A0A3Q0KP04_SCHMA Loading...

Putative zinc finger protein AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KP04, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 672 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.2	Very low	35.2	Very low	228 Å²	228	145.1 Å²	145.1	100%	1.123	81%	0.812	S	S	*	*				0	110	0	-72.4	179.8	175.3	0	0	105.3
2	N	38.4	Very low	35	Very low	156 Å²	156	141.4 Å²	141.4	83%	0.834	80%	0.804	S	S	*	*			trans	-96.7	126	-134.2	-58.7	-4.5	0	0	0	110.3
3	M	34.8	Very low	34.6	Very low	176 Å²	176	139.5 Å²	139.5	87%	0.867	80%	0.797	S	S	*	*				80	101.8	59.5	-72.9	-71.3	-179.7	0	0	113
4	I	35.3	Very low	34.4	Very low	160 Å²	160	139.4 Å²	139.4	82%	0.821	80%	0.8	S	S	*	*			trans	-56	146.2	164.7	-63.1	150.9	0	0	0	110.8
5	S	36.3	Very low	34.2	Very low	117 Å²	117	133.7 Å²	133.7	82%	0.818	79%	0.785	S	S	*	*			trans	-175.4	136	138.5	-81	0	0	0	0	112.2
6	Q	38.6	Very low	34.3	Very low	166 Å²	166	137.8 Å²	137.8	78%	0.776	79%	0.793	S	S	*	*			trans	-81.3	179.4	155.7	-67	-168.1	-13.4	0	0	109.9
7	P	41	Very low	34.1	Very low	129 Å²	129	133.6 Å²	133.6	84%	0.838	79%	0.787	S	S	*	*				-142.7	151.7	114	35.3	-21.1	0	0	0	116.3
8	V	30.4	Very low	34	Very low	112 Å²	112	135.8 Å²	135.8	68%	0.679	79%	0.793	S	S	*	*			trans	-84	156.5	159	172.3	0	0	0	0	109.1
9	L	35.8	Very low	33.8	Very low	159 Å²	159	133.9 Å²	133.9	83%	0.832	79%	0.788	S	S	*	*			trans	163.3	93.3	147.9	-87.2	160.8	0	0	0	107.3
10	S	29.7	Very low	33.9	Very low	85 Å²	85	135.5 Å²	135.5	59%	0.594	79%	0.792	S	S	*	*				75	113	79.8	74.4	0	0	0	0	116.6
11	S	28.8	Very low	33.8	Very low	108 Å²	108	133.4 Å²	133.4	76%	0.755	78%	0.784	S	S	*	*			trans	74.3	130.5	138.6	66.2	0	0	0	0	122.8
12	S	32.6	Very low	33.8	Very low	101 Å²	101	129.5 Å²	129.5	71%	0.706	77%	0.768	S	S	*	*				111.6	102.8	123.6	73.1	0	0	0	0	120.7
13	T	30.2	Very low	33.3	Very low	117 Å²	117	129.4 Å²	129.4	72%	0.718	77%	0.767	S	S	*	*				79.1	116.1	122.2	56.9	0	0	0	0	122.6
14	T	31.5	Very low	33.3	Very low	137 Å²	137	130.5 Å²	130.5	84%	0.84	77%	0.768	S	S	*	*				67.8	129.1	129	60.7	0	0	0	0	121.6
15	G	31.4	Very low	33.4	Very low	55 Å²	55	128.9 Å²	128.9	57%	0.567	77%	0.766	S	S	*	*				137.3	115.2	115.2	0	0	0	0	0	116.8
16	H	36.3	Very low	33.1	Very low	198 Å²	198	129 Å²	129	92%	0.917	76%	0.761	S	S	*	*			trans	63.4	136.8	161.6	-49.3	-84.9	0	0	0	116.2
17	G	30.4	Very low	32.8	Very low	67 Å²	67	126.5 Å²	126.5	69%	0.691	76%	0.76	S	S	*	*			cis	109.2	118.5	10.4	0	0	0	0	0	110.6
18	L	33.4	Very low	32.2	Very low	173 Å²	173	127.7 Å²	127.7	91%	0.906	76%	0.757	S	S	*	*			trans	178.9	128.8	148.2	-99.4	163	0	0	0	110.9
19	S	30.2	Very low	32.2	Very low	100 Å²	100	129.3 Å²	129.3	70%	0.699	77%	0.767	S	S	*	*			trans	-81.8	160.4	164.7	51.6	0	0	0	0	111.4
20	I	34.9	Very low	31.9	Very low	166 Å²	166	126.7 Å²	126.7	85%	0.851	76%	0.762	S	S	*	*			trans	-157.6	146.5	141.4	-98.9	142	0	0	0	109.4
21	S	32	Very low	32	Very low	91 Å²	91	131.7 Å²	131.7	64%	0.636	78%	0.776	S	S	*	*			trans	-86.4	171.6	-178.9	48.8	0	0	0	0	112.9
22	D	37.3	Very low	32.1	Very low	146 Å²	146	132.4 Å²	132.4	78%	0.781	78%	0.778	S	S	*	*				179.3	141.3	109.8	-84.6	-9.8	0	0	0	112.9
23	N	29.1	Very low	32	Very low	154 Å²	154	133.5 Å²	133.5	82%	0.824	78%	0.781	S	S	*	*			trans	-90.3	141.2	176.4	-66.4	-52.8	0	0	0	110.7
24	F	34.8	Very low	31.8	Very low	200 Å²	200	136.2 Å²	136.2	88%	0.877	79%	0.79	S	S	*	*			trans	-157.9	111.4	149.5	-100.2	-70.7	0	0	0	114.2
25	T	36.1	Very low	31.6	Very low	126 Å²	126	136.3 Å²	136.3	77%	0.773	79%	0.785	S	S	*	*			trans	59.9	123.7	137.5	-56	0	0	0	0	123.2
26	T	31	Very low	31.3	Very low	118 Å²	118	141.8 Å²	141.8	72%	0.724	80%	0.801	S	S	*	*			trans	-71.5	160	169.9	60.2	0	0	0	0	113.8
27	P	32.5	Very low	30.9	Very low	115 Å²	115	138.2 Å²	138.2	75%	0.747	79%	0.793	S	S	*	*				-148.9	139	80.7	36.3	-16.7	0	0	0	118
28	I	28.1	Very low	30.8	Very low	153 Å²	153	141.9 Å²	141.9	79%	0.785	80%	0.802	S	S	*	*			trans	29	104.7	135.2	-46.8	171.6	0	0	0	118.3
29	V	31.3	Very low	30.4	Very low	146 Å²	146	137.2 Å²	137.2	89%	0.885	80%	0.795	S	S	*	*			trans	-139	138.1	138.3	177.8	0	0	0	0	108.8
30	S	29.5	Very low	30.4	Very low	104 Å²	104	140.7 Å²	140.7	73%	0.727	81%	0.805	S	S	*	*			trans	-82	132.1	-166.9	-37.3	0	0	0	0	114.6
31	Q	30.7	Very low	30.2	Very low	191 Å²	191	140.3 Å²	140.3	89%	0.893	80%	0.8	S	S	*	*			trans	-164.5	138.6	144.9	-109.7	168.4	37.1	0	0	110
32	P	31.4	Very low	30	Very low	122 Å²	122	141.8 Å²	141.8	79%	0.792	80%	0.8	S	S	*	*			trans	-80.4	140.5	-171.8	31.6	-34.4	0	0	0	112.8
33	T	29.2	Very low	29.8	Very low	124 Å²	124	140.4 Å²	140.4	76%	0.761	80%	0.797	S	S	*	*			trans	-64.4	127.5	174.9	15.5	0	0	0	0	112.3	L35	T33-L35 HydrophobicContact CG2-CD1 4.49Å; T33-L35 PolarHBondContact O-N 3.44Å
34	L	26.5	Very low	29.6	Very low	175 Å²	175	139.5 Å²	139.5	92%	0.916	79%	0.792	S	S	*	*			trans	-71.9	101.7	158.5	-70	172.5	0	0	0	108.4
35	L	27.6	Very low	29.4	Very low	139 Å²	139	140.5 Å²	140.5	73%	0.728	79%	0.791	S	S	*	*			trans	-102.5	124	165.7	-118.1	79.2	0	0	0	109.5	T33 T37	T33-L35 HydrophobicContact CG2-CD1 4.49Å; T33-L35 PolarHBondContact O-N 3.44Å; L35-T37 PolarHBondContact O-N 2.78Å; L35-T37 VanDerWaalsContact O-N 3.15Å
36	N	25.3	Very low	28.9	Very low	169 Å²	169	142.7 Å²	142.7	90%	0.904	79%	0.793	S	S	*	*			trans	-66.2	110.3	179.4	-72.3	-32.9	0	0	0	111
37	T	28.3	Very low	28.8	Very low	124 Å²	124	147.7 Å²	147.7	76%	0.761	80%	0.8	S	S	*	*			trans	-124.9	111.9	167.3	40.2	0	0	0	0	110.9	L35	L35-T37 PolarHBondContact O-N 2.78Å; L35-T37 VanDerWaalsContact O-N 3.15Å
38	V	27.7	Very low	28.5	Very low	144 Å²	144	150.1 Å²	150.1	87%	0.873	81%	0.806	S	S	*	*			trans	31.5	93.6	151.6	-166.9	0	0	0	0	117
39	G	25.5	Very low	28.5	Very low	74 Å²	74	147.9 Å²	147.9	76%	0.763	80%	0.801	S	S	*	*			trans	-121.9	91.2	164.4	0	0	0	0	0	111.4
40	L	30.1	Very low	28.2	Very low	173 Å²	173	151.7 Å²	151.7	91%	0.906	80%	0.801	S	S	*	*			trans	-88	110.8	165.7	-92.5	168.9	0	0	0	108.9
41	H	31.4	Very low	28.1	Very low	159 Å²	159	154.4 Å²	154.4	74%	0.736	81%	0.806	S	S	*	*			trans	-69.4	143.7	-179.5	-104.3	-87.9	0	0	0	113.2
42	D	27.4	Very low	27.9	Very low	122 Å²	122	155.2 Å²	155.2	65%	0.652	81%	0.807	S	S	*	*			trans	24.2	112.7	143	-58.9	-46.5	0	0	0	119.6
43	V	31.9	Very low	27.6	Very low	116 Å²	116	157 Å²	157	70%	0.703	81%	0.81	S	S	*	*			trans	-131.3	99.1	144.5	-171.5	0	0	0	0	109.3	Y45	V43-Y45 HydrophobicContact CG1-CD2 4.04Å; V43-Y45 HydrophobicContact CG1-CE2 3.74Å; V43-Y45 PolarHBondContact O-N 3.41Å
44	N	26	Very low	27.5	Very low	135 Å²	135	156.4 Å²	156.4	72%	0.722	81%	0.811	S	S	*	*			trans	-61.1	125.3	173.7	-75.6	-41.6	0	0	0	111.2
45	Y	29.7	Very low	27.5	Very low	222 Å²	222	157.5 Å²	157.5	87%	0.871	81%	0.808	S	S	*	*			trans	-114.9	51.8	168.1	-91.6	-83.5	0	0	0	111.7	V43 Y47	V43-Y45 HydrophobicContact CG1-CD2 4.04Å; V43-Y45 HydrophobicContact CG1-CE2 3.74Å; V43-Y45 PolarHBondContact O-N 3.41Å; Y45-Y47 PolarHBondContact O-N 3.01Å
46	E	26.5	Very low	27.5	Very low	172 Å²	172	159.1 Å²	159.1	80%	0.804	82%	0.817	S	S	*	*			trans	-74.4	101.9	155.4	-70.6	-169.6	135.1	0	0	108.8
47	Y	28.9	Very low	27.8	Very low	223 Å²	223	158.4 Å²	158.4	88%	0.875	81%	0.813	S	S	*	*			trans	-172.3	79.6	147.7	-112.7	-74.7	0	0	0	111.2	Y45 P49	Y45-Y47 PolarHBondContact O-N 3.01Å; Y47-P49 WeakPolarHBondContact O-CD 2.99Å
48	L	24.9	Very low	27.8	Very low	165 Å²	165	157.2 Å²	157.2	86%	0.864	81%	0.807	S	S	*	*			trans	-100.3	112.6	165.8	-84.8	172.2	0	0	0	110.3	Y50	L48-Y50 PolarHBondContact O-N 3.04Å
49	P	28.8	Very low	27.8	Very low	107 Å²	107	157.2 Å²	157.2	70%	0.695	80%	0.802	S	S	*	*			trans	-91.8	97.2	166.6	32.1	-28.6	0	0	0	111.7	Y47 I51	Y47-P49 WeakPolarHBondContact O-CD 2.99Å; P49-I51 PolarHBondContact O-N 3.33Å
50	Y	25	Very low	28.1	Very low	226 Å²	226	160.7 Å²	160.7	89%	0.886	80%	0.804	S	S	*	*			trans	26.2	87.1	140	-70.4	-95.7	0	0	0	119.6	L48	L48-Y50 PolarHBondContact O-N 3.04Å
51	I	27.7	Very low	28	Very low	161 Å²	161	160.9 Å²	160.9	83%	0.826	80%	0.8	S	S	*	*			trans	-145.8	65.9	145	-44.8	179.1	0	0	0	111.4	P49	P49-I51 PolarHBondContact O-N 3.33Å
52	F	25.6	Very low	27.9	Very low	207 Å²	207	160.8 Å²	160.8	91%	0.908	80%	0.799	S	S	*	*			trans	-150.1	79.4	163.7	-98.4	-76.2	0	0	0	110.8
53	N	26.2	Very low	28.1	Very low	161 Å²	161	161.9 Å²	161.9	86%	0.861	80%	0.8	S	S	*	*			trans	-168.3	75.6	161.3	-105.2	-16.9	0	0	0	110.3
54	S	26.6	Very low	28	Very low	110 Å²	110	163.6 Å²	163.6	77%	0.769	80%	0.8	S	S	*	*	S	Bend	trans	-154.9	15.7	174.9	-69	0	0	0	0	114.7
55	F	26.6	Very low	28.3	Very low	199 Å²	199	164.3 Å²	164.3	87%	0.873	80%	0.799	S	S	*	*	S	Bend	trans	-144.4	143.9	168.1	-71.4	-80.8	0	0	0	107.9
56	L	28.3	Very low	28.3	Very low	172 Å²	172	159.1 Å²	159.1	90%	0.901	79%	0.787	S	S	*	*	S	Bend	trans	81.6	48.5	-176.8	-48	175.5	0	0	0	117.9
57	N	30.1	Very low	28.6	Very low	155 Å²	155	157.1 Å²	157.1	83%	0.829	78%	0.782	S	S	*	*			trans	-160.8	112.8	135.7	-137.5	-4.5	0	0	0	112.8
58	P	28.5	Very low	28.6	Very low	98 Å²	98	151 Å²	151	64%	0.636	77%	0.77	S	S	*	*			trans	-88.7	143	162.2	33.5	-28.1	0	0	0	110.9
59	N	27.4	Very low	28.8	Very low	144 Å²	144	149.7 Å²	149.7	77%	0.77	76%	0.764	S	S	*	*			trans	101	142.1	166.8	-50.7	-33.2	0	0	0	118.2
60	N	32	Very low	28.9	Very low	148 Å²	148	151.2 Å²	151.2	79%	0.791	77%	0.766	S	S	*	*			trans	84	72.2	163.5	-58	-8.2	0	0	0	120
61	Q	29.7	Very low	29.1	Very low	177 Å²	177	146.5 Å²	146.5	83%	0.827	76%	0.761	S	S	*	*				45.1	115.9	118	-65.1	-174.3	-14.5	0	0	122.3
62	H	29.3	Very low	29.1	Very low	157 Å²	157	145 Å²	145	73%	0.727	76%	0.762	S	S	*	*			trans	79.8	129.7	130.8	-81.6	-85.7	0	0	0	124.9
63	H	31	Very low	29.4	Very low	145 Å²	145	143.4 Å²	143.4	67%	0.671	76%	0.762	S	S	*	*			trans	72.4	116.7	158	-69	-51.1	0	0	0	119
64	H	29.6	Very low	29.3	Very low	151 Å²	151	142.2 Å²	142.2	70%	0.699	76%	0.756	S	S	*	*				60.8	138.2	81.7	-73.8	-22.3	0	0	0	112.2
65	Q	31.8	Very low	29.6	Very low	151 Å²	151	145.8 Å²	145.8	71%	0.706	76%	0.76	S	S	*	*			cis	-174.8	164.2	3	-110.5	171.9	-58.3	0	0	106.7
66	N	29.3	Very low	29.6	Very low	113 Å²	113	144.3 Å²	144.3	60%	0.604	76%	0.756	S	S	*	*			cis	-163.6	173.9	-3.6	-147.5	52.9	0	0	0	108.9
67	D	33.8	Very low	29.7	Very low	130 Å²	130	143.9 Å²	143.9	70%	0.695	75%	0.753	S	S	*	*			trans	63.4	159.1	156.1	-60	-43	0	0	0	121.2
68	C	28.9	Very low	29.6	Very low	94 Å²	94	143.6 Å²	143.6	64%	0.635	75%	0.75	S	S	*	*			cis	-169	146.1	-37.6	-105.1	0	0	0	0	109.5
69	N	28.6	Very low	29.5	Very low	137 Å²	137	144.1 Å²	144.1	73%	0.733	75%	0.754	S	S	*	*			trans	63	119.1	145.5	-62.8	-13.9	0	0	0	123.5
70	N	30.6	Very low	29.6	Very low	139 Å²	139	144.9 Å²	144.9	74%	0.743	76%	0.758	S	S	*	*				135.8	116.1	110.8	-85.1	-8.6	0	0	0	119.8
71	T	29.7	Very low	29.3	Very low	127 Å²	127	146 Å²	146	78%	0.779	76%	0.764	S	S	*	*			trans	63.4	124.2	138.5	55.2	0	0	0	0	122.4
72	P	27.7	Very low	29.2	Very low	130 Å²	130	142.2 Å²	142.2	84%	0.844	76%	0.757	S	S	*	*			trans	-94.5	165.7	169	38.7	-33.8	0	0	0	113
73	L	30.9	Very low	29.2	Very low	173 Å²	173	142.3 Å²	142.3	91%	0.906	76%	0.763	S	S	*	*			trans	-136.9	139.8	172.9	-143.2	147.3	0	0	0	110.9
74	N	25.8	Very low	28.9	Very low	137 Å²	137	143.7 Å²	143.7	73%	0.733	77%	0.773	S	S	*	*			trans	-97.8	142.1	-163.4	-157.8	-2.9	0	0	0	111.5
75	H	32.9	Very low	28.7	Very low	184 Å²	184	143.7 Å²	143.7	85%	0.852	78%	0.778	S	S	*	*			trans	-160.5	122.3	152.6	-105.8	-59.1	0	0	0	112.3
76	Q	26.5	Very low	28.4	Very low	168 Å²	168	143.1 Å²	143.1	79%	0.785	78%	0.78	S	S	*	*			trans	-74	155.9	170.6	-63	172.3	-25.2	0	0	111.6
77	L	28.8	Very low	28.4	Very low	163 Å²	163	144.2 Å²	144.2	85%	0.853	78%	0.784	S	S	*	*			trans	-167.4	98.1	140.8	-104.5	160.6	0	0	0	111.9
78	I	28.3	Very low	28	Very low	149 Å²	149	146.2 Å²	146.2	76%	0.764	80%	0.795	S	S	*	*			trans	43.2	129.7	140.5	-54.2	176.8	0	0	0	120
79	P	27.6	Very low	27.9	Very low	109 Å²	109	145.1 Å²	145.1	71%	0.708	79%	0.793	S	S	*	*			trans	-91.3	159.5	-176.8	38.1	-36.5	0	0	0	114.7
80	N	29	Very low	27.9	Very low	160 Å²	160	146.2 Å²	146.2	86%	0.856	80%	0.798	S	S	*	*			trans	-123.6	124.6	165.2	-81.8	-28.5	0	0	0	110.5
81	N	25.7	Very low	27.8	Very low	171 Å²	171	148 Å²	148	91%	0.914	80%	0.802	S	S	*	*			trans	-87.9	109.1	171.5	-85.2	-16	0	0	0	110.5
82	S	26.4	Very low	27.8	Very low	98 Å²	98	148.2 Å²	148.2	69%	0.685	80%	0.797	S	S	*	*			trans	-162.3	103.7	155.7	57.2	0	0	0	0	109
83	D	29.4	Very low	28.1	Very low	159 Å²	159	145.2 Å²	145.2	85%	0.85	78%	0.778	S	S	*	*			trans	177.3	74.6	143.8	-87.9	-16.4	0	0	0	108.9	L85	D83-L85 PolarHBondContact O-N 3.46Å; D83-L85 VanDerWaalsContact O-N 3.14Å
84	I	25.7	Very low	28.1	Very low	174 Å²	174	143.9 Å²	143.9	89%	0.892	77%	0.77	S	S	*	*			trans	-69.7	99.9	157	-62.8	170.6	0	0	0	105.8
85	L	25.6	Very low	28.1	Very low	152 Å²	152	145 Å²	145	80%	0.796	77%	0.768	S	S	*	*			trans	-175.1	140.5	156	-101.6	167.9	0	0	0	109.9	D83	D83-L85 PolarHBondContact O-N 3.46Å; D83-L85 VanDerWaalsContact O-N 3.14Å
86	N	26.2	Very low	28	Very low	139 Å²	139	143.2 Å²	143.2	74%	0.743	76%	0.758	S	S	*	*			trans	57.8	94.7	174.4	-73.2	-38.7	0	0	0	118.1
87	L	27.5	Very low	28.1	Very low	135 Å²	135	142 Å²	142	71%	0.707	75%	0.754	S	S	*	*			trans	-149.1	62.9	130.7	-140.3	71.1	0	0	0	114.1	A89 L90	L87-A89 HydrophobicContact CD1-CB 4.49Å; L87-A89 HydrophobicContact CG-CB 4.31Å; L87-A89 PolarHBondContact O-N 3.48Å; L87-L90 HydrophobicContact CD2-CD1 4.06Å
88	N	26.3	Very low	28.2	Very low	173 Å²	173	140 Å²	140	93%	0.925	74%	0.743	S	S	*	*			trans	-67.7	55.3	158	-77.6	-19.7	0	0	0	110.8
89	A	27.5	Very low	28.3	Very low	71 Å²	71	138.1 Å²	138.1	59%	0.587	73%	0.733	S	S	*	*			trans	-165.5	53.8	-170.8	0	0	0	0	0	114	L87	L87-A89 HydrophobicContact CD1-CB 4.49Å; L87-A89 HydrophobicContact CG-CB 4.31Å; L87-A89 PolarHBondContact O-N 3.48Å
90	L	27.8	Very low	28.5	Very low	160 Å²	160	136.3 Å²	136.3	84%	0.838	73%	0.728	S	S	*	*			trans	-157.9	33.3	163.1	-111.4	158.7	0	0	0	114.6	L87 I92	L87-L90 HydrophobicContact CD2-CD1 4.06Å; L90-I92 PolarHBondContact O-N 2.88Å
91	Q	28	Very low	28.5	Very low	177 Å²	177	135.9 Å²	135.9	83%	0.827	73%	0.725	S	S	*	*			trans	-85.8	106.2	173.1	-162.3	178.3	32	0	0	110.5
92	I	30.2	Very low	28.8	Very low	131 Å²	131	137.9 Å²	137.9	67%	0.672	72%	0.72	S	S	*	*			trans	66.6	124.8	154	-62.9	173.8	0	0	0	114.8	L90	L90-I92 PolarHBondContact O-N 2.88Å
93	P	33	Very low	28.9	Very low	67 Å²	67	139.5 Å²	139.5	44%	0.435	72%	0.721	S	S	.	*				-159.9	87.7	85.5	42.5	-19.7	0	0	0	118.3	F95 K96	P93-F95 PolarHBondContact O-N 2.06Å; P93-K96 HydrophobicContact CB-CB 3.61Å; P93-K96 HydrophobicContact CB-CD 3.83Å; P93-K96 HydrophobicContact CB-CG 3.6Å; P93-K96 HydrophobicContact CG-CB 3.89Å; P93-K96 HydrophobicContact CG-CD 3.89Å; P93-K96 HydrophobicContact CG-CG 4.11Å; P93-K96 PolarHBondContact O-N 2.93Å; P93-K96 VanDerWaalsContact O-N 3.15Å
94	I	30.7	Very low	28.9	Very low	145 Å²	145	139.1 Å²	139.1	74%	0.744	72%	0.719	S	S	*	*	H	α-helix	trans	-56.7	-32.1	153.7	-64.5	176	0	0	0	109.8	K96 M97	I94-K96 PolarHBondContact O-N 3.01Å; I94-M97 PolarHBondContact O-N 3.15Å
95	F	27	Very low	29	Very low	160 Å²	160	138.9 Å²	138.9	70%	0.702	71%	0.712	S	S	*	*	H	α-helix	trans	-69	-18.6	176	-126.9	-95.3	0	0	0	115.8	P93 I99	P93-F95 PolarHBondContact O-N 2.06Å; F95-I99 HydrophobicContact CD1-CD1 4.32Å
96	K	30.3	Very low	29.2	Very low	146 Å²	146	138.4 Å²	138.4	64%	0.635	71%	0.707	S	S	*	*	H	α-helix	trans	-88.9	-23.6	173.9	-72.6	179	179.8	167.2	0	112.6	P93 I94 I98 I99 A100	P93-K96 HydrophobicContact CB-CB 3.61Å; P93-K96 HydrophobicContact CB-CD 3.83Å; P93-K96 HydrophobicContact CB-CG 3.6Å; P93-K96 HydrophobicContact CG-CB 3.89Å; P93-K96 HydrophobicContact CG-CD 3.89Å; P93-K96 HydrophobicContact CG-CG 4.11Å; P93-K96 PolarHBondContact O-N 2.93Å; P93-K96 VanDerWaalsContact O-N 3.15Å; I94-K96 PolarHBondContact O-N 3.01Å; K96-I98 PolarHBondContact O-N 3.35Å; K96-I99 PolarHBondContact O-N 2.82Å; K96-A100 WeakPolarHBondContact O-CB 3.36Å; K96-A100 PolarHBondContact O-N 3.45Å
97	M	29.7	Very low	29.1	Very low	144 Å²	144	138.2 Å²	138.2	71%	0.709	71%	0.706	S	S	*	*	H	α-helix	trans	-67.1	-28.8	178	-161.9	168.6	70.6	0	0	112.2	I94	I94-M97 PolarHBondContact O-N 3.15Å
98	I	30.2	Very low	29	Very low	121 Å²	121	138.4 Å²	138.4	62%	0.621	71%	0.708	S	S	*	*	H	α-helix	trans	-81.1	-20	177.5	-61	174.2	0	0	0	112.3	K96	K96-I98 PolarHBondContact O-N 3.35Å
99	I	31.3	Very low	29	Very low	108 Å²	108	134.9 Å²	134.9	55%	0.554	70%	0.697	S	S	*	*	H	α-helix	trans	-102.9	-33.4	-178.7	-60.9	177.5	0	0	0	112.1	F95 K96 N101	F95-I99 HydrophobicContact CD1-CD1 4.32Å; K96-I99 PolarHBondContact O-N 2.82Å; I99-N101 PolarHBondContact O-N 3.19Å
100	A	30.2	Very low	29.1	Very low	72 Å²	72	138.9 Å²	138.9	60%	0.595	71%	0.706	S	S	*	*	H	α-helix	trans	-71.3	-28	-178.7	0	0	0	0	0	113.7	K96 R102	K96-A100 WeakPolarHBondContact O-CB 3.36Å; K96-A100 PolarHBondContact O-N 3.45Å; A100-R102 PolarHBondContact O-N 3.37Å; A100-R102 VanDerWaalsContact O-N 3.15Å
101	N	30.6	Very low	29.1	Very low	150 Å²	150	137.9 Å²	137.9	80%	0.802	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.4	3.7	-179.1	-113.8	-4.8	0	0	0	114.6	I99	I99-N101 PolarHBondContact O-N 3.19Å
102	R	31.8	Very low	29	Very low	214 Å²	214	135.9 Å²	135.9	81%	0.808	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.7	-16.7	178.1	-102.1	-179.8	162.4	123.2	-4.2	114.8	A100	A100-R102 PolarHBondContact O-N 3.37Å; A100-R102 VanDerWaalsContact O-N 3.15Å
103	N	28.2	Very low	28.9	Very low	131 Å²	131	136.7 Å²	136.7	70%	0.701	70%	0.701	S	S	*	*	S	Bend	trans	-133	82.5	-172.8	-68.5	-26.8	0	0	0	111.4
104	N	28.6	Very low	28.5	Very low	151 Å²	151	140.8 Å²	140.8	81%	0.807	72%	0.72	S	S	*	*			trans	-178.8	120.1	137.3	-97	-45.4	0	0	0	115
105	K	28.8	Very low	28.5	Very low	170 Å²	170	140 Å²	140	74%	0.739	72%	0.724	S	S	*	*			trans	76.6	129.2	138.8	-82.7	178.7	172.5	176.5	0	122.8
106	M	28.3	Very low	28.4	Very low	142 Å²	142	140.2 Å²	140.2	70%	0.7	73%	0.729	S	S	*	*			trans	73.2	109.8	163.2	-44.1	-40	-168.8	0	0	115.3
107	N	25.1	Very low	28.4	Very low	134 Å²	134	141 Å²	141	72%	0.717	74%	0.739	S	S	*	*				53.5	112	68.8	-62.8	11.1	0	0	0	109.7
108	D	26	Very low	28.1	Very low	139 Å²	139	140.5 Å²	140.5	74%	0.743	74%	0.739	S	S	*	*			cis	-161.3	155.6	44.2	-86.9	-50	0	0	0	114.8
109	S	26.3	Very low	27.9	Very low	100 Å²	100	143 Å²	143	70%	0.699	75%	0.75	S	S	*	*			trans	73.9	149.8	149.5	70.9	0	0	0	0	121.7
110	I	28.7	Very low	27.6	Very low	154 Å²	154	143.3 Å²	143.3	79%	0.79	76%	0.757	S	S	*	*			trans	73.1	70.1	176.5	-42.8	172	0	0	0	114
111	I	27.1	Very low	27.4	Very low	140 Å²	140	149.3 Å²	149.3	72%	0.718	77%	0.772	S	S	*	*				69.5	118.8	65.5	-58.7	175.1	0	0	0	114.5
112	N	27.2	Very low	27.2	Very low	135 Å²	135	151.8 Å²	151.8	72%	0.722	78%	0.776	S	S	*	*			trans	73.4	88.6	161.1	-66	-5.8	0	0	0	120.5
113	N	27.6	Very low	26.9	Very low	147 Å²	147	149.5 Å²	149.5	79%	0.786	78%	0.78	S	S	*	*				161.4	88.1	97.5	-82.2	-22.8	0	0	0	112.5
114	N	25	Very low	26.7	Very low	154 Å²	154	148.6 Å²	148.6	82%	0.824	78%	0.784	S	S	*	*			trans	-148.5	124.3	164	-99.1	-31.1	0	0	0	108.8	M116	N114-M116 PolarHBondContact O-N 3.45Å
115	P	30.5	Very low	26.5	Very low	129 Å²	129	149.2 Å²	149.2	84%	0.838	78%	0.782	S	S	*	*			trans	-80.5	94.1	168	31.8	-29.8	0	0	0	109.1
116	M	24.6	Very low	26.3	Very low	164 Å²	164	148.2 Å²	148.2	81%	0.808	78%	0.784	S	S	*	*			trans	-76.2	139	156.4	-71.8	-147.4	79.5	0	0	109.2	N114	N114-M116 PolarHBondContact O-N 3.45Å
117	I	30.3	Very low	26.2	Very low	163 Å²	163	149.5 Å²	149.5	84%	0.836	79%	0.794	S	S	*	*			trans	-115.7	120.6	158.2	-65.7	-177.9	0	0	0	107.6
118	N	24.6	Very low	26.1	Very low	133 Å²	133	148.4 Å²	148.4	71%	0.711	80%	0.797	S	S	*	*			trans	-66.2	164.5	174.1	-92.4	-35.2	0	0	0	112.1
119	M	25.4	Very low	26.1	Very low	174 Å²	174	146 Å²	146	86%	0.857	79%	0.791	S	S	*	*				161.6	92.2	129.3	-79.8	-90.5	-169	0	0	107.3
120	T	25.4	Very low	26	Very low	114 Å²	114	150.3 Å²	150.3	70%	0.699	80%	0.798	S	S	*	*				51.7	105.4	98	60.5	0	0	0	0	114.8	K122	T120-K122 PolarHBondContact O-N 3.31Å
121	H	26.1	Very low	26.1	Very low	197 Å²	197	148 Å²	148	91%	0.912	79%	0.791	S	S	*	*			trans	-53.1	132.5	166	-73.5	-100.7	0	0	0	111.8
122	K	26.4	Very low	26.1	Very low	202 Å²	202	149.1 Å²	149.1	88%	0.878	80%	0.798	S	S	*	*			trans	-150.9	137	146.4	-105.4	-179.4	-174.1	-178.9	0	110.2	T120	T120-K122 PolarHBondContact O-N 3.31Å
123	N	23.9	Very low	26.3	Very low	166 Å²	166	150.9 Å²	150.9	89%	0.888	80%	0.8	S	S	*	*			trans	-48.8	130.3	-179.2	-43.1	-16.5	0	0	0	113.4
124	S	25	Very low	26.5	Very low	112 Å²	112	147.3 Å²	147.3	78%	0.783	79%	0.786	S	S	*	*				-164.9	160.6	119.3	67.2	0	0	0	0	109.8
125	E	24.9	Very low	27.1	Very low	164 Å²	164	145.8 Å²	145.8	77%	0.766	78%	0.777	S	S	*	*			trans	-59.8	164	171.4	-60.4	124	162.4	0	0	112.5
126	N	25	Very low	27.3	Very low	149 Å²	149	143.9 Å²	143.9	80%	0.797	76%	0.763	S	S	*	*			trans	115.5	129.1	162.2	-58.8	-52.7	0	0	0	117	S128	N126-S128 PolarHBondContact O-N 3.45Å
127	N	24.7	Very low	27.6	Very low	169 Å²	169	138.8 Å²	138.8	90%	0.904	74%	0.744	S	S	*	*			trans	-30.2	113.9	173.1	-62.9	-28.7	0	0	0	114.9
128	S	24.4	Very low	27.9	Very low	111 Å²	111	134.9 Å²	134.9	78%	0.776	73%	0.731	S	S	*	*			trans	-154.8	153	152.8	49.8	0	0	0	0	112	N126	N126-S128 PolarHBondContact O-N 3.45Å
129	S	25.7	Very low	28.4	Very low	88 Å²	88	132.6 Å²	132.6	62%	0.615	72%	0.718	S	S	*	*			trans	-56.8	-176.9	174.4	47.8	0	0	0	0	114.8
130	F	24.4	Very low	29.1	Very low	192 Å²	192	127 Å²	127	84%	0.842	70%	0.695	S	S	*	*			trans	86.8	137.4	173.3	-53.4	-78.4	0	0	0	114.7
131	T	30.7	Very low	29.7	Very low	105 Å²	105	130.7 Å²	130.7	64%	0.644	70%	0.696	S	S	*	*			cis	-134.8	139.7	13.4	46.5	0	0	0	0	112.6	F133	T131-F133 PolarHBondContact O-N 3.1Å
132	N	27.3	Very low	30.1	Very low	164 Å²	164	124.5 Å²	124.5	88%	0.877	68%	0.678	S	S	*	*			trans	-75.3	116.4	168.1	-77	-29.8	0	0	0	110.1	S134	N132-S134 PolarHBondContact O-N 3.5Å
133	F	31.4	Very low	30.6	Very low	172 Å²	172	118.2 Å²	118.2	75%	0.754	65%	0.654	S	S	*	*			trans	-67.5	98.7	175.9	-97	-96.4	0	0	0	111.4	T131 L135	T131-F133 PolarHBondContact O-N 3.1Å; F133-L135 HydrophobicContact CD1-CD1 4.38Å; F133-L135 PolarHBondContact O-N 2.81Å
134	S	32.1	Very low	31.4	Very low	71 Å²	71	113.8 Å²	113.8	50%	0.497	64%	0.636	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.8	50	179.6	176.5	0	0	0	0	113.5	N132 S137	N132-S134 PolarHBondContact O-N 3.5Å; S134-S137 WeakPolarHBondContact OG-CB 3.44Å; S134-S137 PolarHBondContact OG-OG 3.47Å
135	L	35.7	Very low	32.3	Very low	123 Å²	123	112.9 Å²	112.9	64%	0.644	63%	0.629	S	S	*	*	H	α-helix	trans	-68.9	-36.5	171.4	-77.2	164.2	0	0	0	111.5	F133 S137 S138 L139	F133-L135 HydrophobicContact CD1-CD1 4.38Å; F133-L135 PolarHBondContact O-N 2.81Å; L135-S137 PolarHBondContact O-N 3.13Å; L135-S138 PolarHBondContact O-N 3.17Å; L135-L139 PolarHBondContact O-N 3.3Å
136	T	35	Very low	32.9	Very low	88 Å²	88	111.1 Å²	111.1	54%	0.54	63%	0.625	S	S	.	*	H	α-helix	trans	-61.1	-41.7	-178.6	-28.8	0	0	0	0	112.6	S138 L139 T140 L186	T136-S138 PolarHBondContact O-N 2.71Å; T136-L139 PolarHBondContact O-N 3.2Å; T136-T140 WeakPolarHBondContact O-CB 3.14Å; T136-T140 PolarHBondContact O-N 2.81Å; T136-T140 PolarHBondContact O-OG1 2.79Å; T136-L186 HydrophobicContact CG2-CD1 4.34Å
137	S	32.3	Very low	33.8	Very low	57 Å²	57	108.2 Å²	108.2	40%	0.399	61%	0.613	S	S	.	*	H	α-helix	trans	-66	-38.4	-176.4	-45.7	0	0	0	0	112.7	S134 L135 R141	S134-S137 WeakPolarHBondContact OG-CB 3.44Å; S134-S137 PolarHBondContact OG-OG 3.47Å; L135-S137 PolarHBondContact O-N 3.13Å; S137-R141 WeakPolarHBondContact O-CB 3.48Å; S137-R141 PolarHBondContact O-N 3.4Å
138	S	34.9	Very low	34.6	Very low	82 Å²	82	106.3 Å²	106.3	57%	0.573	60%	0.602	S	S	*	*	H	α-helix	trans	-71.4	-39.2	178.3	-62.4	0	0	0	0	111.5	L135 T136 R141 A142	L135-S138 PolarHBondContact O-N 3.17Å; T136-S138 PolarHBondContact O-N 2.71Å; S138-R141 PolarHBondContact O-N 2.79Å; S138-A142 WeakPolarHBondContact O-CB 3.49Å; S138-A142 PolarHBondContact O-N 3.5Å
139	L	35.5	Very low	35.4	Very low	84 Å²	84	104 Å²	104	44%	0.44	59%	0.586	S	S	.	*	H	α-helix	trans	-65.6	-45.4	174.7	-156	89.9	0	0	0	111.4	L135 T136 R141 A142 I143 L162	L135-L139 PolarHBondContact O-N 3.3Å; T136-L139 PolarHBondContact O-N 3.2Å; L139-R141 VanDerWaalsContact C-N 3.27Å; L139-R141 PolarHBondContact O-N 2.94Å; L139-A142 PolarHBondContact O-N 3.19Å; L139-A142 VanDerWaalsContact O-N 3.15Å; L139-I143 HydrophobicContact CD2-CD1 3.95Å; L139-I143 HydrophobicContact CG-CD1 3.91Å; L139-I143 WeakPolarHBondContact O-CB 2.94Å; L139-I143 WeakPolarHBondContact O-CD1 3.12Å; L139-I143 VanDerWaalsContact O-CG1 3.26Å; L139-I143 WeakPolarHBondContact O-CG1 3.16Å; L139-I143 PolarHBondContact O-N 2.82Å; L139-L162 HydrophobicContact CD2-CD2 3.41Å; L139-L162 VanDerWaalsContact CD2-CD2 3.41Å
140	T	40.8	Very low	36.3	Very low	58 Å²	58	104.9 Å²	104.9	36%	0.356	58%	0.583	S	S	.	*	H	α-helix	trans	-59.7	-38	176.9	-53.8	0	0	0	0	111.5	T136 I143 S144	T136-T140 WeakPolarHBondContact O-CB 3.14Å; T136-T140 PolarHBondContact O-N 2.81Å; T136-T140 PolarHBondContact O-OG1 2.79Å; T140-I143 PolarHBondContact O-N 2.92Å; T140-S144 WeakPolarHBondContact O-CB 3.31Å; T140-S144 PolarHBondContact O-N 3.33Å; T140-S144 PolarHBondContact O-OG 2.94Å
141	R	37.4	Very low	37	Very low	191 Å²	191	97 Å²	97	72%	0.721	56%	0.557	S	S	*	*	H	α-helix	trans	-74	-30.1	177.1	-157.3	177.3	-65.3	169.3	-0.7	113.4	S137 S138 L139 S144	S137-R141 WeakPolarHBondContact O-CB 3.48Å; S137-R141 PolarHBondContact O-N 3.4Å; S138-R141 PolarHBondContact O-N 2.79Å; L139-R141 VanDerWaalsContact C-N 3.27Å; L139-R141 PolarHBondContact O-N 2.94Å; R141-S144 WeakPolarHBondContact CA-OG 3.32Å; R141-S144 PolarHBondContact O-OG 3.01Å
142	A	35.7	Very low	37.6	Very low	66 Å²	66	95.5 Å²	95.5	55%	0.545	55%	0.55	S	S	.	*	H	α-helix	trans	-76.2	-23.2	173.4	0	0	0	0	0	113.5	S138 L139 S145	S138-A142 WeakPolarHBondContact O-CB 3.49Å; S138-A142 PolarHBondContact O-N 3.5Å; L139-A142 PolarHBondContact O-N 3.19Å; L139-A142 VanDerWaalsContact O-N 3.15Å; A142-S145 PolarHBondContact O-OG 2.88Å; A142-S145 VanDerWaalsContact O-OG 3.12Å
143	I	36.8	Very low	38.5	Very low	71 Å²	71	94.8 Å²	94.8	36%	0.364	54%	0.542	S	S	.	.	H	α-helix	trans	-89.2	-35.2	179.5	-68.9	166.9	0	0	0	111.6	L139 T140 S145 N146 L155	L139-I143 HydrophobicContact CD2-CD1 3.95Å; L139-I143 HydrophobicContact CG-CD1 3.91Å; L139-I143 WeakPolarHBondContact O-CB 2.94Å; L139-I143 WeakPolarHBondContact O-CD1 3.12Å; L139-I143 VanDerWaalsContact O-CG1 3.26Å; L139-I143 WeakPolarHBondContact O-CG1 3.16Å; L139-I143 PolarHBondContact O-N 2.82Å; T140-I143 PolarHBondContact O-N 2.92Å; I143-S145 PolarHBondContact O-N 3.24Å; I143-N146 PolarHBondContact O-N 3.16Å; I143-L155 HydrophobicContact CG2-CD1 3.74Å; I143-L155 HydrophobicContact CG2-CD2 3.86Å; I143-L155 HydrophobicContact CG2-CG 4.31Å
144	S	40.4	Very low	39.2	Very low	73 Å²	73	90 Å²	90	51%	0.51	52%	0.523	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-7.7	179.7	43.4	0	0	0	0	114.9	T140 R141 T147	T140-S144 WeakPolarHBondContact O-CB 3.31Å; T140-S144 PolarHBondContact O-N 3.33Å; T140-S144 PolarHBondContact O-OG 2.94Å; R141-S144 WeakPolarHBondContact CA-OG 3.32Å; R141-S144 PolarHBondContact O-OG 3.01Å; S144-T147 WeakPolarHBondContact O-CG2 3.12Å
145	S	43.1	Very low	39.8	Very low	93 Å²	93	89.6 Å²	89.6	65%	0.65	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-5.6	171	56.9	0	0	0	0	114	A142 I143	A142-S145 PolarHBondContact O-OG 2.88Å; A142-S145 VanDerWaalsContact O-OG 3.12Å; I143-S145 PolarHBondContact O-N 3.24Å
146	N	38.8	Very low	40.3	Very low	126 Å²	126	87.9 Å²	87.9	67%	0.674	51%	0.511	S	S	*	.			trans	-120.7	38.7	-169.3	-136.6	-3.3	0	0	0	112.8	I143 N148	I143-N146 PolarHBondContact O-N 3.16Å; N146-N148 PolarHBondContact O-N 2.69Å; N146-N148 VanDerWaalsContact O-N 3.14Å
147	T	42	Very low	41.2	Very low	88 Å²	88	89 Å²	89	54%	0.54	51%	0.512	S	S	.	.			trans	-72.5	-0.2	-168.4	46.1	0	0	0	0	116.2	S144	S144-T147 WeakPolarHBondContact O-CG2 3.12Å
148	N	42.9	Very low	41.8	Very low	129 Å²	129	89.2 Å²	89.2	69%	0.69	51%	0.513	S	S	*	.	S	Bend	trans	-111.3	42.1	-174.2	-70.8	-21.6	0	0	0	113.9	N146	N146-N148 PolarHBondContact O-N 2.69Å; N146-N148 VanDerWaalsContact O-N 3.14Å
149	S	41	Very low	42.8	Very low	63 Å²	63	88.4 Å²	88.4	44%	0.441	51%	0.505	S	S	.	.	S	Bend	trans	-159.1	179.9	163.2	75.7	0	0	0	0	112.9	G151	S149-G151 PolarHBondContact O-N 3.09Å
150	I	45.3	Very low	43.6	Very low	106 Å²	106	86.9 Å²	86.9	54%	0.544	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.5	-11.9	-179	-69.9	150.1	0	0	0	116	S152 Q153 I154	I150-S152 PolarHBondContact O-N 3.29Å; I150-Q153 PolarHBondContact O-N 2.82Å; I150-I154 HydrophobicContact CG2-CD1 4Å; I150-I154 HydrophobicContact CG2-CG1 4.49Å
151	G	38.4	Very low	44.5	Very low	28 Å²	28	89.5 Å²	89.5	29%	0.289	51%	0.512	S	S	.	.	H	α-helix	trans	-53.5	-24.9	176.5	0	0	0	0	0	115.5	S149 Q153 I154 L155	S149-G151 PolarHBondContact O-N 3.09Å; G151-Q153 PolarHBondContact O-N 2.81Å; G151-I154 PolarHBondContact O-N 2.84Å; G151-I154 VanDerWaalsContact O-N 3.11Å; G151-L155 PolarHBondContact O-N 2.9Å
152	S	43.9	Very low	45.9	Very low	72 Å²	72	84.2 Å²	84.2	50%	0.503	50%	0.497	S	S	.	.	H	α-helix	trans	-63.8	-21.5	175	58.3	0	0	0	0	114.4	I150	I150-S152 PolarHBondContact O-N 3.29Å
153	Q	45.7	Very low	46.8	Very low	150 Å²	150	84 Å²	84	70%	0.701	49%	0.485	S	S	*	.	H	α-helix	trans	-93.2	-18.5	174	-60.8	-175.7	13.4	0	0	113	I150 G151	I150-Q153 PolarHBondContact O-N 2.82Å; G151-Q153 PolarHBondContact O-N 2.81Å
154	I	45.8	Very low	47.9	Very low	72 Å²	72	85.8 Å²	85.8	37%	0.369	50%	0.495	S	S	.	.	H	α-helix	trans	-95.1	-28.8	-175.1	-62.2	174.4	0	0	0	111.3	I150 G151 P156 I157 C158	I150-I154 HydrophobicContact CG2-CD1 4Å; I150-I154 HydrophobicContact CG2-CG1 4.49Å; G151-I154 PolarHBondContact O-N 2.84Å; G151-I154 VanDerWaalsContact O-N 3.11Å; I154-P156 VanDerWaalsContact C-CD 3.47Å; I154-I157 WeakPolarHBondContact O-CA 3.41Å; I154-I157 WeakPolarHBondContact O-CB 3.37Å; I154-I157 PolarHBondContact O-N 3.27Å; I154-C158 VanDerWaalsContact CG2-SG 3.59Å; I154-C158 PolarHBondContact O-N 3.16Å
155	L	45	Very low	48.9	Very low	62 Å²	62	84.9 Å²	84.9	33%	0.325	49%	0.492	S	S	.	.	H	α-helix	trans	-50.1	-43.7	176.9	-117.2	68.9	0	0	0	115.1	I143 G151 I157 T159	I143-L155 HydrophobicContact CG2-CD1 3.74Å; I143-L155 HydrophobicContact CG2-CD2 3.86Å; I143-L155 HydrophobicContact CG2-CG 4.31Å; G151-L155 PolarHBondContact O-N 2.9Å; L155-I157 PolarHBondContact O-N 3.35Å; L155-T159 WeakPolarHBondContact O-CB 3.5Å; L155-T159 WeakPolarHBondContact O-CG2 3.45Å; L155-T159 PolarHBondContact O-N 3.43Å; L155-T159 PolarHBondContact O-OG1 2.94Å
156	P	45.6	Very low	49.8	Very low	87 Å²	87	84.3 Å²	84.3	57%	0.565	48%	0.48	S	S	*	.	H	α-helix	trans	-68.6	-15.8	176.8	-19.5	33.4	0	0	0	114.3	I154 P160	I154-P156 VanDerWaalsContact C-CD 3.47Å; P156-P160 VanDerWaalsContact O-CD 3.28Å; P156-P160 WeakPolarHBondContact O-CD 3.5Å
157	I	53.4	Low	50.4	Low	110 Å²	110	83.3 Å²	83.3	56%	0.564	47%	0.467	S	S	*	.	H	α-helix	trans	-95.3	-40.1	-176.9	-55.2	174.2	0	0	0	110.1	I154 L155 P160	I154-I157 WeakPolarHBondContact O-CA 3.41Å; I154-I157 WeakPolarHBondContact O-CB 3.37Å; I154-I157 PolarHBondContact O-N 3.27Å; L155-I157 PolarHBondContact O-N 3.35Å; I157-P160 WeakPolarHBondContact O-CD 3.2Å; I157-P160 WeakPolarHBondContact O-CG 3.36Å
158	C	46.4	Very low	51.2	Low	62 Å²	62	84 Å²	84	42%	0.419	46%	0.464	S	S	.	.	H	α-helix	trans	-79.6	-25.4	178.7	-66.4	0	0	0	0	113.9	I154 L161 L162	I154-C158 VanDerWaalsContact CG2-SG 3.59Å; I154-C158 PolarHBondContact O-N 3.16Å; C158-L161 PolarHBondContact O-N 3.49Å; C158-L162 WeakPolarHBondContact O-CB 3.44Å; C158-L162 PolarHBondContact O-N 2.98Å
159	T	54.5	Low	52.1	Low	66 Å²	66	80 Å²	80	41%	0.405	45%	0.45	S	S	.	.	H	α-helix	trans	-59.9	-50	178.2	34.2	0	0	0	0	114.2	L155 L161 L162 Q163	L155-T159 WeakPolarHBondContact O-CB 3.5Å; L155-T159 WeakPolarHBondContact O-CG2 3.45Å; L155-T159 PolarHBondContact O-N 3.43Å; L155-T159 PolarHBondContact O-OG1 2.94Å; T159-L161 VanDerWaalsContact C-N 3.33Å; T159-L161 PolarHBondContact O-N 3.12Å; T159-L162 PolarHBondContact O-N 3.18Å; T159-Q163 WeakPolarHBondContact O-CB 3.48Å; T159-Q163 PolarHBondContact O-N 3.04Å
160	P	52.4	Low	52.6	Low	52 Å²	52	79.8 Å²	79.8	34%	0.338	44%	0.443	S	S	.	.	H	α-helix	trans	-65.8	-33.4	177.1	24.8	-34.5	0	0	0	113	P156 I157 Q163 L164 L573	P156-P160 VanDerWaalsContact O-CD 3.28Å; P156-P160 WeakPolarHBondContact O-CD 3.5Å; I157-P160 WeakPolarHBondContact O-CD 3.2Å; I157-P160 WeakPolarHBondContact O-CG 3.36Å; P160-Q163 PolarHBondContact O-N 2.91Å; P160-L164 WeakPolarHBondContact O-CB 3.43Å; P160-L164 PolarHBondContact O-N 3.13Å; P160-L573 HydrophobicContact CB-CD1 4.4Å
161	L	60.3	Low	53.2	Low	113 Å²	113	77.9 Å²	77.9	59%	0.592	44%	0.443	S	S	*	.	H	α-helix	trans	-67.1	-43.8	176.4	-67.7	173.5	0	0	0	112	C158 T159 Q163 L164 A165	C158-L161 PolarHBondContact O-N 3.49Å; T159-L161 VanDerWaalsContact C-N 3.33Å; T159-L161 PolarHBondContact O-N 3.12Å; L161-Q163 VanDerWaalsContact C-N 3.32Å; L161-L164 PolarHBondContact O-N 2.77Å; L161-A165 PolarHBondContact O-N 2.8Å
162	L	65.9	Low	54.1	Low	80 Å²	80	81.2 Å²	81.2	42%	0.419	45%	0.451	S	S	.	.	H	α-helix	trans	-65.7	-37.7	175.1	-173	66.8	0	0	0	111.4	L139 C158 T159 A165 I166	L139-L162 HydrophobicContact CD2-CD2 3.41Å; L139-L162 VanDerWaalsContact CD2-CD2 3.41Å; C158-L162 WeakPolarHBondContact O-CB 3.44Å; C158-L162 PolarHBondContact O-N 2.98Å; T159-L162 PolarHBondContact O-N 3.18Å; L162-A165 PolarHBondContact O-N 3.41Å; L162-I166 HydrophobicContact CG-CD1 4.04Å; L162-I166 VanDerWaalsContact O-CG1 3.28Å; L162-I166 WeakPolarHBondContact O-CG1 3.39Å; L162-I166 PolarHBondContact O-N 2.82Å
163	Q	54.5	Low	54.3	Low	62 Å²	62	82.1 Å²	82.1	29%	0.29	46%	0.456	S	S	.	.	H	α-helix	trans	-66.6	-38.8	175.9	-168	139.1	-2.6	0	0	112	T159 P160 L161 I166 R167	T159-Q163 WeakPolarHBondContact O-CB 3.48Å; T159-Q163 PolarHBondContact O-N 3.04Å; P160-Q163 PolarHBondContact O-N 2.91Å; L161-Q163 VanDerWaalsContact C-N 3.32Å; Q163-I166 PolarHBondContact O-N 3.38Å; Q163-R167 WeakPolarHBondContact O-CB 3.23Å; Q163-R167 VanDerWaalsContact O-CG 3.28Å; Q163-R167 WeakPolarHBondContact O-CG 3.4Å; Q163-R167 PolarHBondContact O-N 2.76Å
164	L	61.2	Low	54.1	Low	107 Å²	107	80 Å²	80	56%	0.56	45%	0.445	S	S	*	.	H	α-helix	trans	-63.5	-45.2	173.8	-167.4	70.7	0	0	0	111.4	P160 L161 I166 R167 H168	P160-L164 WeakPolarHBondContact O-CB 3.43Å; P160-L164 PolarHBondContact O-N 3.13Å; L161-L164 PolarHBondContact O-N 2.77Å; L164-I166 PolarHBondContact O-N 3.44Å; L164-R167 PolarHBondContact O-N 2.82Å; L164-H168 PolarHBondContact O-N 2.64Å
165	A	60.8	Low	54.3	Low	54 Å²	54	81.5 Å²	81.5	45%	0.446	46%	0.459	S	S	.	.	H	α-helix	trans	-61.8	-40.8	176.7	0	0	0	0	0	112.8	L161 L162 A169	L161-A165 PolarHBondContact O-N 2.8Å; L162-A165 PolarHBondContact O-N 3.41Å; A165-A169 WeakPolarHBondContact O-CB 3.33Å; A165-A169 PolarHBondContact O-N 2.78Å
166	I	62	Low	54.2	Low	81 Å²	81	85.4 Å²	85.4	42%	0.415	48%	0.481	S	S	.	.	H	α-helix	trans	-67.5	-40.6	175.2	-68.4	165.9	0	0	0	111.1	L162 Q163 L164 A169 L170	L162-I166 HydrophobicContact CG-CD1 4.04Å; L162-I166 VanDerWaalsContact O-CG1 3.28Å; L162-I166 WeakPolarHBondContact O-CG1 3.39Å; L162-I166 PolarHBondContact O-N 2.82Å; Q163-I166 PolarHBondContact O-N 3.38Å; L164-I166 PolarHBondContact O-N 3.44Å; I166-A169 PolarHBondContact O-N 3.14Å; I166-L170 HydrophobicContact CG2-CD1 3.85Å; I166-L170 HydrophobicContact CG2-CG 4.38Å; I166-L170 WeakPolarHBondContact O-CB 3.1Å; I166-L170 VanDerWaalsContact O-CG 3.28Å; I166-L170 WeakPolarHBondContact O-CG 3.24Å; I166-L170 PolarHBondContact O-N 3.45Å
167	R	51.2	Low	53.7	Low	105 Å²	105	86.6 Å²	86.6	40%	0.396	48%	0.482	S	S	.	.	H	α-helix	trans	-64.3	-41.1	176.4	-72.7	-179.9	95.8	123.8	16.6	111.8	Q163 L164 L170 A171 I182 D216	Q163-R167 WeakPolarHBondContact O-CB 3.23Å; Q163-R167 VanDerWaalsContact O-CG 3.28Å; Q163-R167 WeakPolarHBondContact O-CG 3.4Å; Q163-R167 PolarHBondContact O-N 2.76Å; L164-R167 PolarHBondContact O-N 2.82Å; R167-L170 PolarHBondContact O-N 3.07Å; R167-A171 WeakPolarHBondContact O-CB 3.46Å; R167-A171 PolarHBondContact O-N 3Å; R167-I182 HydrophobicContact CG-CD1 4.12Å; R167-D216 IonicContact CZ-OD2 3.38Å; R167-D216 IonicContact NH1-OD1 2.75Å; R167-D216 IonicContact NH1-OD2 3.32Å; R167-D216 PolarHBondContact NH1-OD2 3.24Å; R167-D216 VanDerWaalsContact NH1-OD2 3.12Å; R167-D216 IonicContact NH2-OD2 2.69Å; R167-D216 PolarHBondContact NH2-OD2 2.98Å
168	H	60	Low	52.9	Low	102 Å²	102	88.3 Å²	88.3	47%	0.472	50%	0.498	S	S	.	.	H	α-helix	trans	-61.9	-52.2	174.2	-115.7	-89.9	0	0	0	111.7	L164 L170 A171 E172	L164-H168 PolarHBondContact O-N 2.64Å; H168-L170 VanDerWaalsContact C-N 3.27Å; H168-L170 PolarHBondContact O-N 2.74Å; H168-A171 PolarHBondContact O-N 3.34Å; H168-A171 VanDerWaalsContact O-N 3.12Å; H168-E172 IonicContact CE1-OE1 3.08Å; H168-E172 IonicContact CG-OE1 3.17Å; H168-E172 IonicContact ND1-OE1 2.62Å; H168-E172 PolarHBondContact ND1-OE1 3.11Å; H168-E172 WeakPolarHBondContact O-CB 3.38Å; H168-E172 WeakPolarHBondContact O-CG 3.49Å; H168-E172 PolarHBondContact O-N 3.43Å
169	A	61.3	Low	52.4	Low	47 Å²	47	93.8 Å²	93.8	39%	0.388	52%	0.517	S	S	.	.	H	α-helix	trans	-59.5	-35.9	179.2	0	0	0	0	0	113.1	A165 I166 C173	A165-A169 WeakPolarHBondContact O-CB 3.33Å; A165-A169 PolarHBondContact O-N 2.78Å; I166-A169 PolarHBondContact O-N 3.14Å; A169-C173 WeakPolarHBondContact O-CB 3.41Å; A169-C173 PolarHBondContact O-N 3.32Å; A169-C173 VanDerWaalsContact O-N 3.07Å; A169-C173 PolarHBondContact O-SG 3.17Å
170	L	51.2	Low	51.2	Low	58 Å²	58	95.1 Å²	95.1	30%	0.304	52%	0.521	S	S	.	.	H	α-helix	trans	-73.5	-36.8	175.8	-72	173.2	0	0	0	113	I166 R167 H168 F174 L180	I166-L170 HydrophobicContact CG2-CD1 3.85Å; I166-L170 HydrophobicContact CG2-CG 4.38Å; I166-L170 WeakPolarHBondContact O-CB 3.1Å; I166-L170 VanDerWaalsContact O-CG 3.28Å; I166-L170 WeakPolarHBondContact O-CG 3.24Å; I166-L170 PolarHBondContact O-N 3.45Å; R167-L170 PolarHBondContact O-N 3.07Å; H168-L170 VanDerWaalsContact C-N 3.27Å; H168-L170 PolarHBondContact O-N 2.74Å; L170-F174 HydrophobicContact CD2-CE2 4.49Å; L170-F174 PolarHBondContact O-N 3.4Å; L170-L180 HydrophobicContact CB-CD1 4.35Å
171	A	57.7	Low	50.2	Low	66 Å²	66	97.4 Å²	97.4	55%	0.545	53%	0.527	S	S	.	.	H	α-helix	trans	-67.4	-37.7	174.8	0	0	0	0	0	111.9	R167 H168	R167-A171 WeakPolarHBondContact O-CB 3.46Å; R167-A171 PolarHBondContact O-N 3Å; H168-A171 PolarHBondContact O-N 3.34Å; H168-A171 VanDerWaalsContact O-N 3.12Å
172	E	57.2	Low	49	Very low	98 Å²	98	94.6 Å²	94.6	46%	0.458	51%	0.512	S	S	.	.	H	α-helix	trans	-72.1	-34.8	177.5	-72.1	162.1	-163.7	0	0	112.6	H168	H168-E172 IonicContact CE1-OE1 3.08Å; H168-E172 IonicContact CG-OE1 3.17Å; H168-E172 IonicContact ND1-OE1 2.62Å; H168-E172 PolarHBondContact ND1-OE1 3.11Å; H168-E172 WeakPolarHBondContact O-CB 3.38Å; H168-E172 WeakPolarHBondContact O-CG 3.49Å; H168-E172 PolarHBondContact O-N 3.43Å
173	C	48.4	Very low	47.4	Very low	91 Å²	91	97.1 Å²	97.1	62%	0.615	52%	0.522	S	S	*	.	H	α-helix	trans	-75.8	-19.7	176.9	-75.6	0	0	0	0	114.9	A169	A169-C173 WeakPolarHBondContact O-CB 3.41Å; A169-C173 PolarHBondContact O-N 3.32Å; A169-C173 VanDerWaalsContact O-N 3.07Å; A169-C173 PolarHBondContact O-SG 3.17Å
174	F	41.7	Very low	46.4	Very low	105 Å²	105	95.8 Å²	95.8	46%	0.461	53%	0.525	S	S	.	.			trans	-138.7	63.3	-172.1	-60.5	-75.3	0	0	0	113.4	L170 N176 N177 L180	L170-F174 HydrophobicContact CD2-CE2 4.49Å; L170-F174 PolarHBondContact O-N 3.4Å; F174-N176 PolarHBondContact O-N 3.29Å; F174-N177 HydrophobicContact CB-CB 4.49Å; F174-N177 PolarHBondContact O-N 2.87Å; F174-L180 HydrophobicContact CB-CD1 4.47Å; F174-L180 HydrophobicContact CD2-CD1 4.44Å
175	P	49.3	Very low	45	Very low	103 Å²	103	98.2 Å²	98.2	67%	0.669	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-17.8	-177.1	24.9	-35.1	0	0	0	114.6
176	N	43.4	Very low	43.6	Very low	145 Å²	145	97.1 Å²	97.1	78%	0.775	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.8	0.5	-172.2	-62.4	2.7	0	0	0	114.6	F174	F174-N176 PolarHBondContact O-N 3.29Å
177	N	36.1	Very low	42.1	Very low	112 Å²	112	98.4 Å²	98.4	60%	0.599	52%	0.517	S	S	*	.			trans	-112.8	88.2	-177.1	-79.4	-11.8	0	0	0	112.1	F174 Q179	F174-N177 HydrophobicContact CB-CB 4.49Å; F174-N177 PolarHBondContact O-N 2.87Å; N177-Q179 PolarHBondContact O-N 2.86Å
178	V	36.4	Very low	41.3	Very low	146 Å²	146	96.1 Å²	96.1	89%	0.885	51%	0.512	S	S	*	.			trans	-77.4	46.6	-177.2	-163.3	0	0	0	0	112.8
179	Q	34.3	Very low	39.9	Very low	177 Å²	177	95.4 Å²	95.4	83%	0.827	52%	0.518	S	S	*	.			trans	-161.4	52	170.9	-137.5	171.7	7.2	0	0	115.8	N177 H181	N177-Q179 PolarHBondContact O-N 2.86Å; Q179-H181 PolarHBondContact O-N 3.12Å
180	L	30.7	Very low	38.5	Very low	93 Å²	93	97.8 Å²	97.8	49%	0.487	52%	0.523	S	S	.	.			trans	-78.8	81.8	171.7	-86.3	162.9	0	0	0	112.1	L170 F174 I182	L170-L180 HydrophobicContact CB-CD1 4.35Å; F174-L180 HydrophobicContact CB-CD1 4.47Å; F174-L180 HydrophobicContact CD2-CD1 4.44Å; L180-I182 PolarHBondContact O-N 2.93Å; L180-I182 VanDerWaalsContact O-N 3.16Å
181	H	31.6	Very low	37.6	Very low	100 Å²	100	100.5 Å²	100.5	46%	0.463	54%	0.538	S	S	.	.			trans	-76.4	94.6	178.9	-168.3	-77.2	0	0	0	111.8	Q179 Q183	Q179-H181 PolarHBondContact O-N 3.12Å; H181-Q183 PolarHBondContact O-N 3.45Å
182	I	34.8	Very low	36.4	Very low	55 Å²	55	101.8 Å²	101.8	28%	0.282	54%	0.539	S	S	.	.			trans	-80.1	87	179	-53.5	177.4	0	0	0	110	R167 L180	R167-I182 HydrophobicContact CG-CD1 4.12Å; L180-I182 PolarHBondContact O-N 2.93Å; L180-I182 VanDerWaalsContact O-N 3.16Å
183	Q	32.4	Very low	35.3	Very low	133 Å²	133	102.5 Å²	102.5	62%	0.621	55%	0.545	S	S	*	.			trans	-92.2	124.9	172.2	-140.1	166.9	17.8	0	0	110.5	H181 N215	H181-Q183 PolarHBondContact O-N 3.45Å; Q183-N215 PolarHBondContact NE2-OD1 3.25Å
184	G	33.9	Very low	34.6	Very low	34 Å²	34	104.6 Å²	104.6	35%	0.351	55%	0.55	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	147.2	-174.5	0	0	0	0	0	113.4	F214	G184-F214 WeakPolarHBondContact O-CD2 3.45Å; G184-F214 PolarHBondContact O-N 2.85Å; G184-F214 VanDerWaalsContact O-N 3.16Å
185	R	30.9	Very low	34.2	Very low	157 Å²	157	105.5 Å²	105.5	59%	0.592	56%	0.56	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-118.3	120.5	169.4	-177.5	-175.6	-178.7	-178	2.4	107.8	E187 T211	R185-E187 HydrophobicContact CG-CG 4.32Å; R185-E187 IonicContact CZ-OE1 3.2Å; R185-E187 IonicContact NE-OE1 3.3Å; R185-E187 PolarHBondContact NE-OE1 3.35Å; R185-E187 IonicContact NH1-OE1 3.97Å; R185-E187 IonicContact NH2-OE1 3.36Å; R185-E187 PolarHBondContact NH2-OE1 2.86Å; R185-T211 HydrophobicContact CG-CG2 3.93Å
186	L	31.2	Very low	33.5	Very low	31 Å²	31	107.5 Å²	107.5	16%	0.162	57%	0.565	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-106.9	114.9	170.3	-169.8	74.9	0	0	0	108.7	T136 I188 T211 L212 F214	T136-L186 HydrophobicContact CG2-CD1 4.34Å; L186-I188 HydrophobicContact CD2-CD1 3.94Å; L186-I188 HydrophobicContact CD2-CG1 4Å; L186-I188 HydrophobicContact CG-CG1 4.14Å; L186-T211 WeakPolarHBondContact O-CA 3.48Å; L186-L212 HydrophobicContact CB-CB 4.38Å; L186-L212 HydrophobicContact CD2-CD1 4.41Å; L186-L212 PolarHBondContact N-O 2.99Å; L186-L212 PolarHBondContact O-N 3.44Å; L186-F214 HydrophobicContact CB-CE2 4.19Å
187	E	29.7	Very low	33.1	Very low	108 Å²	108	108 Å²	108	51%	0.505	57%	0.567	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-97.4	120.5	168.4	-63.4	-167.2	137.5	0	0	109.3	R185 T211	R185-E187 HydrophobicContact CG-CG 4.32Å; R185-E187 IonicContact CZ-OE1 3.2Å; R185-E187 IonicContact NE-OE1 3.3Å; R185-E187 PolarHBondContact NE-OE1 3.35Å; R185-E187 IonicContact NH1-OE1 3.97Å; R185-E187 IonicContact NH2-OE1 3.36Å; R185-E187 PolarHBondContact NH2-OE1 2.86Å; E187-T211 HydrophobicContact CG-CG2 4.41Å
188	I	34.4	Very low	33.1	Very low	58 Å²	58	109.5 Å²	109.5	30%	0.297	58%	0.575	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-108.9	103.7	171.7	-56	175.5	0	0	0	107	L186 S209 T210	L186-I188 HydrophobicContact CD2-CD1 3.94Å; L186-I188 HydrophobicContact CD2-CG1 4Å; L186-I188 HydrophobicContact CG-CG1 4.14Å; I188-S209 CarbonylContact O-C 3.59Å; I188-S209 WeakPolarHBondContact O-CA 3.48Å; I188-T210 PolarHBondContact N-O 3.47Å; I188-T210 PolarHBondContact O-N 3.36Å
189	S	32.1	Very low	33	Very low	86 Å²	86	108.2 Å²	108.2	60%	0.601	57%	0.568	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-95.3	122.2	171.2	49.7	0	0	0	0	110.7
190	M	30.7	Very low	32.8	Very low	97 Å²	97	105.8 Å²	105.8	48%	0.478	57%	0.565	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-94.5	111.1	171.9	-69.8	-69.3	-157.6	0	0	109.4	S208	M190-S208 PolarHBondContact N-O 2.85Å; M190-S208 PolarHBondContact O-N 3.3Å
191	N	33.1	Very low	32.8	Very low	116 Å²	116	107.7 Å²	107.7	62%	0.62	58%	0.581	S	S	*	*			trans	-99.3	109.2	165.8	-77	-7.9	0	0	0	109.1	I193	N191-I193 PolarHBondContact O-N 3Å
192	T	31.8	Very low	32.6	Very low	92 Å²	92	108.5 Å²	108.5	56%	0.564	59%	0.593	S	S	*	*			trans	-73.5	103.5	168.2	47.4	0	0	0	0	109	D194	T192-D194 PolarHBondContact O-N 2.98Å
193	I	34.6	Very low	32.5	Very low	113 Å²	113	113.1 Å²	113.1	58%	0.579	62%	0.618	S	S	*	*			trans	-82.3	95.2	170.2	-58	176.9	0	0	0	107.7	N191 N195	N191-I193 PolarHBondContact O-N 3Å; I193-N195 PolarHBondContact O-N 3.47Å
194	D	33.3	Very low	32.4	Very low	135 Å²	135	111.6 Å²	111.6	72%	0.722	62%	0.623	S	S	*	*			trans	-69	94.4	170.1	-77.2	-30.3	0	0	0	109.5	T192 N196	T192-D194 PolarHBondContact O-N 2.98Å; D194-N196 PolarHBondContact O-N 3.18Å
195	N	32.9	Very low	32.4	Very low	125 Å²	125	115.2 Å²	115.2	67%	0.668	64%	0.642	S	S	*	*			trans	-71.8	60.6	174	-87.8	-22.1	0	0	0	112	I193	I193-N195 PolarHBondContact O-N 3.47Å
196	N	35.6	Very low	32.4	Very low	145 Å²	145	113.9 Å²	113.9	78%	0.775	65%	0.647	S	S	*	*			trans	-100.8	88.3	167.6	-82.3	-33	0	0	0	110.2	D194 N198	D194-N196 PolarHBondContact O-N 3.18Å; N196-N198 VanDerWaalsContact C-N 3.28Å; N196-N198 PolarHBondContact O-N 2.96Å
197	N	34	Very low	32.4	Very low	156 Å²	156	116.3 Å²	116.3	83%	0.834	67%	0.666	S	S	*	*			trans	-62	91.5	159.5	-77.1	-27.2	0	0	0	109
198	N	36.9	Very low	32.5	Very low	143 Å²	143	114.8 Å²	114.8	77%	0.765	67%	0.668	S	S	*	*			trans	-179.6	131.5	139.4	-89.2	-30.1	0	0	0	112.3	N196	N196-N198 VanDerWaalsContact C-N 3.28Å; N196-N198 PolarHBondContact O-N 2.96Å
199	T	33.5	Very low	32.5	Very low	119 Å²	119	116.4 Å²	116.4	73%	0.73	68%	0.684	S	S	*	*			trans	51.2	99.3	150.8	57.3	0	0	0	0	119
200	T	29.9	Very low	32.5	Very low	126 Å²	126	116.2 Å²	116.2	77%	0.773	68%	0.68	S	S	*	*			trans	43.6	95.8	131.6	57.1	0	0	0	0	118.3
201	T	31.7	Very low	32.8	Very low	133 Å²	133	113.9 Å²	113.9	82%	0.816	67%	0.671	S	S	*	*				170.2	133.8	114	33.3	0	0	0	0	111
202	T	28.3	Very low	32.8	Very low	117 Å²	117	111.9 Å²	111.9	72%	0.718	66%	0.66	S	S	*	*			trans	3.9	116.7	156.3	54.9	0	0	0	0	118.9
203	N	31	Very low	33.1	Very low	151 Å²	151	115.7 Å²	115.7	81%	0.807	67%	0.665	S	S	*	*				172	139.7	113.6	-83.5	-23.8	0	0	0	114.9
204	S	31.5	Very low	33	Very low	102 Å²	102	113.5 Å²	113.5	71%	0.713	65%	0.651	S	S	*	*			trans	41.9	94	154	59.3	0	0	0	0	119.8
205	S	32.7	Very low	33.1	Very low	109 Å²	109	112 Å²	112	76%	0.762	64%	0.643	S	S	*	*			trans	-78.5	112.6	158.9	54.2	0	0	0	0	110.9	S207	S205-S207 PolarHBondContact O-N 2.8Å
206	N	31.8	Very low	33	Very low	130 Å²	130	109 Å²	109	70%	0.695	63%	0.627	S	S	*	*			trans	-80	94.5	175	-76.3	-15.7	0	0	0	111.2
207	S	31.4	Very low	32.9	Very low	81 Å²	81	107.8 Å²	107.8	57%	0.566	63%	0.625	S	S	*	*			trans	-76.5	132.6	167	49.7	0	0	0	0	110.6	S205	S205-S207 PolarHBondContact O-N 2.8Å
208	S	31.8	Very low	32.6	Very low	76 Å²	76	110.1 Å²	110.1	53%	0.531	62%	0.624	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-110.9	119.5	174.4	-62.1	0	0	0	0	109.3	M190	M190-S208 PolarHBondContact N-O 2.85Å; M190-S208 PolarHBondContact O-N 3.3Å
209	S	33.6	Very low	32.2	Very low	93 Å²	93	112.3 Å²	112.3	65%	0.65	63%	0.63	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-111.4	127.5	177.6	57.2	0	0	0	0	111.7	I188	I188-S209 CarbonylContact O-C 3.59Å; I188-S209 WeakPolarHBondContact O-CA 3.48Å
210	T	33.4	Very low	32	Very low	82 Å²	82	111.8 Å²	111.8	50%	0.503	63%	0.631	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.1	123.7	170	-58.6	0	0	0	0	108.9	I188 L212	I188-T210 PolarHBondContact N-O 3.47Å; I188-T210 PolarHBondContact O-N 3.36Å; T210-L212 HydrophobicContact CG2-CD2 4.31Å
211	T	37	Very low	32	Very low	47 Å²	47	111.9 Å²	111.9	29%	0.288	63%	0.633	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-103.2	124.1	173.1	-50.6	0	0	0	0	109.5	R185 L186 E187 Y213	R185-T211 HydrophobicContact CG-CG2 3.93Å; L186-T211 WeakPolarHBondContact O-CA 3.48Å; E187-T211 HydrophobicContact CG-CG2 4.41Å; T211-Y213 HydrophobicContact CG2-CD2 4.15Å; T211-Y213 HydrophobicContact CG2-CE2 3.61Å
212	L	32.7	Very low	31.9	Very low	74 Å²	74	111.9 Å²	111.9	39%	0.387	63%	0.634	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104.6	131.4	170.3	-60.4	177.7	0	0	0	109.6	L186 T210 F214	L186-L212 HydrophobicContact CB-CB 4.38Å; L186-L212 HydrophobicContact CD2-CD1 4.41Å; L186-L212 PolarHBondContact N-O 2.99Å; L186-L212 PolarHBondContact O-N 3.44Å; T210-L212 HydrophobicContact CG2-CD2 4.31Å; L212-F214 HydrophobicContact CB-CE2 4.25Å; L212-F214 HydrophobicContact CB-CZ 4.17Å; L212-F214 HydrophobicContact CD1-CZ 4.46Å
213	Y	37	Very low	31.8	Very low	172 Å²	172	116.3 Å²	116.3	68%	0.675	64%	0.643	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-106.4	133.7	174.6	-69.4	-91.8	0	0	0	109.3	T211	T211-Y213 HydrophobicContact CG2-CD2 4.15Å; T211-Y213 HydrophobicContact CG2-CE2 3.61Å
214	F	32.8	Very low	31.7	Very low	67 Å²	67	114.7 Å²	114.7	29%	0.294	64%	0.643	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-117.3	113.3	173.5	-55.7	-78.7	0	0	0	109.3	G184 L186 L212	G184-F214 WeakPolarHBondContact O-CD2 3.45Å; G184-F214 PolarHBondContact O-N 2.85Å; G184-F214 VanDerWaalsContact O-N 3.16Å; L186-F214 HydrophobicContact CB-CE2 4.19Å; L212-F214 HydrophobicContact CB-CE2 4.25Å; L212-F214 HydrophobicContact CB-CZ 4.17Å; L212-F214 HydrophobicContact CD1-CZ 4.46Å
215	N	36.3	Very low	31.3	Very low	104 Å²	104	114.5 Å²	114.5	56%	0.556	64%	0.642	S	S	*	*			trans	-130.7	114.7	169.2	-82.5	-15.5	0	0	0	107.5	Q183	Q183-N215 PolarHBondContact NE2-OD1 3.25Å
216	D	31.3	Very low	31.1	Very low	62 Å²	62	115.7 Å²	115.7	33%	0.332	64%	0.64	S	S	.	*			trans	-93.7	96.8	171.3	-73.7	-31.8	0	0	0	108.3	R167	R167-D216 IonicContact CZ-OD2 3.38Å; R167-D216 IonicContact NH1-OD1 2.75Å; R167-D216 IonicContact NH1-OD2 3.32Å; R167-D216 PolarHBondContact NH1-OD2 3.24Å; R167-D216 VanDerWaalsContact NH1-OD2 3.12Å; R167-D216 IonicContact NH2-OD2 2.69Å; R167-D216 PolarHBondContact NH2-OD2 2.98Å
217	T	31.7	Very low	30.8	Very low	120 Å²	120	118 Å²	118	74%	0.736	64%	0.644	S	S	*	*			trans	-127.6	97.2	167.7	35.6	0	0	0	0	109
218	Y	28.9	Very low	30.6	Very low	204 Å²	204	118.2 Å²	118.2	80%	0.8	65%	0.645	S	S	*	*			trans	-97	93.4	169.7	-87.1	-92.1	0	0	0	108.7
219	E	27.5	Very low	30.4	Very low	190 Å²	190	120.7 Å²	120.7	89%	0.888	65%	0.653	S	S	*	*			trans	-116.2	119.1	157.3	-75.2	-171.6	155.7	0	0	108
220	S	29	Very low	30.1	Very low	108 Å²	108	123 Å²	123	76%	0.755	65%	0.653	S	S	*	*			trans	-86.1	125.3	178.7	39.8	0	0	0	0	110.4	T222	S220-T222 PolarHBondContact O-N 2.94Å; S220-T222 VanDerWaalsContact O-N 3.17Å
221	P	30.1	Very low	30	Very low	127 Å²	127	124.1 Å²	124.1	83%	0.825	66%	0.656	S	S	*	*			trans	-82.5	98.6	-178.2	31.3	-33.3	0	0	0	111.2	K223	P221-K223 PolarHBondContact O-N 2.81Å
222	T	29.9	Very low	29.6	Very low	134 Å²	134	130 Å²	130	82%	0.822	68%	0.677	S	S	*	*			trans	-75	119.5	165.7	43	0	0	0	0	110.1	S220	S220-T222 PolarHBondContact O-N 2.94Å; S220-T222 VanDerWaalsContact O-N 3.17Å
223	K	26.1	Very low	29.5	Very low	210 Å²	210	132.6 Å²	132.6	91%	0.913	69%	0.688	S	S	*	*			trans	-75.3	123.2	172	-74.6	177.4	176.5	174.7	0	110.1	P221	P221-K223 PolarHBondContact O-N 2.81Å
224	S	28.4	Very low	29.1	Very low	116 Å²	116	131.3 Å²	131.3	81%	0.811	69%	0.688	S	S	*	*			trans	-136.9	118.6	150.8	53.8	0	0	0	0	110.2
225	S	24.2	Very low	29.2	Very low	99 Å²	99	133.9 Å²	133.9	69%	0.692	71%	0.705	S	S	*	*			trans	-73.9	136.5	166.7	49	0	0	0	0	109.6
226	N	29.1	Very low	29	Very low	133 Å²	133	134.3 Å²	134.3	71%	0.711	71%	0.707	S	S	*	*				177.2	132.9	113.7	-87.6	-20.9	0	0	0	114.3
227	F	25.6	Very low	29	Very low	179 Å²	179	137.1 Å²	137.1	79%	0.785	72%	0.722	S	S	*	*			trans	51.4	104.6	137.3	-79.1	-101.2	0	0	0	120.8
228	S	26.4	Very low	29.1	Very low	85 Å²	85	137 Å²	137	59%	0.594	72%	0.717	S	S	*	*				97.7	133.6	107.5	-84.9	0	0	0	0	121.4
229	N	26.8	Very low	29.3	Very low	128 Å²	128	133.4 Å²	133.4	68%	0.684	71%	0.712	S	S	*	*			trans	68	144.9	150.5	-61.4	26	0	0	0	114.5
230	E	29.1	Very low	29.6	Very low	143 Å²	143	131.1 Å²	131.1	67%	0.668	71%	0.705	S	S	*	*			cis	-167.8	151.7	-1.3	-114.1	169.8	-132.4	0	0	102.4
231	N	29.9	Very low	29.9	Very low	105 Å²	105	133.6 Å²	133.6	56%	0.561	71%	0.71	S	S	*	*			cis	-179	156.2	38.5	-114.9	-45.8	0	0	0	105.9
232	K	28.7	Very low	30.4	Very low	169 Å²	169	132.6 Å²	132.6	74%	0.735	70%	0.704	S	S	*	*			trans	36.6	142.7	133.4	-67.3	173.4	-172.8	173.9	0	120.6
233	Q	30.2	Very low	30.4	Very low	130 Å²	130	134.7 Å²	134.7	61%	0.607	71%	0.706	S	S	*	*			cis	-172.4	158.2	30.9	-128.2	162.1	-64.6	0	0	110
234	E	30.3	Very low	30.7	Very low	144 Å²	144	128.2 Å²	128.2	67%	0.673	69%	0.687	S	S	*	*			trans	54.1	142.9	142.6	-71.2	154.1	-160.9	0	0	119.8
235	D	33.5	Very low	31	Very low	121 Å²	121	131.1 Å²	131.1	65%	0.647	69%	0.688	S	S	*	*			cis	-166	149.2	6.7	-128.7	0.6	0	0	0	114.2
236	N	32	Very low	31.4	Very low	114 Å²	114	135.4 Å²	135.4	61%	0.61	69%	0.694	S	S	*	*			trans	59.9	124.1	136.7	-76.8	-37.9	0	0	0	125.7
237	N	32.7	Very low	31.5	Very low	120 Å²	120	136.5 Å²	136.5	64%	0.642	70%	0.699	S	S	*	*				98.9	104.9	124.1	-75.5	-25.5	0	0	0	123.4
238	N	32.9	Very low	31.9	Very low	118 Å²	118	134.6 Å²	134.6	63%	0.631	70%	0.695	S	S	*	*				90.3	113.8	113.9	-71.6	-16.7	0	0	0	123.5
239	N	33.5	Very low	32	Very low	129 Å²	129	136.5 Å²	136.5	69%	0.69	70%	0.699	S	S	*	*				106.5	128.9	114.9	-77.5	-12.7	0	0	0	122.7
240	N	33.7	Very low	32.4	Very low	141 Å²	141	136.8 Å²	136.8	75%	0.754	70%	0.696	S	S	*	*			trans	96	76.9	141.9	-60.7	-18.4	0	0	0	123
241	N	34.9	Very low	32.6	Very low	160 Å²	160	137.6 Å²	137.6	86%	0.856	70%	0.7	S	S	*	*				49.1	166.3	104.3	-109.5	-0.8	0	0	0	123.2
242	P	40.4	Very low	32.5	Very low	106 Å²	106	136.7 Å²	136.7	69%	0.688	70%	0.701	S	S	*	*				-139.8	-172.3	-124.5	43.3	-21.2	0	0	0	117
243	M	31.1	Very low	32.5	Very low	179 Å²	179	134.3 Å²	134.3	88%	0.882	70%	0.701	S	S	*	*			trans	-173.8	160.8	157.9	-99.2	172.2	110.2	0	0	108.3
244	C	32.1	Very low	32.7	Very low	74 Å²	74	134.7 Å²	134.7	50%	0.5	71%	0.713	S	S	.	*			cis	-152.3	147.8	-7.9	-122.6	0	0	0	0	108.9
245	Q	34.8	Very low	32.7	Very low	177 Å²	177	132.4 Å²	132.4	83%	0.827	71%	0.713	S	S	*	*				50.3	139.8	95.3	-58.3	178.4	5.8	0	0	117.1
246	K	32.2	Very low	32.5	Very low	189 Å²	189	137.7 Å²	137.7	82%	0.822	72%	0.724	S	S	*	*			cis	176.3	-171.9	-15.8	-145.4	172.4	-175.4	176.3	0	106.1
247	L	31.6	Very low	32.6	Very low	156 Å²	156	144.6 Å²	144.6	82%	0.817	74%	0.741	S	S	*	*			trans	86.9	141.4	173.8	-46.8	164.8	0	0	0	114.8
248	I	33.3	Very low	32.6	Very low	139 Å²	139	148.6 Å²	148.6	71%	0.713	75%	0.753	S	S	*	*			cis	-155.8	137.9	-7.3	-113.7	166.1	0	0	0	109.8
249	N	29	Very low	32.7	Very low	125 Å²	125	148.4 Å²	148.4	67%	0.668	76%	0.758	S	S	*	*			trans	6.9	156	133	-79.1	-19.3	0	0	0	120
250	Q	34.1	Very low	32.6	Very low	134 Å²	134	150.8 Å²	150.8	63%	0.626	77%	0.77	S	S	*	*			cis	-175.7	169.3	18.9	-124.6	166	46.8	0	0	112
251	Q	33	Very low	32.6	Very low	160 Å²	160	150.9 Å²	150.9	75%	0.748	77%	0.77	S	S	*	*			trans	68.4	154.7	151.6	-68.6	169.5	42.8	0	0	120.7
252	S	28.7	Very low	32.5	Very low	85 Å²	85	148.5 Å²	148.5	59%	0.594	76%	0.763	S	S	*	*			cis	-176.3	137.1	-32.3	52.3	0	0	0	0	114
253	T	29.1	Very low	32.1	Very low	119 Å²	119	148 Å²	148	73%	0.73	76%	0.762	S	S	*	*			trans	73	145.1	143.2	62.2	0	0	0	0	125.7
254	T	33	Very low	32.2	Very low	138 Å²	138	148.7 Å²	148.7	85%	0.847	76%	0.76	S	S	*	*			trans	76.9	150.3	158.9	75.9	0	0	0	0	119.3
255	S	30.8	Very low	31.9	Very low	97 Å²	97	150.8 Å²	150.8	68%	0.678	78%	0.775	S	S	*	*			cis	-171.4	147.8	-22.8	179.3	0	0	0	0	111.6
256	R	30.3	Very low	31.5	Very low	231 Å²	231	152.3 Å²	152.3	87%	0.872	77%	0.774	S	S	*	*			trans	57.9	123.3	160.5	-73.9	172.3	-179.2	-160.4	1.9	121.6
257	R	33.2	Very low	31.5	Very low	260 Å²	260	148.3 Å²	148.3	98%	0.981	77%	0.768	S	S	*	*				-154.1	154.5	107.9	-101.9	169.5	-162.5	-158.5	4.7	110.8
258	K	33.8	Very low	31.3	Very low	204 Å²	204	150.2 Å²	150.2	89%	0.887	77%	0.765	S	S	*	*			trans	-103.4	166.4	-161.6	-102.8	-171.1	175.1	-173.9	0	114
259	P	33.8	Very low	31	Very low	113 Å²	113	151.4 Å²	151.4	73%	0.734	77%	0.774	S	S	*	*			trans	-99.6	179.7	-165.1	40.8	-38.2	0	0	0	114.9
260	L	31.8	Very low	31.1	Very low	179 Å²	179	151.5 Å²	151.5	94%	0.937	77%	0.773	S	S	*	*			trans	-121.4	125.8	165.5	-83.9	158.7	0	0	0	110.4
261	N	34.1	Very low	30.7	Very low	143 Å²	143	153 Å²	153	77%	0.765	78%	0.784	S	S	*	*			trans	-144.5	147.5	171.4	-162.6	1.8	0	0	0	105.3
262	P	33.4	Very low	30.6	Very low	110 Å²	110	155.2 Å²	155.2	71%	0.714	79%	0.787	S	S	*	*				-146.9	169.1	93.7	34.2	-13.5	0	0	0	112.6
263	S	31.9	Very low	30.5	Very low	95 Å²	95	157.5 Å²	157.5	66%	0.664	79%	0.792	S	S	*	*				-177.8	158.1	60.2	-50.3	0	0	0	0	113.7
264	K	31.8	Very low	30.6	Very low	194 Å²	194	158.5 Å²	158.5	84%	0.843	79%	0.793	S	S	*	*			trans	80.5	87.2	161.3	-60	-173.9	-179.9	-178.1	0	118.2
265	C	26.6	Very low	30.3	Very low	119 Å²	119	159 Å²	159	80%	0.804	79%	0.786	S	S	*	*			trans	-72.7	153.7	151.8	-49.6	0	0	0	0	111.1
266	Y	27.2	Very low	30.3	Very low	208 Å²	208	164.8 Å²	164.8	82%	0.816	79%	0.794	S	S	*	*			trans	-140.8	120.6	149.7	-86.4	-73.1	0	0	0	108.3
267	P	30.9	Very low	30.3	Very low	106 Å²	106	157.9 Å²	157.9	69%	0.688	78%	0.775	S	S	*	*			trans	-94.4	138.7	161.3	34.3	-27.3	0	0	0	109.8
268	Y	28.6	Very low	30.2	Very low	195 Å²	195	151 Å²	151	77%	0.765	76%	0.757	S	S	*	*			trans	-144.4	88.4	166.4	-110.5	-82	0	0	0	109.5	I270	Y268-I270 HydrophobicContact CD1-CD1 3.88Å; Y268-I270 HydrophobicContact CD1-CG1 4Å; Y268-I270 HydrophobicContact CE1-CD1 3.7Å; Y268-I270 HydrophobicContact CE1-CG1 4.3Å; Y268-I270 PolarHBondContact O-N 2.77Å
269	D	25.2	Very low	30.1	Very low	165 Å²	165	146.6 Å²	146.6	88%	0.882	74%	0.74	S	S	*	*			trans	-80	102.4	157.9	-68.8	-54.7	0	0	0	107.8
270	I	31.3	Very low	30	Very low	127 Å²	127	149.5 Å²	149.5	65%	0.651	74%	0.744	S	S	*	*			trans	-129.2	112.2	158.6	-69	-175.6	0	0	0	108.9	Y268	Y268-I270 HydrophobicContact CD1-CD1 3.88Å; Y268-I270 HydrophobicContact CD1-CG1 4Å; Y268-I270 HydrophobicContact CE1-CD1 3.7Å; Y268-I270 HydrophobicContact CE1-CG1 4.3Å; Y268-I270 PolarHBondContact O-N 2.77Å
271	L	26.4	Very low	29.8	Very low	164 Å²	164	144.8 Å²	144.8	86%	0.859	73%	0.725	S	S	*	*			trans	-53.8	129.7	166.7	-63.7	154.8	0	0	0	110.3
272	Y	31	Very low	29.6	Very low	208 Å²	208	145.1 Å²	145.1	82%	0.816	72%	0.722	S	S	*	*			trans	-141.7	97.7	153.3	-128.9	-86.1	0	0	0	110.9
273	N	26.6	Very low	29.4	Very low	132 Å²	132	145.6 Å²	145.6	71%	0.706	72%	0.718	S	S	*	*			trans	-67.6	147	164.9	-87	-25.7	0	0	0	110.3
274	N	30.2	Very low	29.4	Very low	141 Å²	141	147 Å²	147	75%	0.754	72%	0.718	S	S	*	*			trans	174	89.5	152	-85.9	-23.3	0	0	0	104.4
275	H	28.4	Very low	29.2	Very low	147 Å²	147	143.6 Å²	143.6	68%	0.681	71%	0.71	S	S	*	*				52.4	83.9	52.2	-122.9	-50.9	0	0	0	113.7	N277	H275-N277 PolarHBondContact ND1-OD1 3.26Å
276	Y	30.8	Very low	29.4	Very low	219 Å²	219	145.4 Å²	145.4	86%	0.859	71%	0.706	S	S	*	*			trans	-152.2	92.1	147	-105.8	-85.3	0	0	0	104.7
277	N	30.2	Very low	29.5	Very low	87 Å²	87	142 Å²	142	47%	0.465	70%	0.7	S	S	.	*				66.8	107.7	87.4	-62.9	3.2	0	0	0	110.8	H275	H275-N277 PolarHBondContact ND1-OD1 3.26Å
278	N	29.6	Very low	29.3	Very low	115 Å²	115	141.1 Å²	141.1	62%	0.615	70%	0.697	S	S	*	*				108.5	151.9	87.9	-87.9	24.9	0	0	0	108.4
279	E	32	Very low	29.4	Very low	112 Å²	112	138.1 Å²	138.1	52%	0.523	69%	0.694	S	S	.	*			cis	-134.5	156.5	-7.1	-87.5	118.5	-165.2	0	0	105.9	S306	E279-S306 VanDerWaalsContact CD-OG 3.29Å; E279-S306 WeakPolarHBondContact OE1-CB 3.47Å; E279-S306 PolarHBondContact OE1-OG 3.17Å; E279-S306 PolarHBondContact OE2-OG 2.88Å; E279-S306 VanDerWaalsContact OE2-OG 3.09Å
280	Q	32.1	Very low	29.5	Very low	174 Å²	174	136.7 Å²	136.7	81%	0.813	69%	0.686	S	S	*	*				45.5	140.6	71.6	-77.5	-179.9	-58.1	0	0	113.8
281	C	28.2	Very low	29.5	Very low	80 Å²	80	136.9 Å²	136.9	54%	0.541	69%	0.688	S	S	.	*			cis	-159.4	167.7	11.8	-128.6	0	0	0	0	111.6
282	E	29.4	Very low	29.5	Very low	150 Å²	150	136.1 Å²	136.1	70%	0.701	69%	0.685	S	S	*	*			trans	73.7	127.7	137.9	-78.9	163	-133.2	0	0	124.1
283	N	29.6	Very low	29.5	Very low	120 Å²	120	131.1 Å²	131.1	64%	0.642	68%	0.681	S	S	*	*			trans	71.8	142.3	134.7	-55.2	-9.1	0	0	0	118.7
284	D	31.2	Very low	29.6	Very low	124 Å²	124	131.6 Å²	131.6	66%	0.663	68%	0.683	S	S	*	*			cis	-156.2	152.6	-4.2	-119	-33.7	0	0	0	110.5
285	N	28.1	Very low	29.7	Very low	123 Å²	123	132.2 Å²	132.2	66%	0.658	69%	0.687	S	S	*	*			trans	32.6	143.5	149.8	-66.1	-56.1	0	0	0	123.8
286	H	29.6	Very low	29.7	Very low	157 Å²	157	133.7 Å²	133.7	73%	0.727	69%	0.692	S	S	*	*			trans	97	114.8	143.1	-72	-45.8	0	0	0	122.1
287	I	29.7	Very low	29.7	Very low	135 Å²	135	129.6 Å²	129.6	69%	0.692	69%	0.685	S	S	*	*				82.1	90	125.9	-62.9	169.6	0	0	0	117.5
288	S	27.9	Very low	29.7	Very low	88 Å²	88	132.1 Å²	132.1	62%	0.615	70%	0.697	S	S	*	*				65.7	150.7	125	82.9	0	0	0	0	122.2
289	N	29.5	Very low	29.7	Very low	133 Å²	133	132.7 Å²	132.7	71%	0.711	70%	0.7	S	S	*	*			trans	79	99	150.8	-65.3	-14.7	0	0	0	118.8
290	N	27.8	Very low	29.6	Very low	134 Å²	134	134.5 Å²	134.5	72%	0.717	71%	0.708	S	S	*	*				79.2	136.8	118.9	-78.2	-4.6	0	0	0	120.9
291	N	30.9	Very low	29.5	Very low	131 Å²	131	132.4 Å²	132.4	70%	0.701	70%	0.701	S	S	*	*			trans	76	96.8	147.4	-59.1	-13.6	0	0	0	118.5
292	N	26.9	Very low	29.5	Very low	148 Å²	148	134.1 Å²	134.1	79%	0.791	70%	0.704	S	S	*	*				60.1	148.3	119	-74.4	-5.8	0	0	0	121.5
293	S	31.4	Very low	29.5	Very low	103 Å²	103	134.5 Å²	134.5	72%	0.72	71%	0.706	S	S	*	*			trans	70.8	101.1	156.4	49.8	0	0	0	0	118
294	N	28.4	Very low	29.6	Very low	143 Å²	143	133.5 Å²	133.5	77%	0.765	71%	0.709	S	S	*	*				45.2	108.6	121.5	-52	-5.3	0	0	0	117.4
295	N	31.5	Very low	29.6	Very low	153 Å²	153	134.2 Å²	134.2	82%	0.818	72%	0.718	S	S	*	*				-174	149.1	103.7	-93.9	-32.2	0	0	0	114.7
296	F	28.3	Very low	29.8	Very low	179 Å²	179	131.1 Å²	131.1	79%	0.785	71%	0.706	S	S	*	*			trans	-45.7	136.8	167.8	-64.2	-104.8	0	0	0	114.7
297	N	32.1	Very low	30.1	Very low	133 Å²	133	129 Å²	129	71%	0.711	71%	0.706	S	S	*	*				169.7	129.9	96.6	-95.6	-49.9	0	0	0	115.4
298	L	28.5	Very low	30.2	Very low	140 Å²	140	129.7 Å²	129.7	73%	0.733	71%	0.71	S	S	*	*				45.1	117.2	128.2	-109.6	72.3	0	0	0	121.9
299	L	29.7	Very low	30.4	Very low	127 Å²	127	132.6 Å²	132.6	67%	0.665	72%	0.718	S	S	*	*				136	140.8	111.1	-85.1	174	0	0	0	118.8
300	H	31.1	Very low	30.5	Very low	149 Å²	149	130.8 Å²	130.8	69%	0.69	72%	0.716	S	S	*	*			trans	67.9	153	151.6	-66.2	-48.1	0	0	0	120.9
301	I	29.7	Very low	30.5	Very low	130 Å²	130	130.5 Å²	130.5	67%	0.667	72%	0.719	S	S	*	*			cis	-167.7	144.2	-41.1	-123.6	-177.5	0	0	0	109.4
302	N	29.1	Very low	30.7	Very low	116 Å²	116	129.8 Å²	129.8	62%	0.62	72%	0.724	S	S	*	*			trans	65	116.4	155.7	-69.8	-12.8	0	0	0	126.2
303	Q	29.2	Very low	30.8	Very low	159 Å²	159	128.1 Å²	128.1	74%	0.743	72%	0.724	S	S	*	*				79.8	120.7	114.8	-64.7	175.4	30.7	0	0	124.9
304	S	30.3	Very low	31.2	Very low	99 Å²	99	128.4 Å²	128.4	69%	0.692	72%	0.723	S	S	*	*				117.3	114.1	116.3	65.9	0	0	0	0	124
305	T	31.8	Very low	31.4	Very low	138 Å²	138	128 Å²	128	85%	0.847	73%	0.726	S	S	*	*			trans	85.4	127.1	132.2	51.8	0	0	0	0	125.4
306	S	31.6	Very low	31.4	Very low	58 Å²	58	126.1 Å²	126.1	41%	0.406	73%	0.726	S	S	.	*			trans	-86.5	177.7	178.6	-25.1	0	0	0	0	115.8	E279	E279-S306 VanDerWaalsContact CD-OG 3.29Å; E279-S306 WeakPolarHBondContact OE1-CB 3.47Å; E279-S306 PolarHBondContact OE1-OG 3.17Å; E279-S306 PolarHBondContact OE2-OG 2.88Å; E279-S306 VanDerWaalsContact OE2-OG 3.09Å
307	P	36.6	Very low	31.9	Very low	113 Å²	113	123 Å²	123	73%	0.734	72%	0.723	S	S	*	*				-162.2	150.6	101.5	39.5	-18.2	0	0	0	121.9
308	L	31.6	Very low	31.8	Very low	149 Å²	149	121.6 Å²	121.6	78%	0.78	72%	0.724	S	S	*	*			trans	53.7	132.4	133.5	-59.4	170.5	0	0	0	125.7
309	L	32.3	Very low	32.2	Very low	150 Å²	150	120.2 Å²	120.2	79%	0.785	73%	0.726	S	S	*	*				152.9	125.3	105.2	-102.5	133	0	0	0	118.6
310	S	31.7	Very low	32.4	Very low	94 Å²	94	121.4 Å²	121.4	66%	0.657	73%	0.733	S	S	*	*			trans	59.1	153	143	56.1	0	0	0	0	123.2
311	T	27.8	Very low	32.5	Very low	128 Å²	128	119.9 Å²	119.9	79%	0.785	74%	0.739	S	S	*	*			cis	-170.3	165.6	-10.7	29.2	0	0	0	0	111.5
312	S	35.7	Very low	32.8	Very low	117 Å²	117	116.8 Å²	116.8	82%	0.818	74%	0.739	S	S	*	*			trans	96.1	129.8	149.8	76.2	0	0	0	0	121.8
313	S	28.8	Very low	33	Very low	112 Å²	112	118 Å²	118	78%	0.783	75%	0.75	S	S	*	*			trans	-111.5	-159.2	168.4	-39.5	0	0	0	0	107.9
314	P	39.2	Very low	33.3	Very low	109 Å²	109	118.8 Å²	118.8	71%	0.708	76%	0.759	S	S	*	*			cis	-140.3	-160.9	-7.3	30	-3.5	0	0	0	114.6
315	T	33.9	Very low	33.5	Very low	134 Å²	134	120.6 Å²	120.6	82%	0.822	76%	0.761	S	S	*	*			trans	110.1	127.2	151.4	68.2	0	0	0	0	120.4
316	S	30.7	Very low	33.5	Very low	115 Å²	115	122.4 Å²	122.4	80%	0.804	76%	0.764	S	S	*	*			trans	-106.7	-174.5	165.2	-30.3	0	0	0	0	108.1
317	P	38	Very low	33.5	Very low	112 Å²	112	123.5 Å²	123.5	73%	0.727	77%	0.772	S	S	*	*			cis	-145.9	-179	21.4	41.5	-19.1	0	0	0	118.3
318	S	30.1	Very low	33.4	Very low	104 Å²	104	127 Å²	127	73%	0.727	78%	0.778	S	S	*	*			trans	46.4	122.8	148.2	65.7	0	0	0	0	122.2
319	S	37.5	Very low	33.4	Very low	112 Å²	112	123.7 Å²	123.7	78%	0.783	78%	0.78	S	S	*	*				173.7	136.7	101.4	60.4	0	0	0	0	114.9
320	D	33.3	Very low	33.2	Very low	152 Å²	152	120.1 Å²	120.1	81%	0.813	78%	0.779	S	S	*	*			trans	68.8	134.1	143.6	-105.7	-37.5	0	0	0	126
321	S	34.6	Very low	33.2	Very low	116 Å²	116	120.9 Å²	120.9	81%	0.811	79%	0.785	S	S	*	*			trans	71.8	140.2	146.4	74.5	0	0	0	0	122.1
322	G	35	Very low	33.2	Very low	65 Å²	65	122.8 Å²	122.8	67%	0.67	79%	0.789	S	S	*	*			trans	119.7	69.9	174.7	0	0	0	0	0	113.5
323	V	34.4	Very low	33	Very low	141 Å²	141	121.5 Å²	121.5	86%	0.855	79%	0.786	S	S	*	*				50.2	85.9	94.5	-171.8	0	0	0	0	113.4
324	L	34.9	Very low	33.1	Very low	176 Å²	176	123.1 Å²	123.1	92%	0.921	79%	0.786	S	S	*	*			trans	-141.7	125.3	143.2	-79.2	-175.7	0	0	0	108.8
325	D	33.1	Very low	32.5	Very low	138 Å²	138	123 Å²	123	74%	0.738	79%	0.787	S	S	*	*			trans	-100.7	140.7	176.7	179.4	16.6	0	0	0	108.9
326	L	33.4	Very low	32.3	Very low	176 Å²	176	121.1 Å²	121.1	92%	0.921	79%	0.785	S	S	*	*			trans	-167.1	82.6	166.8	-104.3	146.7	0	0	0	109.7
327	S	31.9	Very low	32.4	Very low	81 Å²	81	120.8 Å²	120.8	57%	0.566	78%	0.78	S	S	*	*			trans	-73.4	148.6	171.9	65.8	0	0	0	0	113.8
328	H	34	Very low	31.8	Very low	187 Å²	187	122.8 Å²	122.8	87%	0.866	78%	0.783	S	S	*	*			trans	179.4	139.6	137	-81.3	-13.3	0	0	0	106.6
329	G	32	Very low	31.7	Very low	79 Å²	79	123.7 Å²	123.7	81%	0.814	79%	0.785	S	S	*	*			cis	96.1	121.6	31	0	0	0	0	0	108.7
330	G	26.8	Very low	31.1	Very low	75 Å²	75	124 Å²	124	77%	0.773	78%	0.784	S	S	*	*			cis	119.7	134.3	9.1	0	0	0	0	0	111
331	S	31.2	Very low	30.8	Very low	110 Å²	110	124.8 Å²	124.8	77%	0.769	79%	0.787	S	S	*	*			trans	83.5	116.8	-178.2	-148.3	0	0	0	0	114.2
332	L	29.5	Very low	30.6	Very low	167 Å²	167	129 Å²	129	87%	0.874	79%	0.791	S	S	*	*				62	109.8	69.5	-66.8	163.5	0	0	0	114.4
333	A	29.9	Very low	30.1	Very low	91 Å²	91	134.3 Å²	134.3	75%	0.752	80%	0.798	S	S	*	*				174.3	150.8	124.6	0	0	0	0	0	114.1
334	D	31.2	Very low	29.7	Very low	146 Å²	146	137.5 Å²	137.5	78%	0.781	80%	0.801	S	S	*	*			trans	70.7	92.3	148.2	-63	-36.5	0	0	0	125.6
335	S	27.4	Very low	29.1	Very low	106 Å²	106	137.2 Å²	137.2	74%	0.741	80%	0.795	S	S	*	*				67.4	116.5	102.1	-57.1	0	0	0	0	123.2
336	A	29.8	Very low	28.8	Very low	94 Å²	94	138.1 Å²	138.1	78%	0.777	80%	0.798	S	S	*	*			trans	90.3	160.8	139.1	0	0	0	0	0	118.6
337	P	31.9	Very low	28.3	Very low	108 Å²	108	134.4 Å²	134.4	70%	0.701	79%	0.787	S	S	*	*				-136.7	-165.6	-94.9	33.7	-11.2	0	0	0	115.3
338	I	26	Very low	28.1	Very low	155 Å²	155	139.2 Å²	139.2	80%	0.795	80%	0.8	S	S	*	*			trans	70.2	139.6	167.3	-12.2	-179.1	0	0	0	114
339	T	28.1	Very low	27.7	Very low	123 Å²	123	135.7 Å²	135.7	76%	0.755	80%	0.797	S	S	*	*			cis	-140.7	161.1	16.7	41.8	0	0	0	0	113
340	P	24.7	Very low	27.6	Very low	119 Å²	119	139.9 Å²	139.9	77%	0.773	80%	0.799	S	S	*	*			trans	-96.5	135.3	176.7	36	-31.2	0	0	0	113.8
341	L	26.7	Very low	27.5	Very low	168 Å²	168	139.9 Å²	139.9	88%	0.88	80%	0.799	S	S	*	*			trans	-153.6	119.7	162.5	-81.6	178.2	0	0	0	109.7
342	K	29.9	Very low	27.4	Very low	204 Å²	204	141.7 Å²	141.7	89%	0.887	80%	0.799	S	S	*	*				-174.3	125.3	90.8	-152	158.4	-172.3	173	0	111.7
343	E	24.8	Very low	27.5	Very low	176 Å²	176	139.2 Å²	139.2	82%	0.822	80%	0.795	S	S	*	*			trans	-78	133.5	-176.6	-156.2	164.3	-153.6	0	0	110.7	Q345	E343-Q345 PolarHBondContact O-N 3.43Å
344	F	25.4	Very low	27.3	Very low	208 Å²	208	142.1 Å²	142.1	91%	0.912	80%	0.798	S	S	*	*			trans	-80.8	112	167.6	-105.2	-83.7	0	0	0	108.8	I346	F344-I346 PolarHBondContact O-N 3.46Å
345	Q	23.6	Very low	27.4	Very low	171 Å²	171	142.5 Å²	142.5	80%	0.799	80%	0.801	S	S	*	*			trans	-71.6	125.1	178.2	-66.6	-172.8	-23.8	0	0	111.2	E343	E343-Q345 PolarHBondContact O-N 3.43Å
346	I	27.4	Very low	27.6	Very low	157 Å²	157	145.9 Å²	145.9	81%	0.805	80%	0.802	S	S	*	*			trans	-119.5	101.3	149.7	-59.6	-179.5	0	0	0	106.5	F344 H348	F344-I346 PolarHBondContact O-N 3.46Å; I346-H348 PolarHBondContact O-N 3.45Å
347	S	23	Very low	27.6	Very low	97 Å²	97	149.4 Å²	149.4	68%	0.678	80%	0.802	S	S	*	*			trans	-81.2	111.6	-175.6	51.6	0	0	0	0	111.8
348	H	27.3	Very low	27.5	Very low	182 Å²	182	151.5 Å²	151.5	84%	0.843	81%	0.807	S	S	*	*			trans	-118.5	86.9	157.8	-89	-90.7	0	0	0	109.9	I346 L350	I346-H348 PolarHBondContact O-N 3.45Å; H348-L350 PolarHBondContact O-N 2.92Å
349	S	24.8	Very low	27.7	Very low	114 Å²	114	147.9 Å²	147.9	80%	0.797	80%	0.796	S	S	*	*			trans	-83.2	105.6	178.3	54.3	0	0	0	0	111.5
350	L	29.8	Very low	27.8	Very low	167 Å²	167	148.8 Å²	148.8	87%	0.874	80%	0.796	S	S	*	*			trans	-132.4	85.3	161.8	-89.2	165.8	0	0	0	108.9	H348 I352	H348-L350 PolarHBondContact O-N 2.92Å; L350-I352 PolarHBondContact O-N 2.94Å
351	G	25.7	Very low	28.2	Very low	75 Å²	75	150.5 Å²	150.5	77%	0.773	80%	0.798	S	S	*	*			trans	-77.5	115.8	178.3	0	0	0	0	0	111.5
352	I	29.1	Very low	28.5	Very low	148 Å²	148	146.5 Å²	146.5	76%	0.759	79%	0.785	S	S	*	*			trans	-103.7	81.5	166.1	-56.2	179.6	0	0	0	107.6	L350 N354	L350-I352 PolarHBondContact O-N 2.94Å; I352-N354 PolarHBondContact O-N 3.45Å
353	S	30.2	Very low	28.6	Very low	114 Å²	114	143.3 Å²	143.3	80%	0.797	78%	0.777	S	S	*	*			trans	-75.5	103.2	170.5	-65.5	0	0	0	0	109.3	D355	S353-D355 PolarHBondContact O-N 3.29Å
354	N	27.5	Very low	28.9	Very low	153 Å²	153	141.7 Å²	141.7	82%	0.818	77%	0.774	S	S	*	*			trans	-68.9	93	169.6	-77.3	-46.3	0	0	0	110	I352	I352-N354 PolarHBondContact O-N 3.45Å
355	D	32.1	Very low	29.1	Very low	154 Å²	154	139.1 Å²	139.1	82%	0.824	77%	0.768	S	S	*	*			trans	-133.5	143.5	163.7	-105	-44.1	0	0	0	113.7	S353	S353-D355 PolarHBondContact O-N 3.29Å
356	K	31.4	Very low	29.5	Very low	177 Å²	177	136.8 Å²	136.8	77%	0.77	77%	0.766	S	S	*	*			trans	-86.2	136.9	-165.4	-61	155.5	-178.5	162	0	110.6
357	H	30.8	Very low	29.7	Very low	168 Å²	168	136.9 Å²	136.9	78%	0.778	77%	0.768	S	S	*	*				143.2	109.9	127	-81.9	-73.8	0	0	0	114.7
358	N	28.5	Very low	30.5	Very low	151 Å²	151	138.7 Å²	138.7	81%	0.807	77%	0.77	S	S	*	*				81.4	132.4	119.8	-151.6	21.2	0	0	0	120.6
359	S	30.9	Very low	30.9	Very low	80 Å²	80	136.9 Å²	136.9	56%	0.559	77%	0.767	S	S	*	*			trans	80.2	93.8	148.1	-157.9	0	0	0	0	120.5
360	N	30.9	Very low	31.6	Very low	141 Å²	141	139.4 Å²	139.4	75%	0.754	77%	0.766	S	S	*	*				79.5	145.6	125	-59.4	-12.7	0	0	0	121.7
361	N	32.2	Very low	32	Very low	155 Å²	155	137.6 Å²	137.6	83%	0.829	75%	0.752	S	S	*	*			trans	73.5	129.3	171.5	-63.2	-8.1	0	0	0	117.2
362	S	32.8	Very low	32.6	Very low	85 Å²	85	143 Å²	143	59%	0.594	75%	0.751	S	S	*	*			cis	169.9	136.4	-21.7	41.7	0	0	0	0	106
363	N	32.8	Very low	33.1	Very low	136 Å²	136	142.7 Å²	142.7	73%	0.727	75%	0.746	S	S	*	*			trans	78.5	108.8	157.2	-50.5	-18.6	0	0	0	118.5
364	N	30.4	Very low	33.3	Very low	142 Å²	142	145.7 Å²	145.7	76%	0.759	74%	0.741	S	S	*	*			trans	64.2	118.3	134	-51.9	-10	0	0	0	118.7
365	I	29.3	Very low	33.7	Very low	154 Å²	154	144.4 Å²	144.4	79%	0.79	73%	0.729	S	S	*	*				-177.3	127.7	109.8	-91.1	152.8	0	0	0	110.2
366	T	31.9	Very low	34	Very low	123 Å²	123	141.8 Å²	141.8	76%	0.755	72%	0.715	S	S	*	*			trans	55.7	89	166.7	54.5	0	0	0	0	119.5
367	D	32.7	Very low	34.4	Very low	158 Å²	158	138 Å²	138	85%	0.845	70%	0.703	S	S	*	*			trans	-74.8	123.9	146.7	-65.5	-56.8	0	0	0	109.1
368	D	39.3	Very low	35	Very low	135 Å²	135	134.9 Å²	134.9	72%	0.722	69%	0.688	S	S	*	*	S	Bend	trans	-175.3	-40.8	160.5	-96.6	-32.7	0	0	0	110.7	H370	D368-H370 VanDerWaalsContact C-N 3.35Å; D368-H370 PolarHBondContact O-N 3.18Å
369	N	36.7	Very low	35.7	Very low	144 Å²	144	132.2 Å²	132.2	77%	0.77	67%	0.674	S	S	*	*	H	α-helix	trans	-72.8	-18.8	-174.4	-75.6	-32.6	0	0	0	115.3	H371	N369-H371 VanDerWaalsContact C-N 3.31Å; N369-H371 PolarHBondContact O-N 3.43Å
370	H	38.8	Very low	36.2	Very low	168 Å²	168	134.3 Å²	134.3	78%	0.778	68%	0.675	S	S	*	*	H	α-helix	trans	-75	-17.2	-177.2	-105.3	-71.7	0	0	0	114.2	D368	D368-H370 VanDerWaalsContact C-N 3.35Å; D368-H370 PolarHBondContact O-N 3.18Å
371	H	38.2	Very low	36.7	Very low	128 Å²	128	132.4 Å²	132.4	59%	0.593	66%	0.664	S	S	*	*	H	α-helix	trans	-76.1	-44.7	-177.7	-152.1	63.4	0	0	0	112	N369 Q373 Y374 F375	N369-H371 VanDerWaalsContact C-N 3.31Å; N369-H371 PolarHBondContact O-N 3.43Å; H371-Q373 PolarHBondContact O-N 3.37Å; H371-Y374 PolarHBondContact O-N 3.38Å; H371-F375 AromaticContact CD2-CE2 3.88Å; H371-F375 AromaticContact CE1-CE2 3.64Å; H371-F375 AromaticContact NE2-CE2 3.37Å; H371-F375 WeakPolarHBondContact NE2-CE2 3.39Å; H371-F375 PolarHBondContact O-N 3.48Å
372	Y	38.4	Very low	37.3	Very low	190 Å²	190	130.3 Å²	130.3	75%	0.745	65%	0.649	S	S	*	*	H	α-helix	trans	-64.9	-35.7	-179.7	-83.8	-82.3	0	0	0	113.6	Y374 N376	Y372-Y374 VanDerWaalsContact C-N 3.32Å; Y372-Y374 PolarHBondContact O-N 2.91Å; Y372-N376 PolarHBondContact O-N 3.03Å
373	Q	39.6	Very low	38.1	Very low	141 Å²	141	133 Å²	133	66%	0.659	65%	0.653	S	S	*	*	H	α-helix	trans	-66.6	-34.5	177.8	-158.3	86.8	22.7	0	0	112	H371	H371-Q373 PolarHBondContact O-N 3.37Å
374	Y	33.4	Very low	38.5	Very low	177 Å²	177	134 Å²	134	69%	0.694	65%	0.647	S	S	*	*	H	α-helix	trans	-80.3	-37.8	-176.2	-148.9	-86	0	0	0	112.3	H371 Y372 L377 H378	H371-Y374 PolarHBondContact O-N 3.38Å; Y372-Y374 VanDerWaalsContact C-N 3.32Å; Y372-Y374 PolarHBondContact O-N 2.91Å; Y374-L377 PolarHBondContact O-N 3.39Å; Y374-H378 PolarHBondContact O-N 2.93Å
375	F	36	Very low	39.3	Very low	125 Å²	125	132.6 Å²	132.6	55%	0.548	64%	0.64	S	S	.	*	H	α-helix	trans	-63.1	-44.2	174.8	-96.1	-93.1	0	0	0	112.6	H371 L377 H378 D379	H371-F375 AromaticContact CD2-CE2 3.88Å; H371-F375 AromaticContact CE1-CE2 3.64Å; H371-F375 AromaticContact NE2-CE2 3.37Å; H371-F375 WeakPolarHBondContact NE2-CE2 3.39Å; H371-F375 PolarHBondContact O-N 3.48Å; F375-L377 VanDerWaalsContact C-N 3.27Å; F375-L377 PolarHBondContact O-N 3.4Å; F375-H378 PolarHBondContact O-N 3.17Å; F375-D379 PolarHBondContact O-N 3.42Å; F375-D379 VanDerWaalsContact O-N 3.1Å
376	N	38.6	Very low	40.4	Very low	100 Å²	100	130.3 Å²	130.3	54%	0.535	63%	0.628	S	S	.	*	H	α-helix	trans	-67	-28.5	-178.2	-150.1	-11.2	0	0	0	112.5	Y372 Q380	Y372-N376 PolarHBondContact O-N 3.03Å; N376-Q380 VanDerWaalsContact O-CG 3.29Å; N376-Q380 WeakPolarHBondContact O-CG 3.35Å; N376-Q380 PolarHBondContact O-N 2.72Å
377	L	39.4	Very low	41.2	Very low	98 Å²	98	130 Å²	130	51%	0.513	62%	0.618	S	S	.	*	H	α-helix	trans	-73.2	-33.1	171.6	-110.3	128.8	0	0	0	112.7	Y374 F375 L381	Y374-L377 PolarHBondContact O-N 3.39Å; F375-L377 VanDerWaalsContact C-N 3.27Å; F375-L377 PolarHBondContact O-N 3.4Å; L377-L381 WeakPolarHBondContact O-CB 3.08Å; L377-L381 WeakPolarHBondContact O-CD1 3.48Å; L377-L381 VanDerWaalsContact O-CG 3.28Å; L377-L381 WeakPolarHBondContact O-CG 3.45Å; L377-L381 PolarHBondContact O-N 3.22Å; L377-L381 VanDerWaalsContact O-N 3.08Å
378	H	43.8	Very low	42.2	Very low	101 Å²	101	124.6 Å²	124.6	47%	0.468	59%	0.592	S	S	.	*	H	α-helix	trans	-71.4	-43.7	178.5	-149.6	-73.3	0	0	0	111.6	Y374 F375 Q380 L381 E382	Y374-H378 PolarHBondContact O-N 2.93Å; F375-H378 PolarHBondContact O-N 3.17Å; H378-Q380 VanDerWaalsContact C-N 3.32Å; H378-Q380 PolarHBondContact O-N 2.99Å; H378-L381 PolarHBondContact O-N 2.8Å; H378-E382 IonicContact CE1-OE1 3.06Å; H378-E382 PolarHBondContact CE1-OE1 3.38Å; H378-E382 IonicContact ND1-OE1 3Å; H378-E382 PolarHBondContact ND1-OE1 2.9Å; H378-E382 PolarHBondContact O-N 2.96Å
379	D	44.2	Very low	42.7	Very low	96 Å²	96	123.3 Å²	123.3	51%	0.513	58%	0.58	S	S	.	*	H	α-helix	trans	-59.9	-40.2	173.7	-89.5	-8	0	0	0	112	F375 Q383	F375-D379 PolarHBondContact O-N 3.42Å; F375-D379 VanDerWaalsContact O-N 3.1Å; D379-Q383 WeakPolarHBondContact O-CB 3.16Å; D379-Q383 WeakPolarHBondContact O-CG 3.2Å; D379-Q383 PolarHBondContact O-N 2.89Å
380	Q	40.5	Very low	43.7	Very low	123 Å²	123	120.2 Å²	120.2	58%	0.575	56%	0.564	S	S	*	*	H	α-helix	trans	-68	-36.9	177	-75.2	179	5	0	0	112.7	N376 H378 Y384	N376-Q380 VanDerWaalsContact O-CG 3.29Å; N376-Q380 WeakPolarHBondContact O-CG 3.35Å; N376-Q380 PolarHBondContact O-N 2.72Å; H378-Q380 VanDerWaalsContact C-N 3.32Å; H378-Q380 PolarHBondContact O-N 2.99Å; Q380-Y384 WeakPolarHBondContact O-CB 3.42Å; Q380-Y384 PolarHBondContact O-N 3.33Å
381	L	42.6	Very low	44.7	Very low	102 Å²	102	120 Å²	120	53%	0.534	56%	0.556	S	S	.	*	H	α-helix	trans	-70.5	-42.1	175.6	-74	165.9	0	0	0	111.8	L377 H378 Y384 D385	L377-L381 WeakPolarHBondContact O-CB 3.08Å; L377-L381 WeakPolarHBondContact O-CD1 3.48Å; L377-L381 VanDerWaalsContact O-CG 3.28Å; L377-L381 WeakPolarHBondContact O-CG 3.45Å; L377-L381 PolarHBondContact O-N 3.22Å; L377-L381 VanDerWaalsContact O-N 3.08Å; H378-L381 PolarHBondContact O-N 2.8Å; L381-Y384 PolarHBondContact O-N 3.5Å; L381-D385 PolarHBondContact O-N 3.19Å
382	E	43.8	Very low	45.7	Very low	111 Å²	111	119.9 Å²	119.9	52%	0.519	56%	0.556	S	S	.	*	H	α-helix	trans	-65.5	-38.8	175.6	-75.8	-174.2	-163.1	0	0	112.5	H378 Y384 L386	H378-E382 IonicContact CE1-OE1 3.06Å; H378-E382 PolarHBondContact CE1-OE1 3.38Å; H378-E382 IonicContact ND1-OE1 3Å; H378-E382 PolarHBondContact ND1-OE1 2.9Å; H378-E382 PolarHBondContact O-N 2.96Å; E382-Y384 VanDerWaalsContact C-N 3.32Å; E382-Y384 PolarHBondContact O-N 2.87Å; E382-L386 VanDerWaalsContact O-CB 3.26Å; E382-L386 WeakPolarHBondContact O-CB 3.48Å; E382-L386 PolarHBondContact O-N 3.39Å
383	Q	50.8	Low	46.9	Very low	142 Å²	142	115.8 Å²	115.8	66%	0.664	54%	0.543	S	S	*	.	H	α-helix	trans	-63.9	-37.1	171.6	-76.5	-175.8	10.6	0	0	112.4	D379 H387	D379-Q383 WeakPolarHBondContact O-CB 3.16Å; D379-Q383 WeakPolarHBondContact O-CG 3.2Å; D379-Q383 PolarHBondContact O-N 2.89Å; Q383-H387 VanDerWaalsContact O-CB 3.24Å; Q383-H387 WeakPolarHBondContact O-CB 3.26Å; Q383-H387 PolarHBondContact O-N 3.45Å
384	Y	40.3	Very low	48	Very low	155 Å²	155	114.5 Å²	114.5	61%	0.608	54%	0.541	S	S	*	.	H	α-helix	trans	-68.6	-44.7	178.3	-168.3	-91.1	0	0	0	112.1	Q380 L381 E382 H387 C388	Q380-Y384 WeakPolarHBondContact O-CB 3.42Å; Q380-Y384 PolarHBondContact O-N 3.33Å; L381-Y384 PolarHBondContact O-N 3.5Å; E382-Y384 VanDerWaalsContact C-N 3.32Å; E382-Y384 PolarHBondContact O-N 2.87Å; Y384-H387 PolarHBondContact O-N 2.79Å; Y384-C388 PolarHBondContact O-N 3.31Å; Y384-C388 PolarHBondContact O-SG 3.12Å
385	D	46.9	Very low	49.6	Very low	113 Å²	113	109 Å²	109	60%	0.604	52%	0.523	S	S	*	.	H	α-helix	trans	-65.2	-41.2	176.1	-84.3	-9.2	0	0	0	111.7	L381 C388 F389	L381-D385 PolarHBondContact O-N 3.19Å; D385-C388 PolarHBondContact O-N 2.89Å; D385-F389 WeakPolarHBondContact O-CB 3.3Å; D385-F389 PolarHBondContact O-N 3.31Å
386	L	52	Low	51	Low	106 Å²	106	107.9 Å²	107.9	56%	0.555	52%	0.522	S	S	*	.	H	α-helix	trans	-66.2	-39.3	176.4	-169.5	67.7	0	0	0	112	E382 F389 N390	E382-L386 VanDerWaalsContact O-CB 3.26Å; E382-L386 WeakPolarHBondContact O-CB 3.48Å; E382-L386 PolarHBondContact O-N 3.39Å; L386-F389 PolarHBondContact O-N 2.82Å; L386-N390 WeakPolarHBondContact O-CB 3.47Å; L386-N390 PolarHBondContact O-N 3.38Å; L386-N390 PolarHBondContact O-ND2 3.15Å
387	H	48.6	Very low	52.5	Low	118 Å²	118	106.8 Å²	106.8	55%	0.546	51%	0.514	S	S	.	.	H	α-helix	trans	-64.2	-41	173.5	177.1	-95.9	0	0	0	111.9	Q383 Y384 R391	Q383-H387 VanDerWaalsContact O-CB 3.24Å; Q383-H387 WeakPolarHBondContact O-CB 3.26Å; Q383-H387 PolarHBondContact O-N 3.45Å; Y384-H387 PolarHBondContact O-N 2.79Å; H387-R391 WeakPolarHBondContact O-CB 3.28Å; H387-R391 PolarHBondContact O-N 3.22Å
388	C	54.4	Low	53.6	Low	43 Å²	43	104.8 Å²	104.8	29%	0.291	51%	0.508	S	S	.	.	H	α-helix	trans	-63.7	-44.9	174.2	-67.5	0	0	0	0	111.8	Y384 D385 R391 E392	Y384-C388 PolarHBondContact O-N 3.31Å; Y384-C388 PolarHBondContact O-SG 3.12Å; D385-C388 PolarHBondContact O-N 2.89Å; C388-R391 PolarHBondContact O-N 2.79Å; C388-E392 PolarHBondContact O-N 3.39Å
389	F	50.7	Low	54.8	Low	109 Å²	109	106.8 Å²	106.8	48%	0.478	51%	0.513	S	S	.	.	H	α-helix	trans	-63.5	-42.2	178.2	-175.9	-106.1	0	0	0	112.9	D385 L386 E392 Q393	D385-F389 WeakPolarHBondContact O-CB 3.3Å; D385-F389 PolarHBondContact O-N 3.31Å; L386-F389 PolarHBondContact O-N 2.82Å; F389-E392 PolarHBondContact O-N 3.18Å; F389-Q393 HydrophobicContact CE1-CG 4.42Å; F389-Q393 VanDerWaalsContact CZ-NE2 3.3Å; F389-Q393 PolarHBondContact O-N 3.1Å
390	N	57.2	Low	56.1	Low	78 Å²	78	107.5 Å²	107.5	42%	0.417	51%	0.511	S	S	.	.	H	α-helix	trans	-62.8	-42.8	174.8	-70.8	-25	0	0	0	111.3	L386 E392 Q393 D394	L386-N390 WeakPolarHBondContact O-CB 3.47Å; L386-N390 PolarHBondContact O-N 3.38Å; L386-N390 PolarHBondContact O-ND2 3.15Å; N390-E392 PolarHBondContact O-N 3.15Å; N390-Q393 PolarHBondContact O-N 3.19Å; N390-Q393 VanDerWaalsContact O-N 3.17Å; N390-D394 PolarHBondContact O-N 3.19Å
391	R	59.5	Low	57.8	Low	163 Å²	163	108 Å²	108	62%	0.615	51%	0.512	S	S	*	.	H	α-helix	trans	-62.3	-39.7	175.5	-173.1	178.9	-179.1	-175.1	1	112.4	H387 C388 D394 I395	H387-R391 WeakPolarHBondContact O-CB 3.28Å; H387-R391 PolarHBondContact O-N 3.22Å; C388-R391 PolarHBondContact O-N 2.79Å; R391-D394 PolarHBondContact O-N 3.24Å; R391-I395 HydrophobicContact CG-CD1 4.16Å; R391-I395 WeakPolarHBondContact O-CD1 3.43Å; R391-I395 VanDerWaalsContact O-CG1 3.24Å; R391-I395 WeakPolarHBondContact O-CG1 3.4Å; R391-I395 PolarHBondContact O-N 3.25Å
392	E	58.3	Low	59	Low	127 Å²	127	108.9 Å²	108.9	59%	0.593	51%	0.513	S	S	*	.	H	α-helix	trans	-62.9	-40.9	172.8	-75.2	-173.2	170.8	0	0	112	C388 F389 N390 I395 L396	C388-E392 PolarHBondContact O-N 3.39Å; F389-E392 PolarHBondContact O-N 3.18Å; N390-E392 PolarHBondContact O-N 3.15Å; E392-I395 PolarHBondContact O-N 3.2Å; E392-L396 WeakPolarHBondContact O-CB 3.42Å; E392-L396 PolarHBondContact O-N 3.03Å
393	Q	63.5	Low	60.3	Low	103 Å²	103	107.2 Å²	107.2	48%	0.481	51%	0.507	S	S	.	.	H	α-helix	trans	-63.4	-45.1	174.9	-71.3	-160.4	12.5	0	0	112.3	F389 N390 I395 L396 E397	F389-Q393 HydrophobicContact CE1-CG 4.42Å; F389-Q393 VanDerWaalsContact CZ-NE2 3.3Å; F389-Q393 PolarHBondContact O-N 3.1Å; N390-Q393 PolarHBondContact O-N 3.19Å; N390-Q393 VanDerWaalsContact O-N 3.17Å; Q393-I395 VanDerWaalsContact C-N 3.32Å; Q393-I395 PolarHBondContact O-N 3.42Å; Q393-L396 WeakPolarHBondContact O-CB 3.31Å; Q393-L396 PolarHBondContact O-N 3.37Å; Q393-E397 VanDerWaalsContact O-CB 3.3Å; Q393-E397 WeakPolarHBondContact O-CB 3.27Å; Q393-E397 PolarHBondContact O-N 3.31Å
394	D	64.4	Low	61.3	Low	115 Å²	115	102.7 Å²	102.7	62%	0.615	49%	0.494	S	S	*	.	H	α-helix	trans	-61.8	-38.5	178	-78.1	-31.4	0	0	0	112.3	N390 R391 E397 S398	N390-D394 PolarHBondContact O-N 3.19Å; R391-D394 PolarHBondContact O-N 3.24Å; D394-E397 PolarHBondContact O-N 3.17Å; D394-S398 VanDerWaalsContact O-CB 3.27Å; D394-S398 WeakPolarHBondContact O-CB 3.34Å; D394-S398 PolarHBondContact O-N 3.2Å
395	I	65.1	Low	62.7	Low	62 Å²	62	97.5 Å²	97.5	32%	0.318	48%	0.483	S	S	.	.	H	α-helix	trans	-64.6	-45.1	173.8	-68.2	164.1	0	0	0	110.7	R391 E392 Q393 E397 S398 Y399	R391-I395 HydrophobicContact CG-CD1 4.16Å; R391-I395 WeakPolarHBondContact O-CD1 3.43Å; R391-I395 VanDerWaalsContact O-CG1 3.24Å; R391-I395 WeakPolarHBondContact O-CG1 3.4Å; R391-I395 PolarHBondContact O-N 3.25Å; E392-I395 PolarHBondContact O-N 3.2Å; Q393-I395 VanDerWaalsContact C-N 3.32Å; Q393-I395 PolarHBondContact O-N 3.42Å; I395-E397 VanDerWaalsContact C-N 3.34Å; I395-E397 PolarHBondContact O-N 3.12Å; I395-S398 WeakPolarHBondContact O-CB 3.36Å; I395-S398 PolarHBondContact O-N 3.13Å; I395-Y399 WeakPolarHBondContact O-CB 3.49Å; I395-Y399 PolarHBondContact O-N 3.16Å
396	L	66.6	Low	64.1	Low	100 Å²	100	97.4 Å²	97.4	52%	0.524	48%	0.478	S	S	.	.	H	α-helix	trans	-62.3	-40.2	176.1	-109.1	156.4	0	0	0	112.3	E392 Q393 Y399 K400	E392-L396 WeakPolarHBondContact O-CB 3.42Å; E392-L396 PolarHBondContact O-N 3.03Å; Q393-L396 WeakPolarHBondContact O-CB 3.31Å; Q393-L396 PolarHBondContact O-N 3.37Å; L396-Y399 PolarHBondContact O-N 3.14Å; L396-K400 VanDerWaalsContact O-CG 3.29Å; L396-K400 WeakPolarHBondContact O-CG 3.31Å; L396-K400 PolarHBondContact O-N 2.86Å
397	E	69.6	Low	65.1	Low	77 Å²	77	96.6 Å²	96.6	36%	0.36	47%	0.474	S	S	.	.	H	α-helix	trans	-68.8	-41.1	178.6	-164.6	62.2	-159.5	0	0	111.6	Q393 D394 I395 K400 K401	Q393-E397 VanDerWaalsContact O-CB 3.3Å; Q393-E397 WeakPolarHBondContact O-CB 3.27Å; Q393-E397 PolarHBondContact O-N 3.31Å; D394-E397 PolarHBondContact O-N 3.17Å; I395-E397 VanDerWaalsContact C-N 3.34Å; I395-E397 PolarHBondContact O-N 3.12Å; E397-K400 PolarHBondContact O-N 3.21Å; E397-K400 IonicContact OE2-NZ 3.69Å; E397-K400 PolarHBondContact OE2-NZ 2.8Å; E397-K401 WeakPolarHBondContact O-CD 3.49Å; E397-K401 VanDerWaalsContact O-CG 3.31Å; E397-K401 WeakPolarHBondContact O-CG 3.43Å; E397-K401 PolarHBondContact O-N 2.98Å; E397-K401 VanDerWaalsContact O-N 3.09Å
398	S	62.2	Low	66.3	Low	57 Å²	57	97.5 Å²	97.5	40%	0.399	48%	0.478	S	S	.	.	H	α-helix	trans	-58.4	-48.9	169.6	177.3	0	0	0	0	111.6	D394 I395 K400 K401 Q402	D394-S398 VanDerWaalsContact O-CB 3.27Å; D394-S398 WeakPolarHBondContact O-CB 3.34Å; D394-S398 PolarHBondContact O-N 3.2Å; I395-S398 WeakPolarHBondContact O-CB 3.36Å; I395-S398 PolarHBondContact O-N 3.13Å; S398-K400 PolarHBondContact O-N 2.98Å; S398-K401 WeakPolarHBondContact O-CB 3.47Å; S398-K401 PolarHBondContact O-N 3.3Å; S398-K401 VanDerWaalsContact O-N 3.17Å; S398-Q402 WeakPolarHBondContact O-CG 3.26Å; S398-Q402 PolarHBondContact O-N 3.24Å
399	Y	69	Low	67.3	Low	142 Å²	142	101 Å²	101	56%	0.557	49%	0.493	S	S	*	.	H	α-helix	trans	-62.2	-42.2	179.2	-176.4	-105.2	0	0	0	112.4	I395 L396 K401 Q402 L403	I395-Y399 WeakPolarHBondContact O-CB 3.49Å; I395-Y399 PolarHBondContact O-N 3.16Å; L396-Y399 PolarHBondContact O-N 3.14Å; Y399-K401 PolarHBondContact O-N 2.88Å; Y399-Q402 PolarHBondContact O-N 3.43Å; Y399-L403 HydrophobicContact CE1-CD1 4.01Å; Y399-L403 HydrophobicContact CE2-CD1 4.29Å; Y399-L403 PolarHBondContact O-N 3.16Å
400	K	71.6	Confident	68.1	Low	111 Å²	111	99.3 Å²	99.3	48%	0.483	49%	0.486	S	S	.	.	H	α-helix	trans	-58.2	-45	172.7	-70.9	171.4	-151.9	159.5	0	111.9	L396 E397 S398 L403 A404	L396-K400 VanDerWaalsContact O-CG 3.29Å; L396-K400 WeakPolarHBondContact O-CG 3.31Å; L396-K400 PolarHBondContact O-N 2.86Å; E397-K400 PolarHBondContact O-N 3.21Å; E397-K400 IonicContact OE2-NZ 3.69Å; E397-K400 PolarHBondContact OE2-NZ 2.8Å; S398-K400 PolarHBondContact O-N 2.98Å; K400-L403 PolarHBondContact O-N 2.99Å; K400-A404 WeakPolarHBondContact O-CB 3.33Å; K400-A404 PolarHBondContact O-N 3.33Å
401	K	76.5	Confident	68.8	Low	134 Å²	134	97.9 Å²	97.9	58%	0.583	49%	0.485	S	S	*	.	H	α-helix	trans	-62.8	-41.9	178.2	-72.3	164.4	-176.2	165.9	0	111.5	E397 S398 Y399 A404 A405	E397-K401 WeakPolarHBondContact O-CD 3.49Å; E397-K401 VanDerWaalsContact O-CG 3.31Å; E397-K401 WeakPolarHBondContact O-CG 3.43Å; E397-K401 PolarHBondContact O-N 2.98Å; E397-K401 VanDerWaalsContact O-N 3.09Å; S398-K401 WeakPolarHBondContact O-CB 3.47Å; S398-K401 PolarHBondContact O-N 3.3Å; S398-K401 VanDerWaalsContact O-N 3.17Å; Y399-K401 PolarHBondContact O-N 2.88Å; K401-A404 PolarHBondContact O-N 2.93Å; K401-A405 PolarHBondContact O-N 3.42Å
402	Q	67.1	Low	69.4	Low	120 Å²	120	94.5 Å²	94.5	56%	0.561	48%	0.483	S	S	*	.	H	α-helix	trans	-63.1	-43.3	173.9	-68.1	178.5	17.2	0	0	112.1	S398 Y399 A404 A405 F406	S398-Q402 WeakPolarHBondContact O-CG 3.26Å; S398-Q402 PolarHBondContact O-N 3.24Å; Y399-Q402 PolarHBondContact O-N 3.43Å; Q402-A404 PolarHBondContact O-N 2.93Å; Q402-A405 PolarHBondContact O-N 3.35Å; Q402-F406 WeakPolarHBondContact O-CB 3.41Å; Q402-F406 PolarHBondContact O-N 3.39Å
403	L	71.7	Confident	69.4	Low	76 Å²	76	95 Å²	95	40%	0.398	48%	0.479	S	S	.	.	H	α-helix	trans	-63	-41.2	176.7	-135.4	82.5	0	0	0	112	Y399 K400 F406 N407	Y399-L403 HydrophobicContact CE1-CD1 4.01Å; Y399-L403 HydrophobicContact CE2-CD1 4.29Å; Y399-L403 PolarHBondContact O-N 3.16Å; K400-L403 PolarHBondContact O-N 2.99Å; L403-F406 PolarHBondContact O-N 3.47Å; L403-N407 WeakPolarHBondContact O-CB 3.3Å; L403-N407 VanDerWaalsContact O-CG 3.27Å; L403-N407 PolarHBondContact O-N 2.96Å; L403-N407 PolarHBondContact O-ND2 2.98Å
404	A	72.5	Confident	69.8	Low	48 Å²	48	95.6 Å²	95.6	40%	0.397	48%	0.48	S	S	.	.	H	α-helix	trans	-63.3	-45.6	176.4	0	0	0	0	0	111.8	K400 K401 Q402 N407 Q408	K400-A404 WeakPolarHBondContact O-CB 3.33Å; K400-A404 PolarHBondContact O-N 3.33Å; K401-A404 PolarHBondContact O-N 2.93Å; Q402-A404 PolarHBondContact O-N 2.93Å; A404-N407 PolarHBondContact O-N 3.46Å; A404-Q408 WeakPolarHBondContact O-CG 3.25Å; A404-Q408 PolarHBondContact O-N 3.41Å
405	A	70	Confident	69.4	Low	45 Å²	45	97.3 Å²	97.3	37%	0.372	49%	0.486	S	S	.	.	H	α-helix	trans	-61.6	-42.9	175	0	0	0	0	0	112	K401 Q402 N407 Q408 I409	K401-A405 PolarHBondContact O-N 3.42Å; Q402-A405 PolarHBondContact O-N 3.35Å; A405-N407 PolarHBondContact O-N 3.29Å; A405-Q408 PolarHBondContact O-N 3.49Å; A405-I409 WeakPolarHBondContact O-CG1 3.18Å; A405-I409 PolarHBondContact O-N 3.31Å
406	F	76.2	Confident	69	Low	112 Å²	112	97.9 Å²	97.9	49%	0.491	50%	0.496	S	S	.	.	H	α-helix	trans	-61.9	-42.2	175.6	-178	-107.1	0	0	0	112.3	Q402 L403 I409 Q410	Q402-F406 WeakPolarHBondContact O-CB 3.41Å; Q402-F406 PolarHBondContact O-N 3.39Å; L403-F406 PolarHBondContact O-N 3.47Å; F406-I409 PolarHBondContact O-N 3.31Å; F406-Q410 HydrophobicContact CD1-CG 4.45Å; F406-Q410 HydrophobicContact CE1-CG 4.19Å; F406-Q410 HydrophobicContact CZ-CG 4.34Å; F406-Q410 VanDerWaalsContact CZ-NE2 3.33Å; F406-Q410 WeakPolarHBondContact O-CG 3.49Å; F406-Q410 PolarHBondContact O-N 3.19Å
407	N	73.1	Confident	68.4	Low	88 Å²	88	96 Å²	96	47%	0.471	49%	0.489	S	S	.	.	H	α-helix	trans	-65.1	-37.8	175.8	-74	-25.3	0	0	0	112.5	L403 A404 A405 Q410 A411	L403-N407 WeakPolarHBondContact O-CB 3.3Å; L403-N407 VanDerWaalsContact O-CG 3.27Å; L403-N407 PolarHBondContact O-N 2.96Å; L403-N407 PolarHBondContact O-ND2 2.98Å; A404-N407 PolarHBondContact O-N 3.46Å; A405-N407 PolarHBondContact O-N 3.29Å; N407-Q410 PolarHBondContact O-N 3.24Å; N407-A411 WeakPolarHBondContact O-CB 3.45Å; N407-A411 PolarHBondContact O-N 3.48Å
408	Q	72.9	Confident	67.6	Low	138 Å²	138	95.4 Å²	95.4	65%	0.645	49%	0.493	S	S	*	.	H	α-helix	trans	-63.2	-44.6	172.5	-72.2	177.5	4.8	0	0	111.6	A404 A405 Q410 A411 V412	A404-Q408 WeakPolarHBondContact O-CG 3.25Å; A404-Q408 PolarHBondContact O-N 3.41Å; A405-Q408 PolarHBondContact O-N 3.49Å; Q408-Q410 VanDerWaalsContact C-N 3.34Å; Q408-Q410 PolarHBondContact O-N 3.35Å; Q408-A411 PolarHBondContact O-N 2.93Å; Q408-A411 VanDerWaalsContact O-N 3.17Å; Q408-V412 WeakPolarHBondContact O-CG2 3.34Å; Q408-V412 PolarHBondContact O-N 3.39Å
409	I	74.6	Confident	66.6	Low	116 Å²	116	96.8 Å²	96.8	60%	0.595	50%	0.503	S	S	*	.	H	α-helix	trans	-60.5	-43.8	175.3	-66.8	163.6	0	0	0	110.5	A405 F406 A411 V412 W413	A405-I409 WeakPolarHBondContact O-CG1 3.18Å; A405-I409 PolarHBondContact O-N 3.31Å; F406-I409 PolarHBondContact O-N 3.31Å; I409-A411 VanDerWaalsContact C-N 3.35Å; I409-A411 PolarHBondContact O-N 3.38Å; I409-V412 PolarHBondContact O-N 3.33Å; I409-W413 WeakPolarHBondContact O-CB 3.39Å; I409-W413 PolarHBondContact O-N 2.77Å
410	Q	69.2	Low	65.2	Low	73 Å²	73	97.4 Å²	97.4	34%	0.341	52%	0.516	S	S	.	.	H	α-helix	trans	-61.9	-39.2	174.3	-74.8	-160.1	1	0	0	113	F406 N407 Q408 W413 K414	F406-Q410 HydrophobicContact CD1-CG 4.45Å; F406-Q410 HydrophobicContact CE1-CG 4.19Å; F406-Q410 HydrophobicContact CZ-CG 4.34Å; F406-Q410 VanDerWaalsContact CZ-NE2 3.33Å; F406-Q410 WeakPolarHBondContact O-CG 3.49Å; F406-Q410 PolarHBondContact O-N 3.19Å; N407-Q410 PolarHBondContact O-N 3.24Å; Q408-Q410 VanDerWaalsContact C-N 3.34Å; Q408-Q410 PolarHBondContact O-N 3.35Å; Q410-W413 PolarHBondContact O-N 3.16Å; Q410-K414 WeakPolarHBondContact O-CB 3.18Å; Q410-K414 WeakPolarHBondContact O-CG 3.21Å; Q410-K414 PolarHBondContact O-N 3.32Å
411	A	70.7	Confident	63.5	Low	48 Å²	48	96.4 Å²	96.4	40%	0.397	52%	0.523	S	S	.	.	H	α-helix	trans	-65.8	-47.4	178.2	0	0	0	0	0	111.5	N407 Q408 I409 W413 K414 M415	N407-A411 WeakPolarHBondContact O-CB 3.45Å; N407-A411 PolarHBondContact O-N 3.48Å; Q408-A411 PolarHBondContact O-N 2.93Å; Q408-A411 VanDerWaalsContact O-N 3.17Å; I409-A411 VanDerWaalsContact C-N 3.35Å; I409-A411 PolarHBondContact O-N 3.38Å; A411-W413 VanDerWaalsContact C-N 3.29Å; A411-W413 PolarHBondContact O-N 2.9Å; A411-K414 PolarHBondContact O-N 2.65Å; A411-M415 WeakPolarHBondContact O-CG 3.49Å; A411-M415 PolarHBondContact O-N 3.3Å
412	V	72.6	Confident	61.7	Low	93 Å²	93	98 Å²	98	56%	0.564	53%	0.532	S	S	*	.	H	α-helix	trans	-59.9	-40.3	174.7	173.9	0	0	0	0	111	Q408 I409 M415 S416	Q408-V412 WeakPolarHBondContact O-CG2 3.34Å; Q408-V412 PolarHBondContact O-N 3.39Å; I409-V412 PolarHBondContact O-N 3.33Å; V412-M415 PolarHBondContact O-N 3.08Å; V412-S416 WeakPolarHBondContact O-CB 3.41Å; V412-S416 PolarHBondContact O-N 3.07Å; V412-S416 PolarHBondContact O-OG 3.03Å
413	W	58.5	Low	60.4	Low	136 Å²	136	102.1 Å²	102.1	52%	0.515	55%	0.549	S	S	.	.	H	α-helix	trans	-66.1	-42.7	176.4	-168.6	62	0	0	0	112.6	I409 Q410 A411 S416 T417	I409-W413 WeakPolarHBondContact O-CB 3.39Å; I409-W413 PolarHBondContact O-N 2.77Å; Q410-W413 PolarHBondContact O-N 3.16Å; A411-W413 VanDerWaalsContact C-N 3.29Å; A411-W413 PolarHBondContact O-N 2.9Å; W413-S416 PolarHBondContact O-N 3.31Å; W413-T417 HydrophobicContact CD2-CG2 4.42Å; W413-T417 HydrophobicContact CZ2-CG2 4.46Å; W413-T417 WeakPolarHBondContact O-CB 3.47Å; W413-T417 WeakPolarHBondContact O-CG2 3.4Å; W413-T417 PolarHBondContact O-N 2.92Å; W413-T417 PolarHBondContact O-OG1 3.16Å
414	K	71	Confident	58.5	Low	116 Å²	116	106.3 Å²	106.3	50%	0.504	57%	0.569	S	S	.	*	H	α-helix	trans	-59.4	-47.1	172.7	-76.7	173.3	179.9	173.8	0	111.6	Q410 A411 S416 T417 S418	Q410-K414 WeakPolarHBondContact O-CB 3.18Å; Q410-K414 WeakPolarHBondContact O-CG 3.21Å; Q410-K414 PolarHBondContact O-N 3.32Å; A411-K414 PolarHBondContact O-N 2.65Å; K414-S416 VanDerWaalsContact C-N 3.26Å; K414-S416 PolarHBondContact O-N 2.82Å; K414-T417 WeakPolarHBondContact CA-OG1 3.49Å; K414-T417 PolarHBondContact O-N 2.69Å; K414-T417 VanDerWaalsContact O-N 3.16Å; K414-T417 PolarHBondContact O-OG1 3.38Å; K414-S418 VanDerWaalsContact O-CB 3.31Å; K414-S418 WeakPolarHBondContact O-CB 3.31Å; K414-S418 PolarHBondContact O-N 3.47Å; K414-S418 PolarHBondContact O-OG 3.39Å; K414-S418 VanDerWaalsContact O-OG 3.14Å
415	M	56.2	Low	56.5	Low	151 Å²	151	109 Å²	109	74%	0.744	59%	0.585	S	S	*	*	H	α-helix	trans	-61.3	-34.8	176.3	-66	-179.6	83.1	0	0	112.7	A411 V412 S419	A411-M415 WeakPolarHBondContact O-CG 3.49Å; A411-M415 PolarHBondContact O-N 3.3Å; V412-M415 PolarHBondContact O-N 3.08Å; M415-S419 PolarHBondContact O-OG 3.06Å
416	S	56.4	Low	54.7	Low	75 Å²	75	114.9 Å²	114.9	52%	0.524	61%	0.611	S	S	.	*	H	α-helix	trans	-75.5	-22.1	178	-55.7	0	0	0	0	114	V412 W413 K414	V412-S416 WeakPolarHBondContact O-CB 3.41Å; V412-S416 PolarHBondContact O-N 3.07Å; V412-S416 PolarHBondContact O-OG 3.03Å; W413-S416 PolarHBondContact O-N 3.31Å; K414-S416 VanDerWaalsContact C-N 3.26Å; K414-S416 PolarHBondContact O-N 2.82Å
417	T	54.5	Low	52.6	Low	60 Å²	60	115.5 Å²	115.5	37%	0.368	63%	0.629	S	S	.	*	H	α-helix	trans	-102.6	-40.8	-177	49.1	0	0	0	0	112.7	W413 K414 S419 N420	W413-T417 HydrophobicContact CD2-CG2 4.42Å; W413-T417 HydrophobicContact CZ2-CG2 4.46Å; W413-T417 WeakPolarHBondContact O-CB 3.47Å; W413-T417 WeakPolarHBondContact O-CG2 3.4Å; W413-T417 PolarHBondContact O-N 2.92Å; W413-T417 PolarHBondContact O-OG1 3.16Å; K414-T417 WeakPolarHBondContact CA-OG1 3.49Å; K414-T417 PolarHBondContact O-N 2.69Å; K414-T417 VanDerWaalsContact O-N 3.16Å; K414-T417 PolarHBondContact O-OG1 3.38Å; T417-S419 PolarHBondContact O-N 2.8Å; T417-S419 VanDerWaalsContact O-N 3.13Å; T417-N420 PolarHBondContact O-N 3.48Å
418	S	52.9	Low	50.8	Low	64 Å²	64	116.7 Å²	116.7	45%	0.448	64%	0.644	S	S	.	*	H	α-helix	trans	-64.2	-16.8	-179.8	-65.3	0	0	0	0	114.2	K414 N420	K414-S418 VanDerWaalsContact O-CB 3.31Å; K414-S418 WeakPolarHBondContact O-CB 3.31Å; K414-S418 PolarHBondContact O-N 3.47Å; K414-S418 PolarHBondContact O-OG 3.39Å; K414-S418 VanDerWaalsContact O-OG 3.14Å; S418-N420 VanDerWaalsContact C-N 3.28Å; S418-N420 PolarHBondContact O-N 3.16Å
419	S	41.9	Very low	49	Very low	87 Å²	87	117.2 Å²	117.2	61%	0.608	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	-6	179.5	34.5	0	0	0	0	114.7	M415 T417	M415-S419 PolarHBondContact O-OG 3.06Å; T417-S419 PolarHBondContact O-N 2.8Å; T417-S419 VanDerWaalsContact O-N 3.13Å
420	N	38.5	Very low	47.2	Very low	154 Å²	154	120.1 Å²	120.1	82%	0.824	66%	0.659	S	S	*	*	S	Bend	trans	-126.5	2.3	-174.8	-84	-39	0	0	0	116.8	T417 S418	T417-N420 PolarHBondContact O-N 3.48Å; S418-N420 VanDerWaalsContact C-N 3.28Å; S418-N420 PolarHBondContact O-N 3.16Å
421	S	37.4	Very low	45.3	Very low	90 Å²	90	125.6 Å²	125.6	63%	0.629	68%	0.682	S	S	*	*	S	Bend	trans	-120.7	-10.4	-171.7	57.7	0	0	0	0	117.8
422	E	38	Very low	43.5	Very low	168 Å²	168	130.7 Å²	130.7	79%	0.785	70%	0.703	S	S	*	*	S	Bend	trans	-104.7	24.5	-168.3	-64.5	-170.3	162.8	0	0	115.9
423	K	39.2	Very low	41.8	Very low	207 Å²	207	131 Å²	131	90%	0.9	71%	0.707	S	S	*	*	S	Bend	trans	-125.8	15.4	-178.5	-72.9	-171	178.2	176.8	0	116.5
424	I	32.5	Very low	40.8	Very low	163 Å²	163	134.1 Å²	134.1	84%	0.836	72%	0.724	S	S	*	*	S	Bend	trans	-141.6	55.2	179.6	-39.3	178.1	0	0	0	113.3
425	S	31.3	Very low	39.2	Very low	105 Å²	105	136 Å²	136	73%	0.734	74%	0.738	S	S	*	*	S	Bend	trans	174.1	104	150.4	52.8	0	0	0	0	111
426	N	32	Very low	38.3	Very low	169 Å²	169	137.1 Å²	137.1	90%	0.904	74%	0.738	S	S	*	*			trans	162.2	63	150.4	-84.3	-18.9	0	0	0	110.7
427	S	31.5	Very low	37.2	Very low	124 Å²	124	142.9 Å²	142.9	87%	0.867	75%	0.75	S	S	*	*			trans	-110.3	86.3	169.1	59.6	0	0	0	0	109.7
428	S	34.7	Very low	36.3	Very low	113 Å²	113	145.6 Å²	145.6	79%	0.79	77%	0.772	S	S	*	*			trans	-133.9	141	171.7	-93.2	0	0	0	0	110
429	L	35.2	Very low	35.3	Very low	150 Å²	150	149.5 Å²	149.5	79%	0.785	79%	0.787	S	S	*	*			trans	98.5	91.5	169.4	-51.6	179	0	0	0	119
430	K	37.6	Very low	35	Very low	176 Å²	176	153.6 Å²	153.6	77%	0.765	80%	0.803	S	S	*	*				61.5	112.9	127.9	-60	176.8	-179.3	-179.1	0	119.4
431	F	29.2	Very low	34.8	Very low	188 Å²	188	150.9 Å²	150.9	83%	0.825	80%	0.796	S	S	*	*				67.2	129.6	99.2	-74.3	-73.2	0	0	0	113.8
432	D	33.7	Very low	34.7	Very low	156 Å²	156	153.5 Å²	153.5	83%	0.834	80%	0.803	S	S	*	*			cis	-146.9	161.6	49.5	-80.5	-50.4	0	0	0	116.3
433	P	35.5	Very low	34.8	Very low	100 Å²	100	151.4 Å²	151.4	65%	0.649	80%	0.797	S	S	*	*			trans	-125.1	140.9	174.1	39.1	-26.2	0	0	0	116.5
434	K	38.3	Very low	34.9	Very low	201 Å²	201	149.3 Å²	149.3	87%	0.874	79%	0.787	S	S	*	*			trans	175.3	119.7	160.7	-105.2	154.6	-169.1	173.9	0	110.9
435	I	37.4	Very low	35.4	Very low	156 Å²	156	150.5 Å²	150.5	80%	0.8	79%	0.79	S	S	*	*				172.7	114.9	92	-87.1	144.5	0	0	0	104.6
436	K	36.7	Very low	35.7	Very low	173 Å²	173	154.7 Å²	154.7	75%	0.752	80%	0.795	S	S	*	*				92.6	108.3	72.2	-87.1	-158.1	172.6	-172.5	0	116
437	Y	33.4	Very low	36.1	Very low	196 Å²	196	151.8 Å²	151.8	77%	0.769	79%	0.785	S	S	*	*			trans	50.7	134.4	143.2	-56.6	-72.9	0	0	0	121.2
438	S	35.6	Very low	36.5	Very low	118 Å²	118	153.5 Å²	153.5	83%	0.825	78%	0.784	S	S	*	*				-167.9	144.1	74.1	32	0	0	0	0	114
439	D	31.4	Very low	37	Very low	146 Å²	146	152.7 Å²	152.7	78%	0.781	78%	0.779	S	S	*	*			trans	-85.1	154	171	-65.4	-67.2	0	0	0	111.8
440	N	36.9	Very low	37.3	Very low	173 Å²	173	154.4 Å²	154.4	93%	0.925	78%	0.783	S	S	*	*			trans	-152.2	133.1	144.7	-108.1	-30.3	0	0	0	110.7
441	S	32.9	Very low	37.5	Very low	97 Å²	97	150.8 Å²	150.8	68%	0.678	78%	0.777	S	S	*	*			trans	-130.2	144.7	176.9	53.2	0	0	0	0	108.4
442	N	35.8	Very low	38.1	Very low	145 Å²	145	149.4 Å²	149.4	78%	0.775	78%	0.778	S	S	*	*			trans	-178.9	164.1	141.1	-100.8	-49.5	0	0	0	113.7
443	D	41.1	Very low	38.8	Very low	124 Å²	124	148 Å²	148	66%	0.663	78%	0.775	S	S	*	*			trans	69.3	137	168.6	-66.6	-25.6	0	0	0	119.2
444	K	39.8	Very low	39.1	Very low	162 Å²	162	149.1 Å²	149.1	70%	0.704	78%	0.783	S	S	*	*			cis	165.7	160.4	-26.9	-109.1	-175.7	-154.1	117.2	0	105.3
445	Q	42.6	Very low	39.3	Very low	188 Å²	188	143.3 Å²	143.3	88%	0.879	77%	0.772	S	S	*	*			trans	87.9	139	169.9	-51.5	-178.7	52.5	0	0	116.2
446	K	38.9	Very low	39.7	Very low	194 Å²	194	145.4 Å²	145.4	84%	0.843	78%	0.776	S	S	*	*			cis	-161.7	146.9	-27	-159.9	174.1	-179.8	-168.8	0	107.3
447	P	39.7	Very low	39.9	Very low	108 Å²	108	144.9 Å²	144.9	70%	0.701	78%	0.78	S	S	*	*			trans	-97.1	173.5	-173.3	38.4	-36.9	0	0	0	114.1
448	N	40.7	Very low	40.2	Very low	159 Å²	159	139.3 Å²	139.3	85%	0.85	78%	0.782	S	S	*	*			trans	169.1	152.3	155.6	-82.7	-14.7	0	0	0	106
449	S	44.8	Very low	40.3	Very low	96 Å²	96	145 Å²	145	67%	0.671	79%	0.785	S	S	*	*			cis	-175.7	146	-9.2	43.9	0	0	0	0	105.9
450	E	41.3	Very low	40.8	Very low	187 Å²	187	150.3 Å²	150.3	87%	0.874	79%	0.794	S	S	*	*			cis	-160.2	175.9	-1.2	-111	-177.1	92.4	0	0	109.9
451	P	42.3	Very low	40.8	Very low	99 Å²	99	148.8 Å²	148.8	64%	0.643	79%	0.791	S	S	*	*			trans	-104.5	167.8	-165.5	40.5	-36.4	0	0	0	115.5
452	N	42	Very low	41.2	Very low	159 Å²	159	155.3 Å²	155.3	85%	0.85	80%	0.801	S	S	*	*			trans	169.5	133.9	152.7	-90.7	-35.8	0	0	0	108.7
453	T	48.1	Very low	41.6	Very low	126 Å²	126	154 Å²	154	77%	0.773	80%	0.798	S	S	*	*			cis	-146.8	153.3	5.8	40.7	0	0	0	0	111.6
454	P	42	Very low	41.8	Very low	125 Å²	125	156 Å²	156	81%	0.812	81%	0.809	S	S	*	*			trans	-117.2	-173.9	-173.1	43.4	-35.2	0	0	0	117
455	A	41.8	Very low	42.4	Very low	79 Å²	79	156.5 Å²	156.5	65%	0.653	82%	0.818	S	S	*	*			trans	83.7	143.5	165.7	0	0	0	0	0	117.7
456	K	45.4	Very low	42.2	Very low	199 Å²	199	150.8 Å²	150.8	87%	0.865	81%	0.809	S	S	*	*			cis	-131.4	126.5	11.2	-59.8	162	-179.5	170.4	0	108.4
457	I	42	Very low	42.8	Very low	163 Å²	163	151.2 Å²	151.2	84%	0.836	81%	0.814	S	S	*	*				70.2	112.5	57.5	-59.4	172.7	0	0	0	113.5
458	G	38	Very low	43.2	Very low	79 Å²	79	152.5 Å²	152.5	81%	0.814	82%	0.82	S	S	*	*			trans	-172.4	22.3	-179.9	0	0	0	0	0	116.1
459	R	39.7	Very low	43.2	Very low	238 Å²	238	148.2 Å²	148.2	90%	0.898	81%	0.813	S	S	*	*			trans	-123.6	125.4	170.1	-79.2	-171.6	179.4	176.9	1.8	110.5
460	R	40.1	Very low	42.8	Very low	257 Å²	257	154 Å²	154	97%	0.97	82%	0.821	S	S	*	*			trans	-81.9	108.6	167.6	-74.4	176.5	169.9	162.1	-3.8	108.9
461	T	37.9	Very low	43	Very low	140 Å²	140	152.5 Å²	152.5	86%	0.859	82%	0.817	S	S	*	*			trans	-97	129.2	157.7	35	0	0	0	0	108.4
462	R	41.7	Very low	43	Very low	235 Å²	235	151.8 Å²	151.8	89%	0.887	81%	0.812	S	S	*	*			trans	-115	101.7	174	-157.3	177.9	-174.8	178	1.6	109.1
463	T	44	Very low	42.9	Very low	116 Å²	116	149.5 Å²	149.5	71%	0.712	81%	0.808	S	S	*	*			trans	45.6	110.7	152.5	56	0	0	0	0	119
464	N	44.6	Very low	42.6	Very low	166 Å²	166	150 Å²	150	89%	0.888	80%	0.804	S	S	*	*			trans	-60.7	133.7	161.5	-62.4	-46.7	0	0	0	111.7
465	I	52	Low	42.4	Very low	174 Å²	174	155 Å²	155	89%	0.892	81%	0.807	S	S	*	*			trans	-152.5	134.2	143.1	-83.8	117.7	0	0	0	106.1
466	G	39.2	Very low	42.5	Very low	68 Å²	68	161.8 Å²	161.8	70%	0.701	82%	0.816	S	S	*	*			trans	110.9	86	178	0	0	0	0	0	113.7	T468	G466-T468 PolarHBondContact O-N 3.15Å
467	Q	52.3	Low	42.1	Very low	202 Å²	202	161.5 Å²	161.5	94%	0.944	82%	0.818	S	S	*	*			trans	-71.9	106	167	-69.3	169.4	-20.6	0	0	109.5
468	T	48	Very low	42.3	Very low	136 Å²	136	158.6 Å²	158.6	83%	0.834	81%	0.811	S	S	*	*			trans	-117.1	121.4	152.3	49.3	0	0	0	0	108.3	G466 R470	G466-T468 PolarHBondContact O-N 3.15Å; T468-R470 PolarHBondContact O-N 3.19Å
469	G	40	Very low	42.9	Very low	68 Å²	68	160.6 Å²	160.6	70%	0.701	81%	0.808	S	S	*	*			trans	-59.2	126.6	-168.2	0	0	0	0	0	112.1	L471	G469-L471 VanDerWaalsContact C-N 3.27Å; G469-L471 PolarHBondContact O-N 2.82Å
470	R	37.2	Very low	43.5	Very low	219 Å²	219	156.1 Å²	156.1	83%	0.826	80%	0.802	S	S	*	*			trans	-58.1	87.9	164.6	-172.3	-166.7	-169.8	170.6	2.6	108.8	T468 T472	T468-R470 PolarHBondContact O-N 3.19Å; R470-T472 HydrophobicContact CG-CG2 4.01Å; R470-T472 WeakPolarHBondContact CG-OG1 3.37Å; R470-T472 PolarHBondContact O-N 2.81Å
471	L	45.6	Very low	44.3	Very low	154 Å²	154	153.6 Å²	153.6	81%	0.806	79%	0.792	S	S	*	*			trans	-73.3	52.4	172.7	-71.7	177.8	0	0	0	111.3	G469 I474	G469-L471 VanDerWaalsContact C-N 3.27Å; G469-L471 PolarHBondContact O-N 2.82Å; L471-I474 HydrophobicContact CD2-CD1 3.99Å
472	T	42	Very low	46.1	Very low	85 Å²	85	153.4 Å²	153.4	52%	0.521	78%	0.776	S	S	.	*	S	Bend	trans	-89.8	124.5	157.9	53.7	0	0	0	0	107.6	R470	R470-T472 HydrophobicContact CG-CG2 4.01Å; R470-T472 WeakPolarHBondContact CG-OG1 3.37Å; R470-T472 PolarHBondContact O-N 2.81Å
473	S	39.5	Very low	47.4	Very low	111 Å²	111	145.2 Å²	145.2	78%	0.776	75%	0.747	S	S	*	*			trans	52.2	64.5	168.6	66.9	0	0	0	0	116.7	R475	S473-R475 PolarHBondContact O-N 3.11Å; S473-R475 VanDerWaalsContact O-N 3.1Å
474	I	41.9	Very low	48.8	Very low	135 Å²	135	143.1 Å²	143.1	69%	0.692	74%	0.736	S	S	*	*			trans	-72	94.6	139.8	-63.4	179.8	0	0	0	105.8	L471 R476	L471-I474 HydrophobicContact CD2-CD1 3.99Å; I474-R476 PolarHBondContact O-N 3.25Å
475	R	38.7	Very low	50.1	Low	232 Å²	232	135.6 Å²	135.6	88%	0.875	70%	0.696	S	S	*	*			trans	-67.7	80.9	174.9	-172.9	-176.4	-169.1	174.2	3.3	108.9	S473 Q477	S473-R475 PolarHBondContact O-N 3.11Å; S473-R475 VanDerWaalsContact O-N 3.1Å; R475-Q477 PolarHBondContact O-N 3.03Å
476	R	42.6	Very low	50.8	Low	221 Å²	221	134.3 Å²	134.3	83%	0.834	69%	0.691	S	S	*	*			trans	-55.2	138.7	155.6	-68.1	-174.2	179.7	-175.3	-0.2	106.7	I474 S478	I474-R476 PolarHBondContact O-N 3.25Å; R476-S478 VanDerWaalsContact C-N 3.26Å; R476-S478 PolarHBondContact O-N 3.05Å
477	Q	37.9	Very low	51.7	Low	193 Å²	193	137.4 Å²	137.4	90%	0.902	69%	0.687	S	S	*	*			trans	-65.7	90	174.5	-72.2	168.6	-22.9	0	0	108.3	R475 T479	R475-Q477 PolarHBondContact O-N 3.03Å; Q477-T479 PolarHBondContact O-N 2.62Å
478	S	45.9	Very low	52.5	Low	101 Å²	101	129.2 Å²	129.2	71%	0.706	65%	0.651	S	S	*	*			trans	-65	115.5	165.5	54.3	0	0	0	0	106.8	R476 N480	R476-S478 VanDerWaalsContact C-N 3.26Å; R476-S478 PolarHBondContact O-N 3.05Å; S478-N480 PolarHBondContact O-N 2.98Å; S478-N480 VanDerWaalsContact O-N 3.13Å
479	T	51.3	Low	53.5	Low	121 Å²	121	133.1 Å²	133.1	74%	0.742	66%	0.657	S	S	*	*			trans	-49.9	121.1	171	42.5	0	0	0	0	108.1	Q477 R481	Q477-T479 PolarHBondContact O-N 2.62Å; T479-R481 PolarHBondContact O-N 3.28Å
480	N	51.3	Low	54.9	Low	144 Å²	144	135 Å²	135	77%	0.77	65%	0.648	S	S	*	*			trans	-80.4	53.5	-167.3	-158.4	14.8	0	0	0	110.7	S478 R482	S478-N480 PolarHBondContact O-N 2.98Å; S478-N480 VanDerWaalsContact O-N 3.13Å; N480-R482 PolarHBondContact O-N 2.92Å
481	R	56	Low	56.8	Low	204 Å²	204	129.8 Å²	129.8	77%	0.77	63%	0.632	S	S	*	*			trans	-71.2	96.9	175.4	-78.4	-167.9	178.2	-138.3	1	108.5	T479	T479-R481 PolarHBondContact O-N 3.28Å
482	R	75.8	Confident	58.3	Low	136 Å²	136	124.2 Å²	124.2	51%	0.513	60%	0.602	S	S	.	*			trans	-79.1	154.9	163.4	-62.2	176.2	158.5	-155.2	-9.5	109.5	N480 P484 E491 F492	N480-R482 PolarHBondContact O-N 2.92Å; R482-P484 WeakPolarHBondContact O-CD 3.35Å; R482-E491 HydrophobicContact CB-CB 4.02Å; R482-E491 WeakPolarHBondContact CD-OE2 3.37Å; R482-E491 IonicContact CZ-OE2 3.68Å; R482-E491 IonicContact NE-OE2 3.77Å; R482-E491 IonicContact NH1-OE2 2.78Å; R482-E491 PolarHBondContact NH1-OE2 3.03Å; R482-F492 CarbonylContact C-O 3.52Å; R482-F492 WeakPolarHBondContact CA-O 3.33Å
483	F	70.7	Confident	60	Low	63 Å²	63	125.3 Å²	125.3	28%	0.276	61%	0.61	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-108.7	103.9	-178.3	-63.8	-81.5	0	0	0	108.7	F492 L495 L498	F483-F492 PolarHBondContact N-O 3.39Å; F483-F492 PolarHBondContact O-N 2.93Å; F483-L495 HydrophobicContact CD1-CD2 3.36Å; F483-L495 HydrophobicContact CD1-CG 3.81Å; F483-L495 HydrophobicContact CD2-CG 4.34Å; F483-L495 HydrophobicContact CE1-CD1 4.18Å; F483-L495 HydrophobicContact CE1-CD2 3.5Å; F483-L495 HydrophobicContact CE1-CG 3.55Å; F483-L495 HydrophobicContact CE2-CG 4.12Å; F483-L495 HydrophobicContact CG-CD2 3.95Å; F483-L495 HydrophobicContact CG-CG 4.19Å; F483-L495 HydrophobicContact CZ-CD1 4.3Å; F483-L495 HydrophobicContact CZ-CD2 4.2Å; F483-L495 HydrophobicContact CZ-CG 3.72Å; F483-L498 HydrophobicContact CB-CB 4.12Å; F483-L498 HydrophobicContact CB-CD2 3.84Å
484	P	72.8	Confident	61.8	Low	73 Å²	73	122.4 Å²	122.4	47%	0.474	59%	0.59	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-71.5	150.9	177.4	30.9	-34.8	0	0	0	110.9	R482 E490	R482-P484 WeakPolarHBondContact O-CD 3.35Å; P484-E490 WeakPolarHBondContact CA-O 3.34Å
485	C	71.9	Confident	63.5	Low	8 Å²	8	121.1 Å²	121.1	5%	0.054	58%	0.584	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-86.3	125.6	171.8	158.1	0	0	0	0	110.5	Q487 C488 E490 F492 L498 H501	C485-Q487 PolarHBondContact O-N 2.91Å; C485-C488 CarbonylContact C-O 3.41Å; C485-C488 HydrophobicContact CB-CB 4.31Å; C485-C488 WeakPolarHBondContact CB-O 3.46Å; C485-C488 WeakPolarHBondContact CB-SG 3.12Å; C485-C488 CarbonylContact O-C 3.15Å; C485-C488 PolarHBondContact O-N 3.17Å; C485-C488 VanDerWaalsContact SG-CA 3.56Å; C485-C488 WeakPolarHBondContact SG-CB 3.31Å; C485-C488 PolarHBondContact SG-N 3.38Å; C485-C488 PolarHBondContact SG-O 2.9Å; C485-C488 VanDerWaalsContact SG-O 3.35Å; C485-C488 CovalentContact SG-SG 2.06Å; C485-C488 PolarHBondContact SG-SG 2.84Å; C485-E490 PolarHBondContact N-O 3.48Å; C485-F492 HydrophobicContact CB-CE2 4.4Å; C485-L498 HydrophobicContact CB-CD1 3.78Å; C485-H501 PolarHBondContact SG-NE2 3.46Å; C485-H501 VanDerWaalsContact SG-NE2 3.45Å
486	N	65.6	Low	65.3	Low	146 Å²	146	116 Å²	116	78%	0.781	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.6	-9.4	-175.9	-68.9	9.8	0	0	0	113.8
487	Q	59	Low	67	Low	134 Å²	134	107.6 Å²	107.6	63%	0.626	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.5	-0.4	178.3	-60.4	-170.9	18.8	0	0	113.2	C485 H506	C485-Q487 PolarHBondContact O-N 2.91Å; Q487-H506 WeakPolarHBondContact CB-CE1 3.46Å; Q487-H506 VanDerWaalsContact CB-ND1 3.32Å; Q487-H506 WeakPolarHBondContact CB-ND1 3.47Å; Q487-H506 PolarHBondContact O-CE1 2.84Å; Q487-H506 VanDerWaalsContact OE1-CG 3.28Å; Q487-H506 PolarHBondContact OE1-ND1 3.14Å
488	C	68.1	Low	68.8	Low	29 Å²	29	99.8 Å²	99.8	20%	0.196	51%	0.507	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.4	138.7	-177.1	72.7	0	0	0	0	110.5	C485 E490 H501 H506	C485-C488 CarbonylContact C-O 3.41Å; C485-C488 HydrophobicContact CB-CB 4.31Å; C485-C488 WeakPolarHBondContact CB-O 3.46Å; C485-C488 WeakPolarHBondContact CB-SG 3.12Å; C485-C488 CarbonylContact O-C 3.15Å; C485-C488 PolarHBondContact O-N 3.17Å; C485-C488 VanDerWaalsContact SG-CA 3.56Å; C485-C488 WeakPolarHBondContact SG-CB 3.31Å; C485-C488 PolarHBondContact SG-N 3.38Å; C485-C488 PolarHBondContact SG-O 2.9Å; C485-C488 VanDerWaalsContact SG-O 3.35Å; C485-C488 CovalentContact SG-SG 2.06Å; C485-C488 PolarHBondContact SG-SG 2.84Å; C488-E490 PolarHBondContact O-N 2.97Å; C488-H501 PolarHBondContact SG-CE1 3.39Å; C488-H501 PolarHBondContact SG-NE2 3.28Å; C488-H506 WeakPolarHBondContact CB-NE2 3.42Å
489	K	69.2	Low	69.9	Low	219 Å²	219	100.9 Å²	100.9	95%	0.952	50%	0.501	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.3	30.3	-171.5	-60.9	-177.7	179.4	-177.5	0	114.3
490	E	71	Confident	70.9	Confident	108 Å²	108	101.2 Å²	101.2	51%	0.505	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	137.4	177.3	-62.8	-162.4	144.9	0	0	111.4	P484 C485 C488 F492 H501	P484-E490 WeakPolarHBondContact CA-O 3.34Å; C485-E490 PolarHBondContact N-O 3.48Å; C488-E490 PolarHBondContact O-N 2.97Å; E490-F492 HydrophobicContact CB-CE2 3.61Å; E490-F492 HydrophobicContact CB-CZ 3.74Å; E490-F492 WeakPolarHBondContact OE2-CZ 3.42Å; E490-H501 IonicContact OE2-CE1 3.33Å; E490-H501 PolarHBondContact OE2-CE1 3.04Å; E490-H501 IonicContact OE2-ND1 3.64Å; E490-H501 PolarHBondContact OE2-ND1 3.31Å
491	E	76.2	Confident	72	Confident	108 Å²	108	95.3 Å²	95.3	51%	0.505	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	119.7	-177.7	-67	-176.1	159.2	0	0	111.5	R482	R482-E491 HydrophobicContact CB-CB 4.02Å; R482-E491 WeakPolarHBondContact CD-OE2 3.37Å; R482-E491 IonicContact CZ-OE2 3.68Å; R482-E491 IonicContact NE-OE2 3.77Å; R482-E491 IonicContact NH1-OE2 2.78Å; R482-E491 PolarHBondContact NH1-OE2 3.03Å
492	F	78.1	Confident	72.5	Confident	37 Å²	37	87.6 Å²	87.6	16%	0.162	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	145.1	-175.7	-67	-79	0	0	0	113	R482 F483 C485 E490 S494 L498 H501	R482-F492 CarbonylContact C-O 3.52Å; R482-F492 WeakPolarHBondContact CA-O 3.33Å; F483-F492 PolarHBondContact N-O 3.39Å; F483-F492 PolarHBondContact O-N 2.93Å; C485-F492 HydrophobicContact CB-CE2 4.4Å; E490-F492 HydrophobicContact CB-CE2 3.61Å; E490-F492 HydrophobicContact CB-CZ 3.74Å; E490-F492 WeakPolarHBondContact OE2-CZ 3.42Å; F492-S494 PolarHBondContact O-N 2.93Å; F492-L498 HydrophobicContact CB-CB 4.22Å; F492-L498 HydrophobicContact CD2-CB 4.39Å; F492-L498 HydrophobicContact CD2-CD1 3.95Å; F492-H501 HydrophobicContact CD2-CB 4.2Å; F492-H501 HydrophobicContact CE1-CB 4.06Å; F492-H501 HydrophobicContact CE2-CB 3.7Å; F492-H501 AromaticContact CE2-CD2 3.88Å; F492-H501 AromaticContact CE2-CG 3.35Å; F492-H501 AromaticContact CE2-ND1 3.56Å; F492-H501 HydrophobicContact CZ-CB 3.65Å; F492-H501 AromaticContact CZ-CE1 3.96Å; F492-H501 AromaticContact CZ-CG 3.35Å; F492-H501 AromaticContact CZ-ND1 3.14Å; F492-H501 WeakPolarHBondContact CZ-ND1 3.27Å
493	P	75.8	Confident	72.1	Confident	108 Å²	108	84.5 Å²	84.5	70%	0.701	43%	0.431	S	S	*	.	S	Bend	trans	-76.4	-4.7	-179.1	31.7	-36.3	0	0	0	114.3
494	S	78	Confident	71.7	Confident	50 Å²	50	85.2 Å²	85.2	35%	0.35	44%	0.444	S	S	.	.	S	Bend	trans	-152.3	148.5	-179.3	173.5	0	0	0	0	111.6	F492 H496 T497 L498	F492-S494 PolarHBondContact O-N 2.93Å; S494-H496 PolarHBondContact O-N 3.2Å; S494-H496 PolarHBondContact OG-N 2.81Å; S494-T497 WeakPolarHBondContact CA-OG1 3.05Å; S494-T497 WeakPolarHBondContact CB-OG1 3.34Å; S494-T497 PolarHBondContact N-OG1 3.31Å; S494-T497 VanDerWaalsContact N-OG1 3.17Å; S494-T497 PolarHBondContact O-N 2.91Å; S494-T497 VanDerWaalsContact O-N 3.16Å; S494-T497 PolarHBondContact O-OG1 3.37Å; S494-L498 PolarHBondContact O-N 2.92Å
495	L	78.5	Confident	71.1	Confident	108 Å²	108	87.9 Å²	87.9	57%	0.565	45%	0.45	S	S	*	.	H	α-helix	trans	-55.4	-39.4	170.8	-78.2	171.6	0	0	0	112.1	F483 T497 L498 E499	F483-L495 HydrophobicContact CD1-CD2 3.36Å; F483-L495 HydrophobicContact CD1-CG 3.81Å; F483-L495 HydrophobicContact CD2-CG 4.34Å; F483-L495 HydrophobicContact CE1-CD1 4.18Å; F483-L495 HydrophobicContact CE1-CD2 3.5Å; F483-L495 HydrophobicContact CE1-CG 3.55Å; F483-L495 HydrophobicContact CE2-CG 4.12Å; F483-L495 HydrophobicContact CG-CD2 3.95Å; F483-L495 HydrophobicContact CG-CG 4.19Å; F483-L495 HydrophobicContact CZ-CD1 4.3Å; F483-L495 HydrophobicContact CZ-CD2 4.2Å; F483-L495 HydrophobicContact CZ-CG 3.72Å; L495-T497 VanDerWaalsContact C-N 3.32Å; L495-T497 PolarHBondContact O-N 2.99Å; L495-L498 PolarHBondContact O-N 3.49Å; L495-E499 WeakPolarHBondContact O-CB 3.49Å; L495-E499 PolarHBondContact O-N 2.91Å
496	H	76.6	Confident	70.8	Confident	125 Å²	125	90.1 Å²	90.1	58%	0.579	46%	0.46	S	S	*	.	H	α-helix	trans	-65.8	-36.1	179.2	-176	57.9	0	0	0	112.3	S494 E499 Q500	S494-H496 PolarHBondContact O-N 3.2Å; S494-H496 PolarHBondContact OG-N 2.81Å; H496-E499 IonicContact ND1-OE2 3.48Å; H496-Q500 WeakPolarHBondContact O-CB 3.2Å; H496-Q500 PolarHBondContact O-N 2.95Å
497	T	76.6	Confident	70.6	Confident	45 Å²	45	84.3 Å²	84.3	28%	0.276	43%	0.434	S	S	.	.	H	α-helix	trans	-73.2	-31.8	173.8	43.5	0	0	0	0	112.4	S494 L495 H501	S494-T497 WeakPolarHBondContact CA-OG1 3.05Å; S494-T497 WeakPolarHBondContact CB-OG1 3.34Å; S494-T497 PolarHBondContact N-OG1 3.31Å; S494-T497 VanDerWaalsContact N-OG1 3.17Å; S494-T497 PolarHBondContact O-N 2.91Å; S494-T497 VanDerWaalsContact O-N 3.16Å; S494-T497 PolarHBondContact O-OG1 3.37Å; L495-T497 VanDerWaalsContact C-N 3.32Å; L495-T497 PolarHBondContact O-N 2.99Å; T497-H501 WeakPolarHBondContact O-CB 3.42Å; T497-H501 PolarHBondContact O-N 3.45Å
498	L	75.8	Confident	71	Confident	29 Å²	29	81.4 Å²	81.4	15%	0.152	43%	0.425	C	S	.	.	H	α-helix	trans	-66.7	-45.8	170.2	174.5	63.8	0	0	0	110.8	F483 C485 F492 S494 L495 H501 T502	F483-L498 HydrophobicContact CB-CB 4.12Å; F483-L498 HydrophobicContact CB-CD2 3.84Å; C485-L498 HydrophobicContact CB-CD1 3.78Å; F492-L498 HydrophobicContact CB-CB 4.22Å; F492-L498 HydrophobicContact CD2-CB 4.39Å; F492-L498 HydrophobicContact CD2-CD1 3.95Å; S494-L498 PolarHBondContact O-N 2.92Å; L495-L498 PolarHBondContact O-N 3.49Å; L498-H501 CarbonylContact O-C 3.57Å; L498-H501 WeakPolarHBondContact O-CB 3.45Å; L498-H501 PolarHBondContact O-N 3.09Å; L498-T502 HydrophobicContact CD1-CG2 3.78Å; L498-T502 HydrophobicContact CG-CG2 4.24Å; L498-T502 WeakPolarHBondContact O-CG2 3.39Å; L498-T502 PolarHBondContact O-N 3.01Å; L498-T502 PolarHBondContact O-OG1 3.4Å; L498-T502 VanDerWaalsContact O-OG1 3.12Å
499	E	70.5	Confident	71.2	Confident	123 Å²	123	82.3 Å²	82.3	58%	0.575	43%	0.425	S	S	*	.	H	α-helix	trans	-60.8	-45	177.9	-175.8	-175.5	-161.7	0	0	111.3	L495 H496 H501 T502 L503	L495-E499 WeakPolarHBondContact O-CB 3.49Å; L495-E499 PolarHBondContact O-N 2.91Å; H496-E499 IonicContact ND1-OE2 3.48Å; E499-H501 VanDerWaalsContact C-N 3.34Å; E499-H501 PolarHBondContact O-N 3.17Å; E499-T502 PolarHBondContact O-N 3Å; E499-T502 PolarHBondContact O-OG1 2.8Å; E499-T502 VanDerWaalsContact O-OG1 3.13Å; E499-L503 VanDerWaalsContact O-CB 3.23Å; E499-L503 WeakPolarHBondContact O-CB 3.38Å; E499-L503 PolarHBondContact O-N 2.76Å
500	Q	70.6	Confident	71.5	Confident	128 Å²	128	77.5 Å²	77.5	60%	0.598	40%	0.401	S	S	*	.	H	α-helix	trans	-64.5	-39.6	174.4	-171.1	178.7	13.9	0	0	111.9	H496 S504	H496-Q500 WeakPolarHBondContact O-CB 3.2Å; H496-Q500 PolarHBondContact O-N 2.95Å; Q500-S504 WeakPolarHBondContact O-CB 3.34Å; Q500-S504 PolarHBondContact O-N 3.31Å; Q500-S504 PolarHBondContact O-OG 2.96Å
501	H	74.3	Confident	72	Confident	20 Å²	20	72.4 Å²	72.4	9%	0.093	38%	0.377	C	S	.	.	H	α-helix	trans	-61.8	-55.3	174.9	171.2	91.1	0	0	0	110.9	C485 C488 E490 F492 T497 L498 E499 L503 S504 Q505 H506	C485-H501 PolarHBondContact SG-NE2 3.46Å; C485-H501 VanDerWaalsContact SG-NE2 3.45Å; C488-H501 PolarHBondContact SG-CE1 3.39Å; C488-H501 PolarHBondContact SG-NE2 3.28Å; E490-H501 IonicContact OE2-CE1 3.33Å; E490-H501 PolarHBondContact OE2-CE1 3.04Å; E490-H501 IonicContact OE2-ND1 3.64Å; E490-H501 PolarHBondContact OE2-ND1 3.31Å; F492-H501 HydrophobicContact CD2-CB 4.2Å; F492-H501 HydrophobicContact CE1-CB 4.06Å; F492-H501 HydrophobicContact CE2-CB 3.7Å; F492-H501 AromaticContact CE2-CD2 3.88Å; F492-H501 AromaticContact CE2-CG 3.35Å; F492-H501 AromaticContact CE2-ND1 3.56Å; F492-H501 HydrophobicContact CZ-CB 3.65Å; F492-H501 AromaticContact CZ-CE1 3.96Å; F492-H501 AromaticContact CZ-CG 3.35Å; F492-H501 AromaticContact CZ-ND1 3.14Å; F492-H501 WeakPolarHBondContact CZ-ND1 3.27Å; T497-H501 WeakPolarHBondContact O-CB 3.42Å; T497-H501 PolarHBondContact O-N 3.45Å; L498-H501 CarbonylContact O-C 3.57Å; L498-H501 WeakPolarHBondContact O-CB 3.45Å; L498-H501 PolarHBondContact O-N 3.09Å; E499-H501 VanDerWaalsContact C-N 3.34Å; E499-H501 PolarHBondContact O-N 3.17Å; H501-L503 VanDerWaalsContact C-N 3.26Å; H501-L503 PolarHBondContact O-N 2.86Å; H501-S504 WeakPolarHBondContact O-CA 3.28Å; H501-S504 PolarHBondContact O-N 3.27Å; H501-S504 PolarHBondContact O-OG 3.24Å; H501-Q505 WeakPolarHBondContact CE1-CG 3.46Å; H501-Q505 PolarHBondContact O-N 3.21Å; H501-H506 AromaticContact NE2-CD2 3.71Å; H501-H506 AromaticContact NE2-NE2 3.88Å
502	T	68.5	Low	72.1	Confident	43 Å²	43	70.2 Å²	70.2	26%	0.264	37%	0.367	S	S	.	.	H	α-helix	trans	-61.9	-38.4	-177.2	54.2	0	0	0	0	110	L498 E499 S504 H506 G507	L498-T502 HydrophobicContact CD1-CG2 3.78Å; L498-T502 HydrophobicContact CG-CG2 4.24Å; L498-T502 WeakPolarHBondContact O-CG2 3.39Å; L498-T502 PolarHBondContact O-N 3.01Å; L498-T502 PolarHBondContact O-OG1 3.4Å; L498-T502 VanDerWaalsContact O-OG1 3.12Å; E499-T502 PolarHBondContact O-N 3Å; E499-T502 PolarHBondContact O-OG1 2.8Å; E499-T502 VanDerWaalsContact O-OG1 3.13Å; T502-S504 VanDerWaalsContact C-N 3.3Å; T502-S504 PolarHBondContact O-N 2.89Å; T502-H506 CarbonylContact O-C 3.6Å; T502-H506 VanDerWaalsContact O-C 3.26Å; T502-H506 VanDerWaalsContact O-CA 3.24Å; T502-H506 WeakPolarHBondContact O-CA 3.47Å; T502-H506 WeakPolarHBondContact O-CB 3.46Å; T502-H506 PolarHBondContact O-N 3.25Å; T502-G507 PolarHBondContact O-N 3.25Å
503	L	66.6	Low	72.1	Confident	71 Å²	71	72.9 Å²	72.9	37%	0.372	38%	0.382	S	S	.	.	H	α-helix	trans	-60.8	-38.5	172.5	-153.9	77.1	0	0	0	113.1	E499 H501 Y509	E499-L503 VanDerWaalsContact O-CB 3.23Å; E499-L503 WeakPolarHBondContact O-CB 3.38Å; E499-L503 PolarHBondContact O-N 2.76Å; H501-L503 VanDerWaalsContact C-N 3.26Å; H501-L503 PolarHBondContact O-N 2.86Å; L503-Y509 HydrophobicContact CD1-CE1 4.49Å; L503-Y509 HydrophobicContact CD1-CE2 3.7Å; L503-Y509 WeakPolarHBondContact CD1-OH 3.48Å; L503-Y509 HydrophobicContact CD2-CE2 4.21Å; L503-Y509 WeakPolarHBondContact CD2-OH 3.49Å; L503-Y509 HydrophobicContact CG-CE2 4.07Å
504	S	62.4	Low	72.4	Confident	77 Å²	77	70.8 Å²	70.8	54%	0.538	37%	0.369	S	S	.	.	H	α-helix	trans	-78.8	-34.3	-177.3	76.2	0	0	0	0	114.9	Q500 H501 T502	Q500-S504 WeakPolarHBondContact O-CB 3.34Å; Q500-S504 PolarHBondContact O-N 3.31Å; Q500-S504 PolarHBondContact O-OG 2.96Å; H501-S504 WeakPolarHBondContact O-CA 3.28Å; H501-S504 PolarHBondContact O-N 3.27Å; H501-S504 PolarHBondContact O-OG 3.24Å; T502-S504 VanDerWaalsContact C-N 3.3Å; T502-S504 PolarHBondContact O-N 2.89Å
505	Q	59.7	Low	72.5	Confident	129 Å²	129	73.4 Å²	73.4	60%	0.603	38%	0.376	S	S	*	.	H	α-helix	trans	-105.1	-25.5	-175.1	-62.3	-50.9	-64.7	0	0	113.7	H501	H501-Q505 WeakPolarHBondContact CE1-CG 3.46Å; H501-Q505 PolarHBondContact O-N 3.21Å
506	H	64.9	Low	72.5	Confident	56 Å²	56	69.8 Å²	69.8	26%	0.259	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-134.9	-10.5	-164.5	-63.4	-63.4	0	0	0	114.3	Q487 C488 H501 T502	Q487-H506 WeakPolarHBondContact CB-CE1 3.46Å; Q487-H506 VanDerWaalsContact CB-ND1 3.32Å; Q487-H506 WeakPolarHBondContact CB-ND1 3.47Å; Q487-H506 PolarHBondContact O-CE1 2.84Å; Q487-H506 VanDerWaalsContact OE1-CG 3.28Å; Q487-H506 PolarHBondContact OE1-ND1 3.14Å; C488-H506 WeakPolarHBondContact CB-NE2 3.42Å; H501-H506 AromaticContact NE2-CD2 3.71Å; H501-H506 AromaticContact NE2-NE2 3.88Å; T502-H506 CarbonylContact O-C 3.6Å; T502-H506 VanDerWaalsContact O-C 3.26Å; T502-H506 VanDerWaalsContact O-CA 3.24Å; T502-H506 WeakPolarHBondContact O-CA 3.47Å; T502-H506 WeakPolarHBondContact O-CB 3.46Å; T502-H506 PolarHBondContact O-N 3.25Å
507	G	61.8	Low	72.8	Confident	24 Å²	24	68.2 Å²	68.2	25%	0.247	35%	0.354	C	S	.	.			trans	-99.9	87.6	-170.9	0	0	0	0	0	113.4	T502	T502-G507 PolarHBondContact O-N 3.25Å
508	T	68.8	Low	73	Confident	72 Å²	72	68.2 Å²	68.2	44%	0.442	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-86.9	117	166.7	58.4	0	0	0	0	111.1	R510 Q517	T508-R510 PolarHBondContact O-N 2.7Å; T508-Q517 HydrophobicContact CG2-CB 4.32Å
509	Y	70.8	Confident	73	Confident	48 Å²	48	71.1 Å²	71.1	19%	0.188	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	117.3	167.9	-67.5	-83.4	0	0	0	109.9	L503 Q517 F518 R521 L524	L503-Y509 HydrophobicContact CD1-CE1 4.49Å; L503-Y509 HydrophobicContact CD1-CE2 3.7Å; L503-Y509 WeakPolarHBondContact CD1-OH 3.48Å; L503-Y509 HydrophobicContact CD2-CE2 4.21Å; L503-Y509 WeakPolarHBondContact CD2-OH 3.49Å; L503-Y509 HydrophobicContact CG-CE2 4.07Å; Y509-Q517 CarbonylContact O-C 3.26Å; Y509-Q517 WeakPolarHBondContact O-CA 3.28Å; Y509-F518 WeakPolarHBondContact CB-O 3.47Å; Y509-F518 PolarHBondContact N-O 2.89Å; Y509-F518 PolarHBondContact O-N 3.3Å; Y509-R521 HydrophobicContact CD1-CB 4.23Å; Y509-R521 HydrophobicContact CD1-CG 4.35Å; Y509-R521 HydrophobicContact CD2-CB 4.47Å; Y509-R521 VanDerWaalsContact CD2-N 3.3Å; Y509-R521 HydrophobicContact CE1-CB 3.73Å; Y509-R521 HydrophobicContact CE1-CG 3.93Å; Y509-R521 HydrophobicContact CE2-CB 3.98Å; Y509-L524 HydrophobicContact CD1-CD2 4.46Å
510	R	76.3	Confident	73.3	Confident	118 Å²	118	70.1 Å²	70.1	45%	0.445	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	136.6	-177.4	-160.6	-179.5	-66.3	171	-4.2	111.7	T508 Q515 A516 Q517	T508-R510 PolarHBondContact O-N 2.7Å; R510-Q515 HydrophobicContact CG-CB 4.4Å; R510-Q515 WeakPolarHBondContact CG-O 3.23Å; R510-A516 CarbonylContact C-O 3.59Å; R510-A516 WeakPolarHBondContact CA-O 3.46Å; R510-Q517 HydrophobicContact CG-CG 4.31Å
511	C	81.3	Confident	73.7	Confident	1 Å²	1	68.8 Å²	68.8	1%	0.007	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-78.6	125.4	170.3	-179.4	0	0	0	0	111.1	I513 Q515 A516 F518 L524 H527 H531	C511-I513 PolarHBondContact O-N 2.92Å; C511-I513 PolarHBondContact SG-N 3.18Å; C511-Q515 WeakPolarHBondContact O-CA 3.45Å; C511-Q515 PolarHBondContact O-N 3.43Å; C511-Q515 PolarHBondContact O-OE1 2.95Å; C511-A516 PolarHBondContact N-O 3.4Å; C511-F518 HydrophobicContact CB-CE2 4.47Å; C511-L524 HydrophobicContact CB-CD1 3.71Å; C511-H527 WeakPolarHBondContact CB-NE2 3.31Å; C511-H527 PolarHBondContact SG-NE2 3.44Å; C511-H527 VanDerWaalsContact SG-NE2 3.37Å; C511-H531 VanDerWaalsContact SG-CD2 3.52Å; C511-H531 PolarHBondContact SG-NE2 3.12Å
512	H	78.1	Confident	74	Confident	63 Å²	63	70.7 Å²	70.7	29%	0.292	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-9.6	-178.9	75.9	76.8	0	0	0	115	Y581 L588	H512-Y581 AromaticContact CE1-CE2 3.49Å; H512-Y581 VanDerWaalsContact CE1-CE2 3.49Å; H512-Y581 WeakPolarHBondContact CE1-CE2 3.28Å; H512-Y581 AromaticContact NE2-CD2 3.92Å; H512-Y581 AromaticContact NE2-CE2 3.21Å; H512-Y581 WeakPolarHBondContact NE2-CE2 3.39Å; H512-Y581 AromaticContact NE2-CZ 3.66Å; H512-L588 HydrophobicContact CB-CD1 4.27Å
513	I	78.3	Confident	74.8	Confident	92 Å²	92	70.4 Å²	70.4	47%	0.472	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	-63.7	175.6	-66.3	-170.7	0	0	0	110.8	C511 H531 Y581	C511-I513 PolarHBondContact O-N 2.92Å; C511-I513 PolarHBondContact SG-N 3.18Å; I513-H531 HydrophobicContact CD1-CB 3.88Å; I513-Y581 HydrophobicContact CD1-CE2 3.69Å; I513-Y581 WeakPolarHBondContact CD1-OH 3.45Å; I513-Y581 HydrophobicContact CG1-CE2 4.28Å; I513-Y581 WeakPolarHBondContact CG1-OH 3.36Å
514	C	82.7	Confident	75.7	Confident	64 Å²	64	67.2 Å²	67.2	43%	0.432	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.8	9.2	-175.1	69.3	0	0	0	0	114.6	A516 H527	C514-A516 PolarHBondContact O-N 3.42Å; C514-A516 VanDerWaalsContact SG-CB 3.57Å; C514-H527 PolarHBondContact SG-CE1 2.94Å; C514-H527 PolarHBondContact SG-NE2 3.21Å
515	Q	80	Confident	76.6	Confident	106 Å²	106	66.7 Å²	66.7	50%	0.495	34%	0.339	S	S	.	.			trans	56.8	13	179.7	-52.2	-61.8	-10.7	0	0	115.4	R510 C511	R510-Q515 HydrophobicContact CG-CB 4.4Å; R510-Q515 WeakPolarHBondContact CG-O 3.23Å; C511-Q515 WeakPolarHBondContact O-CA 3.45Å; C511-Q515 PolarHBondContact O-N 3.43Å; C511-Q515 PolarHBondContact O-OE1 2.95Å
516	A	79	Confident	77.8	Confident	32 Å²	32	65 Å²	65	26%	0.264	33%	0.327	S	S	.	.			trans	-61.8	137.5	176.5	0	0	0	0	0	111.6	R510 C511 C514 F518	R510-A516 CarbonylContact C-O 3.59Å; R510-A516 WeakPolarHBondContact CA-O 3.46Å; C511-A516 PolarHBondContact N-O 3.4Å; C514-A516 PolarHBondContact O-N 3.42Å; C514-A516 VanDerWaalsContact SG-CB 3.57Å; A516-F518 HydrophobicContact CB-CE2 3.71Å; A516-F518 HydrophobicContact CB-CZ 3.82Å; A516-F518 WeakPolarHBondContact O-CE2 3.44Å
517	Q	81.6	Confident	78.7	Confident	92 Å²	92	63.9 Å²	63.9	43%	0.43	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	132.7	-174	-67.4	-178.8	13.8	0	0	111.4	T508 Y509 R510	T508-Q517 HydrophobicContact CG2-CB 4.32Å; Y509-Q517 CarbonylContact O-C 3.26Å; Y509-Q517 WeakPolarHBondContact O-CA 3.28Å; R510-Q517 HydrophobicContact CG-CG 4.31Å
518	F	80.3	Confident	79.8	Confident	45 Å²	45	62.8 Å²	62.8	20%	0.197	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	138.5	-177.8	-59.6	-80.3	0	0	0	111.1	Y509 C511 A516 Q520 N523 L524 H527	Y509-F518 WeakPolarHBondContact CB-O 3.47Å; Y509-F518 PolarHBondContact N-O 2.89Å; Y509-F518 PolarHBondContact O-N 3.3Å; C511-F518 HydrophobicContact CB-CE2 4.47Å; A516-F518 HydrophobicContact CB-CE2 3.71Å; A516-F518 HydrophobicContact CB-CZ 3.82Å; A516-F518 WeakPolarHBondContact O-CE2 3.44Å; F518-Q520 PolarHBondContact O-N 3.41Å; F518-N523 HydrophobicContact CB-CB 3.98Å; F518-N523 HydrophobicContact CD1-CB 3.88Å; F518-N523 HydrophobicContact CG-CB 4.17Å; F518-L524 HydrophobicContact CB-CB 4.4Å; F518-L524 HydrophobicContact CD2-CB 4.04Å; F518-L524 HydrophobicContact CD2-CD1 3.95Å; F518-L524 HydrophobicContact CE2-CD1 4.2Å; F518-L524 HydrophobicContact CG-CB 4.44Å; F518-H527 HydrophobicContact CE1-CB 3.99Å; F518-H527 HydrophobicContact CE2-CB 3.76Å; F518-H527 AromaticContact CE2-CD2 3.45Å; F518-H527 VanDerWaalsContact CE2-CD2 3.45Å; F518-H527 WeakPolarHBondContact CE2-CD2 3.43Å; F518-H527 AromaticContact CE2-CG 3.48Å; F518-H527 VanDerWaalsContact CE2-CG 3.48Å; F518-H527 HydrophobicContact CZ-CB 3.44Å; F518-H527 VanDerWaalsContact CZ-CB 3.44Å; F518-H527 AromaticContact CZ-CD2 3.68Å; F518-H527 AromaticContact CZ-CG 3.23Å; F518-H527 AromaticContact CZ-ND1 3.48Å; F518-H527 WeakPolarHBondContact CZ-ND1 3.42Å
519	T	77	Confident	80.5	Confident	89 Å²	89	60.4 Å²	60.4	55%	0.546	30%	0.295	S	S	.	.	S	Bend	trans	-75.2	-5.1	176.9	53.1	0	0	0	0	114.1
520	Q	76.3	Confident	81.1	Confident	102 Å²	102	64.4 Å²	64.4	48%	0.477	31%	0.313	S	S	.	.	S	Bend	trans	-145.4	140.8	-176.9	-59.7	-178.6	-0.5	0	0	111.5	F518 S522 N523 L524	F518-Q520 PolarHBondContact O-N 3.41Å; Q520-S522 VanDerWaalsContact C-N 3.29Å; Q520-S522 PolarHBondContact O-N 3.01Å; Q520-S522 PolarHBondContact OE1-OG 2.91Å; Q520-N523 HydrophobicContact CB-CB 4.34Å; Q520-N523 WeakPolarHBondContact O-CA 3.37Å; Q520-N523 WeakPolarHBondContact O-CB 3.13Å; Q520-N523 PolarHBondContact O-N 3.39Å; Q520-L524 PolarHBondContact O-N 3.35Å; Q520-L524 VanDerWaalsContact O-N 3.11Å
521	R	79.6	Confident	81.5	Confident	101 Å²	101	62 Å²	62	38%	0.381	31%	0.307	S	S	.	.	H	α-helix	trans	-58.8	-39	178	-165.6	171.8	176.9	149.5	-0.4	112.8	Y509 N523 L524 Q525 N586	Y509-R521 HydrophobicContact CD1-CB 4.23Å; Y509-R521 HydrophobicContact CD1-CG 4.35Å; Y509-R521 HydrophobicContact CD2-CB 4.47Å; Y509-R521 VanDerWaalsContact CD2-N 3.3Å; Y509-R521 HydrophobicContact CE1-CB 3.73Å; Y509-R521 HydrophobicContact CE1-CG 3.93Å; Y509-R521 HydrophobicContact CE2-CB 3.98Å; R521-N523 VanDerWaalsContact C-N 3.27Å; R521-N523 PolarHBondContact O-N 2.87Å; R521-L524 PolarHBondContact O-N 3.28Å; R521-Q525 WeakPolarHBondContact O-CG 3.43Å; R521-Q525 PolarHBondContact O-N 2.89Å; R521-N586 PolarHBondContact NE-OD1 3.41Å; R521-N586 PolarHBondContact NH2-O 3.45Å; R521-N586 PolarHBondContact NH2-OD1 2.97Å
522	S	80.5	Confident	81.4	Confident	60 Å²	60	64.5 Å²	64.5	42%	0.42	32%	0.322	S	S	.	.	H	α-helix	trans	-59.6	-35.8	174.1	49.7	0	0	0	0	112.6	Q520 R526	Q520-S522 VanDerWaalsContact C-N 3.29Å; Q520-S522 PolarHBondContact O-N 3.01Å; Q520-S522 PolarHBondContact OE1-OG 2.91Å; S522-R526 WeakPolarHBondContact O-CB 3.44Å; S522-R526 PolarHBondContact O-N 3.49Å
523	N	84.2	Confident	81.6	Confident	36 Å²	36	63.3 Å²	63.3	19%	0.193	33%	0.327	C	S	.	.	H	α-helix	trans	-73.2	-41.2	176.1	-68.7	-24.1	0	0	0	111.2	F518 Q520 R521 R526 H527	F518-N523 HydrophobicContact CB-CB 3.98Å; F518-N523 HydrophobicContact CD1-CB 3.88Å; F518-N523 HydrophobicContact CG-CB 4.17Å; Q520-N523 HydrophobicContact CB-CB 4.34Å; Q520-N523 WeakPolarHBondContact O-CA 3.37Å; Q520-N523 WeakPolarHBondContact O-CB 3.13Å; Q520-N523 PolarHBondContact O-N 3.39Å; R521-N523 VanDerWaalsContact C-N 3.27Å; R521-N523 PolarHBondContact O-N 2.87Å; N523-R526 PolarHBondContact O-N 3.45Å; N523-R526 PolarHBondContact OD1-NH2 3.42Å; N523-H527 VanDerWaalsContact O-CB 3.26Å; N523-H527 WeakPolarHBondContact O-CB 3.44Å; N523-H527 PolarHBondContact O-N 2.82Å
524	L	86.5	Confident	81.7	Confident	5 Å²	5	60.8 Å²	60.8	3%	0.026	31%	0.313	C	S	.	.	H	α-helix	trans	-61	-48.5	171.7	174.4	60.9	0	0	0	111.6	Y509 C511 F518 Q520 R521 R526 H527 A528 S585	Y509-L524 HydrophobicContact CD1-CD2 4.46Å; C511-L524 HydrophobicContact CB-CD1 3.71Å; F518-L524 HydrophobicContact CB-CB 4.4Å; F518-L524 HydrophobicContact CD2-CB 4.04Å; F518-L524 HydrophobicContact CD2-CD1 3.95Å; F518-L524 HydrophobicContact CE2-CD1 4.2Å; F518-L524 HydrophobicContact CG-CB 4.44Å; Q520-L524 PolarHBondContact O-N 3.35Å; Q520-L524 VanDerWaalsContact O-N 3.11Å; R521-L524 PolarHBondContact O-N 3.28Å; L524-R526 PolarHBondContact O-N 3.41Å; L524-H527 CarbonylContact O-C 3.58Å; L524-H527 WeakPolarHBondContact O-CB 3.41Å; L524-H527 PolarHBondContact O-N 2.82Å; L524-A528 VanDerWaalsContact O-CB 3.3Å; L524-A528 WeakPolarHBondContact O-CB 3.25Å; L524-A528 PolarHBondContact O-N 2.89Å; L524-S585 WeakPolarHBondContact CD2-O 3.46Å
525	Q	82.2	Confident	81.8	Confident	66 Å²	66	62 Å²	62	31%	0.308	31%	0.311	S	S	.	.	H	α-helix	trans	-59	-44.3	177.4	-75	177	-10.9	0	0	112.2	R521 H527 A528 L529 L582 N586	R521-Q525 WeakPolarHBondContact O-CG 3.43Å; R521-Q525 PolarHBondContact O-N 2.89Å; Q525-H527 VanDerWaalsContact C-N 3.32Å; Q525-H527 PolarHBondContact O-N 3.46Å; Q525-A528 WeakPolarHBondContact O-CB 3.23Å; Q525-A528 PolarHBondContact O-N 3.21Å; Q525-L529 PolarHBondContact O-N 3.12Å; Q525-L529 VanDerWaalsContact O-N 3.12Å; Q525-L582 HydrophobicContact CB-CD2 4.15Å; Q525-L582 HydrophobicContact CG-CD2 4.36Å; Q525-N586 PolarHBondContact NE2-ND2 3.46Å; Q525-N586 PolarHBondContact NE2-OD1 3.07Å
526	R	83.3	Confident	81.9	Confident	94 Å²	94	57.7 Å²	57.7	36%	0.355	29%	0.292	S	S	.	.	H	α-helix	trans	-65.8	-33.8	176.5	175.6	170.2	58.2	142.5	-1.6	112.9	S522 N523 L524 R548	S522-R526 WeakPolarHBondContact O-CB 3.44Å; S522-R526 PolarHBondContact O-N 3.49Å; N523-R526 PolarHBondContact O-N 3.45Å; N523-R526 PolarHBondContact OD1-NH2 3.42Å; L524-R526 PolarHBondContact O-N 3.41Å; R526-R548 HydrophobicContact CG-CG 4.42Å; R526-R548 VanDerWaalsContact NH1-CZ 3.31Å
527	H	85.4	Confident	82.2	Confident	32 Å²	32	58.1 Å²	58.1	15%	0.148	29%	0.287	C	S	.	.	H	α-helix	trans	-71.4	-40.1	172.6	166.7	80.3	0	0	0	111.5	C511 C514 F518 N523 L524 Q525 L529 K530 H531	C511-H527 WeakPolarHBondContact CB-NE2 3.31Å; C511-H527 PolarHBondContact SG-NE2 3.44Å; C511-H527 VanDerWaalsContact SG-NE2 3.37Å; C514-H527 PolarHBondContact SG-CE1 2.94Å; C514-H527 PolarHBondContact SG-NE2 3.21Å; F518-H527 HydrophobicContact CE1-CB 3.99Å; F518-H527 HydrophobicContact CE2-CB 3.76Å; F518-H527 AromaticContact CE2-CD2 3.45Å; F518-H527 VanDerWaalsContact CE2-CD2 3.45Å; F518-H527 WeakPolarHBondContact CE2-CD2 3.43Å; F518-H527 AromaticContact CE2-CG 3.48Å; F518-H527 VanDerWaalsContact CE2-CG 3.48Å; F518-H527 HydrophobicContact CZ-CB 3.44Å; F518-H527 VanDerWaalsContact CZ-CB 3.44Å; F518-H527 AromaticContact CZ-CD2 3.68Å; F518-H527 AromaticContact CZ-CG 3.23Å; F518-H527 AromaticContact CZ-ND1 3.48Å; F518-H527 WeakPolarHBondContact CZ-ND1 3.42Å; N523-H527 VanDerWaalsContact O-CB 3.26Å; N523-H527 WeakPolarHBondContact O-CB 3.44Å; N523-H527 PolarHBondContact O-N 2.82Å; L524-H527 CarbonylContact O-C 3.58Å; L524-H527 WeakPolarHBondContact O-CB 3.41Å; L524-H527 PolarHBondContact O-N 2.82Å; Q525-H527 VanDerWaalsContact C-N 3.32Å; Q525-H527 PolarHBondContact O-N 3.46Å; H527-L529 VanDerWaalsContact C-N 3.26Å; H527-L529 PolarHBondContact O-N 3.26Å; H527-K530 VanDerWaalsContact O-CB 3.28Å; H527-K530 WeakPolarHBondContact O-CB 3.38Å; H527-K530 PolarHBondContact O-N 3.17Å; H527-H531 AromaticContact CD2-NE2 3.79Å; H527-H531 AromaticContact CE1-NE2 3.45Å; H527-H531 PolarHBondContact CE1-NE2 2.93Å; H527-H531 AromaticContact NE2-CD2 3.69Å; H527-H531 AromaticContact NE2-CE1 3.97Å; H527-H531 AromaticContact NE2-NE2 2.94Å; H527-H531 PolarHBondContact NE2-NE2 3.45Å
528	A	83.4	Confident	82.4	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-55.5	-38.8	174.7	0	0	0	0	0	112.3	L524 Q525 K530 H531 V532 Y581 L582	L524-A528 VanDerWaalsContact O-CB 3.3Å; L524-A528 WeakPolarHBondContact O-CB 3.25Å; L524-A528 PolarHBondContact O-N 2.89Å; Q525-A528 WeakPolarHBondContact O-CB 3.23Å; Q525-A528 PolarHBondContact O-N 3.21Å; A528-K530 PolarHBondContact O-N 2.89Å; A528-K530 VanDerWaalsContact O-N 3.17Å; A528-H531 PolarHBondContact O-N 3.47Å; A528-H531 VanDerWaalsContact O-N 3.12Å; A528-V532 PolarHBondContact O-N 2.97Å; A528-Y581 HydrophobicContact CB-CD1 3.94Å; A528-Y581 HydrophobicContact CB-CE1 3.43Å; A528-Y581 VanDerWaalsContact CB-CE1 3.43Å; A528-Y581 WeakPolarHBondContact O-CE1 3.49Å; A528-L582 HydrophobicContact CB-CD2 4.37Å
529	L	84.4	Confident	82.7	Confident	23 Å²	23	53.6 Å²	53.6	12%	0.12	27%	0.267	C	S	.	.	H	α-helix	trans	-56.7	-27.9	172.2	-66.3	177.6	0	0	0	114.2	Q525 H527 G533 F534 P536 Y547 L582	Q525-L529 PolarHBondContact O-N 3.12Å; Q525-L529 VanDerWaalsContact O-N 3.12Å; H527-L529 VanDerWaalsContact C-N 3.26Å; H527-L529 PolarHBondContact O-N 3.26Å; L529-G533 PolarHBondContact O-N 3.06Å; L529-F534 HydrophobicContact CD2-CB 4.4Å; L529-F534 HydrophobicContact CD2-CD1 3.95Å; L529-F534 PolarHBondContact O-N 2.9Å; L529-P536 HydrophobicContact CD1-CG 4.16Å; L529-Y547 HydrophobicContact CB-CD1 4.16Å; L529-Y547 WeakPolarHBondContact O-CE1 3.33Å; L529-L582 HydrophobicContact CD2-CD1 4.26Å; L529-L582 HydrophobicContact CD2-CD2 4.26Å
530	K	83.4	Confident	83	Confident	131 Å²	131	56.5 Å²	56.5	57%	0.57	27%	0.268	S	S	*	.	H	α-helix	trans	-69.8	-38.1	177.2	-63.6	-168.3	173.3	-167.6	0	112	H527 A528 G533	H527-K530 VanDerWaalsContact O-CB 3.28Å; H527-K530 WeakPolarHBondContact O-CB 3.38Å; H527-K530 PolarHBondContact O-N 3.17Å; A528-K530 PolarHBondContact O-N 2.89Å; A528-K530 VanDerWaalsContact O-N 3.17Å; K530-G533 PolarHBondContact O-N 3Å
531	H	83.3	Confident	83.3	Confident	67 Å²	67	54.1 Å²	54.1	31%	0.31	26%	0.26	S	S	.	.	H	α-helix	trans	-68.2	-37.1	179	-67.9	-60.1	0	0	0	112.8	C511 I513 H527 A528 G533 Y581	C511-H531 VanDerWaalsContact SG-CD2 3.52Å; C511-H531 PolarHBondContact SG-NE2 3.12Å; I513-H531 HydrophobicContact CD1-CB 3.88Å; H527-H531 AromaticContact CD2-NE2 3.79Å; H527-H531 AromaticContact CE1-NE2 3.45Å; H527-H531 PolarHBondContact CE1-NE2 2.93Å; H527-H531 AromaticContact NE2-CD2 3.69Å; H527-H531 AromaticContact NE2-CE1 3.97Å; H527-H531 AromaticContact NE2-NE2 2.94Å; H527-H531 PolarHBondContact NE2-NE2 3.45Å; A528-H531 PolarHBondContact O-N 3.47Å; A528-H531 VanDerWaalsContact O-N 3.12Å; H531-G533 PolarHBondContact O-N 3.47Å; H531-Y581 HydrophobicContact CB-CE1 4.33Å; H531-Y581 PolarHBondContact CD2-OH 2.95Å
532	V	80.6	Confident	83.6	Confident	55 Å²	55	51.9 Å²	51.9	33%	0.333	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-10.6	176.5	-169.9	0	0	0	0	111.7	A528 F534 Y581	A528-V532 PolarHBondContact O-N 2.97Å; V532-F534 HydrophobicContact CB-CB 4.32Å; V532-F534 HydrophobicContact CG1-CB 4.14Å; V532-F534 PolarHBondContact O-N 3.01Å; V532-Y581 HydrophobicContact CG2-CD1 3.26Å; V532-Y581 HydrophobicContact CG2-CD2 4.19Å; V532-Y581 HydrophobicContact CG2-CE1 3.81Å; V532-Y581 HydrophobicContact CG2-CG 3.49Å; V532-Y581 VanDerWaalsContact CG2-CG 3.49Å
533	G	81.6	Confident	83.7	Confident	37 Å²	37	52.7 Å²	52.7	38%	0.381	27%	0.265	S	S	.	.			trans	68	-2.6	-171.1	0	0	0	0	0	114.7	L529 K530 H531 K535	L529-G533 PolarHBondContact O-N 3.06Å; K530-G533 PolarHBondContact O-N 3Å; H531-G533 PolarHBondContact O-N 3.47Å; G533-K535 PolarHBondContact O-N 3.41Å
534	F	80.5	Confident	83.8	Confident	40 Å²	40	55.1 Å²	55.1	18%	0.175	27%	0.274	C	S	.	.			trans	-68.5	118.7	-171.8	-172	-111.8	0	0	0	112.5	L529 V532 P536 Y547 H572 T574	L529-F534 HydrophobicContact CD2-CB 4.4Å; L529-F534 HydrophobicContact CD2-CD1 3.95Å; L529-F534 PolarHBondContact O-N 2.9Å; V532-F534 HydrophobicContact CB-CB 4.32Å; V532-F534 HydrophobicContact CG1-CB 4.14Å; V532-F534 PolarHBondContact O-N 3.01Å; F534-P536 HydrophobicContact CD1-CB 4.36Å; F534-P536 HydrophobicContact CE1-CB 3.84Å; F534-P536 HydrophobicContact CE1-CG 4.43Å; F534-P536 WeakPolarHBondContact O-CD 3.37Å; F534-Y547 VanDerWaalsContact O-CD1 3.26Å; F534-Y547 WeakPolarHBondContact O-CD1 3.5Å; F534-Y547 WeakPolarHBondContact O-CE1 3.43Å; F534-H572 HydrophobicContact CE2-CB 4.2Å; F534-H572 HydrophobicContact CZ-CB 3.79Å; F534-H572 WeakPolarHBondContact CZ-O 3.44Å; F534-T574 HydrophobicContact CD1-CG2 4.48Å; F534-T574 HydrophobicContact CE1-CG2 3.91Å
535	K	84.9	Confident	83.8	Confident	90 Å²	90	56.4 Å²	56.4	39%	0.391	29%	0.286	S	S	.	.			trans	-109.2	88.5	-178.8	-74.7	162	168.9	-178.6	0	109.9	G533 F537 A545 Y546 Y547	G533-K535 PolarHBondContact O-N 3.41Å; K535-F537 VanDerWaalsContact C-N 3.25Å; K535-F537 PolarHBondContact O-N 2.75Å; K535-F537 VanDerWaalsContact O-N 3.16Å; K535-A545 HydrophobicContact CB-CB 3.64Å; K535-A545 HydrophobicContact CD-CB 4.19Å; K535-A545 WeakPolarHBondContact CD-O 3.27Å; K535-Y546 CarbonylContact C-O 3.58Å; K535-Y547 HydrophobicContact CD-CE2 4.45Å; K535-Y547 WeakPolarHBondContact CE-OH 3.49Å; K535-Y547 HydrophobicContact CG-CD1 3.88Å; K535-Y547 HydrophobicContact CG-CD2 4.27Å; K535-Y547 HydrophobicContact CG-CE1 3.6Å; K535-Y547 HydrophobicContact CG-CE2 4.02Å; K535-Y547 HydrophobicContact CG-CG 4.2Å
536	P	82.7	Confident	83.9	Confident	15 Å²	15	55.9 Å²	55.9	10%	0.097	28%	0.281	C	S	.	.			trans	-65.1	-18.3	-171.7	20.1	-31.8	0	0	0	115.5	L529 F534 V571 H572	L529-P536 HydrophobicContact CD1-CG 4.16Å; F534-P536 HydrophobicContact CD1-CB 4.36Å; F534-P536 HydrophobicContact CE1-CB 3.84Å; F534-P536 HydrophobicContact CE1-CG 4.43Å; F534-P536 WeakPolarHBondContact O-CD 3.37Å; P536-V571 CarbonylContact O-C 3.54Å; P536-V571 VanDerWaalsContact O-CA 3.25Å; P536-V571 WeakPolarHBondContact O-CA 3.39Å; P536-H572 PolarHBondContact O-N 2.9Å
537	F	85.2	Confident	84	Confident	40 Å²	40	54.6 Å²	54.6	18%	0.175	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	103	-172.8	-60.4	-78.4	0	0	0	111.8	K535 A545 Y546 K549 L552 I569 V571	K535-F537 VanDerWaalsContact C-N 3.25Å; K535-F537 PolarHBondContact O-N 2.75Å; K535-F537 VanDerWaalsContact O-N 3.16Å; F537-A545 CarbonylContact O-C 3.53Å; F537-A545 WeakPolarHBondContact O-CA 3.46Å; F537-Y546 PolarHBondContact N-O 2.89Å; F537-Y546 VanDerWaalsContact N-O 3.08Å; F537-Y546 PolarHBondContact O-N 3.42Å; F537-K549 HydrophobicContact CD1-CB 3.97Å; F537-K549 HydrophobicContact CD1-CG 4.32Å; F537-K549 HydrophobicContact CD2-CB 4.48Å; F537-K549 VanDerWaalsContact CD2-N 3.3Å; F537-K549 HydrophobicContact CE1-CB 3.73Å; F537-K549 HydrophobicContact CE1-CD 4.47Å; F537-K549 HydrophobicContact CE1-CG 4.23Å; F537-K549 HydrophobicContact CE2-CB 4.26Å; F537-K549 HydrophobicContact CG-CB 4.35Å; F537-K549 HydrophobicContact CZ-CB 3.89Å; F537-L552 HydrophobicContact CB-CB 4.2Å; F537-L552 HydrophobicContact CB-CD2 3.74Å; F537-I569 HydrophobicContact CD1-CG2 4.35Å; F537-V571 HydrophobicContact CD1-CG2 3.98Å; F537-V571 HydrophobicContact CE1-CG1 4.48Å; F537-V571 HydrophobicContact CE1-CG2 3.99Å
538	E	85.5	Confident	84	Confident	42 Å²	42	55.6 Å²	55.6	20%	0.196	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	137.8	-179.9	-168.7	-168.6	158.4	0	0	112.8	S543 A545 T570 H572	E538-S543 WeakPolarHBondContact OE1-CA 3.44Å; E538-S543 VanDerWaalsContact OE1-CB 3.23Å; E538-S543 WeakPolarHBondContact OE1-CB 3.29Å; E538-S543 PolarHBondContact OE1-OG 3.01Å; E538-A545 HydrophobicContact CB-CB 4.31Å; E538-A545 HydrophobicContact CG-CB 4.34Å; E538-T570 PolarHBondContact N-O 3.24Å; E538-T570 PolarHBondContact O-N 2.91Å; E538-H572 IonicContact OE2-CD2 3.73Å; E538-H572 IonicContact OE2-CE1 3.12Å; E538-H572 IonicContact OE2-NE2 3.68Å; E538-H572 PolarHBondContact OE2-NE2 3.42Å
539	C	86.2	Confident	84.2	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	117.9	170.3	176.8	0	0	0	0	111.8	V541 C542 S543 K544 L552 H555 M556 H560	C539-V541 PolarHBondContact O-N 3Å; C539-V541 PolarHBondContact SG-N 3.17Å; C539-V541 VanDerWaalsContact SG-N 3.35Å; C539-C542 PolarHBondContact SG-N 2.92Å; C539-S543 WeakPolarHBondContact O-CA 3.4Å; C539-S543 PolarHBondContact O-N 3.47Å; C539-K544 WeakPolarHBondContact CB-O 3.46Å; C539-K544 PolarHBondContact N-O 3.18Å; C539-L552 HydrophobicContact CB-CD1 3.58Å; C539-H555 PolarHBondContact SG-NE2 2.69Å; C539-M556 HydrophobicContact CB-CE 3.85Å; C539-M556 WeakPolarHBondContact SG-CE 3.42Å; C539-H560 VanDerWaalsContact SG-CD2 3.54Å
540	R	82.4	Confident	84.2	Confident	150 Å²	150	63.6 Å²	63.6	57%	0.566	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-12.2	175.6	-68.5	-172.3	179.6	175.3	-16.2	115.3	D567 N568 T570	R540-D567 PolarHBondContact NH1-O 3.19Å; R540-N568 HydrophobicContact CB-CB 4.23Å; R540-N568 WeakPolarHBondContact CB-O 3.24Å; R540-N568 WeakPolarHBondContact CG-O 3.26Å; R540-N568 PolarHBondContact N-O 2.98Å; R540-T570 WeakPolarHBondContact CG-OG1 3.4Å; R540-T570 PolarHBondContact NE-OG1 3.31Å
541	V	83.5	Confident	84.5	Confident	53 Å²	53	58.7 Å²	58.7	32%	0.321	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93	-31.2	-175.9	-170.9	0	0	0	0	112.2	C539 M556 F563 N568	C539-V541 PolarHBondContact O-N 3Å; C539-V541 PolarHBondContact SG-N 3.17Å; C539-V541 VanDerWaalsContact SG-N 3.35Å; V541-M556 HydrophobicContact CG2-SD 4.36Å; V541-F563 HydrophobicContact CG1-CE2 4.2Å; V541-F563 HydrophobicContact CG1-CZ 4.33Å; V541-F563 HydrophobicContact CG2-CD1 4.21Å; V541-F563 HydrophobicContact CG2-CD2 4.48Å; V541-F563 HydrophobicContact CG2-CE1 4.46Å; V541-F563 HydrophobicContact CG2-CG 4.18Å; V541-N568 HydrophobicContact CG2-CB 4.31Å; V541-N568 WeakPolarHBondContact CG2-ND2 3.38Å
542	C	86.7	Confident	84.7	Confident	53 Å²	53	55.5 Å²	55.5	36%	0.358	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-136.5	7.9	179.4	70.9	0	0	0	0	115.1	C539 K544 H555 H560	C539-C542 PolarHBondContact SG-N 2.92Å; C542-K544 PolarHBondContact O-N 3.27Å; C542-H555 PolarHBondContact SG-CE1 3.16Å; C542-H555 PolarHBondContact SG-NE2 3.24Å; C542-H560 PolarHBondContact SG-NE2 3.07Å
543	S	82.7	Confident	84.9	Confident	78 Å²	78	56.1 Å²	56.1	55%	0.545	28%	0.281	S	S	.	.			trans	54.9	14.4	-177	-74.2	0	0	0	0	116.5	E538 C539 A545	E538-S543 WeakPolarHBondContact OE1-CA 3.44Å; E538-S543 VanDerWaalsContact OE1-CB 3.23Å; E538-S543 WeakPolarHBondContact OE1-CB 3.29Å; E538-S543 PolarHBondContact OE1-OG 3.01Å; C539-S543 WeakPolarHBondContact O-CA 3.4Å; C539-S543 PolarHBondContact O-N 3.47Å; S543-A545 PolarHBondContact O-N 3.04Å
544	K	85.2	Confident	85.2	Confident	87 Å²	87	58.9 Å²	58.9	38%	0.378	28%	0.28	S	S	.	.			trans	-68.6	123.9	169.8	-70.5	-160.1	176.7	-159.5	0	110.2	C539 C542 Y546 E626	C539-K544 WeakPolarHBondContact CB-O 3.46Å; C539-K544 PolarHBondContact N-O 3.18Å; C542-K544 PolarHBondContact O-N 3.27Å; K544-Y546 HydrophobicContact CB-CE2 3.87Å; K544-Y546 WeakPolarHBondContact O-CD2 3.3Å; K544-Y546 WeakPolarHBondContact O-CE2 3.43Å; K544-E626 IonicContact NZ-OE1 3.51Å; K544-E626 IonicContact NZ-OE2 3.9Å; K544-E626 PolarHBondContact NZ-OE2 3.37Å
545	A	86.2	Confident	85.6	Confident	32 Å²	32	58.5 Å²	58.5	26%	0.264	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	144.4	-179.5	0	0	0	0	0	112.7	K535 F537 E538 S543	K535-A545 HydrophobicContact CB-CB 3.64Å; K535-A545 HydrophobicContact CD-CB 4.19Å; K535-A545 WeakPolarHBondContact CD-O 3.27Å; F537-A545 CarbonylContact O-C 3.53Å; F537-A545 WeakPolarHBondContact O-CA 3.46Å; E538-A545 HydrophobicContact CB-CB 4.31Å; E538-A545 HydrophobicContact CG-CB 4.34Å; S543-A545 PolarHBondContact O-N 3.04Å
546	Y	85.6	Confident	85.6	Confident	54 Å²	54	54.4 Å²	54.4	21%	0.212	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	147.9	-172.1	-64	-87.7	0	0	0	112	K535 F537 K544 R548 H551 L552 H555	K535-Y546 CarbonylContact C-O 3.58Å; F537-Y546 PolarHBondContact N-O 2.89Å; F537-Y546 VanDerWaalsContact N-O 3.08Å; F537-Y546 PolarHBondContact O-N 3.42Å; K544-Y546 HydrophobicContact CB-CE2 3.87Å; K544-Y546 WeakPolarHBondContact O-CD2 3.3Å; K544-Y546 WeakPolarHBondContact O-CE2 3.43Å; Y546-R548 VanDerWaalsContact C-N 3.3Å; Y546-R548 PolarHBondContact O-N 3.31Å; Y546-H551 HydrophobicContact CD1-CB 3.72Å; Y546-H551 HydrophobicContact CG-CB 4.18Å; Y546-L552 HydrophobicContact CD2-CB 3.92Å; Y546-L552 HydrophobicContact CD2-CD1 3.75Å; Y546-L552 HydrophobicContact CD2-CG 4.41Å; Y546-L552 HydrophobicContact CE2-CD1 3.97Å; Y546-L552 HydrophobicContact CG-CB 4.29Å; Y546-H555 HydrophobicContact CE1-CB 4.36Å; Y546-H555 HydrophobicContact CE2-CB 3.88Å; Y546-H555 AromaticContact CE2-CD2 3.8Å; Y546-H555 AromaticContact CE2-CG 3.72Å; Y546-H555 AromaticContact CZ-CG 3.65Å; Y546-H555 WeakPolarHBondContact OH-CB 3.37Å; Y546-H555 PolarHBondContact OH-ND1 3.06Å; Y546-H555 VanDerWaalsContact OH-ND1 3.15Å
547	Y	84.3	Confident	85.7	Confident	67 Å²	67	61.1 Å²	61.1	26%	0.263	29%	0.291	S	S	.	.	S	Bend	trans	-71.6	-21.2	176.4	-62.8	-73.9	0	0	0	114	L529 F534 K535	L529-Y547 HydrophobicContact CB-CD1 4.16Å; L529-Y547 WeakPolarHBondContact O-CE1 3.33Å; F534-Y547 VanDerWaalsContact O-CD1 3.26Å; F534-Y547 WeakPolarHBondContact O-CD1 3.5Å; F534-Y547 WeakPolarHBondContact O-CE1 3.43Å; K535-Y547 HydrophobicContact CD-CE2 4.45Å; K535-Y547 WeakPolarHBondContact CE-OH 3.49Å; K535-Y547 HydrophobicContact CG-CD1 3.88Å; K535-Y547 HydrophobicContact CG-CD2 4.27Å; K535-Y547 HydrophobicContact CG-CE1 3.6Å; K535-Y547 HydrophobicContact CG-CE2 4.02Å; K535-Y547 HydrophobicContact CG-CG 4.2Å
548	R	86.2	Confident	85.7	Confident	54 Å²	54	66.3 Å²	66.3	20%	0.204	32%	0.317	C	S	.	.	S	Bend	trans	-136.6	145.9	-176.2	-58.9	156.5	57.6	174.8	0.2	110.9	R526 Y546 D550 H551 L552 D630	R526-R548 HydrophobicContact CG-CG 4.42Å; R526-R548 VanDerWaalsContact NH1-CZ 3.31Å; Y546-R548 VanDerWaalsContact C-N 3.3Å; Y546-R548 PolarHBondContact O-N 3.31Å; R548-D550 VanDerWaalsContact C-N 3.32Å; R548-D550 WeakPolarHBondContact CB-OD1 3.46Å; R548-D550 IonicContact CZ-OD1 2.65Å; R548-D550 IonicContact CZ-OD2 3.98Å; R548-D550 IonicContact NE-OD1 3.72Å; R548-D550 PolarHBondContact NE-OD1 3.4Å; R548-D550 IonicContact NE-OD2 2.85Å; R548-D550 PolarHBondContact NE-OD2 2.7Å; R548-D550 IonicContact NH2-OD1 2.64Å; R548-D550 IonicContact NH2-OD2 3.85Å; R548-D550 PolarHBondContact NH2-OD2 2.94Å; R548-D550 PolarHBondContact O-N 3.22Å; R548-H551 PolarHBondContact NH1-NE2 3.3Å; R548-H551 PolarHBondContact O-N 3.44Å; R548-L552 PolarHBondContact O-N 2.74Å; R548-D630 IonicContact CZ-OD2 3.7Å; R548-D630 IonicContact NH1-OD1 3.3Å; R548-D630 PolarHBondContact NH1-OD1 2.81Å; R548-D630 IonicContact NH1-OD2 2.82Å; R548-D630 PolarHBondContact NH1-OD2 3.45Å
549	K	86.6	Confident	85.5	Confident	117 Å²	117	66.3 Å²	66.3	51%	0.509	33%	0.329	S	S	.	.	H	α-helix	trans	-59.2	-40.4	177.4	-172.5	175.2	-179.7	175.4	0	112.6	F537 H551 L552 M553 I569	F537-K549 HydrophobicContact CD1-CB 3.97Å; F537-K549 HydrophobicContact CD1-CG 4.32Å; F537-K549 HydrophobicContact CD2-CB 4.48Å; F537-K549 VanDerWaalsContact CD2-N 3.3Å; F537-K549 HydrophobicContact CE1-CB 3.73Å; F537-K549 HydrophobicContact CE1-CD 4.47Å; F537-K549 HydrophobicContact CE1-CG 4.23Å; F537-K549 HydrophobicContact CE2-CB 4.26Å; F537-K549 HydrophobicContact CG-CB 4.35Å; F537-K549 HydrophobicContact CZ-CB 3.89Å; K549-H551 VanDerWaalsContact C-N 3.33Å; K549-H551 PolarHBondContact O-N 2.62Å; K549-L552 PolarHBondContact O-N 2.91Å; K549-M553 HydrophobicContact CG-CG 4.36Å; K549-M553 VanDerWaalsContact O-CG 3.27Å; K549-M553 WeakPolarHBondContact O-CG 3.26Å; K549-M553 PolarHBondContact O-N 3.15Å; K549-I569 HydrophobicContact CG-CD1 4.46Å
550	D	85.7	Confident	85.3	Confident	73 Å²	73	67.8 Å²	67.8	39%	0.39	34%	0.336	S	S	.	.	H	α-helix	trans	-68.8	-29.2	-176.5	59.2	-64.5	0	0	0	113.4	R548 M553 R554	R548-D550 VanDerWaalsContact C-N 3.32Å; R548-D550 WeakPolarHBondContact CB-OD1 3.46Å; R548-D550 IonicContact CZ-OD1 2.65Å; R548-D550 IonicContact CZ-OD2 3.98Å; R548-D550 IonicContact NE-OD1 3.72Å; R548-D550 PolarHBondContact NE-OD1 3.4Å; R548-D550 IonicContact NE-OD2 2.85Å; R548-D550 PolarHBondContact NE-OD2 2.7Å; R548-D550 IonicContact NH2-OD1 2.64Å; R548-D550 IonicContact NH2-OD2 3.85Å; R548-D550 PolarHBondContact NH2-OD2 2.94Å; R548-D550 PolarHBondContact O-N 3.22Å; D550-M553 PolarHBondContact O-N 2.95Å; D550-R554 WeakPolarHBondContact O-CB 3.49Å; D550-R554 PolarHBondContact O-N 2.94Å
551	H	87.9	Confident	85	Confident	28 Å²	28	65.6 Å²	65.6	13%	0.13	34%	0.341	C	S	.	.	H	α-helix	trans	-68	-42.3	169.5	-67.1	-39	0	0	0	111.9	Y546 R548 K549 M553 R554 H555 D630	Y546-H551 HydrophobicContact CD1-CB 3.72Å; Y546-H551 HydrophobicContact CG-CB 4.18Å; R548-H551 PolarHBondContact NH1-NE2 3.3Å; R548-H551 PolarHBondContact O-N 3.44Å; K549-H551 VanDerWaalsContact C-N 3.33Å; K549-H551 PolarHBondContact O-N 2.62Å; H551-M553 VanDerWaalsContact C-N 3.34Å; H551-M553 PolarHBondContact O-N 2.98Å; H551-R554 PolarHBondContact CE1-NH2 3.39Å; H551-R554 PolarHBondContact ND1-NH2 3.06Å; H551-R554 PolarHBondContact O-N 3.05Å; H551-H555 WeakPolarHBondContact O-CB 3.28Å; H551-H555 PolarHBondContact O-N 3.29Å; H551-D630 VanDerWaalsContact CE1-CG 3.48Å; H551-D630 IonicContact CE1-OD1 2.8Å; H551-D630 PolarHBondContact CE1-OD1 3.15Å; H551-D630 IonicContact CE1-OD2 3.74Å; H551-D630 PolarHBondContact CE1-OD2 3.33Å; H551-D630 VanDerWaalsContact CE1-OD2 3.3Å; H551-D630 IonicContact NE2-OD1 2.98Å; H551-D630 IonicContact NE2-OD2 2.76Å; H551-D630 PolarHBondContact NE2-OD2 3.19Å
552	L	88.2	Confident	84.3	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-64	-38.9	174.3	178.4	59.7	0	0	0	111.9	F537 C539 Y546 R548 K549 H555 M556 I569	F537-L552 HydrophobicContact CB-CB 4.2Å; F537-L552 HydrophobicContact CB-CD2 3.74Å; C539-L552 HydrophobicContact CB-CD1 3.58Å; Y546-L552 HydrophobicContact CD2-CB 3.92Å; Y546-L552 HydrophobicContact CD2-CD1 3.75Å; Y546-L552 HydrophobicContact CD2-CG 4.41Å; Y546-L552 HydrophobicContact CE2-CD1 3.97Å; Y546-L552 HydrophobicContact CG-CB 4.29Å; R548-L552 PolarHBondContact O-N 2.74Å; K549-L552 PolarHBondContact O-N 2.91Å; L552-H555 PolarHBondContact O-N 3.41Å; L552-M556 HydrophobicContact CD1-CE 4.07Å; L552-M556 HydrophobicContact CD1-CG 4.4Å; L552-M556 VanDerWaalsContact O-CG 3.31Å; L552-M556 WeakPolarHBondContact O-CG 3.48Å; L552-M556 PolarHBondContact O-N 2.99Å; L552-I569 HydrophobicContact CD2-CB 4.02Å; L552-I569 HydrophobicContact CD2-CD1 4.17Å; L552-I569 HydrophobicContact CD2-CG1 3.66Å; L552-I569 HydrophobicContact CD2-CG2 3.64Å; L552-I569 HydrophobicContact CG-CG1 4.24Å
553	M	85.9	Confident	83.3	Confident	68 Å²	68	69.9 Å²	69.9	34%	0.335	37%	0.374	S	S	.	.	H	α-helix	trans	-59.5	-49.8	173.2	-67.6	-70.2	-50.8	0	0	111.3	K549 D550 H551 H555 M556 E557 P565 I569	K549-M553 HydrophobicContact CG-CG 4.36Å; K549-M553 VanDerWaalsContact O-CG 3.27Å; K549-M553 WeakPolarHBondContact O-CG 3.26Å; K549-M553 PolarHBondContact O-N 3.15Å; D550-M553 PolarHBondContact O-N 2.95Å; H551-M553 VanDerWaalsContact C-N 3.34Å; H551-M553 PolarHBondContact O-N 2.98Å; M553-H555 VanDerWaalsContact C-N 3.31Å; M553-H555 PolarHBondContact O-N 3.32Å; M553-M556 PolarHBondContact O-N 3.4Å; M553-E557 WeakPolarHBondContact O-CB 3.42Å; M553-E557 PolarHBondContact O-N 3.49Å; M553-P565 HydrophobicContact CE-CB 3.5Å; M553-P565 VanDerWaalsContact CE-CB 3.5Å; M553-P565 HydrophobicContact CE-CG 3.63Å; M553-P565 HydrophobicContact SD-CB 3.69Å; M553-P565 HydrophobicContact SD-CG 4.43Å; M553-I569 HydrophobicContact SD-CD1 4.05Å
554	R	87.3	Confident	82.6	Confident	96 Å²	96	70 Å²	70	36%	0.362	37%	0.371	S	S	.	.	H	α-helix	trans	-60.1	-40.9	177.3	-163.2	-157.4	-47.9	177.9	4	111.7	D550 H551 E557 M558	D550-R554 WeakPolarHBondContact O-CB 3.49Å; D550-R554 PolarHBondContact O-N 2.94Å; H551-R554 PolarHBondContact CE1-NH2 3.39Å; H551-R554 PolarHBondContact ND1-NH2 3.06Å; H551-R554 PolarHBondContact O-N 3.05Å; R554-E557 PolarHBondContact O-N 2.99Å; R554-M558 WeakPolarHBondContact O-CG 3.24Å; R554-M558 PolarHBondContact O-N 3.49Å
555	H	88.2	Confident	81.6	Confident	32 Å²	32	68.3 Å²	68.3	15%	0.148	37%	0.369	C	S	.	.	H	α-helix	trans	-63.7	-43.7	175.4	163.7	70.1	0	0	0	112.3	C539 C542 Y546 H551 L552 M553 E557 G559 H560	C539-H555 PolarHBondContact SG-NE2 2.69Å; C542-H555 PolarHBondContact SG-CE1 3.16Å; C542-H555 PolarHBondContact SG-NE2 3.24Å; Y546-H555 HydrophobicContact CE1-CB 4.36Å; Y546-H555 HydrophobicContact CE2-CB 3.88Å; Y546-H555 AromaticContact CE2-CD2 3.8Å; Y546-H555 AromaticContact CE2-CG 3.72Å; Y546-H555 AromaticContact CZ-CG 3.65Å; Y546-H555 WeakPolarHBondContact OH-CB 3.37Å; Y546-H555 PolarHBondContact OH-ND1 3.06Å; Y546-H555 VanDerWaalsContact OH-ND1 3.15Å; H551-H555 WeakPolarHBondContact O-CB 3.28Å; H551-H555 PolarHBondContact O-N 3.29Å; L552-H555 PolarHBondContact O-N 3.41Å; M553-H555 VanDerWaalsContact C-N 3.31Å; M553-H555 PolarHBondContact O-N 3.32Å; H555-E557 VanDerWaalsContact C-N 3.35Å; H555-G559 WeakPolarHBondContact O-CA 3.48Å; H555-G559 PolarHBondContact O-N 3.25Å; H555-H560 AromaticContact CE1-CD2 3.88Å; H555-H560 AromaticContact CE1-NE2 3.6Å; H555-H560 AromaticContact NE2-CD2 3.38Å; H555-H560 PolarHBondContact NE2-CD2 3.29Å; H555-H560 AromaticContact NE2-NE2 3.31Å; H555-H560 PolarHBondContact NE2-NE2 2.9Å
556	M	84.5	Confident	80.5	Confident	4 Å²	4	77.8 Å²	77.8	2%	0.02	40%	0.398	C	S	.	.	H	α-helix	trans	-61.8	-44	174.2	-72.4	-72.6	-178	0	0	111.4	C539 V541 L552 M553 H560 N568	C539-M556 HydrophobicContact CB-CE 3.85Å; C539-M556 WeakPolarHBondContact SG-CE 3.42Å; V541-M556 HydrophobicContact CG2-SD 4.36Å; L552-M556 HydrophobicContact CD1-CE 4.07Å; L552-M556 HydrophobicContact CD1-CG 4.4Å; L552-M556 VanDerWaalsContact O-CG 3.31Å; L552-M556 WeakPolarHBondContact O-CG 3.48Å; L552-M556 PolarHBondContact O-N 2.99Å; M553-M556 PolarHBondContact O-N 3.4Å; M556-H560 CarbonylContact O-C 3.57Å; M556-H560 VanDerWaalsContact O-CA 3.31Å; M556-H560 WeakPolarHBondContact O-CA 3.46Å; M556-H560 PolarHBondContact O-N 3.12Å; M556-H560 HydrophobicContact SD-CB 4.3Å; M556-N568 HydrophobicContact CE-CB 3.63Å; M556-N568 WeakPolarHBondContact CE-O 3.28Å; M556-N568 HydrophobicContact SD-CB 4.21Å
557	E	85.3	Confident	79.4	Confident	155 Å²	155	79.5 Å²	79.5	72%	0.724	41%	0.411	S	S	*	.	H	α-helix	trans	-65.8	-41.1	-178	-173	165.7	-154.1	0	0	112.9	M553 R554 H555	M553-E557 WeakPolarHBondContact O-CB 3.42Å; M553-E557 PolarHBondContact O-N 3.49Å; R554-E557 PolarHBondContact O-N 2.99Å; H555-E557 VanDerWaalsContact C-N 3.35Å
558	M	85.2	Confident	78.4	Confident	149 Å²	149	77.8 Å²	77.8	73%	0.734	41%	0.406	S	S	*	.	H	α-helix	trans	-90.8	-35.8	-179.2	-58.8	-153.5	-50.6	0	0	114.4	R554	R554-M558 WeakPolarHBondContact O-CG 3.24Å; R554-M558 PolarHBondContact O-N 3.49Å
559	G	81.5	Confident	77.5	Confident	43 Å²	43	76.4 Å²	76.4	44%	0.443	40%	0.403	S	S	.	.	H	α-helix	trans	-96.2	-22.4	-174.6	0	0	0	0	0	114.8	H555 P561	H555-G559 WeakPolarHBondContact O-CA 3.48Å; H555-G559 PolarHBondContact O-N 3.25Å; G559-P561 VanDerWaalsContact C-CD 3.46Å
560	H	82.8	Confident	76.4	Confident	31 Å²	31	72.6 Å²	72.6	14%	0.144	39%	0.389	C	S	.	.	S	Bend	trans	-132.8	56.6	-175.5	-62.1	-46.5	0	0	0	112.3	C539 C542 H555 M556 G562 F563	C539-H560 VanDerWaalsContact SG-CD2 3.54Å; C542-H560 PolarHBondContact SG-NE2 3.07Å; H555-H560 AromaticContact CE1-CD2 3.88Å; H555-H560 AromaticContact CE1-NE2 3.6Å; H555-H560 AromaticContact NE2-CD2 3.38Å; H555-H560 PolarHBondContact NE2-CD2 3.29Å; H555-H560 AromaticContact NE2-NE2 3.31Å; H555-H560 PolarHBondContact NE2-NE2 2.9Å; M556-H560 CarbonylContact O-C 3.57Å; M556-H560 VanDerWaalsContact O-CA 3.31Å; M556-H560 WeakPolarHBondContact O-CA 3.46Å; M556-H560 PolarHBondContact O-N 3.12Å; M556-H560 HydrophobicContact SD-CB 4.3Å; H560-G562 PolarHBondContact O-N 3.18Å; H560-F563 HydrophobicContact CB-CB 4.37Å; H560-F563 HydrophobicContact CB-CD2 3.88Å; H560-F563 HydrophobicContact CB-CG 4.48Å; H560-F563 PolarHBondContact O-N 2.96Å; H560-F563 VanDerWaalsContact O-N 3.16Å
561	P	75.5	Confident	75.7	Confident	104 Å²	104	72.9 Å²	72.9	68%	0.675	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	132.7	179.1	26	-35.2	0	0	0	111.2	G559	G559-P561 VanDerWaalsContact C-CD 3.46Å
562	G	68.3	Low	74.6	Confident	86 Å²	86	74.4 Å²	74.4	89%	0.887	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.9	-12.8	-177.7	0	0	0	0	0	115.2	H560	H560-G562 PolarHBondContact O-N 3.18Å
563	F	67.2	Low	73.1	Confident	110 Å²	110	81.1 Å²	81.1	48%	0.482	44%	0.435	S	S	.	.	S	Bend	trans	-87	136.8	173.4	-73.4	-81.5	0	0	0	112.1	V541 H560 P565 N568	V541-F563 HydrophobicContact CG1-CE2 4.2Å; V541-F563 HydrophobicContact CG1-CZ 4.33Å; V541-F563 HydrophobicContact CG2-CD1 4.21Å; V541-F563 HydrophobicContact CG2-CD2 4.48Å; V541-F563 HydrophobicContact CG2-CE1 4.46Å; V541-F563 HydrophobicContact CG2-CG 4.18Å; H560-F563 HydrophobicContact CB-CB 4.37Å; H560-F563 HydrophobicContact CB-CD2 3.88Å; H560-F563 HydrophobicContact CB-CG 4.48Å; H560-F563 PolarHBondContact O-N 2.96Å; H560-F563 VanDerWaalsContact O-N 3.16Å; F563-P565 WeakPolarHBondContact O-CD 3.47Å; F563-N568 WeakPolarHBondContact CD1-ND2 3.36Å
564	T	67.4	Low	71.7	Confident	80 Å²	80	80.3 Å²	80.3	49%	0.491	43%	0.434	S	S	.	.			trans	-75.6	122.6	179	42.7	0	0	0	0	110.8	R566 D567	T564-R566 PolarHBondContact O-N 3.48Å; T564-D567 VanDerWaalsContact CB-OD2 3.31Å; T564-D567 WeakPolarHBondContact CB-OD2 3.43Å; T564-D567 PolarHBondContact O-N 2.92Å; T564-D567 PolarHBondContact OG1-OD2 3.06Å
565	P	64.5	Low	70.2	Confident	51 Å²	51	78.3 Å²	78.3	33%	0.331	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	0.1	-176.9	28.5	-36.1	0	0	0	114.1	M553 F563 I569	M553-P565 HydrophobicContact CE-CB 3.5Å; M553-P565 VanDerWaalsContact CE-CB 3.5Å; M553-P565 HydrophobicContact CE-CG 3.63Å; M553-P565 HydrophobicContact SD-CB 3.69Å; M553-P565 HydrophobicContact SD-CG 4.43Å; F563-P565 WeakPolarHBondContact O-CD 3.47Å; P565-I569 WeakPolarHBondContact O-CD1 3.43Å; P565-I569 WeakPolarHBondContact O-CG1 3.45Å
566	R	63.4	Low	68.6	Low	232 Å²	232	81.2 Å²	81.2	88%	0.875	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-33.5	176	-109.9	-179.8	178.9	151.9	0.9	113.3	T564	T564-R566 PolarHBondContact O-N 3.48Å
567	D	62	Low	67.3	Low	90 Å²	90	88.2 Å²	88.2	48%	0.481	49%	0.492	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	-17.1	-165	-46.2	-57.5	0	0	0	111.9	R540 T564	R540-D567 PolarHBondContact NH1-O 3.19Å; T564-D567 VanDerWaalsContact CB-OD2 3.31Å; T564-D567 WeakPolarHBondContact CB-OD2 3.43Å; T564-D567 PolarHBondContact O-N 2.92Å; T564-D567 PolarHBondContact OG1-OD2 3.06Å
568	N	62.3	Low	66.2	Low	30 Å²	30	81.1 Å²	81.1	16%	0.16	46%	0.459	C	S	.	.	S	Bend	trans	-105.4	13.5	-173.8	-69.9	-5.7	0	0	0	114.9	R540 V541 M556 F563	R540-N568 HydrophobicContact CB-CB 4.23Å; R540-N568 WeakPolarHBondContact CB-O 3.24Å; R540-N568 WeakPolarHBondContact CG-O 3.26Å; R540-N568 PolarHBondContact N-O 2.98Å; V541-N568 HydrophobicContact CG2-CB 4.31Å; V541-N568 WeakPolarHBondContact CG2-ND2 3.38Å; M556-N568 HydrophobicContact CE-CB 3.63Å; M556-N568 WeakPolarHBondContact CE-O 3.28Å; M556-N568 HydrophobicContact SD-CB 4.21Å; F563-N568 WeakPolarHBondContact CD1-ND2 3.36Å
569	I	67.1	Low	65.1	Low	26 Å²	26	78 Å²	78	13%	0.133	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	119.2	173.6	-61	-178.7	0	0	0	109.1	F537 K549 L552 M553 P565 V571	F537-I569 HydrophobicContact CD1-CG2 4.35Å; K549-I569 HydrophobicContact CG-CD1 4.46Å; L552-I569 HydrophobicContact CD2-CB 4.02Å; L552-I569 HydrophobicContact CD2-CD1 4.17Å; L552-I569 HydrophobicContact CD2-CG1 3.66Å; L552-I569 HydrophobicContact CD2-CG2 3.64Å; L552-I569 HydrophobicContact CG-CG1 4.24Å; M553-I569 HydrophobicContact SD-CD1 4.05Å; P565-I569 WeakPolarHBondContact O-CD1 3.43Å; P565-I569 WeakPolarHBondContact O-CG1 3.45Å; I569-V571 HydrophobicContact CG2-CG2 3.99Å
570	T	65.3	Low	64.2	Low	36 Å²	36	81 Å²	81	22%	0.221	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	132.3	161.3	-62.1	0	0	0	0	108.4	E538 R540	E538-T570 PolarHBondContact N-O 3.24Å; E538-T570 PolarHBondContact O-N 2.91Å; R540-T570 WeakPolarHBondContact CG-OG1 3.4Å; R540-T570 PolarHBondContact NE-OG1 3.31Å
571	V	69.2	Low	63.2	Low	80 Å²	80	81 Å²	81	49%	0.485	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	112.4	169.9	-176.5	0	0	0	0	108.3	P536 F537 I569 L573	P536-V571 CarbonylContact O-C 3.54Å; P536-V571 VanDerWaalsContact O-CA 3.25Å; P536-V571 WeakPolarHBondContact O-CA 3.39Å; F537-V571 HydrophobicContact CD1-CG2 3.98Å; F537-V571 HydrophobicContact CE1-CG1 4.48Å; F537-V571 HydrophobicContact CE1-CG2 3.99Å; I569-V571 HydrophobicContact CG2-CG2 3.99Å; V571-L573 PolarHBondContact O-N 3.08Å
572	H	65.8	Low	62.7	Low	59 Å²	59	77.3 Å²	77.3	27%	0.273	43%	0.425	S	S	.	.			trans	-73.8	114.6	171.7	-73.6	-72	0	0	0	109	F534 P536 E538	F534-H572 HydrophobicContact CE2-CB 4.2Å; F534-H572 HydrophobicContact CZ-CB 3.79Å; F534-H572 WeakPolarHBondContact CZ-O 3.44Å; P536-H572 PolarHBondContact O-N 2.9Å; E538-H572 IonicContact OE2-CD2 3.73Å; E538-H572 IonicContact OE2-CE1 3.12Å; E538-H572 IonicContact OE2-NE2 3.68Å; E538-H572 PolarHBondContact OE2-NE2 3.42Å
573	L	55.8	Low	62.4	Low	141 Å²	141	76.7 Å²	76.7	74%	0.738	40%	0.403	S	S	*	.	P	Polyproline II helix	trans	-69.7	132.4	168.5	-72.4	144.3	0	0	0	107.5	P160 V571	P160-L573 HydrophobicContact CB-CD1 4.4Å; V571-L573 PolarHBondContact O-N 3.08Å
574	T	57	Low	62.2	Low	51 Å²	51	79.6 Å²	79.6	31%	0.313	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-49.4	134.5	-169.4	48	0	0	0	0	113.3	F534 L582	F534-T574 HydrophobicContact CD1-CG2 4.48Å; F534-T574 HydrophobicContact CE1-CG2 3.91Å; T574-L582 HydrophobicContact CG2-CD1 3.89Å
575	S	55.9	Low	61.8	Low	55 Å²	55	76.4 Å²	76.4	39%	0.385	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-55.4	154.4	159.3	62.1	0	0	0	0	109.9	E577 S578 L579	S575-E577 PolarHBondContact O-N 3.06Å; S575-S578 WeakPolarHBondContact O-CB 3.34Å; S575-S578 PolarHBondContact O-N 3.14Å; S575-S578 WeakPolarHBondContact OG-CB 3.45Å; S575-S578 PolarHBondContact OG-N 3Å; S575-S578 PolarHBondContact OG-OG 3.1Å; S575-L579 PolarHBondContact O-N 3.07Å
576	S	55.4	Low	61.4	Low	93 Å²	93	75.8 Å²	75.8	65%	0.65	39%	0.386	S	S	*	.	H	α-helix	trans	-49.3	-47.5	176.1	44.4	0	0	0	0	111.4	S578 L579 D580	S576-S578 PolarHBondContact O-N 3.33Å; S576-L579 CarbonylContact O-C 3.56Å; S576-L579 WeakPolarHBondContact O-CA 3.4Å; S576-L579 WeakPolarHBondContact O-CB 3.38Å; S576-L579 PolarHBondContact O-N 3.32Å; S576-D580 VanDerWaalsContact O-CG 3.31Å; S576-D580 PolarHBondContact O-N 3.45Å
577	E	56.3	Low	60.8	Low	151 Å²	151	69.3 Å²	69.3	71%	0.706	38%	0.377	S	S	*	.	H	α-helix	trans	-59.7	-40.5	178	-164.2	169	-145.6	0	0	113.5	S575 Y581	S575-E577 PolarHBondContact O-N 3.06Å; E577-Y581 PolarHBondContact O-N 3.47Å; E577-Y581 VanDerWaalsContact O-N 3.16Å
578	S	63.3	Low	60	Low	5 Å²	5	70.2 Å²	70.2	4%	0.035	38%	0.381	C	S	.	.	H	α-helix	trans	-68.2	-35.9	173.1	-60.6	0	0	0	0	112.1	S575 S576 L582	S575-S578 WeakPolarHBondContact O-CB 3.34Å; S575-S578 PolarHBondContact O-N 3.14Å; S575-S578 WeakPolarHBondContact OG-CB 3.45Å; S575-S578 PolarHBondContact OG-N 3Å; S575-S578 PolarHBondContact OG-OG 3.1Å; S576-S578 PolarHBondContact O-N 3.33Å; S578-L582 VanDerWaalsContact O-CG 3.3Å; S578-L582 WeakPolarHBondContact O-CG 3.38Å; S578-L582 PolarHBondContact O-N 2.86Å; S578-L582 VanDerWaalsContact O-N 3.07Å
579	L	61.2	Low	59.1	Low	85 Å²	85	72.7 Å²	72.7	45%	0.445	40%	0.397	S	S	.	.	H	α-helix	trans	-71.3	-41.4	179	-173.9	61.9	0	0	0	111.3	S575 S576 Y581 L582 T583	S575-L579 PolarHBondContact O-N 3.07Å; S576-L579 CarbonylContact O-C 3.56Å; S576-L579 WeakPolarHBondContact O-CA 3.4Å; S576-L579 WeakPolarHBondContact O-CB 3.38Å; S576-L579 PolarHBondContact O-N 3.32Å; L579-Y581 VanDerWaalsContact C-N 3.32Å; L579-Y581 PolarHBondContact O-N 3.35Å; L579-L582 CarbonylContact O-C 3.48Å; L579-L582 PolarHBondContact O-N 3.04Å; L579-T583 VanDerWaalsContact O-CB 3.28Å; L579-T583 WeakPolarHBondContact O-CB 3.29Å; L579-T583 PolarHBondContact O-N 3.16Å; L579-T583 PolarHBondContact O-OG1 3.39Å
580	D	62.2	Low	57.7	Low	106 Å²	106	79.2 Å²	79.2	57%	0.567	43%	0.427	S	S	*	.	H	α-helix	trans	-62.4	-41.3	176.1	-68.7	-29.4	0	0	0	110.9	S576 T583 R584	S576-D580 VanDerWaalsContact O-CG 3.31Å; S576-D580 PolarHBondContact O-N 3.45Å; D580-T583 CarbonylContact O-C 3.6Å; D580-T583 PolarHBondContact O-N 3.02Å; D580-T583 VanDerWaalsContact O-N 3.16Å; D580-R584 WeakPolarHBondContact O-CB 3.47Å; D580-R584 PolarHBondContact O-N 3.03Å
581	Y	63.1	Low	56.2	Low	31 Å²	31	85.1 Å²	85.1	12%	0.122	45%	0.45	C	S	.	.	H	α-helix	trans	-64.2	-44.8	174.8	-169.1	-96.5	0	0	0	113	H512 I513 A528 H531 V532 E577 L579 T583 R584 S585	H512-Y581 AromaticContact CE1-CE2 3.49Å; H512-Y581 VanDerWaalsContact CE1-CE2 3.49Å; H512-Y581 WeakPolarHBondContact CE1-CE2 3.28Å; H512-Y581 AromaticContact NE2-CD2 3.92Å; H512-Y581 AromaticContact NE2-CE2 3.21Å; H512-Y581 WeakPolarHBondContact NE2-CE2 3.39Å; H512-Y581 AromaticContact NE2-CZ 3.66Å; I513-Y581 HydrophobicContact CD1-CE2 3.69Å; I513-Y581 WeakPolarHBondContact CD1-OH 3.45Å; I513-Y581 HydrophobicContact CG1-CE2 4.28Å; I513-Y581 WeakPolarHBondContact CG1-OH 3.36Å; A528-Y581 HydrophobicContact CB-CD1 3.94Å; A528-Y581 HydrophobicContact CB-CE1 3.43Å; A528-Y581 VanDerWaalsContact CB-CE1 3.43Å; A528-Y581 WeakPolarHBondContact O-CE1 3.49Å; H531-Y581 HydrophobicContact CB-CE1 4.33Å; H531-Y581 PolarHBondContact CD2-OH 2.95Å; V532-Y581 HydrophobicContact CG2-CD1 3.26Å; V532-Y581 HydrophobicContact CG2-CD2 4.19Å; V532-Y581 HydrophobicContact CG2-CE1 3.81Å; V532-Y581 HydrophobicContact CG2-CG 3.49Å; V532-Y581 VanDerWaalsContact CG2-CG 3.49Å; E577-Y581 PolarHBondContact O-N 3.47Å; E577-Y581 VanDerWaalsContact O-N 3.16Å; L579-Y581 VanDerWaalsContact C-N 3.32Å; L579-Y581 PolarHBondContact O-N 3.35Å; Y581-T583 PolarHBondContact O-N 3.34Å; Y581-R584 PolarHBondContact O-N 3.27Å; Y581-S585 PolarHBondContact O-N 2.79Å; Y581-S585 PolarHBondContact O-OG 3.37Å
582	L	64.1	Low	54.6	Low	26 Å²	26	89.1 Å²	89.1	14%	0.136	46%	0.463	C	S	.	.	H	α-helix	trans	-63.2	-31.3	172.3	-72.4	170.4	0	0	0	111.8	Q525 A528 L529 T574 S578 L579 S585 N586	Q525-L582 HydrophobicContact CB-CD2 4.15Å; Q525-L582 HydrophobicContact CG-CD2 4.36Å; A528-L582 HydrophobicContact CB-CD2 4.37Å; L529-L582 HydrophobicContact CD2-CD1 4.26Å; L529-L582 HydrophobicContact CD2-CD2 4.26Å; T574-L582 HydrophobicContact CG2-CD1 3.89Å; S578-L582 VanDerWaalsContact O-CG 3.3Å; S578-L582 WeakPolarHBondContact O-CG 3.38Å; S578-L582 PolarHBondContact O-N 2.86Å; S578-L582 VanDerWaalsContact O-N 3.07Å; L579-L582 CarbonylContact O-C 3.48Å; L579-L582 PolarHBondContact O-N 3.04Å; L582-S585 WeakPolarHBondContact CA-OG 3.28Å; L582-S585 PolarHBondContact O-OG 3.42Å; L582-N586 WeakPolarHBondContact O-CB 3.37Å; L582-N586 PolarHBondContact O-N 3.43Å; L582-N586 PolarHBondContact O-ND2 3.45Å
583	T	62.6	Low	53.2	Low	72 Å²	72	90.8 Å²	90.8	44%	0.442	48%	0.481	S	S	.	.	H	α-helix	trans	-78	-35.1	178.9	-55.6	0	0	0	0	111.9	L579 D580 Y581 N586 S587	L579-T583 VanDerWaalsContact O-CB 3.28Å; L579-T583 WeakPolarHBondContact O-CB 3.29Å; L579-T583 PolarHBondContact O-N 3.16Å; L579-T583 PolarHBondContact O-OG1 3.39Å; D580-T583 CarbonylContact O-C 3.6Å; D580-T583 PolarHBondContact O-N 3.02Å; D580-T583 VanDerWaalsContact O-N 3.16Å; Y581-T583 PolarHBondContact O-N 3.34Å; T583-N586 CarbonylContact O-C 3.56Å; T583-N586 WeakPolarHBondContact O-CA 3.49Å; T583-N586 VanDerWaalsContact O-CB 3.25Å; T583-N586 WeakPolarHBondContact O-CB 3.18Å; T583-N586 PolarHBondContact O-N 3.45Å; T583-S587 WeakPolarHBondContact O-CB 3.21Å; T583-S587 PolarHBondContact O-N 2.88Å
584	R	61.9	Low	52.1	Low	171 Å²	171	89.9 Å²	89.9	65%	0.645	48%	0.476	S	S	*	.	H	α-helix	trans	-70.7	-44	175.6	-162.4	170.3	-171.3	151.3	0.4	112.1	D580 Y581 N586 S587 L588	D580-R584 WeakPolarHBondContact O-CB 3.47Å; D580-R584 PolarHBondContact O-N 3.03Å; Y581-R584 PolarHBondContact O-N 3.27Å; R584-N586 PolarHBondContact O-N 2.8Å; R584-S587 PolarHBondContact O-N 3.22Å; R584-S587 VanDerWaalsContact O-N 3.1Å; R584-L588 PolarHBondContact O-N 3.46Å
585	S	60	Low	51.1	Low	13 Å²	13	92.6 Å²	92.6	9%	0.091	49%	0.494	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-13.8	169.7	55.6	0	0	0	0	113.8	L524 Y581 L582	L524-S585 WeakPolarHBondContact CD2-O 3.46Å; Y581-S585 PolarHBondContact O-N 2.79Å; Y581-S585 PolarHBondContact O-OG 3.37Å; L582-S585 WeakPolarHBondContact CA-OG 3.28Å; L582-S585 PolarHBondContact O-OG 3.42Å
586	N	56.6	Low	49.9	Very low	39 Å²	39	98.6 Å²	98.6	21%	0.209	52%	0.516	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-15	172.3	-89.2	-31.6	0	0	0	114.4	R521 Q525 L582 T583 R584	R521-N586 PolarHBondContact NE-OD1 3.41Å; R521-N586 PolarHBondContact NH2-O 3.45Å; R521-N586 PolarHBondContact NH2-OD1 2.97Å; Q525-N586 PolarHBondContact NE2-ND2 3.46Å; Q525-N586 PolarHBondContact NE2-OD1 3.07Å; L582-N586 WeakPolarHBondContact O-CB 3.37Å; L582-N586 PolarHBondContact O-N 3.43Å; L582-N586 PolarHBondContact O-ND2 3.45Å; T583-N586 CarbonylContact O-C 3.56Å; T583-N586 WeakPolarHBondContact O-CA 3.49Å; T583-N586 VanDerWaalsContact O-CB 3.25Å; T583-N586 WeakPolarHBondContact O-CB 3.18Å; T583-N586 PolarHBondContact O-N 3.45Å; R584-N586 PolarHBondContact O-N 2.8Å
587	S	49.7	Very low	49	Very low	96 Å²	96	101 Å²	101	67%	0.671	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.4	-22.7	-167.7	-159.6	0	0	0	0	114.4	T583 R584 V589	T583-S587 WeakPolarHBondContact O-CB 3.21Å; T583-S587 PolarHBondContact O-N 2.88Å; R584-S587 PolarHBondContact O-N 3.22Å; R584-S587 VanDerWaalsContact O-N 3.1Å; S587-V589 PolarHBondContact O-N 3.42Å
588	L	45	Very low	47.7	Very low	108 Å²	108	102.5 Å²	102.5	57%	0.565	52%	0.522	S	S	*	.			trans	-79.4	68.9	173.8	-71.8	171.1	0	0	0	111.5	H512 R584 E590	H512-L588 HydrophobicContact CB-CD1 4.27Å; R584-L588 PolarHBondContact O-N 3.46Å; L588-E590 PolarHBondContact O-N 3.18Å; L588-E590 VanDerWaalsContact O-N 3.12Å
589	V	44.4	Very low	46.2	Very low	83 Å²	83	110.8 Å²	110.8	50%	0.503	56%	0.561	S	S	.	*			trans	-81.3	72	158.4	-167.8	0	0	0	0	107.4	S587 F591	S587-V589 PolarHBondContact O-N 3.42Å; V589-F591 HydrophobicContact CB-CE2 4.38Å; V589-F591 HydrophobicContact CG1-CD2 3.65Å; V589-F591 HydrophobicContact CG1-CE1 4.45Å; V589-F591 HydrophobicContact CG1-CE2 3.37Å; V589-F591 HydrophobicContact CG1-CG 4.31Å; V589-F591 HydrophobicContact CG1-CZ 3.82Å; V589-F591 PolarHBondContact O-N 3.47Å
590	E	37.1	Very low	44.9	Very low	163 Å²	163	116 Å²	116	76%	0.762	58%	0.583	S	S	*	*			trans	-74.8	80	174.5	-165.7	161.2	-151.8	0	0	108.7	L588 Q592	L588-E590 PolarHBondContact O-N 3.18Å; L588-E590 VanDerWaalsContact O-N 3.12Å; E590-Q592 PolarHBondContact O-N 3.27Å
591	F	34.9	Very low	43.6	Very low	160 Å²	160	120.1 Å²	120.1	70%	0.702	60%	0.598	S	S	*	*			trans	-57.5	112	165.9	-76.6	-76.1	0	0	0	107.9	V589 S593	V589-F591 HydrophobicContact CB-CE2 4.38Å; V589-F591 HydrophobicContact CG1-CD2 3.65Å; V589-F591 HydrophobicContact CG1-CE1 4.45Å; V589-F591 HydrophobicContact CG1-CE2 3.37Å; V589-F591 HydrophobicContact CG1-CG 4.31Å; V589-F591 HydrophobicContact CG1-CZ 3.82Å; V589-F591 PolarHBondContact O-N 3.47Å; F591-S593 PolarHBondContact O-N 3.41Å; F591-S593 PolarHBondContact O-OG 2.98Å
592	Q	35.6	Very low	42	Very low	163 Å²	163	127.4 Å²	127.4	76%	0.762	63%	0.634	S	S	*	*			trans	-71.7	62.2	157.3	-69.9	-174.8	-39.7	0	0	109	E590 I594	E590-Q592 PolarHBondContact O-N 3.27Å; Q592-I594 PolarHBondContact O-N 3.41Å; Q592-I594 VanDerWaalsContact O-N 3.14Å
593	S	36.3	Very low	40.7	Very low	94 Å²	94	134.3 Å²	134.3	66%	0.657	67%	0.665	S	S	*	*			trans	-72.5	96.3	162	44.7	0	0	0	0	107.3	F591	F591-S593 PolarHBondContact O-N 3.41Å; F591-S593 PolarHBondContact O-OG 2.98Å
594	I	31.7	Very low	39.5	Very low	123 Å²	123	138.5 Å²	138.5	63%	0.631	68%	0.68	S	S	*	*			trans	-50.1	131	170.8	-60	166.3	0	0	0	108.1	Q592 E596	Q592-I594 PolarHBondContact O-N 3.41Å; Q592-I594 VanDerWaalsContact O-N 3.14Å; I594-E596 PolarHBondContact O-N 3.48Å; I594-E596 VanDerWaalsContact O-N 3.16Å
595	P	36.4	Very low	38.3	Very low	107 Å²	107	139.2 Å²	139.2	70%	0.695	69%	0.691	S	S	*	*			trans	-61.9	118.3	172.9	-20.3	32.2	0	0	0	110	N597	P595-N597 PolarHBondContact O-N 3.22Å
596	E	31.2	Very low	37	Very low	181 Å²	181	147.7 Å²	147.7	85%	0.846	73%	0.729	S	S	*	*			trans	-69.9	84.9	167.1	-71.7	-177.9	147.5	0	0	108.8	I594	I594-E596 PolarHBondContact O-N 3.48Å; I594-E596 VanDerWaalsContact O-N 3.16Å
597	N	35	Very low	35.8	Very low	145 Å²	145	151 Å²	151	78%	0.775	75%	0.752	S	S	*	*			trans	-151.8	96.1	165.9	-139.6	-10.6	0	0	0	110.1	P595	P595-N597 PolarHBondContact O-N 3.22Å
598	Y	28.9	Very low	34.9	Very low	181 Å²	181	155.1 Å²	155.1	71%	0.71	76%	0.763	S	S	*	*			trans	-120.2	158.4	169.1	-54.4	-71.4	0	0	0	108.2
599	E	32.3	Very low	34.3	Very low	180 Å²	180	157.7 Å²	157.7	84%	0.841	77%	0.77	S	S	*	*			trans	74.8	66.7	179.9	-52.8	-168.3	115.9	0	0	117
600	Q	35.1	Very low	33.6	Very low	194 Å²	194	160.2 Å²	160.2	91%	0.907	79%	0.786	S	S	*	*	S	Bend		-168.9	147.7	120.4	-100.4	147.8	89.9	0	0	111.7
601	Q	34.9	Very low	33.2	Very low	192 Å²	192	158.7 Å²	158.7	90%	0.897	78%	0.783	S	S	*	*			trans	79.3	56.9	177.9	-52.3	-177.3	15.6	0	0	117.5	Q603	Q601-Q603 PolarHBondContact O-N 3.36Å
602	E	29.4	Very low	33.3	Very low	185 Å²	185	159.7 Å²	159.7	86%	0.864	79%	0.79	S	S	*	*			trans	-67.9	113.5	136.7	-75.3	-175.4	106.2	0	0	109.4
603	Q	35.7	Very low	33.3	Very low	170 Å²	170	156.9 Å²	156.9	79%	0.794	78%	0.784	S	S	*	*			trans	173.4	138.9	140.3	-98.2	156.7	75.9	0	0	111.9	Q601	Q601-Q603 PolarHBondContact O-N 3.36Å
604	Q	38.1	Very low	33	Very low	161 Å²	161	159.2 Å²	159.2	75%	0.752	79%	0.788	S	S	*	*	S	Bend	trans	66.9	93.6	167.5	-56	169.7	53.3	0	0	115.2
605	Q	37.3	Very low	33.1	Very low	186 Å²	186	160.7 Å²	160.7	87%	0.869	80%	0.795	S	S	*	*				-169.9	162.8	57.9	-94	154.3	78.7	0	0	112.1
606	Q	32	Very low	32.9	Very low	190 Å²	190	163.8 Å²	163.8	89%	0.888	80%	0.8	S	S	*	*			trans	-86.4	159.6	-170.7	-77.3	178.4	-12.2	0	0	114.4
607	P	30.3	Very low	32.8	Very low	109 Å²	109	162.7 Å²	162.7	71%	0.708	80%	0.801	S	S	*	*			trans	-86.6	156.4	-175.4	35.7	-36.1	0	0	0	113.4
608	M	31.7	Very low	32.7	Very low	183 Å²	183	165 Å²	165	90%	0.901	81%	0.806	S	S	*	*			trans	-121	115.6	164.8	-80.5	-67.4	-64.2	0	0	110
609	F	31.5	Very low	32.8	Very low	161 Å²	161	166 Å²	166	71%	0.706	81%	0.81	S	S	*	*			trans	-73.8	150.7	166.1	-94.7	-104.6	0	0	0	110.4
610	T	30.5	Very low	32.8	Very low	137 Å²	137	167.7 Å²	167.7	84%	0.84	81%	0.811	S	S	*	*				-170.4	154.3	99.3	34	0	0	0	0	111.4
611	D	29	Very low	32.4	Very low	130 Å²	130	163.6 Å²	163.6	70%	0.695	80%	0.795	S	S	*	*			trans	-75.6	165.1	-173.7	-47.9	-88.4	0	0	0	114.6
612	E	37.3	Very low	32.3	Very low	181 Å²	181	161.2 Å²	161.2	85%	0.846	79%	0.789	S	S	*	*				-171.9	121.8	117	-103.4	176.7	-177.4	0	0	114.9
613	T	33.9	Very low	32.3	Very low	105 Å²	105	158 Å²	158	64%	0.644	78%	0.777	S	S	*	*			trans	39.4	117.6	138.9	59.1	0	0	0	0	122.4
614	I	30.7	Very low	32.2	Very low	143 Å²	143	159.4 Å²	159.4	73%	0.733	78%	0.784	S	S	*	*				73.2	125.1	94.5	-61.7	161.5	0	0	0	115.7
615	I	32.9	Very low	31.9	Very low	153 Å²	153	159.9 Å²	159.9	79%	0.785	79%	0.786	S	S	*	*			trans	-174.8	95	140.7	-90.9	147.5	0	0	0	105
616	E	33.2	Very low	31.8	Very low	172 Å²	172	157.8 Å²	157.8	80%	0.804	78%	0.776	S	S	*	*				80.5	115.9	101.2	-73.3	-177.7	165.4	0	0	114.6
617	N	28.7	Very low	32	Very low	159 Å²	159	155.5 Å²	155.5	85%	0.85	77%	0.77	S	S	*	*			trans	-95.3	129.2	171.3	-70.1	-45.9	0	0	0	109.1
618	E	33.8	Very low	32.3	Very low	192 Å²	192	157.9 Å²	157.9	90%	0.897	78%	0.776	S	S	*	*			trans	-86.6	129.8	163.2	-69.5	-166.7	152.1	0	0	110.6
619	Y	30.7	Very low	32.3	Very low	203 Å²	203	155 Å²	155	80%	0.796	76%	0.764	S	S	*	*			trans	-107.8	114.4	-173.1	-142.2	-91.2	0	0	0	107.9	N621	Y619-N621 HydrophobicContact CD1-CB 4.06Å; Y619-N621 HydrophobicContact CE1-CB 4.44Å
620	Y	32	Very low	32.7	Very low	215 Å²	215	151.8 Å²	151.8	84%	0.843	75%	0.754	S	S	*	*			trans	-93	121.1	164.8	-105.6	-88.6	0	0	0	109.4
621	N	27.2	Very low	33.2	Very low	108 Å²	108	151.4 Å²	151.4	58%	0.578	75%	0.752	S	S	*	*			trans	-138.9	95.5	-178.5	-175.1	48.4	0	0	0	107.7	Y619	Y619-N621 HydrophobicContact CD1-CB 4.06Å; Y619-N621 HydrophobicContact CE1-CB 4.44Å
622	D	32.6	Very low	33.3	Very low	143 Å²	143	152.6 Å²	152.6	77%	0.765	76%	0.758	S	S	*	*			trans	-108.1	133.4	173.1	-86.6	-51.7	0	0	0	111
623	N	29.3	Very low	33.2	Very low	116 Å²	116	152.3 Å²	152.3	62%	0.62	76%	0.761	S	S	*	*			trans	-96	133.6	-164.5	-59.7	-89.6	0	0	0	110.6
624	E	33	Very low	33.1	Very low	200 Å²	200	151.9 Å²	151.9	94%	0.935	76%	0.763	S	S	*	*			trans	-120.1	110.7	150.1	-72.5	-157.5	150.4	0	0	110.2
625	H	32.7	Very low	33.6	Very low	172 Å²	172	149.6 Å²	149.6	80%	0.796	76%	0.757	S	S	*	*			trans	-80.6	111.4	-179.9	-109.1	-94.5	0	0	0	110.9
626	E	35.5	Very low	33.6	Very low	141 Å²	141	147.1 Å²	147.1	66%	0.659	75%	0.753	S	S	*	*			trans	-141.4	98.5	150.9	-82.3	-152.6	164	0	0	112.1	K544	K544-E626 IonicContact NZ-OE1 3.51Å; K544-E626 IonicContact NZ-OE2 3.9Å; K544-E626 PolarHBondContact NZ-OE2 3.37Å
627	N	35.7	Very low	33.7	Very low	143 Å²	143	144.5 Å²	144.5	77%	0.765	75%	0.752	S	S	*	*			trans	54.3	83.9	149.4	-60.9	-55.7	0	0	0	120
628	L	35.6	Very low	33.9	Very low	159 Å²	159	144.5 Å²	144.5	83%	0.832	75%	0.75	S	S	*	*			trans	8.9	116.8	131.4	-63.6	161.6	0	0	0	118.4
629	D	33.1	Very low	33.8	Very low	122 Å²	122	142.2 Å²	142.2	65%	0.652	74%	0.744	S	S	*	*				170.7	97.8	118.1	-95.5	-9.5	0	0	0	112
630	D	39.7	Very low	33.9	Very low	94 Å²	94	142.2 Å²	142.2	50%	0.503	75%	0.748	S	S	.	*			trans	-148.4	98.3	160.3	-121.6	-2.9	0	0	0	107.3	R548 H551	R548-D630 IonicContact CZ-OD2 3.7Å; R548-D630 IonicContact NH1-OD1 3.3Å; R548-D630 PolarHBondContact NH1-OD1 2.81Å; R548-D630 IonicContact NH1-OD2 2.82Å; R548-D630 PolarHBondContact NH1-OD2 3.45Å; H551-D630 VanDerWaalsContact CE1-CG 3.48Å; H551-D630 IonicContact CE1-OD1 2.8Å; H551-D630 PolarHBondContact CE1-OD1 3.15Å; H551-D630 IonicContact CE1-OD2 3.74Å; H551-D630 PolarHBondContact CE1-OD2 3.33Å; H551-D630 VanDerWaalsContact CE1-OD2 3.3Å; H551-D630 IonicContact NE2-OD1 2.98Å; H551-D630 IonicContact NE2-OD2 2.76Å; H551-D630 PolarHBondContact NE2-OD2 3.19Å
631	T	39.5	Very low	34	Very low	128 Å²	128	137.2 Å²	137.2	79%	0.785	74%	0.744	S	S	*	*			trans	-60.8	146.1	-172.8	44.4	0	0	0	0	114.3	L633	T631-L633 PolarHBondContact O-N 3.15Å
632	N	32.3	Very low	34.2	Very low	156 Å²	156	140.9 Å²	140.9	83%	0.834	76%	0.757	S	S	*	*			trans	-49	125.4	179.6	-68.8	-58.6	0	0	0	114.9
633	L	34.2	Very low	34.2	Very low	174 Å²	174	141.8 Å²	141.8	91%	0.911	76%	0.763	S	S	*	*			trans	-129.1	74.1	152.5	-91.4	134.7	0	0	0	107.9	T631	T631-L633 PolarHBondContact O-N 3.15Å
634	S	33.5	Very low	34.2	Very low	96 Å²	96	141.3 Å²	141.3	67%	0.671	76%	0.764	S	S	*	*			trans	-90.8	121.7	164.7	-172.3	0	0	0	0	108.1	S636	S634-S636 PolarHBondContact O-N 3.44Å
635	P	39.4	Very low	34.3	Very low	95 Å²	95	139.3 Å²	139.3	62%	0.617	76%	0.759	S	S	*	*			trans	-73.8	110.4	174.6	-7.9	24.1	0	0	0	109.3
636	S	34	Very low	34.4	Very low	101 Å²	101	135.8 Å²	135.8	71%	0.706	75%	0.754	S	S	*	*			trans	-63.2	146.2	172.1	-52.3	0	0	0	0	111.1	S634 I638	S634-S636 PolarHBondContact O-N 3.44Å; S636-I638 PolarHBondContact O-N 3.31Å
637	P	34.8	Very low	34.5	Very low	118 Å²	118	135 Å²	135	77%	0.766	76%	0.759	S	S	*	*			trans	-68.3	122.5	-179.1	27.7	-34	0	0	0	111.1	N639	P637-N639 PolarHBondContact O-N 3.22Å
638	I	33.1	Very low	34.3	Very low	158 Å²	158	138.5 Å²	138.5	81%	0.81	76%	0.763	S	S	*	*			trans	-77.1	90.6	174.5	-59.4	177	0	0	0	108.9	S636 K640	S636-I638 PolarHBondContact O-N 3.31Å; I638-K640 PolarHBondContact O-N 3.47Å
639	N	32	Very low	34.3	Very low	144 Å²	144	135 Å²	135	77%	0.77	75%	0.751	S	S	*	*			trans	-69.5	119.6	161.3	-87.7	-21.4	0	0	0	109.2	P637 S641	P637-N639 PolarHBondContact O-N 3.22Å; N639-S641 PolarHBondContact O-N 3.02Å
640	K	31.9	Very low	34.4	Very low	204 Å²	204	135.2 Å²	135.2	89%	0.887	76%	0.759	S	S	*	*			trans	-75.2	116.3	166.2	-71.1	176.5	179.6	172	0	108.9	I638	I638-K640 PolarHBondContact O-N 3.47Å
641	S	34.4	Very low	34.3	Very low	110 Å²	110	139 Å²	139	77%	0.769	78%	0.778	S	S	*	*			trans	-135.9	132.2	157.1	49.1	0	0	0	0	109.3	N639	N639-S641 PolarHBondContact O-N 3.02Å
642	H	32.3	Very low	34.1	Very low	184 Å²	184	141.2 Å²	141.2	85%	0.852	78%	0.777	S	S	*	*			trans	-66.1	141	174.9	-73.3	-109.6	0	0	0	109.6
643	N	32.2	Very low	34.5	Very low	163 Å²	163	141.7 Å²	141.7	87%	0.872	78%	0.779	S	S	*	*			trans	-145.4	152.8	131.8	-144.3	-4.1	0	0	0	111.7
644	V	29.7	Very low	34.6	Very low	106 Å²	106	141.6 Å²	141.6	64%	0.642	77%	0.774	S	S	*	*			trans	-110.7	135.7	-168.5	-179.1	0	0	0	0	109.1
645	D	35	Very low	34.9	Very low	157 Å²	157	145.2 Å²	145.2	84%	0.84	78%	0.784	S	S	*	*			trans	-165.8	106.6	148.9	-92.4	-38.1	0	0	0	106.9
646	S	34	Very low	34.5	Very low	99 Å²	99	145.2 Å²	145.2	69%	0.692	79%	0.786	S	S	*	*				81.9	120.1	74.8	-170.9	0	0	0	0	113
647	V	38.5	Very low	34.6	Very low	124 Å²	124	148.6 Å²	148.6	75%	0.752	80%	0.795	S	S	*	*			trans	150.3	133.4	140.9	165.7	0	0	0	0	112.1
648	Y	31.3	Very low	34.4	Very low	217 Å²	217	148.2 Å²	148.2	85%	0.851	80%	0.795	S	S	*	*			trans	72.3	133.2	170.3	-107.6	-106.9	0	0	0	119.5
649	S	35.9	Very low	34.5	Very low	85 Å²	85	148.8 Å²	148.8	59%	0.594	80%	0.8	S	S	*	*			cis	-166.4	138.5	-24.5	-92.5	0	0	0	0	108
650	P	34.9	Very low	34.7	Very low	126 Å²	126	147.1 Å²	147.1	82%	0.818	80%	0.799	S	S	*	*			trans	-97.5	153.3	-176.5	36.7	-33.7	0	0	0	114.2
651	I	37.9	Very low	34.8	Very low	174 Å²	174	146 Å²	146	89%	0.892	80%	0.797	S	S	*	*			trans	-120	137	161.5	-68.7	173.8	0	0	0	107.9
652	K	35.5	Very low	35	Very low	175 Å²	175	148.6 Å²	148.6	76%	0.761	80%	0.797	S	S	*	*			trans	-76.5	158.8	-174.6	-57.6	172.5	176.9	-176.5	0	111.1
653	D	40.3	Very low	35.3	Very low	166 Å²	166	147.2 Å²	147.2	89%	0.888	79%	0.791	S	S	*	*				-159.4	138.7	109.8	-89.8	-23.8	0	0	0	110.5
654	E	37.1	Very low	35.4	Very low	171 Å²	171	146.5 Å²	146.5	80%	0.799	79%	0.786	S	S	*	*			trans	-87.1	148.3	179	-60.5	176.9	150.1	0	0	110.3
655	I	37.9	Very low	35.8	Very low	173 Å²	173	150.2 Å²	150.2	89%	0.887	79%	0.793	S	S	*	*			trans	-149.2	117.5	133.2	-94.5	139.8	0	0	0	106.6
656	S	33	Very low	36	Very low	95 Å²	95	150 Å²	150	66%	0.664	79%	0.791	S	S	*	*			trans	-73.8	155.8	173.2	-38.2	0	0	0	0	110.6
657	L	35.5	Very low	36.3	Very low	171 Å²	171	150.5 Å²	150.5	90%	0.895	80%	0.795	S	S	*	*				-177.3	105	126.8	-97.7	159.8	0	0	0	110.2
658	S	30.9	Very low	36.4	Very low	110 Å²	110	150.9 Å²	150.9	77%	0.769	80%	0.798	S	S	*	*			trans	-75.8	138.4	166	50.9	0	0	0	0	110.8
659	L	34.2	Very low	36.8	Very low	171 Å²	171	149 Å²	149	90%	0.895	80%	0.797	S	S	*	*			trans	-144.4	150.5	155.3	-103.4	165.9	0	0	0	109.4
660	S	36.9	Very low	36.9	Very low	108 Å²	108	150.3 Å²	150.3	76%	0.755	80%	0.801	S	S	*	*			trans	-95.3	169.3	-151.6	50.3	0	0	0	0	115.5
661	E	32.6	Very low	36.9	Very low	182 Å²	182	150.4 Å²	150.4	85%	0.85	80%	0.8	S	S	*	*			trans	-50.1	143.8	163.8	-59.4	163.1	119.1	0	0	111.9
662	E	38.6	Very low	37.1	Very low	163 Å²	163	154.8 Å²	154.8	76%	0.762	82%	0.817	S	S	*	*				-175.1	131.2	117.9	-101.4	-157.7	123.6	0	0	114.9
663	Q	38.9	Very low	37.2	Very low	156 Å²	156	153.8 Å²	153.8	73%	0.729	82%	0.82	S	S	*	*			trans	74.2	159.3	143.9	-61.6	-169.7	26.3	0	0	123.7
664	I	35.8	Very low	37.1	Very low	148 Å²	148	153.2 Å²	153.2	76%	0.759	82%	0.816	S	S	*	*			trans	78.4	85.3	165.8	-43.4	-175.2	0	0	0	114.9
665	K	38.2	Very low	37.1	Very low	184 Å²	184	152.2 Å²	152.2	80%	0.8	82%	0.817	S	S	*	*				46.7	104.6	83	-76.9	-171.3	175	179.8	0	115.1
666	D	39.2	Very low	37	Very low	151 Å²	151	150.9 Å²	150.9	81%	0.807	81%	0.813	S	S	*	*				171.8	176.3	105.3	-92.3	-17.9	0	0	0	112.1
667	S	39.4	Very low	37.3	Very low	110 Å²	110	154.4 Å²	154.4	77%	0.769	82%	0.822	S	S	*	*			trans	77.7	73.7	166.1	-56.1	0	0	0	0	117.9
668	T	40.7	Very low	37.4	Very low	132 Å²	132	153.3 Å²	153.3	81%	0.81	82%	0.817	S	S	*	*			trans	-36.6	143.5	132.9	49.9	0	0	0	0	113.1
669	Q	40.3	Very low	37.8	Very low	178 Å²	178	156.4 Å²	156.4	83%	0.832	82%	0.821	S	S	*	*				173.6	103.1	112.6	-164.1	158.7	28	0	0	113.5
670	T	36.7	Very low	38.1	Very low	112 Å²	112	155.3 Å²	155.3	69%	0.687	82%	0.815	S	S	*	*				47.8	121	125.1	-34.7	0	0	0	0	122.3
671	T	34.5	Very low	38.2	Very low	128 Å²	128	159.3 Å²	159.3	79%	0.785	82%	0.82	S	S	*	*			trans	62.2	121.2	149.6	51.9	0	0	0	0	122.7
672	Q	43.8	Very low	38.7	Very low	267 Å²	267	157.2 Å²	157.2	100%	1.248	82%	0.817	S	S	*	*				-135.6	0	109.8	-126.3	179.5	22.2	0	0	110

Retrieved 672 of 672 residues in 380.2 ms (Link to these results)

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