PHE 40 Ca 0.11 1.52 -0.01 0.00 0.00 0.00 0.00 56.93 58.55 1gt3 s PHE 40 Cb -0.19 -3.44 -0.00 0.00 0.00 0.00 0.00 43.02 39.38 1gt3 s PHE 40 CO 0.11 -2.03 -0.01 0.54 -0.00 0.00 0.00 175.22 173.83 1gt3 n ARG 41 N -1.40 0.02 -3.75 0.44 1.74 0.15 -4.51 116.66 109.36 1gt3 n ARG 41 Ca 0.12 0.01 -0.12 0.00 -0.77 0.00 0.00 57.85 57.10 1gt3 n ARG 41 Cb 0.50 -0.54 -0.07 0.00 -1.02 0.00 0.00 32.46 31.32 1gt3 n ARG 41 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 1gt3 s GLU 42 N -2.03 0.80 -0.01 5.56 2.02 -1.08 -2.00 118.70 121.95 1gt3 s GLU 42 Ca -0.01 -0.47 0.04 0.00 0.02 0.00 0.00 54.97 54.55 1gt3 s GLU 42 Cb 0.00 0.35 -0.01 0.00 0.10 0.00 0.00 34.13 34.57 1gt3 s GLU 42 CO 0.02 -0.25 -0.12 -0.51 0.02 0.00 0.00 175.26 174.42 1gt3 s LEU 43 N -1.99 2.01 -0.15 1.80 1.43 -0.74 -1.58 118.68 119.46 1gt3 s LEU 43 Ca -0.06 -0.21 0.00 0.00 -1.03 0.00 0.00 54.13 52.83 1gt3 s LEU 43 Cb -0.01 -0.61 0.03 0.00 0.03 0.00 0.00 46.19 45.63 1gt3 s LEU 43 CO -0.02 0.14 -0.11 -0.69 0.23 0.00 0.00 176.35 175.89 1gt3 s VAL 44 N -0.26 1.44 -0.15 -1.59 1.01 -0.56 -1.07 120.40 119.21 1gt3 s VAL 44 Ca 0.04 -0.64 -0.08 0.00 0.00 0.00 0.00 61.98 61.30 1gt3 s VAL 44 Cb -0.05 -1.42 -0.04 0.00 0.00 0.00 0.00 36.38 34.87 1gt3 s VAL 44 CO -0.00 0.35 0.12 -0.36 0.00 0.00 0.00 175.10 175.21 1gt3 s PHE 45 N 1.53 3.48 -0.29 5.22 0.40 -1.26 -0.59 117.98 126.46 1gt3 s PHE 45 Ca 0.03 0.41 0.01 0.00 -0.60 0.00 0.00 56.93 56.77 1gt3 s PHE 45 Cb -0.14 -2.01 0.09 0.00 0.51 0.00 0.00 43.02 41.47 1gt3 s PHE 45 CO -0.09 0.53 0.05 0.34 0.70 0.00 0.00 175.22 176.74 1gt3 s ASP 46 N -0.46 4.08 0.22 1.36 -1.08 -0.48 -4.47 116.67 115.84 1gt3 s ASP 46 Ca 0.12 -1.59 -0.09 0.00 -0.52 0.00 0.00 52.55 50.47 1gt3 s ASP 46 Cb -0.12 -1.10 0.19 0.00 -1.46 0.00 0.00 42.92 40.44 1gt3 s ASP 46 CO 0.02 -0.36 1.89 0.44 0.52 0.00 0.00 175.17 177.68 1gt3 h ASP 47 N 7.96 0.99 0.43 -0.34 3.45 -1.94 0.54 116.42 127.50 1gt3 h ASP 47 Ca -0.13 -0.04 -0.02 0.00 0.43 0.00 0.00 57.03 57.28 1gt3 h ASP 47 Cb 1.04 -0.25 0.00 0.00 -0.56 0.00 0.00 39.33 39.56 1gt3 h ASP 47 CO 0.46 0.73 -0.21 -0.08 -1.57 0.00 0.00 179.24 178.57 1gt3 h GLU 48 N 1.16 -0.56 0.00 3.56 4.81 -1.96 -3.15 114.58 118.43 1gt3 h GLU 48 Ca 0.31 0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.58 1gt3 h GLU 48 Cb -0.11 0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.40 1gt3 h GLU 48 CO -0.06 -0.38 -0.22 0.87 -0.73 0.00 0.00 179.01 178.49 1gt3 h LYS 49 N -0.59 0.00 -3.50 1.92 1.57 -1.99 -3.47 116.57 110.51 1gt3 h LYS 49 Ca -0.06 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.55 1gt3 h LYS 49 Cb 0.45 0.00 0.07 0.00 0.08 0.00 0.00 32.23 32.84 1gt3 h LYS 49 CO 0.09 0.00 -0.34 0.41 -0.57 0.00 0.00 179.45 179.04 1gt3 n GLY 50 N 1.23 0.16 3.31 3.86 0.00 0.15 -4.84 105.19 109.06 1gt3 n GLY 50 Ca 0.04 -0.22 -0.17 0.00 0.00 0.00 0.00 46.02 45.67 1gt3 n GLY 50 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1gt3 s THR 51 N -3.16 1.23 -0.04 2.61 -4.23 -1.00 -1.02 115.64 110.02 1gt3 s THR 51 Ca 0.13 -2.07 -0.00 0.00 -1.18 0.00 0.00 61.69 58.57 1gt3 s THR 51 Cb -0.06 -2.15 0.03 0.00 1.34 0.00 0.00 72.50 71.66 1gt3 s THR 51 CO 0.34 -0.50 -0.00 -0.69 -0.54 0.00 0.00 174.62 173.23 1gt3 s VAL 52 N -3.29 0.26 -0.20 2.29 1.01 -0.89 -1.38 120.40 118.19 1gt3 s VAL 52 Ca 0.24 0.09 -0.08 0.00 0.00 0.00 0.00 61.98 62.22 1gt3 s VAL 52 Cb 0.04 -0.37 -0.04 0.00 0.00 0.00 0.00 36.38 36.00 1gt3 s VAL 52 CO 0.06 0.19 0.09 -1.81 0.00 0.00 0.00 175.10 173.63 1gt3 s ASP 53 N 1.33 5.75 -0.14 3.32 1.11 0.24 -1.08 116.67 127.20 1gt3 s ASP 53 Ca -0.05 0.08 -0.05 0.00 0.18 0.00 0.00 52.55 52.70 1gt3 s ASP 53 Cb -0.13 -2.00 -0.04 0.00 1.07 0.00 0.00 42.92 41.82 1gt3 s ASP 53 CO -0.02 0.13 0.04 -0.36 1.18 0.00 0.00 175.17 176.14 1gt3 s PHE 54 N 0.62 3.25 -0.14 4.23 0.08 0.98 -1.50 117.98 125.50 1gt3 s PHE 54 Ca 0.05 0.13 -0.00 0.00 0.12 0.00 0.00 56.93 57.22 1gt3 s PHE 54 Cb -0.13 -1.96 0.03 0.00 -0.57 0.00 0.00 43.02 40.39 1gt3 s PHE 54 CO 0.01 0.30 -0.09 0.71 -0.10 0.00 0.00 175.22 176.05 1gt3 s TYR 55 N -0.18 1.83 0.29 0.36 1.51 -0.61 -1.38 117.35 119.17 1gt3 s TYR 55 Ca 0.07 -1.04 -0.06 0.00 -1.01 0.00 0.00 57.07 55.03 1gt3 s TYR 55 Cb -0.12 -1.40 -0.00 0.00 -0.11 0.00 0.00 41.96 40.32 1gt3 s TYR 55 CO 0.02 -0.61 0.44 -0.59 -1.11 0.00 0.00 175.55 173.70 1gt3 s PHE 56 N 1.59 0.81 0.01 2.71 -0.71 -0.73 -0.67 117.98 120.99 1gt3 s PHE 56 Ca 0.04 -1.10 0.06 0.00 -1.04 0.00 0.00 56.93 54.89 1gt3 s PHE 56 Cb -0.13 -0.02 -0.02 0.00 -1.21 0.00 0.00 43.02 41.63 1gt3 s PHE 56 CO -0.09 -1.04 -0.19 -1.12 -1.34 0.00 0.00 175.22 171.45 1gt3 s SER 57 N -3.15 2.19 -0.06 1.98 0.01 -0.31 -0.60 113.70 113.76 1gt3 s SER 57 Ca 0.28 -0.39 -0.07 0.00 1.31 0.00 0.00 55.95 57.08 1gt3 s SER 57 Cb 0.00 -0.22 0.02 0.00 0.21 0.00 0.00 66.02 66.03 1gt3 s SER 57 CO 0.15 0.19 0.18 0.54 0.41 0.00 0.00 173.24 174.71 1gt3 s VAL 58 N -0.57 0.02 -0.19 3.43 0.11 -0.57 -1.15 120.40 121.49 1gt3 s VAL 58 Ca 0.07 -0.13 -0.20 0.00 -2.93 0.00 0.00 61.98 58.79 1gt3 s VAL 58 Cb -0.08 -0.30 -0.03 0.00 -1.53 0.00 0.00 36.38 34.45 1gt3 s VAL 58 CO 0.00 -0.07 0.58 -0.75 -3.33 0.00 0.00 175.10 171.53 1gt3 s LYS 59 N -0.18 4.21 -0.04 1.54 2.20 -1.26 -0.50 119.74 125.70 1gt3 s LYS 59 Ca -0.03 0.53 0.00 0.00 -0.36 0.00 0.00 55.97 56.12 1gt3 s LYS 59 Cb -0.02 -3.56 0.03 0.00 -1.51 0.00 0.00 37.83 32.76 1gt3 s LYS 59 CO 0.01 -0.18 -0.01 0.50 -0.36 0.00 0.00 175.35 175.31 1gt3 s ARG 60 N 1.73 0.49 -1.32 4.03 3.00 0.82 -3.96 118.95 123.74 1gt3 s ARG 60 Ca 0.27 0.05 -0.07 0.00 -1.00 0.00 0.00 55.73 54.99 1gt3 s ARG 60 Cb -0.16 -0.69 0.01 0.00 0.00 0.00 0.00 34.95 34.11 1gt3 s ARG 60 CO 0.10 -0.17 0.88 -0.25 0.00 0.00 0.00 175.30 175.86 1gt3 n ASP 61 N 4.42 -5.93 0.00 -2.12 8.00 -1.26 -2.21 116.55 117.45 1gt3 n ASP 61 Ca -0.20 -0.40 0.00 0.00 0.71 0.00 0.00 54.79 54.90 1gt3 n ASP 61 Cb 0.50 -4.63 0.00 0.00 -0.02 0.00 0.00 41.12 36.98 1gt3 n ASP 61 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1gt3 n GLY 62 N -1.72 1.82 3.16 0.44 0.00 -1.26 -5.03 105.19 102.60 1gt3 n GLY 62 Ca -0.04 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.83 1gt3 n GLY 62 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1gt3 s LYS 63 N -0.22 0.79 0.05 1.61 -2.85 -0.94 -5.10 119.74 113.08 1gt3 s LYS 63 Ca 0.00 -1.01 -0.30 0.00 -1.00 0.00 0.00 55.97 53.66 1gt3 s LYS 63 Cb 0.00 -0.62 -0.05 0.00 -2.06 0.00 0.00 37.83 35.10 1gt3 s LYS 63 CO 0.00 0.12 1.16 -1.58 0.10 0.00 0.00 175.35 175.15 1gt3 s TRP 64 N -1.77 3.47 0.01 1.78 0.52 -1.26 -0.13 118.94 121.56 1gt3 s TRP 64 Ca -0.00 1.36 0.08 0.00 0.02 0.00 0.00 56.10 57.57 1gt3 s TRP 64 Cb -0.07 -3.37 -0.02 0.00 -1.15 0.00 0.00 33.47 28.86 1gt3 s TRP 64 CO 0.01 -1.07 -0.26 0.15 0.02 0.00 0.00 176.95 175.81 1gt3 s LYS 65 N 1.10 1.99 -0.21 4.98 -0.14 0.34 -4.47 119.74 123.34 1gt3 s LYS 65 Ca 0.57 -1.00 -0.14 0.00 -1.36 0.00 0.00 55.97 54.04 1gt3 s LYS 65 Cb -0.28 -2.03 -0.04 0.00 -1.68 0.00 0.00 37.83 33.80 1gt3 s LYS 65 CO 0.29 0.54 0.34 -0.80 -0.76 0.00 0.00 175.35 174.95 1gt3 s ASN 66 N -0.89 6.36 0.05 2.83 0.01 -1.26 -1.51 114.94 120.54 1gt3 s ASN 66 Ca 0.11 0.42 0.08 0.00 -0.71 0.00 0.00 52.86 52.76 1gt3 s ASN 66 Cb -0.10 -2.20 -0.03 0.00 0.41 0.00 0.00 41.25 39.33 1gt3 s ASN 66 CO 0.00 -0.03 -0.22 -0.69 -1.51 0.00 0.00 177.10 174.65 1gt3 s VAL 67 N 1.18 1.82 -0.07 1.60 1.01 0.23 -5.01 120.40 121.16 1gt3 s VAL 67 Ca 0.16 -1.30 0.03 0.00 0.00 0.00 0.00 61.98 60.88 1gt3 s VAL 67 Cb -0.14 -1.58 0.00 0.00 0.00 0.00 0.00 36.38 34.66 1gt3 s VAL 67 CO 0.07 0.22 -0.18 -2.28 0.00 0.00 0.00 175.10 172.93 1gt3 s HIS 68 N -0.84 1.96 -0.03 5.22 2.46 -1.26 -1.78 115.29 121.03 1gt3 s HIS 68 Ca 0.09 -0.73 0.02 0.00 0.47 0.00 0.00 55.06 54.91 1gt3 s HIS 68 Cb -0.09 -1.35 0.01 0.00 -0.13 0.00 0.00 32.58 31.01 1gt3 s HIS 68 CO 0.02 -0.31 -0.08 0.08 -2.47 0.00 0.00 174.74 171.98 1gt3 s VAL 69 N 0.41 0.73 -0.24 0.89 1.01 -0.48 -4.98 120.40 117.73 1gt3 s VAL 69 Ca -0.14 -0.32 -0.06 0.00 0.00 0.00 0.00 61.98 61.46 1gt3 s VAL 69 Cb -0.16 -0.66 -0.01 0.00 0.00 0.00 0.00 36.38 35.55 1gt3 s VAL 69 CO 0.06 0.23 0.02 -0.75 0.00 0.00 0.00 175.10 174.66 1gt3 s LYS 70 N 0.27 3.46 -0.02 2.72 2.20 -1.26 -0.01 119.74 127.09 1gt3 s LYS 70 Ca -0.04 -0.59 -0.02 0.00 -0.36 0.00 0.00 55.97 54.96 1gt3 s LYS 70 Cb -0.09 -3.19 -0.04 0.00 -1.51 0.00 0.00 37.83 33.01 1gt3 s LYS 70 CO 0.00 -0.22 0.10 0.00 -0.36 0.00 0.00 175.35 174.87 1gt3 s ALA 71 N 1.54 3.65 -0.09 3.13 0.00 -0.24 -4.58 121.76 125.17 1gt3 s ALA 71 Ca 0.06 -0.83 0.03 0.00 0.00 0.00 0.00 51.96 51.22 1gt3 s ALA 71 Cb -0.15 -1.66 -0.01 0.00 0.00 0.00 0.00 23.12 21.30 1gt3 s ALA 71 CO 0.00 0.69 -0.18 0.99 0.00 0.00 0.00 175.76 177.25 1gt3 s THR 72 N -1.18 2.61 0.36 0.00 2.01 -0.03 -2.09 115.64 117.32 1gt3 s THR 72 Ca 0.22 -0.85 -0.26 0.00 0.31 0.00 0.00 61.69 61.12 1gt3 s THR 72 Cb -0.12 -2.03 -0.09 0.00 0.01 0.00 0.00 72.50 70.27 1gt3 s THR 72 CO 0.13 0.55 1.05 -0.75 -0.69 0.00 0.00 174.62 174.91 1gt3 s LYS 73 N 0.03 4.32 0.45 4.92 2.20 -0.19 -0.94 119.74 130.53 1gt3 s LYS 73 Ca -0.07 1.57 0.08 0.00 -0.36 0.00 0.00 55.97 57.19 1gt3 s LYS 73 Cb -0.15 -2.73 0.00 0.00 -1.51 0.00 0.00 37.83 33.44 1gt3 s LYS 73 CO 0.05 -0.01 0.46 -0.65 -0.36 0.00 0.00 175.35 174.83 1gt3 s GLN 74 N -2.18 2.53 0.31 4.03 -0.21 0.16 -4.93 119.66 119.37 1gt3 s GLN 74 Ca 0.54 -1.55 -0.00 0.00 0.02 0.00 0.00 55.36 54.37 1gt3 s GLN 74 Cb -0.24 -2.44 0.50 0.00 1.00 0.00 0.00 33.01 31.83 1gt3 s GLN 74 CO 0.31 -0.32 1.96 -0.44 -2.12 0.00 0.00 175.29 174.68 1gt3 h ASP 75 N 0.84 0.90 0.00 5.90 3.45 -1.97 -0.68 116.42 124.86 1gt3 h ASP 75 Ca -0.39 -0.02 0.00 0.00 0.43 0.00 0.00 57.03 57.05 1gt3 h ASP 75 Cb 1.27 -0.21 0.00 0.00 -0.56 0.00 0.00 39.33 39.83 1gt3 h ASP 75 CO 0.53 0.63 0.00 -0.90 -1.57 0.00 0.00 179.24 177.93 1gt3 n ASP 76 N -4.43 0.00 0.00 6.45 5.68 -1.26 -4.84 116.55 118.14 1gt3 n ASP 76 Ca 0.10 -0.97 0.00 0.00 -0.50 0.00 0.00 54.79 53.42 1gt3 n ASP 76 Cb 0.07 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.05 1gt3 n ASP 76 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1gt3 n GLY 77 N 0.28 2.05 3.90 6.12 0.00 -0.26 -5.04 105.19 112.24 1gt3 n GLY 77 Ca 0.09 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.83 1gt3 n GLY 77 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1gt3 s THR 78 N -2.55 2.35 0.10 2.61 -4.23 -1.26 -4.70 115.64 107.97 1gt3 s THR 78 Ca 0.00 0.02 0.10 0.00 -1.18 0.00 0.00 61.69 60.63 1gt3 s THR 78 Cb 0.00 -3.09 -0.04 0.00 1.34 0.00 0.00 72.50 70.71 1gt3 s THR 78 CO 0.00 -0.12 -0.24 -0.31 -0.54 0.00 0.00 174.62 173.41 1gt3 s TYR 79 N -3.46 2.08 0.04 3.99 1.51 -0.41 0.37 117.35 121.49 1gt3 s TYR 79 Ca 0.61 -0.40 0.09 0.00 -1.01 0.00 0.00 57.07 56.36 1gt3 s TYR 79 Cb -0.11 -1.15 -0.03 0.00 -0.11 0.00 0.00 41.96 40.56 1gt3 s TYR 79 CO 0.48 0.25 -0.24 0.14 -1.11 0.00 0.00 175.55 175.08 1gt3 s VAL 80 N -1.05 2.34 -0.03 0.71 -7.23 -0.12 -0.79 120.40 114.24 1gt3 s VAL 80 Ca 0.11 -1.32 -0.20 0.00 -1.81 0.00 0.00 61.98 58.75 1gt3 s VAL 80 Cb -0.10 -1.94 0.04 0.00 0.56 0.00 0.00 36.38 34.94 1gt3 s VAL 80 CO 0.05 0.36 0.43 0.00 -0.31 0.00 0.00 175.10 175.62 1gt3 s ALA 81 N -0.84 -1.10 -0.32 1.32 0.00 -0.85 -0.85 121.76 119.13 1gt3 s ALA 81 Ca 0.13 0.65 -0.13 0.00 0.00 0.00 0.00 51.96 52.60 1gt3 s ALA 81 Cb -0.10 0.04 -0.03 0.00 0.00 0.00 0.00 23.12 23.04 1gt3 s ALA 81 CO 0.03 -0.29 0.26 0.34 0.00 0.00 0.00 175.76 176.09 1gt3 s ASP 82 N -1.27 6.08 -0.30 0.00 2.15 -1.26 -1.58 116.67 120.50 1gt3 s ASP 82 Ca -0.13 -0.21 -0.12 0.00 0.43 0.00 0.00 52.55 52.52 1gt3 s ASP 82 Cb -0.04 -2.15 0.17 0.00 -0.30 0.00 0.00 42.92 40.61 1gt3 s ASP 82 CO 0.06 -0.19 0.94 -0.47 -0.17 0.00 0.00 175.17 175.34 1gt3 s TYR 83 N 1.81 -0.79 -1.52 -5.34 5.04 -1.26 -4.88 117.35 110.41 1gt3 s TYR 83 Ca 0.08 1.06 -0.08 0.00 -2.44 0.00 0.00 57.07 55.70 1gt3 s TYR 83 Cb -0.17 0.36 0.06 0.00 0.35 0.00 0.00 41.96 42.57 1gt3 s TYR 83 CO 0.11 -0.42 0.60 0.39 -1.34 0.00 0.00 175.55 174.89 1gt3 n GLU 84 N 5.25 -3.49 0.00 4.97 -0.58 -1.26 -4.52 120.64 121.01 1gt3 n GLU 84 Ca -0.07 0.41 0.00 0.00 -0.42 0.00 0.00 57.16 57.08 1gt3 n GLU 84 Cb 0.53 -4.82 0.00 0.00 -0.57 0.00 0.00 31.44 26.57 1gt3 n GLU 84 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1gt3 n GLY 85 N -1.76 -0.41 3.88 0.62 0.00 -1.26 -4.40 105.19 101.86 1gt3 n GLY 85 Ca -0.15 -2.19 -0.37 0.00 0.00 0.00 0.00 46.02 43.31 1gt3 n GLY 85 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1gt3 s GLN 86 N 0.00 3.48 0.03 1.61 -0.21 -0.37 -4.54 119.66 119.65 1gt3 s GLN 86 Ca 0.00 -0.10 0.05 0.00 0.02 0.00 0.00 55.36 55.33 1gt3 s GLN 86 Cb 0.00 -3.19 -0.02 0.00 1.00 0.00 0.00 33.01 30.80 1gt3 s GLN 86 CO 0.00 0.77 -0.15 -0.80 -2.12 0.00 0.00 175.29 172.99 1gt3 s ASN 87 N -1.08 1.72 -0.20 5.90 0.01 -0.61 -1.23 114.94 119.45 1gt3 s ASN 87 Ca 0.16 -0.43 -0.00 0.00 -0.71 0.00 0.00 52.86 51.89 1gt3 s ASN 87 Cb -0.12 -0.13 0.05 0.00 0.41 0.00 0.00 41.25 41.46 1gt3 s ASN 87 CO 0.05 0.07 -0.05 -0.69 -1.51 0.00 0.00 177.10 174.97 1gt3 s VAL 88 N -0.75 1.31 0.02 1.60 1.01 -0.62 -2.01 120.40 120.96 1gt3 s VAL 88 Ca 0.03 -0.93 0.07 0.00 0.00 0.00 0.00 61.98 61.15 1gt3 s VAL 88 Cb -0.07 -1.54 -0.03 0.00 0.00 0.00 0.00 36.38 34.73 1gt3 s VAL 88 CO 0.01 -0.00 -0.21 0.72 0.00 0.00 0.00 175.10 175.62 1gt3 s PHE 89 N 1.52 2.49 -0.09 5.22 -0.12 0.03 -1.01 117.98 126.02 1gt3 s PHE 89 Ca -0.03 -0.30 0.03 0.00 -0.05 0.00 0.00 56.93 56.58 1gt3 s PHE 89 Cb -0.17 -1.47 0.01 0.00 -0.63 0.00 0.00 43.02 40.75 1gt3 s PHE 89 CO -0.07 0.18 -0.20 0.21 -0.05 0.00 0.00 175.22 175.29 1gt3 s LYS 90 N -1.21 2.62 -0.34 1.99 2.47 0.55 -1.28 119.74 124.53 1gt3 s LYS 90 Ca 0.13 -0.73 -0.24 0.00 -1.56 0.00 0.00 55.97 53.57 1gt3 s LYS 90 Cb -0.10 -2.03 0.01 0.00 -1.46 0.00 0.00 37.83 34.24 1gt3 s LYS 90 CO 0.03 0.11 0.82 0.42 0.16 0.00 0.00 175.35 176.88 1gt3 s ILE 91 N 0.51 4.72 -0.04 5.43 1.01 -1.26 -1.00 121.20 130.58 1gt3 s ILE 91 Ca -0.16 1.06 0.02 0.00 0.00 0.00 0.00 60.65 61.57 1gt3 s ILE 91 Cb -0.17 -4.21 -0.25 0.00 0.01 0.00 0.00 42.46 37.83 1gt3 s ILE 91 CO 0.06 -0.39 0.70 0.58 0.00 0.00 0.00 174.94 175.89 1gt3 h VAL 92 N 5.71 0.95 -2.63 2.92 2.07 -1.28 -3.47 116.25 120.52 1gt3 h VAL 92 Ca -0.24 -2.69 -0.11 0.00 0.82 0.00 0.00 66.70 64.48 1gt3 h VAL 92 Cb 1.09 2.59 -0.25 0.00 -1.52 0.00 0.00 31.29 33.21 1gt3 h VAL 92 CO 0.92 0.74 -0.22 -0.55 0.02 0.00 0.00 177.57 178.47 1gt3 s SER 93 N -6.69 -0.50 -0.12 0.57 0.15 -0.99 -4.99 113.70 101.13 1gt3 s SER 93 Ca -0.10 0.92 -0.07 0.00 0.70 0.00 0.00 55.95 57.40 1gt3 s SER 93 Cb 0.07 0.88 0.05 0.00 -1.71 0.00 0.00 66.02 65.31 1gt3 s SER 93 CO 0.82 -0.17 0.29 -0.22 1.20 0.00 0.00 173.24 175.16 1gt3 s LEU 94 N 0.71 0.34 0.00 3.45 2.96 -1.26 -0.97 118.68 123.92 1gt3 s LEU 94 Ca -0.04 0.62 -0.00 0.00 -0.22 0.00 0.00 54.13 54.49 1gt3 s LEU 94 Cb -0.05 0.92 0.00 0.00 0.50 0.00 0.00 46.19 47.56 1gt3 s LEU 94 CO -0.05 -0.16 0.38 -1.54 -1.32 0.00 0.00 176.35 173.65 1gt3 n SER 95 N 4.08 -1.04 0.29 3.68 3.41 -0.46 -4.99 113.62 118.59 1gt3 n SER 95 Ca -0.23 -2.62 0.19 0.00 -0.26 0.00 0.00 58.87 55.95 1gt3 n SER 95 Cb 0.54 2.00 0.98 0.00 -0.26 0.00 0.00 64.21 67.47 1gt3 n SER 95 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1gt3 h ARG 96 N 0.00 0.00 0.00 4.33 2.43 -1.99 -3.16 114.38 115.98 1gt3 h ARG 96 Ca -0.22 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.95 1gt3 h ARG 96 Cb 0.99 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.54 1gt3 h ARG 96 CO 0.30 0.00 -0.31 0.25 -1.51 0.00 0.00 179.97 178.70 1gt3 n THR 97 N -3.36 0.00 -4.05 0.20 -2.24 -1.26 -4.76 114.28 98.81 1gt3 n THR 97 Ca -0.01 -0.30 -0.08 0.00 -2.27 0.00 0.00 64.05 61.38 1gt3 n THR 97 Cb 0.22 0.81 -0.09 0.00 -2.10 0.00 0.00 70.33 69.17 1gt3 n THR 97 CO 0.00 0.00 0.00 -1.38 -0.57 0.00 0.00 175.07 173.12 1gt3 s HIS 98 N -1.23 0.53 -0.10 4.78 -3.43 -1.20 -1.26 115.29 113.38 1gt3 s HIS 98 Ca 0.00 -1.00 -0.04 0.00 -0.80 0.00 0.00 55.06 53.22 1gt3 s HIS 98 Cb 0.00 -0.33 0.05 0.00 -1.43 0.00 0.00 32.58 30.87 1gt3 s HIS 98 CO 0.00 -0.47 0.22 -1.17 -2.00 0.00 0.00 174.74 171.32 1gt3 s LEU 99 N -2.94 0.15 -0.12 5.38 2.96 -0.11 -1.36 118.68 122.65 1gt3 s LEU 99 Ca 0.12 0.47 0.03 0.00 -0.22 0.00 0.00 54.13 54.53 1gt3 s LEU 99 Cb 0.07 0.57 0.00 0.00 0.50 0.00 0.00 46.19 47.33 1gt3 s LEU 99 CO -0.06 -0.20 -0.22 -0.69 -1.32 0.00 0.00 176.35 173.85 1gt3 s VAL 100 N 1.79 2.14 0.08 1.68 1.01 -0.14 -0.68 120.40 126.29 1gt3 s VAL 100 Ca -0.04 -0.98 -0.01 0.00 0.00 0.00 0.00 61.98 60.95 1gt3 s VAL 100 Cb -0.11 -1.83 -0.04 0.00 0.00 0.00 0.00 36.38 34.39 1gt3 s VAL 100 CO -0.08 0.55 0.01 0.00 0.00 0.00 0.00 175.10 175.59 1gt3 s ALA 101 N 0.50 0.58 -0.09 5.51 0.00 -0.81 -0.72 121.76 126.73 1gt3 s ALA 101 Ca -0.14 -1.26 0.02 0.00 0.00 0.00 0.00 51.96 50.57 1gt3 s ALA 101 Cb -0.17 0.47 0.01 0.00 0.00 0.00 0.00 23.12 23.44 1gt3 s ALA 101 CO 0.05 -0.42 -0.14 -1.58 0.00 0.00 0.00 175.76 173.68 1gt3 s HIS 102 N -3.96 1.78 -0.05 0.00 5.65 -0.17 -1.46 115.29 117.09 1gt3 s HIS 102 Ca 0.12 -0.78 0.06 0.00 0.25 0.00 0.00 55.06 54.71 1gt3 s HIS 102 Cb 0.08 -1.30 -0.01 0.00 -1.18 0.00 0.00 32.58 30.17 1gt3 s HIS 102 CO -0.06 -0.41 -0.23 1.21 -0.65 0.00 0.00 174.74 174.60 1gt3 s ASN 103 N 0.91 2.76 -0.21 9.88 3.84 0.11 -0.33 114.94 131.90 1gt3 s ASN 103 Ca -0.09 -0.45 -0.04 0.00 0.21 0.00 0.00 52.86 52.49 1gt3 s ASN 103 Cb -0.15 -0.69 -0.01 0.00 -0.55 0.00 0.00 41.25 39.84 1gt3 s ASN 103 CO 0.00 0.22 -0.03 -0.63 -2.79 0.00 0.00 177.10 173.88 1gt3 s ILE 104 N -0.16 3.57 -0.07 -5.21 1.01 -0.18 -0.60 121.20 119.55 1gt3 s ILE 104 Ca -0.02 -0.43 0.05 0.00 0.00 0.00 0.00 60.65 60.25 1gt3 s ILE 104 Cb -0.12 -2.62 -0.01 0.00 0.01 0.00 0.00 42.46 39.72 1gt3 s ILE 104 CO 0.03 0.43 -0.23 0.21 0.00 0.00 0.00 174.94 175.37 1gt3 s ASN 105 N 1.26 3.22 -0.21 3.58 3.84 0.10 -1.59 114.94 125.14 1gt3 s ASN 105 Ca 0.03 -0.48 0.01 0.00 0.21 0.00 0.00 52.86 52.63 1gt3 s ASN 105 Cb -0.14 -1.02 0.04 0.00 -0.55 0.00 0.00 41.25 39.58 1gt3 s ASN 105 CO -0.01 0.23 -0.12 -0.69 -2.79 0.00 0.00 177.10 173.72 1gt3 s VAL 106 N -0.06 1.84 0.69 -5.21 1.01 -0.36 -0.61 120.40 117.70 1gt3 s VAL 106 Ca -0.06 -1.18 -0.11 0.00 0.00 0.00 0.00 61.98 60.63 1gt3 s VAL 106 Cb -0.15 -1.89 0.16 0.00 0.00 0.00 0.00 36.38 34.50 1gt3 s VAL 106 CO 0.05 0.16 0.94 -0.90 0.00 0.00 0.00 175.10 175.34 1gt3 n ASP 107 N 4.61 0.18 0.00 3.32 5.68 -0.63 -1.24 116.55 128.47 1gt3 n ASP 107 Ca -0.15 -1.41 0.01 0.00 -0.50 0.00 0.00 54.79 52.74 1gt3 n ASP 107 Cb 0.46 -0.71 0.06 0.00 -1.14 0.00 0.00 41.12 39.79 1gt3 n ASP 107 CO 0.00 0.00 0.00 2.29 -1.33 0.00 0.00 177.20 178.16 1gt3 n LYS 108 N -2.96 0.05 -0.04 0.11 0.00 -1.26 -1.48 118.16 112.58 1gt3 n LYS 108 Ca 0.12 0.12 0.01 0.00 -0.00 0.00 0.00 58.31 58.57 1gt3 n LYS 108 Cb 0.42 -1.50 0.03 0.00 -0.00 0.00 0.00 35.03 33.98 1gt3 n LYS 108 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.40 178.12 1gt3 n HIS 109 N -1.13 0.10 -1.00 5.58 8.25 -1.26 -4.98 115.22 120.77 1gt3 n HIS 109 Ca 0.01 -0.49 0.00 0.00 -0.26 0.00 0.00 57.72 56.98 1gt3 n HIS 109 Cb 0.01 -0.04 0.00 0.00 1.12 0.00 0.00 29.99 31.08 1gt3 n HIS 109 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1gt3 n GLY 110 N -0.28 0.55 3.71 -1.41 0.00 -0.55 -5.02 105.19 102.19 1gt3 n GLY 110 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 1gt3 n GLY 110 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1gt3 s GLN 111 N -0.01 4.50 -0.17 1.61 0.74 -1.26 -4.83 119.66 120.25 1gt3 s GLN 111 Ca 0.00 1.23 -0.08 0.00 0.05 0.00 0.00 55.36 56.55 1gt3 s GLN 111 Cb 0.00 -3.46 -0.05 0.00 1.10 0.00 0.00 33.01 30.60 1gt3 s GLN 111 CO 0.00 -0.03 0.13 -0.08 -0.55 0.00 0.00 175.29 174.75 1gt3 s THR 112 N 1.03 5.37 -0.02 -0.34 -1.32 -1.26 -1.60 115.64 117.50 1gt3 s THR 112 Ca 0.47 0.17 0.03 0.00 -1.21 0.00 0.00 61.69 61.14 1gt3 s THR 112 Cb -0.20 -3.40 -0.00 0.00 -1.51 0.00 0.00 72.50 67.39 1gt3 s THR 112 CO 0.24 0.51 -0.10 -0.89 -2.21 0.00 0.00 174.62 172.17 1gt3 s THR 113 N -0.19 0.84 -0.09 5.08 2.01 0.22 -4.94 115.64 118.57 1gt3 s THR 113 Ca 0.10 -0.41 0.01 0.00 0.31 0.00 0.00 61.69 61.70 1gt3 s THR 113 Cb -0.11 -0.74 -0.02 0.00 0.01 0.00 0.00 72.50 71.63 1gt3 s THR 113 CO 0.01 0.26 -0.11 -1.61 -0.69 0.00 0.00 174.62 172.47 1gt3 s GLU 114 N 0.08 3.00 0.11 4.92 2.02 -1.26 -0.72 118.70 126.85 1gt3 s GLU 114 Ca -0.01 -0.65 0.07 0.00 0.02 0.00 0.00 54.97 54.40 1gt3 s GLU 114 Cb -0.08 -2.57 -0.04 0.00 0.10 0.00 0.00 34.13 31.55 1gt3 s GLU 114 CO 0.00 0.44 -0.17 -0.51 0.02 0.00 0.00 175.26 175.04 1gt3 s LEU 115 N -0.23 2.35 0.08 1.80 1.02 0.23 -1.49 118.68 122.44 1gt3 s LEU 115 Ca 0.02 -0.74 0.06 0.00 0.02 0.00 0.00 54.13 53.49 1gt3 s LEU 115 Cb -0.13 -0.71 -0.03 0.00 0.02 0.00 0.00 46.19 45.33 1gt3 s LEU 115 CO 0.03 -0.04 -0.17 0.42 0.02 0.00 0.00 176.35 176.61 1gt3 s THR 116 N -1.61 1.38 0.02 5.49 -4.23 -0.61 -0.72 115.64 115.36 1gt3 s THR 116 Ca 0.07 -1.37 -0.14 0.00 -1.18 0.00 0.00 61.69 59.07 1gt3 s THR 116 Cb -0.08 -1.28 0.02 0.00 1.34 0.00 0.00 72.50 72.51 1gt3 s THR 116 CO 0.04 -0.12 0.31 -0.70 -0.54 0.00 0.00 174.62 173.61 1gt3 s GLU 117 N -1.73 0.77 -0.10 3.99 -6.30 -0.53 -0.41 118.70 114.39 1gt3 s GLU 117 Ca 0.02 -0.38 0.01 0.00 -2.50 0.00 0.00 54.97 52.11 1gt3 s GLU 117 Cb -0.10 0.34 0.02 0.00 0.00 0.00 0.00 34.13 34.39 1gt3 s GLU 117 CO 0.03 -0.24 -0.10 -1.17 0.02 0.00 0.00 175.26 173.80 1gt3 s LEU 118 N -1.80 1.43 0.07 2.70 2.96 -0.10 -1.91 118.68 122.03 1gt3 s LEU 118 Ca -0.08 -0.33 0.07 0.00 -0.22 0.00 0.00 54.13 53.57 1gt3 s LEU 118 Cb -0.02 -0.89 -0.03 0.00 0.50 0.00 0.00 46.19 45.75 1gt3 s LEU 118 CO -0.01 -0.05 -0.18 -0.36 -1.32 0.00 0.00 176.35 174.43 1gt3 s PHE 119 N 1.28 1.57 0.05 5.38 0.40 0.15 -0.70 117.98 126.11 1gt3 s PHE 119 Ca -0.02 -0.40 0.08 0.00 -0.60 0.00 0.00 56.93 55.98 1gt3 s PHE 119 Cb -0.14 -0.90 -0.03 0.00 0.51 0.00 0.00 43.02 42.47 1gt3 s PHE 119 CO -0.04 0.12 -0.22 0.54 0.70 0.00 0.00 175.22 176.32 1gt3 s VAL 120 N -1.04 1.76 0.03 -0.44 0.11 -0.14 -0.93 120.40 119.75 1gt3 s VAL 120 Ca 0.04 -1.29 -0.10 0.00 -2.93 0.00 0.00 61.98 57.70 1gt3 s VAL 120 Cb -0.09 -1.53 -0.05 0.00 -1.53 0.00 0.00 36.38 33.17 1gt3 s VAL 120 CO 0.03 0.19 0.36 -0.75 -3.33 0.00 0.00 175.10 171.60 1gt3 s LYS 121 N -1.31 3.74 -0.42 1.54 2.20 -0.39 -0.01 119.74 125.10 1gt3 s LYS 121 Ca 0.08 0.17 -0.18 0.00 -0.36 0.00 0.00 55.97 55.68 1gt3 s LYS 121 Cb -0.09 -3.08 0.02 0.00 -1.51 0.00 0.00 37.83 33.17 1gt3 s LYS 121 CO 0.02 0.63 0.50 -0.51 -0.36 0.00 0.00 175.35 175.62 1gt3 s LEU 122 N -1.60 4.75 -0.23 5.43 1.02 -0.49 -4.93 118.68 122.62 1gt3 s LEU 122 Ca 0.28 -0.57 -0.09 0.00 0.02 0.00 0.00 54.13 53.77 1gt3 s LEU 122 Cb -0.14 -2.49 -0.04 0.00 0.02 0.00 0.00 46.19 43.54 1gt3 s LEU 122 CO 0.15 -0.63 0.12 0.20 0.02 0.00 0.00 176.35 176.21 1gt3 s ASN 123 N 1.86 5.83 -0.30 2.29 0.01 -1.26 -4.59 114.94 118.79 1gt3 s ASN 123 Ca 0.15 0.04 -0.02 0.00 -0.71 0.00 0.00 52.86 52.32 1gt3 s ASN 123 Cb -0.16 -2.04 0.04 0.00 0.41 0.00 0.00 41.25 39.50 1gt3 s ASN 123 CO 0.15 0.07 0.00 -0.69 -1.51 0.00 0.00 177.10 175.12 1gt3 s VAL 124 N 1.02 3.07 0.43 1.60 1.01 -1.26 -5.10 120.40 121.17 1gt3 s VAL 124 Ca 0.06 -1.29 -0.22 0.00 0.00 0.00 0.00 61.98 60.53 1gt3 s VAL 124 Cb -0.14 -2.73 -0.10 0.00 0.00 0.00 0.00 36.38 33.42 1gt3 s VAL 124 CO 0.04 -0.06 0.99 -1.61 0.00 0.00 0.00 175.10 174.45 1gt3 s GLU 125 N 1.28 4.14 0.13 2.72 8.01 -1.26 -4.97 118.70 128.75 1gt3 s GLU 125 Ca -0.04 1.27 -0.20 0.00 0.01 0.00 0.00 54.97 56.01 1gt3 s GLU 125 Cb -0.19 -2.28 -0.03 0.00 -4.31 0.00 0.00 34.13 27.31 1gt3 s GLU 125 CO -0.01 -0.12 1.72 -0.44 0.01 0.00 0.00 175.26 176.41 1gt3 h ASP 126 N 2.05 -0.11 0.23 -0.19 3.45 -1.99 -2.04 116.42 117.82 1gt3 h ASP 126 Ca -0.49 0.05 -0.04 0.00 0.43 0.00 0.00 57.03 56.98 1gt3 h ASP 126 Cb 1.20 0.09 -0.01 0.00 -0.56 0.00 0.00 39.33 40.05 1gt3 h ASP 126 CO 0.61 -0.03 -0.18 1.05 -1.57 0.00 0.00 179.24 179.12 1gt3 h GLU 127 N 0.04 0.00 -0.18 3.56 4.11 -1.99 -0.91 114.58 119.21 1gt3 h GLU 127 Ca 0.09 0.00 -0.19 0.00 0.07 0.00 0.00 59.36 59.33 1gt3 h GLU 127 Cb 0.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.37 1gt3 h GLU 127 CO -0.17 0.18 -0.66 -0.44 0.07 0.00 0.00 179.01 178.00 1gt3 h ASP 128 N 0.00 0.78 -0.65 3.06 3.32 -1.85 -1.29 116.42 119.79 1gt3 h ASP 128 Ca -0.00 -0.47 -0.08 0.00 0.02 0.00 0.00 57.03 56.50 1gt3 h ASP 128 Cb 0.35 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.64 1gt3 h ASP 128 CO 0.02 1.24 0.11 -0.07 -1.72 0.00 0.00 179.24 178.82 1gt3 h LEU 129 N 0.49 1.05 -0.62 1.55 3.38 -0.71 -1.77 115.31 118.69 1gt3 h LEU 129 Ca -0.02 -0.25 -0.08 0.00 0.09 0.00 0.00 57.88 57.63 1gt3 h LEU 129 Cb 1.25 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.70 1gt3 h LEU 129 CO 0.13 1.04 0.08 -0.08 0.09 0.00 0.00 178.44 179.70 1gt3 h GLU 130 N 1.02 1.04 -0.70 1.13 4.57 -1.03 -0.97 114.58 119.64 1gt3 h GLU 130 Ca 0.20 -0.29 -0.00 0.00 -1.18 0.00 0.00 59.36 58.09 1gt3 h GLU 130 Cb 0.44 -0.11 -0.03 0.00 -0.16 0.00 0.00 28.75 28.88 1gt3 h GLU 130 CO 0.01 0.98 0.42 0.87 -1.18 0.00 0.00 179.01 180.11 1gt3 h LYS 131 N 0.95 0.96 -0.13 1.92 1.57 -1.01 -0.11 116.57 120.71 1gt3 h LYS 131 Ca 0.18 -0.09 -0.01 0.00 -1.87 0.00 0.00 60.65 58.87 1gt3 h LYS 131 Cb 0.46 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.56 1gt3 h LYS 131 CO 0.02 0.69 0.06 0.35 -0.57 0.00 0.00 179.45 179.99 1gt3 h PHE 132 N 0.96 0.20 -0.22 -1.35 3.57 -0.99 -1.91 116.94 117.20 1gt3 h PHE 132 Ca 0.25 -0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.66 1gt3 h PHE 132 Cb -0.02 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 38.64 1gt3 h PHE 132 CO -0.01 0.27 -0.21 -1.49 -2.23 0.00 0.00 178.31 174.64 1gt3 h TRP 133 N 0.07 0.43 -0.14 0.41 4.06 -0.92 -0.79 115.95 119.06 1gt3 h TRP 133 Ca 0.04 -0.08 -0.02 0.00 2.06 0.00 0.00 58.89 60.90 1gt3 h TRP 133 Cb 0.16 -0.11 -0.01 0.00 -1.00 0.00 0.00 29.16 28.20 1gt3 h TRP 133 CO -0.02 0.59 0.02 -0.22 -3.56 0.00 0.00 178.44 175.25 1gt3 h LYS 134 N 0.36 0.24 -0.69 0.49 1.63 -0.90 -0.89 116.57 116.81 1gt3 h LYS 134 Ca 0.06 -0.07 -0.02 0.00 -0.85 0.00 0.00 60.65 59.77 1gt3 h LYS 134 Cb 0.58 -0.03 -0.03 0.00 -0.60 0.00 0.00 32.23 32.15 1gt3 h LYS 134 CO 0.04 0.43 0.33 1.25 -3.45 0.00 0.00 179.45 178.05 1gt3 h LEU 135 N 0.02 0.89 -0.65 5.20 5.85 -1.19 0.17 115.31 125.59 1gt3 h LEU 135 Ca 0.04 -0.09 -0.09 0.00 0.84 0.00 0.00 57.88 58.58 1gt3 h LEU 135 Cb 0.31 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.09 1gt3 h LEU 135 CO 0.00 0.75 0.02 0.74 -0.34 0.00 0.00 178.44 179.61 1gt3 h THR 136 N 0.98 1.26 0.00 1.05 2.02 -0.91 -2.30 112.91 115.01 1gt3 h THR 136 Ca 0.24 -1.13 -0.13 0.00 0.77 0.00 0.00 66.41 66.16 1gt3 h THR 136 Cb 0.10 0.77 -0.02 0.00 -1.74 0.00 0.00 68.15 67.25 1gt3 h THR 136 CO -0.03 0.41 -0.63 1.05 0.37 0.00 0.00 175.52 176.69 1gt3 h GLU 137 N 0.98 0.00 -0.23 6.66 4.11 -0.69 -2.41 114.58 123.00 1gt3 h GLU 137 Ca 0.18 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 59.58 1gt3 h GLU 137 Cb 0.54 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.77 1gt3 h GLU 137 CO 0.03 0.63 0.00 -0.44 0.07 0.00 0.00 179.01 179.30 1gt3 h ASP 138 N 0.00 0.31 -0.34 3.06 3.32 -0.62 -2.04 116.42 120.12 1gt3 h ASP 138 Ca -0.01 -0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.00 1gt3 h ASP 138 Cb 1.30 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.77 1gt3 h ASP 138 CO 0.08 0.37 0.00 0.29 -1.72 0.00 0.00 179.24 178.26 1gt3 n LYS 139 N -4.35 1.86 -2.40 3.56 4.76 -0.90 -4.92 118.16 115.77 1gt3 n LYS 139 Ca 0.00 -1.33 -0.15 0.00 -2.87 0.00 0.00 58.31 53.97 1gt3 n LYS 139 Cb 0.20 -1.31 0.00 0.00 -1.84 0.00 0.00 35.03 32.07 1gt3 n LYS 139 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1gt3 n GLY 140 N 1.11 -0.23 3.69 0.72 0.00 -0.77 -4.99 105.19 104.73 1gt3 n GLY 140 Ca 0.13 -0.23 -0.38 0.00 0.00 0.00 0.00 46.02 45.54 1gt3 n GLY 140 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1gt3 s ILE 141 N -2.80 5.19 0.36 -0.61 1.01 -0.92 -5.05 121.20 118.37 1gt3 s ILE 141 Ca 0.05 0.83 -0.27 0.00 0.00 0.00 0.00 60.65 61.26 1gt3 s ILE 141 Cb -0.02 -3.77 -0.09 0.00 0.01 0.00 0.00 42.46 38.59 1gt3 s ILE 141 CO 0.06 0.27 1.15 -0.62 0.00 0.00 0.00 174.94 175.80 1gt3 s ASP 142 N 0.86 6.78 0.57 3.58 -1.08 -1.26 -4.59 116.67 121.54 1gt3 s ASP 142 Ca 0.22 2.32 0.27 0.00 -0.52 0.00 0.00 52.55 54.84 1gt3 s ASP 142 Cb -0.15 -2.62 1.62 0.00 -1.46 0.00 0.00 42.92 40.32 1gt3 s ASP 142 CO 0.09 -0.49 2.14 0.11 0.52 0.00 0.00 175.17 177.53 1gt3 h LYS 143 N 3.01 0.00 0.00 4.34 1.57 -1.97 0.08 116.57 123.60 1gt3 h LYS 143 Ca -0.48 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.30 1gt3 h LYS 143 Cb 1.22 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.53 1gt3 h LYS 143 CO 0.64 0.00 0.00 1.63 -0.57 0.00 0.00 179.45 181.15 1gt3 n LYS 144 N -3.97 0.29 -1.19 3.15 4.76 -1.26 -2.99 118.16 116.94 1gt3 n LYS 144 Ca 0.00 0.02 -0.21 0.00 -2.87 0.00 0.00 58.31 55.25 1gt3 n LYS 144 Cb 0.25 -1.50 0.15 0.00 -1.84 0.00 0.00 35.03 32.10 1gt3 n LYS 144 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 1gt3 n ASN 145 N -1.35 4.31 -4.08 4.39 5.03 0.01 -4.90 115.26 118.68 1gt3 n ASN 145 Ca 0.11 -3.70 -0.26 0.00 0.87 0.00 0.00 54.58 51.60 1gt3 n ASN 145 Cb 0.25 -0.79 -0.17 0.00 -1.02 0.00 0.00 39.78 38.06 1gt3 n ASN 145 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1gt3 s VAL 146 N -3.69 1.34 -0.09 2.41 1.01 -1.16 -4.90 120.40 115.33 1gt3 s VAL 146 Ca 0.55 -0.61 -0.02 0.00 0.00 0.00 0.00 61.98 61.90 1gt3 s VAL 146 Cb 0.46 -1.20 -0.03 0.00 0.00 0.00 0.00 36.38 35.61 1gt3 s VAL 146 CO 0.05 0.40 0.00 -0.69 0.00 0.00 0.00 175.10 174.86 1gt3 s VAL 147 N 0.50 4.30 -0.55 2.92 1.01 -1.26 -5.07 120.40 122.25 1gt3 s VAL 147 Ca -0.14 -0.25 -0.16 0.00 0.00 0.00 0.00 61.98 61.44 1gt3 s VAL 147 Cb -0.15 -2.82 0.13 0.00 0.00 0.00 0.00 36.38 33.54 1gt3 s VAL 147 CO 0.04 0.59 0.53 0.21 0.00 0.00 0.00 175.10 176.48 1gt3 s ASN 148 N -0.75 6.20 0.21 3.32 3.04 -1.26 -4.91 114.94 120.79 1gt3 s ASN 148 Ca 0.12 -1.76 0.06 0.00 0.04 0.00 0.00 52.86 51.31 1gt3 s ASN 148 Cb -0.12 -2.22 0.14 0.00 -1.54 0.00 0.00 41.25 37.52 1gt3 s ASN 148 CO 0.02 -0.89 1.48 -0.26 -3.04 0.00 0.00 177.10 174.42 1gt3 h PHE 149 N 8.90 0.18 -0.66 0.43 -1.00 -2.00 -3.23 116.94 119.57 1gt3 h PHE 149 Ca -0.29 -0.09 -0.02 0.00 2.81 0.00 0.00 57.97 60.38 1gt3 h PHE 149 Cb 1.10 -0.03 -0.03 0.00 3.61 0.00 0.00 35.95 40.60 1gt3 h PHE 149 CO 0.75 0.82 0.34 1.25 -1.61 0.00 0.00 178.31 179.87 1gt3 h LEU 150 N 0.08 0.84 -0.98 1.54 5.85 -2.00 -1.64 115.31 119.01 1gt3 h LEU 150 Ca -0.02 -0.11 -0.04 0.00 0.84 0.00 0.00 57.88 58.55 1gt3 h LEU 150 Cb 1.31 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 42.12 1gt3 h LEU 150 CO 0.11 0.72 -0.18 -0.33 -0.34 0.00 0.00 178.44 178.42 1gt3 h GLU 151 N 0.91 0.00 -0.08 1.25 4.39 -1.98 -1.25 114.58 117.81 1gt3 h GLU 151 Ca 0.23 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.90 1gt3 h GLU 151 Cb 0.08 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.73 1gt3 h GLU 151 CO -0.03 0.18 -0.08 -0.91 -1.16 0.00 0.00 179.01 177.00 1gt3 h ASN 152 N 0.00 0.21 0.15 1.42 2.35 -1.41 -2.23 115.58 116.07 1gt3 h ASN 152 Ca -0.00 -0.48 -0.05 0.00 -0.55 0.00 0.00 56.30 55.22 1gt3 h ASN 152 Cb 0.77 -0.06 -0.01 0.00 0.05 0.00 0.00 38.32 39.08 1gt3 h ASN 152 CO 0.02 0.65 -0.19 -0.33 -1.65 0.00 0.00 177.43 175.93 1gt3 h GLU 153 N -0.23 0.10 0.00 0.81 5.08 -1.14 -2.13 114.58 117.07 1gt3 h GLU 153 Ca 0.01 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1gt3 h GLU 153 Cb 0.59 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.83 1gt3 h GLU 153 CO 0.02 0.29 0.00 0.09 -1.00 0.00 0.00 179.01 178.41 1gt3 n ASN 154 N -4.27 0.74 -3.22 1.42 5.03 -0.49 -4.01 115.26 110.47 1gt3 n ASN 154 Ca -0.02 0.60 -0.24 0.00 0.87 0.00 0.00 54.58 55.80 1gt3 n ASN 154 Cb 0.28 -0.79 -0.07 0.00 -1.02 0.00 0.00 39.78 38.18 1gt3 n ASN 154 CO 0.00 0.00 0.00 1.41 -1.83 0.00 0.00 177.26 176.84 1gt3 n HIS 155 N -2.23 0.33 -1.04 3.10 8.25 -0.81 -4.83 115.22 118.00 1gt3 n HIS 155 Ca 0.04 -3.68 -0.09 0.00 -0.26 0.00 0.00 57.72 53.74 1gt3 n HIS 155 Cb 0.36 -0.39 0.07 0.00 1.12 0.00 0.00 29.99 31.15 1gt3 n HIS 155 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 1gt3 n PRO 156 N 1.19 -0.88 -3.64 -0.41 -0.04 -1.14 -4.83 135.00 125.25 1gt3 n PRO 156 Ca 0.23 -0.58 -0.10 0.00 -0.04 0.00 0.00 63.50 63.00 1gt3 n PRO 156 Cb 0.52 -0.44 0.01 0.00 -0.04 0.00 0.00 33.50 33.55 1gt3 n PRO 156 CO 0.00 0.00 0.00 -2.39 -0.04 0.00 0.00 175.50 173.07 1gt3 n HIS 157 N -2.81 -1.97 0.00 0.54 1.44 -1.26 -4.98 115.22 106.18 1gt3 n HIS 157 Ca 0.05 -1.88 0.00 0.00 -2.01 0.00 0.00 57.72 53.88 1gt3 n HIS 157 Cb 0.18 0.74 0.00 0.00 0.12 0.00 0.00 29.99 31.03 1gt3 n HIS 157 CO 0.00 0.00 0.00 -2.30 -2.81 0.00 0.00 176.34 171.23