#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x6p n THR 26 N 0.00 0.55 -1.77 2.61 -2.24 -1.26 -5.01 114.28 107.16 1x6p n THR 26 Ca 0.00 -0.78 -0.40 0.00 -2.27 0.00 0.00 64.05 60.60 1x6p n THR 26 Cb 0.00 0.88 0.02 0.00 -2.10 0.00 0.00 70.33 69.12 1x6p n THR 26 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1x6p s GLU 27 N -1.16 3.73 -1.02 -0.78 2.12 -1.26 -4.89 118.70 115.43 1x6p s GLU 27 Ca 0.27 2.48 -0.08 0.00 0.36 0.00 0.00 54.97 58.01 1x6p s GLU 27 Cb 0.16 -2.70 -0.10 0.00 0.26 0.00 0.00 34.13 31.75 1x6p s GLU 27 CO 0.22 -0.81 3.05 1.19 -0.54 0.00 0.00 175.26 178.37 1x6p n PHE 28 N -0.12 1.70 -0.32 5.30 0.99 -1.26 -4.77 117.46 118.98 1x6p n PHE 28 Ca 0.04 -2.51 0.01 0.00 -0.00 0.00 0.00 57.45 55.00 1x6p n PHE 28 Cb 0.41 -2.05 0.15 0.00 -1.00 0.00 0.00 39.48 36.99 1x6p n PHE 28 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1x6p h ALA 29 N 4.20 1.23 -0.40 4.37 0.00 -1.99 -1.05 119.26 125.63 1x6p h ALA 29 Ca 0.62 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 55.43 1x6p h ALA 29 Cb 0.67 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 1x6p h ALA 29 CO 1.23 0.30 -0.12 0.07 0.00 0.00 0.00 179.25 180.73 1x6p h ARG 30 N 1.00 0.78 -0.00 0.00 -0.00 -1.90 -3.00 114.38 111.26 1x6p h ARG 30 Ca 0.39 -0.31 -0.11 0.00 -0.00 0.00 0.00 59.98 59.95 1x6p h ARG 30 Cb 0.19 -0.04 -0.02 0.00 -0.00 0.00 0.00 29.97 30.11 1x6p h ARG 30 CO -0.18 0.92 -0.54 0.66 -0.00 0.00 0.00 179.97 180.83 1x6p h SER 31 N 0.59 0.01 -0.40 0.08 4.64 -1.85 -2.47 113.55 114.15 1x6p h SER 31 Ca 0.10 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 1x6p h SER 31 Cb 0.65 -0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.72 1x6p h SER 31 CO 0.04 0.54 0.26 -0.33 -0.87 0.00 0.00 176.83 176.48 1x6p h GLU 32 N 0.01 0.53 -0.73 4.77 5.08 -1.15 -0.21 114.58 122.87 1x6p h GLU 32 Ca -0.01 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.29 1x6p h GLU 32 Cb 0.95 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 30.05 1x6p h GLU 32 CO 0.07 0.36 0.35 0.78 -1.00 0.00 0.00 179.01 179.57 1x6p h GLY 33 N 0.54 1.14 1.06 -3.84 0.00 -1.35 -0.93 103.07 99.68 1x6p h GLY 33 Ca 0.15 -0.57 -0.09 0.00 0.00 0.00 0.00 47.33 46.82 1x6p h GLY 33 CO -0.03 0.54 0.00 0.00 0.00 0.00 0.00 176.54 177.05 1x6p h ALA 34 N 1.17 0.76 -0.59 3.60 0.00 -1.19 -1.75 119.26 121.27 1x6p h ALA 34 Ca 0.25 -0.30 -0.06 0.00 0.00 0.00 0.00 54.91 54.80 1x6p h ALA 34 Cb 0.13 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1x6p h ALA 34 CO -0.03 0.59 0.14 1.03 0.00 0.00 0.00 179.25 180.98 1x6p h SER 35 N 0.89 0.89 -0.16 0.00 0.87 -0.78 -1.47 113.55 113.79 1x6p h SER 35 Ca 0.16 -0.23 -0.01 0.00 -1.23 0.00 0.00 61.79 60.48 1x6p h SER 35 Cb 0.54 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 62.26 1x6p h SER 35 CO 0.03 0.89 0.07 0.00 -0.53 0.00 0.00 176.83 177.29 1x6p h ALA 36 N 1.03 0.21 -0.66 6.23 0.00 -1.04 -2.56 119.26 122.47 1x6p h ALA 36 Ca 0.18 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 1x6p h ALA 36 Cb 0.35 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 1x6p h ALA 36 CO 0.00 -0.21 0.25 1.25 0.00 0.00 0.00 179.25 180.54 1x6p h LEU 37 N 0.12 0.90 -2.26 0.00 5.85 -1.22 -2.22 115.31 116.48 1x6p h LEU 37 Ca 0.06 -0.13 -0.00 0.00 0.84 0.00 0.00 57.88 58.64 1x6p h LEU 37 Cb 0.15 -0.23 -0.00 0.00 0.37 0.00 0.00 40.66 40.95 1x6p h LEU 37 CO -0.01 0.82 -0.02 0.00 -0.34 0.00 0.00 178.44 178.89 1x6p h ALA 38 N 1.31 1.07 0.00 1.25 0.00 -1.01 1.00 119.26 122.88 1x6p h ALA 38 Ca 0.22 -0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.96 1x6p h ALA 38 Cb 0.21 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 1x6p h ALA 38 CO -0.02 0.03 -0.76 0.77 0.00 0.00 0.00 179.25 179.27 1x6p h SER 39 N 0.00 0.00 0.00 0.00 0.02 -1.00 -3.39 113.55 109.18 1x6p h SER 39 Ca -0.00 0.00 -0.18 0.00 -0.84 0.00 0.00 61.79 60.77 1x6p h SER 39 Cb 0.24 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.74 1x6p h SER 39 CO 0.00 0.67 -1.83 1.33 -1.14 0.00 0.00 176.83 175.87 1x6p n VAL 40 N -3.23 0.66 -0.22 2.27 0.24 -0.80 -4.68 118.33 112.57 1x6p n VAL 40 Ca -0.00 -0.49 0.00 0.00 -2.04 0.00 0.00 64.34 61.81 1x6p n VAL 40 Cb 0.81 -0.43 0.11 0.00 -1.47 0.00 0.00 33.84 32.87 1x6p n VAL 40 CO 0.00 0.00 0.00 -1.13 -2.14 0.00 0.00 176.83 173.56 1x6p h ASN 41 N 0.00 0.37 0.30 -1.34 -1.24 -1.02 -1.42 115.58 111.23 1x6p h ASN 41 Ca -0.26 0.06 -0.01 0.00 0.71 0.00 0.00 56.30 56.81 1x6p h ASN 41 Cb 1.50 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 40.55 1x6p h ASN 41 CO 0.01 0.22 -0.03 -0.65 -1.29 0.00 0.00 177.43 175.70 1x6p h PRO 42 N 0.52 0.00 0.00 6.67 0.11 -1.83 -2.47 132.00 135.00 1x6p h PRO 42 Ca 0.32 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.43 1x6p h PRO 42 Cb 0.34 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.45 1x6p h PRO 42 CO -0.27 0.03 0.00 -0.07 -0.21 0.00 0.00 178.00 177.48 1x6p h LEU 43 N 0.00 0.00 -0.84 2.35 3.38 -1.54 -2.78 115.31 115.89 1x6p h LEU 43 Ca -0.00 0.00 0.02 0.00 0.09 0.00 0.00 57.88 57.99 1x6p h LEU 43 Cb 0.19 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 40.89 1x6p h LEU 43 CO 0.00 0.00 0.55 0.11 0.09 0.00 0.00 178.44 179.19 1x6p h LYS 44 N 0.00 1.05 -0.26 1.13 1.57 -1.55 -0.80 116.57 117.71 1x6p h LYS 44 Ca 0.00 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.71 1x6p h LYS 44 Cb 0.38 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 32.44 1x6p h LYS 44 CO 0.00 0.69 0.13 1.15 -0.57 0.00 0.00 179.45 180.85 1x6p h THR 45 N 1.08 1.14 -0.49 -0.16 2.02 -1.70 -1.08 112.91 113.72 1x6p h THR 45 Ca 0.32 -0.41 0.06 0.00 0.77 0.00 0.00 66.41 67.16 1x6p h THR 45 Cb -0.04 0.94 -0.05 0.00 -1.74 0.00 0.00 68.15 67.25 1x6p h THR 45 CO -0.10 0.14 0.19 0.74 0.37 0.00 0.00 175.52 176.87 1x6p h THR 46 N 0.29 0.86 -0.18 3.16 2.02 -1.50 -0.64 112.91 116.92 1x6p h THR 46 Ca 0.09 -0.13 -0.01 0.00 0.77 0.00 0.00 66.41 67.13 1x6p h THR 46 Cb 0.12 0.45 -0.01 0.00 -1.74 0.00 0.00 68.15 66.96 1x6p h THR 46 CO -0.01 0.07 0.08 0.58 0.37 0.00 0.00 175.52 176.61 1x6p h VAL 47 N 0.38 1.13 -0.70 3.16 2.07 -0.98 -2.56 116.25 118.76 1x6p h VAL 47 Ca 0.23 -0.39 -0.04 0.00 0.82 0.00 0.00 66.70 67.32 1x6p h VAL 47 Cb 0.22 1.07 -0.03 0.00 -1.52 0.00 0.00 31.29 31.03 1x6p h VAL 47 CO -0.22 0.13 0.28 -0.33 0.02 0.00 0.00 177.57 177.45 1x6p h GLU 48 N 0.15 1.04 -0.63 1.57 4.39 -0.79 -1.41 114.58 118.90 1x6p h GLU 48 Ca 0.06 -0.18 -0.08 0.00 0.34 0.00 0.00 59.36 59.51 1x6p h GLU 48 Cb 0.13 -0.18 -0.03 0.00 -0.10 0.00 0.00 28.75 28.58 1x6p h GLU 48 CO -0.01 0.84 0.09 0.93 -1.16 0.00 0.00 179.01 179.71 1x6p h GLU 49 N 1.02 1.04 -0.13 2.33 4.39 -1.05 -1.51 114.58 120.67 1x6p h GLU 49 Ca 0.24 -0.28 -0.03 0.00 0.34 0.00 0.00 59.36 59.63 1x6p h GLU 49 Cb 0.19 -0.12 -0.00 0.00 -0.10 0.00 0.00 28.75 28.72 1x6p h GLU 49 CO -0.02 0.96 -0.03 0.00 -1.16 0.00 0.00 179.01 178.76 1x6p h ALA 50 N 1.11 0.18 -0.14 3.43 0.00 -1.06 -3.07 119.26 119.71 1x6p h ALA 50 Ca 0.19 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 1x6p h ALA 50 Cb 0.44 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 1x6p h ALA 50 CO 0.01 -0.08 -0.05 -0.07 0.00 0.00 0.00 179.25 179.06 1x6p h LEU 51 N -0.06 0.19 -1.84 0.00 3.38 -1.12 -1.77 115.31 114.09 1x6p h LEU 51 Ca 0.03 -0.03 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 1x6p h LEU 51 Cb 0.45 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.14 1x6p h LEU 51 CO 0.01 0.28 -0.13 0.77 0.09 0.00 0.00 178.44 179.47 1x6p h SER 52 N 0.21 0.00 0.47 -0.43 4.64 -1.18 -1.83 113.55 115.43 1x6p h SER 52 Ca 0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 1x6p h SER 52 Cb 0.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.32 1x6p h SER 52 CO 0.01 0.13 -0.38 0.54 -0.87 0.00 0.00 176.83 176.25 1x6p n ARG 53 N -3.60 0.23 -0.99 4.77 1.74 -0.72 -4.93 116.66 113.16 1x6p n ARG 53 Ca -0.02 -0.13 0.00 0.00 -0.77 0.00 0.00 57.85 56.94 1x6p n ARG 53 Cb 0.26 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.20 1x6p n ARG 53 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1x6p n GLY 54 N 1.45 0.41 3.94 -0.13 0.00 -0.69 -5.05 105.19 105.12 1x6p n GLY 54 Ca 0.08 -0.85 -0.26 0.00 0.00 0.00 0.00 46.02 44.99 1x6p n GLY 54 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1x6p s TRP 55 N -2.00 3.48 0.41 1.61 0.52 -0.89 -5.02 118.94 117.05 1x6p s TRP 55 Ca 0.00 0.30 -0.02 0.00 0.02 0.00 0.00 56.10 56.41 1x6p s TRP 55 Cb 0.00 -1.83 -0.03 0.00 -1.15 0.00 0.00 33.47 30.46 1x6p s TRP 55 CO 0.00 0.32 0.65 -1.12 0.02 0.00 0.00 176.95 176.82 1x6p s SER 56 N -3.47 6.23 -0.08 2.95 0.01 -0.19 -3.87 113.70 115.29 1x6p s SER 56 Ca 0.38 0.62 0.00 0.00 1.31 0.00 0.00 55.95 58.26 1x6p s SER 56 Cb -0.10 -2.07 -0.03 0.00 0.21 0.00 0.00 66.02 64.03 1x6p s SER 56 CO 0.31 -0.44 -0.06 -0.69 0.41 0.00 0.00 173.24 172.77 1x6p s VAL 57 N -2.50 3.80 0.15 3.43 1.01 -0.01 -0.47 120.40 125.81 1x6p s VAL 57 Ca 0.44 -0.44 0.07 0.00 0.00 0.00 0.00 61.98 62.05 1x6p s VAL 57 Cb -0.10 -2.57 -0.04 0.00 0.00 0.00 0.00 36.38 33.67 1x6p s VAL 57 CO 0.40 0.59 -0.16 -1.59 0.00 0.00 0.00 175.10 174.34 1x6p s LYS 58 N -0.71 1.17 0.79 2.72 -2.85 -0.33 -0.76 119.74 119.77 1x6p s LYS 58 Ca 0.11 -1.36 -0.11 0.00 -1.00 0.00 0.00 55.97 53.60 1x6p s LYS 58 Cb -0.11 -1.09 0.06 0.00 -2.06 0.00 0.00 37.83 34.63 1x6p s LYS 58 CO 0.02 0.21 1.09 -1.54 0.10 0.00 0.00 175.35 175.22 1x6p s SER 59 N -2.69 4.49 0.00 0.03 1.04 -1.26 -1.07 113.70 114.24 1x6p s SER 59 Ca 0.14 1.51 0.00 0.00 0.48 0.00 0.00 55.95 58.08 1x6p s SER 59 Cb -0.04 -2.26 0.00 0.00 0.10 0.00 0.00 66.02 63.81 1x6p s SER 59 CO 0.05 -2.00 0.00 0.61 0.98 0.00 0.00 173.24 172.88 1x6p n GLY 60 N -1.71 -1.83 3.81 7.32 0.00 -1.26 -4.59 105.19 106.94 1x6p n GLY 60 Ca 0.07 -1.58 -0.22 0.00 0.00 0.00 0.00 46.02 44.29 1x6p n GLY 60 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1x6p s THR 61 N 0.00 3.18 -5.00 2.61 -4.23 -1.26 -0.72 115.64 110.23 1x6p s THR 61 Ca 0.00 -1.49 0.00 0.00 -1.18 0.00 0.00 61.69 59.02 1x6p s THR 61 Cb 0.00 -3.08 0.00 0.00 1.34 0.00 0.00 72.50 70.76 1x6p s THR 61 CO 0.00 -0.14 0.00 0.61 -0.54 0.00 0.00 174.62 174.55 1x6p n GLY 62 N -1.32 0.86 3.74 3.99 0.00 -1.26 -4.93 105.19 106.28 1x6p n GLY 62 Ca -0.01 -1.83 -0.24 0.00 0.00 0.00 0.00 46.02 43.94 1x6p n GLY 62 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1x6p s THR 63 N -2.83 4.05 0.45 2.61 -4.23 -1.26 -4.84 115.64 109.59 1x6p s THR 63 Ca 0.00 -1.51 -0.25 0.00 -1.18 0.00 0.00 61.69 58.75 1x6p s THR 63 Cb 0.00 -3.14 -0.08 0.00 1.34 0.00 0.00 72.50 70.62 1x6p s THR 63 CO 0.00 -0.28 1.42 -1.61 -0.54 0.00 0.00 174.62 173.60 1x6p s GLU 64 N -3.54 3.69 -0.41 3.99 2.02 -1.26 -4.58 118.70 118.60 1x6p s GLU 64 Ca 0.31 2.40 -0.07 0.00 0.02 0.00 0.00 54.97 57.63 1x6p s GLU 64 Cb -0.08 -2.65 0.09 0.00 0.10 0.00 0.00 34.13 31.59 1x6p s GLU 64 CO 0.22 -0.80 0.23 0.34 0.02 0.00 0.00 175.26 175.27 1x6p s ASP 65 N -0.53 5.48 0.22 -0.19 3.68 -0.17 -4.96 116.67 120.20 1x6p s ASP 65 Ca 0.61 -1.67 0.24 0.00 2.13 0.00 0.00 52.55 53.86 1x6p s ASP 65 Cb -0.43 -1.92 0.92 0.00 -1.45 0.00 0.00 42.92 40.03 1x6p s ASP 65 CO 0.56 -0.53 1.73 0.00 0.13 0.00 0.00 175.17 177.05 1x6p n ALA 66 N 4.81 1.88 -0.03 3.66 0.00 -1.26 -0.03 120.51 129.53 1x6p n ALA 66 Ca -0.08 0.04 -0.09 0.00 0.00 0.00 0.00 53.44 53.31 1x6p n ALA 66 Cb 0.42 -1.41 -0.08 0.00 0.00 0.00 0.00 19.45 18.39 1x6p n ALA 66 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1x6p h THR 67 N 0.00 1.03 0.00 0.00 2.02 -1.97 -3.34 112.91 110.66 1x6p h THR 67 Ca 0.00 -1.62 0.00 0.00 0.77 0.00 0.00 66.41 65.56 1x6p h THR 67 Cb 0.48 1.90 0.00 0.00 -1.74 0.00 0.00 68.15 68.78 1x6p h THR 67 CO 0.00 0.33 -0.45 0.29 0.37 0.00 0.00 175.52 176.06 1x6p n LYS 68 N -4.75 0.16 -3.09 6.66 5.02 -1.22 -4.98 118.16 115.97 1x6p n LYS 68 Ca -0.07 0.06 -0.14 0.00 -2.02 0.00 0.00 58.31 56.15 1x6p n LYS 68 Cb 0.28 -1.62 0.07 0.00 -0.02 0.00 0.00 35.03 33.74 1x6p n LYS 68 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1x6p n LYS 69 N -1.86 -2.79 -4.97 1.97 5.02 0.96 -4.83 118.16 111.65 1x6p n LYS 69 Ca 0.05 0.77 -0.28 0.00 -2.02 0.00 0.00 58.31 56.83 1x6p n LYS 69 Cb 0.39 -5.37 -0.16 0.00 -0.02 0.00 0.00 35.03 29.88 1x6p n LYS 69 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1x6p s GLU 70 N -4.43 1.96 -0.16 1.97 2.02 -0.88 -1.02 118.70 118.16 1x6p s GLU 70 Ca 0.32 -0.70 -0.02 0.00 0.02 0.00 0.00 54.97 54.59 1x6p s GLU 70 Cb -0.04 -1.72 -0.02 0.00 0.10 0.00 0.00 34.13 32.45 1x6p s GLU 70 CO 0.65 0.31 -0.08 0.08 0.02 0.00 0.00 175.26 176.24 1x6p s VAL 71 N -0.09 3.43 0.54 2.63 1.01 0.38 -1.00 120.40 127.30 1x6p s VAL 71 Ca -0.02 -0.52 -0.17 0.00 0.00 0.00 0.00 61.98 61.27 1x6p s VAL 71 Cb -0.12 -2.49 -0.06 0.00 0.00 0.00 0.00 36.38 33.71 1x6p s VAL 71 CO 0.02 0.49 1.03 -2.16 0.00 0.00 0.00 175.10 174.48 1x6p s PRO 72 N 0.57 3.64 0.42 2.72 0.04 -1.26 -1.19 135.00 139.94 1x6p s PRO 72 Ca -0.05 1.19 0.09 0.00 0.04 0.00 0.00 61.00 62.27 1x6p s PRO 72 Cb -0.15 -2.08 0.89 0.00 0.04 0.00 0.00 34.50 33.20 1x6p s PRO 72 CO 0.03 -0.54 2.01 -0.07 0.04 0.00 0.00 177.00 178.46 1x6p h LEU 73 N 0.94 0.29 0.00 -3.56 3.38 -0.92 -3.46 115.31 111.98 1x6p h LEU 73 Ca -0.48 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.46 1x6p h LEU 73 Cb 1.21 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.89 1x6p h LEU 73 CO 0.59 0.31 0.00 0.61 0.09 0.00 0.00 178.44 180.04 1x6p n GLY 74 N -1.20 0.72 3.20 0.83 0.00 0.10 -5.02 105.19 103.82 1x6p n GLY 74 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 1x6p n GLY 74 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x6p s VAL 75 N -2.46 1.61 0.60 1.61 0.11 -1.23 -4.81 120.40 115.83 1x6p s VAL 75 Ca 0.00 -0.85 -0.16 0.00 -2.93 0.00 0.00 61.98 58.04 1x6p s VAL 75 Cb 0.00 -1.35 -0.03 0.00 -1.53 0.00 0.00 36.38 33.47 1x6p s VAL 75 CO 0.00 0.46 1.07 0.00 -3.33 0.00 0.00 175.10 173.30 1x6p s ALA 76 N -0.28 2.68 0.49 1.54 0.00 -1.26 -4.08 121.76 120.85 1x6p s ALA 76 Ca 0.03 0.48 0.15 0.00 0.00 0.00 0.00 51.96 52.62 1x6p s ALA 76 Cb -0.10 -3.26 1.16 0.00 0.00 0.00 0.00 23.12 20.92 1x6p s ALA 76 CO 0.01 -0.89 2.09 0.00 0.00 0.00 0.00 175.76 176.96 1x6p h ALA 77 N 0.46 1.89 -0.53 0.00 0.00 -1.97 -2.68 119.26 116.43 1x6p h ALA 77 Ca -0.47 -0.06 -0.20 0.00 0.00 0.00 0.00 54.91 54.18 1x6p h ALA 77 Cb 1.23 -0.02 -0.12 0.00 0.00 0.00 0.00 17.79 18.89 1x6p h ALA 77 CO 0.57 0.09 0.15 -0.40 0.00 0.00 0.00 179.25 179.65 1x6p n ASP 78 N -4.46 3.65 -0.26 0.00 5.75 -1.26 -1.65 116.55 118.32 1x6p n ASP 78 Ca -0.03 -3.42 0.06 0.00 -0.01 0.00 0.00 54.79 51.39 1x6p n ASP 78 Cb 0.14 -0.68 0.30 0.00 -1.03 0.00 0.00 41.12 39.85 1x6p n ASP 78 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1x6p h ALA 79 N 1.65 1.62 -3.04 2.12 0.00 -1.76 -3.37 119.26 116.47 1x6p h ALA 79 Ca 0.24 -0.02 -0.67 0.00 0.00 0.00 0.00 54.91 54.47 1x6p h ALA 79 Cb 1.98 -0.22 -0.27 0.00 0.00 0.00 0.00 17.79 19.28 1x6p h ALA 79 CO 0.55 0.24 -0.66 1.21 0.00 0.00 0.00 179.25 180.59 1x6p s ASN 80 N -6.04 4.83 0.00 0.00 3.84 -1.26 -4.99 114.94 111.32 1x6p s ASN 80 Ca -0.11 -0.60 0.10 0.00 0.21 0.00 0.00 52.86 52.47 1x6p s ASN 80 Cb 0.20 -1.82 0.54 0.00 -0.55 0.00 0.00 41.25 39.62 1x6p s ASN 80 CO 0.79 -0.12 1.13 0.29 -2.79 0.00 0.00 177.10 176.40 1x6p n LYS 81 N 4.83 0.22 0.09 0.43 4.76 -1.26 -1.87 118.16 125.35 1x6p n LYS 81 Ca -0.16 0.11 0.12 0.00 -2.87 0.00 0.00 58.31 55.51 1x6p n LYS 81 Cb 0.49 -1.50 0.45 0.00 -1.84 0.00 0.00 35.03 32.63 1x6p n LYS 81 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 1x6p n LEU 82 N -1.16 0.52 0.00 -0.35 4.77 -1.26 -4.45 117.00 115.07 1x6p n LEU 82 Ca 0.06 0.59 0.00 0.00 -0.03 0.00 0.00 56.01 56.63 1x6p n LEU 82 Cb 0.06 -0.48 0.00 0.00 -2.33 0.00 0.00 43.42 40.67 1x6p n LEU 82 CO 0.07 -0.34 0.00 0.61 -1.33 0.00 0.00 177.39 176.40 1x6p n GLY 83 N 0.54 -0.58 3.11 -0.72 0.00 -0.78 -0.68 105.19 106.08 1x6p n GLY 83 Ca 0.04 -0.70 -0.21 0.00 0.00 0.00 0.00 46.02 45.14 1x6p n GLY 83 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1x6p s THR 84 N -3.35 1.08 -0.12 2.61 -4.23 -0.57 -4.58 115.64 106.49 1x6p s THR 84 Ca 0.00 -0.73 -0.09 0.00 -1.18 0.00 0.00 61.69 59.69 1x6p s THR 84 Cb 0.00 -0.93 -0.05 0.00 1.34 0.00 0.00 72.50 72.86 1x6p s THR 84 CO 0.00 0.19 0.20 -0.63 -0.54 0.00 0.00 174.62 173.84 1x6p s ILE 85 N -0.51 5.39 0.03 2.99 1.01 -0.66 -1.25 121.20 128.21 1x6p s ILE 85 Ca 0.04 0.35 0.00 0.00 0.00 0.00 0.00 60.65 61.04 1x6p s ILE 85 Cb -0.06 -3.49 -0.02 0.00 0.01 0.00 0.00 42.46 38.90 1x6p s ILE 85 CO 0.00 0.56 -0.03 0.00 0.00 0.00 0.00 174.94 175.47 1x6p s ALA 86 N -0.66 0.22 -0.04 9.38 0.00 -0.64 -4.71 121.76 125.31 1x6p s ALA 86 Ca 0.16 -0.70 0.05 0.00 0.00 0.00 0.00 51.96 51.47 1x6p s ALA 86 Cb -0.13 0.16 -0.01 0.00 0.00 0.00 0.00 23.12 23.14 1x6p s ALA 86 CO 0.05 -0.18 -0.21 -1.17 0.00 0.00 0.00 175.76 174.24 1x6p s LEU 87 N -1.69 2.00 -0.06 0.00 2.96 -1.26 -1.19 118.68 119.43 1x6p s LEU 87 Ca -0.12 -0.42 -0.04 0.00 -0.22 0.00 0.00 54.13 53.33 1x6p s LEU 87 Cb -0.07 -1.15 0.03 0.00 0.50 0.00 0.00 46.19 45.49 1x6p s LEU 87 CO -0.02 0.21 0.14 -0.54 -1.32 0.00 0.00 176.35 174.82 1x6p s LYS 88 N -0.15 0.12 0.92 1.98 3.01 -0.55 -4.24 119.74 120.84 1x6p s LYS 88 Ca -0.01 0.28 -0.12 0.00 -1.01 0.00 0.00 55.97 55.11 1x6p s LYS 88 Cb -0.12 -0.05 0.14 0.00 -1.01 0.00 0.00 37.83 36.79 1x6p s LYS 88 CO 0.02 -0.09 1.10 -1.25 0.51 0.00 0.00 175.35 175.64 1x6p s PRO 89 N 0.63 1.06 -0.21 -1.68 0.04 -1.26 -0.59 135.00 133.00 1x6p s PRO 89 Ca -0.05 0.58 -0.04 0.00 0.04 0.00 0.00 61.00 61.53 1x6p s PRO 89 Cb -0.06 -1.81 0.07 0.00 0.04 0.00 0.00 34.50 32.74 1x6p s PRO 89 CO -0.03 -2.32 0.09 0.34 0.04 0.00 0.00 177.00 175.12 1x6p s ASP 90 N -3.63 2.82 0.79 6.66 3.68 -1.26 -3.36 116.67 122.37 1x6p s ASP 90 Ca 0.64 -0.86 -0.12 0.00 2.13 0.00 0.00 52.55 54.34 1x6p s ASP 90 Cb -0.17 -0.38 0.07 0.00 -1.45 0.00 0.00 42.92 40.99 1x6p s ASP 90 CO 0.56 -0.36 1.12 -2.16 0.13 0.00 0.00 175.17 174.46 1x6p s PRO 91 N 2.04 2.12 -0.09 4.34 0.04 -1.26 -5.00 135.00 137.18 1x6p s PRO 91 Ca 0.03 0.41 0.04 0.00 0.04 0.00 0.00 61.00 61.52 1x6p s PRO 91 Cb -0.16 -1.94 0.00 0.00 0.04 0.00 0.00 34.50 32.44 1x6p s PRO 91 CO -0.15 -1.55 -0.22 0.00 0.04 0.00 0.00 177.00 175.11 1x6p s ALA 92 N -3.33 2.04 -1.44 8.56 0.00 0.06 -4.94 121.76 122.71 1x6p s ALA 92 Ca 0.61 -0.90 0.13 0.00 0.00 0.00 0.00 51.96 51.80 1x6p s ALA 92 Cb -0.13 -0.76 0.21 0.00 0.00 0.00 0.00 23.12 22.44 1x6p s ALA 92 CO 0.52 0.27 1.08 -0.40 0.00 0.00 0.00 175.76 177.24 1x6p n ASP 93 N 3.51 2.52 0.00 0.00 5.68 -1.26 -0.83 116.55 126.17 1x6p n ASP 93 Ca -0.19 -1.74 0.00 0.00 -0.50 0.00 0.00 54.79 52.36 1x6p n ASP 93 Cb 0.53 -0.11 0.00 0.00 -1.14 0.00 0.00 41.12 40.39 1x6p n ASP 93 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1x6p n GLY 94 N 0.74 1.31 0.69 6.12 0.00 -1.26 -4.89 105.19 107.89 1x6p n GLY 94 Ca 0.10 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.23 1x6p n GLY 94 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1x6p n THR 95 N -2.00 0.23 -4.02 2.61 -2.24 -1.26 -4.82 114.28 102.79 1x6p n THR 95 Ca 0.00 -0.42 -0.08 0.00 -2.27 0.00 0.00 64.05 61.27 1x6p n THR 95 Cb 0.00 0.57 -0.09 0.00 -2.10 0.00 0.00 70.33 68.71 1x6p n THR 95 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1x6p s ALA 96 N -1.77 0.31 0.46 6.98 0.00 -1.26 -4.99 121.76 121.49 1x6p s ALA 96 Ca 0.34 -1.06 -0.25 0.00 0.00 0.00 0.00 51.96 50.99 1x6p s ALA 96 Cb 0.19 0.53 -0.08 0.00 0.00 0.00 0.00 23.12 23.76 1x6p s ALA 96 CO 0.28 -0.47 1.43 -0.25 0.00 0.00 0.00 175.76 176.75 1x6p n ASP 97 N -0.02 3.28 -4.37 0.00 8.00 -1.26 -4.47 116.55 117.70 1x6p n ASP 97 Ca -0.12 1.11 -0.32 0.00 0.71 0.00 0.00 54.79 56.18 1x6p n ASP 97 Cb 0.62 -1.60 -0.15 0.00 -0.02 0.00 0.00 41.12 39.97 1x6p n ASP 97 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1x6p s ILE 98 N -1.20 2.58 -0.04 0.53 1.01 -0.53 -4.35 121.20 119.20 1x6p s ILE 98 Ca 0.62 -0.89 0.04 0.00 0.00 0.00 0.00 60.65 60.42 1x6p s ILE 98 Cb -0.45 -1.98 -0.00 0.00 0.01 0.00 0.00 42.46 40.04 1x6p s ILE 98 CO 0.57 0.57 -0.18 0.42 0.00 0.00 0.00 174.94 176.33 1x6p s THR 99 N -0.39 1.48 -0.17 2.92 -4.23 0.25 -0.41 115.64 115.10 1x6p s THR 99 Ca 0.03 -0.75 -0.01 0.00 -1.18 0.00 0.00 61.69 59.79 1x6p s THR 99 Cb -0.12 -1.27 -0.00 0.00 1.34 0.00 0.00 72.50 72.44 1x6p s THR 99 CO 0.02 0.43 -0.13 -0.76 -0.54 0.00 0.00 174.62 173.64 1x6p s LEU 100 N 0.02 2.58 0.08 4.79 1.43 0.04 -1.48 118.68 126.14 1x6p s LEU 100 Ca -0.04 -0.44 0.09 0.00 -1.03 0.00 0.00 54.13 52.72 1x6p s LEU 100 Cb -0.12 -1.60 -0.03 0.00 0.03 0.00 0.00 46.19 44.47 1x6p s LEU 100 CO 0.02 0.07 -0.25 0.42 0.23 0.00 0.00 176.35 176.84 1x6p s THR 101 N 0.89 2.05 -0.25 5.49 -4.23 -0.33 -0.22 115.64 119.04 1x6p s THR 101 Ca -0.03 -1.49 0.01 0.00 -1.18 0.00 0.00 61.69 59.00 1x6p s THR 101 Cb -0.15 -1.79 0.05 0.00 1.34 0.00 0.00 72.50 71.94 1x6p s THR 101 CO -0.01 0.21 -0.10 0.12 -0.54 0.00 0.00 174.62 174.30 1x6p s PHE 102 N -0.92 3.16 -0.28 3.99 5.36 -0.13 -1.61 117.98 127.54 1x6p s PHE 102 Ca 0.11 -2.02 -0.11 0.00 -0.96 0.00 0.00 56.93 53.96 1x6p s PHE 102 Cb -0.10 -1.98 -0.04 0.00 -0.34 0.00 0.00 43.02 40.56 1x6p s PHE 102 CO 0.03 -0.83 0.18 0.99 -1.46 0.00 0.00 175.22 174.14 1x6p s THR 103 N 1.19 5.21 -1.46 0.12 2.01 -0.38 -1.45 115.64 120.89 1x6p s THR 103 Ca -0.05 0.09 -0.08 0.00 0.31 0.00 0.00 61.69 61.97 1x6p s THR 103 Cb -0.18 -3.50 0.03 0.00 0.01 0.00 0.00 72.50 68.86 1x6p s THR 103 CO -0.05 0.23 2.62 0.23 -0.69 0.00 0.00 174.62 176.95 1x6p n MET 104 N 5.05 4.16 0.23 4.92 0.00 -0.14 -1.51 117.12 129.82 1x6p n MET 104 Ca -0.14 -2.91 0.16 0.00 0.00 0.00 0.00 57.70 54.81 1x6p n MET 104 Cb 0.52 -2.73 0.61 0.00 0.00 0.00 0.00 33.22 31.62 1x6p n MET 104 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 175.97 176.75 1x6p h GLY 105 N 6.34 0.00 -2.33 3.03 0.00 -1.83 -2.60 103.07 105.68 1x6p h GLY 105 Ca 0.77 0.00 0.00 0.00 0.00 0.00 0.00 47.33 48.10 1x6p h GLY 105 CO 1.62 0.00 0.00 0.61 0.00 0.00 0.00 176.54 178.77 1x6p n GLY 106 N 0.08 1.84 3.92 4.60 0.00 0.15 -4.81 105.19 110.97 1x6p n GLY 106 Ca 0.01 -0.73 -0.28 0.00 0.00 0.00 0.00 46.02 45.02 1x6p n GLY 106 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x6p s ALA 107 N -1.39 2.76 1.22 4.61 0.00 -1.16 -4.72 121.76 123.09 1x6p s ALA 107 Ca 0.39 -0.90 -0.20 0.00 0.00 0.00 0.00 51.96 51.25 1x6p s ALA 107 Cb 0.23 -2.77 0.30 0.00 0.00 0.00 0.00 23.12 20.88 1x6p s ALA 107 CO 0.31 -1.72 1.14 0.20 0.00 0.00 0.00 175.76 175.69 1x6p s GLY 108 N -4.64 1.61 0.32 0.00 0.00 -1.26 -4.39 107.32 98.97 1x6p s GLY 108 Ca 0.64 -1.12 0.05 0.00 0.00 0.00 0.00 44.72 44.30 1x6p s GLY 108 CO 0.48 -0.18 1.86 -2.55 0.00 0.00 0.00 173.10 172.72 1x6p h PRO 109 N -2.64 0.81 -0.22 2.90 0.11 -1.98 0.83 132.00 131.82 1x6p h PRO 109 Ca -0.42 -0.05 -0.12 0.00 0.11 0.00 0.00 66.00 65.52 1x6p h PRO 109 Cb 1.28 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 1x6p h PRO 109 CO 0.28 0.54 -0.37 0.87 -0.21 0.00 0.00 178.00 179.12 1x6p h LYS 110 N 0.84 0.48 -0.01 1.05 6.56 -2.00 -3.30 116.57 120.19 1x6p h LYS 110 Ca 0.46 -0.22 0.00 0.00 -1.06 0.00 0.00 60.65 59.83 1x6p h LYS 110 Cb 0.58 -0.01 0.00 0.00 -0.57 0.00 0.00 32.23 32.23 1x6p h LYS 110 CO -0.22 0.78 -0.42 0.09 -2.06 0.00 0.00 179.45 177.61 1x6p n ASN 111 N -4.05 1.10 -4.73 0.86 3.02 -0.95 -4.81 115.26 105.69 1x6p n ASN 111 Ca -0.01 -1.05 -0.42 0.00 -0.03 0.00 0.00 54.58 53.07 1x6p n ASN 111 Cb 0.48 0.69 -0.02 0.00 -0.61 0.00 0.00 39.78 40.32 1x6p n ASN 111 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 1x6p s LYS 112 N -1.91 4.12 0.00 3.52 2.20 0.25 -1.68 119.74 126.23 1x6p s LYS 112 Ca 0.09 2.61 0.00 0.00 -0.36 0.00 0.00 55.97 58.31 1x6p s LYS 112 Cb 0.10 -3.05 0.00 0.00 -1.51 0.00 0.00 37.83 33.38 1x6p s LYS 112 CO 0.42 -0.72 0.00 0.41 -0.36 0.00 0.00 175.35 175.11 1x6p n GLY 113 N 3.25 1.07 3.88 5.54 0.00 -0.99 -5.01 105.19 112.93 1x6p n GLY 113 Ca 0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.85 1x6p n GLY 113 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x6p s LYS 114 N -0.24 3.73 -0.05 1.61 -0.14 -0.68 -4.84 119.74 119.13 1x6p s LYS 114 Ca 0.00 0.37 0.02 0.00 -1.36 0.00 0.00 55.97 55.00 1x6p s LYS 114 Cb 0.00 -2.42 0.02 0.00 -1.68 0.00 0.00 37.83 33.75 1x6p s LYS 114 CO 0.00 -0.03 -0.08 0.42 -0.76 0.00 0.00 175.35 174.90 1x6p s ILE 115 N -2.39 0.81 -0.22 2.17 1.01 -1.26 -0.97 121.20 120.35 1x6p s ILE 115 Ca 0.50 -0.28 -0.10 0.00 0.00 0.00 0.00 60.65 60.76 1x6p s ILE 115 Cb -0.10 -0.78 -0.05 0.00 0.01 0.00 0.00 42.46 41.54 1x6p s ILE 115 CO 0.33 0.28 0.14 -0.63 0.00 0.00 0.00 174.94 175.07 1x6p s ILE 116 N 0.80 5.37 -0.14 2.92 1.01 -0.53 -2.80 121.20 127.84 1x6p s ILE 116 Ca -0.13 0.18 0.02 0.00 0.00 0.00 0.00 60.65 60.73 1x6p s ILE 116 Cb -0.15 -3.48 0.01 0.00 0.01 0.00 0.00 42.46 38.85 1x6p s ILE 116 CO 0.02 0.40 -0.20 -0.89 0.00 0.00 0.00 174.94 174.26 1x6p s THR 117 N 0.69 1.93 -0.22 2.92 2.01 0.18 -0.95 115.64 122.20 1x6p s THR 117 Ca 0.08 -0.90 -0.07 0.00 0.31 0.00 0.00 61.69 61.11 1x6p s THR 117 Cb -0.12 -1.72 -0.03 0.00 0.01 0.00 0.00 72.50 70.63 1x6p s THR 117 CO 0.01 0.52 0.06 -0.76 -0.69 0.00 0.00 174.62 173.77 1x6p s LEU 118 N 0.92 3.58 -0.08 4.42 1.43 0.69 -1.27 118.68 128.36 1x6p s LEU 118 Ca -0.05 -0.09 0.04 0.00 -1.03 0.00 0.00 54.13 53.00 1x6p s LEU 118 Cb -0.15 -1.93 -0.01 0.00 0.03 0.00 0.00 46.19 44.13 1x6p s LEU 118 CO -0.03 0.06 -0.23 -0.89 0.23 0.00 0.00 176.35 175.49 1x6p s THR 119 N 1.03 2.21 -0.31 5.49 2.01 -0.29 -0.78 115.64 125.00 1x6p s THR 119 Ca 0.04 -0.99 -0.06 0.00 0.31 0.00 0.00 61.69 60.99 1x6p s THR 119 Cb -0.14 -1.83 0.03 0.00 0.01 0.00 0.00 72.50 70.56 1x6p s THR 119 CO 0.03 0.56 0.07 -0.60 -0.69 0.00 0.00 174.62 173.99 1x6p s ARG 120 N 0.10 2.79 -0.03 4.92 3.52 0.45 -0.83 118.95 129.86 1x6p s ARG 120 Ca -0.11 -1.05 -0.29 0.00 -0.13 0.00 0.00 55.73 54.15 1x6p s ARG 120 Cb -0.16 -3.35 -0.03 0.00 -1.56 0.00 0.00 34.95 29.85 1x6p s ARG 120 CO 0.06 -0.56 0.95 0.95 -0.81 0.00 0.00 175.30 175.90 1x6p s THR 121 N 1.41 4.87 0.32 4.11 -4.23 -0.54 -1.45 115.64 120.14 1x6p s THR 121 Ca -0.00 1.98 0.16 0.00 -1.18 0.00 0.00 61.69 62.64 1x6p s THR 121 Cb -0.18 -4.28 0.12 0.00 1.34 0.00 0.00 72.50 69.50 1x6p s THR 121 CO 0.02 0.13 1.82 0.00 -0.54 0.00 0.00 174.62 176.05 1x6p h ALA 122 N 6.88 1.24 -0.13 3.99 0.00 -1.88 0.14 119.26 129.50 1x6p h ALA 122 Ca -0.39 -0.32 -0.07 0.00 0.00 0.00 0.00 54.91 54.13 1x6p h ALA 122 Cb 1.20 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 1x6p h ALA 122 CO 0.78 0.44 -0.24 0.00 0.00 0.00 0.00 179.25 180.23 1x6p h ALA 123 N 1.65 1.37 0.00 0.00 0.00 -1.92 -3.34 119.26 117.02 1x6p h ALA 123 Ca -0.00 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1x6p h ALA 123 Cb 0.70 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.41 1x6p h ALA 123 CO 0.05 0.44 0.00 -0.40 0.00 0.00 0.00 179.25 179.33 1x6p n ASP 124 N -4.18 0.31 -0.64 0.00 5.68 -1.19 -5.02 116.55 111.50 1x6p n ASP 124 Ca -0.01 -0.71 -0.08 0.00 -0.50 0.00 0.00 54.79 53.49 1x6p n ASP 124 Cb 0.35 0.20 -0.04 0.00 -1.14 0.00 0.00 41.12 40.49 1x6p n ASP 124 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1x6p n GLY 125 N 0.20 0.99 3.88 6.12 0.00 0.48 -5.00 105.19 111.85 1x6p n GLY 125 Ca 0.00 -0.38 -0.32 0.00 0.00 0.00 0.00 46.02 45.32 1x6p n GLY 125 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1x6p s LEU 126 N -1.91 4.22 0.03 0.99 1.43 -1.23 -4.83 118.68 117.37 1x6p s LEU 126 Ca 0.00 0.85 0.03 0.00 -1.03 0.00 0.00 54.13 53.97 1x6p s LEU 126 Cb 0.00 -3.52 -0.04 0.00 0.03 0.00 0.00 46.19 42.67 1x6p s LEU 126 CO 0.00 -0.01 -0.00 0.26 0.23 0.00 0.00 176.35 176.83 1x6p s TRP 127 N -1.72 3.04 0.07 0.29 0.52 -1.26 -1.47 118.94 118.41 1x6p s TRP 127 Ca 0.44 0.04 0.01 0.00 0.02 0.00 0.00 56.10 56.62 1x6p s TRP 127 Cb -0.12 -1.63 -0.04 0.00 -1.15 0.00 0.00 33.47 30.54 1x6p s TRP 127 CO 0.22 0.46 -0.06 -1.59 0.02 0.00 0.00 176.95 176.00 1x6p s LYS 128 N -1.78 0.69 -0.11 4.98 0.00 -0.01 -4.98 119.74 118.53 1x6p s LYS 128 Ca 0.21 -1.12 0.01 0.00 0.00 0.00 0.00 55.97 55.08 1x6p s LYS 128 Cb -0.12 -0.15 0.02 0.00 0.00 0.00 0.00 37.83 37.58 1x6p s LYS 128 CO 0.13 -0.02 -0.14 0.00 0.00 0.00 0.00 175.35 175.32 1x6p s THR 130 N 1.08 1.61 -0.00 0.00 -4.23 -0.40 -1.45 115.64 112.26 1x6p s THR 130 Ca -0.05 -1.67 -0.03 0.00 -1.18 0.00 0.00 61.69 58.75 1x6p s THR 130 Cb -0.15 -1.60 -0.00 0.00 1.34 0.00 0.00 72.50 72.09 1x6p s THR 130 CO -0.03 -0.23 0.06 -0.55 -0.54 0.00 0.00 174.62 173.34 1x6p s SER 131 N -2.24 0.07 -0.12 3.99 0.15 -0.25 -0.65 113.70 114.65 1x6p s SER 131 Ca 0.09 -0.20 0.17 0.00 0.70 0.00 0.00 55.95 56.71 1x6p s SER 131 Cb -0.08 0.15 0.65 0.00 -1.71 0.00 0.00 66.02 65.04 1x6p s SER 131 CO 0.05 -0.24 1.57 -0.90 1.20 0.00 0.00 173.24 174.92 1x6p n ASP 132 N 2.01 4.51 -4.65 5.45 5.68 -1.12 -4.33 116.55 124.09 1x6p n ASP 132 Ca -0.20 -2.53 -0.29 0.00 -0.50 0.00 0.00 54.79 51.27 1x6p n ASP 132 Cb 0.57 -0.54 0.17 0.00 -1.14 0.00 0.00 41.12 40.18 1x6p n ASP 132 CO 0.00 0.00 0.00 -1.10 -1.33 0.00 0.00 177.20 174.77 1x6p s GLN 133 N -1.98 0.61 0.32 0.11 -0.21 -1.26 -4.89 119.66 112.36 1x6p s GLN 133 Ca 0.47 0.88 -0.29 0.00 0.02 0.00 0.00 55.36 56.43 1x6p s GLN 133 Cb 0.31 -1.73 -0.11 0.00 1.00 0.00 0.00 33.01 32.49 1x6p s GLN 133 CO 0.20 -2.70 1.50 -0.51 -2.12 0.00 0.00 175.29 171.66 1x6p s ASP 134 N -3.12 6.45 0.33 5.90 1.01 -1.26 -4.86 116.67 121.11 1x6p s ASP 134 Ca 0.65 2.91 0.09 0.00 0.71 0.00 0.00 52.55 56.91 1x6p s ASP 134 Cb -0.20 -2.65 0.95 0.00 1.01 0.00 0.00 42.92 42.03 1x6p s ASP 134 CO 0.59 -0.83 1.59 1.05 0.21 0.00 0.00 175.17 177.79 1x6p h GLU 135 N 4.09 0.06 0.00 8.23 4.11 -1.97 -0.13 114.58 128.97 1x6p h GLU 135 Ca -0.48 -0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.94 1x6p h GLU 135 Cb 1.23 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.46 1x6p h GLU 135 CO 0.72 0.04 0.00 0.00 0.07 0.00 0.00 179.01 179.84 1x6p n GLN 136 N -5.35 0.10 -0.04 1.06 10.64 -1.26 -2.46 117.38 120.08 1x6p n GLN 136 Ca 0.28 0.42 0.05 0.00 -1.83 0.00 0.00 57.00 55.91 1x6p n GLN 136 Cb 0.92 -1.73 0.06 0.00 -0.86 0.00 0.00 30.24 28.64 1x6p n GLN 136 CO 0.00 0.00 0.00 1.19 -1.83 0.00 0.00 177.06 176.42 1x6p n PHE 137 N -1.92 0.10 -2.28 2.61 3.72 -0.06 -4.96 117.46 114.66 1x6p n PHE 137 Ca 0.02 -0.13 -0.42 0.00 -0.05 0.00 0.00 57.45 56.87 1x6p n PHE 137 Cb 0.15 -0.01 -0.03 0.00 -0.94 0.00 0.00 39.48 38.65 1x6p n PHE 137 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 1x6p s ILE 138 N -0.85 3.66 0.65 4.37 1.01 -1.03 -4.70 121.20 124.31 1x6p s ILE 138 Ca 0.13 1.17 -0.17 0.00 0.00 0.00 0.00 60.65 61.79 1x6p s ILE 138 Cb 0.09 -3.75 -0.00 0.00 0.01 0.00 0.00 42.46 38.80 1x6p s ILE 138 CO 0.12 0.08 1.18 -2.84 0.00 0.00 0.00 174.94 173.48 1x6p s PRO 139 N 1.28 2.67 0.11 2.79 0.02 -1.26 -4.92 135.00 135.69 1x6p s PRO 139 Ca 0.62 1.69 -0.35 0.00 0.02 0.00 0.00 61.00 62.99 1x6p s PRO 139 Cb -0.33 -1.91 -0.14 0.00 0.02 0.00 0.00 34.50 32.14 1x6p s PRO 139 CO 0.29 -1.41 1.56 1.17 -0.33 0.00 0.00 177.00 178.28 1x6p n LYS 140 N -2.14 1.90 0.00 5.54 4.81 -1.26 -1.86 118.16 125.14 1x6p n LYS 140 Ca 0.13 0.69 0.00 0.00 -0.87 0.00 0.00 58.31 58.25 1x6p n LYS 140 Cb 0.50 -2.43 0.00 0.00 0.02 0.00 0.00 35.03 33.12 1x6p n LYS 140 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1x6p n GLY 141 N 3.33 0.87 3.86 3.14 0.00 -1.26 -5.07 105.19 110.06 1x6p n GLY 141 Ca 0.18 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.92 1x6p n GLY 141 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x6p s SER 143 N -2.86 3.13 0.00 0.00 1.04 -0.53 -4.85 113.70 109.63 1x6p s SER 143 Ca 0.32 -1.48 0.32 0.00 0.48 0.00 0.00 55.95 55.59 1x6p s SER 143 Cb -0.11 0.06 1.89 0.00 0.10 0.00 0.00 66.02 67.95 1x6p s SER 143 CO 0.25 -0.67 2.22 -1.14 0.98 0.00 0.00 173.24 174.88