#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rce s ASP 38 N 0.00 3.95 0.00 5.98 2.15 -1.26 -5.01 116.67 122.48 2rce s ASP 38 Ca 0.00 -1.58 0.18 0.00 0.43 0.00 0.00 52.55 51.58 2rce s ASP 38 Cb 0.00 -0.78 0.97 0.00 -0.30 0.00 0.00 42.92 42.81 2rce s ASP 38 CO 0.00 -0.42 1.64 -1.54 -0.17 0.00 0.00 175.17 174.68 2rce n SER 39 N 4.92 0.41 -0.35 -0.34 3.41 -1.26 -4.22 113.62 116.18 2rce n SER 39 Ca -0.03 -1.52 0.12 0.00 -0.26 0.00 0.00 58.87 57.18 2rce n SER 39 Cb 0.42 -0.03 0.31 0.00 -0.26 0.00 0.00 64.21 64.65 2rce n SER 39 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 2rce h THR 40 N 0.54 0.76 -0.01 6.66 2.02 -2.06 -1.14 112.91 119.68 2rce h THR 40 Ca 0.00 -0.28 0.00 0.00 0.77 0.00 0.00 66.41 66.90 2rce h THR 40 Cb 0.12 -0.13 0.00 0.00 -1.74 0.00 0.00 68.15 66.40 2rce h THR 40 CO 0.00 0.15 -0.29 0.47 0.37 0.00 0.00 175.52 176.22 2rce n ASP 41 N -4.73 1.07 -4.85 4.18 10.43 -1.26 -4.90 116.55 116.49 2rce n ASP 41 Ca 0.22 -0.91 -0.32 0.00 2.57 0.00 0.00 54.79 56.36 2rce n ASP 41 Cb 0.52 0.17 -0.03 0.00 1.84 0.00 0.00 41.12 43.63 2rce n ASP 41 CO 0.00 0.00 0.00 -1.61 -1.07 0.00 0.00 177.20 174.52 2rce s GLU 42 N -2.52 3.86 -0.22 -1.24 2.02 -0.43 -5.07 118.70 115.09 2rce s GLU 42 Ca 0.23 0.82 -0.04 0.00 0.02 0.00 0.00 54.97 56.01 2rce s GLU 42 Cb 0.19 -2.18 -0.01 0.00 0.10 0.00 0.00 34.13 32.23 2rce s GLU 42 CO 0.53 -0.27 -0.04 0.99 0.02 0.00 0.00 175.26 176.50 2rce s THR 43 N -2.66 3.40 0.30 3.63 2.01 -1.26 -5.06 115.64 116.00 2rce s THR 43 Ca 0.57 -0.48 -0.30 0.00 0.31 0.00 0.00 61.69 61.78 2rce s THR 43 Cb -0.10 -2.55 -0.12 0.00 0.01 0.00 0.00 72.50 69.74 2rce s THR 43 CO 0.35 0.42 1.57 -2.65 -0.69 0.00 0.00 174.62 173.62 2rce n PRO 44 N 4.78 2.64 -1.83 4.92 -0.02 -1.26 -4.94 135.00 139.29 2rce n PRO 44 Ca -0.18 0.94 -0.42 0.00 -2.02 0.00 0.00 63.50 61.82 2rce n PRO 44 Cb 0.51 -2.70 -0.03 0.00 -0.02 0.00 0.00 33.50 31.26 2rce n PRO 44 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2rce s ALA 45 N -0.13 3.87 -0.15 3.55 0.00 -1.26 -4.98 121.76 122.66 2rce s ALA 45 Ca 0.63 1.49 -0.23 0.00 0.00 0.00 0.00 51.96 53.85 2rce s ALA 45 Cb -0.51 -3.66 0.06 0.00 0.00 0.00 0.00 23.12 19.01 2rce s ALA 45 CO 0.50 -0.86 0.59 0.45 0.00 0.00 0.00 175.76 176.45 2rce s SER 46 N 1.16 -0.58 -0.37 0.00 0.15 -1.26 -5.02 113.70 107.78 2rce s SER 46 Ca 0.72 0.92 0.07 0.00 0.70 0.00 0.00 55.95 58.36 2rce s SER 46 Cb -0.47 0.91 0.60 0.00 -1.71 0.00 0.00 66.02 65.35 2rce s SER 46 CO 0.32 -0.36 1.70 -1.22 1.20 0.00 0.00 173.24 174.88 2rce n TYR 47 N 2.01 2.13 -0.12 3.44 4.02 -1.26 -4.74 117.16 122.63 2rce n TYR 47 Ca -0.16 -1.70 0.00 0.00 -0.01 0.00 0.00 57.90 56.03 2rce n TYR 47 Cb 0.56 -0.72 0.28 0.00 -0.02 0.00 0.00 39.34 39.43 2rce n TYR 47 CO 0.00 0.00 0.00 -0.97 -1.01 0.00 0.00 176.86 174.88 2rce h ASN 48 N 1.10 0.71 -0.62 7.72 -0.73 -1.95 -2.70 115.58 119.11 2rce h ASN 48 Ca 0.43 -0.06 0.07 0.00 1.87 0.00 0.00 56.30 58.60 2rce h ASN 48 Cb 2.29 -0.18 -0.06 0.00 0.27 0.00 0.00 38.32 40.64 2rce h ASN 48 CO 0.76 0.59 0.32 0.25 -0.37 0.00 0.00 177.43 178.98 2rce h LEU 49 N 0.80 0.44 -0.89 0.34 5.85 -1.90 0.27 115.31 120.23 2rce h LEU 49 Ca 0.20 0.04 -0.08 0.00 0.84 0.00 0.00 57.88 58.88 2rce h LEU 49 Cb 0.06 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.03 2rce h LEU 49 CO -0.03 0.28 -0.07 0.00 -0.34 0.00 0.00 178.44 178.29 2rce h ALA 50 N 1.35 1.07 0.13 1.25 0.00 -1.63 -2.01 119.26 119.41 2rce h ALA 50 Ca 0.29 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2rce h ALA 50 Cb 0.23 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.84 2rce h ALA 50 CO -0.21 0.58 -0.06 0.28 0.00 0.00 0.00 179.25 179.84 2rce h VAL 51 N 0.69 0.97 -0.92 0.00 2.07 -1.01 -0.49 116.25 117.56 2rce h VAL 51 Ca 0.13 -0.36 0.07 0.00 0.82 0.00 0.00 66.70 67.36 2rce h VAL 51 Cb 0.52 1.20 -0.06 0.00 -1.52 0.00 0.00 31.29 31.42 2rce h VAL 51 CO 0.03 0.09 0.60 0.03 0.02 0.00 0.00 177.57 178.33 2rce h ARG 52 N -0.34 0.99 0.02 1.57 3.08 -0.40 0.40 114.38 119.70 2rce h ARG 52 Ca -0.02 -0.06 -0.25 0.00 0.07 0.00 0.00 59.98 59.72 2rce h ARG 52 Cb 0.27 -0.22 0.02 0.00 0.08 0.00 0.00 29.97 30.12 2rce h ARG 52 CO 0.03 0.66 -0.99 0.00 -1.07 0.00 0.00 179.97 178.60 2rce h ARG 53 N 1.02 0.64 0.00 0.04 3.08 -1.29 -3.41 114.38 114.46 2rce h ARG 53 Ca 0.40 -0.71 -0.35 0.00 0.07 0.00 0.00 59.98 59.39 2rce h ARG 53 Cb 0.25 0.21 -0.06 0.00 0.08 0.00 0.00 29.97 30.44 2rce h ARG 53 CO -0.16 1.30 -2.34 0.00 -1.07 0.00 0.00 179.97 177.70 2rce n ALA 54 N -2.64 1.50 -0.05 0.04 0.00 -0.20 -4.64 120.51 114.52 2rce n ALA 54 Ca -0.11 -1.07 -0.00 0.00 0.00 0.00 0.00 53.44 52.26 2rce n ALA 54 Cb 0.86 -0.07 0.28 0.00 0.00 0.00 0.00 19.45 20.52 2rce n ALA 54 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2rce h ALA 55 N 0.21 1.37 -0.27 0.00 0.00 -1.08 -2.70 119.26 116.79 2rce h ALA 55 Ca -0.53 -0.17 0.08 0.00 0.00 0.00 0.00 54.91 54.29 2rce h ALA 55 Cb 1.90 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 19.50 2rce h ALA 55 CO -0.06 0.45 0.25 -1.35 0.00 0.00 0.00 179.25 178.54 2rce h PRO 56 N 0.61 0.00 -0.01 0.00 0.11 -1.80 -2.27 132.00 128.65 2rce h PRO 56 Ca 0.14 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.25 2rce h PRO 56 Cb 0.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.36 2rce h PRO 56 CO -0.00 0.00 -0.21 0.00 -0.21 0.00 0.00 178.00 177.58 2rce n ALA 57 N -2.44 2.98 -2.64 -0.75 0.00 -1.02 -4.45 120.51 112.19 2rce n ALA 57 Ca 0.04 -0.38 -0.37 0.00 0.00 0.00 0.00 53.44 52.73 2rce n ALA 57 Cb 0.40 -1.18 -0.09 0.00 0.00 0.00 0.00 19.45 18.58 2rce n ALA 57 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2rce s VAL 58 N -2.47 5.30 0.26 0.00 1.01 -0.85 -0.40 120.40 123.24 2rce s VAL 58 Ca 0.26 0.32 0.08 0.00 0.00 0.00 0.00 61.98 62.64 2rce s VAL 58 Cb 0.19 -3.57 -0.04 0.00 0.00 0.00 0.00 36.38 32.96 2rce s VAL 58 CO 0.50 0.28 0.08 0.68 0.00 0.00 0.00 175.10 176.65 2rce s VAL 59 N 1.38 3.89 -0.20 2.92 -7.23 0.50 -4.56 120.40 117.10 2rce s VAL 59 Ca 0.10 -1.68 -0.14 0.00 -1.81 0.00 0.00 61.98 58.45 2rce s VAL 59 Cb -0.15 -3.09 -0.04 0.00 0.56 0.00 0.00 36.38 33.66 2rce s VAL 59 CO 0.07 -0.36 0.32 0.20 -0.31 0.00 0.00 175.10 175.02 2rce s ASN 60 N -3.73 6.37 -0.17 4.85 0.01 -0.46 -1.38 114.94 120.44 2rce s ASN 60 Ca 0.32 0.43 -0.06 0.00 -0.71 0.00 0.00 52.86 52.84 2rce s ASN 60 Cb -0.07 -2.19 -0.04 0.00 0.41 0.00 0.00 41.25 39.36 2rce s ASN 60 CO 0.22 0.00 0.03 -0.69 -1.51 0.00 0.00 177.10 175.15 2rce s VAL 61 N 1.02 4.54 -0.08 1.60 1.01 -0.57 -0.64 120.40 127.28 2rce s VAL 61 Ca 0.16 -0.13 0.04 0.00 0.00 0.00 0.00 61.98 62.05 2rce s VAL 61 Cb -0.14 -3.02 0.00 0.00 0.00 0.00 0.00 36.38 33.22 2rce s VAL 61 CO 0.06 0.49 -0.21 -0.31 0.00 0.00 0.00 175.10 175.12 2rce s TYR 62 N 0.23 2.22 -0.77 5.22 1.51 0.85 -1.81 117.35 124.80 2rce s TYR 62 Ca 0.02 -0.83 -0.08 0.00 -1.01 0.00 0.00 57.07 55.18 2rce s TYR 62 Cb -0.13 -1.50 0.20 0.00 -0.11 0.00 0.00 41.96 40.42 2rce s TYR 62 CO 0.01 -0.33 0.65 1.21 -1.11 0.00 0.00 175.55 175.99 2rce s ASN 63 N 0.28 6.06 0.00 2.29 3.84 -0.34 -0.18 114.94 126.90 2rce s ASN 63 Ca -0.14 -2.93 0.00 0.00 0.21 0.00 0.00 52.86 50.00 2rce s ASN 63 Cb -0.16 -2.03 0.00 0.00 -0.55 0.00 0.00 41.25 38.51 2rce s ASN 63 CO 0.06 -0.43 0.00 0.18 -2.79 0.00 0.00 177.10 174.13 2rce n LEU 74 N 3.51 0.00 -4.30 3.21 4.77 -1.26 -4.31 117.00 118.61 2rce n LEU 74 Ca 0.13 0.00 -0.24 0.00 -0.03 0.00 0.00 56.01 55.87 2rce n LEU 74 Cb 0.42 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.38 2rce n LEU 74 CO 0.34 0.00 -0.51 -0.70 -1.33 0.00 0.00 177.39 175.19 2rce s GLU 75 N -1.81 1.17 -0.06 3.23 2.12 -1.26 -5.13 118.70 116.97 2rce s GLU 75 Ca 0.00 -1.22 -0.21 0.00 0.36 0.00 0.00 54.97 53.90 2rce s GLU 75 Cb 0.00 -1.41 -0.04 0.00 0.26 0.00 0.00 34.13 32.93 2rce s GLU 75 CO 0.00 0.32 0.59 0.42 -0.54 0.00 0.00 175.26 176.06 2rce s ILE 76 N -1.33 5.04 -0.27 -3.70 1.01 -1.26 -4.99 121.20 115.71 2rce s ILE 76 Ca 0.09 1.22 -0.16 0.00 0.00 0.00 0.00 60.65 61.81 2rce s ILE 76 Cb -0.09 -3.93 -0.13 0.00 0.01 0.00 0.00 42.46 38.31 2rce s ILE 76 CO 0.05 0.33 -0.24 0.54 0.00 0.00 0.00 174.94 175.62 2rce n ARG 77 N 3.36 0.58 -4.11 2.79 1.74 -1.26 -5.01 116.66 114.76 2rce n ARG 77 Ca -0.05 0.33 -0.13 0.00 -0.77 0.00 0.00 57.85 57.23 2rce n ARG 77 Cb 0.51 -1.54 -0.11 0.00 -1.02 0.00 0.00 32.46 30.30 2rce n ARG 77 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 2rce s THR 78 N -2.48 0.66 0.26 0.55 2.01 -1.26 -5.04 115.64 110.34 2rce s THR 78 Ca -0.37 -1.42 0.02 0.00 0.31 0.00 0.00 61.69 60.23 2rce s THR 78 Cb 0.13 -1.05 -0.05 0.00 0.01 0.00 0.00 72.50 71.53 2rce s THR 78 CO 0.51 -0.55 0.06 -1.48 -0.69 0.00 0.00 174.62 172.47 2rce s LEU 79 N -2.15 1.92 0.00 4.42 0.05 -1.26 -1.20 118.68 120.47 2rce s LEU 79 Ca -0.01 -1.33 0.00 0.00 0.05 0.00 0.00 54.13 52.84 2rce s LEU 79 Cb -0.04 -0.14 0.00 0.00 -2.05 0.00 0.00 46.19 43.96 2rce s LEU 79 CO -0.01 -0.64 0.00 0.61 -0.55 0.00 0.00 176.35 175.76 2rce n GLY 80 N -0.48 1.88 3.38 -3.48 0.00 -0.75 -4.46 105.19 101.29 2rce n GLY 80 Ca -0.02 -0.56 -0.19 0.00 0.00 0.00 0.00 46.02 45.25 2rce n GLY 80 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2rce s SER 81 N 2.00 1.87 0.19 1.61 0.01 -1.20 -1.51 113.70 116.67 2rce s SER 81 Ca 0.00 -1.36 -0.10 0.00 1.31 0.00 0.00 55.95 55.80 2rce s SER 81 Cb 0.00 0.02 -0.01 0.00 0.21 0.00 0.00 66.02 66.24 2rce s SER 81 CO 0.00 -0.64 0.35 -0.83 0.41 0.00 0.00 173.24 172.53 2rce s GLY 82 N -3.40 0.51 -0.09 3.44 0.00 -0.48 -4.00 107.32 103.31 2rce s GLY 82 Ca 0.36 -0.88 -0.00 0.00 0.00 0.00 0.00 44.72 44.20 2rce s GLY 82 CO 0.14 -0.76 -0.06 0.14 0.00 0.00 0.00 173.10 172.56 2rce s VAL 83 N -3.99 0.80 -0.21 1.40 1.01 0.08 -0.37 120.40 119.13 2rce s VAL 83 Ca 0.20 -0.19 -0.29 0.00 0.00 0.00 0.00 61.98 61.70 2rce s VAL 83 Cb 0.02 -0.84 -0.01 0.00 0.00 0.00 0.00 36.38 35.55 2rce s VAL 83 CO 0.03 0.32 1.22 -0.63 0.00 0.00 0.00 175.10 176.04 2rce s ILE 84 N 1.50 4.34 -0.15 2.22 1.01 0.46 -0.59 121.20 129.98 2rce s ILE 84 Ca -0.00 1.60 0.11 0.00 0.00 0.00 0.00 60.65 62.36 2rce s ILE 84 Cb -0.13 -4.11 -0.23 0.00 0.01 0.00 0.00 42.46 38.00 2rce s ILE 84 CO -0.04 -0.23 0.23 0.23 0.00 0.00 0.00 174.94 175.13 2rce n MET 85 N 6.71 0.67 -4.02 2.79 2.81 0.54 -1.20 117.12 125.42 2rce n MET 85 Ca 0.14 0.14 -0.10 0.00 -1.81 0.00 0.00 57.70 56.07 2rce n MET 85 Cb 0.45 -1.62 -0.06 0.00 -0.71 0.00 0.00 33.22 31.29 2rce n MET 85 CO 0.00 0.00 0.00 0.16 1.51 0.00 0.00 175.97 177.64 2rce s ASP 86 N -5.99 -0.03 0.53 7.83 1.47 -1.24 -4.56 116.67 114.68 2rce s ASP 86 Ca -0.13 -0.99 0.35 0.00 1.18 0.00 0.00 52.55 52.95 2rce s ASP 86 Cb 0.07 0.57 1.66 0.00 -0.34 0.00 0.00 42.92 44.88 2rce s ASP 86 CO 0.79 -1.12 2.05 1.56 0.68 0.00 0.00 175.17 179.12 2rce h GLN 87 N 2.28 0.00 0.00 2.11 1.08 -1.93 -2.65 115.11 116.00 2rce h GLN 87 Ca -0.27 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.93 2rce h GLN 87 Cb 1.25 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.68 2rce h GLN 87 CO 0.37 0.00 0.00 0.00 -0.95 0.00 0.00 178.83 178.25 2rce h ARG 88 N 0.00 0.00 0.00 1.46 3.08 -1.97 -3.43 114.38 113.52 2rce h ARG 88 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2rce h ARG 88 Cb 0.27 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.32 2rce h ARG 88 CO 0.00 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 179.31 2rce n GLY 89 N 0.48 1.28 3.70 0.04 0.00 -1.00 -4.72 105.19 104.97 2rce n GLY 89 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 2rce n GLY 89 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2rce s TYR 90 N -2.00 3.46 -0.08 1.61 1.51 -1.25 -1.57 117.35 119.03 2rce s TYR 90 Ca 0.00 1.47 0.02 0.00 -1.01 0.00 0.00 57.07 57.55 2rce s TYR 90 Cb 0.00 -3.28 0.01 0.00 -0.11 0.00 0.00 41.96 38.59 2rce s TYR 90 CO 0.00 -0.67 -0.13 0.42 -1.11 0.00 0.00 175.55 174.06 2rce s ILE 91 N 1.52 1.22 -0.08 2.71 1.01 -0.26 -0.34 121.20 126.98 2rce s ILE 91 Ca 0.54 -0.51 -0.20 0.00 0.00 0.00 0.00 60.65 60.48 2rce s ILE 91 Cb -0.23 -1.12 -0.04 0.00 0.01 0.00 0.00 42.46 41.07 2rce s ILE 91 CO 0.25 0.38 0.55 -0.63 0.00 0.00 0.00 174.94 175.48 2rce s ILE 92 N 0.81 5.11 0.00 2.92 1.01 0.24 -0.06 121.20 131.22 2rce s ILE 92 Ca -0.12 1.12 0.00 0.00 0.00 0.00 0.00 60.65 61.65 2rce s ILE 92 Cb -0.15 -3.89 0.00 0.00 0.01 0.00 0.00 42.46 38.43 2rce s ILE 92 CO 0.02 0.33 0.00 1.07 0.00 0.00 0.00 174.94 176.36 2rce n THR 93 N 3.49 0.00 -4.44 2.92 5.66 0.22 -0.74 114.28 121.40 2rce n THR 93 Ca -0.06 0.00 -0.34 0.00 -3.05 0.00 0.00 64.05 60.60 2rce n THR 93 Cb 0.51 0.00 -0.10 0.00 -1.55 0.00 0.00 70.33 69.19 2rce n THR 93 CO 0.00 0.00 0.00 0.20 -3.05 0.00 0.00 175.07 172.22 2rce s ASN 94 N 0.09 5.02 0.27 1.09 0.02 -1.26 -1.89 114.94 118.28 2rce s ASN 94 Ca 0.00 0.06 -0.01 0.00 -1.02 0.00 0.00 52.86 51.89 2rce s ASN 94 Cb 0.00 -1.45 0.58 0.00 0.02 0.00 0.00 41.25 40.40 2rce s ASN 94 CO 0.00 0.34 1.69 0.50 0.02 0.00 0.00 177.10 179.65 2rce h LYS 95 N 5.46 0.34 0.00 -0.60 3.64 -1.60 -0.70 116.57 123.11 2rce h LYS 95 Ca -0.47 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 58.88 2rce h LYS 95 Cb 1.19 -0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 32.93 2rce h LYS 95 CO 0.56 0.22 -0.08 1.12 -2.27 0.00 0.00 179.45 179.00 2rce h HIS 96 N 0.35 0.00 -0.10 1.91 2.07 -1.95 -2.08 115.15 115.34 2rce h HIS 96 Ca 0.48 0.00 -0.03 0.00 -2.85 0.00 0.00 60.37 57.97 2rce h HIS 96 Cb 0.86 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.83 2rce h HIS 96 CO -0.20 0.08 -0.05 0.28 -3.07 0.00 0.00 177.93 174.97 2rce h VAL 97 N 0.00 1.32 -0.02 6.12 2.07 -1.51 -3.33 116.25 120.89 2rce h VAL 97 Ca -0.00 -1.06 0.00 0.00 0.82 0.00 0.00 66.70 66.46 2rce h VAL 97 Cb 0.55 1.81 0.00 0.00 -1.52 0.00 0.00 31.29 32.14 2rce h VAL 97 CO 0.01 0.30 -0.05 2.30 0.02 0.00 0.00 177.57 180.15 2rce n ILE 98 N -4.73 0.00 -1.86 4.57 -6.64 -1.08 -4.84 119.36 104.78 2rce n ILE 98 Ca -0.07 -0.38 -0.41 0.00 -1.77 0.00 0.00 62.75 60.12 2rce n ILE 98 Cb 0.27 1.09 -0.02 0.00 -1.44 0.00 0.00 39.64 39.54 2rce n ILE 98 CO 0.00 0.00 0.00 0.21 -1.77 0.00 0.00 176.55 174.99 2rce s ASN 99 N -2.06 6.47 -1.46 7.28 2.47 -0.80 -2.89 114.94 123.95 2rce s ASN 99 Ca 0.30 2.84 0.00 0.00 0.42 0.00 0.00 52.86 56.43 2rce s ASN 99 Cb 0.20 -2.63 0.00 0.00 -1.45 0.00 0.00 41.25 37.37 2rce s ASN 99 CO 0.34 -0.84 0.00 -0.67 -3.72 0.00 0.00 177.10 172.21 2rce n ASP 100 N 2.33 -4.71 -4.73 -4.21 4.64 -1.26 -4.98 116.55 103.62 2rce n ASP 100 Ca 0.08 0.18 -0.41 0.00 -1.38 0.00 0.00 54.79 53.27 2rce n ASP 100 Cb 0.38 -3.70 -0.04 0.00 -1.04 0.00 0.00 41.12 36.72 2rce n ASP 100 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 2rce s ALA 101 N -2.66 3.27 -0.02 -1.67 0.00 -1.14 -4.95 121.76 114.59 2rce s ALA 101 Ca 0.00 0.46 -0.20 0.00 0.00 0.00 0.00 51.96 52.23 2rce s ALA 101 Cb 0.00 -3.19 -0.33 0.00 0.00 0.00 0.00 23.12 19.60 2rce s ALA 101 CO 0.00 -0.04 0.94 -0.44 0.00 0.00 0.00 175.76 176.22 2rce h ASP 102 N 5.86 0.62 -3.52 0.00 3.32 -1.92 -3.46 116.42 117.33 2rce h ASP 102 Ca -0.43 -0.94 -0.27 0.00 0.02 0.00 0.00 57.03 55.41 2rce h ASP 102 Cb 1.21 -0.20 -0.33 0.00 0.22 0.00 0.00 39.33 40.23 2rce h ASP 102 CO 0.72 1.52 -0.68 -1.58 -1.72 0.00 0.00 179.24 177.50 2rce s GLN 103 N -2.51 0.01 -0.26 3.56 0.74 -1.26 -5.13 119.66 114.81 2rce s GLN 103 Ca -0.12 0.23 -0.08 0.00 0.05 0.00 0.00 55.36 55.44 2rce s GLN 103 Cb 0.02 -0.20 -0.03 0.00 1.10 0.00 0.00 33.01 33.90 2rce s GLN 103 CO 0.88 -0.15 0.10 0.42 -0.55 0.00 0.00 175.29 175.99 2rce s ILE 104 N 0.98 4.60 -0.08 -2.34 1.01 -1.26 -4.37 121.20 119.74 2rce s ILE 104 Ca -0.08 -0.07 -0.02 0.00 0.00 0.00 0.00 60.65 60.48 2rce s ILE 104 Cb -0.11 -3.17 -0.03 0.00 0.01 0.00 0.00 42.46 39.16 2rce s ILE 104 CO -0.03 0.31 0.02 -0.63 0.00 0.00 0.00 174.94 174.61 2rce s ILE 105 N 1.65 4.44 -0.13 2.92 -1.09 0.75 -0.48 121.20 129.27 2rce s ILE 105 Ca 0.07 -0.23 0.01 0.00 -2.23 0.00 0.00 60.65 58.27 2rce s ILE 105 Cb -0.15 -2.89 0.02 0.00 -1.58 0.00 0.00 42.46 37.86 2rce s ILE 105 CO 0.06 0.58 -0.15 -0.69 -1.23 0.00 0.00 174.94 173.51 2rce s VAL 106 N -0.92 1.53 -0.17 2.92 1.01 0.11 -0.11 120.40 124.78 2rce s VAL 106 Ca 0.14 -0.64 -0.01 0.00 0.00 0.00 0.00 61.98 61.48 2rce s VAL 106 Cb -0.11 -1.42 -0.00 0.00 0.00 0.00 0.00 36.38 34.84 2rce s VAL 106 CO 0.03 0.45 -0.13 0.00 0.00 0.00 0.00 175.10 175.45 2rce s ALA 107 N 1.20 2.56 0.31 5.51 0.00 0.19 -0.45 121.76 131.07 2rce s ALA 107 Ca -0.02 -1.07 -0.06 0.00 0.00 0.00 0.00 51.96 50.82 2rce s ALA 107 Cb -0.14 -1.31 -0.05 0.00 0.00 0.00 0.00 23.12 21.61 2rce s ALA 107 CO -0.05 -0.11 0.59 -0.51 0.00 0.00 0.00 175.76 175.68 2rce s LEU 108 N 0.93 4.02 0.61 0.00 1.02 0.35 -1.35 118.68 124.26 2rce s LEU 108 Ca -0.03 0.78 0.39 0.00 0.02 0.00 0.00 54.13 55.29 2rce s LEU 108 Cb -0.15 -3.60 1.89 0.00 0.02 0.00 0.00 46.19 44.35 2rce s LEU 108 CO -0.01 -0.23 2.18 1.56 0.02 0.00 0.00 176.35 179.87 2rce h GLN 109 N 1.61 0.00 0.00 1.70 1.08 -1.80 -1.54 115.11 116.15 2rce h GLN 109 Ca -0.48 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.72 2rce h GLN 109 Cb 1.19 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.62 2rce h GLN 109 CO 0.66 0.01 0.00 -0.40 -0.95 0.00 0.00 178.83 178.14 2rce n ASP 110 N -3.12 0.00 0.00 1.46 5.68 -1.26 -4.89 116.55 114.42 2rce n ASP 110 Ca -0.01 -1.54 0.00 0.00 -0.50 0.00 0.00 54.79 52.74 2rce n ASP 110 Cb 0.19 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.17 2rce n ASP 110 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2rce n GLY 111 N 0.68 1.19 3.76 6.12 0.00 -0.58 -5.05 105.19 111.31 2rce n GLY 111 Ca 0.10 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.72 2rce n GLY 111 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2rce s ARG 112 N -0.63 4.53 -0.09 1.61 0.52 -1.25 -4.84 118.95 118.79 2rce s ARG 112 Ca 0.00 1.93 0.02 0.00 -0.52 0.00 0.00 55.73 57.15 2rce s ARG 112 Cb 0.00 -3.13 0.01 0.00 0.52 0.00 0.00 34.95 32.36 2rce s ARG 112 CO 0.00 0.07 -0.14 0.08 0.02 0.00 0.00 175.30 175.33 2rce s VAL 113 N -1.17 1.33 0.09 3.52 1.01 -1.26 -0.50 120.40 123.42 2rce s VAL 113 Ca 0.46 -0.56 0.07 0.00 0.00 0.00 0.00 61.98 61.95 2rce s VAL 113 Cb -0.34 -1.23 -0.03 0.00 0.00 0.00 0.00 36.38 34.78 2rce s VAL 113 CO 0.44 0.41 -0.18 -0.36 0.00 0.00 0.00 175.10 175.41 2rce s PHE 114 N 0.91 1.52 0.14 5.22 0.40 0.40 -4.99 117.98 121.58 2rce s PHE 114 Ca -0.09 -0.44 -0.29 0.00 -0.60 0.00 0.00 56.93 55.51 2rce s PHE 114 Cb -0.15 -0.84 -0.07 0.00 0.51 0.00 0.00 43.02 42.47 2rce s PHE 114 CO 0.00 0.13 0.93 -2.00 0.70 0.00 0.00 175.22 174.98 2rce s GLU 115 N -1.81 4.71 0.03 0.44 2.12 -1.26 0.08 118.70 123.01 2rce s GLU 115 Ca 0.03 1.41 0.03 0.00 0.36 0.00 0.00 54.97 56.80 2rce s GLU 115 Cb -0.10 -3.35 -0.04 0.00 0.26 0.00 0.00 34.13 30.91 2rce s GLU 115 CO 0.03 0.31 -0.02 0.00 -0.54 0.00 0.00 175.26 175.05 2rce s ALA 116 N -0.36 3.22 -0.04 6.30 0.00 0.37 -4.60 121.76 126.65 2rce s ALA 116 Ca 0.44 -1.02 0.01 0.00 0.00 0.00 0.00 51.96 51.38 2rce s ALA 116 Cb -0.24 -1.24 -0.03 0.00 0.00 0.00 0.00 23.12 21.61 2rce s ALA 116 CO 0.30 0.66 -0.02 -0.51 0.00 0.00 0.00 175.76 176.18 2rce s LEU 117 N -1.78 3.40 -0.59 0.00 1.43 -0.48 -4.35 118.68 116.30 2rce s LEU 117 Ca 0.21 0.01 -0.28 0.00 -1.03 0.00 0.00 54.13 53.04 2rce s LEU 117 Cb -0.11 -1.86 0.03 0.00 0.03 0.00 0.00 46.19 44.28 2rce s LEU 117 CO 0.12 0.32 1.18 -0.22 0.23 0.00 0.00 176.35 177.98 2rce s LEU 118 N -1.20 3.49 0.25 1.79 1.98 -1.26 -1.24 118.68 122.49 2rce s LEU 118 Ca 0.16 0.01 0.06 0.00 -2.89 0.00 0.00 54.13 51.47 2rce s LEU 118 Cb -0.11 -3.08 0.28 0.00 0.66 0.00 0.00 46.19 43.94 2rce s LEU 118 CO 0.06 -1.49 1.57 0.58 -1.89 0.00 0.00 176.35 175.18 2rce h VAL 119 N 6.13 1.40 0.00 1.68 2.07 -1.17 -3.49 116.25 122.88 2rce h VAL 119 Ca -0.25 -2.01 0.00 0.00 0.82 0.00 0.00 66.70 65.26 2rce h VAL 119 Cb 1.06 2.03 0.00 0.00 -1.52 0.00 0.00 31.29 32.86 2rce h VAL 119 CO 1.19 0.59 0.00 0.61 0.02 0.00 0.00 177.57 179.97 2rce n GLY 120 N 0.25 2.71 3.52 2.17 0.00 -1.15 -4.89 105.19 107.80 2rce n GLY 120 Ca -0.02 -1.10 -0.25 0.00 0.00 0.00 0.00 46.02 44.65 2rce n GLY 120 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2rce s SER 121 N 0.00 2.79 -0.17 1.61 1.04 -1.26 -0.15 113.70 117.56 2rce s SER 121 Ca 0.00 -1.53 -0.03 0.00 0.48 0.00 0.00 55.95 54.86 2rce s SER 121 Cb 0.00 0.22 0.06 0.00 0.10 0.00 0.00 66.02 66.40 2rce s SER 121 CO 0.00 -0.77 0.05 -0.62 0.98 0.00 0.00 173.24 172.89 2rce s ASP 122 N -3.59 2.58 0.30 7.02 2.15 0.18 -4.94 116.67 120.37 2rce s ASP 122 Ca 0.28 -0.68 0.06 0.00 0.43 0.00 0.00 52.55 52.64 2rce s ASP 122 Cb 0.05 -0.45 0.49 0.00 -0.30 0.00 0.00 42.92 42.72 2rce s ASP 122 CO 0.14 -0.31 1.73 0.77 -0.17 0.00 0.00 175.17 177.33 2rce h SER 123 N 8.32 0.30 0.74 -0.34 4.64 -1.94 0.20 113.55 125.47 2rce h SER 123 Ca -0.16 -0.11 -0.10 0.00 -0.47 0.00 0.00 61.79 60.95 2rce h SER 123 Cb 1.13 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 63.12 2rce h SER 123 CO 0.31 0.62 -0.47 0.25 -0.87 0.00 0.00 176.83 176.67 2rce h LEU 124 N 0.25 0.00 -2.28 5.97 6.46 -1.96 -3.30 115.31 120.45 2rce h LEU 124 Ca 0.03 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.79 2rce h LEU 124 Cb 0.72 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.65 2rce h LEU 124 CO 0.05 0.47 0.00 0.35 -0.62 0.00 0.00 178.44 178.70 2rce n THR 125 N -3.65 0.64 -1.89 1.05 -2.24 -1.15 -5.00 114.28 102.03 2rce n THR 125 Ca -0.01 -0.82 -0.18 0.00 -2.27 0.00 0.00 64.05 60.77 2rce n THR 125 Cb 0.55 0.69 -0.05 0.00 -2.10 0.00 0.00 70.33 69.42 2rce n THR 125 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2rce n ASP 126 N -0.26 -5.06 -4.56 3.42 2.03 0.03 -4.96 116.55 107.19 2rce n ASP 126 Ca 0.01 0.29 -0.34 0.00 0.52 0.00 0.00 54.79 55.27 2rce n ASP 126 Cb 0.17 -4.40 -0.11 0.00 -0.72 0.00 0.00 41.12 36.06 2rce n ASP 126 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 2rce s LEU 127 N -5.04 3.30 0.06 -2.67 1.43 -1.05 -1.81 118.68 112.89 2rce s LEU 127 Ca 0.00 -0.05 0.07 0.00 -1.03 0.00 0.00 54.13 53.13 2rce s LEU 127 Cb 0.00 -1.77 -0.03 0.00 0.03 0.00 0.00 46.19 44.42 2rce s LEU 127 CO 0.00 0.26 -0.20 0.00 0.23 0.00 0.00 176.35 176.64 2rce s ALA 128 N -0.17 1.72 -0.16 4.21 0.00 -0.79 0.48 121.76 127.05 2rce s ALA 128 Ca 0.03 -1.09 -0.01 0.00 0.00 0.00 0.00 51.96 50.89 2rce s ALA 128 Cb -0.13 -0.30 -0.01 0.00 0.00 0.00 0.00 23.12 22.68 2rce s ALA 128 CO 0.02 0.37 -0.10 0.08 0.00 0.00 0.00 175.76 176.13 2rce s VAL 129 N -0.90 3.22 0.24 0.00 1.01 0.79 -0.61 120.40 124.15 2rce s VAL 129 Ca 0.07 -0.59 0.07 0.00 0.00 0.00 0.00 61.98 61.53 2rce s VAL 129 Cb -0.09 -2.39 -0.04 0.00 0.00 0.00 0.00 36.38 33.86 2rce s VAL 129 CO 0.02 0.50 0.15 -0.76 0.00 0.00 0.00 175.10 175.01 2rce s LEU 130 N 0.63 3.69 -0.08 3.92 1.43 0.92 -0.59 118.68 128.60 2rce s LEU 130 Ca -0.06 -0.31 0.00 0.00 -1.03 0.00 0.00 54.13 52.74 2rce s LEU 130 Cb -0.15 -2.24 0.02 0.00 0.03 0.00 0.00 46.19 43.85 2rce s LEU 130 CO 0.03 -0.01 -0.07 -0.75 0.23 0.00 0.00 176.35 175.78 2rce s LYS 131 N -3.70 1.22 0.19 1.70 2.47 -0.37 -1.10 119.74 120.16 2rce s LYS 131 Ca 0.32 -0.19 0.07 0.00 -1.56 0.00 0.00 55.97 54.61 2rce s LYS 131 Cb -0.08 -1.24 -0.04 0.00 -1.46 0.00 0.00 37.83 35.01 2rce s LYS 131 CO 0.24 -0.15 0.07 0.96 0.16 0.00 0.00 175.35 176.62 2rce s ILE 132 N 1.29 4.00 -0.44 5.43 -4.36 -0.61 -1.38 121.20 125.14 2rce s ILE 132 Ca -0.04 -1.39 0.01 0.00 -0.26 0.00 0.00 60.65 58.97 2rce s ILE 132 Cb -0.14 -3.06 0.12 0.00 1.25 0.00 0.00 42.46 40.63 2rce s ILE 132 CO -0.03 -0.18 0.20 0.21 0.24 0.00 0.00 174.94 175.39 2rce s ASN 133 N -3.21 4.91 0.02 4.36 3.84 -1.26 -4.43 114.94 119.16 2rce s ASN 133 Ca 0.30 -2.41 0.05 0.00 0.21 0.00 0.00 52.86 51.01 2rce s ASN 133 Cb -0.09 -1.73 -0.03 0.00 -0.55 0.00 0.00 41.25 38.85 2rce s ASN 133 CO 0.21 -0.40 -0.12 0.00 -2.79 0.00 0.00 177.10 174.00 2rce s ALA 134 N 0.57 2.82 0.00 1.71 0.00 -1.26 -5.06 121.76 120.55 2rce s ALA 134 Ca 0.12 -1.09 0.00 0.00 0.00 0.00 0.00 51.96 50.99 2rce s ALA 134 Cb -0.22 -0.96 0.00 0.00 0.00 0.00 0.00 23.12 21.95 2rce s ALA 134 CO -0.04 0.59 0.30 2.41 0.00 0.00 0.00 175.76 179.02 2rce n THR 135 N 1.59 0.00 -0.51 0.00 -1.04 -1.26 -4.95 114.28 108.11 2rce n THR 135 Ca -0.16 0.69 -0.30 0.00 -2.04 0.00 0.00 64.05 62.24 2rce n THR 135 Cb 0.52 -1.47 0.28 0.00 -1.82 0.00 0.00 70.33 67.84 2rce n THR 135 CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 2rce s GLY 136 N -1.29 1.46 0.50 3.41 0.00 -1.26 -4.95 107.32 105.19 2rce s GLY 136 Ca 0.00 -0.71 -0.23 0.00 0.00 0.00 0.00 44.72 43.78 2rce s GLY 136 CO 0.00 0.23 1.32 -0.32 0.00 0.00 0.00 173.10 174.33 2rce s GLY 137 N -3.14 2.87 -0.13 0.20 0.00 -1.26 -5.02 107.32 100.84 2rce s GLY 137 Ca 0.69 1.25 -0.03 0.00 0.00 0.00 0.00 44.72 46.63 2rce s GLY 137 CO 0.59 1.78 -0.00 1.08 0.00 0.00 0.00 173.10 176.54 2rce s LEU 138 N -3.23 3.48 0.21 0.66 1.43 -1.26 -5.09 118.68 114.89 2rce s LEU 138 Ca 0.67 0.02 -0.30 0.00 -1.03 0.00 0.00 54.13 53.49 2rce s LEU 138 Cb -0.38 -1.83 -0.09 0.00 0.03 0.00 0.00 46.19 43.92 2rce s LEU 138 CO 0.46 0.26 1.41 -2.16 0.23 0.00 0.00 176.35 176.55 2rce s PRO 139 N -0.17 4.30 0.21 1.29 0.04 -1.26 -4.80 135.00 134.61 2rce s PRO 139 Ca 0.05 2.21 0.11 0.00 0.04 0.00 0.00 61.00 63.41 2rce s PRO 139 Cb -0.13 -3.16 -0.05 0.00 0.04 0.00 0.00 34.50 31.21 2rce s PRO 139 CO 0.02 -0.39 -0.21 0.95 0.04 0.00 0.00 177.00 177.41 2rce s THR 140 N 0.28 2.49 0.11 1.26 -4.23 -1.26 -4.55 115.64 109.75 2rce s THR 140 Ca 0.60 -2.07 -0.30 0.00 -1.18 0.00 0.00 61.69 58.74 2rce s THR 140 Cb -0.40 -2.23 -0.06 0.00 1.34 0.00 0.00 72.50 71.15 2rce s THR 140 CO 0.39 -0.18 1.07 -0.51 -0.54 0.00 0.00 174.62 174.84 2rce s ILE 141 N -1.87 4.21 0.18 2.99 1.10 -0.34 -4.74 121.20 122.73 2rce s ILE 141 Ca 0.23 1.76 -0.32 0.00 -0.51 0.00 0.00 60.65 61.82 2rce s ILE 141 Cb -0.07 -4.13 -0.10 0.00 0.15 0.00 0.00 42.46 38.31 2rce s ILE 141 CO 0.12 0.24 1.59 -2.84 -2.11 0.00 0.00 174.94 171.94 2rce s PRO 142 N 0.21 4.20 -0.08 3.50 0.02 -1.26 -4.96 135.00 136.63 2rce s PRO 142 Ca 0.51 2.40 -0.01 0.00 0.02 0.00 0.00 61.00 63.92 2rce s PRO 142 Cb -0.27 -3.14 0.03 0.00 0.02 0.00 0.00 34.50 31.14 2rce s PRO 142 CO 0.31 -0.63 -0.02 0.42 -0.33 0.00 0.00 177.00 176.76 2rce s ILE 143 N 1.11 0.57 -0.41 2.83 1.01 -1.26 -1.09 121.20 123.95 2rce s ILE 143 Ca 0.70 -0.00 -0.04 0.00 0.00 0.00 0.00 60.65 61.31 2rce s ILE 143 Cb -0.45 -0.68 0.11 0.00 0.01 0.00 0.00 42.46 41.45 2rce s ILE 143 CO 0.32 0.29 0.21 0.21 0.00 0.00 0.00 174.94 175.97 2rce s ASN 144 N 1.85 5.31 0.63 3.58 3.84 -1.26 -4.97 114.94 123.92 2rce s ASN 144 Ca 0.04 -1.95 0.41 0.00 0.21 0.00 0.00 52.86 51.58 2rce s ASN 144 Cb -0.12 -1.85 2.11 0.00 -0.55 0.00 0.00 41.25 40.83 2rce s ASN 144 CO -0.06 -0.55 2.25 0.00 -2.79 0.00 0.00 177.10 175.95 2rce h ALA 145 N 8.11 1.00 0.00 1.71 0.00 -1.98 -2.39 119.26 125.71 2rce h ALA 145 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.76 2rce h ALA 145 Cb 1.05 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.84 2rce h ALA 145 CO 0.71 0.00 -0.94 0.54 0.00 0.00 0.00 179.25 179.56 2rce n ARG 146 N -3.06 0.23 -2.15 0.00 1.74 -1.26 -4.90 116.66 107.26 2rce n ARG 146 Ca -0.02 0.00 -0.42 0.00 -0.77 0.00 0.00 57.85 56.64 2rce n ARG 146 Cb 0.14 -1.58 -0.03 0.00 -1.02 0.00 0.00 32.46 29.97 2rce n ARG 146 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 2rce s ARG 147 N -3.16 4.23 -0.33 5.56 6.06 -0.90 -5.00 118.95 125.42 2rce s ARG 147 Ca 0.05 2.03 -0.17 0.00 -2.50 0.00 0.00 55.73 55.15 2rce s ARG 147 Cb 0.15 -3.74 -0.01 0.00 0.06 0.00 0.00 34.95 31.40 2rce s ARG 147 CO 0.79 -0.70 0.44 0.08 -2.50 0.00 0.00 175.30 173.41 2rce s VAL 148 N 3.14 5.10 0.25 7.11 1.01 -1.26 -5.02 120.40 130.72 2rce s VAL 148 Ca 0.67 0.32 -0.30 0.00 0.00 0.00 0.00 61.98 62.67 2rce s VAL 148 Cb -0.31 -3.86 -0.10 0.00 0.00 0.00 0.00 36.38 32.11 2rce s VAL 148 CO 0.26 -0.09 1.45 -2.84 0.00 0.00 0.00 175.10 173.89 2rce s PRO 149 N 2.21 4.26 0.07 2.72 0.02 -1.26 -5.02 135.00 137.98 2rce s PRO 149 Ca 0.16 2.32 0.09 0.00 0.02 0.00 0.00 61.00 63.59 2rce s PRO 149 Cb -0.16 -3.11 -0.03 0.00 0.02 0.00 0.00 34.50 31.22 2rce s PRO 149 CO 0.12 -0.44 -0.26 -1.01 -0.33 0.00 0.00 177.00 175.08 2rce s HIS 150 N 0.05 2.25 0.08 6.54 3.76 -1.26 -5.03 115.29 121.68 2rce s HIS 150 Ca 0.60 -0.40 -0.31 0.00 -0.15 0.00 0.00 55.06 54.80 2rce s HIS 150 Cb -0.42 -1.31 -0.09 0.00 1.11 0.00 0.00 32.58 31.87 2rce s HIS 150 CO 0.43 0.18 1.66 0.42 -0.85 0.00 0.00 174.74 176.58 2rce s ILE 151 N -0.88 2.96 0.00 0.60 1.01 -1.26 -1.94 121.20 121.68 2rce s ILE 151 Ca 0.12 0.44 0.00 0.00 0.00 0.00 0.00 60.65 61.21 2rce s ILE 151 Cb -0.10 -3.28 0.00 0.00 0.01 0.00 0.00 42.46 39.09 2rce s ILE 151 CO 0.03 0.00 0.00 0.61 0.00 0.00 0.00 174.94 175.58 2rce n GLY 152 N 4.00 1.36 3.73 6.18 0.00 -0.09 -4.98 105.19 115.38 2rce n GLY 152 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 2rce n GLY 152 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2rce n ASP 153 N 0.00 3.81 -4.72 1.61 9.92 -0.82 -4.66 116.55 121.70 2rce n ASP 153 Ca 0.00 1.11 -0.42 0.00 -0.53 0.00 0.00 54.79 54.95 2rce n ASP 153 Cb 0.00 -1.57 -0.03 0.00 -0.64 0.00 0.00 41.12 38.88 2rce n ASP 153 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 2rce s VAL 154 N 0.51 2.71 0.08 2.53 1.01 -1.26 -0.76 120.40 125.23 2rce s VAL 154 Ca 0.69 0.49 0.05 0.00 0.00 0.00 0.00 61.98 63.21 2rce s VAL 154 Cb -0.52 -3.31 -0.03 0.00 0.00 0.00 0.00 36.38 32.52 2rce s VAL 154 CO 0.41 0.03 -0.13 0.68 0.00 0.00 0.00 175.10 176.10 2rce s VAL 155 N 1.27 1.09 -0.08 2.92 -7.23 -0.44 -3.50 120.40 114.44 2rce s VAL 155 Ca 0.70 -1.42 0.04 0.00 -1.81 0.00 0.00 61.98 59.49 2rce s VAL 155 Cb -0.43 -1.17 -0.01 0.00 0.56 0.00 0.00 36.38 35.33 2rce s VAL 155 CO 0.31 -0.32 -0.20 -0.76 -0.31 0.00 0.00 175.10 173.83 2rce s LEU 156 N -1.97 2.39 -0.17 1.32 1.43 0.13 -1.22 118.68 120.59 2rce s LEU 156 Ca 0.01 -0.39 -0.07 0.00 -1.03 0.00 0.00 54.13 52.64 2rce s LEU 156 Cb -0.08 -1.48 -0.04 0.00 0.03 0.00 0.00 46.19 44.62 2rce s LEU 156 CO 0.02 0.25 0.08 0.00 0.23 0.00 0.00 176.35 176.93 2rce s ALA 157 N -0.15 3.53 -0.14 4.21 0.00 0.09 -1.02 121.76 128.28 2rce s ALA 157 Ca -0.03 -0.72 -0.00 0.00 0.00 0.00 0.00 51.96 51.21 2rce s ALA 157 Cb -0.14 -1.94 0.03 0.00 0.00 0.00 0.00 23.12 21.07 2rce s ALA 157 CO 0.04 0.28 -0.11 0.42 0.00 0.00 0.00 175.76 176.39 2rce s ILE 158 N 0.03 1.30 0.00 0.00 1.01 0.51 -1.66 121.20 122.39 2rce s ILE 158 Ca 0.07 -0.49 0.00 0.00 0.00 0.00 0.00 60.65 60.23 2rce s ILE 158 Cb -0.12 -1.28 0.00 0.00 0.01 0.00 0.00 42.46 41.07 2rce s ILE 158 CO 0.00 0.39 0.00 0.61 0.00 0.00 0.00 174.94 175.94 2rce n GLY 159 N 4.85 1.18 2.51 6.18 0.00 -1.08 -2.05 105.19 116.78 2rce n GLY 159 Ca -0.15 -0.84 -0.28 0.00 0.00 0.00 0.00 46.02 44.75 2rce n GLY 159 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2rce n ASN 160 N -0.33 4.04 -4.71 1.61 5.15 -1.15 -0.23 115.26 119.64 2rce n ASN 160 Ca 0.00 -3.47 -0.42 0.00 -0.60 0.00 0.00 54.58 50.09 2rce n ASN 160 Cb 0.00 -0.70 -0.03 0.00 -0.53 0.00 0.00 39.78 38.52 2rce n ASN 160 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 2rce s PRO 161 N -2.62 4.23 -1.64 1.20 0.04 -1.26 -3.21 135.00 131.74 2rce s PRO 161 Ca 0.40 2.26 0.00 0.00 0.04 0.00 0.00 61.00 63.71 2rce s PRO 161 Cb 0.16 -3.36 0.00 0.00 0.04 0.00 0.00 34.50 31.34 2rce s PRO 161 CO -0.02 -0.61 0.00 0.66 0.04 0.00 0.00 177.00 177.07 2rce n TYR 162 N 4.63 -1.01 -1.96 0.56 4.02 -0.08 -1.94 117.16 121.38 2rce n TYR 162 Ca 0.14 0.00 -0.16 0.00 -0.01 0.00 0.00 57.90 57.87 2rce n TYR 162 Cb 0.40 -3.64 -0.04 0.00 -0.02 0.00 0.00 39.34 36.05 2rce n TYR 162 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 2rce n ASN 163 N -1.89 -4.61 0.22 7.72 5.15 -1.20 -4.86 115.26 115.80 2rce n ASN 163 Ca -0.22 0.25 0.09 0.00 -0.60 0.00 0.00 54.58 54.09 2rce n ASN 163 Cb 0.66 -4.01 0.49 0.00 -0.53 0.00 0.00 39.78 36.39 2rce n ASN 163 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 2rce h LEU 164 N 0.00 0.00 0.00 1.20 3.38 -1.64 -3.49 115.31 114.76 2rce h LEU 164 Ca -0.36 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.61 2rce h LEU 164 Cb 1.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.93 2rce h LEU 164 CO 0.48 0.25 0.00 0.61 0.09 0.00 0.00 178.44 179.87 2rce n GLY 165 N -0.16 2.65 3.61 0.83 0.00 -1.26 -5.03 105.19 105.84 2rce n GLY 165 Ca -0.01 -2.09 -0.52 0.00 0.00 0.00 0.00 46.02 43.40 2rce n GLY 165 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2rce n GLN 166 N -0.73 1.23 -4.63 1.61 7.27 -1.26 -4.40 117.38 116.46 2rce n GLN 166 Ca 0.00 0.45 -0.24 0.00 0.07 0.00 0.00 57.00 57.27 2rce n GLN 166 Cb 0.00 -2.11 -0.16 0.00 2.41 0.00 0.00 30.24 30.38 2rce n GLN 166 CO 0.00 0.00 0.00 0.99 0.07 0.00 0.00 177.06 178.12 2rce s THR 167 N 1.02 1.16 -0.19 1.69 2.01 0.67 -4.99 115.64 117.02 2rce s THR 167 Ca 0.86 -0.54 -0.07 0.00 0.31 0.00 0.00 61.69 62.25 2rce s THR 167 Cb -0.95 -1.03 -0.04 0.00 0.01 0.00 0.00 72.50 70.49 2rce s THR 167 CO 0.49 0.35 0.05 -0.63 -0.69 0.00 0.00 174.62 174.20 2rce s ILE 168 N 0.33 4.63 0.21 1.82 -1.09 -1.26 -2.62 121.20 123.23 2rce s ILE 168 Ca -0.08 -0.09 0.09 0.00 -2.23 0.00 0.00 60.65 58.34 2rce s ILE 168 Cb -0.13 -3.09 -0.05 0.00 -1.58 0.00 0.00 42.46 37.61 2rce s ILE 168 CO 0.02 0.44 -0.16 0.42 -1.23 0.00 0.00 174.94 174.43 2rce s THR 169 N 0.57 1.92 -0.01 2.92 -4.23 -0.66 -4.96 115.64 111.18 2rce s THR 169 Ca 0.03 -2.21 0.05 0.00 -1.18 0.00 0.00 61.69 58.38 2rce s THR 169 Cb -0.13 -2.07 -0.01 0.00 1.34 0.00 0.00 72.50 71.63 2rce s THR 169 CO 0.01 -0.50 -0.18 -1.58 -0.54 0.00 0.00 174.62 171.83 2rce s GLN 170 N -3.47 1.45 0.00 3.99 -0.44 -1.26 -0.73 119.66 119.19 2rce s GLN 170 Ca 0.23 -0.64 0.00 0.00 -2.50 0.00 0.00 55.36 52.45 2rce s GLN 170 Cb -0.03 -1.40 0.00 0.00 -1.64 0.00 0.00 33.01 29.94 2rce s GLN 170 CO 0.09 0.38 0.00 0.41 0.50 0.00 0.00 175.29 176.67 2rce n GLY 171 N 2.65 3.58 3.26 2.59 0.00 -0.36 -4.26 105.19 112.65 2rce n GLY 171 Ca -0.15 -0.56 -0.14 0.00 0.00 0.00 0.00 46.02 45.16 2rce n GLY 171 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2rce s ILE 172 N -0.96 0.68 -0.30 -0.61 -4.36 -1.26 -1.33 121.20 113.07 2rce s ILE 172 Ca 0.00 -1.99 -0.29 0.00 -0.26 0.00 0.00 60.65 58.11 2rce s ILE 172 Cb 0.00 -2.24 -0.01 0.00 1.25 0.00 0.00 42.46 41.46 2rce s ILE 172 CO 0.00 -0.37 1.51 -0.63 0.24 0.00 0.00 174.94 175.69 2rce s ILE 173 N -3.66 3.84 -0.15 8.37 1.01 0.06 -3.11 121.20 127.57 2rce s ILE 173 Ca 0.27 0.91 0.16 0.00 0.00 0.00 0.00 60.65 62.00 2rce s ILE 173 Cb 0.06 -3.93 -0.02 0.00 0.01 0.00 0.00 42.46 38.59 2rce s ILE 173 CO 0.06 -0.46 1.19 0.28 0.00 0.00 0.00 174.94 176.02 2rce h SER 174 N 10.58 0.00 -4.02 3.58 0.02 -0.33 -0.21 113.55 123.16 2rce h SER 174 Ca -0.30 0.00 0.10 0.00 -0.84 0.00 0.00 61.79 60.75 2rce h SER 174 Cb 1.13 0.00 -0.23 0.00 0.14 0.00 0.00 62.40 63.44 2rce h SER 174 CO 1.03 0.51 0.60 0.00 -1.14 0.00 0.00 176.83 177.83 2rce s ALA 175 N -2.96 -1.95 -0.48 3.77 0.00 -1.15 -4.93 121.76 114.06 2rce s ALA 175 Ca 0.01 1.61 0.13 0.00 0.00 0.00 0.00 51.96 53.71 2rce s ALA 175 Cb 0.08 -0.76 0.39 0.00 0.00 0.00 0.00 23.12 22.83 2rce s ALA 175 CO 0.77 -0.32 1.31 0.25 0.00 0.00 0.00 175.76 177.77 2rce n THR 176 N 0.66 1.64 0.00 0.00 -2.24 -1.26 -0.93 114.28 112.14 2rce n THR 176 Ca -0.09 -1.47 0.00 0.00 -2.27 0.00 0.00 64.05 60.22 2rce n THR 176 Cb 0.58 0.11 0.00 0.00 -2.10 0.00 0.00 70.33 68.92 2rce n THR 176 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2rce n GLY 177 N -0.13 1.05 2.86 3.38 0.00 -0.87 -4.69 105.19 106.78 2rce n GLY 177 Ca 0.15 -1.85 -0.15 0.00 0.00 0.00 0.00 46.02 44.17 2rce n GLY 177 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2rce s ARG 178 N -1.22 0.21 -0.02 1.61 1.81 0.02 -4.96 118.95 116.40 2rce s ARG 178 Ca 0.00 0.01 -0.21 0.00 -1.72 0.00 0.00 55.73 53.82 2rce s ARG 178 Cb 0.00 -0.31 -0.30 0.00 -0.45 0.00 0.00 34.95 33.89 2rce s ARG 178 CO 0.00 -0.05 0.96 0.82 -0.68 0.00 0.00 175.30 176.35 2rce h ILE 179 N 5.70 1.46 -2.40 1.52 1.08 -1.96 -3.43 117.51 119.49 2rce h ILE 179 Ca -0.35 -2.45 -0.44 0.00 -0.39 0.00 0.00 64.86 61.23 2rce h ILE 179 Cb 1.16 3.03 0.04 0.00 -3.07 0.00 0.00 36.82 37.98 2rce h ILE 179 CO 0.49 0.70 -0.09 -0.83 -0.69 0.00 0.00 178.15 177.74 2rce s GLY 180 N -4.37 1.78 0.33 5.37 0.00 -1.26 -5.06 107.32 104.10 2rce s GLY 180 Ca -0.13 -1.32 -0.29 0.00 0.00 0.00 0.00 44.72 42.99 2rce s GLY 180 CO 0.85 -1.08 1.51 1.08 0.00 0.00 0.00 173.10 175.45 2rce s LEU 181 N -4.64 4.35 0.22 0.66 1.43 -1.26 -4.95 118.68 114.48 2rce s LEU 181 Ca 0.55 2.94 -0.12 0.00 -1.03 0.00 0.00 54.13 56.47 2rce s LEU 181 Cb -0.10 -3.65 -0.00 0.00 0.03 0.00 0.00 46.19 42.47 2rce s LEU 181 CO 0.37 -0.84 0.41 0.54 0.23 0.00 0.00 176.35 177.07 2rce s ASN 182 N 0.12 -0.06 0.50 2.29 2.20 -1.26 -5.06 114.94 113.67 2rce s ASN 182 Ca 0.57 -0.89 0.33 0.00 -0.94 0.00 0.00 52.86 51.94 2rce s ASN 182 Cb -0.46 0.53 1.82 0.00 -2.00 0.00 0.00 41.25 41.14 2rce s ASN 182 CO 0.54 -1.05 2.02 -0.65 -2.94 0.00 0.00 177.10 175.03 2rce h PRO 183 N 2.34 0.00 0.00 3.55 0.11 -1.95 -1.02 132.00 135.03 2rce h PRO 183 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 2rce h PRO 183 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 2rce h PRO 183 CO 0.40 0.00 -0.07 1.79 -0.21 0.00 0.00 178.00 179.91 2rce h THR 184 N 0.00 0.00 0.00 -1.15 1.35 -2.00 -3.47 112.91 107.64 2rce h THR 184 Ca 0.00 -0.95 0.00 0.00 -0.55 0.00 0.00 66.41 64.91 2rce h THR 184 Cb 0.02 1.91 0.00 0.00 -1.73 0.00 0.00 68.15 68.35 2rce h THR 184 CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 2rce n GLY 185 N 1.13 1.90 3.53 5.82 0.00 -0.39 -4.98 105.19 112.19 2rce n GLY 185 Ca 0.04 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.81 2rce n GLY 185 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2rce s ARG 186 N -0.04 1.78 0.00 1.61 0.52 -1.26 -4.95 118.95 116.61 2rce s ARG 186 Ca 0.00 -1.93 0.02 0.00 -0.52 0.00 0.00 55.73 53.30 2rce s ARG 186 Cb 0.00 -1.59 -0.01 0.00 0.52 0.00 0.00 34.95 33.86 2rce s ARG 186 CO 0.00 0.10 0.17 1.04 0.02 0.00 0.00 175.30 176.63 2rce n GLN 187 N -0.77 4.99 -0.02 3.54 1.13 -1.26 -4.74 117.38 120.25 2rce n GLN 187 Ca -0.05 -0.13 0.02 0.00 -1.94 0.00 0.00 57.00 54.91 2rce n GLN 187 Cb 0.64 -0.67 0.03 0.00 0.11 0.00 0.00 30.24 30.35 2rce n GLN 187 CO 0.00 0.00 0.00 0.27 -1.44 0.00 0.00 177.06 175.89 2rce n ASN 188 N -0.80 1.99 -4.77 1.08 6.94 -1.26 -0.80 115.26 117.64 2rce n ASN 188 Ca 0.00 -2.19 -0.40 0.00 -0.02 0.00 0.00 54.58 51.97 2rce n ASN 188 Cb 0.03 -0.09 -0.02 0.00 -2.36 0.00 0.00 39.78 37.33 2rce n ASN 188 CO 0.00 0.00 0.00 -0.36 -1.03 0.00 0.00 177.26 175.87 2rce s PHE 189 N -1.35 3.16 0.04 -2.53 0.08 -1.26 -4.38 117.98 111.74 2rce s PHE 189 Ca 0.07 1.50 -0.25 0.00 0.12 0.00 0.00 56.93 58.36 2rce s PHE 189 Cb 0.06 -3.56 -0.05 0.00 -0.57 0.00 0.00 43.02 38.89 2rce s PHE 189 CO 0.01 -1.51 0.78 -0.51 -0.10 0.00 0.00 175.22 173.89 2rce s LEU 190 N -1.82 4.44 0.01 -0.37 1.43 -0.19 -2.06 118.68 120.13 2rce s LEU 190 Ca 0.49 1.47 0.01 0.00 -1.03 0.00 0.00 54.13 55.07 2rce s LEU 190 Cb -0.37 -3.26 -0.04 0.00 0.03 0.00 0.00 46.19 42.55 2rce s LEU 190 CO 0.49 -0.01 0.02 -1.58 0.23 0.00 0.00 176.35 175.50 2rce s GLN 191 N 0.03 2.83 0.06 1.70 0.74 -0.11 -0.36 119.66 124.55 2rce s GLN 191 Ca 0.40 -0.61 -0.13 0.00 0.05 0.00 0.00 55.36 55.07 2rce s GLN 191 Cb -0.21 -2.70 0.02 0.00 1.10 0.00 0.00 33.01 31.22 2rce s GLN 191 CO 0.23 0.62 0.28 -0.08 -0.55 0.00 0.00 175.29 175.79 2rce s THR 192 N -1.16 0.09 -1.48 -0.34 -1.32 -0.18 0.46 115.64 111.72 2rce s THR 192 Ca 0.22 -0.78 0.16 0.00 -1.21 0.00 0.00 61.69 60.08 2rce s THR 192 Cb -0.12 -1.02 0.38 0.00 -1.51 0.00 0.00 72.50 70.23 2rce s THR 192 CO 0.13 -0.43 1.30 -0.90 -2.21 0.00 0.00 174.62 172.50 2rce n ASP 193 N 0.40 3.14 -4.67 8.08 5.75 -1.18 -0.66 116.55 127.41 2rce n ASP 193 Ca -0.18 -1.93 -0.45 0.00 -0.01 0.00 0.00 54.79 52.22 2rce n ASP 193 Cb 0.60 -0.27 -0.04 0.00 -1.03 0.00 0.00 41.12 40.39 2rce n ASP 193 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2rce n ALA 194 N 0.96 1.35 -1.67 2.12 0.00 -1.26 -4.66 120.51 117.34 2rce n ALA 194 Ca 0.15 0.27 -0.47 0.00 0.00 0.00 0.00 53.44 53.39 2rce n ALA 194 Cb 0.48 -2.57 -0.04 0.00 0.00 0.00 0.00 19.45 17.31 2rce n ALA 194 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2rce n SER 195 N 6.67 3.18 -3.99 0.00 7.64 -1.26 -4.79 113.62 121.06 2rce n SER 195 Ca 0.21 1.04 -0.24 0.00 1.01 0.00 0.00 58.87 60.89 2rce n SER 195 Cb 0.35 -1.40 -0.17 0.00 -1.01 0.00 0.00 64.21 61.99 2rce n SER 195 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2rce s ILE 196 N 2.11 1.04 0.31 0.44 -1.09 -1.26 -4.76 121.20 117.99 2rce s ILE 196 Ca 0.84 -0.41 0.03 0.00 -2.23 0.00 0.00 60.65 58.88 2rce s ILE 196 Cb -0.69 -0.97 -0.05 0.00 -1.58 0.00 0.00 42.46 39.16 2rce s ILE 196 CO 0.43 0.34 0.09 0.20 -1.23 0.00 0.00 174.94 174.78 2rce s ASN 197 N 0.81 1.89 0.05 3.58 0.01 -1.26 -4.99 114.94 115.03 2rce s ASN 197 Ca -0.12 -1.44 -0.32 0.00 -0.71 0.00 0.00 52.86 50.26 2rce s ASN 197 Cb -0.15 0.14 -0.11 0.00 0.41 0.00 0.00 41.25 41.54 2rce s ASN 197 CO 0.02 -0.73 1.84 1.57 -1.51 0.00 0.00 177.10 178.28 2rce n HIS 198 N -0.62 2.46 0.00 2.20 -0.00 -1.26 -0.88 115.22 117.11 2rce n HIS 198 Ca -0.02 -0.08 0.00 0.00 -0.00 0.00 0.00 57.72 57.63 2rce n HIS 198 Cb 0.66 -2.69 0.00 0.00 -0.00 0.00 0.00 29.99 27.96 2rce n HIS 198 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2rce n GLY 199 N 4.21 2.63 3.57 1.57 0.00 -1.26 -0.90 105.19 115.00 2rce n GLY 199 Ca 0.20 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.83 2rce n GLY 199 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2rce s ASN 200 N -1.67 6.33 0.00 1.61 -0.87 -0.06 -2.92 114.94 117.35 2rce s ASN 200 Ca 0.00 -1.64 0.00 0.00 -1.57 0.00 0.00 52.86 49.65 2rce s ASN 200 Cb 0.00 -2.57 0.00 0.00 -0.02 0.00 0.00 41.25 38.66 2rce s ASN 200 CO 0.00 -1.68 0.00 0.61 -2.57 0.00 0.00 177.10 173.46 2rce n GLY 202 N 6.41 0.00 4.01 0.66 0.00 0.14 -4.58 105.19 111.83 2rce n GLY 202 Ca 0.39 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.18 2rce n GLY 202 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2rce s GLY 203 N 0.00 1.74 0.10 -0.02 0.00 -1.26 -3.44 107.32 104.44 2rce s GLY 203 Ca 0.00 -1.94 -0.18 0.00 0.00 0.00 0.00 44.72 42.59 2rce s GLY 203 CO 0.00 -1.33 0.58 0.00 0.00 0.00 0.00 173.10 172.35 2rce s ALA 204 N -3.12 3.57 -0.27 3.20 0.00 -0.87 -0.84 121.76 123.44 2rce s ALA 204 Ca 0.67 0.01 -0.02 0.00 0.00 0.00 0.00 51.96 52.62 2rce s ALA 204 Cb -0.04 -2.63 0.03 0.00 0.00 0.00 0.00 23.12 20.48 2rce s ALA 204 CO 0.44 0.41 -0.03 -1.17 0.00 0.00 0.00 175.76 175.41 2rce s LEU 205 N -1.36 3.43 0.26 0.00 2.96 -0.27 -0.36 118.68 123.33 2rce s LEU 205 Ca 0.32 -0.93 0.12 0.00 -0.22 0.00 0.00 54.13 53.42 2rce s LEU 205 Cb -0.18 -1.70 -0.05 0.00 0.50 0.00 0.00 46.19 44.75 2rce s LEU 205 CO 0.19 -0.16 -0.18 0.68 -1.32 0.00 0.00 176.35 175.56 2rce s VAL 206 N 1.34 2.59 0.35 1.68 -7.23 -0.19 0.88 120.40 119.82 2rce s VAL 206 Ca -0.01 -2.27 -0.03 0.00 -1.81 0.00 0.00 61.98 57.86 2rce s VAL 206 Cb -0.17 -2.34 0.08 0.00 0.56 0.00 0.00 36.38 34.50 2rce s VAL 206 CO -0.03 -0.34 0.48 -0.46 -0.31 0.00 0.00 175.10 174.44 2rce n ASN 207 N -0.48 0.30 0.00 4.85 0.23 -0.46 0.19 115.26 119.90 2rce n ASN 207 Ca -0.07 -1.34 0.05 0.00 -0.53 0.00 0.00 54.58 52.70 2rce n ASN 207 Cb 0.59 -0.34 0.24 0.00 -2.08 0.00 0.00 39.78 38.19 2rce n ASN 207 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 2rce n SER 208 N -3.15 0.00 -0.49 0.53 3.41 -1.23 -1.52 113.62 111.17 2rce n SER 208 Ca 0.07 0.46 0.11 0.00 -0.26 0.00 0.00 58.87 59.25 2rce n SER 208 Cb 0.24 -0.48 0.07 0.00 -0.26 0.00 0.00 64.21 63.78 2rce n SER 208 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2rce n LEU 209 N -1.48 1.94 0.00 1.04 4.77 -1.26 -3.97 117.00 118.04 2rce n LEU 209 Ca 0.03 -0.69 0.00 0.00 -0.03 0.00 0.00 56.01 55.31 2rce n LEU 209 Cb 0.12 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.19 2rce n LEU 209 CO 0.10 0.36 0.00 0.61 -1.33 0.00 0.00 177.39 177.13 2rce n GLY 210 N 1.40 0.75 3.71 -0.72 0.00 -0.58 -4.73 105.19 105.02 2rce n GLY 210 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 2rce n GLY 210 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2rce s GLU 211 N -0.43 4.54 0.12 1.61 2.02 -1.26 -4.22 118.70 121.07 2rce s GLU 211 Ca 0.00 1.36 -0.31 0.00 0.02 0.00 0.00 54.97 56.04 2rce s GLU 211 Cb 0.00 -3.46 -0.10 0.00 0.10 0.00 0.00 34.13 30.67 2rce s GLU 211 CO 0.00 -0.06 1.73 -1.17 0.02 0.00 0.00 175.26 175.78 2rce s LEU 212 N 1.05 4.38 -0.23 1.80 2.96 -0.25 -1.35 118.68 127.04 2rce s LEU 212 Ca 0.50 2.66 -0.01 0.00 -0.22 0.00 0.00 54.13 57.07 2rce s LEU 212 Cb -0.20 -3.57 -0.14 0.00 0.50 0.00 0.00 46.19 42.77 2rce s LEU 212 CO 0.26 -0.94 -0.22 0.23 -1.32 0.00 0.00 176.35 174.36 2rce n MET 213 N 5.28 0.57 -3.52 1.98 2.81 0.25 -4.77 117.12 119.72 2rce n MET 213 Ca 0.16 0.15 -0.06 0.00 -1.81 0.00 0.00 57.70 56.15 2rce n MET 213 Cb 0.39 -1.45 0.02 0.00 -0.71 0.00 0.00 33.22 31.47 2rce n MET 213 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2rce n GLY 214 N 2.23 0.91 3.34 3.03 0.00 -0.84 -1.01 105.19 112.86 2rce n GLY 214 Ca -0.42 -1.19 -0.36 0.00 0.00 0.00 0.00 46.02 44.05 2rce n GLY 214 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2rce s ILE 215 N -2.16 3.75 0.10 -0.61 -1.09 0.11 -1.11 121.20 120.19 2rce s ILE 215 Ca 0.17 -0.53 -0.31 0.00 -2.23 0.00 0.00 60.65 57.75 2rce s ILE 215 Cb -0.04 -2.81 -0.09 0.00 -1.58 0.00 0.00 42.46 37.95 2rce s ILE 215 CO 0.08 0.27 1.56 0.20 -1.23 0.00 0.00 174.94 175.82 2rce s ASN 216 N 1.51 6.66 0.00 3.58 0.01 -0.02 -0.26 114.94 126.41 2rce s ASN 216 Ca 0.04 2.47 0.00 0.00 -0.71 0.00 0.00 52.86 54.66 2rce s ASN 216 Cb -0.16 -2.58 0.00 0.00 0.41 0.00 0.00 41.25 38.93 2rce s ASN 216 CO 0.00 -0.81 0.00 0.41 -1.51 0.00 0.00 177.10 175.19 2rce n THR 217 N 4.34 0.00 -4.24 1.60 -1.04 -0.32 0.27 114.28 114.88 2rce n THR 217 Ca 0.14 0.00 -0.14 0.00 -2.04 0.00 0.00 64.05 62.01 2rce n THR 217 Cb 0.40 -0.89 -0.10 0.00 -1.82 0.00 0.00 70.33 67.92 2rce n THR 217 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 2rce s LEU 218 N -5.28 2.34 -0.00 -4.42 1.43 -1.08 -4.89 118.68 106.78 2rce s LEU 218 Ca 0.00 -1.09 0.01 0.00 -1.03 0.00 0.00 54.13 52.02 2rce s LEU 218 Cb 0.00 -0.19 -0.00 0.00 0.03 0.00 0.00 46.19 46.03 2rce s LEU 218 CO 0.00 -0.46 -0.03 -0.55 0.23 0.00 0.00 176.35 175.54 2rce s SER 219 N -3.17 0.40 -0.32 2.29 0.15 -1.26 -0.32 113.70 111.48 2rce s SER 219 Ca 0.20 -0.06 -0.28 0.00 0.70 0.00 0.00 55.95 56.51 2rce s SER 219 Cb 0.05 -0.05 -0.03 0.00 -1.71 0.00 0.00 66.02 64.28 2rce s SER 219 CO 0.02 0.04 1.97 0.12 1.20 0.00 0.00 173.24 176.59 2rce s PHE 220 N -0.05 1.55 -0.13 3.44 2.19 0.11 -4.84 117.98 120.24 2rce s PHE 220 Ca 0.01 0.66 0.18 0.00 0.33 0.00 0.00 56.93 58.11 2rce s PHE 220 Cb -0.02 -4.03 -0.18 0.00 -1.31 0.00 0.00 43.02 37.49 2rce s PHE 220 CO -0.00 -3.26 0.66 -0.40 1.83 0.00 0.00 175.22 174.04 2rce n ASP 221 N 11.20 0.58 -0.86 6.13 3.85 -1.26 -4.55 116.55 131.64 2rce n ASP 221 Ca 0.26 0.25 0.00 0.00 -0.71 0.00 0.00 54.79 54.59 2rce n ASP 221 Cb 0.47 0.61 0.00 0.00 -1.35 0.00 0.00 41.12 40.85 2rce n ASP 221 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.20 177.36 2rce n LYS 222 N -2.75 1.15 0.00 0.11 3.00 -1.26 -4.72 118.16 113.68 2rce n LYS 222 Ca -0.12 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.19 2rce n LYS 222 Cb 0.83 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.86 2rce n LYS 222 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.40 177.00 2rce n ASP 225 N 0.00 0.00 -2.06 3.14 5.75 -1.26 -4.36 116.55 117.76 2rce n ASP 225 Ca 0.00 0.00 -0.07 0.00 -0.01 0.00 0.00 54.79 54.71 2rce n ASP 225 Cb 0.00 0.00 0.04 0.00 -1.03 0.00 0.00 41.12 40.13 2rce n ASP 225 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2rce n GLY 226 N 0.00 0.09 3.78 6.12 0.00 -1.26 -5.02 105.19 108.91 2rce n GLY 226 Ca 0.00 -0.17 -0.36 0.00 0.00 0.00 0.00 46.02 45.48 2rce n GLY 226 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2rce s GLU 227 N -4.37 4.04 -0.43 1.61 2.56 -1.26 -4.98 118.70 115.87 2rce s GLU 227 Ca 0.04 1.56 -0.29 0.00 0.00 0.00 0.00 54.97 56.28 2rce s GLU 227 Cb -0.01 -2.47 0.01 0.00 2.00 0.00 0.00 34.13 33.66 2rce s GLU 227 CO 0.31 -0.26 1.38 0.99 -0.56 0.00 0.00 175.26 177.12 2rce s THR 228 N -1.66 3.93 0.34 -1.70 2.01 -1.26 -4.70 115.64 112.60 2rce s THR 228 Ca 0.60 0.95 -0.27 0.00 0.31 0.00 0.00 61.69 63.28 2rce s THR 228 Cb -0.23 -4.26 -0.09 0.00 0.01 0.00 0.00 72.50 67.92 2rce s THR 228 CO 0.28 -0.81 1.04 -2.84 -0.69 0.00 0.00 174.62 171.60 2rce s PRO 229 N 4.91 4.44 -0.09 4.92 0.02 -1.26 -5.05 135.00 142.89 2rce s PRO 229 Ca 0.59 1.56 0.04 0.00 0.02 0.00 0.00 61.00 63.22 2rce s PRO 229 Cb -0.13 -2.85 0.00 0.00 0.02 0.00 0.00 34.50 31.55 2rce s PRO 229 CO 0.32 0.10 -0.21 -2.00 -0.33 0.00 0.00 177.00 174.88 2rce s GLU 230 N -1.98 2.65 -0.80 5.54 2.12 -1.26 -4.81 118.70 120.16 2rce s GLU 230 Ca 0.51 -0.77 -0.01 0.00 0.36 0.00 0.00 54.97 55.06 2rce s GLU 230 Cb -0.25 -2.06 0.00 0.00 0.26 0.00 0.00 34.13 32.09 2rce s GLU 230 CO 0.31 0.17 0.19 0.41 -0.54 0.00 0.00 175.26 175.80 2rce n GLY 231 N 3.52 0.04 3.01 -1.50 0.00 -1.26 -5.01 105.19 103.99 2rce n GLY 231 Ca -0.20 -0.38 -0.31 0.00 0.00 0.00 0.00 46.02 45.13 2rce n GLY 231 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2rce s ILE 232 N -2.73 2.20 0.18 -0.61 1.01 -1.26 -3.72 121.20 116.28 2rce s ILE 232 Ca 0.10 -2.20 0.08 0.00 0.00 0.00 0.00 60.65 58.62 2rce s ILE 232 Cb -0.04 -2.58 -0.04 0.00 0.01 0.00 0.00 42.46 39.80 2rce s ILE 232 CO 0.12 -0.52 -0.15 -0.83 0.00 0.00 0.00 174.94 173.55 2rce s GLY 233 N 0.96 1.37 -0.01 6.18 0.00 0.17 -0.72 107.32 115.27 2rce s GLY 233 Ca 0.08 -1.57 0.04 0.00 0.00 0.00 0.00 44.72 43.27 2rce s GLY 233 CO -0.08 -1.65 -0.12 -1.36 0.00 0.00 0.00 173.10 169.89 2rce s PHE 234 N -2.63 1.12 0.01 1.90 0.08 0.57 -1.01 117.98 118.03 2rce s PHE 234 Ca 0.19 -0.23 0.05 0.00 0.12 0.00 0.00 56.93 57.06 2rce s PHE 234 Cb -0.03 -0.73 -0.02 0.00 -0.57 0.00 0.00 43.02 41.68 2rce s PHE 234 CO 0.06 -0.03 -0.15 0.00 -0.10 0.00 0.00 175.22 174.99 2rce s ALA 235 N -0.22 1.27 -0.06 5.36 0.00 0.52 -1.18 121.76 127.45 2rce s ALA 235 Ca 0.03 -0.75 -0.30 0.00 0.00 0.00 0.00 51.96 50.94 2rce s ALA 235 Cb -0.06 -0.27 -0.03 0.00 0.00 0.00 0.00 23.12 22.76 2rce s ALA 235 CO -0.00 0.29 1.20 0.42 0.00 0.00 0.00 175.76 177.66 2rce s ILE 236 N -0.57 4.27 0.41 0.00 -1.09 0.64 -1.02 121.20 123.84 2rce s ILE 236 Ca 0.05 1.59 -0.26 0.00 -2.23 0.00 0.00 60.65 59.80 2rce s ILE 236 Cb -0.07 -4.02 -0.09 0.00 -1.58 0.00 0.00 42.46 36.70 2rce s ILE 236 CO 0.00 -0.01 1.33 -2.16 -1.23 0.00 0.00 174.94 172.88 2rce s PRO 237 N 2.28 3.93 0.48 2.79 0.04 -1.26 0.08 135.00 143.34 2rce s PRO 237 Ca 0.55 2.22 0.15 0.00 0.04 0.00 0.00 61.00 63.97 2rce s PRO 237 Cb -0.24 -2.76 1.16 0.00 0.04 0.00 0.00 34.50 32.70 2rce s PRO 237 CO 0.21 -0.54 2.08 0.27 0.04 0.00 0.00 177.00 179.06 2rce h PHE 238 N 2.65 0.18 -0.45 0.56 -5.15 -1.37 -1.52 116.94 111.84 2rce h PHE 238 Ca -0.50 0.00 -0.12 0.00 -0.20 0.00 0.00 57.97 57.16 2rce h PHE 238 Cb 1.25 -0.06 -0.01 0.00 0.22 0.00 0.00 35.95 37.35 2rce h PHE 238 CO 0.53 0.11 -0.18 1.96 -2.00 0.00 0.00 178.31 178.72 2rce h GLN 239 N 0.19 0.92 -0.35 6.09 7.50 -1.91 0.41 115.11 127.96 2rce h GLN 239 Ca 0.11 -0.38 -0.05 0.00 0.50 0.00 0.00 58.65 58.83 2rce h GLN 239 Cb 0.22 -0.03 -0.01 0.00 0.05 0.00 0.00 27.48 27.70 2rce h GLN 239 CO -0.02 1.04 0.01 1.25 -1.50 0.00 0.00 178.83 179.61 2rce h LEU 240 N 0.75 0.60 -0.99 1.46 5.85 -1.76 -2.86 115.31 118.36 2rce h LEU 240 Ca 0.11 -0.30 -0.04 0.00 0.84 0.00 0.00 57.88 58.48 2rce h LEU 240 Cb 0.74 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.58 2rce h LEU 240 CO 0.06 0.75 0.21 0.00 -0.34 0.00 0.00 178.44 179.12 2rce h ALA 241 N 0.87 1.19 -0.05 1.25 0.00 -1.00 -0.90 119.26 120.62 2rce h ALA 241 Ca 0.10 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 2rce h ALA 241 Cb 0.43 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.97 2rce h ALA 241 CO 0.02 0.57 0.03 1.15 0.00 0.00 0.00 179.25 181.02 2rce h THR 242 N 0.92 1.04 0.25 0.00 2.02 -0.95 -1.55 112.91 114.65 2rce h THR 242 Ca 0.21 -0.11 -0.01 0.00 0.77 0.00 0.00 66.41 67.27 2rce h THR 242 Cb 0.24 1.02 0.00 0.00 -1.74 0.00 0.00 68.15 67.67 2rce h THR 242 CO -0.01 0.04 -0.12 0.11 0.37 0.00 0.00 175.52 175.90 2rce h LYS 243 N 0.04 -0.33 -0.70 6.66 1.57 -1.23 -1.09 116.57 121.49 2rce h LYS 243 Ca 0.02 0.02 0.05 0.00 -1.87 0.00 0.00 60.65 58.87 2rce h LYS 243 Cb 0.03 0.07 -0.05 0.00 0.08 0.00 0.00 32.23 32.36 2rce h LYS 243 CO -0.00 -0.22 0.41 0.82 -0.57 0.00 0.00 179.45 179.89 2rce h ILE 244 N -0.34 1.00 -0.40 1.86 1.08 -1.20 -1.94 117.51 117.58 2rce h ILE 244 Ca -0.03 -0.26 0.01 0.00 -0.39 0.00 0.00 64.86 64.19 2rce h ILE 244 Cb 0.26 0.18 -0.02 0.00 -3.07 0.00 0.00 36.82 34.17 2rce h ILE 244 CO 0.05 0.14 0.24 -0.03 -0.69 0.00 0.00 178.15 177.86 2rce h MET 245 N 0.76 0.48 -0.34 2.37 4.05 -1.09 -1.78 114.93 119.38 2rce h MET 245 Ca 0.31 -0.03 -0.03 0.00 -0.28 0.00 0.00 59.70 59.66 2rce h MET 245 Cb 0.15 -0.11 -0.02 0.00 -0.80 0.00 0.00 31.60 30.83 2rce h MET 245 CO -0.17 0.32 0.07 -0.44 0.23 0.00 0.00 176.91 176.92 2rce h ASP 246 N 0.50 0.46 0.54 1.39 3.32 -0.55 0.46 116.42 122.53 2rce h ASP 246 Ca 0.16 -0.06 -0.24 0.00 0.02 0.00 0.00 57.03 56.90 2rce h ASP 246 Cb -0.01 -0.12 -0.00 0.00 0.22 0.00 0.00 39.33 39.42 2rce h ASP 246 CO -0.06 0.47 -1.07 0.11 -1.72 0.00 0.00 179.24 176.98 2rce h LYS 247 N 0.49 0.29 -0.17 3.56 1.57 -1.25 -2.50 116.57 118.56 2rce h LYS 247 Ca 0.12 -0.39 -0.17 0.00 -1.87 0.00 0.00 60.65 58.34 2rce h LYS 247 Cb 0.21 0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.65 2rce h LYS 247 CO -0.00 1.12 -0.58 -0.07 -0.57 0.00 0.00 179.45 179.35 2rce h LEU 248 N 0.13 0.61 -0.95 2.94 3.38 -0.89 -2.51 115.31 118.03 2rce h LEU 248 Ca -0.09 -0.34 0.00 0.00 0.09 0.00 0.00 57.88 57.54 2rce h LEU 248 Cb 1.75 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 42.28 2rce h LEU 248 CO 0.17 1.06 0.60 0.40 0.09 0.00 0.00 178.44 180.77 2rce h ILE 249 N 0.41 1.25 0.00 1.22 2.04 -0.99 -0.79 117.51 120.65 2rce h ILE 249 Ca 0.00 -0.50 0.00 0.00 1.00 0.00 0.00 64.86 65.36 2rce h ILE 249 Cb 1.13 -0.12 0.00 0.00 -0.74 0.00 0.00 36.82 37.09 2rce h ILE 249 CO 0.11 0.25 0.00 -1.14 0.00 0.00 0.00 178.15 177.37 2rce n ARG 250 N -4.39 0.45 0.00 2.37 3.00 -0.94 -4.88 116.66 112.27 2rce n ARG 250 Ca 0.11 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.96 2rce n ARG 250 Cb 0.03 -1.15 0.00 0.00 0.00 0.00 0.00 32.46 31.35 2rce n ARG 250 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 2rce n ASP 251 N -0.65 0.00 -4.76 6.15 8.00 -0.30 -4.92 116.55 120.07 2rce n ASP 251 Ca 0.03 0.00 -0.39 0.00 0.71 0.00 0.00 54.79 55.14 2rce n ASP 251 Cb 0.01 0.00 0.02 0.00 -0.02 0.00 0.00 41.12 41.13 2rce n ASP 251 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2rce s GLY 252 N 0.00 2.89 0.00 0.44 0.00 -1.24 -4.77 107.32 104.64 2rce s GLY 252 Ca 0.00 1.30 0.00 0.00 0.00 0.00 0.00 44.72 46.02 2rce s GLY 252 CO 0.00 1.85 0.00 0.54 0.00 0.00 0.00 173.10 175.49