A0A077Z1T5_TRITR Loading...

Transcriptional enhancer factor TEF 1

AlphaFold DB , UniProt , Accession A0A077Z1T5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 528 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	40	Very low	40.1	Very low	245 Å²	245	167.6 Å²	167.6	100%	1.207	87%	0.867	S	S	*	*				0	152.9	0	-73.5	173.1	170.3	0	0	108.2
2	M	34.9	Very low	39.8	Very low	193 Å²	193	167.3 Å²	167.3	95%	0.951	87%	0.868	S	S	*	*			trans	-82.7	169.4	-151.3	-74.1	103.3	158.4	0	0	118.2
3	N	37.5	Very low	40.1	Very low	162 Å²	162	166.8 Å²	166.8	87%	0.866	87%	0.865	S	S	*	*			trans	-77.5	175.8	-179.9	-71.2	-23.5	0	0	0	116
4	A	41.2	Very low	40	Very low	93 Å²	93	162.7 Å²	162.7	77%	0.769	86%	0.857	S	S	*	*			trans	76.2	130.2	150.9	0	0	0	0	0	117.4
5	L	37	Very low	39.7	Very low	169 Å²	169	161.9 Å²	161.9	89%	0.885	85%	0.854	S	S	*	*			cis	80.9	98	41.8	-169.2	92.5	0	0	0	114
6	V	45	Very low	39.7	Very low	145 Å²	145	159.9 Å²	159.9	88%	0.879	85%	0.85	S	S	*	*			trans	-145	146.1	161.7	179.6	0	0	0	0	110.2
7	K	36.1	Very low	39.5	Very low	197 Å²	197	154.4 Å²	154.4	86%	0.857	84%	0.839	S	S	*	*			trans	-118.9	175.2	176.8	-114.7	-160	171	177.3	0	110.1
8	P	42.6	Very low	39.6	Very low	121 Å²	121	157.3 Å²	157.3	79%	0.786	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-102.5	172.4	-138.7	40.3	-35.4	0	0	0	116.4
9	E	45.3	Very low	39.6	Very low	149 Å²	149	154.3 Å²	154.3	70%	0.696	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-97.2	149	-179.8	-171	-176.8	125	0	0	112.6	R11	E9-R11 IonicContact OE1-CZ 3.49Å; E9-R11 IonicContact OE1-NE 2.79Å; E9-R11 PolarHBondContact OE1-NE 3.43Å; E9-R11 IonicContact OE1-NH2 3.68Å; E9-R11 PolarHBondContact OE1-NH2 3.21Å
10	N	36.2	Very low	39.8	Very low	158 Å²	158	155.1 Å²	155.1	85%	0.845	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-102.8	138.3	-178.1	-147.4	6.6	0	0	0	109.6
11	R	45.6	Very low	40.3	Very low	212 Å²	212	152.9 Å²	152.9	80%	0.8	84%	0.835	S	S	*	*			trans	-135.3	132.5	170.4	-71.6	-167.9	-179.3	-169.7	-0.2	112.5	E9	E9-R11 IonicContact OE1-CZ 3.49Å; E9-R11 IonicContact OE1-NE 2.79Å; E9-R11 PolarHBondContact OE1-NE 3.43Å; E9-R11 IonicContact OE1-NH2 3.68Å; E9-R11 PolarHBondContact OE1-NH2 3.21Å
12	N	35.9	Very low	40.3	Very low	163 Å²	163	151.4 Å²	151.4	87%	0.872	82%	0.823	S	S	*	*			trans	-120.8	134.5	-178.7	-160.3	4.7	0	0	0	107.4
13	I	44.2	Very low	40.4	Very low	162 Å²	162	146.8 Å²	146.8	83%	0.831	81%	0.809	S	S	*	*			trans	-132.9	139.4	179.6	-57.9	179.8	0	0	0	108
14	S	38.1	Very low	40.5	Very low	109 Å²	109	146.7 Å²	146.7	76%	0.762	81%	0.808	S	S	*	*			trans	-124.2	159.3	-171.2	54.2	0	0	0	0	113.5
15	N	35.6	Very low	40.6	Very low	151 Å²	151	146.8 Å²	146.8	81%	0.807	81%	0.809	S	S	*	*			trans	99.1	156.8	142.2	-146.6	16	0	0	0	119.8
16	V	40.4	Very low	40.9	Very low	130 Å²	130	144.4 Å²	144.4	79%	0.788	81%	0.806	S	S	*	*			trans	72	126.2	175.9	-157.5	0	0	0	0	115.3
17	G	35.5	Very low	40.6	Very low	65 Å²	65	141.4 Å²	141.4	67%	0.67	81%	0.805	S	S	*	*			cis	126.1	107.1	-9.5	0	0	0	0	0	113.7
18	E	42.6	Very low	40.8	Very low	207 Å²	207	136.2 Å²	136.2	97%	0.967	81%	0.807	S	S	*	*			trans	-161.7	166.5	160.3	-121.2	172.5	169	0	0	112.8
19	S	39	Very low	40.6	Very low	101 Å²	101	136 Å²	136	71%	0.706	81%	0.808	S	S	*	*			trans	-119.9	168.2	-157.5	59.6	0	0	0	0	114.5
20	L	43.4	Very low	40.5	Very low	170 Å²	170	133 Å²	133	89%	0.89	81%	0.809	S	S	*	*				-178.1	146.2	128.7	-93.8	178.8	0	0	0	112.1
21	P	50.4	Low	40.7	Very low	109 Å²	109	134.1 Å²	134.1	71%	0.708	81%	0.809	S	S	*	*			trans	-127.2	165.6	-170.6	42.7	-30	0	0	0	117.3
22	F	40	Very low	40.4	Very low	214 Å²	214	128 Å²	128	94%	0.939	80%	0.803	S	S	*	*			trans	-156.2	104.5	157.9	-108.4	-90.2	0	0	0	107.7
23	S	37.4	Very low	40.5	Very low	96 Å²	96	125.1 Å²	125.1	67%	0.671	80%	0.796	S	S	*	*				83.4	102.5	74.3	-167.7	0	0	0	0	115.6
24	L	40.2	Very low	40.3	Very low	160 Å²	160	122.9 Å²	122.9	84%	0.838	79%	0.79	S	S	*	*				171.9	131.7	123.4	-95.7	161.4	0	0	0	113.9
25	A	41.4	Very low	40.4	Very low	95 Å²	95	123.8 Å²	123.8	79%	0.785	79%	0.791	S	S	*	*			trans	42.9	145.4	152.6	0	0	0	0	0	121.6
26	S	43.7	Very low	40.4	Very low	118 Å²	118	121.7 Å²	121.7	83%	0.825	79%	0.789	S	S	*	*			cis	-164.8	129.4	-10	47.1	0	0	0	0	106.5
27	G	39.7	Very low	40.2	Very low	83 Å²	83	118.8 Å²	118.8	86%	0.856	78%	0.784	S	S	*	*				114.2	143.3	95	0	0	0	0	0	111.9
28	G	38.9	Very low	40.2	Very low	87 Å²	87	120.5 Å²	120.5	90%	0.897	79%	0.792	S	S	*	*			trans	117.3	116.9	175	0	0	0	0	0	114.7
29	S	39	Very low	39.7	Very low	118 Å²	118	115.3 Å²	115.3	83%	0.825	79%	0.785	S	S	*	*			trans	-134.7	140.9	-170.4	173	0	0	0	0	112.7
30	A	42.8	Very low	39.7	Very low	86 Å²	86	117 Å²	117	71%	0.711	79%	0.791	S	S	*	*			trans	166.1	120.9	146.6	0	0	0	0	0	108.7
31	H	40.7	Very low	39.5	Very low	181 Å²	181	113.8 Å²	113.8	84%	0.838	78%	0.782	S	S	*	*				50.7	129.7	87.8	-81.8	-93.6	0	0	0	114
32	A	40.5	Very low	38.5	Very low	83 Å²	83	116.1 Å²	116.1	69%	0.686	79%	0.789	S	S	*	*			cis	-157	161	24.2	0	0	0	0	0	114.8
33	S	38.1	Very low	38.5	Very low	102 Å²	102	111.9 Å²	111.9	71%	0.713	78%	0.783	S	S	*	*			trans	-0.1	156.6	138.6	4.9	0	0	0	0	119.9
34	T	38.4	Very low	38.3	Very low	115 Å²	115	116.7 Å²	116.7	71%	0.706	79%	0.792	S	S	*	*			cis	-171.3	167.2	15.9	-95.1	0	0	0	0	109.8
35	T	40	Very low	38.1	Very low	128 Å²	128	117.3 Å²	117.3	79%	0.785	79%	0.79	S	S	*	*			trans	63.8	161.7	162.5	41.2	0	0	0	0	118.8
36	S	37.4	Very low	37.6	Very low	108 Å²	108	119.9 Å²	119.9	76%	0.755	79%	0.79	S	S	*	*			cis	177.3	148.8	-36.1	56.8	0	0	0	0	108.4
37	G	35.5	Very low	37.2	Very low	68 Å²	68	118.2 Å²	118.2	70%	0.701	78%	0.783	S	S	*	*			trans	131.5	113.2	170.2	0	0	0	0	0	112.8
38	A	35.7	Very low	36.6	Very low	101 Å²	101	118.8 Å²	118.8	84%	0.835	78%	0.78	S	S	*	*				71.5	88.6	103.2	0	0	0	0	0	112.2
39	A	32.6	Very low	36.2	Very low	98 Å²	98	119.5 Å²	119.5	81%	0.81	78%	0.777	S	S	*	*				70.8	118.6	84	0	0	0	0	0	113.7
40	V	37.5	Very low	35.9	Very low	137 Å²	137	122.9 Å²	122.9	83%	0.83	78%	0.78	S	S	*	*			trans	-179.1	133.9	143.7	140.6	0	0	0	0	111.7
41	S	39.2	Very low	35.4	Very low	102 Å²	102	123.3 Å²	123.3	71%	0.713	78%	0.778	S	S	*	*			trans	54.6	115.6	157.8	66.7	0	0	0	0	123.4
42	D	29.1	Very low	35.2	Very low	159 Å²	159	120.1 Å²	120.1	85%	0.85	78%	0.776	S	S	*	*			trans	-61.2	161.2	137.7	-72.3	-57.5	0	0	0	111.2
43	P	41.2	Very low	34.9	Very low	124 Å²	124	122.6 Å²	122.6	81%	0.805	78%	0.777	S	S	*	*				-142.8	158.7	107.5	37.2	-24.2	0	0	0	116.5
44	K	33	Very low	34.8	Very low	198 Å²	198	127.4 Å²	127.4	86%	0.861	78%	0.78	S	S	*	*			trans	-67	132.2	178.3	-61.2	161.4	176.4	171.6	0	113.7
45	H	34.7	Very low	34.6	Very low	173 Å²	173	127.1 Å²	127.1	80%	0.801	78%	0.783	S	S	*	*			trans	-173.1	147.2	150	-112.9	-149	0	0	0	107.9
46	L	32.9	Very low	34.2	Very low	149 Å²	149	125 Å²	125	78%	0.78	78%	0.779	S	S	*	*			cis	-129.3	179.5	2.1	-92.7	113.9	0	0	0	111.9
47	A	33.3	Very low	34.1	Very low	83 Å²	83	125.1 Å²	125.1	69%	0.686	78%	0.779	S	S	*	*			trans	-46.2	150.8	155.8	0	0	0	0	0	114.1
48	A	28.4	Very low	33.8	Very low	95 Å²	95	130.6 Å²	130.6	79%	0.785	79%	0.786	S	S	*	*			cis	77.3	133	41	0	0	0	0	0	114.5
49	A	29.8	Very low	33.8	Very low	101 Å²	101	131 Å²	131	84%	0.835	78%	0.783	S	S	*	*			trans	69.2	151.5	-171.4	0	0	0	0	0	114.3
50	E	33.6	Very low	33.8	Very low	189 Å²	189	132 Å²	132	88%	0.883	78%	0.784	S	S	*	*			cis	-133.1	165.8	15.6	-73.2	173.5	99.1	0	0	114
51	S	32.3	Very low	33.9	Very low	96 Å²	96	131 Å²	131	67%	0.671	78%	0.78	S	S	*	*			trans	-75.3	137.2	-179.2	43.3	0	0	0	0	114.3	D53	S51-D53 PolarHBondContact O-N 3.14Å; S51-D53 VanDerWaalsContact O-N 3.08Å
52	S	36.4	Very low	33.4	Very low	114 Å²	114	134.1 Å²	134.1	80%	0.797	79%	0.788	S	S	*	*			trans	-78.5	83.5	165.9	-47.6	0	0	0	0	110.7	W54	S52-W54 PolarHBondContact O-N 3.25Å
53	D	34.2	Very low	33.7	Very low	135 Å²	135	132.3 Å²	132.3	72%	0.722	79%	0.788	S	S	*	*			trans	-69.1	125.4	-172.8	-127.1	-17.5	0	0	0	113	S51 S55	S51-D53 PolarHBondContact O-N 3.14Å; S51-D53 VanDerWaalsContact O-N 3.08Å; D53-S55 PolarHBondContact O-N 2.85Å; D53-S55 VanDerWaalsContact O-N 3.09Å
54	W	34.9	Very low	33.3	Very low	202 Å²	202	133.6 Å²	133.6	77%	0.765	79%	0.788	S	S	*	*			trans	-82.3	87.8	-179.5	-74	12.3	0	0	0	111	S52 A56 C460	S52-W54 PolarHBondContact O-N 3.25Å; W54-A56 PolarHBondContact O-N 2.85Å; W54-A56 VanDerWaalsContact O-N 3.15Å; W54-C460 HydrophobicContact CH2-CB 4.37Å
55	S	35.1	Very low	33	Very low	109 Å²	109	130.3 Å²	130.3	76%	0.762	79%	0.788	S	S	*	*			trans	-77.7	97.8	-179.6	-70.3	0	0	0	0	113.1	D53 S57	D53-S55 PolarHBondContact O-N 2.85Å; D53-S55 VanDerWaalsContact O-N 3.09Å; S55-S57 PolarHBondContact O-N 2.82Å; S55-S57 VanDerWaalsContact O-N 3.12Å
56	A	30.6	Very low	33.3	Very low	85 Å²	85	127.6 Å²	127.6	70%	0.702	79%	0.789	S	S	*	*			trans	-76.8	87.5	169.1	0	0	0	0	0	111.1	W54 H58	W54-A56 PolarHBondContact O-N 2.85Å; W54-A56 VanDerWaalsContact O-N 3.15Å; A56-H58 PolarHBondContact O-N 2.79Å
57	S	35.4	Very low	33.3	Very low	110 Å²	110	130 Å²	130	77%	0.769	80%	0.796	S	S	*	*			trans	-74.3	83.6	-177.9	51.2	0	0	0	0	113.5	S55 S59	S55-S57 PolarHBondContact O-N 2.82Å; S55-S57 VanDerWaalsContact O-N 3.12Å; S57-S59 PolarHBondContact O-N 3Å
58	H	29.8	Very low	33.3	Very low	183 Å²	183	130 Å²	130	85%	0.847	80%	0.804	S	S	*	*			trans	-73	106.2	163.1	-81.9	-92.9	0	0	0	110.3	A56	A56-H58 PolarHBondContact O-N 2.79Å
59	S	35.8	Very low	33.7	Very low	110 Å²	110	131.6 Å²	131.6	77%	0.769	81%	0.809	S	S	*	*			trans	-142	104	173.6	-67.5	0	0	0	0	112.3	S57	S57-S59 PolarHBondContact O-N 3Å
60	S	33.6	Very low	34.1	Very low	119 Å²	119	131.5 Å²	131.5	83%	0.832	81%	0.809	S	S	*	*			trans	-160.4	134.5	161.6	-72.7	0	0	0	0	105.9
61	P	37.6	Very low	34.2	Very low	115 Å²	115	126.1 Å²	126.1	75%	0.747	80%	0.804	S	S	*	*				-150.9	156.3	100.4	35.9	-17.8	0	0	0	117.1
62	L	29.4	Very low	34.4	Very low	168 Å²	168	127.5 Å²	127.5	88%	0.88	81%	0.814	S	S	*	*			trans	58.4	110.1	140.9	-64.5	165.6	0	0	0	121.5
63	S	36.4	Very low	34.5	Very low	120 Å²	120	127.1 Å²	127.1	84%	0.839	82%	0.817	S	S	*	*				-160.5	101.2	130	43.6	0	0	0	0	108.9
64	N	31.9	Very low	34.6	Very low	152 Å²	152	124.9 Å²	124.9	81%	0.813	83%	0.826	S	S	*	*				83.4	106.4	90.6	-156	42.6	0	0	0	113.4
65	C	27.7	Very low	34.5	Very low	128 Å²	128	118.8 Å²	118.8	87%	0.865	83%	0.826	S	S	*	*			trans	-95	141.6	176	-71.4	0	0	0	0	111.5
66	S	39.7	Very low	35.3	Very low	117 Å²	117	119.5 Å²	119.5	82%	0.818	83%	0.828	S	S	*	*			trans	-111.1	142.3	166.6	-60.8	0	0	0	0	110.2
67	Q	33.6	Very low	35.9	Very low	200 Å²	200	121 Å²	121	94%	0.935	83%	0.831	S	S	*	*			trans	-84.6	155.6	-172	-61.8	172.5	-0.5	0	0	113.2
68	G	34.1	Very low	35.9	Very low	83 Å²	83	122 Å²	122	86%	0.856	83%	0.832	S	S	*	*			trans	-150.9	134.8	163.9	0	0	0	0	0	109
69	S	36.4	Very low	36.5	Very low	127 Å²	127	120.9 Å²	120.9	89%	0.888	83%	0.831	S	S	*	*			trans	-130.9	164	-159.9	-171	0	0	0	0	113.6
70	A	37.2	Very low	36.6	Very low	100 Å²	100	122.7 Å²	122.7	83%	0.826	83%	0.832	S	S	*	*			trans	121.3	142.7	145.1	0	0	0	0	0	119.4
71	G	35.2	Very low	36.6	Very low	75 Å²	75	120.1 Å²	120.1	77%	0.773	82%	0.824	S	S	*	*			trans	90.6	101.9	165	0	0	0	0	0	115.7
72	S	37.2	Very low	36.9	Very low	126 Å²	126	123.1 Å²	123.1	88%	0.881	83%	0.834	S	S	*	*			cis	88.3	110.9	25.2	-160.8	0	0	0	0	116.3
73	A	38.8	Very low	37.2	Very low	105 Å²	105	126.3 Å²	126.3	87%	0.868	83%	0.834	S	S	*	*			trans	153.9	143.4	133.3	0	0	0	0	0	114.2
74	G	36.3	Very low	37.5	Very low	88 Å²	88	129.4 Å²	129.4	91%	0.907	84%	0.835	S	S	*	*			trans	121.4	110.2	158.2	0	0	0	0	0	117.4
75	G	32.6	Very low	37.7	Very low	74 Å²	74	126.9 Å²	126.9	76%	0.763	83%	0.827	S	S	*	*			trans	-122.5	173.6	174.9	0	0	0	0	0	114.4
76	P	53.2	Low	38.3	Very low	125 Å²	125	128.5 Å²	128.5	81%	0.812	83%	0.827	S	S	*	*			trans	-99.4	177.9	-170.3	40.8	-37	0	0	0	114.1
77	P	43.2	Very low	38.5	Very low	116 Å²	116	129 Å²	129	75%	0.753	83%	0.827	S	S	*	*				-156.4	156.8	105.5	37.8	-18.1	0	0	0	119.9
78	T	34.7	Very low	38.5	Very low	130 Å²	130	125 Å²	125	80%	0.798	82%	0.821	S	S	*	*			trans	41.3	129.5	135.6	-45.8	0	0	0	0	124.9
79	I	41.8	Very low	38.9	Very low	161 Å²	161	128.2 Å²	128.2	83%	0.826	82%	0.824	S	S	*	*			trans	-155.6	162.5	133.5	-123.9	164.6	0	0	0	115.3
80	N	38	Very low	38.9	Very low	148 Å²	148	128.8 Å²	128.8	79%	0.791	82%	0.817	S	S	*	*			trans	-58.9	169.8	-174.7	-59.3	-30.1	0	0	0	116.4
81	G	34.6	Very low	39.1	Very low	65 Å²	65	131.2 Å²	131.2	67%	0.67	82%	0.816	S	S	*	*			cis	168.7	-158.7	0.9	0	0	0	0	0	113.3
82	N	43.3	Very low	39.2	Very low	177 Å²	177	130.7 Å²	130.7	95%	0.947	81%	0.811	S	S	*	*			trans	95.1	141.4	172.2	-61.2	-1.1	0	0	0	119.5
83	R	35.4	Very low	39.3	Very low	235 Å²	235	132.8 Å²	132.8	89%	0.887	81%	0.812	S	S	*	*			trans	-152.4	134.5	-162.7	172	-166.8	-170.6	-169.5	4.1	107.8
84	E	42.3	Very low	39.6	Very low	186 Å²	186	133.1 Å²	133.1	87%	0.869	81%	0.809	S	S	*	*			trans	-148.7	132.6	174.7	-97.1	-76.6	90.6	0	0	109.3
85	P	37.4	Very low	39.8	Very low	99 Å²	99	135 Å²	135	64%	0.643	80%	0.802	S	S	*	*			trans	-120.1	141.5	179.3	38	-26.3	0	0	0	115.8
86	L	40.1	Very low	40.4	Very low	162 Å²	162	138.5 Å²	138.5	85%	0.848	81%	0.808	S	S	*	*			trans	22.1	145.8	149.6	-69.5	164.8	0	0	0	122
87	P	43.6	Very low	39.8	Very low	128 Å²	128	137.1 Å²	137.1	83%	0.831	81%	0.808	S	S	*	*				-134.1	163.9	123.8	37.7	-27.6	0	0	0	115.6
88	S	32.4	Very low	39.6	Very low	116 Å²	116	136 Å²	136	81%	0.811	81%	0.808	S	S	*	*			trans	-94.2	161.8	-176.4	-47.8	0	0	0	0	113.7
89	T	43.8	Very low	40.1	Very low	149 Å²	149	137.3 Å²	137.3	91%	0.914	81%	0.81	S	S	*	*			trans	-138.3	150.6	161.9	-53.7	0	0	0	0	110.8
90	N	36.5	Very low	40.2	Very low	140 Å²	140	134.3 Å²	134.3	75%	0.749	80%	0.804	S	S	*	*			trans	-121	180	-164.9	-170.8	24	0	0	0	112.7
91	N	40.8	Very low	40.9	Very low	150 Å²	150	133.6 Å²	133.6	80%	0.802	80%	0.804	S	S	*	*			trans	89.9	144	175.4	-53.7	-9.3	0	0	0	115.4
92	G	37.2	Very low	41.1	Very low	64 Å²	64	135.1 Å²	135.1	66%	0.66	80%	0.804	S	S	*	*			cis	160.3	152.3	-5.6	0	0	0	0	0	112.7
93	N	39.8	Very low	40.6	Very low	170 Å²	170	133.1 Å²	133.1	91%	0.909	80%	0.801	S	S	*	*			trans	69.6	153.4	177.1	-56.7	3.4	0	0	0	116
94	S	43.8	Very low	40.9	Very low	113 Å²	113	126.6 Å²	126.6	79%	0.79	80%	0.798	S	S	*	*			cis	-147.4	164	8.3	-163	0	0	0	0	113.2
95	V	40.8	Very low	40.7	Very low	127 Å²	127	121.8 Å²	121.8	77%	0.77	79%	0.789	S	S	*	*			trans	-69.5	148.6	178.1	-82.1	0	0	0	0	115.7
96	V	45.3	Very low	40.7	Very low	148 Å²	148	123.8 Å²	123.8	90%	0.897	80%	0.8	S	S	*	*				-165.9	151.8	118.6	-94.3	0	0	0	0	113.5
97	A	40.7	Very low	40.7	Very low	96 Å²	96	124.2 Å²	124.2	79%	0.793	80%	0.803	S	S	*	*			trans	-56.4	174	173.3	0	0	0	0	0	115.8
98	A	39.9	Very low	40.6	Very low	92 Å²	92	122.2 Å²	122.2	76%	0.76	80%	0.797	S	S	*	*			cis	-176	141.6	-27	0	0	0	0	0	107.8
99	D	44.5	Very low	41.3	Very low	157 Å²	157	123.4 Å²	123.4	84%	0.84	79%	0.79	S	S	*	*			trans	-165.7	169.5	132.3	-142.1	-29	0	0	0	111
100	S	43.9	Very low	42.3	Very low	99 Å²	99	118.4 Å²	118.4	69%	0.692	77%	0.768	S	S	*	*			trans	-82.2	143.3	-165.5	49.7	0	0	0	0	115
101	V	52.3	Low	44.1	Very low	133 Å²	133	115.5 Å²	115.5	81%	0.806	76%	0.755	S	S	*	*			trans	177	116	137.3	150.6	0	0	0	0	110.3
102	S	40.1	Very low	46.2	Very low	96 Å²	96	111.4 Å²	111.4	67%	0.671	73%	0.728	S	S	*	*			trans	46.9	111	163.2	58.7	0	0	0	0	121.4
103	P	33.2	Very low	48.6	Very low	136 Å²	136	108.7 Å²	108.7	88%	0.883	70%	0.699	S	S	*	*			trans	-92.4	97.9	168.8	34.6	-28.9	0	0	0	112
104	A	40	Very low	50.8	Low	98 Å²	98	105.8 Å²	105.8	81%	0.81	69%	0.69	S	S	*	*			trans	-153.1	8.3	-177.9	0	0	0	0	0	117.8
105	A	39.7	Very low	53	Low	84 Å²	84	103.1 Å²	103.1	69%	0.694	67%	0.667	S	S	*	*			trans	-136	10.7	-166.5	0	0	0	0	0	116.9	D107	A105-D107 PolarHBondContact O-N 2.9Å
106	T	35.9	Very low	55.4	Low	142 Å²	142	97.1 Å²	97.1	87%	0.871	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.2	10.6	-169.1	42.1	0	0	0	0	116.7
107	D	40.1	Very low	57.5	Low	171 Å²	171	91.8 Å²	91.8	91%	0.914	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.2	8.1	176.8	-81.7	-47.5	0	0	0	114.2	A105	A105-D107 PolarHBondContact O-N 2.9Å
108	A	43	Very low	59.9	Low	85 Å²	85	92.7 Å²	92.7	70%	0.702	58%	0.583	S	S	*	*			trans	-102.8	4.4	-166.5	0	0	0	0	0	116.8	G110	A108-G110 PolarHBondContact O-N 3.17Å
109	E	47	Very low	62.3	Low	142 Å²	142	88.5 Å²	88.5	66%	0.664	55%	0.549	S	S	*	.			trans	-75.8	66.6	170	-89	-127.2	113	0	0	111.5	S113 K160	E109-S113 PolarHBondContact OE1-OG 2.98Å; E109-K160 IonicContact OE1-NZ 2.82Å; E109-K160 PolarHBondContact OE1-NZ 2.77Å
110	G	65	Low	64.6	Low	43 Å²	43	81 Å²	81	44%	0.443	51%	0.509	S	S	.	.			trans	-59.8	157.2	166.8	0	0	0	0	0	111.6	A108 W112 S113	A108-G110 PolarHBondContact O-N 3.17Å; G110-W112 CarbonylContact O-C 3.59Å; G110-W112 PolarHBondContact O-N 3.01Å; G110-S113 PolarHBondContact O-N 3.15Å; G110-S113 VanDerWaalsContact O-N 3.14Å; G110-S113 PolarHBondContact O-OG 2.93Å
111	V	73.9	Confident	66.7	Low	79 Å²	79	81.7 Å²	81.7	48%	0.479	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-22	-176.8	179.4	0	0	0	0	113.5	R162	V111-R162 VanDerWaalsContact O-CZ 3.22Å; V111-R162 PolarHBondContact O-NE 3.4Å; V111-R162 PolarHBondContact O-NH2 2.72Å
112	W	84.2	Confident	68.5	Low	64 Å²	64	77.4 Å²	77.4	24%	0.242	47%	0.472	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.8	67.8	173.8	-62.7	97.9	0	0	0	111.3	G110 I116 F120 I154 Q166 V167 H170	G110-W112 CarbonylContact O-C 3.59Å; G110-W112 PolarHBondContact O-N 3.01Å; W112-I116 HydrophobicContact CE3-CG2 3.64Å; W112-I116 HydrophobicContact CZ3-CG2 3.74Å; W112-F120 HydrophobicContact CH2-CD2 4.14Å; W112-F120 HydrophobicContact CZ3-CB 4Å; W112-F120 AromaticContact CZ3-CD2 3.98Å; W112-F120 HydrophobicContact CZ3-CD2 3.98Å; W112-F120 HydrophobicContact CZ3-CG 4Å; W112-I154 HydrophobicContact CZ3-CD1 4.26Å; W112-Q166 HydrophobicContact CZ2-CB 4.21Å; W112-V167 HydrophobicContact CH2-CG2 4.49Å; W112-H170 AromaticContact CD2-CD2 3.7Å; W112-H170 AromaticContact CD2-CG 3.99Å; W112-H170 AromaticContact CD2-NE2 3.78Å; W112-H170 AromaticContact CE2-CD2 3.73Å; W112-H170 AromaticContact CE2-CG 3.59Å; W112-H170 AromaticContact CE2-ND1 4Å; W112-H170 AromaticContact CE3-CD2 3.7Å; W112-H170 AromaticContact CE3-NE2 3.88Å; W112-H170 HydrophobicContact CH2-CB 4.01Å; W112-H170 AromaticContact CH2-CD2 3.87Å; W112-H170 HydrophobicContact CZ2-CB 3.44Å; W112-H170 VanDerWaalsContact CZ2-CB 3.44Å; W112-H170 AromaticContact CZ2-CD2 3.85Å; W112-H170 AromaticContact CZ2-CG 3.73Å; W112-H170 AromaticContact CZ3-CD2 3.79Å; W112-H170 AromaticContact NE1-CG 3.87Å; W112-H170 AromaticContact NE1-ND1 3.84Å
113	S	87.7	Confident	70.9	Confident	7 Å²	7	72.9 Å²	72.9	5%	0.049	44%	0.44	C	S	.	.			trans	-54.1	150.6	167.2	-53.1	0	0	0	0	111.1	E109 G110 D115 I116 E117	E109-S113 PolarHBondContact OE1-OG 2.98Å; G110-S113 PolarHBondContact O-N 3.15Å; G110-S113 VanDerWaalsContact O-N 3.14Å; G110-S113 PolarHBondContact O-OG 2.93Å; S113-D115 VanDerWaalsContact C-N 3.3Å; S113-D115 VanDerWaalsContact C-OD1 3.3Å; S113-D115 WeakPolarHBondContact CB-OD1 3.47Å; S113-D115 PolarHBondContact O-N 2.96Å; S113-I116 WeakPolarHBondContact O-CA 3.3Å; S113-I116 WeakPolarHBondContact O-CB 2.89Å; S113-I116 PolarHBondContact O-N 3.38Å; S113-E117 PolarHBondContact O-N 3.04Å
114	P	86.8	Confident	73.4	Confident	110 Å²	110	68.9 Å²	68.9	71%	0.714	41%	0.411	S	S	*	.	H	α-helix	trans	-58.3	-34.3	-171.8	-27.4	35.9	0	0	0	115.4	I116 E117 Q118	P114-I116 VanDerWaalsContact C-N 3.34Å; P114-E117 PolarHBondContact O-N 2.79Å; P114-Q118 WeakPolarHBondContact O-CB 3.49Å; P114-Q118 PolarHBondContact O-N 3.13Å
115	D	88.6	Confident	75.4	Confident	57 Å²	57	67.7 Å²	67.7	31%	0.305	40%	0.402	S	S	.	.	H	α-helix	trans	-60.1	-40.5	172.6	56.5	-36.8	0	0	0	112.7	S113 S119 T158 K160	S113-D115 VanDerWaalsContact C-N 3.3Å; S113-D115 VanDerWaalsContact C-OD1 3.3Å; S113-D115 WeakPolarHBondContact CB-OD1 3.47Å; S113-D115 PolarHBondContact O-N 2.96Å; D115-S119 WeakPolarHBondContact O-CB 3.16Å; D115-S119 PolarHBondContact O-N 2.93Å; D115-S119 VanDerWaalsContact O-N 3.13Å; D115-S119 PolarHBondContact O-OG 3.41Å; D115-T158 HydrophobicContact CB-CG2 4.48Å; D115-T158 WeakPolarHBondContact O-CG2 3.2Å; D115-K160 IonicContact OD1-NZ 2.71Å; D115-K160 VanDerWaalsContact OD2-CE 3.3Å; D115-K160 WeakPolarHBondContact OD2-CE 3.41Å; D115-K160 IonicContact OD2-NZ 3.77Å; D115-K160 PolarHBondContact OD2-NZ 2.78Å
116	I	91.3	Very high	77.5	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-74.4	-40.7	177.7	-60	170.7	0	0	0	110.4	W112 S113 P114 S119 F120 I154 T158 K160 R162	W112-I116 HydrophobicContact CE3-CG2 3.64Å; W112-I116 HydrophobicContact CZ3-CG2 3.74Å; S113-I116 WeakPolarHBondContact O-CA 3.3Å; S113-I116 WeakPolarHBondContact O-CB 2.89Å; S113-I116 PolarHBondContact O-N 3.38Å; P114-I116 VanDerWaalsContact C-N 3.34Å; I116-S119 PolarHBondContact O-N 3.4Å; I116-F120 VanDerWaalsContact O-CB 3.23Å; I116-F120 WeakPolarHBondContact O-CB 3.44Å; I116-F120 PolarHBondContact O-N 2.94Å; I116-I154 HydrophobicContact CG2-CG2 3.86Å; I116-T158 HydrophobicContact CG1-CG2 4.27Å; I116-K160 HydrophobicContact CD1-CB 3.97Å; I116-K160 HydrophobicContact CD1-CD 3.54Å; I116-K160 HydrophobicContact CD1-CG 4.38Å; I116-K160 HydrophobicContact CG1-CB 4.33Å; I116-K160 HydrophobicContact CG1-CD 3.95Å; I116-R162 VanDerWaalsContact CD1-CZ 3.45Å; I116-R162 HydrophobicContact CG2-CG 3.95Å
117	E	89.9	Confident	79.7	Confident	37 Å²	37	61.8 Å²	61.8	17%	0.173	35%	0.348	C	S	.	.	H	α-helix	trans	-63.4	-44.5	177.3	-175.3	59.1	-148.2	0	0	111.4	S113 P114 F120 Q121 H170	S113-E117 PolarHBondContact O-N 3.04Å; P114-E117 PolarHBondContact O-N 2.79Å; E117-F120 PolarHBondContact O-N 2.83Å; E117-Q121 WeakPolarHBondContact O-CG 3.44Å; E117-Q121 PolarHBondContact O-N 3.38Å; E117-Q121 PolarHBondContact OE1-NE2 2.9Å; E117-H170 IonicContact OE1-NE2 3.35Å; E117-H170 IonicContact OE2-CD2 2.79Å; E117-H170 IonicContact OE2-CE1 3.52Å; E117-H170 IonicContact OE2-NE2 3.04Å; E117-H170 PolarHBondContact OE2-NE2 2.93Å
118	Q	90	Very high	81.3	Confident	114 Å²	114	56.9 Å²	56.9	53%	0.533	33%	0.326	S	S	.	.	H	α-helix	trans	-58.4	-51.9	172.7	180	-178.4	-16.1	0	0	111.2	P114 F120 Q121 E122	P114-Q118 WeakPolarHBondContact O-CB 3.49Å; P114-Q118 PolarHBondContact O-N 3.13Å; Q118-F120 PolarHBondContact O-N 2.83Å; Q118-Q121 PolarHBondContact O-N 2.78Å; Q118-Q121 VanDerWaalsContact O-N 3.09Å; Q118-E122 PolarHBondContact NE2-OE1 3.02Å; Q118-E122 VanDerWaalsContact NE2-OE1 3.15Å; Q118-E122 WeakPolarHBondContact O-CG 3.42Å; Q118-E122 PolarHBondContact O-N 2.96Å
119	S	90.6	Very high	82.5	Confident	5 Å²	5	58.3 Å²	58.3	4%	0.035	33%	0.328	C	S	.	.	H	α-helix	trans	-61.9	-31.1	179.9	-59.5	0	0	0	0	112.7	D115 I116 A123 Y153 T158	D115-S119 WeakPolarHBondContact O-CB 3.16Å; D115-S119 PolarHBondContact O-N 2.93Å; D115-S119 VanDerWaalsContact O-N 3.13Å; D115-S119 PolarHBondContact O-OG 3.41Å; I116-S119 PolarHBondContact O-N 3.4Å; S119-A123 VanDerWaalsContact O-CB 3.28Å; S119-A123 WeakPolarHBondContact O-CB 3.41Å; S119-A123 PolarHBondContact O-N 2.7Å; S119-Y153 WeakPolarHBondContact O-CD1 3.5Å; S119-Y153 WeakPolarHBondContact O-CE1 3.49Å; S119-T158 WeakPolarHBondContact OG-CG2 3.49Å
120	F	92.5	Very high	83.1	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-71.2	-41.5	173.4	169.7	-95.6	0	0	0	112.2	W112 I116 E117 Q118 A123 L124 I150 I154 V167 H170 I171 L174	W112-F120 HydrophobicContact CH2-CD2 4.14Å; W112-F120 HydrophobicContact CZ3-CB 4Å; W112-F120 AromaticContact CZ3-CD2 3.98Å; W112-F120 HydrophobicContact CZ3-CD2 3.98Å; W112-F120 HydrophobicContact CZ3-CG 4Å; I116-F120 VanDerWaalsContact O-CB 3.23Å; I116-F120 WeakPolarHBondContact O-CB 3.44Å; I116-F120 PolarHBondContact O-N 2.94Å; E117-F120 PolarHBondContact O-N 2.83Å; Q118-F120 PolarHBondContact O-N 2.83Å; F120-A123 PolarHBondContact O-N 2.69Å; F120-L124 HydrophobicContact CD1-CD1 4.08Å; F120-L124 HydrophobicContact CD1-CG 4.47Å; F120-L124 HydrophobicContact CE1-CD1 3.46Å; F120-L124 VanDerWaalsContact CE1-CD1 3.46Å; F120-L124 HydrophobicContact CE1-CG 4.09Å; F120-L124 HydrophobicContact CE2-CD2 4.45Å; F120-L124 HydrophobicContact CE2-CG 4.46Å; F120-L124 HydrophobicContact CZ-CD1 3.77Å; F120-L124 HydrophobicContact CZ-CD2 4.18Å; F120-L124 HydrophobicContact CZ-CG 4.09Å; F120-L124 WeakPolarHBondContact O-CG 3.23Å; F120-L124 PolarHBondContact O-N 3.34Å; F120-I150 HydrophobicContact CD2-CG2 3.82Å; F120-I150 HydrophobicContact CE2-CG2 4.26Å; F120-I154 HydrophobicContact CB-CD1 3.92Å; F120-I154 HydrophobicContact CB-CG1 4.39Å; F120-I154 HydrophobicContact CD2-CD1 4.12Å; F120-V167 HydrophobicContact CE2-CG1 4.2Å; F120-H170 AromaticContact CD1-CD2 3.75Å; F120-H170 AromaticContact CE1-CD2 3.44Å; F120-H170 VanDerWaalsContact CE1-CD2 3.44Å; F120-H170 WeakPolarHBondContact CE1-CD2 3.35Å; F120-H170 HydrophobicContact CZ-CB 4.43Å; F120-H170 AromaticContact CZ-CD2 3.59Å; F120-I171 HydrophobicContact CE2-CG1 4.03Å; F120-I171 HydrophobicContact CZ-CG1 3.76Å; F120-L174 HydrophobicContact CE1-CD1 3.59Å; F120-L174 HydrophobicContact CZ-CD1 4.08Å
121	Q	89.8	Confident	83	Confident	113 Å²	113	55.9 Å²	55.9	53%	0.528	33%	0.331	S	S	.	.	H	α-helix	trans	-66	-42.2	177.2	-72	175.9	21.9	0	0	112.1	E117 Q118 L124 A125	E117-Q121 WeakPolarHBondContact O-CG 3.44Å; E117-Q121 PolarHBondContact O-N 3.38Å; E117-Q121 PolarHBondContact OE1-NE2 2.9Å; Q118-Q121 PolarHBondContact O-N 2.78Å; Q118-Q121 VanDerWaalsContact O-N 3.09Å; Q121-L124 WeakPolarHBondContact O-CB 3.35Å; Q121-L124 PolarHBondContact O-N 3.47Å; Q121-A125 PolarHBondContact O-N 3.43Å
122	E	88.9	Confident	81.8	Confident	43 Å²	43	64.3 Å²	64.3	20%	0.201	35%	0.354	C	S	.	.	H	α-helix	trans	-59.7	-46.4	170.7	-66.9	172.7	-175.8	0	0	111.5	Q118 L124 A125 I126 Y153 R157	Q118-E122 PolarHBondContact NE2-OE1 3.02Å; Q118-E122 VanDerWaalsContact NE2-OE1 3.15Å; Q118-E122 WeakPolarHBondContact O-CG 3.42Å; Q118-E122 PolarHBondContact O-N 2.96Å; E122-L124 PolarHBondContact O-N 2.98Å; E122-A125 WeakPolarHBondContact O-CB 3.44Å; E122-A125 PolarHBondContact O-N 3.07Å; E122-I126 WeakPolarHBondContact O-CG1 3.15Å; E122-I126 PolarHBondContact O-N 3.09Å; E122-Y153 HydrophobicContact CB-CE1 4.05Å; E122-Y153 PolarHBondContact OE2-OH 2.93Å; E122-R157 VanDerWaalsContact CD-CZ 3.45Å; E122-R157 IonicContact OE1-CZ 3.57Å; E122-R157 IonicContact OE1-NE 3.99Å; E122-R157 IonicContact OE1-NH2 3.39Å; E122-R157 PolarHBondContact OE1-NH2 3.39Å; E122-R157 WeakPolarHBondContact OE2-CD 3.28Å; E122-R157 IonicContact OE2-CZ 2.79Å; E122-R157 IonicContact OE2-NE 2.78Å; E122-R157 PolarHBondContact OE2-NE 3.36Å; E122-R157 IonicContact OE2-NH1 2.71Å; E122-R157 PolarHBondContact OE2-NH1 3.29Å; E122-R157 IonicContact OE2-NH2 2.79Å; E122-R157 PolarHBondContact OE2-NH2 3Å
123	A	89.9	Confident	80.5	Confident	0 Å²	0	70 Å²	70	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-62.5	-28.9	176.5	0	0	0	0	0	113.5	S119 F120 A125 Y127 I150 Y153	S119-A123 VanDerWaalsContact O-CB 3.28Å; S119-A123 WeakPolarHBondContact O-CB 3.41Å; S119-A123 PolarHBondContact O-N 2.7Å; F120-A123 PolarHBondContact O-N 2.69Å; A123-A125 VanDerWaalsContact C-N 3.33Å; A123-Y127 WeakPolarHBondContact O-CB 3.45Å; A123-Y127 WeakPolarHBondContact O-CD2 3.42Å; A123-Y127 PolarHBondContact O-N 2.97Å; A123-I150 HydrophobicContact CB-CB 4.21Å; A123-I150 HydrophobicContact CB-CG1 4.03Å; A123-I150 HydrophobicContact CB-CG2 3.89Å; A123-Y153 HydrophobicContact CB-CD1 3.66Å; A123-Y153 HydrophobicContact CB-CE1 4.31Å; A123-Y153 HydrophobicContact CB-CG 4.05Å
124	L	86.8	Confident	79	Confident	52 Å²	52	76.1 Å²	76.1	27%	0.272	40%	0.401	S	S	.	.	H	α-helix	trans	-69.6	-29.5	172.7	-73.8	178	0	0	0	112.6	F120 Q121 E122 I150 I171	F120-L124 HydrophobicContact CD1-CD1 4.08Å; F120-L124 HydrophobicContact CD1-CG 4.47Å; F120-L124 HydrophobicContact CE1-CD1 3.46Å; F120-L124 VanDerWaalsContact CE1-CD1 3.46Å; F120-L124 HydrophobicContact CE1-CG 4.09Å; F120-L124 HydrophobicContact CE2-CD2 4.45Å; F120-L124 HydrophobicContact CE2-CG 4.46Å; F120-L124 HydrophobicContact CZ-CD1 3.77Å; F120-L124 HydrophobicContact CZ-CD2 4.18Å; F120-L124 HydrophobicContact CZ-CG 4.09Å; F120-L124 WeakPolarHBondContact O-CG 3.23Å; F120-L124 PolarHBondContact O-N 3.34Å; Q121-L124 WeakPolarHBondContact O-CB 3.35Å; Q121-L124 PolarHBondContact O-N 3.47Å; E122-L124 PolarHBondContact O-N 2.98Å; L124-I150 HydrophobicContact CD2-CD1 4.06Å; L124-I171 HydrophobicContact CD2-CD1 4.44Å; L124-I171 HydrophobicContact CD2-CG1 4.4Å
125	A	82.8	Confident	77.6	Confident	74 Å²	74	74.4 Å²	74.4	61%	0.612	39%	0.385	S	S	*	.	H	α-helix	trans	-76.7	-41.8	174.1	0	0	0	0	0	111.7	Q121 E122 A123	Q121-A125 PolarHBondContact O-N 3.43Å; E122-A125 WeakPolarHBondContact O-CB 3.44Å; E122-A125 PolarHBondContact O-N 3.07Å; A123-A125 VanDerWaalsContact C-N 3.33Å
126	I	83.8	Confident	76.1	Confident	40 Å²	40	77 Å²	77	21%	0.205	40%	0.398	C	S	.	.	H	α-helix	trans	-69.1	-35.8	178.5	-63.3	164.9	0	0	0	111.8	E122 P128 Y153	E122-I126 WeakPolarHBondContact O-CG1 3.15Å; E122-I126 PolarHBondContact O-N 3.09Å; I126-P128 VanDerWaalsContact O-CD 3.31Å; I126-P128 WeakPolarHBondContact O-CD 3.49Å; I126-Y153 HydrophobicContact CD1-CD2 4.08Å; I126-Y153 HydrophobicContact CD1-CE1 4.34Å; I126-Y153 HydrophobicContact CD1-CE2 3.35Å; I126-Y153 VanDerWaalsContact CD1-CZ 3.5Å
127	Y	81.4	Confident	74.4	Confident	61 Å²	61	79.4 Å²	79.4	24%	0.239	41%	0.411	C	S	.	.	S	Bend	trans	-116.5	88.2	178.5	-54.5	-63.1	0	0	0	111	A123 R146 L149 I150	A123-Y127 WeakPolarHBondContact O-CB 3.45Å; A123-Y127 WeakPolarHBondContact O-CD2 3.42Å; A123-Y127 PolarHBondContact O-N 2.97Å; Y127-R146 PolarHBondContact O-NE 3.25Å; Y127-R146 PolarHBondContact O-NH2 2.84Å; Y127-L149 HydrophobicContact CD1-CB 4.23Å; Y127-L149 HydrophobicContact CD1-CD1 4Å; Y127-L149 HydrophobicContact CD2-CB 4.01Å; Y127-L149 HydrophobicContact CE1-CB 4.02Å; Y127-L149 HydrophobicContact CE1-CD1 3.91Å; Y127-L149 HydrophobicContact CE1-CG 4.45Å; Y127-L149 HydrophobicContact CE2-CB 3.78Å; Y127-L149 HydrophobicContact CG-CB 4.23Å; Y127-I150 HydrophobicContact CD2-CG1 3.95Å
128	P	74.1	Confident	72.9	Confident	69 Å²	69	83.4 Å²	83.4	45%	0.448	44%	0.443	S	S	.	.			trans	-55.3	165.6	172.5	-26.6	35.4	0	0	0	113.2	I126 C130 R146	I126-P128 VanDerWaalsContact O-CD 3.31Å; I126-P128 WeakPolarHBondContact O-CD 3.49Å; P128-C130 PolarHBondContact O-N 3.15Å; P128-R146 VanDerWaalsContact C-NE 3.35Å; P128-R146 VanDerWaalsContact O-CD 3.3Å; P128-R146 WeakPolarHBondContact O-CD 3.18Å; P128-R146 PolarHBondContact O-NE 2.9Å
129	P	67.7	Low	71.3	Confident	114 Å²	114	84.1 Å²	84.1	74%	0.74	45%	0.446	S	S	*	.			trans	-70.3	74.7	176.4	29.6	-35.3	0	0	0	112.5	G131	P129-G131 PolarHBondContact O-N 3.38Å
130	C	59.9	Low	69.9	Low	60 Å²	60	87.6 Å²	87.6	41%	0.405	46%	0.462	S	S	.	.			trans	-58.3	129.6	163.3	-52.1	0	0	0	0	108.9	P128	P128-C130 PolarHBondContact O-N 3.15Å
131	G	63.5	Low	68.3	Low	75 Å²	75	91 Å²	91	77%	0.773	50%	0.496	S	S	*	.			trans	-68.4	-106.7	-170.9	0	0	0	0	0	115	P129	P129-G131 PolarHBondContact O-N 3.38Å
132	R	48.1	Very low	67.3	Low	256 Å²	256	91 Å²	91	97%	0.966	50%	0.495	S	S	*	.	S	Bend	trans	-91.1	-7	-179.1	-169.1	175.7	-80	-141.9	1.6	113.6
133	R	57.3	Low	66.1	Low	184 Å²	184	94.3 Å²	94.3	69%	0.694	51%	0.512	S	S	*	.	P	Polyproline II helix	trans	-86.5	135.5	-174.7	-122.6	180	-80.8	152.2	-13.4	111.2	D365	R133-D365 IonicContact NH2-OD2 3.14Å
134	K	54.7	Low	65.2	Low	134 Å²	134	96.2 Å²	96.2	58%	0.583	52%	0.519	S	S	*	.	P	Polyproline II helix	trans	-88.7	149.2	173.2	-60.8	-177.8	-175.7	178	0	109.8	M143	K134-M143 HydrophobicContact CD-CB 4.01Å; K134-M143 HydrophobicContact CD-SD 4.04Å
135	I	58.3	Low	64.8	Low	74 Å²	74	94.6 Å²	94.6	38%	0.379	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	134.1	174.6	-59.1	172.7	0	0	0	107.7	Y144 L149	I135-Y144 PolarHBondContact N-O 3.12Å; I135-Y144 PolarHBondContact O-N 3.42Å; I135-L149 HydrophobicContact CB-CD1 4.27Å; I135-L149 HydrophobicContact CD1-CD1 3.96Å
136	I	56.6	Low	64.9	Low	111 Å²	111	93.2 Å²	93.2	57%	0.569	49%	0.494	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.7	121.3	175.6	-57	175	0	0	0	107	M143	I136-M143 HydrophobicContact CD1-CE 4.27Å; I136-M143 HydrophobicContact CG1-CE 4.44Å; I136-M143 HydrophobicContact CG1-CG 4.49Å
137	L	56	Low	65.1	Low	52 Å²	52	93.5 Å²	93.5	27%	0.272	50%	0.496	S	S	.	.			trans	-99.5	112.3	172.8	-171.9	64.4	0	0	0	108.4	E139 Y144	L137-E139 HydrophobicContact CD2-CG 4.05Å; L137-E139 WeakPolarHBondContact CD2-OE1 3.31Å; L137-E139 HydrophobicContact CG-CG 3.99Å; L137-E139 PolarHBondContact O-N 3.35Å; L137-E139 VanDerWaalsContact O-N 3.12Å; L137-Y144 HydrophobicContact CB-CD2 4.49Å
138	S	58.5	Low	65.4	Low	120 Å²	120	93.6 Å²	93.6	84%	0.839	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-16	-167.8	-50.1	0	0	0	0	115
139	E	57.4	Low	66.1	Low	130 Å²	130	90.8 Å²	90.8	61%	0.607	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-22.2	-174.7	79.1	-162.4	-159.8	0	0	114.6	L137 R152	L137-E139 HydrophobicContact CD2-CG 4.05Å; L137-E139 WeakPolarHBondContact CD2-OE1 3.31Å; L137-E139 HydrophobicContact CG-CG 3.99Å; L137-E139 PolarHBondContact O-N 3.35Å; L137-E139 VanDerWaalsContact O-N 3.12Å; E139-R152 IonicContact OE1-CZ 2.69Å; E139-R152 VanDerWaalsContact OE1-CZ 3.29Å; E139-R152 IonicContact OE1-NH1 2.95Å; E139-R152 PolarHBondContact OE1-NH1 3Å; E139-R152 IonicContact OE1-NH2 3.72Å; E139-R152 PolarHBondContact OE1-NH2 3.27Å
140	E	60.1	Low	67.1	Low	77 Å²	77	85.3 Å²	85.3	36%	0.36	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131.9	2.3	-169.3	-135.3	-168.1	124.8	0	0	114.3	K142 Y144 R152	E140-K142 PolarHBondContact O-N 3Å; E140-K142 IonicContact OE1-NZ 3.66Å; E140-K142 PolarHBondContact OE1-NZ 3.09Å; E140-Y144 PolarHBondContact OE1-OH 2.88Å; E140-Y144 PolarHBondContact OE2-OH 3.18Å; E140-R152 IonicContact OE2-CZ 3.53Å; E140-R152 IonicContact OE2-NH2 3.34Å; E140-R152 PolarHBondContact OE2-NH2 2.93Å
141	G	59.1	Low	68.6	Low	71 Å²	71	83 Å²	83	73%	0.732	43%	0.43	S	S	*	.			trans	65.3	-4.6	176.7	0	0	0	0	0	116.6
142	K	68.9	Low	69.8	Low	113 Å²	113	84.1 Å²	84.1	49%	0.491	41%	0.41	S	S	.	.			trans	-95.4	135.5	-176.7	-67.5	162	-166.4	161	0	111.1	E140 Y144	E140-K142 PolarHBondContact O-N 3Å; E140-K142 IonicContact OE1-NZ 3.66Å; E140-K142 PolarHBondContact OE1-NZ 3.09Å; K142-Y144 HydrophobicContact CB-CD2 4.37Å; K142-Y144 HydrophobicContact CB-CE2 3.67Å; K142-Y144 WeakPolarHBondContact CD-OH 3.49Å; K142-Y144 WeakPolarHBondContact O-CD2 3.24Å; K142-Y144 WeakPolarHBondContact O-CE2 3.37Å; K142-Y144 PolarHBondContact O-N 2.99Å
143	M	62.4	Low	71.9	Confident	114 Å²	114	73.8 Å²	73.8	56%	0.562	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.9	111.5	173.6	-72.2	-173.4	167.5	0	0	111.2	K134 I136	K134-M143 HydrophobicContact CD-CB 4.01Å; K134-M143 HydrophobicContact CD-SD 4.04Å; I136-M143 HydrophobicContact CD1-CE 4.27Å; I136-M143 HydrophobicContact CG1-CE 4.44Å; I136-M143 HydrophobicContact CG1-CG 4.49Å
144	Y	71.5	Confident	73.5	Confident	39 Å²	39	65 Å²	65	15%	0.153	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	132.8	176.9	-65.2	-84.9	0	0	0	111.6	I135 L137 E140 K142 E148 L149	I135-Y144 PolarHBondContact N-O 3.12Å; I135-Y144 PolarHBondContact O-N 3.42Å; L137-Y144 HydrophobicContact CB-CD2 4.49Å; E140-Y144 PolarHBondContact OE1-OH 2.88Å; E140-Y144 PolarHBondContact OE2-OH 3.18Å; K142-Y144 HydrophobicContact CB-CD2 4.37Å; K142-Y144 HydrophobicContact CB-CE2 3.67Å; K142-Y144 WeakPolarHBondContact CD-OH 3.49Å; K142-Y144 WeakPolarHBondContact O-CD2 3.24Å; K142-Y144 WeakPolarHBondContact O-CE2 3.37Å; K142-Y144 PolarHBondContact O-N 2.99Å; Y144-E148 HydrophobicContact CD1-CB 4.04Å; Y144-L149 HydrophobicContact CG-CD2 4.36Å
145	G	79.2	Confident	75.3	Confident	18 Å²	18	64.3 Å²	64.3	19%	0.186	34%	0.336	C	S	.	.			trans	-79.2	159.3	166.4	0	0	0	0	0	112	N147 E148 L149	G145-N147 VanDerWaalsContact C-N 3.25Å; G145-N147 PolarHBondContact O-N 3.32Å; G145-N147 VanDerWaalsContact O-N 3.11Å; G145-E148 PolarHBondContact N-OE2 3.08Å; G145-E148 WeakPolarHBondContact O-CA 3.43Å; G145-E148 WeakPolarHBondContact O-CB 3.42Å; G145-E148 PolarHBondContact O-N 3.22Å; G145-L149 PolarHBondContact O-N 3.29Å
146	R	84.3	Confident	76.8	Confident	46 Å²	46	67.9 Å²	67.9	17%	0.174	36%	0.355	C	S	.	.	H	α-helix	trans	-44.4	-46.9	177.4	-177	-173.8	-176.3	-103.6	-2.1	113.8	Y127 P128 E148 L149 I150	Y127-R146 PolarHBondContact O-NE 3.25Å; Y127-R146 PolarHBondContact O-NH2 2.84Å; P128-R146 VanDerWaalsContact C-NE 3.35Å; P128-R146 VanDerWaalsContact O-CD 3.3Å; P128-R146 WeakPolarHBondContact O-CD 3.18Å; P128-R146 PolarHBondContact O-NE 2.9Å; R146-E148 PolarHBondContact O-N 2.87Å; R146-L149 PolarHBondContact O-N 2.95Å; R146-I150 HydrophobicContact CG-CD1 4.02Å; R146-I150 WeakPolarHBondContact O-CG1 3.38Å; R146-I150 PolarHBondContact O-N 3.12Å
147	N	88.1	Confident	78.2	Confident	45 Å²	45	69.2 Å²	69.2	24%	0.241	35%	0.353	C	S	.	.	H	α-helix	trans	-74.3	-15.1	-176.5	-59.5	-5	0	0	0	113	G145 A151 V167 S168	G145-N147 VanDerWaalsContact C-N 3.25Å; G145-N147 PolarHBondContact O-N 3.32Å; G145-N147 VanDerWaalsContact O-N 3.11Å; N147-A151 WeakPolarHBondContact O-CB 3.46Å; N147-A151 PolarHBondContact O-N 2.92Å; N147-V167 HydrophobicContact CB-CB 4.43Å; N147-V167 HydrophobicContact CB-CG1 3.83Å; N147-S168 PolarHBondContact ND2-OG 3.26Å
148	E	88.2	Confident	79.8	Confident	63 Å²	63	68.3 Å²	68.3	29%	0.294	35%	0.349	S	S	.	.	H	α-helix	trans	-85.9	-37.1	172.1	-64.6	167.5	128.4	0	0	110.8	Y144 G145 R146 A151 R152 R164	Y144-E148 HydrophobicContact CD1-CB 4.04Å; G145-E148 PolarHBondContact N-OE2 3.08Å; G145-E148 WeakPolarHBondContact O-CA 3.43Å; G145-E148 WeakPolarHBondContact O-CB 3.42Å; G145-E148 PolarHBondContact O-N 3.22Å; R146-E148 PolarHBondContact O-N 2.87Å; E148-A151 WeakPolarHBondContact O-CB 3.43Å; E148-A151 PolarHBondContact O-N 3.39Å; E148-R152 PolarHBondContact O-N 3.49Å; E148-R164 HydrophobicContact CG-CB 3.63Å; E148-R164 HydrophobicContact CG-CG 4.2Å; E148-R164 WeakPolarHBondContact OE1-CD 3.5Å; E148-R164 IonicContact OE1-NE 2.72Å
149	L	87.8	Confident	81.2	Confident	10 Å²	10	65.3 Å²	65.3	5%	0.052	34%	0.337	C	S	.	.	H	α-helix	trans	-62.8	-46.1	171.2	-65.3	173.2	0	0	0	111.7	Y127 I135 Y144 G145 R146 A151 R152 Y153	Y127-L149 HydrophobicContact CD1-CB 4.23Å; Y127-L149 HydrophobicContact CD1-CD1 4Å; Y127-L149 HydrophobicContact CD2-CB 4.01Å; Y127-L149 HydrophobicContact CE1-CB 4.02Å; Y127-L149 HydrophobicContact CE1-CD1 3.91Å; Y127-L149 HydrophobicContact CE1-CG 4.45Å; Y127-L149 HydrophobicContact CE2-CB 3.78Å; Y127-L149 HydrophobicContact CG-CB 4.23Å; I135-L149 HydrophobicContact CB-CD1 4.27Å; I135-L149 HydrophobicContact CD1-CD1 3.96Å; Y144-L149 HydrophobicContact CG-CD2 4.36Å; G145-L149 PolarHBondContact O-N 3.29Å; R146-L149 PolarHBondContact O-N 2.95Å; L149-A151 VanDerWaalsContact C-N 3.29Å; L149-A151 PolarHBondContact O-N 3.1Å; L149-R152 PolarHBondContact O-N 2.99Å; L149-Y153 WeakPolarHBondContact O-CB 3.43Å; L149-Y153 PolarHBondContact O-N 2.95Å
150	I	89.6	Confident	82.7	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-58.2	-41.6	173.1	-66.9	164.4	0	0	0	111.1	F120 A123 L124 Y127 R146 Y153 I154 V167 I171	F120-I150 HydrophobicContact CD2-CG2 3.82Å; F120-I150 HydrophobicContact CE2-CG2 4.26Å; A123-I150 HydrophobicContact CB-CB 4.21Å; A123-I150 HydrophobicContact CB-CG1 4.03Å; A123-I150 HydrophobicContact CB-CG2 3.89Å; L124-I150 HydrophobicContact CD2-CD1 4.06Å; Y127-I150 HydrophobicContact CD2-CG1 3.95Å; R146-I150 HydrophobicContact CG-CD1 4.02Å; R146-I150 WeakPolarHBondContact O-CG1 3.38Å; R146-I150 PolarHBondContact O-N 3.12Å; I150-Y153 PolarHBondContact O-N 2.89Å; I150-I154 HydrophobicContact CG2-CD1 3.92Å; I150-I154 VanDerWaalsContact O-CG1 3.31Å; I150-I154 WeakPolarHBondContact O-CG1 3.13Å; I150-I154 PolarHBondContact O-N 3.41Å; I150-V167 HydrophobicContact CB-CG1 3.94Å; I150-V167 HydrophobicContact CD1-CG1 4.2Å; I150-V167 HydrophobicContact CG2-CB 4.49Å; I150-V167 HydrophobicContact CG2-CG1 3.64Å; I150-V167 HydrophobicContact CG2-CG2 3.96Å; I150-I171 HydrophobicContact CD1-CD1 4.47Å
151	A	91.3	Very high	84	Confident	12 Å²	12	62.2 Å²	62.2	10%	0.099	33%	0.327	C	S	.	.	H	α-helix	trans	-65	-41.2	175.9	0	0	0	0	0	113.1	N147 E148 L149 K155 R162 V167	N147-A151 WeakPolarHBondContact O-CB 3.46Å; N147-A151 PolarHBondContact O-N 2.92Å; E148-A151 WeakPolarHBondContact O-CB 3.43Å; E148-A151 PolarHBondContact O-N 3.39Å; L149-A151 VanDerWaalsContact C-N 3.29Å; L149-A151 PolarHBondContact O-N 3.1Å; A151-K155 PolarHBondContact O-N 3.47Å; A151-K155 VanDerWaalsContact O-N 3.09Å; A151-R162 VanDerWaalsContact CB-O 3.24Å; A151-R162 WeakPolarHBondContact CB-O 3.38Å; A151-V167 HydrophobicContact CB-CG2 4.2Å
152	R	89.2	Confident	85.5	Confident	97 Å²	97	60.9 Å²	60.9	37%	0.366	30%	0.3	S	S	.	.	H	α-helix	trans	-63.7	-42.4	175.1	-160.6	-175	-163.7	-135	18.1	110.5	E139 E140 E148 L149 K155 L156	E139-R152 IonicContact OE1-CZ 2.69Å; E139-R152 VanDerWaalsContact OE1-CZ 3.29Å; E139-R152 IonicContact OE1-NH1 2.95Å; E139-R152 PolarHBondContact OE1-NH1 3Å; E139-R152 IonicContact OE1-NH2 3.72Å; E139-R152 PolarHBondContact OE1-NH2 3.27Å; E140-R152 IonicContact OE2-CZ 3.53Å; E140-R152 IonicContact OE2-NH2 3.34Å; E140-R152 PolarHBondContact OE2-NH2 2.93Å; E148-R152 PolarHBondContact O-N 3.49Å; L149-R152 PolarHBondContact O-N 2.99Å; R152-K155 PolarHBondContact O-N 3Å; R152-L156 WeakPolarHBondContact O-CB 3.42Å; R152-L156 PolarHBondContact O-N 3.2Å
153	Y	91.1	Very high	86.4	Confident	40 Å²	40	58.8 Å²	58.8	16%	0.157	30%	0.297	C	S	.	.	H	α-helix	trans	-63.4	-47.9	177.8	-172.6	-87.7	0	0	0	112.5	S119 E122 A123 I126 L149 I150 K155 L156 R157	S119-Y153 WeakPolarHBondContact O-CD1 3.5Å; S119-Y153 WeakPolarHBondContact O-CE1 3.49Å; E122-Y153 HydrophobicContact CB-CE1 4.05Å; E122-Y153 PolarHBondContact OE2-OH 2.93Å; A123-Y153 HydrophobicContact CB-CD1 3.66Å; A123-Y153 HydrophobicContact CB-CE1 4.31Å; A123-Y153 HydrophobicContact CB-CG 4.05Å; I126-Y153 HydrophobicContact CD1-CD2 4.08Å; I126-Y153 HydrophobicContact CD1-CE1 4.34Å; I126-Y153 HydrophobicContact CD1-CE2 3.35Å; I126-Y153 VanDerWaalsContact CD1-CZ 3.5Å; L149-Y153 WeakPolarHBondContact O-CB 3.43Å; L149-Y153 PolarHBondContact O-N 2.95Å; I150-Y153 PolarHBondContact O-N 2.89Å; Y153-K155 VanDerWaalsContact C-N 3.31Å; Y153-K155 PolarHBondContact O-N 3.31Å; Y153-L156 PolarHBondContact O-N 3.06Å; Y153-L156 VanDerWaalsContact O-N 3.15Å; Y153-R157 HydrophobicContact CE1-CB 4.46Å; Y153-R157 WeakPolarHBondContact O-CB 3.4Å; Y153-R157 PolarHBondContact O-N 2.89Å; Y153-R157 PolarHBondContact OH-NH1 3.27Å
154	I	91.5	Very high	87.7	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-57.5	-45.5	175.1	-69.4	164.1	0	0	0	110.7	W112 I116 F120 I150 L156 R157 T158 R162 V167	W112-I154 HydrophobicContact CZ3-CD1 4.26Å; I116-I154 HydrophobicContact CG2-CG2 3.86Å; F120-I154 HydrophobicContact CB-CD1 3.92Å; F120-I154 HydrophobicContact CB-CG1 4.39Å; F120-I154 HydrophobicContact CD2-CD1 4.12Å; I150-I154 HydrophobicContact CG2-CD1 3.92Å; I150-I154 VanDerWaalsContact O-CG1 3.31Å; I150-I154 WeakPolarHBondContact O-CG1 3.13Å; I150-I154 PolarHBondContact O-N 3.41Å; I154-L156 VanDerWaalsContact C-N 3.34Å; I154-L156 PolarHBondContact O-N 3.28Å; I154-R157 PolarHBondContact O-N 2.63Å; I154-T158 WeakPolarHBondContact O-CB 3.47Å; I154-T158 PolarHBondContact O-N 2.98Å; I154-T158 PolarHBondContact O-OG1 3.04Å; I154-R162 HydrophobicContact CG2-CB 4.24Å; I154-R162 HydrophobicContact CG2-CG 3.98Å; I154-V167 HydrophobicContact CD1-CG2 4.25Å
155	K	91.4	Very high	88.5	Confident	118 Å²	118	65.9 Å²	65.9	51%	0.513	32%	0.322	S	S	.	.	H	α-helix	trans	-62.4	-40.9	177.5	-172.9	-177.2	-177.4	-171.9	0	111.8	A151 R152 Y153 G159 T161	A151-K155 PolarHBondContact O-N 3.47Å; A151-K155 VanDerWaalsContact O-N 3.09Å; R152-K155 PolarHBondContact O-N 3Å; Y153-K155 VanDerWaalsContact C-N 3.31Å; Y153-K155 PolarHBondContact O-N 3.31Å; K155-G159 WeakPolarHBondContact O-CA 3.4Å; K155-G159 PolarHBondContact O-N 3.05Å; K155-T161 WeakPolarHBondContact CE-OG1 3.43Å
156	L	90	Very high	89.1	Confident	150 Å²	150	67.9 Å²	67.9	79%	0.785	33%	0.326	S	S	*	.	H	α-helix	trans	-66.3	-40	179.4	-175.5	63.1	0	0	0	112.2	R152 Y153 I154	R152-L156 WeakPolarHBondContact O-CB 3.42Å; R152-L156 PolarHBondContact O-N 3.2Å; Y153-L156 PolarHBondContact O-N 3.06Å; Y153-L156 VanDerWaalsContact O-N 3.15Å; I154-L156 VanDerWaalsContact C-N 3.34Å; I154-L156 PolarHBondContact O-N 3.28Å
157	R	87.6	Confident	89.4	Confident	139 Å²	139	65.7 Å²	65.7	53%	0.525	32%	0.318	S	S	.	.	H	α-helix	trans	-88.2	-30.6	-173.8	-164.9	166.3	-176.6	122.1	-18.1	114.7	E122 Y153 I154	E122-R157 VanDerWaalsContact CD-CZ 3.45Å; E122-R157 IonicContact OE1-CZ 3.57Å; E122-R157 IonicContact OE1-NE 3.99Å; E122-R157 IonicContact OE1-NH2 3.39Å; E122-R157 PolarHBondContact OE1-NH2 3.39Å; E122-R157 WeakPolarHBondContact OE2-CD 3.28Å; E122-R157 IonicContact OE2-CZ 2.79Å; E122-R157 IonicContact OE2-NE 2.78Å; E122-R157 PolarHBondContact OE2-NE 3.36Å; E122-R157 IonicContact OE2-NH1 2.71Å; E122-R157 PolarHBondContact OE2-NH1 3.29Å; E122-R157 IonicContact OE2-NH2 2.79Å; E122-R157 PolarHBondContact OE2-NH2 3Å; Y153-R157 HydrophobicContact CE1-CB 4.46Å; Y153-R157 WeakPolarHBondContact O-CB 3.4Å; Y153-R157 PolarHBondContact O-N 2.89Å; Y153-R157 PolarHBondContact OH-NH1 3.27Å; I154-R157 PolarHBondContact O-N 2.63Å
158	T	88.7	Confident	89.5	Confident	32 Å²	32	65.2 Å²	65.2	20%	0.196	32%	0.318	C	S	.	.	H	α-helix	trans	-110.8	-11.7	-177.6	67	0	0	0	0	114.3	D115 I116 S119 I154 K160	D115-T158 HydrophobicContact CB-CG2 4.48Å; D115-T158 WeakPolarHBondContact O-CG2 3.2Å; I116-T158 HydrophobicContact CG1-CG2 4.27Å; S119-T158 WeakPolarHBondContact OG-CG2 3.49Å; I154-T158 WeakPolarHBondContact O-CB 3.47Å; I154-T158 PolarHBondContact O-N 2.98Å; I154-T158 PolarHBondContact O-OG1 3.04Å; T158-K160 PolarHBondContact O-N 2.82Å; T158-K160 PolarHBondContact OG1-N 2.85Å; T158-K160 PolarHBondContact OG1-O 2.64Å
159	G	88.5	Confident	89.6	Confident	57 Å²	57	65.4 Å²	65.4	59%	0.588	33%	0.326	S	S	*	.	S	Bend	trans	69.2	-26.3	-165.3	0	0	0	0	0	114.3	K155 T161	K155-G159 WeakPolarHBondContact O-CA 3.4Å; K155-G159 PolarHBondContact O-N 3.05Å; G159-T161 PolarHBondContact O-N 3.36Å
160	K	89.3	Confident	89.8	Confident	64 Å²	64	66 Å²	66	28%	0.278	33%	0.328	S	S	.	.			trans	-73	121.9	-178.7	-61.4	176.7	-176	173.3	0	110.1	E109 D115 I116 T158	E109-K160 IonicContact OE1-NZ 2.82Å; E109-K160 PolarHBondContact OE1-NZ 2.77Å; D115-K160 IonicContact OD1-NZ 2.71Å; D115-K160 VanDerWaalsContact OD2-CE 3.3Å; D115-K160 WeakPolarHBondContact OD2-CE 3.41Å; D115-K160 IonicContact OD2-NZ 3.77Å; D115-K160 PolarHBondContact OD2-NZ 2.78Å; I116-K160 HydrophobicContact CD1-CB 3.97Å; I116-K160 HydrophobicContact CD1-CD 3.54Å; I116-K160 HydrophobicContact CD1-CG 4.38Å; I116-K160 HydrophobicContact CG1-CB 4.33Å; I116-K160 HydrophobicContact CG1-CD 3.95Å; T158-K160 PolarHBondContact O-N 2.82Å; T158-K160 PolarHBondContact OG1-N 2.85Å; T158-K160 PolarHBondContact OG1-O 2.64Å
161	T	87.4	Confident	89.8	Confident	79 Å²	79	68.2 Å²	68.2	49%	0.485	34%	0.34	S	S	.	.			trans	-77.1	131.4	179.4	-64.9	0	0	0	0	111	K155 G159	K155-T161 WeakPolarHBondContact CE-OG1 3.43Å; G159-T161 PolarHBondContact O-N 3.36Å
162	R	88.7	Confident	89.7	Confident	43 Å²	43	72.7 Å²	72.7	16%	0.162	36%	0.359	C	S	.	.			trans	-125	137.7	167.6	-66.7	-64.6	175.9	-99.1	9.7	109.5	V111 I116 A151 I154	V111-R162 VanDerWaalsContact O-CZ 3.22Å; V111-R162 PolarHBondContact O-NE 3.4Å; V111-R162 PolarHBondContact O-NH2 2.72Å; I116-R162 VanDerWaalsContact CD1-CZ 3.45Å; I116-R162 HydrophobicContact CG2-CG 3.95Å; A151-R162 VanDerWaalsContact CB-O 3.24Å; A151-R162 WeakPolarHBondContact CB-O 3.38Å; I154-R162 HydrophobicContact CG2-CB 4.24Å; I154-R162 HydrophobicContact CG2-CG 3.98Å
163	T	89.2	Confident	89.8	Confident	69 Å²	69	71.6 Å²	71.6	42%	0.423	36%	0.363	S	S	.	.			trans	-82.2	154	-176	64.2	0	0	0	0	111.8	K165 Q166 V167	T163-K165 PolarHBondContact O-N 2.92Å; T163-Q166 PolarHBondContact O-N 3.08Å; T163-Q166 WeakPolarHBondContact OG1-CG 3.29Å; T163-Q166 PolarHBondContact OG1-N 2.97Å; T163-Q166 VanDerWaalsContact OG1-N 3.12Å; T163-Q166 PolarHBondContact OG1-OE1 3.07Å; T163-V167 PolarHBondContact O-N 3.21Å
164	R	88.4	Confident	89.7	Confident	141 Å²	141	72.9 Å²	72.9	53%	0.532	37%	0.372	S	S	.	.	H	α-helix	trans	-52.6	-28.5	170.6	72.9	-174.4	-176	114.3	-1.5	113.4	E148 S168	E148-R164 HydrophobicContact CG-CB 3.63Å; E148-R164 HydrophobicContact CG-CG 4.2Å; E148-R164 WeakPolarHBondContact OE1-CD 3.5Å; E148-R164 IonicContact OE1-NE 2.72Å; R164-S168 WeakPolarHBondContact O-CB 3.09Å; R164-S168 PolarHBondContact O-N 2.85Å; R164-S168 PolarHBondContact O-OG 3.04Å
165	K	90.2	Very high	89.4	Confident	160 Å²	160	75.7 Å²	75.7	70%	0.696	40%	0.396	S	S	*	.	H	α-helix	trans	-73.3	-44.8	175.5	-68.8	-174.5	178.8	-179.3	0	111.8	T163 S168 S169	T163-K165 PolarHBondContact O-N 2.92Å; K165-S168 PolarHBondContact O-N 3.42Å; K165-S169 WeakPolarHBondContact O-CB 3.37Å; K165-S169 PolarHBondContact O-N 3.45Å
166	Q	90.9	Very high	89.1	Confident	61 Å²	61	77.8 Å²	77.8	29%	0.285	40%	0.4	S	S	.	.	H	α-helix	trans	-60.1	-47.1	173.9	-77.1	162.2	-50.9	0	0	111.4	W112 T163 S168 S169 H170	W112-Q166 HydrophobicContact CZ2-CB 4.21Å; T163-Q166 PolarHBondContact O-N 3.08Å; T163-Q166 WeakPolarHBondContact OG1-CG 3.29Å; T163-Q166 PolarHBondContact OG1-N 2.97Å; T163-Q166 VanDerWaalsContact OG1-N 3.12Å; T163-Q166 PolarHBondContact OG1-OE1 3.07Å; Q166-S168 VanDerWaalsContact C-N 3.34Å; Q166-S168 PolarHBondContact O-N 3.07Å; Q166-S169 WeakPolarHBondContact O-CB 3.43Å; Q166-S169 PolarHBondContact O-N 2.96Å; Q166-H170 PolarHBondContact O-N 3.45Å
167	V	90.5	Very high	89	Confident	0 Å²	0	76.1 Å²	76.1	0%	0	39%	0.387	C	S	.	.	H	α-helix	trans	-55.4	-47.8	174	170.4	0	0	0	0	111.2	W112 F120 N147 I150 A151 I154 T163 S169 H170 I171	W112-V167 HydrophobicContact CH2-CG2 4.49Å; F120-V167 HydrophobicContact CE2-CG1 4.2Å; N147-V167 HydrophobicContact CB-CB 4.43Å; N147-V167 HydrophobicContact CB-CG1 3.83Å; I150-V167 HydrophobicContact CB-CG1 3.94Å; I150-V167 HydrophobicContact CD1-CG1 4.2Å; I150-V167 HydrophobicContact CG2-CB 4.49Å; I150-V167 HydrophobicContact CG2-CG1 3.64Å; I150-V167 HydrophobicContact CG2-CG2 3.96Å; A151-V167 HydrophobicContact CB-CG2 4.2Å; I154-V167 HydrophobicContact CD1-CG2 4.25Å; T163-V167 PolarHBondContact O-N 3.21Å; V167-S169 PolarHBondContact O-N 3.5Å; V167-H170 PolarHBondContact O-N 3.2Å; V167-I171 HydrophobicContact CG1-CD1 3.91Å; V167-I171 WeakPolarHBondContact O-CD1 3.44Å; V167-I171 VanDerWaalsContact O-CG1 3.29Å; V167-I171 WeakPolarHBondContact O-CG1 3.48Å; V167-I171 PolarHBondContact O-N 3.5Å; V167-I171 VanDerWaalsContact O-N 3.08Å
168	S	89.3	Confident	88.7	Confident	35 Å²	35	76.2 Å²	76.2	25%	0.245	39%	0.391	C	S	.	.	H	α-helix	trans	-61.8	-42.4	177.9	-56.6	0	0	0	0	112.6	N147 R164 K165 Q166 Q172	N147-S168 PolarHBondContact ND2-OG 3.26Å; R164-S168 WeakPolarHBondContact O-CB 3.09Å; R164-S168 PolarHBondContact O-N 2.85Å; R164-S168 PolarHBondContact O-OG 3.04Å; K165-S168 PolarHBondContact O-N 3.42Å; Q166-S168 VanDerWaalsContact C-N 3.34Å; Q166-S168 PolarHBondContact O-N 3.07Å; S168-Q172 WeakPolarHBondContact O-CG 3.42Å; S168-Q172 PolarHBondContact O-N 2.95Å
169	S	91.5	Very high	88.3	Confident	66 Å²	66	77.4 Å²	77.4	46%	0.462	40%	0.404	S	S	.	.	H	α-helix	trans	-62.9	-46	177.8	-172.9	0	0	0	0	111.3	K165 Q166 V167 Q172 V173	K165-S169 WeakPolarHBondContact O-CB 3.37Å; K165-S169 PolarHBondContact O-N 3.45Å; Q166-S169 WeakPolarHBondContact O-CB 3.43Å; Q166-S169 PolarHBondContact O-N 2.96Å; V167-S169 PolarHBondContact O-N 3.5Å; S169-Q172 WeakPolarHBondContact O-CB 3.45Å; S169-Q172 PolarHBondContact O-N 2.79Å; S169-Q172 VanDerWaalsContact O-N 3.1Å; S169-V173 WeakPolarHBondContact O-CG2 3.15Å; S169-V173 PolarHBondContact O-N 3.1Å
170	H	91.6	Very high	88.1	Confident	22 Å²	22	82.7 Å²	82.7	10%	0.102	41%	0.406	C	S	.	.	H	α-helix	trans	-64.6	-43.1	-179.1	-163.5	44.6	0	0	0	112.7	W112 E117 F120 Q166 V167 Q172 V173 L174	W112-H170 AromaticContact CD2-CD2 3.7Å; W112-H170 AromaticContact CD2-CG 3.99Å; W112-H170 AromaticContact CD2-NE2 3.78Å; W112-H170 AromaticContact CE2-CD2 3.73Å; W112-H170 AromaticContact CE2-CG 3.59Å; W112-H170 AromaticContact CE2-ND1 4Å; W112-H170 AromaticContact CE3-CD2 3.7Å; W112-H170 AromaticContact CE3-NE2 3.88Å; W112-H170 HydrophobicContact CH2-CB 4.01Å; W112-H170 AromaticContact CH2-CD2 3.87Å; W112-H170 HydrophobicContact CZ2-CB 3.44Å; W112-H170 VanDerWaalsContact CZ2-CB 3.44Å; W112-H170 AromaticContact CZ2-CD2 3.85Å; W112-H170 AromaticContact CZ2-CG 3.73Å; W112-H170 AromaticContact CZ3-CD2 3.79Å; W112-H170 AromaticContact NE1-CG 3.87Å; W112-H170 AromaticContact NE1-ND1 3.84Å; E117-H170 IonicContact OE1-NE2 3.35Å; E117-H170 IonicContact OE2-CD2 2.79Å; E117-H170 IonicContact OE2-CE1 3.52Å; E117-H170 IonicContact OE2-NE2 3.04Å; E117-H170 PolarHBondContact OE2-NE2 2.93Å; F120-H170 AromaticContact CD1-CD2 3.75Å; F120-H170 AromaticContact CE1-CD2 3.44Å; F120-H170 VanDerWaalsContact CE1-CD2 3.44Å; F120-H170 WeakPolarHBondContact CE1-CD2 3.35Å; F120-H170 HydrophobicContact CZ-CB 4.43Å; F120-H170 AromaticContact CZ-CD2 3.59Å; Q166-H170 PolarHBondContact O-N 3.45Å; V167-H170 PolarHBondContact O-N 3.2Å; H170-Q172 VanDerWaalsContact C-N 3.25Å; H170-Q172 PolarHBondContact O-N 2.88Å; H170-V173 PolarHBondContact O-N 3.37Å; H170-V173 VanDerWaalsContact O-N 3.12Å; H170-L174 WeakPolarHBondContact O-CG 3.43Å; H170-L174 PolarHBondContact O-N 3.13Å
171	I	89.7	Confident	87.6	Confident	47 Å²	47	84.1 Å²	84.1	24%	0.241	41%	0.414	C	S	.	.	H	α-helix	trans	-55.5	-42	171.8	-66.8	164.6	0	0	0	111	F120 L124 I150 V167 A175	F120-I171 HydrophobicContact CE2-CG1 4.03Å; F120-I171 HydrophobicContact CZ-CG1 3.76Å; L124-I171 HydrophobicContact CD2-CD1 4.44Å; L124-I171 HydrophobicContact CD2-CG1 4.4Å; I150-I171 HydrophobicContact CD1-CD1 4.47Å; V167-I171 HydrophobicContact CG1-CD1 3.91Å; V167-I171 WeakPolarHBondContact O-CD1 3.44Å; V167-I171 VanDerWaalsContact O-CG1 3.29Å; V167-I171 WeakPolarHBondContact O-CG1 3.48Å; V167-I171 PolarHBondContact O-N 3.5Å; V167-I171 VanDerWaalsContact O-N 3.08Å; I171-A175 WeakPolarHBondContact O-CB 3.48Å; I171-A175 PolarHBondContact O-N 3.28Å
172	Q	89.5	Confident	87	Confident	106 Å²	106	85.2 Å²	85.2	50%	0.495	42%	0.416	S	S	.	.	H	α-helix	trans	-69.3	-38.5	177.1	-69.2	177.1	19.4	0	0	112.8	S168 S169 H170 A175 R176	S168-Q172 WeakPolarHBondContact O-CG 3.42Å; S168-Q172 PolarHBondContact O-N 2.95Å; S169-Q172 WeakPolarHBondContact O-CB 3.45Å; S169-Q172 PolarHBondContact O-N 2.79Å; S169-Q172 VanDerWaalsContact O-N 3.1Å; H170-Q172 VanDerWaalsContact C-N 3.25Å; H170-Q172 PolarHBondContact O-N 2.88Å; Q172-A175 PolarHBondContact O-N 3.34Å; Q172-R176 WeakPolarHBondContact O-CB 3.47Å; Q172-R176 VanDerWaalsContact O-CG 3.26Å; Q172-R176 WeakPolarHBondContact O-CG 3.4Å; Q172-R176 PolarHBondContact O-N 3.38Å
173	V	90.7	Very high	86.3	Confident	74 Å²	74	86.3 Å²	86.3	45%	0.448	43%	0.431	S	S	.	.	H	α-helix	trans	-61.7	-46.7	174.9	170.6	0	0	0	0	110.5	S169 H170 R176 K177	S169-V173 WeakPolarHBondContact O-CG2 3.15Å; S169-V173 PolarHBondContact O-N 3.1Å; H170-V173 PolarHBondContact O-N 3.37Å; H170-V173 VanDerWaalsContact O-N 3.12Å; V173-R176 PolarHBondContact O-N 3.31Å; V173-K177 WeakPolarHBondContact O-CB 3.39Å; V173-K177 PolarHBondContact O-N 3.38Å
174	L	88.5	Confident	85.7	Confident	67 Å²	67	85.8 Å²	85.8	35%	0.351	43%	0.433	S	S	.	.	H	α-helix	trans	-62.6	-44.3	176.7	-68.4	171.5	0	0	0	112	F120 H170 R176 K177 K178	F120-L174 HydrophobicContact CE1-CD1 3.59Å; F120-L174 HydrophobicContact CZ-CD1 4.08Å; H170-L174 WeakPolarHBondContact O-CG 3.43Å; H170-L174 PolarHBondContact O-N 3.13Å; L174-R176 PolarHBondContact O-N 2.84Å; L174-K177 PolarHBondContact O-N 2.76Å; L174-K178 WeakPolarHBondContact O-CB 3.42Å; L174-K178 PolarHBondContact O-N 3.44Å
175	A	86.1	Confident	84.8	Confident	60 Å²	60	86.6 Å²	86.6	50%	0.496	44%	0.44	S	S	.	.	H	α-helix	trans	-60.8	-43.6	175.2	0	0	0	0	0	112.2	I171 Q172 K178 A179	I171-A175 WeakPolarHBondContact O-CB 3.48Å; I171-A175 PolarHBondContact O-N 3.28Å; Q172-A175 PolarHBondContact O-N 3.34Å; A175-K178 PolarHBondContact O-N 3.47Å; A175-A179 WeakPolarHBondContact O-CB 3.4Å; A175-A179 PolarHBondContact O-N 2.91Å
176	R	85.5	Confident	83.4	Confident	162 Å²	162	83.6 Å²	83.6	61%	0.611	43%	0.432	S	S	*	.	H	α-helix	trans	-68.6	-32.8	176.1	-72.9	174.2	-179.9	-175.7	1.6	113.1	Q172 V173 L174 R180	Q172-R176 WeakPolarHBondContact O-CB 3.47Å; Q172-R176 VanDerWaalsContact O-CG 3.26Å; Q172-R176 WeakPolarHBondContact O-CG 3.4Å; Q172-R176 PolarHBondContact O-N 3.38Å; V173-R176 PolarHBondContact O-N 3.31Å; L174-R176 PolarHBondContact O-N 2.84Å; R176-R180 WeakPolarHBondContact O-CG 3.42Å; R176-R180 PolarHBondContact O-N 2.7Å; R176-R180 VanDerWaalsContact O-N 3.13Å; R176-R180 PolarHBondContact O-NE 3.38Å
177	K	86.9	Confident	82	Confident	115 Å²	115	89.5 Å²	89.5	50%	0.5	46%	0.456	S	S	.	.	H	α-helix	trans	-66.2	-51.2	173.8	-171.9	179.4	177.3	-176.9	0	110	V173 L174 A179 R180 E181	V173-K177 WeakPolarHBondContact O-CB 3.39Å; V173-K177 PolarHBondContact O-N 3.38Å; L174-K177 PolarHBondContact O-N 2.76Å; K177-A179 VanDerWaalsContact C-N 3.34Å; K177-A179 PolarHBondContact O-N 3.14Å; K177-R180 PolarHBondContact O-N 2.97Å; K177-R180 VanDerWaalsContact O-N 3.1Å; K177-E181 WeakPolarHBondContact CE-OE1 3.05Å; K177-E181 WeakPolarHBondContact CG-OE1 3.4Å; K177-E181 WeakPolarHBondContact O-CG 3.44Å; K177-E181 PolarHBondContact O-N 3.16Å
178	K	82.1	Confident	80.5	Confident	140 Å²	140	96.7 Å²	96.7	61%	0.609	50%	0.495	S	S	*	.	H	α-helix	trans	-60	-39.5	177.2	-169.9	166.9	-174.5	166	0	113.1	L174 A175 L182	L174-K178 WeakPolarHBondContact O-CB 3.42Å; L174-K178 PolarHBondContact O-N 3.44Å; A175-K178 PolarHBondContact O-N 3.47Å; K178-L182 HydrophobicContact CG-CD1 4.44Å; K178-L182 PolarHBondContact O-N 3.27Å; K178-L182 VanDerWaalsContact O-N 3.07Å
179	A	79.5	Confident	78.8	Confident	58 Å²	58	100.5 Å²	100.5	48%	0.479	51%	0.508	S	S	.	.	H	α-helix	trans	-63.9	-41.3	174.3	0	0	0	0	0	112.5	A175 K177 L182 S183	A175-A179 WeakPolarHBondContact O-CB 3.4Å; A175-A179 PolarHBondContact O-N 2.91Å; K177-A179 VanDerWaalsContact C-N 3.34Å; K177-A179 PolarHBondContact O-N 3.14Å; A179-L182 PolarHBondContact O-N 3.28Å; A179-S183 PolarHBondContact O-N 3.2Å; A179-S183 PolarHBondContact O-OG 3.08Å
180	R	83.7	Confident	76.6	Confident	167 Å²	167	100.8 Å²	100.8	63%	0.63	52%	0.522	S	S	*	.	H	α-helix	trans	-67.2	-42.3	177	-77.7	-176.5	-71.9	-177.3	1.6	112.4	R176 K177 L182 S183 A184	R176-R180 WeakPolarHBondContact O-CG 3.42Å; R176-R180 PolarHBondContact O-N 2.7Å; R176-R180 VanDerWaalsContact O-N 3.13Å; R176-R180 PolarHBondContact O-NE 3.38Å; K177-R180 PolarHBondContact O-N 2.97Å; K177-R180 VanDerWaalsContact O-N 3.1Å; R180-L182 VanDerWaalsContact C-N 3.33Å; R180-L182 PolarHBondContact O-N 2.99Å; R180-S183 WeakPolarHBondContact CA-OG 3.3Å; R180-S183 PolarHBondContact O-N 3.44Å; R180-S183 PolarHBondContact O-OG 3.08Å; R180-A184 WeakPolarHBondContact O-CB 3.36Å; R180-A184 PolarHBondContact O-N 3.29Å
181	E	79.2	Confident	74.6	Confident	95 Å²	95	103.7 Å²	103.7	44%	0.444	55%	0.55	S	S	.	.	H	α-helix	trans	-60	-41.1	174.4	-71.8	167.4	-171.2	0	0	112.1	K177 A184 K185	K177-E181 WeakPolarHBondContact CE-OE1 3.05Å; K177-E181 WeakPolarHBondContact CG-OE1 3.4Å; K177-E181 WeakPolarHBondContact O-CG 3.44Å; K177-E181 PolarHBondContact O-N 3.16Å; E181-A184 PolarHBondContact O-N 2.73Å; E181-K185 WeakPolarHBondContact O-CG 3.26Å; E181-K185 PolarHBondContact O-N 3.24Å; E181-K185 VanDerWaalsContact O-N 3.08Å
182	L	75.4	Confident	72.8	Confident	102 Å²	102	105.9 Å²	105.9	53%	0.534	56%	0.558	S	S	.	*	H	α-helix	trans	-63.1	-44.4	172.8	-82	160.6	0	0	0	112.3	K178 A179 R180 L186	K178-L182 HydrophobicContact CG-CD1 4.44Å; K178-L182 PolarHBondContact O-N 3.27Å; K178-L182 VanDerWaalsContact O-N 3.07Å; A179-L182 PolarHBondContact O-N 3.28Å; R180-L182 VanDerWaalsContact C-N 3.33Å; R180-L182 PolarHBondContact O-N 2.99Å; L182-L186 PolarHBondContact O-N 2.65Å; L182-L186 VanDerWaalsContact O-N 3.14Å
183	S	74.4	Confident	71.1	Confident	66 Å²	66	109.1 Å²	109.1	46%	0.462	57%	0.573	S	S	.	*	H	α-helix	trans	-67.5	-35.7	177.8	64.4	0	0	0	0	113.4	A179 R180 L186 K187	A179-S183 PolarHBondContact O-N 3.2Å; A179-S183 PolarHBondContact O-OG 3.08Å; R180-S183 WeakPolarHBondContact CA-OG 3.3Å; R180-S183 PolarHBondContact O-N 3.44Å; R180-S183 PolarHBondContact O-OG 3.08Å; S183-L186 PolarHBondContact O-N 2.59Å; S183-K187 WeakPolarHBondContact O-CB 3.37Å; S183-K187 PolarHBondContact O-N 2.84Å
184	A	76	Confident	69.4	Low	57 Å²	57	114.4 Å²	114.4	47%	0.471	59%	0.59	S	S	.	*	H	α-helix	trans	-65.6	-47.8	177	0	0	0	0	0	110.6	R180 E181 L186 K187 D188	R180-A184 WeakPolarHBondContact O-CB 3.36Å; R180-A184 PolarHBondContact O-N 3.29Å; E181-A184 PolarHBondContact O-N 2.73Å; A184-L186 PolarHBondContact O-N 2.81Å; A184-K187 PolarHBondContact O-N 2.88Å; A184-D188 WeakPolarHBondContact O-CB 3.27Å; A184-D188 PolarHBondContact O-N 3.02Å
185	K	69.8	Low	67.7	Low	158 Å²	158	113.6 Å²	113.6	69%	0.687	59%	0.592	S	S	*	*	H	α-helix	trans	-62.3	-23.7	175.2	-71.5	-178.2	177.2	-172.5	0	113.8	E181 H189	E181-K185 WeakPolarHBondContact O-CG 3.26Å; E181-K185 PolarHBondContact O-N 3.24Å; E181-K185 VanDerWaalsContact O-N 3.08Å; K185-H189 PolarHBondContact O-CD2 3.38Å
186	L	61.6	Low	66.3	Low	98 Å²	98	116 Å²	116	51%	0.513	60%	0.596	S	S	.	*	H	α-helix	trans	-80.8	-36.8	171.6	-79.9	166.1	0	0	0	112.8	L182 S183 A184	L182-L186 PolarHBondContact O-N 2.65Å; L182-L186 VanDerWaalsContact O-N 3.14Å; S183-L186 PolarHBondContact O-N 2.59Å; A184-L186 PolarHBondContact O-N 2.81Å
187	K	60	Low	65	Low	184 Å²	184	112.3 Å²	112.3	80%	0.8	60%	0.596	S	S	*	*	H	α-helix	trans	-80.3	-31.8	-177.1	-167.5	164.3	-176.3	173.6	0	113.8	S183 A184 H189 G190	S183-K187 WeakPolarHBondContact O-CB 3.37Å; S183-K187 PolarHBondContact O-N 2.84Å; A184-K187 PolarHBondContact O-N 2.88Å; K187-H189 VanDerWaalsContact C-N 3.26Å; K187-H189 PolarHBondContact O-N 3.41Å; K187-G190 PolarHBondContact O-N 2.95Å
188	D	58.5	Low	63.5	Low	152 Å²	152	110.3 Å²	110.3	81%	0.813	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	-24.8	177.2	-155.1	40.4	0	0	0	112.2	A184 G190	A184-D188 WeakPolarHBondContact O-CB 3.27Å; A184-D188 PolarHBondContact O-N 3.02Å; D188-G190 PolarHBondContact O-N 3.21Å
189	H	54.2	Low	62.1	Low	114 Å²	114	108.9 Å²	108.9	53%	0.528	59%	0.594	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.4	32.7	172.4	-89.9	-56.2	0	0	0	114.1	K185 K187 A191 K192	K185-H189 PolarHBondContact O-CD2 3.38Å; K187-H189 VanDerWaalsContact C-N 3.26Å; K187-H189 PolarHBondContact O-N 3.41Å; H189-A191 PolarHBondContact O-N 2.87Å; H189-K192 HydrophobicContact CB-CD 3.88Å; H189-K192 HydrophobicContact CB-CG 4.11Å; H189-K192 VanDerWaalsContact O-CB 3.28Å; H189-K192 WeakPolarHBondContact O-CB 3.22Å; H189-K192 WeakPolarHBondContact O-CG 3.37Å; H189-K192 PolarHBondContact O-N 3.47Å
190	G	45.3	Very low	61.2	Low	72 Å²	72	113.4 Å²	113.4	74%	0.742	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.3	-11.8	180	0	0	0	0	0	115.9	K187 D188 K192	K187-G190 PolarHBondContact O-N 2.95Å; D188-G190 PolarHBondContact O-N 3.21Å; G190-K192 VanDerWaalsContact C-N 3.29Å; G190-K192 PolarHBondContact O-N 3.24Å
191	A	50.5	Low	60	Low	84 Å²	84	109.9 Å²	109.9	69%	0.694	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	9.1	172.8	0	0	0	0	0	114.6	H189 E193 K194	H189-A191 PolarHBondContact O-N 2.87Å; A191-E193 PolarHBondContact O-N 2.69Å; A191-K194 PolarHBondContact O-N 3.28Å
192	K	50.5	Low	58.6	Low	92 Å²	92	110 Å²	110	40%	0.4	61%	0.613	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.7	-19.2	-164.3	-108	177.6	-180	175.2	0	117.7	H189 G190 K194 A195 L196	H189-K192 HydrophobicContact CB-CD 3.88Å; H189-K192 HydrophobicContact CB-CG 4.11Å; H189-K192 VanDerWaalsContact O-CB 3.28Å; H189-K192 WeakPolarHBondContact O-CB 3.22Å; H189-K192 WeakPolarHBondContact O-CG 3.37Å; H189-K192 PolarHBondContact O-N 3.47Å; G190-K192 VanDerWaalsContact C-N 3.29Å; G190-K192 PolarHBondContact O-N 3.24Å; K192-K194 VanDerWaalsContact C-N 3.27Å; K192-K194 PolarHBondContact O-N 3.33Å; K192-A195 PolarHBondContact O-N 2.86Å; K192-A195 VanDerWaalsContact O-N 3.13Å; K192-L196 PolarHBondContact O-N 3.46Å; K192-L196 VanDerWaalsContact O-N 3.1Å
193	E	55.3	Low	57.2	Low	174 Å²	174	109.4 Å²	109.4	81%	0.813	62%	0.618	S	S	*	*	H	α-helix	trans	-62.2	-35.6	176.4	-72.9	-156.7	134.6	0	0	112.5	A191 A195 L196 S197	A191-E193 PolarHBondContact O-N 2.69Å; E193-A195 VanDerWaalsContact C-N 3.27Å; E193-A195 PolarHBondContact O-N 3.11Å; E193-L196 PolarHBondContact O-N 2.83Å; E193-S197 PolarHBondContact O-N 2.71Å
194	K	54.8	Low	56.1	Low	186 Å²	186	110.9 Å²	110.9	81%	0.809	63%	0.628	S	S	*	*	H	α-helix	trans	-73.3	-17.1	177.1	-66.8	-172.1	177.5	-176.6	0	113.7	A191 K192 S197	A191-K194 PolarHBondContact O-N 3.28Å; K192-K194 VanDerWaalsContact C-N 3.27Å; K192-K194 PolarHBondContact O-N 3.33Å; K194-S197 PolarHBondContact O-OG 2.85Å
195	A	52.7	Low	55	Low	49 Å²	49	112.2 Å²	112.2	41%	0.405	64%	0.639	S	S	.	*	H	α-helix	trans	-87.4	-33.4	173.7	0	0	0	0	0	112.1	K192 E193 S198 L199	K192-A195 PolarHBondContact O-N 2.86Å; K192-A195 VanDerWaalsContact O-N 3.13Å; E193-A195 VanDerWaalsContact C-N 3.27Å; E193-A195 PolarHBondContact O-N 3.11Å; A195-S198 PolarHBondContact O-N 3.37Å; A195-L199 PolarHBondContact O-N 2.89Å
196	L	57	Low	54.3	Low	111 Å²	111	110.7 Å²	110.7	58%	0.581	63%	0.634	S	S	*	*	H	α-helix	trans	-69.2	-36.7	178.2	-80.2	163.2	0	0	0	112.7	K192 E193 S198 L199 N200	K192-L196 PolarHBondContact O-N 3.46Å; K192-L196 VanDerWaalsContact O-N 3.1Å; E193-L196 PolarHBondContact O-N 2.83Å; L196-S198 VanDerWaalsContact C-N 3.32Å; L196-S198 PolarHBondContact O-N 2.69Å; L196-L199 PolarHBondContact O-N 2.72Å; L196-N200 PolarHBondContact O-N 3.06Å
197	S	58.5	Low	53.8	Low	85 Å²	85	111.1 Å²	111.1	59%	0.594	64%	0.636	S	S	*	*	H	α-helix	trans	-66.8	-32	174.5	62.9	0	0	0	0	113.1	E193 K194	E193-S197 PolarHBondContact O-N 2.71Å; K194-S197 PolarHBondContact O-OG 2.85Å
198	S	54.2	Low	53.3	Low	72 Å²	72	107.8 Å²	107.8	50%	0.503	63%	0.631	S	S	.	*	H	α-helix	trans	-80.3	-22.6	179.5	-164.8	0	0	0	0	113.8	A195 L196 S201	A195-S198 PolarHBondContact O-N 3.37Å; L196-S198 VanDerWaalsContact C-N 3.32Å; L196-S198 PolarHBondContact O-N 2.69Å; S198-S201 PolarHBondContact O-OG 2.81Å
199	L	53.8	Low	52.6	Low	110 Å²	110	105.9 Å²	105.9	58%	0.576	63%	0.63	S	S	*	*	H	α-helix	trans	-79.1	-22.9	174.7	-82.3	164.5	0	0	0	112.8	A195 L196 S201 M202	A195-L199 PolarHBondContact O-N 2.89Å; L196-L199 PolarHBondContact O-N 2.72Å; L199-S201 PolarHBondContact O-N 3.43Å; L199-M202 PolarHBondContact O-N 3.4Å
200	N	60.2	Low	52.2	Low	153 Å²	153	108.4 Å²	108.4	82%	0.818	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.2	-2.2	173	-85	5.3	0	0	0	114.2	L196	L196-N200 PolarHBondContact O-N 3.06Å
201	S	57.5	Low	52.4	Low	94 Å²	94	108.4 Å²	108.4	66%	0.657	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.3	7.9	175	73.4	0	0	0	0	114.3	S198 L199	S198-S201 PolarHBondContact O-OG 2.81Å; L199-S201 PolarHBondContact O-N 3.43Å
202	M	50.7	Low	52.2	Low	96 Å²	96	109.3 Å²	109.3	47%	0.473	64%	0.64	S	S	.	*	S	Bend	trans	-105.8	136.1	-179.9	-68.9	-167.8	175.5	0	0	112.8	L199	L199-M202 PolarHBondContact O-N 3.4Å
203	S	46.5	Very low	52.1	Low	91 Å²	91	113.5 Å²	113.5	64%	0.636	66%	0.663	S	S	*	*			trans	-73.8	154	-173.6	-173.5	0	0	0	0	113.3	A205 Q206	S203-A205 PolarHBondContact O-N 3.45Å; S203-Q206 PolarHBondContact O-N 3.12Å
204	S	50.9	Low	51.7	Low	96 Å²	96	112.1 Å²	112.1	67%	0.671	66%	0.656	S	S	*	*	G	3₁₀ helix	trans	-51.9	-25.7	-164.7	-44.2	0	0	0	0	116.2	Q206	S204-Q206 VanDerWaalsContact C-N 3.34Å; S204-Q206 PolarHBondContact O-N 2.91Å
205	A	52.3	Low	51	Low	85 Å²	85	108.6 Å²	108.6	70%	0.702	66%	0.655	S	S	*	*	G	3₁₀ helix	trans	-67.1	-28.8	-177.8	0	0	0	0	0	114	S203	S203-A205 PolarHBondContact O-N 3.45Å
206	Q	54.9	Low	50.4	Low	127 Å²	127	115.9 Å²	115.9	59%	0.593	68%	0.677	S	S	*	*	G	3₁₀ helix	trans	-82	-14.4	-176	-74.1	174.2	-107.8	0	0	114.1	S203 S204	S203-Q206 PolarHBondContact O-N 3.12Å; S204-Q206 VanDerWaalsContact C-N 3.34Å; S204-Q206 PolarHBondContact O-N 2.91Å
207	I	52.6	Low	49.8	Very low	106 Å²	106	117.1 Å²	117.1	54%	0.544	68%	0.682	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.7	-26.6	-173.8	-61.2	173.9	0	0	0	111.7	S209 M210	I207-S209 PolarHBondContact O-N 2.96Å; I207-M210 PolarHBondContact O-N 3.46Å
208	V	47.7	Very low	49.2	Very low	114 Å²	114	119.6 Å²	119.6	69%	0.691	69%	0.694	S	S	*	*	G	3₁₀ helix	trans	-67.4	-34.2	-173	-175.3	0	0	0	0	112.5	M210	V208-M210 PolarHBondContact O-N 3.33Å
209	S	44.5	Very low	48.6	Very low	113 Å²	113	120.9 Å²	120.9	79%	0.79	71%	0.708	S	S	*	*	G	3₁₀ helix	trans	-79.2	-5	-176.1	-57	0	0	0	0	115.7	I207	I207-S209 PolarHBondContact O-N 2.96Å
210	M	46.5	Very low	48	Very low	166 Å²	166	119.9 Å²	119.9	82%	0.818	72%	0.716	S	S	*	*	G	3₁₀ helix	trans	-109.7	-7.8	176.2	-79.5	-153.1	173.5	0	0	115.2	I207 V208 A212 M213	I207-M210 PolarHBondContact O-N 3.46Å; V208-M210 PolarHBondContact O-N 3.33Å; M210-A212 PolarHBondContact O-N 3.45Å; M210-M213 PolarHBondContact O-N 3.45Å
211	S	49.8	Very low	46.7	Very low	72 Å²	72	116.4 Å²	116.4	50%	0.503	72%	0.717	S	S	.	*	G	3₁₀ helix	trans	-68.8	-6.1	-175.4	-75.8	0	0	0	0	115.5	M213	S211-M213 PolarHBondContact O-N 2.98Å; S211-M213 VanDerWaalsContact O-N 3.08Å
212	A	46	Very low	45.9	Very low	103 Å²	103	119.9 Å²	119.9	85%	0.851	73%	0.727	S	S	*	*	G	3₁₀ helix	trans	-64.9	-6.9	174.4	0	0	0	0	0	114.9	M210	M210-A212 PolarHBondContact O-N 3.45Å
213	M	47.6	Very low	45.1	Very low	181 Å²	181	122.4 Å²	122.4	89%	0.892	75%	0.748	S	S	*	*	G	3₁₀ helix	trans	-115.9	-1.8	-176.9	-67.2	-162.7	178.8	0	0	116.4	M210 S211	M210-M213 PolarHBondContact O-N 3.45Å; S211-M213 PolarHBondContact O-N 2.98Å; S211-M213 VanDerWaalsContact O-N 3.08Å
214	H	46	Very low	44.6	Very low	144 Å²	144	120.9 Å²	120.9	67%	0.667	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.9	-24.4	-172.4	-133	103.9	0	0	0	116	K216	H214-K216 PolarHBondContact O-N 3.14Å
215	S	41.4	Very low	44	Very low	112 Å²	112	122.7 Å²	122.7	78%	0.783	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.9	19	-170.5	-47.2	0	0	0	0	116.5
216	K	40.1	Very low	43.3	Very low	202 Å²	202	129 Å²	129	88%	0.878	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120	4.1	-178	-122.5	172.9	-173.2	169.5	0	115.1	H214	H214-K216 PolarHBondContact O-N 3.14Å
217	M	43.3	Very low	42.3	Very low	137 Å²	137	126.7 Å²	126.7	68%	0.675	77%	0.765	S	S	*	*	S	Bend	trans	-101.5	-5.3	-175.2	-155.9	167.8	-86.3	0	0	114.5
218	T	45.7	Very low	41.3	Very low	137 Å²	137	125.7 Å²	125.7	84%	0.84	78%	0.781	S	S	*	*	S	Bend	trans	-108.6	6.1	-172.6	46.4	0	0	0	0	115.7
219	A	43.1	Very low	40.7	Very low	99 Å²	99	125 Å²	125	82%	0.818	79%	0.788	S	S	*	*	S	Bend	trans	-117.9	6.6	-172.7	0	0	0	0	0	115.5
220	A	41	Very low	40.6	Very low	90 Å²	90	125.4 Å²	125.4	74%	0.744	79%	0.788	S	S	*	*			trans	-110.4	88.6	178.7	0	0	0	0	0	110.6	L222	A220-L222 PolarHBondContact O-N 3.3Å
221	G	33.4	Very low	40.4	Very low	80 Å²	80	123.3 Å²	123.3	83%	0.825	79%	0.787	S	S	*	*			trans	-66.9	111.6	-177	0	0	0	0	0	113.2
222	L	39.1	Very low	40.1	Very low	166 Å²	166	128.1 Å²	128.1	87%	0.869	80%	0.799	S	S	*	*			trans	-134	57.8	170.4	-96.2	165	0	0	0	110.2	A220	A220-L222 PolarHBondContact O-N 3.3Å
223	T	35.6	Very low	39.8	Very low	150 Å²	150	132.4 Å²	132.4	92%	0.92	79%	0.793	S	S	*	*			trans	-90.5	105	163.2	50	0	0	0	0	108.9
224	G	35.4	Very low	39.6	Very low	58 Å²	58	132.6 Å²	132.6	60%	0.598	79%	0.792	S	S	*	*			trans	140.1	98.1	172.7	0	0	0	0	0	113
225	L	37.1	Very low	39.4	Very low	134 Å²	134	131.3 Å²	131.3	70%	0.702	80%	0.796	S	S	*	*			trans	169.5	137.8	136.8	-88.8	153.5	0	0	0	108.6
226	Y	38.8	Very low	39.4	Very low	217 Å²	217	129.1 Å²	129.1	85%	0.851	79%	0.791	S	S	*	*			trans	62.9	130.6	173.6	-18.6	-73.4	0	0	0	116.3
227	G	34.1	Very low	39.8	Very low	79 Å²	79	128.5 Å²	128.5	81%	0.814	79%	0.789	S	S	*	*			cis	167.2	121.8	-7.3	0	0	0	0	0	111.9
228	G	31.3	Very low	40.2	Very low	85 Å²	85	127.7 Å²	127.7	88%	0.876	79%	0.794	S	S	*	*			trans	46.8	108.1	155.8	0	0	0	0	0	122.8
229	A	34.8	Very low	40.1	Very low	100 Å²	100	126 Å²	126	83%	0.826	79%	0.785	S	S	*	*				-179.4	128.1	129.9	0	0	0	0	0	111.5
230	P	41.8	Very low	40.3	Very low	122 Å²	122	126.5 Å²	126.5	79%	0.792	78%	0.783	S	S	*	*			trans	-112.4	-167.5	176.1	44	-34	0	0	0	111.9
231	P	44	Very low	40.7	Very low	122 Å²	122	127.9 Å²	127.9	79%	0.792	78%	0.784	S	S	*	*				-126.3	167.4	-80.9	38.8	-23.5	0	0	0	113.1
232	F	42.4	Very low	41.3	Very low	172 Å²	172	129.4 Å²	129.4	75%	0.754	78%	0.78	S	S	*	*			trans	-155.1	136.7	168	-152.2	-168.1	0	0	0	114.2
233	W	40.3	Very low	41.6	Very low	193 Å²	193	126.7 Å²	126.7	73%	0.731	77%	0.774	S	S	*	*			trans	69.3	99.2	172	-55.3	114	0	0	0	120.7
234	Q	42.9	Very low	41.9	Very low	186 Å²	186	125.2 Å²	125.2	87%	0.869	77%	0.765	S	S	*	*				-106	164.5	127.3	-65	-176.9	-32.6	0	0	107.5
235	P	42.4	Very low	42.2	Very low	116 Å²	116	130.3 Å²	130.3	75%	0.753	78%	0.778	S	S	*	*				-156.2	169.2	92.7	38.6	-19	0	0	0	117.4
236	G	41	Very low	42.4	Very low	67 Å²	67	128.5 Å²	128.5	69%	0.691	78%	0.782	S	S	*	*			trans	132.4	71.1	164.7	0	0	0	0	0	115
237	F	47.6	Very low	42.5	Very low	188 Å²	188	124.5 Å²	124.5	83%	0.825	78%	0.781	S	S	*	*				63.2	145.8	87.8	-78.4	-75.5	0	0	0	116.6
238	P	51.6	Low	43	Very low	120 Å²	120	126.4 Å²	126.4	78%	0.779	78%	0.779	S	S	*	*			cis	-128.7	168.4	-4.4	40.4	-24.8	0	0	0	116.1
239	P	45.1	Very low	43.4	Very low	102 Å²	102	130 Å²	130	66%	0.662	78%	0.777	S	S	*	*			trans	-126.5	171.3	-179.5	42.5	-30.5	0	0	0	117.2
240	S	46.7	Very low	43.7	Very low	110 Å²	110	129.2 Å²	129.2	77%	0.769	77%	0.771	S	S	*	*			trans	75.3	163.7	152	85.6	0	0	0	0	117.5
241	P	49.6	Very low	43.5	Very low	119 Å²	119	128.2 Å²	128.2	77%	0.773	77%	0.767	S	S	*	*			cis	-130.4	170.3	22.6	41.9	-25.1	0	0	0	118.6
242	P	46.3	Very low	43.5	Very low	112 Å²	112	128.5 Å²	128.5	73%	0.727	77%	0.766	S	S	*	*			trans	-114.9	-166	178.6	43.9	-34.3	0	0	0	114.4
243	S	45.5	Very low	43.5	Very low	108 Å²	108	126.7 Å²	126.7	76%	0.755	77%	0.769	S	S	*	*			trans	89.8	150.3	176.7	-27.2	0	0	0	0	114
244	T	42.3	Very low	43.5	Very low	119 Å²	119	122.5 Å²	122.5	73%	0.73	77%	0.769	S	S	*	*			cis	-156.8	150.3	21	15.5	0	0	0	0	112.3
245	L	41.3	Very low	43.7	Very low	165 Å²	165	118.8 Å²	118.8	86%	0.864	76%	0.761	S	S	*	*			trans	46.4	147.8	144.7	-88.8	85.2	0	0	0	124.8
246	A	40.9	Very low	43.8	Very low	96 Å²	96	119 Å²	119	79%	0.793	76%	0.76	S	S	*	*			trans	106.5	117.2	140.3	0	0	0	0	0	120.2
247	T	39.8	Very low	43.7	Very low	134 Å²	134	122.1 Å²	122.1	82%	0.822	76%	0.761	S	S	*	*			trans	-89.8	-174.3	168.6	49.7	0	0	0	0	111.5
248	P	44.9	Very low	43.7	Very low	118 Å²	118	119.2 Å²	119.2	77%	0.766	76%	0.759	S	S	*	*				-130.1	-155.5	-63.8	41	-23.2	0	0	0	111
249	L	39.7	Very low	43.4	Very low	161 Å²	161	119.7 Å²	119.7	84%	0.843	76%	0.759	S	S	*	*			trans	100.6	134.5	152.2	-167.3	63.4	0	0	0	119.7
250	A	40.9	Very low	42.9	Very low	84 Å²	84	121.2 Å²	121.2	69%	0.694	76%	0.762	S	S	*	*			trans	67.5	147.9	158.6	0	0	0	0	0	119
251	S	39.4	Very low	42.9	Very low	101 Å²	101	124.4 Å²	124.4	71%	0.706	77%	0.767	S	S	*	*			cis	-173.6	173.7	-13.2	54	0	0	0	0	109.9
252	V	42.3	Very low	42.4	Very low	128 Å²	128	128.5 Å²	128.5	78%	0.776	77%	0.772	S	S	*	*			trans	71	135.5	156.5	170.9	0	0	0	0	115.1
253	T	42.3	Very low	42.2	Very low	133 Å²	133	128.4 Å²	128.4	82%	0.816	77%	0.771	S	S	*	*			cis	-149.6	169.1	16.4	-11.9	0	0	0	0	112.3
254	S	41.3	Very low	42.1	Very low	105 Å²	105	133.3 Å²	133.3	73%	0.734	78%	0.78	S	S	*	*			trans	-118.2	-162.3	171.7	62.5	0	0	0	0	110.4
255	P	47.5	Very low	41.8	Very low	108 Å²	108	132.4 Å²	132.4	70%	0.701	78%	0.778	S	S	*	*			cis	-135.6	-158.6	-17.9	34.9	-12.1	0	0	0	114.1
256	T	43.8	Very low	42	Very low	120 Å²	120	130.4 Å²	130.4	74%	0.736	78%	0.775	S	S	*	*			trans	105.4	137.9	171.3	67.7	0	0	0	0	116
257	D	40.2	Very low	41.6	Very low	133 Å²	133	132.7 Å²	132.7	71%	0.711	77%	0.773	S	S	*	*			cis	-162	151	-14.4	-110.2	-34.2	0	0	0	112.6
258	V	47.1	Very low	41.5	Very low	128 Å²	128	134.1 Å²	134.1	78%	0.776	78%	0.776	S	S	*	*			trans	41.4	150.3	154.9	-48.8	0	0	0	0	122.1
259	V	44.2	Very low	40.8	Very low	130 Å²	130	134 Å²	134	79%	0.788	77%	0.773	S	S	*	*			cis	-143.6	140.8	15.2	-75.8	0	0	0	0	108.7
260	D	35.5	Very low	40.7	Very low	133 Å²	133	130.8 Å²	130.8	71%	0.711	77%	0.77	S	S	*	*				76.4	119	63.1	-164.7	39.2	0	0	0	118.3
261	M	46.3	Very low	40.2	Very low	178 Å²	178	131.1 Å²	131.1	88%	0.877	77%	0.772	S	S	*	*				176	150.3	126.8	-94.2	173	-177.3	0	0	114.8
262	K	38.8	Very low	39.9	Very low	205 Å²	205	131 Å²	131	89%	0.891	78%	0.778	S	S	*	*			trans	-122.2	173.2	-169.9	-118.3	-169.2	165.2	171.7	0	112.8
263	P	42	Very low	39.5	Very low	109 Å²	109	129.5 Å²	129.5	71%	0.708	78%	0.779	S	S	*	*			trans	-92.1	160.3	-168.5	37.8	-37	0	0	0	115.1
264	F	44	Very low	39	Very low	211 Å²	211	130.1 Å²	130.1	93%	0.925	78%	0.782	S	S	*	*			trans	-153	144.6	173.2	-123.2	-99.7	0	0	0	113.5
265	S	36	Very low	38.8	Very low	101 Å²	101	130.2 Å²	130.2	71%	0.706	79%	0.789	S	S	*	*			trans	-117.1	174.5	160.2	-44	0	0	0	0	107.5
266	P	45.7	Very low	38.3	Very low	122 Å²	122	130.1 Å²	130.1	79%	0.792	80%	0.798	S	S	*	*			cis	-133.2	-151.6	-5.6	42.2	-22.9	0	0	0	112
267	L	32.1	Very low	38	Very low	145 Å²	145	131.2 Å²	131.2	76%	0.759	80%	0.804	S	S	*	*			trans	83.1	117	160.3	-162	75.6	0	0	0	118.3
268	N	37.1	Very low	37.8	Very low	163 Å²	163	130.6 Å²	130.6	87%	0.872	80%	0.801	S	S	*	*				-155.5	156.5	128.8	-121.8	-7.5	0	0	0	113.7
269	T	31	Very low	37.5	Very low	115 Å²	115	134.6 Å²	134.6	71%	0.706	80%	0.803	S	S	*	*			trans	-103.4	173.3	-163.1	-57.9	0	0	0	0	112.6
270	A	37	Very low	37.2	Very low	95 Å²	95	131 Å²	131	79%	0.785	79%	0.792	S	S	*	*			trans	84.2	147.7	164.1	0	0	0	0	0	116.8
271	A	31.7	Very low	37.7	Very low	90 Å²	90	134.3 Å²	134.3	74%	0.744	80%	0.801	S	S	*	*			cis	-166.1	163.3	-19.3	0	0	0	0	0	110
272	A	31.8	Very low	37.4	Very low	100 Å²	100	134 Å²	134	83%	0.826	80%	0.797	S	S	*	*			trans	51.5	123.5	154.7	0	0	0	0	0	120.7
273	A	34	Very low	37.6	Very low	96 Å²	96	134.3 Å²	134.3	79%	0.793	79%	0.793	S	S	*	*				-177.1	119.1	112.8	0	0	0	0	0	113.5
274	V	31.1	Very low	37.7	Very low	146 Å²	146	134.6 Å²	134.6	89%	0.885	80%	0.795	S	S	*	*			trans	-13.2	136.7	152	-74.3	0	0	0	0	120.1
275	A	38.9	Very low	37.9	Very low	107 Å²	107	129.2 Å²	129.2	88%	0.884	78%	0.781	S	S	*	*				-170.4	140.7	115.6	0	0	0	0	0	110.9
276	A	36.5	Very low	38.1	Very low	106 Å²	106	128.9 Å²	128.9	88%	0.876	78%	0.784	S	S	*	*			trans	-115.7	172.6	-174.5	0	0	0	0	0	113.6
277	V	36.4	Very low	38.2	Very low	142 Å²	142	129.9 Å²	129.9	86%	0.861	79%	0.788	S	S	*	*			trans	-83.3	145.8	-166.2	-170.9	0	0	0	0	113.9
278	N	36.4	Very low	38.5	Very low	121 Å²	121	128.7 Å²	128.7	65%	0.647	79%	0.791	S	S	*	*			trans	-153.9	147.2	151.1	-148.9	13	0	0	0	106.1
279	Y	41.5	Very low	38.7	Very low	212 Å²	212	129.6 Å²	129.6	83%	0.831	80%	0.795	S	S	*	*			cis	-140	170.5	30.1	-53.5	-101.8	0	0	0	108.3
280	G	38.2	Very low	39.1	Very low	54 Å²	54	128.6 Å²	128.6	56%	0.557	80%	0.799	S	S	*	*			cis	149.8	153.4	7.8	0	0	0	0	0	108.8
281	F	45.3	Very low	38.9	Very low	202 Å²	202	127.3 Å²	127.3	89%	0.886	79%	0.794	S	S	*	*			trans	73.7	143.8	-176.1	-60.7	-92.8	0	0	0	117.5
282	Q	40.7	Very low	39.6	Very low	172 Å²	172	134.5 Å²	134.5	80%	0.804	80%	0.804	S	S	*	*			cis	-157.5	153.7	-26.7	-174.6	161.5	-49.2	0	0	110.4
283	R	41.3	Very low	40.1	Very low	211 Å²	211	133.7 Å²	133.7	80%	0.796	80%	0.797	S	S	*	*			trans	-72	-179.2	-178	-120.3	-157	-175.2	-166.1	2.4	113.9
284	P	44.5	Very low	40.5	Very low	116 Å²	116	135.8 Å²	135.8	75%	0.753	80%	0.803	S	S	*	*			cis	-142.6	-159.3	23.6	53.3	-32.5	0	0	0	114.7
285	P	48.6	Very low	40.8	Very low	97 Å²	97	132 Å²	132	63%	0.63	79%	0.794	S	S	*	*				-139.2	-164.7	-127.3	37.1	-9.6	0	0	0	118.3
286	A	40.8	Very low	40.7	Very low	94 Å²	94	132.5 Å²	132.5	78%	0.777	79%	0.79	S	S	*	*			trans	76.6	144	169.2	0	0	0	0	0	116.1
287	V	47.3	Very low	40.9	Very low	144 Å²	144	136 Å²	136	87%	0.873	79%	0.793	S	S	*	*			cis	-139.4	160.2	24	-84.2	0	0	0	0	113.2
288	S	37.8	Very low	40.9	Very low	119 Å²	119	134.1 Å²	134.1	83%	0.832	79%	0.787	S	S	*	*			trans	-97.6	145.6	178.7	-46.5	0	0	0	0	113.2
289	L	42.5	Very low	40.9	Very low	182 Å²	182	137.2 Å²	137.2	95%	0.953	80%	0.802	S	S	*	*			trans	-153	156	137.5	-155.1	57.1	0	0	0	111.5
290	A	38	Very low	40.6	Very low	95 Å²	95	131 Å²	131	79%	0.785	80%	0.795	S	S	*	*			trans	-99.7	154.8	-158.7	0	0	0	0	0	115.5
291	G	33.3	Very low	40.6	Very low	67 Å²	67	132.6 Å²	132.6	69%	0.691	80%	0.803	S	S	*	*			trans	86.5	95.9	135.9	0	0	0	0	0	118.4
292	Y	46.2	Very low	40.1	Very low	241 Å²	241	132.1 Å²	132.1	95%	0.945	80%	0.803	S	S	*	*			trans	-152	159.5	137.7	-115.4	-84	0	0	0	109.8
293	A	42.1	Very low	40.1	Very low	83 Å²	83	131.9 Å²	131.9	69%	0.686	80%	0.802	S	S	*	*			trans	-64.5	151.8	-161	0	0	0	0	0	116.1	G295	A293-G295 VanDerWaalsContact C-N 3.33Å; A293-G295 PolarHBondContact O-N 3Å
294	P	43.1	Very low	40.3	Very low	141 Å²	141	127.5 Å²	127.5	92%	0.916	80%	0.798	S	S	*	*			trans	-78.2	79.5	175.5	33.7	-34.9	0	0	0	111.3
295	G	38	Very low	40.7	Very low	67 Å²	67	129 Å²	129	69%	0.691	80%	0.799	S	S	*	*			trans	-81	123.5	165.8	0	0	0	0	0	111.2	A293	A293-G295 VanDerWaalsContact C-N 3.33Å; A293-G295 PolarHBondContact O-N 3Å
296	S	36.2	Very low	41.4	Very low	116 Å²	116	128.1 Å²	128.1	81%	0.811	79%	0.792	S	S	*	*			trans	53.7	91.8	160.2	-159.5	0	0	0	0	117.6
297	L	40.3	Very low	42.6	Very low	179 Å²	179	126 Å²	126	94%	0.937	77%	0.77	S	S	*	*			trans	-112.7	125.5	151.4	-75.3	178.9	0	0	0	109.9
298	S	37.5	Very low	43.7	Very low	103 Å²	103	119.8 Å²	119.8	72%	0.72	73%	0.734	S	S	*	*			trans	-67.3	133.7	-165.4	-173.5	0	0	0	0	113.6	A300	S298-A300 PolarHBondContact O-N 3.36Å; S298-A300 WeakPolarHBondContact OG-CB 3.38Å
299	L	36.5	Very low	45.2	Very low	186 Å²	186	117.7 Å²	117.7	97%	0.974	71%	0.708	S	S	*	*			trans	-78.8	64.2	174.5	-158	92.7	0	0	0	111
300	A	34.9	Very low	46.7	Very low	82 Å²	82	114.1 Å²	114.1	68%	0.678	69%	0.686	S	S	*	*			trans	-134.1	55	-169.7	0	0	0	0	0	113.6	S298	S298-A300 PolarHBondContact O-N 3.36Å; S298-A300 WeakPolarHBondContact OG-CB 3.38Å
301	A	36.8	Very low	48.4	Very low	88 Å²	88	111.3 Å²	111.3	73%	0.727	67%	0.667	S	S	*	*			trans	-150.5	36.6	-179.4	0	0	0	0	0	115.4
302	H	36.4	Very low	50.6	Low	191 Å²	191	110.5 Å²	110.5	88%	0.884	64%	0.643	S	S	*	*			trans	-140.6	45.3	169.5	-82.6	98.9	0	0	0	112.3	V304	H302-V304 PolarHBondContact O-N 3.17Å
303	H	39.2	Very low	52.4	Low	168 Å²	168	99.4 Å²	99.4	78%	0.778	60%	0.6	S	S	*	*			trans	-81.8	95.2	163.6	-151.4	-64.7	0	0	0	108.2	L305	H303-L305 PolarHBondContact O-N 3.13Å
304	V	46.1	Very low	54.6	Low	118 Å²	118	95.7 Å²	95.7	72%	0.715	57%	0.569	S	S	*	*			trans	-57.1	115.2	168.8	178.2	0	0	0	0	106.8	H302 T306	H302-V304 PolarHBondContact O-N 3.17Å; V304-T306 PolarHBondContact O-N 3Å
305	L	53.8	Low	56.9	Low	147 Å²	147	90 Å²	90	77%	0.77	53%	0.533	S	S	*	.			trans	-70.5	101.3	179.5	-73	168.8	0	0	0	108.1	H303	H303-L305 PolarHBondContact O-N 3.13Å
306	T	63	Low	59.3	Low	79 Å²	79	87.7 Å²	87.7	49%	0.485	51%	0.506	S	S	.	.			trans	-58.9	136.7	170.3	46.6	0	0	0	0	108.8	V304 A308 H350	V304-T306 PolarHBondContact O-N 3Å; T306-A308 PolarHBondContact O-N 3.23Å; T306-H350 PolarHBondContact O-CE1 3.49Å
307	P	64.8	Low	61.7	Low	49 Å²	49	86.5 Å²	86.5	32%	0.318	50%	0.497	S	S	.	.			trans	-61.2	140.7	-176.3	-22.9	33.4	0	0	0	112.1	W309 E310	P307-W309 HydrophobicContact CB-CD2 3.61Å; P307-W309 HydrophobicContact CB-CE3 4.04Å; P307-W309 HydrophobicContact CB-CG 4.23Å; P307-W309 HydrophobicContact CB-CH2 3.8Å; P307-W309 HydrophobicContact CB-CZ2 3.34Å; P307-W309 HydrophobicContact CB-CZ3 4.13Å; P307-W309 HydrophobicContact CG-CZ2 3.85Å; P307-W309 PolarHBondContact O-N 3.47Å; P307-E310 WeakPolarHBondContact O-CB 3.5Å; P307-E310 PolarHBondContact O-N 2.93Å
308	A	71.2	Confident	64.1	Low	15 Å²	15	81 Å²	81	12%	0.124	47%	0.466	C	S	.	.	T	Hydrogen-bonded Turn	trans	-46.1	-39	-176.8	0	0	0	0	0	114.4	T306 E310 R312 H350	T306-A308 PolarHBondContact O-N 3.23Å; A308-E310 VanDerWaalsContact C-N 3.33Å; A308-E310 PolarHBondContact O-N 3.2Å; A308-R312 VanDerWaalsContact O-CD 3.31Å; A308-R312 WeakPolarHBondContact O-CD 3.31Å; A308-R312 PolarHBondContact O-NH1 3.3Å; A308-H350 WeakPolarHBondContact CB-NE2 3.47Å
309	W	69.5	Low	66.8	Low	74 Å²	74	76.2 Å²	76.2	28%	0.28	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-18.4	-176.5	58.8	75.7	0	0	0	114.7	P307 G311 R312 T313 R320	P307-W309 HydrophobicContact CB-CD2 3.61Å; P307-W309 HydrophobicContact CB-CE3 4.04Å; P307-W309 HydrophobicContact CB-CG 4.23Å; P307-W309 HydrophobicContact CB-CH2 3.8Å; P307-W309 HydrophobicContact CB-CZ2 3.34Å; P307-W309 HydrophobicContact CB-CZ3 4.13Å; P307-W309 HydrophobicContact CG-CZ2 3.85Å; P307-W309 PolarHBondContact O-N 3.47Å; W309-G311 PolarHBondContact O-N 3.04Å; W309-R312 PolarHBondContact O-N 2.95Å; W309-T313 HydrophobicContact CB-CG2 3.81Å; W309-T313 PolarHBondContact O-N 3.23Å; W309-T313 PolarHBondContact O-OG1 3.11Å; W309-R320 VanDerWaalsContact CE2-NH1 3.28Å
310	E	73.3	Confident	69.5	Low	107 Å²	107	69 Å²	69	50%	0.5	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	126.8	-177.6	-171.2	166.4	-150.9	0	0	110.6	P307 A308 R312	P307-E310 WeakPolarHBondContact O-CB 3.5Å; P307-E310 PolarHBondContact O-N 2.93Å; A308-E310 VanDerWaalsContact C-N 3.33Å; A308-E310 PolarHBondContact O-N 3.2Å; E310-R312 PolarHBondContact O-N 3.12Å
311	G	73.3	Confident	72.3	Confident	36 Å²	36	65.4 Å²	65.4	37%	0.371	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.6	1.5	-174.6	0	0	0	0	0	115.5	W309 L355	W309-G311 PolarHBondContact O-N 3.04Å; G311-L355 WeakPolarHBondContact O-CG 3.46Å; G311-L355 PolarHBondContact O-N 3.12Å
312	R	81.2	Confident	74.9	Confident	50 Å²	50	61.7 Å²	61.7	19%	0.189	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.1	-18.3	-180	-60.7	-174	-175	69.5	2.3	114.5	A308 W309 E310 V348 H350 D352 L354 L355	A308-R312 VanDerWaalsContact O-CD 3.31Å; A308-R312 WeakPolarHBondContact O-CD 3.31Å; A308-R312 PolarHBondContact O-NH1 3.3Å; W309-R312 PolarHBondContact O-N 2.95Å; E310-R312 PolarHBondContact O-N 3.12Å; R312-V348 HydrophobicContact CB-CG1 3.64Å; R312-V348 HydrophobicContact CG-CG1 4.36Å; R312-H350 PolarHBondContact NH2-O 2.96Å; R312-D352 VanDerWaalsContact CD-O 3.29Å; R312-D352 WeakPolarHBondContact CD-O 3.33Å; R312-D352 PolarHBondContact NE-O 2.85Å; R312-L354 HydrophobicContact CG-CD2 4.08Å; R312-L355 WeakPolarHBondContact O-CD2 3.31Å
313	T	83.6	Confident	77.6	Confident	9 Å²	9	54.3 Å²	54.3	6%	0.055	30%	0.297	C	S	.	.	S	Bend	trans	-120.6	170.2	178.5	62.5	0	0	0	0	111.2	W309 S315 V348 L355	W309-T313 HydrophobicContact CB-CG2 3.81Å; W309-T313 PolarHBondContact O-N 3.23Å; W309-T313 PolarHBondContact O-OG1 3.11Å; T313-S315 PolarHBondContact O-N 3.42Å; T313-V348 HydrophobicContact CG2-CB 3.94Å; T313-V348 HydrophobicContact CG2-CG1 4.36Å; T313-V348 HydrophobicContact CG2-CG2 3.57Å; T313-L355 WeakPolarHBondContact O-CD1 3.3Å
314	V	88.8	Confident	80.3	Confident	5 Å²	5	47.2 Å²	47.2	3%	0.03	26%	0.264	C	S	.	.	S	Bend	trans	-72	82.5	170.5	-175.5	0	0	0	0	109.1	L321 F387 V389 L502 I504 V520	V314-L321 HydrophobicContact CB-CB 4.17Å; V314-L321 HydrophobicContact CB-CD2 4.48Å; V314-L321 HydrophobicContact CG1-CB 4.21Å; V314-L321 HydrophobicContact CG1-CD2 4.49Å; V314-L321 PolarHBondContact O-N 3.25Å; V314-F387 HydrophobicContact CG1-CB 4.28Å; V314-F387 HydrophobicContact CG1-CD2 3.75Å; V314-F387 HydrophobicContact CG1-CE2 4.23Å; V314-F387 HydrophobicContact CG1-CG 3.93Å; V314-F387 HydrophobicContact CG2-CG 4.49Å; V314-V389 HydrophobicContact CG2-CG2 4.39Å; V314-L502 HydrophobicContact CG1-CD1 4.08Å; V314-L502 HydrophobicContact CG1-CD2 3.97Å; V314-L502 HydrophobicContact CG1-CG 4.25Å; V314-I504 HydrophobicContact CG1-CD1 3.8Å; V314-I504 HydrophobicContact CG1-CG1 4Å; V314-V520 HydrophobicContact CG2-CG1 3.54Å; V314-V520 HydrophobicContact CG2-CG2 4.13Å
315	S	90.2	Very high	82.6	Confident	21 Å²	21	41.6 Å²	41.6	15%	0.147	23%	0.23	C	C	.	.	B	Isolated β-bridge	trans	-133.2	123.8	-178.2	62.7	0	0	0	0	111.5	T313 F387	T313-S315 PolarHBondContact O-N 3.42Å; S315-F387 WeakPolarHBondContact O-CZ 3.34Å
316	S	89.4	Confident	84.6	Confident	19 Å²	19	35.1 Å²	35.1	13%	0.133	20%	0.198	C	C	.	.			trans	-90.1	-175.3	164.2	78.2	0	0	0	0	110.7	K318 I319 L501	S316-K318 VanDerWaalsContact C-N 3.28Å; S316-K318 PolarHBondContact O-N 3.41Å; S316-K318 PolarHBondContact OG-N 3.05Å; S316-I319 PolarHBondContact N-O 2.94Å; S316-I319 PolarHBondContact OG-N 2.58Å; S316-I319 PolarHBondContact OG-O 3.49Å; S316-L501 WeakPolarHBondContact CB-O 3.46Å; S316-L501 PolarHBondContact OG-O 3.18Å
317	S	86.7	Confident	86.1	Confident	90 Å²	90	31.6 Å²	31.6	63%	0.629	18%	0.176	S	C	*	.	S	Bend	trans	-66.8	-24.9	176.4	42.5	0	0	0	0	114.2
318	K	90.7	Very high	87.4	Confident	64 Å²	64	29.2 Å²	29.2	28%	0.278	16%	0.16	S	C	.	.	S	Bend	trans	-111.5	-30.7	-175.4	-74.9	176.4	171	169.2	0	113.7	S316 S415 M419 E499 L501	S316-K318 VanDerWaalsContact C-N 3.28Å; S316-K318 PolarHBondContact O-N 3.41Å; S316-K318 PolarHBondContact OG-N 3.05Å; K318-S415 WeakPolarHBondContact O-CA 3.23Å; K318-S415 VanDerWaalsContact O-CB 3.26Å; K318-S415 WeakPolarHBondContact O-CB 3.3Å; K318-S415 PolarHBondContact O-OG 3.42Å; K318-M419 HydrophobicContact CB-CE 4.4Å; K318-M419 HydrophobicContact CD-CE 4.49Å; K318-E499 IonicContact NZ-OE1 2.69Å; K318-E499 PolarHBondContact NZ-OE1 3.33Å; K318-E499 IonicContact NZ-OE2 2.71Å; K318-E499 PolarHBondContact NZ-OE2 3.11Å; K318-L501 HydrophobicContact CB-CD2 4.07Å; K318-L501 HydrophobicContact CD-CD2 3.86Å
319	I	93.2	Very high	88.3	Confident	3 Å²	3	28.7 Å²	28.7	2%	0.015	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	146.8	-175.1	-157.2	169.4	0	0	0	111.4	S316 Y413 E414 I421 Y452 V492 L501 L502	S316-I319 PolarHBondContact N-O 2.94Å; S316-I319 PolarHBondContact OG-N 2.58Å; S316-I319 PolarHBondContact OG-O 3.49Å; I319-Y413 HydrophobicContact CD1-CG 4.42Å; I319-E414 WeakPolarHBondContact CA-O 3.47Å; I319-E414 WeakPolarHBondContact CG1-O 3.38Å; I319-I421 HydrophobicContact CD1-CD1 4.21Å; I319-I421 HydrophobicContact CD1-CG2 4.29Å; I319-Y452 HydrophobicContact CD1-CD2 4.22Å; I319-Y452 HydrophobicContact CD1-CE2 4.2Å; I319-V492 HydrophobicContact CD1-CG1 4.38Å; I319-L501 HydrophobicContact CG2-CB 3.74Å; I319-L502 HydrophobicContact CG2-CB 3.98Å; I319-L502 HydrophobicContact CG2-CD2 4.45Å
320	R	92.6	Very high	89	Confident	35 Å²	35	26.1 Å²	26.1	13%	0.132	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	148.3	170.4	65.3	177	-174.6	165.4	3.4	111.6	W309 Y413 E414	W309-R320 VanDerWaalsContact CE2-NH1 3.28Å; R320-Y413 CarbonylContact O-C 3.58Å; R320-Y413 VanDerWaalsContact O-CA 3.28Å; R320-Y413 WeakPolarHBondContact O-CA 3.43Å; R320-E414 HydrophobicContact CG-CB 4.01Å; R320-E414 IonicContact CZ-OE1 3.3Å; R320-E414 VanDerWaalsContact CZ-OE1 3.3Å; R320-E414 IonicContact CZ-OE2 3.74Å; R320-E414 PolarHBondContact N-O 2.73Å; R320-E414 IonicContact NE-OE1 3.19Å; R320-E414 PolarHBondContact NE-OE1 3.44Å; R320-E414 IonicContact NE-OE2 3.71Å; R320-E414 IonicContact NH2-OE1 2.76Å; R320-E414 PolarHBondContact NH2-OE1 2.55Å; R320-E414 IonicContact NH2-OE2 2.94Å; R320-E414 PolarHBondContact NH2-OE2 2.96Å; R320-E414 PolarHBondContact O-N 3.03Å
321	L	94.5	Very high	89.4	Confident	5 Å²	5	24.6 Å²	24.6	3%	0.026	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	120.5	166	176.4	67.1	0	0	0	108.7	V314 D323 F324 I344 Y413 L502 I504	V314-L321 HydrophobicContact CB-CB 4.17Å; V314-L321 HydrophobicContact CB-CD2 4.48Å; V314-L321 HydrophobicContact CG1-CB 4.21Å; V314-L321 HydrophobicContact CG1-CD2 4.49Å; V314-L321 PolarHBondContact O-N 3.25Å; L321-D323 WeakPolarHBondContact CD1-O 3.43Å; L321-F324 HydrophobicContact CD1-CB 4.1Å; L321-F324 HydrophobicContact CD2-CB 3.96Å; L321-F324 HydrophobicContact CG-CB 4.43Å; L321-I344 HydrophobicContact CD2-CD1 4.19Å; L321-Y413 HydrophobicContact CB-CD1 4.28Å; L321-Y413 HydrophobicContact CB-CE1 4.41Å; L321-Y413 HydrophobicContact CD1-CD1 3.81Å; L321-Y413 HydrophobicContact CD1-CE1 3.51Å; L321-L502 HydrophobicContact CB-CD2 4.2Å; L321-I504 HydrophobicContact CD2-CD1 3.8Å
322	C	92	Very high	89.7	Confident	10 Å²	10	25.5 Å²	25.5	7%	0.068	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	-34.1	-179.5	-67.2	0	0	0	0	113.3	S346 R412 E414	C322-S346 WeakPolarHBondContact O-CB 3.44Å; C322-S346 PolarHBondContact O-N 3.08Å; C322-S346 VanDerWaalsContact O-N 3.08Å; C322-R412 HydrophobicContact CB-CG 4.27Å; C322-R412 WeakPolarHBondContact CB-O 3.4Å; C322-R412 PolarHBondContact N-O 2.78Å; C322-E414 VanDerWaalsContact SG-CB 3.57Å
323	D	93.6	Very high	89.7	Confident	37 Å²	37	27.2 Å²	27.2	20%	0.198	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	134.9	179.5	-154.6	52.1	0	0	0	108.3	L321 R343 I344 S411 R412	L321-D323 WeakPolarHBondContact CD1-O 3.43Å; D323-R343 IonicContact OD1-CZ 2.76Å; D323-R343 IonicContact OD1-NE 3.03Å; D323-R343 IonicContact OD1-NH2 3.5Å; D323-R343 PolarHBondContact OD1-NH2 3.36Å; D323-R343 IonicContact OD2-CZ 3.38Å; D323-R343 IonicContact OD2-NH2 3.67Å; D323-R343 PolarHBondContact OD2-NH2 3.49Å; D323-I344 WeakPolarHBondContact CA-O 3.22Å; D323-S411 CarbonylContact O-C 3.53Å; D323-S411 WeakPolarHBondContact O-CA 3.41Å; D323-R412 HydrophobicContact CB-CB 4.18Å; D323-R412 PolarHBondContact N-O 2.85Å; D323-R412 PolarHBondContact O-N 3.36Å
324	F	95.6	Very high	89.7	Confident	18 Å²	18	28.9 Å²	28.9	8%	0.079	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	129.7	168.9	175.2	-87.7	0	0	0	107.7	L321 V342 R343 I344 F391 V409 D410 F506	L321-F324 HydrophobicContact CD1-CB 4.1Å; L321-F324 HydrophobicContact CD2-CB 3.96Å; L321-F324 HydrophobicContact CG-CB 4.43Å; F324-V342 HydrophobicContact CE1-CG2 4.19Å; F324-R343 CarbonylContact O-C 3.54Å; F324-R343 WeakPolarHBondContact O-CA 3.39Å; F324-I344 HydrophobicContact CB-CB 4.22Å; F324-I344 HydrophobicContact CB-CD1 4.21Å; F324-I344 HydrophobicContact CB-CG1 4.38Å; F324-I344 HydrophobicContact CD1-CD1 4.31Å; F324-I344 HydrophobicContact CD1-CG1 4.44Å; F324-I344 PolarHBondContact N-O 2.96Å; F324-I344 PolarHBondContact O-N 2.84Å; F324-F391 HydrophobicContact CD1-CZ 4.02Å; F324-F391 HydrophobicContact CE1-CE2 4.27Å; F324-F391 HydrophobicContact CE1-CZ 4.08Å; F324-V409 HydrophobicContact CD2-CG1 4.33Å; F324-V409 HydrophobicContact CE2-CG1 3.68Å; F324-V409 HydrophobicContact CZ-CG1 3.97Å; F324-D410 WeakPolarHBondContact CA-O 3.32Å; F324-F506 HydrophobicContact CE1-CZ 4.42Å; F324-F506 HydrophobicContact CE2-CZ 4.38Å; F324-F506 HydrophobicContact CZ-CE2 4.48Å; F324-F506 HydrophobicContact CZ-CZ 4.29Å
325	S	94.7	Very high	89.3	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	132.9	179.7	55.6	0	0	0	0	111.2	R338 V342 V409 D410	S325-R338 PolarHBondContact OG-NH2 3.2Å; S325-V342 WeakPolarHBondContact CA-O 3.21Å; S325-V409 CarbonylContact O-C 3.54Å; S325-V409 VanDerWaalsContact O-CA 3.32Å; S325-V409 WeakPolarHBondContact O-CA 3.28Å; S325-D410 PolarHBondContact N-O 3.13Å; S325-D410 PolarHBondContact O-N 3.2Å
326	A	95.5	Very high	88.8	Confident	12 Å²	12	36.1 Å²	36.1	10%	0.099	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	127.8	171.7	0	0	0	0	0	107.8	L341 V342 A408 V409 M459	A326-L341 WeakPolarHBondContact O-CB 3.23Å; A326-L341 PolarHBondContact O-N 3.2Å; A326-V342 HydrophobicContact CB-CG2 3.64Å; A326-V342 PolarHBondContact N-O 3.23Å; A326-V342 PolarHBondContact O-N 3.23Å; A326-A408 WeakPolarHBondContact CA-O 3.33Å; A326-V409 HydrophobicContact CB-CG2 4.13Å; A326-M459 HydrophobicContact CB-CE 3.78Å
327	Y	93.8	Very high	88.4	Confident	4 Å²	4	43.5 Å²	43.5	2%	0.016	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	158.2	-167.7	58	-85.4	0	0	0	112.4	L329 R338 H339 F407 A408 D410 R456	Y327-L329 HydrophobicContact CD2-CD1 4.41Å; Y327-L329 HydrophobicContact CD2-CG 4.01Å; Y327-L329 HydrophobicContact CE2-CD1 3.85Å; Y327-L329 HydrophobicContact CE2-CG 3.96Å; Y327-R338 VanDerWaalsContact CD1-CZ 3.46Å; Y327-R338 HydrophobicContact CD2-CG 3.82Å; Y327-R338 HydrophobicContact CG-CG 3.94Å; Y327-H339 CarbonylContact C-O 3.53Å; Y327-H339 WeakPolarHBondContact CA-O 3.39Å; Y327-H339 WeakPolarHBondContact CB-O 3.34Å; Y327-F407 WeakPolarHBondContact O-CA 3.45Å; Y327-A408 HydrophobicContact CE1-CB 4.31Å; Y327-A408 HydrophobicContact CE2-CB 3.96Å; Y327-A408 PolarHBondContact N-O 3.37Å; Y327-A408 PolarHBondContact O-N 3.4Å; Y327-D410 HydrophobicContact CE1-CB 4.2Å; Y327-D410 WeakPolarHBondContact CE1-OD1 3.48Å; Y327-D410 VanDerWaalsContact CE1-OD2 3.22Å; Y327-D410 WeakPolarHBondContact CE1-OD2 3.41Å; Y327-D410 VanDerWaalsContact OH-CG 3.29Å; Y327-D410 PolarHBondContact OH-OD1 3.14Å; Y327-D410 PolarHBondContact OH-OD2 2.78Å; Y327-R456 WeakPolarHBondContact OH-CG 3.29Å
328	C	91.7	Very high	88.6	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	132.2	169.3	-172.4	0	0	0	0	109.1	H339 F397 F407	C328-H339 PolarHBondContact N-O 3.39Å; C328-H339 PolarHBondContact O-N 3.45Å; C328-F397 HydrophobicContact CB-CD2 4.14Å; C328-F397 HydrophobicContact CB-CE2 4.36Å; C328-F407 HydrophobicContact CB-CD1 3.92Å; C328-F407 HydrophobicContact CB-CE1 3.71Å; C328-F407 HydrophobicContact CB-CZ 4.38Å; C328-F407 VanDerWaalsContact SG-CE1 3.55Å; C328-F407 VanDerWaalsContact SG-CZ 3.6Å
329	L	90.1	Very high	88.6	Confident	3 Å²	3	41.6 Å²	41.6	2%	0.016	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	101.9	164.5	-75.1	169.8	0	0	0	107.9	Y327 N331 R338 A405 L406	Y327-L329 HydrophobicContact CD2-CD1 4.41Å; Y327-L329 HydrophobicContact CD2-CG 4.01Å; Y327-L329 HydrophobicContact CE2-CD1 3.85Å; Y327-L329 HydrophobicContact CE2-CG 3.96Å; L329-N331 PolarHBondContact O-N 3.13Å; L329-R338 HydrophobicContact CD2-CB 3.82Å; L329-A405 CarbonylContact O-C 3.58Å; L329-A405 VanDerWaalsContact O-CA 3.29Å; L329-A405 WeakPolarHBondContact O-CA 3.48Å; L329-L406 HydrophobicContact CB-CB 4.3Å; L329-L406 HydrophobicContact CD1-CD2 4.38Å; L329-L406 PolarHBondContact N-O 2.89Å; L329-L406 PolarHBondContact O-N 2.46Å
330	P	84.9	Confident	88.5	Confident	20 Å²	20	44 Å²	44	13%	0.13	24%	0.241	C	C	.	.	S	Bend	trans	-59.1	-29.5	178.2	-24.5	34.7	0	0	0	112.8	R337 T404	P330-R337 VanDerWaalsContact CD-O 3.23Å; P330-R337 WeakPolarHBondContact CD-O 3.35Å; P330-T404 PolarHBondContact O-OG1 2.86Å
331	N	82.1	Confident	88.5	Confident	76 Å²	76	43 Å²	43	41%	0.406	24%	0.238	S	C	.	.	S	Bend	trans	-129.9	117	167.9	-179.9	-4.6	0	0	0	109	L329 A333 D334	L329-N331 PolarHBondContact O-N 3.13Å; N331-A333 PolarHBondContact O-N 2.87Å; N331-A333 WeakPolarHBondContact OD1-CB 3.35Å; N331-A333 PolarHBondContact OD1-N 2.78Å; N331-D334 HydrophobicContact CB-CB 4.45Å; N331-D334 PolarHBondContact O-N 2.83Å; N331-D334 VanDerWaalsContact O-N 3.13Å
332	P	79.6	Confident	88.5	Confident	55 Å²	55	43.1 Å²	43.1	36%	0.357	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-17.7	-178.4	26.8	-34.9	0	0	0	113.8	T404 L406	P332-T404 VanDerWaalsContact CD-O 3.25Å; P332-T404 WeakPolarHBondContact CD-O 3.32Å; P332-L406 HydrophobicContact CB-CB 4.26Å
333	A	81.5	Confident	88.6	Confident	85 Å²	85	46.7 Å²	46.7	70%	0.702	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-22.5	174.3	0	0	0	0	0	113.2	N331 P335	N331-A333 PolarHBondContact O-N 2.87Å; N331-A333 WeakPolarHBondContact OD1-CB 3.35Å; N331-A333 PolarHBondContact OD1-N 2.78Å; A333-P335 VanDerWaalsContact O-CD 3.29Å; A333-P335 WeakPolarHBondContact O-CD 3.29Å
334	D	82.3	Confident	88.5	Confident	45 Å²	45	45.5 Å²	45.5	24%	0.241	24%	0.244	C	C	.	.			trans	-113.2	89	-179.3	-177.1	4.4	0	0	0	110.9	N331 S336 R337	N331-D334 HydrophobicContact CB-CB 4.45Å; N331-D334 PolarHBondContact O-N 2.83Å; N331-D334 VanDerWaalsContact O-N 3.13Å; D334-S336 PolarHBondContact O-N 2.89Å; D334-S336 VanDerWaalsContact OD1-CB 3.29Å; D334-S336 WeakPolarHBondContact OD1-CB 3.25Å; D334-S336 PolarHBondContact OD1-N 2.94Å; D334-S336 PolarHBondContact OD1-OG 3.36Å; D334-S336 PolarHBondContact OD2-OG 2.9Å; D334-R337 PolarHBondContact O-N 3.19Å; D334-R337 VanDerWaalsContact OD2-CD 3.27Å; D334-R337 WeakPolarHBondContact OD2-CD 3.23Å; D334-R337 WeakPolarHBondContact OD2-CG 3.48Å; D334-R337 IonicContact OD2-NE 2.82Å; D334-R337 PolarHBondContact OD2-NE 2.85Å; D334-R337 VanDerWaalsContact OD2-NE 3.14Å
335	P	80.1	Confident	87.9	Confident	78 Å²	78	45.8 Å²	45.8	51%	0.506	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-67.4	-10.9	178.7	29.3	-35.4	0	0	0	113.9	A333 R337 R338	A333-P335 VanDerWaalsContact O-CD 3.29Å; A333-P335 WeakPolarHBondContact O-CD 3.29Å; P335-R337 VanDerWaalsContact C-N 3.31Å; P335-R338 WeakPolarHBondContact O-CB 3.44Å
336	S	80.2	Confident	86.8	Confident	100 Å²	100	47.4 Å²	47.4	70%	0.699	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-71.4	-27.8	179	76.8	0	0	0	0	112.5	D334 R338	D334-S336 PolarHBondContact O-N 2.89Å; D334-S336 VanDerWaalsContact OD1-CB 3.29Å; D334-S336 WeakPolarHBondContact OD1-CB 3.25Å; D334-S336 PolarHBondContact OD1-N 2.94Å; D334-S336 PolarHBondContact OD1-OG 3.36Å; D334-S336 PolarHBondContact OD2-OG 2.9Å; S336-R338 PolarHBondContact O-N 2.68Å
337	R	82.2	Confident	85.5	Confident	173 Å²	173	53.3 Å²	53.3	65%	0.653	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-86.1	25.1	177.9	-65	179.5	-176.4	-131.6	-4.8	113.5	P330 D334 P335 H339	P330-R337 VanDerWaalsContact CD-O 3.23Å; P330-R337 WeakPolarHBondContact CD-O 3.35Å; D334-R337 PolarHBondContact O-N 3.19Å; D334-R337 VanDerWaalsContact OD2-CD 3.27Å; D334-R337 WeakPolarHBondContact OD2-CD 3.23Å; D334-R337 WeakPolarHBondContact OD2-CG 3.48Å; D334-R337 IonicContact OD2-NE 2.82Å; D334-R337 PolarHBondContact OD2-NE 2.85Å; D334-R337 VanDerWaalsContact OD2-NE 3.14Å; P335-R337 VanDerWaalsContact C-N 3.31Å; R337-H339 PolarHBondContact O-N 2.79Å
338	R	89.2	Confident	84.4	Confident	65 Å²	65	55.1 Å²	55.1	25%	0.245	31%	0.31	C	S	.	.			trans	-65.5	114.3	175.7	173.3	175.7	158.1	139.6	-7	109.9	S325 Y327 L329 P335 S336 E340 D410	S325-R338 PolarHBondContact OG-NH2 3.2Å; Y327-R338 VanDerWaalsContact CD1-CZ 3.46Å; Y327-R338 HydrophobicContact CD2-CG 3.82Å; Y327-R338 HydrophobicContact CG-CG 3.94Å; L329-R338 HydrophobicContact CD2-CB 3.82Å; P335-R338 WeakPolarHBondContact O-CB 3.44Å; S336-R338 PolarHBondContact O-N 2.68Å; R338-E340 HydrophobicContact CG-CG 4.27Å; R338-E340 IonicContact CZ-OE1 2.97Å; R338-E340 IonicContact NE-OE1 3.42Å; R338-E340 PolarHBondContact NE-OE1 3.46Å; R338-E340 VanDerWaalsContact NE-OE1 3.12Å; R338-E340 IonicContact NH2-OE1 3.38Å; R338-E340 PolarHBondContact NH2-OE1 3.1Å; R338-D410 IonicContact CZ-OD2 3.48Å; R338-D410 IonicContact NH1-OD2 2.66Å; R338-D410 PolarHBondContact NH1-OD2 2.72Å; R338-D410 IonicContact NH2-OD2 3.49Å
339	H	90.4	Very high	83.2	Confident	49 Å²	49	58.9 Å²	58.9	23%	0.227	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	121.5	169.8	-176.4	98.3	0	0	0	110.1	Y327 C328 R337 L341 D394 S396 F397	Y327-H339 CarbonylContact C-O 3.53Å; Y327-H339 WeakPolarHBondContact CA-O 3.39Å; Y327-H339 WeakPolarHBondContact CB-O 3.34Å; C328-H339 PolarHBondContact N-O 3.39Å; C328-H339 PolarHBondContact O-N 3.45Å; R337-H339 PolarHBondContact O-N 2.79Å; H339-L341 PolarHBondContact O-N 3.13Å; H339-D394 IonicContact NE2-OD1 2.72Å; H339-D394 PolarHBondContact NE2-OD1 3.38Å; H339-D394 VanDerWaalsContact NE2-OD1 3.13Å; H339-D394 IonicContact NE2-OD2 2.77Å; H339-D394 PolarHBondContact NE2-OD2 3.36Å; H339-S396 PolarHBondContact NE2-OG 3.31Å; H339-F397 HydrophobicContact CB-CB 3.87Å; H339-F397 VanDerWaalsContact CG-CB 3.41Å
340	E	91.7	Very high	82.1	Confident	54 Å²	54	64.1 Å²	64.1	25%	0.252	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	107.6	-178.2	-58.3	-165.1	131.2	0	0	110.8	R338 R343	R338-E340 HydrophobicContact CG-CG 4.27Å; R338-E340 IonicContact CZ-OE1 2.97Å; R338-E340 IonicContact NE-OE1 3.42Å; R338-E340 PolarHBondContact NE-OE1 3.46Å; R338-E340 VanDerWaalsContact NE-OE1 3.12Å; R338-E340 IonicContact NH2-OE1 3.38Å; R338-E340 PolarHBondContact NH2-OE1 3.1Å; E340-R343 IonicContact OE1-CZ 2.71Å; E340-R343 IonicContact OE1-NH1 3.1Å; E340-R343 PolarHBondContact OE1-NH1 3.36Å; E340-R343 WeakPolarHBondContact OE2-CD 3.29Å; E340-R343 IonicContact OE2-NH1 3.4Å
341	L	93.1	Very high	81.6	Confident	14 Å²	14	67.7 Å²	67.7	7%	0.073	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	-43.3	176.3	-56.1	169.4	0	0	0	110	A326 H339 A393 D394 F397 F407 M459 I467 S516	A326-L341 WeakPolarHBondContact O-CB 3.23Å; A326-L341 PolarHBondContact O-N 3.2Å; H339-L341 PolarHBondContact O-N 3.13Å; L341-A393 CarbonylContact O-C 3.59Å; L341-A393 VanDerWaalsContact O-CA 3.25Å; L341-A393 WeakPolarHBondContact O-CA 3.36Å; L341-D394 VanDerWaalsContact CD2-O 3.31Å; L341-D394 WeakPolarHBondContact CD2-O 3.37Å; L341-D394 PolarHBondContact O-N 2.88Å; L341-F397 HydrophobicContact CD2-CD1 3.55Å; L341-F397 HydrophobicContact CD2-CE1 3.42Å; L341-F397 VanDerWaalsContact CD2-CE1 3.42Å; L341-F397 HydrophobicContact CD2-CG 4.41Å; L341-F397 HydrophobicContact CD2-CZ 4.17Å; L341-F407 HydrophobicContact CD1-CD1 4.22Å; L341-M459 HydrophobicContact CD1-CE 4.18Å; L341-I467 HydrophobicContact CD1-CD1 4.01Å; L341-S516 VanDerWaalsContact O-CB 3.25Å; L341-S516 WeakPolarHBondContact O-CB 3.31Å
342	V	94.9	Very high	81.4	Confident	8 Å²	8	67 Å²	67	5%	0.048	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	143.2	170.6	-69.3	0	0	0	0	110.7	F324 S325 A326 F391 A393	F324-V342 HydrophobicContact CE1-CG2 4.19Å; S325-V342 WeakPolarHBondContact CA-O 3.21Å; A326-V342 HydrophobicContact CB-CG2 3.64Å; A326-V342 PolarHBondContact N-O 3.23Å; A326-V342 PolarHBondContact O-N 3.23Å; V342-F391 HydrophobicContact CB-CD1 3.65Å; V342-F391 HydrophobicContact CB-CD2 4.38Å; V342-F391 HydrophobicContact CB-CE1 3.64Å; V342-F391 HydrophobicContact CB-CE2 4.31Å; V342-F391 HydrophobicContact CB-CG 4.04Å; V342-F391 HydrophobicContact CB-CZ 3.96Å; V342-F391 HydrophobicContact CG1-CB 3.74Å; V342-F391 HydrophobicContact CG1-CD1 3.58Å; V342-F391 HydrophobicContact CG1-CD2 4.07Å; V342-F391 HydrophobicContact CG1-CE1 4.11Å; V342-F391 HydrophobicContact CG1-CE2 4.49Å; V342-F391 HydrophobicContact CG1-CG 3.57Å; V342-F391 HydrophobicContact CG2-CD1 4.49Å; V342-F391 HydrophobicContact CG2-CD2 4.48Å; V342-F391 HydrophobicContact CG2-CE1 4.23Å; V342-F391 HydrophobicContact CG2-CE2 4.15Å; V342-F391 HydrophobicContact CG2-CZ 4.02Å; V342-A393 HydrophobicContact CG1-CB 3.85Å
343	R	93.4	Very high	81.5	Confident	85 Å²	85	69.6 Å²	69.6	32%	0.321	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	138.1	170.6	-176.7	173.7	-169.8	106.2	15.4	112.3	D323 F324 E340 S516 H518	D323-R343 IonicContact OD1-CZ 2.76Å; D323-R343 IonicContact OD1-NE 3.03Å; D323-R343 IonicContact OD1-NH2 3.5Å; D323-R343 PolarHBondContact OD1-NH2 3.36Å; D323-R343 IonicContact OD2-CZ 3.38Å; D323-R343 IonicContact OD2-NH2 3.67Å; D323-R343 PolarHBondContact OD2-NH2 3.49Å; F324-R343 CarbonylContact O-C 3.54Å; F324-R343 WeakPolarHBondContact O-CA 3.39Å; E340-R343 IonicContact OE1-CZ 2.71Å; E340-R343 IonicContact OE1-NH1 3.1Å; E340-R343 PolarHBondContact OE1-NH1 3.36Å; E340-R343 WeakPolarHBondContact OE2-CD 3.29Å; E340-R343 IonicContact OE2-NH1 3.4Å; R343-S516 PolarHBondContact N-OG 3.05Å; R343-H518 PolarHBondContact O-CE1 3.49Å; R343-H518 PolarHBondContact O-ND1 3.42Å
344	I	92.3	Very high	81.6	Confident	11 Å²	11	71 Å²	71	6%	0.056	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	121.5	162.6	-51.6	176	0	0	0	107	L321 D323 F324 V389 F391 F506	L321-I344 HydrophobicContact CD2-CD1 4.19Å; D323-I344 WeakPolarHBondContact CA-O 3.22Å; F324-I344 HydrophobicContact CB-CB 4.22Å; F324-I344 HydrophobicContact CB-CD1 4.21Å; F324-I344 HydrophobicContact CB-CG1 4.38Å; F324-I344 HydrophobicContact CD1-CD1 4.31Å; F324-I344 HydrophobicContact CD1-CG1 4.44Å; F324-I344 PolarHBondContact N-O 2.96Å; F324-I344 PolarHBondContact O-N 2.84Å; I344-V389 HydrophobicContact CD1-CG1 3.95Å; I344-V389 HydrophobicContact CD1-CG2 4.23Å; I344-V389 HydrophobicContact CG1-CG1 4.49Å; I344-F391 HydrophobicContact CD1-CE1 4.12Å; I344-F391 HydrophobicContact CD1-CZ 3.63Å; I344-F391 HydrophobicContact CG1-CE1 3.57Å; I344-F391 HydrophobicContact CG1-CZ 3.54Å; I344-F506 HydrophobicContact CD1-CE1 4.07Å
345	G	83.4	Confident	81.9	Confident	24 Å²	24	70.6 Å²	70.6	25%	0.247	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	143.3	172.4	0	0	0	0	0	111.3	T347	G345-T347 VanDerWaalsContact C-N 3.26Å; G345-T347 PolarHBondContact O-N 3.03Å
346	S	71.3	Confident	82.4	Confident	34 Å²	34	71.4 Å²	71.4	24%	0.238	39%	0.391	C	S	.	.			trans	-87.3	22.5	179	-172.8	0	0	0	0	114	C322 V348	C322-S346 WeakPolarHBondContact O-CB 3.44Å; C322-S346 PolarHBondContact O-N 3.08Å; C322-S346 VanDerWaalsContact O-N 3.08Å; S346-V348 PolarHBondContact O-N 3.05Å
347	T	66.9	Low	82.8	Confident	136 Å²	136	69.8 Å²	69.8	83%	0.834	38%	0.384	S	S	*	.			trans	-75.4	87.1	175.6	49.1	0	0	0	0	110.3	G345	G345-T347 VanDerWaalsContact C-N 3.26Å; G345-T347 PolarHBondContact O-N 3.03Å
348	V	70.7	Confident	83.3	Confident	42 Å²	42	63.2 Å²	63.2	26%	0.255	36%	0.362	S	S	.	.			trans	-127.1	139.3	-176.9	171.1	0	0	0	0	110.7	R312 T313 S346 D352	R312-V348 HydrophobicContact CB-CG1 3.64Å; R312-V348 HydrophobicContact CG-CG1 4.36Å; T313-V348 HydrophobicContact CG2-CB 3.94Å; T313-V348 HydrophobicContact CG2-CG1 4.36Å; T313-V348 HydrophobicContact CG2-CG2 3.57Å; S346-V348 PolarHBondContact O-N 3.05Å; V348-D352 HydrophobicContact CG1-CB 4.15Å
349	T	67.1	Low	83.4	Confident	79 Å²	79	61.6 Å²	61.6	49%	0.485	36%	0.358	S	S	.	.			trans	-107.7	165.5	178.1	71.2	0	0	0	0	110.9	A351 D352	T349-A351 PolarHBondContact O-N 3.17Å; T349-A351 PolarHBondContact OG1-N 2.99Å; T349-D352 WeakPolarHBondContact CA-OD2 3.37Å; T349-D352 PolarHBondContact N-OD2 3.01Å; T349-D352 PolarHBondContact O-N 2.88Å; T349-D352 PolarHBondContact OG1-OD2 3.22Å
350	H	67.5	Low	83.5	Confident	113 Å²	113	59.2 Å²	59.2	52%	0.523	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-18.9	174.7	-78.8	-88	0	0	0	113.8	T306 A308 R312	T306-H350 PolarHBondContact O-CE1 3.49Å; A308-H350 WeakPolarHBondContact CB-NE2 3.47Å; R312-H350 PolarHBondContact NH2-O 2.96Å
351	A	74	Confident	83.3	Confident	96 Å²	96	59.6 Å²	59.6	79%	0.793	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-17.2	-179.8	0	0	0	0	0	113.3	T349	T349-A351 PolarHBondContact O-N 3.17Å; T349-A351 PolarHBondContact OG1-N 2.99Å
352	D	78.6	Confident	83.1	Confident	62 Å²	62	65.3 Å²	65.3	33%	0.332	38%	0.382	S	S	.	.	S	Bend	trans	-69.3	146.9	-178	-63.8	-48.6	0	0	0	111.3	R312 V348 T349	R312-D352 VanDerWaalsContact CD-O 3.29Å; R312-D352 WeakPolarHBondContact CD-O 3.33Å; R312-D352 PolarHBondContact NE-O 2.85Å; V348-D352 HydrophobicContact CG1-CB 4.15Å; T349-D352 WeakPolarHBondContact CA-OD2 3.37Å; T349-D352 PolarHBondContact N-OD2 3.01Å; T349-D352 PolarHBondContact O-N 2.88Å; T349-D352 PolarHBondContact OG1-OD2 3.22Å
353	P	80.8	Confident	82.9	Confident	108 Å²	108	65.6 Å²	65.6	70%	0.701	38%	0.384	S	S	*	.	P	Polyproline II helix	trans	-64.6	152.2	-178.9	27	-34.9	0	0	0	111.9
354	L	84.1	Confident	82.6	Confident	116 Å²	116	63.3 Å²	63.3	61%	0.607	38%	0.376	S	S	*	.	P	Polyproline II helix	trans	-66.5	150.6	170.5	-63.6	176.8	0	0	0	110.6	R312 E356	R312-L354 HydrophobicContact CG-CD2 4.08Å; L354-E356 PolarHBondContact O-N 2.88Å
355	L	87.5	Confident	82.4	Confident	36 Å²	36	66.3 Å²	66.3	19%	0.188	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-61.4	127.5	178.5	-65	179.3	0	0	0	111.6	G311 R312 T313 F387 V520 R522	G311-L355 WeakPolarHBondContact O-CG 3.46Å; G311-L355 PolarHBondContact O-N 3.12Å; R312-L355 WeakPolarHBondContact O-CD2 3.31Å; T313-L355 WeakPolarHBondContact O-CD1 3.3Å; L355-F387 HydrophobicContact CD1-CD1 4.05Å; L355-F387 HydrophobicContact CD1-CE1 3.77Å; L355-V520 HydrophobicContact CD1-CG1 3.9Å; L355-V520 HydrophobicContact CD2-CB 3.69Å; L355-V520 HydrophobicContact CD2-CG1 3.75Å; L355-V520 HydrophobicContact CG-CG1 4.47Å; L355-R522 HydrophobicContact CB-CB 4.43Å
356	E	90.3	Very high	82.6	Confident	94 Å²	94	67.1 Å²	67.1	44%	0.439	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	142.2	173.1	-72.4	171.8	159.5	0	0	111	L354 R519 Y521 R522	L354-E356 PolarHBondContact O-N 2.88Å; E356-R519 IonicContact OE1-CZ 2.83Å; E356-R519 IonicContact OE1-NH2 2.46Å; E356-R519 PolarHBondContact OE1-NH2 3.01Å; E356-R519 IonicContact OE2-CZ 2.71Å; E356-R519 VanDerWaalsContact OE2-CZ 3.31Å; E356-R519 IonicContact OE2-NE 3.06Å; E356-R519 PolarHBondContact OE2-NE 3.15Å; E356-R519 VanDerWaalsContact OE2-NE 3.13Å; E356-R519 IonicContact OE2-NH2 3.75Å; E356-R519 PolarHBondContact OE2-NH2 3.15Å; E356-Y521 HydrophobicContact CB-CD1 3.86Å; E356-Y521 HydrophobicContact CB-CE1 4.3Å; E356-Y521 CarbonylContact O-C 3.58Å; E356-Y521 WeakPolarHBondContact O-CA 3.5Å; E356-Y521 VanDerWaalsContact OE2-CE1 3.23Å; E356-Y521 WeakPolarHBondContact OE2-CE1 3.49Å; E356-R522 PolarHBondContact O-N 3.22Å
357	A	90.2	Very high	83.4	Confident	67 Å²	67	65.7 Å²	65.7	55%	0.554	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.4	130.6	176.7	0	0	0	0	0	111	R522 T524	A357-R522 WeakPolarHBondContact CA-O 3.33Å; A357-T524 HydrophobicContact CB-CG2 3.97Å
358	I	92	Very high	84.1	Confident	35 Å²	35	59.9 Å²	59.9	18%	0.179	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	134.9	170.8	-71.4	-177.8	0	0	0	109.1	I360 L388 Y521 R522 T524	I358-I360 PolarHBondContact O-N 3.19Å; I358-L388 HydrophobicContact CD1-CD2 4.02Å; I358-L388 HydrophobicContact CG2-CD2 4.44Å; I358-Y521 HydrophobicContact CD1-CD1 3.34Å; I358-Y521 HydrophobicContact CD1-CD2 3.92Å; I358-Y521 HydrophobicContact CD1-CE1 3.67Å; I358-Y521 HydrophobicContact CD1-CE2 4.22Å; I358-Y521 HydrophobicContact CD1-CG 3.46Å; I358-Y521 VanDerWaalsContact CD1-CG 3.46Å; I358-Y521 HydrophobicContact CG1-CD1 3.76Å; I358-Y521 HydrophobicContact CG1-CE1 4.37Å; I358-Y521 HydrophobicContact CG1-CG 4.07Å; I358-R522 PolarHBondContact N-O 3.45Å; I358-T524 PolarHBondContact O-N 3.47Å
359	D	92.4	Very high	84.5	Confident	30 Å²	30	63.4 Å²	63.4	16%	0.16	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	119.5	175	-177.3	31.9	0	0	0	110.7	S361 Q362 T524 T526	D359-S361 PolarHBondContact O-N 3.47Å; D359-S361 WeakPolarHBondContact OD2-CB 3.43Å; D359-S361 PolarHBondContact OD2-OG 3.48Å; D359-Q362 WeakPolarHBondContact O-CB 3.29Å; D359-Q362 WeakPolarHBondContact O-CG 3.23Å; D359-Q362 PolarHBondContact O-N 2.76Å; D359-Q362 VanDerWaalsContact O-N 3.07Å; D359-T524 CarbonylContact C-O 3.55Å; D359-T524 WeakPolarHBondContact CA-O 3.39Å; D359-T526 PolarHBondContact OD1-N 2.87Å
360	I	90.9	Very high	84.9	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-60.7	-21.9	-175	-165.3	171.4	0	0	0	112.9	I358 Q362 V363 F364 L374 Y378 L523 T524 H525	I358-I360 PolarHBondContact O-N 3.19Å; I360-Q362 PolarHBondContact O-N 2.93Å; I360-Q362 VanDerWaalsContact O-N 3.13Å; I360-V363 HydrophobicContact CG1-CG2 4.08Å; I360-V363 VanDerWaalsContact O-CG2 3.3Å; I360-V363 WeakPolarHBondContact O-CG2 3.09Å; I360-V363 PolarHBondContact O-N 3.23Å; I360-F364 HydrophobicContact CB-CZ 4.28Å; I360-F364 HydrophobicContact CD1-CE1 3.85Å; I360-F364 HydrophobicContact CD1-CZ 4.14Å; I360-F364 HydrophobicContact CG1-CD1 4.31Å; I360-F364 HydrophobicContact CG1-CE1 3.64Å; I360-F364 HydrophobicContact CG1-CZ 3.84Å; I360-F364 HydrophobicContact CG2-CE1 4.4Å; I360-F364 HydrophobicContact CG2-CE2 4.15Å; I360-F364 HydrophobicContact CG2-CZ 3.7Å; I360-F364 PolarHBondContact O-N 2.99Å; I360-L374 HydrophobicContact CD1-CD1 4.27Å; I360-L374 HydrophobicContact CD1-CD2 4.38Å; I360-L374 HydrophobicContact CD1-CG 4.06Å; I360-L374 HydrophobicContact CG1-CD2 4.32Å; I360-L374 HydrophobicContact CG1-CG 4.48Å; I360-Y378 HydrophobicContact CD1-CD1 4.3Å; I360-Y378 HydrophobicContact CD1-CD2 3.33Å; I360-Y378 HydrophobicContact CD1-CE2 4.06Å; I360-Y378 HydrophobicContact CD1-CG 3.48Å; I360-Y378 VanDerWaalsContact CD1-CG 3.48Å; I360-Y378 HydrophobicContact CG2-CD1 4.49Å; I360-Y378 HydrophobicContact CG2-CE1 4.49Å; I360-L523 HydrophobicContact CB-CB 4.47Å; I360-L523 HydrophobicContact CB-CD2 4.26Å; I360-L523 HydrophobicContact CD1-CB 4.44Å; I360-L523 HydrophobicContact CD1-CD1 4.23Å; I360-L523 HydrophobicContact CG1-CD1 4.32Å; I360-L523 HydrophobicContact CG1-CD2 4.26Å; I360-T524 PolarHBondContact N-O 3.05Å; I360-H525 HydrophobicContact CG2-CB 4.34Å
361	S	88.9	Confident	85.1	Confident	62 Å²	62	64.8 Å²	64.8	43%	0.434	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-54	-31.4	173.9	82.1	0	0	0	0	113.4	D359 V363	D359-S361 PolarHBondContact O-N 3.47Å; D359-S361 WeakPolarHBondContact OD2-CB 3.43Å; D359-S361 PolarHBondContact OD2-OG 3.48Å; S361-V363 PolarHBondContact O-N 3.03Å
362	Q	88.1	Confident	85.2	Confident	133 Å²	133	64 Å²	64	62%	0.621	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-75.1	-21.8	-175.5	-57.9	-177.3	27.3	0	0	113.7	D359 I360	D359-Q362 WeakPolarHBondContact O-CB 3.29Å; D359-Q362 WeakPolarHBondContact O-CG 3.23Å; D359-Q362 PolarHBondContact O-N 2.76Å; D359-Q362 VanDerWaalsContact O-N 3.07Å; I360-Q362 PolarHBondContact O-N 2.93Å; I360-Q362 VanDerWaalsContact O-N 3.13Å
363	V	90.6	Very high	85.4	Confident	14 Å²	14	61 Å²	61	9%	0.085	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.6	-10.2	-175.2	-63.9	0	0	0	0	113.8	I360 S361 D365 K366 F367 L374 L388 L523	I360-V363 HydrophobicContact CG1-CG2 4.08Å; I360-V363 VanDerWaalsContact O-CG2 3.3Å; I360-V363 WeakPolarHBondContact O-CG2 3.09Å; I360-V363 PolarHBondContact O-N 3.23Å; S361-V363 PolarHBondContact O-N 3.03Å; V363-D365 PolarHBondContact O-N 2.83Å; V363-D365 VanDerWaalsContact O-N 3.07Å; V363-K366 PolarHBondContact O-N 2.85Å; V363-F367 HydrophobicContact CB-CD2 4.28Å; V363-F367 HydrophobicContact CB-CE2 4.18Å; V363-F367 WeakPolarHBondContact O-CD2 3.29Å; V363-L374 HydrophobicContact CG2-CD2 3.9Å; V363-L388 HydrophobicContact CG1-CD1 4.28Å; V363-L388 HydrophobicContact CG1-CD2 4Å; V363-L523 HydrophobicContact CG2-CD2 4.16Å
364	F	87.8	Confident	85.8	Confident	37 Å²	37	56 Å²	56	16%	0.162	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-25.1	-178.3	-72.2	-41.6	0	0	0	114.6	I360 K366 L374 R375	I360-F364 HydrophobicContact CB-CZ 4.28Å; I360-F364 HydrophobicContact CD1-CE1 3.85Å; I360-F364 HydrophobicContact CD1-CZ 4.14Å; I360-F364 HydrophobicContact CG1-CD1 4.31Å; I360-F364 HydrophobicContact CG1-CE1 3.64Å; I360-F364 HydrophobicContact CG1-CZ 3.84Å; I360-F364 HydrophobicContact CG2-CE1 4.4Å; I360-F364 HydrophobicContact CG2-CE2 4.15Å; I360-F364 HydrophobicContact CG2-CZ 3.7Å; I360-F364 PolarHBondContact O-N 2.99Å; F364-K366 VanDerWaalsContact C-N 3.3Å; F364-K366 PolarHBondContact O-N 2.68Å; F364-L374 HydrophobicContact CD1-CD2 4.48Å; F364-L374 HydrophobicContact CD1-CG 4.45Å; F364-L374 HydrophobicContact CE1-CG 4.38Å; F364-R375 HydrophobicContact CD1-CB 4.03Å; F364-R375 VanDerWaalsContact CE1-CA 3.46Å; F364-R375 HydrophobicContact CE1-CB 3.66Å; F364-R375 HydrophobicContact CE1-CG 4.37Å; F364-R375 HydrophobicContact CZ-CB 4.09Å; F364-R375 HydrophobicContact CZ-CG 4.3Å
365	D	87	Confident	85.9	Confident	74 Å²	74	56.1 Å²	56.1	40%	0.396	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-15.8	177.4	83.3	-41.9	0	0	0	113.8	R133 V363	R133-D365 IonicContact NH2-OD2 3.14Å; V363-D365 PolarHBondContact O-N 2.83Å; V363-D365 VanDerWaalsContact O-N 3.07Å
366	K	86.9	Confident	86	Confident	42 Å²	42	58.3 Å²	58.3	18%	0.183	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-14.5	179.7	-56.5	-58.7	-178.7	-67.6	0	114	V363 F364 T487	V363-K366 PolarHBondContact O-N 2.85Å; F364-K366 VanDerWaalsContact C-N 3.3Å; F364-K366 PolarHBondContact O-N 2.68Å; K366-T487 HydrophobicContact CB-CG2 3.8Å; K366-T487 PolarHBondContact O-OG1 3.09Å
367	F	88.3	Confident	86	Confident	3 Å²	3	54.4 Å²	54.4	1%	0.013	30%	0.298	C	S	.	.	S	Bend	trans	-117.2	161.7	-173.8	-69.6	-74	0	0	0	111.9	V363 S369 L374 T487 L489 A505 V507	V363-F367 HydrophobicContact CB-CD2 4.28Å; V363-F367 HydrophobicContact CB-CE2 4.18Å; V363-F367 WeakPolarHBondContact O-CD2 3.29Å; F367-S369 PolarHBondContact O-N 3.46Å; F367-L374 HydrophobicContact CB-CB 3.93Å; F367-L374 HydrophobicContact CB-CD2 4.14Å; F367-L374 HydrophobicContact CD2-CD2 3.55Å; F367-L374 HydrophobicContact CE2-CD2 4.24Å; F367-L374 HydrophobicContact CG-CB 4.44Å; F367-L374 HydrophobicContact CG-CD2 3.92Å; F367-T487 HydrophobicContact CE1-CG2 4.25Å; F367-T487 HydrophobicContact CZ-CG2 3.99Å; F367-L489 HydrophobicContact CD1-CB 3.97Å; F367-L489 HydrophobicContact CD1-CD1 4.33Å; F367-L489 HydrophobicContact CE1-CB 4.15Å; F367-L489 HydrophobicContact CE1-CD1 4.45Å; F367-A505 HydrophobicContact CE1-CB 4.05Å; F367-A505 HydrophobicContact CE2-CB 3.75Å; F367-A505 HydrophobicContact CZ-CB 3.45Å; F367-A505 VanDerWaalsContact CZ-CB 3.45Å; F367-V507 HydrophobicContact CZ-CG1 4.3Å
368	P	83.4	Confident	86	Confident	15 Å²	15	51.7 Å²	51.7	10%	0.097	27%	0.274	C	S	.	.			trans	-55.4	136	178.4	-26.4	36.3	0	0	0	112.4	G373 L374 C428 G431 Q433	P368-G373 WeakPolarHBondContact O-CA 3.39Å; P368-L374 PolarHBondContact O-N 3.02Å; P368-C428 VanDerWaalsContact CD-SG 3.54Å; P368-C428 WeakPolarHBondContact CG-SG 3.5Å; P368-G431 WeakPolarHBondContact CA-O 3.21Å; P368-Q433 HydrophobicContact CG-CB 4.26Å
369	S	77.9	Confident	85.9	Confident	115 Å²	115	55.8 Å²	55.8	80%	0.804	29%	0.292	S	S	*	.			trans	-102.4	139.6	170.1	54.2	0	0	0	0	110.7	F367	F367-S369 PolarHBondContact O-N 3.46Å
370	G	75.1	Confident	85.7	Confident	36 Å²	36	61.1 Å²	61.1	37%	0.371	31%	0.31	S	S	.	.	S	Bend	trans	115.2	-167.4	-174.3	0	0	0	0	0	113.1	T372 G373 E376	G370-T372 VanDerWaalsContact C-N 3.26Å; G370-T372 PolarHBondContact O-N 3.41Å; G370-G373 WeakPolarHBondContact O-CA 3.26Å; G370-G373 PolarHBondContact O-N 3.37Å; G370-E376 WeakPolarHBondContact CA-OE1 3.33Å
371	K	72.5	Confident	85.5	Confident	186 Å²	186	61.6 Å²	61.6	81%	0.809	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-22.7	-163.1	-67	-171.4	176.6	-175	0	117.6	E376	K371-E376 WeakPolarHBondContact CA-OE1 3.45Å; K371-E376 WeakPolarHBondContact CA-OE2 3.24Å; K371-E376 PolarHBondContact N-OE1 3.42Å; K371-E376 VanDerWaalsContact N-OE1 3.16Å
372	T	75.4	Confident	85.5	Confident	78 Å²	78	60.9 Å²	60.9	48%	0.479	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.6	16.2	175.3	61.2	0	0	0	0	112.1	G370	G370-T372 VanDerWaalsContact C-N 3.26Å; G370-T372 PolarHBondContact O-N 3.41Å
373	G	82.6	Confident	85.6	Confident	1 Å²	1	59.5 Å²	59.5	1%	0.01	30%	0.302	C	S	.	.	S	Bend	trans	-85.1	161	-176.6	0	0	0	0	0	113.4	P368 G370 R375 E376 L377	P368-G373 WeakPolarHBondContact O-CA 3.39Å; G370-G373 WeakPolarHBondContact O-CA 3.26Å; G370-G373 PolarHBondContact O-N 3.37Å; G373-R375 PolarHBondContact O-N 3.19Å; G373-R375 VanDerWaalsContact O-N 3.16Å; G373-E376 PolarHBondContact O-N 3.48Å; G373-L377 WeakPolarHBondContact O-CG 3.2Å; G373-L377 PolarHBondContact O-N 2.92Å; G373-L377 VanDerWaalsContact O-N 3.08Å
374	L	89.1	Confident	85.6	Confident	1 Å²	1	61.5 Å²	61.5	1%	0.005	31%	0.312	C	S	.	.	H	α-helix	trans	-57.6	-34.3	-175.3	179.5	61.7	0	0	0	112.8	I360 V363 F364 F367 P368 Y378 F386 L489	I360-L374 HydrophobicContact CD1-CD1 4.27Å; I360-L374 HydrophobicContact CD1-CD2 4.38Å; I360-L374 HydrophobicContact CD1-CG 4.06Å; I360-L374 HydrophobicContact CG1-CD2 4.32Å; I360-L374 HydrophobicContact CG1-CG 4.48Å; V363-L374 HydrophobicContact CG2-CD2 3.9Å; F364-L374 HydrophobicContact CD1-CD2 4.48Å; F364-L374 HydrophobicContact CD1-CG 4.45Å; F364-L374 HydrophobicContact CE1-CG 4.38Å; F367-L374 HydrophobicContact CB-CB 3.93Å; F367-L374 HydrophobicContact CB-CD2 4.14Å; F367-L374 HydrophobicContact CD2-CD2 3.55Å; F367-L374 HydrophobicContact CE2-CD2 4.24Å; F367-L374 HydrophobicContact CG-CB 4.44Å; F367-L374 HydrophobicContact CG-CD2 3.92Å; P368-L374 PolarHBondContact O-N 3.02Å; L374-Y378 WeakPolarHBondContact O-CB 3.28Å; L374-Y378 PolarHBondContact O-N 3.47Å; L374-F386 HydrophobicContact CD1-CD1 4Å; L374-F386 HydrophobicContact CD1-CE1 4.19Å; L374-L489 HydrophobicContact CD1-CD1 4.11Å
375	R	87.7	Confident	85.9	Confident	119 Å²	119	59.7 Å²	59.7	45%	0.449	30%	0.304	S	S	.	.	H	α-helix	trans	-62	-60	176.7	174.9	174.5	-81.5	-84.7	5	112.3	F364 G373 L377 Y378 E379	F364-R375 HydrophobicContact CD1-CB 4.03Å; F364-R375 VanDerWaalsContact CE1-CA 3.46Å; F364-R375 HydrophobicContact CE1-CB 3.66Å; F364-R375 HydrophobicContact CE1-CG 4.37Å; F364-R375 HydrophobicContact CZ-CB 4.09Å; F364-R375 HydrophobicContact CZ-CG 4.3Å; G373-R375 PolarHBondContact O-N 3.19Å; G373-R375 VanDerWaalsContact O-N 3.16Å; R375-L377 VanDerWaalsContact C-N 3.26Å; R375-L377 PolarHBondContact O-N 3.39Å; R375-Y378 PolarHBondContact O-N 2.95Å; R375-Y378 VanDerWaalsContact O-N 3.13Å; R375-E379 WeakPolarHBondContact CD-OE1 3.39Å; R375-E379 HydrophobicContact CG-CG 4.48Å; R375-E379 WeakPolarHBondContact CG-OE1 3.18Å; R375-E379 IonicContact CZ-OE1 3.75Å; R375-E379 IonicContact NH1-OE1 2.77Å; R375-E379 PolarHBondContact NH1-OE1 3.09Å; R375-E379 WeakPolarHBondContact O-CG 3.49Å; R375-E379 PolarHBondContact O-N 3.31Å
376	E	88.7	Confident	86.3	Confident	83 Å²	83	56.2 Å²	56.2	39%	0.388	29%	0.286	S	S	.	.	H	α-helix	trans	-65.8	-32.9	-176	-65.5	-172.3	-134	0	0	111.3	G370 K371 G373 R380	G370-E376 WeakPolarHBondContact CA-OE1 3.33Å; K371-E376 WeakPolarHBondContact CA-OE1 3.45Å; K371-E376 WeakPolarHBondContact CA-OE2 3.24Å; K371-E376 PolarHBondContact N-OE1 3.42Å; K371-E376 VanDerWaalsContact N-OE1 3.16Å; G373-E376 PolarHBondContact O-N 3.48Å; E376-R380 VanDerWaalsContact O-CB 3.25Å; E376-R380 WeakPolarHBondContact O-CB 3.34Å; E376-R380 PolarHBondContact O-N 3.2Å
377	L	90.2	Very high	86.7	Confident	11 Å²	11	54.5 Å²	54.5	6%	0.058	28%	0.278	C	S	.	.	H	α-helix	trans	-63	-45.9	171.6	-70.1	169.3	0	0	0	112.2	G373 R375 R380 G381 F386 L489 L491	G373-L377 WeakPolarHBondContact O-CG 3.2Å; G373-L377 PolarHBondContact O-N 2.92Å; G373-L377 VanDerWaalsContact O-N 3.08Å; R375-L377 VanDerWaalsContact C-N 3.26Å; R375-L377 PolarHBondContact O-N 3.39Å; L377-R380 PolarHBondContact O-N 2.87Å; L377-G381 PolarHBondContact O-N 3.21Å; L377-F386 HydrophobicContact CB-CE1 3.93Å; L377-F386 HydrophobicContact CB-CZ 4Å; L377-F386 WeakPolarHBondContact O-CZ 3.41Å; L377-L489 HydrophobicContact CD1-CD2 4.44Å; L377-L491 HydrophobicContact CD1-CD1 4.26Å; L377-L491 HydrophobicContact CD1-CD2 4Å; L377-L491 HydrophobicContact CD2-CD1 4.3Å; L377-L491 HydrophobicContact CD2-CD2 3.89Å
378	Y	91.4	Very high	87	Confident	11 Å²	11	54.8 Å²	54.8	4%	0.043	28%	0.28	C	S	.	.	H	α-helix	trans	-67.2	-40.9	179.1	-174.8	-85.3	0	0	0	112.1	I360 L374 R375 R380 G381 Q383 F386 H525	I360-Y378 HydrophobicContact CD1-CD1 4.3Å; I360-Y378 HydrophobicContact CD1-CD2 3.33Å; I360-Y378 HydrophobicContact CD1-CE2 4.06Å; I360-Y378 HydrophobicContact CD1-CG 3.48Å; I360-Y378 VanDerWaalsContact CD1-CG 3.48Å; I360-Y378 HydrophobicContact CG2-CD1 4.49Å; I360-Y378 HydrophobicContact CG2-CE1 4.49Å; L374-Y378 WeakPolarHBondContact O-CB 3.28Å; L374-Y378 PolarHBondContact O-N 3.47Å; R375-Y378 PolarHBondContact O-N 2.95Å; R375-Y378 VanDerWaalsContact O-N 3.13Å; Y378-R380 VanDerWaalsContact C-N 3.33Å; Y378-R380 PolarHBondContact O-N 2.67Å; Y378-G381 PolarHBondContact O-N 3.25Å; Y378-G381 VanDerWaalsContact O-N 3.15Å; Y378-Q383 HydrophobicContact CD1-CG 4.41Å; Y378-Q383 HydrophobicContact CE1-CB 4.49Å; Y378-Q383 HydrophobicContact CE1-CG 3.8Å; Y378-Q383 HydrophobicContact CE2-CB 4.08Å; Y378-Q383 HydrophobicContact CE2-CG 4.2Å; Y378-Q383 PolarHBondContact OH-OE1 2.89Å; Y378-F386 HydrophobicContact CD2-CB 3.88Å; Y378-F386 AromaticContact CD2-CD1 3.84Å; Y378-F386 HydrophobicContact CD2-CD1 3.84Å; Y378-F386 AromaticContact CD2-CD2 3.93Å; Y378-F386 HydrophobicContact CD2-CD2 3.93Å; Y378-F386 HydrophobicContact CD2-CE1 4.4Å; Y378-F386 AromaticContact CD2-CG 3.59Å; Y378-F386 HydrophobicContact CD2-CG 3.59Å; Y378-F386 HydrophobicContact CE2-CB 4.13Å; Y378-F386 HydrophobicContact CE2-CD2 4.48Å; Y378-F386 HydrophobicContact CE2-CG 4.25Å; Y378-H525 HydrophobicContact CE1-CB 3.78Å; Y378-H525 PolarHBondContact OH-N 2.71Å; Y378-H525 VanDerWaalsContact OH-N 3.11Å
379	E	89.2	Confident	87.6	Confident	120 Å²	120	54.1 Å²	54.1	56%	0.561	28%	0.275	S	S	*	.	H	α-helix	trans	-64.2	-36.3	175.7	-71.4	168.2	-171	0	0	111.6	R375	R375-E379 WeakPolarHBondContact CD-OE1 3.39Å; R375-E379 HydrophobicContact CG-CG 4.48Å; R375-E379 WeakPolarHBondContact CG-OE1 3.18Å; R375-E379 IonicContact CZ-OE1 3.75Å; R375-E379 IonicContact NH1-OE1 2.77Å; R375-E379 PolarHBondContact NH1-OE1 3.09Å; R375-E379 WeakPolarHBondContact O-CG 3.49Å; R375-E379 PolarHBondContact O-N 3.31Å
380	R	88.4	Confident	88.4	Confident	143 Å²	143	50.8 Å²	50.8	54%	0.54	25%	0.246	S	C	.	.	H	α-helix	trans	-69.7	-30.3	171.7	-169.6	177	77.4	151.1	12.5	113.1	E376 L377 Y378 L498 T500	E376-R380 VanDerWaalsContact O-CB 3.25Å; E376-R380 WeakPolarHBondContact O-CB 3.34Å; E376-R380 PolarHBondContact O-N 3.2Å; L377-R380 PolarHBondContact O-N 2.87Å; Y378-R380 VanDerWaalsContact C-N 3.33Å; Y378-R380 PolarHBondContact O-N 2.67Å; R380-L498 PolarHBondContact NH2-O 3.13Å; R380-T500 PolarHBondContact NH2-OG1 2.95Å
381	G	85.3	Confident	89.4	Confident	10 Å²	10	49 Å²	49	10%	0.103	23%	0.229	C	C	.	.	S	Bend	trans	75.3	-172	177.7	0	0	0	0	0	115.1	L377 Y378 T500	L377-G381 PolarHBondContact O-N 3.21Å; Y378-G381 PolarHBondContact O-N 3.25Å; Y378-G381 VanDerWaalsContact O-N 3.15Å; G381-T500 WeakPolarHBondContact O-CB 3.3Å; G381-T500 PolarHBondContact O-OG1 3.2Å
382	P	90.9	Very high	90.5	Very high	46 Å²	46	42.4 Å²	42.4	30%	0.299	20%	0.199	S	C	.	.			cis	-79.3	138.7	-0.1	34.6	-34	0	0	0	111.7	N384 A385 F386 T500	P382-N384 WeakPolarHBondContact CB-OD1 3.2Å; P382-N384 PolarHBondContact O-N 2.86Å; P382-N384 VanDerWaalsContact O-N 3.15Å; P382-A385 HydrophobicContact CG-CB 4.11Å; P382-A385 WeakPolarHBondContact O-CB 3.25Å; P382-A385 PolarHBondContact O-N 2.94Å; P382-F386 VanDerWaalsContact O-CD2 3.3Å; P382-F386 WeakPolarHBondContact O-CD2 3.25Å; P382-F386 WeakPolarHBondContact O-CE2 3.36Å; P382-T500 WeakPolarHBondContact CD-O 3.07Å
383	Q	90	Very high	91.4	Very high	105 Å²	105	39.3 Å²	39.3	49%	0.491	18%	0.181	S	C	.	.	G	3₁₀ helix	trans	-64.9	-23.3	-169.4	-62.2	179.7	21.9	0	0	114.1	Y378 A385 F386	Y378-Q383 HydrophobicContact CD1-CG 4.41Å; Y378-Q383 HydrophobicContact CE1-CB 4.49Å; Y378-Q383 HydrophobicContact CE1-CG 3.8Å; Y378-Q383 HydrophobicContact CE2-CB 4.08Å; Y378-Q383 HydrophobicContact CE2-CG 4.2Å; Y378-Q383 PolarHBondContact OH-OE1 2.89Å; Q383-A385 PolarHBondContact O-N 2.71Å; Q383-F386 PolarHBondContact O-N 2.77Å
384	N	90.7	Very high	91.9	Very high	55 Å²	55	39.9 Å²	39.9	29%	0.294	18%	0.183	S	C	.	.	G	3₁₀ helix	trans	-72.1	-9.5	174.6	68.9	-32.1	0	0	0	113.9	P382 F387	P382-N384 WeakPolarHBondContact CB-OD1 3.2Å; P382-N384 PolarHBondContact O-N 2.86Å; P382-N384 VanDerWaalsContact O-N 3.15Å; N384-F387 WeakPolarHBondContact O-CE2 3.44Å
385	A	93.4	Very high	91.9	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-86.8	-2.1	177.3	0	0	0	0	0	113.8	P382 Q383 F387 C503	P382-A385 HydrophobicContact CG-CB 4.11Å; P382-A385 WeakPolarHBondContact O-CB 3.25Å; P382-A385 PolarHBondContact O-N 2.94Å; Q383-A385 PolarHBondContact O-N 2.71Å; A385-F387 WeakPolarHBondContact O-CD2 3.21Å; A385-C503 PolarHBondContact O-N 2.93Å
386	F	94.8	Very high	91.7	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	122.4	-170.8	-70.4	-102.1	0	0	0	112.8	L374 L377 Y378 P382 Q383 T500 C503 L523	L374-F386 HydrophobicContact CD1-CD1 4Å; L374-F386 HydrophobicContact CD1-CE1 4.19Å; L377-F386 HydrophobicContact CB-CE1 3.93Å; L377-F386 HydrophobicContact CB-CZ 4Å; L377-F386 WeakPolarHBondContact O-CZ 3.41Å; Y378-F386 HydrophobicContact CD2-CB 3.88Å; Y378-F386 AromaticContact CD2-CD1 3.84Å; Y378-F386 HydrophobicContact CD2-CD1 3.84Å; Y378-F386 AromaticContact CD2-CD2 3.93Å; Y378-F386 HydrophobicContact CD2-CD2 3.93Å; Y378-F386 HydrophobicContact CD2-CE1 4.4Å; Y378-F386 AromaticContact CD2-CG 3.59Å; Y378-F386 HydrophobicContact CD2-CG 3.59Å; Y378-F386 HydrophobicContact CE2-CB 4.13Å; Y378-F386 HydrophobicContact CE2-CD2 4.48Å; Y378-F386 HydrophobicContact CE2-CG 4.25Å; P382-F386 VanDerWaalsContact O-CD2 3.3Å; P382-F386 WeakPolarHBondContact O-CD2 3.25Å; P382-F386 WeakPolarHBondContact O-CE2 3.36Å; Q383-F386 PolarHBondContact O-N 2.77Å; F386-T500 HydrophobicContact CE2-CG2 4.22Å; F386-T500 HydrophobicContact CZ-CG2 4.09Å; F386-C503 WeakPolarHBondContact CA-O 3.45Å; F386-C503 HydrophobicContact CD1-CB 3.58Å; F386-C503 HydrophobicContact CD2-CB 4.5Å; F386-C503 HydrophobicContact CE1-CB 3.53Å; F386-C503 WeakPolarHBondContact CE1-SG 3.42Å; F386-C503 HydrophobicContact CE2-CB 4.43Å; F386-C503 HydrophobicContact CG-CB 4.07Å; F386-C503 HydrophobicContact CZ-CB 3.94Å; F386-L523 HydrophobicContact CB-CB 3.95Å; F386-L523 HydrophobicContact CB-CD1 4.29Å; F386-L523 PolarHBondContact O-N 3.33Å
387	F	95.3	Very high	91.5	Very high	7 Å²	7	35.6 Å²	35.6	3%	0.031	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	148.1	-177.2	-61	-89	0	0	0	111	V314 S315 L355 N384 A385 L502 C503 I504 A505 V520 Y521	V314-F387 HydrophobicContact CG1-CB 4.28Å; V314-F387 HydrophobicContact CG1-CD2 3.75Å; V314-F387 HydrophobicContact CG1-CE2 4.23Å; V314-F387 HydrophobicContact CG1-CG 3.93Å; V314-F387 HydrophobicContact CG2-CG 4.49Å; S315-F387 WeakPolarHBondContact O-CZ 3.34Å; L355-F387 HydrophobicContact CD1-CD1 4.05Å; L355-F387 HydrophobicContact CD1-CE1 3.77Å; N384-F387 WeakPolarHBondContact O-CE2 3.44Å; A385-F387 WeakPolarHBondContact O-CD2 3.21Å; F387-L502 HydrophobicContact CD2-CD1 3.99Å; F387-L502 HydrophobicContact CE2-CD1 3.75Å; F387-C503 PolarHBondContact N-O 2.96Å; F387-I504 WeakPolarHBondContact O-CA 3.18Å; F387-A505 PolarHBondContact O-N 2.83Å; F387-V520 HydrophobicContact CD1-CG1 4.29Å; F387-Y521 WeakPolarHBondContact CA-O 3.5Å
388	L	95.3	Very high	90.9	Very high	9 Å²	9	41.4 Å²	41.4	5%	0.047	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	128	168.6	176.1	75.5	0	0	0	107.8	I358 V363 A505 V507 Y521 L523	I358-L388 HydrophobicContact CD1-CD2 4.02Å; I358-L388 HydrophobicContact CG2-CD2 4.44Å; V363-L388 HydrophobicContact CG1-CD1 4.28Å; V363-L388 HydrophobicContact CG1-CD2 4Å; L388-A505 CarbonylContact C-O 3.59Å; L388-A505 WeakPolarHBondContact CA-O 3.42Å; L388-A505 HydrophobicContact CD1-CB 3.71Å; L388-V507 HydrophobicContact CD1-CG1 3.89Å; L388-V507 HydrophobicContact CD1-CG2 4.11Å; L388-Y521 HydrophobicContact CD2-CD2 4.38Å; L388-Y521 PolarHBondContact N-O 2.71Å; L388-Y521 PolarHBondContact O-N 3.5Å; L388-L523 HydrophobicContact CB-CD1 4.33Å; L388-L523 HydrophobicContact CB-CD2 3.91Å; L388-L523 HydrophobicContact CB-CG 4.02Å
389	V	95.6	Very high	90.1	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	118.9	174.1	-178.4	0	0	0	0	108.2	V314 I344 F391 I504 A505 F506 V507 H518 R519 V520	V314-V389 HydrophobicContact CG2-CG2 4.39Å; I344-V389 HydrophobicContact CD1-CG1 3.95Å; I344-V389 HydrophobicContact CD1-CG2 4.23Å; I344-V389 HydrophobicContact CG1-CG1 4.49Å; V389-F391 HydrophobicContact CG1-CD1 4.37Å; V389-F391 HydrophobicContact CG1-CD2 4.37Å; V389-F391 HydrophobicContact CG1-CE1 4.14Å; V389-F391 HydrophobicContact CG1-CE2 4.2Å; V389-F391 HydrophobicContact CG1-CG 4.47Å; V389-F391 HydrophobicContact CG1-CZ 4.08Å; V389-I504 HydrophobicContact CB-CG2 4.46Å; V389-I504 HydrophobicContact CG2-CG2 3.73Å; V389-A505 PolarHBondContact N-O 2.8Å; V389-F506 HydrophobicContact CB-CD1 3.82Å; V389-F506 HydrophobicContact CB-CE1 4.05Å; V389-F506 HydrophobicContact CG1-CD1 4.35Å; V389-F506 HydrophobicContact CG1-CE1 4.49Å; V389-F506 HydrophobicContact CG2-CD1 4.46Å; V389-F506 HydrophobicContact CG2-CE1 4.25Å; V389-F506 WeakPolarHBondContact O-CA 3.48Å; V389-V507 PolarHBondContact O-N 3.04Å; V389-H518 HydrophobicContact CG1-CB 4.26Å; V389-R519 WeakPolarHBondContact CA-O 3.26Å; V389-V520 HydrophobicContact CG2-CG1 4.37Å; V389-V520 HydrophobicContact CG2-CG2 4.16Å
390	K	95.3	Very high	89.2	Confident	45 Å²	45	41.6 Å²	41.6	20%	0.196	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	123	168.4	-178.5	170.9	-179.9	-178.7	0	108.6	W392 V507 E509 H518 R519 Y521	K390-W392 HydrophobicContact CB-CH2 4.46Å; K390-W392 HydrophobicContact CB-CZ3 4.47Å; K390-W392 HydrophobicContact CD-CH2 3.69Å; K390-W392 HydrophobicContact CD-CZ2 3.6Å; K390-W392 HydrophobicContact CD-CZ3 4.39Å; K390-W392 HydrophobicContact CG-CE3 4.5Å; K390-W392 HydrophobicContact CG-CH2 3.94Å; K390-W392 HydrophobicContact CG-CZ2 4.1Å; K390-W392 HydrophobicContact CG-CZ3 4.13Å; K390-V507 WeakPolarHBondContact CA-O 3.49Å; K390-V507 HydrophobicContact CB-CG2 3.88Å; K390-V507 HydrophobicContact CG-CG2 4.11Å; K390-E509 WeakPolarHBondContact CE-OE1 3.48Å; K390-E509 WeakPolarHBondContact CE-OE2 3.44Å; K390-E509 IonicContact NZ-OE1 3.44Å; K390-E509 PolarHBondContact NZ-OE1 2.87Å; K390-E509 IonicContact NZ-OE2 2.78Å; K390-E509 PolarHBondContact NZ-OE2 3.32Å; K390-H518 CarbonylContact O-C 3.57Å; K390-H518 VanDerWaalsContact O-CA 3.23Å; K390-H518 WeakPolarHBondContact O-CA 3.41Å; K390-R519 PolarHBondContact N-O 2.86Å; K390-R519 PolarHBondContact O-N 2.94Å; K390-Y521 HydrophobicContact CB-CE2 4.04Å
391	F	96	Very high	88.6	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	142.8	173.5	-77.4	-61	0	0	0	111.4	F324 V342 I344 V389 F506 V507 F508 E509 H518	F324-F391 HydrophobicContact CD1-CZ 4.02Å; F324-F391 HydrophobicContact CE1-CE2 4.27Å; F324-F391 HydrophobicContact CE1-CZ 4.08Å; V342-F391 HydrophobicContact CB-CD1 3.65Å; V342-F391 HydrophobicContact CB-CD2 4.38Å; V342-F391 HydrophobicContact CB-CE1 3.64Å; V342-F391 HydrophobicContact CB-CE2 4.31Å; V342-F391 HydrophobicContact CB-CG 4.04Å; V342-F391 HydrophobicContact CB-CZ 3.96Å; V342-F391 HydrophobicContact CG1-CB 3.74Å; V342-F391 HydrophobicContact CG1-CD1 3.58Å; V342-F391 HydrophobicContact CG1-CD2 4.07Å; V342-F391 HydrophobicContact CG1-CE1 4.11Å; V342-F391 HydrophobicContact CG1-CE2 4.49Å; V342-F391 HydrophobicContact CG1-CG 3.57Å; V342-F391 HydrophobicContact CG2-CD1 4.49Å; V342-F391 HydrophobicContact CG2-CD2 4.48Å; V342-F391 HydrophobicContact CG2-CE1 4.23Å; V342-F391 HydrophobicContact CG2-CE2 4.15Å; V342-F391 HydrophobicContact CG2-CZ 4.02Å; I344-F391 HydrophobicContact CD1-CE1 4.12Å; I344-F391 HydrophobicContact CD1-CZ 3.63Å; I344-F391 HydrophobicContact CG1-CE1 3.57Å; I344-F391 HydrophobicContact CG1-CZ 3.54Å; V389-F391 HydrophobicContact CG1-CD1 4.37Å; V389-F391 HydrophobicContact CG1-CD2 4.37Å; V389-F391 HydrophobicContact CG1-CE1 4.14Å; V389-F391 HydrophobicContact CG1-CE2 4.2Å; V389-F391 HydrophobicContact CG1-CG 4.47Å; V389-F391 HydrophobicContact CG1-CZ 4.08Å; F391-F506 AromaticContact CD2-CD1 3.93Å; F391-F506 HydrophobicContact CD2-CD1 3.93Å; F391-F506 AromaticContact CE2-CD1 3.3Å; F391-F506 HydrophobicContact CE2-CD1 3.3Å; F391-F506 AromaticContact CE2-CE1 3.63Å; F391-F506 HydrophobicContact CE2-CE1 3.63Å; F391-F506 HydrophobicContact CE2-CG 4.13Å; F391-F506 HydrophobicContact CZ-CD1 4.17Å; F391-F506 HydrophobicContact CZ-CE1 4.08Å; F391-V507 PolarHBondContact N-O 3.17Å; F391-F508 HydrophobicContact CB-CD1 3.8Å; F391-F508 HydrophobicContact CB-CE1 4.18Å; F391-F508 HydrophobicContact CD2-CD1 4.01Å; F391-F508 AromaticContact CD2-CE1 3.5Å; F391-F508 HydrophobicContact CD2-CE1 3.5Å; F391-F508 HydrophobicContact CD2-CZ 4.1Å; F391-F508 HydrophobicContact CE2-CE1 4.24Å; F391-F508 HydrophobicContact CG-CD1 4.35Å; F391-F508 HydrophobicContact CG-CE1 4.22Å; F391-F508 CarbonylContact O-C 3.53Å; F391-F508 WeakPolarHBondContact O-CA 3.35Å; F391-E509 PolarHBondContact O-N 2.8Å; F391-H518 HydrophobicContact CD1-CB 3.56Å; F391-H518 HydrophobicContact CE1-CB 3.73Å
392	W	95.4	Very high	87.9	Confident	47 Å²	47	42.4 Å²	42.4	18%	0.178	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	96.6	158.8	-68.4	-87.6	0	0	0	106.6	K390 E509 S516 Q517 R519	K390-W392 HydrophobicContact CB-CH2 4.46Å; K390-W392 HydrophobicContact CB-CZ3 4.47Å; K390-W392 HydrophobicContact CD-CH2 3.69Å; K390-W392 HydrophobicContact CD-CZ2 3.6Å; K390-W392 HydrophobicContact CD-CZ3 4.39Å; K390-W392 HydrophobicContact CG-CE3 4.5Å; K390-W392 HydrophobicContact CG-CH2 3.94Å; K390-W392 HydrophobicContact CG-CZ2 4.1Å; K390-W392 HydrophobicContact CG-CZ3 4.13Å; W392-E509 CarbonylContact C-O 3.51Å; W392-E509 WeakPolarHBondContact CA-O 3.26Å; W392-E509 PolarHBondContact NE1-OE2 2.93Å; W392-S516 VanDerWaalsContact O-CA 3.29Å; W392-S516 WeakPolarHBondContact O-CA 3.42Å; W392-Q517 HydrophobicContact CB-CB 4.13Å; W392-Q517 HydrophobicContact CE3-CB 4.11Å; W392-Q517 PolarHBondContact N-O 3.13Å; W392-Q517 PolarHBondContact O-N 2.62Å; W392-R519 HydrophobicContact CH2-CB 4.17Å; W392-R519 HydrophobicContact CZ3-CB 3.84Å
393	A	95.1	Very high	87	Confident	12 Å²	12	48.9 Å²	48.9	10%	0.099	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	135.3	-172.9	0	0	0	0	0	111.2	L341 V342 E509 I510 S511	L341-A393 CarbonylContact O-C 3.59Å; L341-A393 VanDerWaalsContact O-CA 3.25Å; L341-A393 WeakPolarHBondContact O-CA 3.36Å; V342-A393 HydrophobicContact CG1-CB 3.85Å; A393-E509 PolarHBondContact N-O 3.05Å; A393-I510 CarbonylContact O-C 3.49Å; A393-I510 WeakPolarHBondContact O-CA 3.19Å; A393-I510 WeakPolarHBondContact O-CG2 3.25Å; A393-S511 PolarHBondContact O-N 3.01Å
394	D	92.9	Very high	86.6	Confident	13 Å²	13	47.1 Å²	47.1	7%	0.07	26%	0.255	C	S	.	.			trans	-82.9	128.7	171.5	-168.2	-3.2	0	0	0	110.1	H339 L341 S396 G515	H339-D394 IonicContact NE2-OD1 2.72Å; H339-D394 PolarHBondContact NE2-OD1 3.38Å; H339-D394 VanDerWaalsContact NE2-OD1 3.13Å; H339-D394 IonicContact NE2-OD2 2.77Å; H339-D394 PolarHBondContact NE2-OD2 3.36Å; L341-D394 VanDerWaalsContact CD2-O 3.31Å; L341-D394 WeakPolarHBondContact CD2-O 3.37Å; L341-D394 PolarHBondContact O-N 2.88Å; D394-S396 VanDerWaalsContact CG-OG 3.31Å; D394-S396 WeakPolarHBondContact OD1-CB 3.48Å; D394-S396 PolarHBondContact OD1-N 3.28Å; D394-S396 PolarHBondContact OD1-OG 3Å; D394-S396 PolarHBondContact OD2-OG 2.79Å; D394-G515 WeakPolarHBondContact OD2-CA 3.28Å
395	V	88.1	Confident	86.3	Confident	30 Å²	30	45.2 Å²	45.2	18%	0.182	25%	0.247	C	C	.	.			trans	-121.7	9.5	176.5	-59.3	0	0	0	0	112.3	F397 M479 I510	V395-F397 HydrophobicContact CB-CE1 4.44Å; V395-F397 PolarHBondContact O-N 2.7Å; V395-F397 VanDerWaalsContact O-N 3.08Å; V395-M479 HydrophobicContact CG2-SD 4.18Å; V395-I510 HydrophobicContact CG1-CD1 3.83Å; V395-I510 HydrophobicContact CG1-CG2 4.48Å; V395-I510 HydrophobicContact CG2-CD1 4.35Å; V395-I510 HydrophobicContact CG2-CG2 3.65Å
396	S	84.3	Confident	86.1	Confident	77 Å²	77	47.7 Å²	47.7	54%	0.538	26%	0.26	S	S	.	.			trans	-76.1	15.3	-178.1	70	0	0	0	0	114.3	H339 D394	H339-S396 PolarHBondContact NE2-OG 3.31Å; D394-S396 VanDerWaalsContact CG-OG 3.31Å; D394-S396 WeakPolarHBondContact OD1-CB 3.48Å; D394-S396 PolarHBondContact OD1-N 3.28Å; D394-S396 PolarHBondContact OD1-OG 3Å; D394-S396 PolarHBondContact OD2-OG 2.79Å
397	F	83.1	Confident	86	Confident	7 Å²	7	47.8 Å²	47.8	3%	0.031	26%	0.26	C	S	.	.			trans	-81.4	140.7	179.4	66.9	-79.3	0	0	0	112.6	C328 H339 L341 V395 V399 F407 I467 K471	C328-F397 HydrophobicContact CB-CD2 4.14Å; C328-F397 HydrophobicContact CB-CE2 4.36Å; H339-F397 HydrophobicContact CB-CB 3.87Å; H339-F397 VanDerWaalsContact CG-CB 3.41Å; L341-F397 HydrophobicContact CD2-CD1 3.55Å; L341-F397 HydrophobicContact CD2-CE1 3.42Å; L341-F397 VanDerWaalsContact CD2-CE1 3.42Å; L341-F397 HydrophobicContact CD2-CG 4.41Å; L341-F397 HydrophobicContact CD2-CZ 4.17Å; V395-F397 HydrophobicContact CB-CE1 4.44Å; V395-F397 PolarHBondContact O-N 2.7Å; V395-F397 VanDerWaalsContact O-N 3.08Å; F397-V399 HydrophobicContact CD2-CG2 3.56Å; F397-V399 HydrophobicContact CE2-CG2 3.64Å; F397-F407 AromaticContact CE2-CE1 3.87Å; F397-F407 HydrophobicContact CE2-CE1 3.87Å; F397-F407 AromaticContact CE2-CZ 3.86Å; F397-F407 HydrophobicContact CE2-CZ 3.86Å; F397-F407 AromaticContact CZ-CE1 3.96Å; F397-F407 HydrophobicContact CZ-CE1 3.96Å; F397-F407 HydrophobicContact CZ-CZ 4.22Å; F397-I467 HydrophobicContact CE1-CG2 4.18Å; F397-I467 HydrophobicContact CZ-CG2 3.65Å; F397-K471 HydrophobicContact CZ-CD 4.31Å; F397-K471 PolarHBondContact O-NZ 2.91Å
398	N	77.5	Confident	85.9	Confident	132 Å²	132	47.5 Å²	47.5	71%	0.706	26%	0.259	S	S	*	.			trans	-105.8	130.5	171.1	-157.6	6.9	0	0	0	111.3
399	V	76.3	Confident	86	Confident	17 Å²	17	48.6 Å²	48.6	10%	0.103	27%	0.266	C	S	.	.			trans	-118.2	115.7	177.4	176.6	0	0	0	0	106.7	F397 D401 A405	F397-V399 HydrophobicContact CD2-CG2 3.56Å; F397-V399 HydrophobicContact CE2-CG2 3.64Å; V399-D401 VanDerWaalsContact CG1-C 3.45Å; V399-D401 WeakPolarHBondContact CG1-O 3.22Å; V399-A405 HydrophobicContact CG1-CB 3.58Å; V399-A405 HydrophobicContact CG2-CB 4.26Å
400	P	69.5	Low	85.9	Confident	118 Å²	118	49.7 Å²	49.7	77%	0.766	27%	0.272	S	S	*	.	S	Bend	trans	-73.3	-30.7	-179.3	29	-33.5	0	0	0	112.4
401	D	75.2	Confident	85.9	Confident	72 Å²	72	47.8 Å²	47.8	39%	0.385	26%	0.264	S	S	.	.			trans	-134.7	114	175.5	-176.9	-7	0	0	0	109.9	V399 Q403 T404	V399-D401 VanDerWaalsContact CG1-C 3.45Å; V399-D401 WeakPolarHBondContact CG1-O 3.22Å; D401-Q403 PolarHBondContact O-N 2.89Å; D401-Q403 WeakPolarHBondContact OD1-CB 3.41Å; D401-Q403 PolarHBondContact OD1-N 3.03Å; D401-T404 HydrophobicContact CB-CG2 4.27Å; D401-T404 PolarHBondContact O-N 3.5Å; D401-T404 PolarHBondContact O-OG1 2.78Å
402	E	71.8	Confident	85.9	Confident	98 Å²	98	51.1 Å²	51.1	46%	0.458	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-20	-179.7	-60.8	-166.8	136.3	0	0	112.1	H468 K472	E402-H468 VanDerWaalsContact CD-ND1 3.27Å; E402-H468 IonicContact OE1-CE1 3.65Å; E402-H468 IonicContact OE1-CG 3.68Å; E402-H468 IonicContact OE1-ND1 2.7Å; E402-H468 PolarHBondContact OE1-ND1 2.81Å; E402-K472 IonicContact OE1-NZ 3.87Å; E402-K472 PolarHBondContact OE1-NZ 3.2Å; E402-K472 IonicContact OE2-NZ 3.29Å; E402-K472 PolarHBondContact OE2-NZ 3.44Å
403	Q	72.3	Confident	85.9	Confident	183 Å²	183	48.9 Å²	48.9	86%	0.855	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-26.8	-178.4	-57.7	-172	9.8	0	0	113.9	D401	D401-Q403 PolarHBondContact O-N 2.89Å; D401-Q403 WeakPolarHBondContact OD1-CB 3.41Å; D401-Q403 PolarHBondContact OD1-N 3.03Å
404	T	79.9	Confident	85.8	Confident	68 Å²	68	49 Å²	49	42%	0.417	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-19.9	177.9	61.4	0	0	0	0	113.2	P330 P332 D401 L406	P330-T404 PolarHBondContact O-OG1 2.86Å; P332-T404 VanDerWaalsContact CD-O 3.25Å; P332-T404 WeakPolarHBondContact CD-O 3.32Å; D401-T404 HydrophobicContact CB-CG2 4.27Å; D401-T404 PolarHBondContact O-N 3.5Å; D401-T404 PolarHBondContact O-OG1 2.78Å; T404-L406 PolarHBondContact O-N 2.86Å
405	A	85.8	Confident	85.8	Confident	14 Å²	14	48.6 Å²	48.6	12%	0.116	26%	0.264	C	S	.	.			trans	-72.5	127.1	-173.7	0	0	0	0	0	112.8	L329 V399 F407	L329-A405 CarbonylContact O-C 3.58Å; L329-A405 VanDerWaalsContact O-CA 3.29Å; L329-A405 WeakPolarHBondContact O-CA 3.48Å; V399-A405 HydrophobicContact CG1-CB 3.58Å; V399-A405 HydrophobicContact CG2-CB 4.26Å; A405-F407 HydrophobicContact CB-CE2 4.17Å
406	L	89.6	Confident	86	Confident	52 Å²	52	50.7 Å²	50.7	27%	0.272	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	112.5	173.5	177.5	62.6	0	0	0	110	L329 P332 T404 A408 P458	L329-L406 HydrophobicContact CB-CB 4.3Å; L329-L406 HydrophobicContact CD1-CD2 4.38Å; L329-L406 PolarHBondContact N-O 2.89Å; L329-L406 PolarHBondContact O-N 2.46Å; P332-L406 HydrophobicContact CB-CB 4.26Å; T404-L406 PolarHBondContact O-N 2.86Å; L406-A408 HydrophobicContact CG-CB 4.25Å; L406-P458 HydrophobicContact CD1-CB 4.41Å
407	F	92	Very high	86.3	Confident	3 Å²	3	50.5 Å²	50.5	1%	0.013	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	119.6	166.4	-67.6	-89.8	0	0	0	109.2	Y327 C328 L341 F397 A405 M459 N464 I467 H468	Y327-F407 WeakPolarHBondContact O-CA 3.45Å; C328-F407 HydrophobicContact CB-CD1 3.92Å; C328-F407 HydrophobicContact CB-CE1 3.71Å; C328-F407 HydrophobicContact CB-CZ 4.38Å; C328-F407 VanDerWaalsContact SG-CE1 3.55Å; C328-F407 VanDerWaalsContact SG-CZ 3.6Å; L341-F407 HydrophobicContact CD1-CD1 4.22Å; F397-F407 AromaticContact CE2-CE1 3.87Å; F397-F407 HydrophobicContact CE2-CE1 3.87Å; F397-F407 AromaticContact CE2-CZ 3.86Å; F397-F407 HydrophobicContact CE2-CZ 3.86Å; F397-F407 AromaticContact CZ-CE1 3.96Å; F397-F407 HydrophobicContact CZ-CE1 3.96Å; F397-F407 HydrophobicContact CZ-CZ 4.22Å; A405-F407 HydrophobicContact CB-CE2 4.17Å; F407-M459 HydrophobicContact CB-CB 4.12Å; F407-M459 HydrophobicContact CB-CE 4.23Å; F407-M459 HydrophobicContact CB-CG 4.16Å; F407-M459 HydrophobicContact CB-SD 3.98Å; F407-M459 PolarHBondContact O-N 2.79Å; F407-N464 WeakPolarHBondContact CB-OD1 3.28Å; F407-N464 HydrophobicContact CD2-CB 4.45Å; F407-I467 HydrophobicContact CD1-CD1 4.06Å; F407-I467 HydrophobicContact CE1-CD1 4.35Å; F407-I467 HydrophobicContact CE1-CG2 3.98Å; F407-I467 HydrophobicContact CZ-CG2 4.46Å; F407-H468 AromaticContact CE2-CE1 3.98Å; F407-H468 AromaticContact CE2-NE2 3.48Å; F407-H468 WeakPolarHBondContact CE2-NE2 3.43Å; F407-H468 AromaticContact CZ-NE2 3.89Å
408	A	94	Very high	86.7	Confident	0 Å²	0	54 Å²	54	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	162.4	-174.6	0	0	0	0	0	112.7	A326 Y327 L406 S457 M459	A326-A408 WeakPolarHBondContact CA-O 3.33Å; Y327-A408 HydrophobicContact CE1-CB 4.31Å; Y327-A408 HydrophobicContact CE2-CB 3.96Å; Y327-A408 PolarHBondContact N-O 3.37Å; Y327-A408 PolarHBondContact O-N 3.4Å; L406-A408 HydrophobicContact CG-CB 4.25Å; A408-S457 CarbonylContact C-O 3.6Å; A408-S457 VanDerWaalsContact CA-O 3.26Å; A408-S457 WeakPolarHBondContact CA-O 3.47Å; A408-M459 VanDerWaalsContact O-CE 3.28Å; A408-M459 WeakPolarHBondContact O-CE 3.36Å
409	V	95.8	Very high	87.5	Confident	32 Å²	32	48.8 Å²	48.8	19%	0.194	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	133.3	173.9	-176.8	0	0	0	0	108.7	F324 S325 A326 S457 M459	F324-V409 HydrophobicContact CD2-CG1 4.33Å; F324-V409 HydrophobicContact CE2-CG1 3.68Å; F324-V409 HydrophobicContact CZ-CG1 3.97Å; S325-V409 CarbonylContact O-C 3.54Å; S325-V409 VanDerWaalsContact O-CA 3.32Å; S325-V409 WeakPolarHBondContact O-CA 3.28Å; A326-V409 HydrophobicContact CB-CG2 4.13Å; V409-S457 PolarHBondContact N-O 2.99Å; V409-S457 WeakPolarHBondContact O-CB 3.42Å; V409-S457 PolarHBondContact O-N 3.49Å; V409-M459 HydrophobicContact CG2-CE 4.02Å; V409-M459 HydrophobicContact CG2-CG 4.07Å
410	D	95.2	Very high	88.4	Confident	24 Å²	24	48.7 Å²	48.7	13%	0.128	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	137.6	163	-56.2	-25.2	0	0	0	108.9	F324 S325 Y327 R338 I454 R456	F324-D410 WeakPolarHBondContact CA-O 3.32Å; S325-D410 PolarHBondContact N-O 3.13Å; S325-D410 PolarHBondContact O-N 3.2Å; Y327-D410 HydrophobicContact CE1-CB 4.2Å; Y327-D410 WeakPolarHBondContact CE1-OD1 3.48Å; Y327-D410 VanDerWaalsContact CE1-OD2 3.22Å; Y327-D410 WeakPolarHBondContact CE1-OD2 3.41Å; Y327-D410 VanDerWaalsContact OH-CG 3.29Å; Y327-D410 PolarHBondContact OH-OD1 3.14Å; Y327-D410 PolarHBondContact OH-OD2 2.78Å; R338-D410 IonicContact CZ-OD2 3.48Å; R338-D410 IonicContact NH1-OD2 2.66Å; R338-D410 PolarHBondContact NH1-OD2 2.72Å; R338-D410 IonicContact NH2-OD2 3.49Å; D410-I454 CarbonylContact C-O 3.5Å; D410-I454 VanDerWaalsContact CA-O 3.27Å; D410-I454 WeakPolarHBondContact CA-O 3.46Å; D410-R456 PolarHBondContact OD1-N 2.66Å
411	S	95.2	Very high	89.6	Confident	4 Å²	4	43 Å²	43	3%	0.028	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	139.7	168.2	64.7	0	0	0	0	112.2	D323 Y413 I454	D323-S411 CarbonylContact O-C 3.53Å; D323-S411 WeakPolarHBondContact O-CA 3.41Å; S411-Y413 VanDerWaalsContact OG-CE2 3.28Å; S411-Y413 WeakPolarHBondContact OG-CE2 3.23Å; S411-Y413 PolarHBondContact OG-OH 3.4Å; S411-I454 PolarHBondContact N-O 3.1Å; S411-I454 PolarHBondContact O-N 2.6Å
412	R	95.1	Very high	90.6	Very high	71 Å²	71	40.4 Å²	40.4	27%	0.268	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	122.1	179.8	-177.5	173.9	178.2	-96.5	-13.1	110.2	C322 D323 E414 V451 Y452 R453	C322-R412 HydrophobicContact CB-CG 4.27Å; C322-R412 WeakPolarHBondContact CB-O 3.4Å; C322-R412 PolarHBondContact N-O 2.78Å; D323-R412 HydrophobicContact CB-CB 4.18Å; D323-R412 PolarHBondContact N-O 2.85Å; D323-R412 PolarHBondContact O-N 3.36Å; R412-E414 IonicContact NH2-OE2 2.68Å; R412-V451 HydrophobicContact CG-CG1 4.12Å; R412-Y452 WeakPolarHBondContact CA-O 3.5Å; R412-R453 HydrophobicContact CG-CG 4.22Å
413	Y	94.8	Very high	91.8	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	158.5	176	-48.3	-93.6	0	0	0	110.6	I319 R320 L321 S411 I421 V423 V451 Y452 Q490 V492 L502	I319-Y413 HydrophobicContact CD1-CG 4.42Å; R320-Y413 CarbonylContact O-C 3.58Å; R320-Y413 VanDerWaalsContact O-CA 3.28Å; R320-Y413 WeakPolarHBondContact O-CA 3.43Å; L321-Y413 HydrophobicContact CB-CD1 4.28Å; L321-Y413 HydrophobicContact CB-CE1 4.41Å; L321-Y413 HydrophobicContact CD1-CD1 3.81Å; L321-Y413 HydrophobicContact CD1-CE1 3.51Å; S411-Y413 VanDerWaalsContact OG-CE2 3.28Å; S411-Y413 WeakPolarHBondContact OG-CE2 3.23Å; S411-Y413 PolarHBondContact OG-OH 3.4Å; Y413-I421 HydrophobicContact CD2-CD1 4.24Å; Y413-V423 HydrophobicContact CE2-CG2 4.17Å; Y413-V451 WeakPolarHBondContact O-CA 3.46Å; Y413-Y452 PolarHBondContact N-O 3.28Å; Y413-Y452 PolarHBondContact O-N 2.93Å; Y413-Q490 VanDerWaalsContact OH-CD 3.28Å; Y413-Q490 PolarHBondContact OH-NE2 2.66Å; Y413-Q490 PolarHBondContact OH-OE1 3.15Å; Y413-V492 HydrophobicContact CE1-CG2 3.96Å; Y413-L502 HydrophobicContact CD1-CD2 4.46Å; Y413-L502 HydrophobicContact CE1-CD2 4.45Å
414	E	93.8	Very high	92.8	Very high	14 Å²	14	27.6 Å²	27.6	7%	0.065	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	136.8	179.7	-166.8	-172	112.2	0	0	110.8	I319 R320 C322 R412 R449 F450 V451	I319-E414 WeakPolarHBondContact CA-O 3.47Å; I319-E414 WeakPolarHBondContact CG1-O 3.38Å; R320-E414 HydrophobicContact CG-CB 4.01Å; R320-E414 IonicContact CZ-OE1 3.3Å; R320-E414 VanDerWaalsContact CZ-OE1 3.3Å; R320-E414 IonicContact CZ-OE2 3.74Å; R320-E414 PolarHBondContact N-O 2.73Å; R320-E414 IonicContact NE-OE1 3.19Å; R320-E414 PolarHBondContact NE-OE1 3.44Å; R320-E414 IonicContact NE-OE2 3.71Å; R320-E414 IonicContact NH2-OE1 2.76Å; R320-E414 PolarHBondContact NH2-OE1 2.55Å; R320-E414 IonicContact NH2-OE2 2.94Å; R320-E414 PolarHBondContact NH2-OE2 2.96Å; R320-E414 PolarHBondContact O-N 3.03Å; C322-E414 VanDerWaalsContact SG-CB 3.57Å; R412-E414 IonicContact NH2-OE2 2.68Å; E414-R449 HydrophobicContact CG-CB 3.66Å; E414-R449 HydrophobicContact CG-CG 4.1Å; E414-R449 VanDerWaalsContact OE1-CD 3.27Å; E414-R449 WeakPolarHBondContact OE1-CD 3.24Å; E414-R449 VanDerWaalsContact OE1-CG 3.32Å; E414-R449 WeakPolarHBondContact OE1-CG 3Å; E414-R449 IonicContact OE1-CZ 3.54Å; E414-R449 IonicContact OE1-NE 3.71Å; E414-R449 IonicContact OE1-NH1 2.69Å; E414-R449 PolarHBondContact OE1-NH1 2.82Å; E414-F450 CarbonylContact C-O 3.56Å; E414-F450 VanDerWaalsContact CA-O 3.31Å; E414-F450 WeakPolarHBondContact CA-O 3.43Å; E414-V451 HydrophobicContact CG-CG2 4.32Å
415	S	93.7	Very high	93.6	Very high	4 Å²	4	25.7 Å²	25.7	3%	0.028	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	157.5	-179.1	-175.2	0	0	0	0	111.4	K318 D417 F450	K318-S415 WeakPolarHBondContact O-CA 3.23Å; K318-S415 VanDerWaalsContact O-CB 3.26Å; K318-S415 WeakPolarHBondContact O-CB 3.3Å; K318-S415 PolarHBondContact O-OG 3.42Å; S415-D417 PolarHBondContact OG-N 3.41Å; S415-D417 VanDerWaalsContact OG-N 3.13Å; S415-D417 PolarHBondContact OG-O 2.84Å; S415-F450 PolarHBondContact N-O 3.09Å; S415-F450 PolarHBondContact O-N 3.46Å
416	S	91	Very high	94	Very high	74 Å²	74	25.4 Å²	25.4	52%	0.517	15%	0.148	S	C	.	.	S	Bend	trans	-74	-27.4	166.1	52.5	0	0	0	0	112.7	F450	S416-F450 WeakPolarHBondContact O-CD2 3.36Å; S416-F450 WeakPolarHBondContact O-CE2 3.34Å
417	D	91	Very high	94.2	Very high	73 Å²	73	23.3 Å²	23.3	39%	0.39	14%	0.137	S	C	.	.	S	Bend	trans	-115.4	147.1	-166.3	-44.6	-20.3	0	0	0	110.8	S415 M419 F450 Y452	S415-D417 PolarHBondContact OG-N 3.41Å; S415-D417 VanDerWaalsContact OG-N 3.13Å; S415-D417 PolarHBondContact OG-O 2.84Å; D417-M419 HydrophobicContact CB-CE 3.71Å; D417-M419 PolarHBondContact O-N 2.85Å; D417-F450 WeakPolarHBondContact O-CD2 3.3Å; D417-Y452 PolarHBondContact O-OH 2.94Å
418	S	92.1	Very high	94.2	Very high	80 Å²	80	23.2 Å²	23.2	56%	0.559	14%	0.137	S	C	*	.			trans	-81.2	105.4	176.3	178.2	0	0	0	0	110.1	P443	S418-P443 WeakPolarHBondContact OG-CG 3.43Å
419	M	93.6	Very high	94.1	Very high	24 Å²	24	24.7 Å²	24.7	12%	0.118	15%	0.147	C	C	.	.			trans	-140.9	147	177.4	63.4	-175	79.3	0	0	110.6	K318 D417 I421 P443 Y452 T494 L501	K318-M419 HydrophobicContact CB-CE 4.4Å; K318-M419 HydrophobicContact CD-CE 4.49Å; D417-M419 HydrophobicContact CB-CE 3.71Å; D417-M419 PolarHBondContact O-N 2.85Å; M419-I421 HydrophobicContact CG-CG2 4Å; M419-I421 HydrophobicContact SD-CG2 4.48Å; M419-P443 WeakPolarHBondContact O-CD 3.46Å; M419-Y452 PolarHBondContact N-OH 2.85Å; M419-Y452 WeakPolarHBondContact O-CE1 3.45Å; M419-Y452 PolarHBondContact O-OH 2.87Å; M419-T494 HydrophobicContact CB-CG2 4.34Å; M419-L501 HydrophobicContact SD-CD1 3.44Å; M419-L501 WeakPolarHBondContact SD-CD1 3.4Å; M419-L501 HydrophobicContact SD-CD2 3.76Å; M419-L501 HydrophobicContact SD-CG 4.25Å
420	A	95.2	Very high	93.7	Very high	14 Å²	14	30.1 Å²	30.1	12%	0.116	17%	0.168	C	C	.	.			trans	-78.1	133.8	168.3	0	0	0	0	0	109.3	Y442 K495	A420-Y442 HydrophobicContact CB-CD1 4Å; A420-Y442 HydrophobicContact CB-CE1 4.06Å; A420-K495 HydrophobicContact CB-CB 3.77Å; A420-K495 HydrophobicContact CB-CD 3.92Å; A420-K495 WeakPolarHBondContact O-CB 3.16Å; A420-K495 PolarHBondContact O-N 3.49Å
421	I	95.8	Very high	93.2	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	149.7	-179.2	69.9	171.8	0	0	0	111.6	I319 Y413 M419 V423 H440 E441 Y452 V492 T493 L501	I319-I421 HydrophobicContact CD1-CD1 4.21Å; I319-I421 HydrophobicContact CD1-CG2 4.29Å; Y413-I421 HydrophobicContact CD2-CD1 4.24Å; M419-I421 HydrophobicContact CG-CG2 4Å; M419-I421 HydrophobicContact SD-CG2 4.48Å; I421-V423 HydrophobicContact CD1-CG2 4.15Å; I421-V423 HydrophobicContact CG1-CG2 4.49Å; I421-H440 WeakPolarHBondContact O-CA 3.41Å; I421-E441 HydrophobicContact CD1-CB 4.25Å; I421-E441 HydrophobicContact CG1-CB 3.79Å; I421-E441 PolarHBondContact N-O 2.9Å; I421-E441 PolarHBondContact O-N 2.71Å; I421-Y452 HydrophobicContact CD1-CD1 3.72Å; I421-Y452 HydrophobicContact CD1-CD2 4.08Å; I421-Y452 HydrophobicContact CD1-CE1 4.38Å; I421-Y452 HydrophobicContact CD1-CG 3.54Å; I421-Y452 HydrophobicContact CG1-CD1 3.75Å; I421-Y452 HydrophobicContact CG1-CE1 4.19Å; I421-Y452 HydrophobicContact CG1-CG 4.13Å; I421-Y452 HydrophobicContact CG2-CD1 4.38Å; I421-Y452 HydrophobicContact CG2-CE1 3.99Å; I421-V492 HydrophobicContact CB-CG1 4.17Å; I421-V492 HydrophobicContact CD1-CG1 4.13Å; I421-T493 WeakPolarHBondContact CA-O 3.38Å; I421-L501 HydrophobicContact CG2-CD1 3.79Å
422	S	95.9	Very high	92.9	Very high	16 Å²	16	36.6 Å²	36.6	11%	0.112	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	116.7	173.9	-174.4	0	0	0	0	108.6	V438 H440 V492 T493	S422-V438 WeakPolarHBondContact OG-CG1 3.34Å; S422-H440 PolarHBondContact OG-CE1 3.07Å; S422-H440 PolarHBondContact OG-ND1 2.56Å; S422-V492 WeakPolarHBondContact O-CA 3.47Å; S422-T493 PolarHBondContact N-O 2.88Å; S422-T493 PolarHBondContact O-N 3.27Å
423	V	95.9	Very high	92.7	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	101.4	179.5	-174.9	0	0	0	0	108.3	Y413 I421 V438 E439 I454 Q490 V492	Y413-V423 HydrophobicContact CE2-CG2 4.17Å; I421-V423 HydrophobicContact CD1-CG2 4.15Å; I421-V423 HydrophobicContact CG1-CG2 4.49Å; V423-V438 WeakPolarHBondContact O-CA 3.38Å; V423-E439 PolarHBondContact N-O 3.07Å; V423-E439 PolarHBondContact O-N 2.78Å; V423-I454 HydrophobicContact CB-CD1 4.06Å; V423-I454 HydrophobicContact CG1-CD1 4.31Å; V423-I454 HydrophobicContact CG2-CD1 3.93Å; V423-Q490 HydrophobicContact CG1-CG 3.92Å; V423-V492 HydrophobicContact CG1-CG2 4.43Å; V423-V492 HydrophobicContact CG2-CG1 4.33Å; V423-V492 HydrophobicContact CG2-CG2 4.26Å
424	S	94.7	Very high	92.5	Very high	12 Å²	12	40.1 Å²	40.1	8%	0.084	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	126.1	169.4	164.9	0	0	0	0	109.4	E436 K437 Q490 L491	S424-E436 PolarHBondContact OG-OE1 2.79Å; S424-K437 CarbonylContact C-O 3.51Å; S424-K437 WeakPolarHBondContact CA-O 3.38Å; S424-Q490 CarbonylContact O-C 3.52Å; S424-Q490 WeakPolarHBondContact O-CA 3.31Å; S424-L491 PolarHBondContact N-O 3.2Å; S424-L491 PolarHBondContact O-N 2.87Å
425	T	95.1	Very high	92.5	Very high	28 Å²	28	41.4 Å²	41.4	17%	0.172	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	105.7	175.7	-57.8	0	0	0	0	108.8	E436 K437 I488 Q490	T425-E436 WeakPolarHBondContact O-CA 3.37Å; T425-K437 PolarHBondContact N-O 3.17Å; T425-K437 PolarHBondContact O-N 2.99Å; T425-I488 HydrophobicContact CG2-CG2 3.52Å; T425-Q490 PolarHBondContact OG1-NE2 3.19Å
426	K	93.8	Very high	92.5	Very high	9 Å²	9	44.8 Å²	44.8	4%	0.039	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	114.4	-177.1	-66.1	168.7	-178.5	-81.9	0	110.5	V435 E436 I488 L489	K426-V435 CarbonylContact C-O 3.56Å; K426-V435 WeakPolarHBondContact CA-O 3.36Å; K426-E436 VanDerWaalsContact CE-OE1 3.23Å; K426-E436 WeakPolarHBondContact CE-OE1 3.49Å; K426-E436 HydrophobicContact CG-CB 4.08Å; K426-E436 HydrophobicContact CG-CG 3.84Å; K426-E436 IonicContact NZ-OE1 3.72Å; K426-E436 PolarHBondContact NZ-OE1 2.89Å; K426-E436 VanDerWaalsContact NZ-OE1 3.1Å; K426-E436 IonicContact NZ-OE2 2.7Å; K426-E436 PolarHBondContact NZ-OE2 3.48Å; K426-I488 WeakPolarHBondContact O-CA 3.47Å; K426-L489 HydrophobicContact CB-CB 4.4Å; K426-L489 PolarHBondContact N-O 2.76Å; K426-L489 PolarHBondContact O-N 2.69Å
427	V	94.6	Very high	92.6	Very high	8 Å²	8	44.5 Å²	44.5	5%	0.048	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	126.4	173.6	-176.4	0	0	0	0	109	V434 V435 Y462 M463 F486 I488	V427-V434 PolarHBondContact O-N 3.5Å; V427-V435 HydrophobicContact CB-CB 4.43Å; V427-V435 PolarHBondContact N-O 3.08Å; V427-V435 PolarHBondContact O-N 3.07Å; V427-Y462 HydrophobicContact CG1-CD1 4.23Å; V427-Y462 HydrophobicContact CG1-CE1 3.76Å; V427-M463 HydrophobicContact CG1-SD 3.86Å; V427-M463 HydrophobicContact CG2-CG 4.28Å; V427-M463 HydrophobicContact CG2-SD 3.88Å; V427-F486 HydrophobicContact CG1-CD2 4.48Å; V427-F486 HydrophobicContact CG1-CE2 3.53Å; V427-F486 HydrophobicContact CG1-CZ 3.94Å; V427-I488 HydrophobicContact CG2-CD1 4.44Å; V427-I488 HydrophobicContact CG2-CG1 4.35Å
428	C	92.4	Very high	92.8	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	138.4	-170	-58.8	0	0	0	0	111.4	P368 K432 T487	P368-C428 VanDerWaalsContact CD-SG 3.54Å; P368-C428 WeakPolarHBondContact CG-SG 3.5Å; C428-K432 CarbonylContact C-O 3.55Å; C428-K432 WeakPolarHBondContact CA-O 3.27Å; C428-T487 WeakPolarHBondContact CA-O 3.36Å; C428-T487 WeakPolarHBondContact CB-O 3.36Å; C428-T487 WeakPolarHBondContact CB-OG1 3.47Å; C428-T487 PolarHBondContact N-O 2.99Å; C428-T487 PolarHBondContact O-N 3.16Å
429	S	90.8	Very high	93	Very high	31 Å²	31	42.7 Å²	42.7	22%	0.217	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	127.8	175.1	-170.5	0	0	0	0	109.6	G431 K432 N485	S429-G431 VanDerWaalsContact C-N 3.26Å; S429-G431 PolarHBondContact O-N 2.86Å; S429-K432 PolarHBondContact N-O 2.87Å; S429-K432 PolarHBondContact O-N 2.84Å; S429-N485 CarbonylContact C-O 3.6Å; S429-N485 WeakPolarHBondContact CA-O 3.45Å
430	F	87.9	Confident	93	Very high	146 Å²	146	46.2 Å²	46.2	64%	0.64	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.5	43	-174.5	-59.6	-85.9	0	0	0	113.1	K432 N485	F430-K432 VanDerWaalsContact C-N 3.25Å; F430-K432 PolarHBondContact O-N 2.78Å; F430-N485 HydrophobicContact CD1-CB 3.66Å; F430-N485 WeakPolarHBondContact CD1-OD1 3.42Å; F430-N485 HydrophobicContact CD2-CB 4.44Å; F430-N485 HydrophobicContact CE1-CB 3.6Å; F430-N485 VanDerWaalsContact CE1-CG 3.47Å; F430-N485 HydrophobicContact CE2-CB 4.39Å; F430-N485 HydrophobicContact CG-CB 4.09Å; F430-N485 HydrophobicContact CZ-CB 3.99Å; F430-N485 PolarHBondContact N-O 3.02Å
431	G	84.9	Confident	93	Very high	11 Å²	11	47.4 Å²	47.4	11%	0.113	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.8	14.8	-178.7	0	0	0	0	0	115	P368 S429	P368-G431 WeakPolarHBondContact CA-O 3.21Å; S429-G431 VanDerWaalsContact C-N 3.26Å; S429-G431 PolarHBondContact O-N 2.86Å
432	K	88.6	Confident	92.9	Very high	153 Å²	153	53.5 Å²	53.5	67%	0.665	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.9	134.8	176.9	-63.3	-175.5	178.5	-174	0	111	C428 S429 F430 V434	C428-K432 CarbonylContact C-O 3.55Å; C428-K432 WeakPolarHBondContact CA-O 3.27Å; S429-K432 PolarHBondContact N-O 2.87Å; S429-K432 PolarHBondContact O-N 2.84Å; F430-K432 VanDerWaalsContact C-N 3.25Å; F430-K432 PolarHBondContact O-N 2.78Å; K432-V434 PolarHBondContact O-N 2.97Å
433	Q	90.4	Very high	92.8	Very high	77 Å²	77	54.5 Å²	54.5	36%	0.36	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	128.4	170.2	179	174.8	-37	0	0	109.7	P368 E436	P368-Q433 HydrophobicContact CG-CB 4.26Å; Q433-E436 VanDerWaalsContact NE2-CB 3.32Å; Q433-E436 PolarHBondContact NE2-OE2 3.48Å
434	V	91.7	Very high	92.7	Very high	69 Å²	69	59.4 Å²	59.4	42%	0.418	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	-42.3	177.9	-172.5	0	0	0	0	110.6	V427 K432 Y462	V427-V434 PolarHBondContact O-N 3.5Å; K432-V434 PolarHBondContact O-N 2.97Å; V434-Y462 HydrophobicContact CG1-CD2 4.2Å; V434-Y462 HydrophobicContact CG1-CE1 4.47Å; V434-Y462 HydrophobicContact CG1-CE2 3.74Å
435	V	92.8	Very high	92.6	Very high	41 Å²	41	65.4 Å²	65.4	25%	0.248	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	148.3	177.2	-175.3	0	0	0	0	108.6	K426 V427 Y462	K426-V435 CarbonylContact C-O 3.56Å; K426-V435 WeakPolarHBondContact CA-O 3.36Å; V427-V435 HydrophobicContact CB-CB 4.43Å; V427-V435 PolarHBondContact N-O 3.08Å; V427-V435 PolarHBondContact O-N 3.07Å; V435-Y462 HydrophobicContact CG2-CD1 4.17Å; V435-Y462 HydrophobicContact CG2-CG 3.99Å
436	E	94.1	Very high	92.4	Very high	75 Å²	75	67 Å²	67	35%	0.35	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	136.8	168.6	173.6	167.9	-163.6	0	0	109.2	S424 T425 K426 Q433 V438	S424-E436 PolarHBondContact OG-OE1 2.79Å; T425-E436 WeakPolarHBondContact O-CA 3.37Å; K426-E436 VanDerWaalsContact CE-OE1 3.23Å; K426-E436 WeakPolarHBondContact CE-OE1 3.49Å; K426-E436 HydrophobicContact CG-CB 4.08Å; K426-E436 HydrophobicContact CG-CG 3.84Å; K426-E436 IonicContact NZ-OE1 3.72Å; K426-E436 PolarHBondContact NZ-OE1 2.89Å; K426-E436 VanDerWaalsContact NZ-OE1 3.1Å; K426-E436 IonicContact NZ-OE2 2.7Å; K426-E436 PolarHBondContact NZ-OE2 3.48Å; Q433-E436 VanDerWaalsContact NE2-CB 3.32Å; Q433-E436 PolarHBondContact NE2-OE2 3.48Å; E436-V438 HydrophobicContact CG-CG2 4.03Å
437	K	94.2	Very high	92.2	Very high	68 Å²	68	76.8 Å²	76.8	30%	0.296	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	129.2	171.5	-171.7	-179.7	-172.9	179.4	0	108	S424 T425 E439 S457 P458	S424-K437 CarbonylContact C-O 3.51Å; S424-K437 WeakPolarHBondContact CA-O 3.38Å; T425-K437 PolarHBondContact N-O 3.17Å; T425-K437 PolarHBondContact O-N 2.99Å; K437-E439 HydrophobicContact CD-CG 4.41Å; K437-E439 WeakPolarHBondContact CE-OE1 3.49Å; K437-E439 HydrophobicContact CG-CG 4.26Å; K437-E439 IonicContact NZ-OE1 3.13Å; K437-E439 PolarHBondContact NZ-OE1 3.35Å; K437-S457 PolarHBondContact NZ-OG 2.97Å; K437-P458 PolarHBondContact NZ-O 3.48Å
438	V	95.1	Very high	91.8	Very high	71 Å²	71	78.9 Å²	78.9	43%	0.43	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	126.3	176.9	-174.5	0	0	0	0	108.5	S422 V423 E436	S422-V438 WeakPolarHBondContact OG-CG1 3.34Å; V423-V438 WeakPolarHBondContact O-CA 3.38Å; E436-V438 HydrophobicContact CG-CG2 4.03Å
439	E	94.7	Very high	91.8	Very high	43 Å²	43	83 Å²	83	20%	0.201	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	135.5	-180	-66.2	177.3	114.3	0	0	109.3	V423 K437 I454 S457	V423-E439 PolarHBondContact N-O 3.07Å; V423-E439 PolarHBondContact O-N 2.78Å; K437-E439 HydrophobicContact CD-CG 4.41Å; K437-E439 WeakPolarHBondContact CE-OE1 3.49Å; K437-E439 HydrophobicContact CG-CG 4.26Å; K437-E439 IonicContact NZ-OE1 3.13Å; K437-E439 PolarHBondContact NZ-OE1 3.35Å; E439-I454 HydrophobicContact CB-CD1 4.03Å; E439-S457 WeakPolarHBondContact OE1-CB 3.45Å; E439-S457 PolarHBondContact OE1-OG 3.36Å; E439-S457 PolarHBondContact OE2-OG 2.8Å
440	H	94.8	Very high	92	Very high	99 Å²	99	83.5 Å²	83.5	46%	0.458	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	120.2	-177.9	-63.2	-51.5	0	0	0	110.1	I421 S422	I421-H440 WeakPolarHBondContact O-CA 3.41Å; S422-H440 PolarHBondContact OG-CE1 3.07Å; S422-H440 PolarHBondContact OG-ND1 2.56Å
441	E	94.7	Very high	92.3	Very high	39 Å²	39	76.6 Å²	76.6	18%	0.182	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	145.4	-177.4	-78.6	-64.5	148.9	0	0	111.6	I421 Y452 I454	I421-E441 HydrophobicContact CD1-CB 4.25Å; I421-E441 HydrophobicContact CG1-CB 3.79Å; I421-E441 PolarHBondContact N-O 2.9Å; I421-E441 PolarHBondContact O-N 2.71Å; E441-Y452 HydrophobicContact CB-CD1 4.29Å; E441-I454 HydrophobicContact CG-CD1 4.17Å; E441-I454 HydrophobicContact CG-CG1 3.56Å
442	Y	93.9	Very high	92.8	Very high	128 Å²	128	76.1 Å²	76.1	50%	0.502	37%	0.366	S	S	.	.			trans	-113.3	145.6	-177.2	-63.8	-82.4	0	0	0	110.8	A420 K444 K495	A420-Y442 HydrophobicContact CB-CD1 4Å; A420-Y442 HydrophobicContact CB-CE1 4.06Å; Y442-K444 PolarHBondContact O-N 2.96Å; Y442-K495 PolarHBondContact OH-NZ 3.35Å
443	P	93.7	Very high	93.1	Very high	36 Å²	36	72.4 Å²	72.4	23%	0.234	35%	0.348	C	S	.	.			trans	-68.1	127.1	-172.4	25.4	-32.2	0	0	0	111.7	S418 M419 F450 Y452	S418-P443 WeakPolarHBondContact OG-CG 3.43Å; M419-P443 WeakPolarHBondContact O-CD 3.46Å; P443-F450 HydrophobicContact CB-CB 4Å; P443-F450 HydrophobicContact CB-CD1 3.82Å; P443-F450 HydrophobicContact CB-CG 4.2Å; P443-Y452 VanDerWaalsContact CA-CE1 3.45Å; P443-Y452 HydrophobicContact CB-CE1 3.69Å; P443-Y452 HydrophobicContact CG-CE1 4.44Å
444	K	93.9	Very high	93.3	Very high	104 Å²	104	69 Å²	69	45%	0.452	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	115.9	171.5	-64.1	171.4	-174.5	164	0	108.7	Y442 E446 V451	Y442-K444 PolarHBondContact O-N 2.96Å; K444-E446 PolarHBondContact O-N 3.41Å; K444-V451 WeakPolarHBondContact CB-O 3.45Å; K444-V451 PolarHBondContact N-O 3.15Å; K444-V451 PolarHBondContact O-N 3.12Å
445	F	92.6	Very high	93.4	Very high	137 Å²	137	70.6 Å²	70.6	60%	0.601	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75	115.4	-178.4	-173.9	-107.6	0	0	0	110.8	R449 F450	F445-R449 WeakPolarHBondContact CA-O 3.37Å; F445-F450 HydrophobicContact CB-CD1 4.08Å; F445-F450 HydrophobicContact CB-CE1 3.92Å; F445-F450 AromaticContact CD2-CD1 3.97Å; F445-F450 HydrophobicContact CD2-CD1 3.97Å; F445-F450 AromaticContact CD2-CE1 3.6Å; F445-F450 HydrophobicContact CD2-CE1 3.6Å; F445-F450 HydrophobicContact CD2-CE2 4.24Å; F445-F450 HydrophobicContact CD2-CG 4.47Å; F445-F450 AromaticContact CD2-CZ 3.74Å; F445-F450 HydrophobicContact CD2-CZ 3.74Å; F445-F450 HydrophobicContact CE2-CZ 4.28Å; F445-F450 HydrophobicContact CG-CE1 4.17Å
446	E	91.9	Very high	93.3	Very high	62 Å²	62	74.6 Å²	74.6	29%	0.29	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	130.9	-179.8	-65.7	-175.9	-178.4	0	0	110.1	K444 G448 R449 V451 R453	K444-E446 PolarHBondContact O-N 3.41Å; E446-G448 PolarHBondContact O-N 3.24Å; E446-G448 VanDerWaalsContact O-N 3.09Å; E446-R449 PolarHBondContact N-O 3.33Å; E446-R449 PolarHBondContact O-N 3.03Å; E446-R449 VanDerWaalsContact O-O 3.05Å; E446-V451 HydrophobicContact CB-CG2 3.97Å; E446-V451 HydrophobicContact CG-CG2 4.49Å; E446-R453 IonicContact OE1-CZ 2.79Å; E446-R453 IonicContact OE1-NH1 3.79Å; E446-R453 PolarHBondContact OE1-NH1 2.78Å; E446-R453 IonicContact OE1-NH2 3.35Å; E446-R453 PolarHBondContact OE1-NH2 2.81Å; E446-R453 IonicContact OE2-CZ 3.12Å; E446-R453 IonicContact OE2-NH1 3.84Å; E446-R453 PolarHBondContact OE2-NH1 2.76Å; E446-R453 IonicContact OE2-NH2 2.76Å; E446-R453 PolarHBondContact OE2-NH2 2.71Å
447	K	88.2	Confident	93.3	Very high	214 Å²	214	71.4 Å²	71.4	93%	0.93	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.7	35.1	173.4	-57.5	-178.9	178.4	-177.2	0	114.2
448	G	87.6	Confident	93.3	Very high	53 Å²	53	71.8 Å²	71.8	55%	0.546	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.3	13.4	179.6	0	0	0	0	0	115.4	E446	E446-G448 PolarHBondContact O-N 3.24Å; E446-G448 VanDerWaalsContact O-N 3.09Å
449	R	91.4	Very high	93.2	Very high	86 Å²	86	69.6 Å²	69.6	33%	0.325	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	157.2	179.5	-59.1	-82.4	176.8	109	-9.5	109.6	E414 F445 E446	E414-R449 HydrophobicContact CG-CB 3.66Å; E414-R449 HydrophobicContact CG-CG 4.1Å; E414-R449 VanDerWaalsContact OE1-CD 3.27Å; E414-R449 WeakPolarHBondContact OE1-CD 3.24Å; E414-R449 VanDerWaalsContact OE1-CG 3.32Å; E414-R449 WeakPolarHBondContact OE1-CG 3Å; E414-R449 IonicContact OE1-CZ 3.54Å; E414-R449 IonicContact OE1-NE 3.71Å; E414-R449 IonicContact OE1-NH1 2.69Å; E414-R449 PolarHBondContact OE1-NH1 2.82Å; F445-R449 WeakPolarHBondContact CA-O 3.37Å; E446-R449 PolarHBondContact N-O 3.33Å; E446-R449 PolarHBondContact O-N 3.03Å; E446-R449 VanDerWaalsContact O-O 3.05Å
450	F	94.1	Very high	93	Very high	42 Å²	42	68.8 Å²	68.8	18%	0.184	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	121.4	168.8	-62.7	-79.2	0	0	0	109.6	E414 S415 S416 D417 P443 F445 Y452	E414-F450 CarbonylContact C-O 3.56Å; E414-F450 VanDerWaalsContact CA-O 3.31Å; E414-F450 WeakPolarHBondContact CA-O 3.43Å; S415-F450 PolarHBondContact N-O 3.09Å; S415-F450 PolarHBondContact O-N 3.46Å; S416-F450 WeakPolarHBondContact O-CD2 3.36Å; S416-F450 WeakPolarHBondContact O-CE2 3.34Å; D417-F450 WeakPolarHBondContact O-CD2 3.3Å; P443-F450 HydrophobicContact CB-CB 4Å; P443-F450 HydrophobicContact CB-CD1 3.82Å; P443-F450 HydrophobicContact CB-CG 4.2Å; F445-F450 HydrophobicContact CB-CD1 4.08Å; F445-F450 HydrophobicContact CB-CE1 3.92Å; F445-F450 AromaticContact CD2-CD1 3.97Å; F445-F450 HydrophobicContact CD2-CD1 3.97Å; F445-F450 AromaticContact CD2-CE1 3.6Å; F445-F450 HydrophobicContact CD2-CE1 3.6Å; F445-F450 HydrophobicContact CD2-CE2 4.24Å; F445-F450 HydrophobicContact CD2-CG 4.47Å; F445-F450 AromaticContact CD2-CZ 3.74Å; F445-F450 HydrophobicContact CD2-CZ 3.74Å; F445-F450 HydrophobicContact CE2-CZ 4.28Å; F445-F450 HydrophobicContact CG-CE1 4.17Å; F450-Y452 HydrophobicContact CB-CE2 4.4Å
451	V	95	Very high	92.8	Very high	1 Å²	1	70.3 Å²	70.3	1%	0.006	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	137.1	-175.4	-179.2	0	0	0	0	109.6	R412 Y413 E414 K444 E446 R453	R412-V451 HydrophobicContact CG-CG1 4.12Å; Y413-V451 WeakPolarHBondContact O-CA 3.46Å; E414-V451 HydrophobicContact CG-CG2 4.32Å; K444-V451 WeakPolarHBondContact CB-O 3.45Å; K444-V451 PolarHBondContact N-O 3.15Å; K444-V451 PolarHBondContact O-N 3.12Å; E446-V451 HydrophobicContact CB-CG2 3.97Å; E446-V451 HydrophobicContact CG-CG2 4.49Å; V451-R453 HydrophobicContact CG1-CG 4.08Å
452	Y	95.3	Very high	92.7	Very high	0 Å²	0	72.1 Å²	72.1	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	135.8	175.7	-47.8	-92.6	0	0	0	107.8	I319 R412 Y413 D417 M419 I421 E441 P443 F450	I319-Y452 HydrophobicContact CD1-CD2 4.22Å; I319-Y452 HydrophobicContact CD1-CE2 4.2Å; R412-Y452 WeakPolarHBondContact CA-O 3.5Å; Y413-Y452 PolarHBondContact N-O 3.28Å; Y413-Y452 PolarHBondContact O-N 2.93Å; D417-Y452 PolarHBondContact O-OH 2.94Å; M419-Y452 PolarHBondContact N-OH 2.85Å; M419-Y452 WeakPolarHBondContact O-CE1 3.45Å; M419-Y452 PolarHBondContact O-OH 2.87Å; I421-Y452 HydrophobicContact CD1-CD1 3.72Å; I421-Y452 HydrophobicContact CD1-CD2 4.08Å; I421-Y452 HydrophobicContact CD1-CE1 4.38Å; I421-Y452 HydrophobicContact CD1-CG 3.54Å; I421-Y452 HydrophobicContact CG1-CD1 3.75Å; I421-Y452 HydrophobicContact CG1-CE1 4.19Å; I421-Y452 HydrophobicContact CG1-CG 4.13Å; I421-Y452 HydrophobicContact CG2-CD1 4.38Å; I421-Y452 HydrophobicContact CG2-CE1 3.99Å; E441-Y452 HydrophobicContact CB-CD1 4.29Å; P443-Y452 VanDerWaalsContact CA-CE1 3.45Å; P443-Y452 HydrophobicContact CB-CE1 3.69Å; P443-Y452 HydrophobicContact CG-CE1 4.44Å; F450-Y452 HydrophobicContact CB-CE2 4.4Å
453	R	94.8	Very high	92.7	Very high	75 Å²	75	67.2 Å²	67.2	28%	0.283	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	106.8	-175.9	-71.2	-163.1	-173.3	92.2	3.2	111.4	R412 E446 V451	R412-R453 HydrophobicContact CG-CG 4.22Å; E446-R453 IonicContact OE1-CZ 2.79Å; E446-R453 IonicContact OE1-NH1 3.79Å; E446-R453 PolarHBondContact OE1-NH1 2.78Å; E446-R453 IonicContact OE1-NH2 3.35Å; E446-R453 PolarHBondContact OE1-NH2 2.81Å; E446-R453 IonicContact OE2-CZ 3.12Å; E446-R453 IonicContact OE2-NH1 3.84Å; E446-R453 PolarHBondContact OE2-NH1 2.76Å; E446-R453 IonicContact OE2-NH2 2.76Å; E446-R453 PolarHBondContact OE2-NH2 2.71Å; V451-R453 HydrophobicContact CG1-CG 4.08Å
454	I	95	Very high	92.5	Very high	5 Å²	5	67.4 Å²	67.4	3%	0.026	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	112.3	164.2	-59.5	177.4	0	0	0	106	D410 S411 V423 E439 E441 S457	D410-I454 CarbonylContact C-O 3.5Å; D410-I454 VanDerWaalsContact CA-O 3.27Å; D410-I454 WeakPolarHBondContact CA-O 3.46Å; S411-I454 PolarHBondContact N-O 3.1Å; S411-I454 PolarHBondContact O-N 2.6Å; V423-I454 HydrophobicContact CB-CD1 4.06Å; V423-I454 HydrophobicContact CG1-CD1 4.31Å; V423-I454 HydrophobicContact CG2-CD1 3.93Å; E439-I454 HydrophobicContact CB-CD1 4.03Å; E441-I454 HydrophobicContact CG-CD1 4.17Å; E441-I454 HydrophobicContact CG-CG1 3.56Å; I454-S457 VanDerWaalsContact CG2-CB 3.44Å
455	N	93.3	Very high	92.4	Very high	104 Å²	104	65.4 Å²	65.4	56%	0.556	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.3	138.5	-176.2	-68.7	-22.9	0	0	0	110.4	S457	N455-S457 PolarHBondContact O-N 2.92Å; N455-S457 VanDerWaalsContact O-N 3.15Å
456	R	91.5	Very high	92.4	Very high	125 Å²	125	60.5 Å²	60.5	47%	0.472	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	50.6	34	179.1	-73.5	179.3	161.6	-159.3	-10.9	113	Y327 D410 P458	Y327-R456 WeakPolarHBondContact OH-CG 3.29Å; D410-R456 PolarHBondContact OD1-N 2.66Å; R456-P458 VanDerWaalsContact O-CD 3.3Å; R456-P458 WeakPolarHBondContact O-CD 3.23Å
457	S	94.6	Very high	92.4	Very high	8 Å²	8	58.4 Å²	58.4	6%	0.056	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	114.8	-178.6	178.1	0	0	0	0	109.4	A408 V409 K437 E439 I454 N455	A408-S457 CarbonylContact C-O 3.6Å; A408-S457 VanDerWaalsContact CA-O 3.26Å; A408-S457 WeakPolarHBondContact CA-O 3.47Å; V409-S457 PolarHBondContact N-O 2.99Å; V409-S457 WeakPolarHBondContact O-CB 3.42Å; V409-S457 PolarHBondContact O-N 3.49Å; K437-S457 PolarHBondContact NZ-OG 2.97Å; E439-S457 WeakPolarHBondContact OE1-CB 3.45Å; E439-S457 PolarHBondContact OE1-OG 3.36Å; E439-S457 PolarHBondContact OE2-OG 2.8Å; I454-S457 VanDerWaalsContact CG2-CB 3.44Å; N455-S457 PolarHBondContact O-N 2.92Å; N455-S457 VanDerWaalsContact O-N 3.15Å
458	P	93.1	Very high	92.4	Very high	76 Å²	76	49.3 Å²	49.3	49%	0.494	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	138.4	-172.3	26.6	-34	0	0	0	110.7	L406 K437 R456	L406-P458 HydrophobicContact CD1-CB 4.41Å; K437-P458 PolarHBondContact NZ-O 3.48Å; R456-P458 VanDerWaalsContact O-CD 3.3Å; R456-P458 WeakPolarHBondContact O-CD 3.23Å
459	M	93.4	Very high	92.6	Very high	25 Å²	25	53.6 Å²	53.6	12%	0.123	25%	0.25	C	C	.	.	P	Polyproline II helix	trans	-67.3	147.4	169.9	-66.9	-166.8	-151.8	0	0	110.2	A326 L341 F407 A408 V409 M463 N464 I467	A326-M459 HydrophobicContact CB-CE 3.78Å; L341-M459 HydrophobicContact CD1-CE 4.18Å; F407-M459 HydrophobicContact CB-CB 4.12Å; F407-M459 HydrophobicContact CB-CE 4.23Å; F407-M459 HydrophobicContact CB-CG 4.16Å; F407-M459 HydrophobicContact CB-SD 3.98Å; F407-M459 PolarHBondContact O-N 2.79Å; A408-M459 VanDerWaalsContact O-CE 3.28Å; A408-M459 WeakPolarHBondContact O-CE 3.36Å; V409-M459 HydrophobicContact CG2-CE 4.02Å; V409-M459 HydrophobicContact CG2-CG 4.07Å; M459-M463 HydrophobicContact CB-CB 4.09Å; M459-M463 HydrophobicContact SD-CB 4.38Å; M459-N464 VanDerWaalsContact CB-OD1 3.24Å; M459-N464 WeakPolarHBondContact CB-OD1 3.5Å; M459-I467 HydrophobicContact SD-CD1 3.97Å
460	C	90.8	Very high	92.6	Very high	25 Å²	25	50 Å²	50	17%	0.169	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-72.1	157.3	177.4	64.3	0	0	0	0	111.4	W54 Y462 M463 N464	W54-C460 HydrophobicContact CH2-CB 4.37Å; C460-Y462 PolarHBondContact O-N 3.2Å; C460-Y462 VanDerWaalsContact O-N 3.09Å; C460-M463 WeakPolarHBondContact O-CB 3.28Å; C460-M463 PolarHBondContact O-N 3.43Å; C460-N464 PolarHBondContact O-N 2.7Å
461	E	90.8	Very high	92.4	Very high	132 Å²	132	51.8 Å²	51.8	62%	0.617	25%	0.245	S	C	*	.	H	α-helix	trans	-54.9	-34.1	-177.7	-157.9	-150.9	135.1	0	0	112.9	N464 N465	E461-N464 PolarHBondContact O-N 2.82Å; E461-N465 VanDerWaalsContact O-CB 3.26Å; E461-N465 WeakPolarHBondContact O-CB 3.32Å; E461-N465 PolarHBondContact O-N 2.91Å; E461-N465 PolarHBondContact O-ND2 2.88Å; E461-N465 PolarHBondContact OE1-ND2 2.82Å
462	Y	92.6	Very high	92.1	Very high	76 Å²	76	58.2 Å²	58.2	30%	0.298	27%	0.273	S	S	.	.	H	α-helix	trans	-58.7	-45.8	173.4	175.8	-92.1	0	0	0	112.5	V427 V434 V435 C460 F466 F486	V427-Y462 HydrophobicContact CG1-CD1 4.23Å; V427-Y462 HydrophobicContact CG1-CE1 3.76Å; V434-Y462 HydrophobicContact CG1-CD2 4.2Å; V434-Y462 HydrophobicContact CG1-CE1 4.47Å; V434-Y462 HydrophobicContact CG1-CE2 3.74Å; V435-Y462 HydrophobicContact CG2-CD1 4.17Å; V435-Y462 HydrophobicContact CG2-CG 3.99Å; C460-Y462 PolarHBondContact O-N 3.2Å; C460-Y462 VanDerWaalsContact O-N 3.09Å; Y462-F466 VanDerWaalsContact O-CB 3.28Å; Y462-F466 WeakPolarHBondContact O-CB 3.33Å; Y462-F466 PolarHBondContact O-N 2.83Å; Y462-F486 HydrophobicContact CE1-CE2 4.45Å
463	M	92.8	Very high	91.9	Very high	25 Å²	25	60.6 Å²	60.6	12%	0.123	29%	0.285	C	S	.	.	H	α-helix	trans	-67.5	-43.4	-179.8	-75.8	-63.6	-56.9	0	0	111.6	V427 M459 C460 F466 I467 F486 I488	V427-M463 HydrophobicContact CG1-SD 3.86Å; V427-M463 HydrophobicContact CG2-CG 4.28Å; V427-M463 HydrophobicContact CG2-SD 3.88Å; M459-M463 HydrophobicContact CB-CB 4.09Å; M459-M463 HydrophobicContact SD-CB 4.38Å; C460-M463 WeakPolarHBondContact O-CB 3.28Å; C460-M463 PolarHBondContact O-N 3.43Å; M463-F466 WeakPolarHBondContact O-CB 2.99Å; M463-F466 PolarHBondContact O-N 3.42Å; M463-I467 WeakPolarHBondContact O-CG1 3.49Å; M463-I467 PolarHBondContact O-N 2.99Å; M463-F486 HydrophobicContact CE-CZ 3.86Å; M463-F486 HydrophobicContact SD-CE2 4.12Å; M463-F486 HydrophobicContact SD-CZ 3.69Å; M463-I488 HydrophobicContact CE-CD1 4.19Å; M463-I488 HydrophobicContact SD-CD1 4.49Å
464	N	90.7	Very high	91.6	Very high	40 Å²	40	62.3 Å²	62.3	21%	0.214	31%	0.306	C	S	.	.	H	α-helix	trans	-60.2	-53.6	176.9	-60.2	-0.5	0	0	0	109.4	F407 M459 C460 E461 F466 I467 H468	F407-N464 WeakPolarHBondContact CB-OD1 3.28Å; F407-N464 HydrophobicContact CD2-CB 4.45Å; M459-N464 VanDerWaalsContact CB-OD1 3.24Å; M459-N464 WeakPolarHBondContact CB-OD1 3.5Å; C460-N464 PolarHBondContact O-N 2.7Å; E461-N464 PolarHBondContact O-N 2.82Å; N464-F466 PolarHBondContact O-N 3.34Å; N464-I467 PolarHBondContact O-N 2.81Å; N464-I467 VanDerWaalsContact O-N 3.12Å; N464-H468 PolarHBondContact O-CD2 3Å; N464-H468 PolarHBondContact O-N 2.93Å
465	N	91	Very high	91.3	Very high	63 Å²	63	66.3 Å²	66.3	34%	0.337	33%	0.325	S	S	.	.	H	α-helix	trans	-57.4	-34.8	176.8	-82.3	-52.7	0	0	0	113.2	E461 K469	E461-N465 VanDerWaalsContact O-CB 3.26Å; E461-N465 WeakPolarHBondContact O-CB 3.32Å; E461-N465 PolarHBondContact O-N 2.91Å; E461-N465 PolarHBondContact O-ND2 2.88Å; E461-N465 PolarHBondContact OE1-ND2 2.82Å; N465-K469 WeakPolarHBondContact O-CB 3.48Å; N465-K469 WeakPolarHBondContact O-CD 3.47Å; N465-K469 VanDerWaalsContact O-CG 3.23Å; N465-K469 WeakPolarHBondContact O-CG 3.36Å; N465-K469 PolarHBondContact O-N 3.13Å; N465-K469 VanDerWaalsContact O-N 3.11Å
466	F	92.9	Very high	91.2	Very high	33 Å²	33	65 Å²	65	15%	0.145	31%	0.312	C	S	.	.	H	α-helix	trans	-65.6	-49.4	175	178.8	-97.4	0	0	0	111.2	Y462 M463 N464 H468 K469 L470 V482 L483 F486	Y462-F466 VanDerWaalsContact O-CB 3.28Å; Y462-F466 WeakPolarHBondContact O-CB 3.33Å; Y462-F466 PolarHBondContact O-N 2.83Å; M463-F466 WeakPolarHBondContact O-CB 2.99Å; M463-F466 PolarHBondContact O-N 3.42Å; N464-F466 PolarHBondContact O-N 3.34Å; F466-H468 PolarHBondContact O-N 2.84Å; F466-K469 PolarHBondContact O-N 3.31Å; F466-L470 HydrophobicContact CE1-CD2 4.26Å; F466-L470 WeakPolarHBondContact O-CB 3.45Å; F466-L470 PolarHBondContact O-N 3.01Å; F466-V482 HydrophobicContact CE2-CG1 3.73Å; F466-V482 HydrophobicContact CZ-CG1 3.9Å; F466-L483 HydrophobicContact CE1-CD2 3.92Å; F466-L483 HydrophobicContact CZ-CD2 3.95Å; F466-F486 HydrophobicContact CD1-CD2 4.44Å; F466-F486 HydrophobicContact CD1-CE2 4.1Å; F466-F486 HydrophobicContact CD1-CZ 4.24Å; F466-F486 HydrophobicContact CD2-CD2 4.39Å; F466-F486 HydrophobicContact CD2-CE2 4.49Å; F466-F486 HydrophobicContact CE1-CD1 4.04Å; F466-F486 AromaticContact CE1-CD2 3.91Å; F466-F486 HydrophobicContact CE1-CD2 3.91Å; F466-F486 HydrophobicContact CE1-CE1 4.09Å; F466-F486 AromaticContact CE1-CE2 3.93Å; F466-F486 HydrophobicContact CE1-CE2 3.93Å; F466-F486 AromaticContact CE1-CG 3.96Å; F466-F486 HydrophobicContact CE1-CG 3.96Å; F466-F486 HydrophobicContact CE1-CZ 4.04Å; F466-F486 AromaticContact CE2-CD2 3.85Å; F466-F486 HydrophobicContact CE2-CD2 3.85Å; F466-F486 HydrophobicContact CE2-CE2 4.35Å; F466-F486 HydrophobicContact CE2-CG 4.28Å; F466-F486 HydrophobicContact CG-CE2 4.38Å; F466-F486 HydrophobicContact CZ-CB 4Å; F466-F486 HydrophobicContact CZ-CD1 4.12Å; F466-F486 AromaticContact CZ-CD2 3.58Å; F466-F486 HydrophobicContact CZ-CD2 3.58Å; F466-F486 HydrophobicContact CZ-CE2 4.06Å; F466-F486 AromaticContact CZ-CG 3.61Å; F466-F486 HydrophobicContact CZ-CG 3.61Å
467	I	91.9	Very high	91.2	Very high	18 Å²	18	63.4 Å²	63.4	9%	0.092	31%	0.306	C	S	.	.	H	α-helix	trans	-60.5	-46.4	178.2	-66.1	163	0	0	0	111	L341 F397 F407 M459 M463 N464 K469 L470 K471	L341-I467 HydrophobicContact CD1-CD1 4.01Å; F397-I467 HydrophobicContact CE1-CG2 4.18Å; F397-I467 HydrophobicContact CZ-CG2 3.65Å; F407-I467 HydrophobicContact CD1-CD1 4.06Å; F407-I467 HydrophobicContact CE1-CD1 4.35Å; F407-I467 HydrophobicContact CE1-CG2 3.98Å; F407-I467 HydrophobicContact CZ-CG2 4.46Å; M459-I467 HydrophobicContact SD-CD1 3.97Å; M463-I467 WeakPolarHBondContact O-CG1 3.49Å; M463-I467 PolarHBondContact O-N 2.99Å; N464-I467 PolarHBondContact O-N 2.81Å; N464-I467 VanDerWaalsContact O-N 3.12Å; I467-K469 VanDerWaalsContact C-N 3.31Å; I467-K469 PolarHBondContact O-N 3Å; I467-L470 PolarHBondContact O-N 2.93Å; I467-K471 PolarHBondContact O-N 2.96Å
468	H	88.2	Confident	91.1	Very high	24 Å²	24	65.2 Å²	65.2	11%	0.111	32%	0.315	C	S	.	.	H	α-helix	trans	-61.1	-36.9	176.5	-72.5	-74.7	0	0	0	112.7	E402 F407 N464 F466 K472	E402-H468 VanDerWaalsContact CD-ND1 3.27Å; E402-H468 IonicContact OE1-CE1 3.65Å; E402-H468 IonicContact OE1-CG 3.68Å; E402-H468 IonicContact OE1-ND1 2.7Å; E402-H468 PolarHBondContact OE1-ND1 2.81Å; F407-H468 AromaticContact CE2-CE1 3.98Å; F407-H468 AromaticContact CE2-NE2 3.48Å; F407-H468 WeakPolarHBondContact CE2-NE2 3.43Å; F407-H468 AromaticContact CZ-NE2 3.89Å; N464-H468 PolarHBondContact O-CD2 3Å; N464-H468 PolarHBondContact O-N 2.93Å; F466-H468 PolarHBondContact O-N 2.84Å; H468-K472 VanDerWaalsContact O-CD 3.3Å; H468-K472 WeakPolarHBondContact O-CD 3.48Å; H468-K472 VanDerWaalsContact O-CG 3.22Å; H468-K472 WeakPolarHBondContact O-CG 3.44Å; H468-K472 PolarHBondContact O-N 2.87Å
469	K	91.2	Very high	91.1	Very high	142 Å²	142	62.6 Å²	62.6	62%	0.617	30%	0.296	S	S	*	.	H	α-helix	trans	-74.1	-37.3	176.2	-74.7	170.1	-175	170.8	0	112.4	N465 F466 I467 K472	N465-K469 WeakPolarHBondContact O-CB 3.48Å; N465-K469 WeakPolarHBondContact O-CD 3.47Å; N465-K469 VanDerWaalsContact O-CG 3.23Å; N465-K469 WeakPolarHBondContact O-CG 3.36Å; N465-K469 PolarHBondContact O-N 3.13Å; N465-K469 VanDerWaalsContact O-N 3.11Å; F466-K469 PolarHBondContact O-N 3.31Å; I467-K469 VanDerWaalsContact C-N 3.31Å; I467-K469 PolarHBondContact O-N 3Å; K469-K472 PolarHBondContact O-N 3.48Å
470	L	92.6	Very high	91.2	Very high	12 Å²	12	63.6 Å²	63.6	6%	0.063	30%	0.302	C	S	.	.	H	α-helix	trans	-62.3	-47.1	176.8	-168.4	71	0	0	0	110.6	F466 I467 K472 L473 M479 V482 L483 I510	F466-L470 HydrophobicContact CE1-CD2 4.26Å; F466-L470 WeakPolarHBondContact O-CB 3.45Å; F466-L470 PolarHBondContact O-N 3.01Å; I467-L470 PolarHBondContact O-N 2.93Å; L470-K472 PolarHBondContact O-N 3.25Å; L470-L473 HydrophobicContact CD1-CD1 4.22Å; L470-L473 WeakPolarHBondContact O-CB 3.36Å; L470-L473 WeakPolarHBondContact O-CG 3.44Å; L470-L473 PolarHBondContact O-N 3.02Å; L470-L473 VanDerWaalsContact O-N 3.16Å; L470-M479 HydrophobicContact CD1-CB 3.87Å; L470-M479 HydrophobicContact CD1-CG 4.27Å; L470-M479 HydrophobicContact CG-CB 4.23Å; L470-M479 HydrophobicContact CG-CG 4.31Å; L470-V482 HydrophobicContact CD1-CB 4.11Å; L470-V482 HydrophobicContact CD1-CG1 4.1Å; L470-L483 HydrophobicContact CD1-CG 4.26Å; L470-L483 HydrophobicContact CD2-CD1 4.28Å; L470-L483 HydrophobicContact CD2-CD2 4Å; L470-L483 HydrophobicContact CD2-CG 4.24Å; L470-I510 HydrophobicContact CD2-CD1 4.03Å
471	K	88.9	Confident	91.3	Very high	78 Å²	78	65.3 Å²	65.3	34%	0.339	31%	0.314	S	S	.	.	H	α-helix	trans	-63.8	-24.2	176.6	-175.6	177.5	170.4	-173.7	0	113.8	F397 I467 L473	F397-K471 HydrophobicContact CZ-CD 4.31Å; F397-K471 PolarHBondContact O-NZ 2.91Å; I467-K471 PolarHBondContact O-N 2.96Å; K471-L473 VanDerWaalsContact C-N 3.26Å; K471-L473 PolarHBondContact O-N 3.45Å
472	K	88.9	Confident	91.4	Very high	137 Å²	137	62.1 Å²	62.1	60%	0.596	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-4.4	177	-74.4	166.7	-170	173.8	0	113.5	E402 H468 K469 L470	E402-K472 IonicContact OE1-NZ 3.87Å; E402-K472 PolarHBondContact OE1-NZ 3.2Å; E402-K472 IonicContact OE2-NZ 3.29Å; E402-K472 PolarHBondContact OE2-NZ 3.44Å; H468-K472 VanDerWaalsContact O-CD 3.3Å; H468-K472 WeakPolarHBondContact O-CD 3.48Å; H468-K472 VanDerWaalsContact O-CG 3.22Å; H468-K472 WeakPolarHBondContact O-CG 3.44Å; H468-K472 PolarHBondContact O-N 2.87Å; K469-K472 PolarHBondContact O-N 3.48Å; L470-K472 PolarHBondContact O-N 3.25Å
473	L	91.3	Very high	91.5	Very high	49 Å²	49	58.9 Å²	58.9	26%	0.257	29%	0.291	S	S	.	.			trans	-76.9	134.8	173.6	-62.9	172.5	0	0	0	110.3	L470 K471 E475 M478 M479 V482	L470-L473 HydrophobicContact CD1-CD1 4.22Å; L470-L473 WeakPolarHBondContact O-CB 3.36Å; L470-L473 WeakPolarHBondContact O-CG 3.44Å; L470-L473 PolarHBondContact O-N 3.02Å; L470-L473 VanDerWaalsContact O-N 3.16Å; K471-L473 VanDerWaalsContact C-N 3.26Å; K471-L473 PolarHBondContact O-N 3.45Å; L473-E475 PolarHBondContact O-N 3.36Å; L473-M478 HydrophobicContact CB-CB 4.26Å; L473-M478 HydrophobicContact CD1-CB 4.11Å; L473-M478 HydrophobicContact CD2-CB 4.46Å; L473-M479 HydrophobicContact CB-CE 4.29Å; L473-M479 HydrophobicContact CB-CG 3.92Å; L473-M479 HydrophobicContact CD1-CB 4.46Å; L473-M479 HydrophobicContact CD1-CG 4.01Å; L473-M479 WeakPolarHBondContact O-CE 3.32Å; L473-V482 HydrophobicContact CD1-CG2 4.07Å
474	P	88.2	Confident	91.5	Very high	111 Å²	111	63.1 Å²	63.1	72%	0.721	31%	0.311	S	S	*	.	S	Bend	trans	-74	-27.6	-174.2	29.6	-35.8	0	0	0	113.1	M478	P474-M478 HydrophobicContact CG-CE 4.35Å; P474-M478 HydrophobicContact CG-SD 4.06Å
475	E	89.5	Confident	91.5	Very high	89 Å²	89	63.2 Å²	63.2	42%	0.416	31%	0.311	S	S	.	.	S	Bend	trans	-126	133.9	-169.5	-63.6	-178.1	120.9	0	0	111.3	L473 Y477 M478 M479	L473-E475 PolarHBondContact O-N 3.36Å; E475-Y477 VanDerWaalsContact C-N 3.29Å; E475-Y477 HydrophobicContact CB-CD1 3.85Å; E475-Y477 HydrophobicContact CB-CE1 3.53Å; E475-Y477 VanDerWaalsContact CD-CE1 3.44Å; E475-Y477 HydrophobicContact CG-CE1 4.09Å; E475-Y477 PolarHBondContact O-N 3.08Å; E475-Y477 WeakPolarHBondContact OE2-CE1 3.48Å; E475-Y477 PolarHBondContact OE2-OH 2.81Å; E475-M478 HydrophobicContact CB-CG 4.24Å; E475-M478 VanDerWaalsContact O-CB 3.31Å; E475-M478 WeakPolarHBondContact O-CB 3.31Å; E475-M478 PolarHBondContact O-N 2.96Å; E475-M478 WeakPolarHBondContact OE2-CE 3.47Å; E475-M479 PolarHBondContact O-N 3.21Å
476	R	89.3	Confident	91.7	Very high	77 Å²	77	60.5 Å²	60.5	29%	0.291	30%	0.296	S	S	.	.	H	α-helix	trans	-53.8	-38.8	-177.8	-179.6	178.6	176.3	63.5	15.8	114.1	M478 M479 N480 I510 S511 D512	R476-M478 VanDerWaalsContact C-N 3.29Å; R476-M478 PolarHBondContact O-N 3.19Å; R476-M479 WeakPolarHBondContact O-CB 3.47Å; R476-M479 PolarHBondContact O-N 3.35Å; R476-N480 PolarHBondContact O-N 2.99Å; R476-I510 VanDerWaalsContact NH2-C 3.34Å; R476-I510 PolarHBondContact NH2-O 2.93Å; R476-S511 VanDerWaalsContact CZ-O 3.32Å; R476-S511 VanDerWaalsContact NH1-C 3.33Å; R476-S511 PolarHBondContact NH1-O 3.34Å; R476-S511 PolarHBondContact NH2-O 3.24Å; R476-D512 IonicContact CZ-OD1 3.94Å; R476-D512 IonicContact NE-OD1 3.13Å; R476-D512 PolarHBondContact NE-OD1 2.97Å; R476-D512 IonicContact NH2-OD1 3.31Å; R476-D512 PolarHBondContact NH2-OD1 3.2Å; R476-D512 IonicContact NH2-OD2 2.85Å; R476-D512 PolarHBondContact NH2-OD2 2.84Å
477	Y	91.9	Very high	91.8	Very high	91 Å²	91	59 Å²	59	36%	0.357	29%	0.29	S	S	.	.	H	α-helix	trans	-67.8	-29.1	177.9	76.2	-95	0	0	0	112.2	E475 N480 S481	E475-Y477 VanDerWaalsContact C-N 3.29Å; E475-Y477 HydrophobicContact CB-CD1 3.85Å; E475-Y477 HydrophobicContact CB-CE1 3.53Å; E475-Y477 VanDerWaalsContact CD-CE1 3.44Å; E475-Y477 HydrophobicContact CG-CE1 4.09Å; E475-Y477 PolarHBondContact O-N 3.08Å; E475-Y477 WeakPolarHBondContact OE2-CE1 3.48Å; E475-Y477 PolarHBondContact OE2-OH 2.81Å; Y477-N480 PolarHBondContact O-N 2.77Å; Y477-S481 WeakPolarHBondContact O-CB 3.32Å; Y477-S481 PolarHBondContact O-N 3.16Å; Y477-S481 PolarHBondContact O-OG 3.02Å
478	M	92.9	Very high	92	Very high	46 Å²	46	59.1 Å²	59.1	23%	0.227	29%	0.291	C	S	.	.	H	α-helix	trans	-66.4	-41	173.4	-61.3	-171.8	-179.2	0	0	110.4	L473 P474 E475 R476 S481 V482	L473-M478 HydrophobicContact CB-CB 4.26Å; L473-M478 HydrophobicContact CD1-CB 4.11Å; L473-M478 HydrophobicContact CD2-CB 4.46Å; P474-M478 HydrophobicContact CG-CE 4.35Å; P474-M478 HydrophobicContact CG-SD 4.06Å; E475-M478 HydrophobicContact CB-CG 4.24Å; E475-M478 VanDerWaalsContact O-CB 3.31Å; E475-M478 WeakPolarHBondContact O-CB 3.31Å; E475-M478 PolarHBondContact O-N 2.96Å; E475-M478 WeakPolarHBondContact OE2-CE 3.47Å; R476-M478 VanDerWaalsContact C-N 3.29Å; R476-M478 PolarHBondContact O-N 3.19Å; M478-S481 PolarHBondContact O-N 2.94Å; M478-V482 WeakPolarHBondContact O-CG2 3.47Å; M478-V482 PolarHBondContact O-N 2.81Å; M478-V482 VanDerWaalsContact O-N 3.08Å
479	M	93.2	Very high	92.3	Very high	22 Å²	22	58 Å²	58	11%	0.108	29%	0.286	C	S	.	.	H	α-helix	trans	-60.7	-49.6	174.6	-57.5	-179.4	-173	0	0	111	V395 L470 L473 E475 R476 S481 V482 L483 I510	V395-M479 HydrophobicContact CG2-SD 4.18Å; L470-M479 HydrophobicContact CD1-CB 3.87Å; L470-M479 HydrophobicContact CD1-CG 4.27Å; L470-M479 HydrophobicContact CG-CB 4.23Å; L470-M479 HydrophobicContact CG-CG 4.31Å; L473-M479 HydrophobicContact CB-CE 4.29Å; L473-M479 HydrophobicContact CB-CG 3.92Å; L473-M479 HydrophobicContact CD1-CB 4.46Å; L473-M479 HydrophobicContact CD1-CG 4.01Å; L473-M479 WeakPolarHBondContact O-CE 3.32Å; E475-M479 PolarHBondContact O-N 3.21Å; R476-M479 WeakPolarHBondContact O-CB 3.47Å; R476-M479 PolarHBondContact O-N 3.35Å; M479-S481 VanDerWaalsContact C-N 3.31Å; M479-S481 PolarHBondContact O-N 2.95Å; M479-V482 PolarHBondContact O-N 2.81Å; M479-V482 VanDerWaalsContact O-N 3.14Å; M479-L483 WeakPolarHBondContact O-CG 3.43Å; M479-L483 PolarHBondContact O-N 2.86Å; M479-I510 HydrophobicContact CB-CD1 3.92Å; M479-I510 HydrophobicContact CB-CG1 3.67Å; M479-I510 HydrophobicContact SD-CD1 4.16Å; M479-I510 HydrophobicContact SD-CG1 4.14Å
480	N	94.7	Very high	92.5	Very high	46 Å²	46	51.5 Å²	51.5	25%	0.246	26%	0.257	C	S	.	.	H	α-helix	trans	-59.8	-37.9	175.5	-72.9	-19.6	0	0	0	112.6	R476 Y477 V482 L483 E484 I510	R476-N480 PolarHBondContact O-N 2.99Å; Y477-N480 PolarHBondContact O-N 2.77Å; N480-V482 VanDerWaalsContact C-N 3.3Å; N480-V482 PolarHBondContact O-N 2.81Å; N480-L483 PolarHBondContact O-N 3.08Å; N480-E484 PolarHBondContact O-N 2.84Å; N480-I510 WeakPolarHBondContact OD1-CG1 3.36Å; N480-I510 PolarHBondContact OD1-N 3.28Å
481	S	93.6	Very high	92.6	Very high	61 Å²	61	51.8 Å²	51.8	43%	0.427	26%	0.259	S	S	.	.	H	α-helix	trans	-64.7	-32.5	176.6	-56.4	0	0	0	0	112.9	Y477 M478 M479	Y477-S481 WeakPolarHBondContact O-CB 3.32Å; Y477-S481 PolarHBondContact O-N 3.16Å; Y477-S481 PolarHBondContact O-OG 3.02Å; M478-S481 PolarHBondContact O-N 2.94Å; M479-S481 VanDerWaalsContact C-N 3.31Å; M479-S481 PolarHBondContact O-N 2.95Å
482	V	93.8	Very high	93	Very high	65 Å²	65	48.1 Å²	48.1	39%	0.394	24%	0.243	S	C	.	.	H	α-helix	trans	-74	-41.8	172.5	172.7	0	0	0	0	110.5	F466 L470 L473 M478 M479 N480 E484	F466-V482 HydrophobicContact CE2-CG1 3.73Å; F466-V482 HydrophobicContact CZ-CG1 3.9Å; L470-V482 HydrophobicContact CD1-CB 4.11Å; L470-V482 HydrophobicContact CD1-CG1 4.1Å; L473-V482 HydrophobicContact CD1-CG2 4.07Å; M478-V482 WeakPolarHBondContact O-CG2 3.47Å; M478-V482 PolarHBondContact O-N 2.81Å; M478-V482 VanDerWaalsContact O-N 3.08Å; M479-V482 PolarHBondContact O-N 2.81Å; M479-V482 VanDerWaalsContact O-N 3.14Å; N480-V482 VanDerWaalsContact C-N 3.3Å; N480-V482 PolarHBondContact O-N 2.81Å; V482-E484 PolarHBondContact O-N 3.17Å
483	L	94.6	Very high	93.2	Very high	7 Å²	7	42.4 Å²	42.4	4%	0.037	22%	0.22	C	C	.	.	H	α-helix	trans	-68.9	-27.9	-179.4	-69.5	176.3	0	0	0	114.1	F466 L470 M479 N480 N485 F486 F508 I510	F466-L483 HydrophobicContact CE1-CD2 3.92Å; F466-L483 HydrophobicContact CZ-CD2 3.95Å; L470-L483 HydrophobicContact CD1-CG 4.26Å; L470-L483 HydrophobicContact CD2-CD1 4.28Å; L470-L483 HydrophobicContact CD2-CD2 4Å; L470-L483 HydrophobicContact CD2-CG 4.24Å; M479-L483 WeakPolarHBondContact O-CG 3.43Å; M479-L483 PolarHBondContact O-N 2.86Å; N480-L483 PolarHBondContact O-N 3.08Å; L483-N485 PolarHBondContact O-N 3.35Å; L483-F486 HydrophobicContact CD2-CB 4.42Å; L483-F486 HydrophobicContact CD2-CD1 3.96Å; L483-F486 HydrophobicContact CD2-CG 4.44Å; L483-F486 PolarHBondContact O-N 3.3Å; L483-F486 VanDerWaalsContact O-O 3.09Å; L483-F508 HydrophobicContact CB-CB 4.24Å; L483-F508 WeakPolarHBondContact CB-O 3.47Å; L483-F508 HydrophobicContact CD1-CB 4.09Å; L483-F508 HydrophobicContact CD2-CB 3.95Å; L483-F508 HydrophobicContact CG-CB 4.33Å; L483-I510 HydrophobicContact CD1-CD1 3.48Å; L483-I510 VanDerWaalsContact CD1-CD1 3.48Å; L483-I510 HydrophobicContact CD1-CG1 4Å
484	E	92.4	Very high	93.4	Very high	114 Å²	114	40.5 Å²	40.5	53%	0.533	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.3	-32	177.5	-167.4	-159.2	165.1	0	0	113.2	N480 V482	N480-E484 PolarHBondContact O-N 2.84Å; V482-E484 PolarHBondContact O-N 3.17Å
485	N	91.1	Very high	93.6	Very high	42 Å²	42	39.1 Å²	39.1	23%	0.225	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.2	10.1	-178.6	-66.7	-91.3	0	0	0	112.8	S429 F430 L483	S429-N485 CarbonylContact C-O 3.6Å; S429-N485 WeakPolarHBondContact CA-O 3.45Å; F430-N485 HydrophobicContact CD1-CB 3.66Å; F430-N485 WeakPolarHBondContact CD1-OD1 3.42Å; F430-N485 HydrophobicContact CD2-CB 4.44Å; F430-N485 HydrophobicContact CE1-CB 3.6Å; F430-N485 VanDerWaalsContact CE1-CG 3.47Å; F430-N485 HydrophobicContact CE2-CB 4.39Å; F430-N485 HydrophobicContact CG-CB 4.09Å; F430-N485 HydrophobicContact CZ-CB 3.99Å; F430-N485 PolarHBondContact N-O 3.02Å; L483-N485 PolarHBondContact O-N 3.35Å
486	F	94.8	Very high	93.6	Very high	6 Å²	6	40.8 Å²	40.8	3%	0.026	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	119.8	176.9	176.6	-93.1	0	0	0	109.6	V427 Y462 M463 F466 L483 I488 F508	V427-F486 HydrophobicContact CG1-CD2 4.48Å; V427-F486 HydrophobicContact CG1-CE2 3.53Å; V427-F486 HydrophobicContact CG1-CZ 3.94Å; Y462-F486 HydrophobicContact CE1-CE2 4.45Å; M463-F486 HydrophobicContact CE-CZ 3.86Å; M463-F486 HydrophobicContact SD-CE2 4.12Å; M463-F486 HydrophobicContact SD-CZ 3.69Å; F466-F486 HydrophobicContact CD1-CD2 4.44Å; F466-F486 HydrophobicContact CD1-CE2 4.1Å; F466-F486 HydrophobicContact CD1-CZ 4.24Å; F466-F486 HydrophobicContact CD2-CD2 4.39Å; F466-F486 HydrophobicContact CD2-CE2 4.49Å; F466-F486 HydrophobicContact CE1-CD1 4.04Å; F466-F486 AromaticContact CE1-CD2 3.91Å; F466-F486 HydrophobicContact CE1-CD2 3.91Å; F466-F486 HydrophobicContact CE1-CE1 4.09Å; F466-F486 AromaticContact CE1-CE2 3.93Å; F466-F486 HydrophobicContact CE1-CE2 3.93Å; F466-F486 AromaticContact CE1-CG 3.96Å; F466-F486 HydrophobicContact CE1-CG 3.96Å; F466-F486 HydrophobicContact CE1-CZ 4.04Å; F466-F486 AromaticContact CE2-CD2 3.85Å; F466-F486 HydrophobicContact CE2-CD2 3.85Å; F466-F486 HydrophobicContact CE2-CE2 4.35Å; F466-F486 HydrophobicContact CE2-CG 4.28Å; F466-F486 HydrophobicContact CG-CE2 4.38Å; F466-F486 HydrophobicContact CZ-CB 4Å; F466-F486 HydrophobicContact CZ-CD1 4.12Å; F466-F486 AromaticContact CZ-CD2 3.58Å; F466-F486 HydrophobicContact CZ-CD2 3.58Å; F466-F486 HydrophobicContact CZ-CE2 4.06Å; F466-F486 AromaticContact CZ-CG 3.61Å; F466-F486 HydrophobicContact CZ-CG 3.61Å; L483-F486 HydrophobicContact CD2-CB 4.42Å; L483-F486 HydrophobicContact CD2-CD1 3.96Å; L483-F486 HydrophobicContact CD2-CG 4.44Å; L483-F486 PolarHBondContact O-N 3.3Å; L483-F486 VanDerWaalsContact O-O 3.09Å; F486-I488 HydrophobicContact CE1-CD1 4.14Å; F486-I488 HydrophobicContact CE1-CG1 4.11Å; F486-I488 HydrophobicContact CZ-CD1 4.04Å; F486-I488 HydrophobicContact CZ-CG1 4.07Å; F486-F508 AromaticContact CD1-CD2 3.73Å; F486-F508 HydrophobicContact CD1-CD2 3.73Å; F486-F508 HydrophobicContact CD1-CE2 4.07Å; F486-F508 HydrophobicContact CD1-CG 4.42Å; F486-F508 AromaticContact CE1-CD2 3.91Å; F486-F508 HydrophobicContact CE1-CD2 3.91Å; F486-F508 AromaticContact CE1-CE2 3.82Å; F486-F508 HydrophobicContact CE1-CE2 3.82Å; F486-F508 HydrophobicContact CE1-CZ 4.42Å
487	T	95.2	Very high	93.7	Very high	2 Å²	2	41.5 Å²	41.5	1%	0.012	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	157.5	-179.4	56.9	0	0	0	0	110.7	K366 F367 C428 F506 V507	K366-T487 HydrophobicContact CB-CG2 3.8Å; K366-T487 PolarHBondContact O-OG1 3.09Å; F367-T487 HydrophobicContact CE1-CG2 4.25Å; F367-T487 HydrophobicContact CZ-CG2 3.99Å; C428-T487 WeakPolarHBondContact CA-O 3.36Å; C428-T487 WeakPolarHBondContact CB-O 3.36Å; C428-T487 WeakPolarHBondContact CB-OG1 3.47Å; C428-T487 PolarHBondContact N-O 2.99Å; C428-T487 PolarHBondContact O-N 3.16Å; T487-F506 WeakPolarHBondContact CA-O 3.3Å; T487-F506 WeakPolarHBondContact CB-O 3.13Å; T487-V507 HydrophobicContact CG2-CG1 3.94Å
488	I	95.8	Very high	93.7	Very high	20 Å²	20	42.2 Å²	42.2	10%	0.103	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	132.4	172.9	-58.5	179.2	0	0	0	107.7	T425 K426 V427 M463 F486 F506 F508	T425-I488 HydrophobicContact CG2-CG2 3.52Å; K426-I488 WeakPolarHBondContact O-CA 3.47Å; V427-I488 HydrophobicContact CG2-CD1 4.44Å; V427-I488 HydrophobicContact CG2-CG1 4.35Å; M463-I488 HydrophobicContact CE-CD1 4.19Å; M463-I488 HydrophobicContact SD-CD1 4.49Å; F486-I488 HydrophobicContact CE1-CD1 4.14Å; F486-I488 HydrophobicContact CE1-CG1 4.11Å; F486-I488 HydrophobicContact CZ-CD1 4.04Å; F486-I488 HydrophobicContact CZ-CG1 4.07Å; I488-F506 HydrophobicContact CB-CB 4.14Å; I488-F506 HydrophobicContact CB-CD2 3.99Å; I488-F506 HydrophobicContact CG2-CD2 4.01Å; I488-F506 PolarHBondContact N-O 2.94Å; I488-F506 WeakPolarHBondContact O-CB 3.3Å; I488-F506 PolarHBondContact O-N 3.11Å; I488-F508 HydrophobicContact CB-CE2 4.34Å; I488-F508 HydrophobicContact CD1-CE2 4.19Å; I488-F508 HydrophobicContact CD1-CZ 3.94Å; I488-F508 HydrophobicContact CG1-CE2 3.98Å; I488-F508 HydrophobicContact CG1-CZ 4.2Å
489	L	95.1	Very high	93.7	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.005	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	113.6	174.2	-176.8	64.8	0	0	0	108.3	F367 L374 L377 K426 A505	F367-L489 HydrophobicContact CD1-CB 3.97Å; F367-L489 HydrophobicContact CD1-CD1 4.33Å; F367-L489 HydrophobicContact CE1-CB 4.15Å; F367-L489 HydrophobicContact CE1-CD1 4.45Å; L374-L489 HydrophobicContact CD1-CD1 4.11Å; L377-L489 HydrophobicContact CD1-CD2 4.44Å; K426-L489 HydrophobicContact CB-CB 4.4Å; K426-L489 PolarHBondContact N-O 2.76Å; K426-L489 PolarHBondContact O-N 2.69Å; L489-A505 HydrophobicContact CD1-CB 4.41Å
490	Q	95.4	Very high	93.7	Very high	5 Å²	5	42.4 Å²	42.4	2%	0.023	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	121.8	174.2	-178.3	171.1	85.6	0	0	110.1	Y413 V423 S424 T425 C503 I504 F506	Y413-Q490 VanDerWaalsContact OH-CD 3.28Å; Y413-Q490 PolarHBondContact OH-NE2 2.66Å; Y413-Q490 PolarHBondContact OH-OE1 3.15Å; V423-Q490 HydrophobicContact CG1-CG 3.92Å; S424-Q490 CarbonylContact O-C 3.52Å; S424-Q490 WeakPolarHBondContact O-CA 3.31Å; T425-Q490 PolarHBondContact OG1-NE2 3.19Å; Q490-C503 CarbonylContact O-C 3.53Å; Q490-C503 WeakPolarHBondContact O-CA 3.4Å; Q490-I504 PolarHBondContact N-O 3Å; Q490-I504 PolarHBondContact O-N 3.4Å; Q490-F506 HydrophobicContact CB-CD2 4.48Å; Q490-F506 HydrophobicContact CB-CE2 3.72Å
491	L	94.9	Very high	93.7	Very high	19 Å²	19	40.3 Å²	40.3	10%	0.099	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	118	-179.5	-179.3	67.8	0	0	0	108.9	L377 S424 T493 T500 C503	L377-L491 HydrophobicContact CD1-CD1 4.26Å; L377-L491 HydrophobicContact CD1-CD2 4Å; L377-L491 HydrophobicContact CD2-CD1 4.3Å; L377-L491 HydrophobicContact CD2-CD2 3.89Å; S424-L491 PolarHBondContact N-O 3.2Å; S424-L491 PolarHBondContact O-N 2.87Å; L491-T493 HydrophobicContact CD1-CG2 4.33Å; L491-T493 HydrophobicContact CD2-CG2 4.04Å; L491-T493 HydrophobicContact CG-CG2 3.89Å; L491-T500 HydrophobicContact CD1-CG2 3.77Å; L491-C503 HydrophobicContact CD1-CB 4.07Å
492	V	95.7	Very high	93.8	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	117.3	172.9	-171.9	0	0	0	0	107.9	I319 Y413 I421 S422 V423 L501 L502	I319-V492 HydrophobicContact CD1-CG1 4.38Å; Y413-V492 HydrophobicContact CE1-CG2 3.96Å; I421-V492 HydrophobicContact CB-CG1 4.17Å; I421-V492 HydrophobicContact CD1-CG1 4.13Å; S422-V492 WeakPolarHBondContact O-CA 3.47Å; V423-V492 HydrophobicContact CG1-CG2 4.43Å; V423-V492 HydrophobicContact CG2-CG1 4.33Å; V423-V492 HydrophobicContact CG2-CG2 4.26Å; V492-L501 HydrophobicContact CG1-CB 4.4Å; V492-L501 HydrophobicContact CG1-CD1 4.38Å; V492-L501 WeakPolarHBondContact O-CB 3.35Å; V492-L501 PolarHBondContact O-N 2.86Å; V492-L502 HydrophobicContact CB-CB 3.98Å; V492-L502 HydrophobicContact CG2-CB 4.11Å; V492-L502 PolarHBondContact N-O 3.01Å; V492-L502 PolarHBondContact O-N 3.13Å
493	T	94.7	Very high	93.8	Very high	17 Å²	17	34.4 Å²	34.4	10%	0.104	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	154.3	174.4	63.4	0	0	0	0	111.8	I421 S422 L491 E499	I421-T493 WeakPolarHBondContact CA-O 3.38Å; S422-T493 PolarHBondContact N-O 2.88Å; S422-T493 PolarHBondContact O-N 3.27Å; L491-T493 HydrophobicContact CD1-CG2 4.33Å; L491-T493 HydrophobicContact CD2-CG2 4.04Å; L491-T493 HydrophobicContact CG-CG2 3.89Å; T493-E499 CarbonylContact C-O 3.57Å; T493-E499 WeakPolarHBondContact CA-O 3.35Å; T493-E499 VanDerWaalsContact CB-O 3.3Å; T493-E499 WeakPolarHBondContact CB-O 3.32Å
494	T	94.6	Very high	93.9	Very high	9 Å²	9	34 Å²	34	6%	0.055	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	137.5	164.7	-48.4	0	0	0	0	109.5	M419 T497 L498 E499 L501	M419-T494 HydrophobicContact CB-CG2 4.34Å; T494-T497 VanDerWaalsContact CB-OG1 3.25Å; T494-T497 WeakPolarHBondContact CB-OG1 3.32Å; T494-T497 WeakPolarHBondContact CG2-OG1 3.42Å; T494-L498 VanDerWaalsContact O-CA 3.3Å; T494-L498 WeakPolarHBondContact O-CA 3.27Å; T494-L498 PolarHBondContact O-N 2.7Å; T494-L498 VanDerWaalsContact O-N 3.11Å; T494-E499 PolarHBondContact N-O 3.41Å; T494-L501 WeakPolarHBondContact OG1-CD2 3.36Å
495	K	91.5	Very high	94	Very high	82 Å²	82	28.6 Å²	28.6	36%	0.357	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-41.1	179.6	-169.3	-175.8	-179.8	-169.8	0	112.2	A420 Y442	A420-K495 HydrophobicContact CB-CB 3.77Å; A420-K495 HydrophobicContact CB-CD 3.92Å; A420-K495 WeakPolarHBondContact O-CB 3.16Å; A420-K495 PolarHBondContact O-N 3.49Å; Y442-K495 PolarHBondContact OH-NZ 3.35Å
496	D	90.7	Very high	94.3	Very high	125 Å²	125	26.7 Å²	26.7	67%	0.668	14%	0.14	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-41	-170.5	-45.7	-61.9	0	0	0	112.9
497	T	91.5	Very high	94.3	Very high	92 Å²	92	27.9 Å²	27.9	56%	0.564	15%	0.147	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97	-11.4	-177.3	63.4	0	0	0	0	114.3	T494 E499	T494-T497 VanDerWaalsContact CB-OG1 3.25Å; T494-T497 WeakPolarHBondContact CB-OG1 3.32Å; T494-T497 WeakPolarHBondContact CG2-OG1 3.42Å; T497-E499 PolarHBondContact O-N 2.77Å; T497-E499 WeakPolarHBondContact OG1-CB 3.34Å; T497-E499 PolarHBondContact OG1-N 2.93Å
498	L	91	Very high	94.3	Very high	106 Å²	106	29.1 Å²	29.1	56%	0.555	15%	0.153	S	C	*	.			trans	54.4	18.9	-172	-53.8	178.9	0	0	0	114.5	R380 T494	R380-L498 PolarHBondContact NH2-O 3.13Å; T494-L498 VanDerWaalsContact O-CA 3.3Å; T494-L498 WeakPolarHBondContact O-CA 3.27Å; T494-L498 PolarHBondContact O-N 2.7Å; T494-L498 VanDerWaalsContact O-N 3.11Å
499	E	92.8	Very high	94.3	Very high	68 Å²	68	31.5 Å²	31.5	32%	0.318	16%	0.163	S	C	.	.			trans	-64.5	135.4	175.1	-176	-175.7	-179.9	0	0	110.3	K318 T493 T494 T497 L501	K318-E499 IonicContact NZ-OE1 2.69Å; K318-E499 PolarHBondContact NZ-OE1 3.33Å; K318-E499 IonicContact NZ-OE2 2.71Å; K318-E499 PolarHBondContact NZ-OE2 3.11Å; T493-E499 CarbonylContact C-O 3.57Å; T493-E499 WeakPolarHBondContact CA-O 3.35Å; T493-E499 VanDerWaalsContact CB-O 3.3Å; T493-E499 WeakPolarHBondContact CB-O 3.32Å; T494-E499 PolarHBondContact N-O 3.41Å; T497-E499 PolarHBondContact O-N 2.77Å; T497-E499 WeakPolarHBondContact OG1-CB 3.34Å; T497-E499 PolarHBondContact OG1-N 2.93Å; E499-L501 PolarHBondContact O-N 2.91Å
500	T	94	Very high	94.3	Very high	3 Å²	3	31.6 Å²	31.6	2%	0.018	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	110.2	174.3	-48.7	0	0	0	0	109.7	R380 G381 P382 F386 L491 C503	R380-T500 PolarHBondContact NH2-OG1 2.95Å; G381-T500 WeakPolarHBondContact O-CB 3.3Å; G381-T500 PolarHBondContact O-OG1 3.2Å; P382-T500 WeakPolarHBondContact CD-O 3.07Å; F386-T500 HydrophobicContact CE2-CG2 4.22Å; F386-T500 HydrophobicContact CZ-CG2 4.09Å; L491-T500 HydrophobicContact CD1-CG2 3.77Å; T500-C503 HydrophobicContact CG2-CB 4.33Å
501	L	94.7	Very high	94.2	Very high	3 Å²	3	31.9 Å²	31.9	2%	0.016	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	-38.2	177.3	-61.4	172.7	0	0	0	111.7	S316 K318 I319 M419 I421 V492 T494 E499	S316-L501 WeakPolarHBondContact CB-O 3.46Å; S316-L501 PolarHBondContact OG-O 3.18Å; K318-L501 HydrophobicContact CB-CD2 4.07Å; K318-L501 HydrophobicContact CD-CD2 3.86Å; I319-L501 HydrophobicContact CG2-CB 3.74Å; M419-L501 HydrophobicContact SD-CD1 3.44Å; M419-L501 WeakPolarHBondContact SD-CD1 3.4Å; M419-L501 HydrophobicContact SD-CD2 3.76Å; M419-L501 HydrophobicContact SD-CG 4.25Å; I421-L501 HydrophobicContact CG2-CD1 3.79Å; V492-L501 HydrophobicContact CG1-CB 4.4Å; V492-L501 HydrophobicContact CG1-CD1 4.38Å; V492-L501 WeakPolarHBondContact O-CB 3.35Å; V492-L501 PolarHBondContact O-N 2.86Å; T494-L501 WeakPolarHBondContact OG1-CD2 3.36Å; E499-L501 PolarHBondContact O-N 2.91Å
502	L	94.9	Very high	93.8	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	139.9	-179.5	-155.6	64.4	0	0	0	110	V314 I319 L321 F387 Y413 V492 I504	V314-L502 HydrophobicContact CG1-CD1 4.08Å; V314-L502 HydrophobicContact CG1-CD2 3.97Å; V314-L502 HydrophobicContact CG1-CG 4.25Å; I319-L502 HydrophobicContact CG2-CB 3.98Å; I319-L502 HydrophobicContact CG2-CD2 4.45Å; L321-L502 HydrophobicContact CB-CD2 4.2Å; F387-L502 HydrophobicContact CD2-CD1 3.99Å; F387-L502 HydrophobicContact CE2-CD1 3.75Å; Y413-L502 HydrophobicContact CD1-CD2 4.46Å; Y413-L502 HydrophobicContact CE1-CD2 4.45Å; V492-L502 HydrophobicContact CB-CB 3.98Å; V492-L502 HydrophobicContact CG2-CB 4.11Å; V492-L502 PolarHBondContact N-O 3.01Å; V492-L502 PolarHBondContact O-N 3.13Å; L502-I504 HydrophobicContact CD2-CD1 3.91Å; L502-I504 HydrophobicContact CD2-CG1 4.25Å; L502-I504 HydrophobicContact CG-CD1 4.34Å; L502-I504 HydrophobicContact CG-CG1 4.11Å
503	C	95	Very high	92.9	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.007	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	116	175.9	-173.1	0	0	0	0	109	A385 F386 F387 Q490 L491 T500	A385-C503 PolarHBondContact O-N 2.93Å; F386-C503 WeakPolarHBondContact CA-O 3.45Å; F386-C503 HydrophobicContact CD1-CB 3.58Å; F386-C503 HydrophobicContact CD2-CB 4.5Å; F386-C503 HydrophobicContact CE1-CB 3.53Å; F386-C503 WeakPolarHBondContact CE1-SG 3.42Å; F386-C503 HydrophobicContact CE2-CB 4.43Å; F386-C503 HydrophobicContact CG-CB 4.07Å; F386-C503 HydrophobicContact CZ-CB 3.94Å; F387-C503 PolarHBondContact N-O 2.96Å; Q490-C503 CarbonylContact O-C 3.53Å; Q490-C503 WeakPolarHBondContact O-CA 3.4Å; L491-C503 HydrophobicContact CD1-CB 4.07Å; T500-C503 HydrophobicContact CG2-CB 4.33Å
504	I	95.5	Very high	91.9	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	114.4	-174.3	-45	174.1	0	0	0	108.8	V314 L321 F387 V389 Q490 L502 F506	V314-I504 HydrophobicContact CG1-CD1 3.8Å; V314-I504 HydrophobicContact CG1-CG1 4Å; L321-I504 HydrophobicContact CD2-CD1 3.8Å; F387-I504 WeakPolarHBondContact O-CA 3.18Å; V389-I504 HydrophobicContact CB-CG2 4.46Å; V389-I504 HydrophobicContact CG2-CG2 3.73Å; Q490-I504 PolarHBondContact N-O 3Å; Q490-I504 PolarHBondContact O-N 3.4Å; L502-I504 HydrophobicContact CD2-CD1 3.91Å; L502-I504 HydrophobicContact CD2-CG1 4.25Å; L502-I504 HydrophobicContact CG-CD1 4.34Å; L502-I504 HydrophobicContact CG-CG1 4.11Å; I504-F506 HydrophobicContact CB-CE1 4.45Å; I504-F506 HydrophobicContact CB-CE2 4.28Å; I504-F506 HydrophobicContact CB-CZ 4.03Å; I504-F506 HydrophobicContact CD1-CZ 4.4Å; I504-F506 HydrophobicContact CG2-CD1 4.05Å; I504-F506 HydrophobicContact CG2-CE1 3.49Å; I504-F506 VanDerWaalsContact CG2-CE1 3.49Å; I504-F506 HydrophobicContact CG2-CE2 4.13Å; I504-F506 HydrophobicContact CG2-CZ 3.55Å
505	A	95.5	Very high	91.5	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	122.6	170.6	0	0	0	0	0	109.2	F367 F387 L388 V389 L489 L523	F367-A505 HydrophobicContact CE1-CB 4.05Å; F367-A505 HydrophobicContact CE2-CB 3.75Å; F367-A505 HydrophobicContact CZ-CB 3.45Å; F367-A505 VanDerWaalsContact CZ-CB 3.45Å; F387-A505 PolarHBondContact O-N 2.83Å; L388-A505 CarbonylContact C-O 3.59Å; L388-A505 WeakPolarHBondContact CA-O 3.42Å; L388-A505 HydrophobicContact CD1-CB 3.71Å; V389-A505 PolarHBondContact N-O 2.8Å; L489-A505 HydrophobicContact CD1-CB 4.41Å; A505-L523 HydrophobicContact CB-CD1 4.45Å
506	F	96.2	Very high	91.5	Very high	2 Å²	2	45.1 Å²	45.1	1%	0.009	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	128.9	176.6	-60.2	-68.4	0	0	0	111	F324 I344 V389 F391 T487 I488 Q490 I504 F508	F324-F506 HydrophobicContact CE1-CZ 4.42Å; F324-F506 HydrophobicContact CE2-CZ 4.38Å; F324-F506 HydrophobicContact CZ-CE2 4.48Å; F324-F506 HydrophobicContact CZ-CZ 4.29Å; I344-F506 HydrophobicContact CD1-CE1 4.07Å; V389-F506 HydrophobicContact CB-CD1 3.82Å; V389-F506 HydrophobicContact CB-CE1 4.05Å; V389-F506 HydrophobicContact CG1-CD1 4.35Å; V389-F506 HydrophobicContact CG1-CE1 4.49Å; V389-F506 HydrophobicContact CG2-CD1 4.46Å; V389-F506 HydrophobicContact CG2-CE1 4.25Å; V389-F506 WeakPolarHBondContact O-CA 3.48Å; F391-F506 AromaticContact CD2-CD1 3.93Å; F391-F506 HydrophobicContact CD2-CD1 3.93Å; F391-F506 AromaticContact CE2-CD1 3.3Å; F391-F506 HydrophobicContact CE2-CD1 3.3Å; F391-F506 AromaticContact CE2-CE1 3.63Å; F391-F506 HydrophobicContact CE2-CE1 3.63Å; F391-F506 HydrophobicContact CE2-CG 4.13Å; F391-F506 HydrophobicContact CZ-CD1 4.17Å; F391-F506 HydrophobicContact CZ-CE1 4.08Å; T487-F506 WeakPolarHBondContact CA-O 3.3Å; T487-F506 WeakPolarHBondContact CB-O 3.13Å; I488-F506 HydrophobicContact CB-CB 4.14Å; I488-F506 HydrophobicContact CB-CD2 3.99Å; I488-F506 HydrophobicContact CG2-CD2 4.01Å; I488-F506 PolarHBondContact N-O 2.94Å; I488-F506 WeakPolarHBondContact O-CB 3.3Å; I488-F506 PolarHBondContact O-N 3.11Å; Q490-F506 HydrophobicContact CB-CD2 4.48Å; Q490-F506 HydrophobicContact CB-CE2 3.72Å; I504-F506 HydrophobicContact CB-CE1 4.45Å; I504-F506 HydrophobicContact CB-CE2 4.28Å; I504-F506 HydrophobicContact CB-CZ 4.03Å; I504-F506 HydrophobicContact CD1-CZ 4.4Å; I504-F506 HydrophobicContact CG2-CD1 4.05Å; I504-F506 HydrophobicContact CG2-CE1 3.49Å; I504-F506 VanDerWaalsContact CG2-CE1 3.49Å; I504-F506 HydrophobicContact CG2-CE2 4.13Å; I504-F506 HydrophobicContact CG2-CZ 3.55Å; F506-F508 HydrophobicContact CB-CE2 3.73Å; F506-F508 HydrophobicContact CB-CZ 3.68Å
507	V	95.6	Very high	91.5	Very high	30 Å²	30	44.7 Å²	44.7	18%	0.182	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	148	172.2	-62.8	0	0	0	0	109.4	F367 L388 V389 K390 F391 T487	F367-V507 HydrophobicContact CZ-CG1 4.3Å; L388-V507 HydrophobicContact CD1-CG1 3.89Å; L388-V507 HydrophobicContact CD1-CG2 4.11Å; V389-V507 PolarHBondContact O-N 3.04Å; K390-V507 WeakPolarHBondContact CA-O 3.49Å; K390-V507 HydrophobicContact CB-CG2 3.88Å; K390-V507 HydrophobicContact CG-CG2 4.11Å; F391-V507 PolarHBondContact N-O 3.17Å; T487-V507 HydrophobicContact CG2-CG1 3.94Å
508	F	95.8	Very high	91.6	Very high	28 Å²	28	43.7 Å²	43.7	12%	0.123	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	139.7	-165.2	-59.1	-91.9	0	0	0	112.7	F391 L483 F486 I488 F506	F391-F508 HydrophobicContact CB-CD1 3.8Å; F391-F508 HydrophobicContact CB-CE1 4.18Å; F391-F508 HydrophobicContact CD2-CD1 4.01Å; F391-F508 AromaticContact CD2-CE1 3.5Å; F391-F508 HydrophobicContact CD2-CE1 3.5Å; F391-F508 HydrophobicContact CD2-CZ 4.1Å; F391-F508 HydrophobicContact CE2-CE1 4.24Å; F391-F508 HydrophobicContact CG-CD1 4.35Å; F391-F508 HydrophobicContact CG-CE1 4.22Å; F391-F508 CarbonylContact O-C 3.53Å; F391-F508 WeakPolarHBondContact O-CA 3.35Å; L483-F508 HydrophobicContact CB-CB 4.24Å; L483-F508 WeakPolarHBondContact CB-O 3.47Å; L483-F508 HydrophobicContact CD1-CB 4.09Å; L483-F508 HydrophobicContact CD2-CB 3.95Å; L483-F508 HydrophobicContact CG-CB 4.33Å; F486-F508 AromaticContact CD1-CD2 3.73Å; F486-F508 HydrophobicContact CD1-CD2 3.73Å; F486-F508 HydrophobicContact CD1-CE2 4.07Å; F486-F508 HydrophobicContact CD1-CG 4.42Å; F486-F508 AromaticContact CE1-CD2 3.91Å; F486-F508 HydrophobicContact CE1-CD2 3.91Å; F486-F508 AromaticContact CE1-CE2 3.82Å; F486-F508 HydrophobicContact CE1-CE2 3.82Å; F486-F508 HydrophobicContact CE1-CZ 4.42Å; I488-F508 HydrophobicContact CB-CE2 4.34Å; I488-F508 HydrophobicContact CD1-CE2 4.19Å; I488-F508 HydrophobicContact CD1-CZ 3.94Å; I488-F508 HydrophobicContact CG1-CE2 3.98Å; I488-F508 HydrophobicContact CG1-CZ 4.2Å; F506-F508 HydrophobicContact CB-CE2 3.73Å; F506-F508 HydrophobicContact CB-CZ 3.68Å
509	E	95.3	Very high	91.7	Very high	70 Å²	70	44 Å²	44	33%	0.327	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	170.3	158.6	-76.3	168.3	-165.3	0	0	107.2	K390 F391 W392 A393	K390-E509 WeakPolarHBondContact CE-OE1 3.48Å; K390-E509 WeakPolarHBondContact CE-OE2 3.44Å; K390-E509 IonicContact NZ-OE1 3.44Å; K390-E509 PolarHBondContact NZ-OE1 2.87Å; K390-E509 IonicContact NZ-OE2 2.78Å; K390-E509 PolarHBondContact NZ-OE2 3.32Å; F391-E509 PolarHBondContact O-N 2.8Å; W392-E509 CarbonylContact C-O 3.51Å; W392-E509 WeakPolarHBondContact CA-O 3.26Å; W392-E509 PolarHBondContact NE1-OE2 2.93Å; A393-E509 PolarHBondContact N-O 3.05Å
510	I	94.5	Very high	91.7	Very high	4 Å²	4	41.7 Å²	41.7	2%	0.021	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	154.9	169.2	-48.4	-66.3	0	0	0	109.4	A393 V395 L470 R476 M479 N480 L483	A393-I510 CarbonylContact O-C 3.49Å; A393-I510 WeakPolarHBondContact O-CA 3.19Å; A393-I510 WeakPolarHBondContact O-CG2 3.25Å; V395-I510 HydrophobicContact CG1-CD1 3.83Å; V395-I510 HydrophobicContact CG1-CG2 4.48Å; V395-I510 HydrophobicContact CG2-CD1 4.35Å; V395-I510 HydrophobicContact CG2-CG2 3.65Å; L470-I510 HydrophobicContact CD2-CD1 4.03Å; R476-I510 VanDerWaalsContact NH2-C 3.34Å; R476-I510 PolarHBondContact NH2-O 2.93Å; M479-I510 HydrophobicContact CB-CD1 3.92Å; M479-I510 HydrophobicContact CB-CG1 3.67Å; M479-I510 HydrophobicContact SD-CD1 4.16Å; M479-I510 HydrophobicContact SD-CG1 4.14Å; N480-I510 WeakPolarHBondContact OD1-CG1 3.36Å; N480-I510 PolarHBondContact OD1-N 3.28Å; L483-I510 HydrophobicContact CD1-CD1 3.48Å; L483-I510 VanDerWaalsContact CD1-CD1 3.48Å; L483-I510 HydrophobicContact CD1-CG1 4Å
511	S	92.9	Very high	91.7	Very high	10 Å²	10	43.1 Å²	43.1	7%	0.07	23%	0.23	C	C	.	.			trans	-81.5	135	173.7	-168.7	0	0	0	0	113.6	A393 R476 G513 G515	A393-S511 PolarHBondContact O-N 3.01Å; R476-S511 VanDerWaalsContact CZ-O 3.32Å; R476-S511 VanDerWaalsContact NH1-C 3.33Å; R476-S511 PolarHBondContact NH1-O 3.34Å; R476-S511 PolarHBondContact NH2-O 3.24Å; S511-G513 VanDerWaalsContact C-N 3.29Å; S511-G513 PolarHBondContact OG-O 2.99Å; S511-G515 VanDerWaalsContact CB-O 3.23Å; S511-G515 WeakPolarHBondContact CB-O 3.2Å; S511-G515 PolarHBondContact OG-O 2.95Å
512	D	86.6	Confident	91.6	Very high	139 Å²	139	48.5 Å²	48.5	74%	0.743	25%	0.25	S	C	*	.	S	Bend	trans	-79.1	-9.7	-179.4	-72.4	-67.5	0	0	0	113.4	R476	R476-D512 IonicContact CZ-OD1 3.94Å; R476-D512 IonicContact NE-OD1 3.13Å; R476-D512 PolarHBondContact NE-OD1 2.97Å; R476-D512 IonicContact NH2-OD1 3.31Å; R476-D512 PolarHBondContact NH2-OD1 3.2Å; R476-D512 IonicContact NH2-OD2 2.85Å; R476-D512 PolarHBondContact NH2-OD2 2.84Å
513	G	77	Confident	91.5	Very high	38 Å²	38	48.6 Å²	48.6	39%	0.392	25%	0.25	S	C	.	.	S	Bend	trans	-135	-174.5	-178.9	0	0	0	0	0	113.2	S511 G515	S511-G513 VanDerWaalsContact C-N 3.29Å; S511-G513 PolarHBondContact OG-O 2.99Å; G513-G515 VanDerWaalsContact C-N 3.34Å; G513-G515 PolarHBondContact O-N 3.39Å
514	D	75	Confident	91.3	Very high	175 Å²	175	50.2 Å²	50.2	94%	0.936	26%	0.26	S	S	*	.	S	Bend	trans	-73.5	80.7	-174.6	-60.4	-29.6	0	0	0	112
515	G	85.5	Confident	90.7	Very high	23 Å²	23	54.3 Å²	54.3	24%	0.237	28%	0.279	C	S	.	.	S	Bend	trans	133.9	160.9	172.1	0	0	0	0	0	114.5	D394 S511 G513	D394-G515 WeakPolarHBondContact OD2-CA 3.28Å; S511-G515 VanDerWaalsContact CB-O 3.23Å; S511-G515 WeakPolarHBondContact CB-O 3.2Å; S511-G515 PolarHBondContact OG-O 2.95Å; G513-G515 VanDerWaalsContact C-N 3.34Å; G513-G515 PolarHBondContact O-N 3.39Å
516	S	90.9	Very high	89.6	Confident	31 Å²	31	57.9 Å²	57.9	22%	0.217	30%	0.301	C	S	.	.			trans	-74.9	142.8	-179.5	81.8	0	0	0	0	112.5	L341 R343 W392	L341-S516 VanDerWaalsContact O-CB 3.25Å; L341-S516 WeakPolarHBondContact O-CB 3.31Å; R343-S516 PolarHBondContact N-OG 3.05Å; W392-S516 VanDerWaalsContact O-CA 3.29Å; W392-S516 WeakPolarHBondContact O-CA 3.42Å
517	Q	92	Very high	87.9	Confident	116 Å²	116	63.4 Å²	63.4	54%	0.542	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	159.9	172.9	-52.6	-177.6	10.6	0	0	110.6	W392	W392-Q517 HydrophobicContact CB-CB 4.13Å; W392-Q517 HydrophobicContact CE3-CB 4.11Å; W392-Q517 PolarHBondContact N-O 3.13Å; W392-Q517 PolarHBondContact O-N 2.62Å
518	H	93.1	Very high	85.1	Confident	71 Å²	71	74.4 Å²	74.4	33%	0.329	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	155.4	175	70.4	-83.9	0	0	0	111.9	R343 V389 K390 F391	R343-H518 PolarHBondContact O-CE1 3.49Å; R343-H518 PolarHBondContact O-ND1 3.42Å; V389-H518 HydrophobicContact CG1-CB 4.26Å; K390-H518 CarbonylContact O-C 3.57Å; K390-H518 VanDerWaalsContact O-CA 3.23Å; K390-H518 WeakPolarHBondContact O-CA 3.41Å; F391-H518 HydrophobicContact CD1-CB 3.56Å; F391-H518 HydrophobicContact CE1-CB 3.73Å
519	R	91.9	Very high	84.6	Confident	112 Å²	112	76.7 Å²	76.7	42%	0.423	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	130.7	169.7	-173.1	162.7	173.8	160	-2.1	109.5	E356 V389 K390 W392 Y521	E356-R519 IonicContact OE1-CZ 2.83Å; E356-R519 IonicContact OE1-NH2 2.46Å; E356-R519 PolarHBondContact OE1-NH2 3.01Å; E356-R519 IonicContact OE2-CZ 2.71Å; E356-R519 VanDerWaalsContact OE2-CZ 3.31Å; E356-R519 IonicContact OE2-NE 3.06Å; E356-R519 PolarHBondContact OE2-NE 3.15Å; E356-R519 VanDerWaalsContact OE2-NE 3.13Å; E356-R519 IonicContact OE2-NH2 3.75Å; E356-R519 PolarHBondContact OE2-NH2 3.15Å; V389-R519 WeakPolarHBondContact CA-O 3.26Å; K390-R519 PolarHBondContact N-O 2.86Å; K390-R519 PolarHBondContact O-N 2.94Å; W392-R519 HydrophobicContact CH2-CB 4.17Å; W392-R519 HydrophobicContact CZ3-CB 3.84Å; R519-Y521 HydrophobicContact CB-CE2 4.07Å; R519-Y521 VanDerWaalsContact CD-OH 3.24Å; R519-Y521 WeakPolarHBondContact CD-OH 3.25Å; R519-Y521 HydrophobicContact CG-CE1 4.18Å; R519-Y521 HydrophobicContact CG-CE2 3.83Å; R519-Y521 PolarHBondContact NE-OH 3.06Å
520	V	93.6	Very high	84	Confident	20 Å²	20	77.1 Å²	77.1	12%	0.121	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	137.2	-179	-176.3	0	0	0	0	108.9	V314 L355 F387 V389	V314-V520 HydrophobicContact CG2-CG1 3.54Å; V314-V520 HydrophobicContact CG2-CG2 4.13Å; L355-V520 HydrophobicContact CD1-CG1 3.9Å; L355-V520 HydrophobicContact CD2-CB 3.69Å; L355-V520 HydrophobicContact CD2-CG1 3.75Å; L355-V520 HydrophobicContact CG-CG1 4.47Å; F387-V520 HydrophobicContact CD1-CG1 4.29Å; V389-V520 HydrophobicContact CG2-CG1 4.37Å; V389-V520 HydrophobicContact CG2-CG2 4.16Å
521	Y	93.4	Very high	83.5	Confident	33 Å²	33	81.1 Å²	81.1	13%	0.129	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	144.9	175.7	-55.6	-89.6	0	0	0	109.2	E356 I358 F387 L388 K390 R519	E356-Y521 HydrophobicContact CB-CD1 3.86Å; E356-Y521 HydrophobicContact CB-CE1 4.3Å; E356-Y521 CarbonylContact O-C 3.58Å; E356-Y521 WeakPolarHBondContact O-CA 3.5Å; E356-Y521 VanDerWaalsContact OE2-CE1 3.23Å; E356-Y521 WeakPolarHBondContact OE2-CE1 3.49Å; I358-Y521 HydrophobicContact CD1-CD1 3.34Å; I358-Y521 HydrophobicContact CD1-CD2 3.92Å; I358-Y521 HydrophobicContact CD1-CE1 3.67Å; I358-Y521 HydrophobicContact CD1-CE2 4.22Å; I358-Y521 HydrophobicContact CD1-CG 3.46Å; I358-Y521 VanDerWaalsContact CD1-CG 3.46Å; I358-Y521 HydrophobicContact CG1-CD1 3.76Å; I358-Y521 HydrophobicContact CG1-CE1 4.37Å; I358-Y521 HydrophobicContact CG1-CG 4.07Å; F387-Y521 WeakPolarHBondContact CA-O 3.5Å; L388-Y521 HydrophobicContact CD2-CD2 4.38Å; L388-Y521 PolarHBondContact N-O 2.71Å; L388-Y521 PolarHBondContact O-N 3.5Å; K390-Y521 HydrophobicContact CB-CE2 4.04Å; R519-Y521 HydrophobicContact CB-CE2 4.07Å; R519-Y521 VanDerWaalsContact CD-OH 3.24Å; R519-Y521 WeakPolarHBondContact CD-OH 3.25Å; R519-Y521 HydrophobicContact CG-CE1 4.18Å; R519-Y521 HydrophobicContact CG-CE2 3.83Å; R519-Y521 PolarHBondContact NE-OH 3.06Å
522	R	93.1	Very high	82.9	Confident	116 Å²	116	85.3 Å²	85.3	44%	0.438	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	130.8	169.1	-175.4	177.1	174.5	-166.6	-2.5	108.8	L355 E356 A357 I358 T524	L355-R522 HydrophobicContact CB-CB 4.43Å; E356-R522 PolarHBondContact O-N 3.22Å; A357-R522 WeakPolarHBondContact CA-O 3.33Å; I358-R522 PolarHBondContact N-O 3.45Å; R522-T524 HydrophobicContact CG-CG2 4.4Å
523	L	92.8	Very high	82.7	Confident	1 Å²	1	81.9 Å²	81.9	1%	0.005	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	128.9	172.4	-71.1	171.6	0	0	0	109.4	I360 V363 F386 L388 A505	I360-L523 HydrophobicContact CB-CB 4.47Å; I360-L523 HydrophobicContact CB-CD2 4.26Å; I360-L523 HydrophobicContact CD1-CB 4.44Å; I360-L523 HydrophobicContact CD1-CD1 4.23Å; I360-L523 HydrophobicContact CG1-CD1 4.32Å; I360-L523 HydrophobicContact CG1-CD2 4.26Å; V363-L523 HydrophobicContact CG2-CD2 4.16Å; F386-L523 HydrophobicContact CB-CB 3.95Å; F386-L523 HydrophobicContact CB-CD1 4.29Å; F386-L523 PolarHBondContact O-N 3.33Å; L388-L523 HydrophobicContact CB-CD1 4.33Å; L388-L523 HydrophobicContact CB-CD2 3.91Å; L388-L523 HydrophobicContact CB-CG 4.02Å; A505-L523 HydrophobicContact CB-CD1 4.45Å
524	T	90.2	Very high	83	Confident	35 Å²	35	84.9 Å²	84.9	22%	0.215	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	160.2	174.5	56.6	0	0	0	0	109.5	A357 I358 D359 I360 R522	A357-T524 HydrophobicContact CB-CG2 3.97Å; I358-T524 PolarHBondContact O-N 3.47Å; D359-T524 CarbonylContact C-O 3.55Å; D359-T524 WeakPolarHBondContact CA-O 3.39Å; I360-T524 PolarHBondContact N-O 3.05Å; R522-T524 HydrophobicContact CG-CG2 4.4Å
525	H	84.1	Confident	83.6	Confident	87 Å²	87	78.4 Å²	78.4	40%	0.403	38%	0.384	S	S	.	.			trans	-103.9	111.7	168	-177.3	-90.2	0	0	0	108.9	I360 Y378 T527	I360-H525 HydrophobicContact CG2-CB 4.34Å; Y378-H525 HydrophobicContact CE1-CB 3.78Å; Y378-H525 PolarHBondContact OH-N 2.71Å; Y378-H525 VanDerWaalsContact OH-N 3.11Å; H525-T527 PolarHBondContact ND1-OG1 2.69Å; H525-T527 PolarHBondContact O-N 2.94Å; H525-T527 VanDerWaalsContact O-N 3.13Å
526	T	71.8	Confident	83.5	Confident	74 Å²	74	82.7 Å²	82.7	45%	0.454	40%	0.395	S	S	.	.			trans	-84.1	90.1	176.2	-54.1	0	0	0	0	108.9	D359 K528	D359-T526 PolarHBondContact OD1-N 2.87Å; T526-K528 HydrophobicContact CG2-CG 4.41Å; T526-K528 PolarHBondContact O-N 2.95Å
527	T	59.8	Low	82.9	Confident	119 Å²	119	87 Å²	87	73%	0.73	41%	0.41	S	S	*	.			trans	-64.8	105	169.3	-41	0	0	0	0	108.3	H525	H525-T527 PolarHBondContact ND1-OG1 2.69Å; H525-T527 PolarHBondContact O-N 2.94Å; H525-T527 VanDerWaalsContact O-N 3.13Å
528	K	38.4	Very low	82	Confident	260 Å²	260	84.4 Å²	84.4	100%	1.13	40%	0.398	S	S	*	.			trans	-85.9	0	170.5	-75.2	-169.7	175.3	-176.1	0	111.2	T526	T526-K528 HydrophobicContact CG2-CG 4.41Å; T526-K528 PolarHBondContact O-N 2.95Å

Retrieved 528 of 528 residues in 822 ms (Link to these results)

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