#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rce n ASP 41 N 0.00 3.04 -4.77 8.00 9.92 -1.26 -4.99 116.55 126.49 2rce n ASP 41 Ca 0.00 -1.88 -0.36 0.00 -0.53 0.00 0.00 54.79 52.02 2rce n ASP 41 Cb 0.00 -0.20 0.01 0.00 -0.64 0.00 0.00 41.12 40.28 2rce n ASP 41 CO 0.00 0.00 0.00 -1.61 0.13 0.00 0.00 177.20 175.72 2rce s GLU 42 N -1.23 3.39 -0.23 -1.24 2.02 -1.26 -5.04 118.70 115.12 2rce s GLU 42 Ca 0.30 1.72 -0.06 0.00 0.02 0.00 0.00 54.97 56.94 2rce s GLU 42 Cb 0.17 -2.11 -0.03 0.00 0.10 0.00 0.00 34.13 32.27 2rce s GLU 42 CO 0.24 -0.85 0.04 0.99 0.02 0.00 0.00 175.26 175.71 2rce s THR 43 N -1.66 4.21 0.43 3.63 2.01 -1.26 -5.09 115.64 117.90 2rce s THR 43 Ca 0.71 -0.22 -0.26 0.00 0.31 0.00 0.00 61.69 62.24 2rce s THR 43 Cb -0.27 -2.94 -0.08 0.00 0.01 0.00 0.00 72.50 69.22 2rce s THR 43 CO 0.31 0.38 1.37 -2.84 -0.69 0.00 0.00 174.62 173.15 2rce s PRO 44 N 1.28 3.82 0.34 4.92 0.02 -1.26 -4.97 135.00 139.15 2rce s PRO 44 Ca 0.04 2.29 -0.29 0.00 0.02 0.00 0.00 61.00 63.06 2rce s PRO 44 Cb -0.15 -2.70 -0.11 0.00 0.02 0.00 0.00 34.50 31.56 2rce s PRO 44 CO 0.02 -0.66 1.52 0.00 -0.33 0.00 0.00 177.00 177.55 2rce s ALA 45 N -1.23 3.63 -0.18 -1.55 0.00 -1.26 -4.98 121.76 116.19 2rce s ALA 45 Ca 0.59 1.55 -0.28 0.00 0.00 0.00 0.00 51.96 53.82 2rce s ALA 45 Cb -0.41 -3.62 0.10 0.00 0.00 0.00 0.00 23.12 19.19 2rce s ALA 45 CO 0.53 -1.01 0.84 0.45 0.00 0.00 0.00 175.76 176.57 2rce s SER 46 N 0.09 -0.57 -0.25 0.00 0.15 -1.26 -5.01 113.70 106.85 2rce s SER 46 Ca 0.57 0.85 0.13 0.00 0.70 0.00 0.00 55.95 58.19 2rce s SER 46 Cb -0.47 0.78 0.57 0.00 -1.71 0.00 0.00 66.02 65.19 2rce s SER 46 CO 0.57 -0.36 1.52 -1.22 1.20 0.00 0.00 173.24 174.94 2rce n TYR 47 N 1.57 1.31 0.09 3.44 4.02 -1.26 -4.70 117.16 121.63 2rce n TYR 47 Ca -0.14 -1.18 0.08 0.00 -0.01 0.00 0.00 57.90 56.64 2rce n TYR 47 Cb 0.56 -0.45 0.54 0.00 -0.02 0.00 0.00 39.34 39.97 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 1.68 0.23 -0.07 7.72 -0.73 -1.95 -2.39 115.58 120.08 2rce h ASN 48 Ca 0.13 -0.00 0.02 0.00 1.87 0.00 0.00 56.30 58.31 2rce h ASN 48 Cb 1.71 -0.06 -0.02 0.00 0.27 0.00 0.00 38.32 40.23 2rce h ASN 48 CO 0.39 0.16 -0.02 0.25 -0.37 0.00 0.00 177.43 177.84 2rce h LEU 49 N 0.27 -0.09 -0.97 0.34 5.85 -1.90 0.14 115.31 118.96 2rce h LEU 49 Ca 0.11 0.02 0.03 0.00 0.84 0.00 0.00 57.88 58.89 2rce h LEU 49 Cb 0.12 0.05 -0.06 0.00 0.37 0.00 0.00 40.66 41.15 2rce h LEU 49 CO -0.02 -0.03 0.63 0.00 -0.34 0.00 0.00 178.44 178.68 2rce h ALA 50 N 1.06 1.28 0.11 1.25 0.00 -1.58 -1.72 119.26 119.67 2rce h ALA 50 Ca 0.04 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2rce h ALA 50 Cb 0.07 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.51 2rce h ALA 50 CO -0.08 0.53 -0.06 0.28 0.00 0.00 0.00 179.25 179.92 2rce h VAL 51 N 1.23 0.95 -0.57 0.00 2.07 -0.96 -0.60 116.25 118.37 2rce h VAL 51 Ca 0.38 -0.23 -0.00 0.00 0.82 0.00 0.00 66.70 67.68 2rce h VAL 51 Cb -0.01 1.09 -0.03 0.00 -1.52 0.00 0.00 31.29 30.82 2rce h VAL 51 CO -0.12 0.06 0.35 0.03 0.02 0.00 0.00 177.57 177.91 2rce h ARG 52 N -0.26 0.76 0.02 1.57 3.08 -0.53 0.27 114.38 119.30 2rce h ARG 52 Ca -0.02 -0.06 -0.25 0.00 0.07 0.00 0.00 59.98 59.73 2rce h ARG 52 Cb 0.21 -0.17 0.01 0.00 0.08 0.00 0.00 29.97 30.10 2rce h ARG 52 CO 0.03 0.53 -1.03 0.00 -1.07 0.00 0.00 179.97 178.43 2rce h ARG 53 N 0.78 0.51 0.00 0.04 3.08 -1.19 -3.41 114.38 114.19 2rce h ARG 53 Ca 0.21 -0.58 -0.30 0.00 0.07 0.00 0.00 59.98 59.37 2rce h ARG 53 Cb -0.05 0.17 -0.05 0.00 0.08 0.00 0.00 29.97 30.12 2rce h ARG 53 CO -0.04 1.21 -2.15 0.00 -1.07 0.00 0.00 179.97 177.92 2rce n ALA 54 N -2.59 1.56 -0.14 0.04 0.00 -0.24 -4.55 120.51 114.60 2rce n ALA 54 Ca -0.09 -0.87 0.01 0.00 0.00 0.00 0.00 53.44 52.49 2rce n ALA 54 Cb 0.88 0.03 0.29 0.00 0.00 0.00 0.00 19.45 20.65 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 0.03 1.50 -0.10 0.00 0.00 -1.11 -2.33 119.26 117.24 2rce h ALA 55 Ca -0.45 -0.07 0.03 0.00 0.00 0.00 0.00 54.91 54.42 2rce h ALA 55 Cb 1.71 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 19.24 2rce h ALA 55 CO -0.07 0.44 0.12 -1.35 0.00 0.00 0.00 179.25 178.40 2rce h PRO 56 N 0.85 0.00 -0.01 0.00 0.11 -1.80 -1.74 132.00 129.42 2rce h PRO 56 Ca 0.22 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.33 2rce h PRO 56 Cb -0.04 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.07 2rce h PRO 56 CO -0.04 0.00 -0.24 0.00 -0.21 0.00 0.00 178.00 177.51 2rce n ALA 57 N -2.31 3.03 -2.67 -0.75 0.00 -0.88 -4.52 120.51 112.42 2rce n ALA 57 Ca -0.00 -0.36 -0.37 0.00 0.00 0.00 0.00 53.44 52.71 2rce n ALA 57 Cb 0.23 -1.19 -0.08 0.00 0.00 0.00 0.00 19.45 18.41 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 -2.55 5.28 0.21 0.00 1.01 -0.65 -0.59 120.40 123.10 2rce s VAL 58 Ca 0.24 0.45 0.08 0.00 0.00 0.00 0.00 61.98 62.75 2rce s VAL 58 Cb 0.19 -3.61 -0.04 0.00 0.00 0.00 0.00 36.38 32.92 2rce s VAL 58 CO 0.53 0.31 0.01 0.68 0.00 0.00 0.00 175.10 176.63 2rce s VAL 59 N 1.13 3.69 -0.15 2.92 -7.23 0.42 -4.53 120.40 116.64 2rce s VAL 59 Ca 0.13 -1.57 -0.21 0.00 -1.81 0.00 0.00 61.98 58.53 2rce s VAL 59 Cb -0.14 -2.90 -0.03 0.00 0.56 0.00 0.00 36.38 33.87 2rce s VAL 59 CO 0.06 -0.21 0.61 0.20 -0.31 0.00 0.00 175.10 175.45 2rce s ASN 60 N -3.23 6.74 -0.19 4.85 0.01 -0.33 -1.20 114.94 121.60 2rce s ASN 60 Ca 0.29 0.90 -0.05 0.00 -0.71 0.00 0.00 52.86 53.29 2rce s ASN 60 Cb -0.08 -2.35 -0.03 0.00 0.41 0.00 0.00 41.25 39.20 2rce s ASN 60 CO 0.19 -0.18 -0.00 -0.69 -1.51 0.00 0.00 177.10 174.91 2rce s VAL 61 N 1.41 4.03 -0.19 1.60 1.01 -0.40 -0.83 120.40 127.03 2rce s VAL 61 Ca 0.30 -0.29 -0.01 0.00 0.00 0.00 0.00 61.98 61.97 2rce s VAL 61 Cb -0.16 -2.81 0.01 0.00 0.00 0.00 0.00 36.38 33.42 2rce s VAL 61 CO 0.12 0.45 -0.14 -0.31 0.00 0.00 0.00 175.10 175.22 2rce s TYR 62 N 0.76 2.84 -0.42 5.22 1.51 0.69 -0.91 117.35 127.05 2rce s TYR 62 Ca 0.00 -1.33 -0.19 0.00 -1.01 0.00 0.00 57.07 54.54 2rce s TYR 62 Cb -0.14 -1.98 0.02 0.00 -0.11 0.00 0.00 41.96 39.74 2rce s TYR 62 CO 0.02 -0.68 0.53 1.21 -1.11 0.00 0.00 175.55 175.52 2rce s ASN 63 N 1.31 6.26 -0.07 2.29 3.84 0.30 -0.98 114.94 127.89 2rce s ASN 63 Ca 0.04 -0.44 0.01 0.00 0.21 0.00 0.00 52.86 52.68 2rce s ASN 63 Cb -0.14 -2.27 -0.03 0.00 -0.55 0.00 0.00 41.25 38.27 2rce s ASN 63 CO -0.08 -0.65 -0.08 -0.13 -2.79 0.00 0.00 177.10 173.38 2rce s ARG 64 N 2.46 2.79 0.14 0.43 0.52 0.30 0.42 118.95 126.01 2rce s ARG 64 Ca 0.17 -0.56 0.08 0.00 -0.52 0.00 0.00 55.73 54.90 2rce s ARG 64 Cb -0.16 -2.59 -0.04 0.00 0.52 0.00 0.00 34.95 32.69 2rce s ARG 64 CO 0.16 0.63 -0.19 0.20 0.02 0.00 0.00 175.30 176.11 2rce s GLY 65 N -0.71 1.33 -0.00 -3.53 0.00 -0.45 -0.20 107.32 103.76 2rce s GLY 65 Ca 0.11 -1.40 -0.30 0.00 0.00 0.00 0.00 44.72 43.12 2rce s GLY 65 CO 0.02 -1.44 1.32 1.08 0.00 0.00 0.00 173.10 174.08 2rce s LEU 66 N -2.41 4.31 -0.48 0.66 1.43 -1.26 -1.66 118.68 119.27 2rce s LEU 66 Ca 0.12 2.03 -0.14 0.00 -1.03 0.00 0.00 54.13 55.11 2rce s LEU 66 Cb -0.07 -3.56 0.09 0.00 0.03 0.00 0.00 46.19 42.68 2rce s LEU 66 CO 0.06 -0.65 0.39 0.21 0.23 0.00 0.00 176.35 176.59 2rce s ASN 67 N 1.63 6.01 0.54 2.29 2.47 -0.54 -4.95 114.94 122.38 2rce s ASN 67 Ca 0.61 -1.56 0.29 0.00 0.42 0.00 0.00 52.86 52.63 2rce s ASN 67 Cb -0.30 -2.13 1.54 0.00 -1.45 0.00 0.00 41.25 38.91 2rce s ASN 67 CO 0.26 -0.69 2.10 0.71 -3.72 0.00 0.00 177.10 175.76 2rce h THR 68 N 5.90 0.49 0.00 -5.21 1.35 -1.89 -2.75 112.91 110.80 2rce h THR 68 Ca -0.27 -0.46 0.00 0.00 -0.55 0.00 0.00 66.41 65.13 2rce h THR 68 Cb 1.10 1.31 0.00 0.00 -1.73 0.00 0.00 68.15 68.83 2rce h THR 68 CO 0.90 0.09 0.00 0.59 -0.25 0.00 0.00 175.52 176.85 2rce n ASN 69 N -3.58 0.65 0.00 5.36 4.13 -1.26 -4.61 115.26 115.95 2rce n ASN 69 Ca -0.02 0.72 0.00 0.00 1.68 0.00 0.00 54.58 56.96 2rce n ASN 69 Cb 0.22 -0.84 0.00 0.00 -1.54 0.00 0.00 39.78 37.62 2rce n ASN 69 CO 0.00 0.00 0.00 -0.24 0.28 0.00 0.00 177.26 177.30 2rce n SER 70 N -2.28 0.23 -1.78 6.41 2.88 -1.05 -4.99 113.62 113.04 2rce n SER 70 Ca 0.00 0.00 -0.03 0.00 -1.33 0.00 0.00 58.87 57.51 2rce n SER 70 Cb 0.14 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.56 2rce n SER 70 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2rce n HIS 71 N 0.00 0.00 -1.15 0.66 1.44 -1.26 -4.71 115.22 110.20 2rce n HIS 71 Ca 0.00 -0.87 -0.09 0.00 -2.01 0.00 0.00 57.72 54.75 2rce n HIS 71 Cb 0.00 -0.71 -0.04 0.00 0.12 0.00 0.00 29.99 29.36 2rce n HIS 71 CO 0.00 0.00 0.00 0.09 -2.81 0.00 0.00 176.34 173.62 2rce n ASN 72 N 1.94 -2.79 -4.80 4.39 4.13 -1.14 -4.92 115.26 112.07 2rce n ASN 72 Ca 0.10 0.21 -0.30 0.00 1.68 0.00 0.00 54.58 56.27 2rce n ASN 72 Cb 0.48 -2.55 0.09 0.00 -1.54 0.00 0.00 39.78 36.25 2rce n ASN 72 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2rce s GLN 73 N -2.53 2.20 0.10 3.52 0.00 -1.25 -4.24 119.66 117.46 2rce s GLN 73 Ca 0.00 0.75 -0.30 0.00 -0.00 0.00 0.00 55.36 55.81 2rce s GLN 73 Cb 0.00 -1.92 -0.06 0.00 0.00 0.00 0.00 33.01 31.03 2rce s GLN 73 CO 0.00 -1.56 0.96 -0.51 0.00 0.00 0.00 175.29 174.17 2rce s LEU 74 N -5.77 4.49 0.02 2.60 1.43 -1.26 -1.47 118.68 118.71 2rce s LEU 74 Ca 0.60 1.77 0.03 0.00 -1.03 0.00 0.00 54.13 55.50 2rce s LEU 74 Cb -0.15 -3.57 -0.02 0.00 0.03 0.00 0.00 46.19 42.48 2rce s LEU 74 CO 0.55 -0.08 -0.09 -1.61 0.23 0.00 0.00 176.35 175.34 2rce s GLU 75 N 0.08 0.66 0.07 1.70 2.02 -0.67 -4.94 118.70 117.63 2rce s GLU 75 Ca 0.47 -0.57 -0.30 0.00 0.02 0.00 0.00 54.97 54.58 2rce s GLU 75 Cb -0.23 -0.58 -0.10 0.00 0.10 0.00 0.00 34.13 33.33 2rce s GLU 75 CO 0.29 0.14 1.93 0.42 0.02 0.00 0.00 175.26 178.07 2rce s ILE 76 N -0.78 2.82 -0.23 -1.63 1.01 -1.26 -1.34 121.20 119.79 2rce s ILE 76 Ca -0.02 0.01 0.03 0.00 0.00 0.00 0.00 60.65 60.67 2rce s ILE 76 Cb -0.07 -3.01 -0.16 0.00 0.01 0.00 0.00 42.46 39.24 2rce s ILE 76 CO 0.00 -0.00 -0.19 -1.14 0.00 0.00 0.00 174.94 173.62 2rce n ARG 77 N 6.90 0.62 -3.68 2.79 0.63 0.17 -4.90 116.66 119.18 2rce n ARG 77 Ca 0.19 0.12 -0.15 0.00 -0.92 0.00 0.00 57.85 57.10 2rce n ARG 77 Cb 0.40 -1.47 -0.08 0.00 0.45 0.00 0.00 32.46 31.77 2rce n ARG 77 CO 0.00 0.00 0.00 0.99 -2.51 0.00 0.00 177.63 176.11 2rce s THR 78 N -2.46 0.04 0.04 5.15 2.01 -1.03 -5.03 115.64 114.35 2rce s THR 78 Ca -0.30 -0.31 0.03 0.00 0.31 0.00 0.00 61.69 61.43 2rce s THR 78 Cb 0.08 -0.75 -0.02 0.00 0.01 0.00 0.00 72.50 71.82 2rce s THR 78 CO 0.55 -0.17 -0.10 -1.48 -0.69 0.00 0.00 174.62 172.74 2rce s LEU 79 N -1.28 2.19 0.00 4.42 0.05 -1.26 -0.54 118.68 122.27 2rce s LEU 79 Ca -0.13 -0.45 0.00 0.00 0.05 0.00 0.00 54.13 53.60 2rce s LEU 79 Cb -0.03 -0.34 0.00 0.00 -2.05 0.00 0.00 46.19 43.76 2rce s LEU 79 CO 0.06 -0.08 0.00 0.61 -0.55 0.00 0.00 176.35 176.40 2rce n GLY 80 N 1.82 4.12 3.45 -3.48 0.00 -0.09 -4.21 105.19 106.81 2rce n GLY 80 Ca -0.20 -0.83 -0.22 0.00 0.00 0.00 0.00 46.02 44.77 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 1.59 2.31 0.20 1.61 0.01 -1.20 -1.27 113.70 116.96 2rce s SER 81 Ca 0.00 -1.49 -0.19 0.00 1.31 0.00 0.00 55.95 55.59 2rce s SER 81 Cb 0.00 0.17 0.03 0.00 0.21 0.00 0.00 66.02 66.43 2rce s SER 81 CO 0.00 -0.75 0.56 -0.83 0.41 0.00 0.00 173.24 172.63 2rce s GLY 82 N -3.50 -0.14 -0.10 3.44 0.00 -0.34 -4.00 107.32 102.69 2rce s GLY 82 Ca 0.32 -0.16 0.01 0.00 0.00 0.00 0.00 44.72 44.89 2rce s GLY 82 CO 0.15 -0.19 -0.10 0.14 0.00 0.00 0.00 173.10 173.09 2rce s VAL 83 N -3.87 1.11 -0.19 1.40 1.01 0.46 -0.44 120.40 119.89 2rce s VAL 83 Ca 0.09 -0.39 -0.29 0.00 0.00 0.00 0.00 61.98 61.38 2rce s VAL 83 Cb -0.02 -1.08 -0.01 0.00 0.00 0.00 0.00 36.38 35.27 2rce s VAL 83 CO -0.02 0.37 1.30 -0.63 0.00 0.00 0.00 175.10 176.11 2rce s ILE 84 N 1.27 4.21 -0.14 2.22 1.01 0.24 -1.15 121.20 128.85 2rce s ILE 84 Ca -0.03 1.43 0.09 0.00 0.00 0.00 0.00 60.65 62.14 2rce s ILE 84 Cb -0.14 -4.00 -0.23 0.00 0.01 0.00 0.00 42.46 38.09 2rce s ILE 84 CO -0.04 -0.21 0.28 0.23 0.00 0.00 0.00 174.94 175.20 2rce n MET 85 N 6.82 0.68 -3.92 2.79 2.81 0.01 -1.43 117.12 124.88 2rce n MET 85 Ca 0.14 0.17 -0.09 0.00 -1.81 0.00 0.00 57.70 56.11 2rce n MET 85 Cb 0.45 -1.65 -0.05 0.00 -0.71 0.00 0.00 33.22 31.26 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 -6.15 -0.10 0.61 7.83 1.47 -1.24 -4.62 116.67 114.47 2rce s ASP 86 Ca -0.14 -0.79 0.32 0.00 1.18 0.00 0.00 52.55 53.12 2rce s ASP 86 Cb 0.07 0.54 1.86 0.00 -0.34 0.00 0.00 42.92 45.05 2rce s ASP 86 CO 0.78 -1.05 2.20 1.56 0.68 0.00 0.00 175.17 179.34 2rce h GLN 87 N 2.32 0.00 0.00 2.11 1.08 -1.93 -2.23 115.11 116.46 2rce h GLN 87 Ca -0.28 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.92 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 0.40 0.00 0.00 0.00 -0.95 0.00 0.00 178.83 178.28 2rce h ARG 88 N 0.00 0.00 0.00 1.46 3.08 -1.97 -3.43 114.38 113.53 2rce h ARG 88 Ca 0.03 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.08 2rce h ARG 88 Cb 0.22 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.27 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 -0.17 1.31 3.73 0.04 0.00 -0.84 -4.73 105.19 104.54 2rce n GLY 89 Ca 0.01 -0.18 -0.40 0.00 0.00 0.00 0.00 46.02 45.45 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 3.65 -0.07 1.61 1.51 -1.25 -0.79 117.35 120.02 2rce s TYR 90 Ca 0.00 1.37 0.02 0.00 -1.01 0.00 0.00 57.07 57.44 2rce s TYR 90 Cb 0.00 -2.82 0.02 0.00 -0.11 0.00 0.00 41.96 39.04 2rce s TYR 90 CO 0.00 0.17 -0.11 0.42 -1.11 0.00 0.00 175.55 174.92 2rce s ILE 91 N 0.42 1.05 -0.05 2.71 1.01 -0.01 -0.81 121.20 125.52 2rce s ILE 91 Ca 0.39 -0.42 -0.17 0.00 0.00 0.00 0.00 60.65 60.44 2rce s ILE 91 Cb -0.19 -0.98 -0.05 0.00 0.01 0.00 0.00 42.46 41.25 2rce s ILE 91 CO 0.21 0.34 0.48 -0.63 0.00 0.00 0.00 174.94 175.33 2rce s ILE 92 N 0.78 5.05 0.19 2.92 1.01 -0.30 0.15 121.20 131.00 2rce s ILE 92 Ca -0.13 0.98 0.04 0.00 0.00 0.00 0.00 60.65 61.54 2rce s ILE 92 Cb -0.15 -3.80 -0.02 0.00 0.01 0.00 0.00 42.46 38.50 2rce s ILE 92 CO 0.02 0.44 0.16 1.07 0.00 0.00 0.00 174.94 176.64 2rce n THR 93 N 2.76 0.00 -3.22 2.92 5.66 -0.29 -0.40 114.28 121.71 2rce n THR 93 Ca -0.10 -1.37 -0.38 0.00 -3.05 0.00 0.00 64.05 59.15 2rce n THR 93 Cb 0.52 0.69 -0.06 0.00 -1.55 0.00 0.00 70.33 69.93 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 -2.32 7.09 0.27 1.09 0.02 -1.26 -1.20 114.94 118.63 2rce s ASN 94 Ca 0.23 1.32 0.01 0.00 -1.02 0.00 0.00 52.86 53.39 2rce s ASN 94 Cb 0.01 -2.38 0.56 0.00 0.02 0.00 0.00 41.25 39.46 2rce s ASN 94 CO 0.16 0.22 1.80 0.50 0.02 0.00 0.00 177.10 179.79 2rce h LYS 95 N 4.25 0.78 0.00 -0.60 3.64 -0.87 -1.98 116.57 121.80 2rce h LYS 95 Ca -0.49 -0.05 -0.00 0.00 -1.27 0.00 0.00 60.65 58.84 2rce h LYS 95 Cb 1.21 -0.18 -0.00 0.00 -0.41 0.00 0.00 32.23 32.85 2rce h LYS 95 CO 0.64 0.52 -0.01 1.12 -2.27 0.00 0.00 179.45 179.45 2rce h HIS 96 N 0.81 0.00 -0.28 1.91 2.07 -1.94 -0.99 115.15 116.73 2rce h HIS 96 Ca 0.49 0.00 -0.13 0.00 -2.85 0.00 0.00 60.37 57.88 2rce h HIS 96 Cb 0.60 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.58 2rce h HIS 96 CO -0.04 0.01 -0.34 0.28 -3.07 0.00 0.00 177.93 174.77 2rce h VAL 97 N 0.00 1.30 -0.00 6.12 2.07 -1.73 -3.36 116.25 120.65 2rce h VAL 97 Ca -0.00 -1.52 0.00 0.00 0.82 0.00 0.00 66.70 66.00 2rce h VAL 97 Cb 0.45 1.63 0.00 0.00 -1.52 0.00 0.00 31.29 31.85 2rce h VAL 97 CO 0.00 0.49 -0.86 2.30 0.02 0.00 0.00 177.57 179.52 2rce n ILE 98 N -4.22 0.00 -1.60 4.57 -6.64 -0.90 -4.64 119.36 105.93 2rce n ILE 98 Ca -0.04 -0.05 -0.49 0.00 -1.77 0.00 0.00 62.75 60.39 2rce n ILE 98 Cb 0.50 1.01 -0.04 0.00 -1.44 0.00 0.00 39.64 39.67 2rce n ILE 98 CO 0.00 0.00 0.00 0.59 -1.77 0.00 0.00 176.55 175.37 2rce n ASN 99 N -1.19 1.76 -1.61 7.28 3.02 -0.42 -2.50 115.26 121.60 2rce n ASN 99 Ca 0.05 1.13 -0.19 0.00 -0.03 0.00 0.00 54.58 55.55 2rce n ASN 99 Cb 0.36 -1.25 -0.06 0.00 -0.61 0.00 0.00 39.78 38.21 2rce n ASN 99 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 2rce n ASP 100 N 2.29 -5.29 -4.74 6.41 10.43 -1.26 -4.98 116.55 119.42 2rce n ASP 100 Ca 0.16 0.34 -0.41 0.00 2.57 0.00 0.00 54.79 57.45 2rce n ASP 100 Cb 0.24 -4.41 -0.04 0.00 1.84 0.00 0.00 41.12 38.75 2rce n ASP 100 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2rce s ALA 101 N -2.75 3.36 -0.04 2.24 0.00 -1.04 -4.83 121.76 118.70 2rce s ALA 101 Ca 0.00 0.80 0.03 0.00 0.00 0.00 0.00 51.96 52.79 2rce s ALA 101 Cb 0.00 -3.34 -0.25 0.00 0.00 0.00 0.00 23.12 19.53 2rce s ALA 101 CO 0.00 -0.18 0.67 -0.44 0.00 0.00 0.00 175.76 175.80 2rce h ASP 102 N 5.05 0.21 -3.53 0.00 3.32 -0.94 -3.47 116.42 117.06 2rce h ASP 102 Ca -0.44 -0.40 -0.28 0.00 0.02 0.00 0.00 57.03 55.92 2rce h ASP 102 Cb 1.21 -0.07 -0.33 0.00 0.22 0.00 0.00 39.33 40.36 2rce h ASP 102 CO 0.72 1.35 -0.71 -1.58 -1.72 0.00 0.00 179.24 177.30 2rce s GLN 103 N -2.60 -0.02 -0.24 3.56 0.74 -0.39 -5.02 119.66 115.70 2rce s GLN 103 Ca -0.10 0.20 -0.07 0.00 0.05 0.00 0.00 55.36 55.44 2rce s GLN 103 Cb 0.07 -0.21 -0.03 0.00 1.10 0.00 0.00 33.01 33.94 2rce s GLN 103 CO 0.82 -0.15 0.05 0.42 -0.55 0.00 0.00 175.29 175.88 2rce s ILE 104 N 0.98 4.23 -0.11 -2.34 1.01 -1.26 -0.54 121.20 123.17 2rce s ILE 104 Ca -0.08 -0.20 -0.03 0.00 0.00 0.00 0.00 60.65 60.34 2rce s ILE 104 Cb -0.11 -2.96 -0.03 0.00 0.01 0.00 0.00 42.46 39.36 2rce s ILE 104 CO -0.03 0.37 -0.01 -0.63 0.00 0.00 0.00 174.94 174.63 2rce s ILE 105 N 1.42 4.17 -0.17 2.92 -1.09 -0.15 -0.35 121.20 127.95 2rce s ILE 105 Ca 0.05 -0.28 0.01 0.00 -2.23 0.00 0.00 60.65 58.20 2rce s ILE 105 Cb -0.15 -2.78 0.01 0.00 -1.58 0.00 0.00 42.46 37.97 2rce s ILE 105 CO 0.03 0.56 -0.19 -0.69 -1.23 0.00 0.00 174.94 173.42 2rce s VAL 106 N -0.41 2.21 -0.17 2.92 1.01 0.20 -0.22 120.40 125.94 2rce s VAL 106 Ca 0.07 -0.90 -0.03 0.00 0.00 0.00 0.00 61.98 61.12 2rce s VAL 106 Cb -0.12 -1.92 -0.02 0.00 0.00 0.00 0.00 36.38 34.32 2rce s VAL 106 CO 0.02 0.53 -0.06 0.00 0.00 0.00 0.00 175.10 175.59 2rce s ALA 107 N 1.14 2.84 0.39 5.51 0.00 -0.01 -0.84 121.76 130.79 2rce s ALA 107 Ca 0.01 -0.97 -0.04 0.00 0.00 0.00 0.00 51.96 50.97 2rce s ALA 107 Cb -0.14 -1.53 -0.04 0.00 0.00 0.00 0.00 23.12 21.41 2rce s ALA 107 CO -0.08 -0.02 0.65 -0.51 0.00 0.00 0.00 175.76 175.80 2rce s LEU 108 N 0.78 3.87 0.54 0.00 1.02 0.10 -1.18 118.68 123.81 2rce s LEU 108 Ca -0.02 0.74 0.32 0.00 0.02 0.00 0.00 54.13 55.18 2rce s LEU 108 Cb -0.15 -3.63 1.40 0.00 0.02 0.00 0.00 46.19 43.84 2rce s LEU 108 CO 0.02 -0.38 2.01 1.56 0.02 0.00 0.00 176.35 179.57 2rce h GLN 109 N 0.81 0.00 0.00 1.70 1.08 -1.80 -2.21 115.11 114.69 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 1.20 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.63 2rce h GLN 109 CO 0.63 0.07 0.00 -0.40 -0.95 0.00 0.00 178.83 178.17 2rce n ASP 110 N -3.24 0.00 0.00 1.46 5.68 -1.26 -4.91 116.55 114.28 2rce n ASP 110 Ca -0.00 -0.69 0.00 0.00 -0.50 0.00 0.00 54.79 53.59 2rce n ASP 110 Cb 0.30 -0.10 0.00 0.00 -1.14 0.00 0.00 41.12 40.18 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 1.08 0.36 3.75 6.12 0.00 -0.83 -5.08 105.19 110.59 2rce n GLY 111 Ca 0.20 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.82 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 -0.80 4.66 -0.07 1.61 0.52 -1.26 -4.85 118.95 118.76 2rce s ARG 112 Ca 0.00 1.69 0.03 0.00 -0.52 0.00 0.00 55.73 56.93 2rce s ARG 112 Cb 0.00 -3.26 0.01 0.00 0.52 0.00 0.00 34.95 32.22 2rce s ARG 112 CO 0.00 0.20 -0.17 0.08 0.02 0.00 0.00 175.30 175.43 2rce s VAL 113 N -0.67 1.48 0.09 3.52 1.01 -1.26 -0.72 120.40 123.85 2rce s VAL 113 Ca 0.46 -0.69 0.06 0.00 0.00 0.00 0.00 61.98 61.81 2rce s VAL 113 Cb -0.29 -1.31 -0.03 0.00 0.00 0.00 0.00 36.38 34.74 2rce s VAL 113 CO 0.36 0.43 -0.16 -0.36 0.00 0.00 0.00 175.10 175.38 2rce s PHE 114 N 0.45 1.37 -0.06 5.22 0.40 -0.02 -5.00 117.98 120.35 2rce s PHE 114 Ca -0.14 -0.47 -0.25 0.00 -0.60 0.00 0.00 56.93 55.47 2rce s PHE 114 Cb -0.16 -0.75 -0.03 0.00 0.51 0.00 0.00 43.02 42.58 2rce s PHE 114 CO 0.05 0.11 0.78 -2.00 0.70 0.00 0.00 175.22 174.85 2rce s GLU 115 N -1.96 4.46 0.00 0.44 2.12 -1.26 -0.63 118.70 121.87 2rce s GLU 115 Ca 0.02 1.02 -0.01 0.00 0.36 0.00 0.00 54.97 56.35 2rce s GLU 115 Cb -0.09 -3.46 -0.04 0.00 0.26 0.00 0.00 34.13 30.80 2rce s GLU 115 CO 0.03 0.01 0.14 0.00 -0.54 0.00 0.00 175.26 174.91 2rce s ALA 116 N 0.93 3.81 -0.12 6.30 0.00 0.52 -4.62 121.76 128.58 2rce s ALA 116 Ca 0.41 -0.82 -0.06 0.00 0.00 0.00 0.00 51.96 51.49 2rce s ALA 116 Cb -0.18 -1.75 -0.04 0.00 0.00 0.00 0.00 23.12 21.14 2rce s ALA 116 CO 0.20 0.73 0.10 -0.51 0.00 0.00 0.00 175.76 176.29 2rce s LEU 117 N -1.93 4.14 -0.38 0.00 1.43 0.03 -4.37 118.68 117.60 2rce s LEU 117 Ca 0.26 0.34 -0.29 0.00 -1.03 0.00 0.00 54.13 53.42 2rce s LEU 117 Cb -0.12 -2.01 0.01 0.00 0.03 0.00 0.00 46.19 44.10 2rce s LEU 117 CO 0.18 0.36 1.28 -0.22 0.23 0.00 0.00 176.35 178.18 2rce s LEU 118 N -0.76 3.74 0.00 1.79 1.98 -1.26 -0.49 118.68 123.68 2rce s LEU 118 Ca 0.13 0.91 -0.18 0.00 -2.89 0.00 0.00 54.13 52.10 2rce s LEU 118 Cb -0.12 -3.54 -0.33 0.00 0.66 0.00 0.00 46.19 42.86 2rce s LEU 118 CO 0.03 -1.21 0.98 0.58 -1.89 0.00 0.00 176.35 174.84 2rce h VAL 119 N 6.15 1.37 0.00 1.68 2.07 -1.32 -3.48 116.25 122.71 2rce h VAL 119 Ca -0.25 -2.59 0.00 0.00 0.82 0.00 0.00 66.70 64.67 2rce h VAL 119 Cb 1.09 3.05 0.00 0.00 -1.52 0.00 0.00 31.29 33.91 2rce h VAL 119 CO 1.07 0.76 0.00 0.61 0.02 0.00 0.00 177.57 180.03 2rce n GLY 120 N 1.64 1.09 3.09 2.17 0.00 -1.17 -4.66 105.19 107.35 2rce n GLY 120 Ca -0.15 -0.86 -0.09 0.00 0.00 0.00 0.00 46.02 44.92 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 0.27 -0.18 1.61 1.04 -1.26 -0.35 113.70 114.82 2rce s SER 121 Ca 0.00 -0.66 -0.01 0.00 0.48 0.00 0.00 55.95 55.77 2rce s SER 121 Cb 0.00 0.21 0.05 0.00 0.10 0.00 0.00 66.02 66.38 2rce s SER 121 CO 0.00 -0.51 -0.03 -0.62 0.98 0.00 0.00 173.24 173.06 2rce s ASP 122 N -2.27 3.02 0.29 7.02 2.15 0.12 -4.71 116.67 122.30 2rce s ASP 122 Ca -0.03 -0.79 0.11 0.00 0.43 0.00 0.00 52.55 52.27 2rce s ASP 122 Cb 0.00 -0.89 0.44 0.00 -0.30 0.00 0.00 42.92 42.17 2rce s ASP 122 CO -0.06 -0.22 1.66 0.77 -0.17 0.00 0.00 175.17 177.15 2rce h SER 123 N 8.12 0.02 -0.63 -0.34 4.64 -1.95 0.13 113.55 123.53 2rce h SER 123 Ca -0.21 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.10 2rce h SER 123 Cb 1.11 -0.01 -0.03 0.00 -0.31 0.00 0.00 62.40 63.16 2rce h SER 123 CO 0.39 0.57 0.41 0.25 -0.87 0.00 0.00 176.83 177.57 2rce h LEU 124 N 0.01 0.74 -0.37 5.97 6.46 -1.96 -3.12 115.31 123.04 2rce h LEU 124 Ca -0.00 -0.03 0.00 0.00 -0.12 0.00 0.00 57.88 57.73 2rce h LEU 124 Cb 0.98 -0.18 0.00 0.00 -0.73 0.00 0.00 40.66 40.73 2rce h LEU 124 CO 0.07 0.54 -0.35 0.35 -0.62 0.00 0.00 178.44 178.43 2rce n THR 125 N -4.43 0.00 -2.19 1.05 -2.24 -1.17 -5.00 114.28 100.31 2rce n THR 125 Ca 0.06 -0.32 -0.20 0.00 -2.27 0.00 0.00 64.05 61.32 2rce n THR 125 Cb 0.05 1.06 -0.03 0.00 -2.10 0.00 0.00 70.33 69.31 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 -0.76 -5.55 -4.87 3.42 2.03 0.41 -4.98 116.55 106.25 2rce n ASP 126 Ca 0.03 0.10 -0.33 0.00 0.52 0.00 0.00 54.79 55.10 2rce n ASP 126 Cb 0.19 -4.63 -0.05 0.00 -0.72 0.00 0.00 41.12 35.90 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 -5.35 4.24 0.04 -2.67 1.43 -0.92 -0.37 118.68 115.07 2rce s LEU 127 Ca 0.00 0.30 0.03 0.00 -1.03 0.00 0.00 54.13 53.43 2rce s LEU 127 Cb 0.00 -2.49 -0.02 0.00 0.03 0.00 0.00 46.19 43.71 2rce s LEU 127 CO 0.00 0.27 -0.09 0.00 0.23 0.00 0.00 176.35 176.76 2rce s ALA 128 N -1.27 0.72 -0.11 4.21 0.00 -0.34 0.11 121.76 125.09 2rce s ALA 128 Ca 0.25 -0.72 0.00 0.00 0.00 0.00 0.00 51.96 51.49 2rce s ALA 128 Cb -0.12 -0.03 -0.02 0.00 0.00 0.00 0.00 23.12 22.94 2rce s ALA 128 CO 0.16 0.06 -0.10 0.08 0.00 0.00 0.00 175.76 175.96 2rce s VAL 129 N -1.08 3.34 0.29 0.00 1.01 0.53 -1.13 120.40 123.35 2rce s VAL 129 Ca -0.05 -0.58 0.10 0.00 0.00 0.00 0.00 61.98 61.44 2rce s VAL 129 Cb -0.08 -2.39 -0.05 0.00 0.00 0.00 0.00 36.38 33.86 2rce s VAL 129 CO 0.01 0.55 -0.02 -0.76 0.00 0.00 0.00 175.10 174.87 2rce s LEU 130 N -0.09 3.04 -0.05 3.92 1.43 0.12 -0.87 118.68 126.18 2rce s LEU 130 Ca -0.01 -0.81 0.00 0.00 -1.03 0.00 0.00 54.13 52.29 2rce s LEU 130 Cb -0.14 -1.52 0.02 0.00 0.03 0.00 0.00 46.19 44.59 2rce s LEU 130 CO 0.03 -0.07 -0.02 -0.75 0.23 0.00 0.00 176.35 175.77 2rce s LYS 131 N -3.67 0.68 0.09 1.70 2.47 0.36 -0.83 119.74 120.54 2rce s LYS 131 Ca 0.32 -0.00 0.06 0.00 -1.56 0.00 0.00 55.97 54.79 2rce s LYS 131 Cb -0.04 -0.84 -0.04 0.00 -1.46 0.00 0.00 37.83 35.44 2rce s LYS 131 CO 0.19 -0.17 -0.08 0.96 0.16 0.00 0.00 175.35 176.41 2rce s ILE 132 N 1.32 3.52 -0.40 5.43 -4.36 0.03 -0.79 121.20 125.95 2rce s ILE 132 Ca -0.05 -1.16 -0.06 0.00 -0.26 0.00 0.00 60.65 59.12 2rce s ILE 132 Cb -0.13 -2.64 0.09 0.00 1.25 0.00 0.00 42.46 41.02 2rce s ILE 132 CO -0.02 0.15 0.22 0.21 0.24 0.00 0.00 174.94 175.73 2rce s ASN 133 N -2.13 5.42 0.01 4.36 2.47 -1.26 -4.46 114.94 119.35 2rce s ASN 133 Ca 0.22 -1.67 0.08 0.00 0.42 0.00 0.00 52.86 51.90 2rce s ASN 133 Cb -0.11 -1.90 -0.02 0.00 -1.45 0.00 0.00 41.25 37.76 2rce s ASN 133 CO 0.14 -0.52 -0.23 0.00 -3.72 0.00 0.00 177.10 172.77 2rce s ALA 134 N 1.31 1.93 -0.09 1.71 0.00 -1.26 -5.03 121.76 120.32 2rce s ALA 134 Ca 0.04 -1.06 -0.25 0.00 0.00 0.00 0.00 51.96 50.70 2rce s ALA 134 Cb -0.23 -0.45 -0.29 0.00 0.00 0.00 0.00 23.12 22.16 2rce s ALA 134 CO -0.01 0.46 0.81 1.79 0.00 0.00 0.00 175.76 178.81 2rce h THR 135 N 4.45 1.59 -3.75 0.00 1.35 -2.01 -3.47 112.91 111.07 2rce h THR 135 Ca -0.42 -2.45 -0.43 0.00 -0.55 0.00 0.00 66.41 62.56 2rce h THR 135 Cb 1.14 3.24 0.17 0.00 -1.73 0.00 0.00 68.15 70.97 2rce h THR 135 CO 0.46 0.66 0.21 -0.83 -0.25 0.00 0.00 175.52 175.77 2rce s GLY 136 N -4.38 1.60 0.47 5.82 0.00 -1.26 -5.01 107.32 104.57 2rce s GLY 136 Ca -0.16 -0.81 -0.23 0.00 0.00 0.00 0.00 44.72 43.52 2rce s GLY 136 CO 0.76 -0.04 1.24 -0.32 0.00 0.00 0.00 173.10 174.75 2rce s GLY 137 N -3.95 2.84 -0.05 0.20 0.00 -1.26 -5.05 107.32 100.05 2rce s GLY 137 Ca 0.69 1.10 -0.02 0.00 0.00 0.00 0.00 44.72 46.49 2rce s GLY 137 CO 0.56 1.60 0.07 1.08 0.00 0.00 0.00 173.10 176.41 2rce s LEU 138 N -3.02 3.90 0.27 0.66 1.43 -1.26 -5.10 118.68 115.55 2rce s LEU 138 Ca 0.64 0.20 -0.30 0.00 -1.03 0.00 0.00 54.13 53.65 2rce s LEU 138 Cb -0.34 -2.11 -0.09 0.00 0.03 0.00 0.00 46.19 43.68 2rce s LEU 138 CO 0.41 0.33 1.10 -2.16 0.23 0.00 0.00 176.35 176.26 2rce s PRO 139 N -1.37 4.64 0.13 1.29 0.04 -1.26 -4.84 135.00 133.63 2rce s PRO 139 Ca 0.19 1.79 0.09 0.00 0.04 0.00 0.00 61.00 63.11 2rce s PRO 139 Cb -0.12 -3.20 -0.04 0.00 0.04 0.00 0.00 34.50 31.18 2rce s PRO 139 CO 0.09 0.20 -0.22 0.95 0.04 0.00 0.00 177.00 178.06 2rce s THR 140 N -1.05 1.96 0.13 1.26 -4.23 -1.26 -4.57 115.64 107.87 2rce s THR 140 Ca 0.45 -1.74 -0.30 0.00 -1.18 0.00 0.00 61.69 58.92 2rce s THR 140 Cb -0.32 -1.80 -0.07 0.00 1.34 0.00 0.00 72.50 71.65 2rce s THR 140 CO 0.40 -0.08 1.16 -0.51 -0.54 0.00 0.00 174.62 175.04 2rce s ILE 141 N -1.39 3.91 0.18 2.99 1.10 -0.51 -4.73 121.20 122.75 2rce s ILE 141 Ca 0.12 1.50 -0.32 0.00 -0.51 0.00 0.00 60.65 61.45 2rce s ILE 141 Cb -0.09 -3.96 -0.11 0.00 0.15 0.00 0.00 42.46 38.46 2rce s ILE 141 CO 0.06 0.19 1.60 -2.84 -2.11 0.00 0.00 174.94 171.84 2rce s PRO 142 N 0.29 4.19 -0.12 3.50 0.02 -1.26 -4.95 135.00 136.67 2rce s PRO 142 Ca 0.54 2.43 -0.00 0.00 0.02 0.00 0.00 61.00 63.98 2rce s PRO 142 Cb -0.30 -3.13 0.02 0.00 0.02 0.00 0.00 34.50 31.12 2rce s PRO 142 CO 0.33 -0.63 -0.09 0.42 -0.33 0.00 0.00 177.00 176.69 2rce s ILE 143 N 1.05 1.17 -0.50 2.83 1.01 -1.26 -0.88 121.20 124.61 2rce s ILE 143 Ca 0.70 -0.38 -0.07 0.00 0.00 0.00 0.00 60.65 60.90 2rce s ILE 143 Cb -0.45 -1.15 0.13 0.00 0.01 0.00 0.00 42.46 40.99 2rce s ILE 143 CO 0.33 0.39 0.36 0.21 0.00 0.00 0.00 174.94 176.23 2rce s ASN 144 N 1.62 5.63 0.46 3.58 3.84 -1.26 -4.96 114.94 123.85 2rce s ASN 144 Ca 0.04 -2.11 0.31 0.00 0.21 0.00 0.00 52.86 51.31 2rce s ASN 144 Cb -0.13 -1.97 1.60 0.00 -0.55 0.00 0.00 41.25 40.20 2rce s ASN 144 CO -0.09 -0.62 1.95 0.00 -2.79 0.00 0.00 177.10 175.56 2rce h ALA 145 N 8.15 1.00 -0.01 1.71 0.00 -1.98 -1.92 119.26 126.20 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 0.81 0.00 -0.46 0.54 0.00 0.00 0.00 179.25 180.14 2rce n ARG 146 N -2.63 1.18 -2.36 0.00 1.74 -1.26 -4.93 116.66 108.41 2rce n ARG 146 Ca -0.01 -0.96 -0.42 0.00 -0.77 0.00 0.00 57.85 55.68 2rce n ARG 146 Cb 0.11 -1.48 -0.03 0.00 -1.02 0.00 0.00 32.46 30.04 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 -2.48 4.36 -0.29 5.56 6.06 -0.72 -5.01 118.95 126.42 2rce s ARG 147 Ca 0.19 1.82 -0.10 0.00 -2.50 0.00 0.00 55.73 55.14 2rce s ARG 147 Cb 0.18 -3.45 -0.02 0.00 0.06 0.00 0.00 34.95 31.72 2rce s ARG 147 CO 0.57 -0.41 0.15 0.08 -2.50 0.00 0.00 175.30 173.19 2rce s VAL 148 N 1.72 4.79 0.23 7.11 1.01 -1.26 -5.04 120.40 128.97 2rce s VAL 148 Ca 0.60 -0.19 -0.30 0.00 0.00 0.00 0.00 61.98 62.08 2rce s VAL 148 Cb -0.29 -3.36 -0.10 0.00 0.00 0.00 0.00 36.38 32.63 2rce s VAL 148 CO 0.27 0.17 1.43 -2.84 0.00 0.00 0.00 175.10 174.13 2rce s PRO 149 N 1.66 4.28 0.10 2.72 0.02 -1.26 -5.02 135.00 137.50 2rce s PRO 149 Ca 0.06 2.27 0.10 0.00 0.02 0.00 0.00 61.00 63.45 2rce s PRO 149 Cb -0.16 -3.13 -0.04 0.00 0.02 0.00 0.00 34.50 31.19 2rce s PRO 149 CO 0.07 -0.42 -0.27 -1.01 -0.33 0.00 0.00 177.00 175.05 2rce s HIS 150 N 0.14 2.32 0.14 6.54 3.76 -1.26 -5.09 115.29 121.84 2rce s HIS 150 Ca 0.60 -0.39 -0.31 0.00 -0.15 0.00 0.00 55.06 54.81 2rce s HIS 150 Cb -0.41 -1.30 -0.10 0.00 1.11 0.00 0.00 32.58 31.87 2rce s HIS 150 CO 0.41 0.27 1.74 0.42 -0.85 0.00 0.00 174.74 176.73 2rce s ILE 151 N -0.98 2.50 0.00 0.60 1.01 -1.26 -1.64 121.20 121.42 2rce s ILE 151 Ca 0.13 0.17 0.00 0.00 0.00 0.00 0.00 60.65 60.95 2rce s ILE 151 Cb -0.10 -3.11 0.00 0.00 0.01 0.00 0.00 42.46 39.26 2rce s ILE 151 CO 0.05 0.00 0.00 0.61 0.00 0.00 0.00 174.94 175.60 2rce n GLY 152 N 4.07 0.91 3.72 6.18 0.00 0.21 -4.97 105.19 115.31 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 0.99 0.00 0.00 0.00 173.32 174.31 2rce s ASP 153 N -1.78 6.39 0.17 1.61 1.01 -0.65 -4.68 116.67 118.74 2rce s ASP 153 Ca 0.00 2.87 -0.31 0.00 0.71 0.00 0.00 52.55 55.82 2rce s ASP 153 Cb 0.00 -2.60 -0.10 0.00 1.01 0.00 0.00 42.92 41.23 2rce s ASP 153 CO 0.00 -0.96 1.53 -0.69 0.21 0.00 0.00 175.17 175.26 2rce s VAL 154 N 1.06 2.68 0.06 -1.27 1.01 -1.26 -0.74 120.40 121.94 2rce s VAL 154 Ca 0.73 0.50 0.03 0.00 0.00 0.00 0.00 61.98 63.25 2rce s VAL 154 Cb -0.49 -3.32 -0.03 0.00 0.00 0.00 0.00 36.38 32.54 2rce s VAL 154 CO 0.34 0.05 -0.11 0.68 0.00 0.00 0.00 175.10 176.06 2rce s VAL 155 N 0.95 0.81 -0.07 2.92 -7.23 -0.31 -3.43 120.40 114.04 2rce s VAL 155 Ca 0.68 -1.25 0.05 0.00 -1.81 0.00 0.00 61.98 59.65 2rce s VAL 155 Cb -0.43 -0.90 -0.01 0.00 0.56 0.00 0.00 36.38 35.60 2rce s VAL 155 CO 0.33 -0.35 -0.23 -0.76 -0.31 0.00 0.00 175.10 173.78 2rce s LEU 156 N -1.78 2.21 -0.17 1.32 1.43 0.69 -1.04 118.68 121.34 2rce s LEU 156 Ca -0.05 -0.47 -0.11 0.00 -1.03 0.00 0.00 54.13 52.48 2rce s LEU 156 Cb -0.09 -1.42 -0.05 0.00 0.03 0.00 0.00 46.19 44.66 2rce s LEU 156 CO 0.01 0.24 0.19 0.00 0.23 0.00 0.00 176.35 177.02 2rce s ALA 157 N -0.12 3.69 -0.14 4.21 0.00 0.48 -1.08 121.76 128.81 2rce s ALA 157 Ca -0.04 -0.59 0.01 0.00 0.00 0.00 0.00 51.96 51.33 2rce s ALA 157 Cb -0.14 -2.21 0.02 0.00 0.00 0.00 0.00 23.12 20.78 2rce s ALA 157 CO 0.04 0.22 -0.16 0.42 0.00 0.00 0.00 175.76 176.28 2rce s ILE 158 N 0.13 1.63 0.01 0.00 1.01 0.31 -1.53 121.20 122.76 2rce s ILE 158 Ca 0.12 -0.69 -0.05 0.00 0.00 0.00 0.00 60.65 60.03 2rce s ILE 158 Cb -0.12 -1.50 0.02 0.00 0.01 0.00 0.00 42.46 40.87 2rce s ILE 158 CO 0.01 0.47 0.24 0.61 0.00 0.00 0.00 174.94 176.27 2rce n GLY 159 N 4.50 0.78 2.55 6.18 0.00 -1.02 -2.09 105.19 116.09 2rce n GLY 159 Ca -0.18 -0.91 -0.27 0.00 0.00 0.00 0.00 46.02 44.65 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 -0.48 3.61 -4.73 1.61 5.15 -1.18 0.29 115.26 119.52 2rce n ASN 160 Ca 0.00 -3.39 -0.42 0.00 -0.60 0.00 0.00 54.58 50.18 2rce n ASN 160 Cb 0.12 -0.70 -0.03 0.00 -0.53 0.00 0.00 39.78 38.64 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 -2.23 4.41 -1.65 1.20 0.04 -1.26 -3.19 135.00 132.32 2rce s PRO 161 Ca 0.36 1.97 0.00 0.00 0.04 0.00 0.00 61.00 63.37 2rce s PRO 161 Cb 0.10 -3.24 0.00 0.00 0.04 0.00 0.00 34.50 31.40 2rce s PRO 161 CO -0.05 -0.25 0.00 0.66 0.04 0.00 0.00 177.00 177.40 2rce n TYR 162 N 3.08 -0.58 -3.22 0.56 4.02 0.31 -1.91 117.16 119.43 2rce n TYR 162 Ca 0.07 0.00 -0.23 0.00 -0.01 0.00 0.00 57.90 57.73 2rce n TYR 162 Cb 0.44 -3.13 0.02 0.00 -0.02 0.00 0.00 39.34 36.64 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 -1.28 -4.88 0.10 7.72 5.15 -1.19 -4.87 115.26 116.02 2rce n ASN 163 Ca -0.18 -0.35 0.13 0.00 -0.60 0.00 0.00 54.58 53.58 2rce n ASN 163 Cb 0.59 -3.97 0.43 0.00 -0.53 0.00 0.00 39.78 36.30 2rce n ASN 163 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 2rce n LEU 164 N -3.91 0.73 0.00 1.20 4.77 -0.80 -5.03 117.00 113.96 2rce n LEU 164 Ca -0.06 0.59 0.00 0.00 -0.03 0.00 0.00 56.01 56.51 2rce n LEU 164 Cb 0.58 -0.38 0.00 0.00 -2.33 0.00 0.00 43.42 41.28 2rce n LEU 164 CO 0.50 -0.25 0.00 0.61 -1.33 0.00 0.00 177.39 176.92 2rce n GLY 165 N 1.04 2.27 3.62 -0.72 0.00 -1.26 -5.03 105.19 105.11 2rce n GLY 165 Ca 0.05 -1.97 -0.50 0.00 0.00 0.00 0.00 46.02 43.61 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 1.04 1.49 -4.62 1.61 7.27 -1.26 -4.45 117.38 118.46 2rce n GLN 166 Ca 0.00 0.53 -0.23 0.00 0.07 0.00 0.00 57.00 57.37 2rce n GLN 166 Cb 0.00 -2.20 -0.16 0.00 2.41 0.00 0.00 30.24 30.29 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 0.50 1.11 -0.19 1.69 2.01 0.15 -4.97 115.64 115.93 2rce s THR 167 Ca 0.81 -0.55 -0.05 0.00 0.31 0.00 0.00 61.69 62.21 2rce s THR 167 Cb -0.85 -0.96 -0.03 0.00 0.01 0.00 0.00 72.50 70.67 2rce s THR 167 CO 0.45 0.33 0.01 -0.63 -0.69 0.00 0.00 174.62 174.09 2rce s ILE 168 N 0.08 4.11 0.17 1.82 -1.09 -1.26 -2.43 121.20 122.61 2rce s ILE 168 Ca -0.03 -0.26 0.10 0.00 -2.23 0.00 0.00 60.65 58.23 2rce s ILE 168 Cb -0.10 -2.86 -0.04 0.00 -1.58 0.00 0.00 42.46 37.89 2rce s ILE 168 CO 0.01 0.44 -0.21 0.42 -1.23 0.00 0.00 174.94 174.37 2rce s THR 169 N 0.84 2.02 -0.05 2.92 -4.23 -0.58 -4.95 115.64 111.62 2rce s THR 169 Ca 0.01 -1.94 0.06 0.00 -1.18 0.00 0.00 61.69 58.65 2rce s THR 169 Cb -0.14 -1.94 -0.01 0.00 1.34 0.00 0.00 72.50 71.75 2rce s THR 169 CO 0.02 -0.22 -0.24 -1.58 -0.54 0.00 0.00 174.62 172.06 2rce s GLN 170 N -2.69 2.32 0.00 3.99 -0.44 -1.26 -0.39 119.66 121.20 2rce s GLN 170 Ca 0.17 -0.87 0.00 0.00 -2.50 0.00 0.00 55.36 52.16 2rce s GLN 170 Cb -0.07 -2.04 0.00 0.00 -1.64 0.00 0.00 33.01 29.26 2rce s GLN 170 CO 0.08 0.41 0.00 0.41 0.50 0.00 0.00 175.29 176.68 2rce n GLY 171 N 2.84 3.76 3.22 2.59 0.00 -0.20 -4.37 105.19 113.03 2rce n GLY 171 Ca -0.17 -0.64 -0.13 0.00 0.00 0.00 0.00 46.02 45.08 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 -0.83 0.31 -0.19 -0.61 -4.36 -1.26 -1.17 121.20 113.10 2rce s ILE 172 Ca 0.00 -1.97 -0.29 0.00 -0.26 0.00 0.00 60.65 58.13 2rce s ILE 172 Cb 0.00 -2.32 -0.02 0.00 1.25 0.00 0.00 42.46 41.38 2rce s ILE 172 CO 0.00 -0.24 1.33 -0.63 0.24 0.00 0.00 174.94 175.64 2rce s ILE 173 N -3.92 4.14 -0.06 8.37 1.01 0.08 -3.19 121.20 127.63 2rce s ILE 173 Ca 0.31 1.36 0.06 0.00 0.00 0.00 0.00 60.65 62.38 2rce s ILE 173 Cb 0.07 -3.96 -0.24 0.00 0.01 0.00 0.00 42.46 38.34 2rce s ILE 173 CO 0.08 -0.22 0.60 0.28 0.00 0.00 0.00 174.94 175.68 2rce h SER 174 N 8.76 0.14 -4.81 3.58 0.02 -0.52 0.63 113.55 121.34 2rce h SER 174 Ca -0.28 -0.30 0.11 0.00 -0.84 0.00 0.00 61.79 60.48 2rce h SER 174 Cb 1.11 -0.05 -0.13 0.00 0.14 0.00 0.00 62.40 63.47 2rce h SER 174 CO 0.99 1.27 0.47 0.00 -1.14 0.00 0.00 176.83 178.42 2rce s ALA 175 N -2.59 -1.77 0.15 3.77 0.00 -1.16 -4.91 121.76 115.26 2rce s ALA 175 Ca -0.10 0.78 0.06 0.00 0.00 0.00 0.00 51.96 52.70 2rce s ALA 175 Cb 0.08 0.50 -0.04 0.00 0.00 0.00 0.00 23.12 23.65 2rce s ALA 175 CO 0.81 -0.77 -0.13 0.95 0.00 0.00 0.00 175.76 176.62 2rce s THR 176 N -3.21 1.37 -0.93 0.00 -4.23 -1.26 -0.31 115.64 107.06 2rce s THR 176 Ca 0.06 -1.95 -0.04 0.00 -1.18 0.00 0.00 61.69 58.58 2rce s THR 176 Cb -0.01 -1.76 0.00 0.00 1.34 0.00 0.00 72.50 72.07 2rce s THR 176 CO -0.07 -0.57 0.47 0.61 -0.54 0.00 0.00 174.62 174.52 2rce n GLY 177 N 0.07 -0.04 3.87 3.99 0.00 -0.63 -4.95 105.19 107.49 2rce n GLY 177 Ca -0.12 -0.19 -0.36 0.00 0.00 0.00 0.00 46.02 45.35 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 -5.39 3.67 0.00 1.61 1.81 -0.65 -4.71 118.95 115.29 2rce s ARG 178 Ca 0.23 0.09 0.30 0.00 -1.72 0.00 0.00 55.73 54.63 2rce s ARG 178 Cb -0.10 -3.12 1.52 0.00 -0.45 0.00 0.00 34.95 32.80 2rce s ARG 178 CO 0.29 0.67 2.05 0.44 -0.68 0.00 0.00 175.30 178.07 2rce n ILE 179 N 1.42 0.01 0.00 1.52 -5.35 -1.26 0.71 119.36 116.40 2rce n ILE 179 Ca -0.13 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.35 2rce n ILE 179 Cb 0.53 -0.50 0.00 0.00 -1.74 0.00 0.00 39.64 37.93 2rce n ILE 179 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2rce n GLY 180 N 1.27 1.22 0.00 3.28 0.00 -1.26 -3.77 105.19 105.94 2rce n GLY 180 Ca 0.14 -0.69 0.11 0.00 0.00 0.00 0.00 46.02 45.58 2rce n GLY 180 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2rce n LEU 181 N 0.00 0.79 -2.89 0.99 4.77 -1.26 -5.10 117.00 114.31 2rce n LEU 181 Ca 0.00 -0.31 -0.02 0.00 -0.03 0.00 0.00 56.01 55.65 2rce n LEU 181 Cb 0.00 -0.06 -0.02 0.00 -2.33 0.00 0.00 43.42 41.01 2rce n LEU 181 CO 0.00 0.18 -0.38 -3.20 -1.33 0.00 0.00 177.39 172.67 2rce n ASN 182 N -1.60 -5.04 -4.66 -1.43 5.15 -1.25 -5.19 115.26 101.24 2rce n ASN 182 Ca 0.04 1.08 -0.39 0.00 -0.60 0.00 0.00 54.58 54.70 2rce n ASN 182 Cb 0.36 -3.33 -0.07 0.00 -0.53 0.00 0.00 39.78 36.20 2rce n ASN 182 CO 0.00 0.00 0.00 0.20 1.40 0.00 0.00 177.26 178.86 2rce s ASN 188 N -0.60 6.46 0.06 1.20 0.01 -1.26 -5.24 114.94 115.58 2rce s ASN 188 Ca -0.10 0.55 -0.03 0.00 -0.71 0.00 0.00 52.86 52.57 2rce s ASN 188 Cb 0.01 -2.25 -0.05 0.00 0.41 0.00 0.00 41.25 39.37 2rce s ASN 188 CO 0.38 -0.14 0.27 -0.36 -1.51 0.00 0.00 177.10 175.74 2rce s PHE 189 N 1.57 3.52 0.17 2.20 0.40 0.22 -4.31 117.98 121.75 2rce s PHE 189 Ca 0.20 0.42 -0.30 0.00 -0.60 0.00 0.00 56.93 56.66 2rce s PHE 189 Cb -0.15 -1.89 -0.07 0.00 0.51 0.00 0.00 43.02 41.42 2rce s PHE 189 CO 0.09 0.56 0.95 -0.51 0.70 0.00 0.00 175.22 177.00 2rce s LEU 190 N -2.31 4.57 -0.07 -0.37 1.43 -0.27 -1.60 118.68 120.06 2rce s LEU 190 Ca 0.34 1.87 -0.03 0.00 -1.03 0.00 0.00 54.13 55.28 2rce s LEU 190 Cb -0.13 -3.60 -0.04 0.00 0.03 0.00 0.00 46.19 42.46 2rce s LEU 190 CO 0.23 0.04 0.06 -1.58 0.23 0.00 0.00 176.35 175.34 2rce s GLN 191 N -0.57 3.13 0.03 1.70 0.74 0.57 -0.94 119.66 124.32 2rce s GLN 191 Ca 0.44 -0.35 -0.04 0.00 0.05 0.00 0.00 55.36 55.46 2rce s GLN 191 Cb -0.25 -2.92 -0.02 0.00 1.10 0.00 0.00 33.01 30.93 2rce s GLN 191 CO 0.31 0.71 0.06 -0.08 -0.55 0.00 0.00 175.29 175.73 2rce s THR 192 N -1.01 0.13 -1.61 -0.34 -1.32 0.28 0.29 115.64 112.06 2rce s THR 192 Ca 0.17 -1.11 0.18 0.00 -1.21 0.00 0.00 61.69 59.72 2rce s THR 192 Cb -0.12 -0.80 0.52 0.00 -1.51 0.00 0.00 72.50 70.59 2rce s THR 192 CO 0.06 -0.61 1.43 -0.90 -2.21 0.00 0.00 174.62 172.39 2rce n ASP 193 N 0.92 3.58 -4.67 8.08 5.75 -1.19 -1.07 116.55 127.95 2rce n ASP 193 Ca -0.20 -2.00 -0.42 0.00 -0.01 0.00 0.00 54.79 52.16 2rce n ASP 193 Cb 0.58 -0.39 -0.03 0.00 -1.03 0.00 0.00 41.12 40.25 2rce n ASP 193 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2rce s ALA 194 N -1.01 3.62 -0.01 2.12 0.00 -1.26 -4.65 121.76 120.57 2rce s ALA 194 Ca 0.40 1.17 -0.33 0.00 0.00 0.00 0.00 51.96 53.19 2rce s ALA 194 Cb 0.21 -3.78 -0.12 0.00 0.00 0.00 0.00 23.12 19.43 2rce s ALA 194 CO 0.27 -1.41 1.83 0.43 0.00 0.00 0.00 175.76 176.88 2rce n SER 195 N 6.94 3.51 -4.17 0.00 7.64 -1.26 -4.84 113.62 121.43 2rce n SER 195 Ca 0.18 0.99 -0.29 0.00 1.01 0.00 0.00 58.87 60.76 2rce n SER 195 Cb 0.41 -1.41 -0.17 0.00 -1.01 0.00 0.00 64.21 62.03 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 3.37 1.71 0.26 0.44 -1.09 -1.26 -4.76 121.20 119.87 2rce s ILE 196 Ca 0.89 -0.84 0.01 0.00 -2.23 0.00 0.00 60.65 58.48 2rce s ILE 196 Cb -0.64 -1.48 -0.05 0.00 -1.58 0.00 0.00 42.46 38.70 2rce s ILE 196 CO 0.47 0.48 0.11 0.20 -1.23 0.00 0.00 174.94 174.97 2rce s ASN 197 N 0.22 1.18 -0.03 3.58 0.01 -1.26 -4.95 114.94 113.69 2rce s ASN 197 Ca -0.11 -1.41 -0.35 0.00 -0.71 0.00 0.00 52.86 50.28 2rce s ASN 197 Cb -0.15 0.21 -0.13 0.00 0.41 0.00 0.00 41.25 41.59 2rce s ASN 197 CO 0.05 -0.76 1.78 1.57 -1.51 0.00 0.00 177.10 178.22 2rce n HIS 198 N -0.47 2.27 0.00 2.20 -0.00 -1.26 -0.72 115.22 117.23 2rce n HIS 198 Ca 0.00 0.13 0.00 0.00 -0.00 0.00 0.00 57.72 57.85 2rce n HIS 198 Cb 0.66 -2.61 0.00 0.00 -0.00 0.00 0.00 29.99 28.04 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 4.07 2.54 3.58 1.57 0.00 -1.26 -0.53 105.19 115.16 2rce n GLY 199 Ca 0.21 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.86 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 -1.53 6.19 0.00 1.61 -0.87 0.10 -3.12 114.94 117.32 2rce s ASN 200 Ca 0.00 -2.12 0.00 0.00 -1.57 0.00 0.00 52.86 49.17 2rce s ASN 200 Cb 0.00 -2.58 0.00 0.00 -0.02 0.00 0.00 41.25 38.65 2rce s ASN 200 CO 0.00 -1.86 0.00 0.61 -2.57 0.00 0.00 177.10 173.28 2rce n GLY 202 N 5.62 0.00 2.47 0.66 0.00 0.59 -4.55 105.19 109.98 2rce n GLY 202 Ca 0.47 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.31 2rce n GLY 202 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2rce n GLY 203 N 0.16 -0.76 3.81 -0.02 0.00 -1.26 -3.33 105.19 103.79 2rce n GLY 203 Ca 0.00 -1.79 -0.36 0.00 0.00 0.00 0.00 46.02 43.87 2rce n GLY 203 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2rce s ALA 204 N -3.70 3.67 -0.23 4.61 0.00 -0.89 -1.25 121.76 123.98 2rce s ALA 204 Ca 0.46 -0.70 -0.05 0.00 0.00 0.00 0.00 51.96 51.68 2rce s ALA 204 Cb -0.02 -1.81 -0.01 0.00 0.00 0.00 0.00 23.12 21.28 2rce s ALA 204 CO 0.32 0.60 -0.01 -1.17 0.00 0.00 0.00 175.76 175.50 2rce s LEU 205 N -0.95 3.06 0.18 0.00 2.96 -0.04 -0.53 118.68 123.36 2rce s LEU 205 Ca 0.14 -0.33 0.09 0.00 -0.22 0.00 0.00 54.13 53.81 2rce s LEU 205 Cb -0.12 -1.79 -0.04 0.00 0.50 0.00 0.00 46.19 44.73 2rce s LEU 205 CO 0.03 -0.02 -0.18 0.68 -1.32 0.00 0.00 176.35 175.54 2rce s VAL 206 N 1.50 1.91 0.47 1.68 -7.23 -0.24 0.46 120.40 118.96 2rce s VAL 206 Ca 0.06 -2.00 -0.07 0.00 -1.81 0.00 0.00 61.98 58.16 2rce s VAL 206 Cb -0.14 -1.92 0.11 0.00 0.56 0.00 0.00 36.38 34.98 2rce s VAL 206 CO -0.01 -0.33 0.64 -0.46 -0.31 0.00 0.00 175.10 174.63 2rce n ASN 207 N 0.15 0.19 0.00 4.85 0.23 -0.53 -0.22 115.26 119.92 2rce n ASN 207 Ca -0.12 -1.32 0.06 0.00 -0.53 0.00 0.00 54.58 52.67 2rce n ASN 207 Cb 0.58 -0.48 0.27 0.00 -2.08 0.00 0.00 39.78 38.07 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 -3.33 0.00 -0.18 0.53 3.41 -1.22 -1.43 113.62 111.38 2rce n SER 208 Ca 0.08 0.43 0.11 0.00 -0.26 0.00 0.00 58.87 59.24 2rce n SER 208 Cb 0.30 -0.46 0.07 0.00 -0.26 0.00 0.00 64.21 63.86 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 -1.46 1.20 0.00 1.04 4.77 -1.26 -3.93 117.00 117.35 2rce n LEU 209 Ca 0.03 -0.43 0.00 0.00 -0.03 0.00 0.00 56.01 55.58 2rce n LEU 209 Cb 0.14 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.16 2rce n LEU 209 CO 0.11 0.25 0.00 0.61 -1.33 0.00 0.00 177.39 177.03 2rce n GLY 210 N 1.45 0.76 3.74 -0.72 0.00 -0.52 -4.71 105.19 105.19 2rce n GLY 210 Ca 0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 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 -0.44 4.59 0.06 1.61 2.02 -1.26 -4.23 118.70 121.05 2rce s GLU 211 Ca 0.00 1.71 -0.31 0.00 0.02 0.00 0.00 54.97 56.39 2rce s GLU 211 Cb 0.00 -3.29 -0.08 0.00 0.10 0.00 0.00 34.13 30.86 2rce s GLU 211 CO 0.00 0.07 1.61 -1.17 0.02 0.00 0.00 175.26 175.79 2rce s LEU 212 N -0.29 4.36 -0.22 1.80 2.96 -0.06 -1.45 118.68 125.78 2rce s LEU 212 Ca 0.50 2.44 0.03 0.00 -0.22 0.00 0.00 54.13 56.88 2rce s LEU 212 Cb -0.29 -3.56 -0.15 0.00 0.50 0.00 0.00 46.19 42.68 2rce s LEU 212 CO 0.34 -0.86 -0.17 0.23 -1.32 0.00 0.00 176.35 174.58 2rce n MET 213 N 5.47 0.62 -3.91 1.98 2.81 0.17 -4.76 117.12 119.51 2rce n MET 213 Ca 0.15 0.11 -0.01 0.00 -1.81 0.00 0.00 57.70 56.14 2rce n MET 213 Cb 0.41 -1.44 0.02 0.00 -0.71 0.00 0.00 33.22 31.49 2rce n MET 213 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 2rce s GLY 214 N -6.04 0.04 -0.29 3.03 0.00 -0.91 -1.10 107.32 102.06 2rce s GLY 214 Ca -0.27 -0.22 -0.04 0.00 0.00 0.00 0.00 44.72 44.18 2rce s GLY 214 CO 0.53 3.38 0.02 -0.42 0.00 0.00 0.00 173.10 176.62 2rce s ILE 215 N -2.12 3.43 0.23 0.90 -1.09 0.74 -0.86 121.20 122.43 2rce s ILE 215 Ca 0.24 -0.97 -0.31 0.00 -2.23 0.00 0.00 60.65 57.38 2rce s ILE 215 Cb -0.02 -2.82 -0.11 0.00 -1.58 0.00 0.00 42.46 37.93 2rce s ILE 215 CO 0.03 0.05 1.62 0.20 -1.23 0.00 0.00 174.94 175.62 2rce s ASN 216 N 1.39 6.45 0.00 3.58 0.01 -0.38 -0.80 114.94 125.19 2rce s ASN 216 Ca -0.00 2.82 0.00 0.00 -0.71 0.00 0.00 52.86 54.97 2rce s ASN 216 Cb -0.18 -2.61 0.00 0.00 0.41 0.00 0.00 41.25 38.87 2rce s ASN 216 CO -0.00 -0.90 0.00 0.41 -1.51 0.00 0.00 177.10 175.10 2rce n THR 217 N 3.26 0.00 -4.15 1.60 -1.04 -0.48 -0.30 114.28 113.17 2rce n THR 217 Ca 0.12 0.00 -0.15 0.00 -2.04 0.00 0.00 64.05 61.98 2rce n THR 217 Cb 0.37 -0.41 -0.11 0.00 -1.82 0.00 0.00 70.33 68.36 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 -4.36 2.33 -0.08 -4.42 1.43 -1.06 -4.90 118.68 107.62 2rce s LEU 218 Ca 0.00 -0.69 0.01 0.00 -1.03 0.00 0.00 54.13 52.42 2rce s LEU 218 Cb 0.00 -0.33 0.02 0.00 0.03 0.00 0.00 46.19 45.90 2rce s LEU 218 CO 0.00 -0.19 -0.11 -0.55 0.23 0.00 0.00 176.35 175.73 2rce s SER 219 N -2.03 1.87 -0.28 2.29 0.15 -1.26 -0.83 113.70 113.61 2rce s SER 219 Ca -0.01 -0.30 -0.29 0.00 0.70 0.00 0.00 55.95 56.06 2rce s SER 219 Cb -0.07 -0.82 -0.02 0.00 -1.71 0.00 0.00 66.02 63.40 2rce s SER 219 CO 0.01 -0.01 1.61 0.12 1.20 0.00 0.00 173.24 176.17 2rce s PHE 220 N 0.96 2.11 -0.03 3.44 2.19 -0.25 -5.01 117.98 121.39 2rce s PHE 220 Ca -0.09 0.60 0.03 0.00 0.33 0.00 0.00 56.93 57.80 2rce s PHE 220 Cb -0.15 -4.06 0.00 0.00 -1.31 0.00 0.00 43.02 37.51 2rce s PHE 220 CO 0.00 -2.73 -0.10 -0.51 1.83 0.00 0.00 175.22 173.70 2rce s ASP 221 N 4.54 1.39 -0.26 6.13 1.01 -1.26 -4.58 116.67 123.65 2rce s ASP 221 Ca 0.71 -0.22 -0.02 0.00 0.71 0.00 0.00 52.55 53.73 2rce s ASP 221 Cb -0.22 -0.43 0.02 0.00 1.01 0.00 0.00 42.92 43.30 2rce s ASP 221 CO 0.30 0.07 0.06 -0.62 0.21 0.00 0.00 175.17 175.19 2rce n GLU 227 N 3.38 -0.97 -3.40 8.23 1.02 -1.26 -4.66 120.64 122.98 2rce n GLU 227 Ca -0.19 0.02 -0.39 0.00 -0.02 0.00 0.00 57.16 56.58 2rce n GLU 227 Cb 0.54 -0.63 -0.09 0.00 -0.02 0.00 0.00 31.44 31.24 2rce n GLU 227 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 2rce s THR 228 N -1.93 5.19 0.32 2.62 2.01 -1.26 -5.06 115.64 117.52 2rce s THR 228 Ca 0.08 0.58 -0.29 0.00 0.31 0.00 0.00 61.69 62.38 2rce s THR 228 Cb -0.05 -3.70 -0.10 0.00 0.01 0.00 0.00 72.50 68.66 2rce s THR 228 CO 0.15 0.18 1.31 -2.84 -0.69 0.00 0.00 174.62 172.73 2rce s PRO 229 N 1.88 4.35 -0.08 4.92 0.02 -1.26 -5.02 135.00 139.80 2rce s PRO 229 Ca 0.16 2.21 0.03 0.00 0.02 0.00 0.00 61.00 63.42 2rce s PRO 229 Cb -0.15 -3.08 0.01 0.00 0.02 0.00 0.00 34.50 31.29 2rce s PRO 229 CO 0.09 -0.20 -0.18 -2.00 -0.33 0.00 0.00 177.00 174.38 2rce s GLU 230 N -1.65 2.34 -1.09 5.54 2.12 -1.26 -4.80 118.70 119.90 2rce s GLU 230 Ca 0.50 -0.63 -0.00 0.00 0.36 0.00 0.00 54.97 55.19 2rce s GLU 230 Cb -0.40 -1.83 0.00 0.00 0.26 0.00 0.00 34.13 32.17 2rce s GLU 230 CO 0.52 0.10 0.00 0.41 -0.54 0.00 0.00 175.26 175.75 2rce n GLY 231 N 3.67 -0.16 3.05 -1.50 0.00 -1.26 -5.00 105.19 103.99 2rce n GLY 231 Ca -0.21 -0.35 -0.32 0.00 0.00 0.00 0.00 46.02 45.14 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 -2.64 2.28 0.09 -0.61 1.01 -1.26 -3.65 121.20 116.42 2rce s ILE 232 Ca 0.00 -1.99 0.02 0.00 0.00 0.00 0.00 60.65 58.68 2rce s ILE 232 Cb -0.00 -2.52 -0.04 0.00 0.01 0.00 0.00 42.46 39.91 2rce s ILE 232 CO 0.00 -0.33 -0.07 -0.83 0.00 0.00 0.00 174.94 173.71 2rce s GLY 233 N 1.03 0.74 0.01 6.18 0.00 -0.24 -1.09 107.32 113.95 2rce s GLY 233 Ca 0.01 -1.29 0.03 0.00 0.00 0.00 0.00 44.72 43.48 2rce s GLY 233 CO -0.06 -1.39 -0.11 -1.36 0.00 0.00 0.00 173.10 170.19 2rce s PHE 234 N -3.36 0.94 0.01 1.90 0.08 -0.01 -0.55 117.98 116.98 2rce s PHE 234 Ca 0.09 -0.25 0.03 0.00 0.12 0.00 0.00 56.93 56.93 2rce s PHE 234 Cb 0.03 -0.58 -0.01 0.00 -0.57 0.00 0.00 43.02 41.89 2rce s PHE 234 CO -0.04 -0.01 -0.10 0.00 -0.10 0.00 0.00 175.22 174.97 2rce s ALA 235 N -0.51 0.79 0.01 5.36 0.00 -0.11 -1.38 121.76 125.92 2rce s ALA 235 Ca 0.02 -0.55 -0.30 0.00 0.00 0.00 0.00 51.96 51.12 2rce s ALA 235 Cb -0.05 -0.14 -0.06 0.00 0.00 0.00 0.00 23.12 22.87 2rce s ALA 235 CO 0.00 0.15 1.38 0.42 0.00 0.00 0.00 175.76 177.71 2rce s ILE 236 N -0.57 3.73 0.49 0.00 -1.09 0.02 -1.11 121.20 122.66 2rce s ILE 236 Ca 0.00 1.13 -0.23 0.00 -2.23 0.00 0.00 60.65 59.33 2rce s ILE 236 Cb -0.06 -3.73 -0.07 0.00 -1.58 0.00 0.00 42.46 37.02 2rce s ILE 236 CO 0.00 0.01 1.26 -2.65 -1.23 0.00 0.00 174.94 172.33 2rce n PRO 237 N 5.18 1.70 0.29 2.79 -0.02 -1.26 -0.19 135.00 143.49 2rce n PRO 237 Ca 0.13 0.62 0.16 0.00 -2.02 0.00 0.00 63.50 62.38 2rce n PRO 237 Cb 0.44 -2.42 0.89 0.00 -0.02 0.00 0.00 33.50 32.39 2rce n PRO 237 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 2rce h PHE 238 N 1.63 0.00 -0.06 6.00 -5.15 -1.41 -2.13 116.94 115.82 2rce h PHE 238 Ca -0.49 0.00 -0.16 0.00 -0.20 0.00 0.00 57.97 57.12 2rce h PHE 238 Cb 1.31 0.00 0.01 0.00 0.22 0.00 0.00 35.95 37.49 2rce h PHE 238 CO 0.45 0.05 -0.60 1.96 -2.00 0.00 0.00 178.31 178.17 2rce h GLN 239 N 0.00 0.52 -0.60 6.09 7.50 -1.90 -0.64 115.11 126.08 2rce h GLN 239 Ca -0.00 -0.47 -0.10 0.00 0.50 0.00 0.00 58.65 58.58 2rce h GLN 239 Cb 0.15 0.11 -0.02 0.00 0.05 0.00 0.00 27.48 27.77 2rce h GLN 239 CO 0.01 1.11 -0.01 1.25 -1.50 0.00 0.00 178.83 179.68 2rce h LEU 240 N 0.10 1.05 -0.69 1.46 5.85 -1.87 -2.51 115.31 118.70 2rce h LEU 240 Ca -0.06 -0.31 -0.04 0.00 0.84 0.00 0.00 57.88 58.32 2rce h LEU 240 Cb 1.26 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.98 2rce h LEU 240 CO 0.12 1.10 0.28 0.00 -0.34 0.00 0.00 178.44 179.61 2rce h ALA 241 N 0.98 0.89 -0.46 1.25 0.00 -1.31 -1.51 119.26 119.10 2rce h ALA 241 Ca 0.17 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.83 2rce h ALA 241 Cb 0.57 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 2rce h ALA 241 CO 0.03 0.50 -0.01 1.15 0.00 0.00 0.00 179.25 180.93 2rce h THR 242 N 0.97 1.26 -0.46 0.00 2.02 -1.09 -1.75 112.91 113.87 2rce h THR 242 Ca 0.23 -1.06 -0.04 0.00 0.77 0.00 0.00 66.41 66.31 2rce h THR 242 Cb 0.20 1.04 -0.02 0.00 -1.74 0.00 0.00 68.15 67.62 2rce h THR 242 CO -0.02 0.37 0.14 0.11 0.37 0.00 0.00 175.52 176.49 2rce h LYS 243 N 0.66 0.71 -0.35 6.66 1.57 -1.31 -1.82 116.57 122.69 2rce h LYS 243 Ca 0.13 -0.16 -0.03 0.00 -1.87 0.00 0.00 60.65 58.72 2rce h LYS 243 Cb 0.51 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.70 2rce h LYS 243 CO 0.02 0.69 0.09 0.82 -0.57 0.00 0.00 179.45 180.50 2rce h ILE 244 N 0.60 1.22 -0.43 1.86 1.08 -1.28 -2.74 117.51 117.83 2rce h ILE 244 Ca 0.15 -0.73 0.06 0.00 -0.39 0.00 0.00 64.86 63.94 2rce h ILE 244 Cb 0.27 1.04 -0.05 0.00 -3.07 0.00 0.00 36.82 35.01 2rce h ILE 244 CO -0.00 0.25 0.11 -0.03 -0.69 0.00 0.00 178.15 177.79 2rce h MET 245 N 0.41 0.25 -0.21 2.37 4.05 -1.22 -1.28 114.93 119.31 2rce h MET 245 Ca 0.11 -0.02 -0.02 0.00 -0.28 0.00 0.00 59.70 59.50 2rce h MET 245 Cb 0.29 -0.06 -0.01 0.00 -0.80 0.00 0.00 31.60 31.02 2rce h MET 245 CO 0.00 0.17 0.05 -0.44 0.23 0.00 0.00 176.91 176.92 2rce h ASP 246 N 0.26 0.27 0.29 1.39 3.32 -1.29 -1.10 116.42 119.56 2rce h ASP 246 Ca 0.21 -0.02 -0.22 0.00 0.02 0.00 0.00 57.03 57.01 2rce h ASP 246 Cb 0.23 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 39.72 2rce h ASP 246 CO -0.25 0.28 -0.91 0.11 -1.72 0.00 0.00 179.24 176.76 2rce h LYS 247 N 0.30 0.44 -0.05 3.56 1.57 -1.09 -2.27 116.57 119.02 2rce h LYS 247 Ca 0.07 -0.45 -0.21 0.00 -1.87 0.00 0.00 60.65 58.20 2rce h LYS 247 Cb 0.12 0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.55 2rce h LYS 247 CO -0.00 1.10 -0.85 -0.07 -0.57 0.00 0.00 179.45 179.06 2rce h LEU 248 N 0.26 0.61 -0.43 2.94 3.38 -0.95 -0.17 115.31 120.95 2rce h LEU 248 Ca -0.07 -0.44 -0.03 0.00 0.09 0.00 0.00 57.88 57.42 2rce h LEU 248 Cb 1.53 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 42.08 2rce h LEU 248 CO 0.16 1.22 0.13 0.40 0.09 0.00 0.00 178.44 180.44 2rce h ILE 249 N 0.31 1.22 -0.01 1.22 2.04 -1.26 0.29 117.51 121.31 2rce h ILE 249 Ca -0.06 -0.73 -0.01 0.00 1.00 0.00 0.00 64.86 65.06 2rce h ILE 249 Cb 1.46 0.88 0.00 0.00 -0.74 0.00 0.00 36.82 38.43 2rce h ILE 249 CO 0.15 0.26 -0.04 -0.09 0.00 0.00 0.00 178.15 178.43 2rce h ARG 250 N 0.55 0.04 0.00 2.37 2.43 -1.40 -3.38 114.38 115.00 2rce h ARG 250 Ca 0.14 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.27 2rce h ARG 250 Cb 0.26 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.82 2rce h ARG 250 CO -0.00 0.72 -0.80 -0.25 -1.51 0.00 0.00 179.97 178.13 2rce n ASP 251 N -4.72 0.78 0.00 -3.80 8.00 -0.08 -4.96 116.55 111.77 2rce n ASP 251 Ca -0.09 -0.86 0.00 0.00 0.71 0.00 0.00 54.79 54.55 2rce n ASP 251 Cb 0.36 1.02 0.00 0.00 -0.02 0.00 0.00 41.12 42.48 2rce n ASP 251 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2rce n GLY 252 N 1.39 2.71 3.79 0.44 0.00 0.10 -4.93 105.19 108.70 2rce n GLY 252 Ca 0.03 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.97 2rce n GLY 252 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2rce s ARG 253 N 0.00 1.72 -0.49 1.61 1.70 -1.25 -4.35 118.95 117.89 2rce s ARG 253 Ca 0.00 -0.98 -0.17 0.00 -0.47 0.00 0.00 55.73 54.11 2rce s ARG 253 Cb 0.00 0.59 0.07 0.00 -0.57 0.00 0.00 34.95 35.04 2rce s ARG 253 CO 0.00 -0.78 0.52 0.08 -1.08 0.00 0.00 175.30 174.04 2rce s VAL 254 N -3.92 5.05 -0.25 4.99 1.01 -1.26 -4.29 120.40 121.72 2rce s VAL 254 Ca 0.12 -0.78 -0.26 0.00 0.00 0.00 0.00 61.98 61.06 2rce s VAL 254 Cb -0.05 -4.22 0.00 0.00 0.00 0.00 0.00 36.38 32.11 2rce s VAL 254 CO 0.06 -0.70 0.90 -0.63 0.00 0.00 0.00 175.10 174.72 2rce s ILE 255 N 2.16 4.76 -0.19 2.22 1.01 -1.26 -5.14 121.20 124.77 2rce s ILE 255 Ca 0.10 1.67 0.02 0.00 0.00 0.00 0.00 60.65 62.43 2rce s ILE 255 Cb -0.22 -4.20 0.01 0.00 0.01 0.00 0.00 42.46 38.07 2rce s ILE 255 CO 0.09 -0.15 0.55 0.54 0.00 0.00 0.00 174.94 175.97