#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nef n TRP 57 N 0.00 0.00 -1.81 0.00 -0.00 -1.26 -4.25 117.44 110.12 2nef n TRP 57 Ca 0.00 0.00 -0.42 0.00 -0.00 0.00 0.00 57.50 57.08 2nef n TRP 57 Cb 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 31.31 31.31 2nef n TRP 57 CO 0.00 0.00 0.00 -0.11 -0.00 0.00 0.00 177.69 177.58 2nef n LEU 58 N -0.15 6.91 -4.56 5.87 0.00 -1.26 -4.88 117.00 118.92 2nef n LEU 58 Ca 0.00 -4.23 -0.33 0.00 0.00 0.00 0.00 56.01 51.45 2nef n LEU 58 Cb 0.00 -1.63 -0.04 0.00 0.00 0.00 0.00 43.42 41.75 2nef n LEU 58 CO 0.00 1.19 1.45 -1.83 0.00 0.00 0.00 177.39 178.20 2nef s GLU 59 N 2.71 3.00 0.00 1.96 -1.05 -1.26 -4.74 118.70 119.31 2nef s GLU 59 Ca 0.47 -0.77 0.03 0.00 -0.15 0.00 0.00 54.97 54.54 2nef s GLU 59 Cb 0.13 -5.21 0.18 0.00 -0.44 0.00 0.00 34.13 28.79 2nef s GLU 59 CO -0.07 -2.97 0.64 0.00 0.95 0.00 0.00 175.26 173.81 2nef n ALA 60 N 11.92 1.99 -3.27 -0.84 0.00 -1.26 -4.00 120.51 125.05 2nef n ALA 60 Ca 0.39 -0.02 -0.39 0.00 0.00 0.00 0.00 53.44 53.42 2nef n ALA 60 Cb 0.48 -1.05 -0.02 0.00 0.00 0.00 0.00 19.45 18.86 2nef n ALA 60 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2nef n GLN 61 N -0.60 3.59 -1.36 0.00 1.13 -1.26 -5.05 117.38 113.83 2nef n GLN 61 Ca 0.02 -4.54 -0.39 0.00 -1.94 0.00 0.00 57.00 50.14 2nef n GLN 61 Cb 0.01 -2.46 0.02 0.00 0.11 0.00 0.00 30.24 27.92 2nef n GLN 61 CO 0.00 0.00 0.00 -0.85 -1.44 0.00 0.00 177.06 174.77 2nef n GLU 62 N 1.70 0.25 -3.55 -1.09 0.00 -1.26 -4.98 120.64 111.71 2nef n GLU 62 Ca 0.25 0.10 -0.10 0.00 0.00 0.00 0.00 57.16 57.41 2nef n GLU 62 Cb 0.36 -1.30 -0.04 0.00 0.00 0.00 0.00 31.44 30.46 2nef n GLU 62 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.13 175.13 2nef s GLU 63 N -1.44 0.67 0.00 3.44 2.12 -1.26 -5.09 118.70 117.15 2nef s GLU 63 Ca 0.62 0.01 0.00 0.00 0.36 0.00 0.00 54.97 55.96 2nef s GLU 63 Cb -0.52 0.32 0.00 0.00 0.26 0.00 0.00 34.13 34.19 2nef s GLU 63 CO 0.61 -0.24 0.66 -1.91 -0.54 0.00 0.00 175.26 173.83 2nef n GLU 64 N 0.42 0.00 -2.73 4.30 2.13 -1.26 -4.69 120.64 118.80 2nef n GLU 64 Ca -0.10 0.39 -0.40 0.00 0.66 0.00 0.00 57.16 57.71 2nef n GLU 64 Cb 0.59 -1.26 -0.06 0.00 0.27 0.00 0.00 31.44 30.99 2nef n GLU 64 CO 0.00 0.00 0.00 -2.00 -0.41 0.00 0.00 177.13 174.72 2nef s GLU 65 N -2.09 4.82 -0.68 5.31 2.12 -1.26 -4.92 118.70 122.01 2nef s GLU 65 Ca 0.00 1.50 -0.07 0.00 0.36 0.00 0.00 54.97 56.75 2nef s GLU 65 Cb 0.00 -3.29 -0.18 0.00 0.26 0.00 0.00 34.13 30.92 2nef s GLU 65 CO 0.00 0.45 3.31 0.28 -0.54 0.00 0.00 175.26 178.76 2nef n VAL 66 N 1.71 3.59 0.00 3.70 0.31 -1.26 -4.91 118.33 121.46 2nef n VAL 66 Ca -0.01 -2.05 0.00 0.00 -0.01 0.00 0.00 64.34 62.27 2nef n VAL 66 Cb 0.47 -2.23 0.00 0.00 -0.91 0.00 0.00 33.84 31.18 2nef n VAL 66 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2nef n GLY 67 N 2.83 3.69 3.86 2.92 0.00 -1.26 -4.64 105.19 112.59 2nef n GLY 67 Ca 0.58 -0.04 -0.31 0.00 0.00 0.00 0.00 46.02 46.24 2nef n GLY 67 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2nef s PHE 68 N 0.00 3.42 -0.45 1.61 -0.12 -1.26 -5.00 117.98 116.17 2nef s PHE 68 Ca 0.00 1.09 -0.28 0.00 -0.05 0.00 0.00 56.93 57.69 2nef s PHE 68 Cb 0.00 -2.45 0.01 0.00 -0.63 0.00 0.00 43.02 39.94 2nef s PHE 68 CO 0.00 0.05 1.47 -1.25 -0.05 0.00 0.00 175.22 175.44 2nef s PRO 69 N -3.28 3.44 0.29 1.99 0.04 -1.26 -5.01 135.00 131.21 2nef s PRO 69 Ca 0.52 0.85 -0.23 0.00 0.04 0.00 0.00 61.00 62.18 2nef s PRO 69 Cb -0.10 -4.08 -0.09 0.00 0.04 0.00 0.00 34.50 30.26 2nef s PRO 69 CO 0.23 -1.74 0.87 0.08 0.04 0.00 0.00 177.00 176.47 2nef s VAL 70 N 5.91 4.35 0.40 -0.36 1.01 -1.26 -5.05 120.40 125.40 2nef s VAL 70 Ca 0.61 1.61 -0.09 0.00 0.00 0.00 0.00 61.98 64.11 2nef s VAL 70 Cb -0.14 -3.93 -0.06 0.00 0.00 0.00 0.00 36.38 32.25 2nef s VAL 70 CO 0.30 0.14 0.75 0.42 0.00 0.00 0.00 175.10 176.71 2nef s THR 71 N -1.61 4.82 0.00 3.92 -4.23 -1.26 -5.07 115.64 112.21 2nef s THR 71 Ca 0.48 0.53 0.00 0.00 -1.18 0.00 0.00 61.69 61.52 2nef s THR 71 Cb -0.17 -3.74 0.00 0.00 1.34 0.00 0.00 72.50 69.92 2nef s THR 71 CO 0.22 -0.53 0.00 -2.65 -0.54 0.00 0.00 174.62 171.12 2nef n PRO 72 N -1.35 0.96 0.00 3.99 -0.02 -1.26 -4.93 135.00 132.39 2nef n PRO 72 Ca 0.02 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.50 2nef n PRO 72 Cb 0.54 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.02 2nef n PRO 72 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2nef n GLN 73 N -0.55 2.24 -1.47 -0.52 1.13 -1.26 -4.94 117.38 112.00 2nef n GLN 73 Ca 0.00 0.00 -0.35 0.00 -1.94 0.00 0.00 57.00 54.71 2nef n GLN 73 Cb 0.00 0.00 0.09 0.00 0.11 0.00 0.00 30.24 30.44 2nef n GLN 73 CO 0.00 0.00 0.00 0.14 -1.44 0.00 0.00 177.06 175.76 2nef s VAL 74 N 1.20 2.13 0.85 5.09 -7.23 -1.26 -4.93 120.40 116.25 2nef s VAL 74 Ca 0.00 0.07 -0.21 0.00 -1.81 0.00 0.00 61.98 60.03 2nef s VAL 74 Cb 0.00 -2.75 -0.16 0.00 0.56 0.00 0.00 36.38 34.03 2nef s VAL 74 CO 0.00 -0.03 -1.14 -2.65 -0.31 0.00 0.00 175.10 170.97 2nef n PRO 75 N -2.56 0.00 -1.79 4.82 -0.02 -1.26 -4.39 135.00 129.80 2nef n PRO 75 Ca 0.14 0.00 -0.39 0.00 -2.02 0.00 0.00 63.50 61.24 2nef n PRO 75 Cb 0.49 -0.85 -0.03 0.00 -0.02 0.00 0.00 33.50 33.09 2nef n PRO 75 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2nef s LEU 76 N 6.83 3.39 0.51 2.45 1.43 -1.26 -4.69 118.68 127.34 2nef s LEU 76 Ca 0.32 0.98 -0.17 0.00 -1.03 0.00 0.00 54.13 54.22 2nef s LEU 76 Cb 0.02 -2.80 -0.08 0.00 0.03 0.00 0.00 46.19 43.35 2nef s LEU 76 CO 0.61 -2.42 0.99 -0.13 0.23 0.00 0.00 176.35 175.63 2nef s ARG 77 N 7.21 3.93 -0.01 1.70 1.81 -1.18 -4.98 118.95 127.42 2nef s ARG 77 Ca 0.85 1.03 -0.30 0.00 -1.72 0.00 0.00 55.73 55.59 2nef s ARG 77 Cb -0.18 -2.13 -0.05 0.00 -0.45 0.00 0.00 34.95 32.13 2nef s ARG 77 CO 0.27 -0.29 1.39 -1.25 -0.68 0.00 0.00 175.30 174.74 2nef s PRO 78 N -3.86 4.28 -0.47 3.54 0.04 -1.26 -4.50 135.00 132.77 2nef s PRO 78 Ca 0.60 1.95 -0.27 0.00 0.04 0.00 0.00 61.00 63.32 2nef s PRO 78 Cb -0.11 -3.58 -0.04 0.00 0.04 0.00 0.00 34.50 30.81 2nef s PRO 78 CO 0.28 -0.58 2.04 1.41 0.04 0.00 0.00 177.00 180.20 2nef s MET 79 N 2.44 2.69 0.11 4.56 1.75 -1.26 -4.95 119.30 124.64 2nef s MET 79 Ca 0.63 1.19 -0.20 0.00 -1.25 0.00 0.00 55.69 56.06 2nef s MET 79 Cb -0.31 -4.40 -0.07 0.00 2.84 0.00 0.00 34.83 32.89 2nef s MET 79 CO 0.26 -2.62 0.62 0.95 -0.65 0.00 0.00 175.02 173.57 2nef s THR 80 N 9.40 4.67 0.31 10.11 -4.23 -1.26 -4.91 115.64 129.73 2nef s THR 80 Ca 0.83 1.27 0.07 0.00 -1.18 0.00 0.00 61.69 62.67 2nef s THR 80 Cb -0.18 -3.92 0.31 0.00 1.34 0.00 0.00 72.50 70.04 2nef s THR 80 CO 0.27 0.49 1.80 0.22 -0.54 0.00 0.00 174.62 176.86 2nef h TYR 81 N 4.31 1.02 0.00 3.99 3.20 -1.93 2.65 116.97 130.21 2nef h TYR 81 Ca -0.49 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 61.39 2nef h TYR 81 Cb 1.21 -0.31 -0.00 0.00 1.54 0.00 0.00 36.73 39.16 2nef h TYR 81 CO 0.67 0.26 -0.12 -0.22 -1.64 0.00 0.00 178.16 177.10 2nef h LYS 82 N 0.76 0.00 -0.62 1.82 3.64 -1.96 -2.23 116.57 117.98 2nef h LYS 82 Ca 0.55 0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.86 2nef h LYS 82 Cb 0.87 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.66 2nef h LYS 82 CO -0.34 0.12 0.12 0.00 -2.27 0.00 0.00 179.45 177.09 2nef h ALA 83 N 1.88 0.82 0.26 5.00 0.00 0.43 0.25 119.26 127.89 2nef h ALA 83 Ca -0.00 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 2nef h ALA 83 Cb 0.23 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.78 2nef h ALA 83 CO 0.02 0.56 -0.12 0.00 0.00 0.00 0.00 179.25 179.70 2nef h ALA 84 N 1.03 -0.34 -0.31 0.00 0.00 -0.88 0.29 119.26 119.05 2nef h ALA 84 Ca 0.19 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 2nef h ALA 84 Cb 0.40 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 2nef h ALA 84 CO 0.01 -0.61 0.07 0.28 0.00 0.00 0.00 179.25 179.00 2nef h VAL 85 N -0.50 1.22 -0.48 0.00 2.07 -1.49 0.32 116.25 117.38 2nef h VAL 85 Ca -0.04 -0.74 0.00 0.00 0.82 0.00 0.00 66.70 66.75 2nef h VAL 85 Cb 0.37 1.11 -0.02 0.00 -1.52 0.00 0.00 31.29 31.24 2nef h VAL 85 CO 0.06 0.24 0.30 0.44 0.02 0.00 0.00 177.57 178.64 2nef h ASP 86 N 0.34 0.57 -0.39 0.57 5.19 -0.91 -1.58 116.42 120.21 2nef h ASP 86 Ca 0.10 -0.04 -0.01 0.00 -0.62 0.00 0.00 57.03 56.46 2nef h ASP 86 Cb 0.30 -0.14 -0.02 0.00 0.18 0.00 0.00 39.33 39.65 2nef h ASP 86 CO 0.00 0.44 0.20 0.25 -3.12 0.00 0.00 179.24 177.02 2nef h LEU 87 N 0.65 0.49 -0.80 1.55 5.85 -0.13 -0.03 115.31 122.89 2nef h LEU 87 Ca 0.18 -0.10 0.12 0.00 0.84 0.00 0.00 57.88 58.91 2nef h LEU 87 Cb -0.03 -0.13 -0.08 0.00 0.37 0.00 0.00 40.66 40.79 2nef h LEU 87 CO -0.03 0.45 0.42 0.77 -0.34 0.00 0.00 178.44 179.70 2nef h SER 88 N 0.49 0.54 -0.30 1.25 4.64 0.22 -0.41 113.55 119.98 2nef h SER 88 Ca 0.14 0.07 -0.19 0.00 -0.47 0.00 0.00 61.79 61.34 2nef h SER 88 Cb 0.08 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.15 2nef h SER 88 CO -0.02 0.27 -0.54 0.45 -0.87 0.00 0.00 176.83 176.13 2nef h HIS 89 N 0.65 1.12 0.36 4.77 3.86 -0.79 -1.53 115.15 123.59 2nef h HIS 89 Ca 0.41 -0.39 -0.01 0.00 -1.16 0.00 0.00 60.37 59.22 2nef h HIS 89 Cb 0.49 -0.21 -0.01 0.00 1.06 0.00 0.00 27.41 28.74 2nef h HIS 89 CO -0.09 1.23 -0.25 0.35 0.86 0.00 0.00 177.93 180.03 2nef h PHE 90 N 0.69 -0.65 0.00 2.45 3.57 0.09 -0.76 116.94 122.32 2nef h PHE 90 Ca 0.02 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.51 2nef h PHE 90 Cb 1.15 0.24 0.00 0.00 2.79 0.00 0.00 35.95 40.12 2nef h PHE 90 CO 0.07 -0.38 0.00 -0.07 -2.23 0.00 0.00 178.31 175.70 2nef h LEU 91 N -0.60 0.00 0.00 0.59 3.38 -1.13 -2.69 115.31 114.86 2nef h LEU 91 Ca -0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.94 2nef h LEU 91 Cb 0.51 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.26 2nef h LEU 91 CO 0.02 0.00 0.00 1.17 0.09 0.00 0.00 178.44 179.72 2nef n LYS 92 N -2.73 0.00 0.07 1.13 4.81 -0.30 0.14 118.16 121.28 2nef n LYS 92 Ca -0.01 0.42 -0.13 0.00 -0.87 0.00 0.00 58.31 57.73 2nef n LYS 92 Cb 0.14 -1.38 -0.09 0.00 0.02 0.00 0.00 35.03 33.73 2nef n LYS 92 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 2nef h GLU 93 N 0.00 -0.19 0.01 1.64 4.39 -1.59 -2.49 114.58 116.35 2nef h GLU 93 Ca 0.00 0.01 -0.00 0.00 0.34 0.00 0.00 59.36 59.71 2nef h GLU 93 Cb 0.00 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 28.69 2nef h GLU 93 CO 0.00 0.20 -0.00 0.87 -1.16 0.00 0.00 179.01 178.92 2nef h LYS 94 N -0.65 -0.01 0.68 2.33 1.79 -1.63 -3.37 116.57 115.70 2nef h LYS 94 Ca -0.02 0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.42 2nef h LYS 94 Cb 0.48 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.14 2nef h LYS 94 CO 0.03 0.74 -0.33 0.78 -1.08 0.00 0.00 179.45 179.60 2nef h GLY 95 N -0.79 -0.95 -0.73 3.86 0.00 -0.71 -3.48 103.07 100.27 2nef h GLY 95 Ca -0.00 0.35 -0.02 0.00 0.00 0.00 0.00 47.33 47.66 2nef h GLY 95 CO 0.00 -0.35 -0.03 0.61 0.00 0.00 0.00 176.54 176.78 2nef n GLY 96 N -1.26 0.64 0.19 4.60 0.00 0.38 -4.91 105.19 104.82 2nef n GLY 96 Ca -0.11 -0.73 0.09 0.00 0.00 0.00 0.00 46.02 45.26 2nef n GLY 96 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2nef h LEU 97 N -0.07 0.00 -9.67 0.99 5.85 -1.81 -3.43 115.31 107.17 2nef h LEU 97 Ca -0.02 0.00 -0.58 0.00 0.84 0.00 0.00 57.88 58.12 2nef h LEU 97 Cb 1.02 0.00 0.16 0.00 0.37 0.00 0.00 40.66 42.20 2nef h LEU 97 CO 0.03 0.18 -0.06 1.21 -0.34 0.00 0.00 178.44 179.46 2nef n GLU 98 N -3.12 0.85 -0.40 1.25 0.00 -1.26 -0.93 120.64 117.03 2nef n GLU 98 Ca 0.03 0.32 0.00 0.00 0.00 0.00 0.00 57.16 57.51 2nef n GLU 98 Cb 0.61 -1.97 0.00 0.00 0.00 0.00 0.00 31.44 30.08 2nef n GLU 98 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2nef n GLY 99 N 1.45 0.00 3.65 8.31 0.00 0.78 -4.85 105.19 114.53 2nef n GLY 99 Ca 0.12 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.71 2nef n GLY 99 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2nef s LEU 100 N 0.00 4.08 -0.29 0.99 2.96 -0.11 -4.64 118.68 121.68 2nef s LEU 100 Ca 0.00 1.55 -0.28 0.00 -0.22 0.00 0.00 54.13 55.18 2nef s LEU 100 Cb 0.00 -3.54 -0.05 0.00 0.50 0.00 0.00 46.19 43.11 2nef s LEU 100 CO 0.00 -0.88 2.16 -0.63 -1.32 0.00 0.00 176.35 175.67 2nef s ILE 101 N 3.85 3.11 -0.47 6.68 -1.09 -1.26 -2.51 121.20 129.50 2nef s ILE 101 Ca 0.56 0.10 -0.27 0.00 -2.23 0.00 0.00 60.65 58.82 2nef s ILE 101 Cb -0.20 -3.16 -0.03 0.00 -1.58 0.00 0.00 42.46 37.48 2nef s ILE 101 CO 0.18 -0.11 2.01 -2.28 -1.23 0.00 0.00 174.94 173.51 2nef s HIS 102 N 8.57 1.51 0.00 3.97 5.65 0.81 -4.87 115.29 130.93 2nef s HIS 102 Ca 0.95 0.92 0.00 0.00 0.25 0.00 0.00 55.06 57.19 2nef s HIS 102 Cb -0.28 -3.96 0.00 0.00 -1.18 0.00 0.00 32.58 27.16 2nef s HIS 102 CO 0.33 -2.68 0.41 0.45 -0.65 0.00 0.00 174.74 172.60 2nef n SER 103 N 12.82 0.00 0.00 9.88 2.88 -1.26 -3.24 113.62 134.69 2nef n SER 103 Ca 0.26 0.59 0.00 0.00 -1.33 0.00 0.00 58.87 58.39 2nef n SER 103 Cb 0.51 -0.35 0.00 0.00 -0.75 0.00 0.00 64.21 63.62 2nef n SER 103 CO 0.00 0.00 0.00 1.67 -1.23 0.00 0.00 175.04 175.48 2nef n GLN 104 N -1.55 0.00 0.10 -1.46 -0.06 -1.26 -4.66 117.38 108.49 2nef n GLN 104 Ca 0.00 0.00 0.12 0.00 -2.00 0.00 0.00 57.00 55.12 2nef n GLN 104 Cb 0.00 0.00 0.17 0.00 -4.06 0.00 0.00 30.24 26.35 2nef n GLN 104 CO 0.00 0.00 0.00 -0.09 -0.20 0.00 0.00 177.06 176.77 2nef h ARG 105 N 0.00 0.00 -0.83 3.69 9.65 -2.00 -3.35 114.38 121.53 2nef h ARG 105 Ca 0.00 0.00 0.10 0.00 -1.10 0.00 0.00 59.98 58.98 2nef h ARG 105 Cb 0.00 0.00 -0.07 0.00 -1.39 0.00 0.00 29.97 28.51 2nef h ARG 105 CO 0.00 0.00 0.48 0.00 2.80 0.00 0.00 179.97 183.25 2nef h ARG 106 N 0.00 0.78 -0.60 0.20 -0.00 -1.95 -1.40 114.38 111.40 2nef h ARG 106 Ca 0.00 -0.05 -0.02 0.00 -0.50 0.00 0.00 59.98 59.41 2nef h ARG 106 Cb 0.84 -0.18 -0.03 0.00 0.00 0.00 0.00 29.97 30.60 2nef h ARG 106 CO 0.00 0.52 0.29 -0.56 0.00 0.00 0.00 179.97 180.21 2nef h GLN 107 N 0.80 0.87 0.22 0.04 3.07 -1.98 -2.53 115.11 115.60 2nef h GLN 107 Ca 0.40 -0.13 0.01 0.00 0.09 0.00 0.00 58.65 59.02 2nef h GLN 107 Cb 0.37 -0.16 -0.03 0.00 0.08 0.00 0.00 27.48 27.74 2nef h GLN 107 CO -0.25 0.70 -0.27 -0.44 0.09 0.00 0.00 178.83 178.66 2nef h ASP 108 N 0.82 -0.75 -0.72 0.06 5.19 -1.48 -2.19 116.42 117.35 2nef h ASP 108 Ca 0.21 0.07 0.14 0.00 -0.62 0.00 0.00 57.03 56.83 2nef h ASP 108 Cb 0.12 0.27 -0.09 0.00 0.18 0.00 0.00 39.33 39.80 2nef h ASP 108 CO -0.03 -0.38 0.25 0.40 -3.12 0.00 0.00 179.24 176.36 2nef h ILE 109 N -0.55 0.64 0.03 0.35 2.04 -1.26 -1.85 117.51 116.91 2nef h ILE 109 Ca 0.00 -0.13 -0.00 0.00 1.00 0.00 0.00 64.86 65.73 2nef h ILE 109 Cb 0.53 0.22 -0.00 0.00 -0.74 0.00 0.00 36.82 36.82 2nef h ILE 109 CO -0.09 0.07 -0.05 0.25 0.00 0.00 0.00 178.15 178.32 2nef h LEU 110 N 0.38 -0.15 -0.73 1.44 5.85 -0.97 0.82 115.31 121.94 2nef h LEU 110 Ca 0.39 0.01 0.14 0.00 0.84 0.00 0.00 57.88 59.27 2nef h LEU 110 Cb 0.60 0.05 -0.14 0.00 0.37 0.00 0.00 40.66 41.54 2nef h LEU 110 CO -0.41 -0.06 -0.23 0.44 -0.34 0.00 0.00 178.44 177.83 2nef h ASP 111 N -0.09 -0.84 -0.19 1.25 3.32 -1.18 -0.44 116.42 118.25 2nef h ASP 111 Ca -0.00 0.23 -0.02 0.00 0.02 0.00 0.00 57.03 57.26 2nef h ASP 111 Cb 0.09 0.51 -0.01 0.00 0.22 0.00 0.00 39.33 40.13 2nef h ASP 111 CO -0.02 -0.26 0.04 0.25 -1.72 0.00 0.00 179.24 177.53 2nef h LEU 112 N -0.04 0.29 -0.56 1.55 5.85 -1.09 -2.71 115.31 118.59 2nef h LEU 112 Ca 0.34 -0.23 0.11 0.00 0.84 0.00 0.00 57.88 58.93 2nef h LEU 112 Cb 0.56 -0.08 -0.09 0.00 0.37 0.00 0.00 40.66 41.42 2nef h LEU 112 CO -0.77 0.45 0.05 -0.25 -0.34 0.00 0.00 178.44 177.58 2nef h TRP 113 N 0.11 0.07 -0.12 1.25 7.01 0.22 0.70 115.95 125.19 2nef h TRP 113 Ca 0.06 0.04 0.03 0.00 2.11 0.00 0.00 58.89 61.13 2nef h TRP 113 Cb 0.27 0.06 -0.00 0.00 -2.10 0.00 0.00 29.16 27.39 2nef h TRP 113 CO 0.01 -0.09 0.11 0.82 -2.79 0.00 0.00 178.44 176.50 2nef h ILE 114 N 0.18 0.69 0.23 2.65 2.04 -1.01 -2.98 117.51 119.31 2nef h ILE 114 Ca 0.29 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 66.14 2nef h ILE 114 Cb 0.44 0.92 0.00 0.00 -0.74 0.00 0.00 36.82 37.44 2nef h ILE 114 CO -0.43 0.00 -0.11 0.22 0.00 0.00 0.00 178.15 177.83 2nef h TYR 115 N 0.00 -0.29 0.00 1.37 3.20 0.73 -3.08 116.97 118.90 2nef h TYR 115 Ca 0.06 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.92 2nef h TYR 115 Cb 0.27 0.10 0.00 0.00 1.54 0.00 0.00 36.73 38.63 2nef h TYR 115 CO 0.00 -0.18 0.00 0.72 -1.64 0.00 0.00 178.16 177.06 2nef n HIS 116 N -3.21 0.00 0.00 -3.82 8.25 -0.96 -1.44 115.22 114.04 2nef n HIS 116 Ca -0.04 -0.13 0.00 0.00 -0.26 0.00 0.00 57.72 57.30 2nef n HIS 116 Cb 0.12 -0.13 0.00 0.00 1.12 0.00 0.00 29.99 31.10 2nef n HIS 116 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 2nef n THR 117 N 0.78 0.00 1.01 1.59 -2.24 -1.17 -4.71 114.28 109.55 2nef n THR 117 Ca 0.00 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 61.91 2nef n THR 117 Cb 0.14 -0.02 0.36 0.00 -2.10 0.00 0.00 70.33 68.71 2nef n THR 117 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2nef n GLN 118 N -0.05 0.03 -2.44 -0.78 3.00 -1.19 -4.37 117.38 111.59 2nef n GLN 118 Ca 0.00 -0.02 -0.04 0.00 -0.01 0.00 0.00 57.00 56.94 2nef n GLN 118 Cb 0.00 -1.50 0.01 0.00 0.00 0.00 0.00 30.24 28.75 2nef n GLN 118 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2nef n GLY 119 N 1.49 0.50 3.75 1.08 0.00 -0.52 -4.36 105.19 107.12 2nef n GLY 119 Ca 0.06 -0.61 -0.40 0.00 0.00 0.00 0.00 46.02 45.07 2nef n GLY 119 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2nef s TYR 120 N -2.70 3.81 0.14 1.61 2.02 -1.25 -3.12 117.35 117.86 2nef s TYR 120 Ca 0.06 1.80 -0.28 0.00 -0.37 0.00 0.00 57.07 58.28 2nef s TYR 120 Cb -0.03 -3.11 -0.07 0.00 -0.40 0.00 0.00 41.96 38.36 2nef s TYR 120 CO 0.08 0.03 0.86 0.12 -1.57 0.00 0.00 175.55 175.06 2nef s PHE 121 N -0.78 3.87 -0.66 2.71 2.19 -1.26 -4.56 117.98 119.49 2nef s PHE 121 Ca 0.44 1.71 -0.27 0.00 0.33 0.00 0.00 56.93 59.15 2nef s PHE 121 Cb -0.27 -2.90 0.00 0.00 -1.31 0.00 0.00 43.02 38.54 2nef s PHE 121 CO 0.34 0.37 1.60 -1.25 1.83 0.00 0.00 175.22 178.11 2nef s PRO 122 N -0.63 2.90 0.00 10.12 0.04 -1.26 -4.58 135.00 141.59 2nef s PRO 122 Ca 0.40 0.25 0.02 0.00 0.04 0.00 0.00 61.00 61.71 2nef s PRO 122 Cb -0.23 -4.29 0.03 0.00 0.04 0.00 0.00 34.50 30.05 2nef s PRO 122 CO 0.28 -2.45 0.74 -0.40 0.04 0.00 0.00 177.00 175.21 2nef n ASP 123 N 11.18 -0.09 0.00 6.66 5.68 -1.26 -4.86 116.55 133.86 2nef n ASP 123 Ca 0.13 -1.46 0.00 0.00 -0.50 0.00 0.00 54.79 52.95 2nef n ASP 123 Cb 0.51 -0.02 0.00 0.00 -1.14 0.00 0.00 41.12 40.47 2nef n ASP 123 CO 0.00 0.00 0.00 -2.67 -1.33 0.00 0.00 177.20 173.20 2nef n TRP 124 N 0.04 0.00 -2.46 2.11 4.27 -1.26 -4.92 117.44 115.21 2nef n TRP 124 Ca -0.04 0.00 -0.39 0.00 -3.89 0.00 0.00 57.50 53.18 2nef n TRP 124 Cb 0.62 0.00 -0.02 0.00 -1.36 0.00 0.00 31.31 30.56 2nef n TRP 124 CO 0.00 0.00 0.00 1.14 -2.29 0.00 0.00 177.69 176.54 2nef s GLN 125 N -0.97 3.59 0.29 -2.67 -2.07 -1.26 -4.66 119.66 111.91 2nef s GLN 125 Ca 0.00 -1.61 0.07 0.00 -1.82 0.00 0.00 55.36 52.01 2nef s GLN 125 Cb 0.00 -5.43 -0.06 0.00 -1.09 0.00 0.00 33.01 26.43 2nef s GLN 125 CO 0.00 -2.59 -0.07 -0.80 -1.32 0.00 0.00 175.29 170.51 2nef s ASN 126 N 4.94 2.95 0.28 12.60 0.02 -1.26 -5.10 114.94 129.37 2nef s ASN 126 Ca 0.56 -1.18 -0.21 0.00 -1.02 0.00 0.00 52.86 51.01 2nef s ASN 126 Cb 0.02 -0.20 0.03 0.00 0.02 0.00 0.00 41.25 41.12 2nef s ASN 126 CO 0.05 -0.30 0.77 -0.31 0.02 0.00 0.00 177.10 177.33 2nef s TYR 127 N -2.93 -0.12 0.56 2.20 1.51 -1.26 -2.95 117.35 114.36 2nef s TYR 127 Ca 0.30 -0.36 -0.20 0.00 -1.01 0.00 0.00 57.07 55.80 2nef s TYR 127 Cb 0.03 0.72 -0.04 0.00 -0.11 0.00 0.00 41.96 42.56 2nef s TYR 127 CO 0.13 -1.24 1.26 0.95 -1.11 0.00 0.00 175.55 175.53 2nef s THR 128 N -3.50 2.47 -1.15 -0.71 -4.23 -1.13 -4.72 115.64 102.67 2nef s THR 128 Ca 0.12 0.32 -0.18 0.00 -1.18 0.00 0.00 61.69 60.77 2nef s THR 128 Cb -0.05 -3.15 -0.05 0.00 1.34 0.00 0.00 72.50 70.59 2nef s THR 128 CO 0.07 -0.04 2.07 -0.81 -0.54 0.00 0.00 174.62 175.38 2nef n PRO 129 N -1.27 2.24 0.00 3.99 -0.04 -1.26 -4.81 135.00 133.85 2nef n PRO 129 Ca 0.12 -2.29 0.00 0.00 -0.04 0.00 0.00 63.50 61.29 2nef n PRO 129 Cb 0.48 -3.15 0.00 0.00 -0.04 0.00 0.00 33.50 30.79 2nef n PRO 129 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2nef n GLY 130 N 4.38 0.95 0.00 0.55 0.00 -1.26 -5.18 105.19 104.63 2nef n GLY 130 Ca 0.51 -0.55 0.00 0.00 0.00 0.00 0.00 46.02 45.98 2nef n GLY 130 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2nef n PRO 131 N -0.09 1.18 0.00 1.61 -0.04 -1.26 -4.79 135.00 131.61 2nef n PRO 131 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 2nef n PRO 131 Cb 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 2nef n PRO 131 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2nef n GLY 132 N 4.44 -0.20 3.53 0.55 0.00 -1.26 -4.50 105.19 107.75 2nef n GLY 132 Ca 0.00 -1.02 -0.25 0.00 0.00 0.00 0.00 46.02 44.74 2nef n GLY 132 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2nef n ILE 133 N 0.00 -0.02 -2.50 -0.61 2.08 -1.26 -4.69 119.36 112.36 2nef n ILE 133 Ca 0.00 -0.49 -0.42 0.00 0.56 0.00 0.00 62.75 62.40 2nef n ILE 133 Cb 0.00 -1.47 -0.02 0.00 -0.75 0.00 0.00 39.64 37.40 2nef n ILE 133 CO 0.00 0.00 0.00 -0.60 0.56 0.00 0.00 176.55 176.51 2nef s ARG 134 N 8.33 3.45 0.24 0.38 3.52 -1.11 -4.94 118.95 128.82 2nef s ARG 134 Ca 1.11 0.37 -0.11 0.00 -0.13 0.00 0.00 55.73 56.97 2nef s ARG 134 Cb -0.50 -4.05 -0.07 0.00 -1.56 0.00 0.00 34.95 28.77 2nef s ARG 134 CO 0.31 -1.75 0.58 0.71 -0.81 0.00 0.00 175.30 174.34 2nef s TYR 135 N 5.34 3.42 -0.28 5.12 1.51 -1.26 -3.29 117.35 127.90 2nef s TYR 135 Ca 0.47 0.94 -0.27 0.00 -1.01 0.00 0.00 57.07 57.20 2nef s TYR 135 Cb -0.09 -2.31 0.01 0.00 -0.11 0.00 0.00 41.96 39.46 2nef s TYR 135 CO 0.26 0.25 0.97 -1.25 -1.11 0.00 0.00 175.55 174.66 2nef s PRO 136 N -2.81 4.10 0.23 -1.71 0.04 -1.26 -2.83 135.00 130.76 2nef s PRO 136 Ca 0.48 1.01 -0.08 0.00 0.04 0.00 0.00 61.00 62.45 2nef s PRO 136 Cb -0.11 -3.70 0.20 0.00 0.04 0.00 0.00 34.50 30.93 2nef s PRO 136 CO 0.20 -0.73 1.86 -0.07 0.04 0.00 0.00 177.00 178.30 2nef h LEU 137 N 9.67 1.08-10.21 -3.56 3.38 -1.82 -3.42 115.31 110.42 2nef h LEU 137 Ca -0.21 -0.08 -0.51 0.00 0.09 0.00 0.00 57.88 57.16 2nef h LEU 137 Cb 1.07 -0.27 0.12 0.00 0.09 0.00 0.00 40.66 41.67 2nef h LEU 137 CO 0.96 0.84 0.36 0.42 0.09 0.00 0.00 178.44 181.12 2nef s THR 138 N -5.91 3.02 0.19 0.22 -4.23 -1.26 -4.93 115.64 102.73 2nef s THR 138 Ca -0.13 0.45 0.04 0.00 -1.18 0.00 0.00 61.69 60.87 2nef s THR 138 Cb 0.16 -2.95 -0.03 0.00 1.34 0.00 0.00 72.50 71.02 2nef s THR 138 CO 0.82 -0.32 0.32 0.12 -0.54 0.00 0.00 174.62 175.02 2nef s PHE 139 N -2.36 3.46 0.00 3.99 5.36 -1.26 -4.47 117.98 122.70 2nef s PHE 139 Ca 0.68 0.05 0.00 0.00 -0.96 0.00 0.00 56.93 56.70 2nef s PHE 139 Cb -0.22 -1.62 0.00 0.00 -0.34 0.00 0.00 43.02 40.84 2nef s PHE 139 CO 0.45 0.48 0.00 0.41 -1.46 0.00 0.00 175.22 175.10 2nef n GLY 140 N -0.96 2.87 3.55 13.12 0.00 -1.26 -4.93 105.19 117.57 2nef n GLY 140 Ca -0.08 -0.61 -0.39 0.00 0.00 0.00 0.00 46.02 44.94 2nef n GLY 140 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2nef s TRP 141 N -1.24 2.05 -0.41 1.61 -0.00 -1.26 -3.75 118.94 115.94 2nef s TRP 141 Ca 0.00 0.23 -0.06 0.00 -0.00 0.00 0.00 56.10 56.26 2nef s TRP 141 Cb 0.00 -4.42 -0.18 0.00 -0.00 0.00 0.00 33.47 28.87 2nef s TRP 141 CO 0.00 -2.14 3.35 0.00 -0.00 0.00 0.00 176.95 178.16 2nef s TYR 143 N 0.78 3.17 -0.29 0.00 1.13 -1.26 -2.11 117.35 118.76 2nef s TYR 143 Ca 0.66 0.09 -0.02 0.00 -1.41 0.00 0.00 57.07 56.39 2nef s TYR 143 Cb 0.30 -1.88 0.10 0.00 -1.10 0.00 0.00 41.96 39.37 2nef s TYR 143 CO -0.04 0.32 0.09 0.15 -2.51 0.00 0.00 175.55 173.56 2nef s LYS 144 N -0.40 0.63 0.35 -3.49 1.02 -1.06 -4.43 119.74 112.36 2nef s LYS 144 Ca 0.08 -0.91 -0.26 0.00 0.02 0.00 0.00 55.97 54.90 2nef s LYS 144 Cb -0.12 -1.87 -0.09 0.00 -0.52 0.00 0.00 37.83 35.23 2nef s LYS 144 CO 0.02 -0.95 1.05 -0.51 -0.92 0.00 0.00 175.35 174.04 2nef s LEU 145 N 1.72 4.30 -0.23 3.17 1.43 -1.21 -1.38 118.68 126.48 2nef s LEU 145 Ca 0.08 2.09 -0.05 0.00 -1.03 0.00 0.00 54.13 55.22 2nef s LEU 145 Cb -0.17 -3.98 0.11 0.00 0.03 0.00 0.00 46.19 42.19 2nef s LEU 145 CO -0.25 -0.32 0.43 -0.69 0.23 0.00 0.00 176.35 175.75 2nef s VAL 146 N -1.48 -0.68 1.07 -1.59 1.01 -1.12 -2.74 120.40 114.86 2nef s VAL 146 Ca 0.52 0.07 -0.22 0.00 0.00 0.00 0.00 61.98 62.35 2nef s VAL 146 Cb -0.25 -0.76 -0.01 0.00 0.00 0.00 0.00 36.38 35.36 2nef s VAL 146 CO 0.31 -0.00 -0.57 -2.65 0.00 0.00 0.00 175.10 172.19 2nef n PRO 147 N 5.39 -0.99 0.00 2.72 -0.02 -1.26 -3.05 135.00 137.79 2nef n PRO 147 Ca -0.06 -0.28 0.00 0.00 -2.02 0.00 0.00 63.50 61.14 2nef n PRO 147 Cb 0.50 -1.44 0.00 0.00 -0.02 0.00 0.00 33.50 32.54 2nef n PRO 147 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2nef n VAL 148 N -4.06 0.00 -2.86 -1.45 0.31 -1.25 -4.80 118.33 104.22 2nef n VAL 148 Ca -0.00 0.00 -0.12 0.00 -0.01 0.00 0.00 64.34 64.21 2nef n VAL 148 Cb 0.67 0.00 0.04 0.00 -0.91 0.00 0.00 33.84 33.64 2nef n VAL 148 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2nef n GLU 149 N 0.00 0.87 -1.79 5.55 1.02 -1.26 -5.15 120.64 119.88 2nef n GLU 149 Ca 0.00 -2.22 -0.30 0.00 -0.02 0.00 0.00 57.16 54.62 2nef n GLU 149 Cb 0.00 -1.31 0.07 0.00 -0.02 0.00 0.00 31.44 30.17 2nef n GLU 149 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 2nef s PRO 150 N -0.12 2.43 1.36 3.49 0.04 -1.26 -5.05 135.00 135.90 2nef s PRO 150 Ca 0.30 0.43 -0.20 0.00 0.04 0.00 0.00 61.00 61.57 2nef s PRO 150 Cb 0.26 -1.98 0.35 0.00 0.04 0.00 0.00 34.50 33.17 2nef s PRO 150 CO -0.14 -1.33 0.95 -1.21 0.04 0.00 0.00 177.00 175.30 2nef s GLU 151 N -5.35 -2.48 0.00 4.56 2.02 -1.26 -5.04 118.70 111.15 2nef s GLU 151 Ca 0.60 0.38 0.00 0.00 0.02 0.00 0.00 54.97 55.96 2nef s GLU 151 Cb -0.12 -1.41 0.00 0.00 0.10 0.00 0.00 34.13 32.70 2nef s GLU 151 CO 0.52 -4.64 0.00 1.63 0.02 0.00 0.00 175.26 172.79 2nef n LYS 152 N -5.50 0.00 -2.72 1.61 5.02 -1.26 -4.83 118.16 110.48 2nef n LYS 152 Ca 0.09 0.00 -0.42 0.00 -2.02 0.00 0.00 58.31 55.96 2nef n LYS 152 Cb 0.58 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 35.56 2nef n LYS 152 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 2nef s LEU 153 N 0.00 4.15 0.00 -0.35 2.96 -1.26 -4.91 118.68 119.27 2nef s LEU 153 Ca 0.00 -1.61 0.00 0.00 -0.22 0.00 0.00 54.13 52.30 2nef s LEU 153 Cb 0.00 -2.49 0.00 0.00 0.50 0.00 0.00 46.19 44.20 2nef s LEU 153 CO 0.00 -1.35 0.00 -0.62 -1.32 0.00 0.00 176.35 173.06 2nef n GLU 154 N 7.91 0.00 0.00 1.98 -0.58 -1.26 -4.96 120.64 123.73 2nef n GLU 154 Ca 0.26 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 57.00 2nef n GLU 154 Cb 0.50 -0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.36 2nef n GLU 154 CO 0.00 0.00 0.00 -0.85 -0.48 0.00 0.00 177.13 175.80 2nef n GLU 155 N 0.00 0.73 -3.26 3.49 -0.00 -1.26 -5.04 120.64 115.30 2nef n GLU 155 Ca 0.00 0.00 -0.24 0.00 -0.00 0.00 0.00 57.16 56.92 2nef n GLU 155 Cb 0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 31.44 31.36 2nef n GLU 155 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2nef n ALA 156 N -3.00 2.38 0.03 -1.84 0.00 -1.26 -4.90 120.51 111.92 2nef n ALA 156 Ca 0.00 -3.12 0.00 0.00 0.00 0.00 0.00 53.44 50.32 2nef n ALA 156 Cb 0.00 -0.82 0.00 0.00 0.00 0.00 0.00 19.45 18.63 2nef n ALA 156 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2nef n ASN 157 N 2.14 -0.62 -3.01 0.00 5.15 -1.26 -4.97 115.26 112.70 2nef n ASN 157 Ca 0.25 0.17 -0.32 0.00 -0.60 0.00 0.00 54.58 54.08 2nef n ASN 157 Cb 0.51 0.86 -0.06 0.00 -0.53 0.00 0.00 39.78 40.55 2nef n ASN 157 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 2nef n LYS 158 N -2.53 3.27 -0.83 1.20 5.02 -1.26 -4.58 118.16 118.45 2nef n LYS 158 Ca 0.00 -1.90 -0.17 0.00 -2.02 0.00 0.00 58.31 54.22 2nef n LYS 158 Cb 0.00 -2.60 0.09 0.00 -0.02 0.00 0.00 35.03 32.50 2nef n LYS 158 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 2nef n ASP 174 N 3.35 4.42 -4.85 4.39 5.68 -1.26 -4.94 116.55 123.34 2nef n ASP 174 Ca 0.70 -3.07 -0.32 0.00 -0.50 0.00 0.00 54.79 51.60 2nef n ASP 174 Cb 0.38 -0.80 -0.05 0.00 -1.14 0.00 0.00 41.12 39.51 2nef n ASP 174 CO 0.00 0.00 0.00 -1.81 -1.33 0.00 0.00 177.20 174.06 2nef s ASP 175 N -0.40 6.71 0.00 -1.12 1.11 -1.26 -4.93 116.67 116.78 2nef s ASP 175 Ca 0.37 1.33 -0.00 0.00 0.18 0.00 0.00 52.55 54.43 2nef s ASP 175 Cb 0.30 -2.40 -0.01 0.00 1.07 0.00 0.00 42.92 41.88 2nef s ASP 175 CO 0.05 -0.32 1.47 -0.81 1.18 0.00 0.00 175.17 176.73 2nef n PRO 176 N -0.79 0.74 -0.12 8.23 -0.04 -1.26 -4.49 135.00 137.27 2nef n PRO 176 Ca 0.04 -0.05 0.00 0.00 -0.04 0.00 0.00 63.50 63.45 2nef n PRO 176 Cb 0.54 -1.21 0.00 0.00 -0.04 0.00 0.00 33.50 32.79 2nef n PRO 176 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 2nef n GLU 177 N 1.73 1.00 -0.29 0.54 0.28 -1.26 -4.39 120.64 118.25 2nef n GLU 177 Ca 0.02 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.02 2nef n GLU 177 Cb 0.36 -1.00 0.00 0.00 1.43 0.00 0.00 31.44 32.23 2nef n GLU 177 CO 0.00 0.00 0.00 -2.13 -0.16 0.00 0.00 177.13 174.84 2nef n ARG 178 N 0.74 0.99 0.00 3.44 3.00 -1.26 -4.27 116.66 119.30 2nef n ARG 178 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 2nef n ARG 178 Cb 0.50 -1.01 0.00 0.00 0.00 0.00 0.00 32.46 31.95 2nef n ARG 178 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02 2nef n GLU 179 N 1.10 0.86 -2.92 -0.14 1.02 -1.26 -4.53 120.64 114.77 2nef n GLU 179 Ca 0.00 0.00 -0.44 0.00 -0.02 0.00 0.00 57.16 56.70 2nef n GLU 179 Cb 0.49 -1.39 -0.00 0.00 -0.02 0.00 0.00 31.44 30.53 2nef n GLU 179 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2nef s VAL 180 N -1.11 4.94 -0.07 2.62 1.01 -1.26 -4.45 120.40 122.09 2nef s VAL 180 Ca 0.00 -2.46 0.04 0.00 0.00 0.00 0.00 61.98 59.55 2nef s VAL 180 Cb 0.00 -4.91 -0.02 0.00 0.00 0.00 0.00 36.38 31.45 2nef s VAL 180 CO 0.00 -1.63 -0.17 -0.76 0.00 0.00 0.00 175.10 172.54 2nef s LEU 181 N 1.87 2.55 -0.13 3.92 1.43 -1.20 -3.80 118.68 123.32 2nef s LEU 181 Ca 0.42 -0.31 -0.08 0.00 -1.03 0.00 0.00 54.13 53.14 2nef s LEU 181 Cb -0.03 -1.51 -0.04 0.00 0.03 0.00 0.00 46.19 44.64 2nef s LEU 181 CO -0.01 0.29 0.14 -1.83 0.23 0.00 0.00 176.35 175.17 2nef s GLU 182 N -0.38 3.54 -0.39 1.70 -1.05 -1.17 0.28 118.70 121.23 2nef s GLU 182 Ca 0.04 -0.13 -0.29 0.00 -0.15 0.00 0.00 54.97 54.44 2nef s GLU 182 Cb -0.12 -3.22 0.01 0.00 -0.44 0.00 0.00 34.13 30.35 2nef s GLU 182 CO 0.02 0.72 1.40 -1.58 0.95 0.00 0.00 175.26 176.77 2nef s TRP 183 N -0.86 2.43 -0.73 4.83 0.51 -1.04 -2.81 118.94 121.28 2nef s TRP 183 Ca 0.14 0.70 -0.16 0.00 -2.12 0.00 0.00 56.10 54.67 2nef s TRP 183 Cb -0.12 -4.23 0.17 0.00 -0.81 0.00 0.00 33.47 28.48 2nef s TRP 183 CO 0.03 -1.97 0.74 0.50 -0.51 0.00 0.00 176.95 175.74 2nef s ARG 184 N 4.80 3.36 0.26 4.98 3.52 -0.48 0.28 118.95 135.67 2nef s ARG 184 Ca 0.61 -1.99 -0.30 0.00 -0.13 0.00 0.00 55.73 53.92 2nef s ARG 184 Cb -0.15 -4.43 -0.10 0.00 -1.56 0.00 0.00 34.95 28.72 2nef s ARG 184 CO 0.31 -1.40 1.31 0.12 -0.81 0.00 0.00 175.30 174.83 2nef s PHE 185 N 1.27 3.17 -0.48 5.12 2.19 -1.26 -2.56 117.98 125.43 2nef s PHE 185 Ca 0.15 1.30 0.06 0.00 0.33 0.00 0.00 56.93 58.78 2nef s PHE 185 Cb -0.17 -3.64 0.21 0.00 -1.31 0.00 0.00 43.02 38.12 2nef s PHE 185 CO -0.03 -1.88 0.71 -3.47 1.83 0.00 0.00 175.22 172.37 2nef n ASP 186 N 1.76 -2.43 0.00 6.13 2.03 -0.90 -4.97 116.55 118.17 2nef n ASP 186 Ca 0.03 -2.96 0.00 0.00 0.52 0.00 0.00 54.79 52.38 2nef n ASP 186 Cb 0.42 1.19 0.00 0.00 -0.72 0.00 0.00 41.12 42.01 2nef n ASP 186 CO 0.00 0.00 0.00 -0.24 -1.92 0.00 0.00 177.20 175.04 2nef n SER 187 N 2.27 0.00 0.25 1.67 2.88 -1.26 -0.57 113.62 118.85 2nef n SER 187 Ca 0.17 0.17 0.08 0.00 -1.33 0.00 0.00 58.87 57.96 2nef n SER 187 Cb 0.57 -0.17 0.62 0.00 -0.75 0.00 0.00 64.21 64.48 2nef n SER 187 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 2nef h ARG 188 N 0.00 0.00 0.00 -1.46 3.08 -1.93 0.15 114.38 114.22 2nef h ARG 188 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2nef h ARG 188 Cb 0.54 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.59 2nef h ARG 188 CO 0.00 0.09 0.00 1.28 -1.07 0.00 0.00 179.97 180.27 2nef n LEU 189 N -4.30 0.00 0.00 3.04 4.77 0.26 -1.73 117.00 119.04 2nef n LEU 189 Ca -0.03 0.02 0.10 0.00 -0.03 0.00 0.00 56.01 56.07 2nef n LEU 189 Cb 0.17 -0.02 0.62 0.00 -2.33 0.00 0.00 43.42 41.86 2nef n LEU 189 CO 0.34 -0.01 0.82 0.00 -1.33 0.00 0.00 177.39 177.20 2nef n ALA 190 N -1.02 2.31 0.11 -1.18 0.00 0.52 -4.10 120.51 117.16 2nef n ALA 190 Ca 0.04 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.35 2nef n ALA 190 Cb 0.02 -1.34 0.00 0.00 0.00 0.00 0.00 19.45 18.13 2nef n ALA 190 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2nef n PHE 191 N -0.98 -1.67 -1.49 0.00 3.72 -0.71 -4.99 117.46 111.34 2nef n PHE 191 Ca 0.16 0.30 -0.31 0.00 -0.05 0.00 0.00 57.45 57.55 2nef n PHE 191 Cb 0.07 0.39 0.08 0.00 -0.94 0.00 0.00 39.48 39.08 2nef n PHE 191 CO 0.00 0.00 0.00 -1.58 -0.05 0.00 0.00 176.76 175.13 2nef s HIS 192 N -1.96 2.88 -0.31 1.38 2.46 -1.23 -5.05 115.29 113.46 2nef s HIS 192 Ca 0.00 1.34 0.00 0.00 0.47 0.00 0.00 55.06 56.87 2nef s HIS 192 Cb 0.00 -3.01 0.14 0.00 -0.13 0.00 0.00 32.58 29.58 2nef s HIS 192 CO 0.00 -1.59 0.30 -1.58 -2.47 0.00 0.00 174.74 169.41 2nef s HIS 193 N -3.05 -0.35 0.08 3.88 2.46 -1.26 -4.68 115.29 112.37 2nef s HIS 193 Ca 0.60 -0.42 -0.14 0.00 0.47 0.00 0.00 55.06 55.58 2nef s HIS 193 Cb -0.15 -0.48 -0.22 0.00 -0.13 0.00 0.00 32.58 31.60 2nef s HIS 193 CO 0.55 -0.93 1.21 0.52 -2.47 0.00 0.00 174.74 173.62 2nef h MET 194 N 7.93 0.71 -0.79 2.88 2.86 -1.96 -3.12 114.93 123.44 2nef h MET 194 Ca -0.08 -0.75 0.19 0.00 -2.06 0.00 0.00 59.70 57.00 2nef h MET 194 Cb 1.06 0.21 -0.05 0.00 0.06 0.00 0.00 31.60 32.88 2nef h MET 194 CO 0.30 1.32 0.54 0.00 1.06 0.00 0.00 176.91 180.13 2nef h ALA 195 N 0.42 2.37 -0.00 6.32 0.00 -1.95 0.14 119.26 126.57 2nef h ALA 195 Ca -0.12 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 2nef h ALA 195 Cb 1.67 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.45 2nef h ALA 195 CO 0.20 -0.60 -0.01 -0.09 0.00 0.00 0.00 179.25 178.75 2nef h ARG 196 N 0.25 0.01 0.00 0.00 2.43 -1.90 -3.03 114.38 112.14 2nef h ARG 196 Ca 0.39 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.55 2nef h ARG 196 Cb 1.16 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.71 2nef h ARG 196 CO -0.09 0.65 0.00 0.39 -1.51 0.00 0.00 179.97 179.41 2nef n GLU 197 N -4.77 0.21 0.00 0.20 -0.58 -0.66 -3.23 120.64 111.81 2nef n GLU 197 Ca -0.09 0.43 0.00 0.00 -0.42 0.00 0.00 57.16 57.08 2nef n GLU 197 Cb 0.33 -1.90 0.00 0.00 -0.57 0.00 0.00 31.44 29.30 2nef n GLU 197 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 2nef n LEU 198 N -2.29 0.93 -3.29 -4.62 4.77 0.41 -4.84 117.00 108.06 2nef n LEU 198 Ca 0.02 0.39 -0.22 0.00 -0.03 0.00 0.00 56.01 56.17 2nef n LEU 198 Cb 0.24 -0.32 -0.08 0.00 -2.33 0.00 0.00 43.42 40.92 2nef n LEU 198 CO 0.20 -0.32 -0.23 -1.00 -1.33 0.00 0.00 177.39 174.71 2nef s HIS 199 N -0.86 0.42 -0.79 -1.77 3.76 -1.15 -5.09 115.29 109.82 2nef s HIS 199 Ca 0.00 -1.77 -0.24 0.00 -0.15 0.00 0.00 55.06 52.90 2nef s HIS 199 Cb 0.00 -0.65 0.06 0.00 1.11 0.00 0.00 32.58 33.10 2nef s HIS 199 CO 0.00 -0.92 1.20 -1.25 -0.85 0.00 0.00 174.74 172.92 2nef s PRO 200 N 0.48 3.28 0.00 8.40 0.04 -1.20 -4.87 135.00 141.13 2nef s PRO 200 Ca 0.29 -0.73 0.00 0.00 0.04 0.00 0.00 61.00 60.59 2nef s PRO 200 Cb -0.02 -4.48 0.00 0.00 0.04 0.00 0.00 34.50 30.03 2nef s PRO 200 CO -0.13 -2.02 0.00 0.39 0.04 0.00 0.00 177.00 175.28 2nef n GLU 201 N 8.49 0.00 0.00 4.56 1.02 -1.26 -4.51 120.64 128.94 2nef n GLU 201 Ca 0.08 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.23 2nef n GLU 201 Cb 0.48 -0.06 0.00 0.00 -0.02 0.00 0.00 31.44 31.84 2nef n GLU 201 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2nef n TYR 202 N -1.56 0.00 1.36 -0.32 4.02 -1.26 -3.42 117.16 115.98 2nef n TYR 202 Ca 0.00 -0.17 0.13 0.00 -0.01 0.00 0.00 57.90 57.85 2nef n TYR 202 Cb 0.00 -0.15 0.43 0.00 -0.02 0.00 0.00 39.34 39.60 2nef n TYR 202 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 176.86 177.04 2nef n PHE 203 N 0.22 0.00 -1.99 -0.72 3.01 -1.26 -4.86 117.46 111.85 2nef n PHE 203 Ca 0.00 0.00 -0.43 0.00 1.01 0.00 0.00 57.45 58.03 2nef n PHE 203 Cb 0.32 -0.04 -0.03 0.00 -0.01 0.00 0.00 39.48 39.72 2nef n PHE 203 CO 0.00 0.00 0.00 0.15 1.01 0.00 0.00 176.76 177.92 2nef s LYS 204 N -2.19 3.86 0.04 -1.08 1.02 -1.22 -4.84 119.74 115.33 2nef s LYS 204 Ca 0.32 1.93 0.22 0.00 0.02 0.00 0.00 55.97 58.46 2nef s LYS 204 Cb 0.20 -4.07 -0.06 0.00 -0.52 0.00 0.00 37.83 33.39 2nef s LYS 204 CO 0.41 -1.23 0.92 0.09 -0.92 0.00 0.00 175.35 174.62 2nef n ASN 205 N 8.34 0.57 -0.11 2.83 3.02 -1.26 -5.17 115.26 123.48 2nef n ASN 205 Ca 0.20 -0.26 0.16 0.00 -0.03 0.00 0.00 54.58 54.64 2nef n ASN 205 Cb 0.44 1.01 0.85 0.00 -0.61 0.00 0.00 39.78 41.47 2nef n ASN 205 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64