#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 3.44 0.00 5.98 3.68 -1.26 -5.00 116.67 123.51 2rce s ASP 38 Ca 0.00 -2.33 0.00 0.00 2.13 0.00 0.00 52.55 52.35 2rce s ASP 38 Cb 0.00 -0.77 0.00 0.00 -1.45 0.00 0.00 42.92 40.70 2rce s ASP 38 CO 0.00 -0.30 0.65 -1.54 0.13 0.00 0.00 175.17 174.11 2rce n SER 39 N 3.90 0.41 -0.30 -0.34 3.41 -1.26 -4.25 113.62 115.19 2rce n SER 39 Ca 0.08 -1.71 0.08 0.00 -0.26 0.00 0.00 58.87 57.05 2rce n SER 39 Cb 0.36 -0.20 0.23 0.00 -0.26 0.00 0.00 64.21 64.34 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 0.00 0.71 -0.02 6.66 2.02 -2.06 -2.22 112.91 118.00 2rce h THR 40 Ca 0.00 -0.21 0.00 0.00 0.77 0.00 0.00 66.41 66.97 2rce h THR 40 Cb 0.20 0.05 0.00 0.00 -1.74 0.00 0.00 68.15 66.66 2rce h THR 40 CO 0.00 0.11 -0.16 0.47 0.37 0.00 0.00 175.52 176.31 2rce n ASP 41 N -4.88 2.14 -4.85 4.18 8.00 -1.26 -4.90 116.55 114.97 2rce n ASP 41 Ca 0.17 -1.60 -0.32 0.00 0.71 0.00 0.00 54.79 53.75 2rce n ASP 41 Cb 0.45 0.14 -0.04 0.00 -0.02 0.00 0.00 41.12 41.65 2rce n ASP 41 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2rce s GLU 42 N -2.20 3.95 -0.21 -1.24 2.02 -0.84 -5.07 118.70 115.11 2rce s GLU 42 Ca 0.27 0.81 -0.05 0.00 0.02 0.00 0.00 54.97 56.02 2rce s GLU 42 Cb 0.20 -2.25 -0.02 0.00 0.10 0.00 0.00 34.13 32.15 2rce s GLU 42 CO 0.41 -0.11 0.01 0.99 0.02 0.00 0.00 175.26 176.58 2rce s THR 43 N -2.40 3.96 0.25 3.63 2.01 -1.26 -5.04 115.64 116.78 2rce s THR 43 Ca 0.57 -0.31 -0.31 0.00 0.31 0.00 0.00 61.69 61.95 2rce s THR 43 Cb -0.10 -2.80 -0.11 0.00 0.01 0.00 0.00 72.50 69.50 2rce s THR 43 CO 0.27 0.41 1.61 -2.84 -0.69 0.00 0.00 174.62 173.38 2rce s PRO 44 N 1.15 4.15 0.30 4.92 0.02 -1.26 -4.95 135.00 139.33 2rce s PRO 44 Ca 0.03 2.54 -0.30 0.00 0.02 0.00 0.00 61.00 63.29 2rce s PRO 44 Cb -0.14 -3.06 -0.12 0.00 0.02 0.00 0.00 34.50 31.20 2rce s PRO 44 CO 0.01 -0.64 1.53 0.00 -0.33 0.00 0.00 177.00 177.57 2rce n ALA 45 N 2.84 2.20 -3.58 -1.55 0.00 -1.26 -4.98 120.51 114.18 2rce n ALA 45 Ca 0.11 0.37 -0.15 0.00 0.00 0.00 0.00 53.44 53.76 2rce n ALA 45 Cb 0.37 -2.41 -0.07 0.00 0.00 0.00 0.00 19.45 17.35 2rce n ALA 45 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2rce s SER 46 N 0.30 -0.69 -0.24 0.00 0.15 -1.26 -5.01 113.70 106.94 2rce s SER 46 Ca 0.62 1.08 0.13 0.00 0.70 0.00 0.00 55.95 58.47 2rce s SER 46 Cb -0.52 1.01 0.53 0.00 -1.71 0.00 0.00 66.02 65.32 2rce s SER 46 CO 0.52 -0.40 1.47 -1.22 1.20 0.00 0.00 173.24 174.81 2rce n TYR 47 N 1.84 1.14 0.07 3.44 4.02 -1.26 -4.73 117.16 121.68 2rce n TYR 47 Ca -0.16 -1.25 0.07 0.00 -0.01 0.00 0.00 57.90 56.55 2rce n TYR 47 Cb 0.56 -0.43 0.51 0.00 -0.02 0.00 0.00 39.34 39.96 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 1.41 0.29 -0.19 7.72 -0.73 -1.95 -2.33 115.58 119.80 2rce h ASN 48 Ca 0.14 -0.01 0.01 0.00 1.87 0.00 0.00 56.30 58.31 2rce h ASN 48 Cb 1.63 -0.07 -0.02 0.00 0.27 0.00 0.00 38.32 40.13 2rce h ASN 48 CO 0.35 0.21 0.09 0.25 -0.37 0.00 0.00 177.43 177.96 2rce h LEU 49 N 0.34 0.14 -1.00 0.34 5.85 -1.90 0.73 115.31 119.81 2rce h LEU 49 Ca 0.12 0.01 0.05 0.00 0.84 0.00 0.00 57.88 58.90 2rce h LEU 49 Cb 0.06 -0.02 -0.06 0.00 0.37 0.00 0.00 40.66 41.01 2rce h LEU 49 CO -0.03 0.11 0.65 0.00 -0.34 0.00 0.00 178.44 178.83 2rce h ALA 50 N 1.10 1.35 0.50 1.25 0.00 -1.58 -1.82 119.26 120.05 2rce h ALA 50 Ca 0.08 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 2rce h ALA 50 Cb 0.02 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 17.48 2rce h ALA 50 CO -0.06 0.51 -0.24 0.28 0.00 0.00 0.00 179.25 179.74 2rce h VAL 51 N 1.23 0.50 -0.57 0.00 2.07 -0.93 -1.25 116.25 117.31 2rce h VAL 51 Ca 0.41 -0.09 0.03 0.00 0.82 0.00 0.00 66.70 67.88 2rce h VAL 51 Cb 0.07 0.55 -0.03 0.00 -1.52 0.00 0.00 31.29 30.35 2rce h VAL 51 CO -0.14 0.02 0.38 0.03 0.02 0.00 0.00 177.57 177.87 2rce h ARG 52 N -0.72 0.64 0.06 1.57 3.08 -0.67 0.40 114.38 118.73 2rce h ARG 52 Ca -0.07 -0.04 -0.28 0.00 0.07 0.00 0.00 59.98 59.67 2rce h ARG 52 Cb 0.54 -0.14 0.02 0.00 0.08 0.00 0.00 29.97 30.47 2rce h ARG 52 CO 0.11 0.42 -1.14 0.00 -1.07 0.00 0.00 179.97 178.30 2rce h ARG 53 N 0.66 0.61 0.00 0.04 3.08 -1.26 -3.42 114.38 114.09 2rce h ARG 53 Ca 0.23 -0.74 -0.35 0.00 0.07 0.00 0.00 59.98 59.19 2rce h ARG 53 Cb 0.10 0.23 -0.06 0.00 0.08 0.00 0.00 29.97 30.32 2rce h ARG 53 CO -0.06 1.32 -2.31 0.00 -1.07 0.00 0.00 179.97 177.85 2rce n ALA 54 N -2.64 1.50 0.05 0.04 0.00 -0.48 -4.58 120.51 114.40 2rce n ALA 54 Ca -0.12 -0.97 0.02 0.00 0.00 0.00 0.00 53.44 52.37 2rce n ALA 54 Cb 0.93 -0.00 0.36 0.00 0.00 0.00 0.00 19.45 20.74 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 -0.11 1.48 -0.20 0.00 0.00 -1.10 -2.36 119.26 116.98 2rce h ALA 55 Ca -0.52 -0.18 0.06 0.00 0.00 0.00 0.00 54.91 54.27 2rce h ALA 55 Cb 1.76 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 19.42 2rce h ALA 55 CO -0.11 0.37 0.23 -1.35 0.00 0.00 0.00 179.25 178.39 2rce h PRO 56 N 0.38 0.00 -0.01 0.00 0.11 -1.80 -2.15 132.00 128.53 2rce h PRO 56 Ca 0.08 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.19 2rce h PRO 56 Cb 0.30 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.41 2rce h PRO 56 CO 0.01 0.00 -0.26 0.00 -0.21 0.00 0.00 178.00 177.54 2rce n ALA 57 N -2.32 3.09 -2.69 -0.75 0.00 -0.89 -4.51 120.51 112.45 2rce n ALA 57 Ca 0.02 -0.41 -0.37 0.00 0.00 0.00 0.00 53.44 52.68 2rce n ALA 57 Cb 0.35 -1.12 -0.08 0.00 0.00 0.00 0.00 19.45 18.60 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 -2.50 5.27 0.24 0.00 1.01 -0.81 -0.58 120.40 123.03 2rce s VAL 58 Ca 0.24 0.56 0.10 0.00 0.00 0.00 0.00 61.98 62.87 2rce s VAL 58 Cb 0.19 -3.65 -0.04 0.00 0.00 0.00 0.00 36.38 32.88 2rce s VAL 58 CO 0.52 0.32 -0.06 0.68 0.00 0.00 0.00 175.10 176.57 2rce s VAL 59 N 0.92 3.24 -0.12 2.92 -7.23 0.57 -4.53 120.40 116.18 2rce s VAL 59 Ca 0.16 -1.90 -0.20 0.00 -1.81 0.00 0.00 61.98 58.23 2rce s VAL 59 Cb -0.14 -2.69 -0.04 0.00 0.56 0.00 0.00 36.38 34.07 2rce s VAL 59 CO 0.06 -0.29 0.58 0.20 -0.31 0.00 0.00 175.10 175.33 2rce s ASN 60 N -3.39 6.79 -0.19 4.85 0.01 -0.29 -1.33 114.94 121.39 2rce s ASN 60 Ca 0.29 0.94 -0.03 0.00 -0.71 0.00 0.00 52.86 53.35 2rce s ASN 60 Cb -0.07 -2.34 -0.02 0.00 0.41 0.00 0.00 41.25 39.23 2rce s ASN 60 CO 0.18 -0.09 -0.05 -0.69 -1.51 0.00 0.00 177.10 174.94 2rce s VAL 61 N 0.93 3.56 -0.25 1.60 1.01 -0.36 -0.82 120.40 126.06 2rce s VAL 61 Ca 0.30 -0.45 -0.02 0.00 0.00 0.00 0.00 61.98 61.81 2rce s VAL 61 Cb -0.16 -2.58 0.03 0.00 0.00 0.00 0.00 36.38 33.66 2rce s VAL 61 CO 0.13 0.45 -0.05 -0.31 0.00 0.00 0.00 175.10 175.32 2rce s TYR 62 N 0.97 3.08 -0.50 5.22 1.51 0.68 -1.00 117.35 127.30 2rce s TYR 62 Ca 0.00 -1.55 -0.23 0.00 -1.01 0.00 0.00 57.07 54.29 2rce s TYR 62 Cb -0.15 -2.07 0.04 0.00 -0.11 0.00 0.00 41.96 39.68 2rce s TYR 62 CO 0.01 -0.73 0.81 1.21 -1.11 0.00 0.00 175.55 175.75 2rce s ASN 63 N 1.33 6.34 -0.06 2.29 3.84 0.37 -1.08 114.94 127.97 2rce s ASN 63 Ca -0.00 -0.38 -0.01 0.00 0.21 0.00 0.00 52.86 52.68 2rce s ASN 63 Cb -0.17 -2.39 -0.03 0.00 -0.55 0.00 0.00 41.25 38.11 2rce s ASN 63 CO -0.04 -1.04 -0.00 -0.13 -2.79 0.00 0.00 177.10 173.10 2rce s ARG 64 N 3.42 2.91 -0.05 0.43 0.52 -0.38 -1.15 118.95 124.66 2rce s ARG 64 Ca 0.27 -0.47 -0.07 0.00 -0.52 0.00 0.00 55.73 54.94 2rce s ARG 64 Cb -0.14 -2.75 0.01 0.00 0.52 0.00 0.00 34.95 32.60 2rce s ARG 64 CO 0.19 0.68 0.18 0.20 0.02 0.00 0.00 175.30 176.57 2rce s GLY 65 N -1.07 -0.09 0.01 -3.53 0.00 -0.02 -1.10 107.32 101.51 2rce s GLY 65 Ca 0.15 0.34 -0.30 0.00 0.00 0.00 0.00 44.72 44.91 2rce s GLY 65 CO 0.05 0.24 1.63 1.08 0.00 0.00 0.00 173.10 176.10 2rce s LEU 66 N -0.36 4.34 -0.32 0.66 1.02 -1.26 -2.21 118.68 120.56 2rce s LEU 66 Ca -0.05 2.34 -0.27 0.00 0.02 0.00 0.00 54.13 56.18 2rce s LEU 66 Cb -0.03 -3.55 0.01 0.00 0.02 0.00 0.00 46.19 42.64 2rce s LEU 66 CO 0.01 -0.89 0.97 0.21 0.02 0.00 0.00 176.35 176.67 2rce s ASN 67 N 2.81 6.83 0.25 2.29 3.84 -0.89 -4.85 114.94 125.22 2rce s ASN 67 Ca 0.73 0.90 0.24 0.00 0.21 0.00 0.00 52.86 54.94 2rce s ASN 67 Cb -0.36 -2.49 0.34 0.00 -0.55 0.00 0.00 41.25 38.19 2rce s ASN 67 CO 0.31 -0.79 1.42 0.74 -2.79 0.00 0.00 177.10 175.99 2rce h THR 68 N 5.69 0.00 0.00 -5.21 2.02 -1.93 -1.54 112.91 111.94 2rce h THR 68 Ca -0.22 -0.77 -0.02 0.00 0.77 0.00 0.00 66.41 66.17 2rce h THR 68 Cb 1.07 1.53 -0.00 0.00 -1.74 0.00 0.00 68.15 69.01 2rce h THR 68 CO 0.98 0.00 -0.09 0.78 0.37 0.00 0.00 175.52 177.56 2rce h ASN 69 N 0.00 0.00 -2.12 4.18 2.35 -2.01 -3.43 115.58 114.55 2rce h ASN 69 Ca 0.00 0.00 -0.47 0.00 -0.55 0.00 0.00 56.30 55.28 2rce h ASN 69 Cb 0.88 0.00 -0.34 0.00 0.05 0.00 0.00 38.32 38.92 2rce h ASN 69 CO 0.00 0.09 -0.81 -0.44 -1.65 0.00 0.00 177.43 174.62 2rce s SER 70 N -6.19 1.30 -1.37 5.81 0.01 -1.12 -5.03 113.70 107.11 2rce s SER 70 Ca 0.06 -2.31 -0.08 0.00 1.31 0.00 0.00 55.95 54.93 2rce s SER 70 Cb 0.06 0.15 0.02 0.00 0.21 0.00 0.00 66.02 66.46 2rce s SER 70 CO 0.67 -0.21 1.11 1.41 0.41 0.00 0.00 173.24 176.62 2rce n HIS 71 N 3.49 -2.65 -3.55 2.43 8.25 -1.22 -4.01 115.22 117.96 2rce n HIS 71 Ca 0.20 0.98 -0.24 0.00 -0.26 0.00 0.00 57.72 58.40 2rce n HIS 71 Cb 0.46 -4.83 -0.06 0.00 1.12 0.00 0.00 29.99 26.68 2rce n HIS 71 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 2rce n ASN 72 N -3.00 -0.31 -4.36 0.41 3.02 -0.59 -4.92 115.26 105.51 2rce n ASN 72 Ca -0.04 -0.81 -0.29 0.00 -0.03 0.00 0.00 54.58 53.42 2rce n ASN 72 Cb 0.57 -1.02 -0.13 0.00 -0.61 0.00 0.00 39.78 38.59 2rce n ASN 72 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 2rce s GLN 73 N -5.38 1.48 0.12 3.52 2.00 -1.26 -4.80 119.66 115.35 2rce s GLN 73 Ca 0.28 -1.24 -0.31 0.00 -2.00 0.00 0.00 55.36 52.09 2rce s GLN 73 Cb -0.16 -1.84 -0.09 0.00 0.80 0.00 0.00 33.01 31.72 2rce s GLN 73 CO 0.65 0.45 1.47 -0.51 -0.50 0.00 0.00 175.29 176.85 2rce s LEU 74 N -1.76 4.37 0.06 3.68 1.43 -1.26 -2.09 118.68 123.11 2rce s LEU 74 Ca 0.12 2.43 -0.07 0.00 -1.03 0.00 0.00 54.13 55.59 2rce s LEU 74 Cb -0.10 -3.59 -0.01 0.00 0.03 0.00 0.00 46.19 42.52 2rce s LEU 74 CO 0.04 -0.74 0.13 -1.83 0.23 0.00 0.00 176.35 174.19 2rce s GLU 75 N 1.29 0.72 0.04 1.70 -1.05 -0.94 -4.93 118.70 115.53 2rce s GLU 75 Ca 0.67 -0.91 -0.30 0.00 -0.15 0.00 0.00 54.97 54.28 2rce s GLU 75 Cb -0.39 0.28 -0.08 0.00 -0.44 0.00 0.00 34.13 33.51 2rce s GLU 75 CO 0.31 -0.20 1.65 0.42 0.95 0.00 0.00 175.26 178.38 2rce s ILE 76 N -3.39 3.18 -0.10 1.83 1.01 -1.26 -0.84 121.20 121.63 2rce s ILE 76 Ca 0.02 0.54 0.12 0.00 0.00 0.00 0.00 60.65 61.33 2rce s ILE 76 Cb 0.03 -3.35 -0.17 0.00 0.01 0.00 0.00 42.46 38.98 2rce s ILE 76 CO -0.08 -0.01 0.12 -2.11 0.00 0.00 0.00 174.94 172.85 2rce n ARG 77 N 5.93 1.49 -3.80 2.79 1.85 -0.30 -4.90 116.66 119.71 2rce n ARG 77 Ca 0.16 -0.04 -0.12 0.00 -1.00 0.00 0.00 57.85 56.85 2rce n ARG 77 Cb 0.41 -1.33 -0.10 0.00 -1.05 0.00 0.00 32.46 30.39 2rce n ARG 77 CO 0.00 0.00 0.00 0.99 -0.01 0.00 0.00 177.63 178.61 2rce s THR 78 N -2.49 0.04 0.04 8.89 2.01 -0.93 -5.05 115.64 118.15 2rce s THR 78 Ca -0.06 -0.34 0.04 0.00 0.31 0.00 0.00 61.69 61.64 2rce s THR 78 Cb 0.05 -0.45 -0.02 0.00 0.01 0.00 0.00 72.50 72.09 2rce s THR 78 CO 0.54 -0.19 -0.11 -1.48 -0.69 0.00 0.00 174.62 172.70 2rce s LEU 79 N -0.72 2.19 0.00 4.42 0.05 -1.26 -0.48 118.68 122.88 2rce s LEU 79 Ca -0.08 -0.46 0.00 0.00 0.05 0.00 0.00 54.13 53.64 2rce s LEU 79 Cb -0.04 -0.40 0.00 0.00 -2.05 0.00 0.00 46.19 43.70 2rce s LEU 79 CO 0.02 -0.06 0.00 0.61 -0.55 0.00 0.00 176.35 176.37 2rce n GLY 80 N 1.81 4.23 3.50 -3.48 0.00 -0.17 -4.22 105.19 106.86 2rce n GLY 80 Ca -0.19 -0.95 -0.24 0.00 0.00 0.00 0.00 46.02 44.63 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 1.51 2.71 0.20 1.61 0.01 -1.21 -1.23 113.70 117.30 2rce s SER 81 Ca 0.00 -1.53 -0.21 0.00 1.31 0.00 0.00 55.95 55.53 2rce s SER 81 Cb 0.00 0.21 0.04 0.00 0.21 0.00 0.00 66.02 66.49 2rce s SER 81 CO 0.00 -0.76 0.60 -0.83 0.41 0.00 0.00 173.24 172.66 2rce s GLY 82 N -3.57 -0.32 -0.10 3.44 0.00 -0.44 -4.02 107.32 102.31 2rce s GLY 82 Ca 0.29 0.06 0.01 0.00 0.00 0.00 0.00 44.72 45.07 2rce s GLY 82 CO 0.14 -0.04 -0.10 0.14 0.00 0.00 0.00 173.10 173.24 2rce s VAL 83 N -3.83 1.13 -0.16 1.40 1.01 0.39 -0.32 120.40 120.02 2rce s VAL 83 Ca 0.06 -0.40 -0.29 0.00 0.00 0.00 0.00 61.98 61.35 2rce s VAL 83 Cb -0.02 -1.09 -0.01 0.00 0.00 0.00 0.00 36.38 35.25 2rce s VAL 83 CO -0.05 0.37 1.24 -0.63 0.00 0.00 0.00 175.10 176.03 2rce s ILE 84 N 1.29 4.31 -0.16 2.22 1.01 0.25 -0.99 121.20 129.13 2rce s ILE 84 Ca -0.02 1.59 0.15 0.00 0.00 0.00 0.00 60.65 62.36 2rce s ILE 84 Cb -0.14 -4.03 -0.24 0.00 0.01 0.00 0.00 42.46 38.07 2rce s ILE 84 CO -0.04 -0.13 0.22 0.23 0.00 0.00 0.00 174.94 175.22 2rce n MET 85 N 6.48 0.67 -3.91 2.79 2.81 -0.15 -1.50 117.12 124.32 2rce n MET 85 Ca 0.14 0.09 -0.09 0.00 -1.81 0.00 0.00 57.70 56.02 2rce n MET 85 Cb 0.45 -1.60 -0.05 0.00 -0.71 0.00 0.00 33.22 31.31 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 -5.77 -0.11 0.63 7.83 1.47 -1.24 -4.63 116.67 114.85 2rce s ASP 86 Ca -0.11 -0.77 0.40 0.00 1.18 0.00 0.00 52.55 53.25 2rce s ASP 86 Cb 0.07 0.54 2.16 0.00 -0.34 0.00 0.00 42.92 45.35 2rce s ASP 86 CO 0.81 -1.04 2.21 1.56 0.68 0.00 0.00 175.17 179.39 2rce h GLN 87 N 2.32 0.00 0.00 2.11 1.08 -1.93 -2.10 115.11 116.59 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 -1.96 -3.44 114.38 113.52 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 0.12 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.17 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 0.91 3.70 0.04 0.00 -0.79 -4.72 105.19 104.50 2rce n GLY 89 Ca 0.02 -0.15 -0.42 0.00 0.00 0.00 0.00 46.02 45.48 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 3.55 -0.08 1.61 1.51 -1.26 -1.25 117.35 119.44 2rce s TYR 90 Ca 0.00 1.48 0.03 0.00 -1.01 0.00 0.00 57.07 57.58 2rce s TYR 90 Cb 0.00 -3.05 0.01 0.00 -0.11 0.00 0.00 41.96 38.81 2rce s TYR 90 CO 0.00 -0.09 -0.19 0.42 -1.11 0.00 0.00 175.55 174.58 2rce s ILE 91 N 1.46 1.64 -0.03 2.71 1.01 -0.16 -0.97 121.20 126.85 2rce s ILE 91 Ca 0.45 -0.78 -0.19 0.00 0.00 0.00 0.00 60.65 60.13 2rce s ILE 91 Cb -0.19 -1.44 -0.05 0.00 0.01 0.00 0.00 42.46 40.79 2rce s ILE 91 CO 0.20 0.47 0.54 -0.63 0.00 0.00 0.00 174.94 175.51 2rce s ILE 92 N 0.45 4.99 0.00 2.92 1.01 -0.16 -0.08 121.20 130.32 2rce s ILE 92 Ca -0.16 1.11 0.00 0.00 0.00 0.00 0.00 60.65 61.60 2rce s ILE 92 Cb -0.17 -3.87 0.00 0.00 0.01 0.00 0.00 42.46 38.43 2rce s ILE 92 CO 0.06 0.42 0.00 1.07 0.00 0.00 0.00 174.94 176.50 2rce n THR 93 N 2.80 0.00 -3.44 2.92 5.66 -0.27 -0.46 114.28 121.48 2rce n THR 93 Ca -0.08 0.00 -0.38 0.00 -3.05 0.00 0.00 64.05 60.54 2rce n THR 93 Cb 0.51 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.23 2rce n THR 93 CO 0.00 0.00 0.00 0.21 -3.05 0.00 0.00 175.07 172.23 2rce s ASN 94 N -0.97 6.87 0.22 1.09 2.47 -1.26 -1.69 114.94 121.66 2rce s ASN 94 Ca 0.00 1.04 -0.08 0.00 0.42 0.00 0.00 52.86 54.24 2rce s ASN 94 Cb 0.00 -2.28 0.18 0.00 -1.45 0.00 0.00 41.25 37.70 2rce s ASN 94 CO 0.00 0.29 1.81 0.50 -3.72 0.00 0.00 177.10 175.98 2rce h LYS 95 N 4.53 1.21 -0.37 0.43 3.64 -0.84 -2.73 116.57 122.45 2rce h LYS 95 Ca -0.51 -0.18 -0.02 0.00 -1.27 0.00 0.00 60.65 58.67 2rce h LYS 95 Cb 1.22 -0.22 -0.02 0.00 -0.41 0.00 0.00 32.23 32.80 2rce h LYS 95 CO 0.62 0.94 0.15 0.45 -2.27 0.00 0.00 179.45 179.34 2rce h HIS 96 N 1.20 0.52 -0.59 1.91 3.86 -1.95 -1.78 115.15 118.31 2rce h HIS 96 Ca 0.29 -0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.47 2rce h HIS 96 Cb 0.13 -0.16 -0.03 0.00 1.06 0.00 0.00 27.41 28.41 2rce h HIS 96 CO 0.02 0.41 0.33 0.28 0.86 0.00 0.00 177.93 179.83 2rce h VAL 97 N 0.52 1.19 -0.13 2.45 2.07 -1.86 -3.28 116.25 117.21 2rce h VAL 97 Ca 0.13 -0.47 0.00 0.00 0.82 0.00 0.00 66.70 67.18 2rce h VAL 97 Cb 0.11 0.42 0.00 0.00 -1.52 0.00 0.00 31.29 30.30 2rce h VAL 97 CO -0.01 0.20 0.00 2.30 0.02 0.00 0.00 177.57 180.08 2rce n ILE 98 N -4.59 0.17 -1.70 4.57 -6.64 -1.06 -4.61 119.36 105.51 2rce n ILE 98 Ca 0.04 -0.59 -0.43 0.00 -1.77 0.00 0.00 62.75 60.00 2rce n ILE 98 Cb 0.08 1.25 -0.02 0.00 -1.44 0.00 0.00 39.64 39.52 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 1.14 3.07 -0.76 7.28 3.02 -0.69 -2.97 115.26 125.35 2rce n ASN 99 Ca 0.13 1.16 -0.10 0.00 -0.03 0.00 0.00 54.58 55.75 2rce n ASN 99 Cb 0.50 -1.49 -0.04 0.00 -0.61 0.00 0.00 39.78 38.14 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 1.71 -4.64 -4.77 6.41 10.43 -1.26 -4.98 116.55 119.46 2rce n ASP 100 Ca 0.09 0.24 -0.39 0.00 2.57 0.00 0.00 54.79 57.30 2rce n ASP 100 Cb 0.34 -3.01 -0.04 0.00 1.84 0.00 0.00 41.12 40.25 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 -2.21 3.27 -0.13 2.24 0.00 -1.16 -4.89 121.76 118.88 2rce s ALA 101 Ca 0.00 0.81 0.18 0.00 0.00 0.00 0.00 51.96 52.95 2rce s ALA 101 Cb 0.00 -3.30 -0.24 0.00 0.00 0.00 0.00 23.12 19.58 2rce s ALA 101 CO 0.00 -0.17 0.39 -0.25 0.00 0.00 0.00 175.76 175.73 2rce n ASP 102 N 0.70 0.32 -3.70 0.00 8.00 -0.26 -4.94 116.55 116.67 2rce n ASP 102 Ca 0.01 0.15 -0.11 0.00 0.71 0.00 0.00 54.79 55.55 2rce n ASP 102 Cb 0.47 0.81 -0.12 0.00 -0.02 0.00 0.00 41.12 42.26 2rce n ASP 102 CO 0.00 0.00 0.00 -1.58 -0.39 0.00 0.00 177.20 175.23 2rce s GLN 103 N -2.76 0.33 -0.22 -1.24 0.74 -0.86 -5.03 119.66 110.62 2rce s GLN 103 Ca -0.07 0.72 -0.06 0.00 0.05 0.00 0.00 55.36 56.00 2rce s GLN 103 Cb 0.08 -0.04 -0.02 0.00 1.10 0.00 0.00 33.01 34.12 2rce s GLN 103 CO 0.84 -0.17 0.02 0.42 -0.55 0.00 0.00 175.29 175.85 2rce s ILE 104 N 1.42 3.99 -0.08 -2.34 1.01 -1.26 -1.25 121.20 122.69 2rce s ILE 104 Ca -0.09 -0.29 -0.00 0.00 0.00 0.00 0.00 60.65 60.27 2rce s ILE 104 Cb -0.09 -2.83 -0.03 0.00 0.01 0.00 0.00 42.46 39.52 2rce s ILE 104 CO -0.11 0.40 -0.06 -0.63 0.00 0.00 0.00 174.94 174.53 2rce s ILE 105 N 1.29 3.77 -0.14 2.92 -1.09 -0.24 -0.44 121.20 127.27 2rce s ILE 105 Ca 0.04 -0.44 0.02 0.00 -2.23 0.00 0.00 60.65 58.04 2rce s ILE 105 Cb -0.15 -2.56 0.01 0.00 -1.58 0.00 0.00 42.46 38.18 2rce s ILE 105 CO 0.01 0.58 -0.21 -0.69 -1.23 0.00 0.00 174.94 173.41 2rce s VAL 106 N -0.60 1.99 -0.17 2.92 1.01 0.34 -0.23 120.40 125.66 2rce s VAL 106 Ca 0.09 -0.94 -0.01 0.00 0.00 0.00 0.00 61.98 61.13 2rce s VAL 106 Cb -0.12 -1.77 -0.00 0.00 0.00 0.00 0.00 36.38 34.49 2rce s VAL 106 CO 0.02 0.54 -0.12 0.00 0.00 0.00 0.00 175.10 175.53 2rce s ALA 107 N 0.88 2.60 0.34 5.51 0.00 -0.00 -0.58 121.76 130.52 2rce s ALA 107 Ca -0.06 -1.05 -0.05 0.00 0.00 0.00 0.00 51.96 50.80 2rce s ALA 107 Cb -0.15 -1.34 -0.05 0.00 0.00 0.00 0.00 23.12 21.58 2rce s ALA 107 CO -0.03 -0.09 0.62 -0.51 0.00 0.00 0.00 175.76 175.75 2rce s LEU 108 N 0.91 3.95 0.56 0.00 1.02 0.29 -1.14 118.68 124.27 2rce s LEU 108 Ca -0.03 0.76 0.34 0.00 0.02 0.00 0.00 54.13 55.23 2rce s LEU 108 Cb -0.15 -3.62 1.54 0.00 0.02 0.00 0.00 46.19 43.99 2rce s LEU 108 CO -0.01 -0.30 2.06 1.56 0.02 0.00 0.00 176.35 179.68 2rce h GLN 109 N 1.24 0.00 -0.00 1.70 1.08 -1.80 -1.93 115.11 115.41 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 0.64 0.04 -0.01 -0.40 -0.95 0.00 0.00 178.83 178.16 2rce n ASP 110 N -3.19 0.21 0.00 1.46 5.68 -1.26 -4.91 116.55 114.54 2rce n ASP 110 Ca -0.00 -0.94 0.00 0.00 -0.50 0.00 0.00 54.79 53.34 2rce n ASP 110 Cb 0.26 -0.04 0.00 0.00 -1.14 0.00 0.00 41.12 40.21 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 1.07 0.21 3.76 6.12 0.00 -0.72 -5.07 105.19 110.55 2rce n GLY 111 Ca 0.22 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.92 4.64 -0.09 1.61 0.52 -1.26 -4.84 118.95 118.62 2rce s ARG 112 Ca 0.00 1.80 0.02 0.00 -0.52 0.00 0.00 55.73 57.03 2rce s ARG 112 Cb 0.00 -3.19 0.01 0.00 0.52 0.00 0.00 34.95 32.29 2rce s ARG 112 CO 0.00 0.22 -0.14 0.08 0.02 0.00 0.00 175.30 175.47 2rce s VAL 113 N -1.13 1.37 0.10 3.52 1.01 -1.26 -0.55 120.40 123.45 2rce s VAL 113 Ca 0.45 -0.59 0.08 0.00 0.00 0.00 0.00 61.98 61.91 2rce s VAL 113 Cb -0.32 -1.24 -0.03 0.00 0.00 0.00 0.00 36.38 34.79 2rce s VAL 113 CO 0.41 0.41 -0.20 -0.36 0.00 0.00 0.00 175.10 175.36 2rce s PHE 114 N 0.78 1.70 -0.04 5.22 0.40 0.26 -4.99 117.98 121.30 2rce s PHE 114 Ca -0.11 -0.43 -0.27 0.00 -0.60 0.00 0.00 56.93 55.51 2rce s PHE 114 Cb -0.16 -0.93 -0.03 0.00 0.51 0.00 0.00 43.02 42.41 2rce s PHE 114 CO 0.02 0.19 0.87 -2.00 0.70 0.00 0.00 175.22 175.00 2rce s GLU 115 N -1.92 4.49 -0.01 0.44 2.12 -1.26 -0.51 118.70 122.05 2rce s GLU 115 Ca 0.05 1.19 -0.03 0.00 0.36 0.00 0.00 54.97 56.55 2rce s GLU 115 Cb -0.10 -3.47 -0.04 0.00 0.26 0.00 0.00 34.13 30.78 2rce s GLU 115 CO 0.04 -0.05 0.18 0.00 -0.54 0.00 0.00 175.26 174.90 2rce s ALA 116 N 1.08 3.96 -0.12 6.30 0.00 0.42 -4.62 121.76 128.78 2rce s ALA 116 Ca 0.45 -0.76 -0.06 0.00 0.00 0.00 0.00 51.96 51.59 2rce s ALA 116 Cb -0.19 -1.88 -0.04 0.00 0.00 0.00 0.00 23.12 21.01 2rce s ALA 116 CO 0.23 0.75 0.10 -0.51 0.00 0.00 0.00 175.76 176.32 2rce s LEU 117 N -1.94 4.12 -0.33 0.00 1.43 0.22 -4.38 118.68 117.79 2rce s LEU 117 Ca 0.27 0.34 -0.29 0.00 -1.03 0.00 0.00 54.13 53.42 2rce s LEU 117 Cb -0.13 -2.00 0.01 0.00 0.03 0.00 0.00 46.19 44.10 2rce s LEU 117 CO 0.19 0.37 1.25 -0.22 0.23 0.00 0.00 176.35 178.17 2rce s LEU 118 N -0.78 3.83 -0.01 1.79 1.98 -1.26 -0.41 118.68 123.83 2rce s LEU 118 Ca 0.13 1.06 -0.19 0.00 -2.89 0.00 0.00 54.13 52.24 2rce s LEU 118 Cb -0.12 -3.54 -0.29 0.00 0.66 0.00 0.00 46.19 42.90 2rce s LEU 118 CO 0.03 -1.10 1.01 0.58 -1.89 0.00 0.00 176.35 174.98 2rce h VAL 119 N 6.00 1.42 0.00 1.68 2.07 -1.28 -3.48 116.25 122.66 2rce h VAL 119 Ca -0.25 -2.39 0.00 0.00 0.82 0.00 0.00 66.70 64.88 2rce h VAL 119 Cb 1.09 2.90 0.00 0.00 -1.52 0.00 0.00 31.29 33.76 2rce h VAL 119 CO 1.05 0.69 0.00 0.61 0.02 0.00 0.00 177.57 179.94 2rce n GLY 120 N 1.42 1.16 3.09 2.17 0.00 -1.18 -4.73 105.19 107.12 2rce n GLY 120 Ca -0.13 -0.83 -0.08 0.00 0.00 0.00 0.00 46.02 44.99 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 0.41 -0.22 1.61 1.04 -1.26 -0.54 113.70 114.73 2rce s SER 121 Ca 0.00 -0.88 -0.01 0.00 0.48 0.00 0.00 55.95 55.54 2rce s SER 121 Cb 0.00 0.20 0.06 0.00 0.10 0.00 0.00 66.02 66.38 2rce s SER 121 CO 0.00 -0.57 0.00 -0.62 0.98 0.00 0.00 173.24 173.03 2rce s ASP 122 N -2.69 3.44 0.30 7.02 2.15 0.10 -4.99 116.67 122.02 2rce s ASP 122 Ca 0.03 -1.06 0.08 0.00 0.43 0.00 0.00 52.55 52.03 2rce s ASP 122 Cb 0.05 -0.89 0.48 0.00 -0.30 0.00 0.00 42.92 42.26 2rce s ASP 122 CO -0.09 -0.28 1.70 0.77 -0.17 0.00 0.00 175.17 177.10 2rce h SER 123 N 8.09 0.16 -0.68 -0.34 4.64 -1.95 0.20 113.55 123.66 2rce h SER 123 Ca -0.17 -0.07 -0.00 0.00 -0.47 0.00 0.00 61.79 61.08 2rce h SER 123 Cb 1.09 -0.04 -0.03 0.00 -0.31 0.00 0.00 62.40 63.10 2rce h SER 123 CO 0.38 0.59 0.41 0.25 -0.87 0.00 0.00 176.83 177.60 2rce h LEU 124 N 0.12 0.83 -0.71 5.97 6.46 -1.96 -3.16 115.31 122.87 2rce h LEU 124 Ca 0.01 -0.05 0.00 0.00 -0.12 0.00 0.00 57.88 57.72 2rce h LEU 124 Cb 0.85 -0.21 0.00 0.00 -0.73 0.00 0.00 40.66 40.57 2rce h LEU 124 CO 0.07 0.64 -0.22 0.35 -0.62 0.00 0.00 178.44 178.66 2rce n THR 125 N -4.39 0.00 -1.82 1.05 -2.24 -1.16 -5.00 114.28 100.71 2rce n THR 125 Ca 0.07 -0.39 -0.16 0.00 -2.27 0.00 0.00 64.05 61.30 2rce n THR 125 Cb 0.07 1.11 -0.04 0.00 -2.10 0.00 0.00 70.33 69.37 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 -0.30 -4.82 -4.88 3.42 2.03 0.66 -4.99 116.55 107.66 2rce n ASP 126 Ca 0.04 0.21 -0.32 0.00 0.52 0.00 0.00 54.79 55.24 2rce n ASP 126 Cb 0.21 -3.81 -0.05 0.00 -0.72 0.00 0.00 41.12 36.75 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 -4.00 4.25 0.04 -2.67 1.43 -1.00 -0.27 118.68 116.47 2rce s LEU 127 Ca 0.00 0.26 0.03 0.00 -1.03 0.00 0.00 54.13 53.39 2rce s LEU 127 Cb 0.00 -2.66 -0.02 0.00 0.03 0.00 0.00 46.19 43.54 2rce s LEU 127 CO 0.00 0.23 -0.09 0.00 0.23 0.00 0.00 176.35 176.72 2rce s ALA 128 N -1.37 0.69 -0.09 4.21 0.00 -0.68 0.03 121.76 124.55 2rce s ALA 128 Ca 0.29 -0.78 0.02 0.00 0.00 0.00 0.00 51.96 51.50 2rce s ALA 128 Cb -0.13 0.00 -0.02 0.00 0.00 0.00 0.00 23.12 22.98 2rce s ALA 128 CO 0.21 0.03 -0.15 0.08 0.00 0.00 0.00 175.76 175.93 2rce s VAL 129 N -1.27 2.91 0.30 0.00 1.01 0.30 -1.12 120.40 122.53 2rce s VAL 129 Ca -0.08 -0.74 0.10 0.00 0.00 0.00 0.00 61.98 61.26 2rce s VAL 129 Cb -0.09 -2.17 -0.05 0.00 0.00 0.00 0.00 36.38 34.07 2rce s VAL 129 CO 0.01 0.55 -0.02 -0.76 0.00 0.00 0.00 175.10 174.88 2rce s LEU 130 N -0.10 3.01 -0.05 3.92 1.43 0.88 -0.80 118.68 126.97 2rce s LEU 130 Ca -0.02 -0.86 0.01 0.00 -1.03 0.00 0.00 54.13 52.22 2rce s LEU 130 Cb -0.14 -1.46 0.02 0.00 0.03 0.00 0.00 46.19 44.64 2rce s LEU 130 CO 0.04 -0.11 -0.05 -0.75 0.23 0.00 0.00 176.35 175.72 2rce s LYS 131 N -3.67 0.92 -0.01 1.70 2.47 0.45 -0.99 119.74 120.60 2rce s LYS 131 Ca 0.33 -0.11 0.04 0.00 -1.56 0.00 0.00 55.97 54.66 2rce s LYS 131 Cb -0.03 -0.95 -0.03 0.00 -1.46 0.00 0.00 37.83 35.35 2rce s LYS 131 CO 0.19 -0.12 -0.10 0.96 0.16 0.00 0.00 175.35 176.44 2rce s ILE 132 N 1.10 3.40 -0.52 5.43 -4.36 -0.38 -0.61 121.20 125.25 2rce s ILE 132 Ca -0.08 -0.79 -0.11 0.00 -0.26 0.00 0.00 60.65 59.41 2rce s ILE 132 Cb -0.14 -2.43 0.13 0.00 1.25 0.00 0.00 42.46 41.27 2rce s ILE 132 CO -0.01 0.46 0.42 0.21 0.24 0.00 0.00 174.94 176.26 2rce s ASN 133 N -1.19 5.89 0.12 4.36 2.47 -1.26 -4.47 114.94 120.86 2rce s ASN 133 Ca 0.15 -1.98 0.09 0.00 0.42 0.00 0.00 52.86 51.54 2rce s ASN 133 Cb -0.11 -2.07 -0.04 0.00 -1.45 0.00 0.00 41.25 37.58 2rce s ASN 133 CO 0.05 -0.72 -0.18 0.00 -3.72 0.00 0.00 177.10 172.53 2rce s ALA 134 N 1.28 2.69 0.07 1.71 0.00 -1.26 -5.05 121.76 121.19 2rce s ALA 134 Ca 0.06 -1.37 0.05 0.00 0.00 0.00 0.00 51.96 50.70 2rce s ALA 134 Cb -0.26 -0.64 -0.04 0.00 0.00 0.00 0.00 23.12 22.18 2rce s ALA 134 CO -0.00 0.58 -0.06 -0.08 0.00 0.00 0.00 175.76 176.19 2rce s THR 135 N -1.21 3.64 0.00 0.00 -1.32 -1.26 -4.83 115.64 110.66 2rce s THR 135 Ca 0.19 -1.03 0.00 0.00 -1.21 0.00 0.00 61.69 59.64 2rce s THR 135 Cb -0.10 -2.67 0.00 0.00 -1.51 0.00 0.00 72.50 68.22 2rce s THR 135 CO 0.10 0.21 0.00 0.61 -2.21 0.00 0.00 174.62 173.33 2rce n GLY 136 N 0.95 0.62 0.00 6.08 0.00 -1.26 -4.96 105.19 106.62 2rce n GLY 136 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.89 2rce n GLY 136 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2rce n GLY 137 N -1.94 2.05 3.37 -0.02 0.00 -1.26 -5.09 105.19 102.30 2rce n GLY 137 Ca 0.00 -1.53 -0.31 0.00 0.00 0.00 0.00 46.02 44.18 2rce n GLY 137 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2rce s LEU 138 N 0.00 2.27 0.28 0.99 1.43 -1.26 -5.12 118.68 117.27 2rce s LEU 138 Ca 0.00 -0.47 -0.29 0.00 -1.03 0.00 0.00 54.13 52.34 2rce s LEU 138 Cb 0.00 -1.38 -0.10 0.00 0.03 0.00 0.00 46.19 44.75 2rce s LEU 138 CO 0.00 0.29 1.14 -2.16 0.23 0.00 0.00 176.35 175.85 2rce s PRO 139 N -0.98 4.59 0.12 1.29 0.04 -1.26 -4.84 135.00 133.96 2rce s PRO 139 Ca 0.12 1.87 0.09 0.00 0.04 0.00 0.00 61.00 63.11 2rce s PRO 139 Cb -0.10 -3.18 -0.04 0.00 0.04 0.00 0.00 34.50 31.22 2rce s PRO 139 CO 0.01 0.13 -0.22 0.95 0.04 0.00 0.00 177.00 177.91 2rce s THR 140 N -1.07 1.91 0.15 1.26 -4.23 -1.26 -4.59 115.64 107.81 2rce s THR 140 Ca 0.46 -1.67 -0.30 0.00 -1.18 0.00 0.00 61.69 58.99 2rce s THR 140 Cb -0.33 -1.74 -0.08 0.00 1.34 0.00 0.00 72.50 71.69 2rce s THR 140 CO 0.42 -0.05 1.26 -0.51 -0.54 0.00 0.00 174.62 175.21 2rce s ILE 141 N -1.25 3.53 0.17 2.99 1.10 -0.56 -4.74 121.20 122.43 2rce s ILE 141 Ca 0.10 1.19 -0.32 0.00 -0.51 0.00 0.00 60.65 61.12 2rce s ILE 141 Cb -0.09 -3.76 -0.10 0.00 0.15 0.00 0.00 42.46 38.65 2rce s ILE 141 CO 0.05 0.15 1.61 -2.84 -2.11 0.00 0.00 174.94 171.80 2rce s PRO 142 N 0.34 4.19 -0.11 3.50 0.02 -1.26 -4.95 135.00 136.73 2rce s PRO 142 Ca 0.57 2.41 -0.00 0.00 0.02 0.00 0.00 61.00 64.01 2rce s PRO 142 Cb -0.34 -3.16 0.02 0.00 0.02 0.00 0.00 34.50 31.05 2rce s PRO 142 CO 0.34 -0.64 -0.09 0.42 -0.33 0.00 0.00 177.00 176.70 2rce s ILE 143 N 1.23 1.09 -0.50 2.83 1.01 -1.26 -0.84 121.20 124.76 2rce s ILE 143 Ca 0.71 -0.33 -0.07 0.00 0.00 0.00 0.00 60.65 60.96 2rce s ILE 143 Cb -0.45 -1.09 0.13 0.00 0.01 0.00 0.00 42.46 41.06 2rce s ILE 143 CO 0.31 0.38 0.35 0.21 0.00 0.00 0.00 174.94 176.19 2rce s ASN 144 N 1.63 5.60 0.32 3.58 3.84 -1.26 -4.96 114.94 123.69 2rce s ASN 144 Ca 0.04 -2.11 0.24 0.00 0.21 0.00 0.00 52.86 51.24 2rce s ASN 144 Cb -0.13 -1.96 1.16 0.00 -0.55 0.00 0.00 41.25 39.77 2rce s ASN 144 CO -0.08 -0.61 1.74 0.00 -2.79 0.00 0.00 177.10 175.36 2rce h ALA 145 N 8.13 1.00 -0.01 1.71 0.00 -1.98 -1.93 119.26 126.19 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 0.80 0.00 -0.63 0.54 0.00 0.00 0.00 179.25 179.96 2rce n ARG 146 N -2.34 0.49 -2.34 0.00 1.74 -1.26 -4.93 116.66 108.03 2rce n ARG 146 Ca 0.00 -0.37 -0.42 0.00 -0.77 0.00 0.00 57.85 56.29 2rce n ARG 146 Cb 0.14 -1.49 -0.03 0.00 -1.02 0.00 0.00 32.46 30.06 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 -2.77 4.33 -0.39 5.56 6.06 -0.73 -5.01 118.95 126.02 2rce s ARG 147 Ca 0.14 1.84 -0.16 0.00 -2.50 0.00 0.00 55.73 55.05 2rce s ARG 147 Cb 0.17 -3.51 0.01 0.00 0.06 0.00 0.00 34.95 31.68 2rce s ARG 147 CO 0.69 -0.47 0.36 0.08 -2.50 0.00 0.00 175.30 173.46 2rce s VAL 148 N 2.03 5.18 0.24 7.11 1.01 -1.26 -5.04 120.40 129.67 2rce s VAL 148 Ca 0.60 -0.31 -0.31 0.00 0.00 0.00 0.00 61.98 61.96 2rce s VAL 148 Cb -0.29 -3.92 -0.11 0.00 0.00 0.00 0.00 36.38 32.06 2rce s VAL 148 CO 0.26 -0.26 1.61 -2.84 0.00 0.00 0.00 175.10 173.86 2rce s PRO 149 N 1.94 4.16 0.07 2.72 0.02 -1.26 -5.02 135.00 137.62 2rce s PRO 149 Ca 0.09 2.52 0.09 0.00 0.02 0.00 0.00 61.00 63.72 2rce s PRO 149 Cb -0.17 -3.07 -0.03 0.00 0.02 0.00 0.00 34.50 31.24 2rce s PRO 149 CO 0.12 -0.63 -0.23 -1.01 -0.33 0.00 0.00 177.00 174.91 2rce s HIS 150 N 0.51 2.41 0.16 6.54 3.76 -1.26 -5.02 115.29 122.39 2rce s HIS 150 Ca 0.67 -0.34 -0.31 0.00 -0.15 0.00 0.00 55.06 54.92 2rce s HIS 150 Cb -0.47 -1.38 -0.10 0.00 1.11 0.00 0.00 32.58 31.73 2rce s HIS 150 CO 0.40 0.23 1.68 0.42 -0.85 0.00 0.00 174.74 176.63 2rce s ILE 151 N -0.92 2.48 0.00 0.60 1.01 -1.26 -1.78 121.20 121.32 2rce s ILE 151 Ca 0.14 0.23 0.00 0.00 0.00 0.00 0.00 60.65 61.02 2rce s ILE 151 Cb -0.10 -3.15 0.00 0.00 0.01 0.00 0.00 42.46 39.22 2rce s ILE 151 CO 0.05 0.01 0.00 0.61 0.00 0.00 0.00 174.94 175.61 2rce n GLY 152 N 3.96 1.71 3.71 6.18 0.00 0.17 -4.97 105.19 115.94 2rce n GLY 152 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 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 3.94 -4.72 1.61 9.92 -0.74 -4.68 116.55 121.89 2rce n ASP 153 Ca 0.00 1.05 -0.42 0.00 -0.53 0.00 0.00 54.79 54.89 2rce n ASP 153 Cb 0.00 -1.56 -0.03 0.00 -0.64 0.00 0.00 41.12 38.89 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 1.37 2.46 0.09 2.53 1.01 -1.26 -0.84 120.40 125.76 2rce s VAL 154 Ca 0.76 0.34 0.05 0.00 0.00 0.00 0.00 61.98 63.13 2rce s VAL 154 Cb -0.51 -3.21 -0.03 0.00 0.00 0.00 0.00 36.38 32.62 2rce s VAL 154 CO 0.33 0.03 -0.12 0.68 0.00 0.00 0.00 175.10 176.02 2rce s VAL 155 N 0.95 1.06 -0.09 2.92 -7.23 -0.13 -3.43 120.40 114.46 2rce s VAL 155 Ca 0.69 -1.47 0.04 0.00 -1.81 0.00 0.00 61.98 59.44 2rce s VAL 155 Cb -0.45 -1.21 -0.01 0.00 0.56 0.00 0.00 36.38 35.27 2rce s VAL 155 CO 0.34 -0.37 -0.22 -0.76 -0.31 0.00 0.00 175.10 173.77 2rce s LEU 156 N -2.07 2.20 -0.16 1.32 1.43 0.66 -1.17 118.68 120.88 2rce s LEU 156 Ca 0.02 -0.50 -0.11 0.00 -1.03 0.00 0.00 54.13 52.50 2rce s LEU 156 Cb -0.07 -1.43 -0.05 0.00 0.03 0.00 0.00 46.19 44.67 2rce s LEU 156 CO 0.02 0.19 0.21 0.00 0.23 0.00 0.00 176.35 177.00 2rce s ALA 157 N 0.17 3.68 -0.14 4.21 0.00 0.32 -1.08 121.76 128.91 2rce s ALA 157 Ca -0.13 -0.56 0.00 0.00 0.00 0.00 0.00 51.96 51.27 2rce s ALA 157 Cb -0.16 -2.24 0.02 0.00 0.00 0.00 0.00 23.12 20.74 2rce s ALA 157 CO 0.07 0.22 -0.12 0.42 0.00 0.00 0.00 175.76 176.35 2rce s ILE 158 N 0.11 1.44 0.00 0.00 1.01 0.20 -1.54 121.20 122.42 2rce s ILE 158 Ca 0.13 -0.55 0.00 0.00 0.00 0.00 0.00 60.65 60.23 2rce s ILE 158 Cb -0.12 -1.37 0.00 0.00 0.01 0.00 0.00 42.46 40.98 2rce s ILE 158 CO 0.02 0.43 0.00 0.61 0.00 0.00 0.00 174.94 176.00 2rce n GLY 159 N 4.81 1.36 2.45 6.18 0.00 -1.04 -2.10 105.19 116.85 2rce n GLY 159 Ca -0.16 -0.88 -0.27 0.00 0.00 0.00 0.00 46.02 44.71 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 -0.46 3.77 -4.73 1.61 5.15 -1.14 0.08 115.26 119.54 2rce n ASN 160 Ca 0.00 -3.44 -0.41 0.00 -0.60 0.00 0.00 54.58 50.13 2rce n ASN 160 Cb 0.00 -0.68 -0.03 0.00 -0.53 0.00 0.00 39.78 38.54 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 -2.44 4.41 -1.31 1.20 0.04 -1.26 -3.00 135.00 132.63 2rce s PRO 161 Ca 0.39 1.99 0.00 0.00 0.04 0.00 0.00 61.00 63.43 2rce s PRO 161 Cb 0.14 -3.22 0.00 0.00 0.04 0.00 0.00 34.50 31.46 2rce s PRO 161 CO -0.02 -0.24 0.00 0.66 0.04 0.00 0.00 177.00 177.44 2rce n TYR 162 N 2.88 -0.96 -3.34 0.56 4.02 0.11 -1.66 117.16 118.77 2rce n TYR 162 Ca 0.07 0.00 -0.24 0.00 -0.01 0.00 0.00 57.90 57.72 2rce n TYR 162 Cb 0.43 -2.88 0.01 0.00 -0.02 0.00 0.00 39.34 36.88 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 -1.39 -4.60 0.19 7.72 5.15 -1.16 -4.87 115.26 116.31 2rce n ASN 163 Ca -0.16 -0.41 0.13 0.00 -0.60 0.00 0.00 54.58 53.54 2rce n ASN 163 Cb 0.57 -3.75 0.34 0.00 -0.53 0.00 0.00 39.78 36.41 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 -1.26 0.00 0.00 1.20 3.38 -1.56 -3.50 115.31 113.58 2rce h LEU 164 Ca -0.48 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.49 2rce h LEU 164 Cb 1.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.07 2rce h LEU 164 CO 0.56 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.70 2rce n GLY 165 N 0.89 2.42 3.62 0.83 0.00 -1.26 -5.03 105.19 106.66 2rce n GLY 165 Ca 0.04 -2.01 -0.50 0.00 0.00 0.00 0.00 46.02 43.54 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 0.34 1.47 -4.70 1.61 7.27 -1.26 -4.43 117.38 117.68 2rce n GLN 166 Ca 0.00 0.53 -0.24 0.00 0.07 0.00 0.00 57.00 57.36 2rce n GLN 166 Cb 0.00 -2.22 -0.16 0.00 2.41 0.00 0.00 30.24 30.28 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 0.85 1.23 -0.17 1.69 2.01 0.11 -4.97 115.64 116.39 2rce s THR 167 Ca 0.84 -0.60 -0.05 0.00 0.31 0.00 0.00 61.69 62.18 2rce s THR 167 Cb -0.87 -1.07 -0.03 0.00 0.01 0.00 0.00 72.50 70.54 2rce s THR 167 CO 0.45 0.36 -0.01 -0.63 -0.69 0.00 0.00 174.62 174.11 2rce s ILE 168 N 0.10 4.11 0.16 1.82 -1.09 -1.26 -2.51 121.20 122.53 2rce s ILE 168 Ca -0.04 -0.28 0.08 0.00 -2.23 0.00 0.00 60.65 58.19 2rce s ILE 168 Cb -0.11 -2.82 -0.04 0.00 -1.58 0.00 0.00 42.46 37.91 2rce s ILE 168 CO 0.02 0.47 -0.18 0.42 -1.23 0.00 0.00 174.94 174.44 2rce s THR 169 N 0.52 1.78 -0.04 2.92 -4.23 -0.59 -4.96 115.64 111.04 2rce s THR 169 Ca -0.01 -1.89 0.07 0.00 -1.18 0.00 0.00 61.69 58.67 2rce s THR 169 Cb -0.14 -1.81 -0.01 0.00 1.34 0.00 0.00 72.50 71.87 2rce s THR 169 CO 0.02 -0.31 -0.24 -1.58 -0.54 0.00 0.00 174.62 171.97 2rce s GLN 170 N -2.76 2.23 0.00 3.99 -0.44 -1.26 -0.52 119.66 120.90 2rce s GLN 170 Ca 0.15 -0.86 0.00 0.00 -2.50 0.00 0.00 55.36 52.15 2rce s GLN 170 Cb -0.06 -2.00 0.00 0.00 -1.64 0.00 0.00 33.01 29.31 2rce s GLN 170 CO 0.06 0.43 0.00 0.41 0.50 0.00 0.00 175.29 176.69 2rce n GLY 171 N 2.77 3.84 3.33 2.59 0.00 -0.32 -4.37 105.19 113.04 2rce n GLY 171 Ca -0.17 -0.69 -0.17 0.00 0.00 0.00 0.00 46.02 44.99 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 -0.85 0.77 -0.23 -0.61 -4.36 -1.26 -0.95 121.20 113.71 2rce s ILE 172 Ca 0.00 -2.00 -0.29 0.00 -0.26 0.00 0.00 60.65 58.09 2rce s ILE 172 Cb 0.00 -2.54 -0.01 0.00 1.25 0.00 0.00 42.46 41.16 2rce s ILE 172 CO 0.00 -0.12 1.28 -0.63 0.24 0.00 0.00 174.94 175.71 2rce s ILE 173 N -3.60 4.21 -0.06 8.37 1.01 -0.02 -3.16 121.20 127.96 2rce s ILE 173 Ca 0.34 1.42 0.13 0.00 0.00 0.00 0.00 60.65 62.54 2rce s ILE 173 Cb 0.07 -4.08 -0.13 0.00 0.01 0.00 0.00 42.46 38.34 2rce s ILE 173 CO 0.12 -0.30 1.03 0.28 0.00 0.00 0.00 174.94 176.06 2rce h SER 174 N 8.77 0.00 -4.02 3.58 0.02 -0.62 0.50 113.55 121.78 2rce h SER 174 Ca -0.26 0.00 0.11 0.00 -0.84 0.00 0.00 61.79 60.80 2rce h SER 174 Cb 1.10 0.00 -0.23 0.00 0.14 0.00 0.00 62.40 63.41 2rce h SER 174 CO 1.00 0.75 0.61 0.00 -1.14 0.00 0.00 176.83 178.06 2rce s ALA 175 N -2.81 -1.96 -0.57 3.77 0.00 -1.15 -4.92 121.76 114.12 2rce s ALA 175 Ca -0.01 1.59 0.06 0.00 0.00 0.00 0.00 51.96 53.61 2rce s ALA 175 Cb 0.09 -0.71 0.24 0.00 0.00 0.00 0.00 23.12 22.73 2rce s ALA 175 CO 0.80 -0.34 0.66 0.25 0.00 0.00 0.00 175.76 177.13 2rce n THR 176 N 0.59 1.36 0.00 0.00 -2.24 -1.26 -0.51 114.28 112.22 2rce n THR 176 Ca -0.08 -4.81 0.00 0.00 -2.27 0.00 0.00 64.05 56.88 2rce n THR 176 Cb 0.58 -2.05 0.00 0.00 -2.10 0.00 0.00 70.33 66.76 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 1.12 0.09 2.98 3.38 0.00 0.12 -4.94 105.19 107.94 2rce n GLY 177 Ca 0.27 -1.81 -0.14 0.00 0.00 0.00 0.00 46.02 44.34 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 -2.02 0.39 -0.09 1.61 1.81 -0.53 -4.95 118.95 115.17 2rce s ARG 178 Ca 0.00 -0.33 -0.26 0.00 -1.72 0.00 0.00 55.73 53.41 2rce s ARG 178 Cb 0.00 -0.30 -0.26 0.00 -0.45 0.00 0.00 34.95 33.94 2rce s ARG 178 CO 0.00 0.07 0.89 0.82 -0.68 0.00 0.00 175.30 176.41 2rce h ILE 179 N 4.88 1.66 -2.25 1.52 1.08 -1.95 -3.43 117.51 119.01 2rce h ILE 179 Ca -0.30 -2.19 -0.43 0.00 -0.39 0.00 0.00 64.86 61.55 2rce h ILE 179 Cb 1.20 3.11 0.04 0.00 -3.07 0.00 0.00 36.82 38.10 2rce h ILE 179 CO 0.47 0.59 -0.10 -0.83 -0.69 0.00 0.00 178.15 177.59 2rce s GLY 180 N -4.10 1.83 0.34 5.37 0.00 -1.26 -5.07 107.32 104.43 2rce s GLY 180 Ca -0.17 -1.39 -0.28 0.00 0.00 0.00 0.00 44.72 42.88 2rce s GLY 180 CO 0.73 -1.15 1.28 1.08 0.00 0.00 0.00 173.10 175.04 2rce s LEU 181 N -4.63 4.40 0.22 0.66 1.43 -1.26 -4.95 118.68 114.55 2rce s LEU 181 Ca 0.56 2.64 -0.16 0.00 -1.03 0.00 0.00 54.13 56.13 2rce s LEU 181 Cb -0.10 -3.69 0.01 0.00 0.03 0.00 0.00 46.19 42.44 2rce s LEU 181 CO 0.37 -0.54 0.51 0.54 0.23 0.00 0.00 176.35 177.45 2rce s ASN 182 N -0.58 -0.18 0.66 2.29 2.20 -1.26 -5.06 114.94 113.01 2rce s ASN 182 Ca 0.50 -0.66 0.28 0.00 -0.94 0.00 0.00 52.86 52.03 2rce s ASN 182 Cb -0.39 0.59 1.50 0.00 -2.00 0.00 0.00 41.25 40.95 2rce s ASN 182 CO 0.51 -1.10 1.85 -0.65 -2.94 0.00 0.00 177.10 174.77 2rce h PRO 183 N 2.22 0.00 0.00 3.55 0.11 -1.95 0.46 132.00 136.39 2rce h PRO 183 Ca -0.27 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.76 2rce h PRO 183 Cb 1.25 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.35 2rce h PRO 183 CO 0.36 0.00 -0.40 1.79 -0.21 0.00 0.00 178.00 179.54 2rce h THR 184 N 0.00 0.70 0.00 -1.15 1.35 -1.99 -3.47 112.91 108.34 2rce h THR 184 Ca 0.02 -1.97 0.00 0.00 -0.55 0.00 0.00 66.41 63.90 2rce h THR 184 Cb 0.81 2.33 0.00 0.00 -1.73 0.00 0.00 68.15 69.56 2rce h THR 184 CO -0.00 0.40 0.00 0.61 -0.25 0.00 0.00 175.52 176.28 2rce n GLY 185 N 1.18 0.92 3.35 5.82 0.00 0.15 -5.01 105.19 111.60 2rce n GLY 185 Ca 0.02 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.86 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 -0.06 1.36 0.00 1.61 0.52 -1.26 -4.95 118.95 116.17 2rce s ARG 186 Ca 0.00 -1.64 0.05 0.00 -0.52 0.00 0.00 55.73 53.62 2rce s ARG 186 Cb 0.00 -1.00 0.01 0.00 0.52 0.00 0.00 34.95 34.48 2rce s ARG 186 CO 0.00 0.09 0.52 1.04 0.02 0.00 0.00 175.30 176.97 2rce n GLN 187 N -0.42 1.48 0.00 3.54 1.13 -1.26 -4.69 117.38 117.16 2rce n GLN 187 Ca -0.07 -0.56 0.00 0.00 -1.94 0.00 0.00 57.00 54.43 2rce n GLN 187 Cb 0.62 -0.98 0.00 0.00 0.11 0.00 0.00 30.24 29.98 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 -0.14 1.44 -4.77 1.08 0.23 -1.26 -1.45 115.26 110.40 2rce n ASN 188 Ca 0.02 -1.46 -0.41 0.00 -0.53 0.00 0.00 54.58 52.20 2rce n ASN 188 Cb 0.11 0.00 -0.01 0.00 -2.08 0.00 0.00 39.78 37.80 2rce n ASN 188 CO 0.00 0.00 0.00 -0.36 -0.93 0.00 0.00 177.26 175.97 2rce s PHE 189 N -0.46 2.83 0.04 -2.53 0.08 -1.26 -4.32 117.98 112.36 2rce s PHE 189 Ca 0.00 1.16 -0.26 0.00 0.12 0.00 0.00 56.93 57.95 2rce s PHE 189 Cb 0.00 -3.89 -0.05 0.00 -0.57 0.00 0.00 43.02 38.51 2rce s PHE 189 CO 0.00 -2.67 0.83 -0.51 -0.10 0.00 0.00 175.22 172.77 2rce s LEU 190 N -1.44 4.43 -0.06 -0.37 1.43 -0.17 0.13 118.68 122.64 2rce s LEU 190 Ca 0.54 1.51 -0.02 0.00 -1.03 0.00 0.00 54.13 55.13 2rce s LEU 190 Cb -0.44 -3.33 -0.04 0.00 0.03 0.00 0.00 46.19 42.41 2rce s LEU 190 CO 0.54 -0.06 0.07 -1.58 0.23 0.00 0.00 176.35 175.55 2rce s GLN 191 N 0.22 3.13 0.03 1.70 0.74 0.33 -0.47 119.66 125.34 2rce s GLN 191 Ca 0.42 -0.37 -0.07 0.00 0.05 0.00 0.00 55.36 55.39 2rce s GLN 191 Cb -0.21 -2.91 -0.01 0.00 1.10 0.00 0.00 33.01 30.98 2rce s GLN 191 CO 0.24 0.70 0.13 -0.08 -0.55 0.00 0.00 175.29 175.73 2rce s THR 192 N -1.05 0.12 -1.45 -0.34 -1.32 0.49 0.18 115.64 112.27 2rce s THR 192 Ca 0.18 -0.99 0.17 0.00 -1.21 0.00 0.00 61.69 59.84 2rce s THR 192 Cb -0.12 -0.83 0.50 0.00 -1.51 0.00 0.00 72.50 70.54 2rce s THR 192 CO 0.08 -0.54 1.41 -0.90 -2.21 0.00 0.00 174.62 172.46 2rce n ASP 193 N 0.85 3.52 -4.67 8.08 5.75 -1.19 -0.97 116.55 127.92 2rce n ASP 193 Ca -0.19 -2.02 -0.42 0.00 -0.01 0.00 0.00 54.79 52.14 2rce n ASP 193 Cb 0.58 -0.38 -0.03 0.00 -1.03 0.00 0.00 41.12 40.26 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 -1.04 3.65 -0.05 2.12 0.00 -1.26 -4.66 121.76 120.51 2rce s ALA 194 Ca 0.37 1.29 -0.34 0.00 0.00 0.00 0.00 51.96 53.29 2rce s ALA 194 Cb 0.20 -3.79 -0.12 0.00 0.00 0.00 0.00 23.12 19.41 2rce s ALA 194 CO 0.25 -1.40 1.85 0.43 0.00 0.00 0.00 175.76 176.89 2rce n SER 195 N 6.77 3.48 -4.19 0.00 7.64 -1.26 -4.84 113.62 121.21 2rce n SER 195 Ca 0.18 0.98 -0.30 0.00 1.01 0.00 0.00 58.87 60.74 2rce n SER 195 Cb 0.40 -1.39 -0.17 0.00 -1.01 0.00 0.00 64.21 62.04 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 3.71 1.84 0.29 0.44 -1.09 -1.26 -4.78 121.20 120.35 2rce s ILE 196 Ca 0.91 -0.91 0.02 0.00 -2.23 0.00 0.00 60.65 58.44 2rce s ILE 196 Cb -0.67 -1.59 -0.06 0.00 -1.58 0.00 0.00 42.46 38.57 2rce s ILE 196 CO 0.49 0.51 0.08 0.20 -1.23 0.00 0.00 174.94 175.00 2rce s ASN 197 N 0.25 1.69 -0.13 3.58 0.01 -1.26 -4.95 114.94 114.13 2rce s ASN 197 Ca -0.13 -1.39 -0.36 0.00 -0.71 0.00 0.00 52.86 50.26 2rce s ASN 197 Cb -0.16 0.07 -0.13 0.00 0.41 0.00 0.00 41.25 41.44 2rce s ASN 197 CO 0.06 -0.69 1.79 1.57 -1.51 0.00 0.00 177.10 178.32 2rce n HIS 198 N -0.56 2.19 0.00 2.20 -0.00 -1.26 -0.80 115.22 116.99 2rce n HIS 198 Ca -0.01 0.23 0.00 0.00 -0.00 0.00 0.00 57.72 57.94 2rce n HIS 198 Cb 0.66 -2.57 0.00 0.00 -0.00 0.00 0.00 29.99 28.08 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 4.17 2.12 3.58 1.57 0.00 -1.26 -0.71 105.19 114.66 2rce n GLY 199 Ca 0.23 0.00 -0.40 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 -1.65 6.44 0.00 1.61 -0.87 0.02 -2.87 114.94 117.62 2rce s ASN 200 Ca 0.00 -2.16 0.00 0.00 -1.57 0.00 0.00 52.86 49.13 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 -1.59 0.00 0.61 -2.57 0.00 0.00 177.10 173.55 2rce n GLY 202 N 5.67 0.00 2.39 0.66 0.00 0.74 -4.57 105.19 110.08 2rce n GLY 202 Ca 0.46 0.00 -0.17 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 -0.07 -0.62 3.86 -0.02 0.00 -1.26 -3.37 105.19 103.72 2rce n GLY 203 Ca 0.00 -1.81 -0.36 0.00 0.00 0.00 0.00 46.02 43.86 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 -3.63 3.81 -0.22 4.61 0.00 -0.89 -1.09 121.76 124.35 2rce s ALA 204 Ca 0.45 -0.71 -0.04 0.00 0.00 0.00 0.00 51.96 51.66 2rce s ALA 204 Cb -0.02 -1.86 -0.01 0.00 0.00 0.00 0.00 23.12 21.23 2rce s ALA 204 CO 0.31 0.65 -0.03 -1.17 0.00 0.00 0.00 175.76 175.52 2rce s LEU 205 N -1.29 3.01 0.18 0.00 2.96 -0.00 -0.62 118.68 122.92 2rce s LEU 205 Ca 0.18 -0.33 0.09 0.00 -0.22 0.00 0.00 54.13 53.85 2rce s LEU 205 Cb -0.12 -1.77 -0.04 0.00 0.50 0.00 0.00 46.19 44.76 2rce s LEU 205 CO 0.08 0.00 -0.18 0.68 -1.32 0.00 0.00 176.35 175.61 2rce s VAL 206 N 1.37 1.88 0.48 1.68 -7.23 -0.24 0.45 120.40 118.78 2rce s VAL 206 Ca 0.04 -1.99 -0.06 0.00 -1.81 0.00 0.00 61.98 58.17 2rce s VAL 206 Cb -0.14 -1.91 0.11 0.00 0.56 0.00 0.00 36.38 34.99 2rce s VAL 206 CO -0.01 -0.34 0.65 -0.46 -0.31 0.00 0.00 175.10 174.63 2rce n ASN 207 N 0.15 0.30 0.02 4.85 0.23 -0.58 -0.25 115.26 119.99 2rce n ASN 207 Ca -0.12 -1.39 0.06 0.00 -0.53 0.00 0.00 54.58 52.60 2rce n ASN 207 Cb 0.58 -0.48 0.26 0.00 -2.08 0.00 0.00 39.78 38.06 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 -3.28 0.10 -0.34 0.53 3.41 -1.22 -1.46 113.62 111.37 2rce n SER 208 Ca 0.09 0.53 0.12 0.00 -0.26 0.00 0.00 58.87 59.35 2rce n SER 208 Cb 0.31 -0.55 0.14 0.00 -0.26 0.00 0.00 64.21 63.85 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 -1.62 1.52 0.00 1.04 4.77 -1.26 -3.97 117.00 117.47 2rce n LEU 209 Ca 0.02 -0.52 0.00 0.00 -0.03 0.00 0.00 56.01 55.48 2rce n LEU 209 Cb 0.12 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.15 2rce n LEU 209 CO 0.10 0.29 0.00 0.61 -1.33 0.00 0.00 177.39 177.06 2rce n GLY 210 N 1.40 0.76 3.73 -0.72 0.00 -0.53 -4.71 105.19 105.12 2rce n GLY 210 Ca 0.10 0.00 -0.41 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 -0.35 4.53 0.09 1.61 2.02 -1.26 -4.23 118.70 121.11 2rce s GLU 211 Ca 0.00 1.73 -0.31 0.00 0.02 0.00 0.00 54.97 56.41 2rce s GLU 211 Cb 0.00 -3.31 -0.09 0.00 0.10 0.00 0.00 34.13 30.83 2rce s GLU 211 CO 0.00 -0.06 1.67 -1.17 0.02 0.00 0.00 175.26 175.72 2rce s LEU 212 N 0.22 4.37 -0.21 1.80 2.96 -0.02 -1.52 118.68 126.29 2rce s LEU 212 Ca 0.53 2.56 0.05 0.00 -0.22 0.00 0.00 54.13 57.05 2rce s LEU 212 Cb -0.29 -3.57 -0.16 0.00 0.50 0.00 0.00 46.19 42.67 2rce s LEU 212 CO 0.33 -0.90 -0.13 0.23 -1.32 0.00 0.00 176.35 174.56 2rce n MET 213 N 5.35 0.72 -3.86 1.98 2.81 0.17 -4.76 117.12 119.54 2rce n MET 213 Ca 0.16 0.09 -0.01 0.00 -1.81 0.00 0.00 57.70 56.13 2rce n MET 213 Cb 0.40 -1.44 0.01 0.00 -0.71 0.00 0.00 33.22 31.48 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 -5.85 -0.06 -0.26 3.03 0.00 -0.94 -1.26 107.32 101.99 2rce s GLY 214 Ca -0.24 -0.04 -0.06 0.00 0.00 0.00 0.00 44.72 44.38 2rce s GLY 214 CO 0.55 2.60 0.03 -0.42 0.00 0.00 0.00 173.10 175.87 2rce s ILE 215 N -2.31 3.78 0.18 0.90 -1.09 0.53 -0.82 121.20 122.37 2rce s ILE 215 Ca 0.21 -0.54 -0.31 0.00 -2.23 0.00 0.00 60.65 57.79 2rce s ILE 215 Cb -0.01 -2.84 -0.10 0.00 -1.58 0.00 0.00 42.46 37.93 2rce s ILE 215 CO 0.02 0.25 1.55 0.20 -1.23 0.00 0.00 174.94 175.73 2rce s ASN 216 N 1.51 6.60 0.00 3.58 0.01 -0.25 -0.70 114.94 125.69 2rce s ASN 216 Ca 0.04 2.62 0.00 0.00 -0.71 0.00 0.00 52.86 54.81 2rce s ASN 216 Cb -0.16 -2.60 0.00 0.00 0.41 0.00 0.00 41.25 38.90 2rce s ASN 216 CO 0.00 -0.80 0.00 0.41 -1.51 0.00 0.00 177.10 175.20 2rce n THR 217 N 3.72 0.00 -4.15 1.60 -1.04 -0.55 -0.19 114.28 113.67 2rce n THR 217 Ca 0.13 0.00 -0.15 0.00 -2.04 0.00 0.00 64.05 61.99 2rce n THR 217 Cb 0.39 -0.79 -0.11 0.00 -1.82 0.00 0.00 70.33 67.99 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 -5.14 2.36 -0.06 -4.42 1.43 -1.09 -4.90 118.68 106.86 2rce s LEU 218 Ca 0.00 -0.75 0.02 0.00 -1.03 0.00 0.00 54.13 52.38 2rce s LEU 218 Cb 0.00 -0.30 0.01 0.00 0.03 0.00 0.00 46.19 45.93 2rce s LEU 218 CO 0.00 -0.23 -0.12 -0.55 0.23 0.00 0.00 176.35 175.67 2rce s SER 219 N -2.21 1.77 0.17 2.29 0.15 -1.26 -0.68 113.70 113.92 2rce s SER 219 Ca 0.02 -0.30 -0.34 0.00 0.70 0.00 0.00 55.95 56.03 2rce s SER 219 Cb -0.05 -0.80 -0.14 0.00 -1.71 0.00 0.00 66.02 63.33 2rce s SER 219 CO 0.00 0.04 1.57 0.33 1.20 0.00 0.00 173.24 176.39 2rce n PHE 220 N 3.76 2.28 -3.79 3.44 7.35 -0.74 -5.01 117.46 124.75 2rce n PHE 220 Ca -0.22 0.27 -0.29 0.00 -0.76 0.00 0.00 57.45 56.44 2rce n PHE 220 Cb 0.52 -2.54 -0.16 0.00 0.35 0.00 0.00 39.48 37.65 2rce n PHE 220 CO 0.00 0.00 0.00 0.16 -0.76 0.00 0.00 176.76 176.16 2rce s ASP 221 N 0.88 3.64 0.00 -2.13 3.84 -1.26 -4.74 116.67 116.90 2rce s ASP 221 Ca 0.78 -1.27 0.00 0.00 -0.00 0.00 0.00 52.55 52.06 2rce s ASP 221 Cb -0.67 -0.87 0.00 0.00 -1.38 0.00 0.00 42.92 39.99 2rce s ASP 221 CO 0.38 -0.34 0.00 -1.84 -0.00 0.00 0.00 175.17 173.38 2rce n GLU 227 N 4.85 0.00 -2.64 2.11 0.00 -1.26 -4.84 120.64 118.87 2rce n GLU 227 Ca -0.06 0.00 -0.43 0.00 0.00 0.00 0.00 57.16 56.67 2rce n GLU 227 Cb 0.44 0.00 -0.02 0.00 0.00 0.00 0.00 31.44 31.86 2rce n GLU 227 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.13 178.12 2rce s THR 228 N -1.08 4.32 0.41 3.84 2.01 -1.26 -5.02 115.64 118.85 2rce s THR 228 Ca 0.00 1.32 -0.25 0.00 0.31 0.00 0.00 61.69 63.07 2rce s THR 228 Cb 0.00 -4.53 -0.08 0.00 0.01 0.00 0.00 72.50 67.89 2rce s THR 228 CO 0.00 -0.85 1.23 -2.84 -0.69 0.00 0.00 174.62 171.48 2rce s PRO 229 N 4.16 3.96 -0.06 4.92 0.02 -1.26 -5.03 135.00 141.71 2rce s PRO 229 Ca 0.46 1.98 0.03 0.00 0.02 0.00 0.00 61.00 63.49 2rce s PRO 229 Cb -0.09 -2.67 0.01 0.00 0.02 0.00 0.00 34.50 31.76 2rce s PRO 229 CO 0.27 -0.44 -0.14 -2.00 -0.33 0.00 0.00 177.00 174.35 2rce s GLU 230 N -2.32 1.74 -0.96 5.54 2.12 -1.26 -4.80 118.70 118.76 2rce s GLU 230 Ca 0.58 -0.48 -0.01 0.00 0.36 0.00 0.00 54.97 55.42 2rce s GLU 230 Cb -0.34 -1.46 0.00 0.00 0.26 0.00 0.00 34.13 32.60 2rce s GLU 230 CO 0.43 0.10 0.13 0.41 -0.54 0.00 0.00 175.26 175.79 2rce n GLY 231 N 3.57 -0.07 3.05 -1.50 0.00 -1.26 -5.01 105.19 103.97 2rce n GLY 231 Ca -0.21 -0.34 -0.32 0.00 0.00 0.00 0.00 46.02 45.15 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 -2.71 2.20 0.05 -0.61 1.01 -1.26 -3.74 121.20 116.14 2rce s ILE 232 Ca 0.06 -1.86 0.00 0.00 0.00 0.00 0.00 60.65 58.85 2rce s ILE 232 Cb -0.03 -2.41 -0.03 0.00 0.01 0.00 0.00 42.46 40.00 2rce s ILE 232 CO 0.08 -0.21 -0.04 -0.83 0.00 0.00 0.00 174.94 173.94 2rce s GLY 233 N 1.04 0.47 0.02 6.18 0.00 -0.15 -1.79 107.32 113.09 2rce s GLY 233 Ca -0.03 -1.03 0.05 0.00 0.00 0.00 0.00 44.72 43.71 2rce s GLY 233 CO -0.06 -1.12 -0.14 -1.36 0.00 0.00 0.00 173.10 170.42 2rce s PHE 234 N -2.98 1.21 0.02 1.90 0.08 0.14 -0.37 117.98 117.97 2rce s PHE 234 Ca 0.00 -0.30 0.03 0.00 0.12 0.00 0.00 56.93 56.78 2rce s PHE 234 Cb 0.01 -0.74 -0.02 0.00 -0.57 0.00 0.00 43.02 41.70 2rce s PHE 234 CO -0.06 0.01 -0.09 0.00 -0.10 0.00 0.00 175.22 174.98 2rce s ALA 235 N -0.64 0.75 -0.03 5.36 0.00 0.38 -1.48 121.76 126.10 2rce s ALA 235 Ca 0.03 -0.58 -0.30 0.00 0.00 0.00 0.00 51.96 51.11 2rce s ALA 235 Cb -0.07 -0.10 -0.04 0.00 0.00 0.00 0.00 23.12 22.91 2rce s ALA 235 CO 0.01 0.12 1.27 0.42 0.00 0.00 0.00 175.76 177.58 2rce s ILE 236 N -0.70 4.06 0.44 0.00 -1.09 0.12 -0.99 121.20 123.03 2rce s ILE 236 Ca -0.01 1.40 -0.25 0.00 -2.23 0.00 0.00 60.65 59.56 2rce s ILE 236 Cb -0.06 -3.90 -0.08 0.00 -1.58 0.00 0.00 42.46 36.84 2rce s ILE 236 CO 0.00 -0.00 1.36 -2.16 -1.23 0.00 0.00 174.94 172.92 2rce s PRO 237 N 2.27 3.73 0.45 2.79 0.04 -1.26 -0.35 135.00 142.68 2rce s PRO 237 Ca 0.59 2.28 0.11 0.00 0.04 0.00 0.00 61.00 64.02 2rce s PRO 237 Cb -0.27 -2.64 1.03 0.00 0.04 0.00 0.00 34.50 32.66 2rce s PRO 237 CO 0.24 -0.73 2.08 0.27 0.04 0.00 0.00 177.00 178.90 2rce h PHE 238 N 2.35 0.32 -0.81 0.56 -5.15 -1.48 -2.12 116.94 110.60 2rce h PHE 238 Ca -0.50 0.01 -0.03 0.00 -0.20 0.00 0.00 57.97 57.24 2rce h PHE 238 Cb 1.26 -0.11 -0.04 0.00 0.22 0.00 0.00 35.95 37.29 2rce h PHE 238 CO 0.51 0.19 0.39 1.96 -2.00 0.00 0.00 178.31 179.36 2rce h GLN 239 N 0.33 1.17 -0.09 6.09 7.50 -1.90 0.12 115.11 128.33 2rce h GLN 239 Ca 0.11 -0.17 -0.15 0.00 0.50 0.00 0.00 58.65 58.94 2rce h GLN 239 Cb 0.05 -0.21 0.01 0.00 0.05 0.00 0.00 27.48 27.38 2rce h GLN 239 CO -0.02 0.90 -0.53 1.25 -1.50 0.00 0.00 178.83 178.93 2rce h LEU 240 N 1.15 0.62 -0.58 1.46 5.85 -1.78 -2.32 115.31 119.70 2rce h LEU 240 Ca 0.28 -0.66 0.03 0.00 0.84 0.00 0.00 57.88 58.37 2rce h LEU 240 Cb 0.12 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 40.93 2rce h LEU 240 CO -0.03 1.18 0.35 0.00 -0.34 0.00 0.00 178.44 179.59 2rce h ALA 241 N 0.45 0.75 0.05 1.25 0.00 -1.16 0.93 119.26 121.54 2rce h ALA 241 Ca -0.04 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.88 2rce h ALA 241 Cb 1.18 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.76 2rce h ALA 241 CO 0.11 0.08 -0.20 1.15 0.00 0.00 0.00 179.25 180.39 2rce h THR 242 N 0.69 0.53 -0.33 0.00 2.02 -0.80 0.01 112.91 115.03 2rce h THR 242 Ca 0.23 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.43 2rce h THR 242 Cb 0.02 0.53 -0.03 0.00 -1.74 0.00 0.00 68.15 66.94 2rce h THR 242 CO -0.10 0.00 0.17 0.50 0.37 0.00 0.00 175.52 176.46 2rce h LYS 243 N -0.35 0.34 -0.59 6.66 3.64 -1.10 -2.16 116.57 123.01 2rce h LYS 243 Ca 0.04 -0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.37 2rce h LYS 243 Cb 0.40 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 32.12 2rce h LYS 243 CO -0.15 0.23 0.25 0.82 -2.27 0.00 0.00 179.45 178.32 2rce h ILE 244 N 0.35 1.22 -0.15 2.00 1.08 -0.69 -2.36 117.51 118.97 2rce h ILE 244 Ca 0.14 -0.68 0.02 0.00 -0.39 0.00 0.00 64.86 63.95 2rce h ILE 244 Cb 0.04 0.57 -0.02 0.00 -3.07 0.00 0.00 36.82 34.34 2rce h ILE 244 CO -0.09 0.27 0.01 -0.03 -0.69 0.00 0.00 178.15 177.62 2rce h MET 245 N 0.81 0.06 -0.88 2.37 4.05 -0.79 -1.46 114.93 119.09 2rce h MET 245 Ca 0.20 -0.00 0.07 0.00 -0.28 0.00 0.00 59.70 59.69 2rce h MET 245 Cb 0.18 -0.01 -0.07 0.00 -0.80 0.00 0.00 31.60 30.90 2rce h MET 245 CO -0.02 0.04 0.54 -0.44 0.23 0.00 0.00 176.91 177.26 2rce h ASP 246 N 0.06 0.84 -0.62 1.39 3.32 -1.27 0.12 116.42 120.26 2rce h ASP 246 Ca 0.07 0.03 -0.03 0.00 0.02 0.00 0.00 57.03 57.11 2rce h ASP 246 Cb 0.08 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 39.45 2rce h ASP 246 CO -0.11 0.52 0.27 0.50 -1.72 0.00 0.00 179.24 178.70 2rce h LYS 247 N 0.96 0.91 -0.18 3.56 3.11 -1.16 -2.44 116.57 121.33 2rce h LYS 247 Ca 0.40 -0.15 -0.21 0.00 -2.81 0.00 0.00 60.65 57.87 2rce h LYS 247 Cb 0.24 -0.16 0.01 0.00 -1.00 0.00 0.00 32.23 31.32 2rce h LYS 247 CO -0.20 0.76 -0.73 -0.07 -2.81 0.00 0.00 179.45 176.41 2rce h LEU 248 N 0.86 0.94 -0.15 5.20 3.38 -0.48 -2.10 115.31 122.96 2rce h LEU 248 Ca 0.21 -0.59 0.04 0.00 0.09 0.00 0.00 57.88 57.63 2rce h LEU 248 Cb 0.17 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.61 2rce h LEU 248 CO -0.02 1.39 -0.08 0.40 0.09 0.00 0.00 178.44 180.22 2rce h ILE 249 N 0.56 0.75 -0.18 1.22 2.04 -0.74 -1.87 117.51 119.29 2rce h ILE 249 Ca -0.04 0.00 -0.15 0.00 1.00 0.00 0.00 64.86 65.67 2rce h ILE 249 Cb 1.35 0.75 0.00 0.00 -0.74 0.00 0.00 36.82 38.18 2rce h ILE 249 CO 0.15 0.00 -0.49 0.08 0.00 0.00 0.00 178.15 177.89 2rce h ARG 250 N -0.07 0.65 0.00 2.37 0.11 -1.47 -3.12 114.38 112.86 2rce h ARG 250 Ca 0.09 -0.46 0.00 0.00 0.10 0.00 0.00 59.98 59.71 2rce h ARG 250 Cb 0.19 0.07 0.00 0.00 1.11 0.00 0.00 29.97 31.34 2rce h ARG 250 CO -0.19 1.08 0.00 -0.25 0.10 0.00 0.00 179.97 180.71 2rce n ASP 251 N -4.17 0.00 0.00 0.08 8.00 -0.79 -5.12 116.55 114.54 2rce n ASP 251 Ca -0.06 -0.76 0.15 0.00 0.71 0.00 0.00 54.79 54.83 2rce n ASP 251 Cb 0.59 -0.04 0.88 0.00 -0.02 0.00 0.00 41.12 42.52 2rce n ASP 251 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42