A0A077Z4V7_TRITR Loading...

Brain tumor protein

AlphaFold DB , UniProt , Accession A0A077Z4V7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 712 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	25.8	Very low	25.7	Very low	233 Å²	233	138.8 Å²	138.8	100%	1.148	77%	0.769	S	S	*	*				0	140.6	0	-73.3	-167.7	175.7	0	0	107.7	N3	M1-N3 PolarHBondContact O-N 2.74Å
2	P	29.3	Very low	25.7	Very low	122 Å²	122	137.4 Å²	137.4	79%	0.792	78%	0.776	S	S	*	*			trans	-71.1	127.7	-172.7	8.7	4.8	0	0	0	110.2	V4	P2-V4 PolarHBondContact O-N 2.82Å; P2-V4 VanDerWaalsContact O-N 3.15Å
3	N	27.5	Very low	25.6	Very low	151 Å²	151	130.4 Å²	130.4	81%	0.807	75%	0.753	S	S	*	*			trans	-15.7	98.5	166.6	-58.7	-16.1	0	0	0	114.5	M1 V5	M1-N3 PolarHBondContact O-N 2.74Å; N3-V5 PolarHBondContact O-N 3.39Å
4	V	23.3	Very low	25.5	Very low	126 Å²	126	126.8 Å²	126.8	76%	0.764	76%	0.758	S	S	*	*			trans	-77.9	98.2	160.7	179.3	0	0	0	0	106.2	P2 I6	P2-V4 PolarHBondContact O-N 2.82Å; P2-V4 VanDerWaalsContact O-N 3.15Å; V4-I6 HydrophobicContact CG1-CG1 4.06Å; V4-I6 PolarHBondContact O-N 2.9Å; V4-I6 VanDerWaalsContact O-N 3.14Å
5	V	26	Very low	25.4	Very low	102 Å²	102	125.9 Å²	125.9	62%	0.618	75%	0.753	S	S	*	*			trans	-68.4	102.2	169.2	176.3	0	0	0	0	107	N3 N7	N3-V5 PolarHBondContact O-N 3.39Å; V5-N7 PolarHBondContact O-N 3.02Å; V5-N7 VanDerWaalsContact O-N 3.14Å
6	I	24.5	Very low	25.3	Very low	131 Å²	131	128.3 Å²	128.3	67%	0.672	76%	0.761	S	S	*	*			trans	-80.4	94.1	175.8	-59.5	177.7	0	0	0	107.3	V4 C8	V4-I6 HydrophobicContact CG1-CG1 4.06Å; V4-I6 PolarHBondContact O-N 2.9Å; V4-I6 VanDerWaalsContact O-N 3.14Å; I6-C8 PolarHBondContact O-N 2.93Å
7	N	24.8	Very low	25.2	Very low	129 Å²	129	128.3 Å²	128.3	69%	0.69	76%	0.755	S	S	*	*			trans	-61.4	104	167.5	-101.1	-27.2	0	0	0	109.2	V5 L9	V5-N7 PolarHBondContact O-N 3.02Å; V5-N7 VanDerWaalsContact O-N 3.14Å; N7-L9 PolarHBondContact O-N 3.24Å
8	C	24.1	Very low	25.1	Very low	107 Å²	107	128.1 Å²	128.1	72%	0.723	76%	0.758	S	S	*	*			trans	-72.8	74.6	168.3	-76.3	0	0	0	0	109.9	I6	I6-C8 PolarHBondContact O-N 2.93Å
9	L	25.2	Very low	25.2	Very low	137 Å²	137	131.9 Å²	131.9	72%	0.717	76%	0.76	S	S	*	*	S	Bend	trans	-116.8	114.2	163.3	-83.8	162.8	0	0	0	107.7	N7	N7-L9 PolarHBondContact O-N 3.24Å
10	N	24.6	Very low	25.1	Very low	149 Å²	149	134.1 Å²	134.1	80%	0.797	76%	0.762	S	S	*	*			trans	54.2	71.2	168.5	-68.6	-18	0	0	0	116.2	S12	N10-S12 PolarHBondContact O-N 3.45Å
11	L	27.5	Very low	25.1	Very low	140 Å²	140	133.8 Å²	133.8	73%	0.733	77%	0.769	S	S	*	*			trans	-77.8	69.2	160.6	-73.4	166.6	0	0	0	110.3
12	S	26.3	Very low	25.2	Very low	122 Å²	122	127.8 Å²	127.8	85%	0.853	75%	0.75	S	S	*	*			trans	-88.7	18.3	153.5	61.4	0	0	0	0	111.4	N10	N10-S12 PolarHBondContact O-N 3.45Å
13	G	23.7	Very low	25.2	Very low	46 Å²	46	126.6 Å²	126.6	47%	0.474	75%	0.751	S	S	.	*	S	Bend	trans	-114.9	109.3	173.6	0	0	0	0	0	109.5	V15	G13-V15 PolarHBondContact O-N 3.17Å
14	G	24.8	Very low	25.1	Very low	80 Å²	80	125.4 Å²	125.4	83%	0.825	75%	0.754	S	S	*	*			trans	-58.1	123.1	177.6	0	0	0	0	0	111.3
15	V	24	Very low	25.5	Very low	113 Å²	113	126.9 Å²	126.9	69%	0.685	75%	0.75	S	S	*	*			trans	-100.7	106.6	165.5	180	0	0	0	0	106.4	G13 I17	G13-V15 PolarHBondContact O-N 3.17Å; V15-I17 PolarHBondContact O-N 3.02Å
16	D	23.7	Very low	25.8	Very low	164 Å²	164	126.8 Å²	126.8	88%	0.877	75%	0.746	S	S	*	*			trans	-65.5	99.9	174.6	-78.5	-39.8	0	0	0	109.8
17	I	23.8	Very low	26	Very low	129 Å²	129	124.6 Å²	124.6	66%	0.662	74%	0.741	S	S	*	*			trans	-88.8	124.9	165.3	-56.9	174.7	0	0	0	106.5	V15 Y19	V15-I17 PolarHBondContact O-N 3.02Å; I17-Y19 PolarHBondContact O-N 3Å
18	P	22.7	Very low	26.3	Very low	125 Å²	125	123 Å²	123	81%	0.812	74%	0.739	S	S	*	*			trans	-70.2	106.5	-173.6	28	-31.4	0	0	0	109.3
19	Y	26.4	Very low	26.6	Very low	201 Å²	201	122.3 Å²	122.3	79%	0.788	74%	0.736	S	S	*	*			trans	-90.1	124.1	179.6	-121.7	-93.1	0	0	0	110.2	I17 S21	I17-Y19 PolarHBondContact O-N 3Å; Y19-S21 PolarHBondContact O-N 2.9Å
20	E	24	Very low	26.7	Very low	174 Å²	174	119.3 Å²	119.3	81%	0.813	72%	0.72	S	S	*	*			trans	-57.9	132	175.7	-72.8	-179.9	153.5	0	0	111.6	S22	E20-S22 PolarHBondContact O-N 3.16Å
21	S	25.1	Very low	26.8	Very low	129 Å²	129	117.6 Å²	117.6	90%	0.902	72%	0.717	S	S	*	*			trans	-56.5	104	176.5	54.5	0	0	0	0	111.1	Y19	Y19-S21 PolarHBondContact O-N 2.9Å
22	S	28.3	Very low	26.6	Very low	107 Å²	107	120.2 Å²	120.2	75%	0.748	72%	0.722	S	S	*	*			trans	-123.8	114.5	165.4	47.8	0	0	0	0	109.4	E20	E20-S22 PolarHBondContact O-N 3.16Å
23	A	28.7	Very low	26.6	Very low	97 Å²	97	121.1 Å²	121.1	80%	0.802	72%	0.722	S	S	*	*			trans	27.1	106.4	166.4	0	0	0	0	0	117	F25	A23-F25 PolarHBondContact O-N 3.2Å
24	S	26.5	Very low	26.6	Very low	125 Å²	125	127.1 Å²	127.1	87%	0.874	74%	0.738	S	S	*	*			trans	-46.5	109.7	166.2	50.3	0	0	0	0	111.2	D26	S24-D26 PolarHBondContact O-N 3.38Å
25	F	31.6	Very low	26.6	Very low	157 Å²	157	131.7 Å²	131.7	69%	0.689	74%	0.738	S	S	*	*			trans	-68.1	109.1	170.8	-176.2	-95.1	0	0	0	108.4	A23 P27	A23-F25 PolarHBondContact O-N 3.2Å; F25-P27 HydrophobicContact CD1-CG 4.25Å; F25-P27 HydrophobicContact CE1-CB 4.32Å; F25-P27 VanDerWaalsContact O-CD 3.28Å; F25-P27 WeakPolarHBondContact O-CD 3.35Å
26	D	30.6	Very low	26.6	Very low	101 Å²	101	133.8 Å²	133.8	54%	0.54	74%	0.743	S	S	.	*			trans	-85.2	107.4	172	-170.1	-18.6	0	0	0	109.4	S24 S28 S29	S24-D26 PolarHBondContact O-N 3.38Å; D26-S28 PolarHBondContact O-N 2.88Å; D26-S28 VanDerWaalsContact O-N 3.12Å; D26-S28 WeakPolarHBondContact OD1-CB 3.39Å; D26-S28 PolarHBondContact OD1-N 3.18Å; D26-S28 VanDerWaalsContact OD1-N 3.07Å; D26-S28 PolarHBondContact OD1-OG 3.4Å; D26-S28 PolarHBondContact OD2-OG 3.48Å; D26-S29 PolarHBondContact O-OG 3.4Å; D26-S29 VanDerWaalsContact O-OG 3.08Å
27	P	29.7	Very low	26.6	Very low	85 Å²	85	133.6 Å²	133.6	55%	0.552	74%	0.742	S	S	*	*	G	3₁₀ helix	trans	-70.1	-5.7	-174.9	-10.5	27.3	0	0	0	113.6	F25 S29	F25-P27 HydrophobicContact CD1-CG 4.25Å; F25-P27 HydrophobicContact CE1-CB 4.32Å; F25-P27 VanDerWaalsContact O-CD 3.28Å; F25-P27 WeakPolarHBondContact O-CD 3.35Å; P27-S29 PolarHBondContact O-N 2.97Å
28	S	30.5	Very low	26.6	Very low	94 Å²	94	130.3 Å²	130.3	66%	0.657	74%	0.74	S	S	*	*	G	3₁₀ helix	trans	-74.7	-6.7	-179.4	64.6	0	0	0	0	114.4	D26 I30	D26-S28 PolarHBondContact O-N 2.88Å; D26-S28 VanDerWaalsContact O-N 3.12Å; D26-S28 WeakPolarHBondContact OD1-CB 3.39Å; D26-S28 PolarHBondContact OD1-N 3.18Å; D26-S28 VanDerWaalsContact OD1-N 3.07Å; D26-S28 PolarHBondContact OD1-OG 3.4Å; D26-S28 PolarHBondContact OD2-OG 3.48Å; S28-I30 VanDerWaalsContact C-N 3.29Å; S28-I30 PolarHBondContact O-N 3.22Å
29	S	31.5	Very low	26.7	Very low	93 Å²	93	128.1 Å²	128.1	65%	0.65	74%	0.74	S	S	*	*	G	3₁₀ helix	trans	-82.5	3.7	-179.5	54	0	0	0	0	115.1	D26 P27 P31	D26-S29 PolarHBondContact O-OG 3.4Å; D26-S29 VanDerWaalsContact O-OG 3.08Å; P27-S29 PolarHBondContact O-N 2.97Å; S29-P31 WeakPolarHBondContact O-CD 3.21Å
30	I	27.6	Very low	26.5	Very low	75 Å²	75	126.5 Å²	126.5	39%	0.385	74%	0.744	S	S	.	*	S	Bend	trans	-91.7	115	177.9	-55.8	177.5	0	0	0	108.8	S28 K32	S28-I30 VanDerWaalsContact C-N 3.29Å; S28-I30 PolarHBondContact O-N 3.22Å; I30-K32 PolarHBondContact O-N 2.96Å
31	P	25.4	Very low	26.4	Very low	112 Å²	112	125.8 Å²	125.8	73%	0.727	75%	0.745	S	S	*	*			trans	-60.8	125.8	-179.5	-19.5	30.7	0	0	0	110.8	S29 V33	S29-P31 WeakPolarHBondContact O-CD 3.21Å; P31-V33 PolarHBondContact O-N 3.04Å
32	K	24.2	Very low	26.3	Very low	196 Å²	196	128.5 Å²	128.5	85%	0.852	74%	0.744	S	S	*	*			trans	-65.3	120.4	170.1	-75.6	-176.6	-178.8	-179.4	0	108.8	I30 E34	I30-K32 PolarHBondContact O-N 2.96Å; K32-E34 PolarHBondContact O-N 2.86Å
33	V	26.3	Very low	26.1	Very low	140 Å²	140	126.7 Å²	126.7	85%	0.848	74%	0.742	S	S	*	*			trans	-71.6	103.7	169.8	-177.3	0	0	0	0	106.9	P31	P31-V33 PolarHBondContact O-N 3.04Å
34	E	23.9	Very low	25.9	Very low	172 Å²	172	128.7 Å²	128.7	80%	0.804	75%	0.745	S	S	*	*			trans	-72.4	130.2	171.9	-76.4	-172.9	160	0	0	109.9	K32 I36	K32-E34 PolarHBondContact O-N 2.86Å; E34-I36 PolarHBondContact O-N 2.94Å; E34-I36 VanDerWaalsContact O-N 3.09Å
35	E	23.9	Very low	25.8	Very low	177 Å²	177	127.9 Å²	127.9	83%	0.827	74%	0.739	S	S	*	*			trans	-60.1	105.3	-179.2	-72	178.6	150.1	0	0	111.4	N37	E35-N37 PolarHBondContact O-N 2.93Å; E35-N37 VanDerWaalsContact O-N 3.09Å
36	I	24.2	Very low	25.4	Very low	156 Å²	156	125.8 Å²	125.8	80%	0.8	74%	0.743	S	S	*	*			trans	-80.4	90.1	168.5	-56.8	178.2	0	0	0	108	E34 G38	E34-I36 PolarHBondContact O-N 2.94Å; E34-I36 VanDerWaalsContact O-N 3.09Å; I36-G38 PolarHBondContact O-N 3.44Å; I36-G38 VanDerWaalsContact O-N 3.09Å
37	N	23.6	Very low	25.2	Very low	160 Å²	160	124.9 Å²	124.9	86%	0.856	75%	0.75	S	S	*	*			trans	-70.8	91.2	160.3	-88.3	-38.9	0	0	0	108.7	E35	E35-N37 PolarHBondContact O-N 2.93Å; E35-N37 VanDerWaalsContact O-N 3.09Å
38	G	24.6	Very low	24.9	Very low	60 Å²	60	128.2 Å²	128.2	62%	0.619	76%	0.763	S	S	*	*			trans	-150.7	111.2	179.5	0	0	0	0	0	111.3	I36	I36-G38 PolarHBondContact O-N 3.44Å; I36-G38 VanDerWaalsContact O-N 3.09Å
39	G	23.4	Very low	24.5	Very low	79 Å²	79	134.4 Å²	134.4	81%	0.814	77%	0.774	S	S	*	*			trans	-54.5	145.1	-170.6	0	0	0	0	0	115.7	N41	G39-N41 PolarHBondContact O-N 3.42Å
40	I	22.2	Very low	24	Very low	167 Å²	167	138.4 Å²	138.4	86%	0.856	78%	0.782	S	S	*	*			trans	-37.3	116	169.4	-59.8	159.3	0	0	0	111.2
41	N	23.7	Very low	23.9	Very low	159 Å²	159	140.8 Å²	140.8	85%	0.85	80%	0.8	S	S	*	*			trans	-151.4	146.9	148.2	-96.7	-34.7	0	0	0	112.2	G39	G39-N41 PolarHBondContact O-N 3.42Å
42	Q	22.8	Very low	23.6	Very low	187 Å²	187	144.5 Å²	144.5	87%	0.874	81%	0.805	S	S	*	*			trans	-70.5	142.9	-160.6	-64	163.9	-1.3	0	0	114
43	G	22.9	Very low	23.7	Very low	68 Å²	68	141.2 Å²	141.2	70%	0.701	80%	0.801	S	S	*	*			trans	77.1	107.4	148.3	0	0	0	0	0	117.2
44	T	24.3	Very low	23.4	Very low	140 Å²	140	143.2 Å²	143.2	86%	0.859	80%	0.801	S	S	*	*				164.8	132.2	111.5	46.5	0	0	0	0	111.2
45	S	24.8	Very low	23.5	Very low	108 Å²	108	141 Å²	141	76%	0.755	80%	0.802	S	S	*	*			trans	35.5	121.9	154.6	62.7	0	0	0	0	121.2	A47	S45-A47 PolarHBondContact O-N 2.65Å
46	S	23.5	Very low	23.7	Very low	112 Å²	112	138.2 Å²	138.2	78%	0.783	80%	0.801	S	S	*	*			trans	-36.7	118.3	162.6	54.4	0	0	0	0	114.2
47	A	25.5	Very low	23.8	Very low	83 Å²	83	135.7 Å²	135.7	69%	0.686	80%	0.798	S	S	*	*			trans	-113.9	117.2	159.2	0	0	0	0	0	107.7	S45	S45-A47 PolarHBondContact O-N 2.65Å
48	D	24.8	Very low	24.1	Very low	155 Å²	155	135.5 Å²	135.5	83%	0.829	80%	0.797	S	S	*	*			trans	-60.7	131.7	-177.4	-64.1	-55	0	0	0	111.9	E50	D48-E50 PolarHBondContact O-N 2.92Å
49	Y	22.2	Very low	24.3	Very low	223 Å²	223	137.9 Å²	137.9	88%	0.875	80%	0.804	S	S	*	*			trans	-83.2	108.8	176.2	-80.6	-94.9	0	0	0	110.2
50	E	21.2	Very low	24.6	Very low	177 Å²	177	142.4 Å²	142.4	83%	0.827	81%	0.81	S	S	*	*			trans	-94.4	107.7	173.2	-136.1	-178.3	-163	0	0	110	D48 K52	D48-E50 PolarHBondContact O-N 2.92Å; E50-K52 PolarHBondContact O-N 2.96Å
51	V	23.8	Very low	24.9	Very low	126 Å²	126	137.8 Å²	137.8	76%	0.764	80%	0.803	S	S	*	*			trans	-80	109.2	179.5	-179	0	0	0	0	109.8	V53	V51-V53 HydrophobicContact CG1-CG2 3.94Å; V51-V53 PolarHBondContact O-N 3.25Å
52	K	20.6	Very low	25.1	Very low	190 Å²	190	136 Å²	136	83%	0.826	80%	0.803	S	S	*	*			trans	-84.9	104.5	172	-75.2	-177.9	178	175.5	0	110.6	E50	E50-K52 PolarHBondContact O-N 2.96Å
53	V	24.8	Very low	25.3	Very low	126 Å²	126	134 Å²	134	76%	0.764	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-97.6	122	168	-173.5	0	0	0	0	108.6	V51	V51-V53 HydrophobicContact CG1-CG2 3.94Å; V51-V53 PolarHBondContact O-N 3.25Å
54	Q	21.2	Very low	25.5	Very low	183 Å²	183	139.8 Å²	139.8	86%	0.855	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-77.8	138.8	176.5	-77	-172.3	-35.5	0	0	111
55	P	26.1	Very low	25.5	Very low	126 Å²	126	142 Å²	142	82%	0.818	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-81.5	128.8	-173.3	0.9	17.5	0	0	0	111
56	S	27	Very low	26	Very low	117 Å²	117	142.4 Å²	142.4	82%	0.818	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-69	130.4	165.5	51.3	0	0	0	0	109.9	D58	S56-D58 PolarHBondContact O-N 3.27Å
57	S	27.9	Very low	26.3	Very low	104 Å²	104	143.5 Å²	143.5	73%	0.727	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-58.9	121.6	170	50.7	0	0	0	0	110.2
58	D	29.8	Very low	26.6	Very low	156 Å²	156	144.5 Å²	144.5	83%	0.834	79%	0.787	S	S	*	*			trans	-166.8	126.4	135.2	-88.5	-25.7	0	0	0	111.3	S56	S56-D58 PolarHBondContact O-N 3.27Å
59	S	28.7	Very low	27	Very low	109 Å²	109	144.9 Å²	144.9	76%	0.762	78%	0.781	S	S	*	*			trans	6.1	122.7	167.2	57.5	0	0	0	0	122.6
60	D	27.8	Very low	27.5	Very low	175 Å²	175	141.1 Å²	141.1	94%	0.936	77%	0.774	S	S	*	*			trans	34.6	109.4	132.4	-80.4	-18.7	0	0	0	120.2
61	G	29.3	Very low	28.2	Very low	69 Å²	69	139.1 Å²	139.1	71%	0.711	76%	0.759	S	S	*	*			trans	174.5	84.5	164.8	0	0	0	0	0	111.2	L63	G61-L63 PolarHBondContact O-N 2.87Å
62	S	27.6	Very low	29	Very low	122 Å²	122	137.3 Å²	137.3	85%	0.853	76%	0.757	S	S	*	*			trans	-62.7	97	-179.8	56.4	0	0	0	0	112.6
63	L	26.7	Very low	30.3	Very low	146 Å²	146	134.3 Å²	134.3	76%	0.764	75%	0.749	S	S	*	*			trans	-121.6	151.7	154.8	-104.7	86.7	0	0	0	108.3	G61 W65	G61-L63 PolarHBondContact O-N 2.87Å; L63-W65 PolarHBondContact O-N 3.42Å; L63-W65 VanDerWaalsContact O-N 3.13Å
64	E	27.1	Very low	31.8	Very low	189 Å²	189	129.7 Å²	129.7	88%	0.883	72%	0.722	S	S	*	*			trans	-72.7	99.5	-175.2	-68.6	174.1	141.1	0	0	111.7
65	W	25.7	Very low	33.7	Very low	186 Å²	186	131.1 Å²	131.1	71%	0.705	72%	0.719	S	S	*	*			trans	-95.2	25.6	-175.7	-86.1	62.2	0	0	0	114.7	L63	L63-W65 PolarHBondContact O-N 3.42Å; L63-W65 VanDerWaalsContact O-N 3.13Å
66	T	33.8	Very low	35.9	Very low	116 Å²	116	127.7 Å²	127.7	71%	0.712	69%	0.692	S	S	*	*	S	Bend	trans	-83.2	-35	-173.5	49.3	0	0	0	0	114
67	N	30.8	Very low	37.8	Very low	135 Å²	135	126.8 Å²	126.8	72%	0.722	68%	0.677	S	S	*	*	S	Bend	trans	-89.9	-16.8	-175.2	-78.4	-23.4	0	0	0	115.7
68	L	32.5	Very low	40	Very low	105 Å²	105	127.5 Å²	127.5	55%	0.55	67%	0.669	S	S	.	*	G	3₁₀ helix	trans	-76.5	-21.4	178.5	-89	151.4	0	0	0	113.5	M70 W71 A72	L68-M70 VanDerWaalsContact C-N 3.28Å; L68-M70 PolarHBondContact O-N 2.89Å; L68-W71 PolarHBondContact O-N 3.46Å; L68-A72 PolarHBondContact O-N 3.19Å
69	K	31.5	Very low	42.6	Very low	162 Å²	162	120.4 Å²	120.4	70%	0.704	63%	0.632	S	S	*	*	G	3₁₀ helix	trans	-64.1	-29.8	-179.6	-87.5	-173.4	175.4	-179.3	0	113.5	W71	K69-W71 VanDerWaalsContact C-N 3.32Å; K69-W71 PolarHBondContact O-N 3.34Å
70	M	34.5	Very low	45.5	Very low	144 Å²	144	117 Å²	117	71%	0.709	60%	0.602	S	S	*	*	G	3₁₀ helix	trans	-77.8	-19.7	-178.8	-154.6	147.5	76.5	0	0	112.8	L68 T95	L68-M70 VanDerWaalsContact C-N 3.28Å; L68-M70 PolarHBondContact O-N 2.89Å; M70-T95 HydrophobicContact CE-CG2 4.4Å
71	W	35.6	Very low	48.3	Very low	135 Å²	135	110.4 Å²	110.4	51%	0.511	57%	0.567	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93.8	-23.9	179.6	-61.6	-10.1	0	0	0	113.5	L68 K69 I73 C74 P126	L68-W71 PolarHBondContact O-N 3.46Å; K69-W71 VanDerWaalsContact C-N 3.32Å; K69-W71 PolarHBondContact O-N 3.34Å; W71-I73 PolarHBondContact O-N 3.03Å; W71-I73 VanDerWaalsContact O-N 3.17Å; W71-C74 PolarHBondContact O-N 2.93Å; W71-P126 HydrophobicContact CH2-CB 3.85Å; W71-P126 HydrophobicContact CH2-CG 4.13Å; W71-P126 HydrophobicContact CZ3-CB 4.11Å
72	A	39.7	Very low	51.1	Low	89 Å²	89	107.3 Å²	107.3	74%	0.736	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-18.1	-179.4	0	0	0	0	0	114	L68	L68-A72 PolarHBondContact O-N 3.19Å
73	I	48.6	Very low	53.7	Low	126 Å²	126	106.9 Å²	106.9	65%	0.646	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.8	30.6	-179.5	-38.2	176.6	0	0	0	110.8	W71 W75	W71-I73 PolarHBondContact O-N 3.03Å; W71-I73 VanDerWaalsContact O-N 3.17Å; I73-W75 HydrophobicContact CG2-CZ2 4.48Å; I73-W75 PolarHBondContact O-N 3.49Å
74	C	55.3	Low	56.5	Low	30 Å²	30	101 Å²	101	20%	0.203	49%	0.489	C	S	.	.			trans	-87.3	102.7	174.1	-176.7	0	0	0	0	110.3	W71 F76 C89	W71-C74 PolarHBondContact O-N 2.93Å; C74-F76 WeakPolarHBondContact O-CD2 3.46Å; C74-F76 PolarHBondContact O-N 3.04Å; C74-C89 PolarHBondContact SG-SG 3.33Å
75	W	61.1	Low	59.2	Low	212 Å²	212	98.2 Å²	98.2	80%	0.803	48%	0.48	S	S	*	.			trans	-72.4	14.3	177.6	-62.6	-36	0	0	0	114.9	I73 L77	I73-W75 HydrophobicContact CG2-CZ2 4.48Å; I73-W75 PolarHBondContact O-N 3.49Å; W75-L77 PolarHBondContact O-N 3.05Å; W75-L77 VanDerWaalsContact O-N 3.14Å
76	F	72.1	Confident	62.1	Low	54 Å²	54	92.3 Å²	92.3	24%	0.237	46%	0.46	C	S	.	.			trans	52.8	34.3	179.9	-77.4	-85.5	0	0	0	114.3	C74 Q78 P79 S87 K150 V154	C74-F76 WeakPolarHBondContact O-CD2 3.46Å; C74-F76 PolarHBondContact O-N 3.04Å; F76-Q78 PolarHBondContact O-N 3.49Å; F76-P79 HydrophobicContact CB-CB 4.47Å; F76-P79 HydrophobicContact CD1-CB 4.19Å; F76-P79 VanDerWaalsContact O-CD 3.22Å; F76-P79 WeakPolarHBondContact O-CD 3.38Å; F76-S87 WeakPolarHBondContact CE1-O 3.49Å; F76-K150 HydrophobicContact CB-CG 4.41Å; F76-K150 HydrophobicContact CD1-CD 3.78Å; F76-K150 HydrophobicContact CD1-CG 4.29Å; F76-K150 HydrophobicContact CE1-CD 3.98Å; F76-K150 VanDerWaalsContact CE1-CE 3.49Å; F76-K150 HydrophobicContact CG-CD 4.14Å; F76-K150 HydrophobicContact CG-CG 4.31Å; F76-K150 HydrophobicContact CZ-CD 4.5Å; F76-V154 HydrophobicContact CB-CG2 4.07Å
77	L	68.1	Low	64.6	Low	99 Å²	99	87.7 Å²	87.7	52%	0.518	43%	0.432	S	S	.	.	S	Bend	trans	-63.9	117.3	176.8	-166.1	72.7	0	0	0	109.8	W75 C89	W75-L77 PolarHBondContact O-N 3.05Å; W75-L77 VanDerWaalsContact O-N 3.14Å; L77-C89 WeakPolarHBondContact O-CB 3.27Å
78	Q	74.8	Confident	67.3	Low	119 Å²	119	82.6 Å²	82.6	56%	0.556	40%	0.404	S	S	*	.	S	Bend	trans	56.1	70	-172.6	-60.5	176	-25.5	0	0	112.9	F76 E90	F76-Q78 PolarHBondContact O-N 3.49Å; Q78-E90 HydrophobicContact CB-CB 4.21Å; Q78-E90 PolarHBondContact O-N 2.95Å
79	P	84.2	Confident	69.8	Low	7 Å²	7	78 Å²	78	5%	0.045	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	136.1	-177.4	32.8	-31.8	0	0	0	111.1	F76 F88 P146 D147 K150 A151	F76-P79 HydrophobicContact CB-CB 4.47Å; F76-P79 HydrophobicContact CD1-CB 4.19Å; F76-P79 VanDerWaalsContact O-CD 3.22Å; F76-P79 WeakPolarHBondContact O-CD 3.38Å; P79-F88 CarbonylContact C-O 3.58Å; P79-F88 WeakPolarHBondContact CA-O 3.41Å; P79-P146 WeakPolarHBondContact O-CA 3.23Å; P79-D147 HydrophobicContact CB-CB 4.12Å; P79-D147 HydrophobicContact CG-CB 4.21Å; P79-D147 WeakPolarHBondContact CG-O 3.44Å; P79-D147 PolarHBondContact O-N 3.05Å; P79-K150 HydrophobicContact CB-CB 4.39Å; P79-K150 HydrophobicContact CG-CB 4.17Å; P79-A151 HydrophobicContact CG-CB 3.92Å
80	R	88.1	Confident	72.4	Confident	36 Å²	36	72.1 Å²	72.1	14%	0.136	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	145.9	179.3	-53.4	-62.2	179.5	167.3	-0.7	110.3	S87 F88 E90 I93 K142 L144 K145	R80-S87 VanDerWaalsContact O-CA 3.27Å; R80-S87 WeakPolarHBondContact O-CA 3.42Å; R80-F88 PolarHBondContact N-O 3.18Å; R80-F88 PolarHBondContact O-N 3.27Å; R80-E90 HydrophobicContact CG-CB 4.45Å; R80-E90 IonicContact CZ-OE2 3.37Å; R80-E90 IonicContact NE-OE2 3.12Å; R80-E90 PolarHBondContact NE-OE2 2.91Å; R80-E90 VanDerWaalsContact NE-OE2 3.12Å; R80-E90 IonicContact NH2-OE2 2.77Å; R80-E90 PolarHBondContact NH2-OE2 3.41Å; R80-I93 HydrophobicContact CB-CD1 3.63Å; R80-I93 HydrophobicContact CG-CD1 4.17Å; R80-K142 PolarHBondContact NH1-O 3.23Å; R80-K142 PolarHBondContact NH2-O 2.95Å; R80-L144 HydrophobicContact CB-CB 3.92Å; R80-L144 HydrophobicContact CB-CD1 4.32Å; R80-L144 HydrophobicContact CG-CB 4.34Å; R80-L144 PolarHBondContact NH1-O 3.26Å; R80-K145 CarbonylContact C-O 3.59Å
81	L	87.9	Confident	74.7	Confident	37 Å²	37	72.3 Å²	72.3	19%	0.194	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	130.7	174.6	-63.2	170.6	0	0	0	109.8	S87 K145 D147	L81-S87 VanDerWaalsContact CD2-OG 3.32Å; L81-S87 WeakPolarHBondContact CD2-OG 3.43Å; L81-K145 HydrophobicContact CB-CB 4.36Å; L81-K145 WeakPolarHBondContact CB-O 3.21Å; L81-K145 HydrophobicContact CD1-CB 4.27Å; L81-K145 PolarHBondContact N-O 3.2Å; L81-D147 HydrophobicContact CD2-CB 3.94Å; L81-D147 HydrophobicContact CG-CB 4.07Å
82	L	86.7	Confident	77	Confident	4 Å²	4	67 Å²	67	2%	0.021	34%	0.336	C	S	.	.			trans	-76	171	161.2	-62.5	-175	0	0	0	110.3	C84 L85 H86 F88 I93 V123 C125 T132 L144	L82-C84 PolarHBondContact O-N 2.94Å; L82-C84 VanDerWaalsContact O-N 3.13Å; L82-L85 WeakPolarHBondContact O-CA 3.19Å; L82-L85 PolarHBondContact O-N 2.94Å; L82-H86 PolarHBondContact N-O 3.46Å; L82-F88 HydrophobicContact CD1-CD2 3.76Å; L82-F88 HydrophobicContact CD1-CE2 3.64Å; L82-F88 HydrophobicContact CG-CD2 4.01Å; L82-F88 HydrophobicContact CG-CE2 4.28Å; L82-I93 HydrophobicContact CD2-CD1 4.37Å; L82-V123 HydrophobicContact CD1-CG1 4.45Å; L82-C125 HydrophobicContact CD1-CB 3.76Å; L82-T132 HydrophobicContact CB-CG2 4.44Å; L82-T132 WeakPolarHBondContact CB-OG1 3.33Å; L82-T132 HydrophobicContact CD2-CG2 4.03Å; L82-L144 HydrophobicContact CD2-CD1 4.26Å
83	E	83.7	Confident	79.2	Confident	114 Å²	114	62.8 Å²	62.8	53%	0.533	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-24.7	176.7	-75.8	170.3	-145.3	0	0	112.9	L85 T132 N133	E83-L85 PolarHBondContact O-N 3.35Å; E83-T132 HydrophobicContact CB-CG2 4.39Å; E83-T132 WeakPolarHBondContact CB-OG1 3.4Å; E83-T132 HydrophobicContact CG-CG2 3.89Å; E83-T132 PolarHBondContact N-OG1 3.13Å; E83-N133 PolarHBondContact OE1-N 3Å; E83-N133 VanDerWaalsContact OE1-N 3.14Å
84	C	84.1	Confident	80.9	Confident	23 Å²	23	58.3 Å²	58.3	16%	0.155	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	4.8	174.9	71.7	0	0	0	0	114.1	L82 H86 C128 Q130	L82-C84 PolarHBondContact O-N 2.94Å; L82-C84 VanDerWaalsContact O-N 3.13Å; C84-H86 PolarHBondContact O-N 2.96Å; C84-H86 VanDerWaalsContact O-N 3.16Å; C84-H86 VanDerWaalsContact SG-CB 3.58Å; C84-H86 PolarHBondContact SG-ND1 3.34Å; C84-C128 VanDerWaalsContact CB-SG 3.55Å; C84-Q130 HydrophobicContact CB-CB 3.83Å; C84-Q130 VanDerWaalsContact CB-CD 3.46Å; C84-Q130 HydrophobicContact CB-CG 4.03Å
85	L	85.1	Confident	82.2	Confident	130 Å²	130	59.7 Å²	59.7	68%	0.681	29%	0.286	S	S	*	.	S	Bend	trans	63.7	12.1	-176.4	-50.2	177.6	0	0	0	115.4	L82 E83	L82-L85 WeakPolarHBondContact O-CA 3.19Å; L82-L85 PolarHBondContact O-N 2.94Å; E83-L85 PolarHBondContact O-N 3.35Å
86	H	86.6	Confident	83.2	Confident	61 Å²	61	50.9 Å²	50.9	28%	0.282	26%	0.255	S	S	.	.			trans	-79.7	137.5	167.4	-70.1	125.8	0	0	0	110.2	L82 C84 F88 C125 I127	L82-H86 PolarHBondContact N-O 3.46Å; C84-H86 PolarHBondContact O-N 2.96Å; C84-H86 VanDerWaalsContact O-N 3.16Å; C84-H86 VanDerWaalsContact SG-CB 3.58Å; C84-H86 PolarHBondContact SG-ND1 3.34Å; H86-F88 HydrophobicContact CB-CE2 3.74Å; H86-F88 HydrophobicContact CB-CZ 4.33Å; H86-C125 PolarHBondContact ND1-SG 3.01Å; H86-C125 VanDerWaalsContact ND1-SG 3.42Å; H86-I127 HydrophobicContact CB-CD1 4.16Å
87	S	85.9	Confident	83.6	Confident	19 Å²	19	49.7 Å²	49.7	13%	0.133	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	136.3	-174.9	-37.6	0	0	0	0	111.6	F76 R80 L81 D147	F76-S87 WeakPolarHBondContact CE1-O 3.49Å; R80-S87 VanDerWaalsContact O-CA 3.27Å; R80-S87 WeakPolarHBondContact O-CA 3.42Å; L81-S87 VanDerWaalsContact CD2-OG 3.32Å; L81-S87 WeakPolarHBondContact CD2-OG 3.43Å; S87-D147 WeakPolarHBondContact CB-OD2 3.37Å; S87-D147 PolarHBondContact OG-OD2 3.32Å
88	F	87.7	Confident	84	Confident	28 Å²	28	49.6 Å²	49.6	12%	0.123	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	152.9	172.7	-61.1	-88	0	0	0	109.5	P79 R80 L82 H86 I93 M96 P126 I127	P79-F88 CarbonylContact C-O 3.58Å; P79-F88 WeakPolarHBondContact CA-O 3.41Å; R80-F88 PolarHBondContact N-O 3.18Å; R80-F88 PolarHBondContact O-N 3.27Å; L82-F88 HydrophobicContact CD1-CD2 3.76Å; L82-F88 HydrophobicContact CD1-CE2 3.64Å; L82-F88 HydrophobicContact CG-CD2 4.01Å; L82-F88 HydrophobicContact CG-CE2 4.28Å; H86-F88 HydrophobicContact CB-CE2 3.74Å; H86-F88 HydrophobicContact CB-CZ 4.33Å; F88-I93 HydrophobicContact CB-CD1 4.07Å; F88-I93 HydrophobicContact CB-CG1 3.73Å; F88-M96 HydrophobicContact CB-CE 4.02Å; F88-M96 HydrophobicContact CD1-CE 3.78Å; F88-M96 HydrophobicContact CD2-CE 4.47Å; F88-M96 HydrophobicContact CE1-CE 4.4Å; F88-M96 HydrophobicContact CG-CE 3.82Å; F88-P126 HydrophobicContact CE1-CG 4.1Å; F88-P126 HydrophobicContact CZ-CG 4.15Å; F88-I127 HydrophobicContact CE1-CD1 4.36Å; F88-I127 HydrophobicContact CZ-CD1 3.74Å; F88-I127 HydrophobicContact CZ-CG1 4.05Å
89	C	85.5	Confident	83.4	Confident	8 Å²	8	47.7 Å²	47.7	5%	0.054	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	151.9	174.7	87.3	0	0	0	0	110.6	C74 L77 K91 C92 I93	C74-C89 PolarHBondContact SG-SG 3.33Å; L77-C89 WeakPolarHBondContact O-CB 3.27Å; C89-K91 PolarHBondContact O-N 3.41Å; C89-C92 PolarHBondContact O-N 3.04Å; C89-C92 PolarHBondContact SG-N 3.49Å; C89-C92 PolarHBondContact SG-SG 3.12Å; C89-I93 PolarHBondContact O-N 3.38Å; C89-I93 VanDerWaalsContact O-N 3.13Å
90	E	85.1	Confident	82	Confident	39 Å²	39	53.8 Å²	53.8	18%	0.182	27%	0.273	C	S	.	.	H	α-helix	trans	-52.9	-43.3	-179.4	-176.4	158.2	157.2	0	0	112	Q78 R80 C92 I93 V94 V141 K142	Q78-E90 HydrophobicContact CB-CB 4.21Å; Q78-E90 PolarHBondContact O-N 2.95Å; R80-E90 HydrophobicContact CG-CB 4.45Å; R80-E90 IonicContact CZ-OE2 3.37Å; R80-E90 IonicContact NE-OE2 3.12Å; R80-E90 PolarHBondContact NE-OE2 2.91Å; R80-E90 VanDerWaalsContact NE-OE2 3.12Å; R80-E90 IonicContact NH2-OE2 2.77Å; R80-E90 PolarHBondContact NH2-OE2 3.41Å; E90-C92 PolarHBondContact O-N 3.07Å; E90-I93 PolarHBondContact O-N 3.41Å; E90-V94 WeakPolarHBondContact O-CG2 3.33Å; E90-V94 PolarHBondContact O-N 3.39Å; E90-V141 HydrophobicContact CG-CG1 3.86Å; E90-K142 WeakPolarHBondContact OE1-CB 3.39Å
91	K	82.1	Confident	79.9	Confident	149 Å²	149	60.3 Å²	60.3	65%	0.648	31%	0.305	S	S	*	.	H	α-helix	trans	-60.6	-44.4	176.4	-67.7	-176.5	179.2	-179.7	0	112.9	C89 I93 V94 T95	C89-K91 PolarHBondContact O-N 3.41Å; K91-I93 VanDerWaalsContact C-N 3.29Å; K91-I93 PolarHBondContact O-N 2.96Å; K91-V94 PolarHBondContact O-N 3.32Å; K91-T95 PolarHBondContact O-N 3.47Å; K91-T95 PolarHBondContact O-OG1 3.47Å
92	C	84	Confident	77.5	Confident	24 Å²	24	65.5 Å²	65.5	16%	0.162	33%	0.333	C	S	.	.	H	α-helix	trans	-63.5	-37	178.6	-75.7	0	0	0	0	111.6	C89 E90 T95 M96	C89-C92 PolarHBondContact O-N 3.04Å; C89-C92 PolarHBondContact SG-N 3.49Å; C89-C92 PolarHBondContact SG-SG 3.12Å; E90-C92 PolarHBondContact O-N 3.07Å; C92-T95 PolarHBondContact O-N 3.04Å; C92-M96 HydrophobicContact CB-CE 3.99Å; C92-M96 WeakPolarHBondContact O-CB 3.17Å; C92-M96 VanDerWaalsContact O-CE 3.31Å; C92-M96 WeakPolarHBondContact O-CE 3.31Å; C92-M96 VanDerWaalsContact O-CG 3.24Å; C92-M96 WeakPolarHBondContact O-CG 3.27Å; C92-M96 PolarHBondContact O-N 3.12Å
93	I	86.7	Confident	74.9	Confident	0 Å²	0	72.6 Å²	72.6	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-69	-41.5	177.7	-60	169.8	0	0	0	110.6	R80 L82 F88 C89 E90 K91 M96 L97 V123 I134 V141 L144	R80-I93 HydrophobicContact CB-CD1 3.63Å; R80-I93 HydrophobicContact CG-CD1 4.17Å; L82-I93 HydrophobicContact CD2-CD1 4.37Å; F88-I93 HydrophobicContact CB-CD1 4.07Å; F88-I93 HydrophobicContact CB-CG1 3.73Å; C89-I93 PolarHBondContact O-N 3.38Å; C89-I93 VanDerWaalsContact O-N 3.13Å; E90-I93 PolarHBondContact O-N 3.41Å; K91-I93 VanDerWaalsContact C-N 3.29Å; K91-I93 PolarHBondContact O-N 2.96Å; I93-M96 HydrophobicContact CG1-CE 4.19Å; I93-M96 WeakPolarHBondContact O-CB 3.45Å; I93-M96 PolarHBondContact O-N 2.97Å; I93-L97 PolarHBondContact O-N 2.92Å; I93-L97 VanDerWaalsContact O-N 3.09Å; I93-V123 HydrophobicContact CG2-CG2 4.24Å; I93-I134 HydrophobicContact CG2-CD1 3.52Å; I93-V141 HydrophobicContact CB-CG1 3.78Å; I93-V141 HydrophobicContact CD1-CG1 4.25Å; I93-V141 HydrophobicContact CG2-CG1 3.7Å; I93-V141 HydrophobicContact CG2-CG2 4Å; I93-L144 HydrophobicContact CD1-CD1 4.03Å; I93-L144 HydrophobicContact CG2-CD1 4.41Å
94	V	85	Confident	72.5	Confident	31 Å²	31	73.1 Å²	73.1	19%	0.188	38%	0.377	C	S	.	.	H	α-helix	trans	-59.2	-49.2	172.7	171.3	0	0	0	0	110.7	E90 K91 M96 L97 E98 L138 V141	E90-V94 WeakPolarHBondContact O-CG2 3.33Å; E90-V94 PolarHBondContact O-N 3.39Å; K91-V94 PolarHBondContact O-N 3.32Å; V94-M96 VanDerWaalsContact C-N 3.27Å; V94-M96 PolarHBondContact O-N 3.49Å; V94-L97 WeakPolarHBondContact O-CA 3.28Å; V94-L97 WeakPolarHBondContact O-CB 3.44Å; V94-L97 PolarHBondContact O-N 2.92Å; V94-E98 HydrophobicContact CG1-CG 4.2Å; V94-E98 WeakPolarHBondContact CG1-OE1 3.37Å; V94-E98 WeakPolarHBondContact O-CG 3.48Å; V94-E98 PolarHBondContact O-N 3.11Å; V94-L138 HydrophobicContact CG1-CD1 4.49Å; V94-L138 HydrophobicContact CG1-CD2 4.44Å; V94-V141 HydrophobicContact CG2-CB 4.33Å; V94-V141 HydrophobicContact CG2-CG1 4.42Å; V94-V141 HydrophobicContact CG2-CG2 4Å
95	T	81.4	Confident	70.2	Confident	59 Å²	59	78.2 Å²	78.2	36%	0.362	41%	0.411	S	S	.	.	H	α-helix	trans	-61.8	-34	176.7	-52.8	0	0	0	0	112.6	M70 K91 C92 L97 E98 S99	M70-T95 HydrophobicContact CE-CG2 4.4Å; K91-T95 PolarHBondContact O-N 3.47Å; K91-T95 PolarHBondContact O-OG1 3.47Å; C92-T95 PolarHBondContact O-N 3.04Å; T95-L97 VanDerWaalsContact C-N 3.28Å; T95-L97 PolarHBondContact O-N 3.33Å; T95-E98 PolarHBondContact O-N 3.26Å; T95-S99 WeakPolarHBondContact O-CB 3.48Å; T95-S99 PolarHBondContact O-N 3.03Å; T95-S99 PolarHBondContact O-OG 3.49Å
96	M	82.3	Confident	67.9	Low	28 Å²	28	76 Å²	76	14%	0.138	41%	0.406	C	S	.	.	H	α-helix	trans	-65.4	-30	173.7	-78.4	-177.8	-104.4	0	0	112.9	F88 C92 I93 V94 V123 P126	F88-M96 HydrophobicContact CB-CE 4.02Å; F88-M96 HydrophobicContact CD1-CE 3.78Å; F88-M96 HydrophobicContact CD2-CE 4.47Å; F88-M96 HydrophobicContact CE1-CE 4.4Å; F88-M96 HydrophobicContact CG-CE 3.82Å; C92-M96 HydrophobicContact CB-CE 3.99Å; C92-M96 WeakPolarHBondContact O-CB 3.17Å; C92-M96 VanDerWaalsContact O-CE 3.31Å; C92-M96 WeakPolarHBondContact O-CE 3.31Å; C92-M96 VanDerWaalsContact O-CG 3.24Å; C92-M96 WeakPolarHBondContact O-CG 3.27Å; C92-M96 PolarHBondContact O-N 3.12Å; I93-M96 HydrophobicContact CG1-CE 4.19Å; I93-M96 WeakPolarHBondContact O-CB 3.45Å; I93-M96 PolarHBondContact O-N 2.97Å; V94-M96 VanDerWaalsContact C-N 3.27Å; V94-M96 PolarHBondContact O-N 3.49Å; M96-V123 HydrophobicContact CB-CG1 4.22Å; M96-V123 HydrophobicContact SD-CG1 3.97Å; M96-P126 HydrophobicContact CE-CG 4.5Å; M96-P126 HydrophobicContact SD-CG 3.69Å
97	L	79.9	Confident	65.2	Low	29 Å²	29	77.6 Å²	77.6	15%	0.152	44%	0.439	C	S	.	.	H	α-helix	trans	-78.4	-42.5	173.2	-73	166.8	0	0	0	111.6	I93 V94 T95 V123 I134 L138 V141	I93-L97 PolarHBondContact O-N 2.92Å; I93-L97 VanDerWaalsContact O-N 3.09Å; V94-L97 WeakPolarHBondContact O-CA 3.28Å; V94-L97 WeakPolarHBondContact O-CB 3.44Å; V94-L97 PolarHBondContact O-N 2.92Å; T95-L97 VanDerWaalsContact C-N 3.28Å; T95-L97 PolarHBondContact O-N 3.33Å; L97-V123 HydrophobicContact CD1-CG2 4.25Å; L97-V123 HydrophobicContact CD2-CG2 3.45Å; L97-V123 VanDerWaalsContact CD2-CG2 3.45Å; L97-V123 HydrophobicContact CG-CG2 3.54Å; L97-I134 HydrophobicContact CD1-CD1 4.21Å; L97-L138 HydrophobicContact CB-CD2 3.68Å; L97-L138 HydrophobicContact CD1-CD2 3.78Å; L97-L138 HydrophobicContact CG-CD2 4.37Å; L97-V141 HydrophobicContact CD1-CG2 3.76Å
98	E	76.7	Confident	62.6	Low	96 Å²	96	80.9 Å²	80.9	45%	0.449	47%	0.467	S	S	.	.	H	α-helix	trans	-72.1	-38.1	-176.6	-70.3	173	160.9	0	0	113.6	V94 T95 K100 E101 L138	V94-E98 HydrophobicContact CG1-CG 4.2Å; V94-E98 WeakPolarHBondContact CG1-OE1 3.37Å; V94-E98 WeakPolarHBondContact O-CG 3.48Å; V94-E98 PolarHBondContact O-N 3.11Å; T95-E98 PolarHBondContact O-N 3.26Å; E98-K100 PolarHBondContact O-N 3.36Å; E98-E101 PolarHBondContact O-N 3.32Å; E98-E101 VanDerWaalsContact O-N 3.16Å; E98-L138 HydrophobicContact CG-CD1 4.17Å; E98-L138 HydrophobicContact CG-CD2 4.45Å
99	S	61.8	Low	59.8	Low	80 Å²	80	87.6 Å²	87.6	56%	0.559	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	5.6	-173.8	54.8	0	0	0	0	115.9	T95	T95-S99 WeakPolarHBondContact O-CB 3.48Å; T95-S99 PolarHBondContact O-N 3.03Å; T95-S99 PolarHBondContact O-OG 3.49Å
100	K	56.8	Low	57.2	Low	135 Å²	135	96.6 Å²	96.6	59%	0.587	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.4	-5.3	178.9	-62.8	-160.2	-179.8	-165.9	0	115.2	E98 T118	E98-K100 PolarHBondContact O-N 3.36Å; K100-T118 PolarHBondContact NZ-OG1 2.87Å
101	E	44	Very low	54.5	Low	172 Å²	172	101.7 Å²	101.7	80%	0.804	57%	0.573	S	S	*	*	S	Bend	trans	-86.4	-22.8	-179.7	-71.1	-167.5	157.5	0	0	114.3	E98	E98-E101 PolarHBondContact O-N 3.32Å; E98-E101 VanDerWaalsContact O-N 3.16Å
102	D	35.7	Very low	52	Low	146 Å²	146	103 Å²	103	78%	0.781	58%	0.579	S	S	*	*	S	Bend	trans	-112.2	11.1	-162.8	-81.4	-28.4	0	0	0	118.5
103	N	32.4	Very low	49.6	Very low	154 Å²	154	110.3 Å²	110.3	82%	0.824	61%	0.611	S	S	*	*			trans	-118.8	79.9	176.5	-76.7	-31.2	0	0	0	112.5
104	D	33	Very low	47	Very low	124 Å²	124	118.2 Å²	118.2	66%	0.663	65%	0.653	S	S	*	*			trans	-170.5	93.7	134.5	-155.2	-10.9	0	0	0	113.4	S106	D104-S106 PolarHBondContact OD1-N 2.96Å; D104-S106 PolarHBondContact OD1-OG 3.31Å
105	P	36.8	Very low	44.7	Very low	131 Å²	131	125.2 Å²	125.2	85%	0.851	68%	0.684	S	S	*	*			trans	-99.7	62.7	159.5	36.3	-28	0	0	0	110
106	S	36.3	Very low	42.8	Very low	84 Å²	84	126.6 Å²	126.6	59%	0.587	70%	0.695	S	S	*	*			trans	-148.5	100	163.4	53.5	0	0	0	0	112	D104 A108	D104-S106 PolarHBondContact OD1-N 2.96Å; D104-S106 PolarHBondContact OD1-OG 3.31Å; S106-A108 PolarHBondContact O-N 3.49Å
107	G	29.8	Very low	41.3	Very low	94 Å²	94	135 Å²	135	97%	0.969	73%	0.731	S	S	*	*			trans	-62.8	106.6	164	0	0	0	0	0	109.7
108	A	31.8	Very low	40.1	Very low	87 Å²	87	134.8 Å²	134.8	72%	0.719	73%	0.731	S	S	*	*			trans	-143.9	121.1	158.8	0	0	0	0	0	107.8	S106 E110	S106-A108 PolarHBondContact O-N 3.49Å; A108-E110 PolarHBondContact O-N 3.46Å
109	L	29.4	Very low	39.3	Very low	170 Å²	170	134 Å²	134	89%	0.89	73%	0.734	S	S	*	*			trans	-46	130.8	164.7	-85.2	74.2	0	0	0	108.9
110	E	29.9	Very low	39.6	Very low	196 Å²	196	135.1 Å²	135.1	92%	0.916	74%	0.74	S	S	*	*			trans	-165.7	140.5	133.5	-105.3	164.3	-154.6	0	0	111.3	A108	A108-E110 PolarHBondContact O-N 3.46Å
111	D	28.3	Very low	40.4	Very low	146 Å²	146	129.2 Å²	129.2	78%	0.781	72%	0.717	S	S	*	*			trans	-70	168.3	-170.1	-70.6	-56.2	0	0	0	114.3
112	F	30	Very low	42	Very low	178 Å²	178	122.2 Å²	122.2	78%	0.781	69%	0.686	S	S	*	*	S	Bend	trans	84.2	99	163.3	-73.3	-89.8	0	0	0	119
113	Q	34	Very low	44.2	Very low	176 Å²	176	115.5 Å²	115.5	82%	0.822	65%	0.65	S	S	*	*			trans	50.6	67.3	137.3	-61.4	-176.7	-9.6	0	0	117.3
114	N	32.7	Very low	46.6	Very low	166 Å²	166	112.4 Å²	112.4	89%	0.888	63%	0.629	S	S	*	*			trans	-102.8	96.3	158.3	-101.9	-24.8	0	0	0	110.4
115	E	35.3	Very low	49	Very low	179 Å²	179	106.5 Å²	106.5	84%	0.836	60%	0.598	S	S	*	*			trans	-56.4	145.6	164	-73.3	-179.2	145.4	0	0	111
116	S	41.9	Very low	51.2	Low	87 Å²	87	102.9 Å²	102.9	61%	0.608	58%	0.575	S	S	*	*			trans	90.9	37	159.4	89	0	0	0	0	119.6	T118	S116-T118 PolarHBondContact O-N 3.4Å; S116-T118 VanDerWaalsContact O-N 3.08Å
117	K	51.1	Low	53.3	Low	205 Å²	205	104.1 Å²	104.1	89%	0.891	57%	0.573	S	S	*	*	P	Polyproline II helix	trans	-58	118.5	147.9	-75.8	-170.1	178.6	-174.7	0	107.8
118	T	53.9	Low	56	Low	25 Å²	25	102.4 Å²	102.4	15%	0.153	55%	0.546	C	S	.	.	P	Polyproline II helix	trans	-68.3	131.2	-177.8	-28.4	0	0	0	0	107.4	K100 S116 V122 K124	K100-T118 PolarHBondContact NZ-OG1 2.87Å; S116-T118 PolarHBondContact O-N 3.4Å; S116-T118 VanDerWaalsContact O-N 3.08Å; T118-V122 HydrophobicContact CG2-CB 4.3Å; T118-V122 HydrophobicContact CG2-CG1 4.14Å; T118-K124 HydrophobicContact CG2-CD 3.96Å; T118-K124 HydrophobicContact CG2-CG 3.79Å
119	P	59.8	Low	58.5	Low	79 Å²	79	102.3 Å²	102.3	51%	0.513	54%	0.54	S	S	.	.	P	Polyproline II helix	trans	-57	149	-177.8	-22.6	31.3	0	0	0	111.7	G121 V122	P119-G121 PolarHBondContact O-N 2.9Å; P119-V122 HydrophobicContact CB-CB 4.47Å; P119-V122 HydrophobicContact CB-CG2 3.95Å; P119-V122 HydrophobicContact CG-CG2 4.33Å; P119-V122 WeakPolarHBondContact O-CB 3.37Å; P119-V122 PolarHBondContact O-N 2.94Å; P119-V122 VanDerWaalsContact O-N 3.11Å
120	P	67.7	Low	61.2	Low	104 Å²	104	98.6 Å²	98.6	68%	0.675	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.2	138.6	172.4	-24.1	33	0	0	0	111.1	V122 N136	P120-V122 VanDerWaalsContact C-N 3.28Å; P120-V122 PolarHBondContact O-N 3.45Å; P120-N136 PolarHBondContact O-OD1 3.44Å
121	G	73.9	Confident	63.8	Low	10 Å²	10	91.4 Å²	91.4	10%	0.103	49%	0.492	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.2	3.9	-178.3	0	0	0	0	0	115.9	P119 I134 G135	P119-G121 PolarHBondContact O-N 2.9Å; G121-I134 PolarHBondContact O-N 2.74Å; G121-G135 WeakPolarHBondContact CA-O 3.49Å; G121-G135 PolarHBondContact O-N 3.49Å
122	V	77.9	Confident	66.5	Low	26 Å²	26	84.5 Å²	84.5	16%	0.158	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	121.1	179.4	-178	0	0	0	0	111.3	T118 P119 P120 A131 T132 N133	T118-V122 HydrophobicContact CG2-CB 4.3Å; T118-V122 HydrophobicContact CG2-CG1 4.14Å; P119-V122 HydrophobicContact CB-CB 4.47Å; P119-V122 HydrophobicContact CB-CG2 3.95Å; P119-V122 HydrophobicContact CG-CG2 4.33Å; P119-V122 WeakPolarHBondContact O-CB 3.37Å; P119-V122 PolarHBondContact O-N 2.94Å; P119-V122 VanDerWaalsContact O-N 3.11Å; P120-V122 VanDerWaalsContact C-N 3.28Å; P120-V122 PolarHBondContact O-N 3.45Å; V122-A131 HydrophobicContact CG1-CB 3.72Å; V122-T132 WeakPolarHBondContact CA-O 3.35Å; V122-N133 HydrophobicContact CG2-CB 4.4Å
123	V	83	Confident	69	Low	4 Å²	4	81 Å²	81	2%	0.024	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	130	173.7	175.3	0	0	0	0	109.6	L82 I93 M96 L97 A131 T132 I134	L82-V123 HydrophobicContact CD1-CG1 4.45Å; I93-V123 HydrophobicContact CG2-CG2 4.24Å; M96-V123 HydrophobicContact CB-CG1 4.22Å; M96-V123 HydrophobicContact SD-CG1 3.97Å; L97-V123 HydrophobicContact CD1-CG2 4.25Å; L97-V123 HydrophobicContact CD2-CG2 3.45Å; L97-V123 VanDerWaalsContact CD2-CG2 3.45Å; L97-V123 HydrophobicContact CG-CG2 3.54Å; V123-A131 CarbonylContact O-C 3.47Å; V123-A131 WeakPolarHBondContact O-CA 3.3Å; V123-T132 PolarHBondContact N-O 3.16Å; V123-T132 PolarHBondContact O-N 3.07Å; V123-I134 HydrophobicContact CB-CD1 4.11Å; V123-I134 HydrophobicContact CG2-CD1 3.52Å; V123-I134 HydrophobicContact CG2-CG1 4.49Å
124	K	81.4	Confident	71.1	Confident	89 Å²	89	73 Å²	73	39%	0.387	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	124.3	167.1	-81.4	179.1	174.3	-176.3	0	109.1	T118 P126	T118-K124 HydrophobicContact CG2-CD 3.96Å; T118-K124 HydrophobicContact CG2-CG 3.79Å; K124-P126 WeakPolarHBondContact O-CD 3.4Å
125	C	83.9	Confident	73.1	Confident	1 Å²	1	65.8 Å²	65.8	1%	0.007	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-58.6	124	177.7	179	0	0	0	0	110.8	L82 H86 I127 C128 S129 Q130	L82-C125 HydrophobicContact CD1-CB 3.76Å; H86-C125 PolarHBondContact ND1-SG 3.01Å; H86-C125 VanDerWaalsContact ND1-SG 3.42Å; C125-I127 PolarHBondContact O-N 3.1Å; C125-I127 VanDerWaalsContact O-N 3.12Å; C125-I127 PolarHBondContact SG-N 3.24Å; C125-C128 VanDerWaalsContact SG-SG 3.67Å; C125-S129 WeakPolarHBondContact O-CA 3.45Å; C125-S129 PolarHBondContact O-N 3.41Å; C125-Q130 WeakPolarHBondContact CB-O 3.28Å; C125-Q130 PolarHBondContact N-O 3.43Å
126	P	82.9	Confident	74.9	Confident	55 Å²	55	63.8 Å²	63.8	36%	0.357	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-22.2	178.3	-25	32.6	0	0	0	114.7	W71 F88 M96 K124	W71-P126 HydrophobicContact CH2-CB 3.85Å; W71-P126 HydrophobicContact CH2-CG 4.13Å; W71-P126 HydrophobicContact CZ3-CB 4.11Å; F88-P126 HydrophobicContact CE1-CG 4.1Å; F88-P126 HydrophobicContact CZ-CG 4.15Å; M96-P126 HydrophobicContact CE-CG 4.5Å; M96-P126 HydrophobicContact SD-CG 3.69Å; K124-P126 WeakPolarHBondContact O-CD 3.4Å
127	I	81.5	Confident	76.4	Confident	110 Å²	110	62 Å²	62	56%	0.564	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-50.6	-174.1	-59.2	168	0	0	0	110.9	H86 F88 C125	H86-I127 HydrophobicContact CB-CD1 4.16Å; F88-I127 HydrophobicContact CE1-CD1 4.36Å; F88-I127 HydrophobicContact CZ-CD1 3.74Å; F88-I127 HydrophobicContact CZ-CG1 4.05Å; C125-I127 PolarHBondContact O-N 3.1Å; C125-I127 VanDerWaalsContact O-N 3.12Å; C125-I127 PolarHBondContact SG-N 3.24Å
128	C	85.1	Confident	77.6	Confident	57 Å²	57	55.7 Å²	55.7	39%	0.385	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.6	0.6	-174.8	65.6	0	0	0	0	114.4	C84 C125 Q130	C84-C128 VanDerWaalsContact CB-SG 3.55Å; C125-C128 VanDerWaalsContact SG-SG 3.67Å; C128-Q130 PolarHBondContact O-N 3.32Å; C128-Q130 VanDerWaalsContact SG-CB 3.59Å
129	S	85.2	Confident	78.6	Confident	86 Å²	86	62.8 Å²	62.8	60%	0.601	35%	0.35	S	S	*	.			trans	61.2	3.1	-176	-59.6	0	0	0	0	116.3	C125 A131	C125-S129 WeakPolarHBondContact O-CA 3.45Å; C125-S129 PolarHBondContact O-N 3.41Å; S129-A131 PolarHBondContact O-N 2.61Å
130	Q	85.6	Confident	79.3	Confident	91 Å²	91	65.7 Å²	65.7	43%	0.425	35%	0.351	S	S	.	.			trans	-61.6	133	174.4	-177.9	172.1	-15.3	0	0	110.3	C84 C125 C128	C84-Q130 HydrophobicContact CB-CB 3.83Å; C84-Q130 VanDerWaalsContact CB-CD 3.46Å; C84-Q130 HydrophobicContact CB-CG 4.03Å; C125-Q130 WeakPolarHBondContact CB-O 3.28Å; C125-Q130 PolarHBondContact N-O 3.43Å; C128-Q130 PolarHBondContact O-N 3.32Å; C128-Q130 VanDerWaalsContact SG-CB 3.59Å
131	A	84.8	Confident	80	Confident	45 Å²	45	60.8 Å²	60.8	37%	0.372	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	148.4	176.1	0	0	0	0	0	111	V122 V123 S129	V122-A131 HydrophobicContact CG1-CB 3.72Å; V123-A131 CarbonylContact O-C 3.47Å; V123-A131 WeakPolarHBondContact O-CA 3.3Å; S129-A131 PolarHBondContact O-N 2.61Å
132	T	84.3	Confident	80.2	Confident	1 Å²	1	64.5 Å²	64.5	1%	0.006	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	125	171.1	-66.7	0	0	0	0	108	L82 E83 V122 V123 I134 L144	L82-T132 HydrophobicContact CB-CG2 4.44Å; L82-T132 WeakPolarHBondContact CB-OG1 3.33Å; L82-T132 HydrophobicContact CD2-CG2 4.03Å; E83-T132 HydrophobicContact CB-CG2 4.39Å; E83-T132 WeakPolarHBondContact CB-OG1 3.4Å; E83-T132 HydrophobicContact CG-CG2 3.89Å; E83-T132 PolarHBondContact N-OG1 3.13Å; V122-T132 WeakPolarHBondContact CA-O 3.35Å; V123-T132 PolarHBondContact N-O 3.16Å; V123-T132 PolarHBondContact O-N 3.07Å; T132-I134 HydrophobicContact CG2-CG1 4.19Å; T132-L144 HydrophobicContact CG2-CD2 4.2Å
133	N	84	Confident	80.3	Confident	105 Å²	105	70.1 Å²	70.1	56%	0.561	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.4	115.5	-178.9	-171.5	-5.6	0	0	0	110	E83 V122 G135	E83-N133 PolarHBondContact OE1-N 3Å; E83-N133 VanDerWaalsContact OE1-N 3.14Å; V122-N133 HydrophobicContact CG2-CB 4.4Å; N133-G135 PolarHBondContact OD1-N 3.33Å
134	I	77.9	Confident	80.1	Confident	9 Å²	9	71.2 Å²	71.2	5%	0.046	36%	0.358	C	S	.	.			trans	-103.3	-23.6	-177.8	-53.6	178.2	0	0	0	110.6	I93 L97 G121 V123 T132 W140 V141 L144	I93-I134 HydrophobicContact CG2-CD1 3.52Å; L97-I134 HydrophobicContact CD1-CD1 4.21Å; G121-I134 PolarHBondContact O-N 2.74Å; V123-I134 HydrophobicContact CB-CD1 4.11Å; V123-I134 HydrophobicContact CG2-CD1 3.52Å; V123-I134 HydrophobicContact CG2-CG1 4.49Å; T132-I134 HydrophobicContact CG2-CG1 4.19Å; I134-W140 HydrophobicContact CG2-CB 3.91Å; I134-W140 WeakPolarHBondContact O-CB 3.47Å; I134-V141 HydrophobicContact CD1-CG2 4.47Å; I134-V141 HydrophobicContact CG2-CG2 3.97Å; I134-L144 HydrophobicContact CD1-CD1 3.84Å; I134-L144 HydrophobicContact CG1-CD1 4.17Å; I134-L144 HydrophobicContact CG1-CD2 4.39Å
135	G	74.8	Confident	79.9	Confident	14 Å²	14	74.3 Å²	74.3	14%	0.144	37%	0.371	C	S	.	.			trans	95.4	166.3	-172.5	0	0	0	0	0	113	G121 N133 D137	G121-G135 WeakPolarHBondContact CA-O 3.49Å; G121-G135 PolarHBondContact O-N 3.49Å; N133-G135 PolarHBondContact OD1-N 3.33Å; G135-D137 PolarHBondContact O-N 3.38Å
136	N	71.4	Confident	79.7	Confident	137 Å²	137	75.9 Å²	75.9	73%	0.733	38%	0.381	S	S	*	.	S	Bend	trans	-78.4	2.4	-168.7	-65.8	-10.1	0	0	0	114.9	P120	P120-N136 PolarHBondContact O-OD1 3.44Å
137	D	73.8	Confident	79.6	Confident	48 Å²	48	74.2 Å²	74.2	26%	0.257	37%	0.37	S	S	.	.	S	Bend	trans	-119.7	120.9	-178.2	178.6	-15.7	0	0	0	109.2	G135 R139 W140	G135-D137 PolarHBondContact O-N 3.38Å; D137-R139 PolarHBondContact O-N 3.11Å; D137-R139 VanDerWaalsContact OD1-CB 3.22Å; D137-R139 WeakPolarHBondContact OD1-CB 3.3Å; D137-R139 VanDerWaalsContact OD1-CG 3.31Å; D137-R139 WeakPolarHBondContact OD1-CG 3.32Å; D137-R139 PolarHBondContact OD1-N 2.9Å; D137-R139 IonicContact OD1-NE 3.02Å; D137-R139 PolarHBondContact OD1-NE 3.06Å; D137-R139 VanDerWaalsContact OD1-NE 3.09Å; D137-R139 IonicContact OD2-CZ 2.64Å; D137-R139 IonicContact OD2-NE 2.82Å; D137-R139 PolarHBondContact OD2-NE 3.01Å; D137-R139 IonicContact OD2-NH2 3.14Å; D137-R139 PolarHBondContact OD2-NH2 3.37Å; D137-W140 VanDerWaalsContact O-CB 3.27Å; D137-W140 WeakPolarHBondContact O-CB 3.39Å; D137-W140 PolarHBondContact O-N 2.98Å
138	L	76.1	Confident	79.4	Confident	74 Å²	74	72.9 Å²	72.9	39%	0.387	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-55.3	-24.2	-177.9	-61	171.6	0	0	0	112.6	V94 L97 E98 W140 V141	V94-L138 HydrophobicContact CG1-CD1 4.49Å; V94-L138 HydrophobicContact CG1-CD2 4.44Å; L97-L138 HydrophobicContact CB-CD2 3.68Å; L97-L138 HydrophobicContact CD1-CD2 3.78Å; L97-L138 HydrophobicContact CG-CD2 4.37Å; E98-L138 HydrophobicContact CG-CD1 4.17Å; E98-L138 HydrophobicContact CG-CD2 4.45Å; L138-W140 PolarHBondContact O-N 3.2Å; L138-V141 WeakPolarHBondContact O-CG2 3.38Å; L138-V141 PolarHBondContact O-N 3.19Å
139	R	75.1	Confident	78.8	Confident	173 Å²	173	76.4 Å²	76.4	65%	0.653	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-62.4	-13	174.2	-66	179.1	-73.9	-175	-3.9	113.2	D137 K142	D137-R139 PolarHBondContact O-N 3.11Å; D137-R139 VanDerWaalsContact OD1-CB 3.22Å; D137-R139 WeakPolarHBondContact OD1-CB 3.3Å; D137-R139 VanDerWaalsContact OD1-CG 3.31Å; D137-R139 WeakPolarHBondContact OD1-CG 3.32Å; D137-R139 PolarHBondContact OD1-N 2.9Å; D137-R139 IonicContact OD1-NE 3.02Å; D137-R139 PolarHBondContact OD1-NE 3.06Å; D137-R139 VanDerWaalsContact OD1-NE 3.09Å; D137-R139 IonicContact OD2-CZ 2.64Å; D137-R139 IonicContact OD2-NE 2.82Å; D137-R139 PolarHBondContact OD2-NE 3.01Å; D137-R139 IonicContact OD2-NH2 3.14Å; D137-R139 PolarHBondContact OD2-NH2 3.37Å; R139-K142 WeakPolarHBondContact O-CD 3.41Å; R139-K142 WeakPolarHBondContact O-CE 3.32Å; R139-K142 VanDerWaalsContact O-CG 3.28Å; R139-K142 WeakPolarHBondContact O-CG 3.34Å
140	W	76.1	Confident	78.4	Confident	141 Å²	141	75.5 Å²	75.5	53%	0.534	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-81.2	-20.1	-178.6	-69	47.4	0	0	0	113.1	I134 D137 L138 K142 Y143	I134-W140 HydrophobicContact CG2-CB 3.91Å; I134-W140 WeakPolarHBondContact O-CB 3.47Å; D137-W140 VanDerWaalsContact O-CB 3.27Å; D137-W140 WeakPolarHBondContact O-CB 3.39Å; D137-W140 PolarHBondContact O-N 2.98Å; L138-W140 PolarHBondContact O-N 3.2Å; W140-K142 PolarHBondContact O-N 3.28Å; W140-Y143 WeakPolarHBondContact O-CB 3.39Å; W140-Y143 PolarHBondContact O-N 3.4Å
141	V	81.2	Confident	77.8	Confident	0 Å²	0	71.9 Å²	71.9	0%	0	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-55.4	-37.7	177.5	-179.9	0	0	0	0	111.4	E90 I93 V94 L97 I134 L138 Y143 L144	E90-V141 HydrophobicContact CG-CG1 3.86Å; I93-V141 HydrophobicContact CB-CG1 3.78Å; I93-V141 HydrophobicContact CD1-CG1 4.25Å; I93-V141 HydrophobicContact CG2-CG1 3.7Å; I93-V141 HydrophobicContact CG2-CG2 4Å; V94-V141 HydrophobicContact CG2-CB 4.33Å; V94-V141 HydrophobicContact CG2-CG1 4.42Å; V94-V141 HydrophobicContact CG2-CG2 4Å; L97-V141 HydrophobicContact CD1-CG2 3.76Å; I134-V141 HydrophobicContact CD1-CG2 4.47Å; I134-V141 HydrophobicContact CG2-CG2 3.97Å; L138-V141 WeakPolarHBondContact O-CG2 3.38Å; L138-V141 PolarHBondContact O-N 3.19Å; V141-Y143 PolarHBondContact O-N 2.96Å; V141-Y143 VanDerWaalsContact O-N 3.15Å; V141-L144 HydrophobicContact CG1-CD1 4.44Å; V141-L144 WeakPolarHBondContact O-CB 2.98Å; V141-L144 PolarHBondContact O-N 3.17Å; V141-L144 VanDerWaalsContact O-N 3.11Å
142	K	79	Confident	77.2	Confident	89 Å²	89	70.7 Å²	70.7	39%	0.387	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-64.7	-17.4	179.1	81.5	-167.6	177	171.5	0	114.4	R80 E90 R139 W140	R80-K142 PolarHBondContact NH1-O 3.23Å; R80-K142 PolarHBondContact NH2-O 2.95Å; E90-K142 WeakPolarHBondContact OE1-CB 3.39Å; R139-K142 WeakPolarHBondContact O-CD 3.41Å; R139-K142 WeakPolarHBondContact O-CE 3.32Å; R139-K142 VanDerWaalsContact O-CG 3.28Å; R139-K142 WeakPolarHBondContact O-CG 3.34Å; W140-K142 PolarHBondContact O-N 3.28Å
143	Y	78.4	Confident	76.6	Confident	143 Å²	143	78.9 Å²	78.9	56%	0.561	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-90.9	-8.7	178.3	-61	-65.2	0	0	0	113	W140 V141	W140-Y143 WeakPolarHBondContact O-CB 3.39Å; W140-Y143 PolarHBondContact O-N 3.4Å; V141-Y143 PolarHBondContact O-N 2.96Å; V141-Y143 VanDerWaalsContact O-N 3.15Å
144	L	80	Confident	75.9	Confident	27 Å²	27	75.4 Å²	75.4	14%	0.141	35%	0.345	C	S	.	.	S	Bend	trans	-58.6	145.2	167.6	-70.7	175.8	0	0	0	110.2	R80 L82 I93 T132 I134 V141 P146	R80-L144 HydrophobicContact CB-CB 3.92Å; R80-L144 HydrophobicContact CB-CD1 4.32Å; R80-L144 HydrophobicContact CG-CB 4.34Å; R80-L144 PolarHBondContact NH1-O 3.26Å; L82-L144 HydrophobicContact CD2-CD1 4.26Å; I93-L144 HydrophobicContact CD1-CD1 4.03Å; I93-L144 HydrophobicContact CG2-CD1 4.41Å; T132-L144 HydrophobicContact CG2-CD2 4.2Å; I134-L144 HydrophobicContact CD1-CD1 3.84Å; I134-L144 HydrophobicContact CG1-CD1 4.17Å; I134-L144 HydrophobicContact CG1-CD2 4.39Å; V141-L144 HydrophobicContact CG1-CD1 4.44Å; V141-L144 WeakPolarHBondContact O-CB 2.98Å; V141-L144 PolarHBondContact O-N 3.17Å; V141-L144 VanDerWaalsContact O-N 3.11Å; L144-P146 WeakPolarHBondContact O-CD 3.48Å; L144-P146 VanDerWaalsContact O-N 3.16Å
145	K	77.8	Confident	75.6	Confident	154 Å²	154	75.1 Å²	75.1	67%	0.67	34%	0.343	S	S	*	.	P	Polyproline II helix	trans	-56.6	121.5	-179.3	-70.7	-174.9	179.2	-177.5	0	109	R80 L81	R80-K145 CarbonylContact C-O 3.59Å; L81-K145 HydrophobicContact CB-CB 4.36Å; L81-K145 WeakPolarHBondContact CB-O 3.21Å; L81-K145 HydrophobicContact CD1-CB 4.27Å; L81-K145 PolarHBondContact N-O 3.2Å
146	P	79.4	Confident	75.4	Confident	34 Å²	34	75.5 Å²	75.5	22%	0.221	35%	0.346	C	S	.	.	B	Isolated β-bridge	trans	-68.4	146.7	177	30	-36.3	0	0	0	110.7	P79 L144 F148	P79-P146 WeakPolarHBondContact O-CA 3.23Å; L144-P146 WeakPolarHBondContact O-CD 3.48Å; L144-P146 VanDerWaalsContact O-N 3.16Å; P146-F148 HydrophobicContact CB-CE1 4.21Å; P146-F148 HydrophobicContact CB-CZ 4.33Å; P146-F148 HydrophobicContact CG-CD1 4.22Å; P146-F148 HydrophobicContact CG-CD2 4.42Å; P146-F148 HydrophobicContact CG-CE1 3.49Å; P146-F148 VanDerWaalsContact CG-CE1 3.49Å; P146-F148 HydrophobicContact CG-CE2 3.75Å; P146-F148 HydrophobicContact CG-CZ 3.23Å; P146-F148 PolarHBondContact O-N 2.76Å
147	D	80.7	Confident	75.3	Confident	21 Å²	21	71.1 Å²	71.1	11%	0.112	33%	0.328	C	S	.	.			trans	-87.5	89.9	169.9	-178	-13	0	0	0	109.2	P79 L81 S87 I149 K150 A151	P79-D147 HydrophobicContact CB-CB 4.12Å; P79-D147 HydrophobicContact CG-CB 4.21Å; P79-D147 WeakPolarHBondContact CG-O 3.44Å; P79-D147 PolarHBondContact O-N 3.05Å; L81-D147 HydrophobicContact CD2-CB 3.94Å; L81-D147 HydrophobicContact CG-CB 4.07Å; S87-D147 WeakPolarHBondContact CB-OD2 3.37Å; S87-D147 PolarHBondContact OG-OD2 3.32Å; D147-I149 PolarHBondContact O-N 2.93Å; D147-I149 PolarHBondContact OD1-N 3.35Å; D147-I149 VanDerWaalsContact OD1-N 3.12Å; D147-K150 HydrophobicContact CB-CB 4.15Å; D147-K150 VanDerWaalsContact CG-CB 3.41Å; D147-K150 PolarHBondContact O-N 3.38Å; D147-K150 PolarHBondContact OD1-N 2.96Å; D147-K150 WeakPolarHBondContact OD2-CB 3.34Å; D147-A151 WeakPolarHBondContact O-CB 3.11Å; D147-A151 PolarHBondContact O-N 3.18Å
148	F	76.1	Confident	75.3	Confident	82 Å²	82	71.2 Å²	71.2	36%	0.36	33%	0.327	S	S	.	.	H	α-helix	trans	-61.5	-33.6	-179	-60.1	-70.1	0	0	0	112.6	P146 N152 V224	P146-F148 HydrophobicContact CB-CE1 4.21Å; P146-F148 HydrophobicContact CB-CZ 4.33Å; P146-F148 HydrophobicContact CG-CD1 4.22Å; P146-F148 HydrophobicContact CG-CD2 4.42Å; P146-F148 HydrophobicContact CG-CE1 3.49Å; P146-F148 VanDerWaalsContact CG-CE1 3.49Å; P146-F148 HydrophobicContact CG-CE2 3.75Å; P146-F148 HydrophobicContact CG-CZ 3.23Å; P146-F148 PolarHBondContact O-N 2.76Å; F148-N152 VanDerWaalsContact O-CB 3.25Å; F148-N152 WeakPolarHBondContact O-CB 3.42Å; F148-N152 PolarHBondContact O-N 2.82Å; F148-N152 PolarHBondContact O-ND2 3.48Å; F148-N152 VanDerWaalsContact O-ND2 3.15Å; F148-N152 PolarHBondContact O-OD1 3.13Å; F148-V224 HydrophobicContact CD1-CG2 3.84Å; F148-V224 HydrophobicContact CD2-CG2 4.1Å; F148-V224 HydrophobicContact CE1-CB 4.23Å; F148-V224 HydrophobicContact CE1-CG1 4.12Å; F148-V224 HydrophobicContact CE1-CG2 3.68Å; F148-V224 HydrophobicContact CE2-CG1 3.94Å; F148-V224 HydrophobicContact CE2-CG2 3.93Å; F148-V224 HydrophobicContact CG-CG2 4.04Å; F148-V224 HydrophobicContact CZ-CB 4.07Å; F148-V224 HydrophobicContact CZ-CG1 3.49Å; F148-V224 VanDerWaalsContact CZ-CG1 3.49Å; F148-V224 HydrophobicContact CZ-CG2 3.71Å
149	I	72.8	Confident	75.1	Confident	130 Å²	130	68.7 Å²	68.7	67%	0.667	31%	0.313	S	S	*	.	H	α-helix	trans	-66.4	-47	-179	-59.3	176.1	0	0	0	109.2	D147 N152 R153	D147-I149 PolarHBondContact O-N 2.93Å; D147-I149 PolarHBondContact OD1-N 3.35Å; D147-I149 VanDerWaalsContact OD1-N 3.12Å; I149-N152 PolarHBondContact O-N 3.07Å; I149-R153 WeakPolarHBondContact O-CG 3.42Å; I149-R153 PolarHBondContact O-N 2.96Å
150	K	76.2	Confident	74.8	Confident	68 Å²	68	69 Å²	69	30%	0.296	32%	0.319	S	S	.	.	H	α-helix	trans	-70.4	-38.3	179.9	-157.2	150.7	-168.7	173.6	0	112.1	F76 P79 D147 N152 R153 V154	F76-K150 HydrophobicContact CB-CG 4.41Å; F76-K150 HydrophobicContact CD1-CD 3.78Å; F76-K150 HydrophobicContact CD1-CG 4.29Å; F76-K150 HydrophobicContact CE1-CD 3.98Å; F76-K150 VanDerWaalsContact CE1-CE 3.49Å; F76-K150 HydrophobicContact CG-CD 4.14Å; F76-K150 HydrophobicContact CG-CG 4.31Å; F76-K150 HydrophobicContact CZ-CD 4.5Å; P79-K150 HydrophobicContact CB-CB 4.39Å; P79-K150 HydrophobicContact CG-CB 4.17Å; D147-K150 HydrophobicContact CB-CB 4.15Å; D147-K150 VanDerWaalsContact CG-CB 3.41Å; D147-K150 PolarHBondContact O-N 3.38Å; D147-K150 PolarHBondContact OD1-N 2.96Å; D147-K150 WeakPolarHBondContact OD2-CB 3.34Å; K150-N152 PolarHBondContact O-N 3.49Å; K150-R153 PolarHBondContact O-N 2.84Å; K150-V154 WeakPolarHBondContact O-CG2 3.5Å; K150-V154 PolarHBondContact O-N 3.49Å
151	A	74.9	Confident	74.6	Confident	15 Å²	15	66.5 Å²	66.5	12%	0.124	31%	0.313	C	S	.	.	H	α-helix	trans	-60	-44	172.9	0	0	0	0	0	112.1	P79 D147 R153 V154 T155	P79-A151 HydrophobicContact CG-CB 3.92Å; D147-A151 WeakPolarHBondContact O-CB 3.11Å; D147-A151 PolarHBondContact O-N 3.18Å; A151-R153 VanDerWaalsContact C-N 3.34Å; A151-R153 PolarHBondContact O-N 3.04Å; A151-V154 PolarHBondContact O-N 3.03Å; A151-T155 PolarHBondContact O-N 2.93Å; A151-T155 PolarHBondContact O-OG1 2.89Å
152	N	71.1	Confident	74	Confident	19 Å²	19	70.3 Å²	70.3	10%	0.102	33%	0.332	C	S	.	.	H	α-helix	trans	-65.1	-37.4	177.1	-68.8	-13.7	0	0	0	111.5	F148 I149 K150 T155 A156 V220 R222	F148-N152 VanDerWaalsContact O-CB 3.25Å; F148-N152 WeakPolarHBondContact O-CB 3.42Å; F148-N152 PolarHBondContact O-N 2.82Å; F148-N152 PolarHBondContact O-ND2 3.48Å; F148-N152 VanDerWaalsContact O-ND2 3.15Å; F148-N152 PolarHBondContact O-OD1 3.13Å; I149-N152 PolarHBondContact O-N 3.07Å; K150-N152 PolarHBondContact O-N 3.49Å; N152-T155 PolarHBondContact O-N 3.38Å; N152-A156 VanDerWaalsContact O-CB 3.29Å; N152-A156 WeakPolarHBondContact O-CB 3.49Å; N152-A156 PolarHBondContact O-N 3.21Å; N152-V220 WeakPolarHBondContact CB-O 3.34Å; N152-V220 PolarHBondContact OD1-O 3.45Å; N152-V220 VanDerWaalsContact OD1-O 3.06Å; N152-R222 PolarHBondContact OD1-N 3.45Å
153	R	70.8	Confident	74	Confident	173 Å²	173	70.9 Å²	70.9	65%	0.653	34%	0.338	S	S	*	.	H	α-helix	trans	-64.8	-43.1	174.6	-75.1	-179.6	68.1	173.5	2.3	113	I149 K150 A151 A156 A157	I149-R153 WeakPolarHBondContact O-CG 3.42Å; I149-R153 PolarHBondContact O-N 2.96Å; K150-R153 PolarHBondContact O-N 2.84Å; A151-R153 VanDerWaalsContact C-N 3.34Å; A151-R153 PolarHBondContact O-N 3.04Å; R153-A156 PolarHBondContact O-N 2.65Å; R153-A157 PolarHBondContact O-N 3.11Å
154	V	71	Confident	74.2	Confident	33 Å²	33	64.6 Å²	64.6	20%	0.2	31%	0.314	C	S	.	.	H	α-helix	trans	-60.4	-49.9	175.1	172.3	0	0	0	0	109.5	F76 K150 A151 A156 A157 E158	F76-V154 HydrophobicContact CB-CG2 4.07Å; K150-V154 WeakPolarHBondContact O-CG2 3.5Å; K150-V154 PolarHBondContact O-N 3.49Å; A151-V154 PolarHBondContact O-N 3.03Å; V154-A156 VanDerWaalsContact C-N 3.31Å; V154-A156 PolarHBondContact O-N 2.95Å; V154-A157 WeakPolarHBondContact O-CB 3.38Å; V154-A157 PolarHBondContact O-N 3.16Å; V154-E158 HydrophobicContact CG1-CG 4.46Å; V154-E158 WeakPolarHBondContact O-CG 3.28Å; V154-E158 PolarHBondContact O-N 3.35Å
155	T	71.3	Confident	74.5	Confident	2 Å²	2	65.8 Å²	65.8	1%	0.012	33%	0.325	C	S	.	.	H	α-helix	trans	-61.4	-39.2	179.4	-46.5	0	0	0	0	112.1	A151 N152 A157 E158 F159 L164 F185 V220 R222	A151-T155 PolarHBondContact O-N 2.93Å; A151-T155 PolarHBondContact O-OG1 2.89Å; N152-T155 PolarHBondContact O-N 3.38Å; T155-A157 VanDerWaalsContact C-N 3.35Å; T155-E158 PolarHBondContact O-N 3.48Å; T155-F159 WeakPolarHBondContact O-CB 3.29Å; T155-F159 PolarHBondContact O-N 3.03Å; T155-L164 HydrophobicContact CG2-CD2 3.98Å; T155-F185 HydrophobicContact CG2-CE2 3.53Å; T155-F185 HydrophobicContact CG2-CZ 3.86Å; T155-V220 HydrophobicContact CG2-CB 4.28Å; T155-V220 HydrophobicContact CG2-CG1 3.67Å; T155-R222 PolarHBondContact OG1-NH2 2.78Å
156	A	70.2	Confident	75	Confident	23 Å²	23	58.5 Å²	58.5	19%	0.19	29%	0.294	C	S	.	.	H	α-helix	trans	-67.4	-33.6	176.1	0	0	0	0	0	112.7	N152 R153 V154 K160 V220	N152-A156 VanDerWaalsContact O-CB 3.29Å; N152-A156 WeakPolarHBondContact O-CB 3.49Å; N152-A156 PolarHBondContact O-N 3.21Å; R153-A156 PolarHBondContact O-N 2.65Å; V154-A156 VanDerWaalsContact C-N 3.31Å; V154-A156 PolarHBondContact O-N 2.95Å; A156-K160 WeakPolarHBondContact O-CG 3.42Å; A156-K160 PolarHBondContact O-N 3.46Å; A156-K160 VanDerWaalsContact O-N 3.11Å; A156-V220 HydrophobicContact CB-CG2 4.42Å
157	A	70	Confident	75.3	Confident	44 Å²	44	60.8 Å²	60.8	36%	0.364	30%	0.301	S	S	.	.	H	α-helix	trans	-69.9	-42.7	173.6	0	0	0	0	0	111.6	R153 V154 T155 F159 K160 Q161	R153-A157 PolarHBondContact O-N 3.11Å; V154-A157 WeakPolarHBondContact O-CB 3.38Å; V154-A157 PolarHBondContact O-N 3.16Å; T155-A157 VanDerWaalsContact C-N 3.35Å; A157-F159 VanDerWaalsContact C-N 3.32Å; A157-F159 PolarHBondContact O-N 2.85Å; A157-K160 PolarHBondContact O-N 3.4Å; A157-Q161 PolarHBondContact O-N 3.13Å; A157-Q161 VanDerWaalsContact O-N 3.15Å
158	E	74.2	Confident	75.4	Confident	51 Å²	51	62.6 Å²	62.6	24%	0.238	32%	0.316	C	S	.	.	H	α-helix	trans	-60.6	-41.4	173.6	-70.7	172.4	161.2	0	0	111.5	V154 T155 Q161 M162 I163 L164	V154-E158 HydrophobicContact CG1-CG 4.46Å; V154-E158 WeakPolarHBondContact O-CG 3.28Å; V154-E158 PolarHBondContact O-N 3.35Å; T155-E158 PolarHBondContact O-N 3.48Å; E158-Q161 CarbonylContact O-C 3.57Å; E158-Q161 PolarHBondContact O-N 2.63Å; E158-M162 PolarHBondContact O-N 3Å; E158-I163 HydrophobicContact CB-CD1 4.31Å; E158-I163 HydrophobicContact CB-CG1 3.81Å; E158-I163 HydrophobicContact CG-CD1 3.99Å; E158-I163 HydrophobicContact CG-CG1 4Å; E158-I163 WeakPolarHBondContact O-CG1 3.48Å; E158-I163 PolarHBondContact O-N 3.29Å; E158-L164 HydrophobicContact CB-CD2 3.72Å; E158-L164 HydrophobicContact CB-CG 4.12Å
159	F	70.2	Confident	75.7	Confident	20 Å²	20	60.2 Å²	60.2	9%	0.088	31%	0.309	C	S	.	.	H	α-helix	trans	-60.8	-44.7	174.4	-176.6	-102.8	0	0	0	112.1	T155 A157 Q161 M162 L164 F208 L211 F218	T155-F159 WeakPolarHBondContact O-CB 3.29Å; T155-F159 PolarHBondContact O-N 3.03Å; A157-F159 VanDerWaalsContact C-N 3.32Å; A157-F159 PolarHBondContact O-N 2.85Å; F159-Q161 PolarHBondContact O-N 3.27Å; F159-M162 PolarHBondContact O-N 2.95Å; F159-M162 VanDerWaalsContact O-N 3.1Å; F159-L164 HydrophobicContact CB-CD1 3.8Å; F159-L164 HydrophobicContact CD2-CD1 3.66Å; F159-L164 HydrophobicContact CG-CD1 4.23Å; F159-F208 HydrophobicContact CD2-CD1 4.43Å; F159-F208 HydrophobicContact CD2-CE1 4.25Å; F159-F208 HydrophobicContact CD2-CZ 4.34Å; F159-F208 HydrophobicContact CE2-CB 4.32Å; F159-F208 AromaticContact CE2-CD1 3.57Å; F159-F208 HydrophobicContact CE2-CD1 3.57Å; F159-F208 HydrophobicContact CE2-CD2 4.28Å; F159-F208 AromaticContact CE2-CE1 3.79Å; F159-F208 HydrophobicContact CE2-CE1 3.79Å; F159-F208 HydrophobicContact CE2-CE2 4.48Å; F159-F208 AromaticContact CE2-CG 3.81Å; F159-F208 HydrophobicContact CE2-CG 3.81Å; F159-F208 HydrophobicContact CE2-CZ 4.25Å; F159-F208 HydrophobicContact CZ-CD1 4.45Å; F159-L211 HydrophobicContact CE2-CD1 4.25Å; F159-L211 HydrophobicContact CZ-CB 3.85Å; F159-L211 HydrophobicContact CZ-CD1 4.19Å; F159-F218 HydrophobicContact CD1-CD1 4.41Å; F159-F218 HydrophobicContact CE1-CD1 4.26Å
160	K	68.8	Low	76.2	Confident	181 Å²	181	64.4 Å²	64.4	79%	0.787	32%	0.322	S	S	*	.	H	α-helix	trans	-61.3	-29.6	176.6	-76.4	179.9	-179.2	-174.1	0	112.7	A156 A157	A156-K160 WeakPolarHBondContact O-CG 3.42Å; A156-K160 PolarHBondContact O-N 3.46Å; A156-K160 VanDerWaalsContact O-N 3.11Å; A157-K160 PolarHBondContact O-N 3.4Å
161	Q	72.2	Confident	76.5	Confident	87 Å²	87	64.2 Å²	64.2	41%	0.407	33%	0.333	S	S	.	.	H	α-helix	trans	-93.4	-3.4	178.3	-66.5	176.7	22.8	0	0	113.5	A157 E158 F159 I163	A157-Q161 PolarHBondContact O-N 3.13Å; A157-Q161 VanDerWaalsContact O-N 3.15Å; E158-Q161 CarbonylContact O-C 3.57Å; E158-Q161 PolarHBondContact O-N 2.63Å; F159-Q161 PolarHBondContact O-N 3.27Å; Q161-I163 VanDerWaalsContact C-N 3.29Å; Q161-I163 HydrophobicContact CB-CD1 4.24Å; Q161-I163 HydrophobicContact CB-CG1 4.05Å; Q161-I163 HydrophobicContact CB-CG2 4.26Å; Q161-I163 PolarHBondContact O-N 2.92Å
162	M	69.9	Low	76.9	Confident	80 Å²	80	70 Å²	70	39%	0.394	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.6	35.9	-176.2	-66.7	-66.7	-178.9	0	0	114.4	E158 F159 F208 K212	E158-M162 PolarHBondContact O-N 3Å; F159-M162 PolarHBondContact O-N 2.95Å; F159-M162 VanDerWaalsContact O-N 3.1Å; M162-F208 HydrophobicContact CE-CB 4.04Å; M162-F208 HydrophobicContact CE-CD2 4.41Å; M162-F208 HydrophobicContact SD-CB 4.36Å; M162-F208 HydrophobicContact SD-CD2 3.68Å; M162-F208 HydrophobicContact SD-CE2 4.37Å; M162-F208 HydrophobicContact SD-CG 4.39Å; M162-K212 HydrophobicContact CE-CD 4.41Å
163	I	78.9	Confident	77.8	Confident	102 Å²	102	74 Å²	74	52%	0.523	38%	0.376	S	S	.	.			trans	-105.6	23.4	-178.3	59	173.4	0	0	0	113.7	E158 Q161	E158-I163 HydrophobicContact CB-CD1 4.31Å; E158-I163 HydrophobicContact CB-CG1 3.81Å; E158-I163 HydrophobicContact CG-CD1 3.99Å; E158-I163 HydrophobicContact CG-CG1 4Å; E158-I163 WeakPolarHBondContact O-CG1 3.48Å; E158-I163 PolarHBondContact O-N 3.29Å; Q161-I163 VanDerWaalsContact C-N 3.29Å; Q161-I163 HydrophobicContact CB-CD1 4.24Å; Q161-I163 HydrophobicContact CB-CG1 4.05Å; Q161-I163 HydrophobicContact CB-CG2 4.26Å; Q161-I163 PolarHBondContact O-N 2.92Å
164	L	82.1	Confident	78.6	Confident	10 Å²	10	70.1 Å²	70.1	5%	0.052	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-83.4	137.4	180	-67.3	163.8	0	0	0	111.5	T155 E158 F159 A175 F185 F208	T155-L164 HydrophobicContact CG2-CD2 3.98Å; E158-L164 HydrophobicContact CB-CD2 3.72Å; E158-L164 HydrophobicContact CB-CG 4.12Å; F159-L164 HydrophobicContact CB-CD1 3.8Å; F159-L164 HydrophobicContact CD2-CD1 3.66Å; F159-L164 HydrophobicContact CG-CD1 4.23Å; L164-A175 HydrophobicContact CB-CB 4.12Å; L164-A175 WeakPolarHBondContact O-CB 3.38Å; L164-A175 PolarHBondContact O-N 3.26Å; L164-F185 HydrophobicContact CD1-CD1 3.95Å; L164-F185 HydrophobicContact CD1-CD2 4.34Å; L164-F185 HydrophobicContact CD1-CE1 3.6Å; L164-F185 HydrophobicContact CD1-CE2 4.04Å; L164-F185 HydrophobicContact CD1-CG 4.3Å; L164-F185 HydrophobicContact CD1-CZ 3.64Å; L164-F185 HydrophobicContact CD2-CD2 4.18Å; L164-F185 HydrophobicContact CD2-CE2 3.94Å; L164-F185 HydrophobicContact CD2-CZ 4.32Å; L164-F208 HydrophobicContact CB-CZ 4.49Å; L164-F208 HydrophobicContact CD1-CE2 4.36Å; L164-F208 HydrophobicContact CD1-CZ 3.96Å
165	S	85.8	Confident	79.4	Confident	52 Å²	52	69.1 Å²	69.1	36%	0.364	37%	0.368	S	S	.	.	B	Isolated β-bridge	trans	-98.9	162.5	171.2	54.9	0	0	0	0	111.9	E167 E172 E173	S165-E167 PolarHBondContact O-N 3.48Å; S165-E172 WeakPolarHBondContact CB-O 3.24Å; S165-E173 CarbonylContact C-O 3.53Å
166	C	89.2	Confident	80.2	Confident	2 Å²	2	74 Å²	74	1%	0.014	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-73	125.5	177.9	179.8	0	0	0	0	111.3	E173 F185 C187 C190	C166-E173 VanDerWaalsContact CB-O 3.23Å; C166-E173 WeakPolarHBondContact CB-O 3.42Å; C166-E173 PolarHBondContact N-O 3.04Å; C166-F185 CarbonylContact C-O 3.58Å; C166-F185 WeakPolarHBondContact CA-O 3.49Å; C166-F185 PolarHBondContact SG-O 2.85Å; C166-C187 HydrophobicContact CB-CB 3.69Å; C166-C187 PolarHBondContact SG-N 3.28Å; C166-C190 VanDerWaalsContact SG-SG 3.66Å
167	E	83.9	Confident	81.1	Confident	81 Å²	81	73 Å²	73	38%	0.379	38%	0.384	S	S	.	.	S	Bend	trans	-88	-11.5	-177.9	-64.6	172	154.4	0	0	112.8	S165 C184 F185 R222	S165-E167 PolarHBondContact O-N 3.48Å; E167-C184 HydrophobicContact CB-CB 4.31Å; E167-C184 VanDerWaalsContact OE2-CA 3.28Å; E167-C184 WeakPolarHBondContact OE2-CA 3.41Å; E167-F185 HydrophobicContact CG-CB 4.4Å; E167-F185 HydrophobicContact CG-CD2 4.47Å; E167-F185 PolarHBondContact N-O 3.39Å; E167-F185 PolarHBondContact OE2-N 3.45Å; E167-R222 IonicContact OE1-CZ 3.61Å; E167-R222 IonicContact OE1-NH2 3.3Å; E167-R222 PolarHBondContact OE1-NH2 3.37Å
168	S	84.1	Confident	81.9	Confident	60 Å²	60	71.8 Å²	71.8	42%	0.42	37%	0.37	S	S	.	.	S	Bend	trans	-98.2	-18.2	-176.8	-57.1	0	0	0	0	114.3	L186	S168-L186 WeakPolarHBondContact OG-CD2 3.35Å
169	C	82.7	Confident	82.4	Confident	31 Å²	31	69.4 Å²	69.4	21%	0.209	36%	0.359	C	S	.	.	S	Bend	trans	-111.3	149.9	179.3	77.6	0	0	0	0	111.6	A171 E172	C169-A171 PolarHBondContact O-N 3.46Å; C169-E172 PolarHBondContact O-N 3.17Å
170	K	83.3	Confident	83	Confident	218 Å²	218	71.8 Å²	71.8	95%	0.948	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-11.8	175.7	-66.3	-174.3	177.6	-176.9	0	113.9	E172	K170-E172 VanDerWaalsContact C-N 3.35Å
171	A	82.5	Confident	83.4	Confident	65 Å²	65	68.8 Å²	68.8	54%	0.537	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-12.6	-178.7	0	0	0	0	0	112.5	C169 E173	C169-A171 PolarHBondContact O-N 3.46Å; A171-E173 HydrophobicContact CB-CG 3.78Å; A171-E173 PolarHBondContact O-N 2.96Å
172	E	83.2	Confident	83.6	Confident	137 Å²	137	66.3 Å²	66.3	64%	0.64	35%	0.353	S	S	*	.			trans	50	32.6	-179.4	-61.4	-177.8	-176	0	0	113.1	S165 C169 K170	S165-E172 WeakPolarHBondContact CB-O 3.24Å; C169-E172 PolarHBondContact O-N 3.17Å; K170-E172 VanDerWaalsContact C-N 3.35Å
173	E	88.9	Confident	84	Confident	102 Å²	102	63.9 Å²	63.9	48%	0.477	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-57.7	151	178.5	-67.8	-68	165.7	0	0	111.2	S165 C166 A171 A175 C187	S165-E173 CarbonylContact C-O 3.53Å; C166-E173 VanDerWaalsContact CB-O 3.23Å; C166-E173 WeakPolarHBondContact CB-O 3.42Å; C166-E173 PolarHBondContact N-O 3.04Å; A171-E173 HydrophobicContact CB-CG 3.78Å; A171-E173 PolarHBondContact O-N 2.96Å; E173-A175 PolarHBondContact O-N 2.82Å; E173-C187 HydrophobicContact CB-CB 3.59Å
174	P	88.1	Confident	84.2	Confident	91 Å²	91	60.6 Å²	60.6	59%	0.591	33%	0.329	S	S	*	.	B	Isolated β-bridge	trans	-54.8	128.6	-179	21.2	-31.8	0	0	0	111.4
175	A	88.7	Confident	84.4	Confident	12 Å²	12	60.2 Å²	60.2	10%	0.099	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-72.9	142.5	179.7	0	0	0	0	0	110.7	L164 E173 F185 L186 F208	L164-A175 HydrophobicContact CB-CB 4.12Å; L164-A175 WeakPolarHBondContact O-CB 3.38Å; L164-A175 PolarHBondContact O-N 3.26Å; E173-A175 PolarHBondContact O-N 2.82Å; A175-F185 HydrophobicContact CB-CB 3.69Å; A175-L186 WeakPolarHBondContact CA-O 3.41Å; A175-F208 HydrophobicContact CB-CE2 3.98Å; A175-F208 HydrophobicContact CB-CZ 3.77Å; A175-F208 WeakPolarHBondContact O-CE2 3.46Å
176	M	88.2	Confident	84.6	Confident	105 Å²	105	57.7 Å²	57.7	52%	0.517	31%	0.31	S	S	.	.			trans	-123.8	-18.5	179.6	-61.9	-173.2	72.2	0	0	112.8	L186 I188 I191 F208	M176-L186 PolarHBondContact N-O 3.46Å; M176-I188 HydrophobicContact SD-CB 4.11Å; M176-I191 HydrophobicContact CB-CD1 4.08Å; M176-F208 WeakPolarHBondContact O-CG 3.49Å; M176-F208 PolarHBondContact O-N 2.72Å
177	A	88.7	Confident	84.8	Confident	3 Å²	3	57.8 Å²	57.8	3%	0.025	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	167.8	-179.5	0	0	0	0	0	110.8	L186 I191 V205 V206	A177-L186 PolarHBondContact N-O 3.29Å; A177-L186 PolarHBondContact O-N 2.85Å; A177-I191 HydrophobicContact CB-CD1 3.43Å; A177-I191 VanDerWaalsContact CB-CD1 3.43Å; A177-I191 HydrophobicContact CB-CG1 3.87Å; A177-V205 HydrophobicContact CB-CG1 3.6Å; A177-V206 CarbonylContact C-O 3.5Å; A177-V206 VanDerWaalsContact CA-O 3.3Å; A177-V206 WeakPolarHBondContact CA-O 3.31Å; A177-V206 WeakPolarHBondContact CB-O 3.41Å
178	R	86.8	Confident	85.2	Confident	18 Å²	18	58.3 Å²	58.3	7%	0.068	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	132.1	170.4	-173.2	178.1	-176.7	-161.9	-5	108.9	C184 F185 V206 F208 L211 H221	R178-C184 WeakPolarHBondContact CA-O 3.19Å; R178-F185 HydrophobicContact CB-CD1 4.11Å; R178-F185 HydrophobicContact CB-CE1 4.25Å; R178-F185 HydrophobicContact CG-CD1 4.23Å; R178-F185 HydrophobicContact CG-CE1 4.24Å; R178-V206 PolarHBondContact N-O 2.7Å; R178-V206 PolarHBondContact O-N 3.09Å; R178-F208 HydrophobicContact CB-CE1 4.5Å; R178-L211 HydrophobicContact CB-CD1 4.49Å; R178-H221 PolarHBondContact NH2-O 2.96Å
179	C	85.1	Confident	85.6	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	130.8	166.5	174.4	0	0	0	0	109.2	C182 S183 C184 L186 E204 V205	C179-C182 HydrophobicContact CB-CB 3.93Å; C179-C182 PolarHBondContact SG-N 3.31Å; C179-S183 WeakPolarHBondContact O-CA 3.5Å; C179-S183 PolarHBondContact O-N 3.12Å; C179-C184 PolarHBondContact N-O 2.97Å; C179-L186 HydrophobicContact CB-CD1 3.73Å; C179-L186 HydrophobicContact CB-CG 4.36Å; C179-E204 CarbonylContact C-O 3.48Å; C179-E204 VanDerWaalsContact CA-O 3.3Å; C179-E204 WeakPolarHBondContact CA-O 3.38Å; C179-V205 HydrophobicContact CB-CG2 4.18Å
180	L	81	Confident	86.1	Confident	70 Å²	70	58.5 Å²	58.5	37%	0.366	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-44	-178.5	-58.1	-173.9	0	0	0	111.1	S183 E204 V206	L180-S183 PolarHBondContact O-N 2.98Å; L180-S183 PolarHBondContact O-OG 3.37Å; L180-S183 VanDerWaalsContact O-OG 3.06Å; L180-E204 HydrophobicContact CB-CB 4.43Å; L180-E204 HydrophobicContact CD1-CB 4.14Å; L180-E204 HydrophobicContact CD1-CG 4.07Å; L180-E204 HydrophobicContact CG-CB 4.35Å; L180-E204 PolarHBondContact N-O 3.42Å; L180-V206 HydrophobicContact CD1-CG2 3.91Å; L180-V206 HydrophobicContact CD2-CG2 4.09Å; L180-V206 HydrophobicContact CG-CG2 3.95Å
181	E	77.9	Confident	86.5	Confident	118 Å²	118	49.2 Å²	49.2	55%	0.551	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-51.7	176.2	-103.8	53.9	-135.1	0	0	113.5	S183 H203	E181-S183 PolarHBondContact O-N 2.94Å; E181-H203 HydrophobicContact CB-CB 4.23Å
182	C	77.1	Confident	87	Confident	35 Å²	35	49.5 Å²	49.5	24%	0.236	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-24.1	175.3	-68.8	0	0	0	0	111.6	C179 C184 H194 H203	C179-C182 HydrophobicContact CB-CB 3.93Å; C179-C182 PolarHBondContact SG-N 3.31Å; C182-C184 HydrophobicContact CB-CB 4.08Å; C182-C184 PolarHBondContact O-N 3.34Å; C182-C184 VanDerWaalsContact O-N 3.12Å; C182-C184 PolarHBondContact O-SG 3.09Å; C182-C184 VanDerWaalsContact O-SG 3.32Å; C182-H194 PolarHBondContact SG-NE2 2.96Å; C182-H203 PolarHBondContact SG-CE1 3.18Å; C182-H203 PolarHBondContact SG-ND1 3.43Å
183	S	77	Confident	87.3	Confident	29 Å²	29	44.6 Å²	44.6	20%	0.203	25%	0.253	C	S	.	.			trans	54.1	21.7	-167.4	-73.1	0	0	0	0	114.3	C179 L180 E181 P223	C179-S183 WeakPolarHBondContact O-CA 3.5Å; C179-S183 PolarHBondContact O-N 3.12Å; L180-S183 PolarHBondContact O-N 2.98Å; L180-S183 PolarHBondContact O-OG 3.37Å; L180-S183 VanDerWaalsContact O-OG 3.06Å; E181-S183 PolarHBondContact O-N 2.94Å; S183-P223 VanDerWaalsContact CB-CD 3.42Å
184	C	82.9	Confident	87.3	Confident	33 Å²	33	40.4 Å²	40.4	22%	0.223	23%	0.233	C	C	.	.			trans	-101.2	150.4	-178.8	-64.9	0	0	0	0	112.5	E167 R178 C179 C182 L186	E167-C184 HydrophobicContact CB-CB 4.31Å; E167-C184 VanDerWaalsContact OE2-CA 3.28Å; E167-C184 WeakPolarHBondContact OE2-CA 3.41Å; R178-C184 WeakPolarHBondContact CA-O 3.19Å; C179-C184 PolarHBondContact N-O 2.97Å; C182-C184 HydrophobicContact CB-CB 4.08Å; C182-C184 PolarHBondContact O-N 3.34Å; C182-C184 VanDerWaalsContact O-N 3.12Å; C182-C184 PolarHBondContact O-SG 3.09Å; C182-C184 VanDerWaalsContact O-SG 3.32Å; C184-L186 HydrophobicContact CB-CD2 4.17Å
185	F	87.3	Confident	87.4	Confident	2 Å²	2	40.5 Å²	40.5	1%	0.009	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	133.1	167.1	-64.3	-66.5	0	0	0	111.6	T155 L164 C166 E167 A175 R178 F208 V220	T155-F185 HydrophobicContact CG2-CE2 3.53Å; T155-F185 HydrophobicContact CG2-CZ 3.86Å; L164-F185 HydrophobicContact CD1-CD1 3.95Å; L164-F185 HydrophobicContact CD1-CD2 4.34Å; L164-F185 HydrophobicContact CD1-CE1 3.6Å; L164-F185 HydrophobicContact CD1-CE2 4.04Å; L164-F185 HydrophobicContact CD1-CG 4.3Å; L164-F185 HydrophobicContact CD1-CZ 3.64Å; L164-F185 HydrophobicContact CD2-CD2 4.18Å; L164-F185 HydrophobicContact CD2-CE2 3.94Å; L164-F185 HydrophobicContact CD2-CZ 4.32Å; C166-F185 CarbonylContact C-O 3.58Å; C166-F185 WeakPolarHBondContact CA-O 3.49Å; C166-F185 PolarHBondContact SG-O 2.85Å; E167-F185 HydrophobicContact CG-CB 4.4Å; E167-F185 HydrophobicContact CG-CD2 4.47Å; E167-F185 PolarHBondContact N-O 3.39Å; E167-F185 PolarHBondContact OE2-N 3.45Å; A175-F185 HydrophobicContact CB-CB 3.69Å; R178-F185 HydrophobicContact CB-CD1 4.11Å; R178-F185 HydrophobicContact CB-CE1 4.25Å; R178-F185 HydrophobicContact CG-CD1 4.23Å; R178-F185 HydrophobicContact CG-CE1 4.24Å; F185-F208 AromaticContact CD1-CE1 3.69Å; F185-F208 HydrophobicContact CD1-CE1 3.69Å; F185-F208 AromaticContact CD1-CZ 3.61Å; F185-F208 HydrophobicContact CD1-CZ 3.61Å; F185-F208 AromaticContact CE1-CE1 3.97Å; F185-F208 HydrophobicContact CE1-CE1 3.97Å; F185-F208 HydrophobicContact CE1-CZ 4.07Å; F185-V220 HydrophobicContact CE2-CG1 4.33Å; F185-V220 HydrophobicContact CZ-CG1 3.83Å
186	L	89.6	Confident	87.3	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	132.3	-170	-53.7	-176	0	0	0	111.5	S168 A175 M176 A177 C179 C184 C190 I191 V205	S168-L186 WeakPolarHBondContact OG-CD2 3.35Å; A175-L186 WeakPolarHBondContact CA-O 3.41Å; M176-L186 PolarHBondContact N-O 3.46Å; A177-L186 PolarHBondContact N-O 3.29Å; A177-L186 PolarHBondContact O-N 2.85Å; C179-L186 HydrophobicContact CB-CD1 3.73Å; C179-L186 HydrophobicContact CB-CG 4.36Å; C184-L186 HydrophobicContact CB-CD2 4.17Å; L186-C190 HydrophobicContact CB-CB 4Å; L186-C190 HydrophobicContact CD2-CB 3.99Å; L186-C190 HydrophobicContact CG-CB 4.44Å; L186-I191 HydrophobicContact CB-CG1 3.79Å; L186-I191 HydrophobicContact CD1-CG1 4.42Å; L186-V205 HydrophobicContact CD1-CG1 4.34Å; L186-V205 HydrophobicContact CD1-CG2 4.28Å
187	C	93.1	Very high	87.2	Confident	3 Å²	3	48.9 Å²	48.9	2%	0.02	26%	0.259	C	S	.	.			trans	-77.8	171.1	163.5	69.4	0	0	0	0	110.5	C166 E173 S189 C190 I191	C166-C187 HydrophobicContact CB-CB 3.69Å; C166-C187 PolarHBondContact SG-N 3.28Å; E173-C187 HydrophobicContact CB-CB 3.59Å; C187-S189 PolarHBondContact O-N 3.13Å; C187-S189 VanDerWaalsContact O-N 3.15Å; C187-C190 PolarHBondContact O-N 3.04Å; C187-I191 WeakPolarHBondContact O-CG1 3.48Å; C187-I191 PolarHBondContact O-N 2.9Å
188	I	92.7	Very high	86.7	Confident	92 Å²	92	58 Å²	58	47%	0.472	30%	0.298	S	S	.	.	H	α-helix	trans	-53.9	-38.8	-178	-165.4	63.3	0	0	0	113.6	M176 C190 I191 N192	M176-I188 HydrophobicContact SD-CB 4.11Å; I188-C190 PolarHBondContact O-N 3.23Å; I188-I191 PolarHBondContact O-N 3.15Å; I188-N192 PolarHBondContact O-N 2.79Å; I188-N192 PolarHBondContact O-ND2 3.12Å
189	S	92.6	Very high	86.3	Confident	80 Å²	80	61.2 Å²	61.2	56%	0.559	32%	0.322	S	S	*	.	H	α-helix	trans	-65.2	-40.6	178.8	-58.2	0	0	0	0	112	C187 N192 A193	C187-S189 PolarHBondContact O-N 3.13Å; C187-S189 VanDerWaalsContact O-N 3.15Å; S189-N192 PolarHBondContact O-N 2.82Å; S189-A193 PolarHBondContact O-N 2.92Å
190	C	94.2	Very high	86.2	Confident	16 Å²	16	63.9 Å²	63.9	11%	0.108	33%	0.334	C	S	.	.	H	α-helix	trans	-75	-31.9	178	-72.7	0	0	0	0	112.8	C166 L186 C187 I188 N192 A193 H194	C166-C190 VanDerWaalsContact SG-SG 3.66Å; L186-C190 HydrophobicContact CB-CB 4Å; L186-C190 HydrophobicContact CD2-CB 3.99Å; L186-C190 HydrophobicContact CG-CB 4.44Å; C187-C190 PolarHBondContact O-N 3.04Å; I188-C190 PolarHBondContact O-N 3.23Å; C190-N192 VanDerWaalsContact C-N 3.33Å; C190-A193 WeakPolarHBondContact O-CB 3.45Å; C190-A193 PolarHBondContact O-N 3.09Å; C190-H194 PolarHBondContact O-N 3.39Å; C190-H194 PolarHBondContact O-ND1 2.75Å
191	I	92	Very high	86.1	Confident	22 Å²	22	67.6 Å²	67.6	11%	0.113	35%	0.354	C	S	.	.	H	α-helix	trans	-60.1	-47.3	171	-65.4	168	0	0	0	109.6	M176 A177 L186 C187 I188 A193 H194 N195 V205	M176-I191 HydrophobicContact CB-CD1 4.08Å; A177-I191 HydrophobicContact CB-CD1 3.43Å; A177-I191 VanDerWaalsContact CB-CD1 3.43Å; A177-I191 HydrophobicContact CB-CG1 3.87Å; L186-I191 HydrophobicContact CB-CG1 3.79Å; L186-I191 HydrophobicContact CD1-CG1 4.42Å; C187-I191 WeakPolarHBondContact O-CG1 3.48Å; C187-I191 PolarHBondContact O-N 2.9Å; I188-I191 PolarHBondContact O-N 3.15Å; I191-A193 VanDerWaalsContact C-N 3.32Å; I191-A193 PolarHBondContact O-N 3.2Å; I191-H194 PolarHBondContact O-N 3.21Å; I191-H194 VanDerWaalsContact O-N 3.13Å; I191-N195 PolarHBondContact O-N 2.86Å; I191-V205 HydrophobicContact CG1-CG1 4.21Å; I191-V205 HydrophobicContact CG2-CG1 4.28Å
192	N	91.7	Very high	86.3	Confident	71 Å²	71	65.1 Å²	65.1	38%	0.38	36%	0.361	S	S	.	.	H	α-helix	trans	-61.2	-41.9	176.2	-69.5	-26.5	0	0	0	111.6	I188 S189 C190 H194 N195 Y196	I188-N192 PolarHBondContact O-N 2.79Å; I188-N192 PolarHBondContact O-ND2 3.12Å; S189-N192 PolarHBondContact O-N 2.82Å; C190-N192 VanDerWaalsContact C-N 3.33Å; N192-H194 VanDerWaalsContact C-N 3.31Å; N192-H194 PolarHBondContact O-N 3.27Å; N192-N195 PolarHBondContact O-N 3.49Å; N192-Y196 HydrophobicContact CB-CD2 4.26Å; N192-Y196 HydrophobicContact CB-CE2 4.41Å; N192-Y196 WeakPolarHBondContact O-CD2 3.43Å; N192-Y196 PolarHBondContact O-N 3.14Å
193	A	88.9	Confident	86.7	Confident	35 Å²	35	66.2 Å²	66.2	29%	0.289	36%	0.362	S	S	.	.	H	α-helix	trans	-57.4	-45.5	174.2	0	0	0	0	0	111.5	S189 C190 I191 N195 Y196 M197 F200	S189-A193 PolarHBondContact O-N 2.92Å; C190-A193 WeakPolarHBondContact O-CB 3.45Å; C190-A193 PolarHBondContact O-N 3.09Å; I191-A193 VanDerWaalsContact C-N 3.32Å; I191-A193 PolarHBondContact O-N 3.2Å; A193-N195 VanDerWaalsContact C-N 3.34Å; A193-N195 PolarHBondContact O-N 3.31Å; A193-Y196 PolarHBondContact O-N 2.82Å; A193-M197 HydrophobicContact CB-CG 4.44Å; A193-M197 WeakPolarHBondContact O-CB 3.35Å; A193-M197 VanDerWaalsContact O-CG 3.23Å; A193-M197 WeakPolarHBondContact O-CG 3.36Å; A193-M197 PolarHBondContact O-N 3.2Å; A193-F200 HydrophobicContact CB-CE2 4.25Å; A193-F200 WeakPolarHBondContact O-CD2 3.25Å
194	H	90.7	Very high	87.2	Confident	13 Å²	13	70.4 Å²	70.4	6%	0.06	38%	0.378	C	S	.	.	H	α-helix	trans	-62.9	-37.7	177.3	-78.3	68.4	0	0	0	112.9	C182 C190 I191 N192 F200 H203 V205	C182-H194 PolarHBondContact SG-NE2 2.96Å; C190-H194 PolarHBondContact O-N 3.39Å; C190-H194 PolarHBondContact O-ND1 2.75Å; I191-H194 PolarHBondContact O-N 3.21Å; I191-H194 VanDerWaalsContact O-N 3.13Å; N192-H194 VanDerWaalsContact C-N 3.31Å; N192-H194 PolarHBondContact O-N 3.27Å; H194-F200 HydrophobicContact CB-CB 4.32Å; H194-F200 AromaticContact CD2-CG 3.96Å; H194-F200 AromaticContact NE2-CD1 3.95Å; H194-H203 AromaticContact CD2-ND1 3.68Å; H194-H203 AromaticContact NE2-ND1 3.85Å; H194-V205 HydrophobicContact CB-CG2 3.85Å
195	N	88.5	Confident	87.4	Confident	94 Å²	94	70.6 Å²	70.6	50%	0.503	38%	0.379	S	S	.	.	H	α-helix	trans	-75.6	-25.4	-178.8	-69.4	-18.8	0	0	0	114	I191 N192 A193	I191-N195 PolarHBondContact O-N 2.86Å; N192-N195 PolarHBondContact O-N 3.49Å; A193-N195 VanDerWaalsContact C-N 3.34Å; A193-N195 PolarHBondContact O-N 3.31Å
196	Y	87.8	Confident	87.3	Confident	187 Å²	187	71.7 Å²	71.7	73%	0.733	39%	0.386	S	S	*	.	H	α-helix	trans	-118.8	-16.3	-169.4	-63.5	-63.1	0	0	0	115.2	N192 A193	N192-Y196 HydrophobicContact CB-CD2 4.26Å; N192-Y196 HydrophobicContact CB-CE2 4.41Å; N192-Y196 WeakPolarHBondContact O-CD2 3.43Å; N192-Y196 PolarHBondContact O-N 3.14Å; A193-Y196 PolarHBondContact O-N 2.82Å
197	M	85.7	Confident	87.1	Confident	106 Å²	106	73.5 Å²	73.5	52%	0.522	40%	0.398	S	S	.	.			trans	-94.4	131.1	-179.1	-61.2	-69.9	-64.9	0	0	111.1	A193 C199 F200	A193-M197 HydrophobicContact CB-CG 4.44Å; A193-M197 WeakPolarHBondContact O-CB 3.35Å; A193-M197 VanDerWaalsContact O-CG 3.23Å; A193-M197 WeakPolarHBondContact O-CG 3.36Å; A193-M197 PolarHBondContact O-N 3.2Å; M197-C199 PolarHBondContact O-N 3.28Å; M197-F200 HydrophobicContact CB-CD2 3.79Å; M197-F200 HydrophobicContact CB-CE2 4.04Å; M197-F200 HydrophobicContact CG-CE2 4.42Å; M197-F200 PolarHBondContact O-N 2.92Å
198	K	77.2	Confident	86.6	Confident	194 Å²	194	73.9 Å²	73.9	84%	0.843	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-56.7	-24.3	177.3	-75.5	-170	175.1	-172.9	0	114.6	F200 D201	K198-F200 PolarHBondContact O-N 3.1Å; K198-D201 WeakPolarHBondContact O-CB 3.38Å; K198-D201 PolarHBondContact O-N 3.29Å
199	C	79.1	Confident	85.6	Confident	85 Å²	85	76.6 Å²	76.6	57%	0.574	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	-72.1	-10.8	179.7	55.2	0	0	0	0	113.9	M197	M197-C199 PolarHBondContact O-N 3.28Å
200	F	82.2	Confident	84.7	Confident	56 Å²	56	78.1 Å²	78.1	25%	0.246	41%	0.412	C	S	.	.	G	3₁₀ helix	trans	-116.7	18.4	176.6	-50.2	-62.6	0	0	0	111.8	A193 H194 M197 K198 G202 H203	A193-F200 HydrophobicContact CB-CE2 4.25Å; A193-F200 WeakPolarHBondContact O-CD2 3.25Å; H194-F200 HydrophobicContact CB-CB 4.32Å; H194-F200 AromaticContact CD2-CG 3.96Å; H194-F200 AromaticContact NE2-CD1 3.95Å; M197-F200 HydrophobicContact CB-CD2 3.79Å; M197-F200 HydrophobicContact CB-CE2 4.04Å; M197-F200 HydrophobicContact CG-CE2 4.42Å; M197-F200 PolarHBondContact O-N 2.92Å; K198-F200 PolarHBondContact O-N 3.1Å; F200-G202 PolarHBondContact O-N 3.2Å; F200-H203 HydrophobicContact CB-CB 4.36Å; F200-H203 AromaticContact CD1-CE1 3.96Å; F200-H203 VanDerWaalsContact O-CB 3.28Å; F200-H203 WeakPolarHBondContact O-CB 3.5Å; F200-H203 PolarHBondContact O-CD2 3.4Å; F200-H203 PolarHBondContact O-N 3.23Å
201	D	80.7	Confident	83.4	Confident	148 Å²	148	78.5 Å²	78.5	79%	0.791	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	126.2	179.1	-154.3	11.8	0	0	0	109.6	K198	K198-D201 WeakPolarHBondContact O-CB 3.38Å; K198-D201 PolarHBondContact O-N 3.29Å
202	G	81.2	Confident	81.9	Confident	67 Å²	67	83.7 Å²	83.7	69%	0.691	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.4	-2.6	-173.3	0	0	0	0	0	116.2	F200	F200-G202 PolarHBondContact O-N 3.2Å
203	H	85.9	Confident	80	Confident	57 Å²	57	86.5 Å²	86.5	26%	0.264	45%	0.454	S	S	.	.			trans	-77.2	125.7	175.9	-74.6	-143.5	0	0	0	111.4	E181 C182 H194 F200	E181-H203 HydrophobicContact CB-CB 4.23Å; C182-H203 PolarHBondContact SG-CE1 3.18Å; C182-H203 PolarHBondContact SG-ND1 3.43Å; H194-H203 AromaticContact CD2-ND1 3.68Å; H194-H203 AromaticContact NE2-ND1 3.85Å; F200-H203 HydrophobicContact CB-CB 4.36Å; F200-H203 AromaticContact CD1-CE1 3.96Å; F200-H203 VanDerWaalsContact O-CB 3.28Å; F200-H203 WeakPolarHBondContact O-CB 3.5Å; F200-H203 PolarHBondContact O-CD2 3.4Å; F200-H203 PolarHBondContact O-N 3.23Å
204	E	86.4	Confident	78.3	Confident	117 Å²	117	87.2 Å²	87.2	55%	0.547	46%	0.464	S	S	.	.			trans	-86.7	124.3	174.4	-169.8	176.1	172	0	0	111.1	C179 L180 V206	C179-E204 CarbonylContact C-O 3.48Å; C179-E204 VanDerWaalsContact CA-O 3.3Å; C179-E204 WeakPolarHBondContact CA-O 3.38Å; L180-E204 HydrophobicContact CB-CB 4.43Å; L180-E204 HydrophobicContact CD1-CB 4.14Å; L180-E204 HydrophobicContact CD1-CG 4.07Å; L180-E204 HydrophobicContact CG-CB 4.35Å; L180-E204 PolarHBondContact N-O 3.42Å; E204-V206 HydrophobicContact CG-CG2 4.31Å
205	V	88.3	Confident	76.2	Confident	38 Å²	38	94.8 Å²	94.8	23%	0.23	51%	0.506	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	117.5	178.4	-177.8	0	0	0	0	109.9	A177 C179 L186 I191 H194	A177-V205 HydrophobicContact CB-CG1 3.6Å; C179-V205 HydrophobicContact CB-CG2 4.18Å; L186-V205 HydrophobicContact CD1-CG1 4.34Å; L186-V205 HydrophobicContact CD1-CG2 4.28Å; I191-V205 HydrophobicContact CG1-CG1 4.21Å; I191-V205 HydrophobicContact CG2-CG1 4.28Å; H194-V205 HydrophobicContact CB-CG2 3.85Å
206	V	85.7	Confident	74.1	Confident	25 Å²	25	97.1 Å²	97.1	15%	0.152	52%	0.518	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	121.4	-178.7	-169.1	0	0	0	0	109.8	A177 R178 L180 E204 N210 L211	A177-V206 CarbonylContact C-O 3.5Å; A177-V206 VanDerWaalsContact CA-O 3.3Å; A177-V206 WeakPolarHBondContact CA-O 3.31Å; A177-V206 WeakPolarHBondContact CB-O 3.41Å; R178-V206 PolarHBondContact N-O 2.7Å; R178-V206 PolarHBondContact O-N 3.09Å; L180-V206 HydrophobicContact CD1-CG2 3.91Å; L180-V206 HydrophobicContact CD2-CG2 4.09Å; L180-V206 HydrophobicContact CG-CG2 3.95Å; E204-V206 HydrophobicContact CG-CG2 4.31Å; V206-N210 HydrophobicContact CG1-CB 3.98Å; V206-L211 HydrophobicContact CB-CG 4.48Å; V206-L211 HydrophobicContact CG1-CD1 4.41Å; V206-L211 HydrophobicContact CG1-CD2 4.21Å; V206-L211 HydrophobicContact CG1-CG 3.82Å
207	S	85	Confident	72.4	Confident	37 Å²	37	93.1 Å²	93.1	26%	0.259	52%	0.517	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	152.9	176.6	70.1	0	0	0	0	111.7	E209 N210 L211	S207-E209 PolarHBondContact O-N 3.34Å; S207-N210 PolarHBondContact O-N 3.43Å; S207-N210 VanDerWaalsContact O-N 3.15Å; S207-N210 PolarHBondContact OG-N 3.36Å; S207-N210 PolarHBondContact OG-ND2 3.48Å; S207-L211 PolarHBondContact O-N 2.97Å; S207-L211 VanDerWaalsContact O-N 3.13Å
208	F	81.9	Confident	70.9	Confident	12 Å²	12	91.5 Å²	91.5	5%	0.053	51%	0.508	C	S	.	.	H	α-helix	trans	-61.6	-28.7	176.6	-70.1	-5.3	0	0	0	113	F159 M162 L164 A175 M176 R178 F185 L211 K212	F159-F208 HydrophobicContact CD2-CD1 4.43Å; F159-F208 HydrophobicContact CD2-CE1 4.25Å; F159-F208 HydrophobicContact CD2-CZ 4.34Å; F159-F208 HydrophobicContact CE2-CB 4.32Å; F159-F208 AromaticContact CE2-CD1 3.57Å; F159-F208 HydrophobicContact CE2-CD1 3.57Å; F159-F208 HydrophobicContact CE2-CD2 4.28Å; F159-F208 AromaticContact CE2-CE1 3.79Å; F159-F208 HydrophobicContact CE2-CE1 3.79Å; F159-F208 HydrophobicContact CE2-CE2 4.48Å; F159-F208 AromaticContact CE2-CG 3.81Å; F159-F208 HydrophobicContact CE2-CG 3.81Å; F159-F208 HydrophobicContact CE2-CZ 4.25Å; F159-F208 HydrophobicContact CZ-CD1 4.45Å; M162-F208 HydrophobicContact CE-CB 4.04Å; M162-F208 HydrophobicContact CE-CD2 4.41Å; M162-F208 HydrophobicContact SD-CB 4.36Å; M162-F208 HydrophobicContact SD-CD2 3.68Å; M162-F208 HydrophobicContact SD-CE2 4.37Å; M162-F208 HydrophobicContact SD-CG 4.39Å; L164-F208 HydrophobicContact CB-CZ 4.49Å; L164-F208 HydrophobicContact CD1-CE2 4.36Å; L164-F208 HydrophobicContact CD1-CZ 3.96Å; A175-F208 HydrophobicContact CB-CE2 3.98Å; A175-F208 HydrophobicContact CB-CZ 3.77Å; A175-F208 WeakPolarHBondContact O-CE2 3.46Å; M176-F208 WeakPolarHBondContact O-CG 3.49Å; M176-F208 PolarHBondContact O-N 2.72Å; R178-F208 HydrophobicContact CB-CE1 4.5Å; F185-F208 AromaticContact CD1-CE1 3.69Å; F185-F208 HydrophobicContact CD1-CE1 3.69Å; F185-F208 AromaticContact CD1-CZ 3.61Å; F185-F208 HydrophobicContact CD1-CZ 3.61Å; F185-F208 AromaticContact CE1-CE1 3.97Å; F185-F208 HydrophobicContact CE1-CE1 3.97Å; F185-F208 HydrophobicContact CE1-CZ 4.07Å; F208-L211 HydrophobicContact CD1-CD1 4.03Å; F208-L211 PolarHBondContact O-N 2.99Å; F208-K212 WeakPolarHBondContact O-CG 3.49Å; F208-K212 PolarHBondContact O-N 3.26Å
209	E	72.7	Confident	69.9	Low	149 Å²	149	87.2 Å²	87.2	70%	0.696	49%	0.493	S	S	*	.	H	α-helix	trans	-64.1	-43.9	174.1	-69.2	178.8	167.8	0	0	112	S207 L211 K212	S207-E209 PolarHBondContact O-N 3.34Å; E209-L211 VanDerWaalsContact C-N 3.29Å; E209-L211 PolarHBondContact O-N 3.26Å; E209-K212 PolarHBondContact O-N 3.14Å
210	N	72.5	Confident	69.1	Low	111 Å²	111	83.2 Å²	83.2	59%	0.594	47%	0.466	S	S	*	.	H	α-helix	trans	-69.4	-30.4	178.3	-68.7	-16.8	0	0	0	111.8	V206 S207 K212	V206-N210 HydrophobicContact CG1-CB 3.98Å; S207-N210 PolarHBondContact O-N 3.43Å; S207-N210 VanDerWaalsContact O-N 3.15Å; S207-N210 PolarHBondContact OG-N 3.36Å; S207-N210 PolarHBondContact OG-ND2 3.48Å; N210-K212 VanDerWaalsContact C-N 3.31Å; N210-K212 PolarHBondContact O-N 3.39Å
211	L	67.8	Low	68.1	Low	25 Å²	25	85.9 Å²	85.9	13%	0.131	48%	0.479	C	S	.	.	H	α-helix	trans	-69.9	-22.5	174.8	-76	164	0	0	0	113.7	F159 R178 V206 S207 F208 E209 V213 F218	F159-L211 HydrophobicContact CE2-CD1 4.25Å; F159-L211 HydrophobicContact CZ-CB 3.85Å; F159-L211 HydrophobicContact CZ-CD1 4.19Å; R178-L211 HydrophobicContact CB-CD1 4.49Å; V206-L211 HydrophobicContact CB-CG 4.48Å; V206-L211 HydrophobicContact CG1-CD1 4.41Å; V206-L211 HydrophobicContact CG1-CD2 4.21Å; V206-L211 HydrophobicContact CG1-CG 3.82Å; S207-L211 PolarHBondContact O-N 2.97Å; S207-L211 VanDerWaalsContact O-N 3.13Å; F208-L211 HydrophobicContact CD1-CD1 4.03Å; F208-L211 PolarHBondContact O-N 2.99Å; E209-L211 VanDerWaalsContact C-N 3.29Å; E209-L211 PolarHBondContact O-N 3.26Å; L211-V213 VanDerWaalsContact C-N 3.34Å; L211-V213 PolarHBondContact O-N 3.14Å; L211-F218 HydrophobicContact CD1-CE1 4.49Å; L211-F218 HydrophobicContact CD1-CZ 4.3Å; L211-F218 HydrophobicContact CD2-CD2 3.89Å; L211-F218 HydrophobicContact CD2-CE1 4.16Å; L211-F218 HydrophobicContact CD2-CE2 3.31Å; L211-F218 HydrophobicContact CD2-CZ 3.45Å; L211-F218 VanDerWaalsContact CD2-CZ 3.45Å; L211-F218 HydrophobicContact CG-CZ 4.49Å
212	K	59.5	Low	67.2	Low	131 Å²	131	83.7 Å²	83.7	57%	0.57	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-20	179.8	-76.5	178.3	-175.7	178	0	114.5	M162 F208 E209 N210 G214	M162-K212 HydrophobicContact CE-CD 4.41Å; F208-K212 WeakPolarHBondContact O-CG 3.49Å; F208-K212 PolarHBondContact O-N 3.26Å; E209-K212 PolarHBondContact O-N 3.14Å; N210-K212 VanDerWaalsContact C-N 3.31Å; N210-K212 PolarHBondContact O-N 3.39Å; K212-G214 VanDerWaalsContact C-N 3.27Å; K212-G214 PolarHBondContact O-N 2.97Å
213	V	52.6	Low	66.1	Low	130 Å²	130	82.4 Å²	82.4	79%	0.788	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-18.6	-169.2	-175.8	0	0	0	0	112.3	L211	L211-V213 VanDerWaalsContact C-N 3.34Å; L211-V213 PolarHBondContact O-N 3.14Å
214	G	53.2	Low	64.9	Low	49 Å²	49	82 Å²	82	51%	0.505	44%	0.44	S	S	.	.			trans	-86.8	112.1	171.5	0	0	0	0	0	111.5	K212 D216	K212-G214 VanDerWaalsContact C-N 3.27Å; K212-G214 PolarHBondContact O-N 2.97Å; G214-D216 PolarHBondContact O-N 3.01Å
215	N	46.6	Very low	63.6	Low	173 Å²	173	81.3 Å²	81.3	93%	0.925	44%	0.436	S	S	*	.			trans	-67.3	-5.4	170	-110	-5.6	0	0	0	113.2
216	D	45.2	Very low	61.9	Low	143 Å²	143	80.9 Å²	80.9	77%	0.765	43%	0.434	S	S	*	.	S	Bend	trans	-75.5	129.4	174.3	-71.8	-26.2	0	0	0	109.4	G214 F218	G214-D216 PolarHBondContact O-N 3.01Å; D216-F218 PolarHBondContact O-N 3.39Å
217	S	50.8	Low	60.4	Low	103 Å²	103	87 Å²	87	72%	0.72	46%	0.461	S	S	*	.			trans	-42.5	96.5	175.7	50.2	0	0	0	0	111.5	I219	S217-I219 WeakPolarHBondContact O-CG1 3.4Å; S217-I219 PolarHBondContact O-N 3.49Å
218	F	55.3	Low	59	Low	72 Å²	72	88 Å²	88	32%	0.316	48%	0.477	S	S	.	.			trans	-64.1	105.1	179	-178.7	-109.9	0	0	0	108.9	F159 L211 D216 V220	F159-F218 HydrophobicContact CD1-CD1 4.41Å; F159-F218 HydrophobicContact CE1-CD1 4.26Å; L211-F218 HydrophobicContact CD1-CE1 4.49Å; L211-F218 HydrophobicContact CD1-CZ 4.3Å; L211-F218 HydrophobicContact CD2-CD2 3.89Å; L211-F218 HydrophobicContact CD2-CE1 4.16Å; L211-F218 HydrophobicContact CD2-CE2 3.31Å; L211-F218 HydrophobicContact CD2-CZ 3.45Å; L211-F218 VanDerWaalsContact CD2-CZ 3.45Å; L211-F218 HydrophobicContact CG-CZ 4.49Å; D216-F218 PolarHBondContact O-N 3.39Å; F218-V220 HydrophobicContact CD1-CG2 3.72Å; F218-V220 HydrophobicContact CE1-CG2 3.7Å; F218-V220 PolarHBondContact O-N 2.9Å
219	I	55.5	Low	57.6	Low	104 Å²	104	91.5 Å²	91.5	53%	0.533	49%	0.493	S	S	.	.			trans	-82	106.5	178.7	-48.8	-179.7	0	0	0	107.9	S217 H221	S217-I219 WeakPolarHBondContact O-CG1 3.4Å; S217-I219 PolarHBondContact O-N 3.49Å; I219-H221 VanDerWaalsContact CG2-CE1 3.47Å; I219-H221 WeakPolarHBondContact CG2-CE1 2.95Å; I219-H221 WeakPolarHBondContact CG2-NE2 3.41Å; I219-H221 PolarHBondContact O-N 3.44Å
220	V	61.9	Low	56.4	Low	1 Å²	1	90.9 Å²	90.9	1%	0.006	50%	0.504	C	S	.	.			trans	-74.4	96.1	172.9	-174	0	0	0	0	108.4	N152 T155 A156 F185 F218	N152-V220 WeakPolarHBondContact CB-O 3.34Å; N152-V220 PolarHBondContact OD1-O 3.45Å; N152-V220 VanDerWaalsContact OD1-O 3.06Å; T155-V220 HydrophobicContact CG2-CB 4.28Å; T155-V220 HydrophobicContact CG2-CG1 3.67Å; A156-V220 HydrophobicContact CB-CG2 4.42Å; F185-V220 HydrophobicContact CE2-CG1 4.33Å; F185-V220 HydrophobicContact CZ-CG1 3.83Å; F218-V220 HydrophobicContact CD1-CG2 3.72Å; F218-V220 HydrophobicContact CE1-CG2 3.7Å; F218-V220 PolarHBondContact O-N 2.9Å
221	H	61	Low	55.5	Low	112 Å²	112	88.2 Å²	88.2	52%	0.519	50%	0.502	S	S	.	.	P	Polyproline II helix	trans	-87.5	121.5	170	-68.6	-76.6	0	0	0	110.5	R178 I219	R178-H221 PolarHBondContact NH2-O 2.96Å; I219-H221 VanDerWaalsContact CG2-CE1 3.47Å; I219-H221 WeakPolarHBondContact CG2-CE1 2.95Å; I219-H221 WeakPolarHBondContact CG2-NE2 3.41Å; I219-H221 PolarHBondContact O-N 3.44Å
222	R	61.6	Low	54.8	Low	101 Å²	101	93.1 Å²	93.1	38%	0.381	53%	0.525	S	S	.	.	P	Polyproline II helix	trans	-81.2	139.5	166.3	-70.2	-173.7	173.1	176.2	-1.1	110.4	N152 T155 E167 V224	N152-R222 PolarHBondContact OD1-N 3.45Å; T155-R222 PolarHBondContact OG1-NH2 2.78Å; E167-R222 IonicContact OE1-CZ 3.61Å; E167-R222 IonicContact OE1-NH2 3.3Å; E167-R222 PolarHBondContact OE1-NH2 3.37Å; R222-V224 PolarHBondContact O-N 2.86Å
223	P	59.2	Low	54.6	Low	40 Å²	40	89.2 Å²	89.2	26%	0.26	51%	0.513	S	S	.	.	P	Polyproline II helix	trans	-60.3	125.8	173.2	22.3	-31.4	0	0	0	109.4	S183 F225 P233	S183-P223 VanDerWaalsContact CB-CD 3.42Å; P223-F225 HydrophobicContact CB-CE2 4.01Å; P223-F225 HydrophobicContact CB-CZ 4.05Å; P223-F225 HydrophobicContact CG-CE2 3.74Å; P223-F225 HydrophobicContact CG-CZ 3.82Å; P223-F225 VanDerWaalsContact O-CD2 3.3Å; P223-F225 WeakPolarHBondContact O-CD2 3.29Å; P223-F225 WeakPolarHBondContact O-CE2 3.45Å; P223-P233 HydrophobicContact CB-CB 3.98Å
224	V	59.4	Low	54.7	Low	49 Å²	49	87.7 Å²	87.7	30%	0.297	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-78.2	127.2	170.9	176.1	0	0	0	0	106.2	F148 R222 P233 L234	F148-V224 HydrophobicContact CD1-CG2 3.84Å; F148-V224 HydrophobicContact CD2-CG2 4.1Å; F148-V224 HydrophobicContact CE1-CB 4.23Å; F148-V224 HydrophobicContact CE1-CG1 4.12Å; F148-V224 HydrophobicContact CE1-CG2 3.68Å; F148-V224 HydrophobicContact CE2-CG1 3.94Å; F148-V224 HydrophobicContact CE2-CG2 3.93Å; F148-V224 HydrophobicContact CG-CG2 4.04Å; F148-V224 HydrophobicContact CZ-CB 4.07Å; F148-V224 HydrophobicContact CZ-CG1 3.49Å; F148-V224 VanDerWaalsContact CZ-CG1 3.49Å; F148-V224 HydrophobicContact CZ-CG2 3.71Å; R222-V224 PolarHBondContact O-N 2.86Å; V224-P233 CarbonylContact O-C 3.58Å; V224-P233 WeakPolarHBondContact O-CA 3.22Å; V224-L234 HydrophobicContact CB-CB 4.33Å; V224-L234 HydrophobicContact CG1-CB 4.25Å; V224-L234 HydrophobicContact CG1-CD1 4Å; V224-L234 WeakPolarHBondContact O-CB 3.42Å; V224-L234 PolarHBondContact O-N 2.77Å
225	F	59.4	Low	54.7	Low	103 Å²	103	92.7 Å²	92.7	45%	0.452	51%	0.508	S	S	.	.	B	Isolated β-bridge	trans	-99.7	142.6	177.6	-66.9	-89.7	0	0	0	110.5	P223 Q227 G231 E232 P233	P223-F225 HydrophobicContact CB-CE2 4.01Å; P223-F225 HydrophobicContact CB-CZ 4.05Å; P223-F225 HydrophobicContact CG-CE2 3.74Å; P223-F225 HydrophobicContact CG-CZ 3.82Å; P223-F225 VanDerWaalsContact O-CD2 3.3Å; P223-F225 WeakPolarHBondContact O-CD2 3.29Å; P223-F225 WeakPolarHBondContact O-CE2 3.45Å; F225-Q227 PolarHBondContact O-N 2.84Å; F225-G231 WeakPolarHBondContact CD1-O 3.34Å; F225-G231 WeakPolarHBondContact CE1-O 3.04Å; F225-E232 WeakPolarHBondContact CA-O 3.39Å; F225-E232 VanDerWaalsContact CD1-C 3.46Å; F225-P233 HydrophobicContact CD1-CB 4.35Å; F225-P233 HydrophobicContact CE1-CB 4.15Å
226	C	53	Low	54.6	Low	29 Å²	29	91.3 Å²	91.3	20%	0.196	49%	0.49	C	S	.	.	P	Polyproline II helix	trans	-66.4	127.8	177.6	-172.9	0	0	0	0	110.4	G228 H229 E232 L234	C226-G228 PolarHBondContact O-N 3.28Å; C226-G228 PolarHBondContact SG-N 2.94Å; C226-H229 HydrophobicContact CB-CB 4Å; C226-H229 CarbonylContact O-C 3.51Å; C226-H229 PolarHBondContact O-N 2.97Å; C226-H229 PolarHBondContact SG-ND1 3.37Å; C226-E232 PolarHBondContact N-O 2.87Å; C226-L234 HydrophobicContact CB-CD1 4.28Å
227	Q	55.4	Low	54.3	Low	153 Å²	153	86.9 Å²	86.9	72%	0.715	46%	0.464	S	S	*	.	S	Bend	trans	-68.4	-24.3	176	-67.5	-173.1	-7.5	0	0	112.7	F225	F225-Q227 PolarHBondContact O-N 2.84Å
228	G	54.3	Low	53.9	Low	57 Å²	57	84.5 Å²	84.5	59%	0.588	45%	0.447	S	S	*	.	S	Bend	trans	-86.1	-24.1	175.9	0	0	0	0	0	114.5	C226	C226-G228 PolarHBondContact O-N 3.28Å; C226-G228 PolarHBondContact SG-N 2.94Å
229	H	51.9	Low	53.1	Low	86 Å²	86	85.1 Å²	85.1	40%	0.398	47%	0.465	S	S	.	.	S	Bend	trans	-122.1	94.6	-178.4	-52.1	102	0	0	0	109.4	C226 G231 E232	C226-H229 HydrophobicContact CB-CB 4Å; C226-H229 CarbonylContact O-C 3.51Å; C226-H229 PolarHBondContact O-N 2.97Å; C226-H229 PolarHBondContact SG-ND1 3.37Å; H229-G231 PolarHBondContact O-N 2.8Å; H229-E232 HydrophobicContact CB-CB 4.4Å; H229-E232 PolarHBondContact O-N 3.41Å
230	C	49.2	Very low	53.1	Low	136 Å²	136	83.4 Å²	83.4	92%	0.919	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	121.1	-174	-171.2	0	0	0	0	111.6
231	G	53.6	Low	52.4	Low	55 Å²	55	88.1 Å²	88.1	57%	0.567	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.3	-7.4	174	0	0	0	0	0	115.6	F225 H229	F225-G231 WeakPolarHBondContact CD1-O 3.34Å; F225-G231 WeakPolarHBondContact CE1-O 3.04Å; H229-G231 PolarHBondContact O-N 2.8Å
232	E	52.6	Low	51.6	Low	129 Å²	129	89.7 Å²	89.7	60%	0.603	51%	0.511	S	S	*	.			trans	-90.9	123.3	177.3	-65.4	-141.4	149.9	0	0	112	F225 C226 H229	F225-E232 WeakPolarHBondContact CA-O 3.39Å; F225-E232 VanDerWaalsContact CD1-C 3.46Å; C226-E232 PolarHBondContact N-O 2.87Å; H229-E232 HydrophobicContact CB-CB 4.4Å; H229-E232 PolarHBondContact O-N 3.41Å
233	P	55.3	Low	50.8	Low	49 Å²	49	92.6 Å²	92.6	32%	0.318	53%	0.529	S	S	.	.	B	Isolated β-bridge	trans	-64.8	138.2	170.7	28	-32	0	0	0	108.7	P223 V224 F225 K235	P223-P233 HydrophobicContact CB-CB 3.98Å; V224-P233 CarbonylContact O-C 3.58Å; V224-P233 WeakPolarHBondContact O-CA 3.22Å; F225-P233 HydrophobicContact CD1-CB 4.35Å; F225-P233 HydrophobicContact CE1-CB 4.15Å; P233-K235 VanDerWaalsContact C-N 3.34Å; P233-K235 WeakPolarHBondContact O-CG 3.34Å; P233-K235 PolarHBondContact O-N 2.87Å
234	L	54.5	Low	49.9	Very low	97 Å²	97	98.8 Å²	98.8	51%	0.508	56%	0.555	S	S	.	*			trans	-67.6	92	-179.5	-135.1	142.7	0	0	0	107.8	V224 C226	V224-L234 HydrophobicContact CB-CB 4.33Å; V224-L234 HydrophobicContact CG1-CB 4.25Å; V224-L234 HydrophobicContact CG1-CD1 4Å; V224-L234 WeakPolarHBondContact O-CB 3.42Å; V224-L234 PolarHBondContact O-N 2.77Å; C226-L234 HydrophobicContact CB-CD1 4.28Å
235	K	52.8	Low	49.1	Very low	155 Å²	155	100 Å²	100	67%	0.674	56%	0.559	S	S	*	*			trans	-86.8	-32.2	179.5	-69.2	175.2	-175.3	178.6	0	112	P233	P233-K235 VanDerWaalsContact C-N 3.34Å; P233-K235 WeakPolarHBondContact O-CG 3.34Å; P233-K235 PolarHBondContact O-N 2.87Å
236	Y	45.2	Very low	48.4	Very low	143 Å²	143	102.6 Å²	102.6	56%	0.561	58%	0.577	S	S	*	*	S	Bend	trans	-141.8	150.9	-172.2	-55.6	-67.9	0	0	0	111.7	N248	Y236-N248 HydrophobicContact CE1-CB 4.34Å
237	F	38.4	Very low	47.8	Very low	50 Å²	50	109.3 Å²	109.3	22%	0.219	61%	0.605	C	S	.	*			trans	-64.9	132.6	176.1	158.7	-121.3	0	0	0	111.4	N242 E243 L245	F237-N242 VanDerWaalsContact CE2-C 3.5Å; F237-E243 WeakPolarHBondContact CB-O 3.37Å; F237-E243 VanDerWaalsContact CD1-C 3.42Å; F237-E243 WeakPolarHBondContact CD1-O 3.49Å; F237-E243 HydrophobicContact CD2-CB 3.78Å; F237-E243 WeakPolarHBondContact CD2-O 3.36Å; F237-E243 VanDerWaalsContact CE1-C 3.45Å; F237-E243 HydrophobicContact CE2-CB 3.94Å; F237-E243 WeakPolarHBondContact CE2-O 3.35Å; F237-E243 WeakPolarHBondContact CG-O 3.3Å; F237-L245 HydrophobicContact CB-CD1 4.25Å; F237-L245 HydrophobicContact CB-CG 3.95Å; F237-L245 HydrophobicContact CD1-CB 3.52Å; F237-L245 HydrophobicContact CD1-CD1 3.49Å; F237-L245 VanDerWaalsContact CD1-CD1 3.49Å; F237-L245 HydrophobicContact CD1-CG 3.46Å; F237-L245 VanDerWaalsContact CD1-CG 3.46Å; F237-L245 VanDerWaalsContact CD1-N 3.35Å; F237-L245 HydrophobicContact CE1-CB 4.15Å; F237-L245 HydrophobicContact CE1-CD1 4.2Å; F237-L245 HydrophobicContact CE1-CG 4.42Å; F237-L245 HydrophobicContact CG-CD1 4.15Å; F237-L245 HydrophobicContact CG-CG 4.12Å; F237-L245 WeakPolarHBondContact O-CD1 3.45Å
238	C	43.3	Very low	47.5	Very low	54 Å²	54	106.4 Å²	106.4	37%	0.365	59%	0.594	S	S	.	*			trans	-100	123.7	176.8	177.4	0	0	0	0	109.7	A240 C241 N242	C238-A240 PolarHBondContact O-N 2.81Å; C238-C241 WeakPolarHBondContact O-CA 3.34Å; C238-C241 PolarHBondContact O-N 2.87Å; C238-N242 PolarHBondContact O-N 3.4Å
239	A	38.5	Very low	47.2	Very low	84 Å²	84	106 Å²	106	69%	0.694	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64	-20.7	-179.9	0	0	0	0	0	114.3	C241	A239-C241 PolarHBondContact O-N 2.92Å
240	A	54.1	Low	47	Very low	69 Å²	69	105.1 Å²	105.1	57%	0.57	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	-20.6	167	0	0	0	0	0	112.3	C238	C238-A240 PolarHBondContact O-N 2.81Å
241	C	47.9	Very low	47.2	Very low	100 Å²	100	104.7 Å²	104.7	68%	0.676	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.8	-30.9	-179.8	47.2	0	0	0	0	118.6	C238 A239	C238-C241 WeakPolarHBondContact O-CA 3.34Å; C238-C241 PolarHBondContact O-N 2.87Å; A239-C241 PolarHBondContact O-N 2.92Å
242	N	43.5	Very low	47.4	Very low	144 Å²	144	105.6 Å²	105.6	77%	0.77	57%	0.573	S	S	*	*			trans	55.6	81.4	-173.3	-151.6	36.9	0	0	0	119.5	F237 C238	F237-N242 VanDerWaalsContact CE2-C 3.5Å; C238-N242 PolarHBondContact O-N 3.4Å
243	E	45.1	Very low	48.1	Very low	162 Å²	162	103.1 Å²	103.1	76%	0.757	57%	0.567	S	S	*	*	S	Bend	trans	-173.5	71.7	177.9	-78.5	-157	161	0	0	114.4	F237	F237-E243 WeakPolarHBondContact CB-O 3.37Å; F237-E243 VanDerWaalsContact CD1-C 3.42Å; F237-E243 WeakPolarHBondContact CD1-O 3.49Å; F237-E243 HydrophobicContact CD2-CB 3.78Å; F237-E243 WeakPolarHBondContact CD2-O 3.36Å; F237-E243 VanDerWaalsContact CE1-C 3.45Å; F237-E243 HydrophobicContact CE2-CB 3.94Å; F237-E243 WeakPolarHBondContact CE2-O 3.35Å; F237-E243 WeakPolarHBondContact CG-O 3.3Å
244	E	40.1	Very low	48.9	Very low	171 Å²	171	106.2 Å²	106.2	80%	0.799	58%	0.581	S	S	*	*			trans	49	113	154	-141.5	154.9	-131.1	0	0	123.6
245	L	44.2	Very low	49.8	Very low	75 Å²	75	104.1 Å²	104.1	39%	0.393	58%	0.577	S	S	.	*			trans	-133.5	142.1	179.3	-108.4	159.2	0	0	0	109	F237	F237-L245 HydrophobicContact CB-CD1 4.25Å; F237-L245 HydrophobicContact CB-CG 3.95Å; F237-L245 HydrophobicContact CD1-CB 3.52Å; F237-L245 HydrophobicContact CD1-CD1 3.49Å; F237-L245 VanDerWaalsContact CD1-CD1 3.49Å; F237-L245 HydrophobicContact CD1-CG 3.46Å; F237-L245 VanDerWaalsContact CD1-CG 3.46Å; F237-L245 VanDerWaalsContact CD1-N 3.35Å; F237-L245 HydrophobicContact CE1-CB 4.15Å; F237-L245 HydrophobicContact CE1-CD1 4.2Å; F237-L245 HydrophobicContact CE1-CG 4.42Å; F237-L245 HydrophobicContact CG-CD1 4.15Å; F237-L245 HydrophobicContact CG-CG 4.12Å; F237-L245 WeakPolarHBondContact O-CD1 3.45Å
246	L	43.1	Very low	50.7	Low	157 Å²	157	104.5 Å²	104.5	82%	0.822	58%	0.575	S	S	*	*			trans	-156.1	-17.5	152.2	-115.4	135.3	0	0	0	120.3
247	Q	42.1	Very low	52.4	Low	170 Å²	170	100.4 Å²	100.4	79%	0.794	57%	0.565	S	S	*	*	S	Bend	trans	-104	-24	-170.4	-147.1	63.1	30.6	0	0	117.7
248	N	48.3	Very low	54.3	Low	91 Å²	91	102.1 Å²	102.1	49%	0.487	57%	0.573	S	S	.	*	S	Bend	trans	-98.7	1.3	-175.9	-72.5	-18	0	0	0	115.4	Y236 A250 N251 D252	Y236-N248 HydrophobicContact CE1-CB 4.34Å; N248-A250 PolarHBondContact O-N 2.65Å; N248-N251 PolarHBondContact O-N 3.12Å; N248-D252 PolarHBondContact O-N 2.81Å
249	A	46.8	Very low	55.8	Low	48 Å²	48	105.3 Å²	105.3	40%	0.397	59%	0.586	S	S	.	*	H	α-helix	trans	-61.9	-26.4	-178.9	0	0	0	0	0	113.4	D252 V253	A249-D252 PolarHBondContact O-N 3.03Å; A249-V253 WeakPolarHBondContact O-CB 3.31Å; A249-V253 WeakPolarHBondContact O-CG2 3.32Å; A249-V253 PolarHBondContact O-N 3.03Å
250	A	48.1	Very low	57.7	Low	68 Å²	68	106.2 Å²	106.2	56%	0.562	58%	0.578	S	S	*	*	H	α-helix	trans	-65.7	-43.8	-178.8	0	0	0	0	0	112.9	N248 V253	N248-A250 PolarHBondContact O-N 2.65Å; A250-V253 PolarHBondContact O-N 2.84Å
251	N	53.1	Low	59.2	Low	128 Å²	128	110.3 Å²	110.3	68%	0.684	58%	0.579	S	S	*	*	H	α-helix	trans	-76.3	-28	-180	-65.7	-16	0	0	0	112.1	N248 A255	N248-N251 PolarHBondContact O-N 3.12Å; N251-A255 PolarHBondContact O-N 3.31Å
252	D	59.2	Low	60.9	Low	73 Å²	73	109.8 Å²	109.8	39%	0.39	57%	0.57	S	S	.	*	H	α-helix	trans	-71.6	-34.9	174	-173.2	51.6	0	0	0	111.8	N248 A249 D254 A255 R256	N248-D252 PolarHBondContact O-N 2.81Å; A249-D252 PolarHBondContact O-N 3.03Å; D252-D254 VanDerWaalsContact C-N 3.35Å; D252-D254 PolarHBondContact O-N 2.67Å; D252-A255 PolarHBondContact O-N 2.75Å; D252-R256 WeakPolarHBondContact O-CB 3.49Å; D252-R256 VanDerWaalsContact O-CG 3.25Å; D252-R256 WeakPolarHBondContact O-CG 3.35Å; D252-R256 PolarHBondContact O-N 3.16Å; D252-R256 WeakPolarHBondContact OD2-CD 3.38Å; D252-R256 IonicContact OD2-NH1 3.94Å
253	V	66.5	Low	62.6	Low	77 Å²	77	107.5 Å²	107.5	47%	0.467	56%	0.557	S	S	.	*	H	α-helix	trans	-59.7	-45.3	175.6	167.4	0	0	0	0	110.8	A249 A250 A255 R256 V257	A249-V253 WeakPolarHBondContact O-CB 3.31Å; A249-V253 WeakPolarHBondContact O-CG2 3.32Å; A249-V253 PolarHBondContact O-N 3.03Å; A250-V253 PolarHBondContact O-N 2.84Å; V253-A255 PolarHBondContact O-N 2.94Å; V253-R256 PolarHBondContact O-N 2.88Å; V253-V257 HydrophobicContact CG1-CG2 4.12Å; V253-V257 VanDerWaalsContact O-CB 3.31Å; V253-V257 WeakPolarHBondContact O-CB 3.49Å; V253-V257 WeakPolarHBondContact O-CG2 3.38Å; V253-V257 PolarHBondContact O-N 2.83Å
254	D	72.7	Confident	64.5	Low	115 Å²	115	103.3 Å²	103.3	62%	0.615	54%	0.543	S	S	*	.	H	α-helix	trans	-63	-43	178.9	-74	-26.9	0	0	0	112	D252 V257 Q258	D252-D254 VanDerWaalsContact C-N 3.35Å; D252-D254 PolarHBondContact O-N 2.67Å; D254-V257 PolarHBondContact O-N 2.79Å; D254-Q258 WeakPolarHBondContact O-CB 3.29Å; D254-Q258 PolarHBondContact O-N 2.91Å
255	A	73.3	Confident	66.7	Low	52 Å²	52	100.2 Å²	100.2	43%	0.43	53%	0.528	S	S	.	.	H	α-helix	trans	-64.1	-42.7	176.7	0	0	0	0	0	112.2	N251 D252 V253 Q258 L259	N251-A255 PolarHBondContact O-N 3.31Å; D252-A255 PolarHBondContact O-N 2.75Å; V253-A255 PolarHBondContact O-N 2.94Å; A255-Q258 PolarHBondContact O-N 2.83Å; A255-L259 PolarHBondContact O-N 2.82Å
256	R	72.2	Confident	68.2	Low	164 Å²	164	98.9 Å²	98.9	62%	0.619	53%	0.528	S	S	*	.	H	α-helix	trans	-69.8	-36.7	178.2	-71.1	178.8	69.2	163.5	4.4	112.5	D252 V253 Q258 L259 L260	D252-R256 WeakPolarHBondContact O-CB 3.49Å; D252-R256 VanDerWaalsContact O-CG 3.25Å; D252-R256 WeakPolarHBondContact O-CG 3.35Å; D252-R256 PolarHBondContact O-N 3.16Å; D252-R256 WeakPolarHBondContact OD2-CD 3.38Å; D252-R256 IonicContact OD2-NH1 3.94Å; V253-R256 PolarHBondContact O-N 2.88Å; R256-Q258 VanDerWaalsContact C-N 3.32Å; R256-L259 PolarHBondContact O-N 2.78Å; R256-L260 WeakPolarHBondContact O-CB 3.45Å; R256-L260 PolarHBondContact O-N 3.24Å
257	V	79.1	Confident	69.9	Low	57 Å²	57	93.7 Å²	93.7	35%	0.345	50%	0.503	S	S	.	.	H	α-helix	trans	-65	-39.2	172.7	168.6	0	0	0	0	110.2	V253 D254 L260 R261	V253-V257 HydrophobicContact CG1-CG2 4.12Å; V253-V257 VanDerWaalsContact O-CB 3.31Å; V253-V257 WeakPolarHBondContact O-CB 3.49Å; V253-V257 WeakPolarHBondContact O-CG2 3.38Å; V253-V257 PolarHBondContact O-N 2.83Å; D254-V257 PolarHBondContact O-N 2.79Å; V257-L260 PolarHBondContact O-N 2.95Å; V257-R261 WeakPolarHBondContact O-CG 3.42Å; V257-R261 PolarHBondContact O-N 3.46Å
258	Q	79.9	Confident	71.9	Confident	86 Å²	86	92.2 Å²	92.2	40%	0.402	49%	0.49	S	S	.	.	H	α-helix	trans	-67.1	-46.2	176	-170	57.5	38.6	0	0	111.9	D254 A255 R256 L260 R261 D262	D254-Q258 WeakPolarHBondContact O-CB 3.29Å; D254-Q258 PolarHBondContact O-N 2.91Å; A255-Q258 PolarHBondContact O-N 2.83Å; R256-Q258 VanDerWaalsContact C-N 3.32Å; Q258-L260 VanDerWaalsContact C-N 3.26Å; Q258-L260 PolarHBondContact O-N 3.01Å; Q258-R261 WeakPolarHBondContact O-CB 3.44Å; Q258-R261 PolarHBondContact O-N 3.26Å; Q258-D262 PolarHBondContact NE2-OD1 2.78Å; Q258-D262 VanDerWaalsContact O-CG 3.26Å; Q258-D262 PolarHBondContact O-N 3.07Å
259	L	74.5	Confident	73.5	Confident	121 Å²	121	91 Å²	91	63%	0.634	49%	0.488	S	S	*	.	H	α-helix	trans	-55.3	-41.3	172.3	-92.1	157.2	0	0	0	112.3	A255 R256 N263	A255-L259 PolarHBondContact O-N 2.82Å; R256-L259 PolarHBondContact O-N 2.78Å; L259-N263 VanDerWaalsContact O-CB 3.3Å; L259-N263 WeakPolarHBondContact O-CB 3.37Å; L259-N263 PolarHBondContact O-N 3.26Å
260	L	78.5	Confident	74.8	Confident	102 Å²	102	94.7 Å²	94.7	53%	0.534	50%	0.498	S	S	.	.	H	α-helix	trans	-64.4	-42.8	174.9	178.4	63	0	0	0	111.6	R256 V257 Q258 N263 V264	R256-L260 WeakPolarHBondContact O-CB 3.45Å; R256-L260 PolarHBondContact O-N 3.24Å; V257-L260 PolarHBondContact O-N 2.95Å; Q258-L260 VanDerWaalsContact C-N 3.26Å; Q258-L260 PolarHBondContact O-N 3.01Å; L260-N263 PolarHBondContact O-N 3.16Å; L260-V264 HydrophobicContact CD1-CG2 4.16Å; L260-V264 HydrophobicContact CG-CG2 4.39Å; L260-V264 WeakPolarHBondContact O-CB 3.45Å; L260-V264 WeakPolarHBondContact O-CG2 3.42Å; L260-V264 PolarHBondContact O-N 2.83Å
261	R	85.3	Confident	76.2	Confident	156 Å²	156	95.7 Å²	95.7	59%	0.589	49%	0.492	S	S	*	.	H	α-helix	trans	-62.6	-44.7	177	-75.1	173.9	-178.9	172.8	1.9	111.8	V257 Q258 N263 V264 E265	V257-R261 WeakPolarHBondContact O-CG 3.42Å; V257-R261 PolarHBondContact O-N 3.46Å; Q258-R261 WeakPolarHBondContact O-CB 3.44Å; Q258-R261 PolarHBondContact O-N 3.26Å; R261-N263 VanDerWaalsContact C-N 3.33Å; R261-N263 PolarHBondContact O-N 3.38Å; R261-V264 PolarHBondContact O-N 3.38Å; R261-E265 PolarHBondContact O-N 3.44Å
262	D	84	Confident	77.8	Confident	89 Å²	89	94.8 Å²	94.8	48%	0.476	48%	0.484	S	S	.	.	H	α-helix	trans	-64.1	-41.5	178.7	-62.1	-17.8	0	0	0	110.6	Q258 E265 A266	Q258-D262 PolarHBondContact NE2-OD1 2.78Å; Q258-D262 VanDerWaalsContact O-CG 3.26Å; Q258-D262 PolarHBondContact O-N 3.07Å; D262-E265 PolarHBondContact O-N 3.12Å; D262-A266 WeakPolarHBondContact O-CB 3.22Å; D262-A266 PolarHBondContact O-N 2.98Å
263	N	78	Confident	78.6	Confident	95 Å²	95	96.5 Å²	96.5	51%	0.508	49%	0.49	S	S	.	.	H	α-helix	trans	-63.8	-43.8	173.6	-173.7	29	0	0	0	112.2	L259 L260 R261 E265 A266 V267	L259-N263 VanDerWaalsContact O-CB 3.3Å; L259-N263 WeakPolarHBondContact O-CB 3.37Å; L259-N263 PolarHBondContact O-N 3.26Å; L260-N263 PolarHBondContact O-N 3.16Å; R261-N263 VanDerWaalsContact C-N 3.33Å; R261-N263 PolarHBondContact O-N 3.38Å; N263-E265 VanDerWaalsContact C-N 3.29Å; N263-E265 PolarHBondContact O-N 3.29Å; N263-A266 PolarHBondContact O-N 3.46Å; N263-V267 VanDerWaalsContact O-CG2 3.31Å; N263-V267 WeakPolarHBondContact O-CG2 3.39Å; N263-V267 PolarHBondContact O-N 2.9Å
264	V	84.8	Confident	79.1	Confident	74 Å²	74	94.3 Å²	94.3	45%	0.448	48%	0.475	S	S	.	.	H	α-helix	trans	-62.2	-38.1	176.8	167	0	0	0	0	111.3	L260 R261 R268	L260-V264 HydrophobicContact CD1-CG2 4.16Å; L260-V264 HydrophobicContact CG-CG2 4.39Å; L260-V264 WeakPolarHBondContact O-CB 3.45Å; L260-V264 WeakPolarHBondContact O-CG2 3.42Å; L260-V264 PolarHBondContact O-N 2.83Å; R261-V264 PolarHBondContact O-N 3.38Å; V264-R268 VanDerWaalsContact O-CB 3.3Å; V264-R268 WeakPolarHBondContact O-CB 3.3Å; V264-R268 PolarHBondContact O-N 3.11Å
265	E	86.9	Confident	79.4	Confident	107 Å²	107	93.6 Å²	93.6	50%	0.5	47%	0.466	S	S	.	.	H	α-helix	trans	-70.7	-37.6	177.3	-167.2	58.5	-151.8	0	0	112.2	R261 D262 N263 R268 S269	R261-E265 PolarHBondContact O-N 3.44Å; D262-E265 PolarHBondContact O-N 3.12Å; N263-E265 VanDerWaalsContact C-N 3.29Å; N263-E265 PolarHBondContact O-N 3.29Å; E265-R268 PolarHBondContact O-N 3.47Å; E265-R268 IonicContact OE2-NE 3.91Å; E265-S269 PolarHBondContact O-N 3.26Å; E265-S269 PolarHBondContact O-OG 2.9Å
266	A	75.9	Confident	79.9	Confident	47 Å²	47	95.5 Å²	95.5	39%	0.388	47%	0.466	S	S	.	.	H	α-helix	trans	-61.7	-49.9	171.7	0	0	0	0	0	111.3	D262 N263 R268 S269 E270	D262-A266 WeakPolarHBondContact O-CB 3.22Å; D262-A266 PolarHBondContact O-N 2.98Å; N263-A266 PolarHBondContact O-N 3.46Å; A266-R268 VanDerWaalsContact C-N 3.33Å; A266-R268 PolarHBondContact O-N 2.96Å; A266-S269 WeakPolarHBondContact O-CB 3.36Å; A266-S269 PolarHBondContact O-N 3.27Å; A266-S269 VanDerWaalsContact O-N 3.12Å; A266-E270 WeakPolarHBondContact O-CG 3.21Å; A266-E270 PolarHBondContact O-N 2.98Å
267	V	78.1	Confident	80	Confident	48 Å²	48	88.8 Å²	88.8	29%	0.291	44%	0.444	S	S	.	.	H	α-helix	trans	-61.6	-39.8	177	172.2	0	0	0	0	111.5	N263 S269 E270 I271	N263-V267 VanDerWaalsContact O-CG2 3.31Å; N263-V267 WeakPolarHBondContact O-CG2 3.39Å; N263-V267 PolarHBondContact O-N 2.9Å; V267-S269 VanDerWaalsContact C-N 3.33Å; V267-S269 PolarHBondContact O-N 3.09Å; V267-E270 PolarHBondContact O-N 3.29Å; V267-I271 HydrophobicContact CG1-CD1 3.99Å; V267-I271 VanDerWaalsContact O-CG1 3.29Å; V267-I271 WeakPolarHBondContact O-CG1 3.45Å; V267-I271 PolarHBondContact O-N 2.87Å
268	R	84	Confident	79.8	Confident	139 Å²	139	86.5 Å²	86.5	53%	0.525	43%	0.43	S	S	.	.	H	α-helix	trans	-59.5	-45.1	174.2	178.8	-174.1	-69.5	-84.5	-1.3	111.1	V264 E265 A266 E270 I271 E272	V264-R268 VanDerWaalsContact O-CB 3.3Å; V264-R268 WeakPolarHBondContact O-CB 3.3Å; V264-R268 PolarHBondContact O-N 3.11Å; E265-R268 PolarHBondContact O-N 3.47Å; E265-R268 IonicContact OE2-NE 3.91Å; A266-R268 VanDerWaalsContact C-N 3.33Å; A266-R268 PolarHBondContact O-N 2.96Å; R268-E270 VanDerWaalsContact C-N 3.34Å; R268-I271 PolarHBondContact O-N 3.27Å; R268-E272 WeakPolarHBondContact O-CG 3.49Å; R268-E272 PolarHBondContact O-N 3.4Å
269	S	81.6	Confident	79.9	Confident	65 Å²	65	84.8 Å²	84.8	46%	0.455	42%	0.424	S	S	.	.	H	α-helix	trans	-62.8	-41.2	178.3	-60.6	0	0	0	0	111.8	E265 A266 V267 I271 E272 E273	E265-S269 PolarHBondContact O-N 3.26Å; E265-S269 PolarHBondContact O-OG 2.9Å; A266-S269 WeakPolarHBondContact O-CB 3.36Å; A266-S269 PolarHBondContact O-N 3.27Å; A266-S269 VanDerWaalsContact O-N 3.12Å; V267-S269 VanDerWaalsContact C-N 3.33Å; V267-S269 PolarHBondContact O-N 3.09Å; S269-I271 PolarHBondContact O-N 2.96Å; S269-E272 PolarHBondContact O-N 3.47Å; S269-E273 WeakPolarHBondContact O-CB 3.26Å; S269-E273 PolarHBondContact O-N 2.84Å
270	E	75.9	Confident	80	Confident	126 Å²	126	83 Å²	83	59%	0.589	41%	0.412	S	S	*	.	H	α-helix	trans	-62.7	-39.4	174.8	-70.8	178.1	-163.9	0	0	112.4	A266 V267 R268 H274	A266-E270 WeakPolarHBondContact O-CG 3.21Å; A266-E270 PolarHBondContact O-N 2.98Å; V267-E270 PolarHBondContact O-N 3.29Å; R268-E270 VanDerWaalsContact C-N 3.34Å; E270-H274 VanDerWaalsContact O-CB 3.31Å; E270-H274 WeakPolarHBondContact O-CB 2.97Å; E270-H274 PolarHBondContact O-N 3.24Å
271	I	77.6	Confident	79.7	Confident	88 Å²	88	78.9 Å²	78.9	45%	0.451	39%	0.392	S	S	.	.	H	α-helix	trans	-63.9	-45.5	176.1	-69.3	165.7	0	0	0	110.9	V267 R268 S269 H274 F275	V267-I271 HydrophobicContact CG1-CD1 3.99Å; V267-I271 VanDerWaalsContact O-CG1 3.29Å; V267-I271 WeakPolarHBondContact O-CG1 3.45Å; V267-I271 PolarHBondContact O-N 2.87Å; R268-I271 PolarHBondContact O-N 3.27Å; S269-I271 PolarHBondContact O-N 2.96Å; I271-H274 PolarHBondContact O-N 3.4Å; I271-F275 WeakPolarHBondContact O-CB 3.41Å; I271-F275 PolarHBondContact O-N 3.36Å
272	E	84.9	Confident	79.3	Confident	109 Å²	109	75.1 Å²	75.1	51%	0.509	38%	0.383	S	S	.	.	H	α-helix	trans	-65.9	-41	178.9	-68.7	-69	167	0	0	111.7	R268 S269 F275 E276	R268-E272 WeakPolarHBondContact O-CG 3.49Å; R268-E272 PolarHBondContact O-N 3.4Å; S269-E272 PolarHBondContact O-N 3.47Å; E272-F275 PolarHBondContact O-N 2.9Å; E272-E276 PolarHBondContact O-N 2.88Å
273	E	77.7	Confident	79.2	Confident	110 Å²	110	75.5 Å²	75.5	51%	0.514	38%	0.378	S	S	.	.	H	α-helix	trans	-61.7	-46.2	174	-174.8	-179.1	173.3	0	0	111.2	S269 F275 E276 C277	S269-E273 WeakPolarHBondContact O-CB 3.26Å; S269-E273 PolarHBondContact O-N 2.84Å; E273-F275 VanDerWaalsContact C-N 3.31Å; E273-F275 PolarHBondContact O-N 3.07Å; E273-E276 PolarHBondContact O-N 3.43Å; E273-C277 WeakPolarHBondContact O-CB 3.34Å; E273-C277 PolarHBondContact O-N 2.9Å; E273-C277 PolarHBondContact O-SG 3.44Å; E273-C277 VanDerWaalsContact O-SG 3.34Å
274	H	76	Confident	79.1	Confident	31 Å²	31	74.5 Å²	74.5	14%	0.144	37%	0.373	C	S	.	.	H	α-helix	trans	-61.2	-40	176.5	-176.7	47.2	0	0	0	112.2	E270 I271 C277 C278 L380 F381 Y494 K495	E270-H274 VanDerWaalsContact O-CB 3.31Å; E270-H274 WeakPolarHBondContact O-CB 2.97Å; E270-H274 PolarHBondContact O-N 3.24Å; I271-H274 PolarHBondContact O-N 3.4Å; H274-C277 WeakPolarHBondContact O-CB 3.46Å; H274-C277 PolarHBondContact O-N 2.9Å; H274-C278 PolarHBondContact CE1-SG 3.34Å; H274-C278 WeakPolarHBondContact O-CB 3.46Å; H274-C278 PolarHBondContact O-N 3.42Å; H274-C278 PolarHBondContact O-SG 3.3Å; H274-L380 PolarHBondContact NE2-O 3.41Å; H274-F381 AromaticContact CD2-CD1 3.61Å; H274-F381 AromaticContact CD2-CE1 3.42Å; H274-F381 VanDerWaalsContact CD2-CE1 3.42Å; H274-F381 WeakPolarHBondContact CD2-CE1 3.31Å; H274-Y494 AromaticContact CE1-CD1 3.86Å; H274-Y494 AromaticContact CE1-CE1 3.61Å; H274-Y494 AromaticContact ND1-CD1 3.77Å; H274-Y494 AromaticContact ND1-CE1 3.28Å; H274-Y494 VanDerWaalsContact ND1-CE1 3.28Å; H274-Y494 WeakPolarHBondContact ND1-CE1 3.22Å; H274-K495 PolarHBondContact CE1-O 3.17Å
275	F	79.2	Confident	78.5	Confident	99 Å²	99	72.9 Å²	72.9	43%	0.434	37%	0.367	S	S	.	.	H	α-helix	trans	-60.7	-48.3	175.9	177.3	-96	0	0	0	111.7	I271 E272 E273 C277 C278 L279 F381	I271-F275 WeakPolarHBondContact O-CB 3.41Å; I271-F275 PolarHBondContact O-N 3.36Å; E272-F275 PolarHBondContact O-N 2.9Å; E273-F275 VanDerWaalsContact C-N 3.31Å; E273-F275 PolarHBondContact O-N 3.07Å; F275-C277 VanDerWaalsContact C-N 3.33Å; F275-C277 PolarHBondContact O-N 3.43Å; F275-C278 PolarHBondContact O-N 2.98Å; F275-L279 WeakPolarHBondContact O-CB 3.41Å; F275-L279 PolarHBondContact O-N 3.47Å; F275-F381 HydrophobicContact CB-CE1 4.33Å; F275-F381 HydrophobicContact CB-CZ 4.21Å; F275-F381 AromaticContact CD2-CZ 3.93Å; F275-F381 HydrophobicContact CD2-CZ 3.93Å
276	E	84.1	Confident	78.3	Confident	92 Å²	92	74.3 Å²	74.3	43%	0.43	37%	0.368	S	S	.	.	H	α-helix	trans	-67.7	-34	178	-77.8	-56	-106.3	0	0	113.2	E272 E273 L279 Q280	E272-E276 PolarHBondContact O-N 2.88Å; E273-E276 PolarHBondContact O-N 3.43Å; E276-L279 PolarHBondContact O-N 2.87Å; E276-L279 WeakPolarHBondContact OE2-CD2 3.36Å; E276-Q280 WeakPolarHBondContact O-CB 3.38Å; E276-Q280 PolarHBondContact O-N 3.01Å
277	C	73.7	Confident	78.6	Confident	24 Å²	24	74.9 Å²	74.9	16%	0.162	37%	0.365	C	S	.	.	H	α-helix	trans	-60.5	-46.8	170.4	-77.1	0	0	0	0	112.4	E273 H274 F275 Q280 A281 C458 Y494	E273-C277 WeakPolarHBondContact O-CB 3.34Å; E273-C277 PolarHBondContact O-N 2.9Å; E273-C277 PolarHBondContact O-SG 3.44Å; E273-C277 VanDerWaalsContact O-SG 3.34Å; H274-C277 WeakPolarHBondContact O-CB 3.46Å; H274-C277 PolarHBondContact O-N 2.9Å; F275-C277 VanDerWaalsContact C-N 3.33Å; F275-C277 PolarHBondContact O-N 3.43Å; C277-Q280 PolarHBondContact O-N 2.71Å; C277-A281 WeakPolarHBondContact O-CB 3.38Å; C277-A281 PolarHBondContact O-N 2.71Å; C277-C458 HydrophobicContact CB-CB 3.35Å; C277-C458 WeakPolarHBondContact CB-SG 3.44Å; C277-C458 WeakPolarHBondContact SG-CB 2.96Å; C277-C458 CovalentContact SG-SG 2.02Å; C277-C458 PolarHBondContact SG-SG 2.9Å; C277-Y494 HydrophobicContact CB-CD1 4.28Å
278	C	75.2	Confident	78.4	Confident	8 Å²	8	76.6 Å²	76.6	5%	0.054	37%	0.372	C	S	.	.	H	α-helix	trans	-61.8	-44.3	175.9	-71.5	0	0	0	0	111.6	H274 F275 Q280 A281 I282	H274-C278 PolarHBondContact CE1-SG 3.34Å; H274-C278 WeakPolarHBondContact O-CB 3.46Å; H274-C278 PolarHBondContact O-N 3.42Å; H274-C278 PolarHBondContact O-SG 3.3Å; F275-C278 PolarHBondContact O-N 2.98Å; C278-Q280 VanDerWaalsContact C-N 3.34Å; C278-Q280 PolarHBondContact O-N 2.99Å; C278-A281 PolarHBondContact O-N 2.91Å; C278-I282 WeakPolarHBondContact O-CG1 3.43Å; C278-I282 PolarHBondContact O-N 2.93Å
279	L	81.8	Confident	78.1	Confident	50 Å²	50	73.1 Å²	73.1	26%	0.262	37%	0.366	S	S	.	.	H	α-helix	trans	-62.9	-42	178.4	-174.3	64.4	0	0	0	111.4	F275 E276 A281 I282 R283	F275-L279 WeakPolarHBondContact O-CB 3.41Å; F275-L279 PolarHBondContact O-N 3.47Å; E276-L279 PolarHBondContact O-N 2.87Å; E276-L279 WeakPolarHBondContact OE2-CD2 3.36Å; L279-A281 VanDerWaalsContact C-N 3.35Å; L279-I282 PolarHBondContact O-N 2.96Å; L279-R283 VanDerWaalsContact CD2-NH2 3.27Å; L279-R283 WeakPolarHBondContact O-CG 3.41Å; L279-R283 PolarHBondContact O-N 3.41Å
280	Q	77.7	Confident	78.4	Confident	85 Å²	85	74 Å²	74	40%	0.397	37%	0.365	S	S	.	.	H	α-helix	trans	-65.3	-39.4	176.8	-169.7	57	42.8	0	0	111.8	E276 C277 C278 I282 R283 N284	E276-Q280 WeakPolarHBondContact O-CB 3.38Å; E276-Q280 PolarHBondContact O-N 3.01Å; C277-Q280 PolarHBondContact O-N 2.71Å; C278-Q280 VanDerWaalsContact C-N 3.34Å; C278-Q280 PolarHBondContact O-N 2.99Å; Q280-I282 VanDerWaalsContact C-N 3.34Å; Q280-I282 PolarHBondContact O-N 3.41Å; Q280-R283 PolarHBondContact O-N 3.31Å; Q280-N284 PolarHBondContact NE2-OD1 3.05Å; Q280-N284 PolarHBondContact O-N 3.06Å; Q280-N284 PolarHBondContact O-ND2 2.62Å; Q280-N284 PolarHBondContact O-OD1 3.5Å
281	A	71.4	Confident	78.6	Confident	14 Å²	14	72.4 Å²	72.4	12%	0.116	36%	0.358	C	S	.	.	H	α-helix	trans	-61.8	-41.3	174.5	0	0	0	0	0	111.9	C277 C278 L279 N284 A285 L493	C277-A281 WeakPolarHBondContact O-CB 3.38Å; C277-A281 PolarHBondContact O-N 2.71Å; C278-A281 PolarHBondContact O-N 2.91Å; L279-A281 VanDerWaalsContact C-N 3.35Å; A281-N284 PolarHBondContact O-N 3.47Å; A281-A285 PolarHBondContact O-N 3.28Å; A281-L493 HydrophobicContact CB-CD2 3.7Å
282	I	76.4	Confident	78.6	Confident	77 Å²	77	74.2 Å²	74.2	40%	0.395	36%	0.364	S	S	.	.	H	α-helix	trans	-64.6	-42.9	174.4	-67.1	166.6	0	0	0	111.2	C278 L279 Q280 N284 A285 R286 L377	C278-I282 WeakPolarHBondContact O-CG1 3.43Å; C278-I282 PolarHBondContact O-N 2.93Å; L279-I282 PolarHBondContact O-N 2.96Å; Q280-I282 VanDerWaalsContact C-N 3.34Å; Q280-I282 PolarHBondContact O-N 3.41Å; I282-N284 PolarHBondContact O-N 2.63Å; I282-A285 PolarHBondContact O-N 3.41Å; I282-R286 PolarHBondContact O-N 3.08Å; I282-L377 HydrophobicContact CD1-CD2 4.05Å
283	R	82.4	Confident	78.6	Confident	97 Å²	97	72.9 Å²	72.9	37%	0.366	36%	0.36	S	S	.	.	H	α-helix	trans	-59.7	-45.3	175.4	-73.1	170.8	178.4	163.5	2	111.5	L279 Q280 A285 R286 D287	L279-R283 VanDerWaalsContact CD2-NH2 3.27Å; L279-R283 WeakPolarHBondContact O-CG 3.41Å; L279-R283 PolarHBondContact O-N 3.41Å; Q280-R283 PolarHBondContact O-N 3.31Å; R283-A285 VanDerWaalsContact C-N 3.35Å; R283-A285 PolarHBondContact O-N 2.87Å; R283-R286 WeakPolarHBondContact O-CB 3.01Å; R283-R286 PolarHBondContact O-N 3.4Å; R283-D287 VanDerWaalsContact O-CG 3.28Å; R283-D287 PolarHBondContact O-N 3.38Å
284	N	75.1	Confident	79	Confident	75 Å²	75	73.4 Å²	73.4	40%	0.401	36%	0.363	S	S	.	.	H	α-helix	trans	-62.9	-41.2	177.1	-66.7	-12.9	0	0	0	111.7	Q280 A281 I282 R286 D287 N288	Q280-N284 PolarHBondContact NE2-OD1 3.05Å; Q280-N284 PolarHBondContact O-N 3.06Å; Q280-N284 PolarHBondContact O-ND2 2.62Å; Q280-N284 PolarHBondContact O-OD1 3.5Å; A281-N284 PolarHBondContact O-N 3.47Å; I282-N284 PolarHBondContact O-N 2.63Å; N284-R286 VanDerWaalsContact C-N 3.35Å; N284-R286 PolarHBondContact O-N 2.82Å; N284-D287 PolarHBondContact O-N 3.04Å; N284-N288 VanDerWaalsContact O-CG 3.3Å; N284-N288 PolarHBondContact O-N 2.83Å; N284-N288 PolarHBondContact O-ND2 3.27Å
285	A	73	Confident	79.4	Confident	40 Å²	40	79.4 Å²	79.4	33%	0.331	38%	0.384	S	S	.	.	H	α-helix	trans	-61.8	-41.6	176	0	0	0	0	0	112	A281 I282 R283 N288 V289 L493	A281-A285 PolarHBondContact O-N 3.28Å; I282-A285 PolarHBondContact O-N 3.41Å; R283-A285 VanDerWaalsContact C-N 3.35Å; R283-A285 PolarHBondContact O-N 2.87Å; A285-N288 PolarHBondContact O-N 3.22Å; A285-V289 WeakPolarHBondContact O-CG2 3.43Å; A285-V289 PolarHBondContact O-N 3.16Å; A285-V289 VanDerWaalsContact O-N 3.14Å; A285-L493 HydrophobicContact CB-CD2 4.44Å
286	R	83.2	Confident	79.5	Confident	137 Å²	137	77.2 Å²	77.2	52%	0.517	38%	0.379	S	S	.	.	H	α-helix	trans	-57.6	-50.5	172.1	175.6	-157.4	67.7	-164.6	-3.3	111	I282 R283 N284 N288 V289 L290	I282-R286 PolarHBondContact O-N 3.08Å; R283-R286 WeakPolarHBondContact O-CB 3.01Å; R283-R286 PolarHBondContact O-N 3.4Å; N284-R286 VanDerWaalsContact C-N 3.35Å; N284-R286 PolarHBondContact O-N 2.82Å; R286-N288 VanDerWaalsContact C-N 3.28Å; R286-N288 PolarHBondContact O-N 2.88Å; R286-V289 PolarHBondContact O-N 3.42Å; R286-V289 VanDerWaalsContact O-N 3.14Å; R286-L290 HydrophobicContact CG-CD1 4.09Å; R286-L290 HydrophobicContact CG-CG 4.5Å; R286-L290 WeakPolarHBondContact O-CG 3.31Å; R286-L290 PolarHBondContact O-N 3.11Å
287	D	82.1	Confident	79.6	Confident	59 Å²	59	78.4 Å²	78.4	32%	0.316	39%	0.385	S	S	.	.	H	α-helix	trans	-64	-35.6	-176	-64	-15.5	0	0	0	111.6	R283 N284 L290 Q291	R283-D287 VanDerWaalsContact O-CG 3.28Å; R283-D287 PolarHBondContact O-N 3.38Å; N284-D287 PolarHBondContact O-N 3.04Å; D287-L290 PolarHBondContact O-N 3.04Å; D287-Q291 WeakPolarHBondContact O-CG 3.46Å; D287-Q291 PolarHBondContact O-N 3.24Å
288	N	74.1	Confident	80.3	Confident	83 Å²	83	81.2 Å²	81.2	44%	0.444	40%	0.401	S	S	.	.	H	α-helix	trans	-62.6	-43.5	172.7	-73.1	-26.1	0	0	0	112.7	N284 A285 R286 L290 Q291 Q292	N284-N288 VanDerWaalsContact O-CG 3.3Å; N284-N288 PolarHBondContact O-N 2.83Å; N284-N288 PolarHBondContact O-ND2 3.27Å; A285-N288 PolarHBondContact O-N 3.22Å; R286-N288 VanDerWaalsContact C-N 3.28Å; R286-N288 PolarHBondContact O-N 2.88Å; N288-L290 VanDerWaalsContact C-N 3.32Å; N288-Q291 PolarHBondContact O-N 2.9Å; N288-Q292 PolarHBondContact O-N 3.25Å
289	V	77.9	Confident	80.7	Confident	66 Å²	66	85.7 Å²	85.7	40%	0.4	42%	0.424	S	S	.	.	H	α-helix	trans	-66.5	-36.7	177.2	174.7	0	0	0	0	111	A285 R286 Q292 L293 F366	A285-V289 WeakPolarHBondContact O-CG2 3.43Å; A285-V289 PolarHBondContact O-N 3.16Å; A285-V289 VanDerWaalsContact O-N 3.14Å; R286-V289 PolarHBondContact O-N 3.42Å; R286-V289 VanDerWaalsContact O-N 3.14Å; V289-Q292 PolarHBondContact O-N 2.96Å; V289-L293 PolarHBondContact O-N 3.3Å; V289-F366 HydrophobicContact CG1-CE2 4.15Å
290	L	86.5	Confident	80.8	Confident	84 Å²	84	84.6 Å²	84.6	44%	0.44	42%	0.42	S	S	.	.	H	α-helix	trans	-65.7	-43.8	174.8	-69	174.8	0	0	0	111.9	R286 D287 N288 Q292 L293 E294	R286-L290 HydrophobicContact CG-CD1 4.09Å; R286-L290 HydrophobicContact CG-CG 4.5Å; R286-L290 WeakPolarHBondContact O-CG 3.31Å; R286-L290 PolarHBondContact O-N 3.11Å; D287-L290 PolarHBondContact O-N 3.04Å; N288-L290 VanDerWaalsContact C-N 3.32Å; L290-Q292 VanDerWaalsContact C-N 3.27Å; L290-Q292 PolarHBondContact O-N 2.7Å; L290-L293 WeakPolarHBondContact O-CB 2.88Å; L290-L293 PolarHBondContact O-N 3.08Å; L290-L293 VanDerWaalsContact O-N 3.12Å; L290-E294 PolarHBondContact O-N 3.09Å
291	Q	80.8	Confident	81.3	Confident	93 Å²	93	85.4 Å²	85.4	44%	0.435	42%	0.423	S	S	.	.	H	α-helix	trans	-62.6	-35.2	173.4	-74.6	-177.3	11.6	0	0	112.4	D287 N288 L293 E294 R295	D287-Q291 WeakPolarHBondContact O-CG 3.46Å; D287-Q291 PolarHBondContact O-N 3.24Å; N288-Q291 PolarHBondContact O-N 2.9Å; Q291-L293 VanDerWaalsContact C-N 3.33Å; Q291-E294 PolarHBondContact O-N 3.5Å; Q291-R295 WeakPolarHBondContact O-CG 3.33Å; Q291-R295 PolarHBondContact O-N 2.96Å; Q291-R295 VanDerWaalsContact O-N 3.11Å
292	Q	76.6	Confident	82	Confident	125 Å²	125	86.4 Å²	86.4	58%	0.584	44%	0.436	S	S	*	.	H	α-helix	trans	-66.4	-37.5	174.5	-172.8	178.5	-2.5	0	0	111.7	N288 V289 L290 R295 T296	N288-Q292 PolarHBondContact O-N 3.25Å; V289-Q292 PolarHBondContact O-N 2.96Å; L290-Q292 VanDerWaalsContact C-N 3.27Å; L290-Q292 PolarHBondContact O-N 2.7Å; Q292-R295 PolarHBondContact O-N 2.99Å; Q292-T296 WeakPolarHBondContact O-CB 3.37Å; Q292-T296 PolarHBondContact O-N 3.46Å; Q292-T296 PolarHBondContact O-OG1 3.42Å
293	L	85	Confident	82.4	Confident	81 Å²	81	88.2 Å²	88.2	42%	0.424	44%	0.442	S	S	.	.	H	α-helix	trans	-61.2	-48.7	174.1	176.1	61.1	0	0	0	111.1	V289 L290 Q291 R295 T296 E297 I364	V289-L293 PolarHBondContact O-N 3.3Å; L290-L293 WeakPolarHBondContact O-CB 2.88Å; L290-L293 PolarHBondContact O-N 3.08Å; L290-L293 VanDerWaalsContact O-N 3.12Å; Q291-L293 VanDerWaalsContact C-N 3.33Å; L293-R295 VanDerWaalsContact C-N 3.34Å; L293-R295 PolarHBondContact O-N 2.72Å; L293-T296 PolarHBondContact O-N 2.02Å; L293-T296 VanDerWaalsContact O-N 3.16Å; L293-E297 WeakPolarHBondContact O-CB 3.48Å; L293-E297 PolarHBondContact O-N 3.3Å; L293-I364 HydrophobicContact CD1-CD1 4.5Å; L293-I364 HydrophobicContact CD1-CG2 3.66Å
294	E	87.6	Confident	82.6	Confident	121 Å²	121	86.6 Å²	86.6	57%	0.565	44%	0.44	S	S	*	.	H	α-helix	trans	-57.3	-45.1	177.4	-69.6	173.5	179.2	0	0	111.8	L290 Q291 T296 E297 T298	L290-E294 PolarHBondContact O-N 3.09Å; Q291-E294 PolarHBondContact O-N 3.5Å; E294-T296 PolarHBondContact O-N 3.34Å; E294-E297 WeakPolarHBondContact O-CB 3.02Å; E294-E297 PolarHBondContact O-N 3.1Å; E294-T298 WeakPolarHBondContact O-CG2 3.34Å; E294-T298 PolarHBondContact O-N 3.22Å; E294-T298 PolarHBondContact O-OG1 2.9Å
295	R	83.1	Confident	83.1	Confident	158 Å²	158	87.1 Å²	87.1	60%	0.596	44%	0.441	S	S	*	.	H	α-helix	trans	-61.9	-46.1	175.9	-69.4	175.4	-169.9	178.6	6.1	111.8	Q291 Q292 L293 E297 T298 D299	Q291-R295 WeakPolarHBondContact O-CG 3.33Å; Q291-R295 PolarHBondContact O-N 2.96Å; Q291-R295 VanDerWaalsContact O-N 3.11Å; Q292-R295 PolarHBondContact O-N 2.99Å; L293-R295 VanDerWaalsContact C-N 3.34Å; L293-R295 PolarHBondContact O-N 2.72Å; R295-E297 VanDerWaalsContact C-N 3.28Å; R295-E297 PolarHBondContact O-N 3.46Å; R295-T298 PolarHBondContact O-N 3.38Å; R295-T298 PolarHBondContact O-OG1 3.45Å; R295-D299 PolarHBondContact O-N 3.37Å
296	T	82.5	Confident	83.7	Confident	53 Å²	53	88.9 Å²	88.9	33%	0.325	44%	0.443	S	S	.	.	H	α-helix	trans	-63.1	-37.3	-180	-52.9	0	0	0	0	111.4	Q292 L293 E294 T300 I364	Q292-T296 WeakPolarHBondContact O-CB 3.37Å; Q292-T296 PolarHBondContact O-N 3.46Å; Q292-T296 PolarHBondContact O-OG1 3.42Å; L293-T296 PolarHBondContact O-N 2.02Å; L293-T296 VanDerWaalsContact O-N 3.16Å; E294-T296 PolarHBondContact O-N 3.34Å; T296-T300 VanDerWaalsContact O-CB 3.24Å; T296-T300 WeakPolarHBondContact O-CB 3.29Å; T296-T300 PolarHBondContact O-N 3.02Å; T296-T300 PolarHBondContact O-OG1 3.41Å; T296-I364 HydrophobicContact CG2-CD1 4Å; T296-I364 HydrophobicContact CG2-CG1 4.26Å; T296-I364 HydrophobicContact CG2-CG2 4.48Å
297	E	86.2	Confident	83.8	Confident	117 Å²	117	89.1 Å²	89.1	55%	0.547	44%	0.444	S	S	.	.	H	α-helix	trans	-59.8	-54.1	172.4	179.7	179.7	-166	0	0	110.7	L293 E294 R295 D299 T300 E301 I364	L293-E297 WeakPolarHBondContact O-CB 3.48Å; L293-E297 PolarHBondContact O-N 3.3Å; E294-E297 WeakPolarHBondContact O-CB 3.02Å; E294-E297 PolarHBondContact O-N 3.1Å; R295-E297 VanDerWaalsContact C-N 3.28Å; R295-E297 PolarHBondContact O-N 3.46Å; E297-D299 VanDerWaalsContact C-N 3.33Å; E297-D299 PolarHBondContact O-N 3.39Å; E297-T300 PolarHBondContact O-N 2.93Å; E297-E301 WeakPolarHBondContact O-CB 3.42Å; E297-E301 PolarHBondContact O-N 2.8Å; E297-I364 HydrophobicContact CB-CD1 4.4Å
298	T	87.6	Confident	83.9	Confident	82 Å²	82	92.7 Å²	92.7	50%	0.503	46%	0.457	S	S	.	.	H	α-helix	trans	-60.2	-40.3	-179.5	56.4	0	0	0	0	113.1	E294 R295 E301 G302	E294-T298 WeakPolarHBondContact O-CG2 3.34Å; E294-T298 PolarHBondContact O-N 3.22Å; E294-T298 PolarHBondContact O-OG1 2.9Å; R295-T298 PolarHBondContact O-N 3.38Å; R295-T298 PolarHBondContact O-OG1 3.45Å; T298-E301 PolarHBondContact O-N 3.28Å; T298-G302 PolarHBondContact O-N 3.12Å
299	D	83.1	Confident	84.6	Confident	103 Å²	103	93.9 Å²	93.9	55%	0.551	46%	0.455	S	S	*	.	H	α-helix	trans	-67.5	-41.8	177.4	-74.7	-21	0	0	0	111.4	R295 E297 G302 Q303	R295-D299 PolarHBondContact O-N 3.37Å; E297-D299 VanDerWaalsContact C-N 3.33Å; E297-D299 PolarHBondContact O-N 3.39Å; D299-G302 PolarHBondContact O-N 2.88Å; D299-Q303 VanDerWaalsContact O-CG 3.29Å; D299-Q303 WeakPolarHBondContact O-CG 3.46Å; D299-Q303 PolarHBondContact O-N 2.84Å
300	T	84.2	Confident	85	Confident	27 Å²	27	96.2 Å²	96.2	17%	0.166	46%	0.459	C	S	.	.	H	α-helix	trans	-65.7	-42.4	178	-56.5	0	0	0	0	110.6	T296 E297 Q303 I304 P362	T296-T300 VanDerWaalsContact O-CB 3.24Å; T296-T300 WeakPolarHBondContact O-CB 3.29Å; T296-T300 PolarHBondContact O-N 3.02Å; T296-T300 PolarHBondContact O-OG1 3.41Å; E297-T300 PolarHBondContact O-N 2.93Å; T300-Q303 PolarHBondContact O-N 3.31Å; T300-I304 HydrophobicContact CG2-CD1 4.16Å; T300-I304 VanDerWaalsContact O-CG1 3.28Å; T300-I304 WeakPolarHBondContact O-CG1 3.4Å; T300-I304 PolarHBondContact O-N 2.85Å; T300-P362 HydrophobicContact CG2-CB 3.64Å; T300-P362 HydrophobicContact CG2-CG 3.73Å
301	E	88	Confident	85	Confident	101 Å²	101	95 Å²	95	47%	0.472	45%	0.452	S	S	.	.	H	α-helix	trans	-60.2	-46.7	174.9	-163.7	-168.2	173.7	0	0	111.2	E297 T298 Q303 I304 M305	E297-E301 WeakPolarHBondContact O-CB 3.42Å; E297-E301 PolarHBondContact O-N 2.8Å; T298-E301 PolarHBondContact O-N 3.28Å; E301-Q303 VanDerWaalsContact C-N 3.31Å; E301-Q303 PolarHBondContact O-N 2.76Å; E301-I304 WeakPolarHBondContact O-CB 3.28Å; E301-I304 PolarHBondContact O-N 2.89Å; E301-M305 VanDerWaalsContact CD-CE 3.44Å; E301-M305 HydrophobicContact CG-CE 3.56Å; E301-M305 WeakPolarHBondContact O-CG 3.33Å; E301-M305 PolarHBondContact O-N 2.82Å; E301-M305 WeakPolarHBondContact OE1-CE 3.33Å
302	G	87.6	Confident	85.5	Confident	36 Å²	36	96.8 Å²	96.8	37%	0.371	46%	0.455	S	S	.	.	H	α-helix	trans	-58.1	-41.8	175.7	0	0	0	0	0	112.9	T298 D299 M305 E306	T298-G302 PolarHBondContact O-N 3.12Å; D299-G302 PolarHBondContact O-N 2.88Å; G302-M305 PolarHBondContact O-N 2.88Å; G302-E306 WeakPolarHBondContact O-CB 3.16Å; G302-E306 PolarHBondContact O-N 3.17Å
303	Q	84.4	Confident	86.1	Confident	114 Å²	114	94.4 Å²	94.4	53%	0.533	45%	0.446	S	S	.	.	H	α-helix	trans	-65.6	-41	175.8	-71.5	175	37.9	0	0	112.5	D299 T300 E301 E306 R307	D299-Q303 VanDerWaalsContact O-CG 3.29Å; D299-Q303 WeakPolarHBondContact O-CG 3.46Å; D299-Q303 PolarHBondContact O-N 2.84Å; T300-Q303 PolarHBondContact O-N 3.31Å; E301-Q303 VanDerWaalsContact C-N 3.31Å; E301-Q303 PolarHBondContact O-N 2.76Å; Q303-E306 PolarHBondContact O-N 2.97Å; Q303-R307 WeakPolarHBondContact O-CG 3.42Å; Q303-R307 PolarHBondContact O-N 2.95Å
304	I	85.2	Confident	86.3	Confident	63 Å²	63	91.5 Å²	91.5	32%	0.323	43%	0.432	S	S	.	.	H	α-helix	trans	-60.6	-51.7	174.7	-67.9	160.5	0	0	0	109.6	T300 E301 E306 R307 F308 P362	T300-I304 HydrophobicContact CG2-CD1 4.16Å; T300-I304 VanDerWaalsContact O-CG1 3.28Å; T300-I304 WeakPolarHBondContact O-CG1 3.4Å; T300-I304 PolarHBondContact O-N 2.85Å; E301-I304 WeakPolarHBondContact O-CB 3.28Å; E301-I304 PolarHBondContact O-N 2.89Å; I304-E306 VanDerWaalsContact C-N 3.31Å; I304-E306 PolarHBondContact O-N 3.02Å; I304-R307 WeakPolarHBondContact O-CB 3.48Å; I304-R307 PolarHBondContact O-N 2.87Å; I304-R307 VanDerWaalsContact O-N 3.13Å; I304-F308 HydrophobicContact CG2-CD2 3.58Å; I304-F308 HydrophobicContact CG2-CE2 3.61Å; I304-F308 WeakPolarHBondContact O-CD2 3.24Å; I304-F308 PolarHBondContact O-N 3.09Å; I304-P362 HydrophobicContact CD1-CG 3.62Å; I304-P362 HydrophobicContact CG1-CG 3.82Å
305	M	86.2	Confident	86.4	Confident	87 Å²	87	91.7 Å²	91.7	43%	0.429	43%	0.434	S	S	.	.	H	α-helix	trans	-58.2	-42.1	-179.6	-70.5	-165.8	-136.8	0	0	112.4	E301 G302 F308 R309	E301-M305 VanDerWaalsContact CD-CE 3.44Å; E301-M305 HydrophobicContact CG-CE 3.56Å; E301-M305 WeakPolarHBondContact O-CG 3.33Å; E301-M305 PolarHBondContact O-N 2.82Å; E301-M305 WeakPolarHBondContact OE1-CE 3.33Å; G302-M305 PolarHBondContact O-N 2.88Å; M305-F308 PolarHBondContact O-N 3Å; M305-R309 VanDerWaalsContact O-CB 3.32Å; M305-R309 WeakPolarHBondContact O-CB 3.21Å; M305-R309 PolarHBondContact O-N 2.81Å
306	E	86.5	Confident	86.8	Confident	76 Å²	76	88.9 Å²	88.9	36%	0.355	43%	0.428	S	S	.	.	H	α-helix	trans	-64.7	-39.4	177.1	-177.8	58.4	-158.1	0	0	112.4	G302 Q303 I304 R309 K310	G302-E306 WeakPolarHBondContact O-CB 3.16Å; G302-E306 PolarHBondContact O-N 3.17Å; Q303-E306 PolarHBondContact O-N 2.97Å; I304-E306 VanDerWaalsContact C-N 3.31Å; I304-E306 PolarHBondContact O-N 3.02Å; E306-R309 PolarHBondContact O-N 2.91Å; E306-R309 IonicContact OE2-CZ 3.88Å; E306-R309 IonicContact OE2-NH1 3.27Å; E306-R309 PolarHBondContact OE2-NH1 3.18Å; E306-K310 WeakPolarHBondContact O-CG 3.44Å; E306-K310 PolarHBondContact O-N 3.12Å; E306-K310 WeakPolarHBondContact OE1-CE 3.31Å; E306-K310 IonicContact OE1-NZ 3.92Å
307	R	84	Confident	87.3	Confident	143 Å²	143	92.4 Å²	92.4	54%	0.54	44%	0.439	S	S	.	.	H	α-helix	trans	-62.7	-46.6	173.6	-73.3	179.5	-176.2	-173.3	3.6	111.7	Q303 I304 R309 K310 M311	Q303-R307 WeakPolarHBondContact O-CG 3.42Å; Q303-R307 PolarHBondContact O-N 2.95Å; I304-R307 WeakPolarHBondContact O-CB 3.48Å; I304-R307 PolarHBondContact O-N 2.87Å; I304-R307 VanDerWaalsContact O-N 3.13Å; R307-R309 VanDerWaalsContact C-N 3.33Å; R307-R309 PolarHBondContact O-N 3.1Å; R307-K310 PolarHBondContact O-N 3.35Å; R307-M311 WeakPolarHBondContact O-CB 3.28Å; R307-M311 PolarHBondContact O-N 2.83Å
308	F	85.9	Confident	87.5	Confident	134 Å²	134	89 Å²	89	59%	0.588	42%	0.424	S	S	*	.	H	α-helix	trans	-65.1	-35.8	177.5	-84.6	-77.5	0	0	0	112.6	I304 M305 M311 R312	I304-F308 HydrophobicContact CG2-CD2 3.58Å; I304-F308 HydrophobicContact CG2-CE2 3.61Å; I304-F308 WeakPolarHBondContact O-CD2 3.24Å; I304-F308 PolarHBondContact O-N 3.09Å; M305-F308 PolarHBondContact O-N 3Å; F308-M311 PolarHBondContact O-N 3.38Å; F308-R312 WeakPolarHBondContact O-CB 3.11Å; F308-R312 PolarHBondContact O-N 3.05Å
309	R	88.4	Confident	87.8	Confident	108 Å²	108	88 Å²	88	41%	0.408	42%	0.42	S	S	.	.	H	α-helix	trans	-62.9	-47.9	173.4	-174.9	-176	-64.1	102.2	4.9	111.4	M305 E306 R307 M311 R312 N313	M305-R309 VanDerWaalsContact O-CB 3.32Å; M305-R309 WeakPolarHBondContact O-CB 3.21Å; M305-R309 PolarHBondContact O-N 2.81Å; E306-R309 PolarHBondContact O-N 2.91Å; E306-R309 IonicContact OE2-CZ 3.88Å; E306-R309 IonicContact OE2-NH1 3.27Å; E306-R309 PolarHBondContact OE2-NH1 3.18Å; R307-R309 VanDerWaalsContact C-N 3.33Å; R307-R309 PolarHBondContact O-N 3.1Å; R309-M311 PolarHBondContact O-N 3.35Å; R309-R312 PolarHBondContact O-N 3.03Å; R309-N313 VanDerWaalsContact O-CG 3.3Å; R309-N313 PolarHBondContact O-N 2.93Å; R309-N313 PolarHBondContact O-OD1 2.58Å
310	K	86	Confident	88.3	Confident	114 Å²	114	88.1 Å²	88.1	50%	0.496	42%	0.421	S	S	.	.	H	α-helix	trans	-60.4	-44.6	175.2	-72.8	-180	-174.1	179	0	111.8	E306 R307 R312 N313 T314	E306-K310 WeakPolarHBondContact O-CG 3.44Å; E306-K310 PolarHBondContact O-N 3.12Å; E306-K310 WeakPolarHBondContact OE1-CE 3.31Å; E306-K310 IonicContact OE1-NZ 3.92Å; R307-K310 PolarHBondContact O-N 3.35Å; K310-R312 PolarHBondContact O-N 2.87Å; K310-N313 PolarHBondContact O-N 2.79Å; K310-T314 PolarHBondContact O-N 2.92Å; K310-T314 PolarHBondContact O-OG1 3.34Å; K310-T314 VanDerWaalsContact O-OG1 3.12Å
311	M	86.9	Confident	88.7	Confident	58 Å²	58	87.6 Å²	87.6	29%	0.286	42%	0.42	S	S	.	.	H	α-helix	trans	-57.1	-48	176.1	-180	64.3	80.1	0	0	111.5	R307 F308 R309 N313 T314 M315 I355 P356	R307-M311 WeakPolarHBondContact O-CB 3.28Å; R307-M311 PolarHBondContact O-N 2.83Å; F308-M311 PolarHBondContact O-N 3.38Å; R309-M311 PolarHBondContact O-N 3.35Å; M311-N313 PolarHBondContact O-N 2.73Å; M311-T314 PolarHBondContact O-N 2.92Å; M311-M315 WeakPolarHBondContact O-CB 3.32Å; M311-M315 PolarHBondContact O-N 3.16Å; M311-I355 HydrophobicContact CE-CG2 4.48Å; M311-I355 HydrophobicContact SD-CG2 4.47Å; M311-P356 HydrophobicContact CB-CG 4.37Å; M311-P356 HydrophobicContact CE-CB 3.87Å; M311-P356 HydrophobicContact CE-CG 3.89Å; M311-P356 VanDerWaalsContact CE-O 3.23Å; M311-P356 WeakPolarHBondContact CE-O 3.47Å; M311-P356 HydrophobicContact SD-CG 4.21Å
312	R	89.7	Confident	88.9	Confident	132 Å²	132	85.3 Å²	85.3	50%	0.498	41%	0.414	S	S	.	.	H	α-helix	trans	-59.6	-48	177.8	-171.7	-177	-60.2	111.7	1.5	111.9	F308 R309 K310 T314 M315 E316	F308-R312 WeakPolarHBondContact O-CB 3.11Å; F308-R312 PolarHBondContact O-N 3.05Å; R309-R312 PolarHBondContact O-N 3.03Å; K310-R312 PolarHBondContact O-N 2.87Å; R312-T314 VanDerWaalsContact C-N 3.29Å; R312-T314 PolarHBondContact O-N 2.84Å; R312-M315 WeakPolarHBondContact O-CB 3.19Å; R312-M315 PolarHBondContact O-N 2.82Å; R312-M315 VanDerWaalsContact O-N 3.11Å; R312-E316 PolarHBondContact O-N 3.2Å
313	N	89.7	Confident	89.3	Confident	75 Å²	75	87.6 Å²	87.6	40%	0.401	42%	0.417	S	S	.	.	H	α-helix	trans	-61.7	-37.5	178.7	-67.2	-5	0	0	0	112	R309 K310 M311 K317	R309-N313 VanDerWaalsContact O-CG 3.3Å; R309-N313 PolarHBondContact O-N 2.93Å; R309-N313 PolarHBondContact O-OD1 2.58Å; K310-N313 PolarHBondContact O-N 2.79Å; M311-N313 PolarHBondContact O-N 2.73Å; N313-K317 VanDerWaalsContact O-CG 3.3Å; N313-K317 WeakPolarHBondContact O-CG 3.25Å; N313-K317 PolarHBondContact O-N 2.87Å
314	T	89.2	Confident	89.8	Confident	20 Å²	20	87.2 Å²	87.2	12%	0.123	41%	0.414	C	S	.	.	H	α-helix	trans	-67.2	-40.7	174.6	-60.3	0	0	0	0	111.2	K310 M311 R312 K317 I318	K310-T314 PolarHBondContact O-N 2.92Å; K310-T314 PolarHBondContact O-OG1 3.34Å; K310-T314 VanDerWaalsContact O-OG1 3.12Å; M311-T314 PolarHBondContact O-N 2.92Å; R312-T314 VanDerWaalsContact C-N 3.29Å; R312-T314 PolarHBondContact O-N 2.84Å; T314-K317 PolarHBondContact O-N 3.42Å; T314-I318 HydrophobicContact CG2-CD1 3.92Å; T314-I318 HydrophobicContact CG2-CG1 4.5Å; T314-I318 WeakPolarHBondContact O-CG1 3.27Å; T314-I318 PolarHBondContact O-N 2.9Å
315	M	89.4	Confident	90.2	Very high	124 Å²	124	85.3 Å²	85.3	61%	0.611	41%	0.405	S	S	*	.	H	α-helix	trans	-62.6	-42.9	177.4	-170.3	-179.7	73	0	0	112.2	M311 R312 I318 S319	M311-M315 WeakPolarHBondContact O-CB 3.32Å; M311-M315 PolarHBondContact O-N 3.16Å; R312-M315 WeakPolarHBondContact O-CB 3.19Å; R312-M315 PolarHBondContact O-N 2.82Å; R312-M315 VanDerWaalsContact O-N 3.11Å; M315-I318 PolarHBondContact O-N 3.41Å; M315-S319 WeakPolarHBondContact O-CB 3.15Å; M315-S319 PolarHBondContact O-N 3.42Å
316	E	92.1	Very high	90.6	Very high	100 Å²	100	85.4 Å²	85.4	47%	0.467	41%	0.407	S	S	.	.	H	α-helix	trans	-60.2	-47.7	174.6	-72.9	171.3	-172	0	0	111.2	R312 I318 S319 D320	R312-E316 PolarHBondContact O-N 3.2Å; E316-I318 VanDerWaalsContact C-N 3.31Å; E316-I318 PolarHBondContact O-N 3.13Å; E316-S319 WeakPolarHBondContact O-CB 3.49Å; E316-S319 PolarHBondContact O-N 2.98Å; E316-S319 VanDerWaalsContact O-N 3.12Å; E316-D320 PolarHBondContact O-N 3.26Å
317	K	92.1	Very high	91	Very high	126 Å²	126	86.9 Å²	86.9	55%	0.548	41%	0.414	S	S	.	.	H	α-helix	trans	-60.1	-39	176.4	-71.1	173.3	-177.5	-178.5	0	113.1	N313 T314 A321 L351	N313-K317 VanDerWaalsContact O-CG 3.3Å; N313-K317 WeakPolarHBondContact O-CG 3.25Å; N313-K317 PolarHBondContact O-N 2.87Å; T314-K317 PolarHBondContact O-N 3.42Å; K317-A321 WeakPolarHBondContact O-CB 3.32Å; K317-A321 PolarHBondContact O-N 3.39Å; K317-L351 HydrophobicContact CB-CD2 3.78Å; K317-L351 HydrophobicContact CD-CD2 4.32Å
318	I	91.6	Very high	91.4	Very high	46 Å²	46	81.3 Å²	81.3	24%	0.236	40%	0.395	C	S	.	.	H	α-helix	trans	-66	-44.3	175.5	-71	166.9	0	0	0	110.2	T314 M315 E316 D320 A321 C322 L351 I355	T314-I318 HydrophobicContact CG2-CD1 3.92Å; T314-I318 HydrophobicContact CG2-CG1 4.5Å; T314-I318 WeakPolarHBondContact O-CG1 3.27Å; T314-I318 PolarHBondContact O-N 2.9Å; M315-I318 PolarHBondContact O-N 3.41Å; E316-I318 VanDerWaalsContact C-N 3.31Å; E316-I318 PolarHBondContact O-N 3.13Å; I318-D320 PolarHBondContact O-N 2.93Å; I318-A321 PolarHBondContact O-N 2.88Å; I318-C322 WeakPolarHBondContact O-CB 3.25Å; I318-C322 PolarHBondContact O-N 3.49Å; I318-C322 PolarHBondContact O-SG 3.11Å; I318-L351 HydrophobicContact CG1-CB 3.78Å; I318-L351 HydrophobicContact CG1-CD1 4.37Å; I318-I355 HydrophobicContact CD1-CD1 4.06Å; I318-I355 HydrophobicContact CD1-CG1 3.9Å
319	S	93.3	Very high	91.8	Very high	61 Å²	61	80.3 Å²	80.3	43%	0.427	40%	0.395	S	S	.	.	H	α-helix	trans	-57.6	-49.6	177	-177.1	0	0	0	0	111.3	M315 E316 A321 C322 I323	M315-S319 WeakPolarHBondContact O-CB 3.15Å; M315-S319 PolarHBondContact O-N 3.42Å; E316-S319 WeakPolarHBondContact O-CB 3.49Å; E316-S319 PolarHBondContact O-N 2.98Å; E316-S319 VanDerWaalsContact O-N 3.12Å; S319-A321 PolarHBondContact O-N 3.31Å; S319-C322 WeakPolarHBondContact O-CB 3.14Å; S319-C322 PolarHBondContact O-N 2.99Å; S319-I323 VanDerWaalsContact O-CG1 3.31Å; S319-I323 WeakPolarHBondContact O-CG1 3.41Å; S319-I323 PolarHBondContact O-N 3.32Å
320	D	93.8	Very high	92.1	Very high	105 Å²	105	82.7 Å²	82.7	56%	0.561	41%	0.408	S	S	*	.	H	α-helix	trans	-61.4	-44.6	178.8	-69.9	-16.4	0	0	0	111.9	E316 I318 C322 I323 F324	E316-D320 PolarHBondContact O-N 3.26Å; I318-D320 PolarHBondContact O-N 2.93Å; D320-C322 VanDerWaalsContact C-N 3.31Å; D320-C322 PolarHBondContact O-N 3.26Å; D320-I323 PolarHBondContact O-N 2.97Å; D320-F324 PolarHBondContact O-N 3.35Å
321	A	92.7	Very high	92.5	Very high	17 Å²	17	86.3 Å²	86.3	14%	0.14	42%	0.42	C	S	.	.	H	α-helix	trans	-60.8	-41.2	176.2	0	0	0	0	0	111.6	K317 I318 S319 T325 L348 L351	K317-A321 WeakPolarHBondContact O-CB 3.32Å; K317-A321 PolarHBondContact O-N 3.39Å; I318-A321 PolarHBondContact O-N 2.88Å; S319-A321 PolarHBondContact O-N 3.31Å; A321-T325 WeakPolarHBondContact O-CB 3.24Å; A321-T325 PolarHBondContact O-N 2.98Å; A321-T325 PolarHBondContact O-OG1 2.94Å; A321-L348 HydrophobicContact CB-CD2 3.83Å; A321-L351 HydrophobicContact CB-CD1 3.64Å
322	C	93	Very high	92.7	Very high	53 Å²	53	84.6 Å²	84.6	36%	0.358	42%	0.418	S	S	.	.	H	α-helix	trans	-66.9	-40.3	176.2	-74.8	0	0	0	0	112.5	I318 S319 D320 T325 N326	I318-C322 WeakPolarHBondContact O-CB 3.25Å; I318-C322 PolarHBondContact O-N 3.49Å; I318-C322 PolarHBondContact O-SG 3.11Å; S319-C322 WeakPolarHBondContact O-CB 3.14Å; S319-C322 PolarHBondContact O-N 2.99Å; D320-C322 VanDerWaalsContact C-N 3.31Å; D320-C322 PolarHBondContact O-N 3.26Å; C322-T325 PolarHBondContact O-N 3.48Å; C322-N326 WeakPolarHBondContact O-CB 3.45Å; C322-N326 PolarHBondContact O-N 2.89Å; C322-N326 PolarHBondContact O-ND2 3Å
323	I	95	Very high	92.8	Very high	83 Å²	83	81 Å²	81	43%	0.426	41%	0.413	S	S	.	.	H	α-helix	trans	-61.8	-50.2	176.2	-70.2	164.9	0	0	0	110	S319 D320 T325 N326 Q327	S319-I323 VanDerWaalsContact O-CG1 3.31Å; S319-I323 WeakPolarHBondContact O-CG1 3.41Å; S319-I323 PolarHBondContact O-N 3.32Å; D320-I323 PolarHBondContact O-N 2.97Å; I323-T325 VanDerWaalsContact C-N 3.34Å; I323-T325 PolarHBondContact O-N 3.23Å; I323-N326 PolarHBondContact O-N 3.48Å; I323-Q327 WeakPolarHBondContact O-CG 3.31Å; I323-Q327 PolarHBondContact O-N 2.9Å
324	F	94.5	Very high	92.9	Very high	106 Å²	106	81 Å²	81	47%	0.465	42%	0.423	S	S	.	.	H	α-helix	trans	-58.9	-46	177	177.9	-95.8	0	0	0	111.6	D320 N326 Q327 L328 V344	D320-F324 PolarHBondContact O-N 3.35Å; F324-N326 VanDerWaalsContact C-N 3.32Å; F324-N326 PolarHBondContact O-N 3.05Å; F324-Q327 PolarHBondContact O-N 2.95Å; F324-L328 HydrophobicContact CE1-CD2 4.29Å; F324-L328 WeakPolarHBondContact O-CB 3.39Å; F324-L328 PolarHBondContact O-N 3.12Å; F324-V344 HydrophobicContact CD1-CG2 4.1Å; F324-V344 HydrophobicContact CE1-CG2 3.71Å
325	T	94.3	Very high	93	Very high	24 Å²	24	85.8 Å²	85.8	15%	0.147	45%	0.447	C	S	.	.	H	α-helix	trans	-58.7	-44.4	178.2	-56.2	0	0	0	0	111.2	A321 C322 I323 L328 L329 V344 L348	A321-T325 WeakPolarHBondContact O-CB 3.24Å; A321-T325 PolarHBondContact O-N 2.98Å; A321-T325 PolarHBondContact O-OG1 2.94Å; C322-T325 PolarHBondContact O-N 3.48Å; I323-T325 VanDerWaalsContact C-N 3.34Å; I323-T325 PolarHBondContact O-N 3.23Å; T325-L328 PolarHBondContact O-N 2.81Å; T325-L329 HydrophobicContact CG2-CD1 4.13Å; T325-L329 WeakPolarHBondContact O-CB 3.41Å; T325-L329 VanDerWaalsContact O-CG 3.27Å; T325-L329 WeakPolarHBondContact O-CG 3.46Å; T325-L329 PolarHBondContact O-N 3.13Å; T325-V344 HydrophobicContact CG2-CG1 3.92Å; T325-V344 WeakPolarHBondContact OG1-CG1 3.19Å; T325-L348 HydrophobicContact CG2-CD1 4.37Å
326	N	94.7	Very high	93.1	Very high	89 Å²	89	84.6 Å²	84.6	48%	0.476	44%	0.44	S	S	.	.	H	α-helix	trans	-65.1	-38.6	177	-81.6	-48.2	0	0	0	112.9	C322 I323 F324 L329 K330	C322-N326 WeakPolarHBondContact O-CB 3.45Å; C322-N326 PolarHBondContact O-N 2.89Å; C322-N326 PolarHBondContact O-ND2 3Å; I323-N326 PolarHBondContact O-N 3.48Å; F324-N326 VanDerWaalsContact C-N 3.32Å; F324-N326 PolarHBondContact O-N 3.05Å; N326-L329 PolarHBondContact O-N 2.98Å; N326-K330 WeakPolarHBondContact O-CB 3.49Å; N326-K330 WeakPolarHBondContact O-CG 3.45Å; N326-K330 PolarHBondContact O-N 3.48Å
327	Q	94.2	Very high	93	Very high	107 Å²	107	82.8 Å²	82.8	50%	0.5	43%	0.433	S	S	.	.	H	α-helix	trans	-66.1	-44.8	175.9	-73.3	179	-5.6	0	0	111.3	I323 F324 L329 K330 Y331	I323-Q327 WeakPolarHBondContact O-CG 3.31Å; I323-Q327 PolarHBondContact O-N 2.9Å; F324-Q327 PolarHBondContact O-N 2.95Å; Q327-L329 VanDerWaalsContact C-N 3.3Å; Q327-L329 PolarHBondContact O-N 3.25Å; Q327-K330 PolarHBondContact O-N 3.13Å; Q327-Y331 WeakPolarHBondContact O-CD2 3.39Å; Q327-Y331 PolarHBondContact O-N 2.89Å
328	L	94	Very high	92.9	Very high	25 Å²	25	83.2 Å²	83.2	13%	0.131	44%	0.44	C	S	.	.	H	α-helix	trans	-59.8	-40.9	176.3	-177	67.2	0	0	0	111.5	F324 T325 G332 E336 L337 V344	F324-L328 HydrophobicContact CE1-CD2 4.29Å; F324-L328 WeakPolarHBondContact O-CB 3.39Å; F324-L328 PolarHBondContact O-N 3.12Å; T325-L328 PolarHBondContact O-N 2.81Å; L328-G332 WeakPolarHBondContact O-CA 3.2Å; L328-G332 PolarHBondContact O-N 3.01Å; L328-E336 HydrophobicContact CD1-CB 4.41Å; L328-L337 HydrophobicContact CD2-CD2 4.36Å; L328-L337 HydrophobicContact CG-CD2 3.91Å; L328-V344 HydrophobicContact CD2-CG2 4.06Å
329	L	92.9	Very high	92.9	Very high	113 Å²	113	86.3 Å²	86.3	59%	0.592	46%	0.456	S	S	*	.	H	α-helix	trans	-69.4	-34.3	177	-71.8	171.3	0	0	0	113.5	T325 N326 Q327 L337	T325-L329 HydrophobicContact CG2-CD1 4.13Å; T325-L329 WeakPolarHBondContact O-CB 3.41Å; T325-L329 VanDerWaalsContact O-CG 3.27Å; T325-L329 WeakPolarHBondContact O-CG 3.46Å; T325-L329 PolarHBondContact O-N 3.13Å; N326-L329 PolarHBondContact O-N 2.98Å; Q327-L329 VanDerWaalsContact C-N 3.3Å; Q327-L329 PolarHBondContact O-N 3.25Å; L329-L337 HydrophobicContact CD2-CD2 4.03Å
330	K	94.2	Very high	92.8	Very high	158 Å²	158	84.9 Å²	84.9	69%	0.687	45%	0.446	S	S	*	.	H	α-helix	trans	-80.9	-36.8	-178.4	-77.9	-178.3	179.2	-177.9	0	113.6	N326 Q327	N326-K330 WeakPolarHBondContact O-CB 3.49Å; N326-K330 WeakPolarHBondContact O-CG 3.45Å; N326-K330 PolarHBondContact O-N 3.48Å; Q327-K330 PolarHBondContact O-N 3.13Å
331	Y	94.4	Very high	92.6	Very high	191 Å²	191	81.3 Å²	81.3	75%	0.749	44%	0.435	S	S	*	.	H	α-helix	trans	-122.7	-11	-168	-55.9	-70.2	0	0	0	113.9	Q327	Q327-Y331 WeakPolarHBondContact O-CD2 3.39Å; Q327-Y331 PolarHBondContact O-N 2.89Å
332	G	91.6	Very high	92.5	Very high	22 Å²	22	89 Å²	89	23%	0.227	47%	0.465	C	S	.	.			trans	-73	141	-178.6	0	0	0	0	0	112.7	L328	L328-G332 WeakPolarHBondContact O-CA 3.2Å; L328-G332 PolarHBondContact O-N 3.01Å
333	S	92.4	Very high	92.5	Very high	56 Å²	56	92.3 Å²	92.3	39%	0.392	48%	0.478	S	S	.	.			trans	-70.6	161.9	168.9	65	0	0	0	0	111.4	L335 E336 L337	S333-L335 PolarHBondContact O-N 2.96Å; S333-E336 WeakPolarHBondContact CB-OE2 3.39Å; S333-E336 PolarHBondContact N-OE2 2.8Å; S333-E336 PolarHBondContact O-N 2.97Å; S333-E336 VanDerWaalsContact O-N 3.16Å; S333-E336 VanDerWaalsContact OG-CD 3.3Å; S333-E336 WeakPolarHBondContact OG-CG 3.38Å; S333-E336 PolarHBondContact OG-N 2.74Å; S333-E336 PolarHBondContact OG-OE2 2.72Å; S333-L337 PolarHBondContact O-N 3.3Å
334	A	91.7	Very high	92.4	Very high	76 Å²	76	89.2 Å²	89.2	63%	0.628	46%	0.463	S	S	*	.	H	α-helix	trans	-55.1	-36.6	177.4	0	0	0	0	0	112.8	I338	A334-I338 WeakPolarHBondContact O-CD1 3.2Å; A334-I338 VanDerWaalsContact O-CG1 3.27Å; A334-I338 WeakPolarHBondContact O-CG1 3.46Å; A334-I338 PolarHBondContact O-N 2.74Å
335	L	92	Very high	92.3	Very high	119 Å²	119	87.2 Å²	87.2	62%	0.623	46%	0.462	S	S	*	.	H	α-helix	trans	-69.4	-44.8	178.3	-173.7	65	0	0	0	112	S333 L337 I338 I339	S333-L335 PolarHBondContact O-N 2.96Å; L335-L337 VanDerWaalsContact C-N 3.32Å; L335-L337 PolarHBondContact O-N 2.87Å; L335-I338 PolarHBondContact O-N 3.19Å; L335-I339 HydrophobicContact CD1-CD1 4.2Å; L335-I339 HydrophobicContact CG-CD1 3.95Å; L335-I339 WeakPolarHBondContact O-CG1 3.48Å; L335-I339 PolarHBondContact O-N 3.38Å
336	E	91.5	Very high	92.2	Very high	100 Å²	100	89 Å²	89	47%	0.467	48%	0.475	S	S	.	.	H	α-helix	trans	-64	-37.3	178.2	-71.5	162.8	142	0	0	112.1	L328 S333 S340	L328-E336 HydrophobicContact CD1-CB 4.41Å; S333-E336 WeakPolarHBondContact CB-OE2 3.39Å; S333-E336 PolarHBondContact N-OE2 2.8Å; S333-E336 PolarHBondContact O-N 2.97Å; S333-E336 VanDerWaalsContact O-N 3.16Å; S333-E336 VanDerWaalsContact OG-CD 3.3Å; S333-E336 WeakPolarHBondContact OG-CG 3.38Å; S333-E336 PolarHBondContact OG-N 2.74Å; S333-E336 PolarHBondContact OG-OE2 2.72Å; E336-S340 WeakPolarHBondContact O-CB 3.38Å; E336-S340 PolarHBondContact O-N 3.08Å; E336-S340 PolarHBondContact O-OG 2.92Å
337	L	90.2	Very high	92.2	Very high	61 Å²	61	89 Å²	89	32%	0.319	47%	0.472	S	S	.	.	H	α-helix	trans	-62.4	-42.6	173.7	-77	166.4	0	0	0	112.1	L328 L329 S333 L335 G341	L328-L337 HydrophobicContact CD2-CD2 4.36Å; L328-L337 HydrophobicContact CG-CD2 3.91Å; L329-L337 HydrophobicContact CD2-CD2 4.03Å; S333-L337 PolarHBondContact O-N 3.3Å; L335-L337 VanDerWaalsContact C-N 3.32Å; L335-L337 PolarHBondContact O-N 2.87Å; L337-G341 VanDerWaalsContact O-CA 3.28Å; L337-G341 WeakPolarHBondContact O-CA 2.86Å; L337-G341 PolarHBondContact O-N 2.94Å
338	I	88.9	Confident	92.1	Very high	135 Å²	135	86.5 Å²	86.5	69%	0.692	46%	0.462	S	S	*	.	H	α-helix	trans	-67.1	-44.9	178.6	-69.4	165.9	0	0	0	110.9	A334 L335	A334-I338 WeakPolarHBondContact O-CD1 3.2Å; A334-I338 VanDerWaalsContact O-CG1 3.27Å; A334-I338 WeakPolarHBondContact O-CG1 3.46Å; A334-I338 PolarHBondContact O-N 2.74Å; L335-I338 PolarHBondContact O-N 3.19Å
339	I	91.6	Very high	92	Very high	111 Å²	111	89.8 Å²	89.8	57%	0.569	48%	0.479	S	S	*	.	H	α-helix	trans	-67.6	-45.9	-178.7	-66.3	169.9	0	0	0	110.8	L335	L335-I339 HydrophobicContact CD1-CD1 4.2Å; L335-I339 HydrophobicContact CG-CD1 3.95Å; L335-I339 WeakPolarHBondContact O-CG1 3.48Å; L335-I339 PolarHBondContact O-N 3.38Å
340	S	91	Very high	92	Very high	31 Å²	31	89.8 Å²	89.8	22%	0.217	48%	0.476	C	S	.	.	H	α-helix	trans	-85	-24.1	-173.5	-54.6	0	0	0	0	113.2	E336 K342 I343 V344	E336-S340 WeakPolarHBondContact O-CB 3.38Å; E336-S340 PolarHBondContact O-N 3.08Å; E336-S340 PolarHBondContact O-OG 2.92Å; S340-K342 PolarHBondContact O-N 2.82Å; S340-I343 PolarHBondContact O-N 3.09Å; S340-V344 WeakPolarHBondContact O-CG2 3.43Å; S340-V344 PolarHBondContact O-N 2.68Å
341	G	89.6	Confident	91.9	Very high	31 Å²	31	82.9 Å²	82.9	32%	0.32	45%	0.446	S	S	.	.	H	α-helix	trans	-57.1	-42.5	-170.4	0	0	0	0	0	114.1	L337 I343 S345	L337-G341 VanDerWaalsContact O-CA 3.28Å; L337-G341 WeakPolarHBondContact O-CA 2.86Å; L337-G341 PolarHBondContact O-N 2.94Å; G341-I343 PolarHBondContact O-N 3.2Å; G341-S345 VanDerWaalsContact O-CB 3.28Å; G341-S345 WeakPolarHBondContact O-CB 3.48Å; G341-S345 PolarHBondContact O-N 3.04Å
342	K	91	Very high	91.5	Very high	179 Å²	179	76.4 Å²	76.4	78%	0.778	43%	0.432	S	S	*	.	H	α-helix	trans	-65	-40	177.5	-172.4	176.9	179.8	180	0	112.1	S340 S346	S340-K342 PolarHBondContact O-N 2.82Å; K342-S346 WeakPolarHBondContact O-CB 3.44Å; K342-S346 PolarHBondContact O-N 2.81Å
343	I	92.6	Very high	91.3	Very high	122 Å²	122	83 Å²	83	63%	0.626	46%	0.457	S	S	*	.	H	α-helix	trans	-68	-48.4	-179.4	-61.7	171.5	0	0	0	109.7	S340 G341 S346 Q347	S340-I343 PolarHBondContact O-N 3.09Å; G341-I343 PolarHBondContact O-N 3.2Å; I343-S346 PolarHBondContact O-N 2.89Å; I343-Q347 WeakPolarHBondContact O-CB 3.34Å; I343-Q347 PolarHBondContact O-N 3.04Å
344	V	94.1	Very high	91	Very high	18 Å²	18	83.4 Å²	83.4	11%	0.109	46%	0.46	C	S	.	.	H	α-helix	trans	-61.3	-46.7	178.7	173.5	0	0	0	0	111.2	F324 T325 L328 S340 S346 Q347 L348	F324-V344 HydrophobicContact CD1-CG2 4.1Å; F324-V344 HydrophobicContact CE1-CG2 3.71Å; T325-V344 HydrophobicContact CG2-CG1 3.92Å; T325-V344 WeakPolarHBondContact OG1-CG1 3.19Å; L328-V344 HydrophobicContact CD2-CG2 4.06Å; S340-V344 WeakPolarHBondContact O-CG2 3.43Å; S340-V344 PolarHBondContact O-N 2.68Å; V344-S346 PolarHBondContact O-N 3.49Å; V344-Q347 PolarHBondContact O-N 2.85Å; V344-L348 HydrophobicContact CG1-CD1 3.96Å; V344-L348 HydrophobicContact CG1-CG 4.4Å; V344-L348 WeakPolarHBondContact O-CG 2.94Å; V344-L348 PolarHBondContact O-N 3.2Å
345	S	92.1	Very high	90.6	Very high	64 Å²	64	84.3 Å²	84.3	45%	0.448	45%	0.453	S	S	.	.	H	α-helix	trans	-60.5	-45.5	178.1	180	0	0	0	0	111.8	G341 Q347 L348 I349	G341-S345 VanDerWaalsContact O-CB 3.28Å; G341-S345 WeakPolarHBondContact O-CB 3.48Å; G341-S345 PolarHBondContact O-N 3.04Å; S345-Q347 VanDerWaalsContact C-N 3.31Å; S345-Q347 PolarHBondContact O-N 2.82Å; S345-L348 PolarHBondContact O-N 2.98Å; S345-I349 VanDerWaalsContact O-CG1 3.3Å; S345-I349 WeakPolarHBondContact O-CG1 3.48Å; S345-I349 PolarHBondContact O-N 2.81Å
346	S	92.6	Very high	89.7	Confident	61 Å²	61	80.7 Å²	80.7	43%	0.427	44%	0.437	S	S	.	.	H	α-helix	trans	-60.1	-42	175.9	-172.7	0	0	0	0	111.9	K342 I343 V344 I349 Q350	K342-S346 WeakPolarHBondContact O-CB 3.44Å; K342-S346 PolarHBondContact O-N 2.81Å; I343-S346 PolarHBondContact O-N 2.89Å; V344-S346 PolarHBondContact O-N 3.49Å; S346-I349 PolarHBondContact O-N 2.81Å; S346-Q350 WeakPolarHBondContact O-CG 3.5Å; S346-Q350 PolarHBondContact O-N 2.64Å
347	Q	93.6	Very high	88.7	Confident	89 Å²	89	82.7 Å²	82.7	42%	0.416	45%	0.451	S	S	.	.	H	α-helix	trans	-66.3	-43.7	-179.9	-174.1	63.2	17	0	0	112	I343 V344 S345 I349 Q350 L351	I343-Q347 WeakPolarHBondContact O-CB 3.34Å; I343-Q347 PolarHBondContact O-N 3.04Å; V344-Q347 PolarHBondContact O-N 2.85Å; S345-Q347 VanDerWaalsContact C-N 3.31Å; S345-Q347 PolarHBondContact O-N 2.82Å; Q347-I349 PolarHBondContact O-N 3.16Å; Q347-Q350 PolarHBondContact O-N 2.84Å; Q347-L351 HydrophobicContact CG-CD1 4.14Å; Q347-L351 WeakPolarHBondContact O-CG 3.33Å; Q347-L351 PolarHBondContact O-N 3.5Å
348	L	92.2	Very high	87.6	Confident	55 Å²	55	83.8 Å²	83.8	29%	0.288	47%	0.468	S	S	.	.	H	α-helix	trans	-63.6	-40.8	178	-71.3	172.4	0	0	0	111.8	A321 T325 V344 S345 L351 A352	A321-L348 HydrophobicContact CB-CD2 3.83Å; T325-L348 HydrophobicContact CG2-CD1 4.37Å; V344-L348 HydrophobicContact CG1-CD1 3.96Å; V344-L348 HydrophobicContact CG1-CG 4.4Å; V344-L348 WeakPolarHBondContact O-CG 2.94Å; V344-L348 PolarHBondContact O-N 3.2Å; S345-L348 PolarHBondContact O-N 2.98Å; L348-L351 PolarHBondContact O-N 3.11Å; L348-A352 WeakPolarHBondContact O-CB 3.41Å; L348-A352 PolarHBondContact O-N 2.93Å
349	I	92.8	Very high	86.4	Confident	94 Å²	94	84.1 Å²	84.1	48%	0.482	47%	0.471	S	S	.	.	H	α-helix	trans	-62.6	-47.1	175.3	-67.4	166.4	0	0	0	110.3	S345 S346 Q347 L351 A352 H353	S345-I349 VanDerWaalsContact O-CG1 3.3Å; S345-I349 WeakPolarHBondContact O-CG1 3.48Å; S345-I349 PolarHBondContact O-N 2.81Å; S346-I349 PolarHBondContact O-N 2.81Å; Q347-I349 PolarHBondContact O-N 3.16Å; I349-L351 VanDerWaalsContact C-N 3.33Å; I349-L351 PolarHBondContact O-N 2.88Å; I349-A352 PolarHBondContact O-N 3.02Å; I349-H353 PolarHBondContact O-CD2 3.49Å; I349-H353 PolarHBondContact O-N 3.3Å
350	Q	92.5	Very high	84.9	Confident	112 Å²	112	82 Å²	82	52%	0.523	47%	0.47	S	S	.	.	H	α-helix	trans	-60.3	-42	178.3	-76.1	-177.9	-4.3	0	0	112.5	S346 Q347 H353 S354	S346-Q350 WeakPolarHBondContact O-CG 3.5Å; S346-Q350 PolarHBondContact O-N 2.64Å; Q347-Q350 PolarHBondContact O-N 2.84Å; Q350-H353 PolarHBondContact O-N 2.81Å; Q350-S354 PolarHBondContact O-N 2.73Å; Q350-S354 VanDerWaalsContact O-N 3.16Å; Q350-S354 PolarHBondContact O-OG 3.07Å
351	L	91.4	Very high	83.9	Confident	13 Å²	13	86.9 Å²	86.9	7%	0.068	50%	0.499	C	S	.	.	H	α-helix	trans	-67	-39.4	177.3	-71.3	171.8	0	0	0	112.1	K317 I318 A321 Q347 L348 I349 H353 S354	K317-L351 HydrophobicContact CB-CD2 3.78Å; K317-L351 HydrophobicContact CD-CD2 4.32Å; I318-L351 HydrophobicContact CG1-CB 3.78Å; I318-L351 HydrophobicContact CG1-CD1 4.37Å; A321-L351 HydrophobicContact CB-CD1 3.64Å; Q347-L351 HydrophobicContact CG-CD1 4.14Å; Q347-L351 WeakPolarHBondContact O-CG 3.33Å; Q347-L351 PolarHBondContact O-N 3.5Å; L348-L351 PolarHBondContact O-N 3.11Å; I349-L351 VanDerWaalsContact C-N 3.33Å; I349-L351 PolarHBondContact O-N 2.88Å; L351-H353 VanDerWaalsContact C-N 3.34Å; L351-H353 PolarHBondContact O-N 3.13Å; L351-S354 WeakPolarHBondContact O-CB 3.41Å; L351-S354 PolarHBondContact O-N 2.84Å
352	A	87.3	Confident	83.2	Confident	55 Å²	55	88.8 Å²	88.8	46%	0.455	51%	0.506	S	S	.	.	H	α-helix	trans	-62	-40.9	175.5	0	0	0	0	0	112.1	L348 I349 S354 I355	L348-A352 WeakPolarHBondContact O-CB 3.41Å; L348-A352 PolarHBondContact O-N 2.93Å; I349-A352 PolarHBondContact O-N 3.02Å; A352-S354 PolarHBondContact O-N 3.03Å; A352-I355 WeakPolarHBondContact O-CG1 3.39Å; A352-I355 PolarHBondContact O-N 3.21Å
353	H	86.9	Confident	82.7	Confident	161 Å²	161	85.1 Å²	85.1	75%	0.745	50%	0.503	S	S	*	.	H	α-helix	trans	-69.6	-16.8	174.5	-77.3	-122.1	0	0	0	113.3	I349 Q350 L351	I349-H353 PolarHBondContact O-CD2 3.49Å; I349-H353 PolarHBondContact O-N 3.3Å; Q350-H353 PolarHBondContact O-N 2.81Å; L351-H353 VanDerWaalsContact C-N 3.34Å; L351-H353 PolarHBondContact O-N 3.13Å
354	S	86.2	Confident	82.1	Confident	65 Å²	65	83.2 Å²	83.2	46%	0.455	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	1	-179.5	-57.8	0	0	0	0	113.4	Q350 L351 A352 P356	Q350-S354 PolarHBondContact O-N 2.73Å; Q350-S354 VanDerWaalsContact O-N 3.16Å; Q350-S354 PolarHBondContact O-OG 3.07Å; L351-S354 WeakPolarHBondContact O-CB 3.41Å; L351-S354 PolarHBondContact O-N 2.84Å; A352-S354 PolarHBondContact O-N 3.03Å; S354-P356 WeakPolarHBondContact O-CD 3.49Å
355	I	82.6	Confident	81.4	Confident	94 Å²	94	87.5 Å²	87.5	48%	0.482	52%	0.519	S	S	.	.			trans	-69.7	114.7	177.8	-61.8	171.8	0	0	0	108.4	M311 I318 A352	M311-I355 HydrophobicContact CE-CG2 4.48Å; M311-I355 HydrophobicContact SD-CG2 4.47Å; I318-I355 HydrophobicContact CD1-CD1 4.06Å; I318-I355 HydrophobicContact CD1-CG1 3.9Å; A352-I355 WeakPolarHBondContact O-CG1 3.39Å; A352-I355 PolarHBondContact O-N 3.21Å
356	P	72.2	Confident	80.8	Confident	44 Å²	44	91.3 Å²	91.3	29%	0.286	53%	0.528	S	S	.	.			trans	-61.3	141.9	178.4	-16.3	27.2	0	0	0	111.5	M311 S354	M311-P356 HydrophobicContact CB-CG 4.37Å; M311-P356 HydrophobicContact CE-CB 3.87Å; M311-P356 HydrophobicContact CE-CG 3.89Å; M311-P356 VanDerWaalsContact CE-O 3.23Å; M311-P356 WeakPolarHBondContact CE-O 3.47Å; M311-P356 HydrophobicContact SD-CG 4.21Å; S354-P356 WeakPolarHBondContact O-CD 3.49Å
357	N	72.1	Confident	79.9	Confident	142 Å²	142	94.1 Å²	94.1	76%	0.759	54%	0.542	S	S	*	.			trans	-72.2	131.5	177	-152.7	11	0	0	0	110.8
358	A	66.5	Low	78.7	Confident	83 Å²	83	97.6 Å²	97.6	69%	0.686	56%	0.556	S	S	*	*			trans	-91.8	-2.5	-169.8	0	0	0	0	0	114.7	A360	A358-A360 PolarHBondContact O-N 3.08Å
359	D	63.5	Low	77.3	Confident	142 Å²	142	101.4 Å²	101.4	76%	0.759	57%	0.572	S	S	*	*			trans	-83.7	2.6	-156.2	-67.8	-21.5	0	0	0	117.1
360	A	60.9	Low	75.5	Confident	66 Å²	66	102.1 Å²	102.1	55%	0.545	58%	0.583	S	S	.	*			trans	-114.3	102.8	-177.9	0	0	0	0	0	111.9	A358 P362	A358-A360 PolarHBondContact O-N 3.08Å; A360-P362 WeakPolarHBondContact O-CD 3.41Å
361	T	69.1	Low	73.6	Confident	134 Å²	134	103.9 Å²	103.9	82%	0.822	59%	0.591	S	S	*	*			trans	-76.9	115.7	160.3	46.3	0	0	0	0	108.4
362	P	74.9	Confident	71.8	Confident	72 Å²	72	108 Å²	108	47%	0.468	61%	0.613	S	S	.	*			trans	-67.3	142.2	177.4	27.7	-32.5	0	0	0	110	T300 I304 A360	T300-P362 HydrophobicContact CG2-CB 3.64Å; T300-P362 HydrophobicContact CG2-CG 3.73Å; I304-P362 HydrophobicContact CD1-CG 3.62Å; I304-P362 HydrophobicContact CG1-CG 3.82Å; A360-P362 WeakPolarHBondContact O-CD 3.41Å
363	S	80.9	Confident	70.2	Confident	101 Å²	101	109.8 Å²	109.8	71%	0.706	62%	0.62	S	S	*	*			trans	-130.7	136.9	173.3	62.3	0	0	0	0	109.9
364	I	80.1	Confident	68.4	Low	82 Å²	82	109.9 Å²	109.9	42%	0.421	62%	0.621	S	S	.	*			trans	-100.6	123	174.7	-57.5	172.3	0	0	0	106.9	L293 T296 E297	L293-I364 HydrophobicContact CD1-CD1 4.5Å; L293-I364 HydrophobicContact CD1-CG2 3.66Å; T296-I364 HydrophobicContact CG2-CD1 4Å; T296-I364 HydrophobicContact CG2-CG1 4.26Å; T296-I364 HydrophobicContact CG2-CG2 4.48Å; E297-I364 HydrophobicContact CB-CD1 4.4Å
365	V	79.4	Confident	66.6	Low	109 Å²	109	114 Å²	114	66%	0.661	63%	0.631	S	S	*	*			trans	-119.9	128.7	-176.1	-178.2	0	0	0	0	109.5	V367	V365-V367 HydrophobicContact CG1-CG2 4.49Å
366	F	78.7	Confident	65.1	Low	144 Å²	144	111.9 Å²	111.9	63%	0.632	62%	0.624	S	S	*	*			trans	-89.1	108.5	168.6	179.5	-117.1	0	0	0	109.6	V289 K368	V289-F366 HydrophobicContact CG1-CE2 4.15Å; F366-K368 HydrophobicContact CD1-CG 3.78Å; F366-K368 HydrophobicContact CE1-CG 3.66Å; F366-K368 PolarHBondContact O-N 3.44Å
367	V	73.9	Confident	64.2	Low	119 Å²	119	113.6 Å²	113.6	72%	0.721	63%	0.63	S	S	*	*			trans	-80.4	115.7	177.1	-177.2	0	0	0	0	108.7	V365	V365-V367 HydrophobicContact CG1-CG2 4.49Å
368	K	68.3	Low	63.1	Low	162 Å²	162	111.7 Å²	111.7	70%	0.704	62%	0.624	S	S	*	*			trans	-88.5	135.3	173.8	-61.6	179.1	-174.7	-179.5	0	108.9	F366 P370	F366-K368 HydrophobicContact CD1-CG 3.78Å; F366-K368 HydrophobicContact CE1-CG 3.66Å; F366-K368 PolarHBondContact O-N 3.44Å; K368-P370 WeakPolarHBondContact O-CD 3.29Å
369	E	62.9	Low	62.5	Low	136 Å²	136	118.3 Å²	118.3	64%	0.636	63%	0.631	S	S	*	*			trans	-108	95.7	174.6	-154.7	153.8	-128	0	0	108.2	Q371 L372	E369-Q371 PolarHBondContact O-N 3.47Å; E369-Q371 VanDerWaalsContact O-N 3.08Å; E369-L372 HydrophobicContact CB-CD1 4.06Å; E369-L372 HydrophobicContact CG-CD1 4.23Å; E369-L372 PolarHBondContact O-N 2.97Å; E369-L372 VanDerWaalsContact OE2-CD1 3.31Å; E369-L372 WeakPolarHBondContact OE2-CD1 3.43Å
370	P	54.9	Low	62	Low	108 Å²	108	113.1 Å²	113.1	70%	0.701	60%	0.603	S	S	*	*	G	3₁₀ helix	trans	-62.6	-24.7	-165.8	-20.9	31.9	0	0	0	113.6	K368 L372	K368-P370 WeakPolarHBondContact O-CD 3.29Å; P370-L372 VanDerWaalsContact C-N 3.29Å; P370-L372 PolarHBondContact O-N 3.29Å
371	Q	52.6	Low	61.6	Low	149 Å²	149	113.6 Å²	113.6	70%	0.696	59%	0.593	S	S	*	*	G	3₁₀ helix	trans	-77.8	-14.5	-171.6	-51.8	-121.7	10.8	0	0	112.8	E369	E369-Q371 PolarHBondContact O-N 3.47Å; E369-Q371 VanDerWaalsContact O-N 3.08Å
372	L	54.3	Low	60.7	Low	101 Å²	101	111.5 Å²	111.5	53%	0.529	58%	0.579	S	S	.	*	G	3₁₀ helix	trans	-85.9	-10.7	-179.3	-74.9	171.3	0	0	0	113.9	E369 P370 P376	E369-L372 HydrophobicContact CB-CD1 4.06Å; E369-L372 HydrophobicContact CG-CD1 4.23Å; E369-L372 PolarHBondContact O-N 2.97Å; E369-L372 VanDerWaalsContact OE2-CD1 3.31Å; E369-L372 WeakPolarHBondContact OE2-CD1 3.43Å; P370-L372 VanDerWaalsContact C-N 3.29Å; P370-L372 PolarHBondContact O-N 3.29Å; L372-P376 HydrophobicContact CB-CG 4.32Å; L372-P376 HydrophobicContact CD2-CG 3.63Å; L372-P376 WeakPolarHBondContact O-CD 3.3Å; L372-P376 VanDerWaalsContact O-CG 3.27Å; L372-P376 WeakPolarHBondContact O-CG 3.16Å
373	C	53	Low	59.2	Low	91 Å²	91	113 Å²	113	62%	0.615	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	-29.4	-176.1	-67.2	0	0	0	0	113.6	L377	C373-L377 WeakPolarHBondContact O-CD1 3.39Å
374	E	49.8	Very low	57.4	Low	163 Å²	163	113.8 Å²	113.8	76%	0.762	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.7	-41.4	-171.8	-69.8	-178.4	171	0	0	114
375	K	48.5	Very low	55.5	Low	151 Å²	151	115.7 Å²	115.7	66%	0.657	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	-34.1	-170.1	-67.3	-177.5	179.5	174.4	0	116.3	T378	K375-T378 PolarHBondContact O-OG1 3.37Å; K375-T378 VanDerWaalsContact O-OG1 3.07Å
376	P	51.5	Low	53.8	Low	51 Å²	51	115.7 Å²	115.7	33%	0.331	59%	0.588	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.3	-33.8	178.8	-17.8	31.7	0	0	0	113.6	L372 T378 R379	L372-P376 HydrophobicContact CB-CG 4.32Å; L372-P376 HydrophobicContact CD2-CG 3.63Å; L372-P376 WeakPolarHBondContact O-CD 3.3Å; L372-P376 VanDerWaalsContact O-CG 3.27Å; L372-P376 WeakPolarHBondContact O-CG 3.16Å; P376-T378 VanDerWaalsContact C-N 3.34Å; P376-T378 PolarHBondContact O-N 3.4Å; P376-R379 WeakPolarHBondContact O-CB 2.89Å; P376-R379 PolarHBondContact O-N 3.44Å; P376-R379 VanDerWaalsContact O-N 3.08Å
377	L	53	Low	52	Low	79 Å²	79	115.9 Å²	115.9	41%	0.414	60%	0.595	S	S	.	*	G	3₁₀ helix	trans	-67.2	-34.7	-175.4	-70.3	177.3	0	0	0	112.3	I282 C373 R379 L380	I282-L377 HydrophobicContact CD1-CD2 4.05Å; C373-L377 WeakPolarHBondContact O-CD1 3.39Å; L377-R379 PolarHBondContact O-N 2.87Å; L377-L380 HydrophobicContact CD2-CD1 3.56Å; L377-L380 WeakPolarHBondContact O-CB 3.1Å; L377-L380 PolarHBondContact O-N 2.88Å
378	T	49.5	Very low	50.1	Low	103 Å²	103	120.1 Å²	120.1	63%	0.632	60%	0.598	S	S	*	*	G	3₁₀ helix	trans	-65.4	-17.4	174.3	47.1	0	0	0	0	113.2	K375 P376	K375-T378 PolarHBondContact O-OG1 3.37Å; K375-T378 VanDerWaalsContact O-OG1 3.07Å; P376-T378 VanDerWaalsContact C-N 3.34Å; P376-T378 PolarHBondContact O-N 3.4Å
379	R	52.1	Low	48.5	Very low	221 Å²	221	117.5 Å²	117.5	83%	0.834	60%	0.596	S	S	*	*	G	3₁₀ helix	trans	-82.7	-12.5	172.3	-65.9	-176.2	174.3	177.5	-2.8	113.7	P376 L377 F381	P376-R379 WeakPolarHBondContact O-CB 2.89Å; P376-R379 PolarHBondContact O-N 3.44Å; P376-R379 VanDerWaalsContact O-N 3.08Å; L377-R379 PolarHBondContact O-N 2.87Å; R379-F381 VanDerWaalsContact C-N 3.31Å
380	L	54.4	Low	46.9	Very low	33 Å²	33	117.7 Å²	117.7	17%	0.173	61%	0.606	C	S	.	*	T	Hydrogen-bonded Turn	trans	-74	-27.2	176.2	-69.7	168.3	0	0	0	111.9	H274 L377	H274-L380 PolarHBondContact NE2-O 3.41Å; L377-L380 HydrophobicContact CD2-CD1 3.56Å; L377-L380 WeakPolarHBondContact O-CB 3.1Å; L377-L380 PolarHBondContact O-N 2.88Å
381	F	51.9	Low	45.6	Very low	77 Å²	77	119.6 Å²	119.6	34%	0.338	61%	0.606	S	S	.	*	S	Bend	trans	-106.4	116.3	172.9	-59.9	-86.8	0	0	0	106.1	H274 F275 R379 D383	H274-F381 AromaticContact CD2-CD1 3.61Å; H274-F381 AromaticContact CD2-CE1 3.42Å; H274-F381 VanDerWaalsContact CD2-CE1 3.42Å; H274-F381 WeakPolarHBondContact CD2-CE1 3.31Å; F275-F381 HydrophobicContact CB-CE1 4.33Å; F275-F381 HydrophobicContact CB-CZ 4.21Å; F275-F381 AromaticContact CD2-CZ 3.93Å; F275-F381 HydrophobicContact CD2-CZ 3.93Å; R379-F381 VanDerWaalsContact C-N 3.31Å; F381-D383 PolarHBondContact O-N 2.92Å
382	V	50.3	Low	44.3	Very low	89 Å²	89	119.6 Å²	119.6	54%	0.539	61%	0.606	S	S	.	*			trans	-47.6	140.7	-177.2	178.8	0	0	0	0	110.4	T384 E386	V382-T384 PolarHBondContact O-N 2.95Å; V382-E386 HydrophobicContact CG1-CB 4.11Å; V382-E386 HydrophobicContact CG1-CG 4.39Å; V382-E386 VanDerWaalsContact CG1-OE2 3.28Å; V382-E386 WeakPolarHBondContact CG1-OE2 3.37Å
383	D	43	Very low	42.9	Very low	105 Å²	105	118.4 Å²	118.4	56%	0.561	61%	0.606	S	S	*	*			trans	-38.4	120.6	179.3	-160	-23.5	0	0	0	110.3	F381 N385 E386	F381-D383 PolarHBondContact O-N 2.92Å; D383-N385 PolarHBondContact O-N 3.4Å; D383-N385 PolarHBondContact OD1-ND2 3.06Å; D383-E386 PolarHBondContact O-N 3.22Å
384	T	44.3	Very low	41.8	Very low	116 Å²	116	119.4 Å²	119.4	71%	0.712	61%	0.611	S	S	*	*	G	3₁₀ helix	trans	-56.5	-13.5	-173.4	46.1	0	0	0	0	113.3	V382 E386	V382-T384 PolarHBondContact O-N 2.95Å; T384-E386 VanDerWaalsContact C-N 3.27Å; T384-E386 PolarHBondContact O-N 3.05Å
385	N	40.2	Very low	40.7	Very low	123 Å²	123	116.8 Å²	116.8	66%	0.658	61%	0.611	S	S	*	*	G	3₁₀ helix	trans	-75.4	-5	174.5	-63.7	-43.7	0	0	0	114.7	D383	D383-N385 PolarHBondContact O-N 3.4Å; D383-N385 PolarHBondContact OD1-ND2 3.06Å
386	E	42	Very low	39.7	Very low	109 Å²	109	118.7 Å²	118.7	51%	0.509	62%	0.622	S	S	.	*	G	3₁₀ helix	trans	-97.9	5.2	175.8	-70.3	-166.3	172	0	0	114.7	V382 D383 T384 R388	V382-E386 HydrophobicContact CG1-CB 4.11Å; V382-E386 HydrophobicContact CG1-CG 4.39Å; V382-E386 VanDerWaalsContact CG1-OE2 3.28Å; V382-E386 WeakPolarHBondContact CG1-OE2 3.37Å; D383-E386 PolarHBondContact O-N 3.22Å; T384-E386 VanDerWaalsContact C-N 3.27Å; T384-E386 PolarHBondContact O-N 3.05Å; E386-R388 PolarHBondContact O-N 3.32Å
387	L	42.8	Very low	38.4	Very low	147 Å²	147	125 Å²	125	77%	0.77	65%	0.647	S	S	*	*			trans	-68.2	65.2	161.3	-72.6	168	0	0	0	109.6
388	R	33.2	Very low	37	Very low	208 Å²	208	132 Å²	132	79%	0.785	68%	0.675	S	S	*	*			trans	-86.8	128	175.3	-68.7	-175.8	-178.9	-169.3	0.8	108.1	E386 T390	E386-R388 PolarHBondContact O-N 3.32Å; R388-T390 PolarHBondContact O-N 3.37Å
389	T	33.6	Very low	35.8	Very low	107 Å²	107	131.1 Å²	131.1	66%	0.656	69%	0.686	S	S	*	*			trans	-56.3	128.5	157.7	44.1	0	0	0	0	106.9	E391	T389-E391 PolarHBondContact O-N 3.22Å
390	T	30	Very low	34.5	Very low	141 Å²	141	123.3 Å²	123.3	87%	0.865	68%	0.675	S	S	*	*			trans	-67.5	73.5	164.5	44.1	0	0	0	0	107.8	R388 Q392	R388-T390 PolarHBondContact O-N 3.37Å; T390-Q392 VanDerWaalsContact C-N 3.35Å; T390-Q392 PolarHBondContact O-N 3.06Å; T390-Q392 VanDerWaalsContact O-N 3.14Å
391	E	27	Very low	33	Very low	147 Å²	147	129.5 Å²	129.5	69%	0.687	71%	0.707	S	S	*	*			trans	-73.5	98.7	161.2	-74.5	-174.7	-171.3	0	0	106	T389 S393	T389-E391 PolarHBondContact O-N 3.22Å; E391-S393 PolarHBondContact O-N 3.27Å
392	Q	25.2	Very low	31.7	Very low	150 Å²	150	135.1 Å²	135.1	70%	0.701	73%	0.732	S	S	*	*			trans	-62.1	83.2	159.1	-71.9	-175.6	-6.1	0	0	107.6	T390	T390-Q392 VanDerWaalsContact C-N 3.35Å; T390-Q392 PolarHBondContact O-N 3.06Å; T390-Q392 VanDerWaalsContact O-N 3.14Å
393	S	25	Very low	30.5	Very low	76 Å²	76	139.2 Å²	139.2	53%	0.531	74%	0.742	S	S	.	*			trans	-112.7	125.1	164.2	51.5	0	0	0	0	107.7	E391 S395	E391-S393 PolarHBondContact O-N 3.27Å; S393-S395 PolarHBondContact O-N 3Å
394	P	31.1	Very low	30	Very low	111 Å²	111	140.4 Å²	140.4	72%	0.721	76%	0.756	S	S	*	*			trans	-71.1	105.3	-177	28.8	-31.7	0	0	0	108	E396	P394-E396 PolarHBondContact O-N 3.18Å; P394-E396 VanDerWaalsContact O-N 3.12Å
395	S	27	Very low	29.1	Very low	109 Å²	109	139.3 Å²	139.3	76%	0.762	75%	0.753	S	S	*	*			trans	-75.9	101.6	176.7	22.4	0	0	0	0	109.2	S393 Q397	S393-S395 PolarHBondContact O-N 3Å; S395-Q397 PolarHBondContact O-N 3.45Å
396	E	27.1	Very low	28.5	Very low	191 Å²	191	140.5 Å²	140.5	89%	0.893	76%	0.759	S	S	*	*			trans	-56.9	99.3	158.7	-65.7	179.8	145.1	0	0	109.6	P394	P394-E396 PolarHBondContact O-N 3.18Å; P394-E396 VanDerWaalsContact O-N 3.12Å
397	Q	24.7	Very low	27.6	Very low	183 Å²	183	147.1 Å²	147.1	86%	0.855	78%	0.78	S	S	*	*			trans	-138.7	63.3	161.6	-72.6	-167.2	-3.8	0	0	110.2	S395	S395-Q397 PolarHBondContact O-N 3.45Å
398	F	23.5	Very low	26.8	Very low	226 Å²	226	148.8 Å²	148.8	99%	0.991	78%	0.783	S	S	*	*			trans	-99.1	113.6	154.3	-95.3	-86.9	0	0	0	107.9
399	G	24.2	Very low	26.4	Very low	84 Å²	84	143.6 Å²	143.6	87%	0.866	78%	0.779	S	S	*	*			trans	160.1	47.5	175.1	0	0	0	0	0	115.5
400	G	24.2	Very low	26.2	Very low	58 Å²	58	145 Å²	145	60%	0.598	79%	0.788	S	S	*	*			trans	-135.5	65.3	175.9	0	0	0	0	0	110.7	F402	G400-F402 VanDerWaalsContact C-N 3.26Å; G400-F402 PolarHBondContact O-N 2.97Å
401	L	23.4	Very low	25.9	Very low	163 Å²	163	143.2 Å²	143.2	85%	0.853	79%	0.787	S	S	*	*			trans	-64.4	81.6	174.4	-167.3	80.9	0	0	0	109.5	K403	L401-K403 PolarHBondContact O-N 2.79Å
402	F	24.5	Very low	25.9	Very low	194 Å²	194	144.7 Å²	144.7	85%	0.851	79%	0.794	S	S	*	*			trans	-72.4	106.8	170.4	-85.5	-86.2	0	0	0	109	G400	G400-F402 VanDerWaalsContact C-N 3.26Å; G400-F402 PolarHBondContact O-N 2.97Å
403	K	25.4	Very low	25.9	Very low	175 Å²	175	142.7 Å²	142.7	76%	0.761	80%	0.797	S	S	*	*			trans	-62.7	130.4	169.8	-73.4	-180	176.3	179	0	109.2	L401	L401-K403 PolarHBondContact O-N 2.79Å
404	P	32.7	Very low	25.9	Very low	131 Å²	131	148.2 Å²	148.2	85%	0.851	81%	0.814	S	S	*	*			trans	-83.7	117.1	173.7	28.3	-23.2	0	0	0	109.4
405	S	25.3	Very low	25.7	Very low	92 Å²	92	152.1 Å²	152.1	64%	0.643	82%	0.82	S	S	*	*			trans	-149.8	145	162.5	56.8	0	0	0	0	109.5
406	D	26.4	Very low	25.7	Very low	149 Å²	149	152.9 Å²	152.9	80%	0.797	82%	0.822	S	S	*	*			trans	87.5	65.3	162.1	-41.8	-32.4	0	0	0	116.5
407	W	24.4	Very low	25.7	Very low	248 Å²	248	149 Å²	149	94%	0.939	82%	0.816	S	S	*	*			trans	-130.9	72.5	141.4	73.6	-82.4	0	0	0	110
408	E	24	Very low	25.7	Very low	181 Å²	181	149.9 Å²	149.9	85%	0.846	82%	0.817	S	S	*	*			trans	-86	124.6	162.7	-83.4	-171.9	158	0	0	110.5
409	S	25.4	Very low	25.8	Very low	99 Å²	99	147.1 Å²	147.1	69%	0.692	81%	0.812	S	S	*	*			trans	66.4	98.6	145.3	76.7	0	0	0	0	118.5
410	T	28.8	Very low	26	Very low	138 Å²	138	148.2 Å²	148.2	85%	0.847	80%	0.801	S	S	*	*			trans	-141.8	62.3	135.3	-33.9	0	0	0	0	109.9	Q412	T410-Q412 PolarHBondContact O-N 2.81Å
411	A	23.7	Very low	25.9	Very low	102 Å²	102	151 Å²	151	84%	0.843	81%	0.812	S	S	*	*			trans	-84.7	88.8	161.9	0	0	0	0	0	108.3
412	Q	27	Very low	26.1	Very low	178 Å²	178	152.3 Å²	152.3	83%	0.832	81%	0.811	S	S	*	*			trans	-104.1	102	161.5	-82.4	-171.9	4.2	0	0	109.5	T410 Q414	T410-Q412 PolarHBondContact O-N 2.81Å; Q412-Q414 PolarHBondContact O-N 2.94Å
413	S	25.3	Very low	26.2	Very low	108 Å²	108	150.4 Å²	150.4	76%	0.755	81%	0.81	S	S	*	*			trans	-50.2	115.9	169.4	56.7	0	0	0	0	112.2
414	Q	26.4	Very low	26.2	Very low	193 Å²	193	148.2 Å²	148.2	90%	0.902	81%	0.811	S	S	*	*			trans	-95.5	111.3	153.8	-73.7	-171.9	-10.1	0	0	108.2	Q412	Q412-Q414 PolarHBondContact O-N 2.94Å
415	K	25.7	Very low	25.9	Very low	192 Å²	192	149 Å²	149	84%	0.835	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-65.6	147	178.4	-82.5	176.7	174.7	174.3	0	111.1
416	P	26.9	Very low	25.9	Very low	126 Å²	126	153 Å²	153	82%	0.818	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-82.4	129.8	-172.8	31.9	-28.7	0	0	0	111.1
417	S	27.9	Very low	25.9	Very low	108 Å²	108	155 Å²	155	76%	0.755	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-76.5	121.9	170.6	42.3	0	0	0	0	110.1	L419	S417-L419 PolarHBondContact O-N 3.45Å
418	K	24.7	Very low	25.8	Very low	202 Å²	202	150 Å²	150	88%	0.878	82%	0.818	S	S	*	*			trans	-52	114.5	170	-76.7	169.5	168.3	176.2	0	110.4
419	L	25.2	Very low	26	Very low	169 Å²	169	146.6 Å²	146.6	89%	0.885	81%	0.814	S	S	*	*			trans	-93.2	114.6	160.5	-116.8	86.2	0	0	0	108.5	S417	S417-L419 PolarHBondContact O-N 3.45Å
420	T	28.4	Very low	26.2	Very low	106 Å²	106	147.3 Å²	147.3	65%	0.65	82%	0.817	S	S	*	*			trans	-72.9	137.7	178	46	0	0	0	0	111.3	F422	T420-F422 PolarHBondContact O-N 3.12Å
421	S	22.4	Very low	26.4	Very low	117 Å²	117	146.8 Å²	146.8	82%	0.818	82%	0.815	S	S	*	*			trans	-46.6	125.6	170	51.6	0	0	0	0	112.8
422	F	27.2	Very low	26.6	Very low	191 Å²	191	153.7 Å²	153.7	84%	0.838	82%	0.82	S	S	*	*			trans	-104.9	118	163.4	-95.1	-87.7	0	0	0	109	T420	T420-F422 PolarHBondContact O-N 3.12Å
423	D	26.9	Very low	26.6	Very low	153 Å²	153	154.8 Å²	154.8	82%	0.818	82%	0.822	S	S	*	*			trans	-60.6	128.5	178.7	-96.8	-41.6	0	0	0	111.9	N425	D423-N425 PolarHBondContact O-N 2.83Å
424	V	25.7	Very low	26.6	Very low	129 Å²	129	161.4 Å²	161.4	78%	0.782	83%	0.83	S	S	*	*			trans	-82.6	93.2	174.3	178.4	0	0	0	0	107.5
425	N	26.8	Very low	26.6	Very low	149 Å²	149	160.1 Å²	160.1	80%	0.797	83%	0.829	S	S	*	*			trans	-109.4	116.6	165.2	-96.1	-35.7	0	0	0	111.5	D423 Q427	D423-N425 PolarHBondContact O-N 2.83Å; N425-Q427 PolarHBondContact O-N 3.09Å
426	Q	25.4	Very low	26.8	Very low	175 Å²	175	156.2 Å²	156.2	82%	0.818	83%	0.825	S	S	*	*			trans	-53.7	119.9	177	-64	161.8	4.3	0	0	111
427	Q	25.2	Very low	26.8	Very low	190 Å²	190	157.3 Å²	157.3	89%	0.888	82%	0.824	S	S	*	*			trans	-131	105.6	153.4	-79.1	-169.9	-5.2	0	0	109.8	N425	N425-Q427 PolarHBondContact O-N 3.09Å
428	T	23.7	Very low	26.8	Very low	143 Å²	143	157.1 Å²	157.1	88%	0.877	83%	0.829	S	S	*	*			trans	-56.9	125.9	167.8	49	0	0	0	0	110.6
429	S	26.4	Very low	26.9	Very low	111 Å²	111	152.1 Å²	152.1	78%	0.776	82%	0.815	S	S	*	*			trans	-115	146.5	168.7	57.4	0	0	0	0	111
430	P	30.3	Very low	26.9	Very low	114 Å²	114	149.6 Å²	149.6	74%	0.74	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-90.3	169.7	-160.5	38.3	-35.9	0	0	0	112.9
431	P	33.6	Very low	27.2	Very low	126 Å²	126	148.4 Å²	148.4	82%	0.818	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-80.8	126.4	-150.7	31.5	-32.1	0	0	0	112.3
432	R	27.4	Very low	28.1	Very low	247 Å²	247	149.4 Å²	149.4	93%	0.932	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-78.3	128.7	173.8	-79.5	-176.3	173.5	-174.5	-1.3	110.7
433	K	26.7	Very low	29.4	Very low	201 Å²	201	145.1 Å²	145.1	87%	0.874	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-57.1	132	-179.2	-71.2	175.9	175.6	177.8	0	111.8	L435	K433-L435 PolarHBondContact O-N 3.33Å
434	R	24.6	Very low	30.9	Very low	247 Å²	247	142 Å²	142	93%	0.932	76%	0.757	S	S	*	*			trans	-64.1	101	178.3	-163.5	177.9	-164.3	-176.3	3.7	110.3
435	L	28.1	Very low	32.8	Very low	166 Å²	166	136.5 Å²	136.5	87%	0.869	72%	0.722	S	S	*	*			trans	-86.5	102.9	163.4	-86.9	153.4	0	0	0	107.6	K433 L437	K433-L435 PolarHBondContact O-N 3.33Å; L435-L437 PolarHBondContact O-N 3.13Å
436	S	28.4	Very low	34.7	Very low	110 Å²	110	136.6 Å²	136.6	77%	0.769	72%	0.716	S	S	*	*			trans	-70.2	98.3	169.7	51.7	0	0	0	0	109.4
437	L	27.7	Very low	37.3	Very low	149 Å²	149	131.8 Å²	131.8	78%	0.78	70%	0.695	S	S	*	*			trans	-110.2	100.2	156.9	-127.1	85.1	0	0	0	107.5	L435 V439	L435-L437 PolarHBondContact O-N 3.13Å; L437-V439 HydrophobicContact CD2-CG2 4.29Å; L437-V439 PolarHBondContact O-N 2.94Å; L437-V439 VanDerWaalsContact O-N 3.11Å
438	A	27.3	Very low	39.9	Very low	105 Å²	105	129.3 Å²	129.3	87%	0.868	68%	0.678	S	S	*	*			trans	-68.7	99.8	166.6	0	0	0	0	0	108
439	V	27	Very low	42.8	Very low	97 Å²	97	124 Å²	124	59%	0.588	65%	0.646	S	S	*	*			trans	-122.1	86.8	158.2	-176.9	0	0	0	0	105.2	L437 T441	L437-V439 HydrophobicContact CD2-CG2 4.29Å; L437-V439 PolarHBondContact O-N 2.94Å; L437-V439 VanDerWaalsContact O-N 3.11Å; V439-T441 HydrophobicContact CG1-CG2 3.72Å; V439-T441 PolarHBondContact O-N 2.82Å
440	C	26.2	Very low	45.6	Very low	116 Å²	116	125 Å²	125	78%	0.784	63%	0.633	S	S	*	*			trans	-71.7	77.1	163.9	-175.1	0	0	0	0	106.6	Q442	C440-Q442 VanDerWaalsContact C-N 3.27Å; C440-Q442 PolarHBondContact O-N 2.96Å
441	T	34.1	Very low	48.3	Very low	81 Å²	81	120.9 Å²	120.9	50%	0.497	60%	0.604	S	S	.	*			trans	-70.7	96.3	160.4	31	0	0	0	0	105.7	V439 H443	V439-T441 HydrophobicContact CG1-CG2 3.72Å; V439-T441 PolarHBondContact O-N 2.82Å; T441-H443 VanDerWaalsContact C-N 3.26Å; T441-H443 PolarHBondContact O-N 2.96Å; T441-H443 PolarHBondContact O-ND1 2.66Å; T441-H443 PolarHBondContact OG1-CE1 2.96Å
442	Q	42.2	Very low	50.9	Low	138 Å²	138	116.1 Å²	116.1	65%	0.645	58%	0.577	S	S	*	*			trans	-59.4	97.7	162.8	-70.5	176.4	-27.3	0	0	106.5	C440 F444	C440-Q442 VanDerWaalsContact C-N 3.27Å; C440-Q442 PolarHBondContact O-N 2.96Å; Q442-F444 VanDerWaalsContact C-N 3.35Å; Q442-F444 HydrophobicContact CB-CD2 3.96Å; Q442-F444 HydrophobicContact CB-CE2 3.4Å; Q442-F444 HydrophobicContact CB-CZ 3.93Å; Q442-F444 HydrophobicContact CG-CE2 4.26Å; Q442-F444 HydrophobicContact CG-CZ 4.43Å; Q442-F444 WeakPolarHBondContact O-CD2 3.43Å; Q442-F444 PolarHBondContact O-N 3.26Å; Q442-F444 VanDerWaalsContact O-N 3.07Å
443	H	54.8	Low	53.8	Low	100 Å²	100	107.1 Å²	107.1	46%	0.463	55%	0.552	S	S	.	*			trans	-80.4	90	177.5	-65.7	86	0	0	0	106.9	T441 R676	T441-H443 VanDerWaalsContact C-N 3.26Å; T441-H443 PolarHBondContact O-N 2.96Å; T441-H443 PolarHBondContact O-ND1 2.66Å; T441-H443 PolarHBondContact OG1-CE1 2.96Å; H443-R676 WeakPolarHBondContact O-CD 3.07Å
444	F	56.8	Low	56.9	Low	89 Å²	89	102.2 Å²	102.2	39%	0.39	54%	0.535	S	S	.	.	B	Isolated β-bridge	trans	-74.4	141.3	170.7	-66.8	-78.5	0	0	0	109.5	Q442 F446	Q442-F444 VanDerWaalsContact C-N 3.35Å; Q442-F444 HydrophobicContact CB-CD2 3.96Å; Q442-F444 HydrophobicContact CB-CE2 3.4Å; Q442-F444 HydrophobicContact CB-CZ 3.93Å; Q442-F444 HydrophobicContact CG-CE2 4.26Å; Q442-F444 HydrophobicContact CG-CZ 4.43Å; Q442-F444 WeakPolarHBondContact O-CD2 3.43Å; Q442-F444 PolarHBondContact O-N 3.26Å; Q442-F444 VanDerWaalsContact O-N 3.07Å; F444-F446 PolarHBondContact O-N 3.12Å
445	F	65.7	Low	59.9	Low	13 Å²	13	91.4 Å²	91.4	6%	0.057	50%	0.501	C	S	.	.	P	Polyproline II helix	trans	-69.2	124.6	157.8	-94.5	-62.7	0	0	0	107.4	L447 I663 R676 E677 V695 L708 N709 L711	F445-L447 PolarHBondContact O-N 3.27Å; F445-I663 HydrophobicContact CD2-CD1 3.83Å; F445-I663 HydrophobicContact CE2-CB 4.1Å; F445-I663 HydrophobicContact CE2-CD1 3.51Å; F445-I663 HydrophobicContact CE2-CG1 4.38Å; F445-I663 HydrophobicContact CE2-CG2 4.26Å; F445-I663 HydrophobicContact CZ-CD1 4.44Å; F445-R676 HydrophobicContact CB-CB 4.42Å; F445-R676 HydrophobicContact CD2-CB 3.06Å; F445-R676 HydrophobicContact CD2-CG 3.53Å; F445-R676 HydrophobicContact CE2-CB 3.4Å; F445-R676 VanDerWaalsContact CE2-CB 3.4Å; F445-R676 HydrophobicContact CE2-CG 3.48Å; F445-R676 VanDerWaalsContact CE2-CG 3.48Å; F445-R676 HydrophobicContact CG-CB 3.87Å; F445-R676 HydrophobicContact CG-CG 4.12Å; F445-R676 HydrophobicContact CZ-CB 4.43Å; F445-R676 HydrophobicContact CZ-CG 4.07Å; F445-E677 PolarHBondContact N-O 2.89Å; F445-V695 HydrophobicContact CE1-CG2 4.22Å; F445-V695 HydrophobicContact CZ-CB 4.48Å; F445-V695 HydrophobicContact CZ-CG2 3.83Å; F445-L708 HydrophobicContact CB-CB 4.1Å; F445-L708 HydrophobicContact CB-CD1 3.89Å; F445-L708 HydrophobicContact CB-CD2 4.19Å; F445-L708 HydrophobicContact CB-CG 4.29Å; F445-L708 HydrophobicContact CD1-CB 3.72Å; F445-L708 HydrophobicContact CD1-CD1 4.32Å; F445-L708 HydrophobicContact CD2-CD1 3.64Å; F445-L708 HydrophobicContact CE1-CB 4.22Å; F445-L708 HydrophobicContact CE2-CD1 4.18Å; F445-L708 HydrophobicContact CG-CB 3.91Å; F445-L708 HydrophobicContact CG-CD1 3.73Å; F445-L708 HydrophobicContact CG-CG 4.34Å; F445-N709 VanDerWaalsContact CD1-O 3.22Å; F445-N709 WeakPolarHBondContact CD1-O 3.37Å; F445-N709 WeakPolarHBondContact CE1-O 3.41Å; F445-L711 HydrophobicContact CE1-CD2 3.59Å; F445-L711 HydrophobicContact CE1-CG 3.99Å; F445-L711 HydrophobicContact CE2-CD2 3.98Å; F445-L711 HydrophobicContact CZ-CD1 4.47Å; F445-L711 HydrophobicContact CZ-CD2 3.16Å; F445-L711 HydrophobicContact CZ-CG 3.66Å
446	F	67.5	Low	62.7	Low	151 Å²	151	87.2 Å²	87.2	66%	0.662	49%	0.486	S	S	*	.	P	Polyproline II helix	trans	-73.3	116	167.4	-69.2	-79.3	0	0	0	108.4	F444 R448 N709	F444-F446 PolarHBondContact O-N 3.12Å; F446-R448 PolarHBondContact O-N 2.97Å; F446-R448 VanDerWaalsContact O-N 3.09Å; F446-N709 WeakPolarHBondContact CB-ND2 3.42Å; F446-N709 PolarHBondContact O-N 3.03Å; F446-N709 VanDerWaalsContact O-N 3.12Å
447	L	79.4	Confident	65.3	Low	74 Å²	74	82.9 Å²	82.9	39%	0.387	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	111.7	169.1	178.6	65.1	0	0	0	108.1	F445 S449 R450 L706 L708	F445-L447 PolarHBondContact O-N 3.27Å; L447-S449 WeakPolarHBondContact CD1-O 3.4Å; L447-R450 HydrophobicContact CD2-CB 4.29Å; L447-L706 HydrophobicContact CD1-CB 3.93Å; L447-L706 HydrophobicContact CD1-CD2 3.75Å; L447-L706 HydrophobicContact CD1-CG 4.3Å; L447-L706 HydrophobicContact CD2-CD2 4.49Å; L447-L708 HydrophobicContact CB-CD2 4.47Å; L447-L708 HydrophobicContact CD1-CD2 3.95Å
448	R	80.9	Confident	67.9	Low	138 Å²	138	77 Å²	77	52%	0.521	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	-51.8	179.6	-178.5	-179.5	175.3	78	-0.4	110.2	F446 I707	F446-R448 PolarHBondContact O-N 2.97Å; F446-R448 VanDerWaalsContact O-N 3.09Å; R448-I707 WeakPolarHBondContact CA-O 3.49Å; R448-I707 HydrophobicContact CB-CG2 4.38Å; R448-I707 VanDerWaalsContact CB-O 3.3Å; R448-I707 WeakPolarHBondContact CB-O 3.2Å; R448-I707 PolarHBondContact N-O 3.01Å
449	S	83.6	Confident	70.7	Confident	31 Å²	31	72.7 Å²	72.7	22%	0.217	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	153.7	179.7	58.1	0	0	0	0	110.9	L447 I707	L447-S449 WeakPolarHBondContact CD1-O 3.4Å; S449-I707 PolarHBondContact N-O 3.15Å; S449-I707 PolarHBondContact O-N 2.87Å
450	R	86.2	Confident	73.6	Confident	131 Å²	131	71.3 Å²	71.3	49%	0.494	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	130.7	173.4	173.9	177.1	-178.6	-156.2	-3.6	107.9	L447 C704 I705 L706	L447-R450 HydrophobicContact CD2-CB 4.29Å; R450-C704 HydrophobicContact CG-CB 4.3Å; R450-C704 PolarHBondContact NE-SG 3.38Å; R450-I705 WeakPolarHBondContact CA-O 3.3Å; R450-L706 HydrophobicContact CB-CD2 3.9Å; R450-L706 HydrophobicContact CG-CD2 3.7Å
451	F	86	Confident	76.9	Confident	29 Å²	29	65.8 Å²	65.8	13%	0.127	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	158.2	176.4	45.5	-91.3	0	0	0	110.5	L475 C704 I705 I707	F451-L475 HydrophobicContact CE2-CD1 3.85Å; F451-L475 HydrophobicContact CZ-CD1 3.71Å; F451-C704 CarbonylContact O-C 3.57Å; F451-C704 WeakPolarHBondContact O-CA 3.32Å; F451-C704 VanDerWaalsContact O-CB 3.31Å; F451-C704 WeakPolarHBondContact O-CB 3.22Å; F451-I705 HydrophobicContact CD2-CB 3.91Å; F451-I705 HydrophobicContact CD2-CD1 4Å; F451-I705 HydrophobicContact CD2-CG1 4.25Å; F451-I705 HydrophobicContact CE2-CB 3.65Å; F451-I705 HydrophobicContact CE2-CD1 3.55Å; F451-I705 HydrophobicContact CE2-CG1 4.05Å; F451-I705 HydrophobicContact CE2-CG2 3.83Å; F451-I705 HydrophobicContact CZ-CB 4.11Å; F451-I705 HydrophobicContact CZ-CG2 3.87Å; F451-I705 PolarHBondContact N-O 2.76Å; F451-I705 PolarHBondContact O-N 3.01Å; F451-I707 HydrophobicContact CE1-CD1 3.56Å; F451-I707 HydrophobicContact CE1-CG1 3.93Å; F451-I707 HydrophobicContact CZ-CD1 3.75Å; F451-I707 HydrophobicContact CZ-CG1 4.18Å
452	G	88.9	Confident	79.7	Confident	26 Å²	26	64.1 Å²	64.1	27%	0.268	33%	0.333	S	S	.	.			trans	97.1	150.6	-169.4	0	0	0	0	0	113.6	G459 H703 C704	G452-G459 VanDerWaalsContact CA-O 3.24Å; G452-G459 WeakPolarHBondContact CA-O 3.41Å; G452-H703 CarbonylContact C-O 3.47Å; G452-H703 VanDerWaalsContact C-O 3.27Å; G452-C704 WeakPolarHBondContact O-CB 3.27Å
453	S	88.3	Confident	82.1	Confident	58 Å²	58	58.4 Å²	58.4	41%	0.406	31%	0.308	S	S	.	.			trans	-151	166.4	176.8	57.1	0	0	0	0	108.8	G455 Q460 F461 H703	S453-G455 PolarHBondContact O-N 2.84Å; S453-Q460 CarbonylContact O-C 3.29Å; S453-Q460 VanDerWaalsContact O-CA 3.28Å; S453-Q460 WeakPolarHBondContact O-CA 3.31Å; S453-Q460 WeakPolarHBondContact O-CB 3.33Å; S453-F461 PolarHBondContact O-N 3.17Å; S453-H703 CarbonylContact C-O 3.47Å; S453-H703 WeakPolarHBondContact CA-O 3.26Å; S453-H703 PolarHBondContact N-O 2.89Å; S453-H703 VanDerWaalsContact N-O 3.09Å
454	N	90.4	Very high	84	Confident	97 Å²	97	53.7 Å²	53.7	52%	0.519	29%	0.286	S	S	.	.	B	Isolated β-bridge	trans	-65.1	133.2	176.4	-172.9	32.4	0	0	0	110.7	F461 H703	N454-F461 WeakPolarHBondContact CA-O 3.42Å; N454-F461 PolarHBondContact OD1-O 2.96Å; N454-H703 HydrophobicContact CB-CB 3.98Å; N454-H703 PolarHBondContact OD1-CE1 2.78Å; N454-H703 PolarHBondContact OD1-ND1 3.22Å; N454-H703 VanDerWaalsContact OD1-ND1 3.12Å
455	G	89.5	Confident	85.7	Confident	20 Å²	20	50.6 Å²	50.6	21%	0.206	27%	0.273	C	S	.	.	S	Bend	trans	150.7	-177.7	174.8	0	0	0	0	0	113.5	S453 Q460 F461 N482	S453-G455 PolarHBondContact O-N 2.84Å; G455-Q460 CarbonylContact O-C 3.57Å; G455-F461 PolarHBondContact N-O 3.46Å; G455-F461 VanDerWaalsContact N-O 3.16Å; G455-F461 CarbonylContact O-C 3.6Å; G455-F461 VanDerWaalsContact O-C 3.29Å; G455-F461 PolarHBondContact O-N 3.05Å; G455-N482 PolarHBondContact O-ND2 2.83Å
456	S	86.2	Confident	87.1	Confident	79 Å²	79	50 Å²	50	55%	0.552	27%	0.271	S	S	*	.	S	Bend	trans	-110.5	0.3	-179.5	61.3	0	0	0	0	113.3	N482 R484	S456-N482 WeakPolarHBondContact CB-OD1 3.22Å; S456-R484 VanDerWaalsContact C-NH2 3.27Å; S456-R484 VanDerWaalsContact O-CZ 3.23Å; S456-R484 PolarHBondContact O-NH1 2.92Å; S456-R484 PolarHBondContact O-NH2 3.31Å
457	G	83	Confident	88.5	Confident	18 Å²	18	43.3 Å²	43.3	19%	0.186	24%	0.242	C	C	.	.	S	Bend	trans	-73.7	175.5	174.7	0	0	0	0	0	112.8	G459 Q460 R484	G457-G459 PolarHBondContact O-N 3.49Å; G457-Q460 WeakPolarHBondContact O-CB 3.35Å; G457-Q460 PolarHBondContact O-N 3.33Å; G457-Q460 VanDerWaalsContact O-N 3.09Å; G457-R484 PolarHBondContact O-NH2 3.5Å
458	C	83	Confident	89.3	Confident	25 Å²	25	40.2 Å²	40.2	17%	0.169	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	134.4	179.3	-34.3	0	0	0	0	111.8	C277 Q460 Y494	C277-C458 HydrophobicContact CB-CB 3.35Å; C277-C458 WeakPolarHBondContact CB-SG 3.44Å; C277-C458 WeakPolarHBondContact SG-CB 2.96Å; C277-C458 CovalentContact SG-SG 2.02Å; C277-C458 PolarHBondContact SG-SG 2.9Å; C458-Q460 PolarHBondContact O-N 2.88Å; C458-Q460 VanDerWaalsContact O-N 3.11Å; C458-Y494 HydrophobicContact CB-CD1 3.67Å; C458-Y494 HydrophobicContact CB-CD2 3.71Å; C458-Y494 HydrophobicContact CB-CE1 3.74Å; C458-Y494 HydrophobicContact CB-CE2 3.81Å; C458-Y494 HydrophobicContact CB-CG 3.63Å
459	G	84.9	Confident	90	Very high	15 Å²	15	35.2 Å²	35.2	16%	0.155	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.1	1.3	-173.9	0	0	0	0	0	114.1	G452 G457 F461	G452-G459 VanDerWaalsContact CA-O 3.24Å; G452-G459 WeakPolarHBondContact CA-O 3.41Å; G457-G459 PolarHBondContact O-N 3.49Å; G459-F461 VanDerWaalsContact O-CE2 3.29Å; G459-F461 WeakPolarHBondContact O-CE2 3.08Å
460	Q	88.9	Confident	90.4	Very high	68 Å²	68	34.3 Å²	34.3	32%	0.318	20%	0.203	S	C	.	.			trans	-92.5	151.4	164.9	-55.5	-173.8	-37.6	0	0	109.4	S453 G455 G457 C458 R484 Q486	S453-Q460 CarbonylContact O-C 3.29Å; S453-Q460 VanDerWaalsContact O-CA 3.28Å; S453-Q460 WeakPolarHBondContact O-CA 3.31Å; S453-Q460 WeakPolarHBondContact O-CB 3.33Å; G455-Q460 CarbonylContact O-C 3.57Å; G457-Q460 WeakPolarHBondContact O-CB 3.35Å; G457-Q460 PolarHBondContact O-N 3.33Å; G457-Q460 VanDerWaalsContact O-N 3.09Å; C458-Q460 PolarHBondContact O-N 2.88Å; C458-Q460 VanDerWaalsContact O-N 3.11Å; Q460-R484 PolarHBondContact O-NH2 2.82Å; Q460-R484 VanDerWaalsContact O-NH2 3.1Å; Q460-Q486 PolarHBondContact O-NE2 3.02Å
461	F	93.8	Very high	90.4	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	20%	0.204	C	C	.	.	B	Isolated β-bridge	trans	-133.1	153.2	-176.3	-54.3	-80.5	0	0	0	111.1	S453 N454 G455 G459 P464 I477 D479 Q486 L488 H703 I705	S453-F461 PolarHBondContact O-N 3.17Å; N454-F461 WeakPolarHBondContact CA-O 3.42Å; N454-F461 PolarHBondContact OD1-O 2.96Å; G455-F461 PolarHBondContact N-O 3.46Å; G455-F461 VanDerWaalsContact N-O 3.16Å; G455-F461 CarbonylContact O-C 3.6Å; G455-F461 VanDerWaalsContact O-C 3.29Å; G455-F461 PolarHBondContact O-N 3.05Å; G459-F461 VanDerWaalsContact O-CE2 3.29Å; G459-F461 WeakPolarHBondContact O-CE2 3.08Å; F461-P464 HydrophobicContact CB-CB 4.02Å; F461-P464 HydrophobicContact CB-CG 3.79Å; F461-P464 HydrophobicContact CD1-CB 4.27Å; F461-P464 HydrophobicContact CG-CB 4.22Å; F461-P464 HydrophobicContact CG-CG 4.24Å; F461-I477 HydrophobicContact CD1-CG2 4.31Å; F461-I477 HydrophobicContact CE1-CB 4.29Å; F461-I477 HydrophobicContact CE1-CD1 4.29Å; F461-I477 HydrophobicContact CE1-CG2 4.1Å; F461-I477 HydrophobicContact CZ-CD1 4.31Å; F461-D479 WeakPolarHBondContact CA-OD1 3.2Å; F461-D479 HydrophobicContact CD1-CB 4.27Å; F461-Q486 HydrophobicContact CE1-CB 4.13Å; F461-L488 HydrophobicContact CE1-CD1 4.1Å; F461-L488 HydrophobicContact CZ-CD1 3.69Å; F461-L488 HydrophobicContact CZ-CD2 4.35Å; F461-H703 WeakPolarHBondContact O-CB 3.38Å; F461-H703 PolarHBondContact O-ND1 3.4Å; F461-H703 VanDerWaalsContact O-ND1 3.07Å; F461-I705 HydrophobicContact CE2-CD1 3.93Å; F461-I705 HydrophobicContact CE2-CG1 4.12Å; F461-I705 HydrophobicContact CZ-CD1 3.73Å; F461-I705 HydrophobicContact CZ-CG1 4.38Å
462	D	93.5	Very high	90.4	Very high	47 Å²	47	35.7 Å²	35.7	25%	0.251	22%	0.222	S	C	.	.	S	Bend	trans	-124.3	107.3	165.8	-172.2	0.2	0	0	0	109.9	D479 N481 N482 H703	D462-D479 PolarHBondContact N-OD1 3.09Å; D462-N481 HydrophobicContact CB-CB 3.72Å; D462-N481 WeakPolarHBondContact O-CB 3.44Å; D462-N481 PolarHBondContact O-N 3.03Å; D462-N481 PolarHBondContact OD1-ND2 2.71Å; D462-N481 WeakPolarHBondContact OD2-CB 3.39Å; D462-N481 PolarHBondContact OD2-ND2 3.49Å; D462-N482 PolarHBondContact N-ND2 2.81Å; D462-H703 WeakPolarHBondContact CA-ND1 3.37Å; D462-H703 IonicContact OD1-CE1 3.56Å; D462-H703 PolarHBondContact OD1-CE1 3.01Å; D462-H703 IonicContact OD1-ND1 3.39Å
463	S	92.3	Very high	90.3	Very high	18 Å²	18	36.2 Å²	36.2	13%	0.126	22%	0.218	C	C	.	.	S	Bend	trans	52	57.5	-176.3	176.7	0	0	0	0	113.2	H465 S480 N481 K700 H703	S463-H465 PolarHBondContact O-N 3.25Å; S463-S480 WeakPolarHBondContact O-CB 3.27Å; S463-S480 PolarHBondContact O-OG 3.31Å; S463-N481 WeakPolarHBondContact CB-ND2 3.39Å; S463-K700 WeakPolarHBondContact OG-CE 3.49Å; S463-H703 PolarHBondContact N-ND1 3.13Å
464	P	94.8	Very high	90.5	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	135.2	177	29.6	-35.4	0	0	0	110.1	F461 I477 L698	F461-P464 HydrophobicContact CB-CB 4.02Å; F461-P464 HydrophobicContact CB-CG 3.79Å; F461-P464 HydrophobicContact CD1-CB 4.27Å; F461-P464 HydrophobicContact CG-CB 4.22Å; F461-P464 HydrophobicContact CG-CG 4.24Å; P464-I477 HydrophobicContact CB-CG2 3.9Å; P464-L698 HydrophobicContact CB-CD1 4.19Å
465	H	93.3	Very high	90.8	Very high	24 Å²	24	29 Å²	29	11%	0.111	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	-62.1	-165.4	-162.1	-70.3	0	0	0	114.1	S463 A478 S480 R512 S685 K700	S463-H465 PolarHBondContact O-N 3.25Å; H465-A478 PolarHBondContact N-O 3.42Å; H465-S480 WeakPolarHBondContact CB-OG 3.43Å; H465-R512 PolarHBondContact ND1-O 3.35Å; H465-S685 WeakPolarHBondContact O-CB 3.41Å; H465-S685 PolarHBondContact O-OG 3.07Å; H465-K700 PolarHBondContact CD2-NZ 3.29Å
466	G	94.5	Very high	91.1	Very high	2 Å²	2	28.3 Å²	28.3	2%	0.021	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	147.5	-179.5	0	0	0	0	0	110.3	A478 R512	G466-A478 WeakPolarHBondContact O-CB 3.31Å; G466-A478 PolarHBondContact O-N 3.38Å; G466-R512 VanDerWaalsContact CA-O 3.24Å; G466-R512 WeakPolarHBondContact CA-O 3.31Å; G466-R512 PolarHBondContact N-O 3.22Å
467	F	97.5	Very high	91.7	Very high	10 Å²	10	24.5 Å²	24.5	4%	0.044	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	158.5	173.5	74.1	-61.3	0	0	0	111.7	L475 I476 I477 Q688 V696 L698	F467-L475 HydrophobicContact CD2-CD2 4.4Å; F467-L475 HydrophobicContact CE2-CD2 4.46Å; F467-I476 CarbonylContact C-O 3.29Å; F467-I476 WeakPolarHBondContact CA-O 3.45Å; F467-I476 VanDerWaalsContact CB-O 3.25Å; F467-I476 WeakPolarHBondContact CB-O 3.43Å; F467-I477 HydrophobicContact CB-CB 4.3Å; F467-I477 HydrophobicContact CB-CG1 3.83Å; F467-Q688 HydrophobicContact CD1-CG 4.42Å; F467-Q688 HydrophobicContact CD2-CB 4.48Å; F467-Q688 HydrophobicContact CD2-CG 3.91Å; F467-Q688 HydrophobicContact CE1-CG 3.96Å; F467-Q688 HydrophobicContact CE2-CB 3.57Å; F467-Q688 HydrophobicContact CE2-CG 3.38Å; F467-Q688 HydrophobicContact CG-CG 4.4Å; F467-Q688 HydrophobicContact CZ-CB 3.63Å; F467-Q688 HydrophobicContact CZ-CG 3.4Å; F467-Q688 PolarHBondContact O-NE2 3.02Å; F467-V696 HydrophobicContact CE2-CB 3.87Å; F467-V696 HydrophobicContact CE2-CG1 3.54Å; F467-V696 HydrophobicContact CZ-CB 4.12Å; F467-V696 HydrophobicContact CZ-CG1 3.99Å; F467-V696 WeakPolarHBondContact CZ-O 3.46Å; F467-L698 HydrophobicContact CB-CD1 3.98Å; F467-L698 HydrophobicContact CB-CD2 4.43Å; F467-L698 HydrophobicContact CB-CG 4.39Å; F467-L698 HydrophobicContact CD1-CD1 3.52Å; F467-L698 HydrophobicContact CD1-CD2 4.1Å; F467-L698 HydrophobicContact CD1-CG 3.43Å; F467-L698 VanDerWaalsContact CD1-CG 3.43Å; F467-L698 HydrophobicContact CE1-CD1 4.34Å; F467-L698 HydrophobicContact CE1-CG 3.83Å; F467-L698 HydrophobicContact CG-CD1 3.98Å; F467-L698 HydrophobicContact CG-CD2 4.1Å; F467-L698 HydrophobicContact CG-CG 3.93Å
468	C	96.6	Very high	92.4	Very high	9 Å²	9	23.7 Å²	23.7	6%	0.061	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	165.1	169.6	63.6	0	0	0	0	110.6	I476	C468-I476 PolarHBondContact N-O 3.19Å; C468-I476 PolarHBondContact O-N 2.81Å
469	I	94.7	Very high	93	Very high	32 Å²	32	22.5 Å²	22.5	16%	0.164	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	131.5	177	-50.1	-170.1	0	0	0	108.7	D474 L475 Q688 T690 V696	I469-D474 CarbonylContact C-O 3.51Å; I469-D474 VanDerWaalsContact CA-O 3.31Å; I469-D474 WeakPolarHBondContact CA-O 3.42Å; I469-L475 HydrophobicContact CD1-CD2 3.87Å; I469-L475 HydrophobicContact CG1-CD2 3.71Å; I469-Q688 HydrophobicContact CD1-CB 3.57Å; I469-Q688 HydrophobicContact CD1-CG 4.49Å; I469-Q688 HydrophobicContact CG1-CB 3.71Å; I469-Q688 HydrophobicContact CG1-CG 4.1Å; I469-T690 HydrophobicContact CD1-CG2 3.88Å; I469-V696 HydrophobicContact CD1-CB 4.41Å; I469-V696 HydrophobicContact CD1-CG2 3.93Å
470	S	92	Very high	93.5	Very high	13 Å²	13	22 Å²	22	9%	0.091	12%	0.118	C	C	.	.			trans	-78.1	168.1	175.4	87.4	0	0	0	0	112.1	D472 D473 D474 L516	S470-D472 PolarHBondContact O-N 2.9Å; S470-D472 PolarHBondContact OG-N 3.15Å; S470-D472 VanDerWaalsContact OG-N 3.09Å; S470-D473 PolarHBondContact O-N 3.49Å; S470-D473 VanDerWaalsContact O-N 3.12Å; S470-D474 PolarHBondContact N-O 3.41Å; S470-D474 WeakPolarHBondContact OG-CB 3.25Å; S470-D474 PolarHBondContact OG-N 3.47Å; S470-D474 VanDerWaalsContact OG-N 3.1Å; S470-L516 VanDerWaalsContact CA-CD1 3.41Å
471	N	85.7	Confident	93.8	Very high	96 Å²	96	21.7 Å²	21.7	51%	0.513	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-19	172.9	-75	-39.5	0	0	0	113.7	D473 K691	N471-D473 VanDerWaalsContact C-N 3.33Å; N471-K691 PolarHBondContact O-NZ 3.06Å
472	D	86	Confident	93.7	Very high	92 Å²	92	23.3 Å²	23.3	49%	0.492	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.4	18.7	177.8	-61.7	-30.3	0	0	0	111.9	S470 D474 R540	S470-D472 PolarHBondContact O-N 2.9Å; S470-D472 PolarHBondContact OG-N 3.15Å; S470-D472 VanDerWaalsContact OG-N 3.09Å; D472-D474 VanDerWaalsContact C-N 3.27Å; D472-D474 PolarHBondContact O-N 3.5Å; D472-R540 IonicContact OD2-CZ 4Å; D472-R540 IonicContact OD2-NH1 3.2Å; D472-R540 PolarHBondContact OD2-NH1 3.01Å; D472-R540 IonicContact OD2-NH2 2.71Å; D472-R540 PolarHBondContact OD2-NH2 3.27Å
473	D	87.9	Confident	93.8	Very high	37 Å²	37	21.9 Å²	21.9	20%	0.198	12%	0.119	C	C	.	.	S	Bend	trans	57.3	36.3	-177.9	-65.8	-55.2	0	0	0	113.7	S470 N471 I490	S470-D473 PolarHBondContact O-N 3.49Å; S470-D473 VanDerWaalsContact O-N 3.12Å; N471-D473 VanDerWaalsContact C-N 3.33Å; D473-I490 HydrophobicContact CB-CB 4.35Å; D473-I490 HydrophobicContact CB-CG2 4.16Å; D473-I490 WeakPolarHBondContact O-CB 3.31Å; D473-I490 PolarHBondContact O-N 3.04Å
474	D	92.4	Very high	93.9	Very high	4 Å²	4	21.8 Å²	21.8	2%	0.021	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	130	170.7	-65.1	-34.8	0	0	0	111.2	I469 S470 D472 V487 L488 K495 R540	I469-D474 CarbonylContact C-O 3.51Å; I469-D474 VanDerWaalsContact CA-O 3.31Å; I469-D474 WeakPolarHBondContact CA-O 3.42Å; S470-D474 PolarHBondContact N-O 3.41Å; S470-D474 WeakPolarHBondContact OG-CB 3.25Å; S470-D474 PolarHBondContact OG-N 3.47Å; S470-D474 VanDerWaalsContact OG-N 3.1Å; D472-D474 VanDerWaalsContact C-N 3.27Å; D472-D474 PolarHBondContact O-N 3.5Å; D474-V487 HydrophobicContact CB-CG1 3.9Å; D474-L488 CarbonylContact C-O 3.48Å; D474-L488 WeakPolarHBondContact CA-O 3.36Å; D474-K495 WeakPolarHBondContact OD1-CD 3.5Å; D474-K495 WeakPolarHBondContact OD1-CE 3.28Å; D474-K495 IonicContact OD1-NZ 3.21Å; D474-K495 PolarHBondContact OD1-NZ 3.09Å; D474-K495 IonicContact OD2-NZ 3.42Å; D474-K495 PolarHBondContact OD2-NZ 3.44Å; D474-R540 IonicContact OD2-NH2 3.85Å
475	L	95.4	Very high	94.1	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	118.2	169.5	-55.6	-178.7	0	0	0	109	F451 F467 I469 I477 V487 L488 I490 V696 I705	F451-L475 HydrophobicContact CE2-CD1 3.85Å; F451-L475 HydrophobicContact CZ-CD1 3.71Å; F467-L475 HydrophobicContact CD2-CD2 4.4Å; F467-L475 HydrophobicContact CE2-CD2 4.46Å; I469-L475 HydrophobicContact CD1-CD2 3.87Å; I469-L475 HydrophobicContact CG1-CD2 3.71Å; L475-I477 HydrophobicContact CB-CD1 3.69Å; L475-I477 HydrophobicContact CB-CG1 4.35Å; L475-I477 WeakPolarHBondContact O-CD1 3.42Å; L475-V487 VanDerWaalsContact O-CA 3.31Å; L475-V487 WeakPolarHBondContact O-CA 3.35Å; L475-L488 PolarHBondContact N-O 2.95Å; L475-L488 PolarHBondContact O-N 3.26Å; L475-I490 HydrophobicContact CD1-CD1 4.23Å; L475-I490 HydrophobicContact CD2-CD1 3.71Å; L475-I490 HydrophobicContact CG-CD1 4.14Å; L475-V696 HydrophobicContact CD1-CG1 4.31Å; L475-V696 HydrophobicContact CD2-CG1 4.14Å; L475-I705 HydrophobicContact CD1-CD1 4.16Å; L475-I705 HydrophobicContact CD1-CG2 4.01Å
476	I	97.3	Very high	94.1	Very high	5 Å²	5	20.6 Å²	20.6	3%	0.026	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	111.3	175.4	-55.3	179.6	0	0	0	107.2	F467 C468 I485 V487 V514 L516 I523	F467-I476 CarbonylContact C-O 3.29Å; F467-I476 WeakPolarHBondContact CA-O 3.45Å; F467-I476 VanDerWaalsContact CB-O 3.25Å; F467-I476 WeakPolarHBondContact CB-O 3.43Å; C468-I476 PolarHBondContact N-O 3.19Å; C468-I476 PolarHBondContact O-N 2.81Å; I476-I485 HydrophobicContact CG2-CG2 3.45Å; I476-I485 VanDerWaalsContact CG2-CG2 3.45Å; I476-V487 HydrophobicContact CG1-CG1 4.26Å; I476-V487 HydrophobicContact CG1-CG2 4.16Å; I476-V487 HydrophobicContact CG2-CG2 4.27Å; I476-V514 HydrophobicContact CG2-CG2 3.84Å; I476-V514 VanDerWaalsContact O-CG1 3.3Å; I476-V514 WeakPolarHBondContact O-CG1 3.31Å; I476-L516 HydrophobicContact CD1-CD1 3.67Å; I476-L516 HydrophobicContact CD1-CD2 3.76Å; I476-L516 HydrophobicContact CD1-CG 3.83Å; I476-I523 HydrophobicContact CD1-CD1 4Å; I476-I523 HydrophobicContact CD1-CG1 4.04Å; I476-I523 HydrophobicContact CG2-CD1 4.29Å; I476-I523 HydrophobicContact CG2-CG2 4.14Å
477	I	97.8	Very high	94.1	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	130.1	-168	-57	110.5	0	0	0	110.8	F461 P464 F467 L475 D479 I485 Q486 L488 L698 I705	F461-I477 HydrophobicContact CD1-CG2 4.31Å; F461-I477 HydrophobicContact CE1-CB 4.29Å; F461-I477 HydrophobicContact CE1-CD1 4.29Å; F461-I477 HydrophobicContact CE1-CG2 4.1Å; F461-I477 HydrophobicContact CZ-CD1 4.31Å; P464-I477 HydrophobicContact CB-CG2 3.9Å; F467-I477 HydrophobicContact CB-CB 4.3Å; F467-I477 HydrophobicContact CB-CG1 3.83Å; L475-I477 HydrophobicContact CB-CD1 3.69Å; L475-I477 HydrophobicContact CB-CG1 4.35Å; L475-I477 WeakPolarHBondContact O-CD1 3.42Å; I477-D479 PolarHBondContact O-N 3.31Å; I477-I485 CarbonylContact O-C 3.56Å; I477-I485 VanDerWaalsContact O-CA 3.26Å; I477-I485 WeakPolarHBondContact O-CA 3.43Å; I477-Q486 PolarHBondContact N-O 2.84Å; I477-Q486 PolarHBondContact O-N 3.04Å; I477-L488 HydrophobicContact CD1-CD1 3.36Å; I477-L698 HydrophobicContact CG1-CD2 4.23Å; I477-L698 HydrophobicContact CG2-CD1 4.07Å; I477-L698 HydrophobicContact CG2-CD2 4.14Å; I477-I705 HydrophobicContact CD1-CD1 3.69Å; I477-I705 HydrophobicContact CG1-CD1 4.09Å
478	A	97.7	Very high	93.8	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	103.7	166.3	0	0	0	0	0	110.2	H465 G466 S480 I485 P511 V514	H465-A478 PolarHBondContact N-O 3.42Å; G466-A478 WeakPolarHBondContact O-CB 3.31Å; G466-A478 PolarHBondContact O-N 3.38Å; A478-S480 PolarHBondContact O-N 3.29Å; A478-I485 HydrophobicContact CB-CD1 3.89Å; A478-P511 HydrophobicContact CB-CB 4Å; A478-P511 HydrophobicContact CB-CG 4.32Å; A478-V514 HydrophobicContact CB-CG1 4.42Å
479	D	96.4	Very high	93.4	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	81.8	179.3	-171.4	9.4	0	0	0	108.9	F461 D462 I477 N481 N482 H483 R484 Q486	F461-D479 WeakPolarHBondContact CA-OD1 3.2Å; F461-D479 HydrophobicContact CD1-CB 4.27Å; D462-D479 PolarHBondContact N-OD1 3.09Å; I477-D479 PolarHBondContact O-N 3.31Å; D479-N481 PolarHBondContact O-N 3.19Å; D479-N482 HydrophobicContact CB-CB 4.44Å; D479-N482 VanDerWaalsContact CG-ND2 3.34Å; D479-N482 CarbonylContact O-C 3.48Å; D479-N482 PolarHBondContact O-N 3.13Å; D479-N482 PolarHBondContact OD1-ND2 3.44Å; D479-N482 WeakPolarHBondContact OD2-CB 3.48Å; D479-N482 PolarHBondContact OD2-ND2 3.4Å; D479-H483 PolarHBondContact O-N 2.84Å; D479-H483 VanDerWaalsContact O-N 3.11Å; D479-R484 HydrophobicContact CB-CG 3.85Å; D479-R484 PolarHBondContact N-O 2.94Å; D479-R484 PolarHBondContact O-N 2.95Å; D479-R484 IonicContact OD2-CZ 3.73Å; D479-R484 IonicContact OD2-NE 2.78Å; D479-R484 PolarHBondContact OD2-NE 2.83Å; D479-R484 IonicContact OD2-NH2 3.19Å; D479-R484 PolarHBondContact OD2-NH2 2.88Å; D479-Q486 PolarHBondContact OD2-NE2 3.04Å
480	S	95.5	Very high	93.1	Very high	6 Å²	6	19.3 Å²	19.3	4%	0.042	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-48.6	-158.2	-62.9	0	0	0	0	114.1	S463 H465 A478 N482 H483 Y510 P511	S463-S480 WeakPolarHBondContact O-CB 3.27Å; S463-S480 PolarHBondContact O-OG 3.31Å; H465-S480 WeakPolarHBondContact CB-OG 3.43Å; A478-S480 PolarHBondContact O-N 3.29Å; S480-N482 VanDerWaalsContact C-N 3.35Å; S480-H483 PolarHBondContact O-N 2.94Å; S480-Y510 WeakPolarHBondContact O-CA 3.41Å; S480-Y510 WeakPolarHBondContact O-CD1 3.36Å; S480-P511 WeakPolarHBondContact CB-O 3.4Å; S480-P511 PolarHBondContact OG-O 3.28Å
481	N	94.5	Very high	92.6	Very high	61 Å²	61	24.7 Å²	24.7	33%	0.326	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-19.2	-175.5	-71.3	-12.5	0	0	0	112.8	D462 S463 D479 H483 Y510	D462-N481 HydrophobicContact CB-CB 3.72Å; D462-N481 WeakPolarHBondContact O-CB 3.44Å; D462-N481 PolarHBondContact O-N 3.03Å; D462-N481 PolarHBondContact OD1-ND2 2.71Å; D462-N481 WeakPolarHBondContact OD2-CB 3.39Å; D462-N481 PolarHBondContact OD2-ND2 3.49Å; S463-N481 WeakPolarHBondContact CB-ND2 3.39Å; D479-N481 PolarHBondContact O-N 3.19Å; N481-H483 VanDerWaalsContact C-N 3.27Å; N481-H483 PolarHBondContact O-CD2 2.78Å; N481-Y510 WeakPolarHBondContact OD1-CE1 3.02Å
482	N	92.6	Very high	92.5	Very high	33 Å²	33	20.9 Å²	20.9	18%	0.176	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	1.4	169.3	-70.1	-40	0	0	0	112.7	G455 S456 D462 D479 S480 R484	G455-N482 PolarHBondContact O-ND2 2.83Å; S456-N482 WeakPolarHBondContact CB-OD1 3.22Å; D462-N482 PolarHBondContact N-ND2 2.81Å; D479-N482 HydrophobicContact CB-CB 4.44Å; D479-N482 VanDerWaalsContact CG-ND2 3.34Å; D479-N482 CarbonylContact O-C 3.48Å; D479-N482 PolarHBondContact O-N 3.13Å; D479-N482 PolarHBondContact OD1-ND2 3.44Å; D479-N482 WeakPolarHBondContact OD2-CB 3.48Å; D479-N482 PolarHBondContact OD2-ND2 3.4Å; S480-N482 VanDerWaalsContact C-N 3.35Å; N482-R484 VanDerWaalsContact C-N 3.25Å; N482-R484 HydrophobicContact CB-CG 3.94Å; N482-R484 PolarHBondContact ND2-NH2 2.95Å; N482-R484 PolarHBondContact O-N 3.19Å
483	H	94.5	Very high	92.3	Very high	18 Å²	18	19.2 Å²	19.2	8%	0.083	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.4	36.4	175.2	-59.7	-92.9	0	0	0	114.4	D479 S480 N481 P501 L508 W509 Y510	D479-H483 PolarHBondContact O-N 2.84Å; D479-H483 VanDerWaalsContact O-N 3.11Å; S480-H483 PolarHBondContact O-N 2.94Å; N481-H483 VanDerWaalsContact C-N 3.27Å; N481-H483 PolarHBondContact O-CD2 2.78Å; H483-P501 HydrophobicContact CB-CB 3.91Å; H483-P501 HydrophobicContact CB-CG 3.9Å; H483-L508 VanDerWaalsContact O-CB 3.31Å; H483-L508 WeakPolarHBondContact O-CB 3.33Å; H483-W509 AromaticContact CE1-CD2 3.67Å; H483-W509 AromaticContact CE1-CE3 3.27Å; H483-W509 AromaticContact CE1-CH2 3.75Å; H483-W509 AromaticContact CE1-CZ3 3.31Å; H483-W509 WeakPolarHBondContact CE1-CZ3 3.46Å; H483-W509 AromaticContact ND1-CD2 3.84Å; H483-W509 AromaticContact ND1-CE3 3.31Å; H483-W509 VanDerWaalsContact ND1-CE3 3.31Å; H483-W509 AromaticContact ND1-CZ3 3.72Å; H483-W509 AromaticContact NE2-CZ3 3.89Å; H483-Y510 AromaticContact CE1-CD1 3.93Å; H483-Y510 AromaticContact CE1-CD2 3.54Å; H483-Y510 AromaticContact CE1-CE1 3.78Å; H483-Y510 AromaticContact CE1-CE2 3.41Å; H483-Y510 VanDerWaalsContact CE1-CE2 3.41Å; H483-Y510 WeakPolarHBondContact CE1-CE2 3.42Å; H483-Y510 AromaticContact CE1-CG 3.81Å; H483-Y510 AromaticContact CE1-CZ 3.51Å; H483-Y510 PolarHBondContact ND1-N 3.27Å; H483-Y510 VanDerWaalsContact ND1-N 3.16Å; H483-Y510 AromaticContact NE2-CE1 3.83Å; H483-Y510 AromaticContact NE2-CZ 3.67Å
484	R	95.3	Very high	92.1	Very high	15 Å²	15	18.2 Å²	18.2	6%	0.057	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	166	-175	67.1	-176.6	178.7	-173	-2.7	112.4	S456 G457 Q460 D479 N482 Q486 Q497 F498	S456-R484 VanDerWaalsContact C-NH2 3.27Å; S456-R484 VanDerWaalsContact O-CZ 3.23Å; S456-R484 PolarHBondContact O-NH1 2.92Å; S456-R484 PolarHBondContact O-NH2 3.31Å; G457-R484 PolarHBondContact O-NH2 3.5Å; Q460-R484 PolarHBondContact O-NH2 2.82Å; Q460-R484 VanDerWaalsContact O-NH2 3.1Å; D479-R484 HydrophobicContact CB-CG 3.85Å; D479-R484 PolarHBondContact N-O 2.94Å; D479-R484 PolarHBondContact O-N 2.95Å; D479-R484 IonicContact OD2-CZ 3.73Å; D479-R484 IonicContact OD2-NE 2.78Å; D479-R484 PolarHBondContact OD2-NE 2.83Å; D479-R484 IonicContact OD2-NH2 3.19Å; D479-R484 PolarHBondContact OD2-NH2 2.88Å; N482-R484 VanDerWaalsContact C-N 3.25Å; N482-R484 HydrophobicContact CB-CG 3.94Å; N482-R484 PolarHBondContact ND2-NH2 2.95Å; N482-R484 PolarHBondContact O-N 3.19Å; R484-Q486 HydrophobicContact CG-CG 4.35Å; R484-Q497 VanDerWaalsContact CZ-OE1 3.29Å; R484-F498 CarbonylContact C-O 3.54Å; R484-F498 WeakPolarHBondContact CA-O 3.3Å; R484-F498 WeakPolarHBondContact CB-O 3.37Å
485	I	97.8	Very high	91.6	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	132.3	161.4	-56.9	-53.2	0	0	0	108	I476 I477 A478 Q497 F498 L508 P511 V525	I476-I485 HydrophobicContact CG2-CG2 3.45Å; I476-I485 VanDerWaalsContact CG2-CG2 3.45Å; I477-I485 CarbonylContact O-C 3.56Å; I477-I485 VanDerWaalsContact O-CA 3.26Å; I477-I485 WeakPolarHBondContact O-CA 3.43Å; A478-I485 HydrophobicContact CB-CD1 3.89Å; I485-Q497 CarbonylContact O-C 3.5Å; I485-Q497 WeakPolarHBondContact O-CA 3.47Å; I485-Q497 WeakPolarHBondContact O-CB 3.24Å; I485-F498 HydrophobicContact CB-CD1 4.23Å; I485-F498 HydrophobicContact CB-CD2 4.29Å; I485-F498 HydrophobicContact CB-CE1 3.75Å; I485-F498 HydrophobicContact CB-CE2 3.8Å; I485-F498 HydrophobicContact CB-CG 4.49Å; I485-F498 HydrophobicContact CB-CZ 3.52Å; I485-F498 HydrophobicContact CG1-CD2 4.42Å; I485-F498 HydrophobicContact CG1-CE1 4.44Å; I485-F498 HydrophobicContact CG1-CE2 3.67Å; I485-F498 HydrophobicContact CG1-CZ 3.7Å; I485-F498 HydrophobicContact CG2-CE1 3.73Å; I485-F498 HydrophobicContact CG2-CE2 4.46Å; I485-F498 HydrophobicContact CG2-CZ 3.69Å; I485-F498 PolarHBondContact N-O 3.4Å; I485-F498 PolarHBondContact O-N 3.22Å; I485-L508 HydrophobicContact CD1-CD1 4.34Å; I485-L508 HydrophobicContact CG1-CD1 3.8Å; I485-P511 HydrophobicContact CD1-CB 4.04Å; I485-P511 HydrophobicContact CD1-CG 4.31Å; I485-V525 HydrophobicContact CD1-CG1 3.94Å; I485-V525 HydrophobicContact CD1-CG2 3.88Å; I485-V525 HydrophobicContact CG1-CG2 3.84Å
486	Q	94.8	Very high	91.1	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	141	170.1	-76.4	-168.3	75.2	0	0	110.6	Q460 F461 I477 D479 R484 L488 Y494 Q497	Q460-Q486 PolarHBondContact O-NE2 3.02Å; F461-Q486 HydrophobicContact CE1-CB 4.13Å; I477-Q486 PolarHBondContact N-O 2.84Å; I477-Q486 PolarHBondContact O-N 3.04Å; D479-Q486 PolarHBondContact OD2-NE2 3.04Å; R484-Q486 HydrophobicContact CG-CG 4.35Å; Q486-L488 HydrophobicContact CB-CD1 4.07Å; Q486-Y494 HydrophobicContact CG-CE2 4.44Å; Q486-Q497 HydrophobicContact CG-CB 3.85Å
487	V	94.3	Very high	90.8	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	124.8	177.4	-173.9	0	0	0	0	109.4	D474 L475 I476 K495 Y496	D474-V487 HydrophobicContact CB-CG1 3.9Å; L475-V487 VanDerWaalsContact O-CA 3.31Å; L475-V487 WeakPolarHBondContact O-CA 3.35Å; I476-V487 HydrophobicContact CG1-CG1 4.26Å; I476-V487 HydrophobicContact CG1-CG2 4.16Å; I476-V487 HydrophobicContact CG2-CG2 4.27Å; V487-K495 WeakPolarHBondContact O-CB 3.46Å; V487-K495 PolarHBondContact O-N 2.81Å; V487-Y496 HydrophobicContact CB-CD1 4.4Å; V487-Y496 HydrophobicContact CB-CD2 4.35Å; V487-Y496 HydrophobicContact CB-CE1 3.99Å; V487-Y496 HydrophobicContact CB-CE2 3.95Å; V487-Y496 HydrophobicContact CG1-CE1 4.02Å; V487-Y496 HydrophobicContact CG2-CD2 4.17Å; V487-Y496 HydrophobicContact CG2-CE1 4.36Å; V487-Y496 HydrophobicContact CG2-CE2 3.5Å; V487-Y496 VanDerWaalsContact CG2-CE2 3.5Å; V487-Y496 PolarHBondContact N-O 3.04Å; V487-Y496 PolarHBondContact O-N 3.45Å
488	L	90.4	Very high	90.3	Very high	2 Å²	2	27.3 Å²	27.3	1%	0.01	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	154.5	179.4	-61.9	95.5	0	0	0	110.2	F461 D474 L475 I477 Q486 L493	F461-L488 HydrophobicContact CE1-CD1 4.1Å; F461-L488 HydrophobicContact CZ-CD1 3.69Å; F461-L488 HydrophobicContact CZ-CD2 4.35Å; D474-L488 CarbonylContact C-O 3.48Å; D474-L488 WeakPolarHBondContact CA-O 3.36Å; L475-L488 PolarHBondContact N-O 2.95Å; L475-L488 PolarHBondContact O-N 3.26Å; I477-L488 HydrophobicContact CD1-CD1 3.36Å; Q486-L488 HydrophobicContact CB-CD1 4.07Å; L488-L493 CarbonylContact C-O 3.59Å; L488-L493 WeakPolarHBondContact CA-O 3.39Å; L488-L493 WeakPolarHBondContact CB-O 3.46Å
489	S	88.1	Confident	89.9	Confident	8 Å²	8	28.6 Å²	28.6	6%	0.056	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	161.7	166.3	83.6	0	0	0	0	111.1	Q491 G492 L493	S489-Q491 VanDerWaalsContact CB-OE1 3.31Å; S489-Q491 PolarHBondContact O-N 2.66Å; S489-Q491 VanDerWaalsContact O-N 3.08Å; S489-Q491 PolarHBondContact OG-N 3.47Å; S489-Q491 VanDerWaalsContact OG-N 3.16Å; S489-Q491 PolarHBondContact OG-OE1 2.83Å; S489-G492 PolarHBondContact O-N 3.16Å; S489-L493 PolarHBondContact N-O 2.66Å; S489-L493 PolarHBondContact OG-N 3.08Å
490	I	87.7	Confident	89.2	Confident	16 Å²	16	32.4 Å²	32.4	8%	0.082	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-16.2	171.9	-162.1	64.4	0	0	0	113.4	D473 L475 G492 T690 V696 I707	D473-I490 HydrophobicContact CB-CB 4.35Å; D473-I490 HydrophobicContact CB-CG2 4.16Å; D473-I490 WeakPolarHBondContact O-CB 3.31Å; D473-I490 PolarHBondContact O-N 3.04Å; L475-I490 HydrophobicContact CD1-CD1 4.23Å; L475-I490 HydrophobicContact CD2-CD1 3.71Å; L475-I490 HydrophobicContact CG-CD1 4.14Å; I490-G492 VanDerWaalsContact C-N 3.29Å; I490-T690 HydrophobicContact CD1-CG2 3.54Å; I490-T690 HydrophobicContact CG1-CG2 3.95Å; I490-V696 HydrophobicContact CD1-CG2 3.69Å; I490-I707 HydrophobicContact CD1-CD1 3.58Å; I490-I707 HydrophobicContact CG1-CD1 3.78Å; I490-I707 WeakPolarHBondContact O-CD1 3.35Å
491	Q	83	Confident	88.8	Confident	125 Å²	125	35.7 Å²	35.7	58%	0.584	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-0.6	172.5	-58	78.7	18.4	0	0	113.2	S489	S489-Q491 VanDerWaalsContact CB-OE1 3.31Å; S489-Q491 PolarHBondContact O-N 2.66Å; S489-Q491 VanDerWaalsContact O-N 3.08Å; S489-Q491 PolarHBondContact OG-N 3.47Å; S489-Q491 VanDerWaalsContact OG-N 3.16Å; S489-Q491 PolarHBondContact OG-OE1 2.83Å
492	G	83.4	Confident	88.4	Confident	17 Å²	17	33.6 Å²	33.6	18%	0.175	19%	0.185	C	C	.	.	S	Bend	trans	83.6	13.1	-179.2	0	0	0	0	0	114.5	S489 I490	S489-G492 PolarHBondContact O-N 3.16Å; I490-G492 VanDerWaalsContact C-N 3.29Å
493	L	81.9	Confident	88.1	Confident	57 Å²	57	38.1 Å²	38.1	30%	0.298	20%	0.199	S	C	.	.			trans	-77.2	123.4	173.7	-65.1	171.5	0	0	0	109.2	A281 A285 L488 S489	A281-L493 HydrophobicContact CB-CD2 3.7Å; A285-L493 HydrophobicContact CB-CD2 4.44Å; L488-L493 CarbonylContact C-O 3.59Å; L488-L493 WeakPolarHBondContact CA-O 3.39Å; L488-L493 WeakPolarHBondContact CB-O 3.46Å; S489-L493 PolarHBondContact N-O 2.66Å; S489-L493 PolarHBondContact OG-N 3.08Å
494	Y	83.9	Confident	87.7	Confident	16 Å²	16	40 Å²	40	6%	0.063	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	135.4	173.4	175.1	-101	0	0	0	110.9	H274 C277 C458 Q486 Y496 Q497	H274-Y494 AromaticContact CE1-CD1 3.86Å; H274-Y494 AromaticContact CE1-CE1 3.61Å; H274-Y494 AromaticContact ND1-CD1 3.77Å; H274-Y494 AromaticContact ND1-CE1 3.28Å; H274-Y494 VanDerWaalsContact ND1-CE1 3.28Å; H274-Y494 WeakPolarHBondContact ND1-CE1 3.22Å; C277-Y494 HydrophobicContact CB-CD1 4.28Å; C458-Y494 HydrophobicContact CB-CD1 3.67Å; C458-Y494 HydrophobicContact CB-CD2 3.71Å; C458-Y494 HydrophobicContact CB-CE1 3.74Å; C458-Y494 HydrophobicContact CB-CE2 3.81Å; C458-Y494 HydrophobicContact CB-CG 3.63Å; Q486-Y494 HydrophobicContact CG-CE2 4.44Å; Y494-Y496 VanDerWaalsContact OH-C 3.29Å; Y494-Y496 WeakPolarHBondContact OH-CA 3.33Å; Y494-Q497 HydrophobicContact CE2-CB 4.15Å; Y494-Q497 WeakPolarHBondContact OH-CB 3.36Å; Y494-Q497 VanDerWaalsContact OH-CG 3.25Å; Y494-Q497 WeakPolarHBondContact OH-CG 3.32Å; Y494-Q497 PolarHBondContact OH-N 2.72Å; Y494-Q497 VanDerWaalsContact OH-N 3.13Å
495	K	82.2	Confident	87.4	Confident	58 Å²	58	43.1 Å²	43.1	25%	0.252	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	-58.2	176	-66.9	-168.5	168.3	-171.3	0	112	H274 D474 V487	H274-K495 PolarHBondContact CE1-O 3.17Å; D474-K495 WeakPolarHBondContact OD1-CD 3.5Å; D474-K495 WeakPolarHBondContact OD1-CE 3.28Å; D474-K495 IonicContact OD1-NZ 3.21Å; D474-K495 PolarHBondContact OD1-NZ 3.09Å; D474-K495 IonicContact OD2-NZ 3.42Å; D474-K495 PolarHBondContact OD2-NZ 3.44Å; V487-K495 WeakPolarHBondContact O-CB 3.46Å; V487-K495 PolarHBondContact O-N 2.81Å
496	Y	84.7	Confident	86.8	Confident	51 Å²	51	44 Å²	44	20%	0.2	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.6	174	178.2	58.1	-88.4	0	0	0	109.9	V487 Y494 F498 R540	V487-Y496 HydrophobicContact CB-CD1 4.4Å; V487-Y496 HydrophobicContact CB-CD2 4.35Å; V487-Y496 HydrophobicContact CB-CE1 3.99Å; V487-Y496 HydrophobicContact CB-CE2 3.95Å; V487-Y496 HydrophobicContact CG1-CE1 4.02Å; V487-Y496 HydrophobicContact CG2-CD2 4.17Å; V487-Y496 HydrophobicContact CG2-CE1 4.36Å; V487-Y496 HydrophobicContact CG2-CE2 3.5Å; V487-Y496 VanDerWaalsContact CG2-CE2 3.5Å; V487-Y496 PolarHBondContact N-O 3.04Å; V487-Y496 PolarHBondContact O-N 3.45Å; Y494-Y496 VanDerWaalsContact OH-C 3.29Å; Y494-Y496 WeakPolarHBondContact OH-CA 3.33Å; Y496-F498 HydrophobicContact CD2-CD1 4.38Å; Y496-F498 HydrophobicContact CE2-CD1 4.19Å; Y496-F498 HydrophobicContact CE2-CE1 4.36Å; Y496-R540 PolarHBondContact OH-O 3.27Å
497	Q	90.3	Very high	86.6	Confident	70 Å²	70	49.1 Å²	49.1	33%	0.327	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	160	174.3	74.5	-169.9	14.6	0	0	110.4	R484 I485 Q486 Y494	R484-Q497 VanDerWaalsContact CZ-OE1 3.29Å; I485-Q497 CarbonylContact O-C 3.5Å; I485-Q497 WeakPolarHBondContact O-CA 3.47Å; I485-Q497 WeakPolarHBondContact O-CB 3.24Å; Q486-Q497 HydrophobicContact CG-CB 3.85Å; Y494-Q497 HydrophobicContact CE2-CB 4.15Å; Y494-Q497 WeakPolarHBondContact OH-CB 3.36Å; Y494-Q497 VanDerWaalsContact OH-CG 3.25Å; Y494-Q497 WeakPolarHBondContact OH-CG 3.32Å; Y494-Q497 PolarHBondContact OH-N 2.72Å; Y494-Q497 VanDerWaalsContact OH-N 3.13Å
498	F	88.1	Confident	86.6	Confident	20 Å²	20	49.1 Å²	49.1	9%	0.088	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	158.3	171.4	61.7	-89.9	0	0	0	110.7	R484 I485 Y496 I523 F538 G542	R484-F498 CarbonylContact C-O 3.54Å; R484-F498 WeakPolarHBondContact CA-O 3.3Å; R484-F498 WeakPolarHBondContact CB-O 3.37Å; I485-F498 HydrophobicContact CB-CD1 4.23Å; I485-F498 HydrophobicContact CB-CD2 4.29Å; I485-F498 HydrophobicContact CB-CE1 3.75Å; I485-F498 HydrophobicContact CB-CE2 3.8Å; I485-F498 HydrophobicContact CB-CG 4.49Å; I485-F498 HydrophobicContact CB-CZ 3.52Å; I485-F498 HydrophobicContact CG1-CD2 4.42Å; I485-F498 HydrophobicContact CG1-CE1 4.44Å; I485-F498 HydrophobicContact CG1-CE2 3.67Å; I485-F498 HydrophobicContact CG1-CZ 3.7Å; I485-F498 HydrophobicContact CG2-CE1 3.73Å; I485-F498 HydrophobicContact CG2-CE2 4.46Å; I485-F498 HydrophobicContact CG2-CZ 3.69Å; I485-F498 PolarHBondContact N-O 3.4Å; I485-F498 PolarHBondContact O-N 3.22Å; Y496-F498 HydrophobicContact CD2-CD1 4.38Å; Y496-F498 HydrophobicContact CE2-CD1 4.19Å; Y496-F498 HydrophobicContact CE2-CE1 4.36Å; F498-I523 HydrophobicContact CE1-CD1 3.81Å; F498-I523 HydrophobicContact CZ-CD1 3.81Å; F498-I523 HydrophobicContact CZ-CG2 4.26Å; F498-F538 AromaticContact CD2-CD1 3.88Å; F498-F538 HydrophobicContact CD2-CD1 3.88Å; F498-F538 HydrophobicContact CD2-CE1 4.16Å; F498-F538 HydrophobicContact CD2-CG 4.18Å; F498-F538 HydrophobicContact CE2-CB 3.87Å; F498-F538 AromaticContact CE2-CD1 3.73Å; F498-F538 HydrophobicContact CE2-CD1 3.73Å; F498-F538 AromaticContact CE2-CD2 3.85Å; F498-F538 HydrophobicContact CE2-CD2 3.85Å; F498-F538 HydrophobicContact CE2-CE1 4.21Å; F498-F538 HydrophobicContact CE2-CE2 4.32Å; F498-F538 AromaticContact CE2-CG 3.53Å; F498-F538 HydrophobicContact CE2-CG 3.53Å; F498-F538 HydrophobicContact CE2-CZ 4.48Å; F498-F538 HydrophobicContact CZ-CB 4.11Å; F498-F538 HydrophobicContact CZ-CG 4.26Å; F498-G542 VanDerWaalsContact CD1-CA 3.4Å
499	G	87.6	Confident	86.9	Confident	28 Å²	28	52.2 Å²	52.2	29%	0.289	28%	0.277	S	S	.	.			trans	120.9	129.1	-178.1	0	0	0	0	0	111.9
500	V	83.6	Confident	87.2	Confident	79 Å²	79	55.1 Å²	55.1	48%	0.479	29%	0.287	S	S	.	.			trans	-113.3	135.2	172.6	-178.7	0	0	0	0	107.6	G502 Y507 L508	V500-G502 PolarHBondContact O-N 3.45Å; V500-G502 VanDerWaalsContact O-N 3.13Å; V500-Y507 HydrophobicContact CB-CD1 3.64Å; V500-Y507 HydrophobicContact CB-CE1 3.79Å; V500-Y507 HydrophobicContact CB-CG 4.35Å; V500-Y507 HydrophobicContact CG1-CD1 3.59Å; V500-Y507 HydrophobicContact CG1-CE1 3.43Å; V500-Y507 VanDerWaalsContact CG1-CE1 3.43Å; V500-Y507 CarbonylContact O-C 3.58Å; V500-Y507 WeakPolarHBondContact O-CA 3.32Å; V500-Y507 WeakPolarHBondContact O-CB 3.35Å; V500-L508 PolarHBondContact O-N 3.2Å
501	P	86	Confident	87.7	Confident	76 Å²	76	54.3 Å²	54.3	49%	0.494	28%	0.283	S	S	.	.	B	Isolated β-bridge	trans	-56.2	119	177.5	-20.5	27.5	0	0	0	111.6	H483 L508 W509	H483-P501 HydrophobicContact CB-CB 3.91Å; H483-P501 HydrophobicContact CB-CG 3.9Å; P501-L508 WeakPolarHBondContact CA-O 3.3Å; P501-W509 HydrophobicContact CB-CZ3 4.34Å
502	G	85.8	Confident	88.3	Confident	16 Å²	16	50.7 Å²	50.7	17%	0.165	26%	0.264	C	S	.	.	S	Bend	trans	165.7	165.2	176.3	0	0	0	0	0	113.5	V500 Y507 L508 W509	V500-G502 PolarHBondContact O-N 3.45Å; V500-G502 VanDerWaalsContact O-N 3.13Å; G502-Y507 CarbonylContact O-C 3.56Å; G502-Y507 WeakPolarHBondContact O-CB 3.23Å; G502-L508 PolarHBondContact N-O 3.31Å; G502-L508 VanDerWaalsContact N-O 3.11Å; G502-L508 CarbonylContact O-C 3.5Å; G502-L508 VanDerWaalsContact O-C 3.29Å; G502-L508 PolarHBondContact O-N 3.32Å; G502-W509 WeakPolarHBondContact O-CB 3.18Å
503	R	87.1	Confident	88.9	Confident	128 Å²	128	50.5 Å²	50.5	48%	0.483	26%	0.258	S	S	.	.	S	Bend	trans	-102	-1.3	180	-64.4	-179.9	-176.2	166.2	1.3	113.8	W509 R534	R503-W509 HydrophobicContact CG-CB 4.02Å; R503-W509 HydrophobicContact CG-CD2 4.35Å; R503-W509 HydrophobicContact CG-CG 3.86Å; R503-R534 PolarHBondContact O-NH1 2.74Å
504	A	85.5	Confident	89.7	Confident	58 Å²	58	48 Å²	48	48%	0.479	25%	0.245	S	C	.	.	S	Bend	trans	-67	162.8	170.6	0	0	0	0	0	110.2	Y507 R534	A504-Y507 HydrophobicContact CB-CD2 3.88Å; A504-Y507 HydrophobicContact CB-CE2 4.41Å; A504-Y507 HydrophobicContact CB-CG 4.27Å; A504-Y507 WeakPolarHBondContact O-CB 3.37Å; A504-Y507 PolarHBondContact O-N 3.3Å; A504-R534 VanDerWaalsContact C-NH1 3.35Å; A504-R534 PolarHBondContact O-NH1 3.14Å; A504-R534 PolarHBondContact O-NH2 2.82Å
505	D	88.9	Confident	90.3	Very high	81 Å²	81	47.6 Å²	47.6	43%	0.433	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	135.6	175.7	-80.5	3.6	0	0	0	110.5	Y507 R534 F544 S547	D505-Y507 PolarHBondContact O-N 3.25Å; D505-R534 IonicContact OD1-NH1 3.22Å; D505-R534 PolarHBondContact OD1-NH1 2.83Å; D505-F544 HydrophobicContact CB-CE1 4.03Å; D505-F544 HydrophobicContact CB-CE2 4.31Å; D505-F544 HydrophobicContact CB-CZ 3.62Å; D505-S547 WeakPolarHBondContact OD1-CB 3.47Å; D505-S547 PolarHBondContact OD1-OG 2.95Å; D505-S547 VanDerWaalsContact OD1-OG 3.08Å; D505-S547 WeakPolarHBondContact OD2-CB 3.4Å; D505-S547 PolarHBondContact OD2-OG 3.13Å
506	G	86	Confident	91	Very high	18 Å²	18	46.2 Å²	46.2	19%	0.186	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.5	-17.7	-172.4	0	0	0	0	0	114.7	F544	G506-F544 VanDerWaalsContact CA-CG 3.41Å; G506-F544 VanDerWaalsContact N-CE2 3.34Å
507	Y	91.1	Very high	91.4	Very high	108 Å²	108	44 Å²	44	42%	0.424	23%	0.232	S	C	.	.			trans	-88.1	154.4	171.2	-69.1	-118.1	0	0	0	109.3	V500 G502 A504 D505 R534 Q536	V500-Y507 HydrophobicContact CB-CD1 3.64Å; V500-Y507 HydrophobicContact CB-CE1 3.79Å; V500-Y507 HydrophobicContact CB-CG 4.35Å; V500-Y507 HydrophobicContact CG1-CD1 3.59Å; V500-Y507 HydrophobicContact CG1-CE1 3.43Å; V500-Y507 VanDerWaalsContact CG1-CE1 3.43Å; V500-Y507 CarbonylContact O-C 3.58Å; V500-Y507 WeakPolarHBondContact O-CA 3.32Å; V500-Y507 WeakPolarHBondContact O-CB 3.35Å; G502-Y507 CarbonylContact O-C 3.56Å; G502-Y507 WeakPolarHBondContact O-CB 3.23Å; A504-Y507 HydrophobicContact CB-CD2 3.88Å; A504-Y507 HydrophobicContact CB-CE2 4.41Å; A504-Y507 HydrophobicContact CB-CG 4.27Å; A504-Y507 WeakPolarHBondContact O-CB 3.37Å; A504-Y507 PolarHBondContact O-N 3.3Å; D505-Y507 PolarHBondContact O-N 3.25Å; Y507-R534 PolarHBondContact O-NH2 2.84Å; Y507-Q536 PolarHBondContact O-NE2 3.43Å
508	L	94.1	Very high	91	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	-115.1	135.9	-179.2	-70.1	178.5	0	0	0	110.4	H483 I485 V500 P501 G502 V525 D527 F538	H483-L508 VanDerWaalsContact O-CB 3.31Å; H483-L508 WeakPolarHBondContact O-CB 3.33Å; I485-L508 HydrophobicContact CD1-CD1 4.34Å; I485-L508 HydrophobicContact CG1-CD1 3.8Å; V500-L508 PolarHBondContact O-N 3.2Å; P501-L508 WeakPolarHBondContact CA-O 3.3Å; G502-L508 PolarHBondContact N-O 3.31Å; G502-L508 VanDerWaalsContact N-O 3.11Å; G502-L508 CarbonylContact O-C 3.5Å; G502-L508 VanDerWaalsContact O-C 3.29Å; G502-L508 PolarHBondContact O-N 3.32Å; L508-V525 HydrophobicContact CD2-CB 4.42Å; L508-V525 HydrophobicContact CD2-CG1 3.95Å; L508-D527 HydrophobicContact CD2-CB 4.39Å; L508-F538 HydrophobicContact CD2-CE2 3.89Å; L508-F538 HydrophobicContact CD2-CZ 3.89Å; L508-F538 HydrophobicContact CG-CZ 4.22Å
509	W	95.6	Very high	90.5	Very high	67 Å²	67	52.9 Å²	52.9	25%	0.254	27%	0.27	S	S	.	.	S	Bend	trans	-128.6	102.7	176.3	-167	-111.8	0	0	0	110.9	H483 P501 G502 R503 D527 R528	H483-W509 AromaticContact CE1-CD2 3.67Å; H483-W509 AromaticContact CE1-CE3 3.27Å; H483-W509 AromaticContact CE1-CH2 3.75Å; H483-W509 AromaticContact CE1-CZ3 3.31Å; H483-W509 WeakPolarHBondContact CE1-CZ3 3.46Å; H483-W509 AromaticContact ND1-CD2 3.84Å; H483-W509 AromaticContact ND1-CE3 3.31Å; H483-W509 VanDerWaalsContact ND1-CE3 3.31Å; H483-W509 AromaticContact ND1-CZ3 3.72Å; H483-W509 AromaticContact NE2-CZ3 3.89Å; P501-W509 HydrophobicContact CB-CZ3 4.34Å; G502-W509 WeakPolarHBondContact O-CB 3.18Å; R503-W509 HydrophobicContact CG-CB 4.02Å; R503-W509 HydrophobicContact CG-CD2 4.35Å; R503-W509 HydrophobicContact CG-CG 3.86Å; W509-D527 PolarHBondContact N-OD2 3.3Å; W509-R528 WeakPolarHBondContact CB-O 3.43Å; W509-R528 WeakPolarHBondContact O-CB 3.2Å; W509-R528 PolarHBondContact O-N 3.24Å
510	Y	95.8	Very high	90	Very high	68 Å²	68	55.1 Å²	55.1	27%	0.267	28%	0.275	S	S	.	.	S	Bend	trans	48.5	62.2	-174.5	-61.9	-77.8	0	0	0	113.3	S480 N481 H483 R512	S480-Y510 WeakPolarHBondContact O-CA 3.41Å; S480-Y510 WeakPolarHBondContact O-CD1 3.36Å; N481-Y510 WeakPolarHBondContact OD1-CE1 3.02Å; H483-Y510 AromaticContact CE1-CD1 3.93Å; H483-Y510 AromaticContact CE1-CD2 3.54Å; H483-Y510 AromaticContact CE1-CE1 3.78Å; H483-Y510 AromaticContact CE1-CE2 3.41Å; H483-Y510 VanDerWaalsContact CE1-CE2 3.41Å; H483-Y510 WeakPolarHBondContact CE1-CE2 3.42Å; H483-Y510 AromaticContact CE1-CG 3.81Å; H483-Y510 AromaticContact CE1-CZ 3.51Å; H483-Y510 PolarHBondContact ND1-N 3.27Å; H483-Y510 VanDerWaalsContact ND1-N 3.16Å; H483-Y510 AromaticContact NE2-CE1 3.83Å; H483-Y510 AromaticContact NE2-CZ 3.67Å; Y510-R512 WeakPolarHBondContact O-CG 3.48Å; Y510-R512 PolarHBondContact O-N 3.16Å
511	P	97.2	Very high	90.1	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.266	C	S	.	.			trans	-58	131.6	176.4	27.9	-35.4	0	0	0	110	A478 S480 I485 V525 D527	A478-P511 HydrophobicContact CB-CB 4Å; A478-P511 HydrophobicContact CB-CG 4.32Å; S480-P511 WeakPolarHBondContact CB-O 3.4Å; S480-P511 PolarHBondContact OG-O 3.28Å; I485-P511 HydrophobicContact CD1-CB 4.04Å; I485-P511 HydrophobicContact CD1-CG 4.31Å; P511-V525 HydrophobicContact CB-CG1 3.61Å; P511-D527 HydrophobicContact CB-CB 4.18Å
512	R	95.4	Very high	90.5	Very high	49 Å²	49	51 Å²	51	19%	0.185	25%	0.248	C	C	.	.			trans	-113.8	-39.2	-172.5	-68.2	-173.9	68.2	160.6	-5.6	114.2	H465 G466 Y510 C526 I555	H465-R512 PolarHBondContact ND1-O 3.35Å; G466-R512 VanDerWaalsContact CA-O 3.24Å; G466-R512 WeakPolarHBondContact CA-O 3.31Å; G466-R512 PolarHBondContact N-O 3.22Å; Y510-R512 WeakPolarHBondContact O-CG 3.48Å; Y510-R512 PolarHBondContact O-N 3.16Å; R512-C526 PolarHBondContact N-O 3.46Å; R512-I555 VanDerWaalsContact CZ-CG2 3.46Å
513	K	97	Very high	91	Very high	12 Å²	12	50.3 Å²	50.3	5%	0.052	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	144.4	-178	-69.6	-72.9	169.3	155.2	0	109.3	C526 V556 A557 L559 D600	K513-C526 HydrophobicContact CB-CB 4.3Å; K513-C526 PolarHBondContact N-O 3.31Å; K513-C526 PolarHBondContact O-N 2.92Å; K513-V556 HydrophobicContact CB-CG1 4.46Å; K513-V556 HydrophobicContact CG-CG1 4.36Å; K513-A557 WeakPolarHBondContact CE-O 3.49Å; K513-A557 PolarHBondContact NZ-O 3.39Å; K513-L559 HydrophobicContact CB-CB 3.71Å; K513-L559 HydrophobicContact CB-CD2 3.95Å; K513-L559 HydrophobicContact CG-CB 4.3Å; K513-D600 IonicContact NZ-OD1 3.84Å; K513-D600 PolarHBondContact NZ-OD1 2.99Å
514	V	97.8	Very high	91.5	Very high	6 Å²	6	44.2 Å²	44.2	4%	0.036	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	141.2	-179.6	60.8	0	0	0	0	109.3	I476 A478 I523 V524 V525	I476-V514 HydrophobicContact CG2-CG2 3.84Å; I476-V514 VanDerWaalsContact O-CG1 3.3Å; I476-V514 WeakPolarHBondContact O-CG1 3.31Å; A478-V514 HydrophobicContact CB-CG1 4.42Å; V514-I523 HydrophobicContact CG2-CG2 3.42Å; V514-I523 VanDerWaalsContact CG2-CG2 3.42Å; V514-V524 CarbonylContact C-O 3.51Å; V514-V524 VanDerWaalsContact CA-O 3.23Å; V514-V524 WeakPolarHBondContact CA-O 3.3Å; V514-V525 HydrophobicContact CG2-CG2 4.11Å
515	A	97.1	Very high	92.1	Very high	7 Å²	7	41.4 Å²	41.4	6%	0.058	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	163	176.4	0	0	0	0	0	110.2	V524 L559 I561	A515-V524 PolarHBondContact N-O 2.94Å; A515-V524 PolarHBondContact O-N 2.92Å; A515-L559 HydrophobicContact CB-CD2 3.74Å; A515-L559 HydrophobicContact CB-CG 3.83Å; A515-I561 HydrophobicContact CB-CD1 4.33Å; A515-I561 HydrophobicContact CB-CG1 4.22Å
516	L	95.5	Very high	92.5	Very high	28 Å²	28	37.7 Å²	37.7	15%	0.147	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	133.3	174.3	-78.5	167.2	0	0	0	110.2	S470 I476 N521 V522 I523 I561	S470-L516 VanDerWaalsContact CA-CD1 3.41Å; I476-L516 HydrophobicContact CD1-CD1 3.67Å; I476-L516 HydrophobicContact CD1-CD2 3.76Å; I476-L516 HydrophobicContact CD1-CG 3.83Å; L516-N521 WeakPolarHBondContact CD2-O 3.43Å; L516-V522 WeakPolarHBondContact CA-O 3.29Å; L516-I523 HydrophobicContact CD2-CB 4.47Å; L516-I523 HydrophobicContact CD2-CG1 3.65Å; L516-I561 WeakPolarHBondContact O-CG1 3.39Å
517	L	93.6	Very high	93	Very high	4 Å²	4	36.9 Å²	36.9	2%	0.021	17%	0.166	C	C	.	.			trans	-71	140.1	168.4	-58.9	-176.4	0	0	0	110.4	D519 N520 N521 V522 V524 F537 I561 I567	L517-D519 VanDerWaalsContact C-N 3.35Å; L517-D519 WeakPolarHBondContact CB-OD1 3.34Å; L517-D519 PolarHBondContact O-N 2.81Å; L517-N520 WeakPolarHBondContact CB-OD1 3.39Å; L517-N521 PolarHBondContact O-N 3.5Å; L517-V522 HydrophobicContact CB-CB 4.44Å; L517-V522 HydrophobicContact CD1-CB 3.94Å; L517-V522 HydrophobicContact CD1-CG1 4.04Å; L517-V522 HydrophobicContact CG-CB 4.29Å; L517-V522 PolarHBondContact N-O 3.45Å; L517-V524 HydrophobicContact CD1-CG2 4.15Å; L517-V524 HydrophobicContact CD2-CG2 3.69Å; L517-V524 HydrophobicContact CG-CG2 3.69Å; L517-F537 HydrophobicContact CD1-CD1 4.21Å; L517-F537 HydrophobicContact CD1-CE1 4.07Å; L517-I561 HydrophobicContact CD2-CD1 3.76Å; L517-I561 HydrophobicContact CD2-CG1 4.36Å; L517-I567 HydrophobicContact CD2-CD1 4.13Å; L517-I567 HydrophobicContact CD2-CG1 3.9Å
518	R	82	Confident	93	Very high	165 Å²	165	37.5 Å²	37.5	62%	0.623	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-29	-171.5	-66.2	-179.7	-176.5	-92.1	-3.9	113.7	I561 D562	R518-I561 HydrophobicContact CG-CG2 4.2Å; R518-I561 PolarHBondContact NH2-O 3.37Å; R518-D562 PolarHBondContact NE-O 2.69Å; R518-D562 VanDerWaalsContact NE-O 3.13Å
519	D	77.7	Confident	92.6	Very high	112 Å²	112	37.9 Å²	37.9	60%	0.599	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88	-32.2	-168.5	58.2	-35.9	0	0	0	113.6	L517 H582	L517-D519 VanDerWaalsContact C-N 3.35Å; L517-D519 WeakPolarHBondContact CB-OD1 3.34Å; L517-D519 PolarHBondContact O-N 2.81Å; D519-H582 IonicContact OD1-CE1 3.63Å
520	N	78	Confident	91.9	Very high	75 Å²	75	38.3 Å²	38.3	40%	0.401	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-138.6	5.4	-168.1	56.7	26.5	0	0	0	114.4	L517 V522	L517-N520 WeakPolarHBondContact CB-OD1 3.39Å; N520-V522 HydrophobicContact CB-CG2 4.2Å; N520-V522 VanDerWaalsContact CG-CG2 3.42Å; N520-V522 PolarHBondContact O-N 3.46Å; N520-V522 VanDerWaalsContact O-N 3.12Å; N520-V522 WeakPolarHBondContact OD1-CB 3.4Å; N520-V522 WeakPolarHBondContact OD1-CG2 3.5Å; N520-V522 PolarHBondContact OD1-N 3.32Å
521	N	84.7	Confident	91.3	Very high	52 Å²	52	42.7 Å²	42.7	28%	0.278	21%	0.212	S	C	.	.			trans	54	25.3	-175.4	-59.6	-49.9	0	0	0	113.8	L516 L517 I523	L516-N521 WeakPolarHBondContact CD2-O 3.43Å; L517-N521 PolarHBondContact O-N 3.5Å; N521-I523 PolarHBondContact O-N 3.47Å
522	V	93.9	Very high	90.7	Very high	18 Å²	18	48.1 Å²	48.1	11%	0.109	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-67.8	132.4	172.6	166.6	0	0	0	0	109	L516 L517 N520 F537 F538 L545	L516-V522 WeakPolarHBondContact CA-O 3.29Å; L517-V522 HydrophobicContact CB-CB 4.44Å; L517-V522 HydrophobicContact CD1-CB 3.94Å; L517-V522 HydrophobicContact CD1-CG1 4.04Å; L517-V522 HydrophobicContact CG-CB 4.29Å; L517-V522 PolarHBondContact N-O 3.45Å; N520-V522 HydrophobicContact CB-CG2 4.2Å; N520-V522 VanDerWaalsContact CG-CG2 3.42Å; N520-V522 PolarHBondContact O-N 3.46Å; N520-V522 VanDerWaalsContact O-N 3.12Å; N520-V522 WeakPolarHBondContact OD1-CB 3.4Å; N520-V522 WeakPolarHBondContact OD1-CG2 3.5Å; N520-V522 PolarHBondContact OD1-N 3.32Å; V522-F537 HydrophobicContact CG1-CB 3.95Å; V522-F537 HydrophobicContact CG1-CD1 3.79Å; V522-F537 HydrophobicContact CG1-CG 4.37Å; V522-F538 WeakPolarHBondContact CA-O 3.48Å; V522-F538 WeakPolarHBondContact CG1-O 3.44Å; V522-L545 HydrophobicContact CG1-CD1 3.95Å; V522-L545 HydrophobicContact CG2-CD1 3.76Å
523	I	97.2	Very high	90.5	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	119.9	178.7	-57.4	171.2	0	0	0	108	I476 F498 V514 L516 N521 V525 F537 F538	I476-I523 HydrophobicContact CD1-CD1 4Å; I476-I523 HydrophobicContact CD1-CG1 4.04Å; I476-I523 HydrophobicContact CG2-CD1 4.29Å; I476-I523 HydrophobicContact CG2-CG2 4.14Å; F498-I523 HydrophobicContact CE1-CD1 3.81Å; F498-I523 HydrophobicContact CZ-CD1 3.81Å; F498-I523 HydrophobicContact CZ-CG2 4.26Å; V514-I523 HydrophobicContact CG2-CG2 3.42Å; V514-I523 VanDerWaalsContact CG2-CG2 3.42Å; L516-I523 HydrophobicContact CD2-CB 4.47Å; L516-I523 HydrophobicContact CD2-CG1 3.65Å; N521-I523 PolarHBondContact O-N 3.47Å; I523-V525 HydrophobicContact CG2-CG2 3.92Å; I523-F537 CarbonylContact O-C 3.59Å; I523-F537 WeakPolarHBondContact O-CA 3.3Å; I523-F538 HydrophobicContact CB-CB 4.34Å; I523-F538 PolarHBondContact N-O 2.88Å; I523-F538 PolarHBondContact O-N 2.97Å
524	V	97.7	Very high	90.4	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	119	175.5	-176.7	0	0	0	0	108.5	V514 A515 L517 M535 Q536 F537 I567	V514-V524 CarbonylContact C-O 3.51Å; V514-V524 VanDerWaalsContact CA-O 3.23Å; V514-V524 WeakPolarHBondContact CA-O 3.3Å; A515-V524 PolarHBondContact N-O 2.94Å; A515-V524 PolarHBondContact O-N 2.92Å; L517-V524 HydrophobicContact CD1-CG2 4.15Å; L517-V524 HydrophobicContact CD2-CG2 3.69Å; L517-V524 HydrophobicContact CG-CG2 3.69Å; V524-M535 HydrophobicContact CG1-CG 3.34Å; V524-M535 HydrophobicContact CG1-SD 3.56Å; V524-M535 VanDerWaalsContact CG1-SD 3.56Å; V524-Q536 CarbonylContact C-O 3.59Å; V524-Q536 WeakPolarHBondContact CA-O 3.5Å; V524-F537 HydrophobicContact CG1-CZ 4.46Å; V524-F537 HydrophobicContact CG2-CD1 3.81Å; V524-F537 HydrophobicContact CG2-CE1 3.71Å; V524-F537 HydrophobicContact CG2-CZ 4.43Å; V524-I567 HydrophobicContact CG1-CD1 4.32Å; V524-I567 HydrophobicContact CG1-CG2 4.48Å; V524-I567 HydrophobicContact CG2-CD1 4.26Å
525	V	98.1	Very high	90.3	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	126.5	-179.6	-175.4	0	0	0	0	109.2	I485 L508 P511 V514 I523 D527 M535 Q536 F538	I485-V525 HydrophobicContact CD1-CG1 3.94Å; I485-V525 HydrophobicContact CD1-CG2 3.88Å; I485-V525 HydrophobicContact CG1-CG2 3.84Å; L508-V525 HydrophobicContact CD2-CB 4.42Å; L508-V525 HydrophobicContact CD2-CG1 3.95Å; P511-V525 HydrophobicContact CB-CG1 3.61Å; V514-V525 HydrophobicContact CG2-CG2 4.11Å; I523-V525 HydrophobicContact CG2-CG2 3.92Å; V525-D527 HydrophobicContact CG1-CB 4.48Å; V525-M535 CarbonylContact O-C 3.51Å; V525-M535 WeakPolarHBondContact O-CA 3.1Å; V525-Q536 PolarHBondContact N-O 3.34Å; V525-Q536 PolarHBondContact O-N 3.1Å; V525-F538 HydrophobicContact CB-CE2 4.39Å; V525-F538 HydrophobicContact CG2-CD2 3.99Å; V525-F538 HydrophobicContact CG2-CE2 4.17Å
526	C	97.5	Very high	90.3	Very high	2 Å²	2	45.1 Å²	45.1	1%	0.014	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	110.9	166.2	-67.5	0	0	0	0	109.1	R512 K513 R534 V556	R512-C526 PolarHBondContact N-O 3.46Å; K513-C526 HydrophobicContact CB-CB 4.3Å; K513-C526 PolarHBondContact N-O 3.31Å; K513-C526 PolarHBondContact O-N 2.92Å; C526-R534 WeakPolarHBondContact CA-O 3.27Å; C526-V556 HydrophobicContact CB-CB 4.12Å; C526-V556 HydrophobicContact CB-CG1 4.14Å; C526-V556 HydrophobicContact CB-CG2 4.17Å
527	D	96	Very high	90.4	Very high	2 Å²	2	44 Å²	44	1%	0.011	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	177.2	177.1	79.2	-44.3	0	0	0	111.4	L508 W509 P511 V525 G529 S533 R534 Q536	L508-D527 HydrophobicContact CD2-CB 4.39Å; W509-D527 PolarHBondContact N-OD2 3.3Å; P511-D527 HydrophobicContact CB-CB 4.18Å; V525-D527 HydrophobicContact CG1-CB 4.48Å; D527-G529 PolarHBondContact O-N 2.73Å; D527-S533 WeakPolarHBondContact O-CA 3.1Å; D527-R534 PolarHBondContact N-O 3.21Å; D527-R534 PolarHBondContact O-N 3.32Å; D527-R534 WeakPolarHBondContact OD1-CG 3.23Å; D527-R534 IonicContact OD1-CZ 3.81Å; D527-R534 IonicContact OD1-NE 2.71Å; D527-R534 PolarHBondContact OD1-NE 2.78Å; D527-R534 IonicContact OD2-CZ 2.94Å; D527-R534 IonicContact OD2-NE 3.09Å; D527-R534 PolarHBondContact OD2-NE 3.39Å; D527-R534 IonicContact OD2-NH2 2.69Å; D527-R534 PolarHBondContact OD2-NH2 3.09Å; D527-Q536 PolarHBondContact OD1-NE2 3.26Å; D527-Q536 PolarHBondContact OD2-NE2 3.09Å; D527-Q536 VanDerWaalsContact OD2-NE2 3.16Å
528	R	91.4	Very high	90.4	Very high	120 Å²	120	44 Å²	44	45%	0.453	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	109.6	-179.5	-60.3	-173.6	-171.1	-172	0.5	109.8	W509	W509-R528 WeakPolarHBondContact CB-O 3.43Å; W509-R528 WeakPolarHBondContact O-CB 3.2Å; W509-R528 PolarHBondContact O-N 3.24Å
529	G	85.9	Confident	90.8	Very high	8 Å²	8	37.4 Å²	37.4	8%	0.082	19%	0.194	C	C	.	.			trans	-71.9	-168	171	0	0	0	0	0	112.9	D527 R532	D527-G529 PolarHBondContact O-N 2.73Å; G529-R532 WeakPolarHBondContact CA-O 3.02Å; G529-R532 PolarHBondContact N-O 3.48Å
530	S	81.2	Confident	91.2	Very high	77 Å²	77	36.3 Å²	36.3	54%	0.538	18%	0.181	S	C	.	.	S	Bend	trans	-65.4	-43.8	178.9	-62.2	0	0	0	0	113.2
531	D	81.8	Confident	91.4	Very high	160 Å²	160	36.5 Å²	36.5	86%	0.856	18%	0.182	S	C	*	.	S	Bend	trans	-111.6	-43.3	-177	-55.3	-44.2	0	0	0	112.6
532	R	85.7	Confident	91.5	Very high	113 Å²	113	34.7 Å²	34.7	43%	0.426	18%	0.176	S	C	.	.	S	Bend	trans	-137.6	179.1	-175.9	-64.4	-172.8	-177.7	-176.9	-0.6	110.5	G529 R551	G529-R532 WeakPolarHBondContact CA-O 3.02Å; G529-R532 PolarHBondContact N-O 3.48Å; R532-R551 VanDerWaalsContact CD-O 3.3Å; R532-R551 WeakPolarHBondContact CD-O 3.36Å; R532-R551 PolarHBondContact NH1-O 2.92Å
533	S	91	Very high	91.1	Very high	10 Å²	10	38 Å²	38	7%	0.07	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.2	147.8	170.5	-62.9	0	0	0	0	110.7	D527 I550 E554	D527-S533 WeakPolarHBondContact O-CA 3.1Å; S533-I550 WeakPolarHBondContact O-CG1 3.41Å; S533-E554 PolarHBondContact N-O 3.47Å; S533-E554 PolarHBondContact OG-O 3.44Å
534	R	94.4	Very high	90.7	Very high	2 Å²	2	41.4 Å²	41.4	1%	0.008	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	162.9	169.3	70.3	178.2	173.9	172.1	-6.2	109.2	R503 A504 D505 Y507 C526 D527 Q536	R503-R534 PolarHBondContact O-NH1 2.74Å; A504-R534 VanDerWaalsContact C-NH1 3.35Å; A504-R534 PolarHBondContact O-NH1 3.14Å; A504-R534 PolarHBondContact O-NH2 2.82Å; D505-R534 IonicContact OD1-NH1 3.22Å; D505-R534 PolarHBondContact OD1-NH1 2.83Å; Y507-R534 PolarHBondContact O-NH2 2.84Å; C526-R534 WeakPolarHBondContact CA-O 3.27Å; D527-R534 PolarHBondContact N-O 3.21Å; D527-R534 PolarHBondContact O-N 3.32Å; D527-R534 WeakPolarHBondContact OD1-CG 3.23Å; D527-R534 IonicContact OD1-CZ 3.81Å; D527-R534 IonicContact OD1-NE 2.71Å; D527-R534 PolarHBondContact OD1-NE 2.78Å; D527-R534 IonicContact OD2-CZ 2.94Å; D527-R534 IonicContact OD2-NE 3.09Å; D527-R534 PolarHBondContact OD2-NE 3.39Å; D527-R534 IonicContact OD2-NH2 2.69Å; D527-R534 PolarHBondContact OD2-NH2 3.09Å; R534-Q536 HydrophobicContact CG-CG 4.31Å; R534-Q536 VanDerWaalsContact NE-NE2 3.19Å
535	M	96.5	Very high	90.3	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	129.6	176	-173.4	-175.2	-64.3	0	0	108.9	V524 V525 F537 S547 I548 I550 I567 I569	V524-M535 HydrophobicContact CG1-CG 3.34Å; V524-M535 HydrophobicContact CG1-SD 3.56Å; V524-M535 VanDerWaalsContact CG1-SD 3.56Å; V525-M535 CarbonylContact O-C 3.51Å; V525-M535 WeakPolarHBondContact O-CA 3.1Å; M535-F537 HydrophobicContact CG-CE2 3.81Å; M535-F537 HydrophobicContact CG-CZ 4.18Å; M535-F537 HydrophobicContact SD-CE2 3.77Å; M535-F537 HydrophobicContact SD-CZ 3.6Å; M535-F537 VanDerWaalsContact SD-CZ 3.6Å; M535-S547 CarbonylContact O-C 3.58Å; M535-S547 WeakPolarHBondContact O-CA 3.5Å; M535-I548 HydrophobicContact CB-CB 4.41Å; M535-I548 PolarHBondContact N-O 3.26Å; M535-I548 PolarHBondContact O-N 3.07Å; M535-I550 HydrophobicContact CB-CG2 4.19Å; M535-I550 HydrophobicContact CE-CG2 4.26Å; M535-I567 HydrophobicContact CE-CB 4.23Å; M535-I567 HydrophobicContact CE-CD1 4.4Å; M535-I567 HydrophobicContact CE-CG2 3.48Å; M535-I567 VanDerWaalsContact CE-CG2 3.48Å; M535-I567 HydrophobicContact SD-CB 4.45Å; M535-I567 HydrophobicContact SD-CD1 3.53Å; M535-I567 VanDerWaalsContact SD-CD1 3.53Å; M535-I567 HydrophobicContact SD-CG2 3.95Å; M535-I569 HydrophobicContact CE-CG2 4.26Å
536	Q	96.3	Very high	90.1	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	142.3	180	-64.9	-165.6	83.8	0	0	110.6	Y507 V524 V525 D527 R534 F538	Y507-Q536 PolarHBondContact O-NE2 3.43Å; V524-Q536 CarbonylContact C-O 3.59Å; V524-Q536 WeakPolarHBondContact CA-O 3.5Å; V525-Q536 PolarHBondContact N-O 3.34Å; V525-Q536 PolarHBondContact O-N 3.1Å; D527-Q536 PolarHBondContact OD1-NE2 3.26Å; D527-Q536 PolarHBondContact OD2-NE2 3.09Å; D527-Q536 VanDerWaalsContact OD2-NE2 3.16Å; R534-Q536 HydrophobicContact CG-CG 4.31Å; R534-Q536 VanDerWaalsContact NE-NE2 3.19Å; Q536-F538 HydrophobicContact CB-CD2 4.37Å; Q536-F538 HydrophobicContact CB-CE2 3.58Å; Q536-F538 HydrophobicContact CB-CZ 4.24Å
537	F	97.2	Very high	89.9	Confident	4 Å²	4	51.1 Å²	51.1	2%	0.018	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	128.8	-175.6	-65.1	-108.2	0	0	0	108.3	L517 V522 I523 V524 M535 L545 K546 I548 I567	L517-F537 HydrophobicContact CD1-CD1 4.21Å; L517-F537 HydrophobicContact CD1-CE1 4.07Å; V522-F537 HydrophobicContact CG1-CB 3.95Å; V522-F537 HydrophobicContact CG1-CD1 3.79Å; V522-F537 HydrophobicContact CG1-CG 4.37Å; I523-F537 CarbonylContact O-C 3.59Å; I523-F537 WeakPolarHBondContact O-CA 3.3Å; V524-F537 HydrophobicContact CG1-CZ 4.46Å; V524-F537 HydrophobicContact CG2-CD1 3.81Å; V524-F537 HydrophobicContact CG2-CE1 3.71Å; V524-F537 HydrophobicContact CG2-CZ 4.43Å; M535-F537 HydrophobicContact CG-CE2 3.81Å; M535-F537 HydrophobicContact CG-CZ 4.18Å; M535-F537 HydrophobicContact SD-CE2 3.77Å; M535-F537 HydrophobicContact SD-CZ 3.6Å; M535-F537 VanDerWaalsContact SD-CZ 3.6Å; F537-L545 HydrophobicContact CB-CB 4.17Å; F537-L545 WeakPolarHBondContact O-CB 3.08Å; F537-L545 PolarHBondContact O-N 3.12Å; F537-K546 HydrophobicContact CB-CG 3.94Å; F537-K546 HydrophobicContact CD2-CD 4.47Å; F537-K546 HydrophobicContact CD2-CG 3.76Å; F537-K546 HydrophobicContact CG-CG 3.97Å; F537-K546 PolarHBondContact N-O 3.32Å; F537-I548 HydrophobicContact CD2-CD1 4.44Å; F537-I548 HydrophobicContact CE2-CD1 3.43Å; F537-I548 VanDerWaalsContact CE2-CD1 3.43Å; F537-I548 HydrophobicContact CE2-CG1 3.83Å; F537-I548 HydrophobicContact CZ-CD1 3.78Å; F537-I567 HydrophobicContact CE1-CD1 3.68Å; F537-I567 HydrophobicContact CZ-CD1 3.52Å
538	F	94.7	Very high	89.8	Confident	3 Å²	3	52 Å²	52	1%	0.013	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	145.1	177.8	-64	-94	0	0	0	109.9	F498 L508 V522 I523 V525 Q536 G542 T543 F544	F498-F538 AromaticContact CD2-CD1 3.88Å; F498-F538 HydrophobicContact CD2-CD1 3.88Å; F498-F538 HydrophobicContact CD2-CE1 4.16Å; F498-F538 HydrophobicContact CD2-CG 4.18Å; F498-F538 HydrophobicContact CE2-CB 3.87Å; F498-F538 AromaticContact CE2-CD1 3.73Å; F498-F538 HydrophobicContact CE2-CD1 3.73Å; F498-F538 AromaticContact CE2-CD2 3.85Å; F498-F538 HydrophobicContact CE2-CD2 3.85Å; F498-F538 HydrophobicContact CE2-CE1 4.21Å; F498-F538 HydrophobicContact CE2-CE2 4.32Å; F498-F538 AromaticContact CE2-CG 3.53Å; F498-F538 HydrophobicContact CE2-CG 3.53Å; F498-F538 HydrophobicContact CE2-CZ 4.48Å; F498-F538 HydrophobicContact CZ-CB 4.11Å; F498-F538 HydrophobicContact CZ-CG 4.26Å; L508-F538 HydrophobicContact CD2-CE2 3.89Å; L508-F538 HydrophobicContact CD2-CZ 3.89Å; L508-F538 HydrophobicContact CG-CZ 4.22Å; V522-F538 WeakPolarHBondContact CA-O 3.48Å; V522-F538 WeakPolarHBondContact CG1-O 3.44Å; I523-F538 HydrophobicContact CB-CB 4.34Å; I523-F538 PolarHBondContact N-O 2.88Å; I523-F538 PolarHBondContact O-N 2.97Å; V525-F538 HydrophobicContact CB-CE2 4.39Å; V525-F538 HydrophobicContact CG2-CD2 3.99Å; V525-F538 HydrophobicContact CG2-CE2 4.17Å; Q536-F538 HydrophobicContact CB-CD2 4.37Å; Q536-F538 HydrophobicContact CB-CE2 3.58Å; Q536-F538 HydrophobicContact CB-CZ 4.24Å; F538-G542 WeakPolarHBondContact CD1-O 3.42Å; F538-T543 CarbonylContact C-O 3.48Å; F538-T543 VanDerWaalsContact CA-O 3.24Å; F538-T543 WeakPolarHBondContact CA-O 3.46Å; F538-F544 HydrophobicContact CD1-CB 4.18Å; F538-F544 HydrophobicContact CE1-CB 3.95Å; F538-F544 HydrophobicContact CE1-CD2 4.13Å; F538-F544 HydrophobicContact CZ-CD2 4.22Å
539	S	89.6	Confident	89.7	Confident	27 Å²	27	50.6 Å²	50.6	19%	0.189	26%	0.264	C	S	.	.			trans	-59	165.5	167.1	77.7	0	0	0	0	109.7	N541 G542 T543	S539-N541 PolarHBondContact O-N 2.89Å; S539-N541 VanDerWaalsContact O-N 3.09Å; S539-N541 PolarHBondContact OG-N 3.06Å; S539-G542 PolarHBondContact O-N 2.87Å; S539-G542 PolarHBondContact OG-N 3.34Å; S539-T543 PolarHBondContact N-O 3.03Å; S539-T543 VanDerWaalsContact OG-CB 3.29Å; S539-T543 WeakPolarHBondContact OG-CB 3.39Å; S539-T543 PolarHBondContact OG-N 3.37Å; S539-T543 PolarHBondContact OG-OG1 3.36Å
540	R	86.8	Confident	89.8	Confident	89 Å²	89	50.2 Å²	50.2	34%	0.336	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-30.3	173.3	-174.3	179.3	175	172.9	4	112.2	D472 D474 Y496 G542	D472-R540 IonicContact OD2-CZ 4Å; D472-R540 IonicContact OD2-NH1 3.2Å; D472-R540 PolarHBondContact OD2-NH1 3.01Å; D472-R540 IonicContact OD2-NH2 2.71Å; D472-R540 PolarHBondContact OD2-NH2 3.27Å; D474-R540 IonicContact OD2-NH2 3.85Å; Y496-R540 PolarHBondContact OH-O 3.27Å; R540-G542 VanDerWaalsContact C-N 3.33Å
541	N	82.6	Confident	90	Very high	79 Å²	79	55.5 Å²	55.5	42%	0.422	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	6.3	-178.9	-59.3	-5.1	0	0	0	113.1	S539	S539-N541 PolarHBondContact O-N 2.89Å; S539-N541 VanDerWaalsContact O-N 3.09Å; S539-N541 PolarHBondContact OG-N 3.06Å
542	G	86	Confident	90.2	Very high	14 Å²	14	50.6 Å²	50.6	14%	0.144	24%	0.239	C	C	.	.	S	Bend	trans	86.6	8.8	178.4	0	0	0	0	0	115.4	F498 F538 S539 R540	F498-G542 VanDerWaalsContact CD1-CA 3.4Å; F538-G542 WeakPolarHBondContact CD1-O 3.42Å; S539-G542 PolarHBondContact O-N 2.87Å; S539-G542 PolarHBondContact OG-N 3.34Å; R540-G542 VanDerWaalsContact C-N 3.33Å
543	T	85.3	Confident	90.2	Very high	89 Å²	89	45.2 Å²	45.2	55%	0.546	22%	0.219	S	C	.	.			trans	-72.4	128.1	173.5	-40.7	0	0	0	0	109.8	F538 S539 L545	F538-T543 CarbonylContact C-O 3.48Å; F538-T543 VanDerWaalsContact CA-O 3.24Å; F538-T543 WeakPolarHBondContact CA-O 3.46Å; S539-T543 PolarHBondContact N-O 3.03Å; S539-T543 VanDerWaalsContact OG-CB 3.29Å; S539-T543 WeakPolarHBondContact OG-CB 3.39Å; S539-T543 PolarHBondContact OG-N 3.37Å; S539-T543 PolarHBondContact OG-OG1 3.36Å; T543-L545 PolarHBondContact O-N 3.31Å
544	F	89.7	Confident	90.2	Very high	71 Å²	71	47.5 Å²	47.5	31%	0.311	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	134.3	175.4	174.4	-107.7	0	0	0	111.6	D505 G506 F538 K546	D505-F544 HydrophobicContact CB-CE1 4.03Å; D505-F544 HydrophobicContact CB-CE2 4.31Å; D505-F544 HydrophobicContact CB-CZ 3.62Å; G506-F544 VanDerWaalsContact CA-CG 3.41Å; G506-F544 VanDerWaalsContact N-CE2 3.34Å; F538-F544 HydrophobicContact CD1-CB 4.18Å; F538-F544 HydrophobicContact CE1-CB 3.95Å; F538-F544 HydrophobicContact CE1-CD2 4.13Å; F538-F544 HydrophobicContact CZ-CD2 4.22Å; F544-K546 VanDerWaalsContact CE2-O 3.23Å; F544-K546 WeakPolarHBondContact CE2-O 3.42Å
545	L	89.6	Confident	90.1	Very high	91 Å²	91	50 Å²	50	48%	0.476	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	-52.8	177.5	-57.9	177.5	0	0	0	111.5	V522 F537 T543	V522-L545 HydrophobicContact CG1-CD1 3.95Å; V522-L545 HydrophobicContact CG2-CD1 3.76Å; F537-L545 HydrophobicContact CB-CB 4.17Å; F537-L545 WeakPolarHBondContact O-CB 3.08Å; F537-L545 PolarHBondContact O-N 3.12Å; T543-L545 PolarHBondContact O-N 3.31Å
546	K	93.1	Very high	90	Very high	85 Å²	85	50.1 Å²	50.1	37%	0.37	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.4	165.5	-179.6	64.7	-176.7	-176.1	-173.1	0	112.4	F537 F544 H582	F537-K546 HydrophobicContact CB-CG 3.94Å; F537-K546 HydrophobicContact CD2-CD 4.47Å; F537-K546 HydrophobicContact CD2-CG 3.76Å; F537-K546 HydrophobicContact CG-CG 3.97Å; F537-K546 PolarHBondContact N-O 3.32Å; F544-K546 VanDerWaalsContact CE2-O 3.23Å; F544-K546 WeakPolarHBondContact CE2-O 3.42Å; K546-H582 VanDerWaalsContact CE-O 3.24Å; K546-H582 WeakPolarHBondContact CE-O 3.14Å; K546-H582 PolarHBondContact NZ-O 3.25Å
547	S	94	Very high	90	Very high	30 Å²	30	50.3 Å²	50.3	21%	0.21	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	151.6	172.2	79.4	0	0	0	0	110.9	D505 M535	D505-S547 WeakPolarHBondContact OD1-CB 3.47Å; D505-S547 PolarHBondContact OD1-OG 2.95Å; D505-S547 VanDerWaalsContact OD1-OG 3.08Å; D505-S547 WeakPolarHBondContact OD2-CB 3.4Å; D505-S547 PolarHBondContact OD2-OG 3.13Å; M535-S547 CarbonylContact O-C 3.58Å; M535-S547 WeakPolarHBondContact O-CA 3.5Å
548	I	92.3	Very high	89.9	Confident	20 Å²	20	50.1 Å²	50.1	10%	0.103	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	122.9	173.9	-58.1	-179.8	0	0	0	107.9	M535 F537 I550 H582	M535-I548 HydrophobicContact CB-CB 4.41Å; M535-I548 PolarHBondContact N-O 3.26Å; M535-I548 PolarHBondContact O-N 3.07Å; F537-I548 HydrophobicContact CD2-CD1 4.44Å; F537-I548 HydrophobicContact CE2-CD1 3.43Å; F537-I548 VanDerWaalsContact CE2-CD1 3.43Å; F537-I548 HydrophobicContact CE2-CG1 3.83Å; F537-I548 HydrophobicContact CZ-CD1 3.78Å; I548-I550 HydrophobicContact CG2-CG2 4.39Å; I548-I550 PolarHBondContact O-N 3.15Å; I548-H582 WeakPolarHBondContact CD1-O 3.43Å
549	Q	89.6	Confident	90	Very high	90 Å²	90	50.8 Å²	50.8	42%	0.421	25%	0.247	S	C	.	.			trans	-80.3	103.7	176.7	-59.4	-61.5	-30	0	0	109.5	R551	Q549-R551 HydrophobicContact CB-CG 4.26Å; Q549-R551 PolarHBondContact O-N 2.85Å
550	I	88.5	Confident	90.4	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.245	C	C	.	.			trans	-83.2	62.1	178.8	55.6	175.7	0	0	0	111.1	S533 M535 I548 F552 A553 V556 I569	S533-I550 WeakPolarHBondContact O-CG1 3.41Å; M535-I550 HydrophobicContact CB-CG2 4.19Å; M535-I550 HydrophobicContact CE-CG2 4.26Å; I548-I550 HydrophobicContact CG2-CG2 4.39Å; I548-I550 PolarHBondContact O-N 3.15Å; I550-F552 HydrophobicContact CB-CE1 4.27Å; I550-F552 HydrophobicContact CB-CE2 4.25Å; I550-F552 HydrophobicContact CB-CZ 3.94Å; I550-F552 HydrophobicContact CG2-CE1 4.31Å; I550-F552 HydrophobicContact CG2-CE2 4.43Å; I550-F552 HydrophobicContact CG2-CZ 3.82Å; I550-F552 PolarHBondContact O-N 2.82Å; I550-A553 HydrophobicContact CD1-CB 4.39Å; I550-A553 PolarHBondContact O-N 2.97Å; I550-A553 VanDerWaalsContact O-O 3.09Å; I550-V556 HydrophobicContact CD1-CG2 3.45Å; I550-V556 VanDerWaalsContact CD1-CG2 3.45Å; I550-I569 HydrophobicContact CD1-CD1 3.81Å
551	R	84.9	Confident	90.8	Very high	189 Å²	189	47 Å²	47	71%	0.713	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-22.1	-175.3	-63.6	-177.4	-180	-176.5	-1.1	113.7	R532 Q549 A553	R532-R551 VanDerWaalsContact CD-O 3.3Å; R532-R551 WeakPolarHBondContact CD-O 3.36Å; R532-R551 PolarHBondContact NH1-O 2.92Å; Q549-R551 HydrophobicContact CB-CG 4.26Å; Q549-R551 PolarHBondContact O-N 2.85Å; R551-A553 VanDerWaalsContact C-N 3.35Å
552	F	85.7	Confident	91.4	Very high	57 Å²	57	43.5 Å²	43.5	25%	0.25	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-12.9	178.2	50.3	-96.1	0	0	0	114.3	I550 I569 Y578 V580 V586	I550-F552 HydrophobicContact CB-CE1 4.27Å; I550-F552 HydrophobicContact CB-CE2 4.25Å; I550-F552 HydrophobicContact CB-CZ 3.94Å; I550-F552 HydrophobicContact CG2-CE1 4.31Å; I550-F552 HydrophobicContact CG2-CE2 4.43Å; I550-F552 HydrophobicContact CG2-CZ 3.82Å; I550-F552 PolarHBondContact O-N 2.82Å; F552-I569 HydrophobicContact CE2-CD1 3.9Å; F552-Y578 HydrophobicContact CB-CE1 4.04Å; F552-Y578 AromaticContact CD2-CD1 3.47Å; F552-Y578 HydrophobicContact CD2-CD1 3.47Å; F552-Y578 VanDerWaalsContact CD2-CD1 3.47Å; F552-Y578 AromaticContact CD2-CD2 3.73Å; F552-Y578 HydrophobicContact CD2-CD2 3.73Å; F552-Y578 AromaticContact CD2-CE1 3.64Å; F552-Y578 HydrophobicContact CD2-CE1 3.64Å; F552-Y578 AromaticContact CD2-CE2 3.85Å; F552-Y578 HydrophobicContact CD2-CE2 3.85Å; F552-Y578 AromaticContact CD2-CG 3.52Å; F552-Y578 HydrophobicContact CD2-CG 3.52Å; F552-Y578 AromaticContact CD2-CZ 3.81Å; F552-Y578 AromaticContact CE2-CD1 3.85Å; F552-Y578 HydrophobicContact CE2-CD1 3.85Å; F552-Y578 HydrophobicContact CE2-CD2 4.03Å; F552-Y578 HydrophobicContact CE2-CE1 4.47Å; F552-Y578 AromaticContact CE2-CG 3.61Å; F552-Y578 HydrophobicContact CE2-CG 3.61Å; F552-Y578 HydrophobicContact CG-CD1 4.24Å; F552-Y578 HydrophobicContact CG-CE1 4.13Å; F552-Y578 PolarHBondContact O-OH 3.43Å; F552-V580 HydrophobicContact CE2-CG2 4.03Å; F552-V580 HydrophobicContact CZ-CG1 4.37Å; F552-V580 HydrophobicContact CZ-CG2 3.77Å; F552-V586 HydrophobicContact CD1-CG2 3.79Å; F552-V586 HydrophobicContact CD2-CG2 4.32Å; F552-V586 HydrophobicContact CE1-CG2 3.37Å; F552-V586 HydrophobicContact CE2-CG2 3.92Å; F552-V586 HydrophobicContact CG-CG2 4.25Å; F552-V586 HydrophobicContact CZ-CG2 3.44Å; F552-V586 VanDerWaalsContact CZ-CG2 3.44Å
553	A	87.6	Confident	91.6	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	23%	0.23	C	C	.	.			trans	-120.5	127.4	178	0	0	0	0	0	110.9	I550 R551 I569 D571 Y578	I550-A553 HydrophobicContact CD1-CB 4.39Å; I550-A553 PolarHBondContact O-N 2.97Å; I550-A553 VanDerWaalsContact O-O 3.09Å; R551-A553 VanDerWaalsContact C-N 3.35Å; A553-I569 HydrophobicContact CB-CD1 3.82Å; A553-D571 HydrophobicContact CB-CB 4.2Å; A553-Y578 HydrophobicContact CB-CE2 4.35Å
554	E	89.4	Confident	91.8	Very high	58 Å²	58	47.6 Å²	47.6	27%	0.271	23%	0.226	S	C	.	.	S	Bend	trans	-83	-53.7	179.8	-68.4	-178.5	-150.9	0	0	111	S533 D571 V573 K574	S533-E554 PolarHBondContact N-O 3.47Å; S533-E554 PolarHBondContact OG-O 3.44Å; E554-D571 PolarHBondContact N-OD2 3.07Å; E554-V573 HydrophobicContact CB-CB 4.05Å; E554-V573 HydrophobicContact CB-CG2 3.83Å; E554-V573 WeakPolarHBondContact OE2-CG1 3.44Å; E554-K574 IonicContact OE1-NZ 2.67Å; E554-K574 PolarHBondContact OE1-NZ 3.27Å
555	I	91.9	Very high	92	Very high	55 Å²	55	45.1 Å²	45.1	28%	0.282	22%	0.221	S	C	.	.	S	Bend	trans	-131	108.8	-179.9	-63.5	177.4	0	0	0	110.6	R512 A557 D571 S572 V573	R512-I555 VanDerWaalsContact CZ-CG2 3.46Å; I555-A557 PolarHBondContact O-N 3.47Å; I555-A557 VanDerWaalsContact O-N 3.09Å; I555-D571 PolarHBondContact N-OD1 3.42Å; I555-D571 WeakPolarHBondContact O-CA 3.21Å; I555-D571 VanDerWaalsContact O-OD1 3.12Å; I555-S572 VanDerWaalsContact CB-OG 3.3Å; I555-S572 WeakPolarHBondContact CB-OG 3.41Å; I555-S572 WeakPolarHBondContact CG2-OG 3.36Å; I555-S572 PolarHBondContact O-N 2.72Å; I555-S572 PolarHBondContact O-OG 3.25Å; I555-V573 HydrophobicContact CB-CG2 4.1Å; I555-V573 HydrophobicContact CD1-CG2 3.77Å; I555-V573 HydrophobicContact CG1-CG2 3.87Å
556	V	95.6	Very high	92.2	Very high	1 Å²	1	41.6 Å²	41.6	1%	0.006	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	106.8	173	-176.6	0	0	0	0	110.4	K513 C526 I550 G558 L559 I569	K513-V556 HydrophobicContact CB-CG1 4.46Å; K513-V556 HydrophobicContact CG-CG1 4.36Å; C526-V556 HydrophobicContact CB-CB 4.12Å; C526-V556 HydrophobicContact CB-CG1 4.14Å; C526-V556 HydrophobicContact CB-CG2 4.17Å; I550-V556 HydrophobicContact CD1-CG2 3.45Å; I550-V556 VanDerWaalsContact CD1-CG2 3.45Å; V556-G558 VanDerWaalsContact CG1-O 3.32Å; V556-G558 WeakPolarHBondContact CG1-O 3.43Å; V556-L559 HydrophobicContact CG1-CB 4.42Å; V556-I569 HydrophobicContact CG1-CB 4.06Å; V556-I569 HydrophobicContact CG1-CG2 3.9Å; V556-I569 HydrophobicContact CG2-CD1 4.18Å; V556-I569 HydrophobicContact CG2-CG2 4.49Å
557	A	95.1	Very high	92.4	Very high	5 Å²	5	37.6 Å²	37.6	4%	0.041	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	-29.5	176.8	0	0	0	0	0	113.2	K513 I555 V570 P598 S599	K513-A557 WeakPolarHBondContact CE-O 3.49Å; K513-A557 PolarHBondContact NZ-O 3.39Å; I555-A557 PolarHBondContact O-N 3.47Å; I555-A557 VanDerWaalsContact O-N 3.09Å; A557-V570 HydrophobicContact CB-CG1 4.32Å; A557-V570 PolarHBondContact N-O 3.22Å; A557-P598 HydrophobicContact CB-CB 4.44Å; A557-P598 WeakPolarHBondContact CB-O 3.4Å; A557-S599 CarbonylContact O-C 3.58Å
558	G	96.2	Very high	92.6	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	147.7	175.7	0	0	0	0	0	110.2	V556 I569 V570	V556-G558 VanDerWaalsContact CG1-O 3.32Å; V556-G558 WeakPolarHBondContact CG1-O 3.43Å; G558-I569 WeakPolarHBondContact O-CA 3.3Å; G558-V570 VanDerWaalsContact N-CG1 3.31Å; G558-V570 PolarHBondContact O-N 3.04Å; G558-V570 VanDerWaalsContact O-N 3.08Å
559	L	97.4	Very high	92.9	Very high	17 Å²	17	35.2 Å²	35.2	9%	0.089	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	125	-179.6	175.8	68	0	0	0	107.8	K513 A515 V556 I567 V568 I569	K513-L559 HydrophobicContact CB-CB 3.71Å; K513-L559 HydrophobicContact CB-CD2 3.95Å; K513-L559 HydrophobicContact CG-CB 4.3Å; A515-L559 HydrophobicContact CB-CD2 3.74Å; A515-L559 HydrophobicContact CB-CG 3.83Å; V556-L559 HydrophobicContact CG1-CB 4.42Å; L559-I567 HydrophobicContact CD1-CG2 3.48Å; L559-I567 VanDerWaalsContact CD1-CG2 3.48Å; L559-V568 WeakPolarHBondContact CA-O 3.48Å; L559-I569 HydrophobicContact CD1-CG2 3.46Å; L559-I569 VanDerWaalsContact CD1-CG2 3.46Å
560	A	97	Very high	93.2	Very high	18 Å²	18	30.9 Å²	30.9	15%	0.149	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	163	177.2	0	0	0	0	0	110.3	V568 L601 I603	A560-V568 PolarHBondContact N-O 3.38Å; A560-V568 PolarHBondContact O-N 3.48Å; A560-L601 HydrophobicContact CB-CD2 4.05Å; A560-L601 HydrophobicContact CB-CG 4.29Å; A560-I603 HydrophobicContact CB-CD1 3.78Å; A560-I603 HydrophobicContact CB-CG1 4.06Å
561	I	95.6	Very high	93.5	Very high	18 Å²	18	30.9 Å²	30.9	9%	0.092	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	121.8	174.3	-52.3	-55.9	0	0	0	108.9	A515 L516 L517 R518 S566 I567	A515-I561 HydrophobicContact CB-CD1 4.33Å; A515-I561 HydrophobicContact CB-CG1 4.22Å; L516-I561 WeakPolarHBondContact O-CG1 3.39Å; L517-I561 HydrophobicContact CD2-CD1 3.76Å; L517-I561 HydrophobicContact CD2-CG1 4.36Å; R518-I561 HydrophobicContact CG-CG2 4.2Å; R518-I561 PolarHBondContact NH2-O 3.37Å; I561-S566 WeakPolarHBondContact CA-O 3.31Å; I561-I567 HydrophobicContact CD1-CB 4.14Å; I561-I567 HydrophobicContact CD1-CG1 3.82Å; I561-I567 HydrophobicContact CD1-CG2 4.09Å
562	D	93.9	Very high	93.9	Very high	6 Å²	6	23 Å²	23	3%	0.032	13%	0.126	C	C	.	.			trans	-76.9	-176.9	-180	73.9	11.5	0	0	0	112.8	R518 D564 G565 S566 V568 I603	R518-D562 PolarHBondContact NE-O 2.69Å; R518-D562 VanDerWaalsContact NE-O 3.13Å; D562-D564 VanDerWaalsContact C-N 3.27Å; D562-D564 PolarHBondContact O-N 3.47Å; D562-D564 WeakPolarHBondContact OD1-CA 3.24Å; D562-D564 PolarHBondContact OD1-N 3.38Å; D562-G565 PolarHBondContact O-N 2.94Å; D562-G565 PolarHBondContact OD1-N 3.09Å; D562-G565 VanDerWaalsContact OD1-N 3.09Å; D562-S566 PolarHBondContact N-O 3.18Å; D562-S566 VanDerWaalsContact N-O 3.12Å; D562-S566 WeakPolarHBondContact OD1-CB 3.45Å; D562-S566 PolarHBondContact OD1-N 2.93Å; D562-S566 WeakPolarHBondContact OD2-CB 3.28Å; D562-V568 HydrophobicContact CB-CG2 3.97Å; D562-I603 HydrophobicContact CB-CD1 3.92Å; D562-I603 HydrophobicContact CB-CG2 4.43Å
563	E	90.7	Very high	94.1	Very high	101 Å²	101	23.6 Å²	23.6	47%	0.472	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-23.7	179.6	-66.5	171.4	-170.6	0	0	112.9	G565 Q605 R606	E563-G565 VanDerWaalsContact C-N 3.25Å; E563-Q605 WeakPolarHBondContact OE1-CA 3.47Å; E563-R606 WeakPolarHBondContact OE2-CG 3.33Å; E563-R606 IonicContact OE2-CZ 2.58Å; E563-R606 IonicContact OE2-NE 3.48Å; E563-R606 PolarHBondContact OE2-NE 2.71Å; E563-R606 IonicContact OE2-NH2 3.41Å
564	D	91	Very high	94.3	Very high	87 Å²	87	29 Å²	29	47%	0.465	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-0.8	178.3	-58.7	-35.1	0	0	0	111.5	D562 S566 R606	D562-D564 VanDerWaalsContact C-N 3.27Å; D562-D564 PolarHBondContact O-N 3.47Å; D562-D564 WeakPolarHBondContact OD1-CA 3.24Å; D562-D564 PolarHBondContact OD1-N 3.38Å; D564-S566 VanDerWaalsContact C-N 3.27Å; D564-S566 PolarHBondContact O-N 2.79Å; D564-R606 IonicContact OD1-CZ 2.88Å; D564-R606 IonicContact OD1-NH1 3.38Å; D564-R606 PolarHBondContact OD1-NH1 3.1Å; D564-R606 IonicContact OD1-NH2 2.98Å; D564-R606 PolarHBondContact OD1-NH2 3.26Å; D564-R606 IonicContact OD2-CZ 2.92Å; D564-R606 IonicContact OD2-NH1 3.91Å; D564-R606 PolarHBondContact OD2-NH1 2.94Å; D564-R606 IonicContact OD2-NH2 3.85Å
565	G	92.4	Very high	94.5	Very high	19 Å²	19	27.4 Å²	27.4	20%	0.196	15%	0.152	C	C	.	.			trans	78.4	8.7	-175.7	0	0	0	0	0	113.7	D562 E563 H582	D562-G565 PolarHBondContact O-N 2.94Å; D562-G565 PolarHBondContact OD1-N 3.09Å; D562-G565 VanDerWaalsContact OD1-N 3.09Å; E563-G565 VanDerWaalsContact C-N 3.25Å; G565-H582 PolarHBondContact O-NE2 3.07Å
566	S	95.1	Very high	94.7	Very high	18 Å²	18	25.1 Å²	25.1	13%	0.126	14%	0.14	C	C	.	.			trans	-72.8	144.1	176.3	-57.8	0	0	0	0	110.5	I561 D562 D564 V568	I561-S566 WeakPolarHBondContact CA-O 3.31Å; D562-S566 PolarHBondContact N-O 3.18Å; D562-S566 VanDerWaalsContact N-O 3.12Å; D562-S566 WeakPolarHBondContact OD1-CB 3.45Å; D562-S566 PolarHBondContact OD1-N 2.93Å; D562-S566 WeakPolarHBondContact OD2-CB 3.28Å; D564-S566 VanDerWaalsContact C-N 3.27Å; D564-S566 PolarHBondContact O-N 2.79Å; S566-V568 PolarHBondContact O-N 3.41Å
567	I	97	Very high	94.8	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	112.6	175.6	-53.9	167.8	0	0	0	107.6	L517 V524 M535 F537 L559 I561 V580	L517-I567 HydrophobicContact CD2-CD1 4.13Å; L517-I567 HydrophobicContact CD2-CG1 3.9Å; V524-I567 HydrophobicContact CG1-CD1 4.32Å; V524-I567 HydrophobicContact CG1-CG2 4.48Å; V524-I567 HydrophobicContact CG2-CD1 4.26Å; M535-I567 HydrophobicContact CE-CB 4.23Å; M535-I567 HydrophobicContact CE-CD1 4.4Å; M535-I567 HydrophobicContact CE-CG2 3.48Å; M535-I567 VanDerWaalsContact CE-CG2 3.48Å; M535-I567 HydrophobicContact SD-CB 4.45Å; M535-I567 HydrophobicContact SD-CD1 3.53Å; M535-I567 VanDerWaalsContact SD-CD1 3.53Å; M535-I567 HydrophobicContact SD-CG2 3.95Å; F537-I567 HydrophobicContact CE1-CD1 3.68Å; F537-I567 HydrophobicContact CZ-CD1 3.52Å; L559-I567 HydrophobicContact CD1-CG2 3.48Å; L559-I567 VanDerWaalsContact CD1-CG2 3.48Å; I561-I567 HydrophobicContact CD1-CB 4.14Å; I561-I567 HydrophobicContact CD1-CG1 3.82Å; I561-I567 HydrophobicContact CD1-CG2 4.09Å; I567-V580 PolarHBondContact N-O 3.48Å; I567-V580 PolarHBondContact O-N 3.2Å
568	V	97.9	Very high	94.9	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	123.8	-177.2	-173.9	0	0	0	0	109.3	L559 A560 D562 S566 V577 Y578 L601 I603 Y608	L559-V568 WeakPolarHBondContact CA-O 3.48Å; A560-V568 PolarHBondContact N-O 3.38Å; A560-V568 PolarHBondContact O-N 3.48Å; D562-V568 HydrophobicContact CB-CG2 3.97Å; S566-V568 PolarHBondContact O-N 3.41Å; V568-V577 HydrophobicContact CG1-CG1 3.54Å; V568-Y578 VanDerWaalsContact CA-O 3.3Å; V568-Y578 WeakPolarHBondContact CA-O 3.24Å; V568-L601 HydrophobicContact CB-CD2 4.1Å; V568-L601 HydrophobicContact CG1-CD2 3.55Å; V568-I603 HydrophobicContact CB-CD1 3.77Å; V568-I603 HydrophobicContact CG1-CD1 4.11Å; V568-I603 HydrophobicContact CG2-CD1 3.6Å; V568-Y608 HydrophobicContact CB-CE1 4.38Å; V568-Y608 HydrophobicContact CG1-CD1 3.88Å; V568-Y608 HydrophobicContact CG1-CE1 3.56Å; V568-Y608 HydrophobicContact CG2-CE1 4Å
569	I	97.4	Very high	94.9	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	148.8	174.8	60.5	173.2	0	0	0	111.2	M535 I550 F552 A553 V556 G558 L559 V577 Y578	M535-I569 HydrophobicContact CE-CG2 4.26Å; I550-I569 HydrophobicContact CD1-CD1 3.81Å; F552-I569 HydrophobicContact CE2-CD1 3.9Å; A553-I569 HydrophobicContact CB-CD1 3.82Å; V556-I569 HydrophobicContact CG1-CB 4.06Å; V556-I569 HydrophobicContact CG1-CG2 3.9Å; V556-I569 HydrophobicContact CG2-CD1 4.18Å; V556-I569 HydrophobicContact CG2-CG2 4.49Å; G558-I569 WeakPolarHBondContact O-CA 3.3Å; L559-I569 HydrophobicContact CD1-CG2 3.46Å; L559-I569 VanDerWaalsContact CD1-CG2 3.46Å; I569-V577 CarbonylContact O-C 3.53Å; I569-V577 WeakPolarHBondContact O-CA 3.37Å; I569-Y578 HydrophobicContact CG1-CD2 4.27Å; I569-Y578 PolarHBondContact N-O 3.44Å; I569-Y578 PolarHBondContact O-N 3.39Å
570	V	97.1	Very high	94.8	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	126.8	167.6	62.3	0	0	0	0	110.1	A557 G558 T576 V577 P598 L601 I610	A557-V570 HydrophobicContact CB-CG1 4.32Å; A557-V570 PolarHBondContact N-O 3.22Å; G558-V570 VanDerWaalsContact N-CG1 3.31Å; G558-V570 PolarHBondContact O-N 3.04Å; G558-V570 VanDerWaalsContact O-N 3.08Å; V570-T576 WeakPolarHBondContact CA-O 3.4Å; V570-V577 HydrophobicContact CB-CG2 4.34Å; V570-V577 HydrophobicContact CG2-CG2 4.26Å; V570-P598 HydrophobicContact CG1-CB 4.46Å; V570-P598 HydrophobicContact CG2-CB 3.78Å; V570-P598 HydrophobicContact CG2-CG 4.16Å; V570-L601 HydrophobicContact CG1-CB 4.09Å; V570-I610 HydrophobicContact CG1-CG2 4.4Å; V570-I610 HydrophobicContact CG2-CD1 4.48Å; V570-I610 HydrophobicContact CG2-CG2 4.13Å
571	D	94.9	Very high	94.6	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	134.1	173.2	-172.4	2.1	0	0	0	110.1	A553 E554 I555 V573 P575 T576 Y578	A553-D571 HydrophobicContact CB-CB 4.2Å; E554-D571 PolarHBondContact N-OD2 3.07Å; I555-D571 PolarHBondContact N-OD1 3.42Å; I555-D571 WeakPolarHBondContact O-CA 3.21Å; I555-D571 VanDerWaalsContact O-OD1 3.12Å; D571-V573 PolarHBondContact OD1-N 2.86Å; D571-P575 VanDerWaalsContact O-CA 3.29Å; D571-P575 WeakPolarHBondContact O-CA 3.28Å; D571-T576 PolarHBondContact N-O 3.23Å; D571-Y578 HydrophobicContact CB-CE2 4.4Å
572	S	92.7	Very high	94.3	Very high	24 Å²	24	27.7 Å²	27.7	17%	0.168	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-23.8	176.6	49.5	0	0	0	0	114.2	I555 P598	I555-S572 VanDerWaalsContact CB-OG 3.3Å; I555-S572 WeakPolarHBondContact CB-OG 3.41Å; I555-S572 WeakPolarHBondContact CG2-OG 3.36Å; I555-S572 PolarHBondContact O-N 2.72Å; I555-S572 PolarHBondContact O-OG 3.25Å; S572-P598 WeakPolarHBondContact CB-O 3.35Å
573	V	90.5	Very high	94.1	Very high	69 Å²	69	31.2 Å²	31.2	42%	0.418	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-45.8	-178.7	-177.5	0	0	0	0	110.5	E554 I555 D571	E554-V573 HydrophobicContact CB-CB 4.05Å; E554-V573 HydrophobicContact CB-CG2 3.83Å; E554-V573 WeakPolarHBondContact OE2-CG1 3.44Å; I555-V573 HydrophobicContact CB-CG2 4.1Å; I555-V573 HydrophobicContact CD1-CG2 3.77Å; I555-V573 HydrophobicContact CG1-CG2 3.87Å; D571-V573 PolarHBondContact OD1-N 2.86Å
574	K	90.3	Very high	94.1	Very high	114 Å²	114	27.3 Å²	27.3	50%	0.496	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118.4	89.2	172.1	-65.8	175.6	-170.8	164.7	0	107.6	E554 T576	E554-K574 IonicContact OE1-NZ 2.67Å; E554-K574 PolarHBondContact OE1-NZ 3.27Å; K574-T576 WeakPolarHBondContact O-CB 3.4Å; K574-T576 PolarHBondContact O-N 2.73Å; K574-T576 PolarHBondContact O-OG1 3.4Å
575	P	95.1	Very high	94.1	Very high	24 Å²	24	29.8 Å²	29.8	16%	0.156	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-45.2	96.1	-175	-31.2	36.7	0	0	0	112.7	D571 T591 C592 M595 P598	D571-P575 VanDerWaalsContact O-CA 3.29Å; D571-P575 WeakPolarHBondContact O-CA 3.28Å; P575-T591 CarbonylContact O-C 3.27Å; P575-T591 WeakPolarHBondContact O-CG2 3.49Å; P575-C592 HydrophobicContact CB-CB 3.8Å; P575-C592 PolarHBondContact O-N 3.46Å; P575-M595 HydrophobicContact CB-CB 4.11Å; P575-M595 HydrophobicContact CG-CB 4.48Å; P575-P598 HydrophobicContact CB-CG 3.73Å; P575-P598 HydrophobicContact CG-CG 3.94Å
576	T	96.1	Very high	94.2	Very high	7 Å²	7	31.3 Å²	31.3	4%	0.043	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	131.4	-170.3	-51.8	0	0	0	0	108.5	V570 D571 K574 Y578 W589 F590	V570-T576 WeakPolarHBondContact CA-O 3.4Å; D571-T576 PolarHBondContact N-O 3.23Å; K574-T576 WeakPolarHBondContact O-CB 3.4Å; K574-T576 PolarHBondContact O-N 2.73Å; K574-T576 PolarHBondContact O-OG1 3.4Å; T576-Y578 HydrophobicContact CG2-CD1 4.49Å; T576-Y578 HydrophobicContact CG2-CD2 4.2Å; T576-Y578 HydrophobicContact CG2-CE1 3.9Å; T576-Y578 HydrophobicContact CG2-CE2 3.61Å; T576-Y578 VanDerWaalsContact CG2-CZ 3.43Å; T576-W589 HydrophobicContact CG2-CE3 4.01Å; T576-F590 CarbonylContact C-O 3.29Å; T576-F590 WeakPolarHBondContact CA-O 3.29Å; T576-F590 VanDerWaalsContact CG2-O 3.31Å; T576-F590 WeakPolarHBondContact CG2-O 3.23Å
577	V	97.2	Very high	94.1	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	133.8	171.6	177.8	0	0	0	0	108.8	V568 I569 V570 W589 F590 Y608 I610	V568-V577 HydrophobicContact CG1-CG1 3.54Å; I569-V577 CarbonylContact O-C 3.53Å; I569-V577 WeakPolarHBondContact O-CA 3.37Å; V570-V577 HydrophobicContact CB-CG2 4.34Å; V570-V577 HydrophobicContact CG2-CG2 4.26Å; V577-W589 CarbonylContact O-C 3.55Å; V577-W589 WeakPolarHBondContact O-CA 3.23Å; V577-W589 VanDerWaalsContact O-CB 3.27Å; V577-W589 WeakPolarHBondContact O-CB 3.41Å; V577-F590 HydrophobicContact CB-CD1 4.25Å; V577-F590 HydrophobicContact CB-CD2 4.23Å; V577-F590 HydrophobicContact CB-CE1 3.79Å; V577-F590 HydrophobicContact CB-CE2 3.77Å; V577-F590 HydrophobicContact CB-CG 4.46Å; V577-F590 HydrophobicContact CB-CZ 3.54Å; V577-F590 HydrophobicContact CG1-CE1 3.89Å; V577-F590 HydrophobicContact CG1-CZ 3.88Å; V577-F590 HydrophobicContact CG2-CD2 4.39Å; V577-F590 HydrophobicContact CG2-CE1 4.34Å; V577-F590 HydrophobicContact CG2-CE2 3.6Å; V577-F590 HydrophobicContact CG2-CZ 3.58Å; V577-F590 PolarHBondContact N-O 3.18Å; V577-F590 PolarHBondContact O-N 3.01Å; V577-Y608 HydrophobicContact CG1-CD1 4.09Å; V577-Y608 HydrophobicContact CG1-CE1 4.22Å; V577-I610 HydrophobicContact CG2-CD1 3.37Å
578	Y	96.6	Very high	93.9	Very high	27 Å²	27	37.9 Å²	37.9	11%	0.106	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	130	172.4	-59.2	-87.6	0	0	0	109.4	F552 A553 V568 I569 D571 T576 V586 W589	F552-Y578 HydrophobicContact CB-CE1 4.04Å; F552-Y578 AromaticContact CD2-CD1 3.47Å; F552-Y578 HydrophobicContact CD2-CD1 3.47Å; F552-Y578 VanDerWaalsContact CD2-CD1 3.47Å; F552-Y578 AromaticContact CD2-CD2 3.73Å; F552-Y578 HydrophobicContact CD2-CD2 3.73Å; F552-Y578 AromaticContact CD2-CE1 3.64Å; F552-Y578 HydrophobicContact CD2-CE1 3.64Å; F552-Y578 AromaticContact CD2-CE2 3.85Å; F552-Y578 HydrophobicContact CD2-CE2 3.85Å; F552-Y578 AromaticContact CD2-CG 3.52Å; F552-Y578 HydrophobicContact CD2-CG 3.52Å; F552-Y578 AromaticContact CD2-CZ 3.81Å; F552-Y578 AromaticContact CE2-CD1 3.85Å; F552-Y578 HydrophobicContact CE2-CD1 3.85Å; F552-Y578 HydrophobicContact CE2-CD2 4.03Å; F552-Y578 HydrophobicContact CE2-CE1 4.47Å; F552-Y578 AromaticContact CE2-CG 3.61Å; F552-Y578 HydrophobicContact CE2-CG 3.61Å; F552-Y578 HydrophobicContact CG-CD1 4.24Å; F552-Y578 HydrophobicContact CG-CE1 4.13Å; F552-Y578 PolarHBondContact O-OH 3.43Å; A553-Y578 HydrophobicContact CB-CE2 4.35Å; V568-Y578 VanDerWaalsContact CA-O 3.3Å; V568-Y578 WeakPolarHBondContact CA-O 3.24Å; I569-Y578 HydrophobicContact CG1-CD2 4.27Å; I569-Y578 PolarHBondContact N-O 3.44Å; I569-Y578 PolarHBondContact O-N 3.39Å; D571-Y578 HydrophobicContact CB-CE2 4.4Å; T576-Y578 HydrophobicContact CG2-CD1 4.49Å; T576-Y578 HydrophobicContact CG2-CD2 4.2Å; T576-Y578 HydrophobicContact CG2-CE1 3.9Å; T576-Y578 HydrophobicContact CG2-CE2 3.61Å; T576-Y578 VanDerWaalsContact CG2-CZ 3.43Å; Y578-V586 HydrophobicContact CD1-CG1 4.05Å; Y578-W589 HydrophobicContact CD1-CB 3.46Å; Y578-W589 VanDerWaalsContact CD1-CB 3.46Å; Y578-W589 HydrophobicContact CD1-CG 4.14Å; Y578-W589 HydrophobicContact CE1-CB 3.87Å; Y578-W589 HydrophobicContact CE1-CG 4.17Å; Y578-W589 HydrophobicContact CG-CB 4.24Å
579	C	96	Very high	93.8	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	117.6	167.3	-57.5	0	0	0	0	107.5	V586 S587 R588	C579-V586 WeakPolarHBondContact O-CA 3.47Å; C579-S587 PolarHBondContact O-N 2.77Å; C579-S587 PolarHBondContact O-OG 3.31Å; C579-R588 HydrophobicContact CB-CB 4.1Å; C579-R588 PolarHBondContact N-O 2.9Å; C579-R588 PolarHBondContact SG-NH1 3.12Å; C579-R588 VanDerWaalsContact SG-NH1 3.45Å
580	V	95.6	Very high	93.6	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	131.9	-170	-166.1	0	0	0	0	109.1	F552 I567 E585	F552-V580 HydrophobicContact CE2-CG2 4.03Å; F552-V580 HydrophobicContact CZ-CG1 4.37Å; F552-V580 HydrophobicContact CZ-CG2 3.77Å; I567-V580 PolarHBondContact N-O 3.48Å; I567-V580 PolarHBondContact O-N 3.2Å; V580-E585 CarbonylContact C-O 3.59Å; V580-E585 WeakPolarHBondContact CA-O 3.15Å
581	S	93	Very high	93.5	Very high	30 Å²	30	49.7 Å²	49.7	21%	0.21	26%	0.263	C	S	.	.			trans	-69.3	166.5	172.2	75.2	0	0	0	0	110.8	S583 G584 E585	S581-S583 PolarHBondContact O-N 3.46Å; S581-S583 PolarHBondContact OG-N 2.86Å; S581-S583 PolarHBondContact OG-OG 2.95Å; S581-G584 PolarHBondContact O-N 2.99Å; S581-G584 PolarHBondContact OG-N 3.21Å; S581-E585 PolarHBondContact N-O 3.11Å; S581-E585 PolarHBondContact OG-N 3.18Å; S581-E585 VanDerWaalsContact OG-N 3.1Å; S581-E585 PolarHBondContact OG-O 3.15Å
582	H	90.6	Very high	93.4	Very high	56 Å²	56	49.9 Å²	49.9	26%	0.259	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-16.9	175	-56.4	176.9	0	0	0	112.4	D519 K546 I548 G565 G584	D519-H582 IonicContact OD1-CE1 3.63Å; K546-H582 VanDerWaalsContact CE-O 3.24Å; K546-H582 WeakPolarHBondContact CE-O 3.14Å; K546-H582 PolarHBondContact NZ-O 3.25Å; I548-H582 WeakPolarHBondContact CD1-O 3.43Å; G565-H582 PolarHBondContact O-NE2 3.07Å; H582-G584 VanDerWaalsContact C-N 3.34Å
583	S	89.3	Confident	92.9	Very high	80 Å²	80	55 Å²	55	56%	0.559	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-12.5	172.4	58.3	0	0	0	0	113	S581	S581-S583 PolarHBondContact O-N 3.46Å; S581-S583 PolarHBondContact OG-N 2.86Å; S581-S583 PolarHBondContact OG-OG 2.95Å
584	G	90.4	Very high	92.5	Very high	18 Å²	18	57.7 Å²	57.7	19%	0.186	30%	0.298	C	S	.	.	S	Bend	trans	99.1	3.5	178.7	0	0	0	0	0	114.3	S581 H582	S581-G584 PolarHBondContact O-N 2.99Å; S581-G584 PolarHBondContact OG-N 3.21Å; H582-G584 VanDerWaalsContact C-N 3.34Å
585	E	91.7	Very high	92.6	Very high	139 Å²	139	53 Å²	53	65%	0.65	28%	0.278	S	S	*	.			trans	-75.4	133.1	175	-64.8	176.9	171.8	0	0	110.1	V580 S581 S587	V580-E585 CarbonylContact C-O 3.59Å; V580-E585 WeakPolarHBondContact CA-O 3.15Å; S581-E585 PolarHBondContact N-O 3.11Å; S581-E585 PolarHBondContact OG-N 3.18Å; S581-E585 VanDerWaalsContact OG-N 3.1Å; S581-E585 PolarHBondContact OG-O 3.15Å; E585-S587 PolarHBondContact O-N 3.12Å
586	V	94.1	Very high	92.6	Very high	52 Å²	52	57.4 Å²	57.4	32%	0.315	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	107.2	174.7	-179.1	0	0	0	0	108.2	F552 Y578 C579 R588 W589	F552-V586 HydrophobicContact CD1-CG2 3.79Å; F552-V586 HydrophobicContact CD2-CG2 4.32Å; F552-V586 HydrophobicContact CE1-CG2 3.37Å; F552-V586 HydrophobicContact CE2-CG2 3.92Å; F552-V586 HydrophobicContact CG-CG2 4.25Å; F552-V586 HydrophobicContact CZ-CG2 3.44Å; F552-V586 VanDerWaalsContact CZ-CG2 3.44Å; Y578-V586 HydrophobicContact CD1-CG1 4.05Å; C579-V586 WeakPolarHBondContact O-CA 3.47Å; V586-R588 WeakPolarHBondContact CG1-O 3.39Å; V586-W589 HydrophobicContact CG1-CB 4.14Å; V586-W589 HydrophobicContact CG1-CG 4.35Å
587	S	91.9	Very high	92.5	Very high	78 Å²	78	60 Å²	60	55%	0.545	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	-32.2	178.4	61.9	0	0	0	0	112.1	C579 E585	C579-S587 PolarHBondContact O-N 2.77Å; C579-S587 PolarHBondContact O-OG 3.31Å; E585-S587 PolarHBondContact O-N 3.12Å
588	R	92.6	Very high	92.5	Very high	78 Å²	78	60.2 Å²	60.2	29%	0.294	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	150	-178	-159.3	-170.9	-45	115.1	8.1	110.5	C579 V586 Y608 S623	C579-R588 HydrophobicContact CB-CB 4.1Å; C579-R588 PolarHBondContact N-O 2.9Å; C579-R588 PolarHBondContact SG-NH1 3.12Å; C579-R588 VanDerWaalsContact SG-NH1 3.45Å; V586-R588 WeakPolarHBondContact CG1-O 3.39Å; R588-Y608 PolarHBondContact NH1-OH 3.06Å; R588-S623 WeakPolarHBondContact CD-O 3.49Å
589	W	95.6	Very high	92.4	Very high	156 Å²	156	60 Å²	60	59%	0.591	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-153.9	158.1	170.7	61.9	-87	0	0	0	111.2	T576 V577 Y578 V586	T576-W589 HydrophobicContact CG2-CE3 4.01Å; V577-W589 CarbonylContact O-C 3.55Å; V577-W589 WeakPolarHBondContact O-CA 3.23Å; V577-W589 VanDerWaalsContact O-CB 3.27Å; V577-W589 WeakPolarHBondContact O-CB 3.41Å; Y578-W589 HydrophobicContact CD1-CB 3.46Å; Y578-W589 VanDerWaalsContact CD1-CB 3.46Å; Y578-W589 HydrophobicContact CD1-CG 4.14Å; Y578-W589 HydrophobicContact CE1-CB 3.87Å; Y578-W589 HydrophobicContact CE1-CG 4.17Å; Y578-W589 HydrophobicContact CG-CB 4.24Å; V586-W589 HydrophobicContact CG1-CB 4.14Å; V586-W589 HydrophobicContact CG1-CG 4.35Å
590	F	95.2	Very high	92.5	Very high	15 Å²	15	60.6 Å²	60.6	7%	0.066	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	146.8	173.1	59.6	-96.8	0	0	0	111.5	T576 V577 Y608 F621 G625	T576-F590 CarbonylContact C-O 3.29Å; T576-F590 WeakPolarHBondContact CA-O 3.29Å; T576-F590 VanDerWaalsContact CG2-O 3.31Å; T576-F590 WeakPolarHBondContact CG2-O 3.23Å; V577-F590 HydrophobicContact CB-CD1 4.25Å; V577-F590 HydrophobicContact CB-CD2 4.23Å; V577-F590 HydrophobicContact CB-CE1 3.79Å; V577-F590 HydrophobicContact CB-CE2 3.77Å; V577-F590 HydrophobicContact CB-CG 4.46Å; V577-F590 HydrophobicContact CB-CZ 3.54Å; V577-F590 HydrophobicContact CG1-CE1 3.89Å; V577-F590 HydrophobicContact CG1-CZ 3.88Å; V577-F590 HydrophobicContact CG2-CD2 4.39Å; V577-F590 HydrophobicContact CG2-CE1 4.34Å; V577-F590 HydrophobicContact CG2-CE2 3.6Å; V577-F590 HydrophobicContact CG2-CZ 3.58Å; V577-F590 PolarHBondContact N-O 3.18Å; V577-F590 PolarHBondContact O-N 3.01Å; F590-Y608 HydrophobicContact CZ-CD2 4.39Å; F590-Y608 HydrophobicContact CZ-CG 4.22Å; F590-F621 HydrophobicContact CD2-CD1 4.4Å; F590-F621 HydrophobicContact CE2-CB 3.81Å; F590-F621 AromaticContact CE2-CD1 3.93Å; F590-F621 HydrophobicContact CE2-CD1 3.93Å; F590-F621 HydrophobicContact CE2-CD2 4.37Å; F590-F621 AromaticContact CE2-CG 3.8Å; F590-F621 HydrophobicContact CE2-CG 3.8Å; F590-F621 HydrophobicContact CZ-CB 3.9Å; F590-F621 HydrophobicContact CZ-CG 4.36Å; F590-G625 VanDerWaalsContact CD2-CA 3.44Å
591	T	94.7	Very high	92.5	Very high	76 Å²	76	61 Å²	61	47%	0.466	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	134.5	176.2	-53.2	0	0	0	0	110.8	P575 Q593	P575-T591 CarbonylContact O-C 3.27Å; P575-T591 WeakPolarHBondContact O-CG2 3.49Å; T591-Q593 PolarHBondContact O-N 3.26Å; T591-Q593 VanDerWaalsContact O-N 3.12Å
592	C	91.1	Very high	92.8	Very high	4 Å²	4	60 Å²	60	3%	0.027	31%	0.314	C	S	.	.			trans	-81.4	85.3	175.4	-55.9	0	0	0	0	109.6	P575 M595 F621	P575-C592 HydrophobicContact CB-CB 3.8Å; P575-C592 PolarHBondContact O-N 3.46Å; C592-M595 HydrophobicContact CB-CB 4.2Å; C592-M595 HydrophobicContact CB-CG 4.05Å; C592-M595 HydrophobicContact CB-SD 3.64Å; C592-M595 PolarHBondContact O-N 3.26Å; C592-F621 HydrophobicContact CB-CE2 4.45Å; C592-F621 HydrophobicContact CB-CZ 3.93Å
593	Q	82.7	Confident	93	Very high	133 Å²	133	59.1 Å²	59.1	62%	0.621	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	141.1	178.3	-63.1	-178.4	-2	0	0	111.1	T591 M595 I627	T591-Q593 PolarHBondContact O-N 3.26Å; T591-Q593 VanDerWaalsContact O-N 3.12Å; Q593-M595 VanDerWaalsContact C-N 3.25Å; Q593-M595 PolarHBondContact O-N 3.29Å; Q593-I627 HydrophobicContact CB-CD1 4.45Å
594	N	82.6	Confident	93.3	Very high	124 Å²	124	57.6 Å²	57.6	66%	0.663	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	65	14.1	177.7	-48.4	-54	0	0	0	116.5	Y619	N594-Y619 PolarHBondContact O-OH 3.19Å
595	M	92.7	Very high	93.5	Very high	15 Å²	15	62.9 Å²	62.9	7%	0.074	31%	0.313	C	S	.	.			trans	-89.3	136.3	170.3	-77.8	-169.1	77.7	0	0	111.7	P575 C592 Q593 P598 I610 C611 D612 Y619 F621	P575-M595 HydrophobicContact CB-CB 4.11Å; P575-M595 HydrophobicContact CG-CB 4.48Å; C592-M595 HydrophobicContact CB-CB 4.2Å; C592-M595 HydrophobicContact CB-CG 4.05Å; C592-M595 HydrophobicContact CB-SD 3.64Å; C592-M595 PolarHBondContact O-N 3.26Å; Q593-M595 VanDerWaalsContact C-N 3.25Å; Q593-M595 PolarHBondContact O-N 3.29Å; M595-P598 HydrophobicContact CB-CG 4.47Å; M595-P598 HydrophobicContact CE-CB 3.83Å; M595-P598 HydrophobicContact CE-CG 3.73Å; M595-P598 HydrophobicContact SD-CG 4.21Å; M595-I610 HydrophobicContact CE-CB 4.12Å; M595-I610 HydrophobicContact CE-CG2 3.54Å; M595-I610 HydrophobicContact SD-CB 4.08Å; M595-I610 HydrophobicContact SD-CG2 3.83Å; M595-C611 WeakPolarHBondContact CE-O 3.47Å; M595-D612 VanDerWaalsContact CA-OD2 3.31Å; M595-D612 WeakPolarHBondContact CA-OD2 3.35Å; M595-D612 HydrophobicContact CE-CB 3.54Å; M595-D612 HydrophobicContact CG-CB 4.39Å; M595-Y619 HydrophobicContact CG-CD2 3.69Å; M595-Y619 HydrophobicContact CG-CE2 3.98Å; M595-Y619 HydrophobicContact CG-CG 4.36Å; M595-Y619 HydrophobicContact SD-CD2 4.32Å; M595-F621 HydrophobicContact SD-CE2 4.29Å; M595-F621 HydrophobicContact SD-CZ 4.47Å
596	L	94	Very high	93.5	Very high	117 Å²	117	61.3 Å²	61.3	61%	0.613	30%	0.301	S	S	*	.	S	Bend	trans	-90	-46.9	178.2	-64.8	177.9	0	0	0	112.3	D612 K614	L596-D612 PolarHBondContact N-OD1 3.48Å; L596-D612 PolarHBondContact N-OD2 3.37Å; L596-K614 HydrophobicContact CB-CB 3.67Å; L596-K614 HydrophobicContact CD1-CB 4.06Å
597	E	95.1	Very high	93.6	Very high	63 Å²	63	60.8 Å²	60.8	29%	0.294	30%	0.296	S	S	.	.			trans	-153.9	93.7	-179.3	-170.9	171.9	146.8	0	0	111.2	S599 D612 F613 K614	E597-S599 PolarHBondContact O-N 2.77Å; E597-D612 PolarHBondContact N-OD1 3.4Å; E597-F613 HydrophobicContact CB-CB 4.38Å; E597-F613 HydrophobicContact CG-CB 4.47Å; E597-F613 WeakPolarHBondContact O-CB 3.35Å; E597-F613 PolarHBondContact O-N 2.86Å; E597-K614 HydrophobicContact CB-CB 4.11Å; E597-K614 HydrophobicContact CB-CD 4.15Å; E597-K614 HydrophobicContact CB-CG 4.04Å; E597-K614 VanDerWaalsContact OE2-CD 3.22Å; E597-K614 WeakPolarHBondContact OE2-CD 3.3Å; E597-K614 WeakPolarHBondContact OE2-CE 3.07Å; E597-K614 IonicContact OE2-NZ 2.75Å; E597-K614 PolarHBondContact OE2-NZ 3.06Å
598	P	96.8	Very high	93.9	Very high	3 Å²	3	57.2 Å²	57.2	2%	0.019	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.8	133.5	172.3	-23.1	31.6	0	0	0	112.1	A557 V570 S572 P575 M595 I610 C611	A557-P598 HydrophobicContact CB-CB 4.44Å; A557-P598 WeakPolarHBondContact CB-O 3.4Å; V570-P598 HydrophobicContact CG1-CB 4.46Å; V570-P598 HydrophobicContact CG2-CB 3.78Å; V570-P598 HydrophobicContact CG2-CG 4.16Å; S572-P598 WeakPolarHBondContact CB-O 3.35Å; P575-P598 HydrophobicContact CB-CG 3.73Å; P575-P598 HydrophobicContact CG-CG 3.94Å; M595-P598 HydrophobicContact CB-CG 4.47Å; M595-P598 HydrophobicContact CE-CB 3.83Å; M595-P598 HydrophobicContact CE-CG 3.73Å; M595-P598 HydrophobicContact SD-CG 4.21Å; P598-I610 HydrophobicContact CB-CG2 4.21Å; P598-C611 CarbonylContact C-O 3.55Å; P598-C611 VanDerWaalsContact CA-O 3.27Å; P598-C611 WeakPolarHBondContact CA-O 3.18Å
599	S	95.2	Very high	94.1	Very high	23 Å²	23	53.7 Å²	53.7	16%	0.161	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	-26.6	-176.6	53.4	0	0	0	0	115.3	A557 E597 C611 P640	A557-S599 CarbonylContact O-C 3.58Å; E597-S599 PolarHBondContact O-N 2.77Å; S599-C611 PolarHBondContact N-O 3.24Å; S599-C611 WeakPolarHBondContact OG-CB 3.44Å; S599-C611 PolarHBondContact OG-O 3.33Å; S599-P640 PolarHBondContact OG-O 3.41Å
600	D	96.8	Very high	94.2	Very high	13 Å²	13	46.3 Å²	46.3	7%	0.07	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.9	166.4	174.8	-149.2	14.2	0	0	0	111.8	K513 I610 C611 G642 I643	K513-D600 IonicContact NZ-OD1 3.84Å; K513-D600 PolarHBondContact NZ-OD1 2.99Å; D600-I610 WeakPolarHBondContact O-CA 3.28Å; D600-C611 PolarHBondContact O-N 2.92Å; D600-G642 WeakPolarHBondContact OD2-CA 3.4Å; D600-I643 HydrophobicContact CB-CG2 4.04Å; D600-I643 PolarHBondContact OD2-N 2.78Å
601	L	97.3	Very high	94.3	Very high	8 Å²	8	45.6 Å²	45.6	4%	0.042	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	134.6	-174.5	169.2	71.2	0	0	0	110.6	A560 V568 V570 I603 Y608 F609 I610	A560-L601 HydrophobicContact CB-CD2 4.05Å; A560-L601 HydrophobicContact CB-CG 4.29Å; V568-L601 HydrophobicContact CB-CD2 4.1Å; V568-L601 HydrophobicContact CG1-CD2 3.55Å; V570-L601 HydrophobicContact CG1-CB 4.09Å; L601-I603 HydrophobicContact CD1-CG1 4.41Å; L601-I603 HydrophobicContact CG-CG1 4.44Å; L601-Y608 HydrophobicContact CD1-CD1 4.28Å; L601-F609 WeakPolarHBondContact CA-O 3.42Å; L601-I610 HydrophobicContact CD1-CG1 3.86Å
602	A	97.4	Very high	94.3	Very high	10 Å²	10	42 Å²	42	8%	0.083	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	155.2	163.3	0	0	0	0	0	110.4	F609 I643 I645	A602-F609 HydrophobicContact CB-CB 4.49Å; A602-F609 PolarHBondContact N-O 3.41Å; A602-F609 PolarHBondContact O-N 2.88Å; A602-I643 HydrophobicContact CB-CG1 4.15Å; A602-I643 HydrophobicContact CB-CG2 3.89Å; A602-I645 HydrophobicContact CB-CD1 3.91Å; A602-I645 HydrophobicContact CB-CG1 3.97Å
603	I	96.5	Very high	94.5	Very high	36 Å²	36	43.1 Å²	43.1	19%	0.185	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	131.3	-179.7	-55.1	174.4	0	0	0	108.3	A560 D562 V568 L601 D607 Y608	A560-I603 HydrophobicContact CB-CD1 3.78Å; A560-I603 HydrophobicContact CB-CG1 4.06Å; D562-I603 HydrophobicContact CB-CD1 3.92Å; D562-I603 HydrophobicContact CB-CG2 4.43Å; V568-I603 HydrophobicContact CB-CD1 3.77Å; V568-I603 HydrophobicContact CG1-CD1 4.11Å; V568-I603 HydrophobicContact CG2-CD1 3.6Å; L601-I603 HydrophobicContact CD1-CG1 4.41Å; L601-I603 HydrophobicContact CG-CG1 4.44Å; I603-D607 WeakPolarHBondContact CA-O 3.1Å; I603-Y608 HydrophobicContact CD1-CD1 4.13Å; I603-Y608 HydrophobicContact CD1-CE1 3.94Å; I603-Y608 HydrophobicContact CG1-CD1 4.05Å; I603-Y608 HydrophobicContact CG1-CE1 4.32Å
604	Y	95.5	Very high	95	Very high	49 Å²	49	42.3 Å²	42.3	19%	0.192	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	125.8	177.2	-178	-98.7	0	0	0	109.9	R606 D607 I645 G649 P668	Y604-R606 VanDerWaalsContact C-N 3.26Å; Y604-R606 PolarHBondContact O-N 3.41Å; Y604-D607 PolarHBondContact N-O 3.48Å; Y604-D607 WeakPolarHBondContact O-CB 3.49Å; Y604-D607 PolarHBondContact O-N 3.18Å; Y604-I645 VanDerWaalsContact CB-CD1 3.49Å; Y604-I645 HydrophobicContact CD1-CG2 4.41Å; Y604-I645 HydrophobicContact CD2-CB 4.4Å; Y604-I645 HydrophobicContact CD2-CG2 3.54Å; Y604-I645 HydrophobicContact CE2-CG2 4.12Å; Y604-I645 HydrophobicContact CG-CD1 4.39Å; Y604-I645 HydrophobicContact CG-CG2 3.71Å; Y604-G649 WeakPolarHBondContact OH-CA 3.35Å; Y604-P668 HydrophobicContact CE1-CB 4.43Å
605	Q	93	Very high	95.5	Very high	129 Å²	129	37 Å²	37	60%	0.603	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.6	42.7	-179.4	-62.7	-179.9	-6.3	0	0	113.2	E563 D607	E563-Q605 WeakPolarHBondContact OE1-CA 3.47Å; Q605-D607 PolarHBondContact O-N 3.15Å; Q605-D607 VanDerWaalsContact O-N 3.13Å
606	R	93.1	Very high	95.6	Very high	105 Å²	105	38.5 Å²	38.5	40%	0.396	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.8	7.6	-176.2	-54.2	-179.5	170.5	-96.1	-3.2	116.3	E563 D564 Y604 Y608	E563-R606 WeakPolarHBondContact OE2-CG 3.33Å; E563-R606 IonicContact OE2-CZ 2.58Å; E563-R606 IonicContact OE2-NE 3.48Å; E563-R606 PolarHBondContact OE2-NE 2.71Å; E563-R606 IonicContact OE2-NH2 3.41Å; D564-R606 IonicContact OD1-CZ 2.88Å; D564-R606 IonicContact OD1-NH1 3.38Å; D564-R606 PolarHBondContact OD1-NH1 3.1Å; D564-R606 IonicContact OD1-NH2 2.98Å; D564-R606 PolarHBondContact OD1-NH2 3.26Å; D564-R606 IonicContact OD2-CZ 2.92Å; D564-R606 IonicContact OD2-NH1 3.91Å; D564-R606 PolarHBondContact OD2-NH1 2.94Å; D564-R606 IonicContact OD2-NH2 3.85Å; Y604-R606 VanDerWaalsContact C-N 3.26Å; Y604-R606 PolarHBondContact O-N 3.41Å; R606-Y608 WeakPolarHBondContact O-CD2 3.31Å; R606-Y608 VanDerWaalsContact O-CE2 3.24Å; R606-Y608 WeakPolarHBondContact O-CE2 3.17Å
607	D	95.9	Very high	95.7	Very high	41 Å²	41	33 Å²	33	22%	0.219	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	141.7	168.7	-71.7	-14.9	0	0	0	110.3	I603 Y604 Q605 F609 V620 F621 I628	I603-D607 WeakPolarHBondContact CA-O 3.1Å; Y604-D607 PolarHBondContact N-O 3.48Å; Y604-D607 WeakPolarHBondContact O-CB 3.49Å; Y604-D607 PolarHBondContact O-N 3.18Å; Q605-D607 PolarHBondContact O-N 3.15Å; Q605-D607 VanDerWaalsContact O-N 3.13Å; D607-F609 HydrophobicContact CB-CE2 3.92Å; D607-V620 HydrophobicContact CB-CG1 3.93Å; D607-F621 CarbonylContact C-O 3.55Å; D607-F621 WeakPolarHBondContact CA-O 3.18Å; D607-I628 HydrophobicContact CB-CD1 4.31Å; D607-I628 VanDerWaalsContact OD1-CD1 3.3Å; D607-I628 WeakPolarHBondContact OD1-CD1 3.36Å; D607-I628 VanDerWaalsContact OD2-CD1 3.22Å; D607-I628 WeakPolarHBondContact OD2-CD1 3.3Å
608	Y	97.2	Very high	95.8	Very high	4 Å²	4	30 Å²	30	2%	0.016	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	113.3	-174.4	-61.4	-106.2	0	0	0	108.8	V568 V577 R588 F590 L601 I603 R606 V620 F621 S623	V568-Y608 HydrophobicContact CB-CE1 4.38Å; V568-Y608 HydrophobicContact CG1-CD1 3.88Å; V568-Y608 HydrophobicContact CG1-CE1 3.56Å; V568-Y608 HydrophobicContact CG2-CE1 4Å; V577-Y608 HydrophobicContact CG1-CD1 4.09Å; V577-Y608 HydrophobicContact CG1-CE1 4.22Å; R588-Y608 PolarHBondContact NH1-OH 3.06Å; F590-Y608 HydrophobicContact CZ-CD2 4.39Å; F590-Y608 HydrophobicContact CZ-CG 4.22Å; L601-Y608 HydrophobicContact CD1-CD1 4.28Å; I603-Y608 HydrophobicContact CD1-CD1 4.13Å; I603-Y608 HydrophobicContact CD1-CE1 3.94Å; I603-Y608 HydrophobicContact CG1-CD1 4.05Å; I603-Y608 HydrophobicContact CG1-CE1 4.32Å; R606-Y608 WeakPolarHBondContact O-CD2 3.31Å; R606-Y608 VanDerWaalsContact O-CE2 3.24Å; R606-Y608 WeakPolarHBondContact O-CE2 3.17Å; Y608-V620 CarbonylContact O-C 3.57Å; Y608-V620 WeakPolarHBondContact O-CA 3.35Å; Y608-F621 PolarHBondContact N-O 3.45Å; Y608-F621 PolarHBondContact O-N 2.77Å; Y608-S623 VanDerWaalsContact CE2-CA 3.48Å
609	F	97.8	Very high	95.8	Very high	4 Å²	4	31.2 Å²	31.2	2%	0.018	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	112.6	179.2	-68.9	-110.7	0	0	0	108.9	L601 A602 D607 V618 Y619 V620 I631 I643 I645 V651	L601-F609 WeakPolarHBondContact CA-O 3.42Å; A602-F609 HydrophobicContact CB-CB 4.49Å; A602-F609 PolarHBondContact N-O 3.41Å; A602-F609 PolarHBondContact O-N 2.88Å; D607-F609 HydrophobicContact CB-CE2 3.92Å; F609-V618 HydrophobicContact CB-CG1 4.07Å; F609-V618 HydrophobicContact CD1-CG1 4.31Å; F609-Y619 WeakPolarHBondContact CA-O 3.25Å; F609-V620 HydrophobicContact CD1-CB 4.46Å; F609-V620 HydrophobicContact CD1-CG1 4.24Å; F609-V620 HydrophobicContact CD1-CG2 3.52Å; F609-V620 HydrophobicContact CD2-CG1 4.08Å; F609-V620 HydrophobicContact CE1-CB 4.39Å; F609-V620 HydrophobicContact CE1-CG1 3.97Å; F609-V620 HydrophobicContact CE1-CG2 3.48Å; F609-V620 VanDerWaalsContact CE1-CG2 3.48Å; F609-V620 HydrophobicContact CE2-CG1 3.8Å; F609-V620 HydrophobicContact CG-CG1 4.28Å; F609-V620 HydrophobicContact CG-CG2 4.19Å; F609-V620 HydrophobicContact CZ-CG1 3.74Å; F609-V620 HydrophobicContact CZ-CG2 4.12Å; F609-I631 HydrophobicContact CD1-CD1 4.21Å; F609-I631 HydrophobicContact CE1-CD1 3.85Å; F609-I643 HydrophobicContact CB-CD1 3.7Å; F609-I645 HydrophobicContact CB-CD1 4.13Å; F609-I645 HydrophobicContact CD1-CD1 4.14Å; F609-I645 HydrophobicContact CD2-CD1 3.41Å; F609-I645 VanDerWaalsContact CD2-CD1 3.41Å; F609-I645 HydrophobicContact CE1-CD1 4.43Å; F609-I645 HydrophobicContact CE2-CD1 3.76Å; F609-I645 HydrophobicContact CG-CD1 3.64Å; F609-I645 HydrophobicContact CZ-CD1 4.26Å; F609-V651 HydrophobicContact CD1-CG1 4.21Å; F609-V651 HydrophobicContact CD1-CG2 4.16Å; F609-V651 HydrophobicContact CE1-CG2 3.75Å; F609-V651 HydrophobicContact CZ-CG2 4.39Å
610	I	97.8	Very high	95.9	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	122	-172.7	-43.3	-177.8	0	0	0	109.5	V570 V577 M595 P598 D600 L601 V618 Y619 F621	V570-I610 HydrophobicContact CG1-CG2 4.4Å; V570-I610 HydrophobicContact CG2-CD1 4.48Å; V570-I610 HydrophobicContact CG2-CG2 4.13Å; V577-I610 HydrophobicContact CG2-CD1 3.37Å; M595-I610 HydrophobicContact CE-CB 4.12Å; M595-I610 HydrophobicContact CE-CG2 3.54Å; M595-I610 HydrophobicContact SD-CB 4.08Å; M595-I610 HydrophobicContact SD-CG2 3.83Å; P598-I610 HydrophobicContact CB-CG2 4.21Å; D600-I610 WeakPolarHBondContact O-CA 3.28Å; L601-I610 HydrophobicContact CD1-CG1 3.86Å; I610-V618 CarbonylContact O-C 3.57Å; I610-V618 WeakPolarHBondContact O-CA 3.17Å; I610-Y619 PolarHBondContact N-O 3.37Å; I610-Y619 PolarHBondContact O-N 3.17Å; I610-F621 HydrophobicContact CB-CE2 4.5Å; I610-F621 HydrophobicContact CD1-CD2 3.7Å; I610-F621 HydrophobicContact CD1-CE2 3.73Å; I610-F621 HydrophobicContact CG1-CD2 4.07Å; I610-F621 HydrophobicContact CG1-CE2 4.2Å
611	C	96.7	Very high	95.9	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	131.8	173.2	-70.4	0	0	0	0	110.7	M595 P598 S599 D600 P640 I643	M595-C611 WeakPolarHBondContact CE-O 3.47Å; P598-C611 CarbonylContact C-O 3.55Å; P598-C611 VanDerWaalsContact CA-O 3.27Å; P598-C611 WeakPolarHBondContact CA-O 3.18Å; S599-C611 PolarHBondContact N-O 3.24Å; S599-C611 WeakPolarHBondContact OG-CB 3.44Å; S599-C611 PolarHBondContact OG-O 3.33Å; D600-C611 PolarHBondContact O-N 2.92Å; C611-P640 HydrophobicContact CB-CB 4.01Å; C611-P640 HydrophobicContact CB-CG 4.08Å; C611-I643 VanDerWaalsContact SG-CB 3.56Å
612	D	95.9	Very high	95.8	Very high	1 Å²	1	31 Å²	31	1%	0.005	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	103.2	168	-170.9	-10.1	0	0	0	109.4	M595 L596 E597 K614 G615 H616 A617 Y619 P640	M595-D612 VanDerWaalsContact CA-OD2 3.31Å; M595-D612 WeakPolarHBondContact CA-OD2 3.35Å; M595-D612 HydrophobicContact CE-CB 3.54Å; M595-D612 HydrophobicContact CG-CB 4.39Å; L596-D612 PolarHBondContact N-OD1 3.48Å; L596-D612 PolarHBondContact N-OD2 3.37Å; E597-D612 PolarHBondContact N-OD1 3.4Å; D612-K614 PolarHBondContact OD1-N 3.45Å; D612-G615 VanDerWaalsContact CG-CA 3.49Å; D612-G615 VanDerWaalsContact CG-N 3.28Å; D612-G615 PolarHBondContact O-N 3.06Å; D612-G615 PolarHBondContact OD1-N 3.36Å; D612-G615 WeakPolarHBondContact OD2-CA 3.3Å; D612-H616 PolarHBondContact O-N 3.19Å; D612-A617 PolarHBondContact N-O 3.48Å; D612-A617 PolarHBondContact O-N 3.3Å; D612-Y619 HydrophobicContact CB-CD2 4.24Å; D612-Y619 HydrophobicContact CB-CE2 4.2Å; D612-P640 WeakPolarHBondContact O-CD 3.41Å; D612-P640 VanDerWaalsContact O-CG 3.3Å; D612-P640 WeakPolarHBondContact O-CG 3.36Å
613	F	94	Very high	95.5	Very high	28 Å²	28	32.6 Å²	32.6	12%	0.123	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-49.5	-176.4	-177.1	-95.8	0	0	0	111.8	E597 F639	E597-F613 HydrophobicContact CB-CB 4.38Å; E597-F613 HydrophobicContact CG-CB 4.47Å; E597-F613 WeakPolarHBondContact O-CB 3.35Å; E597-F613 PolarHBondContact O-N 2.86Å; F613-F639 HydrophobicContact CD1-CD1 4.09Å; F613-F639 HydrophobicContact CD2-CB 3.97Å; F613-F639 HydrophobicContact CE1-CB 4.43Å; F613-F639 AromaticContact CE1-CD1 3.65Å; F613-F639 HydrophobicContact CE1-CD1 3.65Å; F613-F639 HydrophobicContact CE1-CE1 4.34Å; F613-F639 HydrophobicContact CE1-CG 4.42Å; F613-F639 HydrophobicContact CE2-CB 3.57Å; F613-F639 HydrophobicContact CE2-CD1 4.34Å; F613-F639 HydrophobicContact CE2-CG 4.37Å; F613-F639 HydrophobicContact CZ-CB 3.8Å; F613-F639 AromaticContact CZ-CD1 3.78Å; F613-F639 HydrophobicContact CZ-CD1 3.78Å; F613-F639 HydrophobicContact CZ-CG 4.1Å; F613-F639 WeakPolarHBondContact O-CA 3.39Å; F613-F639 WeakPolarHBondContact O-CD1 3.47Å
614	K	93.1	Very high	95.3	Very high	116 Å²	116	34.5 Å²	34.5	50%	0.504	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-23.1	178.9	-77.5	-177.7	175.2	142	0	112.9	L596 E597 D612 H616	L596-K614 HydrophobicContact CB-CB 3.67Å; L596-K614 HydrophobicContact CD1-CB 4.06Å; E597-K614 HydrophobicContact CB-CB 4.11Å; E597-K614 HydrophobicContact CB-CD 4.15Å; E597-K614 HydrophobicContact CB-CG 4.04Å; E597-K614 VanDerWaalsContact OE2-CD 3.22Å; E597-K614 WeakPolarHBondContact OE2-CD 3.3Å; E597-K614 WeakPolarHBondContact OE2-CE 3.07Å; E597-K614 IonicContact OE2-NZ 2.75Å; E597-K614 PolarHBondContact OE2-NZ 3.06Å; D612-K614 PolarHBondContact OD1-N 3.45Å; K614-H616 VanDerWaalsContact C-N 3.32Å; K614-H616 PolarHBondContact O-CD2 3.44Å; K614-H616 VanDerWaalsContact O-CD2 3.29Å
615	G	94.1	Very high	95.2	Very high	13 Å²	13	33 Å²	33	13%	0.134	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-7	174.6	0	0	0	0	0	114.9	D612 A617 R630	D612-G615 VanDerWaalsContact CG-CA 3.49Å; D612-G615 VanDerWaalsContact CG-N 3.28Å; D612-G615 PolarHBondContact O-N 3.06Å; D612-G615 PolarHBondContact OD1-N 3.36Å; D612-G615 WeakPolarHBondContact OD2-CA 3.3Å; G615-A617 VanDerWaalsContact C-N 3.26Å; G615-A617 PolarHBondContact O-N 3.26Å; G615-R630 PolarHBondContact O-NH2 3.24Å
616	H	94.3	Very high	95.3	Very high	46 Å²	46	31.3 Å²	31.3	21%	0.213	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.4	41	-179.4	-47.9	-85.5	0	0	0	113.8	D612 K614 S633 P634 T637 F639	D612-H616 PolarHBondContact O-N 3.19Å; K614-H616 VanDerWaalsContact C-N 3.32Å; K614-H616 PolarHBondContact O-CD2 3.44Å; K614-H616 VanDerWaalsContact O-CD2 3.29Å; H616-S633 CarbonylContact O-C 3.52Å; H616-S633 WeakPolarHBondContact O-CA 3.46Å; H616-S633 PolarHBondContact O-N 3.29Å; H616-P634 HydrophobicContact CB-CB 4.15Å; H616-P634 HydrophobicContact CB-CG 4Å; H616-T637 CarbonylContact C-O 3.55Å; H616-T637 VanDerWaalsContact C-O 3.29Å; H616-T637 WeakPolarHBondContact CA-O 3.43Å; H616-T637 PolarHBondContact O-OG1 3.21Å; H616-F639 AromaticContact CE1-CD1 3.6Å; H616-F639 AromaticContact CE1-CD2 3.95Å; H616-F639 AromaticContact CE1-CE1 3.34Å; H616-F639 WeakPolarHBondContact CE1-CE1 3.14Å; H616-F639 AromaticContact CE1-CE2 3.7Å; H616-F639 AromaticContact CE1-CG 3.91Å; H616-F639 AromaticContact CE1-CZ 3.41Å; H616-F639 VanDerWaalsContact CE1-CZ 3.41Å; H616-F639 WeakPolarHBondContact CE1-CZ 3.34Å; H616-F639 AromaticContact ND1-CD1 3.86Å; H616-F639 AromaticContact ND1-CG 3.86Å; H616-F639 PolarHBondContact ND1-N 3.05Å
617	A	95.4	Very high	95.4	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	170.9	-174.8	0	0	0	0	0	111.9	D612 G615 R630 I631	D612-A617 PolarHBondContact N-O 3.48Å; D612-A617 PolarHBondContact O-N 3.3Å; G615-A617 VanDerWaalsContact C-N 3.26Å; G615-A617 PolarHBondContact O-N 3.26Å; A617-R630 HydrophobicContact CB-CG 3.79Å; A617-R630 VanDerWaalsContact CB-NE 3.31Å; A617-I631 WeakPolarHBondContact CA-O 3.36Å; A617-I631 WeakPolarHBondContact CB-O 3.36Å
618	V	96.9	Very high	95.3	Very high	1 Å²	1	30 Å²	30	1%	0.006	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	129.4	168.7	179.9	0	0	0	0	108.5	F609 I610 R630 I631 I643 V653	F609-V618 HydrophobicContact CB-CG1 4.07Å; F609-V618 HydrophobicContact CD1-CG1 4.31Å; I610-V618 CarbonylContact O-C 3.57Å; I610-V618 WeakPolarHBondContact O-CA 3.17Å; V618-R630 CarbonylContact O-C 3.59Å; V618-R630 WeakPolarHBondContact O-CA 3.39Å; V618-I631 HydrophobicContact CB-CB 4.36Å; V618-I631 PolarHBondContact N-O 3.46Å; V618-I631 PolarHBondContact O-N 3.38Å; V618-I643 HydrophobicContact CG1-CD1 3.64Å; V618-I643 HydrophobicContact CG2-CD1 4.1Å; V618-V653 HydrophobicContact CG2-CG1 3.96Å; V618-V653 HydrophobicContact CG2-CG2 3.71Å
619	Y	96.9	Very high	95.2	Very high	28 Å²	28	34 Å²	34	11%	0.11	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	138.4	172.1	-73.9	-89.2	0	0	0	110.1	N594 M595 F609 I610 D612 F621 I627 R630	N594-Y619 PolarHBondContact O-OH 3.19Å; M595-Y619 HydrophobicContact CG-CD2 3.69Å; M595-Y619 HydrophobicContact CG-CE2 3.98Å; M595-Y619 HydrophobicContact CG-CG 4.36Å; M595-Y619 HydrophobicContact SD-CD2 4.32Å; F609-Y619 WeakPolarHBondContact CA-O 3.25Å; I610-Y619 PolarHBondContact N-O 3.37Å; I610-Y619 PolarHBondContact O-N 3.17Å; D612-Y619 HydrophobicContact CB-CD2 4.24Å; D612-Y619 HydrophobicContact CB-CE2 4.2Å; Y619-F621 HydrophobicContact CG-CE2 4.4Å; Y619-F621 HydrophobicContact CG-CZ 4.49Å; Y619-I627 HydrophobicContact CD1-CG2 4.42Å; Y619-R630 HydrophobicContact CD1-CB 4.09Å; Y619-R630 HydrophobicContact CD1-CG 4.27Å; Y619-R630 HydrophobicContact CE1-CB 3.96Å; Y619-R630 HydrophobicContact CE1-CG 3.95Å
620	V	97.2	Very high	95.1	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	123.3	176.7	-166.8	0	0	0	0	108.6	D607 Y608 F609 I628 R629 I631	D607-V620 HydrophobicContact CB-CG1 3.93Å; Y608-V620 CarbonylContact O-C 3.57Å; Y608-V620 WeakPolarHBondContact O-CA 3.35Å; F609-V620 HydrophobicContact CD1-CB 4.46Å; F609-V620 HydrophobicContact CD1-CG1 4.24Å; F609-V620 HydrophobicContact CD1-CG2 3.52Å; F609-V620 HydrophobicContact CD2-CG1 4.08Å; F609-V620 HydrophobicContact CE1-CB 4.39Å; F609-V620 HydrophobicContact CE1-CG1 3.97Å; F609-V620 HydrophobicContact CE1-CG2 3.48Å; F609-V620 VanDerWaalsContact CE1-CG2 3.48Å; F609-V620 HydrophobicContact CE2-CG1 3.8Å; F609-V620 HydrophobicContact CG-CG1 4.28Å; F609-V620 HydrophobicContact CG-CG2 4.19Å; F609-V620 HydrophobicContact CZ-CG1 3.74Å; F609-V620 HydrophobicContact CZ-CG2 4.12Å; V620-I628 HydrophobicContact CB-CB 4.44Å; V620-I628 HydrophobicContact CG1-CD1 4.13Å; V620-I628 PolarHBondContact O-N 3.29Å; V620-R629 HydrophobicContact CB-CG 3.88Å; V620-R629 HydrophobicContact CG2-CG 3.62Å; V620-R629 PolarHBondContact N-O 3.18Å; V620-I631 HydrophobicContact CG2-CD1 3.58Å; V620-I631 HydrophobicContact CG2-CG1 4.08Å
621	F	97	Very high	95	Very high	1 Å²	1	39.4 Å²	39.4	0%	0.004	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	143.2	179.3	-60.7	-97.7	0	0	0	110.4	F590 C592 M595 D607 Y608 I610 Y619 T626 I627	F590-F621 HydrophobicContact CD2-CD1 4.4Å; F590-F621 HydrophobicContact CE2-CB 3.81Å; F590-F621 AromaticContact CE2-CD1 3.93Å; F590-F621 HydrophobicContact CE2-CD1 3.93Å; F590-F621 HydrophobicContact CE2-CD2 4.37Å; F590-F621 AromaticContact CE2-CG 3.8Å; F590-F621 HydrophobicContact CE2-CG 3.8Å; F590-F621 HydrophobicContact CZ-CB 3.9Å; F590-F621 HydrophobicContact CZ-CG 4.36Å; C592-F621 HydrophobicContact CB-CE2 4.45Å; C592-F621 HydrophobicContact CB-CZ 3.93Å; M595-F621 HydrophobicContact SD-CE2 4.29Å; M595-F621 HydrophobicContact SD-CZ 4.47Å; D607-F621 CarbonylContact C-O 3.55Å; D607-F621 WeakPolarHBondContact CA-O 3.18Å; Y608-F621 PolarHBondContact N-O 3.45Å; Y608-F621 PolarHBondContact O-N 2.77Å; I610-F621 HydrophobicContact CB-CE2 4.5Å; I610-F621 HydrophobicContact CD1-CD2 3.7Å; I610-F621 HydrophobicContact CD1-CE2 3.73Å; I610-F621 HydrophobicContact CG1-CD2 4.07Å; I610-F621 HydrophobicContact CG1-CE2 4.2Å; Y619-F621 HydrophobicContact CG-CE2 4.4Å; Y619-F621 HydrophobicContact CG-CZ 4.49Å; F621-T626 WeakPolarHBondContact CA-O 3.22Å; F621-I627 HydrophobicContact CD1-CG1 3.66Å; F621-I627 HydrophobicContact CE1-CB 4.48Å; F621-I627 HydrophobicContact CE1-CD1 3.98Å; F621-I627 HydrophobicContact CE1-CG1 3.25Å; F621-I627 HydrophobicContact CZ-CD1 4.45Å; F621-I627 HydrophobicContact CZ-CG1 3.98Å
622	T	95.6	Very high	94.8	Very high	38 Å²	38	40.3 Å²	40.3	23%	0.233	22%	0.22	C	C	.	.			trans	-65	165.1	162.9	59.4	0	0	0	0	110.4	A624 G625 T626 I628	T622-A624 PolarHBondContact O-N 3.2Å; T622-A624 VanDerWaalsContact O-N 3.13Å; T622-A624 PolarHBondContact OG1-N 2.86Å; T622-G625 PolarHBondContact O-N 3.41Å; T622-G625 PolarHBondContact OG1-N 3.01Å; T622-T626 PolarHBondContact N-O 3.48Å; T622-T626 WeakPolarHBondContact OG1-CB 3.31Å; T622-T626 PolarHBondContact OG1-N 2.91Å; T622-T626 PolarHBondContact OG1-O 2.89Å; T622-I628 HydrophobicContact CG2-CD1 3.6Å; T622-I628 HydrophobicContact CG2-CG1 3.54Å
623	S	91.9	Very high	94.6	Very high	44 Å²	44	41.8 Å²	41.8	31%	0.308	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-21.1	170.6	61.7	0	0	0	0	114.9	R588 Y608 G625	R588-S623 WeakPolarHBondContact CD-O 3.49Å; Y608-S623 VanDerWaalsContact CE2-CA 3.48Å; S623-G625 VanDerWaalsContact C-N 3.34Å
624	A	91.7	Very high	94.5	Very high	77 Å²	77	44.2 Å²	44.2	64%	0.636	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-1.1	173.6	0	0	0	0	0	113.7	T622	T622-A624 PolarHBondContact O-N 3.2Å; T622-A624 VanDerWaalsContact O-N 3.13Å; T622-A624 PolarHBondContact OG1-N 2.86Å
625	G	93.1	Very high	94.3	Very high	18 Å²	18	43.6 Å²	43.6	19%	0.186	26%	0.259	C	S	.	.	S	Bend	trans	83.1	7.8	-179.4	0	0	0	0	0	115.3	F590 T622 S623	F590-G625 VanDerWaalsContact CD2-CA 3.44Å; T622-G625 PolarHBondContact O-N 3.41Å; T622-G625 PolarHBondContact OG1-N 3.01Å; S623-G625 VanDerWaalsContact C-N 3.34Å
626	T	95.1	Very high	94.1	Very high	93 Å²	93	44.5 Å²	44.5	57%	0.571	26%	0.262	S	S	*	.			trans	-74.8	129.2	172.1	-52.2	0	0	0	0	109.6	F621 T622 I628	F621-T626 WeakPolarHBondContact CA-O 3.22Å; T622-T626 PolarHBondContact N-O 3.48Å; T622-T626 WeakPolarHBondContact OG1-CB 3.31Å; T622-T626 PolarHBondContact OG1-N 2.91Å; T622-T626 PolarHBondContact OG1-O 2.89Å; T626-I628 PolarHBondContact O-N 2.99Å
627	I	94.9	Very high	94	Very high	59 Å²	59	42.3 Å²	42.3	30%	0.303	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	125.6	174.2	-64.2	169.5	0	0	0	109.1	Q593 Y619 F621	Q593-I627 HydrophobicContact CB-CD1 4.45Å; Y619-I627 HydrophobicContact CD1-CG2 4.42Å; F621-I627 HydrophobicContact CD1-CG1 3.66Å; F621-I627 HydrophobicContact CE1-CB 4.48Å; F621-I627 HydrophobicContact CE1-CD1 3.98Å; F621-I627 HydrophobicContact CE1-CG1 3.25Å; F621-I627 HydrophobicContact CZ-CD1 4.45Å; F621-I627 HydrophobicContact CZ-CG1 3.98Å
628	I	95	Very high	93.8	Very high	60 Å²	60	43 Å²	43	31%	0.308	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	-49.7	175.4	-51	177.2	0	0	0	109.8	D607 V620 T622 T626	D607-I628 HydrophobicContact CB-CD1 4.31Å; D607-I628 VanDerWaalsContact OD1-CD1 3.3Å; D607-I628 WeakPolarHBondContact OD1-CD1 3.36Å; D607-I628 VanDerWaalsContact OD2-CD1 3.22Å; D607-I628 WeakPolarHBondContact OD2-CD1 3.3Å; V620-I628 HydrophobicContact CB-CB 4.44Å; V620-I628 HydrophobicContact CG1-CD1 4.13Å; V620-I628 PolarHBondContact O-N 3.29Å; T622-I628 HydrophobicContact CG2-CD1 3.6Å; T622-I628 HydrophobicContact CG2-CG1 3.54Å; T626-I628 PolarHBondContact O-N 2.99Å
629	R	94.8	Very high	93.6	Very high	88 Å²	88	46.4 Å²	46.4	33%	0.332	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.4	162.5	-176	65.4	-159.2	89.3	-147.6	4.5	112	V620 I631 T669	V620-R629 HydrophobicContact CB-CG 3.88Å; V620-R629 HydrophobicContact CG2-CG 3.62Å; V620-R629 PolarHBondContact N-O 3.18Å; R629-I631 HydrophobicContact CG-CD1 4.37Å; R629-I631 HydrophobicContact CG-CG1 4.08Å; R629-T669 VanDerWaalsContact CD-O 3.28Å; R629-T669 WeakPolarHBondContact CD-O 3.17Å; R629-T669 PolarHBondContact NH1-O 3.09Å
630	R	95.3	Very high	93.5	Very high	115 Å²	115	45.1 Å²	45.1	43%	0.434	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	127.2	168.3	-180	179.7	171.2	-90.4	0.9	108.2	G615 A617 V618 Y619	G615-R630 PolarHBondContact O-NH2 3.24Å; A617-R630 HydrophobicContact CB-CG 3.79Å; A617-R630 VanDerWaalsContact CB-NE 3.31Å; V618-R630 CarbonylContact O-C 3.59Å; V618-R630 WeakPolarHBondContact O-CA 3.39Å; Y619-R630 HydrophobicContact CD1-CB 4.09Å; Y619-R630 HydrophobicContact CD1-CG 4.27Å; Y619-R630 HydrophobicContact CE1-CB 3.96Å; Y619-R630 HydrophobicContact CE1-CG 3.95Å
631	I	95.3	Very high	93.2	Very high	2 Å²	2	45.9 Å²	45.9	1%	0.01	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	142.6	-177.6	-53.2	175.9	0	0	0	108.3	F609 A617 V618 V620 R629 F666	F609-I631 HydrophobicContact CD1-CD1 4.21Å; F609-I631 HydrophobicContact CE1-CD1 3.85Å; A617-I631 WeakPolarHBondContact CA-O 3.36Å; A617-I631 WeakPolarHBondContact CB-O 3.36Å; V618-I631 HydrophobicContact CB-CB 4.36Å; V618-I631 PolarHBondContact N-O 3.46Å; V618-I631 PolarHBondContact O-N 3.38Å; V620-I631 HydrophobicContact CG2-CD1 3.58Å; V620-I631 HydrophobicContact CG2-CG1 4.08Å; R629-I631 HydrophobicContact CG-CD1 4.37Å; R629-I631 HydrophobicContact CG-CG1 4.08Å; I631-F666 HydrophobicContact CG2-CB 3.93Å; I631-F666 HydrophobicContact CG2-CD1 3.3Å; I631-F666 HydrophobicContact CG2-CD2 3.77Å; I631-F666 HydrophobicContact CG2-CE1 3.63Å; I631-F666 HydrophobicContact CG2-CE2 4.05Å; I631-F666 HydrophobicContact CG2-CG 3.39Å; I631-F666 HydrophobicContact CG2-CZ 3.99Å
632	G	93.7	Very high	93.1	Very high	19 Å²	19	45.8 Å²	45.8	20%	0.196	27%	0.271	C	S	.	.			trans	79.9	-178.9	-179.5	0	0	0	0	0	113.9	T637	G632-T637 WeakPolarHBondContact CA-OG1 3.49Å
633	S	92.1	Very high	93.1	Very high	31 Å²	31	44.2 Å²	44.2	22%	0.217	26%	0.261	C	S	.	.			trans	-164.5	168.2	-176.4	69.9	0	0	0	0	110	H616 S635 V636 T637	H616-S633 CarbonylContact O-C 3.52Å; H616-S633 WeakPolarHBondContact O-CA 3.46Å; H616-S633 PolarHBondContact O-N 3.29Å; S633-S635 PolarHBondContact O-N 3.23Å; S633-S635 PolarHBondContact OG-OG 3.13Å; S633-S635 VanDerWaalsContact OG-OG 3.13Å; S633-V636 PolarHBondContact O-N 3.46Å; S633-T637 PolarHBondContact N-OG1 3Å; S633-T637 VanDerWaalsContact N-OG1 3.09Å; S633-T637 PolarHBondContact O-N 3.39Å; S633-T637 PolarHBondContact O-OG1 3.41Å
634	P	91.2	Very high	93.3	Very high	79 Å²	79	42.8 Å²	42.8	51%	0.513	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53	-25.7	175.7	-27.6	35.2	0	0	0	115.4	H616	H616-P634 HydrophobicContact CB-CB 4.15Å; H616-P634 HydrophobicContact CB-CG 4Å
635	S	88.9	Confident	93.5	Very high	104 Å²	104	40.2 Å²	40.2	73%	0.727	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-11.7	178.4	62.3	0	0	0	0	114.5	S633	S633-S635 PolarHBondContact O-N 3.23Å; S633-S635 PolarHBondContact OG-OG 3.13Å; S633-S635 VanDerWaalsContact OG-OG 3.13Å
636	V	90.8	Very high	93.5	Very high	31 Å²	31	39.4 Å²	39.4	19%	0.188	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.2	-33.3	-174.6	-175.5	0	0	0	0	112.1	S633 H662 A664 F666 Y672	S633-V636 PolarHBondContact O-N 3.46Å; V636-H662 PolarHBondContact O-CE1 3.37Å; V636-A664 HydrophobicContact CG1-CB 4.24Å; V636-F666 HydrophobicContact CG1-CE1 4.2Å; V636-F666 HydrophobicContact CG1-CZ 3.7Å; V636-Y672 HydrophobicContact CG1-CD2 3.54Å; V636-Y672 HydrophobicContact CG1-CE2 3.47Å; V636-Y672 VanDerWaalsContact CG1-CE2 3.47Å
637	T	92.1	Very high	93.2	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.22	C	C	.	.	S	Bend	trans	-131.8	60.8	178.7	48	0	0	0	0	109.6	H616 G632 S633 F639 P640 V653 D655 A664 F666	H616-T637 CarbonylContact C-O 3.55Å; H616-T637 VanDerWaalsContact C-O 3.29Å; H616-T637 WeakPolarHBondContact CA-O 3.43Å; H616-T637 PolarHBondContact O-OG1 3.21Å; G632-T637 WeakPolarHBondContact CA-OG1 3.49Å; S633-T637 PolarHBondContact N-OG1 3Å; S633-T637 VanDerWaalsContact N-OG1 3.09Å; S633-T637 PolarHBondContact O-N 3.39Å; S633-T637 PolarHBondContact O-OG1 3.41Å; T637-F639 PolarHBondContact O-N 3.05Å; T637-F639 VanDerWaalsContact O-N 3.15Å; T637-P640 WeakPolarHBondContact O-CD 3.27Å; T637-V653 HydrophobicContact CG2-CB 4.22Å; T637-V653 HydrophobicContact CG2-CG1 4.03Å; T637-D655 WeakPolarHBondContact CA-OD2 3.13Å; T637-A664 HydrophobicContact CG2-CB 3.79Å; T637-F666 HydrophobicContact CG2-CE2 3.68Å; T637-F666 HydrophobicContact CG2-CZ 3.73Å
638	P	91	Very high	93	Very high	15 Å²	15	43 Å²	43	10%	0.097	24%	0.235	C	C	.	.	S	Bend	trans	-68.6	108.8	-179.8	27.8	-34.3	0	0	0	111.1	D655 H657	P638-D655 WeakPolarHBondContact O-CB 3.39Å; P638-H657 HydrophobicContact CB-CB 4.15Å; P638-H657 HydrophobicContact CG-CB 3.69Å
639	F	92.1	Very high	92.9	Very high	73 Å²	73	40.1 Å²	40.1	32%	0.32	22%	0.22	S	C	.	.	S	Bend	trans	65.5	61.1	176.9	-53.6	-78.3	0	0	0	113.7	F613 H616 T637 S641	F613-F639 HydrophobicContact CD1-CD1 4.09Å; F613-F639 HydrophobicContact CD2-CB 3.97Å; F613-F639 HydrophobicContact CE1-CB 4.43Å; F613-F639 AromaticContact CE1-CD1 3.65Å; F613-F639 HydrophobicContact CE1-CD1 3.65Å; F613-F639 HydrophobicContact CE1-CE1 4.34Å; F613-F639 HydrophobicContact CE1-CG 4.42Å; F613-F639 HydrophobicContact CE2-CB 3.57Å; F613-F639 HydrophobicContact CE2-CD1 4.34Å; F613-F639 HydrophobicContact CE2-CG 4.37Å; F613-F639 HydrophobicContact CZ-CB 3.8Å; F613-F639 AromaticContact CZ-CD1 3.78Å; F613-F639 HydrophobicContact CZ-CD1 3.78Å; F613-F639 HydrophobicContact CZ-CG 4.1Å; F613-F639 WeakPolarHBondContact O-CA 3.39Å; F613-F639 WeakPolarHBondContact O-CD1 3.47Å; H616-F639 AromaticContact CE1-CD1 3.6Å; H616-F639 AromaticContact CE1-CD2 3.95Å; H616-F639 AromaticContact CE1-CE1 3.34Å; H616-F639 WeakPolarHBondContact CE1-CE1 3.14Å; H616-F639 AromaticContact CE1-CE2 3.7Å; H616-F639 AromaticContact CE1-CG 3.91Å; H616-F639 AromaticContact CE1-CZ 3.41Å; H616-F639 VanDerWaalsContact CE1-CZ 3.41Å; H616-F639 WeakPolarHBondContact CE1-CZ 3.34Å; H616-F639 AromaticContact ND1-CD1 3.86Å; H616-F639 AromaticContact ND1-CG 3.86Å; H616-F639 PolarHBondContact ND1-N 3.05Å; T637-F639 PolarHBondContact O-N 3.05Å; T637-F639 VanDerWaalsContact O-N 3.15Å; F639-S641 PolarHBondContact O-N 3.37Å
640	P	94.1	Very high	92.8	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	130.7	-178.2	30.8	-35.8	0	0	0	110.5	S599 C611 D612 T637 V653	S599-P640 PolarHBondContact OG-O 3.41Å; C611-P640 HydrophobicContact CB-CB 4.01Å; C611-P640 HydrophobicContact CB-CG 4.08Å; D612-P640 WeakPolarHBondContact O-CD 3.41Å; D612-P640 VanDerWaalsContact O-CG 3.3Å; D612-P640 WeakPolarHBondContact O-CG 3.36Å; T637-P640 WeakPolarHBondContact O-CD 3.27Å; P640-V653 HydrophobicContact CB-CG1 3.53Å
641	S	92.3	Very high	92.9	Very high	16 Å²	16	34.7 Å²	34.7	11%	0.112	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	-4.4	-176	57.5	0	0	0	0	114.3	F639 G654 C684 G686	F639-S641 PolarHBondContact O-N 3.37Å; S641-G654 PolarHBondContact N-O 3.23Å; S641-C684 PolarHBondContact OG-O 2.68Å; S641-C684 PolarHBondContact OG-SG 3.12Å; S641-G686 PolarHBondContact O-N 3.02Å
642	G	93.4	Very high	92.8	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	145	170.4	0	0	0	0	0	111.4	D600 G654	D600-G642 WeakPolarHBondContact OD2-CA 3.4Å; G642-G654 PolarHBondContact N-O 3.29Å; G642-G654 VanDerWaalsContact N-O 3.12Å; G642-G654 PolarHBondContact O-N 3.34Å
643	I	96.1	Very high	92.9	Very high	5 Å²	5	33.7 Å²	33.7	3%	0.026	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	138.8	175.7	-171.9	168.6	0	0	0	111	D600 A602 F609 C611 V618 V651 L652 V653	D600-I643 HydrophobicContact CB-CG2 4.04Å; D600-I643 PolarHBondContact OD2-N 2.78Å; A602-I643 HydrophobicContact CB-CG1 4.15Å; A602-I643 HydrophobicContact CB-CG2 3.89Å; F609-I643 HydrophobicContact CB-CD1 3.7Å; C611-I643 VanDerWaalsContact SG-CB 3.56Å; V618-I643 HydrophobicContact CG1-CD1 3.64Å; V618-I643 HydrophobicContact CG2-CD1 4.1Å; I643-V651 HydrophobicContact CD1-CG1 3.87Å; I643-V651 HydrophobicContact CG1-CG1 4.13Å; I643-L652 WeakPolarHBondContact CA-O 3.43Å; I643-V653 HydrophobicContact CD1-CG2 4.32Å; I643-V653 HydrophobicContact CG1-CG2 4.38Å
644	V	95.9	Very high	92.9	Very high	13 Å²	13	32.2 Å²	32.2	8%	0.079	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	149.9	170	69.5	0	0	0	0	109.4	L652 L687 F689	V644-L652 HydrophobicContact CG1-CB 3.94Å; V644-L652 HydrophobicContact CG1-CD2 4.29Å; V644-L652 PolarHBondContact N-O 2.93Å; V644-L652 PolarHBondContact O-N 3.48Å; V644-L687 HydrophobicContact CB-CB 3.9Å; V644-L687 HydrophobicContact CG1-CB 3.71Å; V644-L687 HydrophobicContact CG1-CD1 4.32Å; V644-F689 HydrophobicContact CG1-CB 4.38Å; V644-F689 HydrophobicContact CG2-CB 3.87Å
645	I	95.6	Very high	92.7	Very high	23 Å²	23	28.5 Å²	28.5	12%	0.118	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	126.1	177.9	-55.5	173.4	0	0	0	107.9	A602 Y604 F609 R650 V651	A602-I645 HydrophobicContact CB-CD1 3.91Å; A602-I645 HydrophobicContact CB-CG1 3.97Å; Y604-I645 VanDerWaalsContact CB-CD1 3.49Å; Y604-I645 HydrophobicContact CD1-CG2 4.41Å; Y604-I645 HydrophobicContact CD2-CB 4.4Å; Y604-I645 HydrophobicContact CD2-CG2 3.54Å; Y604-I645 HydrophobicContact CE2-CG2 4.12Å; Y604-I645 HydrophobicContact CG-CD1 4.39Å; Y604-I645 HydrophobicContact CG-CG2 3.71Å; F609-I645 HydrophobicContact CB-CD1 4.13Å; F609-I645 HydrophobicContact CD1-CD1 4.14Å; F609-I645 HydrophobicContact CD2-CD1 3.41Å; F609-I645 VanDerWaalsContact CD2-CD1 3.41Å; F609-I645 HydrophobicContact CE1-CD1 4.43Å; F609-I645 HydrophobicContact CE2-CD1 3.76Å; F609-I645 HydrophobicContact CG-CD1 3.64Å; F609-I645 HydrophobicContact CZ-CD1 4.26Å; I645-R650 CarbonylContact C-O 3.54Å; I645-R650 VanDerWaalsContact CA-O 3.32Å; I645-R650 WeakPolarHBondContact CA-O 3.28Å; I645-V651 HydrophobicContact CD1-CG2 4.43Å; I645-V651 HydrophobicContact CG1-CG1 4.34Å; I645-V651 HydrophobicContact CG1-CG2 4.22Å
646	T	93.1	Very high	92	Very high	2 Å²	2	24.2 Å²	24.2	1%	0.012	13%	0.125	C	C	.	.			trans	-71.6	163.3	179.8	78.6	0	0	0	0	110.9	E648 G649 R650 L652 F689	T646-E648 VanDerWaalsContact CB-OE2 3.25Å; T646-E648 WeakPolarHBondContact CB-OE2 3.47Å; T646-E648 PolarHBondContact O-N 3.14Å; T646-E648 VanDerWaalsContact O-N 3.17Å; T646-E648 PolarHBondContact OG1-N 3.02Å; T646-E648 PolarHBondContact OG1-OE2 2.76Å; T646-G649 WeakPolarHBondContact O-CA 3.46Å; T646-G649 PolarHBondContact O-N 2.93Å; T646-R650 HydrophobicContact CG2-CB 4.05Å; T646-R650 PolarHBondContact N-O 3.25Å; T646-R650 PolarHBondContact OG1-N 2.95Å; T646-L652 HydrophobicContact CG2-CD1 3.66Å; T646-F689 HydrophobicContact CG2-CD1 4.39Å; T646-F689 HydrophobicContact CG2-CD2 3.92Å; T646-F689 HydrophobicContact CG2-CE1 4.17Å; T646-F689 HydrophobicContact CG2-CE2 3.69Å; T646-F689 HydrophobicContact CG2-CG 4.25Å; T646-F689 HydrophobicContact CG2-CZ 3.8Å
647	P	90.1	Very high	90.9	Very high	97 Å²	97	28 Å²	28	63%	0.63	14%	0.141	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-32.6	174.6	-27	36.6	0	0	0	113.7	G649	P647-G649 PolarHBondContact O-N 3.39Å
648	E	89.6	Confident	89.4	Confident	130 Å²	130	30.5 Å²	30.5	61%	0.607	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-1.4	176.2	-50.5	70.5	-147.8	0	0	113.1	T646	T646-E648 VanDerWaalsContact CB-OE2 3.25Å; T646-E648 WeakPolarHBondContact CB-OE2 3.47Å; T646-E648 PolarHBondContact O-N 3.14Å; T646-E648 VanDerWaalsContact O-N 3.17Å; T646-E648 PolarHBondContact OG1-N 3.02Å; T646-E648 PolarHBondContact OG1-OE2 2.76Å
649	G	92.5	Very high	88.1	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.191	C	C	.	.			trans	85.9	8.7	178.3	0	0	0	0	0	115.1	Y604 T646 P647 V651 P668	Y604-G649 WeakPolarHBondContact OH-CA 3.35Å; T646-G649 WeakPolarHBondContact O-CA 3.46Å; T646-G649 PolarHBondContact O-N 2.93Å; P647-G649 PolarHBondContact O-N 3.39Å; G649-V651 PolarHBondContact O-N 2.99Å; G649-P668 WeakPolarHBondContact O-CB 3.48Å; G649-P668 WeakPolarHBondContact O-CD 3.48Å; G649-P668 WeakPolarHBondContact O-CG 3.4Å
650	R	94.1	Very high	87.1	Confident	89 Å²	89	35.8 Å²	35.8	34%	0.336	19%	0.194	S	C	.	.			trans	-69	128.8	175.6	-63	-176.9	-176.8	179.2	2.1	109.3	I645 T646 L652 I665 I673	I645-R650 CarbonylContact C-O 3.54Å; I645-R650 VanDerWaalsContact CA-O 3.32Å; I645-R650 WeakPolarHBondContact CA-O 3.28Å; T646-R650 HydrophobicContact CG2-CB 4.05Å; T646-R650 PolarHBondContact N-O 3.25Å; T646-R650 PolarHBondContact OG1-N 2.95Å; R650-L652 HydrophobicContact CB-CD1 4.02Å; R650-I665 HydrophobicContact CB-CG2 4.46Å; R650-I673 HydrophobicContact CG-CD1 4.44Å
651	V	96.3	Very high	86.3	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	113.8	179.9	-174	0	0	0	0	108.4	F609 I643 I645 G649 V653 I665 F666	F609-V651 HydrophobicContact CD1-CG1 4.21Å; F609-V651 HydrophobicContact CD1-CG2 4.16Å; F609-V651 HydrophobicContact CE1-CG2 3.75Å; F609-V651 HydrophobicContact CZ-CG2 4.39Å; I643-V651 HydrophobicContact CD1-CG1 3.87Å; I643-V651 HydrophobicContact CG1-CG1 4.13Å; I645-V651 HydrophobicContact CD1-CG2 4.43Å; I645-V651 HydrophobicContact CG1-CG1 4.34Å; I645-V651 HydrophobicContact CG1-CG2 4.22Å; G649-V651 PolarHBondContact O-N 2.99Å; V651-V653 HydrophobicContact CG1-CG2 4.08Å; V651-I665 WeakPolarHBondContact O-CA 3.42Å; V651-F666 HydrophobicContact CB-CB 4.28Å; V651-F666 PolarHBondContact N-O 3.24Å; V651-F666 PolarHBondContact O-N 2.92Å
652	L	94.9	Very high	86.1	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	124.2	176.4	-77.5	61.8	0	0	0	108.2	I643 V644 T646 R650 I663 I665 L687 V695 L711	I643-L652 WeakPolarHBondContact CA-O 3.43Å; V644-L652 HydrophobicContact CG1-CB 3.94Å; V644-L652 HydrophobicContact CG1-CD2 4.29Å; V644-L652 PolarHBondContact N-O 2.93Å; V644-L652 PolarHBondContact O-N 3.48Å; T646-L652 HydrophobicContact CG2-CD1 3.66Å; R650-L652 HydrophobicContact CB-CD1 4.02Å; L652-I663 HydrophobicContact CB-CG2 4.05Å; L652-I663 HydrophobicContact CG-CG2 4.2Å; L652-I665 HydrophobicContact CD1-CG2 4.28Å; L652-L687 HydrophobicContact CB-CD1 4.15Å; L652-L687 WeakPolarHBondContact O-CD1 2.8Å; L652-V695 HydrophobicContact CD2-CG1 4.27Å; L652-V695 HydrophobicContact CD2-CG2 3.49Å; L652-V695 VanDerWaalsContact CD2-CG2 3.49Å; L652-L711 HydrophobicContact CD1-CD1 3.78Å; L652-L711 HydrophobicContact CD2-CD1 3.75Å; L652-L711 HydrophobicContact CG-CD1 3.93Å
653	V	94.8	Very high	85.9	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	112.6	-179.6	-174.3	0	0	0	0	108	V618 T637 P640 I643 V651 I663 A664 F666	V618-V653 HydrophobicContact CG2-CG1 3.96Å; V618-V653 HydrophobicContact CG2-CG2 3.71Å; T637-V653 HydrophobicContact CG2-CB 4.22Å; T637-V653 HydrophobicContact CG2-CG1 4.03Å; P640-V653 HydrophobicContact CB-CG1 3.53Å; I643-V653 HydrophobicContact CD1-CG2 4.32Å; I643-V653 HydrophobicContact CG1-CG2 4.38Å; V651-V653 HydrophobicContact CG1-CG2 4.08Å; V653-I663 CarbonylContact O-C 3.57Å; V653-I663 VanDerWaalsContact O-CA 3.29Å; V653-I663 WeakPolarHBondContact O-CA 3.2Å; V653-A664 PolarHBondContact N-O 2.82Å; V653-A664 PolarHBondContact O-N 3.11Å; V653-F666 HydrophobicContact CG2-CD2 4.18Å; V653-F666 HydrophobicContact CG2-CE2 4.13Å
654	G	91.9	Very high	85.7	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	127.1	174.9	0	0	0	0	0	109.3	S641 G642 H662	S641-G654 PolarHBondContact N-O 3.23Å; G642-G654 PolarHBondContact N-O 3.29Å; G642-G654 VanDerWaalsContact N-O 3.12Å; G642-G654 PolarHBondContact O-N 3.34Å; G654-H662 WeakPolarHBondContact CA-O 3.05Å
655	D	87.8	Confident	85.7	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	166.1	178.3	70.9	62.1	0	0	0	111.5	T637 P638 H662	T637-D655 WeakPolarHBondContact CA-OD2 3.13Å; P638-D655 WeakPolarHBondContact O-CB 3.39Å; D655-H662 VanDerWaalsContact CG-ND1 3.3Å; D655-H662 PolarHBondContact N-O 3.33Å; D655-H662 PolarHBondContact O-N 3Å; D655-H662 WeakPolarHBondContact OD1-CB 3.16Å; D655-H662 IonicContact OD1-CG 3.68Å; D655-H662 IonicContact OD1-ND1 3.64Å; D655-H662 PolarHBondContact OD1-ND1 3.16Å; D655-H662 IonicContact OD2-CE1 3.29Å; D655-H662 IonicContact OD2-CG 2.61Å; D655-H662 IonicContact OD2-ND1 3.85Å; D655-H662 PolarHBondContact OD2-ND1 2.93Å
656	S	74	Confident	85.7	Confident	15 Å²	15	34.4 Å²	34.4	11%	0.105	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	94.4	-170.7	-57.8	0	0	0	0	109.8	R683 C684	S656-R683 WeakPolarHBondContact OG-CA 3.39Å; S656-R683 WeakPolarHBondContact OG-CG 3.39Å; S656-C684 PolarHBondContact OG-N 3Å; S656-C684 VanDerWaalsContact OG-N 3.14Å; S656-C684 PolarHBondContact OG-SG 3.11Å
657	H	66.9	Low	85.8	Confident	111 Å²	111	38.3 Å²	38.3	51%	0.514	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	129.3	175.9	-175.4	-87.1	0	0	0	111.1	P638 N659 H660	P638-H657 HydrophobicContact CB-CB 4.15Å; P638-H657 HydrophobicContact CG-CB 3.69Å; H657-N659 VanDerWaalsContact C-N 3.3Å; H657-N659 PolarHBondContact O-N 3.4Å; H657-N659 VanDerWaalsContact O-N 3.17Å; H657-H660 PolarHBondContact N-O 3.15Å; H657-H660 PolarHBondContact O-N 2.91Å
658	G	61.3	Low	85.8	Confident	51 Å²	51	35.6 Å²	35.6	53%	0.526	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.8	27.7	169.2	0	0	0	0	0	116.4	H660	G658-H660 PolarHBondContact O-CD2 2.75Å; G658-H660 PolarHBondContact O-N 3.01Å; G658-H660 PolarHBondContact O-NE2 2.95Å
659	N	64	Low	86	Confident	117 Å²	117	33.8 Å²	33.8	63%	0.626	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.2	22.5	-172	-55.1	-46.1	0	0	0	114.8	H657 V681	H657-N659 VanDerWaalsContact C-N 3.3Å; H657-N659 PolarHBondContact O-N 3.4Å; H657-N659 VanDerWaalsContact O-N 3.17Å; N659-V681 CarbonylContact C-O 3.58Å; N659-V681 VanDerWaalsContact O-O 3.1Å
660	H	70.3	Confident	86	Confident	83 Å²	83	34.9 Å²	34.9	38%	0.384	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	132.5	169.1	-57.3	-78.3	0	0	0	108.5	H657 G658	H657-H660 PolarHBondContact N-O 3.15Å; H657-H660 PolarHBondContact O-N 2.91Å; G658-H660 PolarHBondContact O-CD2 2.75Å; G658-H660 PolarHBondContact O-N 3.01Å; G658-H660 PolarHBondContact O-NE2 2.95Å
661	F	78.5	Confident	86	Confident	2 Å²	2	32.2 Å²	32.2	1%	0.009	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	117	169.5	171.9	-134.3	0	0	0	108.2	I663 C678 V681 C684 L687 T697 L708	F661-I663 HydrophobicContact CE1-CD1 3.66Å; F661-I663 HydrophobicContact CE1-CG1 4Å; F661-I663 HydrophobicContact CE2-CD1 4.32Å; F661-I663 HydrophobicContact CE2-CG1 3.85Å; F661-I663 HydrophobicContact CZ-CD1 3.52Å; F661-I663 HydrophobicContact CZ-CG1 3.56Å; F661-C678 HydrophobicContact CB-CB 4.38Å; F661-C678 HydrophobicContact CD1-CB 3.98Å; F661-C678 PolarHBondContact N-O 3.34Å; F661-C678 PolarHBondContact O-N 3.08Å; F661-V681 HydrophobicContact CB-CB 3.46Å; F661-V681 VanDerWaalsContact CB-CB 3.46Å; F661-V681 HydrophobicContact CB-CG1 3.57Å; F661-V681 HydrophobicContact CB-CG2 3.97Å; F661-V681 HydrophobicContact CG-CB 4.49Å; F661-V681 HydrophobicContact CG-CG1 4.18Å; F661-C684 HydrophobicContact CD2-CB 3.49Å; F661-C684 VanDerWaalsContact CD2-CB 3.49Å; F661-C684 HydrophobicContact CE2-CB 3.23Å; F661-C684 WeakPolarHBondContact CE2-SG 3.44Å; F661-C684 HydrophobicContact CG-CB 4.43Å; F661-C684 HydrophobicContact CZ-CB 3.99Å; F661-L687 HydrophobicContact CE2-CD2 4.49Å; F661-L687 HydrophobicContact CZ-CD2 3.85Å; F661-T697 HydrophobicContact CD1-CG2 4.24Å; F661-T697 HydrophobicContact CE1-CG2 3.44Å; F661-T697 VanDerWaalsContact CE1-CG2 3.44Å; F661-T697 HydrophobicContact CE2-CG2 4.47Å; F661-T697 HydrophobicContact CZ-CG2 3.57Å; F661-L708 HydrophobicContact CE1-CD1 3.86Å
662	H	86.5	Confident	85.9	Confident	15 Å²	15	37.1 Å²	37.1	7%	0.069	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	134.8	-175.3	169.3	-96	0	0	0	108.5	V636 G654 D655 E675	V636-H662 PolarHBondContact O-CE1 3.37Å; G654-H662 WeakPolarHBondContact CA-O 3.05Å; D655-H662 VanDerWaalsContact CG-ND1 3.3Å; D655-H662 PolarHBondContact N-O 3.33Å; D655-H662 PolarHBondContact O-N 3Å; D655-H662 WeakPolarHBondContact OD1-CB 3.16Å; D655-H662 IonicContact OD1-CG 3.68Å; D655-H662 IonicContact OD1-ND1 3.64Å; D655-H662 PolarHBondContact OD1-ND1 3.16Å; D655-H662 IonicContact OD2-CE1 3.29Å; D655-H662 IonicContact OD2-CG 2.61Å; D655-H662 IonicContact OD2-ND1 3.85Å; D655-H662 PolarHBondContact OD2-ND1 2.93Å; H662-E675 WeakPolarHBondContact NE2-CB 3.4Å; H662-E675 IonicContact NE2-OE2 3.33Å; H662-E675 PolarHBondContact NE2-OE2 2.96Å
663	I	90.5	Very high	85.7	Confident	1 Å²	1	41 Å²	41	1%	0.005	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	110.1	175.2	-61.9	170	0	0	0	108.1	F445 L652 V653 F661 I665 E675 R676 L687 V695 L708	F445-I663 HydrophobicContact CD2-CD1 3.83Å; F445-I663 HydrophobicContact CE2-CB 4.1Å; F445-I663 HydrophobicContact CE2-CD1 3.51Å; F445-I663 HydrophobicContact CE2-CG1 4.38Å; F445-I663 HydrophobicContact CE2-CG2 4.26Å; F445-I663 HydrophobicContact CZ-CD1 4.44Å; L652-I663 HydrophobicContact CB-CG2 4.05Å; L652-I663 HydrophobicContact CG-CG2 4.2Å; V653-I663 CarbonylContact O-C 3.57Å; V653-I663 VanDerWaalsContact O-CA 3.29Å; V653-I663 WeakPolarHBondContact O-CA 3.2Å; F661-I663 HydrophobicContact CE1-CD1 3.66Å; F661-I663 HydrophobicContact CE1-CG1 4Å; F661-I663 HydrophobicContact CE2-CD1 4.32Å; F661-I663 HydrophobicContact CE2-CG1 3.85Å; F661-I663 HydrophobicContact CZ-CD1 3.52Å; F661-I663 HydrophobicContact CZ-CG1 3.56Å; I663-I665 HydrophobicContact CG2-CG1 4.45Å; I663-E675 CarbonylContact O-C 3.6Å; I663-E675 VanDerWaalsContact O-CA 3.25Å; I663-E675 WeakPolarHBondContact O-CA 3.44Å; I663-R676 PolarHBondContact N-O 2.52Å; I663-R676 PolarHBondContact O-N 3.03Å; I663-L687 HydrophobicContact CD1-CD2 4.44Å; I663-V695 HydrophobicContact CD1-CG1 4.11Å; I663-L708 HydrophobicContact CD1-CD1 3.61Å
664	A	92.2	Very high	85.4	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	140.2	169.2	0	0	0	0	0	110.5	V636 T637 V653 F666	V636-A664 HydrophobicContact CG1-CB 4.24Å; T637-A664 HydrophobicContact CG2-CB 3.79Å; V653-A664 PolarHBondContact N-O 2.82Å; V653-A664 PolarHBondContact O-N 3.11Å; A664-F666 HydrophobicContact CB-CD2 4.38Å; A664-F666 HydrophobicContact CB-CE2 3.48Å; A664-F666 VanDerWaalsContact CB-CE2 3.48Å; A664-F666 HydrophobicContact CB-CZ 3.94Å
665	I	94	Very high	85.2	Confident	5 Å²	5	45.3 Å²	45.3	3%	0.026	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	126.9	-176.5	-48.2	166.9	0	0	0	109	R650 V651 L652 I663 I673 G674 R676 L711	R650-I665 HydrophobicContact CB-CG2 4.46Å; V651-I665 WeakPolarHBondContact O-CA 3.42Å; L652-I665 HydrophobicContact CD1-CG2 4.28Å; I663-I665 HydrophobicContact CG2-CG1 4.45Å; I665-I673 HydrophobicContact CB-CB 4.41Å; I665-I673 HydrophobicContact CG2-CB 4.27Å; I665-I673 HydrophobicContact CG2-CD1 4.12Å; I665-I673 PolarHBondContact O-N 3.24Å; I665-G674 WeakPolarHBondContact CA-O 3.48Å; I665-G674 WeakPolarHBondContact CB-O 3.36Å; I665-G674 PolarHBondContact N-O 2.97Å; I665-G674 PolarHBondContact O-N 3.17Å; I665-R676 HydrophobicContact CD1-CG 4.09Å; I665-L711 HydrophobicContact CD1-CD1 3.89Å; I665-L711 HydrophobicContact CD1-CD2 3.37Å; I665-L711 HydrophobicContact CD1-CG 4.29Å; I665-L711 HydrophobicContact CG1-CD1 4.38Å; I665-L711 HydrophobicContact CG1-CD2 4.47Å; I665-L711 HydrophobicContact CG2-CD1 4.4Å
666	F	96.2	Very high	85.1	Confident	5 Å²	5	47.1 Å²	47.1	2%	0.022	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	154.5	179.1	-55.5	-94.2	0	0	0	111.7	I631 V636 T637 V651 V653 A664 G671 Y672	I631-F666 HydrophobicContact CG2-CB 3.93Å; I631-F666 HydrophobicContact CG2-CD1 3.3Å; I631-F666 HydrophobicContact CG2-CD2 3.77Å; I631-F666 HydrophobicContact CG2-CE1 3.63Å; I631-F666 HydrophobicContact CG2-CE2 4.05Å; I631-F666 HydrophobicContact CG2-CG 3.39Å; I631-F666 HydrophobicContact CG2-CZ 3.99Å; V636-F666 HydrophobicContact CG1-CE1 4.2Å; V636-F666 HydrophobicContact CG1-CZ 3.7Å; T637-F666 HydrophobicContact CG2-CE2 3.68Å; T637-F666 HydrophobicContact CG2-CZ 3.73Å; V651-F666 HydrophobicContact CB-CB 4.28Å; V651-F666 PolarHBondContact N-O 3.24Å; V651-F666 PolarHBondContact O-N 2.92Å; V653-F666 HydrophobicContact CG2-CD2 4.18Å; V653-F666 HydrophobicContact CG2-CE2 4.13Å; A664-F666 HydrophobicContact CB-CD2 4.38Å; A664-F666 HydrophobicContact CB-CE2 3.48Å; A664-F666 VanDerWaalsContact CB-CE2 3.48Å; A664-F666 HydrophobicContact CB-CZ 3.94Å; F666-G671 CarbonylContact C-O 3.19Å; F666-G671 VanDerWaalsContact CA-O 3.29Å; F666-G671 WeakPolarHBondContact CA-O 3.36Å; F666-Y672 HydrophobicContact CD1-CD2 4.24Å; F666-Y672 AromaticContact CE1-CD2 3.74Å; F666-Y672 HydrophobicContact CE1-CD2 3.74Å; F666-Y672 HydrophobicContact CE1-CG 4.3Å; F666-Y672 HydrophobicContact CZ-CD2 4.05Å
667	L	94.7	Very high	85.5	Confident	83 Å²	83	50.2 Å²	50.2	44%	0.435	28%	0.278	S	S	.	.			trans	-67.9	154	159.9	-68.3	171	0	0	0	109.1	T669 G670 G671 I673	L667-T669 PolarHBondContact O-N 3.44Å; L667-T669 VanDerWaalsContact O-N 3.07Å; L667-G670 WeakPolarHBondContact O-CA 3.44Å; L667-G670 PolarHBondContact O-N 2.93Å; L667-G671 PolarHBondContact N-O 3.26Å; L667-I673 HydrophobicContact CD2-CD1 3.64Å; L667-I673 HydrophobicContact CD2-CG1 4.22Å; L667-I673 HydrophobicContact CG-CD1 3.74Å; L667-I673 HydrophobicContact CG-CG1 3.81Å
668	P	91.2	Very high	85.8	Confident	40 Å²	40	45.5 Å²	45.5	26%	0.26	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-20.5	177.2	16.2	-19.2	0	0	0	112.4	Y604 G649 G670	Y604-P668 HydrophobicContact CE1-CB 4.43Å; G649-P668 WeakPolarHBondContact O-CB 3.48Å; G649-P668 WeakPolarHBondContact O-CD 3.48Å; G649-P668 WeakPolarHBondContact O-CG 3.4Å; P668-G670 PolarHBondContact O-N 2.85Å
669	T	93.3	Very high	86.1	Confident	93 Å²	93	47 Å²	47	57%	0.571	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-11.2	172.4	56.2	0	0	0	0	114.2	R629 L667	R629-T669 VanDerWaalsContact CD-O 3.28Å; R629-T669 WeakPolarHBondContact CD-O 3.17Å; R629-T669 PolarHBondContact NH1-O 3.09Å; L667-T669 PolarHBondContact O-N 3.44Å; L667-T669 VanDerWaalsContact O-N 3.07Å
670	G	92.8	Very high	86	Confident	23 Å²	23	46.1 Å²	46.1	24%	0.237	26%	0.26	C	S	.	.	S	Bend	trans	101	-3	-178.7	0	0	0	0	0	115.3	L667 P668 Y672	L667-G670 WeakPolarHBondContact O-CA 3.44Å; L667-G670 PolarHBondContact O-N 2.93Å; P668-G670 PolarHBondContact O-N 2.85Å; G670-Y672 PolarHBondContact O-N 3.5Å
671	G	94.6	Very high	85.8	Confident	32 Å²	32	42.5 Å²	42.5	33%	0.33	24%	0.244	S	C	.	.			trans	-68.7	125.9	177.5	0	0	0	0	0	111.9	F666 L667	F666-G671 CarbonylContact C-O 3.19Å; F666-G671 VanDerWaalsContact CA-O 3.29Å; F666-G671 WeakPolarHBondContact CA-O 3.36Å; L667-G671 PolarHBondContact N-O 3.26Å
672	Y	93.6	Very high	85	Confident	104 Å²	104	43.9 Å²	43.9	41%	0.408	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	129.5	176.1	176	-97.7	0	0	0	111	V636 F666 G670 G674 E675	V636-Y672 HydrophobicContact CG1-CD2 3.54Å; V636-Y672 HydrophobicContact CG1-CE2 3.47Å; V636-Y672 VanDerWaalsContact CG1-CE2 3.47Å; F666-Y672 HydrophobicContact CD1-CD2 4.24Å; F666-Y672 AromaticContact CE1-CD2 3.74Å; F666-Y672 HydrophobicContact CE1-CD2 3.74Å; F666-Y672 HydrophobicContact CE1-CG 4.3Å; F666-Y672 HydrophobicContact CZ-CD2 4.05Å; G670-Y672 PolarHBondContact O-N 3.5Å; Y672-G674 WeakPolarHBondContact CE2-O 3.42Å; Y672-G674 VanDerWaalsContact OH-C 3.27Å; Y672-E675 HydrophobicContact CE2-CB 4.44Å; Y672-E675 WeakPolarHBondContact OH-CB 3.46Å; Y672-E675 VanDerWaalsContact OH-CG 3.31Å; Y672-E675 WeakPolarHBondContact OH-CG 3.22Å; Y672-E675 PolarHBondContact OH-N 3.31Å; Y672-E675 PolarHBondContact OH-OE2 3.14Å
673	I	90.8	Very high	84.4	Confident	82 Å²	82	48.8 Å²	48.8	42%	0.421	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	-39.8	179.8	-56.2	179.8	0	0	0	110.2	R650 I665 L667	R650-I673 HydrophobicContact CG-CD1 4.44Å; I665-I673 HydrophobicContact CB-CB 4.41Å; I665-I673 HydrophobicContact CG2-CB 4.27Å; I665-I673 HydrophobicContact CG2-CD1 4.12Å; I665-I673 PolarHBondContact O-N 3.24Å; L667-I673 HydrophobicContact CD2-CD1 3.64Å; L667-I673 HydrophobicContact CD2-CG1 4.22Å; L667-I673 HydrophobicContact CG-CD1 3.74Å; L667-I673 HydrophobicContact CG-CG1 3.81Å
674	G	89.3	Confident	83.7	Confident	12 Å²	12	48.9 Å²	48.9	12%	0.124	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	162.1	-175.3	-175.6	0	0	0	0	0	111.1	I665 Y672	I665-G674 WeakPolarHBondContact CA-O 3.48Å; I665-G674 WeakPolarHBondContact CB-O 3.36Å; I665-G674 PolarHBondContact N-O 2.97Å; I665-G674 PolarHBondContact O-N 3.17Å; Y672-G674 WeakPolarHBondContact CE2-O 3.42Å; Y672-G674 VanDerWaalsContact OH-C 3.27Å
675	E	87.7	Confident	83.4	Confident	78 Å²	78	49.4 Å²	49.4	36%	0.364	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	166.2	177.6	65.5	-152.5	-173.1	0	0	111.6	H662 I663 Y672	H662-E675 WeakPolarHBondContact NE2-CB 3.4Å; H662-E675 IonicContact NE2-OE2 3.33Å; H662-E675 PolarHBondContact NE2-OE2 2.96Å; I663-E675 CarbonylContact O-C 3.6Å; I663-E675 VanDerWaalsContact O-CA 3.25Å; I663-E675 WeakPolarHBondContact O-CA 3.44Å; Y672-E675 HydrophobicContact CE2-CB 4.44Å; Y672-E675 WeakPolarHBondContact OH-CB 3.46Å; Y672-E675 VanDerWaalsContact OH-CG 3.31Å; Y672-E675 WeakPolarHBondContact OH-CG 3.22Å; Y672-E675 PolarHBondContact OH-N 3.31Å; Y672-E675 PolarHBondContact OH-OE2 3.14Å
676	R	85.1	Confident	83.2	Confident	38 Å²	38	49.4 Å²	49.4	14%	0.143	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	138.9	175.3	-59.3	-68.6	-177.3	-96.5	5.8	108.4	H443 F445 I663 I665 L711	H443-R676 WeakPolarHBondContact O-CD 3.07Å; F445-R676 HydrophobicContact CB-CB 4.42Å; F445-R676 HydrophobicContact CD2-CB 3.06Å; F445-R676 HydrophobicContact CD2-CG 3.53Å; F445-R676 HydrophobicContact CE2-CB 3.4Å; F445-R676 VanDerWaalsContact CE2-CB 3.4Å; F445-R676 HydrophobicContact CE2-CG 3.48Å; F445-R676 VanDerWaalsContact CE2-CG 3.48Å; F445-R676 HydrophobicContact CG-CB 3.87Å; F445-R676 HydrophobicContact CG-CG 4.12Å; F445-R676 HydrophobicContact CZ-CB 4.43Å; F445-R676 HydrophobicContact CZ-CG 4.07Å; I663-R676 PolarHBondContact N-O 2.52Å; I663-R676 PolarHBondContact O-N 3.03Å; I665-R676 HydrophobicContact CD1-CG 4.09Å; R676-L711 HydrophobicContact CG-CD2 4.03Å
677	E	81.4	Confident	83.1	Confident	79 Å²	79	49.3 Å²	49.3	37%	0.369	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	147.2	176.7	-70.6	-174.3	168.6	0	0	111.5	F445	F445-E677 PolarHBondContact N-O 2.89Å
678	C	73.5	Confident	83.1	Confident	12 Å²	12	48 Å²	48	8%	0.081	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	116.8	168.4	-169.4	0	0	0	0	108.7	F661	F661-C678 HydrophobicContact CB-CB 4.38Å; F661-C678 HydrophobicContact CD1-CB 3.98Å; F661-C678 PolarHBondContact N-O 3.34Å; F661-C678 PolarHBondContact O-N 3.08Å
679	T	68	Low	83.1	Confident	82 Å²	82	48.1 Å²	48.1	50%	0.503	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	154.4	-178.8	53.7	0	0	0	0	112
680	S	61.9	Low	83	Confident	100 Å²	100	44 Å²	44	70%	0.699	24%	0.239	S	C	*	.	S	Bend	trans	76.1	32.5	174.3	-47.4	0	0	0	0	115.6
681	V	65.1	Low	82.7	Confident	7 Å²	7	49.7 Å²	49.7	4%	0.042	26%	0.258	C	S	.	.			trans	-127.9	117.3	-177.2	-174.4	0	0	0	0	108.9	N659 F661 V699 L706	N659-V681 CarbonylContact C-O 3.58Å; N659-V681 VanDerWaalsContact O-O 3.1Å; F661-V681 HydrophobicContact CB-CB 3.46Å; F661-V681 VanDerWaalsContact CB-CB 3.46Å; F661-V681 HydrophobicContact CB-CG1 3.57Å; F661-V681 HydrophobicContact CB-CG2 3.97Å; F661-V681 HydrophobicContact CG-CB 4.49Å; F661-V681 HydrophobicContact CG-CG1 4.18Å; V681-V699 HydrophobicContact CG1-CB 4.18Å; V681-V699 HydrophobicContact CG1-CG1 3.51Å; V681-V699 HydrophobicContact CG1-CG2 3.58Å; V681-L706 HydrophobicContact CB-CD1 4.47Å; V681-L706 HydrophobicContact CG1-CD1 4Å; V681-L706 HydrophobicContact CG2-CD1 3.56Å
682	S	62.5	Low	82.2	Confident	31 Å²	31	53.7 Å²	53.7	22%	0.217	27%	0.268	C	S	.	.	S	Bend	trans	-77.7	-36.8	-170.7	63.6	0	0	0	0	114	N701 N702	S682-N701 WeakPolarHBondContact OG-CB 3.44Å; S682-N701 PolarHBondContact OG-ND2 3.28Å; S682-N702 WeakPolarHBondContact CB-OD1 3.39Å; S682-N702 PolarHBondContact OG-OD1 3.32Å
683	R	73.5	Confident	82	Confident	117 Å²	117	49.3 Å²	49.3	44%	0.442	25%	0.254	S	S	.	.			trans	-165.3	126.8	178.8	-123.5	176.9	-169.2	138.2	5.7	111.8	S656 V699 K700	S656-R683 WeakPolarHBondContact OG-CA 3.39Å; S656-R683 WeakPolarHBondContact OG-CG 3.39Å; R683-V699 WeakPolarHBondContact O-CA 3.29Å; R683-K700 PolarHBondContact O-N 3.31Å
684	C	77.3	Confident	81.9	Confident	4 Å²	4	46.8 Å²	46.8	3%	0.027	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	146.3	170.1	60.9	0	0	0	0	111.1	S641 S656 F661 T697 L698	S641-C684 PolarHBondContact OG-O 2.68Å; S641-C684 PolarHBondContact OG-SG 3.12Å; S656-C684 PolarHBondContact OG-N 3Å; S656-C684 VanDerWaalsContact OG-N 3.14Å; S656-C684 PolarHBondContact OG-SG 3.11Å; F661-C684 HydrophobicContact CD2-CB 3.49Å; F661-C684 VanDerWaalsContact CD2-CB 3.49Å; F661-C684 HydrophobicContact CE2-CB 3.23Å; F661-C684 WeakPolarHBondContact CE2-SG 3.44Å; F661-C684 HydrophobicContact CG-CB 4.43Å; F661-C684 HydrophobicContact CZ-CB 3.99Å; C684-T697 WeakPolarHBondContact CB-OG1 3.41Å; C684-L698 CarbonylContact C-O 3.57Å; C684-L698 VanDerWaalsContact CA-O 3.31Å; C684-L698 WeakPolarHBondContact CA-O 3.25Å
685	S	84.6	Confident	82	Confident	10 Å²	10	46.2 Å²	46.2	7%	0.07	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	97.3	175.8	-165.6	0	0	0	0	108.8	H465 L698	H465-S685 WeakPolarHBondContact O-CB 3.41Å; H465-S685 PolarHBondContact O-OG 3.07Å; S685-L698 PolarHBondContact N-O 3.12Å
686	G	91.1	Very high	82.2	Confident	5 Å²	5	42.5 Å²	42.5	5%	0.052	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	76.2	159.7	-174	0	0	0	0	0	114.3	S641 T697	S641-G686 PolarHBondContact O-N 3.02Å; G686-T697 PolarHBondContact O-OG1 3.27Å
687	L	93.9	Very high	82.6	Confident	3 Å²	3	40.7 Å²	40.7	2%	0.016	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	144.6	170.8	-76.8	-178.1	0	0	0	109	V644 L652 F661 I663 V695 V696	V644-L687 HydrophobicContact CB-CB 3.9Å; V644-L687 HydrophobicContact CG1-CB 3.71Å; V644-L687 HydrophobicContact CG1-CD1 4.32Å; L652-L687 HydrophobicContact CB-CD1 4.15Å; L652-L687 WeakPolarHBondContact O-CD1 2.8Å; F661-L687 HydrophobicContact CE2-CD2 4.49Å; F661-L687 HydrophobicContact CZ-CD2 3.85Å; I663-L687 HydrophobicContact CD1-CD2 4.44Å; L687-V695 HydrophobicContact CD2-CG1 3.85Å; L687-V696 WeakPolarHBondContact CA-O 3.31Å
688	Q	94.7	Very high	83.1	Confident	56 Å²	56	37 Å²	37	26%	0.262	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	158.7	168.1	-66.7	-67.7	5	0	0	110.4	F467 I469 V696	F467-Q688 HydrophobicContact CD1-CG 4.42Å; F467-Q688 HydrophobicContact CD2-CB 4.48Å; F467-Q688 HydrophobicContact CD2-CG 3.91Å; F467-Q688 HydrophobicContact CE1-CG 3.96Å; F467-Q688 HydrophobicContact CE2-CB 3.57Å; F467-Q688 HydrophobicContact CE2-CG 3.38Å; F467-Q688 HydrophobicContact CG-CG 4.4Å; F467-Q688 HydrophobicContact CZ-CB 3.63Å; F467-Q688 HydrophobicContact CZ-CG 3.4Å; F467-Q688 PolarHBondContact O-NE2 3.02Å; I469-Q688 HydrophobicContact CD1-CB 3.57Å; I469-Q688 HydrophobicContact CD1-CG 4.49Å; I469-Q688 HydrophobicContact CG1-CB 3.71Å; I469-Q688 HydrophobicContact CG1-CG 4.1Å; Q688-V696 HydrophobicContact CB-CB 4.47Å; Q688-V696 PolarHBondContact N-O 3.42Å; Q688-V696 PolarHBondContact O-N 3.43Å
689	F	91.4	Very high	83.9	Confident	43 Å²	43	36.4 Å²	36.4	19%	0.189	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	126.1	-177.4	-166.6	-101.8	0	0	0	109.4	V644 T646 G693 Y694 V695	V644-F689 HydrophobicContact CG1-CB 4.38Å; V644-F689 HydrophobicContact CG2-CB 3.87Å; T646-F689 HydrophobicContact CG2-CD1 4.39Å; T646-F689 HydrophobicContact CG2-CD2 3.92Å; T646-F689 HydrophobicContact CG2-CE1 4.17Å; T646-F689 HydrophobicContact CG2-CE2 3.69Å; T646-F689 HydrophobicContact CG2-CG 4.25Å; T646-F689 HydrophobicContact CG2-CZ 3.8Å; F689-G693 VanDerWaalsContact CE2-O 3.26Å; F689-G693 WeakPolarHBondContact CE2-O 3.47Å; F689-Y694 WeakPolarHBondContact CA-O 3.14Å; F689-V695 HydrophobicContact CD2-CG2 4.1Å; F689-V695 HydrophobicContact CE2-CG2 4.31Å
690	T	90.8	Very high	84.7	Confident	5 Å²	5	35.5 Å²	35.5	3%	0.031	18%	0.177	C	C	.	.			trans	-82.1	164.4	179.7	72.8	0	0	0	0	111.3	I469 I490 E692 G693 Y694 V696	I469-T690 HydrophobicContact CD1-CG2 3.88Å; I490-T690 HydrophobicContact CD1-CG2 3.54Å; I490-T690 HydrophobicContact CG1-CG2 3.95Å; T690-E692 PolarHBondContact O-N 2.98Å; T690-E692 PolarHBondContact OG1-N 3.14Å; T690-G693 PolarHBondContact O-N 2.91Å; T690-G693 PolarHBondContact OG1-N 2.93Å; T690-Y694 HydrophobicContact CG2-CD2 4.34Å; T690-Y694 PolarHBondContact N-O 3.33Å; T690-Y694 WeakPolarHBondContact OG1-CB 2.7Å; T690-Y694 WeakPolarHBondContact OG1-CD2 3.41Å; T690-Y694 PolarHBondContact OG1-N 3.08Å; T690-V696 HydrophobicContact CG2-CG2 3.74Å
691	K	86	Confident	85.6	Confident	144 Å²	144	34.7 Å²	34.7	63%	0.626	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-30.7	173.3	-67.6	175.6	179	175.4	0	113	N471 G693	N471-K691 PolarHBondContact O-NZ 3.06Å; K691-G693 PolarHBondContact O-N 2.8Å
692	E	85	Confident	86.6	Confident	116 Å²	116	37 Å²	37	54%	0.542	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-3.1	174.8	-66	-172.4	-163	0	0	113.4	T690 Y694	T690-E692 PolarHBondContact O-N 2.98Å; T690-E692 PolarHBondContact OG1-N 3.14Å; E692-Y694 HydrophobicContact CB-CD2 3.97Å; E692-Y694 HydrophobicContact CB-CE2 3.6Å; E692-Y694 HydrophobicContact CG-CE2 4.33Å; E692-Y694 WeakPolarHBondContact OE2-CE2 3.21Å; E692-Y694 PolarHBondContact OE2-OH 2.86Å
693	G	87.4	Confident	87.9	Confident	11 Å²	11	37 Å²	37	11%	0.113	17%	0.174	C	C	.	.	S	Bend	trans	89.5	10.3	176.2	0	0	0	0	0	115.4	F689 T690 K691 P710	F689-G693 VanDerWaalsContact CE2-O 3.26Å; F689-G693 WeakPolarHBondContact CE2-O 3.47Å; T690-G693 PolarHBondContact O-N 2.91Å; T690-G693 PolarHBondContact OG1-N 2.93Å; K691-G693 PolarHBondContact O-N 2.8Å; G693-P710 WeakPolarHBondContact O-CA 3.09Å; G693-P710 WeakPolarHBondContact O-CB 3.15Å
694	Y	89.5	Confident	88.7	Confident	30 Å²	30	31.5 Å²	31.5	12%	0.118	15%	0.153	C	C	.	.			trans	-75.6	146.8	174.9	-53.1	-55	0	0	0	111.2	F689 T690 E692 I707 L708 P710	F689-Y694 WeakPolarHBondContact CA-O 3.14Å; T690-Y694 HydrophobicContact CG2-CD2 4.34Å; T690-Y694 PolarHBondContact N-O 3.33Å; T690-Y694 WeakPolarHBondContact OG1-CB 2.7Å; T690-Y694 WeakPolarHBondContact OG1-CD2 3.41Å; T690-Y694 PolarHBondContact OG1-N 3.08Å; E692-Y694 HydrophobicContact CB-CD2 3.97Å; E692-Y694 HydrophobicContact CB-CE2 3.6Å; E692-Y694 HydrophobicContact CG-CE2 4.33Å; E692-Y694 WeakPolarHBondContact OE2-CE2 3.21Å; E692-Y694 PolarHBondContact OE2-OH 2.86Å; Y694-I707 HydrophobicContact CD2-CG2 4.41Å; Y694-I707 HydrophobicContact CG-CG2 4.04Å; Y694-L708 WeakPolarHBondContact CA-O 3.28Å; Y694-L708 WeakPolarHBondContact CB-O 3.4Å; Y694-P710 HydrophobicContact CD1-CG 3.79Å; Y694-P710 HydrophobicContact CE1-CG 3.87Å
695	V	90.9	Very high	89.4	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	127.1	171.3	-175	0	0	0	0	108.7	F445 L652 I663 L687 F689 L708	F445-V695 HydrophobicContact CE1-CG2 4.22Å; F445-V695 HydrophobicContact CZ-CB 4.48Å; F445-V695 HydrophobicContact CZ-CG2 3.83Å; L652-V695 HydrophobicContact CD2-CG1 4.27Å; L652-V695 HydrophobicContact CD2-CG2 3.49Å; L652-V695 VanDerWaalsContact CD2-CG2 3.49Å; I663-V695 HydrophobicContact CD1-CG1 4.11Å; L687-V695 HydrophobicContact CD2-CG1 3.85Å; F689-V695 HydrophobicContact CD2-CG2 4.1Å; F689-V695 HydrophobicContact CE2-CG2 4.31Å; V695-L708 HydrophobicContact CB-CB 4.27Å; V695-L708 PolarHBondContact N-O 3.41Å; V695-L708 VanDerWaalsContact N-O 3.16Å; V695-L708 PolarHBondContact O-N 2.79Å
696	V	92.8	Very high	89.7	Confident	0 Å²	0	31 Å²	31	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	140.5	178.9	-169.5	0	0	0	0	109.1	F467 I469 L475 I490 L687 Q688 T690 I705 L706 I707	F467-V696 HydrophobicContact CE2-CB 3.87Å; F467-V696 HydrophobicContact CE2-CG1 3.54Å; F467-V696 HydrophobicContact CZ-CB 4.12Å; F467-V696 HydrophobicContact CZ-CG1 3.99Å; F467-V696 WeakPolarHBondContact CZ-O 3.46Å; I469-V696 HydrophobicContact CD1-CB 4.41Å; I469-V696 HydrophobicContact CD1-CG2 3.93Å; L475-V696 HydrophobicContact CD1-CG1 4.31Å; L475-V696 HydrophobicContact CD2-CG1 4.14Å; I490-V696 HydrophobicContact CD1-CG2 3.69Å; L687-V696 WeakPolarHBondContact CA-O 3.31Å; Q688-V696 HydrophobicContact CB-CB 4.47Å; Q688-V696 PolarHBondContact N-O 3.42Å; Q688-V696 PolarHBondContact O-N 3.43Å; T690-V696 HydrophobicContact CG2-CG2 3.74Å; V696-I705 HydrophobicContact CG1-CG2 3.72Å; V696-L706 WeakPolarHBondContact CA-O 3.4Å; V696-I707 HydrophobicContact CG1-CG1 4.36Å; V696-I707 HydrophobicContact CG2-CG1 4.33Å
697	T	93.3	Very high	89.6	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	154.1	170.6	-167	0	0	0	0	111.5	F661 C684 G686 I705 L706	F661-T697 HydrophobicContact CD1-CG2 4.24Å; F661-T697 HydrophobicContact CE1-CG2 3.44Å; F661-T697 VanDerWaalsContact CE1-CG2 3.44Å; F661-T697 HydrophobicContact CE2-CG2 4.47Å; F661-T697 HydrophobicContact CZ-CG2 3.57Å; C684-T697 WeakPolarHBondContact CB-OG1 3.41Å; G686-T697 PolarHBondContact O-OG1 3.27Å; T697-I705 WeakPolarHBondContact O-CA 3.24Å; T697-L706 HydrophobicContact CG2-CB 3.93Å; T697-L706 HydrophobicContact CG2-CD1 4.17Å; T697-L706 HydrophobicContact CG2-CG 4.35Å; T697-L706 PolarHBondContact N-O 3.03Å; T697-L706 PolarHBondContact O-N 3.49Å
698	L	92.5	Very high	89.3	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	141	166.5	-54.3	176	0	0	0	109.6	P464 F467 I477 C684 S685 I705	P464-L698 HydrophobicContact CB-CD1 4.19Å; F467-L698 HydrophobicContact CB-CD1 3.98Å; F467-L698 HydrophobicContact CB-CD2 4.43Å; F467-L698 HydrophobicContact CB-CG 4.39Å; F467-L698 HydrophobicContact CD1-CD1 3.52Å; F467-L698 HydrophobicContact CD1-CD2 4.1Å; F467-L698 HydrophobicContact CD1-CG 3.43Å; F467-L698 VanDerWaalsContact CD1-CG 3.43Å; F467-L698 HydrophobicContact CE1-CD1 4.34Å; F467-L698 HydrophobicContact CE1-CG 3.83Å; F467-L698 HydrophobicContact CG-CD1 3.98Å; F467-L698 HydrophobicContact CG-CD2 4.1Å; F467-L698 HydrophobicContact CG-CG 3.93Å; I477-L698 HydrophobicContact CG1-CD2 4.23Å; I477-L698 HydrophobicContact CG2-CD1 4.07Å; I477-L698 HydrophobicContact CG2-CD2 4.14Å; C684-L698 CarbonylContact C-O 3.57Å; C684-L698 VanDerWaalsContact CA-O 3.31Å; C684-L698 WeakPolarHBondContact CA-O 3.25Å; S685-L698 PolarHBondContact N-O 3.12Å; L698-I705 HydrophobicContact CD2-CD1 4.12Å; L698-I705 HydrophobicContact CD2-CG1 3.69Å; L698-I705 HydrophobicContact CD2-CG2 4.49Å
699	V	89	Confident	88.7	Confident	1 Å²	1	30.4 Å²	30.4	1%	0.006	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	93.5	172.4	-168.5	0	0	0	0	108.6	V681 R683 N701 N702 H703 C704 L706	V681-V699 HydrophobicContact CG1-CB 4.18Å; V681-V699 HydrophobicContact CG1-CG1 3.51Å; V681-V699 HydrophobicContact CG1-CG2 3.58Å; R683-V699 WeakPolarHBondContact O-CA 3.29Å; V699-N701 PolarHBondContact O-N 3.16Å; V699-N702 HydrophobicContact CB-CB 4.04Å; V699-N702 HydrophobicContact CG1-CB 3.55Å; V699-N702 WeakPolarHBondContact CG1-OD1 3.44Å; V699-N702 CarbonylContact O-C 3.21Å; V699-N702 PolarHBondContact O-N 3.06Å; V699-N702 VanDerWaalsContact O-N 3.1Å; V699-H703 PolarHBondContact O-N 3.14Å; V699-C704 PolarHBondContact N-O 3.13Å; V699-L706 HydrophobicContact CG2-CD1 3.45Å; V699-L706 VanDerWaalsContact CG2-CD1 3.45Å; V699-L706 HydrophobicContact CG2-CD2 4.3Å; V699-L706 HydrophobicContact CG2-CG 3.54Å
700	K	84.8	Confident	87.9	Confident	63 Å²	63	30.7 Å²	30.7	27%	0.274	15%	0.153	S	C	.	.	G	3₁₀ helix	trans	-54.1	-48.7	-168	-176.6	177	179	-179.1	0	113.2	S463 H465 R683	S463-K700 WeakPolarHBondContact OG-CE 3.49Å; H465-K700 PolarHBondContact CD2-NZ 3.29Å; R683-K700 PolarHBondContact O-N 3.31Å
701	N	82.5	Confident	87	Confident	83 Å²	83	31.4 Å²	31.4	44%	0.444	16%	0.157	S	C	.	.	G	3₁₀ helix	trans	-86.1	-9.5	-176.9	-38	-39.5	0	0	0	113.8	S682 V699 H703	S682-N701 WeakPolarHBondContact OG-CB 3.44Å; S682-N701 PolarHBondContact OG-ND2 3.28Å; V699-N701 PolarHBondContact O-N 3.16Å; N701-H703 PolarHBondContact O-CD2 3.41Å; N701-H703 VanDerWaalsContact O-CD2 3.29Å
702	N	85.2	Confident	85.7	Confident	54 Å²	54	34 Å²	34	29%	0.289	18%	0.177	S	C	.	.	G	3₁₀ helix	trans	-102.3	0.8	174.4	-64.6	69.9	0	0	0	111.8	S682 V699 C704	S682-N702 WeakPolarHBondContact CB-OD1 3.39Å; S682-N702 PolarHBondContact OG-OD1 3.32Å; V699-N702 HydrophobicContact CB-CB 4.04Å; V699-N702 HydrophobicContact CG1-CB 3.55Å; V699-N702 WeakPolarHBondContact CG1-OD1 3.44Å; V699-N702 CarbonylContact O-C 3.21Å; V699-N702 PolarHBondContact O-N 3.06Å; V699-N702 VanDerWaalsContact O-N 3.1Å; N702-C704 PolarHBondContact O-N 3.12Å
703	H	89.6	Confident	85.8	Confident	32 Å²	32	29.9 Å²	29.9	15%	0.148	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.1	37	172.2	-53.2	-97.7	0	0	0	113.2	G452 S453 N454 F461 D462 S463 V699 N701	G452-H703 CarbonylContact C-O 3.47Å; G452-H703 VanDerWaalsContact C-O 3.27Å; S453-H703 CarbonylContact C-O 3.47Å; S453-H703 WeakPolarHBondContact CA-O 3.26Å; S453-H703 PolarHBondContact N-O 2.89Å; S453-H703 VanDerWaalsContact N-O 3.09Å; N454-H703 HydrophobicContact CB-CB 3.98Å; N454-H703 PolarHBondContact OD1-CE1 2.78Å; N454-H703 PolarHBondContact OD1-ND1 3.22Å; N454-H703 VanDerWaalsContact OD1-ND1 3.12Å; F461-H703 WeakPolarHBondContact O-CB 3.38Å; F461-H703 PolarHBondContact O-ND1 3.4Å; F461-H703 VanDerWaalsContact O-ND1 3.07Å; D462-H703 WeakPolarHBondContact CA-ND1 3.37Å; D462-H703 IonicContact OD1-CE1 3.56Å; D462-H703 PolarHBondContact OD1-CE1 3.01Å; D462-H703 IonicContact OD1-ND1 3.39Å; S463-H703 PolarHBondContact N-ND1 3.13Å; V699-H703 PolarHBondContact O-N 3.14Å; N701-H703 PolarHBondContact O-CD2 3.41Å; N701-H703 VanDerWaalsContact O-CD2 3.29Å
704	C	90.6	Very high	85.7	Confident	1 Å²	1	30.9 Å²	30.9	1%	0.007	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	167.9	-173.9	67.3	0	0	0	0	112.4	R450 F451 G452 V699 N702	R450-C704 HydrophobicContact CG-CB 4.3Å; R450-C704 PolarHBondContact NE-SG 3.38Å; F451-C704 CarbonylContact O-C 3.57Å; F451-C704 WeakPolarHBondContact O-CA 3.32Å; F451-C704 VanDerWaalsContact O-CB 3.31Å; F451-C704 WeakPolarHBondContact O-CB 3.22Å; G452-C704 WeakPolarHBondContact O-CB 3.27Å; V699-C704 PolarHBondContact N-O 3.13Å; N702-C704 PolarHBondContact O-N 3.12Å
705	I	92.2	Very high	85.5	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	138.3	177.7	-52.3	-179.4	0	0	0	107.4	R450 F451 F461 L475 I477 V696 T697 L698	R450-I705 WeakPolarHBondContact CA-O 3.3Å; F451-I705 HydrophobicContact CD2-CB 3.91Å; F451-I705 HydrophobicContact CD2-CD1 4Å; F451-I705 HydrophobicContact CD2-CG1 4.25Å; F451-I705 HydrophobicContact CE2-CB 3.65Å; F451-I705 HydrophobicContact CE2-CD1 3.55Å; F451-I705 HydrophobicContact CE2-CG1 4.05Å; F451-I705 HydrophobicContact CE2-CG2 3.83Å; F451-I705 HydrophobicContact CZ-CB 4.11Å; F451-I705 HydrophobicContact CZ-CG2 3.87Å; F451-I705 PolarHBondContact N-O 2.76Å; F451-I705 PolarHBondContact O-N 3.01Å; F461-I705 HydrophobicContact CE2-CD1 3.93Å; F461-I705 HydrophobicContact CE2-CG1 4.12Å; F461-I705 HydrophobicContact CZ-CD1 3.73Å; F461-I705 HydrophobicContact CZ-CG1 4.38Å; L475-I705 HydrophobicContact CD1-CD1 4.16Å; L475-I705 HydrophobicContact CD1-CG2 4.01Å; I477-I705 HydrophobicContact CD1-CD1 3.69Å; I477-I705 HydrophobicContact CG1-CD1 4.09Å; V696-I705 HydrophobicContact CG1-CG2 3.72Å; T697-I705 WeakPolarHBondContact O-CA 3.24Å; L698-I705 HydrophobicContact CD2-CD1 4.12Å; L698-I705 HydrophobicContact CD2-CG1 3.69Å; L698-I705 HydrophobicContact CD2-CG2 4.49Å
706	L	90	Very high	85.1	Confident	4 Å²	4	32.8 Å²	32.8	2%	0.021	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	135.8	172.4	-54.8	177	0	0	0	109.4	L447 R450 V681 V696 T697 V699	L447-L706 HydrophobicContact CD1-CB 3.93Å; L447-L706 HydrophobicContact CD1-CD2 3.75Å; L447-L706 HydrophobicContact CD1-CG 4.3Å; L447-L706 HydrophobicContact CD2-CD2 4.49Å; R450-L706 HydrophobicContact CB-CD2 3.9Å; R450-L706 HydrophobicContact CG-CD2 3.7Å; V681-L706 HydrophobicContact CB-CD1 4.47Å; V681-L706 HydrophobicContact CG1-CD1 4Å; V681-L706 HydrophobicContact CG2-CD1 3.56Å; V696-L706 WeakPolarHBondContact CA-O 3.4Å; T697-L706 HydrophobicContact CG2-CB 3.93Å; T697-L706 HydrophobicContact CG2-CD1 4.17Å; T697-L706 HydrophobicContact CG2-CG 4.35Å; T697-L706 PolarHBondContact N-O 3.03Å; T697-L706 PolarHBondContact O-N 3.49Å; V699-L706 HydrophobicContact CG2-CD1 3.45Å; V699-L706 VanDerWaalsContact CG2-CD1 3.45Å; V699-L706 HydrophobicContact CG2-CD2 4.3Å; V699-L706 HydrophobicContact CG2-CG 3.54Å
707	I	89.9	Confident	84.7	Confident	3 Å²	3	34.8 Å²	34.8	2%	0.015	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	124.4	169.2	-55.7	-171.4	0	0	0	107.9	R448 S449 F451 I490 Y694 V696	R448-I707 WeakPolarHBondContact CA-O 3.49Å; R448-I707 HydrophobicContact CB-CG2 4.38Å; R448-I707 VanDerWaalsContact CB-O 3.3Å; R448-I707 WeakPolarHBondContact CB-O 3.2Å; R448-I707 PolarHBondContact N-O 3.01Å; S449-I707 PolarHBondContact N-O 3.15Å; S449-I707 PolarHBondContact O-N 2.87Å; F451-I707 HydrophobicContact CE1-CD1 3.56Å; F451-I707 HydrophobicContact CE1-CG1 3.93Å; F451-I707 HydrophobicContact CZ-CD1 3.75Å; F451-I707 HydrophobicContact CZ-CG1 4.18Å; I490-I707 HydrophobicContact CD1-CD1 3.58Å; I490-I707 HydrophobicContact CG1-CD1 3.78Å; I490-I707 WeakPolarHBondContact O-CD1 3.35Å; Y694-I707 HydrophobicContact CD2-CG2 4.41Å; Y694-I707 HydrophobicContact CG-CG2 4.04Å; V696-I707 HydrophobicContact CG1-CG1 4.36Å; V696-I707 HydrophobicContact CG2-CG1 4.33Å
708	L	87	Confident	84.1	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	142.9	-179.6	-51.9	179.6	0	0	0	109.4	F445 L447 F661 I663 Y694 V695	F445-L708 HydrophobicContact CB-CB 4.1Å; F445-L708 HydrophobicContact CB-CD1 3.89Å; F445-L708 HydrophobicContact CB-CD2 4.19Å; F445-L708 HydrophobicContact CB-CG 4.29Å; F445-L708 HydrophobicContact CD1-CB 3.72Å; F445-L708 HydrophobicContact CD1-CD1 4.32Å; F445-L708 HydrophobicContact CD2-CD1 3.64Å; F445-L708 HydrophobicContact CE1-CB 4.22Å; F445-L708 HydrophobicContact CE2-CD1 4.18Å; F445-L708 HydrophobicContact CG-CB 3.91Å; F445-L708 HydrophobicContact CG-CD1 3.73Å; F445-L708 HydrophobicContact CG-CG 4.34Å; L447-L708 HydrophobicContact CB-CD2 4.47Å; L447-L708 HydrophobicContact CD1-CD2 3.95Å; F661-L708 HydrophobicContact CE1-CD1 3.86Å; I663-L708 HydrophobicContact CD1-CD1 3.61Å; Y694-L708 WeakPolarHBondContact CA-O 3.28Å; Y694-L708 WeakPolarHBondContact CB-O 3.4Å; V695-L708 HydrophobicContact CB-CB 4.27Å; V695-L708 PolarHBondContact N-O 3.41Å; V695-L708 VanDerWaalsContact N-O 3.16Å; V695-L708 PolarHBondContact O-N 2.79Å
709	N	82.2	Confident	83.5	Confident	49 Å²	49	39.8 Å²	39.8	26%	0.262	21%	0.21	S	C	.	.			trans	-58.7	160.1	175.4	-80.2	-29.1	0	0	0	112	F445 F446	F445-N709 VanDerWaalsContact CD1-O 3.22Å; F445-N709 WeakPolarHBondContact CD1-O 3.37Å; F445-N709 WeakPolarHBondContact CE1-O 3.41Å; F446-N709 WeakPolarHBondContact CB-ND2 3.42Å; F446-N709 PolarHBondContact O-N 3.03Å; F446-N709 VanDerWaalsContact O-N 3.12Å
710	P	74.9	Confident	83.1	Confident	48 Å²	48	42.8 Å²	42.8	31%	0.312	23%	0.226	S	C	.	.			trans	-62.1	156.8	-176.7	-21.1	34.9	0	0	0	113.6	G693 Y694 N712	G693-P710 WeakPolarHBondContact O-CA 3.09Å; G693-P710 WeakPolarHBondContact O-CB 3.15Å; Y694-P710 HydrophobicContact CD1-CG 3.79Å; Y694-P710 HydrophobicContact CE1-CG 3.87Å; P710-N712 PolarHBondContact O-N 3.48Å
711	L	70.8	Confident	82.9	Confident	21 Å²	21	41.1 Å²	41.1	11%	0.11	22%	0.222	C	C	.	.			trans	-73.8	89.7	172	-72.5	174.5	0	0	0	109.9	F445 L652 I665 R676	F445-L711 HydrophobicContact CE1-CD2 3.59Å; F445-L711 HydrophobicContact CE1-CG 3.99Å; F445-L711 HydrophobicContact CE2-CD2 3.98Å; F445-L711 HydrophobicContact CZ-CD1 4.47Å; F445-L711 HydrophobicContact CZ-CD2 3.16Å; F445-L711 HydrophobicContact CZ-CG 3.66Å; L652-L711 HydrophobicContact CD1-CD1 3.78Å; L652-L711 HydrophobicContact CD2-CD1 3.75Å; L652-L711 HydrophobicContact CG-CD1 3.93Å; I665-L711 HydrophobicContact CD1-CD1 3.89Å; I665-L711 HydrophobicContact CD1-CD2 3.37Å; I665-L711 HydrophobicContact CD1-CG 4.29Å; I665-L711 HydrophobicContact CG1-CD1 4.38Å; I665-L711 HydrophobicContact CG1-CD2 4.47Å; I665-L711 HydrophobicContact CG2-CD1 4.4Å; R676-L711 HydrophobicContact CG-CD2 4.03Å
712	N	60.1	Low	82.9	Confident	198 Å²	198	37.3 Å²	37.3	100%	1.059	20%	0.202	S	C	*	.			trans	-54	0	169.1	-74.8	-7.2	0	0	0	112	P710	P710-N712 PolarHBondContact O-N 3.48Å

Retrieved 712 of 712 residues in 349.1 ms (Link to these results)

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