# 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 98.24 9.18 17.08 26.62 119.53 -136.38 -90.06 140.19 99.96 0.03 0.00 99.88 0.10 0.01 0.00 0.00 0.00 0.01 0.00 1 P C C 47.55 15.16 12.27 27.34 115.79 -106.40 -67.27 149.99 97.82 1.69 0.49 96.99 0.38 0.92 0.11 0.17 0.00 1.15 0.28 2 Q C C 109.55 5.56 18.23 24.85 114.79 -126.66 -87.79 144.20 70.65 27.65 1.69 47.67 20.13 3.18 0.43 1.45 0.00 24.02 3.12 3 E E E 103.47 9.26 17.43 27.44 117.79 -103.87 -88.11 136.80 44.56 53.61 1.82 38.27 4.21 1.09 0.78 1.18 0.00 43.69 10.77 4 V C C 19.23 18.78 12.08 30.93 121.69 -165.11 -117.44 132.34 67.01 31.25 1.74 64.49 2.05 0.73 0.82 0.87 0.00 26.64 4.41 5 S C C 77.19 4.61 19.64 25.24 99.90 172.52 -102.81 -8.60 95.85 2.96 1.19 50.44 44.18 1.71 0.45 0.58 0.00 2.15 0.49 6 D C C 74.18 4.79 20.81 26.24 111.36 80.92 -101.90 115.56 94.66 2.91 2.43 52.04 41.74 1.10 2.01 0.44 0.00 0.87 1.80 7 I H H 37.29 20.29 12.51 32.32 92.90 -157.82 -61.61 -37.24 2.48 0.01 97.52 0.49 0.41 1.48 96.02 1.59 0.00 0.00 0.00 8 K H H 127.24 3.92 20.18 25.07 91.32 56.97 -62.74 -39.79 1.12 0.00 98.88 0.12 0.09 0.83 96.85 2.11 0.00 0.00 0.00 9 K H H 92.59 5.86 21.13 27.42 91.88 49.88 -66.71 -39.14 0.55 0.01 99.44 0.09 0.05 0.37 97.21 2.28 0.00 0.01 0.00 10 F H H 5.62 24.64 15.65 40.55 91.40 52.55 -63.04 -44.07 0.27 0.00 99.73 0.05 0.02 0.15 99.34 0.45 0.00 0.00 0.00 11 I H H 29.83 17.32 20.40 37.31 91.50 50.29 -63.66 -42.31 0.27 0.00 99.73 0.03 0.01 0.18 98.96 0.81 0.00 0.00 0.00 12 E H H 103.83 2.80 25.41 27.25 91.60 50.93 -64.10 -41.38 0.66 0.00 99.34 0.05 0.03 0.51 98.40 1.02 0.00 0.00 0.00 13 I H H 22.97 14.97 19.99 35.58 91.97 50.08 -65.35 -40.91 2.00 0.00 97.99 0.07 0.10 1.81 96.72 1.29 0.01 0.00 0.00 14 C H H 4.87 24.30 14.69 39.25 91.95 54.77 -71.40 -25.61 27.80 0.16 72.04 1.93 1.63 24.51 69.45 2.27 0.05 0.06 0.10 15 R C T 131.13 7.73 20.61 28.88 92.87 63.43 -79.64 -12.15 78.10 0.39 21.51 9.74 5.60 62.07 19.15 2.99 0.01 0.17 0.27 16 R C S 95.04 9.47 13.74 24.71 113.61 99.65 -75.85 136.13 95.36 2.03 2.61 20.59 71.36 2.74 2.13 0.46 0.00 0.49 2.22 17 K C T 159.91 2.13 16.20 19.19 92.51 -125.27 -64.31 -29.57 96.45 0.21 3.34 0.91 4.99 90.97 0.86 2.02 0.01 0.10 0.14 18 D C T 101.11 4.06 17.81 22.50 95.18 49.75 -88.35 1.76 98.16 0.10 1.74 1.61 3.69 92.97 0.46 1.17 0.00 0.05 0.05 19 A C C 12.92 21.86 9.20 30.01 114.54 116.53 -76.69 136.90 83.95 11.30 4.75 79.18 3.95 1.44 1.02 3.94 0.00 9.31 1.16 20 S C C 68.27 4.43 23.08 27.88 100.43 -169.92 -95.13 -24.73 76.20 21.13 2.67 41.98 29.67 5.29 0.69 2.02 0.00 19.38 0.97 21 S E E 34.64 9.40 24.51 34.65 143.20 2.85 -158.89 157.75 23.36 73.31 3.33 14.09 6.19 3.57 0.92 2.28 0.00 72.40 0.55 22 A E E 9.23 24.80 15.42 40.36 130.99 -165.87 -138.58 142.42 11.86 85.70 2.44 9.80 1.37 0.65 1.39 0.96 0.00 85.56 0.26 23 R E E 89.51 9.11 26.70 36.39 125.33 -162.00 -123.03 138.99 3.99 94.04 1.97 3.26 0.47 0.41 1.27 0.55 0.00 93.79 0.26 24 I E E 26.18 22.23 16.89 38.94 119.29 -153.93 -107.49 130.41 4.58 93.36 2.05 3.69 0.53 0.45 1.59 0.45 0.00 93.06 0.23 25 K E E 76.18 8.88 22.64 31.99 128.71 -165.44 -125.07 144.10 8.20 90.11 1.69 6.75 0.95 0.52 1.23 0.44 0.00 89.66 0.46 26 K E E 94.55 11.98 15.24 27.61 118.68 -140.02 -98.69 133.99 25.19 73.63 1.18 21.29 3.23 0.62 0.67 0.47 0.00 72.62 1.09 27 N C C 45.57 9.64 11.31 23.04 109.11 -131.25 -89.26 116.41 77.35 22.10 0.54 71.00 4.25 0.85 0.21 0.30 0.00 22.56 0.83 28 P C T 104.90 2.65 11.87 16.31 93.46 -153.95 -64.99 -26.79 90.02 2.14 7.84 19.17 20.72 50.20 0.99 6.92 0.00 1.49 0.51 29 K C T 170.52 0.53 12.75 11.69 95.82 49.39 -77.21 -32.40 90.83 1.43 7.73 18.79 20.56 51.56 1.01 6.69 0.00 0.85 0.54 30 T C T 73.00 4.55 11.15 17.15 105.55 26.72 -107.56 1.15 92.00 1.47 6.52 27.62 22.83 41.57 0.75 5.86 0.00 0.89 0.48 31 Q C T 122.91 4.89 14.20 20.68 95.56 -126.05 53.82 34.22 96.33 2.28 1.39 31.86 23.71 40.87 0.16 1.31 0.00 1.74 0.34 32 Q C E 64.20 9.00 16.41 26.89 123.67 128.17 -106.58 146.12 56.51 42.87 0.62 38.30 15.03 3.89 0.11 0.58 0.00 40.55 1.55 33 I E E 20.62 18.14 15.69 34.73 119.43 -141.12 -106.62 132.15 16.20 83.78 0.02 14.79 0.88 0.06 0.00 0.01 0.00 83.91 0.34 34 K E E 60.60 11.06 23.50 34.99 124.99 -163.88 -117.16 138.79 3.13 96.87 0.00 2.76 0.14 0.00 0.00 0.00 0.00 97.05 0.05 35 F E E 11.65 22.87 17.62 40.54 130.15 -171.49 -129.93 145.99 0.43 99.57 0.00 0.37 0.01 0.00 0.00 0.00 0.00 99.61 0.01 36 K E E 64.71 10.31 25.34 36.21 118.50 -143.42 -106.27 129.06 0.28 99.72 0.00 0.25 0.00 0.00 0.00 0.00 0.00 99.75 0.00 37 V E E 5.90 23.85 16.98 41.46 123.01 -169.23 -119.13 134.23 0.41 99.59 0.00 0.37 0.01 0.00 0.00 0.00 0.00 99.61 0.01 38 R E E 90.51 8.46 23.29 32.26 116.83 -155.31 -108.63 124.36 3.35 96.64 0.01 2.97 0.21 0.02 0.00 0.00 0.00 96.59 0.22 39 C C C 18.71 16.78 12.96 30.02 129.23 174.64 -123.74 170.30 74.37 25.57 0.06 70.52 2.14 0.20 0.01 0.04 0.00 26.60 0.49 40 Q C S 129.14 3.02 17.37 20.98 94.74 -85.81 -62.42 -34.69 99.46 0.38 0.16 1.97 79.51 18.06 0.01 0.14 0.00 0.25 0.06 41 R C S 155.17 3.39 16.79 20.91 103.06 12.19 -103.45 -13.64 99.39 0.46 0.15 1.64 78.59 19.26 0.01 0.13 0.00 0.32 0.06 42 F E E 70.08 10.35 16.52 28.07 137.11 26.94 -145.02 153.29 33.77 66.18 0.05 27.34 4.99 0.35 0.01 0.05 0.00 66.76 0.49 43 L E E 45.81 14.71 17.90 33.12 119.99 -142.77 -111.52 130.88 2.11 97.89 0.00 1.97 0.07 0.00 0.00 0.00 0.00 97.86 0.10 44 Y E E 28.46 16.89 20.72 38.03 128.63 -173.13 -125.32 145.83 0.79 99.21 0.00 0.71 0.02 0.00 0.00 0.00 0.00 99.27 0.00 45 T E E 24.45 16.47 22.73 39.20 123.75 -157.13 -116.90 136.79 0.33 99.67 0.00 0.28 0.01 0.00 0.00 0.00 0.00 99.71 0.00 46 L E E 9.86 21.94 21.17 43.07 121.80 -160.36 -113.85 133.16 0.06 99.94 0.00 0.06 0.00 0.00 0.00 0.00 0.00 99.94 0.00 47 V E E 35.86 11.97 25.03 37.83 117.69 -154.90 -106.25 125.41 0.28 99.72 0.00 0.24 0.01 0.00 0.00 0.00 0.00 99.74 0.01 48 L E E 12.05 20.88 13.84 35.08 121.26 -164.88 -108.32 134.59 18.39 81.61 0.00 18.39 0.25 0.01 0.00 0.00 0.00 80.97 0.38 49 K C S 140.75 3.17 20.01 24.01 96.02 -158.06 -81.92 -24.33 98.42 1.55 0.02 10.35 87.42 0.77 0.00 0.01 0.00 1.39 0.06 50 D C C 73.37 4.64 18.48 23.90 115.85 49.24 -121.59 113.52 98.84 0.49 0.67 49.80 46.64 2.51 0.44 0.17 0.00 0.20 0.25 51 S H H 53.34 11.91 12.66 25.27 93.48 -147.85 -63.38 -35.45 3.39 0.01 96.61 0.53 0.54 2.11 95.02 1.79 0.00 0.00 0.00 52 D H H 107.69 1.14 20.66 19.76 91.71 54.67 -64.24 -39.98 1.89 0.00 98.11 0.16 0.16 1.46 96.38 1.84 0.00 0.00 0.00 53 K H H 79.46 7.57 18.61 27.12 92.08 48.67 -66.34 -39.70 0.91 0.00 99.08 0.14 0.07 0.61 97.38 1.79 0.00 0.00 0.00 54 A H H 4.38 22.50 11.97 34.75 91.18 52.07 -62.93 -43.07 0.43 0.00 99.57 0.08 0.03 0.24 99.35 0.31 0.00 0.00 0.00 55 E H H 97.71 4.38 21.91 26.43 91.36 51.20 -63.52 -41.28 0.45 0.00 99.55 0.04 0.02 0.33 99.27 0.35 0.00 0.00 0.00 56 K H H 113.29 2.24 22.77 23.62 91.58 50.41 -64.16 -41.97 0.42 0.00 99.57 0.03 0.02 0.32 98.68 0.94 0.00 0.00 0.00 57 L H H 12.53 19.98 15.32 35.53 91.80 49.84 -64.26 -41.89 0.35 0.00 99.65 0.03 0.01 0.26 98.59 1.11 0.00 0.00 0.00 58 K H H 74.17 16.18 16.68 32.04 91.10 54.08 -61.83 -38.88 1.46 0.00 98.54 0.07 0.05 1.22 96.90 1.75 0.00 0.00 0.00 59 Q H H 140.55 1.17 20.90 20.48 91.18 54.29 -69.30 -23.71 25.62 0.01 74.37 0.24 0.41 26.42 70.90 2.01 0.01 0.00 0.01 60 S C T 62.69 6.21 18.08 25.15 94.60 53.31 -90.73 -6.67 60.72 0.03 39.25 0.89 1.61 57.73 37.55 2.17 0.00 0.01 0.03 61 L C S 17.97 23.11 8.63 30.48 118.56 105.98 -77.12 142.99 99.60 0.30 0.10 13.30 86.19 0.15 0.07 0.01 0.00 0.05 0.22 62 P C C 42.44 8.15 16.04 26.28 114.67 -105.04 -64.05 148.80 99.91 0.06 0.03 99.17 0.64 0.13 0.01 0.01 0.00 0.02 0.04 63 P C T 107.99 3.27 14.55 19.33 93.08 -107.33 -61.18 -25.52 99.55 0.06 0.39 0.79 3.88 94.92 0.03 0.32 0.00 0.03 0.03 64 N C T 127.85 1.43 16.86 18.00 93.81 52.62 -84.72 0.87 99.41 0.12 0.48 0.96 3.53 94.94 0.03 0.45 0.00 0.08 0.02 65 L C C 27.47 20.41 8.38 27.42 119.10 108.65 -86.27 140.06 90.92 8.84 0.24 58.97 31.15 0.87 0.02 0.25 0.00 8.25 0.48 66 Q E E 115.51 2.75 22.99 25.41 114.71 -135.79 -93.39 129.59 23.81 76.05 0.14 22.69 0.86 0.19 0.02 0.11 0.00 75.73 0.40 67 I E E 47.25 21.26 11.13 31.11 122.07 -160.96 -113.79 132.72 5.13 94.86 0.01 5.04 0.15 0.01 0.00 0.00 0.00 94.55 0.25 68 K E E 103.44 5.08 20.83 26.76 124.35 -172.78 -122.65 139.22 3.08 96.91 0.00 3.02 0.10 0.01 0.00 0.00 0.00 96.65 0.22 69 D E E 86.10 9.14 16.33 26.54 113.96 -126.66 -87.61 127.95 13.07 86.91 0.02 12.54 0.48 0.04 0.00 0.02 0.00 86.46 0.45 70 V C C 38.68 15.11 11.86 27.40 117.37 -156.63 -103.84 130.76 81.35 17.48 1.17 76.29 3.35 0.78 0.33 0.75 0.00 17.84 0.67 71 P C C 75.54 4.89 16.76 22.56 113.50 -112.48 -69.24 147.79 87.18 7.26 5.55 69.64 11.66 5.84 1.71 3.74 0.00 6.33 1.08 72 K C C 115.22 8.61 11.47 21.06 108.49 -117.90 -79.63 123.60 80.76 3.96 15.28 57.44 14.43 8.87 6.91 8.36 0.00 2.22 1.76 73 R C C 151.07 3.87 12.69 18.03 102.76 92.31 -80.29 -13.55 72.43 2.31 25.27 39.91 18.94 14.24 12.11 12.48 0.01 1.13 1.18 74 N C C 95.50 4.52 11.37 17.31 102.84 54.04 -86.69 23.82 71.81 2.12 26.07 44.69 14.05 13.18 12.51 13.44 0.00 1.09 1.04 75 K C C 112.88 6.77 10.00 18.16 100.69 134.81 -77.90 -15.52 66.80 2.52 30.68 44.94 10.91 10.97 15.39 15.26 0.01 1.35 1.17 76 R C C 154.34 3.31 10.67 15.53 101.55 66.80 -81.93 -7.18 68.49 2.56 28.95 40.95 13.39 14.64 13.98 14.49 0.01 1.31 1.24 77 K C C 137.80 3.41 9.61 14.72 105.87 67.77 -85.27 34.86 74.87 2.68 22.45 42.64 15.74 17.23 9.62 12.10 0.01 1.38 1.28 78 S C C 81.31 3.25 8.76 13.80 107.56 61.31 -87.71 86.00 87.17 1.78 11.06 72.86 3.34 12.17 4.90 4.82 0.00 1.01 0.89 79 S C C 81.82 3.19 10.94 15.78 109.09 -146.97 -89.38 112.93 99.90 0.07 0.03 99.74 0.12 0.08 0.01 0.00 0.00 0.03 0.01