#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jd4 s PRO 2679N 0.00 3.69 0.19 0.00 0.04 -1.26 -4.97 135.00 132.69 2jd4 s PRO 2679Ca 0.00 1.43 0.26 0.00 0.04 0.00 0.00 61.00 62.73 2jd4 s PRO 2679Cb 0.00 -2.07 0.82 0.00 0.04 0.00 0.00 34.50 33.28 2jd4 s PRO 2679CO 0.00 -0.54 1.77 1.28 0.04 0.00 0.00 177.00 179.55 2jd4 n LEU 2680N -1.04 0.75 -4.08 -3.56 4.77 -1.26 -4.82 117.00 107.76 2jd4 n LEU 2680Ca 0.10 0.55 -0.12 0.00 -0.03 0.00 0.00 56.01 56.52 2jd4 n LEU 2680Cb 0.52 -0.32 -0.11 0.00 -2.33 0.00 0.00 43.42 41.18 2jd4 n LEU 2680CO 0.40 -0.16 -0.39 0.00 -1.33 0.00 0.00 177.39 175.91 2jd4 s ALA 2681N -3.10 0.63 0.32 -1.18 0.00 -1.26 -5.12 121.76 112.06 2jd4 s ALA 2681Ca 0.11 -0.93 -0.29 0.00 0.00 0.00 0.00 51.96 50.85 2jd4 s ALA 2681Cb 0.13 0.10 -0.12 0.00 0.00 0.00 0.00 23.12 23.22 2jd4 s ALA 2681CO 0.60 -0.11 1.35 0.00 0.00 0.00 0.00 175.76 177.60 2jd4 n GLN 2682N 1.00 2.20 -1.70 0.00 10.64 -1.26 -4.87 117.38 123.38 2jd4 n GLN 2682Ca -0.20 0.77 -0.41 0.00 -1.83 0.00 0.00 57.00 55.34 2jd4 n GLN 2682Cb 0.57 -2.40 0.01 0.00 -0.86 0.00 0.00 30.24 27.57 2jd4 n GLN 2682CO 0.00 0.00 0.00 -0.35 -1.83 0.00 0.00 177.06 174.88 2jd4 n PRO 2683N 0.94 1.88 -2.94 2.61 -0.04 -1.26 -4.94 135.00 131.26 2jd4 n PRO 2683Ca 0.06 0.67 -0.43 0.00 -0.04 0.00 0.00 63.50 63.76 2jd4 n PRO 2683Cb 0.35 -2.38 -0.05 0.00 -0.04 0.00 0.00 33.50 31.38 2jd4 n PRO 2683CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2jd4 s GLU 2684N -2.25 3.54 0.60 0.54 2.02 -1.26 -5.03 118.70 116.86 2jd4 s GLU 2684Ca 0.62 0.08 -0.18 0.00 0.02 0.00 0.00 54.97 55.50 2jd4 s GLU 2684Cb -0.50 -3.89 -0.03 0.00 0.10 0.00 0.00 34.13 29.80 2jd4 s GLU 2684CO 0.57 -1.04 1.17 -0.51 0.02 0.00 0.00 175.26 175.47 2jd4 s LEU 2685N 3.30 3.63 0.45 1.80 1.43 -1.26 -4.79 118.68 123.25 2jd4 s LEU 2685Ca 0.31 2.28 0.04 0.00 -1.03 0.00 0.00 54.13 55.74 2jd4 s LEU 2685Cb -0.12 -4.59 0.01 0.00 0.03 0.00 0.00 46.19 41.52 2jd4 s LEU 2685CO 0.21 -1.54 0.64 0.00 0.23 0.00 0.00 176.35 175.90 2jd4 s ALA 2687N -2.50 -0.17 -0.06 0.00 0.00 -0.80 -5.03 121.76 113.20 2jd4 s ALA 2687Ca 0.53 -0.14 0.06 0.00 0.00 0.00 0.00 51.96 52.40 2jd4 s ALA 2687Cb -0.10 -3.23 -0.01 0.00 0.00 0.00 0.00 23.12 19.78 2jd4 s ALA 2687CO 0.35 -3.64 -0.23 0.08 0.00 0.00 0.00 175.76 172.31 2jd4 s VAL 2688N -2.56 2.20 -0.05 0.00 1.01 -1.26 -4.82 120.40 114.92 2jd4 s VAL 2688Ca 0.68 -1.02 -0.23 0.00 0.00 0.00 0.00 61.98 61.42 2jd4 s VAL 2688Cb -0.24 -1.81 -0.04 0.00 0.00 0.00 0.00 36.38 34.29 2jd4 s VAL 2688CO 0.63 0.57 0.67 -1.81 0.00 0.00 0.00 175.10 175.16 2jd4 s ASP 2689N -0.19 6.98 -0.45 3.32 1.11 -1.26 -5.04 116.67 121.14 2jd4 s ASP 2689Ca -0.02 1.18 -0.12 0.00 0.18 0.00 0.00 52.55 53.76 2jd4 s ASP 2689Cb -0.14 -2.40 0.08 0.00 1.07 0.00 0.00 42.92 41.53 2jd4 s ASP 2689CO 0.03 -0.06 0.33 -0.89 1.18 0.00 0.00 175.17 175.77 2jd4 s THR 2690N 0.53 4.74 -0.01 -1.27 2.01 -1.26 -5.05 115.64 115.33 2jd4 s THR 2690Ca 0.36 -1.24 -0.35 0.00 0.31 0.00 0.00 61.69 60.77 2jd4 s THR 2690Cb -0.18 -3.86 -0.13 0.00 0.01 0.00 0.00 72.50 68.34 2jd4 s THR 2690CO 0.18 -0.55 1.74 0.00 -0.69 0.00 0.00 174.62 175.30 2jd4 n ALA 2691N 5.06 0.89 0.22 7.40 0.00 -1.26 -4.74 120.51 128.09 2jd4 n ALA 2691Ca -0.11 0.36 0.12 0.00 0.00 0.00 0.00 53.44 53.80 2jd4 n ALA 2691Cb 0.43 -2.41 0.23 0.00 0.00 0.00 0.00 19.45 17.70 2jd4 n ALA 2691CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2jd4 h PRO 2692N 7.75 0.00 0.00 0.00 0.11 -1.97 -3.51 132.00 134.39 2jd4 h PRO 2692Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2jd4 h PRO 2692Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 2jd4 h PRO 2692CO 0.92 0.06 0.00 0.41 -0.21 0.00 0.00 178.00 179.18 2jd4 n GLY 2693N 0.94 -0.71 3.51 -0.55 0.00 -1.26 -4.40 105.19 102.71 2jd4 n GLY 2693Ca 0.03 -1.73 -0.28 0.00 0.00 0.00 0.00 46.02 44.05 2jd4 n GLY 2693CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2jd4 s TYR 2694N -1.05 2.52 -0.04 1.61 1.51 -1.26 -1.58 117.35 119.06 2jd4 s TYR 2694Ca 0.00 -0.27 -0.28 0.00 -1.01 0.00 0.00 57.07 55.51 2jd4 s TYR 2694Cb 0.00 -1.27 -0.03 0.00 -0.11 0.00 0.00 41.96 40.55 2jd4 s TYR 2694CO 0.00 0.47 0.89 0.08 -1.11 0.00 0.00 175.55 175.89 2jd4 s VAL 2695N -1.52 4.91 0.27 0.71 1.01 -0.28 -4.74 120.40 120.75 2jd4 s VAL 2695Ca 0.22 1.85 -0.30 0.00 0.00 0.00 0.00 61.98 63.76 2jd4 s VAL 2695Cb -0.09 -4.23 -0.09 0.00 0.00 0.00 0.00 36.38 31.97 2jd4 s VAL 2695CO 0.12 0.16 1.03 0.00 0.00 0.00 0.00 175.10 176.41 2jd4 s ALA 2696N 1.16 3.37 -1.21 5.51 0.00 -1.26 -3.82 121.76 125.51 2jd4 s ALA 2696Ca 0.46 0.78 -0.06 0.00 0.00 0.00 0.00 51.96 53.15 2jd4 s ALA 2696Cb -0.19 -3.28 0.01 0.00 0.00 0.00 0.00 23.12 19.65 2jd4 s ALA 2696CO 0.23 -0.01 0.77 0.41 0.00 0.00 0.00 175.76 177.16 2jd4 n GLY 2697N 1.29 -0.31 3.02 0.00 0.00 -1.26 -5.01 105.19 102.91 2jd4 n GLY 2697Ca -0.01 0.05 -0.09 0.00 0.00 0.00 0.00 46.02 45.97 2jd4 n GLY 2697CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jd4 s ALA 2698N -3.18 0.28 -0.00 4.61 0.00 -1.25 -4.35 121.76 117.87 2jd4 s ALA 2698Ca 0.38 -0.81 0.04 0.00 0.00 0.00 0.00 51.96 51.57 2jd4 s ALA 2698Cb -0.17 0.18 -0.01 0.00 0.00 0.00 0.00 23.12 23.12 2jd4 s ALA 2698CO 0.47 -0.22 -0.14 -1.01 0.00 0.00 0.00 175.76 174.86 2jd4 s HIS 2699N -2.30 1.26 -0.22 0.00 0.09 -0.57 -4.47 115.29 109.09 2jd4 s HIS 2699Ca -0.08 -0.25 -0.10 0.00 -0.00 0.00 0.00 55.06 54.63 2jd4 s HIS 2699Cb -0.04 -0.80 -0.05 0.00 -0.00 0.00 0.00 32.58 31.69 2jd4 s HIS 2699CO -0.04 -0.01 0.13 -1.14 -0.00 0.00 0.00 174.74 173.68 2jd4 s GLN 2700N -0.45 4.08 0.44 1.40 2.00 0.07 -0.34 119.66 126.87 2jd4 s GLN 2700Ca 0.05 -0.27 0.03 0.00 -2.00 0.00 0.00 55.36 53.17 2jd4 s GLN 2700Cb -0.06 -3.43 0.03 0.00 0.80 0.00 0.00 33.01 30.35 2jd4 s GLN 2700CO -0.00 0.18 0.24 1.19 -0.50 0.00 0.00 175.29 176.39 2jd4 n PHE 2701N 3.90 -0.27 -0.99 1.67 3.01 0.52 -2.72 117.46 122.58 2jd4 n PHE 2701Ca -0.16 -1.94 0.00 0.00 1.01 0.00 0.00 57.45 56.37 2jd4 n PHE 2701Cb 0.52 -0.34 0.00 0.00 -0.01 0.00 0.00 39.48 39.65 2jd4 n PHE 2701CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2jd4 n GLY 2702N -0.27 0.76 0.24 1.37 0.00 -0.81 -3.11 105.19 103.38 2jd4 n GLY 2702Ca -0.06 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.94 2jd4 n GLY 2702CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2jd4 h LEU 2703N 0.00 0.42 -8.92 0.99 3.38 -1.80 -3.44 115.31 105.94 2jd4 h LEU 2703Ca 0.00 -0.12 -0.38 0.00 0.09 0.00 0.00 57.88 57.47 2jd4 h LEU 2703Cb 0.02 -0.11 -0.14 0.00 0.09 0.00 0.00 40.66 40.51 2jd4 h LEU 2703CO 0.00 0.63 -0.64 -0.94 0.09 0.00 0.00 178.44 177.57 2jd4 s SER 2704N -6.81 1.75 0.20 -0.43 1.04 -1.26 -4.52 113.70 103.68 2jd4 s SER 2704Ca -0.07 -1.27 0.20 0.00 0.48 0.00 0.00 55.95 55.29 2jd4 s SER 2704Cb 0.14 0.03 0.88 0.00 0.10 0.00 0.00 66.02 67.18 2jd4 s SER 2704CO 0.77 -0.57 1.61 0.00 0.98 0.00 0.00 173.24 176.03 2jd4 n GLN 2705N -0.45 0.14 -0.56 4.02 1.13 -1.05 -2.95 117.38 117.66 2jd4 n GLN 2705Ca -0.04 0.44 0.07 0.00 -1.94 0.00 0.00 57.00 55.52 2jd4 n GLN 2705Cb 0.65 -1.79 0.18 0.00 0.11 0.00 0.00 30.24 29.38 2jd4 n GLN 2705CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 2jd4 n ASN 2706N -2.06 1.76 -4.73 1.08 3.02 -1.26 -1.28 115.26 111.79 2jd4 n ASN 2706Ca 0.02 -3.61 -0.42 0.00 -0.03 0.00 0.00 54.58 50.54 2jd4 n ASN 2706Cb 0.17 -0.49 -0.03 0.00 -0.61 0.00 0.00 39.78 38.82 2jd4 n ASN 2706CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 2jd4 s SER 2707N -3.06 6.83 0.07 6.41 0.01 -1.15 -4.63 113.70 118.17 2jd4 s SER 2707Ca 0.36 2.42 -0.28 0.00 1.31 0.00 0.00 55.95 59.77 2jd4 s SER 2707Cb 0.35 -2.60 0.09 0.00 0.21 0.00 0.00 66.02 64.07 2jd4 s SER 2707CO -0.06 -0.60 1.12 -1.38 0.41 0.00 0.00 173.24 172.73 2jd4 s HIS 2708N 0.46 -0.09 -0.01 2.43 -3.43 -0.72 -3.34 115.29 110.59 2jd4 s HIS 2708Ca 0.60 -0.12 0.04 0.00 -0.80 0.00 0.00 55.06 54.78 2jd4 s HIS 2708Cb -0.38 0.60 -0.01 0.00 -1.43 0.00 0.00 32.58 31.36 2jd4 s HIS 2708CO 0.36 -0.56 -0.13 -0.51 -2.00 0.00 0.00 174.74 171.90 2jd4 s LEU 2709N -2.96 2.02 -0.31 5.38 1.43 -0.81 -2.23 118.68 121.20 2jd4 s LEU 2709Ca 0.13 -0.24 -0.05 0.00 -1.03 0.00 0.00 54.13 52.94 2jd4 s LEU 2709Cb 0.02 -0.69 0.03 0.00 0.03 0.00 0.00 46.19 45.58 2jd4 s LEU 2709CO -0.01 0.16 0.05 -0.69 0.23 0.00 0.00 176.35 176.10 2jd4 s VAL 2710N -0.29 3.57 -0.10 -1.59 1.01 -0.55 -1.03 120.40 121.42 2jd4 s VAL 2710Ca 0.05 -1.03 -0.02 0.00 0.00 0.00 0.00 61.98 60.98 2jd4 s VAL 2710Cb -0.05 -2.94 -0.03 0.00 0.00 0.00 0.00 36.38 33.35 2jd4 s VAL 2710CO -0.00 -0.03 -0.01 -0.76 0.00 0.00 0.00 175.10 174.29 2jd4 s LEU 2711N 1.39 3.47 0.37 3.92 1.43 -0.26 -0.06 118.68 128.95 2jd4 s LEU 2711Ca -0.01 0.07 -0.25 0.00 -1.03 0.00 0.00 54.13 52.91 2jd4 s LEU 2711Cb -0.18 -1.79 -0.09 0.00 0.03 0.00 0.00 46.19 44.15 2jd4 s LEU 2711CO 0.01 0.34 1.09 -2.84 0.23 0.00 0.00 176.35 175.18 2jd4 s PRO 2712N -0.66 4.24 -0.26 1.29 0.02 -1.26 -0.83 135.00 137.54 2jd4 s PRO 2712Ca 0.10 1.65 0.01 0.00 0.02 0.00 0.00 61.00 62.78 2jd4 s PRO 2712Cb -0.12 -2.71 0.05 0.00 0.02 0.00 0.00 34.50 31.74 2jd4 s PRO 2712CO 0.02 -0.10 -0.08 -0.51 -0.33 0.00 0.00 177.00 176.00 2jd4 s LEU 2713N -2.35 3.45 -0.11 -5.54 1.43 -0.89 -4.85 118.68 109.82 2jd4 s LEU 2713Ca 0.55 -1.23 -0.03 0.00 -1.03 0.00 0.00 54.13 52.39 2jd4 s LEU 2713Cb -0.26 -1.61 -0.06 0.00 0.03 0.00 0.00 46.19 44.29 2jd4 s LEU 2713CO 0.33 -0.19 -0.13 0.00 0.23 0.00 0.00 176.35 176.59 2jd4 n GLN 2714N 4.54 0.26 0.00 1.70 3.00 -1.26 -4.73 117.38 120.88 2jd4 n GLN 2714Ca -0.15 0.09 0.11 0.00 -0.01 0.00 0.00 57.00 57.05 2jd4 n GLN 2714Cb 0.44 -1.05 0.11 0.00 0.00 0.00 0.00 30.24 29.73 2jd4 n GLN 2714CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2jd4 n GLN 2715N -3.21 0.03 -2.68 -1.09 10.64 -1.26 -4.93 117.38 114.88 2jd4 n GLN 2715Ca -0.22 -0.02 -0.41 0.00 -1.83 0.00 0.00 57.00 54.52 2jd4 n GLN 2715Cb 0.68 -1.50 -0.05 0.00 -0.86 0.00 0.00 30.24 28.52 2jd4 n GLN 2715CO 0.00 0.00 0.00 -1.12 -1.83 0.00 0.00 177.06 174.11 2jd4 s SER 2716N -2.98 7.46 -0.45 2.61 0.01 -1.26 -5.01 113.70 114.08 2jd4 s SER 2716Ca 0.10 1.89 0.01 0.00 1.31 0.00 0.00 55.95 59.27 2jd4 s SER 2716Cb 0.17 -2.60 0.12 0.00 0.21 0.00 0.00 66.02 63.92 2jd4 s SER 2716CO 0.76 -0.07 0.20 -0.62 0.41 0.00 0.00 173.24 173.92 2jd4 s ASP 2717N -0.21 4.82 0.00 2.44 -1.08 -1.26 -4.96 116.67 116.42 2jd4 s ASP 2717Ca 0.47 -2.48 0.24 0.00 -0.52 0.00 0.00 52.55 50.25 2jd4 s ASP 2717Cb -0.25 -1.71 0.79 0.00 -1.46 0.00 0.00 42.92 40.29 2jd4 s ASP 2717CO 0.31 -0.37 1.59 1.33 0.52 0.00 0.00 175.17 178.55 2jd4 n VAL 2718N 3.88 0.14 -0.21 1.11 0.24 -1.26 -4.36 118.33 117.88 2jd4 n VAL 2718Ca 0.04 -0.36 0.02 0.00 -2.04 0.00 0.00 64.34 62.00 2jd4 n VAL 2718Cb 0.38 0.55 0.13 0.00 -1.47 0.00 0.00 33.84 33.43 2jd4 n VAL 2718CO 0.00 0.00 0.00 0.03 -2.14 0.00 0.00 176.83 174.72 2jd4 h ARG 2719N 2.64 0.22 -0.01 7.34 3.08 -1.93 -2.93 114.38 122.78 2jd4 h ARG 2719Ca 0.00 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.04 2jd4 h ARG 2719Cb 0.57 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.57 2jd4 h ARG 2719CO 0.00 0.15 -0.09 1.63 -1.07 0.00 0.00 179.97 180.59 2jd4 n LYS 2720N -5.17 1.14 -3.64 0.04 4.76 -1.26 -1.07 118.16 112.95 2jd4 n LYS 2720Ca 0.10 -0.97 -0.06 0.00 -2.87 0.00 0.00 58.31 54.51 2jd4 n LYS 2720Cb 0.37 -1.17 -0.07 0.00 -1.84 0.00 0.00 35.03 32.31 2jd4 n LYS 2720CO 0.00 0.00 0.00 0.50 -1.37 0.00 0.00 177.40 176.53 2jd4 s ARG 2721N -1.13 0.68 -0.25 1.97 3.52 -1.11 -2.73 118.95 119.90 2jd4 s ARG 2721Ca 0.12 1.21 -0.02 0.00 -0.13 0.00 0.00 55.73 56.91 2jd4 s ARG 2721Cb 0.09 0.19 0.08 0.00 -1.56 0.00 0.00 34.95 33.75 2jd4 s ARG 2721CO 0.19 -0.15 0.08 -1.17 -0.81 0.00 0.00 175.30 173.44 2jd4 s LEU 2722N 1.72 1.39 -0.20 -0.88 2.96 0.26 -4.01 118.68 119.92 2jd4 s LEU 2722Ca -0.10 -1.19 0.01 0.00 -0.22 0.00 0.00 54.13 52.63 2jd4 s LEU 2722Cb -0.05 -0.63 0.03 0.00 0.50 0.00 0.00 46.19 46.04 2jd4 s LEU 2722CO -0.20 -0.37 -0.17 -1.58 -1.32 0.00 0.00 176.35 172.71 2jd4 s GLN 2723N 1.83 2.86 -0.08 1.98 0.74 -1.26 -1.23 119.66 124.50 2jd4 s GLN 2723Ca 0.05 -0.93 0.04 0.00 0.05 0.00 0.00 55.36 54.57 2jd4 s GLN 2723Cb -0.17 -2.67 -0.01 0.00 1.10 0.00 0.00 33.01 31.26 2jd4 s GLN 2723CO -0.20 -0.29 -0.22 0.08 -0.55 0.00 0.00 175.29 174.12 2jd4 s VAL 2724N 1.27 2.31 -0.04 1.34 1.01 -0.43 -0.59 120.40 125.27 2jd4 s VAL 2724Ca 0.02 -0.95 0.03 0.00 0.00 0.00 0.00 61.98 61.08 2jd4 s VAL 2724Cb -0.15 -1.89 0.01 0.00 0.00 0.00 0.00 36.38 34.35 2jd4 s VAL 2724CO -0.11 0.56 -0.12 -1.58 0.00 0.00 0.00 175.10 173.86 2jd4 s GLN 2725N 0.05 1.41 0.23 2.72 0.74 -0.51 -1.14 119.66 123.16 2jd4 s GLN 2725Ca -0.09 -0.41 -0.16 0.00 0.05 0.00 0.00 55.36 54.75 2jd4 s GLN 2725Cb -0.15 -1.23 0.01 0.00 1.10 0.00 0.00 33.01 32.74 2jd4 s GLN 2725CO 0.06 0.11 0.54 -0.48 -0.55 0.00 0.00 175.29 174.96 2jd4 s LEU 2726N 0.34 0.14 -0.03 3.68 0.05 -0.41 -0.37 118.68 122.08 2jd4 s LEU 2726Ca -0.07 -0.72 0.07 0.00 0.05 0.00 0.00 54.13 53.46 2jd4 s LEU 2726Cb -0.12 2.07 -0.02 0.00 -2.05 0.00 0.00 46.19 46.07 2jd4 s LEU 2726CO 0.02 -1.15 -0.23 -0.94 -0.55 0.00 0.00 176.35 173.50 2jd4 s SER 2727N -2.95 3.31 0.02 1.48 1.04 -1.23 -0.35 113.70 115.02 2jd4 s SER 2727Ca 0.16 -0.40 0.00 0.00 0.48 0.00 0.00 55.95 56.18 2jd4 s SER 2727Cb -0.02 -0.53 -0.02 0.00 0.10 0.00 0.00 66.02 65.56 2jd4 s SER 2727CO 0.04 0.32 -0.04 -0.51 0.98 0.00 0.00 173.24 174.04 2jd4 s ILE 2728N -0.59 0.16 -0.03 -1.02 2.07 0.16 -2.23 121.20 119.72 2jd4 s ILE 2728Ca 0.09 -0.94 -0.01 0.00 -1.41 0.00 0.00 60.65 58.38 2jd4 s ILE 2728Cb -0.11 -0.32 0.03 0.00 0.13 0.00 0.00 42.46 42.20 2jd4 s ILE 2728CO -0.00 -0.49 0.05 -0.60 -1.91 0.00 0.00 174.94 171.99 2jd4 s ARG 2729N -1.50 -0.06 0.16 3.50 3.52 -0.89 -0.70 118.95 122.98 2jd4 s ARG 2729Ca -0.15 0.30 -0.23 0.00 -0.13 0.00 0.00 55.73 55.51 2jd4 s ARG 2729Cb -0.10 -0.38 0.07 0.00 -1.56 0.00 0.00 34.95 32.97 2jd4 s ARG 2729CO -0.01 -0.26 0.64 -0.08 -0.81 0.00 0.00 175.30 174.79 2jd4 s THR 2730N 1.67 0.00 -0.08 4.11 -1.32 -1.26 -1.64 115.64 117.12 2jd4 s THR 2730Ca -0.02 -0.12 0.01 0.00 -1.21 0.00 0.00 61.69 60.35 2jd4 s THR 2730Cb -0.12 -1.12 -0.00 0.00 -1.51 0.00 0.00 72.50 69.74 2jd4 s THR 2730CO -0.03 0.00 0.27 0.49 -2.21 0.00 0.00 174.62 173.14 2jd4 n PHE 2731N -0.38 0.00 -1.33 9.09 3.01 -1.26 -1.30 117.46 125.28 2jd4 n PHE 2731Ca -0.15 0.00 -0.31 0.00 1.01 0.00 0.00 57.45 58.00 2jd4 n PHE 2731Cb 0.64 0.00 0.09 0.00 -0.01 0.00 0.00 39.48 40.20 2jd4 n PHE 2731CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2jd4 s ALA 2732N -0.60 2.29 -0.09 4.37 0.00 -1.26 -4.89 121.76 121.58 2jd4 s ALA 2732Ca 0.01 0.18 0.20 0.00 0.00 0.00 0.00 51.96 52.35 2jd4 s ALA 2732Cb 0.01 -3.24 -0.30 0.00 0.00 0.00 0.00 23.12 19.59 2jd4 s ALA 2732CO 0.02 -1.70 0.32 -1.13 0.00 0.00 0.00 175.76 173.27 2jd4 n SER 2733N -3.47 0.17 -3.73 0.00 3.41 -1.26 -4.58 113.62 104.17 2jd4 n SER 2733Ca 0.08 0.00 -0.11 0.00 -0.26 0.00 0.00 58.87 58.58 2jd4 n SER 2733Cb 0.53 1.60 -0.07 0.00 -0.26 0.00 0.00 64.21 66.02 2jd4 n SER 2733CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2jd4 s SER 2734N -4.79 -0.14 0.00 4.04 1.04 -1.26 -0.62 113.70 111.96 2jd4 s SER 2734Ca -0.08 -0.24 0.00 0.00 0.48 0.00 0.00 55.95 56.11 2jd4 s SER 2734Cb 0.11 0.39 0.00 0.00 0.10 0.00 0.00 66.02 66.62 2jd4 s SER 2734CO 0.85 -0.68 0.00 0.61 0.98 0.00 0.00 173.24 175.00 2jd4 n GLY 2735N 0.33 3.44 3.70 7.32 0.00 -0.72 -4.49 105.19 114.77 2jd4 n GLY 2735Ca -0.18 -0.85 -0.39 0.00 0.00 0.00 0.00 46.02 44.60 2jd4 n GLY 2735CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2jd4 s LEU 2736N 0.00 4.26 -0.23 0.99 0.20 -0.60 -0.18 118.68 123.12 2jd4 s LEU 2736Ca 0.00 1.00 -0.11 0.00 0.69 0.00 0.00 54.13 55.71 2jd4 s LEU 2736Cb 0.00 -2.94 -0.18 0.00 -0.43 0.00 0.00 46.19 42.65 2jd4 s LEU 2736CO 0.00 -0.13 -0.04 -0.38 -0.29 0.00 0.00 176.35 175.50 2jd4 n ILE 2737N 4.02 1.57 -3.66 6.68 5.41 0.02 -3.38 119.36 130.03 2jd4 n ILE 2737Ca -0.03 -0.40 -0.13 0.00 1.00 0.00 0.00 62.75 63.20 2jd4 n ILE 2737Cb 0.51 -1.78 -0.06 0.00 -0.71 0.00 0.00 39.64 37.60 2jd4 n ILE 2737CO 0.00 0.00 0.00 -0.72 0.00 0.00 0.00 176.55 175.83 2jd4 s TYR 2738N -2.49 -0.28 -0.15 1.39 -0.85 -1.14 0.34 117.35 114.17 2jd4 s TYR 2738Ca -0.32 0.26 -0.14 0.00 -0.52 0.00 0.00 57.07 56.35 2jd4 s TYR 2738Cb 0.10 0.23 0.04 0.00 0.38 0.00 0.00 41.96 42.70 2jd4 s TYR 2738CO 0.60 -0.57 0.41 -0.47 -1.52 0.00 0.00 175.55 173.99 2jd4 s TYR 2739N -2.41 -0.45 0.00 -3.49 5.04 -0.37 -2.02 117.35 113.64 2jd4 s TYR 2739Ca -0.06 1.10 -0.01 0.00 -2.44 0.00 0.00 57.07 55.66 2jd4 s TYR 2739Cb -0.01 0.16 -0.01 0.00 0.35 0.00 0.00 41.96 42.45 2jd4 s TYR 2739CO -0.02 -0.22 0.01 0.14 -1.34 0.00 0.00 175.55 174.12 2jd4 s VAL 2740N 0.27 0.04 0.09 3.14 -7.23 -0.64 -1.00 120.40 115.08 2jd4 s VAL 2740Ca -0.00 -0.35 -0.25 0.00 -1.81 0.00 0.00 61.98 59.56 2jd4 s VAL 2740Cb -0.03 -0.14 0.08 0.00 0.56 0.00 0.00 36.38 36.85 2jd4 s VAL 2740CO -0.00 -0.19 0.72 0.00 -0.31 0.00 0.00 175.10 175.32 2jd4 s ALA 2741N -0.58 -1.70 0.75 1.32 0.00 -1.26 -1.41 121.76 118.89 2jd4 s ALA 2741Ca -0.06 0.72 -0.11 0.00 0.00 0.00 0.00 51.96 52.51 2jd4 s ALA 2741Cb -0.04 0.68 0.04 0.00 0.00 0.00 0.00 23.12 23.81 2jd4 s ALA 2741CO -0.00 -0.73 1.08 -1.58 0.00 0.00 0.00 175.76 174.53 2jd4 s HIS 2742N -3.47 2.76 0.33 0.00 5.65 -0.26 -1.26 115.29 119.04 2jd4 s HIS 2742Ca 0.03 1.49 0.02 0.00 0.25 0.00 0.00 55.06 56.85 2jd4 s HIS 2742Cb -0.01 -3.00 0.61 0.00 -1.18 0.00 0.00 32.58 29.00 2jd4 s HIS 2742CO -0.11 -1.62 1.95 0.37 -0.65 0.00 0.00 174.74 174.67 2jd4 h GLN 2743N -1.00 0.89 -0.02 2.88 5.75 -1.91 -0.42 115.11 121.28 2jd4 h GLN 2743Ca -0.44 -0.05 0.00 0.00 -0.15 0.00 0.00 58.65 58.01 2jd4 h GLN 2743Cb 1.23 -0.20 0.00 0.00 1.07 0.00 0.00 27.48 29.58 2jd4 h GLN 2743CO 0.53 0.59 0.00 0.27 -2.65 0.00 0.00 178.83 177.57 2jd4 n ASN 2744N -4.47 1.43 -0.70 -0.69 0.23 -1.26 -4.94 115.26 104.87 2jd4 n ASN 2744Ca 0.11 -1.48 -0.09 0.00 -0.53 0.00 0.00 54.58 52.59 2jd4 n ASN 2744Cb 0.16 -0.00 -0.04 0.00 -2.08 0.00 0.00 39.78 37.82 2jd4 n ASN 2744CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2jd4 n GLN 2745N 0.12 -1.22 0.24 -3.83 6.02 -0.17 -4.86 117.38 113.68 2jd4 n GLN 2745Ca 0.19 0.77 0.13 0.00 -0.01 0.00 0.00 57.00 58.08 2jd4 n GLN 2745Cb 0.34 -4.89 0.33 0.00 1.02 0.00 0.00 30.24 27.03 2jd4 n GLN 2745CO 0.00 0.00 0.00 0.52 -1.01 0.00 0.00 177.06 176.57 2jd4 h MET 2746N 0.11 0.00 -6.36 -1.09 2.86 -1.92 -3.43 114.93 105.10 2jd4 h MET 2746Ca -0.19 0.00 -0.65 0.00 -2.06 0.00 0.00 59.70 56.80 2jd4 h MET 2746Cb 0.89 0.00 -0.29 0.00 0.06 0.00 0.00 31.60 32.26 2jd4 h MET 2746CO 0.27 0.01 -0.87 -0.51 1.06 0.00 0.00 176.91 176.88 2jd4 s ASP 2747N -6.06 2.78 0.12 1.22 1.11 -1.26 -3.76 116.67 110.81 2jd4 s ASP 2747Ca 0.05 -0.46 -0.26 0.00 0.18 0.00 0.00 52.55 52.06 2jd4 s ASP 2747Cb 0.06 -0.29 0.07 0.00 1.07 0.00 0.00 42.92 43.83 2jd4 s ASP 2747CO 0.63 0.27 0.94 -0.72 1.18 0.00 0.00 175.17 177.47 2jd4 s TYR 2748N -0.62 -0.18 -0.19 4.23 -0.85 -0.94 -1.10 117.35 117.70 2jd4 s TYR 2748Ca 0.09 -0.08 -0.14 0.00 -0.52 0.00 0.00 57.07 56.42 2jd4 s TYR 2748Cb -0.09 0.62 0.05 0.00 0.38 0.00 0.00 41.96 42.92 2jd4 s TYR 2748CO -0.00 -0.76 0.48 0.00 -1.52 0.00 0.00 175.55 173.75 2jd4 s ALA 2749N -3.25 -1.21 0.06 9.51 0.00 -0.50 -1.36 121.76 125.00 2jd4 s ALA 2749Ca 0.11 1.54 -0.15 0.00 0.00 0.00 0.00 51.96 53.45 2jd4 s ALA 2749Cb -0.01 -0.91 0.03 0.00 0.00 0.00 0.00 23.12 22.22 2jd4 s ALA 2749CO -0.00 -0.26 0.35 -0.08 0.00 0.00 0.00 175.76 175.77 2jd4 s THR 2750N 0.83 0.07 -0.12 0.00 -1.32 -0.03 -1.62 115.64 113.45 2jd4 s THR 2750Ca -0.05 -0.61 -0.00 0.00 -1.21 0.00 0.00 61.69 59.82 2jd4 s THR 2750Cb -0.05 -0.99 0.03 0.00 -1.51 0.00 0.00 72.50 69.97 2jd4 s THR 2750CO -0.07 -0.34 -0.09 -0.22 -2.21 0.00 0.00 174.62 171.70 2jd4 s LEU 2751N -2.18 1.32 0.10 9.08 2.96 -0.86 -1.88 118.68 127.23 2jd4 s LEU 2751Ca -0.04 -0.36 0.06 0.00 -0.22 0.00 0.00 54.13 53.57 2jd4 s LEU 2751Cb -0.00 -0.92 -0.03 0.00 0.50 0.00 0.00 46.19 45.74 2jd4 s LEU 2751CO -0.04 -0.11 -0.15 -1.10 -1.32 0.00 0.00 176.35 173.63 2jd4 s GLN 2752N 1.66 0.97 -0.11 1.98 -0.21 -0.59 -0.80 119.66 122.55 2jd4 s GLN 2752Ca 0.05 -1.15 -0.04 0.00 0.02 0.00 0.00 55.36 54.24 2jd4 s GLN 2752Cb -0.13 -0.91 -0.04 0.00 1.00 0.00 0.00 33.01 32.94 2jd4 s GLN 2752CO -0.09 0.19 0.03 -1.17 -2.12 0.00 0.00 175.29 172.13 2jd4 s LEU 2753N -2.20 3.75 -0.14 2.90 2.96 0.74 -1.34 118.68 125.35 2jd4 s LEU 2753Ca 0.05 0.18 -0.06 0.00 -0.22 0.00 0.00 54.13 54.08 2jd4 s LEU 2753Cb -0.07 -1.88 0.06 0.00 0.50 0.00 0.00 46.19 44.80 2jd4 s LEU 2753CO 0.03 0.34 0.31 -1.58 -1.32 0.00 0.00 176.35 174.13 2jd4 s GLN 2754N -0.66 0.26 -1.45 1.98 0.74 0.50 -1.75 119.66 119.28 2jd4 s GLN 2754Ca 0.11 0.69 -0.09 0.00 0.05 0.00 0.00 55.36 56.12 2jd4 s GLN 2754Cb -0.12 -0.04 0.05 0.00 1.10 0.00 0.00 33.01 34.01 2jd4 s GLN 2754CO 0.02 -0.19 0.73 0.39 -0.55 0.00 0.00 175.29 175.69 2jd4 n GLU 2755N 4.54 -4.83 -0.96 1.67 1.02 -0.27 -1.03 120.64 120.78 2jd4 n GLU 2755Ca -0.20 0.66 0.00 0.00 -0.02 0.00 0.00 57.16 57.60 2jd4 n GLU 2755Cb 0.53 -5.50 0.00 0.00 -0.02 0.00 0.00 31.44 26.45 2jd4 n GLU 2755CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2jd4 n GLY 2756N -1.50 0.83 3.38 0.62 0.00 0.21 -5.02 105.19 103.72 2jd4 n GLY 2756Ca -0.02 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.76 2jd4 n GLY 2756CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jd4 s ARG 2757N -0.12 1.41 0.12 1.61 0.52 -0.20 -2.30 118.95 119.99 2jd4 s ARG 2757Ca 0.00 -1.51 -0.22 0.00 -0.52 0.00 0.00 55.73 53.49 2jd4 s ARG 2757Cb 0.00 -1.54 -0.07 0.00 0.52 0.00 0.00 34.95 33.86 2jd4 s ARG 2757CO 0.00 0.31 0.66 -0.51 0.02 0.00 0.00 175.30 175.78 2jd4 s LEU 2758N -2.83 4.55 -0.06 2.53 1.43 -1.26 -0.37 118.68 122.68 2jd4 s LEU 2758Ca 0.20 1.42 0.00 0.00 -1.03 0.00 0.00 54.13 54.72 2jd4 s LEU 2758Cb -0.06 -3.08 0.02 0.00 0.03 0.00 0.00 46.19 43.11 2jd4 s LEU 2758CO 0.09 0.24 -0.03 -1.00 0.23 0.00 0.00 176.35 175.88 2jd4 s HIS 2759N -1.14 0.79 -0.17 0.29 3.76 -0.45 -2.51 115.29 115.86 2jd4 s HIS 2759Ca 0.32 -0.24 0.00 0.00 -0.15 0.00 0.00 55.06 54.99 2jd4 s HIS 2759Cb -0.21 -0.75 0.00 0.00 1.11 0.00 0.00 32.58 32.73 2jd4 s HIS 2759CO 0.22 -0.26 -0.16 0.12 -0.85 0.00 0.00 174.74 173.81 2jd4 s PHE 2760N 1.30 2.79 0.02 1.40 5.36 0.12 -1.55 117.98 127.42 2jd4 s PHE 2760Ca -0.05 -1.21 -0.08 0.00 -0.96 0.00 0.00 56.93 54.63 2jd4 s PHE 2760Cb -0.14 -1.92 0.00 0.00 -0.34 0.00 0.00 43.02 40.63 2jd4 s PHE 2760CO -0.02 -0.58 0.15 0.00 -1.46 0.00 0.00 175.22 173.31 2jd4 s MET 2761N 1.02 0.57 0.14 10.12 0.23 -0.79 -0.23 119.30 130.37 2jd4 s MET 2761Ca -0.01 -0.53 -0.15 0.00 -1.03 0.00 0.00 55.69 53.96 2jd4 s MET 2761Cb -0.15 0.24 0.03 0.00 -1.53 0.00 0.00 34.83 33.42 2jd4 s MET 2761CO -0.04 -0.15 0.41 -0.59 -2.03 0.00 0.00 175.02 172.62 2jd4 s PHE 2762N -1.97 -0.10 -0.06 3.16 -0.12 -0.86 -0.86 117.98 117.17 2jd4 s PHE 2762Ca -0.10 -0.24 -0.01 0.00 -0.05 0.00 0.00 56.93 56.53 2jd4 s PHE 2762Cb -0.04 0.24 0.03 0.00 -0.63 0.00 0.00 43.02 42.61 2jd4 s PHE 2762CO -0.01 -0.75 0.01 0.34 -0.05 0.00 0.00 175.22 174.76 2jd4 s ASP 2763N -2.84 1.29 0.00 1.98 -1.08 -0.47 -1.06 116.67 114.49 2jd4 s ASP 2763Ca 0.06 -0.05 0.21 0.00 -0.52 0.00 0.00 52.55 52.25 2jd4 s ASP 2763Cb 0.01 -0.36 0.98 0.00 -1.46 0.00 0.00 42.92 42.10 2jd4 s ASP 2763CO -0.09 -0.18 1.67 0.18 0.52 0.00 0.00 175.17 177.27 2jd4 n LEU 2764N 4.95 0.86 0.00 -1.34 4.77 -1.23 -2.21 117.00 122.79 2jd4 n LEU 2764Ca -0.10 -0.35 0.00 0.00 -0.03 0.00 0.00 56.01 55.53 2jd4 n LEU 2764Cb 0.50 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.54 2jd4 n LEU 2764CO 0.12 0.17 0.00 0.61 -1.33 0.00 0.00 177.39 176.97 2jd4 n GLY 2765N 0.98 1.75 1.16 -0.72 0.00 -1.25 -4.56 105.19 102.55 2jd4 n GLY 2765Ca 0.16 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.20 2jd4 n GLY 2765CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2jd4 n LYS 2766N 0.00 0.00 0.00 1.61 5.02 -1.26 -4.99 118.16 118.54 2jd4 n LYS 2766Ca 0.00 -1.59 0.00 0.00 -2.02 0.00 0.00 58.31 54.70 2jd4 n LYS 2766Cb 0.00 -0.09 0.00 0.00 -0.02 0.00 0.00 35.03 34.92 2jd4 n LYS 2766CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2jd4 n GLY 2767N 0.31 3.88 3.82 0.72 0.00 -1.26 -4.47 105.19 108.18 2jd4 n GLY 2767Ca 0.02 -0.77 -0.36 0.00 0.00 0.00 0.00 46.02 44.91 2jd4 n GLY 2767CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2jd4 s ARG 2768N -2.57 3.42 -0.08 1.61 3.52 -1.26 -3.58 118.95 120.00 2jd4 s ARG 2768Ca 0.00 -0.20 0.02 0.00 -0.13 0.00 0.00 55.73 55.42 2jd4 s ARG 2768Cb 0.00 -3.12 -0.02 0.00 -1.56 0.00 0.00 34.95 30.25 2jd4 s ARG 2768CO 0.00 0.71 -0.14 0.99 -0.81 0.00 0.00 175.30 176.05 2jd4 s THR 2769N -0.84 3.01 0.00 4.11 2.01 -0.23 -4.69 115.64 119.02 2jd4 s THR 2769Ca 0.14 -0.71 0.04 0.00 0.31 0.00 0.00 61.69 61.46 2jd4 s THR 2769Cb -0.12 -2.21 -0.01 0.00 0.01 0.00 0.00 72.50 70.17 2jd4 s THR 2769CO 0.03 0.56 -0.11 -0.75 -0.69 0.00 0.00 174.62 173.66 2jd4 s LYS 2770N -0.25 0.87 0.00 4.92 2.20 -1.26 -2.03 119.74 124.18 2jd4 s LYS 2770Ca 0.01 -0.49 0.03 0.00 -0.36 0.00 0.00 55.97 55.16 2jd4 s LYS 2770Cb -0.13 -0.84 -0.01 0.00 -1.51 0.00 0.00 37.83 35.34 2jd4 s LYS 2770CO 0.03 0.22 -0.09 0.08 -0.36 0.00 0.00 175.35 175.23 2jd4 s VAL 2771N -0.44 0.72 0.19 4.02 1.01 0.68 -4.98 120.40 121.60 2jd4 s VAL 2771Ca 0.03 -0.48 0.07 0.00 0.00 0.00 0.00 61.98 61.60 2jd4 s VAL 2771Cb -0.05 -0.62 -0.05 0.00 0.00 0.00 0.00 36.38 35.66 2jd4 s VAL 2771CO 0.00 0.13 -0.14 -0.44 0.00 0.00 0.00 175.10 174.65 2jd4 s SER 2772N -0.39 2.48 -0.01 3.32 0.01 -1.26 -0.71 113.70 117.14 2jd4 s SER 2772Ca 0.02 -0.99 0.02 0.00 1.31 0.00 0.00 55.95 56.32 2jd4 s SER 2772Cb -0.04 -0.12 -0.00 0.00 0.21 0.00 0.00 66.02 66.06 2jd4 s SER 2772CO -0.00 -0.17 -0.08 -2.28 0.41 0.00 0.00 173.24 171.12 2jd4 s HIS 2773N -2.84 0.78 0.28 2.43 2.46 -1.04 -4.92 115.29 112.43 2jd4 s HIS 2773Ca 0.20 -0.16 0.17 0.00 0.47 0.00 0.00 55.06 55.74 2jd4 s HIS 2773Cb -0.01 -0.52 0.76 0.00 -0.13 0.00 0.00 32.58 32.67 2jd4 s HIS 2773CO 0.06 -0.04 1.79 -1.00 -2.47 0.00 0.00 174.74 173.09 2jd4 h PRO 2774N 6.10 0.00 -6.32 2.88 0.13 -2.00 -3.36 132.00 129.43 2jd4 h PRO 2774Ca -0.31 0.00 -0.66 0.00 -0.87 0.00 0.00 66.00 64.16 2jd4 h PRO 2774Cb 1.18 0.00 0.07 0.00 0.13 0.00 0.00 31.00 32.38 2jd4 h PRO 2774CO 0.49 0.37 0.30 0.00 -0.23 0.00 0.00 178.00 178.93 2jd4 n ALA 2775N -2.36 -0.84 -2.60 -0.56 0.00 -1.26 -4.93 120.51 107.96 2jd4 n ALA 2775Ca -0.01 0.47 -0.40 0.00 0.00 0.00 0.00 53.44 53.50 2jd4 n ALA 2775Cb 0.45 -2.03 -0.08 0.00 0.00 0.00 0.00 19.45 17.79 2jd4 n ALA 2775CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2jd4 s LEU 2776N 0.63 4.14 0.03 0.00 2.96 -1.26 -4.48 118.68 120.70 2jd4 s LEU 2776Ca 0.75 0.34 0.22 0.00 -0.22 0.00 0.00 54.13 55.22 2jd4 s LEU 2776Cb -0.87 -2.64 -0.17 0.00 0.50 0.00 0.00 46.19 43.01 2jd4 s LEU 2776CO 0.51 -0.35 0.77 0.18 -1.32 0.00 0.00 176.35 176.14 2jd4 n LEU 2777N 5.62 0.43 -1.81 -0.68 4.32 -0.97 -4.67 117.00 119.24 2jd4 n LEU 2777Ca -0.04 -0.03 -0.03 0.00 -0.02 0.00 0.00 56.01 55.89 2jd4 n LEU 2777Cb 0.49 -0.04 -0.04 0.00 -1.62 0.00 0.00 43.42 42.22 2jd4 n LEU 2777CO 0.42 0.02 0.90 -1.54 -1.22 0.00 0.00 177.39 175.97 2jd4 n SER 2778N -2.13 3.76 -0.92 -1.43 3.41 -1.26 -4.20 113.62 110.85 2jd4 n SER 2778Ca -0.01 -2.06 0.10 0.00 -0.26 0.00 0.00 58.87 56.64 2jd4 n SER 2778Cb 0.50 -0.87 0.15 0.00 -0.26 0.00 0.00 64.21 63.73 2jd4 n SER 2778CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 2jd4 n ASP 2779N 1.98 3.03 0.00 4.04 5.68 -1.18 -4.57 116.55 125.53 2jd4 n ASP 2779Ca 0.10 -1.89 0.00 0.00 -0.50 0.00 0.00 54.79 52.50 2jd4 n ASP 2779Cb 0.45 -0.15 0.00 0.00 -1.14 0.00 0.00 41.12 40.28 2jd4 n ASP 2779CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2jd4 n GLY 2780N 1.19 0.40 3.67 6.12 0.00 -0.42 -5.00 105.19 111.14 2jd4 n GLY 2780Ca 0.15 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.89 2jd4 n GLY 2780CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jd4 s LYS 2781N -0.44 2.43 0.25 1.61 1.02 -1.26 -4.75 119.74 118.59 2jd4 s LYS 2781Ca 0.00 -1.03 -0.30 0.00 0.02 0.00 0.00 55.97 54.66 2jd4 s LYS 2781Cb 0.00 -2.40 -0.10 0.00 -0.52 0.00 0.00 37.83 34.81 2jd4 s LYS 2781CO 0.00 0.48 1.36 -1.58 -0.92 0.00 0.00 175.35 174.69 2jd4 s TRP 2782N -1.59 3.12 0.07 3.18 0.52 -1.26 -4.51 118.94 118.46 2jd4 s TRP 2782Ca 0.27 1.18 0.05 0.00 0.02 0.00 0.00 56.10 57.62 2jd4 s TRP 2782Cb -0.10 -3.71 -0.03 0.00 -1.15 0.00 0.00 33.47 28.49 2jd4 s TRP 2782CO 0.18 -2.19 -0.13 -1.01 0.02 0.00 0.00 176.95 173.82 2jd4 s HIS 2783N -0.21 1.15 -0.14 -1.98 3.76 0.13 -4.96 115.29 113.03 2jd4 s HIS 2783Ca 0.56 -0.47 -0.06 0.00 -0.15 0.00 0.00 55.06 54.94 2jd4 s HIS 2783Cb -0.39 -0.65 -0.04 0.00 1.11 0.00 0.00 32.58 32.61 2jd4 s HIS 2783CO 0.43 0.04 0.06 0.95 -0.85 0.00 0.00 174.74 175.37 2jd4 s THR 2784N -1.34 4.77 0.00 1.30 -4.23 -1.26 -0.66 115.64 114.21 2jd4 s THR 2784Ca -0.02 -0.06 0.05 0.00 -1.18 0.00 0.00 61.69 60.48 2jd4 s THR 2784Cb -0.10 -3.10 -0.02 0.00 1.34 0.00 0.00 72.50 70.63 2jd4 s THR 2784CO 0.02 0.53 -0.16 -0.69 -0.54 0.00 0.00 174.62 173.78 2jd4 s VAL 2785N -0.25 1.28 -0.02 2.29 1.01 0.53 -1.08 120.40 124.16 2jd4 s VAL 2785Ca 0.08 -0.79 0.01 0.00 0.00 0.00 0.00 61.98 61.28 2jd4 s VAL 2785Cb -0.12 -1.08 0.02 0.00 0.00 0.00 0.00 36.38 35.20 2jd4 s VAL 2785CO 0.02 0.28 -0.01 -0.75 0.00 0.00 0.00 175.10 174.64 2jd4 s LYS 2786N -0.58 0.29 -0.08 2.72 2.20 -0.01 -1.29 119.74 122.98 2jd4 s LYS 2786Ca 0.06 0.03 0.04 0.00 -0.36 0.00 0.00 55.97 55.73 2jd4 s LYS 2786Cb -0.07 -0.42 -0.00 0.00 -1.51 0.00 0.00 37.83 35.84 2jd4 s LYS 2786CO -0.00 -0.08 -0.21 0.95 -0.36 0.00 0.00 175.35 175.65 2jd4 s THR 2787N 0.72 1.80 -0.06 3.43 -4.23 -0.29 -0.94 115.64 116.08 2jd4 s THR 2787Ca -0.07 -0.89 -0.01 0.00 -1.18 0.00 0.00 61.69 59.54 2jd4 s THR 2787Cb -0.10 -1.56 0.03 0.00 1.34 0.00 0.00 72.50 72.20 2jd4 s THR 2787CO -0.01 0.50 -0.00 -1.61 -0.54 0.00 0.00 174.62 172.96 2jd4 s GLU 2788N 0.23 0.54 -0.22 3.99 2.02 -0.22 -1.32 118.70 123.73 2jd4 s GLU 2788Ca -0.12 0.08 -0.01 0.00 0.02 0.00 0.00 54.97 54.94 2jd4 s GLU 2788Cb -0.16 -0.83 0.02 0.00 0.10 0.00 0.00 34.13 33.26 2jd4 s GLU 2788CO 0.06 -0.23 -0.09 -0.47 0.02 0.00 0.00 175.26 174.54 2jd4 s TYR 2789N 1.62 2.97 -0.14 1.61 5.04 -0.36 -0.89 117.35 127.20 2jd4 s TYR 2789Ca -0.01 -1.45 -0.06 0.00 -2.44 0.00 0.00 57.07 53.12 2jd4 s TYR 2789Cb -0.13 -2.03 0.07 0.00 0.35 0.00 0.00 41.96 40.22 2jd4 s TYR 2789CO -0.03 -0.71 0.31 -1.50 -1.34 0.00 0.00 175.55 172.27 2jd4 s ILE 2790N 1.35 -0.39 0.00 3.14 2.07 -0.63 -0.57 121.20 126.16 2jd4 s ILE 2790Ca 0.03 0.23 0.00 0.00 -1.41 0.00 0.00 60.65 59.49 2jd4 s ILE 2790Cb -0.15 -0.50 0.00 0.00 0.13 0.00 0.00 42.46 41.94 2jd4 s ILE 2790CO -0.06 0.09 0.00 0.29 -1.91 0.00 0.00 174.94 173.35 2jd4 n LYS 2791N 5.14 0.00 -0.05 3.50 4.76 -1.11 -2.01 118.16 128.40 2jd4 n LYS 2791Ca -0.10 0.00 0.06 0.00 -2.87 0.00 0.00 58.31 55.39 2jd4 n LYS 2791Cb 0.50 0.00 0.08 0.00 -1.84 0.00 0.00 35.03 33.77 2jd4 n LYS 2791CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 2jd4 n ARG 2792N 0.00 1.98 -4.42 1.97 5.12 -1.26 -4.97 116.66 115.08 2jd4 n ARG 2792Ca 0.00 -2.08 -0.21 0.00 -1.93 0.00 0.00 57.85 53.64 2jd4 n ARG 2792Cb 0.00 -1.26 -0.10 0.00 -1.16 0.00 0.00 32.46 29.93 2jd4 n ARG 2792CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 2jd4 s LYS 2793N -2.01 1.53 -0.14 5.56 3.01 -0.85 -0.79 119.74 126.05 2jd4 s LYS 2793Ca 0.18 -1.79 -0.18 0.00 -1.01 0.00 0.00 55.97 53.17 2jd4 s LYS 2793Cb 0.15 -1.00 0.04 0.00 -1.01 0.00 0.00 37.83 36.01 2jd4 s LYS 2793CO 0.02 -0.03 0.47 0.00 0.51 0.00 0.00 175.35 176.32 2jd4 s ALA 2794N -3.14 -1.18 0.27 5.17 0.00 -0.65 -1.61 121.76 120.63 2jd4 s ALA 2794Ca 0.30 1.17 -0.20 0.00 0.00 0.00 0.00 51.96 53.23 2jd4 s ALA 2794Cb 0.05 -0.56 0.02 0.00 0.00 0.00 0.00 23.12 22.64 2jd4 s ALA 2794CO 0.12 -0.25 0.69 -0.59 0.00 0.00 0.00 175.76 175.73 2jd4 s PHE 2795N -0.17 -0.16 0.10 0.00 -0.12 -0.07 -1.13 117.98 116.43 2jd4 s PHE 2795Ca -0.04 -0.27 0.05 0.00 -0.05 0.00 0.00 56.93 56.62 2jd4 s PHE 2795Cb -0.03 0.66 -0.03 0.00 -0.63 0.00 0.00 43.02 42.98 2jd4 s PHE 2795CO 0.02 -1.20 -0.14 -1.64 -0.05 0.00 0.00 175.22 172.22 2jd4 s MET 2796N -3.92 0.93 -0.02 1.99 -1.94 -1.26 -1.06 119.30 114.03 2jd4 s MET 2796Ca 0.11 -1.13 0.01 0.00 -1.71 0.00 0.00 55.69 52.97 2jd4 s MET 2796Cb -0.05 -0.83 0.01 0.00 2.01 0.00 0.00 34.83 35.97 2jd4 s MET 2796CO 0.06 0.17 -0.01 0.99 -0.01 0.00 0.00 175.02 176.22 2jd4 s THR 2797N -1.88 0.17 -0.09 2.05 2.01 -0.11 -0.91 115.64 116.88 2jd4 s THR 2797Ca 0.05 0.01 -0.00 0.00 0.31 0.00 0.00 61.69 62.05 2jd4 s THR 2797Cb -0.06 -0.22 0.02 0.00 0.01 0.00 0.00 72.50 72.25 2jd4 s THR 2797CO 0.02 0.10 -0.05 -0.69 -0.69 0.00 0.00 174.62 173.31 2jd4 s VAL 2798N 0.55 0.79 -1.57 3.82 1.01 -0.95 -0.83 120.40 123.21 2jd4 s VAL 2798Ca -0.05 -0.16 -0.14 0.00 0.00 0.00 0.00 61.98 61.63 2jd4 s VAL 2798Cb -0.08 -0.84 0.10 0.00 0.00 0.00 0.00 36.38 35.56 2jd4 s VAL 2798CO -0.01 0.32 0.90 0.47 0.00 0.00 0.00 175.10 176.78 2jd4 n ASP 2799N 4.85 -4.12 0.00 3.32 8.00 -0.24 -1.51 116.55 126.85 2jd4 n ASP 2799Ca -0.13 -0.85 0.00 0.00 0.71 0.00 0.00 54.79 54.52 2jd4 n ASP 2799Cb 0.50 -3.56 0.00 0.00 -0.02 0.00 0.00 41.12 38.04 2jd4 n ASP 2799CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2jd4 n GLY 2800N -1.62 2.77 3.57 0.44 0.00 -1.26 -4.99 105.19 104.10 2jd4 n GLY 2800Ca 0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.62 2jd4 n GLY 2800CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2jd4 s GLN 2801N -0.21 3.59 0.04 1.61 -2.07 -0.57 -5.02 119.66 117.04 2jd4 s GLN 2801Ca 0.00 0.24 -0.21 0.00 -1.82 0.00 0.00 55.36 53.58 2jd4 s GLN 2801Cb 0.00 -3.90 -0.06 0.00 -1.09 0.00 0.00 33.01 27.96 2jd4 s GLN 2801CO 0.00 -1.17 0.61 -2.00 -1.32 0.00 0.00 175.29 171.41 2jd4 s GLU 2802N 3.71 4.30 0.46 9.60 2.12 -1.26 -2.24 118.70 135.38 2jd4 s GLU 2802Ca 0.37 0.79 -0.04 0.00 0.36 0.00 0.00 54.97 56.44 2jd4 s GLU 2802Cb -0.10 -3.29 -0.03 0.00 0.26 0.00 0.00 34.13 30.96 2jd4 s GLU 2802CO 0.25 0.50 0.75 -1.54 -0.54 0.00 0.00 175.26 174.68 2jd4 s SER 2803N -0.65 6.25 0.73 -1.70 1.04 -0.09 -5.01 113.70 114.27 2jd4 s SER 2803Ca 0.31 0.85 -0.15 0.00 0.48 0.00 0.00 55.95 57.45 2jd4 s SER 2803Cb -0.19 -2.20 0.04 0.00 0.10 0.00 0.00 66.02 63.76 2jd4 s SER 2803CO 0.19 -0.55 1.18 -2.84 0.98 0.00 0.00 173.24 172.20 2jd4 s PRO 2804N -4.69 2.21 0.59 4.02 0.02 -1.26 -4.58 135.00 131.32 2jd4 s PRO 2804Ca 0.46 1.67 -0.13 0.00 0.02 0.00 0.00 61.00 63.02 2jd4 s PRO 2804Cb -0.10 -1.85 -0.05 0.00 0.02 0.00 0.00 34.50 32.52 2jd4 s PRO 2804CO 0.44 -1.76 1.02 -1.12 -0.33 0.00 0.00 177.00 175.25 2jd4 s SER 2805N -2.19 6.19 0.07 2.53 0.01 -1.26 -4.75 113.70 114.29 2jd4 s SER 2805Ca 0.72 1.54 0.08 0.00 1.31 0.00 0.00 55.95 59.60 2jd4 s SER 2805Cb -0.27 -2.49 -0.03 0.00 0.21 0.00 0.00 66.02 63.44 2jd4 s SER 2805CO 0.45 -0.89 -0.22 -0.69 0.41 0.00 0.00 173.24 172.30 2jd4 s VAL 2806N -2.90 1.77 -0.04 3.43 1.01 -0.28 -4.95 120.40 118.44 2jd4 s VAL 2806Ca 0.58 -1.36 -0.26 0.00 0.00 0.00 0.00 61.98 60.93 2jd4 s VAL 2806Cb -0.12 -1.56 -0.03 0.00 0.00 0.00 0.00 36.38 34.67 2jd4 s VAL 2806CO 0.45 0.13 0.80 -0.89 0.00 0.00 0.00 175.10 175.59 2jd4 s THR 2807N -0.93 4.98 0.19 3.92 2.01 -1.26 -1.64 115.64 122.91 2jd4 s THR 2807Ca 0.08 1.66 -0.33 0.00 0.31 0.00 0.00 61.69 63.41 2jd4 s THR 2807Cb -0.09 -4.14 -0.13 0.00 0.01 0.00 0.00 72.50 68.14 2jd4 s THR 2807CO 0.03 0.22 1.59 0.52 -0.69 0.00 0.00 174.62 176.28 2jd4 n VAL 2808N 3.82 0.18 -3.51 3.82 0.31 0.03 -4.96 118.33 118.02 2jd4 n VAL 2808Ca 0.01 -0.04 -0.36 0.00 -0.01 0.00 0.00 64.34 63.94 2jd4 n VAL 2808Cb 0.51 -1.65 -0.06 0.00 -0.91 0.00 0.00 33.84 31.74 2jd4 n VAL 2808CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 2jd4 s VAL 2809N 0.79 5.03 0.00 2.52 1.01 -1.26 -4.99 120.40 123.50 2jd4 s VAL 2809Ca 0.76 0.69 0.00 0.00 0.00 0.00 0.00 61.98 63.42 2jd4 s VAL 2809Cb -0.63 -3.69 0.00 0.00 0.00 0.00 0.00 36.38 32.06 2jd4 s VAL 2809CO 0.39 0.42 0.00 0.61 0.00 0.00 0.00 175.10 176.52 2jd4 n GLY 2810N 1.33 1.23 0.09 4.51 0.00 -1.26 -4.53 105.19 106.56 2jd4 n GLY 2810Ca -0.11 -1.93 -0.11 0.00 0.00 0.00 0.00 46.02 43.88 2jd4 n GLY 2810CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jd4 h LYS 2811N 0.00 0.05 -6.57 1.61 6.56 -1.94 -3.48 116.57 112.80 2jd4 h LYS 2811Ca 0.00 -0.08 -0.58 0.00 -1.06 0.00 0.00 60.65 58.93 2jd4 h LYS 2811Cb 0.00 0.03 0.17 0.00 -0.57 0.00 0.00 32.23 31.87 2jd4 h LYS 2811CO 0.00 0.66 -0.35 0.00 -2.06 0.00 0.00 179.45 177.70 2jd4 n ALA 2812N -2.60 -1.12 -0.05 3.86 0.00 -1.26 -4.94 120.51 114.40 2jd4 n ALA 2812Ca -0.18 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.19 2jd4 n ALA 2812Cb 1.04 -1.86 0.00 0.00 0.00 0.00 0.00 19.45 18.63 2jd4 n ALA 2812CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2jd4 n THR 2813N -1.87 0.00 -4.43 0.00 -2.24 -1.26 -4.97 114.28 99.51 2jd4 n THR 2813Ca 0.11 -0.45 -0.21 0.00 -2.27 0.00 0.00 64.05 61.24 2jd4 n THR 2813Cb 0.48 1.05 -0.14 0.00 -2.10 0.00 0.00 70.33 69.62 2jd4 n THR 2813CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2jd4 s THR 2814N -0.47 1.10 -0.54 4.28 -4.23 -1.26 -4.72 115.64 109.80 2jd4 s THR 2814Ca 0.00 -0.88 -0.19 0.00 -1.18 0.00 0.00 61.69 59.44 2jd4 s THR 2814Cb 0.00 -0.98 0.08 0.00 1.34 0.00 0.00 72.50 72.94 2jd4 s THR 2814CO 0.00 0.09 0.65 -0.22 -0.54 0.00 0.00 174.62 174.59 2jd4 s LEU 2815N -0.91 5.20 -0.43 4.79 2.96 -0.24 -4.67 118.68 125.39 2jd4 s LEU 2815Ca 0.03 -1.18 -0.12 0.00 -0.22 0.00 0.00 54.13 52.64 2jd4 s LEU 2815Cb -0.07 -2.37 0.07 0.00 0.50 0.00 0.00 46.19 44.32 2jd4 s LEU 2815CO 0.01 -0.98 0.30 -1.81 -1.32 0.00 0.00 176.35 172.55 2jd4 s ASP 2816N 3.11 5.85 0.12 3.68 1.01 -1.26 -3.63 116.67 125.55 2jd4 s ASP 2816Ca 0.13 -1.33 -0.00 0.00 0.71 0.00 0.00 52.55 52.05 2jd4 s ASP 2816Cb -0.22 -2.07 -0.04 0.00 1.01 0.00 0.00 42.92 41.60 2jd4 s ASP 2816CO 0.09 -0.55 0.01 0.68 0.21 0.00 0.00 175.17 175.61 2jd4 s VAL 2817N 1.53 0.32 0.60 -1.27 -7.23 -1.26 -3.84 120.40 109.26 2jd4 s VAL 2817Ca 0.03 -1.91 -0.19 0.00 -1.81 0.00 0.00 61.98 58.11 2jd4 s VAL 2817Cb -0.23 -1.90 -0.03 0.00 0.56 0.00 0.00 36.38 34.78 2jd4 s VAL 2817CO 0.05 -0.63 1.27 -1.61 -0.31 0.00 0.00 175.10 173.86 2jd4 s GLU 2818N -3.97 2.86 0.00 4.82 0.41 -0.39 -4.85 118.70 117.59 2jd4 s GLU 2818Ca 0.19 1.99 -0.04 0.00 -0.41 0.00 0.00 54.97 56.70 2jd4 s GLU 2818Cb 0.07 -1.97 -0.16 0.00 -1.78 0.00 0.00 34.13 30.28 2jd4 s GLU 2818CO -0.01 -1.33 2.42 0.54 -0.49 0.00 0.00 175.26 176.39 2jd4 n ARG 2819N -1.57 1.23 -3.75 1.61 5.12 -1.26 -4.70 116.66 113.34 2jd4 n ARG 2819Ca 0.14 -0.61 -0.13 0.00 -1.93 0.00 0.00 57.85 55.32 2jd4 n ARG 2819Cb 0.48 -1.80 -0.11 0.00 -1.16 0.00 0.00 32.46 29.87 2jd4 n ARG 2819CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 2jd4 s LYS 2820N 1.74 0.37 -0.11 5.56 1.02 -1.26 -2.10 119.74 124.96 2jd4 s LYS 2820Ca 0.41 0.49 0.03 0.00 0.02 0.00 0.00 55.97 56.92 2jd4 s LYS 2820Cb 0.20 0.14 -0.00 0.00 -0.52 0.00 0.00 37.83 37.64 2jd4 s LYS 2820CO 0.00 -0.07 -0.21 -1.17 -0.92 0.00 0.00 175.35 172.98 2jd4 s LEU 2821N 0.39 2.22 -0.25 3.17 0.20 -0.01 -4.62 118.68 119.77 2jd4 s LEU 2821Ca -0.02 -0.52 -0.16 0.00 0.69 0.00 0.00 54.13 54.12 2jd4 s LEU 2821Cb -0.04 -1.46 -0.03 0.00 -0.43 0.00 0.00 46.19 44.23 2jd4 s LEU 2821CO -0.02 0.15 0.43 -0.31 -0.29 0.00 0.00 176.35 176.31 2jd4 s TYR 2822N 0.43 3.28 -0.15 5.38 1.51 -0.17 -1.10 117.35 126.53 2jd4 s TYR 2822Ca -0.15 0.54 -0.03 0.00 -1.01 0.00 0.00 57.07 56.42 2jd4 s TYR 2822Cb -0.17 -2.62 -0.03 0.00 -0.11 0.00 0.00 41.96 39.04 2jd4 s TYR 2822CO 0.06 -0.20 -0.05 -1.17 -1.11 0.00 0.00 175.55 173.09 2jd4 s LEU 2823N 1.98 3.17 0.00 -1.29 2.96 -0.20 -1.24 118.68 124.06 2jd4 s LEU 2823Ca 0.18 -0.16 0.00 0.00 -0.22 0.00 0.00 54.13 53.93 2jd4 s LEU 2823Cb -0.15 -1.76 0.00 0.00 0.50 0.00 0.00 46.19 44.78 2jd4 s LEU 2823CO 0.09 0.17 0.00 0.61 -1.32 0.00 0.00 176.35 175.90 2jd4 n GLY 2824N 3.52 2.68 0.00 7.98 0.00 0.15 -1.93 105.19 117.59 2jd4 n GLY 2824Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.85 2jd4 n GLY 2824CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jd4 n GLY 2825N -1.99 -1.32 3.28 -0.02 0.00 -1.21 -2.03 105.19 101.89 2jd4 n GLY 2825Ca 0.00 -1.05 -0.17 0.00 0.00 0.00 0.00 46.02 44.80 2jd4 n GLY 2825CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jd4 s LEU 2826N 0.00 2.50 0.65 0.99 1.43 -1.26 -4.74 118.68 118.25 2jd4 s LEU 2826Ca 0.00 -0.96 -0.17 0.00 -1.03 0.00 0.00 54.13 51.98 2jd4 s LEU 2826Cb 0.00 -0.51 -0.01 0.00 0.03 0.00 0.00 46.19 45.71 2jd4 s LEU 2826CO 0.00 -0.23 1.19 -2.84 0.23 0.00 0.00 176.35 174.71 2jd4 s PRO 2827N -3.40 2.66 0.41 1.29 0.02 -1.26 -4.59 135.00 130.13 2jd4 s PRO 2827Ca 0.16 1.74 0.07 0.00 0.02 0.00 0.00 61.00 63.00 2jd4 s PRO 2827Cb -0.01 -1.90 0.85 0.00 0.02 0.00 0.00 34.50 33.46 2jd4 s PRO 2827CO 0.03 -1.43 2.03 1.03 -0.33 0.00 0.00 177.00 178.34 2jd4 h SER 2828N 0.36 0.43 1.36 2.53 0.87 -1.97 -2.58 113.55 114.55 2jd4 h SER 2828Ca -0.49 -0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.05 2jd4 h SER 2828Cb 1.29 -0.11 0.00 0.00 -0.44 0.00 0.00 62.40 63.14 2jd4 h SER 2828CO 0.53 0.35 0.00 0.00 -0.53 0.00 0.00 176.83 177.18 2jd4 n HIS 2829N -4.44 0.78 -2.80 2.24 1.44 -1.26 -4.87 115.22 106.31 2jd4 n HIS 2829Ca 0.02 0.23 -0.39 0.00 -2.01 0.00 0.00 57.72 55.57 2jd4 n HIS 2829Cb 0.10 -0.87 -0.06 0.00 0.12 0.00 0.00 29.99 29.27 2jd4 n HIS 2829CO 0.00 0.00 0.00 -0.47 -2.81 0.00 0.00 176.34 173.06 2jd4 s TYR 2830N -3.09 3.87 -0.47 -1.40 5.04 -0.97 -5.04 117.35 115.28 2jd4 s TYR 2830Ca 0.11 1.83 0.04 0.00 -2.44 0.00 0.00 57.07 56.60 2jd4 s TYR 2830Cb 0.13 -2.93 0.12 0.00 0.35 0.00 0.00 41.96 39.64 2jd4 s TYR 2830CO 0.57 0.38 0.21 1.03 -1.34 0.00 0.00 175.55 176.41 2jd4 s ARG 2831N -1.50 1.79 0.01 4.97 1.81 -1.26 -4.90 118.95 119.88 2jd4 s ARG 2831Ca 0.44 -2.39 -0.30 0.00 -1.72 0.00 0.00 55.73 51.75 2jd4 s ARG 2831Cb -0.23 -3.18 -0.04 0.00 -0.45 0.00 0.00 34.95 31.05 2jd4 s ARG 2831CO 0.28 -1.08 1.14 0.00 -0.68 0.00 0.00 175.30 174.96 2jd4 s ALA 2832N 0.04 3.35 0.06 2.13 0.00 -1.26 -5.03 121.76 121.04 2jd4 s ALA 2832Ca 0.16 0.70 0.02 0.00 0.00 0.00 0.00 51.96 52.85 2jd4 s ALA 2832Cb -0.24 -3.43 -0.04 0.00 0.00 0.00 0.00 23.12 19.40 2jd4 s ALA 2832CO -0.02 -0.46 0.06 1.03 0.00 0.00 0.00 175.76 176.37 2jd4 s ARG 2833N 1.33 2.86 -1.54 0.00 0.52 -1.26 -4.69 118.95 116.17 2jd4 s ARG 2833Ca 0.56 -0.66 -0.05 0.00 -0.52 0.00 0.00 55.73 55.06 2jd4 s ARG 2833Cb -0.26 -2.72 0.01 0.00 0.52 0.00 0.00 34.95 32.50 2jd4 s ARG 2833CO 0.27 0.58 0.63 0.09 0.02 0.00 0.00 175.30 176.89 2jd4 n ASN 2834N 0.72 -6.02 -0.25 0.23 3.02 -1.26 -4.87 115.26 106.82 2jd4 n ASN 2834Ca -0.10 -0.30 0.04 0.00 -0.03 0.00 0.00 54.58 54.18 2jd4 n ASN 2834Cb 0.52 -4.86 0.05 0.00 -0.61 0.00 0.00 39.78 34.88 2jd4 n ASN 2834CO 0.00 0.00 0.00 2.30 -2.62 0.00 0.00 177.26 176.94 2jd4 n ILE 2835N -4.51 0.78 -3.59 2.41 -5.35 -1.26 -5.12 119.36 102.72 2jd4 n ILE 2835Ca -0.10 -0.92 0.00 0.00 -0.27 0.00 0.00 62.75 61.46 2jd4 n ILE 2835Cb 0.61 0.28 0.00 0.00 -1.74 0.00 0.00 39.64 38.79 2jd4 n ILE 2835CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2jd4 n GLY 2836N -0.57 -1.67 0.01 3.28 0.00 -1.26 -4.39 105.19 100.59 2jd4 n GLY 2836Ca 0.06 -1.41 0.12 0.00 0.00 0.00 0.00 46.02 44.79 2jd4 n GLY 2836CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2jd4 n THR 2837N 0.00 0.04 -1.98 2.61 -2.24 -1.26 -4.62 114.28 106.84 2jd4 n THR 2837Ca 0.00 -0.04 -0.42 0.00 -2.27 0.00 0.00 64.05 61.31 2jd4 n THR 2837Cb 0.00 0.36 0.00 0.00 -2.10 0.00 0.00 70.33 68.59 2jd4 n THR 2837CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 2jd4 n ILE 2838N -1.59 3.70 0.11 2.28 2.08 -1.26 -4.45 119.36 120.23 2jd4 n ILE 2838Ca 0.05 -3.45 0.03 0.00 0.56 0.00 0.00 62.75 59.94 2jd4 n ILE 2838Cb 0.35 -2.53 0.05 0.00 -0.75 0.00 0.00 39.64 36.76 2jd4 n ILE 2838CO 0.00 0.00 0.00 0.35 0.56 0.00 0.00 176.55 177.46 2jd4 n THR 2839N 4.89 0.40 -2.10 1.39 -2.24 -1.26 -4.27 114.28 111.09 2jd4 n THR 2839Ca 0.49 -0.70 -0.29 0.00 -2.27 0.00 0.00 64.05 61.28 2jd4 n THR 2839Cb 0.39 0.88 0.02 0.00 -2.10 0.00 0.00 70.33 69.52 2jd4 n THR 2839CO 0.00 0.00 0.00 -1.38 -0.57 0.00 0.00 175.07 173.12 2jd4 s HIS 2840N -0.70 3.44 0.23 4.78 -3.43 -1.26 -4.48 115.29 113.87 2jd4 s HIS 2840Ca 0.09 1.01 -0.30 0.00 -0.80 0.00 0.00 55.06 55.06 2jd4 s HIS 2840Cb 0.06 -2.77 -0.09 0.00 -1.43 0.00 0.00 32.58 28.34 2jd4 s HIS 2840CO 0.08 -0.81 1.36 0.45 -2.00 0.00 0.00 174.74 173.82 2jd4 s SER 2841N -4.25 6.78 0.03 7.38 0.15 -0.40 -1.55 113.70 121.84 2jd4 s SER 2841Ca 0.55 2.54 -0.30 0.00 0.70 0.00 0.00 55.95 59.43 2jd4 s SER 2841Cb -0.11 -2.62 -0.05 0.00 -1.71 0.00 0.00 66.02 61.53 2jd4 s SER 2841CO 0.50 -0.60 1.27 -0.51 1.20 0.00 0.00 173.24 175.10 2jd4 s ILE 2842N -0.07 3.91 -1.11 6.45 1.10 -0.86 -4.38 121.20 126.24 2jd4 s ILE 2842Ca 0.57 1.34 -0.21 0.00 -0.51 0.00 0.00 60.65 61.84 2jd4 s ILE 2842Cb -0.39 -3.86 0.06 0.00 0.15 0.00 0.00 42.46 38.43 2jd4 s ILE 2842CO 0.42 0.06 1.52 -2.84 -2.11 0.00 0.00 174.94 171.99 2jd4 s PRO 2843N 1.55 3.73 0.20 3.50 0.02 -1.26 -1.92 135.00 140.83 2jd4 s PRO 2843Ca 0.60 -1.48 -0.23 0.00 0.02 0.00 0.00 61.00 59.92 2jd4 s PRO 2843Cb -0.30 -5.38 0.05 0.00 0.02 0.00 0.00 34.50 28.89 2jd4 s PRO 2843CO 0.27 -2.18 0.69 0.00 -0.33 0.00 0.00 177.00 175.45 2jd4 s ALA 2844N 4.50 -1.44 -0.17 -1.55 0.00 -1.18 -4.28 121.76 117.64 2jd4 s ALA 2844Ca 0.48 0.14 -0.09 0.00 0.00 0.00 0.00 51.96 52.48 2jd4 s ALA 2844Cb 0.01 0.83 -0.05 0.00 0.00 0.00 0.00 23.12 23.91 2jd4 s ALA 2844CO -0.04 -0.90 0.14 0.00 0.00 0.00 0.00 175.76 174.96 2jd4 s ILE 2846N -0.14 1.62 0.00 0.00 1.01 0.54 -2.10 121.20 122.13 2jd4 s ILE 2846Ca 0.11 -0.77 0.00 0.00 0.00 0.00 0.00 60.65 59.99 2jd4 s ILE 2846Cb -0.12 -1.42 0.00 0.00 0.01 0.00 0.00 42.46 40.94 2jd4 s ILE 2846CO 0.01 0.46 0.00 0.61 0.00 0.00 0.00 174.94 176.02 2jd4 n GLY 2847N 3.54 1.14 3.80 6.18 0.00 -0.95 -1.52 105.19 117.39 2jd4 n GLY 2847Ca -0.20 -1.10 -0.33 0.00 0.00 0.00 0.00 46.02 44.39 2jd4 n GLY 2847CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2jd4 s GLU 2848N 1.91 3.31 -0.01 1.61 0.41 -1.26 -4.81 118.70 119.86 2jd4 s GLU 2848Ca 0.00 1.23 0.01 0.00 -0.41 0.00 0.00 54.97 55.80 2jd4 s GLU 2848Cb 0.00 -2.03 0.00 0.00 -1.78 0.00 0.00 34.13 30.32 2jd4 s GLU 2848CO 0.00 -0.82 -0.03 -1.50 -0.49 0.00 0.00 175.26 172.41 2jd4 s ILE 2849N -2.41 0.30 0.04 -1.63 2.07 -1.26 -3.53 121.20 114.78 2jd4 s ILE 2849Ca 0.64 -0.13 0.09 0.00 -1.41 0.00 0.00 60.65 59.84 2jd4 s ILE 2849Cb -0.16 -0.28 -0.03 0.00 0.13 0.00 0.00 42.46 42.12 2jd4 s ILE 2849CO 0.36 0.10 -0.26 -0.04 -1.91 0.00 0.00 174.94 173.19 2jd4 s MET 2850N 0.09 1.83 -0.12 3.50 -1.94 0.50 -1.28 119.30 121.89 2jd4 s MET 2850Ca -0.01 -1.08 0.00 0.00 -1.71 0.00 0.00 55.69 52.90 2jd4 s MET 2850Cb -0.04 -1.97 0.02 0.00 2.01 0.00 0.00 34.83 34.86 2jd4 s MET 2850CO -0.00 0.51 -0.11 0.08 -0.01 0.00 0.00 175.02 175.50 2jd4 s VAL 2851N -0.78 1.23 -1.44 -6.03 1.01 0.09 -1.43 120.40 113.06 2jd4 s VAL 2851Ca 0.11 -0.43 -0.01 0.00 0.00 0.00 0.00 61.98 61.65 2jd4 s VAL 2851Cb -0.10 -1.19 0.01 0.00 0.00 0.00 0.00 36.38 35.10 2jd4 s VAL 2851CO 0.02 0.40 0.39 0.59 0.00 0.00 0.00 175.10 176.49 2jd4 n ASN 2852N 4.72 -0.30 0.00 3.32 4.13 0.25 -1.47 115.26 125.90 2jd4 n ASN 2852Ca -0.15 -1.04 0.00 0.00 1.68 0.00 0.00 54.58 55.07 2jd4 n ASN 2852Cb 0.50 -2.87 0.00 0.00 -1.54 0.00 0.00 39.78 35.87 2jd4 n ASN 2852CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2jd4 n GLY 2853N -2.03 2.10 3.60 7.41 0.00 -1.26 -5.02 105.19 109.99 2jd4 n GLY 2853Ca -0.30 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.38 2jd4 n GLY 2853CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2jd4 s GLN 2854N -0.00 3.55 -0.11 1.61 0.74 -0.55 -5.08 119.66 119.82 2jd4 s GLN 2854Ca 0.00 -0.42 -0.27 0.00 0.05 0.00 0.00 55.36 54.72 2jd4 s GLN 2854Cb 0.00 -2.97 -0.02 0.00 1.10 0.00 0.00 33.01 31.12 2jd4 s GLN 2854CO 0.00 0.40 0.88 -1.14 -0.55 0.00 0.00 175.29 174.88 2jd4 s GLN 2855N -0.04 4.39 0.30 1.67 0.74 -1.26 -0.73 119.66 124.72 2jd4 s GLN 2855Ca 0.04 1.15 -0.27 0.00 0.05 0.00 0.00 55.36 56.32 2jd4 s GLN 2855Cb -0.13 -3.53 -0.09 0.00 1.10 0.00 0.00 33.01 30.36 2jd4 s GLN 2855CO 0.02 -0.23 0.96 -0.51 -0.55 0.00 0.00 175.29 174.98 2jd4 s LEU 2856N 1.76 4.44 -0.82 3.68 1.02 -0.40 -4.98 118.68 123.37 2jd4 s LEU 2856Ca 0.43 1.92 -0.22 0.00 0.02 0.00 0.00 54.13 56.28 2jd4 s LEU 2856Cb -0.18 -3.87 0.08 0.00 0.02 0.00 0.00 46.19 42.24 2jd4 s LEU 2856CO 0.17 -0.03 1.15 -0.62 0.02 0.00 0.00 176.35 177.04 2jd4 s ASP 2857N -1.42 6.37 0.26 2.29 -1.08 -1.26 -4.71 116.67 117.12 2jd4 s ASP 2857Ca 0.47 -1.32 0.23 0.00 -0.52 0.00 0.00 52.55 51.41 2jd4 s ASP 2857Cb -0.22 -2.46 0.99 0.00 -1.46 0.00 0.00 42.92 39.76 2jd4 s ASP 2857CO 0.28 -1.40 1.69 0.29 0.52 0.00 0.00 175.17 176.55 2jd4 n LYS 2858N 7.83 0.18 0.05 4.34 5.02 -1.26 -2.14 118.16 132.19 2jd4 n LYS 2858Ca 0.13 0.45 0.13 0.00 -2.02 0.00 0.00 58.31 57.00 2jd4 n LYS 2858Cb 0.48 -1.87 0.50 0.00 -0.02 0.00 0.00 35.03 34.12 2jd4 n LYS 2858CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2jd4 n ASP 2859N -2.22 0.39 -3.00 4.39 8.00 -1.26 -4.05 116.55 118.79 2jd4 n ASP 2859Ca 0.02 0.54 -0.25 0.00 0.71 0.00 0.00 54.79 55.81 2jd4 n ASP 2859Cb 0.20 -0.64 -0.04 0.00 -0.02 0.00 0.00 41.12 40.62 2jd4 n ASP 2859CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2jd4 n ARG 2860N -1.87 2.75 -2.10 -1.24 1.74 -0.91 -5.10 116.66 109.94 2jd4 n ARG 2860Ca 0.06 -4.55 -0.34 0.00 -0.77 0.00 0.00 57.85 52.25 2jd4 n ARG 2860Cb 0.36 -2.13 0.01 0.00 -1.02 0.00 0.00 32.46 29.69 2jd4 n ARG 2860CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 2jd4 s PRO 2861N -3.23 3.24 0.19 5.56 0.04 -1.26 -4.78 135.00 134.77 2jd4 s PRO 2861Ca 0.47 1.40 -0.04 0.00 0.04 0.00 0.00 61.00 62.87 2jd4 s PRO 2861Cb 0.29 -2.01 0.11 0.00 0.04 0.00 0.00 34.50 32.93 2jd4 s PRO 2861CO -0.12 -0.90 1.52 -0.07 0.04 0.00 0.00 177.00 177.47 2jd4 h LEU 2862N 0.71 0.69 -7.82 -3.56 3.38 -0.84 -3.47 115.31 104.39 2jd4 h LEU 2862Ca -0.48 -0.34 0.13 0.00 0.09 0.00 0.00 57.88 57.28 2jd4 h LEU 2862Cb 1.24 -0.20 -0.07 0.00 0.09 0.00 0.00 40.66 41.73 2jd4 h LEU 2862CO 0.56 1.06 0.37 -0.94 0.09 0.00 0.00 178.44 179.58 2jd4 s SER 2863N -6.89 -0.21 0.05 -0.43 1.04 -1.23 -5.02 113.70 101.00 2jd4 s SER 2863Ca -0.08 -0.50 -0.28 0.00 0.48 0.00 0.00 55.95 55.57 2jd4 s SER 2863Cb 0.11 0.60 0.09 0.00 0.10 0.00 0.00 66.02 66.93 2jd4 s SER 2863CO 0.84 -1.11 1.00 0.00 0.98 0.00 0.00 173.24 174.95 2jd4 s ALA 2864N -3.57 -1.83 -0.21 5.32 0.00 -1.26 -1.48 121.76 118.72 2jd4 s ALA 2864Ca 0.12 0.63 -0.15 0.00 0.00 0.00 0.00 51.96 52.56 2jd4 s ALA 2864Cb -0.04 0.46 0.06 0.00 0.00 0.00 0.00 23.12 23.61 2jd4 s ALA 2864CO 0.05 -0.88 0.54 0.45 0.00 0.00 0.00 175.76 175.91 2jd4 s SER 2865N -2.72 -0.65 -1.49 0.00 0.15 -0.94 -4.99 113.70 103.05 2jd4 s SER 2865Ca 0.10 1.14 -0.04 0.00 0.70 0.00 0.00 55.95 57.85 2jd4 s SER 2865Cb -0.00 1.08 0.03 0.00 -1.71 0.00 0.00 66.02 65.41 2jd4 s SER 2865CO -0.03 -0.20 0.41 0.00 1.20 0.00 0.00 173.24 174.61 2jd4 n ALA 2866N 3.66 -1.87 -2.84 5.45 0.00 -1.26 -1.75 120.51 121.90 2jd4 n ALA 2866Ca -0.18 -0.25 -0.28 0.00 0.00 0.00 0.00 53.44 52.73 2jd4 n ALA 2866Cb 0.57 -1.72 -0.05 0.00 0.00 0.00 0.00 19.45 18.25 2jd4 n ALA 2866CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2jd4 s VAL 2867N -3.91 4.77 0.11 0.00 1.01 -1.26 -4.56 120.40 116.56 2jd4 s VAL 2867Ca 0.14 -0.85 0.02 0.00 0.00 0.00 0.00 61.98 61.30 2jd4 s VAL 2867Cb -0.08 -3.40 -0.01 0.00 0.00 0.00 0.00 36.38 32.90 2jd4 s VAL 2867CO 0.92 -0.02 0.11 -0.67 0.00 0.00 0.00 175.10 175.43 2jd4 n ASP 2868N -0.13 -0.28 -4.94 3.32 4.64 -1.10 -5.00 116.55 113.07 2jd4 n ASP 2868Ca -0.08 -1.70 -0.24 0.00 -1.38 0.00 0.00 54.79 51.40 2jd4 n ASP 2868Cb 0.53 0.61 -0.01 0.00 -1.04 0.00 0.00 41.12 41.21 2jd4 n ASP 2868CO 0.00 0.00 0.00 -0.13 -0.82 0.00 0.00 177.20 176.25 2jd4 s ARG 2869N -2.40 3.48 -0.08 -0.67 0.52 -1.26 -0.75 118.95 117.79 2jd4 s ARG 2869Ca 0.12 -0.30 -0.04 0.00 -0.52 0.00 0.00 55.73 54.99 2jd4 s ARG 2869Cb 0.00 -2.64 -0.04 0.00 0.52 0.00 0.00 34.95 32.80 2jd4 s ARG 2869CO 0.09 0.12 0.12 0.00 0.02 0.00 0.00 175.30 175.64 2jd4 s TYR 2871N -1.08 3.30 0.31 0.00 1.51 -1.26 -1.12 117.35 119.00 2jd4 s TYR 2871Ca 0.18 1.64 0.02 0.00 -1.01 0.00 0.00 57.07 57.90 2jd4 s TYR 2871Cb -0.12 -3.21 0.58 0.00 -0.11 0.00 0.00 41.96 39.10 2jd4 s TYR 2871CO 0.08 -0.73 1.90 0.28 -1.11 0.00 0.00 175.55 175.97 2jd4 h VAL 2872N 2.40 1.02 -3.34 0.71 2.07 -1.50 -3.40 116.25 114.21 2jd4 h VAL 2872Ca -0.48 -0.33 -0.48 0.00 0.82 0.00 0.00 66.70 66.23 2jd4 h VAL 2872Cb 1.22 -0.04 -0.35 0.00 -1.52 0.00 0.00 31.29 30.59 2jd4 h VAL 2872CO 0.63 0.18 -0.79 -0.69 0.02 0.00 0.00 177.57 176.92 2jd4 s VAL 2873N -5.88 0.84 0.21 2.57 1.01 -1.26 -4.99 120.40 112.90 2jd4 s VAL 2873Ca -0.11 -0.25 0.04 0.00 0.00 0.00 0.00 61.98 61.66 2jd4 s VAL 2873Cb 0.20 -0.84 -0.05 0.00 0.00 0.00 0.00 36.38 35.69 2jd4 s VAL 2873CO 0.80 0.31 -0.04 0.00 0.00 0.00 0.00 175.10 176.17 2jd4 s ALA 2874N 1.19 1.74 0.08 5.51 0.00 -1.26 -1.04 121.76 127.98 2jd4 s ALA 2874Ca -0.06 -1.69 0.01 0.00 0.00 0.00 0.00 51.96 50.22 2jd4 s ALA 2874Cb -0.14 0.33 -0.04 0.00 0.00 0.00 0.00 23.12 23.27 2jd4 s ALA 2874CO -0.02 -0.19 -0.06 1.14 0.00 0.00 0.00 175.76 176.64 2jd4 s GLN 2875N -3.82 0.74 0.17 0.00 -2.07 -0.60 -4.72 119.66 109.36 2jd4 s GLN 2875Ca 0.25 -1.23 -0.32 0.00 -1.82 0.00 0.00 55.36 52.24 2jd4 s GLN 2875Cb 0.04 -0.12 -0.11 0.00 -1.09 0.00 0.00 33.01 31.73 2jd4 s GLN 2875CO 0.06 -0.03 1.78 -1.91 -1.32 0.00 0.00 175.29 173.87 2jd4 n GLU 2876N 0.19 2.78 0.00 9.60 2.13 -1.26 -4.00 120.64 130.08 2jd4 n GLU 2876Ca -0.14 1.01 0.00 0.00 0.66 0.00 0.00 57.16 58.69 2jd4 n GLU 2876Cb 0.60 -2.88 0.00 0.00 0.27 0.00 0.00 31.44 29.43 2jd4 n GLU 2876CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2jd4 n GLY 2877N 4.09 1.43 3.28 8.31 0.00 -1.26 -4.85 105.19 116.19 2jd4 n GLY 2877Ca 0.17 -1.64 -0.33 0.00 0.00 0.00 0.00 46.02 44.22 2jd4 n GLY 2877CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jd4 s THR 2878N -1.64 2.78 0.07 2.61 2.01 -0.64 -1.70 115.64 119.14 2jd4 s THR 2878Ca 0.00 -0.73 -0.26 0.00 0.31 0.00 0.00 61.69 61.01 2jd4 s THR 2878Cb 0.00 -2.18 -0.06 0.00 0.01 0.00 0.00 72.50 70.27 2jd4 s THR 2878CO 0.00 0.51 0.79 0.12 -0.69 0.00 0.00 174.62 175.35 2jd4 s PHE 2879N 0.83 3.77 -0.23 4.92 5.36 -0.64 -2.15 117.98 129.84 2jd4 s PHE 2879Ca -0.04 1.53 0.02 0.00 -0.96 0.00 0.00 56.93 57.48 2jd4 s PHE 2879Cb -0.15 -2.84 0.05 0.00 -0.34 0.00 0.00 43.02 39.74 2jd4 s PHE 2879CO -0.00 0.30 -0.12 -0.06 -1.46 0.00 0.00 175.22 173.88 2jd4 s PHE 2880N -0.21 2.99 -0.71 10.12 0.40 0.25 -0.90 117.98 129.92 2jd4 s PHE 2880Ca 0.39 -2.05 0.23 0.00 -0.60 0.00 0.00 56.93 54.90 2jd4 s PHE 2880Cb -0.21 -1.86 0.89 0.00 0.51 0.00 0.00 43.02 42.35 2jd4 s PHE 2880CO 0.24 -0.84 1.70 -0.85 0.70 0.00 0.00 175.22 176.17 2jd4 n GLU 2881N 4.52 0.14 0.00 0.44 0.28 -0.96 -1.48 120.64 123.59 2jd4 n GLU 2881Ca -0.15 0.29 0.00 0.00 -0.16 0.00 0.00 57.16 57.14 2jd4 n GLU 2881Cb 0.44 -1.73 0.00 0.00 1.43 0.00 0.00 31.44 31.58 2jd4 n GLU 2881CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2jd4 n GLY 2882N 0.46 0.99 0.00 -1.84 0.00 -1.04 -4.84 105.19 98.92 2jd4 n GLY 2882Ca 0.04 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.10 2jd4 n GLY 2882CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2jd4 n SER 2883N 0.00 2.91 0.00 1.61 3.41 -1.26 -4.54 113.62 115.75 2jd4 n SER 2883Ca 0.00 -0.04 0.00 0.00 -0.26 0.00 0.00 58.87 58.57 2jd4 n SER 2883Cb 0.00 1.37 0.00 0.00 -0.26 0.00 0.00 64.21 65.32 2jd4 n SER 2883CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2jd4 n GLY 2884N 1.97 4.82 3.86 5.00 0.00 -1.24 -4.92 105.19 114.69 2jd4 n GLY 2884Ca -0.01 -0.66 0.00 0.00 0.00 0.00 0.00 46.02 45.35 2jd4 n GLY 2884CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2jd4 s TYR 2885N 3.71 0.01 -0.04 1.61 -0.85 0.00 -4.14 117.35 117.65 2jd4 s TYR 2885Ca 0.00 -0.22 0.01 0.00 -0.52 0.00 0.00 57.07 56.34 2jd4 s TYR 2885Cb 0.00 0.60 0.02 0.00 0.38 0.00 0.00 41.96 42.96 2jd4 s TYR 2885CO 0.00 -0.50 -0.06 0.00 -1.52 0.00 0.00 175.55 173.47 2jd4 s ALA 2886N -2.23 0.75 -0.14 9.51 0.00 -0.45 -1.01 121.76 128.19 2jd4 s ALA 2886Ca 0.23 -0.13 -0.00 0.00 0.00 0.00 0.00 51.96 52.05 2jd4 s ALA 2886Cb -0.00 -0.41 -0.01 0.00 0.00 0.00 0.00 23.12 22.70 2jd4 s ALA 2886CO 0.01 0.04 -0.13 0.00 0.00 0.00 0.00 175.76 175.67 2jd4 s ALA 2887N 0.74 2.58 0.21 0.00 0.00 -0.02 0.20 121.76 125.47 2jd4 s ALA 2887Ca -0.11 -0.95 0.10 0.00 0.00 0.00 0.00 51.96 51.00 2jd4 s ALA 2887Cb -0.13 -1.23 -0.05 0.00 0.00 0.00 0.00 23.12 21.70 2jd4 s ALA 2887CO 0.01 0.13 -0.20 -0.51 0.00 0.00 0.00 175.76 175.19 2jd4 s LEU 2888N 0.55 2.49 -0.62 0.00 1.02 -0.01 -1.51 118.68 120.61 2jd4 s LEU 2888Ca -0.09 -0.93 -0.01 0.00 0.02 0.00 0.00 54.13 53.12 2jd4 s LEU 2888Cb -0.16 -0.99 0.00 0.00 0.02 0.00 0.00 46.19 45.06 2jd4 s LEU 2888CO 0.04 0.02 0.60 0.52 0.02 0.00 0.00 176.35 177.55 2jd4 n VAL 2889N -0.06 -9.12 0.23 -1.59 0.31 -1.26 -0.28 118.33 106.57 2jd4 n VAL 2889Ca -0.10 -0.11 0.06 0.00 -0.01 0.00 0.00 64.34 64.18 2jd4 n VAL 2889Cb 0.58 -6.54 0.55 0.00 -0.91 0.00 0.00 33.84 27.52 2jd4 n VAL 2889CO 0.00 0.00 0.00 0.50 -1.32 0.00 0.00 176.83 176.01 2jd4 h LYS 2890N 0.53 0.00 0.00 5.55 3.64 -1.94 -1.83 116.57 122.53 2jd4 h LYS 2890Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2jd4 h LYS 2890Cb 0.99 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.81 2jd4 h LYS 2890CO 0.25 0.14 0.00 -0.85 -2.27 0.00 0.00 179.45 176.72 2jd4 n GLU 2891N -4.33 0.15 0.00 1.90 0.00 -1.26 -4.75 120.64 112.35 2jd4 n GLU 2891Ca -0.03 0.31 0.00 0.00 0.00 0.00 0.00 57.16 57.45 2jd4 n GLU 2891Cb 0.21 -1.75 0.00 0.00 0.00 0.00 0.00 31.44 29.89 2jd4 n GLU 2891CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2jd4 n GLY 2892N 0.37 2.49 3.36 -1.84 0.00 -0.69 -4.86 105.19 104.02 2jd4 n GLY 2892Ca 0.03 -1.58 -0.32 0.00 0.00 0.00 0.00 46.02 44.16 2jd4 n GLY 2892CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2jd4 s TYR 2893N -1.11 2.52 -0.34 1.61 5.04 0.40 -4.72 117.35 120.76 2jd4 s TYR 2893Ca 0.00 -0.44 -0.06 0.00 -2.44 0.00 0.00 57.07 54.13 2jd4 s TYR 2893Cb 0.00 -1.60 0.04 0.00 0.35 0.00 0.00 41.96 40.76 2jd4 s TYR 2893CO 0.00 -0.03 0.10 0.15 -1.34 0.00 0.00 175.55 174.43 2jd4 s LYS 2894N -0.45 2.58 0.05 4.97 1.02 -1.26 -2.49 119.74 124.17 2jd4 s LYS 2894Ca 0.05 -1.22 -0.22 0.00 0.02 0.00 0.00 55.97 54.60 2jd4 s LYS 2894Cb -0.12 -3.45 -0.14 0.00 -0.52 0.00 0.00 37.83 33.60 2jd4 s LYS 2894CO 0.01 -0.68 1.49 0.28 -0.92 0.00 0.00 175.35 175.53 2jd4 h VAL 2895N 6.21 1.24 0.00 3.17 2.07 -1.74 -3.48 116.25 123.72 2jd4 h VAL 2895Ca -0.23 -0.75 0.00 0.00 0.82 0.00 0.00 66.70 66.55 2jd4 h VAL 2895Cb 1.08 1.55 0.00 0.00 -1.52 0.00 0.00 31.29 32.40 2jd4 h VAL 2895CO 0.60 0.21 0.00 0.54 0.02 0.00 0.00 177.57 178.95 2jd4 n ARG 2896N -4.84 0.00 -0.02 1.57 5.12 -0.25 -4.06 116.66 114.18 2jd4 n ARG 2896Ca -0.06 0.00 -0.19 0.00 -1.93 0.00 0.00 57.85 55.67 2jd4 n ARG 2896Cb 0.19 0.00 -0.13 0.00 -1.16 0.00 0.00 32.46 31.35 2jd4 n ARG 2896CO 0.00 0.00 0.00 -0.07 -1.93 0.00 0.00 177.63 175.63 2jd4 h LEU 2897N 0.00 0.25 -8.39 0.55 4.07 -1.88 -0.80 115.31 109.11 2jd4 h LEU 2897Ca 0.00 -0.87 -0.61 0.00 0.08 0.00 0.00 57.88 56.48 2jd4 h LEU 2897Cb 0.00 -0.08 -0.30 0.00 1.08 0.00 0.00 40.66 41.35 2jd4 h LEU 2897CO 0.00 1.37 -0.86 -0.62 -1.08 0.00 0.00 178.44 177.26 2jd4 s ASP 2898N -6.78 2.49 -0.28 -0.43 -1.08 -1.26 -3.79 116.67 105.55 2jd4 s ASP 2898Ca -0.19 -0.40 -0.16 0.00 -0.52 0.00 0.00 52.55 51.28 2jd4 s ASP 2898Cb 0.02 -0.48 0.10 0.00 -1.46 0.00 0.00 42.92 41.10 2jd4 s ASP 2898CO 0.74 0.22 0.79 -0.22 0.52 0.00 0.00 175.17 177.23 2jd4 s LEU 2899N -0.27 -0.79 -0.18 -1.34 2.96 -0.26 -5.01 118.68 113.80 2jd4 s LEU 2899Ca 0.02 1.26 -0.02 0.00 -0.22 0.00 0.00 54.13 55.17 2jd4 s LEU 2899Cb -0.10 2.15 -0.01 0.00 0.50 0.00 0.00 46.19 48.73 2jd4 s LEU 2899CO 0.01 -0.20 -0.09 -1.58 -1.32 0.00 0.00 176.35 173.17 2jd4 s GLN 2900N 1.52 3.37 -0.15 1.98 0.74 -1.25 -0.87 119.66 125.00 2jd4 s GLN 2900Ca -0.10 -0.66 -0.01 0.00 0.05 0.00 0.00 55.36 54.65 2jd4 s GLN 2900Cb -0.04 -2.82 -0.01 0.00 1.10 0.00 0.00 33.01 31.23 2jd4 s GLN 2900CO -0.18 -0.01 -0.10 0.42 -0.55 0.00 0.00 175.29 174.87 2jd4 s ILE 2901N 0.95 3.21 0.02 -2.34 1.01 0.01 0.84 121.20 124.90 2jd4 s ILE 2901Ca -0.01 -0.59 0.04 0.00 0.00 0.00 0.00 60.65 60.08 2jd4 s ILE 2901Cb -0.15 -2.38 -0.02 0.00 0.01 0.00 0.00 42.46 39.93 2jd4 s ILE 2901CO -0.00 0.50 -0.12 -0.89 0.00 0.00 0.00 174.94 174.43 2jd4 s THR 2902N 0.62 0.90 0.07 2.92 2.01 -0.63 -0.64 115.64 120.88 2jd4 s THR 2902Ca -0.06 -0.78 -0.27 0.00 0.31 0.00 0.00 61.69 60.89 2jd4 s THR 2902Cb -0.15 -0.81 0.09 0.00 0.01 0.00 0.00 72.50 71.63 2jd4 s THR 2902CO 0.03 0.04 1.02 -1.48 -0.69 0.00 0.00 174.62 173.54 2jd4 s LEU 2903N -0.84 -0.19 0.01 4.42 0.05 -0.69 -1.11 118.68 120.33 2jd4 s LEU 2903Ca 0.01 -0.25 0.07 0.00 0.05 0.00 0.00 54.13 54.01 2jd4 s LEU 2903Cb -0.06 1.94 -0.02 0.00 -2.05 0.00 0.00 46.19 45.99 2jd4 s LEU 2903CO 0.01 -0.69 -0.20 -1.61 -0.55 0.00 0.00 176.35 173.30 2jd4 s GLU 2904N -3.04 1.52 0.04 1.48 2.02 -0.54 -0.72 118.70 119.46 2jd4 s GLU 2904Ca 0.11 -0.80 -0.04 0.00 0.02 0.00 0.00 54.97 54.26 2jd4 s GLU 2904Cb -0.00 -1.53 -0.02 0.00 0.10 0.00 0.00 34.13 32.68 2jd4 s GLU 2904CO -0.02 0.41 0.05 -0.59 0.02 0.00 0.00 175.26 175.13 2jd4 s PHE 2905N -0.60 0.30 -0.02 1.61 -0.12 -0.71 -1.19 117.98 117.26 2jd4 s PHE 2905Ca 0.07 -0.69 -0.01 0.00 -0.05 0.00 0.00 56.93 56.25 2jd4 s PHE 2905Cb -0.08 -0.22 0.01 0.00 -0.63 0.00 0.00 43.02 42.10 2jd4 s PHE 2905CO 0.00 -0.36 0.04 -0.98 -0.05 0.00 0.00 175.22 173.87 2jd4 s ARG 2906N -2.96 0.04 0.09 1.99 1.70 -0.57 -1.43 118.95 117.81 2jd4 s ARG 2906Ca -0.02 0.07 -0.25 0.00 -0.47 0.00 0.00 55.73 55.06 2jd4 s ARG 2906Cb 0.01 -0.01 0.08 0.00 -0.57 0.00 0.00 34.95 34.46 2jd4 s ARG 2906CO -0.06 -0.02 0.67 -0.08 -1.08 0.00 0.00 175.30 174.72 2jd4 s THR 2907N 0.15 0.00 -0.16 4.99 -1.32 -1.26 -1.58 115.64 116.46 2jd4 s THR 2907Ca -0.01 0.00 0.14 0.00 -1.21 0.00 0.00 61.69 60.61 2jd4 s THR 2907Cb -0.02 -1.00 0.36 0.00 -1.51 0.00 0.00 72.50 70.33 2jd4 s THR 2907CO -0.00 0.00 1.18 0.35 -2.21 0.00 0.00 174.62 173.94 2jd4 n THR 2908N -0.12 1.89 -4.29 5.08 -2.24 -1.26 -2.45 114.28 110.88 2jd4 n THR 2908Ca -0.16 -2.64 -0.23 0.00 -2.27 0.00 0.00 64.05 58.76 2jd4 n THR 2908Cb 0.63 -0.15 -0.13 0.00 -2.10 0.00 0.00 70.33 68.59 2jd4 n THR 2908CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2jd4 s SER 2909N -2.95 2.35 0.05 3.42 0.15 -1.26 -4.73 113.70 110.72 2jd4 s SER 2909Ca 0.34 -0.66 0.25 0.00 0.70 0.00 0.00 55.95 56.58 2jd4 s SER 2909Cb 0.32 -0.13 0.46 0.00 -1.71 0.00 0.00 66.02 64.97 2jd4 s SER 2909CO -0.03 0.04 1.39 0.29 1.20 0.00 0.00 173.24 176.12 2jd4 n LYS 2910N 1.20 0.12 -4.15 5.44 5.02 -1.26 -4.71 118.16 119.82 2jd4 n LYS 2910Ca -0.20 0.03 -0.18 0.00 -2.02 0.00 0.00 58.31 55.95 2jd4 n LYS 2910Cb 0.54 -1.57 -0.16 0.00 -0.02 0.00 0.00 35.03 33.82 2jd4 n LYS 2910CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 2jd4 s ASN 2911N -3.50 0.76 0.00 4.39 -0.87 -1.26 -1.94 114.94 112.51 2jd4 s ASN 2911Ca 0.09 -0.11 0.00 0.00 -1.57 0.00 0.00 52.86 51.27 2jd4 s ASN 2911Cb 0.16 -0.26 0.00 0.00 -0.02 0.00 0.00 41.25 41.13 2jd4 s ASN 2911CO 0.70 -0.01 0.00 0.61 -2.57 0.00 0.00 177.10 175.84 2jd4 n GLY 2912N 3.58 1.10 3.75 0.66 0.00 0.19 -4.72 105.19 109.74 2jd4 n GLY 2912Ca -0.21 0.28 -0.41 0.00 0.00 0.00 0.00 46.02 45.69 2jd4 n GLY 2912CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jd4 s VAL 2913N -0.26 3.71 -0.20 1.61 1.01 -0.13 -0.73 120.40 125.41 2jd4 s VAL 2913Ca 0.00 1.57 -0.12 0.00 0.00 0.00 0.00 61.98 63.43 2jd4 s VAL 2913Cb 0.00 -4.00 -0.09 0.00 0.00 0.00 0.00 36.38 32.29 2jd4 s VAL 2913CO 0.00 0.31 -0.28 0.18 0.00 0.00 0.00 175.10 175.31 2jd4 n LEU 2914N 1.91 1.58 -3.64 3.92 4.77 -0.52 -3.66 117.00 121.36 2jd4 n LEU 2914Ca 0.01 0.27 -0.15 0.00 -0.03 0.00 0.00 56.01 56.11 2jd4 n LEU 2914Cb 0.46 -0.65 -0.08 0.00 -2.33 0.00 0.00 43.42 40.82 2jd4 n LEU 2914CO 0.54 0.31 0.26 -0.22 -1.33 0.00 0.00 177.39 176.95 2jd4 s LEU 2915N -7.28 -0.05 -0.18 2.23 0.20 -0.57 -0.61 118.68 112.42 2jd4 s LEU 2915Ca -0.29 0.67 -0.15 0.00 0.69 0.00 0.00 54.13 55.05 2jd4 s LEU 2915Cb 0.10 1.97 0.05 0.00 -0.43 0.00 0.00 46.19 47.88 2jd4 s LEU 2915CO 0.38 -0.43 0.47 -0.83 -0.29 0.00 0.00 176.35 175.65 2jd4 s GLY 2916N -0.74 -0.37 -0.16 7.98 0.00 -0.47 -0.17 107.32 113.38 2jd4 s GLY 2916Ca -0.08 1.45 -0.02 0.00 0.00 0.00 0.00 44.72 46.07 2jd4 s GLY 2916CO 0.05 1.36 0.02 -0.42 0.00 0.00 0.00 173.10 174.12 2jd4 s ILE 2917N 0.62 0.53 0.01 0.90 1.01 -0.87 -1.14 121.20 122.26 2jd4 s ILE 2917Ca -0.03 -0.39 0.00 0.00 0.00 0.00 0.00 60.65 60.24 2jd4 s ILE 2917Cb -0.05 -0.92 -0.01 0.00 0.01 0.00 0.00 42.46 41.49 2jd4 s ILE 2917CO -0.04 -0.06 -0.02 -0.55 0.00 0.00 0.00 174.94 174.26 2jd4 s SER 2918N 1.87 0.22 0.67 3.58 0.15 -1.26 -1.69 113.70 117.25 2jd4 s SER 2918Ca 0.01 -0.30 -0.07 0.00 0.70 0.00 0.00 55.95 56.28 2jd4 s SER 2918Cb -0.16 0.05 0.04 0.00 -1.71 0.00 0.00 66.02 64.24 2jd4 s SER 2918CO -0.07 -0.16 1.00 -0.94 1.20 0.00 0.00 173.24 174.26 2jd4 s SER 2919N -0.87 5.11 0.00 5.45 1.04 -0.85 -4.66 113.70 118.92 2jd4 s SER 2919Ca -0.09 0.63 0.26 0.00 0.48 0.00 0.00 55.95 57.23 2jd4 s SER 2919Cb -0.06 -1.40 1.54 0.00 0.10 0.00 0.00 66.02 66.20 2jd4 s SER 2919CO -0.00 -1.42 1.93 0.00 0.98 0.00 0.00 173.24 174.73 2jd4 n ALA 2920N -2.85 2.53 -2.00 5.32 0.00 -1.26 -4.60 120.51 117.65 2jd4 n ALA 2920Ca 0.07 -0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.35 2jd4 n ALA 2920Cb 0.59 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.62 2jd4 n ALA 2920CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2jd4 n LYS 2921N -0.96 0.00 -0.02 0.00 5.02 -1.26 -5.06 118.16 115.88 2jd4 n LYS 2921Ca 0.19 0.00 -0.06 0.00 -2.02 0.00 0.00 58.31 56.42 2jd4 n LYS 2921Cb 0.09 0.00 -0.02 0.00 -0.02 0.00 0.00 35.03 35.08 2jd4 n LYS 2921CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2jd4 n VAL 2922N 0.00 0.65 -1.66 -0.18 0.31 -1.26 -4.89 118.33 111.29 2jd4 n VAL 2922Ca 0.00 0.02 -0.51 0.00 -0.01 0.00 0.00 64.34 63.84 2jd4 n VAL 2922Cb 0.00 -1.65 -0.06 0.00 -0.91 0.00 0.00 33.84 31.22 2jd4 n VAL 2922CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 2jd4 n ASP 2923N -3.44 2.61 -3.60 4.52 9.92 -1.26 -4.82 116.55 120.48 2jd4 n ASP 2923Ca -0.11 1.06 -0.03 0.00 -0.53 0.00 0.00 54.79 55.18 2jd4 n ASP 2923Cb 0.48 -1.28 -0.02 0.00 -0.64 0.00 0.00 41.12 39.66 2jd4 n ASP 2923CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2jd4 s ALA 2924N 2.20 -2.07 0.05 2.24 0.00 -0.94 -2.00 121.76 121.23 2jd4 s ALA 2924Ca 0.88 1.23 0.02 0.00 0.00 0.00 0.00 51.96 54.09 2jd4 s ALA 2924Cb -0.85 0.10 -0.03 0.00 0.00 0.00 0.00 23.12 22.34 2jd4 s ALA 2924CO 0.50 -0.75 -0.07 0.96 0.00 0.00 0.00 175.76 176.41 2jd4 s ILE 2925N -2.53 0.49 -0.01 0.00 -4.36 -0.68 -0.84 121.20 113.27 2jd4 s ILE 2925Ca 0.10 -1.20 -0.19 0.00 -0.26 0.00 0.00 60.65 59.10 2jd4 s ILE 2925Cb 0.01 -0.74 0.03 0.00 1.25 0.00 0.00 42.46 43.01 2jd4 s ILE 2925CO -0.04 -0.49 0.40 -0.83 0.24 0.00 0.00 174.94 174.22 2jd4 s GLY 2926N -1.82 -0.26 -0.07 6.27 0.00 -0.34 -2.04 107.32 109.07 2jd4 s GLY 2926Ca -0.07 0.53 0.00 0.00 0.00 0.00 0.00 44.72 45.18 2jd4 s GLY 2926CO -0.01 0.28 -0.04 -2.27 0.00 0.00 0.00 173.10 171.06 2jd4 s LEU 2927N -1.38 1.10 0.13 0.66 2.96 0.75 -0.98 118.68 121.92 2jd4 s LEU 2927Ca -0.12 -0.16 -0.16 0.00 -0.22 0.00 0.00 54.13 53.47 2jd4 s LEU 2927Cb -0.04 -0.54 0.03 0.00 0.50 0.00 0.00 46.19 46.14 2jd4 s LEU 2927CO 0.05 -0.10 0.39 -1.83 -1.32 0.00 0.00 176.35 173.54 2jd4 s GLU 2928N 1.35 1.07 -0.25 1.98 -1.05 -0.71 -1.43 118.70 119.66 2jd4 s GLU 2928Ca -0.04 -0.72 -0.05 0.00 -0.15 0.00 0.00 54.97 54.01 2jd4 s GLU 2928Cb -0.14 0.47 -0.00 0.00 -0.44 0.00 0.00 34.13 34.02 2jd4 s GLU 2928CO -0.03 -0.41 0.01 0.42 0.95 0.00 0.00 175.26 176.20 2jd4 s ILE 2929N -3.81 3.68 -0.15 1.83 1.01 0.09 -0.74 121.20 123.11 2jd4 s ILE 2929Ca 0.03 -0.54 -0.01 0.00 0.00 0.00 0.00 60.65 60.14 2jd4 s ILE 2929Cb 0.02 -2.77 0.04 0.00 0.01 0.00 0.00 42.46 39.76 2jd4 s ILE 2929CO -0.12 0.29 -0.04 -0.69 0.00 0.00 0.00 174.94 174.37 2jd4 s VAL 2930N 1.50 1.00 -1.40 2.92 1.01 -0.08 -0.64 120.40 124.71 2jd4 s VAL 2930Ca 0.04 -0.52 -0.09 0.00 0.00 0.00 0.00 61.98 61.42 2jd4 s VAL 2930Cb -0.15 -1.18 0.04 0.00 0.00 0.00 0.00 36.38 35.09 2jd4 s VAL 2930CO -0.00 0.15 1.03 0.47 0.00 0.00 0.00 175.10 176.74 2jd4 n ASP 2931N 4.92 -4.64 0.00 3.32 8.00 -0.85 -2.16 116.55 125.15 2jd4 n ASP 2931Ca -0.11 -0.67 0.00 0.00 0.71 0.00 0.00 54.79 54.71 2jd4 n ASP 2931Cb 0.48 -4.50 0.00 0.00 -0.02 0.00 0.00 41.12 37.08 2jd4 n ASP 2931CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2jd4 n GLY 2932N -1.74 1.41 3.63 0.44 0.00 -0.82 -5.03 105.19 103.08 2jd4 n GLY 2932Ca -0.05 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.70 2jd4 n GLY 2932CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jd4 s LYS 2933N -0.15 2.29 -0.18 1.61 1.02 -0.92 -4.62 119.74 118.80 2jd4 s LYS 2933Ca 0.00 -1.13 -0.07 0.00 0.02 0.00 0.00 55.97 54.78 2jd4 s LYS 2933Cb 0.00 -2.31 -0.04 0.00 -0.52 0.00 0.00 37.83 34.96 2jd4 s LYS 2933CO 0.00 0.46 0.06 0.08 -0.92 0.00 0.00 175.35 175.02 2jd4 s VAL 2934N -1.66 4.73 -0.05 3.17 1.01 -0.75 -0.91 120.40 125.94 2jd4 s VAL 2934Ca 0.26 -0.06 0.06 0.00 0.00 0.00 0.00 61.98 62.25 2jd4 s VAL 2934Cb -0.09 -3.13 -0.01 0.00 0.00 0.00 0.00 36.38 33.14 2jd4 s VAL 2934CO 0.17 0.46 -0.25 -0.76 0.00 0.00 0.00 175.10 174.72 2jd4 s LEU 2935N 0.42 2.10 -0.29 3.92 1.43 0.08 -1.03 118.68 125.31 2jd4 s LEU 2935Ca 0.03 -0.48 0.02 0.00 -1.03 0.00 0.00 54.13 52.67 2jd4 s LEU 2935Cb -0.13 -1.37 0.08 0.00 0.03 0.00 0.00 46.19 44.80 2jd4 s LEU 2935CO 0.01 0.27 -0.01 0.12 0.23 0.00 0.00 176.35 176.97 2jd4 s PHE 2936N -0.32 3.09 -0.01 0.29 5.36 -0.67 -1.73 117.98 123.98 2jd4 s PHE 2936Ca 0.01 -2.41 -0.02 0.00 -0.96 0.00 0.00 56.93 53.55 2jd4 s PHE 2936Cb -0.12 -2.24 -0.04 0.00 -0.34 0.00 0.00 43.02 40.28 2jd4 s PHE 2936CO 0.02 -0.88 0.16 -1.01 -1.46 0.00 0.00 175.22 172.04 2jd4 s HIS 2937N 1.15 3.49 -0.07 10.12 3.76 -0.15 -1.65 115.29 131.94 2jd4 s HIS 2937Ca 0.02 0.33 -0.06 0.00 -0.15 0.00 0.00 55.06 55.21 2jd4 s HIS 2937Cb -0.19 -1.81 0.02 0.00 1.11 0.00 0.00 32.58 31.70 2jd4 s HIS 2937CO -0.09 0.63 0.18 0.08 -0.85 0.00 0.00 174.74 174.69 2jd4 s VAL 2938N -1.28 -0.00 -0.14 -0.90 1.01 0.14 -1.20 120.40 118.03 2jd4 s VAL 2938Ca 0.26 0.01 -0.04 0.00 0.00 0.00 0.00 61.98 62.21 2jd4 s VAL 2938Cb -0.12 -0.25 0.05 0.00 0.00 0.00 0.00 36.38 36.05 2jd4 s VAL 2938CO 0.17 0.00 0.07 0.21 0.00 0.00 0.00 175.10 175.55 2jd4 s ASN 2939N 0.16 2.17 -0.14 3.32 3.84 -0.02 0.14 114.94 124.40 2jd4 s ASN 2939Ca -0.01 -0.48 0.13 0.00 0.21 0.00 0.00 52.86 52.71 2jd4 s ASN 2939Cb -0.02 -0.30 0.63 0.00 -0.55 0.00 0.00 41.25 41.01 2jd4 s ASN 2939CO -0.00 -0.31 1.50 0.59 -2.79 0.00 0.00 177.10 176.08 2jd4 n ASN 2940N 5.23 4.44 0.00 -4.21 3.02 -1.26 -2.22 115.26 120.26 2jd4 n ASN 2940Ca -0.07 -2.56 0.00 0.00 -0.03 0.00 0.00 54.58 51.92 2jd4 n ASN 2940Cb 0.49 -0.59 0.00 0.00 -0.61 0.00 0.00 39.78 39.07 2jd4 n ASN 2940CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2jd4 n GLY 2941N 0.75 0.64 0.00 7.41 0.00 -1.26 -4.64 105.19 108.10 2jd4 n GLY 2941Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.24 2jd4 n GLY 2941CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jd4 n ALA 2942N -1.86 1.86 0.00 4.61 0.00 -1.26 -5.03 120.51 118.82 2jd4 n ALA 2942Ca 0.00 -0.96 0.00 0.00 0.00 0.00 0.00 53.44 52.48 2jd4 n ALA 2942Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 19.45 19.44 2jd4 n ALA 2942CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jd4 n GLY 2943N -0.44 3.45 3.72 0.00 0.00 -1.26 -5.01 105.19 105.65 2jd4 n GLY 2943Ca 0.00 -1.85 -0.42 0.00 0.00 0.00 0.00 46.02 43.76 2jd4 n GLY 2943CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2jd4 s ARG 2944N -3.31 4.40 -0.14 1.61 3.52 -1.26 -4.34 118.95 119.43 2jd4 s ARG 2944Ca 0.00 1.93 -0.01 0.00 -0.13 0.00 0.00 55.73 57.52 2jd4 s ARG 2944Cb 0.00 -3.27 -0.02 0.00 -1.56 0.00 0.00 34.95 30.10 2jd4 s ARG 2944CO 0.00 -0.29 -0.11 0.42 -0.81 0.00 0.00 175.30 174.51 2jd4 s ILE 2945N 0.75 3.18 -0.07 4.11 1.01 0.12 -4.95 121.20 125.35 2jd4 s ILE 2945Ca 0.59 -0.61 0.02 0.00 0.00 0.00 0.00 60.65 60.65 2jd4 s ILE 2945Cb -0.33 -2.35 0.01 0.00 0.01 0.00 0.00 42.46 39.80 2jd4 s ILE 2945CO 0.32 0.51 -0.11 -0.89 0.00 0.00 0.00 174.94 174.77 2jd4 s THR 2946N 0.47 1.07 -0.22 2.92 2.01 -1.26 -0.68 115.64 119.95 2jd4 s THR 2946Ca -0.08 -0.43 -0.06 0.00 0.31 0.00 0.00 61.69 61.43 2jd4 s THR 2946Cb -0.15 -0.99 -0.03 0.00 0.01 0.00 0.00 72.50 71.34 2jd4 s THR 2946CO 0.04 0.34 0.04 0.00 -0.69 0.00 0.00 174.62 174.35 2jd4 s ALA 2947N 0.76 3.14 -0.12 7.40 0.00 -0.66 -4.90 121.76 127.38 2jd4 s ALA 2947Ca -0.13 -1.00 0.02 0.00 0.00 0.00 0.00 51.96 50.84 2jd4 s ALA 2947Cb -0.15 -1.91 -0.01 0.00 0.00 0.00 0.00 23.12 21.05 2jd4 s ALA 2947CO 0.03 -0.22 -0.18 0.99 0.00 0.00 0.00 175.76 176.37 2jd4 s THR 2948N 1.13 2.56 -0.25 0.00 2.01 -1.26 -1.66 115.64 118.16 2jd4 s THR 2948Ca 0.03 -0.84 -0.04 0.00 0.31 0.00 0.00 61.69 61.16 2jd4 s THR 2948Cb -0.14 -2.04 0.01 0.00 0.01 0.00 0.00 72.50 70.34 2jd4 s THR 2948CO 0.02 0.54 -0.02 -0.47 -0.69 0.00 0.00 174.62 174.01 2jd4 s TYR 2949N 0.41 3.06 -0.19 4.92 5.04 -0.20 -4.95 117.35 125.44 2jd4 s TYR 2949Ca -0.14 -1.23 0.01 0.00 -2.44 0.00 0.00 57.07 53.27 2jd4 s TYR 2949Cb -0.17 -2.12 0.02 0.00 0.35 0.00 0.00 41.96 40.04 2jd4 s TYR 2949CO 0.06 -0.64 -0.18 -1.14 -1.34 0.00 0.00 175.55 172.31 2jd4 s GLN 2950N 1.41 2.95 0.74 4.97 0.74 -1.26 -1.81 119.66 127.40 2jd4 s GLN 2950Ca 0.02 -0.86 -0.11 0.00 0.05 0.00 0.00 55.36 54.46 2jd4 s GLN 2950Cb -0.16 -2.64 0.03 0.00 1.10 0.00 0.00 33.01 31.35 2jd4 s GLN 2950CO -0.02 -0.24 1.07 -1.25 -0.55 0.00 0.00 175.29 174.30 2jd4 s PRO 2951N 1.29 2.59 0.23 1.67 0.04 -1.26 -4.96 135.00 134.60 2jd4 s PRO 2951Ca 0.04 0.96 -0.06 0.00 0.04 0.00 0.00 61.00 61.98 2jd4 s PRO 2951Cb -0.14 -1.95 0.38 0.00 0.04 0.00 0.00 34.50 32.83 2jd4 s PRO 2951CO -0.11 -1.35 1.77 0.00 0.04 0.00 0.00 177.00 177.35 2jd4 h ARG 2952N -0.90 0.58 -6.02 4.56 3.08 -2.00 -3.40 114.38 110.28 2jd4 h ARG 2952Ca -0.44 -0.03 -0.68 0.00 0.07 0.00 0.00 59.98 58.90 2jd4 h ARG 2952Cb 1.23 -0.13 -0.14 0.00 0.08 0.00 0.00 29.97 31.00 2jd4 h ARG 2952CO 0.56 0.38 -0.62 0.00 -1.07 0.00 0.00 179.97 179.21 2jd4 s ALA 2953N -6.04 3.30 0.27 0.04 0.00 -1.26 -5.02 121.76 113.04 2jd4 s ALA 2953Ca -0.12 -0.84 -0.04 0.00 0.00 0.00 0.00 51.96 50.96 2jd4 s ALA 2953Cb 0.19 -1.45 0.35 0.00 0.00 0.00 0.00 23.12 22.21 2jd4 s ALA 2953CO 0.77 0.61 1.89 0.00 0.00 0.00 0.00 175.76 179.02 2jd4 h ALA 2954N 4.93 1.27 -0.28 0.00 0.00 -1.95 -2.57 119.26 120.66 2jd4 h ALA 2954Ca -0.50 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.28 2jd4 h ALA 2954Cb 1.19 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.67 2jd4 h ALA 2954CO 0.55 0.59 0.00 2.89 0.00 0.00 0.00 179.25 183.28 2jd4 n ARG 2955N -4.34 1.95 -0.22 0.00 -4.01 -1.26 -4.48 116.66 104.30 2jd4 n ARG 2955Ca 0.08 -1.45 0.02 0.00 -1.04 0.00 0.00 57.85 55.46 2jd4 n ARG 2955Cb 0.11 -1.40 0.13 0.00 -3.04 0.00 0.00 32.46 28.26 2jd4 n ARG 2955CO 0.00 0.00 0.00 0.00 -3.04 0.00 0.00 177.63 174.59 2jd4 h ALA 2956N 4.07 0.81 0.00 2.89 0.00 -1.82 -2.41 119.26 122.79 2jd4 h ALA 2956Ca 0.00 0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2jd4 h ALA 2956Cb 0.61 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.55 2jd4 h ALA 2956CO 0.00 -0.28 0.00 -0.07 0.00 0.00 0.00 179.25 178.90 2jd4 h LEU 2957N 0.31 0.00 -3.98 0.00 3.38 -1.81 -3.26 115.31 109.94 2jd4 h LEU 2957Ca 0.34 0.00 -0.62 0.00 0.09 0.00 0.00 57.88 57.70 2jd4 h LEU 2957Cb 0.52 0.00 -0.30 0.00 0.09 0.00 0.00 40.66 40.97 2jd4 h LEU 2957CO -0.41 0.00 0.76 0.00 0.09 0.00 0.00 178.44 178.88 2jd4 n ASP 2959N -1.00 0.92 0.00 0.00 5.75 -1.22 -1.91 116.55 119.09 2jd4 n ASP 2959Ca 0.61 -1.37 0.00 0.00 -0.01 0.00 0.00 54.79 54.03 2jd4 n ASP 2959Cb 1.01 -0.01 0.00 0.00 -1.03 0.00 0.00 41.12 41.08 2jd4 n ASP 2959CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2jd4 n GLY 2960N 1.08 0.88 3.94 6.12 0.00 -1.03 -4.67 105.19 111.51 2jd4 n GLY 2960Ca 0.20 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.02 2jd4 n GLY 2960CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jd4 s LYS 2961N -0.00 3.00 0.26 1.61 1.02 -1.26 -4.74 119.74 119.63 2jd4 s LYS 2961Ca 0.00 -1.09 -0.29 0.00 0.02 0.00 0.00 55.97 54.61 2jd4 s LYS 2961Cb 0.00 -2.70 -0.09 0.00 -0.52 0.00 0.00 37.83 34.52 2jd4 s LYS 2961CO 0.00 0.11 0.96 -1.58 -0.92 0.00 0.00 175.35 173.92 2jd4 s TRP 2962N -2.20 3.90 0.01 3.18 0.52 -1.26 -4.40 118.94 118.69 2jd4 s TRP 2962Ca 0.42 1.88 0.05 0.00 0.02 0.00 0.00 56.10 58.47 2jd4 s TRP 2962Cb -0.08 -3.00 -0.02 0.00 -1.15 0.00 0.00 33.47 29.22 2jd4 s TRP 2962CO 0.29 0.32 -0.15 -1.01 0.02 0.00 0.00 176.95 176.42 2jd4 s HIS 2963N -1.26 1.30 0.15 -1.98 3.76 -0.52 -4.96 115.29 111.79 2jd4 s HIS 2963Ca 0.43 -0.30 -0.08 0.00 -0.15 0.00 0.00 55.06 54.97 2jd4 s HIS 2963Cb -0.25 -0.81 -0.06 0.00 1.11 0.00 0.00 32.58 32.57 2jd4 s HIS 2963CO 0.31 0.01 0.44 0.95 -0.85 0.00 0.00 174.74 175.60 2jd4 s THR 2964N -0.57 5.07 -0.02 1.30 -4.23 -1.26 -1.74 115.64 114.18 2jd4 s THR 2964Ca 0.04 0.30 -0.00 0.00 -1.18 0.00 0.00 61.69 60.85 2jd4 s THR 2964Cb -0.07 -3.63 0.03 0.00 1.34 0.00 0.00 72.50 70.17 2jd4 s THR 2964CO 0.00 0.08 0.03 -0.22 -0.54 0.00 0.00 174.62 173.97 2jd4 s LEU 2965N -2.48 1.16 -0.06 4.79 0.20 0.10 -1.79 118.68 120.61 2jd4 s LEU 2965Ca 0.41 0.05 0.02 0.00 0.69 0.00 0.00 54.13 55.30 2jd4 s LEU 2965Cb -0.12 -0.04 0.01 0.00 -0.43 0.00 0.00 46.19 45.61 2jd4 s LEU 2965CO 0.22 -0.12 -0.11 -1.10 -0.29 0.00 0.00 176.35 174.95 2jd4 s GLN 2966N 0.96 1.52 -0.18 1.98 -0.21 0.11 -1.71 119.66 122.12 2jd4 s GLN 2966Ca -0.08 -0.38 -0.03 0.00 0.02 0.00 0.00 55.36 54.89 2jd4 s GLN 2966Cb -0.11 -1.29 0.06 0.00 1.00 0.00 0.00 33.01 32.66 2jd4 s GLN 2966CO -0.03 0.04 0.04 0.00 -2.12 0.00 0.00 175.29 173.22 2jd4 s ALA 2967N 0.60 0.88 -0.16 6.09 0.00 0.18 0.81 121.76 130.16 2jd4 s ALA 2967Ca -0.12 -0.60 -0.03 0.00 0.00 0.00 0.00 51.96 51.21 2jd4 s ALA 2967Cb -0.15 -1.13 -0.02 0.00 0.00 0.00 0.00 23.12 21.82 2jd4 s ALA 2967CO 0.03 -1.15 -0.06 -1.58 0.00 0.00 0.00 175.76 173.00 2jd4 s HIS 2968N 1.92 2.95 -0.19 0.00 5.04 0.13 -0.81 115.29 124.33 2jd4 s HIS 2968Ca -0.00 -0.51 -0.03 0.00 -1.54 0.00 0.00 55.06 52.98 2jd4 s HIS 2968Cb -0.17 -1.96 -0.01 0.00 0.04 0.00 0.00 32.58 30.48 2jd4 s HIS 2968CO -0.08 -0.19 -0.07 0.21 -2.34 0.00 0.00 174.74 172.28 2jd4 s LYS 2969N 0.60 3.41 0.36 2.88 2.20 -0.05 -0.95 119.74 128.18 2jd4 s LYS 2969Ca -0.04 -0.63 0.03 0.00 -0.36 0.00 0.00 55.97 54.97 2jd4 s LYS 2969Cb -0.15 -2.90 -0.04 0.00 -1.51 0.00 0.00 37.83 33.24 2jd4 s LYS 2969CO 0.03 -0.04 0.12 -1.54 -0.36 0.00 0.00 175.35 173.55 2jd4 s SER 2970N 1.06 2.30 0.00 1.43 1.04 -0.01 -1.11 113.70 118.41 2jd4 s SER 2970Ca 0.01 -1.56 0.00 0.00 0.48 0.00 0.00 55.95 54.87 2jd4 s SER 2970Cb -0.15 0.33 0.00 0.00 0.10 0.00 0.00 66.02 66.30 2jd4 s SER 2970CO -0.01 -0.84 0.03 0.29 0.98 0.00 0.00 173.24 173.70 2jd4 n LYS 2971N -0.76 0.00 -1.95 4.02 5.02 -1.25 -2.15 118.16 121.10 2jd4 n LYS 2971Ca -0.03 0.03 -0.28 0.00 -2.02 0.00 0.00 58.31 56.01 2jd4 n LYS 2971Cb 0.65 -0.12 0.03 0.00 -0.02 0.00 0.00 35.03 35.57 2jd4 n LYS 2971CO 0.00 0.00 0.00 1.58 -0.52 0.00 0.00 177.40 178.46 2jd4 n HIS 2972N -0.22 3.01 -3.79 2.13 -0.00 -1.26 -4.67 115.22 110.41 2jd4 n HIS 2972Ca 0.00 -2.58 -0.13 0.00 -0.00 0.00 0.00 57.72 55.01 2jd4 n HIS 2972Cb 0.00 -0.61 -0.11 0.00 -0.00 0.00 0.00 29.99 29.27 2jd4 n HIS 2972CO 0.00 0.00 0.00 0.50 -0.00 0.00 0.00 176.34 176.84 2jd4 s ARG 2973N -3.68 0.37 -0.11 1.57 3.52 -0.91 -4.54 118.95 115.17 2jd4 s ARG 2973Ca 0.54 0.21 -0.01 0.00 -0.13 0.00 0.00 55.73 56.34 2jd4 s ARG 2973Cb 0.43 0.17 0.03 0.00 -1.56 0.00 0.00 34.95 34.03 2jd4 s ARG 2973CO -0.05 -0.06 -0.02 0.42 -0.81 0.00 0.00 175.30 174.77 2jd4 s ILE 2974N -0.21 0.67 -0.11 4.11 1.01 -0.83 -0.83 121.20 125.01 2jd4 s ILE 2974Ca -0.03 -0.16 0.02 0.00 0.00 0.00 0.00 60.65 60.47 2jd4 s ILE 2974Cb -0.03 -0.83 0.01 0.00 0.01 0.00 0.00 42.46 41.62 2jd4 s ILE 2974CO 0.01 0.22 -0.17 -0.69 0.00 0.00 0.00 174.94 174.32 2jd4 s VAL 2975N 1.84 1.61 -0.16 2.92 1.01 -0.12 -1.53 120.40 125.98 2jd4 s VAL 2975Ca 0.04 -0.72 -0.01 0.00 0.00 0.00 0.00 61.98 61.30 2jd4 s VAL 2975Cb -0.13 -1.45 -0.01 0.00 0.00 0.00 0.00 36.38 34.79 2jd4 s VAL 2975CO -0.07 0.46 -0.12 -0.22 0.00 0.00 0.00 175.10 175.15 2jd4 s LEU 2976N 0.87 2.65 -0.12 3.92 2.96 -0.04 0.19 118.68 129.12 2jd4 s LEU 2976Ca -0.08 -0.39 0.00 0.00 -0.22 0.00 0.00 54.13 53.43 2jd4 s LEU 2976Cb -0.15 -1.61 0.02 0.00 0.50 0.00 0.00 46.19 44.95 2jd4 s LEU 2976CO -0.00 0.10 -0.10 -0.89 -1.32 0.00 0.00 176.35 174.14 2jd4 s THR 2977N 0.73 1.18 -0.14 3.68 2.01 0.24 -0.49 115.64 122.85 2jd4 s THR 2977Ca -0.06 -0.40 0.02 0.00 0.31 0.00 0.00 61.69 61.56 2jd4 s THR 2977Cb -0.15 -1.16 0.02 0.00 0.01 0.00 0.00 72.50 71.21 2jd4 s THR 2977CO 0.02 0.39 -0.19 -0.69 -0.69 0.00 0.00 174.62 173.46 2jd4 s VAL 2978N 1.51 1.85 -1.42 3.82 1.01 0.25 0.09 120.40 127.52 2jd4 s VAL 2978Ca 0.02 -0.84 -0.11 0.00 0.00 0.00 0.00 61.98 61.06 2jd4 s VAL 2978Cb -0.13 -1.67 0.08 0.00 0.00 0.00 0.00 36.38 34.66 2jd4 s VAL 2978CO -0.07 0.51 0.66 0.47 0.00 0.00 0.00 175.10 176.66 2jd4 n ASP 2979N 4.34 -4.22 0.00 3.32 8.00 -0.74 -0.67 116.55 126.58 2jd4 n ASP 2979Ca -0.19 -0.54 0.00 0.00 0.71 0.00 0.00 54.79 54.77 2jd4 n ASP 2979Cb 0.51 -3.44 0.00 0.00 -0.02 0.00 0.00 41.12 38.17 2jd4 n ASP 2979CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2jd4 n GLY 2980N -1.36 2.00 3.63 0.44 0.00 -1.26 -5.02 105.19 103.61 2jd4 n GLY 2980Ca -0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 2jd4 n GLY 2980CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2jd4 s ASN 2981N -2.59 6.63 0.07 1.61 0.01 0.15 -5.05 114.94 115.76 2jd4 s ASN 2981Ca 0.00 0.76 0.01 0.00 -0.71 0.00 0.00 52.86 52.92 2jd4 s ASN 2981Cb 0.00 -2.36 -0.04 0.00 0.41 0.00 0.00 41.25 39.26 2jd4 s ASN 2981CO 0.00 -0.41 0.18 -0.44 -1.51 0.00 0.00 177.10 174.93 2jd4 s SER 2982N 1.46 6.18 -0.15 -1.22 0.01 -1.26 -0.58 113.70 118.14 2jd4 s SER 2982Ca 0.28 0.21 -0.07 0.00 1.31 0.00 0.00 55.95 57.67 2jd4 s SER 2982Cb -0.15 -1.86 0.06 0.00 0.21 0.00 0.00 66.02 64.28 2jd4 s SER 2982CO 0.08 0.17 0.35 -0.69 0.41 0.00 0.00 173.24 173.56 2jd4 s VAL 2983N -1.49 -0.21 0.30 3.43 1.01 0.35 -4.98 120.40 118.81 2jd4 s VAL 2983Ca 0.34 0.15 0.03 0.00 0.00 0.00 0.00 61.98 62.49 2jd4 s VAL 2983Cb -0.13 -0.54 -0.05 0.00 0.00 0.00 0.00 36.38 35.66 2jd4 s VAL 2983CO 0.27 0.06 0.09 0.00 0.00 0.00 0.00 175.10 175.52 2jd4 s ARG 2984N 1.76 1.56 -0.12 2.72 1.70 -1.26 -0.86 118.95 124.44 2jd4 s ARG 2984Ca -0.06 -1.87 -0.08 0.00 -0.47 0.00 0.00 55.73 53.25 2jd4 s ARG 2984Cb -0.10 -0.50 0.04 0.00 -0.57 0.00 0.00 34.95 33.82 2jd4 s ARG 2984CO -0.11 -0.28 0.31 0.00 -1.08 0.00 0.00 175.30 174.13 2jd4 s ALA 2985N -3.53 -0.75 -0.06 7.88 0.00 -0.58 -4.98 121.76 119.74 2jd4 s ALA 2985Ca 0.36 1.08 0.03 0.00 0.00 0.00 0.00 51.96 53.44 2jd4 s ALA 2985Cb 0.07 -0.66 0.01 0.00 0.00 0.00 0.00 23.12 22.54 2jd4 s ALA 2985CO 0.15 -0.20 -0.16 -1.21 0.00 0.00 0.00 175.76 174.34 2jd4 s GLU 2986N 0.91 1.92 -0.02 0.00 2.02 -1.26 -1.96 118.70 120.32 2jd4 s GLU 2986Ca -0.06 -0.55 0.16 0.00 0.02 0.00 0.00 54.97 54.53 2jd4 s GLU 2986Cb -0.07 -1.58 0.27 0.00 0.10 0.00 0.00 34.13 32.85 2jd4 s GLU 2986CO -0.06 0.13 1.11 -2.39 0.02 0.00 0.00 175.26 174.07 2jd4 n HIS 2991N 3.52 0.00 -1.63 1.61 -0.00 -1.26 -4.96 115.22 112.50 2jd4 n HIS 2991Ca -0.20 -0.41 -0.38 0.00 -0.00 0.00 0.00 57.72 56.73 2jd4 n HIS 2991Cb 0.52 -0.12 0.05 0.00 -0.00 0.00 0.00 29.99 30.44 2jd4 n HIS 2991CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.34 176.77 2jd4 n SER 2992N 0.15 0.99 0.00 4.39 7.64 -1.26 -4.94 113.62 120.59 2jd4 n SER 2992Ca 0.05 0.84 0.00 0.00 1.01 0.00 0.00 58.87 60.78 2jd4 n SER 2992Cb 0.94 -1.40 0.00 0.00 -1.01 0.00 0.00 64.21 62.74 2jd4 n SER 2992CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 2jd4 n THR 2993N -1.54 0.00 -3.60 0.44 -2.24 -1.26 -4.78 114.28 101.29 2jd4 n THR 2993Ca 0.13 -0.39 -0.36 0.00 -2.27 0.00 0.00 64.05 61.15 2jd4 n THR 2993Cb 0.46 0.96 -0.08 0.00 -2.10 0.00 0.00 70.33 69.57 2jd4 n THR 2993CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2jd4 s SER 2994N -0.91 6.26 -0.83 3.42 0.15 -1.26 -4.44 113.70 116.08 2jd4 s SER 2994Ca 0.00 0.29 -0.18 0.00 0.70 0.00 0.00 55.95 56.76 2jd4 s SER 2994Cb 0.00 -2.14 0.14 0.00 -1.71 0.00 0.00 66.02 62.31 2jd4 s SER 2994CO 0.00 0.07 0.96 0.00 1.20 0.00 0.00 173.24 175.47 2jd4 s ALA 2995N 0.83 3.52 -1.30 5.45 0.00 -0.31 -4.63 121.76 125.32 2jd4 s ALA 2995Ca 0.11 -2.74 -0.17 0.00 0.00 0.00 0.00 51.96 49.17 2jd4 s ALA 2995Cb -0.13 -3.82 0.01 0.00 0.00 0.00 0.00 23.12 19.17 2jd4 s ALA 2995CO 0.03 -2.70 2.05 -0.25 0.00 0.00 0.00 175.76 174.89 2jd4 n ASP 2996N 6.00 3.87 -4.96 0.00 8.00 -1.26 -1.09 116.55 127.11 2jd4 n ASP 2996Ca 0.14 -2.83 -0.22 0.00 0.71 0.00 0.00 54.79 52.59 2jd4 n ASP 2996Cb 0.47 -1.60 0.00 0.00 -0.02 0.00 0.00 41.12 39.97 2jd4 n ASP 2996CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2jd4 s THR 2997N 4.20 4.24 -0.39 -3.53 -4.23 -1.26 -4.82 115.64 109.85 2jd4 s THR 2997Ca 0.52 -0.57 0.06 0.00 -1.18 0.00 0.00 61.69 60.51 2jd4 s THR 2997Cb 0.11 -3.55 0.30 0.00 1.34 0.00 0.00 72.50 70.70 2jd4 s THR 2997CO -0.00 -0.35 1.24 -3.20 -0.54 0.00 0.00 174.62 171.77 2jd4 n ASN 2998N -1.95 -1.78 -4.13 3.99 4.05 -1.04 -4.02 115.26 110.39 2jd4 n ASN 2998Ca -0.00 -2.53 -0.13 0.00 0.45 0.00 0.00 54.58 52.37 2jd4 n ASN 2998Cb 0.57 1.27 -0.10 0.00 1.23 0.00 0.00 39.78 42.75 2jd4 n ASN 2998CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 177.26 172.40 2jd4 s ASP 2999N -0.88 0.32 0.87 1.20 1.01 -1.10 -4.53 116.67 113.56 2jd4 s ASP 2999Ca 0.18 -1.42 -0.11 0.00 0.71 0.00 0.00 52.55 51.91 2jd4 s ASP 2999Cb 0.29 0.39 0.12 0.00 1.01 0.00 0.00 42.92 44.73 2jd4 s ASP 2999CO -0.08 -0.86 1.11 -2.84 0.21 0.00 0.00 175.17 172.71 2jd4 s PRO 3000N -4.09 1.42 -0.32 8.23 0.02 -1.25 -0.45 135.00 138.55 2jd4 s PRO 3000Ca 0.39 1.22 -0.12 0.00 0.02 0.00 0.00 61.00 62.51 2jd4 s PRO 3000Cb 0.07 -1.80 -0.02 0.00 0.02 0.00 0.00 34.50 32.77 2jd4 s PRO 3000CO 0.13 -2.25 0.21 0.42 -0.33 0.00 0.00 177.00 175.19 2jd4 s ILE 3001N -2.79 5.16 -0.22 2.83 1.01 0.62 -4.47 121.20 123.34 2jd4 s ILE 3001Ca 0.64 -0.16 -0.15 0.00 0.00 0.00 0.00 60.65 60.98 2jd4 s ILE 3001Cb -0.20 -3.60 -0.04 0.00 0.01 0.00 0.00 42.46 38.63 2jd4 s ILE 3001CO 0.57 0.07 0.37 -0.31 0.00 0.00 0.00 174.94 175.64 2jd4 s TYR 3002N 1.71 3.34 -0.14 3.97 1.51 -0.30 -0.83 117.35 126.61 2jd4 s TYR 3002Ca 0.06 0.53 -0.01 0.00 -1.01 0.00 0.00 57.07 56.64 2jd4 s TYR 3002Cb -0.17 -2.51 -0.01 0.00 -0.11 0.00 0.00 41.96 39.16 2jd4 s TYR 3002CO 0.10 -0.05 -0.12 0.08 -1.11 0.00 0.00 175.55 174.45 2jd4 s VAL 3003N 1.46 3.11 0.00 0.71 1.01 0.13 -1.37 120.40 125.46 2jd4 s VAL 3003Ca 0.17 -0.63 0.00 0.00 0.00 0.00 0.00 61.98 61.52 2jd4 s VAL 3003Cb -0.15 -2.32 0.00 0.00 0.00 0.00 0.00 36.38 33.91 2jd4 s VAL 3003CO 0.08 0.51 0.00 0.61 0.00 0.00 0.00 175.10 176.30 2jd4 n GLY 3004N 3.67 0.84 0.00 4.51 0.00 0.22 -1.34 105.19 113.08 2jd4 n GLY 3004Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.84 2jd4 n GLY 3004CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jd4 n GLY 3005N -2.14 -0.08 3.62 -0.02 0.00 -1.25 -0.80 105.19 104.51 2jd4 n GLY 3005Ca 0.00 -1.55 -0.07 0.00 0.00 0.00 0.00 46.02 44.40 2jd4 n GLY 3005CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2jd4 s TYR 3006N -2.63 -0.26 0.62 1.61 -0.85 -1.26 -4.72 117.35 109.87 2jd4 s TYR 3006Ca 0.00 0.52 -0.16 0.00 -0.52 0.00 0.00 57.07 56.91 2jd4 s TYR 3006Cb 0.00 0.45 -0.02 0.00 0.38 0.00 0.00 41.96 42.77 2jd4 s TYR 3006CO 0.00 -0.20 1.09 -1.25 -1.52 0.00 0.00 175.55 173.67 2jd4 s PRO 3007N -0.66 3.07 0.48 -3.49 0.04 -1.26 -4.95 135.00 128.22 2jd4 s PRO 3007Ca 0.03 1.32 0.21 0.00 0.04 0.00 0.00 61.00 62.60 2jd4 s PRO 3007Cb -0.02 -1.99 1.23 0.00 0.04 0.00 0.00 34.50 33.76 2jd4 s PRO 3007CO -0.05 -1.03 1.96 0.00 0.04 0.00 0.00 177.00 177.93 2jd4 h ALA 3008N 0.29 2.31 0.00 8.56 0.00 -2.02 -1.89 119.26 126.51 2jd4 h ALA 3008Ca -0.47 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.43 2jd4 h ALA 3008Cb 1.24 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.02 2jd4 h ALA 3008CO 0.56 -0.48 0.00 -2.39 0.00 0.00 0.00 179.25 176.93 2jd4 n HIS 3009N -4.42 0.00 -3.65 0.00 1.44 -1.26 -4.75 115.22 102.58 2jd4 n HIS 3009Ca 0.12 0.00 -0.37 0.00 -2.01 0.00 0.00 57.72 55.46 2jd4 n HIS 3009Cb 0.56 -0.30 -0.10 0.00 0.12 0.00 0.00 29.99 30.27 2jd4 n HIS 3009CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 2jd4 s ILE 3010N -2.61 5.35 0.09 0.61 -1.09 -0.71 -5.07 121.20 117.76 2jd4 s ILE 3010Ca 0.26 0.18 -0.30 0.00 -2.23 0.00 0.00 60.65 58.56 2jd4 s ILE 3010Cb 0.19 -3.51 -0.05 0.00 -1.58 0.00 0.00 42.46 37.51 2jd4 s ILE 3010CO 0.44 0.33 0.96 -0.75 -1.23 0.00 0.00 174.94 174.69 2jd4 s LYS 3011N 1.15 4.66 -0.45 2.79 2.20 -1.26 -4.84 119.74 123.98 2jd4 s LYS 3011Ca 0.08 1.43 0.02 0.00 -0.36 0.00 0.00 55.97 57.14 2jd4 s LYS 3011Cb -0.14 -3.39 0.14 0.00 -1.51 0.00 0.00 37.83 32.93 2jd4 s LYS 3011CO 0.05 0.16 0.27 -0.65 -0.36 0.00 0.00 175.35 174.83 2jd4 s GLN 3012N 0.21 1.27 0.49 4.03 -1.52 -1.26 -4.65 119.66 118.24 2jd4 s GLN 3012Ca 0.48 -2.08 0.33 0.00 -1.95 0.00 0.00 55.36 52.14 2jd4 s GLN 3012Cb -0.23 -2.22 1.66 0.00 -0.22 0.00 0.00 33.01 32.01 2jd4 s GLN 3012CO 0.29 -1.21 2.01 -0.97 -0.25 0.00 0.00 175.29 175.16 2jd4 h ASN 3013N 6.49 0.00 -0.79 5.90 -1.24 -1.88 -2.95 115.58 121.12 2jd4 h ASN 3013Ca 0.05 0.00 -0.57 0.00 0.71 0.00 0.00 56.30 56.49 2jd4 h ASN 3013Cb 0.91 0.00 -0.41 0.00 0.73 0.00 0.00 38.32 39.55 2jd4 h ASN 3013CO 0.47 0.00 -0.60 -1.20 -1.29 0.00 0.00 177.43 174.81 2jd4 n SER 3014N -2.74 5.29 -3.72 1.15 7.64 -1.26 -4.95 113.62 115.02 2jd4 n SER 3014Ca -0.01 -3.75 -0.18 0.00 1.01 0.00 0.00 58.87 55.94 2jd4 n SER 3014Cb 0.14 -0.42 -0.17 0.00 -1.01 0.00 0.00 64.21 62.74 2jd4 n SER 3014CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2jd4 s LEU 3015N -3.63 0.60 0.03 -3.43 1.43 -1.12 -3.06 118.68 109.50 2jd4 s LEU 3015Ca 0.53 0.06 0.13 0.00 -1.03 0.00 0.00 54.13 53.82 2jd4 s LEU 3015Cb 0.42 -0.11 -0.18 0.00 0.03 0.00 0.00 46.19 46.35 2jd4 s LEU 3015CO 0.03 -0.19 0.86 0.77 0.23 0.00 0.00 176.35 178.05 2jd4 h SER 3016N 7.88 0.00 -2.79 2.29 4.64 -1.92 -3.48 113.55 120.18 2jd4 h SER 3016Ca -0.29 0.00 -0.47 0.00 -0.47 0.00 0.00 61.79 60.56 2jd4 h SER 3016Cb 1.12 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.22 2jd4 h SER 3016CO 0.31 0.85 -0.20 -0.55 -0.87 0.00 0.00 176.83 176.37 2jd4 s SER 3017N -6.13 6.30 0.00 4.97 0.15 -1.26 -5.01 113.70 112.72 2jd4 s SER 3017Ca -0.03 0.44 0.00 0.00 0.70 0.00 0.00 55.95 57.07 2jd4 s SER 3017Cb 0.08 -2.03 0.00 0.00 -1.71 0.00 0.00 66.02 62.37 2jd4 s SER 3017CO 0.81 -0.29 0.29 -1.14 1.20 0.00 0.00 173.24 174.11 2jd4 n ARG 3018N -1.77 -0.52 -2.39 5.44 0.63 -1.26 -4.95 116.66 111.84 2jd4 n ARG 3018Ca -0.05 -0.29 -0.42 0.00 -0.92 0.00 0.00 57.85 56.17 2jd4 n ARG 3018Cb 0.56 -0.79 -0.03 0.00 0.45 0.00 0.00 32.46 32.66 2jd4 n ARG 3018CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2jd4 s ALA 3019N -0.01 3.47 0.24 5.13 0.00 -1.26 -4.73 121.76 124.60 2jd4 s ALA 3019Ca 0.00 0.78 -0.30 0.00 0.00 0.00 0.00 51.96 52.44 2jd4 s ALA 3019Cb 0.00 -3.50 -0.09 0.00 0.00 0.00 0.00 23.12 19.53 2jd4 s ALA 3019CO 0.00 -0.66 1.22 -1.12 0.00 0.00 0.00 175.76 175.20 2jd4 s SER 3020N 1.38 7.03 0.56 0.00 0.01 -1.26 -0.95 113.70 120.46 2jd4 s SER 3020Ca 0.59 2.37 -0.20 0.00 1.31 0.00 0.00 55.95 60.02 2jd4 s SER 3020Cb -0.28 -2.62 -0.05 0.00 0.21 0.00 0.00 66.02 63.28 2jd4 s SER 3020CO 0.26 -0.38 1.23 0.12 0.41 0.00 0.00 173.24 174.88 2jd4 s PHE 3021N -0.51 2.46 -0.10 2.43 5.36 0.02 -4.67 117.98 122.96 2jd4 s PHE 3021Ca 0.51 1.49 -0.01 0.00 -0.96 0.00 0.00 56.93 57.96 2jd4 s PHE 3021Cb -0.35 -3.53 0.03 0.00 -0.34 0.00 0.00 43.02 38.83 2jd4 s PHE 3021CO 0.41 -2.22 -0.02 0.50 -1.46 0.00 0.00 175.22 172.43 2jd4 s ARG 3022N -3.12 0.93 0.00 10.12 3.52 -1.26 -2.49 118.95 126.66 2jd4 s ARG 3022Ca 0.74 -0.09 0.00 0.00 -0.13 0.00 0.00 55.73 56.24 2jd4 s ARG 3022Cb -0.32 -1.34 0.00 0.00 -1.56 0.00 0.00 34.95 31.73 2jd4 s ARG 3022CO 0.36 -0.34 0.00 0.41 -0.81 0.00 0.00 175.30 174.93 2jd4 n GLY 3023N 5.06 0.35 3.23 8.12 0.00 -0.55 -4.27 105.19 117.14 2jd4 n GLY 3023Ca -0.09 -1.40 -0.19 0.00 0.00 0.00 0.00 46.02 44.34 2jd4 n GLY 3023CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jd4 s VAL 3025N -1.74 1.13 0.05 0.00 1.01 -0.91 -1.50 120.40 118.42 2jd4 s VAL 3025Ca 0.06 -0.66 -0.03 0.00 0.00 0.00 0.00 61.98 61.36 2jd4 s VAL 3025Cb -0.07 -0.95 -0.03 0.00 0.00 0.00 0.00 36.38 35.33 2jd4 s VAL 3025CO 0.03 0.28 0.02 0.00 0.00 0.00 0.00 175.10 175.43 2jd4 s ARG 3026N -0.43 0.60 -1.35 2.72 1.70 -0.33 -1.61 118.95 120.25 2jd4 s ARG 3026Ca 0.05 -1.04 -0.02 0.00 -0.47 0.00 0.00 55.73 54.25 2jd4 s ARG 3026Cb -0.06 0.22 -0.00 0.00 -0.57 0.00 0.00 34.95 34.54 2jd4 s ARG 3026CO -0.00 -0.13 0.55 0.09 -1.08 0.00 0.00 175.30 174.72 2jd4 n ASN 3027N 0.37 -1.03 -4.65 -2.89 3.02 -1.26 -1.47 115.26 107.34 2jd4 n ASN 3027Ca -0.16 -0.94 -0.43 0.00 -0.03 0.00 0.00 54.58 53.02 2jd4 n ASN 3027Cb 0.60 -3.43 -0.02 0.00 -0.61 0.00 0.00 39.78 36.31 2jd4 n ASN 3027CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 2jd4 s LEU 3028N -6.82 4.07 0.02 3.41 2.96 -1.26 -4.00 118.68 117.06 2jd4 s LEU 3028Ca 0.04 1.28 -0.03 0.00 -0.22 0.00 0.00 54.13 55.21 2jd4 s LEU 3028Cb -0.01 -3.50 -0.02 0.00 0.50 0.00 0.00 46.19 43.16 2jd4 s LEU 3028CO 0.86 -0.69 0.03 0.00 -1.32 0.00 0.00 176.35 175.22 2jd4 s ARG 3029N 3.25 0.42 -0.11 1.98 1.70 -0.27 -0.37 118.95 125.55 2jd4 s ARG 3029Ca 0.43 -0.63 0.03 0.00 -0.47 0.00 0.00 55.73 55.09 2jd4 s ARG 3029Cb -0.14 0.16 0.01 0.00 -0.57 0.00 0.00 34.95 34.40 2jd4 s ARG 3029CO 0.08 -0.08 -0.20 -0.51 -1.08 0.00 0.00 175.30 173.51 2jd4 s LEU 3030N -1.65 1.94 0.30 -1.89 1.02 0.34 -1.60 118.68 117.14 2jd4 s LEU 3030Ca -0.12 -0.50 0.05 0.00 0.02 0.00 0.00 54.13 53.58 2jd4 s LEU 3030Cb -0.07 -1.25 -0.06 0.00 0.02 0.00 0.00 46.19 44.83 2jd4 s LEU 3030CO -0.02 0.09 0.00 -0.44 0.02 0.00 0.00 176.35 176.01 2jd4 s SER 3031N 0.65 2.59 -0.93 2.29 0.01 0.25 -0.78 113.70 117.78 2jd4 s SER 3031Ca -0.13 -1.29 -0.08 0.00 1.31 0.00 0.00 55.95 55.76 2jd4 s SER 3031Cb -0.16 -0.13 -0.01 0.00 0.21 0.00 0.00 66.02 65.92 2jd4 s SER 3031CO 0.03 -0.48 0.74 0.00 0.41 0.00 0.00 173.24 173.94 2jd4 n GLN 3035N -0.64 -1.42 -4.09 12.44 1.13 -1.26 -3.96 117.38 119.58 2jd4 n GLN 3035Ca -0.04 0.90 -0.26 0.00 -1.94 0.00 0.00 57.00 55.65 2jd4 n GLN 3035Cb 0.65 -4.42 -0.06 0.00 0.11 0.00 0.00 30.24 26.52 2jd4 n GLN 3035CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 2jd4 s VAL 3036N -3.20 4.43 -0.24 5.09 1.01 -1.26 -5.05 120.40 121.18 2jd4 s VAL 3036Ca 0.22 -1.09 -0.05 0.00 0.00 0.00 0.00 61.98 61.06 2jd4 s VAL 3036Cb -0.07 -3.25 0.12 0.00 0.00 0.00 0.00 36.38 33.18 2jd4 s VAL 3036CO 0.82 -0.09 0.46 -1.58 0.00 0.00 0.00 175.10 174.71 2jd4 s GLN 3037N -3.05 0.39 -0.09 2.72 0.74 0.04 -4.98 119.66 115.44 2jd4 s GLN 3037Ca 0.31 0.95 -0.15 0.00 0.05 0.00 0.00 55.36 56.51 2jd4 s GLN 3037Cb -0.10 0.21 -0.05 0.00 1.10 0.00 0.00 33.01 34.17 2jd4 s GLN 3037CO 0.23 -0.40 0.39 -1.54 -0.55 0.00 0.00 175.29 173.42 2jd4 s SER 3038N 2.66 6.64 -0.14 6.67 1.04 -1.26 0.12 113.70 129.44 2jd4 s SER 3038Ca 0.04 0.76 -0.24 0.00 0.48 0.00 0.00 55.95 56.99 2jd4 s SER 3038Cb -0.13 -2.24 -0.02 0.00 0.10 0.00 0.00 66.02 63.73 2jd4 s SER 3038CO -0.15 0.15 0.76 -0.76 0.98 0.00 0.00 173.24 174.22 2jd4 s LEU 3039N -0.02 4.22 -0.47 2.42 1.43 0.51 -4.97 118.68 121.79 2jd4 s LEU 3039Ca 0.22 1.14 -0.15 0.00 -1.03 0.00 0.00 54.13 54.30 2jd4 s LEU 3039Cb -0.15 -3.14 0.07 0.00 0.03 0.00 0.00 46.19 43.00 2jd4 s LEU 3039CO 0.09 -0.29 0.39 -0.62 0.23 0.00 0.00 176.35 176.16 2jd4 s ASP 3040N 1.06 6.14 0.46 2.29 2.15 -1.26 -4.65 116.67 122.85 2jd4 s ASP 3040Ca 0.37 -1.34 0.31 0.00 0.43 0.00 0.00 52.55 52.32 2jd4 s ASP 3040Cb -0.17 -2.18 1.67 0.00 -0.30 0.00 0.00 42.92 41.94 2jd4 s ASP 3040CO 0.14 -0.65 1.95 -0.07 -0.17 0.00 0.00 175.17 176.38 2jd4 h LEU 3041N 8.75 0.00 -0.16 -1.34 3.38 -1.98 -1.40 115.31 122.56 2jd4 h LEU 3041Ca -0.28 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.69 2jd4 h LEU 3041Cb 1.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.86 2jd4 h LEU 3041CO 0.88 0.00 0.00 -1.54 0.09 0.00 0.00 178.44 177.87 2jd4 n SER 3042N -2.60 0.17 -0.91 -0.43 3.41 -1.26 -2.36 113.62 109.64 2jd4 n SER 3042Ca -0.02 0.54 0.11 0.00 -0.26 0.00 0.00 58.87 59.24 2jd4 n SER 3042Cb 0.06 -0.58 0.27 0.00 -0.26 0.00 0.00 64.21 63.71 2jd4 n SER 3042CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2jd4 n ARG 3043N -1.68 2.19 -1.68 4.33 1.74 -0.53 -2.51 116.66 118.51 2jd4 n ARG 3043Ca 0.03 -1.80 -0.43 0.00 -0.77 0.00 0.00 57.85 54.89 2jd4 n ARG 3043Cb 0.20 -1.46 -0.01 0.00 -1.02 0.00 0.00 32.46 30.17 2jd4 n ARG 3043CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2jd4 n ALA 3044N 1.02 1.09 0.55 7.54 0.00 -0.99 -4.86 120.51 124.86 2jd4 n ALA 3044Ca 0.18 0.36 0.12 0.00 0.00 0.00 0.00 53.44 54.09 2jd4 n ALA 3044Cb 0.49 -2.22 0.13 0.00 0.00 0.00 0.00 19.45 17.85 2jd4 n ALA 3044CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2jd4 h PHE 3045N 2.44 0.00 -2.95 0.00 -5.15 -1.64 -3.44 116.94 106.20 2jd4 h PHE 3045Ca -0.45 0.00 -0.26 0.00 -0.20 0.00 0.00 57.97 57.05 2jd4 h PHE 3045Cb 1.29 0.00 -0.34 0.00 0.22 0.00 0.00 35.95 37.12 2jd4 h PHE 3045CO 0.50 0.00 -0.59 0.34 -2.00 0.00 0.00 178.31 176.56 2jd4 s ASP 3046N -4.21 0.63 -0.04 -0.68 2.15 -1.24 -5.04 116.67 108.24 2jd4 s ASP 3046Ca 0.05 0.41 0.01 0.00 0.43 0.00 0.00 52.55 53.45 2jd4 s ASP 3046Cb 0.13 0.46 0.02 0.00 -0.30 0.00 0.00 42.92 43.24 2jd4 s ASP 3046CO 0.74 -0.25 -0.03 -0.22 -0.17 0.00 0.00 175.17 175.24 2jd4 s LEU 3047N 2.35 1.27 -0.06 -1.34 2.96 -1.26 -0.84 118.68 121.76 2jd4 s LEU 3047Ca 0.03 -0.10 -0.02 0.00 -0.22 0.00 0.00 54.13 53.81 2jd4 s LEU 3047Cb -0.12 -0.39 0.04 0.00 0.50 0.00 0.00 46.19 46.22 2jd4 s LEU 3047CO -0.07 -0.07 0.10 -1.10 -1.32 0.00 0.00 176.35 173.89 2jd4 s GLN 3048N 0.97 -0.01 -1.74 1.98 -1.52 -0.18 -4.88 119.66 114.28 2jd4 s GLN 3048Ca -0.10 0.42 -0.00 0.00 -1.95 0.00 0.00 55.36 53.73 2jd4 s GLN 3048Cb -0.14 -0.35 0.00 0.00 -0.22 0.00 0.00 33.01 32.30 2jd4 s GLN 3048CO -0.00 -0.28 0.04 0.41 -0.25 0.00 0.00 175.29 175.20 2jd4 n GLY 3049N 5.04 -0.48 3.03 3.09 0.00 -1.26 -0.82 105.19 113.79 2jd4 n GLY 3049Ca -0.10 -0.02 -0.19 0.00 0.00 0.00 0.00 46.02 45.72 2jd4 n GLY 3049CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jd4 s VAL 3050N -3.03 0.73 -0.56 1.61 1.01 -1.26 -2.26 120.40 116.65 2jd4 s VAL 3050Ca 0.02 -0.41 0.04 0.00 0.00 0.00 0.00 61.98 61.63 2jd4 s VAL 3050Cb -0.01 -0.62 0.16 0.00 0.00 0.00 0.00 36.38 35.92 2jd4 s VAL 3050CO 0.02 0.20 0.40 -0.36 0.00 0.00 0.00 175.10 175.36 2jd4 s PHE 3051N -0.23 2.42 -0.02 5.22 0.40 -0.08 -5.03 117.98 120.66 2jd4 s PHE 3051Ca 0.03 -2.83 -0.38 0.00 -0.60 0.00 0.00 56.93 53.16 2jd4 s PHE 3051Cb -0.04 -1.94 -0.16 0.00 0.51 0.00 0.00 43.02 41.39 2jd4 s PHE 3051CO -0.00 -0.69 1.46 -0.35 0.70 0.00 0.00 175.22 176.34 2jd4 n PRO 3052N 2.54 1.15 -0.60 0.24 -0.04 -1.26 -1.89 135.00 135.14 2jd4 n PRO 3052Ca 0.21 0.42 0.00 0.00 -0.04 0.00 0.00 63.50 64.09 2jd4 n PRO 3052Cb 0.40 -2.07 0.00 0.00 -0.04 0.00 0.00 33.50 31.78 2jd4 n PRO 3052CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 2jd4 n HIS 3053N 3.40 0.00 -3.88 0.54 8.25 -1.19 -4.38 115.22 117.96 2jd4 n HIS 3053Ca 0.21 0.00 -0.35 0.00 -0.26 0.00 0.00 57.72 57.32 2jd4 n HIS 3053Cb 0.17 -0.34 -0.13 0.00 1.12 0.00 0.00 29.99 30.81 2jd4 n HIS 3053CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2jd4 s SER 3054N -2.98 4.96 -0.08 0.41 0.15 -0.69 -4.44 113.70 111.04 2jd4 s SER 3054Ca 0.00 -1.29 0.01 0.00 0.70 0.00 0.00 55.95 55.37 2jd4 s SER 3054Cb 0.00 -1.74 0.02 0.00 -1.71 0.00 0.00 66.02 62.59 2jd4 s SER 3054CO 0.00 -0.28 -0.10 0.00 1.20 0.00 0.00 173.24 174.06 2jd4 s PRO 3056N 1.03 2.57 0.02 0.00 0.04 -1.26 -1.56 135.00 135.85 2jd4 s PRO 3056Ca -0.08 0.70 0.00 0.00 0.04 0.00 0.00 61.00 61.66 2jd4 s PRO 3056Cb -0.15 -1.97 0.00 0.00 0.04 0.00 0.00 34.50 32.43 2jd4 s PRO 3056CO -0.01 -1.29 0.00 0.41 0.04 0.00 0.00 177.00 176.15 2jd4 n GLY 3057N -2.29 -2.70 3.88 0.56 0.00 -0.21 -4.59 105.19 99.83 2jd4 n GLY 3057Ca 0.07 -1.39 -0.30 0.00 0.00 0.00 0.00 46.02 44.40 2jd4 n GLY 3057CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2jd4 s PRO 3058N -3.36 3.26 -1.06 1.61 0.04 -1.26 -3.21 135.00 131.02 2jd4 s PRO 3058Ca 0.00 0.58 -0.02 0.00 0.04 0.00 0.00 61.00 61.60 2jd4 s PRO 3058Cb 0.00 -2.07 0.31 0.00 0.04 0.00 0.00 34.50 32.78 2jd4 s PRO 3058CO 0.00 -0.76 1.74 -1.91 0.04 0.00 0.00 177.00 176.11 2jd4 n GLU 3059N -2.84 5.12 0.00 4.56 2.13 -1.26 -4.95 120.64 123.40 2jd4 n GLU 3059Ca 0.06 -4.59 0.00 0.00 0.66 0.00 0.00 57.16 53.29 2jd4 n GLU 3059Cb 0.56 -2.49 0.00 0.00 0.27 0.00 0.00 31.44 29.77 2jd4 n GLU 3059CO 0.00 0.00 0.00 -0.35 -0.41 0.00 0.00 177.13 176.37