# AA SS3 SS8 ASA HSEa-u HSEa-d CN13 theta tau phi psi P(3-C) P(3-E) P(3-H) P(8-C) P(8-S) P(8-T) P(8-H) P(8-G) P(8-I) P(8-E) P(8-B) 0 S C C 63.34 5.96 14.71 21.79 117.73 -145.06 -93.41 149.30 99.89 0.06 0.05 99.71 0.15 0.08 0.02 0.00 0.00 0.02 0.01 1 N C C 103.80 6.41 12.12 19.58 100.76 -130.66 -81.14 1.71 71.47 1.68 26.85 59.54 2.70 10.07 18.70 7.11 0.00 0.87 1.01 2 A C C 63.54 6.04 12.04 19.46 103.93 85.62 -79.89 14.05 59.97 2.85 37.18 32.67 12.72 15.28 22.43 14.02 0.04 1.46 1.39 3 A C C 59.83 6.04 13.67 20.94 99.10 59.47 -76.39 -20.92 55.61 4.07 40.31 33.85 9.98 11.97 24.10 16.10 0.04 2.28 1.67 4 L C C 66.73 11.70 11.85 23.90 102.19 61.26 -78.81 -10.96 53.90 4.72 41.38 33.96 10.35 10.08 27.68 13.36 0.05 2.56 1.96 5 D C C 79.64 6.52 14.24 21.84 104.65 64.02 -86.30 39.31 62.37 4.12 33.51 40.66 9.95 11.81 24.11 9.29 0.03 2.16 2.00 6 E C T 119.75 5.96 13.36 20.60 96.35 59.23 -72.04 -18.23 71.80 1.45 26.75 20.94 14.62 37.06 18.05 7.74 0.04 0.68 0.87 7 S C T 76.13 4.50 14.21 19.44 97.07 55.60 -83.19 -11.69 82.01 0.98 17.01 20.31 22.30 40.38 9.67 6.20 0.01 0.42 0.70 8 D C C 59.84 8.25 13.04 22.81 109.88 53.09 -116.21 94.19 98.25 1.04 0.71 73.59 23.88 0.71 0.37 0.29 0.00 0.36 0.79 9 P C G 70.53 10.44 12.41 24.12 93.65 -173.03 -63.51 -23.60 50.60 0.47 48.93 8.81 4.87 34.92 4.66 46.26 0.00 0.28 0.20 10 D H G 95.93 4.58 18.44 24.01 92.20 67.17 -72.64 -16.49 45.34 0.56 54.10 4.75 4.72 34.39 6.98 48.59 0.01 0.34 0.23 11 W H G 63.09 13.83 16.23 30.52 95.83 65.66 -76.89 -14.80 37.88 2.31 59.80 11.30 8.75 20.06 7.79 49.97 0.02 1.44 0.68 12 C C C 24.54 17.79 14.80 32.35 100.14 59.40 -93.02 9.16 54.13 12.88 33.00 28.09 13.93 14.48 8.80 22.75 0.21 8.58 3.15 13 K E B 99.59 8.12 16.63 25.73 118.87 112.22 -95.84 136.86 36.66 58.81 4.54 25.69 6.83 1.60 3.32 1.24 0.10 18.52 42.69 14 T C C 50.42 9.83 11.24 22.26 122.00 -135.93 -84.38 166.22 79.35 17.98 2.68 70.11 5.96 2.17 1.64 1.18 0.00 13.56 5.38 15 A C T 96.20 1.52 11.95 14.16 92.06 -99.02 -62.45 -25.74 81.35 13.77 4.87 8.39 13.29 60.29 0.93 3.67 0.02 9.75 3.65 16 S C T 85.03 1.62 12.90 14.69 94.42 54.44 -86.66 -0.47 95.34 0.84 3.83 3.73 13.49 78.37 0.55 3.04 0.00 0.56 0.26 17 G C S 38.55 7.02 12.92 21.26 97.98 -100.89 87.95 5.76 95.47 2.10 2.43 14.73 61.17 19.68 0.24 2.19 0.00 1.43 0.57 18 H C C 82.91 8.05 15.28 24.66 120.58 128.18 -88.15 149.31 81.21 18.29 0.51 59.80 19.89 1.85 0.18 0.39 0.00 13.91 3.96 19 I E B 38.11 17.06 13.38 30.64 114.08 -114.42 -83.44 131.54 23.18 76.37 0.46 18.84 1.95 0.22 0.38 0.13 0.00 27.98 50.51 20 K C C 103.53 8.51 19.90 28.80 113.75 -134.74 -83.38 141.44 79.89 19.77 0.34 64.30 14.61 0.81 0.14 0.25 0.00 16.56 3.34 21 R C C 107.59 11.35 18.23 29.68 120.98 -103.87 -95.72 143.30 91.47 8.26 0.27 50.44 40.89 1.01 0.09 0.18 0.00 5.85 1.54 22 P C C 48.59 14.52 18.05 32.33 113.81 -89.85 -67.20 148.33 93.23 5.56 1.21 83.43 7.49 2.23 0.43 0.79 0.00 3.69 1.94 23 M C C 48.82 17.29 18.48 35.17 114.41 -116.87 -83.11 134.55 94.35 4.41 1.23 83.66 8.80 1.46 0.63 0.54 0.00 1.76 3.16 24 N C C 41.51 13.71 23.61 36.79 124.70 -138.50 -93.04 161.78 95.21 3.52 1.28 85.17 8.86 0.63 1.05 0.23 0.00 0.90 3.16 25 A H H 21.42 18.79 20.38 38.87 91.68 -104.39 -60.58 -35.79 3.87 0.01 96.12 0.41 0.60 2.76 95.66 0.55 0.01 0.00 0.00 26 F H H 48.00 17.24 22.48 38.72 91.77 54.00 -64.28 -40.32 1.35 0.00 98.64 0.09 0.10 1.09 98.27 0.44 0.00 0.00 0.00 27 M H H 42.55 14.42 23.25 37.34 92.16 50.00 -65.58 -41.30 0.37 0.00 99.62 0.05 0.03 0.25 99.28 0.40 0.00 0.00 0.00 28 V H H 19.94 15.49 22.41 38.20 91.47 50.53 -63.66 -43.44 0.21 0.00 99.79 0.02 0.01 0.13 99.68 0.16 0.00 0.00 0.00 29 W H H 41.01 15.88 22.46 38.19 91.75 49.73 -64.44 -42.07 0.32 0.00 99.68 0.03 0.01 0.21 99.64 0.10 0.00 0.00 0.00 30 S H H 15.47 15.69 20.38 36.44 91.99 51.30 -63.70 -42.04 0.51 0.00 99.49 0.05 0.02 0.34 99.49 0.09 0.00 0.00 0.00 31 K H H 84.40 9.21 23.25 32.47 91.90 50.36 -64.77 -41.18 0.49 0.00 99.51 0.05 0.03 0.33 99.50 0.09 0.00 0.00 0.00 32 I H H 39.87 10.09 21.43 32.59 92.01 49.48 -64.73 -42.24 0.65 0.00 99.34 0.06 0.04 0.46 99.31 0.14 0.00 0.00 0.00 33 E H H 50.41 12.83 20.20 33.25 92.06 50.14 -64.76 -41.11 0.99 0.00 99.00 0.09 0.04 0.72 99.00 0.14 0.00 0.00 0.00 34 R H H 74.39 13.75 18.51 32.01 91.94 51.78 -63.76 -41.38 0.47 0.00 99.53 0.05 0.02 0.29 99.55 0.09 0.00 0.00 0.00 35 R H H 118.28 4.62 20.99 25.83 92.00 50.48 -64.68 -40.78 0.37 0.00 99.63 0.04 0.02 0.23 99.64 0.07 0.00 0.00 0.00 36 K H H 92.91 4.99 20.13 25.52 92.14 49.79 -65.24 -41.10 0.68 0.00 99.32 0.08 0.04 0.45 99.32 0.11 0.00 0.00 0.00 37 I H H 27.30 12.84 14.80 29.09 92.25 49.54 -65.40 -41.31 0.94 0.00 99.06 0.10 0.08 0.65 98.97 0.18 0.00 0.00 0.00 38 M H H 68.45 9.54 13.96 24.72 92.00 51.44 -65.48 -37.32 2.02 0.01 97.97 0.23 0.19 1.47 97.65 0.46 0.00 0.00 0.00 39 E H H 138.73 1.38 16.74 17.42 92.94 51.10 -66.89 -36.16 5.91 0.01 94.08 0.27 0.39 5.17 93.66 0.50 0.01 0.00 0.00 40 Q H H 119.97 2.62 14.72 17.82 95.97 41.16 -80.96 -26.94 10.90 0.04 89.06 0.55 1.68 8.67 88.70 0.34 0.02 0.01 0.03 41 S C C 34.64 9.71 9.49 20.74 112.75 26.05 -133.05 77.59 99.78 0.11 0.12 82.15 17.24 0.35 0.07 0.03 0.00 0.02 0.13 42 P C T 102.00 3.27 11.30 16.96 93.26 172.48 -64.86 -21.21 99.59 0.05 0.36 2.75 3.89 92.98 0.04 0.29 0.00 0.03 0.02 43 D C T 130.38 0.54 14.82 13.37 94.20 57.12 -88.75 -0.05 99.67 0.04 0.29 1.95 4.41 93.32 0.02 0.26 0.00 0.03 0.01 44 M C C 47.32 13.84 7.51 21.44 118.11 105.13 -82.13 143.59 99.55 0.31 0.15 52.20 47.04 0.29 0.05 0.06 0.00 0.07 0.27 45 H C C 113.73 2.27 19.28 20.57 117.42 -117.92 -77.81 155.02 99.35 0.54 0.11 98.82 0.47 0.05 0.06 0.01 0.00 0.08 0.51 46 N H H 82.20 12.17 12.98 25.39 91.70 -110.44 -57.72 -39.74 1.46 0.00 98.53 0.20 0.17 0.89 98.18 0.55 0.00 0.00 0.00 47 A H H 62.09 3.39 18.31 22.00 91.77 53.05 -64.06 -40.28 0.62 0.00 99.38 0.06 0.04 0.43 98.94 0.53 0.00 0.00 0.00 48 E H H 86.72 4.08 19.96 24.25 91.83 49.30 -65.73 -40.76 0.25 0.00 99.75 0.04 0.02 0.15 99.33 0.47 0.00 0.00 0.00 49 I H H 12.57 18.16 14.98 33.89 91.61 50.14 -63.49 -43.27 0.15 0.00 99.85 0.02 0.01 0.08 99.81 0.08 0.00 0.00 0.00 50 S H H 30.24 13.05 18.47 31.96 91.82 51.23 -63.35 -41.77 0.29 0.00 99.71 0.04 0.01 0.18 99.71 0.06 0.00 0.00 0.00 51 K H H 121.84 2.44 23.31 24.87 92.02 49.46 -64.83 -41.39 0.42 0.00 99.58 0.03 0.01 0.31 99.57 0.08 0.00 0.00 0.00 52 R H H 93.00 7.71 22.40 30.39 92.00 48.31 -65.73 -41.69 0.64 0.00 99.36 0.05 0.03 0.50 99.31 0.12 0.00 0.00 0.00 53 L H H 11.69 19.96 17.56 37.69 91.91 49.81 -64.29 -42.54 0.89 0.00 99.10 0.08 0.05 0.65 99.05 0.16 0.00 0.00 0.00 54 G H H 17.18 11.36 18.86 31.38 91.77 52.42 -62.50 -41.52 1.50 0.00 98.50 0.12 0.06 1.15 98.31 0.35 0.00 0.00 0.00 55 K H H 116.59 2.19 23.43 24.16 91.86 50.05 -64.75 -41.22 1.44 0.00 98.56 0.09 0.08 1.16 97.91 0.76 0.00 0.00 0.00 56 R H H 82.73 10.59 19.82 30.65 92.24 49.33 -65.87 -40.79 1.29 0.00 98.71 0.10 0.07 0.98 96.96 1.88 0.00 0.00 0.00 57 W H H 27.83 20.88 14.02 34.60 91.90 51.84 -65.03 -35.99 2.07 0.01 97.92 0.14 0.11 1.69 92.38 5.67 0.00 0.00 0.00 58 K H H 131.86 4.42 19.37 24.99 90.69 59.00 -66.73 -25.40 16.77 0.01 83.22 0.22 0.35 17.17 78.07 4.18 0.01 0.00 0.01 59 M H H 119.53 3.10 18.90 22.12 93.53 56.36 -86.39 -9.01 42.60 0.03 57.37 0.60 1.41 41.11 53.30 3.53 0.02 0.01 0.03 60 L C S 27.54 19.02 7.60 25.45 118.76 102.05 -77.23 145.27 96.49 0.83 2.68 36.24 58.62 1.39 2.42 0.29 0.00 0.17 0.87 61 K C C 123.08 2.09 18.33 19.66 116.78 -115.43 -74.09 154.55 97.32 0.94 1.75 95.20 1.29 0.90 1.22 0.27 0.00 0.26 0.86 62 D H H 100.14 6.04 12.38 20.16 92.79 -104.86 -59.20 -38.22 19.30 0.19 80.51 3.23 2.76 11.53 45.05 37.19 0.04 0.10 0.09 63 S H H 83.88 1.97 15.96 18.06 92.19 55.89 -68.56 -26.29 13.93 0.04 86.03 0.74 1.02 10.64 45.24 42.30 0.01 0.02 0.02 64 E H H 91.38 8.06 15.90 24.77 94.71 51.59 -78.13 -23.37 13.95 0.05 86.00 0.89 1.11 10.25 44.03 43.66 0.01 0.02 0.02 65 K H H 43.04 17.99 13.57 30.77 94.44 60.04 -74.89 -24.29 22.25 0.18 77.57 3.69 3.45 14.01 58.14 20.44 0.07 0.07 0.13 66 I H H 64.47 8.22 18.90 28.17 93.11 68.99 -61.84 -43.31 2.04 0.00 97.96 0.49 0.26 0.97 97.76 0.53 0.00 0.00 0.00 67 P H H 59.10 4.38 22.34 26.86 91.35 51.11 -63.56 -40.28 0.72 0.00 99.28 0.10 0.04 0.46 98.91 0.49 0.00 0.00 0.00 68 F H H 22.86 17.78 18.63 36.49 91.98 50.15 -64.83 -42.01 0.20 0.00 99.80 0.02 0.01 0.13 99.51 0.33 0.00 0.00 0.00 69 I H H 32.20 16.35 19.66 35.82 91.80 50.66 -63.70 -42.77 0.09 0.00 99.91 0.01 0.00 0.05 99.89 0.05 0.00 0.00 0.00 70 R H H 125.65 3.13 24.35 26.80 91.62 49.95 -63.94 -41.98 0.11 0.00 99.89 0.01 0.00 0.07 99.90 0.02 0.00 0.00 0.00 71 E H H 73.66 7.17 22.62 30.24 91.65 49.18 -64.72 -41.74 0.09 0.00 99.91 0.01 0.00 0.06 99.92 0.01 0.00 0.00 0.00 72 A H H 6.06 19.98 16.28 37.00 91.50 51.15 -63.18 -42.36 0.09 0.00 99.91 0.01 0.00 0.05 99.92 0.02 0.00 0.00 0.00 73 E H H 83.84 7.92 21.83 30.09 91.28 51.16 -63.61 -41.07 0.13 0.00 99.87 0.01 0.00 0.08 99.89 0.01 0.00 0.00 0.00 74 R H H 128.90 2.30 23.46 24.46 91.68 50.23 -64.26 -41.52 0.11 0.00 99.89 0.01 0.00 0.07 99.90 0.02 0.00 0.00 0.00 75 L H H 32.61 12.31 18.49 31.94 91.90 50.04 -64.81 -41.75 0.11 0.00 99.89 0.01 0.00 0.07 99.90 0.02 0.00 0.00 0.00 76 R H H 77.59 14.50 17.77 31.76 91.60 51.84 -63.36 -41.64 0.18 0.00 99.82 0.01 0.00 0.12 99.84 0.03 0.00 0.00 0.00 77 L H H 86.02 3.30 20.28 23.39 91.78 50.53 -64.16 -41.41 0.21 0.00 99.79 0.02 0.01 0.14 99.79 0.04 0.00 0.00 0.00 78 K H H 110.23 2.72 20.10 22.32 91.84 49.85 -65.05 -40.93 0.39 0.00 99.61 0.03 0.02 0.28 99.58 0.09 0.00 0.00 0.00 79 H H H 40.28 12.91 14.20 28.14 92.33 49.67 -65.40 -40.76 0.91 0.00 99.09 0.07 0.05 0.71 98.90 0.27 0.00 0.00 0.00 80 M H H 75.65 8.87 14.06 24.04 92.15 51.23 -65.62 -36.55 2.09 0.00 97.91 0.14 0.12 1.71 97.37 0.66 0.00 0.00 0.00 81 A H H 77.58 1.50 15.74 16.60 92.40 53.24 -67.64 -33.64 9.17 0.00 90.82 0.20 0.31 8.70 90.13 0.65 0.01 0.00 0.00 82 D H H 97.34 2.89 14.54 18.05 95.95 43.51 -83.92 -19.61 23.88 0.03 76.09 0.65 1.79 20.90 75.92 0.68 0.02 0.01 0.02 83 Y C C 66.86 10.93 8.53 20.47 110.81 35.47 -127.82 78.94 99.36 0.23 0.41 64.60 34.10 0.63 0.28 0.10 0.00 0.05 0.23 84 P C T 99.50 2.88 11.75 16.68 93.66 171.34 -64.40 -24.70 92.64 0.19 7.17 8.12 5.25 78.43 0.73 7.26 0.00 0.11 0.09 85 D C T 119.76 1.17 14.28 15.11 95.27 56.32 -89.82 2.47 92.53 0.25 7.23 5.19 5.61 80.87 0.63 7.45 0.00 0.16 0.09 86 Y C C 66.36 15.17 7.54 22.10 115.04 111.80 -81.44 134.61 91.15 1.75 7.10 74.23 11.38 4.75 1.08 6.70 0.00 0.84 1.02 87 K C C 136.19 2.61 17.49 20.96 120.95 -167.91 -115.63 135.29 94.18 3.98 1.84 88.23 4.04 1.84 0.63 1.05 0.00 1.84 2.38 88 Y C C 100.28 13.81 10.31 23.95 116.78 -140.07 -92.08 133.19 94.38 4.79 0.83 82.81 10.09 1.15 0.34 0.48 0.00 2.21 2.93 89 R C C 138.25 4.15 14.08 19.79 118.09 -164.31 -110.87 129.83 98.92 0.89 0.19 89.87 8.83 0.34 0.08 0.09 0.00 0.43 0.35 90 P C C 82.62 6.44 11.03 19.13 113.01 -110.45 -67.06 146.44 94.94 1.25 3.81 85.06 5.30 4.48 0.95 2.88 0.00 0.62 0.71 91 R C C 160.99 4.11 9.76 15.65 110.08 -127.13 -83.41 131.72 94.59 1.30 4.10 61.95 25.62 6.81 1.12 3.04 0.00 0.55 0.91 92 K C C 151.46 1.98 10.57 14.01 114.92 -113.74 -92.90 136.08 94.00 2.07 3.93 62.31 27.80 3.56 1.37 2.51 0.00 0.79 1.66 93 K C C 145.14 3.21 9.46 14.85 114.62 -114.12 -83.02 135.86 96.78 0.88 2.34 83.23 12.26 1.34 1.16 1.08 0.00 0.38 0.55 94 P C C 79.07 6.87 8.29 16.82 112.75 -108.33 -67.17 147.97 89.63 1.10 9.27 72.72 7.13 9.23 2.10 7.65 0.00 0.57 0.59 95 K C C 161.41 1.35 11.35 13.49 110.72 -122.53 -84.31 129.39 88.83 2.22 8.96 63.06 13.40 11.55 1.99 7.55 0.00 1.06 1.39 96 M C C 113.63 6.20 7.70 15.48 116.89 -144.42 -90.53 138.17 90.76 2.91 6.34 61.52 22.49 6.10 1.94 4.44 0.00 1.12 2.39 97 D C C 87.00 3.32 10.23 15.20 112.92 -130.38 -91.52 122.70 97.89 1.11 1.00 78.62 17.65 1.44 0.43 0.52 0.00 0.40 0.94 98 P C T 107.86 2.98 9.13 14.23 93.66 -140.21 -62.44 -23.41 77.50 0.60 21.90 19.86 10.06 46.63 2.72 20.09 0.00 0.32 0.33 99 S C T 93.00 1.09 10.96 12.26 96.09 62.37 -82.90 -5.93 77.57 0.80 21.62 15.63 12.08 49.14 2.63 19.65 0.00 0.42 0.44 100 A C C 61.77 5.73 8.89 16.32 106.47 86.59 -83.69 102.60 78.05 2.09 19.85 39.18 25.30 12.85 2.64 17.66 0.00 0.92 1.43 101 K C C 122.95 4.81 10.61 17.30 116.66 -128.28 -91.34 134.97 96.55 1.45 2.00 63.03 32.11 1.50 0.99 0.82 0.00 0.49 1.06 102 P C C 77.09 6.27 10.30 18.33 112.47 -110.33 -66.22 150.01 85.39 2.11 12.50 70.20 6.25 9.10 4.55 7.53 0.00 1.08 1.29 103 S C C 81.47 3.00 11.28 15.72 107.90 -112.41 -78.65 139.16 78.87 2.32 18.81 52.63 11.56 14.27 5.27 13.74 0.00 1.12 1.41 104 A C C 76.33 4.56 9.06 15.32 103.58 -118.96 -78.43 32.02 72.66 2.30 25.04 37.61 17.44 18.06 5.00 19.56 0.00 1.12 1.20 105 S C C 85.50 2.41 9.47 13.43 105.05 77.50 -86.22 55.86 76.34 2.59 21.07 41.09 16.68 18.44 3.91 17.33 0.00 1.31 1.24 106 Q C C 130.04 2.83 8.66 13.31 107.99 130.83 -88.92 88.41 85.56 3.17 11.27 53.49 21.00 10.59 2.59 8.85 0.00 1.38 2.09 107 S C C 78.57 3.09 8.58 13.63 115.49 -127.61 -90.49 134.17 99.22 0.67 0.11 92.96 5.98 0.37 0.05 0.04 0.00 0.28 0.33 108 P C C 102.93 3.12 11.43 16.19 106.99 -105.45 -67.65 137.99 99.94 0.04 0.02 99.72 0.18 0.07 0.01 0.00 0.00 0.02 0.01