#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s3s h PRO 23 N 0.00 0.00 0.00 2.89 0.11 -1.99 -3.37 132.00 129.63 1s3s h PRO 23 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1s3s h PRO 23 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 1s3s h PRO 23 CO 0.00 0.08 0.41 0.09 -0.21 0.00 0.00 178.00 178.37 1s3s n ASN 24 N -3.22 0.00 -4.68 -2.05 4.13 -1.26 -4.61 115.26 103.56 1s3s n ASN 24 Ca 0.00 0.02 -0.40 0.00 1.68 0.00 0.00 54.58 55.88 1s3s n ASN 24 Cb 0.35 0.00 -0.05 0.00 -1.54 0.00 0.00 39.78 38.53 1s3s n ASN 24 CO 0.00 0.00 0.00 -0.13 0.28 0.00 0.00 177.26 177.41 1s3s s ARG 25 N -1.65 4.30 0.04 3.52 1.81 -1.26 -0.72 118.95 124.99 1s3s s ARG 25 Ca 0.00 0.71 0.03 0.00 -1.72 0.00 0.00 55.73 54.75 1s3s s ARG 25 Cb 0.00 -3.53 -0.02 0.00 -0.45 0.00 0.00 34.95 30.95 1s3s s ARG 25 CO 0.00 -0.12 -0.08 -0.51 -0.68 0.00 0.00 175.30 173.90 1s3s s LEU 26 N 1.50 2.25 -0.17 2.53 1.43 -0.41 -4.95 118.68 120.86 1s3s s LEU 26 Ca 0.32 -0.54 -0.22 0.00 -1.03 0.00 0.00 54.13 52.66 1s3s s LEU 26 Cb -0.16 -0.21 -0.03 0.00 0.03 0.00 0.00 46.19 45.82 1s3s s LEU 26 CO 0.13 -0.18 0.67 -0.63 0.23 0.00 0.00 176.35 176.57 1s3s s ILE 27 N -1.31 5.01 -0.00 -0.59 1.01 -0.84 -0.85 121.20 123.63 1s3s s ILE 27 Ca -0.08 1.29 -0.30 0.00 0.00 0.00 0.00 60.65 61.55 1s3s s ILE 27 Cb -0.10 -3.98 -0.06 0.00 0.01 0.00 0.00 42.46 38.33 1s3s s ILE 27 CO 0.01 0.13 1.49 0.54 0.00 0.00 0.00 174.94 177.10 1s3s s VAL 28 N 1.71 3.58 0.00 2.92 0.11 0.74 -1.01 120.40 128.45 1s3s s VAL 28 Ca 0.31 0.93 0.00 0.00 -2.93 0.00 0.00 61.98 60.29 1s3s s VAL 28 Cb -0.16 -3.60 0.00 0.00 -1.53 0.00 0.00 36.38 31.09 1s3s s VAL 28 CO 0.12 -0.02 0.00 -0.67 -3.33 0.00 0.00 175.10 171.20 1s3s n ASP 29 N 5.78 1.71 -4.79 3.54 2.03 -1.10 -1.13 116.55 122.59 1s3s n ASP 29 Ca 0.14 -0.77 -0.39 0.00 0.52 0.00 0.00 54.79 54.30 1s3s n ASP 29 Cb 0.43 0.00 -0.06 0.00 -0.72 0.00 0.00 41.12 40.77 1s3s n ASP 29 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 1s3s s GLU 30 N -1.23 4.37 0.87 -0.67 2.02 -1.26 -3.55 118.70 119.25 1s3s s GLU 30 Ca 0.00 0.93 -0.11 0.00 0.02 0.00 0.00 54.97 55.80 1s3s s GLU 30 Cb 0.00 -3.26 0.11 0.00 0.10 0.00 0.00 34.13 31.09 1s3s s GLU 30 CO 0.00 0.59 1.09 0.00 0.02 0.00 0.00 175.26 176.96 1s3s s ALA 31 N -1.05 1.68 0.00 5.21 0.00 -0.69 -4.27 121.76 122.64 1s3s s ALA 31 Ca 0.32 0.04 0.00 0.00 0.00 0.00 0.00 51.96 52.32 1s3s s ALA 31 Cb -0.21 -3.22 0.00 0.00 0.00 0.00 0.00 23.12 19.69 1s3s s ALA 31 CO 0.22 -2.25 0.00 -0.89 0.00 0.00 0.00 175.76 172.84 1s3s n ILE 32 N -3.82 0.00 -3.68 0.00 2.08 -1.26 -4.90 119.36 107.78 1s3s n ILE 32 Ca 0.08 0.00 -0.37 0.00 0.56 0.00 0.00 62.75 63.01 1s3s n ILE 32 Cb 0.55 -0.31 -0.12 0.00 -0.75 0.00 0.00 39.64 39.01 1s3s n ILE 32 CO 0.00 0.00 0.00 0.21 0.56 0.00 0.00 176.55 177.32 1s3s s ASN 33 N -2.08 5.61 0.24 4.38 3.84 -1.26 -5.01 114.94 120.66 1s3s s ASN 33 Ca 0.00 -0.09 -0.05 0.00 0.21 0.00 0.00 52.86 52.93 1s3s s ASN 33 Cb 0.00 -2.03 0.45 0.00 -0.55 0.00 0.00 41.25 39.13 1s3s s ASN 33 CO 0.00 -0.03 1.71 1.05 -2.79 0.00 0.00 177.10 177.04 1s3s h GLU 34 N 8.24 0.37 -4.76 0.43 -0.00 -1.96 -3.44 114.58 113.46 1s3s h GLU 34 Ca -0.37 -0.02 -0.68 0.00 -0.00 0.00 0.00 59.36 58.29 1s3s h GLU 34 Cb 1.18 -0.08 -0.00 0.00 -0.00 0.00 0.00 28.75 29.85 1s3s h GLU 34 CO 0.57 0.24 0.65 -0.25 -0.00 0.00 0.00 179.01 180.22 1s3s n ASP 35 N -5.05 0.88 0.15 3.06 8.00 -1.26 -4.77 116.55 117.56 1s3s n ASP 35 Ca 0.14 0.86 0.12 0.00 0.71 0.00 0.00 54.79 56.62 1s3s n ASP 35 Cb 0.43 -0.70 0.53 0.00 -0.02 0.00 0.00 41.12 41.36 1s3s n ASP 35 CO 0.00 0.00 0.00 0.78 -0.39 0.00 0.00 177.20 177.59 1s3s h ASN 36 N 4.63 0.00 0.60 -2.24 2.35 -1.95 -2.29 115.58 116.67 1s3s h ASN 36 Ca -0.29 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.46 1s3s h ASN 36 Cb 1.09 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.46 1s3s h ASN 36 CO 0.80 0.00 -0.93 -1.54 -1.65 0.00 0.00 177.43 174.10 1s3s n SER 37 N -2.34 0.64 -4.88 5.81 3.41 -1.26 -4.59 113.62 110.41 1s3s n SER 37 Ca 0.01 -0.06 -0.35 0.00 -0.26 0.00 0.00 58.87 58.22 1s3s n SER 37 Cb 0.21 0.61 -0.05 0.00 -0.26 0.00 0.00 64.21 64.72 1s3s n SER 37 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1s3s s VAL 38 N -3.21 5.29 -0.02 -3.33 0.11 -0.86 -0.37 120.40 118.00 1s3s s VAL 38 Ca 0.04 0.19 0.01 0.00 -2.93 0.00 0.00 61.98 59.29 1s3s s VAL 38 Cb 0.14 -3.57 0.01 0.00 -1.53 0.00 0.00 36.38 31.43 1s3s s VAL 38 CO 0.78 0.37 -0.04 0.68 -3.33 0.00 0.00 175.10 173.56 1s3s s VAL 39 N -1.30 0.38 0.16 2.04 -7.23 0.04 -4.48 120.40 110.01 1s3s s VAL 39 Ca 0.28 -0.11 0.04 0.00 -1.81 0.00 0.00 61.98 60.38 1s3s s VAL 39 Cb -0.13 -0.39 -0.04 0.00 0.56 0.00 0.00 36.38 36.38 1s3s s VAL 39 CO 0.16 0.16 0.17 -0.44 -0.31 0.00 0.00 175.10 174.83 1s3s s SER 40 N 0.50 5.69 0.33 4.85 0.01 0.42 -1.89 113.70 123.61 1s3s s SER 40 Ca -0.06 -0.06 0.02 0.00 1.31 0.00 0.00 55.95 57.16 1s3s s SER 40 Cb -0.09 -1.54 -0.01 0.00 0.21 0.00 0.00 66.02 64.59 1s3s s SER 40 CO -0.00 0.07 0.39 0.18 0.41 0.00 0.00 173.24 174.29 1s3s n LEU 41 N -0.37 0.00 -4.79 2.44 4.77 -0.99 -0.97 117.00 117.09 1s3s n LEU 41 Ca -0.08 -2.82 -0.36 0.00 -0.03 0.00 0.00 56.01 52.72 1s3s n LEU 41 Cb 0.54 2.11 -0.08 0.00 -2.33 0.00 0.00 43.42 43.67 1s3s n LEU 41 CO 0.44 -0.58 -0.23 -0.55 -1.33 0.00 0.00 177.39 175.15 1s3s s SER 42 N -3.12 5.91 0.25 -1.43 0.15 -1.26 0.80 113.70 115.00 1s3s s SER 42 Ca 0.31 0.32 -0.12 0.00 0.70 0.00 0.00 55.95 57.16 1s3s s SER 42 Cb 0.00 -1.84 0.36 0.00 -1.71 0.00 0.00 66.02 62.83 1s3s s SER 42 CO 0.22 0.38 1.51 0.00 1.20 0.00 0.00 173.24 176.55 1s3s n GLN 43 N 2.19 -0.15 -0.25 5.44 10.64 -1.26 0.59 117.38 134.58 1s3s n GLN 43 Ca -0.19 1.50 0.13 0.00 -1.83 0.00 0.00 57.00 56.62 1s3s n GLN 43 Cb 0.54 -2.24 0.41 0.00 -0.86 0.00 0.00 30.24 28.09 1s3s n GLN 43 CO 0.00 0.00 0.00 -1.35 -1.83 0.00 0.00 177.06 173.88 1s3s h PRO 44 N 0.00 0.60 -0.06 2.61 0.11 -1.94 0.30 132.00 133.61 1s3s h PRO 44 Ca 0.41 -0.04 -0.13 0.00 0.11 0.00 0.00 66.00 66.36 1s3s h PRO 44 Cb 0.65 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 31.62 1s3s h PRO 44 CO -0.98 0.39 -0.53 -0.22 -0.21 0.00 0.00 178.00 176.45 1s3s h LYS 45 N 0.61 0.18 -0.33 1.05 3.11 -0.19 -2.87 116.57 118.14 1s3s h LYS 45 Ca 0.45 -0.11 -0.15 0.00 -2.81 0.00 0.00 60.65 58.03 1s3s h LYS 45 Cb 0.81 0.01 -0.01 0.00 -1.00 0.00 0.00 32.23 32.04 1s3s h LYS 45 CO -0.20 0.67 -0.39 0.52 -2.81 0.00 0.00 179.45 177.24 1s3s h MET 46 N 0.14 0.78 -0.27 1.90 2.86 0.38 -2.02 114.93 118.70 1s3s h MET 46 Ca 0.00 -0.41 -0.00 0.00 -2.06 0.00 0.00 59.70 57.23 1s3s h MET 46 Cb 0.98 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.64 1s3s h MET 46 CO 0.08 1.04 0.15 -0.44 1.06 0.00 0.00 176.91 178.79 1s3s h ASP 47 N 0.64 0.31 -0.06 1.22 3.32 -1.00 0.13 116.42 120.98 1s3s h ASP 47 Ca 0.05 -0.01 -0.20 0.00 0.02 0.00 0.00 57.03 56.89 1s3s h ASP 47 Cb 0.95 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.42 1s3s h ASP 47 CO 0.09 0.25 -0.70 -0.33 -1.72 0.00 0.00 179.24 176.83 1s3s h GLU 48 N 0.37 0.69 -0.37 3.56 3.07 -1.22 -3.20 114.58 117.48 1s3s h GLU 48 Ca 0.10 -0.52 0.00 0.00 -0.50 0.00 0.00 59.36 58.43 1s3s h GLU 48 Cb 0.00 0.10 0.00 0.00 -0.84 0.00 0.00 28.75 28.01 1s3s h GLU 48 CO -0.02 1.14 0.00 1.28 -1.40 0.00 0.00 179.01 180.02 1s3s n LEU 49 N -3.93 2.97 -3.74 1.33 4.32 -0.81 -4.97 117.00 112.18 1s3s n LEU 49 Ca -0.06 -1.31 -0.30 0.00 -0.02 0.00 0.00 56.01 54.32 1s3s n LEU 49 Cb 0.70 -0.24 0.02 0.00 -1.62 0.00 0.00 43.42 42.28 1s3s n LEU 49 CO 0.51 0.65 -0.09 1.67 -1.22 0.00 0.00 177.39 178.91 1s3s n GLN 50 N 1.17 -1.06 -4.16 3.23 -0.06 0.40 -4.94 117.38 111.95 1s3s n GLN 50 Ca 0.19 0.55 -0.17 0.00 -2.00 0.00 0.00 57.00 55.56 1s3s n GLN 50 Cb 0.52 -3.44 -0.12 0.00 -4.06 0.00 0.00 30.24 23.14 1s3s n GLN 50 CO 0.00 0.00 0.00 -0.51 -0.20 0.00 0.00 177.06 176.35 1s3s s LEU 51 N -6.08 2.26 0.29 1.69 1.43 -1.04 -5.06 118.68 112.17 1s3s s LEU 51 Ca 0.31 -0.59 0.07 0.00 -1.03 0.00 0.00 54.13 52.89 1s3s s LEU 51 Cb -0.14 -0.45 -0.03 0.00 0.03 0.00 0.00 46.19 45.61 1s3s s LEU 51 CO 0.89 -0.09 0.32 -0.36 0.23 0.00 0.00 176.35 177.33 1s3s s PHE 52 N -1.26 3.13 -0.38 0.29 0.40 -1.26 -4.73 117.98 114.18 1s3s s PHE 52 Ca -0.03 -0.16 0.00 0.00 -0.60 0.00 0.00 56.93 56.13 1s3s s PHE 52 Cb -0.10 -1.67 0.00 0.00 0.51 0.00 0.00 43.02 41.77 1s3s s PHE 52 CO 0.02 0.30 0.05 0.54 0.70 0.00 0.00 175.22 176.84 1s3s n ARG 53 N -1.38 0.00 0.00 0.44 5.12 -1.26 -1.79 116.66 117.79 1s3s n ARG 53 Ca -0.05 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.87 1s3s n ARG 53 Cb 0.58 -1.29 0.00 0.00 -1.16 0.00 0.00 32.46 30.60 1s3s n ARG 53 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1s3s n GLY 54 N -0.38 0.78 3.59 -0.13 0.00 -1.19 -4.63 105.19 103.22 1s3s n GLY 54 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 1s3s n GLY 54 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1s3s n ASP 55 N 0.00 0.43 -4.58 1.61 8.00 -0.74 -4.64 116.55 116.63 1s3s n ASP 55 Ca 0.00 0.80 -0.42 0.00 0.71 0.00 0.00 54.79 55.88 1s3s n ASP 55 Cb 0.27 -1.35 -0.05 0.00 -0.02 0.00 0.00 41.12 39.97 1s3s n ASP 55 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1s3s s THR 56 N -1.55 4.76 0.07 -3.53 2.01 -1.26 -2.37 115.64 113.78 1s3s s THR 56 Ca 0.74 0.83 0.03 0.00 0.31 0.00 0.00 61.69 63.61 1s3s s THR 56 Cb -0.43 -4.19 -0.04 0.00 0.01 0.00 0.00 72.50 67.86 1s3s s THR 56 CO 0.49 -0.41 0.05 -0.69 -0.69 0.00 0.00 174.62 173.36 1s3s s VAL 57 N 3.03 4.34 -0.12 3.82 1.01 0.31 -1.88 120.40 130.91 1s3s s VAL 57 Ca 0.30 -0.80 -0.07 0.00 0.00 0.00 0.00 61.98 61.41 1s3s s VAL 57 Cb -0.13 -3.07 -0.04 0.00 0.00 0.00 0.00 36.38 33.14 1s3s s VAL 57 CO 0.16 0.16 0.13 -0.22 0.00 0.00 0.00 175.10 175.33 1s3s s LEU 58 N -2.25 4.31 -0.06 3.92 2.96 0.22 -1.76 118.68 126.02 1s3s s LEU 58 Ca 0.27 0.43 -0.01 0.00 -0.22 0.00 0.00 54.13 54.60 1s3s s LEU 58 Cb -0.12 -2.05 0.03 0.00 0.50 0.00 0.00 46.19 44.55 1s3s s LEU 58 CO 0.19 0.40 -0.00 -0.76 -1.32 0.00 0.00 176.35 174.86 1s3s s LEU 59 N -0.97 0.76 0.02 -0.68 1.43 -0.12 -1.29 118.68 117.83 1s3s s LEU 59 Ca 0.15 -0.08 0.08 0.00 -1.03 0.00 0.00 54.13 53.25 1s3s s LEU 59 Cb -0.12 -0.41 -0.02 0.00 0.03 0.00 0.00 46.19 45.67 1s3s s LEU 59 CO 0.04 -0.16 -0.24 -1.59 0.23 0.00 0.00 176.35 174.62 1s3s s LYS 60 N 1.70 1.79 0.00 1.70 -2.85 -1.21 0.67 119.74 121.54 1s3s s LYS 60 Ca 0.01 -0.98 0.00 0.00 -1.00 0.00 0.00 55.97 54.00 1s3s s LYS 60 Cb -0.13 -1.86 0.00 0.00 -2.06 0.00 0.00 37.83 33.79 1s3s s LYS 60 CO -0.04 0.49 0.00 0.41 0.10 0.00 0.00 175.35 176.31 1s3s n GLY 61 N 2.08 5.59 3.68 0.59 0.00 0.47 -3.25 105.19 114.34 1s3s n GLY 61 Ca -0.16 -1.54 -0.29 0.00 0.00 0.00 0.00 46.02 44.02 1s3s n GLY 61 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1s3s s LYS 62 N 1.73 -0.16 -1.30 1.61 -2.85 -1.26 -3.59 119.74 113.92 1s3s s LYS 62 Ca 0.00 0.14 0.00 0.00 -1.00 0.00 0.00 55.97 55.11 1s3s s LYS 62 Cb 0.00 -1.70 0.00 0.00 -2.06 0.00 0.00 37.83 34.07 1s3s s LYS 62 CO 0.00 -3.04 0.00 1.63 0.10 0.00 0.00 175.35 174.04 1s3s n LYS 63 N -4.33 -1.31 -3.52 1.78 4.76 -1.26 -2.63 118.16 111.65 1s3s n LYS 63 Ca 0.10 0.91 -0.19 0.00 -2.87 0.00 0.00 58.31 56.25 1s3s n LYS 63 Cb 0.59 -5.13 0.07 0.00 -1.84 0.00 0.00 35.03 28.72 1s3s n LYS 63 CO 0.00 0.00 0.00 -2.13 -1.37 0.00 0.00 177.40 173.90 1s3s n ARG 64 N -1.72 -6.36 -4.38 1.97 3.00 -1.24 -5.01 116.66 102.91 1s3s n ARG 64 Ca -0.12 0.79 -0.30 0.00 -0.00 0.00 0.00 57.85 58.22 1s3s n ARG 64 Cb 0.52 -5.71 -0.12 0.00 0.00 0.00 0.00 32.46 27.16 1s3s n ARG 64 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.63 178.66 1s3s s ARG 65 N -5.63 1.84 0.14 -0.14 1.81 -1.08 -5.00 118.95 110.89 1s3s s ARG 65 Ca 0.08 -1.14 0.05 0.00 -1.72 0.00 0.00 55.73 53.00 1s3s s ARG 65 Cb -0.04 -2.13 -0.04 0.00 -0.45 0.00 0.00 34.95 32.29 1s3s s ARG 65 CO 0.75 0.49 -0.12 -1.21 -0.68 0.00 0.00 175.30 174.54 1s3s s GLU 66 N -1.99 1.04 -0.09 3.54 2.02 -1.26 -0.40 118.70 121.56 1s3s s GLU 66 Ca 0.17 -1.36 -0.13 0.00 0.02 0.00 0.00 54.97 53.67 1s3s s GLU 66 Cb -0.11 -0.74 0.03 0.00 0.10 0.00 0.00 34.13 33.42 1s3s s GLU 66 CO 0.09 0.11 0.34 0.00 0.02 0.00 0.00 175.26 175.82 1s3s s ALA 67 N -2.81 -0.84 -0.23 5.21 0.00 0.21 -4.81 121.76 118.50 1s3s s ALA 67 Ca 0.13 0.77 -0.06 0.00 0.00 0.00 0.00 51.96 52.80 1s3s s ALA 67 Cb -0.01 -0.36 -0.02 0.00 0.00 0.00 0.00 23.12 22.73 1s3s s ALA 67 CO 0.02 -0.20 0.02 0.08 0.00 0.00 0.00 175.76 175.68 1s3s s VAL 68 N -0.32 3.98 0.16 0.00 1.01 -1.26 -0.94 120.40 123.02 1s3s s VAL 68 Ca -0.05 -0.29 0.04 0.00 0.00 0.00 0.00 61.98 61.68 1s3s s VAL 68 Cb -0.03 -2.83 -0.01 0.00 0.00 0.00 0.00 36.38 33.50 1s3s s VAL 68 CO 0.02 0.39 0.13 0.00 0.00 0.00 0.00 175.10 175.64 1s3s s ILE 70 N -2.61 3.30 -0.26 0.00 -1.09 0.50 -0.53 121.20 120.51 1s3s s ILE 70 Ca 0.18 -0.59 -0.11 0.00 -2.23 0.00 0.00 60.65 57.91 1s3s s ILE 70 Cb 0.01 -2.38 -0.05 0.00 -1.58 0.00 0.00 42.46 38.46 1s3s s ILE 70 CO 0.13 0.54 0.17 -0.69 -1.23 0.00 0.00 174.94 173.86 1s3s s VAL 71 N 0.02 5.33 0.47 2.92 1.01 -1.00 -0.78 120.40 128.37 1s3s s VAL 71 Ca -0.03 0.17 0.05 0.00 0.00 0.00 0.00 61.98 62.17 1s3s s VAL 71 Cb -0.14 -3.51 -0.03 0.00 0.00 0.00 0.00 36.38 32.70 1s3s s VAL 71 CO 0.04 0.30 0.12 -0.76 0.00 0.00 0.00 175.10 174.80 1s3s s LEU 72 N 1.41 2.73 0.37 3.92 1.43 -0.79 -3.16 118.68 124.58 1s3s s LEU 72 Ca 0.07 -1.36 0.07 0.00 -1.03 0.00 0.00 54.13 51.89 1s3s s LEU 72 Cb -0.15 -1.05 -0.02 0.00 0.03 0.00 0.00 46.19 45.01 1s3s s LEU 72 CO 0.08 -0.72 0.38 -0.94 0.23 0.00 0.00 176.35 175.38 1s3s s SER 73 N -3.92 5.39 -0.22 2.29 1.04 -1.26 -2.35 113.70 114.67 1s3s s SER 73 Ca 0.27 -0.50 -0.15 0.00 0.48 0.00 0.00 55.95 56.06 1s3s s SER 73 Cb 0.03 -0.88 0.07 0.00 0.10 0.00 0.00 66.02 65.34 1s3s s SER 73 CO 0.15 -0.49 0.55 -0.62 0.98 0.00 0.00 173.24 173.81 1s3s s ASP 74 N -4.10 -0.69 0.42 7.02 -1.08 0.24 -4.70 116.67 113.78 1s3s s ASP 74 Ca 0.45 1.18 0.26 0.00 -0.52 0.00 0.00 52.55 53.92 1s3s s ASP 74 Cb -0.06 1.10 0.65 0.00 -1.46 0.00 0.00 42.92 43.15 1s3s s ASP 74 CO 0.28 -0.21 1.72 0.44 0.52 0.00 0.00 175.17 177.92 1s3s h ASP 75 N 6.55 0.00 0.53 -0.34 5.19 -1.99 -3.09 116.42 123.26 1s3s h ASP 75 Ca -0.32 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.09 1s3s h ASP 75 Cb 1.20 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.71 1s3s h ASP 75 CO 0.21 0.00 -1.08 0.35 -3.12 0.00 0.00 179.24 175.60 1s3s n THR 76 N -2.92 0.25 -2.17 0.35 -2.24 -1.26 -4.91 114.28 101.38 1s3s n THR 76 Ca 0.03 -0.32 -0.41 0.00 -2.27 0.00 0.00 64.05 61.08 1s3s n THR 76 Cb 0.45 0.06 -0.03 0.00 -2.10 0.00 0.00 70.33 68.72 1s3s n THR 76 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1s3s s SER 78 N 0.33 6.61 0.30 0.00 1.04 -1.26 -4.53 113.70 116.18 1s3s s SER 78 Ca 0.57 0.51 0.16 0.00 0.48 0.00 0.00 55.95 57.67 1s3s s SER 78 Cb -0.38 -2.40 1.06 0.00 0.10 0.00 0.00 66.02 64.40 1s3s s SER 78 CO 0.40 -0.67 1.30 0.47 0.98 0.00 0.00 173.24 175.71 1s3s n ASP 79 N 6.32 0.25 0.26 7.02 8.00 -1.26 0.89 116.55 138.02 1s3s n ASP 79 Ca 0.03 1.37 0.17 0.00 0.71 0.00 0.00 54.79 57.07 1s3s n ASP 79 Cb 0.48 -0.65 0.91 0.00 -0.02 0.00 0.00 41.12 41.85 1s3s n ASP 79 CO 0.00 0.00 0.00 1.05 -0.39 0.00 0.00 177.20 177.86 1s3s h GLU 80 N 0.00 0.00 -5.26 -1.24 4.11 -1.96 -3.45 114.58 106.79 1s3s h GLU 80 Ca 0.68 0.00 -0.60 0.00 0.07 0.00 0.00 59.36 59.51 1s3s h GLU 80 Cb 1.77 0.00 -0.13 0.00 0.50 0.00 0.00 28.75 30.89 1s3s h GLU 80 CO -0.65 0.00 -0.55 0.15 0.07 0.00 0.00 179.01 178.03 1s3s s LYS 81 N -3.87 1.99 -0.27 1.06 1.02 0.26 -1.98 119.74 117.95 1s3s s LYS 81 Ca -0.04 -2.20 -0.02 0.00 0.02 0.00 0.00 55.97 53.73 1s3s s LYS 81 Cb 0.10 -1.20 0.09 0.00 -0.52 0.00 0.00 37.83 36.29 1s3s s LYS 81 CO 0.30 -0.30 0.07 -1.50 -0.92 0.00 0.00 175.35 173.01 1s3s s ILE 82 N -3.00 0.72 0.27 2.17 2.07 -0.18 -4.66 121.20 118.58 1s3s s ILE 82 Ca 0.22 -1.07 -0.30 0.00 -1.41 0.00 0.00 60.65 58.09 1s3s s ILE 82 Cb 0.05 -1.41 -0.10 0.00 0.13 0.00 0.00 42.46 41.12 1s3s s ILE 82 CO 0.11 -0.50 1.44 -0.13 -1.91 0.00 0.00 174.94 173.95 1s3s s ARG 83 N 1.72 4.26 0.00 3.50 0.52 -0.15 -2.71 118.95 126.10 1s3s s ARG 83 Ca 0.05 2.32 -0.28 0.00 -0.52 0.00 0.00 55.73 57.30 1s3s s ARG 83 Cb -0.17 -3.09 0.08 0.00 0.52 0.00 0.00 34.95 32.28 1s3s s ARG 83 CO -0.20 -0.41 0.70 0.00 0.02 0.00 0.00 175.30 175.41 1s3s s MET 84 N -0.62 1.06 0.35 3.54 0.23 -1.23 -0.43 119.30 122.20 1s3s s MET 84 Ca 0.58 0.00 -0.07 0.00 -1.03 0.00 0.00 55.69 55.17 1s3s s MET 84 Cb -0.42 0.49 -0.06 0.00 -1.53 0.00 0.00 34.83 33.32 1s3s s MET 84 CO 0.45 -0.38 0.66 0.54 -2.03 0.00 0.00 175.02 174.27 1s3s s ASN 85 N -1.71 6.46 0.62 -1.18 2.20 -1.26 -1.71 114.94 118.36 1s3s s ASN 85 Ca -0.06 0.90 0.24 0.00 -0.94 0.00 0.00 52.86 53.01 1s3s s ASN 85 Cb -0.00 -2.23 0.98 0.00 -2.00 0.00 0.00 41.25 38.00 1s3s s ASN 85 CO 0.01 -0.31 1.45 -0.09 -2.94 0.00 0.00 177.10 175.22 1s3s h ARG 86 N 1.38 0.00 0.13 3.55 2.43 -1.96 -1.91 114.38 118.00 1s3s h ARG 86 Ca -0.47 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 58.69 1s3s h ARG 86 Cb 1.19 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.74 1s3s h ARG 86 CO 0.65 0.00 -0.06 0.28 -1.51 0.00 0.00 179.97 179.32 1s3s h VAL 87 N 0.00 1.01 0.66 0.20 2.07 -1.93 -1.17 116.25 117.09 1s3s h VAL 87 Ca 0.32 -0.64 -0.03 0.00 0.82 0.00 0.00 66.70 67.16 1s3s h VAL 87 Cb 2.21 1.41 0.01 0.00 -1.52 0.00 0.00 31.29 33.39 1s3s h VAL 87 CO -0.00 0.15 -0.32 0.58 0.02 0.00 0.00 177.57 178.00 1s3s h VAL 88 N -0.48 0.21 -1.10 2.57 2.07 -1.60 -2.37 116.25 115.54 1s3s h VAL 88 Ca -0.02 -0.26 0.43 0.00 0.82 0.00 0.00 66.70 67.67 1s3s h VAL 88 Cb 0.39 0.27 -0.16 0.00 -1.52 0.00 0.00 31.29 30.27 1s3s h VAL 88 CO 0.03 0.02 0.64 -1.14 0.02 0.00 0.00 177.57 177.15 1s3s n ARG 89 N -5.40 -0.05 -0.04 1.57 0.63 -1.07 0.10 116.66 112.40 1s3s n ARG 89 Ca -0.12 1.30 -0.14 0.00 -0.92 0.00 0.00 57.85 57.96 1s3s n ARG 89 Cb 0.37 -2.41 -0.08 0.00 0.45 0.00 0.00 32.46 30.79 1s3s n ARG 89 CO 0.00 0.00 0.00 -0.97 -2.51 0.00 0.00 177.63 174.15 1s3s h ASN 90 N 0.00 0.37 0.29 6.15 -0.73 -0.96 -1.00 115.58 119.70 1s3s h ASN 90 Ca 0.84 -0.57 -0.01 0.00 1.87 0.00 0.00 56.30 58.42 1s3s h ASN 90 Cb 2.39 -0.11 -0.00 0.00 0.27 0.00 0.00 38.32 40.87 1s3s h ASN 90 CO -0.64 0.87 -0.05 0.78 -0.37 0.00 0.00 177.43 178.02 1s3s h ASN 91 N -0.12 0.00 -0.05 1.15 -0.26 0.12 0.20 115.58 116.61 1s3s h ASN 91 Ca 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.74 1s3s h ASN 91 Cb 0.82 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.08 1s3s h ASN 91 CO 0.05 0.05 0.00 0.18 -1.06 0.00 0.00 177.43 176.65 1s3s n LEU 92 N -3.48 1.78 -3.94 1.61 4.77 0.42 -4.50 117.00 113.67 1s3s n LEU 92 Ca -0.02 -0.63 -0.25 0.00 -0.03 0.00 0.00 56.01 55.08 1s3s n LEU 92 Cb 0.18 -0.03 -0.01 0.00 -2.33 0.00 0.00 43.42 41.23 1s3s n LEU 92 CO 0.27 0.31 -0.20 0.54 -1.33 0.00 0.00 177.39 176.98 1s3s n ARG 93 N 0.39 -3.51 -4.36 3.23 5.12 0.69 -4.05 116.66 114.17 1s3s n ARG 93 Ca 0.18 0.43 -0.20 0.00 -1.93 0.00 0.00 57.85 56.33 1s3s n ARG 93 Cb 0.39 -4.64 -0.09 0.00 -1.16 0.00 0.00 32.46 26.96 1s3s n ARG 93 CO 0.00 0.00 0.00 0.14 -1.93 0.00 0.00 177.63 175.84 1s3s s VAL 94 N -3.89 0.42 0.40 1.55 -7.23 -0.43 -4.63 120.40 106.60 1s3s s VAL 94 Ca 0.05 -2.00 0.05 0.00 -1.81 0.00 0.00 61.98 58.27 1s3s s VAL 94 Cb -0.03 -2.51 -0.07 0.00 0.56 0.00 0.00 36.38 34.33 1s3s s VAL 94 CO 0.88 0.00 0.02 -0.13 -0.31 0.00 0.00 175.10 175.56 1s3s s ARG 95 N -3.81 1.92 -1.17 4.82 1.81 -1.26 -4.60 118.95 116.66 1s3s s ARG 95 Ca 0.34 -2.10 -0.22 0.00 -1.72 0.00 0.00 55.73 52.03 1s3s s ARG 95 Cb 0.05 -1.42 -0.03 0.00 -0.45 0.00 0.00 34.95 33.10 1s3s s ARG 95 CO 0.17 -0.13 1.85 -0.51 -0.68 0.00 0.00 175.30 176.00 1s3s s LEU 96 N -3.68 3.30 0.00 2.53 1.43 -1.26 -2.51 118.68 118.50 1s3s s LEU 96 Ca 0.31 -1.75 0.00 0.00 -1.03 0.00 0.00 54.13 51.66 1s3s s LEU 96 Cb 0.08 -2.58 0.00 0.00 0.03 0.00 0.00 46.19 43.72 1s3s s LEU 96 CO 0.16 -2.43 0.00 0.61 0.23 0.00 0.00 176.35 174.91 1s3s n GLY 97 N 5.88 0.13 0.79 -3.19 0.00 -0.28 -4.93 105.19 103.59 1s3s n GLY 97 Ca 0.45 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.40 1s3s n GLY 97 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1s3s n ASP 98 N 0.00 -0.59 -4.05 1.61 9.92 -1.04 -4.63 116.55 117.76 1s3s n ASP 98 Ca 0.00 -0.88 -0.16 0.00 -0.53 0.00 0.00 54.79 53.22 1s3s n ASP 98 Cb 0.00 -0.22 -0.13 0.00 -0.64 0.00 0.00 41.12 40.13 1s3s n ASP 98 CO 0.00 0.00 0.00 0.68 0.13 0.00 0.00 177.20 178.01 1s3s s VAL 99 N -1.52 0.66 0.11 2.53 -7.23 -1.26 -0.19 120.40 113.50 1s3s s VAL 99 Ca 0.16 -0.74 0.03 0.00 -1.81 0.00 0.00 61.98 59.61 1s3s s VAL 99 Cb -0.01 -0.63 -0.04 0.00 0.56 0.00 0.00 36.38 36.26 1s3s s VAL 99 CO 0.11 -0.09 -0.08 -0.63 -0.31 0.00 0.00 175.10 174.10 1s3s s ILE 100 N -0.77 0.87 -0.30 -0.62 -1.09 -0.03 -4.85 121.20 114.40 1s3s s ILE 100 Ca -0.02 -1.85 -0.11 0.00 -2.23 0.00 0.00 60.65 56.44 1s3s s ILE 100 Cb -0.07 -1.58 -0.03 0.00 -1.58 0.00 0.00 42.46 39.20 1s3s s ILE 100 CO 0.00 -0.73 0.18 -0.94 -1.23 0.00 0.00 174.94 172.22 1s3s s SER 101 N -2.84 5.79 0.69 3.58 1.04 -1.20 -1.29 113.70 119.47 1s3s s SER 101 Ca 0.10 -0.29 -0.07 0.00 0.48 0.00 0.00 55.95 56.18 1s3s s SER 101 Cb 0.02 -2.07 0.05 0.00 0.10 0.00 0.00 66.02 64.12 1s3s s SER 101 CO -0.02 -0.14 1.01 -0.51 0.98 0.00 0.00 173.24 174.56 1s3s s ILE 102 N 1.69 2.57 -0.30 -1.02 2.07 0.11 -3.28 121.20 123.04 1s3s s ILE 102 Ca 0.06 -0.16 -0.17 0.00 -1.41 0.00 0.00 60.65 58.97 1s3s s ILE 102 Cb -0.17 -3.11 0.19 0.00 0.13 0.00 0.00 42.46 39.51 1s3s s ILE 102 CO 0.09 -0.12 1.21 -1.58 -1.91 0.00 0.00 174.94 172.63 1s3s s GLN 103 N -5.23 0.11 0.44 3.50 0.74 -0.41 -4.80 119.66 114.01 1s3s s GLN 103 Ca 0.59 0.21 -0.25 0.00 0.05 0.00 0.00 55.36 55.95 1s3s s GLN 103 Cb -0.11 0.06 -0.08 0.00 1.10 0.00 0.00 33.01 33.98 1s3s s GLN 103 CO 0.45 -0.03 1.38 -1.25 -0.55 0.00 0.00 175.29 175.29 1s3s s PRO 104 N 1.48 3.76 -0.46 1.67 0.04 -1.26 0.68 135.00 140.91 1s3s s PRO 104 Ca -0.05 2.31 0.07 0.00 0.04 0.00 0.00 61.00 63.37 1s3s s PRO 104 Cb -0.02 -2.67 0.24 0.00 0.04 0.00 0.00 34.50 32.09 1s3s s PRO 104 CO -0.13 -0.72 0.56 0.00 0.04 0.00 0.00 177.00 176.75 1s3s n PRO 106 N 1.43 0.37 -3.30 0.00 -0.04 -1.26 -4.03 135.00 128.18 1s3s n PRO 106 Ca 0.24 0.06 -0.32 0.00 -0.04 0.00 0.00 63.50 63.44 1s3s n PRO 106 Cb 0.49 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.40 1s3s n PRO 106 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1s3s n ASP 107 N -1.26 4.57 -3.84 3.54 2.03 -1.26 -4.93 116.55 115.41 1s3s n ASP 107 Ca 0.12 -3.44 -0.21 0.00 0.52 0.00 0.00 54.79 51.78 1s3s n ASP 107 Cb 0.17 -0.85 -0.17 0.00 -0.72 0.00 0.00 41.12 39.55 1s3s n ASP 107 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1s3s s VAL 108 N -2.57 0.44 0.10 5.18 1.01 -1.26 -5.10 120.40 118.20 1s3s s VAL 108 Ca 0.37 -0.00 0.09 0.00 0.00 0.00 0.00 61.98 62.44 1s3s s VAL 108 Cb 0.12 -0.52 -0.03 0.00 0.00 0.00 0.00 36.38 35.94 1s3s s VAL 108 CO 0.02 0.23 -0.23 -1.59 0.00 0.00 0.00 175.10 173.53 1s3s s LYS 109 N 1.35 1.31 -0.35 2.72 -2.85 -1.26 -4.83 119.74 115.82 1s3s s LYS 109 Ca -0.04 -1.18 -0.31 0.00 -1.00 0.00 0.00 55.97 53.43 1s3s s LYS 109 Cb -0.13 -1.61 -0.14 0.00 -2.06 0.00 0.00 37.83 33.89 1s3s s LYS 109 CO -0.02 0.39 1.47 0.66 0.10 0.00 0.00 175.35 177.95 1s3s n TYR 110 N 1.22 0.87 -1.37 1.78 4.02 -1.26 -3.70 117.16 118.72 1s3s n TYR 110 Ca -0.18 0.58 -0.36 0.00 -0.01 0.00 0.00 57.90 57.93 1s3s n TYR 110 Cb 0.53 -1.62 0.09 0.00 -0.02 0.00 0.00 39.34 38.32 1s3s n TYR 110 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1s3s n GLY 111 N 5.03 -0.25 0.11 2.72 0.00 0.22 -4.84 105.19 108.17 1s3s n GLY 111 Ca 0.37 -0.33 -0.18 0.00 0.00 0.00 0.00 46.02 45.87 1s3s n GLY 111 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1s3s n LYS 112 N -2.06 0.54 -4.26 1.61 4.81 -1.26 -4.46 118.16 113.08 1s3s n LYS 112 Ca 0.13 0.41 -0.18 0.00 -0.87 0.00 0.00 58.31 57.80 1s3s n LYS 112 Cb 0.49 -1.60 -0.11 0.00 0.02 0.00 0.00 35.03 33.83 1s3s n LYS 112 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 1s3s s ARG 113 N -2.48 1.09 -0.03 1.64 0.52 -1.26 -1.69 118.95 116.73 1s3s s ARG 113 Ca -0.29 -1.31 -0.03 0.00 -0.52 0.00 0.00 55.73 53.58 1s3s s ARG 113 Cb 0.07 -0.97 0.01 0.00 0.52 0.00 0.00 34.95 34.58 1s3s s ARG 113 CO 0.45 0.18 0.09 0.42 0.02 0.00 0.00 175.30 176.47 1s3s s ILE 114 N -2.27 0.01 -0.29 1.52 -1.09 -0.20 -1.29 121.20 117.59 1s3s s ILE 114 Ca 0.12 -0.06 -0.03 0.00 -2.23 0.00 0.00 60.65 58.45 1s3s s ILE 114 Cb -0.04 -0.16 0.10 0.00 -1.58 0.00 0.00 42.46 40.77 1s3s s ILE 114 CO 0.04 -0.04 0.11 -2.28 -1.23 0.00 0.00 174.94 171.54 1s3s s HIS 115 N -0.07 0.95 0.22 3.97 2.46 -0.60 0.18 115.29 122.40 1s3s s HIS 115 Ca -0.01 -1.23 0.08 0.00 0.47 0.00 0.00 55.06 54.37 1s3s s HIS 115 Cb -0.01 -1.25 -0.04 0.00 -0.13 0.00 0.00 32.58 31.14 1s3s s HIS 115 CO 0.00 -0.83 -0.01 0.14 -2.47 0.00 0.00 174.74 171.57 1s3s s VAL 116 N 1.88 3.56 0.01 0.89 -7.23 -1.11 -0.84 120.40 117.56 1s3s s VAL 116 Ca 0.09 -1.67 0.01 0.00 -1.81 0.00 0.00 61.98 58.60 1s3s s VAL 116 Cb -0.17 -2.84 -0.01 0.00 0.56 0.00 0.00 36.38 33.92 1s3s s VAL 116 CO -0.30 -0.23 -0.04 -0.76 -0.31 0.00 0.00 175.10 173.46 1s3s s LEU 117 N -3.28 2.12 0.49 1.32 1.43 -0.88 -4.54 118.68 115.34 1s3s s LEU 117 Ca 0.29 -0.27 -0.22 0.00 -1.03 0.00 0.00 54.13 52.90 1s3s s LEU 117 Cb -0.08 -0.09 -0.06 0.00 0.03 0.00 0.00 46.19 45.98 1s3s s LEU 117 CO 0.19 -0.10 1.24 -2.84 0.23 0.00 0.00 176.35 175.07 1s3s s PRO 118 N -0.73 3.53 -0.70 1.29 0.02 -1.26 -1.96 135.00 135.19 1s3s s PRO 118 Ca -0.05 1.94 -0.19 0.00 0.02 0.00 0.00 61.00 62.72 1s3s s PRO 118 Cb -0.05 -2.35 0.11 0.00 0.02 0.00 0.00 34.50 32.23 1s3s s PRO 118 CO -0.00 -0.79 0.86 0.42 -0.33 0.00 0.00 177.00 177.16 1s3s s ILE 119 N -1.46 4.76 0.00 2.83 1.01 -0.49 0.24 121.20 128.09 1s3s s ILE 119 Ca 0.66 -1.12 0.00 0.00 0.00 0.00 0.00 60.65 60.20 1s3s s ILE 119 Cb -0.33 -4.59 0.00 0.00 0.01 0.00 0.00 42.46 37.55 1s3s s ILE 119 CO 0.39 -1.27 0.00 -0.90 0.00 0.00 0.00 174.94 173.16 1s3s n ASP 120 N 6.47 0.00 0.32 3.58 5.68 -1.18 0.24 116.55 131.66 1s3s n ASP 120 Ca 0.01 0.00 0.21 0.00 -0.50 0.00 0.00 54.79 54.51 1s3s n ASP 120 Cb 0.45 0.00 1.09 0.00 -1.14 0.00 0.00 41.12 41.52 1s3s n ASP 120 CO 0.00 0.00 0.00 -2.24 -1.33 0.00 0.00 177.20 173.63 1s3s h ASP 121 N 0.00 0.00 0.50 -1.12 3.04 -1.92 -1.99 116.42 114.93 1s3s h ASP 121 Ca 0.00 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.79 1s3s h ASP 121 Cb 0.00 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.29 1s3s h ASP 121 CO 0.00 0.01 -0.97 0.35 -2.04 0.00 0.00 179.24 176.59 1s3s n THR 122 N -3.19 0.20 0.06 1.15 -2.24 0.66 -4.18 114.28 106.74 1s3s n THR 122 Ca -0.02 -0.25 0.04 0.00 -2.27 0.00 0.00 64.05 61.54 1s3s n THR 122 Cb 0.12 0.15 0.07 0.00 -2.10 0.00 0.00 70.33 68.57 1s3s n THR 122 CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83 1s3s n VAL 123 N -1.99 0.59 -1.88 2.28 0.24 -0.80 -4.62 118.33 112.15 1s3s n VAL 123 Ca 0.02 -0.80 -0.41 0.00 -2.04 0.00 0.00 64.34 61.12 1s3s n VAL 123 Cb 0.44 0.77 -0.01 0.00 -1.47 0.00 0.00 33.84 33.57 1s3s n VAL 123 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 1s3s s GLU 124 N -0.84 4.15 0.00 7.34 2.02 -0.87 -2.63 118.70 127.86 1s3s s GLU 124 Ca 0.13 2.49 0.00 0.00 0.02 0.00 0.00 54.97 57.60 1s3s s GLU 124 Cb 0.07 -2.98 0.00 0.00 0.10 0.00 0.00 34.13 31.32 1s3s s GLU 124 CO 0.10 -0.46 0.00 0.41 0.02 0.00 0.00 175.26 175.33 1s3s n GLY 125 N 0.54 2.67 3.86 -1.39 0.00 -1.26 -5.02 105.19 104.59 1s3s n GLY 125 Ca 0.01 -0.15 -0.36 0.00 0.00 0.00 0.00 46.02 45.52 1s3s n GLY 125 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1s3s s ILE 126 N -1.51 5.21 0.04 -0.61 -4.36 -1.08 -4.09 121.20 114.79 1s3s s ILE 126 Ca 0.00 0.44 0.04 0.00 -0.26 0.00 0.00 60.65 60.88 1s3s s ILE 126 Cb 0.00 -3.60 -0.02 0.00 1.25 0.00 0.00 42.46 40.09 1s3s s ILE 126 CO 0.00 0.46 -0.13 -0.89 0.24 0.00 0.00 174.94 174.63 1s3s s THR 127 N -1.20 0.98 0.00 8.37 2.01 -0.98 -4.93 115.64 119.88 1s3s s THR 127 Ca 0.25 -0.94 0.00 0.00 0.31 0.00 0.00 61.69 61.31 1s3s s THR 127 Cb -0.14 -0.90 0.00 0.00 0.01 0.00 0.00 72.50 71.47 1s3s s THR 127 CO 0.13 -0.04 0.00 0.61 -0.69 0.00 0.00 174.62 174.64 1s3s n GLY 128 N 1.93 3.30 3.58 4.40 0.00 -1.26 0.16 105.19 117.31 1s3s n GLY 128 Ca -0.18 -1.88 -0.48 0.00 0.00 0.00 0.00 46.02 43.48 1s3s n GLY 128 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1s3s n ASN 129 N 0.00 2.99 0.22 1.61 4.05 -1.26 -4.80 115.26 118.07 1s3s n ASN 129 Ca 0.00 0.58 0.12 0.00 0.45 0.00 0.00 54.58 55.74 1s3s n ASN 129 Cb 0.00 -1.39 0.22 0.00 1.23 0.00 0.00 39.78 39.85 1s3s n ASN 129 CO 0.00 0.00 0.00 -0.07 -3.05 0.00 0.00 177.26 174.14 1s3s h LEU 130 N 11.86 0.00 0.32 1.20 3.38 -1.98 -3.32 115.31 126.76 1s3s h LEU 130 Ca -0.40 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.56 1s3s h LEU 130 Cb 1.28 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.03 1s3s h LEU 130 CO 0.97 0.00 -0.15 0.15 0.09 0.00 0.00 178.44 179.50 1s3s h PHE 131 N 0.00 -0.39 -0.28 1.13 3.57 -1.95 0.52 116.94 119.54 1s3s h PHE 131 Ca 0.00 -0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.56 1s3s h PHE 131 Cb 0.95 0.13 -0.01 0.00 2.79 0.00 0.00 35.95 39.80 1s3s h PHE 131 CO 0.00 -0.24 0.20 0.93 -2.23 0.00 0.00 178.31 176.96 1s3s h GLU 132 N -0.52 0.04 0.13 1.11 4.39 -1.97 0.16 114.58 117.91 1s3s h GLU 132 Ca -0.04 -0.00 -0.33 0.00 0.34 0.00 0.00 59.36 59.32 1s3s h GLU 132 Cb 0.32 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.96 1s3s h GLU 132 CO 0.07 0.02 -1.75 0.28 -1.16 0.00 0.00 179.01 176.47 1s3s h VAL 133 N 0.04 0.90 0.00 3.13 2.07 -1.65 -3.39 116.25 117.35 1s3s h VAL 133 Ca 0.13 -2.57 0.00 0.00 0.82 0.00 0.00 66.70 65.08 1s3s h VAL 133 Cb 0.47 2.65 0.00 0.00 -1.52 0.00 0.00 31.29 32.89 1s3s h VAL 133 CO -0.01 0.82 -0.02 -1.22 0.02 0.00 0.00 177.57 177.16 1s3s n TYR 134 N -3.46 0.00 -0.00 1.57 4.01 0.18 -4.65 117.16 114.81 1s3s n TYR 134 Ca -0.23 0.00 -0.13 0.00 -0.16 0.00 0.00 57.90 57.37 1s3s n TYR 134 Cb 1.06 -0.01 -0.07 0.00 -0.31 0.00 0.00 39.34 40.00 1s3s n TYR 134 CO 0.00 0.00 0.00 -0.07 -0.46 0.00 0.00 176.86 176.33 1s3s h LEU 135 N -0.02 -1.46 -0.25 7.72 -0.00 -1.36 -1.94 115.31 117.99 1s3s h LEU 135 Ca 0.00 0.19 0.03 0.00 -0.00 0.00 0.00 57.88 58.10 1s3s h LEU 135 Cb 0.02 0.59 -0.05 0.00 -0.00 0.00 0.00 40.66 41.22 1s3s h LEU 135 CO 0.00 -0.45 -0.34 0.50 -0.00 0.00 0.00 178.44 178.15 1s3s h LYS 136 N -0.53 -0.23 0.00 1.13 1.63 -0.95 -0.03 116.57 117.59 1s3s h LYS 136 Ca 0.06 0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.88 1s3s h LYS 136 Cb 0.65 0.05 0.00 0.00 -0.60 0.00 0.00 32.23 32.33 1s3s h LYS 136 CO -0.41 -0.15 0.00 -0.35 -3.45 0.00 0.00 179.45 175.08 1s3s n PRO 137 N -4.32 0.04 -0.01 1.90 -0.04 -1.19 -1.75 135.00 129.64 1s3s n PRO 137 Ca -0.02 0.37 -0.17 0.00 -0.04 0.00 0.00 63.50 63.64 1s3s n PRO 137 Cb 0.21 -1.60 -0.14 0.00 -0.04 0.00 0.00 33.50 31.93 1s3s n PRO 137 CO 0.00 0.00 0.00 -0.92 -0.04 0.00 0.00 175.50 174.54 1s3s h TYR 138 N 0.00 0.26 0.07 0.54 3.20 -0.20 -3.38 116.97 117.45 1s3s h TYR 138 Ca 0.00 -0.18 -0.32 0.00 3.14 0.00 0.00 58.73 61.36 1s3s h TYR 138 Cb 0.19 -0.01 -0.03 0.00 1.54 0.00 0.00 36.73 38.42 1s3s h TYR 138 CO 0.00 1.13 -1.78 0.74 -1.64 0.00 0.00 178.16 176.61 1s3s h PHE 139 N -0.69 0.27 0.00 -3.82 0.04 -1.38 -3.46 116.94 107.89 1s3s h PHE 139 Ca -0.06 -0.19 -0.00 0.00 2.80 0.00 0.00 57.97 60.51 1s3s h PHE 139 Cb 1.28 -0.01 -0.00 0.00 2.20 0.00 0.00 35.95 39.42 1s3s h PHE 139 CO 0.24 1.37 0.00 -0.11 -0.60 0.00 0.00 178.31 179.21 1s3s n LEU 140 N -3.29 0.00 -4.07 1.54 7.94 -0.72 0.12 117.00 118.53 1s3s n LEU 140 Ca -0.22 0.00 -0.33 0.00 -1.11 0.00 0.00 56.01 54.35 1s3s n LEU 140 Cb 1.05 -0.00 -0.00 0.00 0.53 0.00 0.00 43.42 44.99 1s3s n LEU 140 CO 0.45 -0.00 0.02 -0.62 -1.11 0.00 0.00 177.39 176.13 1s3s n GLU 141 N 0.00 -4.18 -0.05 1.96 -0.58 -1.26 -4.82 120.64 111.72 1s3s n GLU 141 Ca 0.00 0.47 -0.06 0.00 -0.42 0.00 0.00 57.16 57.15 1s3s n GLU 141 Cb -0.00 -5.23 -0.04 0.00 -0.57 0.00 0.00 31.44 25.60 1s3s n GLU 141 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1s3s n ALA 142 N -4.51 1.82 -3.29 0.62 0.00 0.34 -5.03 120.51 110.45 1s3s n ALA 142 Ca 0.03 -0.39 -0.16 0.00 0.00 0.00 0.00 53.44 52.93 1s3s n ALA 142 Cb 0.52 0.29 0.08 0.00 0.00 0.00 0.00 19.45 20.34 1s3s n ALA 142 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1s3s n TYR 143 N -2.78 -2.02 -2.24 0.00 4.02 -1.23 -4.92 117.16 107.97 1s3s n TYR 143 Ca -0.16 0.84 -0.42 0.00 -0.01 0.00 0.00 57.90 58.15 1s3s n TYR 143 Cb 0.67 -4.70 -0.03 0.00 -0.02 0.00 0.00 39.34 35.26 1s3s n TYR 143 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 176.86 176.88 1s3s s ARG 144 N -5.34 4.26 0.09 -0.72 0.52 -1.26 -4.61 118.95 111.89 1s3s s ARG 144 Ca 0.08 1.92 -0.31 0.00 -0.52 0.00 0.00 55.73 56.90 1s3s s ARG 144 Cb -0.03 -3.67 -0.07 0.00 0.52 0.00 0.00 34.95 31.69 1s3s s ARG 144 CO 0.64 -0.63 1.31 -1.25 0.02 0.00 0.00 175.30 175.39 1s3s s PRO 145 N 2.85 4.37 -0.02 3.54 0.04 -1.26 -2.86 135.00 141.66 1s3s s PRO 145 Ca 0.63 1.94 0.01 0.00 0.04 0.00 0.00 61.00 63.62 1s3s s PRO 145 Cb -0.29 -3.29 0.01 0.00 0.04 0.00 0.00 34.50 30.97 1s3s s PRO 145 CO 0.24 -0.36 -0.01 0.96 0.04 0.00 0.00 177.00 177.87 1s3s s ILE 146 N 1.08 0.20 0.20 0.56 -4.36 -1.10 -4.67 121.20 113.12 1s3s s ILE 146 Ca 0.62 -0.02 0.05 0.00 -0.26 0.00 0.00 60.65 61.05 1s3s s ILE 146 Cb -0.34 -0.23 -0.04 0.00 1.25 0.00 0.00 42.46 43.11 1s3s s ILE 146 CO 0.30 0.10 0.22 -0.60 0.24 0.00 0.00 174.94 175.20 1s3s s ARG 147 N 0.48 3.08 0.51 0.37 3.00 -1.26 -2.10 118.95 123.03 1s3s s ARG 147 Ca -0.05 -0.87 -0.21 0.00 -1.00 0.00 0.00 55.73 53.60 1s3s s ARG 147 Cb -0.07 -2.71 -0.06 0.00 0.00 0.00 0.00 34.95 32.10 1s3s s ARG 147 CO -0.01 0.45 1.18 0.21 0.00 0.00 0.00 175.30 177.13 1s3s s LYS 148 N -3.52 3.48 0.00 5.12 2.20 -0.66 -3.09 119.74 123.28 1s3s s LYS 148 Ca 0.33 1.77 0.00 0.00 -0.36 0.00 0.00 55.97 57.71 1s3s s LYS 148 Cb -0.09 -2.21 0.00 0.00 -1.51 0.00 0.00 37.83 34.02 1s3s s LYS 148 CO 0.26 -0.78 0.00 0.41 -0.36 0.00 0.00 175.35 174.87 1s3s n GLY 149 N 0.39 2.97 3.69 5.54 0.00 0.78 -5.01 105.19 113.55 1s3s n GLY 149 Ca 0.10 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.81 1s3s n GLY 149 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1s3s s ASP 150 N -1.39 3.19 -0.09 1.61 1.11 -1.18 -4.67 116.67 115.26 1s3s s ASP 150 Ca 0.00 2.01 -0.00 0.00 0.18 0.00 0.00 52.55 54.73 1s3s s ASP 150 Cb 0.00 -2.51 0.02 0.00 1.07 0.00 0.00 42.92 41.50 1s3s s ASP 150 CO 0.00 -2.90 -0.05 -0.63 1.18 0.00 0.00 175.17 172.77 1s3s s ILE 151 N -2.72 0.74 0.32 0.77 1.01 -1.26 -0.70 121.20 119.37 1s3s s ILE 151 Ca 0.65 -0.13 0.10 0.00 0.00 0.00 0.00 60.65 61.27 1s3s s ILE 151 Cb -0.21 -0.80 -0.06 0.00 0.01 0.00 0.00 42.46 41.40 1s3s s ILE 151 CO 0.58 0.31 -0.09 0.72 0.00 0.00 0.00 174.94 176.46 1s3s s PHE 152 N 1.65 2.43 -0.01 3.97 -0.12 -0.18 -4.86 117.98 120.85 1s3s s PHE 152 Ca 0.02 -0.42 0.05 0.00 -0.05 0.00 0.00 56.93 56.52 1s3s s PHE 152 Cb -0.13 -1.30 -0.03 0.00 -0.63 0.00 0.00 43.02 40.93 1s3s s PHE 152 CO -0.05 0.59 -0.14 -1.17 -0.05 0.00 0.00 175.22 174.40 1s3s s LEU 153 N -3.62 2.77 -0.05 -1.99 2.96 -1.26 -1.38 118.68 116.10 1s3s s LEU 153 Ca 0.32 -0.26 0.00 0.00 -0.22 0.00 0.00 54.13 53.97 1s3s s LEU 153 Cb -0.01 -1.59 0.02 0.00 0.50 0.00 0.00 46.19 45.12 1s3s s LEU 153 CO 0.17 0.31 -0.02 -0.69 -1.32 0.00 0.00 176.35 174.79 1s3s s VAL 154 N -0.84 0.45 -0.16 1.68 1.01 -0.18 -4.99 120.40 117.37 1s3s s VAL 154 Ca 0.13 -0.01 -0.06 0.00 0.00 0.00 0.00 61.98 62.04 1s3s s VAL 154 Cb -0.11 -0.53 -0.04 0.00 0.00 0.00 0.00 36.38 35.71 1s3s s VAL 154 CO 0.03 0.23 0.06 -0.13 0.00 0.00 0.00 175.10 175.30 1s3s s ARG 155 N 1.32 3.73 0.00 2.72 0.52 -1.26 -0.57 118.95 125.41 1s3s s ARG 155 Ca -0.05 -0.32 0.00 0.00 -0.52 0.00 0.00 55.73 54.84 1s3s s ARG 155 Cb -0.13 -3.14 0.00 0.00 0.52 0.00 0.00 34.95 32.20 1s3s s ARG 155 CO -0.02 0.43 0.00 0.41 0.02 0.00 0.00 175.30 176.13 1s3s n GLY 156 N 3.06 1.04 2.41 -3.53 0.00 0.07 -4.94 105.19 103.31 1s3s n GLY 156 Ca -0.17 -1.04 -0.18 0.00 0.00 0.00 0.00 46.02 44.63 1s3s n GLY 156 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1s3s n GLY 157 N -0.65 -0.32 3.49 -0.02 0.00 -1.26 -2.27 105.19 104.18 1s3s n GLY 157 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.81 1s3s n GLY 157 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1s3s n MET 158 N -2.87 -3.39 -3.30 1.61 0.00 -0.29 -4.81 117.12 104.07 1s3s n MET 158 Ca -0.21 0.71 0.00 0.00 0.00 0.00 0.00 57.70 58.20 1s3s n MET 158 Cb 0.65 -5.28 0.00 0.00 0.00 0.00 0.00 33.22 28.59 1s3s n MET 158 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 175.97 178.86 1s3s n ARG 159 N -3.85 -3.13 -3.92 0.03 1.85 -0.96 -4.98 116.66 101.70 1s3s n ARG 159 Ca -0.17 0.00 -0.18 0.00 -1.00 0.00 0.00 57.85 56.50 1s3s n ARG 159 Cb 0.64 0.00 -0.16 0.00 -1.05 0.00 0.00 32.46 31.88 1s3s n ARG 159 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1s3s s ALA 160 N -1.92 0.40 0.09 2.89 0.00 -1.26 -0.75 121.76 121.22 1s3s s ALA 160 Ca 0.00 0.11 0.03 0.00 0.00 0.00 0.00 51.96 52.10 1s3s s ALA 160 Cb 0.00 -0.40 -0.04 0.00 0.00 0.00 0.00 23.12 22.68 1s3s s ALA 160 CO 0.00 -0.14 0.10 0.08 0.00 0.00 0.00 175.76 175.81 1s3s s VAL 161 N 1.19 4.62 -0.12 0.00 1.01 0.26 -4.92 120.40 122.45 1s3s s VAL 161 Ca -0.07 -0.79 0.01 0.00 0.00 0.00 0.00 61.98 61.13 1s3s s VAL 161 Cb -0.13 -3.25 -0.01 0.00 0.00 0.00 0.00 36.38 32.98 1s3s s VAL 161 CO -0.02 0.08 -0.15 -1.61 0.00 0.00 0.00 175.10 173.40 1s3s s GLU 162 N -2.54 3.29 0.21 2.72 2.02 -1.26 -1.01 118.70 122.13 1s3s s GLU 162 Ca 0.30 -0.73 0.11 0.00 0.02 0.00 0.00 54.97 54.67 1s3s s GLU 162 Cb -0.12 -2.55 -0.04 0.00 0.10 0.00 0.00 34.13 31.51 1s3s s GLU 162 CO 0.23 0.22 -0.18 -0.06 0.02 0.00 0.00 175.26 175.49 1s3s s PHE 163 N 0.32 2.42 -0.07 1.61 0.08 -0.48 -1.40 117.98 120.46 1s3s s PHE 163 Ca -0.12 -0.31 0.02 0.00 0.12 0.00 0.00 56.93 56.64 1s3s s PHE 163 Cb -0.16 -1.16 0.01 0.00 -0.57 0.00 0.00 43.02 41.15 1s3s s PHE 163 CO 0.06 0.55 -0.12 0.21 -0.10 0.00 0.00 175.22 175.83 1s3s s LYS 164 N -2.95 1.71 -0.65 0.44 2.20 -0.83 -1.01 119.74 118.66 1s3s s LYS 164 Ca 0.24 -0.40 -0.27 0.00 -0.36 0.00 0.00 55.97 55.18 1s3s s LYS 164 Cb -0.07 -1.45 -0.00 0.00 -1.51 0.00 0.00 37.83 34.80 1s3s s LYS 164 CO 0.13 -0.01 1.62 0.08 -0.36 0.00 0.00 175.35 176.81 1s3s s VAL 165 N 0.79 3.52 0.11 4.02 1.01 0.13 -2.07 120.40 127.91 1s3s s VAL 165 Ca -0.12 0.31 -0.12 0.00 0.00 0.00 0.00 61.98 62.05 1s3s s VAL 165 Cb -0.15 -4.33 -0.15 0.00 0.00 0.00 0.00 36.38 31.75 1s3s s VAL 165 CO 0.02 -1.27 1.33 0.58 0.00 0.00 0.00 175.10 175.76 1s3s h VAL 166 N 6.54 1.28 -2.04 2.92 2.07 -1.31 0.22 116.25 125.93 1s3s h VAL 166 Ca -0.27 -1.95 -0.03 0.00 0.82 0.00 0.00 66.70 65.28 1s3s h VAL 166 Cb 1.12 1.94 -0.21 0.00 -1.52 0.00 0.00 31.29 32.61 1s3s h VAL 166 CO 1.24 0.62 0.08 -0.70 0.02 0.00 0.00 177.57 178.83 1s3s s GLU 167 N -3.80 0.79 -0.12 1.57 2.56 -1.01 -4.69 118.70 114.01 1s3s s GLU 167 Ca -0.10 1.03 0.03 0.00 0.00 0.00 0.00 54.97 55.93 1s3s s GLU 167 Cb 0.09 0.33 0.00 0.00 2.00 0.00 0.00 34.13 36.55 1s3s s GLU 167 CO 0.90 -0.11 -0.21 0.95 -0.56 0.00 0.00 175.26 176.23 1s3s s THR 168 N 0.68 2.23 0.06 -1.70 -4.23 -1.26 -1.56 115.64 109.86 1s3s s THR 168 Ca -0.02 -0.94 -0.17 0.00 -1.18 0.00 0.00 61.69 59.37 1s3s s THR 168 Cb -0.05 -1.88 -0.06 0.00 1.34 0.00 0.00 72.50 71.84 1s3s s THR 168 CO -0.04 0.55 1.28 -0.78 -0.54 0.00 0.00 174.62 175.09 1s3s h ASP 169 N 6.95 -0.90 -0.60 3.99 1.82 -1.58 -2.52 116.42 123.57 1s3s h ASP 169 Ca -0.25 0.11 -0.60 0.00 -0.39 0.00 0.00 57.03 55.89 1s3s h ASP 169 Cb 1.22 0.36 -0.06 0.00 0.68 0.00 0.00 39.33 41.53 1s3s h ASP 169 CO 0.51 -0.24 2.09 -2.65 -1.61 0.00 0.00 179.24 177.34 1s3s n PRO 170 N -4.04 2.70 -1.64 0.28 -0.02 -1.26 -4.94 135.00 126.08 1s3s n PRO 170 Ca -0.03 -2.92 -0.39 0.00 -2.02 0.00 0.00 63.50 58.13 1s3s n PRO 170 Cb 0.19 -3.49 0.03 0.00 -0.02 0.00 0.00 33.50 30.21 1s3s n PRO 170 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1s3s n SER 171 N 9.37 1.35 -0.04 2.55 7.64 -0.95 -3.48 113.62 130.05 1s3s n SER 171 Ca 0.49 0.94 -0.04 0.00 1.01 0.00 0.00 58.87 61.27 1s3s n SER 171 Cb 0.45 -1.41 -0.14 0.00 -1.01 0.00 0.00 64.21 62.10 1s3s n SER 171 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 1s3s n PRO 172 N -0.44 0.66 -4.18 1.43 -0.04 -1.26 -5.00 135.00 126.16 1s3s n PRO 172 Ca 0.11 0.06 -0.26 0.00 -0.04 0.00 0.00 63.50 63.37 1s3s n PRO 172 Cb 0.43 -1.63 -0.07 0.00 -0.04 0.00 0.00 33.50 32.19 1s3s n PRO 172 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 1s3s s TYR 173 N -2.77 2.91 -0.29 0.54 1.13 -1.23 -1.66 117.35 115.99 1s3s s TYR 173 Ca -0.07 -0.12 -0.26 0.00 -1.41 0.00 0.00 57.07 55.21 1s3s s TYR 173 Cb 0.08 -1.39 0.18 0.00 -1.10 0.00 0.00 41.96 39.73 1s3s s TYR 173 CO 0.84 0.53 1.35 0.00 -2.51 0.00 0.00 175.55 175.76 1s3s s ILE 175 N -0.09 3.86 -0.53 0.00 1.01 -1.24 -2.72 121.20 121.48 1s3s s ILE 175 Ca 0.07 1.55 -0.19 0.00 0.00 0.00 0.00 60.65 62.07 1s3s s ILE 175 Cb -0.04 -3.86 0.07 0.00 0.01 0.00 0.00 42.46 38.64 1s3s s ILE 175 CO -0.13 0.13 0.63 -0.69 0.00 0.00 0.00 174.94 174.88 1s3s s VAL 176 N -1.54 4.89 0.59 2.92 1.01 -1.13 0.71 120.40 127.85 1s3s s VAL 176 Ca 0.52 -0.69 -0.01 0.00 0.00 0.00 0.00 61.98 61.80 1s3s s VAL 176 Cb -0.23 -4.34 0.04 0.00 0.00 0.00 0.00 36.38 31.85 1s3s s VAL 176 CO 0.29 -0.88 0.84 0.00 0.00 0.00 0.00 175.10 175.35 1s3s s ALA 177 N 2.55 3.69 0.61 5.51 0.00 -1.26 -3.68 121.76 129.17 1s3s s ALA 177 Ca 0.13 -1.21 0.32 0.00 0.00 0.00 0.00 51.96 51.20 1s3s s ALA 177 Cb -0.21 -2.23 1.84 0.00 0.00 0.00 0.00 23.12 22.52 1s3s s ALA 177 CO 0.10 -0.90 2.17 -1.00 0.00 0.00 0.00 175.76 176.12 1s3s h PRO 178 N -0.12 0.00 -0.31 0.00 0.13 -1.96 -0.79 132.00 128.95 1s3s h PRO 178 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 1s3s h PRO 178 Cb 1.30 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.43 1s3s h PRO 178 CO 0.54 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.06 1s3s n ASP 179 N -3.59 2.41 -4.69 1.44 8.00 -1.26 -4.90 116.55 113.96 1s3s n ASP 179 Ca -0.01 -1.87 -0.42 0.00 0.71 0.00 0.00 54.79 53.20 1s3s n ASP 179 Cb 0.23 -0.20 -0.03 0.00 -0.02 0.00 0.00 41.12 41.10 1s3s n ASP 179 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1s3s s THR 180 N -1.60 4.44 -0.44 -3.53 2.01 -0.30 -4.96 115.64 111.26 1s3s s THR 180 Ca 0.34 1.75 -0.29 0.00 0.31 0.00 0.00 61.69 63.80 1s3s s THR 180 Cb 0.19 -4.12 0.03 0.00 0.01 0.00 0.00 72.50 68.60 1s3s s THR 180 CO 0.27 0.01 1.11 -0.69 -0.69 0.00 0.00 174.62 174.63 1s3s s VAL 181 N 2.02 4.30 -0.47 3.82 1.01 -0.69 -4.94 120.40 125.45 1s3s s VAL 181 Ca 0.53 1.31 -0.22 0.00 0.00 0.00 0.00 61.98 63.60 1s3s s VAL 181 Cb -0.23 -4.55 0.03 0.00 0.00 0.00 0.00 36.38 31.64 1s3s s VAL 181 CO 0.21 -0.87 0.75 -0.63 0.00 0.00 0.00 175.10 174.56 1s3s s ILE 182 N 4.22 4.68 -0.04 2.22 1.01 -1.26 -1.04 121.20 130.99 1s3s s ILE 182 Ca 0.46 0.18 -0.15 0.00 0.00 0.00 0.00 60.65 61.14 1s3s s ILE 182 Cb -0.08 -4.33 -0.05 0.00 0.01 0.00 0.00 42.46 38.01 1s3s s ILE 182 CO 0.28 -0.77 0.39 -2.28 0.00 0.00 0.00 174.94 172.55 1s3s s HIS 183 N 3.18 3.67 -0.39 3.97 2.46 0.48 -4.96 115.29 123.70 1s3s s HIS 183 Ca 0.26 0.91 0.03 0.00 0.47 0.00 0.00 55.06 56.73 1s3s s HIS 183 Cb -0.14 -2.31 0.16 0.00 -0.13 0.00 0.00 32.58 30.16 1s3s s HIS 183 CO 0.19 0.55 0.30 0.00 -2.47 0.00 0.00 174.74 173.31 1s3s h GLU 185 N 6.09 0.45 -1.43 0.00 3.07 -1.97 -3.47 114.58 117.33 1s3s h GLU 185 Ca 0.20 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 59.03 1s3s h GLU 185 Cb 0.93 -0.10 0.00 0.00 -0.84 0.00 0.00 28.75 28.74 1s3s h GLU 185 CO 0.33 0.30 0.00 0.41 -1.40 0.00 0.00 179.01 178.65 1s3s n GLY 186 N -1.33 0.54 2.79 -3.84 0.00 -1.26 -5.09 105.19 96.99 1s3s n GLY 186 Ca 0.22 -0.52 -0.08 0.00 0.00 0.00 0.00 46.02 45.64 1s3s n GLY 186 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1s3s s GLU 187 N -2.48 0.96 0.01 1.61 2.56 -1.26 -5.13 118.70 114.97 1s3s s GLU 187 Ca 0.00 -1.05 -0.19 0.00 0.00 0.00 0.00 54.97 53.73 1s3s s GLU 187 Cb 0.00 -0.29 -0.10 0.00 2.00 0.00 0.00 34.13 35.74 1s3s s GLU 187 CO 0.00 -1.30 0.50 -2.30 -0.56 0.00 0.00 175.26 171.60 1s3s n PRO 188 N 3.33 0.00 -4.07 4.30 -0.02 -1.26 -4.78 135.00 132.50 1s3s n PRO 188 Ca 0.18 0.00 -0.34 0.00 -2.02 0.00 0.00 63.50 61.32 1s3s n PRO 188 Cb 0.54 -0.70 -0.07 0.00 -0.02 0.00 0.00 33.50 33.25 1s3s n PRO 188 CO 0.00 0.00 0.00 0.96 1.98 0.00 0.00 175.50 178.44 1s3s s ILE 189 N -0.04 4.88 0.39 4.25 -4.36 0.14 -4.73 121.20 121.73 1s3s s ILE 189 Ca 0.43 -0.29 -0.25 0.00 -0.26 0.00 0.00 60.65 60.28 1s3s s ILE 189 Cb -0.60 -3.21 -0.09 0.00 1.25 0.00 0.00 42.46 39.81 1s3s s ILE 189 CO 0.27 0.40 1.11 -0.75 0.24 0.00 0.00 174.94 176.21 1s3s s LYS 190 N -1.61 4.15 -0.12 0.37 2.47 -1.26 -3.09 119.74 120.64 1s3s s LYS 190 Ca 0.22 1.69 -0.29 0.00 -1.56 0.00 0.00 55.97 56.03 1s3s s LYS 190 Cb -0.12 -2.66 -0.01 0.00 -1.46 0.00 0.00 37.83 33.58 1s3s s LYS 190 CO 0.12 -0.20 1.00 0.50 0.16 0.00 0.00 175.35 176.94 1s3s s ARG 191 N -2.31 4.40 0.70 4.03 6.06 -1.26 -5.02 118.95 125.55 1s3s s ARG 191 Ca 0.56 1.37 -0.11 0.00 -2.50 0.00 0.00 55.73 55.05 1s3s s ARG 191 Cb -0.27 -3.56 0.01 0.00 0.06 0.00 0.00 34.95 31.19 1s3s s ARG 191 CO 0.34 -0.35 1.07 -1.21 -2.50 0.00 0.00 175.30 172.64 1s3s s GLU 192 N 2.16 2.90 0.27 5.12 0.41 -1.26 -4.94 118.70 123.36 1s3s s GLU 192 Ca 0.47 0.74 -0.03 0.00 -0.41 0.00 0.00 54.97 55.75 1s3s s GLU 192 Cb -0.18 -2.00 0.39 0.00 -1.78 0.00 0.00 34.13 30.56 1s3s s GLU 192 CO 0.16 -1.07 1.91 -0.44 -0.49 0.00 0.00 175.26 175.33 1s3s h ASP 193 N -0.69 1.04 1.29 -0.19 3.32 -2.05 -2.31 116.42 116.84 1s3s h ASP 193 Ca -0.45 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 56.60 1s3s h ASP 193 Cb 1.23 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 40.54 1s3s h ASP 193 CO 0.60 0.70 0.00 1.21 -1.72 0.00 0.00 179.24 180.03 1s3s n GLU 194 N -4.45 0.18 -2.68 3.56 2.13 -1.26 -4.53 120.64 113.58 1s3s n GLU 194 Ca 0.14 0.16 -0.43 0.00 0.66 0.00 0.00 57.16 57.69 1s3s n GLU 194 Cb 0.12 -1.71 -0.01 0.00 0.27 0.00 0.00 31.44 30.10 1s3s n GLU 194 CO 0.00 0.00 0.00 -1.21 -0.41 0.00 0.00 177.13 175.51 1s3s s GLU 195 N -3.08 3.84 0.24 5.31 2.02 -0.87 -4.97 118.70 121.19 1s3s s GLU 195 Ca 0.11 -1.82 -0.30 0.00 0.02 0.00 0.00 54.97 52.98 1s3s s GLU 195 Cb 0.14 -5.32 -0.10 0.00 0.10 0.00 0.00 34.13 28.94 1s3s s GLU 195 CO 0.56 -2.09 1.52 -1.21 0.02 0.00 0.00 175.26 174.06 1s3s s GLU 196 N 3.77 4.21 0.67 1.61 2.02 -1.26 -4.70 118.70 125.02 1s3s s GLU 196 Ca 0.47 2.40 -0.15 0.00 0.02 0.00 0.00 54.97 57.71 1s3s s GLU 196 Cb 0.00 -3.10 0.00 0.00 0.10 0.00 0.00 34.13 31.14 1s3s s GLU 196 CO -0.01 -0.54 1.12 0.45 0.02 0.00 0.00 175.26 176.31 1s3s s SER 197 N 0.62 4.98 0.00 -0.19 0.15 -1.26 -4.92 113.70 113.08 1s3s s SER 197 Ca 0.64 2.06 0.29 0.00 0.70 0.00 0.00 55.95 59.63 1s3s s SER 197 Cb -0.44 -2.56 1.25 0.00 -1.71 0.00 0.00 66.02 62.56 1s3s s SER 197 CO 0.41 -1.72 1.86 0.18 1.20 0.00 0.00 173.24 175.18 1s3s n LEU 198 N -2.44 0.62 -3.45 3.45 4.77 -1.26 -3.58 117.00 115.11 1s3s n LEU 198 Ca 0.11 -0.10 -0.41 0.00 -0.03 0.00 0.00 56.01 55.58 1s3s n LEU 198 Cb 0.52 -0.12 0.03 0.00 -2.33 0.00 0.00 43.42 41.51 1s3s n LEU 198 CO 0.48 0.11 1.47 -3.20 -1.33 0.00 0.00 177.39 174.91 1s3s n ASN 199 N -0.75 7.41 -4.10 -1.43 4.05 -1.26 -4.88 115.26 114.30 1s3s n ASN 199 Ca 0.16 -3.73 -0.14 0.00 0.45 0.00 0.00 54.58 51.32 1s3s n ASN 199 Cb 0.27 -1.14 -0.11 0.00 1.23 0.00 0.00 39.78 40.03 1s3s n ASN 199 CO 0.00 0.00 0.00 -0.70 -3.05 0.00 0.00 177.26 173.51 1s3s s GLU 200 N -4.27 0.63 0.22 1.20 2.56 -1.23 -5.12 118.70 112.69 1s3s s GLU 200 Ca 0.42 -0.86 -0.30 0.00 0.00 0.00 0.00 54.97 54.23 1s3s s GLU 200 Cb 0.26 -0.42 -0.09 0.00 2.00 0.00 0.00 34.13 35.88 1s3s s GLU 200 CO -0.21 0.08 1.18 0.08 -0.56 0.00 0.00 175.26 175.84 1s3s s VAL 201 N -1.57 3.48 0.14 3.70 1.01 -1.26 -5.00 120.40 120.90 1s3s s VAL 201 Ca -0.06 1.31 -0.05 0.00 0.00 0.00 0.00 61.98 63.18 1s3s s VAL 201 Cb -0.09 -3.84 -0.02 0.00 0.00 0.00 0.00 36.38 32.43 1s3s s VAL 201 CO 0.00 0.24 0.17 -0.83 0.00 0.00 0.00 175.10 174.69 1s3s s GLY 202 N -0.15 0.68 0.56 4.51 0.00 -1.26 -4.40 107.32 107.25 1s3s s GLY 202 Ca 0.51 -1.14 0.29 0.00 0.00 0.00 0.00 44.72 44.38 1s3s s GLY 202 CO 0.39 -1.08 1.91 -0.97 0.00 0.00 0.00 173.10 173.35 1s3s h TYR 203 N 2.72 0.00 0.00 1.90 0.05 -1.95 0.91 116.97 120.60 1s3s h TYR 203 Ca -0.33 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.45 1s3s h TYR 203 Cb 1.21 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.95 1s3s h TYR 203 CO 0.42 0.00 0.00 -0.40 -1.05 0.00 0.00 178.16 177.13 1s3s n ASP 204 N -4.03 0.00 -0.88 3.88 5.68 -1.26 -1.94 116.55 118.00 1s3s n ASP 204 Ca 0.12 -0.41 0.10 0.00 -0.50 0.00 0.00 54.79 54.10 1s3s n ASP 204 Cb 0.76 -0.11 0.14 0.00 -1.14 0.00 0.00 41.12 40.77 1s3s n ASP 204 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 1s3s n ASP 205 N -1.11 2.92 -4.13 -1.12 8.00 0.31 -4.88 116.55 116.54 1s3s n ASP 205 Ca 0.14 -1.87 -0.33 0.00 0.71 0.00 0.00 54.79 53.44 1s3s n ASP 205 Cb 0.11 -0.12 -0.16 0.00 -0.02 0.00 0.00 41.12 40.93 1s3s n ASP 205 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1s3s s VAL 206 N -1.43 2.23 0.24 2.53 1.01 -0.82 -4.96 120.40 119.20 1s3s s VAL 206 Ca 0.28 -1.00 0.12 0.00 0.00 0.00 0.00 61.98 61.38 1s3s s VAL 206 Cb 0.18 -2.01 -0.05 0.00 0.00 0.00 0.00 36.38 34.50 1s3s s VAL 206 CO 0.25 0.44 -0.22 -0.83 0.00 0.00 0.00 175.10 174.74 1s3s s GLY 207 N 1.28 1.81 0.00 4.51 0.00 -1.26 -4.70 107.32 108.96 1s3s s GLY 207 Ca 0.03 -1.77 0.00 0.00 0.00 0.00 0.00 44.72 42.98 1s3s s GLY 207 CO -0.11 -1.83 0.00 0.61 0.00 0.00 0.00 173.10 171.78 1s3s n GLY 208 N -0.20 2.83 3.20 0.20 0.00 -1.26 -4.78 105.19 105.19 1s3s n GLY 208 Ca -0.09 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.56 1s3s n GLY 208 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s3s n ARG 210 N 4.76 0.12 0.09 0.00 1.74 -1.26 -4.10 116.66 118.00 1s3s n ARG 210 Ca -0.08 0.05 -0.13 0.00 -0.77 0.00 0.00 57.85 56.93 1s3s n ARG 210 Cb 0.42 -0.71 -0.07 0.00 -1.02 0.00 0.00 32.46 31.09 1s3s n ARG 210 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 1s3s h LYS 211 N -0.21 -0.16 0.00 5.56 1.79 -1.99 -0.93 116.57 120.62 1s3s h LYS 211 Ca -0.13 0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.35 1s3s h LYS 211 Cb 1.05 0.04 0.00 0.00 -1.58 0.00 0.00 32.23 31.73 1s3s h LYS 211 CO -0.08 -0.11 0.00 1.04 -1.08 0.00 0.00 179.45 179.22 1s3s n GLN 212 N -5.18 0.00 0.13 3.15 1.13 -1.26 -1.07 117.38 114.27 1s3s n GLN 212 Ca -0.07 0.72 0.06 0.00 -1.94 0.00 0.00 57.00 55.76 1s3s n GLN 212 Cb 0.11 -1.42 0.32 0.00 0.11 0.00 0.00 30.24 29.36 1s3s n GLN 212 CO 0.00 0.00 0.00 -0.11 -1.44 0.00 0.00 177.06 175.51 1s3s n LEU 213 N -2.30 0.31 0.08 1.08 7.94 -1.20 -2.12 117.00 120.79 1s3s n LEU 213 Ca 0.00 0.55 -0.04 0.00 -1.11 0.00 0.00 56.01 55.41 1s3s n LEU 213 Cb 0.00 -0.53 -0.02 0.00 0.53 0.00 0.00 43.42 43.40 1s3s n LEU 213 CO 0.00 -0.65 0.13 0.00 -1.11 0.00 0.00 177.39 175.75 1s3s h ALA 214 N 1.38 -0.31 -0.13 1.96 0.00 0.35 -2.65 119.26 119.85 1s3s h ALA 214 Ca 0.00 -0.06 0.05 0.00 0.00 0.00 0.00 54.91 54.89 1s3s h ALA 214 Cb 0.43 0.11 -0.06 0.00 0.00 0.00 0.00 17.79 18.27 1s3s h ALA 214 CO 0.00 -0.29 -0.34 1.96 0.00 0.00 0.00 179.25 180.58 1s3s h GLN 215 N -0.93 -0.40 -1.01 0.00 4.20 -0.98 0.16 115.11 116.16 1s3s h GLN 215 Ca -0.03 0.03 0.24 0.00 0.06 0.00 0.00 58.65 58.95 1s3s h GLN 215 Cb 0.21 0.09 -0.12 0.00 0.30 0.00 0.00 27.48 27.97 1s3s h GLN 215 CO 0.05 -0.27 0.61 0.82 -0.67 0.00 0.00 178.83 179.37 1s3s h ILE 216 N -0.41 0.55 0.98 2.54 2.04 -1.62 -0.01 117.51 121.58 1s3s h ILE 216 Ca 0.09 -0.20 -0.05 0.00 1.00 0.00 0.00 64.86 65.71 1s3s h ILE 216 Cb 0.56 -0.07 0.01 0.00 -0.74 0.00 0.00 36.82 36.58 1s3s h ILE 216 CO -0.36 0.11 -0.47 0.11 0.00 0.00 0.00 178.15 177.54 1s3s h LYS 217 N 0.58 -1.27 -0.80 2.37 1.57 -0.33 -1.99 116.57 116.69 1s3s h LYS 217 Ca 0.63 0.09 0.04 0.00 -1.87 0.00 0.00 60.65 59.54 1s3s h LYS 217 Cb 1.23 0.29 -0.05 0.00 0.08 0.00 0.00 32.23 33.78 1s3s h LYS 217 CO -0.44 -0.85 0.50 1.05 -0.57 0.00 0.00 179.45 179.15 1s3s h GLU 218 N -1.35 0.94 -0.07 3.15 4.11 -0.64 0.51 114.58 121.23 1s3s h GLU 218 Ca -0.13 -0.06 0.03 0.00 0.07 0.00 0.00 59.36 59.27 1s3s h GLU 218 Cb 1.01 -0.21 -0.06 0.00 0.50 0.00 0.00 28.75 29.99 1s3s h GLU 218 CO 0.22 0.62 -0.51 0.52 0.07 0.00 0.00 179.01 179.93 1s3s h MET 219 N 0.96 -0.58 0.00 1.06 2.86 -0.95 -2.41 114.93 115.87 1s3s h MET 219 Ca 0.33 0.04 -0.04 0.00 -2.06 0.00 0.00 59.70 57.96 1s3s h MET 219 Cb 0.05 0.13 -0.01 0.00 0.06 0.00 0.00 31.60 31.84 1s3s h MET 219 CO -0.13 -0.39 -0.20 0.28 1.06 0.00 0.00 176.91 177.53 1s3s h VAL 220 N -0.61 0.43 -0.64 -2.22 2.07 -0.91 -3.38 116.25 110.99 1s3s h VAL 220 Ca 0.03 -1.23 0.06 0.00 0.82 0.00 0.00 66.70 66.38 1s3s h VAL 220 Cb 0.69 1.91 -0.08 0.00 -1.52 0.00 0.00 31.29 32.29 1s3s h VAL 220 CO -0.39 0.20 -0.38 1.21 0.02 0.00 0.00 177.57 178.23 1s3s n GLU 221 N -3.25 -0.28 0.10 1.57 4.07 0.18 -1.99 120.64 121.03 1s3s n GLU 221 Ca 0.01 1.19 -0.05 0.00 -0.06 0.00 0.00 57.16 58.26 1s3s n GLU 221 Cb 0.49 -1.76 -0.02 0.00 -0.06 0.00 0.00 31.44 30.09 1s3s n GLU 221 CO 0.00 0.00 0.00 -0.07 -0.06 0.00 0.00 177.13 177.00 1s3s h LEU 222 N 0.00 -0.27 -2.25 4.31 3.38 -1.74 -2.60 115.31 116.14 1s3s h LEU 222 Ca 0.10 0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.09 1s3s h LEU 222 Cb 0.26 0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.08 1s3s h LEU 222 CO -0.60 0.05 0.25 1.55 0.09 0.00 0.00 178.44 179.78 1s3s h PRO 223 N -0.81 0.00 0.00 1.13 0.13 -1.79 0.55 132.00 131.21 1s3s h PRO 223 Ca -0.03 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.10 1s3s h PRO 223 Cb 0.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.38 1s3s h PRO 223 CO 0.05 0.00 -1.53 -0.11 -0.23 0.00 0.00 178.00 176.18 1s3s n LEU 224 N -3.02 0.01 -0.08 1.56 7.94 -0.84 -4.31 117.00 118.26 1s3s n LEU 224 Ca -0.02 -0.01 -0.08 0.00 -1.11 0.00 0.00 56.01 54.79 1s3s n LEU 224 Cb 0.31 0.00 -0.13 0.00 0.53 0.00 0.00 43.42 44.14 1s3s n LEU 224 CO 0.16 0.00 -1.03 0.54 -1.11 0.00 0.00 177.39 175.95 1s3s n ARG 225 N -1.91 1.32 -3.37 1.96 1.74 -0.98 -4.71 116.66 110.71 1s3s n ARG 225 Ca -0.02 -0.00 -0.27 0.00 -0.77 0.00 0.00 57.85 56.79 1s3s n ARG 225 Cb 0.32 -1.41 -0.08 0.00 -1.02 0.00 0.00 32.46 30.26 1s3s n ARG 225 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 1s3s n HIS 226 N -2.63 3.16 0.07 -1.55 8.25 0.19 -4.97 115.22 117.74 1s3s n HIS 226 Ca -0.27 -4.08 -0.08 0.00 -0.26 0.00 0.00 57.72 53.03 1s3s n HIS 226 Cb 1.02 -0.53 -0.05 0.00 1.12 0.00 0.00 29.99 31.55 1s3s n HIS 226 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 1s3s h PRO 227 N 4.09 -0.38 -0.88 -0.41 0.11 -1.75 -2.86 132.00 129.93 1s3s h PRO 227 Ca 0.18 0.03 0.34 0.00 0.11 0.00 0.00 66.00 66.66 1s3s h PRO 227 Cb 0.68 0.09 -0.16 0.00 0.11 0.00 0.00 31.00 31.72 1s3s h PRO 227 CO 0.79 -0.25 0.39 0.00 -0.21 0.00 0.00 178.00 178.71 1s3s n ALA 228 N -2.66 0.82 -0.29 -0.75 0.00 -1.26 -0.40 120.51 115.97 1s3s n ALA 228 Ca -0.04 0.90 0.11 0.00 0.00 0.00 0.00 53.44 54.40 1s3s n ALA 228 Cb 0.21 -0.85 0.26 0.00 0.00 0.00 0.00 19.45 19.06 1s3s n ALA 228 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1s3s h LEU 229 N 0.00 0.09 0.00 0.00 5.85 -1.88 0.20 115.31 119.57 1s3s h LEU 229 Ca 0.70 0.17 0.00 0.00 0.84 0.00 0.00 57.88 59.59 1s3s h LEU 229 Cb 1.81 0.21 0.00 0.00 0.37 0.00 0.00 40.66 43.05 1s3s h LEU 229 CO -0.70 -0.08 -0.17 -0.26 -0.34 0.00 0.00 178.44 176.89 1s3s h PHE 230 N 0.28 0.00 -0.05 1.25 -1.00 -0.88 0.62 116.94 117.16 1s3s h PHE 230 Ca 0.51 0.00 -0.18 0.00 2.81 0.00 0.00 57.97 61.11 1s3s h PHE 230 Cb 0.97 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.53 1s3s h PHE 230 CO -0.23 0.00 -0.76 -0.22 -1.61 0.00 0.00 178.31 175.49 1s3s h LYS 231 N 0.00 0.31 0.00 1.51 3.64 -0.66 -3.20 116.57 118.18 1s3s h LYS 231 Ca 0.00 -0.27 0.00 0.00 -1.27 0.00 0.00 60.65 59.11 1s3s h LYS 231 Cb 0.85 0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.74 1s3s h LYS 231 CO 0.00 0.93 -1.02 0.00 -2.27 0.00 0.00 179.45 177.10 1s3s n ALA 232 N -2.49 3.78 -2.63 5.00 0.00 -0.20 -4.95 120.51 119.03 1s3s n ALA 232 Ca -0.04 -0.46 -0.21 0.00 0.00 0.00 0.00 53.44 52.73 1s3s n ALA 232 Cb 0.73 -0.92 -0.03 0.00 0.00 0.00 0.00 19.45 19.23 1s3s n ALA 232 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 1s3s s ILE 233 N -3.13 4.10 -0.47 0.00 1.10 0.20 -5.01 121.20 117.97 1s3s s ILE 233 Ca 0.05 -1.23 0.16 0.00 -0.51 0.00 0.00 60.65 59.12 1s3s s ILE 233 Cb 0.15 -3.38 -0.21 0.00 0.15 0.00 0.00 42.46 39.18 1s3s s ILE 233 CO 0.81 -0.23 0.56 0.61 -2.11 0.00 0.00 174.94 174.59 1s3s n GLY 234 N -1.40 -0.62 3.77 1.50 0.00 -1.26 -4.82 105.19 102.35 1s3s n GLY 234 Ca -0.04 -0.43 -0.36 0.00 0.00 0.00 0.00 46.02 45.19 1s3s n GLY 234 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1s3s s VAL 235 N -2.77 2.99 -0.17 1.61 1.01 -1.26 -5.03 120.40 116.78 1s3s s VAL 235 Ca 0.01 0.64 -0.05 0.00 0.00 0.00 0.00 61.98 62.58 1s3s s VAL 235 Cb 0.12 -3.27 -0.03 0.00 0.00 0.00 0.00 36.38 33.20 1s3s s VAL 235 CO 0.68 -0.12 0.00 -0.54 0.00 0.00 0.00 175.10 175.12 1s3s s LYS 236 N -3.22 3.74 0.44 2.72 1.02 -1.26 -4.96 119.74 118.22 1s3s s LYS 236 Ca 0.73 -0.47 -0.02 0.00 0.02 0.00 0.00 55.97 56.23 1s3s s LYS 236 Cb -0.26 -3.04 -0.02 0.00 -0.52 0.00 0.00 37.83 33.99 1s3s s LYS 236 CO 0.30 0.19 0.69 -1.25 -0.92 0.00 0.00 175.35 174.36 1s3s s PRO 237 N 0.53 3.28 0.43 -1.68 0.04 -1.26 -5.04 135.00 131.30 1s3s s PRO 237 Ca -0.01 -0.22 -0.26 0.00 0.04 0.00 0.00 61.00 60.55 1s3s s PRO 237 Cb -0.14 -2.51 -0.09 0.00 0.04 0.00 0.00 34.50 31.80 1s3s s PRO 237 CO 0.02 -0.19 1.41 -1.25 0.04 0.00 0.00 177.00 177.03 1s3s s PRO 238 N -4.58 3.84 -0.13 0.56 0.04 -1.26 -4.92 135.00 128.54 1s3s s PRO 238 Ca 0.46 2.39 -0.06 0.00 0.04 0.00 0.00 61.00 63.83 1s3s s PRO 238 Cb -0.10 -2.74 -0.06 0.00 0.04 0.00 0.00 34.50 31.64 1s3s s PRO 238 CO 0.40 -0.69 -0.17 0.54 0.04 0.00 0.00 177.00 177.13 1s3s n ARG 239 N 0.01 0.28 -3.83 4.56 1.74 -1.26 -4.87 116.66 113.28 1s3s n ARG 239 Ca 0.04 0.12 -0.36 0.00 -0.77 0.00 0.00 57.85 56.88 1s3s n ARG 239 Cb 0.42 -0.97 -0.12 0.00 -1.02 0.00 0.00 32.46 30.77 1s3s n ARG 239 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1s3s s GLY 240 N -5.24 1.78 -0.21 -0.13 0.00 -0.93 0.94 107.32 103.52 1s3s s GLY 240 Ca -0.18 -1.06 -0.00 0.00 0.00 0.00 0.00 44.72 43.47 1s3s s GLY 240 CO 0.23 0.44 -0.13 -0.42 0.00 0.00 0.00 173.10 173.21 1s3s s ILE 241 N 1.38 2.45 -0.25 0.90 1.01 0.15 -2.13 121.20 124.72 1s3s s ILE 241 Ca 0.05 -0.98 -0.10 0.00 0.00 0.00 0.00 60.65 59.63 1s3s s ILE 241 Cb -0.15 -2.15 -0.05 0.00 0.01 0.00 0.00 42.46 40.13 1s3s s ILE 241 CO 0.03 0.38 0.14 -0.22 0.00 0.00 0.00 174.94 175.27 1s3s s LEU 242 N 1.30 3.95 -0.22 2.97 2.96 0.50 -1.75 118.68 128.40 1s3s s LEU 242 Ca 0.02 0.02 -0.04 0.00 -0.22 0.00 0.00 54.13 53.91 1s3s s LEU 242 Cb -0.15 -2.06 -0.01 0.00 0.50 0.00 0.00 46.19 44.46 1s3s s LEU 242 CO -0.09 0.03 -0.03 -0.76 -1.32 0.00 0.00 176.35 174.19 1s3s s LEU 243 N 1.27 3.01 0.43 -0.68 1.02 0.67 0.16 118.68 124.55 1s3s s LEU 243 Ca 0.07 -0.34 0.07 0.00 0.02 0.00 0.00 54.13 53.95 1s3s s LEU 243 Cb -0.14 -1.77 -0.05 0.00 0.02 0.00 0.00 46.19 44.25 1s3s s LEU 243 CO 0.06 -0.00 0.18 -0.72 0.02 0.00 0.00 176.35 175.89 1s3s s TYR 244 N 1.37 2.51 0.00 0.29 -0.00 -0.96 -0.88 117.35 119.68 1s3s s TYR 244 Ca 0.04 -0.62 0.00 0.00 -0.00 0.00 0.00 57.07 56.49 1s3s s TYR 244 Cb -0.14 -1.94 0.00 0.00 -0.00 0.00 0.00 41.96 39.88 1s3s s TYR 244 CO -0.01 0.16 0.00 0.41 -0.00 0.00 0.00 175.55 176.10 1s3s n GLY 245 N -1.26 4.44 3.34 5.49 0.00 -1.05 -1.83 105.19 114.32 1s3s n GLY 245 Ca -0.02 -1.36 -0.33 0.00 0.00 0.00 0.00 46.02 44.31 1s3s n GLY 245 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1s3s n PRO 246 N -1.83 -0.57 -1.64 1.61 -0.04 -1.26 -4.35 135.00 126.91 1s3s n PRO 246 Ca 0.00 -0.14 -0.36 0.00 -0.04 0.00 0.00 63.50 62.97 1s3s n PRO 246 Cb 0.00 -1.74 0.08 0.00 -0.04 0.00 0.00 33.50 31.80 1s3s n PRO 246 CO 0.00 0.00 0.00 -2.14 -0.04 0.00 0.00 175.50 173.32 1s3s s PRO 247 N -3.44 2.41 0.00 0.54 0.02 -1.26 -2.99 135.00 130.29 1s3s s PRO 247 Ca 0.55 1.91 0.00 0.00 0.02 0.00 0.00 61.00 63.48 1s3s s PRO 247 Cb -0.18 -1.85 0.00 0.00 0.02 0.00 0.00 34.50 32.49 1s3s s PRO 247 CO 0.68 -1.66 0.00 0.41 -0.33 0.00 0.00 177.00 176.10 1s3s n GLY 248 N 0.65 0.69 0.17 0.52 0.00 -1.26 -4.88 105.19 101.08 1s3s n GLY 248 Ca 0.15 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.30 1s3s n GLY 248 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1s3s h THR 249 N 0.00 0.00 0.00 2.61 2.02 -1.87 -1.57 112.91 114.09 1s3s h THR 249 Ca 0.00 -0.26 0.00 0.00 0.77 0.00 0.00 66.41 66.92 1s3s h THR 249 Cb 0.06 1.03 0.00 0.00 -1.74 0.00 0.00 68.15 67.49 1s3s h THR 249 CO 0.00 0.00 0.00 0.61 0.37 0.00 0.00 175.52 176.50 1s3s n GLY 250 N -0.17 1.02 0.25 2.16 0.00 -1.26 -4.77 105.19 102.42 1s3s n GLY 250 Ca 0.01 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.95 1s3s n GLY 250 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1s3s h LYS 251 N 0.77 0.84 0.00 1.61 1.57 -1.94 0.86 116.57 120.28 1s3s h LYS 251 Ca 0.00 -0.20 -0.04 0.00 -1.87 0.00 0.00 60.65 58.55 1s3s h LYS 251 Cb 0.00 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.19 1s3s h LYS 251 CO 0.00 0.79 -0.18 1.15 -0.57 0.00 0.00 179.45 180.64 1s3s h THR 252 N 0.73 0.50 0.07 -0.16 2.02 -1.99 -1.55 112.91 112.54 1s3s h THR 252 Ca 0.17 -0.90 -0.00 0.00 0.77 0.00 0.00 66.41 66.44 1s3s h THR 252 Cb 0.32 1.62 0.00 0.00 -1.74 0.00 0.00 68.15 68.35 1s3s h THR 252 CO 0.00 0.17 -0.03 0.25 0.37 0.00 0.00 175.52 176.28 1s3s h LEU 253 N 0.00 -0.08 0.40 2.58 6.46 -1.69 -2.91 115.31 120.07 1s3s h LEU 253 Ca -0.00 -0.53 -0.01 0.00 -0.12 0.00 0.00 57.88 57.22 1s3s h LEU 253 Cb 0.60 0.02 -0.02 0.00 -0.73 0.00 0.00 40.66 40.54 1s3s h LEU 253 CO 0.02 0.58 -0.32 0.40 -0.62 0.00 0.00 178.44 178.51 1s3s h ILE 254 N -0.85 0.33 -0.87 4.05 2.04 -0.75 0.16 117.51 121.63 1s3s h ILE 254 Ca -0.01 0.00 0.18 0.00 1.00 0.00 0.00 64.86 66.03 1s3s h ILE 254 Cb 0.61 0.33 -0.11 0.00 -0.74 0.00 0.00 36.82 36.92 1s3s h ILE 254 CO 0.02 0.00 0.42 0.00 0.00 0.00 0.00 178.15 178.59 1s3s h ALA 255 N -0.24 1.35 -0.23 1.87 0.00 -1.42 -0.12 119.26 120.48 1s3s h ALA 255 Ca -0.03 0.11 -0.10 0.00 0.00 0.00 0.00 54.91 54.89 1s3s h ALA 255 Cb 0.63 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.46 1s3s h ALA 255 CO -0.01 -0.19 -0.24 -0.09 0.00 0.00 0.00 179.25 178.72 1s3s h ARG 256 N 0.54 0.56 -0.49 0.00 2.43 -1.26 -2.71 114.38 113.45 1s3s h ARG 256 Ca 0.50 -0.30 -0.02 0.00 -0.81 0.00 0.00 59.98 59.35 1s3s h ARG 256 Cb 0.82 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.36 1s3s h ARG 256 CO -0.43 0.89 0.23 0.00 -1.51 0.00 0.00 179.97 179.16 1s3s h ALA 257 N 0.66 0.64 -0.99 2.80 0.00 -0.28 -2.50 119.26 119.59 1s3s h ALA 257 Ca 0.03 -0.12 0.09 0.00 0.00 0.00 0.00 54.91 54.91 1s3s h ALA 257 Cb 0.80 -0.19 -0.07 0.00 0.00 0.00 0.00 17.79 18.32 1s3s h ALA 257 CO 0.06 0.20 0.63 0.28 0.00 0.00 0.00 179.25 180.43 1s3s h VAL 258 N 0.65 1.00 0.57 0.00 2.07 -1.03 0.14 116.25 119.66 1s3s h VAL 258 Ca 0.17 -0.37 -0.03 0.00 0.82 0.00 0.00 66.70 67.30 1s3s h VAL 258 Cb 0.13 -0.16 0.01 0.00 -1.52 0.00 0.00 31.29 29.75 1s3s h VAL 258 CO -0.02 0.19 -0.28 0.00 0.02 0.00 0.00 177.57 177.49 1s3s h ALA 259 N 1.50 -0.77 0.13 1.67 0.00 -1.13 -2.78 119.26 117.89 1s3s h ALA 259 Ca 0.46 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.17 1s3s h ALA 259 Cb 0.33 0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 1s3s h ALA 259 CO -0.21 -0.86 -0.11 -0.91 0.00 0.00 0.00 179.25 177.17 1s3s h ASN 260 N -0.92 -0.27 0.00 0.00 2.35 -1.09 0.15 115.58 115.80 1s3s h ASN 260 Ca -0.08 0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.69 1s3s h ASN 260 Cb 0.64 0.09 0.00 0.00 0.05 0.00 0.00 38.32 39.10 1s3s h ASN 260 CO 0.13 -0.17 0.02 -0.08 -1.65 0.00 0.00 177.43 175.68 1s3s h GLU 261 N -0.25 0.00 -0.02 0.81 4.57 -0.80 0.11 114.58 119.00 1s3s h GLU 261 Ca -0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1s3s h GLU 261 Cb 0.23 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.82 1s3s h GLU 261 CO -0.01 0.00 0.00 0.25 -1.18 0.00 0.00 179.01 178.07 1s3s n THR 262 N -2.46 1.67 -3.41 0.32 -2.24 -1.05 -4.18 114.28 102.94 1s3s n THR 262 Ca -0.02 -1.90 -0.23 0.00 -2.27 0.00 0.00 64.05 59.63 1s3s n THR 262 Cb 0.06 -0.04 -0.01 0.00 -2.10 0.00 0.00 70.33 68.24 1s3s n THR 262 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1s3s n GLY 263 N -1.10 -0.48 3.90 3.38 0.00 0.38 -4.88 105.19 106.40 1s3s n GLY 263 Ca 0.12 0.07 -0.33 0.00 0.00 0.00 0.00 46.02 45.89 1s3s n GLY 263 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s3s s ALA 264 N -2.86 3.92 0.39 4.61 0.00 0.46 -4.97 121.76 123.31 1s3s s ALA 264 Ca 0.41 -0.71 -0.27 0.00 0.00 0.00 0.00 51.96 51.39 1s3s s ALA 264 Cb -0.22 -1.95 -0.10 0.00 0.00 0.00 0.00 23.12 20.85 1s3s s ALA 264 CO 0.50 0.74 1.40 0.12 0.00 0.00 0.00 175.76 178.52 1s3s s PHE 265 N -1.44 2.70 -0.20 0.00 5.36 -0.41 -4.41 117.98 119.58 1s3s s PHE 265 Ca 0.32 1.29 0.00 0.00 -0.96 0.00 0.00 56.93 57.58 1s3s s PHE 265 Cb -0.13 -3.86 0.05 0.00 -0.34 0.00 0.00 43.02 38.74 1s3s s PHE 265 CO 0.22 -2.58 -0.06 0.12 -1.46 0.00 0.00 175.22 171.47 1s3s s PHE 266 N -1.17 2.02 -0.16 10.12 5.36 -1.26 0.35 117.98 133.24 1s3s s PHE 266 Ca 0.55 -1.39 -0.01 0.00 -0.96 0.00 0.00 56.93 55.11 1s3s s PHE 266 Cb -0.43 -1.45 -0.01 0.00 -0.34 0.00 0.00 43.02 40.80 1s3s s PHE 266 CO 0.57 -0.69 -0.11 0.12 -1.46 0.00 0.00 175.22 173.65 1s3s s PHE 267 N 1.52 2.86 0.01 10.12 2.19 -0.55 -4.99 117.98 129.14 1s3s s PHE 267 Ca -0.02 -0.84 -0.08 0.00 0.33 0.00 0.00 56.93 56.32 1s3s s PHE 267 Cb -0.17 -1.94 -0.05 0.00 -1.31 0.00 0.00 43.02 39.56 1s3s s PHE 267 CO -0.07 -0.38 0.30 -1.17 1.83 0.00 0.00 175.22 175.73 1s3s s LEU 268 N 0.80 4.38 -0.17 6.12 2.96 -1.26 -1.21 118.68 130.30 1s3s s LEU 268 Ca -0.04 0.64 -0.03 0.00 -0.22 0.00 0.00 54.13 54.49 1s3s s LEU 268 Cb -0.15 -2.67 0.05 0.00 0.50 0.00 0.00 46.19 43.93 1s3s s LEU 268 CO 0.01 0.26 0.03 -0.63 -1.32 0.00 0.00 176.35 174.70 1s3s s ILE 269 N -1.27 0.51 -0.22 6.68 1.01 -0.11 -4.92 121.20 122.88 1s3s s ILE 269 Ca 0.27 -0.44 -0.16 0.00 0.00 0.00 0.00 60.65 60.31 1s3s s ILE 269 Cb -0.14 -0.95 -0.04 0.00 0.01 0.00 0.00 42.46 41.35 1s3s s ILE 269 CO 0.15 -0.12 0.44 0.21 0.00 0.00 0.00 174.94 175.61 1s3s s ASN 270 N 1.87 6.43 0.16 3.58 3.04 -1.26 0.25 114.94 129.01 1s3s s ASN 270 Ca 0.00 0.51 -0.28 0.00 0.04 0.00 0.00 52.86 53.13 1s3s s ASN 270 Cb -0.16 -2.25 -0.00 0.00 -1.54 0.00 0.00 41.25 37.30 1s3s s ASN 270 CO -0.08 -0.15 1.56 1.23 -3.04 0.00 0.00 177.10 176.62 1s3s h GLY 271 N 8.06 -0.63 0.64 1.21 0.00 -0.19 -0.61 103.07 111.55 1s3s h GLY 271 Ca -0.34 0.64 0.09 0.00 0.00 0.00 0.00 47.33 47.73 1s3s h GLY 271 CO 0.71 -0.12 0.62 -2.55 0.00 0.00 0.00 176.54 175.21 1s3s h PRO 272 N -0.22 1.01 -0.59 4.80 0.11 -1.83 -0.89 132.00 134.39 1s3s h PRO 272 Ca 0.16 -0.06 0.08 0.00 0.11 0.00 0.00 66.00 66.29 1s3s h PRO 272 Cb 0.55 -0.23 -0.06 0.00 0.11 0.00 0.00 31.00 31.37 1s3s h PRO 272 CO -0.73 0.67 0.25 1.49 -0.21 0.00 0.00 178.00 179.46 1s3s h GLU 273 N 1.04 0.44 0.16 1.05 4.81 -1.54 -0.23 114.58 120.31 1s3s h GLU 273 Ca 0.45 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.65 1s3s h GLU 273 Cb 0.34 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.62 1s3s h GLU 273 CO -0.21 0.29 -0.08 0.82 -0.73 0.00 0.00 179.01 179.11 1s3s h ILE 274 N 0.45 0.98 0.00 2.32 1.08 -0.57 -3.07 117.51 118.69 1s3s h ILE 274 Ca 0.29 -0.92 0.00 0.00 -0.39 0.00 0.00 64.86 63.84 1s3s h ILE 274 Cb 0.31 1.51 0.00 0.00 -3.07 0.00 0.00 36.82 35.57 1s3s h ILE 274 CO -0.26 0.20 0.00 0.23 -0.69 0.00 0.00 178.15 177.63 1s3s n MET 275 N -4.98 0.03 0.06 2.37 2.81 -0.45 -1.80 117.12 115.17 1s3s n MET 275 Ca -0.09 0.33 0.13 0.00 -1.81 0.00 0.00 57.70 56.26 1s3s n MET 275 Cb 0.25 -1.50 0.30 0.00 -0.71 0.00 0.00 33.22 31.57 1s3s n MET 275 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 1s3s n SER 276 N -1.42 0.62 -4.98 7.83 3.41 -0.11 -4.87 113.62 114.09 1s3s n SER 276 Ca 0.02 0.25 -0.20 0.00 -0.26 0.00 0.00 58.87 58.68 1s3s n SER 276 Cb 0.06 -0.18 0.02 0.00 -0.26 0.00 0.00 64.21 63.85 1s3s n SER 276 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1s3s s LYS 277 N -3.10 2.86 0.34 4.33 1.02 -0.74 -5.08 119.74 119.35 1s3s s LYS 277 Ca 0.09 -0.89 -0.26 0.00 0.02 0.00 0.00 55.97 54.93 1s3s s LYS 277 Cb 0.14 -2.65 -0.10 0.00 -0.52 0.00 0.00 37.83 34.71 1s3s s LYS 277 CO 0.66 -0.33 0.97 -1.17 -0.92 0.00 0.00 175.35 174.56 1s3s s LEU 278 N -4.48 4.30 0.00 3.17 2.96 -1.26 -4.63 118.68 118.74 1s3s s LEU 278 Ca 0.52 1.89 0.00 0.00 -0.22 0.00 0.00 54.13 56.32 1s3s s LEU 278 Cb -0.10 -4.04 0.00 0.00 0.50 0.00 0.00 46.19 42.55 1s3s s LEU 278 CO 0.35 -0.15 0.00 0.00 -1.32 0.00 0.00 176.35 175.23 1s3s n ALA 279 N 0.44 0.00 0.04 5.97 0.00 -1.26 -0.15 120.51 125.56 1s3s n ALA 279 Ca 0.02 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.34 1s3s n ALA 279 Cb 0.50 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.87 1s3s n ALA 279 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1s3s h GLY 280 N 0.00 -0.05 2.00 0.00 0.00 -2.00 -2.66 103.07 100.36 1s3s h GLY 280 Ca 0.00 0.02 -0.01 0.00 0.00 0.00 0.00 47.33 47.34 1s3s h GLY 280 CO 0.00 -0.02 -0.04 -2.09 0.00 0.00 0.00 176.54 174.39 1s3s h GLU 281 N -0.18 0.00 0.62 4.80 4.81 -0.94 -0.03 114.58 123.66 1s3s h GLU 281 Ca -0.00 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.19 1s3s h GLU 281 Cb 0.16 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.55 1s3s h GLU 281 CO 0.01 0.04 -0.30 1.03 -0.73 0.00 0.00 179.01 179.06 1s3s h SER 282 N 0.00 -0.71 0.67 1.04 0.87 -0.21 -2.60 113.55 112.62 1s3s h SER 282 Ca -0.00 -0.01 -0.07 0.00 -1.23 0.00 0.00 61.79 60.49 1s3s h SER 282 Cb 0.19 0.18 -0.01 0.00 -0.44 0.00 0.00 62.40 62.32 1s3s h SER 282 CO 0.01 -0.33 -0.31 -0.33 -0.53 0.00 0.00 176.83 175.34 1s3s h GLU 283 N -1.16 0.00 -0.33 2.24 5.08 -1.25 -2.77 114.58 116.38 1s3s h GLU 283 Ca -0.09 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.27 1s3s h GLU 283 Cb 0.67 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.91 1s3s h GLU 283 CO 0.14 0.31 0.21 1.03 -1.00 0.00 0.00 179.01 179.70 1s3s h SER 284 N 0.00 0.40 -0.09 1.42 0.87 -1.03 -1.46 113.55 113.66 1s3s h SER 284 Ca -0.00 -0.04 -0.05 0.00 -1.23 0.00 0.00 61.79 60.46 1s3s h SER 284 Cb 0.73 -0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 62.58 1s3s h SER 284 CO 0.04 0.32 -0.09 0.78 -0.53 0.00 0.00 176.83 177.35 1s3s h ASN 285 N 0.44 0.36 -0.22 6.23 -0.26 -1.19 0.25 115.58 121.18 1s3s h ASN 285 Ca 0.12 -0.07 -0.03 0.00 -0.56 0.00 0.00 56.30 55.76 1s3s h ASN 285 Cb -0.01 -0.09 -0.01 0.00 -1.06 0.00 0.00 38.32 37.15 1s3s h ASN 285 CO -0.02 0.48 0.01 -0.07 -1.06 0.00 0.00 177.43 176.77 1s3s h LEU 286 N 0.36 0.37 0.05 1.61 3.38 -1.18 0.22 115.31 120.12 1s3s h LEU 286 Ca 0.07 -0.29 -0.00 0.00 0.09 0.00 0.00 57.88 57.75 1s3s h LEU 286 Cb 0.38 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.03 1s3s h LEU 286 CO 0.02 0.57 -0.03 0.03 0.09 0.00 0.00 178.44 179.12 1s3s h ARG 287 N 0.15 -0.07 -0.40 1.13 3.08 -0.86 -1.95 114.38 115.46 1s3s h ARG 287 Ca 0.06 0.00 0.08 0.00 0.07 0.00 0.00 59.98 60.20 1s3s h ARG 287 Cb 0.37 0.02 -0.09 0.00 0.08 0.00 0.00 29.97 30.35 1s3s h ARG 287 CO 0.01 0.02 -0.31 -0.22 -1.07 0.00 0.00 179.97 178.39 1s3s h LYS 288 N -0.14 -0.23 -0.14 0.04 1.63 -0.36 0.31 116.57 117.67 1s3s h LYS 288 Ca -0.01 0.02 0.05 0.00 -0.85 0.00 0.00 60.65 59.85 1s3s h LYS 288 Cb 0.12 0.05 -0.05 0.00 -0.60 0.00 0.00 32.23 31.75 1s3s h LYS 288 CO 0.01 -0.15 -0.19 0.00 -3.45 0.00 0.00 179.45 175.67 1s3s h ALA 289 N 0.81 -0.12 -0.71 5.00 0.00 -0.33 0.39 119.26 124.30 1s3s h ALA 289 Ca 0.18 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.11 1s3s h ALA 289 Cb 0.53 0.38 -0.03 0.00 0.00 0.00 0.00 17.79 18.67 1s3s h ALA 289 CO -0.54 -0.64 0.33 0.74 0.00 0.00 0.00 179.25 179.14 1s3s h PHE 290 N -0.23 1.04 -0.10 0.00 -1.00 -0.68 -1.53 116.94 114.43 1s3s h PHE 290 Ca 0.10 -0.06 -0.00 0.00 2.81 0.00 0.00 57.97 60.82 1s3s h PHE 290 Cb 0.39 -0.32 -0.00 0.00 3.61 0.00 0.00 35.95 39.62 1s3s h PHE 290 CO -0.31 0.78 0.05 1.49 -1.61 0.00 0.00 178.31 178.71 1s3s h GLU 291 N 1.00 0.15 0.38 1.51 4.81 0.33 -1.06 114.58 121.70 1s3s h GLU 291 Ca 0.24 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.43 1s3s h GLU 291 Cb 0.14 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.50 1s3s h GLU 291 CO -0.03 0.22 -0.18 1.49 -0.73 0.00 0.00 179.01 179.78 1s3s h GLU 292 N 0.04 -0.50 -0.82 1.92 4.81 -0.11 -2.12 114.58 117.81 1s3s h GLU 292 Ca 0.04 0.03 0.22 0.00 -0.13 0.00 0.00 59.36 59.52 1s3s h GLU 292 Cb 0.12 0.11 -0.04 0.00 0.63 0.00 0.00 28.75 29.57 1s3s h GLU 292 CO -0.00 -0.32 0.57 0.00 -0.73 0.00 0.00 179.01 178.53 1s3s h ALA 293 N 0.09 2.53 0.00 2.92 0.00 -1.19 0.20 119.26 123.82 1s3s h ALA 293 Ca -0.05 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 1s3s h ALA 293 Cb 0.40 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 1s3s h ALA 293 CO 0.09 -0.78 -0.32 0.93 0.00 0.00 0.00 179.25 179.17 1s3s h GLU 294 N 0.16 0.00 0.32 0.00 5.08 -0.50 -3.12 114.58 116.51 1s3s h GLU 294 Ca 0.41 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.75 1s3s h GLU 294 Cb 1.36 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.61 1s3s h GLU 294 CO -0.07 0.32 -0.15 0.87 -1.00 0.00 0.00 179.01 178.98 1s3s h LYS 295 N 0.00 -0.41 -1.17 2.33 1.57 -0.38 -3.26 116.57 115.26 1s3s h LYS 295 Ca -0.00 0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.79 1s3s h LYS 295 Cb 0.76 0.09 -0.01 0.00 0.08 0.00 0.00 32.23 33.16 1s3s h LYS 295 CO 0.04 -0.08 0.02 0.09 -0.57 0.00 0.00 179.45 178.95 1s3s n ASN 296 N -5.09 3.44 -4.75 0.86 3.02 -1.16 -4.93 115.26 106.64 1s3s n ASN 296 Ca -0.09 -2.11 -0.37 0.00 -0.03 0.00 0.00 54.58 51.98 1s3s n ASN 296 Cb 0.27 -0.62 0.03 0.00 -0.61 0.00 0.00 39.78 38.85 1s3s n ASN 296 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1s3s s ALA 297 N -0.08 2.77 0.43 5.41 0.00 -1.18 -4.18 121.76 124.91 1s3s s ALA 297 Ca 0.01 1.15 -0.24 0.00 0.00 0.00 0.00 51.96 52.88 1s3s s ALA 297 Cb 0.01 -3.49 -0.08 0.00 0.00 0.00 0.00 23.12 19.56 1s3s s ALA 297 CO 0.00 -1.15 1.13 -1.25 0.00 0.00 0.00 175.76 174.49 1s3s s PRO 298 N -2.98 3.96 0.11 0.00 0.04 -1.26 -5.01 135.00 129.86 1s3s s PRO 298 Ca 0.72 1.72 -0.08 0.00 0.04 0.00 0.00 61.00 63.40 1s3s s PRO 298 Cb -0.35 -2.52 -0.01 0.00 0.04 0.00 0.00 34.50 31.66 1s3s s PRO 298 CO 0.40 -0.37 0.19 0.00 0.04 0.00 0.00 177.00 177.26 1s3s s ALA 299 N -1.54 -0.04 -0.10 8.56 0.00 -0.59 -1.29 121.76 126.76 1s3s s ALA 299 Ca 0.60 -0.79 0.03 0.00 0.00 0.00 0.00 51.96 51.80 1s3s s ALA 299 Cb -0.27 0.60 0.01 0.00 0.00 0.00 0.00 23.12 23.45 1s3s s ALA 299 CO 0.34 -0.54 -0.19 0.42 0.00 0.00 0.00 175.76 175.79 1s3s s ILE 300 N -3.91 1.73 -0.25 0.00 1.01 0.16 -2.01 121.20 117.92 1s3s s ILE 300 Ca 0.10 -0.80 -0.07 0.00 0.00 0.00 0.00 60.65 59.87 1s3s s ILE 300 Cb 0.05 -1.53 -0.03 0.00 0.01 0.00 0.00 42.46 40.96 1s3s s ILE 300 CO -0.07 0.49 0.07 -0.63 0.00 0.00 0.00 174.94 174.79 1s3s s ILE 301 N 0.68 4.28 -0.40 2.92 1.01 -0.84 -1.48 121.20 127.38 1s3s s ILE 301 Ca -0.12 -0.20 -0.10 0.00 0.00 0.00 0.00 60.65 60.23 1s3s s ILE 301 Cb -0.16 -3.01 0.06 0.00 0.01 0.00 0.00 42.46 39.36 1s3s s ILE 301 CO 0.03 0.33 0.24 0.12 0.00 0.00 0.00 174.94 175.66 1s3s s PHE 302 N 1.61 3.29 -0.68 3.97 5.36 -0.35 0.33 117.98 131.51 1s3s s PHE 302 Ca 0.06 -1.30 -0.23 0.00 -0.96 0.00 0.00 56.93 54.50 1s3s s PHE 302 Cb -0.15 -2.75 0.07 0.00 -0.34 0.00 0.00 43.02 39.85 1s3s s PHE 302 CO 0.03 -0.77 1.01 0.42 -1.46 0.00 0.00 175.22 174.45 1s3s s ILE 303 N 1.48 4.27 -0.00 3.12 1.01 0.34 -0.93 121.20 130.48 1s3s s ILE 303 Ca 0.02 -0.32 -0.25 0.00 0.00 0.00 0.00 60.65 60.10 1s3s s ILE 303 Cb -0.22 -4.72 -0.05 0.00 0.01 0.00 0.00 42.46 37.49 1s3s s ILE 303 CO 0.04 -1.51 0.75 -0.62 0.00 0.00 0.00 174.94 173.60 1s3s s ASP 304 N 3.70 7.13 -0.78 3.58 2.15 0.14 -2.06 116.67 130.53 1s3s s ASP 304 Ca 0.24 1.35 -0.04 0.00 0.43 0.00 0.00 52.55 54.53 1s3s s ASP 304 Cb -0.16 -2.45 -0.04 0.00 -0.30 0.00 0.00 42.92 39.97 1s3s s ASP 304 CO 0.10 -0.06 0.69 -0.62 -0.17 0.00 0.00 175.17 175.11 1s3s n GLU 305 N 3.27 -1.62 -0.10 4.34 1.02 -1.19 0.37 120.64 126.73 1s3s n GLU 305 Ca -0.01 0.82 -0.10 0.00 -0.02 0.00 0.00 57.16 57.84 1s3s n GLU 305 Cb 0.51 -4.93 -0.03 0.00 -0.02 0.00 0.00 31.44 26.97 1s3s n GLU 305 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 1s3s h LEU 306 N -0.58 0.48 -0.97 -4.62 5.85 -1.61 -2.79 115.31 111.07 1s3s h LEU 306 Ca -0.38 -0.26 0.00 0.00 0.84 0.00 0.00 57.88 58.09 1s3s h LEU 306 Cb 1.19 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 42.09 1s3s h LEU 306 CO 0.32 0.62 0.25 -0.90 -0.34 0.00 0.00 178.44 178.39 1s3s n ASP 307 N -4.63 0.38 -0.03 1.25 5.68 -1.26 0.16 116.55 118.10 1s3s n ASP 307 Ca -0.02 0.59 0.15 0.00 -0.50 0.00 0.00 54.79 55.01 1s3s n ASP 307 Cb 0.21 -0.56 0.84 0.00 -1.14 0.00 0.00 41.12 40.48 1s3s n ASP 307 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1s3s n ALA 308 N -1.60 2.62 0.00 2.12 0.00 -1.05 -3.67 120.51 118.93 1s3s n ALA 308 Ca -0.01 -0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.24 1s3s n ALA 308 Cb 0.27 -1.48 0.00 0.00 0.00 0.00 0.00 19.45 18.24 1s3s n ALA 308 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1s3s n ILE 309 N -1.05 0.00 -3.17 0.00 5.41 0.12 -4.80 119.36 115.86 1s3s n ILE 309 Ca 0.20 -0.00 -0.19 0.00 1.00 0.00 0.00 62.75 63.75 1s3s n ILE 309 Cb 0.18 0.13 -0.04 0.00 -0.71 0.00 0.00 39.64 39.20 1s3s n ILE 309 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1s3s n ALA 310 N -0.31 2.26 -1.92 -1.39 0.00 -0.72 -4.13 120.51 114.30 1s3s n ALA 310 Ca 0.00 -3.51 -0.29 0.00 0.00 0.00 0.00 53.44 49.64 1s3s n ALA 310 Cb 0.00 -0.90 0.14 0.00 0.00 0.00 0.00 19.45 18.69 1s3s n ALA 310 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1s3s s PRO 311 N -2.36 1.28 0.95 0.00 0.04 -1.24 0.54 135.00 134.21 1s3s s PRO 311 Ca 0.40 -0.20 -0.12 0.00 0.04 0.00 0.00 61.00 61.12 1s3s s PRO 311 Cb 0.32 -1.91 0.16 0.00 0.04 0.00 0.00 34.50 33.11 1s3s s PRO 311 CO -0.09 -2.01 1.09 0.15 0.04 0.00 0.00 177.00 176.18 1s3s s LYS 312 N -5.72 0.79 0.48 4.56 1.02 -1.03 -3.78 119.74 116.07 1s3s s LYS 312 Ca 0.68 0.81 0.32 0.00 0.02 0.00 0.00 55.97 57.81 1s3s s LYS 312 Cb -0.07 -1.76 1.48 0.00 -0.52 0.00 0.00 37.83 36.96 1s3s s LYS 312 CO 0.51 -2.56 1.97 0.00 -0.92 0.00 0.00 175.35 174.35 1s3s h ARG 313 N -1.78 0.00 -0.65 1.68 2.47 -1.94 -2.43 114.38 111.73 1s3s h ARG 313 Ca -0.52 0.00 0.06 0.00 -1.26 0.00 0.00 59.98 58.27 1s3s h ARG 313 Cb 1.30 0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 29.58 1s3s h ARG 313 CO 0.54 0.00 0.43 1.49 0.56 0.00 0.00 179.97 182.99 1s3s h GLU 314 N 0.00 0.63 -1.31 0.04 4.57 -2.00 -3.04 114.58 113.47 1s3s h GLU 314 Ca 0.00 -0.04 -0.51 0.00 -1.18 0.00 0.00 59.36 57.63 1s3s h GLU 314 Cb 0.32 -0.14 -0.41 0.00 -0.16 0.00 0.00 28.75 28.35 1s3s h GLU 314 CO 0.00 0.42 -0.89 1.63 -1.18 0.00 0.00 179.01 178.99 1s3s n LYS 315 N -4.48 2.68 -4.17 1.92 4.76 -0.92 -5.06 118.16 112.90 1s3s n LYS 315 Ca 0.09 -4.08 -0.23 0.00 -2.87 0.00 0.00 58.31 51.22 1s3s n LYS 315 Cb 0.23 -1.92 -0.17 0.00 -1.84 0.00 0.00 35.03 31.34 1s3s n LYS 315 CO 0.00 0.00 0.00 -0.08 -1.37 0.00 0.00 177.40 175.95 1s3s s THR 316 N -4.71 0.77 -0.54 -0.18 -1.32 -1.15 -4.83 115.64 103.68 1s3s s THR 316 Ca 0.41 -0.21 -0.16 0.00 -1.21 0.00 0.00 61.69 60.52 1s3s s THR 316 Cb 0.42 -0.78 0.13 0.00 -1.51 0.00 0.00 72.50 70.76 1s3s s THR 316 CO -0.11 0.29 0.49 -1.00 -2.21 0.00 0.00 174.62 172.09 1s3s s HIS 317 N 1.15 3.25 0.00 9.09 0.09 -1.26 -5.00 115.29 122.62 1s3s s HIS 317 Ca -0.07 -1.27 0.00 0.00 -0.00 0.00 0.00 55.06 53.72 1s3s s HIS 317 Cb -0.14 -3.76 0.00 0.00 -0.00 0.00 0.00 32.58 28.68 1s3s s HIS 317 CO -0.01 -1.01 0.00 0.41 -0.00 0.00 0.00 174.74 174.13 1s3s n GLY 318 N 5.24 0.00 6.68 -2.22 0.00 -1.26 -4.25 105.19 109.38 1s3s n GLY 318 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.88 1s3s n GLY 318 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1s3s n GLU 319 N 0.00 0.00 0.05 1.61 0.00 -1.26 -0.06 120.64 120.98 1s3s n GLU 319 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 57.16 57.24 1s3s n GLU 319 Cb 0.00 0.00 0.36 0.00 0.00 0.00 0.00 31.44 31.80 1s3s n GLU 319 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.13 177.41 1s3s n VAL 320 N 0.00 1.01 -0.11 3.84 0.31 -1.26 -1.54 118.33 120.58 1s3s n VAL 320 Ca 0.00 0.28 -0.11 0.00 -0.01 0.00 0.00 64.34 64.49 1s3s n VAL 320 Cb 0.00 -1.12 -0.03 0.00 -0.91 0.00 0.00 33.84 31.78 1s3s n VAL 320 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 1s3s h GLU 321 N 0.00 0.60 0.00 5.55 4.81 -0.65 0.30 114.58 125.19 1s3s h GLU 321 Ca 0.00 -0.23 -0.05 0.00 -0.13 0.00 0.00 59.36 58.96 1s3s h GLU 321 Cb 0.26 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.60 1s3s h GLU 321 CO 0.00 0.78 -0.52 0.00 -0.73 0.00 0.00 179.01 178.54 1s3s h ARG 322 N 0.37 0.00 -0.16 1.92 3.08 -0.88 -3.25 114.38 115.46 1s3s h ARG 322 Ca 0.08 0.00 -0.12 0.00 0.07 0.00 0.00 59.98 60.01 1s3s h ARG 322 Cb 0.56 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.61 1s3s h ARG 322 CO 0.03 0.16 -0.37 -0.09 -1.07 0.00 0.00 179.97 178.63 1s3s h ARG 323 N 0.00 0.53 -0.47 0.04 2.43 -1.02 -2.36 114.38 113.53 1s3s h ARG 323 Ca -0.02 -0.36 -0.02 0.00 -0.81 0.00 0.00 59.98 58.77 1s3s h ARG 323 Cb 1.17 0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 30.74 1s3s h ARG 323 CO 0.02 0.97 0.20 0.82 -1.51 0.00 0.00 179.97 180.48 1s3s h ILE 324 N 0.17 1.20 0.35 1.20 2.04 -1.03 0.37 117.51 121.81 1s3s h ILE 324 Ca -0.00 -0.60 -0.01 0.00 1.00 0.00 0.00 64.86 65.25 1s3s h ILE 324 Cb 0.97 0.72 -0.01 0.00 -0.74 0.00 0.00 36.82 37.76 1s3s h ILE 324 CO 0.08 0.23 -0.27 0.58 0.00 0.00 0.00 178.15 178.77 1s3s h VAL 325 N 0.62 0.43 -0.66 1.67 2.07 -1.59 0.14 116.25 118.93 1s3s h VAL 325 Ca 0.16 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.76 1s3s h VAL 325 Cb 0.17 0.43 -0.07 0.00 -1.52 0.00 0.00 31.29 30.30 1s3s h VAL 325 CO -0.02 0.00 0.32 0.28 0.02 0.00 0.00 177.57 178.17 1s3s h SER 326 N -0.63 0.41 -0.89 0.57 0.02 -1.19 0.38 113.55 112.22 1s3s h SER 326 Ca -0.03 0.06 0.18 0.00 -0.84 0.00 0.00 61.79 61.16 1s3s h SER 326 Cb 0.55 -0.01 -0.11 0.00 0.14 0.00 0.00 62.40 62.97 1s3s h SER 326 CO -0.01 0.24 0.45 -0.61 -1.14 0.00 0.00 176.83 175.77 1s3s h GLN 327 N 0.55 0.55 0.30 3.45 5.75 0.68 0.36 115.11 126.74 1s3s h GLN 327 Ca 0.32 -0.03 -0.01 0.00 -0.15 0.00 0.00 58.65 58.77 1s3s h GLN 327 Cb 0.32 -0.12 0.00 0.00 1.07 0.00 0.00 27.48 28.75 1s3s h GLN 327 CO -0.25 0.36 -0.14 1.25 -2.65 0.00 0.00 178.83 177.40 1s3s h LEU 328 N 0.57 -0.34 -0.55 -2.39 5.85 0.24 -2.06 115.31 116.63 1s3s h LEU 328 Ca 0.51 -0.16 0.10 0.00 0.84 0.00 0.00 57.88 59.18 1s3s h LEU 328 Cb 0.84 0.09 -0.11 0.00 0.37 0.00 0.00 40.66 41.84 1s3s h LEU 328 CO -0.42 -0.01 -0.31 -0.07 -0.34 0.00 0.00 178.44 177.28 1s3s h LEU 329 N -0.69 -1.08 -0.50 2.25 3.38 -0.03 -0.65 115.31 117.99 1s3s h LEU 329 Ca -0.04 0.21 0.07 0.00 0.09 0.00 0.00 57.88 58.21 1s3s h LEU 329 Cb 0.48 0.54 -0.06 0.00 0.09 0.00 0.00 40.66 41.71 1s3s h LEU 329 CO 0.07 -0.30 0.17 0.74 0.09 0.00 0.00 178.44 179.21 1s3s h THR 330 N -0.17 0.82 -0.90 0.22 2.02 -0.93 -2.31 112.91 111.66 1s3s h THR 330 Ca 0.23 -0.12 0.12 0.00 0.77 0.00 0.00 66.41 67.40 1s3s h THR 330 Cb 0.54 0.44 -0.08 0.00 -1.74 0.00 0.00 68.15 67.31 1s3s h THR 330 CO -0.64 0.06 0.53 -0.07 0.37 0.00 0.00 175.52 175.77 1s3s h LEU 331 N 0.34 0.75 0.77 2.58 3.38 -0.39 0.54 115.31 123.29 1s3s h LEU 331 Ca 0.24 0.06 -0.04 0.00 0.09 0.00 0.00 57.88 58.23 1s3s h LEU 331 Cb 0.27 -0.09 0.01 0.00 0.09 0.00 0.00 40.66 40.94 1s3s h LEU 331 CO -0.25 0.40 -0.37 0.24 0.09 0.00 0.00 178.44 178.54 1s3s h MET 332 N 0.84 -1.00 -0.65 1.13 2.86 -0.86 -2.76 114.93 114.49 1s3s h MET 332 Ca 0.45 0.07 0.17 0.00 -2.06 0.00 0.00 59.70 58.33 1s3s h MET 332 Cb 0.48 0.23 -0.03 0.00 0.06 0.00 0.00 31.60 32.33 1s3s h MET 332 CO -0.28 -0.65 0.46 -0.44 1.06 0.00 0.00 176.91 177.06 1s3s h ASP 333 N -1.19 0.12 0.45 1.22 3.32 -1.18 0.21 116.42 119.37 1s3s h ASP 333 Ca -0.11 0.01 0.00 0.00 0.02 0.00 0.00 57.03 56.95 1s3s h ASP 333 Cb 0.81 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 40.34 1s3s h ASP 333 CO 0.17 0.06 0.00 0.61 -1.72 0.00 0.00 179.24 178.36 1s3s n GLY 334 N -1.62 -1.02 3.68 2.75 0.00 0.16 -4.73 105.19 104.41 1s3s n GLY 334 Ca 0.13 -0.09 -0.43 0.00 0.00 0.00 0.00 46.02 45.63 1s3s n GLY 334 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1s3s s LEU 335 N -2.65 4.21 -0.12 0.99 1.43 0.74 -5.00 118.68 118.27 1s3s s LEU 335 Ca 0.18 1.54 -0.22 0.00 -1.03 0.00 0.00 54.13 54.60 1s3s s LEU 335 Cb 0.14 -3.55 -0.03 0.00 0.03 0.00 0.00 46.19 42.77 1s3s s LEU 335 CO 0.33 -0.54 0.64 -0.54 0.23 0.00 0.00 176.35 176.46 1s3s s LYS 336 N 2.45 4.35 0.63 1.70 -0.14 -1.26 -4.94 119.74 122.53 1s3s s LYS 336 Ca 0.48 0.72 0.22 0.00 -1.36 0.00 0.00 55.97 56.04 1s3s s LYS 336 Cb -0.18 -3.49 1.09 0.00 -1.68 0.00 0.00 37.83 33.57 1s3s s LYS 336 CO 0.15 -0.02 1.59 -0.56 -0.76 0.00 0.00 175.35 175.75 1s3s h GLN 337 N 6.98 0.00 -0.02 1.68 3.07 -1.96 0.40 115.11 125.26 1s3s h GLN 337 Ca -0.38 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.36 1s3s h GLN 337 Cb 1.17 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.73 1s3s h GLN 337 CO 0.76 0.00 0.00 0.54 0.09 0.00 0.00 178.83 180.22 1s3s n ARG 338 N -3.09 1.37 0.07 0.06 3.00 -1.26 -3.63 116.66 113.18 1s3s n ARG 338 Ca 0.06 -0.55 0.12 0.00 -0.01 0.00 0.00 57.85 57.48 1s3s n ARG 338 Cb 0.82 -1.47 0.47 0.00 0.00 0.00 0.00 32.46 32.28 1s3s n ARG 338 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1s3s n ALA 339 N -0.32 2.08 -3.63 7.54 0.00 0.14 -4.92 120.51 121.40 1s3s n ALA 339 Ca 0.20 -0.02 -0.22 0.00 0.00 0.00 0.00 53.44 53.40 1s3s n ALA 339 Cb 0.24 -1.42 0.06 0.00 0.00 0.00 0.00 19.45 18.33 1s3s n ALA 339 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1s3s n HIS 340 N -1.97 -2.31 -4.90 0.00 8.25 -1.24 -4.70 115.22 108.35 1s3s n HIS 340 Ca 0.05 0.93 -0.27 0.00 -0.26 0.00 0.00 57.72 58.17 1s3s n HIS 340 Cb 0.33 -4.70 -0.16 0.00 1.12 0.00 0.00 29.99 26.58 1s3s n HIS 340 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1s3s s VAL 341 N -3.42 1.51 -0.05 1.59 1.01 -1.26 -1.55 120.40 118.23 1s3s s VAL 341 Ca 0.26 -0.78 0.06 0.00 0.00 0.00 0.00 61.98 61.52 1s3s s VAL 341 Cb -0.12 -1.28 -0.01 0.00 0.00 0.00 0.00 36.38 34.97 1s3s s VAL 341 CO 0.77 0.43 -0.23 -0.63 0.00 0.00 0.00 175.10 175.44 1s3s s ILE 342 N -0.12 1.86 -0.15 2.22 1.01 -0.85 -4.85 121.20 120.31 1s3s s ILE 342 Ca -0.01 -0.96 -0.05 0.00 0.00 0.00 0.00 60.65 59.63 1s3s s ILE 342 Cb -0.10 -1.57 -0.03 0.00 0.01 0.00 0.00 42.46 40.76 1s3s s ILE 342 CO 0.01 0.52 0.01 -0.69 0.00 0.00 0.00 174.94 174.79 1s3s s VAL 343 N -0.16 4.31 -0.13 2.92 1.01 0.27 -1.98 120.40 126.64 1s3s s VAL 343 Ca -0.02 -0.22 0.03 0.00 0.00 0.00 0.00 61.98 61.77 1s3s s VAL 343 Cb -0.12 -2.90 0.00 0.00 0.00 0.00 0.00 36.38 33.36 1s3s s VAL 343 CO 0.03 0.50 -0.22 -0.04 0.00 0.00 0.00 175.10 175.37 1s3s s MET 344 N 0.15 3.05 -0.01 2.72 -1.94 0.15 0.30 119.30 123.72 1s3s s MET 344 Ca 0.01 -0.85 0.02 0.00 -1.71 0.00 0.00 55.69 53.16 1s3s s MET 344 Cb -0.13 -2.40 -0.00 0.00 2.01 0.00 0.00 34.83 34.31 1s3s s MET 344 CO 0.02 0.07 -0.08 0.00 -0.01 0.00 0.00 175.02 175.02 1s3s s ALA 345 N 0.62 0.71 -0.13 3.03 0.00 -0.72 0.13 121.76 125.40 1s3s s ALA 345 Ca -0.12 -0.33 0.01 0.00 0.00 0.00 0.00 51.96 51.53 1s3s s ALA 345 Cb -0.16 -0.22 -0.01 0.00 0.00 0.00 0.00 23.12 22.73 1s3s s ALA 345 CO 0.03 0.15 -0.17 0.00 0.00 0.00 0.00 175.76 175.77 1s3s s ALA 346 N -0.05 2.46 0.00 0.00 0.00 -0.88 -0.24 121.76 123.06 1s3s s ALA 346 Ca 0.01 -0.97 0.00 0.00 0.00 0.00 0.00 51.96 51.00 1s3s s ALA 346 Cb -0.05 -1.12 0.00 0.00 0.00 0.00 0.00 23.12 21.95 1s3s s ALA 346 CO -0.00 0.15 0.00 -2.37 0.00 0.00 0.00 175.76 173.54 1s3s n THR 347 N 3.73 0.00 -0.06 0.00 5.66 -0.06 -2.39 114.28 121.16 1s3s n THR 347 Ca -0.19 0.00 -0.03 0.00 -3.05 0.00 0.00 64.05 60.78 1s3s n THR 347 Cb 0.52 0.00 -0.13 0.00 -1.55 0.00 0.00 70.33 69.17 1s3s n THR 347 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 175.07 172.61 1s3s n ASN 348 N -1.45 0.97 -3.57 1.09 5.03 -1.26 -3.16 115.26 112.90 1s3s n ASN 348 Ca 0.00 0.00 -0.06 0.00 0.87 0.00 0.00 54.58 55.39 1s3s n ASN 348 Cb 0.00 1.16 -0.02 0.00 -1.02 0.00 0.00 39.78 39.90 1s3s n ASN 348 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1s3s s ARG 349 N -2.63 0.46 0.25 3.52 1.70 -1.26 -2.53 118.95 118.46 1s3s s ARG 349 Ca -0.08 -0.16 -0.08 0.00 -0.47 0.00 0.00 55.73 54.95 1s3s s ARG 349 Cb 0.07 0.21 0.44 0.00 -0.57 0.00 0.00 34.95 35.10 1s3s s ARG 349 CO 0.69 -0.20 1.61 -1.35 -1.08 0.00 0.00 175.30 174.96 1s3s h PRO 350 N 2.01 0.04 -0.85 3.89 0.11 -1.96 -2.20 132.00 133.04 1s3s h PRO 350 Ca -0.13 -0.00 0.22 0.00 0.11 0.00 0.00 66.00 66.19 1s3s h PRO 350 Cb 1.19 -0.01 -0.14 0.00 0.11 0.00 0.00 31.00 32.15 1s3s h PRO 350 CO 0.25 0.03 0.20 -0.91 -0.21 0.00 0.00 178.00 177.36 1s3s h ASN 351 N 0.04 -0.03 0.42 -2.05 -0.26 -2.03 -2.89 115.58 108.79 1s3s h ASN 351 Ca 0.43 0.19 -0.01 0.00 -0.56 0.00 0.00 56.30 56.35 1s3s h ASN 351 Cb 0.73 0.26 -0.02 0.00 -1.06 0.00 0.00 38.32 38.23 1s3s h ASN 351 CO -0.79 -0.13 -0.43 0.28 -1.06 0.00 0.00 177.43 175.30 1s3s h SER 352 N 0.21 -1.18 -4.18 5.81 0.02 -1.79 -3.41 113.55 109.03 1s3s h SER 352 Ca 0.52 0.10 -0.53 0.00 -0.84 0.00 0.00 61.79 61.04 1s3s h SER 352 Cb 1.00 0.39 0.14 0.00 0.14 0.00 0.00 62.40 64.08 1s3s h SER 352 CO -0.63 -0.58 0.39 -0.63 -1.14 0.00 0.00 176.83 174.23 1s3s s ILE 353 N -5.94 2.54 -0.01 3.27 -1.09 -1.09 -2.45 121.20 116.43 1s3s s ILE 353 Ca -0.17 0.26 -0.30 0.00 -2.23 0.00 0.00 60.65 58.21 1s3s s ILE 353 Cb 0.05 -2.82 -0.03 0.00 -1.58 0.00 0.00 42.46 38.09 1s3s s ILE 353 CO 0.62 -0.14 0.98 -0.62 -1.23 0.00 0.00 174.94 174.55 1s3s s ASP 354 N -2.16 7.35 0.54 3.58 2.15 0.19 -3.98 116.67 124.35 1s3s s ASP 354 Ca 0.72 1.64 0.39 0.00 0.43 0.00 0.00 52.55 55.74 1s3s s ASP 354 Cb -0.27 -2.57 1.59 0.00 -0.30 0.00 0.00 42.92 41.37 1s3s s ASP 354 CO 0.44 -0.28 1.76 -0.65 -0.17 0.00 0.00 175.17 176.27 1s3s h PRO 355 N 6.84 0.00 0.00 4.34 0.11 -1.90 -0.07 132.00 141.32 1s3s h PRO 355 Ca -0.40 -0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.71 1s3s h PRO 355 Cb 1.21 -0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.32 1s3s h PRO 355 CO 0.76 0.00 -0.00 0.00 -0.21 0.00 0.00 178.00 178.56 1s3s h ALA 356 N 1.34 1.00 0.00 -0.75 0.00 -1.98 -1.75 119.26 117.11 1s3s h ALA 356 Ca 0.63 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.52 1s3s h ALA 356 Cb 2.54 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 20.33 1s3s h ALA 356 CO -0.01 0.00 -0.13 -0.07 0.00 0.00 0.00 179.25 179.04 1s3s h LEU 357 N 0.00 0.00 -0.23 0.00 3.38 -1.40 -2.99 115.31 114.07 1s3s h LEU 357 Ca -0.00 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.89 1s3s h LEU 357 Cb 0.18 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 1s3s h LEU 357 CO 0.00 0.13 -0.36 0.03 0.09 0.00 0.00 178.44 178.33 1s3s h ARG 358 N 0.00 0.00 -5.43 1.13 2.47 -1.50 -0.94 114.38 110.11 1s3s h ARG 358 Ca -0.00 0.00 -0.70 0.00 -1.26 0.00 0.00 59.98 58.02 1s3s h ARG 358 Cb 0.72 0.00 0.05 0.00 -1.65 0.00 0.00 29.97 29.09 1s3s h ARG 358 CO 0.02 0.36 -0.01 -2.13 0.56 0.00 0.00 179.97 178.77 1s3s n ARG 359 N -3.24 0.00 -0.18 0.04 0.63 -1.13 -4.24 116.66 108.54 1s3s n ARG 359 Ca 0.02 0.00 0.10 0.00 -0.92 0.00 0.00 57.85 57.05 1s3s n ARG 359 Cb 0.64 -1.31 0.19 0.00 0.45 0.00 0.00 32.46 32.43 1s3s n ARG 359 CO 0.00 0.00 0.00 1.19 -2.51 0.00 0.00 177.63 176.31 1s3s n PHE 360 N 1.21 0.39 1.78 -0.14 3.01 -1.26 0.91 117.46 123.36 1s3s n PHE 360 Ca 0.18 0.62 0.15 0.00 1.01 0.00 0.00 57.45 59.40 1s3s n PHE 360 Cb 0.09 -0.92 0.85 0.00 -0.01 0.00 0.00 39.48 39.49 1s3s n PHE 360 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1s3s n GLY 361 N -1.23 -0.95 0.00 1.37 0.00 -1.26 -4.41 105.19 98.71 1s3s n GLY 361 Ca 0.14 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.98 1s3s n GLY 361 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1s3s n ARG 362 N -1.03 0.00 -2.47 1.61 1.74 0.26 -4.72 116.66 112.05 1s3s n ARG 362 Ca 0.21 0.00 -0.43 0.00 -0.77 0.00 0.00 57.85 56.86 1s3s n ARG 362 Cb 0.11 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.56 1s3s n ARG 362 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 1s3s n PHE 363 N 0.00 3.47 1.03 -1.55 3.72 -0.36 -2.19 117.46 121.58 1s3s n PHE 363 Ca 0.00 -2.93 0.14 0.00 -0.05 0.00 0.00 57.45 54.60 1s3s n PHE 363 Cb 0.00 -2.03 0.57 0.00 -0.94 0.00 0.00 39.48 37.07 1s3s n PHE 363 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 1s3s n ASP 364 N 4.42 0.09 -4.24 4.37 5.68 -1.19 -4.43 116.55 121.26 1s3s n ASP 364 Ca 0.40 0.32 -0.34 0.00 -0.50 0.00 0.00 54.79 54.67 1s3s n ASP 364 Cb 0.38 -0.36 -0.15 0.00 -1.14 0.00 0.00 41.12 39.85 1s3s n ASP 364 CO 0.00 0.00 0.00 -0.13 -1.33 0.00 0.00 177.20 175.74 1s3s s ARG 365 N -2.97 3.22 -0.07 0.11 3.00 -0.90 -5.05 118.95 116.30 1s3s s ARG 365 Ca 0.15 -0.71 0.05 0.00 0.00 0.00 0.00 55.73 55.22 1s3s s ARG 365 Cb 0.19 -2.81 -0.01 0.00 0.00 0.00 0.00 34.95 32.32 1s3s s ARG 365 CO 0.55 -0.18 -0.23 -1.21 0.00 0.00 0.00 175.30 174.23 1s3s s GLU 366 N 1.34 2.66 -0.13 3.54 2.02 -1.26 0.19 118.70 127.06 1s3s s GLU 366 Ca 0.04 -0.87 0.02 0.00 0.02 0.00 0.00 54.97 54.18 1s3s s GLU 366 Cb -0.14 -2.23 -0.00 0.00 0.10 0.00 0.00 34.13 31.86 1s3s s GLU 366 CO -0.07 0.36 -0.19 0.08 0.02 0.00 0.00 175.26 175.47 1s3s s VAL 367 N -0.11 2.40 -0.52 2.63 1.01 0.12 -4.93 120.40 121.01 1s3s s VAL 367 Ca -0.05 -0.88 -0.20 0.00 0.00 0.00 0.00 61.98 60.85 1s3s s VAL 367 Cb -0.14 -1.97 0.06 0.00 0.00 0.00 0.00 36.38 34.32 1s3s s VAL 367 CO 0.04 0.54 0.69 -0.62 0.00 0.00 0.00 175.10 175.75 1s3s s ASP 368 N 0.60 6.24 -1.04 3.32 -1.08 -1.26 -2.27 116.67 121.18 1s3s s ASP 368 Ca -0.11 -0.82 -0.03 0.00 -0.52 0.00 0.00 52.55 51.08 1s3s s ASP 368 Cb -0.16 -2.32 0.31 0.00 -1.46 0.00 0.00 42.92 39.29 1s3s s ASP 368 CO 0.03 -0.97 1.49 -0.38 0.52 0.00 0.00 175.17 175.86 1s3s n ILE 369 N 5.73 5.28 0.00 4.11 5.41 -0.76 -4.95 119.36 134.18 1s3s n ILE 369 Ca -0.05 -5.91 0.00 0.00 1.00 0.00 0.00 62.75 57.79 1s3s n ILE 369 Cb 0.46 -1.98 0.00 0.00 -0.71 0.00 0.00 39.64 37.41 1s3s n ILE 369 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1s3s n GLY 370 N 1.04 -2.79 3.80 7.39 0.00 -1.26 -4.57 105.19 108.80 1s3s n GLY 370 Ca 0.30 -0.94 -0.38 0.00 0.00 0.00 0.00 46.02 45.00 1s3s n GLY 370 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1s3s s ILE 371 N -0.23 4.53 0.52 -0.61 -4.36 -1.26 -4.92 121.20 114.87 1s3s s ILE 371 Ca 0.00 1.43 -0.22 0.00 -0.26 0.00 0.00 60.65 61.61 1s3s s ILE 371 Cb 0.00 -3.98 -0.07 0.00 1.25 0.00 0.00 42.46 39.66 1s3s s ILE 371 CO 0.00 0.43 1.17 -2.65 0.24 0.00 0.00 174.94 174.13 1s3s n PRO 372 N 1.33 1.44 -3.12 0.37 -0.02 -1.26 -5.04 135.00 128.69 1s3s n PRO 372 Ca -0.06 0.53 -0.20 0.00 -2.02 0.00 0.00 63.50 61.75 1s3s n PRO 372 Cb 0.50 -2.34 0.05 0.00 -0.02 0.00 0.00 33.50 31.69 1s3s n PRO 372 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1s3s n ASP 373 N -0.50 2.21 -0.16 2.55 5.68 -1.26 -4.70 116.55 120.36 1s3s n ASP 373 Ca 0.11 -2.58 -0.11 0.00 -0.50 0.00 0.00 54.79 51.71 1s3s n ASP 373 Cb 0.44 -0.32 -0.07 0.00 -1.14 0.00 0.00 41.12 40.03 1s3s n ASP 373 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1s3s h ALA 374 N 0.26 -0.54 0.27 2.12 0.00 -1.96 0.22 119.26 119.63 1s3s h ALA 374 Ca -0.28 0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.68 1s3s h ALA 374 Cb 1.22 1.02 -0.03 0.00 0.00 0.00 0.00 17.79 20.00 1s3s h ALA 374 CO 0.41 -0.93 -0.46 1.15 0.00 0.00 0.00 179.25 179.42 1s3s h THR 375 N -0.32 0.00 -0.57 0.00 2.02 -1.95 -2.46 112.91 109.64 1s3s h THR 375 Ca 0.13 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.40 1s3s h THR 375 Cb 0.58 0.00 -0.07 0.00 -1.74 0.00 0.00 68.15 66.92 1s3s h THR 375 CO -0.63 0.00 0.18 1.23 0.37 0.00 0.00 175.52 176.67 1s3s h GLY 376 N -0.78 0.76 0.04 2.16 0.00 -1.78 -1.71 103.07 101.76 1s3s h GLY 376 Ca -0.03 -0.08 0.12 0.00 0.00 0.00 0.00 47.33 47.34 1s3s h GLY 376 CO -0.16 -0.04 0.01 3.21 0.00 0.00 0.00 176.54 179.56 1s3s h ARG 377 N 0.34 0.13 0.18 4.80 3.08 -0.33 -1.58 114.38 120.99 1s3s h ARG 377 Ca 0.29 -0.01 0.01 0.00 0.07 0.00 0.00 59.98 60.34 1s3s h ARG 377 Cb 0.37 -0.03 -0.04 0.00 0.08 0.00 0.00 29.97 30.35 1s3s h ARG 377 CO -0.32 0.08 -0.50 1.25 -1.07 0.00 0.00 179.97 179.41 1s3s h LEU 378 N 0.13 -1.48 -0.99 3.04 7.12 -0.85 -1.21 115.31 121.07 1s3s h LEU 378 Ca 0.30 0.15 0.33 0.00 0.13 0.00 0.00 57.88 58.79 1s3s h LEU 378 Cb 0.47 0.54 -0.16 0.00 -0.53 0.00 0.00 40.66 40.98 1s3s h LEU 378 CO -0.48 -0.56 0.50 -0.33 -0.13 0.00 0.00 178.44 177.44 1s3s h GLU 379 N -0.77 0.22 -0.26 1.25 5.08 -0.95 0.19 114.58 119.33 1s3s h GLU 379 Ca -0.01 -0.01 -0.09 0.00 -1.00 0.00 0.00 59.36 58.24 1s3s h GLU 379 Cb 0.76 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.96 1s3s h GLU 379 CO -0.24 0.14 -0.20 0.82 -1.00 0.00 0.00 179.01 178.53 1s3s h ILE 380 N 0.22 1.31 -0.50 3.13 2.04 -0.42 -2.48 117.51 120.81 1s3s h ILE 380 Ca 0.74 -1.34 0.00 0.00 1.00 0.00 0.00 64.86 65.25 1s3s h ILE 380 Cb 1.72 1.60 -0.02 0.00 -0.74 0.00 0.00 36.82 39.37 1s3s h ILE 380 CO -0.66 0.42 0.32 -0.07 0.00 0.00 0.00 178.15 178.16 1s3s h LEU 381 N 0.33 0.58 -0.38 1.44 3.38 0.31 -0.67 115.31 120.30 1s3s h LEU 381 Ca 0.05 -0.02 -0.17 0.00 0.09 0.00 0.00 57.88 57.83 1s3s h LEU 381 Cb 0.75 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 41.35 1s3s h LEU 381 CO 0.05 0.43 -0.50 1.56 0.09 0.00 0.00 178.44 180.08 1s3s h GLN 382 N 0.69 0.83 -0.49 1.13 4.20 -1.05 -2.79 115.11 117.62 1s3s h GLN 382 Ca 0.18 -0.50 -0.10 0.00 0.06 0.00 0.00 58.65 58.29 1s3s h GLN 382 Cb -0.06 0.05 -0.02 0.00 0.30 0.00 0.00 27.48 27.75 1s3s h GLN 382 CO -0.04 1.13 -0.10 0.82 -0.67 0.00 0.00 178.83 179.97 1s3s h ILE 383 N 0.65 1.26 -0.20 2.54 2.04 -0.94 -1.84 117.51 121.02 1s3s h ILE 383 Ca 0.03 -1.21 0.00 0.00 1.00 0.00 0.00 64.86 64.68 1s3s h ILE 383 Cb 1.09 0.99 0.00 0.00 -0.74 0.00 0.00 36.82 38.16 1s3s h ILE 383 CO 0.11 0.42 0.00 1.41 0.00 0.00 0.00 178.15 180.09 1s3s n HIS 384 N -4.15 0.68 0.00 1.37 8.25 -0.31 -3.50 115.22 117.55 1s3s n HIS 384 Ca 0.02 -0.24 0.00 0.00 -0.26 0.00 0.00 57.72 57.24 1s3s n HIS 384 Cb 0.38 -0.22 0.00 0.00 1.12 0.00 0.00 29.99 31.27 1s3s n HIS 384 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 1s3s n THR 385 N 0.21 0.00 0.07 1.59 -2.24 -1.04 -4.82 114.28 108.06 1s3s n THR 385 Ca 0.09 -0.09 0.03 0.00 -2.27 0.00 0.00 64.05 61.81 1s3s n THR 385 Cb 0.54 0.65 0.14 0.00 -2.10 0.00 0.00 70.33 69.57 1s3s n THR 385 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 1s3s n LYS 386 N -0.35 0.04 0.00 -0.78 2.85 -0.72 0.25 118.16 119.44 1s3s n LYS 386 Ca 0.00 0.39 0.06 0.00 -1.05 0.00 0.00 58.31 57.71 1s3s n LYS 386 Cb 0.00 -1.91 0.05 0.00 -0.65 0.00 0.00 35.03 32.52 1s3s n LYS 386 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 1s3s n ASN 387 N -1.60 1.94 -4.47 -5.58 4.13 -1.26 -4.67 115.26 103.76 1s3s n ASN 387 Ca -0.00 -1.47 -0.28 0.00 1.68 0.00 0.00 54.58 54.50 1s3s n ASN 387 Cb 0.30 0.03 -0.11 0.00 -1.54 0.00 0.00 39.78 38.46 1s3s n ASN 387 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1s3s s MET 388 N -1.03 1.68 -0.86 3.52 0.23 0.14 -1.14 119.30 121.84 1s3s s MET 388 Ca 0.14 -1.32 -0.24 0.00 -1.03 0.00 0.00 55.69 53.24 1s3s s MET 388 Cb 0.10 -2.01 0.06 0.00 -1.53 0.00 0.00 34.83 31.45 1s3s s MET 388 CO 0.16 0.45 1.28 0.21 -2.03 0.00 0.00 175.02 175.08 1s3s s LYS 389 N -2.37 3.39 -0.21 3.16 2.20 -1.26 -4.99 119.74 119.66 1s3s s LYS 389 Ca 0.19 -0.88 -0.29 0.00 -0.36 0.00 0.00 55.97 54.63 1s3s s LYS 389 Cb -0.09 -4.74 0.01 0.00 -1.51 0.00 0.00 37.83 31.49 1s3s s LYS 389 CO 0.10 -2.07 1.05 -0.51 -0.36 0.00 0.00 175.35 173.56 1s3s s LEU 390 N 4.77 4.12 0.98 5.43 1.43 -1.26 -1.36 118.68 132.79 1s3s s LEU 390 Ca 0.37 1.41 -0.16 0.00 -1.03 0.00 0.00 54.13 54.72 1s3s s LEU 390 Cb -0.06 -3.54 -0.07 0.00 0.03 0.00 0.00 46.19 42.55 1s3s s LEU 390 CO 0.01 -0.66 -0.35 0.00 0.23 0.00 0.00 176.35 175.58 1s3s n ALA 391 N 6.22 -4.38 0.22 4.21 0.00 0.53 -4.83 120.51 122.49 1s3s n ALA 391 Ca 0.12 -0.71 0.11 0.00 0.00 0.00 0.00 53.44 52.95 1s3s n ALA 391 Cb 0.46 -1.39 0.45 0.00 0.00 0.00 0.00 19.45 18.97 1s3s n ALA 391 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1s3s h ASP 392 N -1.25 0.00 0.17 0.00 5.19 -1.95 -2.72 116.42 115.87 1s3s h ASP 392 Ca -0.44 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.97 1s3s h ASP 392 Cb 1.30 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.81 1s3s h ASP 392 CO 0.28 0.20 -0.02 -0.90 -3.12 0.00 0.00 179.24 175.68 1s3s n ASP 393 N -3.33 0.24 -4.60 6.45 5.75 -1.26 -4.77 116.55 115.03 1s3s n ASP 393 Ca 0.00 -0.81 -0.43 0.00 -0.01 0.00 0.00 54.79 53.54 1s3s n ASP 393 Cb 0.44 -0.07 -0.02 0.00 -1.03 0.00 0.00 41.12 40.43 1s3s n ASP 393 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1s3s s VAL 394 N -2.19 3.91 -1.09 2.12 1.01 -1.03 -4.45 120.40 118.69 1s3s s VAL 394 Ca 0.40 0.92 -0.09 0.00 0.00 0.00 0.00 61.98 63.21 1s3s s VAL 394 Cb 0.21 -4.23 0.27 0.00 0.00 0.00 0.00 36.38 32.63 1s3s s VAL 394 CO 0.40 -0.79 1.08 -0.62 0.00 0.00 0.00 175.10 175.17 1s3s s ASP 395 N 3.91 7.22 0.57 3.32 -1.08 -1.26 -4.91 116.67 124.44 1s3s s ASP 395 Ca 0.60 -3.56 0.26 0.00 -0.52 0.00 0.00 52.55 49.34 1s3s s ASP 395 Cb -0.13 -2.19 1.59 0.00 -1.46 0.00 0.00 42.92 40.73 1s3s s ASP 395 CO 0.32 -0.30 2.14 -0.07 0.52 0.00 0.00 175.17 177.79 1s3s h LEU 396 N 6.69 0.00 -0.78 -1.34 3.38 -1.99 0.12 115.31 121.39 1s3s h LEU 396 Ca 0.17 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.05 1s3s h LEU 396 Cb 0.88 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.62 1s3s h LEU 396 CO 0.99 0.00 -0.43 -0.08 0.09 0.00 0.00 178.44 179.02 1s3s h GLU 397 N 0.00 0.00 -0.04 1.13 4.81 -1.97 0.21 114.58 118.73 1s3s h GLU 397 Ca 0.06 0.00 -0.09 0.00 -0.13 0.00 0.00 59.36 59.21 1s3s h GLU 397 Cb 0.32 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.70 1s3s h GLU 397 CO -0.00 0.43 -0.31 0.37 -0.73 0.00 0.00 179.01 178.76 1s3s h GLN 398 N 0.00 0.27 0.02 1.92 4.15 -1.21 -1.73 115.11 118.53 1s3s h GLN 398 Ca -0.00 -0.25 0.02 0.00 0.77 0.00 0.00 58.65 59.19 1s3s h GLN 398 Cb 1.00 0.06 -0.03 0.00 0.21 0.00 0.00 27.48 28.71 1s3s h GLN 398 CO 0.06 0.92 -0.18 0.28 -1.93 0.00 0.00 178.83 177.97 1s3s h VAL 399 N -0.29 0.57 -0.56 2.39 2.07 -1.13 -1.09 116.25 118.22 1s3s h VAL 399 Ca -0.03 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.58 1s3s h VAL 399 Cb 1.00 0.57 -0.03 0.00 -1.52 0.00 0.00 31.29 31.31 1s3s h VAL 399 CO 0.06 0.00 0.38 0.00 0.02 0.00 0.00 177.57 178.03 1s3s h ALA 400 N 0.60 2.00 -0.44 1.67 0.00 -0.60 -2.36 119.26 120.13 1s3s h ALA 400 Ca 0.05 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.86 1s3s h ALA 400 Cb 0.37 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1s3s h ALA 400 CO -0.16 -0.12 -0.07 -0.91 0.00 0.00 0.00 179.25 177.99 1s3s h ASN 401 N 0.40 0.82 -0.35 0.00 2.35 -0.27 -3.18 115.58 115.35 1s3s h ASN 401 Ca 0.26 -0.34 0.00 0.00 -0.55 0.00 0.00 56.30 55.66 1s3s h ASN 401 Cb 0.49 -0.22 0.00 0.00 0.05 0.00 0.00 38.32 38.64 1s3s h ASN 401 CO -0.07 0.97 0.00 -1.84 -1.65 0.00 0.00 177.43 174.84 1s3s n GLU 402 N -4.32 2.31 -1.37 0.81 0.28 -0.75 -4.02 120.64 113.58 1s3s n GLU 402 Ca -0.00 -1.46 -0.19 0.00 -0.16 0.00 0.00 57.16 55.34 1s3s n GLU 402 Cb 0.35 -1.53 0.11 0.00 1.43 0.00 0.00 31.44 31.80 1s3s n GLU 402 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 177.13 177.22 1s3s n THR 403 N 0.50 2.81 -1.82 3.84 -2.24 -1.12 -5.04 114.28 111.21 1s3s n THR 403 Ca 0.13 -3.31 -0.42 0.00 -2.27 0.00 0.00 64.05 58.19 1s3s n THR 403 Cb 0.48 -0.81 -0.02 0.00 -2.10 0.00 0.00 70.33 67.88 1s3s n THR 403 CO 0.00 0.00 0.00 -1.38 -0.57 0.00 0.00 175.07 173.12 1s3s s HIS 404 N -3.51 2.89 0.00 4.78 -3.43 -1.26 -2.28 115.29 112.48 1s3s s HIS 404 Ca 0.52 0.66 0.00 0.00 -0.80 0.00 0.00 55.06 55.44 1s3s s HIS 404 Cb 0.43 -4.03 0.00 0.00 -1.43 0.00 0.00 32.58 27.55 1s3s s HIS 404 CO 0.01 -3.64 0.00 0.41 -2.00 0.00 0.00 174.74 169.52 1s3s n GLY 405 N 2.98 2.94 3.76 -1.38 0.00 -1.26 -5.05 105.19 107.17 1s3s n GLY 405 Ca 0.11 -0.37 -0.33 0.00 0.00 0.00 0.00 46.02 45.43 1s3s n GLY 405 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1s3s s HIS 406 N -2.07 2.46 0.44 1.61 4.02 -0.97 -4.94 115.29 115.84 1s3s s HIS 406 Ca 0.00 1.57 0.07 0.00 1.02 0.00 0.00 55.06 57.72 1s3s s HIS 406 Cb 0.00 -3.23 -0.03 0.00 -1.02 0.00 0.00 32.58 28.30 1s3s s HIS 406 CO 0.00 -1.93 0.27 0.14 1.02 0.00 0.00 174.74 174.24 1s3s s VAL 407 N -2.32 2.27 0.29 -0.90 -7.23 -1.26 -4.34 120.40 106.91 1s3s s VAL 407 Ca 0.68 -1.56 0.04 0.00 -1.81 0.00 0.00 61.98 59.33 1s3s s VAL 407 Cb -0.22 -2.83 0.30 0.00 0.56 0.00 0.00 36.38 34.19 1s3s s VAL 407 CO 0.44 0.00 1.67 1.23 -0.31 0.00 0.00 175.10 178.13 1s3s h GLY 408 N 1.18 1.50 1.00 2.32 0.00 -1.85 0.20 103.07 107.42 1s3s h GLY 408 Ca -0.41 -0.11 0.01 0.00 0.00 0.00 0.00 47.33 46.81 1s3s h GLY 408 CO 0.64 -0.33 0.32 0.00 0.00 0.00 0.00 176.54 177.17 1s3s h ALA 409 N 1.75 0.62 -0.11 3.60 0.00 -1.62 -0.74 119.26 122.75 1s3s h ALA 409 Ca 0.57 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.47 1s3s h ALA 409 Cb 1.14 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.71 1s3s h ALA 409 CO -0.59 0.06 -0.05 -0.44 0.00 0.00 0.00 179.25 178.23 1s3s h ASP 410 N 0.66 -0.16 -0.14 0.00 3.32 -0.93 -2.06 116.42 117.11 1s3s h ASP 410 Ca 0.18 0.04 0.01 0.00 0.02 0.00 0.00 57.03 57.28 1s3s h ASP 410 Cb -0.07 0.09 -0.02 0.00 0.22 0.00 0.00 39.33 39.55 1s3s h ASP 410 CO -0.04 -0.06 0.04 -0.07 -1.72 0.00 0.00 179.24 177.39 1s3s h LEU 411 N -0.03 0.04 -1.61 1.55 3.38 -1.15 0.15 115.31 117.64 1s3s h LEU 411 Ca 0.06 0.02 0.06 0.00 0.09 0.00 0.00 57.88 58.11 1s3s h LEU 411 Cb 0.12 0.01 -0.03 0.00 0.09 0.00 0.00 40.66 40.85 1s3s h LEU 411 CO -0.13 0.04 0.36 0.00 0.09 0.00 0.00 178.44 178.80 1s3s h ALA 412 N 1.09 1.89 0.06 1.53 0.00 -0.89 -1.08 119.26 121.87 1s3s h ALA 412 Ca 0.06 -0.02 -0.28 0.00 0.00 0.00 0.00 54.91 54.67 1s3s h ALA 412 Cb 0.04 -0.12 0.02 0.00 0.00 0.00 0.00 17.79 17.74 1s3s h ALA 412 CO -0.07 0.01 -1.14 0.00 0.00 0.00 0.00 179.25 178.06 1s3s h ALA 413 N 1.71 0.07 -0.79 0.00 0.00 -0.85 -2.57 119.26 116.83 1s3s h ALA 413 Ca 0.23 -0.73 0.12 0.00 0.00 0.00 0.00 54.91 54.53 1s3s h ALA 413 Cb 0.32 0.08 -0.08 0.00 0.00 0.00 0.00 17.79 18.10 1s3s h ALA 413 CO -0.06 0.70 0.41 1.25 0.00 0.00 0.00 179.25 181.54 1s3s h LEU 414 N 0.34 0.51 -0.65 0.00 5.85 0.43 0.12 115.31 121.90 1s3s h LEU 414 Ca -0.16 0.08 -0.13 0.00 0.84 0.00 0.00 57.88 58.51 1s3s h LEU 414 Cb 1.80 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 42.81 1s3s h LEU 414 CO 0.22 0.26 -0.32 0.00 -0.34 0.00 0.00 178.44 178.26 1s3s h SER 416 N 0.60 0.93 0.06 0.00 0.02 -0.63 -2.03 113.55 112.51 1s3s h SER 416 Ca 0.07 -0.21 -0.10 0.00 -0.84 0.00 0.00 61.79 60.71 1s3s h SER 416 Cb 0.83 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 63.12 1s3s h SER 416 CO 0.07 0.89 -0.33 -0.33 -1.14 0.00 0.00 176.83 176.00 1s3s h GLU 417 N 0.92 0.38 -0.27 3.45 4.39 -0.68 -1.18 114.58 121.59 1s3s h GLU 417 Ca 0.20 -0.16 -0.12 0.00 0.34 0.00 0.00 59.36 59.63 1s3s h GLU 417 Cb 0.30 -0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 28.93 1s3s h GLU 417 CO -0.01 0.67 -0.28 0.00 -1.16 0.00 0.00 179.01 178.23 1s3s h ALA 418 N 1.33 0.40 -0.05 3.43 0.00 -1.24 -0.36 119.26 122.77 1s3s h ALA 418 Ca 0.04 -0.40 -0.06 0.00 0.00 0.00 0.00 54.91 54.49 1s3s h ALA 418 Cb 0.74 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 1s3s h ALA 418 CO 0.06 0.41 -0.24 0.00 0.00 0.00 0.00 179.25 179.48 1s3s h ALA 419 N 0.69 1.52 0.09 0.00 0.00 -1.22 -1.62 119.26 118.72 1s3s h ALA 419 Ca 0.04 -0.24 -0.26 0.00 0.00 0.00 0.00 54.91 54.45 1s3s h ALA 419 Cb 0.85 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.58 1s3s h ALA 419 CO 0.07 0.35 -1.19 -0.07 0.00 0.00 0.00 179.25 178.42 1s3s h LEU 420 N 0.07 0.31 -0.60 0.00 3.38 -1.03 -2.14 115.31 115.31 1s3s h LEU 420 Ca 0.01 -0.33 -0.02 0.00 0.09 0.00 0.00 57.88 57.62 1s3s h LEU 420 Cb 0.47 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 41.09 1s3s h LEU 420 CO 0.03 1.26 0.28 -0.61 0.09 0.00 0.00 178.44 179.50 1s3s h GLN 421 N 0.05 0.87 0.37 1.13 5.75 -0.66 0.44 115.11 123.06 1s3s h GLN 421 Ca -0.10 -0.13 -0.02 0.00 -0.15 0.00 0.00 58.65 58.25 1s3s h GLN 421 Cb 1.92 -0.15 0.00 0.00 1.07 0.00 0.00 27.48 30.32 1s3s h GLN 421 CO 0.18 0.71 -0.18 0.00 -2.65 0.00 0.00 178.83 176.89 1s3s h ALA 422 N 1.12 -0.50 -0.95 3.38 0.00 -1.31 -1.09 119.26 119.90 1s3s h ALA 422 Ca 0.21 -0.16 0.10 0.00 0.00 0.00 0.00 54.91 55.06 1s3s h ALA 422 Cb 0.13 0.19 -0.08 0.00 0.00 0.00 0.00 17.79 18.03 1s3s h ALA 422 CO -0.02 -0.70 0.59 0.82 0.00 0.00 0.00 179.25 179.94 1s3s h ILE 423 N -0.67 0.95 -0.58 0.00 2.04 -1.08 0.10 117.51 118.28 1s3s h ILE 423 Ca -0.05 -0.33 0.00 0.00 1.00 0.00 0.00 64.86 65.48 1s3s h ILE 423 Cb 0.48 -0.11 -0.03 0.00 -0.74 0.00 0.00 36.82 36.42 1s3s h ILE 423 CO 0.08 0.18 0.37 0.03 0.00 0.00 0.00 178.15 178.81 1s3s h ARG 424 N 0.98 0.77 0.00 2.37 3.08 0.07 -1.65 114.38 119.99 1s3s h ARG 424 Ca 0.46 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.45 1s3s h ARG 424 Cb 0.39 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 30.27 1s3s h ARG 424 CO -0.24 0.52 0.00 1.63 -1.07 0.00 0.00 179.97 180.81 1s3s n LYS 425 N -4.67 0.00 0.21 0.04 5.02 0.18 -3.21 118.16 115.73 1s3s n LYS 425 Ca 0.04 0.44 0.18 0.00 -2.02 0.00 0.00 58.31 56.95 1s3s n LYS 425 Cb 0.03 -1.31 0.84 0.00 -0.02 0.00 0.00 35.03 34.57 1s3s n LYS 425 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 1s3s h LYS 426 N 0.00 0.00 -0.02 1.97 1.57 -1.15 -2.24 116.57 116.70 1s3s h LYS 426 Ca 0.00 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.61 1s3s h LYS 426 Cb 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 1s3s h LYS 426 CO 0.00 0.00 -0.77 0.00 -0.57 0.00 0.00 179.45 178.11 1s3s h MET 427 N 0.00 0.17 -1.01 3.15 -0.00 -1.37 -2.64 114.93 113.24 1s3s h MET 427 Ca 0.09 -0.16 0.23 0.00 -0.00 0.00 0.00 59.70 59.87 1s3s h MET 427 Cb 0.62 0.04 -0.12 0.00 -0.00 0.00 0.00 31.60 32.15 1s3s h MET 427 CO -0.00 0.86 0.61 0.38 -0.00 0.00 0.00 176.91 178.75 1s3s h ASP 428 N 0.10 0.69 -0.24 -0.10 2.03 -1.37 -0.83 116.42 116.71 1s3s h ASP 428 Ca -0.03 0.12 0.00 0.00 -0.73 0.00 0.00 57.03 56.39 1s3s h ASP 428 Cb 1.35 0.01 0.00 0.00 -0.83 0.00 0.00 39.33 39.86 1s3s h ASP 428 CO 0.11 0.15 0.00 0.00 -1.03 0.00 0.00 179.24 178.48 1s3s n LEU 429 N -4.83 3.73 -4.12 0.15 -0.00 -1.20 -5.00 117.00 105.73 1s3s n LEU 429 Ca 0.26 -3.00 -0.12 0.00 -0.00 0.00 0.00 56.01 53.15 1s3s n LEU 429 Cb 0.71 -0.53 -0.11 0.00 -0.00 0.00 0.00 43.42 43.49 1s3s n LEU 429 CO 0.19 0.68 -0.40 -0.51 -0.00 0.00 0.00 177.39 177.35 1s3s s ILE 430 N -2.79 0.65 0.13 1.47 2.07 -0.32 -5.11 121.20 117.30 1s3s s ILE 430 Ca 0.41 -1.53 -0.31 0.00 -1.41 0.00 0.00 60.65 57.81 1s3s s ILE 430 Cb 0.33 -1.18 -0.08 0.00 0.13 0.00 0.00 42.46 41.66 1s3s s ILE 430 CO 0.08 -0.63 1.32 -0.62 -1.91 0.00 0.00 174.94 173.19 1s3s s ASP 431 N -2.35 6.91 0.00 4.50 -1.08 -1.26 -4.73 116.67 118.66 1s3s s ASP 431 Ca 0.02 2.28 0.16 0.00 -0.52 0.00 0.00 52.55 54.49 1s3s s ASP 431 Cb -0.02 -2.59 0.43 0.00 -1.46 0.00 0.00 42.92 39.27 1s3s s ASP 431 CO -0.02 -0.57 1.35 0.18 0.52 0.00 0.00 175.17 176.63 1s3s n LEU 432 N 3.50 3.30 -3.51 -1.34 4.77 -1.26 -4.95 117.00 117.50 1s3s n LEU 432 Ca 0.09 -1.92 -0.25 0.00 -0.03 0.00 0.00 56.01 53.90 1s3s n LEU 432 Cb 0.43 -0.32 -0.01 0.00 -2.33 0.00 0.00 43.42 41.20 1s3s n LEU 432 CO 0.58 0.81 -0.03 -0.62 -1.33 0.00 0.00 177.39 176.80 1s3s n GLU 433 N 1.00 -3.46 0.00 3.23 -0.58 -1.26 -4.32 120.64 115.26 1s3s n GLU 433 Ca 0.17 0.46 0.00 0.00 -0.42 0.00 0.00 57.16 57.37 1s3s n GLU 433 Cb 0.50 -5.18 0.00 0.00 -0.57 0.00 0.00 31.44 26.19 1s3s n GLU 433 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 1s3s n ASP 434 N -2.36 0.00 -0.02 1.62 8.00 -1.26 0.34 116.55 122.87 1s3s n ASP 434 Ca 0.00 0.00 -0.07 0.00 0.71 0.00 0.00 54.79 55.43 1s3s n ASP 434 Cb 0.53 0.00 -0.05 0.00 -0.02 0.00 0.00 41.12 41.59 1s3s n ASP 434 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 1s3s h GLU 435 N 0.00 -0.24 -3.43 -1.24 4.39 -2.05 -3.42 114.58 108.58 1s3s h GLU 435 Ca 0.00 0.02 -0.25 0.00 0.34 0.00 0.00 59.36 59.47 1s3s h GLU 435 Cb 0.00 0.05 -0.31 0.00 -0.10 0.00 0.00 28.75 28.40 1s3s h GLU 435 CO 0.00 -0.16 -0.64 0.99 -1.16 0.00 0.00 179.01 178.03 1s3s s THR 436 N -4.26 -0.03 0.63 1.13 2.01 0.15 -5.15 115.64 110.12 1s3s s THR 436 Ca -0.07 0.12 -0.19 0.00 0.31 0.00 0.00 61.69 61.87 1s3s s THR 436 Cb 0.04 -0.15 -0.02 0.00 0.01 0.00 0.00 72.50 72.38 1s3s s THR 436 CO 0.29 0.05 1.31 -0.63 -0.69 0.00 0.00 174.62 174.95 1s3s s ILE 437 N 0.72 2.01 0.15 1.82 -1.09 -1.25 -4.61 121.20 118.95 1s3s s ILE 437 Ca -0.06 0.01 -0.08 0.00 -2.23 0.00 0.00 60.65 58.29 1s3s s ILE 437 Cb -0.08 -3.00 -0.06 0.00 -1.58 0.00 0.00 42.46 37.74 1s3s s ILE 437 CO -0.03 -0.00 0.43 -0.62 -1.23 0.00 0.00 174.94 173.49 1s3s s ASP 438 N -1.31 6.58 0.01 3.58 2.15 -1.26 -2.33 116.67 124.09 1s3s s ASP 438 Ca 0.81 0.75 -0.13 0.00 0.43 0.00 0.00 52.55 54.41 1s3s s ASP 438 Cb -0.38 -2.16 -0.07 0.00 -0.30 0.00 0.00 42.92 40.01 1s3s s ASP 438 CO 0.41 0.05 1.02 0.00 -0.17 0.00 0.00 175.17 176.48 1s3s h ALA 439 N 3.00 -0.95 -0.80 3.66 0.00 0.12 -3.07 119.26 121.21 1s3s h ALA 439 Ca -0.47 -0.10 0.15 0.00 0.00 0.00 0.00 54.91 54.49 1s3s h ALA 439 Cb 1.17 0.18 -0.06 0.00 0.00 0.00 0.00 17.79 19.09 1s3s h ALA 439 CO 0.70 -0.92 0.53 1.05 0.00 0.00 0.00 179.25 180.61 1s3s h GLU 440 N -0.55 0.48 0.03 0.00 9.09 -1.84 -1.67 114.58 120.12 1s3s h GLU 440 Ca -0.05 -0.03 0.02 0.00 0.05 0.00 0.00 59.36 59.36 1s3s h GLU 440 Cb 0.36 -0.11 -0.03 0.00 -1.65 0.00 0.00 28.75 27.32 1s3s h GLU 440 CO 0.08 0.32 -0.19 0.28 0.05 0.00 0.00 179.01 179.55 1s3s h VAL 441 N 0.49 0.56 0.00 -1.06 2.07 -1.94 0.57 116.25 116.94 1s3s h VAL 441 Ca 0.40 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.90 1s3s h VAL 441 Cb 0.83 0.56 -0.00 0.00 -1.52 0.00 0.00 31.29 31.16 1s3s h VAL 441 CO -0.15 0.00 -0.09 0.24 0.02 0.00 0.00 177.57 177.59 1s3s h MET 442 N -0.32 0.00 0.00 1.57 2.86 -1.23 -1.94 114.93 115.86 1s3s h MET 442 Ca 0.05 0.00 -0.13 0.00 -2.06 0.00 0.00 59.70 57.56 1s3s h MET 442 Cb 0.38 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.02 1s3s h MET 442 CO -0.16 0.09 -0.62 -0.97 1.06 0.00 0.00 176.91 176.32 1s3s h ASN 443 N 0.00 0.00 -0.00 1.22 -0.73 -0.36 -3.30 115.58 112.40 1s3s h ASN 443 Ca -0.00 0.00 -0.01 0.00 1.87 0.00 0.00 56.30 58.16 1s3s h ASN 443 Cb 0.28 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.87 1s3s h ASN 443 CO 0.01 0.62 -0.02 0.77 -0.37 0.00 0.00 177.43 178.44 1s3s h SER 444 N 0.00 0.02 -0.91 1.15 4.64 -0.17 -3.45 113.55 114.83 1s3s h SER 444 Ca -0.01 -0.66 -0.84 0.00 -0.47 0.00 0.00 61.79 59.81 1s3s h SER 444 Cb 1.41 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.50 1s3s h SER 444 CO 0.08 0.68 0.83 -0.11 -0.87 0.00 0.00 176.83 177.44 1s3s n LEU 445 N -4.75 1.29 -4.34 5.97 7.94 -1.08 -4.95 117.00 117.07 1s3s n LEU 445 Ca -0.09 1.08 -0.32 0.00 -1.11 0.00 0.00 56.01 55.57 1s3s n LEU 445 Cb 0.34 -0.92 -0.15 0.00 0.53 0.00 0.00 43.42 43.22 1s3s n LEU 445 CO 0.34 -0.78 -0.52 0.00 -1.11 0.00 0.00 177.39 175.32 1s3s s ALA 446 N 3.61 2.37 -0.37 1.96 0.00 -1.26 -4.49 121.76 123.58 1s3s s ALA 446 Ca 1.07 -1.01 -0.22 0.00 0.00 0.00 0.00 51.96 51.80 1s3s s ALA 446 Cb -1.44 -0.83 0.01 0.00 0.00 0.00 0.00 23.12 20.86 1s3s s ALA 446 CO 0.77 0.43 0.70 0.08 0.00 0.00 0.00 175.76 177.75 1s3s s VAL 447 N -0.26 4.81 0.39 0.00 1.01 -0.46 -4.78 120.40 121.10 1s3s s VAL 447 Ca 0.00 0.64 -0.14 0.00 0.00 0.00 0.00 61.98 62.49 1s3s s VAL 447 Cb -0.13 -4.16 -0.08 0.00 0.00 0.00 0.00 36.38 32.02 1s3s s VAL 447 CO 0.03 -0.41 0.80 0.42 0.00 0.00 0.00 175.10 175.93 1s3s s THR 448 N 2.91 4.69 -0.84 3.92 -4.23 -1.26 -0.35 115.64 120.48 1s3s s THR 448 Ca 0.27 0.87 0.03 0.00 -1.18 0.00 0.00 61.69 61.68 1s3s s THR 448 Cb -0.14 -3.68 0.03 0.00 1.34 0.00 0.00 72.50 70.06 1s3s s THR 448 CO 0.17 -0.40 1.06 0.80 -0.54 0.00 0.00 174.62 175.71 1s3s n MET 449 N -0.94 0.02 0.11 3.99 0.00 -1.26 -0.22 117.12 118.82 1s3s n MET 449 Ca 0.04 0.50 -0.21 0.00 -0.00 0.00 0.00 57.70 58.03 1s3s n MET 449 Cb 0.54 -1.59 -0.13 0.00 0.00 0.00 0.00 33.22 32.04 1s3s n MET 449 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 175.97 175.53 1s3s h ASP 450 N 0.00 0.73 0.29 6.12 5.19 -1.91 -2.63 116.42 124.20 1s3s h ASP 450 Ca 0.00 -0.72 -0.06 0.00 -0.62 0.00 0.00 57.03 55.63 1s3s h ASP 450 Cb 0.05 -0.23 -0.01 0.00 0.18 0.00 0.00 39.33 39.32 1s3s h ASP 450 CO 0.00 1.55 -0.26 0.44 -3.12 0.00 0.00 179.24 177.85 1s3s h ASP 451 N 0.18 0.00 0.59 6.45 3.32 -0.94 -0.72 116.42 125.31 1s3s h ASP 451 Ca -0.19 0.00 -0.19 0.00 0.02 0.00 0.00 57.03 56.67 1s3s h ASP 451 Cb 1.99 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 41.53 1s3s h ASP 451 CO 0.24 0.26 -0.86 -0.26 -1.72 0.00 0.00 179.24 176.90 1s3s h PHE 452 N 0.00 0.27 -0.44 4.55 -1.00 -1.51 -2.43 116.94 116.38 1s3s h PHE 452 Ca -0.00 -0.15 -0.08 0.00 2.81 0.00 0.00 57.97 60.55 1s3s h PHE 452 Cb 0.48 -0.03 -0.02 0.00 3.61 0.00 0.00 35.95 40.00 1s3s h PHE 452 CO 0.00 0.95 -0.03 0.00 -1.61 0.00 0.00 178.31 177.63 1s3s h ARG 453 N 0.10 0.79 -0.40 1.51 3.08 -0.92 -2.28 114.38 116.26 1s3s h ARG 453 Ca -0.04 -0.26 -0.06 0.00 0.07 0.00 0.00 59.98 59.69 1s3s h ARG 453 Cb 1.48 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 31.45 1s3s h ARG 453 CO 0.13 0.87 0.02 2.35 -1.07 0.00 0.00 179.97 182.27 1s3s h TRP 454 N 0.62 0.75 -0.60 3.04 7.01 -1.15 -2.41 115.95 123.21 1s3s h TRP 454 Ca 0.12 -0.12 0.02 0.00 2.11 0.00 0.00 58.89 61.02 1s3s h TRP 454 Cb 0.53 -0.20 -0.04 0.00 -2.10 0.00 0.00 29.16 27.36 1s3s h TRP 454 CO 0.04 0.75 0.37 0.00 -2.79 0.00 0.00 178.44 176.82 1s3s h ALA 455 N 0.90 0.77 0.00 2.65 0.00 -1.37 -0.51 119.26 121.70 1s3s h ALA 455 Ca 0.12 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 1s3s h ALA 455 Cb 0.44 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 1s3s h ALA 455 CO 0.02 0.12 -0.02 -0.07 0.00 0.00 0.00 179.25 179.29 1s3s h LEU 456 N 0.74 0.00 -0.09 0.00 3.38 -1.29 -1.86 115.31 116.19 1s3s h LEU 456 Ca 0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.21 1s3s h LEU 456 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1s3s h LEU 456 CO -0.09 0.02 -0.13 -1.20 0.09 0.00 0.00 178.44 177.12 1s3s n SER 457 N -3.14 0.27 -0.70 -0.43 7.64 -0.23 -5.11 113.62 111.91 1s3s n SER 457 Ca -0.01 -0.12 0.09 0.00 1.01 0.00 0.00 58.87 59.84 1s3s n SER 457 Cb 0.24 -0.18 0.07 0.00 -1.01 0.00 0.00 64.21 63.33 1s3s n SER 457 CO 0.00 0.00 0.00 1.67 -3.01 0.00 0.00 175.04 173.70