#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3n4t s ARG 2 N 0.00 4.35 0.31 0.03 3.52 0.62 -5.04 118.95 122.74 3n4t s ARG 2 Ca 0.00 1.18 0.03 0.00 -0.13 0.00 0.00 55.73 56.81 3n4t s ARG 2 Cb 0.00 -2.40 -0.06 0.00 -1.56 0.00 0.00 34.95 30.94 3n4t s ARG 2 CO 0.00 0.08 0.08 -0.08 -0.81 0.00 0.00 175.30 174.57 3n4t s THR 3 N -1.98 0.93 -0.05 4.11 -1.32 -1.26 -4.63 115.64 111.43 3n4t s THR 3 Ca 0.58 -2.00 -0.03 0.00 -1.21 0.00 0.00 61.69 59.03 3n4t s THR 3 Cb -0.12 -2.71 0.03 0.00 -1.51 0.00 0.00 72.50 68.19 3n4t s THR 3 CO 0.17 0.00 0.13 -0.31 -2.21 0.00 0.00 174.62 172.40 3n4t s TYR 4 N -3.44 -0.14 0.74 9.09 2.02 -1.26 -5.11 117.35 119.24 3n4t s TYR 4 Ca 0.36 0.40 -0.11 0.00 -0.37 0.00 0.00 57.07 57.35 3n4t s TYR 4 Cb 0.08 -0.05 0.03 0.00 -0.40 0.00 0.00 41.96 41.63 3n4t s TYR 4 CO 0.15 -0.12 1.10 0.95 -1.57 0.00 0.00 175.55 176.06 3n4t s THR 5 N 0.76 3.27 0.36 -0.71 -4.23 -1.26 -4.93 115.64 108.90 3n4t s THR 5 Ca -0.06 0.41 0.03 0.00 -1.18 0.00 0.00 61.69 60.90 3n4t s THR 5 Cb -0.08 -3.34 0.27 0.00 1.34 0.00 0.00 72.50 70.69 3n4t s THR 5 CO -0.04 -0.54 2.01 -0.26 -0.54 0.00 0.00 174.62 175.26 3n4t h PHE 6 N -0.80 0.76 -0.19 3.99 0.04 -2.00 -2.31 116.94 116.43 3n4t h PHE 6 Ca -0.46 0.02 -0.01 0.00 2.80 0.00 0.00 57.97 60.32 3n4t h PHE 6 Cb 1.26 -0.26 -0.01 0.00 2.20 0.00 0.00 35.95 39.15 3n4t h PHE 6 CO 0.48 0.48 0.08 -0.44 -0.60 0.00 0.00 178.31 178.31 3n4t h ASP 7 N 0.82 0.26 -0.50 2.17 5.19 -1.99 -1.79 116.42 120.58 3n4t h ASP 7 Ca 0.23 -0.15 0.06 0.00 -0.62 0.00 0.00 57.03 56.55 3n4t h ASP 7 Cb -0.07 -0.07 -0.05 0.00 0.18 0.00 0.00 39.33 39.32 3n4t h ASP 7 CO -0.05 0.34 0.19 1.56 -3.12 0.00 0.00 179.24 178.17 3n4t h GLN 8 N 0.17 0.37 -0.20 3.56 4.20 -1.85 0.14 115.11 121.49 3n4t h GLN 8 Ca 0.07 -0.02 0.05 0.00 0.06 0.00 0.00 58.65 58.80 3n4t h GLN 8 Cb 0.16 -0.08 -0.05 0.00 0.30 0.00 0.00 27.48 27.80 3n4t h GLN 8 CO -0.01 0.24 -0.14 0.28 -0.67 0.00 0.00 178.83 178.54 3n4t h VAL 9 N 0.38 0.60 -0.46 -0.54 2.07 -1.19 0.28 116.25 117.40 3n4t h VAL 9 Ca 0.24 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.71 3n4t h VAL 9 Cb 0.23 0.60 -0.02 0.00 -1.52 0.00 0.00 31.29 30.58 3n4t h VAL 9 CO -0.23 0.00 0.11 -0.33 0.02 0.00 0.00 177.57 177.14 3n4t h GLU 10 N -0.14 0.73 -0.88 1.57 5.08 -0.78 -1.63 114.58 118.54 3n4t h GLU 10 Ca 0.12 -0.18 0.05 0.00 -1.00 0.00 0.00 59.36 58.35 3n4t h GLU 10 Cb 0.31 -0.10 -0.05 0.00 0.50 0.00 0.00 28.75 29.41 3n4t h GLU 10 CO -0.28 0.73 0.57 -0.22 -1.00 0.00 0.00 179.01 178.81 3n4t h LYS 11 N 0.61 1.01 -0.42 2.33 1.63 -0.36 -0.90 116.57 120.47 3n4t h LYS 11 Ca 0.14 -0.06 -0.11 0.00 -0.85 0.00 0.00 60.65 59.77 3n4t h LYS 11 Cb 0.33 -0.23 -0.01 0.00 -0.60 0.00 0.00 32.23 31.72 3n4t h LYS 11 CO 0.00 0.67 -0.16 0.00 -3.45 0.00 0.00 179.45 176.51 3n4t h ALA 12 N 1.51 0.59 0.00 5.00 0.00 0.19 -2.93 119.26 123.61 3n4t h ALA 12 Ca 0.37 -0.35 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 3n4t h ALA 12 Cb 0.13 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 3n4t h ALA 12 CO -0.12 0.52 -0.28 0.82 0.00 0.00 0.00 179.25 180.18 3n4t h ILE 13 N 0.67 0.73 -0.04 0.00 2.04 -0.92 -2.98 117.51 117.02 3n4t h ILE 13 Ca 0.10 -1.23 -0.15 0.00 1.00 0.00 0.00 64.86 64.59 3n4t h ILE 13 Cb 0.71 1.78 -0.01 0.00 -0.74 0.00 0.00 36.82 38.56 3n4t h ILE 13 CO 0.05 0.28 -0.63 -0.08 0.00 0.00 0.00 178.15 177.77 3n4t h GLU 14 N 0.00 0.15 -0.51 2.37 4.81 -0.99 -1.34 114.58 119.07 3n4t h GLU 14 Ca -0.00 -0.11 0.09 0.00 -0.13 0.00 0.00 59.36 59.20 3n4t h GLU 14 Cb 0.76 0.02 -0.07 0.00 0.63 0.00 0.00 28.75 30.09 3n4t h GLU 14 CO 0.04 0.74 0.12 0.37 -0.73 0.00 0.00 179.01 179.54 3n4t h GLN 15 N 0.11 0.25 0.00 1.92 4.15 -1.44 -1.95 115.11 118.16 3n4t h GLN 15 Ca -0.01 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.40 3n4t h GLN 15 Cb 1.14 -0.06 0.00 0.00 0.21 0.00 0.00 27.48 28.77 3n4t h GLN 15 CO 0.09 0.17 -1.49 1.28 -1.93 0.00 0.00 178.83 176.95 3n4t n LEU 16 N -5.09 0.36 -3.17 -2.39 7.99 -1.24 -4.66 117.00 108.79 3n4t n LEU 16 Ca 0.06 -0.20 -0.22 0.00 -0.01 0.00 0.00 56.01 55.64 3n4t n LEU 16 Cb 0.25 0.00 -0.05 0.00 -0.11 0.00 0.00 43.42 43.51 3n4t n LEU 16 CO 0.21 0.09 -0.15 -1.22 -1.51 0.00 0.00 177.39 174.80 3n4t n TYR 17 N -1.88 1.02 0.32 -1.77 4.01 -0.51 -4.92 117.16 113.43 3n4t n TYR 17 Ca -0.01 -3.82 0.16 0.00 -0.16 0.00 0.00 57.90 54.07 3n4t n TYR 17 Cb 0.42 -0.43 0.68 0.00 -0.31 0.00 0.00 39.34 39.70 3n4t n TYR 17 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 3n4t h PRO 18 N 3.35 0.00 -0.02 -0.72 0.14 -1.55 -2.41 132.00 130.79 3n4t h PRO 18 Ca 0.11 0.00 0.00 0.00 0.14 0.00 0.00 66.00 66.25 3n4t h PRO 18 Cb 0.84 0.00 0.00 0.00 0.14 0.00 0.00 31.00 31.98 3n4t h PRO 18 CO 0.57 0.00 -0.17 -3.47 0.14 0.00 0.00 178.00 175.08 3n4t n ASP 19 N -2.71 1.98 -4.61 1.44 2.03 -1.26 -4.86 116.55 108.55 3n4t n ASP 19 Ca 0.00 -1.53 -0.43 0.00 0.52 0.00 0.00 54.79 53.35 3n4t n ASP 19 Cb 0.22 0.14 -0.03 0.00 -0.72 0.00 0.00 41.12 40.74 3n4t n ASP 19 CO 0.00 0.00 0.00 0.12 -1.92 0.00 0.00 177.20 175.40 3n4t s PHE 20 N -2.22 3.04 -0.21 -0.67 5.36 -0.91 -5.00 117.98 117.38 3n4t s PHE 20 Ca 0.28 0.86 -0.26 0.00 -0.96 0.00 0.00 56.93 56.85 3n4t s PHE 20 Cb 0.20 -3.82 -0.00 0.00 -0.34 0.00 0.00 43.02 39.05 3n4t s PHE 20 CO 0.42 -0.90 0.88 0.99 -1.46 0.00 0.00 175.22 175.14 3n4t s THR 21 N 3.72 4.81 -0.44 0.12 2.01 -1.26 -5.01 115.64 119.59 3n4t s THR 21 Ca 0.42 1.70 -0.18 0.00 0.31 0.00 0.00 61.69 63.94 3n4t s THR 21 Cb -0.11 -4.17 0.03 0.00 0.01 0.00 0.00 72.50 68.26 3n4t s THR 21 CO 0.21 -0.07 0.49 -0.63 -0.69 0.00 0.00 174.62 173.93 3n4t s ILE 22 N 2.70 5.03 -0.06 1.82 1.01 -1.26 -4.92 121.20 125.52 3n4t s ILE 22 Ca 0.38 -0.37 -0.02 0.00 0.00 0.00 0.00 60.65 60.64 3n4t s ILE 22 Cb -0.16 -4.12 -0.26 0.00 0.01 0.00 0.00 42.46 37.93 3n4t s ILE 22 CO 0.09 -0.53 0.59 0.78 0.00 0.00 0.00 174.94 175.87 3n4t h ASN 23 N 8.80 0.35 -3.72 3.58 2.35 -1.97 -3.48 115.58 121.49 3n4t h ASN 23 Ca -0.27 -0.65 -0.22 0.00 -0.55 0.00 0.00 56.30 54.62 3n4t h ASN 23 Cb 1.11 -0.11 -0.28 0.00 0.05 0.00 0.00 38.32 39.08 3n4t h ASN 23 CO 0.85 1.57 -0.64 0.42 -1.65 0.00 0.00 177.43 177.97 3n4t s THR 24 N -2.58 -0.01 -0.04 2.81 -4.23 -1.26 -4.97 115.64 105.36 3n4t s THR 24 Ca -0.15 0.03 0.01 0.00 -1.18 0.00 0.00 61.69 60.40 3n4t s THR 24 Cb 0.07 -0.11 0.02 0.00 1.34 0.00 0.00 72.50 73.81 3n4t s THR 24 CO 0.81 0.01 -0.04 -0.51 -0.54 0.00 0.00 174.62 174.35 3n4t s ILE 25 N 0.18 0.48 0.13 2.99 2.07 -1.26 -0.58 121.20 125.21 3n4t s ILE 25 Ca -0.01 -0.11 -0.07 0.00 -1.41 0.00 0.00 60.65 59.05 3n4t s ILE 25 Cb -0.02 -0.50 -0.01 0.00 0.13 0.00 0.00 42.46 42.05 3n4t s ILE 25 CO -0.01 0.20 0.19 -1.83 -1.91 0.00 0.00 174.94 171.59 3n4t s GLU 26 N 0.80 0.99 -0.32 3.50 -1.05 -0.78 -5.00 118.70 116.83 3n4t s GLU 26 Ca -0.10 -1.17 -0.19 0.00 -0.15 0.00 0.00 54.97 53.36 3n4t s GLU 26 Cb -0.13 0.33 -0.01 0.00 -0.44 0.00 0.00 34.13 33.88 3n4t s GLU 26 CO 0.00 -0.33 0.55 0.42 0.95 0.00 0.00 175.26 176.85 3n4t s ILE 27 N -3.95 5.00 0.14 1.83 1.01 -1.26 -0.42 121.20 123.55 3n4t s ILE 27 Ca 0.14 0.59 0.07 0.00 0.00 0.00 0.00 60.65 61.46 3n4t s ILE 27 Cb 0.05 -3.95 -0.19 0.00 0.01 0.00 0.00 42.46 38.38 3n4t s ILE 27 CO -0.03 -0.14 1.32 -1.28 0.00 0.00 0.00 174.94 174.81 3n4t h SER 28 N 8.31 0.01 0.00 3.58 0.87 -1.01 -3.46 113.55 121.85 3n4t h SER 28 Ca -0.28 -0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.27 3n4t h SER 28 Cb 1.13 -0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.08 3n4t h SER 28 CO 0.77 0.95 0.00 0.61 -0.53 0.00 0.00 176.83 178.64 3n4t n GLY 29 N 1.20 1.16 2.95 5.77 0.00 -1.21 -5.01 105.19 110.04 3n4t n GLY 29 Ca -0.00 -0.97 -0.13 0.00 0.00 0.00 0.00 46.02 44.92 3n4t n GLY 29 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3n4t s GLU 30 N -2.00 0.10 0.00 1.61 2.12 -1.26 -0.20 118.70 119.07 3n4t s GLU 30 Ca 0.00 0.23 0.00 0.00 0.36 0.00 0.00 54.97 55.56 3n4t s GLU 30 Cb 0.00 -0.05 0.00 0.00 0.26 0.00 0.00 34.13 34.34 3n4t s GLU 30 CO 0.00 -0.08 0.00 0.41 -0.54 0.00 0.00 175.26 175.05 3n4t n GLY 31 N 3.54 5.24 0.17 -1.50 0.00 0.41 -5.01 105.19 108.04 3n4t n GLY 31 Ca -0.19 -2.13 -0.04 0.00 0.00 0.00 0.00 46.02 43.67 3n4t n GLY 31 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3n4t h ASN 32 N 0.00 0.23 0.11 1.61 2.35 -2.03 -3.35 115.58 114.50 3n4t h ASN 32 Ca 0.00 -0.12 -0.37 0.00 -0.55 0.00 0.00 56.30 55.26 3n4t h ASN 32 Cb 0.00 -0.06 -0.04 0.00 0.05 0.00 0.00 38.32 38.26 3n4t h ASN 32 CO 0.00 0.74 -2.16 0.47 -1.65 0.00 0.00 177.43 174.83 3n4t n ASP 33 N -3.90 1.83 -4.09 5.81 8.00 -1.26 -4.84 116.55 118.10 3n4t n ASP 33 Ca -0.02 0.10 -0.10 0.00 0.71 0.00 0.00 54.79 55.47 3n4t n ASP 33 Cb 0.58 -0.52 -0.11 0.00 -0.02 0.00 0.00 41.12 41.05 3n4t n ASP 33 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3n4t s ILE 35 N -2.55 5.40 -0.17 0.00 1.01 0.06 -0.44 121.20 124.50 3n4t s ILE 35 Ca -0.01 0.29 -0.07 0.00 0.00 0.00 0.00 60.65 60.86 3n4t s ILE 35 Cb -0.02 -3.49 -0.04 0.00 0.01 0.00 0.00 42.46 38.92 3n4t s ILE 35 CO -0.03 0.49 0.06 0.00 0.00 0.00 0.00 174.94 175.45 3n4t s ALA 36 N -0.09 3.41 -0.17 9.38 0.00 0.72 -0.96 121.76 134.04 3n4t s ALA 36 Ca 0.12 -0.74 -0.01 0.00 0.00 0.00 0.00 51.96 51.33 3n4t s ALA 36 Cb -0.12 -1.89 -0.00 0.00 0.00 0.00 0.00 23.12 21.11 3n4t s ALA 36 CO 0.02 0.22 -0.12 0.71 0.00 0.00 0.00 175.76 176.58 3n4t s TYR 37 N 0.26 2.84 -0.19 0.00 2.02 0.67 -0.33 117.35 122.62 3n4t s TYR 37 Ca 0.04 -1.01 -0.22 0.00 -0.37 0.00 0.00 57.07 55.50 3n4t s TYR 37 Cb -0.12 -1.95 -0.02 0.00 -0.40 0.00 0.00 41.96 39.47 3n4t s TYR 37 CO 0.00 -0.49 0.69 -2.00 -1.57 0.00 0.00 175.55 172.19 3n4t s GLU 38 N 0.99 4.23 -0.09 -0.62 2.12 0.44 -0.29 118.70 125.48 3n4t s GLU 38 Ca -0.02 0.73 0.02 0.00 0.36 0.00 0.00 54.97 56.07 3n4t s GLU 38 Cb -0.15 -3.58 -0.02 0.00 0.26 0.00 0.00 34.13 30.64 3n4t s GLU 38 CO -0.02 -0.28 -0.16 0.42 -0.54 0.00 0.00 175.26 174.68 3n4t s ILE 39 N 2.03 2.85 -1.50 -3.70 1.01 -0.19 -1.88 121.20 119.82 3n4t s ILE 39 Ca 0.31 -0.76 0.00 0.00 0.00 0.00 0.00 60.65 60.20 3n4t s ILE 39 Cb -0.16 -2.14 0.00 0.00 0.01 0.00 0.00 42.46 40.17 3n4t s ILE 39 CO 0.11 0.56 0.00 0.59 0.00 0.00 0.00 174.94 176.19 3n4t n ASN 40 N 3.04 -4.24 -1.75 3.58 3.02 0.26 -0.22 115.26 118.94 3n4t n ASN 40 Ca -0.18 0.35 -0.14 0.00 -0.03 0.00 0.00 54.58 54.59 3n4t n ASN 40 Cb 0.52 -3.71 -0.04 0.00 -0.61 0.00 0.00 39.78 35.95 3n4t n ASN 40 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 3n4t n ARG 41 N -1.74 -1.59 0.00 3.52 5.12 -1.26 -4.77 116.66 115.94 3n4t n ARG 41 Ca -0.14 0.75 0.00 0.00 -1.93 0.00 0.00 57.85 56.53 3n4t n ARG 41 Cb 0.51 -5.12 0.00 0.00 -1.16 0.00 0.00 32.46 26.68 3n4t n ARG 41 CO 0.00 0.00 0.00 -0.25 -1.93 0.00 0.00 177.63 175.45 3n4t n ASP 42 N -0.98 4.46 -4.18 0.55 8.00 0.69 -4.96 116.55 120.13 3n4t n ASP 42 Ca -0.14 0.00 -0.19 0.00 0.71 0.00 0.00 54.79 55.17 3n4t n ASP 42 Cb 0.51 0.48 -0.12 0.00 -0.02 0.00 0.00 41.12 41.96 3n4t n ASP 42 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3n4t s PHE 43 N -1.88 1.26 -0.27 1.24 0.08 -0.63 -1.16 117.98 116.61 3n4t s PHE 43 Ca 0.00 -0.47 -0.06 0.00 0.12 0.00 0.00 56.93 56.52 3n4t s PHE 43 Cb 0.00 -0.70 0.00 0.00 -0.57 0.00 0.00 43.02 41.75 3n4t s PHE 43 CO 0.00 0.07 0.05 0.42 -0.10 0.00 0.00 175.22 175.66 3n4t s ILE 44 N -1.35 3.86 -0.30 0.64 -1.09 0.18 -1.02 121.20 122.12 3n4t s ILE 44 Ca -0.01 -0.60 -0.11 0.00 -2.23 0.00 0.00 60.65 57.71 3n4t s ILE 44 Cb -0.10 -2.92 -0.03 0.00 -1.58 0.00 0.00 42.46 37.83 3n4t s ILE 44 CO 0.02 0.18 0.19 -0.36 -1.23 0.00 0.00 174.94 173.75 3n4t s PHE 45 N 1.50 3.20 -0.18 3.97 0.08 0.60 0.34 117.98 127.49 3n4t s PHE 45 Ca 0.04 -0.13 -0.13 0.00 0.12 0.00 0.00 56.93 56.83 3n4t s PHE 45 Cb -0.16 -2.39 -0.05 0.00 -0.57 0.00 0.00 43.02 39.85 3n4t s PHE 45 CO 0.01 -0.28 0.24 0.15 -0.10 0.00 0.00 175.22 175.24 3n4t s LYS 46 N 1.71 4.22 -0.11 0.44 1.02 0.06 -0.24 119.74 126.84 3n4t s LYS 46 Ca 0.06 -0.02 0.00 0.00 0.02 0.00 0.00 55.97 56.03 3n4t s LYS 46 Cb -0.16 -3.44 -0.02 0.00 -0.52 0.00 0.00 37.83 33.68 3n4t s LYS 46 CO 0.09 0.22 -0.12 -0.06 -0.92 0.00 0.00 175.35 174.57 3n4t s PHE 47 N 0.55 2.82 0.41 3.18 0.08 -0.13 -2.19 117.98 122.70 3n4t s PHE 47 Ca 0.13 -0.45 -0.23 0.00 0.12 0.00 0.00 56.93 56.51 3n4t s PHE 47 Cb -0.13 -1.80 -0.10 0.00 -0.57 0.00 0.00 43.02 40.42 3n4t s PHE 47 CO 0.02 -0.07 0.98 -2.14 -0.10 0.00 0.00 175.22 173.92 3n4t s PRO 48 N 0.04 4.23 0.00 0.24 0.02 -1.26 -0.76 135.00 137.51 3n4t s PRO 48 Ca -0.04 1.28 0.24 0.00 0.02 0.00 0.00 61.00 62.50 3n4t s PRO 48 Cb -0.14 -2.37 0.32 0.00 0.02 0.00 0.00 34.50 32.33 3n4t s PRO 48 CO 0.04 -0.04 1.34 1.63 -0.33 0.00 0.00 177.00 179.63 3n4t n LYS 49 N -0.32 2.34 0.00 5.54 5.02 0.67 -4.85 118.16 126.57 3n4t n LYS 49 Ca 0.06 -1.98 0.00 0.00 -2.02 0.00 0.00 58.31 54.37 3n4t n LYS 49 Cb 0.52 -1.48 0.00 0.00 -0.02 0.00 0.00 35.03 34.05 3n4t n LYS 49 CO 0.00 0.00 0.00 -2.39 -0.52 0.00 0.00 177.40 174.49 3n4t n HIS 50 N 1.32 0.00 -0.18 2.13 1.44 -1.26 -0.28 115.22 118.39 3n4t n HIS 50 Ca 0.16 0.00 -0.05 0.00 -2.01 0.00 0.00 57.72 55.82 3n4t n HIS 50 Cb 0.59 0.00 0.02 0.00 0.12 0.00 0.00 29.99 30.71 3n4t n HIS 50 CO 0.00 0.00 0.00 0.77 -2.81 0.00 0.00 176.34 174.30 3n4t h SER 51 N 0.00 -0.95 -0.53 4.39 0.02 -1.94 0.90 113.55 115.44 3n4t h SER 51 Ca 0.00 0.20 0.02 0.00 -0.84 0.00 0.00 61.79 61.17 3n4t h SER 51 Cb 0.00 0.49 -0.03 0.00 0.14 0.00 0.00 62.40 63.01 3n4t h SER 51 CO 0.00 -0.28 0.35 -0.09 -1.14 0.00 0.00 176.83 175.67 3n4t h ARG 52 N -0.14 0.65 -0.56 3.45 2.43 -1.97 -0.26 114.38 117.98 3n4t h ARG 52 Ca 0.23 -0.04 -0.08 0.00 -0.81 0.00 0.00 59.98 59.28 3n4t h ARG 52 Cb 0.52 -0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 29.90 3n4t h ARG 52 CO -0.62 0.43 0.02 0.78 -1.51 0.00 0.00 179.97 179.07 3n4t h GLY 53 N 0.67 1.05 1.13 2.80 0.00 -1.15 -2.12 103.07 105.44 3n4t h GLY 53 Ca 0.20 -0.76 0.00 0.00 0.00 0.00 0.00 47.33 46.78 3n4t h GLY 53 CO -0.05 0.70 0.55 0.23 0.00 0.00 0.00 176.54 177.97 3n4t h SER 54 N 0.85 1.02 -0.56 0.19 0.87 0.41 -1.36 113.55 114.96 3n4t h SER 54 Ca 0.16 -0.04 -0.05 0.00 -1.23 0.00 0.00 61.79 60.63 3n4t h SER 54 Cb 0.51 -0.26 -0.02 0.00 -0.44 0.00 0.00 62.40 62.19 3n4t h SER 54 CO 0.02 0.76 0.16 0.74 -0.53 0.00 0.00 176.83 177.98 3n4t h THR 55 N 1.19 1.24 -0.71 2.23 2.02 -0.86 -1.44 112.91 116.58 3n4t h THR 55 Ca 0.32 -0.83 -0.05 0.00 0.77 0.00 0.00 66.41 66.61 3n4t h THR 55 Cb -0.10 0.72 -0.03 0.00 -1.74 0.00 0.00 68.15 66.99 3n4t h THR 55 CO -0.06 0.31 0.24 0.78 0.37 0.00 0.00 175.52 177.15 3n4t h ASN 56 N 0.79 1.00 -0.62 4.18 2.35 -1.03 -1.50 115.58 120.75 3n4t h ASN 56 Ca 0.18 -0.17 -0.01 0.00 -0.55 0.00 0.00 56.30 55.75 3n4t h ASN 56 Cb 0.30 -0.26 -0.03 0.00 0.05 0.00 0.00 38.32 38.38 3n4t h ASN 56 CO -0.00 0.92 0.36 0.25 -1.65 0.00 0.00 177.43 177.30 3n4t h LEU 57 N 1.04 0.76 -0.03 1.61 5.85 -1.13 0.52 115.31 123.93 3n4t h LEU 57 Ca 0.23 -0.08 0.02 0.00 0.84 0.00 0.00 57.88 58.89 3n4t h LEU 57 Cb 0.27 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.09 3n4t h LEU 57 CO -0.01 0.62 -0.06 0.15 -0.34 0.00 0.00 178.44 178.79 3n4t h PHE 58 N 0.84 -0.15 -0.93 1.25 3.57 -0.90 0.11 116.94 120.73 3n4t h PHE 58 Ca 0.22 0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.74 3n4t h PHE 58 Cb 0.01 0.07 -0.05 0.00 2.79 0.00 0.00 35.95 38.78 3n4t h PHE 58 CO -0.01 -0.10 0.61 -0.91 -2.23 0.00 0.00 178.31 175.67 3n4t h ASN 59 N -0.10 1.05 -0.38 0.41 -0.26 -1.17 0.21 115.58 115.35 3n4t h ASN 59 Ca 0.04 -0.02 0.00 0.00 -0.56 0.00 0.00 56.30 55.76 3n4t h ASN 59 Cb 0.15 -0.26 -0.02 0.00 -1.06 0.00 0.00 38.32 37.13 3n4t h ASN 59 CO -0.09 0.75 0.25 -0.08 -1.06 0.00 0.00 177.43 177.20 3n4t h GLU 60 N 1.24 0.50 0.02 0.81 4.81 -0.25 0.10 114.58 121.81 3n4t h GLU 60 Ca 0.35 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.54 3n4t h GLU 60 Cb -0.11 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.16 3n4t h GLU 60 CO -0.08 0.34 -0.01 0.28 -0.73 0.00 0.00 179.01 178.80 3n4t h VAL 61 N 0.51 1.09 -0.40 0.32 2.07 -0.42 -0.33 116.25 119.08 3n4t h VAL 61 Ca 0.14 -0.35 0.07 0.00 0.82 0.00 0.00 66.70 67.38 3n4t h VAL 61 Cb -0.05 1.33 -0.06 0.00 -1.52 0.00 0.00 31.29 30.99 3n4t h VAL 61 CO -0.03 0.09 0.05 -1.13 0.02 0.00 0.00 177.57 176.57 3n4t h ASN 62 N -0.18 -0.05 -0.13 0.57 -0.73 -0.81 -2.14 115.58 112.11 3n4t h ASN 62 Ca -0.00 0.08 -0.03 0.00 1.87 0.00 0.00 56.30 58.21 3n4t h ASN 62 Cb 0.17 0.12 -0.00 0.00 0.27 0.00 0.00 38.32 38.87 3n4t h ASN 62 CO 0.00 0.01 -0.04 0.40 -0.37 0.00 0.00 177.43 177.43 3n4t h ILE 63 N 0.17 1.30 -0.98 2.57 2.04 -0.67 -2.28 117.51 119.67 3n4t h ILE 63 Ca 0.19 -1.02 0.03 0.00 1.00 0.00 0.00 64.86 65.06 3n4t h ILE 63 Cb 0.25 1.71 -0.05 0.00 -0.74 0.00 0.00 36.82 37.99 3n4t h ILE 63 CO -0.28 0.30 0.64 -0.07 0.00 0.00 0.00 178.15 178.74 3n4t h LEU 64 N -0.07 1.08 -0.49 1.44 3.38 -1.00 -0.86 115.31 118.80 3n4t h LEU 64 Ca 0.03 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 3n4t h LEU 64 Cb 0.48 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.95 3n4t h LEU 64 CO 0.02 0.75 0.24 0.11 0.09 0.00 0.00 178.44 179.65 3n4t h LYS 65 N 1.26 0.70 -0.42 1.13 1.57 -1.36 -0.93 116.57 118.52 3n4t h LYS 65 Ca 0.38 -0.10 -0.06 0.00 -1.87 0.00 0.00 60.65 59.00 3n4t h LYS 65 Cb -0.04 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.12 3n4t h LYS 65 CO -0.11 0.58 0.01 -0.09 -0.57 0.00 0.00 179.45 179.28 3n4t h ARG 66 N 0.65 0.67 -0.46 3.15 9.65 -0.75 -2.91 114.38 124.38 3n4t h ARG 66 Ca 0.17 -0.16 0.00 0.00 -1.10 0.00 0.00 59.98 58.89 3n4t h ARG 66 Cb 0.11 -0.09 0.00 0.00 -1.39 0.00 0.00 29.97 28.60 3n4t h ARG 66 CO -0.02 0.68 0.00 0.44 2.80 0.00 0.00 179.97 183.87 3n4t n ILE 67 N -4.25 0.71 -1.55 1.20 -5.35 -0.40 -4.95 119.36 104.77 3n4t n ILE 67 Ca 0.02 -0.86 -0.51 0.00 -0.27 0.00 0.00 62.75 61.14 3n4t n ILE 67 Cb 0.27 0.77 -0.05 0.00 -1.74 0.00 0.00 39.64 38.89 3n4t n ILE 67 CO 0.00 0.00 0.00 1.57 -1.76 0.00 0.00 176.55 176.36 3n4t n HIS 68 N 1.30 1.02 -1.72 4.28 -0.00 -0.36 -1.23 115.22 118.51 3n4t n HIS 68 Ca 0.19 0.77 -0.16 0.00 0.46 0.00 0.00 57.72 58.97 3n4t n HIS 68 Cb 0.55 -2.22 -0.05 0.00 -0.12 0.00 0.00 29.99 28.15 3n4t n HIS 68 CO 0.00 0.00 0.00 0.09 0.46 0.00 0.00 176.34 176.89 3n4t n ASN 69 N 1.98 -4.44 -0.19 0.26 4.13 -1.26 -4.80 115.26 110.94 3n4t n ASN 69 Ca 0.16 0.32 0.09 0.00 1.68 0.00 0.00 54.58 56.84 3n4t n ASN 69 Cb 0.21 -3.94 -0.06 0.00 -1.54 0.00 0.00 39.78 34.45 3n4t n ASN 69 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 3n4t n LYS 70 N -2.30 1.17 -4.32 3.52 5.02 -0.36 -5.03 118.16 115.86 3n4t n LYS 70 Ca -0.17 -0.39 -0.29 0.00 -2.02 0.00 0.00 58.31 55.45 3n4t n LYS 70 Cb 0.56 -1.37 -0.11 0.00 -0.02 0.00 0.00 35.03 34.09 3n4t n LYS 70 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3n4t s LEU 71 N -2.61 2.70 0.00 -0.35 1.43 -1.26 -4.95 118.68 113.65 3n4t s LEU 71 Ca 0.11 -0.61 0.23 0.00 -1.03 0.00 0.00 54.13 52.83 3n4t s LEU 71 Cb 0.15 -1.50 1.29 0.00 0.03 0.00 0.00 46.19 46.15 3n4t s LEU 71 CO 0.64 0.16 1.84 -0.81 0.23 0.00 0.00 176.35 178.41 3n4t n PRO 72 N 0.60 1.15 -4.59 1.29 -0.04 -1.26 -4.71 135.00 127.44 3n4t n PRO 72 Ca -0.14 -0.22 -0.23 0.00 -0.04 0.00 0.00 63.50 62.87 3n4t n PRO 72 Cb 0.54 -1.38 -0.14 0.00 -0.04 0.00 0.00 33.50 32.47 3n4t n PRO 72 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3n4t s LEU 73 N -1.73 2.11 0.30 1.53 1.43 -1.26 -5.01 118.68 116.05 3n4t s LEU 73 Ca 0.35 -0.40 -0.29 0.00 -1.03 0.00 0.00 54.13 52.76 3n4t s LEU 73 Cb 0.17 -0.78 -0.13 0.00 0.03 0.00 0.00 46.19 45.47 3n4t s LEU 73 CO 0.27 0.13 1.19 -2.65 0.23 0.00 0.00 176.35 175.52 3n4t n PRO 74 N 2.22 1.78 -4.25 1.29 -0.02 -1.26 -4.79 135.00 129.97 3n4t n PRO 74 Ca -0.16 0.62 -0.14 0.00 -2.02 0.00 0.00 63.50 61.80 3n4t n PRO 74 Cb 0.54 -2.13 -0.10 0.00 -0.02 0.00 0.00 33.50 31.79 3n4t n PRO 74 CO 0.00 0.00 0.00 0.96 1.98 0.00 0.00 175.50 178.44 3n4t s ILE 75 N -0.94 1.17 0.59 4.25 -4.36 -1.26 -1.49 121.20 119.16 3n4t s ILE 75 Ca 0.59 -2.04 -0.20 0.00 -0.26 0.00 0.00 60.65 58.73 3n4t s ILE 75 Cb -0.64 -1.83 -0.03 0.00 1.25 0.00 0.00 42.46 41.21 3n4t s ILE 75 CO 0.60 -0.73 1.33 -2.84 0.24 0.00 0.00 174.94 173.54 3n4t s PRO 76 N -3.69 2.88 -0.03 0.37 0.02 -1.26 -5.01 135.00 128.28 3n4t s PRO 76 Ca 0.16 2.17 0.01 0.00 0.02 0.00 0.00 61.00 63.36 3n4t s PRO 76 Cb 0.02 -2.07 -0.03 0.00 0.02 0.00 0.00 34.50 32.43 3n4t s PRO 76 CO 0.01 -1.38 -0.03 -2.00 -0.33 0.00 0.00 177.00 173.27 3n4t s GLU 77 N -3.12 2.76 -0.24 5.54 2.12 -1.26 -4.91 118.70 119.59 3n4t s GLU 77 Ca 0.77 -0.59 -0.24 0.00 0.36 0.00 0.00 54.97 55.27 3n4t s GLU 77 Cb -0.39 -2.64 -0.01 0.00 0.26 0.00 0.00 34.13 31.35 3n4t s GLU 77 CO 0.44 0.64 0.79 0.08 -0.54 0.00 0.00 175.26 176.68 3n4t s VAL 78 N -0.97 4.87 -0.03 3.70 1.01 -1.26 -0.52 120.40 127.19 3n4t s VAL 78 Ca 0.16 1.50 0.01 0.00 0.00 0.00 0.00 61.98 63.66 3n4t s VAL 78 Cb -0.11 -4.09 -0.03 0.00 0.00 0.00 0.00 36.38 32.15 3n4t s VAL 78 CO 0.06 -0.04 -0.01 0.52 0.00 0.00 0.00 175.10 175.63 3n4t n VAL 79 N 5.18 0.20 -4.78 2.92 0.31 0.18 -4.97 118.33 117.37 3n4t n VAL 79 Ca 0.04 -0.10 -0.28 0.00 -0.01 0.00 0.00 64.34 63.99 3n4t n VAL 79 Cb 0.48 -0.75 -0.14 0.00 -0.91 0.00 0.00 33.84 32.52 3n4t n VAL 79 CO 0.00 0.00 0.00 -0.36 -1.32 0.00 0.00 176.83 175.15 3n4t s PHE 80 N -2.07 2.14 -0.03 3.52 0.08 -0.31 -4.96 117.98 116.35 3n4t s PHE 80 Ca -0.03 -0.40 0.01 0.00 0.12 0.00 0.00 56.93 56.62 3n4t s PHE 80 Cb 0.01 -1.27 0.02 0.00 -0.57 0.00 0.00 43.02 41.21 3n4t s PHE 80 CO 0.10 0.13 -0.01 0.95 -0.10 0.00 0.00 175.22 176.28 3n4t s THR 81 N -0.82 0.25 0.61 0.64 -4.23 -1.26 -0.33 115.64 110.50 3n4t s THR 81 Ca 0.10 0.04 -0.09 0.00 -1.18 0.00 0.00 61.69 60.56 3n4t s THR 81 Cb -0.10 -0.33 -0.02 0.00 1.34 0.00 0.00 72.50 73.40 3n4t s THR 81 CO 0.02 0.16 0.98 -0.83 -0.54 0.00 0.00 174.62 174.41 3n4t s GLY 82 N 0.95 1.61 0.51 3.99 0.00 0.10 -4.97 107.32 109.51 3n4t s GLY 82 Ca -0.10 -0.31 -0.12 0.00 0.00 0.00 0.00 44.72 44.19 3n4t s GLY 82 CO -0.01 -0.03 0.92 1.06 0.00 0.00 0.00 173.10 175.03 3n4t s MET 83 N -5.11 3.78 0.93 2.90 -1.94 -1.26 -4.25 119.30 114.34 3n4t s MET 83 Ca 0.54 0.70 -0.11 0.00 -1.71 0.00 0.00 55.69 55.11 3n4t s MET 83 Cb -0.11 -2.21 0.15 0.00 2.01 0.00 0.00 34.83 34.67 3n4t s MET 83 CO 0.51 -0.28 1.09 -2.14 -0.01 0.00 0.00 175.02 174.19 3n4t s PRO 84 N -4.36 0.97 -0.26 2.03 0.02 -1.25 -1.82 135.00 130.33 3n4t s PRO 84 Ca 0.55 0.91 -0.19 0.00 0.02 0.00 0.00 61.00 62.29 3n4t s PRO 84 Cb -0.10 -1.77 0.07 0.00 0.02 0.00 0.00 34.50 32.72 3n4t s PRO 84 CO 0.38 -2.46 0.66 -1.54 -0.33 0.00 0.00 177.00 173.71 3n4t s SER 85 N -3.22 -0.79 0.00 2.53 1.04 -0.19 -4.85 113.70 108.22 3n4t s SER 85 Ca 0.64 1.39 0.00 0.00 0.48 0.00 0.00 55.95 58.46 3n4t s SER 85 Cb -0.19 1.34 0.00 0.00 0.10 0.00 0.00 66.02 67.26 3n4t s SER 85 CO 0.58 -0.23 0.00 -0.62 0.98 0.00 0.00 173.24 173.95 3n4t n GLU 86 N 3.46 0.00 0.07 4.02 4.71 -1.26 0.48 120.64 132.12 3n4t n GLU 86 Ca -0.17 0.00 0.12 0.00 -0.01 0.00 0.00 57.16 57.10 3n4t n GLU 86 Cb 0.57 0.00 0.26 0.00 -1.01 0.00 0.00 31.44 31.26 3n4t n GLU 86 CO 0.00 0.00 0.00 0.25 0.09 0.00 0.00 177.13 177.47 3n4t n THR 87 N 0.00 0.40 -2.69 2.62 -2.24 -1.26 -4.77 114.28 106.34 3n4t n THR 87 Ca 0.00 -0.26 -0.43 0.00 -2.27 0.00 0.00 64.05 61.10 3n4t n THR 87 Cb 0.00 -0.26 -0.03 0.00 -2.10 0.00 0.00 70.33 67.94 3n4t n THR 87 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 3n4t s TYR 88 N -3.13 3.07 0.37 4.78 4.12 0.18 -4.85 117.35 121.89 3n4t s TYR 88 Ca 0.08 0.97 0.34 0.00 0.02 0.00 0.00 57.07 58.48 3n4t s TYR 88 Cb 0.13 -3.79 1.66 0.00 -1.52 0.00 0.00 41.96 38.45 3n4t s TYR 88 CO 0.68 -0.86 2.11 1.96 0.02 0.00 0.00 175.55 179.46 3n4t h GLN 89 N 8.40 0.00 -1.84 -0.62 4.20 -1.81 -0.48 115.11 122.96 3n4t h GLN 89 Ca -0.22 0.00 0.06 0.00 0.06 0.00 0.00 58.65 58.55 3n4t h GLN 89 Cb 1.07 0.00 -0.21 0.00 0.30 0.00 0.00 27.48 28.63 3n4t h GLN 89 CO 1.03 0.06 -0.20 1.41 -0.67 0.00 0.00 178.83 180.46 3n4t s MET 90 N -3.99 0.54 0.44 1.46 0.00 -1.26 -3.92 119.30 112.57 3n4t s MET 90 Ca -0.02 1.29 0.23 0.00 0.00 0.00 0.00 55.69 57.19 3n4t s MET 90 Cb 0.12 0.71 1.00 0.00 0.00 0.00 0.00 34.83 36.66 3n4t s MET 90 CO 0.53 -0.31 1.87 0.66 0.00 0.00 0.00 175.02 177.77 3n4t h SER 91 N 8.02 0.00 -5.70 1.11 4.64 -1.54 -3.44 113.55 116.64 3n4t h SER 91 Ca -0.19 0.00 0.30 0.00 -0.47 0.00 0.00 61.79 61.43 3n4t h SER 91 Cb 1.12 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 63.10 3n4t h SER 91 CO 0.14 0.24 0.77 0.72 -0.87 0.00 0.00 176.83 177.83 3n4t s PHE 92 N -3.81 -0.05 -0.13 4.77 -0.12 -1.26 -4.34 117.98 113.04 3n4t s PHE 92 Ca -0.01 -0.10 -0.15 0.00 -0.05 0.00 0.00 56.93 56.63 3n4t s PHE 92 Cb 0.11 0.57 0.04 0.00 -0.63 0.00 0.00 43.02 43.11 3n4t s PHE 92 CO 0.64 -0.38 0.40 0.00 -0.05 0.00 0.00 175.22 175.82 3n4t s ALA 93 N -2.52 -0.99 -0.19 1.99 0.00 -0.93 0.02 121.76 119.14 3n4t s ALA 93 Ca 0.15 1.03 -0.03 0.00 0.00 0.00 0.00 51.96 53.11 3n4t s ALA 93 Cb 0.03 -0.54 -0.01 0.00 0.00 0.00 0.00 23.12 22.60 3n4t s ALA 93 CO -0.02 -0.20 -0.06 0.20 0.00 0.00 0.00 175.76 175.67 3n4t s GLY 94 N -0.03 1.60 0.14 0.00 0.00 0.55 -0.76 107.32 108.83 3n4t s GLY 94 Ca -0.02 -1.07 0.08 0.00 0.00 0.00 0.00 44.72 43.71 3n4t s GLY 94 CO 0.01 0.23 -0.08 -1.36 0.00 0.00 0.00 173.10 171.91 3n4t s PHE 95 N 1.10 2.72 0.22 1.90 0.08 0.15 -0.65 117.98 123.51 3n4t s PHE 95 Ca 0.01 -0.17 -0.32 0.00 0.12 0.00 0.00 56.93 56.57 3n4t s PHE 95 Cb -0.15 -1.37 -0.14 0.00 -0.57 0.00 0.00 43.02 40.79 3n4t s PHE 95 CO -0.01 0.47 1.36 2.41 -0.10 0.00 0.00 175.22 179.35 3n4t n THR 96 N 0.32 0.89 -2.77 0.64 -1.04 0.32 0.49 114.28 113.12 3n4t n THR 96 Ca -0.12 -0.22 -0.42 0.00 -2.04 0.00 0.00 64.05 61.25 3n4t n THR 96 Cb 0.54 -1.32 -0.03 0.00 -1.82 0.00 0.00 70.33 67.70 3n4t n THR 96 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 3n4t s LYS 97 N -0.34 4.15 0.13 -2.82 2.20 -0.31 -4.49 119.74 118.26 3n4t s LYS 97 Ca 0.70 1.05 -0.17 0.00 -0.36 0.00 0.00 55.97 57.19 3n4t s LYS 97 Cb -0.70 -3.68 -0.07 0.00 -1.51 0.00 0.00 37.83 31.87 3n4t s LYS 97 CO 0.50 -0.66 0.58 0.42 -0.36 0.00 0.00 175.35 175.83 3n4t s ILE 98 N 3.14 4.78 0.34 5.43 1.01 -1.26 -4.94 121.20 129.70 3n4t s ILE 98 Ca 0.40 1.03 -0.18 0.00 0.00 0.00 0.00 60.65 61.89 3n4t s ILE 98 Cb -0.14 -3.81 -0.10 0.00 0.01 0.00 0.00 42.46 38.42 3n4t s ILE 98 CO 0.09 0.36 0.81 -0.54 0.00 0.00 0.00 174.94 175.66 3n4t s LYS 99 N -1.64 4.14 0.00 2.79 -0.14 -1.26 -4.99 119.74 118.63 3n4t s LYS 99 Ca 0.35 0.87 0.00 0.00 -1.36 0.00 0.00 55.97 55.83 3n4t s LYS 99 Cb -0.17 -2.44 0.00 0.00 -1.68 0.00 0.00 37.83 33.55 3n4t s LYS 99 CO 0.19 0.14 0.00 0.41 -0.76 0.00 0.00 175.35 175.33 3n4t n GLY 100 N -0.25 3.20 3.35 -3.33 0.00 -1.26 -4.73 105.19 102.16 3n4t n GLY 100 Ca 0.04 -1.80 -0.28 0.00 0.00 0.00 0.00 46.02 43.98 3n4t n GLY 100 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3n4t s VAL 101 N -2.03 2.07 0.20 1.61 0.11 0.24 -4.71 120.40 117.89 3n4t s VAL 101 Ca 0.00 -1.58 -0.33 0.00 -2.93 0.00 0.00 61.98 57.14 3n4t s VAL 101 Cb 0.00 -1.82 -0.14 0.00 -1.53 0.00 0.00 36.38 32.89 3n4t s VAL 101 CO 0.00 0.13 1.37 -2.65 -3.33 0.00 0.00 175.10 170.62 3n4t n PRO 102 N 1.22 1.76 -2.27 1.54 -0.02 -1.26 0.10 135.00 136.08 3n4t n PRO 102 Ca -0.18 0.63 -0.41 0.00 -2.02 0.00 0.00 63.50 61.51 3n4t n PRO 102 Cb 0.53 -2.26 -0.01 0.00 -0.02 0.00 0.00 33.50 31.74 3n4t n PRO 102 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 3n4t n LEU 103 N 2.36 5.23 -4.64 2.45 7.94 0.14 -4.76 117.00 125.73 3n4t n LEU 103 Ca 0.14 -3.87 -0.39 0.00 -1.11 0.00 0.00 56.01 50.78 3n4t n LEU 103 Cb 0.28 -1.70 0.04 0.00 0.53 0.00 0.00 43.42 42.57 3n4t n LEU 103 CO 0.62 0.20 0.65 0.41 -1.11 0.00 0.00 177.39 178.16 3n4t n THR 104 N 6.18 3.51 -0.19 1.96 -1.04 -1.26 -4.69 114.28 118.75 3n4t n THR 104 Ca 0.49 -0.50 -0.04 0.00 -2.04 0.00 0.00 64.05 61.97 3n4t n THR 104 Cb 0.44 -1.26 0.06 0.00 -1.82 0.00 0.00 70.33 67.75 3n4t n THR 104 CO 0.00 0.00 0.00 -0.65 -0.64 0.00 0.00 175.07 173.78 3n4t h PRO 105 N 0.88 0.59 -0.35 -2.82 0.11 -1.91 0.27 132.00 128.77 3n4t h PRO 105 Ca -0.48 -0.04 0.08 0.00 0.11 0.00 0.00 66.00 65.67 3n4t h PRO 105 Cb 1.35 -0.13 -0.08 0.00 0.11 0.00 0.00 31.00 32.25 3n4t h PRO 105 CO 0.53 0.39 -0.17 1.25 -0.21 0.00 0.00 178.00 179.79 3n4t h LEU 106 N 0.60 -0.58 -1.08 2.35 5.85 -1.94 0.53 115.31 121.04 3n4t h LEU 106 Ca 0.25 0.14 -0.05 0.00 0.84 0.00 0.00 57.88 59.05 3n4t h LEU 106 Cb 0.12 0.32 -0.02 0.00 0.37 0.00 0.00 40.66 41.44 3n4t h LEU 106 CO -0.15 -0.21 0.09 0.25 -0.34 0.00 0.00 178.44 178.08 3n4t h LEU 107 N -0.12 0.69 -0.15 2.25 5.85 -1.79 -2.05 115.31 119.99 3n4t h LEU 107 Ca 0.18 -0.13 -0.01 0.00 0.84 0.00 0.00 57.88 58.75 3n4t h LEU 107 Cb 0.39 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.23 3n4t h LEU 107 CO -0.42 0.71 0.05 0.25 -0.34 0.00 0.00 178.44 178.69 3n4t h LEU 108 N 0.71 0.22 -0.75 2.25 5.85 0.93 -2.84 115.31 121.69 3n4t h LEU 108 Ca 0.16 -0.20 0.00 0.00 0.84 0.00 0.00 57.88 58.67 3n4t h LEU 108 Cb 0.31 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.28 3n4t h LEU 108 CO 0.00 0.37 0.00 0.59 -0.34 0.00 0.00 178.44 179.06 3n4t n ASN 109 N -4.84 0.59 -0.11 1.25 5.03 0.17 -1.82 115.26 115.54 3n4t n ASN 109 Ca -0.05 0.67 0.11 0.00 0.87 0.00 0.00 54.58 56.18 3n4t n ASN 109 Cb 0.14 -0.78 0.12 0.00 -1.02 0.00 0.00 39.78 38.24 3n4t n ASN 109 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 3n4t n ASN 110 N -2.18 0.95 -4.78 6.41 3.02 -0.80 -4.93 115.26 112.95 3n4t n ASN 110 Ca 0.02 -0.77 -0.35 0.00 -0.03 0.00 0.00 54.58 53.45 3n4t n ASN 110 Cb 0.19 0.50 -0.01 0.00 -0.61 0.00 0.00 39.78 39.85 3n4t n ASN 110 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3n4t s LEU 111 N -2.85 3.82 0.52 3.41 1.02 -0.75 -4.99 118.68 118.86 3n4t s LEU 111 Ca 0.13 2.11 -0.22 0.00 0.02 0.00 0.00 54.13 56.18 3n4t s LEU 111 Cb 0.17 -4.52 -0.06 0.00 0.02 0.00 0.00 46.19 41.80 3n4t s LEU 111 CO 0.71 -1.03 1.18 -2.65 0.02 0.00 0.00 176.35 174.58 3n4t n PRO 112 N -1.07 1.45 -0.36 1.29 -0.02 -1.26 -4.77 135.00 130.26 3n4t n PRO 112 Ca 0.10 0.53 0.27 0.00 -2.02 0.00 0.00 63.50 62.38 3n4t n PRO 112 Cb 0.51 -2.35 0.53 0.00 -0.02 0.00 0.00 33.50 32.17 3n4t n PRO 112 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 3n4t h LYS 113 N 1.28 0.29 0.00 -0.52 1.79 -1.96 0.31 116.57 117.76 3n4t h LYS 113 Ca -0.49 -0.02 -0.09 0.00 -2.18 0.00 0.00 60.65 57.88 3n4t h LYS 113 Cb 1.32 -0.06 -0.01 0.00 -1.58 0.00 0.00 32.23 31.90 3n4t h LYS 113 CO 0.56 0.19 -0.47 0.37 -1.08 0.00 0.00 179.45 179.01 3n4t h GLN 114 N 0.29 0.00 -0.03 3.15 5.75 -2.00 -3.07 115.11 119.21 3n4t h GLN 114 Ca 0.71 0.00 -0.18 0.00 -0.15 0.00 0.00 58.65 59.02 3n4t h GLN 114 Cb 1.85 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 30.39 3n4t h GLN 114 CO -0.44 0.41 -0.79 0.77 -2.65 0.00 0.00 178.83 176.13 3n4t h SER 115 N 0.00 0.30 -0.41 -0.69 0.02 -1.28 -2.59 113.55 108.90 3n4t h SER 115 Ca -0.01 -0.22 -0.02 0.00 -0.84 0.00 0.00 61.79 60.70 3n4t h SER 115 Cb 1.33 -0.09 -0.02 0.00 0.14 0.00 0.00 62.40 63.76 3n4t h SER 115 CO 0.05 0.98 0.19 1.56 -1.14 0.00 0.00 176.83 178.47 3n4t h GLN 116 N 0.15 0.60 -0.86 3.45 4.20 -1.47 -1.47 115.11 119.72 3n4t h GLN 116 Ca -0.03 -0.09 0.01 0.00 0.06 0.00 0.00 58.65 58.59 3n4t h GLN 116 Cb 1.38 -0.10 -0.04 0.00 0.30 0.00 0.00 27.48 29.02 3n4t h GLN 116 CO 0.12 0.53 0.57 -0.91 -0.67 0.00 0.00 178.83 178.48 3n4t h ASN 117 N 0.52 0.98 -0.70 1.46 -0.26 -1.48 -1.24 115.58 114.86 3n4t h ASN 117 Ca 0.14 -0.02 -0.06 0.00 -0.56 0.00 0.00 56.30 55.79 3n4t h ASN 117 Cb 0.14 -0.25 -0.03 0.00 -1.06 0.00 0.00 38.32 37.13 3n4t h ASN 117 CO -0.02 0.71 0.20 -0.61 -1.06 0.00 0.00 177.43 176.66 3n4t h GLN 118 N 1.16 1.10 -0.40 0.81 5.75 -1.25 -0.60 115.11 121.67 3n4t h GLN 118 Ca 0.32 -0.25 -0.07 0.00 -0.15 0.00 0.00 58.65 58.50 3n4t h GLN 118 Cb -0.13 -0.15 -0.02 0.00 1.07 0.00 0.00 27.48 28.25 3n4t h GLN 118 CO -0.07 0.95 -0.04 0.00 -2.65 0.00 0.00 178.83 177.03 3n4t h ALA 119 N 1.09 1.18 -0.29 3.38 0.00 -0.73 0.34 119.26 124.24 3n4t h ALA 119 Ca 0.22 -0.26 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 3n4t h ALA 119 Cb 0.33 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 3n4t h ALA 119 CO -0.00 0.53 -0.03 0.00 0.00 0.00 0.00 179.25 179.75 3n4t h ALA 120 N 1.34 0.39 0.25 0.00 0.00 -0.91 -0.86 119.26 119.47 3n4t h ALA 120 Ca 0.12 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 3n4t h ALA 120 Cb 0.44 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 3n4t h ALA 120 CO 0.02 0.17 -0.17 -0.22 0.00 0.00 0.00 179.25 179.05 3n4t h LYS 121 N 0.30 -0.40 -0.86 0.00 3.64 -0.72 -1.41 116.57 117.12 3n4t h LYS 121 Ca 0.08 0.03 0.01 0.00 -1.27 0.00 0.00 60.65 59.50 3n4t h LYS 121 Cb 0.48 0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 32.35 3n4t h LYS 121 CO 0.02 -0.27 0.57 -0.44 -2.27 0.00 0.00 179.45 177.07 3n4t h ASP 122 N -0.42 0.98 -0.21 4.20 3.32 -0.29 -0.84 116.42 123.15 3n4t h ASP 122 Ca -0.02 -0.02 -0.02 0.00 0.02 0.00 0.00 57.03 56.99 3n4t h ASP 122 Cb 0.36 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.65 3n4t h ASP 122 CO 0.01 0.70 0.06 -0.07 -1.72 0.00 0.00 179.24 178.22 3n4t h LEU 123 N 1.15 0.32 -0.28 1.55 4.07 -1.00 -1.07 115.31 120.05 3n4t h LEU 123 Ca 0.32 -0.22 0.00 0.00 0.08 0.00 0.00 57.88 58.07 3n4t h LEU 123 Cb -0.11 -0.08 -0.01 0.00 1.08 0.00 0.00 40.66 41.53 3n4t h LEU 123 CO -0.07 0.45 0.19 0.00 -1.08 0.00 0.00 178.44 177.93 3n4t h ALA 124 N 0.88 0.36 -0.52 1.53 0.00 -0.71 0.57 119.26 121.38 3n4t h ALA 124 Ca 0.07 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.97 3n4t h ALA 124 Cb 0.26 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 3n4t h ALA 124 CO -0.00 -0.17 0.33 -0.09 0.00 0.00 0.00 179.25 179.32 3n4t h ARG 125 N 0.38 0.66 0.16 0.00 2.43 -1.14 0.41 114.38 117.28 3n4t h ARG 125 Ca 0.10 -0.04 0.01 0.00 -0.81 0.00 0.00 59.98 59.24 3n4t h ARG 125 Cb -0.04 -0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 29.34 3n4t h ARG 125 CO -0.02 0.43 -0.19 0.35 -1.51 0.00 0.00 179.97 179.03 3n4t h PHE 126 N 0.68 -0.51 -0.78 2.20 3.57 -0.56 -1.21 116.94 120.33 3n4t h PHE 126 Ca 0.20 0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.72 3n4t h PHE 126 Cb -0.05 0.20 -0.04 0.00 2.79 0.00 0.00 35.95 38.85 3n4t h PHE 126 CO -0.05 -0.29 0.51 -0.07 -2.23 0.00 0.00 178.31 176.19 3n4t h LEU 127 N -0.40 0.88 -0.71 0.59 3.38 -0.42 0.37 115.31 119.00 3n4t h LEU 127 Ca 0.01 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 3n4t h LEU 127 Cb 0.39 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 3n4t h LEU 127 CO -0.07 0.63 0.35 -1.28 0.09 0.00 0.00 178.44 178.15 3n4t h SER 128 N 1.03 0.92 -0.34 -0.43 0.87 -0.01 0.14 113.55 115.74 3n4t h SER 128 Ca 0.29 -0.13 -0.06 0.00 -1.23 0.00 0.00 61.79 60.66 3n4t h SER 128 Cb -0.09 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 61.62 3n4t h SER 128 CO -0.08 0.79 -0.02 -0.33 -0.53 0.00 0.00 176.83 176.66 3n4t h GLU 129 N 0.99 0.61 -0.63 2.24 4.39 -0.72 -2.57 114.58 118.88 3n4t h GLU 129 Ca 0.24 -0.21 -0.03 0.00 0.34 0.00 0.00 59.36 59.70 3n4t h GLU 129 Cb 0.11 -0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 28.68 3n4t h GLU 129 CO -0.03 0.75 0.26 1.25 -1.16 0.00 0.00 179.01 180.07 3n4t h LEU 130 N 0.41 0.86 0.00 1.33 5.85 -0.63 -1.84 115.31 121.30 3n4t h LEU 130 Ca 0.09 -0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.65 3n4t h LEU 130 Cb 0.49 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 41.29 3n4t h LEU 130 CO 0.02 0.79 0.00 1.41 -0.34 0.00 0.00 178.44 180.33 3n4t n HIS 131 N -4.44 0.00 0.91 1.25 8.25 0.48 -2.60 115.22 119.06 3n4t n HIS 131 Ca 0.04 0.00 0.09 0.00 -0.26 0.00 0.00 57.72 57.59 3n4t n HIS 131 Cb 0.16 -0.27 -0.10 0.00 1.12 0.00 0.00 29.99 30.90 3n4t n HIS 131 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 3n4t n SER 132 N -1.27 0.95 -4.72 0.41 7.64 -0.72 -4.70 113.62 111.21 3n4t n SER 132 Ca 0.12 -0.98 -0.42 0.00 1.01 0.00 0.00 58.87 58.60 3n4t n SER 132 Cb 0.19 0.98 -0.03 0.00 -1.01 0.00 0.00 64.21 64.34 3n4t n SER 132 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 3n4t s ILE 133 N -2.80 2.41 0.11 0.44 1.01 -1.04 -4.92 121.20 116.42 3n4t s ILE 133 Ca 0.08 0.30 -0.31 0.00 0.00 0.00 0.00 60.65 60.72 3n4t s ILE 133 Cb 0.15 -3.19 -0.10 0.00 0.01 0.00 0.00 42.46 39.33 3n4t s ILE 133 CO 0.78 0.03 1.77 0.21 0.00 0.00 0.00 174.94 177.72 3n4t s ASN 134 N 1.03 6.48 0.00 3.58 3.84 -1.26 -4.62 114.94 123.99 3n4t s ASN 134 Ca 0.70 2.68 0.18 0.00 0.21 0.00 0.00 52.86 56.63 3n4t s ASN 134 Cb -0.46 -2.57 0.07 0.00 -0.55 0.00 0.00 41.25 37.75 3n4t s ASN 134 CO 0.34 -0.96 1.00 0.00 -2.79 0.00 0.00 177.10 174.68 3n4t n ILE 135 N 4.68 0.00 -0.34 -5.21 0.13 -1.26 -4.53 119.36 112.83 3n4t n ILE 135 Ca 0.17 -0.41 0.22 0.00 -1.10 0.00 0.00 62.75 61.63 3n4t n ILE 135 Cb 0.39 1.30 0.48 0.00 -0.84 0.00 0.00 39.64 40.96 3n4t n ILE 135 CO 0.00 0.00 0.00 0.28 2.80 0.00 0.00 176.55 179.63 3n4t h SER 136 N 2.80 0.51 1.24 9.51 0.02 -2.02 -2.29 113.55 123.32 3n4t h SER 136 Ca 0.00 0.11 0.00 0.00 -0.84 0.00 0.00 61.79 61.06 3n4t h SER 136 Cb 0.68 0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.25 3n4t h SER 136 CO 0.00 0.06 0.00 1.23 -1.14 0.00 0.00 176.83 176.98 3n4t h GLY 137 N 0.43 0.00 -2.20 -3.77 0.00 -2.01 -3.46 103.07 92.06 3n4t h GLY 137 Ca 0.63 0.00 -0.45 0.00 0.00 0.00 0.00 47.33 47.51 3n4t h GLY 137 CO -0.38 0.00 0.36 -1.36 0.00 0.00 0.00 176.54 175.16 3n4t s PHE 138 N -3.31 3.27 0.78 5.60 0.08 -0.87 -5.04 117.98 118.49 3n4t s PHE 138 Ca 0.06 1.62 -0.11 0.00 0.12 0.00 0.00 56.93 58.62 3n4t s PHE 138 Cb 0.09 -2.92 0.06 0.00 -0.57 0.00 0.00 43.02 39.68 3n4t s PHE 138 CO 0.54 -0.27 1.10 0.15 -0.10 0.00 0.00 175.22 176.63 3n4t s LYS 139 N -3.04 2.23 0.41 0.44 1.02 -1.26 -4.95 119.74 114.60 3n4t s LYS 139 Ca 0.62 0.61 0.20 0.00 0.02 0.00 0.00 55.97 57.42 3n4t s LYS 139 Cb -0.12 -1.94 0.86 0.00 -0.52 0.00 0.00 37.83 36.11 3n4t s LYS 139 CO 0.16 -1.51 1.82 0.66 -0.92 0.00 0.00 175.35 175.56 3n4t h SER 140 N -1.01 0.00 0.10 2.83 4.64 -1.99 -2.64 113.55 115.49 3n4t h SER 140 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 3n4t h SER 140 Cb 1.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 3n4t h SER 140 CO 0.60 0.31 0.00 -0.46 -0.87 0.00 0.00 176.83 176.41 3n4t n ASN 141 N -3.59 0.00 -0.11 4.97 0.23 -1.26 -1.53 115.26 113.97 3n4t n ASN 141 Ca -0.01 -0.08 0.11 0.00 -0.53 0.00 0.00 54.58 54.08 3n4t n ASN 141 Cb 0.44 -0.15 0.00 0.00 -2.08 0.00 0.00 39.78 37.99 3n4t n ASN 141 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 3n4t n LEU 142 N -1.15 1.10 -4.53 -4.53 4.32 -0.99 -4.82 117.00 106.39 3n4t n LEU 142 Ca 0.06 -0.44 -0.42 0.00 -0.02 0.00 0.00 56.01 55.19 3n4t n LEU 142 Cb 0.06 -0.05 -0.03 0.00 -1.62 0.00 0.00 43.42 41.77 3n4t n LEU 142 CO 0.07 0.25 1.00 -0.69 -1.22 0.00 0.00 177.39 176.79 3n4t s VAL 143 N -2.87 4.02 -0.22 4.08 1.01 -0.58 -0.57 120.40 125.26 3n4t s VAL 143 Ca 0.12 0.35 -0.29 0.00 0.00 0.00 0.00 61.98 62.15 3n4t s VAL 143 Cb 0.17 -4.77 -0.03 0.00 0.00 0.00 0.00 36.38 31.75 3n4t s VAL 143 CO 0.76 -1.54 1.77 -0.22 0.00 0.00 0.00 175.10 175.87 3n4t s LEU 144 N 4.93 3.79 -0.87 3.92 0.20 -0.11 -4.93 118.68 125.61 3n4t s LEU 144 Ca 0.33 1.67 -0.19 0.00 0.69 0.00 0.00 54.13 56.63 3n4t s LEU 144 Cb -0.10 -3.53 0.12 0.00 -0.43 0.00 0.00 46.19 42.25 3n4t s LEU 144 CO 0.17 -1.44 1.07 -0.62 -0.29 0.00 0.00 176.35 175.24 3n4t s ASP 145 N 5.21 6.55 0.16 3.68 -1.08 -1.26 -4.80 116.67 125.12 3n4t s ASP 145 Ca 0.79 -1.89 -0.15 0.00 -0.52 0.00 0.00 52.55 50.78 3n4t s ASP 145 Cb -0.27 -2.39 0.05 0.00 -1.46 0.00 0.00 42.92 38.85 3n4t s ASP 145 CO 0.32 -1.10 1.81 0.15 0.52 0.00 0.00 175.17 176.87 3n4t h PHE 146 N 8.92 0.51 -0.95 -5.34 3.57 -1.93 -0.59 116.94 121.14 3n4t h PHE 146 Ca 0.07 0.01 0.16 0.00 3.53 0.00 0.00 57.97 61.74 3n4t h PHE 146 Cb 1.03 -0.17 -0.10 0.00 2.79 0.00 0.00 35.95 39.51 3n4t h PHE 146 CO 1.12 0.30 0.55 -0.09 -2.23 0.00 0.00 178.31 177.96 3n4t h ARG 147 N 0.55 0.74 -0.04 1.11 2.43 -1.91 -0.21 114.38 117.05 3n4t h ARG 147 Ca 0.17 -0.04 -0.18 0.00 -0.81 0.00 0.00 59.98 59.11 3n4t h ARG 147 Cb -0.02 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.36 3n4t h ARG 147 CO -0.06 0.49 -0.77 1.49 -1.51 0.00 0.00 179.97 179.61 3n4t h GLU 148 N 0.76 0.29 -0.54 0.20 4.57 -1.65 -2.38 114.58 115.84 3n4t h GLU 148 Ca 0.52 -0.26 -0.11 0.00 -1.18 0.00 0.00 59.36 58.34 3n4t h GLU 148 Cb 0.73 0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 29.36 3n4t h GLU 148 CO -0.35 0.93 -0.09 -0.22 -1.18 0.00 0.00 179.01 178.09 3n4t h LYS 149 N 0.19 1.00 -0.40 1.92 1.63 -0.05 0.32 116.57 121.17 3n4t h LYS 149 Ca -0.03 -0.36 -0.05 0.00 -0.85 0.00 0.00 60.65 59.36 3n4t h LYS 149 Cb 1.35 -0.07 -0.02 0.00 -0.60 0.00 0.00 32.23 32.89 3n4t h LYS 149 CO 0.12 1.04 0.07 0.82 -3.45 0.00 0.00 179.45 178.05 3n4t h ILE 150 N 0.89 1.24 -0.97 2.00 1.08 -1.03 -0.31 117.51 120.42 3n4t h ILE 150 Ca 0.14 -0.85 0.03 0.00 -0.39 0.00 0.00 64.86 63.80 3n4t h ILE 150 Cb 0.65 1.02 -0.06 0.00 -3.07 0.00 0.00 36.82 35.36 3n4t h ILE 150 CO 0.04 0.29 0.63 0.78 -0.69 0.00 0.00 178.15 179.21 3n4t h ASN 151 N 0.51 1.05 -0.30 1.72 2.35 -1.16 0.27 115.58 120.03 3n4t h ASN 151 Ca 0.12 -0.01 -0.17 0.00 -0.55 0.00 0.00 56.30 55.70 3n4t h ASN 151 Cb 0.35 -0.24 -0.00 0.00 0.05 0.00 0.00 38.32 38.48 3n4t h ASN 151 CO 0.01 0.72 -0.47 -0.08 -1.65 0.00 0.00 177.43 175.96 3n4t h GLU 152 N 1.22 0.84 -0.54 0.81 4.57 -0.72 -1.81 114.58 118.94 3n4t h GLU 152 Ca 0.38 -0.51 0.01 0.00 -1.18 0.00 0.00 59.36 58.06 3n4t h GLU 152 Cb -0.01 0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 28.61 3n4t h GLU 152 CO -0.12 1.14 0.36 -0.44 -1.18 0.00 0.00 179.01 178.77 3n4t h ASP 153 N 0.61 0.62 -0.59 1.04 5.19 -0.70 -1.26 116.42 121.33 3n4t h ASP 153 Ca 0.03 -0.02 0.08 0.00 -0.62 0.00 0.00 57.03 56.50 3n4t h ASP 153 Cb 1.07 -0.16 -0.06 0.00 0.18 0.00 0.00 39.33 40.36 3n4t h ASP 153 CO 0.11 0.45 0.26 -1.13 -3.12 0.00 0.00 179.24 175.80 3n4t h ASN 154 N 0.74 0.31 -0.71 6.45 -0.73 -0.31 0.25 115.58 121.56 3n4t h ASN 154 Ca 0.20 0.06 -0.05 0.00 1.87 0.00 0.00 56.30 58.38 3n4t h ASN 154 Cb -0.09 0.02 -0.03 0.00 0.27 0.00 0.00 38.32 38.49 3n4t h ASN 154 CO -0.04 0.19 0.25 0.11 -0.37 0.00 0.00 177.43 177.57 3n4t h LYS 155 N 0.47 1.10 -0.22 6.67 1.57 -1.03 -0.92 116.57 124.21 3n4t h LYS 155 Ca 0.29 -0.22 -0.03 0.00 -1.87 0.00 0.00 60.65 58.82 3n4t h LYS 155 Cb 0.30 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.43 3n4t h LYS 155 CO -0.25 0.92 0.01 0.87 -0.57 0.00 0.00 179.45 180.43 3n4t h LYS 156 N 1.07 0.38 0.13 3.15 1.57 -0.26 -2.51 116.57 120.10 3n4t h LYS 156 Ca 0.24 -0.12 0.00 0.00 -1.87 0.00 0.00 60.65 58.90 3n4t h LYS 156 Cb 0.27 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.53 3n4t h LYS 156 CO -0.01 0.57 -0.10 0.82 -0.57 0.00 0.00 179.45 180.15 3n4t h ILE 157 N 0.16 0.78 -0.67 1.86 1.08 -0.44 -0.33 117.51 119.95 3n4t h ILE 157 Ca 0.06 0.00 0.09 0.00 -0.39 0.00 0.00 64.86 64.62 3n4t h ILE 157 Cb 0.39 0.78 -0.04 0.00 -3.07 0.00 0.00 36.82 34.88 3n4t h ILE 157 CO 0.01 0.00 0.44 0.11 -0.69 0.00 0.00 178.15 178.02 3n4t h LYS 158 N -0.23 0.56 0.09 2.37 1.79 -1.16 0.49 116.57 120.48 3n4t h LYS 158 Ca -0.00 -0.03 -0.00 0.00 -2.18 0.00 0.00 60.65 58.43 3n4t h LYS 158 Cb 0.21 -0.13 0.00 0.00 -1.58 0.00 0.00 32.23 30.74 3n4t h LYS 158 CO -0.01 0.37 -0.05 -0.22 -1.08 0.00 0.00 179.45 178.46 3n4t h LYS 159 N 0.57 -0.12 -0.98 3.15 3.64 -1.24 -3.09 116.57 118.51 3n4t h LYS 159 Ca 0.30 0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.70 3n4t h LYS 159 Cb 0.43 0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 32.22 3n4t h LYS 159 CO -0.10 0.40 0.65 -0.07 -2.27 0.00 0.00 179.45 178.06 3n4t h LEU 160 N -0.84 1.11 -2.72 5.20 4.07 -0.67 -3.13 115.31 118.34 3n4t h LEU 160 Ca -0.01 -0.03 0.00 0.00 0.08 0.00 0.00 57.88 57.92 3n4t h LEU 160 Cb 0.58 -0.28 0.00 0.00 1.08 0.00 0.00 40.66 42.05 3n4t h LEU 160 CO 0.02 0.80 0.00 0.18 -1.08 0.00 0.00 178.44 178.36 3n4t n LEU 161 N -4.41 3.83 0.01 1.67 4.77 0.13 -4.56 117.00 118.44 3n4t n LEU 161 Ca 0.12 -1.95 0.03 0.00 -0.03 0.00 0.00 56.01 54.17 3n4t n LEU 161 Cb 0.02 -0.45 0.39 0.00 -2.33 0.00 0.00 43.42 41.05 3n4t n LEU 161 CO 0.37 0.95 1.08 0.77 -1.33 0.00 0.00 177.39 179.23 3n4t h SER 162 N 4.12 0.45 -0.00 -1.43 4.64 -1.48 -2.28 113.55 117.58 3n4t h SER 162 Ca 0.00 -0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.28 3n4t h SER 162 Cb 0.97 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.94 3n4t h SER 162 CO 0.00 0.40 -0.75 0.54 -0.87 0.00 0.00 176.83 176.14 3n4t n ARG 163 N -4.41 0.88 0.08 4.77 1.74 -1.26 -4.33 116.66 114.12 3n4t n ARG 163 Ca 0.02 -0.31 0.10 0.00 -0.77 0.00 0.00 57.85 56.90 3n4t n ARG 163 Cb 0.12 -1.41 -0.03 0.00 -1.02 0.00 0.00 32.46 30.12 3n4t n ARG 163 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 3n4t n GLU 164 N -1.00 0.61 -4.71 5.56 -0.58 -0.99 -4.94 120.64 114.60 3n4t n GLU 164 Ca 0.05 0.09 -0.31 0.00 -0.42 0.00 0.00 57.16 56.58 3n4t n GLU 164 Cb 0.34 -1.79 -0.13 0.00 -0.57 0.00 0.00 31.44 29.29 3n4t n GLU 164 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 3n4t s LEU 165 N -5.30 2.62 0.49 -4.62 1.02 -0.89 -5.09 118.68 106.90 3n4t s LEU 165 Ca -0.02 -0.39 -0.04 0.00 0.02 0.00 0.00 54.13 53.70 3n4t s LEU 165 Cb 0.10 -1.53 -0.02 0.00 0.02 0.00 0.00 46.19 44.76 3n4t s LEU 165 CO 0.81 0.27 0.78 -0.54 0.02 0.00 0.00 176.35 177.68 3n4t s LYS 166 N -1.31 3.36 0.16 1.70 -0.14 -1.26 -4.84 119.74 117.40 3n4t s LYS 166 Ca 0.14 0.04 -0.16 0.00 -1.36 0.00 0.00 55.97 54.63 3n4t s LYS 166 Cb -0.10 -2.40 0.12 0.00 -1.68 0.00 0.00 37.83 33.76 3n4t s LYS 166 CO 0.04 -0.28 1.14 0.41 -0.76 0.00 0.00 175.35 175.90 3n4t n GLY 167 N -2.27 -1.63 0.28 -3.33 0.00 -1.26 -1.08 105.19 95.91 3n4t n GLY 167 Ca 0.01 0.84 -0.06 0.00 0.00 0.00 0.00 46.02 46.81 3n4t n GLY 167 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3n4t h PRO 168 N 0.00 0.80 -0.42 1.61 0.11 -1.99 -1.61 132.00 130.50 3n4t h PRO 168 Ca 0.22 -0.25 -0.06 0.00 0.11 0.00 0.00 66.00 66.02 3n4t h PRO 168 Cb 0.40 -0.07 -0.02 0.00 0.11 0.00 0.00 31.00 31.42 3n4t h PRO 168 CO -0.72 0.86 0.04 1.96 -0.21 0.00 0.00 178.00 179.92 3n4t h GLN 169 N 0.73 0.72 -0.44 1.05 4.20 -1.49 -2.39 115.11 117.49 3n4t h GLN 169 Ca 0.13 -0.21 -0.06 0.00 0.06 0.00 0.00 58.65 58.56 3n4t h GLN 169 Cb 0.56 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 28.24 3n4t h GLN 169 CO 0.03 0.78 0.01 1.98 -0.67 0.00 0.00 178.83 180.96 3n4t h MET 170 N 0.56 0.72 -0.75 1.46 4.05 -1.21 -2.20 114.93 117.56 3n4t h MET 170 Ca 0.12 -0.18 -0.01 0.00 -0.28 0.00 0.00 59.70 59.35 3n4t h MET 170 Cb 0.43 -0.09 -0.04 0.00 -0.80 0.00 0.00 31.60 31.10 3n4t h MET 170 CO 0.01 0.72 0.41 -0.22 0.23 0.00 0.00 176.91 178.07 3n4t h LYS 171 N 0.68 1.04 -0.38 0.39 3.64 -1.09 0.12 116.57 120.97 3n4t h LYS 171 Ca 0.14 -0.12 -0.13 0.00 -1.27 0.00 0.00 60.65 59.27 3n4t h LYS 171 Cb 0.40 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 32.01 3n4t h LYS 171 CO 0.01 0.77 -0.27 0.87 -2.27 0.00 0.00 179.45 178.57 3n4t h LYS 172 N 1.03 0.80 0.21 1.90 1.79 -1.09 0.42 116.57 121.63 3n4t h LYS 172 Ca 0.26 -0.35 -0.01 0.00 -2.18 0.00 0.00 60.65 58.38 3n4t h LYS 172 Cb 0.03 -0.02 -0.00 0.00 -1.58 0.00 0.00 32.23 30.66 3n4t h LYS 172 CO -0.04 0.97 -0.11 0.28 -1.08 0.00 0.00 179.45 179.47 3n4t h VAL 173 N 0.68 0.77 -0.88 0.50 2.07 -1.22 0.14 116.25 118.32 3n4t h VAL 173 Ca 0.08 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.60 3n4t h VAL 173 Cb 0.80 0.77 -0.04 0.00 -1.52 0.00 0.00 31.29 31.30 3n4t h VAL 173 CO 0.07 0.00 0.53 -0.78 0.02 0.00 0.00 177.57 177.41 3n4t h ASP 174 N -0.30 1.05 -0.71 0.57 3.58 -0.41 0.38 116.42 120.59 3n4t h ASP 174 Ca -0.03 -0.07 0.10 0.00 0.42 0.00 0.00 57.03 57.46 3n4t h ASP 174 Cb 0.24 -0.27 -0.08 0.00 1.72 0.00 0.00 39.33 40.94 3n4t h ASP 174 CO 0.04 0.81 0.33 0.44 -2.88 0.00 0.00 179.24 177.97 3n4t h ASP 175 N 1.21 0.39 -0.11 2.28 3.45 0.03 -0.85 116.42 122.83 3n4t h ASP 175 Ca 0.31 0.07 0.01 0.00 0.43 0.00 0.00 57.03 57.85 3n4t h ASP 175 Cb -0.05 0.01 -0.01 0.00 -0.56 0.00 0.00 39.33 38.73 3n4t h ASP 175 CO -0.06 0.21 0.04 0.15 -1.57 0.00 0.00 179.24 178.02 3n4t h PHE 176 N 0.54 0.08 -0.16 4.55 3.57 0.14 -1.37 116.94 124.30 3n4t h PHE 176 Ca 0.36 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.85 3n4t h PHE 176 Cb 0.43 -0.02 -0.01 0.00 2.79 0.00 0.00 35.95 39.14 3n4t h PHE 176 CO -0.13 0.05 0.06 1.88 -2.23 0.00 0.00 178.31 177.94 3n4t h TYR 177 N 0.10 0.24 -0.43 0.41 -1.99 -1.03 -2.10 116.97 112.17 3n4t h TYR 177 Ca 0.04 -0.02 0.09 0.00 2.00 0.00 0.00 58.73 60.84 3n4t h TYR 177 Cb 0.01 -0.07 -0.09 0.00 2.00 0.00 0.00 36.73 38.59 3n4t h TYR 177 CO -0.09 0.32 -0.14 -0.09 -0.00 0.00 0.00 178.16 178.15 3n4t h ARG 178 N 0.09 -0.04 -0.36 4.88 2.43 -1.13 -0.14 114.38 120.11 3n4t h ARG 178 Ca 0.05 0.00 0.05 0.00 -0.81 0.00 0.00 59.98 59.27 3n4t h ARG 178 Cb 0.18 0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 29.70 3n4t h ARG 178 CO -0.00 -0.03 0.10 -0.44 -1.51 0.00 0.00 179.97 178.08 3n4t h ASP 179 N -0.05 0.07 0.43 -3.80 3.45 -0.96 0.10 116.42 115.67 3n4t h ASP 179 Ca 0.21 0.05 -0.01 0.00 0.43 0.00 0.00 57.03 57.71 3n4t h ASP 179 Cb 0.37 0.05 -0.02 0.00 -0.56 0.00 0.00 39.33 39.17 3n4t h ASP 179 CO -0.47 0.08 -0.42 0.40 -1.57 0.00 0.00 179.24 177.26 3n4t h ILE 180 N 0.23 0.16 0.00 0.35 2.04 -0.81 -2.47 117.51 117.01 3n4t h ILE 180 Ca 0.17 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.03 3n4t h ILE 180 Cb 0.17 0.16 0.00 0.00 -0.74 0.00 0.00 36.82 36.41 3n4t h ILE 180 CO -0.20 0.00 0.00 -0.07 0.00 0.00 0.00 178.15 177.88 3n4t h LEU 181 N -0.86 0.00 -2.26 1.44 3.38 -0.52 0.70 115.31 117.20 3n4t h LEU 181 Ca -0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.93 3n4t h LEU 181 Cb 0.76 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.51 3n4t h LEU 181 CO -0.06 0.00 0.00 -0.62 0.09 0.00 0.00 178.44 177.85 3n4t n GLU 182 N -3.01 2.47 -3.75 1.13 1.02 -0.02 -4.81 120.64 113.66 3n4t n GLU 182 Ca -0.03 -2.22 -0.37 0.00 -0.02 0.00 0.00 57.16 54.52 3n4t n GLU 182 Cb 0.09 -1.51 -0.11 0.00 -0.02 0.00 0.00 31.44 29.88 3n4t n GLU 182 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 3n4t s ASN 183 N -1.44 5.30 0.37 1.62 3.84 0.24 -4.97 114.94 119.91 3n4t s ASN 183 Ca 0.39 -1.81 0.25 0.00 0.21 0.00 0.00 52.86 51.91 3n4t s ASN 183 Cb 0.23 -1.85 1.34 0.00 -0.55 0.00 0.00 41.25 40.41 3n4t s ASN 183 CO 0.31 -0.51 1.78 -0.33 -2.79 0.00 0.00 177.10 175.56 3n4t h GLU 184 N 8.14 0.00 0.00 0.43 4.39 -1.87 -2.90 114.58 122.77 3n4t h GLU 184 Ca -0.17 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.51 3n4t h GLU 184 Cb 1.06 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.71 3n4t h GLU 184 CO 0.70 0.00 -0.10 0.97 -1.16 0.00 0.00 179.01 179.42 3n4t h ILE 185 N 0.00 0.60 0.00 3.13 2.10 -1.93 -0.05 117.51 121.37 3n4t h ILE 185 Ca 0.00 -0.41 0.00 0.00 1.08 0.00 0.00 64.86 65.53 3n4t h ILE 185 Cb 0.06 1.26 0.00 0.00 -1.09 0.00 0.00 36.82 37.04 3n4t h ILE 185 CO 0.00 0.09 -0.03 1.88 -1.08 0.00 0.00 178.15 179.01 3n4t h TYR 186 N 0.00 0.00 0.00 2.19 0.05 -1.86 -3.37 116.97 113.99 3n4t h TYR 186 Ca -0.00 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 58.78 3n4t h TYR 186 Cb 0.25 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 37.99 3n4t h TYR 186 CO 0.00 0.00 -1.01 1.19 -1.05 0.00 0.00 178.16 177.29 3n4t n PHE 187 N -2.58 0.00 -3.19 4.88 3.01 -0.66 -4.84 117.46 114.08 3n4t n PHE 187 Ca 0.05 0.00 -0.45 0.00 1.01 0.00 0.00 57.45 58.06 3n4t n PHE 187 Cb 0.47 -0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.94 3n4t n PHE 187 CO 0.00 0.00 0.00 1.17 1.01 0.00 0.00 176.76 178.94 3n4t n LYS 188 N -1.57 3.51 -4.21 -1.08 4.81 -0.12 -4.96 118.16 114.54 3n4t n LYS 188 Ca -0.00 -4.25 -0.13 0.00 -0.87 0.00 0.00 58.31 53.06 3n4t n LYS 188 Cb 0.07 -2.71 -0.10 0.00 0.02 0.00 0.00 35.03 32.31 3n4t n LYS 188 CO 0.00 0.00 0.00 1.52 1.17 0.00 0.00 177.40 180.09 3n4t s TYR 189 N -0.38 1.10 -0.55 5.64 -0.85 -1.26 -4.88 117.35 116.16 3n4t s TYR 189 Ca 0.35 -0.89 -0.24 0.00 -0.52 0.00 0.00 57.07 55.77 3n4t s TYR 189 Cb -0.07 -0.60 0.04 0.00 0.38 0.00 0.00 41.96 41.71 3n4t s TYR 189 CO -0.05 -0.08 0.94 0.71 -1.52 0.00 0.00 175.55 175.55 3n4t s TYR 190 N -3.53 2.80 0.49 -3.49 2.02 -1.26 -5.02 117.35 109.36 3n4t s TYR 190 Ca 0.16 -0.01 -0.24 0.00 -0.37 0.00 0.00 57.07 56.62 3n4t s TYR 190 Cb 0.05 -4.07 -0.07 0.00 -0.40 0.00 0.00 41.96 37.46 3n4t s TYR 190 CO -0.01 -1.35 1.35 -2.14 -1.57 0.00 0.00 175.55 171.84 3n4t s PRO 191 N 3.94 3.48 0.19 -1.71 0.02 -1.26 -4.65 135.00 135.01 3n4t s PRO 191 Ca 0.30 2.24 -0.13 0.00 0.02 0.00 0.00 61.00 63.43 3n4t s PRO 191 Cb -0.13 -2.46 0.01 0.00 0.02 0.00 0.00 34.50 31.94 3n4t s PRO 191 CO 0.19 -0.92 0.42 0.00 -0.33 0.00 0.00 177.00 176.37 3n4t n LEU 193 N -0.30 4.00 -4.28 0.00 7.94 -1.26 -1.26 117.00 121.84 3n4t n LEU 193 Ca -0.07 1.00 -0.20 0.00 -1.11 0.00 0.00 56.01 55.62 3n4t n LEU 193 Cb 0.62 -1.54 -0.11 0.00 0.53 0.00 0.00 43.42 42.92 3n4t n LEU 193 CO 0.21 0.16 -0.47 0.27 -1.11 0.00 0.00 177.39 176.44 3n4t s ILE 194 N 2.52 1.57 0.05 1.96 -4.36 0.23 -4.04 121.20 119.13 3n4t s ILE 194 Ca 0.81 -1.75 -0.23 0.00 -0.26 0.00 0.00 60.65 59.23 3n4t s ILE 194 Cb -0.50 -1.64 -0.15 0.00 1.25 0.00 0.00 42.46 41.43 3n4t s ILE 194 CO 0.37 -0.31 1.49 -0.74 0.24 0.00 0.00 174.94 175.99 3n4t h HIS 195 N 3.54 0.15 0.00 1.37 -0.00 -1.93 -2.72 115.15 115.56 3n4t h HIS 195 Ca -0.42 -0.02 0.00 0.00 -0.00 0.00 0.00 60.37 59.93 3n4t h HIS 195 Cb 1.20 -0.04 0.00 0.00 -0.00 0.00 0.00 27.41 28.57 3n4t h HIS 195 CO 0.66 0.37 0.00 -1.71 -0.00 0.00 0.00 177.93 177.25 3n4t n ASN 196 N -4.86 -1.11 -2.71 3.26 5.15 -1.26 -2.89 115.26 110.83 3n4t n ASN 196 Ca -0.06 0.00 -0.05 0.00 -0.60 0.00 0.00 54.58 53.86 3n4t n ASN 196 Cb 0.18 -0.41 0.07 0.00 -0.53 0.00 0.00 39.78 39.09 3n4t n ASN 196 CO 0.00 0.00 0.00 -0.67 1.40 0.00 0.00 177.26 177.99 3n4t n ASP 197 N -0.03 0.18 -4.54 1.20 4.64 -1.26 -4.89 116.55 111.84 3n4t n ASP 197 Ca 0.00 -2.40 -0.41 0.00 -1.38 0.00 0.00 54.79 50.59 3n4t n ASP 197 Cb 0.02 0.06 -0.03 0.00 -1.04 0.00 0.00 41.12 40.13 3n4t n ASP 197 CO 0.00 0.00 0.00 0.12 -0.82 0.00 0.00 177.20 176.50 3n4t s PHE 198 N -1.94 2.62 0.24 -0.67 5.36 -1.26 -4.81 117.98 117.52 3n4t s PHE 198 Ca 0.23 -0.94 -0.01 0.00 -0.96 0.00 0.00 56.93 55.25 3n4t s PHE 198 Cb 0.41 -4.64 -0.03 0.00 -0.34 0.00 0.00 43.02 38.42 3n4t s PHE 198 CO -0.04 -1.87 0.23 -1.54 -1.46 0.00 0.00 175.22 170.54 3n4t s SER 199 N 4.76 0.51 0.33 6.13 1.04 -1.26 -3.80 113.70 121.42 3n4t s SER 199 Ca 0.44 -1.43 0.05 0.00 0.48 0.00 0.00 55.95 55.50 3n4t s SER 199 Cb -0.01 0.46 0.70 0.00 0.10 0.00 0.00 66.02 67.27 3n4t s SER 199 CO -0.10 -0.96 1.88 0.77 0.98 0.00 0.00 173.24 175.82 3n4t h SER 200 N 2.43 0.76 0.27 7.02 4.64 -1.87 -0.31 113.55 126.49 3n4t h SER 200 Ca -0.32 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.03 3n4t h SER 200 Cb 1.25 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 63.21 3n4t h SER 200 CO 0.46 0.43 0.00 0.44 -0.87 0.00 0.00 176.83 177.29 3n4t h ASP 201 N 0.83 0.00 -0.43 4.97 5.19 -1.94 -2.26 116.42 122.77 3n4t h ASP 201 Ca 0.43 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.84 3n4t h ASP 201 Cb 0.50 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.01 3n4t h ASP 201 CO -0.19 0.00 0.00 1.41 -3.12 0.00 0.00 179.24 177.34 3n4t n HIS 202 N -2.81 0.57 -3.82 4.55 8.25 -0.13 -4.83 115.22 117.01 3n4t n HIS 202 Ca -0.01 -0.44 -0.37 0.00 -0.26 0.00 0.00 57.72 56.64 3n4t n HIS 202 Cb 0.12 -0.02 -0.13 0.00 1.12 0.00 0.00 29.99 31.09 3n4t n HIS 202 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 3n4t s ILE 203 N -1.04 3.50 0.01 1.59 1.01 -0.86 -1.47 121.20 123.94 3n4t s ILE 203 Ca 0.31 -1.12 -0.15 0.00 0.00 0.00 0.00 60.65 59.68 3n4t s ILE 203 Cb 0.17 -2.94 -0.06 0.00 0.01 0.00 0.00 42.46 39.64 3n4t s ILE 203 CO 0.22 -0.08 0.43 -0.76 0.00 0.00 0.00 174.94 174.75 3n4t s LEU 204 N 1.37 4.48 0.04 2.97 1.43 0.15 0.27 118.68 129.39 3n4t s LEU 204 Ca -0.02 1.00 0.06 0.00 -1.03 0.00 0.00 54.13 54.15 3n4t s LEU 204 Cb -0.19 -2.62 -0.02 0.00 0.03 0.00 0.00 46.19 43.38 3n4t s LEU 204 CO 0.01 0.32 -0.19 0.12 0.23 0.00 0.00 176.35 176.84 3n4t s PHE 205 N -1.07 1.63 -0.43 0.29 5.36 0.29 -0.25 117.98 123.79 3n4t s PHE 205 Ca 0.24 -0.36 -0.07 0.00 -0.96 0.00 0.00 56.93 55.78 3n4t s PHE 205 Cb -0.17 -0.97 0.10 0.00 -0.34 0.00 0.00 43.02 41.64 3n4t s PHE 205 CO 0.14 0.07 0.26 0.34 -1.46 0.00 0.00 175.22 174.57 3n4t s ASP 206 N -1.12 5.51 0.00 6.13 -1.08 -0.13 -0.59 116.67 125.38 3n4t s ASP 206 Ca 0.06 -1.80 0.28 0.00 -0.52 0.00 0.00 52.55 50.56 3n4t s ASP 206 Cb -0.08 -1.93 1.52 0.00 -1.46 0.00 0.00 42.92 40.97 3n4t s ASP 206 CO 0.01 -0.58 1.98 0.35 0.52 0.00 0.00 175.17 177.45 3n4t n THR 207 N 4.80 0.06 -0.02 1.71 -2.24 -1.26 -0.01 114.28 117.33 3n4t n THR 207 Ca -0.07 0.02 -0.16 0.00 -2.27 0.00 0.00 64.05 61.57 3n4t n THR 207 Cb 0.42 -0.57 -0.11 0.00 -2.10 0.00 0.00 70.33 67.96 3n4t n THR 207 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 3n4t h GLU 208 N 0.00 0.25 -0.00 -0.78 4.57 -1.94 -3.35 114.58 113.33 3n4t h GLU 208 Ca 0.00 -0.26 0.00 0.00 -1.18 0.00 0.00 59.36 57.92 3n4t h GLU 208 Cb 0.13 0.07 0.00 0.00 -0.16 0.00 0.00 28.75 28.79 3n4t h GLU 208 CO 0.00 0.97 -0.92 1.63 -1.18 0.00 0.00 179.01 179.51 3n4t n LYS 209 N -4.42 0.03 -3.67 1.92 5.02 -1.10 -4.99 118.16 110.96 3n4t n LYS 209 Ca -0.10 -0.03 -0.24 0.00 -2.02 0.00 0.00 58.31 55.92 3n4t n LYS 209 Cb 0.55 -1.50 0.06 0.00 -0.02 0.00 0.00 35.03 34.12 3n4t n LYS 209 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3n4t n ASN 210 N -1.46 -4.24 -4.00 4.39 4.13 0.99 -5.02 115.26 110.05 3n4t n ASN 210 Ca 0.04 -0.67 -0.09 0.00 1.68 0.00 0.00 54.58 55.55 3n4t n ASN 210 Cb 0.33 -4.57 -0.11 0.00 -1.54 0.00 0.00 39.78 33.90 3n4t n ASN 210 CO 0.00 0.00 0.00 0.42 0.28 0.00 0.00 177.26 177.96 3n4t s THR 211 N -3.38 0.14 0.24 3.41 -4.23 -0.97 -4.94 115.64 105.91 3n4t s THR 211 Ca 0.40 -1.14 -0.31 0.00 -1.18 0.00 0.00 61.69 59.46 3n4t s THR 211 Cb -0.19 -0.65 -0.11 0.00 1.34 0.00 0.00 72.50 72.90 3n4t s THR 211 CO 0.77 -0.63 1.59 -0.63 -0.54 0.00 0.00 174.62 175.18 3n4t s ILE 212 N -2.18 2.28 -0.04 2.99 1.01 -1.26 -0.96 121.20 123.04 3n4t s ILE 212 Ca -0.09 0.22 0.06 0.00 0.00 0.00 0.00 60.65 60.84 3n4t s ILE 212 Cb -0.05 -3.14 0.09 0.00 0.01 0.00 0.00 42.46 39.37 3n4t s ILE 212 CO -0.03 0.03 0.98 0.00 0.00 0.00 0.00 174.94 175.91 3n4t n GLY 214 N -0.48 1.81 3.21 0.00 0.00 -1.11 -4.43 105.19 104.20 3n4t n GLY 214 Ca 0.05 -0.16 -0.29 0.00 0.00 0.00 0.00 46.02 45.62 3n4t n GLY 214 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3n4t s ILE 215 N -1.47 1.81 0.37 -0.61 -1.09 -0.56 0.35 121.20 120.01 3n4t s ILE 215 Ca 0.00 -0.92 0.04 0.00 -2.23 0.00 0.00 60.65 57.53 3n4t s ILE 215 Cb 0.00 -1.54 -0.03 0.00 -1.58 0.00 0.00 42.46 39.30 3n4t s ILE 215 CO 0.00 0.51 0.13 0.27 -1.23 0.00 0.00 174.94 174.61 3n4t s ILE 216 N -0.04 0.64 -0.58 2.92 -4.36 -0.54 -4.06 121.20 115.17 3n4t s ILE 216 Ca -0.05 -2.00 -0.08 0.00 -0.26 0.00 0.00 60.65 58.26 3n4t s ILE 216 Cb -0.13 -2.46 0.01 0.00 1.25 0.00 0.00 42.46 41.13 3n4t s ILE 216 CO 0.04 0.00 0.65 0.47 0.24 0.00 0.00 174.94 176.33 3n4t n ASP 217 N -1.13 -7.84 -1.57 4.36 8.00 -1.26 -4.83 116.55 112.27 3n4t n ASP 217 Ca -0.04 0.23 0.07 0.00 0.71 0.00 0.00 54.79 55.76 3n4t n ASP 217 Cb 0.65 -5.33 0.33 0.00 -0.02 0.00 0.00 41.12 36.76 3n4t n ASP 217 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3n4t n PHE 218 N -1.05 1.57 0.26 1.24 3.72 -1.26 -4.58 117.46 117.36 3n4t n PHE 218 Ca 0.06 -0.58 0.14 0.00 -0.05 0.00 0.00 57.45 57.02 3n4t n PHE 218 Cb 0.48 -0.34 0.70 0.00 -0.94 0.00 0.00 39.48 39.38 3n4t n PHE 218 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 3n4t h GLY 219 N 4.28 0.00 -1.39 1.37 0.00 -1.88 -0.98 103.07 104.46 3n4t h GLY 219 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3n4t h GLY 219 CO 0.32 0.00 0.00 1.22 0.00 0.00 0.00 176.54 178.08 3n4t n ASP 220 N -2.49 2.70 -4.74 0.19 8.00 -1.26 -4.66 116.55 114.29 3n4t n ASP 220 Ca -0.01 -1.80 -0.36 0.00 0.71 0.00 0.00 54.79 53.33 3n4t n ASP 220 Cb 0.11 -0.15 0.06 0.00 -0.02 0.00 0.00 41.12 41.11 3n4t n ASP 220 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3n4t s ALA 221 N -1.09 2.41 0.13 2.24 0.00 -0.37 -4.66 121.76 120.42 3n4t s ALA 221 Ca 0.23 1.04 -0.25 0.00 0.00 0.00 0.00 51.96 52.98 3n4t s ALA 221 Cb 0.14 -3.48 0.08 0.00 0.00 0.00 0.00 23.12 19.85 3n4t s ALA 221 CO 0.19 -1.43 1.06 0.00 0.00 0.00 0.00 175.76 175.58 3n4t s ALA 222 N -1.62 -1.77 -0.40 0.00 0.00 -1.03 -4.97 121.76 111.97 3n4t s ALA 222 Ca 0.78 0.05 -0.18 0.00 0.00 0.00 0.00 51.96 52.62 3n4t s ALA 222 Cb -0.32 0.65 0.01 0.00 0.00 0.00 0.00 23.12 23.46 3n4t s ALA 222 CO 0.37 -1.06 0.48 0.42 0.00 0.00 0.00 175.76 175.98 3n4t s ILE 223 N -2.68 5.04 0.00 0.00 1.01 0.26 -0.60 121.20 124.23 3n4t s ILE 223 Ca 0.17 -0.08 0.00 0.00 0.00 0.00 0.00 60.65 60.74 3n4t s ILE 223 Cb -0.01 -4.03 0.00 0.00 0.01 0.00 0.00 42.46 38.44 3n4t s ILE 223 CO 0.02 -0.37 0.00 -0.24 0.00 0.00 0.00 174.94 174.35 3n4t n SER 224 N 5.72 0.00 -4.63 3.58 2.88 -0.39 -0.94 113.62 119.85 3n4t n SER 224 Ca -0.06 -0.12 -0.42 0.00 -1.33 0.00 0.00 58.87 56.95 3n4t n SER 224 Cb 0.48 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.90 3n4t n SER 224 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 3n4t s ASP 225 N 1.63 6.77 0.62 -3.46 3.68 -1.26 -0.76 116.67 123.89 3n4t s ASP 225 Ca 0.00 0.90 0.34 0.00 2.13 0.00 0.00 52.55 55.92 3n4t s ASP 225 Cb 0.00 -2.43 1.90 0.00 -1.45 0.00 0.00 42.92 40.95 3n4t s ASP 225 CO 0.00 -0.56 2.18 1.55 0.13 0.00 0.00 175.17 178.47 3n4t h PRO 226 N 7.85 0.00 0.00 4.34 0.13 -1.86 -1.10 132.00 141.37 3n4t h PRO 226 Ca -0.23 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.89 3n4t h PRO 226 Cb 1.09 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.22 3n4t h PRO 226 CO 0.88 0.00 -0.04 -0.44 -0.23 0.00 0.00 178.00 178.17 3n4t h ASP 227 N 0.00 0.00 0.01 1.44 3.32 -1.98 -2.60 116.42 116.62 3n4t h ASP 227 Ca 0.03 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.07 3n4t h ASP 227 Cb 0.29 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.84 3n4t h ASP 227 CO -0.00 0.04 -0.03 0.78 -1.72 0.00 0.00 179.24 178.31 3n4t h ASN 228 N 0.00 0.06 1.01 6.45 2.35 -1.61 -1.81 115.58 122.03 3n4t h ASN 228 Ca -0.00 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3n4t h ASN 228 Cb 0.20 -0.02 0.00 0.00 0.05 0.00 0.00 38.32 38.56 3n4t h ASN 228 CO 0.01 0.11 0.00 0.47 -1.65 0.00 0.00 177.43 176.36 3n4t n ASP 229 N -4.46 0.45 -0.05 5.81 10.43 -0.98 -2.62 116.55 125.14 3n4t n ASP 229 Ca -0.02 0.57 -0.21 0.00 2.57 0.00 0.00 54.79 57.70 3n4t n ASP 229 Cb 0.14 -0.68 -0.13 0.00 1.84 0.00 0.00 41.12 42.29 3n4t n ASP 229 CO 0.00 0.00 0.00 0.49 -1.07 0.00 0.00 177.20 176.62 3n4t n PHE 230 N -1.95 0.84 -0.13 1.24 3.01 -0.72 -4.38 117.46 115.37 3n4t n PHE 230 Ca 0.05 0.20 0.05 0.00 1.01 0.00 0.00 57.45 58.76 3n4t n PHE 230 Cb 0.31 -1.11 0.37 0.00 -0.01 0.00 0.00 39.48 39.05 3n4t n PHE 230 CO 0.00 0.00 0.00 0.82 1.01 0.00 0.00 176.76 178.59 3n4t h ILE 231 N -0.14 1.06 0.00 4.37 2.04 -1.46 -0.74 117.51 122.63 3n4t h ILE 231 Ca -0.47 -0.24 0.00 0.00 1.00 0.00 0.00 64.86 65.14 3n4t h ILE 231 Cb 1.89 0.29 0.00 0.00 -0.74 0.00 0.00 36.82 38.26 3n4t h ILE 231 CO -0.03 0.13 0.00 -1.54 0.00 0.00 0.00 178.15 176.71 3n4t n SER 232 N -4.47 0.00 -0.25 1.72 3.41 -1.08 -2.13 113.62 110.83 3n4t n SER 232 Ca 0.08 0.47 0.06 0.00 -0.26 0.00 0.00 58.87 59.23 3n4t n SER 232 Cb 0.16 -0.49 -0.01 0.00 -0.26 0.00 0.00 64.21 63.61 3n4t n SER 232 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3n4t n LEU 233 N -1.49 1.29 0.10 1.04 4.77 -0.30 -4.49 117.00 117.92 3n4t n LEU 233 Ca 0.04 -0.72 0.06 0.00 -0.03 0.00 0.00 56.01 55.36 3n4t n LEU 233 Cb 0.16 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.25 3n4t n LEU 233 CO 0.13 0.26 0.12 0.24 -1.33 0.00 0.00 177.39 176.80 3n4t h MET 234 N 1.22 0.00 -5.55 3.23 2.86 -1.24 -2.01 114.93 113.44 3n4t h MET 234 Ca 0.00 0.00 -0.51 0.00 -2.06 0.00 0.00 59.70 57.13 3n4t h MET 234 Cb 0.43 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.07 3n4t h MET 234 CO 0.00 0.20 1.62 -1.91 1.06 0.00 0.00 176.91 177.89 3n4t n GLU 235 N -2.92 0.86 -1.73 1.72 0.00 -1.26 -3.13 120.64 114.18 3n4t n GLU 235 Ca -0.02 0.08 -0.42 0.00 0.00 0.00 0.00 57.16 56.79 3n4t n GLU 235 Cb 0.69 -2.81 -0.02 0.00 0.00 0.00 0.00 31.44 29.30 3n4t n GLU 235 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 3n4t n ASP 236 N 13.40 3.61 -3.13 4.31 8.00 -1.26 -0.73 116.55 140.75 3n4t n ASP 236 Ca 0.44 1.15 -0.17 0.00 0.71 0.00 0.00 54.79 56.92 3n4t n ASP 236 Cb 0.37 -1.56 0.02 0.00 -0.02 0.00 0.00 41.12 39.92 3n4t n ASP 236 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 3n4t n ASP 237 N 2.14 -7.05 0.00 -2.24 8.00 -1.26 -4.63 116.55 111.52 3n4t n ASP 237 Ca 0.09 0.15 0.00 0.00 0.71 0.00 0.00 54.79 55.74 3n4t n ASP 237 Cb 0.36 -4.10 0.00 0.00 -0.02 0.00 0.00 41.12 37.35 3n4t n ASP 237 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02 3n4t n GLU 238 N -0.65 0.00 0.00 -1.24 4.07 -1.24 -5.09 120.64 116.49 3n4t n GLU 238 Ca 0.01 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.11 3n4t n GLU 238 Cb 0.54 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.92 3n4t n GLU 238 CO 0.00 0.00 0.00 0.39 -0.06 0.00 0.00 177.13 177.46 3n4t n GLU 239 N 0.00 3.40 0.09 5.31 -0.58 0.09 -4.90 120.64 124.05 3n4t n GLU 239 Ca 0.00 0.00 -0.04 0.00 -0.42 0.00 0.00 57.16 56.70 3n4t n GLU 239 Cb 0.00 0.00 -0.06 0.00 -0.57 0.00 0.00 31.44 30.81 3n4t n GLU 239 CO 0.00 0.00 0.00 1.88 -0.48 0.00 0.00 177.13 178.53 3n4t h TYR 240 N 0.00 0.00 0.00 -0.32 0.05 -1.50 -3.44 116.97 111.77 3n4t h TYR 240 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 3n4t h TYR 240 Cb 0.00 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.74 3n4t h TYR 240 CO 0.00 0.83 0.00 0.41 -1.05 0.00 0.00 178.16 178.35 3n4t n GLY 241 N 1.25 -0.82 0.34 3.88 0.00 -1.07 -4.46 105.19 104.32 3n4t n GLY 241 Ca 0.00 -1.65 -0.03 0.00 0.00 0.00 0.00 46.02 44.35 3n4t n GLY 241 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 3n4t h MET 242 N 0.00 1.09 -0.51 1.61 4.05 -1.86 -2.81 114.93 116.50 3n4t h MET 242 Ca 0.00 -0.13 0.02 0.00 -0.28 0.00 0.00 59.70 59.31 3n4t h MET 242 Cb 0.00 -0.21 -0.03 0.00 -0.80 0.00 0.00 31.60 30.56 3n4t h MET 242 CO 0.00 0.81 0.31 1.49 0.23 0.00 0.00 176.91 179.76 3n4t h GLU 243 N 1.10 0.61 -0.02 0.39 4.57 -1.92 -1.38 114.58 117.92 3n4t h GLU 243 Ca 0.27 -0.04 -0.03 0.00 -1.18 0.00 0.00 59.36 58.39 3n4t h GLU 243 Cb 0.05 -0.14 0.00 0.00 -0.16 0.00 0.00 28.75 28.51 3n4t h GLU 243 CO -0.04 0.40 -0.09 0.35 -1.18 0.00 0.00 179.01 178.45 3n4t h PHE 244 N 0.63 0.12 -0.24 0.92 3.04 -1.75 -3.19 116.94 116.48 3n4t h PHE 244 Ca 0.20 -0.05 0.04 0.00 3.98 0.00 0.00 57.97 62.14 3n4t h PHE 244 Cb -0.00 -0.02 -0.01 0.00 2.56 0.00 0.00 35.95 38.48 3n4t h PHE 244 CO -0.06 0.74 0.16 0.28 -2.02 0.00 0.00 178.31 177.42 3n4t h VAL 245 N -0.53 0.95 -0.05 1.41 2.07 -1.46 0.15 116.25 118.79 3n4t h VAL 245 Ca -0.01 -0.05 -0.04 0.00 0.82 0.00 0.00 66.70 67.43 3n4t h VAL 245 Cb 0.75 0.81 -0.01 0.00 -1.52 0.00 0.00 31.29 31.32 3n4t h VAL 245 CO 0.02 0.02 -0.15 0.77 0.02 0.00 0.00 177.57 178.25 3n4t h SER 246 N 0.14 0.06 -0.09 0.57 4.64 -1.23 0.11 113.55 117.74 3n4t h SER 246 Ca 0.10 -0.01 -0.02 0.00 -0.47 0.00 0.00 61.79 61.40 3n4t h SER 246 Cb 0.24 -0.02 -0.00 0.00 -0.31 0.00 0.00 62.40 62.31 3n4t h SER 246 CO -0.01 0.23 -0.00 0.11 -0.87 0.00 0.00 176.83 176.28 3n4t h LYS 247 N 0.07 0.17 -0.49 4.77 1.57 -0.74 -1.51 116.57 120.41 3n4t h LYS 247 Ca 0.01 -0.05 0.08 0.00 -1.87 0.00 0.00 60.65 58.82 3n4t h LYS 247 Cb 0.31 -0.01 -0.06 0.00 0.08 0.00 0.00 32.23 32.54 3n4t h LYS 247 CO 0.02 0.43 0.13 0.82 -0.57 0.00 0.00 179.45 180.28 3n4t h ILE 248 N -0.12 0.77 -0.42 1.86 2.04 -0.98 -1.19 117.51 119.48 3n4t h ILE 248 Ca 0.03 -0.10 -0.05 0.00 1.00 0.00 0.00 64.86 65.75 3n4t h ILE 248 Cb 0.36 0.47 -0.02 0.00 -0.74 0.00 0.00 36.82 36.89 3n4t h ILE 248 CO 0.01 0.05 0.07 -0.07 0.00 0.00 0.00 178.15 178.21 3n4t h LEU 249 N 0.28 0.59 -0.18 1.44 3.38 -0.68 -0.25 115.31 119.89 3n4t h LEU 249 Ca 0.24 -0.10 -0.14 0.00 0.09 0.00 0.00 57.88 57.97 3n4t h LEU 249 Cb 0.30 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 3n4t h LEU 249 CO -0.29 0.62 -0.69 0.78 0.09 0.00 0.00 178.44 178.95 3n4t h ASN 250 N 0.62 0.00 0.19 -0.43 -0.26 -0.65 -1.99 115.58 113.05 3n4t h ASN 250 Ca 0.14 0.00 -0.17 0.00 -0.56 0.00 0.00 56.30 55.71 3n4t h ASN 250 Cb 0.28 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.54 3n4t h ASN 250 CO 0.00 0.69 -0.64 0.45 -1.06 0.00 0.00 177.43 176.87 3n4t h HIS 251 N 0.00 0.56 0.00 1.19 3.86 -0.82 -3.18 115.15 116.75 3n4t h HIS 251 Ca -0.01 -0.22 0.00 0.00 -1.16 0.00 0.00 60.37 58.98 3n4t h HIS 251 Cb 1.45 -0.10 0.00 0.00 1.06 0.00 0.00 27.41 29.82 3n4t h HIS 251 CO 0.00 0.95 0.00 0.98 0.86 0.00 0.00 177.93 180.72 3n4t n TYR 252 N -3.89 0.63 -3.04 2.45 4.19 -0.14 -4.90 117.16 112.45 3n4t n TYR 252 Ca -0.04 0.23 -0.12 0.00 3.31 0.00 0.00 57.90 61.29 3n4t n TYR 252 Cb 0.65 -0.88 0.04 0.00 0.49 0.00 0.00 39.34 39.65 3n4t n TYR 252 CO 0.00 0.00 0.00 1.63 0.91 0.00 0.00 176.86 179.40 3n4t n LYS 253 N -2.06 -4.24 -2.39 2.98 4.01 -0.91 -4.97 118.16 110.59 3n4t n LYS 253 Ca 0.03 0.46 -0.42 0.00 -0.51 0.00 0.00 58.31 57.86 3n4t n LYS 253 Cb 0.25 -4.35 -0.03 0.00 -0.51 0.00 0.00 35.03 30.39 3n4t n LYS 253 CO 0.00 0.00 0.00 -1.58 -1.11 0.00 0.00 177.40 174.71 3n4t s HIS 254 N -3.18 3.34 -1.86 2.13 2.46 -0.80 -4.92 115.29 112.45 3n4t s HIS 254 Ca 0.26 1.21 0.26 0.00 0.47 0.00 0.00 55.06 57.26 3n4t s HIS 254 Cb -0.12 -3.47 0.60 0.00 -0.13 0.00 0.00 32.58 29.47 3n4t s HIS 254 CO 0.40 -1.49 1.47 1.63 -2.47 0.00 0.00 174.74 174.28 3n4t n LYS 255 N 4.23 0.97 -3.09 2.88 4.76 -1.26 -4.63 118.16 122.03 3n4t n LYS 255 Ca 0.10 -0.64 -0.20 0.00 -2.87 0.00 0.00 58.31 54.70 3n4t n LYS 255 Cb 0.46 -1.49 -0.04 0.00 -1.84 0.00 0.00 35.03 32.12 3n4t n LYS 255 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 3n4t n ASP 256 N -0.45 -0.53 -0.18 4.39 -0.08 -1.26 -4.98 116.55 113.45 3n4t n ASP 256 Ca 0.12 -2.84 -0.09 0.00 -1.51 0.00 0.00 54.79 50.47 3n4t n ASP 256 Cb 0.38 -0.06 0.04 0.00 2.34 0.00 0.00 41.12 43.82 3n4t n ASP 256 CO 0.00 0.00 0.00 0.40 0.12 0.00 0.00 177.20 177.72 3n4t h ILE 257 N 2.21 1.27 -0.75 5.18 2.04 -2.00 -2.64 117.51 122.82 3n4t h ILE 257 Ca 0.02 -1.20 0.13 0.00 1.00 0.00 0.00 64.86 64.81 3n4t h ILE 257 Cb 0.92 0.90 -0.05 0.00 -0.74 0.00 0.00 36.82 37.84 3n4t h ILE 257 CO 0.43 0.43 0.50 -0.65 0.00 0.00 0.00 178.15 178.86 3n4t h PRO 258 N 0.91 0.48 0.04 2.37 0.11 -1.99 -1.14 132.00 132.79 3n4t h PRO 258 Ca 0.15 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 66.23 3n4t h PRO 258 Cb 0.61 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 31.61 3n4t h PRO 258 CO 0.04 0.32 -0.02 1.15 -0.21 0.00 0.00 178.00 179.28 3n4t h THR 259 N 0.50 1.08 -0.57 -1.15 2.02 -1.90 -0.87 112.91 112.02 3n4t h THR 259 Ca 0.36 -0.36 0.10 0.00 0.77 0.00 0.00 66.41 67.29 3n4t h THR 259 Cb 0.72 1.31 -0.08 0.00 -1.74 0.00 0.00 68.15 68.36 3n4t h THR 259 CO -0.13 0.09 0.14 0.58 0.37 0.00 0.00 175.52 176.58 3n4t h VAL 260 N -0.20 0.69 -0.76 3.16 2.07 -1.33 0.54 116.25 120.42 3n4t h VAL 260 Ca -0.01 -0.10 0.02 0.00 0.82 0.00 0.00 66.70 67.44 3n4t h VAL 260 Cb 0.19 0.38 -0.04 0.00 -1.52 0.00 0.00 31.29 30.30 3n4t h VAL 260 CO 0.01 0.05 0.49 0.25 0.02 0.00 0.00 177.57 178.39 3n4t h LEU 261 N 0.28 0.84 -0.91 2.57 6.46 -1.16 0.80 115.31 124.18 3n4t h LEU 261 Ca 0.30 -0.01 -0.03 0.00 -0.12 0.00 0.00 57.88 58.02 3n4t h LEU 261 Cb 0.41 -0.20 -0.04 0.00 -0.73 0.00 0.00 40.66 40.11 3n4t h LEU 261 CO -0.36 0.59 0.43 -0.08 -0.62 0.00 0.00 178.44 178.40 3n4t h GLU 262 N 0.99 1.21 -0.49 1.25 4.81 0.00 -0.98 114.58 121.37 3n4t h GLU 262 Ca 0.29 -0.16 -0.13 0.00 -0.13 0.00 0.00 59.36 59.23 3n4t h GLU 262 Cb -0.06 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 29.08 3n4t h GLU 262 CO -0.08 0.91 -0.19 0.87 -0.73 0.00 0.00 179.01 179.79 3n4t h LYS 263 N 1.20 0.98 -0.41 1.92 1.57 -0.46 -2.30 116.57 119.07 3n4t h LYS 263 Ca 0.30 -0.40 -0.00 0.00 -1.87 0.00 0.00 60.65 58.67 3n4t h LYS 263 Cb 0.08 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.33 3n4t h LYS 263 CO -0.04 1.07 0.25 -0.92 -0.57 0.00 0.00 179.45 179.24 3n4t h TYR 264 N 0.85 0.54 -0.29 -1.35 3.20 -0.51 -1.51 116.97 117.91 3n4t h TYR 264 Ca 0.12 -0.00 -0.05 0.00 3.14 0.00 0.00 58.73 61.94 3n4t h TYR 264 Cb 0.76 -0.18 -0.02 0.00 1.54 0.00 0.00 36.73 38.83 3n4t h TYR 264 CO 0.05 0.38 -0.02 0.00 -1.64 0.00 0.00 178.16 176.93 3n4t h ARG 265 N 0.54 0.44 -0.30 1.82 3.08 -0.95 -0.84 114.38 118.18 3n4t h ARG 265 Ca 0.15 -0.09 -0.16 0.00 0.07 0.00 0.00 59.98 59.95 3n4t h ARG 265 Cb -0.00 -0.07 -0.00 0.00 0.08 0.00 0.00 29.97 29.98 3n4t h ARG 265 CO -0.03 0.49 -0.44 1.98 -1.07 0.00 0.00 179.97 180.90 3n4t h MET 266 N 0.43 0.83 -0.65 0.04 4.05 -1.17 -2.83 114.93 115.63 3n4t h MET 266 Ca 0.09 -0.49 -0.08 0.00 -0.28 0.00 0.00 59.70 58.94 3n4t h MET 266 Cb 0.32 0.04 -0.03 0.00 -0.80 0.00 0.00 31.60 31.13 3n4t h MET 266 CO 0.01 1.13 0.09 -0.22 0.23 0.00 0.00 176.91 178.14 3n4t h LYS 267 N 0.60 1.08 -0.07 0.39 3.64 -0.57 0.52 116.57 122.16 3n4t h LYS 267 Ca 0.03 -0.29 0.02 0.00 -1.27 0.00 0.00 60.65 59.14 3n4t h LYS 267 Cb 1.04 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 32.71 3n4t h LYS 267 CO 0.10 1.00 -0.06 1.49 -2.27 0.00 0.00 179.45 179.71 3n4t h GLU 268 N 1.00 -0.07 0.00 1.90 4.81 -1.18 -0.67 114.58 120.38 3n4t h GLU 268 Ca 0.20 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.40 3n4t h GLU 268 Cb 0.46 0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.85 3n4t h GLU 268 CO 0.02 -0.05 -0.12 0.87 -0.73 0.00 0.00 179.01 179.00 3n4t h LYS 269 N -0.07 0.00 0.00 1.92 1.57 -1.25 -3.04 116.57 115.70 3n4t h LYS 269 Ca 0.05 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 3n4t h LYS 269 Cb 0.14 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.45 3n4t h LYS 269 CO -0.11 0.12 -0.16 -0.92 -0.57 0.00 0.00 179.45 177.81 3n4t h TYR 270 N 0.00 0.00 -0.93 -1.35 3.20 0.53 -3.33 116.97 115.09 3n4t h TYR 270 Ca -0.00 0.00 0.05 0.00 3.14 0.00 0.00 58.73 61.91 3n4t h TYR 270 Cb 0.22 0.00 -0.06 0.00 1.54 0.00 0.00 36.73 38.44 3n4t h TYR 270 CO 0.00 0.00 0.60 2.35 -1.64 0.00 0.00 178.16 179.47 3n4t h TRP 271 N 0.00 1.12 -0.80 -3.82 -0.00 -1.12 -1.75 115.95 109.58 3n4t h TRP 271 Ca 0.00 0.03 0.19 0.00 -0.00 0.00 0.00 58.89 59.11 3n4t h TRP 271 Cb 0.79 -0.37 -0.13 0.00 -0.00 0.00 0.00 29.16 29.46 3n4t h TRP 271 CO 0.00 0.62 0.16 0.77 -0.00 0.00 0.00 178.44 179.99 3n4t h SER 272 N 1.14 -0.07 -0.24 2.65 0.02 -1.79 0.18 113.55 115.43 3n4t h SER 272 Ca 0.38 0.18 -0.20 0.00 -0.84 0.00 0.00 61.79 61.31 3n4t h SER 272 Cb 0.06 0.26 0.00 0.00 0.14 0.00 0.00 62.40 62.86 3n4t h SER 272 CO -0.14 -0.11 -0.63 -0.26 -1.14 0.00 0.00 176.83 174.55 3n4t h PHE 273 N 0.21 1.10 -0.79 3.45 0.04 -1.58 -2.26 116.94 117.11 3n4t h PHE 273 Ca 0.47 -0.42 0.11 0.00 2.80 0.00 0.00 57.97 60.93 3n4t h PHE 273 Cb 0.87 -0.19 -0.08 0.00 2.20 0.00 0.00 35.95 38.74 3n4t h PHE 273 CO -0.30 1.26 0.41 0.93 -0.60 0.00 0.00 178.31 180.01 3n4t h GLU 274 N 0.63 0.64 -0.68 1.51 4.39 -1.01 -0.48 114.58 119.58 3n4t h GLU 274 Ca -0.01 -0.04 -0.03 0.00 0.34 0.00 0.00 59.36 59.62 3n4t h GLU 274 Cb 1.25 -0.14 -0.03 0.00 -0.10 0.00 0.00 28.75 29.72 3n4t h GLU 274 CO 0.14 0.42 0.29 0.87 -1.16 0.00 0.00 179.01 179.57 3n4t h LYS 275 N 0.66 1.01 0.24 2.33 1.57 -0.81 0.38 116.57 121.94 3n4t h LYS 275 Ca 0.41 -0.17 -0.01 0.00 -1.87 0.00 0.00 60.65 59.00 3n4t h LYS 275 Cb 0.47 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.62 3n4t h LYS 275 CO -0.30 0.82 -0.11 0.82 -0.57 0.00 0.00 179.45 180.11 3n4t h ILE 276 N 0.96 0.77 0.58 1.86 1.08 -0.85 0.77 117.51 122.68 3n4t h ILE 276 Ca 0.23 -0.02 -0.03 0.00 -0.39 0.00 0.00 64.86 64.65 3n4t h ILE 276 Cb 0.17 0.78 0.01 0.00 -3.07 0.00 0.00 36.82 34.71 3n4t h ILE 276 CO -0.02 0.00 -0.28 0.40 -0.69 0.00 0.00 178.15 177.56 3n4t h ILE 277 N -0.33 0.29 -0.96 -0.67 2.04 -0.80 -0.23 117.51 116.85 3n4t h ILE 277 Ca -0.03 -0.34 0.00 0.00 1.00 0.00 0.00 64.86 65.49 3n4t h ILE 277 Cb 0.25 0.39 -0.05 0.00 -0.74 0.00 0.00 36.82 36.67 3n4t h ILE 277 CO 0.05 0.04 0.61 1.88 0.00 0.00 0.00 178.15 180.73 3n4t h TYR 278 N -1.03 1.22 -0.36 1.37 0.05 -0.37 0.22 116.97 118.08 3n4t h TYR 278 Ca -0.08 0.02 0.06 0.00 0.05 0.00 0.00 58.73 58.78 3n4t h TYR 278 Cb 0.65 -0.41 -0.05 0.00 1.01 0.00 0.00 36.73 37.93 3n4t h TYR 278 CO 0.00 0.79 0.04 0.78 -1.05 0.00 0.00 178.16 178.72 3n4t h GLY 279 N 1.30 0.39 0.72 3.88 0.00 -0.80 0.35 103.07 108.92 3n4t h GLY 279 Ca 0.35 0.01 -0.00 0.00 0.00 0.00 0.00 47.33 47.68 3n4t h GLY 279 CO -0.07 -0.05 -0.04 1.70 0.00 0.00 0.00 176.54 178.07 3n4t h LYS 280 N 0.15 -0.11 -0.17 4.80 1.63 -0.42 0.40 116.57 122.84 3n4t h LYS 280 Ca 0.17 0.01 -0.02 0.00 -0.85 0.00 0.00 60.65 59.96 3n4t h LYS 280 Cb 0.22 0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 31.87 3n4t h LYS 280 CO -0.26 0.18 0.04 0.93 -3.45 0.00 0.00 179.45 176.89 3n4t h GLU 281 N -0.39 0.28 0.00 1.90 5.08 -0.35 -3.00 114.58 118.10 3n4t h GLU 281 Ca -0.01 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 3n4t h GLU 281 Cb 0.33 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.55 3n4t h GLU 281 CO 0.02 0.43 -0.08 0.66 -1.00 0.00 0.00 179.01 179.05 3n4t n TYR 282 N -4.79 0.55 -1.10 4.33 4.01 0.12 -4.94 117.16 115.34 3n4t n TYR 282 Ca -0.05 0.16 -0.00 0.00 -0.16 0.00 0.00 57.90 57.85 3n4t n TYR 282 Cb 0.17 -0.74 -0.00 0.00 -0.31 0.00 0.00 39.34 38.46 3n4t n TYR 282 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3n4t n GLY 283 N 1.38 0.39 3.49 2.72 0.00 -0.20 -5.02 105.19 107.95 3n4t n GLY 283 Ca 0.06 -1.07 -0.42 0.00 0.00 0.00 0.00 46.02 44.59 3n4t n GLY 283 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3n4t s TYR 284 N -2.01 2.58 -0.07 1.61 4.12 -0.04 -4.90 117.35 118.64 3n4t s TYR 284 Ca 0.00 -0.36 0.27 0.00 0.02 0.00 0.00 57.07 56.99 3n4t s TYR 284 Cb 0.00 -4.36 0.85 0.00 -1.52 0.00 0.00 41.96 36.93 3n4t s TYR 284 CO 0.00 -1.73 1.79 0.52 0.02 0.00 0.00 175.55 176.15 3n4t h MET 285 N 9.66 0.00 -0.74 -0.62 2.86 -1.96 -2.30 114.93 121.83 3n4t h MET 285 Ca -0.28 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.32 3n4t h MET 285 Cb 1.07 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.69 3n4t h MET 285 CO 1.20 0.09 0.31 0.38 1.06 0.00 0.00 176.91 179.95 3n4t h ASP 286 N 0.00 1.01 -0.13 1.22 -0.00 -1.95 -1.13 116.42 115.44 3n4t h ASP 286 Ca -0.00 -0.16 -0.01 0.00 -0.00 0.00 0.00 57.03 56.85 3n4t h ASP 286 Cb 0.78 -0.26 -0.01 0.00 -0.00 0.00 0.00 39.33 39.85 3n4t h ASP 286 CO 0.01 0.89 0.03 -0.50 -0.00 0.00 0.00 179.24 179.68 3n4t h TRP 287 N 1.06 0.22 0.30 4.15 4.06 -1.78 -1.87 115.95 122.08 3n4t h TRP 287 Ca 0.25 -0.03 -0.01 0.00 2.06 0.00 0.00 58.89 61.16 3n4t h TRP 287 Cb 0.19 -0.06 -0.00 0.00 -1.00 0.00 0.00 29.16 28.28 3n4t h TRP 287 CO 0.02 0.36 -0.18 -0.92 -3.56 0.00 0.00 178.44 174.16 3n4t h TYR 288 N 0.02 -0.46 -0.13 0.49 3.20 -1.34 -1.96 116.97 116.79 3n4t h TYR 288 Ca 0.04 -0.01 -0.03 0.00 3.14 0.00 0.00 58.73 61.88 3n4t h TYR 288 Cb 0.25 0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.67 3n4t h TYR 288 CO 0.01 -0.28 -0.05 0.93 -1.64 0.00 0.00 178.16 177.13 3n4t h GLU 289 N -0.45 0.19 -0.18 1.82 4.39 -1.25 -1.20 114.58 117.90 3n4t h GLU 289 Ca -0.03 -0.03 -0.08 0.00 0.34 0.00 0.00 59.36 59.56 3n4t h GLU 289 Cb 0.37 -0.03 -0.00 0.00 -0.10 0.00 0.00 28.75 28.99 3n4t h GLU 289 CO 0.04 0.26 -0.19 1.49 -1.16 0.00 0.00 179.01 179.45 3n4t h GLU 290 N 0.19 0.45 -0.29 2.33 4.81 -1.09 -0.15 114.58 120.82 3n4t h GLU 290 Ca 0.04 -0.24 -0.09 0.00 -0.13 0.00 0.00 59.36 58.95 3n4t h GLU 290 Cb 0.22 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.60 3n4t h GLU 290 CO 0.01 0.81 -0.16 0.78 -0.73 0.00 0.00 179.01 179.72 3n4t h GLY 291 N 0.10 0.66 0.74 1.92 0.00 -1.18 -1.52 103.07 103.80 3n4t h GLY 291 Ca 0.03 -0.61 0.07 0.00 0.00 0.00 0.00 47.33 46.82 3n4t h GLY 291 CO 0.05 0.55 0.63 -2.00 0.00 0.00 0.00 176.54 175.77 3n4t h LEU 292 N 0.35 0.99 -0.32 3.11 5.85 -1.23 0.29 115.31 124.34 3n4t h LEU 292 Ca 0.06 0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.74 3n4t h LEU 292 Cb 0.68 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.50 3n4t h LEU 292 CO 0.05 0.62 0.00 -1.13 -0.34 0.00 0.00 178.44 177.64 3n4t h ASN 293 N 1.11 0.56 -0.14 1.25 -0.73 -0.90 -1.97 115.58 114.76 3n4t h ASN 293 Ca 0.43 -0.31 -0.05 0.00 1.87 0.00 0.00 56.30 58.25 3n4t h ASN 293 Cb 0.22 -0.15 -0.01 0.00 0.27 0.00 0.00 38.32 38.64 3n4t h ASN 293 CO -0.18 0.73 -0.04 -0.33 -0.37 0.00 0.00 177.43 177.24 3n4t h GLU 294 N 0.37 0.40 -0.10 6.67 5.08 -0.16 -2.82 114.58 124.02 3n4t h GLU 294 Ca 0.09 -0.08 -0.22 0.00 -1.00 0.00 0.00 59.36 58.15 3n4t h GLU 294 Cb 0.44 -0.06 0.01 0.00 0.50 0.00 0.00 28.75 29.64 3n4t h GLU 294 CO 0.02 0.46 -0.82 0.82 -1.00 0.00 0.00 179.01 178.49 3n4t h ILE 295 N 0.39 1.31 0.00 3.13 2.04 -0.40 -2.67 117.51 121.31 3n4t h ILE 295 Ca 0.08 -2.09 0.00 0.00 1.00 0.00 0.00 64.86 63.86 3n4t h ILE 295 Cb 0.32 2.10 0.00 0.00 -0.74 0.00 0.00 36.82 38.50 3n4t h ILE 295 CO 0.01 0.65 0.00 0.54 0.00 0.00 0.00 178.15 179.35 3n4t n ARG 296 N -3.89 0.17 0.00 2.37 1.74 -0.75 -5.04 116.66 111.26 3n4t n ARG 296 Ca -0.07 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.01 3n4t n ARG 296 Cb 0.76 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.72 3n4t n ARG 296 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54