#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s3s h ASN 24 N 0.00 0.94 -1.12 2.55 -1.07 -1.95 -3.47 115.58 111.46 1s3s h ASN 24 Ca 0.00 -0.60 -0.85 0.00 0.07 0.00 0.00 56.30 54.93 1s3s h ASN 24 Cb 0.00 -0.27 0.01 0.00 -2.07 0.00 0.00 38.32 35.99 1s3s h ASN 24 CO 0.00 1.37 0.73 0.54 0.07 0.00 0.00 177.43 180.15 1s3s n ARG 25 N -3.99 0.25 -4.54 4.14 1.74 -1.25 -3.97 116.66 109.04 1s3s n ARG 25 Ca -0.06 0.09 -0.27 0.00 -0.77 0.00 0.00 57.85 56.84 1s3s n ARG 25 Cb 0.70 -1.63 -0.08 0.00 -1.02 0.00 0.00 32.46 30.42 1s3s n ARG 25 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1s3s s LEU 26 N 3.10 2.02 -0.20 0.55 1.43 -0.24 -4.93 118.68 120.40 1s3s s LEU 26 Ca 1.03 -1.69 -0.06 0.00 -1.03 0.00 0.00 54.13 52.38 1s3s s LEU 26 Cb -1.41 -0.16 -0.03 0.00 0.03 0.00 0.00 46.19 44.62 1s3s s LEU 26 CO 0.78 -0.94 0.04 -0.63 0.23 0.00 0.00 176.35 175.84 1s3s s ILE 27 N -3.17 4.36 -0.39 -0.59 -1.09 0.16 -2.15 121.20 118.34 1s3s s ILE 27 Ca 0.22 -0.17 -0.29 0.00 -2.23 0.00 0.00 60.65 58.18 1s3s s ILE 27 Cb 0.02 -2.99 0.01 0.00 -1.58 0.00 0.00 42.46 37.92 1s3s s ILE 27 CO 0.13 0.42 1.45 0.54 -1.23 0.00 0.00 174.94 176.25 1s3s s VAL 28 N 0.91 3.86 0.53 2.92 0.11 -0.32 0.34 120.40 128.76 1s3s s VAL 28 Ca 0.03 0.89 0.04 0.00 -2.93 0.00 0.00 61.98 60.01 1s3s s VAL 28 Cb -0.14 -4.13 0.02 0.00 -1.53 0.00 0.00 36.38 30.60 1s3s s VAL 28 CO 0.02 -0.69 0.26 -0.62 -3.33 0.00 0.00 175.10 170.75 1s3s s ASP 29 N 4.11 4.46 1.01 3.54 2.15 0.48 -0.25 116.67 132.17 1s3s s ASP 29 Ca 0.63 -1.38 -0.12 0.00 0.43 0.00 0.00 52.55 52.11 1s3s s ASP 29 Cb -0.15 0.43 0.19 0.00 -0.30 0.00 0.00 42.92 43.09 1s3s s ASP 29 CO 0.32 -1.00 1.08 -1.61 -0.17 0.00 0.00 175.17 173.78 1s3s s GLU 30 N -4.14 0.36 0.17 4.34 2.02 -1.26 -3.00 118.70 117.19 1s3s s GLU 30 Ca 0.25 0.80 0.03 0.00 0.02 0.00 0.00 54.97 56.06 1s3s s GLU 30 Cb -0.01 -1.71 -0.03 0.00 0.10 0.00 0.00 34.13 32.48 1s3s s GLU 30 CO 0.15 -2.85 0.30 0.00 0.02 0.00 0.00 175.26 172.88 1s3s s ALA 31 N -2.78 3.96 -0.16 5.21 0.00 -1.20 -3.66 121.76 123.12 1s3s s ALA 31 Ca 0.66 -1.06 -0.01 0.00 0.00 0.00 0.00 51.96 51.55 1s3s s ALA 31 Cb -0.21 -1.78 -0.10 0.00 0.00 0.00 0.00 23.12 21.03 1s3s s ALA 31 CO 0.59 0.49 -0.16 -0.89 0.00 0.00 0.00 175.76 175.79 1s3s n ILE 32 N -0.69 0.93 -3.13 0.00 2.08 -1.26 -4.82 119.36 112.47 1s3s n ILE 32 Ca -0.07 -0.33 -0.43 0.00 0.56 0.00 0.00 62.75 62.47 1s3s n ILE 32 Cb 0.54 -1.21 -0.06 0.00 -0.75 0.00 0.00 39.64 38.16 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 -5.77 6.25 0.00 4.38 3.84 -1.26 -4.92 114.94 117.46 1s3s s ASN 33 Ca -0.22 -0.74 0.05 0.00 0.21 0.00 0.00 52.86 52.15 1s3s s ASN 33 Cb 0.06 -2.31 0.29 0.00 -0.55 0.00 0.00 41.25 38.75 1s3s s ASN 33 CO 0.36 -0.88 0.66 -1.84 -2.79 0.00 0.00 177.10 172.60 1s3s n GLU 34 N 6.28 0.29 -2.36 0.43 -0.00 -1.26 -4.77 120.64 119.24 1s3s n GLU 34 Ca -0.05 0.00 -0.42 0.00 -0.00 0.00 0.00 57.16 56.69 1s3s n GLU 34 Cb 0.46 -1.26 -0.03 0.00 -0.00 0.00 0.00 31.44 30.62 1s3s n GLU 34 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.13 177.47 1s3s s ASP 35 N -1.86 6.98 0.19 -1.84 -1.08 -1.26 -4.94 116.67 112.85 1s3s s ASP 35 Ca 0.07 1.97 -0.14 0.00 -0.52 0.00 0.00 52.55 53.93 1s3s s ASP 35 Cb 0.03 -2.56 0.19 0.00 -1.46 0.00 0.00 42.92 39.12 1s3s s ASP 35 CO 0.06 -0.61 1.67 0.78 0.52 0.00 0.00 175.17 177.58 1s3s h ASN 36 N 7.46 -0.32 0.85 -0.34 -0.26 -1.95 -2.50 115.58 118.51 1s3s h ASN 36 Ca -0.37 0.14 0.00 0.00 -0.56 0.00 0.00 56.30 55.51 1s3s h ASN 36 Cb 1.18 0.26 0.00 0.00 -1.06 0.00 0.00 38.32 38.70 1s3s h ASN 36 CO 0.88 -0.12 0.00 0.28 -1.06 0.00 0.00 177.43 177.41 1s3s h SER 37 N 0.07 0.00 -2.99 5.81 0.02 -1.93 -3.44 113.55 111.09 1s3s h SER 37 Ca 0.26 0.00 -0.67 0.00 -0.84 0.00 0.00 61.79 60.53 1s3s h SER 37 Cb 0.40 0.00 -0.11 0.00 0.14 0.00 0.00 62.40 62.83 1s3s h SER 37 CO -0.47 0.00 -0.55 0.54 -1.14 0.00 0.00 176.83 175.20 1s3s s VAL 38 N -3.55 4.91 0.19 2.27 0.11 -0.94 0.04 120.40 123.42 1s3s s VAL 38 Ca 0.02 -0.05 0.10 0.00 -2.93 0.00 0.00 61.98 59.11 1s3s s VAL 38 Cb 0.09 -3.12 -0.04 0.00 -1.53 0.00 0.00 36.38 31.78 1s3s s VAL 38 CO 0.47 0.59 -0.20 0.68 -3.33 0.00 0.00 175.10 173.31 1s3s s VAL 39 N -0.98 2.05 0.24 2.04 -7.23 -0.06 -4.63 120.40 111.82 1s3s s VAL 39 Ca 0.15 -2.05 0.08 0.00 -1.81 0.00 0.00 61.98 58.35 1s3s s VAL 39 Cb -0.12 -2.00 -0.05 0.00 0.56 0.00 0.00 36.38 34.77 1s3s s VAL 39 CO 0.04 -0.30 -0.12 -0.44 -0.31 0.00 0.00 175.10 173.98 1s3s s SER 40 N -2.85 2.73 0.29 4.85 0.01 -0.71 -1.85 113.70 116.18 1s3s s SER 40 Ca 0.20 -1.08 -0.09 0.00 1.31 0.00 0.00 55.95 56.29 1s3s s SER 40 Cb -0.06 -0.16 0.00 0.00 0.21 0.00 0.00 66.02 66.01 1s3s s SER 40 CO 0.09 -0.21 0.49 -0.76 0.41 0.00 0.00 173.24 173.26 1s3s s LEU 41 N -3.38 0.59 0.19 2.44 1.43 -1.04 -1.36 118.68 117.55 1s3s s LEU 41 Ca 0.26 -1.19 -0.16 0.00 -1.03 0.00 0.00 54.13 52.01 1s3s s LEU 41 Cb 0.00 1.69 -0.08 0.00 0.03 0.00 0.00 46.19 47.84 1s3s s LEU 41 CO 0.09 -1.24 0.63 -0.94 0.23 0.00 0.00 176.35 175.12 1s3s s SER 42 N -3.11 6.92 0.19 2.29 1.04 -1.25 0.12 113.70 119.89 1s3s s SER 42 Ca 0.26 1.22 -0.22 0.00 0.48 0.00 0.00 55.95 57.69 1s3s s SER 42 Cb -0.01 -2.34 0.11 0.00 0.10 0.00 0.00 66.02 63.88 1s3s s SER 42 CO 0.14 0.06 1.58 -0.61 0.98 0.00 0.00 173.24 175.38 1s3s h GLN 43 N 3.43 -0.16 -0.72 4.02 5.75 -1.91 -0.69 115.11 124.83 1s3s h GLN 43 Ca -0.48 0.01 0.16 0.00 -0.15 0.00 0.00 58.65 58.19 1s3s h GLN 43 Cb 1.19 0.04 -0.13 0.00 1.07 0.00 0.00 27.48 29.65 1s3s h GLN 43 CO 0.66 -0.11 -0.04 -1.35 -2.65 0.00 0.00 178.83 175.34 1s3s h PRO 44 N -0.17 0.08 -0.79 -2.39 0.11 -1.95 0.00 132.00 126.90 1s3s h PRO 44 Ca 0.23 -0.00 0.01 0.00 0.11 0.00 0.00 66.00 66.35 1s3s h PRO 44 Cb 0.56 -0.02 -0.04 0.00 0.11 0.00 0.00 31.00 31.61 1s3s h PRO 44 CO -0.70 0.05 0.52 0.87 -0.21 0.00 0.00 178.00 178.53 1s3s h LYS 45 N 0.08 1.01 -0.41 1.05 1.79 -1.45 -0.51 116.57 118.14 1s3s h LYS 45 Ca 0.38 -0.06 -0.00 0.00 -2.18 0.00 0.00 60.65 58.79 1s3s h LYS 45 Cb 0.64 -0.23 -0.02 0.00 -1.58 0.00 0.00 32.23 31.04 1s3s h LYS 45 CO -0.65 0.67 0.25 0.52 -1.08 0.00 0.00 179.45 179.16 1s3s h MET 46 N 1.04 0.54 -0.01 3.15 2.86 -0.43 -1.28 114.93 120.80 1s3s h MET 46 Ca 0.29 -0.04 -0.00 0.00 -2.06 0.00 0.00 59.70 57.90 1s3s h MET 46 Cb -0.09 -0.12 -0.00 0.00 0.06 0.00 0.00 31.60 31.45 1s3s h MET 46 CO -0.07 0.37 0.00 -0.44 1.06 0.00 0.00 176.91 177.83 1s3s h ASP 47 N 0.55 0.02 -0.73 1.22 3.32 -0.17 0.23 116.42 120.87 1s3s h ASP 47 Ca 0.15 -0.21 0.06 0.00 0.02 0.00 0.00 57.03 57.04 1s3s h ASP 47 Cb -0.03 -0.01 -0.06 0.00 0.22 0.00 0.00 39.33 39.45 1s3s h ASP 47 CO -0.03 0.23 0.43 -0.08 -1.72 0.00 0.00 179.24 178.06 1s3s h GLU 48 N -0.19 0.76 -0.01 3.56 4.81 -0.55 -1.85 114.58 121.11 1s3s h GLU 48 Ca 0.00 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.19 1s3s h GLU 48 Cb 0.22 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.42 1s3s h GLU 48 CO -0.00 0.50 -0.01 1.28 -0.73 0.00 0.00 179.01 180.05 1s3s n LEU 49 N -4.73 0.99 -3.50 1.64 4.32 -0.56 -4.94 117.00 110.23 1s3s n LEU 49 Ca 0.10 -0.32 -0.20 0.00 -0.02 0.00 0.00 56.01 55.56 1s3s n LEU 49 Cb 0.17 -0.01 0.06 0.00 -1.62 0.00 0.00 43.42 42.02 1s3s n LEU 49 CO 0.30 0.17 0.00 0.00 -1.22 0.00 0.00 177.39 176.64 1s3s n GLN 50 N -0.24 -4.07 -4.31 3.23 1.13 0.52 -4.91 117.38 108.72 1s3s n GLN 50 Ca 0.20 0.72 -0.25 0.00 -1.94 0.00 0.00 57.00 55.74 1s3s n GLN 50 Cb 0.28 -5.38 -0.09 0.00 0.11 0.00 0.00 30.24 25.16 1s3s n GLN 50 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 1s3s s LEU 51 N -6.21 3.02 0.25 1.08 1.43 0.50 -5.03 118.68 113.72 1s3s s LEU 51 Ca 0.20 -0.66 0.08 0.00 -1.03 0.00 0.00 54.13 52.72 1s3s s LEU 51 Cb -0.04 -1.61 -0.05 0.00 0.03 0.00 0.00 46.19 44.51 1s3s s LEU 51 CO 0.78 0.05 -0.13 -0.36 0.23 0.00 0.00 176.35 176.92 1s3s s PHE 52 N -2.06 1.95 0.00 0.29 0.40 -1.26 -4.64 117.98 112.66 1s3s s PHE 52 Ca 0.28 -0.55 0.00 0.00 -0.60 0.00 0.00 56.93 56.06 1s3s s PHE 52 Cb -0.07 -0.97 0.00 0.00 0.51 0.00 0.00 43.02 42.48 1s3s s PHE 52 CO 0.17 0.43 0.48 -2.13 0.70 0.00 0.00 175.22 174.87 1s3s n ARG 53 N -0.52 0.00 0.00 0.44 3.00 -1.26 -1.26 116.66 117.06 1s3s n ARG 53 Ca -0.06 -0.17 0.00 0.00 -0.00 0.00 0.00 57.85 57.62 1s3s n ARG 53 Cb 0.61 -1.40 0.00 0.00 0.00 0.00 0.00 32.46 31.68 1s3s n ARG 53 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1s3s n GLY 54 N 2.98 0.18 3.73 5.14 0.00 -1.19 -4.98 105.19 111.06 1s3s n GLY 54 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 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 3.01 -4.72 1.61 8.00 -0.39 -4.60 116.55 119.46 1s3s n ASP 55 Ca 0.00 1.17 -0.40 0.00 0.71 0.00 0.00 54.79 56.28 1s3s n ASP 55 Cb 0.00 -1.54 -0.05 0.00 -0.02 0.00 0.00 41.12 39.52 1s3s n ASP 55 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1s3s s THR 56 N -1.14 5.01 0.26 -3.53 -4.23 -1.26 -2.28 115.64 108.46 1s3s s THR 56 Ca 0.57 1.46 0.08 0.00 -1.18 0.00 0.00 61.69 62.62 1s3s s THR 56 Cb -0.51 -4.04 -0.04 0.00 1.34 0.00 0.00 72.50 69.24 1s3s s THR 56 CO 0.61 0.27 0.12 0.68 -0.54 0.00 0.00 174.62 175.76 1s3s s VAL 57 N 0.66 4.04 -0.24 2.29 -7.23 0.25 -1.53 120.40 118.64 1s3s s VAL 57 Ca 0.37 -1.60 -0.01 0.00 -1.81 0.00 0.00 61.98 58.93 1s3s s VAL 57 Cb -0.18 -3.18 0.02 0.00 0.56 0.00 0.00 36.38 33.60 1s3s s VAL 57 CO 0.19 -0.36 -0.08 -0.22 -0.31 0.00 0.00 175.10 174.33 1s3s s LEU 58 N -3.78 3.06 0.11 1.32 2.96 0.14 -1.79 118.68 120.69 1s3s s LEU 58 Ca 0.32 -0.82 -0.06 0.00 -0.22 0.00 0.00 54.13 53.35 1s3s s LEU 58 Cb -0.07 -1.65 -0.05 0.00 0.50 0.00 0.00 46.19 44.92 1s3s s LEU 58 CO 0.23 -0.11 0.36 -0.76 -1.32 0.00 0.00 176.35 174.75 1s3s s LEU 59 N 1.33 4.30 -0.05 -0.68 1.43 0.28 -2.23 118.68 123.05 1s3s s LEU 59 Ca 0.01 0.61 0.02 0.00 -1.03 0.00 0.00 54.13 53.73 1s3s s LEU 59 Cb -0.16 -3.13 0.02 0.00 0.03 0.00 0.00 46.19 42.95 1s3s s LEU 59 CO -0.05 0.11 -0.09 -0.54 0.23 0.00 0.00 176.35 176.01 1s3s s LYS 60 N -2.36 1.28 0.00 1.70 1.02 0.05 -2.39 119.74 119.04 1s3s s LYS 60 Ca 0.37 -0.27 0.00 0.00 0.02 0.00 0.00 55.97 56.09 1s3s s LYS 60 Cb -0.13 -1.13 0.00 0.00 -0.52 0.00 0.00 37.83 36.06 1s3s s LYS 60 CO 0.22 -0.02 0.00 0.41 -0.92 0.00 0.00 175.35 175.04 1s3s n GLY 61 N 3.91 5.24 3.90 -3.33 0.00 -0.88 -1.84 105.19 112.19 1s3s n GLY 61 Ca -0.24 -1.50 -0.29 0.00 0.00 0.00 0.00 46.02 43.99 1s3s n GLY 61 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1s3s s LYS 62 N 2.37 2.20 -1.44 1.61 1.02 -0.81 -4.13 119.74 120.56 1s3s s LYS 62 Ca 0.00 0.10 -0.02 0.00 0.02 0.00 0.00 55.97 56.07 1s3s s LYS 62 Cb 0.00 -2.01 0.02 0.00 -0.52 0.00 0.00 37.83 35.32 1s3s s LYS 62 CO 0.00 -1.40 0.46 1.63 -0.92 0.00 0.00 175.35 175.12 1s3s n LYS 63 N -3.17 -3.29 -4.21 1.68 5.02 -1.26 -1.71 118.16 111.22 1s3s n LYS 63 Ca 0.08 0.40 -0.31 0.00 -2.02 0.00 0.00 58.31 56.46 1s3s n LYS 63 Cb 0.60 -4.59 -0.07 0.00 -0.02 0.00 0.00 35.03 30.95 1s3s n LYS 63 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1s3s n ARG 64 N -4.41 -1.92 -4.18 1.97 1.74 -1.26 -4.95 116.66 103.65 1s3s n ARG 64 Ca -0.26 0.23 -0.26 0.00 -0.77 0.00 0.00 57.85 56.78 1s3s n ARG 64 Cb 0.66 -4.13 -0.07 0.00 -1.02 0.00 0.00 32.46 27.90 1s3s n ARG 64 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 1s3s s ARG 65 N -7.05 2.50 0.10 5.56 0.52 -0.70 -5.03 118.95 114.85 1s3s s ARG 65 Ca 0.14 -1.07 -0.04 0.00 -0.52 0.00 0.00 55.73 54.23 1s3s s ARG 65 Cb -0.08 -2.41 -0.03 0.00 0.52 0.00 0.00 34.95 32.96 1s3s s ARG 65 CO 0.96 0.46 0.11 -1.21 0.02 0.00 0.00 175.30 175.63 1s3s s GLU 66 N -3.01 0.86 0.06 3.54 2.02 -1.26 -2.08 118.70 118.84 1s3s s GLU 66 Ca 0.28 -1.22 -0.14 0.00 0.02 0.00 0.00 54.97 53.92 1s3s s GLU 66 Cb -0.09 0.28 0.02 0.00 0.10 0.00 0.00 34.13 34.44 1s3s s GLU 66 CO 0.20 -0.25 0.31 0.00 0.02 0.00 0.00 175.26 175.53 1s3s s ALA 67 N -3.95 -0.67 -0.15 5.21 0.00 -1.01 -4.83 121.76 116.36 1s3s s ALA 67 Ca 0.14 -0.09 0.02 0.00 0.00 0.00 0.00 51.96 52.03 1s3s s ALA 67 Cb 0.06 0.41 0.01 0.00 0.00 0.00 0.00 23.12 23.60 1s3s s ALA 67 CO -0.05 -0.47 -0.22 0.08 0.00 0.00 0.00 175.76 175.11 1s3s s VAL 68 N -2.96 2.05 0.16 0.00 1.01 -1.26 -0.56 120.40 118.85 1s3s s VAL 68 Ca -0.02 -0.97 -0.01 0.00 0.00 0.00 0.00 61.98 60.98 1s3s s VAL 68 Cb 0.01 -1.82 -0.04 0.00 0.00 0.00 0.00 36.38 34.52 1s3s s VAL 68 CO -0.06 0.55 0.08 0.00 0.00 0.00 0.00 175.10 175.67 1s3s s ILE 70 N -4.06 4.82 -0.30 0.00 -1.09 0.11 0.86 121.20 121.53 1s3s s ILE 70 Ca 0.30 0.94 -0.01 0.00 -2.23 0.00 0.00 60.65 59.65 1s3s s ILE 70 Cb 0.07 -3.77 0.05 0.00 -1.58 0.00 0.00 42.46 37.23 1s3s s ILE 70 CO 0.06 0.32 -0.00 0.54 -1.23 0.00 0.00 174.94 174.63 1s3s s VAL 71 N -1.38 2.90 0.57 2.92 0.11 -0.97 -0.88 120.40 123.67 1s3s s VAL 71 Ca 0.36 -1.47 0.09 0.00 -2.93 0.00 0.00 61.98 58.03 1s3s s VAL 71 Cb -0.16 -2.70 0.08 0.00 -1.53 0.00 0.00 36.38 32.07 1s3s s VAL 71 CO 0.19 -0.14 0.75 -0.76 -3.33 0.00 0.00 175.10 171.81 1s3s s LEU 72 N 1.22 3.08 -0.04 2.54 1.43 -0.77 -3.15 118.68 122.99 1s3s s LEU 72 Ca -0.05 -0.87 -0.01 0.00 -1.03 0.00 0.00 54.13 52.18 1s3s s LEU 72 Cb -0.20 -1.62 -0.04 0.00 0.03 0.00 0.00 46.19 44.37 1s3s s LEU 72 CO -0.02 -1.30 0.02 -0.94 0.23 0.00 0.00 176.35 174.34 1s3s s SER 73 N -4.62 5.30 -0.02 2.29 1.04 -1.26 -2.50 113.70 113.92 1s3s s SER 73 Ca 0.59 0.10 -0.00 0.00 0.48 0.00 0.00 55.95 57.12 1s3s s SER 73 Cb -0.06 -1.47 0.03 0.00 0.10 0.00 0.00 66.02 64.63 1s3s s SER 73 CO 0.37 0.33 0.03 -0.62 0.98 0.00 0.00 173.24 174.33 1s3s s ASP 74 N -1.26 0.24 0.19 7.02 2.15 0.33 -4.84 116.67 120.50 1s3s s ASP 74 Ca 0.17 0.04 0.10 0.00 0.43 0.00 0.00 52.55 53.29 1s3s s ASP 74 Cb -0.12 -0.10 -0.05 0.00 -0.30 0.00 0.00 42.92 42.36 1s3s s ASP 74 CO 0.07 -0.14 1.37 -2.24 -0.17 0.00 0.00 175.17 174.06 1s3s h ASP 75 N 7.43 0.00 -0.03 -0.34 2.03 -1.98 -3.12 116.42 120.40 1s3s h ASP 75 Ca -0.42 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.88 1s3s h ASP 75 Cb 1.12 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.62 1s3s h ASP 75 CO 0.44 0.78 0.00 0.35 -1.03 0.00 0.00 179.24 179.79 1s3s n THR 76 N -3.34 0.03 -3.27 1.15 -2.24 -1.26 -4.78 114.28 100.57 1s3s n THR 76 Ca 0.01 -0.12 -0.38 0.00 -2.27 0.00 0.00 64.05 61.29 1s3s n THR 76 Cb 0.84 -0.06 -0.06 0.00 -2.10 0.00 0.00 70.33 68.95 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 0.38 7.30 0.24 0.00 0.01 -1.26 -4.40 113.70 115.97 1s3s s SER 78 Ca 0.28 2.23 -0.12 0.00 1.31 0.00 0.00 55.95 59.65 1s3s s SER 78 Cb -0.16 -2.62 0.33 0.00 0.21 0.00 0.00 66.02 63.78 1s3s s SER 78 CO 0.13 -0.12 1.58 0.44 0.41 0.00 0.00 173.24 175.67 1s3s h ASP 79 N 3.82 -0.99 0.39 2.44 3.32 -1.96 -0.83 116.42 122.61 1s3s h ASP 79 Ca -0.47 0.27 0.00 0.00 0.02 0.00 0.00 57.03 56.86 1s3s h ASP 79 Cb 1.21 0.59 0.00 0.00 0.22 0.00 0.00 39.33 41.36 1s3s h ASP 79 CO 0.67 -0.29 0.00 -1.84 -1.72 0.00 0.00 179.24 176.05 1s3s n GLU 80 N -5.54 0.58 -4.26 3.56 0.28 -1.26 -4.74 120.64 109.27 1s3s n GLU 80 Ca 0.12 0.00 -0.23 0.00 -0.16 0.00 0.00 57.16 56.89 1s3s n GLU 80 Cb 0.43 -1.50 -0.07 0.00 1.43 0.00 0.00 31.44 31.73 1s3s n GLU 80 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 177.13 177.12 1s3s s LYS 81 N -2.40 2.30 -0.04 3.44 1.02 -0.32 -0.67 119.74 123.07 1s3s s LYS 81 Ca 0.34 -1.45 0.03 0.00 0.02 0.00 0.00 55.97 54.90 1s3s s LYS 81 Cb 0.20 -2.15 0.01 0.00 -0.52 0.00 0.00 37.83 35.37 1s3s s LYS 81 CO 0.42 0.31 -0.11 -1.50 -0.92 0.00 0.00 175.35 173.56 1s3s s ILE 82 N -2.35 0.95 0.24 2.17 2.07 0.15 -4.62 121.20 119.81 1s3s s ILE 82 Ca 0.33 -0.43 -0.10 0.00 -1.41 0.00 0.00 60.65 59.04 1s3s s ILE 82 Cb -0.05 -0.86 -0.07 0.00 0.13 0.00 0.00 42.46 41.61 1s3s s ILE 82 CO 0.20 0.30 0.56 -0.13 -1.91 0.00 0.00 174.94 173.96 1s3s s ARG 83 N 0.36 3.80 -0.24 3.50 0.52 -0.46 -0.38 118.95 126.05 1s3s s ARG 83 Ca -0.07 0.28 -0.29 0.00 -0.52 0.00 0.00 55.73 55.13 1s3s s ARG 83 Cb -0.11 -2.64 0.17 0.00 0.52 0.00 0.00 34.95 32.89 1s3s s ARG 83 CO 0.02 0.31 1.21 0.00 0.02 0.00 0.00 175.30 176.86 1s3s s MET 84 N -2.85 0.28 0.61 3.54 0.23 -1.16 -1.73 119.30 118.21 1s3s s MET 84 Ca 0.48 0.08 -0.08 0.00 -1.03 0.00 0.00 55.69 55.13 1s3s s MET 84 Cb -0.11 0.13 -0.01 0.00 -1.53 0.00 0.00 34.83 33.31 1s3s s MET 84 CO 0.21 -0.08 0.96 -0.80 -2.03 0.00 0.00 175.02 173.27 1s3s s ASN 85 N -1.00 5.78 0.63 -1.18 -0.87 -1.26 -3.27 114.94 113.77 1s3s s ASN 85 Ca 0.05 0.98 0.31 0.00 -1.57 0.00 0.00 52.86 52.63 1s3s s ASN 85 Cb -0.01 -1.99 1.69 0.00 -0.02 0.00 0.00 41.25 40.93 1s3s s ASN 85 CO -0.04 -1.02 2.02 -0.09 -2.57 0.00 0.00 177.10 175.39 1s3s h ARG 86 N -0.26 0.00 0.60 -0.60 2.43 -1.97 -0.36 114.38 114.22 1s3s h ARG 86 Ca -0.45 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 58.69 1s3s h ARG 86 Cb 1.24 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 30.79 1s3s h ARG 86 CO 0.62 0.00 -0.29 0.28 -1.51 0.00 0.00 179.97 179.07 1s3s h VAL 87 N 0.00 0.34 -0.23 0.20 2.07 -1.93 -0.71 116.25 115.99 1s3s h VAL 87 Ca 0.07 -0.22 -0.03 0.00 0.82 0.00 0.00 66.70 67.34 1s3s h VAL 87 Cb 0.65 0.42 -0.01 0.00 -1.52 0.00 0.00 31.29 30.83 1s3s h VAL 87 CO -0.00 0.03 0.03 0.58 0.02 0.00 0.00 177.57 178.23 1s3s h VAL 88 N -0.96 1.23 -0.96 2.57 2.07 -1.61 -1.27 116.25 117.33 1s3s h VAL 88 Ca -0.08 -0.79 0.20 0.00 0.82 0.00 0.00 66.70 66.84 1s3s h VAL 88 Cb 0.66 1.30 -0.08 0.00 -1.52 0.00 0.00 31.29 31.65 1s3s h VAL 88 CO 0.14 0.25 0.61 -0.09 0.02 0.00 0.00 177.57 178.50 1s3s h ARG 89 N 0.19 0.57 0.11 1.57 2.43 -1.11 0.55 114.38 118.68 1s3s h ARG 89 Ca 0.07 -0.03 -0.26 0.00 -0.81 0.00 0.00 59.98 58.94 1s3s h ARG 89 Cb 0.34 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 29.77 1s3s h ARG 89 CO 0.01 0.38 -1.19 -0.91 -1.51 0.00 0.00 179.97 176.74 1s3s h ASN 90 N 0.59 0.42 0.20 -3.80 -0.26 -0.84 -0.44 115.58 111.45 1s3s h ASN 90 Ca 0.52 -0.43 -0.01 0.00 -0.56 0.00 0.00 56.30 55.82 1s3s h ASN 90 Cb 1.04 -0.14 -0.00 0.00 -1.06 0.00 0.00 38.32 38.16 1s3s h ASN 90 CO -0.27 1.32 -0.05 0.78 -1.06 0.00 0.00 177.43 178.16 1s3s h ASN 91 N 0.09 0.00 0.01 5.81 2.35 0.27 -1.90 115.58 122.21 1s3s h ASN 91 Ca -0.12 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.63 1s3s h ASN 91 Cb 1.91 0.00 0.00 0.00 0.05 0.00 0.00 38.32 40.28 1s3s h ASN 91 CO 0.20 0.05 -0.52 0.18 -1.65 0.00 0.00 177.43 175.68 1s3s n LEU 92 N -3.56 1.85 -1.42 1.61 4.77 -0.51 -4.53 117.00 115.21 1s3s n LEU 92 Ca -0.02 -0.69 -0.13 0.00 -0.03 0.00 0.00 56.01 55.14 1s3s n LEU 92 Cb 0.15 -0.01 -0.01 0.00 -2.33 0.00 0.00 43.42 41.22 1s3s n LEU 92 CO 0.27 0.35 -0.16 0.54 -1.33 0.00 0.00 177.39 177.06 1s3s n ARG 93 N -0.23 -1.00 -4.32 3.23 3.00 -0.71 -1.92 116.66 114.70 1s3s n ARG 93 Ca 0.09 0.64 -0.29 0.00 -0.01 0.00 0.00 57.85 58.27 1s3s n ARG 93 Cb 0.45 -4.83 -0.11 0.00 0.00 0.00 0.00 32.46 27.96 1s3s n ARG 93 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 1s3s s VAL 94 N -2.62 2.77 0.32 1.55 1.01 -0.20 -4.55 120.40 118.67 1s3s s VAL 94 Ca 0.00 -1.58 0.08 0.00 0.00 0.00 0.00 61.98 60.48 1s3s s VAL 94 Cb 0.00 -2.28 -0.04 0.00 0.00 0.00 0.00 36.38 34.07 1s3s s VAL 94 CO 0.00 0.07 0.18 -0.13 0.00 0.00 0.00 175.10 175.22 1s3s s ARG 95 N -2.21 2.54 0.04 2.72 1.81 -1.26 -4.27 118.95 118.31 1s3s s ARG 95 Ca 0.18 -1.39 -0.33 0.00 -1.72 0.00 0.00 55.73 52.47 1s3s s ARG 95 Cb -0.10 -2.31 -0.12 0.00 -0.45 0.00 0.00 34.95 31.97 1s3s s ARG 95 CO 0.10 0.17 1.82 1.28 -0.68 0.00 0.00 175.30 177.99 1s3s n LEU 96 N -1.19 3.65 0.00 2.53 4.77 -1.26 -2.61 117.00 122.88 1s3s n LEU 96 Ca -0.04 0.99 0.00 0.00 -0.03 0.00 0.00 56.01 56.93 1s3s n LEU 96 Cb 0.60 -1.45 0.00 0.00 -2.33 0.00 0.00 43.42 40.24 1s3s n LEU 96 CO 0.42 -0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.09 1s3s n GLY 97 N 4.18 0.61 3.42 -0.72 0.00 0.66 -5.01 105.19 108.33 1s3s n GLY 97 Ca 0.20 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.92 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 -2.60 -4.30 1.61 8.00 -1.07 -4.55 116.55 113.64 1s3s n ASP 98 Ca 0.00 -1.10 -0.27 0.00 0.71 0.00 0.00 54.79 54.13 1s3s n ASP 98 Cb 0.00 -1.00 -0.14 0.00 -0.02 0.00 0.00 41.12 39.96 1s3s n ASP 98 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 1s3s s VAL 99 N -2.77 1.88 0.24 2.53 -7.23 -1.26 -1.17 120.40 112.63 1s3s s VAL 99 Ca 0.70 -1.37 0.04 0.00 -1.81 0.00 0.00 61.98 59.54 1s3s s VAL 99 Cb -0.08 -1.64 -0.05 0.00 0.56 0.00 0.00 36.38 35.16 1s3s s VAL 99 CO 0.55 0.20 -0.02 0.27 -0.31 0.00 0.00 175.10 175.79 1s3s s ILE 100 N -0.89 1.16 -0.20 -0.62 -5.25 -0.91 -4.89 121.20 109.60 1s3s s ILE 100 Ca 0.09 -2.05 -0.04 0.00 -0.99 0.00 0.00 60.65 57.66 1s3s s ILE 100 Cb -0.09 -2.36 -0.01 0.00 2.95 0.00 0.00 42.46 42.94 1s3s s ILE 100 CO 0.03 -0.33 -0.04 -0.94 -1.79 0.00 0.00 174.94 171.87 1s3s s SER 101 N -3.33 4.45 -0.09 4.36 1.04 -0.77 -1.08 113.70 118.28 1s3s s SER 101 Ca 0.28 -0.32 -0.02 0.00 0.48 0.00 0.00 55.95 56.38 1s3s s SER 101 Cb 0.05 -1.75 -0.03 0.00 0.10 0.00 0.00 66.02 64.39 1s3s s SER 101 CO 0.09 0.03 0.01 -0.51 0.98 0.00 0.00 173.24 173.85 1s3s s ILE 102 N 1.17 4.41 -0.03 -1.02 2.07 -1.25 -0.77 121.20 125.77 1s3s s ILE 102 Ca 0.02 -0.22 -0.17 0.00 -1.41 0.00 0.00 60.65 58.87 1s3s s ILE 102 Cb -0.14 -2.86 0.03 0.00 0.13 0.00 0.00 42.46 39.62 1s3s s ILE 102 CO -0.00 0.60 0.38 0.00 -1.91 0.00 0.00 174.94 174.01 1s3s s GLN 103 N -0.91 0.72 0.42 3.50 -2.07 -0.95 -4.69 119.66 115.68 1s3s s GLN 103 Ca 0.14 -0.06 -0.26 0.00 -1.82 0.00 0.00 55.36 53.36 1s3s s GLN 103 Cb -0.11 0.32 -0.09 0.00 -1.09 0.00 0.00 33.01 32.04 1s3s s GLN 103 CO 0.03 -0.20 1.43 -2.14 -1.32 0.00 0.00 175.29 173.09 1s3s s PRO 104 N -1.18 3.85 -0.54 9.60 0.02 -1.26 -0.68 135.00 144.81 1s3s s PRO 104 Ca -0.12 2.43 0.06 0.00 0.02 0.00 0.00 61.00 63.39 1s3s s PRO 104 Cb -0.04 -2.77 0.22 0.00 0.02 0.00 0.00 34.50 31.93 1s3s s PRO 104 CO 0.05 -0.69 0.56 0.00 -0.33 0.00 0.00 177.00 176.59 1s3s n PRO 106 N 1.57 0.90 0.00 0.00 -0.04 -1.26 -3.68 135.00 132.49 1s3s n PRO 106 Ca 0.25 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.83 1s3s n PRO 106 Cb 0.45 -1.50 0.13 0.00 -0.04 0.00 0.00 33.50 32.53 1s3s n PRO 106 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1s3s n ASP 107 N -1.05 0.93 -4.73 3.54 5.68 -1.26 -4.96 116.55 114.71 1s3s n ASP 107 Ca 0.22 -0.75 -0.42 0.00 -0.50 0.00 0.00 54.79 53.35 1s3s n ASP 107 Cb 0.13 0.49 -0.03 0.00 -1.14 0.00 0.00 41.12 40.57 1s3s n ASP 107 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 1s3s s VAL 108 N -2.85 2.11 0.68 2.12 1.01 -1.24 -5.00 120.40 117.23 1s3s s VAL 108 Ca 0.13 0.08 0.02 0.00 0.00 0.00 0.00 61.98 62.21 1s3s s VAL 108 Cb 0.17 -3.05 0.12 0.00 0.00 0.00 0.00 36.38 33.62 1s3s s VAL 108 CO 0.71 0.01 0.94 -0.54 0.00 0.00 0.00 175.10 176.22 1s3s s LYS 109 N 0.62 1.82 -0.95 2.72 1.02 -1.26 -4.87 119.74 118.84 1s3s s LYS 109 Ca 0.70 -1.28 -0.13 0.00 0.02 0.00 0.00 55.97 55.29 1s3s s LYS 109 Cb -0.48 -2.42 0.23 0.00 -0.52 0.00 0.00 37.83 34.64 1s3s s LYS 109 CO 0.37 -1.31 0.95 0.71 -0.92 0.00 0.00 175.35 175.15 1s3s s TYR 110 N -3.02 3.86 1.03 3.18 1.51 -1.26 -0.13 117.35 122.52 1s3s s TYR 110 Ca 0.65 -2.17 -0.25 0.00 -1.01 0.00 0.00 57.07 54.29 1s3s s TYR 110 Cb -0.05 -3.90 -0.11 0.00 -0.11 0.00 0.00 41.96 37.79 1s3s s TYR 110 CO 0.43 -1.05 -1.11 0.41 -1.11 0.00 0.00 175.55 173.12 1s3s n GLY 111 N 3.71 -2.85 0.00 0.71 0.00 -0.93 -4.89 105.19 100.94 1s3s n GLY 111 Ca 0.19 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.91 1s3s n GLY 111 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1s3s n LYS 112 N 1.17 0.00 -4.79 1.61 5.02 -1.26 -4.53 118.16 115.38 1s3s n LYS 112 Ca -0.01 0.00 -0.33 0.00 -2.02 0.00 0.00 58.31 55.95 1s3s n LYS 112 Cb 0.72 -0.01 -0.13 0.00 -0.02 0.00 0.00 35.03 35.58 1s3s n LYS 112 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 1s3s s ARG 113 N 0.00 2.74 -0.03 1.97 1.70 -1.26 0.46 118.95 124.52 1s3s s ARG 113 Ca 0.00 -0.65 0.07 0.00 -0.47 0.00 0.00 55.73 54.67 1s3s s ARG 113 Cb 0.00 -2.49 -0.01 0.00 -0.57 0.00 0.00 34.95 31.88 1s3s s ARG 113 CO 0.00 0.56 -0.24 0.42 -1.08 0.00 0.00 175.30 174.96 1s3s s ILE 114 N -0.54 1.89 -0.29 4.99 1.01 0.32 -0.38 121.20 128.19 1s3s s ILE 114 Ca 0.08 -1.00 -0.05 0.00 0.00 0.00 0.00 60.65 59.67 1s3s s ILE 114 Cb -0.12 -1.58 0.02 0.00 0.01 0.00 0.00 42.46 40.79 1s3s s ILE 114 CO 0.02 0.53 0.05 -2.28 0.00 0.00 0.00 174.94 173.26 1s3s s HIS 115 N -0.37 3.16 0.19 3.97 2.46 0.11 0.81 115.29 125.62 1s3s s HIS 115 Ca 0.04 -1.22 0.09 0.00 0.47 0.00 0.00 55.06 54.44 1s3s s HIS 115 Cb -0.11 -2.21 -0.04 0.00 -0.13 0.00 0.00 32.58 30.09 1s3s s HIS 115 CO 0.01 -0.65 -0.07 0.08 -2.47 0.00 0.00 174.74 171.65 1s3s s VAL 116 N 1.43 3.32 -0.17 0.89 1.01 0.26 -1.57 120.40 125.57 1s3s s VAL 116 Ca 0.01 -1.67 -0.08 0.00 0.00 0.00 0.00 61.98 60.24 1s3s s VAL 116 Cb -0.18 -2.67 0.06 0.00 0.00 0.00 0.00 36.38 33.60 1s3s s VAL 116 CO 0.01 -0.16 0.39 -0.76 0.00 0.00 0.00 175.10 174.58 1s3s s LEU 117 N -3.00 -0.12 0.00 3.92 1.43 -0.81 -4.22 118.68 115.89 1s3s s LEU 117 Ca 0.26 0.87 -0.18 0.00 -1.03 0.00 0.00 54.13 54.05 1s3s s LEU 117 Cb -0.08 1.28 0.27 0.00 0.03 0.00 0.00 46.19 47.68 1s3s s LEU 117 CO 0.17 -0.20 0.86 -0.81 0.23 0.00 0.00 176.35 176.60 1s3s n PRO 118 N 4.43 -3.20 -3.93 1.29 -0.04 -1.26 -0.77 135.00 131.52 1s3s n PRO 118 Ca -0.21 -1.39 -0.31 0.00 -0.04 0.00 0.00 63.50 61.55 1s3s n PRO 118 Cb 0.54 -1.41 -0.15 0.00 -0.04 0.00 0.00 33.50 32.44 1s3s n PRO 118 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1s3s s ILE 119 N -2.45 1.73 0.00 0.52 1.01 -0.80 -2.28 121.20 118.93 1s3s s ILE 119 Ca 0.58 -1.78 0.00 0.00 0.00 0.00 0.00 60.65 59.45 1s3s s ILE 119 Cb -0.07 -2.18 0.00 0.00 0.01 0.00 0.00 42.46 40.22 1s3s s ILE 119 CO 0.45 -0.45 0.00 -0.90 0.00 0.00 0.00 174.94 174.04 1s3s n ASP 120 N 4.52 0.00 0.16 3.58 5.68 -1.07 0.90 116.55 130.32 1s3s n ASP 120 Ca -0.03 0.00 0.10 0.00 -0.50 0.00 0.00 54.79 54.37 1s3s n ASP 120 Cb 0.43 0.00 0.56 0.00 -1.14 0.00 0.00 41.12 40.96 1s3s n ASP 120 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 1s3s n ASP 121 N -0.98 0.53 0.03 -1.12 5.68 -1.26 -1.43 116.55 118.00 1s3s n ASP 121 Ca 0.00 0.74 0.05 0.00 -0.50 0.00 0.00 54.79 55.08 1s3s n ASP 121 Cb 0.00 -0.79 -0.08 0.00 -1.14 0.00 0.00 41.12 39.11 1s3s n ASP 121 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 1s3s n THR 122 N -2.22 0.79 -0.71 2.12 -2.24 0.26 -4.30 114.28 107.97 1s3s n THR 122 Ca -0.01 -0.62 0.07 0.00 -2.27 0.00 0.00 64.05 61.22 1s3s n THR 122 Cb 0.07 -0.44 0.19 0.00 -2.10 0.00 0.00 70.33 68.05 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 -2.68 1.79 -2.26 2.28 0.24 -0.52 -4.64 118.33 112.54 1s3s n VAL 123 Ca -0.08 -1.64 -0.43 0.00 -2.04 0.00 0.00 64.34 60.16 1s3s n VAL 123 Cb 0.72 0.00 -0.02 0.00 -1.47 0.00 0.00 33.84 33.07 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 -2.21 4.24 0.00 7.34 2.02 -0.89 -3.06 118.70 126.14 1s3s s GLU 124 Ca 0.32 1.88 0.00 0.00 0.02 0.00 0.00 54.97 57.19 1s3s s GLU 124 Cb 0.25 -3.77 0.00 0.00 0.10 0.00 0.00 34.13 30.71 1s3s s GLU 124 CO 0.09 -0.70 0.00 0.41 0.02 0.00 0.00 175.26 175.08 1s3s n GLY 125 N 3.75 2.51 3.80 -1.39 0.00 -1.26 -5.05 105.19 107.55 1s3s n GLY 125 Ca 0.14 -0.30 -0.38 0.00 0.00 0.00 0.00 46.02 45.49 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 -1.88 5.15 0.03 -0.61 -4.36 -1.17 -4.84 121.20 113.52 1s3s s ILE 126 Ca 0.00 0.75 0.04 0.00 -0.26 0.00 0.00 60.65 61.19 1s3s s ILE 126 Cb 0.00 -3.69 -0.02 0.00 1.25 0.00 0.00 42.46 40.00 1s3s s ILE 126 CO 0.00 0.50 -0.13 -0.89 0.24 0.00 0.00 174.94 174.66 1s3s s THR 127 N -0.48 1.06 -2.99 8.37 2.01 -1.23 -4.92 115.64 117.46 1s3s s THR 127 Ca 0.22 -0.88 0.00 0.00 0.31 0.00 0.00 61.69 61.34 1s3s s THR 127 Cb -0.15 -0.94 0.00 0.00 0.01 0.00 0.00 72.50 71.41 1s3s s THR 127 CO 0.10 0.06 0.00 0.61 -0.69 0.00 0.00 174.62 174.70 1s3s n GLY 128 N 2.11 0.83 3.56 4.40 0.00 -1.26 -2.07 105.19 112.75 1s3s n GLY 128 Ca -0.17 -2.09 -0.39 0.00 0.00 0.00 0.00 46.02 43.37 1s3s n GLY 128 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1s3s s ASN 129 N -2.01 5.36 0.18 1.61 3.84 -1.26 -4.83 114.94 117.83 1s3s s ASN 129 Ca 0.00 0.60 0.26 0.00 0.21 0.00 0.00 52.86 53.93 1s3s s ASN 129 Cb 0.00 -2.53 0.89 0.00 -0.55 0.00 0.00 41.25 39.06 1s3s s ASN 129 CO 0.00 -2.25 1.79 0.18 -2.79 0.00 0.00 177.10 174.02 1s3s n LEU 130 N 12.38 0.67 -0.01 3.21 4.77 -1.26 -2.66 117.00 134.10 1s3s n LEU 130 Ca 0.22 0.57 -0.09 0.00 -0.03 0.00 0.00 56.01 56.68 1s3s n LEU 130 Cb 0.51 -0.37 -0.07 0.00 -2.33 0.00 0.00 43.42 41.16 1s3s n LEU 130 CO 0.70 -0.19 0.28 0.15 -1.33 0.00 0.00 177.39 177.01 1s3s h PHE 131 N 0.00 -0.09 0.00 -1.77 3.57 -1.94 0.90 116.94 117.61 1s3s h PHE 131 Ca 0.00 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1s3s h PHE 131 Cb 0.66 0.03 0.00 0.00 2.79 0.00 0.00 35.95 39.43 1s3s h PHE 131 CO 0.00 0.40 0.00 0.39 -2.23 0.00 0.00 178.31 176.87 1s3s n GLU 132 N -4.79 0.01 -0.07 1.11 1.02 -1.25 0.11 120.64 116.79 1s3s n GLU 132 Ca -0.06 0.09 -0.14 0.00 -0.02 0.00 0.00 57.16 57.03 1s3s n GLU 132 Cb 0.26 -1.52 -0.14 0.00 -0.02 0.00 0.00 31.44 30.02 1s3s n GLU 132 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1s3s n VAL 133 N -1.55 1.55 0.01 2.62 0.31 -1.09 -4.67 118.33 115.52 1s3s n VAL 133 Ca 0.06 -0.72 0.00 0.00 -0.01 0.00 0.00 64.34 63.67 1s3s n VAL 133 Cb 0.29 -1.12 0.00 0.00 -0.91 0.00 0.00 33.84 32.10 1s3s n VAL 133 CO 0.00 0.00 0.00 -1.22 -1.32 0.00 0.00 176.83 174.29 1s3s n TYR 134 N -3.11 -0.06 -0.18 3.52 4.01 0.26 -4.80 117.16 116.81 1s3s n TYR 134 Ca -0.33 0.01 -0.06 0.00 -0.16 0.00 0.00 57.90 57.36 1s3s n TYR 134 Cb 1.07 0.07 -0.01 0.00 -0.31 0.00 0.00 39.34 40.16 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 0.00 -1.19 0.18 7.72 -0.00 -1.10 -2.11 115.31 118.81 1s3s h LEU 135 Ca 0.00 0.22 0.00 0.00 -0.00 0.00 0.00 57.88 58.10 1s3s h LEU 135 Cb 0.00 0.57 -0.03 0.00 -0.00 0.00 0.00 40.66 41.20 1s3s h LEU 135 CO 0.00 -0.31 -0.41 0.50 -0.00 0.00 0.00 178.44 178.21 1s3s h LYS 136 N -0.20 -0.63 -0.30 1.13 3.64 0.49 -2.35 116.57 118.35 1s3s h LYS 136 Ca 0.21 0.04 0.02 0.00 -1.27 0.00 0.00 60.65 59.66 1s3s h LYS 136 Cb 0.55 0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 32.50 1s3s h LYS 136 CO -0.64 -0.42 0.20 -1.35 -2.27 0.00 0.00 179.45 174.97 1s3s h PRO 137 N -0.65 0.30 -0.22 1.90 0.11 -1.75 -1.91 132.00 129.79 1s3s h PRO 137 Ca -0.02 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 66.04 1s3s h PRO 137 Cb 0.62 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 31.66 1s3s h PRO 137 CO -0.18 0.20 -0.00 -0.92 -0.21 0.00 0.00 178.00 176.89 1s3s h TYR 138 N 0.31 0.42 0.00 0.65 3.20 -0.93 -3.27 116.97 117.35 1s3s h TYR 138 Ca 0.12 -0.07 -0.15 0.00 3.14 0.00 0.00 58.73 61.77 1s3s h TYR 138 Cb 0.10 -0.11 -0.02 0.00 1.54 0.00 0.00 36.73 38.24 1s3s h TYR 138 CO -0.00 0.57 -1.07 0.74 -1.64 0.00 0.00 178.16 176.76 1s3s h PHE 139 N 0.15 0.00 -0.05 -3.82 0.04 -1.38 -3.45 116.94 108.43 1s3s h PHE 139 Ca 0.06 0.00 -0.51 0.00 2.80 0.00 0.00 57.97 60.32 1s3s h PHE 139 Cb 0.40 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.53 1s3s h PHE 139 CO 0.04 0.58 0.83 -0.11 -0.60 0.00 0.00 178.31 179.05 1s3s n LEU 140 N -3.04 0.51 -2.16 1.54 7.94 -0.72 -0.33 117.00 120.75 1s3s n LEU 140 Ca -0.05 0.47 -0.10 0.00 -1.11 0.00 0.00 56.01 55.22 1s3s n LEU 140 Cb 0.81 -0.59 -0.01 0.00 0.53 0.00 0.00 43.42 44.16 1s3s n LEU 140 CO 0.42 -0.51 -0.12 -0.62 -1.11 0.00 0.00 177.39 175.46 1s3s n GLU 141 N 4.73 -2.09 -0.06 1.96 -0.58 -1.26 -4.80 120.64 118.55 1s3s n GLU 141 Ca 0.35 0.51 -0.02 0.00 -0.42 0.00 0.00 57.16 57.57 1s3s n GLU 141 Cb -0.03 -4.99 -0.16 0.00 -0.57 0.00 0.00 31.44 25.70 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 -1.67 1.98 -2.43 0.62 0.00 0.56 -4.99 120.51 114.58 1s3s n ALA 142 Ca -0.11 -1.00 -0.19 0.00 0.00 0.00 0.00 53.44 52.13 1s3s n ALA 142 Cb 0.52 -0.37 -0.01 0.00 0.00 0.00 0.00 19.45 19.60 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 -2.54 -1.11 -1.89 0.00 4.01 -1.22 -4.89 117.16 109.52 1s3s n TYR 143 Ca -0.22 0.02 -0.42 0.00 -0.16 0.00 0.00 57.90 57.12 1s3s n TYR 143 Cb 0.92 -3.78 -0.03 0.00 -0.31 0.00 0.00 39.34 36.14 1s3s n TYR 143 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 1s3s s ARG 144 N -5.07 4.19 0.31 -0.72 0.52 -1.25 -4.54 118.95 112.39 1s3s s ARG 144 Ca 0.01 2.39 -0.18 0.00 -0.52 0.00 0.00 55.73 57.43 1s3s s ARG 144 Cb -0.01 -3.46 -0.09 0.00 0.52 0.00 0.00 34.95 31.91 1s3s s ARG 144 CO 0.01 -0.72 0.78 -1.25 0.02 0.00 0.00 175.30 174.15 1s3s s PRO 145 N 2.22 4.15 -0.07 3.54 0.04 -1.26 -1.25 135.00 142.36 1s3s s PRO 145 Ca 0.74 0.85 -0.14 0.00 0.04 0.00 0.00 61.00 62.49 1s3s s PRO 145 Cb -0.42 -2.55 0.03 0.00 0.04 0.00 0.00 34.50 31.60 1s3s s PRO 145 CO 0.33 0.20 0.34 0.96 0.04 0.00 0.00 177.00 178.87 1s3s s ILE 146 N -1.85 0.03 0.12 0.56 -4.36 -0.25 -4.83 121.20 110.61 1s3s s ILE 146 Ca 0.52 -0.24 0.07 0.00 -0.26 0.00 0.00 60.65 60.74 1s3s s ILE 146 Cb -0.12 -0.56 -0.04 0.00 1.25 0.00 0.00 42.46 42.98 1s3s s ILE 146 CO 0.18 -0.13 -0.09 -0.60 0.24 0.00 0.00 174.94 174.55 1s3s s ARG 147 N -0.58 2.17 0.39 0.37 3.00 -1.26 -1.31 118.95 121.72 1s3s s ARG 147 Ca -0.07 -1.04 -0.27 0.00 -1.00 0.00 0.00 55.73 53.35 1s3s s ARG 147 Cb -0.04 -2.31 -0.10 0.00 0.00 0.00 0.00 34.95 32.50 1s3s s ARG 147 CO 0.02 0.50 1.36 0.21 0.00 0.00 0.00 175.30 177.40 1s3s s LYS 148 N -2.33 4.06 0.00 5.12 2.20 0.18 -2.92 119.74 126.06 1s3s s LYS 148 Ca 0.22 2.30 0.00 0.00 -0.36 0.00 0.00 55.97 58.14 1s3s s LYS 148 Cb -0.11 -2.87 0.00 0.00 -1.51 0.00 0.00 37.83 33.34 1s3s s LYS 148 CO 0.15 -0.46 0.00 0.41 -0.36 0.00 0.00 175.35 175.08 1s3s n GLY 149 N 0.64 1.22 3.87 5.54 0.00 0.16 -5.01 105.19 111.61 1s3s n GLY 149 Ca 0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 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 -2.54 5.65 -0.12 1.61 1.01 -1.15 -4.75 116.67 116.38 1s3s s ASP 150 Ca 0.00 1.30 0.01 0.00 0.71 0.00 0.00 52.55 54.57 1s3s s ASP 150 Cb 0.00 -2.19 0.02 0.00 1.01 0.00 0.00 42.92 41.76 1s3s s ASP 150 CO 0.00 -1.23 -0.15 -0.63 0.21 0.00 0.00 175.17 173.37 1s3s s ILE 151 N -3.25 1.57 0.38 0.77 1.01 -1.26 -1.19 121.20 119.23 1s3s s ILE 151 Ca 0.57 -0.67 0.08 0.00 0.00 0.00 0.00 60.65 60.63 1s3s s ILE 151 Cb -0.12 -1.44 -0.05 0.00 0.01 0.00 0.00 42.46 40.86 1s3s s ILE 151 CO 0.53 0.46 0.12 0.72 0.00 0.00 0.00 174.94 176.76 1s3s s PHE 152 N 1.15 2.61 0.01 3.97 -0.71 -0.22 -4.87 117.98 119.91 1s3s s PHE 152 Ca -0.03 -0.50 0.06 0.00 -1.04 0.00 0.00 56.93 55.42 1s3s s PHE 152 Cb -0.14 -1.75 -0.02 0.00 -1.21 0.00 0.00 43.02 39.90 1s3s s PHE 152 CO -0.05 0.31 -0.18 -1.17 -1.34 0.00 0.00 175.22 172.79 1s3s s LEU 153 N -3.83 2.08 -0.09 -1.99 2.96 -1.26 -1.26 118.68 115.29 1s3s s LEU 153 Ca 0.38 -0.39 0.01 0.00 -0.22 0.00 0.00 54.13 53.91 1s3s s LEU 153 Cb 0.02 -0.91 0.02 0.00 0.50 0.00 0.00 46.19 45.82 1s3s s LEU 153 CO 0.21 0.19 -0.09 -0.69 -1.32 0.00 0.00 176.35 174.65 1s3s s VAL 154 N -0.56 1.03 0.18 1.68 1.01 -0.57 -5.00 120.40 118.18 1s3s s VAL 154 Ca 0.07 -0.34 -0.08 0.00 0.00 0.00 0.00 61.98 61.62 1s3s s VAL 154 Cb -0.07 -1.01 -0.06 0.00 0.00 0.00 0.00 36.38 35.23 1s3s s VAL 154 CO 0.00 0.36 0.47 -0.13 0.00 0.00 0.00 175.10 175.80 1s3s s ARG 155 N 1.31 3.74 0.00 2.72 0.52 -1.26 -1.14 118.95 124.83 1s3s s ARG 155 Ca -0.03 0.14 0.00 0.00 -0.52 0.00 0.00 55.73 55.32 1s3s s ARG 155 Cb -0.14 -2.76 0.00 0.00 0.52 0.00 0.00 34.95 32.57 1s3s s ARG 155 CO -0.04 0.40 0.00 0.41 0.02 0.00 0.00 175.30 176.09 1s3s n GLY 156 N 0.08 2.92 2.57 -3.53 0.00 -0.17 -4.99 105.19 102.06 1s3s n GLY 156 Ca -0.02 -1.16 -0.12 0.00 0.00 0.00 0.00 46.02 44.72 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 -1.27 -0.50 3.29 -0.02 0.00 -1.25 -1.85 105.19 103.59 1s3s n GLY 157 Ca 0.00 0.01 -0.16 0.00 0.00 0.00 0.00 46.02 45.88 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 -2.89 -4.86 0.00 1.61 0.00 0.11 -4.77 117.12 106.31 1s3s n MET 158 Ca -0.11 0.83 0.00 0.00 0.00 0.00 0.00 57.70 58.41 1s3s n MET 158 Cb 0.59 -5.73 0.00 0.00 0.00 0.00 0.00 33.22 28.08 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 -3.71 -0.45 -4.12 0.03 1.85 -0.77 -4.99 116.66 104.50 1s3s n ARG 159 Ca -0.20 0.00 -0.27 0.00 -1.00 0.00 0.00 57.85 56.37 1s3s n ARG 159 Cb 0.65 0.00 -0.17 0.00 -1.05 0.00 0.00 32.46 31.89 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 -2.00 1.49 -0.05 2.89 0.00 -1.26 -1.00 121.76 121.83 1s3s s ALA 160 Ca 0.00 -0.63 -0.05 0.00 0.00 0.00 0.00 51.96 51.28 1s3s s ALA 160 Cb 0.00 -0.88 -0.04 0.00 0.00 0.00 0.00 23.12 22.20 1s3s s ALA 160 CO 0.00 -0.27 0.17 0.08 0.00 0.00 0.00 175.76 175.74 1s3s s VAL 161 N 1.38 5.45 -0.13 0.00 1.01 -0.29 -4.90 120.40 122.92 1s3s s VAL 161 Ca 0.00 0.02 -0.02 0.00 0.00 0.00 0.00 61.98 61.98 1s3s s VAL 161 Cb -0.13 -3.49 -0.03 0.00 0.00 0.00 0.00 36.38 32.73 1s3s s VAL 161 CO -0.06 0.45 -0.05 -1.61 0.00 0.00 0.00 175.10 173.83 1s3s s GLU 162 N -1.56 3.43 -0.03 2.72 2.02 -1.26 -1.50 118.70 122.52 1s3s s GLU 162 Ca 0.22 -0.54 0.07 0.00 0.02 0.00 0.00 54.97 54.74 1s3s s GLU 162 Cb -0.12 -2.81 -0.02 0.00 0.10 0.00 0.00 34.13 31.28 1s3s s GLU 162 CO 0.13 0.34 -0.23 -0.06 0.02 0.00 0.00 175.26 175.45 1s3s s PHE 163 N 0.07 2.15 -0.12 1.61 0.08 -0.39 -1.90 117.98 119.48 1s3s s PHE 163 Ca -0.01 -0.47 -0.05 0.00 0.12 0.00 0.00 56.93 56.52 1s3s s PHE 163 Cb -0.14 -1.39 -0.04 0.00 -0.57 0.00 0.00 43.02 40.88 1s3s s PHE 163 CO 0.03 -0.08 0.05 0.21 -0.10 0.00 0.00 175.22 175.33 1s3s s LYS 164 N -0.42 3.41 -0.92 0.44 2.20 0.05 -1.05 119.74 123.45 1s3s s LYS 164 Ca 0.05 -0.32 -0.20 0.00 -0.36 0.00 0.00 55.97 55.14 1s3s s LYS 164 Cb -0.10 -3.02 0.10 0.00 -1.51 0.00 0.00 37.83 33.31 1s3s s LYS 164 CO 0.00 0.58 1.18 0.08 -0.36 0.00 0.00 175.35 176.84 1s3s s VAL 165 N -0.52 4.49 0.38 4.02 1.01 -0.33 -1.91 120.40 127.54 1s3s s VAL 165 Ca 0.10 -1.23 0.10 0.00 0.00 0.00 0.00 61.98 60.95 1s3s s VAL 165 Cb -0.12 -4.83 0.15 0.00 0.00 0.00 0.00 36.38 31.58 1s3s s VAL 165 CO 0.02 -1.60 1.90 0.58 0.00 0.00 0.00 175.10 176.00 1s3s h VAL 166 N 6.06 1.19 -1.68 2.92 2.07 -1.62 0.45 116.25 125.65 1s3s h VAL 166 Ca 0.11 -0.83 0.04 0.00 0.82 0.00 0.00 66.70 66.84 1s3s h VAL 166 Cb 1.03 1.26 -0.23 0.00 -1.52 0.00 0.00 31.29 31.82 1s3s h VAL 166 CO 1.19 0.26 0.43 -0.70 0.02 0.00 0.00 177.57 178.76 1s3s s GLU 167 N -4.67 0.65 -0.05 1.57 2.56 -0.92 -4.72 118.70 113.12 1s3s s GLU 167 Ca -0.05 0.39 0.01 0.00 0.00 0.00 0.00 54.97 55.32 1s3s s GLU 167 Cb 0.15 0.31 0.02 0.00 2.00 0.00 0.00 34.13 36.61 1s3s s GLU 167 CO 0.73 -0.16 -0.07 0.95 -0.56 0.00 0.00 175.26 176.16 1s3s s THR 168 N -0.53 0.74 0.10 -1.70 -4.23 -1.26 0.08 115.64 108.84 1s3s s THR 168 Ca -0.01 -0.24 -0.28 0.00 -1.18 0.00 0.00 61.69 59.99 1s3s s THR 168 Cb -0.02 -0.73 -0.10 0.00 1.34 0.00 0.00 72.50 72.99 1s3s s THR 168 CO 0.00 0.27 1.45 -0.78 -0.54 0.00 0.00 174.62 175.03 1s3s h ASP 169 N 7.18 -1.49 -3.19 3.99 1.82 -1.09 -3.18 116.42 120.47 1s3s h ASP 169 Ca -0.35 0.19 -0.57 0.00 -0.39 0.00 0.00 57.03 55.91 1s3s h ASP 169 Cb 1.16 0.59 -0.05 0.00 0.68 0.00 0.00 39.33 41.72 1s3s h ASP 169 CO 0.46 -0.37 1.09 -2.84 -1.61 0.00 0.00 179.24 175.98 1s3s s PRO 170 N -5.20 3.52 0.26 0.28 0.02 -1.26 -4.95 135.00 127.68 1s3s s PRO 170 Ca -0.12 0.92 -0.20 0.00 0.02 0.00 0.00 61.00 61.62 1s3s s PRO 170 Cb 0.06 -4.05 -0.09 0.00 0.02 0.00 0.00 34.50 30.45 1s3s s PRO 170 CO 0.50 -1.64 0.77 -1.12 -0.33 0.00 0.00 177.00 175.19 1s3s s SER 171 N 4.19 7.05 0.00 2.53 0.01 -1.20 -3.23 113.70 123.05 1s3s s SER 171 Ca 0.62 1.48 0.23 0.00 1.31 0.00 0.00 55.95 59.59 1s3s s SER 171 Cb -0.14 -2.44 0.00 0.00 0.21 0.00 0.00 66.02 63.65 1s3s s SER 171 CO 0.32 -0.04 1.10 -0.81 0.41 0.00 0.00 173.24 174.22 1s3s n PRO 172 N 0.46 1.23 -4.05 12.44 -0.04 -1.26 -5.01 135.00 138.76 1s3s n PRO 172 Ca -0.00 -1.02 -0.12 0.00 -0.04 0.00 0.00 63.50 62.32 1s3s n PRO 172 Cb 0.51 -1.48 -0.11 0.00 -0.04 0.00 0.00 33.50 32.38 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 -2.47 0.59 0.20 0.54 -0.85 -1.20 0.51 117.35 114.67 1s3s s TYR 173 Ca 0.19 -0.55 -0.15 0.00 -0.52 0.00 0.00 57.07 56.04 1s3s s TYR 173 Cb 0.18 -0.36 0.01 0.00 0.38 0.00 0.00 41.96 42.17 1s3s s TYR 173 CO 0.57 -0.12 0.46 0.00 -1.52 0.00 0.00 175.55 174.94 1s3s s ILE 175 N -3.92 5.42 -0.58 0.00 1.01 0.81 -1.09 121.20 122.85 1s3s s ILE 175 Ca 0.13 0.31 -0.23 0.00 0.00 0.00 0.00 60.65 60.87 1s3s s ILE 175 Cb 0.00 -3.47 0.05 0.00 0.01 0.00 0.00 42.46 39.06 1s3s s ILE 175 CO -0.00 0.57 0.90 -0.69 0.00 0.00 0.00 174.94 175.72 1s3s s VAL 176 N -0.73 4.44 0.42 2.92 1.01 -0.38 -2.18 120.40 125.90 1s3s s VAL 176 Ca 0.15 -0.07 0.04 0.00 0.00 0.00 0.00 61.98 62.11 1s3s s VAL 176 Cb -0.13 -4.55 0.00 0.00 0.00 0.00 0.00 36.38 31.71 1s3s s VAL 176 CO 0.04 -1.19 0.60 0.00 0.00 0.00 0.00 175.10 174.56 1s3s s ALA 177 N 3.78 4.09 0.43 5.51 0.00 -1.26 -3.37 121.76 130.95 1s3s s ALA 177 Ca 0.25 -1.36 0.30 0.00 0.00 0.00 0.00 51.96 51.15 1s3s s ALA 177 Cb -0.15 -1.87 1.65 0.00 0.00 0.00 0.00 23.12 22.75 1s3s s ALA 177 CO 0.15 -0.31 1.92 -1.00 0.00 0.00 0.00 175.76 176.51 1s3s h PRO 178 N 0.55 0.00 -0.64 0.00 0.13 -1.94 0.17 132.00 130.27 1s3s h PRO 178 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 1s3s h PRO 178 Cb 1.27 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.40 1s3s h PRO 178 CO 0.52 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.04 1s3s n ASP 179 N -2.72 3.76 -4.74 1.44 9.92 -1.26 -4.94 116.55 118.02 1s3s n ASP 179 Ca -0.02 -2.02 -0.41 0.00 -0.53 0.00 0.00 54.79 51.81 1s3s n ASP 179 Cb 0.23 -0.44 -0.05 0.00 -0.64 0.00 0.00 41.12 40.22 1s3s n ASP 179 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 1s3s s THR 180 N -1.05 4.37 -0.19 -3.53 2.01 0.61 -4.93 115.64 112.92 1s3s s THR 180 Ca 0.43 2.07 -0.18 0.00 0.31 0.00 0.00 61.69 64.32 1s3s s THR 180 Cb 0.23 -4.32 -0.04 0.00 0.01 0.00 0.00 72.50 68.38 1s3s s THR 180 CO 0.29 0.38 0.48 -0.69 -0.69 0.00 0.00 174.62 174.38 1s3s s VAL 181 N -0.39 5.14 -0.26 3.82 1.01 0.17 -4.92 120.40 124.98 1s3s s VAL 181 Ca 0.45 0.88 -0.07 0.00 0.00 0.00 0.00 61.98 63.24 1s3s s VAL 181 Cb -0.24 -3.80 -0.02 0.00 0.00 0.00 0.00 36.38 32.31 1s3s s VAL 181 CO 0.30 0.22 0.06 -0.63 0.00 0.00 0.00 175.10 175.05 1s3s s ILE 182 N 1.42 4.18 -0.09 2.22 1.01 -1.26 0.12 121.20 128.79 1s3s s ILE 182 Ca 0.23 -0.29 -0.00 0.00 0.00 0.00 0.00 60.65 60.59 1s3s s ILE 182 Cb -0.15 -2.98 -0.03 0.00 0.01 0.00 0.00 42.46 39.31 1s3s s ILE 182 CO 0.09 0.30 -0.06 -1.00 0.00 0.00 0.00 174.94 174.27 1s3s s HIS 183 N 1.59 2.97 -0.60 3.97 3.76 0.24 -4.95 115.29 122.27 1s3s s HIS 183 Ca 0.06 -0.04 0.06 0.00 -0.15 0.00 0.00 55.06 54.99 1s3s s HIS 183 Cb -0.15 -1.77 0.25 0.00 1.11 0.00 0.00 32.58 32.02 1s3s s HIS 183 CO 0.03 0.26 0.71 0.00 -0.85 0.00 0.00 174.74 174.89 1s3s s GLU 185 N -2.26 3.12 0.00 0.00 2.02 -1.26 -5.00 118.70 115.32 1s3s s GLU 185 Ca 0.39 -1.64 0.00 0.00 0.02 0.00 0.00 54.97 53.74 1s3s s GLU 185 Cb 0.15 -4.33 0.00 0.00 0.10 0.00 0.00 34.13 30.05 1s3s s GLU 185 CO -0.03 -1.44 0.00 0.41 0.02 0.00 0.00 175.26 174.22 1s3s n GLY 186 N 5.11 1.40 3.76 -1.39 0.00 -1.26 -5.06 105.19 107.75 1s3s n GLY 186 Ca -0.07 -2.24 -0.38 0.00 0.00 0.00 0.00 46.02 43.33 1s3s n GLY 186 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1s3s s GLU 187 N -1.37 3.44 0.77 1.61 0.41 -1.26 -4.93 118.70 117.37 1s3s s GLU 187 Ca 0.00 2.10 -0.13 0.00 -0.41 0.00 0.00 54.97 56.53 1s3s s GLU 187 Cb 0.00 -2.37 0.06 0.00 -1.78 0.00 0.00 34.13 30.04 1s3s s GLU 187 CO 0.00 -0.91 1.15 -2.14 -0.49 0.00 0.00 175.26 172.87 1s3s s PRO 188 N -2.75 2.01 0.36 0.39 0.02 -1.26 -4.89 135.00 128.88 1s3s s PRO 188 Ca 0.67 1.52 0.05 0.00 0.02 0.00 0.00 61.00 63.26 1s3s s PRO 188 Cb -0.37 -1.84 -0.01 0.00 0.02 0.00 0.00 34.50 32.30 1s3s s PRO 188 CO 0.44 -1.89 0.52 0.96 -0.33 0.00 0.00 177.00 176.71 1s3s s ILE 189 N -2.39 4.07 0.88 2.83 -0.00 -0.97 -4.64 121.20 120.98 1s3s s ILE 189 Ca 0.68 -0.87 -0.13 0.00 -0.00 0.00 0.00 60.65 60.33 1s3s s ILE 189 Cb -0.24 -3.43 0.12 0.00 -0.00 0.00 0.00 42.46 38.92 1s3s s ILE 189 CO 0.50 -0.20 1.19 -1.59 -0.00 0.00 0.00 174.94 174.84 1s3s s LYS 190 N -4.27 1.38 -0.20 0.37 0.00 -1.26 -2.61 119.74 113.16 1s3s s LYS 190 Ca 0.46 0.06 -0.12 0.00 0.00 0.00 0.00 55.97 56.37 1s3s s LYS 190 Cb -0.10 -1.89 -0.05 0.00 0.00 0.00 0.00 37.83 35.80 1s3s s LYS 190 CO 0.33 -1.99 0.21 0.50 0.00 0.00 0.00 175.35 174.40 1s3s s ARG 191 N -5.54 4.18 0.17 1.78 3.52 -1.26 -4.94 118.95 116.86 1s3s s ARG 191 Ca 0.65 -0.11 -0.30 0.00 -0.13 0.00 0.00 55.73 55.84 1s3s s ARG 191 Cb -0.11 -3.46 -0.08 0.00 -1.56 0.00 0.00 34.95 29.74 1s3s s ARG 191 CO 0.51 0.19 1.20 -1.21 -0.81 0.00 0.00 175.30 175.19 1s3s s GLU 192 N 0.66 4.48 0.33 5.12 2.02 -1.26 -4.88 118.70 125.16 1s3s s GLU 192 Ca 0.11 1.87 0.21 0.00 0.02 0.00 0.00 54.97 57.18 1s3s s GLU 192 Cb -0.12 -3.25 1.15 0.00 0.10 0.00 0.00 34.13 32.01 1s3s s GLU 192 CO 0.02 -0.11 1.29 -0.40 0.02 0.00 0.00 175.26 176.08 1s3s n ASP 193 N 2.64 0.24 -0.69 -0.19 5.68 -1.26 0.97 116.55 123.94 1s3s n ASP 193 Ca 0.05 1.27 0.05 0.00 -0.50 0.00 0.00 54.79 55.66 1s3s n ASP 193 Cb 0.45 -0.62 0.15 0.00 -1.14 0.00 0.00 41.12 39.96 1s3s n ASP 193 CO 0.00 0.00 0.00 -1.84 -1.33 0.00 0.00 177.20 174.03 1s3s n GLU 194 N -4.65 1.91 -3.55 0.11 0.28 -1.26 -4.67 120.64 108.81 1s3s n GLU 194 Ca 0.32 -1.23 -0.41 0.00 -0.16 0.00 0.00 57.16 55.68 1s3s n GLU 194 Cb 1.14 -1.34 -0.06 0.00 1.43 0.00 0.00 31.44 32.61 1s3s n GLU 194 CO 0.00 0.00 0.00 -1.21 -0.16 0.00 0.00 177.13 175.76 1s3s s GLU 195 N -1.59 3.02 0.38 3.44 2.02 0.27 -5.06 118.70 121.18 1s3s s GLU 195 Ca 0.23 -2.51 -0.28 0.00 0.02 0.00 0.00 54.97 52.43 1s3s s GLU 195 Cb 0.13 -4.03 -0.10 0.00 0.10 0.00 0.00 34.13 30.22 1s3s s GLU 195 CO 0.14 -1.23 1.42 -1.21 0.02 0.00 0.00 175.26 174.41 1s3s s GLU 196 N 0.01 4.11 0.49 1.61 2.02 -1.26 -4.76 118.70 120.93 1s3s s GLU 196 Ca 0.17 2.44 -0.21 0.00 0.02 0.00 0.00 54.97 57.39 1s3s s GLU 196 Cb -0.16 -2.95 -0.07 0.00 0.10 0.00 0.00 34.13 31.05 1s3s s GLU 196 CO -0.06 -0.48 1.11 0.45 0.02 0.00 0.00 175.26 176.30 1s3s s SER 197 N -0.31 6.13 0.00 -0.19 0.15 -1.26 -4.90 113.70 113.32 1s3s s SER 197 Ca 0.53 2.14 0.15 0.00 0.70 0.00 0.00 55.95 59.47 1s3s s SER 197 Cb -0.44 -2.58 0.49 0.00 -1.71 0.00 0.00 66.02 61.78 1s3s s SER 197 CO 0.59 -0.94 1.38 0.18 1.20 0.00 0.00 173.24 175.65 1s3s n LEU 198 N -0.83 1.80 -0.45 3.45 4.77 -1.26 -3.03 117.00 121.46 1s3s n LEU 198 Ca 0.09 -0.85 0.13 0.00 -0.03 0.00 0.00 56.01 55.35 1s3s n LEU 198 Cb 0.50 -0.18 0.35 0.00 -2.33 0.00 0.00 43.42 41.76 1s3s n LEU 198 CO 0.43 0.42 0.69 -3.20 -1.33 0.00 0.00 177.39 174.40 1s3s n ASN 199 N 0.45 1.55 -4.88 -1.43 4.05 -1.26 -4.89 115.26 108.86 1s3s n ASN 199 Ca 0.14 -1.32 -0.30 0.00 0.45 0.00 0.00 54.58 53.54 1s3s n ASN 199 Cb 0.31 0.11 0.00 0.00 1.23 0.00 0.00 39.78 41.44 1s3s n ASN 199 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 177.26 172.60 1s3s s GLU 200 N -2.26 3.61 0.14 1.20 0.41 -1.17 -5.02 118.70 115.62 1s3s s GLU 200 Ca 0.29 0.63 -0.30 0.00 -0.41 0.00 0.00 54.97 55.18 1s3s s GLU 200 Cb 0.20 -2.16 -0.07 0.00 -1.78 0.00 0.00 34.13 30.32 1s3s s GLU 200 CO 0.43 -0.46 1.13 0.08 -0.49 0.00 0.00 175.26 175.95 1s3s s VAL 201 N -3.03 3.93 0.16 2.63 1.01 -1.26 -5.04 120.40 118.80 1s3s s VAL 201 Ca 0.53 1.57 -0.05 0.00 0.00 0.00 0.00 61.98 64.04 1s3s s VAL 201 Cb -0.11 -4.01 -0.03 0.00 0.00 0.00 0.00 36.38 32.24 1s3s s VAL 201 CO 0.50 0.23 0.17 -0.83 0.00 0.00 0.00 175.10 175.17 1s3s s GLY 202 N 0.24 0.82 0.55 4.51 0.00 -1.26 -4.37 107.32 107.82 1s3s s GLY 202 Ca 0.52 -1.24 0.32 0.00 0.00 0.00 0.00 44.72 44.32 1s3s s GLY 202 CO 0.33 -1.13 1.85 -0.97 0.00 0.00 0.00 173.10 173.18 1s3s h TYR 203 N 2.69 0.00 0.00 1.90 0.05 -1.96 0.30 116.97 119.95 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 1.22 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.96 1s3s h TYR 203 CO 0.41 0.00 0.00 -0.40 -1.05 0.00 0.00 178.16 177.12 1s3s n ASP 204 N -4.10 0.00 -0.40 3.88 5.68 -1.26 -1.95 116.55 118.39 1s3s n ASP 204 Ca 0.18 -1.08 0.09 0.00 -0.50 0.00 0.00 54.79 53.48 1s3s n ASP 204 Cb 0.99 0.00 -0.00 0.00 -1.14 0.00 0.00 41.12 40.96 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 -0.77 1.74 -4.47 -1.12 8.00 0.10 -4.90 116.55 115.13 1s3s n ASP 205 Ca 0.10 -1.37 -0.35 0.00 0.71 0.00 0.00 54.79 53.88 1s3s n ASP 205 Cb 0.04 0.48 -0.12 0.00 -0.02 0.00 0.00 41.12 41.50 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 -2.09 4.09 0.04 2.53 1.01 -0.83 -5.02 120.40 120.12 1s3s s VAL 206 Ca 0.15 -0.27 0.08 0.00 0.00 0.00 0.00 61.98 61.94 1s3s s VAL 206 Cb 0.15 -2.85 -0.03 0.00 0.00 0.00 0.00 36.38 33.65 1s3s s VAL 206 CO 0.46 0.43 -0.24 -0.83 0.00 0.00 0.00 175.10 174.92 1s3s s GLY 207 N 0.94 1.29 0.00 4.51 0.00 -1.26 -4.74 107.32 108.05 1s3s s GLY 207 Ca 0.02 -1.17 0.00 0.00 0.00 0.00 0.00 44.72 43.56 1s3s s GLY 207 CO 0.02 -1.06 0.00 0.61 0.00 0.00 0.00 173.10 172.67 1s3s n GLY 208 N 1.89 0.61 2.56 0.20 0.00 -1.26 -4.77 105.19 104.42 1s3s n GLY 208 Ca -0.17 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.59 1s3s n GLY 208 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s3s h ARG 210 N 3.61 -0.09 -0.61 0.00 -0.00 -1.95 -2.77 114.38 112.57 1s3s h ARG 210 Ca 0.15 0.01 -0.02 0.00 -0.00 0.00 0.00 59.98 60.12 1s3s h ARG 210 Cb 0.66 0.02 -0.03 0.00 -0.00 0.00 0.00 29.97 30.62 1s3s h ARG 210 CO 0.76 0.26 0.30 -0.22 -0.00 0.00 0.00 179.97 181.06 1s3s h LYS 211 N -0.99 0.87 -0.30 0.08 3.64 -2.00 -1.60 116.57 116.28 1s3s h LYS 211 Ca -0.01 -0.13 -0.09 0.00 -1.27 0.00 0.00 60.65 59.15 1s3s h LYS 211 Cb 0.40 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 32.05 1s3s h LYS 211 CO 0.02 0.70 -0.18 -0.56 -2.27 0.00 0.00 179.45 177.16 1s3s h GLN 212 N 0.83 0.65 0.00 1.90 -0.00 -1.90 -2.43 115.11 114.17 1s3s h GLN 212 Ca 0.21 -0.30 -0.04 0.00 -0.00 0.00 0.00 58.65 58.52 1s3s h GLN 212 Cb 0.11 -0.01 -0.01 0.00 -0.00 0.00 0.00 27.48 27.57 1s3s h GLN 212 CO -0.03 0.89 -0.21 -0.07 -0.00 0.00 0.00 178.83 179.42 1s3s h LEU 213 N 0.40 0.00 -0.15 0.06 3.38 -1.39 -1.55 115.31 116.07 1s3s h LEU 213 Ca 0.06 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.98 1s3s h LEU 213 Cb 0.72 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.46 1s3s h LEU 213 CO 0.05 0.21 -0.10 0.00 0.09 0.00 0.00 178.44 178.68 1s3s h ALA 214 N 1.79 0.21 -0.38 1.53 0.00 -1.10 -2.38 119.26 118.94 1s3s h ALA 214 Ca -0.00 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.60 1s3s h ALA 214 Cb 0.36 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1s3s h ALA 214 CO 0.03 0.05 0.18 1.96 0.00 0.00 0.00 179.25 181.47 1s3s h GLN 215 N -0.02 0.54 -0.55 0.00 4.20 -1.03 -2.52 115.11 115.72 1s3s h GLN 215 Ca 0.03 -0.08 0.03 0.00 0.06 0.00 0.00 58.65 58.69 1s3s h GLN 215 Cb 0.60 -0.10 -0.04 0.00 0.30 0.00 0.00 27.48 28.25 1s3s h GLN 215 CO 0.03 0.48 0.32 0.82 -0.67 0.00 0.00 178.83 179.80 1s3s h ILE 216 N 0.47 1.02 0.39 2.54 2.04 -1.32 -1.55 117.51 121.10 1s3s h ILE 216 Ca 0.13 -0.21 -0.01 0.00 1.00 0.00 0.00 64.86 65.77 1s3s h ILE 216 Cb 0.11 0.35 -0.02 0.00 -0.74 0.00 0.00 36.82 36.52 1s3s h ILE 216 CO -0.02 0.11 -0.36 0.11 0.00 0.00 0.00 178.15 178.00 1s3s h LYS 217 N 0.62 -0.74 0.00 2.37 1.57 -1.24 -1.53 116.57 117.62 1s3s h LYS 217 Ca 0.23 0.05 0.00 0.00 -1.87 0.00 0.00 60.65 59.06 1s3s h LYS 217 Cb 0.07 0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.55 1s3s h LYS 217 CO -0.12 -0.49 0.00 1.05 -0.57 0.00 0.00 179.45 179.32 1s3s h GLU 218 N -0.77 0.00 -0.03 3.15 4.11 -1.35 0.46 114.58 120.16 1s3s h GLU 218 Ca -0.03 0.00 -0.13 0.00 0.07 0.00 0.00 59.36 59.26 1s3s h GLU 218 Cb 0.68 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.94 1s3s h GLU 218 CO -0.05 0.00 -0.51 0.52 0.07 0.00 0.00 179.01 179.05 1s3s h MET 219 N 0.00 0.39 0.00 1.06 2.86 -0.69 -3.33 114.93 115.22 1s3s h MET 219 Ca 0.00 -0.39 0.00 0.00 -2.06 0.00 0.00 59.70 57.25 1s3s h MET 219 Cb 0.23 0.10 0.00 0.00 0.06 0.00 0.00 31.60 31.99 1s3s h MET 219 CO 0.00 1.05 -0.92 -0.39 1.06 0.00 0.00 176.91 177.71 1s3s h VAL 220 N -0.12 0.00 -0.42 -2.22 -1.51 -0.81 -3.42 116.25 107.74 1s3s h VAL 220 Ca -0.06 -0.85 0.04 0.00 -1.23 0.00 0.00 66.70 64.60 1s3s h VAL 220 Cb 1.21 1.36 -0.05 0.00 -2.13 0.00 0.00 31.29 31.67 1s3s h VAL 220 CO 0.10 0.00 -0.25 1.21 -1.23 0.00 0.00 177.57 177.40 1s3s n GLU 221 N -2.51 -0.19 -0.05 5.19 4.07 0.16 -0.51 120.64 126.81 1s3s n GLU 221 Ca 0.01 1.06 -0.13 0.00 -0.06 0.00 0.00 57.16 58.03 1s3s n GLU 221 Cb 0.52 -1.57 -0.08 0.00 -0.06 0.00 0.00 31.44 30.25 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 0.33 -1.18 4.31 3.38 -1.80 0.27 115.31 120.62 1s3s h LEU 222 Ca 0.07 -0.52 -0.01 0.00 0.09 0.00 0.00 57.88 57.51 1s3s h LEU 222 Cb 0.17 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 40.79 1s3s h LEU 222 CO -0.40 0.79 0.41 -0.65 0.09 0.00 0.00 178.44 178.67 1s3s h PRO 223 N -0.11 0.97 0.01 1.13 0.11 -1.77 0.25 132.00 132.60 1s3s h PRO 223 Ca 0.01 -0.09 -0.31 0.00 0.11 0.00 0.00 66.00 65.72 1s3s h PRO 223 Cb 0.71 -0.20 -0.05 0.00 0.11 0.00 0.00 31.00 31.57 1s3s h PRO 223 CO 0.04 0.70 -1.83 1.28 -0.21 0.00 0.00 178.00 177.98 1s3s n LEU 224 N -4.38 1.00 -0.06 2.35 4.32 0.34 -3.81 117.00 116.76 1s3s n LEU 224 Ca 0.07 0.34 -0.07 0.00 -0.02 0.00 0.00 56.01 56.33 1s3s n LEU 224 Cb 0.08 0.05 -0.15 0.00 -1.62 0.00 0.00 43.42 41.79 1s3s n LEU 224 CO 0.37 0.46 -0.90 0.54 -1.22 0.00 0.00 177.39 176.65 1s3s n ARG 225 N -3.06 0.67 -2.83 3.23 5.12 0.95 -4.62 116.66 116.12 1s3s n ARG 225 Ca -0.21 0.07 -0.24 0.00 -1.93 0.00 0.00 57.85 55.54 1s3s n ARG 225 Cb 1.06 -1.61 -0.02 0.00 -1.16 0.00 0.00 32.46 30.73 1s3s n ARG 225 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42 1s3s n HIS 226 N -2.79 2.91 -0.12 -1.55 8.25 0.89 -4.95 115.22 117.86 1s3s n HIS 226 Ca -0.25 -3.60 -0.14 0.00 -0.26 0.00 0.00 57.72 53.48 1s3s n HIS 226 Cb 1.05 -0.35 -0.10 0.00 1.12 0.00 0.00 29.99 31.71 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 2.88 -0.41 0.00 -0.41 0.11 -1.65 -1.02 132.00 131.50 1s3s h PRO 227 Ca 0.15 0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.28 1s3s h PRO 227 Cb 0.77 0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.97 1s3s h PRO 227 CO 0.74 -0.27 0.69 0.00 -0.21 0.00 0.00 178.00 178.95 1s3s h ALA 228 N -0.10 1.67 0.33 -0.75 0.00 -1.92 -1.28 119.26 117.23 1s3s h ALA 228 Ca 0.07 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 1s3s h ALA 228 Cb 0.60 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1s3s h ALA 228 CO -0.57 -0.67 -0.16 1.25 0.00 0.00 0.00 179.25 179.10 1s3s h LEU 229 N 0.00 -0.38 -1.02 0.00 5.85 -1.53 -2.74 115.31 115.49 1s3s h LEU 229 Ca 0.00 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.73 1s3s h LEU 229 Cb 1.38 0.10 0.00 0.00 0.37 0.00 0.00 40.66 42.51 1s3s h LEU 229 CO 0.00 -0.26 0.00 0.49 -0.34 0.00 0.00 178.44 178.33 1s3s n PHE 230 N -3.28 0.00 -0.07 1.25 3.72 -0.48 -0.31 117.46 118.29 1s3s n PHE 230 Ca -0.06 0.00 -0.08 0.00 -0.05 0.00 0.00 57.45 57.27 1s3s n PHE 230 Cb 0.18 -0.00 -0.11 0.00 -0.94 0.00 0.00 39.48 38.61 1s3s n PHE 230 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 176.76 177.88 1s3s n LYS 231 N 0.44 1.49 -0.27 -1.08 4.81 -1.03 -4.49 118.16 118.03 1s3s n LYS 231 Ca 0.00 0.01 0.07 0.00 -0.87 0.00 0.00 58.31 57.52 1s3s n LYS 231 Cb 0.00 -1.36 0.19 0.00 0.02 0.00 0.00 35.03 33.88 1s3s n LYS 231 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1s3s n ALA 232 N -2.61 2.47 -2.61 3.14 0.00 0.58 -4.99 120.51 116.49 1s3s n ALA 232 Ca -0.25 -1.55 -0.21 0.00 0.00 0.00 0.00 53.44 51.44 1s3s n ALA 232 Cb 0.94 -0.54 -0.13 0.00 0.00 0.00 0.00 19.45 19.73 1s3s n ALA 232 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1s3s s ILE 233 N -1.64 1.30 -0.98 0.00 -1.09 -1.16 -5.03 121.20 112.61 1s3s s ILE 233 Ca 0.30 -1.18 0.25 0.00 -2.23 0.00 0.00 60.65 57.78 1s3s s ILE 233 Cb 0.20 -1.18 0.00 0.00 -1.58 0.00 0.00 42.46 39.90 1s3s s ILE 233 CO 0.13 -0.02 1.40 0.61 -1.23 0.00 0.00 174.94 175.83 1s3s n GLY 234 N 1.63 -1.25 3.73 6.18 0.00 -1.26 -4.83 105.19 109.39 1s3s n GLY 234 Ca -0.19 -0.35 -0.38 0.00 0.00 0.00 0.00 46.02 45.10 1s3s n GLY 234 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1s3s n VAL 235 N -1.53 4.12 -3.74 1.61 0.31 -1.26 -4.98 118.33 112.86 1s3s n VAL 235 Ca 0.05 -0.50 -0.38 0.00 -0.01 0.00 0.00 64.34 63.50 1s3s n VAL 235 Cb 0.34 -1.60 -0.12 0.00 -0.91 0.00 0.00 33.84 31.54 1s3s n VAL 235 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 1s3s s LYS 236 N -3.00 2.64 0.95 5.55 2.20 -1.26 -5.00 119.74 121.82 1s3s s LYS 236 Ca 0.75 -1.17 -0.13 0.00 -0.36 0.00 0.00 55.97 55.06 1s3s s LYS 236 Cb -0.41 -3.47 0.16 0.00 -1.51 0.00 0.00 37.83 32.60 1s3s s LYS 236 CO 0.47 -0.66 1.15 -1.25 -0.36 0.00 0.00 175.35 174.69 1s3s s PRO 237 N 1.41 0.84 0.44 4.03 0.04 -1.26 -5.02 135.00 135.48 1s3s s PRO 237 Ca -0.01 0.20 -0.23 0.00 0.04 0.00 0.00 61.00 61.00 1s3s s PRO 237 Cb -0.19 -1.81 -0.08 0.00 0.04 0.00 0.00 34.50 32.45 1s3s s PRO 237 CO 0.03 -2.38 1.09 -2.14 0.04 0.00 0.00 177.00 173.63 1s3s s PRO 238 N -5.33 3.94 0.01 0.56 0.02 -1.26 -4.98 135.00 127.95 1s3s s PRO 238 Ca 0.65 1.57 -0.00 0.00 0.02 0.00 0.00 61.00 63.24 1s3s s PRO 238 Cb -0.14 -2.39 -0.00 0.00 0.02 0.00 0.00 34.50 31.99 1s3s s PRO 238 CO 0.54 -0.35 -0.01 0.54 -0.33 0.00 0.00 177.00 177.39 1s3s n ARG 239 N -0.42 0.01 -3.44 5.54 1.74 -1.26 -4.87 116.66 113.95 1s3s n ARG 239 Ca 0.07 0.01 -0.37 0.00 -0.77 0.00 0.00 57.85 56.78 1s3s n ARG 239 Cb 0.50 -0.17 -0.06 0.00 -1.02 0.00 0.00 32.46 31.71 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 -3.20 2.49 -0.07 -0.13 0.00 -1.03 -0.90 107.32 104.46 1s3s s GLY 240 Ca -0.01 -0.18 -0.02 0.00 0.00 0.00 0.00 44.72 44.52 1s3s s GLY 240 CO 0.01 0.15 0.02 -1.50 0.00 0.00 0.00 173.10 171.78 1s3s s ILE 241 N -1.23 0.24 -0.06 0.90 1.10 0.06 -2.53 121.20 119.67 1s3s s ILE 241 Ca 0.30 0.15 -0.19 0.00 -0.51 0.00 0.00 60.65 60.40 1s3s s ILE 241 Cb -0.16 -0.46 -0.05 0.00 0.15 0.00 0.00 42.46 41.94 1s3s s ILE 241 CO 0.17 0.19 0.52 -0.22 -2.11 0.00 0.00 174.94 173.48 1s3s s LEU 242 N 2.03 4.35 -0.25 8.50 2.96 0.17 -1.55 118.68 134.88 1s3s s LEU 242 Ca 0.05 0.97 -0.04 0.00 -0.22 0.00 0.00 54.13 54.89 1s3s s LEU 242 Cb -0.13 -2.78 0.01 0.00 0.50 0.00 0.00 46.19 43.80 1s3s s LEU 242 CO -0.05 0.07 -0.02 -0.76 -1.32 0.00 0.00 176.35 174.27 1s3s s LEU 243 N 0.15 3.23 -0.11 -0.68 1.02 0.74 -0.21 118.68 122.83 1s3s s LEU 243 Ca 0.28 -0.64 -0.04 0.00 0.02 0.00 0.00 54.13 53.74 1s3s s LEU 243 Cb -0.16 -1.74 -0.04 0.00 0.02 0.00 0.00 46.19 44.27 1s3s s LEU 243 CO 0.13 -0.10 0.06 -0.31 0.02 0.00 0.00 176.35 176.15 1s3s s TYR 244 N 1.43 3.33 0.00 0.29 2.02 -0.67 -1.10 117.35 122.64 1s3s s TYR 244 Ca 0.03 0.31 0.00 0.00 -0.37 0.00 0.00 57.07 57.04 1s3s s TYR 244 Cb -0.16 -1.87 0.00 0.00 -0.40 0.00 0.00 41.96 39.53 1s3s s TYR 244 CO -0.02 0.54 0.00 0.41 -1.57 0.00 0.00 175.55 174.91 1s3s n GLY 245 N 2.20 2.65 3.68 0.71 0.00 -1.01 0.20 105.19 113.63 1s3s n GLY 245 Ca -0.19 -0.72 -0.29 0.00 0.00 0.00 0.00 46.02 44.82 1s3s n GLY 245 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1s3s s PRO 246 N -2.00 -0.22 0.59 1.61 0.04 -1.26 -3.82 135.00 129.93 1s3s s PRO 246 Ca 0.00 0.09 -0.20 0.00 0.04 0.00 0.00 61.00 60.93 1s3s s PRO 246 Cb 0.00 -1.70 -0.03 0.00 0.04 0.00 0.00 34.50 32.81 1s3s s PRO 246 CO 0.00 -3.08 1.34 -2.14 0.04 0.00 0.00 177.00 173.17 1s3s s PRO 247 N -5.33 2.89 -0.05 0.56 0.02 -1.26 -3.12 135.00 128.72 1s3s s PRO 247 Ca 0.69 2.20 0.00 0.00 0.02 0.00 0.00 61.00 63.90 1s3s s PRO 247 Cb -0.12 -2.10 0.00 0.00 0.02 0.00 0.00 34.50 32.30 1s3s s PRO 247 CO 0.56 -1.37 0.00 0.41 -0.33 0.00 0.00 177.00 176.27 1s3s n GLY 248 N 0.80 0.42 0.19 0.52 0.00 -1.26 -4.89 105.19 100.98 1s3s n GLY 248 Ca 0.13 -0.08 0.14 0.00 0.00 0.00 0.00 46.02 46.21 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 -1.89 -1.56 112.91 114.09 1s3s h THR 249 Ca -0.01 -0.41 0.00 0.00 0.77 0.00 0.00 66.41 66.76 1s3s h THR 249 Cb 0.24 1.29 0.00 0.00 -1.74 0.00 0.00 68.15 67.94 1s3s h THR 249 CO 0.01 0.00 0.00 0.61 0.37 0.00 0.00 175.52 176.51 1s3s n GLY 250 N 0.17 1.57 0.10 2.16 0.00 -1.26 -4.78 105.19 103.16 1s3s n GLY 250 Ca 0.02 -0.15 -0.04 0.00 0.00 0.00 0.00 46.02 45.85 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 0.00 0.01 0.04 1.61 1.57 -1.94 -1.09 116.57 116.77 1s3s h LYS 251 Ca 0.00 -0.01 -0.25 0.00 -1.87 0.00 0.00 60.65 58.52 1s3s h LYS 251 Cb 0.13 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.45 1s3s h LYS 251 CO 0.00 0.79 -1.06 1.15 -0.57 0.00 0.00 179.45 179.76 1s3s h THR 252 N 0.00 1.37 -0.52 -0.16 2.02 -1.99 -2.49 112.91 111.15 1s3s h THR 252 Ca -0.01 -2.50 -0.01 0.00 0.77 0.00 0.00 66.41 64.66 1s3s h THR 252 Cb 1.39 2.54 -0.02 0.00 -1.74 0.00 0.00 68.15 70.31 1s3s h THR 252 CO 0.10 0.75 0.29 0.25 0.37 0.00 0.00 175.52 177.29 1s3s h LEU 253 N 0.24 0.64 0.02 2.58 6.46 -1.95 -1.65 115.31 121.65 1s3s h LEU 253 Ca -0.12 -0.08 -0.00 0.00 -0.12 0.00 0.00 57.88 57.56 1s3s h LEU 253 Cb 1.71 -0.16 0.00 0.00 -0.73 0.00 0.00 40.66 41.48 1s3s h LEU 253 CO 0.19 0.53 -0.01 0.40 -0.62 0.00 0.00 178.44 178.93 1s3s h ILE 254 N 0.69 1.23 -0.14 4.05 2.04 -1.21 -1.15 117.51 123.03 1s3s h ILE 254 Ca 0.18 -0.75 -0.02 0.00 1.00 0.00 0.00 64.86 65.28 1s3s h ILE 254 Cb 0.03 1.73 -0.01 0.00 -0.74 0.00 0.00 36.82 37.83 1s3s h ILE 254 CO -0.03 0.19 0.01 0.00 0.00 0.00 0.00 178.15 178.32 1s3s h ALA 255 N 0.64 1.76 0.00 1.87 0.00 -1.36 0.44 119.26 122.61 1s3s h ALA 255 Ca -0.00 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1s3s h ALA 255 Cb 0.33 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1s3s h ALA 255 CO 0.00 0.19 -0.04 -0.09 0.00 0.00 0.00 179.25 179.31 1s3s h ARG 256 N 0.19 0.02 -0.30 0.00 2.43 -1.23 -2.78 114.38 112.72 1s3s h ARG 256 Ca 0.05 -0.03 0.05 0.00 -0.81 0.00 0.00 59.98 59.24 1s3s h ARG 256 Cb 0.12 0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 29.63 1s3s h ARG 256 CO 0.00 0.84 -0.00 0.00 -1.51 0.00 0.00 179.97 179.30 1s3s h ALA 257 N 0.18 0.27 -0.41 2.80 0.00 -0.97 0.16 119.26 121.29 1s3s h ALA 257 Ca -0.00 0.09 0.08 0.00 0.00 0.00 0.00 54.91 55.08 1s3s h ALA 257 Cb 0.86 0.15 -0.08 0.00 0.00 0.00 0.00 17.79 18.71 1s3s h ALA 257 CO 0.01 -0.41 -0.15 0.28 0.00 0.00 0.00 179.25 178.97 1s3s h VAL 258 N 0.09 0.49 0.53 0.00 2.07 -1.00 0.34 116.25 118.78 1s3s h VAL 258 Ca 0.14 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.65 1s3s h VAL 258 Cb 0.19 0.49 -0.02 0.00 -1.52 0.00 0.00 31.29 30.44 1s3s h VAL 258 CO -0.24 0.00 -0.50 0.00 0.02 0.00 0.00 177.57 176.84 1s3s h ALA 259 N 1.28 -1.15 -0.04 1.67 0.00 -0.95 0.37 119.26 120.44 1s3s h ALA 259 Ca 0.20 -0.20 0.02 0.00 0.00 0.00 0.00 54.91 54.93 1s3s h ALA 259 Cb 0.37 0.71 -0.04 0.00 0.00 0.00 0.00 17.79 18.84 1s3s h ALA 259 CO -0.46 -1.18 -0.37 -0.91 0.00 0.00 0.00 179.25 176.33 1s3s h ASN 260 N -1.03 -1.15 -1.07 0.00 2.35 -0.54 0.24 115.58 114.38 1s3s h ASN 260 Ca -0.07 0.13 0.30 0.00 -0.55 0.00 0.00 56.30 56.12 1s3s h ASN 260 Cb 0.89 0.44 -0.12 0.00 0.05 0.00 0.00 38.32 39.58 1s3s h ASN 260 CO -0.05 -0.35 0.66 -0.08 -1.65 0.00 0.00 177.43 175.97 1s3s h GLU 261 N -0.43 0.35 -0.01 0.81 4.57 -0.22 0.80 114.58 120.46 1s3s h GLU 261 Ca 0.01 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.17 1s3s h GLU 261 Cb 0.48 -0.08 0.00 0.00 -0.16 0.00 0.00 28.75 28.99 1s3s h GLU 261 CO -0.27 0.23 -0.33 0.25 -1.18 0.00 0.00 179.01 177.71 1s3s n THR 262 N -4.80 0.00 -2.18 0.32 -2.24 0.11 -4.40 114.28 101.08 1s3s n THR 262 Ca 0.29 -0.10 -0.10 0.00 -2.27 0.00 0.00 64.05 61.88 1s3s n THR 262 Cb 0.97 0.39 -0.00 0.00 -2.10 0.00 0.00 70.33 69.58 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 1.38 -0.03 3.92 3.38 0.00 0.28 -4.88 105.19 109.24 1s3s n GLY 263 Ca 0.10 -0.47 -0.29 0.00 0.00 0.00 0.00 46.02 45.36 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 -2.49 3.87 0.13 4.61 0.00 -0.08 -4.95 121.76 122.85 1s3s s ALA 264 Ca 0.00 -0.81 -0.31 0.00 0.00 0.00 0.00 51.96 50.85 1s3s s ALA 264 Cb 0.00 -1.97 -0.08 0.00 0.00 0.00 0.00 23.12 21.08 1s3s s ALA 264 CO 0.00 0.55 1.34 0.12 0.00 0.00 0.00 175.76 177.77 1s3s s PHE 265 N -1.76 3.28 -0.21 0.00 5.36 -0.23 -4.38 117.98 120.04 1s3s s PHE 265 Ca 0.38 1.08 -0.05 0.00 -0.96 0.00 0.00 56.93 57.38 1s3s s PHE 265 Cb -0.12 -3.62 -0.02 0.00 -0.34 0.00 0.00 43.02 38.93 1s3s s PHE 265 CO 0.28 -2.08 -0.02 0.12 -1.46 0.00 0.00 175.22 172.06 1s3s s PHE 266 N 0.80 2.99 -0.07 10.12 5.36 -1.26 0.80 117.98 136.72 1s3s s PHE 266 Ca 0.61 -0.70 0.04 0.00 -0.96 0.00 0.00 56.93 55.93 1s3s s PHE 266 Cb -0.36 -2.10 -0.01 0.00 -0.34 0.00 0.00 43.02 40.20 1s3s s PHE 266 CO 0.32 -0.41 -0.21 0.12 -1.46 0.00 0.00 175.22 173.59 1s3s s PHE 267 N 1.29 2.56 -0.09 10.12 2.19 -0.12 -4.96 117.98 128.96 1s3s s PHE 267 Ca 0.04 -0.63 -0.03 0.00 0.33 0.00 0.00 56.93 56.64 1s3s s PHE 267 Cb -0.14 -1.65 -0.03 0.00 -1.31 0.00 0.00 43.02 39.88 1s3s s PHE 267 CO -0.00 -0.16 0.02 -1.17 1.83 0.00 0.00 175.22 175.74 1s3s s LEU 268 N -0.14 3.70 -0.16 6.12 2.96 -1.26 -1.10 118.68 128.80 1s3s s LEU 268 Ca -0.03 0.19 -0.02 0.00 -0.22 0.00 0.00 54.13 54.05 1s3s s LEU 268 Cb -0.14 -1.86 0.05 0.00 0.50 0.00 0.00 46.19 44.74 1s3s s LEU 268 CO 0.04 0.38 0.00 -0.63 -1.32 0.00 0.00 176.35 174.82 1s3s s ILE 269 N -0.86 0.65 -0.23 6.68 1.01 -0.70 -4.95 121.20 122.79 1s3s s ILE 269 Ca 0.13 -0.42 -0.10 0.00 0.00 0.00 0.00 60.65 60.26 1s3s s ILE 269 Cb -0.11 -0.98 -0.05 0.00 0.01 0.00 0.00 42.46 41.32 1s3s s ILE 269 CO 0.02 -0.01 0.14 0.21 0.00 0.00 0.00 174.94 175.31 1s3s s ASN 270 N 1.82 5.97 0.00 3.58 3.04 -1.26 0.49 114.94 128.58 1s3s s ASN 270 Ca 0.01 0.08 0.00 0.00 0.04 0.00 0.00 52.86 52.99 1s3s s ASN 270 Cb -0.15 -2.07 0.00 0.00 -1.54 0.00 0.00 41.25 37.48 1s3s s ASN 270 CO -0.07 0.07 0.92 0.61 -3.04 0.00 0.00 177.10 175.59 1s3s n GLY 271 N 4.26 -3.17 0.37 1.21 0.00 0.18 -1.34 105.19 106.71 1s3s n GLY 271 Ca -0.15 0.61 0.18 0.00 0.00 0.00 0.00 46.02 46.65 1s3s n GLY 271 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1s3s h PRO 272 N 0.00 0.15 -0.72 1.61 0.13 -1.84 -0.24 132.00 131.09 1s3s h PRO 272 Ca 0.00 -0.01 0.07 0.00 -0.87 0.00 0.00 66.00 65.19 1s3s h PRO 272 Cb 0.00 -0.03 -0.06 0.00 0.13 0.00 0.00 31.00 31.04 1s3s h PRO 272 CO 0.00 0.10 0.41 1.49 -0.23 0.00 0.00 178.00 179.76 1s3s h GLU 273 N 0.15 0.72 -0.09 0.86 4.57 -1.61 -1.63 114.58 117.55 1s3s h GLU 273 Ca 0.28 -0.04 -0.15 0.00 -1.18 0.00 0.00 59.36 58.27 1s3s h GLU 273 Cb 0.89 -0.16 0.01 0.00 -0.16 0.00 0.00 28.75 29.33 1s3s h GLU 273 CO -0.04 0.47 -0.51 0.82 -1.18 0.00 0.00 179.01 178.57 1s3s h ILE 274 N 0.74 1.37 0.00 2.32 1.08 -0.55 -3.22 117.51 119.25 1s3s h ILE 274 Ca 0.33 -1.84 0.00 0.00 -0.39 0.00 0.00 64.86 62.95 1s3s h ILE 274 Cb 0.22 2.23 0.00 0.00 -3.07 0.00 0.00 36.82 36.20 1s3s h ILE 274 CO -0.20 0.55 0.00 0.23 -0.69 0.00 0.00 178.15 178.05 1s3s n MET 275 N -4.23 0.70 0.04 2.37 2.81 -0.59 -2.43 117.12 115.78 1s3s n MET 275 Ca -0.08 0.00 0.11 0.00 -1.81 0.00 0.00 57.70 55.92 1s3s n MET 275 Cb 0.61 -1.44 -0.06 0.00 -0.71 0.00 0.00 33.22 31.61 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 -0.94 0.47 -4.76 7.83 3.41 -0.63 -4.96 113.62 114.04 1s3s n SER 276 Ca 0.15 0.01 -0.33 0.00 -0.26 0.00 0.00 58.87 58.43 1s3s n SER 276 Cb 0.07 1.15 0.06 0.00 -0.26 0.00 0.00 64.21 65.23 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 -3.36 2.63 0.43 4.33 -0.14 -1.02 -4.99 119.74 117.62 1s3s s LYS 277 Ca -0.02 1.42 -0.24 0.00 -1.36 0.00 0.00 55.97 55.77 1s3s s LYS 277 Cb 0.13 -1.93 -0.08 0.00 -1.68 0.00 0.00 37.83 34.27 1s3s s LYS 277 CO 0.84 -1.39 1.20 -0.51 -0.76 0.00 0.00 175.35 174.73 1s3s s LEU 278 N -5.02 4.10 0.34 3.17 1.43 -1.26 -4.70 118.68 116.74 1s3s s LEU 278 Ca 0.67 2.40 -0.26 0.00 -1.03 0.00 0.00 54.13 55.92 1s3s s LEU 278 Cb -0.21 -4.11 -0.13 0.00 0.03 0.00 0.00 46.19 41.77 1s3s s LEU 278 CO 0.43 -0.86 0.86 0.00 0.23 0.00 0.00 176.35 177.02 1s3s n ALA 279 N -0.22 -0.65 0.00 4.21 0.00 -1.26 -1.44 120.51 121.16 1s3s n ALA 279 Ca 0.06 0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.80 1s3s n ALA 279 Cb 0.47 -1.94 0.00 0.00 0.00 0.00 0.00 19.45 17.97 1s3s n ALA 279 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1s3s n GLY 280 N 1.41 2.45 0.28 0.00 0.00 -1.26 -4.61 105.19 103.46 1s3s n GLY 280 Ca 0.11 -0.51 0.14 0.00 0.00 0.00 0.00 46.02 45.76 1s3s n GLY 280 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1s3s h GLU 281 N 0.00 0.00 -0.07 1.61 4.81 -1.60 0.71 114.58 120.05 1s3s h GLU 281 Ca 0.00 0.00 -0.16 0.00 -0.13 0.00 0.00 59.36 59.07 1s3s h GLU 281 Cb 0.00 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.39 1s3s h GLU 281 CO 0.00 0.03 -0.57 0.66 -0.73 0.00 0.00 179.01 178.40 1s3s h SER 282 N 0.00 0.62 0.77 1.04 4.64 -1.77 -1.65 113.55 117.19 1s3s h SER 282 Ca -0.00 -0.68 -0.13 0.00 -0.47 0.00 0.00 61.79 60.51 1s3s h SER 282 Cb 0.09 -0.18 -0.02 0.00 -0.31 0.00 0.00 62.40 61.97 1s3s h SER 282 CO 0.00 1.21 -0.62 -0.33 -0.87 0.00 0.00 176.83 176.22 1s3s h GLU 283 N 0.08 0.00 -0.56 4.77 3.07 -1.55 -2.68 114.58 117.70 1s3s h GLU 283 Ca -0.05 0.00 -0.05 0.00 -0.50 0.00 0.00 59.36 58.76 1s3s h GLU 283 Cb 1.24 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 29.12 1s3s h GLU 283 CO 0.12 0.62 0.16 1.03 -1.40 0.00 0.00 179.01 179.53 1s3s h SER 284 N 0.00 0.84 0.99 1.42 0.87 0.42 -2.78 113.55 115.31 1s3s h SER 284 Ca -0.01 -0.22 -0.06 0.00 -1.23 0.00 0.00 61.79 60.27 1s3s h SER 284 Cb 1.17 -0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 62.90 1s3s h SER 284 CO 0.08 0.84 -0.29 0.78 -0.53 0.00 0.00 176.83 177.71 1s3s h ASN 285 N 0.80 0.00 -0.15 6.23 -0.26 -1.09 -1.95 115.58 119.15 1s3s h ASN 285 Ca 0.18 0.00 -0.06 0.00 -0.56 0.00 0.00 56.30 55.86 1s3s h ASN 285 Cb 0.31 0.00 -0.00 0.00 -1.06 0.00 0.00 38.32 37.57 1s3s h ASN 285 CO -0.00 0.29 -0.14 -0.07 -1.06 0.00 0.00 177.43 176.45 1s3s h LEU 286 N 0.00 0.38 -0.38 1.61 3.38 -1.31 -2.34 115.31 116.64 1s3s h LEU 286 Ca -0.00 -0.48 -0.02 0.00 0.09 0.00 0.00 57.88 57.47 1s3s h LEU 286 Cb 0.86 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.49 1s3s h LEU 286 CO 0.04 0.78 0.15 0.03 0.09 0.00 0.00 178.44 179.52 1s3s h ARG 287 N -0.01 0.58 -0.13 1.13 3.08 -1.37 -2.33 114.38 115.33 1s3s h ARG 287 Ca 0.02 -0.11 -0.02 0.00 0.07 0.00 0.00 59.98 59.95 1s3s h ARG 287 Cb 0.67 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.62 1s3s h ARG 287 CO 0.04 0.56 -0.00 0.87 -1.07 0.00 0.00 179.97 180.36 1s3s h LYS 288 N 0.48 0.18 -0.60 0.04 1.79 -1.39 -0.90 116.57 116.18 1s3s h LYS 288 Ca 0.13 -0.02 -0.04 0.00 -2.18 0.00 0.00 60.65 58.54 1s3s h LYS 288 Cb 0.21 -0.03 -0.03 0.00 -1.58 0.00 0.00 32.23 30.79 1s3s h LYS 288 CO -0.01 0.21 0.22 0.00 -1.08 0.00 0.00 179.45 178.79 1s3s h ALA 289 N 1.82 0.78 -0.06 3.86 0.00 -0.88 -1.05 119.26 123.73 1s3s h ALA 289 Ca 0.04 -0.18 -0.24 0.00 0.00 0.00 0.00 54.91 54.53 1s3s h ALA 289 Cb 0.14 -0.23 0.01 0.00 0.00 0.00 0.00 17.79 17.71 1s3s h ALA 289 CO 0.00 0.41 -0.92 0.74 0.00 0.00 0.00 179.25 179.48 1s3s h PHE 290 N 0.83 1.01 -0.12 0.00 -1.00 -1.08 -2.60 116.94 113.99 1s3s h PHE 290 Ca 0.20 -0.50 0.02 0.00 2.81 0.00 0.00 57.97 60.49 1s3s h PHE 290 Cb 0.23 -0.13 -0.02 0.00 3.61 0.00 0.00 35.95 39.64 1s3s h PHE 290 CO 0.01 1.33 -0.01 0.93 -1.61 0.00 0.00 178.31 178.96 1s3s h GLU 291 N 0.44 0.02 -0.50 1.51 5.08 -0.99 0.14 114.58 120.29 1s3s h GLU 291 Ca -0.09 -0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.23 1s3s h GLU 291 Cb 1.56 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.78 1s3s h GLU 291 CO 0.18 0.01 0.14 1.49 -1.00 0.00 0.00 179.01 179.84 1s3s h GLU 292 N 0.02 0.74 0.00 2.33 4.81 -1.25 -1.73 114.58 119.50 1s3s h GLU 292 Ca 0.05 -0.13 -0.10 0.00 -0.13 0.00 0.00 59.36 59.06 1s3s h GLU 292 Cb 0.07 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.32 1s3s h GLU 292 CO -0.11 0.65 -0.46 0.00 -0.73 0.00 0.00 179.01 178.37 1s3s h ALA 293 N 1.44 1.23 0.00 2.92 0.00 -0.99 -2.75 119.26 121.10 1s3s h ALA 293 Ca 0.17 -0.42 -0.13 0.00 0.00 0.00 0.00 54.91 54.53 1s3s h ALA 293 Cb 0.23 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1s3s h ALA 293 CO -0.01 0.57 -0.60 1.49 0.00 0.00 0.00 179.25 180.70 1s3s h GLU 294 N 0.00 0.00 -0.32 0.00 4.81 0.04 -3.19 114.58 115.92 1s3s h GLU 294 Ca -0.00 0.00 -0.11 0.00 -0.13 0.00 0.00 59.36 59.12 1s3s h GLU 294 Cb 0.82 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.19 1s3s h GLU 294 CO 0.06 0.60 -0.22 0.87 -0.73 0.00 0.00 179.01 179.59 1s3s h LYS 295 N 0.00 0.71 -0.97 1.92 1.57 -1.06 -3.24 116.57 115.49 1s3s h LYS 295 Ca -0.01 -0.34 -0.40 0.00 -1.87 0.00 0.00 60.65 58.04 1s3s h LYS 295 Cb 1.39 -0.01 -0.24 0.00 0.08 0.00 0.00 32.23 33.46 1s3s h LYS 295 CO 0.08 0.95 0.51 0.09 -0.57 0.00 0.00 179.45 180.50 1s3s n ASN 296 N -4.30 3.72 -4.76 0.86 3.02 -1.08 -4.99 115.26 107.73 1s3s n ASN 296 Ca -0.03 -3.30 -0.38 0.00 -0.03 0.00 0.00 54.58 50.84 1s3s n ASN 296 Cb 0.43 -0.77 0.00 0.00 -0.61 0.00 0.00 39.78 38.83 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 -2.72 3.04 0.23 5.41 0.00 -1.21 -4.17 121.76 122.34 1s3s s ALA 297 Ca 0.47 1.13 -0.31 0.00 0.00 0.00 0.00 51.96 53.25 1s3s s ALA 297 Cb 0.39 -3.46 -0.12 0.00 0.00 0.00 0.00 23.12 19.94 1s3s s ALA 297 CO 0.09 -0.87 1.67 -2.14 0.00 0.00 0.00 175.76 174.51 1s3s s PRO 298 N -2.57 4.13 0.03 0.00 0.02 -1.26 -5.02 135.00 130.32 1s3s s PRO 298 Ca 0.63 2.57 -0.02 0.00 0.02 0.00 0.00 61.00 64.20 1s3s s PRO 298 Cb -0.35 -3.07 -0.02 0.00 0.02 0.00 0.00 34.50 31.09 1s3s s PRO 298 CO 0.43 -0.70 0.01 0.00 -0.33 0.00 0.00 177.00 176.40 1s3s s ALA 299 N 0.79 0.13 -0.20 -1.55 0.00 -0.94 -1.07 121.76 118.92 1s3s s ALA 299 Ca 0.71 -0.68 0.01 0.00 0.00 0.00 0.00 51.96 52.00 1s3s s ALA 299 Cb -0.49 0.19 0.03 0.00 0.00 0.00 0.00 23.12 22.86 1s3s s ALA 299 CO 0.37 -0.24 -0.16 0.42 0.00 0.00 0.00 175.76 176.15 1s3s s ILE 300 N -2.20 2.00 -0.09 0.00 1.01 0.24 -1.24 121.20 120.92 1s3s s ILE 300 Ca -0.09 -1.11 -0.18 0.00 0.00 0.00 0.00 60.65 59.27 1s3s s ILE 300 Cb -0.04 -1.92 -0.04 0.00 0.01 0.00 0.00 42.46 40.46 1s3s s ILE 300 CO -0.03 0.34 0.47 -0.63 0.00 0.00 0.00 174.94 175.09 1s3s s ILE 301 N 1.27 5.15 -0.22 2.92 1.01 -0.74 -0.94 121.20 129.64 1s3s s ILE 301 Ca 0.01 0.95 0.02 0.00 0.00 0.00 0.00 60.65 61.63 1s3s s ILE 301 Cb -0.15 -3.81 0.04 0.00 0.01 0.00 0.00 42.46 38.55 1s3s s ILE 301 CO -0.10 0.37 -0.14 0.12 0.00 0.00 0.00 174.94 175.19 1s3s s PHE 302 N 0.34 2.91 -0.42 3.97 5.36 -0.26 -0.15 117.98 129.73 1s3s s PHE 302 Ca 0.26 -1.94 -0.21 0.00 -0.96 0.00 0.00 56.93 54.08 1s3s s PHE 302 Cb -0.15 -1.86 0.02 0.00 -0.34 0.00 0.00 43.02 40.69 1s3s s PHE 302 CO 0.11 -0.83 0.65 0.42 -1.46 0.00 0.00 175.22 174.12 1s3s s ILE 303 N 1.23 4.83 -0.21 3.12 1.01 0.41 -1.71 121.20 129.87 1s3s s ILE 303 Ca -0.03 0.24 -0.21 0.00 0.00 0.00 0.00 60.65 60.65 1s3s s ILE 303 Cb -0.17 -4.19 -0.02 0.00 0.01 0.00 0.00 42.46 38.09 1s3s s ILE 303 CO -0.08 -0.55 0.65 -0.62 0.00 0.00 0.00 174.94 174.34 1s3s s ASP 304 N 1.97 6.68 -0.51 3.58 2.15 0.18 -1.58 116.67 129.14 1s3s s ASP 304 Ca 0.24 0.83 -0.01 0.00 0.43 0.00 0.00 52.55 54.04 1s3s s ASP 304 Cb -0.14 -2.36 0.00 0.00 -0.30 0.00 0.00 42.92 40.12 1s3s s ASP 304 CO 0.18 -0.32 0.43 -0.62 -0.17 0.00 0.00 175.17 174.67 1s3s n GLU 305 N 5.28 -2.84 -0.23 4.34 1.02 -1.20 0.49 120.64 127.50 1s3s n GLU 305 Ca -0.00 0.35 0.04 0.00 -0.02 0.00 0.00 57.16 57.53 1s3s n GLU 305 Cb 0.49 -3.90 0.16 0.00 -0.02 0.00 0.00 31.44 28.17 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 -0.84 0.00 -1.65 -4.62 5.85 -1.49 -0.47 115.31 112.09 1s3s h LEU 306 Ca -0.24 0.14 0.18 0.00 0.84 0.00 0.00 57.88 58.80 1s3s h LEU 306 Cb 1.14 0.19 -0.03 0.00 0.37 0.00 0.00 40.66 42.33 1s3s h LEU 306 CO 0.21 -0.02 0.72 -2.24 -0.34 0.00 0.00 178.44 176.77 1s3s h ASP 307 N 0.27 0.00 1.35 1.25 3.04 -1.82 0.78 116.42 121.30 1s3s h ASP 307 Ca 0.39 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 54.18 1s3s h ASP 307 Cb 0.63 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.92 1s3s h ASP 307 CO -0.48 0.00 0.00 0.00 -2.04 0.00 0.00 179.24 176.72 1s3s h ALA 308 N 1.15 1.00 0.00 4.15 0.00 -1.45 -3.31 119.26 120.80 1s3s h ALA 308 Ca 0.30 0.00 -0.28 0.00 0.00 0.00 0.00 54.91 54.93 1s3s h ALA 308 Cb 1.74 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 19.49 1s3s h ALA 308 CO -0.00 0.00 -1.88 -0.89 0.00 0.00 0.00 179.25 176.48 1s3s n ILE 309 N -2.67 1.03 -3.79 0.00 5.41 0.25 -4.80 119.36 114.79 1s3s n ILE 309 Ca 0.03 -0.21 -0.31 0.00 1.00 0.00 0.00 62.75 63.26 1s3s n ILE 309 Cb 0.39 -1.78 -0.10 0.00 -0.71 0.00 0.00 39.64 37.44 1s3s n ILE 309 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1s3s s ALA 310 N -2.35 4.01 -0.04 -1.39 0.00 0.39 -4.52 121.76 117.86 1s3s s ALA 310 Ca -0.25 -3.84 0.05 0.00 0.00 0.00 0.00 51.96 47.92 1s3s s ALA 310 Cb 0.09 -2.45 -0.03 0.00 0.00 0.00 0.00 23.12 20.73 1s3s s ALA 310 CO 0.31 -2.12 -0.17 -1.25 0.00 0.00 0.00 175.76 172.54 1s3s s PRO 311 N -1.41 2.40 0.15 0.00 0.04 -1.24 -2.19 135.00 132.74 1s3s s PRO 311 Ca 0.26 -0.76 -0.23 0.00 0.04 0.00 0.00 61.00 60.31 1s3s s PRO 311 Cb -0.06 -2.30 0.07 0.00 0.04 0.00 0.00 34.50 32.25 1s3s s PRO 311 CO -0.15 0.61 0.63 0.21 0.04 0.00 0.00 177.00 178.34 1s3s s LYS 312 N -0.76 1.25 0.00 4.56 2.20 -1.26 -4.72 119.74 121.00 1s3s s LYS 312 Ca 0.11 -0.46 0.00 0.00 -0.36 0.00 0.00 55.97 55.26 1s3s s LYS 312 Cb -0.10 0.57 0.00 0.00 -1.51 0.00 0.00 37.83 36.79 1s3s s LYS 312 CO 0.01 -0.55 0.00 -2.13 -0.36 0.00 0.00 175.35 172.32 1s3s n ARG 313 N -0.37 0.00 0.00 4.03 3.00 -1.26 -4.48 116.66 117.58 1s3s n ARG 313 Ca -0.16 0.28 0.00 0.00 -0.00 0.00 0.00 57.85 57.97 1s3s n ARG 313 Cb 0.65 -2.84 0.00 0.00 0.00 0.00 0.00 32.46 30.26 1s3s n ARG 313 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.63 175.72 1s3s n GLU 314 N -2.76 0.00 0.00 -0.14 2.13 -1.26 -5.01 120.64 113.60 1s3s n GLU 314 Ca 0.00 0.00 0.12 0.00 0.66 0.00 0.00 57.16 57.94 1s3s n GLU 314 Cb 0.00 0.00 0.17 0.00 0.27 0.00 0.00 31.44 31.88 1s3s n GLU 314 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 1s3s n LYS 315 N 0.00 0.82 0.00 5.31 5.02 -1.26 -5.04 118.16 123.01 1s3s n LYS 315 Ca 0.00 -0.59 0.00 0.00 -2.02 0.00 0.00 58.31 55.70 1s3s n LYS 315 Cb 0.00 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.52 1s3s n LYS 315 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 1s3s n THR 316 N -0.58 0.00 -2.59 -0.18 -1.04 -1.26 -4.95 114.28 103.68 1s3s n THR 316 Ca 0.10 0.00 -0.03 0.00 -2.04 0.00 0.00 64.05 62.07 1s3s n THR 316 Cb 0.39 0.00 0.05 0.00 -1.82 0.00 0.00 70.33 68.95 1s3s n THR 316 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1s3s n HIS 317 N -1.65 1.29 -0.43 -1.42 1.44 -1.26 -4.66 115.22 108.53 1s3s n HIS 317 Ca 0.00 -1.88 -0.05 0.00 -2.01 0.00 0.00 57.72 53.78 1s3s n HIS 317 Cb 0.00 -0.24 -0.07 0.00 0.12 0.00 0.00 29.99 29.80 1s3s n HIS 317 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1s3s n GLY 318 N -0.48 1.85 2.51 -1.39 0.00 -1.26 -4.74 105.19 101.68 1s3s n GLY 318 Ca 0.14 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.66 1s3s n GLY 318 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1s3s n GLU 319 N 2.70 0.00 0.00 1.61 -0.58 -1.26 -3.22 120.64 119.90 1s3s n GLU 319 Ca 0.18 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.92 1s3s n GLU 319 Cb 0.39 -0.25 0.00 0.00 -0.57 0.00 0.00 31.44 31.02 1s3s n GLU 319 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 1s3s n VAL 320 N 0.25 0.00 -0.10 2.62 0.31 -1.26 -4.44 118.33 115.71 1s3s n VAL 320 Ca 0.00 0.00 -0.10 0.00 -0.01 0.00 0.00 64.34 64.23 1s3s n VAL 320 Cb 0.00 -0.56 -0.02 0.00 -0.91 0.00 0.00 33.84 32.35 1s3s n VAL 320 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 1s3s h GLU 321 N 0.00 0.46 -0.27 5.55 3.07 -1.91 -2.32 114.58 119.15 1s3s h GLU 321 Ca 0.00 -0.08 -0.15 0.00 -0.50 0.00 0.00 59.36 58.62 1s3s h GLU 321 Cb 0.71 -0.07 -0.00 0.00 -0.84 0.00 0.00 28.75 28.54 1s3s h GLU 321 CO 0.00 0.46 -0.43 -0.09 -1.40 0.00 0.00 179.01 177.55 1s3s h ARG 322 N 0.35 0.78 -0.42 2.33 2.43 -1.84 -2.62 114.38 115.38 1s3s h ARG 322 Ca 0.10 -0.47 0.03 0.00 -0.81 0.00 0.00 59.98 58.83 1s3s h ARG 322 Cb 0.18 0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.75 1s3s h ARG 322 CO -0.01 1.10 0.28 -0.09 -1.51 0.00 0.00 179.97 179.74 1s3s h ARG 323 N 0.53 0.46 -0.26 0.20 2.43 -1.76 0.53 114.38 116.50 1s3s h ARG 323 Ca 0.02 -0.03 -0.15 0.00 -0.81 0.00 0.00 59.98 59.01 1s3s h ARG 323 Cb 1.03 -0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 30.48 1s3s h ARG 323 CO 0.10 0.30 -0.43 0.82 -1.51 0.00 0.00 179.97 179.25 1s3s h ILE 324 N 0.47 1.30 -0.24 1.20 2.04 -1.23 -1.01 117.51 120.05 1s3s h ILE 324 Ca 0.17 -1.63 -0.00 0.00 1.00 0.00 0.00 64.86 64.40 1s3s h ILE 324 Cb 0.10 1.69 -0.01 0.00 -0.74 0.00 0.00 36.82 37.85 1s3s h ILE 324 CO -0.04 0.52 0.14 0.58 0.00 0.00 0.00 178.15 179.35 1s3s h VAL 325 N 0.50 1.09 -0.99 1.67 2.07 -0.92 -1.36 116.25 118.33 1s3s h VAL 325 Ca 0.02 -0.23 0.09 0.00 0.82 0.00 0.00 66.70 67.40 1s3s h VAL 325 Cb 1.03 0.82 -0.07 0.00 -1.52 0.00 0.00 31.29 31.55 1s3s h VAL 325 CO 0.10 0.09 0.63 0.28 0.02 0.00 0.00 177.57 178.69 1s3s h SER 326 N 0.29 0.97 -0.42 0.57 0.02 -0.80 -0.08 113.55 114.10 1s3s h SER 326 Ca 0.09 0.03 0.02 0.00 -0.84 0.00 0.00 61.79 61.08 1s3s h SER 326 Cb 0.03 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 62.36 1s3s h SER 326 CO -0.02 0.58 0.24 -0.61 -1.14 0.00 0.00 176.83 175.88 1s3s h GLN 327 N 1.08 0.47 -0.25 3.45 5.75 -0.56 -0.64 115.11 124.41 1s3s h GLN 327 Ca 0.45 -0.03 -0.04 0.00 -0.15 0.00 0.00 58.65 58.88 1s3s h GLN 327 Cb 0.30 -0.11 -0.01 0.00 1.07 0.00 0.00 27.48 28.73 1s3s h GLN 327 CO -0.21 0.31 -0.04 1.25 -2.65 0.00 0.00 178.83 177.49 1s3s h LEU 328 N 0.49 0.36 -0.41 -2.39 5.85 0.00 -1.55 115.31 117.66 1s3s h LEU 328 Ca 0.17 -0.06 -0.18 0.00 0.84 0.00 0.00 57.88 58.65 1s3s h LEU 328 Cb 0.02 -0.09 -0.00 0.00 0.37 0.00 0.00 40.66 40.96 1s3s h LEU 328 CO -0.09 0.45 -0.66 -0.07 -0.34 0.00 0.00 178.44 177.73 1s3s h LEU 329 N 0.37 0.63 -0.54 2.25 3.38 -0.58 -2.89 115.31 117.93 1s3s h LEU 329 Ca 0.08 -0.38 -0.02 0.00 0.09 0.00 0.00 57.88 57.66 1s3s h LEU 329 Cb 0.31 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 1s3s h LEU 329 CO 0.01 1.12 0.27 0.74 0.09 0.00 0.00 178.44 180.67 1s3s h THR 330 N 0.39 1.19 -0.24 0.22 2.02 -0.48 -2.17 112.91 113.84 1s3s h THR 330 Ca -0.02 -0.53 -0.04 0.00 0.77 0.00 0.00 66.41 66.60 1s3s h THR 330 Cb 1.23 0.55 -0.01 0.00 -1.74 0.00 0.00 68.15 68.18 1s3s h THR 330 CO 0.12 0.21 -0.03 -0.07 0.37 0.00 0.00 175.52 176.13 1s3s h LEU 331 N 0.72 0.34 -0.69 2.58 3.38 -1.28 0.78 115.31 121.14 1s3s h LEU 331 Ca 0.19 -0.06 -0.14 0.00 0.09 0.00 0.00 57.88 57.96 1s3s h LEU 331 Cb 0.09 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 1s3s h LEU 331 CO -0.03 0.42 -0.62 0.24 0.09 0.00 0.00 178.44 178.55 1s3s h MET 332 N 0.36 0.13 0.17 1.13 2.86 -1.25 -2.76 114.93 115.57 1s3s h MET 332 Ca 0.08 -0.09 -0.30 0.00 -2.06 0.00 0.00 59.70 57.33 1s3s h MET 332 Cb 0.28 0.02 0.02 0.00 0.06 0.00 0.00 31.60 31.98 1s3s h MET 332 CO 0.01 0.71 -1.35 -0.44 1.06 0.00 0.00 176.91 176.90 1s3s h ASP 333 N 0.10 0.57 0.55 1.22 5.19 -0.89 -3.27 116.42 119.89 1s3s h ASP 333 Ca -0.01 -0.62 0.00 0.00 -0.62 0.00 0.00 57.03 55.78 1s3s h ASP 333 Cb 1.12 -0.19 0.00 0.00 0.18 0.00 0.00 39.33 40.44 1s3s h ASP 333 CO 0.09 1.49 0.00 1.23 -3.12 0.00 0.00 179.24 178.93 1s3s h GLY 334 N 1.10 0.00 -2.06 2.75 0.00 -0.76 -3.43 103.07 100.66 1s3s h GLY 334 Ca -0.18 0.00 -0.53 0.00 0.00 0.00 0.00 47.33 46.61 1s3s h GLY 334 CO 0.23 0.00 0.47 1.08 0.00 0.00 0.00 176.54 178.32 1s3s s LEU 335 N -6.02 3.62 -0.13 3.11 1.43 -1.05 -5.03 118.68 114.60 1s3s s LEU 335 Ca -0.01 2.40 -0.12 0.00 -1.03 0.00 0.00 54.13 55.37 1s3s s LEU 335 Cb 0.11 -4.60 0.04 0.00 0.03 0.00 0.00 46.19 41.76 1s3s s LEU 335 CO 0.47 -1.69 0.35 -1.59 0.23 0.00 0.00 176.35 174.12 1s3s s LYS 336 N -3.40 0.41 0.51 1.70 -2.85 -1.26 -5.04 119.74 109.81 1s3s s LYS 336 Ca 0.77 0.50 0.44 0.00 -1.00 0.00 0.00 55.97 56.68 1s3s s LYS 336 Cb -0.31 0.19 1.65 0.00 -2.06 0.00 0.00 37.83 37.30 1s3s s LYS 336 CO 0.35 -0.05 1.58 1.96 0.10 0.00 0.00 175.35 179.28 1s3s h GLN 337 N 5.66 0.00 -0.84 1.78 1.08 -1.96 0.80 115.11 121.63 1s3s h GLN 337 Ca -0.27 -0.00 0.21 0.00 -1.45 0.00 0.00 58.65 57.14 1s3s h GLN 337 Cb 1.18 -0.00 -0.05 0.00 -0.05 0.00 0.00 27.48 28.56 1s3s h GLN 337 CO 0.29 0.00 0.57 0.00 -0.95 0.00 0.00 178.83 178.74 1s3s h ARG 338 N 0.00 0.23 0.00 1.46 3.08 -1.96 -1.69 114.38 115.50 1s3s h ARG 338 Ca 0.92 -0.01 -0.04 0.00 0.07 0.00 0.00 59.98 60.92 1s3s h ARG 338 Cb 3.42 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 33.42 1s3s h ARG 338 CO -0.19 0.15 -0.20 0.00 -1.07 0.00 0.00 179.97 178.66 1s3s h ALA 339 N 1.61 1.22 -5.87 0.04 0.00 0.22 -3.47 119.26 113.02 1s3s h ALA 339 Ca 0.42 -0.18 -0.37 0.00 0.00 0.00 0.00 54.91 54.77 1s3s h ALA 339 Cb 1.28 -0.03 0.11 0.00 0.00 0.00 0.00 17.79 19.15 1s3s h ALA 339 CO -0.10 0.25 -0.80 0.72 0.00 0.00 0.00 179.25 179.32 1s3s n HIS 340 N -3.65 -2.06 -4.68 0.00 8.25 -0.64 -4.69 115.22 107.75 1s3s n HIS 340 Ca -0.01 0.89 -0.23 0.00 -0.26 0.00 0.00 57.72 58.11 1s3s n HIS 340 Cb 0.33 -4.74 -0.15 0.00 1.12 0.00 0.00 29.99 26.54 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 -3.51 1.20 -0.16 1.59 1.01 -1.26 -2.21 120.40 117.06 1s3s s VAL 341 Ca 0.01 -0.69 0.00 0.00 0.00 0.00 0.00 61.98 61.30 1s3s s VAL 341 Cb -0.01 -1.01 0.02 0.00 0.00 0.00 0.00 36.38 35.39 1s3s s VAL 341 CO 0.77 0.31 -0.15 -0.63 0.00 0.00 0.00 175.10 175.40 1s3s s ILE 342 N -0.41 1.67 -0.18 2.22 1.01 -0.38 -4.81 121.20 120.33 1s3s s ILE 342 Ca 0.06 -0.72 -0.14 0.00 0.00 0.00 0.00 60.65 59.85 1s3s s ILE 342 Cb -0.06 -1.56 -0.04 0.00 0.01 0.00 0.00 42.46 40.80 1s3s s ILE 342 CO -0.00 0.45 0.33 -0.69 0.00 0.00 0.00 174.94 175.02 1s3s s VAL 343 N 1.45 5.27 -0.00 2.92 1.01 -0.08 -1.79 120.40 129.18 1s3s s VAL 343 Ca 0.05 0.59 0.06 0.00 0.00 0.00 0.00 61.98 62.67 1s3s s VAL 343 Cb -0.13 -3.66 -0.03 0.00 0.00 0.00 0.00 36.38 32.56 1s3s s VAL 343 CO -0.11 0.34 -0.16 -0.04 0.00 0.00 0.00 175.10 175.13 1s3s s MET 344 N 0.79 2.28 0.08 2.72 -1.94 0.79 -0.76 119.30 123.26 1s3s s MET 344 Ca 0.17 -0.85 0.02 0.00 -1.71 0.00 0.00 55.69 53.32 1s3s s MET 344 Cb -0.14 -2.27 -0.04 0.00 2.01 0.00 0.00 34.83 34.39 1s3s s MET 344 CO 0.06 0.58 -0.07 0.00 -0.01 0.00 0.00 175.02 175.58 1s3s s ALA 345 N -0.83 0.84 0.00 3.03 0.00 -0.60 -0.45 121.76 123.75 1s3s s ALA 345 Ca 0.13 -1.19 0.04 0.00 0.00 0.00 0.00 51.96 50.94 1s3s s ALA 345 Cb -0.11 0.14 -0.01 0.00 0.00 0.00 0.00 23.12 23.14 1s3s s ALA 345 CO 0.03 -0.19 -0.12 0.00 0.00 0.00 0.00 175.76 175.47 1s3s s ALA 346 N -3.10 1.04 0.19 0.00 0.00 -0.61 -0.19 121.76 119.09 1s3s s ALA 346 Ca 0.06 -0.59 -0.15 0.00 0.00 0.00 0.00 51.96 51.28 1s3s s ALA 346 Cb 0.02 -0.23 0.01 0.00 0.00 0.00 0.00 23.12 22.92 1s3s s ALA 346 CO -0.04 0.24 0.45 -0.08 0.00 0.00 0.00 175.76 176.33 1s3s s THR 347 N -0.43 0.03 0.10 0.00 -1.32 -0.26 -1.72 115.64 112.04 1s3s s THR 347 Ca 0.04 -1.03 -0.15 0.00 -1.21 0.00 0.00 61.69 59.34 1s3s s THR 347 Cb -0.05 -1.73 -0.08 0.00 -1.51 0.00 0.00 72.50 69.12 1s3s s THR 347 CO -0.00 -0.16 1.42 0.78 -2.21 0.00 0.00 174.62 174.46 1s3s h ASN 348 N 2.30 0.75 -4.93 8.08 -0.26 -1.85 -2.67 115.58 117.00 1s3s h ASN 348 Ca -0.29 -0.47 0.01 0.00 -0.56 0.00 0.00 56.30 54.99 1s3s h ASN 348 Cb 1.25 -0.21 -0.13 0.00 -1.06 0.00 0.00 38.32 38.17 1s3s h ASN 348 CO 0.40 1.06 0.27 0.00 -1.06 0.00 0.00 177.43 178.10 1s3s s ARG 349 N -4.37 1.19 0.16 0.81 1.70 -1.26 -2.71 118.95 114.47 1s3s s ARG 349 Ca -0.12 -0.44 -0.24 0.00 -0.47 0.00 0.00 55.73 54.46 1s3s s ARG 349 Cb 0.09 0.55 0.05 0.00 -0.57 0.00 0.00 34.95 35.06 1s3s s ARG 349 CO 0.83 -0.52 1.60 -1.35 -1.08 0.00 0.00 175.30 174.77 1s3s h PRO 350 N 2.00 -0.26 -1.51 3.89 0.11 -1.96 -2.36 132.00 131.89 1s3s h PRO 350 Ca -0.32 0.02 0.44 0.00 0.11 0.00 0.00 66.00 66.25 1s3s h PRO 350 Cb 1.30 0.06 -0.06 0.00 0.11 0.00 0.00 31.00 32.41 1s3s h PRO 350 CO 0.37 -0.18 1.15 -0.91 -0.21 0.00 0.00 178.00 178.22 1s3s h ASN 351 N -0.27 0.00 -0.08 -2.05 -0.26 -2.02 -0.31 115.58 110.59 1s3s h ASN 351 Ca 0.16 0.00 -0.02 0.00 -0.56 0.00 0.00 56.30 55.89 1s3s h ASN 351 Cb 0.55 0.00 -0.00 0.00 -1.06 0.00 0.00 38.32 37.80 1s3s h ASN 351 CO -0.53 0.00 -0.01 0.28 -1.06 0.00 0.00 177.43 176.11 1s3s h SER 352 N 0.00 0.15 -4.03 5.81 0.02 -1.83 -3.45 113.55 110.21 1s3s h SER 352 Ca 0.72 -0.34 -0.49 0.00 -0.84 0.00 0.00 61.79 60.84 1s3s h SER 352 Cb 3.01 -0.04 0.17 0.00 0.14 0.00 0.00 62.40 65.68 1s3s h SER 352 CO -0.01 0.45 0.22 -0.63 -1.14 0.00 0.00 176.83 175.72 1s3s s ILE 353 N -4.84 2.53 -0.15 3.27 -1.09 -0.13 -4.40 121.20 116.39 1s3s s ILE 353 Ca -0.15 0.17 -0.20 0.00 -2.23 0.00 0.00 60.65 58.24 1s3s s ILE 353 Cb 0.04 -2.48 -0.03 0.00 -1.58 0.00 0.00 42.46 38.41 1s3s s ILE 353 CO 0.70 -0.22 0.58 -0.62 -1.23 0.00 0.00 174.94 174.14 1s3s s ASP 354 N -3.10 6.72 0.28 3.58 2.15 -0.93 -4.50 116.67 120.87 1s3s s ASP 354 Ca 0.65 0.86 0.17 0.00 0.43 0.00 0.00 52.55 54.66 1s3s s ASP 354 Cb -0.20 -2.33 0.99 0.00 -0.30 0.00 0.00 42.92 41.08 1s3s s ASP 354 CO 0.58 -0.15 1.14 -2.65 -0.17 0.00 0.00 175.17 173.93 1s3s n PRO 355 N 4.36 -0.04 0.27 4.34 -0.02 -1.26 -0.38 135.00 142.27 1s3s n PRO 355 Ca -0.04 0.98 0.13 0.00 -2.02 0.00 0.00 63.50 62.55 1s3s n PRO 355 Cb 0.51 -1.79 0.76 0.00 -0.02 0.00 0.00 33.50 32.96 1s3s n PRO 355 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1s3s h ALA 356 N 1.40 1.41 0.00 3.55 0.00 -1.97 -2.36 119.26 121.29 1s3s h ALA 356 Ca 0.62 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 55.40 1s3s h ALA 356 Cb 1.69 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.46 1s3s h ALA 356 CO -0.52 0.11 -0.26 -0.07 0.00 0.00 0.00 179.25 178.51 1s3s h LEU 357 N 0.00 0.00 0.00 0.00 3.38 -1.11 -2.12 115.31 115.46 1s3s h LEU 357 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1s3s h LEU 357 Cb 0.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.97 1s3s h LEU 357 CO 0.01 0.26 -0.58 0.54 0.09 0.00 0.00 178.44 178.76 1s3s n ARG 358 N -3.77 0.29 -1.60 1.13 1.74 -0.90 -0.12 116.66 113.43 1s3s n ARG 358 Ca -0.01 0.09 -0.48 0.00 -0.77 0.00 0.00 57.85 56.68 1s3s n ARG 358 Cb 0.36 -1.69 -0.04 0.00 -1.02 0.00 0.00 32.46 30.07 1s3s n ARG 358 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 1s3s n ARG 359 N -2.12 1.36 -1.67 5.56 0.63 -0.80 -4.38 116.66 115.25 1s3s n ARG 359 Ca 0.03 0.49 -0.52 0.00 -0.92 0.00 0.00 57.85 56.93 1s3s n ARG 359 Cb 0.44 -2.05 -0.06 0.00 0.45 0.00 0.00 32.46 31.24 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 1.83 2.02 0.00 -0.14 3.01 -1.26 -1.86 117.46 121.05 1s3s n PHE 360 Ca 0.15 0.40 0.00 0.00 1.01 0.00 0.00 57.45 59.01 1s3s n PHE 360 Cb 0.25 -2.49 0.00 0.00 -0.01 0.00 0.00 39.48 37.23 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 3.73 1.27 0.00 1.37 0.00 -1.26 -5.01 105.19 105.30 1s3s n GLY 361 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.24 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 -0.28 0.00 -2.39 1.61 1.74 -0.78 -4.60 116.66 111.96 1s3s n ARG 362 Ca 0.00 0.00 -0.43 0.00 -0.77 0.00 0.00 57.85 56.65 1s3s n ARG 362 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.44 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 3.74 0.82 -1.55 3.72 0.83 -2.46 117.46 122.54 1s3s n PHE 363 Ca 0.00 -2.97 0.13 0.00 -0.05 0.00 0.00 57.45 54.56 1s3s n PHE 363 Cb 0.00 -2.20 0.42 0.00 -0.94 0.00 0.00 39.48 36.76 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 5.24 0.45 -4.59 4.37 5.68 -1.24 -4.30 116.55 122.15 1s3s n ASP 364 Ca 0.43 0.34 -0.30 0.00 -0.50 0.00 0.00 54.79 54.75 1s3s n ASP 364 Cb 0.39 -0.36 -0.10 0.00 -1.14 0.00 0.00 41.12 39.92 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 -3.06 2.26 -0.03 0.11 1.81 -1.05 -5.03 118.95 113.97 1s3s s ARG 365 Ca 0.11 -0.94 -0.05 0.00 -1.72 0.00 0.00 55.73 53.12 1s3s s ARG 365 Cb 0.16 -2.37 0.01 0.00 -0.45 0.00 0.00 34.95 32.29 1s3s s ARG 365 CO 0.61 0.53 0.13 -1.21 -0.68 0.00 0.00 175.30 174.68 1s3s s GLU 366 N -2.08 0.30 -0.04 3.54 2.02 -1.26 0.42 118.70 121.60 1s3s s GLU 366 Ca 0.21 -0.09 -0.01 0.00 0.02 0.00 0.00 54.97 55.10 1s3s s GLU 366 Cb -0.11 0.13 0.03 0.00 0.10 0.00 0.00 34.13 34.28 1s3s s GLU 366 CO 0.13 -0.06 0.08 0.08 0.02 0.00 0.00 175.26 175.51 1s3s s VAL 367 N -0.59 -0.09 -0.07 2.63 1.01 0.71 -4.89 120.40 119.12 1s3s s VAL 367 Ca -0.07 0.27 -0.22 0.00 0.00 0.00 0.00 61.98 61.97 1s3s s VAL 367 Cb -0.04 -0.16 -0.04 0.00 0.00 0.00 0.00 36.38 36.14 1s3s s VAL 367 CO 0.01 0.11 0.63 -0.62 0.00 0.00 0.00 175.10 175.23 1s3s s ASP 368 N 1.49 6.91 -0.51 3.32 2.15 -1.26 -1.67 116.67 127.09 1s3s s ASP 368 Ca -0.05 1.09 0.04 0.00 0.43 0.00 0.00 52.55 54.06 1s3s s ASP 368 Cb -0.12 -2.37 0.16 0.00 -0.30 0.00 0.00 42.92 40.28 1s3s s ASP 368 CO -0.04 -0.05 0.36 -0.63 -0.17 0.00 0.00 175.17 174.64 1s3s s ILE 369 N 0.58 1.38 0.00 4.11 1.01 0.13 -4.87 121.20 123.54 1s3s s ILE 369 Ca 0.34 -3.11 0.00 0.00 0.00 0.00 0.00 60.65 57.88 1s3s s ILE 369 Cb -0.17 -1.93 0.00 0.00 0.01 0.00 0.00 42.46 40.36 1s3s s ILE 369 CO 0.16 -1.08 0.00 0.61 0.00 0.00 0.00 174.94 174.63 1s3s n GLY 370 N 2.77 -0.25 3.77 6.18 0.00 -1.26 -4.28 105.19 112.12 1s3s n GLY 370 Ca 0.21 -1.75 -0.41 0.00 0.00 0.00 0.00 46.02 44.07 1s3s n GLY 370 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1s3s s ILE 371 N 0.01 2.35 0.79 -0.61 1.09 -1.26 -4.97 121.20 118.60 1s3s s ILE 371 Ca 0.00 0.35 -0.11 0.00 -1.10 0.00 0.00 60.65 59.79 1s3s s ILE 371 Cb 0.00 -3.22 0.07 0.00 -1.06 0.00 0.00 42.46 38.25 1s3s s ILE 371 CO 0.00 0.08 1.09 -2.84 -0.10 0.00 0.00 174.94 173.17 1s3s s PRO 372 N -1.95 2.10 0.00 2.79 0.02 -1.26 -5.08 135.00 131.63 1s3s s PRO 372 Ca 0.51 0.95 0.00 0.00 0.02 0.00 0.00 61.00 62.48 1s3s s PRO 372 Cb -0.44 -1.90 0.00 0.00 0.02 0.00 0.00 34.50 32.19 1s3s s PRO 372 CO 0.59 -1.69 0.00 -0.40 -0.33 0.00 0.00 177.00 175.17 1s3s n ASP 373 N -3.53 0.00 -0.05 2.53 5.68 -1.26 -4.72 116.55 115.20 1s3s n ASP 373 Ca 0.08 -0.67 -0.08 0.00 -0.50 0.00 0.00 54.79 53.61 1s3s n ASP 373 Cb 0.54 0.00 -0.02 0.00 -1.14 0.00 0.00 41.12 40.50 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 -0.42 0.25 0.17 2.12 0.00 -1.94 0.12 119.26 119.56 1s3s h ALA 374 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1s3s h ALA 374 Cb 0.00 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1s3s h ALA 374 CO 0.00 -0.35 -0.18 1.15 0.00 0.00 0.00 179.25 179.87 1s3s h THR 375 N 0.17 0.60 0.19 0.00 2.02 -1.96 -2.41 112.91 111.53 1s3s h THR 375 Ca 0.10 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.28 1s3s h THR 375 Cb 0.08 0.60 -0.03 0.00 -1.74 0.00 0.00 68.15 67.06 1s3s h THR 375 CO -0.11 0.00 -0.41 1.23 0.37 0.00 0.00 175.52 176.60 1s3s h GLY 376 N -0.39 -1.17 -0.31 2.16 0.00 -1.81 -2.14 103.07 99.41 1s3s h GLY 376 Ca 0.00 0.59 0.28 0.00 0.00 0.00 0.00 47.33 48.21 1s3s h GLY 376 CO -0.05 -0.32 0.62 3.21 0.00 0.00 0.00 176.54 180.00 1s3s h ARG 377 N -0.66 0.43 0.60 4.80 3.08 -0.76 -0.75 114.38 121.12 1s3s h ARG 377 Ca -0.02 -0.03 -0.03 0.00 0.07 0.00 0.00 59.98 59.97 1s3s h ARG 377 Cb 0.63 -0.10 0.01 0.00 0.08 0.00 0.00 29.97 30.59 1s3s h ARG 377 CO -0.17 0.28 -0.29 1.25 -1.07 0.00 0.00 179.97 179.98 1s3s h LEU 378 N 0.44 -0.68 -0.86 3.04 5.85 -0.89 -0.36 115.31 121.85 1s3s h LEU 378 Ca 0.67 0.02 0.12 0.00 0.84 0.00 0.00 57.88 59.53 1s3s h LEU 378 Cb 1.49 0.18 -0.08 0.00 0.37 0.00 0.00 40.66 42.62 1s3s h LEU 378 CO -0.48 -0.48 0.48 -0.33 -0.34 0.00 0.00 178.44 177.29 1s3s h GLU 379 N -0.81 0.72 -0.45 1.25 5.08 -0.57 -0.37 114.58 119.42 1s3s h GLU 379 Ca -0.08 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.24 1s3s h GLU 379 Cb 0.62 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.69 1s3s h GLU 379 CO 0.14 0.48 0.29 0.82 -1.00 0.00 0.00 179.01 179.73 1s3s h ILE 380 N 0.74 1.12 -0.76 3.13 2.04 -0.87 -0.46 117.51 122.45 1s3s h ILE 380 Ca 0.44 -0.25 0.02 0.00 1.00 0.00 0.00 64.86 66.08 1s3s h ILE 380 Cb 0.51 0.48 -0.04 0.00 -0.74 0.00 0.00 36.82 37.02 1s3s h ILE 380 CO -0.30 0.12 0.49 -0.07 0.00 0.00 0.00 178.15 178.40 1s3s h LEU 381 N 0.61 0.83 -1.07 1.44 3.38 0.42 -1.51 115.31 119.41 1s3s h LEU 381 Ca 0.17 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.10 1s3s h LEU 381 Cb -0.05 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.47 1s3s h LEU 381 CO -0.03 0.58 0.34 1.56 0.09 0.00 0.00 178.44 180.98 1s3s h GLN 382 N 0.98 0.99 -0.39 1.13 4.20 -0.27 -2.20 115.11 119.56 1s3s h GLN 382 Ca 0.30 -0.13 -0.08 0.00 0.06 0.00 0.00 58.65 58.79 1s3s h GLN 382 Cb -0.04 -0.19 -0.02 0.00 0.30 0.00 0.00 27.48 27.54 1s3s h GLN 382 CO -0.09 0.76 -0.10 0.82 -0.67 0.00 0.00 178.83 179.55 1s3s h ILE 383 N 0.99 1.25 -0.42 2.54 2.04 -0.25 -2.91 117.51 120.75 1s3s h ILE 383 Ca 0.24 -1.10 -0.08 0.00 1.00 0.00 0.00 64.86 64.92 1s3s h ILE 383 Cb 0.10 1.06 -0.05 0.00 -0.74 0.00 0.00 36.82 37.19 1s3s h ILE 383 CO -0.03 0.37 0.10 1.41 0.00 0.00 0.00 178.15 180.00 1s3s n HIS 384 N -4.18 1.43 0.00 1.37 8.25 -0.65 -3.72 115.22 117.72 1s3s n HIS 384 Ca 0.01 -0.67 0.00 0.00 -0.26 0.00 0.00 57.72 56.80 1s3s n HIS 384 Cb 0.34 -0.44 0.00 0.00 1.12 0.00 0.00 29.99 31.02 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 0.15 0.00 0.13 1.59 -2.24 -1.16 -4.84 114.28 107.91 1s3s n THR 385 Ca 0.22 -0.10 0.16 0.00 -2.27 0.00 0.00 64.05 62.05 1s3s n THR 385 Cb 0.93 0.83 0.48 0.00 -2.10 0.00 0.00 70.33 70.47 1s3s n THR 385 CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 1s3s h LYS 386 N 0.00 0.00 -0.22 -0.78 2.10 -1.59 0.64 116.57 116.72 1s3s h LYS 386 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1s3s h LYS 386 Cb 0.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.33 1s3s h LYS 386 CO 0.00 0.00 0.00 0.09 -2.00 0.00 0.00 179.45 177.54 1s3s n ASN 387 N -3.06 2.84 -4.56 7.07 3.02 -1.26 -4.55 115.26 114.76 1s3s n ASN 387 Ca 0.07 -1.83 -0.24 0.00 -0.03 0.00 0.00 54.58 52.55 1s3s n ASN 387 Cb 0.91 -0.14 -0.09 0.00 -0.61 0.00 0.00 39.78 39.85 1s3s n ASN 387 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1s3s s MET 388 N -1.29 1.92 -0.62 3.52 0.23 0.22 0.08 119.30 123.37 1s3s s MET 388 Ca 0.27 -1.73 -0.20 0.00 -1.03 0.00 0.00 55.69 52.99 1s3s s MET 388 Cb 0.16 -1.87 0.09 0.00 -1.53 0.00 0.00 34.83 31.69 1s3s s MET 388 CO 0.23 0.25 0.79 0.21 -2.03 0.00 0.00 175.02 174.47 1s3s s LYS 389 N -3.61 3.08 0.28 3.16 2.20 -1.26 -4.97 119.74 118.61 1s3s s LYS 389 Ca 0.32 -1.19 -0.21 0.00 -0.36 0.00 0.00 55.97 54.53 1s3s s LYS 389 Cb -0.03 -4.27 -0.09 0.00 -1.51 0.00 0.00 37.83 31.94 1s3s s LYS 389 CO 0.17 -1.63 0.81 -0.51 -0.36 0.00 0.00 175.35 173.83 1s3s s LEU 390 N 3.10 4.29 0.44 5.43 1.43 -1.26 -1.26 118.68 130.85 1s3s s LEU 390 Ca 0.15 1.56 -0.17 0.00 -1.03 0.00 0.00 54.13 54.64 1s3s s LEU 390 Cb -0.21 -3.83 -0.09 0.00 0.03 0.00 0.00 46.19 42.08 1s3s s LEU 390 CO 0.07 -0.05 0.90 0.00 0.23 0.00 0.00 176.35 177.51 1s3s s ALA 391 N -1.63 3.14 0.50 4.21 0.00 -0.68 -4.86 121.76 122.44 1s3s s ALA 391 Ca 0.47 0.19 0.37 0.00 0.00 0.00 0.00 51.96 52.99 1s3s s ALA 391 Cb -0.16 -3.02 2.00 0.00 0.00 0.00 0.00 23.12 21.94 1s3s s ALA 391 CO 0.21 0.02 2.12 -0.44 0.00 0.00 0.00 175.76 177.68 1s3s h ASP 392 N 1.54 0.00 1.25 0.00 3.32 -1.97 0.82 116.42 121.39 1s3s h ASP 392 Ca -0.48 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.57 1s3s h ASP 392 Cb 1.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.73 1s3s h ASP 392 CO 0.62 0.00 -0.02 -0.90 -1.72 0.00 0.00 179.24 177.23 1s3s n ASP 393 N -2.87 0.47 -4.64 6.45 5.68 -1.26 -4.76 116.55 115.62 1s3s n ASP 393 Ca -0.02 0.53 -0.43 0.00 -0.50 0.00 0.00 54.79 54.36 1s3s n ASP 393 Cb 0.14 -0.64 -0.02 0.00 -1.14 0.00 0.00 41.12 39.46 1s3s n ASP 393 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 1s3s s VAL 394 N -3.06 4.32 -0.65 2.12 1.01 0.28 -4.57 120.40 119.85 1s3s s VAL 394 Ca 0.12 1.51 -0.04 0.00 0.00 0.00 0.00 61.98 63.57 1s3s s VAL 394 Cb 0.15 -4.27 0.17 0.00 0.00 0.00 0.00 36.38 32.43 1s3s s VAL 394 CO 0.57 -0.46 0.48 -0.62 0.00 0.00 0.00 175.10 175.07 1s3s s ASP 395 N 2.21 5.40 0.49 3.32 -1.08 -1.26 -4.93 116.67 120.81 1s3s s ASP 395 Ca 0.51 -2.85 0.22 0.00 -0.52 0.00 0.00 52.55 49.91 1s3s s ASP 395 Cb -0.15 -1.89 1.26 0.00 -1.46 0.00 0.00 42.92 40.68 1s3s s ASP 395 CO 0.19 -0.39 1.95 -0.07 0.52 0.00 0.00 175.17 177.38 1s3s h LEU 396 N 7.09 0.16 -2.11 -1.34 3.38 -1.98 0.36 115.31 120.88 1s3s h LEU 396 Ca -0.00 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 1s3s h LEU 396 Cb 0.96 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.69 1s3s h LEU 396 CO 0.72 0.08 -0.03 -0.08 0.09 0.00 0.00 178.44 179.22 1s3s h GLU 397 N 0.17 0.00 0.01 1.13 4.81 -1.95 0.90 114.58 119.66 1s3s h GLU 397 Ca 0.32 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.55 1s3s h GLU 397 Cb 1.01 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.39 1s3s h GLU 397 CO -0.05 0.03 -0.01 0.37 -0.73 0.00 0.00 179.01 178.62 1s3s h GLN 398 N 0.00 -0.02 -0.48 1.92 5.75 -0.64 -2.35 115.11 119.29 1s3s h GLN 398 Ca -0.00 0.00 0.09 0.00 -0.15 0.00 0.00 58.65 58.59 1s3s h GLN 398 Cb 0.29 0.00 -0.08 0.00 1.07 0.00 0.00 27.48 28.77 1s3s h GLN 398 CO 0.00 0.58 0.02 0.28 -2.65 0.00 0.00 178.83 177.07 1s3s h VAL 399 N -0.98 0.65 -0.91 2.39 2.07 -1.19 0.25 116.25 118.53 1s3s h VAL 399 Ca -0.00 -0.05 0.06 0.00 0.82 0.00 0.00 66.70 67.53 1s3s h VAL 399 Cb 0.61 0.50 -0.06 0.00 -1.52 0.00 0.00 31.29 30.82 1s3s h VAL 399 CO 0.00 0.03 0.59 0.00 0.02 0.00 0.00 177.57 178.21 1s3s h ALA 400 N 1.42 1.51 -0.47 1.67 0.00 -0.92 -2.88 119.26 119.59 1s3s h ALA 400 Ca 0.24 -0.02 -0.62 0.00 0.00 0.00 0.00 54.91 54.51 1s3s h ALA 400 Cb 0.35 -0.27 -0.11 0.00 0.00 0.00 0.00 17.79 17.76 1s3s h ALA 400 CO -0.38 0.35 1.84 -1.71 0.00 0.00 0.00 179.25 179.36 1s3s n ASN 401 N -4.49 7.50 0.00 0.00 2.85 0.86 -3.09 115.26 118.89 1s3s n ASN 401 Ca 0.14 -3.02 0.00 0.00 -0.11 0.00 0.00 54.58 51.58 1s3s n ASN 401 Cb 0.20 -1.36 0.00 0.00 1.24 0.00 0.00 39.78 39.86 1s3s n ASN 401 CO 0.00 0.00 0.00 -1.84 -2.11 0.00 0.00 177.26 173.31 1s3s n GLU 402 N 1.82 0.00 -0.85 1.20 0.28 -1.10 -4.94 120.64 117.05 1s3s n GLU 402 Ca 0.60 0.00 0.05 0.00 -0.16 0.00 0.00 57.16 57.65 1s3s n GLU 402 Cb 0.38 0.00 0.14 0.00 1.43 0.00 0.00 31.44 33.39 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 0.00 1.45 0.00 3.84 -2.24 -1.17 -4.96 114.28 111.20 1s3s n THR 403 Ca 0.00 -2.42 0.00 0.00 -2.27 0.00 0.00 64.05 59.36 1s3s n THR 403 Cb 0.00 0.17 0.00 0.00 -2.10 0.00 0.00 70.33 68.40 1s3s n THR 403 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1s3s n HIS 404 N -0.60 0.00 -0.36 4.78 8.25 -1.26 -1.92 115.22 124.11 1s3s n HIS 404 Ca 0.14 0.00 0.07 0.00 -0.26 0.00 0.00 57.72 57.67 1s3s n HIS 404 Cb 0.83 -0.25 0.24 0.00 1.12 0.00 0.00 29.99 31.93 1s3s n HIS 404 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 1s3s h GLY 405 N 0.00 1.61 -3.95 -1.41 0.00 -1.93 -3.45 103.07 93.93 1s3s h GLY 405 Ca 0.00 -0.43 -0.60 0.00 0.00 0.00 0.00 47.33 46.30 1s3s h GLY 405 CO 0.00 0.19 -1.06 1.42 0.00 0.00 0.00 176.54 177.09 1s3s n HIS 406 N -4.60 -2.59 -4.06 5.60 -0.00 -0.81 -4.91 115.22 103.86 1s3s n HIS 406 Ca 0.18 0.48 -0.25 0.00 -0.00 0.00 0.00 57.72 58.13 1s3s n HIS 406 Cb 0.33 -1.72 -0.05 0.00 -0.00 0.00 0.00 29.99 28.54 1s3s n HIS 406 CO 0.00 0.00 0.00 0.14 -0.00 0.00 0.00 176.34 176.48 1s3s s VAL 407 N -1.94 2.11 0.19 1.59 -7.23 -1.26 -4.55 120.40 109.31 1s3s s VAL 407 Ca 0.58 -1.63 -0.22 0.00 -1.81 0.00 0.00 61.98 58.90 1s3s s VAL 407 Cb -0.51 -2.74 0.11 0.00 0.56 0.00 0.00 36.38 33.80 1s3s s VAL 407 CO 0.65 0.00 1.57 1.23 -0.31 0.00 0.00 175.10 178.24 1s3s h GLY 408 N 1.22 -0.20 0.12 2.32 0.00 -1.86 0.13 103.07 104.80 1s3s h GLY 408 Ca -0.41 0.50 0.19 0.00 0.00 0.00 0.00 47.33 47.61 1s3s h GLY 408 CO 0.66 -0.18 0.61 0.00 0.00 0.00 0.00 176.54 177.63 1s3s h ALA 409 N 0.94 1.70 0.03 3.60 0.00 -1.62 0.13 119.26 124.04 1s3s h ALA 409 Ca 0.24 0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.22 1s3s h ALA 409 Cb 0.56 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.27 1s3s h ALA 409 CO -0.75 -0.07 -0.02 -0.44 0.00 0.00 0.00 179.25 177.97 1s3s h ASP 410 N 0.75 -0.04 -0.70 0.00 3.32 -1.05 -2.06 116.42 116.64 1s3s h ASP 410 Ca 0.58 -0.31 0.02 0.00 0.02 0.00 0.00 57.03 57.34 1s3s h ASP 410 Cb 0.93 0.01 -0.04 0.00 0.22 0.00 0.00 39.33 40.45 1s3s h ASP 410 CO -0.38 0.30 0.46 -0.07 -1.72 0.00 0.00 179.24 177.83 1s3s h LEU 411 N -0.38 0.75 -0.04 1.55 3.38 -0.66 0.13 115.31 120.04 1s3s h LEU 411 Ca -0.00 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 1s3s h LEU 411 Cb 0.35 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.92 1s3s h LEU 411 CO 0.01 0.52 0.02 0.00 0.09 0.00 0.00 178.44 179.08 1s3s h ALA 412 N 1.59 0.06 -0.27 1.53 0.00 -0.89 -1.47 119.26 119.80 1s3s h ALA 412 Ca 0.27 -0.10 -0.05 0.00 0.00 0.00 0.00 54.91 55.03 1s3s h ALA 412 Cb 0.01 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1s3s h ALA 412 CO -0.07 -0.35 -0.04 0.00 0.00 0.00 0.00 179.25 178.79 1s3s h ALA 413 N 0.84 1.42 0.10 0.00 0.00 -0.82 -2.56 119.26 118.23 1s3s h ALA 413 Ca 0.01 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1s3s h ALA 413 Cb 0.19 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1s3s h ALA 413 CO -0.00 0.41 -0.10 1.25 0.00 0.00 0.00 179.25 180.81 1s3s h LEU 414 N 0.41 -0.25 -0.25 0.00 5.85 -0.17 -1.45 115.31 119.45 1s3s h LEU 414 Ca 0.09 0.02 0.04 0.00 0.84 0.00 0.00 57.88 58.88 1s3s h LEU 414 Cb 0.34 0.09 -0.04 0.00 0.37 0.00 0.00 40.66 41.42 1s3s h LEU 414 CO 0.01 -0.15 -0.02 0.00 -0.34 0.00 0.00 178.44 177.94 1s3s h SER 416 N 0.05 -0.00 -0.67 0.00 0.02 -1.11 0.62 113.55 112.46 1s3s h SER 416 Ca 0.12 0.11 -0.06 0.00 -0.84 0.00 0.00 61.79 61.12 1s3s h SER 416 Cb 0.16 0.15 -0.03 0.00 0.14 0.00 0.00 62.40 62.83 1s3s h SER 416 CO -0.22 0.01 0.19 -0.33 -1.14 0.00 0.00 176.83 175.34 1s3s h GLU 417 N 0.26 1.07 0.11 3.45 4.39 -0.72 0.00 114.58 123.14 1s3s h GLU 417 Ca 0.31 -0.23 0.01 0.00 0.34 0.00 0.00 59.36 59.79 1s3s h GLU 417 Cb 0.46 -0.15 -0.02 0.00 -0.10 0.00 0.00 28.75 28.94 1s3s h GLU 417 CO -0.40 0.93 -0.15 0.00 -1.16 0.00 0.00 179.01 178.22 1s3s h ALA 418 N 1.18 -0.27 0.14 3.43 0.00 0.07 0.86 119.26 124.68 1s3s h ALA 418 Ca 0.22 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.12 1s3s h ALA 418 Cb 0.32 0.23 -0.04 0.00 0.00 0.00 0.00 17.79 18.30 1s3s h ALA 418 CO -0.00 -0.68 -0.39 0.00 0.00 0.00 0.00 179.25 178.18 1s3s h ALA 419 N 0.53 -0.70 -0.99 0.00 0.00 -0.56 -0.36 119.26 117.19 1s3s h ALA 419 Ca 0.02 -0.07 0.14 0.00 0.00 0.00 0.00 54.91 54.99 1s3s h ALA 419 Cb 0.32 0.64 -0.09 0.00 0.00 0.00 0.00 17.79 18.66 1s3s h ALA 419 CO -0.07 -0.96 0.61 -0.07 0.00 0.00 0.00 179.25 178.76 1s3s h LEU 420 N -0.64 0.86 0.54 0.00 3.38 -0.80 0.12 115.31 118.77 1s3s h LEU 420 Ca 0.02 0.06 -0.02 0.00 0.09 0.00 0.00 57.88 58.03 1s3s h LEU 420 Cb 0.66 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.30 1s3s h LEU 420 CO -0.21 0.42 -0.36 -0.61 0.09 0.00 0.00 178.44 177.77 1s3s h GLN 421 N 0.91 -0.82 -1.02 1.13 5.75 0.09 0.53 115.11 121.67 1s3s h GLN 421 Ca 0.51 0.06 0.36 0.00 -0.15 0.00 0.00 58.65 59.42 1s3s h GLN 421 Cb 0.59 0.19 -0.16 0.00 1.07 0.00 0.00 27.48 29.17 1s3s h GLN 421 CO -0.30 -0.55 0.58 0.00 -2.65 0.00 0.00 178.83 175.92 1s3s h ALA 422 N -1.35 2.08 -0.16 3.38 0.00 0.13 0.91 119.26 124.24 1s3s h ALA 422 Ca -0.07 0.21 -0.15 0.00 0.00 0.00 0.00 54.91 54.90 1s3s h ALA 422 Cb 0.69 0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.69 1s3s h ALA 422 CO 0.06 -0.74 -0.47 0.82 0.00 0.00 0.00 179.25 178.92 1s3s h ILE 423 N 0.22 1.34 -0.76 0.00 2.04 -0.04 -2.71 117.51 117.59 1s3s h ILE 423 Ca 0.77 -1.73 0.00 0.00 1.00 0.00 0.00 64.86 64.91 1s3s h ILE 423 Cb 1.90 1.99 -0.04 0.00 -0.74 0.00 0.00 36.82 39.94 1s3s h ILE 423 CO -0.64 0.53 0.48 0.03 0.00 0.00 0.00 178.15 178.55 1s3s h ARG 424 N 0.26 1.01 0.00 2.37 3.08 0.59 -0.30 114.38 121.40 1s3s h ARG 424 Ca -0.01 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 59.96 1s3s h ARG 424 Cb 1.09 -0.22 0.00 0.00 0.08 0.00 0.00 29.97 30.91 1s3s h ARG 424 CO 0.10 0.69 0.00 1.63 -1.07 0.00 0.00 179.97 181.32 1s3s n LYS 425 N -4.40 0.00 0.24 0.04 5.02 0.37 -3.88 118.16 115.54 1s3s n LYS 425 Ca 0.08 0.00 0.10 0.00 -2.02 0.00 0.00 58.31 56.47 1s3s n LYS 425 Cb 0.05 -0.75 0.58 0.00 -0.02 0.00 0.00 35.03 34.88 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 0.00 1.97 6.56 -1.60 -3.37 116.57 120.14 1s3s h LYS 426 Ca 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.59 1s3s h LYS 426 Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.66 1s3s h LYS 426 CO 0.00 0.20 -0.94 -1.33 -2.06 0.00 0.00 179.45 175.32 1s3s n MET 427 N -3.63 0.50 -0.44 3.15 2.00 -0.24 -4.18 117.12 114.27 1s3s n MET 427 Ca -0.01 0.20 0.36 0.00 0.00 0.00 0.00 57.70 58.25 1s3s n MET 427 Cb 0.33 -1.37 0.65 0.00 0.00 0.00 0.00 33.22 32.83 1s3s n MET 427 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 175.97 176.19 1s3s h ASP 428 N -0.94 0.23 0.00 7.83 1.82 -1.36 -1.33 116.42 122.67 1s3s h ASP 428 Ca 0.00 0.11 0.00 0.00 -0.39 0.00 0.00 57.03 56.75 1s3s h ASP 428 Cb 0.94 0.09 0.00 0.00 0.68 0.00 0.00 39.33 41.04 1s3s h ASP 428 CO 0.00 -0.12 0.00 0.18 -1.61 0.00 0.00 179.24 177.69 1s3s n LEU 429 N -4.58 0.77 0.00 2.28 4.77 -1.26 -3.50 117.00 115.48 1s3s n LEU 429 Ca 0.36 0.16 0.00 0.00 -0.03 0.00 0.00 56.01 56.49 1s3s n LEU 429 Cb 1.40 -0.28 0.00 0.00 -2.33 0.00 0.00 43.42 42.21 1s3s n LEU 429 CO 0.25 -0.28 0.11 -0.38 -1.33 0.00 0.00 177.39 175.76 1s3s n ILE 430 N -1.64 0.00 -2.85 -0.08 2.08 -1.21 -1.51 119.36 114.15 1s3s n ILE 430 Ca 0.00 0.00 -0.11 0.00 0.56 0.00 0.00 62.75 63.20 1s3s n ILE 430 Cb 0.00 -0.82 0.05 0.00 -0.75 0.00 0.00 39.64 38.12 1s3s n ILE 430 CO 0.00 0.00 0.00 -0.67 0.56 0.00 0.00 176.55 176.44 1s3s n ASP 431 N -0.65 -1.59 -0.14 4.38 4.64 -0.50 -4.93 116.55 117.76 1s3s n ASP 431 Ca 0.00 -3.49 0.10 0.00 -1.38 0.00 0.00 54.79 50.02 1s3s n ASP 431 Cb 0.00 1.27 0.52 0.00 -1.04 0.00 0.00 41.12 41.87 1s3s n ASP 431 CO 0.00 0.00 0.00 -0.11 -0.82 0.00 0.00 177.20 176.27 1s3s n LEU 432 N 0.47 0.41 -4.83 -2.67 0.00 -0.57 -4.58 117.00 105.24 1s3s n LEU 432 Ca 0.11 -0.17 -0.38 0.00 0.00 0.00 0.00 56.01 55.57 1s3s n LEU 432 Cb 0.68 -0.02 -0.06 0.00 0.00 0.00 0.00 43.42 44.02 1s3s n LEU 432 CO 0.08 0.08 0.15 -1.83 0.00 0.00 0.00 177.39 175.88 1s3s s GLU 433 N -1.95 4.00 0.80 1.96 -1.05 -1.26 -5.09 118.70 116.11 1s3s s GLU 433 Ca 0.30 0.50 -0.10 0.00 -0.15 0.00 0.00 54.97 55.51 1s3s s GLU 433 Cb 0.14 -3.23 0.10 0.00 -0.44 0.00 0.00 34.13 30.71 1s3s s GLU 433 CO 0.23 0.67 1.14 -0.51 0.95 0.00 0.00 175.26 177.74 1s3s s ASP 434 N -1.05 4.29 0.00 0.83 1.11 -1.26 -4.52 116.67 116.07 1s3s s ASP 434 Ca 0.25 0.48 0.00 0.00 0.18 0.00 0.00 52.55 53.46 1s3s s ASP 434 Cb -0.17 -0.92 0.00 0.00 1.07 0.00 0.00 42.92 42.90 1s3s s ASP 434 CO 0.15 -1.99 0.00 -0.62 1.18 0.00 0.00 175.17 173.89 1s3s n GLU 435 N -3.25 0.00 -0.85 8.23 4.71 -1.26 -4.97 120.64 123.25 1s3s n GLU 435 Ca 0.10 0.00 0.02 0.00 -0.01 0.00 0.00 57.16 57.27 1s3s n GLU 435 Cb 0.60 -2.62 0.17 0.00 -1.01 0.00 0.00 31.44 28.58 1s3s n GLU 435 CO 0.00 0.00 0.00 2.41 0.09 0.00 0.00 177.13 179.63 1s3s n THR 436 N -2.78 2.09 0.71 2.62 -1.04 -1.26 -4.67 114.28 109.95 1s3s n THR 436 Ca 0.00 -3.21 0.06 0.00 -2.04 0.00 0.00 64.05 58.86 1s3s n THR 436 Cb 0.47 -0.25 0.35 0.00 -1.82 0.00 0.00 70.33 69.08 1s3s n THR 436 CO 0.00 0.00 0.00 2.30 -0.64 0.00 0.00 175.07 176.73 1s3s n ILE 437 N -0.96 0.25 -1.60 12.58 -5.35 -1.26 -4.80 119.36 118.23 1s3s n ILE 437 Ca 0.21 0.06 -0.47 0.00 -0.27 0.00 0.00 62.75 62.28 1s3s n ILE 437 Cb 0.75 -0.87 -0.03 0.00 -1.74 0.00 0.00 39.64 37.75 1s3s n ILE 437 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 1s3s n ASP 438 N -1.10 1.62 0.04 7.28 9.92 -1.24 -3.52 116.55 129.55 1s3s n ASP 438 Ca 0.08 1.15 0.09 0.00 -0.53 0.00 0.00 54.79 55.58 1s3s n ASP 438 Cb 0.06 -1.27 0.40 0.00 -0.64 0.00 0.00 41.12 39.68 1s3s n ASP 438 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1s3s n ALA 439 N 1.43 1.79 -0.01 2.24 0.00 -0.88 -2.98 120.51 122.10 1s3s n ALA 439 Ca 0.14 -0.02 -0.16 0.00 0.00 0.00 0.00 53.44 53.39 1s3s n ALA 439 Cb 0.27 -1.32 -0.11 0.00 0.00 0.00 0.00 19.45 18.29 1s3s n ALA 439 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1s3s h GLU 440 N 0.00 0.31 0.07 0.00 3.07 -1.88 -1.39 114.58 114.76 1s3s h GLU 440 Ca 0.00 -0.32 0.02 0.00 -0.50 0.00 0.00 59.36 58.56 1s3s h GLU 440 Cb 0.34 0.09 -0.03 0.00 -0.84 0.00 0.00 28.75 28.31 1s3s h GLU 440 CO 0.00 1.01 -0.18 0.28 -1.40 0.00 0.00 179.01 178.72 1s3s h VAL 441 N -0.26 0.58 0.00 3.13 2.07 -1.86 -0.60 116.25 119.31 1s3s h VAL 441 Ca -0.05 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.45 1s3s h VAL 441 Cb 1.15 0.58 -0.00 0.00 -1.52 0.00 0.00 31.29 31.49 1s3s h VAL 441 CO 0.08 0.00 -0.08 0.24 0.02 0.00 0.00 177.57 177.83 1s3s h MET 442 N -0.33 0.00 0.00 1.57 2.86 -1.62 -1.47 114.93 115.94 1s3s h MET 442 Ca 0.04 0.00 -0.13 0.00 -2.06 0.00 0.00 59.70 57.55 1s3s h MET 442 Cb 0.37 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.01 1s3s h MET 442 CO -0.13 0.08 -0.60 -0.97 1.06 0.00 0.00 176.91 176.36 1s3s h ASN 443 N 0.00 0.00 0.73 1.22 -0.73 -0.32 -3.24 115.58 113.23 1s3s h ASN 443 Ca -0.00 0.00 -0.19 0.00 1.87 0.00 0.00 56.30 57.98 1s3s h ASN 443 Cb 0.15 0.00 -0.03 0.00 0.27 0.00 0.00 38.32 38.71 1s3s h ASN 443 CO 0.01 0.60 -1.39 0.77 -0.37 0.00 0.00 177.43 177.05 1s3s h SER 444 N 0.00 0.00 -2.50 1.15 4.64 -0.41 -3.44 113.55 112.99 1s3s h SER 444 Ca -0.01 0.00 -0.55 0.00 -0.47 0.00 0.00 61.79 60.76 1s3s h SER 444 Cb 1.23 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.31 1s3s h SER 444 CO 0.08 0.67 1.19 -0.22 -0.87 0.00 0.00 176.83 177.67 1s3s s LEU 445 N -5.92 4.17 0.09 5.97 0.20 -0.62 -4.98 118.68 117.58 1s3s s LEU 445 Ca -0.03 2.21 0.04 0.00 0.69 0.00 0.00 54.13 57.04 1s3s s LEU 445 Cb 0.08 -3.53 -0.04 0.00 -0.43 0.00 0.00 46.19 42.28 1s3s s LEU 445 CO 0.81 -1.15 0.02 0.00 -0.29 0.00 0.00 176.35 175.74 1s3s s ALA 446 N 4.89 3.38 -0.29 5.97 0.00 -1.26 -4.50 121.76 129.95 1s3s s ALA 446 Ca 0.81 -1.09 -0.10 0.00 0.00 0.00 0.00 51.96 51.58 1s3s s ALA 446 Cb -0.34 -1.27 -0.03 0.00 0.00 0.00 0.00 23.12 21.48 1s3s s ALA 446 CO 0.34 0.72 0.17 0.08 0.00 0.00 0.00 175.76 177.06 1s3s s VAL 447 N -1.34 4.97 0.33 0.00 1.01 -0.39 -4.91 120.40 120.08 1s3s s VAL 447 Ca 0.27 -0.09 -0.09 0.00 0.00 0.00 0.00 61.98 62.07 1s3s s VAL 447 Cb -0.12 -3.43 -0.06 0.00 0.00 0.00 0.00 36.38 32.77 1s3s s VAL 447 CO 0.19 0.18 0.66 0.42 0.00 0.00 0.00 175.10 176.56 1s3s s THR 448 N 1.70 4.88 -0.94 3.92 -4.23 -1.26 -1.68 115.64 118.03 1s3s s THR 448 Ca 0.06 0.44 0.01 0.00 -1.18 0.00 0.00 61.69 61.02 1s3s s THR 448 Cb -0.16 -3.70 0.01 0.00 1.34 0.00 0.00 72.50 69.98 1s3s s THR 448 CO 0.09 -0.36 1.01 0.80 -0.54 0.00 0.00 174.62 175.62 1s3s n MET 449 N -0.92 0.01 0.10 3.99 1.56 -1.26 0.34 117.12 120.93 1s3s n MET 449 Ca 0.01 0.49 -0.00 0.00 -0.27 0.00 0.00 57.70 57.92 1s3s n MET 449 Cb 0.54 -1.53 -0.03 0.00 2.15 0.00 0.00 33.22 34.34 1s3s n MET 449 CO 0.00 0.00 0.00 0.22 -0.73 0.00 0.00 175.97 175.46 1s3s h ASP 450 N 0.00 0.00 0.15 6.12 3.58 -1.92 -2.64 116.42 121.71 1s3s h ASP 450 Ca 0.00 0.00 -0.29 0.00 0.42 0.00 0.00 57.03 57.16 1s3s h ASP 450 Cb 0.03 0.00 0.03 0.00 1.72 0.00 0.00 39.33 41.11 1s3s h ASP 450 CO 0.00 0.64 -1.21 0.44 -2.88 0.00 0.00 179.24 176.23 1s3s h ASP 451 N 0.00 0.84 0.60 2.28 3.32 -0.47 -2.70 116.42 120.28 1s3s h ASP 451 Ca -0.04 -0.77 -0.03 0.00 0.02 0.00 0.00 57.03 56.21 1s3s h ASP 451 Cb 1.53 -0.26 -0.00 0.00 0.22 0.00 0.00 39.33 40.81 1s3s h ASP 451 CO 0.08 1.57 -0.15 -0.26 -1.72 0.00 0.00 179.24 178.76 1s3s h PHE 452 N 0.28 0.00 0.00 4.55 -1.00 -1.57 0.26 116.94 119.47 1s3s h PHE 452 Ca -0.17 0.00 -0.14 0.00 2.81 0.00 0.00 57.97 60.47 1s3s h PHE 452 Cb 1.88 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 41.42 1s3s h PHE 452 CO 0.11 0.15 -0.64 -0.09 -1.61 0.00 0.00 178.31 176.22 1s3s h ARG 453 N 0.00 0.00 0.00 1.51 2.43 -1.38 -2.55 114.38 114.40 1s3s h ARG 453 Ca -0.00 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1s3s h ARG 453 Cb 0.49 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.04 1s3s h ARG 453 CO 0.02 0.64 -0.00 2.35 -1.51 0.00 0.00 179.97 181.47 1s3s h TRP 454 N 0.00 -0.00 -0.77 2.20 7.01 -0.92 -3.06 115.95 120.41 1s3s h TRP 454 Ca -0.01 -0.00 0.09 0.00 2.11 0.00 0.00 58.89 61.08 1s3s h TRP 454 Cb 1.34 0.00 -0.05 0.00 -2.10 0.00 0.00 29.16 28.35 1s3s h TRP 454 CO 0.00 0.88 0.50 0.00 -2.79 0.00 0.00 178.44 177.04 1s3s h ALA 455 N -0.02 1.77 -0.12 2.65 0.00 -1.06 -0.21 119.26 122.28 1s3s h ALA 455 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1s3s h ALA 455 Cb 0.89 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 1s3s h ALA 455 CO 0.00 0.07 0.08 -0.07 0.00 0.00 0.00 179.25 179.33 1s3s h LEU 456 N 0.71 0.14 -5.34 0.00 3.38 -1.52 -2.97 115.31 109.70 1s3s h LEU 456 Ca 0.35 -0.00 -0.59 0.00 0.09 0.00 0.00 57.88 57.73 1s3s h LEU 456 Cb 0.42 -0.03 0.02 0.00 0.09 0.00 0.00 40.66 41.16 1s3s h LEU 456 CO -0.13 0.10 3.32 -1.20 0.09 0.00 0.00 178.44 180.62 1s3s n SER 457 N -5.01 6.68 0.00 -0.43 7.64 -0.09 -5.12 113.62 117.30 1s3s n SER 457 Ca -0.05 -2.54 0.00 0.00 1.01 0.00 0.00 58.87 57.30 1s3s n SER 457 Cb 0.03 -1.41 0.00 0.00 -1.01 0.00 0.00 64.21 61.82 1s3s n SER 457 CO 0.00 0.00 0.00 1.67 -3.01 0.00 0.00 175.04 173.70