#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kbx n ASP 2 N 0.00 0.00 0.00 6.12 5.75 -1.26 -4.54 116.55 122.62 2kbx n ASP 2 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.78 2kbx n ASP 2 Cb 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.09 2kbx n ASP 2 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 2kbx n ASP 3 N 0.00 0.00 -0.20 -1.12 8.00 -1.26 -1.28 116.55 120.69 2kbx n ASP 3 Ca 0.00 0.00 -0.06 0.00 0.71 0.00 0.00 54.79 55.44 2kbx n ASP 3 Cb 0.00 0.00 0.04 0.00 -0.02 0.00 0.00 41.12 41.14 2kbx n ASP 3 CO 0.00 0.00 0.00 -0.29 -0.39 0.00 0.00 177.20 176.52 2kbx h ILE 4 N 0.00 1.13 -0.79 0.53 2.10 -1.95 0.65 117.51 119.19 2kbx h ILE 4 Ca 0.00 -0.26 0.18 0.00 1.08 0.00 0.00 64.86 65.86 2kbx h ILE 4 Cb 0.00 0.30 -0.12 0.00 -1.09 0.00 0.00 36.82 35.91 2kbx h ILE 4 CO 0.00 0.14 0.22 -0.26 -1.08 0.00 0.00 178.15 177.17 2kbx h PHE 5 N 0.76 0.35 0.20 2.19 0.04 -1.43 1.54 116.94 120.58 2kbx h PHE 5 Ca 0.22 0.04 -0.01 0.00 2.80 0.00 0.00 57.97 61.02 2kbx h PHE 5 Cb -0.06 -0.03 0.00 0.00 2.20 0.00 0.00 35.95 38.06 2kbx h PHE 5 CO -0.04 -0.09 -0.09 1.15 -0.60 0.00 0.00 178.31 178.64 2kbx h THR 6 N 0.29 0.56 0.00 -1.55 2.02 -1.08 -2.86 112.91 110.28 2kbx h THR 6 Ca 0.46 -1.04 0.00 0.00 0.77 0.00 0.00 66.41 66.60 2kbx h THR 6 Cb 0.81 0.96 0.00 0.00 -1.74 0.00 0.00 68.15 68.18 2kbx h THR 6 CO -0.53 0.15 0.03 1.67 0.37 0.00 0.00 175.52 177.21 2kbx n GLN 7 N -4.94 0.00 -0.06 6.66 7.27 0.16 -1.68 117.38 124.78 2kbx n GLN 7 Ca -0.07 0.38 -0.03 0.00 0.07 0.00 0.00 57.00 57.35 2kbx n GLN 7 Cb 0.23 -1.53 -0.01 0.00 2.41 0.00 0.00 30.24 31.34 2kbx n GLN 7 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2kbx n ARG 9 N -4.47 0.05 0.00 0.00 -4.01 -1.06 -2.07 116.66 105.11 2kbx n ARG 9 Ca -0.05 0.44 0.00 0.00 -1.04 0.00 0.00 57.85 57.20 2kbx n ARG 9 Cb 0.17 -1.64 0.00 0.00 -3.04 0.00 0.00 32.46 27.96 2kbx n ARG 9 CO 0.00 0.00 0.00 0.39 -3.04 0.00 0.00 177.63 174.98 2kbx n GLU 10 N -1.75 0.00 -0.05 2.89 -0.58 -0.68 -4.60 120.64 115.87 2kbx n GLU 10 Ca 0.01 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.76 2kbx n GLU 10 Cb 0.09 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.46 2kbx n GLU 10 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2kbx n GLY 11 N -0.99 0.78 2.47 0.62 0.00 -0.88 -4.94 105.19 102.25 2kbx n GLY 11 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.84 2kbx n GLY 11 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2kbx n ASN 12 N 0.00 4.52 0.33 1.61 3.02 -0.94 -4.56 115.26 119.24 2kbx n ASN 12 Ca 0.00 -2.25 0.01 0.00 -0.03 0.00 0.00 54.58 52.31 2kbx n ASN 12 Cb 0.00 -1.03 0.08 0.00 -0.61 0.00 0.00 39.78 38.21 2kbx n ASN 12 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2kbx h ALA 13 N 5.60 1.93 -0.00 5.41 0.00 -1.92 3.30 119.26 133.58 2kbx h ALA 13 Ca 0.39 0.00 -0.17 0.00 0.00 0.00 0.00 54.91 55.13 2kbx h ALA 13 Cb 0.40 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 2kbx h ALA 13 CO 1.11 -0.93 -0.79 -0.24 0.00 0.00 0.00 179.25 178.40 2kbx h VAL 14 N 0.00 1.54 -0.13 0.00 3.04 -1.93 -1.05 116.25 117.71 2kbx h VAL 14 Ca 0.00 -2.64 -0.15 0.00 -1.01 0.00 0.00 66.70 62.90 2kbx h VAL 14 Cb 1.86 2.43 0.01 0.00 -2.01 0.00 0.00 31.29 33.58 2kbx h VAL 14 CO 0.00 0.76 -0.51 0.00 -1.01 0.00 0.00 177.57 176.81 2kbx h ALA 15 N 1.18 0.24 -0.01 3.17 0.00 0.58 0.28 119.26 124.69 2kbx h ALA 15 Ca -0.01 -0.50 -0.17 0.00 0.00 0.00 0.00 54.91 54.23 2kbx h ALA 15 Cb 1.39 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.14 2kbx h ALA 15 CO 0.11 0.42 -0.76 -0.24 0.00 0.00 0.00 179.25 178.77 2kbx h VAL 16 N 0.21 1.50 -0.41 0.00 3.04 -1.55 -2.67 116.25 116.36 2kbx h VAL 16 Ca -0.03 -2.48 -0.10 0.00 -1.01 0.00 0.00 66.70 63.08 2kbx h VAL 16 Cb 1.14 2.34 -0.01 0.00 -2.01 0.00 0.00 31.29 32.75 2kbx h VAL 16 CO 0.11 0.72 -0.14 -0.09 -1.01 0.00 0.00 177.57 177.15 2kbx h ARG 17 N 0.06 0.83 -1.01 4.17 2.43 -1.13 -1.43 114.38 118.29 2kbx h ARG 17 Ca -0.02 -0.34 0.25 0.00 -0.81 0.00 0.00 59.98 59.07 2kbx h ARG 17 Cb 1.34 -0.04 -0.12 0.00 -0.42 0.00 0.00 29.97 30.73 2kbx h ARG 17 CO 0.11 0.97 0.60 1.25 -1.51 0.00 0.00 179.97 181.38 2kbx h LEU 18 N 0.64 0.65 -1.24 3.80 5.85 -0.17 1.54 115.31 126.39 2kbx h LEU 18 Ca 0.10 0.14 -0.07 0.00 0.84 0.00 0.00 57.88 58.89 2kbx h LEU 18 Cb 0.69 0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.74 2kbx h LEU 18 CO 0.05 0.09 -0.18 -0.50 -0.34 0.00 0.00 178.44 177.56 2kbx h TRP 19 N 0.56 0.33 -0.52 1.25 6.55 -0.95 -2.69 115.95 120.47 2kbx h TRP 19 Ca 0.65 -0.05 -0.05 0.00 0.95 0.00 0.00 58.89 60.39 2kbx h TRP 19 Cb 1.27 -0.09 -0.02 0.00 -0.86 0.00 0.00 29.16 29.46 2kbx h TRP 19 CO -0.01 0.48 0.12 -0.07 -1.05 0.00 0.00 178.44 177.91 2kbx h LEU 20 N 0.28 0.79 -4.09 -4.49 3.38 0.26 -2.91 115.31 108.54 2kbx h LEU 20 Ca 0.05 -0.24 -0.64 0.00 0.09 0.00 0.00 57.88 57.15 2kbx h LEU 20 Cb 0.48 -0.21 -0.26 0.00 0.09 0.00 0.00 40.66 40.76 2kbx h LEU 20 CO 0.03 0.82 0.83 -0.67 0.09 0.00 0.00 178.44 179.55 2kbx n ASP 21 N -4.43 7.49 -4.75 -0.43 2.03 -0.75 -4.94 116.55 110.76 2kbx n ASP 21 Ca 0.02 -3.68 -0.36 0.00 0.52 0.00 0.00 54.79 51.29 2kbx n ASP 21 Cb 0.23 -1.01 -0.07 0.00 -0.72 0.00 0.00 41.12 39.55 2kbx n ASP 21 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 2kbx s ASN 22 N -1.39 6.34 0.00 1.67 6.03 -1.10 -4.95 114.94 121.54 2kbx s ASN 22 Ca 0.58 0.39 0.22 0.00 -1.03 0.00 0.00 52.86 53.03 2kbx s ASN 22 Cb 0.46 -2.13 1.32 0.00 -3.03 0.00 0.00 41.25 37.88 2kbx s ASN 22 CO -0.07 0.19 1.85 0.35 -2.03 0.00 0.00 177.10 177.39 2kbx n THR 23 N 3.27 0.00 -0.12 0.54 -2.24 -1.26 -3.40 114.28 111.07 2kbx n THR 23 Ca -0.15 -0.00 -0.14 0.00 -2.27 0.00 0.00 64.05 61.48 2kbx n THR 23 Cb 0.52 -0.34 -0.14 0.00 -2.10 0.00 0.00 70.33 68.27 2kbx n THR 23 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 2kbx n GLU 24 N -0.84 0.67 -3.27 -0.78 0.28 -1.26 -5.04 120.64 110.40 2kbx n GLU 24 Ca 0.17 0.08 -0.10 0.00 -0.16 0.00 0.00 57.16 57.14 2kbx n GLU 24 Cb 0.08 -1.52 0.00 0.00 1.43 0.00 0.00 31.44 31.43 2kbx n GLU 24 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 2kbx n ASN 25 N -3.04 -6.86 0.00 -1.84 5.03 -1.22 -4.91 115.26 102.43 2kbx n ASN 25 Ca -0.40 -0.25 0.00 0.00 0.87 0.00 0.00 54.58 54.80 2kbx n ASN 25 Cb 1.06 -4.08 0.00 0.00 -1.02 0.00 0.00 39.78 35.74 2kbx n ASN 25 CO 0.00 0.00 0.00 0.47 -1.83 0.00 0.00 177.26 175.90 2kbx n ASP 26 N -1.73 0.00 0.11 6.41 8.00 -1.26 -4.82 116.55 123.27 2kbx n ASP 26 Ca -0.08 0.00 0.04 0.00 0.71 0.00 0.00 54.79 55.46 2kbx n ASP 26 Cb 0.56 0.00 0.22 0.00 -0.02 0.00 0.00 41.12 41.88 2kbx n ASP 26 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 2kbx n LEU 27 N -1.11 0.21 -0.81 0.64 -0.00 -1.26 -0.86 117.00 113.81 2kbx n LEU 27 Ca 0.00 0.45 0.00 0.00 -0.00 0.00 0.00 56.01 56.46 2kbx n LEU 27 Cb 0.00 -0.40 0.00 0.00 -0.00 0.00 0.00 43.42 43.02 2kbx n LEU 27 CO 0.00 -0.52 0.27 -3.20 -0.00 0.00 0.00 177.39 173.95 2kbx n ASN 28 N -1.78 1.51 -4.80 1.96 2.85 -1.26 -4.82 115.26 108.93 2kbx n ASN 28 Ca -0.01 -1.36 -0.35 0.00 -0.11 0.00 0.00 54.58 52.76 2kbx n ASN 28 Cb 0.31 -0.34 -0.06 0.00 1.24 0.00 0.00 39.78 40.93 2kbx n ASN 28 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2kbx s GLN 29 N -0.19 4.34 0.00 1.20 -2.07 -0.04 -4.61 119.66 118.29 2kbx s GLN 29 Ca 0.00 1.25 0.00 0.00 -1.82 0.00 0.00 55.36 54.79 2kbx s GLN 29 Cb 0.00 -2.45 0.00 0.00 -1.09 0.00 0.00 33.01 29.47 2kbx s GLN 29 CO 0.00 0.06 0.00 0.41 -1.32 0.00 0.00 175.29 174.44 2kbx n GLY 30 N -0.06 0.91 3.37 2.60 0.00 -1.26 -4.46 105.19 106.29 2kbx n GLY 30 Ca 0.05 -0.48 -0.22 0.00 0.00 0.00 0.00 46.02 45.38 2kbx n GLY 30 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2kbx s ASP 31 N -1.00 2.07 0.33 1.61 1.11 0.52 -4.87 116.67 116.43 2kbx s ASP 31 Ca 0.00 -1.74 0.07 0.00 0.18 0.00 0.00 52.55 51.06 2kbx s ASP 31 Cb 0.00 0.56 0.57 0.00 1.07 0.00 0.00 42.92 45.12 2kbx s ASP 31 CO 0.00 -1.03 1.79 -0.78 1.18 0.00 0.00 175.17 176.33 2kbx h ASP 32 N 2.01 0.28 0.40 0.27 3.58 -2.00 -1.72 116.42 119.23 2kbx h ASP 32 Ca -0.28 -0.09 0.00 0.00 0.42 0.00 0.00 57.03 57.08 2kbx h ASP 32 Cb 1.25 -0.07 0.00 0.00 1.72 0.00 0.00 39.33 42.22 2kbx h ASP 32 CO 0.43 0.55 0.00 1.41 -2.88 0.00 0.00 179.24 178.76 2kbx n HIS 33 N -4.13 0.00 -0.18 0.28 8.25 -1.26 -4.85 115.22 113.33 2kbx n HIS 33 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.45 2kbx n HIS 33 Cb 0.39 -0.23 0.00 0.00 1.12 0.00 0.00 29.99 31.27 2kbx n HIS 33 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2kbx n GLY 34 N 0.91 0.91 3.64 -1.41 0.00 -0.64 -3.88 105.19 104.73 2kbx n GLY 34 Ca 0.14 -0.02 -0.43 0.00 0.00 0.00 0.00 46.02 45.71 2kbx n GLY 34 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2kbx s PHE 35 N -2.00 2.14 0.58 1.61 0.08 -1.26 -4.67 117.98 114.46 2kbx s PHE 35 Ca 0.00 0.47 0.01 0.00 0.12 0.00 0.00 56.93 57.53 2kbx s PHE 35 Cb 0.00 -3.90 0.05 0.00 -0.57 0.00 0.00 43.02 38.60 2kbx s PHE 35 CO 0.00 -3.13 0.81 -1.12 -0.10 0.00 0.00 175.22 171.68 2kbx s SER 36 N 3.65 5.13 0.07 1.36 0.01 -1.26 -0.35 113.70 122.31 2kbx s SER 36 Ca 0.70 -0.07 -0.28 0.00 1.31 0.00 0.00 55.95 57.61 2kbx s SER 36 Cb -0.28 -0.73 -0.17 0.00 0.21 0.00 0.00 66.02 65.05 2kbx s SER 36 CO 0.27 -1.26 1.62 1.55 0.41 0.00 0.00 173.24 175.84 2kbx h PRO 37 N -0.03 -0.44 -1.00 12.44 0.13 -1.81 -1.73 132.00 139.56 2kbx h PRO 37 Ca -0.41 0.03 0.19 0.00 -0.87 0.00 0.00 66.00 64.94 2kbx h PRO 37 Cb 1.29 0.10 -0.11 0.00 0.13 0.00 0.00 31.00 32.42 2kbx h PRO 37 CO 0.50 -0.26 0.61 1.25 -0.23 0.00 0.00 178.00 179.88 2kbx h LEU 38 N -0.50 0.79 0.34 1.56 6.46 -1.95 0.11 115.31 122.12 2kbx h LEU 38 Ca -0.05 0.10 -0.01 0.00 -0.12 0.00 0.00 57.88 57.80 2kbx h LEU 38 Cb 0.38 -0.05 -0.03 0.00 -0.73 0.00 0.00 40.66 40.23 2kbx h LEU 38 CO 0.08 0.28 -0.47 0.45 -0.62 0.00 0.00 178.44 178.16 2kbx h HIS 39 N 0.77 -1.31 -0.32 1.25 3.86 -1.68 0.17 115.15 117.89 2kbx h HIS 39 Ca 0.58 0.02 0.03 0.00 -1.16 0.00 0.00 60.37 59.83 2kbx h HIS 39 Cb 0.90 0.53 -0.03 0.00 1.06 0.00 0.00 27.41 29.86 2kbx h HIS 39 CO -0.00 -0.59 0.14 -1.49 0.86 0.00 0.00 177.93 176.84 2kbx h TRP 40 N -0.84 0.25 0.02 2.45 4.06 -0.54 -2.36 115.95 119.00 2kbx h TRP 40 Ca -0.04 0.01 0.03 0.00 2.06 0.00 0.00 58.89 60.95 2kbx h TRP 40 Cb 0.76 -0.07 -0.04 0.00 -1.00 0.00 0.00 29.16 28.81 2kbx h TRP 40 CO -0.30 0.13 -0.25 0.00 -3.56 0.00 0.00 178.44 174.45 2kbx h ALA 41 N 1.18 -0.36 -0.66 1.49 0.00 -0.69 -0.04 119.26 120.18 2kbx h ALA 41 Ca 0.14 -0.01 0.15 0.00 0.00 0.00 0.00 54.91 55.18 2kbx h ALA 41 Cb 0.08 0.44 -0.04 0.00 0.00 0.00 0.00 17.79 18.27 2kbx h ALA 41 CO -0.12 -0.76 0.46 0.00 0.00 0.00 0.00 179.25 178.83 2kbx h ARG 43 N 0.26 0.43 0.48 0.00 9.65 -0.59 -3.36 114.38 121.25 2kbx h ARG 43 Ca 0.32 -0.29 -0.02 0.00 -1.10 0.00 0.00 59.98 58.89 2kbx h ARG 43 Cb 0.90 0.04 0.00 0.00 -1.39 0.00 0.00 29.97 29.53 2kbx h ARG 43 CO -0.07 0.90 -0.23 0.93 2.80 0.00 0.00 179.97 184.30 2kbx h GLU 44 N 0.02 -0.61 0.00 0.20 5.08 0.15 -3.49 114.58 115.94 2kbx h GLU 44 Ca -0.00 0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 2kbx h GLU 44 Cb 0.90 0.14 0.00 0.00 0.50 0.00 0.00 28.75 30.29 2kbx h GLU 44 CO 0.07 -0.41 0.00 0.41 -1.00 0.00 0.00 179.01 178.08 2kbx n GLY 45 N -0.05 1.14 2.65 -3.84 0.00 -0.10 -5.01 105.19 99.98 2kbx n GLY 45 Ca -0.08 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.80 2kbx n GLY 45 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kbx n ARG 46 N 0.00 1.41 -0.29 1.61 1.74 -1.25 -4.65 116.66 115.23 2kbx n ARG 46 Ca 0.00 -1.07 0.28 0.00 -0.77 0.00 0.00 57.85 56.28 2kbx n ARG 46 Cb 0.00 -2.23 0.50 0.00 -1.02 0.00 0.00 32.46 29.71 2kbx n ARG 46 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 2kbx n SER 47 N 4.17 0.26 0.00 0.55 3.41 -1.26 -2.25 113.62 118.50 2kbx n SER 47 Ca 0.30 1.31 0.00 0.00 -0.26 0.00 0.00 58.87 60.22 2kbx n SER 47 Cb 0.14 -0.64 0.00 0.00 -0.26 0.00 0.00 64.21 63.45 2kbx n SER 47 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2kbx n ALA 48 N -2.43 0.00 -0.33 7.33 0.00 -1.26 -0.14 120.51 123.68 2kbx n ALA 48 Ca 0.32 0.00 0.24 0.00 0.00 0.00 0.00 53.44 54.00 2kbx n ALA 48 Cb 1.11 0.05 0.46 0.00 0.00 0.00 0.00 19.45 21.08 2kbx n ALA 48 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.50 177.11 2kbx h VAL 49 N 0.00 0.04 -0.43 0.00 -1.51 -1.86 0.20 116.25 112.68 2kbx h VAL 49 Ca 0.00 -0.01 -0.06 0.00 -1.23 0.00 0.00 66.70 65.40 2kbx h VAL 49 Cb 0.00 0.00 -0.02 0.00 -2.13 0.00 0.00 31.29 29.15 2kbx h VAL 49 CO 0.00 0.01 0.05 1.62 -1.23 0.00 0.00 177.57 178.01 2kbx h VAL 50 N 0.03 1.25 -0.22 7.19 3.04 -1.33 -1.86 116.25 124.35 2kbx h VAL 50 Ca 0.74 -0.94 0.06 0.00 -1.01 0.00 0.00 66.70 65.55 2kbx h VAL 50 Cb 1.79 1.02 -0.06 0.00 -2.01 0.00 0.00 31.29 32.03 2kbx h VAL 50 CO -0.81 0.32 -0.17 -0.08 -1.01 0.00 0.00 177.57 175.82 2kbx h GLU 51 N 0.58 -0.17 0.00 4.17 4.22 0.27 1.56 114.58 125.22 2kbx h GLU 51 Ca 0.13 0.01 -0.04 0.00 0.08 0.00 0.00 59.36 59.54 2kbx h GLU 51 Cb 0.42 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.70 2kbx h GLU 51 CO 0.01 -0.11 -0.18 0.52 -2.18 0.00 0.00 179.01 177.07 2kbx h MET 52 N -0.17 0.00 0.12 1.92 0.00 -1.40 -2.89 114.93 112.52 2kbx h MET 52 Ca 0.13 0.00 -0.22 0.00 0.00 0.00 0.00 59.70 59.61 2kbx h MET 52 Cb 0.37 0.00 0.01 0.00 0.00 0.00 0.00 31.60 31.98 2kbx h MET 52 CO -0.33 0.18 -1.05 1.25 0.00 0.00 0.00 176.91 176.97 2kbx h LEU 53 N 0.00 0.41 -1.47 1.22 5.85 -0.06 -3.14 115.31 118.11 2kbx h LEU 53 Ca -0.00 -0.90 0.39 0.00 0.84 0.00 0.00 57.88 58.21 2kbx h LEU 53 Cb 0.45 -0.13 -0.11 0.00 0.37 0.00 0.00 40.66 41.23 2kbx h LEU 53 CO 0.02 1.48 0.84 0.40 -0.34 0.00 0.00 178.44 180.84 2kbx h ILE 54 N -0.38 0.24 0.00 4.05 1.08 0.24 1.96 117.51 124.69 2kbx h ILE 54 Ca -0.21 -0.05 0.00 0.00 -0.39 0.00 0.00 64.86 64.21 2kbx h ILE 54 Cb 1.67 0.07 0.00 0.00 -3.07 0.00 0.00 36.82 35.49 2kbx h ILE 54 CO 0.10 0.03 -0.65 1.15 -0.69 0.00 0.00 178.15 178.09 2kbx n MET 55 N -4.60 0.19 0.18 2.37 0.00 -1.21 -3.81 117.12 110.25 2kbx n MET 55 Ca 0.34 0.04 0.13 0.00 0.00 0.00 0.00 57.70 58.21 2kbx n MET 55 Cb 1.31 -1.61 0.42 0.00 0.00 0.00 0.00 33.22 33.35 2kbx n MET 55 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 175.97 175.88 2kbx h ARG 56 N 0.00 0.00 0.00 3.17 2.43 0.32 -3.45 114.38 116.85 2kbx h ARG 56 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2kbx h ARG 56 Cb 0.66 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.21 2kbx h ARG 56 CO 0.00 0.00 0.00 0.41 -1.51 0.00 0.00 179.97 178.87 2kbx n GLY 57 N 0.68 1.74 3.32 2.80 0.00 -1.08 -5.10 105.19 107.55 2kbx n GLY 57 Ca 0.03 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.73 2kbx n GLY 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kbx n ALA 58 N 0.00 -3.85 -2.93 4.61 0.00 -1.18 -4.93 120.51 112.23 2kbx n ALA 58 Ca 0.00 -1.21 -0.44 0.00 0.00 0.00 0.00 53.44 51.78 2kbx n ALA 58 Cb 0.00 -1.61 -0.08 0.00 0.00 0.00 0.00 19.45 17.76 2kbx n ALA 58 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2kbx s ARG 59 N -3.59 2.94 0.00 0.00 0.52 -1.26 -4.90 118.95 112.66 2kbx s ARG 59 Ca 0.58 -1.38 0.26 0.00 -0.52 0.00 0.00 55.73 54.67 2kbx s ARG 59 Cb -0.14 -4.10 0.68 0.00 0.52 0.00 0.00 34.95 31.91 2kbx s ARG 59 CO 0.66 -1.03 1.53 -0.89 0.02 0.00 0.00 175.30 175.59 2kbx n ILE 60 N 5.17 0.00 0.14 1.52 5.41 -1.26 -4.07 119.36 126.28 2kbx n ILE 60 Ca -0.12 -0.30 0.02 0.00 1.00 0.00 0.00 62.75 63.35 2kbx n ILE 60 Cb 0.43 0.81 -0.02 0.00 -0.71 0.00 0.00 39.64 40.16 2kbx n ILE 60 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 176.55 176.09 2kbx n ASN 61 N 0.33 0.48 -4.52 4.38 0.23 -1.26 -4.78 115.26 110.12 2kbx n ASN 61 Ca 0.16 -0.53 -0.35 0.00 -0.53 0.00 0.00 54.58 53.33 2kbx n ASN 61 Cb 0.43 1.01 0.10 0.00 -2.08 0.00 0.00 39.78 39.24 2kbx n ASN 61 CO 0.00 0.00 0.00 0.55 -0.93 0.00 0.00 177.26 176.88 2kbx n VAL 62 N -1.12 1.48 -3.95 3.53 3.14 -1.26 -4.96 118.33 115.19 2kbx n VAL 62 Ca 0.01 -0.30 -0.10 0.00 -2.96 0.00 0.00 64.34 60.99 2kbx n VAL 62 Cb 0.05 -0.85 -0.11 0.00 -1.06 0.00 0.00 33.84 31.87 2kbx n VAL 62 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2kbx s MET 63 N -3.35 0.30 0.62 1.45 0.23 -1.26 -4.20 119.30 113.09 2kbx s MET 63 Ca 0.66 -0.51 -0.11 0.00 -1.03 0.00 0.00 55.69 54.70 2kbx s MET 63 Cb -0.30 0.11 -0.04 0.00 -1.53 0.00 0.00 34.83 33.07 2kbx s MET 63 CO 0.58 -0.05 1.03 -0.80 -2.03 0.00 0.00 175.02 173.75 2kbx s ASN 64 N -1.27 6.14 0.00 -1.18 -0.87 -1.02 -4.87 114.94 111.87 2kbx s ASN 64 Ca -0.14 1.47 0.01 0.00 -1.57 0.00 0.00 52.86 52.63 2kbx s ASN 64 Cb -0.08 -2.48 0.06 0.00 -0.02 0.00 0.00 41.25 38.73 2kbx s ASN 64 CO -0.01 -0.93 0.83 -2.11 -2.57 0.00 0.00 177.10 172.31 2kbx n ARG 65 N -2.70 0.02 -1.32 -0.60 -4.01 -1.25 -1.35 116.66 105.45 2kbx n ARG 65 Ca 0.06 0.26 -0.19 0.00 -1.04 0.00 0.00 57.85 56.94 2kbx n ARG 65 Cb 0.54 -1.50 0.12 0.00 -3.04 0.00 0.00 32.46 28.58 2kbx n ARG 65 CO 0.00 0.00 0.00 0.41 -3.04 0.00 0.00 177.63 175.00 2kbx n GLY 66 N -1.18 5.53 3.29 2.89 0.00 -1.26 -4.98 105.19 109.48 2kbx n GLY 66 Ca 0.01 -1.88 -0.27 0.00 0.00 0.00 0.00 46.02 43.87 2kbx n GLY 66 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2kbx n ASP 67 N -0.96 -6.36 -3.19 1.61 -0.08 -0.45 -4.99 116.55 102.12 2kbx n ASP 67 Ca 0.46 0.03 0.01 0.00 -1.51 0.00 0.00 54.79 53.78 2kbx n ASP 67 Cb 0.99 -3.03 -0.01 0.00 2.34 0.00 0.00 41.12 41.40 2kbx n ASP 67 CO 0.00 0.00 0.00 -1.81 0.12 0.00 0.00 177.20 175.51 2kbx s ASP 68 N -1.99 -1.20 0.38 1.67 1.01 -1.26 -4.91 116.67 110.38 2kbx s ASP 68 Ca 0.30 0.02 -0.08 0.00 0.71 0.00 0.00 52.55 53.50 2kbx s ASP 68 Cb -0.05 1.83 -0.06 0.00 1.01 0.00 0.00 42.92 45.66 2kbx s ASP 68 CO 0.84 -0.31 0.72 0.42 0.21 0.00 0.00 175.17 177.05 2kbx s THR 69 N 2.72 4.86 0.29 -1.27 -4.23 -1.26 -2.42 115.64 114.33 2kbx s THR 69 Ca 0.10 0.42 0.05 0.00 -1.18 0.00 0.00 61.69 61.08 2kbx s THR 69 Cb -0.10 -3.75 0.29 0.00 1.34 0.00 0.00 72.50 70.28 2kbx s THR 69 CO -0.26 -0.51 1.74 -0.65 -0.54 0.00 0.00 174.62 174.40 2kbx h PRO 70 N 1.25 0.56 -0.46 3.99 0.10 -1.87 -1.12 132.00 134.45 2kbx h PRO 70 Ca -0.47 -0.03 0.09 0.00 0.10 0.00 0.00 66.00 65.68 2kbx h PRO 70 Cb 1.19 -0.13 -0.10 0.00 0.10 0.00 0.00 31.00 32.07 2kbx h PRO 70 CO 0.64 0.37 -0.31 1.25 0.10 0.00 0.00 178.00 180.06 2kbx h LEU 71 N 0.58 -1.03 0.37 2.35 5.85 -1.92 1.87 115.31 123.38 2kbx h LEU 71 Ca 0.56 0.20 -0.02 0.00 0.84 0.00 0.00 57.88 59.46 2kbx h LEU 71 Cb 0.97 0.50 -0.00 0.00 0.37 0.00 0.00 40.66 42.50 2kbx h LEU 71 CO -0.44 -0.30 -0.24 0.45 -0.34 0.00 0.00 178.44 177.57 2kbx h HIS 72 N -0.21 -0.64 -0.81 1.25 3.86 -1.58 -1.43 115.15 115.60 2kbx h HIS 72 Ca 0.20 -0.01 0.19 0.00 -1.16 0.00 0.00 60.37 59.60 2kbx h HIS 72 Cb 0.53 0.23 -0.13 0.00 1.06 0.00 0.00 27.41 29.10 2kbx h HIS 72 CO -0.55 -0.35 0.21 -0.07 0.86 0.00 0.00 177.93 178.03 2kbx h LEU 73 N -0.57 0.01 0.22 2.43 3.38 -1.05 1.00 115.31 120.73 2kbx h LEU 73 Ca -0.05 0.17 0.00 0.00 0.09 0.00 0.00 57.88 58.10 2kbx h LEU 73 Cb 0.46 0.23 -0.04 0.00 0.09 0.00 0.00 40.66 41.40 2kbx h LEU 73 CO 0.04 -0.09 -0.50 0.00 0.09 0.00 0.00 178.44 177.99 2kbx h ALA 74 N 1.69 -1.02 0.00 1.53 0.00 0.32 -1.30 119.26 120.49 2kbx h ALA 74 Ca 0.48 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 55.22 2kbx h ALA 74 Cb 0.89 0.83 -0.01 0.00 0.00 0.00 0.00 17.79 19.51 2kbx h ALA 74 CO -0.58 -1.12 -0.19 0.00 0.00 0.00 0.00 179.25 177.36 2kbx h ALA 75 N -0.70 1.07 -0.31 0.00 0.00 -0.16 -3.19 119.26 115.97 2kbx h ALA 75 Ca -0.02 -0.17 0.07 0.00 0.00 0.00 0.00 54.91 54.78 2kbx h ALA 75 Cb 0.75 -0.03 -0.07 0.00 0.00 0.00 0.00 17.79 18.44 2kbx h ALA 75 CO -0.21 0.24 -0.16 1.03 0.00 0.00 0.00 179.25 180.15 2kbx h SER 76 N 0.00 -0.52 0.62 0.00 0.87 0.22 -2.81 113.55 111.92 2kbx h SER 76 Ca -0.00 0.12 -0.02 0.00 -1.23 0.00 0.00 61.79 60.66 2kbx h SER 76 Cb 0.65 0.29 -0.01 0.00 -0.44 0.00 0.00 62.40 62.88 2kbx h SER 76 CO 0.02 -0.19 -0.47 -0.74 -0.53 0.00 0.00 176.83 174.92 2kbx h HIS 77 N -0.11 -1.29 0.00 2.24 2.76 -1.48 -3.47 115.15 113.79 2kbx h HIS 77 Ca 0.16 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.33 2kbx h HIS 77 Cb 0.35 0.48 0.00 0.00 1.55 0.00 0.00 27.41 29.80 2kbx h HIS 77 CO -0.36 -0.67 0.00 0.41 -1.30 0.00 0.00 177.93 176.01 2kbx n GLY 78 N -1.56 -0.37 3.51 5.26 0.00 -1.06 -5.08 105.19 105.88 2kbx n GLY 78 Ca -0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.47 2kbx n GLY 78 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2kbx s HIS 79 N -0.58 2.81 0.63 1.61 3.76 -1.26 -4.79 115.29 117.48 2kbx s HIS 79 Ca 0.00 -1.11 0.33 0.00 -0.15 0.00 0.00 55.06 54.13 2kbx s HIS 79 Cb 0.00 -4.50 1.84 0.00 1.11 0.00 0.00 32.58 31.03 2kbx s HIS 79 CO 0.00 -1.72 2.11 0.07 -0.85 0.00 0.00 174.74 174.35 2kbx h ARG 80 N 9.33 0.00 0.58 1.40 -0.00 -1.94 -2.67 114.38 121.07 2kbx h ARG 80 Ca 0.18 0.00 -0.03 0.00 -0.00 0.00 0.00 59.98 60.13 2kbx h ARG 80 Cb 1.02 0.00 0.01 0.00 -0.00 0.00 0.00 29.97 30.99 2kbx h ARG 80 CO 1.28 0.00 -0.28 -0.44 -0.00 0.00 0.00 179.97 180.53 2kbx h ASP 81 N 0.00 -0.66 -0.63 0.08 3.32 -1.98 -0.85 116.42 115.70 2kbx h ASP 81 Ca 0.04 -0.02 0.11 0.00 0.02 0.00 0.00 57.03 57.19 2kbx h ASP 81 Cb 0.44 0.17 -0.04 0.00 0.22 0.00 0.00 39.33 40.12 2kbx h ASP 81 CO -0.00 -0.39 0.42 -0.29 -1.72 0.00 0.00 179.24 177.27 2kbx h ILE 82 N -0.90 0.86 0.30 0.35 2.10 -1.86 -2.04 117.51 116.32 2kbx h ILE 82 Ca -0.08 -0.13 -0.01 0.00 1.08 0.00 0.00 64.86 65.71 2kbx h ILE 82 Cb 0.64 0.45 0.00 0.00 -1.09 0.00 0.00 36.82 36.82 2kbx h ILE 82 CO 0.13 0.07 -0.15 0.58 -1.08 0.00 0.00 178.15 177.70 2kbx h VAL 83 N 0.38 0.72 -0.77 2.19 2.07 -1.45 -2.86 116.25 116.53 2kbx h VAL 83 Ca 0.30 -0.50 0.17 0.00 0.82 0.00 0.00 66.70 67.49 2kbx h VAL 83 Cb 0.65 0.98 -0.11 0.00 -1.52 0.00 0.00 31.29 31.28 2kbx h VAL 83 CO -0.08 0.10 0.22 1.56 0.02 0.00 0.00 177.57 179.39 2kbx h GLN 84 N -0.69 0.30 -0.36 1.57 1.08 -0.43 1.93 115.11 118.51 2kbx h GLN 84 Ca -0.04 -0.02 -0.12 0.00 -1.45 0.00 0.00 58.65 57.02 2kbx h GLN 84 Cb 0.48 -0.07 -0.01 0.00 -0.05 0.00 0.00 27.48 27.83 2kbx h GLN 84 CO 0.07 0.20 -0.26 1.57 -0.95 0.00 0.00 178.83 179.46 2kbx h LYS 85 N 0.31 0.72 0.00 1.46 2.10 -1.47 -2.03 116.57 117.66 2kbx h LYS 85 Ca 0.44 -0.30 -0.01 0.00 -2.00 0.00 0.00 60.65 58.78 2kbx h LYS 85 Cb 0.76 -0.03 -0.00 0.00 -0.90 0.00 0.00 32.23 32.06 2kbx h LYS 85 CO -0.51 0.91 -1.18 1.47 -2.00 0.00 0.00 179.45 178.14 2kbx n LEU 86 N -4.10 0.71 0.20 7.07 -0.00 -0.58 -3.27 117.00 117.03 2kbx n LEU 86 Ca -0.00 0.28 0.13 0.00 -0.00 0.00 0.00 56.01 56.42 2kbx n LEU 86 Cb 0.45 -0.04 0.35 0.00 -0.00 0.00 0.00 43.42 44.18 2kbx n LEU 86 CO 0.45 -0.14 0.87 0.25 -0.00 0.00 0.00 177.39 178.81 2kbx h LEU 87 N 0.00 0.00 0.00 1.47 5.85 0.31 -2.99 115.31 119.95 2kbx h LEU 87 Ca -0.01 0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.63 2kbx h LEU 87 Cb 1.03 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.04 2kbx h LEU 87 CO 0.00 0.00 -1.80 0.00 -0.34 0.00 0.00 178.44 176.30 2kbx n GLN 88 N -2.84 0.65 0.08 1.25 1.13 -0.77 -1.22 117.38 115.65 2kbx n GLN 88 Ca 0.04 -0.05 -0.10 0.00 -1.94 0.00 0.00 57.00 54.95 2kbx n GLN 88 Cb 0.44 -1.62 -0.02 0.00 0.11 0.00 0.00 30.24 29.16 2kbx n GLN 88 CO 0.00 0.00 0.00 1.88 -1.44 0.00 0.00 177.06 177.50 2kbx h TYR 89 N 0.00 0.35 0.00 1.08 -1.99 -1.52 -3.41 116.97 111.48 2kbx h TYR 89 Ca -0.11 -0.19 0.00 0.00 2.00 0.00 0.00 58.73 60.42 2kbx h TYR 89 Cb 1.29 -0.04 0.00 0.00 2.00 0.00 0.00 36.73 39.98 2kbx h TYR 89 CO 0.00 1.01 0.00 1.63 -0.00 0.00 0.00 178.16 180.80 2kbx n LYS 90 N -3.67 5.11 -3.91 4.88 4.76 -1.14 -5.05 118.16 119.14 2kbx n LYS 90 Ca -0.04 0.00 -0.31 0.00 -2.87 0.00 0.00 58.31 55.09 2kbx n LYS 90 Cb 0.82 -0.43 -0.00 0.00 -1.84 0.00 0.00 35.03 33.58 2kbx n LYS 90 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2kbx n ALA 91 N 0.00 -2.28 0.78 7.82 0.00 -0.36 -4.73 120.51 121.75 2kbx n ALA 91 Ca 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.12 2kbx n ALA 91 Cb 0.00 -2.46 0.00 0.00 0.00 0.00 0.00 19.45 16.99 2kbx n ALA 91 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2kbx n ASP 92 N -2.76 2.22 0.05 0.00 2.03 -1.26 -3.47 116.55 113.36 2kbx n ASP 92 Ca -0.21 -1.56 -0.17 0.00 0.52 0.00 0.00 54.79 53.37 2kbx n ASP 92 Cb 0.64 -0.39 -0.07 0.00 -0.72 0.00 0.00 41.12 40.58 2kbx n ASP 92 CO 0.00 0.00 0.00 -0.29 -1.92 0.00 0.00 177.20 174.99 2kbx h ILE 93 N 0.20 1.34 0.00 5.18 2.10 -1.92 -2.95 117.51 121.46 2kbx h ILE 93 Ca 0.00 -2.32 0.00 0.00 1.08 0.00 0.00 64.86 63.62 2kbx h ILE 93 Cb 0.75 2.37 0.00 0.00 -1.09 0.00 0.00 36.82 38.85 2kbx h ILE 93 CO 0.00 0.71 0.00 -0.46 -1.08 0.00 0.00 178.15 177.32 2kbx n ASN 94 N -3.81 0.00 -4.11 2.19 2.04 -1.23 -4.36 115.26 105.99 2kbx n ASN 94 Ca -0.09 0.39 -0.36 0.00 -0.44 0.00 0.00 54.58 54.09 2kbx n ASN 94 Cb 0.85 -0.46 -0.11 0.00 -2.53 0.00 0.00 39.78 37.53 2kbx n ASN 94 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 2kbx s ALA 95 N -2.92 3.23 1.12 -2.53 0.00 -1.12 -5.09 121.76 114.46 2kbx s ALA 95 Ca 0.13 -2.68 -0.10 0.00 0.00 0.00 0.00 51.96 49.31 2kbx s ALA 95 Cb 0.15 -2.45 0.15 0.00 0.00 0.00 0.00 23.12 20.97 2kbx s ALA 95 CO 0.39 -1.86 0.57 1.33 0.00 0.00 0.00 175.76 176.19 2kbx n VAL 96 N 4.38 0.00 0.00 0.00 0.24 -1.26 -4.93 118.33 116.76 2kbx n VAL 96 Ca -0.00 -0.27 0.00 0.00 -2.04 0.00 0.00 64.34 62.03 2kbx n VAL 96 Cb 0.41 -1.17 0.00 0.00 -1.47 0.00 0.00 33.84 31.60 2kbx n VAL 96 CO 0.00 0.00 0.00 -0.46 -2.14 0.00 0.00 176.83 174.23 2kbx n ASN 97 N -3.91 0.00 -0.00 -1.34 2.04 -1.26 -4.93 115.26 105.87 2kbx n ASN 97 Ca 0.08 0.00 0.06 0.00 -0.44 0.00 0.00 54.58 54.28 2kbx n ASN 97 Cb 0.30 0.00 -0.08 0.00 -2.53 0.00 0.00 39.78 37.47 2kbx n ASN 97 CO 0.00 0.00 0.00 -0.62 -0.44 0.00 0.00 177.26 176.20 2kbx n GLU 98 N 0.00 1.93 -0.03 -3.83 1.02 -1.26 -4.40 120.64 114.06 2kbx n GLU 98 Ca 0.00 -0.04 0.09 0.00 -0.02 0.00 0.00 57.16 57.18 2kbx n GLU 98 Cb 0.00 -1.18 0.09 0.00 -0.02 0.00 0.00 31.44 30.33 2kbx n GLU 98 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 2kbx n HIS 99 N -1.53 0.08 -0.93 -0.32 8.25 -1.26 -4.96 115.22 114.54 2kbx n HIS 99 Ca 0.01 -0.05 0.00 0.00 -0.26 0.00 0.00 57.72 57.41 2kbx n HIS 99 Cb 0.25 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.36 2kbx n HIS 99 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2kbx n GLY 100 N 0.97 0.73 3.57 -1.41 0.00 -1.26 -4.85 105.19 102.95 2kbx n GLY 100 Ca 0.11 -0.66 -0.28 0.00 0.00 0.00 0.00 46.02 45.19 2kbx n GLY 100 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kbx s ASN 101 N -2.66 5.05 0.36 1.61 6.03 -1.26 -4.86 114.94 119.22 2kbx s ASN 101 Ca 0.00 -1.35 -0.25 0.00 -1.03 0.00 0.00 52.86 50.23 2kbx s ASN 101 Cb 0.00 -2.58 -0.09 0.00 -3.03 0.00 0.00 41.25 35.55 2kbx s ASN 101 CO 0.00 -2.99 1.03 -0.69 -2.03 0.00 0.00 177.10 172.42 2kbx s VAL 102 N 10.78 3.83 0.44 3.54 1.01 -1.26 -4.37 120.40 134.36 2kbx s VAL 102 Ca 0.69 1.49 0.25 0.00 0.00 0.00 0.00 61.98 64.41 2kbx s VAL 102 Cb -0.03 -3.82 0.45 0.00 0.00 0.00 0.00 36.38 32.98 2kbx s VAL 102 CO 0.09 0.10 1.75 -0.65 0.00 0.00 0.00 175.10 176.39 2kbx h PRO 103 N 2.89 0.25 -0.20 2.72 0.11 -1.92 0.09 132.00 135.94 2kbx h PRO 103 Ca -0.48 -0.01 -0.08 0.00 0.11 0.00 0.00 66.00 65.54 2kbx h PRO 103 Cb 1.21 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 32.26 2kbx h PRO 103 CO 0.64 0.16 -0.19 1.25 -0.21 0.00 0.00 178.00 179.65 2kbx h LEU 104 N 0.25 0.51 -0.88 2.35 5.85 -1.98 -1.59 115.31 119.83 2kbx h LEU 104 Ca 0.63 -0.47 0.20 0.00 0.84 0.00 0.00 57.88 59.07 2kbx h LEU 104 Cb 1.87 -0.14 -0.12 0.00 0.37 0.00 0.00 40.66 42.64 2kbx h LEU 104 CO -0.25 0.88 0.40 0.45 -0.34 0.00 0.00 178.44 179.57 2kbx h HIS 105 N 0.15 0.67 0.17 1.25 3.86 -1.34 1.42 115.15 121.34 2kbx h HIS 105 Ca 0.03 0.04 -0.01 0.00 -1.16 0.00 0.00 60.37 59.27 2kbx h HIS 105 Cb 0.73 -0.16 0.00 0.00 1.06 0.00 0.00 27.41 29.04 2kbx h HIS 105 CO 0.08 0.02 -0.08 -0.92 0.86 0.00 0.00 177.93 177.88 2kbx h TYR 106 N 0.46 -0.22 0.00 2.45 5.03 -1.36 -2.60 116.97 120.73 2kbx h TYR 106 Ca 0.53 -0.01 -0.01 0.00 2.58 0.00 0.00 58.73 61.82 2kbx h TYR 106 Cb 0.93 0.07 -0.00 0.00 1.55 0.00 0.00 36.73 39.28 2kbx h TYR 106 CO -0.13 0.17 -0.04 0.00 -1.32 0.00 0.00 178.16 176.84 2kbx h ALA 107 N 0.01 1.92 -0.44 1.82 0.00 -0.19 -1.61 119.26 120.76 2kbx h ALA 107 Ca -0.02 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 2kbx h ALA 107 Cb 0.49 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 2kbx h ALA 107 CO 0.04 0.05 0.18 0.00 0.00 0.00 0.00 179.25 179.52 2kbx h PHE 109 N 0.57 0.00 0.00 0.00 0.04 -0.92 -3.32 116.94 113.31 2kbx h PHE 109 Ca 0.15 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.92 2kbx h PHE 109 Cb 0.19 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.34 2kbx h PHE 109 CO 0.00 0.12 -0.13 -1.49 -0.60 0.00 0.00 178.31 176.21 2kbx h TRP 110 N 0.00 0.00 0.00 -0.55 4.06 -0.77 -3.50 115.95 115.19 2kbx h TRP 110 Ca -0.00 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.95 2kbx h TRP 110 Cb 0.58 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.74 2kbx h TRP 110 CO 0.00 0.00 0.00 0.41 -3.56 0.00 0.00 178.44 175.29 2kbx n GLY 111 N 1.73 0.89 3.53 1.49 0.00 0.31 -5.07 105.19 108.06 2kbx n GLY 111 Ca -0.02 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.58 2kbx n GLY 111 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2kbx s GLN 112 N 0.00 3.83 0.06 1.61 -1.52 -1.14 -4.84 119.66 117.65 2kbx s GLN 112 Ca 0.00 -1.79 -0.31 0.00 -1.95 0.00 0.00 55.36 51.31 2kbx s GLN 112 Cb 0.00 -5.31 -0.18 0.00 -0.22 0.00 0.00 33.01 27.30 2kbx s GLN 112 CO 0.00 -2.09 1.56 0.38 -0.25 0.00 0.00 175.29 174.90 2kbx h ASP 113 N 8.38 -0.64 -0.31 5.90 2.03 -1.98 -1.81 116.42 128.00 2kbx h ASP 113 Ca 0.31 -0.00 0.05 0.00 -0.73 0.00 0.00 57.03 56.65 2kbx h ASP 113 Cb 0.94 0.17 -0.08 0.00 -0.83 0.00 0.00 39.33 39.53 2kbx h ASP 113 CO 1.36 -0.42 -0.53 0.06 -1.03 0.00 0.00 179.24 178.68 2kbx h GLN 114 N -0.82 -0.44 -0.79 4.15 -0.00 -1.99 0.10 115.11 115.33 2kbx h GLN 114 Ca -0.08 0.03 0.00 0.00 -0.00 0.00 0.00 58.65 58.60 2kbx h GLN 114 Cb 0.61 0.10 -0.04 0.00 -0.00 0.00 0.00 27.48 28.15 2kbx h GLN 114 CO 0.13 -0.29 0.49 -0.39 -0.00 0.00 0.00 178.83 178.77 2kbx h VAL 115 N -0.46 1.21 0.00 1.86 -1.51 -1.86 -0.53 116.25 114.96 2kbx h VAL 115 Ca 0.07 -0.44 -0.01 0.00 -1.23 0.00 0.00 66.70 65.09 2kbx h VAL 115 Cb 0.63 0.08 -0.00 0.00 -2.13 0.00 0.00 31.29 29.87 2kbx h VAL 115 CO -0.54 0.22 -0.05 0.00 -1.23 0.00 0.00 177.57 175.97 2kbx h ALA 116 N 1.46 1.75 0.49 5.19 0.00 -0.26 -2.73 119.26 125.16 2kbx h ALA 116 Ca 0.29 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.13 2kbx h ALA 116 Cb -0.07 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.71 2kbx h ALA 116 CO -0.06 0.06 -0.23 1.49 0.00 0.00 0.00 179.25 180.51 2kbx h GLU 117 N 0.00 -0.63 -1.12 0.00 4.81 0.81 -2.87 114.58 115.57 2kbx h GLU 117 Ca -0.00 0.04 0.31 0.00 -0.13 0.00 0.00 59.36 59.59 2kbx h GLU 117 Cb 0.10 0.14 -0.10 0.00 0.63 0.00 0.00 28.75 29.53 2kbx h GLU 117 CO 0.01 -0.37 0.73 0.38 -0.73 0.00 0.00 179.01 179.02 2kbx h ASP 118 N -1.12 0.35 0.62 1.04 3.04 -1.23 0.77 116.42 119.90 2kbx h ASP 118 Ca -0.07 0.09 -0.03 0.00 -3.24 0.00 0.00 57.03 53.78 2kbx h ASP 118 Cb 0.55 0.04 0.01 0.00 -1.04 0.00 0.00 39.33 38.88 2kbx h ASP 118 CO 0.11 0.02 -0.30 -0.07 -2.04 0.00 0.00 179.24 176.96 2kbx h LEU 119 N 0.28 -0.71 0.00 0.15 3.38 -1.43 -2.20 115.31 114.77 2kbx h LEU 119 Ca 0.64 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.64 2kbx h LEU 119 Cb 1.83 0.18 0.00 0.00 0.09 0.00 0.00 40.66 42.77 2kbx h LEU 119 CO -0.29 -0.35 0.00 0.55 0.09 0.00 0.00 178.44 178.44 2kbx n VAL 120 N -5.15 1.76 0.84 1.22 3.14 -0.73 -0.45 118.33 118.96 2kbx n VAL 120 Ca -0.10 0.44 0.13 0.00 -2.96 0.00 0.00 64.34 61.85 2kbx n VAL 120 Cb 0.33 -1.43 0.53 0.00 -1.06 0.00 0.00 33.84 32.21 2kbx n VAL 120 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2kbx n ALA 121 N -1.45 2.27 -0.03 1.55 0.00 0.19 -3.43 120.51 119.60 2kbx n ALA 121 Ca 0.00 -0.07 -0.20 0.00 0.00 0.00 0.00 53.44 53.17 2kbx n ALA 121 Cb 0.01 -1.46 -0.13 0.00 0.00 0.00 0.00 19.45 17.86 2kbx n ALA 121 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2kbx n ASN 122 N -1.77 2.05 0.00 0.00 0.23 0.40 -4.97 115.26 111.20 2kbx n ASN 122 Ca 0.06 0.12 0.00 0.00 -0.53 0.00 0.00 54.58 54.23 2kbx n ASN 122 Cb 0.36 -0.71 0.00 0.00 -2.08 0.00 0.00 39.78 37.35 2kbx n ASN 122 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2kbx n GLY 123 N 2.06 -0.61 0.35 4.83 0.00 -1.22 -5.00 105.19 105.59 2kbx n GLY 123 Ca -0.36 0.00 0.18 0.00 0.00 0.00 0.00 46.02 45.84 2kbx n GLY 123 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kbx h ALA 124 N 0.00 1.72 -1.75 4.61 0.00 -1.79 -3.47 119.26 118.58 2kbx h ALA 124 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2kbx h ALA 124 Cb 0.00 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.80 2kbx h ALA 124 CO 0.00 -0.34 -0.34 -0.11 0.00 0.00 0.00 179.25 178.45 2kbx n LEU 125 N -3.58 -3.55 -0.53 0.00 7.94 -1.26 -4.71 117.00 111.30 2kbx n LEU 125 Ca 0.02 1.18 0.09 0.00 -1.11 0.00 0.00 56.01 56.19 2kbx n LEU 125 Cb 0.37 -0.97 0.34 0.00 0.53 0.00 0.00 43.42 43.69 2kbx n LEU 125 CO 0.25 -0.38 0.75 1.33 -1.11 0.00 0.00 177.39 178.23 2kbx n VAL 126 N 0.17 0.24 -1.35 1.96 0.24 -1.26 -3.72 118.33 114.61 2kbx n VAL 126 Ca 0.00 -0.34 -0.04 0.00 -2.04 0.00 0.00 64.34 61.91 2kbx n VAL 126 Cb 0.00 0.30 0.21 0.00 -1.47 0.00 0.00 33.84 32.88 2kbx n VAL 126 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 2kbx n SER 127 N 0.28 2.86 0.25 -1.34 2.88 -1.26 -4.70 113.62 112.58 2kbx n SER 127 Ca 0.15 -3.63 -0.16 0.00 -1.33 0.00 0.00 58.87 53.90 2kbx n SER 127 Cb 0.30 -0.64 -0.08 0.00 -0.75 0.00 0.00 64.21 63.04 2kbx n SER 127 CO 0.00 0.00 0.00 0.40 -1.23 0.00 0.00 175.04 174.21 2kbx h ILE 128 N 1.15 0.58 -1.02 2.46 2.04 -1.84 -3.49 117.51 117.39 2kbx h ILE 128 Ca 0.23 -0.03 0.00 0.00 1.00 0.00 0.00 64.86 66.05 2kbx h ILE 128 Cb 1.75 0.60 0.00 0.00 -0.74 0.00 0.00 36.82 38.43 2kbx h ILE 128 CO 0.44 0.01 0.00 0.00 0.00 0.00 0.00 178.15 178.59 2kbx n ASN 130 N 0.00 -2.97 0.29 0.00 2.85 -1.26 -4.39 115.26 109.78 2kbx n ASN 130 Ca 0.00 -0.36 0.16 0.00 -0.11 0.00 0.00 54.58 54.26 2kbx n ASN 130 Cb 0.00 -0.79 0.84 0.00 1.24 0.00 0.00 39.78 41.07 2kbx n ASN 130 CO 0.00 0.00 0.00 0.07 -2.11 0.00 0.00 177.26 175.22 2kbx h LYS 131 N -2.61 0.00 0.00 1.20 2.10 -1.91 0.18 116.57 115.53 2kbx h LYS 131 Ca -0.29 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.36 2kbx h LYS 131 Cb 0.88 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.21 2kbx h LYS 131 CO 0.19 0.00 -0.08 0.66 -2.00 0.00 0.00 179.45 178.22 2kbx n TYR 132 N -2.75 0.00 -1.10 0.07 4.01 -1.26 -4.95 117.16 111.18 2kbx n TYR 132 Ca -0.02 -0.54 -0.03 0.00 -0.16 0.00 0.00 57.90 57.15 2kbx n TYR 132 Cb 0.24 -0.08 -0.01 0.00 -0.31 0.00 0.00 39.34 39.17 2kbx n TYR 132 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2kbx n GLY 133 N -0.70 0.64 3.56 2.72 0.00 0.65 -4.91 105.19 107.14 2kbx n GLY 133 Ca 0.06 -0.53 -0.27 0.00 0.00 0.00 0.00 46.02 45.28 2kbx n GLY 133 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2kbx s GLU 134 N -1.75 2.55 0.28 1.61 2.56 -1.26 -4.47 118.70 118.22 2kbx s GLU 134 Ca 0.00 -0.30 0.11 0.00 0.00 0.00 0.00 54.97 54.78 2kbx s GLU 134 Cb 0.00 -5.06 -0.05 0.00 2.00 0.00 0.00 34.13 31.02 2kbx s GLU 134 CO 0.00 -3.39 -0.10 -1.64 -0.56 0.00 0.00 175.26 169.57 2kbx s MET 135 N 7.01 2.00 0.41 4.30 -1.94 -1.26 -4.05 119.30 125.77 2kbx s MET 135 Ca 0.70 -1.60 0.14 0.00 -1.71 0.00 0.00 55.69 53.22 2kbx s MET 135 Cb -0.07 -1.97 0.87 0.00 2.01 0.00 0.00 34.83 35.68 2kbx s MET 135 CO -0.01 0.34 1.91 -1.00 -0.01 0.00 0.00 175.02 176.26 2kbx h PRO 136 N 2.06 0.00 -0.85 2.03 0.14 -1.91 -2.69 132.00 130.78 2kbx h PRO 136 Ca -0.42 0.00 0.21 0.00 0.14 0.00 0.00 66.00 65.93 2kbx h PRO 136 Cb 1.25 0.00 -0.13 0.00 0.14 0.00 0.00 31.00 32.27 2kbx h PRO 136 CO 0.60 0.27 0.28 0.28 0.14 0.00 0.00 178.00 179.58 2kbx h VAL 137 N 0.00 0.44 0.00 1.56 2.07 -1.95 1.90 116.25 120.26 2kbx h VAL 137 Ca -0.00 -0.10 -0.05 0.00 0.82 0.00 0.00 66.70 67.36 2kbx h VAL 137 Cb 0.49 0.11 -0.01 0.00 -1.52 0.00 0.00 31.29 30.35 2kbx h VAL 137 CO 0.04 0.06 -0.32 -0.78 0.02 0.00 0.00 177.57 176.58 2kbx h ASP 138 N 0.30 0.00 0.04 0.57 3.58 -1.84 -2.48 116.42 116.59 2kbx h ASP 138 Ca 0.51 -0.70 0.00 0.00 0.42 0.00 0.00 57.03 57.26 2kbx h ASP 138 Cb 0.97 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.02 2kbx h ASP 138 CO -0.56 1.03 0.00 0.29 -2.88 0.00 0.00 179.24 177.12 2kbx n LYS 139 N -4.59 0.02 -0.02 0.28 4.76 -0.93 -1.07 118.16 116.61 2kbx n LYS 139 Ca -0.14 0.50 -0.18 0.00 -2.87 0.00 0.00 58.31 55.62 2kbx n LYS 139 Cb 0.45 -1.56 -0.14 0.00 -1.84 0.00 0.00 35.03 31.94 2kbx n LYS 139 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2kbx n ALA 140 N -1.54 1.08 1.61 7.82 0.00 0.64 -3.93 120.51 126.19 2kbx n ALA 140 Ca 0.00 -0.70 0.15 0.00 0.00 0.00 0.00 53.44 52.89 2kbx n ALA 140 Cb 0.02 -0.64 0.76 0.00 0.00 0.00 0.00 19.45 19.59 2kbx n ALA 140 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2kbx n LYS 141 N -3.35 0.75 -0.08 0.00 0.00 -0.24 -2.16 118.16 113.08 2kbx n LYS 141 Ca -0.31 -0.12 -0.11 0.00 0.00 0.00 0.00 58.31 57.78 2kbx n LYS 141 Cb 1.05 -1.50 -0.06 0.00 0.00 0.00 0.00 35.03 34.52 2kbx n LYS 141 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2kbx h ALA 142 N 3.71 0.08 0.20 3.14 0.00 -1.36 -3.39 119.26 121.65 2kbx h ALA 142 Ca 0.00 -0.64 0.00 0.00 0.00 0.00 0.00 54.91 54.27 2kbx h ALA 142 Cb 0.23 0.42 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 2kbx h ALA 142 CO 0.00 0.41 -0.20 -1.35 0.00 0.00 0.00 179.25 178.10 2kbx h PRO 143 N -1.00 -0.42 0.00 0.00 0.10 -1.70 -3.46 132.00 125.52 2kbx h PRO 143 Ca -0.11 0.03 0.00 0.00 0.10 0.00 0.00 66.00 66.02 2kbx h PRO 143 Cb 0.74 0.10 0.00 0.00 0.10 0.00 0.00 31.00 31.94 2kbx h PRO 143 CO -0.07 -0.28 0.00 1.47 0.10 0.00 0.00 178.00 179.22 2kbx n LEU 144 N -5.33 0.00 0.00 2.35 -0.00 -1.24 -5.09 117.00 107.70 2kbx n LEU 144 Ca -0.08 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 55.93 2kbx n LEU 144 Cb 0.24 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.66 2kbx n LEU 144 CO 0.30 0.00 0.32 0.54 -0.00 0.00 0.00 177.39 178.54 2kbx n ARG 145 N 0.00 0.00 -0.18 1.47 5.12 -0.92 -4.72 116.66 117.43 2kbx n ARG 145 Ca 0.00 0.16 0.00 0.00 -1.93 0.00 0.00 57.85 56.08 2kbx n ARG 145 Cb 0.00 -1.13 0.00 0.00 -1.16 0.00 0.00 32.46 30.17 2kbx n ARG 145 CO 0.00 0.00 0.00 0.39 -1.93 0.00 0.00 177.63 176.09 2kbx n GLU 146 N -0.92 0.00 0.01 5.56 1.02 -1.16 -4.70 120.64 120.45 2kbx n GLU 146 Ca 0.00 0.00 -0.06 0.00 -0.02 0.00 0.00 57.16 57.08 2kbx n GLU 146 Cb 0.00 -4.02 -0.04 0.00 -0.02 0.00 0.00 31.44 27.36 2kbx n GLU 146 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 2kbx h LEU 147 N 0.00 -0.12 -2.34 -4.62 5.85 -1.90 -2.82 115.31 109.36 2kbx h LEU 147 Ca 0.00 -0.21 0.00 0.00 0.84 0.00 0.00 57.88 58.51 2kbx h LEU 147 Cb 0.00 0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.06 2kbx h LEU 147 CO 0.00 0.45 0.00 0.17 -0.34 0.00 0.00 178.44 178.72 2kbx h LEU 148 N -1.01 0.00 -0.11 2.25 8.10 -1.97 -1.33 115.31 121.25 2kbx h LEU 148 Ca -0.01 0.00 -0.04 0.00 0.11 0.00 0.00 57.88 57.94 2kbx h LEU 148 Cb 0.32 0.00 -0.00 0.00 -0.44 0.00 0.00 40.66 40.54 2kbx h LEU 148 CO 0.02 0.00 -0.09 -0.09 -4.11 0.00 0.00 178.44 174.18 2kbx h ARG 149 N 0.00 0.25 -0.70 0.17 2.43 -1.90 -2.17 114.38 112.47 2kbx h ARG 149 Ca 0.00 -0.13 0.02 0.00 -0.81 0.00 0.00 59.98 59.07 2kbx h ARG 149 Cb 0.05 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 29.56 2kbx h ARG 149 CO 0.00 0.64 0.45 0.93 -1.51 0.00 0.00 179.97 180.48 2kbx h GLU 150 N -0.13 0.86 -0.81 0.20 5.08 -0.98 0.92 114.58 119.71 2kbx h GLU 150 Ca 0.02 -0.05 0.08 0.00 -1.00 0.00 0.00 59.36 58.41 2kbx h GLU 150 Cb 0.59 -0.19 -0.05 0.00 0.50 0.00 0.00 28.75 29.59 2kbx h GLU 150 CO 0.02 0.57 0.53 -0.09 -1.00 0.00 0.00 179.01 179.04 2kbx h ARG 151 N 0.89 0.81 0.00 2.33 2.43 -1.40 0.50 114.38 119.94 2kbx h ARG 151 Ca 0.28 -0.05 -0.00 0.00 -0.81 0.00 0.00 59.98 59.40 2kbx h ARG 151 Cb -0.02 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 29.35 2kbx h ARG 151 CO -0.09 0.53 -0.00 0.00 -1.51 0.00 0.00 179.97 178.90 2kbx h ALA 152 N 1.57 -0.01 -1.01 2.80 0.00 -0.48 -2.82 119.26 119.32 2kbx h ALA 152 Ca 0.36 -0.43 0.26 0.00 0.00 0.00 0.00 54.91 55.10 2kbx h ALA 152 Cb 0.32 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.04 2kbx h ALA 152 CO -0.14 -0.04 0.68 1.49 0.00 0.00 0.00 179.25 181.24 2kbx h GLU 153 N -0.93 0.27 -0.12 0.00 4.22 0.13 0.85 114.58 119.01 2kbx h GLU 153 Ca -0.00 -0.02 0.00 0.00 0.08 0.00 0.00 59.36 59.42 2kbx h GLU 153 Cb 0.87 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.06 2kbx h GLU 153 CO 0.00 0.18 0.00 0.36 -2.18 0.00 0.00 179.01 177.37 2kbx n LYS 154 N -4.48 1.93 0.18 1.92 2.85 0.12 -3.71 118.16 116.97 2kbx n LYS 154 Ca 0.23 -1.38 0.12 0.00 -1.05 0.00 0.00 58.31 56.23 2kbx n LYS 154 Cb 0.91 -1.45 0.63 0.00 -0.65 0.00 0.00 35.03 34.46 2kbx n LYS 154 CO 0.00 0.00 0.00 1.98 -0.05 0.00 0.00 177.40 179.33 2kbx h MET 155 N 3.07 0.00 0.00 -1.58 4.05 0.10 -3.44 114.93 117.13 2kbx h MET 155 Ca 0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 2kbx h MET 155 Cb 0.66 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.46 2kbx h MET 155 CO 0.00 0.00 0.00 0.41 0.23 0.00 0.00 176.91 177.55 2kbx n GLY 156 N -1.28 1.16 0.08 1.39 0.00 -1.26 -4.98 105.19 100.30 2kbx n GLY 156 Ca -0.02 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.93 2kbx n GLY 156 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 2kbx h GLN 157 N 2.03 0.00 0.01 1.61 3.07 -1.79 -3.28 115.11 116.75 2kbx h GLN 157 Ca 0.00 0.00 -0.33 0.00 0.09 0.00 0.00 58.65 58.41 2kbx h GLN 157 Cb 0.00 0.00 -0.05 0.00 0.08 0.00 0.00 27.48 27.51 2kbx h GLN 157 CO 0.00 0.62 -1.82 0.09 0.09 0.00 0.00 178.83 177.81 2kbx n ASN 158 N -3.13 1.92 -4.07 0.06 4.13 -1.24 -4.56 115.26 108.36 2kbx n ASN 158 Ca -0.11 0.36 -0.41 0.00 1.68 0.00 0.00 54.58 56.09 2kbx n ASN 158 Cb 1.00 -0.89 -0.01 0.00 -1.54 0.00 0.00 39.78 38.34 2kbx n ASN 158 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2kbx n LEU 159 N -4.26 5.68 -4.90 3.41 -0.00 -1.26 -5.03 117.00 110.63 2kbx n LEU 159 Ca -0.41 -5.17 -0.28 0.00 -0.00 0.00 0.00 56.01 50.15 2kbx n LEU 159 Cb 0.79 -1.26 -0.02 0.00 -0.00 0.00 0.00 43.42 42.93 2kbx n LEU 159 CO 0.15 1.61 0.34 0.54 -0.00 0.00 0.00 177.39 180.02 2kbx s ASN 160 N -0.72 6.38 0.85 1.45 2.20 -1.24 -4.69 114.94 119.17 2kbx s ASN 160 Ca 0.31 0.84 -0.15 0.00 -0.94 0.00 0.00 52.86 52.93 2kbx s ASN 160 Cb -0.00 -2.20 -0.02 0.00 -2.00 0.00 0.00 41.25 37.02 2kbx s ASN 160 CO 0.01 -0.39 0.28 -1.14 -2.94 0.00 0.00 177.10 172.93 2kbx n ARG 161 N -1.61 -0.01 -1.50 3.55 0.63 -1.26 -4.63 116.66 111.82 2kbx n ARG 161 Ca -0.00 0.04 -0.46 0.00 -0.92 0.00 0.00 57.85 56.50 2kbx n ARG 161 Cb 0.55 -1.71 -0.06 0.00 0.45 0.00 0.00 32.46 31.69 2kbx n ARG 161 CO 0.00 0.00 0.00 0.44 -2.51 0.00 0.00 177.63 175.56 2kbx n ILE 162 N -2.91 0.18 -2.06 5.15 -5.35 -1.26 -4.85 119.36 108.27 2kbx n ILE 162 Ca 0.07 -0.38 -0.43 0.00 -0.27 0.00 0.00 62.75 61.75 2kbx n ILE 162 Cb 0.52 -2.00 -0.03 0.00 -1.74 0.00 0.00 39.64 36.40 2kbx n ILE 162 CO 0.00 0.00 0.00 -2.16 -1.76 0.00 0.00 176.55 172.63 2kbx s PRO 163 N 6.69 3.94 0.00 6.28 0.05 -1.26 -4.82 135.00 145.89 2kbx s PRO 163 Ca 1.07 1.90 0.00 0.00 0.05 0.00 0.00 61.00 64.02 2kbx s PRO 163 Cb -0.64 -4.02 0.00 0.00 0.05 0.00 0.00 34.50 29.89 2kbx s PRO 163 CO 0.42 -1.12 0.00 0.98 0.05 0.00 0.00 177.00 177.33 2kbx n TYR 164 N 7.98 0.00 0.00 0.56 4.19 -1.26 -5.04 117.16 123.59 2kbx n TYR 164 Ca 0.18 0.00 0.00 0.00 3.31 0.00 0.00 57.90 61.39 2kbx n TYR 164 Cb 0.44 0.00 0.00 0.00 0.49 0.00 0.00 39.34 40.27 2kbx n TYR 164 CO 0.00 0.00 0.00 1.63 0.91 0.00 0.00 176.86 179.40 2kbx n LYS 165 N 0.00 0.00 0.00 2.98 5.02 -1.26 -4.82 118.16 120.08 2kbx n LYS 165 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2kbx n LYS 165 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 2kbx n LYS 165 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 2kbx n ASP 166 N 2.30 0.00 -0.78 4.39 -0.08 -1.26 -1.92 116.55 119.20 2kbx n ASP 166 Ca 0.00 0.00 -0.04 0.00 -1.51 0.00 0.00 54.79 53.24 2kbx n ASP 166 Cb 0.00 0.00 -0.04 0.00 2.34 0.00 0.00 41.12 43.42 2kbx n ASP 166 CO 0.00 0.00 0.00 0.41 0.12 0.00 0.00 177.20 177.73 2kbx n THR 167 N 0.00 0.00 -3.40 5.18 -1.04 -1.26 -5.07 114.28 108.69 2kbx n THR 167 Ca 0.00 0.00 -0.20 0.00 -2.04 0.00 0.00 64.05 61.81 2kbx n THR 167 Cb 0.00 0.30 -0.09 0.00 -1.82 0.00 0.00 70.33 68.71 2kbx n THR 167 CO 0.00 0.00 0.00 0.72 -0.64 0.00 0.00 175.07 175.15 2kbx s PHE 168 N 0.00 -0.12 0.00 -1.42 -0.12 -0.81 -4.86 117.98 110.65 2kbx s PHE 168 Ca 0.00 -0.82 0.00 0.00 -0.05 0.00 0.00 56.93 56.06 2kbx s PHE 168 Cb 0.00 -0.54 0.00 0.00 -0.63 0.00 0.00 43.02 41.85 2kbx s PHE 168 CO 0.00 -0.92 0.00 0.91 -0.05 0.00 0.00 175.22 175.16 2kbx n TRP 169 N 4.52 0.00 -4.03 3.49 7.02 -1.26 -4.82 117.44 122.37 2kbx n TRP 169 Ca 0.07 0.00 -0.29 0.00 -1.02 0.00 0.00 57.50 56.27 2kbx n TRP 169 Cb 0.44 0.00 -0.02 0.00 -2.42 0.00 0.00 31.31 29.31 2kbx n TRP 169 CO 0.00 0.00 0.00 1.63 -2.02 0.00 0.00 177.69 177.30 2kbx n LYS 170 N -0.29 -3.38 -0.66 -0.99 4.76 -1.26 -5.20 118.16 111.14 2kbx n LYS 170 Ca 0.00 0.40 0.00 0.00 -2.87 0.00 0.00 58.31 55.84 2kbx n LYS 170 Cb 0.00 -4.73 0.00 0.00 -1.84 0.00 0.00 35.03 28.46 2kbx n LYS 170 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44