# 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 M C C 111.51 6.52 12.64 20.30 111.25 -140.16 -89.12 122.20 99.89 0.08 0.03 99.79 0.10 0.05 0.02 0.00 0.00 0.03 0.01 1 A C C 67.00 6.23 9.88 17.65 113.15 -133.17 -83.49 138.73 91.45 2.68 5.87 87.82 1.19 3.51 3.50 1.37 0.00 1.51 1.10 2 K C C 147.28 2.61 11.51 15.77 112.94 -137.15 -89.90 133.30 86.92 5.12 7.96 68.55 11.44 6.76 4.40 3.54 0.00 2.98 2.33 3 K C C 126.70 6.27 9.84 17.81 113.63 -119.93 -82.73 134.72 85.38 4.22 10.40 65.63 11.98 7.68 5.27 5.11 0.00 2.48 1.84 4 S C C 65.45 6.55 10.74 18.78 115.01 -133.97 -89.14 141.98 87.32 2.88 9.80 64.09 13.39 9.85 4.83 4.96 0.00 1.64 1.24 5 K C C 148.16 3.17 12.76 17.43 107.63 -136.73 -89.37 67.39 87.07 2.74 10.19 62.88 14.31 9.83 5.60 4.62 0.00 1.47 1.29 6 K C C 123.30 5.83 11.62 19.04 113.42 97.29 -90.31 137.88 88.81 1.89 9.31 68.85 12.26 7.53 6.36 3.07 0.00 0.98 0.95 7 S C C 62.44 6.93 11.98 20.22 113.42 -127.52 -86.89 141.40 87.32 1.47 11.21 70.93 8.87 7.23 8.33 3.12 0.00 0.72 0.81 8 A C C 69.64 6.91 13.21 21.22 101.37 -129.14 -77.07 -8.04 70.49 1.12 28.39 42.54 12.15 15.85 22.11 6.22 0.01 0.50 0.64 9 G C C 41.43 7.66 14.47 22.75 104.02 50.38 -64.76 -25.64 62.87 0.97 36.15 31.10 14.36 18.10 28.40 7.06 0.02 0.40 0.57 10 D C H 84.99 7.15 15.59 23.56 103.04 77.01 -82.33 -7.35 55.55 0.87 43.57 30.50 13.50 12.15 37.56 5.48 0.02 0.35 0.46 11 N C H 73.50 8.37 18.89 27.62 107.18 51.91 -84.94 99.96 49.87 0.91 49.22 33.67 8.77 7.73 45.85 3.17 0.01 0.35 0.45 12 I H H 16.71 22.48 16.32 37.97 93.48 -132.22 -64.55 -40.51 8.40 0.11 91.49 4.04 1.71 3.02 90.07 1.06 0.01 0.04 0.05 13 N H H 52.28 15.38 19.98 34.54 91.93 53.14 -62.94 -41.71 4.70 0.06 95.25 1.79 0.71 2.26 94.27 0.90 0.01 0.03 0.02 14 A H H 53.75 3.54 23.97 26.94 91.74 49.92 -64.86 -41.49 3.25 0.04 96.72 1.19 0.46 1.62 95.91 0.78 0.01 0.01 0.01 15 K H H 56.03 13.89 21.67 35.16 92.09 49.93 -65.42 -41.91 1.35 0.01 98.64 0.45 0.17 0.68 98.39 0.29 0.00 0.00 0.00 16 L H H 2.96 26.18 17.09 43.65 91.34 50.82 -63.59 -42.33 0.59 0.00 99.40 0.16 0.05 0.30 99.37 0.10 0.00 0.00 0.00 17 Q H H 80.68 8.59 22.93 31.78 91.26 52.62 -62.47 -41.25 0.39 0.00 99.60 0.10 0.03 0.20 99.59 0.08 0.00 0.00 0.00 18 L H H 73.88 4.31 23.64 27.86 91.66 50.58 -64.04 -42.11 0.39 0.01 99.60 0.08 0.03 0.23 99.56 0.10 0.00 0.00 0.00 19 V H H 10.16 19.49 16.76 36.65 92.25 49.70 -64.47 -42.63 0.59 0.02 99.39 0.11 0.05 0.36 99.28 0.19 0.01 0.01 0.00 20 M H H 50.17 17.71 15.78 32.64 92.08 50.35 -64.20 -40.20 1.50 0.03 98.47 0.22 0.10 1.06 98.00 0.59 0.01 0.01 0.00 21 K H H 153.92 1.64 19.77 21.02 91.30 52.36 -66.24 -30.78 7.57 0.03 92.40 0.37 0.35 6.77 91.86 0.62 0.02 0.01 0.01 22 S C T 64.43 5.04 17.05 22.96 93.49 48.84 -84.39 -10.13 54.87 0.07 45.05 0.74 2.10 50.54 45.50 1.02 0.02 0.02 0.06 23 G C T 32.82 10.73 16.53 27.68 99.48 -108.39 82.88 9.53 99.48 0.22 0.30 4.07 15.74 79.77 0.09 0.12 0.00 0.17 0.04 24 K C C 97.59 9.55 21.38 30.98 107.27 112.98 -93.98 21.37 83.53 16.23 0.23 60.69 20.26 1.33 0.04 0.23 0.00 17.05 0.41 25 Y E E 32.76 21.95 16.74 37.93 129.23 70.16 -124.16 143.09 13.94 85.88 0.18 11.78 2.23 0.23 0.08 0.12 0.00 84.07 1.50 26 Q E E 41.76 14.70 24.14 38.68 126.26 -167.54 -122.51 140.49 5.68 94.28 0.05 5.75 0.20 0.02 0.03 0.02 0.00 92.56 1.42 27 F E E 60.55 17.96 22.03 38.61 122.68 -161.44 -120.61 132.82 20.70 79.27 0.03 18.10 2.03 0.08 0.01 0.02 0.00 79.03 0.73 28 G C S 16.08 10.92 25.34 37.22 126.14 22.70 97.73 165.23 94.70 2.47 2.83 14.31 78.26 2.00 3.38 0.22 0.00 1.12 0.71 29 R H H 59.30 20.37 17.22 36.39 91.94 -89.25 -60.95 -39.70 1.66 0.00 98.33 0.14 0.35 1.00 98.34 0.17 0.00 0.00 0.00 30 K H H 130.77 3.75 23.93 28.35 91.54 51.64 -63.18 -41.68 0.68 0.00 99.32 0.04 0.05 0.51 99.24 0.16 0.00 0.00 0.00 31 S H H 39.62 8.20 23.10 31.83 91.97 48.21 -65.82 -40.50 0.22 0.00 99.78 0.02 0.01 0.14 99.69 0.13 0.00 0.00 0.00 32 C H H 1.43 26.79 17.08 44.60 91.16 50.91 -63.56 -43.90 0.08 0.00 99.92 0.01 0.00 0.04 99.92 0.03 0.00 0.00 0.00 33 L H H 25.07 18.62 22.38 40.22 91.25 49.72 -63.40 -42.77 0.05 0.00 99.95 0.00 0.00 0.03 99.95 0.01 0.00 0.00 0.00 34 K H H 111.21 2.77 27.17 29.17 91.60 50.19 -63.75 -41.95 0.05 0.00 99.95 0.00 0.00 0.04 99.95 0.01 0.00 0.00 0.00 35 A H H 11.66 14.82 20.36 36.20 91.30 50.34 -63.93 -42.21 0.12 0.00 99.88 0.01 0.00 0.08 99.86 0.04 0.00 0.00 0.00 36 L H H 3.59 26.09 15.61 42.02 91.40 49.63 -64.26 -42.30 0.39 0.00 99.61 0.02 0.01 0.32 99.45 0.20 0.00 0.00 0.00 37 R H H 123.89 9.29 20.50 30.24 91.48 51.47 -64.62 -34.38 2.93 0.00 97.07 0.04 0.06 2.95 96.71 0.25 0.00 0.00 0.00 38 T C T 89.74 2.47 21.65 23.30 92.58 50.39 -85.40 -6.74 69.01 0.01 30.97 0.24 1.03 67.14 31.01 0.56 0.00 0.00 0.01 39 G C T 33.03 13.71 15.60 28.95 95.49 -113.05 80.21 11.08 99.62 0.01 0.37 1.15 3.24 95.36 0.17 0.06 0.00 0.00 0.00 40 K C C 114.34 5.59 22.89 29.10 96.50 124.29 -86.43 -11.21 99.31 0.52 0.16 59.52 37.59 2.23 0.05 0.12 0.00 0.22 0.27 41 G C C 4.49 24.39 14.05 37.83 122.00 86.58 -95.09 149.07 92.82 7.05 0.13 81.12 9.93 1.29 0.01 0.19 0.00 7.00 0.46 42 K C S 89.03 10.51 26.64 37.92 100.57 -170.23 -96.03 -25.29 90.92 9.06 0.01 13.39 76.88 0.34 0.00 0.01 0.00 9.25 0.12 43 L E E 10.33 21.70 26.34 47.20 133.56 18.63 -141.35 141.73 2.19 97.80 0.01 1.52 0.56 0.03 0.00 0.00 0.00 97.84 0.05 44 V E E 1.02 27.23 27.27 54.42 121.06 -163.68 -118.51 127.62 0.13 99.87 0.00 0.11 0.00 0.00 0.00 0.00 0.00 99.88 0.00 45 I E E 1.77 26.09 29.40 54.98 116.97 -161.39 -109.40 124.81 0.02 99.98 0.00 0.02 0.00 0.00 0.00 0.00 0.00 99.98 0.00 46 V E E 3.36 24.94 26.78 50.74 130.20 -176.99 -126.62 147.32 0.21 99.79 0.00 0.20 0.00 0.00 0.00 0.00 0.00 99.79 0.01 47 S E E 4.97 22.10 21.15 43.55 114.97 -114.76 -75.02 144.02 24.98 75.00 0.01 24.06 0.55 0.03 0.00 0.01 0.00 75.10 0.24 48 S C T 50.29 11.21 22.10 33.79 93.22 -129.32 -68.50 -21.92 93.17 6.45 0.38 3.61 22.56 67.49 0.02 0.42 0.00 5.56 0.34 49 N C T 94.22 5.52 22.43 28.89 94.86 59.29 -91.88 5.53 98.36 1.36 0.28 6.43 29.04 62.93 0.02 0.34 0.00 1.07 0.17 50 C C S 10.69 23.49 9.04 31.50 118.86 114.92 -76.69 144.34 98.50 1.35 0.15 41.27 57.11 0.29 0.07 0.05 0.00 0.39 0.82 51 P C C 61.06 4.53 18.40 23.75 114.38 -102.21 -63.48 149.62 99.72 0.09 0.19 99.07 0.59 0.13 0.11 0.02 0.00 0.02 0.06 52 S H H 83.04 3.20 14.23 19.24 91.75 -109.84 -57.85 -38.02 9.95 0.03 90.02 1.60 1.51 6.57 84.31 5.97 0.01 0.01 0.02 53 I H H 115.89 2.05 17.48 19.36 91.84 54.38 -64.59 -38.25 7.20 0.03 92.77 0.93 0.81 5.24 86.35 6.63 0.02 0.01 0.01 54 Q H H 44.34 15.75 15.07 30.56 92.69 48.25 -70.32 -35.26 5.13 0.05 94.82 1.30 0.62 2.95 87.54 7.53 0.01 0.03 0.01 55 R H H 76.42 16.61 16.12 31.77 91.68 55.95 -61.63 -42.50 3.75 0.03 96.22 1.07 0.50 1.93 94.85 1.63 0.00 0.01 0.01 56 S H H 61.32 2.44 23.46 24.53 91.63 51.32 -64.02 -40.88 5.00 0.02 94.98 0.71 0.38 3.51 94.71 0.68 0.00 0.01 0.01 57 V H H 50.05 9.07 22.07 31.74 91.72 49.57 -64.71 -42.09 2.19 0.01 97.80 0.36 0.17 1.46 97.72 0.27 0.00 0.00 0.00 58 I H H 1.93 26.93 16.28 43.95 91.18 49.74 -63.80 -43.18 0.25 0.00 99.75 0.05 0.02 0.11 99.76 0.06 0.00 0.00 0.00 59 E H H 77.98 12.63 22.16 34.13 91.42 51.77 -62.19 -42.23 0.07 0.00 99.93 0.01 0.00 0.03 99.93 0.02 0.00 0.00 0.00 60 Y H H 125.01 2.54 25.36 26.43 91.74 49.77 -63.76 -42.53 0.07 0.00 99.93 0.00 0.00 0.04 99.93 0.02 0.00 0.00 0.00 61 Y H H 35.82 15.69 20.78 36.56 92.14 48.99 -64.84 -42.51 0.08 0.00 99.92 0.00 0.00 0.06 99.90 0.04 0.00 0.00 0.00 62 A H H 3.96 23.53 14.76 38.48 91.48 50.65 -63.45 -42.12 0.29 0.00 99.71 0.02 0.01 0.22 99.63 0.12 0.00 0.00 0.00 63 M H H 115.52 3.88 20.85 25.44 91.89 49.58 -64.45 -40.24 1.20 0.00 98.80 0.05 0.05 1.07 98.49 0.35 0.00 0.00 0.00 64 L H H 99.68 4.55 20.08 25.06 91.85 51.28 -66.06 -34.10 5.60 0.00 94.39 0.12 0.21 5.24 94.07 0.35 0.00 0.00 0.00 65 S C T 24.12 16.33 14.69 31.29 94.68 46.93 -88.75 -2.61 56.88 0.08 43.04 1.30 3.67 49.83 44.18 0.91 0.01 0.02 0.07 66 K C T 157.83 2.07 21.57 23.80 94.00 -124.32 58.69 39.66 99.48 0.06 0.46 7.09 4.22 88.32 0.24 0.09 0.00 0.03 0.02 67 C C C 13.24 22.38 12.72 34.65 124.65 144.29 -108.76 149.38 96.99 2.98 0.03 87.61 8.83 0.33 0.00 0.02 0.00 3.05 0.14 68 G E E 27.85 7.44 25.82 33.93 117.51 -112.34 -76.69 150.74 43.03 56.92 0.05 38.34 2.60 0.23 0.01 0.04 0.00 58.40 0.38 69 V E E 31.57 23.21 15.37 37.74 125.71 -155.00 -122.37 135.41 4.47 95.52 0.00 4.31 0.15 0.01 0.00 0.00 0.00 95.18 0.34 70 H E E 59.26 12.81 23.85 36.48 124.25 -169.26 -118.66 135.26 0.72 99.27 0.00 0.67 0.02 0.00 0.00 0.00 0.00 99.25 0.05 71 D E E 69.19 13.33 21.75 34.51 118.52 -150.02 -98.97 129.31 3.20 96.79 0.00 3.05 0.11 0.01 0.00 0.00 0.00 96.70 0.14 72 Y E E 35.94 19.90 14.18 33.59 122.06 -171.11 -113.13 136.63 46.01 53.91 0.08 43.11 1.57 0.19 0.02 0.06 0.00 54.43 0.63 73 H C C 143.85 2.68 21.97 24.63 103.33 -149.52 -94.92 48.13 83.14 16.65 0.20 50.39 28.37 3.75 0.03 0.22 0.00 16.65 0.59 74 G C S 24.76 10.90 17.66 28.89 134.65 71.37 -119.71 -174.31 93.67 5.94 0.39 17.63 71.70 4.51 0.07 0.29 0.00 5.01 0.79 75 D C C 71.35 5.61 23.76 29.26 126.12 -79.61 -102.08 160.03 95.78 2.91 1.31 82.18 12.52 0.94 1.07 0.31 0.00 1.26 1.72 76 N H H 37.50 21.08 14.60 34.85 92.34 -108.65 -60.68 -36.12 6.59 0.04 93.37 1.15 1.60 3.84 92.39 0.98 0.01 0.01 0.02 77 N H H 89.30 6.11 21.85 28.59 92.43 54.64 -65.09 -40.34 4.19 0.02 95.79 0.55 0.54 3.04 94.81 1.03 0.02 0.01 0.01 78 D H H 68.65 5.44 23.42 28.90 92.50 48.30 -66.26 -40.32 2.40 0.04 97.56 0.58 0.35 1.52 96.29 1.21 0.01 0.02 0.01 79 L H H 5.17 23.22 16.08 39.61 91.87 51.42 -64.27 -43.23 1.11 0.02 98.87 0.21 0.16 0.71 98.25 0.65 0.01 0.01 0.00 80 G H H 8.41 15.86 17.10 33.81 91.62 51.16 -62.66 -42.22 1.95 0.03 98.02 0.34 0.21 1.34 97.17 0.92 0.01 0.01 0.01 81 T H H 92.08 2.26 22.06 23.54 92.14 49.66 -65.36 -40.40 2.39 0.02 97.59 0.31 0.22 1.78 96.10 1.57 0.01 0.01 0.00 82 A H H 42.45 11.96 17.72 29.98 92.32 52.46 -66.87 -34.72 6.31 0.04 93.65 0.31 0.46 5.59 92.25 1.32 0.02 0.01 0.01 83 C H H 23.70 18.08 14.59 32.62 95.22 40.15 -90.65 -5.02 49.39 0.08 50.53 0.74 2.17 46.13 49.10 1.74 0.03 0.02 0.07 84 G C T 57.21 1.99 20.47 21.80 94.22 -115.05 77.95 14.31 99.12 0.05 0.84 4.05 6.12 89.17 0.35 0.27 0.00 0.02 0.02 85 K C C 77.15 10.83 13.13 25.03 130.89 115.37 -119.24 155.92 98.48 0.86 0.67 51.19 44.83 2.47 0.22 0.42 0.00 0.31 0.57 86 L C C 114.49 4.47 18.42 23.76 97.83 -132.12 -81.47 -8.05 97.10 1.73 1.17 62.54 31.29 3.17 0.23 1.05 0.00 0.82 0.92 87 F C C 63.42 13.88 17.61 31.60 131.32 65.67 -125.09 154.43 94.47 3.76 1.77 57.35 32.99 4.12 0.31 1.70 0.00 2.26 1.27 88 R C C 106.57 11.25 24.29 35.18 112.06 -104.54 -77.77 129.62 90.49 8.09 1.42 69.98 16.51 3.74 0.23 1.48 0.00 6.51 1.55 89 I C C 9.23 24.84 18.64 43.44 121.80 -158.05 -109.49 135.53 68.87 30.53 0.60 64.09 4.02 0.56 0.17 0.48 0.00 27.79 2.89 90 S C S 18.95 17.34 26.40 43.48 98.78 -169.90 -92.26 -30.81 74.53 25.11 0.36 26.18 47.35 0.97 0.04 0.27 0.00 24.85 0.33 91 C E E 5.39 22.61 27.25 49.50 138.00 7.58 -148.95 146.81 8.72 90.79 0.49 6.91 1.55 0.29 0.09 0.27 0.00 90.61 0.27 92 L E E 2.79 26.45 26.44 52.33 125.29 -163.98 -126.49 135.87 1.31 98.63 0.06 1.19 0.10 0.01 0.02 0.01 0.00 98.63 0.03 93 V E E 11.79 20.98 28.46 48.44 121.92 -163.28 -115.01 129.93 0.52 99.46 0.02 0.47 0.02 0.00 0.01 0.00 0.00 99.48 0.02 94 I E E 7.14 23.87 21.35 45.25 115.07 -157.14 -105.01 121.83 2.68 97.29 0.02 2.65 0.06 0.01 0.01 0.00 0.00 97.10 0.16 95 T C E 48.82 12.72 23.28 35.75 100.70 -172.81 -91.92 -25.44 60.59 39.13 0.28 29.60 29.36 1.56 0.07 0.19 0.00 38.74 0.47 96 D C S 70.51 7.32 22.50 30.32 117.21 33.57 -126.67 109.00 88.42 9.40 2.18 28.21 54.01 6.07 1.11 0.95 0.00 8.59 1.07 97 V C C 55.43 16.93 14.83 31.08 96.31 -162.90 -70.88 -23.21 64.90 2.92 32.17 26.42 14.01 25.13 22.99 8.48 0.09 1.84 1.05 98 G C H 36.39 6.22 20.53 27.27 95.66 62.99 -59.57 -40.81 57.60 1.27 41.13 19.03 12.43 27.09 31.52 8.55 0.08 0.68 0.64 99 D H H 57.48 11.88 18.57 30.47 95.62 47.73 -81.24 -15.27 41.21 0.97 57.81 22.55 7.49 12.17 47.42 9.41 0.02 0.53 0.41 100 S H H 17.27 20.01 13.83 33.22 94.52 75.93 -66.91 -35.85 24.36 0.69 74.95 12.51 4.90 8.34 65.55 8.03 0.03 0.40 0.23 101 D H H 87.72 3.73 22.34 25.87 92.84 63.55 -65.74 -35.27 18.50 0.79 80.72 8.50 3.85 7.50 71.34 8.00 0.05 0.54 0.22 102 I H H 50.56 9.97 18.47 29.54 92.90 55.58 -66.06 -40.89 15.95 1.34 82.71 7.18 3.25 6.90 73.83 7.41 0.07 1.08 0.29 103 I H H 17.81 20.98 13.86 34.24 92.89 51.85 -67.09 -39.23 17.77 2.64 79.58 8.59 3.63 7.15 71.60 6.22 0.12 2.17 0.52 104 K H H 110.12 8.06 17.17 25.98 93.43 56.42 -69.15 -29.82 29.50 2.84 67.67 12.43 5.27 13.10 61.64 4.68 0.10 2.12 0.65 105 T C H 92.29 3.44 14.86 19.00 98.57 55.37 -82.53 -12.26 48.93 3.08 47.99 17.06 7.67 25.00 43.18 4.10 0.10 1.95 0.92 106 N C C 80.29 9.17 9.51 19.63 108.41 87.99 -83.76 109.01 73.64 2.14 24.23 51.27 3.93 17.25 23.10 2.38 0.00 1.10 0.97 107 E C C 138.70 3.19 13.84 18.53 106.92 -135.70 -80.32 100.68 99.90 0.04 0.05 99.76 0.08 0.09 0.03 0.00 0.00 0.02 0.00