A0A087YMT0_POEFO Loading...

Poly-U binding splicing factor b

AlphaFold DB , UniProt , Accession A0A087YMT0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 552 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.7	Very low	36.2	Very low	226 Å²	226	149.9 Å²	149.9	100%	1.113	75%	0.749	S	S	*	*				0	140.9	0	-84	-65.7	-161.9	0	0	107.8
2	Y	31.6	Very low	36.5	Very low	219 Å²	219	147.7 Å²	147.7	86%	0.859	74%	0.74	S	S	*	*			trans	67.6	154.4	-171	-63.1	-79.7	0	0	0	116.2
3	F	27.3	Very low	36.6	Very low	212 Å²	212	142.3 Å²	142.3	93%	0.93	73%	0.732	S	S	*	*			trans	58.8	74.4	-172.1	-71	-81.1	0	0	0	116.7
4	L	40.1	Very low	36.8	Very low	176 Å²	176	139.3 Å²	139.3	92%	0.921	72%	0.724	S	S	*	*			trans	-143.3	77.5	164.1	-148.4	174.1	0	0	0	109.9
5	A	38.4	Very low	36.9	Very low	101 Å²	101	138.5 Å²	138.5	84%	0.835	71%	0.713	S	S	*	*			trans	-160.2	49.8	-179.8	0	0	0	0	0	112.6
6	I	38.1	Very low	37.3	Very low	139 Å²	139	141.4 Å²	141.4	71%	0.713	72%	0.722	S	S	*	*			trans	-93	135.6	170.8	-70.1	177	0	0	0	108.6
7	S	34.1	Very low	37.8	Very low	69 Å²	69	144.4 Å²	144.4	48%	0.483	73%	0.733	S	S	.	*			trans	-79.1	147.9	-168.7	-169	0	0	0	0	112.7	S9 E10	S7-S9 PolarHBondContact O-N 3.3Å; S7-S9 PolarHBondContact OG-OG 3.29Å; S7-E10 PolarHBondContact O-N 3.4Å
8	R	35.9	Very low	38	Very low	221 Å²	221	139.5 Å²	139.5	83%	0.834	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.4	-13.9	-176.4	-154.5	175.8	-172.5	177.9	2.3	113.7
9	S	37.1	Very low	38.3	Very low	72 Å²	72	134.8 Å²	134.8	50%	0.503	70%	0.703	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.6	-36.7	176.7	45.1	0	0	0	0	114.3	S7 I11 L12 A13	S7-S9 PolarHBondContact O-N 3.3Å; S7-S9 PolarHBondContact OG-OG 3.29Å; S9-I11 VanDerWaalsContact C-N 3.3Å; S9-I11 PolarHBondContact O-N 3.32Å; S9-L12 PolarHBondContact O-N 3.14Å; S9-A13 PolarHBondContact O-N 2.95Å
10	E	36.9	Very low	38.7	Very low	120 Å²	120	133.6 Å²	133.6	56%	0.561	70%	0.704	S	S	*	*	H	α-helix	trans	-72.5	-26.5	-176.5	-68.2	175	103	0	0	112.3	S7 L12 T14	S7-E10 PolarHBondContact O-N 3.4Å; E10-L12 VanDerWaalsContact C-N 3.34Å; E10-T14 PolarHBondContact O-OG1 2.68Å
11	I	39.9	Very low	38.8	Very low	94 Å²	94	132.9 Å²	132.9	48%	0.482	70%	0.7	S	S	.	*	H	α-helix	trans	-70.5	-29.6	174.9	-63.5	169.4	0	0	0	111.5	S9 T14 F15	S9-I11 VanDerWaalsContact C-N 3.3Å; S9-I11 PolarHBondContact O-N 3.32Å; I11-T14 PolarHBondContact O-OG1 3.47Å; I11-F15 WeakPolarHBondContact O-CD2 3.31Å
12	L	39.3	Very low	39	Very low	123 Å²	123	126 Å²	126	64%	0.644	67%	0.667	S	S	*	*	H	α-helix	trans	-80.1	-39.1	179.2	-75	168.2	0	0	0	112.1	S9 E10 T14 F15	S9-L12 PolarHBondContact O-N 3.14Å; E10-L12 VanDerWaalsContact C-N 3.34Å; L12-T14 PolarHBondContact O-N 3.06Å; L12-F15 WeakPolarHBondContact O-CB 3.32Å; L12-F15 PolarHBondContact O-N 3.41Å; L12-F15 VanDerWaalsContact O-N 3.1Å
13	A	37.7	Very low	39.2	Very low	78 Å²	78	123.5 Å²	123.5	65%	0.645	66%	0.661	S	S	*	*	H	α-helix	trans	-62.9	-26.1	177	0	0	0	0	0	113.4	S9	S9-A13 PolarHBondContact O-N 2.95Å
14	T	39.7	Very low	39.8	Very low	100 Å²	100	118.8 Å²	118.8	61%	0.613	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.5	-2.7	177.4	44.1	0	0	0	0	114	E10 I11 L12	E10-T14 PolarHBondContact O-OG1 2.68Å; I11-T14 PolarHBondContact O-OG1 3.47Å; L12-T14 PolarHBondContact O-N 3.06Å
15	F	38	Very low	39.7	Very low	128 Å²	128	114.5 Å²	114.5	56%	0.561	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.2	-21.9	-175.2	-127	-96.2	0	0	0	114.1	I11 L12 L22	I11-F15 WeakPolarHBondContact O-CD2 3.31Å; L12-F15 WeakPolarHBondContact O-CB 3.32Å; L12-F15 PolarHBondContact O-N 3.41Å; L12-F15 VanDerWaalsContact O-N 3.1Å; F15-L22 HydrophobicContact CE1-CD2 3.9Å; F15-L22 HydrophobicContact CE2-CD2 4.14Å; F15-L22 HydrophobicContact CZ-CD2 3.57Å
16	E	44	Very low	39.5	Very low	184 Å²	184	116.8 Å²	116.8	86%	0.86	62%	0.624	S	S	*	*	S	Bend	trans	-88.7	-36.7	-170.1	-153.2	168	150.1	0	0	113.5
17	E	45.7	Very low	39.3	Very low	192 Å²	192	117.7 Å²	117.7	90%	0.897	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	-16.5	-180	-67.4	-166.1	125.7	0	0	114.5
18	C	41	Very low	39.5	Very low	57 Å²	57	118 Å²	118	39%	0.385	63%	0.634	S	S	.	*	T	Hydrogen-bonded Turn	trans	-105.8	19	-167.5	-127.7	0	0	0	0	115.1	P20 L21	C18-P20 VanDerWaalsContact C-CD 3.46Å; C18-L21 PolarHBondContact O-N 2.84Å; C18-L21 VanDerWaalsContact O-N 3.12Å
19	G	44.1	Very low	39.5	Very low	51 Å²	51	113 Å²	113	53%	0.526	63%	0.628	S	S	.	*	H	α-helix	trans	-44.4	-44.7	-173.2	0	0	0	0	0	118.1
20	P	46.1	Very low	39.4	Very low	109 Å²	109	114.9 Å²	114.9	71%	0.708	64%	0.636	S	S	*	*	H	α-helix	trans	-78.7	-24.6	-178	29.6	-34.4	0	0	0	114.1	C18	C18-P20 VanDerWaalsContact C-CD 3.46Å
21	L	41.9	Very low	39.3	Very low	119 Å²	119	115.9 Å²	115.9	62%	0.623	65%	0.645	S	S	*	*	H	α-helix	trans	-80.6	-39.2	-173.4	-85.5	163.4	0	0	0	112.7	C18 K23 V24	C18-L21 PolarHBondContact O-N 2.84Å; C18-L21 VanDerWaalsContact O-N 3.12Å; L21-K23 PolarHBondContact O-N 2.89Å; L21-V24 PolarHBondContact O-N 3.42Å
22	L	41.1	Very low	39.1	Very low	81 Å²	81	117.8 Å²	117.8	42%	0.424	66%	0.662	S	S	.	*	H	α-helix	trans	-64.2	-26.6	-175.8	-143	76	0	0	0	112.9	F15 V24 C25 F26	F15-L22 HydrophobicContact CE1-CD2 3.9Å; F15-L22 HydrophobicContact CE2-CD2 4.14Å; F15-L22 HydrophobicContact CZ-CD2 3.57Å; L22-V24 PolarHBondContact O-N 2.81Å; L22-C25 PolarHBondContact O-N 2.83Å; L22-F26 PolarHBondContact O-N 2.97Å
23	K	36.7	Very low	38.9	Very low	168 Å²	168	117.1 Å²	117.1	73%	0.73	67%	0.674	S	S	*	*	H	α-helix	trans	-66	-23.7	-179	-151.2	171	-170.4	175.2	0	113.4	L21	L21-K23 PolarHBondContact O-N 2.89Å
24	V	40.2	Very low	38.5	Very low	113 Å²	113	117.4 Å²	117.4	69%	0.685	69%	0.685	S	S	*	*	H	α-helix	trans	-81.4	-43.9	174.3	-177	0	0	0	0	110.9	L21 L22	L21-V24 PolarHBondContact O-N 3.42Å; L22-V24 PolarHBondContact O-N 2.81Å
25	C	36.9	Very low	38.1	Very low	86 Å²	86	116.5 Å²	116.5	58%	0.581	70%	0.695	S	S	*	*	H	α-helix	trans	-65.3	-40.3	178.2	-78.6	0	0	0	0	113	L22 M27 A28	L22-C25 PolarHBondContact O-N 2.83Å; C25-M27 VanDerWaalsContact C-N 3.29Å; C25-M27 PolarHBondContact O-N 3.05Å; C25-A28 PolarHBondContact O-N 3.14Å; C25-A28 VanDerWaalsContact O-N 3.09Å
26	F	35.1	Very low	37.6	Very low	148 Å²	148	120 Å²	120	65%	0.649	71%	0.713	S	S	*	*	H	α-helix	trans	-68.7	-25.6	-172.2	-143	-87.5	0	0	0	113.8	L22 A28	L22-F26 PolarHBondContact O-N 2.97Å; F26-A28 VanDerWaalsContact C-N 3.31Å
27	M	34	Very low	37.3	Very low	159 Å²	159	115.8 Å²	115.8	78%	0.783	71%	0.71	S	S	*	*	H	α-helix	trans	-75.8	-15.3	174	-68.9	-162.9	69.6	0	0	114	C25	C25-M27 VanDerWaalsContact C-N 3.29Å; C25-M27 PolarHBondContact O-N 3.05Å
28	A	38.3	Very low	36.6	Very low	75 Å²	75	114.3 Å²	114.3	62%	0.62	71%	0.708	S	S	*	*	H	α-helix	trans	-87.6	-25.4	-178.6	0	0	0	0	0	113.4	C25 F26	C25-A28 PolarHBondContact O-N 3.14Å; C25-A28 VanDerWaalsContact O-N 3.09Å; F26-A28 VanDerWaalsContact C-N 3.31Å
29	V	36.3	Very low	36	Very low	116 Å²	116	117.9 Å²	117.9	70%	0.703	73%	0.728	S	S	*	*	H	α-helix	trans	-85.2	-19.9	-169.6	179.5	0	0	0	0	113	N31	V29-N31 VanDerWaalsContact C-N 3.28Å; V29-N31 PolarHBondContact O-N 3.03Å
30	T	33.6	Very low	35.6	Very low	111 Å²	111	124.3 Å²	124.3	68%	0.681	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.2	10.3	-173.5	57.8	0	0	0	0	115.1
31	N	36.3	Very low	34.6	Very low	141 Å²	141	128.6 Å²	128.6	75%	0.754	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-142	40.5	-171.6	-161.4	25.6	0	0	0	116.4	V29	V29-N31 VanDerWaalsContact C-N 3.28Å; V29-N31 PolarHBondContact O-N 3.03Å
32	T	36	Very low	34.2	Very low	135 Å²	135	130.7 Å²	130.7	83%	0.828	77%	0.769	S	S	*	*			trans	-147	100.5	154.4	43.6	0	0	0	0	110.3
33	A	35.1	Very low	33.9	Very low	109 Å²	109	130.1 Å²	130.1	90%	0.901	78%	0.783	S	S	*	*			trans	-120.1	124.3	169.2	0	0	0	0	0	109.8
34	G	29.4	Very low	34.1	Very low	84 Å²	84	131.9 Å²	131.9	87%	0.866	79%	0.794	S	S	*	*			trans	105.4	147.1	179.9	0	0	0	0	0	114.1
35	G	29.6	Very low	33.6	Very low	81 Å²	81	130.4 Å²	130.4	84%	0.835	80%	0.801	S	S	*	*			trans	126.9	108.3	177.9	0	0	0	0	0	113.4
36	E	28.4	Very low	33.6	Very low	201 Å²	201	133.2 Å²	133.2	94%	0.939	82%	0.816	S	S	*	*			trans	-64	177	-172.7	-64.1	165.2	101.5	0	0	116.2
37	A	38.3	Very low	34	Very low	96 Å²	96	130.3 Å²	130.3	79%	0.793	83%	0.827	S	S	*	*			trans	-103.5	136.8	-177.1	0	0	0	0	0	113.2
38	L	30.7	Very low	34.1	Very low	161 Å²	161	128.3 Å²	128.3	84%	0.843	83%	0.829	S	S	*	*			trans	-140.5	129.9	168.9	-79.6	179.5	0	0	0	113.1
39	T	28.7	Very low	34.6	Very low	132 Å²	132	134.5 Å²	134.5	81%	0.81	84%	0.842	S	S	*	*			trans	27.1	144.1	145.2	53.1	0	0	0	0	123.1
40	M	34.2	Very low	34.9	Very low	186 Å²	186	137.3 Å²	137.3	92%	0.916	85%	0.852	S	S	*	*			trans	-79.7	148.1	172.2	-49.6	161.5	73.2	0	0	112.3
41	E	26.7	Very low	35.3	Very low	198 Å²	198	135 Å²	135	93%	0.925	85%	0.85	S	S	*	*				-159.6	171.9	130	-159.9	150.8	103	0	0	111
42	N	32.3	Very low	35.9	Very low	163 Å²	163	135.8 Å²	135.8	87%	0.872	85%	0.854	S	S	*	*			trans	-83.5	156.3	-179.2	-83.3	-52.2	0	0	0	113.9
43	G	35.7	Very low	36.8	Very low	70 Å²	70	134.5 Å²	134.5	72%	0.722	85%	0.848	S	S	*	*			trans	112.5	117.2	137.9	0	0	0	0	0	117.9
44	Q	39.5	Very low	38	Very low	205 Å²	205	135.1 Å²	135.1	96%	0.958	84%	0.842	S	S	*	*			trans	50.4	88.8	153.4	-61.1	-175.5	-6.9	0	0	118
45	G	29.9	Very low	39.3	Very low	81 Å²	81	135.8 Å²	135.8	84%	0.835	83%	0.826	S	S	*	*			trans	-111.3	122.5	160.3	0	0	0	0	0	111.6
46	T	37.3	Very low	41.5	Very low	146 Å²	146	135 Å²	135	90%	0.896	81%	0.805	S	S	*	*			trans	-71.8	146.9	168.3	43.4	0	0	0	0	110.5	S48	T46-S48 PolarHBondContact O-N 2.96Å
47	G	43.8	Very low	43.7	Very low	86 Å²	86	130.7 Å²	130.7	89%	0.887	79%	0.794	S	S	*	*			trans	-67.8	129.2	-162.6	0	0	0	0	0	115.5
48	S	36.8	Very low	45.3	Very low	118 Å²	118	133.6 Å²	133.6	83%	0.825	79%	0.791	S	S	*	*			trans	-108.4	137.8	162.6	57.5	0	0	0	0	110.3	T46 L50	T46-S48 PolarHBondContact O-N 2.96Å; S48-L50 PolarHBondContact O-N 3.33Å
49	K	47.8	Very low	46.9	Very low	204 Å²	204	130.9 Å²	130.9	89%	0.887	77%	0.774	S	S	*	*			trans	-97.7	88.2	-156.4	-176.9	-175.1	175.9	-176.9	0	112.6	G51	K49-G51 PolarHBondContact O-N 2.64Å; K49-G51 VanDerWaalsContact O-N 3.14Å
50	L	42.5	Very low	49.1	Very low	175 Å²	175	128.8 Å²	128.8	92%	0.916	76%	0.755	S	S	*	*			trans	-74.2	97.3	162.3	-91.8	164.2	0	0	0	109.4	S48 L52	S48-L50 PolarHBondContact O-N 3.33Å; L50-L52 PolarHBondContact O-N 2.67Å
51	G	42.3	Very low	51.3	Low	63 Å²	63	125.7 Å²	125.7	65%	0.649	74%	0.739	S	S	*	*			trans	-79.1	84.1	-167.1	0	0	0	0	0	114.9	K49	K49-G51 PolarHBondContact O-N 2.64Å; K49-G51 VanDerWaalsContact O-N 3.14Å
52	L	48.4	Very low	53.4	Low	157 Å²	157	119 Å²	119	82%	0.822	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-64	141.5	147.1	-70	171.2	0	0	0	108.7	L50	L50-L52 PolarHBondContact O-N 2.67Å
53	P	56.6	Low	55.4	Low	109 Å²	109	114.8 Å²	114.8	71%	0.708	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-61.6	140.2	172.5	27.1	-33.6	0	0	0	109.4	L55	P53-L55 PolarHBondContact O-N 2.91Å
54	P	60.3	Low	57.2	Low	121 Å²	121	117.5 Å²	117.5	79%	0.786	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-61.4	131.1	175.6	26.7	-33.4	0	0	0	109.2	T56	P54-T56 PolarHBondContact O-N 2.86Å
55	L	56.6	Low	59.1	Low	98 Å²	98	116.4 Å²	116.4	51%	0.513	68%	0.675	S	S	.	*	P	Polyproline II helix	trans	-49.3	128.1	173.5	-75.5	152.3	0	0	0	109.2	P53 Q59	P53-L55 PolarHBondContact O-N 2.91Å; L55-Q59 HydrophobicContact CB-CB 4.42Å; L55-Q59 HydrophobicContact CD2-CB 3.91Å
56	T	75.8	Confident	61.2	Low	64 Å²	64	115.3 Å²	115.3	39%	0.393	66%	0.658	S	S	.	*	P	Polyproline II helix	trans	-60.8	152.1	175.1	63.9	0	0	0	0	109.3	P54 E58 Q59 Q60	P54-T56 PolarHBondContact O-N 2.86Å; T56-E58 PolarHBondContact O-N 3.39Å; T56-E58 VanDerWaalsContact O-N 3.12Å; T56-Q59 VanDerWaalsContact N-OE1 3.15Å; T56-Q59 WeakPolarHBondContact O-CA 3.44Å; T56-Q59 WeakPolarHBondContact O-CB 3.35Å; T56-Q59 PolarHBondContact O-N 3.4Å; T56-Q59 VanDerWaalsContact OG1-CG 3.26Å; T56-Q59 WeakPolarHBondContact OG1-CG 3.46Å; T56-Q59 PolarHBondContact OG1-N 3.01Å; T56-Q59 PolarHBondContact OG1-OE1 2.87Å; T56-Q60 PolarHBondContact O-N 2.86Å
57	P	74.6	Confident	63.1	Low	111 Å²	111	114.9 Å²	114.9	72%	0.721	64%	0.644	S	S	*	*	H	α-helix	trans	-55.6	-34.3	-179.5	20.4	-32.7	0	0	0	112.3	Q60 E61	P57-Q60 WeakPolarHBondContact O-CB 3.27Å; P57-Q60 PolarHBondContact O-N 2.83Å; P57-E61 WeakPolarHBondContact O-CB 3.42Å; P57-E61 PolarHBondContact O-N 3.02Å
58	E	70.6	Confident	64.8	Low	158 Å²	158	116.9 Å²	116.9	74%	0.738	63%	0.628	S	S	*	*	H	α-helix	trans	-65.9	-41.5	173.7	-171.5	175.1	-160.2	0	0	113.2	T56 E61 A62	T56-E58 PolarHBondContact O-N 3.39Å; T56-E58 VanDerWaalsContact O-N 3.12Å; E58-E61 PolarHBondContact O-N 3.41Å; E58-A62 VanDerWaalsContact O-CB 3.26Å; E58-A62 WeakPolarHBondContact O-CB 3.35Å; E58-A62 PolarHBondContact O-N 3.49Å
59	Q	64.9	Low	66.6	Low	104 Å²	104	118.1 Å²	118.1	49%	0.486	62%	0.616	S	S	.	*	H	α-helix	trans	-67	-36.9	172.1	-74.4	170.6	-18.7	0	0	112.1	L55 T56 L63	L55-Q59 HydrophobicContact CB-CB 4.42Å; L55-Q59 HydrophobicContact CD2-CB 3.91Å; T56-Q59 VanDerWaalsContact N-OE1 3.15Å; T56-Q59 WeakPolarHBondContact O-CA 3.44Å; T56-Q59 WeakPolarHBondContact O-CB 3.35Å; T56-Q59 PolarHBondContact O-N 3.4Å; T56-Q59 VanDerWaalsContact OG1-CG 3.26Å; T56-Q59 WeakPolarHBondContact OG1-CG 3.46Å; T56-Q59 PolarHBondContact OG1-N 3.01Å; T56-Q59 PolarHBondContact OG1-OE1 2.87Å; Q59-L63 VanDerWaalsContact O-CB 3.29Å; Q59-L63 WeakPolarHBondContact O-CB 3.35Å; Q59-L63 PolarHBondContact O-N 3.22Å
60	Q	74.9	Confident	67.9	Low	88 Å²	88	111.2 Å²	111.2	41%	0.411	60%	0.597	S	S	.	*	H	α-helix	trans	-65.9	-43.5	176.3	-170.3	81.9	-47.8	0	0	110.8	T56 P57 L63 Q64	T56-Q60 PolarHBondContact O-N 2.86Å; P57-Q60 WeakPolarHBondContact O-CB 3.27Å; P57-Q60 PolarHBondContact O-N 2.83Å; Q60-L63 PolarHBondContact O-N 3.01Å; Q60-Q64 WeakPolarHBondContact O-CG 3.13Å; Q60-Q64 PolarHBondContact O-N 3.32Å
61	E	79.8	Confident	69.4	Low	121 Å²	121	108.6 Å²	108.6	57%	0.565	58%	0.582	S	S	*	*	H	α-helix	trans	-66	-45	174.4	-169.4	-174.8	148.2	0	0	111.4	P57 E58 L63 Q64 R65	P57-E61 WeakPolarHBondContact O-CB 3.42Å; P57-E61 PolarHBondContact O-N 3.02Å; E58-E61 PolarHBondContact O-N 3.41Å; E61-L63 VanDerWaalsContact C-N 3.3Å; E61-L63 PolarHBondContact O-N 2.92Å; E61-Q64 PolarHBondContact O-N 2.68Å; E61-Q64 VanDerWaalsContact O-N 3.16Å; E61-R65 VanDerWaalsContact O-CB 3.29Å; E61-R65 WeakPolarHBondContact O-CB 3.34Å; E61-R65 PolarHBondContact O-N 3.45Å
62	A	71.7	Confident	70.9	Confident	57 Å²	57	110.3 Å²	110.3	47%	0.471	57%	0.573	S	S	.	*	H	α-helix	trans	-58.4	-41.5	174.9	0	0	0	0	0	111.9	E58 R65 A66	E58-A62 VanDerWaalsContact O-CB 3.26Å; E58-A62 WeakPolarHBondContact O-CB 3.35Å; E58-A62 PolarHBondContact O-N 3.49Å; A62-R65 PolarHBondContact O-N 3.06Å; A62-A66 VanDerWaalsContact O-CB 3.26Å; A62-A66 WeakPolarHBondContact O-CB 3.42Å; A62-A66 PolarHBondContact O-N 2.75Å
63	L	73.9	Confident	71.7	Confident	75 Å²	75	106.9 Å²	106.9	39%	0.393	55%	0.553	S	S	.	*	H	α-helix	trans	-66.2	-40.5	175.3	-168.3	78	0	0	0	112.1	Q59 Q60 E61 K67	Q59-L63 VanDerWaalsContact O-CB 3.29Å; Q59-L63 WeakPolarHBondContact O-CB 3.35Å; Q59-L63 PolarHBondContact O-N 3.22Å; Q60-L63 PolarHBondContact O-N 3.01Å; E61-L63 VanDerWaalsContact C-N 3.3Å; E61-L63 PolarHBondContact O-N 2.92Å; L63-K67 HydrophobicContact CG-CD 4.42Å; L63-K67 WeakPolarHBondContact O-CB 3.41Å; L63-K67 VanDerWaalsContact O-CG 3.28Å; L63-K67 WeakPolarHBondContact O-CG 3.43Å; L63-K67 PolarHBondContact O-N 2.69Å
64	Q	73.6	Confident	72.2	Confident	126 Å²	126	104.8 Å²	104.8	59%	0.589	54%	0.54	S	S	*	.	H	α-helix	trans	-66.3	-41.4	175	-74.5	-179.4	11.9	0	0	111.8	Q60 E61 K67 K68	Q60-Q64 WeakPolarHBondContact O-CG 3.13Å; Q60-Q64 PolarHBondContact O-N 3.32Å; E61-Q64 PolarHBondContact O-N 2.68Å; E61-Q64 VanDerWaalsContact O-N 3.16Å; Q64-K67 PolarHBondContact O-N 2.63Å; Q64-K68 WeakPolarHBondContact O-CB 3.35Å; Q64-K68 PolarHBondContact O-N 3.48Å
65	R	78.7	Confident	73	Confident	183 Å²	183	103.4 Å²	103.4	69%	0.691	53%	0.525	S	S	*	.	H	α-helix	trans	-65.4	-42.3	176.3	-171.3	172.8	-177	152.1	-2.1	111.8	E61 A62 K68 Y69	E61-R65 VanDerWaalsContact O-CB 3.29Å; E61-R65 WeakPolarHBondContact O-CB 3.34Å; E61-R65 PolarHBondContact O-N 3.45Å; A62-R65 PolarHBondContact O-N 3.06Å; R65-K68 PolarHBondContact O-N 3.36Å; R65-Y69 WeakPolarHBondContact O-CB 3.42Å; R65-Y69 PolarHBondContact O-N 2.93Å
66	A	74.3	Confident	73.6	Confident	58 Å²	58	105.2 Å²	105.2	48%	0.479	53%	0.529	S	S	.	.	H	α-helix	trans	-64.3	-44.3	173.8	0	0	0	0	0	112	A62 Y69 A70	A62-A66 VanDerWaalsContact O-CB 3.26Å; A62-A66 WeakPolarHBondContact O-CB 3.42Å; A62-A66 PolarHBondContact O-N 2.75Å; A66-Y69 PolarHBondContact O-N 2.74Å; A66-A70 WeakPolarHBondContact O-CB 3.49Å; A66-A70 PolarHBondContact O-N 2.78Å
67	K	77.1	Confident	72.9	Confident	136 Å²	136	105 Å²	105	59%	0.591	53%	0.53	S	S	*	.	H	α-helix	trans	-62	-44	174.3	-77.9	174.5	176.6	179.3	0	112.2	L63 Q64 A70 M71	L63-K67 HydrophobicContact CG-CD 4.42Å; L63-K67 WeakPolarHBondContact O-CB 3.41Å; L63-K67 VanDerWaalsContact O-CG 3.28Å; L63-K67 WeakPolarHBondContact O-CG 3.43Å; L63-K67 PolarHBondContact O-N 2.69Å; Q64-K67 PolarHBondContact O-N 2.63Å; K67-A70 PolarHBondContact O-N 3.02Å; K67-M71 VanDerWaalsContact O-CB 3.3Å; K67-M71 WeakPolarHBondContact O-CB 3.47Å; K67-M71 PolarHBondContact O-N 2.82Å
68	K	79.6	Confident	72.9	Confident	128 Å²	128	103.9 Å²	103.9	56%	0.557	52%	0.521	S	S	*	.	H	α-helix	trans	-61.2	-47.9	175.4	-179	175.9	170.8	177.8	0	111.1	Q64 R65 A70 M71 E72	Q64-K68 WeakPolarHBondContact O-CB 3.35Å; Q64-K68 PolarHBondContact O-N 3.48Å; R65-K68 PolarHBondContact O-N 3.36Å; K68-A70 PolarHBondContact O-N 3.02Å; K68-M71 PolarHBondContact O-N 2.78Å; K68-E72 WeakPolarHBondContact CE-OE1 3.46Å; K68-E72 HydrophobicContact CG-CG 4.38Å; K68-E72 IonicContact NZ-OE1 2.67Å; K68-E72 WeakPolarHBondContact O-CB 3.25Å; K68-E72 WeakPolarHBondContact O-CG 3.5Å; K68-E72 PolarHBondContact O-N 3.06Å
69	Y	75.6	Confident	72.9	Confident	144 Å²	144	101.2 Å²	101.2	57%	0.565	51%	0.511	S	S	*	.	H	α-helix	trans	-62.7	-43	178.2	-177.7	-107.3	0	0	0	112.5	R65 A66 M71 E72 Q73	R65-Y69 WeakPolarHBondContact O-CB 3.42Å; R65-Y69 PolarHBondContact O-N 2.93Å; A66-Y69 PolarHBondContact O-N 2.74Å; Y69-M71 VanDerWaalsContact C-N 3.32Å; Y69-M71 PolarHBondContact O-N 3.33Å; Y69-E72 PolarHBondContact O-N 2.87Å; Y69-Q73 HydrophobicContact CD1-CG 4.32Å; Y69-Q73 HydrophobicContact CD2-CG 4.36Å; Y69-Q73 HydrophobicContact CE1-CG 3.96Å; Y69-Q73 HydrophobicContact CE2-CG 4Å; Y69-Q73 WeakPolarHBondContact O-CB 2.94Å; Y69-Q73 VanDerWaalsContact O-CG 3.3Å; Y69-Q73 WeakPolarHBondContact O-CG 3.38Å; Y69-Q73 PolarHBondContact O-N 2.73Å; Y69-Q73 PolarHBondContact OH-NE2 2.82Å
70	A	73.6	Confident	73.2	Confident	60 Å²	60	99.9 Å²	99.9	50%	0.496	51%	0.51	S	S	.	.	H	α-helix	trans	-63.6	-36.6	175.5	0	0	0	0	0	112.5	A66 K67 K68 S74	A66-A70 WeakPolarHBondContact O-CB 3.49Å; A66-A70 PolarHBondContact O-N 2.78Å; K67-A70 PolarHBondContact O-N 3.02Å; K68-A70 PolarHBondContact O-N 3.02Å; A70-S74 WeakPolarHBondContact O-CB 3.44Å; A70-S74 PolarHBondContact O-N 2.92Å; A70-S74 PolarHBondContact O-OG 2.83Å
71	M	74	Confident	72.9	Confident	120 Å²	120	102.7 Å²	102.7	59%	0.591	52%	0.521	S	S	*	.	H	α-helix	trans	-71.2	-41.9	174.7	178	174.9	160.2	0	0	112.3	K67 K68 Y69 S74 I75	K67-M71 VanDerWaalsContact O-CB 3.3Å; K67-M71 WeakPolarHBondContact O-CB 3.47Å; K67-M71 PolarHBondContact O-N 2.82Å; K68-M71 PolarHBondContact O-N 2.78Å; Y69-M71 VanDerWaalsContact C-N 3.32Å; Y69-M71 PolarHBondContact O-N 3.33Å; M71-S74 PolarHBondContact O-N 3.44Å; M71-S74 PolarHBondContact O-OG 3.39Å; M71-S74 VanDerWaalsContact O-OG 3.08Å; M71-I75 HydrophobicContact CE-CD1 3.96Å; M71-I75 HydrophobicContact CG-CD1 3.84Å; M71-I75 WeakPolarHBondContact O-CB 3.36Å; M71-I75 WeakPolarHBondContact O-CD1 3.45Å; M71-I75 WeakPolarHBondContact O-CG1 3.46Å; M71-I75 PolarHBondContact O-N 2.7Å
72	E	74.3	Confident	72.3	Confident	99 Å²	99	103 Å²	103	46%	0.463	52%	0.523	S	S	.	.	H	α-helix	trans	-65.1	-39.7	174.8	-74.4	174.3	160.3	0	0	111.2	K68 Y69 K76	K68-E72 WeakPolarHBondContact CE-OE1 3.46Å; K68-E72 HydrophobicContact CG-CG 4.38Å; K68-E72 IonicContact NZ-OE1 2.67Å; K68-E72 WeakPolarHBondContact O-CB 3.25Å; K68-E72 WeakPolarHBondContact O-CG 3.5Å; K68-E72 PolarHBondContact O-N 3.06Å; Y69-E72 PolarHBondContact O-N 2.87Å; E72-K76 WeakPolarHBondContact O-CB 3.3Å; E72-K76 PolarHBondContact O-N 3.21Å
73	Q	64.6	Low	72	Confident	85 Å²	85	104.1 Å²	104.1	40%	0.397	52%	0.523	S	S	.	.	H	α-helix	trans	-69.9	-37.8	174.6	-71.7	-68.9	6.1	0	0	112.8	Y69 K76 S77	Y69-Q73 HydrophobicContact CD1-CG 4.32Å; Y69-Q73 HydrophobicContact CD2-CG 4.36Å; Y69-Q73 HydrophobicContact CE1-CG 3.96Å; Y69-Q73 HydrophobicContact CE2-CG 4Å; Y69-Q73 WeakPolarHBondContact O-CB 2.94Å; Y69-Q73 VanDerWaalsContact O-CG 3.3Å; Y69-Q73 WeakPolarHBondContact O-CG 3.38Å; Y69-Q73 PolarHBondContact O-N 2.73Å; Y69-Q73 PolarHBondContact OH-NE2 2.82Å; Q73-K76 PolarHBondContact O-N 2.71Å; Q73-S77 WeakPolarHBondContact O-CB 3.21Å; Q73-S77 PolarHBondContact O-N 2.82Å
74	S	67.4	Low	71.8	Confident	64 Å²	64	104.8 Å²	104.8	45%	0.448	53%	0.527	S	S	.	.	H	α-helix	trans	-68.9	-42.3	175.8	71.7	0	0	0	0	111.6	A70 M71 S77 V78	A70-S74 WeakPolarHBondContact O-CB 3.44Å; A70-S74 PolarHBondContact O-N 2.92Å; A70-S74 PolarHBondContact O-OG 2.83Å; M71-S74 PolarHBondContact O-N 3.44Å; M71-S74 PolarHBondContact O-OG 3.39Å; M71-S74 VanDerWaalsContact O-OG 3.08Å; S74-S77 PolarHBondContact O-N 3.38Å; S74-V78 WeakPolarHBondContact O-CB 3.44Å; S74-V78 VanDerWaalsContact O-CG2 3.3Å; S74-V78 WeakPolarHBondContact O-CG2 3.31Å; S74-V78 PolarHBondContact O-N 3.44Å
75	I	78.1	Confident	71.2	Confident	92 Å²	92	101 Å²	101	47%	0.472	52%	0.517	S	S	.	.	H	α-helix	trans	-60.3	-46.3	172.3	-69.3	165.6	0	0	0	110.5	M71 S77 V78 L79	M71-I75 HydrophobicContact CE-CD1 3.96Å; M71-I75 HydrophobicContact CG-CD1 3.84Å; M71-I75 WeakPolarHBondContact O-CB 3.36Å; M71-I75 WeakPolarHBondContact O-CD1 3.45Å; M71-I75 WeakPolarHBondContact O-CG1 3.46Å; M71-I75 PolarHBondContact O-N 2.7Å; I75-S77 PolarHBondContact O-N 2.96Å; I75-V78 PolarHBondContact O-N 2.69Å; I75-L79 WeakPolarHBondContact O-CB 3.42Å; I75-L79 PolarHBondContact O-N 3.35Å
76	K	68.3	Low	70.4	Confident	136 Å²	136	97.3 Å²	97.3	59%	0.591	51%	0.507	S	S	*	.	H	α-helix	trans	-66.1	-38	179.4	-165.1	172.2	-172.8	177	0	112.3	E72 Q73 V80	E72-K76 WeakPolarHBondContact O-CB 3.3Å; E72-K76 PolarHBondContact O-N 3.21Å; Q73-K76 PolarHBondContact O-N 2.71Å; K76-V80 VanDerWaalsContact O-CB 3.3Å; K76-V80 WeakPolarHBondContact O-CB 3.47Å; K76-V80 WeakPolarHBondContact O-CG2 3.18Å; K76-V80 PolarHBondContact O-N 3.04Å
77	S	60.2	Low	69.9	Low	60 Å²	60	100 Å²	100	42%	0.42	51%	0.51	S	S	.	.	H	α-helix	trans	-65.5	-46	174.3	-180	0	0	0	0	112.3	Q73 S74 I75 K81	Q73-S77 WeakPolarHBondContact O-CB 3.21Å; Q73-S77 PolarHBondContact O-N 2.82Å; S74-S77 PolarHBondContact O-N 3.38Å; I75-S77 PolarHBondContact O-N 2.96Å; S77-K81 WeakPolarHBondContact O-CB 3.47Å; S77-K81 WeakPolarHBondContact O-CG 3.39Å; S77-K81 PolarHBondContact O-N 3Å
78	V	74.7	Confident	69.2	Low	87 Å²	87	99.8 Å²	99.8	53%	0.527	51%	0.511	S	S	.	.	H	α-helix	trans	-64.7	-46.2	175.7	170.3	0	0	0	0	110.7	S74 I75 K81 Q82	S74-V78 WeakPolarHBondContact O-CB 3.44Å; S74-V78 VanDerWaalsContact O-CG2 3.3Å; S74-V78 WeakPolarHBondContact O-CG2 3.31Å; S74-V78 PolarHBondContact O-N 3.44Å; I75-V78 PolarHBondContact O-N 2.69Å; V78-K81 PolarHBondContact O-N 3Å; V78-Q82 VanDerWaalsContact O-CB 3.26Å; V78-Q82 WeakPolarHBondContact O-CB 3.31Å; V78-Q82 PolarHBondContact O-N 3.5Å
79	L	71.3	Confident	68.2	Low	103 Å²	103	99.5 Å²	99.5	54%	0.539	51%	0.512	S	S	.	.	H	α-helix	trans	-62.1	-45.6	178.5	-170.7	69.5	0	0	0	111.2	I75 K81 Q82 T83	I75-L79 WeakPolarHBondContact O-CB 3.42Å; I75-L79 PolarHBondContact O-N 3.35Å; L79-K81 PolarHBondContact O-N 3.25Å; L79-Q82 PolarHBondContact O-N 3.3Å; L79-T83 WeakPolarHBondContact O-CB 3.45Å; L79-T83 PolarHBondContact O-N 2.86Å; L79-T83 PolarHBondContact O-OG1 2.92Å; L79-T83 VanDerWaalsContact O-OG1 3.05Å
80	V	72.1	Confident	67.4	Low	76 Å²	76	97.4 Å²	97.4	46%	0.461	51%	0.507	S	S	.	.	H	α-helix	trans	-62	-43.3	175.1	166.9	0	0	0	0	111.4	K76 Q82 T83 I84	K76-V80 VanDerWaalsContact O-CB 3.3Å; K76-V80 WeakPolarHBondContact O-CB 3.47Å; K76-V80 WeakPolarHBondContact O-CG2 3.18Å; K76-V80 PolarHBondContact O-N 3.04Å; V80-Q82 VanDerWaalsContact C-N 3.32Å; V80-Q82 PolarHBondContact O-N 3.34Å; V80-T83 PolarHBondContact O-N 3.11Å; V80-I84 HydrophobicContact CG1-CD1 3.67Å; V80-I84 HydrophobicContact CG1-CG1 4.4Å; V80-I84 WeakPolarHBondContact O-CB 3.14Å; V80-I84 VanDerWaalsContact O-CG1 3.22Å; V80-I84 WeakPolarHBondContact O-CG1 3.33Å; V80-I84 PolarHBondContact O-N 3.32Å
81	K	66.9	Low	66.5	Low	146 Å²	146	99.9 Å²	99.9	64%	0.635	51%	0.511	S	S	*	.	H	α-helix	trans	-61.8	-38.9	173.8	-78.1	179.7	176.7	-176.6	0	112.4	S77 V78 L79 A85	S77-K81 WeakPolarHBondContact O-CB 3.47Å; S77-K81 WeakPolarHBondContact O-CG 3.39Å; S77-K81 PolarHBondContact O-N 3Å; V78-K81 PolarHBondContact O-N 3Å; L79-K81 PolarHBondContact O-N 3.25Å; K81-A85 VanDerWaalsContact O-CB 3.27Å; K81-A85 WeakPolarHBondContact O-CB 3.44Å; K81-A85 PolarHBondContact O-N 3.07Å
82	Q	68	Low	65.6	Low	129 Å²	129	97.9 Å²	97.9	60%	0.603	51%	0.506	S	S	*	.	H	α-helix	trans	-73.3	-38.2	-179.8	-165.4	170.4	10	0	0	111.8	V78 L79 V80 A85 H86	V78-Q82 VanDerWaalsContact O-CB 3.26Å; V78-Q82 WeakPolarHBondContact O-CB 3.31Å; V78-Q82 PolarHBondContact O-N 3.5Å; L79-Q82 PolarHBondContact O-N 3.3Å; V80-Q82 VanDerWaalsContact C-N 3.32Å; V80-Q82 PolarHBondContact O-N 3.34Å; Q82-A85 PolarHBondContact O-N 2.91Å; Q82-H86 VanDerWaalsContact O-CB 3.28Å; Q82-H86 WeakPolarHBondContact O-CB 3.28Å; Q82-H86 PolarHBondContact O-N 2.88Å
83	T	66.4	Low	64.4	Low	79 Å²	79	97.9 Å²	97.9	49%	0.485	51%	0.509	S	S	.	.	H	α-helix	trans	-65	-43	170.4	-61.5	0	0	0	0	111.5	L79 V80 H86 Q87	L79-T83 WeakPolarHBondContact O-CB 3.45Å; L79-T83 PolarHBondContact O-N 2.86Å; L79-T83 PolarHBondContact O-OG1 2.92Å; L79-T83 VanDerWaalsContact O-OG1 3.05Å; V80-T83 PolarHBondContact O-N 3.11Å; T83-H86 PolarHBondContact O-N 2.94Å; T83-Q87 VanDerWaalsContact O-CB 3.24Å; T83-Q87 WeakPolarHBondContact O-CB 3.48Å; T83-Q87 PolarHBondContact O-N 3.47Å
84	I	69.2	Low	63.7	Low	90 Å²	90	99.7 Å²	99.7	46%	0.462	52%	0.521	S	S	.	.	H	α-helix	trans	-64.5	-45.1	175.3	-71.1	167.9	0	0	0	110.6	V80 H86 Q87 Q88	V80-I84 HydrophobicContact CG1-CD1 3.67Å; V80-I84 HydrophobicContact CG1-CG1 4.4Å; V80-I84 WeakPolarHBondContact O-CB 3.14Å; V80-I84 VanDerWaalsContact O-CG1 3.22Å; V80-I84 WeakPolarHBondContact O-CG1 3.33Å; V80-I84 PolarHBondContact O-N 3.32Å; I84-H86 VanDerWaalsContact C-N 3.34Å; I84-H86 PolarHBondContact O-N 3.47Å; I84-Q87 PolarHBondContact O-N 2.87Å; I84-Q88 VanDerWaalsContact O-CB 3.22Å; I84-Q88 WeakPolarHBondContact O-CB 3.37Å; I84-Q88 PolarHBondContact O-N 2.89Å
85	A	61.4	Low	62.8	Low	47 Å²	47	102 Å²	102	39%	0.388	53%	0.525	S	S	.	.	H	α-helix	trans	-62.1	-40.6	176.1	0	0	0	0	0	112	K81 Q82 Q88 Q89	K81-A85 VanDerWaalsContact O-CB 3.27Å; K81-A85 WeakPolarHBondContact O-CB 3.44Å; K81-A85 PolarHBondContact O-N 3.07Å; Q82-A85 PolarHBondContact O-N 2.91Å; A85-Q88 PolarHBondContact O-N 3.1Å; A85-Q89 WeakPolarHBondContact O-CB 3.32Å; A85-Q89 WeakPolarHBondContact O-CG 3.49Å; A85-Q89 PolarHBondContact O-N 2.96Å
86	H	60.9	Low	61.2	Low	104 Å²	104	103.4 Å²	103.4	48%	0.481	53%	0.531	S	S	.	.	H	α-helix	trans	-69.4	-41.1	176.8	-167.7	65.7	0	0	0	112.1	Q82 T83 I84 Q88 Q89 Q90	Q82-H86 VanDerWaalsContact O-CB 3.28Å; Q82-H86 WeakPolarHBondContact O-CB 3.28Å; Q82-H86 PolarHBondContact O-N 2.88Å; T83-H86 PolarHBondContact O-N 2.94Å; I84-H86 VanDerWaalsContact C-N 3.34Å; I84-H86 PolarHBondContact O-N 3.47Å; H86-Q88 VanDerWaalsContact C-N 3.33Å; H86-Q88 PolarHBondContact O-N 3.1Å; H86-Q89 PolarHBondContact O-N 3.47Å; H86-Q90 PolarHBondContact CD2-NE2 3.13Å; H86-Q90 PolarHBondContact NE2-NE2 3.27Å; H86-Q90 WeakPolarHBondContact O-CG 3.03Å; H86-Q90 PolarHBondContact O-N 3.39Å
87	Q	64.8	Low	59.8	Low	115 Å²	115	99.5 Å²	99.5	54%	0.537	52%	0.524	S	S	.	.	H	α-helix	trans	-63.1	-39.3	173.2	-177.2	176.6	93.1	0	0	111.4	T83 I84 Q90 L91	T83-Q87 VanDerWaalsContact O-CB 3.24Å; T83-Q87 WeakPolarHBondContact O-CB 3.48Å; T83-Q87 PolarHBondContact O-N 3.47Å; I84-Q87 PolarHBondContact O-N 2.87Å; Q87-Q90 PolarHBondContact O-N 3.19Å; Q87-L91 WeakPolarHBondContact O-CG 3.34Å; Q87-L91 PolarHBondContact O-N 2.82Å
88	Q	62.5	Low	58.9	Low	131 Å²	131	100.5 Å²	100.5	61%	0.612	54%	0.536	S	S	*	.	H	α-helix	trans	-67.2	-40.7	175.3	-169.6	167.7	66.8	0	0	111.5	I84 A85 H86 L91 T92	I84-Q88 VanDerWaalsContact O-CB 3.22Å; I84-Q88 WeakPolarHBondContact O-CB 3.37Å; I84-Q88 PolarHBondContact O-N 2.89Å; A85-Q88 PolarHBondContact O-N 3.1Å; H86-Q88 VanDerWaalsContact C-N 3.33Å; H86-Q88 PolarHBondContact O-N 3.1Å; Q88-L91 PolarHBondContact O-N 3.48Å; Q88-T92 PolarHBondContact O-N 2.95Å; Q88-T92 PolarHBondContact O-OG1 3.17Å; Q88-T92 VanDerWaalsContact O-OG1 3.06Å
89	Q	58.5	Low	57.5	Low	123 Å²	123	102.3 Å²	102.3	58%	0.575	55%	0.547	S	S	*	.	H	α-helix	trans	-64.4	-37.8	170.7	-77.8	-176.4	-36.7	0	0	113	A85 H86 T92 N93	A85-Q89 WeakPolarHBondContact O-CB 3.32Å; A85-Q89 WeakPolarHBondContact O-CG 3.49Å; A85-Q89 PolarHBondContact O-N 2.96Å; H86-Q89 PolarHBondContact O-N 3.47Å; Q89-T92 PolarHBondContact O-N 3.35Å; Q89-N93 WeakPolarHBondContact O-CB 3.36Å; Q89-N93 PolarHBondContact O-N 3.09Å
90	Q	57.3	Low	56	Low	99 Å²	99	102.9 Å²	102.9	46%	0.463	56%	0.555	S	S	.	*	H	α-helix	trans	-64	-41.9	173.9	-75.1	-179.4	4.9	0	0	111.3	H86 Q87 N93 L94	H86-Q90 PolarHBondContact CD2-NE2 3.13Å; H86-Q90 PolarHBondContact NE2-NE2 3.27Å; H86-Q90 WeakPolarHBondContact O-CG 3.03Å; H86-Q90 PolarHBondContact O-N 3.39Å; Q87-Q90 PolarHBondContact O-N 3.19Å; Q90-N93 PolarHBondContact O-N 3.25Å; Q90-L94 VanDerWaalsContact O-CD1 3.26Å; Q90-L94 WeakPolarHBondContact O-CD1 3.47Å; Q90-L94 PolarHBondContact O-N 3.31Å
91	L	56.4	Low	54.3	Low	112 Å²	112	106.8 Å²	106.8	59%	0.586	57%	0.57	S	S	*	*	H	α-helix	trans	-61.4	-44.9	173.6	-72.4	166.8	0	0	0	111.9	Q87 Q88 N93 L94 Q95	Q87-L91 WeakPolarHBondContact O-CG 3.34Å; Q87-L91 PolarHBondContact O-N 2.82Å; Q88-L91 PolarHBondContact O-N 3.48Å; L91-N93 VanDerWaalsContact C-N 3.34Å; L91-N93 PolarHBondContact O-N 3.37Å; L91-L94 PolarHBondContact O-N 2.85Å; L91-Q95 WeakPolarHBondContact O-CB 3.38Å; L91-Q95 PolarHBondContact O-N 3.26Å
92	T	55.2	Low	53.3	Low	78 Å²	78	103.9 Å²	103.9	48%	0.479	58%	0.581	S	S	.	*	H	α-helix	trans	-61.6	-40.1	174.6	-55	0	0	0	0	112.2	Q88 Q89 Q95 M96	Q88-T92 PolarHBondContact O-N 2.95Å; Q88-T92 PolarHBondContact O-OG1 3.17Å; Q88-T92 VanDerWaalsContact O-OG1 3.06Å; Q89-T92 PolarHBondContact O-N 3.35Å; T92-Q95 PolarHBondContact O-N 3.41Å; T92-M96 PolarHBondContact O-N 3.2Å
93	N	48.4	Very low	51.9	Low	100 Å²	100	108 Å²	108	54%	0.535	60%	0.597	S	S	.	*	H	α-helix	trans	-71.7	-37.6	177.9	-86.5	-26.9	0	0	0	113.2	Q89 Q90 L91 Q95 M96 A97	Q89-N93 WeakPolarHBondContact O-CB 3.36Å; Q89-N93 PolarHBondContact O-N 3.09Å; Q90-N93 PolarHBondContact O-N 3.25Å; L91-N93 VanDerWaalsContact C-N 3.34Å; L91-N93 PolarHBondContact O-N 3.37Å; N93-Q95 VanDerWaalsContact C-N 3.26Å; N93-Q95 PolarHBondContact O-N 3.47Å; N93-M96 PolarHBondContact O-N 3.01Å; N93-A97 WeakPolarHBondContact O-CB 3.11Å; N93-A97 PolarHBondContact O-N 2.86Å
94	L	50.3	Low	50.4	Low	123 Å²	123	107.5 Å²	107.5	64%	0.644	61%	0.608	S	S	*	*	H	α-helix	trans	-62.5	-37.8	169.9	-95.4	86	0	0	0	111.1	Q90 L91 M96 A97 A98	Q90-L94 VanDerWaalsContact O-CD1 3.26Å; Q90-L94 WeakPolarHBondContact O-CD1 3.47Å; Q90-L94 PolarHBondContact O-N 3.31Å; L91-L94 PolarHBondContact O-N 2.85Å; L94-M96 VanDerWaalsContact C-N 3.33Å; L94-M96 PolarHBondContact O-N 3.31Å; L94-A97 PolarHBondContact O-N 2.87Å; L94-A98 PolarHBondContact O-N 3.27Å
95	Q	48	Very low	48.9	Very low	112 Å²	112	109.7 Å²	109.7	52%	0.523	62%	0.621	S	S	.	*	H	α-helix	trans	-68.8	-29.3	178.7	-168.3	146.2	62.7	0	0	113	L91 T92 N93 S112	L91-Q95 WeakPolarHBondContact O-CB 3.38Å; L91-Q95 PolarHBondContact O-N 3.26Å; T92-Q95 PolarHBondContact O-N 3.41Å; N93-Q95 VanDerWaalsContact C-N 3.26Å; N93-Q95 PolarHBondContact O-N 3.47Å; Q95-S112 PolarHBondContact NE2-OG 2.76Å
96	M	44	Very low	47.8	Very low	121 Å²	121	113.3 Å²	113.3	60%	0.596	64%	0.64	S	S	*	*	H	α-helix	trans	-77.8	-37.5	166.1	-77.9	-161.6	-71.6	0	0	113.3	T92 N93 L94 A98 V99	T92-M96 PolarHBondContact O-N 3.2Å; N93-M96 PolarHBondContact O-N 3.01Å; L94-M96 VanDerWaalsContact C-N 3.33Å; L94-M96 PolarHBondContact O-N 3.31Å; M96-A98 VanDerWaalsContact C-N 3.28Å; M96-A98 PolarHBondContact O-N 2.94Å; M96-V99 WeakPolarHBondContact O-CB 3.23Å; M96-V99 PolarHBondContact O-N 3.16Å; M96-V99 VanDerWaalsContact O-N 3.08Å
97	A	40.1	Very low	47.2	Very low	55 Å²	55	114.1 Å²	114.1	46%	0.455	65%	0.647	S	S	.	*	H	α-helix	trans	-62.1	-35.5	179.2	0	0	0	0	0	112.5	N93 L94 V99 T100	N93-A97 WeakPolarHBondContact O-CB 3.11Å; N93-A97 PolarHBondContact O-N 2.86Å; L94-A97 PolarHBondContact O-N 2.87Å; A97-V99 PolarHBondContact O-N 3.01Å; A97-V99 VanDerWaalsContact O-N 3.14Å; A97-T100 PolarHBondContact O-N 3.36Å; A97-T100 VanDerWaalsContact O-N 3.16Å
98	A	40.8	Very low	46.4	Very low	81 Å²	81	112.4 Å²	112.4	67%	0.669	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.6	-16.7	175.1	0	0	0	0	0	114.3	L94 M96	L94-A98 PolarHBondContact O-N 3.27Å; M96-A98 VanDerWaalsContact C-N 3.28Å; M96-A98 PolarHBondContact O-N 2.94Å
99	V	44	Very low	45.7	Very low	125 Å²	125	110.4 Å²	110.4	76%	0.758	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	-19.2	178.1	-177.7	0	0	0	0	112.3	M96 A97	M96-V99 WeakPolarHBondContact O-CB 3.23Å; M96-V99 PolarHBondContact O-N 3.16Å; M96-V99 VanDerWaalsContact O-N 3.08Å; A97-V99 PolarHBondContact O-N 3.01Å; A97-V99 VanDerWaalsContact O-N 3.14Å
100	T	40.2	Very low	45.1	Very low	115 Å²	115	110.2 Å²	110.2	71%	0.706	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.8	-12.3	-166.8	-144	0	0	0	0	115.4	A97	A97-T100 PolarHBondContact O-N 3.36Å; A97-T100 VanDerWaalsContact O-N 3.16Å
101	M	37.9	Very low	44.9	Very low	158 Å²	158	112.3 Å²	112.3	78%	0.778	66%	0.659	S	S	*	*	S	Bend	trans	-120.3	81.6	-178.5	-65	-62.4	-72.9	0	0	111.1	F103	M101-F103 PolarHBondContact O-N 3.28Å
102	G	44.2	Very low	44.7	Very low	84 Å²	84	109.1 Å²	109.1	87%	0.866	65%	0.646	S	S	*	*			trans	-74	91.5	-172.1	0	0	0	0	0	115
103	F	39.1	Very low	44.9	Very low	216 Å²	216	109.9 Å²	109.9	95%	0.947	65%	0.65	S	S	*	*			trans	-151.7	88.9	159.1	-151.1	-94.3	0	0	0	111.4	M101	M101-F103 PolarHBondContact O-N 3.28Å
104	G	34.8	Very low	45.5	Very low	69 Å²	69	107.3 Å²	107.3	71%	0.711	64%	0.643	S	S	*	*	S	Bend	trans	155.6	152.3	-177.4	0	0	0	0	0	111.7
105	D	37.1	Very low	46.1	Very low	136 Å²	136	103.6 Å²	103.6	73%	0.727	63%	0.63	S	S	*	*			trans	-65.7	143.9	-165.3	-63.5	-83.4	0	0	0	115.4	L107	D105-L107 PolarHBondContact O-N 2.96Å
106	P	40.3	Very low	46.9	Very low	123 Å²	123	102.4 Å²	102.4	80%	0.799	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	32.7	-166.3	33.8	-38.9	0	0	0	115.6
107	L	46.8	Very low	48	Very low	120 Å²	120	99.2 Å²	99.2	63%	0.628	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103	-18	-172.7	-80.5	160.2	0	0	0	115.2	D105 L110	D105-L107 PolarHBondContact O-N 2.96Å; L107-L110 PolarHBondContact O-N 3.26Å
108	S	49.4	Very low	49.3	Very low	80 Å²	80	101.7 Å²	101.7	56%	0.559	61%	0.608	S	S	*	*	H	α-helix	trans	-66.5	-34.1	-168.1	-57.6	0	0	0	0	117.3	L110 Q111	S108-L110 VanDerWaalsContact C-N 3.25Å; S108-L110 PolarHBondContact O-N 3Å; S108-Q111 PolarHBondContact O-N 2.86Å
109	P	45.9	Very low	50.7	Low	89 Å²	89	105.4 Å²	105.4	58%	0.578	61%	0.605	S	S	*	*	H	α-helix	trans	-63.6	-32.8	177.5	-22.5	34	0	0	0	112.9	S112 V113	P109-S112 PolarHBondContact O-OG 3.27Å; P109-S112 VanDerWaalsContact O-OG 3.1Å; P109-V113 PolarHBondContact O-N 2.9Å
110	L	46.4	Very low	51.9	Low	119 Å²	119	99.6 Å²	99.6	62%	0.623	57%	0.57	S	S	*	*	H	α-helix	trans	-73.1	-35.2	-177.7	-145.3	158.8	0	0	0	110.7	L107 S108 V113 A114	L107-L110 PolarHBondContact O-N 3.26Å; S108-L110 VanDerWaalsContact C-N 3.25Å; S108-L110 PolarHBondContact O-N 3Å; L110-V113 PolarHBondContact O-N 2.6Å; L110-A114 WeakPolarHBondContact O-CB 3.21Å; L110-A114 PolarHBondContact O-N 3.06Å
111	Q	52.8	Low	53.5	Low	142 Å²	142	94.9 Å²	94.9	66%	0.664	54%	0.54	S	S	*	.	H	α-helix	trans	-65.6	-39.3	176.2	-78.8	-171.1	-7.6	0	0	113.9	S108 A114 A115	S108-Q111 PolarHBondContact O-N 2.86Å; Q111-A114 PolarHBondContact O-N 2.85Å; Q111-A115 VanDerWaalsContact O-CB 3.28Å; Q111-A115 WeakPolarHBondContact O-CB 3.43Å; Q111-A115 PolarHBondContact O-N 2.79Å
112	S	52.1	Low	55.1	Low	46 Å²	46	89.5 Å²	89.5	32%	0.322	52%	0.521	S	S	.	.	H	α-helix	trans	-67.9	-40.1	178	49.8	0	0	0	0	112.3	Q95 P109 Q116	Q95-S112 PolarHBondContact NE2-OG 2.76Å; P109-S112 PolarHBondContact O-OG 3.27Å; P109-S112 VanDerWaalsContact O-OG 3.1Å; S112-Q116 WeakPolarHBondContact O-CB 3.43Å; S112-Q116 PolarHBondContact O-N 3.01Å; S112-Q116 VanDerWaalsContact O-N 3.09Å
113	V	60.6	Low	56.6	Low	93 Å²	93	88.3 Å²	88.3	56%	0.564	49%	0.494	S	S	*	.	H	α-helix	trans	-66.9	-44.6	175	176.5	0	0	0	0	110.4	P109 L110 A115 Q116 R117	P109-V113 PolarHBondContact O-N 2.9Å; L110-V113 PolarHBondContact O-N 2.6Å; V113-A115 PolarHBondContact O-N 3.47Å; V113-Q116 PolarHBondContact O-N 3.17Å; V113-R117 WeakPolarHBondContact O-CB 3.5Å; V113-R117 PolarHBondContact O-N 2.95Å
114	A	60	Low	58.1	Low	46 Å²	46	79.2 Å²	79.2	38%	0.38	46%	0.455	S	S	.	.	H	α-helix	trans	-62.6	-40.7	176.8	0	0	0	0	0	112.6	L110 Q111 R117 Q118	L110-A114 WeakPolarHBondContact O-CB 3.21Å; L110-A114 PolarHBondContact O-N 3.06Å; Q111-A114 PolarHBondContact O-N 2.85Å; A114-R117 PolarHBondContact O-N 3.41Å; A114-Q118 VanDerWaalsContact O-CB 3.29Å; A114-Q118 WeakPolarHBondContact O-CB 3.44Å; A114-Q118 PolarHBondContact O-N 2.93Å
115	A	62.7	Low	60.3	Low	46 Å²	46	76.5 Å²	76.5	38%	0.38	43%	0.425	S	S	.	.	H	α-helix	trans	-66.3	-38	176.4	0	0	0	0	0	112.4	Q111 V113 R119	Q111-A115 VanDerWaalsContact O-CB 3.28Å; Q111-A115 WeakPolarHBondContact O-CB 3.43Å; Q111-A115 PolarHBondContact O-N 2.79Å; V113-A115 PolarHBondContact O-N 3.47Å; A115-R119 WeakPolarHBondContact O-CG 3.4Å; A115-R119 PolarHBondContact O-N 3.29Å; A115-R119 VanDerWaalsContact O-N 3.12Å
116	Q	66.2	Low	62.6	Low	86 Å²	86	73.2 Å²	73.2	40%	0.402	40%	0.402	S	S	.	.	H	α-helix	trans	-69.5	-42.2	174.9	-164.6	72.8	-15	0	0	111.5	S112 V113 R119 A120 I210	S112-Q116 WeakPolarHBondContact O-CB 3.43Å; S112-Q116 PolarHBondContact O-N 3.01Å; S112-Q116 VanDerWaalsContact O-N 3.09Å; V113-Q116 PolarHBondContact O-N 3.17Å; Q116-R119 PolarHBondContact O-N 3.14Å; Q116-A120 PolarHBondContact O-N 3.15Å; Q116-I210 HydrophobicContact CG-CD1 4.43Å
117	R	65.9	Low	64.8	Low	54 Å²	54	67.6 Å²	67.6	20%	0.204	37%	0.366	C	S	.	.	H	α-helix	trans	-60.4	-45.5	172.7	177.9	178.5	-92.9	172.9	-2.4	111.3	V113 A114 R119 A120 L121 L214 E217	V113-R117 WeakPolarHBondContact O-CB 3.5Å; V113-R117 PolarHBondContact O-N 2.95Å; A114-R117 PolarHBondContact O-N 3.41Å; R117-R119 VanDerWaalsContact C-N 3.32Å; R117-R119 PolarHBondContact O-N 3.42Å; R117-A120 WeakPolarHBondContact O-CB 3.43Å; R117-A120 PolarHBondContact O-N 2.95Å; R117-A120 VanDerWaalsContact O-N 3.11Å; R117-L121 HydrophobicContact CG-CD1 3.86Å; R117-L121 HydrophobicContact CG-CG 4.28Å; R117-L121 WeakPolarHBondContact O-CG 3.39Å; R117-L121 PolarHBondContact O-N 3.09Å; R117-L214 HydrophobicContact CG-CD1 4.2Å; R117-L214 HydrophobicContact CG-CD2 4.01Å; R117-L214 VanDerWaalsContact NE-CD1 3.29Å; R117-E217 IonicContact CZ-OE1 2.6Å; R117-E217 IonicContact CZ-OE2 3.93Å; R117-E217 IonicContact NH2-OE1 3.55Å; R117-E217 PolarHBondContact NH2-OE1 3.11Å; R117-E217 IonicContact NH2-OE2 3.14Å; R117-E217 PolarHBondContact NH2-OE2 2.98Å
118	Q	67.6	Low	66.8	Low	107 Å²	107	65.7 Å²	65.7	50%	0.5	35%	0.351	S	S	.	.	H	α-helix	trans	-64.5	-35.8	179.7	-167.9	63.9	16.3	0	0	112.3	A114 A122	A114-Q118 VanDerWaalsContact O-CB 3.29Å; A114-Q118 WeakPolarHBondContact O-CB 3.44Å; A114-Q118 PolarHBondContact O-N 2.93Å; Q118-A122 WeakPolarHBondContact O-CB 3.19Å; Q118-A122 PolarHBondContact O-N 3.04Å
119	R	71.1	Confident	68.7	Low	160 Å²	160	61.9 Å²	61.9	60%	0.604	32%	0.324	S	S	*	.	H	α-helix	trans	-63.8	-45.2	170.4	-72.6	168	180	161.6	-0.6	111.5	A115 Q116 R117 A122 I123	A115-R119 WeakPolarHBondContact O-CG 3.4Å; A115-R119 PolarHBondContact O-N 3.29Å; A115-R119 VanDerWaalsContact O-N 3.12Å; Q116-R119 PolarHBondContact O-N 3.14Å; R117-R119 VanDerWaalsContact C-N 3.32Å; R117-R119 PolarHBondContact O-N 3.42Å; R119-A122 PolarHBondContact O-N 2.59Å; R119-I123 WeakPolarHBondContact O-CB 3.34Å; R119-I123 WeakPolarHBondContact O-CD1 3.36Å; R119-I123 WeakPolarHBondContact O-CG1 3.34Å; R119-I123 PolarHBondContact O-N 2.78Å
120	A	68.2	Low	70.6	Confident	3 Å²	3	57.7 Å²	57.7	3%	0.025	30%	0.297	C	S	.	.	H	α-helix	trans	-62.2	-44.4	176.7	0	0	0	0	0	112.1	Q116 R117 I123 M124 I210 L214	Q116-A120 PolarHBondContact O-N 3.15Å; R117-A120 WeakPolarHBondContact O-CB 3.43Å; R117-A120 PolarHBondContact O-N 2.95Å; R117-A120 VanDerWaalsContact O-N 3.11Å; A120-I123 CarbonylContact O-C 3.58Å; A120-I123 PolarHBondContact O-N 2.58Å; A120-M124 WeakPolarHBondContact O-CG 3.47Å; A120-M124 PolarHBondContact O-N 2.8Å; A120-I210 HydrophobicContact CB-CG2 3.84Å; A120-L214 HydrophobicContact CB-CD2 4.19Å
121	L	74.3	Confident	72.6	Confident	15 Å²	15	53.4 Å²	53.4	8%	0.079	28%	0.277	C	S	.	.	H	α-helix	trans	-61.5	-48.3	175.9	-69.1	168.6	0	0	0	111.7	R117 I123 M124 C125 P176 L214	R117-L121 HydrophobicContact CG-CD1 3.86Å; R117-L121 HydrophobicContact CG-CG 4.28Å; R117-L121 WeakPolarHBondContact O-CG 3.39Å; R117-L121 PolarHBondContact O-N 3.09Å; L121-I123 PolarHBondContact O-N 2.89Å; L121-M124 HydrophobicContact CD2-SD 4.1Å; L121-M124 WeakPolarHBondContact O-CB 3.24Å; L121-M124 PolarHBondContact O-N 2.95Å; L121-C125 PolarHBondContact O-N 2.83Å; L121-C125 PolarHBondContact O-SG 3.03Å; L121-P176 HydrophobicContact CD2-CG 4.02Å; L121-L214 HydrophobicContact CD2-CD2 3.99Å; L121-L214 HydrophobicContact CG-CD2 4.11Å
122	A	71.6	Confident	74.2	Confident	46 Å²	46	46.7 Å²	46.7	38%	0.38	25%	0.246	S	C	.	.	H	α-helix	trans	-61.1	-31.8	176.2	0	0	0	0	0	112.8	Q118 R119	Q118-A122 WeakPolarHBondContact O-CB 3.19Å; Q118-A122 PolarHBondContact O-N 3.04Å; R119-A122 PolarHBondContact O-N 2.59Å
123	I	76.4	Confident	75.8	Confident	58 Å²	58	49 Å²	49	30%	0.297	25%	0.248	S	C	.	.	H	α-helix	trans	-74.4	-33.6	174.3	-71.4	168.8	0	0	0	111.7	R119 A120 L121 I204 A207 I211	R119-I123 WeakPolarHBondContact O-CB 3.34Å; R119-I123 WeakPolarHBondContact O-CD1 3.36Å; R119-I123 WeakPolarHBondContact O-CG1 3.34Å; R119-I123 PolarHBondContact O-N 2.78Å; A120-I123 CarbonylContact O-C 3.58Å; A120-I123 PolarHBondContact O-N 2.58Å; L121-I123 PolarHBondContact O-N 2.89Å; I123-I204 HydrophobicContact CG2-CD1 3.34Å; I123-I204 HydrophobicContact CG2-CG1 3.57Å; I123-A207 HydrophobicContact CD1-CB 4.32Å; I123-I211 HydrophobicContact CG2-CD1 3.88Å
124	M	71	Confident	76.8	Confident	26 Å²	26	50.3 Å²	50.3	13%	0.128	24%	0.244	C	C	.	.	H	α-helix	trans	-69.5	-40.1	171.2	-69	166.4	167.8	0	0	112.4	A120 L121 R126 P176 A179 I211 L214 V299	A120-M124 WeakPolarHBondContact O-CG 3.47Å; A120-M124 PolarHBondContact O-N 2.8Å; L121-M124 HydrophobicContact CD2-SD 4.1Å; L121-M124 WeakPolarHBondContact O-CB 3.24Å; L121-M124 PolarHBondContact O-N 2.95Å; M124-R126 PolarHBondContact O-N 3.33Å; M124-P176 HydrophobicContact CB-CB 3.71Å; M124-P176 HydrophobicContact SD-CB 4.47Å; M124-A179 VanDerWaalsContact O-CB 3.29Å; M124-A179 WeakPolarHBondContact O-CB 3.28Å; M124-I211 HydrophobicContact CE-CB 4.12Å; M124-I211 HydrophobicContact CE-CG1 4.26Å; M124-I211 HydrophobicContact CE-CG2 3.81Å; M124-I211 WeakPolarHBondContact CE-O 3.44Å; M124-I211 HydrophobicContact CG-CG1 4.3Å; M124-I211 HydrophobicContact CG-CG2 4.39Å; M124-L214 HydrophobicContact CE-CB 4.17Å; M124-L214 HydrophobicContact CE-CD2 3.91Å; M124-L214 HydrophobicContact CE-CG 4.16Å; M124-L214 HydrophobicContact SD-CD2 4.32Å; M124-V299 HydrophobicContact CE-CG1 3.68Å; M124-V299 HydrophobicContact SD-CG1 3.68Å
125	C	80.8	Confident	77.8	Confident	12 Å²	12	56 Å²	56	8%	0.081	26%	0.262	C	S	.	.	H	α-helix	trans	-62.4	-22.8	179.9	-75.8	0	0	0	0	114.2	L121 E172 Y173	L121-C125 PolarHBondContact O-N 2.83Å; L121-C125 PolarHBondContact O-SG 3.03Å; C125-E172 HydrophobicContact CB-CG 4.45Å; C125-Y173 VanDerWaalsContact CB-O 3.28Å; C125-Y173 WeakPolarHBondContact CB-O 3.38Å; C125-Y173 PolarHBondContact O-N 3.23Å; C125-Y173 PolarHBondContact SG-O 3.07Å; C125-Y173 VanDerWaalsContact SG-O 3.4Å
126	R	84.1	Confident	78.8	Confident	67 Å²	67	54.5 Å²	54.5	25%	0.253	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	114.1	-175.3	-167.7	175.7	-178.5	108.2	3	111.2	M124 D155 F170 V171 P201	M124-R126 PolarHBondContact O-N 3.33Å; R126-D155 IonicContact CZ-OD2 2.68Å; R126-D155 VanDerWaalsContact CZ-OD2 3.3Å; R126-D155 IonicContact NH1-OD2 2.67Å; R126-D155 PolarHBondContact NH1-OD2 2.76Å; R126-D155 IonicContact NH2-OD2 3.65Å; R126-D155 PolarHBondContact NH2-OD2 3.12Å; R126-F170 HydrophobicContact CG-CB 4.39Å; R126-F170 VanDerWaalsContact NH2-CG 3.33Å; R126-V171 WeakPolarHBondContact CA-O 3.24Å; R126-P201 HydrophobicContact CB-CG 4.38Å; R126-P201 HydrophobicContact CG-CG 4.36Å; R126-P201 WeakPolarHBondContact O-CD 3.08Å
127	V	87.8	Confident	79.7	Confident	5 Å²	5	51.6 Å²	51.6	3%	0.03	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	139.7	175.3	-176.8	0	0	0	0	109.9	V129 F170 V171 Y173 A179 V198	V127-V129 HydrophobicContact CG1-CG2 4.09Å; V127-F170 CarbonylContact O-C 3.6Å; V127-F170 VanDerWaalsContact O-CA 3.27Å; V127-F170 WeakPolarHBondContact O-CA 3.41Å; V127-V171 HydrophobicContact CB-CB 4.46Å; V127-V171 PolarHBondContact N-O 3.11Å; V127-V171 PolarHBondContact O-N 2.87Å; V127-Y173 HydrophobicContact CG2-CD2 4.02Å; V127-Y173 HydrophobicContact CG2-CE2 3.99Å; V127-A179 HydrophobicContact CG2-CB 3.48Å; V127-A179 VanDerWaalsContact CG2-CB 3.48Å; V127-V198 HydrophobicContact CG1-CG1 3.3Å
128	Y	88.4	Confident	80.6	Confident	79 Å²	79	52.7 Å²	52.7	31%	0.31	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	131.3	166	168.9	-98.9	0	0	0	109.9	F168 F170 V198 G199	Y128-F168 HydrophobicContact CE2-CB 3.71Å; Y128-F168 AromaticContact CE2-CD2 3.97Å; Y128-F168 HydrophobicContact CE2-CD2 3.97Å; Y128-F168 HydrophobicContact CE2-CG 4.07Å; Y128-F170 HydrophobicContact CD2-CD1 4.1Å; Y128-F170 AromaticContact CD2-CE1 3.67Å; Y128-F170 HydrophobicContact CD2-CE1 3.67Å; Y128-F170 HydrophobicContact CD2-CZ 4.1Å; Y128-F170 HydrophobicContact CG-CE1 4.42Å; Y128-V198 CarbonylContact O-C 3.57Å; Y128-V198 WeakPolarHBondContact O-CA 3.33Å; Y128-G199 PolarHBondContact N-O 3.12Å; Y128-G199 PolarHBondContact O-N 3.3Å
129	V	88.3	Confident	81.5	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	96.3	178.1	-172.8	0	0	0	0	108.7	V127 I132 F145 F168 A169 V171 I196	V127-V129 HydrophobicContact CG1-CG2 4.09Å; V129-I132 HydrophobicContact CG1-CG2 4.03Å; V129-F145 HydrophobicContact CB-CZ 4.43Å; V129-F145 HydrophobicContact CG1-CE2 4.3Å; V129-F145 HydrophobicContact CG1-CZ 3.9Å; V129-F145 HydrophobicContact CG2-CE1 3.65Å; V129-F145 HydrophobicContact CG2-CE2 4.44Å; V129-F145 HydrophobicContact CG2-CZ 3.58Å; V129-F168 CarbonylContact O-C 3.59Å; V129-F168 VanDerWaalsContact O-CA 3.32Å; V129-F168 WeakPolarHBondContact O-CA 3.5Å; V129-A169 PolarHBondContact N-O 3.38Å; V129-A169 PolarHBondContact O-N 3.01Å; V129-V171 HydrophobicContact CG2-CG2 3.95Å; V129-I196 HydrophobicContact CG1-CB 4.38Å; V129-I196 HydrophobicContact CG1-CD1 4.09Å
130	G	87.4	Confident	82.3	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.01	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	172.9	175.9	0	0	0	0	0	113.1	I132 G167 I196 K197	G130-I132 VanDerWaalsContact C-N 3.26Å; G130-I132 PolarHBondContact O-N 2.7Å; G130-G167 CarbonylContact C-O 3.45Å; G130-I196 WeakPolarHBondContact O-CA 3.42Å; G130-K197 PolarHBondContact N-O 3.03Å; G130-K197 PolarHBondContact O-N 2.77Å
131	S	87	Confident	83.2	Confident	30 Å²	30	48.5 Å²	48.5	21%	0.21	24%	0.243	C	C	.	.			trans	63.8	26.6	177.5	-165	0	0	0	0	114.2	G167 R194 N195	S131-G167 PolarHBondContact N-O 2.95Å; S131-R194 WeakPolarHBondContact O-CD 3.13Å; S131-N195 VanDerWaalsContact CB-O 3.28Å; S131-N195 WeakPolarHBondContact CB-O 3.34Å; S131-N195 PolarHBondContact OG-O 3.38Å
132	I	86.9	Confident	83.9	Confident	1 Å²	1	54.5 Å²	54.5	1%	0.005	27%	0.265	C	S	.	.			trans	-70.5	146.5	168.5	50.9	170.1	0	0	0	110.9	V129 G130 L136 I141 M156 H165 G167 A169 I196	V129-I132 HydrophobicContact CG1-CG2 4.03Å; G130-I132 VanDerWaalsContact C-N 3.26Å; G130-I132 PolarHBondContact O-N 2.7Å; I132-L136 HydrophobicContact CB-CD2 4.33Å; I132-L136 HydrophobicContact CG2-CD2 4.29Å; I132-I141 HydrophobicContact CD1-CD1 3.83Å; I132-I141 HydrophobicContact CG2-CD1 4.15Å; I132-M156 HydrophobicContact CD1-CE 3.69Å; I132-H165 WeakPolarHBondContact CB-NE2 3.25Å; I132-H165 WeakPolarHBondContact CD1-CE1 3.15Å; I132-H165 VanDerWaalsContact CD1-ND1 3.27Å; I132-H165 WeakPolarHBondContact CD1-ND1 3.49Å; I132-H165 WeakPolarHBondContact CD1-NE2 3.42Å; I132-H165 WeakPolarHBondContact CG1-CE1 3.4Å; I132-H165 WeakPolarHBondContact CG1-NE2 3.39Å; I132-H165 PolarHBondContact O-NE2 3.41Å; I132-H165 VanDerWaalsContact O-NE2 3.11Å; I132-G167 WeakPolarHBondContact CG1-O 3.43Å; I132-G167 PolarHBondContact N-O 2.73Å; I132-A169 HydrophobicContact CD1-CB 4.3Å; I132-I196 HydrophobicContact CG2-CG2 3.69Å
133	Y	84.8	Confident	84.6	Confident	95 Å²	95	59.6 Å²	59.6	37%	0.373	28%	0.281	S	S	.	.			trans	-77.5	141.4	-179.3	-177.5	-106.2	0	0	0	112.1	E135 L136 H165 G192	Y133-E135 HydrophobicContact CD1-CB 4.03Å; Y133-E135 HydrophobicContact CD1-CG 4.38Å; Y133-E135 HydrophobicContact CE1-CB 3.82Å; Y133-E135 HydrophobicContact CE1-CG 3.76Å; Y133-E135 PolarHBondContact O-N 2.91Å; Y133-L136 WeakPolarHBondContact O-CB 3.48Å; Y133-L136 PolarHBondContact O-N 2.85Å; Y133-H165 PolarHBondContact N-NE2 3.47Å; Y133-H165 PolarHBondContact O-NE2 3.41Å; Y133-G192 WeakPolarHBondContact CB-O 3.27Å; Y133-G192 WeakPolarHBondContact CD2-O 3.49Å
134	Y	82	Confident	85.1	Confident	120 Å²	120	58 Å²	58	47%	0.471	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-10	-164.3	-60.7	-73.6	0	0	0	117.3	H165	Y134-H165 WeakPolarHBondContact CD1-O 3.43Å
135	E	82.2	Confident	85.9	Confident	164 Å²	164	56.8 Å²	56.8	77%	0.766	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.8	1.5	176	-54.6	-175.3	143.9	0	0	112.2	Y133 G137	Y133-E135 HydrophobicContact CD1-CB 4.03Å; Y133-E135 HydrophobicContact CD1-CG 4.38Å; Y133-E135 HydrophobicContact CE1-CB 3.82Å; Y133-E135 HydrophobicContact CE1-CG 3.76Å; Y133-E135 PolarHBondContact O-N 2.91Å; E135-G137 PolarHBondContact O-N 3.39Å
136	L	83.1	Confident	86.1	Confident	16 Å²	16	58.5 Å²	58.5	8%	0.084	29%	0.285	C	S	.	.			trans	-85.8	107.8	-174.5	-162.3	78.3	0	0	0	110.5	I132 Y133 T140 I141 L191	I132-L136 HydrophobicContact CB-CD2 4.33Å; I132-L136 HydrophobicContact CG2-CD2 4.29Å; Y133-L136 WeakPolarHBondContact O-CB 3.48Å; Y133-L136 PolarHBondContact O-N 2.85Å; L136-T140 HydrophobicContact CD1-CG2 3.64Å; L136-T140 HydrophobicContact CG-CG2 4.37Å; L136-I141 HydrophobicContact CD2-CG1 4.28Å; L136-L191 HydrophobicContact CD2-CB 4.11Å; L136-L191 HydrophobicContact CD2-CD2 4.34Å
137	G	84.3	Confident	86.2	Confident	24 Å²	24	57.3 Å²	57.3	25%	0.247	29%	0.286	C	S	.	.			trans	-72	170.6	179.7	0	0	0	0	0	114.6	E135 D139 T140 I141	E135-G137 PolarHBondContact O-N 3.39Å; G137-D139 VanDerWaalsContact C-N 3.26Å; G137-D139 PolarHBondContact O-N 3.37Å; G137-T140 PolarHBondContact O-N 2.95Å; G137-I141 PolarHBondContact O-N 3.39Å
138	E	84.7	Confident	86.1	Confident	77 Å²	77	57 Å²	57	36%	0.36	28%	0.284	S	S	.	.	H	α-helix	trans	-58.2	-40.9	176.8	-170	-176.4	140.8	0	0	111	T140 I141 R142 I154 M156	E138-T140 VanDerWaalsContact C-N 3.27Å; E138-T140 PolarHBondContact O-N 3.24Å; E138-I141 CarbonylContact O-C 3.53Å; E138-I141 WeakPolarHBondContact O-CB 3.47Å; E138-I141 PolarHBondContact O-N 3.06Å; E138-I141 VanDerWaalsContact O-N 3.07Å; E138-R142 WeakPolarHBondContact O-CB 3.45Å; E138-R142 PolarHBondContact O-N 3.44Å; E138-I154 HydrophobicContact CG-CB 3.93Å; E138-I154 HydrophobicContact CG-CD1 3.93Å; E138-I154 HydrophobicContact CG-CG1 4.47Å; E138-I154 HydrophobicContact CG-CG2 3.99Å; E138-M156 WeakPolarHBondContact CA-SD 3.35Å; E138-M156 HydrophobicContact CB-CG 4.32Å; E138-M156 HydrophobicContact CB-SD 3.64Å; E138-M156 HydrophobicContact CG-CG 4.38Å; E138-M156 HydrophobicContact CG-SD 4.29Å; E138-M156 PolarHBondContact N-SD 2.85Å; E138-M156 VanDerWaalsContact N-SD 3.36Å
139	D	87.3	Confident	85.9	Confident	127 Å²	127	53.7 Å²	53.7	68%	0.679	27%	0.274	S	S	*	.	H	α-helix	trans	-56.2	-38.3	-179	-54.2	-87.7	0	0	0	113	G137 R142 Q143	G137-D139 VanDerWaalsContact C-N 3.26Å; G137-D139 PolarHBondContact O-N 3.37Å; D139-R142 PolarHBondContact O-N 3.11Å; D139-Q143 VanDerWaalsContact O-CB 3.3Å; D139-Q143 WeakPolarHBondContact O-CB 3.37Å; D139-Q143 PolarHBondContact O-N 3.34Å
140	T	87.3	Confident	85.8	Confident	54 Å²	54	54.5 Å²	54.5	33%	0.331	28%	0.279	S	S	.	.	H	α-helix	trans	-75	-34.5	179.1	-38.2	0	0	0	0	111.7	L136 G137 E138 A144 L191	L136-T140 HydrophobicContact CD1-CG2 3.64Å; L136-T140 HydrophobicContact CG-CG2 4.37Å; G137-T140 PolarHBondContact O-N 2.95Å; E138-T140 VanDerWaalsContact C-N 3.27Å; E138-T140 PolarHBondContact O-N 3.24Å; T140-A144 WeakPolarHBondContact O-CB 3.4Å; T140-A144 PolarHBondContact O-N 2.99Å; T140-L191 HydrophobicContact CG2-CD2 4.31Å
141	I	87.6	Confident	85.9	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.005	29%	0.286	C	S	.	.	H	α-helix	trans	-65.2	-46.8	170.1	-58.2	176	0	0	0	108.9	I132 L136 G137 E138 Q143 A144 F145 I154 M156 A169 V171	I132-I141 HydrophobicContact CD1-CD1 3.83Å; I132-I141 HydrophobicContact CG2-CD1 4.15Å; L136-I141 HydrophobicContact CD2-CG1 4.28Å; G137-I141 PolarHBondContact O-N 3.39Å; E138-I141 CarbonylContact O-C 3.53Å; E138-I141 WeakPolarHBondContact O-CB 3.47Å; E138-I141 PolarHBondContact O-N 3.06Å; E138-I141 VanDerWaalsContact O-N 3.07Å; I141-Q143 VanDerWaalsContact C-N 3.33Å; I141-Q143 PolarHBondContact O-N 2.79Å; I141-A144 PolarHBondContact O-N 3.26Å; I141-F145 HydrophobicContact CG2-CD2 3.88Å; I141-F145 HydrophobicContact CG2-CE2 4.2Å; I141-F145 HydrophobicContact CG2-CG 4.45Å; I141-F145 WeakPolarHBondContact O-CB 3.48Å; I141-F145 VanDerWaalsContact O-CD2 3.28Å; I141-F145 WeakPolarHBondContact O-CD2 3.44Å; I141-F145 PolarHBondContact O-N 3.49Å; I141-I154 HydrophobicContact CG2-CD1 4.48Å; I141-M156 HydrophobicContact CD1-CE 3.96Å; I141-M156 HydrophobicContact CD1-CG 4.44Å; I141-M156 HydrophobicContact CD1-SD 4.05Å; I141-A169 HydrophobicContact CD1-CB 4.2Å; I141-V171 HydrophobicContact CG2-CG2 4.16Å
142	R	88.1	Confident	85.9	Confident	142 Å²	142	60.8 Å²	60.8	54%	0.536	30%	0.303	S	S	.	.	H	α-helix	trans	-58.5	-43.1	177.9	-165	175.2	-173.2	-82.9	-3.8	111.6	E138 D139 A146 I151 I154	E138-R142 WeakPolarHBondContact O-CB 3.45Å; E138-R142 PolarHBondContact O-N 3.44Å; D139-R142 PolarHBondContact O-N 3.11Å; R142-A146 WeakPolarHBondContact O-CB 3.37Å; R142-A146 PolarHBondContact O-N 2.81Å; R142-I151 HydrophobicContact CG-CD1 4.25Å; R142-I154 HydrophobicContact CB-CD1 3.78Å; R142-I154 HydrophobicContact CG-CD1 4.11Å
143	Q	88.1	Confident	85.7	Confident	153 Å²	153	62.9 Å²	62.9	72%	0.715	32%	0.318	S	S	*	.	H	α-helix	trans	-67.1	-41.6	176.7	-170.9	178.6	15.9	0	0	112.5	D139 I141 P147	D139-Q143 VanDerWaalsContact O-CB 3.3Å; D139-Q143 WeakPolarHBondContact O-CB 3.37Å; D139-Q143 PolarHBondContact O-N 3.34Å; I141-Q143 VanDerWaalsContact C-N 3.33Å; I141-Q143 PolarHBondContact O-N 2.79Å; Q143-P147 WeakPolarHBondContact O-CD 3.45Å
144	A	86.3	Confident	85.9	Confident	23 Å²	23	59.1 Å²	59.1	19%	0.19	30%	0.304	C	S	.	.	H	α-helix	trans	-70.1	-32.9	177.8	0	0	0	0	0	113.2	T140 I141 P147 F148 L191	T140-A144 WeakPolarHBondContact O-CB 3.4Å; T140-A144 PolarHBondContact O-N 2.99Å; I141-A144 PolarHBondContact O-N 3.26Å; A144-P147 WeakPolarHBondContact O-CD 3.49Å; A144-F148 WeakPolarHBondContact O-CE2 3.41Å; A144-L191 HydrophobicContact CB-CD1 4.12Å; A144-L191 HydrophobicContact CB-CD2 4.14Å
145	F	86.9	Confident	86.1	Confident	1 Å²	1	57 Å²	57	0%	0.004	30%	0.301	C	S	.	.	H	α-helix	trans	-93.7	-19.4	-176.8	-77.3	-111.8	0	0	0	113.3	V129 I141 P147 F148 I151 V171 Y173 A182 M186 I196 V198	V129-F145 HydrophobicContact CB-CZ 4.43Å; V129-F145 HydrophobicContact CG1-CE2 4.3Å; V129-F145 HydrophobicContact CG1-CZ 3.9Å; V129-F145 HydrophobicContact CG2-CE1 3.65Å; V129-F145 HydrophobicContact CG2-CE2 4.44Å; V129-F145 HydrophobicContact CG2-CZ 3.58Å; I141-F145 HydrophobicContact CG2-CD2 3.88Å; I141-F145 HydrophobicContact CG2-CE2 4.2Å; I141-F145 HydrophobicContact CG2-CG 4.45Å; I141-F145 WeakPolarHBondContact O-CB 3.48Å; I141-F145 VanDerWaalsContact O-CD2 3.28Å; I141-F145 WeakPolarHBondContact O-CD2 3.44Å; I141-F145 PolarHBondContact O-N 3.49Å; F145-P147 VanDerWaalsContact C-CD 3.49Å; F145-F148 PolarHBondContact O-N 3.16Å; F145-I151 HydrophobicContact CB-CD1 3.68Å; F145-V171 HydrophobicContact CD1-CG2 4.33Å; F145-Y173 WeakPolarHBondContact CB-OH 3.12Å; F145-Y173 HydrophobicContact CD1-CE2 4.43Å; F145-Y173 WeakPolarHBondContact CD1-OH 3.34Å; F145-Y173 PolarHBondContact O-OH 2.95Å; F145-Y173 VanDerWaalsContact O-OH 3.11Å; F145-A182 HydrophobicContact CD1-CB 4.17Å; F145-A182 HydrophobicContact CE1-CB 4.2Å; F145-M186 HydrophobicContact CE1-CB 4.23Å; F145-M186 HydrophobicContact CE1-CG 4.32Å; F145-M186 HydrophobicContact CE2-CB 4.45Å; F145-M186 HydrophobicContact CE2-CG 4.26Å; F145-M186 HydrophobicContact CE2-SD 4.35Å; F145-M186 HydrophobicContact CZ-CB 3.88Å; F145-M186 HydrophobicContact CZ-CG 4.07Å; F145-I196 HydrophobicContact CE2-CD1 3.9Å; F145-I196 HydrophobicContact CZ-CD1 3.84Å; F145-V198 HydrophobicContact CZ-CG2 4.12Å
146	A	85.7	Confident	86.3	Confident	49 Å²	49	50 Å²	50	41%	0.405	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-52.4	-43.1	175.3	0	0	0	0	0	116.4	R142 F148 G149	R142-A146 WeakPolarHBondContact O-CB 3.37Å; R142-A146 PolarHBondContact O-N 2.81Å; A146-F148 PolarHBondContact O-N 3.39Å; A146-F148 VanDerWaalsContact O-N 3.11Å; A146-G149 PolarHBondContact O-N 2.84Å; A146-G149 VanDerWaalsContact O-N 3.12Å
147	P	86	Confident	86.3	Confident	41 Å²	41	50.7 Å²	50.7	27%	0.266	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-69	-8.1	-178.3	27.3	-36.1	0	0	0	114	Q143 A144 F145 S228	Q143-P147 WeakPolarHBondContact O-CD 3.45Å; A144-P147 WeakPolarHBondContact O-CD 3.49Å; F145-P147 VanDerWaalsContact C-CD 3.49Å; P147-S228 WeakPolarHBondContact O-CB 3.47Å
148	F	85.8	Confident	86.2	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-86	-22.8	173.7	-62.2	-81.3	0	0	0	112.7	A144 F145 A146 Y173 A178 L181 A182 Q185 M186 Y225 A227 R294	A144-F148 WeakPolarHBondContact O-CE2 3.41Å; F145-F148 PolarHBondContact O-N 3.16Å; A146-F148 PolarHBondContact O-N 3.39Å; A146-F148 VanDerWaalsContact O-N 3.11Å; F148-Y173 HydrophobicContact CB-CE1 4.36Å; F148-A178 WeakPolarHBondContact O-CB 3.26Å; F148-L181 HydrophobicContact CD1-CB 4.13Å; F148-A182 HydrophobicContact CB-CB 4.26Å; F148-A182 HydrophobicContact CD1-CB 4.38Å; F148-A182 HydrophobicContact CD2-CB 4.42Å; F148-A182 HydrophobicContact CG-CB 4.07Å; F148-Q185 HydrophobicContact CE1-CB 3.64Å; F148-Q185 HydrophobicContact CE1-CG 4.33Å; F148-Q185 HydrophobicContact CZ-CB 4.06Å; F148-M186 HydrophobicContact CD2-CG 4.2Å; F148-M186 HydrophobicContact CE2-CE 3.69Å; F148-M186 HydrophobicContact CE2-CG 3.39Å; F148-M186 HydrophobicContact CE2-SD 3.98Å; F148-M186 HydrophobicContact CZ-CE 3.63Å; F148-M186 HydrophobicContact CZ-CG 3.63Å; F148-M186 HydrophobicContact CZ-SD 4.35Å; F148-Y225 WeakPolarHBondContact O-CE1 3.27Å; F148-Y225 PolarHBondContact O-OH 2.88Å; F148-A227 WeakPolarHBondContact O-CB 3.1Å; F148-R294 VanDerWaalsContact CE1-CD 3.41Å
149	G	84.6	Confident	86.1	Confident	9 Å²	9	54.4 Å²	54.4	9%	0.093	28%	0.281	C	S	.	.	S	Bend	trans	154.5	178	177.7	0	0	0	0	0	114.2	A146 I151 Y225	A146-G149 PolarHBondContact O-N 2.84Å; A146-G149 VanDerWaalsContact O-N 3.12Å; G149-I151 PolarHBondContact O-N 3.43Å; G149-I151 VanDerWaalsContact O-N 3.16Å; G149-Y225 WeakPolarHBondContact CA-OH 3.23Å
150	P	85.9	Confident	85.6	Confident	16 Å²	16	54.1 Å²	54.1	10%	0.104	29%	0.289	C	S	.	.			trans	-63.3	113.4	177.9	27.2	-37	0	0	0	111.9	D174 V175 F265	P150-D174 HydrophobicContact CB-CB 4.01Å; P150-D174 HydrophobicContact CG-CB 3.79Å; P150-D174 WeakPolarHBondContact O-CB 3.49Å; P150-D174 PolarHBondContact O-N 3.48Å; P150-V175 HydrophobicContact CG-CG2 3.95Å; P150-F265 HydrophobicContact CB-CE1 4.14Å; P150-F265 HydrophobicContact CG-CD1 4.09Å; P150-F265 HydrophobicContact CG-CE1 3.53Å; P150-F265 HydrophobicContact CG-CZ 3.78Å
151	I	89.1	Confident	85.2	Confident	30 Å²	30	57.6 Å²	57.6	15%	0.154	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	132	170.2	-56.7	169.8	0	0	0	108.9	R142 F145 G149 I154 V171 Y173	R142-I151 HydrophobicContact CG-CD1 4.25Å; F145-I151 HydrophobicContact CB-CD1 3.68Å; G149-I151 PolarHBondContact O-N 3.43Å; G149-I151 VanDerWaalsContact O-N 3.16Å; I151-I154 HydrophobicContact CD1-CD1 4.3Å; I151-I154 HydrophobicContact CG2-CD1 4.16Å; I151-I154 HydrophobicContact CG2-CG1 3.68Å; I151-V171 HydrophobicContact CD1-CG1 4.33Å; I151-V171 HydrophobicContact CG1-CG1 4.15Å; I151-V171 HydrophobicContact CG2-CG1 3.82Å; I151-Y173 HydrophobicContact CG1-CD1 4.11Å; I151-Y173 HydrophobicContact CG1-CE1 3.74Å
152	K	86.2	Confident	84.7	Confident	133 Å²	133	60.8 Å²	60.8	58%	0.578	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.2	-40.1	-179.6	179.1	-179.7	167.6	-159.1	0	112.1	E172	K152-E172 WeakPolarHBondContact CA-O 3.45Å; K152-E172 WeakPolarHBondContact CB-O 3.35Å; K152-E172 HydrophobicContact CD-CG 4.41Å; K152-E172 WeakPolarHBondContact CD-OE1 3.35Å; K152-E172 WeakPolarHBondContact CE-OE1 3.49Å; K152-E172 PolarHBondContact N-O 3.37Å; K152-E172 IonicContact NZ-OE1 3.76Å; K152-E172 PolarHBondContact NZ-OE1 3.12Å
153	S	84.3	Confident	84	Confident	46 Å²	46	62.2 Å²	62.2	32%	0.322	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	159.7	171.9	55.8	0	0	0	0	111.9	E172	S153-E172 PolarHBondContact N-O 2.92Å; S153-E172 PolarHBondContact O-N 3.36Å
154	I	88.1	Confident	83.4	Confident	16 Å²	16	60.2 Å²	60.2	8%	0.082	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	112.9	172.5	-53.8	178.3	0	0	0	108.9	E138 I141 R142 I151 M156 A169 F170 V171	E138-I154 HydrophobicContact CG-CB 3.93Å; E138-I154 HydrophobicContact CG-CD1 3.93Å; E138-I154 HydrophobicContact CG-CG1 4.47Å; E138-I154 HydrophobicContact CG-CG2 3.99Å; I141-I154 HydrophobicContact CG2-CD1 4.48Å; R142-I154 HydrophobicContact CB-CD1 3.78Å; R142-I154 HydrophobicContact CG-CD1 4.11Å; I151-I154 HydrophobicContact CD1-CD1 4.3Å; I151-I154 HydrophobicContact CG2-CD1 4.16Å; I151-I154 HydrophobicContact CG2-CG1 3.68Å; I154-M156 HydrophobicContact CG2-CG 4.09Å; I154-M156 PolarHBondContact O-N 2.87Å; I154-A169 HydrophobicContact CG2-CB 4.42Å; I154-F170 CarbonylContact C-O 3.57Å; I154-F170 WeakPolarHBondContact CA-O 3.42Å; I154-V171 HydrophobicContact CG1-CG1 4.48Å; I154-V171 HydrophobicContact CG1-CG2 4.41Å; I154-V171 HydrophobicContact CG2-CG2 4.29Å
155	D	87.4	Confident	83.3	Confident	75 Å²	75	59.4 Å²	59.4	40%	0.401	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	86.5	173.1	-68.8	-42.5	0	0	0	109.5	R126 A169 F170	R126-D155 IonicContact CZ-OD2 2.68Å; R126-D155 VanDerWaalsContact CZ-OD2 3.3Å; R126-D155 IonicContact NH1-OD2 2.67Å; R126-D155 PolarHBondContact NH1-OD2 2.76Å; R126-D155 IonicContact NH2-OD2 3.65Å; R126-D155 PolarHBondContact NH2-OD2 3.12Å; D155-A169 CarbonylContact O-C 3.37Å; D155-A169 WeakPolarHBondContact O-CA 3.36Å; D155-F170 HydrophobicContact CB-CB 4.25Å; D155-F170 HydrophobicContact CB-CD2 4.34Å; D155-F170 PolarHBondContact N-O 3.5Å; D155-F170 PolarHBondContact O-N 3.45Å
156	M	85.8	Confident	83.1	Confident	16 Å²	16	64.4 Å²	64.4	8%	0.079	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	128.5	167.6	-71.8	-159.8	71.9	0	0	110.8	I132 E138 I141 I154 W158 H165 A169	I132-M156 HydrophobicContact CD1-CE 3.69Å; E138-M156 WeakPolarHBondContact CA-SD 3.35Å; E138-M156 HydrophobicContact CB-CG 4.32Å; E138-M156 HydrophobicContact CB-SD 3.64Å; E138-M156 HydrophobicContact CG-CG 4.38Å; E138-M156 HydrophobicContact CG-SD 4.29Å; E138-M156 PolarHBondContact N-SD 2.85Å; E138-M156 VanDerWaalsContact N-SD 3.36Å; I141-M156 HydrophobicContact CD1-CE 3.96Å; I141-M156 HydrophobicContact CD1-CG 4.44Å; I141-M156 HydrophobicContact CD1-SD 4.05Å; I154-M156 HydrophobicContact CG2-CG 4.09Å; I154-M156 PolarHBondContact O-N 2.87Å; M156-W158 PolarHBondContact O-N 2.9Å; M156-W158 HydrophobicContact SD-CZ2 4.28Å; M156-H165 HydrophobicContact CE-CB 3.8Å; M156-A169 HydrophobicContact CG-CB 3.98Å
157	S	83.1	Confident	82.9	Confident	32 Å²	32	62.5 Å²	62.5	22%	0.224	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	98.6	-179.2	-72.5	0	0	0	0	111.6	H165 K166 F168	S157-H165 CarbonylContact O-C 3.49Å; S157-H165 WeakPolarHBondContact O-CA 3.15Å; S157-K166 WeakPolarHBondContact O-CB 3.33Å; S157-K166 PolarHBondContact O-N 2.81Å; S157-F168 PolarHBondContact N-O 3.17Å; S157-F168 WeakPolarHBondContact OG-CE2 3.47Å
158	W	81.1	Confident	83	Confident	141 Å²	141	63.4 Å²	63.4	53%	0.534	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	149.8	179.3	-61.1	88.7	0	0	0	113	M156 H165 K166	M156-W158 PolarHBondContact O-N 2.9Å; M156-W158 HydrophobicContact SD-CZ2 4.28Å; W158-H165 HydrophobicContact CD2-CB 4.33Å; W158-H165 HydrophobicContact CE3-CB 4.19Å; W158-H165 HydrophobicContact CZ3-CB 4.42Å; W158-K166 VanDerWaalsContact O-CE 3.24Å; W158-K166 WeakPolarHBondContact O-CE 3.47Å
159	D	82.8	Confident	83.1	Confident	37 Å²	37	63.4 Å²	63.4	20%	0.198	33%	0.332	C	S	.	.			trans	-98.4	116.3	168.3	-175	56.5	0	0	0	110.9	V161 T162 M163 K164 K166	D159-V161 PolarHBondContact O-N 2.86Å; D159-T162 WeakPolarHBondContact OD2-CB 3.32Å; D159-T162 WeakPolarHBondContact OD2-CG2 3.47Å; D159-T162 PolarHBondContact OD2-N 3.42Å; D159-T162 PolarHBondContact OD2-OG1 3.34Å; D159-M163 VanDerWaalsContact O-CA 3.31Å; D159-M163 WeakPolarHBondContact O-CA 3.3Å; D159-M163 PolarHBondContact O-N 2.99Å; D159-K164 WeakPolarHBondContact CB-O 3.49Å; D159-K164 PolarHBondContact N-O 2.82Å; D159-K166 VanDerWaalsContact CA-CE 3.45Å; D159-K166 HydrophobicContact CB-CD 4.45Å; D159-K166 HydrophobicContact CB-CG 3.92Å; D159-K166 VanDerWaalsContact OD1-CE 3.3Å; D159-K166 WeakPolarHBondContact OD1-CE 3.3Å; D159-K166 IonicContact OD1-NZ 3.74Å
160	S	77.9	Confident	83.3	Confident	121 Å²	121	65.1 Å²	65.1	85%	0.846	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-17.7	-174.9	51.4	0	0	0	0	114
161	V	79.1	Confident	83.5	Confident	128 Å²	128	64.3 Å²	64.3	78%	0.776	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-43.4	-180	-179.1	0	0	0	0	111.4	D159	D159-V161 PolarHBondContact O-N 2.86Å
162	T	76.8	Confident	83.4	Confident	68 Å²	68	64.7 Å²	64.7	42%	0.417	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	-6.7	-175.2	63	0	0	0	0	114.7	D159 K164	D159-T162 WeakPolarHBondContact OD2-CB 3.32Å; D159-T162 WeakPolarHBondContact OD2-CG2 3.47Å; D159-T162 PolarHBondContact OD2-N 3.42Å; D159-T162 PolarHBondContact OD2-OG1 3.34Å; T162-K164 WeakPolarHBondContact O-CG 3.38Å; T162-K164 PolarHBondContact O-N 2.85Å; T162-K164 PolarHBondContact O-NZ 3.41Å
163	M	73.9	Confident	83.5	Confident	172 Å²	172	58.4 Å²	58.4	85%	0.847	31%	0.306	S	S	*	.	S	Bend	trans	59.9	20.3	-177.1	-133.2	179.2	-164.9	0	0	115	D159	D159-M163 VanDerWaalsContact O-CA 3.31Å; D159-M163 WeakPolarHBondContact O-CA 3.3Å; D159-M163 PolarHBondContact O-N 2.99Å
164	K	75.6	Confident	83.5	Confident	111 Å²	111	60.4 Å²	60.4	48%	0.483	31%	0.313	S	S	.	.	S	Bend	trans	-109.8	156.6	178.4	-32	-169.3	-163.6	-44.8	0	109.1	D159 T162	D159-K164 WeakPolarHBondContact CB-O 3.49Å; D159-K164 PolarHBondContact N-O 2.82Å; T162-K164 WeakPolarHBondContact O-CG 3.38Å; T162-K164 PolarHBondContact O-N 2.85Å; T162-K164 PolarHBondContact O-NZ 3.41Å
165	H	83.4	Confident	83.4	Confident	5 Å²	5	60.3 Å²	60.3	2%	0.023	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	147.9	170.8	64.7	91.7	0	0	0	111.3	I132 Y133 Y134 M156 S157 W158 G167	I132-H165 WeakPolarHBondContact CB-NE2 3.25Å; I132-H165 WeakPolarHBondContact CD1-CE1 3.15Å; I132-H165 VanDerWaalsContact CD1-ND1 3.27Å; I132-H165 WeakPolarHBondContact CD1-ND1 3.49Å; I132-H165 WeakPolarHBondContact CD1-NE2 3.42Å; I132-H165 WeakPolarHBondContact CG1-CE1 3.4Å; I132-H165 WeakPolarHBondContact CG1-NE2 3.39Å; I132-H165 PolarHBondContact O-NE2 3.41Å; I132-H165 VanDerWaalsContact O-NE2 3.11Å; Y133-H165 PolarHBondContact N-NE2 3.47Å; Y133-H165 PolarHBondContact O-NE2 3.41Å; Y134-H165 WeakPolarHBondContact CD1-O 3.43Å; M156-H165 HydrophobicContact CE-CB 3.8Å; S157-H165 CarbonylContact O-C 3.49Å; S157-H165 WeakPolarHBondContact O-CA 3.15Å; W158-H165 HydrophobicContact CD2-CB 4.33Å; W158-H165 HydrophobicContact CE3-CB 4.19Å; W158-H165 HydrophobicContact CZ3-CB 4.42Å; H165-G167 WeakPolarHBondContact CE1-CA 3.42Å; H165-G167 PolarHBondContact CE1-N 3.44Å; H165-G167 PolarHBondContact O-N 2.88Å
166	K	82.1	Confident	83.1	Confident	106 Å²	106	57.2 Å²	57.2	46%	0.461	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	19.9	-171.9	-65.6	-178.3	180	176.1	0	114.3	S157 W158 D159 F168	S157-K166 WeakPolarHBondContact O-CB 3.33Å; S157-K166 PolarHBondContact O-N 2.81Å; W158-K166 VanDerWaalsContact O-CE 3.24Å; W158-K166 WeakPolarHBondContact O-CE 3.47Å; D159-K166 VanDerWaalsContact CA-CE 3.45Å; D159-K166 HydrophobicContact CB-CD 4.45Å; D159-K166 HydrophobicContact CB-CG 3.92Å; D159-K166 VanDerWaalsContact OD1-CE 3.3Å; D159-K166 WeakPolarHBondContact OD1-CE 3.3Å; D159-K166 IonicContact OD1-NZ 3.74Å; K166-F168 VanDerWaalsContact C-N 3.29Å; K166-F168 HydrophobicContact CB-CD1 3.89Å; K166-F168 HydrophobicContact CB-CE1 3.56Å; K166-F168 HydrophobicContact CB-CZ 4.41Å; K166-F168 HydrophobicContact CD-CE1 4.42Å; K166-F168 WeakPolarHBondContact O-CD1 3.27Å; K166-F168 PolarHBondContact O-N 3.39Å
167	G	82.8	Confident	82.9	Confident	9 Å²	9	56.5 Å²	56.5	9%	0.093	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	73.1	14.3	-175.4	0	0	0	0	0	114.9	G130 S131 I132 H165	G130-G167 CarbonylContact C-O 3.45Å; S131-G167 PolarHBondContact N-O 2.95Å; I132-G167 WeakPolarHBondContact CG1-O 3.43Å; I132-G167 PolarHBondContact N-O 2.73Å; H165-G167 WeakPolarHBondContact CE1-CA 3.42Å; H165-G167 PolarHBondContact CE1-N 3.44Å; H165-G167 PolarHBondContact O-N 2.88Å
168	F	87.6	Confident	83	Confident	60 Å²	60	55 Å²	55	26%	0.263	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	155.9	173.7	68.7	-87.8	0	0	0	114.1	Y128 V129 S157 K166 F170	Y128-F168 HydrophobicContact CE2-CB 3.71Å; Y128-F168 AromaticContact CE2-CD2 3.97Å; Y128-F168 HydrophobicContact CE2-CD2 3.97Å; Y128-F168 HydrophobicContact CE2-CG 4.07Å; V129-F168 CarbonylContact O-C 3.59Å; V129-F168 VanDerWaalsContact O-CA 3.32Å; V129-F168 WeakPolarHBondContact O-CA 3.5Å; S157-F168 PolarHBondContact N-O 3.17Å; S157-F168 WeakPolarHBondContact OG-CE2 3.47Å; K166-F168 VanDerWaalsContact C-N 3.29Å; K166-F168 HydrophobicContact CB-CD1 3.89Å; K166-F168 HydrophobicContact CB-CE1 3.56Å; K166-F168 HydrophobicContact CB-CZ 4.41Å; K166-F168 HydrophobicContact CD-CE1 4.42Å; K166-F168 WeakPolarHBondContact O-CD1 3.27Å; K166-F168 PolarHBondContact O-N 3.39Å; F168-F170 HydrophobicContact CD2-CE2 4.21Å; F168-F170 HydrophobicContact CE2-CE2 4.07Å
169	A	88.1	Confident	83.2	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	163.8	174.7	0	0	0	0	0	110.6	V129 I132 I141 I154 D155 M156	V129-A169 PolarHBondContact N-O 3.38Å; V129-A169 PolarHBondContact O-N 3.01Å; I132-A169 HydrophobicContact CD1-CB 4.3Å; I141-A169 HydrophobicContact CD1-CB 4.2Å; I154-A169 HydrophobicContact CG2-CB 4.42Å; D155-A169 CarbonylContact O-C 3.37Å; D155-A169 WeakPolarHBondContact O-CA 3.36Å; M156-A169 HydrophobicContact CG-CB 3.98Å
170	F	89.3	Confident	83.2	Confident	45 Å²	45	49.3 Å²	49.3	20%	0.197	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	138.2	163.6	-55.7	-92.1	0	0	0	109.6	R126 V127 Y128 I154 D155 F168 P201	R126-F170 HydrophobicContact CG-CB 4.39Å; R126-F170 VanDerWaalsContact NH2-CG 3.33Å; V127-F170 CarbonylContact O-C 3.6Å; V127-F170 VanDerWaalsContact O-CA 3.27Å; V127-F170 WeakPolarHBondContact O-CA 3.41Å; Y128-F170 HydrophobicContact CD2-CD1 4.1Å; Y128-F170 AromaticContact CD2-CE1 3.67Å; Y128-F170 HydrophobicContact CD2-CE1 3.67Å; Y128-F170 HydrophobicContact CD2-CZ 4.1Å; Y128-F170 HydrophobicContact CG-CE1 4.42Å; I154-F170 CarbonylContact C-O 3.57Å; I154-F170 WeakPolarHBondContact CA-O 3.42Å; D155-F170 HydrophobicContact CB-CB 4.25Å; D155-F170 HydrophobicContact CB-CD2 4.34Å; D155-F170 PolarHBondContact N-O 3.5Å; D155-F170 PolarHBondContact O-N 3.45Å; F168-F170 HydrophobicContact CD2-CE2 4.21Å; F168-F170 HydrophobicContact CE2-CE2 4.07Å; F170-P201 HydrophobicContact CD1-CB 4.48Å; F170-P201 HydrophobicContact CE1-CB 4.2Å
171	V	89.5	Confident	83.5	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	122	175.8	179.9	0	0	0	0	107.5	R126 V127 V129 I141 F145 I151 I154 Y173	R126-V171 WeakPolarHBondContact CA-O 3.24Å; V127-V171 HydrophobicContact CB-CB 4.46Å; V127-V171 PolarHBondContact N-O 3.11Å; V127-V171 PolarHBondContact O-N 2.87Å; V129-V171 HydrophobicContact CG2-CG2 3.95Å; I141-V171 HydrophobicContact CG2-CG2 4.16Å; F145-V171 HydrophobicContact CD1-CG2 4.33Å; I151-V171 HydrophobicContact CD1-CG1 4.33Å; I151-V171 HydrophobicContact CG1-CG1 4.15Å; I151-V171 HydrophobicContact CG2-CG1 3.82Å; I154-V171 HydrophobicContact CG1-CG1 4.48Å; I154-V171 HydrophobicContact CG1-CG2 4.41Å; I154-V171 HydrophobicContact CG2-CG2 4.29Å; V171-Y173 HydrophobicContact CG1-CD2 4.1Å; V171-Y173 HydrophobicContact CG1-CE2 3.85Å
172	E	87	Confident	83.8	Confident	38 Å²	38	37.8 Å²	37.8	18%	0.178	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	118.7	171	-167.7	173.5	136.7	0	0	108.8	C125 K152 S153	C125-E172 HydrophobicContact CB-CG 4.45Å; K152-E172 WeakPolarHBondContact CA-O 3.45Å; K152-E172 WeakPolarHBondContact CB-O 3.35Å; K152-E172 HydrophobicContact CD-CG 4.41Å; K152-E172 WeakPolarHBondContact CD-OE1 3.35Å; K152-E172 WeakPolarHBondContact CE-OE1 3.49Å; K152-E172 PolarHBondContact N-O 3.37Å; K152-E172 IonicContact NZ-OE1 3.76Å; K152-E172 PolarHBondContact NZ-OE1 3.12Å; S153-E172 PolarHBondContact N-O 2.92Å; S153-E172 PolarHBondContact O-N 3.36Å
173	Y	88.7	Confident	84.3	Confident	1 Å²	1	36.2 Å²	36.2	0%	0.004	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	151.1	172.7	-77.4	-84.1	0	0	0	111.6	C125 V127 F145 F148 I151 V171 V175 A178 A179 A182	C125-Y173 VanDerWaalsContact CB-O 3.28Å; C125-Y173 WeakPolarHBondContact CB-O 3.38Å; C125-Y173 PolarHBondContact O-N 3.23Å; C125-Y173 PolarHBondContact SG-O 3.07Å; C125-Y173 VanDerWaalsContact SG-O 3.4Å; V127-Y173 HydrophobicContact CG2-CD2 4.02Å; V127-Y173 HydrophobicContact CG2-CE2 3.99Å; F145-Y173 WeakPolarHBondContact CB-OH 3.12Å; F145-Y173 HydrophobicContact CD1-CE2 4.43Å; F145-Y173 WeakPolarHBondContact CD1-OH 3.34Å; F145-Y173 PolarHBondContact O-OH 2.95Å; F145-Y173 VanDerWaalsContact O-OH 3.11Å; F148-Y173 HydrophobicContact CB-CE1 4.36Å; I151-Y173 HydrophobicContact CG1-CD1 4.11Å; I151-Y173 HydrophobicContact CG1-CE1 3.74Å; V171-Y173 HydrophobicContact CG1-CD2 4.1Å; V171-Y173 HydrophobicContact CG1-CE2 3.85Å; Y173-V175 WeakPolarHBondContact CB-O 3.33Å; Y173-V175 PolarHBondContact O-N 2.88Å; Y173-A178 HydrophobicContact CD1-CB 3.5Å; Y173-A178 VanDerWaalsContact CD1-CB 3.5Å; Y173-A178 HydrophobicContact CE1-CB 3.8Å; Y173-A178 HydrophobicContact CG-CB 3.9Å; Y173-A179 HydrophobicContact CD2-CB 3.77Å; Y173-A179 HydrophobicContact CE2-CB 4.45Å; Y173-A179 HydrophobicContact CG-CB 4.43Å; Y173-A182 HydrophobicContact CE2-CB 4.05Å; Y173-A182 WeakPolarHBondContact OH-CB 3.42Å
174	D	84.4	Confident	84.7	Confident	88 Å²	88	34 Å²	34	47%	0.471	16%	0.163	S	C	.	.	S	Bend	trans	-68.3	-25.7	168.5	-152.7	23	0	0	0	110.9	P150 R263	P150-D174 HydrophobicContact CB-CB 4.01Å; P150-D174 HydrophobicContact CG-CB 3.79Å; P150-D174 WeakPolarHBondContact O-CB 3.49Å; P150-D174 PolarHBondContact O-N 3.48Å; D174-R263 IonicContact OD2-NH1 3.94Å
175	V	84.6	Confident	85.1	Confident	13 Å²	13	30.6 Å²	30.6	8%	0.079	15%	0.149	C	C	.	.	S	Bend	trans	-126.6	120.5	-172.2	179.2	0	0	0	0	110.1	P150 Y173 E177 A178 Y225 F265 F267	P150-V175 HydrophobicContact CG-CG2 3.95Å; Y173-V175 WeakPolarHBondContact CB-O 3.33Å; Y173-V175 PolarHBondContact O-N 2.88Å; V175-E177 VanDerWaalsContact C-N 3.27Å; V175-E177 HydrophobicContact CG1-CB 3.94Å; V175-E177 HydrophobicContact CG1-CG 4.48Å; V175-E177 WeakPolarHBondContact CG1-OE2 3.42Å; V175-E177 PolarHBondContact O-N 2.98Å; V175-A178 HydrophobicContact CB-CB 4.38Å; V175-A178 WeakPolarHBondContact O-CB 3.42Å; V175-A178 PolarHBondContact O-N 2.85Å; V175-Y225 HydrophobicContact CG1-CD2 4.16Å; V175-Y225 HydrophobicContact CG1-CE2 3.8Å; V175-F265 HydrophobicContact CG2-CE2 4.3Å; V175-F267 HydrophobicContact CG1-CZ 4.2Å
176	P	80.6	Confident	85.1	Confident	11 Å²	11	31.4 Å²	31.4	7%	0.071	15%	0.153	C	C	.	.	H	α-helix	trans	-68.7	-22.5	-176.7	26.3	-32.9	0	0	0	113.7	L121 M124 A178 A179 Q180	L121-P176 HydrophobicContact CD2-CG 4.02Å; M124-P176 HydrophobicContact CB-CB 3.71Å; M124-P176 HydrophobicContact SD-CB 4.47Å; P176-A178 VanDerWaalsContact C-N 3.34Å; P176-A179 WeakPolarHBondContact O-CB 3.29Å; P176-A179 PolarHBondContact O-N 3.16Å; P176-Q180 PolarHBondContact O-N 3.27Å; P176-Q180 VanDerWaalsContact O-N 3.09Å
177	E	83.1	Confident	85.3	Confident	1 Å²	1	30.1 Å²	30.1	1%	0.005	15%	0.151	C	C	.	.	H	α-helix	trans	-62.3	-40.1	171.6	-66.8	81.5	170.6	0	0	112.2	V175 A179 Q180 L181 Y225 A298 V299 T300	V175-E177 VanDerWaalsContact C-N 3.27Å; V175-E177 HydrophobicContact CG1-CB 3.94Å; V175-E177 HydrophobicContact CG1-CG 4.48Å; V175-E177 WeakPolarHBondContact CG1-OE2 3.42Å; V175-E177 PolarHBondContact O-N 2.98Å; E177-A179 VanDerWaalsContact C-N 3.3Å; E177-A179 PolarHBondContact O-N 2.83Å; E177-Q180 PolarHBondContact O-N 2.94Å; E177-L181 PolarHBondContact O-N 3.31Å; E177-Y225 HydrophobicContact CB-CD1 3.5Å; E177-Y225 HydrophobicContact CB-CD2 4.28Å; E177-Y225 HydrophobicContact CB-CE1 4.16Å; E177-Y225 HydrophobicContact CB-CG 3.57Å; E177-Y225 HydrophobicContact CG-CG 4.14Å; E177-A298 HydrophobicContact CG-CB 4.45Å; E177-V299 PolarHBondContact OE1-N 3.41Å; E177-T300 VanDerWaalsContact OE1-CB 3.25Å; E177-T300 WeakPolarHBondContact OE1-CB 3.03Å; E177-T300 PolarHBondContact OE1-N 3.42Å; E177-T300 PolarHBondContact OE1-OG1 3.1Å; E177-T300 PolarHBondContact OE2-OG1 3.34Å
178	A	85.2	Confident	85.4	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-64	-38.2	176	0	0	0	0	0	111.4	F148 Y173 V175 P176 L181 A182 Y225	F148-A178 WeakPolarHBondContact O-CB 3.26Å; Y173-A178 HydrophobicContact CD1-CB 3.5Å; Y173-A178 VanDerWaalsContact CD1-CB 3.5Å; Y173-A178 HydrophobicContact CE1-CB 3.8Å; Y173-A178 HydrophobicContact CG-CB 3.9Å; V175-A178 HydrophobicContact CB-CB 4.38Å; V175-A178 WeakPolarHBondContact O-CB 3.42Å; V175-A178 PolarHBondContact O-N 2.85Å; P176-A178 VanDerWaalsContact C-N 3.34Å; A178-L181 PolarHBondContact O-N 3.38Å; A178-A182 VanDerWaalsContact O-CB 3.3Å; A178-A182 WeakPolarHBondContact O-CB 3.43Å; A178-A182 PolarHBondContact O-N 3.27Å; A178-Y225 HydrophobicContact CB-CE1 4.1Å
179	A	84.4	Confident	85.3	Confident	4 Å²	4	32.2 Å²	32.2	3%	0.033	17%	0.17	C	C	.	.	H	α-helix	trans	-63.2	-41.6	174.6	0	0	0	0	0	112.4	M124 V127 Y173 P176 E177 L183	M124-A179 VanDerWaalsContact O-CB 3.29Å; M124-A179 WeakPolarHBondContact O-CB 3.28Å; V127-A179 HydrophobicContact CG2-CB 3.48Å; V127-A179 VanDerWaalsContact CG2-CB 3.48Å; Y173-A179 HydrophobicContact CD2-CB 3.77Å; Y173-A179 HydrophobicContact CE2-CB 4.45Å; Y173-A179 HydrophobicContact CG-CB 4.43Å; P176-A179 WeakPolarHBondContact O-CB 3.29Å; P176-A179 PolarHBondContact O-N 3.16Å; E177-A179 VanDerWaalsContact C-N 3.3Å; E177-A179 PolarHBondContact O-N 2.83Å; A179-L183 WeakPolarHBondContact O-CB 3.26Å; A179-L183 PolarHBondContact O-N 2.84Å
180	Q	83.2	Confident	85.1	Confident	54 Å²	54	39 Å²	39	25%	0.252	20%	0.203	S	C	.	.	H	α-helix	trans	-70.1	-41.3	176.6	-174.8	63.7	30.1	0	0	112.3	P176 E177 L183 E184	P176-Q180 PolarHBondContact O-N 3.27Å; P176-Q180 VanDerWaalsContact O-N 3.09Å; E177-Q180 PolarHBondContact O-N 2.94Å; Q180-L183 WeakPolarHBondContact O-CB 3.48Å; Q180-L183 PolarHBondContact O-N 3.41Å; Q180-E184 PolarHBondContact NE2-OE1 2.91Å; Q180-E184 PolarHBondContact O-N 2.77Å; Q180-E184 VanDerWaalsContact O-N 3.1Å
181	L	83.8	Confident	84.8	Confident	7 Å²	7	38 Å²	38	4%	0.037	20%	0.199	C	C	.	.	H	α-helix	trans	-63.8	-41.3	174.8	-78.1	177.4	0	0	0	112.4	F148 E177 A178 L183 E184 Q185 Y225	F148-L181 HydrophobicContact CD1-CB 4.13Å; E177-L181 PolarHBondContact O-N 3.31Å; A178-L181 PolarHBondContact O-N 3.38Å; L181-L183 VanDerWaalsContact C-N 3.33Å; L181-L183 PolarHBondContact O-N 2.79Å; L181-E184 PolarHBondContact O-N 2.9Å; L181-Q185 WeakPolarHBondContact O-CB 3.47Å; L181-Q185 WeakPolarHBondContact O-CG 3.28Å; L181-Q185 PolarHBondContact O-N 3.01Å; L181-Y225 HydrophobicContact CD1-CD1 3.77Å; L181-Y225 HydrophobicContact CD1-CE1 4.04Å
182	A	86.2	Confident	84.1	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-63.9	-38.2	173.8	0	0	0	0	0	111.7	F145 F148 Y173 A178 E184 M186	F145-A182 HydrophobicContact CD1-CB 4.17Å; F145-A182 HydrophobicContact CE1-CB 4.2Å; F148-A182 HydrophobicContact CB-CB 4.26Å; F148-A182 HydrophobicContact CD1-CB 4.38Å; F148-A182 HydrophobicContact CD2-CB 4.42Å; F148-A182 HydrophobicContact CG-CB 4.07Å; Y173-A182 HydrophobicContact CE2-CB 4.05Å; Y173-A182 WeakPolarHBondContact OH-CB 3.42Å; A178-A182 VanDerWaalsContact O-CB 3.3Å; A178-A182 WeakPolarHBondContact O-CB 3.43Å; A178-A182 PolarHBondContact O-N 3.27Å; A182-E184 VanDerWaalsContact C-N 3.32Å; A182-E184 PolarHBondContact O-N 2.83Å; A182-M186 WeakPolarHBondContact O-CA 3.49Å; A182-M186 VanDerWaalsContact O-CB 3.29Å; A182-M186 WeakPolarHBondContact O-CB 3.44Å; A182-M186 PolarHBondContact O-N 3.48Å
183	L	86.1	Confident	83.9	Confident	35 Å²	35	41.8 Å²	41.8	18%	0.183	25%	0.249	C	C	.	.	H	α-helix	trans	-60.6	-39.4	175.1	177.9	61.6	0	0	0	112.7	A179 Q180 L181 N187 V198 G199 R200	A179-L183 WeakPolarHBondContact O-CB 3.26Å; A179-L183 PolarHBondContact O-N 2.84Å; Q180-L183 WeakPolarHBondContact O-CB 3.48Å; Q180-L183 PolarHBondContact O-N 3.41Å; L181-L183 VanDerWaalsContact C-N 3.33Å; L181-L183 PolarHBondContact O-N 2.79Å; L183-N187 WeakPolarHBondContact O-CB 3.34Å; L183-V198 HydrophobicContact CB-CG1 4.48Å; L183-V198 HydrophobicContact CD1-CB 4.46Å; L183-V198 HydrophobicContact CD1-CG1 4.11Å; L183-V198 WeakPolarHBondContact CD1-O 3.28Å; L183-G199 VanDerWaalsContact CD1-CA 3.46Å; L183-R200 HydrophobicContact CD2-CG 3.88Å
184	E	82.9	Confident	83.7	Confident	126 Å²	126	46.6 Å²	46.6	59%	0.589	27%	0.267	S	S	*	.	H	α-helix	trans	-80.2	-36.8	-179.7	-70.5	171.4	-162.6	0	0	112.8	Q180 L181 A182	Q180-E184 PolarHBondContact NE2-OE1 2.91Å; Q180-E184 PolarHBondContact O-N 2.77Å; Q180-E184 VanDerWaalsContact O-N 3.1Å; L181-E184 PolarHBondContact O-N 2.9Å; A182-E184 VanDerWaalsContact C-N 3.32Å; A182-E184 PolarHBondContact O-N 2.83Å
185	Q	83.3	Confident	83.8	Confident	39 Å²	39	46.3 Å²	46.3	18%	0.182	27%	0.266	C	S	.	.	H	α-helix	trans	-105.7	-21.7	-169.7	-59.3	-173.3	18.9	0	0	115.7	F148 L181 V189 N284	F148-Q185 HydrophobicContact CE1-CB 3.64Å; F148-Q185 HydrophobicContact CE1-CG 4.33Å; F148-Q185 HydrophobicContact CZ-CB 4.06Å; L181-Q185 WeakPolarHBondContact O-CB 3.47Å; L181-Q185 WeakPolarHBondContact O-CG 3.28Å; L181-Q185 PolarHBondContact O-N 3.01Å; Q185-V189 WeakPolarHBondContact O-CG2 3.47Å; Q185-N284 PolarHBondContact NE2-ND2 3.22Å; Q185-N284 VanDerWaalsContact NE2-ND2 3.11Å; Q185-N284 PolarHBondContact NE2-OD1 3.37Å
186	M	84.1	Confident	84.1	Confident	22 Å²	22	45.8 Å²	45.8	11%	0.108	26%	0.262	C	S	.	.	S	Bend	trans	-95	-10	174.2	-76.9	-74.9	114.1	0	0	113.3	F145 F148 A182 S188 V189 I196 V198	F145-M186 HydrophobicContact CE1-CB 4.23Å; F145-M186 HydrophobicContact CE1-CG 4.32Å; F145-M186 HydrophobicContact CE2-CB 4.45Å; F145-M186 HydrophobicContact CE2-CG 4.26Å; F145-M186 HydrophobicContact CE2-SD 4.35Å; F145-M186 HydrophobicContact CZ-CB 3.88Å; F145-M186 HydrophobicContact CZ-CG 4.07Å; F148-M186 HydrophobicContact CD2-CG 4.2Å; F148-M186 HydrophobicContact CE2-CE 3.69Å; F148-M186 HydrophobicContact CE2-CG 3.39Å; F148-M186 HydrophobicContact CE2-SD 3.98Å; F148-M186 HydrophobicContact CZ-CE 3.63Å; F148-M186 HydrophobicContact CZ-CG 3.63Å; F148-M186 HydrophobicContact CZ-SD 4.35Å; A182-M186 WeakPolarHBondContact O-CA 3.49Å; A182-M186 VanDerWaalsContact O-CB 3.29Å; A182-M186 WeakPolarHBondContact O-CB 3.44Å; A182-M186 PolarHBondContact O-N 3.48Å; M186-S188 PolarHBondContact O-N 3.36Å; M186-V189 HydrophobicContact CE-CB 4.44Å; M186-V189 HydrophobicContact CE-CG1 4.21Å; M186-V189 HydrophobicContact CE-CG2 3.85Å; M186-V189 WeakPolarHBondContact O-CB 3.25Å; M186-V189 PolarHBondContact O-N 2.97Å; M186-V189 HydrophobicContact SD-CB 4.27Å; M186-V189 HydrophobicContact SD-CG1 4.17Å; M186-V189 HydrophobicContact SD-CG2 4.17Å; M186-I196 HydrophobicContact CB-CD1 4.24Å; M186-I196 WeakPolarHBondContact O-CD1 3.46Å; M186-I196 WeakPolarHBondContact O-CG1 3.45Å; M186-V198 HydrophobicContact CB-CG2 3.85Å; M186-V198 WeakPolarHBondContact O-CG2 3.48Å
187	N	86.7	Confident	84.3	Confident	80 Å²	80	51.9 Å²	51.9	43%	0.428	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	129.2	175.9	-177.3	24.1	0	0	0	111.2	L183 V189 V198	L183-N187 WeakPolarHBondContact O-CB 3.34Å; N187-V189 PolarHBondContact O-N 3.22Å; N187-V198 HydrophobicContact CB-CB 4.24Å
188	S	84	Confident	84.5	Confident	68 Å²	68	52.4 Å²	52.4	48%	0.476	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.9	8.7	-176.9	-53	0	0	0	0	116.4	M186 N195 I196	M186-S188 PolarHBondContact O-N 3.36Å; S188-N195 PolarHBondContact O-ND2 3.31Å; S188-I196 WeakPolarHBondContact CA-O 3.47Å; S188-I196 PolarHBondContact N-O 2.99Å
189	V	85.7	Confident	84.5	Confident	45 Å²	45	53.3 Å²	53.3	27%	0.273	30%	0.301	S	S	.	.			trans	-62.3	140.8	171.7	168.9	0	0	0	0	110.9	Q185 M186 N187 L191 N195 I196	Q185-V189 WeakPolarHBondContact O-CG2 3.47Å; M186-V189 HydrophobicContact CE-CB 4.44Å; M186-V189 HydrophobicContact CE-CG1 4.21Å; M186-V189 HydrophobicContact CE-CG2 3.85Å; M186-V189 WeakPolarHBondContact O-CB 3.25Å; M186-V189 PolarHBondContact O-N 2.97Å; M186-V189 HydrophobicContact SD-CB 4.27Å; M186-V189 HydrophobicContact SD-CG1 4.17Å; M186-V189 HydrophobicContact SD-CG2 4.17Å; N187-V189 PolarHBondContact O-N 3.22Å; V189-L191 HydrophobicContact CG1-CD1 4.27Å; V189-L191 HydrophobicContact CG1-CG 4.48Å; V189-N195 CarbonylContact O-C 3.57Å; V189-N195 WeakPolarHBondContact O-CA 3.47Å; V189-I196 HydrophobicContact CB-CG1 4.29Å; V189-I196 WeakPolarHBondContact O-CG1 3.44Å; V189-I196 PolarHBondContact O-N 3.36Å
190	M	83.9	Confident	84.2	Confident	142 Å²	142	58.2 Å²	58.2	70%	0.7	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.8	116.8	176.3	-67.3	-168.5	-64.4	0	0	111	R194 N195	M190-R194 WeakPolarHBondContact CA-O 3.39Å; M190-N195 WeakPolarHBondContact CG-ND2 3.35Å
191	L	82.9	Confident	83.4	Confident	23 Å²	23	56 Å²	56	12%	0.12	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	124.1	176.8	-92.7	151.1	0	0	0	108.7	L136 T140 A144 V189 G193 R194 I196	L136-L191 HydrophobicContact CD2-CB 4.11Å; L136-L191 HydrophobicContact CD2-CD2 4.34Å; T140-L191 HydrophobicContact CG2-CD2 4.31Å; A144-L191 HydrophobicContact CB-CD1 4.12Å; A144-L191 HydrophobicContact CB-CD2 4.14Å; V189-L191 HydrophobicContact CG1-CD1 4.27Å; V189-L191 HydrophobicContact CG1-CG 4.48Å; L191-G193 VanDerWaalsContact C-N 3.28Å; L191-G193 PolarHBondContact O-N 3.42Å; L191-R194 PolarHBondContact N-O 3.43Å; L191-R194 PolarHBondContact O-N 3.43Å; L191-R194 VanDerWaalsContact O-O 3.06Å; L191-I196 HydrophobicContact CB-CG2 4Å; L191-I196 HydrophobicContact CD1-CD1 3.63Å; L191-I196 HydrophobicContact CD1-CG1 4.08Å; L191-I196 HydrophobicContact CD1-CG2 4.26Å
192	G	75.1	Confident	81.9	Confident	38 Å²	38	61.9 Å²	61.9	39%	0.392	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.7	35.9	-173.9	0	0	0	0	0	113.7	Y133 R194	Y133-G192 WeakPolarHBondContact CB-O 3.27Å; Y133-G192 WeakPolarHBondContact CD2-O 3.49Å; G192-R194 PolarHBondContact O-N 2.84Å
193	G	82.3	Confident	80.5	Confident	80 Å²	80	68.3 Å²	68.3	83%	0.825	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.5	8.6	-178.6	0	0	0	0	0	115.4	L191	L191-G193 VanDerWaalsContact C-N 3.28Å; L191-G193 PolarHBondContact O-N 3.42Å
194	R	84.4	Confident	79.1	Confident	102 Å²	102	67.5 Å²	67.5	39%	0.385	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	140.5	177.9	-159.1	174	-162.4	171.9	8.4	110.8	S131 M190 L191 G192 I196	S131-R194 WeakPolarHBondContact O-CD 3.13Å; M190-R194 WeakPolarHBondContact CA-O 3.39Å; L191-R194 PolarHBondContact N-O 3.43Å; L191-R194 PolarHBondContact O-N 3.43Å; L191-R194 VanDerWaalsContact O-O 3.06Å; G192-R194 PolarHBondContact O-N 2.84Å; R194-I196 PolarHBondContact O-N 2.94Å
195	N	87.6	Confident	77.6	Confident	83 Å²	83	64.4 Å²	64.4	44%	0.444	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	123	171.3	-55	86.4	0	0	0	109.6	S131 S188 V189 M190	S131-N195 VanDerWaalsContact CB-O 3.28Å; S131-N195 WeakPolarHBondContact CB-O 3.34Å; S131-N195 PolarHBondContact OG-O 3.38Å; S188-N195 PolarHBondContact O-ND2 3.31Å; V189-N195 CarbonylContact O-C 3.57Å; V189-N195 WeakPolarHBondContact O-CA 3.47Å; M190-N195 WeakPolarHBondContact CG-ND2 3.35Å
196	I	89.6	Confident	76.1	Confident	1 Å²	1	71.2 Å²	71.2	1%	0.005	41%	0.414	C	S	.	.			trans	-77.6	149.4	172.2	56.4	157.7	0	0	0	110.9	V129 G130 I132 F145 M186 S188 V189 L191 R194 V198	V129-I196 HydrophobicContact CG1-CB 4.38Å; V129-I196 HydrophobicContact CG1-CD1 4.09Å; G130-I196 WeakPolarHBondContact O-CA 3.42Å; I132-I196 HydrophobicContact CG2-CG2 3.69Å; F145-I196 HydrophobicContact CE2-CD1 3.9Å; F145-I196 HydrophobicContact CZ-CD1 3.84Å; M186-I196 HydrophobicContact CB-CD1 4.24Å; M186-I196 WeakPolarHBondContact O-CD1 3.46Å; M186-I196 WeakPolarHBondContact O-CG1 3.45Å; S188-I196 WeakPolarHBondContact CA-O 3.47Å; S188-I196 PolarHBondContact N-O 2.99Å; V189-I196 HydrophobicContact CB-CG1 4.29Å; V189-I196 WeakPolarHBondContact O-CG1 3.44Å; V189-I196 PolarHBondContact O-N 3.36Å; L191-I196 HydrophobicContact CB-CG2 4Å; L191-I196 HydrophobicContact CD1-CD1 3.63Å; L191-I196 HydrophobicContact CD1-CG1 4.08Å; L191-I196 HydrophobicContact CD1-CG2 4.26Å; R194-I196 PolarHBondContact O-N 2.94Å; I196-V198 HydrophobicContact CD1-CG2 3.82Å; I196-V198 HydrophobicContact CG1-CG2 4.41Å
197	K	86.4	Confident	74.6	Confident	139 Å²	139	70.7 Å²	70.7	60%	0.604	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.3	107.5	176.7	-70.1	-172.3	175.7	-175.5	0	108.8	G130	G130-K197 PolarHBondContact N-O 3.03Å; G130-K197 PolarHBondContact O-N 2.77Å
198	V	87.6	Confident	73.3	Confident	12 Å²	12	72 Å²	72	7%	0.073	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	136.5	179	-169.3	0	0	0	0	108.8	V127 Y128 F145 L183 M186 N187 I196	V127-V198 HydrophobicContact CG1-CG1 3.3Å; Y128-V198 CarbonylContact O-C 3.57Å; Y128-V198 WeakPolarHBondContact O-CA 3.33Å; F145-V198 HydrophobicContact CZ-CG2 4.12Å; L183-V198 HydrophobicContact CB-CG1 4.48Å; L183-V198 HydrophobicContact CD1-CB 4.46Å; L183-V198 HydrophobicContact CD1-CG1 4.11Å; L183-V198 WeakPolarHBondContact CD1-O 3.28Å; M186-V198 HydrophobicContact CB-CG2 3.85Å; M186-V198 WeakPolarHBondContact O-CG2 3.48Å; N187-V198 HydrophobicContact CB-CB 4.24Å; I196-V198 HydrophobicContact CD1-CG2 3.82Å; I196-V198 HydrophobicContact CG1-CG2 4.41Å
199	G	83.5	Confident	72.1	Confident	20 Å²	20	72.9 Å²	72.9	21%	0.206	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	166.5	-174.4	0	0	0	0	0	113.3	Y128 L183	Y128-G199 PolarHBondContact N-O 3.12Å; Y128-G199 PolarHBondContact O-N 3.3Å; L183-G199 VanDerWaalsContact CD1-CA 3.46Å
200	R	77.9	Confident	71	Confident	106 Å²	106	73.1 Å²	73.1	40%	0.4	42%	0.42	S	S	.	.			trans	-79.4	139.6	165.2	-64.3	-175.2	179.8	174.8	-1.3	109.4	L183 S202 I204	L183-R200 HydrophobicContact CD2-CG 3.88Å; R200-S202 PolarHBondContact O-N 3.47Å; R200-I204 HydrophobicContact CB-CD1 4.42Å
201	P	66.5	Low	70.2	Confident	9 Å²	9	66.6 Å²	66.6	6%	0.058	39%	0.388	C	S	.	.			trans	-64.3	133.5	-177.3	22.9	-31.7	0	0	0	111.9	R126 F170 N203 I204	R126-P201 HydrophobicContact CB-CG 4.38Å; R126-P201 HydrophobicContact CG-CG 4.36Å; R126-P201 WeakPolarHBondContact O-CD 3.08Å; F170-P201 HydrophobicContact CD1-CB 4.48Å; F170-P201 HydrophobicContact CE1-CB 4.2Å; P201-N203 PolarHBondContact O-N 3.05Å; P201-N203 PolarHBondContact O-OD1 3.4Å; P201-I204 HydrophobicContact CG-CD1 3.71Å; P201-I204 WeakPolarHBondContact O-CB 3.4Å; P201-I204 WeakPolarHBondContact O-CD1 3.35Å; P201-I204 PolarHBondContact O-N 3.35Å
202	S	54	Low	69.4	Low	130 Å²	130	69.4 Å²	69.4	91%	0.909	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-71.2	-0.4	-164	-47.2	0	0	0	0	116.2	R200 I204	R200-S202 PolarHBondContact O-N 3.47Å; S202-I204 PolarHBondContact O-N 3.07Å
203	N	55.6	Low	68.9	Low	135 Å²	135	74.5 Å²	74.5	72%	0.722	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-77.8	-1.1	171	65.8	-8.7	0	0	0	113.4	P201 G205	P201-N203 PolarHBondContact O-N 3.05Å; P201-N203 PolarHBondContact O-OD1 3.4Å; N203-G205 PolarHBondContact O-N 3.29Å
204	I	56.4	Low	68.2	Low	18 Å²	18	71.1 Å²	71.1	9%	0.092	38%	0.38	C	S	.	.	G	3₁₀ helix	trans	-59.2	-12.4	-179.2	-109.5	88.3	0	0	0	115.5	I123 R200 P201 S202 Q206 A207 Q208 I211	I123-I204 HydrophobicContact CG2-CD1 3.34Å; I123-I204 HydrophobicContact CG2-CG1 3.57Å; R200-I204 HydrophobicContact CB-CD1 4.42Å; P201-I204 HydrophobicContact CG-CD1 3.71Å; P201-I204 WeakPolarHBondContact O-CB 3.4Å; P201-I204 WeakPolarHBondContact O-CD1 3.35Å; P201-I204 PolarHBondContact O-N 3.35Å; S202-I204 PolarHBondContact O-N 3.07Å; I204-Q206 PolarHBondContact O-N 3.24Å; I204-A207 WeakPolarHBondContact O-CA 3.5Å; I204-A207 PolarHBondContact O-N 3Å; I204-Q208 HydrophobicContact CG2-CG 3.46Å; I204-Q208 VanDerWaalsContact CG2-CG 3.46Å; I204-Q208 PolarHBondContact O-N 3.22Å; I204-I211 HydrophobicContact CG1-CD1 3.85Å
205	G	52.5	Low	67.3	Low	60 Å²	60	67.3 Å²	67.3	62%	0.619	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-60.8	-15.5	-167.3	0	0	0	0	0	117.3	N203	N203-G205 PolarHBondContact O-N 3.29Å
206	Q	52.1	Low	66.3	Low	182 Å²	182	68.4 Å²	68.4	85%	0.85	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-93.6	-10.9	171.8	-69.1	-80.3	-54.5	0	0	113.2	I204	I204-Q206 PolarHBondContact O-N 3.24Å
207	A	50.8	Low	65	Low	12 Å²	12	72.4 Å²	72.4	10%	0.099	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.2	-16.4	-167.4	0	0	0	0	0	114.7	I123 I204 I210 I211	I123-A207 HydrophobicContact CD1-CB 4.32Å; I204-A207 WeakPolarHBondContact O-CA 3.5Å; I204-A207 PolarHBondContact O-N 3Å; A207-I210 PolarHBondContact O-N 3.19Å; A207-I211 HydrophobicContact CB-CD1 3.91Å; A207-I211 HydrophobicContact CB-CG1 4.48Å; A207-I211 WeakPolarHBondContact O-CG1 3.38Å; A207-I211 PolarHBondContact O-N 2.83Å
208	Q	60.2	Low	63.8	Low	106 Å²	106	65.9 Å²	65.9	50%	0.495	36%	0.363	S	S	.	.	H	α-helix	trans	-44.5	-52.8	177.4	-73.4	-165.4	-65.1	0	0	114.7	I204 I210 I211 D212	I204-Q208 HydrophobicContact CG2-CG 3.46Å; I204-Q208 VanDerWaalsContact CG2-CG 3.46Å; I204-Q208 PolarHBondContact O-N 3.22Å; Q208-I210 PolarHBondContact O-N 3.16Å; Q208-I211 WeakPolarHBondContact O-CB 3.29Å; Q208-I211 PolarHBondContact O-N 3.36Å; Q208-D212 PolarHBondContact O-N 2.85Å
209	P	58.4	Low	62.5	Low	87 Å²	87	71.4 Å²	71.4	57%	0.565	38%	0.383	S	S	*	.	H	α-helix	trans	-63.4	-29.7	-177.6	24.3	-34.7	0	0	0	113.4	Q213	P209-Q213 WeakPolarHBondContact O-CB 3.33Å; P209-Q213 PolarHBondContact O-N 3.2Å; P209-Q213 VanDerWaalsContact O-N 3.09Å
210	I	62.9	Low	61.5	Low	51 Å²	51	74.1 Å²	74.1	26%	0.262	40%	0.403	S	S	.	.	H	α-helix	trans	-76.5	-37.9	176.2	-57.9	160.5	0	0	0	110.1	Q116 A120 A207 Q208 L214	Q116-I210 HydrophobicContact CG-CD1 4.43Å; A120-I210 HydrophobicContact CB-CG2 3.84Å; A207-I210 PolarHBondContact O-N 3.19Å; Q208-I210 PolarHBondContact O-N 3.16Å; I210-L214 WeakPolarHBondContact O-CB 3.5Å; I210-L214 PolarHBondContact O-N 3.11Å
211	I	67.4	Low	60.9	Low	4 Å²	4	73.4 Å²	73.4	2%	0.021	40%	0.401	C	S	.	.	H	α-helix	trans	-64	-47.2	177	-74.9	164.5	0	0	0	110.7	I123 M124 I204 A207 Q208 L214 A215	I123-I211 HydrophobicContact CG2-CD1 3.88Å; M124-I211 HydrophobicContact CE-CB 4.12Å; M124-I211 HydrophobicContact CE-CG1 4.26Å; M124-I211 HydrophobicContact CE-CG2 3.81Å; M124-I211 WeakPolarHBondContact CE-O 3.44Å; M124-I211 HydrophobicContact CG-CG1 4.3Å; M124-I211 HydrophobicContact CG-CG2 4.39Å; I204-I211 HydrophobicContact CG1-CD1 3.85Å; A207-I211 HydrophobicContact CB-CD1 3.91Å; A207-I211 HydrophobicContact CB-CG1 4.48Å; A207-I211 WeakPolarHBondContact O-CG1 3.38Å; A207-I211 PolarHBondContact O-N 2.83Å; Q208-I211 WeakPolarHBondContact O-CB 3.29Å; Q208-I211 PolarHBondContact O-N 3.36Å; I211-L214 PolarHBondContact O-N 2.76Å; I211-A215 VanDerWaalsContact O-CB 3.31Å; I211-A215 WeakPolarHBondContact O-CB 3.48Å; I211-A215 PolarHBondContact O-N 2.87Å
212	D	65.8	Low	61.6	Low	83 Å²	83	74.2 Å²	74.2	44%	0.444	41%	0.405	S	S	.	.	H	α-helix	trans	-72.2	-39.8	-178.2	-60.8	-27.1	0	0	0	110.9	Q208 L214 A215 E216	Q208-D212 PolarHBondContact O-N 2.85Å; D212-L214 PolarHBondContact O-N 3.14Å; D212-A215 PolarHBondContact O-N 3.35Å; D212-E216 WeakPolarHBondContact O-CB 3.28Å; D212-E216 PolarHBondContact O-N 3.14Å
213	Q	65.4	Low	63.1	Low	145 Å²	145	70.6 Å²	70.6	68%	0.678	37%	0.371	S	S	*	.	H	α-helix	trans	-62.7	-41.9	173.9	-173.6	172.4	25.7	0	0	112.4	P209 E216 E217	P209-Q213 WeakPolarHBondContact O-CB 3.33Å; P209-Q213 PolarHBondContact O-N 3.2Å; P209-Q213 VanDerWaalsContact O-N 3.09Å; Q213-E216 PolarHBondContact O-N 2.82Å; Q213-E217 WeakPolarHBondContact O-CB 3.45Å; Q213-E217 PolarHBondContact O-N 2.9Å
214	L	67.8	Low	64.6	Low	8 Å²	8	64.2 Å²	64.2	4%	0.042	34%	0.337	C	S	.	.	H	α-helix	trans	-67.6	-37.5	175.7	179.7	58.9	0	0	0	112.1	R117 A120 L121 M124 I210 I211 D212 A218	R117-L214 HydrophobicContact CG-CD1 4.2Å; R117-L214 HydrophobicContact CG-CD2 4.01Å; R117-L214 VanDerWaalsContact NE-CD1 3.29Å; A120-L214 HydrophobicContact CB-CD2 4.19Å; L121-L214 HydrophobicContact CD2-CD2 3.99Å; L121-L214 HydrophobicContact CG-CD2 4.11Å; M124-L214 HydrophobicContact CE-CB 4.17Å; M124-L214 HydrophobicContact CE-CD2 3.91Å; M124-L214 HydrophobicContact CE-CG 4.16Å; M124-L214 HydrophobicContact SD-CD2 4.32Å; I210-L214 WeakPolarHBondContact O-CB 3.5Å; I210-L214 PolarHBondContact O-N 3.11Å; I211-L214 PolarHBondContact O-N 2.76Å; D212-L214 PolarHBondContact O-N 3.14Å; L214-A218 VanDerWaalsContact O-CB 3.23Å; L214-A218 WeakPolarHBondContact O-CB 3.43Å; L214-A218 PolarHBondContact O-N 3.28Å
215	A	65.6	Low	66.2	Low	22 Å²	22	63.3 Å²	63.3	18%	0.182	33%	0.333	C	S	.	.	H	α-helix	trans	-69.6	-31.4	176.5	0	0	0	0	0	112.9	I211 D212 R219 V299	I211-A215 VanDerWaalsContact O-CB 3.31Å; I211-A215 WeakPolarHBondContact O-CB 3.48Å; I211-A215 PolarHBondContact O-N 2.87Å; D212-A215 PolarHBondContact O-N 3.35Å; A215-R219 WeakPolarHBondContact O-CB 3.33Å; A215-R219 PolarHBondContact O-N 2.89Å; A215-V299 HydrophobicContact CB-CG1 4.34Å
216	E	65.8	Low	67.9	Low	106 Å²	106	60.5 Å²	60.5	50%	0.495	30%	0.303	S	S	.	.	H	α-helix	trans	-76.6	-40	174.7	-151.6	64.5	-124.5	0	0	111.8	D212 Q213 A218 R219 A220	D212-E216 WeakPolarHBondContact O-CB 3.28Å; D212-E216 PolarHBondContact O-N 3.14Å; Q213-E216 PolarHBondContact O-N 2.82Å; E216-A218 VanDerWaalsContact C-N 3.35Å; E216-R219 PolarHBondContact O-N 3.27Å; E216-R219 WeakPolarHBondContact OE1-CD 3.46Å; E216-R219 IonicContact OE1-CZ 3.63Å; E216-R219 IonicContact OE1-NE 3.81Å; E216-R219 IonicContact OE1-NH1 2.73Å; E216-R219 PolarHBondContact OE1-NH1 3.48Å; E216-R219 IonicContact OE2-CZ 3.57Å; E216-R219 IonicContact OE2-NH1 3.63Å; E216-R219 PolarHBondContact OE2-NH1 2.95Å; E216-R219 IonicContact OE2-NH2 2.7Å; E216-A220 PolarHBondContact O-N 2.94Å
217	E	63.2	Low	69.6	Low	86 Å²	86	51.9 Å²	51.9	40%	0.402	26%	0.263	S	S	.	.	H	α-helix	trans	-60	-44.4	170.5	-171.2	-163.4	166	0	0	111.1	R117 Q213 R219 A220 Y221	R117-E217 IonicContact CZ-OE1 2.6Å; R117-E217 IonicContact CZ-OE2 3.93Å; R117-E217 IonicContact NH2-OE1 3.55Å; R117-E217 PolarHBondContact NH2-OE1 3.11Å; R117-E217 IonicContact NH2-OE2 3.14Å; R117-E217 PolarHBondContact NH2-OE2 2.98Å; Q213-E217 WeakPolarHBondContact O-CB 3.45Å; Q213-E217 PolarHBondContact O-N 2.9Å; E217-R219 VanDerWaalsContact C-N 3.35Å; E217-R219 PolarHBondContact O-N 2.93Å; E217-A220 WeakPolarHBondContact O-CB 3.25Å; E217-A220 PolarHBondContact O-N 2.72Å; E217-Y221 WeakPolarHBondContact O-CD2 3.08Å
218	A	60.1	Low	71.3	Confident	2 Å²	2	52 Å²	52	2%	0.017	26%	0.263	C	S	.	.	H	α-helix	trans	-65.3	-36.5	176.6	0	0	0	0	0	112.4	L214 E216 A220 Y221 V299	L214-A218 VanDerWaalsContact O-CB 3.23Å; L214-A218 WeakPolarHBondContact O-CB 3.43Å; L214-A218 PolarHBondContact O-N 3.28Å; E216-A218 VanDerWaalsContact C-N 3.35Å; A218-A220 PolarHBondContact O-N 2.96Å; A218-Y221 WeakPolarHBondContact O-CB 3.07Å; A218-Y221 PolarHBondContact O-N 3.1Å; A218-V299 WeakPolarHBondContact CB-O 3.41Å
219	R	61.5	Low	72.6	Confident	128 Å²	128	47 Å²	47	48%	0.483	24%	0.24	S	C	.	.	H	α-helix	trans	-63.8	-22.7	176.6	-171.1	-178.7	-58.6	149.4	8.5	113.5	A215 E216 E217 Y221	A215-R219 WeakPolarHBondContact O-CB 3.33Å; A215-R219 PolarHBondContact O-N 2.89Å; E216-R219 PolarHBondContact O-N 3.27Å; E216-R219 WeakPolarHBondContact OE1-CD 3.46Å; E216-R219 IonicContact OE1-CZ 3.63Å; E216-R219 IonicContact OE1-NE 3.81Å; E216-R219 IonicContact OE1-NH1 2.73Å; E216-R219 PolarHBondContact OE1-NH1 3.48Å; E216-R219 IonicContact OE2-CZ 3.57Å; E216-R219 IonicContact OE2-NH1 3.63Å; E216-R219 PolarHBondContact OE2-NH1 2.95Å; E216-R219 IonicContact OE2-NH2 2.7Å; E217-R219 VanDerWaalsContact C-N 3.35Å; E217-R219 PolarHBondContact O-N 2.93Å; R219-Y221 PolarHBondContact O-N 3.4Å
220	A	62.4	Low	73.9	Confident	77 Å²	77	45.1 Å²	45.1	64%	0.636	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-20.7	172.3	0	0	0	0	0	112.8	E216 E217 A218	E216-A220 PolarHBondContact O-N 2.94Å; E217-A220 WeakPolarHBondContact O-CB 3.25Å; E217-A220 PolarHBondContact O-N 2.72Å; A218-A220 PolarHBondContact O-N 2.96Å
221	Y	65.4	Low	74.9	Confident	91 Å²	91	45.2 Å²	45.2	36%	0.357	23%	0.227	S	C	.	.	S	Bend	trans	-89.8	120	165.9	-57.9	-83.6	0	0	0	108.4	E217 A218 R219 R223 P301 P302	E217-Y221 WeakPolarHBondContact O-CD2 3.08Å; A218-Y221 WeakPolarHBondContact O-CB 3.07Å; A218-Y221 PolarHBondContact O-N 3.1Å; R219-Y221 PolarHBondContact O-N 3.4Å; Y221-R223 PolarHBondContact O-N 3.32Å; Y221-P301 HydrophobicContact CD2-CB 4.1Å; Y221-P301 HydrophobicContact CE2-CB 3.98Å; Y221-P302 VanDerWaalsContact CD1-CD 3.42Å; Y221-P302 HydrophobicContact CD1-CG 3.24Å; Y221-P302 HydrophobicContact CD2-CG 4.37Å; Y221-P302 HydrophobicContact CE1-CG 3.58Å; Y221-P302 HydrophobicContact CG-CG 3.68Å
222	N	80.9	Confident	75.8	Confident	25 Å²	25	50.6 Å²	50.6	13%	0.134	26%	0.256	C	S	.	.			trans	-75.8	50.3	-172.9	-58.6	-34.4	0	0	0	112.2	Y270 E271 P273	N222-Y270 WeakPolarHBondContact CB-O 3.18Å; N222-Y270 PolarHBondContact O-N 3.1Å; N222-E271 PolarHBondContact ND2-O 3.18Å; N222-P273 WeakPolarHBondContact OD1-CA 3.2Å; N222-P273 WeakPolarHBondContact OD1-CB 3.31Å
223	R	84	Confident	76.7	Confident	54 Å²	54	47.8 Å²	47.8	20%	0.204	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	137.5	-167.5	-167.8	-177.3	-166.5	-152.7	2.6	110.3	Y221 I268 E269 A298 T300	Y221-R223 PolarHBondContact O-N 3.32Å; R223-I268 CarbonylContact C-O 3.6Å; R223-I268 VanDerWaalsContact CA-O 3.29Å; R223-I268 WeakPolarHBondContact CA-O 3.48Å; R223-I268 WeakPolarHBondContact CG-O 3.33Å; R223-E269 HydrophobicContact CB-CB 4.49Å; R223-E269 HydrophobicContact CB-CG 4.4Å; R223-E269 HydrophobicContact CG-CB 4.4Å; R223-A298 HydrophobicContact CB-CB 3.79Å; R223-A298 HydrophobicContact CG-CB 3.8Å; R223-A298 VanDerWaalsContact O-CB 3.23Å; R223-A298 WeakPolarHBondContact O-CB 3.08Å; R223-A298 PolarHBondContact O-N 3.49Å; R223-T300 PolarHBondContact NH1-O 3.36Å; R223-T300 VanDerWaalsContact NH1-O 3.17Å
224	I	88.5	Confident	77.7	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.005	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	153.9	176.4	63.8	162.4	0	0	0	109.7	V226 F242 F267 I268 Y270 A276 A279 V280 V295 G296	I224-V226 HydrophobicContact CD1-CG2 4.08Å; I224-F242 HydrophobicContact CD1-CD1 3.61Å; I224-F242 HydrophobicContact CD1-CE1 3.52Å; I224-F267 WeakPolarHBondContact O-CA 3.47Å; I224-I268 HydrophobicContact CD1-CB 4.18Å; I224-I268 HydrophobicContact CD1-CD1 4.18Å; I224-I268 HydrophobicContact CG1-CB 3.75Å; I224-I268 HydrophobicContact CG1-CG1 4.4Å; I224-I268 PolarHBondContact N-O 2.88Å; I224-I268 PolarHBondContact O-N 2.89Å; I224-Y270 HydrophobicContact CD1-CE2 3.83Å; I224-Y270 HydrophobicContact CG1-CE2 4.18Å; I224-A276 HydrophobicContact CG2-CB 3.84Å; I224-A279 HydrophobicContact CD1-CB 4.4Å; I224-V280 HydrophobicContact CB-CG2 4.22Å; I224-V280 HydrophobicContact CG2-CG2 3.59Å; I224-V295 HydrophobicContact CB-CG1 4.46Å; I224-V295 HydrophobicContact CD1-CG1 3.83Å; I224-G296 CarbonylContact C-O 3.54Å; I224-G296 VanDerWaalsContact CA-O 3.28Å; I224-G296 WeakPolarHBondContact CA-O 3.37Å; I224-G296 WeakPolarHBondContact CB-O 3.38Å
225	Y	89.2	Confident	78.7	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	131.6	172	170	-107.7	0	0	0	108.3	F148 G149 V175 E177 A178 L181 A227 F265 G266 F267 V295 G296	F148-Y225 WeakPolarHBondContact O-CE1 3.27Å; F148-Y225 PolarHBondContact O-OH 2.88Å; G149-Y225 WeakPolarHBondContact CA-OH 3.23Å; V175-Y225 HydrophobicContact CG1-CD2 4.16Å; V175-Y225 HydrophobicContact CG1-CE2 3.8Å; E177-Y225 HydrophobicContact CB-CD1 3.5Å; E177-Y225 HydrophobicContact CB-CD2 4.28Å; E177-Y225 HydrophobicContact CB-CE1 4.16Å; E177-Y225 HydrophobicContact CB-CG 3.57Å; E177-Y225 HydrophobicContact CG-CG 4.14Å; A178-Y225 HydrophobicContact CB-CE1 4.1Å; L181-Y225 HydrophobicContact CD1-CD1 3.77Å; L181-Y225 HydrophobicContact CD1-CE1 4.04Å; Y225-A227 HydrophobicContact CE1-CB 3.75Å; Y225-F265 HydrophobicContact CE2-CB 3.92Å; Y225-F265 AromaticContact CE2-CD2 3.76Å; Y225-F265 HydrophobicContact CE2-CD2 3.76Å; Y225-F265 HydrophobicContact CE2-CG 4.17Å; Y225-G266 WeakPolarHBondContact CD2-O 3.33Å; Y225-F267 HydrophobicContact CD2-CD1 4.05Å; Y225-F267 AromaticContact CD2-CE1 3.69Å; Y225-F267 HydrophobicContact CD2-CE1 3.69Å; Y225-F267 HydrophobicContact CD2-CZ 4.02Å; Y225-F267 HydrophobicContact CE2-CE1 4.49Å; Y225-F267 HydrophobicContact CE2-CZ 4.4Å; Y225-F267 HydrophobicContact CG-CE1 4.45Å; Y225-V295 WeakPolarHBondContact O-CA 3.08Å; Y225-G296 PolarHBondContact N-O 2.84Å; Y225-G296 PolarHBondContact O-N 2.81Å
226	V	88.6	Confident	79.7	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	130.9	178.4	-175.6	0	0	0	0	107.9	I224 V229 F242 F265 G266 I268 L293 R294 V295	I224-V226 HydrophobicContact CD1-CG2 4.08Å; V226-V229 HydrophobicContact CG1-CG2 3.74Å; V226-F242 HydrophobicContact CG1-CZ 4.22Å; V226-F242 HydrophobicContact CG2-CE1 4Å; V226-F242 HydrophobicContact CG2-CE2 4.39Å; V226-F242 HydrophobicContact CG2-CZ 3.75Å; V226-F265 CarbonylContact O-C 3.55Å; V226-F265 WeakPolarHBondContact O-CA 3.34Å; V226-F265 WeakPolarHBondContact O-CB 3.33Å; V226-G266 PolarHBondContact N-O 2.67Å; V226-G266 PolarHBondContact O-N 3.15Å; V226-I268 HydrophobicContact CG2-CD1 3.87Å; V226-I268 HydrophobicContact CG2-CG1 4.3Å; V226-L293 HydrophobicContact CG1-CD2 4.19Å; V226-R294 CarbonylContact C-O 3.55Å; V226-R294 WeakPolarHBondContact CA-O 3.4Å; V226-V295 HydrophobicContact CG1-CG2 4.41Å; V226-V295 HydrophobicContact CG2-CG1 4.33Å; V226-V295 HydrophobicContact CG2-CG2 4.42Å
227	A	87.2	Confident	80.8	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.008	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	169	177.8	0	0	0	0	0	111	F148 Y225 V229 G264 F265 R294	F148-A227 WeakPolarHBondContact O-CB 3.1Å; Y225-A227 HydrophobicContact CE1-CB 3.75Å; A227-V229 VanDerWaalsContact C-N 3.31Å; A227-V229 PolarHBondContact O-N 2.87Å; A227-G264 CarbonylContact C-O 3.58Å; A227-G264 WeakPolarHBondContact CA-O 3.44Å; A227-F265 HydrophobicContact CB-CB 4.4Å; A227-R294 HydrophobicContact CB-CB 4.45Å; A227-R294 PolarHBondContact N-O 2.85Å; A227-R294 PolarHBondContact O-N 2.9Å
228	S	86.9	Confident	82.1	Confident	14 Å²	14	41.6 Å²	41.6	10%	0.098	22%	0.219	C	C	.	.			trans	58.3	40	-175	-162.2	0	0	0	0	113.4	P147 G264 Q291 Y292	P147-S228 WeakPolarHBondContact O-CB 3.47Å; S228-G264 PolarHBondContact N-O 3.17Å; S228-Q291 VanDerWaalsContact C-OE1 3.22Å; S228-Q291 WeakPolarHBondContact O-CG 3.47Å; S228-Q291 PolarHBondContact O-OE1 2.68Å; S228-Q291 VanDerWaalsContact O-OE1 3.07Å; S228-Q291 WeakPolarHBondContact OG-CG 3.32Å; S228-Q291 PolarHBondContact OG-OE1 2.67Å; S228-Y292 VanDerWaalsContact CB-O 3.26Å; S228-Y292 WeakPolarHBondContact CB-O 3.37Å; S228-Y292 PolarHBondContact OG-O 2.86Å
229	V	87.5	Confident	83.5	Confident	1 Å²	1	45.6 Å²	45.6	1%	0.006	24%	0.236	C	C	.	.			trans	-78.7	127.2	173.5	-177.8	0	0	0	0	110	V226 A227 L233 I238 L253 G264 L293	V226-V229 HydrophobicContact CG1-CG2 3.74Å; A227-V229 VanDerWaalsContact C-N 3.31Å; A227-V229 PolarHBondContact O-N 2.87Å; V229-L233 HydrophobicContact CG1-CB 4.04Å; V229-L233 HydrophobicContact CG1-CD1 3.99Å; V229-I238 HydrophobicContact CG1-CD1 3.99Å; V229-I238 HydrophobicContact CG1-CG1 4.16Å; V229-I238 HydrophobicContact CG2-CD1 4.48Å; V229-L253 HydrophobicContact CG1-CD1 4.43Å; V229-L253 HydrophobicContact CG2-CD2 4.39Å; V229-G264 PolarHBondContact N-O 2.89Å; V229-G264 WeakPolarHBondContact O-CA 3.34Å; V229-L293 HydrophobicContact CB-CD2 4.36Å; V229-L293 HydrophobicContact CG2-CD2 3.9Å
230	H	86.7	Confident	84.8	Confident	49 Å²	49	43.3 Å²	43.3	23%	0.227	24%	0.239	C	C	.	.			trans	-57.6	134.8	176.9	-166.4	-97.3	0	0	0	111.6	D232 L233 H262 G289 Q291	H230-D232 IonicContact CE1-OD2 3.87Å; H230-D232 PolarHBondContact CE1-OD2 2.89Å; H230-D232 IonicContact ND1-OD2 2.68Å; H230-D232 PolarHBondContact O-N 3.37Å; H230-L233 HydrophobicContact CB-CD1 3.68Å; H230-L233 HydrophobicContact CB-CG 4.1Å; H230-L233 PolarHBondContact O-N 3.05Å; H230-L233 VanDerWaalsContact O-N 3.09Å; H230-H262 PolarHBondContact O-NE2 2.68Å; H230-G289 PolarHBondContact CD2-O 3.41Å; H230-Q291 HydrophobicContact CB-CB 4.38Å
231	P	83.9	Confident	86	Confident	52 Å²	52	41.6 Å²	41.6	34%	0.338	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-4.5	-169.8	25.9	-37.7	0	0	0	116.5	H262	P231-H262 WeakPolarHBondContact CA-NE2 2.74Å; P231-H262 PolarHBondContact O-CE1 3.49Å
232	D	84.5	Confident	87.1	Confident	117 Å²	117	37.2 Å²	37.2	63%	0.626	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.5	-6.9	178.8	-53.4	-28.9	0	0	0	113	H230	H230-D232 IonicContact CE1-OD2 3.87Å; H230-D232 PolarHBondContact CE1-OD2 2.89Å; H230-D232 IonicContact ND1-OD2 2.68Å; H230-D232 PolarHBondContact O-N 3.37Å
233	L	85.4	Confident	87.5	Confident	24 Å²	24	41 Å²	41	13%	0.126	22%	0.22	C	C	.	.			trans	-84	124.8	179.5	-65.9	164.5	0	0	0	112	V229 H230 D237 I238 H262 L288	V229-L233 HydrophobicContact CG1-CB 4.04Å; V229-L233 HydrophobicContact CG1-CD1 3.99Å; H230-L233 HydrophobicContact CB-CD1 3.68Å; H230-L233 HydrophobicContact CB-CG 4.1Å; H230-L233 PolarHBondContact O-N 3.05Å; H230-L233 VanDerWaalsContact O-N 3.09Å; L233-D237 HydrophobicContact CD2-CB 4.27Å; L233-I238 HydrophobicContact CD1-CD1 4.42Å; L233-H262 PolarHBondContact O-CE1 2.8Å; L233-H262 PolarHBondContact O-NE2 2.85Å; L233-L288 HydrophobicContact CD1-CB 4.2Å; L233-L288 HydrophobicContact CD1-CD2 3.69Å; L233-L288 HydrophobicContact CD1-CG 3.67Å; L233-L288 HydrophobicContact CD2-CD2 4.2Å; L233-L288 HydrophobicContact CD2-CG 4.04Å
234	S	87.4	Confident	87.7	Confident	37 Å²	37	42.5 Å²	42.5	26%	0.259	25%	0.245	S	C	.	.			trans	-75.4	168	175.6	72.8	0	0	0	0	113.2	D236 D237 I238	S234-D236 PolarHBondContact O-N 3.26Å; S234-D236 PolarHBondContact OG-N 2.88Å; S234-D237 WeakPolarHBondContact CA-OD2 3.37Å; S234-D237 VanDerWaalsContact CB-OD2 3.27Å; S234-D237 WeakPolarHBondContact CB-OD2 3.29Å; S234-D237 PolarHBondContact N-OD2 2.76Å; S234-D237 PolarHBondContact O-N 3.02Å; S234-D237 VanDerWaalsContact OG-CG 3.25Å; S234-D237 PolarHBondContact OG-N 3.44Å; S234-D237 PolarHBondContact OG-OD2 3.35Å; S234-I238 WeakPolarHBondContact O-CG1 3.45Å; S234-I238 PolarHBondContact O-N 3.3Å; S234-I238 VanDerWaalsContact O-N 3.16Å
235	D	87.1	Confident	87.5	Confident	45 Å²	45	45.2 Å²	45.2	24%	0.241	26%	0.257	C	S	.	.	H	α-helix	trans	-67.2	-22.5	170.1	43.2	-64.9	0	0	0	113.2	K239 C251 L253 R255	D235-K239 WeakPolarHBondContact O-CB 3.24Å; D235-K239 PolarHBondContact O-N 3.38Å; D235-C251 PolarHBondContact O-SG 3.2Å; D235-C251 VanDerWaalsContact O-SG 3.37Å; D235-L253 HydrophobicContact CB-CB 4.28Å; D235-L253 HydrophobicContact CB-CD1 4.07Å; D235-L253 HydrophobicContact CB-CG 3.86Å; D235-R255 IonicContact OD1-CZ 2.71Å; D235-R255 IonicContact OD1-NE 2.7Å; D235-R255 IonicContact OD1-NH2 2.69Å; D235-R255 PolarHBondContact OD1-NH2 3.47Å
236	D	88.1	Confident	87.4	Confident	83 Å²	83	46.2 Å²	46.2	44%	0.444	27%	0.267	S	S	.	.	H	α-helix	trans	-77.6	-34	171.6	-81.7	-57.5	0	0	0	113.1	S234 K239 S240	S234-D236 PolarHBondContact O-N 3.26Å; S234-D236 PolarHBondContact OG-N 2.88Å; D236-K239 PolarHBondContact O-N 2.79Å; D236-K239 IonicContact OD1-NZ 2.67Å; D236-K239 PolarHBondContact OD1-NZ 2.42Å; D236-S240 WeakPolarHBondContact O-CB 3.34Å; D236-S240 PolarHBondContact O-N 3.01Å; D236-S240 PolarHBondContact O-OG 2.94Å
237	D	88.8	Confident	87.4	Confident	73 Å²	73	54.5 Å²	54.5	39%	0.39	30%	0.298	S	S	.	.	H	α-helix	trans	-62.4	-49.4	170.7	-64.2	-63.4	0	0	0	110.2	L233 S234 K239 S240 V241	L233-D237 HydrophobicContact CD2-CB 4.27Å; S234-D237 WeakPolarHBondContact CA-OD2 3.37Å; S234-D237 VanDerWaalsContact CB-OD2 3.27Å; S234-D237 WeakPolarHBondContact CB-OD2 3.29Å; S234-D237 PolarHBondContact N-OD2 2.76Å; S234-D237 PolarHBondContact O-N 3.02Å; S234-D237 VanDerWaalsContact OG-CG 3.25Å; S234-D237 PolarHBondContact OG-N 3.44Å; S234-D237 PolarHBondContact OG-OD2 3.35Å; D237-K239 PolarHBondContact O-N 3.4Å; D237-S240 PolarHBondContact O-N 3.11Å; D237-V241 WeakPolarHBondContact O-CG2 3.08Å; D237-V241 PolarHBondContact O-N 2.93Å
238	I	89.1	Confident	87.5	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-62.8	-42.7	177.6	-68.4	-63.9	0	0	0	110.9	V229 L233 S234 S240 V241 F242 L253 I268 L288 L293	V229-I238 HydrophobicContact CG1-CD1 3.99Å; V229-I238 HydrophobicContact CG1-CG1 4.16Å; V229-I238 HydrophobicContact CG2-CD1 4.48Å; L233-I238 HydrophobicContact CD1-CD1 4.42Å; S234-I238 WeakPolarHBondContact O-CG1 3.45Å; S234-I238 PolarHBondContact O-N 3.3Å; S234-I238 VanDerWaalsContact O-N 3.16Å; I238-S240 PolarHBondContact O-N 2.85Å; I238-V241 PolarHBondContact O-N 3.11Å; I238-F242 HydrophobicContact CG2-CD2 3.93Å; I238-F242 HydrophobicContact CG2-CE2 4.19Å; I238-F242 WeakPolarHBondContact O-CB 3.33Å; I238-F242 VanDerWaalsContact O-CD2 3.25Å; I238-F242 WeakPolarHBondContact O-CD2 3.4Å; I238-F242 PolarHBondContact O-N 3.32Å; I238-L253 HydrophobicContact CG1-CD1 4.11Å; I238-L253 HydrophobicContact CG1-CD2 4.39Å; I238-L253 HydrophobicContact CG2-CD2 4.47Å; I238-I268 HydrophobicContact CG2-CD1 3.68Å; I238-L288 HydrophobicContact CD1-CD2 3.72Å; I238-L293 HydrophobicContact CD1-CD2 4.44Å
239	K	90	Very high	87.6	Confident	85 Å²	85	61.2 Å²	61.2	37%	0.37	33%	0.326	S	S	.	.	H	α-helix	trans	-58.5	-47.5	173.5	170.8	-178.7	149.1	-151.7	0	111.7	D235 D236 D237 V241 F242 E243 I248 C251	D235-K239 WeakPolarHBondContact O-CB 3.24Å; D235-K239 PolarHBondContact O-N 3.38Å; D236-K239 PolarHBondContact O-N 2.79Å; D236-K239 IonicContact OD1-NZ 2.67Å; D236-K239 PolarHBondContact OD1-NZ 2.42Å; D237-K239 PolarHBondContact O-N 3.4Å; K239-V241 VanDerWaalsContact C-N 3.35Å; K239-V241 PolarHBondContact O-N 2.93Å; K239-F242 PolarHBondContact O-N 3.5Å; K239-E243 VanDerWaalsContact O-CB 3.27Å; K239-E243 WeakPolarHBondContact O-CB 3.37Å; K239-E243 PolarHBondContact O-N 3.37Å; K239-I248 HydrophobicContact CB-CD1 4.41Å; K239-I248 HydrophobicContact CG-CD1 4.23Å; K239-I248 WeakPolarHBondContact O-CD1 3.25Å; K239-C251 HydrophobicContact CB-CB 4.15Å
240	S	89.3	Confident	87.4	Confident	80 Å²	80	63.8 Å²	63.8	56%	0.559	35%	0.345	S	S	*	.	H	α-helix	trans	-60.5	-40.8	178.9	-59.7	0	0	0	0	112.8	D236 D237 I238	D236-S240 WeakPolarHBondContact O-CB 3.34Å; D236-S240 PolarHBondContact O-N 3.01Å; D236-S240 PolarHBondContact O-OG 2.94Å; D237-S240 PolarHBondContact O-N 3.11Å; I238-S240 PolarHBondContact O-N 2.85Å
241	V	88.3	Confident	87.4	Confident	41 Å²	41	62.4 Å²	62.4	25%	0.248	34%	0.34	C	S	.	.	H	α-helix	trans	-68.3	-44.6	176.2	171	0	0	0	0	111.5	D237 I238 K239 A244 M283 L288	D237-V241 WeakPolarHBondContact O-CG2 3.08Å; D237-V241 PolarHBondContact O-N 2.93Å; I238-V241 PolarHBondContact O-N 3.11Å; K239-V241 VanDerWaalsContact C-N 3.35Å; K239-V241 PolarHBondContact O-N 2.93Å; V241-A244 WeakPolarHBondContact O-CB 3.24Å; V241-M283 HydrophobicContact CG1-CE 3.38Å; V241-M283 HydrophobicContact CG1-SD 4.2Å; V241-L288 HydrophobicContact CG2-CD1 4.31Å; V241-L288 HydrophobicContact CG2-CD2 4.18Å
242	F	88.2	Confident	87.5	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-80.7	-19.3	-175.4	-81.9	-101.2	0	0	0	113.6	I224 V226 I238 K239 A244 F245 I248 I268 Y270 A279 M283 L293 V295	I224-F242 HydrophobicContact CD1-CD1 3.61Å; I224-F242 HydrophobicContact CD1-CE1 3.52Å; V226-F242 HydrophobicContact CG1-CZ 4.22Å; V226-F242 HydrophobicContact CG2-CE1 4Å; V226-F242 HydrophobicContact CG2-CE2 4.39Å; V226-F242 HydrophobicContact CG2-CZ 3.75Å; I238-F242 HydrophobicContact CG2-CD2 3.93Å; I238-F242 HydrophobicContact CG2-CE2 4.19Å; I238-F242 WeakPolarHBondContact O-CB 3.33Å; I238-F242 VanDerWaalsContact O-CD2 3.25Å; I238-F242 WeakPolarHBondContact O-CD2 3.4Å; I238-F242 PolarHBondContact O-N 3.32Å; K239-F242 PolarHBondContact O-N 3.5Å; F242-A244 PolarHBondContact O-N 2.86Å; F242-F245 PolarHBondContact O-N 2.86Å; F242-I248 HydrophobicContact CB-CD1 3.8Å; F242-I268 HydrophobicContact CB-CD1 3.87Å; F242-I268 HydrophobicContact CD1-CD1 3.75Å; F242-I268 HydrophobicContact CD2-CD1 3.87Å; F242-I268 HydrophobicContact CE1-CD1 4.22Å; F242-I268 HydrophobicContact CE2-CD1 4.32Å; F242-I268 HydrophobicContact CG-CD1 3.54Å; F242-I268 HydrophobicContact CZ-CD1 4.48Å; F242-Y270 WeakPolarHBondContact CB-OH 3.27Å; F242-Y270 WeakPolarHBondContact CD1-OH 3.3Å; F242-Y270 PolarHBondContact O-OH 3.29Å; F242-A279 HydrophobicContact CD1-CB 4.19Å; F242-A279 HydrophobicContact CE1-CB 4.45Å; F242-M283 HydrophobicContact CD1-CG 4.34Å; F242-M283 HydrophobicContact CE1-CB 3.85Å; F242-M283 HydrophobicContact CE1-CG 3.89Å; F242-M283 HydrophobicContact CE2-CE 4.07Å; F242-M283 HydrophobicContact CZ-CB 3.81Å; F242-M283 HydrophobicContact CZ-CE 4.24Å; F242-M283 HydrophobicContact CZ-CG 4.02Å; F242-L293 HydrophobicContact CE2-CD1 4.17Å; F242-L293 HydrophobicContact CZ-CD1 4.49Å; F242-V295 HydrophobicContact CE1-CG1 4.1Å; F242-V295 HydrophobicContact CE1-CG2 4.13Å; F242-V295 HydrophobicContact CZ-CG2 3.82Å
243	E	89	Confident	87.6	Confident	103 Å²	103	58.5 Å²	58.5	48%	0.481	32%	0.319	S	S	.	.	H	α-helix	trans	-64.7	-24.1	174.5	-179.3	163.3	-155.8	0	0	112.6	K239 F245 G246 I248	K239-E243 VanDerWaalsContact O-CB 3.27Å; K239-E243 WeakPolarHBondContact O-CB 3.37Å; K239-E243 PolarHBondContact O-N 3.37Å; E243-F245 PolarHBondContact O-N 3.31Å; E243-F245 VanDerWaalsContact O-N 3.1Å; E243-G246 WeakPolarHBondContact CA-O 3.18Å; E243-G246 CarbonylContact O-C 3.59Å; E243-G246 PolarHBondContact O-N 3.16Å; E243-I248 HydrophobicContact CB-CD1 4.29Å
244	A	87.2	Confident	87.5	Confident	87 Å²	87	58.5 Å²	58.5	72%	0.719	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-25	174.9	0	0	0	0	0	113.9	V241 F242	V241-A244 WeakPolarHBondContact O-CB 3.24Å; F242-A244 PolarHBondContact O-N 2.86Å
245	F	85.9	Confident	87.2	Confident	58 Å²	58	63.3 Å²	63.3	25%	0.254	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-12.3	177.9	-56.7	-85.1	0	0	0	113	F242 E243 S275 A279 S282 M283	F242-F245 PolarHBondContact O-N 2.86Å; E243-F245 PolarHBondContact O-N 3.31Å; E243-F245 VanDerWaalsContact O-N 3.1Å; F245-S275 WeakPolarHBondContact O-CB 3.45Å; F245-S275 PolarHBondContact O-OG 3.01Å; F245-A279 HydrophobicContact CB-CB 4.02Å; F245-A279 HydrophobicContact CD2-CB 4.21Å; F245-A279 HydrophobicContact CG-CB 3.97Å; F245-S282 VanDerWaalsContact CE1-CB 3.46Å; F245-M283 HydrophobicContact CD2-CG 4.19Å; F245-M283 HydrophobicContact CE2-CG 3.41Å; F245-M283 VanDerWaalsContact CE2-CG 3.41Å; F245-M283 HydrophobicContact CE2-SD 3.47Å; F245-M283 WeakPolarHBondContact CE2-SD 3.46Å; F245-M283 HydrophobicContact CZ-CG 3.65Å; F245-M283 HydrophobicContact CZ-SD 3.59Å; F245-M283 VanDerWaalsContact CZ-SD 3.59Å
246	G	86.6	Confident	86.8	Confident	20 Å²	20	63 Å²	63	21%	0.206	33%	0.334	C	S	.	.	S	Bend	trans	149.2	173.6	177	0	0	0	0	0	113.4	E243 I248 Y270	E243-G246 WeakPolarHBondContact CA-O 3.18Å; E243-G246 CarbonylContact O-C 3.59Å; E243-G246 PolarHBondContact O-N 3.16Å; G246-I248 PolarHBondContact O-N 3.33Å; G246-Y270 WeakPolarHBondContact O-CE1 3.37Å
247	R	88.1	Confident	86.1	Confident	174 Å²	174	65.2 Å²	65.2	66%	0.657	35%	0.353	S	S	*	.			trans	-63.7	122.1	-177.3	-72.5	172.2	172.2	-178.2	-2.8	112	Y270 E271	R247-Y270 WeakPolarHBondContact O-CD1 3.42Å; R247-E271 HydrophobicContact CB-CB 4.13Å; R247-E271 WeakPolarHBondContact CD-OE2 3.47Å; R247-E271 IonicContact NH1-OE2 3.37Å; R247-E271 PolarHBondContact O-N 3.13Å
248	I	90.3	Very high	85.4	Confident	35 Å²	35	67.8 Å²	67.8	18%	0.179	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	130.9	171.5	-65.1	169.4	0	0	0	108.4	K239 F242 E243 G246 S250 C251 I268 Y270	K239-I248 HydrophobicContact CB-CD1 4.41Å; K239-I248 HydrophobicContact CG-CD1 4.23Å; K239-I248 WeakPolarHBondContact O-CD1 3.25Å; F242-I248 HydrophobicContact CB-CD1 3.8Å; E243-I248 HydrophobicContact CB-CD1 4.29Å; G246-I248 PolarHBondContact O-N 3.33Å; I248-S250 VanDerWaalsContact CG2-C 3.46Å; I248-S250 WeakPolarHBondContact CG2-O 3.16Å; I248-C251 HydrophobicContact CG2-CB 4.37Å; I248-I268 HydrophobicContact CB-CG2 4.37Å; I248-I268 HydrophobicContact CD1-CG2 3.87Å; I248-I268 HydrophobicContact CG1-CG2 3.81Å; I248-I268 HydrophobicContact CG2-CG2 3.71Å; I248-Y270 HydrophobicContact CG1-CD1 4.19Å; I248-Y270 HydrophobicContact CG1-CE1 3.86Å
249	K	87.8	Confident	84.7	Confident	121 Å²	121	71.2 Å²	71.2	53%	0.526	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	-39.5	168.3	-72.9	166.6	166.9	164.8	0	111.9	E269	K249-E269 HydrophobicContact CB-CB 4.48Å; K249-E269 HydrophobicContact CD-CG 3.99Å; K249-E269 WeakPolarHBondContact CD-OE1 3.29Å; K249-E269 WeakPolarHBondContact CE-OE1 3.33Å; K249-E269 PolarHBondContact N-O 2.93Å; K249-E269 IonicContact NZ-OE1 3.4Å; K249-E269 PolarHBondContact NZ-OE1 3.15Å
250	S	83.6	Confident	83.7	Confident	55 Å²	55	69.4 Å²	69.4	39%	0.385	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	134.2	-176.3	-179.7	0	0	0	0	110.3	I248 I268 E269	I248-S250 VanDerWaalsContact CG2-C 3.46Å; I248-S250 WeakPolarHBondContact CG2-O 3.16Å; S250-I268 CarbonylContact O-C 3.58Å; S250-I268 WeakPolarHBondContact O-CA 3.23Å; S250-E269 PolarHBondContact N-O 2.8Å; S250-E269 PolarHBondContact O-N 2.89Å
251	C	86.8	Confident	83	Confident	21 Å²	21	72.8 Å²	72.8	14%	0.142	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	139.5	166.4	-174.2	0	0	0	0	107.1	D235 K239 I248	D235-C251 PolarHBondContact O-SG 3.2Å; D235-C251 VanDerWaalsContact O-SG 3.37Å; K239-C251 HydrophobicContact CB-CB 4.15Å; I248-C251 HydrophobicContact CG2-CB 4.37Å
252	T	86.4	Confident	82.7	Confident	76 Å²	76	71.7 Å²	71.7	47%	0.466	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	108.8	173.6	-51.5	0	0	0	0	110.3	G266 F267	T252-G266 CarbonylContact O-C 3.55Å; T252-G266 VanDerWaalsContact O-CA 3.24Å; T252-G266 WeakPolarHBondContact O-CA 3.34Å; T252-F267 PolarHBondContact N-O 2.92Å; T252-F267 PolarHBondContact O-N 3.47Å
253	L	87.1	Confident	82.1	Confident	10 Å²	10	77.8 Å²	77.8	5%	0.052	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	140.6	168.5	-64.2	-177.4	0	0	0	110.7	V229 D235 I238 R255 H262	V229-L253 HydrophobicContact CG1-CD1 4.43Å; V229-L253 HydrophobicContact CG2-CD2 4.39Å; D235-L253 HydrophobicContact CB-CB 4.28Å; D235-L253 HydrophobicContact CB-CD1 4.07Å; D235-L253 HydrophobicContact CB-CG 3.86Å; I238-L253 HydrophobicContact CG1-CD1 4.11Å; I238-L253 HydrophobicContact CG1-CD2 4.39Å; I238-L253 HydrophobicContact CG2-CD2 4.47Å; L253-R255 PolarHBondContact O-N 3Å; L253-R255 VanDerWaalsContact O-N 3.12Å; L253-H262 HydrophobicContact CB-CB 4.21Å
254	A	83.3	Confident	81.8	Confident	25 Å²	25	73.7 Å²	73.7	21%	0.207	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	94.4	-179.4	0	0	0	0	0	110.8	H262 R263 F265	A254-H262 CarbonylContact O-C 3.5Å; A254-H262 WeakPolarHBondContact O-CA 3.34Å; A254-R263 PolarHBondContact O-N 3.24Å; A254-F265 HydrophobicContact CB-CD1 4.33Å; A254-F265 HydrophobicContact CB-CD2 3.7Å; A254-F265 HydrophobicContact CB-CE1 3.98Å; A254-F265 HydrophobicContact CB-CE2 3.3Å; A254-F265 HydrophobicContact CB-CG 4.22Å; A254-F265 HydrophobicContact CB-CZ 3.45Å; A254-F265 VanDerWaalsContact CB-CZ 3.45Å; A254-F265 WeakPolarHBondContact CB-O 3.12Å; A254-F265 PolarHBondContact N-O 3.3Å
255	R	81.3	Confident	81.8	Confident	138 Å²	138	70.1 Å²	70.1	52%	0.521	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	135.7	175.8	-64.2	179.6	-177.3	-118.9	11.2	111.6	D235 L253 H262	D235-R255 IonicContact OD1-CZ 2.71Å; D235-R255 IonicContact OD1-NE 2.7Å; D235-R255 IonicContact OD1-NH2 2.69Å; D235-R255 PolarHBondContact OD1-NH2 3.47Å; L253-R255 PolarHBondContact O-N 3Å; L253-R255 VanDerWaalsContact O-N 3.12Å; R255-H262 HydrophobicContact CG-CB 4.47Å
256	D	78.6	Confident	81.9	Confident	37 Å²	37	67.4 Å²	67.4	20%	0.198	36%	0.358	C	S	.	.			trans	-75.4	121.8	172.2	164.7	35	0	0	0	109.2	T258 S259 G260 R261 R263	D256-T258 PolarHBondContact O-N 3.08Å; D256-T258 VanDerWaalsContact O-N 3.11Å; D256-T258 WeakPolarHBondContact OD1-CB 3.4Å; D256-T258 PolarHBondContact OD1-N 3.45Å; D256-T258 PolarHBondContact OD1-OG1 2.96Å; D256-T258 WeakPolarHBondContact OD2-CB 3.49Å; D256-S259 VanDerWaalsContact OD2-CB 3.24Å; D256-S259 WeakPolarHBondContact OD2-CB 3.29Å; D256-S259 PolarHBondContact OD2-N 2.93Å; D256-S259 PolarHBondContact OD2-OG 2.83Å; D256-G260 WeakPolarHBondContact O-CA 3.23Å; D256-G260 PolarHBondContact O-N 2.75Å; D256-R261 WeakPolarHBondContact CB-O 3.41Å; D256-R261 PolarHBondContact N-O 3.04Å; D256-R263 HydrophobicContact CB-CG 3.87Å
257	P	71.7	Confident	82	Confident	130 Å²	130	68.1 Å²	68.1	84%	0.844	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-14.1	179	28.4	-36.8	0	0	0	113.7
258	T	73.9	Confident	82.1	Confident	128 Å²	128	59.9 Å²	59.9	79%	0.785	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-40.6	-176.8	-26	0	0	0	0	113.1	D256	D256-T258 PolarHBondContact O-N 3.08Å; D256-T258 VanDerWaalsContact O-N 3.11Å; D256-T258 WeakPolarHBondContact OD1-CB 3.4Å; D256-T258 PolarHBondContact OD1-N 3.45Å; D256-T258 PolarHBondContact OD1-OG1 2.96Å; D256-T258 WeakPolarHBondContact OD2-CB 3.49Å
259	S	74.5	Confident	81.9	Confident	71 Å²	71	60 Å²	60	50%	0.497	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.9	-5.2	-174.8	67	0	0	0	0	114.9	D256 R261	D256-S259 VanDerWaalsContact OD2-CB 3.24Å; D256-S259 WeakPolarHBondContact OD2-CB 3.29Å; D256-S259 PolarHBondContact OD2-N 2.93Å; D256-S259 PolarHBondContact OD2-OG 2.83Å; S259-R261 PolarHBondContact O-N 2.71Å
260	G	70.1	Confident	82	Confident	48 Å²	48	54.2 Å²	54.2	50%	0.495	30%	0.299	S	S	.	.	S	Bend	trans	73.8	-18.7	179.7	0	0	0	0	0	115.4	D256	D256-G260 WeakPolarHBondContact O-CA 3.23Å; D256-G260 PolarHBondContact O-N 2.75Å
261	R	74.6	Confident	82.2	Confident	151 Å²	151	55.9 Å²	55.9	57%	0.57	30%	0.301	S	S	*	.	S	Bend	trans	-75.4	156.9	174.6	-48	-169	-154.1	-155.6	7.1	111.1	D256 S259	D256-R261 WeakPolarHBondContact CB-O 3.41Å; D256-R261 PolarHBondContact N-O 3.04Å; S259-R261 PolarHBondContact O-N 2.71Å
262	H	81.8	Confident	82.3	Confident	17 Å²	17	60.8 Å²	60.8	8%	0.079	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	144.6	170.8	45	-67.1	0	0	0	112.7	H230 P231 L233 L253 A254 R255 G264	H230-H262 PolarHBondContact O-NE2 2.68Å; P231-H262 WeakPolarHBondContact CA-NE2 2.74Å; P231-H262 PolarHBondContact O-CE1 3.49Å; L233-H262 PolarHBondContact O-CE1 2.8Å; L233-H262 PolarHBondContact O-NE2 2.85Å; L253-H262 HydrophobicContact CB-CB 4.21Å; A254-H262 CarbonylContact O-C 3.5Å; A254-H262 WeakPolarHBondContact O-CA 3.34Å; R255-H262 HydrophobicContact CG-CB 4.47Å; H262-G264 PolarHBondContact O-N 3.27Å
263	R	76.6	Confident	82.2	Confident	129 Å²	129	60.6 Å²	60.6	49%	0.487	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	21.2	178.6	-61.6	177.7	71.4	-159.4	0.8	112.7	D174 A254 D256 F265	D174-R263 IonicContact OD2-NH1 3.94Å; A254-R263 PolarHBondContact O-N 3.24Å; D256-R263 HydrophobicContact CB-CG 3.87Å; R263-F265 VanDerWaalsContact C-N 3.3Å; R263-F265 HydrophobicContact CB-CD1 3.78Å; R263-F265 HydrophobicContact CB-CE1 3.53Å; R263-F265 HydrophobicContact CG-CE1 4.42Å; R263-F265 WeakPolarHBondContact O-CD1 3.18Å; R263-F265 PolarHBondContact O-N 3.09Å
264	G	80.8	Confident	82.2	Confident	16 Å²	16	66.6 Å²	66.6	17%	0.165	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	70.6	13.8	-176.9	0	0	0	0	0	115.7	A227 S228 V229 H262	A227-G264 CarbonylContact C-O 3.58Å; A227-G264 WeakPolarHBondContact CA-O 3.44Å; S228-G264 PolarHBondContact N-O 3.17Å; V229-G264 PolarHBondContact N-O 2.89Å; V229-G264 WeakPolarHBondContact O-CA 3.34Å; H262-G264 PolarHBondContact O-N 3.27Å
265	F	87.3	Confident	82.4	Confident	12 Å²	12	66 Å²	66	5%	0.053	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	163.9	178	74.3	-91.3	0	0	0	113.5	P150 V175 Y225 V226 A227 A254 R263 F267	P150-F265 HydrophobicContact CB-CE1 4.14Å; P150-F265 HydrophobicContact CG-CD1 4.09Å; P150-F265 HydrophobicContact CG-CE1 3.53Å; P150-F265 HydrophobicContact CG-CZ 3.78Å; V175-F265 HydrophobicContact CG2-CE2 4.3Å; Y225-F265 HydrophobicContact CE2-CB 3.92Å; Y225-F265 AromaticContact CE2-CD2 3.76Å; Y225-F265 HydrophobicContact CE2-CD2 3.76Å; Y225-F265 HydrophobicContact CE2-CG 4.17Å; V226-F265 CarbonylContact O-C 3.55Å; V226-F265 WeakPolarHBondContact O-CA 3.34Å; V226-F265 WeakPolarHBondContact O-CB 3.33Å; A227-F265 HydrophobicContact CB-CB 4.4Å; A254-F265 HydrophobicContact CB-CD1 4.33Å; A254-F265 HydrophobicContact CB-CD2 3.7Å; A254-F265 HydrophobicContact CB-CE1 3.98Å; A254-F265 HydrophobicContact CB-CE2 3.3Å; A254-F265 HydrophobicContact CB-CG 4.22Å; A254-F265 HydrophobicContact CB-CZ 3.45Å; A254-F265 VanDerWaalsContact CB-CZ 3.45Å; A254-F265 WeakPolarHBondContact CB-O 3.12Å; A254-F265 PolarHBondContact N-O 3.3Å; R263-F265 VanDerWaalsContact C-N 3.3Å; R263-F265 HydrophobicContact CB-CD1 3.78Å; R263-F265 HydrophobicContact CB-CE1 3.53Å; R263-F265 HydrophobicContact CG-CE1 4.42Å; R263-F265 WeakPolarHBondContact O-CD1 3.18Å; R263-F265 PolarHBondContact O-N 3.09Å; F265-F267 HydrophobicContact CE2-CE2 4.44Å
266	G	88.5	Confident	82.6	Confident	1 Å²	1	59.9 Å²	59.9	1%	0.01	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.2	-175.2	176.7	0	0	0	0	0	113.8	Y225 V226 T252	Y225-G266 WeakPolarHBondContact CD2-O 3.33Å; V226-G266 PolarHBondContact N-O 2.67Å; V226-G266 PolarHBondContact O-N 3.15Å; T252-G266 CarbonylContact O-C 3.55Å; T252-G266 VanDerWaalsContact O-CA 3.24Å; T252-G266 WeakPolarHBondContact O-CA 3.34Å
267	F	89	Confident	83	Confident	35 Å²	35	61.5 Å²	61.5	15%	0.154	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	143.4	179.8	-56.7	-91.7	0	0	0	110.7	V175 I224 Y225 T252 F265	V175-F267 HydrophobicContact CG1-CZ 4.2Å; I224-F267 WeakPolarHBondContact O-CA 3.47Å; Y225-F267 HydrophobicContact CD2-CD1 4.05Å; Y225-F267 AromaticContact CD2-CE1 3.69Å; Y225-F267 HydrophobicContact CD2-CE1 3.69Å; Y225-F267 HydrophobicContact CD2-CZ 4.02Å; Y225-F267 HydrophobicContact CE2-CE1 4.49Å; Y225-F267 HydrophobicContact CE2-CZ 4.4Å; Y225-F267 HydrophobicContact CG-CE1 4.45Å; T252-F267 PolarHBondContact N-O 2.92Å; T252-F267 PolarHBondContact O-N 3.47Å; F265-F267 HydrophobicContact CE2-CE2 4.44Å
268	I	89.4	Confident	83.8	Confident	1 Å²	1	59.3 Å²	59.3	1%	0.005	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	129.9	177.4	-49.1	177.2	0	0	0	107.8	R223 I224 V226 I238 F242 I248 S250 Y270	R223-I268 CarbonylContact C-O 3.6Å; R223-I268 VanDerWaalsContact CA-O 3.29Å; R223-I268 WeakPolarHBondContact CA-O 3.48Å; R223-I268 WeakPolarHBondContact CG-O 3.33Å; I224-I268 HydrophobicContact CD1-CB 4.18Å; I224-I268 HydrophobicContact CD1-CD1 4.18Å; I224-I268 HydrophobicContact CG1-CB 3.75Å; I224-I268 HydrophobicContact CG1-CG1 4.4Å; I224-I268 PolarHBondContact N-O 2.88Å; I224-I268 PolarHBondContact O-N 2.89Å; V226-I268 HydrophobicContact CG2-CD1 3.87Å; V226-I268 HydrophobicContact CG2-CG1 4.3Å; I238-I268 HydrophobicContact CG2-CD1 3.68Å; F242-I268 HydrophobicContact CB-CD1 3.87Å; F242-I268 HydrophobicContact CD1-CD1 3.75Å; F242-I268 HydrophobicContact CD2-CD1 3.87Å; F242-I268 HydrophobicContact CE1-CD1 4.22Å; F242-I268 HydrophobicContact CE2-CD1 4.32Å; F242-I268 HydrophobicContact CG-CD1 3.54Å; F242-I268 HydrophobicContact CZ-CD1 4.48Å; I248-I268 HydrophobicContact CB-CG2 4.37Å; I248-I268 HydrophobicContact CD1-CG2 3.87Å; I248-I268 HydrophobicContact CG1-CG2 3.81Å; I248-I268 HydrophobicContact CG2-CG2 3.71Å; S250-I268 CarbonylContact O-C 3.58Å; S250-I268 WeakPolarHBondContact O-CA 3.23Å; I268-Y270 HydrophobicContact CG2-CE2 4.48Å
269	E	87.7	Confident	84.5	Confident	37 Å²	37	53.2 Å²	53.2	17%	0.173	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	126.4	172.1	-167.7	-170.6	150.3	0	0	110.4	R223 K249 S250	R223-E269 HydrophobicContact CB-CB 4.49Å; R223-E269 HydrophobicContact CB-CG 4.4Å; R223-E269 HydrophobicContact CG-CB 4.4Å; K249-E269 HydrophobicContact CB-CB 4.48Å; K249-E269 HydrophobicContact CD-CG 3.99Å; K249-E269 WeakPolarHBondContact CD-OE1 3.29Å; K249-E269 WeakPolarHBondContact CE-OE1 3.33Å; K249-E269 PolarHBondContact N-O 2.93Å; K249-E269 IonicContact NZ-OE1 3.4Å; K249-E269 PolarHBondContact NZ-OE1 3.15Å; S250-E269 PolarHBondContact N-O 2.8Å; S250-E269 PolarHBondContact O-N 2.89Å
270	Y	89.7	Confident	85.1	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	157	174.4	-77.8	-81.1	0	0	0	112.8	N222 I224 F242 G246 R247 I248 I268 K272 A276 A279	N222-Y270 WeakPolarHBondContact CB-O 3.18Å; N222-Y270 PolarHBondContact O-N 3.1Å; I224-Y270 HydrophobicContact CD1-CE2 3.83Å; I224-Y270 HydrophobicContact CG1-CE2 4.18Å; F242-Y270 WeakPolarHBondContact CB-OH 3.27Å; F242-Y270 WeakPolarHBondContact CD1-OH 3.3Å; F242-Y270 PolarHBondContact O-OH 3.29Å; G246-Y270 WeakPolarHBondContact O-CE1 3.37Å; R247-Y270 WeakPolarHBondContact O-CD1 3.42Å; I248-Y270 HydrophobicContact CG1-CD1 4.19Å; I248-Y270 HydrophobicContact CG1-CE1 3.86Å; I268-Y270 HydrophobicContact CG2-CE2 4.48Å; Y270-K272 WeakPolarHBondContact CB-O 3.28Å; Y270-A276 HydrophobicContact CD2-CB 3.75Å; Y270-A276 HydrophobicContact CE2-CB 4.48Å; Y270-A276 HydrophobicContact CG-CB 4.38Å; Y270-A279 HydrophobicContact CE2-CB 3.91Å; Y270-A279 WeakPolarHBondContact OH-CB 3.32Å
271	E	87.1	Confident	85.9	Confident	91 Å²	91	53.1 Å²	53.1	43%	0.425	26%	0.264	S	S	.	.	S	Bend	trans	-64.1	-43	166.1	-168.6	-178.6	-171.3	0	0	111.1	N222 R247	N222-E271 PolarHBondContact ND2-O 3.18Å; R247-E271 HydrophobicContact CB-CB 4.13Å; R247-E271 WeakPolarHBondContact CD-OE2 3.47Å; R247-E271 IonicContact NH1-OE2 3.37Å; R247-E271 PolarHBondContact O-N 3.13Å
272	K	88.4	Confident	86.5	Confident	123 Å²	123	49.4 Å²	49.4	54%	0.535	26%	0.261	S	S	.	.	S	Bend	trans	-111.7	145.6	-171.9	-62.4	-177.5	-179.1	-179.6	0	113.4	Y270	Y270-K272 WeakPolarHBondContact CB-O 3.28Å
273	P	83.9	Confident	86.7	Confident	73 Å²	73	48.8 Å²	48.8	47%	0.474	26%	0.259	S	S	.	.	H	α-helix	trans	-67.3	-37.8	175.8	25.1	-32.6	0	0	0	112.8	N222 A276 L277	N222-P273 WeakPolarHBondContact OD1-CA 3.2Å; N222-P273 WeakPolarHBondContact OD1-CB 3.31Å; P273-A276 PolarHBondContact O-N 3.02Å; P273-L277 WeakPolarHBondContact O-CG 3.37Å; P273-L277 PolarHBondContact O-N 3.26Å; P273-L277 VanDerWaalsContact O-N 3.15Å
274	Q	87.1	Confident	87.2	Confident	136 Å²	136	45 Å²	45	64%	0.636	25%	0.248	S	C	*	.	H	α-helix	trans	-61.8	-50.7	179.8	-76.1	169	-56.6	0	0	111.5	A276 L277 D278	Q274-A276 PolarHBondContact O-N 3.23Å; Q274-A276 VanDerWaalsContact O-N 3.1Å; Q274-L277 CarbonylContact O-C 3.59Å; Q274-L277 WeakPolarHBondContact O-CA 3.37Å; Q274-L277 WeakPolarHBondContact O-CB 3.42Å; Q274-L277 PolarHBondContact O-N 3.31Å; Q274-D278 PolarHBondContact O-N 2.85Å; Q274-D278 VanDerWaalsContact O-OD2 3.11Å
275	S	88.1	Confident	87.4	Confident	13 Å²	13	48.5 Å²	48.5	9%	0.091	26%	0.262	C	S	.	.	H	α-helix	trans	-51.1	-38.1	175.2	-62.2	0	0	0	0	113.8	F245 A279	F245-S275 WeakPolarHBondContact O-CB 3.45Å; F245-S275 PolarHBondContact O-OG 3.01Å; S275-A279 WeakPolarHBondContact O-CB 3.5Å; S275-A279 PolarHBondContact O-N 3.05Å
276	A	86.1	Confident	87.3	Confident	9 Å²	9	51.7 Å²	51.7	7%	0.074	28%	0.276	C	S	.	.	H	α-helix	trans	-69.3	-38.8	175.1	0	0	0	0	0	113.1	I224 Y270 P273 Q274 V280	I224-A276 HydrophobicContact CG2-CB 3.84Å; Y270-A276 HydrophobicContact CD2-CB 3.75Å; Y270-A276 HydrophobicContact CE2-CB 4.48Å; Y270-A276 HydrophobicContact CG-CB 4.38Å; P273-A276 PolarHBondContact O-N 3.02Å; Q274-A276 PolarHBondContact O-N 3.23Å; Q274-A276 VanDerWaalsContact O-N 3.1Å; A276-V280 WeakPolarHBondContact O-CB 3.42Å; A276-V280 WeakPolarHBondContact O-CG2 3.34Å; A276-V280 PolarHBondContact O-N 2.76Å; A276-V280 VanDerWaalsContact O-N 3.08Å
277	L	86.9	Confident	87.3	Confident	71 Å²	71	56.5 Å²	56.5	37%	0.372	30%	0.302	S	S	.	.	H	α-helix	trans	-69.9	-41.8	176.1	-64.2	174	0	0	0	112	P273 Q274 V280 S281 K297	P273-L277 WeakPolarHBondContact O-CG 3.37Å; P273-L277 PolarHBondContact O-N 3.26Å; P273-L277 VanDerWaalsContact O-N 3.15Å; Q274-L277 CarbonylContact O-C 3.59Å; Q274-L277 WeakPolarHBondContact O-CA 3.37Å; Q274-L277 WeakPolarHBondContact O-CB 3.42Å; Q274-L277 PolarHBondContact O-N 3.31Å; L277-V280 PolarHBondContact O-N 2.81Å; L277-S281 WeakPolarHBondContact O-CB 3.45Å; L277-S281 PolarHBondContact O-N 2.73Å; L277-S281 PolarHBondContact O-OG 3.06Å; L277-K297 HydrophobicContact CD2-CD 4.12Å; L277-K297 VanDerWaalsContact CD2-CE 3.43Å; L277-K297 VanDerWaalsContact CD2-NZ 3.28Å
278	D	89	Confident	87	Confident	84 Å²	84	56.3 Å²	56.3	45%	0.449	30%	0.302	S	S	.	.	H	α-helix	trans	-67.9	-44.9	-179.7	-59	-31.6	0	0	0	109.9	Q274 S281 S282	Q274-D278 PolarHBondContact O-N 2.85Å; Q274-D278 VanDerWaalsContact O-OD2 3.11Å; D278-S281 PolarHBondContact O-N 3.27Å; D278-S281 VanDerWaalsContact O-N 3.16Å; D278-S282 WeakPolarHBondContact O-CB 3.47Å; D278-S282 PolarHBondContact O-N 2.94Å; D278-S282 PolarHBondContact O-OG 3.12Å; D278-S282 VanDerWaalsContact O-OG 3.13Å
279	A	87.8	Confident	86.3	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-60.1	-45.9	172.5	0	0	0	0	0	112.7	I224 F242 F245 Y270 S275 S281 S282 M283	I224-A279 HydrophobicContact CD1-CB 4.4Å; F242-A279 HydrophobicContact CD1-CB 4.19Å; F242-A279 HydrophobicContact CE1-CB 4.45Å; F245-A279 HydrophobicContact CB-CB 4.02Å; F245-A279 HydrophobicContact CD2-CB 4.21Å; F245-A279 HydrophobicContact CG-CB 3.97Å; Y270-A279 HydrophobicContact CE2-CB 3.91Å; Y270-A279 WeakPolarHBondContact OH-CB 3.32Å; S275-A279 WeakPolarHBondContact O-CB 3.5Å; S275-A279 PolarHBondContact O-N 3.05Å; A279-S281 PolarHBondContact O-N 2.99Å; A279-S282 PolarHBondContact O-N 3.47Å; A279-M283 VanDerWaalsContact O-CB 3.25Å; A279-M283 WeakPolarHBondContact O-CB 3.43Å; A279-M283 PolarHBondContact O-N 3.38Å
280	V	88.1	Confident	85.9	Confident	21 Å²	21	60.6 Å²	60.6	13%	0.127	36%	0.356	C	S	.	.	H	α-helix	trans	-57.9	-38.5	174.7	166.5	0	0	0	0	111.5	I224 A276 L277 N284 V295 K297	I224-V280 HydrophobicContact CB-CG2 4.22Å; I224-V280 HydrophobicContact CG2-CG2 3.59Å; A276-V280 WeakPolarHBondContact O-CB 3.42Å; A276-V280 WeakPolarHBondContact O-CG2 3.34Å; A276-V280 PolarHBondContact O-N 2.76Å; A276-V280 VanDerWaalsContact O-N 3.08Å; L277-V280 PolarHBondContact O-N 2.81Å; V280-N284 VanDerWaalsContact O-CB 3.25Å; V280-N284 WeakPolarHBondContact O-CB 3.46Å; V280-V295 HydrophobicContact CB-CG1 4.41Å; V280-V295 HydrophobicContact CG2-CG1 3.91Å; V280-K297 HydrophobicContact CG1-CG 4.48Å; V280-K297 HydrophobicContact CG2-CG 4.19Å
281	S	86	Confident	85.6	Confident	96 Å²	96	63.9 Å²	63.9	67%	0.671	37%	0.372	S	S	*	.	H	α-helix	trans	-79.1	-31.1	-176.8	-52.9	0	0	0	0	113.2	L277 D278 A279	L277-S281 WeakPolarHBondContact O-CB 3.45Å; L277-S281 PolarHBondContact O-N 2.73Å; L277-S281 PolarHBondContact O-OG 3.06Å; D278-S281 PolarHBondContact O-N 3.27Å; D278-S281 VanDerWaalsContact O-N 3.16Å; A279-S281 PolarHBondContact O-N 2.99Å
282	S	86.8	Confident	85.6	Confident	73 Å²	73	66.3 Å²	66.3	51%	0.51	38%	0.378	S	S	.	.	H	α-helix	trans	-99.5	-29.6	-175	-59.2	0	0	0	0	115	F245 D278 A279	F245-S282 VanDerWaalsContact CE1-CB 3.46Å; D278-S282 WeakPolarHBondContact O-CB 3.47Å; D278-S282 PolarHBondContact O-N 2.94Å; D278-S282 PolarHBondContact O-OG 3.12Å; D278-S282 VanDerWaalsContact O-OG 3.13Å; A279-S282 PolarHBondContact O-N 3.47Å
283	M	85.8	Confident	85.6	Confident	4 Å²	4	60.4 Å²	60.4	2%	0.02	35%	0.353	C	S	.	.	H	α-helix	trans	-96	-10.7	-177.5	-67.2	-59.6	-58.4	0	0	113.9	V241 F242 F245 A279 L285 F286 L293 V295	V241-M283 HydrophobicContact CG1-CE 3.38Å; V241-M283 HydrophobicContact CG1-SD 4.2Å; F242-M283 HydrophobicContact CD1-CG 4.34Å; F242-M283 HydrophobicContact CE1-CB 3.85Å; F242-M283 HydrophobicContact CE1-CG 3.89Å; F242-M283 HydrophobicContact CE2-CE 4.07Å; F242-M283 HydrophobicContact CZ-CB 3.81Å; F242-M283 HydrophobicContact CZ-CE 4.24Å; F242-M283 HydrophobicContact CZ-CG 4.02Å; F245-M283 HydrophobicContact CD2-CG 4.19Å; F245-M283 HydrophobicContact CE2-CG 3.41Å; F245-M283 VanDerWaalsContact CE2-CG 3.41Å; F245-M283 HydrophobicContact CE2-SD 3.47Å; F245-M283 WeakPolarHBondContact CE2-SD 3.46Å; F245-M283 HydrophobicContact CZ-CG 3.65Å; F245-M283 HydrophobicContact CZ-SD 3.59Å; F245-M283 VanDerWaalsContact CZ-SD 3.59Å; A279-M283 VanDerWaalsContact O-CB 3.25Å; A279-M283 WeakPolarHBondContact O-CB 3.43Å; A279-M283 PolarHBondContact O-N 3.38Å; M283-L285 PolarHBondContact O-N 3.4Å; M283-F286 HydrophobicContact CE-CB 3.79Å; M283-F286 HydrophobicContact CE-CD1 3.56Å; M283-F286 HydrophobicContact CE-CD2 4.22Å; M283-F286 HydrophobicContact CE-CE1 4.2Å; M283-F286 HydrophobicContact CE-CG 3.58Å; M283-F286 VanDerWaalsContact O-CB 3.29Å; M283-F286 WeakPolarHBondContact O-CB 3.4Å; M283-F286 PolarHBondContact O-N 3.11Å; M283-F286 VanDerWaalsContact O-N 3.16Å; M283-F286 HydrophobicContact SD-CB 4.3Å; M283-F286 HydrophobicContact SD-CD2 4.17Å; M283-F286 HydrophobicContact SD-CG 4.07Å; M283-L293 HydrophobicContact CE-CD1 3.75Å; M283-V295 HydrophobicContact CB-CG2 3.81Å
284	N	87.4	Confident	85.7	Confident	48 Å²	48	59 Å²	59	26%	0.257	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	122.2	175	-177.2	57.8	0	0	0	110.6	Q185 V280 R294 V295	Q185-N284 PolarHBondContact NE2-ND2 3.22Å; Q185-N284 VanDerWaalsContact NE2-ND2 3.11Å; Q185-N284 PolarHBondContact NE2-OD1 3.37Å; V280-N284 VanDerWaalsContact O-CB 3.25Å; V280-N284 WeakPolarHBondContact O-CB 3.46Å; N284-R294 WeakPolarHBondContact OD1-CA 3.36Å; N284-V295 HydrophobicContact CB-CB 4.24Å; N284-V295 PolarHBondContact OD1-N 3.5Å; N284-V295 VanDerWaalsContact OD1-N 3.14Å
285	L	85.4	Confident	85.8	Confident	90 Å²	90	52.6 Å²	52.6	47%	0.471	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.1	22.4	-168.9	-47.6	178.5	0	0	0	115.1	M283 Y292 L293 R294	M283-L285 PolarHBondContact O-N 3.4Å; L285-Y292 WeakPolarHBondContact O-CD1 3.48Å; L285-L293 VanDerWaalsContact CA-O 3.28Å; L285-L293 WeakPolarHBondContact CA-O 3.3Å; L285-L293 PolarHBondContact N-O 2.82Å; L285-R294 HydrophobicContact CD2-CG 4.44Å
286	F	86.2	Confident	85.6	Confident	80 Å²	80	52.3 Å²	52.3	35%	0.351	31%	0.307	S	S	.	.			trans	-75.1	135.5	169.3	-173.8	-87.1	0	0	0	111.3	M283 L288 Y292 L293	M283-F286 HydrophobicContact CE-CB 3.79Å; M283-F286 HydrophobicContact CE-CD1 3.56Å; M283-F286 HydrophobicContact CE-CD2 4.22Å; M283-F286 HydrophobicContact CE-CE1 4.2Å; M283-F286 HydrophobicContact CE-CG 3.58Å; M283-F286 VanDerWaalsContact O-CB 3.29Å; M283-F286 WeakPolarHBondContact O-CB 3.4Å; M283-F286 PolarHBondContact O-N 3.11Å; M283-F286 VanDerWaalsContact O-N 3.16Å; M283-F286 HydrophobicContact SD-CB 4.3Å; M283-F286 HydrophobicContact SD-CD2 4.17Å; M283-F286 HydrophobicContact SD-CG 4.07Å; F286-L288 HydrophobicContact CD1-CB 4.27Å; F286-L288 HydrophobicContact CE1-CB 4.4Å; F286-L288 HydrophobicContact CE1-CD1 4.25Å; F286-Y292 CarbonylContact O-C 3.53Å; F286-Y292 WeakPolarHBondContact O-CA 3.41Å; F286-L293 HydrophobicContact CD1-CD1 4.36Å; F286-L293 PolarHBondContact O-N 3.47Å
287	D	87.7	Confident	85.4	Confident	102 Å²	102	57.1 Å²	57.1	55%	0.545	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	114.9	177.9	55.8	-53.9	0	0	0	112.5	Y292	D287-Y292 HydrophobicContact CB-CD1 3.99Å; D287-Y292 HydrophobicContact CB-CE1 3.86Å
288	L	82.9	Confident	84.9	Confident	30 Å²	30	54 Å²	54	16%	0.157	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	121.6	176.2	-164.6	65.5	0	0	0	109.5	L233 I238 V241 F286 G290 Q291 L293	L233-L288 HydrophobicContact CD1-CB 4.2Å; L233-L288 HydrophobicContact CD1-CD2 3.69Å; L233-L288 HydrophobicContact CD1-CG 3.67Å; L233-L288 HydrophobicContact CD2-CD2 4.2Å; L233-L288 HydrophobicContact CD2-CG 4.04Å; I238-L288 HydrophobicContact CD1-CD2 3.72Å; V241-L288 HydrophobicContact CG2-CD1 4.31Å; V241-L288 HydrophobicContact CG2-CD2 4.18Å; F286-L288 HydrophobicContact CD1-CB 4.27Å; F286-L288 HydrophobicContact CE1-CB 4.4Å; F286-L288 HydrophobicContact CE1-CD1 4.25Å; L288-G290 VanDerWaalsContact C-N 3.26Å; L288-G290 PolarHBondContact O-N 3.3Å; L288-Q291 PolarHBondContact N-O 3.09Å; L288-Q291 PolarHBondContact O-N 2.79Å; L288-Q291 VanDerWaalsContact O-O 3.13Å; L288-L293 HydrophobicContact CB-CD1 3.92Å; L288-L293 HydrophobicContact CB-CG 4.08Å; L288-L293 HydrophobicContact CD2-CD1 3.92Å
289	G	73.4	Confident	83.8	Confident	47 Å²	47	51.1 Å²	51.1	49%	0.485	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.8	28.8	-173	0	0	0	0	0	114	H230 Q291	H230-G289 PolarHBondContact CD2-O 3.41Å; G289-Q291 PolarHBondContact O-N 2.84Å
290	G	81.1	Confident	82.4	Confident	81 Å²	81	52.5 Å²	52.5	84%	0.835	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.1	9.7	-177	0	0	0	0	0	114.9	L288	L288-G290 VanDerWaalsContact C-N 3.26Å; L288-G290 PolarHBondContact O-N 3.3Å
291	Q	82.4	Confident	80.8	Confident	69 Å²	69	52 Å²	52	32%	0.322	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	139.6	175.4	-168.9	165.6	104.7	0	0	110.6	S228 H230 L288 G289 L293	S228-Q291 VanDerWaalsContact C-OE1 3.22Å; S228-Q291 WeakPolarHBondContact O-CG 3.47Å; S228-Q291 PolarHBondContact O-OE1 2.68Å; S228-Q291 VanDerWaalsContact O-OE1 3.07Å; S228-Q291 WeakPolarHBondContact OG-CG 3.32Å; S228-Q291 PolarHBondContact OG-OE1 2.67Å; H230-Q291 HydrophobicContact CB-CB 4.38Å; L288-Q291 PolarHBondContact N-O 3.09Å; L288-Q291 PolarHBondContact O-N 2.79Å; L288-Q291 VanDerWaalsContact O-O 3.13Å; G289-Q291 PolarHBondContact O-N 2.84Å; Q291-L293 PolarHBondContact O-N 3.48Å
292	Y	87.7	Confident	78.9	Confident	142 Å²	142	49.8 Å²	49.8	56%	0.557	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.6	110.8	-178.8	-64.5	-68.4	0	0	0	111.2	S228 L285 F286 D287	S228-Y292 VanDerWaalsContact CB-O 3.26Å; S228-Y292 WeakPolarHBondContact CB-O 3.37Å; S228-Y292 PolarHBondContact OG-O 2.86Å; L285-Y292 WeakPolarHBondContact O-CD1 3.48Å; F286-Y292 CarbonylContact O-C 3.53Å; F286-Y292 WeakPolarHBondContact O-CA 3.41Å; D287-Y292 HydrophobicContact CB-CD1 3.99Å; D287-Y292 HydrophobicContact CB-CE1 3.86Å
293	L	87.8	Confident	76.6	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	29%	0.291	C	S	.	.			trans	-58.4	142.2	172.8	-64.5	175.5	0	0	0	110.7	V226 V229 I238 F242 M283 L285 F286 L288 Q291	V226-L293 HydrophobicContact CG1-CD2 4.19Å; V229-L293 HydrophobicContact CB-CD2 4.36Å; V229-L293 HydrophobicContact CG2-CD2 3.9Å; I238-L293 HydrophobicContact CD1-CD2 4.44Å; F242-L293 HydrophobicContact CE2-CD1 4.17Å; F242-L293 HydrophobicContact CZ-CD1 4.49Å; M283-L293 HydrophobicContact CE-CD1 3.75Å; L285-L293 VanDerWaalsContact CA-O 3.28Å; L285-L293 WeakPolarHBondContact CA-O 3.3Å; L285-L293 PolarHBondContact N-O 2.82Å; F286-L293 HydrophobicContact CD1-CD1 4.36Å; F286-L293 PolarHBondContact O-N 3.47Å; L288-L293 HydrophobicContact CB-CD1 3.92Å; L288-L293 HydrophobicContact CB-CG 4.08Å; L288-L293 HydrophobicContact CD2-CD1 3.92Å; Q291-L293 PolarHBondContact O-N 3.48Å
294	R	87	Confident	74.3	Confident	43 Å²	43	58.3 Å²	58.3	16%	0.162	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	124.1	172	-59.8	-172.8	-171.3	-90.7	-4.2	108.8	F148 V226 A227 N284 L285	F148-R294 VanDerWaalsContact CE1-CD 3.41Å; V226-R294 CarbonylContact C-O 3.55Å; V226-R294 WeakPolarHBondContact CA-O 3.4Å; A227-R294 HydrophobicContact CB-CB 4.45Å; A227-R294 PolarHBondContact N-O 2.85Å; A227-R294 PolarHBondContact O-N 2.9Å; N284-R294 WeakPolarHBondContact OD1-CA 3.36Å; L285-R294 HydrophobicContact CD2-CG 4.44Å
295	V	88	Confident	71.9	Confident	2 Å²	2	61.4 Å²	61.4	1%	0.012	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	129.6	-170	-169.9	0	0	0	0	109.8	I224 Y225 V226 F242 V280 M283 N284	I224-V295 HydrophobicContact CB-CG1 4.46Å; I224-V295 HydrophobicContact CD1-CG1 3.83Å; Y225-V295 WeakPolarHBondContact O-CA 3.08Å; V226-V295 HydrophobicContact CG1-CG2 4.41Å; V226-V295 HydrophobicContact CG2-CG1 4.33Å; V226-V295 HydrophobicContact CG2-CG2 4.42Å; F242-V295 HydrophobicContact CE1-CG1 4.1Å; F242-V295 HydrophobicContact CE1-CG2 4.13Å; F242-V295 HydrophobicContact CZ-CG2 3.82Å; V280-V295 HydrophobicContact CB-CG1 4.41Å; V280-V295 HydrophobicContact CG2-CG1 3.91Å; M283-V295 HydrophobicContact CB-CG2 3.81Å; N284-V295 HydrophobicContact CB-CB 4.24Å; N284-V295 PolarHBondContact OD1-N 3.5Å; N284-V295 VanDerWaalsContact OD1-N 3.14Å
296	G	84.8	Confident	69.6	Low	6 Å²	6	65.3 Å²	65.3	6%	0.062	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	168.2	-178.6	0	0	0	0	0	112.5	I224 Y225	I224-G296 CarbonylContact C-O 3.54Å; I224-G296 VanDerWaalsContact CA-O 3.28Å; I224-G296 WeakPolarHBondContact CA-O 3.37Å; I224-G296 WeakPolarHBondContact CB-O 3.38Å; Y225-G296 PolarHBondContact N-O 2.84Å; Y225-G296 PolarHBondContact O-N 2.81Å
297	K	80.9	Confident	67	Low	111 Å²	111	66.1 Å²	66.1	48%	0.483	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	137.7	175.4	-56.2	179.1	-167.9	-177.1	0	109.2	L277 V280	L277-K297 HydrophobicContact CD2-CD 4.12Å; L277-K297 VanDerWaalsContact CD2-CE 3.43Å; L277-K297 VanDerWaalsContact CD2-NZ 3.28Å; V280-K297 HydrophobicContact CG1-CG 4.48Å; V280-K297 HydrophobicContact CG2-CG 4.19Å
298	A	76.2	Confident	64.5	Low	6 Å²	6	67.3 Å²	67.3	5%	0.05	39%	0.39	C	S	.	.			trans	-71.7	143	173.9	0	0	0	0	0	111.4	E177 R223	E177-A298 HydrophobicContact CG-CB 4.45Å; R223-A298 HydrophobicContact CB-CB 3.79Å; R223-A298 HydrophobicContact CG-CB 3.8Å; R223-A298 VanDerWaalsContact O-CB 3.23Å; R223-A298 WeakPolarHBondContact O-CB 3.08Å; R223-A298 PolarHBondContact O-N 3.49Å
299	V	66.1	Low	62.3	Low	23 Å²	23	71.5 Å²	71.5	14%	0.139	42%	0.417	C	S	.	.			trans	-117.8	-13.4	175.5	-176.1	0	0	0	0	110.1	M124 E177 A215 A218 P301	M124-V299 HydrophobicContact CE-CG1 3.68Å; M124-V299 HydrophobicContact SD-CG1 3.68Å; E177-V299 PolarHBondContact OE1-N 3.41Å; A215-V299 HydrophobicContact CB-CG1 4.34Å; A218-V299 WeakPolarHBondContact CB-O 3.41Å; V299-P301 WeakPolarHBondContact O-CD 3.44Å
300	T	59.1	Low	60.3	Low	28 Å²	28	74.7 Å²	74.7	17%	0.172	43%	0.428	C	S	.	.	S	Bend	trans	-87.1	108.5	172.9	-52	0	0	0	0	110.5	E177 R223	E177-T300 VanDerWaalsContact OE1-CB 3.25Å; E177-T300 WeakPolarHBondContact OE1-CB 3.03Å; E177-T300 PolarHBondContact OE1-N 3.42Å; E177-T300 PolarHBondContact OE1-OG1 3.1Å; E177-T300 PolarHBondContact OE2-OG1 3.34Å; R223-T300 PolarHBondContact NH1-O 3.36Å; R223-T300 VanDerWaalsContact NH1-O 3.17Å
301	P	54	Low	58.2	Low	12 Å²	12	77.7 Å²	77.7	8%	0.078	43%	0.432	C	S	.	.			trans	-67	152.3	179.8	28.7	-34.9	0	0	0	111.3	Y221 V299 M303	Y221-P301 HydrophobicContact CD2-CB 4.1Å; Y221-P301 HydrophobicContact CE2-CB 3.98Å; V299-P301 WeakPolarHBondContact O-CD 3.44Å; P301-M303 VanDerWaalsContact C-N 3.29Å; P301-M303 PolarHBondContact O-N 3.19Å
302	P	45.4	Very low	55.8	Low	49 Å²	49	77.2 Å²	77.2	32%	0.318	45%	0.446	S	S	.	.	S	Bend	trans	-77.5	78	-179.6	33.2	-34.7	0	0	0	111.3	Y221	Y221-P302 VanDerWaalsContact CD1-CD 3.42Å; Y221-P302 HydrophobicContact CD1-CG 3.24Å; Y221-P302 HydrophobicContact CD2-CG 4.37Å; Y221-P302 HydrophobicContact CE1-CG 3.58Å; Y221-P302 HydrophobicContact CG-CG 3.68Å
303	M	40	Very low	53.1	Low	131 Å²	131	73.9 Å²	73.9	65%	0.645	46%	0.455	S	S	*	.	S	Bend	trans	-114.8	146.9	152.7	-80.1	-173.2	168	0	0	109	P301 L305	P301-M303 VanDerWaalsContact C-N 3.29Å; P301-M303 PolarHBondContact O-N 3.19Å; M303-L305 PolarHBondContact O-N 3.27Å
304	P	36.9	Very low	50.7	Low	124 Å²	124	82.1 Å²	82.1	81%	0.805	50%	0.498	S	S	*	.			trans	-65.9	99.3	167.3	28.7	-32.5	0	0	0	108.3	L306	P304-L306 PolarHBondContact O-N 3.2Å
305	L	36.7	Very low	48.7	Very low	114 Å²	114	84.4 Å²	84.4	60%	0.597	52%	0.518	S	S	*	.			trans	-54.6	124.4	161.1	-82.2	167	0	0	0	107.1	M303 T307	M303-L305 PolarHBondContact O-N 3.27Å; L305-T307 VanDerWaalsContact C-N 3.3Å; L305-T307 PolarHBondContact O-N 3.35Å
306	L	36.3	Very low	46.7	Very low	172 Å²	172	89.5 Å²	89.5	90%	0.901	55%	0.552	S	S	*	*			trans	-63.4	93.6	175.1	-73.6	166.9	0	0	0	108.6	P304 P308	P304-L306 PolarHBondContact O-N 3.2Å; L306-P308 VanDerWaalsContact O-CD 3.23Å; L306-P308 WeakPolarHBondContact O-CD 3.4Å
307	T	32.8	Very low	44.4	Very low	97 Å²	97	92.4 Å²	92.4	60%	0.595	58%	0.575	S	S	*	*			trans	-74.4	117	174.4	50.3	0	0	0	0	109	L305 T309	L305-T307 VanDerWaalsContact C-N 3.3Å; L305-T307 PolarHBondContact O-N 3.35Å; T307-T309 PolarHBondContact O-N 2.89Å; T307-T309 PolarHBondContact O-OG1 3.37Å
308	P	34.6	Very low	42.5	Very low	127 Å²	127	91 Å²	91	83%	0.825	58%	0.584	S	S	*	*			trans	-75.9	66	167.4	33.4	-34.7	0	0	0	109.5	L306 T310	L306-P308 VanDerWaalsContact O-CD 3.23Å; L306-P308 WeakPolarHBondContact O-CD 3.4Å; P308-T310 PolarHBondContact O-N 2.84Å
309	T	36.2	Very low	40.8	Very low	117 Å²	117	94.4 Å²	94.4	72%	0.718	61%	0.612	S	S	*	*			trans	-76.5	66	177.2	34.9	0	0	0	0	111.3	T307	T307-T309 PolarHBondContact O-N 2.89Å; T307-T309 PolarHBondContact O-OG1 3.37Å
310	T	32.8	Very low	39.8	Very low	115 Å²	115	98 Å²	98	71%	0.706	63%	0.634	S	S	*	*			trans	-139.6	105.4	169.5	-49.1	0	0	0	0	110.4	P308 G312	P308-T310 PolarHBondContact O-N 2.84Å; T310-G312 PolarHBondContact O-N 2.88Å
311	P	37.4	Very low	38.9	Very low	144 Å²	144	99.6 Å²	99.6	94%	0.935	65%	0.65	S	S	*	*			trans	-76.2	74.5	168	32	-33.1	0	0	0	110.1
312	G	30	Very low	38.1	Very low	59 Å²	59	102.2 Å²	102.2	61%	0.608	67%	0.672	S	S	*	*			trans	-145.8	130.1	177	0	0	0	0	0	110	T310	T310-G312 PolarHBondContact O-N 2.88Å
313	G	32.4	Very low	37.8	Very low	72 Å²	72	103.1 Å²	103.1	74%	0.742	68%	0.684	S	S	*	*			trans	-92.9	-178.8	-162.9	0	0	0	0	0	116.9
314	L	38	Very low	37.7	Very low	172 Å²	172	99.6 Å²	99.6	90%	0.901	68%	0.676	S	S	*	*			trans	81.2	141.4	175	-50.1	174.4	0	0	0	116.6
315	P	44.5	Very low	37.7	Very low	92 Å²	92	97 Å²	97	60%	0.597	67%	0.665	S	S	*	*			cis	-131.5	166.8	-42.3	37.8	-24.8	0	0	0	112.9	A317	P315-A317 PolarHBondContact O-N 3.36Å
316	P	46.1	Very low	38	Very low	109 Å²	109	96.8 Å²	96.8	71%	0.708	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.6	4	-174.8	-23.1	35.1	0	0	0	117.6	A318 A319	P316-A318 PolarHBondContact O-N 2.66Å; P316-A319 PolarHBondContact O-N 2.92Å
317	A	36.9	Very low	38	Very low	66 Å²	66	92 Å²	92	55%	0.545	65%	0.653	S	S	.	*	H	α-helix	trans	-62.1	-38	-167.8	0	0	0	0	0	114.1	P315 A319 V320 A321	P315-A317 PolarHBondContact O-N 3.36Å; A317-A319 PolarHBondContact O-N 2.89Å; A317-V320 PolarHBondContact O-N 3.29Å; A317-A321 WeakPolarHBondContact O-CB 3.43Å; A317-A321 PolarHBondContact O-N 3.3Å
318	A	39.6	Very low	38.2	Very low	82 Å²	82	96 Å²	96	68%	0.678	66%	0.663	S	S	*	*	H	α-helix	trans	-65.7	-38.8	-177.2	0	0	0	0	0	113	P316 A322	P316-A318 PolarHBondContact O-N 2.66Å; A318-A322 PolarHBondContact O-N 2.88Å
319	A	41.6	Very low	38.6	Very low	78 Å²	78	97.1 Å²	97.1	65%	0.645	66%	0.66	S	S	*	*	H	α-helix	trans	-68.8	-36.7	178.3	0	0	0	0	0	112.1	P316 A317	P316-A319 PolarHBondContact O-N 2.92Å; A317-A319 PolarHBondContact O-N 2.89Å
320	V	44.2	Very low	38.9	Very low	97 Å²	97	98 Å²	98	59%	0.588	67%	0.666	S	S	*	*	H	α-helix	trans	-74.9	-35.5	178.8	-178.9	0	0	0	0	111.6	A317 A322 A323 A324	A317-V320 PolarHBondContact O-N 3.29Å; V320-A322 VanDerWaalsContact C-N 3.33Å; V320-A322 PolarHBondContact O-N 3.25Å; V320-A323 PolarHBondContact O-N 3.33Å; V320-A324 WeakPolarHBondContact O-CB 3.34Å; V320-A324 PolarHBondContact O-N 2.9Å
321	A	39.7	Very low	39.2	Very low	62 Å²	62	96.7 Å²	96.7	51%	0.512	67%	0.667	S	S	.	*	H	α-helix	trans	-60.3	-41	176.7	0	0	0	0	0	112.5	A317 A324 A325	A317-A321 WeakPolarHBondContact O-CB 3.43Å; A317-A321 PolarHBondContact O-N 3.3Å; A321-A324 PolarHBondContact O-N 3.46Å; A321-A325 PolarHBondContact O-N 2.8Å
322	A	37.8	Very low	39.3	Very low	67 Å²	67	98.7 Å²	98.7	55%	0.554	66%	0.664	S	S	*	*	H	α-helix	trans	-62.6	-41.6	175.5	0	0	0	0	0	112.4	A318 V320	A318-A322 PolarHBondContact O-N 2.88Å; V320-A322 VanDerWaalsContact C-N 3.33Å; V320-A322 PolarHBondContact O-N 3.25Å
323	A	39.3	Very low	39.5	Very low	68 Å²	68	105.5 Å²	105.5	56%	0.562	68%	0.679	S	S	*	*	H	α-helix	trans	-68.4	-35.8	177	0	0	0	0	0	113	V320 A325	V320-A323 PolarHBondContact O-N 3.33Å; A323-A325 PolarHBondContact O-N 3.27Å
324	A	38.2	Very low	39.7	Very low	57 Å²	57	106.1 Å²	106.1	47%	0.471	68%	0.678	S	S	.	*	H	α-helix	trans	-69.8	-29.3	-178.7	0	0	0	0	0	113.6	V320 A321	V320-A324 WeakPolarHBondContact O-CB 3.34Å; V320-A324 PolarHBondContact O-N 2.9Å; A321-A324 PolarHBondContact O-N 3.46Å
325	A	37.4	Very low	39.6	Very low	70 Å²	70	105.1 Å²	105.1	58%	0.579	68%	0.678	S	S	*	*	H	α-helix	trans	-67.4	-40.1	-179.7	0	0	0	0	0	112.8	A321 A323 A327	A321-A325 PolarHBondContact O-N 2.8Å; A323-A325 PolarHBondContact O-N 3.27Å; A325-A327 VanDerWaalsContact C-N 3.3Å; A325-A327 PolarHBondContact O-N 2.83Å
326	T	42.7	Very low	39	Very low	109 Å²	109	106.1 Å²	106.1	67%	0.669	70%	0.695	S	S	*	*	H	α-helix	trans	-70.9	-24.7	-179.2	-50.9	0	0	0	0	112.9	K328	T326-K328 VanDerWaalsContact C-N 3.26Å; T326-K328 PolarHBondContact O-N 2.82Å
327	A	36.2	Very low	38.2	Very low	71 Å²	71	104 Å²	104	59%	0.587	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	0.6	-172	0	0	0	0	0	115.7	A325	A325-A327 VanDerWaalsContact C-N 3.3Å; A325-A327 PolarHBondContact O-N 2.83Å
328	K	37	Very low	37.9	Very low	182 Å²	182	105.9 Å²	105.9	79%	0.791	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.6	-3.7	-174.7	-78.3	-165.7	172.3	-172.9	0	116.5	T326	T326-K328 VanDerWaalsContact C-N 3.26Å; T326-K328 PolarHBondContact O-N 2.82Å
329	I	42.2	Very low	37.3	Very low	150 Å²	150	108 Å²	108	77%	0.769	72%	0.717	S	S	*	*	S	Bend	trans	-93.6	-26.6	-175.7	-62.4	180	0	0	0	112.5	A331	I329-A331 VanDerWaalsContact C-N 3.26Å; I329-A331 PolarHBondContact O-N 2.87Å
330	T	42.6	Very low	36.7	Very low	137 Å²	137	110.3 Å²	110.3	84%	0.84	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.3	14.5	-177.5	32	0	0	0	0	115.5
331	A	38.7	Very low	35.9	Very low	87 Å²	87	114 Å²	114	72%	0.719	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.1	19.8	-171.2	0	0	0	0	0	114.9	I329	I329-A331 VanDerWaalsContact C-N 3.26Å; I329-A331 PolarHBondContact O-N 2.87Å
332	Q	39.9	Very low	35.3	Very low	186 Å²	186	115.1 Å²	115.1	87%	0.869	76%	0.757	S	S	*	*	S	Bend	trans	-147.7	39	179.2	-150.7	169.1	0.1	0	0	115.4
333	E	34.6	Very low	34.8	Very low	201 Å²	201	116.3 Å²	116.3	94%	0.939	77%	0.767	S	S	*	*			trans	-126.5	37.7	172.2	-148.3	178.2	165.9	0	0	113
334	A	36.3	Very low	34.2	Very low	86 Å²	86	121.4 Å²	121.4	71%	0.711	78%	0.784	S	S	*	*	S	Bend	trans	-126.1	139.6	166.4	0	0	0	0	0	109.2
335	V	35.7	Very low	33.7	Very low	151 Å²	151	123.7 Å²	123.7	92%	0.915	80%	0.802	S	S	*	*			trans	68.6	69.2	-174.1	-164.8	0	0	0	0	113.9
336	A	31.5	Very low	33.2	Very low	113 Å²	113	124.8 Å²	124.8	93%	0.934	81%	0.811	S	S	*	*			trans	-128.5	60.6	161.3	0	0	0	0	0	110.2
337	G	30.7	Very low	33.3	Very low	65 Å²	65	124.8 Å²	124.8	67%	0.67	81%	0.813	S	S	*	*			trans	-122.8	138.5	175.8	0	0	0	0	0	111.2
338	A	30.3	Very low	32.8	Very low	104 Å²	104	129.5 Å²	129.5	86%	0.86	82%	0.823	S	S	*	*			trans	66.1	102.6	-177.6	0	0	0	0	0	116.4
339	S	27.9	Very low	32.3	Very low	126 Å²	126	127.3 Å²	127.3	88%	0.881	82%	0.819	S	S	*	*			trans	-101.2	112	171.8	-50.7	0	0	0	0	111.1
340	V	27.1	Very low	31.6	Very low	127 Å²	127	127 Å²	127	77%	0.77	82%	0.818	S	S	*	*			trans	-143.5	119.1	168.4	-177.3	0	0	0	0	111.1
341	L	28.2	Very low	30.9	Very low	174 Å²	174	123.2 Å²	123.2	91%	0.911	81%	0.807	S	S	*	*			trans	21.9	128.5	151.2	-52.1	169.5	0	0	0	120.1
342	G	27.2	Very low	30.6	Very low	87 Å²	87	126.9 Å²	126.9	90%	0.897	81%	0.809	S	S	*	*			trans	175.1	82.8	166.4	0	0	0	0	0	117
343	A	27.2	Very low	30.1	Very low	92 Å²	92	125.2 Å²	125.2	76%	0.76	80%	0.801	S	S	*	*			trans	-71.6	165.3	-174.5	0	0	0	0	0	117.4
344	L	26.1	Very low	29.9	Very low	175 Å²	175	123.3 Å²	123.3	92%	0.916	80%	0.796	S	S	*	*			trans	86.5	153.9	151.3	-68.7	158.4	0	0	0	121.8
345	A	28.2	Very low	29.5	Very low	104 Å²	104	122.3 Å²	122.3	86%	0.86	79%	0.794	S	S	*	*			trans	84.2	137.4	165	0	0	0	0	0	120.7
346	A	26.8	Very low	29	Very low	93 Å²	93	123.3 Å²	123.3	77%	0.769	79%	0.794	S	S	*	*			trans	-127.2	-167.2	167.1	0	0	0	0	0	106.6
347	P	44.4	Very low	29.3	Very low	110 Å²	110	124 Å²	124	71%	0.714	79%	0.788	S	S	*	*			cis	-140.9	-158.4	3	32.4	-5.9	0	0	0	114.5
348	Q	26.4	Very low	29.4	Very low	170 Å²	170	130.1 Å²	130.1	79%	0.794	80%	0.799	S	S	*	*			trans	76.4	151.5	162.6	-64.2	-168.5	-36.7	0	0	117.5
349	L	26.7	Very low	29.4	Very low	135 Å²	135	130.2 Å²	130.2	71%	0.707	80%	0.8	S	S	*	*			cis	-165.1	175.3	-7.5	-108.5	170.6	0	0	0	107.3
350	L	26.6	Very low	29.5	Very low	143 Å²	143	130.7 Å²	130.7	75%	0.749	80%	0.798	S	S	*	*			cis	-160.5	157	-1.2	170	59.7	0	0	0	109.2
351	G	29.2	Very low	29.6	Very low	58 Å²	58	133.6 Å²	133.6	60%	0.598	81%	0.805	S	S	*	*			trans	101.5	112.7	159.6	0	0	0	0	0	115
352	Q	32.3	Very low	29.8	Very low	164 Å²	164	130 Å²	130	77%	0.766	80%	0.801	S	S	*	*				75.9	132.6	57.9	-72.3	-171.7	-88.6	0	0	114.9
353	Q	29.8	Very low	30	Very low	152 Å²	152	129.7 Å²	129.7	71%	0.71	79%	0.79	S	S	*	*			cis	-167.6	171.4	-11.7	-169.2	169.1	-25.2	0	0	111
354	I	28.8	Very low	30.1	Very low	160 Å²	160	134.6 Å²	134.6	82%	0.821	80%	0.797	S	S	*	*			trans	83.5	131	165.9	-45.8	176.7	0	0	0	115
355	G	27.5	Very low	30.4	Very low	66 Å²	66	130.4 Å²	130.4	68%	0.68	79%	0.788	S	S	*	*			cis	161.3	132.4	-10.7	0	0	0	0	0	113.9
356	L	25.7	Very low	31.1	Very low	172 Å²	172	132 Å²	132	90%	0.901	79%	0.789	S	S	*	*			trans	-145.1	148.8	173.2	-81.5	171.4	0	0	0	110.8
357	P	38	Very low	31.1	Very low	126 Å²	126	131 Å²	131	82%	0.818	79%	0.787	S	S	*	*			trans	-85.7	171	-178	34.8	-35.7	0	0	0	114.5
358	Q	32.5	Very low	30.6	Very low	194 Å²	194	132.3 Å²	132.3	91%	0.907	79%	0.793	S	S	*	*			trans	-108.1	163.8	-169.1	-53.9	161.3	-78.7	0	0	113.2
359	A	31.3	Very low	30.8	Very low	106 Å²	106	131.6 Å²	131.6	88%	0.876	79%	0.793	S	S	*	*			trans	-145.7	133	150.8	0	0	0	0	0	111.9
360	V	28.8	Very low	31	Very low	137 Å²	137	131.6 Å²	131.6	83%	0.83	80%	0.799	S	S	*	*			trans	-71.6	160	-175.1	-74	0	0	0	0	115.6
361	M	30.8	Very low	31.1	Very low	188 Å²	188	127.9 Å²	127.9	93%	0.926	80%	0.795	S	S	*	*			trans	-158.8	152	134.5	-101	-54.2	171.1	0	0	110.9
362	A	31.9	Very low	31.2	Very low	99 Å²	99	132.5 Å²	132.5	82%	0.818	81%	0.811	S	S	*	*			trans	-149.5	161.1	-177.2	0	0	0	0	0	114.9
363	A	31.9	Very low	31.2	Very low	80 Å²	80	130.8 Å²	130.8	66%	0.661	81%	0.813	S	S	*	*			trans	-42.1	146.9	-172.7	0	0	0	0	0	121.8
364	Q	29.2	Very low	31.7	Very low	194 Å²	194	129 Å²	129	91%	0.907	81%	0.814	S	S	*	*			trans	60.8	156.5	133.9	-64.7	169.1	9.2	0	0	119.7
365	A	31.5	Very low	31.7	Very low	88 Å²	88	128.4 Å²	128.4	73%	0.727	82%	0.817	S	S	*	*			cis	-178.9	-163.7	-21.1	0	0	0	0	0	106.5
366	P	42.2	Very low	31.8	Very low	137 Å²	137	135 Å²	135	89%	0.89	82%	0.822	S	S	*	*			cis	-118.7	-172.9	-48	39.9	-25.3	0	0	0	113.1
367	G	28.3	Very low	32.8	Very low	71 Å²	71	132.6 Å²	132.6	73%	0.732	82%	0.816	S	S	*	*			trans	-177.7	153.3	167.2	0	0	0	0	0	115.5
368	V	32.9	Very low	32.9	Very low	139 Å²	139	130.6 Å²	130.6	84%	0.842	80%	0.804	S	S	*	*			trans	-154	139.9	-177.4	-89.5	0	0	0	0	112.5
369	I	31.9	Very low	33.2	Very low	155 Å²	155	129.3 Å²	129.3	80%	0.795	80%	0.801	S	S	*	*				171	141.6	125.5	53.4	178.7	0	0	0	114.4
370	T	30.4	Very low	33.5	Very low	135 Å²	135	129.9 Å²	129.9	83%	0.828	80%	0.796	S	S	*	*			trans	36.7	134.5	147	60.2	0	0	0	0	124.3
371	G	27.8	Very low	33.9	Very low	65 Å²	65	129.9 Å²	129.9	67%	0.67	80%	0.796	S	S	*	*			trans	147	123.4	130	0	0	0	0	0	121.1
372	V	31.2	Very low	34.2	Very low	154 Å²	154	128.6 Å²	128.6	93%	0.933	79%	0.791	S	S	*	*			trans	61.4	153.1	149.5	-54.7	0	0	0	0	123.3
373	T	32	Very low	34.6	Very low	129 Å²	129	129.7 Å²	129.7	79%	0.791	79%	0.79	S	S	*	*			trans	-107.1	165	174.9	53	0	0	0	0	111.3
374	P	41.1	Very low	34.8	Very low	114 Å²	114	134.7 Å²	134.7	74%	0.74	80%	0.8	S	S	*	*				-155.9	144.3	108.2	37.6	-18.5	0	0	0	119
375	V	29	Very low	34.9	Very low	147 Å²	147	132.9 Å²	132.9	89%	0.891	80%	0.802	S	S	*	*				77.8	152.6	129	176.6	0	0	0	0	122.7
376	R	30.1	Very low	34.9	Very low	204 Å²	204	132.2 Å²	132.2	77%	0.77	80%	0.804	S	S	*	*			trans	-95.5	175.4	-171.9	-132.7	-172.6	173.7	-166.1	-0.6	111.1
377	P	45.6	Very low	34.6	Very low	122 Å²	122	133.9 Å²	133.9	79%	0.792	80%	0.804	S	S	*	*				-146.1	171.1	58.4	37.4	-16.1	0	0	0	117.3
378	P	40.9	Very low	34.7	Very low	85 Å²	85	136.7 Å²	136.7	55%	0.552	81%	0.807	S	S	*	*			trans	-108.5	177.9	175.9	41.7	-33.5	0	0	0	114.4
379	I	37.3	Very low	34.6	Very low	167 Å²	167	137.9 Å²	137.9	86%	0.856	81%	0.808	S	S	*	*			trans	-118.5	150.7	178.3	-70.5	174.5	0	0	0	109.6
380	P	39.7	Very low	35	Very low	118 Å²	118	136.1 Å²	136.1	77%	0.766	81%	0.807	S	S	*	*			trans	-105.1	177.1	-147.5	40.1	-36.5	0	0	0	117.5
381	V	35.3	Very low	35	Very low	137 Å²	137	136.1 Å²	136.1	83%	0.83	81%	0.807	S	S	*	*			trans	-123.9	143.8	177.2	174.2	0	0	0	0	110.1
382	I	38.5	Very low	35	Very low	160 Å²	160	140.9 Å²	140.9	82%	0.821	82%	0.816	S	S	*	*			trans	-147.2	160.4	167.3	25.8	175.8	0	0	0	109.8
383	P	39.9	Very low	34.9	Very low	123 Å²	123	138 Å²	138	80%	0.799	81%	0.808	S	S	*	*				-120.5	-171.4	-128.4	44.1	-36.2	0	0	0	117.1
384	Q	35.3	Very low	34.8	Very low	184 Å²	184	137.4 Å²	137.4	86%	0.86	81%	0.809	S	S	*	*			trans	-80	159.1	-172.9	-53.2	170	-58.3	0	0	115
385	V	32.3	Very low	35.1	Very low	156 Å²	156	137.6 Å²	137.6	95%	0.945	81%	0.811	S	S	*	*			trans	-144.1	152.2	135.8	-97.9	0	0	0	0	108.5
386	G	30.7	Very low	35.8	Very low	75 Å²	75	136.2 Å²	136.2	77%	0.773	81%	0.805	S	S	*	*			trans	-145.2	165.5	178.2	0	0	0	0	0	111.8
387	L	36.3	Very low	35.9	Very low	172 Å²	172	132.6 Å²	132.6	90%	0.901	81%	0.805	S	S	*	*			trans	-142	160.9	176.6	-103.6	167.8	0	0	0	111.5
388	V	30.4	Very low	35.1	Very low	129 Å²	129	135.1 Å²	135.1	78%	0.782	81%	0.811	S	S	*	*			trans	-83.2	160.1	-162.6	-65	0	0	0	0	114.3
389	N	31.4	Very low	34.6	Very low	165 Å²	165	135.6 Å²	135.6	88%	0.882	82%	0.816	S	S	*	*			trans	-132.7	110	171.3	-145.8	11.1	0	0	0	109.5
390	P	38.7	Very low	34.2	Very low	117 Å²	117	134.5 Å²	134.5	76%	0.76	81%	0.812	S	S	*	*			trans	-91.1	176.9	-179.5	36.2	-34.3	0	0	0	112.9
391	V	30.6	Very low	33.7	Very low	136 Å²	136	137.5 Å²	137.5	82%	0.824	82%	0.816	S	S	*	*			trans	-119.8	167.9	-170	104	0	0	0	0	112.2
392	L	28.1	Very low	33.3	Very low	164 Å²	164	135.4 Å²	135.4	86%	0.859	81%	0.813	S	S	*	*			trans	86.1	120.3	162.5	-155	73.2	0	0	0	118.5
393	A	29.2	Very low	32.7	Very low	94 Å²	94	131.9 Å²	131.9	78%	0.777	82%	0.816	S	S	*	*				171.2	129.3	116.8	0	0	0	0	0	114.3
394	S	31	Very low	31.9	Very low	116 Å²	116	129.5 Å²	129.5	81%	0.811	81%	0.814	S	S	*	*			trans	-91.2	-178.2	149.7	-30.7	0	0	0	0	108.2
395	P	46.7	Very low	31.4	Very low	119 Å²	119	126 Å²	126	77%	0.773	81%	0.81	S	S	*	*			cis	-142.2	-144.1	29.7	44	-20.2	0	0	0	110.9
396	P	44.1	Very low	31.1	Very low	118 Å²	118	125.6 Å²	125.6	77%	0.766	80%	0.802	S	S	*	*			cis	-130.3	-171.6	-13.9	38.3	-18.3	0	0	0	115.5
397	V	31.1	Very low	30.9	Very low	127 Å²	127	129.7 Å²	129.7	77%	0.77	80%	0.801	S	S	*	*			trans	-108.6	172.7	-177.1	-64.1	0	0	0	0	113
398	L	28.7	Very low	30.4	Very low	176 Å²	176	128.3 Å²	128.3	92%	0.921	79%	0.79	S	S	*	*			trans	-136.5	159.8	160.6	-142.2	79.7	0	0	0	110.6
399	S	31.1	Very low	30.1	Very low	95 Å²	95	128.8 Å²	128.8	66%	0.664	78%	0.784	S	S	*	*			trans	-140.1	150.4	-160.4	-50.2	0	0	0	0	114.7
400	N	29.8	Very low	29.7	Very low	143 Å²	143	128.8 Å²	128.8	77%	0.765	78%	0.776	S	S	*	*			trans	-175.5	137.1	148	-90.8	-18.6	0	0	0	107.7
401	Q	27.9	Very low	29.1	Very low	181 Å²	181	132.6 Å²	132.6	85%	0.846	78%	0.781	S	S	*	*				64.9	132.8	61.9	-66.2	-164.2	19.4	0	0	114.8
402	A	27.1	Very low	28.8	Very low	93 Å²	93	133.5 Å²	133.5	77%	0.769	78%	0.776	S	S	*	*			cis	-170	147.9	-14.7	0	0	0	0	0	113
403	G	25.6	Very low	28.7	Very low	87 Å²	87	135.1 Å²	135.1	90%	0.897	78%	0.779	S	S	*	*			trans	70.4	155.6	144.9	0	0	0	0	0	123
404	G	24.6	Very low	28.5	Very low	73 Å²	73	140 Å²	140	75%	0.753	78%	0.783	S	S	*	*			trans	133.4	52.2	141.7	0	0	0	0	0	124.4
405	S	24.8	Very low	28.2	Very low	110 Å²	110	143.6 Å²	143.6	77%	0.769	79%	0.787	S	S	*	*			trans	37.7	122.1	139.1	61.8	0	0	0	0	125.2
406	N	24.8	Very low	27.4	Very low	147 Å²	147	146.4 Å²	146.4	79%	0.786	79%	0.79	S	S	*	*				68.1	144.5	128.9	-84.8	-10.4	0	0	0	126
407	Q	26.3	Very low	26.4	Very low	162 Å²	162	147.7 Å²	147.7	76%	0.757	80%	0.796	S	S	*	*			trans	72.1	151.9	152.7	-72.5	174.6	11	0	0	119.1
408	Q	25.7	Very low	26.3	Very low	142 Å²	142	149 Å²	149	66%	0.664	80%	0.797	S	S	*	*			cis	-168.4	151.3	-17.7	173.5	165.8	-29.5	0	0	111.8
409	E	25	Very low	26.3	Very low	140 Å²	140	149.6 Å²	149.6	65%	0.654	80%	0.795	S	S	*	*			trans	55.6	108.4	160.5	-80.4	-178.8	100.9	0	0	124.6
410	K	23.1	Very low	26.1	Very low	164 Å²	164	153 Å²	153	71%	0.713	81%	0.806	S	S	*	*				60.7	118.3	101.2	-168.6	-172.5	-174.1	-178	0	121.3
411	K	25.7	Very low	25.9	Very low	197 Å²	197	149.3 Å²	149.3	86%	0.857	80%	0.803	S	S	*	*				-165.1	162.4	124.2	-112.4	177.4	-178.2	-173.7	0	114.1
412	E	24.7	Very low	25.9	Very low	155 Å²	155	147.9 Å²	147.9	72%	0.724	81%	0.806	S	S	*	*			trans	-97.9	158.1	-172.4	-56.7	128.4	100.5	0	0	113.5
413	E	25.3	Very low	26.1	Very low	199 Å²	199	146.7 Å²	146.7	93%	0.93	80%	0.803	S	S	*	*				-166.2	-178.7	114.6	-105.6	-179.2	149	0	0	112.5
414	K	25.7	Very low	26.3	Very low	196 Å²	196	151.6 Å²	151.6	85%	0.852	80%	0.803	S	S	*	*			trans	-101.8	163.9	-160.5	-52.5	167.6	175.9	175	0	114.3
415	E	24.3	Very low	26.8	Very low	192 Å²	192	157.3 Å²	157.3	90%	0.897	81%	0.81	S	S	*	*				-168.5	174.1	103.6	-159	138.4	117.6	0	0	111.2
416	E	29.6	Very low	27.3	Very low	177 Å²	177	158.8 Å²	158.8	83%	0.827	81%	0.806	S	S	*	*			trans	-102.7	144	-173.2	-61.9	170.6	66.6	0	0	113.5
417	T	23.8	Very low	28.2	Very low	146 Å²	146	159.7 Å²	159.7	90%	0.896	81%	0.81	S	S	*	*			trans	-169.9	167	135.1	6.9	0	0	0	0	112.9
418	L	29.9	Very low	28.9	Very low	153 Å²	153	155.4 Å²	155.4	80%	0.801	80%	0.798	S	S	*	*			trans	-104.1	141.2	-176.7	-60.4	74.7	0	0	0	111.7
419	Q	27.3	Very low	29.7	Very low	189 Å²	189	155.1 Å²	155.1	88%	0.883	80%	0.801	S	S	*	*				172.9	166.1	115.9	-94.4	176.5	8.6	0	0	113.5
420	D	26.7	Very low	30.7	Very low	166 Å²	166	156.7 Å²	156.7	89%	0.888	81%	0.808	S	S	*	*			trans	-36.2	148.1	179.8	-77.3	-120.6	0	0	0	118.6
421	G	27.1	Very low	31.7	Very low	67 Å²	67	157.9 Å²	157.9	69%	0.691	82%	0.816	S	S	*	*			trans	157.7	81.2	156.6	0	0	0	0	0	117.3
422	T	27.8	Very low	32.5	Very low	150 Å²	150	156.9 Å²	156.9	92%	0.92	82%	0.815	S	S	*	*			trans	36	120.9	150.6	57.3	0	0	0	0	121
423	G	30.3	Very low	33	Very low	69 Å²	69	157.9 Å²	157.9	71%	0.711	82%	0.822	S	S	*	*			trans	126.3	116.6	132.1	0	0	0	0	0	119.1
424	Q	30.6	Very low	33.6	Very low	190 Å²	190	153.6 Å²	153.6	89%	0.888	81%	0.813	S	S	*	*			trans	72.1	147.1	153.6	-54.2	-176.4	-98.4	0	0	119
425	E	34.1	Very low	34.4	Very low	192 Å²	192	152.4 Å²	152.4	90%	0.897	82%	0.815	S	S	*	*			trans	65.9	148.8	177	-51.6	-163.3	104.2	0	0	114.2
426	M	34.6	Very low	35.5	Very low	142 Å²	142	147.2 Å²	147.2	70%	0.7	80%	0.799	S	S	*	*			cis	-119.6	146.4	20	-69.4	155.7	46.8	0	0	114.6	S428	M426-S428 WeakPolarHBondContact CE-OG 3.33Å
427	L	45.1	Very low	36.7	Very low	166 Å²	166	141.3 Å²	141.3	87%	0.869	79%	0.786	S	S	*	*			trans	-104.5	85.6	162.8	-108.1	154.4	0	0	0	108.2
428	S	39.9	Very low	38.1	Very low	71 Å²	71	137.5 Å²	137.5	50%	0.497	77%	0.765	S	S	.	*			trans	-155.5	-33.2	175.3	56.2	0	0	0	0	116.1	M426 Q430	M426-S428 WeakPolarHBondContact CE-OG 3.33Å; S428-Q430 PolarHBondContact O-N 3.43Å
429	D	43	Very low	39.4	Very low	136 Å²	136	133.8 Å²	133.8	73%	0.727	75%	0.752	S	S	*	*			trans	-79.3	20	-172.4	-63.2	-37.8	0	0	0	115	E431	D429-E431 PolarHBondContact O-N 2.88Å
430	Q	46.8	Very low	40.8	Very low	173 Å²	173	127.4 Å²	127.4	81%	0.808	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.4	19.6	-171.8	-150.5	-178.2	-16.1	0	0	114.9	S428	S428-Q430 PolarHBondContact O-N 3.43Å
431	E	43.5	Very low	42.1	Very low	189 Å²	189	127.6 Å²	127.6	88%	0.883	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.8	1.1	-177.1	-64.7	-157.5	158.8	0	0	116.4	D429	D429-E431 PolarHBondContact O-N 2.88Å
432	H	42.6	Very low	43.5	Very low	177 Å²	177	130.3 Å²	130.3	82%	0.819	72%	0.715	S	S	*	*	S	Bend	trans	-152.8	63.3	166.6	-154.9	-83.8	0	0	0	116.7
433	M	35	Very low	45	Very low	176 Å²	176	129.1 Å²	129.1	87%	0.867	70%	0.7	S	S	*	*			trans	-128.4	130.6	160	-86.7	-68.3	-174.5	0	0	110.9
434	S	37.8	Very low	46.4	Very low	108 Å²	108	129.6 Å²	129.6	76%	0.755	69%	0.689	S	S	*	*			trans	-68.7	136.5	177.7	41.6	0	0	0	0	111.2	S436	S434-S436 PolarHBondContact O-N 2.88Å
435	I	42.6	Very low	47.6	Very low	172 Å²	172	125.4 Å²	125.4	88%	0.882	67%	0.671	S	S	*	*			trans	-65.3	100	174.9	-74.2	175.4	0	0	0	109
436	S	46.5	Very low	48.6	Very low	82 Å²	82	123.6 Å²	123.6	57%	0.573	66%	0.662	S	S	*	*			trans	-86.3	136.5	169.6	178.2	0	0	0	0	109.8	S434 S438 S439	S434-S436 PolarHBondContact O-N 2.88Å; S436-S438 PolarHBondContact O-N 2.73Å; S436-S439 PolarHBondContact O-N 2.84Å
437	G	55.3	Low	49.5	Very low	54 Å²	54	123.8 Å²	123.8	56%	0.557	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.3	-10.6	-175.7	0	0	0	0	0	115.5	S439 A440 R441	G437-S439 VanDerWaalsContact C-N 3.3Å; G437-S439 PolarHBondContact O-N 2.91Å; G437-A440 PolarHBondContact O-N 3.24Å; G437-R441 WeakPolarHBondContact O-CB 3.31Å; G437-R441 PolarHBondContact O-N 2.73Å
438	S	52.7	Low	49.6	Very low	65 Å²	65	122.4 Å²	122.4	46%	0.455	65%	0.652	S	S	.	*	H	α-helix	trans	-55.8	-39	171.8	-171.6	0	0	0	0	113.3	S436 R441 H442	S436-S438 PolarHBondContact O-N 2.73Å; S438-R441 WeakPolarHBondContact O-CB 3.34Å; S438-R441 PolarHBondContact O-N 2.87Å; S438-H442 PolarHBondContact O-N 3.49Å; S438-H442 PolarHBondContact O-ND1 3.3Å
439	S	57.4	Low	49.9	Very low	76 Å²	76	126.3 Å²	126.3	53%	0.531	67%	0.666	S	S	.	*	H	α-helix	trans	-70.1	-46.1	-179.2	-174.9	0	0	0	0	111.6	S436 G437 R441 H442 M443	S436-S439 PolarHBondContact O-N 2.84Å; G437-S439 VanDerWaalsContact C-N 3.3Å; G437-S439 PolarHBondContact O-N 2.91Å; S439-R441 VanDerWaalsContact C-N 3.29Å; S439-R441 PolarHBondContact O-N 3.03Å; S439-H442 PolarHBondContact O-N 3.28Å; S439-H442 VanDerWaalsContact O-N 3.12Å; S439-M443 PolarHBondContact O-N 3.5Å
440	A	57	Low	50.1	Low	55 Å²	55	128.7 Å²	128.7	46%	0.455	67%	0.665	S	S	.	*	H	α-helix	trans	-57.8	-42	172.4	0	0	0	0	0	111.4	G437 H442 M443 V444	G437-A440 PolarHBondContact O-N 3.24Å; A440-H442 VanDerWaalsContact C-N 3.34Å; A440-H442 PolarHBondContact O-N 3.4Å; A440-M443 PolarHBondContact O-N 2.96Å; A440-V444 VanDerWaalsContact O-CB 3.3Å; A440-V444 WeakPolarHBondContact O-CB 3.33Å; A440-V444 VanDerWaalsContact O-CG2 3.26Å; A440-V444 WeakPolarHBondContact O-CG2 3.44Å; A440-V444 PolarHBondContact O-N 3.1Å
441	R	54.7	Low	50.4	Low	170 Å²	170	127.5 Å²	127.5	64%	0.642	66%	0.657	S	S	*	*	H	α-helix	trans	-59.4	-40	175.3	-171	-179.3	-175.3	178.8	4.3	112.7	G437 S438 S439 M445	G437-R441 WeakPolarHBondContact O-CB 3.31Å; G437-R441 PolarHBondContact O-N 2.73Å; S438-R441 WeakPolarHBondContact O-CB 3.34Å; S438-R441 PolarHBondContact O-N 2.87Å; S439-R441 VanDerWaalsContact C-N 3.29Å; S439-R441 PolarHBondContact O-N 3.03Å; R441-M445 HydrophobicContact CG-SD 4.41Å; R441-M445 WeakPolarHBondContact O-CB 3.37Å; R441-M445 WeakPolarHBondContact O-CG 3.15Å; R441-M445 PolarHBondContact O-N 3.28Å
442	H	55.8	Low	51.2	Low	124 Å²	124	121.3 Å²	121.3	57%	0.574	64%	0.635	S	S	*	*	H	α-helix	trans	-70.5	-41.8	176.3	-77.5	82.8	0	0	0	112.5	S438 S439 A440 V444 M445 Q446	S438-H442 PolarHBondContact O-N 3.49Å; S438-H442 PolarHBondContact O-ND1 3.3Å; S439-H442 PolarHBondContact O-N 3.28Å; S439-H442 VanDerWaalsContact O-N 3.12Å; A440-H442 VanDerWaalsContact C-N 3.34Å; A440-H442 PolarHBondContact O-N 3.4Å; H442-V444 VanDerWaalsContact C-N 3.32Å; H442-V444 PolarHBondContact O-N 3.03Å; H442-M445 PolarHBondContact O-N 2.97Å; H442-Q446 WeakPolarHBondContact O-CB 3.19Å; H442-Q446 PolarHBondContact O-N 3.33Å
443	M	59.5	Low	52.4	Low	124 Å²	124	120.6 Å²	120.6	61%	0.611	63%	0.632	S	S	*	*	H	α-helix	trans	-63.1	-38.6	173.7	-70	177.7	63.5	0	0	112.3	S439 A440 K447	S439-M443 PolarHBondContact O-N 3.5Å; A440-M443 PolarHBondContact O-N 2.96Å; M443-K447 WeakPolarHBondContact O-CB 3.39Å; M443-K447 PolarHBondContact O-N 3.07Å
444	V	60.3	Low	54.5	Low	79 Å²	79	112.6 Å²	112.6	48%	0.479	59%	0.593	S	S	.	*	H	α-helix	trans	-71	-41.8	176.9	167.2	0	0	0	0	111	A440 H442 K447 L448	A440-V444 VanDerWaalsContact O-CB 3.3Å; A440-V444 WeakPolarHBondContact O-CB 3.33Å; A440-V444 VanDerWaalsContact O-CG2 3.26Å; A440-V444 WeakPolarHBondContact O-CG2 3.44Å; A440-V444 PolarHBondContact O-N 3.1Å; H442-V444 VanDerWaalsContact C-N 3.32Å; H442-V444 PolarHBondContact O-N 3.03Å; V444-K447 PolarHBondContact O-N 2.89Å; V444-K447 VanDerWaalsContact O-N 3.17Å; V444-L448 HydrophobicContact CG1-CD1 3.75Å; V444-L448 WeakPolarHBondContact O-CB 3.42Å; V444-L448 PolarHBondContact O-N 3.21Å
445	M	56	Low	56.6	Low	103 Å²	103	108.7 Å²	108.7	51%	0.507	57%	0.565	S	S	.	*	H	α-helix	trans	-66.3	-38	173.9	-79.3	-176.3	149.3	0	0	112.6	R441 H442 K447 L448 L449	R441-M445 HydrophobicContact CG-SD 4.41Å; R441-M445 WeakPolarHBondContact O-CB 3.37Å; R441-M445 WeakPolarHBondContact O-CG 3.15Å; R441-M445 PolarHBondContact O-N 3.28Å; H442-M445 PolarHBondContact O-N 2.97Å; M445-K447 VanDerWaalsContact C-N 3.29Å; M445-K447 PolarHBondContact O-N 3.43Å; M445-L448 PolarHBondContact O-N 2.93Å; M445-L449 WeakPolarHBondContact O-CB 3.49Å; M445-L449 PolarHBondContact O-N 3.48Å
446	Q	55	Low	58.8	Low	153 Å²	153	100.5 Å²	100.5	72%	0.715	52%	0.523	S	S	*	.	H	α-helix	trans	-67.8	-25.9	171.1	-79.5	-169.1	-12.2	0	0	113.5	H442 R450	H442-Q446 WeakPolarHBondContact O-CB 3.19Å; H442-Q446 PolarHBondContact O-N 3.33Å; Q446-R450 PolarHBondContact O-N 3.14Å
447	K	52.3	Low	60.8	Low	147 Å²	147	96.6 Å²	96.6	64%	0.639	50%	0.495	S	S	*	.	H	α-helix	trans	-78	-40.4	171.2	-84.8	-172.4	169.8	-170.2	0	112.6	M443 V444 M445 L449 R450	M443-K447 WeakPolarHBondContact O-CB 3.39Å; M443-K447 PolarHBondContact O-N 3.07Å; V444-K447 PolarHBondContact O-N 2.89Å; V444-K447 VanDerWaalsContact O-N 3.17Å; M445-K447 VanDerWaalsContact C-N 3.29Å; M445-K447 PolarHBondContact O-N 3.43Å; K447-L449 PolarHBondContact O-N 3.23Å; K447-R450 WeakPolarHBondContact O-CB 3.36Å; K447-R450 PolarHBondContact O-N 3.08Å
448	L	48.8	Very low	62.4	Low	137 Å²	137	94.1 Å²	94.1	72%	0.717	47%	0.47	S	S	*	.	H	α-helix	trans	-68.7	-19.6	174.1	-79.5	160.9	0	0	0	113.2	V444 M445	V444-L448 HydrophobicContact CG1-CD1 3.75Å; V444-L448 WeakPolarHBondContact O-CB 3.42Å; V444-L448 PolarHBondContact O-N 3.21Å; M445-L448 PolarHBondContact O-N 2.93Å
449	L	44.8	Very low	64.1	Low	152 Å²	152	91.1 Å²	91.1	80%	0.796	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	2.2	169	-97.2	65	0	0	0	113.9	M445 K447 K451	M445-L449 WeakPolarHBondContact O-CB 3.49Å; M445-L449 PolarHBondContact O-N 3.48Å; K447-L449 PolarHBondContact O-N 3.23Å; L449-K451 PolarHBondContact O-N 3Å
450	R	47.2	Very low	65.6	Low	187 Å²	187	90.5 Å²	90.5	71%	0.706	43%	0.434	S	S	*	.	S	Bend	trans	-73.8	114.4	159	-66.1	-174.3	-176.2	-160.7	-2.2	106.9	Q446 K447 S452	Q446-R450 PolarHBondContact O-N 3.14Å; K447-R450 WeakPolarHBondContact O-CB 3.36Å; K447-R450 PolarHBondContact O-N 3.08Å; R450-S452 PolarHBondContact O-N 2.99Å
451	K	53.1	Low	66.8	Low	148 Å²	148	91.5 Å²	91.5	64%	0.643	43%	0.432	S	S	*	.			trans	-46.1	138.6	160.6	-84.4	-171	142.7	-151.8	0	109.3	L449 E453 D541	L449-K451 PolarHBondContact O-N 3Å; K451-E453 PolarHBondContact O-N 3.34Å; K451-E453 VanDerWaalsContact O-N 3.15Å; K451-D541 WeakPolarHBondContact CE-OD2 3.37Å; K451-D541 IonicContact NZ-OD1 3.18Å; K451-D541 IonicContact NZ-OD2 2.73Å; K451-D541 PolarHBondContact NZ-OD2 3.16Å
452	S	61.9	Low	67.9	Low	58 Å²	58	84.4 Å²	84.4	41%	0.406	41%	0.407	S	S	.	.			trans	-45.2	117.4	159.5	29.3	0	0	0	0	108.3	R450 S454 D543	R450-S452 PolarHBondContact O-N 2.99Å; S452-S454 VanDerWaalsContact C-N 3.34Å; S452-S454 PolarHBondContact O-N 3.4Å; S452-S454 PolarHBondContact O-OG 2.84Å; S452-S454 VanDerWaalsContact O-OG 3.06Å; S452-D543 PolarHBondContact OG-OD2 3.4Å
453	E	66.6	Low	69.1	Low	162 Å²	162	79.6 Å²	79.6	76%	0.757	39%	0.386	S	S	*	.			trans	-68.8	95.6	-179.5	49.8	-175.7	92.3	0	0	109	K451 A515	K451-E453 PolarHBondContact O-N 3.34Å; K451-E453 VanDerWaalsContact O-N 3.15Å; E453-A515 HydrophobicContact CB-CB 4.4Å; E453-A515 HydrophobicContact CG-CB 4.47Å
454	S	78.4	Confident	69.9	Low	8 Å²	8	73.7 Å²	73.7	6%	0.056	36%	0.357	C	S	.	.			trans	-68.4	143.3	-164.9	-39	0	0	0	0	110.9	S452 M518 Y540	S452-S454 VanDerWaalsContact C-N 3.34Å; S452-S454 PolarHBondContact O-N 3.4Å; S452-S454 PolarHBondContact O-OG 2.84Å; S452-S454 VanDerWaalsContact O-OG 3.06Å; S454-M518 WeakPolarHBondContact O-CE 3.26Å; S454-Y540 WeakPolarHBondContact CB-O 3.48Å; S454-Y540 PolarHBondContact OG-O 3.43Å
455	T	83.5	Confident	70.8	Confident	26 Å²	26	71.9 Å²	71.9	16%	0.16	35%	0.347	C	S	.	.			trans	-99.7	-2.7	178.6	76.6	0	0	0	0	112.9	F512 A515 Q542	T455-F512 WeakPolarHBondContact CB-O 3.3Å; T455-F512 PolarHBondContact O-N 2.86Å; T455-F512 PolarHBondContact OG1-O 2.85Å; T455-A515 HydrophobicContact CG2-CB 4.31Å; T455-Q542 PolarHBondContact OG1-NE2 3.37Å; T455-Q542 PolarHBondContact OG1-OE1 3.44Å
456	V	87.9	Confident	71.8	Confident	0 Å²	0	73 Å²	73	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	131.9	179.7	-171.2	0	0	0	0	109.9	V510 E511 M518 Y540 F545	V456-V510 WeakPolarHBondContact CA-O 3.2Å; V456-E511 HydrophobicContact CG2-CB 4.23Å; V456-E511 HydrophobicContact CG2-CG 4.17Å; V456-M518 VanDerWaalsContact C-SD 3.52Å; V456-Y540 PolarHBondContact O-N 2.78Å; V456-F545 HydrophobicContact CB-CG 4.43Å; V456-F545 HydrophobicContact CG1-CB 4.33Å; V456-F545 HydrophobicContact CG1-CD1 4.41Å; V456-F545 HydrophobicContact CG1-CD2 3.73Å; V456-F545 HydrophobicContact CG1-CE2 4.03Å; V456-F545 HydrophobicContact CG1-CG 3.92Å; V456-F545 HydrophobicContact CG1-CZ 4.49Å; V456-F545 HydrophobicContact CG2-CB 4.06Å; V456-F545 HydrophobicContact CG2-CD1 3.65Å; V456-F545 HydrophobicContact CG2-CD2 4.42Å; V456-F545 HydrophobicContact CG2-CE1 4.13Å; V456-F545 HydrophobicContact CG2-CG 3.8Å
457	M	88.3	Confident	72.9	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	156.5	164.2	65.3	164.5	164.9	0	0	111.6	L459 F509 V510 F512 M518 A521 I522 L525 A537 E538	M457-L459 HydrophobicContact CE-CD1 3.88Å; M457-L459 HydrophobicContact CG-CD1 4.01Å; M457-L459 HydrophobicContact SD-CD1 3.85Å; M457-L459 HydrophobicContact SD-CG 4.43Å; M457-F509 WeakPolarHBondContact O-CA 3.41Å; M457-V510 HydrophobicContact CE-CB 4.35Å; M457-V510 HydrophobicContact CG-CB 4.28Å; M457-V510 PolarHBondContact N-O 2.87Å; M457-V510 PolarHBondContact O-N 3.26Å; M457-F512 HydrophobicContact CE-CE2 3.42Å; M457-F512 VanDerWaalsContact CE-CE2 3.42Å; M457-F512 HydrophobicContact CE-CZ 3.61Å; M457-F512 HydrophobicContact CG-CE2 4.14Å; M457-F512 HydrophobicContact SD-CE2 4.47Å; M457-M518 HydrophobicContact CB-CG 3.87Å; M457-M518 HydrophobicContact CB-SD 4.27Å; M457-M518 HydrophobicContact CG-CG 4.23Å; M457-A521 HydrophobicContact CE-CB 3.64Å; M457-A521 HydrophobicContact SD-CB 4.38Å; M457-I522 HydrophobicContact CB-CD1 3.89Å; M457-I522 HydrophobicContact CB-CG1 3.89Å; M457-I522 HydrophobicContact CG-CG1 4.38Å; M457-I522 HydrophobicContact SD-CG1 3.64Å; M457-L525 HydrophobicContact CE-CD1 3.99Å; M457-A537 HydrophobicContact SD-CB 4.4Å; M457-E538 CarbonylContact C-O 3.54Å; M457-E538 VanDerWaalsContact CA-O 3.28Å; M457-E538 WeakPolarHBondContact CA-O 3.28Å; M457-E538 WeakPolarHBondContact CB-O 3.26Å
458	V	89.6	Confident	74.3	Confident	2 Å²	2	64.7 Å²	64.7	1%	0.012	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	128.9	167.5	65.1	0	0	0	0	109.4	R460 K507 I508 F509 A537 E538 Y540	V458-R460 HydrophobicContact CG2-CG 4.16Å; V458-K507 HydrophobicContact CG2-CB 4.08Å; V458-I508 CarbonylContact C-O 3.54Å; V458-I508 WeakPolarHBondContact CA-O 3.27Å; V458-F509 HydrophobicContact CB-CD1 3.8Å; V458-F509 HydrophobicContact CB-CE1 3.8Å; V458-F509 HydrophobicContact CG2-CD1 3.81Å; V458-F509 HydrophobicContact CG2-CE1 3.55Å; V458-F509 HydrophobicContact CG2-CE2 4.34Å; V458-F509 HydrophobicContact CG2-CG 4.31Å; V458-F509 HydrophobicContact CG2-CZ 3.85Å; V458-A537 WeakPolarHBondContact O-CA 3.4Å; V458-E538 HydrophobicContact CG1-CB 4.13Å; V458-E538 PolarHBondContact N-O 3.48Å; V458-E538 PolarHBondContact O-N 3.49Å; V458-Y540 HydrophobicContact CB-CD2 4.24Å; V458-Y540 HydrophobicContact CG1-CD2 4.06Å
459	L	88.4	Confident	75.9	Confident	3 Å²	3	63.8 Å²	63.8	2%	0.016	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	129.9	169.5	-63.7	85.8	0	0	0	108.3	M457 M462 I508 V510 L525 V535 V536 A537	M457-L459 HydrophobicContact CE-CD1 3.88Å; M457-L459 HydrophobicContact CG-CD1 4.01Å; M457-L459 HydrophobicContact SD-CD1 3.85Å; M457-L459 HydrophobicContact SD-CG 4.43Å; L459-M462 HydrophobicContact CB-SD 4.48Å; L459-M462 HydrophobicContact CD2-SD 3.67Å; L459-I508 HydrophobicContact CB-CB 4.43Å; L459-I508 PolarHBondContact N-O 2.8Å; L459-I508 PolarHBondContact O-N 3.21Å; L459-V510 HydrophobicContact CD1-CB 4.47Å; L459-V510 HydrophobicContact CD1-CG2 3.73Å; L459-L525 HydrophobicContact CD2-CD1 4.22Å; L459-V535 HydrophobicContact CB-CG1 4.48Å; L459-V535 HydrophobicContact CD2-CG1 4.31Å; L459-V536 WeakPolarHBondContact CA-O 3.45Å; L459-A537 HydrophobicContact CG-CB 4.44Å
460	R	87.8	Confident	77.6	Confident	62 Å²	62	64.6 Å²	64.6	23%	0.234	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	144.9	-177.1	-67	171.4	163.4	-178.2	-12.6	108.9	V458 M462 V536 E538 A552	V458-R460 HydrophobicContact CG2-CG 4.16Å; R460-M462 VanDerWaalsContact C-N 3.32Å; R460-M462 PolarHBondContact O-N 3.05Å; R460-V536 HydrophobicContact CB-CB 4.36Å; R460-V536 PolarHBondContact N-O 3.08Å; R460-V536 PolarHBondContact O-N 3.46Å; R460-E538 WeakPolarHBondContact CD-OE2 3.28Å; R460-E538 IonicContact CZ-OE2 3.76Å; R460-E538 IonicContact NE-OE2 3.98Å; R460-E538 IonicContact NH1-OE2 3.72Å; R460-E538 PolarHBondContact NH1-OE2 3.47Å; R460-A552 PolarHBondContact NH2-O 3.39Å; R460-A552 PolarHBondContact NH2-OXT 2.96Å
461	N	83.8	Confident	79.3	Confident	76 Å²	76	62 Å²	62	41%	0.406	32%	0.319	S	S	.	.	S	Bend	trans	58.1	38.4	178.8	-167.8	47.2	0	0	0	114.1	K534	N461-K534 PolarHBondContact ND2-O 3.24Å
462	M	77.7	Confident	80.8	Confident	22 Å²	22	55.5 Å²	55.5	11%	0.108	29%	0.291	C	S	.	.	S	Bend	trans	-90.1	-38.5	179.8	-174.6	170.8	170.2	0	0	113.8	L459 R460 V476 I508 F530 V535	L459-M462 HydrophobicContact CB-SD 4.48Å; L459-M462 HydrophobicContact CD2-SD 3.67Å; R460-M462 VanDerWaalsContact C-N 3.32Å; R460-M462 PolarHBondContact O-N 3.05Å; M462-V476 HydrophobicContact CE-CG2 4.1Å; M462-V476 HydrophobicContact SD-CG2 4.47Å; M462-I508 HydrophobicContact SD-CD1 4.39Å; M462-F530 HydrophobicContact CE-CE1 4.36Å; M462-F530 HydrophobicContact CE-CZ 4.23Å; M462-V535 HydrophobicContact CB-CG1 4.28Å; M462-V535 HydrophobicContact CB-CG2 4.21Å; M462-V535 HydrophobicContact CG-CG2 4.1Å
463	V	80.5	Confident	81.8	Confident	22 Å²	22	58 Å²	58	13%	0.133	30%	0.296	C	S	.	.	S	Bend	trans	-138.5	157.9	-178.2	-70.5	0	0	0	0	109.7	D467 I468 L472 V506 I508	V463-D467 HydrophobicContact CB-CB 4.12Å; V463-D467 HydrophobicContact CG1-CB 4.48Å; V463-I468 HydrophobicContact CG2-CG1 4.4Å; V463-L472 HydrophobicContact CG1-CD1 4.02Å; V463-L472 HydrophobicContact CG1-CD2 4.23Å; V463-L472 HydrophobicContact CG2-CD2 3.97Å; V463-V506 HydrophobicContact CG2-CB 4.14Å; V463-V506 HydrophobicContact CG2-CG1 3.85Å; V463-V506 HydrophobicContact CG2-CG2 4.32Å; V463-I508 HydrophobicContact CG2-CD1 4.29Å
464	G	77.3	Confident	82.6	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.282	C	S	.	.			trans	-77.9	165.9	164.4	0	0	0	0	0	112.2	E466 D467 I468	G464-E466 PolarHBondContact O-N 2.78Å; G464-D467 WeakPolarHBondContact CA-OD2 3.22Å; G464-D467 PolarHBondContact N-OD2 2.98Å; G464-D467 PolarHBondContact O-N 3.24Å; G464-D467 VanDerWaalsContact O-N 3.14Å; G464-I468 WeakPolarHBondContact O-CG1 3.46Å
465	P	78.1	Confident	83	Confident	41 Å²	41	58.3 Å²	58.3	27%	0.266	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-63.9	-27.5	169.2	30.6	-36.9	0	0	0	111.8	D467 I504	P465-D467 VanDerWaalsContact C-N 3.29Å; P465-D467 PolarHBondContact O-N 3.4Å; P465-I504 HydrophobicContact CB-CB 3.96Å; P465-I504 HydrophobicContact CB-CD1 4.13Å; P465-I504 HydrophobicContact CB-CG2 3.97Å; P465-I504 HydrophobicContact CG-CB 4.01Å; P465-I504 HydrophobicContact CG-CD1 4.38Å
466	E	77.4	Confident	83.1	Confident	127 Å²	127	57.2 Å²	57.2	59%	0.593	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-68.6	-16.6	171.1	57.9	-81.5	172.8	0	0	115.3	G464 R533	G464-E466 PolarHBondContact O-N 2.78Å; E466-R533 IonicContact OE1-CZ 3.86Å; E466-R533 IonicContact OE1-NH1 2.68Å; E466-R533 IonicContact OE1-NH2 2.68Å; E466-R533 PolarHBondContact OE1-NH2 3.44Å
467	D	78.8	Confident	83	Confident	82 Å²	82	59.8 Å²	59.8	44%	0.439	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-106.4	22.1	-175.1	-49.6	-61.1	0	0	0	112.5	V463 G464 P465 R533	V463-D467 HydrophobicContact CB-CB 4.12Å; V463-D467 HydrophobicContact CG1-CB 4.48Å; G464-D467 WeakPolarHBondContact CA-OD2 3.22Å; G464-D467 PolarHBondContact N-OD2 2.98Å; G464-D467 PolarHBondContact O-N 3.24Å; G464-D467 VanDerWaalsContact O-N 3.14Å; P465-D467 VanDerWaalsContact C-N 3.29Å; P465-D467 PolarHBondContact O-N 3.4Å; D467-R533 IonicContact OD2-NH2 3.71Å
468	I	80.9	Confident	82.9	Confident	43 Å²	43	65.9 Å²	65.9	22%	0.221	35%	0.346	C	S	.	.			trans	-100	84.2	-177.5	-53	177.2	0	0	0	110.6	V463 G464 L472 I491 Q493 V506	V463-I468 HydrophobicContact CG2-CG1 4.4Å; G464-I468 WeakPolarHBondContact O-CG1 3.46Å; I468-L472 HydrophobicContact CG1-CD2 4.4Å; I468-L472 HydrophobicContact CG2-CD2 4.29Å; I468-I491 HydrophobicContact CG2-CG2 4.38Å; I468-Q493 HydrophobicContact CD1-CG 3.71Å; I468-Q493 VanDerWaalsContact CD1-NE2 3.31Å; I468-V506 HydrophobicContact CD1-CB 4.48Å; I468-V506 HydrophobicContact CD1-CG1 3.8Å; I468-V506 HydrophobicContact CD1-CG2 3.79Å; I468-V506 HydrophobicContact CG1-CG1 4.5Å
469	D	83	Confident	82.7	Confident	118 Å²	118	67.9 Å²	67.9	63%	0.631	36%	0.355	S	S	*	.			trans	-94.1	161.6	171.9	-69.3	-55.1	0	0	0	112.4	D471 L472	D469-D471 PolarHBondContact O-N 2.94Å; D469-D471 VanDerWaalsContact O-N 3.14Å; D469-L472 VanDerWaalsContact O-CB 3.27Å; D469-L472 WeakPolarHBondContact O-CB 3.48Å; D469-L472 PolarHBondContact O-N 3.5Å
470	D	80.6	Confident	82.4	Confident	170 Å²	170	67.8 Å²	67.8	91%	0.909	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-26.8	178.3	-72.7	-39.3	0	0	0	113.2	L472	D470-L472 VanDerWaalsContact C-N 3.33Å
471	D	82.2	Confident	82.3	Confident	132 Å²	132	67 Å²	67	71%	0.706	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-16.9	178.7	-70.8	-53.8	0	0	0	113.5	D469 E473 G474 E475	D469-D471 PolarHBondContact O-N 2.94Å; D469-D471 VanDerWaalsContact O-N 3.14Å; D471-E473 VanDerWaalsContact C-N 3.34Å; D471-E473 PolarHBondContact O-N 2.68Å; D471-G474 WeakPolarHBondContact O-CA 3.11Å; D471-G474 PolarHBondContact O-N 2.67Å; D471-E475 PolarHBondContact O-N 3.07Å
472	L	85.1	Confident	82.3	Confident	12 Å²	12	69 Å²	69	6%	0.063	37%	0.371	C	S	.	.	H	α-helix	trans	-63.3	-34.8	-174.1	178.7	61.9	0	0	0	113.1	V463 I468 D469 D470 G474 E475 V476 I491 I508	V463-L472 HydrophobicContact CG1-CD1 4.02Å; V463-L472 HydrophobicContact CG1-CD2 4.23Å; V463-L472 HydrophobicContact CG2-CD2 3.97Å; I468-L472 HydrophobicContact CG1-CD2 4.4Å; I468-L472 HydrophobicContact CG2-CD2 4.29Å; D469-L472 VanDerWaalsContact O-CB 3.27Å; D469-L472 WeakPolarHBondContact O-CB 3.48Å; D469-L472 PolarHBondContact O-N 3.5Å; D470-L472 VanDerWaalsContact C-N 3.33Å; L472-G474 PolarHBondContact O-N 2.91Å; L472-E475 PolarHBondContact O-N 3.21Å; L472-V476 HydrophobicContact CD1-CG2 4.14Å; L472-V476 HydrophobicContact CG-CG2 4.49Å; L472-V476 WeakPolarHBondContact O-CG2 3.16Å; L472-V476 PolarHBondContact O-N 3.04Å; L472-I491 HydrophobicContact CB-CD1 4.42Å; L472-I491 HydrophobicContact CD2-CD1 4.04Å; L472-I491 HydrophobicContact CG-CD1 4.13Å; L472-I508 HydrophobicContact CD2-CD1 4.38Å
473	E	83.4	Confident	82.6	Confident	109 Å²	109	70.9 Å²	70.9	51%	0.509	38%	0.379	S	S	.	.	H	α-helix	trans	-62.5	-36.4	173.8	-167	-177.4	139.3	0	0	110.8	D471 T477 V489 I491	D471-E473 VanDerWaalsContact C-N 3.34Å; D471-E473 PolarHBondContact O-N 2.68Å; E473-T477 VanDerWaalsContact O-CB 3.25Å; E473-T477 WeakPolarHBondContact O-CB 3.47Å; E473-T477 PolarHBondContact O-N 2.87Å; E473-T477 PolarHBondContact O-OG1 3.09Å; E473-V489 HydrophobicContact CG-CB 3.95Å; E473-V489 HydrophobicContact CG-CG1 4.1Å; E473-I491 HydrophobicContact CB-CD1 4.5Å
474	G	82.3	Confident	82.9	Confident	44 Å²	44	70.3 Å²	70.3	45%	0.454	38%	0.377	S	S	.	.	H	α-helix	trans	-66.2	-48.8	174.6	0	0	0	0	0	112.6	D471 L472 V476 T477 E478	D471-G474 WeakPolarHBondContact O-CA 3.11Å; D471-G474 PolarHBondContact O-N 2.67Å; L472-G474 PolarHBondContact O-N 2.91Å; G474-V476 PolarHBondContact O-N 3.32Å; G474-T477 PolarHBondContact O-N 3.32Å; G474-E478 PolarHBondContact O-N 2.92Å
475	E	86.4	Confident	83.3	Confident	134 Å²	134	74.3 Å²	74.3	63%	0.626	40%	0.402	S	S	*	.	H	α-helix	trans	-60.5	-45.8	178	-66.6	-156.8	151.7	0	0	112.3	D471 L472 T477 E478 E479	D471-E475 PolarHBondContact O-N 3.07Å; L472-E475 PolarHBondContact O-N 3.21Å; E475-T477 VanDerWaalsContact C-N 3.31Å; E475-T477 PolarHBondContact O-N 3.06Å; E475-E478 PolarHBondContact O-N 2.97Å; E475-E479 WeakPolarHBondContact O-CB 3.42Å; E475-E479 PolarHBondContact O-N 3.46Å
476	V	85.4	Confident	83.8	Confident	2 Å²	2	73.8 Å²	73.8	1%	0.012	40%	0.398	C	S	.	.	H	α-helix	trans	-62.7	-40.2	176.7	172.2	0	0	0	0	110.7	M462 L472 G474 C480 V489 I508 V510	M462-V476 HydrophobicContact CE-CG2 4.1Å; M462-V476 HydrophobicContact SD-CG2 4.47Å; L472-V476 HydrophobicContact CD1-CG2 4.14Å; L472-V476 HydrophobicContact CG-CG2 4.49Å; L472-V476 WeakPolarHBondContact O-CG2 3.16Å; L472-V476 PolarHBondContact O-N 3.04Å; G474-V476 PolarHBondContact O-N 3.32Å; V476-C480 WeakPolarHBondContact O-CB 3.45Å; V476-C480 PolarHBondContact O-N 3.03Å; V476-C480 PolarHBondContact O-SG 2.85Å; V476-V489 HydrophobicContact CG1-CG1 4.04Å; V476-V489 HydrophobicContact CG1-CG2 4.28Å; V476-I508 HydrophobicContact CG1-CG2 4.08Å; V476-I508 HydrophobicContact CG2-CD1 4.13Å; V476-I508 HydrophobicContact CG2-CG2 4.43Å; V476-V510 HydrophobicContact CG1-CG2 3.75Å
477	T	86.4	Confident	84.2	Confident	55 Å²	55	72.5 Å²	72.5	34%	0.337	40%	0.395	S	S	.	.	H	α-helix	trans	-66.2	-40.6	177.3	-60.4	0	0	0	0	111.9	E473 G474 E475 G481 V489	E473-T477 VanDerWaalsContact O-CB 3.25Å; E473-T477 WeakPolarHBondContact O-CB 3.47Å; E473-T477 PolarHBondContact O-N 2.87Å; E473-T477 PolarHBondContact O-OG1 3.09Å; G474-T477 PolarHBondContact O-N 3.32Å; E475-T477 VanDerWaalsContact C-N 3.31Å; E475-T477 PolarHBondContact O-N 3.06Å; T477-G481 WeakPolarHBondContact O-CA 3.48Å; T477-G481 PolarHBondContact O-N 3.41Å; T477-V489 WeakPolarHBondContact OG1-CG2 3.49Å
478	E	85.9	Confident	84.4	Confident	128 Å²	128	74.9 Å²	74.9	60%	0.598	40%	0.398	S	S	*	.	H	α-helix	trans	-71.2	-42.5	177.8	-161.3	-161.7	126.5	0	0	112.2	G474 E475 G481 K482	G474-E478 PolarHBondContact O-N 2.92Å; E475-E478 PolarHBondContact O-N 2.97Å; E478-G481 PolarHBondContact O-N 2.86Å; E478-K482 VanDerWaalsContact O-CE 3.31Å; E478-K482 WeakPolarHBondContact O-CE 3.26Å; E478-K482 WeakPolarHBondContact O-CG 3.35Å; E478-K482 PolarHBondContact O-N 3.45Å; E478-K482 WeakPolarHBondContact OE1-CE 3.37Å; E478-K482 IonicContact OE1-NZ 3.04Å; E478-K482 PolarHBondContact OE1-NZ 3.29Å
479	E	85.6	Confident	84.7	Confident	43 Å²	43	73.4 Å²	73.4	20%	0.201	39%	0.391	C	S	.	.	H	α-helix	trans	-63.7	-42.9	175.2	-79.1	-70.1	91.1	0	0	111.8	E475 K482 F483 R528	E475-E479 WeakPolarHBondContact O-CB 3.42Å; E475-E479 PolarHBondContact O-N 3.46Å; E479-K482 PolarHBondContact O-N 2.9Å; E479-K482 WeakPolarHBondContact OE1-CD 3.24Å; E479-K482 IonicContact OE1-NZ 3.89Å; E479-K482 PolarHBondContact OE1-NZ 3.39Å; E479-F483 WeakPolarHBondContact O-CD2 3.22Å; E479-F483 VanDerWaalsContact O-CE2 3.3Å; E479-F483 WeakPolarHBondContact O-CE2 3.36Å; E479-R528 IonicContact OE2-CZ 3.81Å; E479-R528 IonicContact OE2-NH1 3.5Å; E479-R528 PolarHBondContact OE2-NH1 2.88Å; E479-R528 IonicContact OE2-NH2 3.06Å; E479-R528 PolarHBondContact OE2-NH2 2.85Å
480	C	82.9	Confident	84.8	Confident	1 Å²	1	69.5 Å²	69.5	1%	0.007	37%	0.37	C	S	.	.	H	α-helix	trans	-71.2	-33.3	176.7	-69	0	0	0	0	112.5	V476 K482 F483 G484 V486 V510 F512	V476-C480 WeakPolarHBondContact O-CB 3.45Å; V476-C480 PolarHBondContact O-N 3.03Å; V476-C480 PolarHBondContact O-SG 2.85Å; C480-K482 PolarHBondContact O-N 3.39Å; C480-K482 VanDerWaalsContact O-N 3.13Å; C480-F483 PolarHBondContact O-N 2.82Å; C480-G484 PolarHBondContact O-N 3.34Å; C480-V486 HydrophobicContact CB-CG2 3.46Å; C480-V486 VanDerWaalsContact CB-CG2 3.46Å; C480-V510 HydrophobicContact CB-CG1 4.14Å; C480-F512 HydrophobicContact CB-CE1 4.27Å; C480-F512 HydrophobicContact CB-CZ 3.77Å
481	G	83.9	Confident	85.2	Confident	45 Å²	45	63.8 Å²	63.8	46%	0.464	34%	0.339	S	S	.	.	H	α-helix	trans	-59.4	-20.3	175.2	0	0	0	0	0	114.4	T477 E478 F483 G484	T477-G481 WeakPolarHBondContact O-CA 3.48Å; T477-G481 PolarHBondContact O-N 3.41Å; E478-G481 PolarHBondContact O-N 2.86Å; G481-F483 VanDerWaalsContact C-N 3.27Å; G481-F483 PolarHBondContact O-N 3.42Å; G481-G484 WeakPolarHBondContact CA-O 3.22Å
482	K	85	Confident	85.3	Confident	118 Å²	118	61 Å²	61	51%	0.513	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-15.7	173.9	-66.1	158.7	-163.4	170.9	0	113	E478 E479 C480	E478-K482 VanDerWaalsContact O-CE 3.31Å; E478-K482 WeakPolarHBondContact O-CE 3.26Å; E478-K482 WeakPolarHBondContact O-CG 3.35Å; E478-K482 PolarHBondContact O-N 3.45Å; E478-K482 WeakPolarHBondContact OE1-CE 3.37Å; E478-K482 IonicContact OE1-NZ 3.04Å; E478-K482 PolarHBondContact OE1-NZ 3.29Å; E479-K482 PolarHBondContact O-N 2.9Å; E479-K482 WeakPolarHBondContact OE1-CD 3.24Å; E479-K482 IonicContact OE1-NZ 3.89Å; E479-K482 PolarHBondContact OE1-NZ 3.39Å; C480-K482 PolarHBondContact O-N 3.39Å; C480-K482 VanDerWaalsContact O-N 3.13Å
483	F	84.5	Confident	85.2	Confident	62 Å²	62	65.4 Å²	65.4	27%	0.272	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.3	-18.9	-177.2	-57.2	-75.6	0	0	0	114.1	E479 C480 G481 A521 A524 L525	E479-F483 WeakPolarHBondContact O-CD2 3.22Å; E479-F483 VanDerWaalsContact O-CE2 3.3Å; E479-F483 WeakPolarHBondContact O-CE2 3.36Å; C480-F483 PolarHBondContact O-N 2.82Å; G481-F483 VanDerWaalsContact C-N 3.27Å; G481-F483 PolarHBondContact O-N 3.42Å; F483-A521 HydrophobicContact CB-CB 3.77Å; F483-A521 HydrophobicContact CD2-CB 4.29Å; F483-A521 HydrophobicContact CG-CB 4.1Å; F483-A524 HydrophobicContact CD1-CB 4.08Å; F483-A524 HydrophobicContact CE1-CB 3.34Å; F483-A524 HydrophobicContact CE2-CB 4.43Å; F483-A524 HydrophobicContact CZ-CB 3.56Å; F483-L525 HydrophobicContact CE2-CD2 4.22Å; F483-L525 HydrophobicContact CE2-CG 4.36Å
484	G	85.1	Confident	84.9	Confident	10 Å²	10	62.1 Å²	62.1	10%	0.103	32%	0.324	C	S	.	.	S	Bend	trans	176.9	-172.8	175.6	0	0	0	0	0	113.9	C480 G481 V486 E517	C480-G484 PolarHBondContact O-N 3.34Å; G481-G484 WeakPolarHBondContact CA-O 3.22Å; G484-V486 PolarHBondContact O-N 2.81Å; G484-E517 WeakPolarHBondContact CA-OE1 3.3Å; G484-E517 WeakPolarHBondContact CA-OE2 3.42Å
485	T	86.2	Confident	84.5	Confident	84 Å²	84	66.6 Å²	66.6	52%	0.515	33%	0.331	S	S	.	.			trans	-86.6	113.2	178.4	-52.5	0	0	0	0	109.5	F512 S513 E517	T485-F512 CarbonylContact O-C 3.57Å; T485-F512 WeakPolarHBondContact O-CA 3.41Å; T485-S513 PolarHBondContact O-N 2.78Å; T485-E517 PolarHBondContact N-OE2 3.25Å
486	V	89.1	Confident	83.3	Confident	31 Å²	31	66.5 Å²	66.5	19%	0.188	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	127.1	174.6	-179.1	0	0	0	0	109.2	C480 G484 V489 V510 F512	C480-V486 HydrophobicContact CB-CG2 3.46Å; C480-V486 VanDerWaalsContact CB-CG2 3.46Å; G484-V486 PolarHBondContact O-N 2.81Å; V486-V489 HydrophobicContact CG1-CG2 3.88Å; V486-V510 HydrophobicContact CG1-CG1 3.79Å; V486-V510 HydrophobicContact CG2-CG1 4.08Å; V486-F512 HydrophobicContact CG2-CD1 4.48Å; V486-F512 HydrophobicContact CG2-CE1 4.04Å; V486-F512 HydrophobicContact CG2-CZ 4.27Å
487	N	86.4	Confident	82	Confident	100 Å²	100	67.9 Å²	67.9	54%	0.535	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	-37.3	174	-71.9	-22.6	0	0	0	111.7	E511	N487-E511 HydrophobicContact CB-CG 4.18Å; N487-E511 PolarHBondContact N-O 3.45Å
488	R	82.3	Confident	80.7	Confident	132 Å²	132	74.4 Å²	74.4	50%	0.498	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	143	-172.4	-164.6	174.6	-177.5	-166.2	-2	111.9	I490 E511	R488-I490 HydrophobicContact CG-CG1 4.29Å; R488-E511 HydrophobicContact CB-CB 4.15Å; R488-E511 PolarHBondContact O-N 3.49Å
489	V	87.1	Confident	79.4	Confident	12 Å²	12	76.4 Å²	76.4	7%	0.073	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	146.4	166.2	-179.1	0	0	0	0	108.4	E473 V476 T477 V486 I508 F509 V510	E473-V489 HydrophobicContact CG-CB 3.95Å; E473-V489 HydrophobicContact CG-CG1 4.1Å; V476-V489 HydrophobicContact CG1-CG1 4.04Å; V476-V489 HydrophobicContact CG1-CG2 4.28Å; T477-V489 WeakPolarHBondContact OG1-CG2 3.49Å; V486-V489 HydrophobicContact CG1-CG2 3.88Å; V489-I508 HydrophobicContact CG1-CG2 3.85Å; V489-F509 CarbonylContact C-O 3.58Å; V489-F509 WeakPolarHBondContact CA-O 3.28Å; V489-V510 HydrophobicContact CG1-CG2 4.5Å; V489-V510 HydrophobicContact CG2-CG1 4.36Å; V489-V510 HydrophobicContact CG2-CG2 4.36Å
490	I	86	Confident	78	Confident	35 Å²	35	84.1 Å²	84.1	18%	0.179	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	121.4	172.3	-54.3	-176.9	0	0	0	108.6	R488 F509 F545 L550	R488-I490 HydrophobicContact CG-CG1 4.29Å; I490-F509 HydrophobicContact CB-CB 4.38Å; I490-F509 PolarHBondContact N-O 2.93Å; I490-F509 PolarHBondContact O-N 3.19Å; I490-F545 HydrophobicContact CD1-CE2 3.58Å; I490-F545 HydrophobicContact CD1-CZ 3.71Å; I490-F545 HydrophobicContact CG1-CE2 4.16Å; I490-F545 HydrophobicContact CG1-CZ 4.24Å; I490-L550 HydrophobicContact CG2-CD1 4.05Å
491	I	88	Confident	76.8	Confident	50 Å²	50	91.8 Å²	91.8	26%	0.256	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	126	172.9	-58.8	166	0	0	0	108.3	I468 L472 E473 V506 I508	I468-I491 HydrophobicContact CG2-CG2 4.38Å; L472-I491 HydrophobicContact CB-CD1 4.42Å; L472-I491 HydrophobicContact CD2-CD1 4.04Å; L472-I491 HydrophobicContact CG-CD1 4.13Å; E473-I491 HydrophobicContact CB-CD1 4.5Å; I491-V506 HydrophobicContact CG2-CG1 4.04Å; I491-I508 HydrophobicContact CG1-CG1 4.29Å; I491-I508 HydrophobicContact CG1-CG2 4.16Å; I491-I508 HydrophobicContact CG2-CG1 4.49Å
492	Y	84	Confident	75.8	Confident	73 Å²	73	90.9 Å²	90.9	29%	0.286	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	135.2	179.1	-176.4	-109.1	0	0	0	110.1	E494 K507 L550	Y492-E494 HydrophobicContact CD1-CB 4.27Å; Y492-E494 HydrophobicContact CE1-CB 3.79Å; Y492-E494 HydrophobicContact CE1-CG 4.2Å; Y492-K507 HydrophobicContact CD1-CD 4.37Å; Y492-K507 PolarHBondContact N-O 3.44Å; Y492-K507 PolarHBondContact O-N 3.49Å; Y492-L550 HydrophobicContact CD1-CB 4.2Å; Y492-L550 WeakPolarHBondContact CD1-O 3.43Å; Y492-L550 HydrophobicContact CD2-CB 3.99Å; Y492-L550 HydrophobicContact CD2-CD1 4.1Å; Y492-L550 HydrophobicContact CE1-CB 4.38Å; Y492-L550 WeakPolarHBondContact CE1-O 3.35Å; Y492-L550 HydrophobicContact CE2-CB 4.19Å; Y492-L550 HydrophobicContact CG-CB 3.99Å
493	Q	82.7	Confident	74.9	Confident	105 Å²	105	91.2 Å²	91.2	49%	0.491	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	114.4	-179.3	-60.1	178	28.9	0	0	108.8	I468 I504	I468-Q493 HydrophobicContact CD1-CG 3.71Å; I468-Q493 VanDerWaalsContact CD1-NE2 3.31Å; Q493-I504 HydrophobicContact CB-CG2 4.17Å
494	E	77.5	Confident	74.4	Confident	40 Å²	40	91.7 Å²	91.7	19%	0.187	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	110.9	-178.4	-167.8	167.2	-121.5	0	0	110.1	Y492 Q496 I505 K507 S551	Y492-E494 HydrophobicContact CD1-CB 4.27Å; Y492-E494 HydrophobicContact CE1-CB 3.79Å; Y492-E494 HydrophobicContact CE1-CG 4.2Å; E494-Q496 PolarHBondContact O-N 3.45Å; E494-I505 PolarHBondContact N-O 2.9Å; E494-I505 PolarHBondContact O-N 3.36Å; E494-K507 IonicContact OE1-NZ 3.3Å; E494-K507 WeakPolarHBondContact OE2-CE 3.22Å; E494-K507 IonicContact OE2-NZ 2.71Å; E494-K507 PolarHBondContact OE2-NZ 3.5Å; E494-S551 WeakPolarHBondContact OE1-CA 3.43Å; E494-S551 WeakPolarHBondContact OE1-CB 3.36Å; E494-S551 PolarHBondContact OE1-OG 2.88Å
495	K	73.3	Confident	74.1	Confident	139 Å²	139	93.8 Å²	93.8	60%	0.604	47%	0.467	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.7	117.4	173.8	54.3	154.6	-162	142.2	0	110.6	G497 I504	K495-G497 PolarHBondContact NZ-O 3.34Å; K495-G497 PolarHBondContact O-N 2.97Å; K495-I504 HydrophobicContact CB-CG1 4.46Å
496	Q	62.7	Low	74	Confident	131 Å²	131	90.2 Å²	90.2	61%	0.612	44%	0.444	S	S	*	.			trans	-83.3	53.2	-177.2	-168.1	162.1	91.4	0	0	112	E494 D503 I505	E494-Q496 PolarHBondContact O-N 3.45Å; Q496-D503 VanDerWaalsContact CB-O 3.31Å; Q496-D503 WeakPolarHBondContact CB-O 3.3Å; Q496-D503 PolarHBondContact N-O 3.31Å; Q496-I505 HydrophobicContact CB-CD1 4.4Å; Q496-I505 VanDerWaalsContact NE2-CD1 3.26Å
497	G	57.9	Low	73.8	Confident	32 Å²	32	89.2 Å²	89.2	33%	0.33	44%	0.438	S	S	.	.			trans	165.2	178.3	175.2	0	0	0	0	0	117.1	K495	K495-G497 PolarHBondContact NZ-O 3.34Å; K495-G497 PolarHBondContact O-N 2.97Å
498	E	58.7	Low	73.9	Confident	191 Å²	191	84.5 Å²	84.5	89%	0.893	41%	0.413	S	S	*	.	S	Bend	trans	-108	-8.6	170.2	-62.3	-166.3	141.7	0	0	113.1
499	E	58.3	Low	74.3	Confident	170 Å²	170	78.2 Å²	78.2	79%	0.794	39%	0.389	S	S	*	.	S	Bend	trans	-80.8	153.6	175.8	-59.5	-173.8	156	0	0	111.2	D501 A502	E499-D501 VanDerWaalsContact C-N 3.26Å; E499-D501 PolarHBondContact O-N 2.99Å; E499-A502 VanDerWaalsContact O-CB 3.32Å; E499-A502 WeakPolarHBondContact O-CB 3.4Å; E499-A502 PolarHBondContact O-N 3.23Å
500	E	57.5	Low	74.3	Confident	205 Å²	205	77.7 Å²	77.7	96%	0.958	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-20.8	-173.3	-66.1	-174.2	120.9	0	0	113.7
501	D	57.4	Low	74.5	Confident	162 Å²	162	77.7 Å²	77.7	87%	0.866	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.4	19.9	177.3	-64.2	-55.2	0	0	0	113.3	E499	E499-D501 VanDerWaalsContact C-N 3.26Å; E499-D501 PolarHBondContact O-N 2.99Å
502	A	62.5	Low	74.5	Confident	26 Å²	26	75.4 Å²	75.4	22%	0.215	37%	0.373	C	S	.	.			trans	-70.2	128.5	-174.8	0	0	0	0	0	114	E499 I504	E499-A502 VanDerWaalsContact O-CB 3.32Å; E499-A502 WeakPolarHBondContact O-CB 3.4Å; E499-A502 PolarHBondContact O-N 3.23Å; A502-I504 PolarHBondContact O-N 2.83Å
503	D	65.8	Low	74.7	Confident	125 Å²	125	74.9 Å²	74.9	67%	0.668	38%	0.38	S	S	*	.			trans	-54.2	124.9	177.5	-76.6	-55.1	0	0	0	112.3	Q496	Q496-D503 VanDerWaalsContact CB-O 3.31Å; Q496-D503 WeakPolarHBondContact CB-O 3.3Å; Q496-D503 PolarHBondContact N-O 3.31Å
504	I	74.8	Confident	74.9	Confident	73 Å²	73	71.6 Å²	71.6	37%	0.374	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	115.9	175.4	-53.8	172.9	0	0	0	109.1	P465 Q493 K495 A502	P465-I504 HydrophobicContact CB-CB 3.96Å; P465-I504 HydrophobicContact CB-CD1 4.13Å; P465-I504 HydrophobicContact CB-CG2 3.97Å; P465-I504 HydrophobicContact CG-CB 4.01Å; P465-I504 HydrophobicContact CG-CD1 4.38Å; Q493-I504 HydrophobicContact CB-CG2 4.17Å; K495-I504 HydrophobicContact CB-CG1 4.46Å; A502-I504 PolarHBondContact O-N 2.83Å
505	I	78	Confident	75.2	Confident	54 Å²	54	70.1 Å²	70.1	28%	0.277	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	117.4	178.2	-59.4	-178.3	0	0	0	109.4	E494 Q496 K507	E494-I505 PolarHBondContact N-O 2.9Å; E494-I505 PolarHBondContact O-N 3.36Å; Q496-I505 HydrophobicContact CB-CD1 4.4Å; Q496-I505 VanDerWaalsContact NE2-CD1 3.26Å; I505-K507 HydrophobicContact CG2-CG 4.31Å
506	V	83.4	Confident	75.8	Confident	8 Å²	8	67.2 Å²	67.2	5%	0.048	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	124.5	173.2	-162.7	0	0	0	0	109.6	V463 I468 I491 I508	V463-V506 HydrophobicContact CG2-CB 4.14Å; V463-V506 HydrophobicContact CG2-CG1 3.85Å; V463-V506 HydrophobicContact CG2-CG2 4.32Å; I468-V506 HydrophobicContact CD1-CB 4.48Å; I468-V506 HydrophobicContact CD1-CG1 3.8Å; I468-V506 HydrophobicContact CD1-CG2 3.79Å; I468-V506 HydrophobicContact CG1-CG1 4.5Å; I491-V506 HydrophobicContact CG2-CG1 4.04Å; V506-I508 HydrophobicContact CG1-CG1 4.32Å
507	K	86.7	Confident	77.1	Confident	11 Å²	11	62.9 Å²	62.9	5%	0.048	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	125.6	173.3	-59.6	-179.3	-170.1	171.3	0	108.5	V458 Y492 E494 I505 F509 S551 A552	V458-K507 HydrophobicContact CG2-CB 4.08Å; Y492-K507 HydrophobicContact CD1-CD 4.37Å; Y492-K507 PolarHBondContact N-O 3.44Å; Y492-K507 PolarHBondContact O-N 3.49Å; E494-K507 IonicContact OE1-NZ 3.3Å; E494-K507 WeakPolarHBondContact OE2-CE 3.22Å; E494-K507 IonicContact OE2-NZ 2.71Å; E494-K507 PolarHBondContact OE2-NZ 3.5Å; I505-K507 HydrophobicContact CG2-CG 4.31Å; K507-F509 HydrophobicContact CB-CE2 3.81Å; K507-F509 HydrophobicContact CB-CZ 4.16Å; K507-F509 HydrophobicContact CD-CZ 4.29Å; K507-S551 VanDerWaalsContact NZ-C 3.29Å; K507-S551 PolarHBondContact NZ-O 3.14Å; K507-A552 PolarHBondContact NZ-O 3.45Å
508	I	87.9	Confident	78.5	Confident	1 Å²	1	61.5 Å²	61.5	1%	0.005	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	118.3	178.4	-51.4	-178.8	0	0	0	108.5	V458 L459 M462 V463 L472 V476 V489 I491 V506 V510	V458-I508 CarbonylContact C-O 3.54Å; V458-I508 WeakPolarHBondContact CA-O 3.27Å; L459-I508 HydrophobicContact CB-CB 4.43Å; L459-I508 PolarHBondContact N-O 2.8Å; L459-I508 PolarHBondContact O-N 3.21Å; M462-I508 HydrophobicContact SD-CD1 4.39Å; V463-I508 HydrophobicContact CG2-CD1 4.29Å; L472-I508 HydrophobicContact CD2-CD1 4.38Å; V476-I508 HydrophobicContact CG1-CG2 4.08Å; V476-I508 HydrophobicContact CG2-CD1 4.13Å; V476-I508 HydrophobicContact CG2-CG2 4.43Å; V489-I508 HydrophobicContact CG1-CG2 3.85Å; I491-I508 HydrophobicContact CG1-CG1 4.29Å; I491-I508 HydrophobicContact CG1-CG2 4.16Å; I491-I508 HydrophobicContact CG2-CG1 4.49Å; V506-I508 HydrophobicContact CG1-CG1 4.32Å; I508-V510 HydrophobicContact CG2-CG2 4.37Å
509	F	89.5	Confident	79.9	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	133	179	-59	-94.5	0	0	0	109.7	M457 V458 V489 I490 K507 Y540 F545 L550	M457-F509 WeakPolarHBondContact O-CA 3.41Å; V458-F509 HydrophobicContact CB-CD1 3.8Å; V458-F509 HydrophobicContact CB-CE1 3.8Å; V458-F509 HydrophobicContact CG2-CD1 3.81Å; V458-F509 HydrophobicContact CG2-CE1 3.55Å; V458-F509 HydrophobicContact CG2-CE2 4.34Å; V458-F509 HydrophobicContact CG2-CG 4.31Å; V458-F509 HydrophobicContact CG2-CZ 3.85Å; V489-F509 CarbonylContact C-O 3.58Å; V489-F509 WeakPolarHBondContact CA-O 3.28Å; I490-F509 HydrophobicContact CB-CB 4.38Å; I490-F509 PolarHBondContact N-O 2.93Å; I490-F509 PolarHBondContact O-N 3.19Å; K507-F509 HydrophobicContact CB-CE2 3.81Å; K507-F509 HydrophobicContact CB-CZ 4.16Å; K507-F509 HydrophobicContact CD-CZ 4.29Å; F509-Y540 HydrophobicContact CD1-CD1 4.17Å; F509-Y540 HydrophobicContact CD1-CD2 4.25Å; F509-Y540 HydrophobicContact CD1-CG 4Å; F509-Y540 HydrophobicContact CE1-CD1 4.1Å; F509-Y540 AromaticContact CE1-CD2 3.65Å; F509-Y540 HydrophobicContact CE1-CD2 3.65Å; F509-Y540 HydrophobicContact CE1-CE1 4.17Å; F509-Y540 AromaticContact CE1-CE2 3.71Å; F509-Y540 HydrophobicContact CE1-CE2 3.71Å; F509-Y540 AromaticContact CE1-CG 3.85Å; F509-Y540 HydrophobicContact CE1-CG 3.85Å; F509-Y540 AromaticContact CE1-CZ 3.99Å; F509-F545 HydrophobicContact CB-CD2 4.22Å; F509-F545 HydrophobicContact CB-CE2 3.78Å; F509-L550 HydrophobicContact CD1-CD2 4.37Å; F509-L550 HydrophobicContact CD2-CD2 3.87Å; F509-L550 HydrophobicContact CE1-CD2 4.32Å; F509-L550 HydrophobicContact CE2-CB 4.02Å; F509-L550 HydrophobicContact CE2-CD2 3.83Å; F509-L550 HydrophobicContact CE2-CG 4.44Å; F509-L550 HydrophobicContact CG-CD2 4.15Å; F509-L550 HydrophobicContact CZ-CB 4.19Å; F509-L550 HydrophobicContact CZ-CD2 4.06Å; F509-L550 WeakPolarHBondContact CZ-O 3.34Å
510	V	88.5	Confident	81.3	Confident	0 Å²	0	53 Å²	53	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	119.8	-178.6	-174.4	0	0	0	0	109.5	V456 M457 L459 V476 C480 V486 V489 I508 F512	V456-V510 WeakPolarHBondContact CA-O 3.2Å; M457-V510 HydrophobicContact CE-CB 4.35Å; M457-V510 HydrophobicContact CG-CB 4.28Å; M457-V510 PolarHBondContact N-O 2.87Å; M457-V510 PolarHBondContact O-N 3.26Å; L459-V510 HydrophobicContact CD1-CB 4.47Å; L459-V510 HydrophobicContact CD1-CG2 3.73Å; V476-V510 HydrophobicContact CG1-CG2 3.75Å; C480-V510 HydrophobicContact CB-CG1 4.14Å; V486-V510 HydrophobicContact CG1-CG1 3.79Å; V486-V510 HydrophobicContact CG2-CG1 4.08Å; V489-V510 HydrophobicContact CG1-CG2 4.5Å; V489-V510 HydrophobicContact CG2-CG1 4.36Å; V489-V510 HydrophobicContact CG2-CG2 4.36Å; I508-V510 HydrophobicContact CG2-CG2 4.37Å; V510-F512 HydrophobicContact CB-CE2 4.04Å; V510-F512 HydrophobicContact CG1-CD2 4.14Å; V510-F512 HydrophobicContact CG1-CE2 3.46Å; V510-F512 VanDerWaalsContact CG1-CE2 3.46Å; V510-F512 HydrophobicContact CG1-CZ 3.91Å
511	E	88.8	Confident	82.8	Confident	36 Å²	36	43.2 Å²	43.2	17%	0.168	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	123.1	178	-178.8	178.4	-151.3	0	0	110.8	V456 N487 R488 F545	V456-E511 HydrophobicContact CG2-CB 4.23Å; V456-E511 HydrophobicContact CG2-CG 4.17Å; N487-E511 HydrophobicContact CB-CG 4.18Å; N487-E511 PolarHBondContact N-O 3.45Å; R488-E511 HydrophobicContact CB-CB 4.15Å; R488-E511 PolarHBondContact O-N 3.49Å; E511-F545 HydrophobicContact CB-CE1 3.96Å; E511-F545 HydrophobicContact CB-CZ 4.1Å; E511-F545 HydrophobicContact CG-CE1 4.28Å
512	F	89.3	Confident	84.3	Confident	1 Å²	1	36.6 Å²	36.6	0%	0.004	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	158.2	176.1	-71.1	-99.5	0	0	0	112.4	T455 M457 C480 T485 V486 V510 A514 E517 M518 A521	T455-F512 WeakPolarHBondContact CB-O 3.3Å; T455-F512 PolarHBondContact O-N 2.86Å; T455-F512 PolarHBondContact OG1-O 2.85Å; M457-F512 HydrophobicContact CE-CE2 3.42Å; M457-F512 VanDerWaalsContact CE-CE2 3.42Å; M457-F512 HydrophobicContact CE-CZ 3.61Å; M457-F512 HydrophobicContact CG-CE2 4.14Å; M457-F512 HydrophobicContact SD-CE2 4.47Å; C480-F512 HydrophobicContact CB-CE1 4.27Å; C480-F512 HydrophobicContact CB-CZ 3.77Å; T485-F512 CarbonylContact O-C 3.57Å; T485-F512 WeakPolarHBondContact O-CA 3.41Å; V486-F512 HydrophobicContact CG2-CD1 4.48Å; V486-F512 HydrophobicContact CG2-CE1 4.04Å; V486-F512 HydrophobicContact CG2-CZ 4.27Å; V510-F512 HydrophobicContact CB-CE2 4.04Å; V510-F512 HydrophobicContact CG1-CD2 4.14Å; V510-F512 HydrophobicContact CG1-CE2 3.46Å; V510-F512 VanDerWaalsContact CG1-CE2 3.46Å; V510-F512 HydrophobicContact CG1-CZ 3.91Å; F512-A514 PolarHBondContact O-N 3.05Å; F512-E517 HydrophobicContact CB-CB 4.47Å; F512-E517 HydrophobicContact CD1-CB 3.94Å; F512-E517 HydrophobicContact CG-CB 4.49Å; F512-M518 HydrophobicContact CB-CB 4.16Å; F512-M518 HydrophobicContact CD2-CB 3.76Å; F512-M518 HydrophobicContact CD2-CG 4.09Å; F512-M518 HydrophobicContact CE2-CB 4.44Å; F512-M518 HydrophobicContact CG-CB 4.01Å; F512-A521 HydrophobicContact CE1-CB 4.23Å; F512-A521 HydrophobicContact CE2-CB 4.38Å; F512-A521 HydrophobicContact CZ-CB 3.75Å
513	S	88.3	Confident	85.5	Confident	63 Å²	63	42.9 Å²	42.9	44%	0.441	23%	0.232	S	C	.	.	S	Bend	trans	-63.6	-27	171.9	81.7	0	0	0	0	113.8	T485 E517	T485-S513 PolarHBondContact O-N 2.78Å; S513-E517 PolarHBondContact OG-OE2 3.37Å
514	A	86.2	Confident	86.5	Confident	36 Å²	36	38.9 Å²	38.9	30%	0.298	22%	0.216	S	C	.	.			trans	-149.1	140.7	-178.3	0	0	0	0	0	113.2	F512 S516 E517 M518	F512-A514 PolarHBondContact O-N 3.05Å; A514-S516 PolarHBondContact O-N 3.1Å; A514-S516 VanDerWaalsContact O-N 3.17Å; A514-E517 HydrophobicContact CB-CG 4.24Å; A514-E517 WeakPolarHBondContact O-CB 3.35Å; A514-E517 PolarHBondContact O-N 2.88Å; A514-M518 PolarHBondContact O-N 2.96Å
515	A	84.6	Confident	87	Confident	9 Å²	9	35.7 Å²	35.7	7%	0.074	20%	0.2	C	C	.	.	H	α-helix	trans	-59.2	-29	177.3	0	0	0	0	0	113.2	E453 T455 E517 N519	E453-A515 HydrophobicContact CB-CB 4.4Å; E453-A515 HydrophobicContact CG-CB 4.47Å; T455-A515 HydrophobicContact CG2-CB 4.31Å; A515-E517 VanDerWaalsContact C-N 3.28Å; A515-E517 PolarHBondContact O-N 3.24Å; A515-N519 WeakPolarHBondContact O-CB 3.48Å; A515-N519 PolarHBondContact O-N 3.18Å; A515-N519 PolarHBondContact O-ND2 2.98Å
516	S	85.9	Confident	87.5	Confident	77 Å²	77	35.4 Å²	35.4	54%	0.538	20%	0.199	S	C	.	.	H	α-helix	trans	-68.4	-23.9	175	-172.9	0	0	0	0	113.5	A514 K520	A514-S516 PolarHBondContact O-N 3.1Å; A514-S516 VanDerWaalsContact O-N 3.17Å; S516-K520 WeakPolarHBondContact O-CD 3.18Å; S516-K520 WeakPolarHBondContact O-CE 3.21Å; S516-K520 WeakPolarHBondContact O-CG 3.15Å
517	E	88.8	Confident	87.7	Confident	41 Å²	41	39.1 Å²	39.1	19%	0.192	22%	0.218	C	C	.	.	H	α-helix	trans	-80.9	-52.1	174.8	-64	-175.9	145.2	0	0	110.5	G484 T485 F512 S513 A514 A515 N519 K520 A521	G484-E517 WeakPolarHBondContact CA-OE1 3.3Å; G484-E517 WeakPolarHBondContact CA-OE2 3.42Å; T485-E517 PolarHBondContact N-OE2 3.25Å; F512-E517 HydrophobicContact CB-CB 4.47Å; F512-E517 HydrophobicContact CD1-CB 3.94Å; F512-E517 HydrophobicContact CG-CB 4.49Å; S513-E517 PolarHBondContact OG-OE2 3.37Å; A514-E517 HydrophobicContact CB-CG 4.24Å; A514-E517 WeakPolarHBondContact O-CB 3.35Å; A514-E517 PolarHBondContact O-N 2.88Å; A515-E517 VanDerWaalsContact C-N 3.28Å; A515-E517 PolarHBondContact O-N 3.24Å; E517-N519 VanDerWaalsContact C-N 3.28Å; E517-N519 PolarHBondContact O-N 3.42Å; E517-K520 WeakPolarHBondContact O-CB 3.36Å; E517-K520 PolarHBondContact O-N 2.97Å; E517-A521 PolarHBondContact O-N 2.91Å
518	M	88.2	Confident	87.5	Confident	2 Å²	2	42.7 Å²	42.7	1%	0.01	23%	0.232	C	C	.	.	H	α-helix	trans	-50.9	-45.8	174.5	-179.9	-145.8	60.3	0	0	111.9	S454 V456 M457 F512 A514 K520 A521 I522 V539	S454-M518 WeakPolarHBondContact O-CE 3.26Å; V456-M518 VanDerWaalsContact C-SD 3.52Å; M457-M518 HydrophobicContact CB-CG 3.87Å; M457-M518 HydrophobicContact CB-SD 4.27Å; M457-M518 HydrophobicContact CG-CG 4.23Å; F512-M518 HydrophobicContact CB-CB 4.16Å; F512-M518 HydrophobicContact CD2-CB 3.76Å; F512-M518 HydrophobicContact CD2-CG 4.09Å; F512-M518 HydrophobicContact CE2-CB 4.44Å; F512-M518 HydrophobicContact CG-CB 4.01Å; A514-M518 PolarHBondContact O-N 2.96Å; M518-K520 VanDerWaalsContact C-N 3.27Å; M518-K520 PolarHBondContact O-N 2.86Å; M518-A521 PolarHBondContact O-N 3.4Å; M518-A521 VanDerWaalsContact O-N 3.16Å; M518-I522 HydrophobicContact CE-CD1 4Å; M518-I522 HydrophobicContact CG-CD1 3.95Å; M518-I522 HydrophobicContact CG-CG1 4.42Å; M518-I522 WeakPolarHBondContact O-CG1 3.29Å; M518-I522 PolarHBondContact O-N 2.83Å; M518-I522 HydrophobicContact SD-CD1 4.04Å; M518-V539 HydrophobicContact CE-CB 4.5Å; M518-V539 HydrophobicContact CE-CG1 4.06Å; M518-V539 HydrophobicContact CE-CG2 3.78Å; M518-V539 HydrophobicContact SD-CG1 4.14Å; M518-V539 HydrophobicContact SD-CG2 4.38Å
519	N	87.4	Confident	87.2	Confident	71 Å²	71	51.1 Å²	51.1	38%	0.38	26%	0.263	S	S	.	.	H	α-helix	trans	-62.1	-30.6	178.6	-85.6	-75.9	0	0	0	113.6	A515 E517 Q523	A515-N519 WeakPolarHBondContact O-CB 3.48Å; A515-N519 PolarHBondContact O-N 3.18Å; A515-N519 PolarHBondContact O-ND2 2.98Å; E517-N519 VanDerWaalsContact C-N 3.28Å; E517-N519 PolarHBondContact O-N 3.42Å; N519-Q523 VanDerWaalsContact O-CG 3.23Å; N519-Q523 WeakPolarHBondContact O-CG 3.33Å; N519-Q523 PolarHBondContact O-N 2.89Å; N519-Q523 PolarHBondContact O-NE2 3.43Å
520	K	88.7	Confident	86.4	Confident	112 Å²	112	53.7 Å²	53.7	49%	0.487	28%	0.275	S	S	.	.	H	α-helix	trans	-75.4	-41	173.7	-63.9	162.4	-166.1	158.2	0	111.1	S516 E517 M518 Q523 A524	S516-K520 WeakPolarHBondContact O-CD 3.18Å; S516-K520 WeakPolarHBondContact O-CE 3.21Å; S516-K520 WeakPolarHBondContact O-CG 3.15Å; E517-K520 WeakPolarHBondContact O-CB 3.36Å; E517-K520 PolarHBondContact O-N 2.97Å; M518-K520 VanDerWaalsContact C-N 3.27Å; M518-K520 PolarHBondContact O-N 2.86Å; K520-Q523 PolarHBondContact O-N 2.81Å; K520-A524 WeakPolarHBondContact O-CB 3.26Å; K520-A524 PolarHBondContact O-N 3.37Å; K520-A524 VanDerWaalsContact O-N 3.1Å
521	A	88	Confident	85.5	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-60.8	-46.7	176.7	0	0	0	0	0	111	M457 F483 F512 E517 M518 Q523 A524 L525	M457-A521 HydrophobicContact CE-CB 3.64Å; M457-A521 HydrophobicContact SD-CB 4.38Å; F483-A521 HydrophobicContact CB-CB 3.77Å; F483-A521 HydrophobicContact CD2-CB 4.29Å; F483-A521 HydrophobicContact CG-CB 4.1Å; F512-A521 HydrophobicContact CE1-CB 4.23Å; F512-A521 HydrophobicContact CE2-CB 4.38Å; F512-A521 HydrophobicContact CZ-CB 3.75Å; E517-A521 PolarHBondContact O-N 2.91Å; M518-A521 PolarHBondContact O-N 3.4Å; M518-A521 VanDerWaalsContact O-N 3.16Å; A521-Q523 PolarHBondContact O-N 3.49Å; A521-A524 PolarHBondContact O-N 3.41Å; A521-A524 VanDerWaalsContact O-N 3.1Å; A521-L525 WeakPolarHBondContact O-CB 3.34Å; A521-L525 WeakPolarHBondContact O-CG 3.34Å; A521-L525 PolarHBondContact O-N 2.92Å
522	I	89	Confident	85	Confident	22 Å²	22	59.2 Å²	59.2	11%	0.113	34%	0.341	C	S	.	.	H	α-helix	trans	-55.5	-48.4	173.1	-70	170.7	0	0	0	111	M457 M518 A524 L525 N526 A537 V539	M457-I522 HydrophobicContact CB-CD1 3.89Å; M457-I522 HydrophobicContact CB-CG1 3.89Å; M457-I522 HydrophobicContact CG-CG1 4.38Å; M457-I522 HydrophobicContact SD-CG1 3.64Å; M518-I522 HydrophobicContact CE-CD1 4Å; M518-I522 HydrophobicContact CG-CD1 3.95Å; M518-I522 HydrophobicContact CG-CG1 4.42Å; M518-I522 WeakPolarHBondContact O-CG1 3.29Å; M518-I522 PolarHBondContact O-N 2.83Å; M518-I522 HydrophobicContact SD-CD1 4.04Å; I522-A524 PolarHBondContact O-N 3.45Å; I522-L525 PolarHBondContact O-N 2.87Å; I522-N526 WeakPolarHBondContact O-CB 3.3Å; I522-N526 PolarHBondContact O-N 3.23Å; I522-A537 HydrophobicContact CG1-CB 4.47Å; I522-A537 WeakPolarHBondContact CG2-O 3.35Å; I522-V539 HydrophobicContact CD1-CB 4.37Å; I522-V539 HydrophobicContact CD1-CG2 3.47Å; I522-V539 VanDerWaalsContact CD1-CG2 3.47Å
523	Q	87.9	Confident	84.5	Confident	159 Å²	159	63.2 Å²	63.2	74%	0.743	36%	0.356	S	S	*	.	H	α-helix	trans	-65.1	-18.4	179.7	-72.9	170.5	27.6	0	0	114.4	N519 K520 A521	N519-Q523 VanDerWaalsContact O-CG 3.23Å; N519-Q523 WeakPolarHBondContact O-CG 3.33Å; N519-Q523 PolarHBondContact O-N 2.89Å; N519-Q523 PolarHBondContact O-NE2 3.43Å; K520-Q523 PolarHBondContact O-N 2.81Å; A521-Q523 PolarHBondContact O-N 3.49Å
524	A	87.3	Confident	84.3	Confident	41 Å²	41	64 Å²	64	34%	0.339	35%	0.352	S	S	.	.	H	α-helix	trans	-103.7	-20.3	179.9	0	0	0	0	0	114.2	F483 K520 A521 I522	F483-A524 HydrophobicContact CD1-CB 4.08Å; F483-A524 HydrophobicContact CE1-CB 3.34Å; F483-A524 HydrophobicContact CE2-CB 4.43Å; F483-A524 HydrophobicContact CZ-CB 3.56Å; K520-A524 WeakPolarHBondContact O-CB 3.26Å; K520-A524 PolarHBondContact O-N 3.37Å; K520-A524 VanDerWaalsContact O-N 3.1Å; A521-A524 PolarHBondContact O-N 3.41Å; A521-A524 VanDerWaalsContact O-N 3.1Å; I522-A524 PolarHBondContact O-N 3.45Å
525	L	85.6	Confident	84.4	Confident	6 Å²	6	62.4 Å²	62.4	3%	0.031	34%	0.338	C	S	.	.	H	α-helix	trans	-108.4	-27	-177.3	-61.2	176.5	0	0	0	113	M457 L459 F483 A521 I522 R528 A537	M457-L525 HydrophobicContact CE-CD1 3.99Å; L459-L525 HydrophobicContact CD2-CD1 4.22Å; F483-L525 HydrophobicContact CE2-CD2 4.22Å; F483-L525 HydrophobicContact CE2-CG 4.36Å; A521-L525 WeakPolarHBondContact O-CB 3.34Å; A521-L525 WeakPolarHBondContact O-CG 3.34Å; A521-L525 PolarHBondContact O-N 2.92Å; I522-L525 PolarHBondContact O-N 2.87Å; L525-R528 VanDerWaalsContact O-CB 3.31Å; L525-R528 WeakPolarHBondContact O-CB 3.36Å; L525-R528 PolarHBondContact O-N 3.12Å; L525-A537 HydrophobicContact CB-CB 4.49Å
526	N	87.8	Confident	84.6	Confident	48 Å²	48	64.4 Å²	64.4	26%	0.257	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	143.2	169.5	-165.6	66.1	0	0	0	110.2	I522 R528 V536 A537	I522-N526 WeakPolarHBondContact O-CB 3.3Å; I522-N526 PolarHBondContact O-N 3.23Å; N526-R528 PolarHBondContact O-N 3.39Å; N526-V536 WeakPolarHBondContact OD1-CA 3.26Å; N526-A537 HydrophobicContact CB-CB 4.11Å; N526-A537 PolarHBondContact OD1-N 3.18Å; N526-A537 PolarHBondContact OD1-O 3.28Å
527	D	86.5	Confident	84.7	Confident	86 Å²	86	60.9 Å²	60.9	46%	0.46	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.8	-0.2	-176.4	-54.2	-66.4	0	0	0	116.4	K534 V535	D527-K534 VanDerWaalsContact CA-CE 3.45Å; D527-K534 WeakPolarHBondContact OD1-CE 3.44Å; D527-K534 IonicContact OD1-NZ 2.64Å; D527-K534 PolarHBondContact OD1-NZ 2.95Å; D527-V535 PolarHBondContact N-O 3.49Å
528	R	84	Confident	84.6	Confident	86 Å²	86	62.9 Å²	62.9	33%	0.325	33%	0.334	S	S	.	.			trans	-70.1	148.3	175.1	-172.5	168.1	163.9	-167.8	-7.5	110.7	E479 L525 N526 F530 V535	E479-R528 IonicContact OE2-CZ 3.81Å; E479-R528 IonicContact OE2-NH1 3.5Å; E479-R528 PolarHBondContact OE2-NH1 2.88Å; E479-R528 IonicContact OE2-NH2 3.06Å; E479-R528 PolarHBondContact OE2-NH2 2.85Å; L525-R528 VanDerWaalsContact O-CB 3.31Å; L525-R528 WeakPolarHBondContact O-CB 3.36Å; L525-R528 PolarHBondContact O-N 3.12Å; N526-R528 PolarHBondContact O-N 3.39Å; R528-F530 HydrophobicContact CB-CE2 4.43Å; R528-F530 HydrophobicContact CG-CD2 4.02Å; R528-F530 HydrophobicContact CG-CE2 3.73Å; R528-F530 VanDerWaalsContact NE-CE2 3.26Å; R528-V535 WeakPolarHBondContact O-CG2 3.21Å; R528-V535 PolarHBondContact O-N 3.32Å
529	W	80	Confident	84.6	Confident	177 Å²	177	66.5 Å²	66.5	67%	0.67	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.4	134	178.8	-69.1	72.7	0	0	0	111.2	G532 R533 K534	W529-G532 WeakPolarHBondContact CZ3-O 3.47Å; W529-R533 WeakPolarHBondContact CA-O 2.8Å; W529-K534 HydrophobicContact CD2-CB 4.17Å; W529-K534 HydrophobicContact CE3-CB 4.33Å; W529-K534 HydrophobicContact CH2-CB 4.42Å; W529-K534 HydrophobicContact CZ2-CB 4.25Å; W529-K534 HydrophobicContact CZ2-CD 4.35Å; W529-K534 HydrophobicContact CZ2-CG 4.48Å; W529-K534 HydrophobicContact CZ3-CB 4.45Å
530	F	73.9	Confident	84.4	Confident	55 Å²	55	63.4 Å²	63.4	24%	0.241	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	135.9	176	-80.3	-98	0	0	0	108.4	M462 R528 G532 R533 V535	M462-F530 HydrophobicContact CE-CE1 4.36Å; M462-F530 HydrophobicContact CE-CZ 4.23Å; R528-F530 HydrophobicContact CB-CE2 4.43Å; R528-F530 HydrophobicContact CG-CD2 4.02Å; R528-F530 HydrophobicContact CG-CE2 3.73Å; R528-F530 VanDerWaalsContact NE-CE2 3.26Å; F530-G532 PolarHBondContact O-N 2.89Å; F530-R533 PolarHBondContact N-O 2.81Å; F530-R533 CarbonylContact O-C 3.59Å; F530-R533 WeakPolarHBondContact O-CA 3.4Å; F530-R533 PolarHBondContact O-N 3.45Å; F530-V535 HydrophobicContact CB-CG2 4.3Å; F530-V535 HydrophobicContact CD2-CG2 3.54Å; F530-V535 HydrophobicContact CE2-CG2 4.22Å; F530-V535 HydrophobicContact CG-CG2 4.33Å
531	G	69.2	Low	84.2	Confident	87 Å²	87	59.3 Å²	59.3	90%	0.897	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.1	16.4	178.4	0	0	0	0	0	116	R533	G531-R533 PolarHBondContact O-N 3.36Å
532	G	78.6	Confident	83.7	Confident	64 Å²	64	60.7 Å²	60.7	66%	0.66	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.4	-1.6	-169.6	0	0	0	0	0	114.8	W529 F530	W529-G532 WeakPolarHBondContact CZ3-O 3.47Å; F530-G532 PolarHBondContact O-N 2.89Å
533	R	78.9	Confident	82.9	Confident	86 Å²	86	64.5 Å²	64.5	33%	0.325	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	161.6	167.9	-49.8	-173	-155.3	-146.5	5.8	109.5	E466 D467 W529 F530 G531	E466-R533 IonicContact OE1-CZ 3.86Å; E466-R533 IonicContact OE1-NH1 2.68Å; E466-R533 IonicContact OE1-NH2 2.68Å; E466-R533 PolarHBondContact OE1-NH2 3.44Å; D467-R533 IonicContact OD2-NH2 3.71Å; W529-R533 WeakPolarHBondContact CA-O 2.8Å; F530-R533 PolarHBondContact N-O 2.81Å; F530-R533 CarbonylContact O-C 3.59Å; F530-R533 WeakPolarHBondContact O-CA 3.4Å; F530-R533 PolarHBondContact O-N 3.45Å; G531-R533 PolarHBondContact O-N 3.36Å
534	K	84.6	Confident	82.2	Confident	80 Å²	80	61.2 Å²	61.2	35%	0.348	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	119.7	178.7	-176.9	-171	170.9	-166.8	0	109.3	N461 D527 W529	N461-K534 PolarHBondContact ND2-O 3.24Å; D527-K534 VanDerWaalsContact CA-CE 3.45Å; D527-K534 WeakPolarHBondContact OD1-CE 3.44Å; D527-K534 IonicContact OD1-NZ 2.64Å; D527-K534 PolarHBondContact OD1-NZ 2.95Å; W529-K534 HydrophobicContact CD2-CB 4.17Å; W529-K534 HydrophobicContact CE3-CB 4.33Å; W529-K534 HydrophobicContact CH2-CB 4.42Å; W529-K534 HydrophobicContact CZ2-CB 4.25Å; W529-K534 HydrophobicContact CZ2-CD 4.35Å; W529-K534 HydrophobicContact CZ2-CG 4.48Å; W529-K534 HydrophobicContact CZ3-CB 4.45Å
535	V	88.1	Confident	81.6	Confident	1 Å²	1	59.6 Å²	59.6	1%	0.006	32%	0.316	C	S	.	.			trans	-74	138	-178.3	-171.9	0	0	0	0	110.3	L459 M462 D527 R528 F530	L459-V535 HydrophobicContact CB-CG1 4.48Å; L459-V535 HydrophobicContact CD2-CG1 4.31Å; M462-V535 HydrophobicContact CB-CG1 4.28Å; M462-V535 HydrophobicContact CB-CG2 4.21Å; M462-V535 HydrophobicContact CG-CG2 4.1Å; D527-V535 PolarHBondContact N-O 3.49Å; R528-V535 WeakPolarHBondContact O-CG2 3.21Å; R528-V535 PolarHBondContact O-N 3.32Å; F530-V535 HydrophobicContact CB-CG2 4.3Å; F530-V535 HydrophobicContact CD2-CG2 3.54Å; F530-V535 HydrophobicContact CE2-CG2 4.22Å; F530-V535 HydrophobicContact CG-CG2 4.33Å
536	V	87.8	Confident	81	Confident	51 Å²	51	64 Å²	64	31%	0.309	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	123.7	171	178.5	0	0	0	0	107.3	L459 R460 N526 E538	L459-V536 WeakPolarHBondContact CA-O 3.45Å; R460-V536 HydrophobicContact CB-CB 4.36Å; R460-V536 PolarHBondContact N-O 3.08Å; R460-V536 PolarHBondContact O-N 3.46Å; N526-V536 WeakPolarHBondContact OD1-CA 3.26Å; V536-E538 HydrophobicContact CG1-CG 3.96Å
537	A	89	Confident	80.2	Confident	4 Å²	4	65.6 Å²	65.6	3%	0.033	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	119.9	-180	0	0	0	0	0	109.4	M457 V458 L459 I522 L525 N526	M457-A537 HydrophobicContact SD-CB 4.4Å; V458-A537 WeakPolarHBondContact O-CA 3.4Å; L459-A537 HydrophobicContact CG-CB 4.44Å; I522-A537 HydrophobicContact CG1-CB 4.47Å; I522-A537 WeakPolarHBondContact CG2-O 3.35Å; L525-A537 HydrophobicContact CB-CB 4.49Å; N526-A537 HydrophobicContact CB-CB 4.11Å; N526-A537 PolarHBondContact OD1-N 3.18Å; N526-A537 PolarHBondContact OD1-O 3.28Å
538	E	86.3	Confident	79.2	Confident	83 Å²	83	65.6 Å²	65.6	39%	0.388	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	148.4	-173.4	-66.1	177.9	121.2	0	0	110.8	M457 V458 R460 V536 Y540	M457-E538 CarbonylContact C-O 3.54Å; M457-E538 VanDerWaalsContact CA-O 3.28Å; M457-E538 WeakPolarHBondContact CA-O 3.28Å; M457-E538 WeakPolarHBondContact CB-O 3.26Å; V458-E538 HydrophobicContact CG1-CB 4.13Å; V458-E538 PolarHBondContact N-O 3.48Å; V458-E538 PolarHBondContact O-N 3.49Å; R460-E538 WeakPolarHBondContact CD-OE2 3.28Å; R460-E538 IonicContact CZ-OE2 3.76Å; R460-E538 IonicContact NE-OE2 3.98Å; R460-E538 IonicContact NH1-OE2 3.72Å; R460-E538 PolarHBondContact NH1-OE2 3.47Å; V536-E538 HydrophobicContact CG1-CG 3.96Å; E538-Y540 PolarHBondContact O-N 2.86Å
539	V	88.2	Confident	78.8	Confident	77 Å²	77	64.7 Å²	64.7	47%	0.467	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	125.1	172.7	-178.1	0	0	0	0	108.8	M518 I522	M518-V539 HydrophobicContact CE-CB 4.5Å; M518-V539 HydrophobicContact CE-CG1 4.06Å; M518-V539 HydrophobicContact CE-CG2 3.78Å; M518-V539 HydrophobicContact SD-CG1 4.14Å; M518-V539 HydrophobicContact SD-CG2 4.38Å; I522-V539 HydrophobicContact CD1-CB 4.37Å; I522-V539 HydrophobicContact CD1-CG2 3.47Å; I522-V539 VanDerWaalsContact CD1-CG2 3.47Å
540	Y	84.2	Confident	78.2	Confident	7 Å²	7	57.6 Å²	57.6	3%	0.027	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-98	154.6	174.1	-161.2	-97.6	0	0	0	111.2	S454 V456 V458 F509 E538 R544 F545 D549 A552	S454-Y540 WeakPolarHBondContact CB-O 3.48Å; S454-Y540 PolarHBondContact OG-O 3.43Å; V456-Y540 PolarHBondContact O-N 2.78Å; V458-Y540 HydrophobicContact CB-CD2 4.24Å; V458-Y540 HydrophobicContact CG1-CD2 4.06Å; F509-Y540 HydrophobicContact CD1-CD1 4.17Å; F509-Y540 HydrophobicContact CD1-CD2 4.25Å; F509-Y540 HydrophobicContact CD1-CG 4Å; F509-Y540 HydrophobicContact CE1-CD1 4.1Å; F509-Y540 AromaticContact CE1-CD2 3.65Å; F509-Y540 HydrophobicContact CE1-CD2 3.65Å; F509-Y540 HydrophobicContact CE1-CE1 4.17Å; F509-Y540 AromaticContact CE1-CE2 3.71Å; F509-Y540 HydrophobicContact CE1-CE2 3.71Å; F509-Y540 AromaticContact CE1-CG 3.85Å; F509-Y540 HydrophobicContact CE1-CG 3.85Å; F509-Y540 AromaticContact CE1-CZ 3.99Å; E538-Y540 PolarHBondContact O-N 2.86Å; Y540-R544 HydrophobicContact CE1-CB 3.68Å; Y540-F545 HydrophobicContact CD1-CB 4.16Å; Y540-F545 HydrophobicContact CE1-CB 4.35Å; Y540-D549 PolarHBondContact OH-O 3.27Å; Y540-A552 HydrophobicContact CE2-CB 4.21Å
541	D	83.1	Confident	77.6	Confident	25 Å²	25	58 Å²	58	13%	0.134	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-81.6	122.7	-173.5	-135.2	-48	0	0	0	111.1	K451 D543 R544 F545	K451-D541 WeakPolarHBondContact CE-OD2 3.37Å; K451-D541 IonicContact NZ-OD1 3.18Å; K451-D541 IonicContact NZ-OD2 2.73Å; K451-D541 PolarHBondContact NZ-OD2 3.16Å; D541-D543 VanDerWaalsContact C-N 3.26Å; D541-D543 PolarHBondContact O-N 3.16Å; D541-R544 HydrophobicContact CB-CB 4.31Å; D541-R544 HydrophobicContact CB-CG 4.41Å; D541-R544 PolarHBondContact O-N 2.95Å; D541-R544 VanDerWaalsContact O-N 3.17Å; D541-R544 IonicContact OD2-NH2 2.63Å; D541-F545 PolarHBondContact O-N 3.24Å; D541-F545 VanDerWaalsContact O-N 3.07Å
542	Q	78.1	Confident	76.8	Confident	29 Å²	29	56.4 Å²	56.4	14%	0.136	33%	0.326	C	S	.	.	H	α-helix	trans	-56.5	-43	-175.5	-158.5	90.3	29.6	0	0	111.6	T455 R544 F545 N546	T455-Q542 PolarHBondContact OG1-NE2 3.37Å; T455-Q542 PolarHBondContact OG1-OE1 3.44Å; Q542-R544 VanDerWaalsContact C-N 3.29Å; Q542-R544 PolarHBondContact O-N 2.83Å; Q542-F545 PolarHBondContact O-N 3.01Å; Q542-N546 WeakPolarHBondContact O-CB 3.5Å; Q542-N546 PolarHBondContact O-N 3.12Å; Q542-N546 PolarHBondContact O-ND2 3.27Å
543	D	72.8	Confident	76.7	Confident	102 Å²	102	56 Å²	56	55%	0.545	31%	0.309	S	S	.	.	H	α-helix	trans	-69.2	-27.7	-174.4	-63.7	-54.7	0	0	0	112.5	S452 D541 S547	S452-D543 PolarHBondContact OG-OD2 3.4Å; D541-D543 VanDerWaalsContact C-N 3.26Å; D541-D543 PolarHBondContact O-N 3.16Å; D543-S547 WeakPolarHBondContact O-CB 3.29Å; D543-S547 PolarHBondContact O-N 2.93Å; D543-S547 VanDerWaalsContact O-N 3.09Å; D543-S547 PolarHBondContact O-OG 2.86Å
544	R	73.4	Confident	76.6	Confident	91 Å²	91	54.4 Å²	54.4	34%	0.343	31%	0.308	S	S	.	.	H	α-helix	trans	-78.4	-38.8	172.5	-72.4	-173.2	-69.8	168.1	3.1	112.6	Y540 D541 Q542 N546 S547 S548 D549	Y540-R544 HydrophobicContact CE1-CB 3.68Å; D541-R544 HydrophobicContact CB-CB 4.31Å; D541-R544 HydrophobicContact CB-CG 4.41Å; D541-R544 PolarHBondContact O-N 2.95Å; D541-R544 VanDerWaalsContact O-N 3.17Å; D541-R544 IonicContact OD2-NH2 2.63Å; Q542-R544 VanDerWaalsContact C-N 3.29Å; Q542-R544 PolarHBondContact O-N 2.83Å; R544-N546 VanDerWaalsContact C-N 3.33Å; R544-N546 PolarHBondContact O-N 3.3Å; R544-S547 WeakPolarHBondContact CA-OG 3.49Å; R544-S547 PolarHBondContact O-N 3.3Å; R544-S547 PolarHBondContact O-OG 2.96Å; R544-S548 PolarHBondContact O-N 2.89Å; R544-S548 VanDerWaalsContact O-N 3.11Å; R544-D549 HydrophobicContact CB-CB 4.31Å; R544-D549 PolarHBondContact O-N 3.09Å
545	F	74.7	Confident	76.1	Confident	6 Å²	6	53 Å²	53	3%	0.026	31%	0.306	C	S	.	.	H	α-helix	trans	-62.3	-43.3	172.6	-174.2	-103.6	0	0	0	111.1	V456 I490 F509 E511 Y540 D541 Q542 S547 S548 L550	V456-F545 HydrophobicContact CB-CG 4.43Å; V456-F545 HydrophobicContact CG1-CB 4.33Å; V456-F545 HydrophobicContact CG1-CD1 4.41Å; V456-F545 HydrophobicContact CG1-CD2 3.73Å; V456-F545 HydrophobicContact CG1-CE2 4.03Å; V456-F545 HydrophobicContact CG1-CG 3.92Å; V456-F545 HydrophobicContact CG1-CZ 4.49Å; V456-F545 HydrophobicContact CG2-CB 4.06Å; V456-F545 HydrophobicContact CG2-CD1 3.65Å; V456-F545 HydrophobicContact CG2-CD2 4.42Å; V456-F545 HydrophobicContact CG2-CE1 4.13Å; V456-F545 HydrophobicContact CG2-CG 3.8Å; I490-F545 HydrophobicContact CD1-CE2 3.58Å; I490-F545 HydrophobicContact CD1-CZ 3.71Å; I490-F545 HydrophobicContact CG1-CE2 4.16Å; I490-F545 HydrophobicContact CG1-CZ 4.24Å; F509-F545 HydrophobicContact CB-CD2 4.22Å; F509-F545 HydrophobicContact CB-CE2 3.78Å; E511-F545 HydrophobicContact CB-CE1 3.96Å; E511-F545 HydrophobicContact CB-CZ 4.1Å; E511-F545 HydrophobicContact CG-CE1 4.28Å; Y540-F545 HydrophobicContact CD1-CB 4.16Å; Y540-F545 HydrophobicContact CE1-CB 4.35Å; D541-F545 PolarHBondContact O-N 3.24Å; D541-F545 VanDerWaalsContact O-N 3.07Å; Q542-F545 PolarHBondContact O-N 3.01Å; F545-S547 PolarHBondContact O-N 3.47Å; F545-S548 PolarHBondContact O-N 2.86Å; F545-L550 HydrophobicContact CD2-CD2 4.36Å
546	N	72.7	Confident	75.4	Confident	99 Å²	99	56.1 Å²	56.1	53%	0.529	32%	0.323	S	S	.	.	H	α-helix	trans	-62.6	-38.6	175.2	-70.7	-18.9	0	0	0	112.5	Q542 R544 S548	Q542-N546 WeakPolarHBondContact O-CB 3.5Å; Q542-N546 PolarHBondContact O-N 3.12Å; Q542-N546 PolarHBondContact O-ND2 3.27Å; R544-N546 VanDerWaalsContact C-N 3.33Å; R544-N546 PolarHBondContact O-N 3.3Å; N546-S548 PolarHBondContact O-N 3.35Å
547	S	71.3	Confident	74.6	Confident	82 Å²	82	56.4 Å²	56.4	57%	0.573	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-1.8	174	71	0	0	0	0	114.2	D543 R544 F545 D549	D543-S547 WeakPolarHBondContact O-CB 3.29Å; D543-S547 PolarHBondContact O-N 2.93Å; D543-S547 VanDerWaalsContact O-N 3.09Å; D543-S547 PolarHBondContact O-OG 2.86Å; R544-S547 WeakPolarHBondContact CA-OG 3.49Å; R544-S547 PolarHBondContact O-N 3.3Å; R544-S547 PolarHBondContact O-OG 2.96Å; F545-S547 PolarHBondContact O-N 3.47Å; S547-D549 PolarHBondContact O-N 3.32Å
548	S	65.4	Low	73.7	Confident	86 Å²	86	59.9 Å²	59.9	60%	0.601	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.3	26.9	-173.5	-53.5	0	0	0	0	114.4	R544 F545 N546 L550	R544-S548 PolarHBondContact O-N 2.89Å; R544-S548 VanDerWaalsContact O-N 3.11Å; F545-S548 PolarHBondContact O-N 2.86Å; N546-S548 PolarHBondContact O-N 3.35Å; S548-L550 PolarHBondContact O-N 3.23Å
549	D	73.8	Confident	72.8	Confident	67 Å²	67	58.2 Å²	58.2	36%	0.358	34%	0.341	S	S	.	.			trans	-79.2	112.7	165	178.1	15.4	0	0	0	109.2	Y540 R544 S547 S551	Y540-D549 PolarHBondContact OH-O 3.27Å; R544-D549 HydrophobicContact CB-CB 4.31Å; R544-D549 PolarHBondContact O-N 3.09Å; S547-D549 PolarHBondContact O-N 3.32Å; D549-S551 PolarHBondContact OD1-N 3.05Å
550	L	68.9	Low	71.6	Confident	27 Å²	27	56.8 Å²	56.8	14%	0.141	33%	0.331	C	S	.	.			trans	-118.2	1.6	-174.8	-59.6	173.8	0	0	0	113	I490 Y492 F509 F545 S548	I490-L550 HydrophobicContact CG2-CD1 4.05Å; Y492-L550 HydrophobicContact CD1-CB 4.2Å; Y492-L550 WeakPolarHBondContact CD1-O 3.43Å; Y492-L550 HydrophobicContact CD2-CB 3.99Å; Y492-L550 HydrophobicContact CD2-CD1 4.1Å; Y492-L550 HydrophobicContact CE1-CB 4.38Å; Y492-L550 WeakPolarHBondContact CE1-O 3.35Å; Y492-L550 HydrophobicContact CE2-CB 4.19Å; Y492-L550 HydrophobicContact CG-CB 3.99Å; F509-L550 HydrophobicContact CD1-CD2 4.37Å; F509-L550 HydrophobicContact CD2-CD2 3.87Å; F509-L550 HydrophobicContact CE1-CD2 4.32Å; F509-L550 HydrophobicContact CE2-CB 4.02Å; F509-L550 HydrophobicContact CE2-CD2 3.83Å; F509-L550 HydrophobicContact CE2-CG 4.44Å; F509-L550 HydrophobicContact CG-CD2 4.15Å; F509-L550 HydrophobicContact CZ-CB 4.19Å; F509-L550 HydrophobicContact CZ-CD2 4.06Å; F509-L550 WeakPolarHBondContact CZ-O 3.34Å; F545-L550 HydrophobicContact CD2-CD2 4.36Å; S548-L550 PolarHBondContact O-N 3.23Å
551	S	61.3	Low	70.6	Confident	63 Å²	63	60.9 Å²	60.9	44%	0.441	36%	0.356	S	S	.	.			trans	-82.7	-12	-172.4	-174.9	0	0	0	0	114	E494 K507 D549	E494-S551 WeakPolarHBondContact OE1-CA 3.43Å; E494-S551 WeakPolarHBondContact OE1-CB 3.36Å; E494-S551 PolarHBondContact OE1-OG 2.88Å; K507-S551 VanDerWaalsContact NZ-C 3.29Å; K507-S551 PolarHBondContact NZ-O 3.14Å; D549-S551 PolarHBondContact OD1-N 3.05Å
552	A	51.3	Low	69.4	Low	54 Å²	54	64.2 Å²	64.2	45%	0.446	38%	0.376	S	S	.	.			trans	-80.7	0	-172.5	0	0	0	0	0	116.8	R460 K507 Y540	R460-A552 PolarHBondContact NH2-O 3.39Å; R460-A552 PolarHBondContact NH2-OXT 2.96Å; K507-A552 PolarHBondContact NZ-O 3.45Å; Y540-A552 HydrophobicContact CE2-CB 4.21Å

Retrieved 552 of 552 residues in 2443.1 ms (Link to these results)

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