#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 4p2p h LEU 2 N 0.00 0.04 -1.92 0.00 5.85 -0.98 -0.22 115.31 118.08 4p2p h LEU 2 Ca 0.00 0.16 -0.03 0.00 0.84 0.00 0.00 57.88 58.85 4p2p h LEU 2 Cb 0.00 0.21 -0.00 0.00 0.37 0.00 0.00 40.66 41.23 4p2p h LEU 2 CO 0.00 -0.06 -0.12 4.11 -0.34 0.00 0.00 178.44 182.03 4p2p h TRP 3 N 0.27 0.00 0.00 1.25 5.08 -1.99 -2.20 115.95 118.37 4p2p h TRP 3 Ca 0.46 0.00 -0.17 0.00 1.08 0.00 0.00 58.89 60.26 4p2p h TRP 3 Cb 0.84 0.00 -0.03 0.00 -3.00 0.00 0.00 29.16 26.97 4p2p h TRP 3 CO -0.25 0.12 -0.92 1.96 -1.28 0.00 0.00 178.44 178.06 4p2p h GLN 4 N 0.00 0.00 0.19 0.12 4.20 -1.44 -3.28 115.11 114.90 4p2p h GLN 4 Ca -0.00 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.70 4p2p h GLN 4 Cb 0.31 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.09 4p2p h GLN 4 CO 0.02 0.68 -0.09 0.35 -0.67 0.00 0.00 178.83 179.11 4p2p h PHE 5 N 0.00 -0.24 -0.54 2.96 3.57 -1.12 -1.43 116.94 120.14 4p2p h PHE 5 Ca -0.05 -0.01 0.10 0.00 3.53 0.00 0.00 57.97 61.54 4p2p h PHE 5 Cb 1.62 0.08 -0.08 0.00 2.79 0.00 0.00 35.95 40.36 4p2p h PHE 5 CO 0.00 0.09 0.08 0.00 -2.23 0.00 0.00 178.31 176.25 4p2p h ARG 6 N -0.60 0.20 0.00 1.11 3.08 -1.67 -0.60 114.38 115.90 4p2p h ARG 6 Ca -0.03 -0.01 -0.05 0.00 0.07 0.00 0.00 59.98 59.96 4p2p h ARG 6 Cb 0.44 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.44 4p2p h ARG 6 CO 0.04 0.13 -0.23 0.66 -1.07 0.00 0.00 179.97 179.50 4p2p h SER 7 N 0.20 0.00 0.33 7.04 4.64 -1.61 -1.02 113.55 123.13 4p2p h SER 7 Ca 0.28 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 61.44 4p2p h SER 7 Cb 0.41 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.49 4p2p h SER 7 CO -0.39 0.23 -0.66 -0.03 -0.87 0.00 0.00 176.83 175.11 4p2p h MET 8 N 0.00 0.31 0.15 4.77 -1.53 0.02 -1.46 114.93 117.19 4p2p h MET 8 Ca -0.00 -0.23 -0.01 0.00 -3.44 0.00 0.00 59.70 56.02 4p2p h MET 8 Cb 0.57 0.04 0.00 0.00 -0.55 0.00 0.00 31.60 31.66 4p2p h MET 8 CO 0.03 0.86 -0.07 0.82 0.14 0.00 0.00 176.91 178.69 4p2p h ILE 9 N 0.22 0.96 -0.78 1.77 2.04 -1.04 0.13 117.51 120.81 4p2p h ILE 9 Ca -0.02 -1.05 0.15 0.00 1.00 0.00 0.00 64.86 64.94 4p2p h ILE 9 Cb 1.20 1.55 -0.10 0.00 -0.74 0.00 0.00 36.82 38.73 4p2p h ILE 9 CO 0.11 0.22 0.33 0.50 0.00 0.00 0.00 178.15 179.31 4p2p h LYS 10 N -0.76 0.46 0.36 2.37 3.64 -1.21 1.87 116.57 123.30 4p2p h LYS 10 Ca -0.02 -0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 59.33 4p2p h LYS 10 Cb 0.53 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 32.21 4p2p h LYS 10 CO 0.03 0.30 -0.42 0.00 -2.27 0.00 0.00 179.45 177.10 4p2p h ALA 12 N -0.44 1.13 -2.71 0.00 0.00 0.27 -3.34 119.26 114.17 4p2p h ALA 12 Ca -0.03 -0.34 -0.60 0.00 0.00 0.00 0.00 54.91 53.94 4p2p h ALA 12 Cb 0.74 -0.12 -0.40 0.00 0.00 0.00 0.00 17.79 18.01 4p2p h ALA 12 CO -0.10 0.55 -0.76 -0.89 0.00 0.00 0.00 179.25 178.05 4p2p n ILE 13 N -4.13 0.42 -0.32 0.00 5.41 0.59 -4.94 119.36 116.39 4p2p n ILE 13 Ca -0.00 -4.26 0.08 0.00 1.00 0.00 0.00 62.75 59.57 4p2p n ILE 13 Cb 0.40 -1.96 0.19 0.00 -0.71 0.00 0.00 39.64 37.56 4p2p n ILE 13 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 176.55 175.90 4p2p h PRO 14 N 5.38 0.02 -0.63 0.38 0.11 -1.38 0.22 132.00 136.10 4p2p h PRO 14 Ca 0.20 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.31 4p2p h PRO 14 Cb 0.82 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.92 4p2p h PRO 14 CO 0.57 0.02 0.00 0.41 -0.21 0.00 0.00 178.00 178.79 4p2p n GLY 15 N -1.52 0.92 3.60 -0.55 0.00 -1.26 -4.84 105.19 101.54 4p2p n GLY 15 Ca 0.17 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.92 4p2p n GLY 15 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 4p2p s SER 16 N -0.36 3.84 -0.49 1.61 1.04 0.76 -5.08 113.70 115.02 4p2p s SER 16 Ca 0.00 -1.32 0.05 0.00 0.48 0.00 0.00 55.95 55.15 4p2p s SER 16 Cb 0.00 -0.39 0.18 0.00 0.10 0.00 0.00 66.02 65.91 4p2p s SER 16 CO 0.00 -0.38 0.41 1.57 0.98 0.00 0.00 173.24 175.82 4p2p n HIS 17 N -0.92 0.26 -0.36 5.02 -0.00 -1.26 -4.85 115.22 113.11 4p2p n HIS 17 Ca -0.05 -3.59 -0.03 0.00 0.46 0.00 0.00 57.72 54.51 4p2p n HIS 17 Cb 0.66 -0.03 0.01 0.00 -0.12 0.00 0.00 29.99 30.51 4p2p n HIS 17 CO 0.00 0.00 0.00 -0.35 0.46 0.00 0.00 176.34 176.45 4p2p n PRO 18 N 2.43 -0.26 -0.36 1.57 -0.04 -1.26 -1.17 135.00 135.91 4p2p n PRO 18 Ca 0.27 1.42 -0.11 0.00 -0.04 0.00 0.00 63.50 65.04 4p2p n PRO 18 Cb 0.45 -2.10 -0.09 0.00 -0.04 0.00 0.00 33.50 31.72 4p2p n PRO 18 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 4p2p h LEU 19 N 0.00 -1.99 0.09 1.53 5.85 -1.96 0.29 115.31 119.12 4p2p h LEU 19 Ca 0.28 0.30 -0.00 0.00 0.84 0.00 0.00 57.88 59.30 4p2p h LEU 19 Cb 0.51 0.87 0.00 0.00 0.37 0.00 0.00 40.66 42.42 4p2p h LEU 19 CO -0.91 -0.23 -0.04 0.24 -0.34 0.00 0.00 178.44 177.15 4p2p h MET 20 N -0.04 -0.12 0.99 1.25 2.86 -1.62 -2.98 114.93 115.27 4p2p h MET 20 Ca 0.14 0.01 -0.05 0.00 -2.06 0.00 0.00 59.70 57.74 4p2p h MET 20 Cb 0.40 0.03 0.01 0.00 0.06 0.00 0.00 31.60 32.10 4p2p h MET 20 CO -0.84 0.14 -0.49 -0.44 1.06 0.00 0.00 176.91 176.34 4p2p h ASP 21 N -0.37 -1.16 0.04 1.22 3.32 -0.35 -3.36 116.42 115.75 4p2p h ASP 21 Ca -0.01 0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.08 4p2p h ASP 21 Cb 0.31 0.30 0.00 0.00 0.22 0.00 0.00 39.33 40.17 4p2p h ASP 21 CO 0.02 -0.82 -0.51 0.49 -1.72 0.00 0.00 179.24 176.70 4p2p n PHE 22 N -5.67 0.00 -2.92 4.55 3.72 0.02 -4.80 117.46 112.35 4p2p n PHE 22 Ca -0.17 0.00 -0.40 0.00 -0.05 0.00 0.00 57.45 56.84 4p2p n PHE 22 Cb 0.53 -0.03 -0.06 0.00 -0.94 0.00 0.00 39.48 38.99 4p2p n PHE 22 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 4p2p s ASN 23 N -2.56 7.45 -1.22 4.37 3.04 -1.13 -3.94 114.94 120.95 4p2p s ASN 23 Ca 0.18 1.71 -0.09 0.00 0.04 0.00 0.00 52.86 54.70 4p2p s ASN 23 Cb 0.18 -2.53 -0.01 0.00 -1.54 0.00 0.00 41.25 37.35 4p2p s ASN 23 CO 0.60 0.19 0.73 0.59 -3.04 0.00 0.00 177.10 176.17 4p2p n ASN 24 N 1.64 -3.45 -4.29 -4.21 5.03 0.27 -4.81 115.26 105.44 4p2p n ASN 24 Ca -0.05 -0.91 -0.30 0.00 0.87 0.00 0.00 54.58 54.20 4p2p n ASN 24 Cb 0.48 -3.82 -0.16 0.00 -1.02 0.00 0.00 39.78 35.26 4p2p n ASN 24 CO 0.00 0.00 0.00 -0.47 -1.83 0.00 0.00 177.26 174.96 4p2p s TYR 25 N -3.59 2.24 0.00 3.10 6.14 -0.52 -0.37 117.35 124.36 4p2p s TYR 25 Ca 0.25 -0.46 0.00 0.00 0.64 0.00 0.00 57.07 57.51 4p2p s TYR 25 Cb -0.08 -1.45 0.00 0.00 0.42 0.00 0.00 41.96 40.86 4p2p s TYR 25 CO 0.83 -0.06 0.00 0.41 0.64 0.00 0.00 175.55 177.37 4p2p n GLY 26 N 2.53 2.24 0.08 8.97 0.00 -0.41 -2.46 105.19 116.14 4p2p n GLY 26 Ca -0.16 -0.24 -0.05 0.00 0.00 0.00 0.00 46.02 45.57 4p2p n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 4p2p n TYR 28 N -2.63 0.00 -2.01 0.00 4.01 -1.25 -3.66 117.16 111.62 4p2p n TYR 28 Ca -0.26 0.00 -0.34 0.00 -0.16 0.00 0.00 57.90 57.14 4p2p n TYR 28 Cb 1.01 -0.39 -0.04 0.00 -0.31 0.00 0.00 39.34 39.61 4p2p n TYR 28 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 4p2p n GLY 30 N 6.13 3.03 3.76 0.00 0.00 -1.26 -0.56 105.19 116.27 4p2p n GLY 30 Ca 0.28 -1.69 -0.41 0.00 0.00 0.00 0.00 46.02 44.20 4p2p n GLY 30 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 4p2p n LEU 31 N 0.00 4.52 0.00 0.99 7.94 -1.26 -4.62 117.00 124.57 4p2p n LEU 31 Ca 0.00 1.17 0.00 0.00 -1.11 0.00 0.00 56.01 56.07 4p2p n LEU 31 Cb 0.00 -1.61 0.00 0.00 0.53 0.00 0.00 43.42 42.34 4p2p n LEU 31 CO 0.00 0.18 0.00 0.61 -1.11 0.00 0.00 177.39 177.07 4p2p n GLY 32 N 1.72 -0.79 0.00 -3.96 0.00 -1.26 -5.02 105.19 95.88 4p2p n GLY 32 Ca 0.07 -1.16 0.00 0.00 0.00 0.00 0.00 46.02 44.93 4p2p n GLY 32 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 4p2p n GLY 33 N 0.00 3.48 3.60 -0.02 0.00 -1.26 -4.72 105.19 106.28 4p2p n GLY 33 Ca 0.00 -0.57 -0.09 0.00 0.00 0.00 0.00 46.02 45.36 4p2p n GLY 33 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 4p2p s SER 34 N 0.00 -0.25 0.40 1.61 1.04 -1.24 -5.01 113.70 110.25 4p2p s SER 34 Ca 0.00 -0.55 0.00 0.00 0.48 0.00 0.00 55.95 55.88 4p2p s SER 34 Cb 0.00 0.62 0.00 0.00 0.10 0.00 0.00 66.02 66.74 4p2p s SER 34 CO 0.00 -1.13 0.00 0.61 0.98 0.00 0.00 173.24 173.70 4p2p n GLY 35 N -0.38 -0.18 3.44 7.32 0.00 -1.25 -4.80 105.19 109.34 4p2p n GLY 35 Ca -0.08 -1.02 -0.33 0.00 0.00 0.00 0.00 46.02 44.60 4p2p n GLY 35 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 4p2p s THR 36 N 0.00 3.06 0.41 2.61 2.01 -1.26 -5.10 115.64 117.37 4p2p s THR 36 Ca 0.00 -0.70 -0.25 0.00 0.31 0.00 0.00 61.69 61.05 4p2p s THR 36 Cb 0.00 -2.23 -0.10 0.00 0.01 0.00 0.00 72.50 70.18 4p2p s THR 36 CO 0.00 0.57 1.20 -0.81 -0.69 0.00 0.00 174.62 174.88 4p2p n PRO 37 N 2.73 1.77 0.14 4.92 -0.04 -1.26 -4.86 135.00 138.41 4p2p n PRO 37 Ca -0.18 0.63 0.13 0.00 -0.04 0.00 0.00 63.50 64.04 4p2p n PRO 37 Cb 0.52 -2.27 0.34 0.00 -0.04 0.00 0.00 33.50 32.06 4p2p n PRO 37 CO 0.00 0.00 0.00 -0.39 -0.04 0.00 0.00 175.50 175.07 4p2p h VAL 38 N 1.97 0.00 -2.04 0.52 -1.51 -1.94 -3.47 116.25 109.78 4p2p h VAL 38 Ca -0.46 -0.62 0.02 0.00 -1.23 0.00 0.00 66.70 64.40 4p2p h VAL 38 Cb 1.31 1.61 -0.00 0.00 -2.13 0.00 0.00 31.29 32.08 4p2p h VAL 38 CO 0.59 0.00 0.12 -0.90 -1.23 0.00 0.00 177.57 176.16 4p2p n ASP 39 N -2.53 -0.55 -0.09 4.19 5.68 -1.26 -5.04 116.55 116.95 4p2p n ASP 39 Ca 0.05 -1.33 -0.11 0.00 -0.50 0.00 0.00 54.79 52.89 4p2p n ASP 39 Cb 0.45 0.90 -0.04 0.00 -1.14 0.00 0.00 41.12 41.30 4p2p n ASP 39 CO 0.00 0.00 0.00 -0.08 -1.33 0.00 0.00 177.20 175.79 4p2p h GLU 40 N 0.00 0.44 -0.44 0.11 4.57 -1.92 -1.66 114.58 115.69 4p2p h GLU 40 Ca -0.08 -0.12 -0.04 0.00 -1.18 0.00 0.00 59.36 57.94 4p2p h GLU 40 Cb 0.34 -0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 28.86 4p2p h GLU 40 CO 0.11 0.57 0.13 1.25 -1.18 0.00 0.00 179.01 179.90 4p2p h LEU 41 N 0.24 0.64 -1.10 1.64 5.85 -1.92 -2.06 115.31 118.59 4p2p h LEU 41 Ca 0.08 -0.21 -0.01 0.00 0.84 0.00 0.00 57.88 58.58 4p2p h LEU 41 Cb 0.35 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.18 4p2p h LEU 41 CO 0.01 0.67 0.43 -0.78 -0.34 0.00 0.00 178.44 178.43 4p2p h ASP 42 N 0.56 0.93 0.35 1.25 3.58 -1.92 -0.35 116.42 120.83 4p2p h ASP 42 Ca 0.14 -0.07 -0.07 0.00 0.42 0.00 0.00 57.03 57.45 4p2p h ASP 42 Cb 0.27 -0.24 -0.01 0.00 1.72 0.00 0.00 39.33 41.07 4p2p h ASP 42 CO -0.00 0.74 -0.35 -0.09 -2.88 0.00 0.00 179.24 176.66 4p2p h ARG 43 N 1.06 0.01 0.01 0.28 1.12 -1.04 -1.23 114.38 114.58 4p2p h ARG 43 Ca 0.27 -0.00 -0.00 0.00 -1.11 0.00 0.00 59.98 59.14 4p2p h ARG 43 Cb 0.01 -0.00 0.00 0.00 -0.01 0.00 0.00 29.97 29.97 4p2p h ARG 43 CO -0.05 0.36 -0.00 0.00 -3.11 0.00 0.00 179.97 177.17 4p2p h GLU 46 N 0.71 0.47 -0.23 0.00 4.81 -1.09 -0.19 114.58 119.06 4p2p h GLU 46 Ca 0.21 -0.07 -0.02 0.00 -0.13 0.00 0.00 59.36 59.35 4p2p h GLU 46 Cb -0.03 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.25 4p2p h GLU 46 CO -0.07 0.43 0.04 1.15 -0.73 0.00 0.00 179.01 179.82 4p2p h THR 47 N 0.40 1.13 -0.09 0.32 2.02 -1.06 0.53 112.91 116.16 4p2p h THR 47 Ca 0.11 -0.46 -0.13 0.00 0.77 0.00 0.00 66.41 66.70 4p2p h THR 47 Cb 0.10 0.92 0.01 0.00 -1.74 0.00 0.00 68.15 67.43 4p2p h THR 47 CO -0.02 0.16 -0.45 -0.74 0.37 0.00 0.00 175.52 174.84 4p2p h HIS 48 N 0.33 0.64 -0.28 3.16 -0.00 -0.95 -1.57 115.15 116.47 4p2p h HIS 48 Ca 0.08 -0.28 0.07 0.00 -0.00 0.00 0.00 60.37 60.23 4p2p h HIS 48 Cb 0.16 -0.10 -0.07 0.00 -0.00 0.00 0.00 27.41 27.40 4p2p h HIS 48 CO 0.00 1.05 -0.21 -0.44 -0.00 0.00 0.00 177.93 178.33 4p2p h ASP 49 N 0.05 -0.69 -0.49 3.26 5.19 -0.45 0.16 116.42 123.45 4p2p h ASP 49 Ca -0.03 0.14 0.00 0.00 -0.62 0.00 0.00 57.03 56.52 4p2p h ASP 49 Cb 1.10 0.34 -0.02 0.00 0.18 0.00 0.00 39.33 40.93 4p2p h ASP 49 CO 0.09 -0.25 0.32 0.78 -3.12 0.00 0.00 179.24 177.07 4p2p h ASN 50 N -0.20 0.56 -0.33 6.45 2.35 -0.90 -0.85 115.58 122.67 4p2p h ASN 50 Ca 0.15 -0.02 -0.01 0.00 -0.55 0.00 0.00 56.30 55.87 4p2p h ASN 50 Cb 0.43 -0.14 -0.02 0.00 0.05 0.00 0.00 38.32 38.64 4p2p h ASN 50 CO -0.40 0.41 0.17 0.00 -1.65 0.00 0.00 177.43 175.96 4p2p h TYR 52 N 0.40 0.86 -0.20 0.00 -1.99 -1.05 -0.20 116.97 114.78 4p2p h TYR 52 Ca 0.11 -0.16 -0.01 0.00 2.00 0.00 0.00 58.73 60.67 4p2p h TYR 52 Cb 0.10 -0.22 -0.01 0.00 2.00 0.00 0.00 36.73 38.60 4p2p h TYR 52 CO -0.02 0.85 0.08 0.00 -0.00 0.00 0.00 178.16 179.07 4p2p h ARG 53 N 0.70 0.31 -0.00 4.88 2.47 -0.73 -2.25 114.38 119.75 4p2p h ARG 53 Ca 0.12 -0.06 0.01 0.00 -1.26 0.00 0.00 59.98 58.79 4p2p h ARG 53 Cb 0.60 -0.05 -0.01 0.00 -1.65 0.00 0.00 29.97 28.86 4p2p h ARG 53 CO 0.04 0.37 -0.04 -0.44 0.56 0.00 0.00 179.97 180.46 4p2p h ASP 54 N 0.18 -0.12 -0.97 7.04 3.45 -0.72 -2.66 116.42 122.61 4p2p h ASP 54 Ca 0.07 0.02 0.18 0.00 0.43 0.00 0.00 57.03 57.73 4p2p h ASP 54 Cb 0.18 0.05 -0.18 0.00 -0.56 0.00 0.00 39.33 38.83 4p2p h ASP 54 CO -0.01 -0.06 -0.29 0.00 -1.57 0.00 0.00 179.24 177.31 4p2p h ALA 55 N 0.92 0.48 -0.75 3.45 0.00 -0.74 0.63 119.26 123.26 4p2p h ALA 55 Ca 0.02 0.34 0.13 0.00 0.00 0.00 0.00 54.91 55.41 4p2p h ALA 55 Cb 0.10 0.82 -0.05 0.00 0.00 0.00 0.00 17.79 18.66 4p2p h ALA 55 CO -0.05 -0.46 0.50 0.87 0.00 0.00 0.00 179.25 180.11 4p2p h LYS 56 N -0.00 0.47 -0.64 0.00 1.57 -1.06 -1.73 116.57 115.17 4p2p h LYS 56 Ca 0.43 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 59.18 4p2p h LYS 56 Cb 0.67 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.88 4p2p h LYS 56 CO -0.99 0.31 0.00 0.09 -0.57 0.00 0.00 179.45 178.29 4p2p n ASN 57 N -4.49 0.82 -4.52 0.86 5.03 0.22 -4.75 115.26 108.43 4p2p n ASN 57 Ca 0.14 -2.02 -0.43 0.00 0.87 0.00 0.00 54.58 53.13 4p2p n ASN 57 Cb 0.47 -0.33 -0.06 0.00 -1.02 0.00 0.00 39.78 38.84 4p2p n ASN 57 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 4p2p s LEU 58 N -0.43 4.43 0.64 3.41 1.43 -0.65 -4.90 118.68 122.61 4p2p s LEU 58 Ca 0.02 -0.34 0.43 0.00 -1.03 0.00 0.00 54.13 53.20 4p2p s LEU 58 Cb 0.01 -2.78 2.31 0.00 0.03 0.00 0.00 46.19 45.77 4p2p s LEU 58 CO 0.01 -0.90 2.31 -2.24 0.23 0.00 0.00 176.35 175.76 4p2p h ASP 59 N 8.99 0.00 0.66 2.29 -0.00 -1.89 0.09 116.42 126.55 4p2p h ASP 59 Ca -0.26 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 56.77 4p2p h ASP 59 Cb 1.09 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 40.42 4p2p h ASP 59 CO 0.95 0.00 -0.45 -1.54 -0.00 0.00 0.00 179.24 178.20 4p2p n SER 60 N -3.01 0.47 -4.36 4.15 3.41 -1.26 -4.78 113.62 108.24 4p2p n SER 60 Ca -0.03 -0.06 -0.34 0.00 -0.26 0.00 0.00 58.87 58.18 4p2p n SER 60 Cb 0.07 0.11 -0.14 0.00 -0.26 0.00 0.00 64.21 64.00 4p2p n SER 60 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 4p2p n LYS 62 N 4.18 1.94 -1.58 0.00 3.00 -1.26 -4.63 118.16 119.81 4p2p n LYS 62 Ca -0.18 -4.31 -0.41 0.00 -0.00 0.00 0.00 58.31 53.41 4p2p n LYS 62 Cb 0.52 -2.06 0.02 0.00 0.00 0.00 0.00 35.03 33.50 4p2p n LYS 62 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.40 178.59 4p2p n PHE 63 N 1.31 0.80 -1.70 5.64 3.72 -1.26 -4.84 117.46 121.12 4p2p n PHE 63 Ca 0.26 0.55 -0.44 0.00 -0.05 0.00 0.00 57.45 57.77 4p2p n PHE 63 Cb 0.42 -2.17 -0.03 0.00 -0.94 0.00 0.00 39.48 36.76 4p2p n PHE 63 CO 0.00 0.00 0.00 -0.11 -0.05 0.00 0.00 176.76 176.60 4p2p n LEU 64 N 0.49 3.63 -4.35 4.37 7.94 -1.26 0.12 117.00 127.94 4p2p n LEU 64 Ca 0.10 1.09 -0.39 0.00 -1.11 0.00 0.00 56.01 55.71 4p2p n LEU 64 Cb 0.40 -1.51 -0.05 0.00 0.53 0.00 0.00 43.42 42.80 4p2p n LEU 64 CO 0.55 -0.08 -0.09 1.33 -1.11 0.00 0.00 177.39 178.00 4p2p n VAL 65 N 3.18 -0.52 -2.31 1.96 0.24 -1.26 -0.11 118.33 119.51 4p2p n VAL 65 Ca 0.14 0.00 -0.07 0.00 -2.04 0.00 0.00 64.34 62.38 4p2p n VAL 65 Cb 0.33 -1.10 -0.01 0.00 -1.47 0.00 0.00 33.84 31.59 4p2p n VAL 65 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 4p2p n ASP 66 N -2.54 -2.51 -4.13 -1.34 8.00 0.12 -4.92 116.55 109.23 4p2p n ASP 66 Ca 0.10 0.31 -0.34 0.00 0.71 0.00 0.00 54.79 55.57 4p2p n ASP 66 Cb 0.47 -2.24 -0.14 0.00 -0.02 0.00 0.00 41.12 39.20 4p2p n ASP 66 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 4p2p s ASN 67 N -1.96 4.86 0.61 -2.24 3.04 0.85 -4.94 114.94 115.15 4p2p s ASN 67 Ca 0.00 -1.50 0.32 0.00 0.04 0.00 0.00 52.86 51.71 4p2p s ASN 67 Cb 0.00 -1.69 1.83 0.00 -1.54 0.00 0.00 41.25 39.85 4p2p s ASN 67 CO 0.00 -0.30 2.19 -0.65 -3.04 0.00 0.00 177.10 175.29 4p2p h PRO 68 N 7.93 0.00 0.00 0.43 0.11 -1.91 -0.29 132.00 138.26 4p2p h PRO 68 Ca -0.18 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.93 4p2p h PRO 68 Cb 1.05 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.16 4p2p h PRO 68 CO 0.54 0.00 0.00 1.88 -0.21 0.00 0.00 178.00 180.21 4p2p h TYR 69 N 0.00 0.00 -0.00 0.65 0.05 -1.94 -0.93 116.97 114.80 4p2p h TYR 69 Ca 0.04 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.82 4p2p h TYR 69 Cb 0.25 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.99 4p2p h TYR 69 CO 0.00 0.00 -0.13 0.25 -1.05 0.00 0.00 178.16 177.23 4p2p n THR 70 N -2.89 0.00 -3.18 -2.88 -2.24 -0.12 -0.35 114.28 102.62 4p2p n THR 70 Ca -0.01 -0.02 -0.40 0.00 -2.27 0.00 0.00 64.05 61.35 4p2p n THR 70 Cb 0.15 -0.22 -0.07 0.00 -2.10 0.00 0.00 70.33 68.09 4p2p n THR 70 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 4p2p s GLU 71 N -2.75 4.13 -0.13 -0.78 2.56 -0.36 -4.84 118.70 116.54 4p2p s GLU 71 Ca 0.21 0.46 -0.13 0.00 0.00 0.00 0.00 54.97 55.51 4p2p s GLU 71 Cb 0.19 -3.62 -0.05 0.00 2.00 0.00 0.00 34.13 32.66 4p2p s GLU 71 CO 0.53 -0.31 0.30 -1.12 -0.56 0.00 0.00 175.26 174.10 4p2p s SER 72 N 1.38 6.50 0.29 -1.70 0.01 -1.26 0.22 113.70 119.14 4p2p s SER 72 Ca 0.25 0.59 0.01 0.00 1.31 0.00 0.00 55.95 58.10 4p2p s SER 72 Cb -0.16 -2.18 -0.00 0.00 0.21 0.00 0.00 66.02 63.89 4p2p s SER 72 CO 0.09 0.16 0.02 0.00 0.41 0.00 0.00 173.24 173.93 4p2p n TYR 73 N 3.13 0.53 -4.73 2.43 0.18 -1.26 -4.89 117.16 112.54 4p2p n TYR 73 Ca -0.13 -1.52 -0.32 0.00 1.88 0.00 0.00 57.90 57.81 4p2p n TYR 73 Cb 0.52 -0.15 -0.17 0.00 -0.38 0.00 0.00 39.34 39.17 4p2p n TYR 73 CO 0.00 0.00 0.00 0.45 -2.08 0.00 0.00 176.86 175.23 4p2p s SER 74 N -2.63 3.12 0.14 9.48 0.15 -1.26 -4.95 113.70 117.76 4p2p s SER 74 Ca 0.04 -0.60 -0.05 0.00 0.70 0.00 0.00 55.95 56.04 4p2p s SER 74 Cb 0.00 -1.44 -0.02 0.00 -1.71 0.00 0.00 66.02 62.84 4p2p s SER 74 CO 0.02 0.09 0.16 -0.72 1.20 0.00 0.00 173.24 174.00 4p2p s TYR 75 N 0.76 0.58 0.04 3.44 -0.85 -1.26 0.36 117.35 120.42 4p2p s TYR 75 Ca -0.08 -0.97 0.05 0.00 -0.52 0.00 0.00 57.07 55.54 4p2p s TYR 75 Cb -0.16 -0.26 -0.02 0.00 0.38 0.00 0.00 41.96 41.90 4p2p s TYR 75 CO -0.01 -0.60 -0.13 -1.54 -1.52 0.00 0.00 175.55 171.75 4p2p s SER 76 N -2.99 1.57 -0.28 -0.18 1.04 0.17 -4.90 113.70 108.13 4p2p s SER 76 Ca 0.19 -0.48 0.03 0.00 0.48 0.00 0.00 55.95 56.17 4p2p s SER 76 Cb 0.05 -0.09 0.07 0.00 0.10 0.00 0.00 66.02 66.16 4p2p s SER 76 CO -0.01 0.00 -0.05 0.00 0.98 0.00 0.00 173.24 174.16 4p2p s SER 78 N 1.10 3.97 -0.96 0.00 0.15 -1.02 -4.91 113.70 112.02 4p2p s SER 78 Ca -0.02 -2.26 -0.05 0.00 0.70 0.00 0.00 55.95 54.32 4p2p s SER 78 Cb -0.19 -1.09 -0.06 0.00 -1.71 0.00 0.00 66.02 62.96 4p2p s SER 78 CO -0.07 -0.33 0.84 -3.20 1.20 0.00 0.00 173.24 171.69 4p2p n ASN 79 N 4.05 -5.96 0.00 5.45 4.05 -1.26 -3.25 115.26 118.33 4p2p n ASN 79 Ca 0.04 -0.64 0.00 0.00 0.45 0.00 0.00 54.58 54.43 4p2p n ASN 79 Cb 0.38 -4.79 0.00 0.00 1.23 0.00 0.00 39.78 36.60 4p2p n ASN 79 CO 0.00 0.00 0.00 0.41 -3.05 0.00 0.00 177.26 174.62 4p2p n THR 80 N -3.13 0.00 -4.58 -0.44 -1.04 -1.26 -5.02 114.28 98.81 4p2p n THR 80 Ca -0.08 0.00 -0.34 0.00 -2.04 0.00 0.00 64.05 61.59 4p2p n THR 80 Cb 0.61 -0.01 -0.11 0.00 -1.82 0.00 0.00 70.33 69.00 4p2p n THR 80 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 4p2p s GLU 81 N -0.03 2.89 -0.14 -2.82 0.41 -1.20 -4.73 118.70 113.09 4p2p s GLU 81 Ca 0.00 -0.53 -0.04 0.00 -0.41 0.00 0.00 54.97 53.99 4p2p s GLU 81 Cb 0.00 -2.65 -0.03 0.00 -1.78 0.00 0.00 34.13 29.67 4p2p s GLU 81 CO 0.00 0.61 0.00 0.42 -0.49 0.00 0.00 175.26 175.81 4p2p s ILE 82 N -0.66 4.30 -0.03 -1.63 1.01 -1.26 -2.44 121.20 120.49 4p2p s ILE 82 Ca 0.10 -0.23 0.05 0.00 0.00 0.00 0.00 60.65 60.58 4p2p s ILE 82 Cb -0.11 -2.87 -0.01 0.00 0.01 0.00 0.00 42.46 39.47 4p2p s ILE 82 CO 0.02 0.53 -0.18 -0.89 0.00 0.00 0.00 174.94 174.42 4p2p s THR 83 N -0.12 1.44 -0.18 2.92 2.01 -0.51 -4.99 115.64 116.22 4p2p s THR 83 Ca 0.04 -0.76 -0.15 0.00 0.31 0.00 0.00 61.69 61.14 4p2p s THR 83 Cb -0.13 -1.21 -0.04 0.00 0.01 0.00 0.00 72.50 71.13 4p2p s THR 83 CO 0.02 0.41 0.33 0.00 -0.69 0.00 0.00 174.62 174.69 4p2p n ASN 85 N 3.93 2.70 0.01 0.00 2.85 0.16 -4.86 115.26 120.05 4p2p n ASN 85 Ca -0.11 1.18 0.12 0.00 -0.11 0.00 0.00 54.58 55.67 4p2p n ASN 85 Cb 0.52 -1.46 0.52 0.00 1.24 0.00 0.00 39.78 40.60 4p2p n ASN 85 CO 0.00 0.00 0.00 -1.54 -2.11 0.00 0.00 177.26 173.61 4p2p n SER 86 N 1.25 0.06 -0.63 1.20 3.41 -1.26 -2.99 113.62 114.66 4p2p n SER 86 Ca 0.07 0.51 0.12 0.00 -0.26 0.00 0.00 58.87 59.31 4p2p n SER 86 Cb 0.34 -0.52 0.38 0.00 -0.26 0.00 0.00 64.21 64.15 4p2p n SER 86 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 4p2p n LYS 87 N -1.56 1.85 -2.10 4.33 5.02 -1.26 -4.91 118.16 119.53 4p2p n LYS 87 Ca 0.06 -1.26 -0.35 0.00 -2.02 0.00 0.00 58.31 54.74 4p2p n LYS 87 Cb 0.30 -1.43 0.02 0.00 -0.02 0.00 0.00 35.03 33.89 4p2p n LYS 87 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 4p2p s ASN 88 N -1.70 5.50 0.86 4.39 0.01 -1.16 -5.01 114.94 117.83 4p2p s ASN 88 Ca 0.34 2.15 -0.12 0.00 -0.71 0.00 0.00 52.86 54.52 4p2p s ASN 88 Cb 0.19 -2.58 0.11 0.00 0.41 0.00 0.00 41.25 39.38 4p2p s ASN 88 CO 0.29 -1.37 1.18 0.54 -1.51 0.00 0.00 177.10 176.23 4p2p s ASN 89 N -1.96 4.06 0.30 -1.22 2.20 -1.26 -4.59 114.94 112.47 4p2p s ASN 89 Ca 0.72 0.80 0.05 0.00 -0.94 0.00 0.00 52.86 53.49 4p2p s ASN 89 Cb -0.24 -1.28 0.75 0.00 -2.00 0.00 0.00 41.25 38.48 4p2p s ASN 89 CO 0.31 -2.19 1.73 0.00 -2.94 0.00 0.00 177.10 174.02 4p2p h ALA 90 N -1.25 1.57 0.19 3.54 0.00 -1.97 0.54 119.26 121.88 4p2p h ALA 90 Ca -0.47 0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.55 4p2p h ALA 90 Cb 1.32 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.15 4p2p h ALA 90 CO 0.63 -0.23 -0.09 0.00 0.00 0.00 0.00 179.25 179.56 4p2p h GLU 92 N -0.59 0.38 -0.50 0.00 5.08 -1.80 -2.07 114.58 115.08 4p2p h GLU 92 Ca -0.03 -0.02 0.10 0.00 -1.00 0.00 0.00 59.36 58.41 4p2p h GLU 92 Cb 0.44 -0.08 -0.08 0.00 0.50 0.00 0.00 28.75 29.52 4p2p h GLU 92 CO 0.04 0.25 -0.02 0.00 -1.00 0.00 0.00 179.01 178.28 4p2p h ALA 93 N 1.21 0.45 0.39 3.43 0.00 0.07 0.53 119.26 125.33 4p2p h ALA 93 Ca 0.17 0.16 -0.01 0.00 0.00 0.00 0.00 54.91 55.22 4p2p h ALA 93 Cb 0.08 0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 4p2p h ALA 93 CO -0.12 -0.40 -0.27 0.35 0.00 0.00 0.00 179.25 178.81 4p2p h PHE 94 N 0.09 -0.72 -0.71 0.00 3.04 -1.02 -1.91 116.94 115.70 4p2p h PHE 94 Ca 0.25 -0.00 0.00 0.00 3.98 0.00 0.00 57.97 62.20 4p2p h PHE 94 Cb 0.38 0.26 -0.03 0.00 2.56 0.00 0.00 35.95 39.12 4p2p h PHE 94 CO -0.33 -0.41 0.45 0.82 -2.02 0.00 0.00 178.31 176.82 4p2p h ILE 95 N -0.65 1.19 -0.27 1.41 1.08 -1.16 -2.25 117.51 116.85 4p2p h ILE 95 Ca -0.04 -0.39 0.07 0.00 -0.39 0.00 0.00 64.86 64.11 4p2p h ILE 95 Cb 0.55 0.17 -0.08 0.00 -3.07 0.00 0.00 36.82 34.40 4p2p h ILE 95 CO 0.02 0.19 -0.28 0.00 -0.69 0.00 0.00 178.15 177.39 4p2p h ASN 97 N -0.28 1.07 -0.32 0.00 4.21 -1.19 0.11 115.58 119.18 4p2p h ASN 97 Ca 0.14 -0.06 0.04 0.00 1.21 0.00 0.00 56.30 57.62 4p2p h ASN 97 Cb 0.50 -0.27 -0.03 0.00 -1.12 0.00 0.00 38.32 37.40 4p2p h ASN 97 CO -0.43 0.83 0.11 0.00 -1.29 0.00 0.00 177.43 176.65 4p2p h ASP 99 N 0.25 -0.46 -0.19 0.00 3.45 -1.11 -1.34 116.42 117.02 4p2p h ASP 99 Ca 0.14 -0.05 0.05 0.00 0.43 0.00 0.00 57.03 57.61 4p2p h ASP 99 Cb 0.12 0.12 -0.06 0.00 -0.56 0.00 0.00 39.33 38.94 4p2p h ASP 99 CO -0.15 -0.24 -0.24 -0.09 -1.57 0.00 0.00 179.24 176.95 4p2p h ARG 100 N -0.66 -0.26 -0.93 3.56 2.43 -0.62 -1.10 114.38 116.79 4p2p h ARG 100 Ca -0.06 0.02 0.07 0.00 -0.81 0.00 0.00 59.98 59.20 4p2p h ARG 100 Cb 0.48 0.06 -0.06 0.00 -0.42 0.00 0.00 29.97 30.03 4p2p h ARG 100 CO 0.09 -0.17 0.60 -0.91 -1.51 0.00 0.00 179.97 178.07 4p2p h ASN 101 N -0.27 0.93 -0.04 -3.80 2.35 -0.40 -2.47 115.58 111.88 4p2p h ASN 101 Ca 0.12 0.01 -0.00 0.00 -0.55 0.00 0.00 56.30 55.88 4p2p h ASN 101 Cb 0.45 -0.19 -0.00 0.00 0.05 0.00 0.00 38.32 38.63 4p2p h ASN 101 CO -0.35 0.59 0.01 0.00 -1.65 0.00 0.00 177.43 176.03 4p2p h ALA 102 N 1.50 0.05 -0.12 -0.83 0.00 -0.09 -1.96 119.26 117.80 4p2p h ALA 102 Ca 0.41 -0.12 0.04 0.00 0.00 0.00 0.00 54.91 55.23 4p2p h ALA 102 Cb 0.21 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.95 4p2p h ALA 102 CO -0.16 -0.33 -0.11 0.00 0.00 0.00 0.00 179.25 178.65 4p2p h ALA 103 N 0.78 -0.02 -0.03 0.00 0.00 -0.81 0.23 119.26 119.41 4p2p h ALA 103 Ca 0.01 0.05 0.02 0.00 0.00 0.00 0.00 54.91 54.99 4p2p h ALA 103 Cb 0.24 0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.24 4p2p h ALA 103 CO 0.00 -0.56 -0.10 0.82 0.00 0.00 0.00 179.25 179.41 4p2p h ILE 104 N -0.13 0.73 -0.46 0.00 2.04 -1.51 -1.07 117.51 117.12 4p2p h ILE 104 Ca 0.08 0.00 0.06 0.00 1.00 0.00 0.00 64.86 66.00 4p2p h ILE 104 Cb 0.25 0.73 -0.09 0.00 -0.74 0.00 0.00 36.82 36.98 4p2p h ILE 104 CO -0.20 0.00 -0.55 0.00 0.00 0.00 0.00 178.15 177.40 4p2p h PHE 106 N -0.36 0.81 0.41 0.00 -1.00 -0.28 -2.94 116.94 113.58 4p2p h PHE 106 Ca 0.09 0.02 -0.02 0.00 2.81 0.00 0.00 57.97 60.87 4p2p h PHE 106 Cb 0.58 -0.26 0.00 0.00 3.61 0.00 0.00 35.95 39.89 4p2p h PHE 106 CO -0.74 0.31 -0.20 0.66 -1.61 0.00 0.00 178.31 176.74 4p2p h SER 107 N 0.70 -0.47 0.00 2.17 4.64 0.11 -3.09 113.55 117.61 4p2p h SER 107 Ca 0.44 -0.07 0.00 0.00 -0.47 0.00 0.00 61.79 61.69 4p2p h SER 107 Cb 0.68 0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.89 4p2p h SER 107 CO -0.20 -0.22 0.00 0.29 -0.87 0.00 0.00 176.83 175.84 4p2p n LYS 108 N -5.27 0.81 -4.09 4.77 5.02 -0.84 -4.88 118.16 113.69 4p2p n LYS 108 Ca -0.11 0.00 -0.31 0.00 -2.02 0.00 0.00 58.31 55.87 4p2p n LYS 108 Cb 0.27 -1.43 -0.07 0.00 -0.02 0.00 0.00 35.03 33.78 4p2p n LYS 108 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 4p2p s ALA 109 N -2.00 3.50 0.16 7.82 0.00 -1.12 -5.08 121.76 125.04 4p2p s ALA 109 Ca 0.33 -1.00 -0.30 0.00 0.00 0.00 0.00 51.96 50.99 4p2p s ALA 109 Cb 0.15 -1.41 -0.07 0.00 0.00 0.00 0.00 23.12 21.79 4p2p s ALA 109 CO 0.26 0.73 1.17 -1.25 0.00 0.00 0.00 175.76 176.67 4p2p s PRO 110 N -2.20 4.50 -0.13 0.00 0.05 -1.26 -4.93 135.00 131.03 4p2p s PRO 110 Ca 0.27 1.81 -0.13 0.00 0.05 0.00 0.00 61.00 63.00 4p2p s PRO 110 Cb -0.12 -3.27 -0.05 0.00 0.05 0.00 0.00 34.50 31.11 4p2p s PRO 110 CO 0.19 -0.09 0.29 -0.47 0.05 0.00 0.00 177.00 176.98 4p2p s TYR 111 N 0.14 3.51 -0.27 0.56 6.14 -1.26 -4.38 117.35 121.79 4p2p s TYR 111 Ca 0.53 0.64 -0.01 0.00 0.64 0.00 0.00 57.07 58.87 4p2p s TYR 111 Cb -0.31 -2.29 0.04 0.00 0.42 0.00 0.00 41.96 39.83 4p2p s TYR 111 CO 0.35 0.35 -0.04 -0.80 0.64 0.00 0.00 175.55 176.04 4p2p s ASN 112 N 0.08 4.58 0.49 4.32 0.02 -1.26 -4.97 114.94 118.20 4p2p s ASN 112 Ca 0.17 -1.14 0.26 0.00 -1.02 0.00 0.00 52.86 51.13 4p2p s ASN 112 Cb -0.13 -1.66 1.33 0.00 0.02 0.00 0.00 41.25 40.81 4p2p s ASN 112 CO 0.05 -0.20 1.88 0.11 0.02 0.00 0.00 177.10 178.96 4p2p h LYS 113 N 7.96 0.15 -0.73 -0.60 1.57 -1.98 0.16 116.57 123.10 4p2p h LYS 113 Ca -0.25 -0.01 0.07 0.00 -1.87 0.00 0.00 60.65 58.59 4p2p h LYS 113 Cb 1.08 -0.03 -0.06 0.00 0.08 0.00 0.00 32.23 33.29 4p2p h LYS 113 CO 0.54 0.10 0.41 0.93 -0.57 0.00 0.00 179.45 180.86 4p2p h GLU 114 N 0.15 0.71 0.00 3.15 3.07 -2.01 -2.21 114.58 117.44 4p2p h GLU 114 Ca 0.44 -0.04 0.00 0.00 -0.50 0.00 0.00 59.36 59.26 4p2p h GLU 114 Cb 1.50 -0.16 0.00 0.00 -0.84 0.00 0.00 28.75 29.25 4p2p h GLU 114 CO -0.08 0.47 0.00 0.72 -1.40 0.00 0.00 179.01 178.73 4p2p n HIS 115 N -4.76 0.00 -2.44 4.33 8.25 0.04 -4.77 115.22 115.87 4p2p n HIS 115 Ca 0.10 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 57.16 4p2p n HIS 115 Cb 0.21 -0.23 -0.04 0.00 1.12 0.00 0.00 29.99 31.05 4p2p n HIS 115 CO 0.00 0.00 0.00 0.21 0.64 0.00 0.00 176.34 177.19 4p2p s LYS 116 N -2.45 4.57 -0.76 -0.41 2.20 -0.83 -1.29 119.74 120.76 4p2p s LYS 116 Ca 0.18 1.83 -0.05 0.00 -0.36 0.00 0.00 55.97 57.56 4p2p s LYS 116 Cb 0.11 -3.13 0.01 0.00 -1.51 0.00 0.00 37.83 33.31 4p2p s LYS 116 CO 0.24 0.14 0.62 0.09 -0.36 0.00 0.00 175.35 176.09 4p2p n ASN 117 N 1.05 -5.43 -4.92 1.43 4.13 0.50 -4.91 115.26 107.11 4p2p n ASN 117 Ca -0.01 -0.71 -0.26 0.00 1.68 0.00 0.00 54.58 55.29 4p2p n ASN 117 Cb 0.45 -2.29 0.03 0.00 -1.54 0.00 0.00 39.78 36.42 4p2p n ASN 117 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 4p2p s LEU 118 N -4.49 3.34 -1.25 3.41 2.96 -1.25 -4.96 118.68 116.44 4p2p s LEU 118 Ca 0.05 0.63 -0.12 0.00 -0.22 0.00 0.00 54.13 54.47 4p2p s LEU 118 Cb -0.01 -3.48 0.16 0.00 0.50 0.00 0.00 46.19 43.37 4p2p s LEU 118 CO 0.87 -0.96 1.66 -0.67 -1.32 0.00 0.00 176.35 175.93 4p2p n ASP 119 N -2.46 5.13 -0.31 3.68 -0.08 -1.26 -4.83 116.55 116.43 4p2p n ASP 119 Ca 0.04 -3.04 0.27 0.00 -1.51 0.00 0.00 54.79 50.55 4p2p n ASP 119 Cb 0.57 -1.53 0.61 0.00 2.34 0.00 0.00 41.12 43.11 4p2p n ASP 119 CO 0.00 0.00 0.00 0.71 0.12 0.00 0.00 177.20 178.03 4p2p h THR 120 N 4.24 0.49 0.00 5.18 1.35 -1.93 0.28 112.91 122.52 4p2p h THR 120 Ca 0.36 -0.08 0.00 0.00 -0.55 0.00 0.00 66.41 66.14 4p2p h THR 120 Cb 0.75 0.24 0.00 0.00 -1.73 0.00 0.00 68.15 67.42 4p2p h THR 120 CO 1.44 0.04 0.00 0.29 -0.25 0.00 0.00 175.52 177.04 4p2p n LYS 121 N -4.45 0.14 -0.03 4.72 5.02 -1.26 -2.38 118.16 119.93 4p2p n LYS 121 Ca 0.25 0.48 -0.03 0.00 -2.02 0.00 0.00 58.31 56.98 4p2p n LYS 121 Cb 1.00 -1.83 -0.03 0.00 -0.02 0.00 0.00 35.03 34.15 4p2p n LYS 121 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 4p2p n LYS 122 N -2.11 1.28 -0.02 1.97 4.81 0.86 -4.79 118.16 120.15 4p2p n LYS 122 Ca 0.01 0.02 0.08 0.00 -0.87 0.00 0.00 58.31 57.55 4p2p n LYS 122 Cb 0.15 -1.11 0.08 0.00 0.02 0.00 0.00 35.03 34.16 4p2p n LYS 122 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 4p2p n TYR 123 N -2.48 0.06 0.32 5.64 4.01 -0.54 -5.11 117.16 119.05 4p2p n TYR 123 Ca -0.09 -0.04 0.04 0.00 -0.16 0.00 0.00 57.90 57.65 4p2p n TYR 123 Cb 0.62 -0.00 0.03 0.00 -0.31 0.00 0.00 39.34 39.68 4p2p n TYR 123 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40