A0A087X6S1_POEFO Loading...

Transcriptional repressor CTCF

AlphaFold DB , UniProt , Accession A0A087X6S1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 757 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	35.6	Very low	34	Very low	214 Å²	214	142.5 Å²	142.5	100%	1.054	81%	0.813	S	S	*	*				0	75.6	0	-55	173.5	-171	0	0	107
2	E	33.8	Very low	33.7	Very low	194 Å²	194	146.3 Å²	146.3	91%	0.907	82%	0.819	S	S	*	*			cis	55.7	128.8	35.8	-53.9	153.5	136.2	0	0	109.6
3	G	37.6	Very low	33.3	Very low	74 Å²	74	142.6 Å²	142.6	76%	0.763	82%	0.818	S	S	*	*			cis	146.1	151.8	19.2	0	0	0	0	0	105
4	E	38	Very low	33.1	Very low	178 Å²	178	139.6 Å²	139.6	83%	0.832	82%	0.819	S	S	*	*			cis	-141.9	153.3	15.9	-71.5	169.9	93	0	0	107.7
5	V	37.1	Very low	32.8	Very low	127 Å²	127	136.9 Å²	136.9	77%	0.77	82%	0.819	S	S	*	*				35.5	143.6	81.6	-56.2	0	0	0	0	115.8
6	V	33.2	Very low	32.6	Very low	127 Å²	127	139.8 Å²	139.8	77%	0.77	83%	0.828	S	S	*	*			cis	-150.5	160	43.7	172.7	0	0	0	0	114.1
7	S	31	Very low	32.5	Very low	90 Å²	90	137.2 Å²	137.2	63%	0.629	83%	0.826	S	S	*	*			trans	-31.1	145.6	168.8	-41.1	0	0	0	0	120.2
8	M	34.5	Very low	32.4	Very low	175 Å²	175	136.1 Å²	136.1	86%	0.862	83%	0.826	S	S	*	*				55.2	133.8	98.7	-48.8	169.5	109.9	0	0	117.8
9	E	29.7	Very low	32.3	Very low	199 Å²	199	138.1 Å²	138.1	93%	0.93	83%	0.831	S	S	*	*				-170.2	178.9	111.2	-107.9	-165.4	126.6	0	0	112.4
10	S	32.3	Very low	32.1	Very low	106 Å²	106	134.8 Å²	134.8	74%	0.741	83%	0.826	S	S	*	*			trans	-142.5	159.6	-160.5	62.8	0	0	0	0	116.1
11	A	31.5	Very low	32.1	Very low	83 Å²	83	136.8 Å²	136.8	69%	0.686	82%	0.824	S	S	*	*			trans	87.3	149.9	146.5	0	0	0	0	0	121.6
12	Q	30.6	Very low	31.7	Very low	189 Å²	189	133 Å²	133	88%	0.883	81%	0.812	S	S	*	*			trans	62.8	110.9	149.2	-70.1	168.1	15.1	0	0	122.2
13	A	28.6	Very low	31.4	Very low	98 Å²	98	129.9 Å²	129.9	81%	0.81	80%	0.801	S	S	*	*				-137.1	111.9	128.3	0	0	0	0	0	107.4
14	A	29.5	Very low	32.2	Very low	100 Å²	100	131.6 Å²	131.6	83%	0.826	80%	0.799	S	S	*	*				68.6	101.5	66.9	0	0	0	0	0	112.2
15	A	29.1	Very low	31.8	Very low	100 Å²	100	132.6 Å²	132.6	83%	0.826	80%	0.803	S	S	*	*			trans	-96.1	148.4	175.8	0	0	0	0	0	111.3
16	L	29.1	Very low	31.5	Very low	182 Å²	182	130.4 Å²	130.4	95%	0.953	81%	0.807	S	S	*	*			trans	-146	150.7	156.4	-92	-179.1	0	0	0	109.8
17	A	32	Very low	31.2	Very low	97 Å²	97	128.1 Å²	128.1	80%	0.802	81%	0.809	S	S	*	*			trans	-124.4	155.1	177.4	0	0	0	0	0	110.5
18	S	30.5	Very low	31.1	Very low	117 Å²	117	133.4 Å²	133.4	82%	0.818	82%	0.824	S	S	*	*			trans	-166.7	135.4	161.4	60	0	0	0	0	112.5
19	D	29.3	Very low	30.8	Very low	174 Å²	174	130.1 Å²	130.1	93%	0.93	82%	0.824	S	S	*	*			trans	-77.5	175.5	176.1	-76.5	-97.8	0	0	0	115.3
20	G	29.5	Very low	30.8	Very low	71 Å²	71	127.9 Å²	127.9	73%	0.732	82%	0.818	S	S	*	*			trans	141.3	103.7	164.8	0	0	0	0	0	112.9
21	K	31.4	Very low	30.7	Very low	177 Å²	177	129.6 Å²	129.6	77%	0.77	82%	0.818	S	S	*	*			cis	100.1	115.3	33.8	-172.8	-176.1	176.7	-178.6	0	113.5
22	V	26.7	Very low	30.6	Very low	135 Å²	135	135 Å²	135	82%	0.818	83%	0.828	S	S	*	*			trans	-151.3	135	157.1	-133.7	0	0	0	0	104.8
23	L	29.2	Very low	30.5	Very low	129 Å²	129	130.8 Å²	130.8	68%	0.675	83%	0.826	S	S	*	*			cis	69.8	155.4	31.2	-59.4	-178.2	0	0	0	114.2
24	P	53.6	Low	30.6	Very low	110 Å²	110	131 Å²	131	71%	0.714	83%	0.828	S	S	*	*			cis	-130.2	-179.3	1.9	42.8	-27.6	0	0	0	115.5
25	E	29.4	Very low	30.6	Very low	198 Å²	198	135.9 Å²	135.9	93%	0.925	83%	0.834	S	S	*	*			trans	153.8	140.9	145.9	-89.3	172.9	-165.2	0	0	108.8
26	G	30	Very low	30.5	Very low	81 Å²	81	134.9 Å²	134.9	84%	0.835	83%	0.833	S	S	*	*			cis	169	138.8	-10.6	0	0	0	0	0	110.8
27	G	28.3	Very low	30.5	Very low	80 Å²	80	135.4 Å²	135.4	83%	0.825	83%	0.831	S	S	*	*			trans	131.8	135.3	172.5	0	0	0	0	0	116.3
28	E	29.5	Very low	30.5	Very low	200 Å²	200	138 Å²	138	94%	0.935	84%	0.836	S	S	*	*			trans	-111.4	164.4	177.8	-61.5	168.5	140.6	0	0	109
29	A	27.4	Very low	30.4	Very low	106 Å²	106	137.3 Å²	137.3	88%	0.876	84%	0.838	S	S	*	*				-168.6	-162	77.8	0	0	0	0	0	112.8
30	L	29.2	Very low	30.5	Very low	153 Å²	153	132.5 Å²	132.5	80%	0.801	83%	0.829	S	S	*	*			trans	-134.1	136.7	-149	-167.5	72.3	0	0	0	115.6
31	I	31	Very low	30.4	Very low	142 Å²	142	136.2 Å²	136.2	73%	0.728	83%	0.832	S	S	*	*			trans	35.5	120.9	151.1	-58.6	167.7	0	0	0	120.1
32	Q	28.3	Very low	30.6	Very low	195 Å²	195	137 Å²	137	91%	0.911	84%	0.841	S	S	*	*				-159.5	168.6	116	-119.2	164.3	19.2	0	0	112.7
33	A	29.7	Very low	30.7	Very low	101 Å²	101	137.6 Å²	137.6	84%	0.835	84%	0.84	S	S	*	*			trans	-131.2	154.5	-167	0	0	0	0	0	113.1
34	A	29.2	Very low	30.8	Very low	103 Å²	103	138.5 Å²	138.5	85%	0.851	84%	0.842	S	S	*	*			trans	-143.5	158.7	169.6	0	0	0	0	0	109.9
35	Q	29.5	Very low	29.8	Very low	202 Å²	202	142 Å²	142	94%	0.944	85%	0.851	S	S	*	*			trans	-96	158.3	-165.6	-65.2	155.6	-44.3	0	0	113.5
36	G	28.5	Very low	30	Very low	79 Å²	79	138 Å²	138	81%	0.814	84%	0.84	S	S	*	*			trans	-175.6	118.3	170.2	0	0	0	0	0	111.6
37	E	29	Very low	30.2	Very low	194 Å²	194	141.5 Å²	141.5	91%	0.907	84%	0.837	S	S	*	*			trans	-99.6	133.8	-171.1	-57	167.7	109.5	0	0	112.9
38	V	31.4	Very low	30.4	Very low	151 Å²	151	144.7 Å²	144.7	92%	0.915	83%	0.834	S	S	*	*			trans	-148.8	141.6	142.1	-173	0	0	0	0	107.6
39	A	28.2	Very low	30.7	Very low	103 Å²	103	138.9 Å²	138.9	85%	0.851	82%	0.821	S	S	*	*			trans	-107.2	171.5	-173.4	0	0	0	0	0	114.3
40	G	30.8	Very low	30.9	Very low	73 Å²	73	141.7 Å²	141.7	75%	0.753	82%	0.821	S	S	*	*			trans	115.4	70.1	177.8	0	0	0	0	0	112.7
41	D	28.6	Very low	31	Very low	149 Å²	149	141.2 Å²	141.2	80%	0.797	82%	0.819	S	S	*	*				72.5	94.7	56.8	-165.8	13.9	0	0	0	114.8
42	M	34.2	Very low	32	Very low	192 Å²	192	138.9 Å²	138.9	95%	0.946	81%	0.813	S	S	*	*				-158.5	147.9	124.2	-112.9	-170.8	174.8	0	0	110.2
43	N	30.1	Very low	32.2	Very low	148 Å²	148	135.5 Å²	135.5	79%	0.791	81%	0.806	S	S	*	*			trans	-110.1	161.9	-158.8	-152.2	-6.3	0	0	0	114.5
44	M	30.2	Very low	32.4	Very low	148 Å²	148	137.7 Å²	137.7	73%	0.729	80%	0.803	S	S	*	*			trans	-63.9	155.3	167.5	-80.1	165.8	36.7	0	0	112.2
45	M	32.3	Very low	32.6	Very low	185 Å²	185	138.8 Å²	138.8	91%	0.911	79%	0.793	S	S	*	*				-156.9	171.2	126.9	-109.1	166.8	-160.8	0	0	112
46	V	35.4	Very low	32.8	Very low	113 Å²	113	137 Å²	137	69%	0.685	79%	0.785	S	S	*	*			trans	-143.2	172.3	-160.6	-170	0	0	0	0	108.9
47	M	33.6	Very low	33.1	Very low	155 Å²	155	141.1 Å²	141.1	76%	0.764	79%	0.785	S	S	*	*			trans	80.9	152.6	169.5	-42.5	-165.2	91.4	0	0	114.2
48	D	32.2	Very low	33.2	Very low	146 Å²	146	140.2 Å²	140.2	78%	0.781	78%	0.778	S	S	*	*			cis	-148.8	-162.5	-9.9	-125.9	-6.8	0	0	0	111.3
49	A	35.9	Very low	33	Very low	79 Å²	79	138.3 Å²	138.3	65%	0.653	77%	0.767	S	S	*	*			trans	-113.2	170.9	-168.4	0	0	0	0	0	116.1
50	L	31.2	Very low	32.9	Very low	165 Å²	165	139.7 Å²	139.7	86%	0.864	76%	0.756	S	S	*	*			trans	72.7	153.2	168.4	-54.2	177.5	0	0	0	116.4
51	D	31	Very low	32.8	Very low	143 Å²	143	142.8 Å²	142.8	77%	0.765	76%	0.76	S	S	*	*			cis	-151.1	-142.2	-35.9	-154.4	16.1	0	0	0	108.4
52	P	53.6	Low	32.7	Very low	93 Å²	93	143.9 Å²	143.9	60%	0.604	77%	0.765	S	S	*	*			trans	-127.6	-169.3	-146.6	36	-11.2	0	0	0	117.3
53	T	31.4	Very low	32.4	Very low	124 Å²	124	144 Å²	144	76%	0.761	76%	0.763	S	S	*	*			trans	94.8	150.3	160.9	76.1	0	0	0	0	120.6
54	L	33.3	Very low	32.3	Very low	147 Å²	147	140.9 Å²	140.9	77%	0.77	77%	0.766	S	S	*	*			trans	102	124.3	155.7	-71.1	170	0	0	0	121.7
55	L	34.9	Very low	31.9	Very low	125 Å²	125	138.1 Å²	138.1	65%	0.654	78%	0.776	S	S	*	*			trans	70	124.8	156.6	-57.4	166.4	0	0	0	116.8
56	Q	33	Very low	31.6	Very low	166 Å²	166	133.2 Å²	133.2	78%	0.776	77%	0.772	S	S	*	*				67.3	142.9	61.1	-62.5	-177.9	4.7	0	0	111.8
57	M	34.3	Very low	31.1	Very low	164 Å²	164	134.4 Å²	134.4	81%	0.808	78%	0.78	S	S	*	*			cis	-170.5	155.9	32	28.5	-179.8	162.2	0	0	112.3
58	K	30.8	Very low	30.7	Very low	175 Å²	175	134 Å²	134	76%	0.761	79%	0.786	S	S	*	*			trans	63.7	160.9	165.1	-89	-169.2	169.1	-157.5	0	117.4	E60	K58-E60 WeakPolarHBondContact CD-OE1 3.47Å; K58-E60 VanDerWaalsContact CE-OE1 3.26Å; K58-E60 WeakPolarHBondContact CE-OE1 3.5Å; K58-E60 IonicContact NZ-OE1 2.65Å; K58-E60 PolarHBondContact NZ-OE1 3.04Å
59	T	27.3	Very low	30.3	Very low	112 Å²	112	132.9 Å²	132.9	69%	0.687	78%	0.784	S	S	*	*			cis	-132.3	138	20.2	47.3	0	0	0	0	112.9
60	E	26.7	Very low	29.8	Very low	131 Å²	131	134.9 Å²	134.9	61%	0.612	79%	0.788	S	S	*	*				65.3	107.7	103.8	-55.3	166.1	-161.3	0	0	114.8	K58	K58-E60 WeakPolarHBondContact CD-OE1 3.47Å; K58-E60 VanDerWaalsContact CE-OE1 3.26Å; K58-E60 WeakPolarHBondContact CE-OE1 3.5Å; K58-E60 IonicContact NZ-OE1 2.65Å; K58-E60 PolarHBondContact NZ-OE1 3.04Å
61	V	28.3	Very low	29.5	Very low	138 Å²	138	133.4 Å²	133.4	84%	0.836	79%	0.786	S	S	*	*				91.5	116.3	59.6	166.4	0	0	0	0	113.7
62	L	27.4	Very low	29.4	Very low	173 Å²	173	130.5 Å²	130.5	91%	0.906	79%	0.79	S	S	*	*			trans	-167.7	151.2	141.6	-110.3	168.7	0	0	0	111.1
63	E	27.3	Very low	28.2	Very low	194 Å²	194	129 Å²	129	91%	0.907	79%	0.791	S	S	*	*			trans	-102.7	159.4	-176.3	-62.7	176.2	112.5	0	0	112.7
64	G	27.3	Very low	28.1	Very low	83 Å²	83	130.2 Å²	130.2	86%	0.856	79%	0.793	S	S	*	*			trans	-177.5	99.4	171.5	0	0	0	0	0	113
65	G	23.7	Very low	28	Very low	90 Å²	90	131.1 Å²	131.1	93%	0.928	79%	0.793	S	S	*	*			trans	-94.5	151.3	179	0	0	0	0	0	113.7
66	G	24.4	Very low	27.8	Very low	81 Å²	81	128.9 Å²	128.9	84%	0.835	80%	0.801	S	S	*	*			trans	-167.3	118.4	172.8	0	0	0	0	0	112.2
67	T	25.8	Very low	27.8	Very low	139 Å²	139	129.2 Å²	129.2	85%	0.853	80%	0.802	S	S	*	*			trans	-106.1	127.4	-178.9	51.7	0	0	0	0	111.7
68	V	24.6	Very low	27.7	Very low	147 Å²	147	128.5 Å²	128.5	89%	0.891	80%	0.8	S	S	*	*			trans	-136.4	141.2	162.6	-179.3	0	0	0	0	108.4
69	T	23.8	Very low	27.6	Very low	122 Å²	122	127.4 Å²	127.4	75%	0.748	80%	0.801	S	S	*	*			trans	-112.2	159.4	-178.5	49.6	0	0	0	0	111.2
70	V	26.1	Very low	27.6	Very low	121 Å²	121	127.6 Å²	127.6	73%	0.733	80%	0.802	S	S	*	*			trans	158.9	109	132	159.2	0	0	0	0	113.3
71	T	25.3	Very low	27.6	Very low	133 Å²	133	129.1 Å²	129.1	82%	0.816	81%	0.814	S	S	*	*			trans	52.8	139.8	146	65.3	0	0	0	0	124.5
72	G	27.4	Very low	27.6	Very low	82 Å²	82	130.7 Å²	130.7	85%	0.845	81%	0.812	S	S	*	*			trans	105.5	118	163.6	0	0	0	0	0	112.9
73	G	28.3	Very low	27.7	Very low	61 Å²	61	129.5 Å²	129.5	63%	0.629	81%	0.812	S	S	*	*			cis	102.9	122.6	2.8	0	0	0	0	0	112.5
74	D	29.3	Very low	28.1	Very low	150 Å²	150	125.4 Å²	125.4	80%	0.802	80%	0.8	S	S	*	*			cis	-146.6	147.9	1.6	-76	-56.9	0	0	0	113.5
75	E	32.1	Very low	28.5	Very low	166 Å²	166	128.4 Å²	128.4	78%	0.776	80%	0.796	S	S	*	*			trans	48.3	109.9	143.5	-60.2	-175.7	161.3	0	0	122.4
76	G	30.6	Very low	29	Very low	79 Å²	79	132.2 Å²	132.2	81%	0.814	79%	0.792	S	S	*	*			trans	-120.9	102.8	150.4	0	0	0	0	0	109.9
77	Q	33.9	Very low	29.6	Very low	173 Å²	173	136.5 Å²	136.5	81%	0.808	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-88.4	135.7	-167.5	-141.2	174.4	49.1	0	0	112.6
78	I	32.1	Very low	30	Very low	149 Å²	149	138.8 Å²	138.8	76%	0.764	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-101.6	121.5	-178.5	-59.2	174	0	0	0	109.3
79	I	28.7	Very low	30.5	Very low	151 Å²	151	140.8 Å²	140.8	77%	0.774	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-86.5	117.2	174.7	-59.5	176.5	0	0	0	109.6
80	T	27.2	Very low	30.8	Very low	117 Å²	117	140.3 Å²	140.3	72%	0.718	80%	0.799	S	S	*	*			trans	-100.3	111.2	170.5	43.7	0	0	0	0	110.4	Q82	T80-Q82 PolarHBondContact O-N 2.74Å
81	L	26.3	Very low	30.9	Very low	163 Å²	163	137.4 Å²	137.4	85%	0.853	79%	0.793	S	S	*	*			trans	-78.2	114.4	173.5	-75.7	166.2	0	0	0	110.3
82	Q	27.9	Very low	31.1	Very low	171 Å²	171	135.7 Å²	135.7	80%	0.799	79%	0.793	S	S	*	*			trans	-86.3	136.7	166.6	-69.5	-177.9	-27.1	0	0	109.9	T80	T80-Q82 PolarHBondContact O-N 2.74Å
83	V	30.4	Very low	31.3	Very low	148 Å²	148	135.9 Å²	135.9	90%	0.897	79%	0.786	S	S	*	*			trans	-107.3	113.1	165.1	179.6	0	0	0	0	107.1
84	V	35.7	Very low	31.7	Very low	108 Å²	108	141.5 Å²	141.5	66%	0.655	80%	0.801	S	S	*	*			trans	-110.3	127.9	176	-179.3	0	0	0	0	107.9
85	N	34.4	Very low	31.8	Very low	146 Å²	146	138 Å²	138	78%	0.781	80%	0.801	S	S	*	*			trans	-79.2	134.4	178.3	-163	49.3	0	0	0	110.1	E87	N85-E87 PolarHBondContact ND2-O 3.27Å
86	M	34.7	Very low	31.9	Very low	170 Å²	170	139 Å²	139	84%	0.837	81%	0.811	S	S	*	*			trans	-134.4	62	-170.8	-113.9	-67.4	154.5	0	0	112.5
87	E	37.1	Very low	31.8	Very low	171 Å²	171	138.9 Å²	138.9	80%	0.799	81%	0.809	S	S	*	*			trans	-177.2	133.2	161.5	-103.1	161.5	-153.5	0	0	105.1	N85	N85-E87 PolarHBondContact ND2-O 3.27Å
88	E	33.5	Very low	31.8	Very low	187 Å²	187	139.9 Å²	139.9	87%	0.874	81%	0.814	S	S	*	*			cis	-117.7	154.9	4.1	-56.9	162.6	93.4	0	0	111.4
89	Q	35.4	Very low	31.6	Very low	189 Å²	189	141 Å²	141	88%	0.883	82%	0.821	S	S	*	*			trans	-148.2	115.6	147.8	-112.3	-161.6	16.4	0	0	112.7
90	A	29.8	Very low	31.6	Very low	111 Å²	111	142.5 Å²	142.5	92%	0.917	82%	0.824	S	S	*	*			trans	-138.6	75.1	162.3	0	0	0	0	0	108.9
91	G	28.6	Very low	31.5	Very low	60 Å²	60	144.9 Å²	144.9	62%	0.619	83%	0.832	S	S	*	*	S	Bend	trans	171.2	79.8	-176.8	0	0	0	0	0	116.9
92	A	29.8	Very low	31.5	Very low	98 Å²	98	143.2 Å²	143.2	81%	0.81	83%	0.828	S	S	*	*			trans	51	108.6	151.6	0	0	0	0	0	121.4
93	A	31.8	Very low	31.4	Very low	85 Å²	85	144 Å²	144	70%	0.702	83%	0.832	S	S	*	*				78	110.7	122.5	0	0	0	0	0	122.4
94	L	35.7	Very low	31.3	Very low	179 Å²	179	143 Å²	143	94%	0.937	83%	0.826	S	S	*	*			trans	68.5	127.8	133.8	-56.8	172.4	0	0	0	120.4
95	G	32.7	Very low	31.2	Very low	78 Å²	78	143.4 Å²	143.4	80%	0.804	83%	0.83	S	S	*	*			trans	144.1	47.1	155.9	0	0	0	0	0	118.7	G97	G95-G97 PolarHBondContact O-N 3.22Å
96	L	32.9	Very low	30.9	Very low	186 Å²	186	143.1 Å²	143.1	97%	0.974	83%	0.833	S	S	*	*			trans	-78.9	111.6	174.1	-72.7	178	0	0	0	112.3
97	G	30.1	Very low	30.7	Very low	76 Å²	76	141.3 Å²	141.3	78%	0.784	83%	0.832	S	S	*	*			trans	-92	137.9	163.7	0	0	0	0	0	111.3	G95	G95-G97 PolarHBondContact O-N 3.22Å
98	Q	34.2	Very low	30.7	Very low	195 Å²	195	139.6 Å²	139.6	91%	0.911	83%	0.834	S	S	*	*			trans	-87.5	138.2	-171.7	-156.7	172.7	19.3	0	0	112
99	L	27.2	Very low	30.6	Very low	173 Å²	173	137 Å²	137	91%	0.906	83%	0.831	S	S	*	*			trans	-132.9	156.4	169.7	-82	176.1	0	0	0	111.4
100	Q	28	Very low	30.3	Very low	181 Å²	181	134 Å²	134	85%	0.846	83%	0.826	S	S	*	*			trans	-123.2	132.4	-154.2	-173.5	176.1	5.3	0	0	111.2
101	L	25.7	Very low	30.3	Very low	168 Å²	168	135.8 Å²	135.8	88%	0.88	83%	0.825	S	S	*	*			trans	-86.2	149.2	173.8	-81.8	89.7	0	0	0	111.9
102	V	25.5	Very low	30.3	Very low	128 Å²	128	142.4 Å²	142.4	78%	0.776	84%	0.839	S	S	*	*			trans	-128.1	134.9	170.2	177.4	0	0	0	0	108.2
103	Q	27.2	Very low	30.3	Very low	188 Å²	188	141 Å²	141	88%	0.879	84%	0.835	S	S	*	*			trans	-109.8	148.8	172.4	-81.5	179.6	-36.4	0	0	110.5
104	V	26.5	Very low	30.1	Very low	126 Å²	126	144.2 Å²	144.2	76%	0.764	84%	0.839	S	S	*	*			trans	-135.4	125.3	172.6	-177.8	0	0	0	0	108.6
105	P	33.7	Very low	29.8	Very low	116 Å²	116	144.2 Å²	144.2	75%	0.753	84%	0.835	S	S	*	*			trans	-84	158.8	175.6	34.6	-34.8	0	0	0	111.9
106	V	29.3	Very low	29.6	Very low	140 Å²	140	144.4 Å²	144.4	85%	0.848	83%	0.829	S	S	*	*			trans	-128.2	130.1	173.3	-178.5	0	0	0	0	109.3
107	T	31.2	Very low	29.3	Very low	133 Å²	133	141.6 Å²	141.6	82%	0.816	82%	0.819	S	S	*	*			trans	-107.6	156.1	-179.4	50	0	0	0	0	112.2
108	T	37.1	Very low	29.1	Very low	135 Å²	135	146.2 Å²	146.2	83%	0.828	82%	0.818	S	S	*	*			trans	-99.8	133.7	-165	51.2	0	0	0	0	115.2
109	T	31.2	Very low	28.8	Very low	132 Å²	132	141.9 Å²	141.9	81%	0.81	80%	0.804	S	S	*	*			trans	-153.5	156.5	166.4	50.8	0	0	0	0	110.2
110	T	28.7	Very low	28.8	Very low	127 Å²	127	141.2 Å²	141.2	78%	0.779	80%	0.797	S	S	*	*			cis	-162.7	130.4	-35.9	26.3	0	0	0	0	106.7
111	V	29.9	Very low	28.8	Very low	147 Å²	147	136.1 Å²	136.1	89%	0.891	79%	0.785	S	S	*	*			trans	-143.1	121	169.3	-175.5	0	0	0	0	110.4
112	E	29.1	Very low	29	Very low	199 Å²	199	134.2 Å²	134.2	93%	0.93	79%	0.787	S	S	*	*			trans	-110.1	156.9	165	-65.7	-173.1	120.7	0	0	109.7
113	G	28.4	Very low	29.1	Very low	69 Å²	69	132.1 Å²	132.1	71%	0.711	79%	0.79	S	S	*	*			trans	165.1	61.4	173.5	0	0	0	0	0	119
114	L	28.6	Very low	29.1	Very low	152 Å²	152	128 Å²	128	80%	0.796	79%	0.789	S	S	*	*			trans	64.3	121.7	157.8	-51.3	172.9	0	0	0	117
115	Q	28.6	Very low	29.2	Very low	180 Å²	180	129.9 Å²	129.9	84%	0.841	80%	0.795	S	S	*	*				67.9	123	58.9	-166.9	-178.5	23.9	0	0	112.2
116	A	28.2	Very low	29.2	Very low	82 Å²	82	132.6 Å²	132.6	68%	0.678	79%	0.794	S	S	*	*			cis	-145.8	-171.4	-4.6	0	0	0	0	0	108.5
117	T	26.6	Very low	29.2	Very low	126 Å²	126	133.3 Å²	133.3	77%	0.773	79%	0.794	S	S	*	*			cis	-159.2	138.3	43.5	45.7	0	0	0	0	110.4
118	F	27.2	Very low	29.1	Very low	174 Å²	174	131.9 Å²	131.9	76%	0.763	80%	0.795	S	S	*	*				63.9	125.9	91.5	-136.1	-133.5	0	0	0	112.7
119	V	27.1	Very low	28.7	Very low	103 Å²	103	134 Å²	134	62%	0.624	80%	0.796	S	S	*	*			cis	-145.5	132.7	31.3	164.2	0	0	0	0	107.9
120	E	28	Very low	28.9	Very low	159 Å²	159	133.4 Å²	133.4	74%	0.743	79%	0.794	S	S	*	*				62	145.2	92	-116.8	176.8	-127.2	0	0	114.9
121	A	28.3	Very low	29	Very low	74 Å²	74	133.4 Å²	133.4	61%	0.612	79%	0.794	S	S	*	*			cis	-153.6	157.7	15.1	0	0	0	0	0	115.1
122	S	28.8	Very low	28.9	Very low	129 Å²	129	133.9 Å²	133.9	90%	0.902	79%	0.79	S	S	*	*			trans	47.7	128.7	141.3	-59.2	0	0	0	0	123.2
123	G	28.2	Very low	28.7	Very low	83 Å²	83	129.6 Å²	129.6	86%	0.856	78%	0.781	S	S	*	*			trans	179	59.9	167.2	0	0	0	0	0	114.1
124	A	27	Very low	28.7	Very low	103 Å²	103	135 Å²	135	85%	0.851	79%	0.787	S	S	*	*			trans	-87.5	126.7	179	0	0	0	0	0	111.9
125	N	28.6	Very low	28.9	Very low	165 Å²	165	134.2 Å²	134.2	88%	0.882	79%	0.788	S	S	*	*			trans	-148.7	162.4	156.2	-141.7	-11.3	0	0	0	109.7
126	K	33.9	Very low	29.2	Very low	172 Å²	172	133.3 Å²	133.3	75%	0.748	79%	0.788	S	S	*	*			trans	-109.4	173	-170.6	-59.7	-176.3	177.6	-178.1	0	113.1
127	D	29.3	Very low	29.5	Very low	156 Å²	156	135.3 Å²	135.3	83%	0.834	80%	0.795	S	S	*	*			trans	65.2	81.3	153.8	-48.2	-38.1	0	0	0	116.6
128	A	29.4	Very low	29.9	Very low	103 Å²	103	137.1 Å²	137.1	85%	0.851	80%	0.799	S	S	*	*			trans	-147.8	153.4	159.1	0	0	0	0	0	110
129	E	28.7	Very low	30.7	Very low	178 Å²	178	133.6 Å²	133.6	83%	0.832	79%	0.793	S	S	*	*			trans	-81	151	-162.8	-62.9	156.3	129.2	0	0	114.6	V131	E129-V131 PolarHBondContact O-N 2.99Å; E129-V131 VanDerWaalsContact O-N 3.17Å
130	P	35.5	Very low	31.4	Very low	121 Å²	121	138.1 Å²	138.1	79%	0.786	81%	0.808	S	S	*	*			trans	-74.9	102.8	174.1	30.5	-33.5	0	0	0	111.5	I132	P130-I132 PolarHBondContact O-N 3.31Å
131	V	28.8	Very low	32.4	Very low	126 Å²	126	134.4 Å²	134.4	76%	0.764	81%	0.812	S	S	*	*			trans	-60.7	126.4	177.9	177.9	0	0	0	0	111.8	E129	E129-V131 PolarHBondContact O-N 2.99Å; E129-V131 VanDerWaalsContact O-N 3.17Å
132	I	28.4	Very low	32.7	Very low	158 Å²	158	139.8 Å²	139.8	81%	0.81	82%	0.822	S	S	*	*			trans	-85.4	118.3	175.5	-59.8	173.3	0	0	0	109.6	P130	P130-I132 PolarHBondContact O-N 3.31Å
133	C	26	Very low	33.2	Very low	109 Å²	109	141.9 Å²	141.9	74%	0.736	82%	0.817	S	S	*	*			trans	-107.8	97.8	176.3	-75.8	0	0	0	0	111.9
134	H	26.7	Very low	33.6	Very low	183 Å²	183	144.5 Å²	144.5	85%	0.847	82%	0.816	S	S	*	*			trans	35.7	108.5	163.1	-61.1	-50.2	0	0	0	119.8
135	T	33.8	Very low	34.2	Very low	134 Å²	134	143.7 Å²	143.7	82%	0.822	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-63	140.6	158.3	44.8	0	0	0	0	112.4
136	L	34.6	Very low	34.7	Very low	161 Å²	161	145 Å²	145	84%	0.843	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-85.2	145.1	160.8	-72.2	165.8	0	0	0	109.6
137	P	34.3	Very low	34.9	Very low	125 Å²	125	141.4 Å²	141.4	81%	0.812	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-69.3	145.6	178.4	28.8	-34.7	0	0	0	112
138	L	35.1	Very low	35.8	Very low	163 Å²	163	136 Å²	136	85%	0.853	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-100.2	160.8	170.6	-76.7	166.5	0	0	0	110.4
139	P	44.9	Very low	36.6	Very low	100 Å²	100	136.4 Å²	136.4	65%	0.649	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-72.3	156	-170.7	-17.6	32.7	0	0	0	114.5
140	E	42	Very low	37.5	Very low	199 Å²	199	135 Å²	135	93%	0.93	77%	0.773	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.7	142.6	171.1	-62.3	164.8	160.5	0	0	111.6
141	G	47.2	Very low	38.1	Very low	80 Å²	80	132.1 Å²	132.1	83%	0.825	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	119.6	-2.2	175.5	0	0	0	0	0	116.6
142	F	36.2	Very low	38.5	Very low	188 Å²	188	133.6 Å²	133.6	83%	0.825	76%	0.764	S	S	*	*			trans	-113.7	120.8	176.3	-71.6	-89.8	0	0	0	111.7
143	Q	39	Very low	39.1	Very low	173 Å²	173	129.9 Å²	129.9	81%	0.808	75%	0.748	S	S	*	*			trans	-99	130.1	175.5	-158.8	171.4	26	0	0	110.1
144	V	36.1	Very low	39.6	Very low	137 Å²	137	133.2 Å²	133.2	83%	0.83	75%	0.753	S	S	*	*			trans	-104.4	111.4	-176.2	-180	0	0	0	0	109.8
145	V	39.8	Very low	40.2	Very low	87 Å²	87	130.5 Å²	130.5	53%	0.527	75%	0.75	S	S	.	*			trans	-95.6	128.3	175.9	-178.9	0	0	0	0	109.7	V153	V145-V153 HydrophobicContact CG1-CG1 3.5Å
146	K	38.4	Very low	40.5	Very low	193 Å²	193	129.3 Å²	129.3	84%	0.839	74%	0.742	S	S	*	*			trans	-99.8	105.5	-178.9	-173.6	-178.4	179.7	-175.9	0	110.3
147	V	39.1	Very low	40.7	Very low	96 Å²	96	129.8 Å²	129.8	58%	0.582	74%	0.74	S	S	*	*			trans	-82.8	127.3	176.5	-172	0	0	0	0	109.9	V153	V147-V153 HydrophobicContact CG1-CG2 4.28Å; V147-V153 HydrophobicContact CG2-CG2 4.11Å
148	G	47.3	Very low	41.3	Very low	41 Å²	41	131.8 Å²	131.8	42%	0.423	74%	0.738	S	S	.	*			trans	-76	156.9	172.8	0	0	0	0	0	112.2	N150 G151	G148-N150 PolarHBondContact O-N 3.43Å; G148-G151 PolarHBondContact O-N 2.89Å
149	A	45.9	Very low	41.6	Very low	112 Å²	112	132.2 Å²	132.2	93%	0.926	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.2	-3.6	-180	0	0	0	0	0	115
150	N	49.5	Very low	41.6	Very low	149 Å²	149	134.9 Å²	134.9	80%	0.797	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.7	-5.6	179.9	-57.9	5.2	0	0	0	113	G148	G148-N150 PolarHBondContact O-N 3.43Å
151	G	46.8	Very low	41.7	Very low	60 Å²	60	132 Å²	132	62%	0.619	73%	0.73	S	S	*	*	S	Bend	trans	88.8	4.6	176	0	0	0	0	0	116.6	G148	G148-G151 PolarHBondContact O-N 2.89Å
152	E	37.1	Very low	41.5	Very low	158 Å²	158	134.4 Å²	134.4	74%	0.738	72%	0.72	S	S	*	*			trans	-88.4	150.2	173.4	-68.9	175.5	149.7	0	0	111.6
153	V	40.6	Very low	41.7	Very low	80 Å²	80	128.3 Å²	128.3	49%	0.485	70%	0.704	S	S	.	*			trans	-136.6	109.8	-175	178.6	0	0	0	0	108.8	V145 V147	V145-V153 HydrophobicContact CG1-CG1 3.5Å; V147-V153 HydrophobicContact CG1-CG2 4.28Å; V147-V153 HydrophobicContact CG2-CG2 4.11Å
154	E	37.3	Very low	41.9	Very low	178 Å²	178	122.7 Å²	122.7	83%	0.832	69%	0.687	S	S	*	*			trans	-100.2	141.3	171.9	-70.2	-174.3	125.3	0	0	110.9
155	T	38.2	Very low	42.1	Very low	127 Å²	127	121.4 Å²	121.4	78%	0.779	67%	0.672	S	S	*	*			trans	-100.7	108	173.9	49.8	0	0	0	0	109.4
156	V	41.7	Very low	42.3	Very low	108 Å²	108	122 Å²	122	66%	0.655	67%	0.672	S	S	*	*			trans	-84	129.3	171.5	-179.4	0	0	0	0	108.8
157	E	37.7	Very low	42.7	Very low	171 Å²	171	120.1 Å²	120.1	80%	0.799	67%	0.666	S	S	*	*			trans	-78.2	156	179.3	-63.4	-166.8	131.3	0	0	112	E159	E157-E159 VanDerWaalsContact C-N 3.28Å; E157-E159 PolarHBondContact O-N 2.84Å; E157-E159 VanDerWaalsContact O-N 3.14Å
158	Q	47.4	Very low	42.7	Very low	167 Å²	167	122.3 Å²	122.3	78%	0.78	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.2	13.3	-157.1	-155.9	168	-7.8	0	0	115.1
159	E	42	Very low	42.2	Very low	173 Å²	173	127.5 Å²	127.5	81%	0.808	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.1	-30.4	-175.4	-61.6	-166.7	142.4	0	0	113.9	E157 L161 Q162	E157-E159 VanDerWaalsContact C-N 3.28Å; E157-E159 PolarHBondContact O-N 2.84Å; E157-E159 VanDerWaalsContact O-N 3.14Å; E159-L161 PolarHBondContact O-N 2.81Å; E159-Q162 PolarHBondContact O-N 3.34Å
160	E	44.3	Very low	41.8	Very low	155 Å²	155	126.1 Å²	126.1	72%	0.724	68%	0.676	S	S	*	*	H	α-helix	trans	-72.4	-26.9	-177.4	-67.7	-169.1	127.6	0	0	114.1	Q162	E160-Q162 VanDerWaalsContact C-N 3.32Å; E160-Q162 PolarHBondContact O-N 3.42Å
161	L	44.1	Very low	41.2	Very low	140 Å²	140	123.6 Å²	123.6	73%	0.733	67%	0.666	S	S	*	*	H	α-helix	trans	-76.8	-16.6	179	-75.9	172	0	0	0	113.8	E159	E159-L161 PolarHBondContact O-N 2.81Å
162	Q	42.1	Very low	40.6	Very low	129 Å²	129	129.2 Å²	129.2	60%	0.603	68%	0.676	S	S	*	*	H	α-helix	trans	-76.9	-45.8	175.9	-161.4	71	35	0	0	110.3	E159 E160 A164 H165	E159-Q162 PolarHBondContact O-N 3.34Å; E160-Q162 VanDerWaalsContact C-N 3.32Å; E160-Q162 PolarHBondContact O-N 3.42Å; Q162-A164 PolarHBondContact O-N 3.25Å; Q162-H165 PolarHBondContact O-N 2.86Å
163	A	41.9	Very low	40.2	Very low	61 Å²	61	131 Å²	131	50%	0.504	68%	0.684	S	S	.	*	H	α-helix	trans	-59.3	-43.4	-179.1	0	0	0	0	0	113.1	H165 D166 E167	A163-H165 PolarHBondContact O-N 3.16Å; A163-D166 PolarHBondContact O-N 3.04Å; A163-E167 PolarHBondContact O-N 3.37Å
164	A	41.7	Very low	39.6	Very low	54 Å²	54	136.6 Å²	136.6	45%	0.446	71%	0.705	S	S	.	*	H	α-helix	trans	-69.5	-14.1	-179	0	0	0	0	0	114.5	Q162	Q162-A164 PolarHBondContact O-N 3.25Å
165	H	41.1	Very low	39.3	Very low	111 Å²	111	137.4 Å²	137.4	51%	0.514	71%	0.709	S	S	.	*	H	α-helix	trans	-84.8	-41.2	174.6	-171.3	-74.4	0	0	0	111.5	Q162 A163 L168	Q162-H165 PolarHBondContact O-N 2.86Å; A163-H165 PolarHBondContact O-N 3.16Å; H165-L168 PolarHBondContact O-N 2.89Å
166	D	44.9	Very low	38.8	Very low	99 Å²	99	140.7 Å²	140.7	53%	0.529	72%	0.715	S	S	.	*	H	α-helix	trans	-72.5	-33.6	-178.8	-69.7	-34.6	0	0	0	112.3	A163 L168 Q169	A163-D166 PolarHBondContact O-N 3.04Å; D166-L168 VanDerWaalsContact C-N 3.26Å; D166-L168 PolarHBondContact O-N 3.47Å; D166-Q169 PolarHBondContact O-N 2.95Å
167	E	45.6	Very low	38.3	Very low	154 Å²	154	144.2 Å²	144.2	72%	0.72	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.5	-27.2	174.2	-74.5	-164.7	127.2	0	0	113.8	A163	A163-E167 PolarHBondContact O-N 3.37Å
168	L	39.1	Very low	37.9	Very low	141 Å²	141	143.3 Å²	143.3	74%	0.738	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	-10	-179.5	-79.4	171.5	0	0	0	114.3	H165 D166	H165-L168 PolarHBondContact O-N 2.89Å; D166-L168 VanDerWaalsContact C-N 3.26Å; D166-L168 PolarHBondContact O-N 3.47Å
169	Q	37.9	Very low	37.1	Very low	150 Å²	150	143.9 Å²	143.9	70%	0.701	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.5	-6.1	175	-162.4	161.7	-8.5	0	0	112.9	D166	D166-Q169 PolarHBondContact O-N 2.95Å
170	A	35.9	Very low	36.6	Very low	83 Å²	83	143.5 Å²	143.5	69%	0.686	73%	0.727	S	S	*	*	S	Bend	trans	-90	4.1	177.7	0	0	0	0	0	114.8
171	T	37.2	Very low	35.9	Very low	96 Å²	96	142.2 Å²	142.2	59%	0.589	73%	0.729	S	S	*	*	S	Bend	trans	-122.9	54.3	-175.8	66.9	0	0	0	0	113.6
172	Q	34.6	Very low	35.3	Very low	179 Å²	179	142.1 Å²	142.1	84%	0.836	73%	0.734	S	S	*	*	S	Bend	trans	-162.9	141.2	158.1	-113.4	141.1	107	0	0	109.3
173	E	29.5	Very low	34.5	Very low	194 Å²	194	144.3 Å²	144.3	91%	0.907	74%	0.744	S	S	*	*	S	Bend	trans	73.4	59	-177.7	-55	-174.7	-172.3	0	0	116.6
174	E	28.6	Very low	34.8	Very low	198 Å²	198	145.7 Å²	145.7	93%	0.925	75%	0.748	S	S	*	*			trans	-148.3	73	150.6	-138.8	170.9	-119.4	0	0	113.2
175	E	29.2	Very low	34.2	Very low	195 Å²	195	152 Å²	152	91%	0.911	77%	0.768	S	S	*	*			trans	-158.6	133.5	163.5	-66.6	-177.1	111.8	0	0	106.5
176	E	29.3	Very low	33.6	Very low	196 Å²	196	150.7 Å²	150.7	92%	0.916	78%	0.777	S	S	*	*	S	Bend	cis	-101.9	-173.6	-17.2	-59.4	160	117.5	0	0	107.7
177	E	30.3	Very low	32.7	Very low	183 Å²	183	150.3 Å²	150.3	86%	0.855	79%	0.787	S	S	*	*			cis	-156.9	161.4	13.2	-170	176.5	-155.7	0	0	107.9
178	D	28.3	Very low	31.8	Very low	152 Å²	152	149.4 Å²	149.4	81%	0.813	79%	0.792	S	S	*	*			trans	-68.3	176.9	-179.1	-59.1	-93.6	0	0	0	114.7
179	E	31.5	Very low	32.1	Very low	179 Å²	179	147.3 Å²	147.3	84%	0.836	79%	0.787	S	S	*	*			cis	-152	158.4	30.1	-84.2	-170.6	137.1	0	0	116.2
180	E	32.1	Very low	31.6	Very low	165 Å²	165	147.7 Å²	147.7	77%	0.771	79%	0.788	S	S	*	*			trans	47.8	100.9	148.9	-62.1	-142.8	125.8	0	0	125
181	V	28.9	Very low	31.2	Very low	127 Å²	127	152 Å²	152	77%	0.77	79%	0.794	S	S	*	*				46	124	111	-175.5	0	0	0	0	121.3
182	V	30.8	Very low	30.7	Very low	138 Å²	138	156.2 Å²	156.2	84%	0.836	81%	0.808	S	S	*	*				-175.8	140.7	119	148.4	0	0	0	0	110.9
183	E	26.5	Very low	30.8	Very low	175 Å²	175	155.1 Å²	155.1	82%	0.818	81%	0.807	S	S	*	*			trans	-128.2	-172.5	-178.4	-123.9	-155.3	163.4	0	0	109.8
184	P	48.8	Very low	31.5	Very low	91 Å²	91	151.5 Å²	151.5	59%	0.591	80%	0.8	S	S	*	*			cis	-140.4	-163.5	-7.8	27.3	0	0	0	0	115.5
185	E	28.4	Very low	31.6	Very low	186 Å²	186	149.7 Å²	149.7	87%	0.869	79%	0.792	S	S	*	*			trans	77.3	146.2	153.8	-61.4	-157.3	161.5	0	0	121.4
186	A	27.8	Very low	31.4	Very low	84 Å²	84	150.8 Å²	150.8	69%	0.694	79%	0.788	S	S	*	*			cis	-168	165.5	-16.5	0	0	0	0	0	113.1
187	A	27.3	Very low	31.5	Very low	90 Å²	90	145.5 Å²	145.5	74%	0.744	77%	0.773	S	S	*	*			trans	43.2	131.9	156.1	0	0	0	0	0	122.3
188	V	26.8	Very low	31.4	Very low	135 Å²	135	146.3 Å²	146.3	82%	0.818	77%	0.774	S	S	*	*			cis	74.8	133.9	37	-177.7	0	0	0	0	113.2
189	P	44.5	Very low	31.6	Very low	98 Å²	98	146.4 Å²	146.4	64%	0.636	77%	0.774	S	S	*	*			cis	-139.1	-156.9	-11.1	40.2	-18.5	0	0	0	116.1
190	Q	28	Very low	32.1	Very low	157 Å²	157	143.1 Å²	143.1	73%	0.734	77%	0.768	S	S	*	*			trans	80.9	129.1	159.7	-72.3	156	0.4	0	0	117.7
191	Q	27.4	Very low	32	Very low	174 Å²	174	142.6 Å²	142.6	81%	0.813	77%	0.77	S	S	*	*				71.5	138.1	59.8	-66.5	178.9	-34.4	0	0	111.9
192	E	25.8	Very low	32.3	Very low	185 Å²	185	146.2 Å²	146.2	86%	0.864	77%	0.772	S	S	*	*			cis	-143.9	166.1	25.4	-60.7	169.5	153.9	0	0	113.1
193	D	36.7	Very low	32.6	Very low	156 Å²	156	147.8 Å²	147.8	83%	0.834	77%	0.77	S	S	*	*			trans	-83	153.3	162.3	-71.9	-69.7	0	0	0	110.9
194	P	45.5	Very low	33.6	Very low	117 Å²	117	144.8 Å²	144.8	76%	0.76	77%	0.766	S	S	*	*				-154.5	142	104	36	-16.4	0	0	0	119
195	E	28.8	Very low	32.7	Very low	161 Å²	161	147.6 Å²	147.6	75%	0.752	77%	0.774	S	S	*	*				58.7	116.2	128.1	-145.9	173	-154.7	0	0	122.8
196	W	25.6	Very low	32.8	Very low	218 Å²	218	143.4 Å²	143.4	83%	0.826	77%	0.771	S	S	*	*				148.6	122	102.1	-141.8	-15.3	0	0	0	117.6
197	S	32	Very low	33	Very low	85 Å²	85	144 Å²	144	59%	0.594	78%	0.776	S	S	*	*			trans	71.4	120.8	141.8	54.9	0	0	0	0	125.8
198	K	28.3	Very low	33.2	Very low	200 Å²	200	145.4 Å²	145.4	87%	0.87	78%	0.775	S	S	*	*				75.7	130.8	127.5	-70	-179.7	176.7	175.2	0	122.5
199	D	32.5	Very low	33.4	Very low	154 Å²	154	148.8 Å²	148.8	82%	0.824	77%	0.773	S	S	*	*			trans	-80.6	-174.9	170.2	-24.2	-104.8	0	0	0	112.1
200	P	41.8	Very low	32.8	Very low	110 Å²	110	153.6 Å²	153.6	71%	0.714	78%	0.784	S	S	*	*			cis	-134.5	-154.9	-3.6	39.3	-18.3	0	0	0	114.1
201	D	30.8	Very low	33	Very low	153 Å²	153	149.9 Å²	149.9	82%	0.818	79%	0.788	S	S	*	*			trans	69	91.6	161.7	-70.6	-10.6	0	0	0	120.5
202	Y	35.2	Very low	33.6	Very low	203 Å²	203	151.3 Å²	151.3	80%	0.796	79%	0.792	S	S	*	*			trans	-148.4	143.3	134.6	-158.5	-111.8	0	0	0	112.7
203	Q	37	Very low	34.1	Very low	171 Å²	171	152.5 Å²	152.5	80%	0.799	79%	0.794	S	S	*	*			trans	-126.2	160.2	175.9	-99.5	-159.6	16.8	0	0	111.8
204	P	46.6	Very low	33.8	Very low	112 Å²	112	148.9 Å²	148.9	73%	0.727	79%	0.794	S	S	*	*			trans	-88.3	165.6	-151.5	34.7	-38.7	0	0	0	115.8
205	I	30.7	Very low	33.5	Very low	151 Å²	151	153 Å²	153	77%	0.774	80%	0.8	S	S	*	*			trans	-109.7	147	169.8	-65.4	178.8	0	0	0	110
206	A	29.8	Very low	33.7	Very low	97 Å²	97	155 Å²	155	80%	0.802	81%	0.806	S	S	*	*			trans	-117.4	153.4	-164.5	0	0	0	0	0	115
207	A	31.3	Very low	33.9	Very low	96 Å²	96	150.3 Å²	150.3	79%	0.793	81%	0.806	S	S	*	*			trans	-170.8	146.1	163.3	0	0	0	0	0	111.6
208	V	31.9	Very low	33.7	Very low	121 Å²	121	157.4 Å²	157.4	73%	0.733	82%	0.82	S	S	*	*			cis	-162.7	142.1	-23.1	101.7	0	0	0	0	111.9
209	R	32.3	Very low	33.8	Very low	206 Å²	206	154 Å²	154	78%	0.777	81%	0.811	S	S	*	*			trans	61.3	122.4	153.9	-70.2	169	-178.5	176.6	1	124
210	K	30.3	Very low	33.5	Very low	199 Å²	199	158 Å²	158	87%	0.865	81%	0.814	S	S	*	*				73.7	116.5	127.3	-66	178.2	178.8	-174.6	0	121.2
211	G	31.9	Very low	32.8	Very low	79 Å²	79	161.3 Å²	161.3	81%	0.814	81%	0.814	S	S	*	*			trans	-169.6	149.6	156.1	0	0	0	0	0	110.7
212	K	40.5	Very low	32.8	Very low	204 Å²	204	158.1 Å²	158.1	89%	0.887	81%	0.809	S	S	*	*			trans	-136.9	138.3	-174.2	-111.1	-178.2	-178.5	177.1	0	113.1
213	K	35.9	Very low	32.5	Very low	209 Å²	209	154.5 Å²	154.5	91%	0.909	80%	0.803	S	S	*	*			trans	68.2	132.1	164.2	-59.1	177.3	176.1	-178.4	0	118
214	G	31.6	Very low	32.3	Very low	81 Å²	81	149.7 Å²	149.7	84%	0.835	80%	0.799	S	S	*	*			trans	161.7	124.6	163.1	0	0	0	0	0	112.6
215	K	39	Very low	31.6	Very low	204 Å²	204	151.9 Å²	151.9	89%	0.887	81%	0.805	S	S	*	*			trans	-106.1	160.8	171.8	-76.8	-172.9	175.9	-177.3	0	110.2
216	K	33.4	Very low	31.8	Very low	203 Å²	203	155.8 Å²	155.8	88%	0.883	81%	0.81	S	S	*	*			trans	102.9	101	157.7	-56.7	178.7	-177.2	-179.4	0	117.3
217	S	28.9	Very low	31.8	Very low	119 Å²	119	159 Å²	159	83%	0.832	81%	0.814	S	S	*	*			trans	-31.6	144.1	155.6	171.7	0	0	0	0	117
218	R	28.9	Very low	31.9	Very low	233 Å²	233	163.4 Å²	163.4	88%	0.879	82%	0.82	S	S	*	*			trans	-160.9	97.4	138	-160.2	166.1	72.5	125.8	-0.5	115.8
219	L	28.8	Very low	31.8	Very low	129 Å²	129	164.3 Å²	164.3	68%	0.675	82%	0.821	S	S	*	*			trans	39.2	118.4	133	-168	74.4	0	0	0	122.3	Y221	L219-Y221 HydrophobicContact CD1-CD2 3.8Å; L219-Y221 HydrophobicContact CD1-CE2 4.1Å; L219-Y221 HydrophobicContact CG-CD2 4.43Å
220	R	27.9	Very low	31.7	Very low	237 Å²	237	160.9 Å²	160.9	89%	0.894	82%	0.822	S	S	*	*				-154.6	155.6	116.3	-52.8	-162.1	-155.1	-136.6	11.2	107.6
221	Y	25.2	Very low	32	Very low	180 Å²	180	156 Å²	156	71%	0.706	81%	0.813	S	S	*	*			cis	63.1	135.5	39.7	-79.9	-86.5	0	0	0	113.2	L219 D223	L219-Y221 HydrophobicContact CD1-CD2 3.8Å; L219-Y221 HydrophobicContact CD1-CE2 4.1Å; L219-Y221 HydrophobicContact CG-CD2 4.43Å; Y221-D223 WeakPolarHBondContact CD1-OD2 3.14Å; Y221-D223 WeakPolarHBondContact CE1-OD2 3.42Å
222	A	31.6	Very low	32.3	Very low	86 Å²	86	158.2 Å²	158.2	71%	0.711	81%	0.811	S	S	*	*			cis	-156.3	166.1	0.4	0	0	0	0	0	111
223	D	29.7	Very low	31.8	Very low	127 Å²	127	158.9 Å²	158.9	68%	0.679	81%	0.81	S	S	*	*			cis	-172.9	154.6	-34.8	-85.4	-29.3	0	0	0	108.7	Y221	Y221-D223 WeakPolarHBondContact CD1-OD2 3.14Å; Y221-D223 WeakPolarHBondContact CE1-OD2 3.42Å
224	G	32	Very low	31.6	Very low	70 Å²	70	156.2 Å²	156.2	72%	0.722	81%	0.805	S	S	*	*			trans	87.4	165.7	151.4	0	0	0	0	0	120.3
225	D	32.2	Very low	31.3	Very low	158 Å²	158	160 Å²	160	85%	0.845	80%	0.799	S	S	*	*			cis	-166.9	174.8	-12.3	-135	-34.3	0	0	0	114.8
226	R	34.4	Very low	31.6	Very low	233 Å²	233	159.2 Å²	159.2	88%	0.879	80%	0.798	S	S	*	*			trans	100.2	76.6	165.6	-55.3	-174.4	-168.9	177.6	5	118.8
227	D	30.9	Very low	31.7	Very low	165 Å²	165	156.1 Å²	156.1	88%	0.882	79%	0.787	S	S	*	*			trans	-79.3	155.1	134.7	-76	-56.9	0	0	0	109.9
228	M	31.9	Very low	32.1	Very low	189 Å²	189	158.6 Å²	158.6	93%	0.931	79%	0.786	S	S	*	*			trans	-112.2	111.6	-177.4	-160.8	70.5	160.9	0	0	111.1
229	D	30	Very low	32.4	Very low	140 Å²	140	156.6 Å²	156.6	75%	0.749	79%	0.786	S	S	*	*			trans	-90.8	142.8	-167.8	-163.7	7	0	0	0	113.2
230	V	31.1	Very low	32.7	Very low	133 Å²	133	159.1 Å²	159.1	81%	0.806	79%	0.794	S	S	*	*			trans	-138.5	92.1	169.7	-176.7	0	0	0	0	109.6
231	S	36.9	Very low	33.2	Very low	96 Å²	96	157.6 Å²	157.6	67%	0.671	80%	0.798	S	S	*	*			trans	-91.6	139.3	179.1	54.2	0	0	0	0	112.7
232	V	37.4	Very low	33.5	Very low	127 Å²	127	152.3 Å²	152.3	77%	0.77	80%	0.797	S	S	*	*			trans	-140.1	81.3	168.1	-169.4	0	0	0	0	111.3
233	Y	30.5	Very low	33.5	Very low	218 Å²	218	156.1 Å²	156.1	86%	0.855	81%	0.805	S	S	*	*			trans	60.7	105.2	158.3	-73.4	-77.1	0	0	0	120.9
234	D	31.8	Very low	33.6	Very low	152 Å²	152	157 Å²	157	81%	0.813	81%	0.809	S	S	*	*			trans	-61.3	156.8	138.3	-72	-63.4	0	0	0	112.1
235	F	25.9	Very low	33.7	Very low	160 Å²	160	158.1 Å²	158.1	70%	0.702	81%	0.805	S	S	*	*			trans	-138.1	88.7	169.5	-172.2	-94.7	0	0	0	109.9	E237	F235-E237 HydrophobicContact CD1-CB 4.47Å; F235-E237 HydrophobicContact CE1-CB 3.76Å; F235-E237 HydrophobicContact CZ-CB 4.12Å; F235-E237 VanDerWaalsContact CZ-OE2 3.23Å; F235-E237 WeakPolarHBondContact CZ-OE2 3.41Å
236	E	44.2	Very low	34.1	Very low	189 Å²	189	158.7 Å²	158.7	88%	0.883	80%	0.803	S	S	*	*			trans	-81.3	110.9	169.5	-65.7	-167.5	127.7	0	0	110.3
237	E	35	Very low	34.1	Very low	137 Å²	137	153.7 Å²	153.7	64%	0.64	80%	0.798	S	S	*	*			trans	-151.4	128.4	161	-121.2	166.8	-156.6	0	0	109.7	F235	F235-E237 HydrophobicContact CD1-CB 4.47Å; F235-E237 HydrophobicContact CE1-CB 3.76Å; F235-E237 HydrophobicContact CZ-CB 4.12Å; F235-E237 VanDerWaalsContact CZ-OE2 3.23Å; F235-E237 WeakPolarHBondContact CZ-OE2 3.41Å
238	E	37.2	Very low	34.2	Very low	172 Å²	172	153.6 Å²	153.6	80%	0.804	80%	0.798	S	S	*	*			trans	58	80.2	158.1	-61.2	176.7	166.5	0	0	118.8
239	Q	35.9	Very low	34.3	Very low	190 Å²	190	149.7 Å²	149.7	89%	0.888	80%	0.795	S	S	*	*			trans	-116.2	51.5	154.6	-79.3	-61.8	-79.2	0	0	112.3
240	Q	35.8	Very low	34.7	Very low	182 Å²	182	149.6 Å²	149.6	85%	0.85	79%	0.79	S	S	*	*			trans	-157	71.9	172.5	-165.9	70.3	19.7	0	0	113.6
241	E	36.8	Very low	35.2	Very low	206 Å²	206	151 Å²	151	96%	0.963	79%	0.785	S	S	*	*			trans	-155.1	149.7	158.3	-127.9	175.3	-132.4	0	0	112.1
242	G	32.3	Very low	35.3	Very low	68 Å²	68	153.3 Å²	153.3	70%	0.701	80%	0.796	S	S	*	*			trans	85.8	51	165.2	0	0	0	0	0	118.6	L244	G242-L244 PolarHBondContact O-N 2.85Å
243	L	32.7	Very low	35.3	Very low	166 Å²	166	153.4 Å²	153.4	87%	0.869	80%	0.796	S	S	*	*			trans	-69.6	106	153.2	-122	96.1	0	0	0	108.4	S245	L243-S245 PolarHBondContact O-N 2.96Å
244	L	30.4	Very low	35.4	Very low	147 Å²	147	146.5 Å²	146.5	77%	0.77	79%	0.791	S	S	*	*			trans	-94.2	82.4	169.9	-78.6	175.1	0	0	0	110.6	G242 E246	G242-L244 PolarHBondContact O-N 2.85Å; L244-E246 HydrophobicContact CD2-CG 4.45Å; L244-E246 PolarHBondContact O-N 3.38Å
245	S	35	Very low	35.5	Very low	92 Å²	92	146.4 Å²	146.4	64%	0.643	79%	0.791	S	S	*	*			trans	-91.8	78	162.7	56.6	0	0	0	0	109.6	L243 V247	L243-S245 PolarHBondContact O-N 2.96Å; S245-V247 PolarHBondContact O-N 2.78Å
246	E	39.8	Very low	36.1	Very low	170 Å²	170	148 Å²	148	79%	0.794	80%	0.802	S	S	*	*			trans	-75.6	84.9	174.7	-70.8	-173.9	173.9	0	0	111	L244	L244-E246 HydrophobicContact CD2-CG 4.45Å; L244-E246 PolarHBondContact O-N 3.38Å
247	V	34.5	Very low	35.7	Very low	129 Å²	129	148.5 Å²	148.5	78%	0.782	80%	0.802	S	S	*	*			trans	-142	96.3	164.8	-108.7	0	0	0	0	110.8	S245	S245-V247 PolarHBondContact O-N 2.78Å
248	N	32.9	Very low	35.9	Very low	163 Å²	163	147.2 Å²	147.2	87%	0.872	81%	0.805	S	S	*	*			trans	51.8	97.9	152.7	-151.2	13.7	0	0	0	118.1
249	A	34.3	Very low	36	Very low	106 Å²	106	145.1 Å²	145.1	88%	0.876	81%	0.806	S	S	*	*			trans	-138.3	77.8	172.8	0	0	0	0	0	111.6
250	E	38.5	Very low	36	Very low	138 Å²	138	145.3 Å²	145.3	65%	0.645	80%	0.804	S	S	*	*			trans	-88.4	144.5	168.5	-148.2	-155.1	161	0	0	110.4
251	K	41.8	Very low	36	Very low	162 Å²	162	142.7 Å²	142.7	70%	0.704	80%	0.803	S	S	*	*			trans	60.6	100.6	167.8	-62.6	145.8	176.4	147	0	117.7
252	V	38.7	Very low	36.2	Very low	146 Å²	146	138.5 Å²	138.5	89%	0.885	79%	0.792	S	S	*	*				-167.1	144.1	116.2	137.6	0	0	0	0	109.8
253	V	37.4	Very low	36.6	Very low	129 Å²	129	145.2 Å²	145.2	78%	0.782	80%	0.802	S	S	*	*			trans	-98.9	134.1	-179.6	177	0	0	0	0	110.3
254	G	32	Very low	37.2	Very low	72 Å²	72	144.5 Å²	144.5	74%	0.742	80%	0.797	S	S	*	*			trans	-154.4	110.8	175.7	0	0	0	0	0	112.4
255	N	35.1	Very low	37.7	Very low	151 Å²	151	146.8 Å²	146.8	81%	0.807	80%	0.801	S	S	*	*			trans	-82.4	120.7	-172.9	-63.6	3.8	0	0	0	112.3
256	M	37.1	Very low	38.3	Very low	192 Å²	192	152.3 Å²	152.3	95%	0.946	81%	0.813	S	S	*	*			trans	-131	155.4	157.3	-71.3	-158.4	79	0	0	111.7
257	K	36.6	Very low	38.6	Very low	200 Å²	200	153.8 Å²	153.8	87%	0.87	82%	0.817	S	S	*	*			trans	-109.6	129.5	-156.7	-162.7	169.4	-173.1	169	0	111.1
258	P	39.3	Very low	39.1	Very low	111 Å²	111	151.1 Å²	151.1	72%	0.721	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-70.8	143.5	-172.9	27.2	-34.8	0	0	0	112.9
259	P	39.5	Very low	39.8	Very low	127 Å²	127	149.9 Å²	149.9	83%	0.825	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-72	160.1	172.8	30.9	-34.6	0	0	0	112.1
260	K	34.8	Very low	41.1	Very low	195 Å²	195	152.7 Å²	152.7	85%	0.848	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-78.4	141.7	-173.7	-62.3	176	-177.1	175	0	111.8	T262	K260-T262 PolarHBondContact O-N 3.07Å
261	P	36.5	Very low	42.3	Very low	127 Å²	127	154.3 Å²	154.3	83%	0.825	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-72.2	127	-178.3	28.7	-34.9	0	0	0	112.5
262	T	39.9	Very low	43.8	Very low	118 Å²	118	151 Å²	151	72%	0.724	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-84.5	141.5	169.5	49	0	0	0	0	110.7	K260 I264	K260-T262 PolarHBondContact O-N 3.07Å; T262-I264 PolarHBondContact O-N 3.09Å
263	K	41.9	Very low	45.7	Very low	209 Å²	209	146.7 Å²	146.7	91%	0.909	77%	0.774	S	S	*	*			trans	-83.1	78.1	-171.8	-66.5	-179.5	179.7	177.4	0	112.3
264	I	44.3	Very low	47.6	Very low	150 Å²	150	146.4 Å²	146.4	77%	0.769	76%	0.764	S	S	*	*			trans	-76.5	132.5	170.4	-59.4	179.6	0	0	0	109.7	T262 K266	T262-I264 PolarHBondContact O-N 3.09Å; I264-K266 PolarHBondContact O-N 3.14Å
265	K	40.9	Very low	49.8	Very low	195 Å²	195	143.2 Å²	143.2	85%	0.848	73%	0.73	S	S	*	*			trans	-73.9	122.5	-175.9	-65	178	-179.5	177.1	0	110.5	K267	K265-K267 PolarHBondContact O-N 3.29Å
266	K	47.5	Very low	51.7	Low	209 Å²	209	144.8 Å²	144.8	91%	0.909	73%	0.733	S	S	*	*			trans	-61.5	102.2	172.3	-69	-177.2	176.6	-177.9	0	110.6	I264	I264-K266 PolarHBondContact O-N 3.14Å
267	K	46.2	Very low	53.3	Low	201 Å²	201	141.1 Å²	141.1	87%	0.874	72%	0.716	S	S	*	*			trans	-70.9	151.5	154.3	-74.5	-174.6	175.8	-179.5	0	108.4	K265 V269	K265-K267 PolarHBondContact O-N 3.29Å; K267-V269 PolarHBondContact O-N 2.88Å
268	G	45.6	Very low	55.2	Low	73 Å²	73	134 Å²	134	75%	0.753	69%	0.692	S	S	*	*			trans	-58.8	133.2	-163.4	0	0	0	0	0	114.3	K270	G268-K270 PolarHBondContact O-N 2.89Å; G268-K270 VanDerWaalsContact O-N 3.09Å
269	V	47.6	Very low	56.7	Low	137 Å²	137	134.1 Å²	134.1	83%	0.83	70%	0.695	S	S	*	*			trans	-60.6	111.7	170	178.2	0	0	0	0	108.2	K267 K271	K267-V269 PolarHBondContact O-N 2.88Å; V269-K271 PolarHBondContact O-N 3.43Å
270	K	61.3	Low	58.3	Low	165 Å²	165	132.8 Å²	132.8	72%	0.717	67%	0.674	S	S	*	*			trans	-61.5	106.7	170.6	-67.4	171.8	-175.9	164.9	0	107.1	G268 T272	G268-K270 PolarHBondContact O-N 2.89Å; G268-K270 VanDerWaalsContact O-N 3.09Å; K270-T272 PolarHBondContact O-N 3.02Å
271	K	65.1	Low	60.3	Low	171 Å²	171	127.2 Å²	127.2	74%	0.743	66%	0.656	S	S	*	*			trans	-62.7	101.9	-173.5	-164.4	171.8	-174.1	176.4	0	109.6	V269 F273	V269-K271 PolarHBondContact O-N 3.43Å; K271-F273 WeakPolarHBondContact O-CD2 3.32Å; K271-F273 VanDerWaalsContact O-CE2 3.28Å; K271-F273 WeakPolarHBondContact O-CE2 3.44Å
272	T	73.4	Confident	62.3	Low	92 Å²	92	121.3 Å²	121.3	56%	0.564	62%	0.618	S	S	*	*			trans	-71.5	137.9	-179.9	41.8	0	0	0	0	110.1	K270	K270-T272 PolarHBondContact O-N 3.02Å
273	F	77.6	Confident	64.1	Low	57 Å²	57	120 Å²	120	25%	0.25	61%	0.611	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-101.9	108.5	179.4	-66.1	-79.5	0	0	0	108	K271 C282 R285 L288	K271-F273 WeakPolarHBondContact O-CD2 3.32Å; K271-F273 VanDerWaalsContact O-CE2 3.28Å; K271-F273 WeakPolarHBondContact O-CE2 3.44Å; F273-C282 PolarHBondContact N-O 2.84Å; F273-C282 PolarHBondContact O-N 3.36Å; F273-C282 PolarHBondContact O-SG 3.19Å; F273-R285 HydrophobicContact CD1-CB 4.46Å; F273-R285 HydrophobicContact CD2-CB 4.35Å; F273-R285 HydrophobicContact CE1-CB 4.25Å; F273-R285 VanDerWaalsContact CE1-CD 3.43Å; F273-R285 HydrophobicContact CE1-CG 4.43Å; F273-R285 HydrophobicContact CE2-CB 4.12Å; F273-R285 HydrophobicContact CZ-CB 4.07Å; F273-L288 HydrophobicContact CB-CB 3.89Å; F273-L288 HydrophobicContact CB-CD2 3.78Å; F273-L288 HydrophobicContact CB-CG 4.42Å
274	Q	77.1	Confident	65.9	Low	123 Å²	123	118.3 Å²	118.3	58%	0.575	60%	0.599	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-89.6	147.1	177.6	-177.4	165.7	-6.4	0	0	110.6	T281 L288	Q274-T281 HydrophobicContact CB-CG2 3.95Å; Q274-T281 HydrophobicContact CG-CG2 3.87Å; Q274-L288 WeakPolarHBondContact O-CD2 3.42Å
275	C	78.9	Confident	67.6	Low	4 Å²	4	119.7 Å²	119.7	3%	0.027	60%	0.595	C	S	.	*			trans	-80.2	136.5	168.8	-176.1	0	0	0	0	111	L277 C278 Y280 L288 H291 M292 H295	C275-L277 VanDerWaalsContact C-N 3.29Å; C275-L277 PolarHBondContact SG-N 3.21Å; C275-C278 WeakPolarHBondContact CB-O 3.26Å; C275-Y280 PolarHBondContact N-O 3.24Å; C275-L288 HydrophobicContact CB-CD1 3.89Å; C275-H291 VanDerWaalsContact SG-CD2 3.56Å; C275-H291 PolarHBondContact SG-NE2 2.84Å; C275-H291 VanDerWaalsContact SG-NE2 3.4Å; C275-M292 HydrophobicContact CB-SD 4.37Å; C275-M292 PolarHBondContact SG-SD 3.26Å; C275-H295 PolarHBondContact SG-NE2 3.29Å
276	E	74.4	Confident	69.3	Low	184 Å²	184	114.1 Å²	114.1	86%	0.86	58%	0.581	S	S	*	*	S	Bend	trans	-79.4	-15.3	176.6	-68.3	160.7	-170	0	0	112.1
277	L	70.3	Confident	70.6	Confident	115 Å²	115	106.2 Å²	106.2	60%	0.602	55%	0.548	S	S	*	.	S	Bend	trans	-106.3	-9.6	-175.6	-58.1	175.6	0	0	0	113.9	C275 M292 H295	C275-L277 VanDerWaalsContact C-N 3.29Å; C275-L277 PolarHBondContact SG-N 3.21Å; L277-M292 HydrophobicContact CD1-CE 3.93Å; L277-M292 HydrophobicContact CG-CE 4.26Å; L277-H295 HydrophobicContact CD1-CB 3.55Å
278	C	76.9	Confident	72	Confident	52 Å²	52	97.6 Å²	97.6	35%	0.351	51%	0.511	S	S	.	.	S	Bend	trans	-161.1	171.6	167.1	74.6	0	0	0	0	112.1	C275 Y280 H291	C275-C278 WeakPolarHBondContact CB-O 3.26Å; C278-Y280 PolarHBondContact O-N 3.47Å; C278-H291 VanDerWaalsContact SG-CE1 3.54Å; C278-H291 PolarHBondContact SG-NE2 3.28Å
279	S	70.9	Confident	73.2	Confident	113 Å²	113	97.8 Å²	97.8	79%	0.79	50%	0.495	S	S	*	.	S	Bend	trans	-69.1	16.5	-178.5	52.1	0	0	0	0	116.1
280	Y	72.1	Confident	74.3	Confident	99 Å²	99	99.3 Å²	99.3	39%	0.388	49%	0.486	S	S	.	.			trans	-77	126	178.1	-176.1	-106.5	0	0	0	111.8	C275 C278 C282 H291	C275-Y280 PolarHBondContact N-O 3.24Å; C278-Y280 PolarHBondContact O-N 3.47Å; Y280-C282 HydrophobicContact CE1-CB 3.75Å; Y280-H291 VanDerWaalsContact CB-CE1 3.49Å; Y280-H291 WeakPolarHBondContact CB-CE1 3.47Å; Y280-H291 HydrophobicContact CD1-CB 3.92Å; Y280-H291 AromaticContact CD1-CD2 3.62Å; Y280-H291 AromaticContact CD1-CE1 3.7Å; Y280-H291 AromaticContact CD1-CG 3.34Å; Y280-H291 AromaticContact CD1-ND1 3.4Å; Y280-H291 WeakPolarHBondContact CD1-ND1 3.47Å; Y280-H291 AromaticContact CD1-NE2 3.83Å; Y280-H291 HydrophobicContact CE1-CB 3.86Å; Y280-H291 AromaticContact CE1-CG 3.77Å; Y280-H291 AromaticContact CE1-ND1 3.88Å; Y280-H291 AromaticContact CG-CE1 3.64Å; Y280-H291 AromaticContact CG-ND1 3.71Å; Y280-H291 AromaticContact CG-NE2 3.97Å
281	T	77.7	Confident	74.9	Confident	77 Å²	77	92.9 Å²	92.9	47%	0.472	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	147.2	172.9	58.4	0	0	0	0	110.3	Q274	Q274-T281 HydrophobicContact CB-CG2 3.95Å; Q274-T281 HydrophobicContact CG-CG2 3.87Å
282	C	79.1	Confident	75.1	Confident	4 Å²	4	87.5 Å²	87.5	3%	0.027	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	154.8	178.3	70.5	0	0	0	0	113.3	F273 Y280 R284 N287 L288	F273-C282 PolarHBondContact N-O 2.84Å; F273-C282 PolarHBondContact O-N 3.36Å; F273-C282 PolarHBondContact O-SG 3.19Å; Y280-C282 HydrophobicContact CE1-CB 3.75Å; C282-R284 PolarHBondContact O-N 2.83Å; C282-R284 PolarHBondContact SG-O 3.46Å; C282-N287 HydrophobicContact CB-CB 4.03Å; C282-L288 PolarHBondContact SG-N 2.94Å
283	P	78.1	Confident	75	Confident	89 Å²	89	88.2 Å²	88.2	58%	0.578	43%	0.432	S	S	*	.	S	Bend	trans	-84.8	5.5	-173.6	33.1	-37.2	0	0	0	115.3
284	R	79.4	Confident	74.3	Confident	175 Å²	175	87.5 Å²	87.5	66%	0.66	43%	0.434	S	S	*	.	S	Bend	trans	-143.7	133.8	-178.1	-68.4	-173.5	177.6	-179.9	-0.7	111.8	C282 S286 N287 L288	C282-R284 PolarHBondContact O-N 2.83Å; C282-R284 PolarHBondContact SG-O 3.46Å; R284-S286 PolarHBondContact O-N 2.82Å; R284-N287 HydrophobicContact CB-CB 4.47Å; R284-N287 WeakPolarHBondContact O-CB 3.3Å; R284-N287 PolarHBondContact O-N 3.35Å; R284-L288 PolarHBondContact O-N 3.33Å
285	R	78.9	Confident	73.6	Confident	179 Å²	179	84.9 Å²	84.9	68%	0.675	42%	0.422	S	S	*	.	H	α-helix	trans	-54.5	-36.4	178.7	-167.5	80.3	-178.7	-89.5	6.9	112.8	F273 L288 D289	F273-R285 HydrophobicContact CD1-CB 4.46Å; F273-R285 HydrophobicContact CD2-CB 4.35Å; F273-R285 HydrophobicContact CE1-CB 4.25Å; F273-R285 VanDerWaalsContact CE1-CD 3.43Å; F273-R285 HydrophobicContact CE1-CG 4.43Å; F273-R285 HydrophobicContact CE2-CB 4.12Å; F273-R285 HydrophobicContact CZ-CB 4.07Å; R285-L288 PolarHBondContact O-N 2.65Å; R285-D289 PolarHBondContact O-N 3.12Å
286	S	76.1	Confident	72.9	Confident	78 Å²	78	87.7 Å²	87.7	55%	0.545	44%	0.439	S	S	.	.	H	α-helix	trans	-69.7	-26.9	176.6	51.3	0	0	0	0	114.2	R284 R290	R284-S286 PolarHBondContact O-N 2.82Å; S286-R290 WeakPolarHBondContact O-CB 3.29Å; S286-R290 PolarHBondContact O-N 2.77Å; S286-R290 VanDerWaalsContact O-N 3.14Å
287	N	75.2	Confident	72.2	Confident	42 Å²	42	84.2 Å²	84.2	23%	0.225	43%	0.426	C	S	.	.	H	α-helix	trans	-74	-36.9	169.4	-78.1	-24.5	0	0	0	111.1	C282 R284 R290 H291	C282-N287 HydrophobicContact CB-CB 4.03Å; R284-N287 HydrophobicContact CB-CB 4.47Å; R284-N287 WeakPolarHBondContact O-CB 3.3Å; R284-N287 PolarHBondContact O-N 3.35Å; N287-R290 PolarHBondContact OD1-NH2 3.04Å; N287-H291 WeakPolarHBondContact O-CB 3.44Å; N287-H291 PolarHBondContact O-N 3.14Å; N287-H291 VanDerWaalsContact O-N 3.1Å
288	L	76.4	Confident	72.1	Confident	20 Å²	20	85.8 Å²	85.8	11%	0.105	43%	0.43	C	S	.	.	H	α-helix	trans	-65.8	-47	172.7	179.7	60.6	0	0	0	110.8	F273 Q274 C275 C282 R284 R285 R290 H291 M292	F273-L288 HydrophobicContact CB-CB 3.89Å; F273-L288 HydrophobicContact CB-CD2 3.78Å; F273-L288 HydrophobicContact CB-CG 4.42Å; Q274-L288 WeakPolarHBondContact O-CD2 3.42Å; C275-L288 HydrophobicContact CB-CD1 3.89Å; C282-L288 PolarHBondContact SG-N 2.94Å; R284-L288 PolarHBondContact O-N 3.33Å; R285-L288 PolarHBondContact O-N 2.65Å; L288-R290 PolarHBondContact O-N 3.09Å; L288-H291 CarbonylContact O-C 3.35Å; L288-H291 VanDerWaalsContact O-CA 3.28Å; L288-H291 WeakPolarHBondContact O-CA 3.47Å; L288-H291 WeakPolarHBondContact O-CB 3.29Å; L288-H291 PolarHBondContact O-N 3.22Å; L288-M292 HydrophobicContact CD1-CG 4.14Å; L288-M292 HydrophobicContact CD1-SD 3.89Å; L288-M292 HydrophobicContact CG-CG 4.11Å; L288-M292 HydrophobicContact CG-SD 4.42Å; L288-M292 WeakPolarHBondContact O-CG 3.5Å; L288-M292 PolarHBondContact O-N 3.06Å
289	D	71.4	Confident	71.8	Confident	78 Å²	78	88.6 Å²	88.6	42%	0.417	43%	0.434	S	S	.	.	H	α-helix	trans	-58	-46.4	178.6	172	73.7	0	0	0	112.3	R285 H291 M292 K293	R285-D289 PolarHBondContact O-N 3.12Å; D289-H291 PolarHBondContact O-N 3.26Å; D289-M292 PolarHBondContact O-N 3.13Å; D289-M292 VanDerWaalsContact O-N 3.15Å; D289-K293 VanDerWaalsContact CG-NZ 3.3Å; D289-K293 WeakPolarHBondContact O-CB 3.38Å; D289-K293 WeakPolarHBondContact O-CG 3.4Å; D289-K293 PolarHBondContact O-N 3.47Å; D289-K293 IonicContact OD1-NZ 3.36Å; D289-K293 PolarHBondContact OD1-NZ 2.84Å; D289-K293 VanDerWaalsContact OD1-NZ 3.14Å; D289-K293 IonicContact OD2-NZ 2.69Å; D289-K293 PolarHBondContact OD2-NZ 3.01Å
290	R	69.5	Low	72	Confident	168 Å²	168	87.8 Å²	87.8	63%	0.634	43%	0.426	S	S	*	.	H	α-helix	trans	-59.8	-25.8	171.3	179.2	167.1	59.4	161.2	-3.9	113.3	S286 N287 L288	S286-R290 WeakPolarHBondContact O-CB 3.29Å; S286-R290 PolarHBondContact O-N 2.77Å; S286-R290 VanDerWaalsContact O-N 3.14Å; N287-R290 PolarHBondContact OD1-NH2 3.04Å; L288-R290 PolarHBondContact O-N 3.09Å
291	H	73.8	Confident	72.2	Confident	31 Å²	31	86 Å²	86	14%	0.144	42%	0.421	C	S	.	.	H	α-helix	trans	-87.5	-30.5	174.9	175.9	86.6	0	0	0	113.3	C275 C278 Y280 N287 L288 D289 K293 S294 H295	C275-H291 VanDerWaalsContact SG-CD2 3.56Å; C275-H291 PolarHBondContact SG-NE2 2.84Å; C275-H291 VanDerWaalsContact SG-NE2 3.4Å; C278-H291 VanDerWaalsContact SG-CE1 3.54Å; C278-H291 PolarHBondContact SG-NE2 3.28Å; Y280-H291 VanDerWaalsContact CB-CE1 3.49Å; Y280-H291 WeakPolarHBondContact CB-CE1 3.47Å; Y280-H291 HydrophobicContact CD1-CB 3.92Å; Y280-H291 AromaticContact CD1-CD2 3.62Å; Y280-H291 AromaticContact CD1-CE1 3.7Å; Y280-H291 AromaticContact CD1-CG 3.34Å; Y280-H291 AromaticContact CD1-ND1 3.4Å; Y280-H291 WeakPolarHBondContact CD1-ND1 3.47Å; Y280-H291 AromaticContact CD1-NE2 3.83Å; Y280-H291 HydrophobicContact CE1-CB 3.86Å; Y280-H291 AromaticContact CE1-CG 3.77Å; Y280-H291 AromaticContact CE1-ND1 3.88Å; Y280-H291 AromaticContact CG-CE1 3.64Å; Y280-H291 AromaticContact CG-ND1 3.71Å; Y280-H291 AromaticContact CG-NE2 3.97Å; N287-H291 WeakPolarHBondContact O-CB 3.44Å; N287-H291 PolarHBondContact O-N 3.14Å; N287-H291 VanDerWaalsContact O-N 3.1Å; L288-H291 CarbonylContact O-C 3.35Å; L288-H291 VanDerWaalsContact O-CA 3.28Å; L288-H291 WeakPolarHBondContact O-CA 3.47Å; L288-H291 WeakPolarHBondContact O-CB 3.29Å; L288-H291 PolarHBondContact O-N 3.22Å; D289-H291 PolarHBondContact O-N 3.26Å; H291-K293 VanDerWaalsContact C-N 3.29Å; H291-S294 WeakPolarHBondContact O-CA 3.38Å; H291-S294 WeakPolarHBondContact O-CB 3.5Å; H291-S294 PolarHBondContact O-N 3.41Å; H291-S294 PolarHBondContact O-OG 3.11Å; H291-H295 AromaticContact CD2-CD2 4Å; H291-H295 AromaticContact CD2-NE2 3.7Å; H291-H295 AromaticContact CE1-NE2 3.68Å; H291-H295 AromaticContact NE2-CD2 3.72Å; H291-H295 AromaticContact NE2-NE2 2.97Å; H291-H295 PolarHBondContact NE2-NE2 3.5Å; H291-H295 PolarHBondContact O-CD2 2.79Å
292	M	70.3	Confident	72.2	Confident	57 Å²	57	89.8 Å²	89.8	28%	0.281	43%	0.431	S	S	.	.	H	α-helix	trans	-65.6	-38	169.6	-62.5	-50.4	-69.8	0	0	110	C275 L277 L288 D289 S294 H295 T296	C275-M292 HydrophobicContact CB-SD 4.37Å; C275-M292 PolarHBondContact SG-SD 3.26Å; L277-M292 HydrophobicContact CD1-CE 3.93Å; L277-M292 HydrophobicContact CG-CE 4.26Å; L288-M292 HydrophobicContact CD1-CG 4.14Å; L288-M292 HydrophobicContact CD1-SD 3.89Å; L288-M292 HydrophobicContact CG-CG 4.11Å; L288-M292 HydrophobicContact CG-SD 4.42Å; L288-M292 WeakPolarHBondContact O-CG 3.5Å; L288-M292 PolarHBondContact O-N 3.06Å; D289-M292 PolarHBondContact O-N 3.13Å; D289-M292 VanDerWaalsContact O-N 3.15Å; M292-S294 PolarHBondContact O-N 3.41Å; M292-H295 PolarHBondContact O-N 3.47Å; M292-T296 PolarHBondContact O-N 3Å; M292-T296 VanDerWaalsContact O-N 3.09Å
293	K	70.3	Confident	72.4	Confident	108 Å²	108	89.7 Å²	89.7	47%	0.47	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	10.1	163.4	-69	161.7	-179.6	158.5	0	114.3	D289 H291 R311	D289-K293 VanDerWaalsContact CG-NZ 3.3Å; D289-K293 WeakPolarHBondContact O-CB 3.38Å; D289-K293 WeakPolarHBondContact O-CG 3.4Å; D289-K293 PolarHBondContact O-N 3.47Å; D289-K293 IonicContact OD1-NZ 3.36Å; D289-K293 PolarHBondContact OD1-NZ 2.84Å; D289-K293 VanDerWaalsContact OD1-NZ 3.14Å; D289-K293 IonicContact OD2-NZ 2.69Å; D289-K293 PolarHBondContact OD2-NZ 3.01Å; H291-K293 VanDerWaalsContact C-N 3.29Å; K293-R311 VanDerWaalsContact O-CD 3.29Å; K293-R311 WeakPolarHBondContact O-CD 3.29Å; K293-R311 PolarHBondContact O-NE 3.34Å
294	S	63.3	Low	72.3	Confident	41 Å²	41	92.6 Å²	92.6	29%	0.287	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.9	-15.3	165.9	88.4	0	0	0	0	114.5	H291 M292 R311	H291-S294 WeakPolarHBondContact O-CA 3.38Å; H291-S294 WeakPolarHBondContact O-CB 3.5Å; H291-S294 PolarHBondContact O-N 3.41Å; H291-S294 PolarHBondContact O-OG 3.11Å; M292-S294 PolarHBondContact O-N 3.41Å; S294-R311 VanDerWaalsContact CA-CZ 3.48Å; S294-R311 PolarHBondContact O-NH2 3.06Å
295	H	61.9	Low	72.3	Confident	69 Å²	69	88.8 Å²	88.8	32%	0.319	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	-33.5	172.9	-63.3	-78	0	0	0	112.5	C275 L277 H291 M292 D297	C275-H295 PolarHBondContact SG-NE2 3.29Å; L277-H295 HydrophobicContact CD1-CB 3.55Å; H291-H295 AromaticContact CD2-CD2 4Å; H291-H295 AromaticContact CD2-NE2 3.7Å; H291-H295 AromaticContact CE1-NE2 3.68Å; H291-H295 AromaticContact NE2-CD2 3.72Å; H291-H295 AromaticContact NE2-NE2 2.97Å; H291-H295 PolarHBondContact NE2-NE2 3.5Å; H291-H295 PolarHBondContact O-CD2 2.79Å; M292-H295 PolarHBondContact O-N 3.47Å; H295-D297 PolarHBondContact O-N 3.39Å
296	T	64.9	Low	72.1	Confident	63 Å²	63	82.9 Å²	82.9	39%	0.387	41%	0.413	S	S	.	.	S	Bend	trans	-70.1	124.1	159.5	61.5	0	0	0	0	108.1	M292 E298 R311	M292-T296 PolarHBondContact O-N 3Å; M292-T296 VanDerWaalsContact O-N 3.09Å; T296-E298 PolarHBondContact O-N 2.65Å; T296-R311 PolarHBondContact O-NH2 2.83Å
297	D	59.8	Low	71.9	Confident	110 Å²	110	81.8 Å²	81.8	59%	0.588	41%	0.414	S	S	*	.			trans	-85.1	10.5	176.7	-122.3	-34.4	0	0	0	112.4	H295 R299 R311	H295-D297 PolarHBondContact O-N 3.39Å; D297-R299 WeakPolarHBondContact O-CD 3.3Å; D297-R299 WeakPolarHBondContact O-CG 3.46Å; D297-R299 PolarHBondContact O-N 2.97Å; D297-R299 IonicContact OD1-CZ 2.7Å; D297-R299 IonicContact OD1-NE 3.72Å; D297-R299 PolarHBondContact OD1-NE 3.09Å; D297-R299 IonicContact OD1-NH2 3.92Å; D297-R299 PolarHBondContact OD1-NH2 3.35Å; D297-R311 IonicContact OD1-NH2 2.71Å
298	E	67.6	Low	71.9	Confident	149 Å²	149	87.7 Å²	87.7	70%	0.696	43%	0.434	S	S	*	.			trans	-55.4	121.2	165.7	-67.6	-178.4	173.4	0	0	110.4	T296	T296-E298 PolarHBondContact O-N 2.65Å
299	R	71.7	Confident	72.1	Confident	111 Å²	111	87.8 Å²	87.8	42%	0.419	44%	0.437	S	S	.	.			trans	-130.2	84.6	-177.4	-70.9	151.4	179.7	-107.6	8.3	107.5	D297 H301 A309 F310 R311	D297-R299 WeakPolarHBondContact O-CD 3.3Å; D297-R299 WeakPolarHBondContact O-CG 3.46Å; D297-R299 PolarHBondContact O-N 2.97Å; D297-R299 IonicContact OD1-CZ 2.7Å; D297-R299 IonicContact OD1-NE 3.72Å; D297-R299 PolarHBondContact OD1-NE 3.09Å; D297-R299 IonicContact OD1-NH2 3.92Å; D297-R299 PolarHBondContact OD1-NH2 3.35Å; R299-H301 PolarHBondContact O-N 3.1Å; R299-A309 HydrophobicContact CB-CB 3.38Å; R299-A309 WeakPolarHBondContact CD-O 3.22Å; R299-A309 HydrophobicContact CG-CB 4.29Å; R299-A309 PolarHBondContact NH1-O 2.92Å; R299-A309 VanDerWaalsContact NH1-O 3.14Å; R299-F310 CarbonylContact C-O 3.51Å; R299-R311 HydrophobicContact CG-CG 4.17Å
300	P	74.1	Confident	72.5	Confident	96 Å²	96	86 Å²	86	62%	0.623	43%	0.426	S	S	*	.			trans	-62.1	-30.5	-168	-25.9	35.8	0	0	0	113.6	K302	P300-K302 PolarHBondContact O-N 3Å
301	H	76.6	Confident	72.8	Confident	62 Å²	62	82.6 Å²	82.6	29%	0.287	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	91.4	-170.4	-52.5	-64.5	0	0	0	111	R299 F310 V313 L316	R299-H301 PolarHBondContact O-N 3.1Å; H301-F310 PolarHBondContact N-O 3.35Å; H301-F310 PolarHBondContact O-N 3.08Å; H301-V313 PolarHBondContact CD2-N 3.12Å; H301-V313 WeakPolarHBondContact CE1-CG2 3.19Å; H301-L316 HydrophobicContact CB-CB 4.08Å; H301-L316 HydrophobicContact CB-CD2 3.81Å
302	K	77.1	Confident	73.1	Confident	156 Å²	156	83.6 Å²	83.6	68%	0.678	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.6	140.9	176.9	-61.2	-178.8	-177.4	175.9	0	111.5	P300 A309	P300-K302 PolarHBondContact O-N 3Å; K302-A309 HydrophobicContact CG-CB 3.98Å
303	C	83.9	Confident	73.5	Confident	2 Å²	2	84.5 Å²	84.5	1%	0.014	43%	0.43	C	S	.	.			trans	-86	122.1	171.8	-174.9	0	0	0	0	110.3	L305 C306 G307 R308 F310 L316	C303-L305 VanDerWaalsContact C-N 3.27Å; C303-L305 PolarHBondContact O-N 3.32Å; C303-C306 PolarHBondContact O-N 2.8Å; C303-G307 WeakPolarHBondContact O-CA 3.32Å; C303-G307 PolarHBondContact O-N 2.95Å; C303-R308 WeakPolarHBondContact CB-O 3.42Å; C303-R308 PolarHBondContact N-O 2.82Å; C303-F310 HydrophobicContact CB-CE2 4.22Å; C303-L316 HydrophobicContact CB-CD1 3.6Å
304	H	76.8	Confident	74	Confident	149 Å²	149	83.1 Å²	83.1	69%	0.69	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-29.2	-179.1	54.8	-84.5	0	0	0	113.1
305	L	78.1	Confident	74.9	Confident	96 Å²	96	85.4 Å²	85.4	50%	0.503	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-12.9	-176.6	-57.6	176.5	0	0	0	115	C303 L320 H323	C303-L305 VanDerWaalsContact C-N 3.27Å; C303-L305 PolarHBondContact O-N 3.32Å; L305-L320 HydrophobicContact CD1-CD1 3.86Å; L305-H323 HydrophobicContact CD1-CB 3.45Å; L305-H323 VanDerWaalsContact CD1-CB 3.45Å
306	C	75.9	Confident	75.9	Confident	55 Å²	55	83.7 Å²	83.7	37%	0.372	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-152.6	7	-175.8	74.1	0	0	0	0	115.7	C303 R308 H319	C303-C306 PolarHBondContact O-N 2.8Å; C306-R308 PolarHBondContact O-N 3Å; C306-H319 PolarHBondContact SG-NE2 3.18Å
307	G	71	Confident	76.7	Confident	55 Å²	55	88.2 Å²	88.2	57%	0.567	44%	0.442	S	S	*	.			trans	67.8	-9.5	-178.8	0	0	0	0	0	116.2	C303 A309	C303-G307 WeakPolarHBondContact O-CA 3.32Å; C303-G307 PolarHBondContact O-N 2.95Å; G307-A309 PolarHBondContact O-N 3.4Å
308	R	76.2	Confident	77.8	Confident	166 Å²	166	85.9 Å²	85.9	63%	0.626	43%	0.43	S	S	*	.			trans	-62.9	133.4	-177.8	-72.9	-175.4	172.2	173.4	2.3	111.4	C303 C306 F310	C303-R308 WeakPolarHBondContact CB-O 3.42Å; C303-R308 PolarHBondContact N-O 2.82Å; C306-R308 PolarHBondContact O-N 3Å; R308-F310 HydrophobicContact CB-CE2 3.66Å; R308-F310 HydrophobicContact CB-CZ 3.87Å; R308-F310 WeakPolarHBondContact O-CD2 2.89Å; R308-F310 VanDerWaalsContact O-CE2 3.24Å; R308-F310 WeakPolarHBondContact O-CE2 3.49Å
309	A	79.5	Confident	78.5	Confident	22 Å²	22	79.9 Å²	79.9	18%	0.182	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	134.8	-175.4	0	0	0	0	0	112	R299 K302 G307	R299-A309 HydrophobicContact CB-CB 3.38Å; R299-A309 WeakPolarHBondContact CD-O 3.22Å; R299-A309 HydrophobicContact CG-CB 4.29Å; R299-A309 PolarHBondContact NH1-O 2.92Å; R299-A309 VanDerWaalsContact NH1-O 3.14Å; K302-A309 HydrophobicContact CG-CB 3.98Å; G307-A309 PolarHBondContact O-N 3.4Å
310	F	79.3	Confident	78.9	Confident	40 Å²	40	77 Å²	77	18%	0.175	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	153.2	-172.7	-61.3	-88.9	0	0	0	112.3	R299 H301 C303 R308 L315 L316 H319	R299-F310 CarbonylContact C-O 3.51Å; H301-F310 PolarHBondContact N-O 3.35Å; H301-F310 PolarHBondContact O-N 3.08Å; C303-F310 HydrophobicContact CB-CE2 4.22Å; R308-F310 HydrophobicContact CB-CE2 3.66Å; R308-F310 HydrophobicContact CB-CZ 3.87Å; R308-F310 WeakPolarHBondContact O-CD2 2.89Å; R308-F310 VanDerWaalsContact O-CE2 3.24Å; R308-F310 WeakPolarHBondContact O-CE2 3.49Å; F310-L315 HydrophobicContact CB-CB 4.17Å; F310-L315 HydrophobicContact CD1-CB 4.03Å; F310-L315 HydrophobicContact CG-CB 4.43Å; F310-L316 HydrophobicContact CB-CB 4.28Å; F310-L316 HydrophobicContact CD2-CB 4.28Å; F310-L316 HydrophobicContact CD2-CD1 3.9Å; F310-L316 HydrophobicContact CE2-CD1 4.28Å; F310-L316 HydrophobicContact CG-CB 4.44Å; F310-H319 HydrophobicContact CE1-CB 3.92Å; F310-H319 HydrophobicContact CE2-CB 3.92Å; F310-H319 AromaticContact CE2-CD2 3.27Å; F310-H319 WeakPolarHBondContact CE2-CD2 3.41Å; F310-H319 AromaticContact CE2-CG 3.77Å; F310-H319 HydrophobicContact CZ-CB 3.5Å; F310-H319 AromaticContact CZ-CD2 3.23Å; F310-H319 WeakPolarHBondContact CZ-CD2 3.3Å; F310-H319 AromaticContact CZ-CG 3.32Å
311	R	76.2	Confident	79.4	Confident	96 Å²	96	73.6 Å²	73.6	36%	0.362	37%	0.371	S	S	.	.	S	Bend	trans	-84	-13.4	-177.2	-69.6	176.8	172.7	161.4	-4.8	114.4	K293 S294 T296 D297 R299	K293-R311 VanDerWaalsContact O-CD 3.29Å; K293-R311 WeakPolarHBondContact O-CD 3.29Å; K293-R311 PolarHBondContact O-NE 3.34Å; S294-R311 VanDerWaalsContact CA-CZ 3.48Å; S294-R311 PolarHBondContact O-NH2 3.06Å; T296-R311 PolarHBondContact O-NH2 2.83Å; D297-R311 IonicContact OD1-NH2 2.71Å; R299-R311 HydrophobicContact CG-CG 4.17Å
312	T	79.8	Confident	79.4	Confident	53 Å²	53	74.6 Å²	74.6	33%	0.325	38%	0.381	S	S	.	.	S	Bend	trans	-144.9	153.5	174.4	67.4	0	0	0	0	111.2	T314 L315 L316	T312-T314 PolarHBondContact O-N 2.89Å; T312-T314 PolarHBondContact OG1-OG1 2.65Å; T312-L315 PolarHBondContact O-N 2.91Å; T312-L315 WeakPolarHBondContact OG1-CD1 3.38Å; T312-L315 PolarHBondContact OG1-N 3.09Å; T312-L315 VanDerWaalsContact OG1-N 3.14Å; T312-L316 PolarHBondContact O-N 3.14Å
313	V	79.6	Confident	79.4	Confident	75 Å²	75	70.8 Å²	70.8	46%	0.455	37%	0.366	S	S	.	.	H	α-helix	trans	-57.5	-35.9	172	-176.6	0	0	0	0	111.6	H301 L315 L316 R317	H301-V313 PolarHBondContact CD2-N 3.12Å; H301-V313 WeakPolarHBondContact CE1-CG2 3.19Å; V313-L315 PolarHBondContact O-N 2.81Å; V313-L316 PolarHBondContact O-N 2.83Å; V313-R317 WeakPolarHBondContact O-CB 2.95Å; V313-R317 PolarHBondContact O-N 3.18Å
314	T	81.6	Confident	79.1	Confident	80 Å²	80	74.3 Å²	74.3	49%	0.491	39%	0.388	S	S	.	.	H	α-helix	trans	-64.3	-39	177	48.4	0	0	0	0	112.9	T312 N318	T312-T314 PolarHBondContact O-N 2.89Å; T312-T314 PolarHBondContact OG1-OG1 2.65Å; T314-N318 WeakPolarHBondContact O-CB 3.24Å; T314-N318 PolarHBondContact O-N 3.11Å; T314-N318 PolarHBondContact O-OD1 2.93Å
315	L	81.3	Confident	79.1	Confident	89 Å²	89	69.5 Å²	69.5	47%	0.466	38%	0.378	S	S	.	.	H	α-helix	trans	-71	-36	173.6	-96	66.4	0	0	0	111.8	F310 T312 V313 H319	F310-L315 HydrophobicContact CB-CB 4.17Å; F310-L315 HydrophobicContact CD1-CB 4.03Å; F310-L315 HydrophobicContact CG-CB 4.43Å; T312-L315 PolarHBondContact O-N 2.91Å; T312-L315 WeakPolarHBondContact OG1-CD1 3.38Å; T312-L315 PolarHBondContact OG1-N 3.09Å; T312-L315 VanDerWaalsContact OG1-N 3.14Å; V313-L315 PolarHBondContact O-N 2.81Å; L315-H319 WeakPolarHBondContact O-CB 3.37Å; L315-H319 PolarHBondContact O-N 3.41Å
316	L	82.7	Confident	79	Confident	32 Å²	32	68.5 Å²	68.5	17%	0.168	38%	0.376	C	S	.	.	H	α-helix	trans	-64.6	-44.5	172.8	175.2	59.9	0	0	0	111.6	H301 C303 F310 T312 V313 H319 L320	H301-L316 HydrophobicContact CB-CB 4.08Å; H301-L316 HydrophobicContact CB-CD2 3.81Å; C303-L316 HydrophobicContact CB-CD1 3.6Å; F310-L316 HydrophobicContact CB-CB 4.28Å; F310-L316 HydrophobicContact CD2-CB 4.28Å; F310-L316 HydrophobicContact CD2-CD1 3.9Å; F310-L316 HydrophobicContact CE2-CD1 4.28Å; F310-L316 HydrophobicContact CG-CB 4.44Å; T312-L316 PolarHBondContact O-N 3.14Å; V313-L316 PolarHBondContact O-N 2.83Å; L316-H319 CarbonylContact O-C 3.11Å; L316-H319 PolarHBondContact O-N 2.95Å; L316-H319 VanDerWaalsContact O-N 3.11Å; L316-L320 PolarHBondContact O-N 2.97Å
317	R	81.9	Confident	79.2	Confident	159 Å²	159	71.2 Å²	71.2	60%	0.6	38%	0.378	S	S	*	.	H	α-helix	trans	-62.4	-46.1	177.5	-173.9	178.7	-70.6	150.5	-3.8	111.3	V313 H319 L320 N321	V313-R317 WeakPolarHBondContact O-CB 2.95Å; V313-R317 PolarHBondContact O-N 3.18Å; R317-H319 PolarHBondContact O-N 3.45Å; R317-L320 PolarHBondContact O-N 3.05Å; R317-L320 VanDerWaalsContact O-N 3.11Å; R317-N321 VanDerWaalsContact O-CG 3.3Å; R317-N321 PolarHBondContact O-N 3.24Å; R317-N321 PolarHBondContact O-OD1 3.33Å
318	N	82.3	Confident	79.5	Confident	61 Å²	61	72.4 Å²	72.4	33%	0.326	38%	0.376	S	S	.	.	H	α-helix	trans	-62.2	-29.7	174.1	-67.9	-0.1	0	0	0	112.2	T314 V339	T314-N318 WeakPolarHBondContact O-CB 3.24Å; T314-N318 PolarHBondContact O-N 3.11Å; T314-N318 PolarHBondContact O-OD1 2.93Å; N318-V339 HydrophobicContact CB-CG1 4.11Å; N318-V339 WeakPolarHBondContact O-CG1 3.35Å
319	H	82.1	Confident	79.7	Confident	22 Å²	22	67.8 Å²	67.8	10%	0.102	36%	0.362	C	S	.	.	H	α-helix	trans	-77.6	-36.7	171.2	-178.2	43.2	0	0	0	113.2	C306 F310 L315 L316 R317 N321 T322 H323	C306-H319 PolarHBondContact SG-NE2 3.18Å; F310-H319 HydrophobicContact CE1-CB 3.92Å; F310-H319 HydrophobicContact CE2-CB 3.92Å; F310-H319 AromaticContact CE2-CD2 3.27Å; F310-H319 WeakPolarHBondContact CE2-CD2 3.41Å; F310-H319 AromaticContact CE2-CG 3.77Å; F310-H319 HydrophobicContact CZ-CB 3.5Å; F310-H319 AromaticContact CZ-CD2 3.23Å; F310-H319 WeakPolarHBondContact CZ-CD2 3.3Å; F310-H319 AromaticContact CZ-CG 3.32Å; L315-H319 WeakPolarHBondContact O-CB 3.37Å; L315-H319 PolarHBondContact O-N 3.41Å; L316-H319 CarbonylContact O-C 3.11Å; L316-H319 PolarHBondContact O-N 2.95Å; L316-H319 VanDerWaalsContact O-N 3.11Å; R317-H319 PolarHBondContact O-N 3.45Å; H319-N321 PolarHBondContact O-N 2.95Å; H319-T322 PolarHBondContact CE1-OG1 3.4Å; H319-T322 PolarHBondContact ND1-OG1 3.43Å; H319-T322 WeakPolarHBondContact O-CA 3.33Å; H319-T322 WeakPolarHBondContact O-CB 3.37Å; H319-T322 PolarHBondContact O-N 3.5Å; H319-T322 PolarHBondContact O-OG1 3.01Å; H319-H323 AromaticContact CD2-NE2 3.82Å; H319-H323 AromaticContact CE1-CD2 3.98Å; H319-H323 AromaticContact CE1-CE1 3.9Å; H319-H323 AromaticContact CE1-NE2 3.27Å; H319-H323 PolarHBondContact CE1-NE2 2.81Å; H319-H323 VanDerWaalsContact CE1-NE2 3.27Å; H319-H323 AromaticContact NE2-CD2 3.86Å; H319-H323 AromaticContact NE2-CE1 3.89Å; H319-H323 AromaticContact NE2-NE2 3.01Å; H319-H323 PolarHBondContact NE2-NE2 3.08Å
320	L	81.7	Confident	79.8	Confident	51 Å²	51	74.6 Å²	74.6	27%	0.267	39%	0.387	S	S	.	.	H	α-helix	trans	-60.3	-39.6	176.4	-172.7	58.1	0	0	0	110.8	L305 L316 R317 T322 H323 T324	L305-L320 HydrophobicContact CD1-CD1 3.86Å; L316-L320 PolarHBondContact O-N 2.97Å; R317-L320 PolarHBondContact O-N 3.05Å; R317-L320 VanDerWaalsContact O-N 3.11Å; L320-T322 PolarHBondContact O-N 2.79Å; L320-H323 PolarHBondContact O-N 3.09Å; L320-T324 HydrophobicContact CD1-CG2 4.37Å; L320-T324 HydrophobicContact CG-CG2 4.26Å; L320-T324 PolarHBondContact O-N 3.29Å; L320-T324 PolarHBondContact O-OG1 3.39Å; L320-T324 VanDerWaalsContact O-OG1 3.12Å
321	N	83.1	Confident	80.1	Confident	24 Å²	24	73.4 Å²	73.4	13%	0.128	38%	0.384	C	S	.	.	H	α-helix	trans	-54.8	-18.9	169.6	-71.1	1.8	0	0	0	114.6	R317 H319 T324 G325 T326 V339	R317-N321 VanDerWaalsContact O-CG 3.3Å; R317-N321 PolarHBondContact O-N 3.24Å; R317-N321 PolarHBondContact O-OD1 3.33Å; H319-N321 PolarHBondContact O-N 2.95Å; N321-T324 WeakPolarHBondContact CA-OG1 3.37Å; N321-G325 PolarHBondContact O-N 3.37Å; N321-T326 VanDerWaalsContact CB-O 3.31Å; N321-T326 WeakPolarHBondContact CB-O 3.24Å; N321-T326 PolarHBondContact OD1-OG1 3.1Å; N321-V339 HydrophobicContact CB-CG1 3.77Å; N321-V339 HydrophobicContact CB-CG2 4.3Å
322	T	77.9	Confident	80.3	Confident	83 Å²	83	74.1 Å²	74.1	51%	0.509	40%	0.399	S	S	.	.	H	α-helix	trans	-86.4	-16	173.2	64.8	0	0	0	0	113.9	H319 L320 V339	H319-T322 PolarHBondContact CE1-OG1 3.4Å; H319-T322 PolarHBondContact ND1-OG1 3.43Å; H319-T322 WeakPolarHBondContact O-CA 3.33Å; H319-T322 WeakPolarHBondContact O-CB 3.37Å; H319-T322 PolarHBondContact O-N 3.5Å; H319-T322 PolarHBondContact O-OG1 3.01Å; L320-T322 PolarHBondContact O-N 2.79Å; T322-V339 HydrophobicContact CG2-CG2 4.19Å
323	H	76.4	Confident	80.4	Confident	76 Å²	76	74.4 Å²	74.4	35%	0.352	40%	0.398	S	S	.	.	H	α-helix	trans	-94.9	-42.8	172.7	-62.9	-68	0	0	0	112	L305 H319 L320 G325	L305-H323 HydrophobicContact CD1-CB 3.45Å; L305-H323 VanDerWaalsContact CD1-CB 3.45Å; H319-H323 AromaticContact CD2-NE2 3.82Å; H319-H323 AromaticContact CE1-CD2 3.98Å; H319-H323 AromaticContact CE1-CE1 3.9Å; H319-H323 AromaticContact CE1-NE2 3.27Å; H319-H323 PolarHBondContact CE1-NE2 2.81Å; H319-H323 VanDerWaalsContact CE1-NE2 3.27Å; H319-H323 AromaticContact NE2-CD2 3.86Å; H319-H323 AromaticContact NE2-CE1 3.89Å; H319-H323 AromaticContact NE2-NE2 3.01Å; H319-H323 PolarHBondContact NE2-NE2 3.08Å; L320-H323 PolarHBondContact O-N 3.09Å; H323-G325 PolarHBondContact O-N 2.61Å
324	T	77.6	Confident	80.7	Confident	77 Å²	77	72.7 Å²	72.7	47%	0.472	39%	0.389	S	S	.	.	S	Bend	trans	-75.1	-8.9	178.3	54.8	0	0	0	0	113.3	L320 N321 T326	L320-T324 HydrophobicContact CD1-CG2 4.37Å; L320-T324 HydrophobicContact CG-CG2 4.26Å; L320-T324 PolarHBondContact O-N 3.29Å; L320-T324 PolarHBondContact O-OG1 3.39Å; L320-T324 VanDerWaalsContact O-OG1 3.12Å; N321-T324 WeakPolarHBondContact CA-OG1 3.37Å; T324-T326 PolarHBondContact O-N 3.33Å; T324-T326 PolarHBondContact OG1-OG1 3Å
325	G	76.4	Confident	80.7	Confident	48 Å²	48	77 Å²	77	50%	0.495	41%	0.409	S	S	.	.			trans	68.5	-4.3	-174.8	0	0	0	0	0	114.9	N321 H323 R327	N321-G325 PolarHBondContact O-N 3.37Å; H323-G325 PolarHBondContact O-N 2.61Å; G325-R327 WeakPolarHBondContact O-CG 3.46Å; G325-R327 PolarHBondContact O-N 3.12Å
326	T	77.6	Confident	80.6	Confident	75 Å²	75	76.7 Å²	76.7	46%	0.46	41%	0.407	S	S	.	.			trans	-69.3	101.8	-176.7	52.8	0	0	0	0	110.8	N321 T324 P328	N321-T326 VanDerWaalsContact CB-O 3.31Å; N321-T326 WeakPolarHBondContact CB-O 3.24Å; N321-T326 PolarHBondContact OD1-OG1 3.1Å; T324-T326 PolarHBondContact O-N 3.33Å; T324-T326 PolarHBondContact OG1-OG1 3Å; T326-P328 WeakPolarHBondContact O-CD 3.26Å
327	R	79.4	Confident	80.6	Confident	111 Å²	111	76 Å²	76	42%	0.419	41%	0.406	S	S	.	.			trans	-108.1	94.2	-177.2	-70.5	161.7	78.7	158.5	2.8	108.9	G325 H329 A337 F338 V339	G325-R327 WeakPolarHBondContact O-CG 3.46Å; G325-R327 PolarHBondContact O-N 3.12Å; R327-H329 VanDerWaalsContact C-N 3.32Å; R327-H329 PolarHBondContact O-N 3.18Å; R327-A337 HydrophobicContact CB-CB 3.56Å; R327-A337 PolarHBondContact NE-O 2.88Å; R327-A337 PolarHBondContact NH2-O 3.31Å; R327-F338 CarbonylContact C-O 3.41Å; R327-F338 VanDerWaalsContact C-O 3.24Å; R327-F338 WeakPolarHBondContact CA-O 3.46Å; R327-V339 HydrophobicContact CG-CG2 3.93Å
328	P	77.5	Confident	80.6	Confident	80 Å²	80	69.8 Å²	69.8	52%	0.519	38%	0.383	S	S	.	.			trans	-69.4	-27.4	-165.9	-20.5	34.3	0	0	0	114	T326 K330 F338	T326-P328 WeakPolarHBondContact O-CD 3.26Å; P328-K330 PolarHBondContact O-N 3.43Å; P328-F338 WeakPolarHBondContact CD-O 3.4Å
329	H	79.7	Confident	80.5	Confident	70 Å²	70	67.9 Å²	67.9	32%	0.324	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	80.4	-173	-59	-71	0	0	0	110.6	R327 A337 F338 S341 L344	R327-H329 VanDerWaalsContact C-N 3.32Å; R327-H329 PolarHBondContact O-N 3.18Å; H329-A337 CarbonylContact O-C 3.54Å; H329-A337 WeakPolarHBondContact O-CA 3.25Å; H329-F338 HydrophobicContact CB-CB 4.4Å; H329-F338 PolarHBondContact N-O 3.34Å; H329-F338 PolarHBondContact O-N 2.66Å; H329-S341 PolarHBondContact CD2-N 3.28Å; H329-S341 PolarHBondContact NE2-N 3.04Å; H329-L344 HydrophobicContact CB-CB 4.09Å; H329-L344 HydrophobicContact CB-CD2 3.94Å
330	K	81.4	Confident	80.5	Confident	165 Å²	165	68.6 Å²	68.6	72%	0.717	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.2	142.9	171.9	-61.4	-169.8	179.9	-176.8	0	110.8	P328 A337 L344	P328-K330 PolarHBondContact O-N 3.43Å; K330-A337 HydrophobicContact CG-CB 4.07Å; K330-L344 VanDerWaalsContact O-CD2 3.26Å; K330-L344 WeakPolarHBondContact O-CD2 3.34Å
331	C	86.8	Confident	80.4	Confident	15 Å²	15	69.5 Å²	69.5	10%	0.101	39%	0.39	C	S	.	.			trans	-79.7	142.8	169.6	-170.5	0	0	0	0	109.7	D333 C334 M336 L344	C331-D333 VanDerWaalsContact C-N 3.28Å; C331-D333 PolarHBondContact SG-N 2.91Å; C331-D333 VanDerWaalsContact SG-N 3.42Å; C331-C334 WeakPolarHBondContact CB-O 3.46Å; C331-C334 VanDerWaalsContact O-O 3.14Å; C331-M336 WeakPolarHBondContact CB-O 3.47Å; C331-M336 PolarHBondContact N-O 2.95Å; C331-M336 VanDerWaalsContact N-O 3.16Å; C331-L344 VanDerWaalsContact CA-CD1 3.47Å; C331-L344 HydrophobicContact CB-CD1 3.53Å
332	T	80.6	Confident	80.3	Confident	110 Å²	110	70.2 Å²	70.2	68%	0.675	40%	0.403	S	S	*	.	S	Bend	trans	-77.8	-19	174.1	47.3	0	0	0	0	112	R348	T332-R348 PolarHBondContact OG1-NE 3.5Å; T332-R348 PolarHBondContact OG1-NH2 3.33Å
333	D	80.4	Confident	80.5	Confident	60 Å²	60	69.8 Å²	69.8	32%	0.321	40%	0.395	S	S	.	.	S	Bend	trans	-110.3	-7.3	-166.1	-39.4	-29.4	0	0	0	112.4	C331 R348 H352	C331-D333 VanDerWaalsContact C-N 3.28Å; C331-D333 PolarHBondContact SG-N 2.91Å; C331-D333 VanDerWaalsContact SG-N 3.42Å; D333-R348 VanDerWaalsContact CG-NH2 3.33Å; D333-R348 IonicContact OD1-CZ 3.59Å; D333-R348 IonicContact OD1-NE 2.72Å; D333-R348 IonicContact OD1-NH2 2.8Å; D333-R348 PolarHBondContact OD1-NH2 3.39Å; D333-R348 IonicContact OD2-CZ 3.84Å; D333-R348 VanDerWaalsContact OD2-CZ 3.32Å; D333-R348 IonicContact OD2-NE 3.48Å; D333-R348 PolarHBondContact OD2-NE 3.41Å; D333-R348 IonicContact OD2-NH2 3.15Å; D333-R348 PolarHBondContact OD2-NH2 3.02Å; D333-R348 VanDerWaalsContact OD2-NH2 3.07Å; D333-H352 HydrophobicContact CB-CB 4.08Å; D333-H352 VanDerWaalsContact CB-CG 3.4Å; D333-H352 VanDerWaalsContact CB-ND1 3.27Å; D333-H352 WeakPolarHBondContact CB-ND1 3.47Å; D333-H352 PolarHBondContact O-CE1 3.15Å; D333-H352 WeakPolarHBondContact OD2-CB 3.27Å; D333-H352 IonicContact OD2-CD2 3.58Å; D333-H352 IonicContact OD2-CG 3.06Å
334	C	86.3	Confident	80.9	Confident	39 Å²	39	67.5 Å²	67.5	26%	0.264	39%	0.385	S	S	.	.	S	Bend	trans	-169	172.6	168.1	66.8	0	0	0	0	111.6	C331 M336 H347 H352	C331-C334 WeakPolarHBondContact CB-O 3.46Å; C331-C334 VanDerWaalsContact O-O 3.14Å; C334-M336 PolarHBondContact O-N 3.42Å; C334-H347 PolarHBondContact SG-NE2 2.88Å; C334-H352 PolarHBondContact SG-NE2 3.1Å
335	D	80.8	Confident	81.1	Confident	169 Å²	169	67.1 Å²	67.1	90%	0.904	38%	0.383	S	S	*	.	S	Bend	trans	-70.2	1.9	-175.4	-43.4	-73.7	0	0	0	115.1	A337	D335-A337 PolarHBondContact O-N 3Å; D335-A337 VanDerWaalsContact O-N 3.07Å
336	M	79.6	Confident	81.4	Confident	84 Å²	84	69.4 Å²	69.4	41%	0.414	38%	0.377	S	S	.	.			trans	-72.5	103.3	179.1	-68.3	-130.3	77.4	0	0	111.7	C331 C334 F338	C331-M336 WeakPolarHBondContact CB-O 3.47Å; C331-M336 PolarHBondContact N-O 2.95Å; C331-M336 VanDerWaalsContact N-O 3.16Å; C334-M336 PolarHBondContact O-N 3.42Å; M336-F338 HydrophobicContact CB-CE2 3.7Å; M336-F338 HydrophobicContact CB-CZ 3.81Å; M336-F338 WeakPolarHBondContact O-CD2 3.38Å; M336-F338 WeakPolarHBondContact O-CE2 3.42Å; M336-F338 HydrophobicContact SD-CZ 4.27Å
337	A	83.2	Confident	81.7	Confident	18 Å²	18	66.8 Å²	66.8	15%	0.149	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	158	167.6	0	0	0	0	0	113	R327 H329 K330 D335	R327-A337 HydrophobicContact CB-CB 3.56Å; R327-A337 PolarHBondContact NE-O 2.88Å; R327-A337 PolarHBondContact NH2-O 3.31Å; H329-A337 CarbonylContact O-C 3.54Å; H329-A337 WeakPolarHBondContact O-CA 3.25Å; K330-A337 HydrophobicContact CG-CB 4.07Å; D335-A337 PolarHBondContact O-N 3Å; D335-A337 VanDerWaalsContact O-N 3.07Å
338	F	81.3	Confident	81.8	Confident	27 Å²	27	66.1 Å²	66.1	12%	0.118	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	154.2	179.9	-66.5	-80	0	0	0	112.8	R327 P328 H329 M336 E343 L344 H347	R327-F338 CarbonylContact C-O 3.41Å; R327-F338 VanDerWaalsContact C-O 3.24Å; R327-F338 WeakPolarHBondContact CA-O 3.46Å; P328-F338 WeakPolarHBondContact CD-O 3.4Å; H329-F338 HydrophobicContact CB-CB 4.4Å; H329-F338 PolarHBondContact N-O 3.34Å; H329-F338 PolarHBondContact O-N 2.66Å; M336-F338 HydrophobicContact CB-CE2 3.7Å; M336-F338 HydrophobicContact CB-CZ 3.81Å; M336-F338 WeakPolarHBondContact O-CD2 3.38Å; M336-F338 WeakPolarHBondContact O-CE2 3.42Å; M336-F338 HydrophobicContact SD-CZ 4.27Å; F338-E343 HydrophobicContact CB-CB 3.96Å; F338-E343 HydrophobicContact CD1-CB 3.79Å; F338-E343 HydrophobicContact CG-CB 4.05Å; F338-L344 HydrophobicContact CB-CB 4.21Å; F338-L344 HydrophobicContact CD2-CB 3.95Å; F338-L344 HydrophobicContact CD2-CD1 3.99Å; F338-L344 HydrophobicContact CE2-CD1 4.39Å; F338-L344 HydrophobicContact CG-CB 4.34Å; F338-H347 HydrophobicContact CD2-CB 4.35Å; F338-H347 HydrophobicContact CE1-CB 4.17Å; F338-H347 HydrophobicContact CE2-CB 3.57Å; F338-H347 AromaticContact CE2-CD2 3.57Å; F338-H347 AromaticContact CE2-CG 3.38Å; F338-H347 AromaticContact CE2-ND1 3.85Å; F338-H347 HydrophobicContact CZ-CB 3.48Å; F338-H347 VanDerWaalsContact CZ-CB 3.48Å; F338-H347 AromaticContact CZ-CD2 3.94Å; F338-H347 AromaticContact CZ-CE1 3.99Å; F338-H347 AromaticContact CZ-CG 3.32Å; F338-H347 AromaticContact CZ-ND1 3.38Å; F338-H347 WeakPolarHBondContact CZ-ND1 3.34Å
339	V	81.6	Confident	82	Confident	21 Å²	21	67.6 Å²	67.6	13%	0.127	35%	0.352	C	S	.	.	S	Bend	trans	-76.3	-32.2	179.2	174.9	0	0	0	0	110.9	N318 N321 T322 R327	N318-V339 HydrophobicContact CB-CG1 4.11Å; N318-V339 WeakPolarHBondContact O-CG1 3.35Å; N321-V339 HydrophobicContact CB-CG1 3.77Å; N321-V339 HydrophobicContact CB-CG2 4.3Å; T322-V339 HydrophobicContact CG2-CG2 4.19Å; R327-V339 HydrophobicContact CG-CG2 3.93Å
340	T	81.9	Confident	81.9	Confident	37 Å²	37	68.6 Å²	68.6	23%	0.227	35%	0.353	C	S	.	.	S	Bend	trans	-127.2	147.5	176.9	67.7	0	0	0	0	112.8	G342 E343 L344	T340-G342 VanDerWaalsContact C-N 3.25Å; T340-G342 PolarHBondContact O-N 2.92Å; T340-E343 WeakPolarHBondContact CB-OE2 3.41Å; T340-E343 PolarHBondContact N-OE2 3.49Å; T340-E343 WeakPolarHBondContact O-CB 3.44Å; T340-E343 PolarHBondContact O-N 2.87Å; T340-E343 VanDerWaalsContact OG1-CG 3.23Å; T340-E343 WeakPolarHBondContact OG1-CG 3.19Å; T340-E343 PolarHBondContact OG1-N 3.15Å; T340-E343 PolarHBondContact OG1-OE2 3.12Å; T340-L344 PolarHBondContact O-N 3.38Å
341	S	79.3	Confident	81.6	Confident	71 Å²	71	67.1 Å²	67.1	50%	0.497	35%	0.347	S	S	.	.	H	α-helix	trans	-58.2	-36.7	176.4	55.2	0	0	0	0	112.6	H329 E343 L344 V345	H329-S341 PolarHBondContact CD2-N 3.28Å; H329-S341 PolarHBondContact NE2-N 3.04Å; S341-E343 VanDerWaalsContact C-N 3.27Å; S341-E343 PolarHBondContact O-N 3.02Å; S341-L344 PolarHBondContact O-N 3.47Å; S341-V345 WeakPolarHBondContact O-CG2 3.42Å; S341-V345 PolarHBondContact O-N 3Å
342	G	81.6	Confident	81.3	Confident	39 Å²	39	69.7 Å²	69.7	40%	0.402	36%	0.357	S	S	.	.	H	α-helix	trans	-65.5	-25	175	0	0	0	0	0	114.2	T340 R346	T340-G342 VanDerWaalsContact C-N 3.25Å; T340-G342 PolarHBondContact O-N 2.92Å; G342-R346 VanDerWaalsContact O-CB 3.27Å; G342-R346 WeakPolarHBondContact O-CB 3.42Å; G342-R346 PolarHBondContact O-N 3.35Å; G342-R346 PolarHBondContact O-NH1 3.22Å
343	E	81.6	Confident	81	Confident	73 Å²	73	67.7 Å²	67.7	34%	0.341	35%	0.345	S	S	.	.	H	α-helix	trans	-77	-40.9	170.2	-72.3	160.4	145.8	0	0	112.1	F338 T340 S341 R346 H347	F338-E343 HydrophobicContact CB-CB 3.96Å; F338-E343 HydrophobicContact CD1-CB 3.79Å; F338-E343 HydrophobicContact CG-CB 4.05Å; T340-E343 WeakPolarHBondContact CB-OE2 3.41Å; T340-E343 PolarHBondContact N-OE2 3.49Å; T340-E343 WeakPolarHBondContact O-CB 3.44Å; T340-E343 PolarHBondContact O-N 2.87Å; T340-E343 VanDerWaalsContact OG1-CG 3.23Å; T340-E343 WeakPolarHBondContact OG1-CG 3.19Å; T340-E343 PolarHBondContact OG1-N 3.15Å; T340-E343 PolarHBondContact OG1-OE2 3.12Å; S341-E343 VanDerWaalsContact C-N 3.27Å; S341-E343 PolarHBondContact O-N 3.02Å; E343-R346 VanDerWaalsContact CG-NH1 3.31Å; E343-R346 PolarHBondContact O-N 2.93Å; E343-H347 VanDerWaalsContact O-CB 3.32Å; E343-H347 WeakPolarHBondContact O-CB 3.28Å; E343-H347 PolarHBondContact O-N 3.4Å
344	L	84.7	Confident	80.7	Confident	28 Å²	28	70.6 Å²	70.6	15%	0.147	36%	0.356	C	S	.	.	H	α-helix	trans	-59.3	-51.3	173.3	171	59.1	0	0	0	111.7	H329 K330 C331 F338 T340 S341 R346 H347 R348	H329-L344 HydrophobicContact CB-CB 4.09Å; H329-L344 HydrophobicContact CB-CD2 3.94Å; K330-L344 VanDerWaalsContact O-CD2 3.26Å; K330-L344 WeakPolarHBondContact O-CD2 3.34Å; C331-L344 VanDerWaalsContact CA-CD1 3.47Å; C331-L344 HydrophobicContact CB-CD1 3.53Å; F338-L344 HydrophobicContact CB-CB 4.21Å; F338-L344 HydrophobicContact CD2-CB 3.95Å; F338-L344 HydrophobicContact CD2-CD1 3.99Å; F338-L344 HydrophobicContact CE2-CD1 4.39Å; F338-L344 HydrophobicContact CG-CB 4.34Å; T340-L344 PolarHBondContact O-N 3.38Å; S341-L344 PolarHBondContact O-N 3.47Å; L344-R346 VanDerWaalsContact C-N 3.29Å; L344-R346 PolarHBondContact O-N 2.61Å; L344-H347 WeakPolarHBondContact O-CB 3.17Å; L344-H347 PolarHBondContact O-N 3.17Å; L344-H347 VanDerWaalsContact O-N 3.07Å; L344-R348 HydrophobicContact CD1-CG 3.93Å; L344-R348 PolarHBondContact O-N 2.79Å
345	V	82.2	Confident	80.1	Confident	69 Å²	69	74 Å²	74	42%	0.418	37%	0.368	S	S	.	.	H	α-helix	trans	-59.9	-40.3	179.1	172.8	0	0	0	0	111.3	S341 R349	S341-V345 WeakPolarHBondContact O-CG2 3.42Å; S341-V345 PolarHBondContact O-N 3Å; V345-R349 WeakPolarHBondContact O-CG 3.4Å; V345-R349 PolarHBondContact O-N 3.24Å
346	R	81.6	Confident	79.9	Confident	97 Å²	97	70.9 Å²	70.9	37%	0.366	35%	0.347	S	S	.	.	H	α-helix	trans	-64.1	-42.4	174.5	-174.1	-161.5	-69.5	103	6.6	111.4	G342 E343 L344 Y350 E369	G342-R346 VanDerWaalsContact O-CB 3.27Å; G342-R346 WeakPolarHBondContact O-CB 3.42Å; G342-R346 PolarHBondContact O-N 3.35Å; G342-R346 PolarHBondContact O-NH1 3.22Å; E343-R346 VanDerWaalsContact CG-NH1 3.31Å; E343-R346 PolarHBondContact O-N 2.93Å; L344-R346 VanDerWaalsContact C-N 3.29Å; L344-R346 PolarHBondContact O-N 2.61Å; R346-Y350 HydrophobicContact CG-CD2 3.81Å; R346-Y350 HydrophobicContact CG-CE2 3.74Å; R346-Y350 VanDerWaalsContact O-CD2 3.3Å; R346-Y350 WeakPolarHBondContact O-CD2 3.49Å; R346-Y350 PolarHBondContact O-N 2.95Å; R346-E369 WeakPolarHBondContact CD-OE1 3.48Å; R346-E369 IonicContact CZ-OE1 3.66Å; R346-E369 IonicContact NE-OE1 3.64Å; R346-E369 PolarHBondContact NE-OE1 2.99Å; R346-E369 IonicContact NH2-OE1 3.56Å
347	H	83.6	Confident	79.8	Confident	20 Å²	20	70.4 Å²	70.4	9%	0.093	35%	0.35	C	S	.	.	H	α-helix	trans	-63.3	-49.5	177.6	168.4	88.1	0	0	0	111.7	C334 F338 E343 L344 R349 Y350 K351 H352	C334-H347 PolarHBondContact SG-NE2 2.88Å; F338-H347 HydrophobicContact CD2-CB 4.35Å; F338-H347 HydrophobicContact CE1-CB 4.17Å; F338-H347 HydrophobicContact CE2-CB 3.57Å; F338-H347 AromaticContact CE2-CD2 3.57Å; F338-H347 AromaticContact CE2-CG 3.38Å; F338-H347 AromaticContact CE2-ND1 3.85Å; F338-H347 HydrophobicContact CZ-CB 3.48Å; F338-H347 VanDerWaalsContact CZ-CB 3.48Å; F338-H347 AromaticContact CZ-CD2 3.94Å; F338-H347 AromaticContact CZ-CE1 3.99Å; F338-H347 AromaticContact CZ-CG 3.32Å; F338-H347 AromaticContact CZ-ND1 3.38Å; F338-H347 WeakPolarHBondContact CZ-ND1 3.34Å; E343-H347 VanDerWaalsContact O-CB 3.32Å; E343-H347 WeakPolarHBondContact O-CB 3.28Å; E343-H347 PolarHBondContact O-N 3.4Å; L344-H347 WeakPolarHBondContact O-CB 3.17Å; L344-H347 PolarHBondContact O-N 3.17Å; L344-H347 VanDerWaalsContact O-N 3.07Å; H347-R349 VanDerWaalsContact C-N 3.29Å; H347-R349 PolarHBondContact O-N 2.82Å; H347-Y350 PolarHBondContact O-N 3.27Å; H347-K351 WeakPolarHBondContact O-CB 3.47Å; H347-K351 PolarHBondContact O-N 2.96Å; H347-H352 AromaticContact NE2-CD2 3.91Å; H347-H352 AromaticContact NE2-NE2 3.5Å
348	R	82.6	Confident	79.7	Confident	96 Å²	96	73.2 Å²	73.2	36%	0.362	36%	0.359	S	S	.	.	H	α-helix	trans	-53.4	-45.3	177.2	-69.3	-171	77.6	-170.4	4.4	111.8	T332 D333 L344 K351 H352 T353	T332-R348 PolarHBondContact OG1-NE 3.5Å; T332-R348 PolarHBondContact OG1-NH2 3.33Å; D333-R348 VanDerWaalsContact CG-NH2 3.33Å; D333-R348 IonicContact OD1-CZ 3.59Å; D333-R348 IonicContact OD1-NE 2.72Å; D333-R348 IonicContact OD1-NH2 2.8Å; D333-R348 PolarHBondContact OD1-NH2 3.39Å; D333-R348 IonicContact OD2-CZ 3.84Å; D333-R348 VanDerWaalsContact OD2-CZ 3.32Å; D333-R348 IonicContact OD2-NE 3.48Å; D333-R348 PolarHBondContact OD2-NE 3.41Å; D333-R348 IonicContact OD2-NH2 3.15Å; D333-R348 PolarHBondContact OD2-NH2 3.02Å; D333-R348 VanDerWaalsContact OD2-NH2 3.07Å; L344-R348 HydrophobicContact CD1-CG 3.93Å; L344-R348 PolarHBondContact O-N 2.79Å; R348-K351 PolarHBondContact O-N 3.36Å; R348-H352 WeakPolarHBondContact O-CA 3.41Å; R348-H352 WeakPolarHBondContact O-CB 3.43Å; R348-H352 PolarHBondContact O-N 2.85Å; R348-T353 PolarHBondContact O-N 3.13Å
349	R	82	Confident	79.8	Confident	112 Å²	112	79.6 Å²	79.6	42%	0.423	39%	0.387	S	S	.	.	H	α-helix	trans	-66.5	-37.4	175.4	-64.1	-179.5	-157.6	-150.6	3.1	114	V345 H347 T353 H354 V368	V345-R349 WeakPolarHBondContact O-CG 3.4Å; V345-R349 PolarHBondContact O-N 3.24Å; H347-R349 VanDerWaalsContact C-N 3.29Å; H347-R349 PolarHBondContact O-N 2.82Å; R349-T353 WeakPolarHBondContact CA-OG1 3.31Å; R349-H354 VanDerWaalsContact O-CA 3.31Å; R349-H354 WeakPolarHBondContact O-CA 3.48Å; R349-H354 PolarHBondContact O-N 2.89Å; R349-V368 HydrophobicContact CB-CG1 3.51Å; R349-V368 HydrophobicContact CG-CG1 4.47Å
350	Y	78.1	Confident	80.2	Confident	91 Å²	91	79.3 Å²	79.3	36%	0.357	39%	0.386	S	S	.	.	H	α-helix	trans	-70.5	-37.8	176.2	-91	-61.9	0	0	0	113.7	R346 H347 H354 V368 E369	R346-Y350 HydrophobicContact CG-CD2 3.81Å; R346-Y350 HydrophobicContact CG-CE2 3.74Å; R346-Y350 VanDerWaalsContact O-CD2 3.3Å; R346-Y350 WeakPolarHBondContact O-CD2 3.49Å; R346-Y350 PolarHBondContact O-N 2.95Å; H347-Y350 PolarHBondContact O-N 3.27Å; Y350-H354 PolarHBondContact O-ND1 2.94Å; Y350-V368 HydrophobicContact CD1-CB 4.15Å; Y350-V368 HydrophobicContact CD1-CG2 3.4Å; Y350-V368 VanDerWaalsContact CD1-CG2 3.4Å; Y350-V368 HydrophobicContact CD2-CB 4.28Å; Y350-V368 HydrophobicContact CD2-CG1 4.47Å; Y350-V368 HydrophobicContact CD2-CG2 4.28Å; Y350-V368 HydrophobicContact CE1-CB 3.82Å; Y350-V368 HydrophobicContact CE1-CG2 3.41Å; Y350-V368 VanDerWaalsContact CE1-CG2 3.41Å; Y350-V368 HydrophobicContact CE2-CB 3.95Å; Y350-V368 HydrophobicContact CE2-CG1 4.43Å; Y350-V368 HydrophobicContact CE2-CG2 4.28Å; Y350-V368 HydrophobicContact CG-CB 4.35Å; Y350-V368 HydrophobicContact CG-CG2 3.85Å; Y350-E369 HydrophobicContact CE2-CG 4.47Å
351	K	75	Confident	80.2	Confident	133 Å²	133	82.8 Å²	82.8	58%	0.578	41%	0.411	S	S	*	.	H	α-helix	trans	-109.9	-28.5	-164.9	-83	-70.7	-164.3	163.2	0	115.9	H347 R348 H354	H347-K351 WeakPolarHBondContact O-CB 3.47Å; H347-K351 PolarHBondContact O-N 2.96Å; R348-K351 PolarHBondContact O-N 3.36Å; K351-H354 PolarHBondContact O-CE1 2.84Å
352	H	78.8	Confident	80.3	Confident	69 Å²	69	84.9 Å²	84.9	32%	0.319	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.1	-50.2	-170.6	-61.2	-77.8	0	0	0	112.6	D333 C334 H347 R348	D333-H352 HydrophobicContact CB-CB 4.08Å; D333-H352 VanDerWaalsContact CB-CG 3.4Å; D333-H352 VanDerWaalsContact CB-ND1 3.27Å; D333-H352 WeakPolarHBondContact CB-ND1 3.47Å; D333-H352 PolarHBondContact O-CE1 3.15Å; D333-H352 WeakPolarHBondContact OD2-CB 3.27Å; D333-H352 IonicContact OD2-CD2 3.58Å; D333-H352 IonicContact OD2-CG 3.06Å; C334-H352 PolarHBondContact SG-NE2 3.1Å; H347-H352 AromaticContact NE2-CD2 3.91Å; H347-H352 AromaticContact NE2-NE2 3.5Å; R348-H352 WeakPolarHBondContact O-CA 3.41Å; R348-H352 WeakPolarHBondContact O-CB 3.43Å; R348-H352 PolarHBondContact O-N 2.85Å
353	T	75.6	Confident	80.6	Confident	69 Å²	69	85.3 Å²	85.3	42%	0.423	41%	0.411	S	S	.	.	S	Bend	trans	-81.6	-22.5	175.5	78.6	0	0	0	0	112.9	R348 R349 E355	R348-T353 PolarHBondContact O-N 3.13Å; R349-T353 WeakPolarHBondContact CA-OG1 3.31Å; T353-E355 VanDerWaalsContact CB-OE2 3.25Å; T353-E355 WeakPolarHBondContact CB-OE2 3.44Å; T353-E355 PolarHBondContact O-N 2.93Å; T353-E355 WeakPolarHBondContact OG1-CG 3.25Å; T353-E355 PolarHBondContact OG1-N 2.86Å; T353-E355 PolarHBondContact OG1-OE2 3.4Å
354	H	72.6	Confident	80.8	Confident	120 Å²	120	89.6 Å²	89.6	56%	0.556	44%	0.436	S	S	*	.			trans	53.2	11.1	-172.8	-70.9	-34.4	0	0	0	115.7	R349 Y350 K351 K356	R349-H354 VanDerWaalsContact O-CA 3.31Å; R349-H354 WeakPolarHBondContact O-CA 3.48Å; R349-H354 PolarHBondContact O-N 2.89Å; Y350-H354 PolarHBondContact O-ND1 2.94Å; K351-H354 PolarHBondContact O-CE1 2.84Å; H354-K356 PolarHBondContact O-N 2.91Å
355	E	74.4	Confident	80.7	Confident	110 Å²	110	93.1 Å²	93.1	51%	0.514	45%	0.448	S	S	.	.			trans	-63.9	126.4	179.5	-66	166.7	123.2	0	0	110.6	T353 P357 V368	T353-E355 VanDerWaalsContact CB-OE2 3.25Å; T353-E355 WeakPolarHBondContact CB-OE2 3.44Å; T353-E355 PolarHBondContact O-N 2.93Å; T353-E355 WeakPolarHBondContact OG1-CG 3.25Å; T353-E355 PolarHBondContact OG1-N 2.86Å; T353-E355 PolarHBondContact OG1-OE2 3.4Å; E355-P357 WeakPolarHBondContact O-CD 3.38Å; E355-V368 WeakPolarHBondContact O-CG2 3.29Å
356	K	77.6	Confident	80.9	Confident	105 Å²	105	91.5 Å²	91.5	46%	0.457	44%	0.44	S	S	.	.			trans	-121.5	78.9	178.8	-66.3	160.6	-166.7	167.6	0	108.9	H354 F358 S366 S367 V368	H354-K356 PolarHBondContact O-N 2.91Å; K356-F358 PolarHBondContact O-N 3.21Å; K356-F358 VanDerWaalsContact O-N 3.15Å; K356-S366 VanDerWaalsContact CD-OG 3.3Å; K356-S366 WeakPolarHBondContact CD-OG 3.43Å; K356-S367 CarbonylContact C-O 3.52Å; K356-V368 HydrophobicContact CG-CG2 4.23Å
357	P	77.5	Confident	80.9	Confident	73 Å²	73	87.1 Å²	87.1	47%	0.474	42%	0.424	S	S	.	.			trans	-59.5	-30.4	-173.6	-24.6	35.1	0	0	0	112.9	E355 K359	E355-P357 WeakPolarHBondContact O-CD 3.38Å; P357-K359 PolarHBondContact O-N 2.89Å
358	F	80.3	Confident	80.8	Confident	78 Å²	78	86.8 Å²	86.8	34%	0.342	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	83.8	-173.8	-49.8	-64.7	0	0	0	110.4	K356 S367 V368 V370 L373	K356-F358 PolarHBondContact O-N 3.21Å; K356-F358 VanDerWaalsContact O-N 3.15Å; F358-S367 WeakPolarHBondContact CB-O 3.47Å; F358-S367 PolarHBondContact N-O 3.42Å; F358-S367 VanDerWaalsContact N-O 3.09Å; F358-S367 PolarHBondContact O-N 2.69Å; F358-S367 PolarHBondContact O-OG 3.28Å; F358-V368 WeakPolarHBondContact CD2-O 3.43Å; F358-V368 WeakPolarHBondContact CE2-O 3.39Å; F358-V370 HydrophobicContact CD1-CG2 3.73Å; F358-V370 HydrophobicContact CD2-CG2 3.97Å; F358-V370 HydrophobicContact CE1-CG2 3.48Å; F358-V370 VanDerWaalsContact CE1-CG2 3.48Å; F358-V370 HydrophobicContact CE2-CG2 3.73Å; F358-V370 HydrophobicContact CG-CG2 3.97Å; F358-V370 HydrophobicContact CZ-CG2 3.48Å; F358-V370 VanDerWaalsContact CZ-CG2 3.48Å; F358-L373 HydrophobicContact CB-CB 4.07Å; F358-L373 HydrophobicContact CB-CD2 3.72Å; F358-L373 HydrophobicContact CB-CG 4.46Å
359	K	83.9	Confident	80.8	Confident	160 Å²	160	84 Å²	84	70%	0.696	42%	0.415	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.1	150.4	171.3	-57.4	-177.8	-178.4	178.6	0	111.1	P357 L373	P357-K359 PolarHBondContact O-N 2.89Å; K359-L373 VanDerWaalsContact O-CD2 3.26Å; K359-L373 WeakPolarHBondContact O-CD2 3.47Å
360	C	89.1	Confident	80.8	Confident	16 Å²	16	81.7 Å²	81.7	11%	0.108	41%	0.413	C	S	.	.			trans	-86.7	145.6	169.9	-169.1	0	0	0	0	110.8	M362 C363 Y365 L373	C360-M362 PolarHBondContact SG-N 2.87Å; C360-C363 WeakPolarHBondContact CB-O 3.23Å; C360-Y365 VanDerWaalsContact CB-O 3.29Å; C360-Y365 WeakPolarHBondContact CB-O 3.24Å; C360-Y365 PolarHBondContact N-O 3.1Å; C360-L373 HydrophobicContact CB-CD1 3.75Å
361	S	82.1	Confident	81	Confident	110 Å²	110	80.8 Å²	80.8	77%	0.769	42%	0.42	S	S	*	.	S	Bend	trans	-80.3	-18.3	173.7	48	0	0	0	0	113.7
362	M	80.9	Confident	81.4	Confident	115 Å²	115	78 Å²	78	57%	0.567	41%	0.408	S	S	*	.	S	Bend	trans	-103.1	-8.9	-172	-53	-76.9	-88.3	0	0	113.3	C360 H380	C360-M362 PolarHBondContact SG-N 2.87Å; M362-H380 HydrophobicContact CB-CB 3.98Å; M362-H380 VanDerWaalsContact CB-CD2 3.45Å; M362-H380 WeakPolarHBondContact CB-CD2 3.17Å; M362-H380 HydrophobicContact CE-CB 3.71Å; M362-H380 HydrophobicContact CG-CB 3.92Å
363	C	88.6	Confident	81.7	Confident	47 Å²	47	75.6 Å²	75.6	32%	0.318	40%	0.397	S	S	.	.	S	Bend	trans	-170.9	169.7	174.8	67.4	0	0	0	0	110.9	C360 Y365 H376 H380	C360-C363 WeakPolarHBondContact CB-O 3.23Å; C363-Y365 PolarHBondContact O-N 3.49Å; C363-H376 PolarHBondContact SG-NE2 3.43Å; C363-H380 PolarHBondContact SG-NE2 3.34Å; C363-H380 VanDerWaalsContact SG-NE2 3.41Å
364	D	85.9	Confident	82.1	Confident	163 Å²	163	78.8 Å²	78.8	87%	0.872	41%	0.405	S	S	*	.	S	Bend	trans	-66.9	1.4	-176.8	-46.6	-66.7	0	0	0	115.6	S366	D364-S366 PolarHBondContact O-N 3.49Å
365	Y	83.3	Confident	82.6	Confident	103 Å²	103	78 Å²	78	40%	0.404	40%	0.397	S	S	.	.			trans	-64.2	123.4	178.2	-177.2	-93.5	0	0	0	111.3	C360 C363 H376	C360-Y365 VanDerWaalsContact CB-O 3.29Å; C360-Y365 WeakPolarHBondContact CB-O 3.24Å; C360-Y365 PolarHBondContact N-O 3.1Å; C363-Y365 PolarHBondContact O-N 3.49Å; Y365-H376 WeakPolarHBondContact CB-CE1 3.32Å; Y365-H376 HydrophobicContact CD1-CB 3.88Å; Y365-H376 AromaticContact CD1-CD2 3.61Å; Y365-H376 AromaticContact CD1-CE1 3.69Å; Y365-H376 AromaticContact CD1-CG 3.32Å; Y365-H376 AromaticContact CD1-ND1 3.37Å; Y365-H376 WeakPolarHBondContact CD1-ND1 3.46Å; Y365-H376 AromaticContact CD1-NE2 3.84Å; Y365-H376 HydrophobicContact CE1-CB 3.75Å; Y365-H376 AromaticContact CE1-CG 3.71Å; Y365-H376 AromaticContact CE1-ND1 3.86Å; Y365-H376 AromaticContact CG-CE1 3.46Å; Y365-H376 VanDerWaalsContact CG-CE1 3.46Å; Y365-H376 AromaticContact CG-CG 3.92Å; Y365-H376 AromaticContact CG-ND1 3.47Å; Y365-H376 AromaticContact CG-NE2 3.88Å
366	S	85.1	Confident	83.1	Confident	35 Å²	35	74.3 Å²	74.3	25%	0.245	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	147.3	179.9	50.1	0	0	0	0	110.7	K356 D364	K356-S366 VanDerWaalsContact CD-OG 3.3Å; K356-S366 WeakPolarHBondContact CD-OG 3.43Å; D364-S366 PolarHBondContact O-N 3.49Å
367	S	81.8	Confident	83.5	Confident	4 Å²	4	71.8 Å²	71.8	3%	0.028	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	159.1	-175.7	66	0	0	0	0	113.8	K356 F358 E369 L373	K356-S367 CarbonylContact C-O 3.52Å; F358-S367 WeakPolarHBondContact CB-O 3.47Å; F358-S367 PolarHBondContact N-O 3.42Å; F358-S367 VanDerWaalsContact N-O 3.09Å; F358-S367 PolarHBondContact O-N 2.69Å; F358-S367 PolarHBondContact O-OG 3.28Å; S367-E369 PolarHBondContact OG-O 3.07Å; S367-L373 PolarHBondContact OG-N 3.04Å
368	V	81.7	Confident	83.8	Confident	14 Å²	14	71.6 Å²	71.6	9%	0.085	36%	0.361	C	S	.	.	S	Bend	trans	-81.8	-15.1	-179.8	-167.8	0	0	0	0	112.4	R349 Y350 E355 K356 F358	R349-V368 HydrophobicContact CB-CG1 3.51Å; R349-V368 HydrophobicContact CG-CG1 4.47Å; Y350-V368 HydrophobicContact CD1-CB 4.15Å; Y350-V368 HydrophobicContact CD1-CG2 3.4Å; Y350-V368 VanDerWaalsContact CD1-CG2 3.4Å; Y350-V368 HydrophobicContact CD2-CB 4.28Å; Y350-V368 HydrophobicContact CD2-CG1 4.47Å; Y350-V368 HydrophobicContact CD2-CG2 4.28Å; Y350-V368 HydrophobicContact CE1-CB 3.82Å; Y350-V368 HydrophobicContact CE1-CG2 3.41Å; Y350-V368 VanDerWaalsContact CE1-CG2 3.41Å; Y350-V368 HydrophobicContact CE2-CB 3.95Å; Y350-V368 HydrophobicContact CE2-CG1 4.43Å; Y350-V368 HydrophobicContact CE2-CG2 4.28Å; Y350-V368 HydrophobicContact CG-CB 4.35Å; Y350-V368 HydrophobicContact CG-CG2 3.85Å; E355-V368 WeakPolarHBondContact O-CG2 3.29Å; K356-V368 HydrophobicContact CG-CG2 4.23Å; F358-V368 WeakPolarHBondContact CD2-O 3.43Å; F358-V368 WeakPolarHBondContact CE2-O 3.39Å
369	E	82.5	Confident	83.9	Confident	37 Å²	37	70.1 Å²	70.1	17%	0.173	36%	0.36	C	S	.	.			trans	-128	127.3	-175.5	-70	-168.8	132.3	0	0	112.5	R346 Y350 S367 S371 K372 L373	R346-E369 WeakPolarHBondContact CD-OE1 3.48Å; R346-E369 IonicContact CZ-OE1 3.66Å; R346-E369 IonicContact NE-OE1 3.64Å; R346-E369 PolarHBondContact NE-OE1 2.99Å; R346-E369 IonicContact NH2-OE1 3.56Å; Y350-E369 HydrophobicContact CE2-CG 4.47Å; S367-E369 PolarHBondContact OG-O 3.07Å; E369-S371 PolarHBondContact O-N 2.99Å; E369-S371 VanDerWaalsContact O-N 3.12Å; E369-K372 HydrophobicContact CB-CB 4.36Å; E369-K372 HydrophobicContact CB-CG 3.74Å; E369-K372 WeakPolarHBondContact O-CB 3.34Å; E369-K372 PolarHBondContact O-N 3.02Å; E369-K372 WeakPolarHBondContact OE2-CE 3.02Å; E369-K372 WeakPolarHBondContact OE2-CG 3.42Å; E369-K372 IonicContact OE2-NZ 3.14Å; E369-L373 PolarHBondContact O-N 3.37Å; E369-L373 VanDerWaalsContact O-N 3.09Å
370	V	82.8	Confident	83.8	Confident	63 Å²	63	65.9 Å²	65.9	38%	0.382	34%	0.343	S	S	.	.	H	α-helix	trans	-51.4	-36.3	173.6	-176.4	0	0	0	0	112.3	F358 K372 L373 K374	F358-V370 HydrophobicContact CD1-CG2 3.73Å; F358-V370 HydrophobicContact CD2-CG2 3.97Å; F358-V370 HydrophobicContact CE1-CG2 3.48Å; F358-V370 VanDerWaalsContact CE1-CG2 3.48Å; F358-V370 HydrophobicContact CE2-CG2 3.73Å; F358-V370 HydrophobicContact CG-CG2 3.97Å; F358-V370 HydrophobicContact CZ-CG2 3.48Å; F358-V370 VanDerWaalsContact CZ-CG2 3.48Å; V370-K372 VanDerWaalsContact C-N 3.35Å; V370-K372 PolarHBondContact O-N 3.26Å; V370-L373 PolarHBondContact O-N 3.46Å; V370-K374 HydrophobicContact CG1-CD 4.04Å; V370-K374 HydrophobicContact CG1-CG 4.17Å; V370-K374 WeakPolarHBondContact O-CB 3.39Å; V370-K374 WeakPolarHBondContact O-CG 3.45Å; V370-K374 PolarHBondContact O-N 2.87Å
371	S	82.3	Confident	83.5	Confident	73 Å²	73	68.5 Å²	68.5	51%	0.51	36%	0.358	S	S	.	.	H	α-helix	trans	-65.1	-36	178.3	64	0	0	0	0	112.8	E369 R375	E369-S371 PolarHBondContact O-N 2.99Å; E369-S371 VanDerWaalsContact O-N 3.12Å; S371-R375 WeakPolarHBondContact O-CB 3.36Å; S371-R375 PolarHBondContact O-N 3.37Å; S371-R375 VanDerWaalsContact O-N 3.1Å
372	K	81.9	Confident	83.4	Confident	73 Å²	73	65.4 Å²	65.4	32%	0.317	34%	0.344	S	S	.	.	H	α-helix	trans	-74	-41.1	176.3	-52.4	-74.7	174.8	169.9	0	109.8	E369 V370 R375 H376	E369-K372 HydrophobicContact CB-CB 4.36Å; E369-K372 HydrophobicContact CB-CG 3.74Å; E369-K372 WeakPolarHBondContact O-CB 3.34Å; E369-K372 PolarHBondContact O-N 3.02Å; E369-K372 WeakPolarHBondContact OE2-CE 3.02Å; E369-K372 WeakPolarHBondContact OE2-CG 3.42Å; E369-K372 IonicContact OE2-NZ 3.14Å; V370-K372 VanDerWaalsContact C-N 3.35Å; V370-K372 PolarHBondContact O-N 3.26Å; K372-R375 PolarHBondContact O-N 2.91Å; K372-H376 VanDerWaalsContact O-CB 3.28Å; K372-H376 WeakPolarHBondContact O-CB 3.42Å; K372-H376 PolarHBondContact O-N 3.28Å
373	L	85.4	Confident	83.5	Confident	20 Å²	20	64.5 Å²	64.5	11%	0.105	34%	0.338	C	S	.	.	H	α-helix	trans	-62.3	-51.4	173.9	-178.7	63.1	0	0	0	111.9	F358 K359 C360 S367 E369 V370 R375 H376 I377	F358-L373 HydrophobicContact CB-CB 4.07Å; F358-L373 HydrophobicContact CB-CD2 3.72Å; F358-L373 HydrophobicContact CB-CG 4.46Å; K359-L373 VanDerWaalsContact O-CD2 3.26Å; K359-L373 WeakPolarHBondContact O-CD2 3.47Å; C360-L373 HydrophobicContact CB-CD1 3.75Å; S367-L373 PolarHBondContact OG-N 3.04Å; E369-L373 PolarHBondContact O-N 3.37Å; E369-L373 VanDerWaalsContact O-N 3.09Å; V370-L373 PolarHBondContact O-N 3.46Å; L373-R375 VanDerWaalsContact C-N 3.3Å; L373-R375 PolarHBondContact O-N 3.32Å; L373-H376 CarbonylContact O-C 3.45Å; L373-H376 WeakPolarHBondContact O-CA 3.43Å; L373-H376 WeakPolarHBondContact O-CB 3.22Å; L373-H376 PolarHBondContact O-N 3.42Å; L373-I377 HydrophobicContact CD1-CD1 4.06Å; L373-I377 HydrophobicContact CD1-CG1 4.07Å; L373-I377 HydrophobicContact CD2-CD1 4.24Å; L373-I377 HydrophobicContact CG-CD1 3.77Å; L373-I377 HydrophobicContact CG-CG1 4.24Å; L373-I377 WeakPolarHBondContact O-CG1 3.49Å; L373-I377 PolarHBondContact O-N 3.49Å
374	K	84.3	Confident	83.2	Confident	136 Å²	136	68.3 Å²	68.3	59%	0.591	35%	0.346	S	S	*	.	H	α-helix	trans	-58.9	-40.2	178.3	-73.6	-173.4	176.5	-172	0	112	V370	V370-K374 HydrophobicContact CG1-CD 4.04Å; V370-K374 HydrophobicContact CG1-CG 4.17Å; V370-K374 WeakPolarHBondContact O-CB 3.39Å; V370-K374 WeakPolarHBondContact O-CG 3.45Å; V370-K374 PolarHBondContact O-N 2.87Å
375	R	83.3	Confident	83	Confident	102 Å²	102	64 Å²	64	39%	0.385	33%	0.327	S	S	.	.	H	α-helix	trans	-67.8	-34.7	173	-174.2	179.5	62.2	173.1	-1.3	112.6	S371 K372 L373 R396 D397	S371-R375 WeakPolarHBondContact O-CB 3.36Å; S371-R375 PolarHBondContact O-N 3.37Å; S371-R375 VanDerWaalsContact O-N 3.1Å; K372-R375 PolarHBondContact O-N 2.91Å; L373-R375 VanDerWaalsContact C-N 3.3Å; L373-R375 PolarHBondContact O-N 3.32Å; R375-R396 PolarHBondContact O-NH2 2.05Å; R375-D397 WeakPolarHBondContact CD-OD2 3.2Å; R375-D397 IonicContact CZ-OD2 2.94Å; R375-D397 IonicContact NE-OD2 3.19Å; R375-D397 IonicContact NH1-OD2 2.66Å; R375-D397 PolarHBondContact NH1-OD2 3.49Å
376	H	85.1	Confident	83	Confident	34 Å²	34	62.1 Å²	62.1	16%	0.157	32%	0.321	C	S	.	.	H	α-helix	trans	-64.4	-54.8	174	169.3	88.7	0	0	0	110.7	C363 Y365 K372 L373 R378 S379 H380 R396	C363-H376 PolarHBondContact SG-NE2 3.43Å; Y365-H376 WeakPolarHBondContact CB-CE1 3.32Å; Y365-H376 HydrophobicContact CD1-CB 3.88Å; Y365-H376 AromaticContact CD1-CD2 3.61Å; Y365-H376 AromaticContact CD1-CE1 3.69Å; Y365-H376 AromaticContact CD1-CG 3.32Å; Y365-H376 AromaticContact CD1-ND1 3.37Å; Y365-H376 WeakPolarHBondContact CD1-ND1 3.46Å; Y365-H376 AromaticContact CD1-NE2 3.84Å; Y365-H376 HydrophobicContact CE1-CB 3.75Å; Y365-H376 AromaticContact CE1-CG 3.71Å; Y365-H376 AromaticContact CE1-ND1 3.86Å; Y365-H376 AromaticContact CG-CE1 3.46Å; Y365-H376 VanDerWaalsContact CG-CE1 3.46Å; Y365-H376 AromaticContact CG-CG 3.92Å; Y365-H376 AromaticContact CG-ND1 3.47Å; Y365-H376 AromaticContact CG-NE2 3.88Å; K372-H376 VanDerWaalsContact O-CB 3.28Å; K372-H376 WeakPolarHBondContact O-CB 3.42Å; K372-H376 PolarHBondContact O-N 3.28Å; L373-H376 CarbonylContact O-C 3.45Å; L373-H376 WeakPolarHBondContact O-CA 3.43Å; L373-H376 WeakPolarHBondContact O-CB 3.22Å; L373-H376 PolarHBondContact O-N 3.42Å; H376-R378 PolarHBondContact O-N 2.94Å; H376-S379 WeakPolarHBondContact O-CB 3.18Å; H376-S379 PolarHBondContact O-N 3.27Å; H376-S379 PolarHBondContact O-OG 3.11Å; H376-H380 AromaticContact CD2-NE2 3.74Å; H376-H380 AromaticContact CE1-NE2 3.61Å; H376-H380 AromaticContact NE2-CD2 3.79Å; H376-H380 AromaticContact NE2-CE1 3.86Å; H376-H380 AromaticContact NE2-NE2 2.92Å; H376-H380 PolarHBondContact NE2-NE2 3.04Å; H376-R396 PolarHBondContact O-NH2 2.93Å
377	I	85.2	Confident	83	Confident	51 Å²	51	67 Å²	67	26%	0.262	34%	0.34	S	S	.	.	H	α-helix	trans	-48.3	-35.9	-176.6	-72.2	167.8	0	0	0	113.1	L373 S379 H380 T381	L373-I377 HydrophobicContact CD1-CD1 4.06Å; L373-I377 HydrophobicContact CD1-CG1 4.07Å; L373-I377 HydrophobicContact CD2-CD1 4.24Å; L373-I377 HydrophobicContact CG-CD1 3.77Å; L373-I377 HydrophobicContact CG-CG1 4.24Å; L373-I377 WeakPolarHBondContact O-CG1 3.49Å; L373-I377 PolarHBondContact O-N 3.49Å; I377-S379 PolarHBondContact O-N 3.34Å; I377-H380 PolarHBondContact O-N 2.9Å; I377-T381 HydrophobicContact CG2-CG2 4.26Å; I377-T381 PolarHBondContact O-N 2.97Å
378	R	85.3	Confident	83.4	Confident	69 Å²	69	67 Å²	67	26%	0.26	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-1.3	170.8	-63.4	178.3	-174.8	149.9	3.4	115.7	H376 E383 R396	H376-R378 PolarHBondContact O-N 2.94Å; R378-E383 HydrophobicContact CG-CB 4.32Å; R378-R396 VanDerWaalsContact C-NE 3.31Å; R378-R396 HydrophobicContact CB-CG 4.41Å; R378-R396 PolarHBondContact NH1-O 3.35Å; R378-R396 VanDerWaalsContact NH1-O 3.16Å; R378-R396 WeakPolarHBondContact O-CD 3.26Å; R378-R396 PolarHBondContact O-NE 2.73Å
379	S	82.5	Confident	83.5	Confident	47 Å²	47	71.3 Å²	71.3	33%	0.329	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-36.1	167.6	47	0	0	0	0	111.4	H376 I377 R396	H376-S379 WeakPolarHBondContact O-CB 3.18Å; H376-S379 PolarHBondContact O-N 3.27Å; H376-S379 PolarHBondContact O-OG 3.11Å; I377-S379 PolarHBondContact O-N 3.34Å; S379-R396 VanDerWaalsContact CA-NH1 3.29Å; S379-R396 VanDerWaalsContact CB-NH1 3.31Å
380	H	81.2	Confident	83.6	Confident	72 Å²	72	74.8 Å²	74.8	33%	0.333	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-35.6	-171.3	-48.5	-53.7	0	0	0	110.4	M362 C363 H376 I377 G382	M362-H380 HydrophobicContact CB-CB 3.98Å; M362-H380 VanDerWaalsContact CB-CD2 3.45Å; M362-H380 WeakPolarHBondContact CB-CD2 3.17Å; M362-H380 HydrophobicContact CE-CB 3.71Å; M362-H380 HydrophobicContact CG-CB 3.92Å; C363-H380 PolarHBondContact SG-NE2 3.34Å; C363-H380 VanDerWaalsContact SG-NE2 3.41Å; H376-H380 AromaticContact CD2-NE2 3.74Å; H376-H380 AromaticContact CE1-NE2 3.61Å; H376-H380 AromaticContact NE2-CD2 3.79Å; H376-H380 AromaticContact NE2-CE1 3.86Å; H376-H380 AromaticContact NE2-NE2 2.92Å; H376-H380 PolarHBondContact NE2-NE2 3.04Å; I377-H380 PolarHBondContact O-N 2.9Å; H380-G382 VanDerWaalsContact C-N 3.33Å
381	T	81.9	Confident	83.9	Confident	70 Å²	70	74.1 Å²	74.1	43%	0.429	39%	0.387	S	S	.	.	S	Bend	trans	-81.6	-9.3	171.1	65.5	0	0	0	0	113.7	I377 E383	I377-T381 HydrophobicContact CG2-CG2 4.26Å; I377-T381 PolarHBondContact O-N 2.97Å; T381-E383 WeakPolarHBondContact CB-OE1 3.45Å; T381-E383 PolarHBondContact O-N 3.06Å; T381-E383 VanDerWaalsContact OG1-CD 3.25Å; T381-E383 WeakPolarHBondContact OG1-CG 3.3Å; T381-E383 PolarHBondContact OG1-OE1 2.94Å
382	G	81.6	Confident	84.1	Confident	46 Å²	46	76.1 Å²	76.1	47%	0.474	40%	0.402	S	S	.	.			trans	67.8	-10.2	-179.7	0	0	0	0	0	116.3	H380 R384	H380-G382 VanDerWaalsContact C-N 3.33Å; G382-R384 WeakPolarHBondContact O-CG 3.41Å; G382-R384 PolarHBondContact O-N 2.66Å
383	E	82	Confident	84.2	Confident	95 Å²	95	76.9 Å²	76.9	44%	0.444	40%	0.403	S	S	.	.			trans	-48.1	128.4	-178.6	-72.4	161.8	-121.2	0	0	113.2	R378 T381 P385 R396	R378-E383 HydrophobicContact CG-CB 4.32Å; T381-E383 WeakPolarHBondContact CB-OE1 3.45Å; T381-E383 PolarHBondContact O-N 3.06Å; T381-E383 VanDerWaalsContact OG1-CD 3.25Å; T381-E383 WeakPolarHBondContact OG1-CG 3.3Å; T381-E383 PolarHBondContact OG1-OE1 2.94Å; E383-P385 WeakPolarHBondContact O-CD 3.32Å; E383-R396 WeakPolarHBondContact O-CG 3.01Å
384	R	82.3	Confident	84.3	Confident	128 Å²	128	76.7 Å²	76.7	48%	0.483	40%	0.404	S	S	.	.			trans	-124.8	71	177.1	-69.7	161.3	82.9	166.7	-0.1	110.9	G382 F386 A394 S395 R396	G382-R384 WeakPolarHBondContact O-CG 3.41Å; G382-R384 PolarHBondContact O-N 2.66Å; R384-F386 PolarHBondContact O-N 3.37Å; R384-A394 HydrophobicContact CB-CB 3.54Å; R384-A394 HydrophobicContact CG-CB 4.48Å; R384-A394 PolarHBondContact NE-O 3.44Å; R384-A394 PolarHBondContact NH2-O 3.48Å; R384-S395 CarbonylContact C-O 3.22Å; R384-S395 WeakPolarHBondContact CA-O 3.46Å; R384-R396 HydrophobicContact CG-CG 3.9Å
385	P	80.9	Confident	84.3	Confident	73 Å²	73	70.4 Å²	70.4	47%	0.474	38%	0.378	S	S	.	.			trans	-65	-11	-168.5	-22.5	34.9	0	0	0	116	E383	E383-P385 WeakPolarHBondContact O-CD 3.32Å
386	F	83.4	Confident	84.2	Confident	63 Å²	63	69.5 Å²	69.5	28%	0.276	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	84.6	-176.1	-54	-68.6	0	0	0	109.9	R384 S395 T398 L401	R384-F386 PolarHBondContact O-N 3.37Å; F386-S395 PolarHBondContact N-O 2.67Å; F386-S395 PolarHBondContact O-N 2.7Å; F386-S395 PolarHBondContact O-OG 2.34Å; F386-T398 HydrophobicContact CD1-CG2 3.59Å; F386-T398 HydrophobicContact CD2-CG2 4.2Å; F386-T398 HydrophobicContact CE1-CG2 3.4Å; F386-T398 HydrophobicContact CE2-CG2 4.02Å; F386-T398 HydrophobicContact CG-CG2 3.99Å; F386-T398 HydrophobicContact CZ-CG2 3.62Å; F386-L401 HydrophobicContact CB-CB 4.16Å; F386-L401 HydrophobicContact CB-CD2 3.88Å
387	Q	86.1	Confident	84.1	Confident	136 Å²	136	69 Å²	69	64%	0.636	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.4	145.9	177.3	-174.6	165.3	-20.2	0	0	112.5	A394 L401	Q387-A394 HydrophobicContact CB-CB 4.34Å; Q387-L401 WeakPolarHBondContact O-CD2 3.33Å
388	C	90.3	Very high	83.9	Confident	4 Å²	4	70.5 Å²	70.5	3%	0.027	38%	0.384	C	S	.	.			trans	-78.2	134	168.2	-176.4	0	0	0	0	110.6	L390 Y393 L401 H404 M405 H408	C388-L390 PolarHBondContact O-N 3.09Å; C388-L390 PolarHBondContact SG-N 3.22Å; C388-Y393 WeakPolarHBondContact CB-O 3.46Å; C388-Y393 PolarHBondContact N-O 2.19Å; C388-L401 HydrophobicContact CB-CD1 3.94Å; C388-H404 PolarHBondContact SG-NE2 2.94Å; C388-M405 HydrophobicContact CB-SD 4.37Å; C388-H408 PolarHBondContact SG-NE2 2.71Å; C388-H408 VanDerWaalsContact SG-NE2 3.38Å
389	S	83.3	Confident	83.8	Confident	105 Å²	105	73.1 Å²	73.1	73%	0.734	40%	0.395	S	S	*	.	S	Bend	trans	-72.4	-16.7	173.4	47.8	0	0	0	0	113.8
390	L	84.1	Confident	83.9	Confident	111 Å²	111	74.9 Å²	74.9	58%	0.581	40%	0.397	S	S	*	.	S	Bend	trans	-108.9	-5.8	-172	-57.1	176.9	0	0	0	113.8	C388 M405 H408	C388-L390 PolarHBondContact O-N 3.09Å; C388-L390 PolarHBondContact SG-N 3.22Å; L390-M405 HydrophobicContact CD1-CE 3.85Å; L390-M405 HydrophobicContact CG-CE 4.19Å; L390-H408 HydrophobicContact CD1-CB 3.54Å
391	C	89.4	Confident	84.1	Confident	48 Å²	48	72.9 Å²	72.9	32%	0.324	39%	0.388	S	S	.	.	S	Bend	trans	-164.7	172.3	171.3	69.8	0	0	0	0	111.6	Y393 H404 H408	C391-Y393 PolarHBondContact O-N 3.49Å; C391-Y393 VanDerWaalsContact SG-CB 3.56Å; C391-H404 PolarHBondContact SG-NE2 2.77Å; C391-H408 PolarHBondContact SG-NE2 3.44Å
392	S	86.1	Confident	84.2	Confident	116 Å²	116	76.9 Å²	76.9	81%	0.811	40%	0.4	S	S	*	.	S	Bend	trans	-66	4.6	177.8	55.8	0	0	0	0	115.8	A394	S392-A394 PolarHBondContact O-N 3.22Å; S392-A394 VanDerWaalsContact O-N 3.11Å
393	Y	85.7	Confident	84.4	Confident	89 Å²	89	78.4 Å²	78.4	35%	0.349	39%	0.391	S	S	.	.			trans	-74.7	102.8	178	-174.9	-95.5	0	0	0	112.2	C388 C391 H404	C388-Y393 WeakPolarHBondContact CB-O 3.46Å; C388-Y393 PolarHBondContact N-O 2.19Å; C391-Y393 PolarHBondContact O-N 3.49Å; C391-Y393 VanDerWaalsContact SG-CB 3.56Å; Y393-H404 HydrophobicContact CD1-CB 4Å; Y393-H404 AromaticContact CD1-CD2 3.39Å; Y393-H404 WeakPolarHBondContact CD1-CD2 3.27Å; Y393-H404 AromaticContact CD1-CG 3.48Å; Y393-H404 VanDerWaalsContact CD1-CG 3.48Å; Y393-H404 AromaticContact CD1-ND1 3.96Å; Y393-H404 AromaticContact CD1-NE2 3.81Å; Y393-H404 HydrophobicContact CE1-CB 3.89Å; Y393-H404 AromaticContact CE1-CG 3.88Å; Y393-H404 AromaticContact CG-NE2 3.95Å
394	A	86.9	Confident	84.6	Confident	16 Å²	16	75.3 Å²	75.3	13%	0.132	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	157	166.5	0	0	0	0	0	112.9	R384 Q387 S392	R384-A394 HydrophobicContact CB-CB 3.54Å; R384-A394 HydrophobicContact CG-CB 4.48Å; R384-A394 PolarHBondContact NE-O 3.44Å; R384-A394 PolarHBondContact NH2-O 3.48Å; Q387-A394 HydrophobicContact CB-CB 4.34Å; S392-A394 PolarHBondContact O-N 3.22Å; S392-A394 VanDerWaalsContact O-N 3.11Å
395	S	83.3	Confident	84.6	Confident	4 Å²	4	71.7 Å²	71.7	3%	0.028	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	163.2	179.7	78.1	0	0	0	0	114	R384 F386 D397 L401	R384-S395 CarbonylContact C-O 3.22Å; R384-S395 WeakPolarHBondContact CA-O 3.46Å; F386-S395 PolarHBondContact N-O 2.67Å; F386-S395 PolarHBondContact O-N 2.7Å; F386-S395 PolarHBondContact O-OG 2.34Å; S395-D397 PolarHBondContact OG-O 3.05Å; S395-L401 WeakPolarHBondContact OG-CB 3.45Å; S395-L401 PolarHBondContact OG-N 3.27Å
396	R	82.6	Confident	84.8	Confident	83 Å²	83	70 Å²	70	31%	0.313	35%	0.35	S	S	.	.	S	Bend	trans	-93.5	-6.2	-171.7	-63.5	174.5	40.6	-163.5	-2.5	114.4	R375 H376 R378 S379 E383 R384	R375-R396 PolarHBondContact O-NH2 2.05Å; H376-R396 PolarHBondContact O-NH2 2.93Å; R378-R396 VanDerWaalsContact C-NE 3.31Å; R378-R396 HydrophobicContact CB-CG 4.41Å; R378-R396 PolarHBondContact NH1-O 3.35Å; R378-R396 VanDerWaalsContact NH1-O 3.16Å; R378-R396 WeakPolarHBondContact O-CD 3.26Å; R378-R396 PolarHBondContact O-NE 2.73Å; S379-R396 VanDerWaalsContact CA-NH1 3.29Å; S379-R396 VanDerWaalsContact CB-NH1 3.31Å; E383-R396 WeakPolarHBondContact O-CG 3.01Å; R384-R396 HydrophobicContact CG-CG 3.9Å
397	D	81.7	Confident	84.8	Confident	22 Å²	22	71.4 Å²	71.4	12%	0.118	36%	0.364	C	S	.	.	S	Bend	trans	-154.5	126.7	-165.5	178.8	-20.8	0	0	0	109	R375 S395 Y399 K400 L401	R375-D397 WeakPolarHBondContact CD-OD2 3.2Å; R375-D397 IonicContact CZ-OD2 2.94Å; R375-D397 IonicContact NE-OD2 3.19Å; R375-D397 IonicContact NH1-OD2 2.66Å; R375-D397 PolarHBondContact NH1-OD2 3.49Å; S395-D397 PolarHBondContact OG-O 3.05Å; D397-Y399 PolarHBondContact O-N 2.9Å; D397-Y399 WeakPolarHBondContact OD1-CB 3.42Å; D397-Y399 PolarHBondContact OD1-N 3.37Å; D397-K400 HydrophobicContact CB-CB 4.37Å; D397-K400 HydrophobicContact CB-CG 3.91Å; D397-K400 WeakPolarHBondContact O-CA 3.28Å; D397-K400 WeakPolarHBondContact O-CB 3.39Å; D397-K400 PolarHBondContact O-N 3.12Å; D397-L401 PolarHBondContact O-N 3.28Å; D397-L401 VanDerWaalsContact O-N 3.16Å
398	T	82.4	Confident	84.6	Confident	83 Å²	83	68.4 Å²	68.4	51%	0.509	35%	0.35	S	S	.	.	H	α-helix	trans	-56.5	-31.4	-179.1	52.5	0	0	0	0	113.1	F386 K400 L401 K402	F386-T398 HydrophobicContact CD1-CG2 3.59Å; F386-T398 HydrophobicContact CD2-CG2 4.2Å; F386-T398 HydrophobicContact CE1-CG2 3.4Å; F386-T398 HydrophobicContact CE2-CG2 4.02Å; F386-T398 HydrophobicContact CG-CG2 3.99Å; F386-T398 HydrophobicContact CZ-CG2 3.62Å; T398-K400 VanDerWaalsContact C-N 3.32Å; T398-K400 PolarHBondContact O-N 3.35Å; T398-L401 PolarHBondContact O-N 3.45Å; T398-K402 WeakPolarHBondContact O-CB 3.4Å; T398-K402 PolarHBondContact O-N 3.17Å
399	Y	83.1	Confident	84.2	Confident	125 Å²	125	71.2 Å²	71.2	49%	0.49	37%	0.369	S	S	.	.	H	α-helix	trans	-67.1	-34.3	175.1	-179.9	-105.6	0	0	0	111.9	D397 R403	D397-Y399 PolarHBondContact O-N 2.9Å; D397-Y399 WeakPolarHBondContact OD1-CB 3.42Å; D397-Y399 PolarHBondContact OD1-N 3.37Å; Y399-R403 WeakPolarHBondContact O-CB 3.47Å; Y399-R403 PolarHBondContact O-N 3.29Å
400	K	83.4	Confident	84.1	Confident	83 Å²	83	68.5 Å²	68.5	36%	0.361	36%	0.358	S	S	.	.	H	α-helix	trans	-72.4	-39.2	176.5	-58.7	-63.8	-178.8	178.5	0	110.8	D397 T398 H404	D397-K400 HydrophobicContact CB-CB 4.37Å; D397-K400 HydrophobicContact CB-CG 3.91Å; D397-K400 WeakPolarHBondContact O-CA 3.28Å; D397-K400 WeakPolarHBondContact O-CB 3.39Å; D397-K400 PolarHBondContact O-N 3.12Å; T398-K400 VanDerWaalsContact C-N 3.32Å; T398-K400 PolarHBondContact O-N 3.35Å; K400-H404 WeakPolarHBondContact O-CB 3.25Å; K400-H404 PolarHBondContact O-N 3.09Å
401	L	86.3	Confident	83.9	Confident	30 Å²	30	68.8 Å²	68.8	16%	0.157	36%	0.356	C	S	.	.	H	α-helix	trans	-61.9	-55	170.8	-178.1	58.8	0	0	0	111.6	F386 Q387 C388 S395 D397 T398 R403 H404 M405	F386-L401 HydrophobicContact CB-CB 4.16Å; F386-L401 HydrophobicContact CB-CD2 3.88Å; Q387-L401 WeakPolarHBondContact O-CD2 3.33Å; C388-L401 HydrophobicContact CB-CD1 3.94Å; S395-L401 WeakPolarHBondContact OG-CB 3.45Å; S395-L401 PolarHBondContact OG-N 3.27Å; D397-L401 PolarHBondContact O-N 3.28Å; D397-L401 VanDerWaalsContact O-N 3.16Å; T398-L401 PolarHBondContact O-N 3.45Å; L401-R403 PolarHBondContact O-N 2.84Å; L401-H404 CarbonylContact O-C 3.53Å; L401-H404 WeakPolarHBondContact O-CA 3.4Å; L401-H404 WeakPolarHBondContact O-CB 3.29Å; L401-H404 PolarHBondContact O-N 3.24Å; L401-M405 HydrophobicContact CD1-CG 4.39Å; L401-M405 HydrophobicContact CD1-SD 3.94Å; L401-M405 HydrophobicContact CG-CG 4.39Å; L401-M405 HydrophobicContact CG-SD 4.47Å; L401-M405 WeakPolarHBondContact O-CG 2.99Å; L401-M405 PolarHBondContact O-N 3.32Å
402	K	84.5	Confident	83.6	Confident	154 Å²	154	71.4 Å²	71.4	67%	0.67	36%	0.362	S	S	*	.	H	α-helix	trans	-60.1	-31.2	-178.3	-173.9	163.8	-175	166.4	0	112.9	T398	T398-K402 WeakPolarHBondContact O-CB 3.4Å; T398-K402 PolarHBondContact O-N 3.17Å
403	R	84.4	Confident	83.4	Confident	78 Å²	78	69.7 Å²	69.7	29%	0.294	35%	0.348	S	S	.	.	H	α-helix	trans	-73	-32.9	171.9	-170.3	-176.1	71	149.2	1.8	112.9	Y399 L401 Q425	Y399-R403 WeakPolarHBondContact O-CB 3.47Å; Y399-R403 PolarHBondContact O-N 3.29Å; L401-R403 PolarHBondContact O-N 2.84Å; R403-Q425 HydrophobicContact CG-CG 4.21Å
404	H	86	Confident	83.3	Confident	30 Å²	30	68.8 Å²	68.8	14%	0.139	35%	0.345	C	S	.	.	H	α-helix	trans	-72	-37	172.7	167.9	64.8	0	0	0	112.2	C388 C391 Y393 K400 L401 R406 T407 H408	C388-H404 PolarHBondContact SG-NE2 2.94Å; C391-H404 PolarHBondContact SG-NE2 2.77Å; Y393-H404 HydrophobicContact CD1-CB 4Å; Y393-H404 AromaticContact CD1-CD2 3.39Å; Y393-H404 WeakPolarHBondContact CD1-CD2 3.27Å; Y393-H404 AromaticContact CD1-CG 3.48Å; Y393-H404 VanDerWaalsContact CD1-CG 3.48Å; Y393-H404 AromaticContact CD1-ND1 3.96Å; Y393-H404 AromaticContact CD1-NE2 3.81Å; Y393-H404 HydrophobicContact CE1-CB 3.89Å; Y393-H404 AromaticContact CE1-CG 3.88Å; Y393-H404 AromaticContact CG-NE2 3.95Å; K400-H404 WeakPolarHBondContact O-CB 3.25Å; K400-H404 PolarHBondContact O-N 3.09Å; L401-H404 CarbonylContact O-C 3.53Å; L401-H404 WeakPolarHBondContact O-CA 3.4Å; L401-H404 WeakPolarHBondContact O-CB 3.29Å; L401-H404 PolarHBondContact O-N 3.24Å; H404-R406 PolarHBondContact O-N 3.3Å; H404-T407 PolarHBondContact ND1-OG1 2.8Å; H404-T407 PolarHBondContact O-N 3.12Å; H404-T407 PolarHBondContact O-OG1 3.42Å; H404-H408 AromaticContact CD2-NE2 3.96Å; H404-H408 AromaticContact CE1-NE2 3.31Å; H404-H408 PolarHBondContact CE1-NE2 2.95Å; H404-H408 VanDerWaalsContact CE1-NE2 3.31Å; H404-H408 AromaticContact NE2-CD2 3.73Å; H404-H408 AromaticContact NE2-NE2 2.99Å; H404-H408 PolarHBondContact NE2-NE2 2.82Å
405	M	83.8	Confident	83.4	Confident	53 Å²	53	71.8 Å²	71.8	26%	0.261	36%	0.356	S	S	.	.	H	α-helix	trans	-54.8	-28.9	177	-62.8	-50.9	-65.8	0	0	113.2	C388 L390 L401 T407 H408 S409	C388-M405 HydrophobicContact CB-SD 4.37Å; L390-M405 HydrophobicContact CD1-CE 3.85Å; L390-M405 HydrophobicContact CG-CE 4.19Å; L401-M405 HydrophobicContact CD1-CG 4.39Å; L401-M405 HydrophobicContact CD1-SD 3.94Å; L401-M405 HydrophobicContact CG-CG 4.39Å; L401-M405 HydrophobicContact CG-SD 4.47Å; L401-M405 WeakPolarHBondContact O-CG 2.99Å; L401-M405 PolarHBondContact O-N 3.32Å; M405-T407 PolarHBondContact O-N 3.26Å; M405-H408 PolarHBondContact O-N 3Å; M405-S409 PolarHBondContact O-N 3.42Å; M405-S409 PolarHBondContact O-OG 3.05Å
406	R	85.1	Confident	83.7	Confident	37 Å²	37	71.6 Å²	71.6	14%	0.14	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-15.7	173.5	-59	-178.1	-167.4	152.1	2.1	115	H404 H408 S409 G410 T424	H404-R406 PolarHBondContact O-N 3.3Å; R406-H408 VanDerWaalsContact C-N 3.3Å; R406-S409 WeakPolarHBondContact CA-OG 3.32Å; R406-G410 PolarHBondContact O-N 3.23Å; R406-T424 PolarHBondContact NH1-O 2.93Å
407	T	82.8	Confident	83.9	Confident	92 Å²	92	73.2 Å²	73.2	56%	0.564	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-19.4	170.9	65.3	0	0	0	0	112.2	H404 M405	H404-T407 PolarHBondContact ND1-OG1 2.8Å; H404-T407 PolarHBondContact O-N 3.12Å; H404-T407 PolarHBondContact O-OG1 3.42Å; M405-T407 PolarHBondContact O-N 3.26Å
408	H	82.3	Confident	84.2	Confident	74 Å²	74	76 Å²	76	34%	0.343	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-41.7	176.8	-57.8	-64.5	0	0	0	112.1	C388 L390 C391 H404 M405 R406 G410	C388-H408 PolarHBondContact SG-NE2 2.71Å; C388-H408 VanDerWaalsContact SG-NE2 3.38Å; L390-H408 HydrophobicContact CD1-CB 3.54Å; C391-H408 PolarHBondContact SG-NE2 3.44Å; H404-H408 AromaticContact CD2-NE2 3.96Å; H404-H408 AromaticContact CE1-NE2 3.31Å; H404-H408 PolarHBondContact CE1-NE2 2.95Å; H404-H408 VanDerWaalsContact CE1-NE2 3.31Å; H404-H408 AromaticContact NE2-CD2 3.73Å; H404-H408 AromaticContact NE2-NE2 2.99Å; H404-H408 PolarHBondContact NE2-NE2 2.82Å; M405-H408 PolarHBondContact O-N 3Å; R406-H408 VanDerWaalsContact C-N 3.3Å; H408-G410 PolarHBondContact O-N 2.9Å
409	S	81.4	Confident	84.6	Confident	63 Å²	63	74.8 Å²	74.8	44%	0.441	37%	0.37	S	S	.	.	S	Bend	trans	-73.2	-11.5	174.7	63.1	0	0	0	0	113.6	M405 R406 E411	M405-S409 PolarHBondContact O-N 3.42Å; M405-S409 PolarHBondContact O-OG 3.05Å; R406-S409 WeakPolarHBondContact CA-OG 3.32Å; S409-E411 WeakPolarHBondContact CB-OE2 3.28Å; S409-E411 PolarHBondContact O-N 3.3Å; S409-E411 VanDerWaalsContact OG-CD 3.3Å; S409-E411 WeakPolarHBondContact OG-CG 3.44Å; S409-E411 PolarHBondContact OG-OE2 3.13Å
410	G	80.2	Confident	84.7	Confident	48 Å²	48	74.7 Å²	74.7	50%	0.495	37%	0.374	S	S	.	.			trans	67.3	-5.5	-175.3	0	0	0	0	0	114.8	R406 H408 K412	R406-G410 PolarHBondContact O-N 3.23Å; H408-G410 PolarHBondContact O-N 2.9Å; G410-K412 PolarHBondContact O-N 3.25Å
411	E	80.6	Confident	84.9	Confident	116 Å²	116	72.2 Å²	72.2	54%	0.542	37%	0.369	S	S	.	.			trans	-57.7	122.7	-174.1	-68.9	168.6	130.1	0	0	111.7	S409 P413	S409-E411 WeakPolarHBondContact CB-OE2 3.28Å; S409-E411 PolarHBondContact O-N 3.3Å; S409-E411 VanDerWaalsContact OG-CD 3.3Å; S409-E411 WeakPolarHBondContact OG-CG 3.44Å; S409-E411 PolarHBondContact OG-OE2 3.13Å; E411-P413 WeakPolarHBondContact O-CD 3.22Å
412	K	83.2	Confident	84.9	Confident	104 Å²	104	77.4 Å²	77.4	45%	0.452	39%	0.386	S	S	.	.			trans	-118.4	86.5	174.3	-69.6	157.7	171.3	-176.1	0	108.7	G410 Y414 R422 F423 T424	G410-K412 PolarHBondContact O-N 3.25Å; K412-Y414 VanDerWaalsContact C-N 3.28Å; K412-Y414 PolarHBondContact O-N 2.75Å; K412-R422 HydrophobicContact CB-CB 3.64Å; K412-R422 HydrophobicContact CD-CB 4.01Å; K412-R422 WeakPolarHBondContact CD-O 3.38Å; K412-R422 HydrophobicContact CG-CB 4.39Å; K412-R422 PolarHBondContact O-NE 2.78Å; K412-R422 PolarHBondContact O-NH2 3.38Å; K412-F423 CarbonylContact C-O 3.51Å; K412-F423 VanDerWaalsContact CA-O 3.27Å; K412-F423 WeakPolarHBondContact CA-O 3.47Å; K412-T424 HydrophobicContact CG-CG2 3.88Å
413	P	81.4	Confident	85	Confident	80 Å²	80	72.1 Å²	72.1	52%	0.519	36%	0.363	S	S	.	.			trans	-80.5	-6.2	-174.6	-12.8	30.7	0	0	0	113.9	E411	E411-P413 WeakPolarHBondContact O-CD 3.22Å
414	Y	84.8	Confident	85	Confident	70 Å²	70	70.2 Å²	70.2	28%	0.275	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	116.7	-177.4	-58	-79	0	0	0	108.8	K412 R422 F423 Q425	K412-Y414 VanDerWaalsContact C-N 3.28Å; K412-Y414 PolarHBondContact O-N 2.75Å; Y414-R422 CarbonylContact O-C 3.53Å; Y414-R422 WeakPolarHBondContact O-CA 3.22Å; Y414-F423 PolarHBondContact N-O 3.45Å; Y414-F423 PolarHBondContact O-N 3.28Å; Y414-Q425 VanDerWaalsContact CD2-C 3.44Å
415	E	87.4	Confident	84.9	Confident	79 Å²	79	71.6 Å²	71.6	37%	0.369	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	135.4	-176.6	-171.9	165.5	128.5	0	0	110.6	Y417 H420 R422	E415-Y417 PolarHBondContact O-N 3.27Å; E415-H420 HydrophobicContact CG-CB 4.39Å; E415-H420 IonicContact OE1-CE1 2.61Å; E415-H420 IonicContact OE1-CG 3.94Å; E415-H420 IonicContact OE1-ND1 4Å; E415-H420 PolarHBondContact OE1-ND1 2.83Å; E415-R422 HydrophobicContact CB-CG 4.27Å; E415-R422 HydrophobicContact CG-CG 3.92Å; E415-R422 VanDerWaalsContact OE2-CD 3.24Å; E415-R422 WeakPolarHBondContact OE2-CD 3.47Å; E415-R422 WeakPolarHBondContact OE2-CG 3.39Å; E415-R422 IonicContact OE2-CZ 3.53Å; E415-R422 IonicContact OE2-NE 3.56Å; E415-R422 IonicContact OE2-NH1 2.76Å
416	C	90.8	Very high	85	Confident	0 Å²	0	71.6 Å²	71.6	0%	0	37%	0.372	C	S	.	.			trans	-72.4	115.9	173.1	-179	0	0	0	0	109.9	I418 C419 H420 A421 F423 H432 I433 H437	C416-I418 PolarHBondContact O-N 3.05Å; C416-C419 PolarHBondContact O-N 3.41Å; C416-H420 VanDerWaalsContact O-CA 3.22Å; C416-H420 WeakPolarHBondContact O-CA 3.48Å; C416-H420 PolarHBondContact O-N 3.21Å; C416-A421 HydrophobicContact CB-CB 4.27Å; C416-A421 PolarHBondContact N-O 3.04Å; C416-F423 HydrophobicContact CB-CE2 4.24Å; C416-H432 VanDerWaalsContact SG-CD2 3.59Å; C416-H432 PolarHBondContact SG-NE2 3.18Å; C416-I433 HydrophobicContact CB-CG1 4.49Å; C416-I433 VanDerWaalsContact SG-CG1 3.53Å; C416-H437 VanDerWaalsContact SG-CD2 3.52Å
417	Y	85.8	Confident	85	Confident	117 Å²	117	72.2 Å²	72.2	46%	0.459	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-4	-178.8	65.2	-90.8	0	0	0	115	E415 I433 I751 M755	E415-Y417 PolarHBondContact O-N 3.27Å; Y417-I433 HydrophobicContact CD1-CD1 4.17Å; Y417-I433 HydrophobicContact CE1-CD1 3.82Å; Y417-I751 WeakPolarHBondContact OH-CG2 3.28Å; Y417-M755 HydrophobicContact CE1-CE 3.96Å
418	I	89.3	Confident	85.1	Confident	80 Å²	80	70.6 Å²	70.6	41%	0.41	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.7	-24.6	-177.1	-48.4	175.1	0	0	0	112.4	C416 I433 H437	C416-I418 PolarHBondContact O-N 3.05Å; I418-I433 HydrophobicContact CD1-CG2 4.4Å; I418-H437 HydrophobicContact CB-CB 4.47Å; I418-H437 HydrophobicContact CD1-CB 3.47Å; I418-H437 VanDerWaalsContact CD1-CB 3.47Å; I418-H437 HydrophobicContact CG2-CB 4.32Å; I418-H437 VanDerWaalsContact CG2-ND1 3.34Å; I418-H437 WeakPolarHBondContact CG2-ND1 3.27Å
419	C	89	Confident	85.5	Confident	58 Å²	58	68.3 Å²	68.3	39%	0.392	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-141.1	10.6	177.9	69.5	0	0	0	0	114.9	C416 A421 H432 H437	C416-C419 PolarHBondContact O-N 3.41Å; C419-A421 PolarHBondContact O-N 2.87Å; C419-A421 VanDerWaalsContact SG-CB 3.57Å; C419-H432 PolarHBondContact SG-NE2 3.22Å; C419-H437 PolarHBondContact SG-NE2 2.84Å
420	H	86.8	Confident	85.7	Confident	123 Å²	123	68.4 Å²	68.4	57%	0.569	36%	0.363	S	S	*	.			trans	56.1	16.1	179.5	-56.9	-77	0	0	0	115.2	E415 C416 R422	E415-H420 HydrophobicContact CG-CB 4.39Å; E415-H420 IonicContact OE1-CE1 2.61Å; E415-H420 IonicContact OE1-CG 3.94Å; E415-H420 IonicContact OE1-ND1 4Å; E415-H420 PolarHBondContact OE1-ND1 2.83Å; C416-H420 VanDerWaalsContact O-CA 3.22Å; C416-H420 WeakPolarHBondContact O-CA 3.48Å; C416-H420 PolarHBondContact O-N 3.21Å; H420-R422 WeakPolarHBondContact O-CG 3.24Å; H420-R422 PolarHBondContact O-N 3.36Å
421	A	86.9	Confident	85.9	Confident	31 Å²	31	69.5 Å²	69.5	26%	0.256	36%	0.355	S	S	.	.			trans	-65.1	125.8	174.2	0	0	0	0	0	110.6	C416 C419 F423	C416-A421 HydrophobicContact CB-CB 4.27Å; C416-A421 PolarHBondContact N-O 3.04Å; C419-A421 PolarHBondContact O-N 2.87Å; C419-A421 VanDerWaalsContact SG-CB 3.57Å; A421-F423 HydrophobicContact CB-CE2 3.72Å; A421-F423 HydrophobicContact CB-CZ 3.88Å; A421-F423 WeakPolarHBondContact O-CD2 3.1Å; A421-F423 WeakPolarHBondContact O-CE2 3.32Å
422	R	87.2	Confident	86.2	Confident	139 Å²	139	65.7 Å²	65.7	53%	0.525	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	131.6	-173.2	-58.5	-173.4	64.4	154.2	1.1	113	K412 Y414 E415 H420	K412-R422 HydrophobicContact CB-CB 3.64Å; K412-R422 HydrophobicContact CD-CB 4.01Å; K412-R422 WeakPolarHBondContact CD-O 3.38Å; K412-R422 HydrophobicContact CG-CB 4.39Å; K412-R422 PolarHBondContact O-NE 2.78Å; K412-R422 PolarHBondContact O-NH2 3.38Å; Y414-R422 CarbonylContact O-C 3.53Å; Y414-R422 WeakPolarHBondContact O-CA 3.22Å; E415-R422 HydrophobicContact CB-CG 4.27Å; E415-R422 HydrophobicContact CG-CG 3.92Å; E415-R422 VanDerWaalsContact OE2-CD 3.24Å; E415-R422 WeakPolarHBondContact OE2-CD 3.47Å; E415-R422 WeakPolarHBondContact OE2-CG 3.39Å; E415-R422 IonicContact OE2-CZ 3.53Å; E415-R422 IonicContact OE2-NE 3.56Å; E415-R422 IonicContact OE2-NH1 2.76Å; H420-R422 WeakPolarHBondContact O-CG 3.24Å; H420-R422 PolarHBondContact O-N 3.36Å
423	F	85.3	Confident	86.3	Confident	43 Å²	43	60.9 Å²	60.9	19%	0.189	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	151.2	-173	-59.2	-85.3	0	0	0	112.7	K412 Y414 C416 A421 Q425 M429 H432	K412-F423 CarbonylContact C-O 3.51Å; K412-F423 VanDerWaalsContact CA-O 3.27Å; K412-F423 WeakPolarHBondContact CA-O 3.47Å; Y414-F423 PolarHBondContact N-O 3.45Å; Y414-F423 PolarHBondContact O-N 3.28Å; C416-F423 HydrophobicContact CB-CE2 4.24Å; A421-F423 HydrophobicContact CB-CE2 3.72Å; A421-F423 HydrophobicContact CB-CZ 3.88Å; A421-F423 WeakPolarHBondContact O-CD2 3.1Å; A421-F423 WeakPolarHBondContact O-CE2 3.32Å; F423-Q425 VanDerWaalsContact C-N 3.33Å; F423-M429 HydrophobicContact CB-CB 4.27Å; F423-M429 HydrophobicContact CD2-CB 3.79Å; F423-M429 HydrophobicContact CD2-CG 3.95Å; F423-M429 HydrophobicContact CE2-CG 4.44Å; F423-M429 HydrophobicContact CG-CB 4.16Å; F423-H432 HydrophobicContact CE1-CB 3.98Å; F423-H432 HydrophobicContact CE2-CB 4.07Å; F423-H432 AromaticContact CE2-CD2 3.48Å; F423-H432 VanDerWaalsContact CE2-CD2 3.48Å; F423-H432 WeakPolarHBondContact CE2-CD2 3.44Å; F423-H432 AromaticContact CE2-CG 3.8Å; F423-H432 HydrophobicContact CZ-CB 3.5Å; F423-H432 AromaticContact CZ-CD2 3.47Å; F423-H432 VanDerWaalsContact CZ-CD2 3.47Å; F423-H432 WeakPolarHBondContact CZ-CD2 3.31Å; F423-H432 AromaticContact CZ-CG 3.3Å; F423-H432 AromaticContact CZ-ND1 3.83Å
424	T	84.3	Confident	86.5	Confident	38 Å²	38	61.2 Å²	61.2	23%	0.233	31%	0.314	C	S	.	.	S	Bend	trans	-82.5	-8.9	177.4	58.6	0	0	0	0	113.6	R406 K412	R406-T424 PolarHBondContact NH1-O 2.93Å; K412-T424 HydrophobicContact CG-CG2 3.88Å
425	Q	85.6	Confident	86.4	Confident	58 Å²	58	60.6 Å²	60.6	27%	0.271	31%	0.313	S	S	.	.	S	Bend	trans	-145.2	138.5	-176.3	-60.2	171.8	82.4	0	0	111.7	R403 Y414 F423 G427 T428 M429	R403-Q425 HydrophobicContact CG-CG 4.21Å; Y414-Q425 VanDerWaalsContact CD2-C 3.44Å; F423-Q425 VanDerWaalsContact C-N 3.33Å; Q425-G427 VanDerWaalsContact C-N 3.34Å; Q425-G427 PolarHBondContact O-N 3.04Å; Q425-T428 PolarHBondContact O-N 3.38Å; Q425-T428 PolarHBondContact O-OG1 3.43Å; Q425-M429 PolarHBondContact O-N 3.07Å
426	S	84.3	Confident	86.1	Confident	53 Å²	53	64.3 Å²	64.3	37%	0.371	33%	0.329	S	S	.	.	H	α-helix	trans	-58.1	-42.7	174.6	50.9	0	0	0	0	112.7	T428 M429 K430	S426-T428 VanDerWaalsContact C-N 3.28Å; S426-T428 PolarHBondContact O-N 3.38Å; S426-M429 CarbonylContact O-C 3.55Å; S426-M429 WeakPolarHBondContact O-CA 3.36Å; S426-M429 WeakPolarHBondContact O-CB 3.38Å; S426-M429 PolarHBondContact O-N 2.88Å; S426-K430 PolarHBondContact O-N 2.85Å
427	G	85.5	Confident	85.7	Confident	50 Å²	50	67.3 Å²	67.3	52%	0.515	34%	0.342	S	S	.	.	H	α-helix	trans	-62.3	-31	179.4	0	0	0	0	0	114.1	Q425 M431	Q425-G427 VanDerWaalsContact C-N 3.34Å; Q425-G427 PolarHBondContact O-N 3.04Å; G427-M431 WeakPolarHBondContact O-CB 2.97Å; G427-M431 PolarHBondContact O-N 3.33Å; G427-M431 VanDerWaalsContact O-N 3.13Å
428	T	85.9	Confident	85.7	Confident	59 Å²	59	63.1 Å²	63.1	36%	0.362	33%	0.329	S	S	.	.	H	α-helix	trans	-76.9	-29.6	172.7	45.3	0	0	0	0	112.5	Q425 S426 H432	Q425-T428 PolarHBondContact O-N 3.38Å; Q425-T428 PolarHBondContact O-OG1 3.43Å; S426-T428 VanDerWaalsContact C-N 3.28Å; S426-T428 PolarHBondContact O-N 3.38Å; T428-H432 VanDerWaalsContact O-CB 3.28Å; T428-H432 WeakPolarHBondContact O-CB 3.36Å; T428-H432 PolarHBondContact O-N 2.83Å
429	M	89.4	Confident	84.6	Confident	26 Å²	26	67 Å²	67	13%	0.128	35%	0.346	C	S	.	.	H	α-helix	trans	-71.3	-52.1	173.6	-175.5	-160.5	85.4	0	0	111.5	F423 Q425 S426 M431 H432 I433	F423-M429 HydrophobicContact CB-CB 4.27Å; F423-M429 HydrophobicContact CD2-CB 3.79Å; F423-M429 HydrophobicContact CD2-CG 3.95Å; F423-M429 HydrophobicContact CE2-CG 4.44Å; F423-M429 HydrophobicContact CG-CB 4.16Å; Q425-M429 PolarHBondContact O-N 3.07Å; S426-M429 CarbonylContact O-C 3.55Å; S426-M429 WeakPolarHBondContact O-CA 3.36Å; S426-M429 WeakPolarHBondContact O-CB 3.38Å; S426-M429 PolarHBondContact O-N 2.88Å; M429-M431 VanDerWaalsContact C-N 3.25Å; M429-M431 PolarHBondContact O-N 3.33Å; M429-H432 PolarHBondContact O-N 3.01Å; M429-I433 HydrophobicContact CE-CD1 4.29Å; M429-I433 HydrophobicContact CG-CD1 4.1Å; M429-I433 WeakPolarHBondContact O-CG1 3.34Å; M429-I433 PolarHBondContact O-N 3.04Å
430	K	86.3	Confident	83.7	Confident	65 Å²	65	71.9 Å²	71.9	28%	0.283	37%	0.368	S	S	.	.	H	α-helix	trans	-55.2	-42.1	174.2	-64.6	-152.1	178.8	-164.6	0	110.5	S426 L434 M755 D756	S426-K430 PolarHBondContact O-N 2.85Å; K430-L434 VanDerWaalsContact O-CB 3.29Å; K430-L434 WeakPolarHBondContact O-CB 3.36Å; K430-L434 PolarHBondContact O-N 3.35Å; K430-M755 HydrophobicContact CB-SD 4.38Å; K430-M755 HydrophobicContact CD-SD 3.49Å; K430-M755 WeakPolarHBondContact CD-SD 2.99Å; K430-M755 VanDerWaalsContact CE-SD 3.55Å; K430-M755 HydrophobicContact CG-CE 4.35Å; K430-M755 HydrophobicContact CG-SD 3.59Å; K430-M755 VanDerWaalsContact CG-SD 3.59Å; K430-M755 VanDerWaalsContact NZ-CB 3.31Å; K430-M755 PolarHBondContact NZ-O 3.17Å; K430-D756 IonicContact NZ-OD1 2.72Å; K430-D756 PolarHBondContact NZ-OD1 3.47Å
431	M	84.6	Confident	83.1	Confident	70 Å²	70	67.5 Å²	67.5	35%	0.345	35%	0.349	S	S	.	.	H	α-helix	trans	-66.5	-38.6	174.3	-178.5	60.6	56.2	0	0	113.6	G427 M429 L434 Q435 R455	G427-M431 WeakPolarHBondContact O-CB 2.97Å; G427-M431 PolarHBondContact O-N 3.33Å; G427-M431 VanDerWaalsContact O-N 3.13Å; M429-M431 VanDerWaalsContact C-N 3.25Å; M429-M431 PolarHBondContact O-N 3.33Å; M431-L434 CarbonylContact O-C 3.58Å; M431-L434 PolarHBondContact O-N 2.76Å; M431-Q435 HydrophobicContact CG-CG 4.29Å; M431-Q435 WeakPolarHBondContact O-CB 3.47Å; M431-Q435 WeakPolarHBondContact O-CG 3.46Å; M431-Q435 PolarHBondContact O-N 3.03Å; M431-Q435 HydrophobicContact SD-CG 3.78Å; M431-R455 VanDerWaalsContact SD-CD 3.54Å; M431-R455 HydrophobicContact SD-CG 3.93Å
432	H	86.4	Confident	82.5	Confident	36 Å²	36	69.4 Å²	69.4	17%	0.167	37%	0.365	C	S	.	.	H	α-helix	trans	-65.1	-43.4	176.8	154.5	76.7	0	0	0	111.5	C416 C419 F423 T428 M429 L434 Q435 K436 H437	C416-H432 VanDerWaalsContact SG-CD2 3.59Å; C416-H432 PolarHBondContact SG-NE2 3.18Å; C419-H432 PolarHBondContact SG-NE2 3.22Å; F423-H432 HydrophobicContact CE1-CB 3.98Å; F423-H432 HydrophobicContact CE2-CB 4.07Å; F423-H432 AromaticContact CE2-CD2 3.48Å; F423-H432 VanDerWaalsContact CE2-CD2 3.48Å; F423-H432 WeakPolarHBondContact CE2-CD2 3.44Å; F423-H432 AromaticContact CE2-CG 3.8Å; F423-H432 HydrophobicContact CZ-CB 3.5Å; F423-H432 AromaticContact CZ-CD2 3.47Å; F423-H432 VanDerWaalsContact CZ-CD2 3.47Å; F423-H432 WeakPolarHBondContact CZ-CD2 3.31Å; F423-H432 AromaticContact CZ-CG 3.3Å; F423-H432 AromaticContact CZ-ND1 3.83Å; T428-H432 VanDerWaalsContact O-CB 3.28Å; T428-H432 WeakPolarHBondContact O-CB 3.36Å; T428-H432 PolarHBondContact O-N 2.83Å; M429-H432 PolarHBondContact O-N 3.01Å; H432-L434 VanDerWaalsContact C-N 3.35Å; H432-L434 PolarHBondContact O-N 3.27Å; H432-Q435 CarbonylContact O-C 3.4Å; H432-Q435 PolarHBondContact O-N 3.29Å; H432-Q435 VanDerWaalsContact O-N 3.11Å; H432-K436 WeakPolarHBondContact O-CB 3.5Å; H432-K436 PolarHBondContact O-N 3.41Å; H432-H437 AromaticContact CE1-NE2 3.86Å; H432-H437 AromaticContact NE2-CD2 3.86Å; H432-H437 AromaticContact NE2-NE2 3.51Å
433	I	86.1	Confident	82.2	Confident	4 Å²	4	69.1 Å²	69.1	2%	0.021	37%	0.368	C	S	.	.	H	α-helix	trans	-58.1	-50	174.6	-66.8	160.9	0	0	0	109.5	C416 Y417 I418 M429 Q435 K436 H437 T438 M755	C416-I433 HydrophobicContact CB-CG1 4.49Å; C416-I433 VanDerWaalsContact SG-CG1 3.53Å; Y417-I433 HydrophobicContact CD1-CD1 4.17Å; Y417-I433 HydrophobicContact CE1-CD1 3.82Å; I418-I433 HydrophobicContact CD1-CG2 4.4Å; M429-I433 HydrophobicContact CE-CD1 4.29Å; M429-I433 HydrophobicContact CG-CD1 4.1Å; M429-I433 WeakPolarHBondContact O-CG1 3.34Å; M429-I433 PolarHBondContact O-N 3.04Å; I433-Q435 PolarHBondContact O-N 3.25Å; I433-K436 PolarHBondContact O-N 3.05Å; I433-H437 HydrophobicContact CG2-CB 4.46Å; I433-H437 PolarHBondContact O-N 2.88Å; I433-T438 PolarHBondContact O-N 2.65Å; I433-T438 PolarHBondContact O-OG1 2.98Å; I433-M755 HydrophobicContact CB-CE 4.44Å; I433-M755 HydrophobicContact CD1-CE 3.4Å; I433-M755 HydrophobicContact CG1-CE 4.49Å; I433-M755 HydrophobicContact CG2-CE 4.23Å
434	L	85.6	Confident	82.2	Confident	87 Å²	87	70.5 Å²	70.5	46%	0.455	37%	0.374	S	S	.	.	H	α-helix	trans	-68.2	12.5	175.8	-163.6	60.8	0	0	0	115.2	K430 M431 H432 T438 V441	K430-L434 VanDerWaalsContact O-CB 3.29Å; K430-L434 WeakPolarHBondContact O-CB 3.36Å; K430-L434 PolarHBondContact O-N 3.35Å; M431-L434 CarbonylContact O-C 3.58Å; M431-L434 PolarHBondContact O-N 2.76Å; H432-L434 VanDerWaalsContact C-N 3.35Å; H432-L434 PolarHBondContact O-N 3.27Å; L434-T438 VanDerWaalsContact C-OG1 3.32Å; L434-T438 VanDerWaalsContact CA-OG1 3.25Å; L434-T438 WeakPolarHBondContact CA-OG1 3.5Å; L434-T438 HydrophobicContact CD1-CG2 4.34Å; L434-V441 HydrophobicContact CD1-CG2 4.49Å; L434-V441 VanDerWaalsContact O-CG2 3.26Å; L434-V441 WeakPolarHBondContact O-CG2 3.38Å
435	Q	82.6	Confident	82.3	Confident	56 Å²	56	74.8 Å²	74.8	26%	0.262	39%	0.391	S	S	.	.	H	α-helix	trans	-142.7	-9.1	-180	-64.6	-76.7	-74	0	0	113.6	M431 H432 I433 A454	M431-Q435 HydrophobicContact CG-CG 4.29Å; M431-Q435 WeakPolarHBondContact O-CB 3.47Å; M431-Q435 WeakPolarHBondContact O-CG 3.46Å; M431-Q435 PolarHBondContact O-N 3.03Å; M431-Q435 HydrophobicContact SD-CG 3.78Å; H432-Q435 CarbonylContact O-C 3.4Å; H432-Q435 PolarHBondContact O-N 3.29Å; H432-Q435 VanDerWaalsContact O-N 3.11Å; I433-Q435 PolarHBondContact O-N 3.25Å; Q435-A454 PolarHBondContact NE2-O 3.03Å; Q435-A454 PolarHBondContact OE1-O 3.01Å
436	K	81.4	Confident	82.4	Confident	158 Å²	158	72.4 Å²	72.4	69%	0.687	38%	0.381	S	S	*	.	H	α-helix	trans	-135.5	-18.1	-176.6	-70.9	-62.4	-177.1	-176.2	0	115.1	H432 I433	H432-K436 WeakPolarHBondContact O-CB 3.5Å; H432-K436 PolarHBondContact O-N 3.41Å; I433-K436 PolarHBondContact O-N 3.05Å
437	H	82.3	Confident	82.4	Confident	62 Å²	62	74.6 Å²	74.6	29%	0.287	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.4	-21.4	-179	-62.1	-58.9	0	0	0	113.4	C416 I418 C419 H432 I433	C416-H437 VanDerWaalsContact SG-CD2 3.52Å; I418-H437 HydrophobicContact CB-CB 4.47Å; I418-H437 HydrophobicContact CD1-CB 3.47Å; I418-H437 VanDerWaalsContact CD1-CB 3.47Å; I418-H437 HydrophobicContact CG2-CB 4.32Å; I418-H437 VanDerWaalsContact CG2-ND1 3.34Å; I418-H437 WeakPolarHBondContact CG2-ND1 3.27Å; C419-H437 PolarHBondContact SG-NE2 2.84Å; H432-H437 AromaticContact CE1-NE2 3.86Å; H432-H437 AromaticContact NE2-CD2 3.86Å; H432-H437 AromaticContact NE2-NE2 3.51Å; I433-H437 HydrophobicContact CG2-CB 4.46Å; I433-H437 PolarHBondContact O-N 2.88Å
438	T	84.3	Confident	82.2	Confident	30 Å²	30	78.1 Å²	78.1	18%	0.184	40%	0.396	C	S	.	.			trans	-92	121.9	161.5	56.8	0	0	0	0	109.1	I433 L434 V441	I433-T438 PolarHBondContact O-N 2.65Å; I433-T438 PolarHBondContact O-OG1 2.98Å; L434-T438 VanDerWaalsContact C-OG1 3.32Å; L434-T438 VanDerWaalsContact CA-OG1 3.25Å; L434-T438 WeakPolarHBondContact CA-OG1 3.5Å; L434-T438 HydrophobicContact CD1-CG2 4.34Å; T438-V441 WeakPolarHBondContact O-CG2 3.48Å; T438-V441 WeakPolarHBondContact OG1-CG2 3.25Å
439	E	67.6	Low	82.1	Confident	162 Å²	162	76 Å²	76	76%	0.757	38%	0.384	S	S	*	.	S	Bend	trans	-87.3	-35	178.2	62.9	-152.9	117.5	0	0	113.6	V441	E439-V441 PolarHBondContact O-N 3.5Å
440	N	68.8	Low	81.8	Confident	160 Å²	160	81.6 Å²	81.6	86%	0.856	42%	0.415	S	S	*	.	S	Bend	trans	-79.4	44.1	180	-70	-49.2	0	0	0	113.7
441	V	74.3	Confident	81.8	Confident	30 Å²	30	80.6 Å²	80.6	18%	0.182	41%	0.414	C	S	.	.			trans	-83.3	128.6	-179.5	179.4	0	0	0	0	110.7	L434 T438 E439 K443	L434-V441 HydrophobicContact CD1-CG2 4.49Å; L434-V441 VanDerWaalsContact O-CG2 3.26Å; L434-V441 WeakPolarHBondContact O-CG2 3.38Å; T438-V441 WeakPolarHBondContact O-CG2 3.48Å; T438-V441 WeakPolarHBondContact OG1-CG2 3.25Å; E439-V441 PolarHBondContact O-N 3.5Å; V441-K443 PolarHBondContact O-N 3.34Å
442	A	75.1	Confident	81.9	Confident	72 Å²	72	81 Å²	81	60%	0.595	42%	0.42	S	S	*	.			trans	-58.4	102.8	173.7	0	0	0	0	0	111.5	F444	A442-F444 WeakPolarHBondContact O-CE2 3.47Å
443	K	81.9	Confident	82	Confident	133 Å²	133	80.4 Å²	80.4	58%	0.578	42%	0.418	S	S	*	.			trans	-77.4	122.5	176	-66.3	166.2	-170.9	163.8	0	109.2	V441 H445 V452	V441-K443 PolarHBondContact O-N 3.34Å; K443-H445 PolarHBondContact O-N 3.35Å; K443-H445 PolarHBondContact O-ND1 2.86Å; K443-V452 HydrophobicContact CB-CG1 3.62Å; K443-V452 HydrophobicContact CD-CG1 4.1Å; K443-V452 HydrophobicContact CG-CG1 4.25Å
444	F	85.3	Confident	81.9	Confident	71 Å²	71	82.5 Å²	82.5	31%	0.311	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	113.7	-177.3	-59.6	-86.4	0	0	0	110	A442 I453 K456 L459	A442-F444 WeakPolarHBondContact O-CE2 3.47Å; F444-I453 WeakPolarHBondContact CA-O 3.25Å; F444-I453 WeakPolarHBondContact CB-O 3.49Å; F444-I453 PolarHBondContact N-O 2.85Å; F444-I453 PolarHBondContact O-N 3.21Å; F444-K456 HydrophobicContact CD1-CB 4.24Å; F444-K456 HydrophobicContact CD1-CG 4.48Å; F444-K456 HydrophobicContact CD2-CB 4.36Å; F444-K456 HydrophobicContact CE1-CB 3.95Å; F444-K456 HydrophobicContact CE1-CD 4.22Å; F444-K456 HydrophobicContact CE1-CG 4.3Å; F444-K456 HydrophobicContact CE2-CB 4.09Å; F444-K456 HydrophobicContact CG-CB 4.44Å; F444-K456 HydrophobicContact CZ-CB 3.88Å; F444-L459 HydrophobicContact CB-CB 4.36Å; F444-L459 HydrophobicContact CB-CD2 3.84Å
445	H	85.3	Confident	81.8	Confident	128 Å²	128	82.9 Å²	82.9	59%	0.593	43%	0.431	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.2	144.5	177.1	-66.6	70.8	0	0	0	110.3	K443	K443-H445 PolarHBondContact O-N 3.35Å; K443-H445 PolarHBondContact O-ND1 2.86Å
446	C	88	Confident	81.9	Confident	9 Å²	9	87.7 Å²	87.7	6%	0.061	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	122.4	174.3	166.8	0	0	0	0	110.5	H448 C449 T451 L459 H462 H467	C446-H448 PolarHBondContact O-N 3.32Å; C446-H448 VanDerWaalsContact O-N 3.09Å; C446-C449 HydrophobicContact CB-CB 4.24Å; C446-C449 VanDerWaalsContact CB-O 3.22Å; C446-C449 WeakPolarHBondContact CB-O 3.32Å; C446-C449 WeakPolarHBondContact CB-SG 3.18Å; C446-C449 PolarHBondContact O-N 3.18Å; C446-C449 WeakPolarHBondContact SG-CB 3.27Å; C446-C449 PolarHBondContact SG-N 3.25Å; C446-C449 CovalentContact SG-SG 2.05Å; C446-C449 PolarHBondContact SG-SG 3.49Å; C446-T451 WeakPolarHBondContact CB-O 3.47Å; C446-T451 WeakPolarHBondContact CB-OG1 3.35Å; C446-T451 PolarHBondContact N-O 3.09Å; C446-T451 VanDerWaalsContact N-O 3.13Å; C446-L459 HydrophobicContact CB-CD1 4.1Å; C446-H462 PolarHBondContact SG-NE2 3.31Å; C446-H467 PolarHBondContact SG-NE2 3.04Å; C446-H467 VanDerWaalsContact SG-NE2 3.44Å
447	P	84.9	Confident	82	Confident	99 Å²	99	83.3 Å²	83.3	64%	0.643	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-12.9	-179.4	-24.8	35.8	0	0	0	115.3
448	H	80.8	Confident	82.2	Confident	123 Å²	123	83.1 Å²	83.1	57%	0.569	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.8	6.4	-174.8	-52.6	-66.1	0	0	0	112.7	C446 H467	C446-H448 PolarHBondContact O-N 3.32Å; C446-H448 VanDerWaalsContact O-N 3.09Å; H448-H467 WeakPolarHBondContact CB-ND1 3.48Å; H448-H467 PolarHBondContact O-CE1 2.96Å
449	C	83.2	Confident	82.4	Confident	15 Å²	15	82.7 Å²	82.7	10%	0.101	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.1	159.4	-173.2	69.9	0	0	0	0	114.1	C446 T451 H462 H467 Y487	C446-C449 HydrophobicContact CB-CB 4.24Å; C446-C449 VanDerWaalsContact CB-O 3.22Å; C446-C449 WeakPolarHBondContact CB-O 3.32Å; C446-C449 WeakPolarHBondContact CB-SG 3.18Å; C446-C449 PolarHBondContact O-N 3.18Å; C446-C449 WeakPolarHBondContact SG-CB 3.27Å; C446-C449 PolarHBondContact SG-N 3.25Å; C446-C449 CovalentContact SG-SG 2.05Å; C446-C449 PolarHBondContact SG-SG 3.49Å; C449-T451 PolarHBondContact O-N 2.92Å; C449-T451 PolarHBondContact SG-OG1 3.45Å; C449-H462 PolarHBondContact SG-NE2 3.44Å; C449-H467 PolarHBondContact SG-NE2 2.89Å; C449-Y487 HydrophobicContact CB-CD1 4.25Å; C449-Y487 HydrophobicContact CB-CD2 4.28Å; C449-Y487 HydrophobicContact CB-CE1 3.63Å; C449-Y487 HydrophobicContact CB-CE2 3.69Å; C449-Y487 WeakPolarHBondContact CB-OH 3.37Å
450	D	83.3	Confident	83.3	Confident	144 Å²	144	76.5 Å²	76.5	77%	0.77	42%	0.417	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.5	18.2	-177.6	-34.2	-74.6	0	0	0	113.8	V452 Y487	D450-V452 PolarHBondContact O-N 2.77Å; D450-Y487 PolarHBondContact OD2-OH 3.42Å
451	T	85.9	Confident	84.1	Confident	43 Å²	43	72.2 Å²	72.2	26%	0.264	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	116	-179.9	71.2	0	0	0	0	111.3	C446 C449 H462	C446-T451 WeakPolarHBondContact CB-O 3.47Å; C446-T451 WeakPolarHBondContact CB-OG1 3.35Å; C446-T451 PolarHBondContact N-O 3.09Å; C446-T451 VanDerWaalsContact N-O 3.13Å; C449-T451 PolarHBondContact O-N 2.92Å; C449-T451 PolarHBondContact SG-OG1 3.45Å; T451-H462 VanDerWaalsContact CG2-CE1 3.42Å; T451-H462 WeakPolarHBondContact CG2-CE1 3.29Å
452	V	87.9	Confident	84.7	Confident	79 Å²	79	72.3 Å²	72.3	48%	0.479	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	118.7	173.7	-174.4	0	0	0	0	108.5	K443 D450	K443-V452 HydrophobicContact CB-CG1 3.62Å; K443-V452 HydrophobicContact CD-CG1 4.1Å; K443-V452 HydrophobicContact CG-CG1 4.25Å; D450-V452 PolarHBondContact O-N 2.77Å
453	I	86.9	Confident	85.3	Confident	24 Å²	24	71.3 Å²	71.3	12%	0.123	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	126.9	-169.8	-59.5	175.9	0	0	0	110.4	F444 R455 D458 L459 H462	F444-I453 WeakPolarHBondContact CA-O 3.25Å; F444-I453 WeakPolarHBondContact CB-O 3.49Å; F444-I453 PolarHBondContact N-O 2.85Å; F444-I453 PolarHBondContact O-N 3.21Å; I453-R455 VanDerWaalsContact C-N 3.3Å; I453-R455 PolarHBondContact O-N 3.35Å; I453-D458 HydrophobicContact CG2-CB 3.58Å; I453-L459 HydrophobicContact CB-CB 4.45Å; I453-L459 HydrophobicContact CD1-CB 4.32Å; I453-L459 HydrophobicContact CD1-CD1 4.04Å; I453-L459 HydrophobicContact CG2-CB 4.41Å; I453-H462 HydrophobicContact CD1-CB 3.5Å
454	A	84.1	Confident	85.5	Confident	47 Å²	47	74.7 Å²	74.7	39%	0.388	39%	0.389	S	S	.	.	S	Bend	trans	-76	-10	-169.8	0	0	0	0	0	115.2	Q435	Q435-A454 PolarHBondContact NE2-O 3.03Å; Q435-A454 PolarHBondContact OE1-O 3.01Å
455	R	84.3	Confident	85.4	Confident	96 Å²	96	77.2 Å²	77.2	36%	0.362	40%	0.4	S	S	.	.			trans	-137.5	135.8	-179.6	-57.1	-171.9	-60.6	166	-1	112.8	M431 I453 S457 D458 L459	M431-R455 VanDerWaalsContact SD-CD 3.54Å; M431-R455 HydrophobicContact SD-CG 3.93Å; I453-R455 VanDerWaalsContact C-N 3.3Å; I453-R455 PolarHBondContact O-N 3.35Å; R455-S457 VanDerWaalsContact C-N 3.26Å; R455-S457 PolarHBondContact O-N 2.86Å; R455-D458 HydrophobicContact CB-CB 4.33Å; R455-D458 IonicContact CZ-OD1 3.07Å; R455-D458 IonicContact CZ-OD2 2.88Å; R455-D458 IonicContact NE-OD1 2.75Å; R455-D458 PolarHBondContact NE-OD1 2.87Å; R455-D458 IonicContact NE-OD2 3.41Å; R455-D458 PolarHBondContact NE-OD2 3.02Å; R455-D458 IonicContact NH2-OD1 3.32Å; R455-D458 PolarHBondContact NH2-OD1 3.41Å; R455-D458 IonicContact NH2-OD2 2.99Å; R455-D458 PolarHBondContact NH2-OD2 3.02Å; R455-D458 WeakPolarHBondContact O-CB 3.5Å; R455-D458 PolarHBondContact O-N 3.01Å; R455-L459 PolarHBondContact O-N 2.96Å; R455-L459 VanDerWaalsContact O-N 3.09Å
456	K	84.1	Confident	85.2	Confident	157 Å²	157	73.5 Å²	73.5	68%	0.683	38%	0.383	S	S	*	.	H	α-helix	trans	-58.5	-32.3	177.1	-168.5	169.8	-176.8	171.4	0	113.8	F444 D458 G460	F444-K456 HydrophobicContact CD1-CB 4.24Å; F444-K456 HydrophobicContact CD1-CG 4.48Å; F444-K456 HydrophobicContact CD2-CB 4.36Å; F444-K456 HydrophobicContact CE1-CB 3.95Å; F444-K456 HydrophobicContact CE1-CD 4.22Å; F444-K456 HydrophobicContact CE1-CG 4.3Å; F444-K456 HydrophobicContact CE2-CB 4.09Å; F444-K456 HydrophobicContact CG-CB 4.44Å; F444-K456 HydrophobicContact CZ-CB 3.88Å; K456-D458 VanDerWaalsContact C-N 3.27Å; K456-D458 PolarHBondContact O-N 3.27Å; K456-G460 PolarHBondContact O-N 2.9Å; K456-G460 VanDerWaalsContact O-N 3.07Å
457	S	84.3	Confident	84.9	Confident	66 Å²	66	74.3 Å²	74.3	46%	0.462	39%	0.385	S	S	.	.	H	α-helix	trans	-59.4	-40.1	172.1	52.3	0	0	0	0	112.3	R455 G460 V461	R455-S457 VanDerWaalsContact C-N 3.26Å; R455-S457 PolarHBondContact O-N 2.86Å; S457-G460 PolarHBondContact O-N 3.47Å; S457-V461 WeakPolarHBondContact O-CG2 3.36Å; S457-V461 PolarHBondContact O-N 3.35Å
458	D	86.4	Confident	84.9	Confident	57 Å²	57	71.4 Å²	71.4	31%	0.305	37%	0.368	S	S	.	.	H	α-helix	trans	-83.9	-32.4	-170.1	-59.5	4.5	0	0	0	109.7	I453 R455 K456 V461 H462	I453-D458 HydrophobicContact CG2-CB 3.58Å; R455-D458 HydrophobicContact CB-CB 4.33Å; R455-D458 IonicContact CZ-OD1 3.07Å; R455-D458 IonicContact CZ-OD2 2.88Å; R455-D458 IonicContact NE-OD1 2.75Å; R455-D458 PolarHBondContact NE-OD1 2.87Å; R455-D458 IonicContact NE-OD2 3.41Å; R455-D458 PolarHBondContact NE-OD2 3.02Å; R455-D458 IonicContact NH2-OD1 3.32Å; R455-D458 PolarHBondContact NH2-OD1 3.41Å; R455-D458 IonicContact NH2-OD2 2.99Å; R455-D458 PolarHBondContact NH2-OD2 3.02Å; R455-D458 WeakPolarHBondContact O-CB 3.5Å; R455-D458 PolarHBondContact O-N 3.01Å; K456-D458 VanDerWaalsContact C-N 3.27Å; K456-D458 PolarHBondContact O-N 3.27Å; D458-V461 PolarHBondContact O-N 2.95Å; D458-H462 VanDerWaalsContact O-CB 3.27Å; D458-H462 WeakPolarHBondContact O-CB 3.28Å; D458-H462 PolarHBondContact O-N 3.02Å
459	L	87.8	Confident	84.8	Confident	21 Å²	21	72.8 Å²	72.8	11%	0.11	37%	0.372	C	S	.	.	H	α-helix	trans	-61.4	-44.9	165.6	176.3	60.1	0	0	0	110.8	F444 C446 I453 R455 V461 H462 L463	F444-L459 HydrophobicContact CB-CB 4.36Å; F444-L459 HydrophobicContact CB-CD2 3.84Å; C446-L459 HydrophobicContact CB-CD1 4.1Å; I453-L459 HydrophobicContact CB-CB 4.45Å; I453-L459 HydrophobicContact CD1-CB 4.32Å; I453-L459 HydrophobicContact CD1-CD1 4.04Å; I453-L459 HydrophobicContact CG2-CB 4.41Å; R455-L459 PolarHBondContact O-N 2.96Å; R455-L459 VanDerWaalsContact O-N 3.09Å; L459-V461 VanDerWaalsContact C-N 3.28Å; L459-V461 PolarHBondContact O-N 3.38Å; L459-H462 PolarHBondContact O-N 3.47Å; L459-L463 HydrophobicContact CD1-CD1 3.99Å; L459-L463 HydrophobicContact CD1-CD2 4.34Å; L459-L463 HydrophobicContact CD1-CG 3.86Å; L459-L463 HydrophobicContact CG-CD1 3.95Å; L459-L463 HydrophobicContact CG-CG 4.29Å; L459-L463 WeakPolarHBondContact O-CB 3.29Å; L459-L463 VanDerWaalsContact O-CG 3.32Å; L459-L463 WeakPolarHBondContact O-CG 3.01Å; L459-L463 PolarHBondContact O-N 2.87Å
460	G	86.3	Confident	84.7	Confident	32 Å²	32	73 Å²	73	33%	0.33	37%	0.372	S	S	.	.	H	α-helix	trans	-61.5	-33.2	175.6	0	0	0	0	0	113.9	K456 S457 R464	K456-G460 PolarHBondContact O-N 2.9Å; K456-G460 VanDerWaalsContact O-N 3.07Å; S457-G460 PolarHBondContact O-N 3.47Å; G460-R464 WeakPolarHBondContact O-CB 3.42Å; G460-R464 PolarHBondContact O-N 2.99Å
461	V	86.8	Confident	84.3	Confident	71 Å²	71	74 Å²	74	43%	0.43	37%	0.372	S	S	.	.	H	α-helix	trans	-76.6	-37.2	173.1	170.1	0	0	0	0	111.9	S457 D458 L459 K465	S457-V461 WeakPolarHBondContact O-CG2 3.36Å; S457-V461 PolarHBondContact O-N 3.35Å; D458-V461 PolarHBondContact O-N 2.95Å; L459-V461 VanDerWaalsContact C-N 3.28Å; L459-V461 PolarHBondContact O-N 3.38Å; V461-K465 HydrophobicContact CG1-CD 3.83Å; V461-K465 HydrophobicContact CG1-CG 4.39Å; V461-K465 VanDerWaalsContact O-CB 3.28Å; V461-K465 WeakPolarHBondContact O-CB 3.39Å; V461-K465 VanDerWaalsContact O-CG 3.29Å; V461-K465 WeakPolarHBondContact O-CG 3.44Å; V461-K465 PolarHBondContact O-N 3.07Å
462	H	86.7	Confident	83.8	Confident	31 Å²	31	78.4 Å²	78.4	14%	0.144	40%	0.399	C	S	.	.	H	α-helix	trans	-62.6	-53.1	175.5	169.5	84.2	0	0	0	110.9	C446 C449 T451 I453 D458 L459 R464 K465 Q466 H467	C446-H462 PolarHBondContact SG-NE2 3.31Å; C449-H462 PolarHBondContact SG-NE2 3.44Å; T451-H462 VanDerWaalsContact CG2-CE1 3.42Å; T451-H462 WeakPolarHBondContact CG2-CE1 3.29Å; I453-H462 HydrophobicContact CD1-CB 3.5Å; D458-H462 VanDerWaalsContact O-CB 3.27Å; D458-H462 WeakPolarHBondContact O-CB 3.28Å; D458-H462 PolarHBondContact O-N 3.02Å; L459-H462 PolarHBondContact O-N 3.47Å; H462-R464 VanDerWaalsContact C-N 3.33Å; H462-R464 PolarHBondContact O-N 3.14Å; H462-K465 PolarHBondContact O-N 2.98Å; H462-Q466 WeakPolarHBondContact O-CB 3.42Å; H462-Q466 WeakPolarHBondContact O-CG 3.35Å; H462-Q466 PolarHBondContact O-N 2.79Å; H462-H467 AromaticContact CD2-CD2 3.71Å; H462-H467 AromaticContact CD2-NE2 3.95Å; H462-H467 AromaticContact CE1-NE2 3.9Å; H462-H467 AromaticContact NE2-CD2 2.67Å; H462-H467 PolarHBondContact NE2-CD2 2.75Å; H462-H467 AromaticContact NE2-CE1 3.48Å; H462-H467 PolarHBondContact NE2-CE1 3.12Å; H462-H467 AromaticContact NE2-CG 3.98Å; H462-H467 AromaticContact NE2-NE2 2.19Å; H462-H467 PolarHBondContact NE2-NE2 3.32Å
463	L	86.3	Confident	83.5	Confident	51 Å²	51	75 Å²	75	27%	0.267	38%	0.381	S	S	.	.	H	α-helix	trans	-53.8	-49.9	176.5	-69	170.4	0	0	0	110.6	L459 K465 H467 S468	L459-L463 HydrophobicContact CD1-CD1 3.99Å; L459-L463 HydrophobicContact CD1-CD2 4.34Å; L459-L463 HydrophobicContact CD1-CG 3.86Å; L459-L463 HydrophobicContact CG-CD1 3.95Å; L459-L463 HydrophobicContact CG-CG 4.29Å; L459-L463 WeakPolarHBondContact O-CB 3.29Å; L459-L463 VanDerWaalsContact O-CG 3.32Å; L459-L463 WeakPolarHBondContact O-CG 3.01Å; L459-L463 PolarHBondContact O-N 2.87Å; L463-K465 VanDerWaalsContact C-N 3.26Å; L463-K465 PolarHBondContact O-N 2.85Å; L463-H467 HydrophobicContact CD2-CB 4.2Å; L463-H467 CarbonylContact O-C 3.52Å; L463-H467 VanDerWaalsContact O-CA 3.29Å; L463-H467 WeakPolarHBondContact O-CA 3.48Å; L463-H467 PolarHBondContact O-N 2.72Å; L463-S468 PolarHBondContact O-N 3Å
464	R	85.9	Confident	83.3	Confident	204 Å²	204	77.8 Å²	77.8	77%	0.77	39%	0.392	S	S	*	.	H	α-helix	trans	-70.2	-13	179.2	-154	-169.1	-55.9	-174.4	-1.1	115.1	G460 H462	G460-R464 WeakPolarHBondContact O-CB 3.42Å; G460-R464 PolarHBondContact O-N 2.99Å; H462-R464 VanDerWaalsContact C-N 3.33Å; H462-R464 PolarHBondContact O-N 3.14Å
465	K	84.1	Confident	83.2	Confident	125 Å²	125	82.9 Å²	82.9	54%	0.543	41%	0.405	S	S	.	.	H	α-helix	trans	-103.6	-27.8	178.5	-78.9	-176.8	177.1	-178.9	0	113.9	V461 H462 L463 R486	V461-K465 HydrophobicContact CG1-CD 3.83Å; V461-K465 HydrophobicContact CG1-CG 4.39Å; V461-K465 VanDerWaalsContact O-CB 3.28Å; V461-K465 WeakPolarHBondContact O-CB 3.39Å; V461-K465 VanDerWaalsContact O-CG 3.29Å; V461-K465 WeakPolarHBondContact O-CG 3.44Å; V461-K465 PolarHBondContact O-N 3.07Å; H462-K465 PolarHBondContact O-N 2.98Å; L463-K465 VanDerWaalsContact C-N 3.26Å; L463-K465 PolarHBondContact O-N 2.85Å; K465-R486 WeakPolarHBondContact O-CD 3.38Å
466	Q	81.1	Confident	83.1	Confident	49 Å²	49	78.9 Å²	78.9	23%	0.229	39%	0.392	C	S	.	.	H	α-helix	trans	-115.7	-42.4	-171.1	-54.5	-64.1	13	0	0	111.9	H462 E485 R486 Y487	H462-Q466 WeakPolarHBondContact O-CB 3.42Å; H462-Q466 WeakPolarHBondContact O-CG 3.35Å; H462-Q466 PolarHBondContact O-N 2.79Å; Q466-E485 WeakPolarHBondContact O-CG 3.49Å; Q466-R486 WeakPolarHBondContact O-CB 3.4Å; Q466-R486 PolarHBondContact O-N 3.38Å; Q466-Y487 PolarHBondContact O-N 3.47Å
467	H	82.1	Confident	82.9	Confident	26 Å²	26	80.7 Å²	80.7	12%	0.12	39%	0.394	C	S	.	.	S	Bend	trans	-106.1	18.9	-178.3	-56.3	-77	0	0	0	112.8	C446 H448 C449 H462 L463 F469 E485 Y487	C446-H467 PolarHBondContact SG-NE2 3.04Å; C446-H467 VanDerWaalsContact SG-NE2 3.44Å; H448-H467 WeakPolarHBondContact CB-ND1 3.48Å; H448-H467 PolarHBondContact O-CE1 2.96Å; C449-H467 PolarHBondContact SG-NE2 2.89Å; H462-H467 AromaticContact CD2-CD2 3.71Å; H462-H467 AromaticContact CD2-NE2 3.95Å; H462-H467 AromaticContact CE1-NE2 3.9Å; H462-H467 AromaticContact NE2-CD2 2.67Å; H462-H467 PolarHBondContact NE2-CD2 2.75Å; H462-H467 AromaticContact NE2-CE1 3.48Å; H462-H467 PolarHBondContact NE2-CE1 3.12Å; H462-H467 AromaticContact NE2-CG 3.98Å; H462-H467 AromaticContact NE2-NE2 2.19Å; H462-H467 PolarHBondContact NE2-NE2 3.32Å; L463-H467 HydrophobicContact CD2-CB 4.2Å; L463-H467 CarbonylContact O-C 3.52Å; L463-H467 VanDerWaalsContact O-CA 3.29Å; L463-H467 WeakPolarHBondContact O-CA 3.48Å; L463-H467 PolarHBondContact O-N 2.72Å; H467-F469 PolarHBondContact O-N 3.04Å; H467-E485 IonicContact CE1-OE1 3.58Å; H467-E485 IonicContact CG-OE1 3.51Å; H467-E485 IonicContact ND1-OE1 3.77Å; H467-E485 PolarHBondContact ND1-OE1 3.35Å; H467-E485 IonicContact ND1-OE2 3.79Å; H467-Y487 VanDerWaalsContact CE1-CB 3.46Å; H467-Y487 WeakPolarHBondContact CE1-CB 3.5Å; H467-Y487 AromaticContact CE1-CD1 3.47Å; H467-Y487 VanDerWaalsContact CE1-CD1 3.47Å; H467-Y487 WeakPolarHBondContact CE1-CD1 3.43Å; H467-Y487 AromaticContact CE1-CG 3.39Å; H467-Y487 AromaticContact NE2-CG 3.9Å
468	S	84.8	Confident	82.2	Confident	39 Å²	39	83 Å²	83	27%	0.273	39%	0.393	S	S	.	.			trans	-70.9	120.2	166	55.9	0	0	0	0	108.6	L463 I470	L463-S468 PolarHBondContact O-N 3Å; S468-I470 PolarHBondContact O-N 3.36Å
469	F	78.9	Confident	81.9	Confident	151 Å²	151	82.1 Å²	82.1	66%	0.662	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-57	136.3	164.8	-175.5	-103.8	0	0	0	109.7	H467 E471 H484	H467-F469 PolarHBondContact O-N 3.04Å; F469-E471 HydrophobicContact CE1-CB 4.07Å; F469-E471 HydrophobicContact CE1-CG 4.4Å; F469-H484 CarbonylContact C-O 3.24Å; F469-H484 WeakPolarHBondContact CA-O 3.36Å; F469-H484 HydrophobicContact CD2-CB 3.92Å; F469-H484 HydrophobicContact CE2-CB 3.56Å; F469-H484 HydrophobicContact CZ-CB 4.3Å
470	I	80.9	Confident	81.5	Confident	20 Å²	20	87.9 Å²	87.9	10%	0.103	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	102.3	179.9	-61.7	140.4	0	0	0	105.9	S468 T472 G473 K474 H484 R486	S468-I470 PolarHBondContact O-N 3.36Å; I470-T472 PolarHBondContact O-N 3.38Å; I470-G473 WeakPolarHBondContact O-CA 3.22Å; I470-G473 PolarHBondContact O-N 2.94Å; I470-K474 HydrophobicContact CD1-CD 4.22Å; I470-K474 HydrophobicContact CD1-CG 4.45Å; I470-K474 HydrophobicContact CG2-CG 4.25Å; I470-H484 PolarHBondContact N-O 3.48Å; I470-H484 PolarHBondContact O-ND1 2.9Å; I470-R486 HydrophobicContact CD1-CB 4.25Å
471	E	74.5	Confident	81.3	Confident	165 Å²	165	88.2 Å²	88.2	77%	0.771	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-56.2	-48.5	-173.3	-167	161.5	-136.9	0	0	112.5	F469 G473 H484	F469-E471 HydrophobicContact CE1-CB 4.07Å; F469-E471 HydrophobicContact CE1-CG 4.4Å; E471-G473 PolarHBondContact O-N 2.61Å; E471-G473 VanDerWaalsContact O-N 3.09Å; E471-H484 PolarHBondContact O-CE1 3.39Å; E471-H484 VanDerWaalsContact O-CE1 3.25Å; E471-H484 PolarHBondContact O-ND1 3.36Å
472	T	75.6	Confident	81.3	Confident	135 Å²	135	88 Å²	88	83%	0.828	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.9	-3.9	174.8	51	0	0	0	0	115.1	I470	I470-T472 PolarHBondContact O-N 3.38Å
473	G	80.7	Confident	81.2	Confident	9 Å²	9	88.5 Å²	88.5	9%	0.093	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	65.3	176.3	-175.1	0	0	0	0	0	113.9	I470 E471 F483	I470-G473 WeakPolarHBondContact O-CA 3.22Å; I470-G473 PolarHBondContact O-N 2.94Å; E471-G473 PolarHBondContact O-N 2.61Å; E471-G473 VanDerWaalsContact O-N 3.09Å; G473-F483 CarbonylContact C-O 3.55Å
474	K	83.6	Confident	81	Confident	82 Å²	82	90 Å²	90	36%	0.357	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	113.4	168.4	-68.8	-166.1	169	80.7	0	109.6	I470 F483 L489	I470-K474 HydrophobicContact CD1-CD 4.22Å; I470-K474 HydrophobicContact CD1-CG 4.45Å; I470-K474 HydrophobicContact CG2-CG 4.25Å; K474-F483 PolarHBondContact N-O 2.85Å; K474-F483 PolarHBondContact O-N 3.17Å; K474-L489 HydrophobicContact CB-CD2 3.8Å; K474-L489 HydrophobicContact CD-CD2 4.39Å
475	K	81.8	Confident	81	Confident	154 Å²	154	82.8 Å²	82.8	67%	0.67	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.6	144.4	175.2	-49	-156.4	176.1	-171.6	0	110.4	V482	K475-V482 HydrophobicContact CD-CG2 4.38Å; K475-V482 HydrophobicContact CG-CG1 4.4Å; K475-V482 HydrophobicContact CG-CG2 4.02Å
476	C	83.3	Confident	81	Confident	11 Å²	11	82.4 Å²	82.4	7%	0.074	40%	0.398	C	S	.	.			trans	-69.1	150.5	170.4	-173.9	0	0	0	0	110.5	Y478 C479 A481 F483 L489 H492	C476-Y478 PolarHBondContact O-N 2.76Å; C476-C479 WeakPolarHBondContact CB-O 3.36Å; C476-C479 VanDerWaalsContact O-O 3.13Å; C476-A481 PolarHBondContact N-O 2.81Å; C476-F483 HydrophobicContact CB-CE2 4.38Å; C476-L489 HydrophobicContact CB-CD1 4.17Å; C476-H492 WeakPolarHBondContact CB-NE2 3.42Å; C476-H492 PolarHBondContact SG-CD2 2.86Å; C476-H492 PolarHBondContact SG-NE2 3.49Å
477	R	78.8	Confident	81.2	Confident	195 Å²	195	81.7 Å²	81.7	74%	0.736	39%	0.394	S	S	*	.	S	Bend	trans	-76.6	-9.5	175.7	-176.9	170.3	173.2	94	4	112.7
478	Y	69.6	Low	81.4	Confident	114 Å²	114	82 Å²	82	45%	0.447	40%	0.401	S	S	.	.	S	Bend	trans	-126.2	-0.9	-166.7	-54.1	-64.6	0	0	0	114.3	C476 H496	C476-Y478 PolarHBondContact O-N 2.76Å; Y478-H496 VanDerWaalsContact C-NE2 3.26Å; Y478-H496 VanDerWaalsContact CB-CE1 3.45Å; Y478-H496 WeakPolarHBondContact CB-CE1 3.47Å; Y478-H496 VanDerWaalsContact CB-ND1 3.33Å; Y478-H496 WeakPolarHBondContact CB-ND1 3.46Å; Y478-H496 HydrophobicContact CD2-CB 4.19Å; Y478-H496 PolarHBondContact O-NE2 2.98Å
479	C	79.9	Confident	81.4	Confident	39 Å²	39	80.9 Å²	80.9	26%	0.264	39%	0.392	S	S	.	.	S	Bend	trans	-170.7	166.2	168.6	62.9	0	0	0	0	108.6	C476 A481 H492 H496	C476-C479 WeakPolarHBondContact CB-O 3.36Å; C476-C479 VanDerWaalsContact O-O 3.13Å; C479-A481 PolarHBondContact O-N 3.07Å; C479-H492 PolarHBondContact SG-CE1 3.03Å; C479-H492 PolarHBondContact SG-NE2 3.28Å; C479-H496 VanDerWaalsContact CB-NE2 3.32Å; C479-H496 WeakPolarHBondContact CB-NE2 3.43Å; C479-H496 PolarHBondContact SG-NE2 3.02Å
480	D	79.6	Confident	81.7	Confident	142 Å²	142	76.6 Å²	76.6	76%	0.759	38%	0.375	S	S	*	.	S	Bend	trans	-77.4	-3.4	-170.1	-53.5	-79.1	0	0	0	115.1	V482	D480-V482 WeakPolarHBondContact O-CG2 3.5Å; D480-V482 PolarHBondContact O-N 3.04Å
481	A	82.9	Confident	81.7	Confident	40 Å²	40	78.6 Å²	78.6	33%	0.331	38%	0.384	S	S	.	.			trans	-52.7	129	175.3	0	0	0	0	0	112.6	C476 C479 F483	C476-A481 PolarHBondContact N-O 2.81Å; C479-A481 PolarHBondContact O-N 3.07Å; A481-F483 HydrophobicContact CB-CE2 3.65Å; A481-F483 HydrophobicContact CB-CZ 3.97Å
482	V	86	Confident	82	Confident	66 Å²	66	72.5 Å²	72.5	40%	0.4	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	135.9	-175.6	-166.4	0	0	0	0	110.3	K475 D480	K475-V482 HydrophobicContact CD-CG2 4.38Å; K475-V482 HydrophobicContact CG-CG1 4.4Å; K475-V482 HydrophobicContact CG-CG2 4.02Å; D480-V482 WeakPolarHBondContact O-CG2 3.5Å; D480-V482 PolarHBondContact O-N 3.04Å
483	F	85.6	Confident	82.2	Confident	42 Å²	42	68.8 Å²	68.8	18%	0.184	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	119.4	-177	-63.8	-87.6	0	0	0	111.2	G473 K474 C476 A481 E485 A488 L489 H492	G473-F483 CarbonylContact C-O 3.55Å; K474-F483 PolarHBondContact N-O 2.85Å; K474-F483 PolarHBondContact O-N 3.17Å; C476-F483 HydrophobicContact CB-CE2 4.38Å; A481-F483 HydrophobicContact CB-CE2 3.65Å; A481-F483 HydrophobicContact CB-CZ 3.97Å; F483-E485 PolarHBondContact O-N 3.16Å; F483-A488 HydrophobicContact CD1-CB 3.92Å; F483-L489 HydrophobicContact CB-CB 3.86Å; F483-L489 HydrophobicContact CB-CD1 4.41Å; F483-L489 HydrophobicContact CD2-CB 4.39Å; F483-L489 HydrophobicContact CD2-CD1 3.65Å; F483-L489 HydrophobicContact CE2-CD1 4.36Å; F483-L489 HydrophobicContact CG-CB 4.16Å; F483-L489 HydrophobicContact CG-CD1 4.27Å; F483-H492 HydrophobicContact CE1-CB 3.89Å; F483-H492 HydrophobicContact CE2-CB 4.02Å; F483-H492 AromaticContact CE2-CD2 3.31Å; F483-H492 WeakPolarHBondContact CE2-CD2 3.37Å; F483-H492 AromaticContact CE2-CG 3.53Å; F483-H492 AromaticContact CE2-NE2 3.71Å; F483-H492 HydrophobicContact CZ-CB 3.53Å; F483-H492 AromaticContact CZ-CD2 3.56Å; F483-H492 AromaticContact CZ-CE1 3.94Å; F483-H492 AromaticContact CZ-CG 3.23Å; F483-H492 AromaticContact CZ-ND1 3.5Å; F483-H492 AromaticContact CZ-NE2 3.99Å
484	H	82.2	Confident	82.2	Confident	83 Å²	83	72.8 Å²	72.8	38%	0.384	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	-2.7	174.8	-64.2	-84.6	0	0	0	113.4	F469 I470 E471	F469-H484 CarbonylContact C-O 3.24Å; F469-H484 WeakPolarHBondContact CA-O 3.36Å; F469-H484 HydrophobicContact CD2-CB 3.92Å; F469-H484 HydrophobicContact CE2-CB 3.56Å; F469-H484 HydrophobicContact CZ-CB 4.3Å; I470-H484 PolarHBondContact N-O 3.48Å; I470-H484 PolarHBondContact O-ND1 2.9Å; E471-H484 PolarHBondContact O-CE1 3.39Å; E471-H484 VanDerWaalsContact O-CE1 3.25Å; E471-H484 PolarHBondContact O-ND1 3.36Å
485	E	85.2	Confident	81.6	Confident	51 Å²	51	72.3 Å²	72.3	24%	0.238	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	138.4	177.1	-165.3	-156.9	-130.7	0	0	110.6	Q466 H467 F483 Y487 A488 L489	Q466-E485 WeakPolarHBondContact O-CG 3.49Å; H467-E485 IonicContact CE1-OE1 3.58Å; H467-E485 IonicContact CG-OE1 3.51Å; H467-E485 IonicContact ND1-OE1 3.77Å; H467-E485 PolarHBondContact ND1-OE1 3.35Å; H467-E485 IonicContact ND1-OE2 3.79Å; F483-E485 PolarHBondContact O-N 3.16Å; E485-Y487 WeakPolarHBondContact OE2-CB 3.31Å; E485-A488 HydrophobicContact CB-CB 4.06Å; E485-A488 PolarHBondContact OE2-N 2.96Å; E485-L489 PolarHBondContact O-N 3.45Å; E485-L489 VanDerWaalsContact O-N 3.12Å
486	R	84.3	Confident	81	Confident	117 Å²	117	66.1 Å²	66.1	44%	0.442	32%	0.321	S	S	.	.	H	α-helix	trans	-73.1	-33.1	-178.3	-165.2	-174.4	-153.6	153.3	6.1	112.4	K465 Q466 I470 I490	K465-R486 WeakPolarHBondContact O-CD 3.38Å; Q466-R486 WeakPolarHBondContact O-CB 3.4Å; Q466-R486 PolarHBondContact O-N 3.38Å; I470-R486 HydrophobicContact CD1-CB 4.25Å; R486-I490 HydrophobicContact CG-CD1 4.08Å; R486-I490 WeakPolarHBondContact O-CB 3.41Å; R486-I490 WeakPolarHBondContact O-CD1 3.43Å; R486-I490 VanDerWaalsContact O-CG1 3.25Å; R486-I490 WeakPolarHBondContact O-CG1 3.38Å; R486-I490 PolarHBondContact O-N 3.06Å
487	Y	85.4	Confident	80.1	Confident	34 Å²	34	71.8 Å²	71.8	13%	0.133	35%	0.345	C	S	.	.	H	α-helix	trans	-66	-50.3	175.4	178.5	-103.5	0	0	0	111.2	C449 D450 Q466 H467 E485 L489 I490 Q491	C449-Y487 HydrophobicContact CB-CD1 4.25Å; C449-Y487 HydrophobicContact CB-CD2 4.28Å; C449-Y487 HydrophobicContact CB-CE1 3.63Å; C449-Y487 HydrophobicContact CB-CE2 3.69Å; C449-Y487 WeakPolarHBondContact CB-OH 3.37Å; D450-Y487 PolarHBondContact OD2-OH 3.42Å; Q466-Y487 PolarHBondContact O-N 3.47Å; H467-Y487 VanDerWaalsContact CE1-CB 3.46Å; H467-Y487 WeakPolarHBondContact CE1-CB 3.5Å; H467-Y487 AromaticContact CE1-CD1 3.47Å; H467-Y487 VanDerWaalsContact CE1-CD1 3.47Å; H467-Y487 WeakPolarHBondContact CE1-CD1 3.43Å; H467-Y487 AromaticContact CE1-CG 3.39Å; H467-Y487 AromaticContact NE2-CG 3.9Å; E485-Y487 WeakPolarHBondContact OE2-CB 3.31Å; Y487-L489 VanDerWaalsContact C-N 3.34Å; Y487-L489 PolarHBondContact O-N 3.24Å; Y487-I490 PolarHBondContact O-N 2.99Å; Y487-Q491 HydrophobicContact CD1-CG 4.26Å; Y487-Q491 HydrophobicContact CD2-CG 4.5Å; Y487-Q491 HydrophobicContact CE1-CG 3.92Å; Y487-Q491 HydrophobicContact CE2-CG 4.15Å; Y487-Q491 WeakPolarHBondContact O-CG 3.27Å; Y487-Q491 PolarHBondContact O-N 3.35Å; Y487-Q491 PolarHBondContact OH-NE2 3.28Å
488	A	85.9	Confident	79	Confident	33 Å²	33	68.2 Å²	68.2	27%	0.273	34%	0.34	S	S	.	.	H	α-helix	trans	-50.9	-49.2	171	0	0	0	0	0	112.8	F483 E485 I490 Q491 H492	F483-A488 HydrophobicContact CD1-CB 3.92Å; E485-A488 HydrophobicContact CB-CB 4.06Å; E485-A488 PolarHBondContact OE2-N 2.96Å; A488-I490 VanDerWaalsContact C-N 3.33Å; A488-I490 PolarHBondContact O-N 3.32Å; A488-Q491 PolarHBondContact O-N 3.44Å; A488-H492 WeakPolarHBondContact O-CB 3.46Å; A488-H492 PolarHBondContact O-N 3.3Å
489	L	85.6	Confident	78.7	Confident	16 Å²	16	67.8 Å²	67.8	8%	0.084	34%	0.342	C	S	.	.	H	α-helix	trans	-56.6	-43.7	175	179	64	0	0	0	112.5	K474 C476 F483 E485 Y487 Q493	K474-L489 HydrophobicContact CB-CD2 3.8Å; K474-L489 HydrophobicContact CD-CD2 4.39Å; C476-L489 HydrophobicContact CB-CD1 4.17Å; F483-L489 HydrophobicContact CB-CB 3.86Å; F483-L489 HydrophobicContact CB-CD1 4.41Å; F483-L489 HydrophobicContact CD2-CB 4.39Å; F483-L489 HydrophobicContact CD2-CD1 3.65Å; F483-L489 HydrophobicContact CE2-CD1 4.36Å; F483-L489 HydrophobicContact CG-CB 4.16Å; F483-L489 HydrophobicContact CG-CD1 4.27Å; E485-L489 PolarHBondContact O-N 3.45Å; E485-L489 VanDerWaalsContact O-N 3.12Å; Y487-L489 VanDerWaalsContact C-N 3.34Å; Y487-L489 PolarHBondContact O-N 3.24Å; L489-Q493 HydrophobicContact CD1-CG 4.4Å; L489-Q493 WeakPolarHBondContact O-CB 3.42Å; L489-Q493 VanDerWaalsContact O-CG 3.28Å; L489-Q493 WeakPolarHBondContact O-CG 3.41Å; L489-Q493 PolarHBondContact O-N 3.31Å
490	I	83.4	Confident	77.7	Confident	60 Å²	60	72.8 Å²	72.8	31%	0.308	36%	0.359	S	S	.	.	H	α-helix	trans	-67.7	-38	179.9	-73.7	165.9	0	0	0	111.3	R486 Y487 A488 Q493 K494	R486-I490 HydrophobicContact CG-CD1 4.08Å; R486-I490 WeakPolarHBondContact O-CB 3.41Å; R486-I490 WeakPolarHBondContact O-CD1 3.43Å; R486-I490 VanDerWaalsContact O-CG1 3.25Å; R486-I490 WeakPolarHBondContact O-CG1 3.38Å; R486-I490 PolarHBondContact O-N 3.06Å; Y487-I490 PolarHBondContact O-N 2.99Å; A488-I490 VanDerWaalsContact C-N 3.33Å; A488-I490 PolarHBondContact O-N 3.32Å; I490-Q493 PolarHBondContact O-N 3.42Å; I490-K494 WeakPolarHBondContact O-CG 3.24Å; I490-K494 PolarHBondContact O-N 2.99Å
491	Q	81.1	Confident	76.8	Confident	62 Å²	62	70.3 Å²	70.3	29%	0.29	34%	0.339	S	S	.	.	H	α-helix	trans	-68.4	-45.4	176.1	-68.1	-68.3	14.4	0	0	111.4	Y487 A488 Q493 K494 T495	Y487-Q491 HydrophobicContact CD1-CG 4.26Å; Y487-Q491 HydrophobicContact CD2-CG 4.5Å; Y487-Q491 HydrophobicContact CE1-CG 3.92Å; Y487-Q491 HydrophobicContact CE2-CG 4.15Å; Y487-Q491 WeakPolarHBondContact O-CG 3.27Å; Y487-Q491 PolarHBondContact O-N 3.35Å; Y487-Q491 PolarHBondContact OH-NE2 3.28Å; A488-Q491 PolarHBondContact O-N 3.44Å; Q491-Q493 VanDerWaalsContact C-N 3.33Å; Q491-Q493 PolarHBondContact O-N 3.43Å; Q491-K494 VanDerWaalsContact CD-NZ 3.27Å; Q491-K494 WeakPolarHBondContact O-CA 3.49Å; Q491-K494 VanDerWaalsContact O-CB 3.3Å; Q491-K494 WeakPolarHBondContact O-CB 3.23Å; Q491-K494 PolarHBondContact O-N 3.16Å; Q491-K494 VanDerWaalsContact OE1-CD 3.32Å; Q491-K494 VanDerWaalsContact OE1-CE 3.26Å; Q491-T495 PolarHBondContact O-N 2.81Å
492	H	81.4	Confident	76	Confident	37 Å²	37	71 Å²	71	17%	0.171	34%	0.335	C	S	.	.	H	α-helix	trans	-59.1	-40.8	172	168.7	82.7	0	0	0	112.1	C476 C479 F483 A488 K494 T495 H496	C476-H492 WeakPolarHBondContact CB-NE2 3.42Å; C476-H492 PolarHBondContact SG-CD2 2.86Å; C476-H492 PolarHBondContact SG-NE2 3.49Å; C479-H492 PolarHBondContact SG-CE1 3.03Å; C479-H492 PolarHBondContact SG-NE2 3.28Å; F483-H492 HydrophobicContact CE1-CB 3.89Å; F483-H492 HydrophobicContact CE2-CB 4.02Å; F483-H492 AromaticContact CE2-CD2 3.31Å; F483-H492 WeakPolarHBondContact CE2-CD2 3.37Å; F483-H492 AromaticContact CE2-CG 3.53Å; F483-H492 AromaticContact CE2-NE2 3.71Å; F483-H492 HydrophobicContact CZ-CB 3.53Å; F483-H492 AromaticContact CZ-CD2 3.56Å; F483-H492 AromaticContact CZ-CE1 3.94Å; F483-H492 AromaticContact CZ-CG 3.23Å; F483-H492 AromaticContact CZ-ND1 3.5Å; F483-H492 AromaticContact CZ-NE2 3.99Å; A488-H492 WeakPolarHBondContact O-CB 3.46Å; A488-H492 PolarHBondContact O-N 3.3Å; H492-K494 PolarHBondContact O-N 3.48Å; H492-K494 VanDerWaalsContact O-N 3.1Å; H492-T495 PolarHBondContact O-N 3.01Å; H492-T495 PolarHBondContact O-OG1 3.11Å; H492-H496 AromaticContact CD2-CD2 3.91Å; H492-H496 AromaticContact CE1-CD2 3.78Å; H492-H496 AromaticContact NE2-CD2 3.42Å; H492-H496 PolarHBondContact NE2-CD2 3.11Å; H492-H496 PolarHBondContact O-N 2.71Å
493	Q	79.8	Confident	75.4	Confident	58 Å²	58	75.4 Å²	75.4	27%	0.271	35%	0.349	S	S	.	.	H	α-helix	trans	-64.7	-12.1	172.1	-74.8	179.7	13.6	0	0	114.3	L489 I490 Q491 K497	L489-Q493 HydrophobicContact CD1-CG 4.4Å; L489-Q493 WeakPolarHBondContact O-CB 3.42Å; L489-Q493 VanDerWaalsContact O-CG 3.28Å; L489-Q493 WeakPolarHBondContact O-CG 3.41Å; L489-Q493 PolarHBondContact O-N 3.31Å; I490-Q493 PolarHBondContact O-N 3.42Å; Q491-Q493 VanDerWaalsContact C-N 3.33Å; Q491-Q493 PolarHBondContact O-N 3.43Å; Q493-K497 WeakPolarHBondContact O-CG 3.46Å
494	K	79.8	Confident	75.1	Confident	92 Å²	92	73.9 Å²	73.9	40%	0.4	34%	0.343	S	S	.	.	H	α-helix	trans	-82.8	-30.1	168.3	-62	174.8	-157.3	167.4	0	112.6	I490 Q491 H492 H496 K497 N498	I490-K494 WeakPolarHBondContact O-CG 3.24Å; I490-K494 PolarHBondContact O-N 2.99Å; Q491-K494 VanDerWaalsContact CD-NZ 3.27Å; Q491-K494 WeakPolarHBondContact O-CA 3.49Å; Q491-K494 VanDerWaalsContact O-CB 3.3Å; Q491-K494 WeakPolarHBondContact O-CB 3.23Å; Q491-K494 PolarHBondContact O-N 3.16Å; Q491-K494 VanDerWaalsContact OE1-CD 3.32Å; Q491-K494 VanDerWaalsContact OE1-CE 3.26Å; H492-K494 PolarHBondContact O-N 3.48Å; H492-K494 VanDerWaalsContact O-N 3.1Å; K494-H496 VanDerWaalsContact C-N 3.33Å; K494-K497 WeakPolarHBondContact O-CB 3.38Å; K494-K497 PolarHBondContact O-N 2.8Å; K494-K497 VanDerWaalsContact O-N 3.12Å; K494-N498 PolarHBondContact O-N 3.06Å
495	T	72.8	Confident	74.8	Confident	72 Å²	72	75.9 Å²	75.9	44%	0.442	36%	0.357	S	S	.	.	H	α-helix	trans	-65.1	-42.4	173.2	73.3	0	0	0	0	109.8	Q491 H492 K497 N498 R501	Q491-T495 PolarHBondContact O-N 2.81Å; H492-T495 PolarHBondContact O-N 3.01Å; H492-T495 PolarHBondContact O-OG1 3.11Å; T495-K497 PolarHBondContact O-N 2.68Å; T495-K497 VanDerWaalsContact O-N 3.15Å; T495-N498 PolarHBondContact O-N 3.36Å; T495-R501 PolarHBondContact O-NH1 3.28Å
496	H	68.9	Low	74.3	Confident	25 Å²	25	79.4 Å²	79.4	12%	0.116	37%	0.373	C	S	.	.	H	α-helix	trans	-52.3	-36.5	170	-81.9	-73.2	0	0	0	113.8	Y478 C479 H492 K494 N498 R501	Y478-H496 VanDerWaalsContact C-NE2 3.26Å; Y478-H496 VanDerWaalsContact CB-CE1 3.45Å; Y478-H496 WeakPolarHBondContact CB-CE1 3.47Å; Y478-H496 VanDerWaalsContact CB-ND1 3.33Å; Y478-H496 WeakPolarHBondContact CB-ND1 3.46Å; Y478-H496 HydrophobicContact CD2-CB 4.19Å; Y478-H496 PolarHBondContact O-NE2 2.98Å; C479-H496 VanDerWaalsContact CB-NE2 3.32Å; C479-H496 WeakPolarHBondContact CB-NE2 3.43Å; C479-H496 PolarHBondContact SG-NE2 3.02Å; H492-H496 AromaticContact CD2-CD2 3.91Å; H492-H496 AromaticContact CE1-CD2 3.78Å; H492-H496 AromaticContact NE2-CD2 3.42Å; H492-H496 PolarHBondContact NE2-CD2 3.11Å; H492-H496 PolarHBondContact O-N 2.71Å; K494-H496 VanDerWaalsContact C-N 3.33Å; H496-N498 VanDerWaalsContact C-N 3.35Å; H496-N498 PolarHBondContact O-N 3.5Å; H496-R501 WeakPolarHBondContact CE1-CD 3.2Å; H496-R501 VanDerWaalsContact CE1-CG 3.48Å; H496-R501 WeakPolarHBondContact CE1-CG 3.27Å; H496-R501 PolarHBondContact CE1-NE 3.16Å
497	K	63.1	Low	74.2	Confident	130 Å²	130	76.1 Å²	76.1	57%	0.565	37%	0.367	S	S	*	.	H	α-helix	trans	-70	-25.6	176.5	-70.1	171.5	-172.9	175.1	0	113.2	Q493 K494 T495 R512	Q493-K497 WeakPolarHBondContact O-CG 3.46Å; K494-K497 WeakPolarHBondContact O-CB 3.38Å; K494-K497 PolarHBondContact O-N 2.8Å; K494-K497 VanDerWaalsContact O-N 3.12Å; T495-K497 PolarHBondContact O-N 2.68Å; T495-K497 VanDerWaalsContact O-N 3.15Å; K497-R512 WeakPolarHBondContact O-CG 3.39Å; K497-R512 PolarHBondContact O-NE 3.25Å; K497-R512 PolarHBondContact O-NH2 2.75Å
498	N	56.4	Low	73.8	Confident	119 Å²	119	82 Å²	82	64%	0.636	40%	0.401	S	S	*	.	H	α-helix	trans	-80.9	-29.2	-171.2	-82	-14	0	0	0	114.1	K494 T495 H496 R512	K494-N498 PolarHBondContact O-N 3.06Å; T495-N498 PolarHBondContact O-N 3.36Å; H496-N498 VanDerWaalsContact C-N 3.35Å; H496-N498 PolarHBondContact O-N 3.5Å; N498-R512 PolarHBondContact OD1-NH2 2.72Å
499	E	62.3	Low	73.2	Confident	106 Å²	106	85.5 Å²	85.5	50%	0.495	41%	0.408	S	S	.	.	S	Bend	trans	-87.4	155.7	173.2	-63.7	163	-116.3	0	0	112.1	R501	E499-R501 PolarHBondContact O-N 2.91Å; E499-R501 IonicContact OE1-CZ 3.11Å; E499-R501 IonicContact OE1-NH1 2.66Å; E499-R501 PolarHBondContact OE1-NH1 3.01Å; E499-R501 IonicContact OE1-NH2 2.88Å; E499-R501 PolarHBondContact OE1-NH2 2.77Å; E499-R501 IonicContact OE2-CZ 3.1Å; E499-R501 IonicContact OE2-NE 3.72Å; E499-R501 IonicContact OE2-NH1 3.31Å; E499-R501 PolarHBondContact OE2-NH1 2.83Å; E499-R501 IonicContact OE2-NH2 2.95Å; E499-R501 PolarHBondContact OE2-NH2 2.82Å
500	K	59.1	Low	72.7	Confident	144 Å²	144	87 Å²	87	63%	0.626	42%	0.42	S	S	*	.			trans	-81.5	63.6	178.9	-62.2	170.3	-173.1	166.9	0	110.4	F502 C510 C511	K500-F502 PolarHBondContact O-N 2.85Å; K500-F502 VanDerWaalsContact O-N 3.09Å; K500-C510 HydrophobicContact CB-CB 3.76Å; K500-C510 HydrophobicContact CD-CB 4.41Å; K500-C511 CarbonylContact C-O 3.59Å; K500-C511 VanDerWaalsContact C-O 3.22Å; K500-C511 WeakPolarHBondContact CA-O 3.21Å
501	R	60.8	Low	72.2	Confident	90 Å²	90	84.6 Å²	84.6	34%	0.34	41%	0.408	S	S	.	.			trans	-53.6	-31.1	-167.6	-119.3	75.4	-172.3	-168.1	21.1	115.1	T495 H496 E499 K503 C511	T495-R501 PolarHBondContact O-NH1 3.28Å; H496-R501 WeakPolarHBondContact CE1-CD 3.2Å; H496-R501 VanDerWaalsContact CE1-CG 3.48Å; H496-R501 WeakPolarHBondContact CE1-CG 3.27Å; H496-R501 PolarHBondContact CE1-NE 3.16Å; E499-R501 PolarHBondContact O-N 2.91Å; E499-R501 IonicContact OE1-CZ 3.11Å; E499-R501 IonicContact OE1-NH1 2.66Å; E499-R501 PolarHBondContact OE1-NH1 3.01Å; E499-R501 IonicContact OE1-NH2 2.88Å; E499-R501 PolarHBondContact OE1-NH2 2.77Å; E499-R501 IonicContact OE2-CZ 3.1Å; E499-R501 IonicContact OE2-NE 3.72Å; E499-R501 IonicContact OE2-NH1 3.31Å; E499-R501 PolarHBondContact OE2-NH1 2.83Å; E499-R501 IonicContact OE2-NH2 2.95Å; E499-R501 PolarHBondContact OE2-NH2 2.82Å; R501-K503 PolarHBondContact O-N 3.34Å; R501-C511 PolarHBondContact N-O 3.18Å
502	F	67	Low	71.6	Confident	55 Å²	55	88.5 Å²	88.5	24%	0.241	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	100.6	-179.3	-55.9	-85.9	0	0	0	109.7	K500 C510 C511 E514 M517	K500-F502 PolarHBondContact O-N 2.85Å; K500-F502 VanDerWaalsContact O-N 3.09Å; F502-C510 CarbonylContact O-C 3.58Å; F502-C510 VanDerWaalsContact O-CA 3.28Å; F502-C510 WeakPolarHBondContact O-CA 3.47Å; F502-C511 PolarHBondContact N-O 3.07Å; F502-C511 VanDerWaalsContact N-O 3.14Å; F502-C511 PolarHBondContact O-N 3.46Å; F502-E514 HydrophobicContact CD1-CB 4.13Å; F502-E514 HydrophobicContact CD1-CG 4.24Å; F502-E514 HydrophobicContact CE1-CB 3.51Å; F502-E514 HydrophobicContact CE1-CG 3.7Å; F502-E514 HydrophobicContact CE2-CB 4.31Å; F502-E514 VanDerWaalsContact CE2-N 3.3Å; F502-E514 HydrophobicContact CZ-CB 3.62Å; F502-E514 HydrophobicContact CZ-CG 4.29Å; F502-M517 HydrophobicContact CB-CB 3.85Å; F502-M517 HydrophobicContact CB-CE 4.15Å; F502-M517 HydrophobicContact CB-CG 4.22Å; F502-M517 HydrophobicContact CG-CB 4.4Å; F502-M517 WeakPolarHBondContact O-CE 3.14Å
503	K	72.6	Confident	71	Confident	157 Å²	157	91.8 Å²	91.8	68%	0.683	44%	0.435	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.3	156.7	169	-54.8	-176.9	-178.3	176.6	0	109.8	R501 M517	R501-K503 PolarHBondContact O-N 3.34Å; K503-M517 VanDerWaalsContact C-CE 3.42Å; K503-M517 VanDerWaalsContact O-CE 3.31Å; K503-M517 WeakPolarHBondContact O-CE 3.43Å
504	C	79.3	Confident	70.7	Confident	11 Å²	11	94 Å²	94	7%	0.074	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	129.8	170.1	-178.2	0	0	0	0	110	Q506 C507 Y509 M517 H520 H524	C504-Q506 PolarHBondContact O-N 3.19Å; C504-C507 WeakPolarHBondContact CB-O 3.32Å; C504-C507 PolarHBondContact O-N 3.14Å; C504-Y509 WeakPolarHBondContact CB-O 3.26Å; C504-Y509 PolarHBondContact N-O 3.38Å; C504-M517 HydrophobicContact CB-CE 3.85Å; C504-M517 HydrophobicContact CB-SD 3.78Å; C504-H520 PolarHBondContact SG-CD2 3.29Å; C504-H520 PolarHBondContact SG-NE2 2.91Å; C504-H520 VanDerWaalsContact SG-NE2 3.39Å; C504-H524 PolarHBondContact SG-NE2 3.48Å; C504-H524 VanDerWaalsContact SG-NE2 3.4Å
505	D	76.6	Confident	70.7	Confident	124 Å²	124	98.8 Å²	98.8	66%	0.663	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-0.1	-177.2	-21.8	-69.6	0	0	0	112.9	K521	D505-K521 IonicContact OD1-NZ 2.95Å; D505-K521 WeakPolarHBondContact OD2-CE 3.4Å; D505-K521 IonicContact OD2-NZ 3.44Å; D505-K521 PolarHBondContact OD2-NZ 3.21Å
506	Q	75.6	Confident	70.9	Confident	126 Å²	126	99.3 Å²	99.3	59%	0.589	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.1	-4.8	-174.2	-61.9	178.1	3	0	0	113.3	C504	C504-Q506 PolarHBondContact O-N 3.19Å
507	C	82.3	Confident	71.5	Confident	47 Å²	47	98.6 Å²	98.6	32%	0.318	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.6	165.6	166.6	70.5	0	0	0	0	112.1	C504 Y509 H520	C504-C507 WeakPolarHBondContact CB-O 3.32Å; C504-C507 PolarHBondContact O-N 3.14Å; C507-Y509 PolarHBondContact O-N 3.26Å; C507-H520 PolarHBondContact SG-NE2 2.88Å
508	D	76.4	Confident	72.3	Confident	158 Å²	158	96.6 Å²	96.6	85%	0.845	45%	0.45	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.7	2.2	-177.9	-35.4	-42.6	0	0	0	116	C510	D508-C510 PolarHBondContact O-N 2.99Å; D508-C510 VanDerWaalsContact O-N 3.11Å; D508-C510 PolarHBondContact O-SG 3.11Å; D508-C510 VanDerWaalsContact O-SG 3.41Å
509	Y	73.3	Confident	73.3	Confident	107 Å²	107	93.3 Å²	93.3	42%	0.42	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	108.4	-179.2	-176.6	-97.8	0	0	0	111.6	C504 C507 C511 M517 H520	C504-Y509 WeakPolarHBondContact CB-O 3.26Å; C504-Y509 PolarHBondContact N-O 3.38Å; C507-Y509 PolarHBondContact O-N 3.26Å; Y509-C511 HydrophobicContact CD1-CB 4.5Å; Y509-C511 HydrophobicContact CE1-CB 3.69Å; Y509-M517 HydrophobicContact CD1-CE 4.18Å; Y509-H520 HydrophobicContact CD1-CB 3.96Å; Y509-H520 AromaticContact CD1-CD2 3.58Å; Y509-H520 AromaticContact CD1-CE1 3.62Å; Y509-H520 AromaticContact CD1-CG 3.31Å; Y509-H520 AromaticContact CD1-ND1 3.34Å; Y509-H520 VanDerWaalsContact CD1-ND1 3.34Å; Y509-H520 WeakPolarHBondContact CD1-ND1 3.21Å; Y509-H520 AromaticContact CD1-NE2 3.77Å; Y509-H520 HydrophobicContact CE1-CB 3.81Å; Y509-H520 AromaticContact CE1-CG 3.66Å; Y509-H520 AromaticContact CE1-ND1 3.76Å; Y509-H520 AromaticContact CG-CE1 3.6Å; Y509-H520 AromaticContact CG-ND1 3.69Å; Y509-H520 AromaticContact CG-NE2 3.96Å
510	C	75	Confident	74.3	Confident	47 Å²	47	89.4 Å²	89.4	32%	0.318	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	132.1	175.5	-55.3	0	0	0	0	110.5	K500 F502 D508	K500-C510 HydrophobicContact CB-CB 3.76Å; K500-C510 HydrophobicContact CD-CB 4.41Å; F502-C510 CarbonylContact O-C 3.58Å; F502-C510 VanDerWaalsContact O-CA 3.28Å; F502-C510 WeakPolarHBondContact O-CA 3.47Å; D508-C510 PolarHBondContact O-N 2.99Å; D508-C510 VanDerWaalsContact O-N 3.11Å; D508-C510 PolarHBondContact O-SG 3.11Å; D508-C510 VanDerWaalsContact O-SG 3.41Å
511	C	72.3	Confident	75.2	Confident	9 Å²	9	86.3 Å²	86.3	6%	0.061	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	168.5	-178.3	83	0	0	0	0	113.6	K500 R501 F502 Y509 Q513 H516 M517	K500-C511 CarbonylContact C-O 3.59Å; K500-C511 VanDerWaalsContact C-O 3.22Å; K500-C511 WeakPolarHBondContact CA-O 3.21Å; R501-C511 PolarHBondContact N-O 3.18Å; F502-C511 PolarHBondContact N-O 3.07Å; F502-C511 VanDerWaalsContact N-O 3.14Å; F502-C511 PolarHBondContact O-N 3.46Å; Y509-C511 HydrophobicContact CD1-CB 4.5Å; Y509-C511 HydrophobicContact CE1-CB 3.69Å; C511-Q513 PolarHBondContact SG-O 3.07Å; C511-Q513 VanDerWaalsContact SG-O 3.33Å; C511-H516 HydrophobicContact CB-CB 4.47Å; C511-M517 PolarHBondContact SG-N 3.19Å; C511-M517 VanDerWaalsContact SG-N 3.41Å
512	R	68.2	Low	76.2	Confident	145 Å²	145	85.5 Å²	85.5	55%	0.547	40%	0.397	S	S	.	.	S	Bend	trans	-95.9	-2.6	-167.7	-160	173.6	177.9	155	10	113.7	K497 N498	K497-R512 WeakPolarHBondContact O-CG 3.39Å; K497-R512 PolarHBondContact O-NE 3.25Å; K497-R512 PolarHBondContact O-NH2 2.75Å; N498-R512 PolarHBondContact OD1-NH2 2.72Å
513	Q	69.5	Low	76.6	Confident	106 Å²	106	85.3 Å²	85.3	50%	0.495	40%	0.4	S	S	.	.			trans	-151	134	-174.8	-64.9	179	-4.5	0	0	111.9	C511 R515 H516 M517	C511-Q513 PolarHBondContact SG-O 3.07Å; C511-Q513 VanDerWaalsContact SG-O 3.33Å; Q513-R515 VanDerWaalsContact C-N 3.34Å; Q513-R515 PolarHBondContact O-N 3.29Å; Q513-H516 WeakPolarHBondContact O-CA 3.32Å; Q513-H516 WeakPolarHBondContact O-CB 3.38Å; Q513-H516 PolarHBondContact O-N 3.25Å; Q513-H516 PolarHBondContact OE1-CE1 2.87Å; Q513-H516 PolarHBondContact OE1-ND1 3.04Å; Q513-M517 PolarHBondContact O-N 3.23Å
514	E	74.1	Confident	76.9	Confident	104 Å²	104	81.2 Å²	81.2	49%	0.486	38%	0.383	S	S	.	.	H	α-helix	trans	-53.3	-44.6	-178.8	-162.5	175.2	170.2	0	0	113.6	F502 H516 M517 I518	F502-E514 HydrophobicContact CD1-CB 4.13Å; F502-E514 HydrophobicContact CD1-CG 4.24Å; F502-E514 HydrophobicContact CE1-CB 3.51Å; F502-E514 HydrophobicContact CE1-CG 3.7Å; F502-E514 HydrophobicContact CE2-CB 4.31Å; F502-E514 VanDerWaalsContact CE2-N 3.3Å; F502-E514 HydrophobicContact CZ-CB 3.62Å; F502-E514 HydrophobicContact CZ-CG 4.29Å; E514-H516 PolarHBondContact O-N 3.02Å; E514-M517 CarbonylContact O-C 3.17Å; E514-M517 WeakPolarHBondContact O-CA 3.48Å; E514-M517 WeakPolarHBondContact O-CB 3.23Å; E514-M517 PolarHBondContact O-N 3.19Å; E514-I518 HydrophobicContact CG-CD1 4.28Å; E514-I518 WeakPolarHBondContact O-CG1 3.44Å; E514-I518 PolarHBondContact O-N 2.87Å
515	R	78.2	Confident	76.7	Confident	192 Å²	192	84.5 Å²	84.5	73%	0.725	40%	0.403	S	S	*	.	H	α-helix	trans	-56.6	-37.2	175.7	-174.6	-178.2	-70.1	-177.7	-2.1	112.6	Q513 M519	Q513-R515 VanDerWaalsContact C-N 3.34Å; Q513-R515 PolarHBondContact O-N 3.29Å; R515-M519 HydrophobicContact CG-CE 4.49Å; R515-M519 WeakPolarHBondContact O-CG 3.19Å; R515-M519 PolarHBondContact O-N 3.33Å; R515-M519 VanDerWaalsContact O-N 3.09Å
516	H	77.9	Confident	76.6	Confident	84 Å²	84	80 Å²	80	39%	0.389	39%	0.385	S	S	.	.	H	α-helix	trans	-73.9	-30.7	175.8	-72.6	111.4	0	0	0	112	C511 Q513 E514 H520	C511-H516 HydrophobicContact CB-CB 4.47Å; Q513-H516 WeakPolarHBondContact O-CA 3.32Å; Q513-H516 WeakPolarHBondContact O-CB 3.38Å; Q513-H516 PolarHBondContact O-N 3.25Å; Q513-H516 PolarHBondContact OE1-CE1 2.87Å; Q513-H516 PolarHBondContact OE1-ND1 3.04Å; E514-H516 PolarHBondContact O-N 3.02Å; H516-H520 VanDerWaalsContact O-CB 3.25Å; H516-H520 WeakPolarHBondContact O-CB 3.41Å; H516-H520 PolarHBondContact O-N 3.36Å
517	M	82	Confident	76.6	Confident	10 Å²	10	78.5 Å²	78.5	5%	0.049	38%	0.378	C	S	.	.	H	α-helix	trans	-69	-43.7	171.3	-177.6	48.2	61	0	0	111.9	F502 K503 C504 Y509 C511 Q513 E514 M519 H520 K521	F502-M517 HydrophobicContact CB-CB 3.85Å; F502-M517 HydrophobicContact CB-CE 4.15Å; F502-M517 HydrophobicContact CB-CG 4.22Å; F502-M517 HydrophobicContact CG-CB 4.4Å; F502-M517 WeakPolarHBondContact O-CE 3.14Å; K503-M517 VanDerWaalsContact C-CE 3.42Å; K503-M517 VanDerWaalsContact O-CE 3.31Å; K503-M517 WeakPolarHBondContact O-CE 3.43Å; C504-M517 HydrophobicContact CB-CE 3.85Å; C504-M517 HydrophobicContact CB-SD 3.78Å; Y509-M517 HydrophobicContact CD1-CE 4.18Å; C511-M517 PolarHBondContact SG-N 3.19Å; C511-M517 VanDerWaalsContact SG-N 3.41Å; Q513-M517 PolarHBondContact O-N 3.23Å; E514-M517 CarbonylContact O-C 3.17Å; E514-M517 WeakPolarHBondContact O-CA 3.48Å; E514-M517 WeakPolarHBondContact O-CB 3.23Å; E514-M517 PolarHBondContact O-N 3.19Å; M517-M519 VanDerWaalsContact C-N 3.35Å; M517-M519 PolarHBondContact O-N 3.39Å; M517-H520 CarbonylContact O-C 3.55Å; M517-H520 WeakPolarHBondContact O-CA 3.43Å; M517-H520 WeakPolarHBondContact O-CB 3.45Å; M517-H520 PolarHBondContact O-N 3.26Å; M517-H520 HydrophobicContact SD-CB 4.39Å; M517-K521 HydrophobicContact CG-CD 4.49Å; M517-K521 HydrophobicContact CG-CG 4.44Å; M517-K521 PolarHBondContact O-N 3.35Å; M517-K521 HydrophobicContact SD-CG 3.98Å
518	I	80.3	Confident	76.3	Confident	87 Å²	87	81.2 Å²	81.2	45%	0.446	39%	0.385	S	S	.	.	H	α-helix	trans	-60.6	-44.7	176.4	-64.7	164.7	0	0	0	110.6	E514 H520 K521 R522	E514-I518 HydrophobicContact CG-CD1 4.28Å; E514-I518 WeakPolarHBondContact O-CG1 3.44Å; E514-I518 PolarHBondContact O-N 2.87Å; I518-H520 VanDerWaalsContact C-N 3.26Å; I518-H520 PolarHBondContact O-N 3.37Å; I518-K521 PolarHBondContact O-N 3.21Å; I518-R522 PolarHBondContact O-N 3.19Å
519	M	76.8	Confident	76.5	Confident	50 Å²	50	77 Å²	77	25%	0.246	37%	0.367	C	S	.	.	H	α-helix	trans	-66.7	-25	173.6	-70.1	-167.9	-56.5	0	0	113.6	R515 M517 Q541	R515-M519 HydrophobicContact CG-CE 4.49Å; R515-M519 WeakPolarHBondContact O-CG 3.19Å; R515-M519 PolarHBondContact O-N 3.33Å; R515-M519 VanDerWaalsContact O-N 3.09Å; M517-M519 VanDerWaalsContact C-N 3.35Å; M517-M519 PolarHBondContact O-N 3.39Å; M519-Q541 HydrophobicContact SD-CG 4.25Å
520	H	82.4	Confident	76.7	Confident	25 Å²	25	74.8 Å²	74.8	12%	0.116	36%	0.359	C	S	.	.	H	α-helix	trans	-78.6	-40.4	173.8	174.2	77.6	0	0	0	112.4	C504 C507 Y509 H516 M517 I518 R522 T523 H524	C504-H520 PolarHBondContact SG-CD2 3.29Å; C504-H520 PolarHBondContact SG-NE2 2.91Å; C504-H520 VanDerWaalsContact SG-NE2 3.39Å; C507-H520 PolarHBondContact SG-NE2 2.88Å; Y509-H520 HydrophobicContact CD1-CB 3.96Å; Y509-H520 AromaticContact CD1-CD2 3.58Å; Y509-H520 AromaticContact CD1-CE1 3.62Å; Y509-H520 AromaticContact CD1-CG 3.31Å; Y509-H520 AromaticContact CD1-ND1 3.34Å; Y509-H520 VanDerWaalsContact CD1-ND1 3.34Å; Y509-H520 WeakPolarHBondContact CD1-ND1 3.21Å; Y509-H520 AromaticContact CD1-NE2 3.77Å; Y509-H520 HydrophobicContact CE1-CB 3.81Å; Y509-H520 AromaticContact CE1-CG 3.66Å; Y509-H520 AromaticContact CE1-ND1 3.76Å; Y509-H520 AromaticContact CG-CE1 3.6Å; Y509-H520 AromaticContact CG-ND1 3.69Å; Y509-H520 AromaticContact CG-NE2 3.96Å; H516-H520 VanDerWaalsContact O-CB 3.25Å; H516-H520 WeakPolarHBondContact O-CB 3.41Å; H516-H520 PolarHBondContact O-N 3.36Å; M517-H520 CarbonylContact O-C 3.55Å; M517-H520 WeakPolarHBondContact O-CA 3.43Å; M517-H520 WeakPolarHBondContact O-CB 3.45Å; M517-H520 PolarHBondContact O-N 3.26Å; M517-H520 HydrophobicContact SD-CB 4.39Å; I518-H520 VanDerWaalsContact C-N 3.26Å; I518-H520 PolarHBondContact O-N 3.37Å; H520-R522 PolarHBondContact O-N 2.83Å; H520-T523 WeakPolarHBondContact O-CA 3.45Å; H520-T523 VanDerWaalsContact O-CB 3.27Å; H520-T523 WeakPolarHBondContact O-CB 3.33Å; H520-T523 WeakPolarHBondContact O-CG2 3.47Å; H520-T523 PolarHBondContact O-N 3.04Å; H520-T523 PolarHBondContact O-OG1 3.35Å; H520-H524 AromaticContact CD2-NE2 3.83Å; H520-H524 AromaticContact CE1-NE2 3.63Å; H520-H524 AromaticContact NE2-CD2 3.88Å; H520-H524 AromaticContact NE2-CE1 3.9Å; H520-H524 AromaticContact NE2-NE2 3Å; H520-H524 PolarHBondContact NE2-NE2 3.07Å
521	K	79.3	Confident	77.1	Confident	79 Å²	79	75.5 Å²	75.5	34%	0.343	37%	0.368	S	S	.	.	H	α-helix	trans	-59	-36	175.9	-74.1	-173.5	170.9	-169.4	0	111.9	D505 M517 I518 T523 H524 T525	D505-K521 IonicContact OD1-NZ 2.95Å; D505-K521 WeakPolarHBondContact OD2-CE 3.4Å; D505-K521 IonicContact OD2-NZ 3.44Å; D505-K521 PolarHBondContact OD2-NZ 3.21Å; M517-K521 HydrophobicContact CG-CD 4.49Å; M517-K521 HydrophobicContact CG-CG 4.44Å; M517-K521 PolarHBondContact O-N 3.35Å; M517-K521 HydrophobicContact SD-CG 3.98Å; I518-K521 PolarHBondContact O-N 3.21Å; K521-T523 PolarHBondContact O-N 3.37Å; K521-T523 VanDerWaalsContact O-N 3.08Å; K521-H524 PolarHBondContact O-N 3.39Å; K521-T525 PolarHBondContact O-N 2.72Å; K521-T525 VanDerWaalsContact O-N 3.1Å
522	R	81.7	Confident	77.8	Confident	73 Å²	73	75.6 Å²	75.6	28%	0.275	37%	0.369	S	S	.	.	H	α-helix	trans	-59.7	-14	168.9	-69.5	179.6	179.8	170.5	2.6	115.2	I518 H520 G526	I518-R522 PolarHBondContact O-N 3.19Å; H520-R522 PolarHBondContact O-N 2.83Å; R522-G526 PolarHBondContact O-N 3.28Å
523	T	75.4	Confident	78.4	Confident	50 Å²	50	74 Å²	74	31%	0.307	38%	0.38	S	S	.	.	H	α-helix	trans	-76.9	-26.6	173	71.6	0	0	0	0	112.9	H520 K521 R540	H520-T523 WeakPolarHBondContact O-CA 3.45Å; H520-T523 VanDerWaalsContact O-CB 3.27Å; H520-T523 WeakPolarHBondContact O-CB 3.33Å; H520-T523 WeakPolarHBondContact O-CG2 3.47Å; H520-T523 PolarHBondContact O-N 3.04Å; H520-T523 PolarHBondContact O-OG1 3.35Å; K521-T523 PolarHBondContact O-N 3.37Å; K521-T523 VanDerWaalsContact O-N 3.08Å; T523-R540 VanDerWaalsContact O-CZ 3.27Å; T523-R540 PolarHBondContact O-NH1 3.14Å; T523-R540 VanDerWaalsContact O-NH1 3.09Å; T523-R540 PolarHBondContact O-NH2 3.3Å
524	H	79.1	Confident	78.8	Confident	72 Å²	72	74.3 Å²	74.3	33%	0.333	38%	0.382	S	S	.	.	H	α-helix	trans	-91.1	-49	176.4	-53.3	-62	0	0	0	112	C504 H520 K521 G526	C504-H524 PolarHBondContact SG-NE2 3.48Å; C504-H524 VanDerWaalsContact SG-NE2 3.4Å; H520-H524 AromaticContact CD2-NE2 3.83Å; H520-H524 AromaticContact CE1-NE2 3.63Å; H520-H524 AromaticContact NE2-CD2 3.88Å; H520-H524 AromaticContact NE2-CE1 3.9Å; H520-H524 AromaticContact NE2-NE2 3Å; H520-H524 PolarHBondContact NE2-NE2 3.07Å; K521-H524 PolarHBondContact O-N 3.39Å; H524-G526 PolarHBondContact O-N 3.02Å; H524-G526 VanDerWaalsContact O-N 3.12Å
525	T	75.6	Confident	79.4	Confident	79 Å²	79	71.1 Å²	71.1	49%	0.485	37%	0.37	S	S	.	.	S	Bend	trans	-64.7	-17.8	177	67.4	0	0	0	0	112.7	K521 E527	K521-T525 PolarHBondContact O-N 2.72Å; K521-T525 VanDerWaalsContact O-N 3.1Å; T525-E527 WeakPolarHBondContact CB-OE1 3.37Å; T525-E527 PolarHBondContact O-N 3.48Å; T525-E527 VanDerWaalsContact OG1-CD 3.26Å; T525-E527 PolarHBondContact OG1-OE1 2.92Å
526	G	73.5	Confident	79.4	Confident	29 Å²	29	71.2 Å²	71.2	30%	0.299	38%	0.379	S	S	.	.			trans	82.7	-13.9	171.9	0	0	0	0	0	115	R522 H524	R522-G526 PolarHBondContact O-N 3.28Å; H524-G526 PolarHBondContact O-N 3.02Å; H524-G526 VanDerWaalsContact O-N 3.12Å
527	E	76	Confident	79.5	Confident	95 Å²	95	72 Å²	72	44%	0.444	38%	0.381	S	S	.	.			trans	-43.6	135.6	179.7	-71.3	159.4	-124	0	0	113.6	T525 R540	T525-E527 WeakPolarHBondContact CB-OE1 3.37Å; T525-E527 PolarHBondContact O-N 3.48Å; T525-E527 VanDerWaalsContact OG1-CD 3.26Å; T525-E527 PolarHBondContact OG1-OE1 2.92Å; E527-R540 WeakPolarHBondContact O-CG 3.3Å
528	K	76.4	Confident	79.6	Confident	104 Å²	104	74.2 Å²	74.2	45%	0.452	40%	0.395	S	S	.	.			trans	-129.6	75.2	177.4	-70.8	162.5	156.7	-141.5	0	110.4	F530 T538 F539 R540	K528-F530 PolarHBondContact O-N 3.1Å; K528-T538 WeakPolarHBondContact CD-O 3.49Å; K528-T538 WeakPolarHBondContact CD-OG1 3.36Å; K528-T538 WeakPolarHBondContact CE-O 3.5Å; K528-T538 PolarHBondContact NZ-O 2.91Å; K528-F539 CarbonylContact C-O 3.58Å; K528-F539 VanDerWaalsContact C-O 3.26Å; K528-F539 VanDerWaalsContact CA-O 3.23Å; K528-F539 WeakPolarHBondContact CA-O 3.46Å; K528-R540 HydrophobicContact CG-CG 3.81Å
529	P	78.9	Confident	79.7	Confident	71 Å²	71	72 Å²	72	46%	0.461	38%	0.383	S	S	.	.			trans	-67.4	-7.7	-172.2	-20.8	34.5	0	0	0	114.9
530	F	79.1	Confident	79.9	Confident	60 Å²	60	74 Å²	74	26%	0.263	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	92.7	-172.8	-55.5	-76	0	0	0	110.1	K528 F539 K542 L545	K528-F530 PolarHBondContact O-N 3.1Å; F530-F539 HydrophobicContact CB-CB 4.4Å; F530-F539 PolarHBondContact N-O 2.98Å; F530-F539 PolarHBondContact O-N 2.82Å; F530-K542 HydrophobicContact CD1-CB 4.02Å; F530-K542 HydrophobicContact CD1-CG 4.39Å; F530-K542 HydrophobicContact CE1-CB 3.89Å; F530-K542 HydrophobicContact CE1-CG 4.46Å; F530-K542 HydrophobicContact CG-CB 4.39Å; F530-K542 HydrophobicContact CZ-CB 4.14Å; F530-L545 HydrophobicContact CB-CB 4.18Å; F530-L545 HydrophobicContact CB-CD2 3.89Å
531	A	82.9	Confident	79.8	Confident	62 Å²	62	75.4 Å²	75.4	51%	0.512	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	149.3	170.7	0	0	0	0	0	111.3	T538 L545	A531-T538 HydrophobicContact CB-CG2 3.92Å; A531-L545 VanDerWaalsContact O-CD2 3.24Å; A531-L545 WeakPolarHBondContact O-CD2 3.27Å
532	C	86.3	Confident	80	Confident	11 Å²	11	77.7 Å²	77.7	7%	0.074	40%	0.404	C	S	.	.			trans	-80.6	139.4	167.3	-170.6	0	0	0	0	110.3	Q534 C535 K537 L545	C532-Q534 VanDerWaalsContact C-N 3.3Å; C532-C535 WeakPolarHBondContact CB-O 3.37Å; C532-K537 PolarHBondContact N-O 2.84Å; C532-L545 HydrophobicContact CB-CD1 3.61Å
533	S	82	Confident	80	Confident	112 Å²	112	81.4 Å²	81.4	78%	0.783	42%	0.424	S	S	*	.	S	Bend	trans	-75	-18	176.2	48.6	0	0	0	0	113.6
534	Q	78	Confident	80.5	Confident	112 Å²	112	82.5 Å²	82.5	52%	0.523	43%	0.428	S	S	.	.	S	Bend	trans	-110.8	-2.3	-178	-65.6	-170.7	21.1	0	0	114.2	C532 F549 H553	C532-Q534 VanDerWaalsContact C-N 3.3Å; Q534-F549 HydrophobicContact CG-CE2 4.26Å; Q534-H553 VanDerWaalsContact CB-CE1 3.46Å; Q534-H553 WeakPolarHBondContact CB-CE1 3.48Å; Q534-H553 WeakPolarHBondContact CB-ND1 3.4Å; Q534-H553 PolarHBondContact OE1-ND1 2.95Å
535	C	84.8	Confident	80.8	Confident	37 Å²	37	80.3 Å²	80.3	25%	0.25	42%	0.419	C	S	.	.	S	Bend	trans	-161.5	163.1	167	70.5	0	0	0	0	112.5	C532 K537 H548 H553	C532-C535 WeakPolarHBondContact CB-O 3.37Å; C535-K537 PolarHBondContact O-N 3.33Å; C535-H548 PolarHBondContact SG-NE2 2.94Å; C535-H553 PolarHBondContact SG-NE2 2.65Å
536	E	79	Confident	81.2	Confident	193 Å²	193	79.6 Å²	79.6	90%	0.902	41%	0.412	S	S	*	.	S	Bend	trans	-64.3	6.1	-176.7	-57	176.7	175.5	0	0	115.6	T538	E536-T538 PolarHBondContact O-N 3.47Å
537	K	80.5	Confident	81.5	Confident	102 Å²	102	82.4 Å²	82.4	44%	0.443	42%	0.418	S	S	.	.			trans	-77.4	118	-176	-66.3	172.6	-167.7	147.5	0	110.7	C532 C535 F539	C532-K537 PolarHBondContact N-O 2.84Å; C535-K537 PolarHBondContact O-N 3.33Å; K537-F539 HydrophobicContact CB-CE2 3.62Å; K537-F539 HydrophobicContact CB-CZ 3.73Å; K537-F539 WeakPolarHBondContact O-CD2 3.45Å; K537-F539 WeakPolarHBondContact O-CE2 3.31Å
538	T	83.6	Confident	81.9	Confident	56 Å²	56	78.3 Å²	78.3	34%	0.344	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	135.4	179	50.9	0	0	0	0	112.1	K528 A531 E536	K528-T538 WeakPolarHBondContact CD-O 3.49Å; K528-T538 WeakPolarHBondContact CD-OG1 3.36Å; K528-T538 WeakPolarHBondContact CE-O 3.5Å; K528-T538 PolarHBondContact NZ-O 2.91Å; A531-T538 HydrophobicContact CB-CG2 3.92Å; E536-T538 PolarHBondContact O-N 3.47Å
539	F	82.6	Confident	82.1	Confident	41 Å²	41	76.9 Å²	76.9	18%	0.18	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	147.8	-169.3	-60.7	-87.8	0	0	0	112.8	K528 F530 K537 L544 L545 H548	K528-F539 CarbonylContact C-O 3.58Å; K528-F539 VanDerWaalsContact C-O 3.26Å; K528-F539 VanDerWaalsContact CA-O 3.23Å; K528-F539 WeakPolarHBondContact CA-O 3.46Å; F530-F539 HydrophobicContact CB-CB 4.4Å; F530-F539 PolarHBondContact N-O 2.98Å; F530-F539 PolarHBondContact O-N 2.82Å; K537-F539 HydrophobicContact CB-CE2 3.62Å; K537-F539 HydrophobicContact CB-CZ 3.73Å; K537-F539 WeakPolarHBondContact O-CD2 3.45Å; K537-F539 WeakPolarHBondContact O-CE2 3.31Å; F539-L544 HydrophobicContact CB-CB 4.27Å; F539-L544 HydrophobicContact CD1-CB 3.87Å; F539-L544 HydrophobicContact CG-CB 4.37Å; F539-L545 HydrophobicContact CB-CB 4.26Å; F539-L545 HydrophobicContact CD2-CB 3.9Å; F539-L545 HydrophobicContact CD2-CD1 3.98Å; F539-L545 HydrophobicContact CE2-CD1 4.12Å; F539-L545 HydrophobicContact CG-CB 4.21Å; F539-H548 HydrophobicContact CE1-CB 3.95Å; F539-H548 HydrophobicContact CE2-CB 4.05Å; F539-H548 AromaticContact CE2-CD2 3.33Å; F539-H548 WeakPolarHBondContact CE2-CD2 2.71Å; F539-H548 AromaticContact CE2-CG 3.85Å; F539-H548 HydrophobicContact CZ-CB 3.48Å; F539-H548 VanDerWaalsContact CZ-CB 3.48Å; F539-H548 AromaticContact CZ-CD2 3.3Å; F539-H548 WeakPolarHBondContact CZ-CD2 3.48Å; F539-H548 AromaticContact CZ-CG 3.35Å
540	R	81	Confident	82.2	Confident	90 Å²	90	79.1 Å²	79.1	34%	0.34	40%	0.396	S	S	.	.	S	Bend	trans	-77.4	-18	-179.7	-62.9	-173.1	167.1	172.3	-12.7	114.1	T523 E527 K528	T523-R540 VanDerWaalsContact O-CZ 3.27Å; T523-R540 PolarHBondContact O-NH1 3.14Å; T523-R540 VanDerWaalsContact O-NH1 3.09Å; T523-R540 PolarHBondContact O-NH2 3.3Å; E527-R540 WeakPolarHBondContact O-CG 3.3Å; K528-R540 HydrophobicContact CG-CG 3.81Å
541	Q	79.6	Confident	82.1	Confident	56 Å²	56	81.7 Å²	81.7	26%	0.262	40%	0.403	S	S	.	.	S	Bend	trans	-145.1	141.2	-175	-65.5	177.2	-3.7	0	0	110.3	M519 Q543 L544 L545	M519-Q541 HydrophobicContact SD-CG 4.25Å; Q541-Q543 VanDerWaalsContact C-N 3.33Å; Q541-Q543 PolarHBondContact O-N 2.99Å; Q541-L544 HydrophobicContact CB-CD1 4.31Å; Q541-L544 HydrophobicContact CB-CG 4.4Å; Q541-L544 PolarHBondContact O-N 2.88Å; Q541-L544 VanDerWaalsContact O-N 3.08Å; Q541-L545 PolarHBondContact O-N 2.82Å
542	K	83.4	Confident	81.8	Confident	127 Å²	127	86.2 Å²	86.2	55%	0.552	41%	0.409	S	S	*	.	H	α-helix	trans	-55.5	-44	-180	-171	-177	170.3	174.3	0	112.6	F530 L544 L545 D546	F530-K542 HydrophobicContact CD1-CB 4.02Å; F530-K542 HydrophobicContact CD1-CG 4.39Å; F530-K542 HydrophobicContact CE1-CB 3.89Å; F530-K542 HydrophobicContact CE1-CG 4.46Å; F530-K542 HydrophobicContact CG-CB 4.39Å; F530-K542 HydrophobicContact CZ-CB 4.14Å; K542-L544 PolarHBondContact O-N 3.14Å; K542-L544 VanDerWaalsContact O-N 3.1Å; K542-L545 CarbonylContact O-C 3.27Å; K542-L545 WeakPolarHBondContact O-CA 3.44Å; K542-L545 WeakPolarHBondContact O-CB 3.3Å; K542-L545 PolarHBondContact O-N 2.85Å; K542-D546 VanDerWaalsContact CE-OD1 3.32Å; K542-D546 WeakPolarHBondContact CE-OD1 3.44Å; K542-D546 VanDerWaalsContact O-CG 3.29Å; K542-D546 PolarHBondContact O-N 2.78Å
543	Q	83.1	Confident	81.3	Confident	150 Å²	150	87.5 Å²	87.5	70%	0.701	41%	0.413	S	S	*	.	H	α-helix	trans	-57	-29.6	178.8	-68.8	179.7	-16.3	0	0	114	Q541 M547	Q541-Q543 VanDerWaalsContact C-N 3.33Å; Q541-Q543 PolarHBondContact O-N 2.99Å; Q543-M547 VanDerWaalsContact O-CB 3.24Å; Q543-M547 WeakPolarHBondContact O-CB 3.48Å; Q543-M547 PolarHBondContact O-N 2.89Å
544	L	84.3	Confident	81.1	Confident	73 Å²	73	84.9 Å²	84.9	38%	0.382	39%	0.39	S	S	.	.	H	α-helix	trans	-77.8	-34.1	176.2	-65.6	174.1	0	0	0	111.9	F539 Q541 K542 M547 H548	F539-L544 HydrophobicContact CB-CB 4.27Å; F539-L544 HydrophobicContact CD1-CB 3.87Å; F539-L544 HydrophobicContact CG-CB 4.37Å; Q541-L544 HydrophobicContact CB-CD1 4.31Å; Q541-L544 HydrophobicContact CB-CG 4.4Å; Q541-L544 PolarHBondContact O-N 2.88Å; Q541-L544 VanDerWaalsContact O-N 3.08Å; K542-L544 PolarHBondContact O-N 3.14Å; K542-L544 VanDerWaalsContact O-N 3.1Å; L544-M547 HydrophobicContact CD2-CE 4.39Å; L544-H548 VanDerWaalsContact O-CB 3.25Å; L544-H548 WeakPolarHBondContact O-CB 3.45Å; L544-H548 PolarHBondContact O-N 3.18Å
545	L	87	Confident	80.6	Confident	26 Å²	26	85.6 Å²	85.6	14%	0.136	41%	0.405	C	S	.	.	H	α-helix	trans	-66.3	-49.9	168.8	169.8	60.4	0	0	0	110.5	F530 A531 C532 F539 Q541 K542 M547 H548 F549	F530-L545 HydrophobicContact CB-CB 4.18Å; F530-L545 HydrophobicContact CB-CD2 3.89Å; A531-L545 VanDerWaalsContact O-CD2 3.24Å; A531-L545 WeakPolarHBondContact O-CD2 3.27Å; C532-L545 HydrophobicContact CB-CD1 3.61Å; F539-L545 HydrophobicContact CB-CB 4.26Å; F539-L545 HydrophobicContact CD2-CB 3.9Å; F539-L545 HydrophobicContact CD2-CD1 3.98Å; F539-L545 HydrophobicContact CE2-CD1 4.12Å; F539-L545 HydrophobicContact CG-CB 4.21Å; Q541-L545 PolarHBondContact O-N 2.82Å; K542-L545 CarbonylContact O-C 3.27Å; K542-L545 WeakPolarHBondContact O-CA 3.44Å; K542-L545 WeakPolarHBondContact O-CB 3.3Å; K542-L545 PolarHBondContact O-N 2.85Å; L545-M547 VanDerWaalsContact C-N 3.31Å; L545-M547 PolarHBondContact O-N 3.33Å; L545-H548 CarbonylContact O-C 3.59Å; L545-H548 PolarHBondContact O-N 3.16Å; L545-F549 WeakPolarHBondContact O-CB 3.34Å; L545-F549 PolarHBondContact O-N 3.43Å
546	D	83.3	Confident	79.9	Confident	65 Å²	65	90.6 Å²	90.6	35%	0.348	43%	0.429	S	S	.	.	H	α-helix	trans	-58.1	-43.3	179.5	-59.6	-24.1	0	0	0	111	K542 K550	K542-D546 VanDerWaalsContact CE-OD1 3.32Å; K542-D546 WeakPolarHBondContact CE-OD1 3.44Å; K542-D546 VanDerWaalsContact O-CG 3.29Å; K542-D546 PolarHBondContact O-N 2.78Å; D546-K550 WeakPolarHBondContact O-CB 3.37Å; D546-K550 WeakPolarHBondContact O-CG 3.32Å; D546-K550 PolarHBondContact O-N 2.99Å
547	M	80.4	Confident	79.4	Confident	88 Å²	88	84.7 Å²	84.7	43%	0.433	40%	0.401	S	S	.	.	H	α-helix	trans	-67.2	-35.9	174.8	-173.6	-165.1	66.8	0	0	112.5	Q543 L544 L545 R551	Q543-M547 VanDerWaalsContact O-CB 3.24Å; Q543-M547 WeakPolarHBondContact O-CB 3.48Å; Q543-M547 PolarHBondContact O-N 2.89Å; L544-M547 HydrophobicContact CD2-CE 4.39Å; L545-M547 VanDerWaalsContact C-N 3.31Å; L545-M547 PolarHBondContact O-N 3.33Å; M547-R551 VanDerWaalsContact O-CB 3.29Å; M547-R551 WeakPolarHBondContact O-CB 3.28Å; M547-R551 WeakPolarHBondContact O-CD 3.34Å; M547-R551 WeakPolarHBondContact O-CG 3.48Å; M547-R551 PolarHBondContact O-N 3.18Å; M547-R551 VanDerWaalsContact O-N 3.12Å
548	H	83.5	Confident	78.6	Confident	9 Å²	9	85.6 Å²	85.6	4%	0.042	41%	0.414	C	S	.	.	H	α-helix	trans	-69.9	-46.5	176.2	164.7	49.1	0	0	0	111.5	C535 F539 L544 L545 K550 R551 Y552 H553	C535-H548 PolarHBondContact SG-NE2 2.94Å; F539-H548 HydrophobicContact CE1-CB 3.95Å; F539-H548 HydrophobicContact CE2-CB 4.05Å; F539-H548 AromaticContact CE2-CD2 3.33Å; F539-H548 WeakPolarHBondContact CE2-CD2 2.71Å; F539-H548 AromaticContact CE2-CG 3.85Å; F539-H548 HydrophobicContact CZ-CB 3.48Å; F539-H548 VanDerWaalsContact CZ-CB 3.48Å; F539-H548 AromaticContact CZ-CD2 3.3Å; F539-H548 WeakPolarHBondContact CZ-CD2 3.48Å; F539-H548 AromaticContact CZ-CG 3.35Å; L544-H548 VanDerWaalsContact O-CB 3.25Å; L544-H548 WeakPolarHBondContact O-CB 3.45Å; L544-H548 PolarHBondContact O-N 3.18Å; L545-H548 CarbonylContact O-C 3.59Å; L545-H548 PolarHBondContact O-N 3.16Å; H548-K550 PolarHBondContact O-N 3.41Å; H548-R551 PolarHBondContact O-N 2.83Å; H548-Y552 AromaticContact CE1-CD2 3.79Å; H548-Y552 AromaticContact CE1-CG 3.93Å; H548-Y552 AromaticContact ND1-CD2 3.19Å; H548-Y552 WeakPolarHBondContact ND1-CD2 3.47Å; H548-Y552 AromaticContact ND1-CE2 3.91Å; H548-Y552 AromaticContact ND1-CG 3.8Å; H548-Y552 WeakPolarHBondContact O-CD2 3.39Å; H548-Y552 PolarHBondContact O-N 3Å; H548-Y552 VanDerWaalsContact O-N 3.09Å; H548-H553 AromaticContact CE1-CD2 3.7Å; H548-H553 AromaticContact CE1-NE2 3.6Å; H548-H553 AromaticContact NE2-CD2 3.64Å; H548-H553 AromaticContact NE2-NE2 3.5Å; H548-H553 PolarHBondContact NE2-NE2 3.4Å
549	F	81.3	Confident	77.8	Confident	73 Å²	73	86.7 Å²	86.7	32%	0.32	42%	0.423	S	S	.	.	H	α-helix	trans	-55.4	-53.4	175.7	-171	-92	0	0	0	109.8	Q534 L545 R551 Y552 H553 D554	Q534-F549 HydrophobicContact CG-CE2 4.26Å; L545-F549 WeakPolarHBondContact O-CB 3.34Å; L545-F549 PolarHBondContact O-N 3.43Å; F549-R551 PolarHBondContact O-N 3.48Å; F549-R551 VanDerWaalsContact O-N 3.13Å; F549-Y552 PolarHBondContact O-N 3.42Å; F549-H553 HydrophobicContact CD2-CB 3.81Å; F549-H553 HydrophobicContact CE2-CB 3.95Å; F549-H553 HydrophobicContact CG-CB 4.17Å; F549-H553 HydrophobicContact CZ-CB 4.4Å; F549-H553 CarbonylContact O-C 3.47Å; F549-H553 WeakPolarHBondContact O-CA 3.35Å; F549-H553 WeakPolarHBondContact O-CB 3.36Å; F549-H553 PolarHBondContact O-N 3.09Å; F549-D554 PolarHBondContact O-N 3.3Å
550	K	81.3	Confident	76.9	Confident	119 Å²	119	89.4 Å²	89.4	52%	0.517	44%	0.442	S	S	.	.	H	α-helix	trans	-59.6	-25.8	176	-71.4	-172.2	175.2	-162.3	0	114.7	D546 H548 F557	D546-K550 WeakPolarHBondContact O-CB 3.37Å; D546-K550 WeakPolarHBondContact O-CG 3.32Å; D546-K550 PolarHBondContact O-N 2.99Å; H548-K550 PolarHBondContact O-N 3.41Å; K550-F557 HydrophobicContact CB-CD2 4.16Å; K550-F557 HydrophobicContact CB-CE2 4.47Å; K550-F557 WeakPolarHBondContact O-CB 3.45Å; K550-F557 WeakPolarHBondContact O-CD1 3.25Å; K550-F557 VanDerWaalsContact O-CD2 3.32Å; K550-F557 WeakPolarHBondContact O-CD2 3.34Å; K550-F557 WeakPolarHBondContact O-CG 3.29Å
551	R	77.1	Confident	76.5	Confident	113 Å²	113	88 Å²	88	43%	0.426	45%	0.45	S	S	.	.	H	α-helix	trans	-92.9	-13.7	-178.2	-78.4	175.7	174.4	-115.2	-7.9	115.4	M547 H548 F549 F557	M547-R551 VanDerWaalsContact O-CB 3.29Å; M547-R551 WeakPolarHBondContact O-CB 3.28Å; M547-R551 WeakPolarHBondContact O-CD 3.34Å; M547-R551 WeakPolarHBondContact O-CG 3.48Å; M547-R551 PolarHBondContact O-N 3.18Å; M547-R551 VanDerWaalsContact O-N 3.12Å; H548-R551 PolarHBondContact O-N 2.83Å; F549-R551 PolarHBondContact O-N 3.48Å; F549-R551 VanDerWaalsContact O-N 3.13Å; R551-F557 HydrophobicContact CG-CD1 4.36Å; R551-F557 HydrophobicContact CG-CE1 3.79Å; R551-F557 HydrophobicContact CG-CZ 4.01Å
552	Y	74.8	Confident	76.4	Confident	158 Å²	158	87.7 Å²	87.7	62%	0.62	45%	0.448	S	S	*	.	H	α-helix	trans	-141.2	-9.2	-169.1	-65.4	-85.6	0	0	0	114.4	H548 F549	H548-Y552 AromaticContact CE1-CD2 3.79Å; H548-Y552 AromaticContact CE1-CG 3.93Å; H548-Y552 AromaticContact ND1-CD2 3.19Å; H548-Y552 WeakPolarHBondContact ND1-CD2 3.47Å; H548-Y552 AromaticContact ND1-CE2 3.91Å; H548-Y552 AromaticContact ND1-CG 3.8Å; H548-Y552 WeakPolarHBondContact O-CD2 3.39Å; H548-Y552 PolarHBondContact O-N 3Å; H548-Y552 VanDerWaalsContact O-N 3.09Å; F549-Y552 PolarHBondContact O-N 3.42Å
553	H	76.3	Confident	76.4	Confident	38 Å²	38	85.1 Å²	85.1	18%	0.176	44%	0.443	C	S	.	.	T	Hydrogen-bonded Turn	trans	-137.4	1.1	-172.5	-65.5	-72	0	0	0	113.4	Q534 C535 H548 F549	Q534-H553 VanDerWaalsContact CB-CE1 3.46Å; Q534-H553 WeakPolarHBondContact CB-CE1 3.48Å; Q534-H553 WeakPolarHBondContact CB-ND1 3.4Å; Q534-H553 PolarHBondContact OE1-ND1 2.95Å; C535-H553 PolarHBondContact SG-NE2 2.65Å; H548-H553 AromaticContact CE1-CD2 3.7Å; H548-H553 AromaticContact CE1-NE2 3.6Å; H548-H553 AromaticContact NE2-CD2 3.64Å; H548-H553 AromaticContact NE2-NE2 3.5Å; H548-H553 PolarHBondContact NE2-NE2 3.4Å; F549-H553 HydrophobicContact CD2-CB 3.81Å; F549-H553 HydrophobicContact CE2-CB 3.95Å; F549-H553 HydrophobicContact CG-CB 4.17Å; F549-H553 HydrophobicContact CZ-CB 4.4Å; F549-H553 CarbonylContact O-C 3.47Å; F549-H553 WeakPolarHBondContact O-CA 3.35Å; F549-H553 WeakPolarHBondContact O-CB 3.36Å; F549-H553 PolarHBondContact O-N 3.09Å
554	D	77.1	Confident	76.4	Confident	56 Å²	56	78 Å²	78	30%	0.299	41%	0.409	S	S	.	.			trans	-111.2	106.6	175.7	-177.8	-14.2	0	0	0	108.3	F549 N556 F557	F549-D554 PolarHBondContact O-N 3.3Å; D554-N556 PolarHBondContact O-N 3.41Å; D554-N556 PolarHBondContact OD1-N 3.32Å; D554-N556 VanDerWaalsContact OD1-N 3.14Å; D554-F557 HydrophobicContact CB-CB 4.34Å; D554-F557 PolarHBondContact O-N 3.09Å
555	P	68.1	Low	76.2	Confident	128 Å²	128	80.4 Å²	80.4	83%	0.831	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-22.4	-176.9	-24.3	35	0	0	0	114.2
556	N	70.8	Confident	75.8	Confident	141 Å²	141	84.8 Å²	84.8	75%	0.754	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	7.8	-175.1	-67.4	-14.9	0	0	0	112.7	D554 V558	D554-N556 PolarHBondContact O-N 3.41Å; D554-N556 PolarHBondContact OD1-N 3.32Å; D554-N556 VanDerWaalsContact OD1-N 3.14Å; N556-V558 PolarHBondContact O-N 2.89Å
557	F	69.1	Low	75.8	Confident	70 Å²	70	82.2 Å²	82.2	31%	0.307	44%	0.437	S	S	.	.			trans	-75.9	87.3	-178.5	-175.5	-100.8	0	0	0	112.9	K550 R551 D554 P559	K550-F557 HydrophobicContact CB-CD2 4.16Å; K550-F557 HydrophobicContact CB-CE2 4.47Å; K550-F557 WeakPolarHBondContact O-CB 3.45Å; K550-F557 WeakPolarHBondContact O-CD1 3.25Å; K550-F557 VanDerWaalsContact O-CD2 3.32Å; K550-F557 WeakPolarHBondContact O-CD2 3.34Å; K550-F557 WeakPolarHBondContact O-CG 3.29Å; R551-F557 HydrophobicContact CG-CD1 4.36Å; R551-F557 HydrophobicContact CG-CE1 3.79Å; R551-F557 HydrophobicContact CG-CZ 4.01Å; D554-F557 HydrophobicContact CB-CB 4.34Å; D554-F557 PolarHBondContact O-N 3.09Å; F557-P559 HydrophobicContact CD1-CG 4.33Å; F557-P559 HydrophobicContact CE1-CB 4.14Å; F557-P559 HydrophobicContact CE1-CG 4.08Å; F557-P559 VanDerWaalsContact O-CD 3.3Å; F557-P559 WeakPolarHBondContact O-CD 3.43Å
558	V	63.7	Low	75.6	Confident	121 Å²	121	82.5 Å²	82.5	73%	0.733	45%	0.448	S	S	*	.			trans	-69	118.6	161	-176.9	0	0	0	0	108.6	N556 T560	N556-V558 PolarHBondContact O-N 2.89Å; V558-T560 PolarHBondContact O-N 3.15Å
559	P	65.1	Low	75.5	Confident	79 Å²	79	86.8 Å²	86.8	51%	0.513	47%	0.466	S	S	.	.			trans	-64.5	129.3	176	-19.7	33	0	0	0	110.3	F557 A561	F557-P559 HydrophobicContact CD1-CG 4.33Å; F557-P559 HydrophobicContact CE1-CB 4.14Å; F557-P559 HydrophobicContact CE1-CG 4.08Å; F557-P559 VanDerWaalsContact O-CD 3.3Å; F557-P559 WeakPolarHBondContact O-CD 3.43Å; P559-A561 PolarHBondContact O-N 3.24Å
560	T	65.4	Low	75.4	Confident	97 Å²	97	88 Å²	88	60%	0.595	48%	0.48	S	S	*	.			trans	-68.2	91	178.8	37	0	0	0	0	111.6	V558 F562	V558-T560 PolarHBondContact O-N 3.15Å; T560-F562 WeakPolarHBondContact O-CD2 3.41Å; T560-F562 WeakPolarHBondContact O-CE2 3.41Å; T560-F562 PolarHBondContact O-N 2.85Å
561	A	71.6	Confident	75.3	Confident	60 Å²	60	84.7 Å²	84.7	50%	0.496	47%	0.465	S	S	.	.			trans	-81.8	107.8	176.9	0	0	0	0	0	110.4	P559 V563	P559-A561 PolarHBondContact O-N 3.24Å; A561-V563 PolarHBondContact O-N 3.12Å
562	F	78.4	Confident	75.2	Confident	50 Å²	50	84 Å²	84	22%	0.219	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	107.5	171.3	-62.1	-80.6	0	0	0	108.6	T560 F571 R574 M577	T560-F562 WeakPolarHBondContact O-CD2 3.41Å; T560-F562 WeakPolarHBondContact O-CE2 3.41Å; T560-F562 PolarHBondContact O-N 2.85Å; F562-F571 PolarHBondContact N-O 3.48Å; F562-F571 PolarHBondContact O-N 2.92Å; F562-R574 HydrophobicContact CD1-CB 4.16Å; F562-R574 HydrophobicContact CD1-CG 4.3Å; F562-R574 HydrophobicContact CD2-CB 4.28Å; F562-R574 HydrophobicContact CE1-CB 4.14Å; F562-R574 HydrophobicContact CE1-CG 4.41Å; F562-R574 HydrophobicContact CE2-CB 4.24Å; F562-R574 HydrophobicContact CG-CB 4.23Å; F562-R574 HydrophobicContact CZ-CB 4.17Å; F562-M577 HydrophobicContact CB-CB 3.86Å; F562-M577 HydrophobicContact CB-CE 4.35Å; F562-M577 HydrophobicContact CB-CG 4Å
563	V	82.1	Confident	75.3	Confident	74 Å²	74	84.6 Å²	84.6	45%	0.448	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	135.7	177.3	-167.8	0	0	0	0	109.6	A561 T570	A561-V563 PolarHBondContact O-N 3.12Å; V563-T570 HydrophobicContact CG2-CG2 4.22Å
564	C	84.5	Confident	75.4	Confident	0 Å²	0	90.1 Å²	90.1	0%	0	49%	0.494	C	S	.	.			trans	-81.4	112.9	171.1	-179.2	0	0	0	0	110.5	K566 C567 S568 K569 F571 M577	C564-K566 PolarHBondContact O-N 3.09Å; C564-C567 PolarHBondContact O-N 2.95Å; C564-C567 VanDerWaalsContact O-N 3.16Å; C564-S568 WeakPolarHBondContact O-CA 3.29Å; C564-S568 PolarHBondContact O-N 3.46Å; C564-K569 PolarHBondContact N-O 3.47Å; C564-F571 HydrophobicContact CB-CE2 4.1Å; C564-M577 HydrophobicContact CB-CG 4.28Å; C564-M577 HydrophobicContact CB-SD 4.48Å
565	S	79.9	Confident	75.5	Confident	123 Å²	123	93.3 Å²	93.3	86%	0.86	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-10.2	-177.1	-41.2	0	0	0	0	115.6
566	K	78.8	Confident	76.1	Confident	119 Å²	119	90.6 Å²	90.6	52%	0.517	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-15.1	179.4	-67.1	-177.1	179.5	176	0	114.8	C564 A581 C584	C564-K566 PolarHBondContact O-N 3.09Å; K566-A581 PolarHBondContact NZ-O 2.77Å; K566-C584 HydrophobicContact CB-CB 4.26Å; K566-C584 HydrophobicContact CD-CB 4.16Å; K566-C584 WeakPolarHBondContact CD-O 3.32Å
567	C	82.4	Confident	76.7	Confident	10 Å²	10	85.2 Å²	85.2	7%	0.068	46%	0.464	C	S	.	.	T	Hydrogen-bonded Turn	trans	-158.5	13.9	-176.8	67.9	0	0	0	0	114.8	C564 K569 H580 C584	C564-C567 PolarHBondContact O-N 2.95Å; C564-C567 VanDerWaalsContact O-N 3.16Å; C567-K569 PolarHBondContact O-N 3.38Å; C567-H580 PolarHBondContact SG-NE2 3.23Å; C567-C584 PolarHBondContact SG-SG 2.96Å
568	S	77.1	Confident	77.3	Confident	94 Å²	94	85.6 Å²	85.6	66%	0.657	47%	0.468	S	S	*	.			trans	59.3	3	177.5	-54	0	0	0	0	117.2	C564 T570	C564-S568 WeakPolarHBondContact O-CA 3.29Å; C564-S568 PolarHBondContact O-N 3.46Å; S568-T570 PolarHBondContact O-N 3.41Å
569	K	80.8	Confident	78	Confident	99 Å²	99	88.4 Å²	88.4	43%	0.43	47%	0.466	S	S	.	.			trans	-65.3	132.4	178.3	-70	167.1	-168.9	154.5	0	110.6	C564 C567 F571 E587	C564-K569 PolarHBondContact N-O 3.47Å; C567-K569 PolarHBondContact O-N 3.38Å; K569-F571 HydrophobicContact CB-CE2 3.81Å; K569-F571 HydrophobicContact CB-CZ 4.12Å; K569-F571 VanDerWaalsContact O-CD2 3.3Å; K569-F571 WeakPolarHBondContact O-CD2 3.46Å; K569-F571 VanDerWaalsContact O-CE2 3.26Å; K569-F571 WeakPolarHBondContact O-CE2 3.39Å; K569-E587 PolarHBondContact NZ-O 2.72Å
570	T	79.6	Confident	78.8	Confident	99 Å²	99	87 Å²	87	61%	0.607	45%	0.452	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.7	138.4	-172.6	63.9	0	0	0	0	112	V563 S568	V563-T570 HydrophobicContact CG2-CG2 4.22Å; S568-T570 PolarHBondContact O-N 3.41Å
571	F	78.5	Confident	79.5	Confident	49 Å²	49	83.4 Å²	83.4	22%	0.215	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	137.1	-174.1	-64.2	-89.5	0	0	0	112	F562 C564 K569 R573 M577 H580	F562-F571 PolarHBondContact N-O 3.48Å; F562-F571 PolarHBondContact O-N 2.92Å; C564-F571 HydrophobicContact CB-CE2 4.1Å; K569-F571 HydrophobicContact CB-CE2 3.81Å; K569-F571 HydrophobicContact CB-CZ 4.12Å; K569-F571 VanDerWaalsContact O-CD2 3.3Å; K569-F571 WeakPolarHBondContact O-CD2 3.46Å; K569-F571 VanDerWaalsContact O-CE2 3.26Å; K569-F571 WeakPolarHBondContact O-CE2 3.39Å; F571-R573 PolarHBondContact O-N 2.82Å; F571-M577 HydrophobicContact CB-CB 3.95Å; F571-M577 HydrophobicContact CD2-CB 3.91Å; F571-M577 HydrophobicContact CD2-CG 3.86Å; F571-M577 HydrophobicContact CG-CB 4.08Å; F571-H580 HydrophobicContact CE1-CB 4.16Å; F571-H580 HydrophobicContact CE2-CB 4.1Å; F571-H580 AromaticContact CE2-CD2 3.41Å; F571-H580 VanDerWaalsContact CE2-CD2 3.41Å; F571-H580 WeakPolarHBondContact CE2-CD2 3.48Å; F571-H580 AromaticContact CE2-CG 3.88Å; F571-H580 HydrophobicContact CZ-CB 3.68Å; F571-H580 AromaticContact CZ-CD2 3.32Å; F571-H580 WeakPolarHBondContact CZ-CD2 3.5Å; F571-H580 AromaticContact CZ-CG 3.39Å; F571-H580 AromaticContact CZ-NE2 3.97Å
572	T	75.9	Confident	79.9	Confident	99 Å²	99	86.8 Å²	86.8	61%	0.607	44%	0.438	S	S	*	.	S	Bend	trans	-78.3	4.6	-179.3	59.5	0	0	0	0	114.6
573	R	76.1	Confident	79.6	Confident	171 Å²	171	90.5 Å²	90.5	65%	0.645	46%	0.46	S	S	*	.	S	Bend	trans	-149.9	138.6	176.8	-61.1	-177	178	-175.9	-2	111.2	F571 N575 T576 M577	F571-R573 PolarHBondContact O-N 2.82Å; R573-N575 PolarHBondContact O-N 3.3Å; R573-T576 WeakPolarHBondContact CB-OG1 3.26Å; R573-T576 PolarHBondContact O-N 2.61Å; R573-T576 PolarHBondContact O-OG1 3.36Å; R573-M577 PolarHBondContact O-N 3.39Å
574	R	78.3	Confident	79.4	Confident	153 Å²	153	87.6 Å²	87.6	58%	0.577	44%	0.443	S	S	*	.	H	α-helix	trans	-58.8	-47.6	179.3	-168.7	179.4	-68.9	174.5	-4.2	112.8	F562 T576 M577 L578	F562-R574 HydrophobicContact CD1-CB 4.16Å; F562-R574 HydrophobicContact CD1-CG 4.3Å; F562-R574 HydrophobicContact CD2-CB 4.28Å; F562-R574 HydrophobicContact CE1-CB 4.14Å; F562-R574 HydrophobicContact CE1-CG 4.41Å; F562-R574 HydrophobicContact CE2-CB 4.24Å; F562-R574 HydrophobicContact CG-CB 4.23Å; F562-R574 HydrophobicContact CZ-CB 4.17Å; R574-T576 VanDerWaalsContact C-N 3.27Å; R574-T576 PolarHBondContact O-N 2.82Å; R574-M577 WeakPolarHBondContact O-CA 3.45Å; R574-M577 WeakPolarHBondContact O-CB 3.49Å; R574-M577 PolarHBondContact O-N 3.17Å; R574-L578 HydrophobicContact CG-CD1 4.07Å; R574-L578 HydrophobicContact CG-CG 4.34Å; R574-L578 WeakPolarHBondContact O-CG 3.42Å; R574-L578 PolarHBondContact O-N 2.95Å
575	N	78.7	Confident	78.5	Confident	124 Å²	124	96 Å²	96	66%	0.663	48%	0.484	S	S	*	.	H	α-helix	trans	-66.5	-24.3	-176.3	-60.2	35.7	0	0	0	113.9	R573 R579	R573-N575 PolarHBondContact O-N 3.3Å; N575-R579 PolarHBondContact O-N 2.85Å
576	T	80.8	Confident	77.6	Confident	71 Å²	71	92.4 Å²	92.4	44%	0.436	47%	0.466	S	S	.	.	H	α-helix	trans	-81.9	-28.9	171.9	45.1	0	0	0	0	112.1	R573 R574 H580	R573-T576 WeakPolarHBondContact CB-OG1 3.26Å; R573-T576 PolarHBondContact O-N 2.61Å; R573-T576 PolarHBondContact O-OG1 3.36Å; R574-T576 VanDerWaalsContact C-N 3.27Å; R574-T576 PolarHBondContact O-N 2.82Å; T576-H580 VanDerWaalsContact O-CB 3.29Å; T576-H580 WeakPolarHBondContact O-CB 3.42Å; T576-H580 PolarHBondContact O-N 2.63Å; T576-H580 VanDerWaalsContact O-N 3.14Å
577	M	84.7	Confident	76.3	Confident	28 Å²	28	94.5 Å²	94.5	14%	0.138	48%	0.478	C	S	.	.	H	α-helix	trans	-68	-45.9	170.1	-171.3	-81.3	-76.2	0	0	110.9	F562 C564 F571 R573 R574 H580 A581	F562-M577 HydrophobicContact CB-CB 3.86Å; F562-M577 HydrophobicContact CB-CE 4.35Å; F562-M577 HydrophobicContact CB-CG 4Å; C564-M577 HydrophobicContact CB-CG 4.28Å; C564-M577 HydrophobicContact CB-SD 4.48Å; F571-M577 HydrophobicContact CB-CB 3.95Å; F571-M577 HydrophobicContact CD2-CB 3.91Å; F571-M577 HydrophobicContact CD2-CG 3.86Å; F571-M577 HydrophobicContact CG-CB 4.08Å; R573-M577 PolarHBondContact O-N 3.39Å; R574-M577 WeakPolarHBondContact O-CA 3.45Å; R574-M577 WeakPolarHBondContact O-CB 3.49Å; R574-M577 PolarHBondContact O-N 3.17Å; M577-H580 CarbonylContact O-C 3.57Å; M577-H580 WeakPolarHBondContact O-CA 3.42Å; M577-H580 WeakPolarHBondContact O-CB 3.17Å; M577-H580 PolarHBondContact O-N 3.14Å; M577-H580 VanDerWaalsContact O-N 3.09Å; M577-A581 WeakPolarHBondContact O-CB 3.17Å; M577-A581 PolarHBondContact O-N 3.34Å; M577-A581 HydrophobicContact SD-CB 4.2Å
578	L	80.5	Confident	75	Confident	77 Å²	77	97.8 Å²	97.8	40%	0.403	51%	0.506	S	S	.	.	H	α-helix	trans	-60	-55.1	178.7	-69.2	171.5	0	0	0	111.6	R574 H580 A581 E582	R574-L578 HydrophobicContact CG-CD1 4.07Å; R574-L578 HydrophobicContact CG-CG 4.34Å; R574-L578 WeakPolarHBondContact O-CG 3.42Å; R574-L578 PolarHBondContact O-N 2.95Å; L578-H580 PolarHBondContact O-N 2.92Å; L578-H580 VanDerWaalsContact O-N 3.07Å; L578-A581 PolarHBondContact O-N 3.29Å; L578-E582 VanDerWaalsContact C-OE1 3.31Å; L578-E582 WeakPolarHBondContact O-CB 3.32Å; L578-E582 VanDerWaalsContact O-CG 3.29Å; L578-E582 WeakPolarHBondContact O-CG 3.28Å; L578-E582 PolarHBondContact O-N 2.69Å
579	R	79.4	Confident	73.3	Confident	181 Å²	181	97 Å²	97	68%	0.683	51%	0.512	S	S	*	.	H	α-helix	trans	-58.5	-22.3	173	-89	-168	60.9	-168.8	-5.8	114.7	N575 E582 N583	N575-R579 PolarHBondContact O-N 2.85Å; R579-E582 WeakPolarHBondContact CA-OE2 3.34Å; R579-N583 PolarHBondContact O-OD1 3.42Å
580	H	81.2	Confident	71.8	Confident	50 Å²	50	95.4 Å²	95.4	23%	0.231	52%	0.524	C	S	.	.	H	α-helix	trans	-79.3	-47.6	170.4	178.7	61.9	0	0	0	111.1	C567 F571 T576 M577 L578 E582 N583 C584	C567-H580 PolarHBondContact SG-NE2 3.23Å; F571-H580 HydrophobicContact CE1-CB 4.16Å; F571-H580 HydrophobicContact CE2-CB 4.1Å; F571-H580 AromaticContact CE2-CD2 3.41Å; F571-H580 VanDerWaalsContact CE2-CD2 3.41Å; F571-H580 WeakPolarHBondContact CE2-CD2 3.48Å; F571-H580 AromaticContact CE2-CG 3.88Å; F571-H580 HydrophobicContact CZ-CB 3.68Å; F571-H580 AromaticContact CZ-CD2 3.32Å; F571-H580 WeakPolarHBondContact CZ-CD2 3.5Å; F571-H580 AromaticContact CZ-CG 3.39Å; F571-H580 AromaticContact CZ-NE2 3.97Å; T576-H580 VanDerWaalsContact O-CB 3.29Å; T576-H580 WeakPolarHBondContact O-CB 3.42Å; T576-H580 PolarHBondContact O-N 2.63Å; T576-H580 VanDerWaalsContact O-N 3.14Å; M577-H580 CarbonylContact O-C 3.57Å; M577-H580 WeakPolarHBondContact O-CA 3.42Å; M577-H580 WeakPolarHBondContact O-CB 3.17Å; M577-H580 PolarHBondContact O-N 3.14Å; M577-H580 VanDerWaalsContact O-N 3.09Å; L578-H580 PolarHBondContact O-N 2.92Å; L578-H580 VanDerWaalsContact O-N 3.07Å; H580-E582 VanDerWaalsContact C-N 3.3Å; H580-E582 PolarHBondContact O-N 3.2Å; H580-N583 CarbonylContact O-C 3.26Å; H580-N583 VanDerWaalsContact O-C 3.27Å; H580-N583 WeakPolarHBondContact O-CA 3.48Å; H580-N583 PolarHBondContact O-N 2.89Å; H580-C584 WeakPolarHBondContact O-CA 3.42Å; H580-C584 WeakPolarHBondContact O-CB 3.32Å; H580-C584 PolarHBondContact O-N 3.14Å
581	A	79.9	Confident	69.9	Low	21 Å²	21	98.8 Å²	98.8	17%	0.174	54%	0.539	C	S	.	.	H	α-helix	trans	-63.6	-31.6	-179.9	0	0	0	0	0	113.6	K566 M577 L578	K566-A581 PolarHBondContact NZ-O 2.77Å; M577-A581 WeakPolarHBondContact O-CB 3.17Å; M577-A581 PolarHBondContact O-N 3.34Å; M577-A581 HydrophobicContact SD-CB 4.2Å; L578-A581 PolarHBondContact O-N 3.29Å
582	E	80.2	Confident	68.3	Low	131 Å²	131	104.6 Å²	104.6	61%	0.612	57%	0.567	S	S	*	*	H	α-helix	trans	-59.2	-46.6	168.2	-72.4	154.3	-147.6	0	0	111	L578 R579 H580	L578-E582 VanDerWaalsContact C-OE1 3.31Å; L578-E582 WeakPolarHBondContact O-CB 3.32Å; L578-E582 VanDerWaalsContact O-CG 3.29Å; L578-E582 WeakPolarHBondContact O-CG 3.28Å; L578-E582 PolarHBondContact O-N 2.69Å; R579-E582 WeakPolarHBondContact CA-OE2 3.34Å; H580-E582 VanDerWaalsContact C-N 3.3Å; H580-E582 PolarHBondContact O-N 3.2Å
583	N	73.2	Confident	66.6	Low	127 Å²	127	107.3 Å²	107.3	68%	0.679	58%	0.577	S	S	*	*	S	Bend	trans	-96	10.5	-179.6	-72.9	105.9	0	0	0	114.6	R579 H580 M585	R579-N583 PolarHBondContact O-OD1 3.42Å; H580-N583 CarbonylContact O-C 3.26Å; H580-N583 VanDerWaalsContact O-C 3.27Å; H580-N583 WeakPolarHBondContact O-CA 3.48Å; H580-N583 PolarHBondContact O-N 2.89Å; N583-M585 PolarHBondContact O-N 3.1Å
584	C	76.3	Confident	64.3	Low	14 Å²	14	103.1 Å²	103.1	10%	0.095	59%	0.587	C	S	.	*			trans	-91.6	103.1	-172.4	-178	0	0	0	0	111.2	K566 C567 H580 G586	K566-C584 HydrophobicContact CB-CB 4.26Å; K566-C584 HydrophobicContact CD-CB 4.16Å; K566-C584 WeakPolarHBondContact CD-O 3.32Å; C567-C584 PolarHBondContact SG-SG 2.96Å; H580-C584 WeakPolarHBondContact O-CA 3.42Å; H580-C584 WeakPolarHBondContact O-CB 3.32Å; H580-C584 PolarHBondContact O-N 3.14Å; C584-G586 PolarHBondContact O-N 3.15Å
585	M	66	Low	61.9	Low	176 Å²	176	103.3 Å²	103.3	87%	0.867	60%	0.6	S	S	*	*			trans	-90.2	70.6	171	-59.1	-164.2	-52.8	0	0	111.2	N583 E587	N583-M585 PolarHBondContact O-N 3.1Å; M585-E587 VanDerWaalsContact C-N 3.26Å; M585-E587 PolarHBondContact O-N 2.83Å
586	G	61.8	Low	60.3	Low	47 Å²	47	101.8 Å²	101.8	49%	0.485	60%	0.597	S	S	.	*	S	Bend	trans	65.5	-37.4	155.4	0	0	0	0	0	120.6	C584 A588	C584-G586 PolarHBondContact O-N 3.15Å; G586-A588 PolarHBondContact O-N 3.4Å
587	E	50.4	Low	58	Low	163 Å²	163	104 Å²	104	76%	0.762	62%	0.615	S	S	*	*			trans	-81.9	112.4	-160.1	-64.3	-165.7	158.8	0	0	113.9	K569 M585 G589	K569-E587 PolarHBondContact NZ-O 2.72Å; M585-E587 VanDerWaalsContact C-N 3.26Å; M585-E587 PolarHBondContact O-N 2.83Å; E587-G589 PolarHBondContact O-N 2.97Å
588	A	55.7	Low	55.8	Low	79 Å²	79	108.5 Å²	108.5	65%	0.653	65%	0.646	S	S	*	*			trans	-84.8	65.6	162.3	0	0	0	0	0	109.6	G586 G590	G586-A588 PolarHBondContact O-N 3.4Å; A588-G590 PolarHBondContact O-N 3.25Å
589	G	41	Very low	54.1	Low	77 Å²	77	114.6 Å²	114.6	79%	0.794	67%	0.669	S	S	*	*			trans	-63.9	101.7	172	0	0	0	0	0	110.8	E587	E587-G589 PolarHBondContact O-N 2.97Å
590	G	49.7	Very low	52	Low	66 Å²	66	116.3 Å²	116.3	68%	0.68	68%	0.682	S	S	*	*			trans	-106.2	116.4	162.4	0	0	0	0	0	108.5	A588	A588-G590 PolarHBondContact O-N 3.25Å
591	D	38.5	Very low	49.6	Very low	171 Å²	171	117.2 Å²	117.2	91%	0.914	71%	0.705	S	S	*	*			trans	-153.2	152.2	168.1	-101.1	-42.8	0	0	0	107.9
592	E	46.3	Very low	47.5	Very low	171 Å²	171	126.4 Å²	126.4	80%	0.799	74%	0.735	S	S	*	*			trans	-110.7	146.4	-160.1	-58.7	-166.6	156.3	0	0	115
593	N	39.3	Very low	45.3	Very low	156 Å²	156	129.8 Å²	129.8	83%	0.834	74%	0.742	S	S	*	*			trans	54	109.3	153.2	-64.2	-49.2	0	0	0	120.2
594	G	28.7	Very low	43.7	Very low	83 Å²	83	127.5 Å²	127.5	86%	0.856	75%	0.749	S	S	*	*			trans	-155.9	129.2	160.7	0	0	0	0	0	111.5
595	D	27.3	Very low	42	Very low	157 Å²	157	138.8 Å²	138.8	84%	0.84	79%	0.789	S	S	*	*			trans	-95	-171.5	-168	-153.2	28.8	0	0	0	112.6
596	P	45.5	Very low	40.5	Very low	92 Å²	92	139.7 Å²	139.7	60%	0.597	79%	0.788	S	S	*	*				-116.4	161.1	-97.7	34.6	-21.3	0	0	0	116.9
597	S	31.7	Very low	39.4	Very low	116 Å²	116	149.3 Å²	149.3	81%	0.811	81%	0.81	S	S	*	*			trans	71	168	154.8	-77.6	0	0	0	0	117.4
598	P	40.1	Very low	38.5	Very low	123 Å²	123	149.3 Å²	149.3	80%	0.799	81%	0.807	S	S	*	*			cis	-123.6	174.7	5.7	42.1	-28.6	0	0	0	116.7
599	K	44.8	Very low	37.3	Very low	205 Å²	205	154 Å²	154	89%	0.891	82%	0.818	S	S	*	*			trans	-64.8	138	-177.5	-59.7	158.6	-176	165.8	0	113.5
600	K	33.5	Very low	36.9	Very low	218 Å²	218	157.6 Å²	157.6	95%	0.948	81%	0.814	S	S	*	*			trans	-121.8	125.5	150.4	-78.3	179.9	179	170.7	0	109.5
601	G	30.7	Very low	36	Very low	69 Å²	69	159.6 Å²	159.6	71%	0.711	82%	0.818	S	S	*	*			trans	-104.3	-164	177.7	0	0	0	0	0	113.1
602	R	36.6	Very low	35.7	Very low	214 Å²	214	163.6 Å²	163.6	81%	0.808	82%	0.82	S	S	*	*			trans	71.2	150.6	-173.8	-71.4	178.1	169.5	-106.8	7.9	114.4
603	R	34.9	Very low	35.1	Very low	202 Å²	202	165.2 Å²	165.2	76%	0.762	82%	0.819	S	S	*	*			cis	-125.6	147.5	-10	-75.8	98.8	-175.6	-81.7	6.2	109
604	G	39	Very low	34.8	Very low	79 Å²	79	162.6 Å²	162.6	81%	0.814	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-70.9	137.4	157.3	0	0	0	0	0	110.6
605	R	39.8	Very low	35.1	Very low	251 Å²	251	165 Å²	165	95%	0.947	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-95.8	119.8	176.1	-163.9	173.3	-174	179.4	1.5	109.6
606	K	35.8	Very low	35.5	Very low	195 Å²	195	164.3 Å²	164.3	85%	0.848	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-63.2	154.3	179.6	-69.5	-176.7	175.3	-176.6	0	111.4
607	R	37.2	Very low	35	Very low	249 Å²	249	167.2 Å²	167.2	94%	0.94	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-53.2	138.7	159	-65.5	176.8	175.4	178.2	-4	109
608	K	32.3	Very low	35.3	Very low	162 Å²	162	169.3 Å²	169.3	70%	0.704	81%	0.807	S	S	*	*			trans	-112.5	108.7	164.2	-171.7	-175.7	-177.9	-159.1	0	107.5	Q610	K608-Q610 HydrophobicContact CD-CG 4.42Å
609	M	31.5	Very low	35	Very low	179 Å²	179	171.1 Å²	171.1	88%	0.882	81%	0.81	S	S	*	*			trans	-68.6	142.9	158.9	-79.2	167	149.4	0	0	108.1
610	Q	32.1	Very low	34.5	Very low	151 Å²	151	168.6 Å²	168.6	71%	0.706	81%	0.806	S	S	*	*			trans	-125.2	109.8	156.5	-84.2	-179.4	-122.8	0	0	107	K608	K608-Q610 HydrophobicContact CD-CG 4.42Å
611	S	30.3	Very low	34.5	Very low	109 Å²	109	165.4 Å²	165.4	76%	0.762	80%	0.8	S	S	*	*			trans	-63.4	140.9	159.5	43.6	0	0	0	0	108.9
612	R	31.9	Very low	34.7	Very low	254 Å²	254	169.6 Å²	169.6	96%	0.958	80%	0.801	S	S	*	*			trans	-119.7	133.4	154.5	-96.6	-174.1	163.6	-177.4	-8	108.4
613	R	33.1	Very low	34.2	Very low	206 Å²	206	164.8 Å²	164.8	78%	0.777	79%	0.791	S	S	*	*			trans	-153.5	146.7	-175.5	-90.3	-164.1	157.3	-127.2	9.1	102.8
614	D	34.8	Very low	33.9	Very low	101 Å²	101	161.2 Å²	161.2	54%	0.54	79%	0.791	S	S	.	*			cis	-131.5	-137.8	-12.9	-82.4	-46.6	0	0	0	106.3
615	D	33.4	Very low	33.5	Very low	132 Å²	132	165.2 Å²	165.2	71%	0.706	79%	0.789	S	S	*	*			trans	91.7	117.9	143.1	-40.7	-47.1	0	0	0	120
616	D	35.9	Very low	33	Very low	144 Å²	144	157.1 Å²	157.1	77%	0.77	78%	0.784	S	S	*	*			trans	61.7	147.8	151.5	-39.3	-28.9	0	0	0	119
617	D	35.3	Very low	32.7	Very low	153 Å²	153	156.4 Å²	156.4	82%	0.818	78%	0.783	S	S	*	*			cis	-126.2	165.3	5.7	-42	-87.8	0	0	0	111.8
618	D	37.3	Very low	32.4	Very low	159 Å²	159	150.1 Å²	150.1	85%	0.85	77%	0.768	S	S	*	*			trans	-137.4	-151.6	-178.5	-74.9	-70.7	0	0	0	113.3
619	D	35.4	Very low	32.2	Very low	161 Å²	161	150.5 Å²	150.5	86%	0.861	78%	0.778	S	S	*	*			trans	71.9	141.4	-175.6	-59.6	-21.5	0	0	0	117.6
620	D	33.5	Very low	32.2	Very low	153 Å²	153	148.1 Å²	148.1	82%	0.818	76%	0.764	S	S	*	*			cis	-124	-118	-5.8	-156.6	-19.8	0	0	0	111.1
621	D	33.7	Very low	32.2	Very low	151 Å²	151	148.1 Å²	148.1	81%	0.807	77%	0.774	S	S	*	*			cis	-158.2	168.4	1	-167	-2.2	0	0	0	108.6
622	E	34.1	Very low	32.2	Very low	157 Å²	157	150.4 Å²	150.4	73%	0.734	77%	0.773	S	S	*	*			trans	-120.3	159.3	-167.7	-97	-161.4	-178.9	0	0	118
623	N	27.8	Very low	32.1	Very low	113 Å²	113	144.6 Å²	144.6	60%	0.604	76%	0.761	S	S	*	*			trans	67.1	158.5	151	-88.7	-57.2	0	0	0	119.2
624	T	26.8	Very low	32.3	Very low	126 Å²	126	142.6 Å²	142.6	77%	0.773	76%	0.76	S	S	*	*			cis	-137	155	28.7	-60.8	0	0	0	0	113.3
625	E	31.3	Very low	32.4	Very low	164 Å²	164	145 Å²	145	77%	0.766	77%	0.768	S	S	*	*			trans	-69.3	159.2	172.6	62.8	-121.3	113.4	0	0	115.3
626	G	29.4	Very low	32.2	Very low	81 Å²	81	145.2 Å²	145.2	84%	0.835	77%	0.77	S	S	*	*			trans	-151.8	113.3	177.1	0	0	0	0	0	110.7
627	E	30.2	Very low	31.9	Very low	179 Å²	179	145.2 Å²	145.2	84%	0.836	77%	0.77	S	S	*	*			trans	-90.1	151	-163.4	-163	171.1	127.2	0	0	113.6
628	L	30.4	Very low	31.6	Very low	118 Å²	118	144.9 Å²	144.9	62%	0.618	77%	0.765	S	S	*	*			trans	7.8	143.2	161.8	-57.9	168.6	0	0	0	120.9	E630	L628-E630 HydrophobicContact CD2-CG 4.42Å
629	D	28.3	Very low	31.5	Very low	170 Å²	170	143.8 Å²	143.8	91%	0.909	76%	0.758	S	S	*	*				-151.3	144.8	111.6	-124	-16.8	0	0	0	110.7
630	E	30.8	Very low	31.3	Very low	129 Å²	129	143.6 Å²	143.6	60%	0.603	76%	0.757	S	S	*	*			trans	-105.8	146.2	-170.2	-67.2	162.6	153.5	0	0	111.9	L628	L628-E630 HydrophobicContact CD2-CG 4.42Å
631	V	31.7	Very low	31.3	Very low	150 Å²	150	144.3 Å²	144.3	91%	0.909	76%	0.755	S	S	*	*			trans	-140.5	106.9	150.9	-82.2	0	0	0	0	108
632	E	30.7	Very low	31.3	Very low	158 Å²	158	144 Å²	144	74%	0.738	75%	0.752	S	S	*	*			trans	-88.9	-155.9	177.9	-58.5	-167.9	108.9	0	0	111
633	D	30.6	Very low	31.2	Very low	131 Å²	131	146 Å²	146	70%	0.701	76%	0.762	S	S	*	*			trans	71.9	94.7	170.8	-51.3	-6.3	0	0	0	115.1
634	E	36.5	Very low	31.5	Very low	164 Å²	164	146 Å²	146	77%	0.766	77%	0.766	S	S	*	*				82.8	142.9	72.6	-73.1	175.9	172.8	0	0	112.3
635	E	37.2	Very low	32.1	Very low	151 Å²	151	149.4 Å²	149.4	71%	0.706	77%	0.773	S	S	*	*			cis	-151.8	159.6	9	-134.4	171.7	-169.2	0	0	109.3
636	D	29.5	Very low	32.2	Very low	138 Å²	138	150.1 Å²	150.1	74%	0.738	78%	0.776	S	S	*	*			trans	36.7	145.6	146.9	-72.7	-6.1	0	0	0	122.6
637	D	30.2	Very low	32.5	Very low	144 Å²	144	151.2 Å²	151.2	77%	0.77	78%	0.777	S	S	*	*				-152.1	170.7	55.2	-153.4	-18.2	0	0	0	114
638	M	28.2	Very low	33	Very low	146 Å²	146	151 Å²	151	72%	0.719	78%	0.776	S	S	*	*			trans	-79.1	158.5	-165.3	-57.7	-174.8	-76.8	0	0	115
639	L	34.5	Very low	33.6	Very low	136 Å²	136	151.1 Å²	151.1	71%	0.712	78%	0.784	S	S	*	*				-179	121.1	102	-91.5	171.4	0	0	0	112.1	E641	L639-E641 HydrophobicContact CD2-CG 4.26Å
640	N	32.1	Very low	34.2	Very low	156 Å²	156	149.4 Å²	149.4	83%	0.834	78%	0.779	S	S	*	*			trans	-103.7	122.1	152	-86.2	-55.1	0	0	0	107
641	E	32.4	Very low	34.6	Very low	168 Å²	168	150 Å²	150	79%	0.785	79%	0.792	S	S	*	*			trans	-119.1	129.1	160.7	-73.1	-168.5	135.7	0	0	109.8	L639	L639-E641 HydrophobicContact CD2-CG 4.26Å
642	I	35	Very low	35.2	Very low	145 Å²	145	147.5 Å²	147.5	74%	0.744	78%	0.778	S	S	*	*			trans	-128.3	105.4	175.2	-63.2	175.8	0	0	0	105.5	V644	I642-V644 HydrophobicContact CG2-CG2 4.05Å
643	E	31.9	Very low	35.4	Very low	199 Å²	199	147.6 Å²	147.6	93%	0.93	78%	0.782	S	S	*	*			trans	-79.8	124.6	169.2	-69.5	-168	125.1	0	0	110.1
644	V	34	Very low	35.7	Very low	113 Å²	113	147 Å²	147	69%	0.685	79%	0.786	S	S	*	*			trans	-129.3	117.3	168.2	169.3	0	0	0	0	106.6	I642	I642-V644 HydrophobicContact CG2-CG2 4.05Å
645	E	38.3	Very low	35.7	Very low	198 Å²	198	143.4 Å²	143.4	93%	0.925	78%	0.784	S	S	*	*			trans	-63.3	137.8	175.4	-69.3	-174.2	114.1	0	0	111
646	Q	33.4	Very low	36.1	Very low	179 Å²	179	141.8 Å²	141.8	84%	0.836	79%	0.787	S	S	*	*			trans	-96.7	161.2	-176.2	-60.8	-176.9	24.2	0	0	111.9
647	A	35.9	Very low	36.4	Very low	103 Å²	103	141.6 Å²	141.6	85%	0.851	79%	0.79	S	S	*	*			trans	-124.3	143.3	167.6	0	0	0	0	0	110.1
648	E	40.5	Very low	36.8	Very low	174 Å²	174	143.1 Å²	143.1	81%	0.813	79%	0.792	S	S	*	*			trans	-120.7	177.3	-178.9	-53.7	-168.2	144.8	0	0	111.1
649	P	44.5	Very low	37.5	Very low	122 Å²	122	141.6 Å²	141.6	79%	0.792	79%	0.794	S	S	*	*				-127.8	-171.6	-70	38.1	-22.7	0	0	0	113.2
650	V	41.2	Very low	38.1	Very low	133 Å²	133	141 Å²	141	81%	0.806	80%	0.797	S	S	*	*			trans	-117.1	141.9	-162.9	172.9	0	0	0	0	114.6
651	V	38.3	Very low	38.2	Very low	142 Å²	142	139.1 Å²	139.1	86%	0.861	79%	0.792	S	S	*	*			trans	-154.7	166.3	156.8	-111.3	0	0	0	0	111.6
652	P	43.2	Very low	38.4	Very low	97 Å²	97	140.3 Å²	140.3	63%	0.63	79%	0.794	S	S	*	*				-141.8	173.6	-117.8	45	-26.3	0	0	0	120.1
653	I	35.6	Very low	38.3	Very low	160 Å²	160	145.7 Å²	145.7	82%	0.821	81%	0.805	S	S	*	*			trans	69.8	156.8	147.6	-76.9	162.7	0	0	0	116.9
654	P	36.3	Very low	38.2	Very low	120 Å²	120	145.5 Å²	145.5	78%	0.779	80%	0.801	S	S	*	*			cis	-125.4	-174.9	6	30.3	-7.7	0	0	0	116.6
655	A	37.3	Very low	38	Very low	87 Å²	87	152.2 Å²	152.2	72%	0.719	81%	0.814	S	S	*	*			trans	-108.4	162.8	163.5	0	0	0	0	0	110.9
656	P	46.2	Very low	37.4	Very low	118 Å²	118	146.4 Å²	146.4	77%	0.766	81%	0.807	S	S	*	*				-131.8	-149.4	75.4	19.1	6.7	0	0	0	112.2
657	V	35.6	Very low	37.2	Very low	133 Å²	133	149.3 Å²	149.3	81%	0.806	81%	0.811	S	S	*	*			cis	-157.6	163.1	15.2	-139.9	0	0	0	0	112.6
658	E	37.6	Very low	37.6	Very low	176 Å²	176	149.3 Å²	149.3	82%	0.822	80%	0.802	S	S	*	*			trans	-92.4	176.7	157.4	-65.3	-164.9	159.5	0	0	110.6
659	P	44.5	Very low	37.6	Very low	115 Å²	115	146.8 Å²	146.8	75%	0.747	80%	0.801	S	S	*	*			cis	-134.6	-144.4	16.5	38.8	-13.2	0	0	0	111.4
660	P	46.1	Very low	36.9	Very low	122 Å²	122	150.1 Å²	150.1	79%	0.792	80%	0.803	S	S	*	*			cis	-134.4	-131.7	-5.3	42.5	-20.2	0	0	0	115.3
661	V	34.8	Very low	36.3	Very low	118 Å²	118	151.6 Å²	151.6	72%	0.715	81%	0.806	S	S	*	*			trans	-140.3	136.3	-152.5	178.2	0	0	0	0	114.7
662	K	36.3	Very low	36	Very low	193 Å²	193	154.2 Å²	154.2	84%	0.839	81%	0.806	S	S	*	*			trans	27.6	137.5	154.9	-56.4	162.9	-173.7	165.5	0	121.5
663	R	32.2	Very low	35.9	Very low	257 Å²	257	154 Å²	154	97%	0.97	81%	0.805	S	S	*	*			trans	-161	178.8	139.7	-116.5	161.4	140.1	-147.9	-6.9	114.8
664	K	30.7	Very low	35.5	Very low	195 Å²	195	153.5 Å²	153.5	85%	0.848	80%	0.804	S	S	*	*			trans	-130.4	165.7	-170.3	-69.9	-177.3	174.9	-179.1	0	112.9
665	R	29.5	Very low	35.8	Very low	254 Å²	254	154 Å²	154	96%	0.958	81%	0.807	S	S	*	*			trans	85.1	145.2	170.9	-49.6	167.6	-177.9	-121.8	4.7	114.8
666	G	25.7	Very low	35.5	Very low	76 Å²	76	154.8 Å²	154.8	78%	0.784	81%	0.813	S	S	*	*			cis	151.7	124.5	-21.9	0	0	0	0	0	117.8
667	R	28.5	Very low	34.7	Very low	240 Å²	240	153 Å²	153	91%	0.906	81%	0.808	S	S	*	*			trans	63	158.5	162.2	-109.6	-168.2	171	-113.1	-3.9	119.2
668	P	44.3	Very low	34.7	Very low	103 Å²	103	151.7 Å²	151.7	67%	0.669	80%	0.796	S	S	*	*			cis	-105.4	-105.1	-12.1	27.1	-4	0	0	0	112.1
669	P	41.4	Very low	34.6	Very low	121 Å²	121	151 Å²	151	79%	0.786	80%	0.796	S	S	*	*			cis	-108.5	-123.7	-4.2	41.7	-27.9	0	0	0	113.8
670	K	29.7	Very low	34.2	Very low	192 Å²	192	152.8 Å²	152.8	84%	0.835	79%	0.788	S	S	*	*			trans	-157.3	147.9	177.3	-69.2	-178.6	179.2	178	0	111.6
671	N	29.4	Very low	34.1	Very low	165 Å²	165	153 Å²	153	88%	0.882	79%	0.787	S	S	*	*				-177.6	176.1	126.6	-98.7	0.1	0	0	0	113.1
672	K	30.3	Very low	34.4	Very low	197 Å²	197	154 Å²	154	86%	0.857	78%	0.784	S	S	*	*			trans	-140.6	173.6	-175.7	-86	-167.6	175.7	-166	0	108.4
673	P	41.9	Very low	34.7	Very low	93 Å²	93	151.2 Å²	151.2	60%	0.604	78%	0.778	S	S	*	*			cis	-134.7	175.6	-40.6	40.9	-25.8	0	0	0	113
674	D	27.6	Very low	35.5	Very low	148 Å²	148	148.8 Å²	148.8	79%	0.791	78%	0.778	S	S	*	*			trans	58.5	170.8	155.8	-49.9	-27.3	0	0	0	119.1
675	P	43.1	Very low	36.6	Very low	131 Å²	131	146 Å²	146	85%	0.851	78%	0.777	S	S	*	*			cis	-116.1	-166.1	-15.3	37.9	-21.3	0	0	0	112.8
676	A	30.6	Very low	38.1	Very low	103 Å²	103	139.6 Å²	139.6	85%	0.851	77%	0.766	S	S	*	*			trans	-95.6	153.1	-174	0	0	0	0	0	115.5
677	A	29.4	Very low	39.5	Very low	80 Å²	80	139 Å²	139	66%	0.661	76%	0.76	S	S	*	*			trans	-141.5	122.3	162.5	0	0	0	0	0	107.3
678	I	35.8	Very low	40.4	Very low	107 Å²	107	136 Å²	136	55%	0.549	76%	0.756	S	S	.	*				65	116.3	94.7	-59	162.2	0	0	0	112.3	R680 I693	I678-R680 HydrophobicContact CG2-CG 4.47Å; I678-I693 HydrophobicContact CD1-CD1 3.81Å; I678-I693 HydrophobicContact CG1-CD1 3.97Å
679	I	34.8	Very low	40.5	Very low	162 Å²	162	134 Å²	134	83%	0.831	74%	0.742	S	S	*	*			trans	-120.1	131.9	168.2	-63.9	175.7	0	0	0	106.5
680	R	35.2	Very low	40.6	Very low	152 Å²	152	135.7 Å²	135.7	57%	0.574	75%	0.745	S	S	*	*			trans	-101.7	155.9	176	-66.5	-179.8	174.3	170	-2.9	110.4	I678 D691	I678-R680 HydrophobicContact CG2-CG 4.47Å; R680-D691 WeakPolarHBondContact CG-OD1 3.49Å; R680-D691 IonicContact CZ-OD2 3.8Å; R680-D691 IonicContact NE-OD1 3.62Å; R680-D691 PolarHBondContact NE-OD1 3.22Å; R680-D691 IonicContact NE-OD2 2.82Å; R680-D691 PolarHBondContact NE-OD2 2.88Å; R680-D691 IonicContact NH2-OD2 2.71Å; R680-D691 PolarHBondContact NH2-OD2 3.42Å
681	V	45.6	Very low	40.8	Very low	127 Å²	127	130 Å²	130	77%	0.77	72%	0.723	S	S	*	*			trans	-134.9	138.3	169.3	-175.8	0	0	0	0	107.4
682	E	40	Very low	41.4	Very low	137 Å²	137	129.4 Å²	129.4	64%	0.64	72%	0.718	S	S	*	*			trans	-112.6	131.9	-179.9	-82.4	158	-153.3	0	0	108.8	V689	E682-V689 HydrophobicContact CG-CG2 3.47Å; E682-V689 VanDerWaalsContact CG-CG2 3.47Å
683	D	43.7	Very low	41.7	Very low	136 Å²	136	125.8 Å²	125.8	73%	0.727	71%	0.707	S	S	*	*			trans	-95.2	130.3	176	-83.4	-42.3	0	0	0	111.1	V685	D683-V685 PolarHBondContact O-N 3.49Å
684	E	48.7	Very low	41.2	Very low	206 Å²	206	127.5 Å²	127.5	96%	0.963	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	11.6	-165.1	-61.2	-169.1	124.3	0	0	116.5
685	V	54.2	Low	41.4	Very low	137 Å²	137	129.3 Å²	129.3	83%	0.83	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.9	-25.4	-171.7	-174	0	0	0	0	113.9	D683	D683-V685 PolarHBondContact O-N 3.49Å
686	T	60.5	Low	41	Very low	118 Å²	118	130.4 Å²	130.4	72%	0.724	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.7	-20	-177.7	49.1	0	0	0	0	116.1	E688	T686-E688 PolarHBondContact O-N 3.29Å
687	G	55	Low	40.9	Very low	65 Å²	65	132.1 Å²	132.1	67%	0.67	70%	0.698	S	S	*	*			trans	68.5	21.8	166.6	0	0	0	0	0	117.1
688	E	46.6	Very low	41	Very low	176 Å²	176	135.2 Å²	135.2	82%	0.822	71%	0.709	S	S	*	*			trans	-112.2	149.6	172	-65.4	-173.1	136.6	0	0	110.5	T686	T686-E688 PolarHBondContact O-N 3.29Å
689	V	46.9	Very low	40.6	Very low	61 Å²	61	133.6 Å²	133.6	37%	0.37	72%	0.719	S	S	.	*			trans	-135.1	120.3	-166.1	-176.6	0	0	0	0	111.6	E682	E682-V689 HydrophobicContact CG-CG2 3.47Å; E682-V689 VanDerWaalsContact CG-CG2 3.47Å
690	D	44.2	Very low	40.3	Very low	157 Å²	157	129.7 Å²	129.7	84%	0.84	71%	0.711	S	S	*	*			trans	-125	130.1	175.6	-91.4	-47.2	0	0	0	112.1
691	D	33.9	Very low	40	Very low	71 Å²	71	130.3 Å²	130.3	38%	0.38	72%	0.72	S	S	.	*			trans	-98.7	125	174.8	-70.7	-38.2	0	0	0	110.7	R680	R680-D691 WeakPolarHBondContact CG-OD1 3.49Å; R680-D691 IonicContact CZ-OD2 3.8Å; R680-D691 IonicContact NE-OD1 3.62Å; R680-D691 PolarHBondContact NE-OD1 3.22Å; R680-D691 IonicContact NE-OD2 2.82Å; R680-D691 PolarHBondContact NE-OD2 2.88Å; R680-D691 IonicContact NH2-OD2 2.71Å; R680-D691 PolarHBondContact NH2-OD2 3.42Å
692	I	42.1	Very low	39.1	Very low	153 Å²	153	131.7 Å²	131.7	79%	0.785	72%	0.718	S	S	*	*			trans	-129.2	126.4	170.7	-58	-176.8	0	0	0	111.6	V694	I692-V694 HydrophobicContact CG2-CG2 4.24Å
693	I	35.6	Very low	38.6	Very low	121 Å²	121	133.4 Å²	133.4	62%	0.621	73%	0.726	S	S	*	*			trans	-128.6	123.2	-178.5	-57.6	168.9	0	0	0	108.9	I678	I678-I693 HydrophobicContact CD1-CD1 3.81Å; I678-I693 HydrophobicContact CG1-CD1 3.97Å
694	V	31.1	Very low	37.8	Very low	130 Å²	130	136.3 Å²	136.3	79%	0.788	74%	0.736	S	S	*	*			trans	-136.4	142.7	172.7	-164.2	0	0	0	0	111	I692	I692-V694 HydrophobicContact CG2-CG2 4.24Å
695	K	32.3	Very low	36.8	Very low	186 Å²	186	130 Å²	130	81%	0.809	73%	0.726	S	S	*	*			trans	-93	-163.6	176.2	-63.1	168.9	-177.4	171.2	0	108.4
696	K	34.4	Very low	35.5	Very low	153 Å²	153	127.4 Å²	127.4	67%	0.665	72%	0.719	S	S	*	*			cis	170.4	143.9	43	-170.7	174.4	-175.7	-89.1	0	108.8
697	E	28.9	Very low	34	Very low	139 Å²	139	130.4 Å²	130.4	65%	0.65	73%	0.727	S	S	*	*			trans	54.2	149.1	161.3	-74.3	142.9	-143.3	0	0	119.3
698	V	32.6	Very low	32.7	Very low	145 Å²	145	135.9 Å²	135.9	88%	0.879	74%	0.735	S	S	*	*			cis	95.5	116	14.6	-177.9	0	0	0	0	116.3
699	G	27.2	Very low	31.8	Very low	74 Å²	74	135.4 Å²	135.4	76%	0.763	73%	0.732	S	S	*	*			trans	123.9	158.1	167.1	0	0	0	0	0	113.2
700	A	27.8	Very low	30.8	Very low	80 Å²	80	137.8 Å²	137.8	66%	0.661	75%	0.747	S	S	*	*			cis	-176.2	142.4	-27.3	0	0	0	0	0	108.1
701	E	29	Very low	30.1	Very low	165 Å²	165	136.1 Å²	136.1	77%	0.771	74%	0.742	S	S	*	*			trans	62.5	161.6	150	-73.9	159.5	-119.4	0	0	117.9
702	Q	26.9	Very low	29.8	Very low	156 Å²	156	139.6 Å²	139.6	73%	0.729	77%	0.765	S	S	*	*			cis	-154.9	175.6	-3.9	-106.5	154.3	44.8	0	0	104.5
703	E	28.8	Very low	29.1	Very low	172 Å²	172	136 Å²	136	80%	0.804	77%	0.766	S	S	*	*			cis	177.8	-174.3	-29.3	-166.9	161.7	-148.3	0	0	105.3
704	E	27.4	Very low	28.6	Very low	198 Å²	198	133.9 Å²	133.9	93%	0.925	77%	0.774	S	S	*	*			trans	69.6	148.5	-178.6	-53.4	-161.8	-170.6	0	0	117.4
705	G	27.4	Very low	28.4	Very low	73 Å²	73	134.6 Å²	134.6	75%	0.753	78%	0.779	S	S	*	*			cis	154.5	157.6	-12.1	0	0	0	0	0	113.2
706	A	27.7	Very low	28.1	Very low	83 Å²	83	135 Å²	135	69%	0.686	78%	0.78	S	S	*	*			cis	-168.1	129.4	-28	0	0	0	0	0	112.2
707	M	28	Very low	27.7	Very low	181 Å²	181	133.3 Å²	133.3	89%	0.892	79%	0.788	S	S	*	*			trans	66.5	168.5	155.5	-55.8	164.4	-161.1	0	0	116.3
708	E	28.2	Very low	27.5	Very low	179 Å²	179	132.2 Å²	132.2	84%	0.836	79%	0.791	S	S	*	*			cis	-150.7	-165.1	12.7	-146.9	-179.4	-171.1	0	0	113.8
709	E	27.3	Very low	27.2	Very low	166 Å²	166	132.8 Å²	132.8	78%	0.776	79%	0.788	S	S	*	*			trans	-77.2	-172.4	-167.5	-78.5	-154.7	162.5	0	0	118
710	V	26.9	Very low	27.1	Very low	111 Å²	111	135.9 Å²	135.9	67%	0.673	78%	0.782	S	S	*	*			cis	-169.8	-168.9	-21.3	148.1	0	0	0	0	107.5
711	V	28.3	Very low	27.2	Very low	123 Å²	123	139.3 Å²	139.3	75%	0.745	79%	0.788	S	S	*	*			trans	110.8	88.8	156.9	-175.9	0	0	0	0	114.6
712	V	28.8	Very low	27.1	Very low	143 Å²	143	139.1 Å²	139.1	87%	0.867	79%	0.788	S	S	*	*				87.6	132.7	92.1	164.7	0	0	0	0	115.4
713	G	26.1	Very low	27.2	Very low	78 Å²	78	139.8 Å²	139.8	80%	0.804	79%	0.791	S	S	*	*			trans	177.7	123.5	164.9	0	0	0	0	0	112.6
714	G	25.9	Very low	27.1	Very low	76 Å²	76	139 Å²	139	78%	0.784	79%	0.791	S	S	*	*			trans	-164.4	154.4	177.5	0	0	0	0	0	111.9
715	V	25.9	Very low	27.1	Very low	146 Å²	146	133.9 Å²	133.9	89%	0.885	78%	0.777	S	S	*	*			trans	-138.1	139.4	-176.3	-156.7	0	0	0	0	110.5
716	K	27	Very low	27.3	Very low	193 Å²	193	139.1 Å²	139.1	84%	0.839	78%	0.782	S	S	*	*			trans	-112.7	149.5	166.6	-77.5	-177.2	174.6	-179.2	0	109.4
717	S	25.7	Very low	27.4	Very low	118 Å²	118	142.5 Å²	142.5	83%	0.825	79%	0.794	S	S	*	*			trans	-137.7	149.4	158	-65.6	0	0	0	0	110.1
718	T	23.8	Very low	27.4	Very low	116 Å²	116	143.2 Å²	143.2	71%	0.712	80%	0.795	S	S	*	*			trans	-154.7	170.2	-174.8	42.8	0	0	0	0	109
719	I	26.8	Very low	27.4	Very low	158 Å²	158	138.8 Å²	138.8	81%	0.81	80%	0.797	S	S	*	*			trans	77.6	141.6	175.3	-47.8	163.3	0	0	0	111.9
720	Q	24.5	Very low	27.5	Very low	138 Å²	138	136 Å²	136	65%	0.645	80%	0.803	S	S	*	*			cis	-135.7	165.1	-12.8	-124.9	-175.8	-89.6	0	0	106.2	E722	Q720-E722 PolarHBondContact NE2-OE1 3.5Å
721	L	31.6	Very low	27.5	Very low	152 Å²	152	136 Å²	136	80%	0.796	81%	0.814	S	S	*	*			cis	86.1	74	5	-142	177.1	0	0	0	118.5
722	E	25.8	Very low	27.5	Very low	162 Å²	162	135 Å²	135	76%	0.757	82%	0.818	S	S	*	*			trans	-151.6	144.1	153.8	-94.9	163.5	-149.3	0	0	104.8	Q720	Q720-E722 PolarHBondContact NE2-OE1 3.5Å
723	E	29.5	Very low	27.5	Very low	170 Å²	170	132.5 Å²	132.5	79%	0.794	81%	0.813	S	S	*	*			cis	119.7	158	14.5	-170.6	159.4	-179.4	0	0	110.9
724	L	26.2	Very low	27.7	Very low	155 Å²	155	137.8 Å²	137.8	81%	0.812	82%	0.817	S	S	*	*			trans	77.9	142.2	-173.9	-49.8	177.6	0	0	0	116.5
725	S	27	Very low	27.8	Very low	90 Å²	90	140.8 Å²	140.8	63%	0.629	82%	0.82	S	S	*	*				166.4	127.3	-51.6	54.2	0	0	0	0	108.6
726	Q	31.6	Very low	28.1	Very low	184 Å²	184	143 Å²	143	86%	0.86	82%	0.821	S	S	*	*			trans	37.2	124	148.5	-62.4	176.4	-14.3	0	0	121
727	V	29.8	Very low	28.2	Very low	153 Å²	153	142.7 Å²	142.7	93%	0.927	82%	0.824	S	S	*	*				-145.4	160.2	124.6	-111.8	0	0	0	0	110.6
728	E	29.3	Very low	28.5	Very low	197 Å²	197	143 Å²	143	92%	0.921	83%	0.826	S	S	*	*			trans	-101.3	168.6	-170.1	-53.1	170.5	116.8	0	0	112.6
729	G	28.5	Very low	28.8	Very low	85 Å²	85	146.5 Å²	146.5	88%	0.876	83%	0.834	S	S	*	*			trans	158.4	120.5	164.8	0	0	0	0	0	113.6
730	A	27.7	Very low	29.2	Very low	109 Å²	109	143.3 Å²	143.3	90%	0.901	83%	0.832	S	S	*	*			trans	-116.3	142.2	-175.9	0	0	0	0	0	113.3
731	A	27.2	Very low	29.7	Very low	109 Å²	109	142.4 Å²	142.4	90%	0.901	84%	0.838	S	S	*	*			trans	-153	165	159.1	0	0	0	0	0	108.6
732	A	28.5	Very low	30.3	Very low	102 Å²	102	140.7 Å²	140.7	84%	0.843	84%	0.836	S	S	*	*			trans	-127.9	171.7	-167.4	0	0	0	0	0	114.1
733	A	29.4	Very low	30.7	Very low	91 Å²	91	140.2 Å²	140.2	75%	0.752	84%	0.838	S	S	*	*			trans	87.6	113.8	167.6	0	0	0	0	0	118.7
734	E	29.3	Very low	31.4	Very low	189 Å²	189	135.7 Å²	135.7	88%	0.883	84%	0.838	S	S	*	*			trans	54.1	116.1	140.9	-54.9	-170.7	159.9	0	0	121.2
735	V	28	Very low	32	Very low	140 Å²	140	135 Å²	135	85%	0.848	84%	0.835	S	S	*	*				-163.4	154.4	95.7	146.2	0	0	0	0	109.2
736	Q	32.8	Very low	33.4	Very low	193 Å²	193	134.8 Å²	134.8	90%	0.902	83%	0.826	S	S	*	*			trans	-85.3	122	-178.8	-65.8	176.4	-11.1	0	0	112.7
737	M	29.3	Very low	35.1	Very low	186 Å²	186	129.2 Å²	129.2	92%	0.916	81%	0.805	S	S	*	*			trans	-141.8	130.8	149.6	-70	-162.6	74.6	0	0	109.1
738	S	32	Very low	36.1	Very low	123 Å²	123	126 Å²	126	86%	0.86	79%	0.787	S	S	*	*			trans	-103.3	111.3	179.1	56.7	0	0	0	0	110.8
739	E	29.5	Very low	37	Very low	190 Å²	190	124 Å²	124	89%	0.888	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-69.4	155.7	171.3	-64.6	-176.2	115.9	0	0	111.8
740	A	35	Very low	38.1	Very low	92 Å²	92	124.3 Å²	124.3	76%	0.76	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-82.6	135.3	-177.8	0	0	0	0	0	112.1
741	P	35.8	Very low	39.8	Very low	119 Å²	119	120.4 Å²	120.4	77%	0.773	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-75.5	132.5	171.7	30.6	-33	0	0	0	110.8	N743	P741-N743 PolarHBondContact O-N 3Å
742	P	43.5	Very low	40.8	Very low	116 Å²	116	119.7 Å²	119.7	75%	0.753	70%	0.702	S	S	*	*			trans	-81.5	112.8	175.5	31	-32.3	0	0	0	111.1
743	N	35.6	Very low	41.8	Very low	151 Å²	151	118.4 Å²	118.4	81%	0.807	69%	0.687	S	S	*	*			trans	-164.4	135.8	150.2	-96.1	-34.7	0	0	0	110.8	P741 D745	P741-N743 PolarHBondContact O-N 3Å; N743-D745 VanDerWaalsContact C-N 3.31Å; N743-D745 PolarHBondContact O-N 3.22Å; N743-D745 VanDerWaalsContact O-N 3.12Å
744	G	43.3	Very low	42.7	Very low	76 Å²	76	120 Å²	120	78%	0.784	68%	0.68	S	S	*	*			trans	-86.4	48	-171.2	0	0	0	0	0	115.1	L746	G744-L746 PolarHBondContact O-N 3.17Å
745	D	38.8	Very low	43.4	Very low	139 Å²	139	112.7 Å²	112.7	74%	0.743	65%	0.646	S	S	*	*			trans	-72.6	97.2	-178.6	-77.4	-28.7	0	0	0	111.8	N743 T747	N743-D745 VanDerWaalsContact C-N 3.31Å; N743-D745 PolarHBondContact O-N 3.22Å; N743-D745 VanDerWaalsContact O-N 3.12Å; D745-T747 PolarHBondContact O-N 3.27Å; D745-T747 VanDerWaalsContact O-N 3.15Å
746	L	56.6	Low	44	Very low	86 Å²	86	112.3 Å²	112.3	45%	0.45	64%	0.639	S	S	.	*			trans	-58.6	115.6	174.9	-75.2	168.4	0	0	0	110.7	G744 M750 I751	G744-L746 PolarHBondContact O-N 3.17Å; L746-M750 HydrophobicContact CD2-CB 4.29Å; L746-M750 HydrophobicContact CD2-CE 3.7Å; L746-M750 HydrophobicContact CD2-SD 4.15Å; L746-I751 HydrophobicContact CB-CD1 4.32Å; L746-I751 HydrophobicContact CB-CG1 4.1Å
747	T	67.8	Low	44.2	Very low	68 Å²	68	116.5 Å²	116.5	42%	0.417	65%	0.647	S	S	.	*			trans	-63	154	-178.9	72.1	0	0	0	0	111.5	D745 E749 M750 I751	D745-T747 PolarHBondContact O-N 3.27Å; D745-T747 VanDerWaalsContact O-N 3.15Å; T747-E749 PolarHBondContact O-N 3.42Å; T747-M750 PolarHBondContact O-N 2.84Å; T747-M750 WeakPolarHBondContact OG1-CG 3.43Å; T747-M750 PolarHBondContact OG1-N 3.37Å; T747-I751 PolarHBondContact O-N 2.94Å
748	P	50.8	Low	45	Very low	84 Å²	84	113 Å²	113	55%	0.545	63%	0.634	S	S	.	*	H	α-helix	trans	-54.8	-28.7	176.4	-27.7	36	0	0	0	113.7	L752	P748-L752 WeakPolarHBondContact O-CB 3.4Å; P748-L752 VanDerWaalsContact O-CG 3.27Å; P748-L752 WeakPolarHBondContact O-CG 3.45Å; P748-L752 PolarHBondContact O-N 3.19Å
749	E	47.8	Very low	45.6	Very low	155 Å²	155	112.5 Å²	112.5	72%	0.724	62%	0.622	S	S	*	*	H	α-helix	trans	-75.7	-38.7	177.5	-56.9	-131	129.9	0	0	112.2	T747 I751 L752 S753	T747-E749 PolarHBondContact O-N 3.42Å; E749-I751 VanDerWaalsContact C-N 3.34Å; E749-L752 PolarHBondContact O-N 3.46Å; E749-S753 WeakPolarHBondContact O-CB 3.36Å; E749-S753 PolarHBondContact O-N 2.92Å
750	M	52.4	Low	46.5	Very low	92 Å²	92	108.2 Å²	108.2	45%	0.453	61%	0.607	S	S	.	*	H	α-helix	trans	-63.2	-41.2	171.2	-69.6	-179.8	75.2	0	0	111.3	L746 T747 L752 S753 M754	L746-M750 HydrophobicContact CD2-CB 4.29Å; L746-M750 HydrophobicContact CD2-CE 3.7Å; L746-M750 HydrophobicContact CD2-SD 4.15Å; T747-M750 PolarHBondContact O-N 2.84Å; T747-M750 WeakPolarHBondContact OG1-CG 3.43Å; T747-M750 PolarHBondContact OG1-N 3.37Å; M750-L752 VanDerWaalsContact C-N 3.35Å; M750-L752 PolarHBondContact O-N 2.8Å; M750-S753 PolarHBondContact O-N 2.92Å; M750-M754 WeakPolarHBondContact O-CB 3.23Å; M750-M754 WeakPolarHBondContact O-CG 3.22Å; M750-M754 PolarHBondContact O-N 3Å
751	I	61.9	Low	47.2	Very low	27 Å²	27	109.1 Å²	109.1	14%	0.138	60%	0.598	C	S	.	*	H	α-helix	trans	-63.3	-40.5	175.2	-66.1	171.1	0	0	0	111.1	Y417 L746 T747 E749 M755	Y417-I751 WeakPolarHBondContact OH-CG2 3.28Å; L746-I751 HydrophobicContact CB-CD1 4.32Å; L746-I751 HydrophobicContact CB-CG1 4.1Å; T747-I751 PolarHBondContact O-N 2.94Å; E749-I751 VanDerWaalsContact C-N 3.34Å; I751-M755 HydrophobicContact CG2-CE 4.07Å; I751-M755 VanDerWaalsContact O-CG 3.25Å; I751-M755 WeakPolarHBondContact O-CG 3.34Å; I751-M755 PolarHBondContact O-N 3.46Å
752	L	49.5	Very low	47.9	Very low	94 Å²	94	108.5 Å²	108.5	49%	0.492	59%	0.587	S	S	.	*	H	α-helix	trans	-67.2	-41.3	175.2	-76.4	166.3	0	0	0	112.2	P748 E749 M750 M755 D756	P748-L752 WeakPolarHBondContact O-CB 3.4Å; P748-L752 VanDerWaalsContact O-CG 3.27Å; P748-L752 WeakPolarHBondContact O-CG 3.45Å; P748-L752 PolarHBondContact O-N 3.19Å; E749-L752 PolarHBondContact O-N 3.46Å; M750-L752 VanDerWaalsContact C-N 3.35Å; M750-L752 PolarHBondContact O-N 2.8Å; L752-M755 PolarHBondContact O-N 3.03Å; L752-M755 VanDerWaalsContact O-N 3.12Å; L752-D756 PolarHBondContact O-N 3.09Å
753	S	48.3	Very low	48.2	Very low	76 Å²	76	108 Å²	108	53%	0.531	58%	0.576	S	S	.	*	H	α-helix	trans	-61.2	-44.9	176	-172.3	0	0	0	0	112.2	E749 M750 M755 D756	E749-S753 WeakPolarHBondContact O-CB 3.36Å; E749-S753 PolarHBondContact O-N 2.92Å; M750-S753 PolarHBondContact O-N 2.92Å; S753-M755 PolarHBondContact O-N 3.46Å; S753-D756 PolarHBondContact O-N 2.99Å
754	M	47.9	Very low	49.1	Very low	125 Å²	125	104.9 Å²	104.9	62%	0.616	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.8	-12.8	174.9	-72.3	-175.5	173.2	0	0	114	M750	M750-M754 WeakPolarHBondContact O-CB 3.23Å; M750-M754 WeakPolarHBondContact O-CG 3.22Å; M750-M754 PolarHBondContact O-N 3Å
755	M	44.9	Very low	49.6	Very low	35 Å²	35	107.2 Å²	107.2	17%	0.172	54%	0.542	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	-2.3	177.3	-77.3	-171.8	177.2	0	0	114.9	Y417 K430 I433 I751 L752 S753	Y417-M755 HydrophobicContact CE1-CE 3.96Å; K430-M755 HydrophobicContact CB-SD 4.38Å; K430-M755 HydrophobicContact CD-SD 3.49Å; K430-M755 WeakPolarHBondContact CD-SD 2.99Å; K430-M755 VanDerWaalsContact CE-SD 3.55Å; K430-M755 HydrophobicContact CG-CE 4.35Å; K430-M755 HydrophobicContact CG-SD 3.59Å; K430-M755 VanDerWaalsContact CG-SD 3.59Å; K430-M755 VanDerWaalsContact NZ-CB 3.31Å; K430-M755 PolarHBondContact NZ-O 3.17Å; I433-M755 HydrophobicContact CB-CE 4.44Å; I433-M755 HydrophobicContact CD1-CE 3.4Å; I433-M755 HydrophobicContact CG1-CE 4.49Å; I433-M755 HydrophobicContact CG2-CE 4.23Å; I751-M755 HydrophobicContact CG2-CE 4.07Å; I751-M755 VanDerWaalsContact O-CG 3.25Å; I751-M755 WeakPolarHBondContact O-CG 3.34Å; I751-M755 PolarHBondContact O-N 3.46Å; L752-M755 PolarHBondContact O-N 3.03Å; L752-M755 VanDerWaalsContact O-N 3.12Å; S753-M755 PolarHBondContact O-N 3.46Å
756	D	40.4	Very low	50.5	Low	131 Å²	131	104.5 Å²	104.5	70%	0.701	53%	0.525	S	S	*	.			trans	-117.2	6.7	178.2	-74.5	9.3	0	0	0	112.1	K430 L752 S753	K430-D756 IonicContact NZ-OD1 2.72Å; K430-D756 PolarHBondContact NZ-OD1 3.47Å; L752-D756 PolarHBondContact O-N 3.09Å; S753-D756 PolarHBondContact O-N 2.99Å
757	R	37.2	Very low	49.9	Very low	281 Å²	281	106.2 Å²	106.2	100%	1.06	53%	0.532	S	S	*	.			trans	-89.9	0	153.8	-86.4	179	154.7	135.4	-7.5	110.4

Retrieved 757 of 757 residues in 245.5 ms (Link to these results)

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