A0A5K4F983_SCHMA Loading...

RUN domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F983, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 587 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure 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	27	Very low	32	Very low	242 Å²	242	130.5 Å²	130.5	100%	1.192	76%	0.762	S	S	*	*				0	109.3	0	-162.8	174	87	0	0	105.6
2	L	28.9	Very low	32.3	Very low	130 Å²	130	128.5 Å²	128.5	68%	0.681	75%	0.753	S	S	*	*			trans	-122.9	113.6	179.8	-104.1	154.4	0	0	0	106.4
3	E	25.5	Very low	32.5	Very low	190 Å²	190	128.9 Å²	128.9	89%	0.888	76%	0.758	S	S	*	*			trans	-88.2	115.1	176.4	-149.8	172.5	-160.6	0	0	106.5
4	V	37	Very low	32.6	Very low	115 Å²	115	127.4 Å²	127.4	70%	0.697	74%	0.743	S	S	*	*			trans	-106.9	102.8	176.4	-176.1	0	0	0	0	107.1	S6	V4-S6 PolarHBondContact O-N 3.25Å
5	S	30.6	Very low	32.7	Very low	113 Å²	113	126.2 Å²	126.2	79%	0.79	74%	0.744	S	S	*	*			trans	-76.6	114.9	172.5	60.9	0	0	0	0	109.5
6	S	32.8	Very low	32.5	Very low	102 Å²	102	129.7 Å²	129.7	71%	0.713	75%	0.748	S	S	*	*			trans	-88.9	102.8	167	174.1	0	0	0	0	108.7	V4	V4-S6 PolarHBondContact O-N 3.25Å
7	G	28.8	Very low	32.6	Very low	64 Å²	64	127.1 Å²	127.1	66%	0.66	74%	0.739	S	S	*	*			trans	-132	107.4	166.6	0	0	0	0	0	108.7
8	G	30.3	Very low	32.6	Very low	62 Å²	62	133.3 Å²	133.3	64%	0.639	75%	0.748	S	S	*	*	S	Bend	trans	61.8	103.5	164.8	0	0	0	0	0	117	D10	G8-D10 PolarHBondContact O-N 3.28Å
9	N	37.8	Very low	32.7	Very low	166 Å²	166	134.6 Å²	134.6	89%	0.888	75%	0.747	S	S	*	*	S	Bend	trans	54.7	-10.2	158.9	-68.6	-4	0	0	0	121.1
10	D	35.4	Very low	32.6	Very low	99 Å²	99	134 Å²	134	53%	0.529	75%	0.751	S	S	.	*			trans	-119.5	108.6	-179.3	-73.8	-9.8	0	0	0	110.5	G8	G8-D10 PolarHBondContact O-N 3.28Å
11	H	38.3	Very low	32.4	Very low	153 Å²	153	136.5 Å²	136.5	71%	0.708	76%	0.757	S	S	*	*			trans	-94.8	115.2	169.5	-69.7	-62.9	0	0	0	109.9
12	T	34.8	Very low	32.5	Very low	106 Å²	106	133.2 Å²	133.2	65%	0.65	74%	0.739	S	S	*	*			trans	-90.7	115.4	171.6	-26.5	0	0	0	0	109
13	V	35.9	Very low	32.6	Very low	134 Å²	134	132.9 Å²	132.9	81%	0.812	74%	0.742	S	S	*	*			trans	-92.7	111.6	173.4	-179	0	0	0	0	108.2
14	I	33.8	Very low	32.8	Very low	107 Å²	107	129.9 Å²	129.9	55%	0.549	73%	0.732	S	S	.	*			trans	-98.6	106.1	173.7	-56	174.1	0	0	0	107.4
15	S	33.6	Very low	32.5	Very low	110 Å²	110	131.1 Å²	131.1	77%	0.769	74%	0.735	S	S	*	*			trans	-82.3	124.9	169.8	59.7	0	0	0	0	109.7
16	F	30	Very low	32.6	Very low	182 Å²	182	134 Å²	134	80%	0.798	73%	0.733	S	S	*	*			trans	-99.3	108.8	169.9	-152.5	-86	0	0	0	108.9
17	S	33.1	Very low	32.4	Very low	86 Å²	86	136.9 Å²	136.9	60%	0.601	73%	0.733	S	S	*	*			trans	-85.9	131.2	163	180	0	0	0	0	108.1	E19	S17-E19 WeakPolarHBondContact CB-O 3.44Å; S17-E19 PolarHBondContact O-N 3.21Å; S17-E19 PolarHBondContact OG-N 2.87Å; S17-E19 PolarHBondContact OG-O 2.91Å
18	R	34	Very low	32.5	Very low	238 Å²	238	139 Å²	139	90%	0.898	73%	0.733	S	S	*	*	S	Bend	trans	-74.4	-1.1	-179.5	-145.7	177.8	-166.8	179.1	3.5	113
19	E	33.6	Very low	32.5	Very low	158 Å²	158	141.8 Å²	141.8	74%	0.738	73%	0.733	S	S	*	*	S	Bend	trans	-139.1	128.5	-177	-64.4	172.9	-177.2	0	0	106.9	S17	S17-E19 WeakPolarHBondContact CB-O 3.44Å; S17-E19 PolarHBondContact O-N 3.21Å; S17-E19 PolarHBondContact OG-N 2.87Å; S17-E19 PolarHBondContact OG-O 2.91Å
20	C	30.8	Very low	32.2	Very low	122 Å²	122	144.1 Å²	144.1	82%	0.824	73%	0.731	S	S	*	*			trans	94.9	106	-177.7	-55.7	0	0	0	0	116.9	H22	C20-H22 PolarHBondContact O-N 3.46Å; C20-H22 VanDerWaalsContact O-N 3.1Å
21	E	28.2	Very low	31.9	Very low	187 Å²	187	143.2 Å²	143.2	87%	0.874	75%	0.745	S	S	*	*	S	Bend	trans	-57.7	101	154.9	-68.1	175.8	154.1	0	0	108.7
22	H	30	Very low	31.3	Very low	173 Å²	173	139.9 Å²	139.9	80%	0.801	75%	0.752	S	S	*	*			trans	176.8	114.1	146.3	-95.5	34.1	0	0	0	108.7	C20	C20-H22 PolarHBondContact O-N 3.46Å; C20-H22 VanDerWaalsContact O-N 3.1Å
23	V	30.3	Very low	31.1	Very low	124 Å²	124	138.2 Å²	138.2	75%	0.752	76%	0.755	S	S	*	*			trans	-94.6	108.7	-179.7	179.9	0	0	0	0	108.6
24	N	30.9	Very low	30.7	Very low	126 Å²	126	142.7 Å²	142.7	67%	0.674	76%	0.759	S	S	*	*			trans	-97	116.8	168	-78.7	-23.6	0	0	0	109.5	F26	N24-F26 HydrophobicContact CB-CD2 4.43Å; N24-F26 HydrophobicContact CB-CE2 3.79Å; N24-F26 HydrophobicContact CB-CZ 4.36Å
25	N	30.7	Very low	30.6	Very low	142 Å²	142	147.5 Å²	147.5	76%	0.759	78%	0.777	S	S	*	*			trans	-80.6	123.4	172.4	-69.7	-33.8	0	0	0	109.5
26	F	30.9	Very low	30.4	Very low	173 Å²	173	150.9 Å²	150.9	76%	0.759	78%	0.78	S	S	*	*			trans	-111	126.7	169	-69.9	-83.1	0	0	0	110.3	N24	N24-F26 HydrophobicContact CB-CD2 4.43Å; N24-F26 HydrophobicContact CB-CE2 3.79Å; N24-F26 HydrophobicContact CB-CZ 4.36Å
27	K	29.4	Very low	30.3	Very low	162 Å²	162	148.4 Å²	148.4	70%	0.704	78%	0.776	S	S	*	*			trans	-101.3	117.6	173.8	-165.3	174.2	-175.9	175.9	0	108.1
28	V	31.5	Very low	30.3	Very low	108 Å²	108	149.9 Å²	149.9	66%	0.655	78%	0.783	S	S	*	*			trans	-104.2	107.7	175.6	-176.4	0	0	0	0	108.1	Y30	V28-Y30 HydrophobicContact CG1-CD2 3.82Å; V28-Y30 HydrophobicContact CG1-CE2 3.6Å
29	N	29.6	Very low	29.9	Very low	121 Å²	121	145.2 Å²	145.2	65%	0.647	78%	0.776	S	S	*	*			trans	-89.8	114.1	171.2	-72.6	-15.2	0	0	0	108.8
30	Y	31.3	Very low	29.7	Very low	216 Å²	216	144.8 Å²	144.8	85%	0.847	78%	0.778	S	S	*	*			trans	-87	107.5	166.3	-87.8	-86.4	0	0	0	109.6	V28 G32	V28-Y30 HydrophobicContact CG1-CD2 3.82Å; V28-Y30 HydrophobicContact CG1-CE2 3.6Å; Y30-G32 PolarHBondContact O-N 3.11Å
31	G	29.3	Very low	29.6	Very low	79 Å²	79	145.2 Å²	145.2	81%	0.814	78%	0.781	S	S	*	*			trans	-72.8	115.7	170.1	0	0	0	0	0	110.4
32	G	26.6	Very low	29.3	Very low	84 Å²	84	147.4 Å²	147.4	87%	0.866	78%	0.782	S	S	*	*			trans	-67.2	134.6	174.1	0	0	0	0	0	112.2	Y30	Y30-G32 PolarHBondContact O-N 3.11Å
33	G	29.7	Very low	29.1	Very low	70 Å²	70	149.1 Å²	149.1	72%	0.722	79%	0.787	S	S	*	*			trans	-155.1	104.7	173.2	0	0	0	0	0	110.1
34	Y	27.3	Very low	28.9	Very low	228 Å²	228	148.1 Å²	148.1	89%	0.894	79%	0.786	S	S	*	*			trans	-53.4	128.1	169.9	-71.2	-99.5	0	0	0	110.9
35	F	32.4	Very low	28.7	Very low	209 Å²	209	145.3 Å²	145.3	92%	0.917	79%	0.786	S	S	*	*			trans	-148.6	136.1	153.2	-94.9	-73.2	0	0	0	112.2
36	E	29.6	Very low	28.6	Very low	181 Å²	181	149.5 Å²	149.5	85%	0.846	79%	0.793	S	S	*	*			trans	-72	156.9	-169.4	-65.8	168.2	138.4	0	0	114
37	N	27.6	Very low	28.4	Very low	130 Å²	130	148.5 Å²	148.5	70%	0.695	80%	0.796	S	S	*	*			trans	-62.6	138.4	-179.9	-174	1.1	0	0	0	113.7	N39	N37-N39 PolarHBondContact OD1-N 3.2Å
38	P	31.7	Very low	28.3	Very low	116 Å²	116	149.9 Å²	149.9	75%	0.753	81%	0.805	S	S	*	*			trans	-129	76.1	156.3	37.3	-21.6	0	0	0	112.5	N40	P38-N40 PolarHBondContact O-N 3.01Å; P38-N40 VanDerWaalsContact O-N 3.11Å
39	N	27.6	Very low	28.1	Very low	140 Å²	140	149 Å²	149	75%	0.749	81%	0.809	S	S	*	*			trans	-72.5	80.5	147.6	-83.2	-22.9	0	0	0	108.8	N37	N37-N39 PolarHBondContact OD1-N 3.2Å
40	N	27.9	Very low	28	Very low	149 Å²	149	149 Å²	149	80%	0.797	82%	0.818	S	S	*	*			trans	-176.8	100.6	160	-98.7	-19.9	0	0	0	109.2	P38	P38-N40 PolarHBondContact O-N 3.01Å; P38-N40 VanDerWaalsContact O-N 3.11Å
41	C	28.2	Very low	27.8	Very low	131 Å²	131	142.1 Å²	142.1	89%	0.885	81%	0.813	S	S	*	*			trans	172.6	114.4	130.2	-92.6	0	0	0	0	110
42	R	23.3	Very low	27.6	Very low	234 Å²	234	145.9 Å²	145.9	88%	0.883	82%	0.815	S	S	*	*			trans	-51.1	142.9	158.3	-66.6	173.2	171.4	-179.5	-3.7	109.4
43	F	25.4	Very low	27.5	Very low	208 Å²	208	150.3 Å²	150.3	91%	0.912	82%	0.818	S	S	*	*				-170.4	146.5	127	-107.5	-76.6	0	0	0	111.1
44	S	25.7	Very low	27.4	Very low	104 Å²	104	151 Å²	151	73%	0.727	82%	0.817	S	S	*	*			trans	-106.9	156.9	-160.1	50.3	0	0	0	0	114.3
45	G	26.2	Very low	27.2	Very low	66 Å²	66	145 Å²	145	68%	0.68	81%	0.814	S	S	*	*			trans	88	149.6	151.7	0	0	0	0	0	115.6
46	Y	28.8	Very low	26.9	Very low	231 Å²	231	141 Å²	141	91%	0.906	81%	0.807	S	S	*	*			cis	-158.9	156.7	9.4	-103.9	-89.9	0	0	0	109.2
47	N	27.5	Very low	26.6	Very low	151 Å²	151	141.7 Å²	141.7	81%	0.807	81%	0.807	S	S	*	*			trans	-87.7	172.8	174.2	-89.6	-26.5	0	0	0	113
48	E	28.1	Very low	26.4	Very low	192 Å²	192	145.2 Å²	145.2	90%	0.897	81%	0.811	S	S	*	*			trans	86	141.1	165.2	-60.2	179.5	170.6	0	0	115.8
49	A	27.2	Very low	26	Very low	90 Å²	90	145 Å²	145	74%	0.744	81%	0.807	S	S	*	*			cis	-156.4	157.1	29.9	0	0	0	0	0	113.8
50	S	26.9	Very low	25.9	Very low	120 Å²	120	146.7 Å²	146.7	84%	0.839	81%	0.808	S	S	*	*			trans	-41.6	146.3	153	49.5	0	0	0	0	115.2
51	G	26.1	Very low	25.7	Very low	72 Å²	72	147 Å²	147	74%	0.742	81%	0.81	S	S	*	*			trans	178.8	90.7	166.9	0	0	0	0	0	114.2
52	N	25.2	Very low	25.5	Very low	158 Å²	158	148.4 Å²	148.4	85%	0.845	81%	0.808	S	S	*	*			trans	20.3	120.4	148.2	-67.8	-27.9	0	0	0	119.1
53	L	25.8	Very low	25.5	Very low	177 Å²	177	146.6 Å²	146.6	93%	0.927	81%	0.806	S	S	*	*			trans	-150.1	104.9	140.3	-134.8	79.6	0	0	0	112.8
54	A	25.8	Very low	25.6	Very low	85 Å²	85	143.9 Å²	143.9	70%	0.702	80%	0.8	S	S	*	*			trans	44.1	108.9	137.2	0	0	0	0	0	119.9	T56	A54-T56 PolarHBondContact O-N 3.25Å
55	A	24	Very low	25.6	Very low	101 Å²	101	144.5 Å²	144.5	84%	0.835	80%	0.799	S	S	*	*			trans	-8.2	113.1	144.5	0	0	0	0	0	116.9
56	T	26	Very low	25.7	Very low	126 Å²	126	147 Å²	147	77%	0.773	80%	0.803	S	S	*	*			trans	-117.8	92.9	150.7	-40.2	0	0	0	0	108.7	A54 R58	A54-T56 PolarHBondContact O-N 3.25Å; T56-R58 PolarHBondContact O-N 3.12Å
57	K	24	Very low	25.8	Very low	194 Å²	194	145.4 Å²	145.4	84%	0.843	80%	0.804	S	S	*	*			trans	-60	120.1	163.4	-87.2	177.6	173.1	175.7	0	108.3
58	R	23.6	Very low	25.9	Very low	205 Å²	205	143.1 Å²	143.1	77%	0.774	80%	0.8	S	S	*	*			trans	-117.3	101.1	156.3	-89.5	-174.2	178.1	155.1	-0.1	108.7	T56 F60	T56-R58 PolarHBondContact O-N 3.12Å; R58-F60 HydrophobicContact CB-CE2 3.98Å; R58-F60 HydrophobicContact CB-CZ 4.1Å
59	T	22.4	Very low	26	Very low	111 Å²	111	142.8 Å²	142.8	68%	0.681	80%	0.798	S	S	*	*			trans	-78.2	130.5	169.3	-33.2	0	0	0	0	108.2
60	F	26.6	Very low	26.4	Very low	175 Å²	175	144.3 Å²	144.3	77%	0.768	80%	0.804	S	S	*	*			trans	-118.5	115.1	165.2	-57.7	-80.7	0	0	0	108	R58	R58-F60 HydrophobicContact CB-CE2 3.98Å; R58-F60 HydrophobicContact CB-CZ 4.1Å
61	N	23.2	Very low	26.8	Very low	157 Å²	157	145.3 Å²	145.3	84%	0.84	81%	0.805	S	S	*	*			trans	-91.6	117.7	171.3	-78.4	-38.8	0	0	0	108.4
62	L	24.8	Very low	27.2	Very low	160 Å²	160	147.4 Å²	147.4	84%	0.838	81%	0.805	S	S	*	*			trans	-109.3	107.5	167.6	-108.1	148.4	0	0	0	108.6
63	K	23.1	Very low	27.6	Very low	196 Å²	196	149.3 Å²	149.3	85%	0.852	81%	0.809	S	S	*	*			trans	-80.4	111.4	176.2	-170.3	178.1	-175.7	-179.2	0	107.9
64	I	27.7	Very low	27.8	Very low	150 Å²	150	146.5 Å²	146.5	77%	0.769	80%	0.803	S	S	*	*			trans	-102.7	115.5	172.1	-58.4	175.5	0	0	0	107.6
65	T	25.6	Very low	28.3	Very low	117 Å²	117	152.2 Å²	152.2	72%	0.718	81%	0.812	S	S	*	*			trans	-84.4	129.8	172	-34	0	0	0	0	108.5
66	P	26.5	Very low	28.7	Very low	118 Å²	118	155.7 Å²	155.7	77%	0.766	81%	0.811	S	S	*	*			trans	-87.8	130.3	176	32.9	-27.8	0	0	0	109.6
67	Q	31.4	Very low	29.1	Very low	198 Å²	198	158.2 Å²	158.2	93%	0.925	81%	0.811	S	S	*	*			trans	-125.9	127.3	158.1	-91.6	-166.1	-5.4	0	0	110.4
68	S	31.1	Very low	29.6	Very low	103 Å²	103	155.9 Å²	155.9	72%	0.72	81%	0.808	S	S	*	*			trans	-86.2	143.8	-174.5	44.4	0	0	0	0	112.8
69	Q	28.9	Very low	30.1	Very low	185 Å²	185	151.6 Å²	151.6	86%	0.864	81%	0.807	S	S	*	*			trans	53.6	114.4	141.8	-68.4	177.9	-11.6	0	0	119.4
70	S	35	Very low	30.8	Very low	122 Å²	122	151.6 Å²	151.6	85%	0.853	81%	0.811	S	S	*	*				-175.7	148.2	103.9	55.4	0	0	0	0	112.3
71	T	35.4	Very low	30.9	Very low	141 Å²	141	150.7 Å²	150.7	87%	0.865	81%	0.813	S	S	*	*			trans	-65.6	173.4	-166.5	20	0	0	0	0	118.1
72	P	35.3	Very low	31.5	Very low	116 Å²	116	151.5 Å²	151.5	75%	0.753	82%	0.815	S	S	*	*			trans	-107.3	170.4	-147.5	42.2	-36.6	0	0	0	115
73	E	33.9	Very low	31.7	Very low	199 Å²	199	152.1 Å²	152.1	93%	0.93	81%	0.811	S	S	*	*			trans	-156.4	140	148.7	-120.6	178.3	-175.6	0	0	112.9
74	C	29.1	Very low	31.9	Very low	118 Å²	118	149.9 Å²	149.9	80%	0.797	81%	0.808	S	S	*	*			trans	-75.9	153.4	-172.9	-62.4	0	0	0	0	114.1
75	K	37.4	Very low	32.1	Very low	205 Å²	205	151.4 Å²	151.4	89%	0.891	81%	0.812	S	S	*	*			trans	-174.8	101.9	131.9	-100	162.4	-170.7	-178.5	0	112.8
76	E	31.8	Very low	32.2	Very low	174 Å²	174	151.1 Å²	151.1	81%	0.813	81%	0.814	S	S	*	*			trans	12.7	119.8	131.3	-155.4	-179.4	-166.4	0	0	119
77	K	35.1	Very low	32.5	Very low	178 Å²	178	151.4 Å²	151.4	77%	0.774	82%	0.816	S	S	*	*				174.1	126.1	114.2	-100.8	-177.5	176.8	179.1	0	115.1
78	D	34.8	Very low	32.3	Very low	146 Å²	146	147.7 Å²	147.7	78%	0.781	81%	0.808	S	S	*	*			trans	57.7	141.3	145.2	-74.2	-38.2	0	0	0	125.3
79	P	33.5	Very low	32.3	Very low	114 Å²	114	148.4 Å²	148.4	74%	0.74	81%	0.812	S	S	*	*			trans	-107.4	151.9	-169.2	39.5	-26.4	0	0	0	113.6
80	S	36.5	Very low	32.1	Very low	111 Å²	111	146.2 Å²	146.2	78%	0.776	81%	0.805	S	S	*	*			trans	-151.7	103.2	165.1	41.3	0	0	0	0	112.9
81	I	29.7	Very low	31.8	Very low	157 Å²	157	148.2 Å²	148.2	81%	0.805	81%	0.805	S	S	*	*			trans	29.7	109.5	131.3	-51.6	169.5	0	0	0	116.5
82	I	35.8	Very low	31.4	Very low	173 Å²	173	150 Å²	150	89%	0.887	80%	0.803	S	S	*	*			trans	-141.4	133.9	137.7	-55.4	-176.7	0	0	0	109.7
83	K	28.8	Very low	30.9	Very low	173 Å²	173	151 Å²	151	75%	0.752	81%	0.806	S	S	*	*			trans	-76.8	162.2	-174.8	-72.3	171.7	166.2	175.5	0	114.3
84	L	26.8	Very low	30.6	Very low	149 Å²	149	153.1 Å²	153.1	78%	0.78	81%	0.806	S	S	*	*			trans	68.4	114.5	139.4	-108.5	79.5	0	0	0	118.7
85	E	32.5	Very low	30.5	Very low	182 Å²	182	152.2 Å²	152.2	85%	0.85	80%	0.801	S	S	*	*				173.1	127.5	99.2	-101.4	175.6	-178.4	0	0	110.7
86	S	26.4	Very low	30.2	Very low	111 Å²	111	148.2 Å²	148.2	78%	0.776	80%	0.796	S	S	*	*			trans	-95.4	154	167.6	45.7	0	0	0	0	110.4
87	P	33.2	Very low	29.9	Very low	124 Å²	124	150.1 Å²	150.1	81%	0.805	80%	0.797	S	S	*	*			trans	-132.4	133.1	139	31.6	-16.6	0	0	0	114.1
88	T	26.7	Very low	29.6	Very low	121 Å²	121	153.1 Å²	153.1	74%	0.742	80%	0.803	S	S	*	*			trans	-48.5	140.7	164.8	-37.4	0	0	0	0	113.1	I90	T88-I90 HydrophobicContact CG2-CD1 4.43Å; T88-I90 HydrophobicContact CG2-CG1 4.2Å
89	S	30.8	Very low	29.1	Very low	117 Å²	117	153 Å²	153	82%	0.818	80%	0.803	S	S	*	*			trans	-140.9	120.4	146.9	56.9	0	0	0	0	111.2
90	I	25	Very low	28.8	Very low	139 Å²	139	153.6 Å²	153.6	71%	0.713	81%	0.81	S	S	*	*			trans	-89	133.6	172.8	-67.9	162.8	0	0	0	106.7	T88	T88-I90 HydrophobicContact CG2-CD1 4.43Å; T88-I90 HydrophobicContact CG2-CG1 4.2Å
91	I	29.9	Very low	28.4	Very low	165 Å²	165	153.4 Å²	153.4	85%	0.846	80%	0.804	S	S	*	*			trans	-132	121.6	159.6	-61.6	-177.3	0	0	0	110.2
92	Q	25.6	Very low	28.6	Very low	178 Å²	178	154.8 Å²	154.8	83%	0.832	81%	0.806	S	S	*	*			trans	-75.1	154.1	178.3	-83.3	172	-59.2	0	0	114.3
93	V	26.8	Very low	28.3	Very low	136 Å²	136	153.5 Å²	153.5	82%	0.824	80%	0.801	S	S	*	*			trans	-47.4	141.3	165.3	179.9	0	0	0	0	114.6
94	R	26.3	Very low	28.4	Very low	245 Å²	245	148.7 Å²	148.7	93%	0.925	80%	0.801	S	S	*	*			trans	-166	124	143.5	-117.3	174	179.7	140.9	-0.4	113.8
95	S	27.2	Very low	28.6	Very low	98 Å²	98	149.7 Å²	149.7	69%	0.685	81%	0.807	S	S	*	*			trans	-89	155.2	158.4	170.5	0	0	0	0	109.8
96	P	30.8	Very low	28.5	Very low	121 Å²	121	144.6 Å²	144.6	79%	0.786	80%	0.803	S	S	*	*			trans	-145.7	152.6	130.6	32.8	-14.7	0	0	0	116.7
97	Y	25.4	Very low	28.6	Very low	214 Å²	214	144.6 Å²	144.6	84%	0.839	80%	0.803	S	S	*	*			trans	-65.4	149.6	164.2	-84.3	-102.7	0	0	0	114
98	R	28.7	Very low	28.4	Very low	241 Å²	241	147 Å²	147	91%	0.909	80%	0.804	S	S	*	*				-179.2	149.2	121.9	-111.9	-176	-176.3	-178.1	2	115.6
99	N	25.3	Very low	28.4	Very low	145 Å²	145	148.2 Å²	148.2	78%	0.775	81%	0.811	S	S	*	*			trans	-64.7	158.6	-170.2	-53.3	-25.4	0	0	0	118.1
100	S	27.4	Very low	28.2	Very low	126 Å²	126	148.7 Å²	148.7	88%	0.881	81%	0.809	S	S	*	*				-163.6	150.2	129	-167	0	0	0	0	112.2
101	V	26.6	Very low	28.4	Very low	106 Å²	106	149.7 Å²	149.7	64%	0.642	82%	0.815	S	S	*	*			trans	-111.7	143.7	-164.2	166.9	0	0	0	0	110.4
102	H	33.8	Very low	28.2	Very low	186 Å²	186	147.1 Å²	147.1	86%	0.861	81%	0.811	S	S	*	*			trans	-164.9	149.6	135.8	-107.9	-19.6	0	0	0	115.7
103	N	29.7	Very low	28.3	Very low	147 Å²	147	144.5 Å²	144.5	79%	0.786	81%	0.807	S	S	*	*			trans	-85.4	164.7	-161.2	-71.2	-27.7	0	0	0	115.4
104	G	32	Very low	28.4	Very low	72 Å²	72	143.1 Å²	143.1	74%	0.742	80%	0.801	S	S	*	*			trans	166.9	74	153.4	0	0	0	0	0	118.6
105	N	29.9	Very low	28.4	Very low	169 Å²	169	137.2 Å²	137.2	90%	0.904	79%	0.794	S	S	*	*			trans	24.4	132.2	146.6	-60.9	-7.3	0	0	0	123
106	G	30.3	Very low	28.4	Very low	75 Å²	75	137.7 Å²	137.7	77%	0.773	80%	0.798	S	S	*	*			trans	171.8	96.7	153.5	0	0	0	0	0	115.5
107	S	30.4	Very low	28.3	Very low	112 Å²	112	138 Å²	138	78%	0.783	80%	0.797	S	S	*	*			trans	-35.7	162.1	165.9	51.4	0	0	0	0	117.3
108	E	27.1	Very low	28.4	Very low	174 Å²	174	131.9 Å²	131.9	81%	0.813	79%	0.791	S	S	*	*			cis	-178.7	141.4	-7.5	-102.5	-179.7	164.8	0	0	104.7
109	T	28.2	Very low	28.3	Very low	146 Å²	146	129.6 Å²	129.6	90%	0.896	79%	0.788	S	S	*	*			trans	158.6	101.5	137.8	34.7	0	0	0	0	110.4
110	T	25.8	Very low	28.3	Very low	127 Å²	127	128.1 Å²	128.1	78%	0.779	79%	0.789	S	S	*	*			trans	-105.4	117.4	-176.5	-46.3	0	0	0	0	110.4
111	I	29.3	Very low	28.4	Very low	161 Å²	161	130.4 Å²	130.4	83%	0.826	78%	0.783	S	S	*	*			trans	-85	113.2	156.9	-62.4	173.6	0	0	0	106	V113	I111-V113 PolarHBondContact O-N 2.83Å
112	S	25.7	Very low	28.7	Very low	110 Å²	110	131 Å²	131	77%	0.769	79%	0.789	S	S	*	*			trans	-81.6	99.5	-175.6	37.6	0	0	0	0	112
113	V	28.4	Very low	28.5	Very low	124 Å²	124	128.2 Å²	128.2	75%	0.752	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-97.5	126	159.3	-177.9	0	0	0	0	107.5	I111	I111-V113 PolarHBondContact O-N 2.83Å
114	P	28.1	Very low	28.6	Very low	107 Å²	107	124.6 Å²	124.6	70%	0.695	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-67.7	145.7	179	27.9	-32.5	0	0	0	110.7	S116	P114-S116 PolarHBondContact O-N 3.33Å
115	P	27	Very low	28.7	Very low	121 Å²	121	126.7 Å²	126.7	79%	0.786	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-68	122.1	-170.9	28	-32.6	0	0	0	110.3	T117	P115-T117 PolarHBondContact O-N 3.24Å
116	S	27.1	Very low	29.2	Very low	108 Å²	108	122.3 Å²	122.3	76%	0.755	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-51.8	117.7	168.1	51.3	0	0	0	0	110.3	P114 A118	P114-S116 PolarHBondContact O-N 3.33Å; S116-A118 PolarHBondContact O-N 3.41Å
117	T	28.5	Very low	30.2	Very low	126 Å²	126	123.4 Å²	123.4	77%	0.773	73%	0.727	S	S	*	*			trans	-68.8	74.4	167.7	49.2	0	0	0	0	109.9	P115 K119	P115-T117 PolarHBondContact O-N 3.24Å; T117-K119 PolarHBondContact O-N 3.43Å
118	A	26.7	Very low	31.7	Very low	86 Å²	86	119.8 Å²	119.8	71%	0.711	70%	0.7	S	S	*	*			trans	-72.5	98.5	158.1	0	0	0	0	0	106.5	S116 S120	S116-A118 PolarHBondContact O-N 3.41Å; A118-S120 VanDerWaalsContact C-N 3.29Å; A118-S120 PolarHBondContact O-N 3.28Å
119	K	27	Very low	33.6	Very low	193 Å²	193	112.4 Å²	112.4	84%	0.839	67%	0.666	S	S	*	*			trans	-61.3	97.8	165.5	-75.3	-179.8	177.3	179	0	107.1	T117 F121	T117-K119 PolarHBondContact O-N 3.43Å; K119-F121 PolarHBondContact O-N 3.04Å
120	S	25.9	Very low	35.3	Very low	114 Å²	114	112.1 Å²	112.1	80%	0.797	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-58.4	116.9	165.2	50.1	0	0	0	0	108	A118	A118-S120 VanDerWaalsContact C-N 3.29Å; A118-S120 PolarHBondContact O-N 3.28Å
121	F	28.2	Very low	37.1	Very low	175 Å²	175	111 Å²	111	77%	0.768	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-61.3	142.3	173.3	-80	-94	0	0	0	109.9	K119 D123	K119-F121 PolarHBondContact O-N 3.04Å; F121-D123 PolarHBondContact O-N 3.34Å
122	P	33.8	Very low	39.3	Very low	118 Å²	118	103.7 Å²	103.7	77%	0.766	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-65.1	132.2	176.1	27.9	-31.1	0	0	0	109	C124	P122-C124 PolarHBondContact O-N 3.48Å
123	D	29.7	Very low	41.8	Very low	128 Å²	128	100.6 Å²	100.6	68%	0.684	59%	0.589	S	S	*	*			trans	-54	103.8	172	-69.8	-56.1	0	0	0	109.9	F121 L125	F121-D123 PolarHBondContact O-N 3.34Å; D123-L125 HydrophobicContact CB-CD1 3.83Å; D123-L125 HydrophobicContact CB-CG 4.07Å; D123-L125 PolarHBondContact O-N 2.94Å
124	C	31.2	Very low	44.4	Very low	71 Å²	71	94.8 Å²	94.8	48%	0.48	55%	0.554	S	S	.	*			trans	-76.1	96.7	173.9	-166.4	0	0	0	0	108.8	P122 T128 H215	P122-C124 PolarHBondContact O-N 3.48Å; C124-T128 PolarHBondContact SG-OG1 3.42Å; C124-H215 PolarHBondContact SG-NE2 3.45Å
125	L	34.2	Very low	47	Very low	115 Å²	115	93.7 Å²	93.7	60%	0.602	54%	0.539	S	S	*	.			trans	-110.4	125.4	-178.6	-67.3	162.5	0	0	0	107.9	D123 D127	D123-L125 HydrophobicContact CB-CD1 3.83Å; D123-L125 HydrophobicContact CB-CG 4.07Å; D123-L125 PolarHBondContact O-N 2.94Å; L125-D127 PolarHBondContact O-N 2.81Å
126	T	40.5	Very low	49.8	Very low	77 Å²	77	91.3 Å²	91.3	47%	0.472	52%	0.524	S	S	.	.	S	Bend	trans	63.5	-25.4	159.4	45	0	0	0	0	122.5
127	D	52	Low	52.8	Low	98 Å²	98	89.8 Å²	89.8	52%	0.524	51%	0.511	S	S	.	.			trans	-111	0.7	-161.4	-62.2	0.4	0	0	0	116.2	L125 F129 E130	L125-D127 PolarHBondContact O-N 2.81Å; D127-F129 VanDerWaalsContact C-N 3.28Å; D127-F129 PolarHBondContact O-N 3.47Å; D127-F129 VanDerWaalsContact O-N 3.11Å; D127-E130 PolarHBondContact O-N 3.49Å; D127-E130 VanDerWaalsContact O-N 3.14Å
128	T	61.4	Low	55.7	Low	36 Å²	36	83.8 Å²	83.8	22%	0.221	47%	0.474	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-32	-165.8	-30.6	0	0	0	0	114.2	C124 L212 H215	C124-T128 PolarHBondContact SG-OG1 3.42Å; T128-L212 HydrophobicContact CG2-CD1 3.57Å; T128-L212 VanDerWaalsContact O-CD1 3.26Å; T128-L212 WeakPolarHBondContact O-CD1 3.34Å; T128-H215 VanDerWaalsContact CG2-CD2 3.46Å; T128-H215 WeakPolarHBondContact CG2-CD2 3.31Å
129	F	67.3	Low	58.7	Low	19 Å²	19	79.7 Å²	79.7	8%	0.083	44%	0.441	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-9.2	180	-74.6	-86.9	0	0	0	114.3	D127 S131 L132 P165 L169 I181 L200 L212 L216	D127-F129 VanDerWaalsContact C-N 3.28Å; D127-F129 PolarHBondContact O-N 3.47Å; D127-F129 VanDerWaalsContact O-N 3.11Å; F129-S131 PolarHBondContact O-N 2.65Å; F129-L132 HydrophobicContact CD1-CD2 3.87Å; F129-L132 HydrophobicContact CE1-CD2 4.33Å; F129-L132 WeakPolarHBondContact O-CB 3.37Å; F129-L132 PolarHBondContact O-N 3.32Å; F129-P165 HydrophobicContact CB-CB 4.23Å; F129-P165 VanDerWaalsContact O-CB 3.32Å; F129-P165 WeakPolarHBondContact O-CB 3.39Å; F129-P165 WeakPolarHBondContact O-CG 3.2Å; F129-L169 HydrophobicContact CB-CD1 4.26Å; F129-L169 HydrophobicContact CD1-CD1 4.09Å; F129-L169 HydrophobicContact CD1-CD2 4.15Å; F129-L169 HydrophobicContact CD1-CG 4.36Å; F129-L169 HydrophobicContact CD2-CD1 3.96Å; F129-L169 HydrophobicContact CE1-CD1 4.38Å; F129-L169 HydrophobicContact CE1-CD2 3.69Å; F129-L169 HydrophobicContact CE1-CG 4.39Å; F129-L169 HydrophobicContact CE2-CD1 4.26Å; F129-L169 HydrophobicContact CE2-CD2 4.31Å; F129-L169 HydrophobicContact CG-CD1 3.84Å; F129-L169 HydrophobicContact CZ-CD1 4.42Å; F129-L169 HydrophobicContact CZ-CD2 3.74Å; F129-I181 HydrophobicContact CD2-CD1 4.18Å; F129-I181 HydrophobicContact CE2-CD1 3.17Å; F129-I181 HydrophobicContact CE2-CG1 3.86Å; F129-I181 HydrophobicContact CZ-CD1 3.48Å; F129-I181 VanDerWaalsContact CZ-CD1 3.48Å; F129-L200 HydrophobicContact CE1-CD2 4.28Å; F129-L212 HydrophobicContact CD1-CD2 4.26Å; F129-L212 HydrophobicContact CE1-CD2 4.23Å; F129-L216 HydrophobicContact CE1-CD1 3.69Å; F129-L216 HydrophobicContact CE1-CD2 4.47Å; F129-L216 HydrophobicContact CE2-CD1 4.14Å; F129-L216 HydrophobicContact CE2-CD2 3.37Å; F129-L216 HydrophobicContact CE2-CG 4.31Å; F129-L216 HydrophobicContact CZ-CD1 3.25Å; F129-L216 HydrophobicContact CZ-CD2 3.34Å; F129-L216 HydrophobicContact CZ-CG 3.87Å
130	E	62.7	Low	61.7	Low	140 Å²	140	74.4 Å²	74.4	65%	0.654	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-23.9	-178.1	-160	166.8	-162.1	0	0	111.4	D127	D127-E130 PolarHBondContact O-N 3.49Å; D127-E130 VanDerWaalsContact O-N 3.14Å
131	S	65	Low	64.7	Low	103 Å²	103	70.5 Å²	70.5	72%	0.72	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-5.6	173	63	0	0	0	0	114.9	F129 D133	F129-S131 PolarHBondContact O-N 2.65Å; S131-D133 PolarHBondContact O-N 2.96Å; S131-D133 VanDerWaalsContact O-N 3.09Å
132	L	74.4	Confident	67.7	Low	9 Å²	9	62.1 Å²	62.1	5%	0.047	35%	0.353	C	S	.	.			trans	-72.9	106.2	-178.2	179.5	60.5	0	0	0	110.3	F129 V134 L138 P165 L168 L204 L212	F129-L132 HydrophobicContact CD1-CD2 3.87Å; F129-L132 HydrophobicContact CE1-CD2 4.33Å; F129-L132 WeakPolarHBondContact O-CB 3.37Å; F129-L132 PolarHBondContact O-N 3.32Å; L132-V134 HydrophobicContact CD2-CG2 4.3Å; L132-V134 HydrophobicContact CG-CG2 4.2Å; L132-V134 PolarHBondContact O-N 2.78Å; L132-V134 VanDerWaalsContact O-N 3.12Å; L132-L138 HydrophobicContact CD1-CD2 4.5Å; L132-L138 HydrophobicContact CD2-CD2 4.44Å; L132-P165 HydrophobicContact CB-CG 4.4Å; L132-P165 WeakPolarHBondContact O-CG 3.18Å; L132-L168 HydrophobicContact CD2-CD2 4.02Å; L132-L204 HydrophobicContact CD1-CD2 3.85Å; L132-L204 HydrophobicContact CD2-CD2 4.39Å; L132-L212 HydrophobicContact CB-CD2 4.15Å; L132-L212 HydrophobicContact CD1-CD2 3.72Å; L132-L212 HydrophobicContact CD2-CD2 4.09Å; L132-L212 HydrophobicContact CG-CD2 4.19Å
133	D	78.8	Confident	70.4	Confident	45 Å²	45	58.2 Å²	58.2	24%	0.241	33%	0.327	C	S	.	.			trans	-76.5	99.7	170	-159.2	-4.1	0	0	0	109.6	S131 Q135 K161	S131-D133 PolarHBondContact O-N 2.96Å; S131-D133 VanDerWaalsContact O-N 3.09Å; D133-Q135 WeakPolarHBondContact O-CG 3.22Å; D133-Q135 PolarHBondContact O-N 3.13Å; D133-Q135 PolarHBondContact OD1-NE2 2.96Å; D133-Q135 PolarHBondContact OD2-NE2 2.64Å; D133-K161 VanDerWaalsContact CG-CE 3.42Å; D133-K161 WeakPolarHBondContact OD1-CE 3.42Å; D133-K161 IonicContact OD1-NZ 3.26Å; D133-K161 WeakPolarHBondContact OD2-CE 3.32Å; D133-K161 IonicContact OD2-NZ 3.97Å; D133-K161 PolarHBondContact OD2-NZ 3.36Å
134	V	82.2	Confident	73.2	Confident	1 Å²	1	58.8 Å²	58.8	1%	0.006	32%	0.319	C	S	.	.			trans	-70.5	99.6	179.9	-177.8	0	0	0	0	109.3	L132 L139 I156 R164 P165 L168	L132-V134 HydrophobicContact CD2-CG2 4.3Å; L132-V134 HydrophobicContact CG-CG2 4.2Å; L132-V134 PolarHBondContact O-N 2.78Å; L132-V134 VanDerWaalsContact O-N 3.12Å; V134-L139 HydrophobicContact CG1-CD1 4.04Å; V134-L139 HydrophobicContact CG1-CD2 3.86Å; V134-L139 HydrophobicContact CG1-CG 3.91Å; V134-I156 HydrophobicContact CG1-CG2 3.89Å; V134-R164 HydrophobicContact CB-CB 3.77Å; V134-R164 HydrophobicContact CG1-CB 4.43Å; V134-R164 HydrophobicContact CG2-CB 3.75Å; V134-P165 HydrophobicContact CG2-CG 4.24Å; V134-L168 HydrophobicContact CG1-CD2 4.32Å; V134-L168 HydrophobicContact CG2-CD2 3.99Å
135	Q	83.3	Confident	75.8	Confident	85 Å²	85	59.3 Å²	59.3	40%	0.397	31%	0.314	S	S	.	.			trans	-95.5	154	-179	-66.4	-68.4	-18.6	0	0	112	D133 L138 L139	D133-Q135 WeakPolarHBondContact O-CG 3.22Å; D133-Q135 PolarHBondContact O-N 3.13Å; D133-Q135 PolarHBondContact OD1-NE2 2.96Å; D133-Q135 PolarHBondContact OD2-NE2 2.64Å; Q135-L138 WeakPolarHBondContact O-CB 3.41Å; Q135-L138 PolarHBondContact O-N 3.42Å; Q135-L139 PolarHBondContact O-N 3.45Å
136	P	86.4	Confident	78.2	Confident	70 Å²	70	62.1 Å²	62.1	46%	0.455	32%	0.324	S	S	.	.	H	α-helix	trans	-52	-38.9	178.3	-25.5	33	0	0	0	115.7	L138 L139 D140 M157	P136-L138 VanDerWaalsContact C-N 3.26Å; P136-L138 PolarHBondContact O-N 3.04Å; P136-L139 PolarHBondContact O-N 3.21Å; P136-D140 WeakPolarHBondContact O-CB 3.37Å; P136-D140 PolarHBondContact O-N 3.44Å; P136-M157 HydrophobicContact CG-CE 4.48Å; P136-M157 HydrophobicContact CG-SD 4.3Å
137	P	88.7	Confident	80.3	Confident	76 Å²	76	59.4 Å²	59.4	49%	0.494	31%	0.31	S	S	.	.	H	α-helix	trans	-62.1	-30.3	177.6	-24.7	35.9	0	0	0	114.1	Y141 T207	P137-Y141 PolarHBondContact O-N 3.01Å; P137-T207 HydrophobicContact CB-CG2 4.15Å
138	L	89.7	Confident	82	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-69.6	-44.6	177.4	-176.3	70.1	0	0	0	110.4	L132 Q135 P136 L142 L168 A203 L204 T207	L132-L138 HydrophobicContact CD1-CD2 4.5Å; L132-L138 HydrophobicContact CD2-CD2 4.44Å; Q135-L138 WeakPolarHBondContact O-CB 3.41Å; Q135-L138 PolarHBondContact O-N 3.42Å; P136-L138 VanDerWaalsContact C-N 3.26Å; P136-L138 PolarHBondContact O-N 3.04Å; L138-L142 WeakPolarHBondContact O-CG 3.37Å; L138-L142 PolarHBondContact O-N 2.9Å; L138-L168 HydrophobicContact CD2-CD2 3.79Å; L138-A203 HydrophobicContact CD1-CB 3.53Å; L138-L204 HydrophobicContact CD1-CD2 4.07Å; L138-L204 HydrophobicContact CD1-CG 4.47Å; L138-L204 HydrophobicContact CD2-CD2 4.38Å; L138-T207 HydrophobicContact CB-CG2 3.98Å; L138-T207 HydrophobicContact CD1-CG2 4.05Å
139	L	90.5	Very high	83.3	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-70.3	-40.9	178.8	-62.4	176.9	0	0	0	111.9	V134 Q135 P136 Y141 L142 V143 I148 S153 I156 M157 L168	V134-L139 HydrophobicContact CG1-CD1 4.04Å; V134-L139 HydrophobicContact CG1-CD2 3.86Å; V134-L139 HydrophobicContact CG1-CG 3.91Å; Q135-L139 PolarHBondContact O-N 3.45Å; P136-L139 PolarHBondContact O-N 3.21Å; L139-Y141 VanDerWaalsContact C-N 3.28Å; L139-Y141 PolarHBondContact O-N 3.26Å; L139-L142 PolarHBondContact O-N 2.95Å; L139-L142 VanDerWaalsContact O-N 3.09Å; L139-V143 WeakPolarHBondContact O-CG2 3.35Å; L139-V143 PolarHBondContact O-N 3.35Å; L139-I148 HydrophobicContact CB-CD1 4.37Å; L139-I148 HydrophobicContact CD2-CD1 3.69Å; L139-S153 WeakPolarHBondContact CB-OG 3.47Å; L139-I156 HydrophobicContact CD1-CB 4.31Å; L139-I156 HydrophobicContact CD1-CG2 4.1Å; L139-I156 HydrophobicContact CD2-CD1 3.99Å; L139-I156 HydrophobicContact CD2-CG2 4.21Å; L139-M157 HydrophobicContact CD1-CG 3.52Å; L139-M157 HydrophobicContact CD1-SD 3.54Å; L139-M157 VanDerWaalsContact CD1-SD 3.54Å; L139-L168 HydrophobicContact CD2-CD1 3.7Å
140	D	89.1	Confident	84.3	Confident	82 Å²	82	62.1 Å²	62.1	44%	0.439	32%	0.323	S	S	.	.	H	α-helix	trans	-58.1	-41.7	175.5	177.1	47.7	0	0	0	111.4	P136 V143 R144	P136-D140 WeakPolarHBondContact O-CB 3.37Å; P136-D140 PolarHBondContact O-N 3.44Å; D140-V143 PolarHBondContact O-N 3.35Å; D140-R144 VanDerWaalsContact CG-NH2 3.31Å; D140-R144 VanDerWaalsContact O-CB 3.22Å; D140-R144 WeakPolarHBondContact O-CB 3.47Å; D140-R144 PolarHBondContact O-N 3.19Å; D140-R144 IonicContact OD1-NH2 3.32Å; D140-R144 PolarHBondContact OD1-NH2 2.86Å; D140-R144 IonicContact OD2-CZ 3.63Å; D140-R144 IonicContact OD2-NH2 2.65Å; D140-R144 PolarHBondContact OD2-NH2 3.43Å
141	Y	90.2	Very high	85.6	Confident	32 Å²	32	61.3 Å²	61.3	13%	0.125	32%	0.319	C	S	.	.	H	α-helix	trans	-59.2	-49.3	172.2	-171.5	-80.4	0	0	0	111.5	P137 L139 V143 R144 H145 N202 A203 H206	P137-Y141 PolarHBondContact O-N 3.01Å; L139-Y141 VanDerWaalsContact C-N 3.28Å; L139-Y141 PolarHBondContact O-N 3.26Å; Y141-V143 PolarHBondContact O-N 3.46Å; Y141-R144 PolarHBondContact O-N 3.31Å; Y141-H145 AromaticContact CD1-CD2 3.65Å; Y141-H145 AromaticContact CE1-CD2 3.37Å; Y141-H145 WeakPolarHBondContact CE1-CD2 3.36Å; Y141-H145 AromaticContact CE1-NE2 3.9Å; Y141-H145 AromaticContact CE2-CD2 3.87Å; Y141-H145 AromaticContact CE2-NE2 3.66Å; Y141-H145 AromaticContact CZ-CD2 3.48Å; Y141-H145 VanDerWaalsContact CZ-CD2 3.48Å; Y141-H145 AromaticContact CZ-NE2 3.47Å; Y141-H145 PolarHBondContact O-CD2 3.48Å; Y141-H145 PolarHBondContact O-N 2.99Å; Y141-N202 HydrophobicContact CE1-CB 4.11Å; Y141-A203 HydrophobicContact CD1-CB 3.41Å; Y141-A203 VanDerWaalsContact CD1-CB 3.41Å; Y141-A203 HydrophobicContact CE1-CB 3.97Å; Y141-A203 HydrophobicContact CG-CB 4.02Å; Y141-H206 HydrophobicContact CD2-CB 3.91Å; Y141-H206 AromaticContact CD2-CG 3.65Å; Y141-H206 AromaticContact CD2-ND1 3.85Å; Y141-H206 HydrophobicContact CE2-CB 3.81Å; Y141-H206 AromaticContact CE2-CD2 3.75Å; Y141-H206 AromaticContact CE2-CG 3.68Å
142	L	89.8	Confident	86.7	Confident	0 Å²	0	58 Å²	58	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-67.2	-35.9	-177.8	-69.5	170.9	0	0	0	113	L138 L139 H146 A147 I148 L168 V172 L199 L200 A203	L138-L142 WeakPolarHBondContact O-CG 3.37Å; L138-L142 PolarHBondContact O-N 2.9Å; L139-L142 PolarHBondContact O-N 2.95Å; L139-L142 VanDerWaalsContact O-N 3.09Å; L142-H146 PolarHBondContact O-N 3.33Å; L142-A147 HydrophobicContact CB-CB 4.08Å; L142-A147 HydrophobicContact CD2-CB 3.67Å; L142-A147 HydrophobicContact CG-CB 4.48Å; L142-A147 WeakPolarHBondContact O-CB 3.39Å; L142-A147 PolarHBondContact O-N 3.25Å; L142-I148 HydrophobicContact CB-CD1 3.8Å; L142-I148 HydrophobicContact CB-CG1 3.77Å; L142-I148 HydrophobicContact CD1-CD1 4.43Å; L142-I148 PolarHBondContact O-N 2.6Å; L142-L168 HydrophobicContact CD1-CD1 3.55Å; L142-V172 HydrophobicContact CD1-CG2 4.22Å; L142-L199 HydrophobicContact CD2-CB 4.2Å; L142-L200 HydrophobicContact CD1-CD1 4.35Å; L142-A203 HydrophobicContact CD2-CB 3.85Å; L142-A203 HydrophobicContact CG-CB 3.94Å
143	V	90.8	Very high	87.5	Confident	35 Å²	35	58.5 Å²	58.5	21%	0.212	30%	0.301	C	S	.	.	H	α-helix	trans	-66.3	-46.8	173.7	172.8	0	0	0	0	110.5	L139 D140 Y141 H145 H146 I148 E150	L139-V143 WeakPolarHBondContact O-CG2 3.35Å; L139-V143 PolarHBondContact O-N 3.35Å; D140-V143 PolarHBondContact O-N 3.35Å; Y141-V143 PolarHBondContact O-N 3.46Å; V143-H145 PolarHBondContact O-N 3.38Å; V143-H146 PolarHBondContact O-N 3.07Å; V143-I148 HydrophobicContact CG2-CD1 4.08Å; V143-I148 HydrophobicContact CG2-CG1 3.71Å; V143-E150 HydrophobicContact CG1-CB 4.34Å
144	R	89.1	Confident	88	Confident	141 Å²	141	61.1 Å²	61.1	53%	0.532	31%	0.314	S	S	.	.	H	α-helix	trans	-59.9	-34.6	179.2	-174.3	-179.3	-60.5	145.1	10.6	112.6	D140 Y141 H146	D140-R144 VanDerWaalsContact CG-NH2 3.31Å; D140-R144 VanDerWaalsContact O-CB 3.22Å; D140-R144 WeakPolarHBondContact O-CB 3.47Å; D140-R144 PolarHBondContact O-N 3.19Å; D140-R144 IonicContact OD1-NH2 3.32Å; D140-R144 PolarHBondContact OD1-NH2 2.86Å; D140-R144 IonicContact OD2-CZ 3.63Å; D140-R144 IonicContact OD2-NH2 2.65Å; D140-R144 PolarHBondContact OD2-NH2 3.43Å; Y141-R144 PolarHBondContact O-N 3.31Å; R144-H146 VanDerWaalsContact C-N 3.33Å
145	H	86.6	Confident	88.4	Confident	82 Å²	82	66.6 Å²	66.6	38%	0.38	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	13.1	177.5	-72.4	-76.9	0	0	0	113.8	Y141 V143 A147 L199	Y141-H145 AromaticContact CD1-CD2 3.65Å; Y141-H145 AromaticContact CE1-CD2 3.37Å; Y141-H145 WeakPolarHBondContact CE1-CD2 3.36Å; Y141-H145 AromaticContact CE1-NE2 3.9Å; Y141-H145 AromaticContact CE2-CD2 3.87Å; Y141-H145 AromaticContact CE2-NE2 3.66Å; Y141-H145 AromaticContact CZ-CD2 3.48Å; Y141-H145 VanDerWaalsContact CZ-CD2 3.48Å; Y141-H145 AromaticContact CZ-NE2 3.47Å; Y141-H145 PolarHBondContact O-CD2 3.48Å; Y141-H145 PolarHBondContact O-N 2.99Å; V143-H145 PolarHBondContact O-N 3.38Å; H145-A147 PolarHBondContact O-N 3.23Å; H145-A147 VanDerWaalsContact O-N 3.12Å; H145-L199 HydrophobicContact CB-CD2 4.11Å
146	H	84.3	Confident	88.7	Confident	174 Å²	174	62.7 Å²	62.7	81%	0.806	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.4	25.7	178.1	-52	-59.4	0	0	0	114.4	L142 V143 R144	L142-H146 PolarHBondContact O-N 3.33Å; V143-H146 PolarHBondContact O-N 3.07Å; R144-H146 VanDerWaalsContact C-N 3.33Å
147	A	83.7	Confident	88.8	Confident	20 Å²	20	61.9 Å²	61.9	17%	0.165	31%	0.31	C	S	.	.	S	Bend	trans	-77.5	-33.3	175.3	0	0	0	0	0	111.8	L142 H145 L199	L142-A147 HydrophobicContact CB-CB 4.08Å; L142-A147 HydrophobicContact CD2-CB 3.67Å; L142-A147 HydrophobicContact CG-CB 4.48Å; L142-A147 WeakPolarHBondContact O-CB 3.39Å; L142-A147 PolarHBondContact O-N 3.25Å; H145-A147 PolarHBondContact O-N 3.23Å; H145-A147 VanDerWaalsContact O-N 3.12Å; A147-L199 HydrophobicContact CB-CB 3.93Å; A147-L199 HydrophobicContact CB-CD1 3.6Å; A147-L199 HydrophobicContact CB-CG 4.38Å
148	I	87.4	Confident	88.7	Confident	10 Å²	10	65.9 Å²	65.9	5%	0.051	32%	0.322	C	S	.	.	S	Bend	trans	-135.6	157.1	174.7	67.2	-179.7	0	0	0	109.2	L139 L142 V143 I156 A171 V172	L139-I148 HydrophobicContact CB-CD1 4.37Å; L139-I148 HydrophobicContact CD2-CD1 3.69Å; L142-I148 HydrophobicContact CB-CD1 3.8Å; L142-I148 HydrophobicContact CB-CG1 3.77Å; L142-I148 HydrophobicContact CD1-CD1 4.43Å; L142-I148 PolarHBondContact O-N 2.6Å; V143-I148 HydrophobicContact CG2-CD1 4.08Å; V143-I148 HydrophobicContact CG2-CG1 3.71Å; I148-I156 HydrophobicContact CD1-CD1 4.41Å; I148-A171 HydrophobicContact CG2-CB 3.79Å; I148-V172 HydrophobicContact CG2-CG2 3.72Å
149	S	88.8	Confident	88.6	Confident	55 Å²	55	66.6 Å²	66.6	39%	0.385	33%	0.329	S	S	.	.			trans	-79.8	157.4	173.6	75.9	0	0	0	0	111.7	E151 S152 S153	S149-E151 PolarHBondContact O-N 3.4Å; S149-S152 WeakPolarHBondContact O-CB 3.31Å; S149-S152 PolarHBondContact O-N 3.48Å; S149-S152 VanDerWaalsContact O-N 3.13Å; S149-S152 WeakPolarHBondContact OG-CB 3.46Å; S149-S152 PolarHBondContact OG-N 3.34Å; S149-S152 PolarHBondContact OG-OG 3.42Å; S149-S153 PolarHBondContact O-N 3.35Å
150	E	88.6	Confident	88.3	Confident	145 Å²	145	71.9 Å²	71.9	68%	0.678	36%	0.357	S	S	*	.	H	α-helix	trans	-58.9	-36.8	172.6	-171.4	174	-172.1	0	0	111.4	V143 S153 L154	V143-E150 HydrophobicContact CG1-CB 4.34Å; E150-S153 WeakPolarHBondContact O-CB 3.3Å; E150-S153 PolarHBondContact O-N 3.3Å; E150-L154 WeakPolarHBondContact O-CG 3.43Å; E150-L154 PolarHBondContact O-N 3Å
151	E	89.7	Confident	87.9	Confident	122 Å²	122	73.9 Å²	73.9	57%	0.57	36%	0.362	S	S	*	.	H	α-helix	trans	-63.2	-42.5	173.9	-166.8	-168.2	152	0	0	112.1	S149 L154 K155	S149-E151 PolarHBondContact O-N 3.4Å; E151-L154 PolarHBondContact O-N 3.39Å; E151-K155 HydrophobicContact CG-CD 4.48Å; E151-K155 WeakPolarHBondContact O-CG 3.39Å; E151-K155 PolarHBondContact O-N 3.49Å; E151-K155 WeakPolarHBondContact OE1-CE 3.39Å; E151-K155 IonicContact OE1-NZ 2.64Å; E151-K155 PolarHBondContact OE1-NZ 3.09Å
152	S	88.4	Confident	87.3	Confident	35 Å²	35	79.3 Å²	79.3	25%	0.245	39%	0.392	C	S	.	.	H	α-helix	trans	-63.7	-41.1	175.2	-57.3	0	0	0	0	111.6	S149 K155 I156	S149-S152 WeakPolarHBondContact O-CB 3.31Å; S149-S152 PolarHBondContact O-N 3.48Å; S149-S152 VanDerWaalsContact O-N 3.13Å; S149-S152 WeakPolarHBondContact OG-CB 3.46Å; S149-S152 PolarHBondContact OG-N 3.34Å; S149-S152 PolarHBondContact OG-OG 3.42Å; S152-K155 PolarHBondContact O-N 3.22Å; S152-I156 WeakPolarHBondContact O-CD1 3.5Å; S152-I156 WeakPolarHBondContact O-CG1 3.4Å; S152-I156 PolarHBondContact O-N 2.86Å
153	S	90.8	Very high	86.9	Confident	19 Å²	19	84 Å²	84	13%	0.133	41%	0.414	C	S	.	.	H	α-helix	trans	-59.5	-46.9	176	176	0	0	0	0	111.8	L139 S149 E150 K155 I156 M157	L139-S153 WeakPolarHBondContact CB-OG 3.47Å; S149-S153 PolarHBondContact O-N 3.35Å; E150-S153 WeakPolarHBondContact O-CB 3.3Å; E150-S153 PolarHBondContact O-N 3.3Å; S153-K155 PolarHBondContact O-N 3.04Å; S153-I156 PolarHBondContact O-N 3.43Å; S153-M157 WeakPolarHBondContact O-CG 3.26Å; S153-M157 PolarHBondContact O-N 3.17Å
154	L	90.2	Very high	86.7	Confident	99 Å²	99	84.7 Å²	84.7	52%	0.518	41%	0.412	S	S	.	.	H	α-helix	trans	-62.6	-43.2	176.3	-70.8	171.4	0	0	0	112	E150 E151 I156 M157 Q158	E150-L154 WeakPolarHBondContact O-CG 3.43Å; E150-L154 PolarHBondContact O-N 3Å; E151-L154 PolarHBondContact O-N 3.39Å; L154-I156 VanDerWaalsContact C-N 3.35Å; L154-I156 PolarHBondContact O-N 3.36Å; L154-M157 PolarHBondContact O-N 3.39Å; L154-Q158 WeakPolarHBondContact O-CB 3.38Å; L154-Q158 VanDerWaalsContact O-CG 3.26Å; L154-Q158 WeakPolarHBondContact O-CG 3.43Å; L154-Q158 PolarHBondContact O-N 2.81Å
155	K	90.1	Very high	86.4	Confident	116 Å²	116	78.3 Å²	78.3	50%	0.504	39%	0.39	S	S	.	.	H	α-helix	trans	-59.7	-42.6	175.4	-77.5	170.7	171.3	169	0	112.2	E151 S152 S153 Q158 A159	E151-K155 HydrophobicContact CG-CD 4.48Å; E151-K155 WeakPolarHBondContact O-CG 3.39Å; E151-K155 PolarHBondContact O-N 3.49Å; E151-K155 WeakPolarHBondContact OE1-CE 3.39Å; E151-K155 IonicContact OE1-NZ 2.64Å; E151-K155 PolarHBondContact OE1-NZ 3.09Å; S152-K155 PolarHBondContact O-N 3.22Å; S153-K155 PolarHBondContact O-N 3.04Å; K155-Q158 PolarHBondContact O-N 3.02Å; K155-A159 PolarHBondContact O-N 3.18Å
156	I	88.8	Confident	86.1	Confident	3 Å²	3	77 Å²	77	2%	0.015	39%	0.39	C	S	.	.	H	α-helix	trans	-65.4	-42.1	176.9	-66.6	159.5	0	0	0	110.5	V134 L139 I148 S152 S153 L154 Q158 A159 R164 L167 L168 A171	V134-I156 HydrophobicContact CG1-CG2 3.89Å; L139-I156 HydrophobicContact CD1-CB 4.31Å; L139-I156 HydrophobicContact CD1-CG2 4.1Å; L139-I156 HydrophobicContact CD2-CD1 3.99Å; L139-I156 HydrophobicContact CD2-CG2 4.21Å; I148-I156 HydrophobicContact CD1-CD1 4.41Å; S152-I156 WeakPolarHBondContact O-CD1 3.5Å; S152-I156 WeakPolarHBondContact O-CG1 3.4Å; S152-I156 PolarHBondContact O-N 2.86Å; S153-I156 PolarHBondContact O-N 3.43Å; L154-I156 VanDerWaalsContact C-N 3.35Å; L154-I156 PolarHBondContact O-N 3.36Å; I156-Q158 VanDerWaalsContact C-N 3.32Å; I156-Q158 PolarHBondContact O-N 2.98Å; I156-A159 PolarHBondContact O-N 2.87Å; I156-R164 HydrophobicContact CG2-CB 4Å; I156-R164 HydrophobicContact CG2-CG 4.45Å; I156-R164 WeakPolarHBondContact O-CG 3.21Å; I156-L167 HydrophobicContact CG1-CB 3.89Å; I156-L168 HydrophobicContact CD1-CB 4.4Å; I156-L168 HydrophobicContact CD1-CD1 4.23Å; I156-A171 HydrophobicContact CD1-CB 4.04Å
157	M	88.6	Confident	86.1	Confident	54 Å²	54	71.9 Å²	71.9	27%	0.266	37%	0.368	S	S	.	.	H	α-helix	trans	-67	-33.1	179.4	-77.4	-53.3	-38.7	0	0	113.5	P136 L139 S153 L154 A159 R164	P136-M157 HydrophobicContact CG-CE 4.48Å; P136-M157 HydrophobicContact CG-SD 4.3Å; L139-M157 HydrophobicContact CD1-CG 3.52Å; L139-M157 HydrophobicContact CD1-SD 3.54Å; L139-M157 VanDerWaalsContact CD1-SD 3.54Å; S153-M157 WeakPolarHBondContact O-CG 3.26Å; S153-M157 PolarHBondContact O-N 3.17Å; L154-M157 PolarHBondContact O-N 3.39Å; M157-A159 VanDerWaalsContact C-N 3.31Å; M157-R164 PolarHBondContact O-NH2 2.96Å
158	Q	88.3	Confident	86.2	Confident	159 Å²	159	71 Å²	71	74%	0.743	36%	0.36	S	S	*	.	H	α-helix	trans	-76.8	-17.2	177.7	-71.7	172.8	1.7	0	0	113.3	L154 K155 I156	L154-Q158 WeakPolarHBondContact O-CB 3.38Å; L154-Q158 VanDerWaalsContact O-CG 3.26Å; L154-Q158 WeakPolarHBondContact O-CG 3.43Å; L154-Q158 PolarHBondContact O-N 2.81Å; K155-Q158 PolarHBondContact O-N 3.02Å; I156-Q158 VanDerWaalsContact C-N 3.32Å; I156-Q158 PolarHBondContact O-N 2.98Å
159	A	86.9	Confident	86	Confident	16 Å²	16	71 Å²	71	13%	0.132	36%	0.36	C	S	.	.	S	Bend	trans	-75.9	157.5	178.9	0	0	0	0	0	112.8	K155 I156 M157 Q163 R164 L167	K155-A159 PolarHBondContact O-N 3.18Å; I156-A159 PolarHBondContact O-N 2.87Å; M157-A159 VanDerWaalsContact C-N 3.31Å; A159-Q163 HydrophobicContact CB-CB 4.39Å; A159-R164 PolarHBondContact O-NE 3.33Å; A159-L167 HydrophobicContact CB-CD1 3.27Å
160	D	83.9	Confident	85.6	Confident	110 Å²	110	72.2 Å²	72.2	59%	0.588	37%	0.369	S	S	*	.			trans	-55.5	143.8	173.8	-70.3	-33.3	0	0	0	111.2	L162 Q163 R164	D160-L162 PolarHBondContact O-N 3.48Å; D160-Q163 HydrophobicContact CB-CG 4.26Å; D160-Q163 WeakPolarHBondContact O-CA 3.46Å; D160-Q163 PolarHBondContact O-N 3.29Å; D160-R164 WeakPolarHBondContact O-CG 3.31Å; D160-R164 PolarHBondContact O-N 3.3Å
161	K	81	Confident	85.4	Confident	125 Å²	125	67 Å²	67	54%	0.543	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.2	-38.7	-174.5	-167.7	174.5	-175.1	170.7	0	112.9	D133 Q163	D133-K161 VanDerWaalsContact CG-CE 3.42Å; D133-K161 WeakPolarHBondContact OD1-CE 3.42Å; D133-K161 IonicContact OD1-NZ 3.26Å; D133-K161 WeakPolarHBondContact OD2-CE 3.32Å; D133-K161 IonicContact OD2-NZ 3.97Å; D133-K161 PolarHBondContact OD2-NZ 3.36Å; K161-Q163 VanDerWaalsContact C-N 3.33Å; K161-Q163 PolarHBondContact O-N 3.24Å
162	L	78.3	Confident	85	Confident	146 Å²	146	61.6 Å²	61.6	76%	0.764	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-24.1	179.2	-62.5	173.3	0	0	0	113.7	D160	D160-L162 PolarHBondContact O-N 3.48Å
163	Q	81	Confident	84.3	Confident	98 Å²	98	62.2 Å²	62.2	46%	0.458	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-17.3	-178.8	-62.5	-177.8	8.4	0	0	112.9	A159 D160 K161 S166 L167	A159-Q163 HydrophobicContact CB-CB 4.39Å; D160-Q163 HydrophobicContact CB-CG 4.26Å; D160-Q163 WeakPolarHBondContact O-CA 3.46Å; D160-Q163 PolarHBondContact O-N 3.29Å; K161-Q163 VanDerWaalsContact C-N 3.33Å; K161-Q163 PolarHBondContact O-N 3.24Å; Q163-S166 PolarHBondContact O-N 3.29Å; Q163-S166 PolarHBondContact O-OG 3.49Å; Q163-L167 HydrophobicContact CB-CD1 4.36Å; Q163-L167 WeakPolarHBondContact O-CG 3.49Å; Q163-L167 PolarHBondContact O-N 3.46Å
164	R	86.5	Confident	83.2	Confident	49 Å²	49	61.8 Å²	61.8	19%	0.185	33%	0.334	C	S	.	.	H	α-helix	trans	-58.9	-43.2	-177.1	-54	-169.9	177.2	162.3	-5.1	113.6	V134 I156 M157 A159 D160 S166 L167 L168	V134-R164 HydrophobicContact CB-CB 3.77Å; V134-R164 HydrophobicContact CG1-CB 4.43Å; V134-R164 HydrophobicContact CG2-CB 3.75Å; I156-R164 HydrophobicContact CG2-CB 4Å; I156-R164 HydrophobicContact CG2-CG 4.45Å; I156-R164 WeakPolarHBondContact O-CG 3.21Å; M157-R164 PolarHBondContact O-NH2 2.96Å; A159-R164 PolarHBondContact O-NE 3.33Å; D160-R164 WeakPolarHBondContact O-CG 3.31Å; D160-R164 PolarHBondContact O-N 3.3Å; R164-S166 PolarHBondContact O-N 2.93Å; R164-L167 PolarHBondContact O-N 3.24Å; R164-L168 VanDerWaalsContact O-CB 3.27Å; R164-L168 WeakPolarHBondContact O-CB 3.24Å; R164-L168 PolarHBondContact O-N 3.44Å
165	P	83.4	Confident	81.5	Confident	8 Å²	8	60.6 Å²	60.6	5%	0.052	33%	0.332	C	S	.	.	H	α-helix	trans	-63.2	-41.6	179.5	-23.3	35.1	0	0	0	112.6	F129 L132 V134 L168 L169	F129-P165 HydrophobicContact CB-CB 4.23Å; F129-P165 VanDerWaalsContact O-CB 3.32Å; F129-P165 WeakPolarHBondContact O-CB 3.39Å; F129-P165 WeakPolarHBondContact O-CG 3.2Å; L132-P165 HydrophobicContact CB-CG 4.4Å; L132-P165 WeakPolarHBondContact O-CG 3.18Å; V134-P165 HydrophobicContact CG2-CG 4.24Å; P165-L168 PolarHBondContact O-N 3.24Å; P165-L169 VanDerWaalsContact O-CG 3.26Å; P165-L169 WeakPolarHBondContact O-CG 3.14Å; P165-L169 PolarHBondContact O-N 2.97Å
166	S	79.3	Confident	79.8	Confident	55 Å²	55	58.2 Å²	58.2	39%	0.385	33%	0.327	S	S	.	.	H	α-helix	trans	-69.2	-39.7	179.8	60.7	0	0	0	0	112	Q163 R164 L169 S170	Q163-S166 PolarHBondContact O-N 3.29Å; Q163-S166 PolarHBondContact O-OG 3.49Å; R164-S166 PolarHBondContact O-N 2.93Å; S166-L169 PolarHBondContact O-N 2.96Å; S166-S170 WeakPolarHBondContact O-CB 3.28Å; S166-S170 PolarHBondContact O-N 3.43Å
167	L	84.2	Confident	77.5	Confident	66 Å²	66	65 Å²	65	35%	0.346	36%	0.357	S	S	.	.	H	α-helix	trans	-65.5	-39.2	173.6	-70.4	172.2	0	0	0	112.3	I156 A159 Q163 R164 S170 A171	I156-L167 HydrophobicContact CG1-CB 3.89Å; A159-L167 HydrophobicContact CB-CD1 3.27Å; Q163-L167 HydrophobicContact CB-CD1 4.36Å; Q163-L167 WeakPolarHBondContact O-CG 3.49Å; Q163-L167 PolarHBondContact O-N 3.46Å; R164-L167 PolarHBondContact O-N 3.24Å; L167-S170 PolarHBondContact O-N 2.83Å; L167-A171 VanDerWaalsContact O-CB 3.3Å; L167-A171 WeakPolarHBondContact O-CB 3.42Å; L167-A171 PolarHBondContact O-N 3.36Å
168	L	86.6	Confident	75.1	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-61	-50.4	174.6	176.2	63.6	0	0	0	111.3	L132 V134 L138 L139 L142 I156 R164 P165 S170 A171 V172 L200	L132-L168 HydrophobicContact CD2-CD2 4.02Å; V134-L168 HydrophobicContact CG1-CD2 4.32Å; V134-L168 HydrophobicContact CG2-CD2 3.99Å; L138-L168 HydrophobicContact CD2-CD2 3.79Å; L139-L168 HydrophobicContact CD2-CD1 3.7Å; L142-L168 HydrophobicContact CD1-CD1 3.55Å; I156-L168 HydrophobicContact CD1-CB 4.4Å; I156-L168 HydrophobicContact CD1-CD1 4.23Å; R164-L168 VanDerWaalsContact O-CB 3.27Å; R164-L168 WeakPolarHBondContact O-CB 3.24Å; R164-L168 PolarHBondContact O-N 3.44Å; P165-L168 PolarHBondContact O-N 3.24Å; L168-S170 VanDerWaalsContact C-N 3.3Å; L168-S170 PolarHBondContact O-N 2.92Å; L168-A171 PolarHBondContact O-N 2.83Å; L168-V172 HydrophobicContact CD1-CG2 4.07Å; L168-V172 WeakPolarHBondContact O-CB 3.24Å; L168-V172 VanDerWaalsContact O-CG2 3.24Å; L168-V172 WeakPolarHBondContact O-CG2 3.4Å; L168-V172 PolarHBondContact O-N 2.93Å; L168-L200 HydrophobicContact CD2-CD1 4.14Å
169	L	82.9	Confident	72.9	Confident	10 Å²	10	64.2 Å²	64.2	5%	0.052	37%	0.368	C	S	.	.	H	α-helix	trans	-60.2	-42.2	179	-70.2	174.6	0	0	0	111.6	F129 P165 S166 V172 G173 L174 V176 I181 L200	F129-L169 HydrophobicContact CB-CD1 4.26Å; F129-L169 HydrophobicContact CD1-CD1 4.09Å; F129-L169 HydrophobicContact CD1-CD2 4.15Å; F129-L169 HydrophobicContact CD1-CG 4.36Å; F129-L169 HydrophobicContact CD2-CD1 3.96Å; F129-L169 HydrophobicContact CE1-CD1 4.38Å; F129-L169 HydrophobicContact CE1-CD2 3.69Å; F129-L169 HydrophobicContact CE1-CG 4.39Å; F129-L169 HydrophobicContact CE2-CD1 4.26Å; F129-L169 HydrophobicContact CE2-CD2 4.31Å; F129-L169 HydrophobicContact CG-CD1 3.84Å; F129-L169 HydrophobicContact CZ-CD1 4.42Å; F129-L169 HydrophobicContact CZ-CD2 3.74Å; P165-L169 VanDerWaalsContact O-CG 3.26Å; P165-L169 WeakPolarHBondContact O-CG 3.14Å; P165-L169 PolarHBondContact O-N 2.97Å; S166-L169 PolarHBondContact O-N 2.96Å; L169-V172 PolarHBondContact O-N 3.42Å; L169-G173 PolarHBondContact O-N 3.35Å; L169-L174 HydrophobicContact CB-CB 4.42Å; L169-L174 HydrophobicContact CD2-CB 4.39Å; L169-L174 HydrophobicContact CD2-CD1 3.54Å; L169-L174 WeakPolarHBondContact O-CB 3.4Å; L169-L174 PolarHBondContact O-N 3.34Å; L169-V176 HydrophobicContact CB-CG2 3.64Å; L169-V176 HydrophobicContact CD1-CG2 4.28Å; L169-I181 HydrophobicContact CD2-CD1 4.06Å; L169-L200 HydrophobicContact CD2-CD2 3.84Å
170	S	81	Confident	70.8	Confident	81 Å²	81	67.1 Å²	67.1	57%	0.566	38%	0.381	S	S	*	.	H	α-helix	trans	-61.6	-46.7	174.6	-174.2	0	0	0	0	112	S166 L167 L168 V172 G173	S166-S170 WeakPolarHBondContact O-CB 3.28Å; S166-S170 PolarHBondContact O-N 3.43Å; L167-S170 PolarHBondContact O-N 2.83Å; L168-S170 VanDerWaalsContact C-N 3.3Å; L168-S170 PolarHBondContact O-N 2.92Å; S170-V172 VanDerWaalsContact C-N 3.3Å; S170-V172 PolarHBondContact O-N 3.2Å; S170-G173 PolarHBondContact O-N 3.35Å
171	A	83.6	Confident	69.1	Low	36 Å²	36	63.8 Å²	63.8	30%	0.298	36%	0.362	S	S	.	.	H	α-helix	trans	-64.1	-33.9	-180	0	0	0	0	0	113.1	I148 I156 L167 L168 G173	I148-A171 HydrophobicContact CG2-CB 3.79Å; I156-A171 HydrophobicContact CD1-CB 4.04Å; L167-A171 VanDerWaalsContact O-CB 3.3Å; L167-A171 WeakPolarHBondContact O-CB 3.42Å; L167-A171 PolarHBondContact O-N 3.36Å; L168-A171 PolarHBondContact O-N 2.83Å; A171-G173 PolarHBondContact O-N 3.03Å
172	V	82	Confident	67.1	Low	9 Å²	9	64 Å²	64	6%	0.055	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-8	177.2	173.8	0	0	0	0	111.9	L142 I148 L168 L169 S170 L174 G196 L200	L142-V172 HydrophobicContact CD1-CG2 4.22Å; I148-V172 HydrophobicContact CG2-CG2 3.72Å; L168-V172 HydrophobicContact CD1-CG2 4.07Å; L168-V172 WeakPolarHBondContact O-CB 3.24Å; L168-V172 VanDerWaalsContact O-CG2 3.24Å; L168-V172 WeakPolarHBondContact O-CG2 3.4Å; L168-V172 PolarHBondContact O-N 2.93Å; L169-V172 PolarHBondContact O-N 3.42Å; S170-V172 VanDerWaalsContact C-N 3.3Å; S170-V172 PolarHBondContact O-N 3.2Å; V172-L174 HydrophobicContact CG1-CD1 4.22Å; V172-L174 HydrophobicContact CG1-CG 4.3Å; V172-G196 WeakPolarHBondContact CG1-O 3.42Å; V172-G196 WeakPolarHBondContact O-CA 3.4Å; V172-L200 HydrophobicContact CG1-CB 4.28Å
173	G	72.3	Confident	65.3	Low	48 Å²	48	59.2 Å²	59.2	50%	0.495	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.4	24.2	179.1	0	0	0	0	0	113.9	L169 S170 A171	L169-G173 PolarHBondContact O-N 3.35Å; S170-G173 PolarHBondContact O-N 3.35Å; A171-G173 PolarHBondContact O-N 3.03Å
174	L	69.2	Low	63.1	Low	9 Å²	9	63.4 Å²	63.4	5%	0.047	37%	0.365	C	S	.	.			trans	-87.4	126.2	173.5	-70.9	170.4	0	0	0	109.7	L169 V172 V176 I181 P194 L197 L200	L169-L174 HydrophobicContact CB-CB 4.42Å; L169-L174 HydrophobicContact CD2-CB 4.39Å; L169-L174 HydrophobicContact CD2-CD1 3.54Å; L169-L174 WeakPolarHBondContact O-CB 3.4Å; L169-L174 PolarHBondContact O-N 3.34Å; V172-L174 HydrophobicContact CG1-CD1 4.22Å; V172-L174 HydrophobicContact CG1-CG 4.3Å; L174-V176 PolarHBondContact O-N 2.87Å; L174-V176 VanDerWaalsContact O-N 3.08Å; L174-I181 HydrophobicContact CD1-CD1 4.33Å; L174-P194 HydrophobicContact CD2-CB 4.15Å; L174-P194 HydrophobicContact CD2-CG 3.99Å; L174-L197 HydrophobicContact CD1-CD1 3.95Å; L174-L197 HydrophobicContact CD2-CB 3.94Å; L174-L197 HydrophobicContact CD2-CD1 4.04Å; L174-L197 HydrophobicContact CD2-CG 4.43Å; L174-L200 HydrophobicContact CD1-CD2 3.72Å
175	P	54.6	Low	60.5	Low	74 Å²	74	64.4 Å²	64.4	48%	0.481	38%	0.38	S	S	.	.			trans	-68	110.7	178.2	26.5	-32	0	0	0	109.8	F177	P175-F177 HydrophobicContact CB-CD2 4.1Å; P175-F177 HydrophobicContact CB-CE2 3.98Å; P175-F177 PolarHBondContact O-N 3.15Å
176	V	52.3	Low	57.8	Low	66 Å²	66	67.1 Å²	67.1	40%	0.4	40%	0.399	S	S	.	.			trans	-87.7	104.1	174.7	-173.4	0	0	0	0	108.2	L169 L174	L169-V176 HydrophobicContact CB-CG2 3.64Å; L169-V176 HydrophobicContact CD1-CG2 4.28Å; L174-V176 PolarHBondContact O-N 2.87Å; L174-V176 VanDerWaalsContact O-N 3.08Å
177	F	42.3	Very low	55.8	Low	147 Å²	147	71.2 Å²	71.2	65%	0.645	42%	0.424	S	S	*	.	B	Isolated β-bridge	trans	-114.8	109.5	169.4	-76.6	-82.1	0	0	0	108.9	P175 G179 I180	P175-F177 HydrophobicContact CB-CD2 4.1Å; P175-F177 HydrophobicContact CB-CE2 3.98Å; P175-F177 PolarHBondContact O-N 3.15Å; F177-G179 VanDerWaalsContact C-N 3.28Å; F177-G179 PolarHBondContact O-N 3.29Å; F177-G179 VanDerWaalsContact O-N 3.11Å; F177-I180 PolarHBondContact O-N 3.16Å
178	N	38.3	Very low	53.3	Low	156 Å²	156	73.7 Å²	73.7	83%	0.834	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.4	42.9	176.5	-74.1	1.9	0	0	0	115.1	I180	N178-I180 PolarHBondContact O-N 2.89Å
179	G	41.8	Very low	50.6	Low	40 Å²	40	76.7 Å²	76.7	41%	0.412	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.8	0.3	179.8	0	0	0	0	0	115.4	F177	F177-G179 VanDerWaalsContact C-N 3.28Å; F177-G179 PolarHBondContact O-N 3.29Å; F177-G179 VanDerWaalsContact O-N 3.11Å
180	I	41.5	Very low	48.1	Very low	77 Å²	77	81.4 Å²	81.4	40%	0.395	50%	0.496	S	S	.	.	B	Isolated β-bridge	trans	-101.2	108.8	-179.4	-56.1	172.3	0	0	0	108.8	F177 N178 N182	F177-I180 PolarHBondContact O-N 3.16Å; N178-I180 PolarHBondContact O-N 2.89Å; I180-N182 PolarHBondContact O-N 3.39Å; I180-N182 VanDerWaalsContact O-N 3.12Å
181	I	49.9	Very low	46	Very low	39 Å²	39	86.3 Å²	86.3	20%	0.2	50%	0.504	C	S	.	.			trans	-71.2	104.4	158.4	-58.3	-163.9	0	0	0	106.3	F129 L169 L174 S183 L216	F129-I181 HydrophobicContact CD2-CD1 4.18Å; F129-I181 HydrophobicContact CE2-CD1 3.17Å; F129-I181 HydrophobicContact CE2-CG1 3.86Å; F129-I181 HydrophobicContact CZ-CD1 3.48Å; F129-I181 VanDerWaalsContact CZ-CD1 3.48Å; L169-I181 HydrophobicContact CD2-CD1 4.06Å; L174-I181 HydrophobicContact CD1-CD1 4.33Å; I181-S183 PolarHBondContact O-N 3.3Å; I181-L216 HydrophobicContact CD1-CD2 4.25Å
182	N	38.2	Very low	44.1	Very low	130 Å²	130	89.6 Å²	89.6	70%	0.695	52%	0.522	S	S	*	.			trans	-64	82.3	172.2	-99.3	-9	0	0	0	109.7	I180	I180-N182 PolarHBondContact O-N 3.39Å; I180-N182 VanDerWaalsContact O-N 3.12Å
183	S	40.5	Very low	42.8	Very low	46 Å²	46	91.3 Å²	91.3	32%	0.322	53%	0.533	S	S	.	.			trans	-97.6	-1.8	169.6	62.3	0	0	0	0	111.8	I181 S185 S219	I181-S183 PolarHBondContact O-N 3.3Å; S183-S185 PolarHBondContact O-N 3.04Å; S183-S219 VanDerWaalsContact CB-OG 3.24Å; S183-S219 WeakPolarHBondContact CB-OG 3.07Å; S183-S219 VanDerWaalsContact OG-CB 3.29Å; S183-S219 WeakPolarHBondContact OG-CB 3.39Å; S183-S219 PolarHBondContact OG-OG 3.03Å
184	K	33.9	Very low	42.3	Very low	185 Å²	185	91.2 Å²	91.2	80%	0.804	52%	0.524	S	S	*	.			trans	-74.2	63.2	165.4	-68.6	-176.1	179.9	177.5	0	110.1	S186	K184-S186 PolarHBondContact O-N 3.19Å
185	S	32	Very low	42.1	Very low	70 Å²	70	96 Å²	96	49%	0.49	56%	0.556	S	S	.	*			trans	-66	114.8	145.9	47.2	0	0	0	0	106	S183	S183-S185 PolarHBondContact O-N 3.04Å
186	S	28.2	Very low	43	Very low	66 Å²	66	92.9 Å²	92.9	46%	0.462	54%	0.536	S	S	.	.			trans	-39.1	153.6	154.3	51.4	0	0	0	0	109.8	K184 T188 C189	K184-S186 PolarHBondContact O-N 3.19Å; S186-T188 PolarHBondContact O-N 2.71Å; S186-T188 PolarHBondContact OG-OG1 3.43Å; S186-C189 PolarHBondContact O-N 2.89Å
187	P	36.1	Very low	44.2	Very low	141 Å²	141	90.4 Å²	90.4	92%	0.916	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	15.5	-175.6	23.9	-33.3	0	0	0	115.4
188	T	32.7	Very low	45.9	Very low	118 Å²	118	85.7 Å²	85.7	72%	0.724	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.6	1.9	-175.5	51.5	0	0	0	0	114.3	S186 S190	S186-T188 PolarHBondContact O-N 2.71Å; S186-T188 PolarHBondContact OG-OG1 3.43Å; T188-S190 PolarHBondContact O-N 2.97Å
189	C	28.6	Very low	48.1	Very low	62 Å²	62	80.4 Å²	80.4	42%	0.419	48%	0.481	S	S	.	.			trans	-87.7	108.2	-178	-141.4	0	0	0	0	112.1	S186 Y191	S186-C189 PolarHBondContact O-N 2.89Å; C189-Y191 VanDerWaalsContact C-N 3.28Å; C189-Y191 PolarHBondContact O-N 3.31Å
190	S	31.1	Very low	50.2	Low	109 Å²	109	78.5 Å²	78.5	76%	0.762	46%	0.461	S	S	*	.			trans	-78.6	20	-170.5	47.4	0	0	0	0	116.1	T188	T188-S190 PolarHBondContact O-N 2.97Å
191	Y	37.3	Very low	52.2	Low	185 Å²	185	75.4 Å²	75.4	73%	0.725	45%	0.445	S	S	*	.	P	Polyproline II helix	trans	-89.3	127.5	-178.1	-67.2	-77.6	0	0	0	111.8	C189	C189-Y191 VanDerWaalsContact C-N 3.28Å; C189-Y191 PolarHBondContact O-N 3.31Å
192	P	43.1	Very low	53.9	Low	105 Å²	105	77.1 Å²	77.1	68%	0.682	46%	0.455	S	S	*	.	P	Polyproline II helix	trans	-60.2	144.2	172.7	24.7	-31.3	0	0	0	109.9
193	P	54.5	Low	56.2	Low	45 Å²	45	71 Å²	71	29%	0.292	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-50.3	145.6	170.9	15.6	-24	0	0	0	109.9	P195 R220	P193-P195 VanDerWaalsContact O-N 3.17Å; P193-R220 VanDerWaalsContact CD-NH2 3.31Å; P193-R220 VanDerWaalsContact CG-CZ 3.45Å
194	P	62.3	Low	58.4	Low	46 Å²	46	68.8 Å²	68.8	30%	0.299	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-52.3	126.3	159.7	-21.8	34.2	0	0	0	107.6	L174 G196 L197	L174-P194 HydrophobicContact CD2-CB 4.15Å; L174-P194 HydrophobicContact CD2-CG 3.99Å; P194-G196 PolarHBondContact O-N 2.91Å; P194-L197 WeakPolarHBondContact O-CB 3.38Å; P194-L197 PolarHBondContact O-N 2.82Å
195	P	65.8	Low	60.9	Low	110 Å²	110	61.9 Å²	61.9	71%	0.714	38%	0.375	S	S	*	.	H	α-helix	trans	-54.8	-27.1	-176.8	17.2	-29.5	0	0	0	112.4	P193 L197 A198	P193-P195 VanDerWaalsContact O-N 3.17Å; P195-L197 VanDerWaalsContact C-N 3.33Å; P195-L197 PolarHBondContact O-N 3.15Å; P195-A198 PolarHBondContact O-N 3Å
196	G	73.4	Confident	63.5	Low	7 Å²	7	64.3 Å²	64.3	7%	0.072	38%	0.379	C	S	.	.	H	α-helix	trans	-62.6	-29.5	173.6	0	0	0	0	0	115.3	V172 P194 A198 L199 L200	V172-G196 WeakPolarHBondContact CG1-O 3.42Å; V172-G196 WeakPolarHBondContact O-CA 3.4Å; P194-G196 PolarHBondContact O-N 2.91Å; G196-A198 PolarHBondContact O-N 3.01Å; G196-L199 PolarHBondContact O-N 3.18Å; G196-L200 WeakPolarHBondContact O-CB 3.42Å; G196-L200 PolarHBondContact O-N 3.42Å
197	L	76.9	Confident	66.1	Low	15 Å²	15	63.2 Å²	63.2	8%	0.079	37%	0.37	C	S	.	.	H	α-helix	trans	-62.7	-44.9	179.2	-173.3	58.6	0	0	0	111.7	L174 P194 P195 L199 L200 L201	L174-L197 HydrophobicContact CD1-CD1 3.95Å; L174-L197 HydrophobicContact CD2-CB 3.94Å; L174-L197 HydrophobicContact CD2-CD1 4.04Å; L174-L197 HydrophobicContact CD2-CG 4.43Å; P194-L197 WeakPolarHBondContact O-CB 3.38Å; P194-L197 PolarHBondContact O-N 2.82Å; P195-L197 VanDerWaalsContact C-N 3.33Å; P195-L197 PolarHBondContact O-N 3.15Å; L197-L199 VanDerWaalsContact C-N 3.32Å; L197-L199 PolarHBondContact O-N 3.28Å; L197-L200 PolarHBondContact O-N 3.31Å; L197-L201 HydrophobicContact CG-CD1 4.32Å; L197-L201 WeakPolarHBondContact O-CG 3.39Å; L197-L201 PolarHBondContact O-N 2.89Å
198	A	77.3	Confident	68.2	Low	48 Å²	48	58.6 Å²	58.6	40%	0.397	35%	0.348	S	S	.	.	H	α-helix	trans	-64.4	-40.8	-179.2	0	0	0	0	0	111	P195 G196 L201 N202	P195-A198 PolarHBondContact O-N 3Å; G196-A198 PolarHBondContact O-N 3.01Å; A198-L201 PolarHBondContact O-N 2.91Å; A198-N202 WeakPolarHBondContact O-CB 3.16Å; A198-N202 VanDerWaalsContact O-CG 3.27Å; A198-N202 PolarHBondContact O-N 2.91Å; A198-N202 PolarHBondContact O-ND2 2.86Å
199	L	84.7	Confident	70.4	Confident	45 Å²	45	55.9 Å²	55.9	24%	0.236	33%	0.326	C	S	.	.	H	α-helix	trans	-66.7	-38.7	176.1	-66.6	174.4	0	0	0	111.7	L142 H145 A147 G196 L197 N202 A203	L142-L199 HydrophobicContact CD2-CB 4.2Å; H145-L199 HydrophobicContact CB-CD2 4.11Å; A147-L199 HydrophobicContact CB-CB 3.93Å; A147-L199 HydrophobicContact CB-CD1 3.6Å; A147-L199 HydrophobicContact CB-CG 4.38Å; G196-L199 PolarHBondContact O-N 3.18Å; L197-L199 VanDerWaalsContact C-N 3.32Å; L197-L199 PolarHBondContact O-N 3.28Å; L199-N202 PolarHBondContact O-N 3.19Å; L199-A203 VanDerWaalsContact O-CB 3.31Å; L199-A203 WeakPolarHBondContact O-CB 3.26Å; L199-A203 PolarHBondContact O-N 3.03Å
200	L	86	Confident	72.9	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-64	-45.7	173.6	-179.4	63	0	0	0	112	F129 L142 L168 L169 V172 L174 G196 L197 N202 A203 L204	F129-L200 HydrophobicContact CE1-CD2 4.28Å; L142-L200 HydrophobicContact CD1-CD1 4.35Å; L168-L200 HydrophobicContact CD2-CD1 4.14Å; L169-L200 HydrophobicContact CD2-CD2 3.84Å; V172-L200 HydrophobicContact CG1-CB 4.28Å; L174-L200 HydrophobicContact CD1-CD2 3.72Å; G196-L200 WeakPolarHBondContact O-CB 3.42Å; G196-L200 PolarHBondContact O-N 3.42Å; L197-L200 PolarHBondContact O-N 3.31Å; L200-N202 VanDerWaalsContact C-N 3.3Å; L200-N202 PolarHBondContact O-N 2.88Å; L200-A203 WeakPolarHBondContact O-CB 3.17Å; L200-A203 PolarHBondContact O-N 3.43Å; L200-A203 VanDerWaalsContact O-N 3.16Å; L200-L204 HydrophobicContact CD1-CD1 4.44Å; L200-L204 HydrophobicContact CD1-CG 4.23Å; L200-L204 HydrophobicContact CG-CD1 4.15Å; L200-L204 HydrophobicContact CG-CG 4.38Å; L200-L204 WeakPolarHBondContact O-CB 3.41Å; L200-L204 VanDerWaalsContact O-CG 3.28Å; L200-L204 WeakPolarHBondContact O-CG 3.49Å; L200-L204 PolarHBondContact O-N 3.01Å
201	L	84.7	Confident	74.9	Confident	12 Å²	12	55.1 Å²	55.1	6%	0.063	30%	0.304	C	S	.	.	H	α-helix	trans	-58.1	-44.1	175.9	-74	173.9	0	0	0	111.4	L197 A198 L204 R205 A213 L216 D217	L197-L201 HydrophobicContact CG-CD1 4.32Å; L197-L201 WeakPolarHBondContact O-CG 3.39Å; L197-L201 PolarHBondContact O-N 2.89Å; A198-L201 PolarHBondContact O-N 2.91Å; L201-L204 PolarHBondContact O-N 3.46Å; L201-R205 VanDerWaalsContact O-CG 3.27Å; L201-R205 WeakPolarHBondContact O-CG 3.34Å; L201-R205 PolarHBondContact O-N 2.84Å; L201-A213 HydrophobicContact CD2-CB 4.48Å; L201-A213 VanDerWaalsContact CD2-O 3.32Å; L201-A213 WeakPolarHBondContact CD2-O 3.18Å; L201-L216 HydrophobicContact CD2-CB 3.63Å; L201-D217 HydrophobicContact CD1-CB 4.33Å; L201-D217 HydrophobicContact CD2-CB 4.09Å
202	N	85.2	Confident	76.7	Confident	75 Å²	75	47.3 Å²	47.3	40%	0.401	28%	0.275	S	S	.	.	H	α-helix	trans	-64.9	-41.2	176	-71	-17.9	0	0	0	111.9	Y141 A198 L199 L200 R205 H206	Y141-N202 HydrophobicContact CE1-CB 4.11Å; A198-N202 WeakPolarHBondContact O-CB 3.16Å; A198-N202 VanDerWaalsContact O-CG 3.27Å; A198-N202 PolarHBondContact O-N 2.91Å; A198-N202 PolarHBondContact O-ND2 2.86Å; L199-N202 PolarHBondContact O-N 3.19Å; L200-N202 VanDerWaalsContact C-N 3.3Å; L200-N202 PolarHBondContact O-N 2.88Å; N202-R205 PolarHBondContact O-N 2.93Å; N202-H206 VanDerWaalsContact O-CB 3.3Å; N202-H206 WeakPolarHBondContact O-CB 3.42Å; N202-H206 PolarHBondContact O-N 3.28Å
203	A	86.2	Confident	78.5	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-62.4	-45.9	176.9	0	0	0	0	0	111.2	L138 Y141 L142 L199 L200 R205 H206 T207	L138-A203 HydrophobicContact CD1-CB 3.53Å; Y141-A203 HydrophobicContact CD1-CB 3.41Å; Y141-A203 VanDerWaalsContact CD1-CB 3.41Å; Y141-A203 HydrophobicContact CE1-CB 3.97Å; Y141-A203 HydrophobicContact CG-CB 4.02Å; L142-A203 HydrophobicContact CD2-CB 3.85Å; L142-A203 HydrophobicContact CG-CB 3.94Å; L199-A203 VanDerWaalsContact O-CB 3.31Å; L199-A203 WeakPolarHBondContact O-CB 3.26Å; L199-A203 PolarHBondContact O-N 3.03Å; L200-A203 WeakPolarHBondContact O-CB 3.17Å; L200-A203 PolarHBondContact O-N 3.43Å; L200-A203 VanDerWaalsContact O-N 3.16Å; A203-R205 PolarHBondContact O-N 3.38Å; A203-H206 PolarHBondContact O-N 2.99Å; A203-H206 VanDerWaalsContact O-N 3.14Å; A203-T207 WeakPolarHBondContact O-CG2 3.4Å; A203-T207 PolarHBondContact O-N 3.16Å; A203-T207 PolarHBondContact O-OG1 3.4Å
204	L	87.2	Confident	79.3	Confident	0 Å²	0	42 Å²	42	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-61.9	-42.1	177	-69.7	173.5	0	0	0	112	L132 L138 L200 L201 H206 T207 G208 H209 L212 A213 L216	L132-L204 HydrophobicContact CD1-CD2 3.85Å; L132-L204 HydrophobicContact CD2-CD2 4.39Å; L138-L204 HydrophobicContact CD1-CD2 4.07Å; L138-L204 HydrophobicContact CD1-CG 4.47Å; L138-L204 HydrophobicContact CD2-CD2 4.38Å; L200-L204 HydrophobicContact CD1-CD1 4.44Å; L200-L204 HydrophobicContact CD1-CG 4.23Å; L200-L204 HydrophobicContact CG-CD1 4.15Å; L200-L204 HydrophobicContact CG-CG 4.38Å; L200-L204 WeakPolarHBondContact O-CB 3.41Å; L200-L204 VanDerWaalsContact O-CG 3.28Å; L200-L204 WeakPolarHBondContact O-CG 3.49Å; L200-L204 PolarHBondContact O-N 3.01Å; L201-L204 PolarHBondContact O-N 3.46Å; L204-H206 VanDerWaalsContact C-N 3.32Å; L204-H206 PolarHBondContact O-N 3.48Å; L204-T207 PolarHBondContact O-N 2.89Å; L204-T207 PolarHBondContact O-OG1 3.44Å; L204-G208 PolarHBondContact O-N 2.88Å; L204-G208 VanDerWaalsContact O-N 3.15Å; L204-H209 HydrophobicContact CB-CB 4.16Å; L204-H209 HydrophobicContact CD2-CB 3.8Å; L204-H209 PolarHBondContact O-N 2.95Å; L204-L212 HydrophobicContact CD1-CD2 3.98Å; L204-L212 HydrophobicContact CD1-CG 4.09Å; L204-L212 HydrophobicContact CD2-CD2 3.94Å; L204-A213 HydrophobicContact CB-CB 3.79Å; L204-A213 HydrophobicContact CD1-CB 4.47Å; L204-L216 HydrophobicContact CD1-CD1 3.65Å
205	R	86.5	Confident	79.6	Confident	40 Å²	40	43.7 Å²	43.7	15%	0.151	25%	0.246	C	C	.	.	H	α-helix	trans	-63.4	-38.9	173.6	-71.7	168.5	177.8	-115	12.9	111.6	L201 N202 A203 H210 A213 D217 E455	L201-R205 VanDerWaalsContact O-CG 3.27Å; L201-R205 WeakPolarHBondContact O-CG 3.34Å; L201-R205 PolarHBondContact O-N 2.84Å; N202-R205 PolarHBondContact O-N 2.93Å; A203-R205 PolarHBondContact O-N 3.38Å; R205-H210 PolarHBondContact O-CE1 3.44Å; R205-A213 HydrophobicContact CG-CB 3.79Å; R205-D217 IonicContact CZ-OD2 2.93Å; R205-D217 IonicContact NH2-OD2 3.52Å; R205-D217 PolarHBondContact NH2-OD2 3.29Å; R205-E455 IonicContact NH1-OE1 3.41Å; R205-E455 PolarHBondContact NH1-OE1 3.38Å; R205-E455 IonicContact NH1-OE2 2.72Å; R205-E455 PolarHBondContact NH1-OE2 2.96Å; R205-E455 VanDerWaalsContact NH1-OE2 3.12Å
206	H	84.7	Confident	79.8	Confident	122 Å²	122	39.3 Å²	39.3	57%	0.565	22%	0.216	S	C	*	.	H	α-helix	trans	-71.3	-33.2	-179.9	-171	-80.9	0	0	0	112.5	Y141 N202 A203 L204	Y141-H206 HydrophobicContact CD2-CB 3.91Å; Y141-H206 AromaticContact CD2-CG 3.65Å; Y141-H206 AromaticContact CD2-ND1 3.85Å; Y141-H206 HydrophobicContact CE2-CB 3.81Å; Y141-H206 AromaticContact CE2-CD2 3.75Å; Y141-H206 AromaticContact CE2-CG 3.68Å; N202-H206 VanDerWaalsContact O-CB 3.3Å; N202-H206 WeakPolarHBondContact O-CB 3.42Å; N202-H206 PolarHBondContact O-N 3.28Å; A203-H206 PolarHBondContact O-N 2.99Å; A203-H206 VanDerWaalsContact O-N 3.14Å; L204-H206 VanDerWaalsContact C-N 3.32Å; L204-H206 PolarHBondContact O-N 3.48Å
207	T	83.3	Confident	79.6	Confident	43 Å²	43	40.2 Å²	40.2	26%	0.264	22%	0.219	S	C	.	.	H	α-helix	trans	-91.2	-1.1	180	57.5	0	0	0	0	114.7	P137 L138 A203 L204 H209	P137-T207 HydrophobicContact CB-CG2 4.15Å; L138-T207 HydrophobicContact CB-CG2 3.98Å; L138-T207 HydrophobicContact CD1-CG2 4.05Å; A203-T207 WeakPolarHBondContact O-CG2 3.4Å; A203-T207 PolarHBondContact O-N 3.16Å; A203-T207 PolarHBondContact O-OG1 3.4Å; L204-T207 PolarHBondContact O-N 2.89Å; L204-T207 PolarHBondContact O-OG1 3.44Å; T207-H209 PolarHBondContact OG1-CD2 2.83Å; T207-H209 VanDerWaalsContact OG1-CD2 3.31Å
208	G	80.4	Confident	78.3	Confident	44 Å²	44	42.7 Å²	42.7	45%	0.454	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	93.3	5.9	175.1	0	0	0	0	0	115.2	L204 H210	L204-G208 PolarHBondContact O-N 2.88Å; L204-G208 VanDerWaalsContact O-N 3.15Å; G208-H210 PolarHBondContact O-N 3.08Å
209	H	79.7	Confident	76.9	Confident	61 Å²	61	43 Å²	43	28%	0.282	24%	0.236	S	C	.	.			trans	-82.2	56.6	172.8	-62.1	-65.1	0	0	0	111.2	L204 T207 E211 L212 A213	L204-H209 HydrophobicContact CB-CB 4.16Å; L204-H209 HydrophobicContact CD2-CB 3.8Å; L204-H209 PolarHBondContact O-N 2.95Å; T207-H209 PolarHBondContact OG1-CD2 2.83Å; T207-H209 VanDerWaalsContact OG1-CD2 3.31Å; H209-E211 PolarHBondContact O-N 3.46Å; H209-L212 HydrophobicContact CB-CB 4.4Å; H209-L212 PolarHBondContact O-N 3.43Å; H209-A213 VanDerWaalsContact O-CB 3.32Å; H209-A213 WeakPolarHBondContact O-CB 3.31Å; H209-A213 PolarHBondContact O-N 3.31Å
210	H	79.6	Confident	75.1	Confident	32 Å²	32	46.3 Å²	46.3	15%	0.148	25%	0.246	C	C	.	.	H	α-helix	trans	-65.5	-35.8	-175.3	-60.9	-67.7	0	0	0	113	R205 G208 S214	R205-H210 PolarHBondContact O-CE1 3.44Å; G208-H210 PolarHBondContact O-N 3.08Å; H210-S214 WeakPolarHBondContact O-CB 3.3Å; H210-S214 PolarHBondContact O-N 3.14Å
211	E	73.6	Confident	73.1	Confident	122 Å²	122	48.4 Å²	48.4	57%	0.57	25%	0.253	S	S	*	.	H	α-helix	trans	-64	-48.7	177.5	-64.3	-169.5	152.2	0	0	111.4	H209 S214 H215 G443	H209-E211 PolarHBondContact O-N 3.46Å; E211-S214 PolarHBondContact O-N 3.5Å; E211-H215 VanDerWaalsContact O-CB 3.29Å; E211-H215 WeakPolarHBondContact O-CB 3.13Å; E211-H215 PolarHBondContact O-N 3.04Å; E211-G443 WeakPolarHBondContact OE1-CA 3.47Å
212	L	76.1	Confident	71	Confident	22 Å²	22	50.3 Å²	50.3	12%	0.115	26%	0.263	C	S	.	.	H	α-helix	trans	-65.2	-44.7	177.3	-175.3	66.4	0	0	0	111	T128 F129 L132 L204 H209 S214 H215 L216	T128-L212 HydrophobicContact CG2-CD1 3.57Å; T128-L212 VanDerWaalsContact O-CD1 3.26Å; T128-L212 WeakPolarHBondContact O-CD1 3.34Å; F129-L212 HydrophobicContact CD1-CD2 4.26Å; F129-L212 HydrophobicContact CE1-CD2 4.23Å; L132-L212 HydrophobicContact CB-CD2 4.15Å; L132-L212 HydrophobicContact CD1-CD2 3.72Å; L132-L212 HydrophobicContact CD2-CD2 4.09Å; L132-L212 HydrophobicContact CG-CD2 4.19Å; L204-L212 HydrophobicContact CD1-CD2 3.98Å; L204-L212 HydrophobicContact CD1-CG 4.09Å; L204-L212 HydrophobicContact CD2-CD2 3.94Å; H209-L212 HydrophobicContact CB-CB 4.4Å; H209-L212 PolarHBondContact O-N 3.43Å; L212-S214 VanDerWaalsContact C-N 3.33Å; L212-S214 PolarHBondContact O-N 3.21Å; L212-H215 PolarHBondContact O-N 3.41Å; L212-L216 HydrophobicContact CD1-CD1 4.21Å; L212-L216 HydrophobicContact CD1-CG 4.33Å; L212-L216 HydrophobicContact CD2-CD1 4.49Å; L212-L216 HydrophobicContact CG-CD1 3.89Å; L212-L216 HydrophobicContact CG-CG 4.41Å; L212-L216 WeakPolarHBondContact O-CB 3.27Å; L212-L216 VanDerWaalsContact O-CG 3.24Å; L212-L216 WeakPolarHBondContact O-CG 3.28Å; L212-L216 PolarHBondContact O-N 3Å
213	A	79.6	Confident	68.8	Low	1 Å²	1	52.6 Å²	52.6	1%	0.008	28%	0.276	C	S	.	.	H	α-helix	trans	-58	-47.9	174.9	0	0	0	0	0	110.8	L201 L204 R205 H209 H215 L216 D217	L201-A213 HydrophobicContact CD2-CB 4.48Å; L201-A213 VanDerWaalsContact CD2-O 3.32Å; L201-A213 WeakPolarHBondContact CD2-O 3.18Å; L204-A213 HydrophobicContact CB-CB 3.79Å; L204-A213 HydrophobicContact CD1-CB 4.47Å; R205-A213 HydrophobicContact CG-CB 3.79Å; H209-A213 VanDerWaalsContact O-CB 3.32Å; H209-A213 WeakPolarHBondContact O-CB 3.31Å; H209-A213 PolarHBondContact O-N 3.31Å; A213-H215 VanDerWaalsContact C-N 3.31Å; A213-H215 PolarHBondContact O-N 2.9Å; A213-L216 PolarHBondContact O-N 3.44Å; A213-D217 WeakPolarHBondContact O-CB 3.48Å; A213-D217 PolarHBondContact O-N 3.47Å
214	S	71.8	Confident	66.5	Low	38 Å²	38	54.4 Å²	54.4	27%	0.266	29%	0.287	S	S	.	.	H	α-helix	trans	-61.1	-42	177.4	-175.2	0	0	0	0	110.9	H210 E211 L212 D217 C218 R221	H210-S214 WeakPolarHBondContact O-CB 3.3Å; H210-S214 PolarHBondContact O-N 3.14Å; E211-S214 PolarHBondContact O-N 3.5Å; L212-S214 VanDerWaalsContact C-N 3.33Å; L212-S214 PolarHBondContact O-N 3.21Å; S214-D217 CarbonylContact O-C 3.54Å; S214-D217 PolarHBondContact O-N 2.98Å; S214-C218 PolarHBondContact O-N 2.87Å; S214-C218 PolarHBondContact O-SG 2.88Å; S214-R221 PolarHBondContact OG-NH1 3.45Å
215	H	68.4	Low	64.3	Low	81 Å²	81	55.2 Å²	55.2	38%	0.375	29%	0.293	S	S	.	.	H	α-helix	trans	-65.8	-40.9	-179.5	-166.2	88.9	0	0	0	112.5	C124 T128 E211 L212 A213 C218	C124-H215 PolarHBondContact SG-NE2 3.45Å; T128-H215 VanDerWaalsContact CG2-CD2 3.46Å; T128-H215 WeakPolarHBondContact CG2-CD2 3.31Å; E211-H215 VanDerWaalsContact O-CB 3.29Å; E211-H215 WeakPolarHBondContact O-CB 3.13Å; E211-H215 PolarHBondContact O-N 3.04Å; L212-H215 PolarHBondContact O-N 3.41Å; A213-H215 VanDerWaalsContact C-N 3.31Å; A213-H215 PolarHBondContact O-N 2.9Å; H215-C218 VanDerWaalsContact O-CB 3.31Å; H215-C218 WeakPolarHBondContact O-CB 3.48Å; H215-C218 PolarHBondContact O-N 3.05Å
216	L	69.4	Low	62	Low	17 Å²	17	57.2 Å²	57.2	9%	0.089	31%	0.313	C	S	.	.	H	α-helix	trans	-74.4	-32.6	176	-65.6	169.3	0	0	0	112.4	F129 I181 L201 L204 L212 A213 C218	F129-L216 HydrophobicContact CE1-CD1 3.69Å; F129-L216 HydrophobicContact CE1-CD2 4.47Å; F129-L216 HydrophobicContact CE2-CD1 4.14Å; F129-L216 HydrophobicContact CE2-CD2 3.37Å; F129-L216 HydrophobicContact CE2-CG 4.31Å; F129-L216 HydrophobicContact CZ-CD1 3.25Å; F129-L216 HydrophobicContact CZ-CD2 3.34Å; F129-L216 HydrophobicContact CZ-CG 3.87Å; I181-L216 HydrophobicContact CD1-CD2 4.25Å; L201-L216 HydrophobicContact CD2-CB 3.63Å; L204-L216 HydrophobicContact CD1-CD1 3.65Å; L212-L216 HydrophobicContact CD1-CD1 4.21Å; L212-L216 HydrophobicContact CD1-CG 4.33Å; L212-L216 HydrophobicContact CD2-CD1 4.49Å; L212-L216 HydrophobicContact CG-CD1 3.89Å; L212-L216 HydrophobicContact CG-CG 4.41Å; L212-L216 WeakPolarHBondContact O-CB 3.27Å; L212-L216 VanDerWaalsContact O-CG 3.24Å; L212-L216 WeakPolarHBondContact O-CG 3.28Å; L212-L216 PolarHBondContact O-N 3Å; A213-L216 PolarHBondContact O-N 3.44Å; L216-C218 VanDerWaalsContact C-N 3.29Å
217	D	70.2	Confident	59.9	Low	27 Å²	27	53.8 Å²	53.8	14%	0.144	30%	0.3	C	S	.	.	H	α-helix	trans	-72.8	-23.8	172.8	-158.6	22.8	0	0	0	110.2	L201 R205 A213 S214 S219 R220 R221	L201-D217 HydrophobicContact CD1-CB 4.33Å; L201-D217 HydrophobicContact CD2-CB 4.09Å; R205-D217 IonicContact CZ-OD2 2.93Å; R205-D217 IonicContact NH2-OD2 3.52Å; R205-D217 PolarHBondContact NH2-OD2 3.29Å; A213-D217 WeakPolarHBondContact O-CB 3.48Å; A213-D217 PolarHBondContact O-N 3.47Å; S214-D217 CarbonylContact O-C 3.54Å; S214-D217 PolarHBondContact O-N 2.98Å; D217-S219 PolarHBondContact O-N 3.44Å; D217-R220 CarbonylContact O-C 3.59Å; D217-R220 WeakPolarHBondContact O-CA 3.43Å; D217-R220 PolarHBondContact O-N 3.48Å; D217-R221 HydrophobicContact CB-CG 4.19Å; D217-R221 WeakPolarHBondContact O-CB 3.47Å; D217-R221 WeakPolarHBondContact O-CG 3.37Å; D217-R221 PolarHBondContact O-N 3.29Å; D217-R221 IonicContact OD2-NE 2.98Å; D217-R221 PolarHBondContact OD2-NE 3.15Å
218	C	50.2	Low	57.7	Low	67 Å²	67	58.6 Å²	58.6	45%	0.453	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-27.1	179.7	-79.3	0	0	0	0	113.7	S214 H215 L216 R220	S214-C218 PolarHBondContact O-N 2.87Å; S214-C218 PolarHBondContact O-SG 2.88Å; H215-C218 VanDerWaalsContact O-CB 3.31Å; H215-C218 WeakPolarHBondContact O-CB 3.48Å; H215-C218 PolarHBondContact O-N 3.05Å; L216-C218 VanDerWaalsContact C-N 3.29Å; C218-R220 VanDerWaalsContact C-N 3.26Å; C218-R220 PolarHBondContact O-N 3.07Å
219	S	47.8	Very low	55.4	Low	54 Å²	54	58.9 Å²	58.9	38%	0.378	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-13.8	176.1	-36.4	0	0	0	0	113.6	S183 D217	S183-S219 VanDerWaalsContact CB-OG 3.24Å; S183-S219 WeakPolarHBondContact CB-OG 3.07Å; S183-S219 VanDerWaalsContact OG-CB 3.29Å; S183-S219 WeakPolarHBondContact OG-CB 3.39Å; S183-S219 PolarHBondContact OG-OG 3.03Å; D217-S219 PolarHBondContact O-N 3.44Å
220	R	46.8	Very low	53	Low	115 Å²	115	59.1 Å²	59.1	43%	0.434	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.7	-20	-178.7	-78.4	176.4	175.9	-87.2	-15.8	113.8	P193 D217 C218 I222	P193-R220 VanDerWaalsContact CD-NH2 3.31Å; P193-R220 VanDerWaalsContact CG-CZ 3.45Å; D217-R220 CarbonylContact O-C 3.59Å; D217-R220 WeakPolarHBondContact O-CA 3.43Å; D217-R220 PolarHBondContact O-N 3.48Å; C218-R220 VanDerWaalsContact C-N 3.26Å; C218-R220 PolarHBondContact O-N 3.07Å; R220-I222 PolarHBondContact O-N 2.88Å
221	R	42.9	Very low	51	Low	43 Å²	43	61.6 Å²	61.6	16%	0.162	36%	0.36	C	S	.	.	S	Bend	trans	-60.7	96.6	161.5	-79.5	176.2	160.7	-139	-11.7	104.9	S214 D217 N223 V462 L463	S214-R221 PolarHBondContact OG-NH1 3.45Å; D217-R221 HydrophobicContact CB-CG 4.19Å; D217-R221 WeakPolarHBondContact O-CB 3.47Å; D217-R221 WeakPolarHBondContact O-CG 3.37Å; D217-R221 PolarHBondContact O-N 3.29Å; D217-R221 IonicContact OD2-NE 2.98Å; D217-R221 PolarHBondContact OD2-NE 3.15Å; R221-N223 PolarHBondContact O-N 3.01Å; R221-V462 PolarHBondContact NH2-O 2.9Å; R221-L463 PolarHBondContact NH1-O 3.24Å
222	I	41.6	Very low	49	Very low	52 Å²	52	61.8 Å²	61.8	27%	0.267	37%	0.369	S	S	.	.				20.5	77.2	105.9	-45.7	-168	0	0	0	112.8	R220 P224 R243 L463	R220-I222 PolarHBondContact O-N 2.88Å; I222-P224 WeakPolarHBondContact O-CD 3.31Å; I222-P224 VanDerWaalsContact O-N 3.12Å; I222-R243 HydrophobicContact CG2-CG 3.5Å; I222-R243 VanDerWaalsContact CG2-CG 3.5Å; I222-L463 HydrophobicContact CG2-CD1 4.21Å
223	N	38.2	Very low	46.8	Very low	124 Å²	124	66.3 Å²	66.3	66%	0.663	40%	0.402	S	S	*	.			trans	-56	124.4	166.5	-81.8	-35.2	0	0	0	106	R221 S225	R221-N223 PolarHBondContact O-N 3.01Å; N223-S225 PolarHBondContact O-N 2.85Å
224	P	39.1	Very low	44.3	Very low	38 Å²	38	69.7 Å²	69.7	25%	0.247	44%	0.438	C	S	.	.			trans	-52.7	134.3	166.9	23.3	-30.7	0	0	0	105.9	I222 S226 D464 I490	I222-P224 WeakPolarHBondContact O-CD 3.31Å; I222-P224 VanDerWaalsContact O-N 3.12Å; P224-S226 PolarHBondContact O-N 3.02Å; P224-D464 HydrophobicContact CG-CB 4.33Å; P224-I490 HydrophobicContact CB-CD1 4.11Å
225	S	40	Very low	42.2	Very low	17 Å²	17	73.7 Å²	73.7	12%	0.119	46%	0.464	C	S	.	.			trans	-40.5	124.4	167.9	57.9	0	0	0	0	108.1	N223 V227	N223-S225 PolarHBondContact O-N 2.85Å; S225-V227 WeakPolarHBondContact O-CG2 3.46Å; S225-V227 PolarHBondContact O-N 3.22Å
226	S	39	Very low	40.4	Very low	82 Å²	82	74.6 Å²	74.6	57%	0.573	48%	0.48	S	S	*	.			trans	-56.1	95.9	175	177.6	0	0	0	0	108.1	P224 N228	P224-S226 PolarHBondContact O-N 3.02Å; S226-N228 PolarHBondContact O-N 2.95Å
227	V	40.5	Very low	38.8	Very low	49 Å²	49	81.7 Å²	81.7	30%	0.297	52%	0.518	S	S	.	.			trans	-83.8	63.4	173	-165.8	0	0	0	0	105.6	S225	S225-V227 WeakPolarHBondContact O-CG2 3.46Å; S225-V227 PolarHBondContact O-N 3.22Å
228	N	36.6	Very low	37.4	Very low	144 Å²	144	84.2 Å²	84.2	77%	0.77	53%	0.531	S	S	*	.			trans	-80.7	7	167	-90.6	3.9	0	0	0	111.6	S226	S226-N228 PolarHBondContact O-N 2.95Å
229	G	32.1	Very low	37	Very low	50 Å²	50	85.2 Å²	85.2	52%	0.515	54%	0.539	S	S	.	.	S	Bend	trans	-96.7	108.9	166.6	0	0	0	0	0	109.4	M231	G229-M231 PolarHBondContact O-N 3.46Å
230	G	30.1	Very low	36.8	Very low	67 Å²	67	89.9 Å²	89.9	69%	0.691	56%	0.559	S	S	*	*			trans	-53.2	127.6	164.9	0	0	0	0	0	109.2	T232	G230-T232 PolarHBondContact O-N 3.49Å
231	M	36.4	Very low	37.4	Very low	84 Å²	84	91.1 Å²	91.1	41%	0.414	57%	0.568	S	S	.	*			trans	-66.4	82.7	173.6	-76.3	164.1	127.6	0	0	108.9	G229 L238 W250	G229-M231 PolarHBondContact O-N 3.46Å; M231-L238 HydrophobicContact CE-CD1 4Å; M231-W250 HydrophobicContact SD-CZ2 4.14Å
232	T	32.8	Very low	38.6	Very low	125 Å²	125	90.6 Å²	90.6	77%	0.767	57%	0.566	S	S	*	*			trans	-75.4	118.2	147.2	50.8	0	0	0	0	106	G230	G230-T232 PolarHBondContact O-N 3.49Å
233	S	30.2	Very low	40.1	Very low	117 Å²	117	92.9 Å²	92.9	82%	0.818	57%	0.571	S	S	*	*	S	Bend	trans	-1	124.6	168.7	62.6	0	0	0	0	117.9
234	G	27.2	Very low	42.1	Very low	73 Å²	73	91.1 Å²	91.1	75%	0.753	56%	0.555	S	S	*	*			trans	103.3	120.5	148.8	0	0	0	0	0	116
235	C	26.9	Very low	44.4	Very low	122 Å²	122	89.3 Å²	89.3	82%	0.824	54%	0.544	S	S	*	.	S	Bend	trans	58.2	112.9	142	-93	0	0	0	0	119.2
236	S	30.9	Very low	46.8	Very low	99 Å²	99	89 Å²	89	69%	0.692	54%	0.54	S	S	*	.	S	Bend	trans	102.2	-20.3	131	-50.2	0	0	0	0	120
237	D	34.4	Very low	49.2	Very low	166 Å²	166	85.1 Å²	85.1	89%	0.888	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	10.9	-175.5	-89	-6.6	0	0	0	115.9
238	L	41.7	Very low	51.6	Low	80 Å²	80	83.3 Å²	83.3	42%	0.419	50%	0.503	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-4.7	179.6	-79.4	163.9	0	0	0	114.8	M231 R242	M231-L238 HydrophobicContact CE-CD1 4Å; L238-R242 WeakPolarHBondContact O-CB 3.24Å
239	S	42.5	Very low	54.3	Low	89 Å²	89	76.5 Å²	76.5	62%	0.622	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-34.4	-168.6	61.1	0	0	0	0	114.7	K241	S239-K241 PolarHBondContact O-N 3.49Å
240	D	43.3	Very low	57.1	Low	151 Å²	151	74.8 Å²	74.8	81%	0.807	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-5.9	-163	-85.8	8.5	0	0	0	115.8
241	K	58.4	Low	60	Low	142 Å²	142	71.7 Å²	71.7	62%	0.617	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135.1	-3.7	179.7	-60.5	179	-176.3	170.7	0	114.1	S239	S239-K241 PolarHBondContact O-N 3.49Å
242	R	68.3	Low	62.6	Low	31 Å²	31	68.4 Å²	68.4	12%	0.117	40%	0.395	C	S	.	.	P	Polyproline II helix	trans	-75.9	144	177.6	-175.6	174.9	153.9	-73	-3.2	109.8	L238 Q246 E581	L238-R242 WeakPolarHBondContact O-CB 3.24Å; R242-Q246 HydrophobicContact CG-CB 3.96Å; R242-Q246 HydrophobicContact CG-CG 4.35Å; R242-Q246 PolarHBondContact NE-O 2.93Å; R242-Q246 PolarHBondContact NH2-O 3.06Å; R242-E581 IonicContact CZ-OE1 3.12Å; R242-E581 IonicContact CZ-OE2 3.06Å; R242-E581 IonicContact NH1-OE1 3.07Å; R242-E581 PolarHBondContact NH1-OE1 3.19Å; R242-E581 IonicContact NH1-OE2 2.91Å; R242-E581 PolarHBondContact NH1-OE2 2.67Å; R242-E581 IonicContact NH2-OE2 3.91Å; R242-E581 PolarHBondContact NH2-OE2 3.29Å; R242-E581 VanDerWaalsContact NH2-OE2 3.07Å
243	R	73	Confident	65.3	Low	100 Å²	100	62.5 Å²	62.5	38%	0.377	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-87.3	148.3	178.2	-61.1	-91.5	168.3	163.1	7	110.2	I222 G245 Q246 I492	I222-R243 HydrophobicContact CG2-CG 3.5Å; I222-R243 VanDerWaalsContact CG2-CG 3.5Å; R243-G245 PolarHBondContact O-N 3.17Å; R243-Q246 HydrophobicContact CB-CB 4.05Å; R243-Q246 WeakPolarHBondContact O-CB 3.37Å; R243-Q246 PolarHBondContact O-N 2.69Å; R243-I492 HydrophobicContact CB-CD1 3.72Å; R243-I492 HydrophobicContact CG-CD1 3.99Å
244	R	81.4	Confident	68	Low	88 Å²	88	57.7 Å²	57.7	33%	0.332	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.8	131.3	168.2	-163.2	-167.5	172.3	127.7	-11.5	110.1	Q246 E581 L582 L585	R244-Q246 PolarHBondContact O-N 2.87Å; R244-E581 WeakPolarHBondContact CA-OE2 3.27Å; R244-E581 HydrophobicContact CG-CB 3.79Å; R244-E581 HydrophobicContact CG-CG 4.44Å; R244-E581 PolarHBondContact NE-O 3.47Å; R244-E581 PolarHBondContact NH1-O 3.37Å; R244-E581 PolarHBondContact NH2-O 3.08Å; R244-L582 HydrophobicContact CG-CD2 4.25Å; R244-L582 VanDerWaalsContact NH2-C 3.3Å; R244-L582 PolarHBondContact NH2-O 3Å; R244-L585 VanDerWaalsContact NH2-CA 3.32Å
245	G	85.9	Confident	70.7	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.3	7.7	178.9	0	0	0	0	0	114.8	R243 A493 E581	R243-G245 PolarHBondContact O-N 3.17Å; G245-A493 PolarHBondContact O-N 3.49Å; G245-E581 PolarHBondContact N-OE2 3.07Å
246	Q	90.4	Very high	73.7	Confident	10 Å²	10	48.6 Å²	48.6	5%	0.047	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	131.8	179.8	-173.2	-177.1	-33.8	0	0	112	R242 R243 R244 I490 L491 I492	R242-Q246 HydrophobicContact CG-CB 3.96Å; R242-Q246 HydrophobicContact CG-CG 4.35Å; R242-Q246 PolarHBondContact NE-O 2.93Å; R242-Q246 PolarHBondContact NH2-O 3.06Å; R243-Q246 HydrophobicContact CB-CB 4.05Å; R243-Q246 WeakPolarHBondContact O-CB 3.37Å; R243-Q246 PolarHBondContact O-N 2.69Å; R244-Q246 PolarHBondContact O-N 2.87Å; Q246-I490 HydrophobicContact CG-CG2 3.8Å; Q246-L491 CarbonylContact C-O 3.49Å; Q246-L491 VanDerWaalsContact CA-O 3.24Å; Q246-L491 WeakPolarHBondContact CA-O 3.41Å; Q246-I492 HydrophobicContact CB-CG1 4.13Å; Q246-I492 HydrophobicContact CG-CG1 4.26Å
247	I	90.8	Very high	76.4	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	153.1	177.5	60.4	-176.8	0	0	0	110.3	L491 I499 L502 L570 E574 A578	I247-L491 HydrophobicContact CG1-CB 3.9Å; I247-L491 HydrophobicContact CG1-CD1 4.37Å; I247-L491 PolarHBondContact N-O 3.48Å; I247-L491 PolarHBondContact O-N 3.37Å; I247-I499 HydrophobicContact CD1-CG1 4.47Å; I247-I499 HydrophobicContact CD1-CG2 4.23Å; I247-I499 HydrophobicContact CG2-CD1 4.44Å; I247-L502 HydrophobicContact CD1-CD2 3.73Å; I247-L570 HydrophobicContact CD1-CD2 4.03Å; I247-L570 HydrophobicContact CG1-CD2 4.31Å; I247-E574 HydrophobicContact CG2-CB 4.38Å; I247-A578 HydrophobicContact CG2-CB 3.57Å
248	S	90.4	Very high	78.8	Confident	11 Å²	11	38.9 Å²	38.9	8%	0.077	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	117.5	179	-53.2	0	0	0	0	110.1	L570 E574	S248-L570 WeakPolarHBondContact O-CD2 3.33Å; S248-E574 WeakPolarHBondContact CA-OE2 3.26Å; S248-E574 WeakPolarHBondContact CB-OE2 3.24Å; S248-E574 PolarHBondContact N-OE2 2.8Å; S248-E574 PolarHBondContact OG-OE1 3.06Å; S248-E574 PolarHBondContact OG-OE2 3.07Å
249	L	92.6	Very high	80.6	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	120.9	172.6	-174.8	74.4	0	0	0	109.8	I251 L454 C488 V489 L491 L542 V568 L570	L249-I251 HydrophobicContact CD2-CD1 4.2Å; L249-I251 HydrophobicContact CD2-CG1 4.28Å; L249-I251 HydrophobicContact CG-CG1 4.33Å; L249-L454 HydrophobicContact CD2-CD1 4.18Å; L249-L454 HydrophobicContact CD2-CD2 4.09Å; L249-C488 WeakPolarHBondContact O-CA 3.3Å; L249-V489 HydrophobicContact CB-CB 4.28Å; L249-V489 PolarHBondContact N-O 3.04Å; L249-V489 PolarHBondContact O-N 2.91Å; L249-L491 HydrophobicContact CB-CD1 3.68Å; L249-L491 HydrophobicContact CB-CG 4.17Å; L249-L491 HydrophobicContact CD2-CD1 4.2Å; L249-L491 HydrophobicContact CG-CD1 4.42Å; L249-L542 HydrophobicContact CD1-CD2 3.85Å; L249-L542 HydrophobicContact CD2-CD2 4.32Å; L249-V568 HydrophobicContact CD1-CG1 3.33Å; L249-V568 HydrophobicContact CD2-CG1 4.22Å; L249-V568 HydrophobicContact CG-CG1 3.84Å; L249-L570 HydrophobicContact CB-CD2 4.11Å; L249-L570 HydrophobicContact CD1-CD2 3.66Å; L249-L570 HydrophobicContact CD1-CG 3.98Å
250	W	91	Very high	82.2	Confident	15 Å²	15	33.6 Å²	33.6	6%	0.057	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	123.8	179.1	-61.8	89.5	0	0	0	109.7	M231 F470 A486 L487 C488 V568 T569	M231-W250 HydrophobicContact SD-CZ2 4.14Å; W250-F470 HydrophobicContact CB-CD2 4.1Å; W250-F470 HydrophobicContact CB-CE2 4.39Å; W250-F470 HydrophobicContact CB-CG 4.47Å; W250-F470 AromaticContact CD1-CD2 3.86Å; W250-F470 AromaticContact CD1-CE2 3.84Å; W250-F470 HydrophobicContact CD2-CB 4.26Å; W250-F470 AromaticContact CD2-CD2 3.56Å; W250-F470 HydrophobicContact CD2-CD2 3.56Å; W250-F470 HydrophobicContact CD2-CE2 4.32Å; W250-F470 HydrophobicContact CD2-CG 4.25Å; W250-F470 AromaticContact CE2-CD2 3.84Å; W250-F470 HydrophobicContact CE3-CB 3.85Å; W250-F470 HydrophobicContact CE3-CD2 4.04Å; W250-F470 HydrophobicContact CE3-CG 4.33Å; W250-F470 AromaticContact CG-CD2 3.57Å; W250-F470 HydrophobicContact CG-CD2 3.57Å; W250-F470 AromaticContact CG-CE2 3.93Å; W250-F470 HydrophobicContact CG-CE2 3.93Å; W250-F470 HydrophobicContact CG-CG 4.32Å; W250-F470 HydrophobicContact CZ3-CB 4.19Å; W250-A486 HydrophobicContact CE3-CB 4.04Å; W250-L487 CarbonylContact C-O 3.59Å; W250-L487 WeakPolarHBondContact CA-O 3.38Å; W250-C488 HydrophobicContact CD2-CB 4.29Å; W250-C488 HydrophobicContact CE3-CB 3.83Å; W250-C488 HydrophobicContact CH2-CB 4Å; W250-C488 HydrophobicContact CZ2-CB 4.41Å; W250-C488 HydrophobicContact CZ3-CB 3.7Å; W250-V568 CarbonylContact O-C 3.55Å; W250-V568 VanDerWaalsContact O-CA 3.26Å; W250-V568 WeakPolarHBondContact O-CA 3.39Å; W250-T569 WeakPolarHBondContact CB-O 3.35Å; W250-T569 PolarHBondContact N-O 3.19Å; W250-T569 PolarHBondContact O-N 3.37Å
251	I	92	Very high	83.6	Confident	1 Å²	1	29.2 Å²	29.2	1%	0.005	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	120.5	179.6	-54	171.6	0	0	0	108.3	L249 L487 V489 L546 L566 S567 V568	L249-I251 HydrophobicContact CD2-CD1 4.2Å; L249-I251 HydrophobicContact CD2-CG1 4.28Å; L249-I251 HydrophobicContact CG-CG1 4.33Å; I251-L487 HydrophobicContact CB-CB 4.25Å; I251-L487 HydrophobicContact CD1-CD2 4.42Å; I251-L487 PolarHBondContact N-O 3.01Å; I251-L487 PolarHBondContact O-N 3.14Å; I251-V489 HydrophobicContact CD1-CG2 3.9Å; I251-L546 HydrophobicContact CD1-CD1 4Å; I251-L566 HydrophobicContact CG2-CD1 4.28Å; I251-L566 HydrophobicContact CG2-CD2 4.29Å; I251-S567 WeakPolarHBondContact CA-O 3.06Å; I251-V568 HydrophobicContact CG1-CG1 4.43Å; I251-V568 HydrophobicContact CG1-CG2 4.27Å; I251-V568 HydrophobicContact CG2-CG2 4.36Å
252	Q	90	Very high	84.3	Confident	15 Å²	15	23 Å²	23	7%	0.07	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	140.8	178.7	-178.1	-178.7	-9.9	0	0	110.8	L254 H320 Y436 V484 A486 L566 S567	Q252-L254 PolarHBondContact O-N 2.97Å; Q252-H320 PolarHBondContact NE2-NE2 2.82Å; Q252-H320 VanDerWaalsContact NE2-NE2 3.11Å; Q252-Y436 WeakPolarHBondContact CA-OH 3.38Å; Q252-V484 HydrophobicContact CG-CG1 4.49Å; Q252-V484 VanDerWaalsContact NE2-CG1 3.33Å; Q252-A486 HydrophobicContact CB-CB 4.29Å; Q252-L566 CarbonylContact O-C 3.53Å; Q252-L566 VanDerWaalsContact O-CA 3.31Å; Q252-L566 WeakPolarHBondContact O-CA 3.33Å; Q252-S567 PolarHBondContact N-O 2.97Å; Q252-S567 PolarHBondContact O-N 3.05Å
253	L	89.8	Confident	84.6	Confident	1 Å²	1	22.2 Å²	22.2	1%	0.005	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	103.4	168.9	-169.1	64.9	0	0	0	109.3	I256 L428 K431 F435 Y436 L564 L566	L253-I256 HydrophobicContact CD1-CG2 3.98Å; L253-I256 HydrophobicContact CD2-CG2 3.58Å; L253-I256 HydrophobicContact CG-CG2 3.84Å; L253-L428 HydrophobicContact CD2-CD1 4.24Å; L253-L428 HydrophobicContact CG-CD1 4.21Å; L253-K431 HydrophobicContact CD2-CB 4.47Å; L253-F435 HydrophobicContact CB-CD1 4.5Å; L253-F435 HydrophobicContact CD2-CB 4.47Å; L253-Y436 PolarHBondContact N-OH 3.29Å; L253-L564 HydrophobicContact CD1-CB 3.99Å; L253-L566 HydrophobicContact CD1-CD2 4.04Å
254	L	86.2	Confident	84.5	Confident	16 Å²	16	19 Å²	19	8%	0.084	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	-42.2	-173	-177.2	65.5	0	0	0	112.3	Q252 M537 T539 R565	Q252-L254 PolarHBondContact O-N 2.97Å; L254-M537 HydrophobicContact CD1-CE 4.1Å; L254-M537 HydrophobicContact CD1-SD 3.75Å; L254-M537 HydrophobicContact CD2-CB 3.9Å; L254-M537 HydrophobicContact CD2-CG 4.48Å; L254-M537 HydrophobicContact CD2-SD 3.93Å; L254-M537 HydrophobicContact CG-SD 3.92Å; L254-T539 HydrophobicContact CD2-CG2 4.47Å; L254-R565 PolarHBondContact N-O 2.86Å
255	A	85.6	Confident	83.9	Confident	5 Å²	5	22.1 Å²	22.1	4%	0.041	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	153.1	179.9	0	0	0	0	0	111.5	W317 I318 D319 L564 R565	A255-W317 HydrophobicContact CB-CE3 4.15Å; A255-W317 HydrophobicContact CB-CZ3 4.31Å; A255-I318 CarbonylContact C-O 3.58Å; A255-I318 WeakPolarHBondContact CA-O 3.39Å; A255-I318 WeakPolarHBondContact CB-O 3.27Å; A255-D319 HydrophobicContact CB-CB 3.68Å; A255-L564 CarbonylContact O-C 3.42Å; A255-L564 WeakPolarHBondContact O-CA 3.41Å; A255-R565 HydrophobicContact CB-CB 4.09Å; A255-R565 HydrophobicContact CB-CG 4.47Å; A255-R565 PolarHBondContact N-O 3.17Å; A255-R565 PolarHBondContact O-N 3.14Å
256	I	89.2	Confident	82.9	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	148	175.5	59.8	179.4	0	0	0	110.3	L253 V258 W317 I318 I427 L428 K431 L561	L253-I256 HydrophobicContact CD1-CG2 3.98Å; L253-I256 HydrophobicContact CD2-CG2 3.58Å; L253-I256 HydrophobicContact CG-CG2 3.84Å; I256-V258 HydrophobicContact CD1-CG1 3.76Å; I256-V258 HydrophobicContact CG1-CG1 4.02Å; I256-W317 CarbonylContact O-C 3.47Å; I256-W317 WeakPolarHBondContact O-CA 3.34Å; I256-I318 HydrophobicContact CD1-CD1 4.5Å; I256-I318 HydrophobicContact CG1-CB 3.95Å; I256-I318 PolarHBondContact N-O 3.48Å; I256-I318 PolarHBondContact O-N 2.93Å; I256-I427 HydrophobicContact CD1-CG2 4.1Å; I256-L428 HydrophobicContact CD1-CD1 4.21Å; I256-L428 HydrophobicContact CG1-CD1 4.03Å; I256-L428 HydrophobicContact CG2-CD1 3.98Å; I256-K431 HydrophobicContact CD1-CB 3.95Å; I256-K431 HydrophobicContact CD1-CG 3.98Å; I256-L561 HydrophobicContact CB-CD1 4.11Å; I256-L561 HydrophobicContact CB-CD2 4.13Å; I256-L561 HydrophobicContact CD1-CD2 4.19Å; I256-L561 HydrophobicContact CG2-CD1 3.66Å; I256-L561 HydrophobicContact CG2-CD2 4.44Å
257	K	87.1	Confident	81.7	Confident	59 Å²	59	25.6 Å²	25.6	26%	0.257	14%	0.14	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	113.8	169.6	-168.2	-179.7	178.9	-179.8	0	108.4	P315 I316 W317 Q562 N563	K257-P315 HydrophobicContact CD-CB 4.4Å; K257-P315 VanDerWaalsContact CE-CB 3.42Å; K257-P315 HydrophobicContact CG-CB 4.16Å; K257-I316 WeakPolarHBondContact CA-O 3.29Å; K257-W317 HydrophobicContact CB-CD2 3.86Å; K257-W317 HydrophobicContact CB-CE3 3.86Å; K257-W317 HydrophobicContact CB-CH2 4.03Å; K257-W317 HydrophobicContact CB-CZ2 4.03Å; K257-W317 HydrophobicContact CB-CZ3 3.93Å; K257-W317 HydrophobicContact CD-CD2 4.47Å; K257-W317 HydrophobicContact CD-CZ2 3.99Å; K257-W317 HydrophobicContact CG-CD2 4.18Å; K257-W317 HydrophobicContact CG-CG 4.47Å; K257-W317 HydrophobicContact CG-CZ2 4.44Å; K257-Q562 HydrophobicContact CB-CB 4.2Å; K257-Q562 HydrophobicContact CD-CB 4.11Å; K257-Q562 HydrophobicContact CG-CB 4.06Å; K257-Q562 WeakPolarHBondContact O-CB 3.09Å; K257-Q562 PolarHBondContact O-N 2.86Å; K257-N563 HydrophobicContact CB-CB 3.73Å; K257-N563 HydrophobicContact CD-CB 4.19Å; K257-N563 PolarHBondContact N-O 3.25Å
258	V	84.2	Confident	79.9	Confident	1 Å²	1	31 Å²	31	1%	0.006	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	148.8	-178	-64.6	0	0	0	0	110.9	I256 L262 Y263 P315 I316 I318 L561	I256-V258 HydrophobicContact CD1-CG1 3.76Å; I256-V258 HydrophobicContact CG1-CG1 4.02Å; V258-L262 HydrophobicContact CB-CD2 4.32Å; V258-L262 HydrophobicContact CG1-CD2 4.1Å; V258-Y263 HydrophobicContact CG2-CD2 4.04Å; V258-P315 WeakPolarHBondContact O-CA 3.48Å; V258-I316 HydrophobicContact CG2-CB 4.45Å; V258-I316 PolarHBondContact N-O 3.45Å; V258-I316 PolarHBondContact O-N 3.32Å; V258-I316 VanDerWaalsContact O-N 3.11Å; V258-I318 HydrophobicContact CG1-CD1 4.24Å; V258-I318 HydrophobicContact CG2-CD1 3.63Å; V258-I318 HydrophobicContact CG2-CG1 4.19Å; V258-L561 HydrophobicContact CG1-CD2 3.83Å
259	S	80.7	Confident	77.7	Confident	35 Å²	35	35.3 Å²	35.3	25%	0.245	20%	0.198	C	C	.	.			trans	-68.3	150.8	167.5	71.6	0	0	0	0	109.4	A261 L262 Y263	S259-A261 PolarHBondContact O-N 3.35Å; S259-L262 PolarHBondContact O-N 2.64Å; S259-L262 WeakPolarHBondContact OG-CB 3.24Å; S259-L262 PolarHBondContact OG-N 3.27Å; S259-Y263 PolarHBondContact O-N 2.66Å
260	P	74.8	Confident	74.9	Confident	24 Å²	24	40.4 Å²	40.4	16%	0.156	24%	0.24	C	C	.	.	H	α-helix	trans	-58.5	-34.3	175	-28.1	37.4	0	0	0	113.8	Y263 N264 P312 L314	P260-Y263 PolarHBondContact O-N 3.26Å; P260-N264 WeakPolarHBondContact O-CB 3.28Å; P260-N264 PolarHBondContact O-N 3.03Å; P260-N264 PolarHBondContact O-ND2 2.95Å; P260-N264 VanDerWaalsContact O-ND2 3.1Å; P260-N264 PolarHBondContact O-OD1 2.98Å; P260-P312 HydrophobicContact CB-CG 4.39Å; P260-P312 WeakPolarHBondContact CB-O 3.48Å; P260-P312 WeakPolarHBondContact CG-O 3.4Å; P260-L314 WeakPolarHBondContact CG-O 3.34Å
261	A	74	Confident	72.2	Confident	59 Å²	59	44.5 Å²	44.5	49%	0.488	27%	0.267	S	S	.	.	H	α-helix	trans	-61.5	-47	177.3	0	0	0	0	0	111.4	S259 N264 Q265	S259-A261 PolarHBondContact O-N 3.35Å; A261-N264 PolarHBondContact O-N 3.33Å; A261-Q265 WeakPolarHBondContact O-CG 3.44Å; A261-Q265 PolarHBondContact O-N 3.27Å; A261-Q265 VanDerWaalsContact O-N 3.14Å
262	L	73	Confident	69.3	Low	11 Å²	11	54.2 Å²	54.2	6%	0.058	31%	0.309	C	S	.	.	H	α-helix	trans	-66.8	-40.6	177.4	-171.3	73.8	0	0	0	111.4	V258 S259 N264 Q265 L266 E560 L561	V258-L262 HydrophobicContact CB-CD2 4.32Å; V258-L262 HydrophobicContact CG1-CD2 4.1Å; S259-L262 PolarHBondContact O-N 2.64Å; S259-L262 WeakPolarHBondContact OG-CB 3.24Å; S259-L262 PolarHBondContact OG-N 3.27Å; L262-N264 VanDerWaalsContact C-N 3.32Å; L262-N264 PolarHBondContact O-N 2.96Å; L262-Q265 PolarHBondContact O-N 2.83Å; L262-L266 HydrophobicContact CD1-CD1 4.13Å; L262-L266 HydrophobicContact CD1-CG 4.45Å; L262-L266 HydrophobicContact CD2-CD1 4.25Å; L262-L266 HydrophobicContact CG-CD1 3.77Å; L262-L266 HydrophobicContact CG-CG 4.37Å; L262-L266 WeakPolarHBondContact O-CG 3.18Å; L262-L266 PolarHBondContact O-N 3.06Å; L262-E560 HydrophobicContact CD2-CB 4.48Å; L262-E560 WeakPolarHBondContact CD2-O 3.39Å; L262-L561 HydrophobicContact CD2-CD2 4.48Å
263	Y	74.2	Confident	66.5	Low	15 Å²	15	60.2 Å²	60.2	6%	0.059	34%	0.341	C	S	.	.	H	α-helix	trans	-55.5	-49.5	175.6	-172.8	-98.9	0	0	0	111.2	V258 S259 P260 Q265 L266 T267 P312 I316 I318 T420 S424 I427	V258-Y263 HydrophobicContact CG2-CD2 4.04Å; S259-Y263 PolarHBondContact O-N 2.66Å; P260-Y263 PolarHBondContact O-N 3.26Å; Y263-Q265 VanDerWaalsContact C-N 3.3Å; Y263-Q265 PolarHBondContact O-N 3.12Å; Y263-L266 PolarHBondContact O-N 2.72Å; Y263-T267 HydrophobicContact CD1-CG2 3.94Å; Y263-T267 HydrophobicContact CD2-CG2 4.45Å; Y263-T267 HydrophobicContact CE1-CG2 3.53Å; Y263-T267 HydrophobicContact CE2-CG2 4.12Å; Y263-T267 HydrophobicContact CG-CG2 4.39Å; Y263-T267 WeakPolarHBondContact O-CG2 3.47Å; Y263-T267 PolarHBondContact O-N 3.1Å; Y263-T267 PolarHBondContact O-OG1 3.37Å; Y263-T267 VanDerWaalsContact O-OG1 3.05Å; Y263-P312 HydrophobicContact CD1-CG 4.42Å; Y263-I316 HydrophobicContact CD1-CD1 4.14Å; Y263-I316 HydrophobicContact CD2-CD1 4.36Å; Y263-I316 HydrophobicContact CE1-CD1 4.37Å; Y263-I316 HydrophobicContact CG-CD1 4.12Å; Y263-I318 HydrophobicContact CD2-CD1 3.8Å; Y263-I318 HydrophobicContact CE2-CD1 3.89Å; Y263-I318 HydrophobicContact CE2-CG1 4.41Å; Y263-T420 WeakPolarHBondContact OH-CG2 3.11Å; Y263-S424 PolarHBondContact OH-OG 3.22Å; Y263-I427 HydrophobicContact CD2-CD1 3.77Å; Y263-I427 HydrophobicContact CE2-CD1 3.83Å
264	N	70.5	Confident	63.6	Low	33 Å²	33	70.3 Å²	70.3	18%	0.176	39%	0.385	C	S	.	.	H	α-helix	trans	-68.1	-27.5	-178.2	-62.3	-22.2	0	0	0	113.8	P260 A261 L262 T267 N269	P260-N264 WeakPolarHBondContact O-CB 3.28Å; P260-N264 PolarHBondContact O-N 3.03Å; P260-N264 PolarHBondContact O-ND2 2.95Å; P260-N264 VanDerWaalsContact O-ND2 3.1Å; P260-N264 PolarHBondContact O-OD1 2.98Å; A261-N264 PolarHBondContact O-N 3.33Å; L262-N264 VanDerWaalsContact C-N 3.32Å; L262-N264 PolarHBondContact O-N 2.96Å; N264-T267 WeakPolarHBondContact CA-OG1 3.15Å; N264-T267 PolarHBondContact O-OG1 2.8Å; N264-N269 PolarHBondContact O-ND2 3.37Å
265	Q	68.8	Low	61.1	Low	152 Å²	152	75.3 Å²	75.3	71%	0.71	42%	0.417	S	S	*	.	H	α-helix	trans	-73.6	-35.5	174.3	-74.9	175.1	0.4	0	0	111.9	A261 L262 Y263	A261-Q265 WeakPolarHBondContact O-CG 3.44Å; A261-Q265 PolarHBondContact O-N 3.27Å; A261-Q265 VanDerWaalsContact O-N 3.14Å; L262-Q265 PolarHBondContact O-N 2.83Å; Y263-Q265 VanDerWaalsContact C-N 3.3Å; Y263-Q265 PolarHBondContact O-N 3.12Å
266	L	66.2	Low	58.5	Low	64 Å²	64	85 Å²	85	34%	0.335	46%	0.458	S	S	.	.	H	α-helix	trans	-92.5	-21.4	-175.6	-61.2	173.7	0	0	0	113.3	L262 Y263 P268 I427	L262-L266 HydrophobicContact CD1-CD1 4.13Å; L262-L266 HydrophobicContact CD1-CG 4.45Å; L262-L266 HydrophobicContact CD2-CD1 4.25Å; L262-L266 HydrophobicContact CG-CD1 3.77Å; L262-L266 HydrophobicContact CG-CG 4.37Å; L262-L266 WeakPolarHBondContact O-CG 3.18Å; L262-L266 PolarHBondContact O-N 3.06Å; Y263-L266 PolarHBondContact O-N 2.72Å; L266-P268 WeakPolarHBondContact O-CD 3.34Å; L266-I427 HydrophobicContact CB-CD1 3.91Å; L266-I427 HydrophobicContact CB-CG1 3.7Å; L266-I427 HydrophobicContact CD1-CG1 4.48Å; L266-I427 HydrophobicContact CD1-CG2 3.85Å
267	T	65	Low	55.9	Low	19 Å²	19	92.2 Å²	92.2	12%	0.117	50%	0.497	C	S	.	.	S	Bend	trans	-73.8	124	166.5	51	0	0	0	0	109.1	Y263 N264 N269 A423 I427	Y263-T267 HydrophobicContact CD1-CG2 3.94Å; Y263-T267 HydrophobicContact CD2-CG2 4.45Å; Y263-T267 HydrophobicContact CE1-CG2 3.53Å; Y263-T267 HydrophobicContact CE2-CG2 4.12Å; Y263-T267 HydrophobicContact CG-CG2 4.39Å; Y263-T267 WeakPolarHBondContact O-CG2 3.47Å; Y263-T267 PolarHBondContact O-N 3.1Å; Y263-T267 PolarHBondContact O-OG1 3.37Å; Y263-T267 VanDerWaalsContact O-OG1 3.05Å; N264-T267 WeakPolarHBondContact CA-OG1 3.15Å; N264-T267 PolarHBondContact O-OG1 2.8Å; T267-N269 PolarHBondContact O-N 3.41Å; T267-A423 HydrophobicContact CG2-CB 4.13Å; T267-I427 HydrophobicContact CG2-CD1 3.9Å
268	P	53.3	Low	53.1	Low	116 Å²	116	94.8 Å²	94.8	75%	0.753	52%	0.522	S	S	*	.			trans	-62.8	102.9	172.9	23.7	-30.2	0	0	0	108.5	L266 A270	L266-P268 WeakPolarHBondContact O-CD 3.34Å; P268-A270 PolarHBondContact O-N 3.38Å; P268-A270 VanDerWaalsContact O-N 3.08Å
269	N	43.1	Very low	50.8	Low	101 Å²	101	104.2 Å²	104.2	54%	0.54	56%	0.563	S	S	.	*			trans	-63.3	115.7	173.7	-72	-39.7	0	0	0	107.6	N264 T267 T271	N264-N269 PolarHBondContact O-ND2 3.37Å; T267-N269 PolarHBondContact O-N 3.41Å; N269-T271 PolarHBondContact O-N 3.42Å
270	A	35.3	Very low	48.5	Very low	106 Å²	106	108.5 Å²	108.5	88%	0.876	59%	0.588	S	S	*	*			trans	-65.5	25	171.7	0	0	0	0	0	113.3	P268	P268-A270 PolarHBondContact O-N 3.38Å; P268-A270 VanDerWaalsContact O-N 3.08Å
271	T	33.9	Very low	46.6	Very low	102 Å²	102	111.4 Å²	111.4	63%	0.626	60%	0.601	S	S	*	*			trans	-101	97.8	175.5	48.5	0	0	0	0	109.2	N269 N273	N269-T271 PolarHBondContact O-N 3.42Å; T271-N273 PolarHBondContact O-N 2.95Å
272	K	29.6	Very low	44.7	Very low	205 Å²	205	111.8 Å²	111.8	89%	0.891	60%	0.599	S	S	*	*			trans	-35	100.5	161.7	-65.5	170.6	177.8	173.3	0	111.2
273	N	32.7	Very low	43.1	Very low	140 Å²	140	115.4 Å²	115.4	75%	0.749	63%	0.625	S	S	*	*			trans	-117.2	110.2	153.8	-79.7	-18.9	0	0	0	107.4	T271 T275	T271-N273 PolarHBondContact O-N 2.95Å; N273-T275 VanDerWaalsContact C-N 3.32Å; N273-T275 PolarHBondContact O-N 2.88Å
274	K	28.8	Very low	41.5	Very low	213 Å²	213	121 Å²	121	93%	0.926	65%	0.652	S	S	*	*			trans	-58.2	92.5	169.8	-75.6	174.3	172.3	175	0	108.7
275	T	33.9	Very low	40.2	Very low	121 Å²	121	122.4 Å²	122.4	74%	0.742	66%	0.661	S	S	*	*			trans	-148.1	120.9	156.9	-12.4	0	0	0	0	108	N273 D277	N273-T275 VanDerWaalsContact C-N 3.32Å; N273-T275 PolarHBondContact O-N 2.88Å; T275-D277 PolarHBondContact O-N 3.43Å
276	K	29.8	Very low	38.7	Very low	208 Å²	208	120.9 Å²	120.9	90%	0.904	65%	0.654	S	S	*	*			trans	-61.6	96.3	178.4	-70.1	169.9	173.2	176.7	0	108.6
277	D	34.4	Very low	37.4	Very low	153 Å²	153	125.8 Å²	125.8	82%	0.818	67%	0.673	S	S	*	*			trans	-146.8	119.4	155.8	-85.8	-38.3	0	0	0	107.9	T275 F279	T275-D277 PolarHBondContact O-N 3.43Å; D277-F279 PolarHBondContact O-N 3.47Å
278	S	29.8	Very low	36	Very low	113 Å²	113	131.5 Å²	131.5	79%	0.79	70%	0.7	S	S	*	*			trans	-66.2	101.3	-171.9	52.3	0	0	0	0	111	V280	S278-V280 PolarHBondContact O-N 2.91Å
279	F	35.7	Very low	35.2	Very low	198 Å²	198	133.1 Å²	133.1	87%	0.868	70%	0.697	S	S	*	*			trans	-79.5	102.8	166	-143.9	-93.7	0	0	0	108.4	D277 L281	D277-F279 PolarHBondContact O-N 3.47Å; F279-L281 PolarHBondContact O-N 3.2Å
280	V	31.5	Very low	34.9	Very low	125 Å²	125	136.4 Å²	136.4	76%	0.758	71%	0.71	S	S	*	*			trans	-78	100.4	175.4	179.9	0	0	0	0	107.8	S278	S278-V280 PolarHBondContact O-N 2.91Å
281	L	34.9	Very low	34.9	Very low	85 Å²	85	135.4 Å²	135.4	45%	0.445	70%	0.696	S	S	.	*			trans	-59.6	135.7	167.8	-138.4	78.7	0	0	0	108.2	F279 S283 V285	F279-L281 PolarHBondContact O-N 3.2Å; L281-S283 PolarHBondContact O-N 3.33Å; L281-V285 HydrophobicContact CD2-CB 3.9Å; L281-V285 HydrophobicContact CD2-CG1 3.86Å
282	P	35	Very low	34.9	Very low	68 Å²	68	137.4 Å²	137.4	44%	0.442	70%	0.703	S	S	.	*			trans	-67.5	128.8	177.5	30.3	-35.6	0	0	0	109.4	H284 V285	P282-H284 WeakPolarHBondContact CB-CE1 3.5Å; P282-H284 VanDerWaalsContact CG-CE1 3.44Å; P282-H284 WeakPolarHBondContact CG-CE1 3.44Å; P282-H284 PolarHBondContact O-N 3Å; P282-V285 PolarHBondContact O-N 3.38Å
283	S	38.5	Very low	34.9	Very low	86 Å²	86	137.2 Å²	137.2	60%	0.601	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.7	-2	-167.2	57.7	0	0	0	0	116.6	L281 V285	L281-S283 PolarHBondContact O-N 3.33Å; S283-V285 VanDerWaalsContact C-N 3.34Å
284	H	40.6	Very low	34.6	Very low	133 Å²	133	137.6 Å²	137.6	62%	0.616	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	-13.1	172.4	54.8	-94.4	0	0	0	113.4	P282	P282-H284 WeakPolarHBondContact CB-CE1 3.5Å; P282-H284 VanDerWaalsContact CG-CE1 3.44Å; P282-H284 WeakPolarHBondContact CG-CE1 3.44Å; P282-H284 PolarHBondContact O-N 3Å
285	V	44.7	Very low	34.7	Very low	62 Å²	62	136.4 Å²	136.4	38%	0.376	70%	0.699	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.3	-31	177.5	-174.5	0	0	0	0	112.2	L281 P282 S283 K287 M288	L281-V285 HydrophobicContact CD2-CB 3.9Å; L281-V285 HydrophobicContact CD2-CG1 3.86Å; P282-V285 PolarHBondContact O-N 3.38Å; S283-V285 VanDerWaalsContact C-N 3.34Å; V285-K287 VanDerWaalsContact C-N 3.3Å; V285-K287 PolarHBondContact O-N 3.48Å; V285-M288 PolarHBondContact O-N 2.82Å
286	E	36.8	Very low	34.4	Very low	120 Å²	120	137.4 Å²	137.4	56%	0.561	70%	0.699	S	S	*	*	G	3₁₀ helix	trans	-65	-32.3	176.8	-81	178.5	146.2	0	0	112.7	M288 Q289 E290	E286-M288 VanDerWaalsContact C-N 3.32Å; E286-M288 PolarHBondContact O-N 3.11Å; E286-Q289 PolarHBondContact O-N 2.91Å; E286-Q289 VanDerWaalsContact O-N 3.13Å; E286-E290 PolarHBondContact O-N 3.49Å
287	K	37.9	Very low	34.6	Very low	167 Å²	167	134.1 Å²	134.1	73%	0.726	69%	0.691	S	S	*	*	G	3₁₀ helix	trans	-74.5	-14.2	-178.8	-76	-174.7	175.9	-178.9	0	115.1	V285	V285-K287 VanDerWaalsContact C-N 3.3Å; V285-K287 PolarHBondContact O-N 3.48Å
288	M	35.5	Very low	34.3	Very low	139 Å²	139	135.6 Å²	135.6	69%	0.685	69%	0.69	S	S	*	*	G	3₁₀ helix	trans	-89.1	-10.2	170	-84.6	-169.7	173.6	0	0	113	V285 E286	V285-M288 PolarHBondContact O-N 2.82Å; E286-M288 VanDerWaalsContact C-N 3.32Å; E286-M288 PolarHBondContact O-N 3.11Å
289	Q	36.4	Very low	34.4	Very low	151 Å²	151	137.2 Å²	137.2	71%	0.706	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.8	-22.7	-178.4	-157.6	167.2	-16.7	0	0	112.7	E286	E286-Q289 PolarHBondContact O-N 2.91Å; E286-Q289 VanDerWaalsContact O-N 3.13Å
290	E	36.7	Very low	34.1	Very low	170 Å²	170	136.4 Å²	136.4	79%	0.794	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	-8.3	177.4	-75.7	-177.6	146.5	0	0	114.8	E286	E286-E290 PolarHBondContact O-N 3.49Å
291	S	35.7	Very low	34.1	Very low	85 Å²	85	135.8 Å²	135.8	59%	0.594	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.9	0.4	-177.1	49.5	0	0	0	0	115.5
292	N	34.8	Very low	33.9	Very low	144 Å²	144	141.1 Å²	141.1	77%	0.77	70%	0.704	S	S	*	*			trans	-113.7	90.6	173.9	-77.1	-34.1	0	0	0	111.2
293	K	29.8	Very low	33.7	Very low	201 Å²	201	147.6 Å²	147.6	87%	0.874	72%	0.72	S	S	*	*			trans	-60.4	141.7	166.4	-82	179.1	175.5	177.6	0	110.7
294	L	26.3	Very low	33.2	Very low	148 Å²	148	151.7 Å²	151.7	78%	0.775	73%	0.731	S	S	*	*			trans	81.6	103.5	150.4	-144.7	83.7	0	0	0	116.2
295	F	30.4	Very low	32.6	Very low	188 Å²	188	151.9 Å²	151.9	83%	0.825	74%	0.744	S	S	*	*				-164.2	95.7	123.2	-95.3	-69.5	0	0	0	108	L297	F295-L297 HydrophobicContact CD1-CD1 4.01Å
296	D	26.7	Very low	31.7	Very low	141 Å²	141	152 Å²	152	75%	0.754	76%	0.758	S	S	*	*			trans	-81.9	106.2	166.4	-164.8	8.4	0	0	0	106.7
297	L	34.6	Very low	31.3	Very low	139 Å²	139	155.3 Å²	155.3	73%	0.728	77%	0.773	S	S	*	*			trans	-125.5	90	163.3	-99.2	101	0	0	0	108	F295 D299	F295-L297 HydrophobicContact CD1-CD1 4.01Å; L297-D299 PolarHBondContact O-N 3.49Å
298	K	27.2	Very low	30.6	Very low	184 Å²	184	157.2 Å²	157.2	80%	0.8	78%	0.781	S	S	*	*			trans	-61	105.2	145.2	-71.3	-178.5	177.5	179.1	0	107.1
299	D	33.6	Very low	30.7	Very low	147 Å²	147	156.9 Å²	156.9	79%	0.786	78%	0.778	S	S	*	*			trans	-153.7	144	145.3	-120	-23	0	0	0	112.5	L297	L297-D299 PolarHBondContact O-N 3.49Å
300	Q	28.7	Very low	30.6	Very low	181 Å²	181	158.7 Å²	158.7	85%	0.846	78%	0.779	S	S	*	*			trans	-70.3	137.3	-170.4	-56.8	179.4	-5	0	0	111.2
301	D	31.3	Very low	30.9	Very low	112 Å²	112	155.9 Å²	155.9	60%	0.599	77%	0.769	S	S	*	*				-161.7	111.7	128.7	-137	-6	0	0	0	109.8	R303	D301-R303 PolarHBondContact O-N 2.99Å; D301-R303 IonicContact OD2-CZ 3.8Å; D301-R303 VanDerWaalsContact OD2-CZ 3.26Å; D301-R303 IonicContact OD2-NE 2.99Å; D301-R303 PolarHBondContact OD2-NE 3.15Å; D301-R303 IonicContact OD2-NH2 2.87Å; D301-R303 PolarHBondContact OD2-NH2 2.87Å
302	E	30	Very low	31.7	Very low	198 Å²	198	153.7 Å²	153.7	93%	0.925	75%	0.752	S	S	*	*			trans	-67.2	97.3	165.9	-74.7	-170.2	144.3	0	0	108.7
303	R	32.6	Very low	32.4	Very low	204 Å²	204	151.5 Å²	151.5	77%	0.77	75%	0.748	S	S	*	*			trans	-129.5	111.5	165	-69.9	-170.6	-151.9	179.8	8.4	111.2	D301	D301-R303 PolarHBondContact O-N 2.99Å; D301-R303 IonicContact OD2-CZ 3.8Å; D301-R303 VanDerWaalsContact OD2-CZ 3.26Å; D301-R303 IonicContact OD2-NE 2.99Å; D301-R303 PolarHBondContact OD2-NE 3.15Å; D301-R303 IonicContact OD2-NH2 2.87Å; D301-R303 PolarHBondContact OD2-NH2 2.87Å
304	M	28.2	Very low	34	Very low	172 Å²	172	147.9 Å²	147.9	85%	0.847	74%	0.738	S	S	*	*			trans	21	135.4	151.4	-69.2	-69.7	173.1	0	0	119	G306	M304-G306 VanDerWaalsContact C-N 3.27Å; M304-G306 PolarHBondContact O-N 3.38Å
305	P	27.6	Very low	36	Very low	137 Å²	137	143.1 Å²	143.1	89%	0.89	72%	0.716	S	S	*	*			trans	-72.7	81.7	177	32.8	-32.4	0	0	0	110
306	G	25.4	Very low	38.2	Very low	64 Å²	64	135.4 Å²	135.4	66%	0.66	68%	0.683	S	S	*	*			trans	-103	133.2	178.5	0	0	0	0	0	111.7	M304	M304-G306 VanDerWaalsContact C-N 3.27Å; M304-G306 PolarHBondContact O-N 3.38Å
307	H	27.3	Very low	40.8	Very low	190 Å²	190	132 Å²	132	88%	0.88	66%	0.659	S	S	*	*			trans	79.8	87.5	172.7	-101.1	-50	0	0	0	118.6	Q309	H307-Q309 PolarHBondContact O-N 3.12Å; H307-Q309 VanDerWaalsContact O-N 3.16Å
308	F	24.9	Very low	43	Very low	206 Å²	206	125.4 Å²	125.4	90%	0.904	63%	0.625	S	S	*	*			trans	-52.4	114.3	152.3	-77.9	-89.2	0	0	0	110.4	R310	F308-R310 PolarHBondContact O-N 3.09Å
309	Q	36	Very low	45.4	Very low	133 Å²	133	117.8 Å²	117.8	62%	0.621	59%	0.593	S	S	*	*			trans	-66.9	110.1	163.2	-109.5	169.3	2.6	0	0	108	H307 L311	H307-Q309 PolarHBondContact O-N 3.12Å; H307-Q309 VanDerWaalsContact O-N 3.16Å; Q309-L311 PolarHBondContact O-N 2.97Å
310	R	36.1	Very low	47	Very low	189 Å²	189	112.8 Å²	112.8	71%	0.713	57%	0.565	S	S	*	*	P	Polyproline II helix	trans	-65.6	121.1	-178.9	-150.6	175.9	-158.2	160.6	4.6	109	F308 H329	F308-R310 PolarHBondContact O-N 3.09Å; R310-H329 PolarHBondContact NH1-CE1 2.83Å; R310-H329 PolarHBondContact NH1-NE2 3.29Å; R310-H329 VanDerWaalsContact NH1-NE2 3.19Å
311	L	42.6	Very low	48.4	Very low	111 Å²	111	108.6 Å²	108.6	58%	0.581	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-57.8	147.7	-177.7	-62.6	169.1	0	0	0	111.6	Q309 S313	Q309-L311 PolarHBondContact O-N 2.97Å; L311-S313 PolarHBondContact O-N 2.89Å
312	P	52	Low	49.5	Very low	38 Å²	38	105.1 Å²	105.1	25%	0.247	53%	0.534	C	S	.	.	P	Polyproline II helix	trans	-59.9	121.3	171.4	23.9	-31.1	0	0	0	109.1	P260 Y263 L314 I316	P260-P312 HydrophobicContact CB-CG 4.39Å; P260-P312 WeakPolarHBondContact CB-O 3.48Å; P260-P312 WeakPolarHBondContact CG-O 3.4Å; Y263-P312 HydrophobicContact CD1-CG 4.42Å; P312-L314 VanDerWaalsContact C-N 3.3Å; P312-I316 HydrophobicContact CB-CD1 3.39Å; P312-I316 HydrophobicContact CB-CG1 3.92Å; P312-I316 HydrophobicContact CG-CD1 3.27Å; P312-I316 HydrophobicContact CG-CG1 4.29Å
313	S	48.8	Very low	50	Low	99 Å²	99	98.8 Å²	98.8	69%	0.692	51%	0.509	S	S	*	.	S	Bend	trans	-83.5	-12.5	174.4	55.2	0	0	0	0	112.6	L311	L311-S313 PolarHBondContact O-N 2.89Å
314	L	63.1	Low	50.5	Low	124 Å²	124	90.8 Å²	90.8	65%	0.649	48%	0.484	S	S	*	.	S	Bend	trans	-116.9	147.7	-174.8	-66.4	173	0	0	0	110.6	P260 P312 I316	P260-L314 WeakPolarHBondContact CG-O 3.34Å; P312-L314 VanDerWaalsContact C-N 3.3Å; L314-I316 PolarHBondContact O-N 3.03Å
315	P	70	Confident	51.1	Low	48 Å²	48	92.5 Å²	92.5	31%	0.312	48%	0.481	S	S	.	.			trans	-54	138.1	175.5	-25.6	34.9	0	0	0	112.8	K257 V258	K257-P315 HydrophobicContact CD-CB 4.4Å; K257-P315 VanDerWaalsContact CE-CB 3.42Å; K257-P315 HydrophobicContact CG-CB 4.16Å; V258-P315 WeakPolarHBondContact O-CA 3.48Å
316	I	76.1	Confident	51.3	Low	26 Å²	26	91.4 Å²	91.4	13%	0.133	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	134	-175	-62	164.2	0	0	0	109.4	K257 V258 Y263 P312 L314 I318	K257-I316 WeakPolarHBondContact CA-O 3.29Å; V258-I316 HydrophobicContact CG2-CB 4.45Å; V258-I316 PolarHBondContact N-O 3.45Å; V258-I316 PolarHBondContact O-N 3.32Å; V258-I316 VanDerWaalsContact O-N 3.11Å; Y263-I316 HydrophobicContact CD1-CD1 4.14Å; Y263-I316 HydrophobicContact CD2-CD1 4.36Å; Y263-I316 HydrophobicContact CE1-CD1 4.37Å; Y263-I316 HydrophobicContact CG-CD1 4.12Å; P312-I316 HydrophobicContact CB-CD1 3.39Å; P312-I316 HydrophobicContact CB-CG1 3.92Å; P312-I316 HydrophobicContact CG-CD1 3.27Å; P312-I316 HydrophobicContact CG-CG1 4.29Å; L314-I316 PolarHBondContact O-N 3.03Å; I316-I318 HydrophobicContact CG2-CG1 4.27Å
317	W	81.1	Confident	51.5	Low	69 Å²	69	92.3 Å²	92.3	26%	0.261	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	128.8	162.7	-78.8	103.8	0	0	0	109.5	A255 I256 K257 N563 R565	A255-W317 HydrophobicContact CB-CE3 4.15Å; A255-W317 HydrophobicContact CB-CZ3 4.31Å; I256-W317 CarbonylContact O-C 3.47Å; I256-W317 WeakPolarHBondContact O-CA 3.34Å; K257-W317 HydrophobicContact CB-CD2 3.86Å; K257-W317 HydrophobicContact CB-CE3 3.86Å; K257-W317 HydrophobicContact CB-CH2 4.03Å; K257-W317 HydrophobicContact CB-CZ2 4.03Å; K257-W317 HydrophobicContact CB-CZ3 3.93Å; K257-W317 HydrophobicContact CD-CD2 4.47Å; K257-W317 HydrophobicContact CD-CZ2 3.99Å; K257-W317 HydrophobicContact CG-CD2 4.18Å; K257-W317 HydrophobicContact CG-CG 4.47Å; K257-W317 HydrophobicContact CG-CZ2 4.44Å; W317-N563 HydrophobicContact CH2-CB 3.67Å; W317-N563 HydrophobicContact CZ2-CB 4.07Å; W317-N563 HydrophobicContact CZ3-CB 4.43Å; W317-R565 HydrophobicContact CH2-CG 3.97Å; W317-R565 HydrophobicContact CZ3-CG 3.84Å
318	I	81.2	Confident	51.5	Low	1 Å²	1	88.5 Å²	88.5	1%	0.005	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	120.6	172.3	-59.4	173.2	0	0	0	107	A255 I256 V258 Y263 I316 S424 I427 L428	A255-I318 CarbonylContact C-O 3.58Å; A255-I318 WeakPolarHBondContact CA-O 3.39Å; A255-I318 WeakPolarHBondContact CB-O 3.27Å; I256-I318 HydrophobicContact CD1-CD1 4.5Å; I256-I318 HydrophobicContact CG1-CB 3.95Å; I256-I318 PolarHBondContact N-O 3.48Å; I256-I318 PolarHBondContact O-N 2.93Å; V258-I318 HydrophobicContact CG1-CD1 4.24Å; V258-I318 HydrophobicContact CG2-CD1 3.63Å; V258-I318 HydrophobicContact CG2-CG1 4.19Å; Y263-I318 HydrophobicContact CD2-CD1 3.8Å; Y263-I318 HydrophobicContact CE2-CD1 3.89Å; Y263-I318 HydrophobicContact CE2-CG1 4.41Å; I316-I318 HydrophobicContact CG2-CG1 4.27Å; I318-S424 VanDerWaalsContact CG2-O 3.24Å; I318-S424 WeakPolarHBondContact CG2-O 3.35Å; I318-I427 HydrophobicContact CD1-CB 4.19Å; I318-I427 HydrophobicContact CD1-CD1 4.32Å; I318-I427 HydrophobicContact CD1-CG2 3.81Å; I318-L428 HydrophobicContact CG2-CB 3.96Å
319	D	78	Confident	51.6	Low	25 Å²	25	85.4 Å²	85.4	13%	0.134	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	175.3	168.8	66.7	39.3	0	0	0	109.3	A255 T321 T322	A255-D319 HydrophobicContact CB-CB 3.68Å; D319-T321 PolarHBondContact O-N 3.05Å; D319-T321 WeakPolarHBondContact OD1-CA 3.49Å; D319-T321 WeakPolarHBondContact OD1-CB 3.37Å; D319-T321 PolarHBondContact OD1-N 3.04Å; D319-T321 PolarHBondContact OD1-OG1 3.23Å; D319-T322 PolarHBondContact N-OG1 2.72Å; D319-T322 PolarHBondContact O-N 3.3Å; D319-T322 PolarHBondContact O-OG1 3.23Å; D319-T322 PolarHBondContact OD1-N 2.9Å; D319-T322 PolarHBondContact OD1-OG1 3.36Å; D319-T322 PolarHBondContact OD2-OG1 2.61Å
320	H	66.2	Low	51.2	Low	41 Å²	41	84.3 Å²	84.3	19%	0.19	45%	0.449	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-6.2	179.4	-67.1	-70.3	0	0	0	114.5	Q252 R425	Q252-H320 PolarHBondContact NE2-NE2 2.82Å; Q252-H320 VanDerWaalsContact NE2-NE2 3.11Å; H320-R425 PolarHBondContact ND1-NE 3.23Å
321	T	58.6	Low	50.9	Low	94 Å²	94	82.3 Å²	82.3	58%	0.577	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.7	-9.4	-174.8	69.7	0	0	0	0	114.8	D319 T323	D319-T321 PolarHBondContact O-N 3.05Å; D319-T321 WeakPolarHBondContact OD1-CA 3.49Å; D319-T321 WeakPolarHBondContact OD1-CB 3.37Å; D319-T321 PolarHBondContact OD1-N 3.04Å; D319-T321 PolarHBondContact OD1-OG1 3.23Å; T321-T323 PolarHBondContact O-N 2.93Å
322	T	52.9	Low	50.2	Low	38 Å²	38	86.8 Å²	86.8	23%	0.233	47%	0.471	C	S	.	.			trans	-75	130.6	-165.4	-18.1	0	0	0	0	111	D319	D319-T322 PolarHBondContact N-OG1 2.72Å; D319-T322 PolarHBondContact O-N 3.3Å; D319-T322 PolarHBondContact O-OG1 3.23Å; D319-T322 PolarHBondContact OD1-N 2.9Å; D319-T322 PolarHBondContact OD1-OG1 3.36Å; D319-T322 PolarHBondContact OD2-OG1 2.61Å
323	T	41.8	Very low	49.1	Very low	65 Å²	65	89.6 Å²	89.6	40%	0.399	49%	0.491	S	S	.	.			trans	-95.2	115.4	160.4	38.7	0	0	0	0	107.3	T321 R325 R421	T321-T323 PolarHBondContact O-N 2.93Å; T323-R325 PolarHBondContact O-N 2.85Å; T323-R421 HydrophobicContact CG2-CG 3.96Å
324	P	43.4	Very low	48.1	Very low	37 Å²	37	92.2 Å²	92.2	24%	0.24	50%	0.498	C	S	.	.			trans	-67.6	106.5	174.3	23	-27.7	0	0	0	108.7	T420	P324-T420 HydrophobicContact CB-CG2 4.48Å; P324-T420 HydrophobicContact CG-CG2 3.26Å
325	R	39.6	Very low	46.5	Very low	207 Å²	207	94 Å²	94	78%	0.781	50%	0.504	S	S	*	.			trans	-75.5	132.9	175.3	-85.9	-174.8	171.5	176.2	-2.5	110.7	T323 A327	T323-R325 PolarHBondContact O-N 2.85Å; R325-A327 PolarHBondContact O-N 2.84Å
326	L	31.5	Very low	44.6	Very low	115 Å²	115	98.2 Å²	98.2	60%	0.602	52%	0.524	S	S	*	.			trans	-53.3	114.5	171.1	-158.2	77.2	0	0	0	110.1	T328	L326-T328 PolarHBondContact O-N 2.83Å; L326-T328 PolarHBondContact O-OG1 2.87Å
327	A	30	Very low	42.4	Very low	82 Å²	82	108.4 Å²	108.4	68%	0.678	56%	0.563	S	S	*	*			trans	-67.1	95.4	172.4	0	0	0	0	0	109	R325	R325-A327 PolarHBondContact O-N 2.84Å
328	T	28.1	Very low	39.9	Very low	110 Å²	110	112 Å²	112	68%	0.675	59%	0.586	S	S	*	*			trans	-84.2	118.2	173.8	7.3	0	0	0	0	109.2	L326	L326-T328 PolarHBondContact O-N 2.83Å; L326-T328 PolarHBondContact O-OG1 2.87Å
329	H	27.6	Very low	37.3	Very low	141 Å²	141	120.6 Å²	120.6	65%	0.653	62%	0.623	S	S	*	*			trans	19.4	107.8	158.9	-74.5	-98.1	0	0	0	117.7	R310	R310-H329 PolarHBondContact NH1-CE1 2.83Å; R310-H329 PolarHBondContact NH1-NE2 3.29Å; R310-H329 VanDerWaalsContact NH1-NE2 3.19Å
330	T	27	Very low	35	Very low	111 Å²	111	125.1 Å²	125.1	68%	0.681	65%	0.654	S	S	*	*			trans	-132.6	129.2	145.4	-20	0	0	0	0	108	V528	T330-V528 HydrophobicContact CG2-CG2 4.41Å
331	N	29.5	Very low	33.2	Very low	147 Å²	147	126.9 Å²	126.9	79%	0.786	68%	0.675	S	S	*	*			trans	-53.7	140.1	-168.3	-70.3	-39.3	0	0	0	112.5	S333	N331-S333 PolarHBondContact O-N 3.4Å
332	Q	27.4	Very low	31.9	Very low	205 Å²	205	131.4 Å²	131.4	96%	0.958	69%	0.69	S	S	*	*			trans	-47	109.8	168.1	-76.7	164.5	-27	0	0	110.2
333	S	30.1	Very low	30.7	Very low	97 Å²	97	135.4 Å²	135.4	68%	0.678	71%	0.71	S	S	*	*			trans	-111.5	116.2	150	61.6	0	0	0	0	107	N331 M335	N331-S333 PolarHBondContact O-N 3.4Å; S333-M335 PolarHBondContact O-N 2.94Å; S333-M335 VanDerWaalsContact O-N 3.15Å
334	N	26.8	Very low	30.1	Very low	154 Å²	154	139 Å²	139	82%	0.824	73%	0.732	S	S	*	*			trans	-32	115.2	165.1	-114.4	-9.3	0	0	0	110.6
335	M	30.6	Very low	29.5	Very low	161 Å²	161	145 Å²	145	79%	0.793	76%	0.76	S	S	*	*			trans	-129.8	107.5	162.5	-86.5	-68.6	170.2	0	0	106.9	S333	S333-M335 PolarHBondContact O-N 2.94Å; S333-M335 VanDerWaalsContact O-N 3.15Å
336	D	30	Very low	29.1	Very low	136 Å²	136	144.4 Å²	144.4	73%	0.727	76%	0.763	S	S	*	*			trans	-48.8	153.2	175.2	-73.1	-54.3	0	0	0	111.9	I338	D336-I338 PolarHBondContact O-N 2.79Å
337	Y	29.1	Very low	29.1	Very low	241 Å²	241	146 Å²	146	95%	0.945	77%	0.773	S	S	*	*			trans	-45.2	95.1	169.8	-87.6	-101.1	0	0	0	111.4	K339	Y337-K339 VanDerWaalsContact C-N 3.3Å; Y337-K339 PolarHBondContact O-N 2.85Å
338	I	28.8	Very low	29.1	Very low	145 Å²	145	145.1 Å²	145.1	74%	0.744	77%	0.765	S	S	*	*			trans	-76.6	92.9	165.6	-60	178	0	0	0	106.2	D336	D336-I338 PolarHBondContact O-N 2.79Å
339	K	26.9	Very low	29.4	Very low	180 Å²	180	150.7 Å²	150.7	78%	0.783	77%	0.774	S	S	*	*			trans	-37	130.1	155.4	-134.4	177.8	-175.9	-175.8	0	107.9	Y337 A341	Y337-K339 VanDerWaalsContact C-N 3.3Å; Y337-K339 PolarHBondContact O-N 2.85Å; K339-A341 PolarHBondContact O-N 2.85Å
340	P	30.2	Very low	29.8	Very low	121 Å²	121	148.9 Å²	148.9	79%	0.786	77%	0.768	S	S	*	*			trans	-57.1	117.2	176.1	23.9	-30.1	0	0	0	107.2	E342	P340-E342 PolarHBondContact O-N 2.89Å
341	A	27.9	Very low	30.3	Very low	77 Å²	77	150.6 Å²	150.6	64%	0.636	77%	0.769	S	S	*	*			trans	-55.4	115.1	-176.1	0	0	0	0	0	108.9	K339 N343	K339-A341 PolarHBondContact O-N 2.85Å; A341-N343 PolarHBondContact O-N 3.45Å
342	E	29.9	Very low	30.6	Very low	189 Å²	189	152.7 Å²	152.7	88%	0.883	77%	0.766	S	S	*	*			trans	-74.3	53.7	176.4	-154.8	170.6	-152.9	0	0	109.3	P340	P340-E342 PolarHBondContact O-N 2.89Å
343	N	28.1	Very low	31.3	Very low	123 Å²	123	147.5 Å²	147.5	66%	0.658	74%	0.744	S	S	*	*			trans	-143.2	120.4	-167	-51.4	46.2	0	0	0	108.4	A341	A341-N343 PolarHBondContact O-N 3.45Å
344	T	28.9	Very low	31.9	Very low	139 Å²	139	150.2 Å²	150.2	85%	0.853	74%	0.743	S	S	*	*			trans	81.8	38.5	177.4	57.2	0	0	0	0	119.1
345	I	31.6	Very low	32.7	Very low	163 Å²	163	149.8 Å²	149.8	84%	0.836	74%	0.74	S	S	*	*			trans	-105.3	57	144.4	-47.8	177.6	0	0	0	108.7
346	K	30.5	Very low	33.4	Very low	196 Å²	196	147.9 Å²	147.9	85%	0.852	73%	0.732	S	S	*	*	S	Bend	trans	-122.1	69.5	163.7	-73.8	-175.5	-179.9	177.8	0	106.8
347	N	31.3	Very low	34.1	Very low	149 Å²	149	146.3 Å²	146.3	80%	0.797	72%	0.724	S	S	*	*	S	Bend	trans	163.1	57.5	159.6	-83.9	-18.3	0	0	0	111.9
348	A	31.3	Very low	34.5	Very low	62 Å²	62	139.5 Å²	139.5	51%	0.512	71%	0.709	S	S	.	*	S	Bend	trans	-134	-2	160.8	0	0	0	0	0	112.8	N350	A348-N350 VanDerWaalsContact C-N 3.3Å; A348-N350 PolarHBondContact O-N 2.82Å
349	R	33.7	Very low	35.1	Very low	228 Å²	228	140 Å²	140	86%	0.86	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	-4.8	177.4	-128.1	172.2	169.3	162.3	-4.6	113.8
350	N	36.2	Very low	36	Very low	102 Å²	102	137.1 Å²	137.1	55%	0.545	71%	0.71	S	S	.	*	T	Hydrogen-bonded Turn	trans	-113.4	5.6	-174.7	-76.8	-11.8	0	0	0	115.3	A348 K354	A348-N350 VanDerWaalsContact C-N 3.3Å; A348-N350 PolarHBondContact O-N 2.82Å; N350-K354 WeakPolarHBondContact O-CG 3.41Å
351	Q	37.3	Very low	36.3	Very low	148 Å²	148	136.7 Å²	136.7	69%	0.692	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99	-29.2	174.5	-78.2	-174.3	-8.6	0	0	113.4	I353 K354 L355	Q351-I353 VanDerWaalsContact C-N 3.34Å; Q351-K354 PolarHBondContact O-N 3.04Å; Q351-L355 PolarHBondContact O-N 2.89Å
352	W	36.9	Very low	36.9	Very low	191 Å²	191	138.5 Å²	138.5	72%	0.723	72%	0.715	S	S	*	*	H	α-helix	trans	-71.5	-29.6	173.4	-69.8	84.1	0	0	0	112.8	K354 L356	W352-K354 VanDerWaalsContact C-N 3.32Å; W352-L356 PolarHBondContact O-N 2.88Å
353	I	42	Very low	37.3	Very low	96 Å²	96	136.7 Å²	136.7	49%	0.492	71%	0.71	S	S	.	*	H	α-helix	trans	-74.7	-24.4	173.7	-61.9	171	0	0	0	111.2	Q351 L356 L357	Q351-I353 VanDerWaalsContact C-N 3.34Å; I353-L356 PolarHBondContact O-N 3.01Å; I353-L357 HydrophobicContact CG2-CD1 3.98Å; I353-L357 VanDerWaalsContact O-CD1 3.31Å; I353-L357 WeakPolarHBondContact O-CD1 3.04Å; I353-L357 PolarHBondContact O-N 2.81Å
354	K	42.3	Very low	37.7	Very low	154 Å²	154	141.8 Å²	141.8	67%	0.67	72%	0.72	S	S	*	*	H	α-helix	trans	-80.1	-23.6	176.9	-76.7	-176.5	177.8	-174.1	0	113.9	N350 Q351 W352 L356	N350-K354 WeakPolarHBondContact O-CG 3.41Å; Q351-K354 PolarHBondContact O-N 3.04Å; W352-K354 VanDerWaalsContact C-N 3.32Å; K354-L356 VanDerWaalsContact C-N 3.35Å
355	L	43.1	Very low	38	Very low	145 Å²	145	144.7 Å²	144.7	76%	0.759	72%	0.724	S	S	*	*	H	α-helix	trans	-81.5	-15.4	169.3	-82.9	156	0	0	0	112.9	Q351	Q351-L355 PolarHBondContact O-N 2.89Å
356	L	46	Very low	38.1	Very low	120 Å²	120	141.7 Å²	141.7	63%	0.628	72%	0.718	S	S	*	*	S	Bend	trans	-94.5	-3.6	172	-75.5	163.7	0	0	0	113.6	W352 I353 K354	W352-L356 PolarHBondContact O-N 2.88Å; I353-L356 PolarHBondContact O-N 3.01Å; K354-L356 VanDerWaalsContact C-N 3.35Å
357	L	44.7	Very low	38.3	Very low	104 Å²	104	141.6 Å²	141.6	55%	0.545	72%	0.717	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.4	-13.7	-174.1	-126.9	75.7	0	0	0	117.2	I353	I353-L357 HydrophobicContact CG2-CD1 3.98Å; I353-L357 VanDerWaalsContact O-CD1 3.31Å; I353-L357 WeakPolarHBondContact O-CD1 3.04Å; I353-L357 PolarHBondContact O-N 2.81Å
358	P	37.3	Very low	38.5	Very low	97 Å²	97	141.5 Å²	141.5	63%	0.63	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.6	-10.1	173.4	-13.4	29.3	0	0	0	115
359	L	41.6	Very low	38.5	Very low	157 Å²	157	143.2 Å²	143.2	82%	0.822	73%	0.731	S	S	*	*	S	Bend	trans	-100.9	-1.7	-173.5	-87.3	155.4	0	0	0	114.9
360	V	44.9	Very low	38.5	Very low	119 Å²	119	139.1 Å²	139.1	72%	0.721	73%	0.726	S	S	*	*	S	Bend	trans	-101.8	0.9	178.4	-170	0	0	0	0	112.5
361	C	37.5	Very low	38.3	Very low	111 Å²	111	143.5 Å²	143.5	75%	0.75	74%	0.74	S	S	*	*	S	Bend	trans	-97.3	9.5	-177.5	-71.2	0	0	0	0	116
362	C	39	Very low	38.1	Very low	116 Å²	116	145.9 Å²	145.9	78%	0.784	75%	0.754	S	S	*	*	S	Bend	trans	-107.2	11.4	-177.1	-70.2	0	0	0	0	115.8
363	L	39.6	Very low	38	Very low	151 Å²	151	142 Å²	142	79%	0.791	76%	0.756	S	S	*	*	S	Bend	trans	-130.6	100.3	179.7	-78.2	161	0	0	0	112.6
364	R	35.7	Very low	37.5	Very low	229 Å²	229	143.2 Å²	143.2	86%	0.864	77%	0.77	S	S	*	*			trans	66.2	108.6	151.4	-62.6	-179.7	174.7	-179.2	-1.2	117.7
365	Q	35.1	Very low	37.1	Very low	200 Å²	200	146 Å²	146	94%	0.935	78%	0.782	S	S	*	*				-163.2	139.1	109	-101.9	172.8	39.8	0	0	111.9
366	S	35	Very low	36.5	Very low	101 Å²	101	146.8 Å²	146.8	71%	0.706	79%	0.787	S	S	*	*			trans	-83.4	147.7	-172.1	49.7	0	0	0	0	113.7
367	K	33.7	Very low	36.5	Very low	193 Å²	193	146.3 Å²	146.3	84%	0.839	79%	0.791	S	S	*	*			trans	61.4	107.5	149.5	-68.1	178.6	175.6	178.7	0	118.4
368	T	35.4	Very low	36	Very low	147 Å²	147	146.5 Å²	146.5	90%	0.902	80%	0.799	S	S	*	*				164.5	152.1	100.6	42.4	0	0	0	0	111.8
369	S	31.3	Very low	35.8	Very low	98 Å²	98	149 Å²	149	69%	0.685	81%	0.805	S	S	*	*			trans	-72.1	142	-167.3	172.9	0	0	0	0	115.5
370	N	33.9	Very low	35.4	Very low	143 Å²	143	149 Å²	149	77%	0.765	81%	0.806	S	S	*	*				176	106.2	116.6	-87.9	-19.3	0	0	0	114
371	K	32.8	Very low	34.6	Very low	194 Å²	194	146.9 Å²	146.9	84%	0.843	81%	0.808	S	S	*	*				42.5	105.1	118.5	-148	178	-168.1	-179.2	0	119.4
372	M	33.5	Very low	34.3	Very low	198 Å²	198	147.9 Å²	147.9	98%	0.975	82%	0.815	S	S	*	*				-171	148.7	121.9	-113.9	166.7	161.4	0	0	113.6
373	S	33.3	Very low	33.9	Very low	110 Å²	110	147.9 Å²	147.9	77%	0.769	81%	0.811	S	S	*	*			trans	-79.8	157.1	-161.3	-179.6	0	0	0	0	115.7
374	P	31.1	Very low	33.3	Very low	121 Å²	121	149.8 Å²	149.8	79%	0.786	81%	0.813	S	S	*	*			trans	-85.1	158.6	179.1	35.5	-35.4	0	0	0	113.1
375	K	34.4	Very low	33.1	Very low	212 Å²	212	146.1 Å²	146.1	92%	0.922	81%	0.81	S	S	*	*			trans	-139.9	126.4	167.4	-129	176.8	-176.4	179.4	0	110.1
376	N	32	Very low	33	Very low	161 Å²	161	143.1 Å²	143.1	86%	0.861	80%	0.8	S	S	*	*			trans	-77.7	165.7	177	-89.2	-30	0	0	0	112.8
377	P	44.1	Very low	32.7	Very low	110 Å²	110	146.9 Å²	146.9	71%	0.714	81%	0.809	S	S	*	*			trans	-93.4	179.7	-161.9	39.7	-34.4	0	0	0	113.2
378	P	35.1	Very low	32.5	Very low	109 Å²	109	141.3 Å²	141.3	71%	0.708	80%	0.799	S	S	*	*				-160.8	164.1	105.1	38.1	-16.8	0	0	0	118.8
379	I	33.8	Very low	32.4	Very low	148 Å²	148	142 Å²	142	76%	0.759	80%	0.797	S	S	*	*			trans	61.3	150.2	133.6	-61.7	165.7	0	0	0	122.7
380	D	33	Very low	32.2	Very low	159 Å²	159	145.3 Å²	145.3	85%	0.85	81%	0.807	S	S	*	*			trans	87.2	129	171.5	-66	-27.8	0	0	0	116.8
381	G	27.2	Very low	32.2	Very low	74 Å²	74	148 Å²	148	76%	0.763	82%	0.815	S	S	*	*			cis	118.7	102.1	25.1	0	0	0	0	0	108.1
382	C	30.6	Very low	32.1	Very low	132 Å²	132	143 Å²	143	89%	0.892	81%	0.81	S	S	*	*			trans	-156.4	151.9	168	-154.5	0	0	0	0	113.6
383	T	30.8	Very low	31.9	Very low	115 Å²	115	143.6 Å²	143.6	71%	0.706	80%	0.803	S	S	*	*			trans	-111.6	155.7	-148.8	34.3	0	0	0	0	115.5
384	K	28.2	Very low	31.8	Very low	191 Å²	191	148.5 Å²	148.5	83%	0.83	80%	0.804	S	S	*	*			trans	68.3	161.1	138.2	-80.3	-178.7	175.2	178.5	0	121.8
385	L	32	Very low	31.5	Very low	153 Å²	153	150.1 Å²	150.1	80%	0.801	81%	0.807	S	S	*	*			trans	103.2	126.7	171.5	-54.7	174.5	0	0	0	112.8
386	N	31.7	Very low	31.4	Very low	136 Å²	136	147.1 Å²	147.1	73%	0.727	80%	0.799	S	S	*	*			cis	-165.5	161.4	6.9	-102	-24.3	0	0	0	111.5
387	M	29.3	Very low	31	Very low	180 Å²	180	144.3 Å²	144.3	89%	0.887	79%	0.792	S	S	*	*			trans	-43.8	165.9	162	-63.1	158.4	61	0	0	113.9
388	A	29.1	Very low	30.5	Very low	76 Å²	76	146.7 Å²	146.7	63%	0.628	80%	0.798	S	S	*	*			cis	-166	155.2	24.9	0	0	0	0	0	109.8
389	N	32.3	Very low	30.2	Very low	163 Å²	163	148.8 Å²	148.8	87%	0.872	80%	0.798	S	S	*	*				171.2	112.5	120.7	-88	-4.7	0	0	0	111.2
390	N	28.8	Very low	30	Very low	166 Å²	166	149.3 Å²	149.3	89%	0.888	80%	0.797	S	S	*	*			trans	-82.4	138.8	163.5	-79.4	-31.9	0	0	0	108.7
391	E	34.2	Very low	29.8	Very low	200 Å²	200	149 Å²	149	94%	0.935	80%	0.796	S	S	*	*			trans	-152.7	121.1	144.6	-114.4	171.8	-160.1	0	0	109.4
392	A	28.8	Very low	29.8	Very low	89 Å²	89	151.3 Å²	151.3	74%	0.736	80%	0.8	S	S	*	*			trans	-89.1	137	177.6	0	0	0	0	0	109.6
393	Y	30.6	Very low	29.9	Very low	210 Å²	210	150.2 Å²	150.2	82%	0.824	79%	0.794	S	S	*	*			trans	-150.9	103.8	156.8	-120.6	-88.3	0	0	0	112.5
394	R	30.5	Very low	29.9	Very low	213 Å²	213	154.7 Å²	154.7	80%	0.804	80%	0.803	S	S	*	*			trans	55.5	123.8	138.5	-65.5	-157.4	174.1	-159.4	-0.3	123.3
395	D	25.5	Very low	30.1	Very low	156 Å²	156	152.7 Å²	152.7	83%	0.834	80%	0.802	S	S	*	*			trans	-38.7	136.1	146.5	-78.6	-46.6	0	0	0	114.9
396	I	32.5	Very low	29.9	Very low	148 Å²	148	153.6 Å²	153.6	76%	0.759	81%	0.807	S	S	*	*			trans	-138.1	101.5	143.9	-58.8	-179.3	0	0	0	107.7	L398	I396-L398 HydrophobicContact CG2-CD1 3.97Å
397	S	23.6	Very low	29.9	Very low	103 Å²	103	152.5 Å²	152.5	72%	0.72	81%	0.81	S	S	*	*			trans	-69.7	129.8	155.3	57.1	0	0	0	0	109.1
398	L	32	Very low	30	Very low	160 Å²	160	155.4 Å²	155.4	84%	0.838	81%	0.812	S	S	*	*			trans	-132.6	101.1	165.1	-121.2	145.8	0	0	0	109.5	I396	I396-L398 HydrophobicContact CG2-CD1 3.97Å
399	H	30.3	Very low	29.9	Very low	153 Å²	153	157.2 Å²	157.2	71%	0.708	82%	0.818	S	S	*	*			trans	-63.8	151.9	165.3	-97.9	-72.3	0	0	0	111.6
400	Q	28.9	Very low	29.8	Very low	159 Å²	159	155.1 Å²	155.1	74%	0.743	81%	0.813	S	S	*	*			trans	67.3	118.5	152.1	-64.2	168.3	11.1	0	0	115.1
401	N	29.7	Very low	29.8	Very low	153 Å²	153	153 Å²	153	82%	0.818	81%	0.806	S	S	*	*				-153.9	140.6	78.6	-74.1	-41.9	0	0	0	112.6
402	S	26.4	Very low	30	Very low	122 Å²	122	149.1 Å²	149.1	85%	0.853	79%	0.79	S	S	*	*			trans	-68	135.5	166.9	65.5	0	0	0	0	111.2
403	S	32.1	Very low	30.4	Very low	108 Å²	108	150 Å²	150	76%	0.755	78%	0.783	S	S	*	*			trans	-139	124.3	144.4	69.7	0	0	0	0	108.9	D405	S403-D405 PolarHBondContact O-N 3.16Å
404	K	31.9	Very low	31.4	Very low	210 Å²	210	144.5 Å²	144.5	91%	0.913	78%	0.775	S	S	*	*			trans	-57.3	123	168.3	-71.4	170.3	173.5	174.4	0	108.3
405	D	31.5	Very low	32.2	Very low	148 Å²	148	137.2 Å²	137.2	79%	0.791	76%	0.76	S	S	*	*			trans	-145.1	110.3	159.2	-130.7	-9.5	0	0	0	109.3	S403 S407	S403-D405 PolarHBondContact O-N 3.16Å; D405-S407 PolarHBondContact O-N 2.83Å
406	D	27.5	Very low	33.8	Very low	172 Å²	172	132.6 Å²	132.6	92%	0.92	74%	0.736	S	S	*	*			trans	-60.5	112.1	170.1	-88.6	-43	0	0	0	108.9
407	S	32.6	Very low	35.2	Very low	113 Å²	113	128.2 Å²	128.2	79%	0.79	71%	0.714	S	S	*	*			trans	-139.4	111.8	161.7	59.4	0	0	0	0	111.2	D405	D405-S407 PolarHBondContact O-N 2.83Å
408	R	32.1	Very low	37.2	Very low	242 Å²	242	128.9 Å²	128.9	91%	0.913	70%	0.704	S	S	*	*			trans	-41.3	131.5	178.9	-71.9	170.7	-177.3	164	1.4	112.6
409	C	26.9	Very low	38.9	Very low	113 Å²	113	128 Å²	128	76%	0.764	69%	0.694	S	S	*	*			trans	-47.3	131.5	152.1	-69.4	0	0	0	0	108.9	V411	C409-V411 PolarHBondContact O-N 2.72Å
410	P	30.1	Very low	40.8	Very low	119 Å²	119	122.6 Å²	122.6	77%	0.773	67%	0.671	S	S	*	*			trans	-64.7	113.8	176.7	25.9	-29.8	0	0	0	107.6	I412	P410-I412 PolarHBondContact O-N 2.9Å
411	V	28.6	Very low	42.6	Very low	122 Å²	122	120.4 Å²	120.4	74%	0.739	66%	0.656	S	S	*	*			trans	-59.7	107.2	165.5	177.2	0	0	0	0	105.5	C409 N413	C409-V411 PolarHBondContact O-N 2.72Å; V411-N413 PolarHBondContact O-N 3.01Å; V411-N413 VanDerWaalsContact O-N 3.07Å
412	I	37.1	Very low	44.5	Very low	118 Å²	118	117.9 Å²	117.9	61%	0.605	64%	0.641	S	S	*	*			trans	-60.2	112.3	169.9	-61.8	171.5	0	0	0	105.6	P410 S414 D417	P410-I412 PolarHBondContact O-N 2.9Å; I412-S414 VanDerWaalsContact C-N 3.31Å; I412-S414 PolarHBondContact O-N 3.47Å; I412-D417 WeakPolarHBondContact CG2-OD2 3.32Å
413	N	38.4	Very low	46.8	Very low	108 Å²	108	113 Å²	113	58%	0.578	61%	0.607	S	S	*	*			trans	-63	95.6	173.3	-80.4	-12.6	0	0	0	108.1	V411 A415 D416 D417	V411-N413 PolarHBondContact O-N 3.01Å; V411-N413 VanDerWaalsContact O-N 3.07Å; N413-A415 PolarHBondContact O-N 2.77Å; N413-D416 PolarHBondContact O-N 3.32Å; N413-D416 VanDerWaalsContact O-N 3.07Å; N413-D417 PolarHBondContact O-N 2.71Å
414	S	51.2	Low	49	Very low	95 Å²	95	108 Å²	108	66%	0.664	57%	0.573	S	S	*	*	H	α-helix	trans	-56.5	-25.5	-174.6	59.1	0	0	0	0	113.8	I412 F418	I412-S414 VanDerWaalsContact C-N 3.31Å; I412-S414 PolarHBondContact O-N 3.47Å; S414-F418 WeakPolarHBondContact O-CB 3.46Å; S414-F418 PolarHBondContact O-N 3.12Å
415	A	47.9	Very low	51.2	Low	59 Å²	59	101.4 Å²	101.4	49%	0.488	54%	0.542	S	S	.	.	H	α-helix	trans	-70.2	-38.6	178.1	0	0	0	0	0	113	N413 K419	N413-A415 PolarHBondContact O-N 2.77Å; A415-K419 WeakPolarHBondContact O-CG 3.34Å; A415-K419 PolarHBondContact O-N 3.02Å; A415-K419 VanDerWaalsContact O-N 3.16Å
416	D	58.8	Low	53.5	Low	59 Å²	59	96.9 Å²	96.9	32%	0.316	53%	0.525	S	S	.	.	H	α-helix	trans	-72.9	-44.2	-179.6	-68.9	-26.5	0	0	0	110.2	N413 F418 K419 T420	N413-D416 PolarHBondContact O-N 3.32Å; N413-D416 VanDerWaalsContact O-N 3.07Å; D416-F418 VanDerWaalsContact C-N 3.27Å; D416-F418 PolarHBondContact O-N 3.36Å; D416-K419 PolarHBondContact O-N 3.21Å; D416-K419 VanDerWaalsContact O-N 3.16Å; D416-T420 PolarHBondContact O-N 3.36Å; D416-T420 PolarHBondContact O-OG1 2.91Å
417	D	62.7	Low	56.2	Low	57 Å²	57	89 Å²	89	31%	0.305	48%	0.483	S	S	.	.	H	α-helix	trans	-60.4	-34.4	175.4	-84	9	0	0	0	112.9	I412 N413 R421	I412-D417 WeakPolarHBondContact CG2-OD2 3.32Å; N413-D417 PolarHBondContact O-N 2.71Å; D417-R421 WeakPolarHBondContact O-CB 3.32Å; D417-R421 VanDerWaalsContact O-CG 3.25Å; D417-R421 WeakPolarHBondContact O-CG 3.46Å; D417-R421 PolarHBondContact O-N 2.71Å; D417-R421 VanDerWaalsContact O-N 3.07Å; D417-R421 PolarHBondContact O-NE 3.05Å; D417-R421 VanDerWaalsContact O-NE 3.13Å
418	F	64.1	Low	58.8	Low	117 Å²	117	83.6 Å²	83.6	51%	0.513	45%	0.445	S	S	.	.	H	α-helix	trans	-68.5	-48.5	174.2	-177.4	-97.6	0	0	0	111.5	S414 D416 T420 R421 M422	S414-F418 WeakPolarHBondContact O-CB 3.46Å; S414-F418 PolarHBondContact O-N 3.12Å; D416-F418 VanDerWaalsContact C-N 3.27Å; D416-F418 PolarHBondContact O-N 3.36Å; F418-T420 VanDerWaalsContact C-N 3.32Å; F418-T420 PolarHBondContact O-N 3.45Å; F418-R421 PolarHBondContact O-N 2.9Å; F418-M422 HydrophobicContact CD1-CG 4.06Å; F418-M422 HydrophobicContact CE1-CG 3.64Å; F418-M422 HydrophobicContact CE1-SD 4.36Å; F418-M422 HydrophobicContact CE2-CG 4.29Å; F418-M422 HydrophobicContact CE2-SD 4.37Å; F418-M422 HydrophobicContact CZ-CG 3.77Å; F418-M422 HydrophobicContact CZ-SD 3.91Å; F418-M422 WeakPolarHBondContact O-CG 3.42Å; F418-M422 PolarHBondContact O-N 3.29Å
419	K	68.8	Low	61.3	Low	142 Å²	142	75 Å²	75	62%	0.617	42%	0.417	S	S	*	.	H	α-helix	trans	-59.6	-42.7	177.5	-73.6	175.7	-177.8	174	0	111.8	A415 D416 M422 A423	A415-K419 WeakPolarHBondContact O-CG 3.34Å; A415-K419 PolarHBondContact O-N 3.02Å; A415-K419 VanDerWaalsContact O-N 3.16Å; D416-K419 PolarHBondContact O-N 3.21Å; D416-K419 VanDerWaalsContact O-N 3.16Å; K419-M422 PolarHBondContact O-N 3.39Å; K419-A423 WeakPolarHBondContact O-CB 3.5Å; K419-A423 PolarHBondContact O-N 3.34Å
420	T	68.7	Low	64.1	Low	39 Å²	39	72.1 Å²	72.1	24%	0.239	40%	0.399	C	S	.	.	H	α-helix	trans	-69.9	-35.3	179.5	-42.1	0	0	0	0	112.3	Y263 P324 D416 F418 A423 S424	Y263-T420 WeakPolarHBondContact OH-CG2 3.11Å; P324-T420 HydrophobicContact CB-CG2 4.48Å; P324-T420 HydrophobicContact CG-CG2 3.26Å; D416-T420 PolarHBondContact O-N 3.36Å; D416-T420 PolarHBondContact O-OG1 2.91Å; F418-T420 VanDerWaalsContact C-N 3.32Å; F418-T420 PolarHBondContact O-N 3.45Å; T420-A423 PolarHBondContact O-N 2.76Å; T420-S424 WeakPolarHBondContact O-CB 3.48Å; T420-S424 PolarHBondContact O-N 3.46Å; T420-S424 PolarHBondContact O-OG 3.46Å
421	R	67.6	Low	66.9	Low	112 Å²	112	66.7 Å²	66.7	42%	0.423	36%	0.363	S	S	.	.	H	α-helix	trans	-62.5	-45.7	170.4	-82	-177	-71.3	172.9	0.4	112	T323 D417 F418 A423 S424 R425	T323-R421 HydrophobicContact CG2-CG 3.96Å; D417-R421 WeakPolarHBondContact O-CB 3.32Å; D417-R421 VanDerWaalsContact O-CG 3.25Å; D417-R421 WeakPolarHBondContact O-CG 3.46Å; D417-R421 PolarHBondContact O-N 2.71Å; D417-R421 VanDerWaalsContact O-N 3.07Å; D417-R421 PolarHBondContact O-NE 3.05Å; D417-R421 VanDerWaalsContact O-NE 3.13Å; F418-R421 PolarHBondContact O-N 2.9Å; R421-A423 VanDerWaalsContact C-N 3.35Å; R421-A423 PolarHBondContact O-N 3.46Å; R421-S424 PolarHBondContact O-N 2.82Å; R421-R425 WeakPolarHBondContact O-CB 3.32Å; R421-R425 PolarHBondContact O-N 2.88Å
422	M	70.3	Confident	69.8	Low	100 Å²	100	61.2 Å²	61.2	49%	0.493	33%	0.33	S	S	.	.	H	α-helix	trans	-61.2	-43.6	176.9	-71.3	-59.7	-66	0	0	111.6	F418 K419 R425 A426	F418-M422 HydrophobicContact CD1-CG 4.06Å; F418-M422 HydrophobicContact CE1-CG 3.64Å; F418-M422 HydrophobicContact CE1-SD 4.36Å; F418-M422 HydrophobicContact CE2-CG 4.29Å; F418-M422 HydrophobicContact CE2-SD 4.37Å; F418-M422 HydrophobicContact CZ-CG 3.77Å; F418-M422 HydrophobicContact CZ-SD 3.91Å; F418-M422 WeakPolarHBondContact O-CG 3.42Å; F418-M422 PolarHBondContact O-N 3.29Å; K419-M422 PolarHBondContact O-N 3.39Å; M422-R425 PolarHBondContact O-N 3.22Å; M422-A426 WeakPolarHBondContact O-CB 3.39Å; M422-A426 PolarHBondContact O-N 2.88Å
423	A	73.9	Confident	72.2	Confident	19 Å²	19	58.3 Å²	58.3	16%	0.157	32%	0.318	C	S	.	.	H	α-helix	trans	-64.3	-44.2	176	0	0	0	0	0	111.9	T267 K419 T420 R421 R425 A426 I427	T267-A423 HydrophobicContact CG2-CB 4.13Å; K419-A423 WeakPolarHBondContact O-CB 3.5Å; K419-A423 PolarHBondContact O-N 3.34Å; T420-A423 PolarHBondContact O-N 2.76Å; R421-A423 VanDerWaalsContact C-N 3.35Å; R421-A423 PolarHBondContact O-N 3.46Å; A423-R425 PolarHBondContact O-N 2.91Å; A423-A426 PolarHBondContact O-N 3.37Å; A423-I427 VanDerWaalsContact O-CG1 3.26Å; A423-I427 WeakPolarHBondContact O-CG1 3.26Å; A423-I427 PolarHBondContact O-N 3.19Å
424	S	77.9	Confident	74.7	Confident	4 Å²	4	56.9 Å²	56.9	3%	0.028	31%	0.307	C	S	.	.	H	α-helix	trans	-61.4	-44.5	177.1	-60.1	0	0	0	0	111.7	Y263 I318 T420 R421 I427 L428	Y263-S424 PolarHBondContact OH-OG 3.22Å; I318-S424 VanDerWaalsContact CG2-O 3.24Å; I318-S424 WeakPolarHBondContact CG2-O 3.35Å; T420-S424 WeakPolarHBondContact O-CB 3.48Å; T420-S424 PolarHBondContact O-N 3.46Å; T420-S424 PolarHBondContact O-OG 3.46Å; R421-S424 PolarHBondContact O-N 2.82Å; S424-I427 PolarHBondContact O-N 3.46Å; S424-L428 PolarHBondContact O-N 2.94Å
425	R	77.7	Confident	76.8	Confident	72 Å²	72	52.3 Å²	52.3	27%	0.272	28%	0.276	S	S	.	.	H	α-helix	trans	-59.4	-46.5	174.1	-171.1	86.1	177.2	-131.7	-14.6	110.9	H320 R421 M422 A423 I427 L428 D429 E482	H320-R425 PolarHBondContact ND1-NE 3.23Å; R421-R425 WeakPolarHBondContact O-CB 3.32Å; R421-R425 PolarHBondContact O-N 2.88Å; M422-R425 PolarHBondContact O-N 3.22Å; A423-R425 PolarHBondContact O-N 2.91Å; R425-I427 VanDerWaalsContact C-N 3.31Å; R425-I427 PolarHBondContact O-N 3.11Å; R425-L428 PolarHBondContact O-N 3.47Å; R425-D429 WeakPolarHBondContact O-CB 3.41Å; R425-D429 VanDerWaalsContact O-CG 3.23Å; R425-D429 PolarHBondContact O-N 2.95Å; R425-E482 IonicContact NH2-OE2 2.75Å; R425-E482 PolarHBondContact NH2-OE2 3.28Å
426	A	80.1	Confident	78.9	Confident	53 Å²	53	49.6 Å²	49.6	44%	0.438	25%	0.253	S	S	.	.	H	α-helix	trans	-61.9	-36.7	177.9	0	0	0	0	0	112.9	M422 A423 S430	M422-A426 WeakPolarHBondContact O-CB 3.39Å; M422-A426 PolarHBondContact O-N 2.88Å; A423-A426 PolarHBondContact O-N 3.37Å; A426-S430 VanDerWaalsContact O-CB 3.24Å; A426-S430 WeakPolarHBondContact O-CB 3.32Å; A426-S430 PolarHBondContact O-N 3.2Å
427	I	84.7	Confident	80.5	Confident	5 Å²	5	51 Å²	51	3%	0.026	26%	0.26	C	S	.	.	H	α-helix	trans	-64.3	-47.4	174.1	-67.3	168.5	0	0	0	110.5	I256 Y263 L266 T267 I318 A423 S424 R425 S430 K431	I256-I427 HydrophobicContact CD1-CG2 4.1Å; Y263-I427 HydrophobicContact CD2-CD1 3.77Å; Y263-I427 HydrophobicContact CE2-CD1 3.83Å; L266-I427 HydrophobicContact CB-CD1 3.91Å; L266-I427 HydrophobicContact CB-CG1 3.7Å; L266-I427 HydrophobicContact CD1-CG1 4.48Å; L266-I427 HydrophobicContact CD1-CG2 3.85Å; T267-I427 HydrophobicContact CG2-CD1 3.9Å; I318-I427 HydrophobicContact CD1-CB 4.19Å; I318-I427 HydrophobicContact CD1-CD1 4.32Å; I318-I427 HydrophobicContact CD1-CG2 3.81Å; A423-I427 VanDerWaalsContact O-CG1 3.26Å; A423-I427 WeakPolarHBondContact O-CG1 3.26Å; A423-I427 PolarHBondContact O-N 3.19Å; S424-I427 PolarHBondContact O-N 3.46Å; R425-I427 VanDerWaalsContact C-N 3.31Å; R425-I427 PolarHBondContact O-N 3.11Å; I427-S430 PolarHBondContact O-N 3.03Å; I427-K431 WeakPolarHBondContact O-CB 3.11Å; I427-K431 WeakPolarHBondContact O-CG 3.38Å; I427-K431 PolarHBondContact O-N 3.11Å
428	L	86.9	Confident	81.9	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-62	-45.1	178	-179.6	60.4	0	0	0	111.2	L253 I256 I318 S424 R425 K431 S432	L253-L428 HydrophobicContact CD2-CD1 4.24Å; L253-L428 HydrophobicContact CG-CD1 4.21Å; I256-L428 HydrophobicContact CD1-CD1 4.21Å; I256-L428 HydrophobicContact CG1-CD1 4.03Å; I256-L428 HydrophobicContact CG2-CD1 3.98Å; I318-L428 HydrophobicContact CG2-CB 3.96Å; S424-L428 PolarHBondContact O-N 2.94Å; R425-L428 PolarHBondContact O-N 3.47Å; L428-K431 PolarHBondContact O-N 3.45Å; L428-S432 VanDerWaalsContact O-CB 3.29Å; L428-S432 WeakPolarHBondContact O-CB 3.5Å; L428-S432 PolarHBondContact O-N 3.34Å
429	D	85	Confident	83.2	Confident	61 Å²	61	44 Å²	44	33%	0.326	23%	0.229	S	C	.	.	H	α-helix	trans	-62.6	-45.3	178.5	-67.6	-20.3	0	0	0	110.7	R425 K431 S432 V433	R425-D429 WeakPolarHBondContact O-CB 3.41Å; R425-D429 VanDerWaalsContact O-CG 3.23Å; R425-D429 PolarHBondContact O-N 2.95Å; D429-K431 PolarHBondContact O-N 3.25Å; D429-S432 PolarHBondContact O-N 3.15Å; D429-S432 PolarHBondContact O-OG 3.06Å; D429-V433 WeakPolarHBondContact O-CG2 3.47Å; D429-V433 PolarHBondContact O-N 2.97Å
430	S	85.6	Confident	84.2	Confident	53 Å²	53	39.5 Å²	39.5	37%	0.371	21%	0.212	S	C	.	.	H	α-helix	trans	-59.2	-48.3	175.1	179.4	0	0	0	0	112.3	A426 I427 S432 V433 Q434	A426-S430 VanDerWaalsContact O-CB 3.24Å; A426-S430 WeakPolarHBondContact O-CB 3.32Å; A426-S430 PolarHBondContact O-N 3.2Å; I427-S430 PolarHBondContact O-N 3.03Å; S430-S432 VanDerWaalsContact C-N 3.32Å; S430-S432 PolarHBondContact O-N 3.02Å; S430-V433 PolarHBondContact O-N 3Å; S430-Q434 PolarHBondContact O-N 3.19Å
431	K	89.4	Confident	85.2	Confident	5 Å²	5	43.7 Å²	43.7	2%	0.022	23%	0.229	C	C	.	.	H	α-helix	trans	-68.9	-29.7	178	-72.4	-69.3	178.1	-179	0	112.7	L253 I256 I427 L428 D429 Q434 F435 L559 E560 L561	L253-K431 HydrophobicContact CD2-CB 4.47Å; I256-K431 HydrophobicContact CD1-CB 3.95Å; I256-K431 HydrophobicContact CD1-CG 3.98Å; I427-K431 WeakPolarHBondContact O-CB 3.11Å; I427-K431 WeakPolarHBondContact O-CG 3.38Å; I427-K431 PolarHBondContact O-N 3.11Å; L428-K431 PolarHBondContact O-N 3.45Å; D429-K431 PolarHBondContact O-N 3.25Å; K431-Q434 PolarHBondContact O-N 2.86Å; K431-F435 WeakPolarHBondContact O-CB 3.41Å; K431-F435 PolarHBondContact O-N 2.85Å; K431-L559 PolarHBondContact NZ-O 3.41Å; K431-E560 IonicContact NZ-OE2 2.67Å; K431-L561 HydrophobicContact CD-CD2 4.3Å; K431-L561 HydrophobicContact CG-CD2 4.45Å
432	S	89.5	Confident	85.7	Confident	7 Å²	7	45.3 Å²	45.3	5%	0.049	25%	0.246	C	C	.	.	H	α-helix	trans	-65.6	-43.5	173.1	79.3	0	0	0	0	111.3	L428 D429 S430 F435 Y436	L428-S432 VanDerWaalsContact O-CB 3.29Å; L428-S432 WeakPolarHBondContact O-CB 3.5Å; L428-S432 PolarHBondContact O-N 3.34Å; D429-S432 PolarHBondContact O-N 3.15Å; D429-S432 PolarHBondContact O-OG 3.06Å; S430-S432 VanDerWaalsContact C-N 3.32Å; S430-S432 PolarHBondContact O-N 3.02Å; S432-F435 WeakPolarHBondContact O-CB 3.35Å; S432-F435 PolarHBondContact O-N 3.26Å; S432-Y436 WeakPolarHBondContact O-CD2 3.41Å; S432-Y436 WeakPolarHBondContact O-CE2 3.47Å; S432-Y436 PolarHBondContact O-N 2.77Å
433	V	87.7	Confident	86.3	Confident	58 Å²	58	42.9 Å²	42.9	35%	0.352	25%	0.246	S	C	.	.	H	α-helix	trans	-65	-42.4	176.4	173.4	0	0	0	0	111	D429 S430 Y436 N437	D429-V433 WeakPolarHBondContact O-CG2 3.47Å; D429-V433 PolarHBondContact O-N 2.97Å; S430-V433 PolarHBondContact O-N 3Å; V433-Y436 PolarHBondContact O-N 3.14Å; V433-N437 WeakPolarHBondContact O-CB 3.35Å; V433-N437 VanDerWaalsContact O-CG 3.24Å; V433-N437 PolarHBondContact O-N 3.1Å; V433-N437 PolarHBondContact O-ND2 2.81Å
434	Q	91	Very high	86.9	Confident	77 Å²	77	42.4 Å²	42.4	36%	0.36	24%	0.242	S	C	.	.	H	α-helix	trans	-57	-50.6	172.4	-71.9	-178.6	12.3	0	0	110.8	S430 K431 Y436 N437 T438 L559	S430-Q434 PolarHBondContact O-N 3.19Å; K431-Q434 PolarHBondContact O-N 2.86Å; Q434-Y436 PolarHBondContact O-N 3.06Å; Q434-N437 PolarHBondContact O-N 2.84Å; Q434-T438 WeakPolarHBondContact O-CB 3.41Å; Q434-T438 PolarHBondContact O-N 3.45Å; Q434-T438 PolarHBondContact O-OG1 3.21Å; Q434-L559 HydrophobicContact CB-CD2 3.92Å
435	F	93.6	Very high	87.6	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-54.3	-50.1	177.2	169.3	-111.1	0	0	0	112.6	L253 K431 S432 N437 T438 V439 L550 L559 L566	L253-F435 HydrophobicContact CB-CD1 4.5Å; L253-F435 HydrophobicContact CD2-CB 4.47Å; K431-F435 WeakPolarHBondContact O-CB 3.41Å; K431-F435 PolarHBondContact O-N 2.85Å; S432-F435 WeakPolarHBondContact O-CB 3.35Å; S432-F435 PolarHBondContact O-N 3.26Å; F435-N437 PolarHBondContact O-N 2.86Å; F435-T438 PolarHBondContact O-N 2.78Å; F435-V439 HydrophobicContact CD2-CG2 4.14Å; F435-V439 HydrophobicContact CE2-CG2 3.76Å; F435-V439 HydrophobicContact CZ-CG2 4.03Å; F435-V439 WeakPolarHBondContact O-CG2 3.26Å; F435-V439 PolarHBondContact O-N 3.28Å; F435-L550 HydrophobicContact CE2-CD1 3.95Å; F435-L550 HydrophobicContact CZ-CD1 3.89Å; F435-L559 HydrophobicContact CB-CD1 3.86Å; F435-L559 HydrophobicContact CB-CD2 4.17Å; F435-L559 HydrophobicContact CD2-CD1 3.91Å; F435-L559 HydrophobicContact CG-CD1 4.3Å; F435-L566 HydrophobicContact CE1-CD2 4.44Å; F435-L566 HydrophobicContact CZ-CD2 4.32Å
436	Y	93	Very high	88.3	Confident	1 Å²	1	41.2 Å²	41.2	0%	0.004	25%	0.247	C	C	.	.	H	α-helix	trans	-65	-41.2	-179.3	-56.1	-44.1	0	0	0	112.4	Q252 L253 S432 V433 Q434 V439 L440 L467 S485 L487	Q252-Y436 WeakPolarHBondContact CA-OH 3.38Å; L253-Y436 PolarHBondContact N-OH 3.29Å; S432-Y436 WeakPolarHBondContact O-CD2 3.41Å; S432-Y436 WeakPolarHBondContact O-CE2 3.47Å; S432-Y436 PolarHBondContact O-N 2.77Å; V433-Y436 PolarHBondContact O-N 3.14Å; Q434-Y436 PolarHBondContact O-N 3.06Å; Y436-V439 PolarHBondContact O-N 2.68Å; Y436-L440 WeakPolarHBondContact O-CB 3.14Å; Y436-L440 VanDerWaalsContact O-CG 3.23Å; Y436-L440 WeakPolarHBondContact O-CG 3.48Å; Y436-L440 PolarHBondContact O-N 3.23Å; Y436-L467 HydrophobicContact CD2-CD1 3.52Å; Y436-L467 HydrophobicContact CE2-CD1 4.22Å; Y436-L467 HydrophobicContact CG-CD1 3.71Å; Y436-S485 VanDerWaalsContact CE2-O 3.23Å; Y436-S485 WeakPolarHBondContact CE2-O 3.41Å; Y436-S485 VanDerWaalsContact CZ-O 3.3Å; Y436-S485 PolarHBondContact OH-O 2.81Å; Y436-L487 HydrophobicContact CD1-CB 3.8Å; Y436-L487 HydrophobicContact CD1-CD1 4.48Å; Y436-L487 HydrophobicContact CE1-CB 3.99Å
437	N	91.4	Very high	88.9	Confident	89 Å²	89	42 Å²	42	48%	0.476	24%	0.239	S	C	.	.	H	α-helix	trans	-64.3	-42.1	177.9	-71.2	-20.8	0	0	0	111.5	V433 Q434 F435 V439 L440 E441	V433-N437 WeakPolarHBondContact O-CB 3.35Å; V433-N437 VanDerWaalsContact O-CG 3.24Å; V433-N437 PolarHBondContact O-N 3.1Å; V433-N437 PolarHBondContact O-ND2 2.81Å; Q434-N437 PolarHBondContact O-N 2.84Å; F435-N437 PolarHBondContact O-N 2.86Å; N437-V439 VanDerWaalsContact C-N 3.31Å; N437-V439 PolarHBondContact O-N 2.83Å; N437-L440 PolarHBondContact O-N 2.87Å; N437-L440 VanDerWaalsContact O-N 3.14Å; N437-E441 PolarHBondContact O-N 3.18Å
438	T	91.9	Very high	89.2	Confident	27 Å²	27	44.6 Å²	44.6	17%	0.166	25%	0.253	C	S	.	.	H	α-helix	trans	-63.6	-36.1	176.2	-55.3	0	0	0	0	111.9	Q434 F435 S444 L446	Q434-T438 WeakPolarHBondContact O-CB 3.41Å; Q434-T438 PolarHBondContact O-N 3.45Å; Q434-T438 PolarHBondContact O-OG1 3.21Å; F435-T438 PolarHBondContact O-N 2.78Å; T438-S444 WeakPolarHBondContact O-CB 3.44Å; T438-S444 PolarHBondContact O-OG 2.88Å; T438-L446 HydrophobicContact CG2-CD1 3.81Å; T438-L446 HydrophobicContact CG2-CG 4.48Å
439	V	92.1	Very high	89.5	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-71.2	-32.4	174	175.8	0	0	0	0	111.9	F435 Y436 N437 L446 R447 I450 L487	F435-V439 HydrophobicContact CD2-CG2 4.14Å; F435-V439 HydrophobicContact CE2-CG2 3.76Å; F435-V439 HydrophobicContact CZ-CG2 4.03Å; F435-V439 WeakPolarHBondContact O-CG2 3.26Å; F435-V439 PolarHBondContact O-N 3.28Å; Y436-V439 PolarHBondContact O-N 2.68Å; N437-V439 VanDerWaalsContact C-N 3.31Å; N437-V439 PolarHBondContact O-N 2.83Å; V439-L446 HydrophobicContact CG2-CB 3.91Å; V439-L446 HydrophobicContact CG2-CD1 4.1Å; V439-R447 HydrophobicContact CG1-CB 4.44Å; V439-R447 WeakPolarHBondContact O-CB 3.29Å; V439-I450 HydrophobicContact CG1-CD1 3.82Å; V439-I450 HydrophobicContact CG2-CD1 4.3Å; V439-L487 HydrophobicContact CB-CD2 4.35Å; V439-L487 HydrophobicContact CG1-CD1 4.27Å; V439-L487 HydrophobicContact CG1-CD2 3.64Å
440	L	90.5	Very high	89.9	Confident	48 Å²	48	42.7 Å²	42.7	25%	0.251	25%	0.245	S	C	.	.	H	α-helix	trans	-86	-7.9	-178.3	-66.9	173.1	0	0	0	114	Y436 N437 C465 L467 L487	Y436-L440 WeakPolarHBondContact O-CB 3.14Å; Y436-L440 VanDerWaalsContact O-CG 3.23Å; Y436-L440 WeakPolarHBondContact O-CG 3.48Å; Y436-L440 PolarHBondContact O-N 3.23Å; N437-L440 PolarHBondContact O-N 2.87Å; N437-L440 VanDerWaalsContact O-N 3.14Å; L440-C465 HydrophobicContact CD2-CB 4.3Å; L440-C465 WeakPolarHBondContact CD2-O 3.21Å; L440-L467 HydrophobicContact CD1-CB 3.85Å; L440-L487 HydrophobicContact CD1-CD1 4.4Å; L440-L487 HydrophobicContact CD2-CD1 3.97Å; L440-L487 HydrophobicContact CG-CD1 4.08Å
441	E	89.2	Confident	90.2	Very high	126 Å²	126	41.3 Å²	41.3	59%	0.589	24%	0.235	S	C	*	.	S	Bend	trans	-63.3	142.8	175.6	-166.2	171	-170.4	0	0	111.5	N437 G443 S444	N437-E441 PolarHBondContact O-N 3.18Å; E441-G443 PolarHBondContact O-N 3.28Å; E441-S444 WeakPolarHBondContact O-CB 3.41Å; E441-S444 PolarHBondContact O-N 2.77Å
442	N	78.7	Confident	90.4	Very high	147 Å²	147	46.1 Å²	46.1	79%	0.786	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	133.1	177.6	-67.2	-26.7	0	0	0	109.8	S444	N442-S444 VanDerWaalsContact C-N 3.25Å; N442-S444 PolarHBondContact O-N 3.38Å
443	G	81.9	Confident	90.6	Very high	49 Å²	49	47.3 Å²	47.3	51%	0.505	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.3	17.3	-175.3	0	0	0	0	0	114.3	E211 E441 A445	E211-G443 WeakPolarHBondContact OE1-CA 3.47Å; E441-G443 PolarHBondContact O-N 3.28Å; G443-A445 PolarHBondContact O-N 3.04Å
444	S	88	Confident	90.9	Very high	9 Å²	9	44.5 Å²	44.5	6%	0.063	24%	0.242	C	C	.	.			trans	-63.7	118.1	177.7	176.5	0	0	0	0	111.8	T438 E441 N442 L446 R447 D448	T438-S444 WeakPolarHBondContact O-CB 3.44Å; T438-S444 PolarHBondContact O-OG 2.88Å; E441-S444 WeakPolarHBondContact O-CB 3.41Å; E441-S444 PolarHBondContact O-N 2.77Å; N442-S444 VanDerWaalsContact C-N 3.25Å; N442-S444 PolarHBondContact O-N 3.38Å; S444-L446 PolarHBondContact O-N 3.08Å; S444-L446 VanDerWaalsContact O-N 3.14Å; S444-L446 PolarHBondContact OG-N 3.22Å; S444-R447 WeakPolarHBondContact O-CB 3.29Å; S444-R447 PolarHBondContact O-N 3.18Å; S444-R447 PolarHBondContact OG-N 3.28Å; S444-D448 PolarHBondContact O-N 3.21Å
445	A	90.7	Very high	91	Very high	50 Å²	50	42.4 Å²	42.4	41%	0.413	23%	0.232	S	C	.	.	H	α-helix	trans	-57.8	-27.7	172.1	0	0	0	0	0	112.7	G443 A449	G443-A445 PolarHBondContact O-N 3.04Å; A445-A449 VanDerWaalsContact O-CB 3.29Å; A445-A449 WeakPolarHBondContact O-CB 3.26Å; A445-A449 PolarHBondContact O-N 3.45Å
446	L	92.6	Very high	90.8	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-71.5	-41.7	176.1	-58.3	-171	0	0	0	111.3	T438 V439 S444 A449 I450 L550 A553 A555	T438-L446 HydrophobicContact CG2-CD1 3.81Å; T438-L446 HydrophobicContact CG2-CG 4.48Å; V439-L446 HydrophobicContact CG2-CB 3.91Å; V439-L446 HydrophobicContact CG2-CD1 4.1Å; S444-L446 PolarHBondContact O-N 3.08Å; S444-L446 VanDerWaalsContact O-N 3.14Å; S444-L446 PolarHBondContact OG-N 3.22Å; L446-A449 PolarHBondContact O-N 2.83Å; L446-I450 WeakPolarHBondContact O-CG1 3.3Å; L446-I450 PolarHBondContact O-N 3.14Å; L446-L550 HydrophobicContact CB-CD2 3.84Å; L446-L550 HydrophobicContact CD2-CD2 3.99Å; L446-L550 HydrophobicContact CG-CD2 4.35Å; L446-A553 HydrophobicContact CD2-CB 3.76Å; L446-A555 HydrophobicContact CD1-CB 4.13Å; L446-A555 HydrophobicContact CD2-CB 3.82Å
447	R	92.6	Very high	90.7	Very high	71 Å²	71	50.9 Å²	50.9	27%	0.268	28%	0.279	S	S	.	.	H	α-helix	trans	-60.6	-48.1	174.8	-169.8	178.7	174.7	174.4	0.5	110.8	V439 S444 A449 I450 V451	V439-R447 HydrophobicContact CG1-CB 4.44Å; V439-R447 WeakPolarHBondContact O-CB 3.29Å; S444-R447 WeakPolarHBondContact O-CB 3.29Å; S444-R447 PolarHBondContact O-N 3.18Å; S444-R447 PolarHBondContact OG-N 3.28Å; R447-A449 VanDerWaalsContact C-N 3.28Å; R447-A449 PolarHBondContact O-N 3.14Å; R447-I450 PolarHBondContact O-N 3.05Å; R447-V451 HydrophobicContact CG-CG2 4.41Å; R447-V451 VanDerWaalsContact O-CG2 3.3Å; R447-V451 WeakPolarHBondContact O-CG2 3.17Å; R447-V451 PolarHBondContact O-N 3.15Å
448	D	91.8	Very high	90.5	Very high	59 Å²	59	47.3 Å²	47.3	32%	0.316	26%	0.261	S	S	.	.	H	α-helix	trans	-61.8	-39.4	179.6	-70.3	-15.3	0	0	0	111.5	S444 V451 K452	S444-D448 PolarHBondContact O-N 3.21Å; D448-V451 PolarHBondContact O-N 2.78Å; D448-K452 WeakPolarHBondContact O-CB 3.31Å; D448-K452 PolarHBondContact O-N 3.48Å
449	A	92.7	Very high	90.4	Very high	17 Å²	17	47.8 Å²	47.8	14%	0.14	27%	0.271	C	S	.	.	H	α-helix	trans	-64.2	-43.3	175.9	0	0	0	0	0	112.4	A445 L446 R447 Y453 V549 A553	A445-A449 VanDerWaalsContact O-CB 3.29Å; A445-A449 WeakPolarHBondContact O-CB 3.26Å; A445-A449 PolarHBondContact O-N 3.45Å; L446-A449 PolarHBondContact O-N 2.83Å; R447-A449 VanDerWaalsContact C-N 3.28Å; R447-A449 PolarHBondContact O-N 3.14Å; A449-Y453 WeakPolarHBondContact O-CB 3.24Å; A449-Y453 PolarHBondContact O-N 2.77Å; A449-V549 HydrophobicContact CB-CG1 3.73Å; A449-V549 WeakPolarHBondContact O-CG1 3.33Å; A449-A553 HydrophobicContact CB-CB 3.62Å
450	I	93.5	Very high	90.4	Very high	4 Å²	4	47.9 Å²	47.9	2%	0.021	27%	0.272	C	S	.	.	H	α-helix	trans	-61.8	-50.8	174.8	-68.5	165.9	0	0	0	110.3	V439 L446 R447 K452 Y453 L454 L487 L550	V439-I450 HydrophobicContact CG1-CD1 3.82Å; V439-I450 HydrophobicContact CG2-CD1 4.3Å; L446-I450 WeakPolarHBondContact O-CG1 3.3Å; L446-I450 PolarHBondContact O-N 3.14Å; R447-I450 PolarHBondContact O-N 3.05Å; I450-K452 PolarHBondContact O-N 3.08Å; I450-Y453 PolarHBondContact O-N 3.45Å; I450-L454 HydrophobicContact CG2-CD1 3.66Å; I450-L454 HydrophobicContact CG2-CG 4.41Å; I450-L454 WeakPolarHBondContact O-CB 3.4Å; I450-L454 WeakPolarHBondContact O-CG 3.36Å; I450-L454 PolarHBondContact O-N 3.2Å; I450-L487 HydrophobicContact CD1-CD2 4.2Å; I450-L550 HydrophobicContact CD1-CD1 4.44Å; I450-L550 HydrophobicContact CD1-CD2 4Å; I450-L550 HydrophobicContact CG1-CD1 4.46Å; I450-L550 HydrophobicContact CG1-CD2 3.88Å; I450-L550 HydrophobicContact CG1-CG 4.33Å
451	V	92.8	Very high	90.4	Very high	24 Å²	24	49 Å²	49	15%	0.145	28%	0.278	C	S	.	.	H	α-helix	trans	-59.5	-49.7	-179.4	172.1	0	0	0	0	110.2	R447 D448 Y453 L454 E455 V462	R447-V451 HydrophobicContact CG-CG2 4.41Å; R447-V451 VanDerWaalsContact O-CG2 3.3Å; R447-V451 WeakPolarHBondContact O-CG2 3.17Å; R447-V451 PolarHBondContact O-N 3.15Å; D448-V451 PolarHBondContact O-N 2.78Å; V451-Y453 VanDerWaalsContact C-N 3.34Å; V451-Y453 PolarHBondContact O-N 3.28Å; V451-L454 PolarHBondContact O-N 3.16Å; V451-E455 HydrophobicContact CG1-CG 4.07Å; V451-E455 WeakPolarHBondContact O-CB 3.29Å; V451-E455 WeakPolarHBondContact O-CG 3.24Å; V451-E455 PolarHBondContact O-N 2.93Å; V451-V462 HydrophobicContact CG1-CB 4.33Å; V451-V462 HydrophobicContact CG2-CB 4.23Å; V451-V462 HydrophobicContact CG2-CG1 4Å
452	K	92.2	Very high	90.5	Very high	105 Å²	105	43.3 Å²	43.3	46%	0.457	25%	0.252	S	S	.	.	H	α-helix	trans	-59.5	-44	179.8	-174.6	175.4	-178.4	171.5	0	112.1	D448 I450 Q456	D448-K452 WeakPolarHBondContact O-CB 3.31Å; D448-K452 PolarHBondContact O-N 3.48Å; I450-K452 PolarHBondContact O-N 3.08Å; K452-Q456 HydrophobicContact CG-CG 4.23Å; K452-Q456 VanDerWaalsContact CG-OE1 3.28Å; K452-Q456 WeakPolarHBondContact O-CB 3.46Å; K452-Q456 VanDerWaalsContact O-CG 3.31Å; K452-Q456 WeakPolarHBondContact O-CG 3.41Å; K452-Q456 PolarHBondContact O-N 3.34Å
453	Y	94.4	Very high	90.8	Very high	32 Å²	32	37.2 Å²	37.2	13%	0.125	22%	0.219	C	C	.	.	H	α-helix	trans	-63.3	-47.7	177.7	175.3	-95.7	0	0	0	111.8	A449 I450 V451 S457 S458 L542 D545 L546 V549	A449-Y453 WeakPolarHBondContact O-CB 3.24Å; A449-Y453 PolarHBondContact O-N 2.77Å; I450-Y453 PolarHBondContact O-N 3.45Å; V451-Y453 VanDerWaalsContact C-N 3.34Å; V451-Y453 PolarHBondContact O-N 3.28Å; Y453-S457 WeakPolarHBondContact O-CA 3.14Å; Y453-S457 WeakPolarHBondContact O-CB 3.39Å; Y453-S457 PolarHBondContact O-N 3.44Å; Y453-S457 PolarHBondContact O-OG 2.69Å; Y453-S458 PolarHBondContact O-N 2.71Å; Y453-L542 HydrophobicContact CE1-CD1 3.64Å; Y453-D545 HydrophobicContact CE1-CB 4.47Å; Y453-D545 HydrophobicContact CE2-CB 4.05Å; Y453-D545 WeakPolarHBondContact OH-CB 3.36Å; Y453-D545 PolarHBondContact OH-OD2 3Å; Y453-L546 HydrophobicContact CD1-CD2 3.52Å; Y453-L546 HydrophobicContact CD1-CG 4.15Å; Y453-L546 HydrophobicContact CE1-CD2 4.04Å; Y453-L546 HydrophobicContact CE1-CG 4.16Å; Y453-L546 HydrophobicContact CG-CD2 4.27Å; Y453-V549 HydrophobicContact CD2-CG2 3.61Å; Y453-V549 HydrophobicContact CE2-CG2 4.29Å; Y453-V549 HydrophobicContact CG-CG2 3.96Å
454	L	94	Very high	91	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.208	C	C	.	.	I	π-helix	trans	-66.8	-45.1	-179	-68.3	172.1	0	0	0	111.8	L249 I450 V451 S458 G459 V460 V462 V489 L491	L249-L454 HydrophobicContact CD2-CD1 4.18Å; L249-L454 HydrophobicContact CD2-CD2 4.09Å; I450-L454 HydrophobicContact CG2-CD1 3.66Å; I450-L454 HydrophobicContact CG2-CG 4.41Å; I450-L454 WeakPolarHBondContact O-CB 3.4Å; I450-L454 WeakPolarHBondContact O-CG 3.36Å; I450-L454 PolarHBondContact O-N 3.2Å; V451-L454 PolarHBondContact O-N 3.16Å; L454-S458 CarbonylContact O-C 3.53Å; L454-S458 WeakPolarHBondContact O-CA 3.18Å; L454-S458 VanDerWaalsContact O-CB 3.26Å; L454-S458 WeakPolarHBondContact O-CB 3.5Å; L454-S458 PolarHBondContact O-N 3Å; L454-G459 PolarHBondContact O-N 3.11Å; L454-V460 HydrophobicContact CB-CG2 3.9Å; L454-V460 WeakPolarHBondContact O-CG2 3.26Å; L454-V460 PolarHBondContact O-N 3.28Å; L454-V462 HydrophobicContact CB-CG2 3.72Å; L454-V462 HydrophobicContact CD1-CG2 3.88Å; L454-V462 HydrophobicContact CG-CG2 4.47Å; L454-V489 HydrophobicContact CD1-CG1 4.07Å; L454-L491 HydrophobicContact CD1-CD2 3.93Å
455	E	93.3	Very high	90.9	Very high	33 Å²	33	37.4 Å²	37.4	15%	0.154	21%	0.209	C	C	.	.	I	π-helix	trans	-68.5	-44.4	179.3	-63.2	-158.6	152	0	0	112.8	R205 V451 V460 V462	R205-E455 IonicContact NH1-OE1 3.41Å; R205-E455 PolarHBondContact NH1-OE1 3.38Å; R205-E455 IonicContact NH1-OE2 2.72Å; R205-E455 PolarHBondContact NH1-OE2 2.96Å; R205-E455 VanDerWaalsContact NH1-OE2 3.12Å; V451-E455 HydrophobicContact CG1-CG 4.07Å; V451-E455 WeakPolarHBondContact O-CB 3.29Å; V451-E455 WeakPolarHBondContact O-CG 3.24Å; V451-E455 PolarHBondContact O-N 2.93Å; E455-V460 WeakPolarHBondContact CA-O 3.35Å; E455-V460 WeakPolarHBondContact CG-O 3.29Å; E455-V462 HydrophobicContact CG-CG2 4.17Å; E455-V462 PolarHBondContact OE1-N 2.82Å
456	Q	90.1	Very high	90.8	Very high	111 Å²	111	37.8 Å²	37.8	52%	0.519	20%	0.201	S	C	.	.	I	π-helix	trans	-88.9	-36	-173.3	-59.4	-177.4	-14.7	0	0	113.5	K452	K452-Q456 HydrophobicContact CG-CG 4.23Å; K452-Q456 VanDerWaalsContact CG-OE1 3.28Å; K452-Q456 WeakPolarHBondContact O-CB 3.46Å; K452-Q456 VanDerWaalsContact O-CG 3.31Å; K452-Q456 WeakPolarHBondContact O-CG 3.41Å; K452-Q456 PolarHBondContact O-N 3.34Å
457	S	89.5	Confident	90.6	Very high	68 Å²	68	41.4 Å²	41.4	48%	0.476	22%	0.22	S	C	.	.	I	π-helix	trans	-99.2	-38.7	-174.3	-48.5	0	0	0	0	112.3	Y453	Y453-S457 WeakPolarHBondContact O-CA 3.14Å; Y453-S457 WeakPolarHBondContact O-CB 3.39Å; Y453-S457 PolarHBondContact O-N 3.44Å; Y453-S457 PolarHBondContact O-OG 2.69Å
458	S	88.8	Confident	90	Very high	13 Å²	13	38.8 Å²	38.8	9%	0.091	22%	0.215	C	C	.	.	I	π-helix	trans	-89.7	-20.2	179	-52.2	0	0	0	0	113	Y453 L454 I498	Y453-S458 PolarHBondContact O-N 2.71Å; L454-S458 CarbonylContact O-C 3.53Å; L454-S458 WeakPolarHBondContact O-CA 3.18Å; L454-S458 VanDerWaalsContact O-CB 3.26Å; L454-S458 WeakPolarHBondContact O-CB 3.5Å; L454-S458 PolarHBondContact O-N 3Å; S458-I498 WeakPolarHBondContact O-CG2 3.44Å
459	G	88.9	Confident	89.2	Confident	37 Å²	37	44.5 Å²	44.5	38%	0.381	23%	0.232	S	C	.	.			trans	76.3	24.3	178.3	0	0	0	0	0	114.1	L454	L454-G459 PolarHBondContact O-N 3.11Å
460	V	92.3	Very high	87.9	Confident	2 Å²	2	45.5 Å²	45.5	1%	0.012	23%	0.233	C	C	.	.			trans	-111	148.9	179.1	-63	0	0	0	0	110.6	L454 E455 L491 A493 I498	L454-V460 HydrophobicContact CB-CG2 3.9Å; L454-V460 WeakPolarHBondContact O-CG2 3.26Å; L454-V460 PolarHBondContact O-N 3.28Å; E455-V460 WeakPolarHBondContact CA-O 3.35Å; E455-V460 WeakPolarHBondContact CG-O 3.29Å; V460-L491 HydrophobicContact CB-CB 4.43Å; V460-L491 HydrophobicContact CG2-CB 4.47Å; V460-L491 HydrophobicContact CG2-CD1 4.17Å; V460-L491 HydrophobicContact CG2-CD2 4.08Å; V460-L491 HydrophobicContact CG2-CG 4.48Å; V460-A493 HydrophobicContact CG1-CB 4.2Å; V460-I498 HydrophobicContact CG1-CG2 3.54Å
461	L	91.4	Very high	86.2	Confident	72 Å²	72	47.7 Å²	47.7	38%	0.377	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	129.3	173.5	-67.4	172.9	0	0	0	110.3	L491 I492	L461-L491 CarbonylContact O-C 3.48Å; L461-L491 WeakPolarHBondContact O-CA 3.12Å; L461-I492 HydrophobicContact CB-CB 4.48Å; L461-I492 PolarHBondContact N-O 3.22Å; L461-I492 PolarHBondContact O-N 3.26Å
462	V	90.6	Very high	84.2	Confident	7 Å²	7	49.8 Å²	49.8	4%	0.042	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	110.6	177.2	-178.9	0	0	0	0	109.4	R221 V451 L454 E455 V489 L491	R221-V462 PolarHBondContact NH2-O 2.9Å; V451-V462 HydrophobicContact CG1-CB 4.33Å; V451-V462 HydrophobicContact CG2-CB 4.23Å; V451-V462 HydrophobicContact CG2-CG1 4Å; L454-V462 HydrophobicContact CB-CG2 3.72Å; L454-V462 HydrophobicContact CD1-CG2 3.88Å; L454-V462 HydrophobicContact CG-CG2 4.47Å; E455-V462 HydrophobicContact CG-CG2 4.17Å; E455-V462 PolarHBondContact OE1-N 2.82Å; V462-V489 HydrophobicContact CG1-CG1 3.52Å; V462-V489 HydrophobicContact CG2-CG1 4.41Å; V462-L491 HydrophobicContact CB-CD2 4.5Å; V462-L491 HydrophobicContact CG2-CD2 3.8Å
463	L	85.5	Confident	81.5	Confident	19 Å²	19	51 Å²	51	10%	0.099	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	-53	179.7	-66.9	-171.7	0	0	0	112.1	R221 I222 I490 I492	R221-L463 PolarHBondContact NH1-O 3.24Å; I222-L463 HydrophobicContact CG2-CD1 4.21Å; L463-I490 HydrophobicContact CB-CB 4.31Å; L463-I490 HydrophobicContact CB-CG2 4.22Å; L463-I490 HydrophobicContact CD1-CG2 4.05Å; L463-I490 PolarHBondContact N-O 2.92Å; L463-I492 HydrophobicContact CD1-CD1 3.56Å; L463-I492 HydrophobicContact CD1-CG1 3.78Å; L463-I492 HydrophobicContact CD2-CD1 4.04Å; L463-I492 HydrophobicContact CD2-CG1 4.43Å; L463-I492 HydrophobicContact CG-CD1 4.01Å; L463-I492 HydrophobicContact CG-CG1 4Å
464	D	85.1	Confident	78.5	Confident	51 Å²	51	56.6 Å²	56.6	27%	0.273	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	159.8	-170.7	-165.3	18.9	0	0	0	110.8	P224 I490	P224-D464 HydrophobicContact CG-CB 4.33Å; D464-I490 HydrophobicContact CB-CB 4.5Å; D464-I490 HydrophobicContact CB-CD1 4.2Å; D464-I490 HydrophobicContact CB-CG1 4.49Å; D464-I490 PolarHBondContact O-N 3.37Å
465	C	86	Confident	75.3	Confident	11 Å²	11	64.7 Å²	64.7	7%	0.074	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	122.1	177.6	-169.5	0	0	0	0	107.8	L440 L487 C488	L440-C465 HydrophobicContact CD2-CB 4.3Å; L440-C465 WeakPolarHBondContact CD2-O 3.21Å; C465-L487 WeakPolarHBondContact SG-CD1 3.38Å; C465-L487 VanDerWaalsContact SG-CG 3.55Å; C465-C488 WeakPolarHBondContact CA-O 3.44Å
466	K	88.7	Confident	72.3	Confident	58 Å²	58	67.5 Å²	67.5	25%	0.252	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	154	-175.9	66	-176.2	-179.7	-179.8	0	111.5	C488	K466-C488 HydrophobicContact CG-CB 3.95Å; K466-C488 PolarHBondContact N-O 3.42Å; K466-C488 PolarHBondContact O-N 2.91Å
467	L	88.2	Confident	69.6	Low	75 Å²	75	69.1 Å²	69.1	39%	0.393	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	124.7	168.5	-171.7	60	0	0	0	109.1	Y436 L440	Y436-L467 HydrophobicContact CD2-CD1 3.52Å; Y436-L467 HydrophobicContact CE2-CD1 4.22Å; Y436-L467 HydrophobicContact CG-CD1 3.71Å; L440-L467 HydrophobicContact CD1-CB 3.85Å
468	G	79.8	Confident	66.8	Low	16 Å²	16	74.1 Å²	74.1	17%	0.165	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	175.2	175.2	0	0	0	0	0	111.7	S485 A486	G468-S485 WeakPolarHBondContact O-CA 3.47Å; G468-A486 PolarHBondContact N-O 2.83Å; G468-A486 PolarHBondContact O-N 3.27Å; G468-A486 VanDerWaalsContact O-O 3.06Å
469	R	74.8	Confident	64.3	Low	180 Å²	180	81.8 Å²	81.8	68%	0.679	44%	0.436	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.2	117.1	171.6	-75.1	-174.2	-177.4	174.9	2.5	107.9
470	F	66.8	Low	61.8	Low	37 Å²	37	84.1 Å²	84.1	16%	0.162	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	118.1	176.5	-173.5	-108.7	0	0	0	108.8	W250 Q472 V484 A486 T569	W250-F470 HydrophobicContact CB-CD2 4.1Å; W250-F470 HydrophobicContact CB-CE2 4.39Å; W250-F470 HydrophobicContact CB-CG 4.47Å; W250-F470 AromaticContact CD1-CD2 3.86Å; W250-F470 AromaticContact CD1-CE2 3.84Å; W250-F470 HydrophobicContact CD2-CB 4.26Å; W250-F470 AromaticContact CD2-CD2 3.56Å; W250-F470 HydrophobicContact CD2-CD2 3.56Å; W250-F470 HydrophobicContact CD2-CE2 4.32Å; W250-F470 HydrophobicContact CD2-CG 4.25Å; W250-F470 AromaticContact CE2-CD2 3.84Å; W250-F470 HydrophobicContact CE3-CB 3.85Å; W250-F470 HydrophobicContact CE3-CD2 4.04Å; W250-F470 HydrophobicContact CE3-CG 4.33Å; W250-F470 AromaticContact CG-CD2 3.57Å; W250-F470 HydrophobicContact CG-CD2 3.57Å; W250-F470 AromaticContact CG-CE2 3.93Å; W250-F470 HydrophobicContact CG-CE2 3.93Å; W250-F470 HydrophobicContact CG-CG 4.32Å; W250-F470 HydrophobicContact CZ3-CB 4.19Å; F470-Q472 HydrophobicContact CD1-CB 4.03Å; F470-Q472 HydrophobicContact CE1-CB 3.78Å; F470-Q472 HydrophobicContact CE1-CG 3.93Å; F470-Q472 PolarHBondContact O-N 2.68Å; F470-V484 PolarHBondContact N-O 2.96Å; F470-V484 PolarHBondContact O-N 3.39Å; F470-V484 VanDerWaalsContact O-N 3.16Å; F470-A486 HydrophobicContact CB-CB 3.97Å; F470-T569 WeakPolarHBondContact CZ-OG1 3.07Å
471	S	56.4	Low	59.4	Low	50 Å²	50	88.1 Å²	88.1	35%	0.35	48%	0.477	S	S	.	.			trans	-89.7	95.4	170.5	-67	0	0	0	0	108	T473	S471-T473 PolarHBondContact O-N 3.44Å; S471-T473 VanDerWaalsContact O-N 3.14Å
472	Q	50.6	Low	57.6	Low	68 Å²	68	90.9 Å²	90.9	32%	0.318	49%	0.488	S	S	.	.			trans	-70.3	111.1	173.8	-162.2	161.6	17.6	0	0	108.3	F470 F474	F470-Q472 HydrophobicContact CD1-CB 4.03Å; F470-Q472 HydrophobicContact CE1-CB 3.78Å; F470-Q472 HydrophobicContact CE1-CG 3.93Å; F470-Q472 PolarHBondContact O-N 2.68Å; Q472-F474 HydrophobicContact CB-CD2 4.03Å; Q472-F474 HydrophobicContact CB-CE2 3.96Å; Q472-F474 HydrophobicContact CG-CD2 3.75Å; Q472-F474 HydrophobicContact CG-CE1 4.47Å; Q472-F474 HydrophobicContact CG-CE2 3.48Å; Q472-F474 VanDerWaalsContact CG-CE2 3.48Å; Q472-F474 HydrophobicContact CG-CG 4.38Å; Q472-F474 HydrophobicContact CG-CZ 3.87Å; Q472-F474 PolarHBondContact O-N 2.77Å; Q472-F474 VanDerWaalsContact OE1-CZ 3.3Å
473	T	36.1	Very low	56.1	Low	132 Å²	132	93 Å²	93	81%	0.81	50%	0.503	S	S	*	.			trans	-72.1	76.4	170.9	42.3	0	0	0	0	108.8	S471 N475	S471-T473 PolarHBondContact O-N 3.44Å; S471-T473 VanDerWaalsContact O-N 3.14Å; T473-N475 PolarHBondContact O-N 2.69Å
474	F	32.1	Very low	55.3	Low	149 Å²	149	93.6 Å²	93.6	65%	0.654	51%	0.507	S	S	*	.			trans	-69.2	114.6	163.2	-77.4	-71	0	0	0	108.2	Q472 S476	Q472-F474 HydrophobicContact CB-CD2 4.03Å; Q472-F474 HydrophobicContact CB-CE2 3.96Å; Q472-F474 HydrophobicContact CG-CD2 3.75Å; Q472-F474 HydrophobicContact CG-CE1 4.47Å; Q472-F474 HydrophobicContact CG-CE2 3.48Å; Q472-F474 VanDerWaalsContact CG-CE2 3.48Å; Q472-F474 HydrophobicContact CG-CG 4.38Å; Q472-F474 HydrophobicContact CG-CZ 3.87Å; Q472-F474 PolarHBondContact O-N 2.77Å; Q472-F474 VanDerWaalsContact OE1-CZ 3.3Å; F474-S476 PolarHBondContact O-N 3.47Å
475	N	26.9	Very low	55.1	Low	170 Å²	170	93 Å²	93	91%	0.909	51%	0.508	S	S	*	.	S	Bend	trans	-63.2	86.8	164.4	-100.7	-11.8	0	0	0	109.2	T473	T473-N475 PolarHBondContact O-N 2.69Å
476	S	30.3	Very low	55.2	Low	91 Å²	91	92.6 Å²	92.6	64%	0.636	51%	0.505	S	S	*	.	S	Bend	trans	-177.7	117.2	147	57.8	0	0	0	0	111.3	F474	F474-S476 PolarHBondContact O-N 3.47Å
477	N	33.3	Very low	55.2	Low	146 Å²	146	89.8 Å²	89.8	78%	0.781	49%	0.493	S	S	*	.	S	Bend	trans	65.7	95.3	154.2	-59.9	-10	0	0	0	118.9	M479	N477-M479 PolarHBondContact O-N 3.26Å
478	N	31.2	Very low	55.4	Low	172 Å²	172	86.3 Å²	86.3	92%	0.92	47%	0.474	S	S	*	.	S	Bend	trans	46.5	12.7	137.7	-76.3	4.2	0	0	0	121.6
479	M	35.8	Very low	56	Low	175 Å²	175	85.6 Å²	85.6	86%	0.862	47%	0.467	S	S	*	.	S	Bend	trans	-107.7	132.2	166.4	-71.5	-67.5	169.3	0	0	108.7	N477	N477-M479 PolarHBondContact O-N 3.26Å
480	A	35.2	Very low	56.7	Low	85 Å²	85	77.1 Å²	77.1	70%	0.702	44%	0.435	S	S	*	.			trans	-48.7	138.7	-178.3	0	0	0	0	0	110.4	E482	A480-E482 PolarHBondContact O-N 2.93Å
481	P	42.7	Very low	58	Low	86 Å²	86	75.4 Å²	75.4	56%	0.558	43%	0.427	S	S	*	.			trans	-59	110.1	-179	23.2	-32	0	0	0	109.1	S483	P481-S483 PolarHBondContact O-N 2.94Å
482	E	52.9	Low	59.6	Low	130 Å²	130	73.9 Å²	73.9	61%	0.607	42%	0.415	S	S	*	.			trans	-63.2	107.2	170.1	-78	-173.5	173.9	0	0	107.3	R425 A480 V484	R425-E482 IonicContact NH2-OE2 2.75Å; R425-E482 PolarHBondContact NH2-OE2 3.28Å; A480-E482 PolarHBondContact O-N 2.93Å; E482-V484 PolarHBondContact O-N 3.39Å
483	S	60.7	Low	61.6	Low	52 Å²	52	70.7 Å²	70.7	36%	0.364	40%	0.401	S	S	.	.			trans	-71.1	112.1	176.6	65.2	0	0	0	0	108.7	P481	P481-S483 PolarHBondContact O-N 2.94Å
484	V	68.8	Low	64	Low	31 Å²	31	69.1 Å²	69.1	19%	0.188	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	139	177	-170.5	0	0	0	0	109.2	Q252 F470 E482 A486	Q252-V484 HydrophobicContact CG-CG1 4.49Å; Q252-V484 VanDerWaalsContact NE2-CG1 3.33Å; F470-V484 PolarHBondContact N-O 2.96Å; F470-V484 PolarHBondContact O-N 3.39Å; F470-V484 VanDerWaalsContact O-N 3.16Å; E482-V484 PolarHBondContact O-N 3.39Å; V484-A486 PolarHBondContact O-N 3.4Å
485	S	80	Confident	66.7	Low	40 Å²	40	66.4 Å²	66.4	28%	0.28	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	127.2	173.7	-63.6	0	0	0	0	109.6	Y436 G468	Y436-S485 VanDerWaalsContact CE2-O 3.23Å; Y436-S485 WeakPolarHBondContact CE2-O 3.41Å; Y436-S485 VanDerWaalsContact CZ-O 3.3Å; Y436-S485 PolarHBondContact OH-O 2.81Å; G468-S485 WeakPolarHBondContact O-CA 3.47Å
486	A	86.9	Confident	69.7	Low	1 Å²	1	58.5 Å²	58.5	1%	0.008	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	150.1	179	0	0	0	0	0	110	W250 Q252 G468 F470 V484 C488	W250-A486 HydrophobicContact CE3-CB 4.04Å; Q252-A486 HydrophobicContact CB-CB 4.29Å; G468-A486 PolarHBondContact N-O 2.83Å; G468-A486 PolarHBondContact O-N 3.27Å; G468-A486 VanDerWaalsContact O-O 3.06Å; F470-A486 HydrophobicContact CB-CB 3.97Å; V484-A486 PolarHBondContact O-N 3.4Å; A486-C488 PolarHBondContact O-N 3.02Å
487	L	90.7	Very high	72.6	Confident	0 Å²	0	60 Å²	60	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	121.2	173.6	-169.5	73.2	0	0	0	108.9	W250 I251 Y436 V439 L440 I450 C465 V489	W250-L487 CarbonylContact C-O 3.59Å; W250-L487 WeakPolarHBondContact CA-O 3.38Å; I251-L487 HydrophobicContact CB-CB 4.25Å; I251-L487 HydrophobicContact CD1-CD2 4.42Å; I251-L487 PolarHBondContact N-O 3.01Å; I251-L487 PolarHBondContact O-N 3.14Å; Y436-L487 HydrophobicContact CD1-CB 3.8Å; Y436-L487 HydrophobicContact CD1-CD1 4.48Å; Y436-L487 HydrophobicContact CE1-CB 3.99Å; V439-L487 HydrophobicContact CB-CD2 4.35Å; V439-L487 HydrophobicContact CG1-CD1 4.27Å; V439-L487 HydrophobicContact CG1-CD2 3.64Å; L440-L487 HydrophobicContact CD1-CD1 4.4Å; L440-L487 HydrophobicContact CD2-CD1 3.97Å; L440-L487 HydrophobicContact CG-CD1 4.08Å; I450-L487 HydrophobicContact CD1-CD2 4.2Å; C465-L487 WeakPolarHBondContact SG-CD1 3.38Å; C465-L487 VanDerWaalsContact SG-CG 3.55Å; L487-V489 HydrophobicContact CD2-CG2 4.26Å; L487-V489 HydrophobicContact CG-CG2 4.38Å
488	C	91.3	Very high	75.4	Confident	1 Å²	1	53.8 Å²	53.8	1%	0.007	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	114.5	175.3	179.3	0	0	0	0	108.9	L249 W250 C465 K466 A486	L249-C488 WeakPolarHBondContact O-CA 3.3Å; W250-C488 HydrophobicContact CD2-CB 4.29Å; W250-C488 HydrophobicContact CE3-CB 3.83Å; W250-C488 HydrophobicContact CH2-CB 4Å; W250-C488 HydrophobicContact CZ2-CB 4.41Å; W250-C488 HydrophobicContact CZ3-CB 3.7Å; C465-C488 WeakPolarHBondContact CA-O 3.44Å; K466-C488 HydrophobicContact CG-CB 3.95Å; K466-C488 PolarHBondContact N-O 3.42Å; K466-C488 PolarHBondContact O-N 2.91Å; A486-C488 PolarHBondContact O-N 3.02Å
489	V	91.7	Very high	78.3	Confident	1 Å²	1	45.6 Å²	45.6	1%	0.006	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	119.1	174.8	-169.7	0	0	0	0	108	L249 I251 L454 V462 L487 L491	L249-V489 HydrophobicContact CB-CB 4.28Å; L249-V489 PolarHBondContact N-O 3.04Å; L249-V489 PolarHBondContact O-N 2.91Å; I251-V489 HydrophobicContact CD1-CG2 3.9Å; L454-V489 HydrophobicContact CD1-CG1 4.07Å; V462-V489 HydrophobicContact CG1-CG1 3.52Å; V462-V489 HydrophobicContact CG2-CG1 4.41Å; L487-V489 HydrophobicContact CD2-CG2 4.26Å; L487-V489 HydrophobicContact CG-CG2 4.38Å; V489-L491 HydrophobicContact CB-CD2 4.38Å; V489-L491 HydrophobicContact CG1-CD2 3.65Å
490	I	90.6	Very high	80.9	Confident	3 Å²	3	41.6 Å²	41.6	2%	0.015	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	117.9	179.6	-54.4	-178.5	0	0	0	108.3	P224 Q246 L463 D464	P224-I490 HydrophobicContact CB-CD1 4.11Å; Q246-I490 HydrophobicContact CG-CG2 3.8Å; L463-I490 HydrophobicContact CB-CB 4.31Å; L463-I490 HydrophobicContact CB-CG2 4.22Å; L463-I490 HydrophobicContact CD1-CG2 4.05Å; L463-I490 PolarHBondContact N-O 2.92Å; D464-I490 HydrophobicContact CB-CB 4.5Å; D464-I490 HydrophobicContact CB-CD1 4.2Å; D464-I490 HydrophobicContact CB-CG1 4.49Å; D464-I490 PolarHBondContact O-N 3.37Å
491	L	93.2	Very high	83.6	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	150.3	-177.1	-49.5	178.9	0	0	0	110.5	Q246 I247 L249 L454 V460 L461 V462 V489 L502	Q246-L491 CarbonylContact C-O 3.49Å; Q246-L491 VanDerWaalsContact CA-O 3.24Å; Q246-L491 WeakPolarHBondContact CA-O 3.41Å; I247-L491 HydrophobicContact CG1-CB 3.9Å; I247-L491 HydrophobicContact CG1-CD1 4.37Å; I247-L491 PolarHBondContact N-O 3.48Å; I247-L491 PolarHBondContact O-N 3.37Å; L249-L491 HydrophobicContact CB-CD1 3.68Å; L249-L491 HydrophobicContact CB-CG 4.17Å; L249-L491 HydrophobicContact CD2-CD1 4.2Å; L249-L491 HydrophobicContact CG-CD1 4.42Å; L454-L491 HydrophobicContact CD1-CD2 3.93Å; V460-L491 HydrophobicContact CB-CB 4.43Å; V460-L491 HydrophobicContact CG2-CB 4.47Å; V460-L491 HydrophobicContact CG2-CD1 4.17Å; V460-L491 HydrophobicContact CG2-CD2 4.08Å; V460-L491 HydrophobicContact CG2-CG 4.48Å; L461-L491 CarbonylContact O-C 3.48Å; L461-L491 WeakPolarHBondContact O-CA 3.12Å; V462-L491 HydrophobicContact CB-CD2 4.5Å; V462-L491 HydrophobicContact CG2-CD2 3.8Å; V489-L491 HydrophobicContact CB-CD2 4.38Å; V489-L491 HydrophobicContact CG1-CD2 3.65Å; L491-L502 HydrophobicContact CD1-CD2 3.69Å
492	I	91.6	Very high	85.9	Confident	18 Å²	18	39.2 Å²	39.2	9%	0.092	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	128.2	162.9	-69.6	-172.7	0	0	0	108.6	R243 Q246 L461 L463	R243-I492 HydrophobicContact CB-CD1 3.72Å; R243-I492 HydrophobicContact CG-CD1 3.99Å; Q246-I492 HydrophobicContact CB-CG1 4.13Å; Q246-I492 HydrophobicContact CG-CG1 4.26Å; L461-I492 HydrophobicContact CB-CB 4.48Å; L461-I492 PolarHBondContact N-O 3.22Å; L461-I492 PolarHBondContact O-N 3.26Å; L463-I492 HydrophobicContact CD1-CD1 3.56Å; L463-I492 HydrophobicContact CD1-CG1 3.78Å; L463-I492 HydrophobicContact CD2-CD1 4.04Å; L463-I492 HydrophobicContact CD2-CG1 4.43Å; L463-I492 HydrophobicContact CG-CD1 4.01Å; L463-I492 HydrophobicContact CG-CG1 4Å
493	A	91.1	Very high	87.8	Confident	2 Å²	2	34.9 Å²	34.9	2%	0.017	18%	0.182	C	C	.	.			trans	-105.4	146.3	165.6	0	0	0	0	0	110.3	G245 V460 I498 I499	G245-A493 PolarHBondContact O-N 3.49Å; V460-A493 HydrophobicContact CG1-CB 4.2Å; A493-I498 HydrophobicContact CB-CB 4.32Å; A493-I498 HydrophobicContact CB-CG2 4.14Å; A493-I499 HydrophobicContact CB-CD1 3.91Å; A493-I499 HydrophobicContact CB-CG1 3.4Å
494	T	87.3	Confident	89.1	Confident	98 Å²	98	37.1 Å²	37.1	60%	0.601	19%	0.19	S	C	*	.	S	Bend	trans	-96.5	-12.6	177.3	52.3	0	0	0	0	113.4
495	Q	89.1	Confident	90.1	Very high	93 Å²	93	36.7 Å²	36.7	44%	0.435	19%	0.186	S	C	.	.	S	Bend	trans	-131.9	139.9	-177	-65.7	177.1	-10.1	0	0	110.5	E497 I498	Q495-E497 PolarHBondContact O-N 2.63Å; Q495-I498 HydrophobicContact CB-CD1 4Å; Q495-I498 HydrophobicContact CB-CG1 4.1Å; Q495-I498 HydrophobicContact CG-CD1 4.4Å; Q495-I498 PolarHBondContact O-N 2.93Å
496	S	90.3	Very high	90.5	Very high	3 Å²	3	35.7 Å²	35.7	2%	0.021	18%	0.179	C	C	.	.	H	α-helix	trans	-62.3	-34.1	-179.9	68.8	0	0	0	0	112.1	I498 I499 K500 E586	S496-I498 VanDerWaalsContact C-N 3.31Å; S496-I498 PolarHBondContact O-N 2.95Å; S496-I499 PolarHBondContact O-N 3Å; S496-K500 WeakPolarHBondContact O-CG 3.46Å; S496-K500 PolarHBondContact O-N 3.14Å; S496-E586 PolarHBondContact N-OE1 2.99Å; S496-E586 PolarHBondContact OG-OE1 3.07Å; S496-E586 VanDerWaalsContact OG-OE1 3.11Å; S496-E586 PolarHBondContact OG-OE2 3.02Å
497	E	91.3	Very high	90.2	Very high	124 Å²	124	38.4 Å²	38.4	58%	0.579	20%	0.198	S	C	*	.	H	α-helix	trans	-60.7	-36.2	177.5	-61.6	-179.5	174.5	0	0	113.5	Q495 K500 R501	Q495-E497 PolarHBondContact O-N 2.63Å; E497-K500 PolarHBondContact O-N 3.05Å; E497-R501 WeakPolarHBondContact O-CB 3.31Å; E497-R501 PolarHBondContact O-N 2.83Å
498	I	91.6	Very high	89.1	Confident	15 Å²	15	43.7 Å²	43.7	8%	0.077	23%	0.226	C	C	.	.	H	α-helix	trans	-68.1	-41.8	179.2	-65.1	173.2	0	0	0	109.8	S458 V460 A493 Q495 S496 R501 L502	S458-I498 WeakPolarHBondContact O-CG2 3.44Å; V460-I498 HydrophobicContact CG1-CG2 3.54Å; A493-I498 HydrophobicContact CB-CB 4.32Å; A493-I498 HydrophobicContact CB-CG2 4.14Å; Q495-I498 HydrophobicContact CB-CD1 4Å; Q495-I498 HydrophobicContact CB-CG1 4.1Å; Q495-I498 HydrophobicContact CG-CD1 4.4Å; Q495-I498 PolarHBondContact O-N 2.93Å; S496-I498 VanDerWaalsContact C-N 3.31Å; S496-I498 PolarHBondContact O-N 2.95Å; I498-R501 PolarHBondContact O-N 2.98Å; I498-L502 WeakPolarHBondContact O-CB 3.34Å; I498-L502 PolarHBondContact O-N 3.43Å
499	I	91	Very high	87.2	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-64.5	-44.3	177.2	-57.5	-170.5	0	0	0	110.7	I247 A493 S496 L502 S503 V575 A578 I579 L582	I247-I499 HydrophobicContact CD1-CG1 4.47Å; I247-I499 HydrophobicContact CD1-CG2 4.23Å; I247-I499 HydrophobicContact CG2-CD1 4.44Å; A493-I499 HydrophobicContact CB-CD1 3.91Å; A493-I499 HydrophobicContact CB-CG1 3.4Å; S496-I499 PolarHBondContact O-N 3Å; I499-L502 PolarHBondContact O-N 3.11Å; I499-S503 WeakPolarHBondContact O-CB 3.35Å; I499-S503 PolarHBondContact O-N 2.97Å; I499-V575 HydrophobicContact CG2-CB 4.49Å; I499-V575 HydrophobicContact CG2-CG1 3.91Å; I499-V575 HydrophobicContact CG2-CG2 4.47Å; I499-A578 HydrophobicContact CD1-CB 3.39Å; I499-I579 HydrophobicContact CB-CG1 4.15Å; I499-I579 HydrophobicContact CG2-CD1 4.2Å; I499-I579 HydrophobicContact CG2-CG1 3.87Å; I499-L582 HydrophobicContact CD1-CD1 3.5Å; I499-L582 VanDerWaalsContact CD1-CD1 3.5Å; I499-L582 HydrophobicContact CG1-CD1 4.18Å
500	K	91	Very high	84.3	Confident	91 Å²	91	52.3 Å²	52.3	40%	0.396	28%	0.276	S	S	.	.	H	α-helix	trans	-58.1	-50.2	176.4	-71.3	171.6	-177.4	167.1	0	111	S496 E497 L502 S503 D504 I579	S496-K500 WeakPolarHBondContact O-CG 3.46Å; S496-K500 PolarHBondContact O-N 3.14Å; E497-K500 PolarHBondContact O-N 3.05Å; K500-L502 VanDerWaalsContact C-N 3.34Å; K500-L502 PolarHBondContact O-N 3.48Å; K500-S503 WeakPolarHBondContact O-CB 3.37Å; K500-S503 PolarHBondContact O-N 3.43Å; K500-S503 VanDerWaalsContact O-N 3.16Å; K500-D504 VanDerWaalsContact O-CG 3.25Å; K500-D504 PolarHBondContact O-N 2.93Å; K500-I579 HydrophobicContact CG-CD1 3.86Å; K500-I579 HydrophobicContact CG-CG1 4.46Å
501	R	91.7	Very high	81.6	Confident	116 Å²	116	56.8 Å²	56.8	44%	0.438	31%	0.308	S	S	.	.	H	α-helix	trans	-59.7	-42.3	177.4	-166.2	-165.9	-41.3	153.4	9.9	112.6	E497 I498 S503 D504 D505	E497-R501 WeakPolarHBondContact O-CB 3.31Å; E497-R501 PolarHBondContact O-N 2.83Å; I498-R501 PolarHBondContact O-N 2.98Å; R501-S503 VanDerWaalsContact C-N 3.34Å; R501-D504 PolarHBondContact O-N 2.99Å; R501-D505 WeakPolarHBondContact O-CB 3.2Å; R501-D505 PolarHBondContact O-N 3.18Å
502	L	92.2	Very high	78.6	Confident	5 Å²	5	64.8 Å²	64.8	3%	0.026	35%	0.345	C	S	.	.	H	α-helix	trans	-65.8	-38.7	177.6	-168.8	73	0	0	0	111.6	I247 L491 I498 I499 K500 D505 C506 L542 L570	I247-L502 HydrophobicContact CD1-CD2 3.73Å; L491-L502 HydrophobicContact CD1-CD2 3.69Å; I498-L502 WeakPolarHBondContact O-CB 3.34Å; I498-L502 PolarHBondContact O-N 3.43Å; I499-L502 PolarHBondContact O-N 3.11Å; K500-L502 VanDerWaalsContact C-N 3.34Å; K500-L502 PolarHBondContact O-N 3.48Å; L502-D505 PolarHBondContact O-N 2.89Å; L502-C506 PolarHBondContact O-N 3.45Å; L502-C506 PolarHBondContact O-SG 2.93Å; L502-L542 HydrophobicContact CD1-CD1 4.37Å; L502-L542 HydrophobicContact CD1-CD2 3.72Å; L502-L542 HydrophobicContact CG-CD2 4.4Å; L502-L570 HydrophobicContact CB-CD1 4.5Å; L502-L570 HydrophobicContact CD2-CD1 4.05Å; L502-L570 HydrophobicContact CD2-CD2 4.29Å; L502-L570 HydrophobicContact CG-CD1 4.06Å
503	S	90.9	Very high	75.6	Confident	38 Å²	38	69.8 Å²	69.8	27%	0.266	38%	0.377	S	S	.	.	H	α-helix	trans	-64.7	-41	174	-174	0	0	0	0	112.1	I499 K500 R501 C506 S507	I499-S503 WeakPolarHBondContact O-CB 3.35Å; I499-S503 PolarHBondContact O-N 2.97Å; K500-S503 WeakPolarHBondContact O-CB 3.37Å; K500-S503 PolarHBondContact O-N 3.43Å; K500-S503 VanDerWaalsContact O-N 3.16Å; R501-S503 VanDerWaalsContact C-N 3.34Å; S503-C506 PolarHBondContact O-N 3.06Å; S503-S507 PolarHBondContact O-N 2.75Å; S503-S507 VanDerWaalsContact O-N 3.15Å; S503-S507 PolarHBondContact O-OG 3.02Å
504	D	89.8	Confident	72.5	Confident	99 Å²	99	78.2 Å²	78.2	53%	0.529	41%	0.413	S	S	.	.	H	α-helix	trans	-64.7	-43.5	175.1	-65.9	-22.2	0	0	0	110.9	K500 R501 C506 S507	K500-D504 VanDerWaalsContact O-CG 3.25Å; K500-D504 PolarHBondContact O-N 2.93Å; R501-D504 PolarHBondContact O-N 2.99Å; D504-C506 PolarHBondContact O-N 2.98Å; D504-S507 VanDerWaalsContact O-CB 3.24Å; D504-S507 WeakPolarHBondContact O-CB 3.42Å; D504-S507 PolarHBondContact O-N 2.83Å
505	D	89.2	Confident	69.8	Low	23 Å²	23	78 Å²	78	12%	0.123	41%	0.413	C	S	.	.	H	α-helix	trans	-67.5	-22.3	177	-78.7	-12.9	0	0	0	113	R501 L502 S540 K541 L542	R501-D505 WeakPolarHBondContact O-CB 3.2Å; R501-D505 PolarHBondContact O-N 3.18Å; L502-D505 PolarHBondContact O-N 2.89Å; D505-S540 VanDerWaalsContact O-CB 3.28Å; D505-S540 WeakPolarHBondContact O-CB 3.14Å; D505-K541 PolarHBondContact O-N 3.41Å; D505-K541 IonicContact OD1-NZ 3.43Å; D505-K541 PolarHBondContact OD1-NZ 3.18Å; D505-K541 IonicContact OD2-NZ 2.71Å; D505-K541 PolarHBondContact OD2-NZ 2.92Å; D505-L542 HydrophobicContact CB-CB 4.17Å; D505-L542 WeakPolarHBondContact O-CB 3.14Å; D505-L542 PolarHBondContact O-N 3.01Å
506	C	87.9	Confident	67	Low	18 Å²	18	77 Å²	77	12%	0.122	42%	0.416	C	S	.	.	H	α-helix	trans	-81.9	-16	170.5	-69.2	0	0	0	0	113.1	L502 S503 D504 S540 L542 L570	L502-C506 PolarHBondContact O-N 3.45Å; L502-C506 PolarHBondContact O-SG 2.93Å; S503-C506 PolarHBondContact O-N 3.06Å; D504-C506 PolarHBondContact O-N 2.98Å; C506-S540 VanDerWaalsContact C-CB 3.41Å; C506-S540 WeakPolarHBondContact O-CB 3.4Å; C506-L542 WeakPolarHBondContact SG-CD2 3.42Å; C506-L570 HydrophobicContact CB-CD1 4.49Å
507	S	80.8	Confident	64.6	Low	59 Å²	59	81.6 Å²	81.6	41%	0.413	45%	0.449	S	S	.	.	S	Bend	trans	-72	143.4	178.2	-61.5	0	0	0	0	110.1	S503 D504 H509	S503-S507 PolarHBondContact O-N 2.75Å; S503-S507 VanDerWaalsContact O-N 3.15Å; S503-S507 PolarHBondContact O-OG 3.02Å; D504-S507 VanDerWaalsContact O-CB 3.24Å; D504-S507 WeakPolarHBondContact O-CB 3.42Å; D504-S507 PolarHBondContact O-N 2.83Å; S507-H509 PolarHBondContact O-N 3.37Å; S507-H509 VanDerWaalsContact O-N 3.14Å
508	L	67.6	Low	62.1	Low	111 Å²	111	84.9 Å²	84.9	58%	0.581	46%	0.461	S	S	*	.	B	Isolated β-bridge	trans	-64.5	116.7	-178.5	-65.8	179	0	0	0	109.8	L538	L508-L538 HydrophobicContact CB-CB 4.19Å; L508-L538 HydrophobicContact CD1-CB 4.08Å; L508-L538 HydrophobicContact CD1-CD1 4.38Å; L508-L538 HydrophobicContact CD2-CB 3.91Å; L508-L538 WeakPolarHBondContact CD2-O 3.49Å; L508-L538 HydrophobicContact CG-CB 4.29Å
509	H	51.3	Low	59.6	Low	88 Å²	88	90 Å²	90	41%	0.407	49%	0.485	S	S	.	.	P	Polyproline II helix	trans	-89	118	171.2	-67.7	-65.8	0	0	0	109.5	S507 S511 K541	S507-H509 PolarHBondContact O-N 3.37Å; S507-H509 VanDerWaalsContact O-N 3.14Å; H509-S511 VanDerWaalsContact C-N 3.29Å; H509-S511 PolarHBondContact O-N 2.83Å; H509-K541 VanDerWaalsContact CD2-CB 3.4Å; H509-K541 WeakPolarHBondContact CD2-CB 3.5Å
510	S	32	Very low	57.2	Low	95 Å²	95	92.3 Å²	92.3	66%	0.664	50%	0.498	S	S	*	.			trans	-73.1	86.8	161.5	61.7	0	0	0	0	108.7	E512	S510-E512 PolarHBondContact O-N 3.26Å
511	S	32	Very low	54.5	Low	97 Å²	97	93.6 Å²	93.6	68%	0.678	51%	0.51	S	S	*	.			trans	-78.1	76.1	161.6	61.8	0	0	0	0	108.8	H509 T513	H509-S511 VanDerWaalsContact C-N 3.29Å; H509-S511 PolarHBondContact O-N 2.83Å; S511-T513 PolarHBondContact O-N 3.27Å
512	E	30.3	Very low	51.9	Low	167 Å²	167	94.9 Å²	94.9	78%	0.78	53%	0.525	S	S	*	.			trans	-68.8	80.4	154.8	-78.5	-169.5	168.6	0	0	107.6	S510 K514	S510-E512 PolarHBondContact O-N 3.26Å; E512-K514 PolarHBondContact O-N 2.78Å
513	T	30.1	Very low	49.2	Very low	123 Å²	123	103.5 Å²	103.5	76%	0.755	56%	0.559	S	S	*	*			trans	-66.9	89.9	156.3	24.9	0	0	0	0	106.9	S511 P515	S511-T513 PolarHBondContact O-N 3.27Å; T513-P515 WeakPolarHBondContact O-CD 3.47Å; T513-P515 VanDerWaalsContact O-N 3.09Å
514	K	26.2	Very low	46.7	Very low	180 Å²	180	107.7 Å²	107.7	78%	0.783	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-48	118.7	163.4	-98	178.2	177.4	171.2	0	107.2	E512 S516	E512-K514 PolarHBondContact O-N 2.78Å; K514-S516 PolarHBondContact O-N 3.45Å
515	P	29.3	Very low	44.1	Very low	94 Å²	94	113.8 Å²	113.8	61%	0.61	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-59.4	128.7	177.4	23	-31	0	0	0	108.1	T513 S517 V520	T513-P515 WeakPolarHBondContact O-CD 3.47Å; T513-P515 VanDerWaalsContact O-N 3.09Å; P515-S517 PolarHBondContact O-N 2.91Å; P515-V520 HydrophobicContact CB-CG2 3.98Å; P515-V520 HydrophobicContact CG-CG2 4.1Å
516	S	31	Very low	41.4	Very low	71 Å²	71	119 Å²	119	50%	0.497	62%	0.62	S	S	.	*	P	Polyproline II helix	trans	-58.9	134.4	177.7	88.9	0	0	0	0	108.6	K514 K518 E519	K514-S516 PolarHBondContact O-N 3.45Å; S516-K518 PolarHBondContact O-N 3.5Å; S516-E519 PolarHBondContact O-N 3.42Å
517	S	38.5	Very low	38.7	Very low	100 Å²	100	124.5 Å²	124.5	70%	0.699	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.7	-5.5	-171.8	54	0	0	0	0	115.3	P515	P515-S517 PolarHBondContact O-N 2.91Å
518	K	40.4	Very low	36.5	Very low	193 Å²	193	125.3 Å²	125.3	84%	0.839	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.7	-17.5	177.4	-68.6	-175	177.4	-178.6	0	114.2	S516	S516-K518 PolarHBondContact O-N 3.5Å
519	E	39.5	Very low	34.8	Very low	122 Å²	122	124.5 Å²	124.5	57%	0.57	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.8	-19.8	173.6	-74.1	176.6	156	0	0	112.4	S516 N521 N522 Y523	S516-E519 PolarHBondContact O-N 3.42Å; E519-N521 PolarHBondContact O-N 2.67Å; E519-N521 VanDerWaalsContact O-N 3.15Å; E519-N522 PolarHBondContact O-N 3.35Å; E519-Y523 VanDerWaalsContact O-CD2 3.3Å; E519-Y523 WeakPolarHBondContact O-CD2 3.5Å
520	V	38.8	Very low	33.8	Very low	48 Å²	48	130.6 Å²	130.6	29%	0.291	68%	0.683	S	S	.	*	H	α-helix	trans	-62.9	-23.3	-176.3	177.3	0	0	0	0	113.3	P515 N522 L524	P515-V520 HydrophobicContact CB-CG2 3.98Å; P515-V520 HydrophobicContact CG-CG2 4.1Å; V520-N522 PolarHBondContact O-N 3.02Å; V520-L524 HydrophobicContact CG1-CD1 3.52Å; V520-L524 HydrophobicContact CG1-CG 4.21Å; V520-L524 WeakPolarHBondContact O-CD1 3.18Å; V520-L524 VanDerWaalsContact O-CG 3.31Å; V520-L524 WeakPolarHBondContact O-CG 3.41Å
521	N	35	Very low	33.5	Very low	118 Å²	118	130.7 Å²	130.7	63%	0.631	68%	0.68	S	S	*	*	H	α-helix	trans	-79.8	-12.8	-178.3	-74.9	-22.1	0	0	0	115.2	E519	E519-N521 PolarHBondContact O-N 2.67Å; E519-N521 VanDerWaalsContact O-N 3.15Å
522	N	36.5	Very low	33.3	Very low	144 Å²	144	132 Å²	132	77%	0.77	68%	0.678	S	S	*	*	H	α-helix	trans	-98.2	-20	174.9	-78.5	-12.2	0	0	0	113.5	E519 V520	E519-N522 PolarHBondContact O-N 3.35Å; V520-N522 PolarHBondContact O-N 3.02Å
523	Y	37	Very low	33.3	Very low	186 Å²	186	127.8 Å²	127.8	73%	0.729	67%	0.665	S	S	*	*	H	α-helix	trans	-88.7	-11.7	177.3	-69.2	-78.7	0	0	0	113.9	E519	E519-Y523 VanDerWaalsContact O-CD2 3.3Å; E519-Y523 WeakPolarHBondContact O-CD2 3.5Å
524	L	37	Very low	33.3	Very low	125 Å²	125	128.3 Å²	128.3	65%	0.654	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.4	6.8	-176.5	-77.2	172.5	0	0	0	115.5	V520	V520-L524 HydrophobicContact CG1-CD1 3.52Å; V520-L524 HydrophobicContact CG1-CG 4.21Å; V520-L524 WeakPolarHBondContact O-CD1 3.18Å; V520-L524 VanDerWaalsContact O-CG 3.31Å; V520-L524 WeakPolarHBondContact O-CG 3.41Å
525	R	36.2	Very low	33.9	Very low	227 Å²	227	127.8 Å²	127.8	86%	0.857	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.7	2.7	179.7	-85.2	-172.5	174.5	165	-0.7	115.9
526	L	31.7	Very low	34.6	Very low	133 Å²	133	127 Å²	127	70%	0.696	66%	0.662	S	S	*	*			trans	-103.8	121.1	174.2	-85.2	140.9	0	0	0	110.4	V528	L526-V528 PolarHBondContact O-N 3.3Å
527	P	30.6	Very low	35.7	Very low	133 Å²	133	126.7 Å²	126.7	86%	0.864	65%	0.654	S	S	*	*	S	Bend	trans	-71	15.4	177.4	-13	27.8	0	0	0	114.4
528	V	34.9	Very low	36.6	Very low	76 Å²	76	126.7 Å²	126.7	46%	0.461	65%	0.645	S	S	.	*	S	Bend	trans	-121.4	123.1	-169	-172.9	0	0	0	0	108.4	T330 L526	T330-V528 HydrophobicContact CG2-CG2 4.41Å; L526-V528 PolarHBondContact O-N 3.3Å
529	V	33.2	Very low	38	Very low	95 Å²	95	118.6 Å²	118.6	58%	0.576	61%	0.612	S	S	*	*			trans	84.2	59.7	178.1	-153.2	0	0	0	0	116.5	T531 L532	V529-T531 PolarHBondContact O-N 3.3Å; V529-L532 HydrophobicContact CG1-CD1 4.24Å
530	K	28.8	Very low	40.2	Very low	215 Å²	215	112.9 Å²	112.9	94%	0.935	59%	0.586	S	S	*	*	S	Bend	trans	-78.8	20.5	152.8	-85.7	-173.7	177.1	178.8	0	113.7
531	T	27.2	Very low	42.6	Very low	97 Å²	97	114.8 Å²	114.8	60%	0.595	59%	0.59	S	S	*	*			trans	-141.4	67.8	170.7	58.5	0	0	0	0	109.6	V529	V529-T531 PolarHBondContact O-N 3.3Å
532	L	27.5	Very low	45.3	Very low	124 Å²	124	109.1 Å²	109.1	65%	0.649	56%	0.56	S	S	*	*			trans	-58.8	130	145.5	-121.4	84.6	0	0	0	104.8	V529 S534 L536	V529-L532 HydrophobicContact CG1-CD1 4.24Å; L532-S534 PolarHBondContact O-N 2.98Å; L532-L536 HydrophobicContact CD2-CD1 4.02Å; L532-L536 HydrophobicContact CG-CD1 4.41Å
533	P	30	Very low	47.9	Very low	79 Å²	79	102.3 Å²	102.3	51%	0.513	52%	0.524	S	S	.	.			trans	-59.8	112.5	165.7	5.7	4.9	0	0	0	104.8	K535 L536	P533-K535 HydrophobicContact CB-CB 4.43Å; P533-K535 PolarHBondContact O-N 3.36Å; P533-L536 HydrophobicContact CG-CG 4.45Å; P533-L536 PolarHBondContact O-N 3.21Å
534	S	29.7	Very low	50.5	Low	134 Å²	134	97 Å²	97	94%	0.937	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	8.1	162.6	44.2	0	0	0	0	112.5	L532	L532-S534 PolarHBondContact O-N 2.98Å
535	K	38.8	Very low	53.1	Low	170 Å²	170	93.7 Å²	93.7	74%	0.739	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.4	25.1	177.5	-137.9	-179	-170	-175.7	0	111.8	P533 M537	P533-K535 HydrophobicContact CB-CB 4.43Å; P533-K535 PolarHBondContact O-N 3.36Å; K535-M537 PolarHBondContact O-N 3.25Å
536	L	43.5	Very low	55.9	Low	76 Å²	76	82.9 Å²	82.9	40%	0.398	45%	0.45	S	S	.	.	S	Bend	trans	-63.1	94.7	161.9	-88.5	165.4	0	0	0	106.4	L532 P533 L538	L532-L536 HydrophobicContact CD2-CD1 4.02Å; L532-L536 HydrophobicContact CG-CD1 4.41Å; P533-L536 HydrophobicContact CG-CG 4.45Å; P533-L536 PolarHBondContact O-N 3.21Å; L536-L538 PolarHBondContact O-N 3.49Å
537	M	54.6	Low	58.8	Low	65 Å²	65	77 Å²	77	32%	0.32	42%	0.42	S	S	.	.			trans	-40.3	125.6	-160	-57.5	-165.6	76.8	0	0	112.8	L254 K535 T539	L254-M537 HydrophobicContact CD1-CE 4.1Å; L254-M537 HydrophobicContact CD1-SD 3.75Å; L254-M537 HydrophobicContact CD2-CB 3.9Å; L254-M537 HydrophobicContact CD2-CG 4.48Å; L254-M537 HydrophobicContact CD2-SD 3.93Å; L254-M537 HydrophobicContact CG-SD 3.92Å; K535-M537 PolarHBondContact O-N 3.25Å; M537-T539 PolarHBondContact O-N 2.91Å; M537-T539 VanDerWaalsContact O-N 3.16Å
538	L	56.9	Low	61.7	Low	100 Å²	100	73.5 Å²	73.5	52%	0.524	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-50.6	120.2	169.5	-71.3	154.4	0	0	0	107.6	L508 L536	L508-L538 HydrophobicContact CB-CB 4.19Å; L508-L538 HydrophobicContact CD1-CB 4.08Å; L508-L538 HydrophobicContact CD1-CD1 4.38Å; L508-L538 HydrophobicContact CD2-CB 3.91Å; L508-L538 WeakPolarHBondContact CD2-O 3.49Å; L508-L538 HydrophobicContact CG-CB 4.29Å; L536-L538 PolarHBondContact O-N 3.49Å
539	T	70.3	Confident	64.4	Low	23 Å²	23	71.2 Å²	71.2	14%	0.141	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-101.1	156.6	169.3	46.9	0	0	0	0	108.5	L254 M537 D544	L254-T539 HydrophobicContact CD2-CG2 4.47Å; M537-T539 PolarHBondContact O-N 2.91Å; M537-T539 VanDerWaalsContact O-N 3.16Å; T539-D544 VanDerWaalsContact CB-OD1 3.29Å; T539-D544 WeakPolarHBondContact CB-OD1 3.23Å; T539-D544 VanDerWaalsContact OG1-CG 3.29Å; T539-D544 PolarHBondContact OG1-OD1 3.03Å; T539-D544 PolarHBondContact OG1-OD2 3.28Å
540	S	85.6	Confident	67.3	Low	3 Å²	3	66.7 Å²	66.7	2%	0.021	36%	0.355	C	S	.	.	B	Isolated β-bridge	trans	-83.1	158.8	171.7	66.1	0	0	0	0	110	D505 C506 L542 A543 D544	D505-S540 VanDerWaalsContact O-CB 3.28Å; D505-S540 WeakPolarHBondContact O-CB 3.14Å; C506-S540 VanDerWaalsContact C-CB 3.41Å; C506-S540 WeakPolarHBondContact O-CB 3.4Å; S540-L542 PolarHBondContact O-N 2.8Å; S540-A543 WeakPolarHBondContact O-CB 2.96Å; S540-A543 PolarHBondContact O-N 3.2Å; S540-A543 WeakPolarHBondContact OG-CB 3.43Å; S540-A543 PolarHBondContact OG-N 2.94Å; S540-D544 PolarHBondContact O-N 3.27Å; S540-D544 VanDerWaalsContact O-N 3.1Å
541	K	89.1	Confident	70.3	Confident	87 Å²	87	59.3 Å²	59.3	38%	0.378	33%	0.326	S	S	.	.	H	α-helix	trans	-57.9	-41.8	177.7	164.1	167.3	166.5	-87.3	0	110.6	D505 H509 A543 D544 D545	D505-K541 PolarHBondContact O-N 3.41Å; D505-K541 IonicContact OD1-NZ 3.43Å; D505-K541 PolarHBondContact OD1-NZ 3.18Å; D505-K541 IonicContact OD2-NZ 2.71Å; D505-K541 PolarHBondContact OD2-NZ 2.92Å; H509-K541 VanDerWaalsContact CD2-CB 3.4Å; H509-K541 WeakPolarHBondContact CD2-CB 3.5Å; K541-A543 VanDerWaalsContact C-N 3.29Å; K541-A543 PolarHBondContact O-N 3.2Å; K541-D544 PolarHBondContact O-N 3.25Å; K541-D545 WeakPolarHBondContact O-CB 3.23Å; K541-D545 PolarHBondContact O-N 3.43Å
542	L	92.4	Very high	73.3	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-60.6	-38.5	176.1	-173.6	60	0	0	0	112.4	L249 Y453 L502 D505 C506 S540 L546 V568	L249-L542 HydrophobicContact CD1-CD2 3.85Å; L249-L542 HydrophobicContact CD2-CD2 4.32Å; Y453-L542 HydrophobicContact CE1-CD1 3.64Å; L502-L542 HydrophobicContact CD1-CD1 4.37Å; L502-L542 HydrophobicContact CD1-CD2 3.72Å; L502-L542 HydrophobicContact CG-CD2 4.4Å; D505-L542 HydrophobicContact CB-CB 4.17Å; D505-L542 WeakPolarHBondContact O-CB 3.14Å; D505-L542 PolarHBondContact O-N 3.01Å; C506-L542 WeakPolarHBondContact SG-CD2 3.42Å; S540-L542 PolarHBondContact O-N 2.8Å; L542-L546 HydrophobicContact CD1-CD1 4.18Å; L542-L546 HydrophobicContact CD1-CG 4.29Å; L542-L546 HydrophobicContact CG-CD1 4Å; L542-L546 VanDerWaalsContact O-CB 3.29Å; L542-L546 WeakPolarHBondContact O-CB 3.43Å; L542-L546 WeakPolarHBondContact O-CG 3.39Å; L542-L546 PolarHBondContact O-N 3.43Å; L542-V568 HydrophobicContact CD2-CG1 3.74Å; L542-V568 HydrophobicContact CG-CG1 4.18Å
543	A	91.9	Very high	76.4	Confident	1 Å²	1	59.8 Å²	59.8	1%	0.008	31%	0.314	C	S	.	.	H	α-helix	trans	-66	-42	177.7	0	0	0	0	0	112.2	S540 K541 A547 L566 V568	S540-A543 WeakPolarHBondContact O-CB 2.96Å; S540-A543 PolarHBondContact O-N 3.2Å; S540-A543 WeakPolarHBondContact OG-CB 3.43Å; S540-A543 PolarHBondContact OG-N 2.94Å; K541-A543 VanDerWaalsContact C-N 3.29Å; K541-A543 PolarHBondContact O-N 3.2Å; A543-A547 VanDerWaalsContact O-CB 3.26Å; A543-A547 WeakPolarHBondContact O-CB 3.37Å; A543-A547 PolarHBondContact O-N 3.22Å; A543-L566 HydrophobicContact CB-CB 4.36Å; A543-V568 HydrophobicContact CB-CB 4.22Å; A543-V568 HydrophobicContact CB-CG2 3.75Å
544	D	90.2	Very high	79.2	Confident	73 Å²	73	57 Å²	57	39%	0.39	30%	0.3	S	S	.	.	H	α-helix	trans	-68.5	-41	178.3	-70.5	-16.7	0	0	0	112	T539 S540 K541 A547 T548	T539-D544 VanDerWaalsContact CB-OD1 3.29Å; T539-D544 WeakPolarHBondContact CB-OD1 3.23Å; T539-D544 VanDerWaalsContact OG1-CG 3.29Å; T539-D544 PolarHBondContact OG1-OD1 3.03Å; T539-D544 PolarHBondContact OG1-OD2 3.28Å; S540-D544 PolarHBondContact O-N 3.27Å; S540-D544 VanDerWaalsContact O-N 3.1Å; K541-D544 PolarHBondContact O-N 3.25Å; D544-A547 PolarHBondContact O-N 3.19Å; D544-T548 WeakPolarHBondContact O-CB 3.5Å; D544-T548 PolarHBondContact O-N 2.83Å; D544-T548 PolarHBondContact O-OG1 3.13Å
545	D	92.1	Very high	82.1	Confident	56 Å²	56	50.7 Å²	50.7	30%	0.299	26%	0.256	S	S	.	.	H	α-helix	trans	-65	-47.5	176.8	-72.8	-25.6	0	0	0	110.8	Y453 K541 A547 T548 V549	Y453-D545 HydrophobicContact CE1-CB 4.47Å; Y453-D545 HydrophobicContact CE2-CB 4.05Å; Y453-D545 WeakPolarHBondContact OH-CB 3.36Å; Y453-D545 PolarHBondContact OH-OD2 3Å; K541-D545 WeakPolarHBondContact O-CB 3.23Å; K541-D545 PolarHBondContact O-N 3.43Å; D545-A547 PolarHBondContact O-N 3.18Å; D545-T548 WeakPolarHBondContact O-CB 3.39Å; D545-T548 PolarHBondContact O-N 2.91Å; D545-V549 WeakPolarHBondContact O-CG2 3.38Å; D545-V549 PolarHBondContact O-N 3.25Å
546	L	94.2	Very high	84.6	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-62.9	-39.9	175.6	-78	172.4	0	0	0	112.2	I251 Y453 L542 T548 V549 L550 L566 V568	I251-L546 HydrophobicContact CD1-CD1 4Å; Y453-L546 HydrophobicContact CD1-CD2 3.52Å; Y453-L546 HydrophobicContact CD1-CG 4.15Å; Y453-L546 HydrophobicContact CE1-CD2 4.04Å; Y453-L546 HydrophobicContact CE1-CG 4.16Å; Y453-L546 HydrophobicContact CG-CD2 4.27Å; L542-L546 HydrophobicContact CD1-CD1 4.18Å; L542-L546 HydrophobicContact CD1-CG 4.29Å; L542-L546 HydrophobicContact CG-CD1 4Å; L542-L546 VanDerWaalsContact O-CB 3.29Å; L542-L546 WeakPolarHBondContact O-CB 3.43Å; L542-L546 WeakPolarHBondContact O-CG 3.39Å; L542-L546 PolarHBondContact O-N 3.43Å; L546-T548 VanDerWaalsContact C-N 3.31Å; L546-T548 PolarHBondContact O-N 3.49Å; L546-V549 PolarHBondContact O-N 3.4Å; L546-L550 WeakPolarHBondContact O-CB 3.25Å; L546-L550 WeakPolarHBondContact O-CG 3.46Å; L546-L550 PolarHBondContact O-N 3.28Å; L546-L566 HydrophobicContact CB-CD1 4.08Å; L546-V568 HydrophobicContact CD1-CG2 4.1Å
547	A	92.5	Very high	86.7	Confident	9 Å²	9	45.8 Å²	45.8	7%	0.074	25%	0.245	C	C	.	.	H	α-helix	trans	-60.6	-43.8	174.8	0	0	0	0	0	110.7	A543 D544 D545 V549 L550 I551 L564 L566	A543-A547 VanDerWaalsContact O-CB 3.26Å; A543-A547 WeakPolarHBondContact O-CB 3.37Å; A543-A547 PolarHBondContact O-N 3.22Å; D544-A547 PolarHBondContact O-N 3.19Å; D545-A547 PolarHBondContact O-N 3.18Å; A547-V549 PolarHBondContact O-N 2.89Å; A547-L550 PolarHBondContact O-N 3Å; A547-I551 WeakPolarHBondContact O-CB 3.24Å; A547-I551 WeakPolarHBondContact O-CD1 3.42Å; A547-I551 WeakPolarHBondContact O-CG1 3.29Å; A547-I551 PolarHBondContact O-N 2.99Å; A547-L564 HydrophobicContact CB-CD1 3.96Å; A547-L566 HydrophobicContact CB-CD1 4.09Å; A547-L566 HydrophobicContact CB-CG 4.29Å
548	T	91.3	Very high	88.2	Confident	59 Å²	59	47 Å²	47	36%	0.362	25%	0.25	S	C	.	.	H	α-helix	trans	-62	-43.6	176.5	-60.2	0	0	0	0	112	D544 D545 L546 R552	D544-T548 WeakPolarHBondContact O-CB 3.5Å; D544-T548 PolarHBondContact O-N 2.83Å; D544-T548 PolarHBondContact O-OG1 3.13Å; D545-T548 WeakPolarHBondContact O-CB 3.39Å; D545-T548 PolarHBondContact O-N 2.91Å; L546-T548 VanDerWaalsContact C-N 3.31Å; L546-T548 PolarHBondContact O-N 3.49Å; T548-R552 WeakPolarHBondContact O-CG 3.48Å; T548-R552 PolarHBondContact O-N 3.48Å
549	V	93	Very high	89.7	Confident	28 Å²	28	42.2 Å²	42.2	17%	0.17	23%	0.225	C	C	.	.	H	α-helix	trans	-61.6	-47.1	177	167.8	0	0	0	0	111	A449 Y453 D545 L546 A547 R552 A553	A449-V549 HydrophobicContact CB-CG1 3.73Å; A449-V549 WeakPolarHBondContact O-CG1 3.33Å; Y453-V549 HydrophobicContact CD2-CG2 3.61Å; Y453-V549 HydrophobicContact CE2-CG2 4.29Å; Y453-V549 HydrophobicContact CG-CG2 3.96Å; D545-V549 WeakPolarHBondContact O-CG2 3.38Å; D545-V549 PolarHBondContact O-N 3.25Å; L546-V549 PolarHBondContact O-N 3.4Å; A547-V549 PolarHBondContact O-N 2.89Å; V549-R552 PolarHBondContact O-N 3.47Å; V549-A553 WeakPolarHBondContact O-CB 3.32Å; V549-A553 PolarHBondContact O-N 2.87Å
550	L	94.1	Very high	90.6	Very high	1 Å²	1	47.2 Å²	47.2	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-67.7	-38.6	-180	-74.6	168.6	0	0	0	112.6	F435 L446 I450 L546 A547 R552 A553 G554 A555 L566	F435-L550 HydrophobicContact CE2-CD1 3.95Å; F435-L550 HydrophobicContact CZ-CD1 3.89Å; L446-L550 HydrophobicContact CB-CD2 3.84Å; L446-L550 HydrophobicContact CD2-CD2 3.99Å; L446-L550 HydrophobicContact CG-CD2 4.35Å; I450-L550 HydrophobicContact CD1-CD1 4.44Å; I450-L550 HydrophobicContact CD1-CD2 4Å; I450-L550 HydrophobicContact CG1-CD1 4.46Å; I450-L550 HydrophobicContact CG1-CD2 3.88Å; I450-L550 HydrophobicContact CG1-CG 4.33Å; L546-L550 WeakPolarHBondContact O-CB 3.25Å; L546-L550 WeakPolarHBondContact O-CG 3.46Å; L546-L550 PolarHBondContact O-N 3.28Å; A547-L550 PolarHBondContact O-N 3Å; L550-R552 VanDerWaalsContact C-N 3.3Å; L550-R552 PolarHBondContact O-N 2.91Å; L550-A553 CarbonylContact O-C 3.52Å; L550-A553 PolarHBondContact O-N 2.79Å; L550-G554 PolarHBondContact O-N 3.07Å; L550-A555 HydrophobicContact CB-CB 4.06Å; L550-A555 WeakPolarHBondContact O-CB 3.33Å; L550-A555 PolarHBondContact O-N 3.31Å; L550-L566 HydrophobicContact CD1-CD1 3.78Å
551	I	91.1	Very high	90.7	Very high	60 Å²	60	47.6 Å²	47.6	31%	0.308	25%	0.249	S	C	.	.	H	α-helix	trans	-59.4	-44.4	173.2	-71.1	165.2	0	0	0	110.1	A547 A553 G554 L556	A547-I551 WeakPolarHBondContact O-CB 3.24Å; A547-I551 WeakPolarHBondContact O-CD1 3.42Å; A547-I551 WeakPolarHBondContact O-CG1 3.29Å; A547-I551 PolarHBondContact O-N 2.99Å; I551-A553 VanDerWaalsContact C-N 3.32Å; I551-A553 PolarHBondContact O-N 2.94Å; I551-G554 PolarHBondContact O-N 2.89Å; I551-G554 VanDerWaalsContact O-N 3.15Å; I551-L556 HydrophobicContact CB-CD1 4.47Å; I551-L556 HydrophobicContact CG1-CD1 4.02Å; I551-L556 HydrophobicContact CG1-CD2 4.23Å; I551-L556 HydrophobicContact CG1-CG 3.95Å; I551-L556 HydrophobicContact CG2-CD1 3.81Å; I551-L556 HydrophobicContact CG2-CG 4.28Å
552	R	91.2	Very high	90.6	Very high	201 Å²	201	47.4 Å²	47.4	76%	0.758	25%	0.249	S	C	*	.	H	α-helix	trans	-66.6	-32.4	176.6	-72	177	-174.3	165.6	5.9	113.1	T548 V549 L550 G554	T548-R552 WeakPolarHBondContact O-CG 3.48Å; T548-R552 PolarHBondContact O-N 3.48Å; V549-R552 PolarHBondContact O-N 3.47Å; L550-R552 VanDerWaalsContact C-N 3.3Å; L550-R552 PolarHBondContact O-N 2.91Å; R552-G554 PolarHBondContact O-N 3.34Å
553	A	91.3	Very high	90.4	Very high	30 Å²	30	50.2 Å²	50.2	25%	0.248	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-2.8	174.8	0	0	0	0	0	113.5	L446 A449 V549 L550 I551	L446-A553 HydrophobicContact CD2-CB 3.76Å; A449-A553 HydrophobicContact CB-CB 3.62Å; V549-A553 WeakPolarHBondContact O-CB 3.32Å; V549-A553 PolarHBondContact O-N 2.87Å; L550-A553 CarbonylContact O-C 3.52Å; L550-A553 PolarHBondContact O-N 2.79Å; I551-A553 VanDerWaalsContact C-N 3.32Å; I551-A553 PolarHBondContact O-N 2.94Å
554	G	90.2	Very high	90.3	Very high	21 Å²	21	50.3 Å²	50.3	22%	0.216	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	95.2	15	174.9	0	0	0	0	0	115.1	L550 I551 R552 L556 C557 Q558	L550-G554 PolarHBondContact O-N 3.07Å; I551-G554 PolarHBondContact O-N 2.89Å; I551-G554 VanDerWaalsContact O-N 3.15Å; R552-G554 PolarHBondContact O-N 3.34Å; G554-L556 PolarHBondContact O-N 3.46Å; G554-C557 PolarHBondContact O-N 3.24Å; G554-C557 VanDerWaalsContact O-N 3.08Å; G554-Q558 WeakPolarHBondContact O-CG 3.41Å; G554-Q558 PolarHBondContact O-N 2.92Å
555	A	90.6	Very high	90.3	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-55.4	-36.6	-179.3	0	0	0	0	0	113.2	L446 L550 Q558 L559 L564	L446-A555 HydrophobicContact CD1-CB 4.13Å; L446-A555 HydrophobicContact CD2-CB 3.82Å; L550-A555 HydrophobicContact CB-CB 4.06Å; L550-A555 WeakPolarHBondContact O-CB 3.33Å; L550-A555 PolarHBondContact O-N 3.31Å; A555-Q558 PolarHBondContact O-N 3.48Å; A555-L559 WeakPolarHBondContact O-CB 3.44Å; A555-L559 WeakPolarHBondContact O-CG 3.38Å; A555-L559 PolarHBondContact O-N 3.45Å; A555-L564 HydrophobicContact CB-CD2 4.06Å
556	L	89.7	Confident	90.2	Very high	32 Å²	32	47.2 Å²	47.2	17%	0.168	24%	0.243	C	C	.	.	H	α-helix	trans	-65.3	-40.1	178.7	-63.4	-174.6	0	0	0	112.6	I551 G554 E560 L561 L564	I551-L556 HydrophobicContact CB-CD1 4.47Å; I551-L556 HydrophobicContact CG1-CD1 4.02Å; I551-L556 HydrophobicContact CG1-CD2 4.23Å; I551-L556 HydrophobicContact CG1-CG 3.95Å; I551-L556 HydrophobicContact CG2-CD1 3.81Å; I551-L556 HydrophobicContact CG2-CG 4.28Å; G554-L556 PolarHBondContact O-N 3.46Å; L556-E560 WeakPolarHBondContact O-CA 3.42Å; L556-E560 PolarHBondContact O-N 3.2Å; L556-L561 WeakPolarHBondContact CB-O 3.46Å; L556-L561 HydrophobicContact CD2-CB 4.07Å; L556-L561 PolarHBondContact O-N 3.36Å; L556-L564 HydrophobicContact CD2-CB 4.47Å; L556-L564 HydrophobicContact CD2-CD2 3.99Å; L556-L564 HydrophobicContact CD2-CG 4.14Å
557	C	87.6	Confident	89.9	Confident	111 Å²	111	48.4 Å²	48.4	75%	0.75	25%	0.251	S	S	*	.	H	α-helix	trans	-69.9	-43.3	177.4	-62.2	0	0	0	0	110.8	G554 L559 E560	G554-C557 PolarHBondContact O-N 3.24Å; G554-C557 VanDerWaalsContact O-N 3.08Å; C557-L559 VanDerWaalsContact C-N 3.31Å; C557-L559 PolarHBondContact O-N 2.99Å; C557-E560 PolarHBondContact O-N 3.05Å
558	Q	87.5	Confident	89.8	Confident	90 Å²	90	48.1 Å²	48.1	42%	0.421	25%	0.249	S	C	.	.	H	α-helix	trans	-66.4	-32.5	-179.7	-68.1	177.6	8.9	0	0	112.7	G554 A555	G554-Q558 WeakPolarHBondContact O-CG 3.41Å; G554-Q558 PolarHBondContact O-N 2.92Å; A555-Q558 PolarHBondContact O-N 3.48Å
559	L	88.5	Confident	89.7	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-99.2	-2.2	-179.6	-61.2	172.9	0	0	0	114.1	K431 Q434 F435 A555 C557 L561	K431-L559 PolarHBondContact NZ-O 3.41Å; Q434-L559 HydrophobicContact CB-CD2 3.92Å; F435-L559 HydrophobicContact CB-CD1 3.86Å; F435-L559 HydrophobicContact CB-CD2 4.17Å; F435-L559 HydrophobicContact CD2-CD1 3.91Å; F435-L559 HydrophobicContact CG-CD1 4.3Å; A555-L559 WeakPolarHBondContact O-CB 3.44Å; A555-L559 WeakPolarHBondContact O-CG 3.38Å; A555-L559 PolarHBondContact O-N 3.45Å; C557-L559 VanDerWaalsContact C-N 3.31Å; C557-L559 PolarHBondContact O-N 2.99Å; L559-L561 VanDerWaalsContact C-N 3.31Å; L559-L561 HydrophobicContact CB-CD1 3.75Å; L559-L561 HydrophobicContact CB-CG 3.74Å; L559-L561 HydrophobicContact CD1-CD1 4Å; L559-L561 PolarHBondContact O-N 3.41Å
560	E	88.1	Confident	89.5	Confident	128 Å²	128	46.5 Å²	46.5	60%	0.598	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.5	39.4	-175.7	-54.2	173.9	157.6	0	0	113.4	L262 K431 L556 C557	L262-E560 HydrophobicContact CD2-CB 4.48Å; L262-E560 WeakPolarHBondContact CD2-O 3.39Å; K431-E560 IonicContact NZ-OE2 2.67Å; L556-E560 WeakPolarHBondContact O-CA 3.42Å; L556-E560 PolarHBondContact O-N 3.2Å; C557-E560 PolarHBondContact O-N 3.05Å
561	L	87.8	Confident	89	Confident	12 Å²	12	48.2 Å²	48.2	6%	0.063	25%	0.247	C	C	.	.			trans	-106.4	151.8	-177.2	-58.9	177.7	0	0	0	111.1	I256 V258 L262 K431 L556 L559 L564	I256-L561 HydrophobicContact CB-CD1 4.11Å; I256-L561 HydrophobicContact CB-CD2 4.13Å; I256-L561 HydrophobicContact CD1-CD2 4.19Å; I256-L561 HydrophobicContact CG2-CD1 3.66Å; I256-L561 HydrophobicContact CG2-CD2 4.44Å; V258-L561 HydrophobicContact CG1-CD2 3.83Å; L262-L561 HydrophobicContact CD2-CD2 4.48Å; K431-L561 HydrophobicContact CD-CD2 4.3Å; K431-L561 HydrophobicContact CG-CD2 4.45Å; L556-L561 WeakPolarHBondContact CB-O 3.46Å; L556-L561 HydrophobicContact CD2-CB 4.07Å; L556-L561 PolarHBondContact O-N 3.36Å; L559-L561 VanDerWaalsContact C-N 3.31Å; L559-L561 HydrophobicContact CB-CD1 3.75Å; L559-L561 HydrophobicContact CB-CG 3.74Å; L559-L561 HydrophobicContact CD1-CD1 4Å; L559-L561 PolarHBondContact O-N 3.41Å; L561-L564 HydrophobicContact CD1-CB 4.46Å
562	Q	86.7	Confident	88.6	Confident	82 Å²	82	49.3 Å²	49.3	38%	0.383	26%	0.258	S	S	.	.	S	Bend	trans	-82.5	-29.4	169.9	-65.3	-165.2	-1.3	0	0	112.4	K257	K257-Q562 HydrophobicContact CB-CB 4.2Å; K257-Q562 HydrophobicContact CD-CB 4.11Å; K257-Q562 HydrophobicContact CG-CB 4.06Å; K257-Q562 WeakPolarHBondContact O-CB 3.09Å; K257-Q562 PolarHBondContact O-N 2.86Å
563	N	88.6	Confident	88.2	Confident	59 Å²	59	45 Å²	45	32%	0.316	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.6	163.1	177.5	-148.2	-32.5	0	0	0	109.9	K257 W317	K257-N563 HydrophobicContact CB-CB 3.73Å; K257-N563 HydrophobicContact CD-CB 4.19Å; K257-N563 PolarHBondContact N-O 3.25Å; W317-N563 HydrophobicContact CH2-CB 3.67Å; W317-N563 HydrophobicContact CZ2-CB 4.07Å; W317-N563 HydrophobicContact CZ3-CB 4.43Å
564	L	90.6	Very high	88	Confident	3 Å²	3	44.4 Å²	44.4	2%	0.016	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	155.5	175.2	64.3	83.3	0	0	0	110.4	L253 A255 A547 A555 L556 L561 L566	L253-L564 HydrophobicContact CD1-CB 3.99Å; A255-L564 CarbonylContact O-C 3.42Å; A255-L564 WeakPolarHBondContact O-CA 3.41Å; A547-L564 HydrophobicContact CB-CD1 3.96Å; A555-L564 HydrophobicContact CB-CD2 4.06Å; L556-L564 HydrophobicContact CD2-CB 4.47Å; L556-L564 HydrophobicContact CD2-CD2 3.99Å; L556-L564 HydrophobicContact CD2-CG 4.14Å; L561-L564 HydrophobicContact CD1-CB 4.46Å; L564-L566 HydrophobicContact CD1-CD1 4.35Å; L564-L566 HydrophobicContact CD1-CD2 3.96Å; L564-L566 HydrophobicContact CD1-CG 3.88Å
565	R	89.4	Confident	87.9	Confident	64 Å²	64	44 Å²	44	24%	0.242	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	141.9	170	-66	-176.4	177.3	-149.8	-6.1	109.2	L254 A255 W317	L254-R565 PolarHBondContact N-O 2.86Å; A255-R565 HydrophobicContact CB-CB 4.09Å; A255-R565 HydrophobicContact CB-CG 4.47Å; A255-R565 PolarHBondContact N-O 3.17Å; A255-R565 PolarHBondContact O-N 3.14Å; W317-R565 HydrophobicContact CH2-CG 3.97Å; W317-R565 HydrophobicContact CZ3-CG 3.84Å
566	L	90.4	Very high	87.8	Confident	1 Å²	1	50.2 Å²	50.2	1%	0.005	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	153.1	-179.8	-57.3	174.8	0	0	0	110.1	I251 Q252 L253 F435 A543 L546 A547 L550 L564 V568	I251-L566 HydrophobicContact CG2-CD1 4.28Å; I251-L566 HydrophobicContact CG2-CD2 4.29Å; Q252-L566 CarbonylContact O-C 3.53Å; Q252-L566 VanDerWaalsContact O-CA 3.31Å; Q252-L566 WeakPolarHBondContact O-CA 3.33Å; L253-L566 HydrophobicContact CD1-CD2 4.04Å; F435-L566 HydrophobicContact CE1-CD2 4.44Å; F435-L566 HydrophobicContact CZ-CD2 4.32Å; A543-L566 HydrophobicContact CB-CB 4.36Å; L546-L566 HydrophobicContact CB-CD1 4.08Å; A547-L566 HydrophobicContact CB-CD1 4.09Å; A547-L566 HydrophobicContact CB-CG 4.29Å; L550-L566 HydrophobicContact CD1-CD1 3.78Å; L564-L566 HydrophobicContact CD1-CD1 4.35Å; L564-L566 HydrophobicContact CD1-CD2 3.96Å; L564-L566 HydrophobicContact CD1-CG 3.88Å; L566-V568 HydrophobicContact CB-CG2 4.46Å
567	S	88.1	Confident	87.7	Confident	25 Å²	25	52.5 Å²	52.5	18%	0.175	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	132.5	161.1	176.8	0	0	0	0	107.3	I251 Q252	I251-S567 WeakPolarHBondContact CA-O 3.06Å; Q252-S567 PolarHBondContact N-O 2.97Å; Q252-S567 PolarHBondContact O-N 3.05Å
568	V	90.3	Very high	87.7	Confident	4 Å²	4	47.2 Å²	47.2	2%	0.024	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	126.4	-178.5	-176.3	0	0	0	0	109.1	L249 W250 I251 L542 A543 L546 L566	L249-V568 HydrophobicContact CD1-CG1 3.33Å; L249-V568 HydrophobicContact CD2-CG1 4.22Å; L249-V568 HydrophobicContact CG-CG1 3.84Å; W250-V568 CarbonylContact O-C 3.55Å; W250-V568 VanDerWaalsContact O-CA 3.26Å; W250-V568 WeakPolarHBondContact O-CA 3.39Å; I251-V568 HydrophobicContact CG1-CG1 4.43Å; I251-V568 HydrophobicContact CG1-CG2 4.27Å; I251-V568 HydrophobicContact CG2-CG2 4.36Å; L542-V568 HydrophobicContact CD2-CG1 3.74Å; L542-V568 HydrophobicContact CG-CG1 4.18Å; A543-V568 HydrophobicContact CB-CB 4.22Å; A543-V568 HydrophobicContact CB-CG2 3.75Å; L546-V568 HydrophobicContact CD1-CG2 4.1Å; L566-V568 HydrophobicContact CB-CG2 4.46Å
569	T	88.2	Confident	87.7	Confident	33 Å²	33	44.4 Å²	44.4	20%	0.202	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	144.7	-175.8	54.7	0	0	0	0	111.6	W250 F470	W250-T569 WeakPolarHBondContact CB-O 3.35Å; W250-T569 PolarHBondContact N-O 3.19Å; W250-T569 PolarHBondContact O-N 3.37Å; F470-T569 WeakPolarHBondContact CZ-OG1 3.07Å
570	L	88.9	Confident	87.7	Confident	20 Å²	20	51 Å²	51	11%	0.105	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	150.4	169.3	-69.3	167.1	0	0	0	109.3	I247 S248 L249 L502 C506 P572 V575	I247-L570 HydrophobicContact CD1-CD2 4.03Å; I247-L570 HydrophobicContact CG1-CD2 4.31Å; S248-L570 WeakPolarHBondContact O-CD2 3.33Å; L249-L570 HydrophobicContact CB-CD2 4.11Å; L249-L570 HydrophobicContact CD1-CD2 3.66Å; L249-L570 HydrophobicContact CD1-CG 3.98Å; L502-L570 HydrophobicContact CB-CD1 4.5Å; L502-L570 HydrophobicContact CD2-CD1 4.05Å; L502-L570 HydrophobicContact CD2-CD2 4.29Å; L502-L570 HydrophobicContact CG-CD1 4.06Å; C506-L570 HydrophobicContact CB-CD1 4.49Å; L570-P572 WeakPolarHBondContact O-CD 3.37Å; L570-V575 HydrophobicContact CB-CG2 3.79Å; L570-V575 HydrophobicContact CD1-CG2 4.04Å; L570-V575 HydrophobicContact CG-CG2 4.44Å
571	D	83.4	Confident	87.6	Confident	37 Å²	37	47 Å²	47	20%	0.198	24%	0.238	C	C	.	.			trans	-73.1	118.4	169.8	-174	-26.7	0	0	0	109.3	N573 E574 V575	D571-N573 PolarHBondContact O-N 3.28Å; D571-N573 WeakPolarHBondContact OD1-CB 3.37Å; D571-N573 PolarHBondContact OD1-N 3.35Å; D571-N573 PolarHBondContact OD1-ND2 3.05Å; D571-E574 HydrophobicContact CB-CB 4.09Å; D571-E574 HydrophobicContact CB-CG 3.92Å; D571-E574 PolarHBondContact O-N 3.21Å; D571-E574 VanDerWaalsContact O-N 3.17Å; D571-V575 WeakPolarHBondContact O-CG2 3.15Å; D571-V575 PolarHBondContact O-N 3.1Å
572	P	83.9	Confident	87.6	Confident	83 Å²	83	46.9 Å²	46.9	54%	0.539	24%	0.238	S	C	.	.	H	α-helix	trans	-60.3	-30.2	-179	24.9	-34.4	0	0	0	112.9	L570 Q576	L570-P572 WeakPolarHBondContact O-CD 3.37Å; P572-Q576 VanDerWaalsContact O-CG 3.31Å; P572-Q576 WeakPolarHBondContact O-CG 3.44Å; P572-Q576 PolarHBondContact O-N 3.43Å
573	N	83.2	Confident	87.5	Confident	111 Å²	111	46.8 Å²	46.8	59%	0.594	24%	0.238	S	C	*	.	H	α-helix	trans	-70.9	-41.7	178.1	-57.5	-54.6	0	0	0	111.1	D571 V575 Q576 L577	D571-N573 PolarHBondContact O-N 3.28Å; D571-N573 WeakPolarHBondContact OD1-CB 3.37Å; D571-N573 PolarHBondContact OD1-N 3.35Å; D571-N573 PolarHBondContact OD1-ND2 3.05Å; N573-V575 VanDerWaalsContact C-N 3.35Å; N573-Q576 PolarHBondContact O-N 3.39Å; N573-L577 VanDerWaalsContact O-CB 3.27Å; N573-L577 WeakPolarHBondContact O-CB 3.45Å; N573-L577 PolarHBondContact O-N 3.16Å
574	E	87.3	Confident	86.8	Confident	17 Å²	17	48.8 Å²	48.8	8%	0.079	25%	0.249	C	C	.	.	H	α-helix	trans	-66.6	-38.4	176.1	-67.2	-172	165.2	0	0	111.5	I247 S248 D571 L577 A578	I247-E574 HydrophobicContact CG2-CB 4.38Å; S248-E574 WeakPolarHBondContact CA-OE2 3.26Å; S248-E574 WeakPolarHBondContact CB-OE2 3.24Å; S248-E574 PolarHBondContact N-OE2 2.8Å; S248-E574 PolarHBondContact OG-OE1 3.06Å; S248-E574 PolarHBondContact OG-OE2 3.07Å; D571-E574 HydrophobicContact CB-CB 4.09Å; D571-E574 HydrophobicContact CB-CG 3.92Å; D571-E574 PolarHBondContact O-N 3.21Å; D571-E574 VanDerWaalsContact O-N 3.17Å; E574-L577 PolarHBondContact O-N 3.16Å; E574-A578 WeakPolarHBondContact O-CB 3.33Å; E574-A578 PolarHBondContact O-N 3.27Å
575	V	88.1	Confident	85.6	Confident	11 Å²	11	54.5 Å²	54.5	7%	0.067	28%	0.279	C	S	.	.	H	α-helix	trans	-61.7	-49.7	175.6	168.4	0	0	0	0	110.9	I499 L570 D571 N573 L577 A578 I579	I499-V575 HydrophobicContact CG2-CB 4.49Å; I499-V575 HydrophobicContact CG2-CG1 3.91Å; I499-V575 HydrophobicContact CG2-CG2 4.47Å; L570-V575 HydrophobicContact CB-CG2 3.79Å; L570-V575 HydrophobicContact CD1-CG2 4.04Å; L570-V575 HydrophobicContact CG-CG2 4.44Å; D571-V575 WeakPolarHBondContact O-CG2 3.15Å; D571-V575 PolarHBondContact O-N 3.1Å; N573-V575 VanDerWaalsContact C-N 3.35Å; V575-L577 PolarHBondContact O-N 2.94Å; V575-A578 PolarHBondContact O-N 3.22Å; V575-I579 HydrophobicContact CG1-CD1 3.78Å; V575-I579 WeakPolarHBondContact O-CB 3.49Å; V575-I579 VanDerWaalsContact O-CG1 3.28Å; V575-I579 WeakPolarHBondContact O-CG1 3.35Å; V575-I579 PolarHBondContact O-N 3.27Å
576	Q	87.5	Confident	84.2	Confident	132 Å²	132	56.6 Å²	56.6	62%	0.617	29%	0.291	S	S	*	.	H	α-helix	trans	-61.6	-44.7	177.9	-73.9	178.5	9.6	0	0	111.7	P572 N573 I579 K580	P572-Q576 VanDerWaalsContact O-CG 3.31Å; P572-Q576 WeakPolarHBondContact O-CG 3.44Å; P572-Q576 PolarHBondContact O-N 3.43Å; N573-Q576 PolarHBondContact O-N 3.39Å; Q576-I579 PolarHBondContact O-N 3.07Å; Q576-K580 WeakPolarHBondContact O-CB 3.48Å; Q576-K580 PolarHBondContact O-N 3.43Å
577	L	87.2	Confident	82.3	Confident	80 Å²	80	65.2 Å²	65.2	42%	0.419	34%	0.337	S	S	.	.	H	α-helix	trans	-61.6	-46.1	177.8	-176.4	65.2	0	0	0	111.1	N573 E574 V575 K580 E581	N573-L577 VanDerWaalsContact O-CB 3.27Å; N573-L577 WeakPolarHBondContact O-CB 3.45Å; N573-L577 PolarHBondContact O-N 3.16Å; E574-L577 PolarHBondContact O-N 3.16Å; V575-L577 PolarHBondContact O-N 2.94Å; L577-K580 PolarHBondContact O-N 2.85Å; L577-E581 HydrophobicContact CG-CG 4.49Å; L577-E581 WeakPolarHBondContact O-CB 3.44Å; L577-E581 WeakPolarHBondContact O-CG 3.45Å; L577-E581 PolarHBondContact O-N 3.13Å
578	A	87.4	Confident	82	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-65.8	-38.4	179.5	0	0	0	0	0	113	I247 I499 E574 V575 L582	I247-A578 HydrophobicContact CG2-CB 3.57Å; I499-A578 HydrophobicContact CD1-CB 3.39Å; E574-A578 WeakPolarHBondContact O-CB 3.33Å; E574-A578 PolarHBondContact O-N 3.27Å; V575-A578 PolarHBondContact O-N 3.22Å; A578-L582 WeakPolarHBondContact O-CB 3.44Å; A578-L582 VanDerWaalsContact O-CG 3.24Å; A578-L582 WeakPolarHBondContact O-CG 3.28Å; A578-L582 PolarHBondContact O-N 2.81Å
579	I	89	Confident	81.6	Confident	30 Å²	30	70.5 Å²	70.5	15%	0.154	36%	0.362	C	S	.	.	H	α-helix	trans	-65.2	-50	174.8	-70.9	167.7	0	0	0	110.1	I499 K500 V575 Q576 E581 L582 M583	I499-I579 HydrophobicContact CB-CG1 4.15Å; I499-I579 HydrophobicContact CG2-CD1 4.2Å; I499-I579 HydrophobicContact CG2-CG1 3.87Å; K500-I579 HydrophobicContact CG-CD1 3.86Å; K500-I579 HydrophobicContact CG-CG1 4.46Å; V575-I579 HydrophobicContact CG1-CD1 3.78Å; V575-I579 WeakPolarHBondContact O-CB 3.49Å; V575-I579 VanDerWaalsContact O-CG1 3.28Å; V575-I579 WeakPolarHBondContact O-CG1 3.35Å; V575-I579 PolarHBondContact O-N 3.27Å; Q576-I579 PolarHBondContact O-N 3.07Å; I579-E581 VanDerWaalsContact C-N 3.32Å; I579-E581 PolarHBondContact O-N 3.16Å; I579-L582 PolarHBondContact O-N 3.28Å; I579-M583 HydrophobicContact CG2-CG 4.33Å; I579-M583 HydrophobicContact CG2-SD 3.88Å; I579-M583 WeakPolarHBondContact O-CG 3.5Å; I579-M583 PolarHBondContact O-N 3.42Å
580	K	87.5	Confident	81.2	Confident	139 Å²	139	72.6 Å²	72.6	60%	0.604	37%	0.371	S	S	*	.	H	α-helix	trans	-57	-50.9	178	-179.3	-178.8	178.2	-177.4	0	110.4	Q576 L577 L582 M583 D584	Q576-K580 WeakPolarHBondContact O-CB 3.48Å; Q576-K580 PolarHBondContact O-N 3.43Å; L577-K580 PolarHBondContact O-N 2.85Å; K580-L582 VanDerWaalsContact C-N 3.32Å; K580-L582 PolarHBondContact O-N 2.77Å; K580-M583 PolarHBondContact O-N 3.05Å; K580-D584 VanDerWaalsContact O-CG 3.32Å; K580-D584 PolarHBondContact O-N 2.91Å
581	E	86.9	Confident	80.8	Confident	44 Å²	44	75.7 Å²	75.7	21%	0.206	39%	0.387	C	S	.	.	H	α-helix	trans	-51.8	-51.4	175.6	-85.7	171.5	180	0	0	111.1	R242 R244 G245 L577 I579 D584	R242-E581 IonicContact CZ-OE1 3.12Å; R242-E581 IonicContact CZ-OE2 3.06Å; R242-E581 IonicContact NH1-OE1 3.07Å; R242-E581 PolarHBondContact NH1-OE1 3.19Å; R242-E581 IonicContact NH1-OE2 2.91Å; R242-E581 PolarHBondContact NH1-OE2 2.67Å; R242-E581 IonicContact NH2-OE2 3.91Å; R242-E581 PolarHBondContact NH2-OE2 3.29Å; R242-E581 VanDerWaalsContact NH2-OE2 3.07Å; R244-E581 WeakPolarHBondContact CA-OE2 3.27Å; R244-E581 HydrophobicContact CG-CB 3.79Å; R244-E581 HydrophobicContact CG-CG 4.44Å; R244-E581 PolarHBondContact NE-O 3.47Å; R244-E581 PolarHBondContact NH1-O 3.37Å; R244-E581 PolarHBondContact NH2-O 3.08Å; G245-E581 PolarHBondContact N-OE2 3.07Å; L577-E581 HydrophobicContact CG-CG 4.49Å; L577-E581 WeakPolarHBondContact O-CB 3.44Å; L577-E581 WeakPolarHBondContact O-CG 3.45Å; L577-E581 PolarHBondContact O-N 3.13Å; I579-E581 VanDerWaalsContact C-N 3.32Å; I579-E581 PolarHBondContact O-N 3.16Å; E581-D584 PolarHBondContact O-N 2.96Å
582	L	87.6	Confident	80.6	Confident	10 Å²	10	78.1 Å²	78.1	5%	0.052	40%	0.399	C	S	.	.	H	α-helix	trans	-68.5	-35.1	-177.7	-71.9	172.6	0	0	0	113.9	R244 I499 A578 I579 K580 D584 L585	R244-L582 HydrophobicContact CG-CD2 4.25Å; R244-L582 VanDerWaalsContact NH2-C 3.3Å; R244-L582 PolarHBondContact NH2-O 3Å; I499-L582 HydrophobicContact CD1-CD1 3.5Å; I499-L582 VanDerWaalsContact CD1-CD1 3.5Å; I499-L582 HydrophobicContact CG1-CD1 4.18Å; A578-L582 WeakPolarHBondContact O-CB 3.44Å; A578-L582 VanDerWaalsContact O-CG 3.24Å; A578-L582 WeakPolarHBondContact O-CG 3.28Å; A578-L582 PolarHBondContact O-N 2.81Å; I579-L582 PolarHBondContact O-N 3.28Å; K580-L582 VanDerWaalsContact C-N 3.32Å; K580-L582 PolarHBondContact O-N 2.77Å; L582-D584 VanDerWaalsContact C-N 3.31Å; L582-D584 PolarHBondContact O-N 3.24Å; L582-L585 PolarHBondContact O-N 2.75Å
583	M	84.6	Confident	80.4	Confident	79 Å²	79	77.8 Å²	77.8	39%	0.389	39%	0.39	S	S	.	.	H	α-helix	trans	-64	-34.2	176.1	-73.2	-177.3	61.4	0	0	112.6	I579 K580 L585 E586 D587	I579-M583 HydrophobicContact CG2-CG 4.33Å; I579-M583 HydrophobicContact CG2-SD 3.88Å; I579-M583 WeakPolarHBondContact O-CG 3.5Å; I579-M583 PolarHBondContact O-N 3.42Å; K580-M583 PolarHBondContact O-N 3.05Å; M583-L585 PolarHBondContact O-N 2.76Å; M583-E586 PolarHBondContact O-N 2.95Å; M583-D587 PolarHBondContact O-N 3.11Å
584	D	74	Confident	80.2	Confident	102 Å²	102	75.4 Å²	75.4	55%	0.545	38%	0.375	S	S	.	.	H	α-helix	trans	-65.4	5.9	177.2	-60.9	-23.1	0	0	0	114.3	K580 E581 L582	K580-D584 VanDerWaalsContact O-CG 3.32Å; K580-D584 PolarHBondContact O-N 2.91Å; E581-D584 PolarHBondContact O-N 2.96Å; L582-D584 VanDerWaalsContact C-N 3.31Å; L582-D584 PolarHBondContact O-N 3.24Å
585	L	64.5	Low	79.6	Confident	122 Å²	122	79.9 Å²	79.9	64%	0.639	40%	0.398	S	S	*	.	H	α-helix	trans	-116.6	-22.6	169.6	-91.6	158.4	0	0	0	111.1	R244 L582 M583	R244-L585 VanDerWaalsContact NH2-CA 3.32Å; L582-L585 PolarHBondContact O-N 2.75Å; M583-L585 PolarHBondContact O-N 2.76Å
586	E	59.5	Low	78.9	Confident	108 Å²	108	85.7 Å²	85.7	51%	0.505	43%	0.425	S	S	.	.	H	α-helix	trans	-74.6	-27.4	179.5	-68	173.3	-174.9	0	0	109.4	S496 M583	S496-E586 PolarHBondContact N-OE1 2.99Å; S496-E586 PolarHBondContact OG-OE1 3.07Å; S496-E586 VanDerWaalsContact OG-OE1 3.11Å; S496-E586 PolarHBondContact OG-OE2 3.02Å; M583-E586 PolarHBondContact O-N 2.95Å
587	D	51.5	Low	78.1	Confident	182 Å²	182	81.5 Å²	81.5	97%	0.973	41%	0.408	S	S	*	.			trans	-86.8	0	162.7	-61.7	-30.2	0	0	0	111.7	M583	M583-D587 PolarHBondContact O-N 3.11Å

Retrieved 587 of 587 residues in 684.4 ms (Link to these results)

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