A0A087XTT8_POEFO Loading...

E3 ubiquitin-protein ligase NEURL1

Plays a role in hippocampal-dependent synaptic plasticity, learning and memory. Involved in the formation of spines and functional synaptic contacts by modulating the translational activity of the cytoplasmic polyadenylation element-binding protein CPEB3. Promotes ubiquitination of CPEB3, and hence induces CPEB3-dependent mRNA translation activation of glutamate receptor GRIA1 and GRIA2. Can function as an E3 ubiquitin-protein ligase to activate monoubiquitination of JAG1 (in vitro), thereby regulating the Notch pathway. Acts as a tumor suppressor; inhibits malignant cell transformation of medulloblastoma (MB) cells by inhibiting the Notch signaling pathway.

AlphaFold DB , UniProt , Accession A0A087XTT8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 573 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.9	Very low	30.4	Very low	252 Å²	252	153.5 Å²	153.5	100%	1.241	84%	0.841	S	S	*	*				0	135	0	-57.4	-167.6	-107.7	0	0	106.9
2	G	30.4	Very low	30.3	Very low	79 Å²	79	153.2 Å²	153.2	81%	0.814	84%	0.837	S	S	*	*			cis	134.1	127.1	5.5	0	0	0	0	0	109.9
3	G	28.1	Very low	30.4	Very low	77 Å²	77	148.7 Å²	148.7	79%	0.794	82%	0.824	S	S	*	*			trans	98	125.4	-176.4	0	0	0	0	0	113.1
4	Q	29.7	Very low	30.6	Very low	176 Å²	176	150.8 Å²	150.8	82%	0.822	83%	0.832	S	S	*	*			cis	98.5	99	9.9	-154.3	176.8	0	0	0	117.1
5	I	31.6	Very low	30.4	Very low	133 Å²	133	145.9 Å²	145.9	68%	0.682	83%	0.83	S	S	*	*			trans	54	120.1	140.3	-51.3	168.9	0	0	0	120.9
6	T	32	Very low	30.3	Very low	129 Å²	129	141.4 Å²	141.4	79%	0.791	83%	0.826	S	S	*	*				175.7	125.3	116.6	35.7	0	0	0	0	108.3
7	R	30.2	Very low	30.8	Very low	232 Å²	232	139.9 Å²	139.9	88%	0.875	82%	0.821	S	S	*	*				77.6	110.4	59.7	-156.7	-174.1	-159.2	-169.2	5.8	114
8	N	27.8	Very low	30.7	Very low	172 Å²	172	143.8 Å²	143.8	92%	0.92	83%	0.827	S	S	*	*			trans	-161.6	159.2	144.8	-102.6	-15.8	0	0	0	110.9
9	A	28.8	Very low	30.9	Very low	89 Å²	89	142.7 Å²	142.7	74%	0.736	83%	0.825	S	S	*	*			trans	-140.1	170.6	-171.5	0	0	0	0	0	110.6
10	L	31	Very low	31	Very low	155 Å²	155	140.7 Å²	140.7	81%	0.812	82%	0.819	S	S	*	*			trans	171.7	129.2	139.8	-91.8	162.4	0	0	0	110.7
11	Y	30.3	Very low	30.9	Very low	195 Å²	195	139.5 Å²	139.5	77%	0.765	82%	0.815	S	S	*	*			trans	45.7	143	134.7	-81.7	-116.8	0	0	0	120.6
12	D	30.2	Very low	30.7	Very low	149 Å²	149	133.3 Å²	133.3	80%	0.797	80%	0.796	S	S	*	*			cis	-147	172	48.5	-121.8	-41.7	0	0	0	116.3
13	S	30.5	Very low	30.9	Very low	95 Å²	95	138.4 Å²	138.4	66%	0.664	80%	0.798	S	S	*	*			trans	-127.1	136.6	-169.5	-59.2	0	0	0	0	117.1
14	L	33.4	Very low	30.9	Very low	178 Å²	178	144.5 Å²	144.5	93%	0.932	80%	0.797	S	S	*	*			trans	-153.7	151.3	154.7	-67.1	179.3	0	0	0	107.5
15	G	27.9	Very low	30.9	Very low	78 Å²	78	141.8 Å²	141.8	80%	0.804	80%	0.796	S	S	*	*			cis	100.4	111.1	-2.6	0	0	0	0	0	113.3
16	G	28.2	Very low	30.9	Very low	74 Å²	74	142.6 Å²	142.6	76%	0.763	80%	0.797	S	S	*	*			cis	178.5	-158.3	-2.2	0	0	0	0	0	107.7
17	P	40.1	Very low	30.8	Very low	115 Å²	115	144.8 Å²	144.8	75%	0.747	80%	0.798	S	S	*	*			cis	-123.4	160.2	-22.3	40.5	-26.6	0	0	0	113.6
18	F	28.7	Very low	30.8	Very low	211 Å²	211	142.7 Å²	142.7	93%	0.925	80%	0.795	S	S	*	*			trans	-151.6	165.1	168.5	-90.3	-71.2	0	0	0	111.5
19	P	35.1	Very low	31	Very low	123 Å²	123	140.7 Å²	140.7	80%	0.799	79%	0.791	S	S	*	*			trans	-90.2	-173.6	-145.3	36.9	-41.5	0	0	0	117.1
20	S	31.6	Very low	31.1	Very low	101 Å²	101	145.1 Å²	145.1	71%	0.706	79%	0.794	S	S	*	*			trans	-94.9	165	-153.7	53.1	0	0	0	0	116.7
21	T	29.3	Very low	31.1	Very low	117 Å²	117	149 Å²	149	72%	0.718	80%	0.798	S	S	*	*			trans	82.9	108.3	161.1	72.1	0	0	0	0	119.2
22	S	30.3	Very low	31.1	Very low	122 Å²	122	145.9 Å²	145.9	85%	0.853	80%	0.803	S	S	*	*				-168.5	140.2	109.6	-81.9	0	0	0	0	111.4
23	H	33.7	Very low	31.1	Very low	186 Å²	186	146.2 Å²	146.2	86%	0.861	80%	0.804	S	S	*	*			trans	-85.6	142.2	-166.7	-79.9	-107.1	0	0	0	114.7
24	R	29.2	Very low	31.3	Very low	205 Å²	205	147 Å²	147	77%	0.774	81%	0.807	S	S	*	*			trans	-77.8	127	167.6	175.7	-174.3	-174.9	160.8	3.4	110.4	H26	R24-H26 PolarHBondContact NE-NE2 2.85Å; R24-H26 PolarHBondContact NH2-NE2 2.88Å
25	C	28.3	Very low	31.4	Very low	118 Å²	118	146.8 Å²	146.8	80%	0.797	81%	0.805	S	S	*	*			trans	-128.7	125.4	164.4	-94.7	0	0	0	0	111.4
26	H	31.9	Very low	31.6	Very low	151 Å²	151	151.8 Å²	151.8	70%	0.699	81%	0.807	S	S	*	*			trans	-78.1	132.4	172.2	-79.5	-99.9	0	0	0	110.3	R24	R24-H26 PolarHBondContact NE-NE2 2.85Å; R24-H26 PolarHBondContact NH2-NE2 2.88Å
27	H	30.3	Very low	32.1	Very low	174 Å²	174	154.8 Å²	154.8	81%	0.806	82%	0.815	S	S	*	*			trans	-121.1	123.9	164	-94.8	-58.2	0	0	0	112.3
28	K	30.5	Very low	31.6	Very low	189 Å²	189	152.5 Å²	152.5	82%	0.822	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-65	151.4	167.4	-66.9	175.5	177.6	176.5	0	110	K30	K28-K30 PolarHBondContact O-N 3.08Å
29	P	31.7	Very low	32.1	Very low	129 Å²	129	148.4 Å²	148.4	84%	0.838	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-65.6	119.6	178.3	27	-34	0	0	0	110.9
30	K	31	Very low	32.1	Very low	182 Å²	182	148.8 Å²	148.8	79%	0.791	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-73.7	128	168.5	-76.6	-177.5	176.3	177.9	0	108.9	K28 C32	K28-K30 PolarHBondContact O-N 3.08Å; K30-C32 PolarHBondContact O-N 2.79Å
31	R	31.3	Very low	32.5	Very low	237 Å²	237	147.9 Å²	147.9	89%	0.894	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-61.2	120.7	164.8	-69.8	174.3	172	171.7	-4.5	108.3
32	C	30.5	Very low	32.7	Very low	129 Å²	129	144.7 Å²	144.7	87%	0.872	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-73.6	126.4	167.3	-69.5	0	0	0	0	109.3	K30	K30-C32 PolarHBondContact O-N 2.79Å
33	L	30.1	Very low	33.3	Very low	157 Å²	157	145.2 Å²	145.2	82%	0.822	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-83.4	164.2	173.8	-75.2	168.6	0	0	0	110.6
34	P	34.3	Very low	33.7	Very low	111 Å²	111	144.9 Å²	144.9	72%	0.721	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-70.8	144.7	-171.1	-11.2	26.3	0	0	0	112.2	Q36	P34-Q36 PolarHBondContact O-N 2.7Å; P34-Q36 VanDerWaalsContact O-N 3.1Å
35	I	35.2	Very low	34.4	Very low	174 Å²	174	141.2 Å²	141.2	89%	0.892	81%	0.806	S	S	*	*			trans	-68.5	107	171.3	-62.4	172.4	0	0	0	108.3
36	Q	32.6	Very low	36.4	Very low	182 Å²	182	139.9 Å²	139.9	85%	0.85	79%	0.794	S	S	*	*			trans	-77.2	138.1	168.3	-79.5	-176.5	-23.1	0	0	110.4	P34 G38	P34-Q36 PolarHBondContact O-N 2.7Å; P34-Q36 VanDerWaalsContact O-N 3.1Å; Q36-G38 PolarHBondContact O-N 3.33Å
37	C	39.3	Very low	38.7	Very low	138 Å²	138	135.7 Å²	135.7	93%	0.932	78%	0.782	S	S	*	*			trans	-70.3	109.1	171.2	-173.9	0	0	0	0	109.6
38	G	29	Very low	41.6	Very low	67 Å²	67	131 Å²	131	69%	0.691	77%	0.767	S	S	*	*			trans	-105	123.4	174.3	0	0	0	0	0	111	Q36 V40	Q36-G38 PolarHBondContact O-N 3.33Å; G38-V40 PolarHBondContact O-N 2.91Å
39	S	39.9	Very low	44.7	Very low	124 Å²	124	122 Å²	122	87%	0.867	73%	0.728	S	S	*	*			trans	-79.7	102.9	-177.8	171.8	0	0	0	0	112.3
40	V	35	Very low	47.8	Very low	131 Å²	131	117.3 Å²	117.3	79%	0.794	70%	0.696	S	S	*	*			trans	-140	132	157.4	-171.8	0	0	0	0	108.6	G38	G38-V40 PolarHBondContact O-N 2.91Å
41	G	40.1	Very low	51	Low	82 Å²	82	108.7 Å²	108.7	85%	0.845	66%	0.658	S	S	*	*			trans	-79	131.8	-171	0	0	0	0	0	114.5
42	G	33.2	Very low	54.2	Low	51 Å²	51	97.7 Å²	97.7	53%	0.526	62%	0.617	S	S	.	*			trans	167.5	135.5	170.8	0	0	0	0	0	109.9	F44	G42-F44 PolarHBondContact O-N 2.79Å
43	P	41.3	Very low	57.3	Low	132 Å²	132	93.6 Å²	93.6	86%	0.857	59%	0.589	S	S	*	*			trans	-73.7	102.4	179	29.5	-32.3	0	0	0	109.4
44	F	42.5	Very low	60.3	Low	180 Å²	180	91.4 Å²	91.4	79%	0.789	58%	0.578	S	S	*	*			trans	-55.6	129.6	164.3	-71	-86.6	0	0	0	108.3	G42 V46	G42-F44 PolarHBondContact O-N 2.79Å; F44-V46 VanDerWaalsContact C-N 3.3Å; F44-V46 PolarHBondContact O-N 3.07Å
45	P	44.3	Very low	63.3	Low	127 Å²	127	86.3 Å²	86.3	83%	0.825	55%	0.545	S	S	*	.			trans	-68.9	91.8	178.1	27.5	-33.1	0	0	0	108.8	S47	P45-S47 PolarHBondContact O-N 2.84Å
46	V	69.7	Low	66.2	Low	90 Å²	90	80.8 Å²	80.8	55%	0.545	51%	0.514	S	S	.	.	P	Polyproline II helix	trans	-61.8	119.6	173.7	-165.6	0	0	0	0	106.7	F44 R84	F44-V46 VanDerWaalsContact C-N 3.3Å; F44-V46 PolarHBondContact O-N 3.07Å; V46-R84 VanDerWaalsContact CG1-CZ 3.44Å
47	S	82	Confident	69	Low	64 Å²	64	72.4 Å²	72.4	45%	0.448	48%	0.477	S	S	.	.	P	Polyproline II helix	trans	-54.1	143	-178	48.9	0	0	0	0	110.8	P45 L49 R84	P45-S47 PolarHBondContact O-N 2.84Å; S47-L49 PolarHBondContact O-N 3.09Å; S47-R84 PolarHBondContact O-NE 3.18Å; S47-R84 PolarHBondContact O-NH2 3.15Å
48	P	90.6	Very high	71.4	Confident	76 Å²	76	69.9 Å²	69.9	49%	0.494	46%	0.461	S	S	.	.	P	Polyproline II helix	trans	-57.3	139.8	-171.7	22.9	-34	0	0	0	110.9	L50 N83	P48-L50 HydrophobicContact CB-CD2 4.43Å; P48-L50 PolarHBondContact O-N 3.47Å; P48-N83 PolarHBondContact O-ND2 2.94Å; P48-N83 VanDerWaalsContact O-ND2 3.14Å
49	L	95.4	Very high	74.2	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	44%	0.436	C	S	.	.			trans	-76.6	112.3	178.1	-177.5	57.4	0	0	0	109.2	S47 I86 V92 L201	S47-L49 PolarHBondContact O-N 3.09Å; L49-I86 HydrophobicContact CD1-CD1 3.45Å; L49-I86 VanDerWaalsContact CD1-CD1 3.45Å; L49-I86 HydrophobicContact CD2-CD1 4.06Å; L49-I86 HydrophobicContact CG-CD1 4.43Å; L49-V92 HydrophobicContact CD2-CB 4.33Å; L49-V92 HydrophobicContact CD2-CG1 4.11Å; L49-V92 HydrophobicContact CD2-CG2 4.14Å; L49-L201 HydrophobicContact CD2-CD2 4.15Å; L49-L201 HydrophobicContact CG-CD1 4.43Å; L49-L201 HydrophobicContact CG-CD2 4.2Å
50	L	97.3	Very high	76.8	Confident	30 Å²	30	63.1 Å²	63.1	16%	0.157	40%	0.398	C	S	.	.			trans	-124.2	168.4	-178.5	-53.2	176.8	0	0	0	109.7	P48 Q66 K67 S82 N83	P48-L50 HydrophobicContact CB-CD2 4.43Å; P48-L50 PolarHBondContact O-N 3.47Å; L50-Q66 HydrophobicContact CB-CB 4.04Å; L50-Q66 HydrophobicContact CD1-CB 4.33Å; L50-K67 HydrophobicContact CD2-CD 4.35Å; L50-K67 HydrophobicContact CD2-CG 3.43Å; L50-K67 VanDerWaalsContact CD2-CG 3.43Å; L50-S82 CarbonylContact O-C 3.53Å; L50-S82 WeakPolarHBondContact O-CA 3.36Å; L50-N83 HydrophobicContact CB-CB 4.14Å; L50-N83 PolarHBondContact N-OD1 3.42Å; L50-N83 PolarHBondContact O-N 3.03Å; L50-N83 PolarHBondContact O-OD1 2.74Å; L50-N83 VanDerWaalsContact O-OD1 3.1Å
51	F	98.3	Very high	79.6	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	38%	0.381	C	S	.	.	B	Isolated β-bridge	trans	-74.4	145.5	167.2	-68.2	-72.7	0	0	0	110.4	M62 Q66 K67 V69 T80 F81 L94 I190 V199 L201	F51-M62 HydrophobicContact CB-CE 3.42Å; F51-M62 VanDerWaalsContact CB-CE 3.42Å; F51-M62 HydrophobicContact CB-SD 4.04Å; F51-M62 HydrophobicContact CG-CE 4.38Å; F51-Q66 WeakPolarHBondContact CD2-O 3.39Å; F51-Q66 PolarHBondContact N-O 3.07Å; F51-K67 WeakPolarHBondContact CE2-O 3.38Å; F51-V69 HydrophobicContact CB-CG1 4.24Å; F51-V69 HydrophobicContact CD1-CG1 4.35Å; F51-V69 HydrophobicContact CD1-CG2 4.42Å; F51-V69 HydrophobicContact CD2-CB 4.43Å; F51-V69 HydrophobicContact CD2-CG1 3.63Å; F51-V69 HydrophobicContact CD2-CG2 4.16Å; F51-V69 HydrophobicContact CE1-CG2 3.98Å; F51-V69 HydrophobicContact CE2-CB 4.34Å; F51-V69 HydrophobicContact CE2-CG1 4.02Å; F51-V69 HydrophobicContact CE2-CG2 3.68Å; F51-V69 HydrophobicContact CG-CG1 3.81Å; F51-V69 HydrophobicContact CZ-CG2 3.59Å; F51-T80 WeakPolarHBondContact CD1-OG1 3.06Å; F51-T80 WeakPolarHBondContact CE1-OG1 3.45Å; F51-F81 CarbonylContact C-O 3.49Å; F51-F81 WeakPolarHBondContact CA-O 3.23Å; F51-L94 HydrophobicContact CE1-CD2 4.43Å; F51-L94 HydrophobicContact CZ-CD2 3.94Å; F51-I190 HydrophobicContact CE1-CD1 4.22Å; F51-I190 HydrophobicContact CE1-CG1 4.44Å; F51-V199 HydrophobicContact CZ-CG2 3.88Å; F51-L201 HydrophobicContact CD1-CD1 3.83Å; F51-L201 HydrophobicContact CD2-CD1 3.71Å; F51-L201 HydrophobicContact CD2-CG 4.21Å; F51-L201 HydrophobicContact CE1-CD1 3.85Å; F51-L201 HydrophobicContact CE1-CG 4.08Å; F51-L201 HydrophobicContact CE2-CB 4.19Å; F51-L201 HydrophobicContact CE2-CD1 3.72Å; F51-L201 HydrophobicContact CE2-CG 3.71Å; F51-L201 HydrophobicContact CG-CD1 3.76Å; F51-L201 HydrophobicContact CZ-CD1 3.79Å; F51-L201 HydrophobicContact CZ-CG 3.62Å
52	H	97.8	Very high	82.2	Confident	6 Å²	6	58.3 Å²	58.3	3%	0.028	35%	0.35	C	S	.	.			trans	-68.4	126.4	177.6	-173	-89.7	0	0	0	110.6	N54 T55 F81 P116 S117	H52-N54 PolarHBondContact O-N 3.42Å; H52-T55 PolarHBondContact CE1-OG1 2.72Å; H52-T55 WeakPolarHBondContact ND1-CB 3.36Å; H52-T55 PolarHBondContact ND1-N 2.92Å; H52-T55 PolarHBondContact ND1-OG1 3.03Å; H52-F81 HydrophobicContact CB-CB 4.27Å; H52-F81 PolarHBondContact N-O 2.79Å; H52-P116 HydrophobicContact CB-CB 4.43Å; H52-S117 PolarHBondContact NE2-N 3.17Å; H52-S117 PolarHBondContact NE2-OG 2.84Å
53	P	95.3	Very high	85.2	Confident	43 Å²	43	58.6 Å²	58.6	28%	0.279	34%	0.339	S	S	.	.	S	Bend	trans	-67.9	-39	-165.9	22.6	-33.6	0	0	0	114.1	K56	P53-K56 PolarHBondContact O-NZ 3.21Å
54	N	94.1	Very high	87.6	Confident	112 Å²	112	61 Å²	61	60%	0.599	34%	0.344	S	S	*	.	S	Bend	trans	-93.9	-62.2	-167.9	-60.7	-21.1	0	0	0	110.9	H52 K56	H52-N54 PolarHBondContact O-N 3.42Å; N54-K56 PolarHBondContact O-N 2.95Å; N54-K56 PolarHBondContact O-NZ 3.18Å
55	T	96.8	Very high	90.1	Very high	4 Å²	4	55.3 Å²	55.3	3%	0.025	33%	0.331	C	S	.	.	S	Bend	trans	-70.5	94.2	-178.9	-44.4	0	0	0	0	112.4	H52 F81 P116 I119 L124	H52-T55 PolarHBondContact CE1-OG1 2.72Å; H52-T55 WeakPolarHBondContact ND1-CB 3.36Å; H52-T55 PolarHBondContact ND1-N 2.92Å; H52-T55 PolarHBondContact ND1-OG1 3.03Å; T55-F81 HydrophobicContact CG2-CD2 3.97Å; T55-F81 HydrophobicContact CG2-CE2 3.88Å; T55-P116 WeakPolarHBondContact CB-O 3.13Å; T55-P116 HydrophobicContact CG2-CB 4.41Å; T55-P116 PolarHBondContact OG1-O 3.25Å; T55-I119 HydrophobicContact CG2-CB 3.76Å; T55-I119 HydrophobicContact CG2-CG2 3.94Å; T55-I119 PolarHBondContact OG1-O 3.12Å; T55-L124 HydrophobicContact CG2-CD1 4.25Å
56	K	96.4	Very high	92.6	Very high	58 Å²	58	52.2 Å²	52.2	25%	0.252	31%	0.305	S	S	.	.			trans	-154.1	155.4	176.9	64.5	-164.4	178.9	-67.9	0	110.1	P53 N54 I60 M62 I79 T80 L124	P53-K56 PolarHBondContact O-NZ 3.21Å; N54-K56 PolarHBondContact O-N 2.95Å; N54-K56 PolarHBondContact O-NZ 3.18Å; K56-I60 HydrophobicContact CB-CB 4.28Å; K56-I60 HydrophobicContact CB-CG2 4.38Å; K56-I60 HydrophobicContact CD-CB 4.28Å; K56-I60 HydrophobicContact CD-CG2 3.95Å; K56-I60 HydrophobicContact CG-CB 4.27Å; K56-I60 HydrophobicContact CG-CG2 4.41Å; K56-M62 HydrophobicContact CD-CE 3.84Å; K56-I79 CarbonylContact C-O 3.59Å; K56-I79 WeakPolarHBondContact CA-O 3.29Å; K56-T80 HydrophobicContact CB-CG2 4.29Å; K56-L124 VanDerWaalsContact C-CD1 3.47Å
57	G	91.3	Very high	93.9	Very high	6 Å²	6	50.4 Å²	50.4	6%	0.062	29%	0.29	C	S	.	.			trans	-64.3	151.5	177.9	0	0	0	0	0	112.8	Q59 I60 N77 I79	G57-Q59 PolarHBondContact O-N 3.46Å; G57-I60 WeakPolarHBondContact O-CB 2.96Å; G57-I60 PolarHBondContact O-N 3.23Å; G57-N77 CarbonylContact C-O 3.56Å; G57-N77 VanDerWaalsContact CA-O 3.26Å; G57-N77 WeakPolarHBondContact CA-O 3.36Å; G57-I79 PolarHBondContact N-O 3.03Å
58	S	88.2	Confident	94.7	Very high	85 Å²	85	48.6 Å²	48.6	59%	0.594	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-11.2	-171.7	58.9	0	0	0	0	115.7	N77	S58-N77 PolarHBondContact N-O 3.01Å
59	Q	89	Confident	95	Very high	37 Å²	37	45 Å²	45	17%	0.173	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99	4.1	175	-61.8	-60.1	-45.3	0	0	113.5	G57 R71 Q72 A73 N77	G57-Q59 PolarHBondContact O-N 3.46Å; Q59-R71 HydrophobicContact CB-CG 3.86Å; Q59-R71 CarbonylContact O-C 3.54Å; Q59-R71 VanDerWaalsContact O-CA 3.28Å; Q59-R71 WeakPolarHBondContact O-CA 3.47Å; Q59-Q72 PolarHBondContact O-N 3.37Å; Q59-A73 PolarHBondContact OE1-O 3.44Å; Q59-N77 HydrophobicContact CB-CB 4.38Å; Q59-N77 HydrophobicContact CG-CB 3.8Å; Q59-N77 PolarHBondContact N-O 3.05Å; Q59-N77 VanDerWaalsContact N-O 3.08Å
60	I	95.2	Very high	95	Very high	12 Å²	12	50.6 Å²	50.6	6%	0.062	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	114.6	-179.4	-62.1	-64.4	0	0	0	111.9	K56 G57 V69 A78 T80 V192	K56-I60 HydrophobicContact CB-CB 4.28Å; K56-I60 HydrophobicContact CB-CG2 4.38Å; K56-I60 HydrophobicContact CD-CB 4.28Å; K56-I60 HydrophobicContact CD-CG2 3.95Å; K56-I60 HydrophobicContact CG-CB 4.27Å; K56-I60 HydrophobicContact CG-CG2 4.41Å; G57-I60 WeakPolarHBondContact O-CB 2.96Å; G57-I60 PolarHBondContact O-N 3.23Å; I60-V69 HydrophobicContact CG2-CB 3.86Å; I60-V69 HydrophobicContact CG2-CG1 3.7Å; I60-A78 HydrophobicContact CD1-CB 3.85Å; I60-A78 HydrophobicContact CG1-CB 4.46Å; I60-T80 HydrophobicContact CB-CG2 4.37Å; I60-T80 HydrophobicContact CD1-CG2 3.89Å; I60-T80 HydrophobicContact CG1-CG2 3.7Å; I60-T80 HydrophobicContact CG2-CG2 3.93Å; I60-V192 HydrophobicContact CD1-CB 4.3Å; I60-V192 HydrophobicContact CD1-CG2 4.34Å
61	V	92.9	Very high	94.7	Very high	73 Å²	73	49.2 Å²	49.2	44%	0.442	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	136.1	160	176.7	0	0	0	0	108.4	V69 K70 Q72	V61-V69 CarbonylContact O-C 3.56Å; V61-V69 WeakPolarHBondContact O-CA 3.28Å; V61-K70 PolarHBondContact N-O 2.89Å; V61-K70 PolarHBondContact O-N 2.78Å; V61-Q72 HydrophobicContact CG2-CB 3.94Å; V61-Q72 VanDerWaalsContact CG2-OE1 3.27Å
62	M	95.6	Very high	93.6	Very high	39 Å²	39	54 Å²	54	19%	0.192	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	146.5	-176.6	-171.8	178.2	-64.8	0	0	109.9	F51 K56 Q66 T68 V69	F51-M62 HydrophobicContact CB-CE 3.42Å; F51-M62 VanDerWaalsContact CB-CE 3.42Å; F51-M62 HydrophobicContact CB-SD 4.04Å; F51-M62 HydrophobicContact CG-CE 4.38Å; K56-M62 HydrophobicContact CD-CE 3.84Å; M62-Q66 HydrophobicContact SD-CB 3.81Å; M62-Q66 HydrophobicContact SD-CG 3.78Å; M62-T68 WeakPolarHBondContact CA-O 3.44Å; M62-V69 HydrophobicContact CB-CG1 4.06Å; M62-V69 HydrophobicContact CE-CG1 3.73Å; M62-V69 HydrophobicContact CG-CG1 3.87Å
63	D	94.6	Very high	91.7	Very high	56 Å²	56	55.6 Å²	55.6	30%	0.299	31%	0.307	S	S	.	.			trans	-74.1	161	172.5	66.2	-0.4	0	0	0	112.6	A65 Q66 K67 T68	D63-A65 PolarHBondContact O-N 2.83Å; D63-Q66 PolarHBondContact O-N 3.22Å; D63-Q66 VanDerWaalsContact OD1-CA 3.32Å; D63-Q66 WeakPolarHBondContact OD1-CA 3.45Å; D63-Q66 PolarHBondContact OD1-N 3.47Å; D63-K67 PolarHBondContact OD1-N 3.18Å; D63-T68 PolarHBondContact N-O 3.03Å; D63-T68 PolarHBondContact OD1-N 3.05Å; D63-T68 WeakPolarHBondContact OD2-CB 3.19Å; D63-T68 PolarHBondContact OD2-N 3.07Å; D63-T68 VanDerWaalsContact OD2-N 3.13Å; D63-T68 PolarHBondContact OD2-OG1 2.76Å
64	L	93.3	Very high	90.2	Very high	182 Å²	182	55.9 Å²	55.9	95%	0.953	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-27.3	179.4	-63.8	175.4	0	0	0	112.7	Q66	L64-Q66 VanDerWaalsContact C-N 3.3Å
65	A	94.8	Very high	88.8	Confident	62 Å²	62	53 Å²	53	51%	0.512	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-7.5	177.1	0	0	0	0	0	113.8	D63 K67	D63-A65 PolarHBondContact O-N 2.83Å; A65-K67 PolarHBondContact O-N 2.86Å; A65-K67 VanDerWaalsContact O-N 3.09Å
66	Q	96.9	Very high	87.6	Confident	62 Å²	62	52.9 Å²	52.9	29%	0.29	29%	0.291	S	S	.	.	S	Bend	trans	56.3	20	-175.1	-52.3	173.6	7.6	0	0	113.8	L50 F51 M62 D63 L64	L50-Q66 HydrophobicContact CB-CB 4.04Å; L50-Q66 HydrophobicContact CD1-CB 4.33Å; F51-Q66 WeakPolarHBondContact CD2-O 3.39Å; F51-Q66 PolarHBondContact N-O 3.07Å; M62-Q66 HydrophobicContact SD-CB 3.81Å; M62-Q66 HydrophobicContact SD-CG 3.78Å; D63-Q66 PolarHBondContact O-N 3.22Å; D63-Q66 VanDerWaalsContact OD1-CA 3.32Å; D63-Q66 WeakPolarHBondContact OD1-CA 3.45Å; D63-Q66 PolarHBondContact OD1-N 3.47Å; L64-Q66 VanDerWaalsContact C-N 3.3Å
67	K	96.9	Very high	86.8	Confident	51 Å²	51	52.4 Å²	52.4	22%	0.222	29%	0.291	C	S	.	.	S	Bend	trans	-95.1	-20.7	176.2	-84.7	-157.9	167.2	-169.9	0	112.7	L50 F51 D63 A65 Q200 L201 D203	L50-K67 HydrophobicContact CD2-CD 4.35Å; L50-K67 HydrophobicContact CD2-CG 3.43Å; L50-K67 VanDerWaalsContact CD2-CG 3.43Å; F51-K67 WeakPolarHBondContact CE2-O 3.38Å; D63-K67 PolarHBondContact OD1-N 3.18Å; A65-K67 PolarHBondContact O-N 2.86Å; A65-K67 VanDerWaalsContact O-N 3.09Å; K67-Q200 CarbonylContact O-C 3.56Å; K67-Q200 VanDerWaalsContact O-CA 3.26Å; K67-Q200 WeakPolarHBondContact O-CA 3.47Å; K67-L201 PolarHBondContact O-N 2.81Å; K67-D203 IonicContact NZ-OD1 2.76Å; K67-D203 PolarHBondContact NZ-OD1 3.38Å; K67-D203 IonicContact NZ-OD2 3.67Å
68	T	97.8	Very high	86.9	Confident	26 Å²	26	52.1 Å²	52.1	16%	0.16	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	134.3	-176.1	-41.3	0	0	0	0	110.8	M62 D63 Q200	M62-T68 WeakPolarHBondContact CA-O 3.44Å; D63-T68 PolarHBondContact N-O 3.03Å; D63-T68 PolarHBondContact OD1-N 3.05Å; D63-T68 WeakPolarHBondContact OD2-CB 3.19Å; D63-T68 PolarHBondContact OD2-N 3.07Å; D63-T68 VanDerWaalsContact OD2-N 3.13Å; D63-T68 PolarHBondContact OD2-OG1 2.76Å; T68-Q200 HydrophobicContact CG2-CB 4.27Å
69	V	97.9	Very high	87.4	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	144.3	170.4	-68.4	0	0	0	0	111.1	F51 I60 V61 M62 T80 V192 G198 V199	F51-V69 HydrophobicContact CB-CG1 4.24Å; F51-V69 HydrophobicContact CD1-CG1 4.35Å; F51-V69 HydrophobicContact CD1-CG2 4.42Å; F51-V69 HydrophobicContact CD2-CB 4.43Å; F51-V69 HydrophobicContact CD2-CG1 3.63Å; F51-V69 HydrophobicContact CD2-CG2 4.16Å; F51-V69 HydrophobicContact CE1-CG2 3.98Å; F51-V69 HydrophobicContact CE2-CB 4.34Å; F51-V69 HydrophobicContact CE2-CG1 4.02Å; F51-V69 HydrophobicContact CE2-CG2 3.68Å; F51-V69 HydrophobicContact CG-CG1 3.81Å; F51-V69 HydrophobicContact CZ-CG2 3.59Å; I60-V69 HydrophobicContact CG2-CB 3.86Å; I60-V69 HydrophobicContact CG2-CG1 3.7Å; V61-V69 CarbonylContact O-C 3.56Å; V61-V69 WeakPolarHBondContact O-CA 3.28Å; M62-V69 HydrophobicContact CB-CG1 4.06Å; M62-V69 HydrophobicContact CE-CG1 3.73Å; M62-V69 HydrophobicContact CG-CG1 3.87Å; V69-T80 HydrophobicContact CG1-CG2 4.4Å; V69-T80 HydrophobicContact CG2-CG2 4.43Å; V69-V192 HydrophobicContact CG2-CG2 4.09Å; V69-G198 WeakPolarHBondContact O-CA 3.45Å; V69-V199 HydrophobicContact CG2-CG2 3.49Å; V69-V199 VanDerWaalsContact CG2-CG2 3.49Å; V69-V199 PolarHBondContact N-O 2.95Å; V69-V199 PolarHBondContact O-N 3.49Å
70	K	94.1	Very high	87.9	Confident	119 Å²	119	46.3 Å²	46.3	52%	0.517	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	138.5	173.7	-66	179.7	-178.2	176	0	109.5	V61 R197	V61-K70 PolarHBondContact N-O 2.89Å; V61-K70 PolarHBondContact O-N 2.78Å; K70-R197 CarbonylContact C-O 3.58Å; K70-R197 WeakPolarHBondContact CA-O 3.21Å
71	R	90.7	Very high	88	Confident	1 Å²	1	45.8 Å²	45.8	0%	0.004	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	115.8	167.1	-168.9	178.6	66.9	-122.1	-2	108.5	Q59 A73 S74 A78 V192 Y193 G194 T196 R197	Q59-R71 HydrophobicContact CB-CG 3.86Å; Q59-R71 CarbonylContact O-C 3.54Å; Q59-R71 VanDerWaalsContact O-CA 3.28Å; Q59-R71 WeakPolarHBondContact O-CA 3.47Å; R71-A73 WeakPolarHBondContact CG-O 3.47Å; R71-S74 PolarHBondContact NE-O 3.12Å; R71-S74 PolarHBondContact NH2-O 3.2Å; R71-A78 HydrophobicContact CB-CB 4.49Å; R71-A78 HydrophobicContact CG-CB 4.04Å; R71-V192 HydrophobicContact CB-CG1 4.48Å; R71-V192 PolarHBondContact NH1-O 3.08Å; R71-Y193 VanDerWaalsContact NH1-C 3.29Å; R71-G194 PolarHBondContact NH1-O 2.78Å; R71-G194 PolarHBondContact NH2-O 3.3Å; R71-T196 PolarHBondContact NH1-O 3.16Å; R71-R197 HydrophobicContact CB-CG 4.4Å; R71-R197 PolarHBondContact N-O 2.88Å; R71-R197 VanDerWaalsContact O-CG 3.32Å; R71-R197 WeakPolarHBondContact O-CG 3.26Å; R71-R197 PolarHBondContact O-NE 2.78Å
72	Q	75.7	Confident	88.3	Confident	99 Å²	99	42.3 Å²	42.3	46%	0.463	23%	0.228	S	C	.	.			trans	-67.7	-52.3	-175.5	69.3	-171.9	16.6	0	0	111.4	Q59 V61 R197	Q59-Q72 PolarHBondContact O-N 3.37Å; V61-Q72 HydrophobicContact CG2-CB 3.94Å; V61-Q72 VanDerWaalsContact CG2-OE1 3.27Å; Q72-R197 PolarHBondContact O-NH2 2.77Å
73	A	58.8	Low	88.3	Confident	41 Å²	41	42.6 Å²	42.6	34%	0.339	23%	0.23	S	C	.	.	S	Bend	trans	-143.1	175.6	-178.3	0	0	0	0	0	111.5	Q59 R71	Q59-A73 PolarHBondContact OE1-O 3.44Å; R71-A73 WeakPolarHBondContact CG-O 3.47Å
74	S	64.2	Low	88.4	Confident	49 Å²	49	41.2 Å²	41.2	34%	0.343	22%	0.221	S	C	.	.	S	Bend	trans	59.1	-169.6	-174.1	-159.2	0	0	0	0	113.9	R71 C76	R71-S74 PolarHBondContact NE-O 3.12Å; R71-S74 PolarHBondContact NH2-O 3.2Å; S74-C76 PolarHBondContact OG-SG 2.82Å; S74-C76 VanDerWaalsContact OG-SG 3.37Å
75	F	63.7	Low	88.6	Confident	52 Å²	52	35.1 Å²	35.1	23%	0.228	19%	0.192	C	C	.	.	S	Bend	trans	-114.6	3.2	179.2	65.3	-89.7	0	0	0	113.7	W103 Y127 Y193 G194	F75-W103 HydrophobicContact CB-CB 4.38Å; F75-W103 HydrophobicContact CB-CD2 3.56Å; F75-W103 HydrophobicContact CB-CE3 3.81Å; F75-W103 HydrophobicContact CB-CG 3.8Å; F75-W103 HydrophobicContact CB-CZ2 4.44Å; F75-W103 HydrophobicContact CB-CZ3 4.35Å; F75-W103 HydrophobicContact CD1-CE3 4Å; F75-W103 HydrophobicContact CD1-CH2 4.1Å; F75-W103 AromaticContact CD1-CZ3 3.77Å; F75-W103 HydrophobicContact CD1-CZ3 3.77Å; F75-W103 HydrophobicContact CE1-CZ3 4.48Å; F75-W103 HydrophobicContact CG-CD2 4.37Å; F75-W103 HydrophobicContact CG-CE3 4.11Å; F75-W103 HydrophobicContact CG-CZ3 4.35Å; F75-Y127 HydrophobicContact CD2-CE1 4.48Å; F75-Y127 AromaticContact CE2-CE1 3.87Å; F75-Y127 HydrophobicContact CE2-CE1 3.87Å; F75-Y193 AromaticContact CD2-CE2 3.7Å; F75-Y193 HydrophobicContact CD2-CE2 3.7Å; F75-Y193 AromaticContact CD2-CZ 3.91Å; F75-Y193 HydrophobicContact CE2-CE2 4.18Å; F75-Y193 WeakPolarHBondContact O-CD2 3.39Å; F75-Y193 WeakPolarHBondContact O-CE2 3.48Å; F75-G194 PolarHBondContact O-N 2.83Å; F75-G194 VanDerWaalsContact O-N 3.14Å
76	C	71.7	Confident	88.7	Confident	1 Å²	1	32.7 Å²	32.7	1%	0.007	17%	0.171	C	C	.	.			trans	-152.8	-167.5	-162.6	65.5	0	0	0	0	111.9	S74 A78 K126 Y127 Y193	S74-C76 PolarHBondContact OG-SG 2.82Å; S74-C76 VanDerWaalsContact OG-SG 3.37Å; C76-A78 PolarHBondContact O-N 2.83Å; C76-K126 HydrophobicContact CB-CG 3.94Å; C76-K126 WeakPolarHBondContact SG-CE 3.11Å; C76-Y127 HydrophobicContact CB-CD1 3.94Å; C76-Y127 HydrophobicContact CB-CE1 3.52Å; C76-Y193 HydrophobicContact CB-CE2 4.41Å
77	N	80.4	Confident	88.6	Confident	47 Å²	47	32.2 Å²	32.2	25%	0.251	18%	0.177	S	C	.	.			trans	56	39.1	-176.1	-67.3	-35.5	0	0	0	112.1	G57 S58 Q59 K126	G57-N77 CarbonylContact C-O 3.56Å; G57-N77 VanDerWaalsContact CA-O 3.26Å; G57-N77 WeakPolarHBondContact CA-O 3.36Å; S58-N77 PolarHBondContact N-O 3.01Å; Q59-N77 HydrophobicContact CB-CB 4.38Å; Q59-N77 HydrophobicContact CG-CB 3.8Å; Q59-N77 PolarHBondContact N-O 3.05Å; Q59-N77 VanDerWaalsContact N-O 3.08Å; N77-K126 PolarHBondContact N-O 2.81Å; N77-K126 VanDerWaalsContact N-O 3.08Å; N77-K126 VanDerWaalsContact OD1-CA 3.31Å; N77-K126 WeakPolarHBondContact OD1-CA 3.33Å; N77-K126 WeakPolarHBondContact OD1-CG 3.41Å
78	A	93.6	Very high	88.5	Confident	0 Å²	0	33 Å²	33	0%	0	18%	0.183	C	C	.	.			trans	-130.5	29.3	-162.3	0	0	0	0	0	113.3	I60 R71 C76 V192	I60-A78 HydrophobicContact CD1-CB 3.85Å; I60-A78 HydrophobicContact CG1-CB 4.46Å; R71-A78 HydrophobicContact CB-CB 4.49Å; R71-A78 HydrophobicContact CG-CB 4.04Å; C76-A78 PolarHBondContact O-N 2.83Å; A78-V192 HydrophobicContact CB-CB 4.14Å; A78-V192 WeakPolarHBondContact CB-O 3.36Å; A78-V192 PolarHBondContact O-N 3.16Å
79	I	97.8	Very high	88.4	Confident	1 Å²	1	33.7 Å²	33.7	1%	0.005	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	133.1	179.2	-56.2	166.9	0	0	0	109.6	K56 G57 F81 P125 A128 L132 I190 D191	K56-I79 CarbonylContact C-O 3.59Å; K56-I79 WeakPolarHBondContact CA-O 3.29Å; G57-I79 PolarHBondContact N-O 3.03Å; I79-F81 HydrophobicContact CG2-CE1 4.39Å; I79-F81 HydrophobicContact CG2-CE2 3.94Å; I79-F81 HydrophobicContact CG2-CZ 3.74Å; I79-P125 HydrophobicContact CD1-CG 4.37Å; I79-P125 VanDerWaalsContact CD1-O 3.31Å; I79-P125 WeakPolarHBondContact CD1-O 3.13Å; I79-A128 HydrophobicContact CG1-CB 4.47Å; I79-L132 HydrophobicContact CD1-CD1 3.8Å; I79-L132 HydrophobicContact CD1-CG 4.22Å; I79-L132 HydrophobicContact CG2-CD1 3.91Å; I79-I190 CarbonylContact C-O 3.58Å; I79-D191 HydrophobicContact CG1-CB 4.26Å
80	T	98.5	Very high	88.3	Confident	0 Å²	0	34 Å²	34	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	163.4	173.2	70.2	0	0	0	0	110.6	F51 K56 I60 V69 I190	F51-T80 WeakPolarHBondContact CD1-OG1 3.06Å; F51-T80 WeakPolarHBondContact CE1-OG1 3.45Å; K56-T80 HydrophobicContact CB-CG2 4.29Å; I60-T80 HydrophobicContact CB-CG2 4.37Å; I60-T80 HydrophobicContact CD1-CG2 3.89Å; I60-T80 HydrophobicContact CG1-CG2 3.7Å; I60-T80 HydrophobicContact CG2-CG2 3.93Å; V69-T80 HydrophobicContact CG1-CG2 4.4Å; V69-T80 HydrophobicContact CG2-CG2 4.43Å; T80-I190 PolarHBondContact N-O 2.76Å; T80-I190 PolarHBondContact O-N 3.17Å; T80-I190 PolarHBondContact OG1-O 3.06Å
81	F	98.6	Very high	88.4	Confident	0 Å²	0	29 Å²	29	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	164.8	179.4	-55.5	-85.7	0	0	0	110.9	F51 H52 T55 I79 T112 P116 I119 L124 L132 F138 A188 L189	F51-F81 CarbonylContact C-O 3.49Å; F51-F81 WeakPolarHBondContact CA-O 3.23Å; H52-F81 HydrophobicContact CB-CB 4.27Å; H52-F81 PolarHBondContact N-O 2.79Å; T55-F81 HydrophobicContact CG2-CD2 3.97Å; T55-F81 HydrophobicContact CG2-CE2 3.88Å; I79-F81 HydrophobicContact CG2-CE1 4.39Å; I79-F81 HydrophobicContact CG2-CE2 3.94Å; I79-F81 HydrophobicContact CG2-CZ 3.74Å; F81-T112 HydrophobicContact CD1-CG2 3.79Å; F81-T112 HydrophobicContact CE1-CG2 3.91Å; F81-P116 HydrophobicContact CB-CB 3.87Å; F81-P116 HydrophobicContact CB-CG 3.55Å; F81-P116 HydrophobicContact CD1-CG 4.28Å; F81-P116 HydrophobicContact CD2-CB 4.21Å; F81-P116 HydrophobicContact CG-CB 4.05Å; F81-P116 HydrophobicContact CG-CG 3.88Å; F81-I119 HydrophobicContact CZ-CD1 4.36Å; F81-L124 HydrophobicContact CE2-CD1 4.43Å; F81-L124 HydrophobicContact CE2-CD2 3.86Å; F81-L124 HydrophobicContact CZ-CD2 4.04Å; F81-L132 HydrophobicContact CZ-CD1 4.21Å; F81-F138 HydrophobicContact CE1-CE1 4.28Å; F81-F138 HydrophobicContact CZ-CE1 4.49Å; F81-A188 WeakPolarHBondContact CA-O 3.38Å; F81-L189 HydrophobicContact CD1-CB 4.34Å; F81-L189 HydrophobicContact CD1-CG 4.28Å; F81-L189 HydrophobicContact CE1-CB 4.36Å; F81-L189 HydrophobicContact CE1-CD1 4.07Å; F81-L189 HydrophobicContact CE1-CG 3.86Å
82	S	98.3	Very high	88.7	Confident	0 Å²	0	29 Å²	29	0%	0	16%	0.163	C	C	.	.	B	Isolated β-bridge	trans	-70.8	148.7	168	54.6	0	0	0	0	112.1	L50 R84 A188	L50-S82 CarbonylContact O-C 3.53Å; L50-S82 WeakPolarHBondContact O-CA 3.36Å; S82-R84 WeakPolarHBondContact CB-O 3.37Å; S82-R84 PolarHBondContact O-N 3.41Å; S82-R84 PolarHBondContact OG-O 3.44Å; S82-A188 PolarHBondContact N-O 3.37Å; S82-A188 VanDerWaalsContact N-O 3.17Å; S82-A188 PolarHBondContact OG-N 2.77Å
83	N	97.1	Very high	89.7	Confident	46 Å²	46	27 Å²	27	25%	0.246	15%	0.152	C	C	.	.	S	Bend	trans	-63.5	-27.4	174.5	66.2	-30.5	0	0	0	113.4	P48 L50	P48-N83 PolarHBondContact O-ND2 2.94Å; P48-N83 VanDerWaalsContact O-ND2 3.14Å; L50-N83 HydrophobicContact CB-CB 4.14Å; L50-N83 PolarHBondContact N-OD1 3.42Å; L50-N83 PolarHBondContact O-N 3.03Å; L50-N83 PolarHBondContact O-OD1 2.74Å; L50-N83 VanDerWaalsContact O-OD1 3.1Å
84	R	96.7	Very high	91.6	Very high	26 Å²	26	25.1 Å²	25.1	10%	0.098	14%	0.136	C	C	.	.	S	Bend	trans	-134.7	166.9	-179.4	64.9	154.5	171.9	84.5	1.6	112.5	V46 S47 S82 E90 W187 S204	V46-R84 VanDerWaalsContact CG1-CZ 3.44Å; S47-R84 PolarHBondContact O-NE 3.18Å; S47-R84 PolarHBondContact O-NH2 3.15Å; S82-R84 WeakPolarHBondContact CB-O 3.37Å; S82-R84 PolarHBondContact O-N 3.41Å; S82-R84 PolarHBondContact OG-O 3.44Å; R84-E90 IonicContact CZ-OE1 3.59Å; R84-E90 IonicContact CZ-OE2 3.9Å; R84-E90 VanDerWaalsContact NH1-CD 3.28Å; R84-E90 IonicContact NH1-OE1 3.15Å; R84-E90 PolarHBondContact NH1-OE1 2.71Å; R84-E90 IonicContact NH1-OE2 2.85Å; R84-E90 PolarHBondContact NH1-OE2 3.02Å; R84-E90 IonicContact NH2-OE1 3.8Å; R84-E90 PolarHBondContact NH2-OE1 3.46Å; R84-E90 IonicContact NH2-OE2 2.9Å; R84-W187 VanDerWaalsContact O-CD1 3.25Å; R84-S204 PolarHBondContact NH2-OG 3.4Å
85	P	97.4	Very high	93.2	Very high	55 Å²	55	26.7 Å²	26.7	36%	0.357	14%	0.136	S	C	.	.	P	Polyproline II helix	trans	-57.7	148.5	165.4	-22.5	32.9	0	0	0	112.6	P185 L186 W187	P85-P185 HydrophobicContact CB-CB 4.18Å; P85-P185 HydrophobicContact CG-CB 4.19Å; P85-L186 CarbonylContact C-O 3.53Å; P85-L186 VanDerWaalsContact CA-O 3.24Å; P85-L186 WeakPolarHBondContact CA-O 3.35Å; P85-W187 HydrophobicContact CG-CD2 4.36Å; P85-W187 HydrophobicContact CG-CH2 4.18Å; P85-W187 HydrophobicContact CG-CZ2 3.66Å
86	I	96.5	Very high	94.8	Very high	11 Å²	11	24.2 Å²	24.2	6%	0.056	13%	0.126	C	C	.	.	B	Isolated β-bridge	trans	-99.8	130.6	175.1	-50	-55.2	0	0	0	107.9	L49 E90 V92 F111 L186 A188	L49-I86 HydrophobicContact CD1-CD1 3.45Å; L49-I86 VanDerWaalsContact CD1-CD1 3.45Å; L49-I86 HydrophobicContact CD2-CD1 4.06Å; L49-I86 HydrophobicContact CG-CD1 4.43Å; I86-E90 HydrophobicContact CG2-CB 3.81Å; I86-E90 HydrophobicContact CG2-CG 4.15Å; I86-V92 HydrophobicContact CD1-CG2 3.91Å; I86-V92 HydrophobicContact CG1-CG2 3.98Å; I86-V92 HydrophobicContact CG2-CG2 3.95Å; I86-F111 HydrophobicContact CG2-CE1 4.39Å; I86-L186 PolarHBondContact N-O 3.24Å; I86-A188 HydrophobicContact CD1-CB 4.29Å; I86-A188 HydrophobicContact CG1-CB 4.08Å
87	A	95.1	Very high	95.9	Very high	51 Å²	51	26.1 Å²	26.1	42%	0.421	14%	0.137	S	C	.	.	P	Polyproline II helix	trans	-71.2	155.5	174.2	0	0	0	0	0	111.3	Y89 E90	A87-Y89 PolarHBondContact O-N 3.13Å; A87-E90 HydrophobicContact CB-CB 4.1Å; A87-E90 PolarHBondContact N-OE2 3.05Å; A87-E90 VanDerWaalsContact O-CB 3.26Å; A87-E90 WeakPolarHBondContact O-CB 3.32Å; A87-E90 PolarHBondContact O-N 3.08Å; A87-E90 VanDerWaalsContact O-N 3.08Å
88	L	94.4	Very high	96.2	Very high	67 Å²	67	27.9 Å²	27.9	35%	0.351	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	138.5	169.2	-60.1	178.9	0	0	0	109.2	E90 V158 K160 T182	L88-E90 PolarHBondContact O-N 3.29Å; L88-V158 HydrophobicContact CD2-CG1 3.96Å; L88-K160 HydrophobicContact CD1-CB 4.21Å; L88-T182 HydrophobicContact CD2-CG2 3.71Å
89	Y	95.3	Very high	95.8	Very high	41 Å²	41	30 Å²	30	16%	0.161	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.7	0.8	-174.4	-48	-76.1	0	0	0	116.4	A87 V158 D159 K160 V207 L212	A87-Y89 PolarHBondContact O-N 3.13Å; Y89-V158 PolarHBondContact N-O 2.82Å; Y89-D159 HydrophobicContact CD1-CB 4.25Å; Y89-D159 HydrophobicContact CE1-CB 3.49Å; Y89-D159 VanDerWaalsContact CE1-CB 3.49Å; Y89-K160 HydrophobicContact CE2-CB 4.35Å; Y89-K160 WeakPolarHBondContact OH-CD 3.45Å; Y89-K160 VanDerWaalsContact OH-CG 3.26Å; Y89-K160 WeakPolarHBondContact OH-CG 3.35Å; Y89-K160 PolarHBondContact OH-N 2.97Å; Y89-V207 WeakPolarHBondContact O-CG2 3.45Å; Y89-V207 PolarHBondContact O-N 3.04Å; Y89-L212 HydrophobicContact CD1-CD1 3.47Å; Y89-L212 VanDerWaalsContact CD1-CD1 3.47Å; Y89-L212 HydrophobicContact CE1-CD1 3.27Å
90	E	95.8	Very high	94.4	Very high	6 Å²	6	30.1 Å²	30.1	3%	0.028	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	125.3	170.6	-173.7	-170	158.9	0	0	110.4	R84 I86 A87 L88 W157 S204	R84-E90 IonicContact CZ-OE1 3.59Å; R84-E90 IonicContact CZ-OE2 3.9Å; R84-E90 VanDerWaalsContact NH1-CD 3.28Å; R84-E90 IonicContact NH1-OE1 3.15Å; R84-E90 PolarHBondContact NH1-OE1 2.71Å; R84-E90 IonicContact NH1-OE2 2.85Å; R84-E90 PolarHBondContact NH1-OE2 3.02Å; R84-E90 IonicContact NH2-OE1 3.8Å; R84-E90 PolarHBondContact NH2-OE1 3.46Å; R84-E90 IonicContact NH2-OE2 2.9Å; I86-E90 HydrophobicContact CG2-CB 3.81Å; I86-E90 HydrophobicContact CG2-CG 4.15Å; A87-E90 HydrophobicContact CB-CB 4.1Å; A87-E90 PolarHBondContact N-OE2 3.05Å; A87-E90 VanDerWaalsContact O-CB 3.26Å; A87-E90 WeakPolarHBondContact O-CB 3.32Å; A87-E90 PolarHBondContact O-N 3.08Å; A87-E90 VanDerWaalsContact O-N 3.08Å; L88-E90 PolarHBondContact O-N 3.29Å; E90-W157 WeakPolarHBondContact O-CB 3.36Å; E90-S204 WeakPolarHBondContact OE1-CB 3.2Å; E90-S204 PolarHBondContact OE1-OG 3.26Å
91	Q	95.5	Very high	92.5	Very high	15 Å²	15	34.1 Å²	34.1	7%	0.07	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	116.7	174.9	-61.7	-166	-3.4	0	0	110.9	R93 A155 W157 S204 E205 V207	Q91-R93 HydrophobicContact CB-CG 3.98Å; Q91-R93 PolarHBondContact O-N 3.28Å; Q91-A155 HydrophobicContact CB-CB 4.44Å; Q91-W157 HydrophobicContact CG-CD2 4.21Å; Q91-W157 HydrophobicContact CG-CE3 3.75Å; Q91-W157 HydrophobicContact CG-CZ3 4.32Å; Q91-S204 WeakPolarHBondContact O-CA 3.5Å; Q91-E205 WeakPolarHBondContact CB-O 3.46Å; Q91-E205 WeakPolarHBondContact CG-O 3.21Å; Q91-E205 PolarHBondContact N-O 3.19Å; Q91-V207 HydrophobicContact CG-CG2 3.5Å; Q91-V207 VanDerWaalsContact NE2-CG2 3.3Å
92	V	97.8	Very high	90.2	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.006	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	113.6	160.4	-177.2	0	0	0	0	107.1	L49 I86 A155 F156 A188 L201	L49-V92 HydrophobicContact CD2-CB 4.33Å; L49-V92 HydrophobicContact CD2-CG1 4.11Å; L49-V92 HydrophobicContact CD2-CG2 4.14Å; I86-V92 HydrophobicContact CD1-CG2 3.91Å; I86-V92 HydrophobicContact CG1-CG2 3.98Å; I86-V92 HydrophobicContact CG2-CG2 3.95Å; V92-A155 WeakPolarHBondContact O-CA 3.21Å; V92-F156 HydrophobicContact CB-CD1 3.92Å; V92-F156 HydrophobicContact CB-CD2 4.5Å; V92-F156 HydrophobicContact CB-CE1 3.52Å; V92-F156 HydrophobicContact CB-CE2 4.13Å; V92-F156 HydrophobicContact CB-CG 4.41Å; V92-F156 HydrophobicContact CB-CZ 3.65Å; V92-F156 HydrophobicContact CG1-CD1 4.21Å; V92-F156 HydrophobicContact CG1-CE1 3.37Å; V92-F156 HydrophobicContact CG1-CE2 4.48Å; V92-F156 HydrophobicContact CG1-CZ 3.55Å; V92-F156 HydrophobicContact CG2-CE1 4.45Å; V92-F156 HydrophobicContact CG2-CE2 4.26Å; V92-F156 HydrophobicContact CG2-CZ 4.1Å; V92-F156 PolarHBondContact N-O 3.22Å; V92-F156 WeakPolarHBondContact O-CD1 3.03Å; V92-F156 PolarHBondContact O-N 2.95Å; V92-A188 HydrophobicContact CG1-CB 4.13Å; V92-A188 HydrophobicContact CG2-CB 3.88Å; V92-L201 HydrophobicContact CG1-CD2 3.83Å
93	R	97.4	Very high	88.2	Confident	58 Å²	58	38.8 Å²	38.8	22%	0.219	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	122.7	-176.1	-67.5	175.2	71.6	175.3	12.8	110.4	Q91 I154 A155 L201 L202 E205	Q91-R93 HydrophobicContact CB-CG 3.98Å; Q91-R93 PolarHBondContact O-N 3.28Å; R93-I154 CarbonylContact C-O 3.53Å; R93-I154 WeakPolarHBondContact CA-O 3.19Å; R93-A155 HydrophobicContact CG-CB 4.02Å; R93-L201 WeakPolarHBondContact O-CA 3.47Å; R93-L202 HydrophobicContact CB-CB 3.93Å; R93-L202 PolarHBondContact O-N 2.74Å; R93-E205 IonicContact CZ-OE2 3.89Å; R93-E205 IonicContact NH1-OE2 3.75Å; R93-E205 PolarHBondContact NH1-OE2 3.33Å
94	L	97.4	Very high	86.2	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	122.1	-177.1	-67.2	167.9	0	0	0	110.2	F51 L107 L109 I153 I154 F156 I190 V199 Q200 L201	F51-L94 HydrophobicContact CE1-CD2 4.43Å; F51-L94 HydrophobicContact CZ-CD2 3.94Å; L94-L107 HydrophobicContact CD1-CD2 4.34Å; L94-L109 HydrophobicContact CD1-CD1 4.4Å; L94-L109 HydrophobicContact CD1-CD2 3.5Å; L94-I153 CarbonylContact O-C 3.57Å; L94-I153 WeakPolarHBondContact O-CA 3.44Å; L94-I154 PolarHBondContact N-O 2.92Å; L94-I154 PolarHBondContact O-N 2.95Å; L94-F156 HydrophobicContact CD1-CE1 3.81Å; L94-F156 HydrophobicContact CG-CE1 4.47Å; L94-I190 HydrophobicContact CD1-CG1 3.91Å; L94-I190 HydrophobicContact CD1-CG2 4.06Å; L94-I190 HydrophobicContact CD2-CG1 4.48Å; L94-V199 HydrophobicContact CD2-CG2 4.46Å; L94-Q200 CarbonylContact C-O 3.6Å; L94-Q200 WeakPolarHBondContact CA-O 3.45Å; L94-L201 HydrophobicContact CD2-CD2 3.57Å; L94-L201 HydrophobicContact CD2-CG 3.86Å; L94-L201 HydrophobicContact CG-CD2 4.36Å
95	K	97.9	Very high	84.6	Confident	82 Å²	82	40.3 Å²	40.3	36%	0.357	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	130.3	166	-174.3	176.2	-178.4	179	0	109.6	T97 N152 I153 V199 Q200 L202	K95-T97 PolarHBondContact O-N 2.69Å; K95-N152 CarbonylContact C-O 3.56Å; K95-N152 WeakPolarHBondContact CA-O 3.5Å; K95-I153 HydrophobicContact CB-CG1 4.38Å; K95-I153 HydrophobicContact CG-CG1 4.33Å; K95-V199 CarbonylContact O-C 3.58Å; K95-V199 VanDerWaalsContact O-CA 3.27Å; K95-V199 WeakPolarHBondContact O-CA 3.28Å; K95-Q200 HydrophobicContact CB-CB 4.49Å; K95-Q200 PolarHBondContact N-O 2.8Å; K95-Q200 PolarHBondContact O-N 3.34Å; K95-L202 HydrophobicContact CB-CD1 4.24Å; K95-L202 HydrophobicContact CB-CD2 4.13Å; K95-L202 HydrophobicContact CB-CG 4.25Å
96	I	96.8	Very high	83.7	Confident	1 Å²	1	37.8 Å²	37.8	1%	0.005	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	117.5	169.1	-60.6	-175	0	0	0	108.4	F147 N149 G151 N152 I154 T196	I96-F147 WeakPolarHBondContact CD1-O 3.4Å; I96-N149 WeakPolarHBondContact CB-O 3.38Å; I96-G151 PolarHBondContact O-N 2.97Å; I96-N152 HydrophobicContact CD1-CB 4.45Å; I96-N152 PolarHBondContact N-O 3.42Å; I96-I154 HydrophobicContact CD1-CD1 3.88Å; I96-I154 HydrophobicContact CG1-CD1 4.13Å; I96-T196 HydrophobicContact CG1-CG2 4.49Å; I96-T196 HydrophobicContact CG2-CG2 4.29Å
97	T	95.3	Very high	83.5	Confident	41 Å²	41	37.4 Å²	37.4	25%	0.252	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	-17.9	-178.2	58	0	0	0	0	113.4	K95 G198 V199 Q200	K95-T97 PolarHBondContact O-N 2.69Å; T97-G198 PolarHBondContact N-O 2.82Å; T97-G198 PolarHBondContact OG1-O 2.95Å; T97-V199 PolarHBondContact OG1-N 2.81Å; T97-Q200 HydrophobicContact CG2-CB 3.61Å
98	K	88	Confident	83.5	Confident	83 Å²	83	36.1 Å²	36.1	36%	0.361	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	131.3	173.8	-164.8	72.1	-167.4	160.1	0	112	E150 R197 G198	K98-E150 WeakPolarHBondContact CA-OE1 3.5Å; K98-E150 WeakPolarHBondContact CD-OE1 3.12Å; K98-E150 IonicContact NZ-OE1 2.66Å; K98-R197 HydrophobicContact CB-CB 4.27Å; K98-R197 HydrophobicContact CG-CB 4.17Å; K98-R197 PolarHBondContact O-N 3.47Å; K98-G198 PolarHBondContact N-O 2.85Å; K98-G198 PolarHBondContact O-N 2.88Å
99	K	84	Confident	83.7	Confident	45 Å²	45	33 Å²	33	20%	0.196	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	153.9	169.7	-170.7	-179.4	-173.9	177.9	0	109.4	A148 N149 E150 L195	K99-A148 WeakPolarHBondContact CD-O 3.4Å; K99-A148 WeakPolarHBondContact CG-O 3.13Å; K99-N149 PolarHBondContact NZ-OD1 2.88Å; K99-E150 HydrophobicContact CB-CG 3.64Å; K99-E150 VanDerWaalsContact N-CG 3.34Å; K99-E150 PolarHBondContact N-OE1 2.84Å; K99-L195 CarbonylContact C-O 3.51Å; K99-L195 VanDerWaalsContact CA-O 3.27Å; K99-L195 WeakPolarHBondContact CA-O 3.33Å; K99-L195 WeakPolarHBondContact CG-O 3.36Å
100	Q	68	Low	83.8	Confident	4 Å²	4	31 Å²	31	2%	0.019	16%	0.164	C	C	.	.			trans	-136.9	89.9	178.6	-174.8	175.7	15.2	0	0	108.3	C102 W103 L195 R197 M417 C420	Q100-C102 VanDerWaalsContact CG-SG 3.54Å; Q100-C102 PolarHBondContact O-N 2.94Å; Q100-W103 VanDerWaalsContact CD-CD1 3.43Å; Q100-W103 VanDerWaalsContact NE2-NE1 3.12Å; Q100-L195 PolarHBondContact N-O 2.92Å; Q100-R197 HydrophobicContact CB-CB 3.86Å; Q100-M417 HydrophobicContact CG-CE 4.49Å; Q100-C420 PolarHBondContact NE2-SG 2.97Å
101	C	59.8	Low	83.9	Confident	83 Å²	83	30.7 Å²	30.7	56%	0.561	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-2.1	-166.2	-58.4	0	0	0	0	116	M417	C101-M417 HydrophobicContact CB-CE 4.37Å
102	C	49.9	Very low	84	Confident	30 Å²	30	30 Å²	30	20%	0.203	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.1	3.1	-176.3	58.1	0	0	0	0	114.9	Q100 Q418 V419 C420	Q100-C102 VanDerWaalsContact CG-SG 3.54Å; Q100-C102 PolarHBondContact O-N 2.94Å; C102-Q418 WeakPolarHBondContact CB-O 3.4Å; C102-V419 VanDerWaalsContact CB-CA 3.49Å; C102-V419 HydrophobicContact CB-CB 4.29Å; C102-V419 HydrophobicContact CB-CG2 4.2Å; C102-C420 VanDerWaalsContact SG-CB 3.56Å; C102-C420 PolarHBondContact SG-N 2.87Å; C102-C420 PolarHBondContact SG-SG 2.87Å
103	W	56.7	Low	84	Confident	68 Å²	68	31.6 Å²	31.6	26%	0.258	17%	0.171	S	C	.	.	S	Bend	trans	-119.3	154.2	175	-56.4	114.7	0	0	0	110.2	F75 Q100 L195	F75-W103 HydrophobicContact CB-CB 4.38Å; F75-W103 HydrophobicContact CB-CD2 3.56Å; F75-W103 HydrophobicContact CB-CE3 3.81Å; F75-W103 HydrophobicContact CB-CG 3.8Å; F75-W103 HydrophobicContact CB-CZ2 4.44Å; F75-W103 HydrophobicContact CB-CZ3 4.35Å; F75-W103 HydrophobicContact CD1-CE3 4Å; F75-W103 HydrophobicContact CD1-CH2 4.1Å; F75-W103 AromaticContact CD1-CZ3 3.77Å; F75-W103 HydrophobicContact CD1-CZ3 3.77Å; F75-W103 HydrophobicContact CE1-CZ3 4.48Å; F75-W103 HydrophobicContact CG-CD2 4.37Å; F75-W103 HydrophobicContact CG-CE3 4.11Å; F75-W103 HydrophobicContact CG-CZ3 4.35Å; Q100-W103 VanDerWaalsContact CD-CD1 3.43Å; Q100-W103 VanDerWaalsContact NE2-NE1 3.12Å; W103-L195 WeakPolarHBondContact O-CD2 3.3Å; W103-L195 VanDerWaalsContact O-CG 3.3Å; W103-L195 WeakPolarHBondContact O-CG 3.46Å
104	S	54.9	Low	84	Confident	86 Å²	86	33 Å²	33	60%	0.601	18%	0.179	S	C	*	.			trans	-101	164	169.6	58.3	0	0	0	0	112.1	Y193	S104-Y193 WeakPolarHBondContact O-CE1 3.4Å
105	G	63.6	Low	84	Confident	18 Å²	18	34.9 Å²	34.9	19%	0.186	19%	0.189	C	C	.	.	S	Bend	trans	74.4	159.3	-170.5	0	0	0	0	0	113.2	E145 G194 L195	G105-E145 WeakPolarHBondContact CA-OE1 3.22Å; G105-E145 PolarHBondContact N-OE1 2.88Å; G105-G194 CarbonylContact O-C 3.47Å; G105-G194 WeakPolarHBondContact O-CA 3.24Å; G105-L195 PolarHBondContact O-N 3.41Å
106	A	77.6	Confident	84	Confident	3 Å²	3	31 Å²	31	3%	0.025	17%	0.172	C	C	.	.			trans	-126	176.3	-175.7	0	0	0	0	0	113.2	R108 E145 A148	A106-R108 PolarHBondContact O-N 2.88Å; A106-E145 HydrophobicContact CB-CG 4.21Å; A106-A148 HydrophobicContact CB-CB 4.11Å
107	L	92.1	Very high	84	Confident	2 Å²	2	35 Å²	35	1%	0.01	20%	0.2	C	C	.	.			trans	-36.5	126.6	170.9	-168.9	68.1	0	0	0	112	L94 L109 L143 I154 I190 V192 T196 V199	L94-L107 HydrophobicContact CD1-CD2 4.34Å; L107-L109 HydrophobicContact CD1-CD2 4.41Å; L107-L109 HydrophobicContact CD2-CD1 4.18Å; L107-L109 HydrophobicContact CD2-CD2 3.91Å; L107-L109 HydrophobicContact CD2-CG 4.17Å; L107-L109 HydrophobicContact CG-CD2 3.86Å; L107-L109 HydrophobicContact CG-CG 4.11Å; L107-L143 HydrophobicContact CB-CD1 4.47Å; L107-L143 HydrophobicContact CD2-CD1 4.3Å; L107-L143 PolarHBondContact O-N 3.4Å; L107-I154 HydrophobicContact CD2-CD1 3.7Å; L107-I190 HydrophobicContact CD1-CG2 3.75Å; L107-V192 HydrophobicContact CD1-CG2 4.44Å; L107-T196 HydrophobicContact CD1-CG2 4.2Å; L107-V199 HydrophobicContact CD1-CG1 4.2Å; L107-V199 HydrophobicContact CD2-CG1 4.44Å
108	R	95.4	Very high	84	Confident	25 Å²	25	43 Å²	43	9%	0.094	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	137.2	168.7	-48.8	105.5	176	-140.4	-8.3	110.1	A106 K141 A142 D191 Y193	A106-R108 PolarHBondContact O-N 2.88Å; R108-K141 CarbonylContact C-O 3.53Å; R108-K141 VanDerWaalsContact CA-O 3.26Å; R108-K141 WeakPolarHBondContact CA-O 3.29Å; R108-K141 WeakPolarHBondContact CB-O 3.37Å; R108-A142 HydrophobicContact CG-CB 3.77Å; R108-D191 HydrophobicContact CB-CB 4.1Å; R108-D191 WeakPolarHBondContact CD-OD2 3.47Å; R108-D191 IonicContact CZ-OD2 3.95Å; R108-D191 PolarHBondContact N-O 3.24Å; R108-D191 VanDerWaalsContact N-O 3.11Å; R108-D191 IonicContact NE-OD2 3.62Å; R108-D191 IonicContact NH1-OD2 3.34Å; R108-D191 PolarHBondContact NH1-OD2 3.18Å; R108-D191 PolarHBondContact O-N 3.07Å; R108-Y193 VanDerWaalsContact CZ-CD1 3.48Å; R108-Y193 VanDerWaalsContact NE-CG 3.34Å; R108-Y193 VanDerWaalsContact NH2-CE1 3.29Å; R108-Y193 VanDerWaalsContact NH2-CE2 3.29Å
109	L	97.7	Very high	84.3	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	151.5	-175	-61.1	177.9	0	0	0	110.8	L94 L107 A140 K141 L143 I154 F156 F176 L189 I190	L94-L109 HydrophobicContact CD1-CD1 4.4Å; L94-L109 HydrophobicContact CD1-CD2 3.5Å; L107-L109 HydrophobicContact CD1-CD2 4.41Å; L107-L109 HydrophobicContact CD2-CD1 4.18Å; L107-L109 HydrophobicContact CD2-CD2 3.91Å; L107-L109 HydrophobicContact CD2-CG 4.17Å; L107-L109 HydrophobicContact CG-CD2 3.86Å; L107-L109 HydrophobicContact CG-CG 4.11Å; L109-A140 VanDerWaalsContact O-CA 3.31Å; L109-A140 WeakPolarHBondContact O-CA 3.39Å; L109-K141 PolarHBondContact N-O 2.78Å; L109-K141 PolarHBondContact O-N 3.36Å; L109-L143 HydrophobicContact CD1-CD1 3.69Å; L109-L143 HydrophobicContact CD1-CG 4.29Å; L109-L143 HydrophobicContact CG-CD1 4.34Å; L109-I154 HydrophobicContact CD1-CG2 3.66Å; L109-F156 HydrophobicContact CB-CD1 4.44Å; L109-F156 HydrophobicContact CB-CE1 4.35Å; L109-F156 HydrophobicContact CB-CE2 4.47Å; L109-F156 HydrophobicContact CB-CZ 4.35Å; L109-F156 HydrophobicContact CD1-CD1 3.72Å; L109-F156 HydrophobicContact CD1-CE1 3.99Å; L109-F156 HydrophobicContact CD1-CG 4.29Å; L109-F156 HydrophobicContact CD2-CD1 4.42Å; L109-F156 HydrophobicContact CD2-CE1 3.84Å; L109-F156 HydrophobicContact CD2-CZ 4.19Å; L109-F156 HydrophobicContact CG-CD1 4.44Å; L109-F156 HydrophobicContact CG-CE1 4.29Å; L109-F176 HydrophobicContact CB-CE1 4.12Å; L109-L189 WeakPolarHBondContact CA-O 3.35Å; L109-I190 HydrophobicContact CD2-CB 4.23Å; L109-I190 HydrophobicContact CD2-CG1 4Å; L109-I190 HydrophobicContact CD2-CG2 3.88Å
110	G	97.5	Very high	84.7	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	167.2	-143.5	170.8	0	0	0	0	0	112.2	W139 F156 L189	G110-W139 CarbonylContact C-O 3.59Å; G110-W139 VanDerWaalsContact CA-O 3.26Å; G110-W139 WeakPolarHBondContact CA-O 3.4Å; G110-F156 WeakPolarHBondContact O-CE2 3.33Å; G110-L189 PolarHBondContact N-O 3.23Å; G110-L189 PolarHBondContact O-N 3Å
111	F	98.4	Very high	85.8	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	157.9	-170.4	-61.1	-83.6	0	0	0	112	I86 W139 F156 V158 V164 V180 L186 W187	I86-F111 HydrophobicContact CG2-CE1 4.39Å; F111-W139 PolarHBondContact N-O 2.97Å; F111-W139 PolarHBondContact O-N 3.3Å; F111-W139 VanDerWaalsContact O-O 3.13Å; F111-F156 HydrophobicContact CE1-CD2 4.41Å; F111-F156 HydrophobicContact CE1-CE2 4.05Å; F111-F156 AromaticContact CE2-CD2 3.87Å; F111-F156 HydrophobicContact CE2-CD2 3.87Å; F111-F156 HydrophobicContact CE2-CE2 4.07Å; F111-F156 AromaticContact CZ-CD2 3.6Å; F111-F156 HydrophobicContact CZ-CD2 3.6Å; F111-F156 AromaticContact CZ-CE2 3.68Å; F111-F156 HydrophobicContact CZ-CE2 3.68Å; F111-V158 HydrophobicContact CD2-CB 4.37Å; F111-V158 HydrophobicContact CE1-CG1 4.35Å; F111-V158 HydrophobicContact CE2-CB 3.93Å; F111-V158 HydrophobicContact CE2-CG1 4.36Å; F111-V158 HydrophobicContact CZ-CB 4.15Å; F111-V158 HydrophobicContact CZ-CG1 4.18Å; F111-V164 HydrophobicContact CD2-CG2 3.83Å; F111-V164 HydrophobicContact CE2-CB 4.47Å; F111-V164 HydrophobicContact CE2-CG1 3.89Å; F111-V164 HydrophobicContact CE2-CG2 3.76Å; F111-V180 HydrophobicContact CB-CG1 4.38Å; F111-L186 HydrophobicContact CB-CD2 4.36Å; F111-L186 HydrophobicContact CD1-CB 4.38Å; F111-W187 CarbonylContact C-O 3.48Å; F111-W187 WeakPolarHBondContact CA-O 3.49Å
112	T	98.1	Very high	87.2	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	145.6	166.5	-177.5	0	0	0	0	111	F81 K114 G137 F138 L186 W187	F81-T112 HydrophobicContact CD1-CG2 3.79Å; F81-T112 HydrophobicContact CE1-CG2 3.91Å; T112-K114 VanDerWaalsContact C-N 3.31Å; T112-K114 WeakPolarHBondContact CG2-O 3.17Å; T112-K114 WeakPolarHBondContact OG1-CB 3.24Å; T112-K114 PolarHBondContact OG1-N 2.99Å; T112-G137 CarbonylContact C-O 3.51Å; T112-G137 VanDerWaalsContact CA-O 3.22Å; T112-G137 WeakPolarHBondContact CA-O 3.19Å; T112-G137 PolarHBondContact OG1-O 3.31Å; T112-F138 HydrophobicContact CG2-CE1 4.4Å; T112-F138 VanDerWaalsContact OG1-CD1 3.25Å; T112-F138 WeakPolarHBondContact OG1-CD1 2.99Å; T112-F138 VanDerWaalsContact OG1-CE1 3.24Å; T112-F138 WeakPolarHBondContact OG1-CE1 3.26Å; T112-L186 CarbonylContact O-C 3.46Å; T112-L186 WeakPolarHBondContact O-CA 3.13Å; T112-W187 HydrophobicContact CG2-CB 4.01Å; T112-W187 PolarHBondContact N-O 2.86Å; T112-W187 PolarHBondContact O-N 3.15Å
113	S	97.6	Very high	89.1	Confident	35 Å²	35	51.1 Å²	51.1	25%	0.245	27%	0.27	C	S	.	.	S	Bend	trans	-95.6	14.9	167.9	75.1	0	0	0	0	112.1	G137	S113-G137 PolarHBondContact N-O 3.36Å
114	K	97	Very high	90.7	Very high	88 Å²	88	49 Å²	49	38%	0.383	26%	0.263	S	S	.	.	S	Bend	trans	-101.2	121.3	172.5	-58.2	-63.1	-175.3	175.5	0	108.1	T112 P116 I119 S136 F138	T112-K114 VanDerWaalsContact C-N 3.31Å; T112-K114 WeakPolarHBondContact CG2-O 3.17Å; T112-K114 WeakPolarHBondContact OG1-CB 3.24Å; T112-K114 PolarHBondContact OG1-N 2.99Å; K114-P116 VanDerWaalsContact O-CD 3.24Å; K114-P116 WeakPolarHBondContact O-CD 3.42Å; K114-I119 HydrophobicContact CB-CD1 4Å; K114-I119 HydrophobicContact CB-CG1 4.42Å; K114-S136 WeakPolarHBondContact CE-O 3.49Å; K114-F138 HydrophobicContact CB-CE1 4.45Å; K114-F138 HydrophobicContact CB-CZ 4.03Å; K114-F138 HydrophobicContact CG-CE1 4.41Å; K114-F138 HydrophobicContact CG-CE2 3.78Å; K114-F138 HydrophobicContact CG-CZ 3.71Å
115	D	97.2	Very high	92.1	Very high	39 Å²	39	46.2 Å²	46.2	21%	0.209	24%	0.244	C	C	.	.			trans	-55.9	114	172.4	175.6	0.1	0	0	0	110.2	S117 R118 W187	D115-S117 PolarHBondContact O-N 3.44Å; D115-S117 WeakPolarHBondContact OD1-CB 3.42Å; D115-S117 PolarHBondContact OD1-N 2.79Å; D115-R118 HydrophobicContact CB-CG 4.11Å; D115-R118 WeakPolarHBondContact O-CB 3.33Å; D115-R118 PolarHBondContact O-N 2.79Å; D115-R118 WeakPolarHBondContact OD2-CD 3.22Å; D115-R118 IonicContact OD2-CZ 3.4Å; D115-R118 IonicContact OD2-NE 2.84Å; D115-R118 PolarHBondContact OD2-NE 2.82Å; D115-R118 IonicContact OD2-NH2 3.35Å; D115-W187 HydrophobicContact CB-CH2 3.68Å; D115-W187 HydrophobicContact CB-CZ2 3.82Å; D115-W187 HydrophobicContact CB-CZ3 4.27Å
116	P	97.4	Very high	92.7	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-59.4	-29.1	-177.2	-25	35.1	0	0	0	113.1	H52 T55 F81 K114 R118 I119 W187	H52-P116 HydrophobicContact CB-CB 4.43Å; T55-P116 WeakPolarHBondContact CB-O 3.13Å; T55-P116 HydrophobicContact CG2-CB 4.41Å; T55-P116 PolarHBondContact OG1-O 3.25Å; F81-P116 HydrophobicContact CB-CB 3.87Å; F81-P116 HydrophobicContact CB-CG 3.55Å; F81-P116 HydrophobicContact CD1-CG 4.28Å; F81-P116 HydrophobicContact CD2-CB 4.21Å; F81-P116 HydrophobicContact CG-CB 4.05Å; F81-P116 HydrophobicContact CG-CG 3.88Å; K114-P116 VanDerWaalsContact O-CD 3.24Å; K114-P116 WeakPolarHBondContact O-CD 3.42Å; P116-R118 PolarHBondContact O-N 2.76Å; P116-R118 VanDerWaalsContact O-N 3.08Å; P116-I119 PolarHBondContact O-N 2.7Å; P116-I119 VanDerWaalsContact O-N 3.13Å; P116-W187 VanDerWaalsContact CD-CG 3.42Å; P116-W187 HydrophobicContact CG-CB 3.99Å; P116-W187 HydrophobicContact CG-CD2 4.38Å; P116-W187 HydrophobicContact CG-CG 3.76Å
117	S	96.9	Very high	93	Very high	86 Å²	86	51.9 Å²	51.9	60%	0.601	26%	0.261	S	S	*	.	G	3₁₀ helix	trans	-65.2	-9.5	175.2	-75.4	0	0	0	0	113.6	H52 D115	H52-S117 PolarHBondContact NE2-N 3.17Å; H52-S117 PolarHBondContact NE2-OG 2.84Å; D115-S117 PolarHBondContact O-N 3.44Å; D115-S117 WeakPolarHBondContact OD1-CB 3.42Å; D115-S117 PolarHBondContact OD1-N 2.79Å
118	R	95.4	Very high	92.4	Very high	209 Å²	209	51.8 Å²	51.8	79%	0.789	26%	0.261	S	S	*	.	G	3₁₀ helix	trans	-108.9	-1.6	177.6	-57.4	178.8	-171.6	-94.4	-5.5	113.7	D115 P116	D115-R118 HydrophobicContact CB-CG 4.11Å; D115-R118 WeakPolarHBondContact O-CB 3.33Å; D115-R118 PolarHBondContact O-N 2.79Å; D115-R118 WeakPolarHBondContact OD2-CD 3.22Å; D115-R118 IonicContact OD2-CZ 3.4Å; D115-R118 IonicContact OD2-NE 2.84Å; D115-R118 PolarHBondContact OD2-NE 2.82Å; D115-R118 IonicContact OD2-NH2 3.35Å; P116-R118 PolarHBondContact O-N 2.76Å; P116-R118 VanDerWaalsContact O-N 3.08Å
119	I	94.8	Very high	91.6	Very high	32 Å²	32	52.1 Å²	52.1	16%	0.164	27%	0.267	C	S	.	.	S	Bend	trans	-94.1	124.6	177.3	-57.4	174.7	0	0	0	107.9	T55 F81 K114 P116 P121 L124 F138	T55-I119 HydrophobicContact CG2-CB 3.76Å; T55-I119 HydrophobicContact CG2-CG2 3.94Å; T55-I119 PolarHBondContact OG1-O 3.12Å; F81-I119 HydrophobicContact CZ-CD1 4.36Å; K114-I119 HydrophobicContact CB-CD1 4Å; K114-I119 HydrophobicContact CB-CG1 4.42Å; P116-I119 PolarHBondContact O-N 2.7Å; P116-I119 VanDerWaalsContact O-N 3.13Å; I119-P121 WeakPolarHBondContact O-CD 3.44Å; I119-L124 HydrophobicContact CG2-CD2 3.89Å; I119-F138 HydrophobicContact CD1-CE1 4.16Å; I119-F138 HydrophobicContact CD1-CZ 4.07Å
120	N	92.3	Very high	90.3	Very high	71 Å²	71	56.6 Å²	56.6	38%	0.38	30%	0.296	S	S	.	.			trans	-67.2	123	170.5	-178.5	1.6	0	0	0	109.2	D122 N123	N120-D122 PolarHBondContact O-N 2.75Å; N120-D122 PolarHBondContact OD1-N 3.34Å; N120-D122 VanDerWaalsContact OD1-N 3.08Å; N120-D122 PolarHBondContact OD1-OD2 2.56Å; N120-N123 HydrophobicContact CB-CB 4.29Å; N120-N123 PolarHBondContact O-N 2.93Å; N120-N123 VanDerWaalsContact O-N 3.07Å
121	P	91	Very high	89.3	Confident	51 Å²	51	58.7 Å²	58.7	33%	0.331	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-55.3	-34	175.6	21.8	-34.3	0	0	0	113.7	I119 N123 L124	I119-P121 WeakPolarHBondContact O-CD 3.44Å; P121-N123 PolarHBondContact O-N 3.4Å; P121-L124 WeakPolarHBondContact O-CB 3.36Å; P121-L124 WeakPolarHBondContact O-CG 3.34Å; P121-L124 PolarHBondContact O-N 3.38Å; P121-L124 VanDerWaalsContact O-N 3.08Å
122	D	88.8	Confident	88.6	Confident	139 Å²	139	58.9 Å²	58.9	74%	0.743	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-68.2	-19.3	179.9	-57.3	-37.4	0	0	0	113	N120	N120-D122 PolarHBondContact O-N 2.75Å; N120-D122 PolarHBondContact OD1-N 3.34Å; N120-D122 VanDerWaalsContact OD1-N 3.08Å; N120-D122 PolarHBondContact OD1-OD2 2.56Å
123	N	89.7	Confident	88	Confident	122 Å²	122	61.6 Å²	61.6	65%	0.652	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	-90.4	1.4	176.5	-67.2	-6.3	0	0	0	112.7	N120 P121	N120-N123 HydrophobicContact CB-CB 4.29Å; N120-N123 PolarHBondContact O-N 2.93Å; N120-N123 VanDerWaalsContact O-N 3.07Å; P121-N123 PolarHBondContact O-N 3.4Å
124	L	91.3	Very high	87.4	Confident	22 Å²	22	64.6 Å²	64.6	12%	0.115	35%	0.345	C	S	.	.			trans	-71.3	127	176.3	-68.3	174.7	0	0	0	110.1	T55 K56 F81 I119 P121	T55-L124 HydrophobicContact CG2-CD1 4.25Å; K56-L124 VanDerWaalsContact C-CD1 3.47Å; F81-L124 HydrophobicContact CE2-CD1 4.43Å; F81-L124 HydrophobicContact CE2-CD2 3.86Å; F81-L124 HydrophobicContact CZ-CD2 4.04Å; I119-L124 HydrophobicContact CG2-CD2 3.89Å; P121-L124 WeakPolarHBondContact O-CB 3.36Å; P121-L124 WeakPolarHBondContact O-CG 3.34Å; P121-L124 PolarHBondContact O-N 3.38Å; P121-L124 VanDerWaalsContact O-N 3.08Å
125	P	84.3	Confident	87	Confident	29 Å²	29	64.7 Å²	64.7	19%	0.188	35%	0.347	C	S	.	.			trans	-76.4	173.9	179.8	35	-37.7	0	0	0	111.5	I79 Y127 D131 L132	I79-P125 HydrophobicContact CD1-CG 4.37Å; I79-P125 VanDerWaalsContact CD1-O 3.31Å; I79-P125 WeakPolarHBondContact CD1-O 3.13Å; P125-Y127 VanDerWaalsContact C-N 3.29Å; P125-Y127 PolarHBondContact O-N 3.07Å; P125-D131 HydrophobicContact CB-CB 3.53Å; P125-D131 HydrophobicContact CG-CB 3.68Å; P125-L132 HydrophobicContact CG-CD2 3.69Å; P125-L132 HydrophobicContact CG-CG 3.64Å
126	K	77.1	Confident	86.8	Confident	86 Å²	86	67.5 Å²	67.5	37%	0.374	37%	0.37	S	S	.	.	S	Bend	trans	-66.3	-29.9	-174.3	-168.6	175.2	179.6	-172.5	0	113.5	C76 N77	C76-K126 HydrophobicContact CB-CG 3.94Å; C76-K126 WeakPolarHBondContact SG-CE 3.11Å; N77-K126 PolarHBondContact N-O 2.81Å; N77-K126 VanDerWaalsContact N-O 3.08Å; N77-K126 VanDerWaalsContact OD1-CA 3.31Å; N77-K126 WeakPolarHBondContact OD1-CA 3.33Å; N77-K126 WeakPolarHBondContact OD1-CG 3.41Å
127	Y	82	Confident	86.7	Confident	53 Å²	53	68.1 Å²	68.1	21%	0.208	38%	0.376	C	S	.	.			trans	-137.4	144.5	-175.5	-47.9	-63.1	0	0	0	111.8	F75 C76 P125 C129 D131 Y193	F75-Y127 HydrophobicContact CD2-CE1 4.48Å; F75-Y127 AromaticContact CE2-CE1 3.87Å; F75-Y127 HydrophobicContact CE2-CE1 3.87Å; C76-Y127 HydrophobicContact CB-CD1 3.94Å; C76-Y127 HydrophobicContact CB-CE1 3.52Å; P125-Y127 VanDerWaalsContact C-N 3.29Å; P125-Y127 PolarHBondContact O-N 3.07Å; Y127-C129 VanDerWaalsContact C-N 3.34Å; Y127-C129 WeakPolarHBondContact CB-O 3.33Å; Y127-D131 WeakPolarHBondContact CD2-OD2 3.32Å; Y127-D131 PolarHBondContact N-OD2 3.27Å; Y127-D131 VanDerWaalsContact O-CB 3.29Å; Y127-D131 WeakPolarHBondContact O-CB 3.25Å; Y127-Y193 HydrophobicContact CD1-CD2 4.17Å; Y127-Y193 AromaticContact CD1-CE2 3.73Å; Y127-Y193 HydrophobicContact CD1-CE2 3.73Å; Y127-Y193 AromaticContact CE1-CE2 3.78Å; Y127-Y193 HydrophobicContact CE1-CE2 3.78Å
128	A	79.5	Confident	86.7	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	35%	0.35	C	S	.	.	I	π-helix	trans	-66.6	-39.7	168.3	0	0	0	0	0	111.7	I79 L132 V133 A140 L189 D191	I79-A128 HydrophobicContact CG1-CB 4.47Å; A128-L132 PolarHBondContact O-N 3.42Å; A128-L132 VanDerWaalsContact O-N 3.08Å; A128-V133 WeakPolarHBondContact O-CG2 3.37Å; A128-V133 PolarHBondContact O-N 2.94Å; A128-A140 HydrophobicContact CB-CB 4.42Å; A128-L189 HydrophobicContact CB-CD2 3.82Å; A128-D191 HydrophobicContact CB-CB 3.65Å; A128-D191 WeakPolarHBondContact CB-OD2 3.31Å; A128-D191 PolarHBondContact N-OD2 3.17Å
129	C	78.5	Confident	86.8	Confident	33 Å²	33	56.8 Å²	56.8	22%	0.223	32%	0.321	C	S	.	.	I	π-helix	trans	-117.3	125	177.7	-55.7	0	0	0	0	109.9	Y127 A140	Y127-C129 VanDerWaalsContact C-N 3.34Å; Y127-C129 WeakPolarHBondContact CB-O 3.33Å; C129-A140 PolarHBondContact SG-O 3.49Å
130	P	71.7	Confident	86.8	Confident	93 Å²	93	55.9 Å²	55.9	60%	0.604	32%	0.318	S	S	*	.	I	π-helix	cis	-82.7	-16.5	0.7	34.2	-35.2	0	0	0	114.6	L132 V133 S134	P130-L132 PolarHBondContact O-N 3.18Å; P130-V133 PolarHBondContact O-N 3.04Å; P130-S134 PolarHBondContact O-N 2.74Å
131	D	76.5	Confident	86.6	Confident	45 Å²	45	57.2 Å²	57.2	24%	0.241	32%	0.32	C	S	.	.	I	π-helix	trans	-60.2	-54.8	-156.4	-36	-20.4	0	0	0	114.1	P125 Y127 S134	P125-D131 HydrophobicContact CB-CB 3.53Å; P125-D131 HydrophobicContact CG-CB 3.68Å; Y127-D131 WeakPolarHBondContact CD2-OD2 3.32Å; Y127-D131 PolarHBondContact N-OD2 3.27Å; Y127-D131 VanDerWaalsContact O-CB 3.29Å; Y127-D131 WeakPolarHBondContact O-CB 3.25Å; D131-S134 PolarHBondContact O-OG 2.84Å
132	L	82.9	Confident	86.4	Confident	4 Å²	4	57 Å²	57	2%	0.021	32%	0.323	C	S	.	.	I	π-helix	trans	-67.7	-42.2	175.6	-77.6	-175.5	0	0	0	112.2	I79 F81 P125 A128 P130 S134 Q135 F138 L189	I79-L132 HydrophobicContact CD1-CD1 3.8Å; I79-L132 HydrophobicContact CD1-CG 4.22Å; I79-L132 HydrophobicContact CG2-CD1 3.91Å; F81-L132 HydrophobicContact CZ-CD1 4.21Å; P125-L132 HydrophobicContact CG-CD2 3.69Å; P125-L132 HydrophobicContact CG-CG 3.64Å; A128-L132 PolarHBondContact O-N 3.42Å; A128-L132 VanDerWaalsContact O-N 3.08Å; P130-L132 PolarHBondContact O-N 3.18Å; L132-S134 PolarHBondContact O-N 3.46Å; L132-Q135 WeakPolarHBondContact O-CA 3.38Å; L132-Q135 VanDerWaalsContact O-CB 3.3Å; L132-Q135 WeakPolarHBondContact O-CB 3.14Å; L132-Q135 PolarHBondContact O-N 2.78Å; L132-F138 HydrophobicContact CB-CB 4.32Å; L132-F138 HydrophobicContact CB-CD1 4.29Å; L132-F138 HydrophobicContact CB-CG 4.25Å; L132-F138 HydrophobicContact CD1-CD1 4.17Å; L132-F138 HydrophobicContact CD1-CE1 4.3Å; L132-F138 HydrophobicContact CD2-CD1 4.33Å; L132-F138 HydrophobicContact CD2-CE1 4.13Å; L132-F138 HydrophobicContact CD2-CE2 4.48Å; L132-F138 HydrophobicContact CD2-CZ 4.21Å; L132-F138 WeakPolarHBondContact O-CB 3.27Å; L132-L189 HydrophobicContact CD1-CD1 4.11Å
133	V	85.5	Confident	86.3	Confident	56 Å²	56	50.8 Å²	50.8	34%	0.339	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-20.4	-177.2	176.5	0	0	0	0	112.5	A128 P130 Q135 A140	A128-V133 WeakPolarHBondContact O-CG2 3.37Å; A128-V133 PolarHBondContact O-N 2.94Å; P130-V133 PolarHBondContact O-N 3.04Å; V133-Q135 PolarHBondContact O-N 3.11Å; V133-A140 HydrophobicContact CG2-CB 3.71Å; V133-A140 VanDerWaalsContact CG2-N 3.29Å
134	S	84.8	Confident	85.9	Confident	98 Å²	98	47.1 Å²	47.1	69%	0.685	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-18.1	169.4	77.7	0	0	0	0	113.7	P130 D131 L132	P130-S134 PolarHBondContact O-N 2.74Å; D131-S134 PolarHBondContact O-OG 2.84Å; L132-S134 PolarHBondContact O-N 3.46Å
135	Q	90.3	Very high	85.4	Confident	91 Å²	91	50.2 Å²	50.2	43%	0.425	29%	0.286	S	S	.	.	S	Bend	trans	-94.5	148.2	-177.4	-52.9	-179.8	25.5	0	0	112.2	L132 V133 G137 F138	L132-Q135 WeakPolarHBondContact O-CA 3.38Å; L132-Q135 VanDerWaalsContact O-CB 3.3Å; L132-Q135 WeakPolarHBondContact O-CB 3.14Å; L132-Q135 PolarHBondContact O-N 2.78Å; V133-Q135 PolarHBondContact O-N 3.11Å; Q135-G137 PolarHBondContact O-N 3.31Å; Q135-F138 HydrophobicContact CB-CD2 3.87Å; Q135-F138 HydrophobicContact CB-CE2 4.2Å; Q135-F138 PolarHBondContact O-N 3.14Å
136	S	92.3	Very high	85.2	Confident	97 Å²	97	54.4 Å²	54.4	68%	0.678	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	127.2	180	69.2	0	0	0	0	112.8	K114	K114-S136 WeakPolarHBondContact CE-O 3.49Å
137	G	94.8	Very high	85.7	Confident	13 Å²	13	52.5 Å²	52.5	13%	0.134	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	92.3	14.1	176.6	0	0	0	0	0	115.3	T112 S113 Q135 W139	T112-G137 CarbonylContact C-O 3.51Å; T112-G137 VanDerWaalsContact CA-O 3.22Å; T112-G137 WeakPolarHBondContact CA-O 3.19Å; T112-G137 PolarHBondContact OG1-O 3.31Å; S113-G137 PolarHBondContact N-O 3.36Å; Q135-G137 PolarHBondContact O-N 3.31Å; G137-W139 WeakPolarHBondContact O-CZ3 3.32Å
138	F	97.1	Very high	85.9	Confident	14 Å²	14	50 Å²	50	6%	0.061	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	137.2	172.6	-61.5	-90.7	0	0	0	110.3	F81 T112 K114 I119 L132 Q135 L189	F81-F138 HydrophobicContact CE1-CE1 4.28Å; F81-F138 HydrophobicContact CZ-CE1 4.49Å; T112-F138 HydrophobicContact CG2-CE1 4.4Å; T112-F138 VanDerWaalsContact OG1-CD1 3.25Å; T112-F138 WeakPolarHBondContact OG1-CD1 2.99Å; T112-F138 VanDerWaalsContact OG1-CE1 3.24Å; T112-F138 WeakPolarHBondContact OG1-CE1 3.26Å; K114-F138 HydrophobicContact CB-CE1 4.45Å; K114-F138 HydrophobicContact CB-CZ 4.03Å; K114-F138 HydrophobicContact CG-CE1 4.41Å; K114-F138 HydrophobicContact CG-CE2 3.78Å; K114-F138 HydrophobicContact CG-CZ 3.71Å; I119-F138 HydrophobicContact CD1-CE1 4.16Å; I119-F138 HydrophobicContact CD1-CZ 4.07Å; L132-F138 HydrophobicContact CB-CB 4.32Å; L132-F138 HydrophobicContact CB-CD1 4.29Å; L132-F138 HydrophobicContact CB-CG 4.25Å; L132-F138 HydrophobicContact CD1-CD1 4.17Å; L132-F138 HydrophobicContact CD1-CE1 4.3Å; L132-F138 HydrophobicContact CD2-CD1 4.33Å; L132-F138 HydrophobicContact CD2-CE1 4.13Å; L132-F138 HydrophobicContact CD2-CE2 4.48Å; L132-F138 HydrophobicContact CD2-CZ 4.21Å; L132-F138 WeakPolarHBondContact O-CB 3.27Å; Q135-F138 HydrophobicContact CB-CD2 3.87Å; Q135-F138 HydrophobicContact CB-CE2 4.2Å; Q135-F138 PolarHBondContact O-N 3.14Å; F138-L189 HydrophobicContact CD1-CD1 3.92Å
139	W	97.7	Very high	86.3	Confident	44 Å²	44	53.2 Å²	53.2	17%	0.167	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	120.4	175.9	-55.6	-95.3	0	0	0	109	G110 F111 G137 F177 G179 V180 R181 L186	G110-W139 CarbonylContact C-O 3.59Å; G110-W139 VanDerWaalsContact CA-O 3.26Å; G110-W139 WeakPolarHBondContact CA-O 3.4Å; F111-W139 PolarHBondContact N-O 2.97Å; F111-W139 PolarHBondContact O-N 3.3Å; F111-W139 VanDerWaalsContact O-O 3.13Å; G137-W139 WeakPolarHBondContact O-CZ3 3.32Å; W139-F177 HydrophobicContact CB-CE2 3.74Å; W139-F177 HydrophobicContact CB-CZ 4.22Å; W139-G179 PolarHBondContact NE1-O 3.21Å; W139-G179 VanDerWaalsContact NE1-O 3.11Å; W139-V180 HydrophobicContact CB-CG2 3.98Å; W139-V180 HydrophobicContact CD2-CB 4.43Å; W139-V180 HydrophobicContact CD2-CG1 4.3Å; W139-V180 HydrophobicContact CD2-CG2 4.23Å; W139-V180 HydrophobicContact CE3-CG1 4.03Å; W139-V180 HydrophobicContact CG-CG2 3.96Å; W139-V180 HydrophobicContact CZ3-CG1 4.3Å; W139-R181 HydrophobicContact CH2-CB 3.95Å; W139-R181 HydrophobicContact CH2-CG 4.23Å; W139-R181 HydrophobicContact CZ2-CB 4.05Å; W139-R181 HydrophobicContact CZ2-CG 3.86Å; W139-L186 HydrophobicContact CZ3-CD2 4.1Å
140	A	94.6	Very high	87	Confident	13 Å²	13	56.3 Å²	56.3	11%	0.107	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	156.8	177.1	0	0	0	0	0	111	L109 A128 C129 V133 L189	L109-A140 VanDerWaalsContact O-CA 3.31Å; L109-A140 WeakPolarHBondContact O-CA 3.39Å; A128-A140 HydrophobicContact CB-CB 4.42Å; C129-A140 PolarHBondContact SG-O 3.49Å; V133-A140 HydrophobicContact CG2-CB 3.71Å; V133-A140 VanDerWaalsContact CG2-N 3.29Å; A140-L189 HydrophobicContact CB-CD2 4.07Å
141	K	87.7	Confident	88	Confident	98 Å²	98	53.9 Å²	53.9	43%	0.426	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	147.4	176.3	-177.2	174.3	168.9	-178.5	0	109.3	R108 L109 F176 F177	R108-K141 CarbonylContact C-O 3.53Å; R108-K141 VanDerWaalsContact CA-O 3.26Å; R108-K141 WeakPolarHBondContact CA-O 3.29Å; R108-K141 WeakPolarHBondContact CB-O 3.37Å; L109-K141 PolarHBondContact N-O 2.78Å; L109-K141 PolarHBondContact O-N 3.36Å; K141-F176 HydrophobicContact CB-CD1 4.44Å; K141-F176 HydrophobicContact CB-CE1 3.87Å; K141-F176 HydrophobicContact CB-CE2 4.01Å; K141-F176 HydrophobicContact CB-CZ 3.64Å; K141-F176 HydrophobicContact CD-CD2 3.89Å; K141-F176 HydrophobicContact CD-CE2 3.78Å; K141-F176 HydrophobicContact CD-CG 4.47Å; K141-F176 HydrophobicContact CD-CZ 4.3Å; K141-F176 WeakPolarHBondContact CD-O 3.01Å; K141-F176 HydrophobicContact CG-CD2 4.36Å; K141-F176 HydrophobicContact CG-CE2 3.77Å; K141-F176 HydrophobicContact CG-CZ 3.88Å; K141-F176 PolarHBondContact NZ-O 2.84Å; K141-F176 VanDerWaalsContact O-CZ 3.24Å; K141-F176 WeakPolarHBondContact O-CZ 3.09Å; K141-F177 HydrophobicContact CB-CD1 3.62Å; K141-F177 HydrophobicContact CB-CE1 3.86Å; K141-F177 HydrophobicContact CD-CB 4.27Å; K141-F177 HydrophobicContact CD-CD1 4.08Å
142	A	88.4	Confident	88.9	Confident	46 Å²	46	53 Å²	53	38%	0.38	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	139.4	172.5	0	0	0	0	0	110.7	R108 F176	R108-A142 HydrophobicContact CG-CB 3.77Å; A142-F176 WeakPolarHBondContact O-CE2 3.47Å
143	L	86.2	Confident	89.6	Confident	9 Å²	9	55 Å²	55	5%	0.047	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-75.1	156.4	164.1	-72.3	173.1	0	0	0	110.8	L107 L109 I154 Y166 F176	L107-L143 HydrophobicContact CB-CD1 4.47Å; L107-L143 HydrophobicContact CD2-CD1 4.3Å; L107-L143 PolarHBondContact O-N 3.4Å; L109-L143 HydrophobicContact CD1-CD1 3.69Å; L109-L143 HydrophobicContact CD1-CG 4.29Å; L109-L143 HydrophobicContact CG-CD1 4.34Å; L143-I154 HydrophobicContact CD1-CD1 3.65Å; L143-I154 HydrophobicContact CD1-CG1 4.44Å; L143-I154 HydrophobicContact CD1-CG2 4.06Å; L143-Y166 HydrophobicContact CD2-CD2 3.66Å; L143-Y166 HydrophobicContact CD2-CE2 3.72Å; L143-Y166 HydrophobicContact CD2-CG 4.23Å; L143-F176 HydrophobicContact CD2-CE1 4.46Å; L143-F176 HydrophobicContact CD2-CE2 3.79Å; L143-F176 HydrophobicContact CD2-CZ 3.73Å; L143-F176 HydrophobicContact CG-CZ 4.1Å
144	P	79.9	Confident	90.1	Very high	46 Å²	46	52.4 Å²	52.4	30%	0.299	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-57.5	146.8	163.9	-24	34.5	0	0	0	112.8	E146 F147	P144-E146 VanDerWaalsContact C-N 3.35Å; P144-E146 HydrophobicContact CB-CG 4.17Å; P144-E146 VanDerWaalsContact CB-OE1 3.22Å; P144-E146 WeakPolarHBondContact CB-OE1 3.46Å; P144-E146 WeakPolarHBondContact CB-OE2 3.19Å; P144-E146 PolarHBondContact O-N 3.34Å; P144-F147 HydrophobicContact CB-CD2 3.99Å; P144-F147 HydrophobicContact CB-CE2 3.94Å; P144-F147 HydrophobicContact CG-CD2 4.05Å; P144-F147 HydrophobicContact CG-CE2 3.72Å; P144-F147 PolarHBondContact O-N 3.1Å
145	E	81.3	Confident	90.7	Very high	86 Å²	86	47.9 Å²	47.9	40%	0.402	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-70.8	-29.3	-171.8	-71.4	-173.2	-155.3	0	0	113.4	G105 A106 F147 A148 L195	G105-E145 WeakPolarHBondContact CA-OE1 3.22Å; G105-E145 PolarHBondContact N-OE1 2.88Å; A106-E145 HydrophobicContact CB-CG 4.21Å; E145-F147 PolarHBondContact O-N 2.78Å; E145-F147 VanDerWaalsContact O-N 3.12Å; E145-A148 VanDerWaalsContact O-CB 3.28Å; E145-A148 WeakPolarHBondContact O-CB 3.5Å; E145-A148 PolarHBondContact O-N 2.95Å; E145-L195 HydrophobicContact CB-CD1 3.67Å; E145-L195 HydrophobicContact CG-CD1 3.86Å; E145-L195 WeakPolarHBondContact OE2-CD1 3.32Å
146	E	81.3	Confident	91.1	Very high	117 Å²	117	43.6 Å²	43.6	55%	0.547	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-58.6	-22.1	175.4	60.8	-92	-145.6	0	0	113.3	P144 N149	P144-E146 VanDerWaalsContact C-N 3.35Å; P144-E146 HydrophobicContact CB-CG 4.17Å; P144-E146 VanDerWaalsContact CB-OE1 3.22Å; P144-E146 WeakPolarHBondContact CB-OE1 3.46Å; P144-E146 WeakPolarHBondContact CB-OE2 3.19Å; P144-E146 PolarHBondContact O-N 3.34Å; E146-N149 PolarHBondContact O-ND2 2.88Å; E146-N149 VanDerWaalsContact O-ND2 3.1Å
147	F	86.9	Confident	91.3	Very high	46 Å²	46	39 Å²	39	20%	0.202	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-87.8	-6.9	177.7	-54.9	-36.5	0	0	0	113.8	I96 P144 E145 N149 N152 Y166 I168	I96-F147 WeakPolarHBondContact CD1-O 3.4Å; P144-F147 HydrophobicContact CB-CD2 3.99Å; P144-F147 HydrophobicContact CB-CE2 3.94Å; P144-F147 HydrophobicContact CG-CD2 4.05Å; P144-F147 HydrophobicContact CG-CE2 3.72Å; P144-F147 PolarHBondContact O-N 3.1Å; E145-F147 PolarHBondContact O-N 2.78Å; E145-F147 VanDerWaalsContact O-N 3.12Å; F147-N149 PolarHBondContact O-N 2.81Å; F147-N152 PolarHBondContact O-ND2 2.92Å; F147-Y166 HydrophobicContact CD2-CE2 4.26Å; F147-Y166 AromaticContact CE2-CE2 3.97Å; F147-Y166 HydrophobicContact CE2-CE2 3.97Å; F147-I168 HydrophobicContact CB-CD1 3.97Å; F147-I168 HydrophobicContact CB-CG1 4.38Å; F147-I168 HydrophobicContact CD1-CB 4.48Å; F147-I168 HydrophobicContact CD1-CD1 4.44Å; F147-I168 HydrophobicContact CD1-CG1 3.92Å; F147-I168 HydrophobicContact CD1-CG2 4.12Å; F147-I168 HydrophobicContact CD2-CD1 3.82Å; F147-I168 HydrophobicContact CD2-CG1 3.83Å; F147-I168 HydrophobicContact CE1-CG1 4.15Å; F147-I168 HydrophobicContact CE2-CD1 4.45Å; F147-I168 HydrophobicContact CE2-CG1 4.05Å; F147-I168 HydrophobicContact CG-CD1 3.83Å; F147-I168 HydrophobicContact CG-CG1 3.78Å; F147-I168 HydrophobicContact CG-CG2 4.41Å; F147-I168 HydrophobicContact CZ-CG1 4.21Å
148	A	86.3	Confident	91.5	Very high	2 Å²	2	38.4 Å²	38.4	2%	0.017	21%	0.206	C	C	.	.			trans	-76.3	15.5	-177	0	0	0	0	0	115.1	K99 A106 E145 L195	K99-A148 WeakPolarHBondContact CD-O 3.4Å; K99-A148 WeakPolarHBondContact CG-O 3.13Å; A106-A148 HydrophobicContact CB-CB 4.11Å; E145-A148 VanDerWaalsContact O-CB 3.28Å; E145-A148 WeakPolarHBondContact O-CB 3.5Å; E145-A148 PolarHBondContact O-N 2.95Å; A148-L195 HydrophobicContact CB-CB 3.74Å; A148-L195 HydrophobicContact CB-CD1 4.1Å
149	N	87.9	Confident	91.4	Very high	66 Å²	66	37.9 Å²	37.9	35%	0.353	20%	0.204	S	C	.	.			trans	-76.5	144	-176.4	-64.4	-31.9	0	0	0	112.7	I96 K99 E146 F147 N152	I96-N149 WeakPolarHBondContact CB-O 3.38Å; K99-N149 PolarHBondContact NZ-OD1 2.88Å; E146-N149 PolarHBondContact O-ND2 2.88Å; E146-N149 VanDerWaalsContact O-ND2 3.1Å; F147-N149 PolarHBondContact O-N 2.81Å; N149-N152 WeakPolarHBondContact O-CB 3.46Å; N149-N152 PolarHBondContact O-N 3.13Å
150	E	93.1	Very high	91.2	Very high	99 Å²	99	42.7 Å²	42.7	46%	0.463	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	141.9	176.4	-60.8	-170.6	178.6	0	0	110.9	K98 K99 N152	K98-E150 WeakPolarHBondContact CA-OE1 3.5Å; K98-E150 WeakPolarHBondContact CD-OE1 3.12Å; K98-E150 IonicContact NZ-OE1 2.66Å; K99-E150 HydrophobicContact CB-CG 3.64Å; K99-E150 VanDerWaalsContact N-CG 3.34Å; K99-E150 PolarHBondContact N-OE1 2.84Å; E150-N152 VanDerWaalsContact C-N 3.28Å; E150-N152 PolarHBondContact O-N 3.26Å
151	G	92.9	Very high	91.2	Very high	42 Å²	42	49.3 Å²	49.3	43%	0.433	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.9	-23.6	-176.7	0	0	0	0	0	115	I96 I153	I96-G151 PolarHBondContact O-N 2.97Å; G151-I153 PolarHBondContact O-N 3.11Å
152	N	95.1	Very high	91.5	Very high	26 Å²	26	44.7 Å²	44.7	14%	0.139	23%	0.232	C	C	.	.			trans	-57.8	137.8	176.2	-86.1	-12.7	0	0	0	111.4	K95 I96 F147 N149 E150 N169	K95-N152 CarbonylContact C-O 3.56Å; K95-N152 WeakPolarHBondContact CA-O 3.5Å; I96-N152 HydrophobicContact CD1-CB 4.45Å; I96-N152 PolarHBondContact N-O 3.42Å; F147-N152 PolarHBondContact O-ND2 2.92Å; N149-N152 WeakPolarHBondContact O-CB 3.46Å; N149-N152 PolarHBondContact O-N 3.13Å; E150-N152 VanDerWaalsContact C-N 3.28Å; E150-N152 PolarHBondContact O-N 3.26Å; N152-N169 WeakPolarHBondContact CA-OD1 3.39Å; N152-N169 PolarHBondContact OD1-ND2 3.02Å
153	I	97.3	Very high	91.8	Very high	46 Å²	46	46.2 Å²	46.2	24%	0.236	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	127.1	172.3	-60.3	175.2	0	0	0	108.1	L94 K95 G151 N169 L202	L94-I153 CarbonylContact O-C 3.57Å; L94-I153 WeakPolarHBondContact O-CA 3.44Å; K95-I153 HydrophobicContact CB-CG1 4.38Å; K95-I153 HydrophobicContact CG-CG1 4.33Å; G151-I153 PolarHBondContact O-N 3.11Å; I153-N169 PolarHBondContact N-OD1 3.18Å; I153-N169 PolarHBondContact O-N 2.9Å; I153-N169 PolarHBondContact O-OD1 3.25Å; I153-L202 HydrophobicContact CD1-CD1 3.9Å; I153-L202 HydrophobicContact CG1-CD1 4.09Å; I153-L202 HydrophobicContact CG2-CD1 3.85Å
154	I	96.9	Very high	92.3	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.005	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	117.9	179	-58.3	164.7	0	0	0	107.6	R93 L94 I96 L107 L109 L143 R167 I168	R93-I154 CarbonylContact C-O 3.53Å; R93-I154 WeakPolarHBondContact CA-O 3.19Å; L94-I154 PolarHBondContact N-O 2.92Å; L94-I154 PolarHBondContact O-N 2.95Å; I96-I154 HydrophobicContact CD1-CD1 3.88Å; I96-I154 HydrophobicContact CG1-CD1 4.13Å; L107-I154 HydrophobicContact CD2-CD1 3.7Å; L109-I154 HydrophobicContact CD1-CG2 3.66Å; L143-I154 HydrophobicContact CD1-CD1 3.65Å; L143-I154 HydrophobicContact CD1-CG1 4.44Å; L143-I154 HydrophobicContact CD1-CG2 4.06Å; I154-R167 WeakPolarHBondContact CA-O 3.45Å; I154-I168 HydrophobicContact CB-CD1 4.45Å; I154-I168 HydrophobicContact CG1-CD1 3.83Å; I154-I168 HydrophobicContact CG2-CD1 4.15Å
155	A	97.3	Very high	93	Very high	4 Å²	4	44.8 Å²	44.8	3%	0.033	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	134	171.2	0	0	0	0	0	109.3	Q91 V92 R93 W157 Y166 R167	Q91-A155 HydrophobicContact CB-CB 4.44Å; V92-A155 WeakPolarHBondContact O-CA 3.21Å; R93-A155 HydrophobicContact CG-CB 4.02Å; A155-W157 HydrophobicContact CB-CZ3 4.21Å; A155-Y166 CarbonylContact O-C 3.42Å; A155-Y166 WeakPolarHBondContact O-CA 3.14Å; A155-R167 HydrophobicContact CB-CB 4.33Å; A155-R167 HydrophobicContact CB-CG 4.42Å; A155-R167 PolarHBondContact N-O 2.96Å; A155-R167 PolarHBondContact O-N 3.43Å
156	F	97.8	Very high	93.7	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	147.1	171.2	71.6	-80.1	0	0	0	112.2	V92 L94 L109 G110 F111 F165 A188 I190	V92-F156 HydrophobicContact CB-CD1 3.92Å; V92-F156 HydrophobicContact CB-CD2 4.5Å; V92-F156 HydrophobicContact CB-CE1 3.52Å; V92-F156 HydrophobicContact CB-CE2 4.13Å; V92-F156 HydrophobicContact CB-CG 4.41Å; V92-F156 HydrophobicContact CB-CZ 3.65Å; V92-F156 HydrophobicContact CG1-CD1 4.21Å; V92-F156 HydrophobicContact CG1-CE1 3.37Å; V92-F156 HydrophobicContact CG1-CE2 4.48Å; V92-F156 HydrophobicContact CG1-CZ 3.55Å; V92-F156 HydrophobicContact CG2-CE1 4.45Å; V92-F156 HydrophobicContact CG2-CE2 4.26Å; V92-F156 HydrophobicContact CG2-CZ 4.1Å; V92-F156 PolarHBondContact N-O 3.22Å; V92-F156 WeakPolarHBondContact O-CD1 3.03Å; V92-F156 PolarHBondContact O-N 2.95Å; L94-F156 HydrophobicContact CD1-CE1 3.81Å; L94-F156 HydrophobicContact CG-CE1 4.47Å; L109-F156 HydrophobicContact CB-CD1 4.44Å; L109-F156 HydrophobicContact CB-CE1 4.35Å; L109-F156 HydrophobicContact CB-CE2 4.47Å; L109-F156 HydrophobicContact CB-CZ 4.35Å; L109-F156 HydrophobicContact CD1-CD1 3.72Å; L109-F156 HydrophobicContact CD1-CE1 3.99Å; L109-F156 HydrophobicContact CD1-CG 4.29Å; L109-F156 HydrophobicContact CD2-CD1 4.42Å; L109-F156 HydrophobicContact CD2-CE1 3.84Å; L109-F156 HydrophobicContact CD2-CZ 4.19Å; L109-F156 HydrophobicContact CG-CD1 4.44Å; L109-F156 HydrophobicContact CG-CE1 4.29Å; G110-F156 WeakPolarHBondContact O-CE2 3.33Å; F111-F156 HydrophobicContact CE1-CD2 4.41Å; F111-F156 HydrophobicContact CE1-CE2 4.05Å; F111-F156 AromaticContact CE2-CD2 3.87Å; F111-F156 HydrophobicContact CE2-CD2 3.87Å; F111-F156 HydrophobicContact CE2-CE2 4.07Å; F111-F156 AromaticContact CZ-CD2 3.6Å; F111-F156 HydrophobicContact CZ-CD2 3.6Å; F111-F156 AromaticContact CZ-CE2 3.68Å; F111-F156 HydrophobicContact CZ-CE2 3.68Å; F156-F165 VanDerWaalsContact CA-O 3.25Å; F156-F165 WeakPolarHBondContact CA-O 3.29Å; F156-F165 WeakPolarHBondContact CB-O 3.21Å; F156-A188 HydrophobicContact CZ-CB 4.21Å; F156-I190 HydrophobicContact CZ-CG1 4.45Å
157	W	97.8	Very high	94.3	Very high	1 Å²	1	38.9 Å²	38.9	0%	0.004	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	165.4	-175.9	62.9	99.4	0	0	0	110.9	E90 Q91 A155 V164 F165 R167 P173 V207 L212	E90-W157 WeakPolarHBondContact O-CB 3.36Å; Q91-W157 HydrophobicContact CG-CD2 4.21Å; Q91-W157 HydrophobicContact CG-CE3 3.75Å; Q91-W157 HydrophobicContact CG-CZ3 4.32Å; A155-W157 HydrophobicContact CB-CZ3 4.21Å; W157-V164 WeakPolarHBondContact O-CA 3.36Å; W157-F165 HydrophobicContact CD2-CB 4.1Å; W157-F165 HydrophobicContact CH2-CB 4.22Å; W157-F165 HydrophobicContact CZ2-CB 3.65Å; W157-F165 HydrophobicContact CZ2-CG 4.43Å; W157-F165 PolarHBondContact N-O 3.16Å; W157-F165 PolarHBondContact O-N 2.78Å; W157-R167 HydrophobicContact CH2-CB 4.16Å; W157-R167 HydrophobicContact CZ3-CB 4.06Å; W157-P173 HydrophobicContact CH2-CB 3.73Å; W157-P173 HydrophobicContact CH2-CG 3.92Å; W157-P173 HydrophobicContact CZ2-CB 3.78Å; W157-P173 HydrophobicContact CZ2-CG 4.08Å; W157-V207 HydrophobicContact CD2-CG2 4Å; W157-V207 HydrophobicContact CG-CG2 4.21Å; W157-V207 HydrophobicContact CZ2-CG2 4.36Å; W157-L212 HydrophobicContact CZ2-CD2 4.44Å
158	V	97.1	Very high	94.6	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.006	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	138.2	176.1	61.9	0	0	0	0	110.5	L88 Y89 F111 R163 V164 V180 T182 L186	L88-V158 HydrophobicContact CD2-CG1 3.96Å; Y89-V158 PolarHBondContact N-O 2.82Å; F111-V158 HydrophobicContact CD2-CB 4.37Å; F111-V158 HydrophobicContact CE1-CG1 4.35Å; F111-V158 HydrophobicContact CE2-CB 3.93Å; F111-V158 HydrophobicContact CE2-CG1 4.36Å; F111-V158 HydrophobicContact CZ-CB 4.15Å; F111-V158 HydrophobicContact CZ-CG1 4.18Å; V158-R163 WeakPolarHBondContact CA-O 3.42Å; V158-V164 HydrophobicContact CB-CG2 4.29Å; V158-V164 HydrophobicContact CG2-CG2 4.22Å; V158-V180 HydrophobicContact CG2-CB 4.17Å; V158-V180 HydrophobicContact CG2-CG1 4.25Å; V158-T182 HydrophobicContact CG2-CG2 4.02Å; V158-L186 HydrophobicContact CG1-CD1 3.91Å
159	D	95.4	Very high	94.9	Very high	3 Å²	3	40.3 Å²	40.3	2%	0.016	20%	0.196	C	C	.	.			trans	-91.4	169	175	84.6	-5.9	0	0	0	112.8	Y89 K161 G162 R163 F165 T182	Y89-D159 HydrophobicContact CD1-CB 4.25Å; Y89-D159 HydrophobicContact CE1-CB 3.49Å; Y89-D159 VanDerWaalsContact CE1-CB 3.49Å; D159-K161 PolarHBondContact O-N 2.86Å; D159-K161 VanDerWaalsContact OD1-CA 3.3Å; D159-K161 WeakPolarHBondContact OD1-CA 3.41Å; D159-K161 WeakPolarHBondContact OD1-CB 3.15Å; D159-K161 PolarHBondContact OD1-N 3.48Å; D159-G162 PolarHBondContact O-N 2.77Å; D159-G162 PolarHBondContact OD1-N 2.83Å; D159-R163 PolarHBondContact N-O 3.08Å; D159-R163 WeakPolarHBondContact OD1-CB 3.24Å; D159-R163 PolarHBondContact OD1-N 3.36Å; D159-R163 IonicContact OD1-NE 2.69Å; D159-R163 IonicContact OD2-CZ 2.95Å; D159-R163 IonicContact OD2-NE 3.8Å; D159-R163 PolarHBondContact OD2-NE 3.47Å; D159-R163 IonicContact OD2-NH2 3.85Å; D159-R163 PolarHBondContact OD2-NH2 2.59Å; D159-F165 HydrophobicContact CB-CE2 4.2Å; D159-T182 WeakPolarHBondContact O-CG2 3.31Å
160	K	94.8	Very high	95	Very high	145 Å²	145	44 Å²	44	63%	0.63	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-15.2	178.1	76.1	-170.2	178	-179.4	0	115.6	L88 Y89 T182	L88-K160 HydrophobicContact CD1-CB 4.21Å; Y89-K160 HydrophobicContact CE2-CB 4.35Å; Y89-K160 WeakPolarHBondContact OH-CD 3.45Å; Y89-K160 VanDerWaalsContact OH-CG 3.26Å; Y89-K160 WeakPolarHBondContact OH-CG 3.35Å; Y89-K160 PolarHBondContact OH-N 2.97Å; K160-T182 PolarHBondContact O-OG1 3.36Å
161	K	94.6	Very high	94.8	Very high	152 Å²	152	41.6 Å²	41.6	66%	0.661	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.4	4.9	177	-61.1	-173.8	175.7	-172.4	0	112.5	D159 R163	D159-K161 PolarHBondContact O-N 2.86Å; D159-K161 VanDerWaalsContact OD1-CA 3.3Å; D159-K161 WeakPolarHBondContact OD1-CA 3.41Å; D159-K161 WeakPolarHBondContact OD1-CB 3.15Å; D159-K161 PolarHBondContact OD1-N 3.48Å; K161-R163 VanDerWaalsContact C-N 3.29Å; K161-R163 HydrophobicContact CB-CG 4.18Å; K161-R163 PolarHBondContact O-N 2.85Å
162	G	93.2	Very high	94.6	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.01	22%	0.216	C	C	.	.	S	Bend	trans	72.8	21.7	-177.4	0	0	0	0	0	113.7	D159 S178 G179 V180	D159-G162 PolarHBondContact O-N 2.77Å; D159-G162 PolarHBondContact OD1-N 2.83Å; G162-S178 CarbonylContact O-C 3.57Å; G162-S178 WeakPolarHBondContact O-CA 3.4Å; G162-G179 PolarHBondContact O-N 3.49Å; G162-V180 WeakPolarHBondContact CA-O 3.49Å; G162-V180 PolarHBondContact O-N 3.09Å
163	R	95.3	Very high	94.4	Very high	78 Å²	78	45.7 Å²	45.7	29%	0.294	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	127.8	173.1	-53.8	-176.4	-64.4	164.6	6.9	108.8	V158 D159 K161 F165 L175	V158-R163 WeakPolarHBondContact CA-O 3.42Å; D159-R163 PolarHBondContact N-O 3.08Å; D159-R163 WeakPolarHBondContact OD1-CB 3.24Å; D159-R163 PolarHBondContact OD1-N 3.36Å; D159-R163 IonicContact OD1-NE 2.69Å; D159-R163 IonicContact OD2-CZ 2.95Å; D159-R163 IonicContact OD2-NE 3.8Å; D159-R163 PolarHBondContact OD2-NE 3.47Å; D159-R163 IonicContact OD2-NH2 3.85Å; D159-R163 PolarHBondContact OD2-NH2 2.59Å; K161-R163 VanDerWaalsContact C-N 3.29Å; K161-R163 HydrophobicContact CB-CG 4.18Å; K161-R163 PolarHBondContact O-N 2.85Å; R163-F165 HydrophobicContact CB-CE2 3.75Å; R163-F165 HydrophobicContact CB-CZ 4.19Å; R163-L175 HydrophobicContact CB-CD1 3.96Å
164	V	95.8	Very high	94	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	130	176.5	176.9	0	0	0	0	108.9	F111 W157 V158 F176 F177 V180	F111-V164 HydrophobicContact CD2-CG2 3.83Å; F111-V164 HydrophobicContact CE2-CB 4.47Å; F111-V164 HydrophobicContact CE2-CG1 3.89Å; F111-V164 HydrophobicContact CE2-CG2 3.76Å; W157-V164 WeakPolarHBondContact O-CA 3.36Å; V158-V164 HydrophobicContact CB-CG2 4.29Å; V158-V164 HydrophobicContact CG2-CG2 4.22Å; V164-F176 HydrophobicContact CB-CB 4.41Å; V164-F176 HydrophobicContact CG1-CB 4.05Å; V164-F176 HydrophobicContact CG1-CD1 4.06Å; V164-F176 WeakPolarHBondContact O-CB 3.41Å; V164-F176 PolarHBondContact O-N 3.42Å; V164-F177 HydrophobicContact CB-CD1 4.3Å; V164-F177 HydrophobicContact CB-CD2 4.23Å; V164-F177 HydrophobicContact CB-CE1 4.17Å; V164-F177 HydrophobicContact CB-CE2 4.08Å; V164-F177 HydrophobicContact CB-CG 4.34Å; V164-F177 HydrophobicContact CB-CZ 4.06Å; V164-F177 HydrophobicContact CG1-CD1 4.45Å; V164-F177 HydrophobicContact CG1-CE1 4.04Å; V164-F177 HydrophobicContact CG1-CZ 4.16Å; V164-F177 HydrophobicContact CG2-CD2 4.04Å; V164-F177 HydrophobicContact CG2-CE1 4.36Å; V164-F177 HydrophobicContact CG2-CE2 3.55Å; V164-F177 HydrophobicContact CG2-CZ 3.74Å; V164-F177 PolarHBondContact N-O 3.47Å; V164-F177 PolarHBondContact O-N 2.67Å; V164-V180 HydrophobicContact CG2-CG2 3.55Å
165	F	94.9	Very high	93.7	Very high	25 Å²	25	52.5 Å²	52.5	11%	0.11	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	154	174.5	-65.1	-89.8	0	0	0	109.9	F156 W157 D159 R163 M174 L175	F156-F165 VanDerWaalsContact CA-O 3.25Å; F156-F165 WeakPolarHBondContact CA-O 3.29Å; F156-F165 WeakPolarHBondContact CB-O 3.21Å; W157-F165 HydrophobicContact CD2-CB 4.1Å; W157-F165 HydrophobicContact CH2-CB 4.22Å; W157-F165 HydrophobicContact CZ2-CB 3.65Å; W157-F165 HydrophobicContact CZ2-CG 4.43Å; W157-F165 PolarHBondContact N-O 3.16Å; W157-F165 PolarHBondContact O-N 2.78Å; D159-F165 HydrophobicContact CB-CE2 4.2Å; R163-F165 HydrophobicContact CB-CE2 3.75Å; R163-F165 HydrophobicContact CB-CZ 4.19Å; F165-M174 CarbonylContact C-O 3.54Å; F165-M174 VanDerWaalsContact CA-O 3.25Å; F165-M174 WeakPolarHBondContact CA-O 3.1Å; F165-L175 HydrophobicContact CD1-CB 4.33Å; F165-L175 HydrophobicContact CD1-CD1 4.32Å; F165-L175 HydrophobicContact CE1-CB 4.12Å; F165-L175 HydrophobicContact CE1-CD1 3.88Å; F165-L175 HydrophobicContact CE2-CD1 4.48Å; F165-L175 HydrophobicContact CZ-CD1 3.97Å
166	Y	95.5	Very high	93.4	Very high	15 Å²	15	52.7 Å²	52.7	6%	0.059	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	162.2	170.2	79.6	-70.6	0	0	0	111.2	L143 F147 A155 I168 M174 F176	L143-Y166 HydrophobicContact CD2-CD2 3.66Å; L143-Y166 HydrophobicContact CD2-CE2 3.72Å; L143-Y166 HydrophobicContact CD2-CG 4.23Å; F147-Y166 HydrophobicContact CD2-CE2 4.26Å; F147-Y166 AromaticContact CE2-CE2 3.97Å; F147-Y166 HydrophobicContact CE2-CE2 3.97Å; A155-Y166 CarbonylContact O-C 3.42Å; A155-Y166 WeakPolarHBondContact O-CA 3.14Å; Y166-I168 HydrophobicContact CD2-CD1 3.77Å; Y166-I168 HydrophobicContact CD2-CG1 4.14Å; Y166-I168 HydrophobicContact CE2-CD1 3.84Å; Y166-I168 HydrophobicContact CE2-CG1 3.9Å; Y166-M174 HydrophobicContact CD1-CB 3.9Å; Y166-M174 WeakPolarHBondContact CD1-O 3.45Å; Y166-M174 HydrophobicContact CE1-CB 3.49Å; Y166-M174 VanDerWaalsContact CE1-CB 3.49Å; Y166-M174 HydrophobicContact CE1-CG 4.49Å; Y166-M174 HydrophobicContact CE1-SD 4.41Å; Y166-M174 HydrophobicContact CE2-SD 4.49Å; Y166-M174 PolarHBondContact N-O 2.97Å; Y166-M174 PolarHBondContact O-N 2.82Å; Y166-F176 HydrophobicContact CD1-CB 3.7Å; Y166-F176 AromaticContact CD1-CD2 3.86Å; Y166-F176 HydrophobicContact CD1-CD2 3.86Å; Y166-F176 AromaticContact CD1-CG 3.87Å; Y166-F176 HydrophobicContact CD1-CG 3.87Å; Y166-F176 HydrophobicContact CE1-CB 4.32Å; Y166-F176 AromaticContact CE1-CD2 3.89Å; Y166-F176 HydrophobicContact CE1-CD2 3.89Å; Y166-F176 HydrophobicContact CE1-CG 4.35Å; Y166-F176 HydrophobicContact CG-CG 4.49Å
167	R	94.2	Very high	93.1	Very high	64 Å²	64	54.4 Å²	54.4	24%	0.242	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	139.9	177.3	147.5	179.7	-81.1	-161.5	-17.2	108	I154 A155 W157 N169 S171	I154-R167 WeakPolarHBondContact CA-O 3.45Å; A155-R167 HydrophobicContact CB-CB 4.33Å; A155-R167 HydrophobicContact CB-CG 4.42Å; A155-R167 PolarHBondContact N-O 2.96Å; A155-R167 PolarHBondContact O-N 3.43Å; W157-R167 HydrophobicContact CH2-CB 4.16Å; W157-R167 HydrophobicContact CZ3-CB 4.06Å; R167-N169 VanDerWaalsContact CD-O 3.25Å; R167-N169 WeakPolarHBondContact CD-O 3.17Å; R167-N169 WeakPolarHBondContact CG-O 3.39Å; R167-S171 PolarHBondContact NE-O 3.17Å; R167-S171 PolarHBondContact NH2-O 3.49Å
168	I	93.7	Very high	92.9	Very high	14 Å²	14	57.5 Å²	57.5	7%	0.072	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	119.8	173.2	-48.9	-62.3	0	0	0	108.1	F147 I154 Y166 E170 S171	F147-I168 HydrophobicContact CB-CD1 3.97Å; F147-I168 HydrophobicContact CB-CG1 4.38Å; F147-I168 HydrophobicContact CD1-CB 4.48Å; F147-I168 HydrophobicContact CD1-CD1 4.44Å; F147-I168 HydrophobicContact CD1-CG1 3.92Å; F147-I168 HydrophobicContact CD1-CG2 4.12Å; F147-I168 HydrophobicContact CD2-CD1 3.82Å; F147-I168 HydrophobicContact CD2-CG1 3.83Å; F147-I168 HydrophobicContact CE1-CG1 4.15Å; F147-I168 HydrophobicContact CE2-CD1 4.45Å; F147-I168 HydrophobicContact CE2-CG1 4.05Å; F147-I168 HydrophobicContact CG-CD1 3.83Å; F147-I168 HydrophobicContact CG-CG1 3.78Å; F147-I168 HydrophobicContact CG-CG2 4.41Å; F147-I168 HydrophobicContact CZ-CG1 4.21Å; I154-I168 HydrophobicContact CB-CD1 4.45Å; I154-I168 HydrophobicContact CG1-CD1 3.83Å; I154-I168 HydrophobicContact CG2-CD1 4.15Å; Y166-I168 HydrophobicContact CD2-CD1 3.77Å; Y166-I168 HydrophobicContact CD2-CG1 4.14Å; Y166-I168 HydrophobicContact CE2-CD1 3.84Å; Y166-I168 HydrophobicContact CE2-CG1 3.9Å; I168-E170 PolarHBondContact O-N 2.87Å; I168-S171 PolarHBondContact N-OG 3.33Å; I168-S171 VanDerWaalsContact N-OG 3.09Å; I168-S171 VanDerWaalsContact O-CB 3.23Å; I168-S171 WeakPolarHBondContact O-CB 3.2Å; I168-S171 PolarHBondContact O-N 3.49Å; I168-S171 VanDerWaalsContact O-N 3.1Å; I168-S171 PolarHBondContact O-OG 3.28Å
169	N	93.1	Very high	92.5	Very high	64 Å²	64	59.8 Å²	59.8	34%	0.342	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.9	-132.8	-172.6	-52.7	-35.8	0	0	0	109.9	N152 I153 R167 S171	N152-N169 WeakPolarHBondContact CA-OD1 3.39Å; N152-N169 PolarHBondContact OD1-ND2 3.02Å; I153-N169 PolarHBondContact N-OD1 3.18Å; I153-N169 PolarHBondContact O-N 2.9Å; I153-N169 PolarHBondContact O-OD1 3.25Å; R167-N169 VanDerWaalsContact CD-O 3.25Å; R167-N169 WeakPolarHBondContact CD-O 3.17Å; R167-N169 WeakPolarHBondContact CG-O 3.39Å; N169-S171 VanDerWaalsContact C-N 3.33Å; N169-S171 PolarHBondContact O-N 3.18Å
170	E	88.2	Confident	92.6	Very high	143 Å²	143	59.9 Å²	59.9	67%	0.668	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	14	-180	-56.4	-48	131.2	0	0	114.9	I168	I168-E170 PolarHBondContact O-N 2.87Å
171	S	89.3	Confident	92.6	Very high	49 Å²	49	62 Å²	62	34%	0.343	32%	0.32	S	S	.	.	S	Bend	trans	-62.7	163.6	179.2	61.1	0	0	0	0	113.7	R167 I168 N169	R167-S171 PolarHBondContact NE-O 3.17Å; R167-S171 PolarHBondContact NH2-O 3.49Å; I168-S171 PolarHBondContact N-OG 3.33Å; I168-S171 VanDerWaalsContact N-OG 3.09Å; I168-S171 VanDerWaalsContact O-CB 3.23Å; I168-S171 WeakPolarHBondContact O-CB 3.2Å; I168-S171 PolarHBondContact O-N 3.49Å; I168-S171 VanDerWaalsContact O-N 3.1Å; I168-S171 PolarHBondContact O-OG 3.28Å; N169-S171 VanDerWaalsContact C-N 3.33Å; N169-S171 PolarHBondContact O-N 3.18Å
172	S	88.4	Confident	92.6	Very high	94 Å²	94	56.9 Å²	56.9	66%	0.657	30%	0.302	S	S	*	.	P	Polyproline II helix	trans	-61.6	140.9	173.6	-62	0	0	0	0	111.8	M174	S172-M174 PolarHBondContact O-N 2.9Å
173	P	91.5	Very high	92.6	Very high	59 Å²	59	61.4 Å²	61.4	38%	0.383	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-55.5	131.3	173.4	-27.8	36.5	0	0	0	113.2	W157	W157-P173 HydrophobicContact CH2-CB 3.73Å; W157-P173 HydrophobicContact CH2-CG 3.92Å; W157-P173 HydrophobicContact CZ2-CB 3.78Å; W157-P173 HydrophobicContact CZ2-CG 4.08Å
174	M	89.9	Confident	92.5	Very high	91 Å²	91	63.5 Å²	63.5	45%	0.448	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	139.7	179.5	-63.2	-176	73.9	0	0	110.6	F165 Y166 S172 F176	F165-M174 CarbonylContact C-O 3.54Å; F165-M174 VanDerWaalsContact CA-O 3.25Å; F165-M174 WeakPolarHBondContact CA-O 3.1Å; Y166-M174 HydrophobicContact CD1-CB 3.9Å; Y166-M174 WeakPolarHBondContact CD1-O 3.45Å; Y166-M174 HydrophobicContact CE1-CB 3.49Å; Y166-M174 VanDerWaalsContact CE1-CB 3.49Å; Y166-M174 HydrophobicContact CE1-CG 4.49Å; Y166-M174 HydrophobicContact CE1-SD 4.41Å; Y166-M174 HydrophobicContact CE2-SD 4.49Å; Y166-M174 PolarHBondContact N-O 2.97Å; Y166-M174 PolarHBondContact O-N 2.82Å; S172-M174 PolarHBondContact O-N 2.9Å; M174-F176 PolarHBondContact O-N 3.35Å
175	L	89.2	Confident	92.5	Very high	100 Å²	100	67 Å²	67	52%	0.524	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	123.4	172	-179.7	68.6	0	0	0	109.5	R163 F165	R163-L175 HydrophobicContact CB-CD1 3.96Å; F165-L175 HydrophobicContact CD1-CB 4.33Å; F165-L175 HydrophobicContact CD1-CD1 4.32Å; F165-L175 HydrophobicContact CE1-CB 4.12Å; F165-L175 HydrophobicContact CE1-CD1 3.88Å; F165-L175 HydrophobicContact CE2-CD1 4.48Å; F165-L175 HydrophobicContact CZ-CD1 3.97Å
176	F	92.2	Very high	92.7	Very high	8 Å²	8	66 Å²	66	4%	0.035	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	-55.8	-178.3	-160.8	-155.2	0	0	0	112.2	L109 K141 A142 L143 V164 Y166 M174	L109-F176 HydrophobicContact CB-CE1 4.12Å; K141-F176 HydrophobicContact CB-CD1 4.44Å; K141-F176 HydrophobicContact CB-CE1 3.87Å; K141-F176 HydrophobicContact CB-CE2 4.01Å; K141-F176 HydrophobicContact CB-CZ 3.64Å; K141-F176 HydrophobicContact CD-CD2 3.89Å; K141-F176 HydrophobicContact CD-CE2 3.78Å; K141-F176 HydrophobicContact CD-CG 4.47Å; K141-F176 HydrophobicContact CD-CZ 4.3Å; K141-F176 WeakPolarHBondContact CD-O 3.01Å; K141-F176 HydrophobicContact CG-CD2 4.36Å; K141-F176 HydrophobicContact CG-CE2 3.77Å; K141-F176 HydrophobicContact CG-CZ 3.88Å; K141-F176 PolarHBondContact NZ-O 2.84Å; K141-F176 VanDerWaalsContact O-CZ 3.24Å; K141-F176 WeakPolarHBondContact O-CZ 3.09Å; A142-F176 WeakPolarHBondContact O-CE2 3.47Å; L143-F176 HydrophobicContact CD2-CE1 4.46Å; L143-F176 HydrophobicContact CD2-CE2 3.79Å; L143-F176 HydrophobicContact CD2-CZ 3.73Å; L143-F176 HydrophobicContact CG-CZ 4.1Å; V164-F176 HydrophobicContact CB-CB 4.41Å; V164-F176 HydrophobicContact CG1-CB 4.05Å; V164-F176 HydrophobicContact CG1-CD1 4.06Å; V164-F176 WeakPolarHBondContact O-CB 3.41Å; V164-F176 PolarHBondContact O-N 3.42Å; Y166-F176 HydrophobicContact CD1-CB 3.7Å; Y166-F176 AromaticContact CD1-CD2 3.86Å; Y166-F176 HydrophobicContact CD1-CD2 3.86Å; Y166-F176 AromaticContact CD1-CG 3.87Å; Y166-F176 HydrophobicContact CD1-CG 3.87Å; Y166-F176 HydrophobicContact CE1-CB 4.32Å; Y166-F176 AromaticContact CE1-CD2 3.89Å; Y166-F176 HydrophobicContact CE1-CD2 3.89Å; Y166-F176 HydrophobicContact CE1-CG 4.35Å; Y166-F176 HydrophobicContact CG-CG 4.49Å; M174-F176 PolarHBondContact O-N 3.35Å
177	F	90.8	Very high	92.8	Very high	36 Å²	36	66.6 Å²	66.6	16%	0.158	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.1	-177	176	59.5	-94.5	0	0	0	110.1	W139 K141 V164 V180	W139-F177 HydrophobicContact CB-CE2 3.74Å; W139-F177 HydrophobicContact CB-CZ 4.22Å; K141-F177 HydrophobicContact CB-CD1 3.62Å; K141-F177 HydrophobicContact CB-CE1 3.86Å; K141-F177 HydrophobicContact CD-CB 4.27Å; K141-F177 HydrophobicContact CD-CD1 4.08Å; V164-F177 HydrophobicContact CB-CD1 4.3Å; V164-F177 HydrophobicContact CB-CD2 4.23Å; V164-F177 HydrophobicContact CB-CE1 4.17Å; V164-F177 HydrophobicContact CB-CE2 4.08Å; V164-F177 HydrophobicContact CB-CG 4.34Å; V164-F177 HydrophobicContact CB-CZ 4.06Å; V164-F177 HydrophobicContact CG1-CD1 4.45Å; V164-F177 HydrophobicContact CG1-CE1 4.04Å; V164-F177 HydrophobicContact CG1-CZ 4.16Å; V164-F177 HydrophobicContact CG2-CD2 4.04Å; V164-F177 HydrophobicContact CG2-CE1 4.36Å; V164-F177 HydrophobicContact CG2-CE2 3.55Å; V164-F177 HydrophobicContact CG2-CZ 3.74Å; V164-F177 PolarHBondContact N-O 3.47Å; V164-F177 PolarHBondContact O-N 2.67Å; F177-V180 HydrophobicContact CD2-CG2 4.35Å; F177-V180 HydrophobicContact CE2-CG2 3.64Å
178	S	92.9	Very high	93	Very high	66 Å²	66	63.6 Å²	63.6	46%	0.462	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	165.4	-179.5	-62.1	0	0	0	0	111.2	G162	G162-S178 CarbonylContact O-C 3.57Å; G162-S178 WeakPolarHBondContact O-CA 3.4Å
179	G	90.4	Very high	93.2	Very high	49 Å²	49	62.9 Å²	62.9	51%	0.505	36%	0.358	S	S	.	.			trans	102.5	11.7	-179.6	0	0	0	0	0	114.7	W139 G162	W139-G179 PolarHBondContact NE1-O 3.21Å; W139-G179 VanDerWaalsContact NE1-O 3.11Å; G162-G179 PolarHBondContact O-N 3.49Å
180	V	96	Very high	93.5	Very high	5 Å²	5	59.9 Å²	59.9	3%	0.03	34%	0.342	C	S	.	.			trans	-69	133	169.9	-178.2	0	0	0	0	109	F111 W139 V158 G162 V164 F177 T182 L186	F111-V180 HydrophobicContact CB-CG1 4.38Å; W139-V180 HydrophobicContact CB-CG2 3.98Å; W139-V180 HydrophobicContact CD2-CB 4.43Å; W139-V180 HydrophobicContact CD2-CG1 4.3Å; W139-V180 HydrophobicContact CD2-CG2 4.23Å; W139-V180 HydrophobicContact CE3-CG1 4.03Å; W139-V180 HydrophobicContact CG-CG2 3.96Å; W139-V180 HydrophobicContact CZ3-CG1 4.3Å; V158-V180 HydrophobicContact CG2-CB 4.17Å; V158-V180 HydrophobicContact CG2-CG1 4.25Å; G162-V180 WeakPolarHBondContact CA-O 3.49Å; G162-V180 PolarHBondContact O-N 3.09Å; V164-V180 HydrophobicContact CG2-CG2 3.55Å; F177-V180 HydrophobicContact CD2-CG2 4.35Å; F177-V180 HydrophobicContact CE2-CG2 3.64Å; V180-T182 PolarHBondContact O-N 2.7Å; V180-L186 HydrophobicContact CG1-CD1 3.61Å; V180-L186 HydrophobicContact CG1-CD2 3.89Å; V180-L186 HydrophobicContact CG1-CG 4.43Å
181	R	94.9	Very high	93.9	Very high	188 Å²	188	53.1 Å²	53.1	71%	0.709	31%	0.31	S	S	*	.			trans	-82.7	116.7	178	-67.3	179.1	180	-173.2	-0.5	110	W139	W139-R181 HydrophobicContact CH2-CB 3.95Å; W139-R181 HydrophobicContact CH2-CG 4.23Å; W139-R181 HydrophobicContact CZ2-CB 4.05Å; W139-R181 HydrophobicContact CZ2-CG 3.86Å
182	T	94.9	Very high	94.3	Very high	46 Å²	46	50.8 Å²	50.8	28%	0.282	29%	0.293	S	S	.	.			trans	-99.7	6	-173.6	49.5	0	0	0	0	114.6	L88 V158 D159 K160 V180 L186	L88-T182 HydrophobicContact CD2-CG2 3.71Å; V158-T182 HydrophobicContact CG2-CG2 4.02Å; D159-T182 WeakPolarHBondContact O-CG2 3.31Å; K160-T182 PolarHBondContact O-OG1 3.36Å; V180-T182 PolarHBondContact O-N 2.7Å; T182-L186 HydrophobicContact CG2-CD1 4.4Å
183	A	92.9	Very high	94.2	Very high	95 Å²	95	47.7 Å²	47.7	79%	0.785	27%	0.268	S	S	*	.	S	Bend	trans	-79	-22.5	176	0	0	0	0	0	113.1
184	E	93	Very high	93.7	Very high	123 Å²	123	44.9 Å²	44.9	58%	0.575	25%	0.25	S	C	*	.	S	Bend	trans	-107.4	157.8	179.5	-59	-58.9	153.2	0	0	110.3
185	P	96.6	Very high	93.1	Very high	72 Å²	72	41.2 Å²	41.2	47%	0.468	23%	0.232	S	C	.	.			trans	-56.7	140.8	169.4	-22.6	33.9	0	0	0	111.8	P85 W187	P85-P185 HydrophobicContact CB-CB 4.18Å; P85-P185 HydrophobicContact CG-CB 4.19Å; P185-W187 HydrophobicContact CB-CH2 3.98Å; P185-W187 HydrophobicContact CB-CZ3 3.84Å; P185-W187 WeakPolarHBondContact O-CZ3 3.44Å
186	L	98.3	Very high	93.2	Very high	5 Å²	5	36.5 Å²	36.5	3%	0.026	21%	0.207	C	C	.	.	B	Isolated β-bridge	trans	-119.8	134.2	-178.6	-67.9	171.7	0	0	0	110.5	P85 I86 F111 T112 W139 V158 V180 T182	P85-L186 CarbonylContact C-O 3.53Å; P85-L186 VanDerWaalsContact CA-O 3.24Å; P85-L186 WeakPolarHBondContact CA-O 3.35Å; I86-L186 PolarHBondContact N-O 3.24Å; F111-L186 HydrophobicContact CB-CD2 4.36Å; F111-L186 HydrophobicContact CD1-CB 4.38Å; T112-L186 CarbonylContact O-C 3.46Å; T112-L186 WeakPolarHBondContact O-CA 3.13Å; W139-L186 HydrophobicContact CZ3-CD2 4.1Å; V158-L186 HydrophobicContact CG1-CD1 3.91Å; V180-L186 HydrophobicContact CG1-CD1 3.61Å; V180-L186 HydrophobicContact CG1-CD2 3.89Å; V180-L186 HydrophobicContact CG1-CG 4.43Å; T182-L186 HydrophobicContact CG2-CD1 4.4Å
187	W	98.5	Very high	93	Very high	27 Å²	27	37.4 Å²	37.4	10%	0.102	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	148.5	169.7	-69.6	-106.7	0	0	0	109.5	R84 P85 F111 T112 D115 P116 P185	R84-W187 VanDerWaalsContact O-CD1 3.25Å; P85-W187 HydrophobicContact CG-CD2 4.36Å; P85-W187 HydrophobicContact CG-CH2 4.18Å; P85-W187 HydrophobicContact CG-CZ2 3.66Å; F111-W187 CarbonylContact C-O 3.48Å; F111-W187 WeakPolarHBondContact CA-O 3.49Å; T112-W187 HydrophobicContact CG2-CB 4.01Å; T112-W187 PolarHBondContact N-O 2.86Å; T112-W187 PolarHBondContact O-N 3.15Å; D115-W187 HydrophobicContact CB-CH2 3.68Å; D115-W187 HydrophobicContact CB-CZ2 3.82Å; D115-W187 HydrophobicContact CB-CZ3 4.27Å; P116-W187 VanDerWaalsContact CD-CG 3.42Å; P116-W187 HydrophobicContact CG-CB 3.99Å; P116-W187 HydrophobicContact CG-CD2 4.38Å; P116-W187 HydrophobicContact CG-CG 3.76Å; P185-W187 HydrophobicContact CB-CH2 3.98Å; P185-W187 HydrophobicContact CB-CZ3 3.84Å; P185-W187 WeakPolarHBondContact O-CZ3 3.44Å
188	A	98.4	Very high	93.2	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.008	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	143.1	171.9	0	0	0	0	0	109.9	F81 S82 I86 V92 F156 I190	F81-A188 WeakPolarHBondContact CA-O 3.38Å; S82-A188 PolarHBondContact N-O 3.37Å; S82-A188 VanDerWaalsContact N-O 3.17Å; S82-A188 PolarHBondContact OG-N 2.77Å; I86-A188 HydrophobicContact CD1-CB 4.29Å; I86-A188 HydrophobicContact CG1-CB 4.08Å; V92-A188 HydrophobicContact CG1-CB 4.13Å; V92-A188 HydrophobicContact CG2-CB 3.88Å; F156-A188 HydrophobicContact CZ-CB 4.21Å; A188-I190 HydrophobicContact CB-CD1 3.76Å
189	L	98.6	Very high	93.5	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	122.8	173.3	-171.8	168	0	0	0	108.2	F81 L109 G110 A128 L132 F138 A140	F81-L189 HydrophobicContact CD1-CB 4.34Å; F81-L189 HydrophobicContact CD1-CG 4.28Å; F81-L189 HydrophobicContact CE1-CB 4.36Å; F81-L189 HydrophobicContact CE1-CD1 4.07Å; F81-L189 HydrophobicContact CE1-CG 3.86Å; L109-L189 WeakPolarHBondContact CA-O 3.35Å; G110-L189 PolarHBondContact N-O 3.23Å; G110-L189 PolarHBondContact O-N 3Å; A128-L189 HydrophobicContact CB-CD2 3.82Å; L132-L189 HydrophobicContact CD1-CD1 4.11Å; F138-L189 HydrophobicContact CD1-CD1 3.92Å; A140-L189 HydrophobicContact CB-CD2 4.07Å
190	I	98.5	Very high	93.9	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.005	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	116.4	-178.2	-54.6	88	0	0	0	108.5	F51 I79 T80 L94 L107 L109 F156 A188 V192	F51-I190 HydrophobicContact CE1-CD1 4.22Å; F51-I190 HydrophobicContact CE1-CG1 4.44Å; I79-I190 CarbonylContact C-O 3.58Å; T80-I190 PolarHBondContact N-O 2.76Å; T80-I190 PolarHBondContact O-N 3.17Å; T80-I190 PolarHBondContact OG1-O 3.06Å; L94-I190 HydrophobicContact CD1-CG1 3.91Å; L94-I190 HydrophobicContact CD1-CG2 4.06Å; L94-I190 HydrophobicContact CD2-CG1 4.48Å; L107-I190 HydrophobicContact CD1-CG2 3.75Å; L109-I190 HydrophobicContact CD2-CB 4.23Å; L109-I190 HydrophobicContact CD2-CG1 4Å; L109-I190 HydrophobicContact CD2-CG2 3.88Å; F156-I190 HydrophobicContact CZ-CG1 4.45Å; A188-I190 HydrophobicContact CB-CD1 3.76Å; I190-V192 HydrophobicContact CG2-CG2 4.13Å
191	D	97.5	Very high	94	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	103.1	173	-176.1	10	0	0	0	109	I79 R108 A128 Y193	I79-D191 HydrophobicContact CG1-CB 4.26Å; R108-D191 HydrophobicContact CB-CB 4.1Å; R108-D191 WeakPolarHBondContact CD-OD2 3.47Å; R108-D191 IonicContact CZ-OD2 3.95Å; R108-D191 PolarHBondContact N-O 3.24Å; R108-D191 VanDerWaalsContact N-O 3.11Å; R108-D191 IonicContact NE-OD2 3.62Å; R108-D191 IonicContact NH1-OD2 3.34Å; R108-D191 PolarHBondContact NH1-OD2 3.18Å; R108-D191 PolarHBondContact O-N 3.07Å; A128-D191 HydrophobicContact CB-CB 3.65Å; A128-D191 WeakPolarHBondContact CB-OD2 3.31Å; A128-D191 PolarHBondContact N-OD2 3.17Å; D191-Y193 PolarHBondContact O-N 3.26Å
192	V	96.2	Very high	94	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.145	C	C	.	.			trans	-74.6	75.3	-177.3	-173.7	0	0	0	0	108.7	I60 V69 R71 A78 L107 I190 T196 V199	I60-V192 HydrophobicContact CD1-CB 4.3Å; I60-V192 HydrophobicContact CD1-CG2 4.34Å; V69-V192 HydrophobicContact CG2-CG2 4.09Å; R71-V192 HydrophobicContact CB-CG1 4.48Å; R71-V192 PolarHBondContact NH1-O 3.08Å; A78-V192 HydrophobicContact CB-CB 4.14Å; A78-V192 WeakPolarHBondContact CB-O 3.36Å; A78-V192 PolarHBondContact O-N 3.16Å; L107-V192 HydrophobicContact CD1-CG2 4.44Å; I190-V192 HydrophobicContact CG2-CG2 4.13Å; V192-T196 HydrophobicContact CG1-CG2 4.3Å; V192-T196 WeakPolarHBondContact CG1-O 3.41Å; V192-V199 HydrophobicContact CG2-CG2 3.77Å
193	Y	86.9	Confident	93.8	Very high	30 Å²	30	28.4 Å²	28.4	12%	0.118	16%	0.157	C	C	.	.			trans	-106.8	149.8	-165.9	180	-90.7	0	0	0	113.6	R71 F75 C76 S104 R108 Y127 D191 L195 T196	R71-Y193 VanDerWaalsContact NH1-C 3.29Å; F75-Y193 AromaticContact CD2-CE2 3.7Å; F75-Y193 HydrophobicContact CD2-CE2 3.7Å; F75-Y193 AromaticContact CD2-CZ 3.91Å; F75-Y193 HydrophobicContact CE2-CE2 4.18Å; F75-Y193 WeakPolarHBondContact O-CD2 3.39Å; F75-Y193 WeakPolarHBondContact O-CE2 3.48Å; C76-Y193 HydrophobicContact CB-CE2 4.41Å; S104-Y193 WeakPolarHBondContact O-CE1 3.4Å; R108-Y193 VanDerWaalsContact CZ-CD1 3.48Å; R108-Y193 VanDerWaalsContact NE-CG 3.34Å; R108-Y193 VanDerWaalsContact NH2-CE1 3.29Å; R108-Y193 VanDerWaalsContact NH2-CE2 3.29Å; Y127-Y193 HydrophobicContact CD1-CD2 4.17Å; Y127-Y193 AromaticContact CD1-CE2 3.73Å; Y127-Y193 HydrophobicContact CD1-CE2 3.73Å; Y127-Y193 AromaticContact CE1-CE2 3.78Å; Y127-Y193 HydrophobicContact CE1-CE2 3.78Å; D191-Y193 PolarHBondContact O-N 3.26Å; Y193-L195 PolarHBondContact O-N 3.23Å; Y193-T196 PolarHBondContact O-N 3.48Å; Y193-T196 VanDerWaalsContact O-N 3.16Å
194	G	80.2	Confident	93.6	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.9	-123.2	167	0	0	0	0	0	112.9	R71 F75 G105 T196	R71-G194 PolarHBondContact NH1-O 2.78Å; R71-G194 PolarHBondContact NH2-O 3.3Å; F75-G194 PolarHBondContact O-N 2.83Å; F75-G194 VanDerWaalsContact O-N 3.14Å; G105-G194 CarbonylContact O-C 3.47Å; G105-G194 WeakPolarHBondContact O-CA 3.24Å; G194-T196 PolarHBondContact O-N 3.43Å; G194-T196 VanDerWaalsContact O-N 3.14Å
195	L	79	Confident	93.4	Very high	14 Å²	14	24.7 Å²	24.7	7%	0.073	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-30.3	179.2	-73.6	171.7	0	0	0	114	K99 Q100 W103 G105 E145 A148 Y193	K99-L195 CarbonylContact C-O 3.51Å; K99-L195 VanDerWaalsContact CA-O 3.27Å; K99-L195 WeakPolarHBondContact CA-O 3.33Å; K99-L195 WeakPolarHBondContact CG-O 3.36Å; Q100-L195 PolarHBondContact N-O 2.92Å; W103-L195 WeakPolarHBondContact O-CD2 3.3Å; W103-L195 VanDerWaalsContact O-CG 3.3Å; W103-L195 WeakPolarHBondContact O-CG 3.46Å; G105-L195 PolarHBondContact O-N 3.41Å; E145-L195 HydrophobicContact CB-CD1 3.67Å; E145-L195 HydrophobicContact CG-CD1 3.86Å; E145-L195 WeakPolarHBondContact OE2-CD1 3.32Å; A148-L195 HydrophobicContact CB-CB 3.74Å; A148-L195 HydrophobicContact CB-CD1 4.1Å; Y193-L195 PolarHBondContact O-N 3.23Å
196	T	90	Very high	93	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	117.9	-179.9	-51.1	0	0	0	0	109.7	R71 I96 L107 V192 Y193 G194 V199	R71-T196 PolarHBondContact NH1-O 3.16Å; I96-T196 HydrophobicContact CG1-CG2 4.49Å; I96-T196 HydrophobicContact CG2-CG2 4.29Å; L107-T196 HydrophobicContact CD1-CG2 4.2Å; V192-T196 HydrophobicContact CG1-CG2 4.3Å; V192-T196 WeakPolarHBondContact CG1-O 3.41Å; Y193-T196 PolarHBondContact O-N 3.48Å; Y193-T196 VanDerWaalsContact O-N 3.16Å; G194-T196 PolarHBondContact O-N 3.43Å; G194-T196 VanDerWaalsContact O-N 3.14Å; T196-V199 HydrophobicContact CG2-CG1 3.57Å
197	R	88.3	Confident	92.2	Very high	27 Å²	27	27 Å²	27	10%	0.102	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	-28.3	176.9	-171.6	179.9	-172.5	-179.7	5.4	112.7	K70 R71 Q72 K98 Q100 E405	K70-R197 CarbonylContact C-O 3.58Å; K70-R197 WeakPolarHBondContact CA-O 3.21Å; R71-R197 HydrophobicContact CB-CG 4.4Å; R71-R197 PolarHBondContact N-O 2.88Å; R71-R197 VanDerWaalsContact O-CG 3.32Å; R71-R197 WeakPolarHBondContact O-CG 3.26Å; R71-R197 PolarHBondContact O-NE 2.78Å; Q72-R197 PolarHBondContact O-NH2 2.77Å; K98-R197 HydrophobicContact CB-CB 4.27Å; K98-R197 HydrophobicContact CG-CB 4.17Å; K98-R197 PolarHBondContact O-N 3.47Å; Q100-R197 HydrophobicContact CB-CB 3.86Å; R197-E405 IonicContact CZ-OE1 3.52Å; R197-E405 IonicContact NH1-OE1 3.47Å; R197-E405 PolarHBondContact NH1-OE1 3.12Å
198	G	95.8	Very high	91	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	137.9	-179.1	0	0	0	0	0	112.6	V69 T97 K98	V69-G198 WeakPolarHBondContact O-CA 3.45Å; T97-G198 PolarHBondContact N-O 2.82Å; T97-G198 PolarHBondContact OG1-O 2.95Å; K98-G198 PolarHBondContact N-O 2.85Å; K98-G198 PolarHBondContact O-N 2.88Å
199	V	98.2	Very high	89.1	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	152.1	173.5	-64.4	0	0	0	0	111.2	F51 V69 L94 K95 T97 L107 V192 T196	F51-V199 HydrophobicContact CZ-CG2 3.88Å; V69-V199 HydrophobicContact CG2-CG2 3.49Å; V69-V199 VanDerWaalsContact CG2-CG2 3.49Å; V69-V199 PolarHBondContact N-O 2.95Å; V69-V199 PolarHBondContact O-N 3.49Å; L94-V199 HydrophobicContact CD2-CG2 4.46Å; K95-V199 CarbonylContact O-C 3.58Å; K95-V199 VanDerWaalsContact O-CA 3.27Å; K95-V199 WeakPolarHBondContact O-CA 3.28Å; T97-V199 PolarHBondContact OG1-N 2.81Å; L107-V199 HydrophobicContact CD1-CG1 4.2Å; L107-V199 HydrophobicContact CD2-CG1 4.44Å; V192-V199 HydrophobicContact CG2-CG2 3.77Å; T196-V199 HydrophobicContact CG2-CG1 3.57Å
200	Q	98.3	Very high	87.1	Confident	62 Å²	62	39.3 Å²	39.3	29%	0.29	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	130	175.6	-178.7	-177.8	24.7	0	0	109.7	K67 T68 L94 K95 T97	K67-Q200 CarbonylContact O-C 3.56Å; K67-Q200 VanDerWaalsContact O-CA 3.26Å; K67-Q200 WeakPolarHBondContact O-CA 3.47Å; T68-Q200 HydrophobicContact CG2-CB 4.27Å; L94-Q200 CarbonylContact C-O 3.6Å; L94-Q200 WeakPolarHBondContact CA-O 3.45Å; K95-Q200 HydrophobicContact CB-CB 4.49Å; K95-Q200 PolarHBondContact N-O 2.8Å; K95-Q200 PolarHBondContact O-N 3.34Å; T97-Q200 HydrophobicContact CG2-CB 3.61Å
201	L	98.1	Very high	85	Confident	2 Å²	2	43.3 Å²	43.3	1%	0.01	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	127	167.9	-83.2	165.7	0	0	0	109.9	L49 F51 K67 V92 R93 L94	L49-L201 HydrophobicContact CD2-CD2 4.15Å; L49-L201 HydrophobicContact CG-CD1 4.43Å; L49-L201 HydrophobicContact CG-CD2 4.2Å; F51-L201 HydrophobicContact CD1-CD1 3.83Å; F51-L201 HydrophobicContact CD2-CD1 3.71Å; F51-L201 HydrophobicContact CD2-CG 4.21Å; F51-L201 HydrophobicContact CE1-CD1 3.85Å; F51-L201 HydrophobicContact CE1-CG 4.08Å; F51-L201 HydrophobicContact CE2-CB 4.19Å; F51-L201 HydrophobicContact CE2-CD1 3.72Å; F51-L201 HydrophobicContact CE2-CG 3.71Å; F51-L201 HydrophobicContact CG-CD1 3.76Å; F51-L201 HydrophobicContact CZ-CD1 3.79Å; F51-L201 HydrophobicContact CZ-CG 3.62Å; K67-L201 PolarHBondContact O-N 2.81Å; V92-L201 HydrophobicContact CG1-CD2 3.83Å; R93-L201 WeakPolarHBondContact O-CA 3.47Å; L94-L201 HydrophobicContact CD2-CD2 3.57Å; L94-L201 HydrophobicContact CD2-CG 3.86Å; L94-L201 HydrophobicContact CG-CD2 4.36Å
202	L	96.1	Very high	83	Confident	39 Å²	39	45 Å²	45	20%	0.204	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	169	168.5	-52	-177.9	0	0	0	109.2	R93 K95 I153 S204	R93-L202 HydrophobicContact CB-CB 3.93Å; R93-L202 PolarHBondContact O-N 2.74Å; K95-L202 HydrophobicContact CB-CD1 4.24Å; K95-L202 HydrophobicContact CB-CD2 4.13Å; K95-L202 HydrophobicContact CB-CG 4.25Å; I153-L202 HydrophobicContact CD1-CD1 3.9Å; I153-L202 HydrophobicContact CG1-CD1 4.09Å; I153-L202 HydrophobicContact CG2-CD1 3.85Å; L202-S204 PolarHBondContact O-N 2.83Å
203	D	90.5	Very high	80.7	Confident	99 Å²	99	54.2 Å²	54.2	53%	0.529	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	136.1	180	-57.7	-53.7	0	0	0	111.5	K67	K67-D203 IonicContact NZ-OD1 2.76Å; K67-D203 PolarHBondContact NZ-OD1 3.38Å; K67-D203 IonicContact NZ-OD2 3.67Å
204	S	88.4	Confident	78.5	Confident	39 Å²	39	57.6 Å²	57.6	27%	0.273	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	140.4	-175	51.7	0	0	0	0	112.2	R84 E90 Q91 L202	R84-S204 PolarHBondContact NH2-OG 3.4Å; E90-S204 WeakPolarHBondContact OE1-CB 3.2Å; E90-S204 PolarHBondContact OE1-OG 3.26Å; Q91-S204 WeakPolarHBondContact O-CA 3.5Å; L202-S204 PolarHBondContact O-N 2.83Å
205	E	88.3	Confident	76.6	Confident	100 Å²	100	69.3 Å²	69.3	47%	0.467	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	137.9	-177.1	-169.1	-179.9	151.4	0	0	110.5	Q91 R93	Q91-E205 WeakPolarHBondContact CB-O 3.46Å; Q91-E205 WeakPolarHBondContact CG-O 3.21Å; Q91-E205 PolarHBondContact N-O 3.19Å; R93-E205 IonicContact CZ-OE2 3.89Å; R93-E205 IonicContact NH1-OE2 3.75Å; R93-E205 PolarHBondContact NH1-OE2 3.33Å
206	I	89	Confident	74.5	Confident	115 Å²	115	73 Å²	73	59%	0.59	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.4	124.5	179.5	-61	172.8	0	0	0	109.4	P208	I206-P208 WeakPolarHBondContact O-CD 3.49Å
207	V	81.3	Confident	72.1	Confident	10 Å²	10	83.6 Å²	83.6	6%	0.061	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-70.5	121.4	175.8	-176.1	0	0	0	0	110.4	Y89 Q91 W157 C211 L212	Y89-V207 WeakPolarHBondContact O-CG2 3.45Å; Y89-V207 PolarHBondContact O-N 3.04Å; Q91-V207 HydrophobicContact CG-CG2 3.5Å; Q91-V207 VanDerWaalsContact NE2-CG2 3.3Å; W157-V207 HydrophobicContact CD2-CG2 4Å; W157-V207 HydrophobicContact CG-CG2 4.21Å; W157-V207 HydrophobicContact CZ2-CG2 4.36Å; V207-C211 HydrophobicContact CG1-CB 4.19Å; V207-L212 HydrophobicContact CG1-CD1 4.49Å; V207-L212 HydrophobicContact CG1-CD2 4.03Å; V207-L212 HydrophobicContact CG1-CG 4.16Å
208	P	73.8	Confident	69.4	Low	71 Å²	71	87.6 Å²	87.6	46%	0.461	45%	0.454	S	S	.	.	P	Polyproline II helix	trans	-60.5	134.6	172.9	-22.9	34.6	0	0	0	110.8	I206 D210 C211	I206-P208 WeakPolarHBondContact O-CD 3.49Å; P208-D210 PolarHBondContact O-N 2.78Å; P208-C211 WeakPolarHBondContact O-CB 3.29Å; P208-C211 PolarHBondContact O-N 3.21Å; P208-C211 VanDerWaalsContact O-N 3.08Å
209	P	57.5	Low	66.5	Low	96 Å²	96	93.6 Å²	93.6	62%	0.623	49%	0.49	S	S	*	.	G	3₁₀ helix	trans	-54.9	-30.2	-175.9	-29.5	36	0	0	0	115	C211 L212	P209-C211 VanDerWaalsContact C-N 3.3Å; P209-C211 PolarHBondContact O-N 2.95Å; P209-L212 PolarHBondContact O-N 2.82Å
210	D	57.8	Low	63.4	Low	120 Å²	120	100.3 Å²	100.3	64%	0.642	53%	0.531	S	S	*	.	G	3₁₀ helix	trans	-70.7	-21.3	-178.2	-67	-60	0	0	0	114.2	P208 L212 R213	P208-D210 PolarHBondContact O-N 2.78Å; D210-L212 PolarHBondContact O-N 3.05Å; D210-R213 IonicContact OD1-NH1 3.97Å
211	C	54.4	Low	60.1	Low	85 Å²	85	108 Å²	108	57%	0.574	56%	0.557	S	S	*	*	G	3₁₀ helix	trans	-73.9	-3.9	177.6	-59.8	0	0	0	0	113.5	V207 P208 P209	V207-C211 HydrophobicContact CG1-CB 4.19Å; P208-C211 WeakPolarHBondContact O-CB 3.29Å; P208-C211 PolarHBondContact O-N 3.21Å; P208-C211 VanDerWaalsContact O-N 3.08Å; P209-C211 VanDerWaalsContact C-N 3.3Å; P209-C211 PolarHBondContact O-N 2.95Å
212	L	54.3	Low	57.1	Low	35 Å²	35	113.6 Å²	113.6	18%	0.183	60%	0.597	C	S	.	*	G	3₁₀ helix	trans	-104.3	8.7	-171.4	-62.1	175.4	0	0	0	114.9	Y89 W157 V207 P209 D210 P214	Y89-L212 HydrophobicContact CD1-CD1 3.47Å; Y89-L212 VanDerWaalsContact CD1-CD1 3.47Å; Y89-L212 HydrophobicContact CE1-CD1 3.27Å; W157-L212 HydrophobicContact CZ2-CD2 4.44Å; V207-L212 HydrophobicContact CG1-CD1 4.49Å; V207-L212 HydrophobicContact CG1-CD2 4.03Å; V207-L212 HydrophobicContact CG1-CG 4.16Å; P209-L212 PolarHBondContact O-N 2.82Å; D210-L212 PolarHBondContact O-N 3.05Å; L212-P214 VanDerWaalsContact O-CD 3.26Å; L212-P214 WeakPolarHBondContact O-CD 3.12Å
213	R	49.2	Very low	54	Low	194 Å²	194	117.3 Å²	117.3	73%	0.732	63%	0.626	S	S	*	*			trans	-73.8	115	163.8	-71.8	-171.1	179.2	102.1	-2.9	108.4	D210 R215	D210-R213 IonicContact OD1-NH1 3.97Å; R213-R215 PolarHBondContact O-N 3.49Å
214	P	39.7	Very low	51.1	Low	102 Å²	102	117.9 Å²	117.9	66%	0.662	64%	0.638	S	S	*	*			trans	-58.2	137	158.9	-11.6	28	0	0	0	106.6	L212 S216	L212-P214 VanDerWaalsContact O-CD 3.26Å; L212-P214 WeakPolarHBondContact O-CD 3.12Å; P214-S216 VanDerWaalsContact C-N 3.3Å; P214-S216 PolarHBondContact O-N 2.75Å
215	R	41.3	Very low	48.4	Very low	246 Å²	246	123.7 Å²	123.7	93%	0.928	67%	0.665	S	S	*	*			trans	-66.8	99.7	165.2	-76.4	-157.9	177.2	-157.1	1.6	107.4	R213 F217	R213-R215 PolarHBondContact O-N 3.49Å; R215-F217 PolarHBondContact O-N 2.66Å
216	S	34.5	Very low	45.7	Very low	91 Å²	91	129.8 Å²	129.8	64%	0.636	68%	0.684	S	S	*	*			trans	-49.7	138.3	167.5	-53.3	0	0	0	0	108.9	P214 T218	P214-S216 VanDerWaalsContact C-N 3.3Å; P214-S216 PolarHBondContact O-N 2.75Å; S216-T218 PolarHBondContact O-N 3.08Å
217	F	39.7	Very low	42.9	Very low	223 Å²	223	135.4 Å²	135.4	98%	0.978	70%	0.698	S	S	*	*			trans	-66.8	82.3	165.3	-85.2	-100.4	0	0	0	108.8	R215	R215-F217 PolarHBondContact O-N 2.66Å
218	T	31.7	Very low	40.3	Very low	111 Å²	111	143.8 Å²	143.8	68%	0.681	74%	0.736	S	S	*	*			trans	-113.6	107.3	167.6	50.9	0	0	0	0	108	S216 V220	S216-T218 PolarHBondContact O-N 3.08Å; T218-V220 PolarHBondContact O-N 2.91Å
219	T	35.5	Very low	38.2	Very low	126 Å²	126	144.7 Å²	144.7	77%	0.773	75%	0.75	S	S	*	*			trans	-23.9	110.1	169.6	-45.8	0	0	0	0	113.1	R221	T219-R221 VanDerWaalsContact C-N 3.27Å; T219-R221 PolarHBondContact O-N 3.24Å
220	V	31.6	Very low	37	Very low	141 Å²	141	146.9 Å²	146.9	86%	0.855	76%	0.756	S	S	*	*			trans	-70.9	92.8	164.4	-179.9	0	0	0	0	106.9	T218 S222	T218-V220 PolarHBondContact O-N 2.91Å; V220-S222 PolarHBondContact O-N 3.41Å
221	R	30.5	Very low	35.7	Very low	222 Å²	222	147.6 Å²	147.6	84%	0.838	76%	0.76	S	S	*	*			trans	-61.7	123.5	160.4	-83	-176.5	167.3	-179	-4.2	107.3	T219 S223	T219-R221 VanDerWaalsContact C-N 3.27Å; T219-R221 PolarHBondContact O-N 3.24Å; R221-S223 PolarHBondContact O-N 3.48Å
222	S	34.7	Very low	34.6	Very low	120 Å²	120	147 Å²	147	84%	0.839	76%	0.756	S	S	*	*			trans	-61.7	124.7	169.4	40.2	0	0	0	0	110.1	V220	V220-S222 PolarHBondContact O-N 3.41Å
223	S	29.9	Very low	33.5	Very low	117 Å²	117	155.5 Å²	155.5	82%	0.818	79%	0.786	S	S	*	*			trans	-124.7	103.7	163.5	59	0	0	0	0	108.7	R221	R221-S223 PolarHBondContact O-N 3.48Å
224	S	29.2	Very low	32.6	Very low	112 Å²	112	154 Å²	154	78%	0.783	79%	0.791	S	S	*	*			trans	-54	145.2	178.1	53.1	0	0	0	0	114.7
225	L	32.7	Very low	32	Very low	160 Å²	160	153.7 Å²	153.7	84%	0.838	79%	0.792	S	S	*	*			trans	-148.6	109.6	133.1	-97.2	178.2	0	0	0	109.8
226	R	30.4	Very low	31.2	Very low	228 Å²	228	148.5 Å²	148.5	86%	0.86	79%	0.788	S	S	*	*			trans	19.7	147.4	146.3	-58.6	-177	179.2	-162.2	-2.4	119.7
227	R	31	Very low	30.8	Very low	234 Å²	234	149.7 Å²	149.7	88%	0.883	80%	0.796	S	S	*	*			cis	157.4	123.9	-8	-152.8	-168.7	-163.6	-171.4	2.8	103.2
228	E	26.5	Very low	30.2	Very low	186 Å²	186	146.4 Å²	146.4	87%	0.869	79%	0.788	S	S	*	*			trans	-172.9	117	137.8	-73.5	-132.9	110.9	0	0	103.4
229	A	29.7	Very low	29.9	Very low	90 Å²	90	146.4 Å²	146.4	74%	0.744	79%	0.791	S	S	*	*				62.2	126.6	83.9	0	0	0	0	0	111.4
230	D	31.9	Very low	29.4	Very low	142 Å²	142	146.4 Å²	146.4	76%	0.759	79%	0.786	S	S	*	*			cis	-154.4	162.5	21.3	-156.6	6.5	0	0	0	113.6
231	D	31.8	Very low	29.1	Very low	134 Å²	134	146.3 Å²	146.3	72%	0.717	78%	0.78	S	S	*	*			trans	42.1	146.8	152.2	-98.7	-12.5	0	0	0	123.5
232	S	32	Very low	28.8	Very low	72 Å²	72	141.5 Å²	141.5	50%	0.503	77%	0.771	S	S	.	*			cis	-161.1	148.4	-4.6	-143.6	0	0	0	0	113.3
233	R	30.6	Very low	28.4	Very low	214 Å²	214	142.4 Å²	142.4	81%	0.808	77%	0.765	S	S	*	*			trans	63.6	112.1	152.1	-68.8	162.3	-179.6	-139.8	-8.2	119.5
234	L	29.2	Very low	28.3	Very low	162 Å²	162	145.1 Å²	145.1	85%	0.848	77%	0.765	S	S	*	*				68.1	138.2	64.6	-62.8	172.5	0	0	0	113.2
235	S	27.2	Very low	28.2	Very low	96 Å²	96	147 Å²	147	67%	0.671	76%	0.762	S	S	*	*			cis	-169.9	141.2	-3.5	44.4	0	0	0	0	112.8
236	V	25.1	Very low	28	Very low	138 Å²	138	146.9 Å²	146.9	84%	0.836	76%	0.757	S	S	*	*			trans	18.5	122.6	131.6	-174	0	0	0	0	118.6
237	S	25.5	Very low	27.9	Very low	115 Å²	115	141.2 Å²	141.2	80%	0.804	74%	0.744	S	S	*	*				-169.7	153	103.3	-164.4	0	0	0	0	113.8
238	L	27.1	Very low	27.8	Very low	155 Å²	155	140.4 Å²	140.4	81%	0.812	74%	0.741	S	S	*	*			trans	-93.8	-175.6	169.8	-74.3	162.5	0	0	0	111
239	C	25	Very low	27.8	Very low	111 Å²	111	135 Å²	135	75%	0.75	73%	0.734	S	S	*	*			trans	81	141	169.3	-58.7	0	0	0	0	114.7
240	D	25.7	Very low	28.4	Very low	125 Å²	125	136.6 Å²	136.6	67%	0.668	74%	0.738	S	S	*	*			cis	-164.6	168.5	-4.2	-120.2	-35.1	0	0	0	109.6
241	L	25	Very low	28.3	Very low	139 Å²	139	133.6 Å²	133.6	73%	0.728	73%	0.733	S	S	*	*			trans	44.2	146	142.7	-62.1	167.7	0	0	0	120.4
242	N	25.8	Very low	28.2	Very low	121 Å²	121	136.6 Å²	136.6	65%	0.647	74%	0.742	S	S	*	*			cis	-168.3	161.1	-3.8	-137.2	-3.3	0	0	0	108.6
243	L	26.1	Very low	28.2	Very low	139 Å²	139	137.4 Å²	137.4	73%	0.728	75%	0.748	S	S	*	*			trans	39.5	156.4	140.6	-68.3	170.1	0	0	0	124.8
244	Q	26.6	Very low	28.2	Very low	174 Å²	174	136.1 Å²	136.1	81%	0.813	75%	0.75	S	S	*	*			trans	85.3	115.8	167.4	-58.7	175.8	10.4	0	0	115.1
245	Q	27	Very low	28.1	Very low	153 Å²	153	137.8 Å²	137.8	72%	0.715	75%	0.745	S	S	*	*			cis	95.2	130.4	36.4	-176.5	171.7	-5.2	0	0	112.4
246	E	29.8	Very low	28.2	Very low	157 Å²	157	140.4 Å²	140.4	73%	0.734	75%	0.746	S	S	*	*			trans	68.8	149.1	169.6	-79.8	154.7	-154.2	0	0	116.3
247	D	27.1	Very low	28.5	Very low	108 Å²	108	140.4 Å²	140.4	58%	0.578	75%	0.747	S	S	*	*			cis	-152.2	169.1	7.4	-152.1	-8	0	0	0	112.9
248	R	29.3	Very low	28.7	Very low	217 Å²	217	142.3 Å²	142.3	82%	0.819	75%	0.748	S	S	*	*			trans	53.6	128.3	152.6	-78.9	159.4	-146.4	-139.3	3.1	122.3
249	G	26.2	Very low	28.8	Very low	72 Å²	72	143.6 Å²	143.6	74%	0.742	75%	0.749	S	S	*	*			trans	-79.8	-149.5	153	0	0	0	0	0	112.4
250	P	43.6	Very low	29.1	Very low	125 Å²	125	146 Å²	146	81%	0.812	75%	0.753	S	S	*	*			cis	-137.9	179.7	17	42.5	-24.5	0	0	0	116.5
251	A	29.1	Very low	29.2	Very low	79 Å²	79	144.3 Å²	144.3	65%	0.653	76%	0.757	S	S	*	*			trans	47.8	125.6	148.5	0	0	0	0	0	121.3
252	H	29.8	Very low	29.4	Very low	197 Å²	197	143.1 Å²	143.1	91%	0.912	76%	0.76	S	S	*	*				-163.8	150.8	100.9	-103.1	-76.9	0	0	0	112.1
253	S	30.8	Very low	29.5	Very low	89 Å²	89	142 Å²	142	62%	0.622	77%	0.768	S	S	*	*			trans	-76.8	146.8	179.2	168.7	0	0	0	0	111.9
254	H	30.7	Very low	29.7	Very low	187 Å²	187	141.3 Å²	141.3	87%	0.866	77%	0.774	S	S	*	*				-161.1	160.4	126.2	-105.4	-70.4	0	0	0	114.2
255	R	28	Very low	29.8	Very low	197 Å²	197	138.4 Å²	138.4	74%	0.743	77%	0.773	S	S	*	*			trans	-87.9	150.6	-158.8	-80.7	172.2	73.7	175.6	2.3	115
256	H	29.7	Very low	30.1	Very low	150 Å²	150	136.8 Å²	136.8	69%	0.694	78%	0.779	S	S	*	*			trans	49.8	131.8	146.2	-74.3	-110.9	0	0	0	120.1
257	T	29.8	Very low	30.1	Very low	138 Å²	138	134.6 Å²	134.6	85%	0.847	78%	0.781	S	S	*	*				-158.9	142.1	115.4	-72.9	0	0	0	0	109.5
258	L	31.3	Very low	30.2	Very low	156 Å²	156	135.6 Å²	135.6	82%	0.817	79%	0.791	S	S	*	*			trans	-81.2	136.7	174.3	-73.3	155.4	0	0	0	110.1
259	H	28.7	Very low	30.4	Very low	181 Å²	181	130.3 Å²	130.3	84%	0.838	79%	0.786	S	S	*	*			trans	-143.7	123.2	152.9	-143.6	-84.6	0	0	0	111.2
260	L	31.2	Very low	30.8	Very low	162 Å²	162	133 Å²	133	85%	0.848	79%	0.79	S	S	*	*			trans	-101.6	116.8	178.3	178.5	69.3	0	0	0	108.1
261	A	28.3	Very low	30.5	Very low	89 Å²	89	131.9 Å²	131.9	74%	0.736	78%	0.777	S	S	*	*			trans	-150.7	106	169.5	0	0	0	0	0	110.8
262	S	27.8	Very low	31	Very low	115 Å²	115	132.4 Å²	132.4	80%	0.804	77%	0.774	S	S	*	*			trans	-56.8	138.7	-177	-39.5	0	0	0	0	116
263	A	28.4	Very low	31.8	Very low	97 Å²	97	127.7 Å²	127.7	80%	0.802	75%	0.752	S	S	*	*			trans	-165.1	93.6	142.2	0	0	0	0	0	112
264	S	30	Very low	32.2	Very low	124 Å²	124	128 Å²	128	87%	0.867	75%	0.746	S	S	*	*			trans	-8.7	118.6	163.1	52.8	0	0	0	0	120.3
265	S	29.9	Very low	32.7	Very low	113 Å²	113	121.9 Å²	121.9	79%	0.79	73%	0.725	S	S	*	*			trans	-137.2	142.3	130.8	59.7	0	0	0	0	109	S267	S265-S267 PolarHBondContact O-N 2.76Å; S265-S267 VanDerWaalsContact O-N 3.13Å
266	S	33	Very low	33.8	Very low	119 Å²	119	115.9 Å²	115.9	83%	0.832	71%	0.707	S	S	*	*			trans	-80.2	94.9	-162.3	51.7	0	0	0	0	113.3	T268	S266-T268 PolarHBondContact O-N 3.46Å
267	S	29.1	Very low	34.3	Very low	111 Å²	111	108.9 Å²	108.9	78%	0.776	68%	0.675	S	S	*	*			trans	-84.7	101.1	165.2	47	0	0	0	0	110.8	S265 C269	S265-S267 PolarHBondContact O-N 2.76Å; S265-S267 VanDerWaalsContact O-N 3.13Å; S267-C269 PolarHBondContact O-N 2.86Å
268	T	28.8	Very low	35.1	Very low	130 Å²	130	105.8 Å²	105.8	80%	0.798	66%	0.659	S	S	*	*			trans	-70.9	113.6	171.5	-30.2	0	0	0	0	109.2	S266	S266-T268 PolarHBondContact O-N 3.46Å
269	C	34.8	Very low	35.9	Very low	105 Å²	105	104.8 Å²	104.8	71%	0.709	65%	0.65	S	S	*	*			trans	-58.2	130.3	173	-54.7	0	0	0	0	109.7	S267 I271	S267-C269 PolarHBondContact O-N 2.86Å; C269-I271 PolarHBondContact O-N 3.15Å; C269-I271 VanDerWaalsContact O-N 3.08Å
270	P	34.8	Very low	37	Very low	128 Å²	128	98.7 Å²	98.7	83%	0.831	62%	0.622	S	S	*	*			trans	-65	115.1	178.3	25.2	-32.5	0	0	0	110
271	I	36.5	Very low	37.9	Very low	103 Å²	103	93.4 Å²	93.4	53%	0.528	60%	0.598	S	S	.	*			trans	-61.3	131.1	175.6	-61.8	172	0	0	0	108.2	C269 Q273 L276	C269-I271 PolarHBondContact O-N 3.15Å; C269-I271 VanDerWaalsContact O-N 3.08Å; I271-Q273 PolarHBondContact O-N 3.39Å; I271-L276 HydrophobicContact CG2-CG 4.23Å
272	P	40.7	Very low	38.9	Very low	90 Å²	90	94 Å²	94	58%	0.584	60%	0.597	S	S	*	*			trans	-55.2	130.1	175.8	-26.3	34.8	0	0	0	111.4	N274 S275	P272-N274 PolarHBondContact O-N 2.86Å; P272-S275 WeakPolarHBondContact O-CB 3.42Å; P272-S275 PolarHBondContact O-N 2.86Å
273	Q	45.7	Very low	40.1	Very low	97 Å²	97	94.4 Å²	94.4	45%	0.453	59%	0.589	S	S	.	*	H	α-helix	trans	-58.7	-26.4	-171.4	-164.2	161.4	-23.5	0	0	113.5	I271 S275 L276 N277	I271-Q273 PolarHBondContact O-N 3.39Å; Q273-S275 VanDerWaalsContact C-N 3.31Å; Q273-S275 PolarHBondContact O-N 3.49Å; Q273-L276 PolarHBondContact O-N 3.24Å; Q273-N277 PolarHBondContact O-N 3.44Å
274	N	39.6	Very low	41.7	Very low	95 Å²	95	91.4 Å²	91.4	51%	0.508	56%	0.56	S	S	.	*	H	α-helix	trans	-60.3	-33.6	170.2	-81.7	-26.5	0	0	0	114.1	P272 S278	P272-N274 PolarHBondContact O-N 2.86Å; N274-S278 WeakPolarHBondContact O-CB 3.39Å; N274-S278 PolarHBondContact O-N 3.47Å; N274-S278 VanDerWaalsContact O-N 3.08Å; N274-S278 PolarHBondContact O-OG 2.87Å
275	S	40	Very low	43.3	Very low	59 Å²	59	88.1 Å²	88.1	41%	0.413	54%	0.536	S	S	.	.	H	α-helix	trans	-73.3	-36.9	177	-58.2	0	0	0	0	111.4	P272 Q273 S278 Q279	P272-S275 WeakPolarHBondContact O-CB 3.42Å; P272-S275 PolarHBondContact O-N 2.86Å; Q273-S275 VanDerWaalsContact C-N 3.31Å; Q273-S275 PolarHBondContact O-N 3.49Å; S275-S278 PolarHBondContact O-N 2.81Å; S275-Q279 PolarHBondContact O-N 2.93Å
276	L	51.3	Low	44.5	Very low	71 Å²	71	89.3 Å²	89.3	37%	0.372	54%	0.544	S	S	.	.	H	α-helix	trans	-65	-47.9	172.9	-73.2	164	0	0	0	111	I271 Q273 S278 Q279 Q280	I271-L276 HydrophobicContact CG2-CG 4.23Å; Q273-L276 PolarHBondContact O-N 3.24Å; L276-S278 PolarHBondContact O-N 3.37Å; L276-Q279 CarbonylContact O-C 3.6Å; L276-Q279 PolarHBondContact O-N 2.83Å; L276-Q279 VanDerWaalsContact O-N 3.13Å; L276-Q280 WeakPolarHBondContact O-CB 3.48Å; L276-Q280 VanDerWaalsContact O-CG 3.29Å; L276-Q280 WeakPolarHBondContact O-CG 3.36Å; L276-Q280 PolarHBondContact O-N 2.69Å
277	N	40.8	Very low	46.1	Very low	4 Å²	4	87.4 Å²	87.4	2%	0.021	54%	0.535	C	S	.	.	H	α-helix	trans	-62.6	-27.7	176.4	-74.1	5	0	0	0	112.8	Q273 Q280 S281 D394 N411	Q273-N277 PolarHBondContact O-N 3.44Å; N277-Q280 PolarHBondContact OD1-OE1 3.32Å; N277-S281 PolarHBondContact O-N 2.85Å; N277-D394 PolarHBondContact ND2-OD1 3.17Å; N277-N411 PolarHBondContact OD1-ND2 3.37Å
278	S	45.4	Very low	48.4	Very low	72 Å²	72	84.1 Å²	84.1	50%	0.503	51%	0.509	S	S	.	.	H	α-helix	trans	-78.7	-32.1	175.3	-57.8	0	0	0	0	112.9	N274 S275 L276 S281	N274-S278 WeakPolarHBondContact O-CB 3.39Å; N274-S278 PolarHBondContact O-N 3.47Å; N274-S278 VanDerWaalsContact O-N 3.08Å; N274-S278 PolarHBondContact O-OG 2.87Å; S275-S278 PolarHBondContact O-N 2.81Å; L276-S278 PolarHBondContact O-N 3.37Å; S278-S281 PolarHBondContact O-OG 3.14Å
279	Q	49.6	Very low	50.8	Low	135 Å²	135	81.5 Å²	81.5	63%	0.631	49%	0.488	S	S	*	.	H	α-helix	trans	-72.4	-36.2	167.7	-72.2	-173	-9	0	0	111.4	S275 L276 S281 S282	S275-Q279 PolarHBondContact O-N 2.93Å; L276-Q279 CarbonylContact O-C 3.6Å; L276-Q279 PolarHBondContact O-N 2.83Å; L276-Q279 VanDerWaalsContact O-N 3.13Å; Q279-S281 PolarHBondContact O-N 3.08Å; Q279-S282 WeakPolarHBondContact O-CB 3.43Å; Q279-S282 PolarHBondContact O-N 3.48Å; Q279-S282 PolarHBondContact O-OG 3.17Å
280	Q	50.4	Low	52.8	Low	54 Å²	54	82 Å²	82	25%	0.252	49%	0.492	S	S	.	.	H	α-helix	trans	-68.6	-15.7	-180	-72.9	170.9	-22.5	0	0	114.3	L276 N277 S282 L283	L276-Q280 WeakPolarHBondContact O-CB 3.48Å; L276-Q280 VanDerWaalsContact O-CG 3.29Å; L276-Q280 WeakPolarHBondContact O-CG 3.36Å; L276-Q280 PolarHBondContact O-N 2.69Å; N277-Q280 PolarHBondContact OD1-OE1 3.32Å; Q280-S282 PolarHBondContact O-N 3.06Å; Q280-L283 HydrophobicContact CB-CD1 4.46Å; Q280-L283 HydrophobicContact CG-CD1 4.04Å; Q280-L283 WeakPolarHBondContact O-CB 3.11Å; Q280-L283 PolarHBondContact O-N 3.08Å
281	S	50.4	Low	55.2	Low	51 Å²	51	78.9 Å²	78.9	36%	0.357	47%	0.468	S	S	.	.	G	3₁₀ helix	trans	-62.1	-16.9	163.9	17.3	0	0	0	0	113.9	N277 S278 Q279	N277-S281 PolarHBondContact O-N 2.85Å; S278-S281 PolarHBondContact O-OG 3.14Å; Q279-S281 PolarHBondContact O-N 3.08Å
282	S	49.8	Very low	57.8	Low	100 Å²	100	74.1 Å²	74.1	70%	0.699	44%	0.444	S	S	*	.	G	3₁₀ helix	trans	-84.7	-5.4	169.7	76.6	0	0	0	0	114.2	Q279 Q280	Q279-S282 WeakPolarHBondContact O-CB 3.43Å; Q279-S282 PolarHBondContact O-N 3.48Å; Q279-S282 PolarHBondContact O-OG 3.17Å; Q280-S282 PolarHBondContact O-N 3.06Å
283	L	53	Low	60.3	Low	124 Å²	124	72.7 Å²	72.7	65%	0.649	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-91	-3.9	169.7	-59.1	179.7	0	0	0	112.7	Q280	Q280-L283 HydrophobicContact CB-CD1 4.46Å; Q280-L283 HydrophobicContact CG-CD1 4.04Å; Q280-L283 WeakPolarHBondContact O-CB 3.11Å; Q280-L283 PolarHBondContact O-N 3.08Å
284	L	61.2	Low	62.6	Low	34 Å²	34	68.1 Å²	68.1	18%	0.178	41%	0.408	C	S	.	.	S	Bend	trans	-66.1	146.2	165.3	-69.3	167.9	0	0	0	109.1	S286 L288 F336 I395 L443	L284-S286 PolarHBondContact O-N 3.45Å; L284-L288 HydrophobicContact CD1-CD1 4.44Å; L284-F336 HydrophobicContact CD2-CB 4.35Å; L284-F336 HydrophobicContact CD2-CD1 3.62Å; L284-F336 HydrophobicContact CD2-CD2 4.49Å; L284-F336 HydrophobicContact CD2-CE1 3.99Å; L284-F336 HydrophobicContact CD2-CG 3.9Å; L284-I395 HydrophobicContact CD1-CD1 4.27Å; L284-I395 HydrophobicContact CD2-CG2 4.18Å; L284-L443 HydrophobicContact CD1-CD1 3.75Å; L284-L443 HydrophobicContact CD2-CD1 4.4Å
285	P	64.4	Low	65.1	Low	56 Å²	56	65.3 Å²	65.3	36%	0.364	39%	0.392	S	S	.	.			trans	-51.2	141.1	170.6	-28.8	37.5	0	0	0	111.9	A287 L288 F336 T446	P285-A287 PolarHBondContact O-N 3.46Å; P285-L288 HydrophobicContact CB-CD2 4.35Å; P285-L288 HydrophobicContact CG-CD2 4.44Å; P285-F336 HydrophobicContact CG-CE2 4.4Å; P285-F336 HydrophobicContact CG-CZ 4.39Å; P285-T446 HydrophobicContact CB-CG2 3.56Å; P285-T446 HydrophobicContact CG-CG2 3.61Å
286	S	54.4	Low	67.5	Low	138 Å²	138	69.8 Å²	69.8	97%	0.965	41%	0.406	S	S	*	.	S	Bend	trans	-63.7	-15.6	-171.1	47.9	0	0	0	0	114.8	L284	L284-S286 PolarHBondContact O-N 3.45Å
287	A	66.6	Low	69.3	Low	78 Å²	78	67 Å²	67	65%	0.645	39%	0.392	S	S	*	.			trans	-133.2	126.9	164.4	0	0	0	0	0	109	P285	P285-A287 PolarHBondContact O-N 3.46Å
288	L	77.7	Confident	71.5	Confident	42 Å²	42	70.5 Å²	70.5	22%	0.22	41%	0.405	C	S	.	.			trans	-102	140.9	165.8	-61.6	-177.4	0	0	0	108.5	L284 P285 S290 F336 L443 S445 T446	L284-L288 HydrophobicContact CD1-CD1 4.44Å; P285-L288 HydrophobicContact CB-CD2 4.35Å; P285-L288 HydrophobicContact CG-CD2 4.44Å; L288-S290 PolarHBondContact O-N 3.46Å; L288-F336 HydrophobicContact CD2-CD2 3.81Å; L288-F336 HydrophobicContact CD2-CE2 4.04Å; L288-L443 HydrophobicContact CD1-CB 3.87Å; L288-L443 WeakPolarHBondContact CD1-O 3.19Å; L288-S445 CarbonylContact C-O 3.45Å; L288-S445 WeakPolarHBondContact CA-O 3.38Å; L288-T446 HydrophobicContact CD2-CG2 3.58Å
289	E	78.9	Confident	73.3	Confident	76 Å²	76	67.1 Å²	67.1	36%	0.355	38%	0.381	S	S	.	.	B	Isolated β-bridge	trans	-69.1	120.5	167.6	-74.7	-179.4	-152.4	0	0	109.1	D291 R327 R330 G444 S445	E289-D291 VanDerWaalsContact C-N 3.3Å; E289-R327 IonicContact OE2-NH2 3.69Å; E289-R330 IonicContact OE2-CZ 3.41Å; E289-R330 IonicContact OE2-NE 2.74Å; E289-R330 PolarHBondContact OE2-NE 3Å; E289-R330 IonicContact OE2-NH2 3.81Å; E289-R330 PolarHBondContact OE2-NH2 2.9Å; E289-G444 WeakPolarHBondContact O-CA 3.4Å; E289-S445 PolarHBondContact N-O 3.06Å; E289-S445 PolarHBondContact O-N 2.95Å; E289-S445 VanDerWaalsContact O-N 3.16Å
290	S	77.3	Confident	74.8	Confident	114 Å²	114	63.9 Å²	63.9	80%	0.797	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	5.4	178.8	-45.8	0	0	0	0	113.7	L288 L292	L288-S290 PolarHBondContact O-N 3.46Å; S290-L292 VanDerWaalsContact C-N 3.25Å; S290-L292 PolarHBondContact O-N 3.4Å
291	D	85.1	Confident	76.3	Confident	63 Å²	63	63.7 Å²	63.7	34%	0.337	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-12.7	-176.1	83.6	-34.7	0	0	0	113.3	E289 N326 R327 R330	E289-D291 VanDerWaalsContact C-N 3.3Å; D291-N326 PolarHBondContact O-ND2 3.43Å; D291-R327 IonicContact OD1-CZ 3.77Å; D291-R327 IonicContact OD1-NE 2.76Å; D291-R327 PolarHBondContact OD1-NE 3.24Å; D291-R327 IonicContact OD1-NH2 3.76Å; D291-R327 PolarHBondContact OD1-NH2 3.24Å; D291-R327 IonicContact OD2-CZ 3.84Å; D291-R327 IonicContact OD2-NE 2.83Å; D291-R327 PolarHBondContact OD2-NE 2.98Å; D291-R327 IonicContact OD2-NH2 2.79Å; D291-R327 PolarHBondContact OD2-NH2 2.81Å; D291-R330 IonicContact OD1-NH2 2.77Å; D291-R330 IonicContact OD2-CZ 2.92Å; D291-R330 IonicContact OD2-NH2 3.8Å; D291-R330 PolarHBondContact OD2-NH2 2.87Å
292	L	90.9	Very high	78	Confident	4 Å²	4	61.5 Å²	61.5	2%	0.021	36%	0.36	C	S	.	.			trans	-94	114.9	-178.5	-165.8	75.8	0	0	0	111.1	S290 T325 R327 V335 I442	S290-L292 VanDerWaalsContact C-N 3.25Å; S290-L292 PolarHBondContact O-N 3.4Å; L292-T325 HydrophobicContact CD1-CG2 3.88Å; L292-T325 HydrophobicContact CD2-CG2 4.26Å; L292-T325 HydrophobicContact CG-CG2 4.21Å; L292-R327 HydrophobicContact CD1-CG 3.9Å; L292-V335 HydrophobicContact CD2-CB 4.11Å; L292-V335 HydrophobicContact CD2-CG1 3.57Å; L292-V335 HydrophobicContact CD2-CG2 3.56Å; L292-I442 HydrophobicContact CB-CG2 4.49Å; L292-I442 HydrophobicContact CD2-CG2 4.18Å; L292-I442 HydrophobicContact CG-CD1 4.49Å; L292-I442 HydrophobicContact CG-CG2 4.38Å; L292-I442 WeakPolarHBondContact O-CG2 3.26Å
293	H	92.9	Very high	79.7	Confident	60 Å²	60	61.3 Å²	61.3	28%	0.278	35%	0.347	S	S	.	.			trans	-131.8	172.3	174	61	86	0	0	0	110.7	Q308 N326	H293-Q308 HydrophobicContact CB-CB 4.11Å; H293-Q308 PolarHBondContact CE1-OE1 2.79Å; H293-Q308 PolarHBondContact ND1-OE1 2.79Å; H293-N326 PolarHBondContact CD2-ND2 2.97Å; H293-N326 WeakPolarHBondContact CE1-CB 3.49Å; H293-N326 PolarHBondContact N-OD1 3.27Å; H293-N326 PolarHBondContact NE2-ND2 3.35Å; H293-N326 WeakPolarHBondContact O-CB 3.42Å; H293-N326 PolarHBondContact O-N 3.08Å; H293-N326 PolarHBondContact O-OD1 3.39Å; H293-N326 VanDerWaalsContact O-OD1 3.12Å
294	F	94.5	Very high	81.1	Confident	0 Å²	0	57 Å²	57	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	143.2	172.2	-65.4	-62.4	0	0	0	110.2	Q308 T309 A311 V323 F324 F431 L440 I442	F294-Q308 WeakPolarHBondContact CA-O 3.29Å; F294-Q308 WeakPolarHBondContact CB-O 3.41Å; F294-Q308 WeakPolarHBondContact CD2-O 3.41Å; F294-Q308 PolarHBondContact N-O 3.28Å; F294-Q308 WeakPolarHBondContact O-CB 3.42Å; F294-Q308 PolarHBondContact O-OE1 2.95Å; F294-T309 WeakPolarHBondContact CD2-O 3.31Å; F294-T309 WeakPolarHBondContact CE2-O 3.38Å; F294-A311 HydrophobicContact CD2-CB 3.72Å; F294-A311 HydrophobicContact CE2-CB 3.5Å; F294-A311 HydrophobicContact CG-CB 4.43Å; F294-A311 HydrophobicContact CZ-CB 4.04Å; F294-V323 HydrophobicContact CD1-CB 3.78Å; F294-V323 HydrophobicContact CD1-CG2 3.62Å; F294-V323 HydrophobicContact CE1-CB 4.18Å; F294-V323 HydrophobicContact CE1-CG2 3.47Å; F294-V323 VanDerWaalsContact CE1-CG2 3.47Å; F294-V323 HydrophobicContact CG-CB 4.28Å; F294-V323 HydrophobicContact CG-CG2 4.39Å; F294-V323 HydrophobicContact CZ-CG2 4.12Å; F294-F324 CarbonylContact C-O 3.45Å; F294-F324 WeakPolarHBondContact CA-O 3.29Å; F294-F431 AromaticContact CE1-CD2 3.88Å; F294-F431 HydrophobicContact CE1-CD2 3.88Å; F294-F431 HydrophobicContact CE1-CE2 4.26Å; F294-L440 HydrophobicContact CZ-CB 4.13Å; F294-I442 HydrophobicContact CD1-CD1 3.75Å; F294-I442 HydrophobicContact CD1-CG1 4.12Å; F294-I442 HydrophobicContact CD2-CD1 4.42Å; F294-I442 HydrophobicContact CD2-CG1 4.19Å; F294-I442 HydrophobicContact CE1-CD1 3.77Å; F294-I442 HydrophobicContact CE1-CG1 3.73Å; F294-I442 HydrophobicContact CE2-CD1 4.44Å; F294-I442 HydrophobicContact CE2-CG1 3.81Å; F294-I442 HydrophobicContact CG-CD1 4.08Å; F294-I442 HydrophobicContact CG-CG1 4.33Å; F294-I442 HydrophobicContact CZ-CD1 4.13Å; F294-I442 HydrophobicContact CZ-CG1 3.57Å
295	H	93.2	Very high	81.8	Confident	36 Å²	36	59.4 Å²	59.4	17%	0.167	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	157.4	174.8	-168.2	-109.3	0	0	0	111.5	L297 F324 P359	H295-L297 VanDerWaalsContact C-N 3.29Å; H295-L297 VanDerWaalsContact ND1-CB 3.28Å; H295-L297 WeakPolarHBondContact ND1-CB 3.48Å; H295-L297 PolarHBondContact ND1-N 3.08Å; H295-L297 PolarHBondContact O-N 3.34Å; H295-F324 HydrophobicContact CB-CB 4.04Å; H295-F324 PolarHBondContact N-O 3.36Å; H295-P359 HydrophobicContact CB-CB 4.36Å; H295-P359 PolarHBondContact CE1-O 3.46Å; H295-P359 WeakPolarHBondContact ND1-CB 3.14Å
296	Q	89.7	Confident	82.5	Confident	154 Å²	154	59.5 Å²	59.5	72%	0.72	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.9	-33.9	176.8	-169.3	178.8	15.3	0	0	112.2	R298	Q296-R298 PolarHBondContact O-N 2.79Å
297	L	88.8	Confident	83.7	Confident	13 Å²	13	61 Å²	61	7%	0.068	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	123.9	168.2	179.9	67.4	0	0	0	110	H295 F324 P359 L362 P364 L367	H295-L297 VanDerWaalsContact C-N 3.29Å; H295-L297 VanDerWaalsContact ND1-CB 3.28Å; H295-L297 WeakPolarHBondContact ND1-CB 3.48Å; H295-L297 PolarHBondContact ND1-N 3.08Å; H295-L297 PolarHBondContact O-N 3.34Å; L297-F324 HydrophobicContact CD2-CD2 4.43Å; L297-F324 HydrophobicContact CD2-CE2 4.18Å; L297-F324 HydrophobicContact CG-CE2 4.47Å; L297-P359 HydrophobicContact CD2-CB 4.43Å; L297-P359 WeakPolarHBondContact CD2-O 3.42Å; L297-L362 HydrophobicContact CD2-CB 3.39Å; L297-L362 HydrophobicContact CD2-CD1 4.31Å; L297-L362 HydrophobicContact CD2-CG 4.49Å; L297-P364 HydrophobicContact CD1-CB 4.35Å; L297-P364 HydrophobicContact CD1-CG 3.8Å; L297-L367 HydrophobicContact CD1-CD1 4.08Å; L297-L367 HydrophobicContact CD2-CD1 4.47Å; L297-L367 HydrophobicContact CD2-CD2 4.3Å; L297-L367 HydrophobicContact CG-CD1 4.16Å
298	R	87	Confident	84.5	Confident	77 Å²	77	60 Å²	60	29%	0.291	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	161.1	174.4	64.8	-164.9	-172.4	-149.3	2.7	110.2	Q296 I302 T304 L322 V323	Q296-R298 PolarHBondContact O-N 2.79Å; R298-I302 HydrophobicContact CB-CB 4.23Å; R298-I302 HydrophobicContact CB-CG2 4.46Å; R298-I302 WeakPolarHBondContact CD-O 3.37Å; R298-I302 HydrophobicContact CG-CB 4.31Å; R298-I302 PolarHBondContact NE-O 3.28Å; R298-T304 PolarHBondContact NH1-OG1 3.49Å; R298-L322 CarbonylContact C-O 3.54Å; R298-L322 WeakPolarHBondContact CA-O 3.4Å; R298-V323 HydrophobicContact CB-CG1 4.11Å
299	G	84.3	Confident	84.8	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	31%	0.31	C	S	.	.			trans	-65.5	151.5	171.1	0	0	0	0	0	112.1	H301 I302 R320 L322	G299-H301 PolarHBondContact O-N 3.46Å; G299-I302 PolarHBondContact O-N 3.45Å; G299-R320 CarbonylContact C-O 3.07Å; G299-R320 WeakPolarHBondContact CA-O 3.48Å; G299-L322 PolarHBondContact N-O 3.24Å
300	A	81.3	Confident	85.2	Confident	67 Å²	67	56.2 Å²	56.2	55%	0.554	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-19.5	-167.9	0	0	0	0	0	115.4	R320	A300-R320 PolarHBondContact N-O 2.92Å
301	H	81.3	Confident	85.8	Confident	51 Å²	51	50.8 Å²	50.8	24%	0.236	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.2	10.4	-179.7	-61.6	-24.9	0	0	0	114.1	G299 S313 E314 H315 E319 R320 T321	G299-H301 PolarHBondContact O-N 3.46Å; H301-S313 WeakPolarHBondContact O-CA 3.33Å; H301-E314 PolarHBondContact O-N 3.14Å; H301-H315 HydrophobicContact CB-CB 4.47Å; H301-E319 PolarHBondContact CD2-O 3.25Å; H301-R320 PolarHBondContact N-O 2.84Å; H301-T321 HydrophobicContact CB-CG2 4.46Å
302	I	86.4	Confident	86	Confident	4 Å²	4	51.8 Å²	51.8	2%	0.021	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	131.3	170.8	-57.3	-59.5	0	0	0	111.6	R298 G299 A311 R312 T321 V323 L433	R298-I302 HydrophobicContact CB-CB 4.23Å; R298-I302 HydrophobicContact CB-CG2 4.46Å; R298-I302 WeakPolarHBondContact CD-O 3.37Å; R298-I302 HydrophobicContact CG-CB 4.31Å; R298-I302 PolarHBondContact NE-O 3.28Å; G299-I302 PolarHBondContact O-N 3.45Å; I302-A311 HydrophobicContact CG2-CB 3.88Å; I302-R312 WeakPolarHBondContact CA-O 3.26Å; I302-T321 HydrophobicContact CD1-CG2 4.28Å; I302-V323 HydrophobicContact CB-CG1 4.25Å; I302-V323 HydrophobicContact CG1-CG1 4.02Å; I302-V323 HydrophobicContact CG2-CG1 3.68Å; I302-L433 HydrophobicContact CD1-CB 4.4Å; I302-L433 HydrophobicContact CD1-CD1 4.29Å; I302-L433 HydrophobicContact CD1-CD2 4.21Å
303	K	84.1	Confident	85.8	Confident	96 Å²	96	52.2 Å²	52.2	42%	0.417	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	131.9	161.2	-73.5	-177.1	172.4	166.8	0	110.1	R312 E314	K303-R312 PolarHBondContact N-O 2.71Å; K303-R312 PolarHBondContact O-N 3.23Å; K303-E314 WeakPolarHBondContact CD-OE1 3.32Å; K303-E314 WeakPolarHBondContact CD-OE2 3.27Å; K303-E314 WeakPolarHBondContact CE-OE1 3.23Å; K303-E314 WeakPolarHBondContact CE-OE2 3.42Å; K303-E314 IonicContact NZ-OE1 2.79Å; K303-E314 PolarHBondContact NZ-OE1 2.81Å; K303-E314 IonicContact NZ-OE2 2.71Å; K303-E314 PolarHBondContact NZ-OE2 2.99Å
304	T	82.5	Confident	84.8	Confident	35 Å²	35	54.3 Å²	54.3	22%	0.215	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	145.5	160.2	57.3	0	0	0	0	109.5	R298 V310	R298-T304 PolarHBondContact NH1-OG1 3.49Å; T304-V310 WeakPolarHBondContact CA-O 3.43Å
305	L	76	Confident	83.3	Confident	83 Å²	83	59 Å²	59	44%	0.435	29%	0.289	S	S	.	.			trans	-118.6	-23.6	-170.5	-72.1	160.5	0	0	0	114.7	V310 R312	L305-V310 HydrophobicContact CB-CB 4.4Å; L305-V310 HydrophobicContact CB-CG1 4.04Å; L305-V310 HydrophobicContact CD1-CG1 3.77Å; L305-V310 HydrophobicContact CG-CG1 4.41Å; L305-V310 PolarHBondContact N-O 2.87Å; L305-R312 HydrophobicContact CD1-CB 3.58Å; L305-R312 HydrophobicContact CD1-CG 4.34Å; L305-R312 HydrophobicContact CG-CB 4.47Å
306	D	79.9	Confident	81.4	Confident	59 Å²	59	61.4 Å²	61.4	32%	0.316	32%	0.316	S	S	.	.	S	Bend	trans	-126.9	-150.9	174.5	49.7	33.9	0	0	0	109.2	Q308 T309 V310 R441	D306-Q308 PolarHBondContact O-N 2.91Å; D306-T309 PolarHBondContact OD1-N 2.9Å; D306-T309 PolarHBondContact OD1-OG1 3.04Å; D306-T309 PolarHBondContact OD2-OG1 2.99Å; D306-V310 PolarHBondContact OD1-N 3.04Å; D306-V310 WeakPolarHBondContact OD2-CB 3.21Å; D306-V310 WeakPolarHBondContact OD2-CG2 3.28Å; D306-R441 IonicContact OD2-CZ 2.71Å; D306-R441 IonicContact OD2-NE 3.82Å; D306-R441 IonicContact OD2-NH2 3.85Å; D306-R441 PolarHBondContact OD2-NH2 3.08Å
307	E	79.4	Confident	79.8	Confident	170 Å²	170	63.2 Å²	63.2	79%	0.794	32%	0.316	S	S	*	.	S	Bend	trans	-67.4	50.4	178.2	-59.7	-174.8	160.7	0	0	112.9	T309	E307-T309 PolarHBondContact O-N 2.86Å
308	Q	82.7	Confident	78.4	Confident	55 Å²	55	65.9 Å²	65.9	26%	0.257	33%	0.328	S	S	.	.	S	Bend	trans	57.9	10.3	-175.4	-52.8	-179.4	-2.9	0	0	114.8	H293 F294 D306	H293-Q308 HydrophobicContact CB-CB 4.11Å; H293-Q308 PolarHBondContact CE1-OE1 2.79Å; H293-Q308 PolarHBondContact ND1-OE1 2.79Å; F294-Q308 WeakPolarHBondContact CA-O 3.29Å; F294-Q308 WeakPolarHBondContact CB-O 3.41Å; F294-Q308 WeakPolarHBondContact CD2-O 3.41Å; F294-Q308 PolarHBondContact N-O 3.28Å; F294-Q308 WeakPolarHBondContact O-CB 3.42Å; F294-Q308 PolarHBondContact O-OE1 2.95Å; D306-Q308 PolarHBondContact O-N 2.91Å
309	T	84.3	Confident	77.4	Confident	39 Å²	39	65.3 Å²	65.3	24%	0.239	33%	0.329	C	S	.	.	S	Bend	trans	-77.8	-26.5	176.4	76.2	0	0	0	0	112.5	F294 D306 E307 R441 I442	F294-T309 WeakPolarHBondContact CD2-O 3.31Å; F294-T309 WeakPolarHBondContact CE2-O 3.38Å; D306-T309 PolarHBondContact OD1-N 2.9Å; D306-T309 PolarHBondContact OD1-OG1 3.04Å; D306-T309 PolarHBondContact OD2-OG1 2.99Å; E307-T309 PolarHBondContact O-N 2.86Å; T309-R441 CarbonylContact O-C 3.54Å; T309-R441 VanDerWaalsContact O-CA 3.29Å; T309-R441 WeakPolarHBondContact O-CA 3.08Å; T309-I442 PolarHBondContact O-N 3.44Å
310	V	87.4	Confident	77	Confident	1 Å²	1	70.3 Å²	70.3	1%	0.006	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	130.9	-179.9	169.6	0	0	0	0	111.8	T304 L305 D306 Q439 L440 R441	T304-V310 WeakPolarHBondContact CA-O 3.43Å; L305-V310 HydrophobicContact CB-CB 4.4Å; L305-V310 HydrophobicContact CB-CG1 4.04Å; L305-V310 HydrophobicContact CD1-CG1 3.77Å; L305-V310 HydrophobicContact CG-CG1 4.41Å; L305-V310 PolarHBondContact N-O 2.87Å; D306-V310 PolarHBondContact OD1-N 3.04Å; D306-V310 WeakPolarHBondContact OD2-CB 3.21Å; D306-V310 WeakPolarHBondContact OD2-CG2 3.28Å; V310-Q439 HydrophobicContact CG1-CG 3.84Å; V310-Q439 VanDerWaalsContact CG1-NE2 3.27Å; V310-L440 VanDerWaalsContact CA-O 3.32Å; V310-L440 WeakPolarHBondContact CA-O 3.39Å; V310-R441 HydrophobicContact CG2-CB 3.8Å; V310-R441 HydrophobicContact CG2-CG 3.9Å
311	A	89.9	Confident	77.2	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	127.9	169.4	0	0	0	0	0	110	F294 I302 V323 Q439 L440	F294-A311 HydrophobicContact CD2-CB 3.72Å; F294-A311 HydrophobicContact CE2-CB 3.5Å; F294-A311 HydrophobicContact CG-CB 4.43Å; F294-A311 HydrophobicContact CZ-CB 4.04Å; I302-A311 HydrophobicContact CG2-CB 3.88Å; A311-V323 HydrophobicContact CB-CG1 3.81Å; A311-V323 HydrophobicContact CB-CG2 4.27Å; A311-Q439 VanDerWaalsContact O-CA 3.31Å; A311-Q439 WeakPolarHBondContact O-CA 3.39Å; A311-Q439 WeakPolarHBondContact O-CG 3.38Å; A311-L440 PolarHBondContact N-O 3.46Å; A311-L440 PolarHBondContact O-N 2.92Å
312	R	89.3	Confident	77.7	Confident	84 Å²	84	64.7 Å²	64.7	32%	0.317	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	131	174.2	-176	-178.2	-72.6	152.1	4.6	110.2	I302 K303 L305 T438 Q439	I302-R312 WeakPolarHBondContact CA-O 3.26Å; K303-R312 PolarHBondContact N-O 2.71Å; K303-R312 PolarHBondContact O-N 3.23Å; L305-R312 HydrophobicContact CD1-CB 3.58Å; L305-R312 HydrophobicContact CD1-CG 4.34Å; L305-R312 HydrophobicContact CG-CB 4.47Å; R312-T438 CarbonylContact C-O 3.47Å; R312-T438 WeakPolarHBondContact CA-O 3.34Å; R312-Q439 HydrophobicContact CB-CB 4.49Å; R312-Q439 HydrophobicContact CB-CG 3.93Å; R312-Q439 HydrophobicContact CG-CB 4.43Å; R312-Q439 HydrophobicContact CG-CG 4.27Å; R312-Q439 VanDerWaalsContact CZ-OE1 3.26Å
313	S	86.6	Confident	78	Confident	13 Å²	13	64.6 Å²	64.6	9%	0.091	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	129.2	163.9	178.2	0	0	0	0	109.9	H301 T438	H301-S313 WeakPolarHBondContact O-CA 3.33Å; S313-T438 PolarHBondContact N-O 2.85Å
314	E	71.9	Confident	78.5	Confident	104 Å²	104	60 Å²	60	49%	0.486	29%	0.29	S	S	.	.			trans	-97.9	-26.7	-173.8	-175.1	167.4	-121.5	0	0	113.9	H301 K303	H301-E314 PolarHBondContact O-N 3.14Å; K303-E314 WeakPolarHBondContact CD-OE1 3.32Å; K303-E314 WeakPolarHBondContact CD-OE2 3.27Å; K303-E314 WeakPolarHBondContact CE-OE1 3.23Å; K303-E314 WeakPolarHBondContact CE-OE2 3.42Å; K303-E314 IonicContact NZ-OE1 2.79Å; K303-E314 PolarHBondContact NZ-OE1 2.81Å; K303-E314 IonicContact NZ-OE2 2.71Å; K303-E314 PolarHBondContact NZ-OE2 2.99Å
315	H	62.5	Low	79.2	Confident	97 Å²	97	58.3 Å²	58.3	45%	0.449	28%	0.279	S	S	.	.			trans	-105	140.6	-172.8	-77.9	63.6	0	0	0	112.3	H301 R317	H301-H315 HydrophobicContact CB-CB 4.47Å; H315-R317 PolarHBondContact O-N 3.1Å
316	A	54.7	Low	80	Confident	87 Å²	87	56.1 Å²	56.1	72%	0.719	27%	0.268	S	S	*	.	S	Bend	trans	-76.7	-8.5	175.3	0	0	0	0	0	113.6
317	R	55.5	Low	80.7	Confident	192 Å²	192	55 Å²	55	73%	0.725	26%	0.259	S	S	*	.	S	Bend	trans	-95.3	118.6	167	-68.6	-177.3	-179.9	-99	-1.5	107.8	H315 E319	H315-R317 PolarHBondContact O-N 3.1Å; R317-E319 HydrophobicContact CB-CG 4.32Å; R317-E319 PolarHBondContact O-N 3.42Å
318	E	60.4	Low	81.4	Confident	69 Å²	69	49 Å²	49	32%	0.322	24%	0.235	S	C	.	.			trans	-86.1	73.2	-161.2	-56.1	-174.5	151.5	0	0	112.3	Y369 G435	E318-Y369 VanDerWaalsContact O-CE1 3.22Å; E318-Y369 WeakPolarHBondContact O-CE1 3.47Å; E318-G435 WeakPolarHBondContact OE1-CA 3.29Å; E318-G435 PolarHBondContact OE1-N 2.82Å
319	E	65.9	Low	81.8	Confident	66 Å²	66	47.4 Å²	47.4	31%	0.308	23%	0.228	S	C	.	.			trans	-121.1	131	-172.7	-28.3	-161.2	174.9	0	0	110.6	H301 R317 T321 Y369	H301-E319 PolarHBondContact CD2-O 3.25Å; R317-E319 HydrophobicContact CB-CG 4.32Å; R317-E319 PolarHBondContact O-N 3.42Å; E319-T321 PolarHBondContact O-N 2.8Å; E319-Y369 HydrophobicContact CB-CD2 3.91Å; E319-Y369 HydrophobicContact CB-CE1 4.49Å; E319-Y369 HydrophobicContact CB-CE2 3.62Å; E319-Y369 HydrophobicContact CB-CG 4.49Å; E319-Y369 HydrophobicContact CG-CD2 4.26Å; E319-Y369 HydrophobicContact CG-CE1 4.45Å; E319-Y369 HydrophobicContact CG-CE2 3.46Å; E319-Y369 VanDerWaalsContact CG-CE2 3.46Å; E319-Y369 WeakPolarHBondContact OE2-CE2 3.11Å
320	R	74.4	Confident	82.1	Confident	104 Å²	104	50.2 Å²	50.2	39%	0.392	23%	0.234	S	C	.	.			trans	46	68.9	173.9	-62.8	-179.8	172	141.4	-1.2	113	G299 A300 H301 L367 Y369	G299-R320 CarbonylContact C-O 3.07Å; G299-R320 WeakPolarHBondContact CA-O 3.48Å; A300-R320 PolarHBondContact N-O 2.92Å; H301-R320 PolarHBondContact N-O 2.84Å; R320-L367 PolarHBondContact NE-O 3.31Å; R320-Y369 PolarHBondContact N-O 2.83Å
321	T	86	Confident	81.7	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	26%	0.258	C	S	.	.			trans	-109.6	23.6	-178.5	54.7	0	0	0	0	113.5	H301 I302 E319 L433 H434	H301-T321 HydrophobicContact CB-CG2 4.46Å; I302-T321 HydrophobicContact CD1-CG2 4.28Å; E319-T321 PolarHBondContact O-N 2.8Å; T321-L433 WeakPolarHBondContact CB-O 3.38Å; T321-L433 WeakPolarHBondContact CG2-O 3.37Å; T321-L433 PolarHBondContact O-N 3.22Å; T321-L433 PolarHBondContact OG1-N 3.28Å; T321-L433 PolarHBondContact OG1-O 3.26Å; T321-H434 PolarHBondContact OG1-CE1 3.24Å; T321-H434 PolarHBondContact OG1-ND1 2.86Å; T321-H434 PolarHBondContact OG1-NE2 3.27Å
322	L	91	Very high	81.5	Confident	1 Å²	1	55 Å²	55	1%	0.005	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	138.4	-179.9	-74.6	167.8	0	0	0	112.6	R298 G299 F324 L367 P368 P371 L374 F430 F431	R298-L322 CarbonylContact C-O 3.54Å; R298-L322 WeakPolarHBondContact CA-O 3.4Å; G299-L322 PolarHBondContact N-O 3.24Å; L322-F324 HydrophobicContact CB-CE2 4.21Å; L322-L367 HydrophobicContact CB-CD1 4.47Å; L322-L367 HydrophobicContact CD1-CB 4.33Å; L322-L367 HydrophobicContact CD1-CD2 4.2Å; L322-P368 HydrophobicContact CD1-CG 4.34Å; L322-P371 HydrophobicContact CD2-CB 4.18Å; L322-L374 HydrophobicContact CD1-CD1 3.99Å; L322-L374 HydrophobicContact CD1-CD2 4.39Å; L322-L374 HydrophobicContact CD2-CD1 4.16Å; L322-F430 HydrophobicContact CD2-CD2 3.85Å; L322-F430 HydrophobicContact CD2-CE2 4.45Å; L322-F431 CarbonylContact C-O 3.54Å; L322-F431 WeakPolarHBondContact CA-O 3.07Å
323	V	93.7	Very high	81.5	Confident	1 Å²	1	51 Å²	51	1%	0.006	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	155.5	165.3	-68.1	0	0	0	0	110.2	F294 R298 I302 A311 F430 F431 L433	F294-V323 HydrophobicContact CD1-CB 3.78Å; F294-V323 HydrophobicContact CD1-CG2 3.62Å; F294-V323 HydrophobicContact CE1-CB 4.18Å; F294-V323 HydrophobicContact CE1-CG2 3.47Å; F294-V323 VanDerWaalsContact CE1-CG2 3.47Å; F294-V323 HydrophobicContact CG-CB 4.28Å; F294-V323 HydrophobicContact CG-CG2 4.39Å; F294-V323 HydrophobicContact CZ-CG2 4.12Å; R298-V323 HydrophobicContact CB-CG1 4.11Å; I302-V323 HydrophobicContact CB-CG1 4.25Å; I302-V323 HydrophobicContact CG1-CG1 4.02Å; I302-V323 HydrophobicContact CG2-CG1 3.68Å; A311-V323 HydrophobicContact CB-CG1 3.81Å; A311-V323 HydrophobicContact CB-CG2 4.27Å; V323-F430 CarbonylContact O-C 3.54Å; V323-F430 WeakPolarHBondContact O-CA 3.49Å; V323-F430 WeakPolarHBondContact O-CB 3.44Å; V323-F431 HydrophobicContact CG2-CB 3.9Å; V323-F431 HydrophobicContact CG2-CD2 4.3Å; V323-F431 PolarHBondContact N-O 2.9Å; V323-F431 PolarHBondContact O-N 2.75Å; V323-L433 HydrophobicContact CG2-CD1 4.07Å
324	F	95.4	Very high	81.8	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	159.5	-176.1	-60.8	-96	0	0	0	110.4	F294 H295 L297 L322 T355 P359 L367 W381 M429 F430	F294-F324 CarbonylContact C-O 3.45Å; F294-F324 WeakPolarHBondContact CA-O 3.29Å; H295-F324 HydrophobicContact CB-CB 4.04Å; H295-F324 PolarHBondContact N-O 3.36Å; L297-F324 HydrophobicContact CD2-CD2 4.43Å; L297-F324 HydrophobicContact CD2-CE2 4.18Å; L297-F324 HydrophobicContact CG-CE2 4.47Å; L322-F324 HydrophobicContact CB-CE2 4.21Å; F324-T355 HydrophobicContact CE1-CG2 4.45Å; F324-P359 HydrophobicContact CB-CB 3.92Å; F324-P359 HydrophobicContact CB-CG 3.64Å; F324-P359 HydrophobicContact CD1-CB 4.23Å; F324-P359 HydrophobicContact CD1-CG 3.75Å; F324-P359 HydrophobicContact CD2-CB 4.45Å; F324-P359 HydrophobicContact CG-CB 3.95Å; F324-P359 HydrophobicContact CG-CG 3.81Å; F324-L367 HydrophobicContact CE2-CD1 4.26Å; F324-L367 HydrophobicContact CE2-CD2 3.68Å; F324-L367 HydrophobicContact CZ-CD2 3.66Å; F324-W381 AromaticContact CE1-CH2 3.73Å; F324-W381 HydrophobicContact CE1-CH2 3.73Å; F324-W381 AromaticContact CE1-CZ3 3.72Å; F324-W381 HydrophobicContact CE1-CZ3 3.72Å; F324-W381 HydrophobicContact CZ-CH2 4.07Å; F324-W381 HydrophobicContact CZ-CZ3 4.24Å; F324-M429 CarbonylContact C-O 3.56Å; F324-M429 VanDerWaalsContact CA-O 3.27Å; F324-M429 WeakPolarHBondContact CA-O 3.07Å; F324-F430 HydrophobicContact CD1-CB 3.6Å; F324-F430 HydrophobicContact CE1-CB 3.71Å; F324-F430 HydrophobicContact CE1-CG 4.36Å; F324-F430 HydrophobicContact CG-CB 4.26Å; F324-F430 HydrophobicContact CZ-CB 4.44Å
325	T	95.8	Very high	82.9	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	146.7	163.7	50.2	0	0	0	0	110.9	L292 R327 M429	L292-T325 HydrophobicContact CD1-CG2 3.88Å; L292-T325 HydrophobicContact CD2-CG2 4.26Å; L292-T325 HydrophobicContact CG-CG2 4.21Å; T325-R327 VanDerWaalsContact C-N 3.3Å; T325-R327 WeakPolarHBondContact CB-O 3.47Å; T325-R327 PolarHBondContact O-N 2.82Å; T325-R327 PolarHBondContact OG1-O 3.4Å; T325-M429 HydrophobicContact CG2-CB 3.81Å; T325-M429 PolarHBondContact N-O 3.46Å; T325-M429 PolarHBondContact OG1-N 3.34Å
326	N	94.3	Very high	84.4	Confident	37 Å²	37	42.9 Å²	42.9	20%	0.198	21%	0.214	C	C	.	.	S	Bend	trans	-62.2	-34.7	177.6	64.4	-33	0	0	0	113.3	D291 H293	D291-N326 PolarHBondContact O-ND2 3.43Å; H293-N326 PolarHBondContact CD2-ND2 2.97Å; H293-N326 WeakPolarHBondContact CE1-CB 3.49Å; H293-N326 PolarHBondContact N-OD1 3.27Å; H293-N326 PolarHBondContact NE2-ND2 3.35Å; H293-N326 WeakPolarHBondContact O-CB 3.42Å; H293-N326 PolarHBondContact O-N 3.08Å; H293-N326 PolarHBondContact O-OD1 3.39Å; H293-N326 VanDerWaalsContact O-OD1 3.12Å
327	R	94.4	Very high	86.4	Confident	34 Å²	34	38.7 Å²	38.7	13%	0.128	18%	0.18	C	C	.	.	S	Bend	trans	-124.8	163	178.8	65.2	162.2	176	73.3	-0.6	111.4	E289 D291 L292 T325 E333 W428	E289-R327 IonicContact OE2-NH2 3.69Å; D291-R327 IonicContact OD1-CZ 3.77Å; D291-R327 IonicContact OD1-NE 2.76Å; D291-R327 PolarHBondContact OD1-NE 3.24Å; D291-R327 IonicContact OD1-NH2 3.76Å; D291-R327 PolarHBondContact OD1-NH2 3.24Å; D291-R327 IonicContact OD2-CZ 3.84Å; D291-R327 IonicContact OD2-NE 2.83Å; D291-R327 PolarHBondContact OD2-NE 2.98Å; D291-R327 IonicContact OD2-NH2 2.79Å; D291-R327 PolarHBondContact OD2-NH2 2.81Å; L292-R327 HydrophobicContact CD1-CG 3.9Å; T325-R327 VanDerWaalsContact C-N 3.3Å; T325-R327 WeakPolarHBondContact CB-O 3.47Å; T325-R327 PolarHBondContact O-N 2.82Å; T325-R327 PolarHBondContact OG1-O 3.4Å; R327-E333 IonicContact CZ-OE1 3.75Å; R327-E333 IonicContact CZ-OE2 3.91Å; R327-E333 IonicContact NH1-OE1 2.79Å; R327-E333 PolarHBondContact NH1-OE1 2.67Å; R327-E333 VanDerWaalsContact NH1-OE1 3.12Å; R327-E333 IonicContact NH1-OE2 3.59Å; R327-E333 PolarHBondContact NH1-OE2 3.09Å; R327-E333 IonicContact NH2-OE1 3.25Å; R327-E333 PolarHBondContact NH2-OE1 3.36Å; R327-E333 IonicContact NH2-OE2 2.86Å; R327-W428 VanDerWaalsContact C-CD1 3.42Å
328	P	93.4	Very high	88.2	Confident	44 Å²	44	31.7 Å²	31.7	29%	0.286	16%	0.155	S	C	.	.	P	Polyproline II helix	trans	-65.4	157.9	167.3	28.7	-35	0	0	0	111.1	P426 L427 W428	P328-P426 HydrophobicContact CB-CB 3.71Å; P328-P426 HydrophobicContact CG-CB 4.07Å; P328-L427 CarbonylContact C-O 3.46Å; P328-L427 VanDerWaalsContact CA-O 3.26Å; P328-L427 WeakPolarHBondContact CA-O 3.34Å; P328-W428 HydrophobicContact CB-CD2 4.02Å; P328-W428 HydrophobicContact CB-CE3 4.27Å; P328-W428 HydrophobicContact CB-CH2 4.41Å; P328-W428 HydrophobicContact CB-CZ2 4.18Å; P328-W428 HydrophobicContact CB-CZ3 4.45Å; P328-W428 HydrophobicContact CG-CZ2 4.1Å
329	L	91.9	Very high	89.8	Confident	22 Å²	22	28.4 Å²	28.4	12%	0.115	14%	0.14	C	C	.	.	P	Polyproline II helix	trans	-70	143.7	172.7	-57.8	-171.8	0	0	0	111.3	E333 V335 V400 L427 M429	L329-E333 WeakPolarHBondContact CA-OE2 3.28Å; L329-V335 HydrophobicContact CD2-CG2 3.48Å; L329-V335 VanDerWaalsContact CD2-CG2 3.48Å; L329-V400 HydrophobicContact CD1-CB 4.14Å; L329-V400 HydrophobicContact CD1-CG2 3.47Å; L329-V400 VanDerWaalsContact CD1-CG2 3.47Å; L329-L427 PolarHBondContact N-O 3.11Å; L329-M429 HydrophobicContact CD1-CG 3.59Å; L329-M429 HydrophobicContact CD1-SD 4.36Å; L329-M429 HydrophobicContact CD2-CB 4.48Å; L329-M429 HydrophobicContact CD2-CG 3.82Å; L329-M429 HydrophobicContact CG-CG 3.95Å
330	R	88.8	Confident	91	Very high	98 Å²	98	27.2 Å²	27.2	37%	0.37	14%	0.137	S	C	.	.	P	Polyproline II helix	trans	-79.8	148.7	163.7	-42.7	-179.5	-154	-74.9	4	108.7	E289 D291 G332 E333	E289-R330 IonicContact OE2-CZ 3.41Å; E289-R330 IonicContact OE2-NE 2.74Å; E289-R330 PolarHBondContact OE2-NE 3Å; E289-R330 IonicContact OE2-NH2 3.81Å; E289-R330 PolarHBondContact OE2-NH2 2.9Å; D291-R330 IonicContact OD1-NH2 2.77Å; D291-R330 IonicContact OD2-CZ 2.92Å; D291-R330 IonicContact OD2-NH2 3.8Å; D291-R330 PolarHBondContact OD2-NH2 2.87Å; R330-G332 PolarHBondContact O-N 2.9Å; R330-E333 HydrophobicContact CB-CB 4.12Å; R330-E333 PolarHBondContact N-OE2 2.81Å; R330-E333 WeakPolarHBondContact O-CB 3.43Å; R330-E333 PolarHBondContact O-N 3.13Å; R330-E333 VanDerWaalsContact O-N 3.08Å
331	T	80.9	Confident	91.7	Very high	83 Å²	83	27.2 Å²	27.2	51%	0.509	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	128.4	178.4	-55.7	0	0	0	0	110.6	E333 Q402 H447	T331-E333 VanDerWaalsContact C-N 3.25Å; T331-E333 PolarHBondContact O-N 2.7Å; T331-Q402 HydrophobicContact CG2-CB 3.92Å; T331-Q402 HydrophobicContact CG2-CG 4.19Å; T331-H447 PolarHBondContact O-CD2 2.94Å; T331-H447 PolarHBondContact O-NE2 2.98Å
332	G	84.6	Confident	91.8	Very high	19 Å²	19	28.3 Å²	28.3	20%	0.196	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.7	7.5	-175.9	0	0	0	0	0	114.5	R330 L399 V400	R330-G332 PolarHBondContact O-N 2.9Å; G332-L399 WeakPolarHBondContact O-CD1 3.24Å; G332-V400 PolarHBondContact N-O 2.9Å
333	E	90.1	Very high	91.5	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	135.6	171	-173.8	174.8	-166.4	0	0	111.2	R327 L329 R330 T331 L399 S445 T446	R327-E333 IonicContact CZ-OE1 3.75Å; R327-E333 IonicContact CZ-OE2 3.91Å; R327-E333 IonicContact NH1-OE1 2.79Å; R327-E333 PolarHBondContact NH1-OE1 2.67Å; R327-E333 VanDerWaalsContact NH1-OE1 3.12Å; R327-E333 IonicContact NH1-OE2 3.59Å; R327-E333 PolarHBondContact NH1-OE2 3.09Å; R327-E333 IonicContact NH2-OE1 3.25Å; R327-E333 PolarHBondContact NH2-OE1 3.36Å; R327-E333 IonicContact NH2-OE2 2.86Å; L329-E333 WeakPolarHBondContact CA-OE2 3.28Å; R330-E333 HydrophobicContact CB-CB 4.12Å; R330-E333 PolarHBondContact N-OE2 2.81Å; R330-E333 WeakPolarHBondContact O-CB 3.43Å; R330-E333 PolarHBondContact O-N 3.13Å; R330-E333 VanDerWaalsContact O-N 3.08Å; T331-E333 VanDerWaalsContact C-N 3.25Å; T331-E333 PolarHBondContact O-N 2.7Å; E333-L399 WeakPolarHBondContact O-CD1 3.42Å; E333-S445 WeakPolarHBondContact OE1-CB 3.5Å; E333-S445 PolarHBondContact OE1-OG 2.96Å; E333-T446 CarbonylContact C-O 3.59Å; E333-T446 VanDerWaalsContact CA-O 3.29Å; E333-T446 WeakPolarHBondContact CA-O 3.43Å
334	T	92.7	Very high	90.5	Very high	20 Å²	20	36.1 Å²	36.1	12%	0.123	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	118.8	168.5	-54.7	0	0	0	0	109.8	F336 F398 L399 S445 T446	T334-F336 HydrophobicContact CG2-CD2 4.42Å; T334-F336 HydrophobicContact CG2-CE1 3.96Å; T334-F336 HydrophobicContact CG2-CE2 3.81Å; T334-F336 HydrophobicContact CG2-CZ 3.56Å; T334-F398 CarbonylContact C-O 3.56Å; T334-F398 WeakPolarHBondContact CA-O 3.49Å; T334-L399 HydrophobicContact CG2-CB 4.49Å; T334-S445 CarbonylContact O-C 3.58Å; T334-S445 WeakPolarHBondContact O-CA 3.44Å; T334-S445 WeakPolarHBondContact O-CB 3.5Å; T334-T446 PolarHBondContact N-O 3.42Å; T334-T446 PolarHBondContact O-N 2.85Å
335	V	94.8	Very high	89.6	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	127.4	174.6	177.3	0	0	0	0	110	L292 L329 I337 G397 F398	L292-V335 HydrophobicContact CD2-CB 4.11Å; L292-V335 HydrophobicContact CD2-CG1 3.57Å; L292-V335 HydrophobicContact CD2-CG2 3.56Å; L329-V335 HydrophobicContact CD2-CG2 3.48Å; L329-V335 VanDerWaalsContact CD2-CG2 3.48Å; V335-I337 HydrophobicContact CG1-CD1 3.79Å; V335-I337 HydrophobicContact CG1-CG1 4.23Å; V335-G397 CarbonylContact O-C 3.52Å; V335-G397 WeakPolarHBondContact O-CA 3.45Å; V335-F398 PolarHBondContact N-O 2.9Å; V335-F398 PolarHBondContact O-N 3.07Å
336	F	94.5	Very high	88.6	Confident	23 Å²	23	44.1 Å²	44.1	10%	0.101	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	122.7	178.5	-66.1	-81.1	0	0	0	111.8	L284 P285 L288 T334 I395 L396 L443 G444 T446	L284-F336 HydrophobicContact CD2-CB 4.35Å; L284-F336 HydrophobicContact CD2-CD1 3.62Å; L284-F336 HydrophobicContact CD2-CD2 4.49Å; L284-F336 HydrophobicContact CD2-CE1 3.99Å; L284-F336 HydrophobicContact CD2-CG 3.9Å; P285-F336 HydrophobicContact CG-CE2 4.4Å; P285-F336 HydrophobicContact CG-CZ 4.39Å; L288-F336 HydrophobicContact CD2-CD2 3.81Å; L288-F336 HydrophobicContact CD2-CE2 4.04Å; T334-F336 HydrophobicContact CG2-CD2 4.42Å; T334-F336 HydrophobicContact CG2-CE1 3.96Å; T334-F336 HydrophobicContact CG2-CE2 3.81Å; T334-F336 HydrophobicContact CG2-CZ 3.56Å; F336-I395 HydrophobicContact CD1-CG2 4.35Å; F336-L396 CarbonylContact C-O 3.37Å; F336-L396 WeakPolarHBondContact CA-O 3.17Å; F336-L443 HydrophobicContact CB-CB 4.07Å; F336-L443 HydrophobicContact CB-CD1 4.41Å; F336-L443 PolarHBondContact O-N 3.49Å; F336-G444 PolarHBondContact N-O 3.09Å; F336-T446 HydrophobicContact CE2-CG2 4.28Å
337	I	95.3	Very high	87.4	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	126.3	179.4	-52.4	-63	0	0	0	109.6	V335 I395 L396 F398 F431 L440 R441 I442	V335-I337 HydrophobicContact CG1-CD1 3.79Å; V335-I337 HydrophobicContact CG1-CG1 4.23Å; I337-I395 WeakPolarHBondContact O-CA 3.17Å; I337-L396 PolarHBondContact N-O 2.69Å; I337-L396 PolarHBondContact O-N 2.92Å; I337-F398 HydrophobicContact CB-CE2 4.07Å; I337-F398 HydrophobicContact CG1-CD2 3.96Å; I337-F398 HydrophobicContact CG1-CE2 3.69Å; I337-F431 HydrophobicContact CD1-CE1 4.35Å; I337-F431 HydrophobicContact CD1-CE2 3.92Å; I337-F431 HydrophobicContact CD1-CZ 3.68Å; I337-F431 HydrophobicContact CG1-CE1 3.84Å; I337-F431 HydrophobicContact CG1-CE2 4.32Å; I337-F431 HydrophobicContact CG1-CZ 3.6Å; I337-L440 HydrophobicContact CG2-CB 4.07Å; I337-L440 HydrophobicContact CG2-CD1 4.27Å; I337-L440 HydrophobicContact CG2-CD2 3.92Å; I337-L440 HydrophobicContact CG2-CG 4.32Å; I337-R441 CarbonylContact C-O 3.48Å; I337-R441 WeakPolarHBondContact CA-O 3.49Å; I337-I442 HydrophobicContact CD1-CB 4.3Å; I337-I442 HydrophobicContact CD1-CD1 4.41Å; I337-I442 HydrophobicContact CD1-CG1 3.74Å; I337-I442 HydrophobicContact CD1-CG2 4.49Å
338	K	94.1	Very high	86.4	Confident	45 Å²	45	49.5 Å²	49.5	20%	0.196	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	127.7	170.5	-170.7	165	-173.2	165.4	0	111.2	T340 S393 D394 I395 L440 R441 L443	K338-T340 HydrophobicContact CG-CG2 4.33Å; K338-T340 PolarHBondContact O-N 3.05Å; K338-S393 WeakPolarHBondContact CE-O 3.42Å; K338-D394 CarbonylContact C-O 3.59Å; K338-D394 WeakPolarHBondContact CA-O 3.46Å; K338-I395 HydrophobicContact CD-CG1 4.41Å; K338-I395 HydrophobicContact CG-CG1 4.27Å; K338-L440 CarbonylContact O-C 3.15Å; K338-L440 WeakPolarHBondContact O-CA 3.44Å; K338-R441 HydrophobicContact CB-CB 4.47Å; K338-R441 PolarHBondContact N-O 3.09Å; K338-R441 PolarHBondContact O-N 3.14Å; K338-L443 HydrophobicContact CB-CD1 4.05Å; K338-L443 HydrophobicContact CB-CD2 3.79Å; K338-L443 HydrophobicContact CB-CG 3.92Å; K338-L443 HydrophobicContact CD-CD2 4.26Å
339	V	93.4	Very high	85.9	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	107.1	166.6	-179.5	0	0	0	0	107.3	L390 Q391 S393 D394 V437 L440	V339-L390 HydrophobicContact CG2-CB 4.28Å; V339-L390 HydrophobicContact CG2-CD1 4.11Å; V339-L390 HydrophobicContact CG2-CD2 4.29Å; V339-L390 HydrophobicContact CG2-CG 4.47Å; V339-Q391 WeakPolarHBondContact CB-O 3.33Å; V339-Q391 WeakPolarHBondContact CG1-O 3.14Å; V339-S393 WeakPolarHBondContact O-CA 3.09Å; V339-S393 PolarHBondContact O-N 2.76Å; V339-D394 HydrophobicContact CB-CB 4.42Å; V339-D394 HydrophobicContact CG2-CB 4.43Å; V339-D394 PolarHBondContact N-O 3.18Å; V339-V437 HydrophobicContact CG1-CG1 4.25Å; V339-V437 HydrophobicContact CG1-CG2 4.26Å; V339-L440 HydrophobicContact CG2-CD2 4.15Å
340	T	91.3	Very high	85.8	Confident	40 Å²	40	47.6 Å²	47.6	25%	0.245	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	-25.9	-176.4	49.7	0	0	0	0	112.9	K338 Q439 R441	K338-T340 HydrophobicContact CG-CG2 4.33Å; K338-T340 PolarHBondContact O-N 3.05Å; T340-Q439 PolarHBondContact N-O 2.86Å; T340-Q439 WeakPolarHBondContact OG1-CB 3.32Å; T340-Q439 VanDerWaalsContact OG1-CD 3.3Å; T340-Q439 WeakPolarHBondContact OG1-CG 3.43Å; T340-Q439 PolarHBondContact OG1-NE2 3.25Å; T340-Q439 PolarHBondContact OG1-O 3.36Å; T340-Q439 VanDerWaalsContact OG1-O 3.13Å; T340-R441 HydrophobicContact CG2-CB 3.72Å
341	K	89.3	Confident	85.8	Confident	104 Å²	104	43 Å²	43	45%	0.452	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	120.8	168.8	-61.1	-170.2	179.4	-169.9	0	111.8	T438 Q439	K341-T438 PolarHBondContact O-N 2.83Å; K341-T438 PolarHBondContact O-OG1 3.29Å; K341-Q439 HydrophobicContact CB-CB 3.73Å; K341-Q439 HydrophobicContact CD-CB 4.49Å; K341-Q439 HydrophobicContact CG-CB 4.01Å; K341-Q439 PolarHBondContact N-O 2.89Å; K341-Q439 PolarHBondContact O-N 2.81Å; K341-Q439 VanDerWaalsContact O-N 3.11Å
342	S	88.5	Confident	86.4	Confident	23 Å²	23	39 Å²	39	16%	0.161	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	155.9	163.4	65.8	0	0	0	0	111.2	L390 S392 A436	S342-L390 WeakPolarHBondContact CB-O 3.33Å; S342-L390 PolarHBondContact OG-O 3.27Å; S342-S392 PolarHBondContact N-OG 2.92Å; S342-S392 PolarHBondContact OG-N 3.21Å; S342-S392 PolarHBondContact OG-OG 2.76Å; S342-A436 CarbonylContact C-O 3.59Å; S342-A436 WeakPolarHBondContact CA-O 3.24Å
343	S	83.4	Confident	86.6	Confident	38 Å²	38	38.2 Å²	38.2	27%	0.266	24%	0.237	S	C	.	.			trans	-126.4	107.8	173.5	-175.7	0	0	0	0	108.7	A345 R346 A436	S343-A345 PolarHBondContact O-N 2.81Å; S343-A345 VanDerWaalsContact O-N 3.09Å; S343-R346 PolarHBondContact O-N 3.26Å; S343-A436 PolarHBondContact N-O 3.1Å; S343-A436 WeakPolarHBondContact O-CA 3.22Å
344	P	74	Confident	86.7	Confident	128 Å²	128	38.2 Å²	38.2	83%	0.831	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-15.9	179.3	-23.9	34.5	0	0	0	114.3	R346	P344-R346 VanDerWaalsContact C-N 3.3Å; P344-R346 PolarHBondContact O-N 3.4Å
345	A	75.4	Confident	86.6	Confident	94 Å²	94	37.3 Å²	37.3	78%	0.777	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-10.5	179.3	0	0	0	0	0	114	S343	S343-A345 PolarHBondContact O-N 2.81Å; S343-A345 VanDerWaalsContact O-N 3.09Å
346	R	75.5	Confident	86.3	Confident	75 Å²	75	38.6 Å²	38.6	28%	0.283	24%	0.24	S	C	.	.	S	Bend	trans	-107.2	133	174.4	-69.7	-171.7	-57	-113.3	-16.7	110.6	S343 P344 G435 A436 T438	S343-R346 PolarHBondContact O-N 3.26Å; P344-R346 VanDerWaalsContact C-N 3.3Å; P344-R346 PolarHBondContact O-N 3.4Å; R346-G435 WeakPolarHBondContact CB-O 3.46Å; R346-G435 PolarHBondContact NE-O 3.1Å; R346-G435 PolarHBondContact NH2-O 3.37Å; R346-A436 PolarHBondContact NH2-O 3.01Å; R346-A436 PolarHBondContact O-N 3.2Å; R346-T438 PolarHBondContact NH2-OG1 2.78Å
347	T	69.1	Low	86	Confident	136 Å²	136	37.9 Å²	37.9	83%	0.834	24%	0.238	S	C	*	.			trans	-77.1	143.2	173.3	44.9	0	0	0	0	110.7	G435	T347-G435 WeakPolarHBondContact O-CA 3.42Å
348	G	72.8	Confident	85.8	Confident	48 Å²	48	40.6 Å²	40.6	50%	0.495	25%	0.253	S	S	.	.			trans	123	150.8	177.3	0	0	0	0	0	113.4	A436	G348-A436 PolarHBondContact O-N 3.5Å; G348-A436 VanDerWaalsContact O-N 3.15Å
349	S	82.9	Confident	85.7	Confident	26 Å²	26	38.5 Å²	38.5	18%	0.182	24%	0.243	C	C	.	.			trans	-113.5	156.2	-176.2	-175	0	0	0	0	111.6	S351 V386	S349-S351 PolarHBondContact O-N 3.33Å; S349-V386 PolarHBondContact OG-O 2.88Å
350	L	90	Very high	85.6	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	27%	0.27	C	S	.	.			trans	-56.4	123.5	171.1	176.4	62.9	0	0	0	109.7	R385 V386 L390 L396 F431 V437 L440	L350-R385 WeakPolarHBondContact O-CA 3.46Å; L350-V386 HydrophobicContact CB-CG2 4.04Å; L350-V386 HydrophobicContact CD2-CG2 4.17Å; L350-V386 HydrophobicContact CG-CG2 4.29Å; L350-V386 PolarHBondContact O-N 3.41Å; L350-L390 HydrophobicContact CB-CD1 3.52Å; L350-L390 HydrophobicContact CD2-CD1 3.99Å; L350-L390 HydrophobicContact CG-CD1 4.41Å; L350-L396 HydrophobicContact CD2-CD1 3.7Å; L350-F431 HydrophobicContact CD1-CB 4.43Å; L350-V437 HydrophobicContact CB-CG2 4.24Å; L350-V437 HydrophobicContact CD1-CG1 4.44Å; L350-L440 HydrophobicContact CD1-CD1 3.74Å; L350-L440 HydrophobicContact CD1-CD2 4.35Å; L350-L440 HydrophobicContact CD2-CD1 4.45Å; L350-L440 HydrophobicContact CD2-CD2 4.14Å
351	S	89.9	Confident	85.5	Confident	1 Å²	1	45 Å²	45	1%	0.007	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	141.5	168.6	-55	0	0	0	0	108.9	S349 C384 F431 G432	S349-S351 PolarHBondContact O-N 3.33Å; S351-C384 WeakPolarHBondContact CA-O 3.39Å; S351-F431 CarbonylContact O-C 3.59Å; S351-F431 WeakPolarHBondContact O-CA 3.49Å; S351-G432 PolarHBondContact N-O 3.1Å; S351-G432 VanDerWaalsContact N-O 3.14Å; S351-G432 PolarHBondContact O-N 3.05Å
352	Y	92.5	Very high	85.4	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	169.9	176.1	67.1	-86.6	0	0	0	109.7	C384 R385 V386 F398 Q418 F430	Y352-C384 HydrophobicContact CD1-CB 4.27Å; Y352-C384 HydrophobicContact CD2-CB 4.06Å; Y352-C384 HydrophobicContact CE1-CB 3.77Å; Y352-C384 HydrophobicContact CE2-CB 3.51Å; Y352-C384 HydrophobicContact CG-CB 4.39Å; Y352-C384 PolarHBondContact N-O 3.41Å; Y352-C384 PolarHBondContact O-N 2.89Å; Y352-C384 VanDerWaalsContact O-O 3.05Å; Y352-C384 WeakPolarHBondContact OH-CB 3.41Å; Y352-R385 VanDerWaalsContact CE1-C 3.47Å; Y352-V386 HydrophobicContact CD1-CG2 3.76Å; Y352-V386 HydrophobicContact CE1-CG2 3.75Å; Y352-F398 AromaticContact CD1-CE1 3.78Å; Y352-F398 HydrophobicContact CD1-CE1 3.78Å; Y352-F398 HydrophobicContact CD1-CZ 4.37Å; Y352-F398 AromaticContact CD2-CD1 3.75Å; Y352-F398 HydrophobicContact CD2-CD1 3.75Å; Y352-F398 AromaticContact CD2-CE1 3.45Å; Y352-F398 HydrophobicContact CD2-CE1 3.45Å; Y352-F398 VanDerWaalsContact CD2-CE1 3.45Å; Y352-F398 HydrophobicContact CE1-CE1 4.06Å; Y352-F398 AromaticContact CE2-CD1 3.96Å; Y352-F398 HydrophobicContact CE2-CD1 3.96Å; Y352-F398 AromaticContact CE2-CE1 3.78Å; Y352-F398 HydrophobicContact CE2-CE1 3.78Å; Y352-F398 HydrophobicContact CG-CD1 4.22Å; Y352-F398 AromaticContact CG-CE1 3.46Å; Y352-F398 HydrophobicContact CG-CE1 3.46Å; Y352-F398 VanDerWaalsContact CG-CE1 3.46Å; Y352-F398 HydrophobicContact CG-CZ 4.17Å; Y352-Q418 WeakPolarHBondContact OH-CB 3.43Å; Y352-Q418 WeakPolarHBondContact OH-CG 3.48Å; Y352-Q418 PolarHBondContact OH-OE1 2.89Å; Y352-Q418 VanDerWaalsContact OH-OE1 3.08Å; Y352-F430 CarbonylContact C-O 3.6Å; Y352-F430 VanDerWaalsContact CA-O 3.24Å; Y352-F430 WeakPolarHBondContact CA-O 3.47Å
353	G	90.1	Very high	85.2	Confident	2 Å²	2	48.1 Å²	48.1	2%	0.021	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	173.4	-176.9	176.3	0	0	0	0	0	113.4	A382 M429 F430	G353-A382 CarbonylContact C-O 3.56Å; G353-A382 WeakPolarHBondContact CA-O 3.33Å; G353-M429 CarbonylContact O-C 3.5Å; G353-M429 WeakPolarHBondContact O-CA 3.32Å; G353-M429 VanDerWaalsContact O-SD 3.39Å; G353-F430 PolarHBondContact N-O 2.85Å; G353-F430 WeakPolarHBondContact O-CD1 3.22Å; G353-F430 PolarHBondContact O-N 3.12Å
354	V	91.3	Very high	85.2	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	150.6	174.1	-65.6	0	0	0	0	111.7	F380 A382 V400 V406 V421 L427 W428 M429	V354-F380 HydrophobicContact CG2-CE1 4.5Å; V354-A382 HydrophobicContact CG2-CB 4.1Å; V354-A382 PolarHBondContact N-O 3.22Å; V354-A382 VanDerWaalsContact N-O 3.1Å; V354-A382 PolarHBondContact O-N 3.42Å; V354-V400 HydrophobicContact CG1-CG2 4.27Å; V354-V406 HydrophobicContact CG2-CG2 4.31Å; V354-V421 HydrophobicContact CG2-CB 3.87Å; V354-V421 HydrophobicContact CG2-CG1 3.2Å; V354-V421 HydrophobicContact CG2-CG2 4.01Å; V354-L427 HydrophobicContact CB-CB 4.44Å; V354-L427 HydrophobicContact CG2-CD1 4.37Å; V354-W428 CarbonylContact C-O 3.6Å; V354-W428 VanDerWaalsContact CA-O 3.25Å; V354-W428 WeakPolarHBondContact CA-O 3.4Å; V354-M429 HydrophobicContact CG1-CG 4.02Å; V354-M429 HydrophobicContact CG1-SD 3.35Å; V354-M429 WeakPolarHBondContact CG1-SD 3.46Å
355	T	90.6	Very high	85.6	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	149	176.2	-176.2	0	0	0	0	111.3	F324 C357 F380 W381 L427 W428 F430	F324-T355 HydrophobicContact CE1-CG2 4.45Å; T355-C357 VanDerWaalsContact C-N 3.28Å; T355-C357 HydrophobicContact CG2-CB 4.32Å; T355-C357 WeakPolarHBondContact CG2-O 3.08Å; T355-C357 VanDerWaalsContact OG1-CB 3.23Å; T355-C357 WeakPolarHBondContact OG1-CB 3.48Å; T355-C357 PolarHBondContact OG1-N 3.22Å; T355-F380 WeakPolarHBondContact CA-O 3.08Å; T355-F380 WeakPolarHBondContact CB-O 3.41Å; T355-F380 PolarHBondContact OG1-O 3.29Å; T355-W381 VanDerWaalsContact CB-CE3 3.46Å; T355-W381 HydrophobicContact CG2-CE3 4.04Å; T355-W381 HydrophobicContact CG2-CH2 3.96Å; T355-W381 HydrophobicContact CG2-CZ3 3.66Å; T355-L427 CarbonylContact O-C 3.58Å; T355-L427 WeakPolarHBondContact O-CA 3.3Å; T355-W428 HydrophobicContact CG2-CB 4.28Å; T355-W428 PolarHBondContact N-O 2.78Å; T355-W428 PolarHBondContact O-N 3.2Å; T355-F430 HydrophobicContact CG2-CD1 4.24Å
356	S	88.4	Confident	85.9	Confident	27 Å²	27	45.6 Å²	45.6	19%	0.189	27%	0.269	C	S	.	.	S	Bend	trans	-90.7	8.2	165.9	85.6	0	0	0	0	112.4	F380	S356-F380 PolarHBondContact N-O 3.2Å
357	C	87.3	Confident	86.3	Confident	8 Å²	8	42.2 Å²	42.2	5%	0.054	26%	0.257	C	S	.	.	S	Bend	trans	-86	119	174	-169.6	0	0	0	0	108.7	T355 P359 E379 W381	T355-C357 VanDerWaalsContact C-N 3.28Å; T355-C357 HydrophobicContact CG2-CB 4.32Å; T355-C357 WeakPolarHBondContact CG2-O 3.08Å; T355-C357 VanDerWaalsContact OG1-CB 3.23Å; T355-C357 WeakPolarHBondContact OG1-CB 3.48Å; T355-C357 PolarHBondContact OG1-N 3.22Å; C357-P359 WeakPolarHBondContact O-CD 3.25Å; C357-E379 HydrophobicContact CB-CB 3.87Å; C357-E379 HydrophobicContact CB-CG 4.14Å; C357-W381 HydrophobicContact CB-CH2 4.33Å; C357-W381 HydrophobicContact CB-CZ2 3.76Å
358	D	91.3	Very high	86.7	Confident	58 Å²	58	37 Å²	37	31%	0.31	23%	0.225	S	C	.	.			trans	-62.2	120.9	174.5	-174	-17.6	0	0	0	109.9	A360 V361 W428	D358-A360 PolarHBondContact O-N 3.06Å; D358-A360 VanDerWaalsContact O-N 3.09Å; D358-A360 VanDerWaalsContact OD1-CB 3.26Å; D358-A360 WeakPolarHBondContact OD1-CB 3.3Å; D358-A360 PolarHBondContact OD1-N 3.08Å; D358-V361 HydrophobicContact CB-CG1 4.38Å; D358-V361 HydrophobicContact CB-CG2 4.37Å; D358-V361 WeakPolarHBondContact O-CG2 3.35Å; D358-V361 PolarHBondContact O-N 2.92Å; D358-W428 HydrophobicContact CB-CH2 3.87Å; D358-W428 HydrophobicContact CB-CZ2 4.01Å; D358-W428 HydrophobicContact CB-CZ3 4.35Å
359	P	92.1	Very high	86.8	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-58.3	-19.1	175.7	-24.8	36.1	0	0	0	114	H295 L297 F324 C357 V361 W428	H295-P359 HydrophobicContact CB-CB 4.36Å; H295-P359 PolarHBondContact CE1-O 3.46Å; H295-P359 WeakPolarHBondContact ND1-CB 3.14Å; L297-P359 HydrophobicContact CD2-CB 4.43Å; L297-P359 WeakPolarHBondContact CD2-O 3.42Å; F324-P359 HydrophobicContact CB-CB 3.92Å; F324-P359 HydrophobicContact CB-CG 3.64Å; F324-P359 HydrophobicContact CD1-CB 4.23Å; F324-P359 HydrophobicContact CD1-CG 3.75Å; F324-P359 HydrophobicContact CD2-CB 4.45Å; F324-P359 HydrophobicContact CG-CB 3.95Å; F324-P359 HydrophobicContact CG-CG 3.81Å; C357-P359 WeakPolarHBondContact O-CD 3.25Å; P359-V361 VanDerWaalsContact C-N 3.34Å; P359-W428 VanDerWaalsContact CD-CG 3.47Å; P359-W428 HydrophobicContact CG-CB 4.1Å; P359-W428 HydrophobicContact CG-CD2 4.5Å; P359-W428 HydrophobicContact CG-CG 3.83Å
360	A	91.9	Very high	86.4	Confident	68 Å²	68	42.3 Å²	42.3	56%	0.562	23%	0.232	S	C	*	.	G	3₁₀ helix	trans	-72.7	-22.3	175.7	0	0	0	0	0	113.7	D358	D358-A360 PolarHBondContact O-N 3.06Å; D358-A360 VanDerWaalsContact O-N 3.09Å; D358-A360 VanDerWaalsContact OD1-CB 3.26Å; D358-A360 WeakPolarHBondContact OD1-CB 3.3Å; D358-A360 PolarHBondContact OD1-N 3.08Å
361	V	88.9	Confident	85.6	Confident	108 Å²	108	42.3 Å²	42.3	66%	0.655	23%	0.232	S	C	*	.	G	3₁₀ helix	trans	-89.8	-6.7	178.8	-55.2	0	0	0	0	114	D358 P359	D358-V361 HydrophobicContact CB-CG1 4.38Å; D358-V361 HydrophobicContact CB-CG2 4.37Å; D358-V361 WeakPolarHBondContact O-CG2 3.35Å; D358-V361 PolarHBondContact O-N 2.92Å; P359-V361 VanDerWaalsContact C-N 3.34Å
362	L	86.7	Confident	84.8	Confident	15 Å²	15	46.5 Å²	46.5	8%	0.079	25%	0.251	C	S	.	.			trans	-98.7	142.3	-177.9	-69.2	175.2	0	0	0	111.5	L297 D366 L367 W381	L297-L362 HydrophobicContact CD2-CB 3.39Å; L297-L362 HydrophobicContact CD2-CD1 4.31Å; L297-L362 HydrophobicContact CD2-CG 4.49Å; L362-D366 HydrophobicContact CD2-CB 4.33Å; L362-L367 HydrophobicContact CD1-CD2 4.49Å; L362-W381 HydrophobicContact CD1-CH2 3.88Å; L362-W381 HydrophobicContact CD1-CZ2 3.99Å
363	R	85.4	Confident	83.7	Confident	179 Å²	179	48.7 Å²	48.7	68%	0.675	27%	0.269	S	S	*	.			trans	-95.8	156.1	171.5	-59.7	175.9	176.3	-173.2	-2.1	110.6	S365 D366	R363-S365 WeakPolarHBondContact CB-OG 3.45Å; R363-S365 PolarHBondContact O-N 2.75Å; R363-S365 VanDerWaalsContact O-N 3.08Å; R363-D366 WeakPolarHBondContact CB-OD2 3.18Å; R363-D366 PolarHBondContact N-OD2 2.84Å; R363-D366 WeakPolarHBondContact O-CB 3.47Å; R363-D366 PolarHBondContact O-N 2.76Å
364	P	83.3	Confident	82.8	Confident	73 Å²	73	48.6 Å²	48.6	47%	0.474	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-57.3	-25.1	174.8	-24.9	33.3	0	0	0	114.2	L297 D366	L297-P364 HydrophobicContact CD1-CB 4.35Å; L297-P364 HydrophobicContact CD1-CG 3.8Å; P364-D366 VanDerWaalsContact C-N 3.3Å
365	S	81.6	Confident	81.6	Confident	75 Å²	75	52.7 Å²	52.7	52%	0.524	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-66.2	-28.4	172.8	49	0	0	0	0	113.9	R363 L367	R363-S365 WeakPolarHBondContact CB-OG 3.45Å; R363-S365 PolarHBondContact O-N 2.75Å; R363-S365 VanDerWaalsContact O-N 3.08Å; S365-L367 VanDerWaalsContact C-N 3.3Å
366	D	82.7	Confident	80.2	Confident	59 Å²	59	58.8 Å²	58.8	32%	0.316	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-86.7	-10.9	-171.1	-47.1	-18.5	0	0	0	111.2	L362 R363 P364 R377	L362-D366 HydrophobicContact CD2-CB 4.33Å; R363-D366 WeakPolarHBondContact CB-OD2 3.18Å; R363-D366 PolarHBondContact N-OD2 2.84Å; R363-D366 WeakPolarHBondContact O-CB 3.47Å; R363-D366 PolarHBondContact O-N 2.76Å; P364-D366 VanDerWaalsContact C-N 3.3Å; D366-R377 PolarHBondContact O-NH1 2.76Å
367	L	83.1	Confident	79.1	Confident	3 Å²	3	61 Å²	61	2%	0.016	33%	0.33	C	S	.	.	S	Bend	trans	-76.5	122.2	176.1	-61.1	-179.4	0	0	0	109.8	L297 R320 L322 F324 L362 S365	L297-L367 HydrophobicContact CD1-CD1 4.08Å; L297-L367 HydrophobicContact CD2-CD1 4.47Å; L297-L367 HydrophobicContact CD2-CD2 4.3Å; L297-L367 HydrophobicContact CG-CD1 4.16Å; R320-L367 PolarHBondContact NE-O 3.31Å; L322-L367 HydrophobicContact CB-CD1 4.47Å; L322-L367 HydrophobicContact CD1-CB 4.33Å; L322-L367 HydrophobicContact CD1-CD2 4.2Å; F324-L367 HydrophobicContact CE2-CD1 4.26Å; F324-L367 HydrophobicContact CE2-CD2 3.68Å; F324-L367 HydrophobicContact CZ-CD2 3.66Å; L362-L367 HydrophobicContact CD1-CD2 4.49Å; S365-L367 VanDerWaalsContact C-N 3.3Å
368	P	77.2	Confident	77.6	Confident	26 Å²	26	70.1 Å²	70.1	17%	0.169	37%	0.369	C	S	.	.			trans	-69.3	162.9	-179.2	29.9	-34.9	0	0	0	111.5	L322 N370 A373 L374	L322-P368 HydrophobicContact CD1-CG 4.34Å; P368-N370 WeakPolarHBondContact CG-O 3.17Å; P368-A373 HydrophobicContact CB-CB 3.91Å; P368-A373 HydrophobicContact CG-CB 4.41Å; P368-L374 HydrophobicContact CG-CD2 3.55Å; P368-L374 HydrophobicContact CG-CG 3.75Å
369	Y	75.4	Confident	76.8	Confident	127 Å²	127	69.3 Å²	69.3	50%	0.498	36%	0.363	S	S	.	.	S	Bend	trans	-60.2	-47.7	174	-171.9	-68.5	0	0	0	111.4	E318 E319 R320	E318-Y369 VanDerWaalsContact O-CE1 3.22Å; E318-Y369 WeakPolarHBondContact O-CE1 3.47Å; E319-Y369 HydrophobicContact CB-CD2 3.91Å; E319-Y369 HydrophobicContact CB-CE1 4.49Å; E319-Y369 HydrophobicContact CB-CE2 3.62Å; E319-Y369 HydrophobicContact CB-CG 4.49Å; E319-Y369 HydrophobicContact CG-CD2 4.26Å; E319-Y369 HydrophobicContact CG-CE1 4.45Å; E319-Y369 HydrophobicContact CG-CE2 3.46Å; E319-Y369 VanDerWaalsContact CG-CE2 3.46Å; E319-Y369 WeakPolarHBondContact OE2-CE2 3.11Å; R320-Y369 PolarHBondContact N-O 2.83Å
370	N	74.7	Confident	75.8	Confident	59 Å²	59	72.5 Å²	72.5	32%	0.316	38%	0.377	S	S	.	.	S	Bend	trans	-113.4	131.8	-178.6	175.3	-6	0	0	0	109.6	P368 E372 A373	P368-N370 WeakPolarHBondContact CG-O 3.17Å; N370-E372 PolarHBondContact ND2-OE2 3.34Å; N370-E372 PolarHBondContact O-N 3.14Å; N370-E372 WeakPolarHBondContact OD1-CB 3.03Å; N370-E372 PolarHBondContact OD1-N 3.16Å; N370-E372 PolarHBondContact OD1-OE2 3.01Å; N370-A373 PolarHBondContact O-N 2.77Å; N370-A373 VanDerWaalsContact O-N 3.15Å
371	P	73.7	Confident	75.2	Confident	1 Å²	1	70 Å²	70	1%	0.006	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-55	-28.5	176	21.1	-34.6	0	0	0	114.3	L322 A373 L374 V383 H434	L322-P371 HydrophobicContact CD2-CB 4.18Å; P371-A373 PolarHBondContact O-N 2.94Å; P371-L374 HydrophobicContact CB-CD1 4.33Å; P371-L374 WeakPolarHBondContact O-CB 3.3Å; P371-L374 WeakPolarHBondContact O-CD1 3.47Å; P371-L374 VanDerWaalsContact O-CG 3.24Å; P371-L374 WeakPolarHBondContact O-CG 3.46Å; P371-L374 PolarHBondContact O-N 3.08Å; P371-V383 HydrophobicContact CB-CG1 4.25Å; P371-V383 WeakPolarHBondContact O-CG2 3.23Å; P371-H434 WeakPolarHBondContact CD-NE2 3.43Å; P371-H434 WeakPolarHBondContact CG-NE2 3.24Å
372	E	72.6	Confident	74.5	Confident	88 Å²	88	65.3 Å²	65.3	41%	0.411	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-60.5	-32.9	178.3	-68.8	171.1	145.5	0	0	112.8	N370 L374 V375 R385	N370-E372 PolarHBondContact ND2-OE2 3.34Å; N370-E372 PolarHBondContact O-N 3.14Å; N370-E372 WeakPolarHBondContact OD1-CB 3.03Å; N370-E372 PolarHBondContact OD1-N 3.16Å; N370-E372 PolarHBondContact OD1-OE2 3.01Å; E372-L374 PolarHBondContact O-N 3.19Å; E372-L374 VanDerWaalsContact O-N 3.13Å; E372-V375 WeakPolarHBondContact O-CB 3.39Å; E372-V375 WeakPolarHBondContact O-CG2 3.42Å; E372-V375 PolarHBondContact O-N 3.38Å; E372-V375 VanDerWaalsContact O-N 3.11Å; E372-R385 IonicContact OE1-CZ 3.22Å; E372-R385 IonicContact OE1-NH1 2.71Å; E372-R385 PolarHBondContact OE1-NH1 3.13Å; E372-R385 IonicContact OE1-NH2 3.79Å; E372-R385 PolarHBondContact OE1-NH2 3.42Å; E372-R385 IonicContact OE2-NH2 3.77Å; E372-R385 PolarHBondContact OE2-NH2 3.07Å
373	A	69.6	Low	74.2	Confident	46 Å²	46	66.1 Å²	66.1	38%	0.38	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-70	-5.8	177.9	0	0	0	0	0	113.5	P368 N370 P371 V375	P368-A373 HydrophobicContact CB-CB 3.91Å; P368-A373 HydrophobicContact CG-CB 4.41Å; N370-A373 PolarHBondContact O-N 2.77Å; N370-A373 VanDerWaalsContact O-N 3.15Å; P371-A373 PolarHBondContact O-N 2.94Å; A373-V375 VanDerWaalsContact C-N 3.29Å
374	L	70.3	Confident	74.2	Confident	1 Å²	1	58.6 Å²	58.6	1%	0.005	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-67	-31.7	168.8	-64.6	168.2	0	0	0	111.6	L322 P368 P371 E372 D376 R377 W381 V383 F430	L322-L374 HydrophobicContact CD1-CD1 3.99Å; L322-L374 HydrophobicContact CD1-CD2 4.39Å; L322-L374 HydrophobicContact CD2-CD1 4.16Å; P368-L374 HydrophobicContact CG-CD2 3.55Å; P368-L374 HydrophobicContact CG-CG 3.75Å; P371-L374 HydrophobicContact CB-CD1 4.33Å; P371-L374 WeakPolarHBondContact O-CB 3.3Å; P371-L374 WeakPolarHBondContact O-CD1 3.47Å; P371-L374 VanDerWaalsContact O-CG 3.24Å; P371-L374 WeakPolarHBondContact O-CG 3.46Å; P371-L374 PolarHBondContact O-N 3.08Å; E372-L374 PolarHBondContact O-N 3.19Å; E372-L374 VanDerWaalsContact O-N 3.13Å; L374-D376 VanDerWaalsContact C-N 3.25Å; L374-D376 PolarHBondContact O-N 3.06Å; L374-R377 WeakPolarHBondContact O-CB 3.33Å; L374-R377 PolarHBondContact O-N 2.63Å; L374-R377 VanDerWaalsContact O-N 3.08Å; L374-W381 HydrophobicContact CB-CB 3.96Å; L374-W381 HydrophobicContact CB-CD2 3.8Å; L374-W381 HydrophobicContact CB-CE3 3.88Å; L374-W381 HydrophobicContact CB-CG 3.82Å; L374-W381 HydrophobicContact CD1-CD2 4.43Å; L374-W381 HydrophobicContact CD1-CE3 3.68Å; L374-W381 HydrophobicContact CD1-CZ3 3.81Å; L374-W381 HydrophobicContact CD2-CD2 4.03Å; L374-W381 HydrophobicContact CD2-CE3 3.9Å; L374-W381 HydrophobicContact CD2-CH2 3.94Å; L374-W381 HydrophobicContact CD2-CZ2 4.04Å; L374-W381 HydrophobicContact CD2-CZ3 3.84Å; L374-W381 HydrophobicContact CG-CD2 4.3Å; L374-W381 HydrophobicContact CG-CE3 4.03Å; L374-W381 HydrophobicContact CG-CZ3 4.31Å; L374-V383 HydrophobicContact CB-CG2 4.19Å; L374-F430 HydrophobicContact CD1-CD2 4.24Å; L374-F430 HydrophobicContact CD1-CE2 3.8Å; L374-F430 HydrophobicContact CD1-CZ 4.04Å
375	V	66.5	Low	74.3	Confident	85 Å²	85	60.3 Å²	60.3	52%	0.515	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-26.6	-176.3	-174.8	0	0	0	0	112.5	E372 A373 R377 V383	E372-V375 WeakPolarHBondContact O-CB 3.39Å; E372-V375 WeakPolarHBondContact O-CG2 3.42Å; E372-V375 PolarHBondContact O-N 3.38Å; E372-V375 VanDerWaalsContact O-N 3.11Å; A373-V375 VanDerWaalsContact C-N 3.29Å; V375-R377 VanDerWaalsContact C-N 3.32Å; V375-V383 HydrophobicContact CG2-CB 4.08Å; V375-V383 HydrophobicContact CG2-CG2 3.6Å
376	D	60.9	Low	74.6	Confident	128 Å²	128	57 Å²	57	68%	0.684	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-0.2	176.7	-69.1	-48.9	0	0	0	113.4	L374	L374-D376 VanDerWaalsContact C-N 3.25Å; L374-D376 PolarHBondContact O-N 3.06Å
377	R	66.6	Low	74.3	Confident	75 Å²	75	58.1 Å²	58.1	28%	0.283	29%	0.29	S	S	.	.	S	Bend	trans	-77.8	163.9	176.9	-64.2	-175.1	56.3	117.4	3.5	112.1	D366 L374 V375 E379	D366-R377 PolarHBondContact O-NH1 2.76Å; L374-R377 WeakPolarHBondContact O-CB 3.33Å; L374-R377 PolarHBondContact O-N 2.63Å; L374-R377 VanDerWaalsContact O-N 3.08Å; V375-R377 VanDerWaalsContact C-N 3.32Å; R377-E379 VanDerWaalsContact CB-OE2 3.29Å; R377-E379 WeakPolarHBondContact CB-OE2 3.47Å; R377-E379 IonicContact CZ-OE1 3.23Å; R377-E379 IonicContact CZ-OE2 3.68Å; R377-E379 IonicContact NE-OE1 3.43Å; R377-E379 IonicContact NE-OE2 2.75Å; R377-E379 PolarHBondContact NE-OE2 2.88Å; R377-E379 IonicContact NH2-OE1 2.7Å; R377-E379 PolarHBondContact NH2-OE1 2.93Å; R377-E379 IonicContact NH2-OE2 2.67Å; R377-E379 PolarHBondContact NH2-OE2 2.79Å
378	K	55.2	Low	74.3	Confident	198 Å²	198	60.4 Å²	60.4	86%	0.861	30%	0.304	S	S	*	.	S	Bend	trans	-72.7	-24.4	178.7	68.6	178.9	-177.5	178.8	0	114
379	E	73.6	Confident	74.7	Confident	41 Å²	41	64.8 Å²	64.8	19%	0.192	33%	0.333	C	S	.	.	S	Bend	trans	-83.4	164.1	177.3	-42.4	83.8	-174.4	0	0	110	C357 R377 W381	C357-E379 HydrophobicContact CB-CB 3.87Å; C357-E379 HydrophobicContact CB-CG 4.14Å; R377-E379 VanDerWaalsContact CB-OE2 3.29Å; R377-E379 WeakPolarHBondContact CB-OE2 3.47Å; R377-E379 IonicContact CZ-OE1 3.23Å; R377-E379 IonicContact CZ-OE2 3.68Å; R377-E379 IonicContact NE-OE1 3.43Å; R377-E379 IonicContact NE-OE2 2.75Å; R377-E379 PolarHBondContact NE-OE2 2.88Å; R377-E379 IonicContact NH2-OE1 2.7Å; R377-E379 PolarHBondContact NH2-OE1 2.93Å; R377-E379 IonicContact NH2-OE2 2.67Å; R377-E379 PolarHBondContact NH2-OE2 2.79Å; E379-W381 PolarHBondContact O-N 2.71Å; E379-W381 PolarHBondContact OE2-NE1 2.78Å
380	F	72.9	Confident	75.4	Confident	67 Å²	67	59.3 Å²	59.3	29%	0.294	31%	0.312	S	S	.	.			trans	-76.7	123	179.1	176.5	-100.3	0	0	0	110.7	V354 T355 S356 A382 V421 L427	V354-F380 HydrophobicContact CG2-CE1 4.5Å; T355-F380 WeakPolarHBondContact CA-O 3.08Å; T355-F380 WeakPolarHBondContact CB-O 3.41Å; T355-F380 PolarHBondContact OG1-O 3.29Å; S356-F380 PolarHBondContact N-O 3.2Å; F380-A382 HydrophobicContact CE1-CB 4.29Å; F380-A382 HydrophobicContact CZ-CB 4.07Å; F380-V421 HydrophobicContact CE1-CB 3.83Å; F380-V421 HydrophobicContact CE1-CG1 3.89Å; F380-V421 HydrophobicContact CZ-CB 3.77Å; F380-V421 HydrophobicContact CZ-CG1 3.76Å; F380-L427 HydrophobicContact CD1-CD2 4.23Å; F380-L427 HydrophobicContact CE1-CD2 4.3Å
381	W	77.9	Confident	76	Confident	15 Å²	15	60.6 Å²	60.6	6%	0.057	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	119.1	177.7	-62.9	94.9	0	0	0	110.4	F324 T355 C357 L362 L374 E379 F430	F324-W381 AromaticContact CE1-CH2 3.73Å; F324-W381 HydrophobicContact CE1-CH2 3.73Å; F324-W381 AromaticContact CE1-CZ3 3.72Å; F324-W381 HydrophobicContact CE1-CZ3 3.72Å; F324-W381 HydrophobicContact CZ-CH2 4.07Å; F324-W381 HydrophobicContact CZ-CZ3 4.24Å; T355-W381 VanDerWaalsContact CB-CE3 3.46Å; T355-W381 HydrophobicContact CG2-CE3 4.04Å; T355-W381 HydrophobicContact CG2-CH2 3.96Å; T355-W381 HydrophobicContact CG2-CZ3 3.66Å; C357-W381 HydrophobicContact CB-CH2 4.33Å; C357-W381 HydrophobicContact CB-CZ2 3.76Å; L362-W381 HydrophobicContact CD1-CH2 3.88Å; L362-W381 HydrophobicContact CD1-CZ2 3.99Å; L374-W381 HydrophobicContact CB-CB 3.96Å; L374-W381 HydrophobicContact CB-CD2 3.8Å; L374-W381 HydrophobicContact CB-CE3 3.88Å; L374-W381 HydrophobicContact CB-CG 3.82Å; L374-W381 HydrophobicContact CD1-CD2 4.43Å; L374-W381 HydrophobicContact CD1-CE3 3.68Å; L374-W381 HydrophobicContact CD1-CZ3 3.81Å; L374-W381 HydrophobicContact CD2-CD2 4.03Å; L374-W381 HydrophobicContact CD2-CE3 3.9Å; L374-W381 HydrophobicContact CD2-CH2 3.94Å; L374-W381 HydrophobicContact CD2-CZ2 4.04Å; L374-W381 HydrophobicContact CD2-CZ3 3.84Å; L374-W381 HydrophobicContact CG-CD2 4.3Å; L374-W381 HydrophobicContact CG-CE3 4.03Å; L374-W381 HydrophobicContact CG-CZ3 4.31Å; E379-W381 PolarHBondContact O-N 2.71Å; E379-W381 PolarHBondContact OE2-NE1 2.78Å; W381-F430 HydrophobicContact CE3-CD1 4.03Å; W381-F430 AromaticContact CE3-CE1 3.67Å; W381-F430 HydrophobicContact CE3-CE1 3.67Å; W381-F430 HydrophobicContact CE3-CZ 4.18Å; W381-F430 AromaticContact CZ3-CD1 3.93Å; W381-F430 HydrophobicContact CZ3-CD1 3.93Å; W381-F430 HydrophobicContact CZ3-CE1 4.06Å; W381-F430 HydrophobicContact CZ3-CG 4.44Å
382	A	74.7	Confident	76.9	Confident	10 Å²	10	62.3 Å²	62.3	8%	0.083	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	111.2	170.5	0	0	0	0	0	108.9	G353 V354 F380 V419 V421	G353-A382 CarbonylContact C-O 3.56Å; G353-A382 WeakPolarHBondContact CA-O 3.33Å; V354-A382 HydrophobicContact CG2-CB 4.1Å; V354-A382 PolarHBondContact N-O 3.22Å; V354-A382 VanDerWaalsContact N-O 3.1Å; V354-A382 PolarHBondContact O-N 3.42Å; F380-A382 HydrophobicContact CE1-CB 4.29Å; F380-A382 HydrophobicContact CZ-CB 4.07Å; A382-V419 HydrophobicContact CB-CG1 4.24Å; A382-V419 HydrophobicContact CB-CG2 4.05Å; A382-V421 HydrophobicContact CB-CG1 3.49Å; A382-V421 VanDerWaalsContact CB-CG1 3.49Å
383	V	81.1	Confident	77.6	Confident	33 Å²	33	59.6 Å²	59.6	20%	0.2	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	136.1	-177.6	-174.9	0	0	0	0	109.7	P371 L374 V375 F430	P371-V383 HydrophobicContact CB-CG1 4.25Å; P371-V383 WeakPolarHBondContact O-CG2 3.23Å; L374-V383 HydrophobicContact CB-CG2 4.19Å; V375-V383 HydrophobicContact CG2-CB 4.08Å; V375-V383 HydrophobicContact CG2-CG2 3.6Å; V383-F430 HydrophobicContact CB-CZ 4.43Å; V383-F430 HydrophobicContact CG2-CE2 4.28Å; V383-F430 HydrophobicContact CG2-CZ 3.8Å
384	C	84.3	Confident	78.7	Confident	21 Å²	21	57.5 Å²	57.5	14%	0.142	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	165.2	176.9	-71.2	0	0	0	0	110.5	S351 Y352 V419	S351-C384 WeakPolarHBondContact CA-O 3.39Å; Y352-C384 HydrophobicContact CD1-CB 4.27Å; Y352-C384 HydrophobicContact CD2-CB 4.06Å; Y352-C384 HydrophobicContact CE1-CB 3.77Å; Y352-C384 HydrophobicContact CE2-CB 3.51Å; Y352-C384 HydrophobicContact CG-CB 4.39Å; Y352-C384 PolarHBondContact N-O 3.41Å; Y352-C384 PolarHBondContact O-N 2.89Å; Y352-C384 VanDerWaalsContact O-O 3.05Å; Y352-C384 WeakPolarHBondContact OH-CB 3.41Å; C384-V419 VanDerWaalsContact SG-CB 3.59Å; C384-V419 VanDerWaalsContact SG-CG1 3.57Å
385	R	86.6	Confident	79.9	Confident	109 Å²	109	58 Å²	58	41%	0.411	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	150.5	168.1	-70.5	-166.6	178.3	89.9	-7.7	110.1	L350 Y352 E372	L350-R385 WeakPolarHBondContact O-CA 3.46Å; Y352-R385 VanDerWaalsContact CE1-C 3.47Å; E372-R385 IonicContact OE1-CZ 3.22Å; E372-R385 IonicContact OE1-NH1 2.71Å; E372-R385 PolarHBondContact OE1-NH1 3.13Å; E372-R385 IonicContact OE1-NH2 3.79Å; E372-R385 PolarHBondContact OE1-NH2 3.42Å; E372-R385 IonicContact OE2-NH2 3.77Å; E372-R385 PolarHBondContact OE2-NH2 3.07Å
386	V	86.6	Confident	81.3	Confident	4 Å²	4	53.9 Å²	53.9	2%	0.024	28%	0.279	C	S	.	.			trans	-70	125	172.8	-178.6	0	0	0	0	108.1	S349 L350 Y352 T388 L390 L396 L408	S349-V386 PolarHBondContact OG-O 2.88Å; L350-V386 HydrophobicContact CB-CG2 4.04Å; L350-V386 HydrophobicContact CD2-CG2 4.17Å; L350-V386 HydrophobicContact CG-CG2 4.29Å; L350-V386 PolarHBondContact O-N 3.41Å; Y352-V386 HydrophobicContact CD1-CG2 3.76Å; Y352-V386 HydrophobicContact CE1-CG2 3.75Å; V386-T388 VanDerWaalsContact C-N 3.29Å; V386-T388 PolarHBondContact O-N 2.78Å; V386-L390 HydrophobicContact CB-CD1 4.12Å; V386-L390 HydrophobicContact CG1-CD1 4.13Å; V386-L390 HydrophobicContact CG1-CD2 4.08Å; V386-L390 HydrophobicContact CG1-CG 4.13Å; V386-L390 HydrophobicContact CG2-CD1 4.14Å; V386-L396 HydrophobicContact CG2-CD1 3.9Å; V386-L408 HydrophobicContact CG1-CD2 4.32Å
387	P	77.4	Confident	82.9	Confident	83 Å²	83	47.9 Å²	47.9	54%	0.539	25%	0.247	S	C	.	.	S	Bend	trans	-74.3	-21.3	-173.2	29.2	-35.6	0	0	0	113	V415	P387-V415 HydrophobicContact CG-CG1 3.96Å
388	T	82.8	Confident	84.2	Confident	51 Å²	51	44.3 Å²	44.3	31%	0.313	23%	0.234	S	C	.	.	S	Bend	trans	-97.3	143	179.4	44.8	0	0	0	0	111.5	V386 L390 H410	V386-T388 VanDerWaalsContact C-N 3.29Å; V386-T388 PolarHBondContact O-N 2.78Å; T388-L390 PolarHBondContact O-N 2.9Å; T388-H410 PolarHBondContact OG1-CE1 2.83Å; T388-H410 PolarHBondContact OG1-ND1 2.85Å
389	P	85.2	Confident	86	Confident	119 Å²	119	37 Å²	37	77%	0.773	20%	0.204	S	C	*	.	P	Polyproline II helix	trans	-60.9	132.3	167.4	-22.2	33.8	0	0	0	111
390	L	89.6	Confident	86.7	Confident	11 Å²	11	35.4 Å²	35.4	6%	0.058	20%	0.197	C	C	.	.	P	Polyproline II helix	trans	-97.6	130.9	-174	-71.7	168.5	0	0	0	113	V339 S342 L350 V386 T388 D394 L396 V437	V339-L390 HydrophobicContact CG2-CB 4.28Å; V339-L390 HydrophobicContact CG2-CD1 4.11Å; V339-L390 HydrophobicContact CG2-CD2 4.29Å; V339-L390 HydrophobicContact CG2-CG 4.47Å; S342-L390 WeakPolarHBondContact CB-O 3.33Å; S342-L390 PolarHBondContact OG-O 3.27Å; L350-L390 HydrophobicContact CB-CD1 3.52Å; L350-L390 HydrophobicContact CD2-CD1 3.99Å; L350-L390 HydrophobicContact CG-CD1 4.41Å; V386-L390 HydrophobicContact CB-CD1 4.12Å; V386-L390 HydrophobicContact CG1-CD1 4.13Å; V386-L390 HydrophobicContact CG1-CD2 4.08Å; V386-L390 HydrophobicContact CG1-CG 4.13Å; V386-L390 HydrophobicContact CG2-CD1 4.14Å; T388-L390 PolarHBondContact O-N 2.9Å; L390-D394 HydrophobicContact CD2-CB 4.32Å; L390-L396 HydrophobicContact CD1-CD1 4.02Å; L390-L396 HydrophobicContact CD2-CD1 4.02Å; L390-L396 HydrophobicContact CD2-CD2 3.88Å; L390-L396 HydrophobicContact CD2-CG 4.27Å; L390-V437 HydrophobicContact CB-CG2 3.87Å; L390-V437 HydrophobicContact CD1-CG2 3.83Å
391	Q	89.2	Confident	87.2	Confident	86 Å²	86	33.4 Å²	33.4	40%	0.402	19%	0.189	S	C	.	.	P	Polyproline II helix	trans	-98.1	162	175.2	-62.2	-170.3	9.1	0	0	111.7	V339 D394	V339-Q391 WeakPolarHBondContact CB-O 3.33Å; V339-Q391 WeakPolarHBondContact CG1-O 3.14Å; Q391-D394 PolarHBondContact N-OD2 3.26Å; Q391-D394 WeakPolarHBondContact O-CB 3.26Å; Q391-D394 PolarHBondContact O-N 2.8Å
392	S	91	Very high	87.4	Confident	38 Å²	38	39.7 Å²	39.7	27%	0.266	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	140.2	172.5	-62	0	0	0	0	109.2	S342 D394	S342-S392 PolarHBondContact N-OG 2.92Å; S342-S392 PolarHBondContact OG-N 3.21Å; S342-S392 PolarHBondContact OG-OG 2.76Å; S392-D394 VanDerWaalsContact C-N 3.33Å
393	S	88.8	Confident	87.4	Confident	30 Å²	30	44.1 Å²	44.1	21%	0.21	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.3	-3.5	-169.8	-47.6	0	0	0	0	117.1	K338 V339	K338-S393 WeakPolarHBondContact CE-O 3.42Å; V339-S393 WeakPolarHBondContact O-CA 3.09Å; V339-S393 PolarHBondContact O-N 2.76Å
394	D	92.5	Very high	87.1	Confident	2 Å²	2	42.6 Å²	42.6	1%	0.011	23%	0.229	C	C	.	.			trans	-61.8	145.4	172.6	-78.2	-13.2	0	0	0	111.7	N277 K338 V339 L390 Q391 S392 H410 N411	N277-D394 PolarHBondContact ND2-OD1 3.17Å; K338-D394 CarbonylContact C-O 3.59Å; K338-D394 WeakPolarHBondContact CA-O 3.46Å; V339-D394 HydrophobicContact CB-CB 4.42Å; V339-D394 HydrophobicContact CG2-CB 4.43Å; V339-D394 PolarHBondContact N-O 3.18Å; L390-D394 HydrophobicContact CD2-CB 4.32Å; Q391-D394 PolarHBondContact N-OD2 3.26Å; Q391-D394 WeakPolarHBondContact O-CB 3.26Å; Q391-D394 PolarHBondContact O-N 2.8Å; S392-D394 VanDerWaalsContact C-N 3.33Å; D394-H410 VanDerWaalsContact CG-NE2 3.28Å; D394-H410 IonicContact OD1-NE2 3.12Å; D394-H410 IonicContact OD2-CE1 3.35Å; D394-H410 IonicContact OD2-NE2 2.7Å; D394-H410 PolarHBondContact OD2-NE2 2.96Å; D394-N411 WeakPolarHBondContact CA-OD1 3.22Å; D394-N411 PolarHBondContact OD1-ND2 3.2Å
395	I	94.4	Very high	86.9	Confident	11 Å²	11	43 Å²	43	6%	0.056	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	127.4	-179.9	-59.4	174.4	0	0	0	108.5	L284 F336 I337 K338 N411 L443	L284-I395 HydrophobicContact CD1-CD1 4.27Å; L284-I395 HydrophobicContact CD2-CG2 4.18Å; F336-I395 HydrophobicContact CD1-CG2 4.35Å; I337-I395 WeakPolarHBondContact O-CA 3.17Å; K338-I395 HydrophobicContact CD-CG1 4.41Å; K338-I395 HydrophobicContact CG-CG1 4.27Å; I395-N411 PolarHBondContact N-OD1 3.34Å; I395-N411 PolarHBondContact O-N 2.77Å; I395-N411 PolarHBondContact O-OD1 2.71Å; I395-L443 HydrophobicContact CD1-CD1 4.24Å; I395-L443 HydrophobicContact CG1-CD1 4.3Å; I395-L443 HydrophobicContact CG2-CD1 4.09Å
396	L	95.3	Very high	86.8	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	128.3	176.4	-57.3	179.4	0	0	0	109.5	F336 I337 L350 V386 L390 F398 L408 S409 H410	F336-L396 CarbonylContact C-O 3.37Å; F336-L396 WeakPolarHBondContact CA-O 3.17Å; I337-L396 PolarHBondContact N-O 2.69Å; I337-L396 PolarHBondContact O-N 2.92Å; L350-L396 HydrophobicContact CD2-CD1 3.7Å; V386-L396 HydrophobicContact CG2-CD1 3.9Å; L390-L396 HydrophobicContact CD1-CD1 4.02Å; L390-L396 HydrophobicContact CD2-CD1 4.02Å; L390-L396 HydrophobicContact CD2-CD2 3.88Å; L390-L396 HydrophobicContact CD2-CG 4.27Å; L396-F398 HydrophobicContact CB-CD2 4.31Å; L396-F398 HydrophobicContact CB-CE2 3.5Å; L396-F398 VanDerWaalsContact CB-CE2 3.5Å; L396-F398 HydrophobicContact CB-CZ 3.79Å; L396-F398 HydrophobicContact CD1-CE2 4.27Å; L396-F398 HydrophobicContact CD1-CZ 3.86Å; L396-F398 HydrophobicContact CG-CZ 4.49Å; L396-L408 HydrophobicContact CB-CD1 4.25Å; L396-L408 HydrophobicContact CD2-CD1 4.31Å; L396-S409 CarbonylContact C-O 3.52Å; L396-S409 VanDerWaalsContact CA-O 3.28Å; L396-S409 WeakPolarHBondContact CA-O 3.24Å; L396-H410 HydrophobicContact CD2-CB 3.92Å
397	G	94.7	Very high	86.8	Confident	2 Å²	2	39.2 Å²	39.2	2%	0.021	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	132	169.7	0	0	0	0	0	109.9	V335 L408 S409	V335-G397 CarbonylContact O-C 3.52Å; V335-G397 WeakPolarHBondContact O-CA 3.45Å; G397-L408 CarbonylContact O-C 3.48Å; G397-L408 WeakPolarHBondContact O-CA 3.31Å; G397-S409 VanDerWaalsContact CA-OG 3.3Å; G397-S409 WeakPolarHBondContact CA-OG 3.26Å; G397-S409 PolarHBondContact N-O 3.41Å; G397-S409 PolarHBondContact N-OG 3.2Å; G397-S409 PolarHBondContact O-N 3Å; G397-S409 PolarHBondContact O-OG 3.46Å
398	F	94.9	Very high	87.6	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	111.7	178.3	-58.9	-91.9	0	0	0	109.4	T334 V335 I337 Y352 L396 L408 M429 F431	T334-F398 CarbonylContact C-O 3.56Å; T334-F398 WeakPolarHBondContact CA-O 3.49Å; V335-F398 PolarHBondContact N-O 2.9Å; V335-F398 PolarHBondContact O-N 3.07Å; I337-F398 HydrophobicContact CB-CE2 4.07Å; I337-F398 HydrophobicContact CG1-CD2 3.96Å; I337-F398 HydrophobicContact CG1-CE2 3.69Å; Y352-F398 AromaticContact CD1-CE1 3.78Å; Y352-F398 HydrophobicContact CD1-CE1 3.78Å; Y352-F398 HydrophobicContact CD1-CZ 4.37Å; Y352-F398 AromaticContact CD2-CD1 3.75Å; Y352-F398 HydrophobicContact CD2-CD1 3.75Å; Y352-F398 AromaticContact CD2-CE1 3.45Å; Y352-F398 HydrophobicContact CD2-CE1 3.45Å; Y352-F398 VanDerWaalsContact CD2-CE1 3.45Å; Y352-F398 HydrophobicContact CE1-CE1 4.06Å; Y352-F398 AromaticContact CE2-CD1 3.96Å; Y352-F398 HydrophobicContact CE2-CD1 3.96Å; Y352-F398 AromaticContact CE2-CE1 3.78Å; Y352-F398 HydrophobicContact CE2-CE1 3.78Å; Y352-F398 HydrophobicContact CG-CD1 4.22Å; Y352-F398 AromaticContact CG-CE1 3.46Å; Y352-F398 HydrophobicContact CG-CE1 3.46Å; Y352-F398 VanDerWaalsContact CG-CE1 3.46Å; Y352-F398 HydrophobicContact CG-CZ 4.17Å; L396-F398 HydrophobicContact CB-CD2 4.31Å; L396-F398 HydrophobicContact CB-CE2 3.5Å; L396-F398 VanDerWaalsContact CB-CE2 3.5Å; L396-F398 HydrophobicContact CB-CZ 3.79Å; L396-F398 HydrophobicContact CD1-CE2 4.27Å; L396-F398 HydrophobicContact CD1-CZ 3.86Å; L396-F398 HydrophobicContact CG-CZ 4.49Å; F398-L408 HydrophobicContact CD1-CD1 3.88Å; F398-L408 HydrophobicContact CE1-CD1 3.55Å; F398-L408 HydrophobicContact CZ-CD1 3.97Å; F398-M429 HydrophobicContact CB-CE 3.31Å; F398-M429 HydrophobicContact CD1-CE 3.75Å; F398-M429 HydrophobicContact CD2-CE 3.98Å; F398-M429 HydrophobicContact CG-CE 3.43Å; F398-M429 VanDerWaalsContact CG-CE 3.43Å; F398-F431 HydrophobicContact CD2-CE1 4.08Å; F398-F431 HydrophobicContact CD2-CZ 4.4Å; F398-F431 HydrophobicContact CE1-CE1 4.46Å; F398-F431 AromaticContact CE2-CE1 3.66Å; F398-F431 HydrophobicContact CE2-CE1 3.66Å; F398-F431 HydrophobicContact CE2-CZ 4.34Å; F398-F431 AromaticContact CZ-CE1 3.87Å; F398-F431 HydrophobicContact CZ-CE1 3.87Å
399	L	92.2	Very high	88	Confident	43 Å²	43	34 Å²	34	23%	0.225	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	135.7	179.6	167.7	63.1	0	0	0	109.6	G332 E333 T334 V406 I407	G332-L399 WeakPolarHBondContact O-CD1 3.24Å; E333-L399 WeakPolarHBondContact O-CD1 3.42Å; T334-L399 HydrophobicContact CG2-CB 4.49Å; L399-V406 CarbonylContact O-C 3.43Å; L399-V406 WeakPolarHBondContact O-CA 3.19Å; L399-I407 HydrophobicContact CB-CB 4.35Å; L399-I407 HydrophobicContact CD2-CD1 4.28Å; L399-I407 PolarHBondContact N-O 2.87Å; L399-I407 PolarHBondContact O-N 2.83Å
400	V	88.4	Confident	88.3	Confident	8 Å²	8	29.7 Å²	29.7	5%	0.048	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	110.3	165.4	-172.7	0	0	0	0	108.7	L329 G332 V354 V406 V421 L427	L329-V400 HydrophobicContact CD1-CB 4.14Å; L329-V400 HydrophobicContact CD1-CG2 3.47Å; L329-V400 VanDerWaalsContact CD1-CG2 3.47Å; G332-V400 PolarHBondContact N-O 2.9Å; V354-V400 HydrophobicContact CG1-CG2 4.27Å; V400-V406 HydrophobicContact CG2-CG1 4.46Å; V400-V406 HydrophobicContact CG2-CG2 4.11Å; V400-V421 HydrophobicContact CG1-CG2 4.15Å; V400-L427 HydrophobicContact CG1-CD1 4.43Å
401	N	84.1	Confident	88.4	Confident	25 Å²	25	30.3 Å²	30.3	13%	0.134	16%	0.156	C	C	.	.			trans	-81.5	177.5	-177.8	73.1	6.2	0	0	0	113	E403 G404 E405 N423	N401-E403 PolarHBondContact ND2-OE2 2.98Å; N401-E403 PolarHBondContact O-N 2.96Å; N401-E403 WeakPolarHBondContact OD1-CB 3.42Å; N401-E403 PolarHBondContact OD1-N 2.99Å; N401-E403 PolarHBondContact OD1-OE2 3.4Å; N401-G404 PolarHBondContact O-N 3.02Å; N401-G404 VanDerWaalsContact O-N 3.16Å; N401-G404 PolarHBondContact OD1-N 2.92Å; N401-E405 PolarHBondContact N-O 2.98Å; N401-E405 VanDerWaalsContact N-O 3.12Å; N401-E405 PolarHBondContact ND2-OE2 3.01Å; N401-E405 WeakPolarHBondContact OD1-CA 3.28Å; N401-E405 VanDerWaalsContact OD1-CB 3.27Å; N401-E405 WeakPolarHBondContact OD1-CB 3.39Å; N401-E405 PolarHBondContact OD1-N 2.94Å; N401-E405 PolarHBondContact OD1-O 3.11Å; N401-N423 PolarHBondContact O-ND2 2.67Å
402	Q	80.9	Confident	88.1	Confident	148 Å²	148	29.2 Å²	29.2	69%	0.692	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-23.9	-178.3	-168.3	171.1	36.2	0	0	112.5	T331 G404 N423	T331-Q402 HydrophobicContact CG2-CB 3.92Å; T331-Q402 HydrophobicContact CG2-CG 4.19Å; Q402-G404 PolarHBondContact O-N 2.85Å; Q402-N423 PolarHBondContact O-ND2 3.19Å
403	E	75.9	Confident	87.8	Confident	103 Å²	103	32 Å²	32	48%	0.481	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	1.4	176.4	-61.7	68.8	-155.8	0	0	113.5	N401 E405	N401-E403 PolarHBondContact ND2-OE2 2.98Å; N401-E403 PolarHBondContact O-N 2.96Å; N401-E403 WeakPolarHBondContact OD1-CB 3.42Å; N401-E403 PolarHBondContact OD1-N 2.99Å; N401-E403 PolarHBondContact OD1-OE2 3.4Å; E403-E405 VanDerWaalsContact C-N 3.34Å; E403-E405 HydrophobicContact CB-CG 4.03Å
404	G	73.8	Confident	87.6	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.202	C	C	.	.			trans	74.4	20.4	-177.9	0	0	0	0	0	113.5	N401 Q402 C420 V421 N423	N401-G404 PolarHBondContact O-N 3.02Å; N401-G404 VanDerWaalsContact O-N 3.16Å; N401-G404 PolarHBondContact OD1-N 2.92Å; Q402-G404 PolarHBondContact O-N 2.85Å; G404-C420 CarbonylContact O-C 3.56Å; G404-C420 VanDerWaalsContact O-CA 3.23Å; G404-C420 WeakPolarHBondContact O-CA 3.27Å; G404-V421 VanDerWaalsContact O-CG2 3.24Å; G404-V421 WeakPolarHBondContact O-CG2 3.45Å; G404-V421 PolarHBondContact O-N 2.91Å; G404-N423 PolarHBondContact N-ND2 2.87Å
405	E	81.1	Confident	87	Confident	30 Å²	30	38.5 Å²	38.5	14%	0.14	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	121.2	178.3	-51.7	177.8	151.9	0	0	109.7	R197 N401 E403 M417	R197-E405 IonicContact CZ-OE1 3.52Å; R197-E405 IonicContact NH1-OE1 3.47Å; R197-E405 PolarHBondContact NH1-OE1 3.12Å; N401-E405 PolarHBondContact N-O 2.98Å; N401-E405 VanDerWaalsContact N-O 3.12Å; N401-E405 PolarHBondContact ND2-OE2 3.01Å; N401-E405 WeakPolarHBondContact OD1-CA 3.28Å; N401-E405 VanDerWaalsContact OD1-CB 3.27Å; N401-E405 WeakPolarHBondContact OD1-CB 3.39Å; N401-E405 PolarHBondContact OD1-N 2.94Å; N401-E405 PolarHBondContact OD1-O 3.11Å; E403-E405 VanDerWaalsContact C-N 3.34Å; E403-E405 HydrophobicContact CB-CG 4.03Å; E405-M417 HydrophobicContact CB-CG 4.04Å; E405-M417 HydrophobicContact CB-SD 4.19Å; E405-M417 HydrophobicContact CG-SD 4.07Å
406	V	84.7	Confident	86.2	Confident	2 Å²	2	39 Å²	39	1%	0.012	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	113.6	173.1	-173.2	0	0	0	0	108	V354 L399 V400 Q418 V419 V421	V354-V406 HydrophobicContact CG2-CG2 4.31Å; L399-V406 CarbonylContact O-C 3.43Å; L399-V406 WeakPolarHBondContact O-CA 3.19Å; V400-V406 HydrophobicContact CG2-CG1 4.46Å; V400-V406 HydrophobicContact CG2-CG2 4.11Å; V406-Q418 PolarHBondContact O-N 3.21Å; V406-V419 HydrophobicContact CB-CG1 3.72Å; V406-V419 HydrophobicContact CG1-CG1 4.38Å; V406-V419 HydrophobicContact CG2-CG1 3.57Å; V406-V419 PolarHBondContact N-O 3.08Å; V406-V421 HydrophobicContact CG2-CG1 3.99Å; V406-V421 HydrophobicContact CG2-CG2 3.87Å
407	I	87.1	Confident	85.4	Confident	32 Å²	32	41.5 Å²	41.5	16%	0.164	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	132.1	-177.4	-61	169.6	0	0	0	108.7	L399 M417	L399-I407 HydrophobicContact CB-CB 4.35Å; L399-I407 HydrophobicContact CD2-CD1 4.28Å; L399-I407 PolarHBondContact N-O 2.87Å; L399-I407 PolarHBondContact O-N 2.83Å; I407-M417 HydrophobicContact CG1-CB 4.4Å
408	L	92.2	Very high	84.8	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	137.6	175.4	174.4	65.2	0	0	0	110.1	V386 L396 G397 F398 V415 G416 Q418	V386-L408 HydrophobicContact CG1-CD2 4.32Å; L396-L408 HydrophobicContact CB-CD1 4.25Å; L396-L408 HydrophobicContact CD2-CD1 4.31Å; G397-L408 CarbonylContact O-C 3.48Å; G397-L408 WeakPolarHBondContact O-CA 3.31Å; F398-L408 HydrophobicContact CD1-CD1 3.88Å; F398-L408 HydrophobicContact CE1-CD1 3.55Å; F398-L408 HydrophobicContact CZ-CD1 3.97Å; L408-V415 HydrophobicContact CB-CB 4.25Å; L408-V415 HydrophobicContact CD2-CB 4.19Å; L408-V415 HydrophobicContact CD2-CG1 4.14Å; L408-V415 HydrophobicContact CD2-CG2 4.34Å; L408-V415 HydrophobicContact CG-CB 4.05Å; L408-V415 HydrophobicContact CG-CG2 4.12Å; L408-V415 WeakPolarHBondContact O-CA 3.37Å; L408-V415 WeakPolarHBondContact O-CB 3.42Å; L408-V415 PolarHBondContact O-N 2.78Å; L408-G416 PolarHBondContact N-O 3.33Å; L408-G416 VanDerWaalsContact N-O 3.1Å; L408-G416 PolarHBondContact O-N 2.86Å; L408-Q418 HydrophobicContact CB-CG 3.51Å; L408-Q418 HydrophobicContact CD2-CG 4.5Å
409	S	91.7	Very high	83.8	Confident	23 Å²	23	44.2 Å²	44.2	16%	0.161	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	147.4	159.5	67.6	0	0	0	0	110.7	L396 G397 T413	L396-S409 CarbonylContact C-O 3.52Å; L396-S409 VanDerWaalsContact CA-O 3.28Å; L396-S409 WeakPolarHBondContact CA-O 3.24Å; G397-S409 VanDerWaalsContact CA-OG 3.3Å; G397-S409 WeakPolarHBondContact CA-OG 3.26Å; G397-S409 PolarHBondContact N-O 3.41Å; G397-S409 PolarHBondContact N-OG 3.2Å; G397-S409 PolarHBondContact O-N 3Å; G397-S409 PolarHBondContact O-OG 3.46Å; S409-T413 CarbonylContact C-O 3.47Å; S409-T413 WeakPolarHBondContact CA-O 3.35Å; S409-T413 VanDerWaalsContact CB-O 3.29Å; S409-T413 WeakPolarHBondContact CB-O 3.37Å
410	H	93.1	Very high	82.7	Confident	30 Å²	30	42.5 Å²	42.5	14%	0.139	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	119.7	177	-176.9	-171.5	0	0	0	107.3	T388 D394 L396 G412 T413 V415	T388-H410 PolarHBondContact OG1-CE1 2.83Å; T388-H410 PolarHBondContact OG1-ND1 2.85Å; D394-H410 VanDerWaalsContact CG-NE2 3.28Å; D394-H410 IonicContact OD1-NE2 3.12Å; D394-H410 IonicContact OD2-CE1 3.35Å; D394-H410 IonicContact OD2-NE2 2.7Å; D394-H410 PolarHBondContact OD2-NE2 2.96Å; L396-H410 HydrophobicContact CD2-CB 3.92Å; H410-G412 VanDerWaalsContact C-N 3.27Å; H410-G412 PolarHBondContact O-N 2.81Å; H410-T413 PolarHBondContact N-O 3.17Å; H410-T413 WeakPolarHBondContact O-CB 3.27Å; H410-T413 PolarHBondContact O-N 3.39Å; H410-V415 HydrophobicContact CB-CG2 3.59Å
411	N	90.4	Very high	82.1	Confident	23 Å²	23	42.8 Å²	42.8	12%	0.123	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.3	44.9	-178.9	-63.3	-8.1	0	0	0	112.5	N277 D394 I395 T413	N277-N411 PolarHBondContact OD1-ND2 3.37Å; D394-N411 WeakPolarHBondContact CA-OD1 3.22Å; D394-N411 PolarHBondContact OD1-ND2 3.2Å; I395-N411 PolarHBondContact N-OD1 3.34Å; I395-N411 PolarHBondContact O-N 2.77Å; I395-N411 PolarHBondContact O-OD1 2.71Å; N411-T413 PolarHBondContact O-N 2.89Å
412	G	83.3	Confident	81.6	Confident	63 Å²	63	45.5 Å²	45.5	65%	0.649	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.3	-12.9	-177.2	0	0	0	0	0	115.4	H410	H410-G412 VanDerWaalsContact C-N 3.27Å; H410-G412 PolarHBondContact O-N 2.81Å
413	T	84.6	Confident	81.5	Confident	98 Å²	98	41.4 Å²	41.4	60%	0.601	24%	0.242	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-85.6	129.7	179.3	-55	0	0	0	0	110.1	S409 H410 N411 V415	S409-T413 CarbonylContact C-O 3.47Å; S409-T413 WeakPolarHBondContact CA-O 3.35Å; S409-T413 VanDerWaalsContact CB-O 3.29Å; S409-T413 WeakPolarHBondContact CB-O 3.37Å; H410-T413 PolarHBondContact N-O 3.17Å; H410-T413 WeakPolarHBondContact O-CB 3.27Å; H410-T413 PolarHBondContact O-N 3.39Å; N411-T413 PolarHBondContact O-N 2.89Å; T413-V415 PolarHBondContact O-N 2.94Å
414	N	84.3	Confident	81.5	Confident	110 Å²	110	40.7 Å²	40.7	59%	0.588	25%	0.249	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-70.8	115.9	176.4	-166.8	-37.7	0	0	0	109.9	G416	N414-G416 VanDerWaalsContact C-N 3.33Å; N414-G416 VanDerWaalsContact OD1-CA 3.23Å; N414-G416 WeakPolarHBondContact OD1-CA 3.44Å; N414-G416 PolarHBondContact OD1-N 3Å
415	V	80.3	Confident	81.9	Confident	57 Å²	57	48.6 Å²	48.6	35%	0.345	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	-15.8	177.7	-174.9	0	0	0	0	110.9	P387 L408 H410 T413	P387-V415 HydrophobicContact CG-CG1 3.96Å; L408-V415 HydrophobicContact CB-CB 4.25Å; L408-V415 HydrophobicContact CD2-CB 4.19Å; L408-V415 HydrophobicContact CD2-CG1 4.14Å; L408-V415 HydrophobicContact CD2-CG2 4.34Å; L408-V415 HydrophobicContact CG-CB 4.05Å; L408-V415 HydrophobicContact CG-CG2 4.12Å; L408-V415 WeakPolarHBondContact O-CA 3.37Å; L408-V415 WeakPolarHBondContact O-CB 3.42Å; L408-V415 PolarHBondContact O-N 2.78Å; H410-V415 HydrophobicContact CB-CG2 3.59Å; T413-V415 PolarHBondContact O-N 2.94Å
416	G	77.4	Confident	82.2	Confident	23 Å²	23	50.9 Å²	50.9	24%	0.237	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	106.5	176.4	176.7	0	0	0	0	0	113.6	L408 N414 Q418	L408-G416 PolarHBondContact N-O 3.33Å; L408-G416 VanDerWaalsContact N-O 3.1Å; L408-G416 PolarHBondContact O-N 2.86Å; N414-G416 VanDerWaalsContact C-N 3.33Å; N414-G416 VanDerWaalsContact OD1-CA 3.23Å; N414-G416 WeakPolarHBondContact OD1-CA 3.44Å; N414-G416 PolarHBondContact OD1-N 3Å; G416-Q418 PolarHBondContact O-NE2 3.29Å
417	M	79.3	Confident	82.5	Confident	52 Å²	52	51.1 Å²	51.1	26%	0.256	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	132.2	171.2	179.1	-163.8	79.2	0	0	110.8	Q100 C101 E405 I407 C420	Q100-M417 HydrophobicContact CG-CE 4.49Å; C101-M417 HydrophobicContact CB-CE 4.37Å; E405-M417 HydrophobicContact CB-CG 4.04Å; E405-M417 HydrophobicContact CB-SD 4.19Å; E405-M417 HydrophobicContact CG-SD 4.07Å; I407-M417 HydrophobicContact CG1-CB 4.4Å; M417-C420 PolarHBondContact SD-SG 3.13Å
418	Q	81.4	Confident	82.9	Confident	43 Å²	43	50.9 Å²	50.9	20%	0.201	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	-52.9	-174.1	-53.4	-68.7	-56.4	0	0	111.2	C102 Y352 V406 L408 G416	C102-Q418 WeakPolarHBondContact CB-O 3.4Å; Y352-Q418 WeakPolarHBondContact OH-CB 3.43Å; Y352-Q418 WeakPolarHBondContact OH-CG 3.48Å; Y352-Q418 PolarHBondContact OH-OE1 2.89Å; Y352-Q418 VanDerWaalsContact OH-OE1 3.08Å; V406-Q418 PolarHBondContact O-N 3.21Å; L408-Q418 HydrophobicContact CB-CG 3.51Å; L408-Q418 HydrophobicContact CD2-CG 4.5Å; G416-Q418 PolarHBondContact O-NE2 3.29Å
419	V	73.6	Confident	83.1	Confident	16 Å²	16	50.9 Å²	50.9	10%	0.097	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	156.6	177.6	66.8	0	0	0	0	111.6	C102 A382 C384 V406 V421	C102-V419 VanDerWaalsContact CB-CA 3.49Å; C102-V419 HydrophobicContact CB-CB 4.29Å; C102-V419 HydrophobicContact CB-CG2 4.2Å; A382-V419 HydrophobicContact CB-CG1 4.24Å; A382-V419 HydrophobicContact CB-CG2 4.05Å; C384-V419 VanDerWaalsContact SG-CB 3.59Å; C384-V419 VanDerWaalsContact SG-CG1 3.57Å; V406-V419 HydrophobicContact CB-CG1 3.72Å; V406-V419 HydrophobicContact CG1-CG1 4.38Å; V406-V419 HydrophobicContact CG2-CG1 3.57Å; V406-V419 PolarHBondContact N-O 3.08Å; V419-V421 HydrophobicContact CG1-CG1 4.13Å; V419-V421 HydrophobicContact CG2-CG1 4.48Å
420	C	70.3	Confident	83.2	Confident	7 Å²	7	49.8 Å²	49.8	5%	0.047	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	135.6	168.6	-64.6	0	0	0	0	109.7	Q100 C102 G404 M417	Q100-C420 PolarHBondContact NE2-SG 2.97Å; C102-C420 VanDerWaalsContact SG-CB 3.56Å; C102-C420 PolarHBondContact SG-N 2.87Å; C102-C420 PolarHBondContact SG-SG 2.87Å; G404-C420 CarbonylContact O-C 3.56Å; G404-C420 VanDerWaalsContact O-CA 3.23Å; G404-C420 WeakPolarHBondContact O-CA 3.27Å; M417-C420 PolarHBondContact SD-SG 3.13Å
421	V	75.3	Confident	83.2	Confident	13 Å²	13	48.4 Å²	48.4	8%	0.079	28%	0.28	C	S	.	.			trans	-128.9	154.4	-169.4	-67.8	0	0	0	0	110.3	V354 F380 A382 V400 G404 V406 V419 N423 L427	V354-V421 HydrophobicContact CG2-CB 3.87Å; V354-V421 HydrophobicContact CG2-CG1 3.2Å; V354-V421 HydrophobicContact CG2-CG2 4.01Å; F380-V421 HydrophobicContact CE1-CB 3.83Å; F380-V421 HydrophobicContact CE1-CG1 3.89Å; F380-V421 HydrophobicContact CZ-CB 3.77Å; F380-V421 HydrophobicContact CZ-CG1 3.76Å; A382-V421 HydrophobicContact CB-CG1 3.49Å; A382-V421 VanDerWaalsContact CB-CG1 3.49Å; V400-V421 HydrophobicContact CG1-CG2 4.15Å; G404-V421 VanDerWaalsContact O-CG2 3.24Å; G404-V421 WeakPolarHBondContact O-CG2 3.45Å; G404-V421 PolarHBondContact O-N 2.91Å; V406-V421 HydrophobicContact CG2-CG1 3.99Å; V406-V421 HydrophobicContact CG2-CG2 3.87Å; V419-V421 HydrophobicContact CG1-CG1 4.13Å; V419-V421 HydrophobicContact CG2-CG1 4.48Å; V421-N423 PolarHBondContact O-N 2.84Å; V421-L427 HydrophobicContact CB-CD1 4.27Å; V421-L427 HydrophobicContact CG2-CD1 3.66Å
422	D	73.5	Confident	83.3	Confident	83 Å²	83	47.3 Å²	47.3	44%	0.444	28%	0.275	S	S	.	.			trans	-80.2	108.5	171.3	-173.3	-11.5	0	0	0	108.7	S424	D422-S424 VanDerWaalsContact CG-OG 3.29Å; D422-S424 WeakPolarHBondContact OD1-CB 3.38Å; D422-S424 PolarHBondContact OD1-N 3.37Å; D422-S424 PolarHBondContact OD1-OG 2.79Å; D422-S424 PolarHBondContact OD2-OG 2.99Å
423	N	78.7	Confident	83.5	Confident	61 Å²	61	44.4 Å²	44.4	33%	0.326	24%	0.244	S	C	.	.			trans	-95.8	14.3	178.2	67.1	-10.3	0	0	0	113.1	N401 Q402 G404 V421 R425 L427	N401-N423 PolarHBondContact O-ND2 2.67Å; Q402-N423 PolarHBondContact O-ND2 3.19Å; G404-N423 PolarHBondContact N-ND2 2.87Å; V421-N423 PolarHBondContact O-N 2.84Å; N423-R425 PolarHBondContact O-N 3.44Å; N423-R425 VanDerWaalsContact O-N 3.17Å; N423-L427 HydrophobicContact CB-CD1 4.12Å
424	S	75.8	Confident	83.2	Confident	88 Å²	88	40.9 Å²	40.9	62%	0.615	22%	0.221	S	C	*	.	S	Bend	trans	-66.5	-8.4	171.2	65.8	0	0	0	0	113.9	D422	D422-S424 VanDerWaalsContact CG-OG 3.29Å; D422-S424 WeakPolarHBondContact OD1-CB 3.38Å; D422-S424 PolarHBondContact OD1-N 3.37Å; D422-S424 PolarHBondContact OD1-OG 2.79Å; D422-S424 PolarHBondContact OD2-OG 2.99Å
425	R	81.8	Confident	82.8	Confident	166 Å²	166	35.8 Å²	35.8	63%	0.626	19%	0.194	S	C	*	.	S	Bend	trans	-127.9	156.6	175.2	-64.1	-177.3	179.9	-179.3	-1.1	109.8	N423 L427	N423-R425 PolarHBondContact O-N 3.44Å; N423-R425 VanDerWaalsContact O-N 3.17Å; R425-L427 PolarHBondContact O-N 3.18Å
426	P	87.5	Confident	83	Confident	78 Å²	78	33.8 Å²	33.8	51%	0.506	18%	0.184	S	C	.	.			trans	-54	137	170.1	-23.4	33.8	0	0	0	111.1	P328 W428	P328-P426 HydrophobicContact CB-CB 3.71Å; P328-P426 HydrophobicContact CG-CB 4.07Å; P426-W428 HydrophobicContact CB-CH2 4.04Å; P426-W428 HydrophobicContact CB-CZ3 3.85Å; P426-W428 WeakPolarHBondContact O-CZ3 3.4Å
427	L	92.1	Very high	83.6	Confident	8 Å²	8	32.8 Å²	32.8	4%	0.042	17%	0.173	C	C	.	.			trans	-118.4	128.6	-178.5	-67.7	177.4	0	0	0	110.4	P328 L329 V354 T355 F380 V400 V421 N423 R425	P328-L427 CarbonylContact C-O 3.46Å; P328-L427 VanDerWaalsContact CA-O 3.26Å; P328-L427 WeakPolarHBondContact CA-O 3.34Å; L329-L427 PolarHBondContact N-O 3.11Å; V354-L427 HydrophobicContact CB-CB 4.44Å; V354-L427 HydrophobicContact CG2-CD1 4.37Å; T355-L427 CarbonylContact O-C 3.58Å; T355-L427 WeakPolarHBondContact O-CA 3.3Å; F380-L427 HydrophobicContact CD1-CD2 4.23Å; F380-L427 HydrophobicContact CE1-CD2 4.3Å; V400-L427 HydrophobicContact CG1-CD1 4.43Å; V421-L427 HydrophobicContact CB-CD1 4.27Å; V421-L427 HydrophobicContact CG2-CD1 3.66Å; N423-L427 HydrophobicContact CB-CD1 4.12Å; R425-L427 PolarHBondContact O-N 3.18Å
428	W	94.9	Very high	84	Confident	26 Å²	26	31.6 Å²	31.6	10%	0.098	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	142.1	170.3	-70.7	-106.3	0	0	0	109.7	R327 P328 V354 T355 D358 P359 P426	R327-W428 VanDerWaalsContact C-CD1 3.42Å; P328-W428 HydrophobicContact CB-CD2 4.02Å; P328-W428 HydrophobicContact CB-CE3 4.27Å; P328-W428 HydrophobicContact CB-CH2 4.41Å; P328-W428 HydrophobicContact CB-CZ2 4.18Å; P328-W428 HydrophobicContact CB-CZ3 4.45Å; P328-W428 HydrophobicContact CG-CZ2 4.1Å; V354-W428 CarbonylContact C-O 3.6Å; V354-W428 VanDerWaalsContact CA-O 3.25Å; V354-W428 WeakPolarHBondContact CA-O 3.4Å; T355-W428 HydrophobicContact CG2-CB 4.28Å; T355-W428 PolarHBondContact N-O 2.78Å; T355-W428 PolarHBondContact O-N 3.2Å; D358-W428 HydrophobicContact CB-CH2 3.87Å; D358-W428 HydrophobicContact CB-CZ2 4.01Å; D358-W428 HydrophobicContact CB-CZ3 4.35Å; P359-W428 VanDerWaalsContact CD-CG 3.47Å; P359-W428 HydrophobicContact CG-CB 4.1Å; P359-W428 HydrophobicContact CG-CD2 4.5Å; P359-W428 HydrophobicContact CG-CG 3.83Å; P426-W428 HydrophobicContact CB-CH2 4.04Å; P426-W428 HydrophobicContact CB-CZ3 3.85Å; P426-W428 WeakPolarHBondContact O-CZ3 3.4Å
429	M	95	Very high	84.5	Confident	1 Å²	1	30.4 Å²	30.4	1%	0.005	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	145.6	170	-79.4	-81.2	-78.8	0	0	110.2	F324 T325 L329 G353 V354 F398 F431	F324-M429 CarbonylContact C-O 3.56Å; F324-M429 VanDerWaalsContact CA-O 3.27Å; F324-M429 WeakPolarHBondContact CA-O 3.07Å; T325-M429 HydrophobicContact CG2-CB 3.81Å; T325-M429 PolarHBondContact N-O 3.46Å; T325-M429 PolarHBondContact OG1-N 3.34Å; L329-M429 HydrophobicContact CD1-CG 3.59Å; L329-M429 HydrophobicContact CD1-SD 4.36Å; L329-M429 HydrophobicContact CD2-CB 4.48Å; L329-M429 HydrophobicContact CD2-CG 3.82Å; L329-M429 HydrophobicContact CG-CG 3.95Å; G353-M429 CarbonylContact O-C 3.5Å; G353-M429 WeakPolarHBondContact O-CA 3.32Å; G353-M429 VanDerWaalsContact O-SD 3.39Å; V354-M429 HydrophobicContact CG1-CG 4.02Å; V354-M429 HydrophobicContact CG1-SD 3.35Å; V354-M429 WeakPolarHBondContact CG1-SD 3.46Å; F398-M429 HydrophobicContact CB-CE 3.31Å; F398-M429 HydrophobicContact CD1-CE 3.75Å; F398-M429 HydrophobicContact CD2-CE 3.98Å; F398-M429 HydrophobicContact CG-CE 3.43Å; F398-M429 VanDerWaalsContact CG-CE 3.43Å; M429-F431 HydrophobicContact CB-CE2 4.17Å; M429-F431 HydrophobicContact CB-CZ 4.24Å; M429-F431 HydrophobicContact CE-CE1 3.86Å; M429-F431 HydrophobicContact CE-CZ 3.64Å
430	F	94.8	Very high	85.5	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	156.2	169.6	69	-93.6	0	0	0	111.8	L322 V323 F324 Y352 G353 T355 L374 W381 V383	L322-F430 HydrophobicContact CD2-CD2 3.85Å; L322-F430 HydrophobicContact CD2-CE2 4.45Å; V323-F430 CarbonylContact O-C 3.54Å; V323-F430 WeakPolarHBondContact O-CA 3.49Å; V323-F430 WeakPolarHBondContact O-CB 3.44Å; F324-F430 HydrophobicContact CD1-CB 3.6Å; F324-F430 HydrophobicContact CE1-CB 3.71Å; F324-F430 HydrophobicContact CE1-CG 4.36Å; F324-F430 HydrophobicContact CG-CB 4.26Å; F324-F430 HydrophobicContact CZ-CB 4.44Å; Y352-F430 CarbonylContact C-O 3.6Å; Y352-F430 VanDerWaalsContact CA-O 3.24Å; Y352-F430 WeakPolarHBondContact CA-O 3.47Å; G353-F430 PolarHBondContact N-O 2.85Å; G353-F430 WeakPolarHBondContact O-CD1 3.22Å; G353-F430 PolarHBondContact O-N 3.12Å; T355-F430 HydrophobicContact CG2-CD1 4.24Å; L374-F430 HydrophobicContact CD1-CD2 4.24Å; L374-F430 HydrophobicContact CD1-CE2 3.8Å; L374-F430 HydrophobicContact CD1-CZ 4.04Å; W381-F430 HydrophobicContact CE3-CD1 4.03Å; W381-F430 AromaticContact CE3-CE1 3.67Å; W381-F430 HydrophobicContact CE3-CE1 3.67Å; W381-F430 HydrophobicContact CE3-CZ 4.18Å; W381-F430 AromaticContact CZ3-CD1 3.93Å; W381-F430 HydrophobicContact CZ3-CD1 3.93Å; W381-F430 HydrophobicContact CZ3-CE1 4.06Å; W381-F430 HydrophobicContact CZ3-CG 4.44Å; V383-F430 HydrophobicContact CB-CZ 4.43Å; V383-F430 HydrophobicContact CG2-CE2 4.28Å; V383-F430 HydrophobicContact CG2-CZ 3.8Å
431	F	93.8	Very high	86.6	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	133.7	-179.9	-52.1	-86.1	0	0	0	109.8	F294 L322 V323 I337 L350 S351 F398 M429 L440	F294-F431 AromaticContact CE1-CD2 3.88Å; F294-F431 HydrophobicContact CE1-CD2 3.88Å; F294-F431 HydrophobicContact CE1-CE2 4.26Å; L322-F431 CarbonylContact C-O 3.54Å; L322-F431 WeakPolarHBondContact CA-O 3.07Å; V323-F431 HydrophobicContact CG2-CB 3.9Å; V323-F431 HydrophobicContact CG2-CD2 4.3Å; V323-F431 PolarHBondContact N-O 2.9Å; V323-F431 PolarHBondContact O-N 2.75Å; I337-F431 HydrophobicContact CD1-CE1 4.35Å; I337-F431 HydrophobicContact CD1-CE2 3.92Å; I337-F431 HydrophobicContact CD1-CZ 3.68Å; I337-F431 HydrophobicContact CG1-CE1 3.84Å; I337-F431 HydrophobicContact CG1-CE2 4.32Å; I337-F431 HydrophobicContact CG1-CZ 3.6Å; L350-F431 HydrophobicContact CD1-CB 4.43Å; S351-F431 CarbonylContact O-C 3.59Å; S351-F431 WeakPolarHBondContact O-CA 3.49Å; F398-F431 HydrophobicContact CD2-CE1 4.08Å; F398-F431 HydrophobicContact CD2-CZ 4.4Å; F398-F431 HydrophobicContact CE1-CE1 4.46Å; F398-F431 AromaticContact CE2-CE1 3.66Å; F398-F431 HydrophobicContact CE2-CE1 3.66Å; F398-F431 HydrophobicContact CE2-CZ 4.34Å; F398-F431 AromaticContact CZ-CE1 3.87Å; F398-F431 HydrophobicContact CZ-CE1 3.87Å; M429-F431 HydrophobicContact CB-CE2 4.17Å; M429-F431 HydrophobicContact CB-CZ 4.24Å; M429-F431 HydrophobicContact CE-CE1 3.86Å; M429-F431 HydrophobicContact CE-CZ 3.64Å; F431-L440 HydrophobicContact CB-CD1 3.89Å; F431-L440 HydrophobicContact CG-CD1 4.26Å
432	G	90.9	Very high	87.5	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	113.7	173	0	0	0	0	0	110.1	S351 H434	S351-G432 PolarHBondContact N-O 3.1Å; S351-G432 VanDerWaalsContact N-O 3.14Å; S351-G432 PolarHBondContact O-N 3.05Å; G432-H434 PolarHBondContact O-CD2 2.93Å; G432-H434 VanDerWaalsContact O-CD2 3.31Å; G432-H434 PolarHBondContact O-N 3.31Å
433	L	88.4	Confident	88.4	Confident	3 Å²	3	32.2 Å²	32.2	2%	0.016	16%	0.163	C	C	.	.			trans	-83.3	100.1	179.2	-71.3	73.4	0	0	0	109.4	I302 T321 V323 L440	I302-L433 HydrophobicContact CD1-CB 4.4Å; I302-L433 HydrophobicContact CD1-CD1 4.29Å; I302-L433 HydrophobicContact CD1-CD2 4.21Å; T321-L433 WeakPolarHBondContact CB-O 3.38Å; T321-L433 WeakPolarHBondContact CG2-O 3.37Å; T321-L433 PolarHBondContact O-N 3.22Å; T321-L433 PolarHBondContact OG1-N 3.28Å; T321-L433 PolarHBondContact OG1-O 3.26Å; V323-L433 HydrophobicContact CG2-CD1 4.07Å; L433-L440 HydrophobicContact CD1-CD1 3.68Å; L433-L440 HydrophobicContact CD1-CG 4.23Å; L433-L440 HydrophobicContact CD2-CG 4.16Å; L433-L440 HydrophobicContact CG-CD1 3.99Å; L433-L440 HydrophobicContact CG-CG 4.08Å
434	H	78.1	Confident	88.9	Confident	24 Å²	24	29.4 Å²	29.4	11%	0.111	15%	0.149	C	C	.	.			trans	-130.2	153.7	179.5	-56.1	-84	0	0	0	110.6	T321 P371 G432 A436	T321-H434 PolarHBondContact OG1-CE1 3.24Å; T321-H434 PolarHBondContact OG1-ND1 2.86Å; T321-H434 PolarHBondContact OG1-NE2 3.27Å; P371-H434 WeakPolarHBondContact CD-NE2 3.43Å; P371-H434 WeakPolarHBondContact CG-NE2 3.24Å; G432-H434 PolarHBondContact O-CD2 2.93Å; G432-H434 VanDerWaalsContact O-CD2 3.31Å; G432-H434 PolarHBondContact O-N 3.31Å; H434-A436 PolarHBondContact O-N 2.7Å
435	G	76.6	Confident	89.7	Confident	2 Å²	2	25.2 Å²	25.2	2%	0.021	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.1	-123.5	173.7	0	0	0	0	0	113.8	E318 R346 T347 V437	E318-G435 WeakPolarHBondContact OE1-CA 3.29Å; E318-G435 PolarHBondContact OE1-N 2.82Å; R346-G435 WeakPolarHBondContact CB-O 3.46Å; R346-G435 PolarHBondContact NE-O 3.1Å; R346-G435 PolarHBondContact NH2-O 3.37Å; T347-G435 WeakPolarHBondContact O-CA 3.42Å; G435-V437 VanDerWaalsContact C-N 3.31Å; G435-V437 PolarHBondContact O-N 3.31Å
436	A	83.3	Confident	90.1	Very high	16 Å²	16	18.5 Å²	18.5	13%	0.132	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-41.4	-175.8	0	0	0	0	0	112.2	S342 S343 R346 G348 H434	S342-A436 CarbonylContact C-O 3.59Å; S342-A436 WeakPolarHBondContact CA-O 3.24Å; S343-A436 PolarHBondContact N-O 3.1Å; S343-A436 WeakPolarHBondContact O-CA 3.22Å; R346-A436 PolarHBondContact NH2-O 3.01Å; R346-A436 PolarHBondContact O-N 3.2Å; G348-A436 PolarHBondContact O-N 3.5Å; G348-A436 VanDerWaalsContact O-N 3.15Å; H434-A436 PolarHBondContact O-N 2.7Å
437	V	89.6	Confident	89.8	Confident	1 Å²	1	19 Å²	19	1%	0.006	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	117.1	-170.5	178.9	0	0	0	0	111.8	V339 L350 L390 G435 L440	V339-V437 HydrophobicContact CG1-CG1 4.25Å; V339-V437 HydrophobicContact CG1-CG2 4.26Å; L350-V437 HydrophobicContact CB-CG2 4.24Å; L350-V437 HydrophobicContact CD1-CG1 4.44Å; L390-V437 HydrophobicContact CB-CG2 3.87Å; L390-V437 HydrophobicContact CD1-CG2 3.83Å; G435-V437 VanDerWaalsContact C-N 3.31Å; G435-V437 PolarHBondContact O-N 3.31Å; V437-L440 HydrophobicContact CG1-CD2 3.61Å; V437-L440 HydrophobicContact CG1-CG 4.2Å
438	T	89.1	Confident	88.5	Confident	27 Å²	27	24.1 Å²	24.1	17%	0.166	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	-10.4	179.9	26.2	0	0	0	0	115.1	R312 S313 K341 R346	R312-T438 CarbonylContact C-O 3.47Å; R312-T438 WeakPolarHBondContact CA-O 3.34Å; S313-T438 PolarHBondContact N-O 2.85Å; K341-T438 PolarHBondContact O-N 2.83Å; K341-T438 PolarHBondContact O-OG1 3.29Å; R346-T438 PolarHBondContact NH2-OG1 2.78Å
439	Q	91.6	Very high	86.2	Confident	18 Å²	18	25 Å²	25	8%	0.084	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	129.3	174.4	-161.1	-173.9	-41.6	0	0	112	V310 A311 R312 T340 K341	V310-Q439 HydrophobicContact CG1-CG 3.84Å; V310-Q439 VanDerWaalsContact CG1-NE2 3.27Å; A311-Q439 VanDerWaalsContact O-CA 3.31Å; A311-Q439 WeakPolarHBondContact O-CA 3.39Å; A311-Q439 WeakPolarHBondContact O-CG 3.38Å; R312-Q439 HydrophobicContact CB-CB 4.49Å; R312-Q439 HydrophobicContact CB-CG 3.93Å; R312-Q439 HydrophobicContact CG-CB 4.43Å; R312-Q439 HydrophobicContact CG-CG 4.27Å; R312-Q439 VanDerWaalsContact CZ-OE1 3.26Å; T340-Q439 PolarHBondContact N-O 2.86Å; T340-Q439 WeakPolarHBondContact OG1-CB 3.32Å; T340-Q439 VanDerWaalsContact OG1-CD 3.3Å; T340-Q439 WeakPolarHBondContact OG1-CG 3.43Å; T340-Q439 PolarHBondContact OG1-NE2 3.25Å; T340-Q439 PolarHBondContact OG1-O 3.36Å; T340-Q439 VanDerWaalsContact OG1-O 3.13Å; K341-Q439 HydrophobicContact CB-CB 3.73Å; K341-Q439 HydrophobicContact CD-CB 4.49Å; K341-Q439 HydrophobicContact CG-CB 4.01Å; K341-Q439 PolarHBondContact N-O 2.89Å; K341-Q439 PolarHBondContact O-N 2.81Å; K341-Q439 VanDerWaalsContact O-N 3.11Å
440	L	94.5	Very high	83.2	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	153.3	175.3	-62.1	179.8	0	0	0	110.2	F294 V310 A311 I337 K338 V339 L350 F431 L433 V437	F294-L440 HydrophobicContact CZ-CB 4.13Å; V310-L440 VanDerWaalsContact CA-O 3.32Å; V310-L440 WeakPolarHBondContact CA-O 3.39Å; A311-L440 PolarHBondContact N-O 3.46Å; A311-L440 PolarHBondContact O-N 2.92Å; I337-L440 HydrophobicContact CG2-CB 4.07Å; I337-L440 HydrophobicContact CG2-CD1 4.27Å; I337-L440 HydrophobicContact CG2-CD2 3.92Å; I337-L440 HydrophobicContact CG2-CG 4.32Å; K338-L440 CarbonylContact O-C 3.15Å; K338-L440 WeakPolarHBondContact O-CA 3.44Å; V339-L440 HydrophobicContact CG2-CD2 4.15Å; L350-L440 HydrophobicContact CD1-CD1 3.74Å; L350-L440 HydrophobicContact CD1-CD2 4.35Å; L350-L440 HydrophobicContact CD2-CD1 4.45Å; L350-L440 HydrophobicContact CD2-CD2 4.14Å; F431-L440 HydrophobicContact CB-CD1 3.89Å; F431-L440 HydrophobicContact CG-CD1 4.26Å; L433-L440 HydrophobicContact CD1-CD1 3.68Å; L433-L440 HydrophobicContact CD1-CG 4.23Å; L433-L440 HydrophobicContact CD2-CG 4.16Å; L433-L440 HydrophobicContact CG-CD1 3.99Å; L433-L440 HydrophobicContact CG-CG 4.08Å; V437-L440 HydrophobicContact CG1-CD2 3.61Å; V437-L440 HydrophobicContact CG1-CG 4.2Å
441	R	94.1	Very high	80.4	Confident	104 Å²	104	37.3 Å²	37.3	39%	0.392	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	128.4	167.6	175.3	167.4	-85.9	175.4	-5.3	109.3	D306 T309 V310 I337 K338 T340 L443	D306-R441 IonicContact OD2-CZ 2.71Å; D306-R441 IonicContact OD2-NE 3.82Å; D306-R441 IonicContact OD2-NH2 3.85Å; D306-R441 PolarHBondContact OD2-NH2 3.08Å; T309-R441 CarbonylContact O-C 3.54Å; T309-R441 VanDerWaalsContact O-CA 3.29Å; T309-R441 WeakPolarHBondContact O-CA 3.08Å; V310-R441 HydrophobicContact CG2-CB 3.8Å; V310-R441 HydrophobicContact CG2-CG 3.9Å; I337-R441 CarbonylContact C-O 3.48Å; I337-R441 WeakPolarHBondContact CA-O 3.49Å; K338-R441 HydrophobicContact CB-CB 4.47Å; K338-R441 PolarHBondContact N-O 3.09Å; K338-R441 PolarHBondContact O-N 3.14Å; T340-R441 HydrophobicContact CG2-CB 3.72Å; R441-L443 HydrophobicContact CG-CD2 4.2Å; R441-L443 PolarHBondContact O-N 3.18Å
442	I	94.6	Very high	77.6	Confident	5 Å²	5	47.9 Å²	47.9	3%	0.026	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	124.1	160.1	-52.9	-164.1	0	0	0	107.3	L292 F294 T309 I337	L292-I442 HydrophobicContact CB-CG2 4.49Å; L292-I442 HydrophobicContact CD2-CG2 4.18Å; L292-I442 HydrophobicContact CG-CD1 4.49Å; L292-I442 HydrophobicContact CG-CG2 4.38Å; L292-I442 WeakPolarHBondContact O-CG2 3.26Å; F294-I442 HydrophobicContact CD1-CD1 3.75Å; F294-I442 HydrophobicContact CD1-CG1 4.12Å; F294-I442 HydrophobicContact CD2-CD1 4.42Å; F294-I442 HydrophobicContact CD2-CG1 4.19Å; F294-I442 HydrophobicContact CE1-CD1 3.77Å; F294-I442 HydrophobicContact CE1-CG1 3.73Å; F294-I442 HydrophobicContact CE2-CD1 4.44Å; F294-I442 HydrophobicContact CE2-CG1 3.81Å; F294-I442 HydrophobicContact CG-CD1 4.08Å; F294-I442 HydrophobicContact CG-CG1 4.33Å; F294-I442 HydrophobicContact CZ-CD1 4.13Å; F294-I442 HydrophobicContact CZ-CG1 3.57Å; T309-I442 PolarHBondContact O-N 3.44Å; I337-I442 HydrophobicContact CD1-CB 4.3Å; I337-I442 HydrophobicContact CD1-CD1 4.41Å; I337-I442 HydrophobicContact CD1-CG1 3.74Å; I337-I442 HydrophobicContact CD1-CG2 4.49Å
443	L	91.3	Very high	74.7	Confident	49 Å²	49	52 Å²	52	26%	0.257	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	-21	173.5	-62.3	-176.7	0	0	0	112	L284 L288 F336 K338 I395 R441	L284-L443 HydrophobicContact CD1-CD1 3.75Å; L284-L443 HydrophobicContact CD2-CD1 4.4Å; L288-L443 HydrophobicContact CD1-CB 3.87Å; L288-L443 WeakPolarHBondContact CD1-O 3.19Å; F336-L443 HydrophobicContact CB-CB 4.07Å; F336-L443 HydrophobicContact CB-CD1 4.41Å; F336-L443 PolarHBondContact O-N 3.49Å; K338-L443 HydrophobicContact CB-CD1 4.05Å; K338-L443 HydrophobicContact CB-CD2 3.79Å; K338-L443 HydrophobicContact CB-CG 3.92Å; K338-L443 HydrophobicContact CD-CD2 4.26Å; I395-L443 HydrophobicContact CD1-CD1 4.24Å; I395-L443 HydrophobicContact CG1-CD1 4.3Å; I395-L443 HydrophobicContact CG2-CD1 4.09Å; R441-L443 HydrophobicContact CG-CD2 4.2Å; R441-L443 PolarHBondContact O-N 3.18Å
444	G	89.9	Confident	72	Confident	2 Å²	2	59 Å²	59	2%	0.021	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	130.3	-165.3	-174.2	0	0	0	0	0	109.5	E289 F336	E289-G444 WeakPolarHBondContact O-CA 3.4Å; F336-G444 PolarHBondContact N-O 3.09Å
445	S	91.5	Very high	69.7	Low	0 Å²	0	63 Å²	63	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	170.5	173.6	59.1	0	0	0	0	112.4	L288 E289 E333 T334	L288-S445 CarbonylContact C-O 3.45Å; L288-S445 WeakPolarHBondContact CA-O 3.38Å; E289-S445 PolarHBondContact N-O 3.06Å; E289-S445 PolarHBondContact O-N 2.95Å; E289-S445 VanDerWaalsContact O-N 3.16Å; E333-S445 WeakPolarHBondContact OE1-CB 3.5Å; E333-S445 PolarHBondContact OE1-OG 2.96Å; T334-S445 CarbonylContact O-C 3.58Å; T334-S445 WeakPolarHBondContact O-CA 3.44Å; T334-S445 WeakPolarHBondContact O-CB 3.5Å
446	T	90.3	Very high	67.5	Low	24 Å²	24	70.1 Å²	70.1	15%	0.147	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	146.7	164.6	55.3	0	0	0	0	111.6	P285 L288 E333 T334 F336	P285-T446 HydrophobicContact CB-CG2 3.56Å; P285-T446 HydrophobicContact CG-CG2 3.61Å; L288-T446 HydrophobicContact CD2-CG2 3.58Å; E333-T446 CarbonylContact C-O 3.59Å; E333-T446 VanDerWaalsContact CA-O 3.29Å; E333-T446 WeakPolarHBondContact CA-O 3.43Å; T334-T446 PolarHBondContact N-O 3.42Å; T334-T446 PolarHBondContact O-N 2.85Å; F336-T446 HydrophobicContact CE2-CG2 4.28Å
447	H	81.9	Confident	65.1	Low	88 Å²	88	74.9 Å²	74.9	41%	0.407	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	131.6	167.5	-172.9	-96	0	0	0	108.9	T331 G449	T331-H447 PolarHBondContact O-CD2 2.94Å; T331-H447 PolarHBondContact O-NE2 2.98Å; H447-G449 VanDerWaalsContact C-N 3.27Å; H447-G449 PolarHBondContact O-N 3.48Å
448	V	65.4	Low	62.1	Low	116 Å²	116	80.5 Å²	80.5	70%	0.703	47%	0.468	S	S	*	.			trans	-76.3	84.4	174.2	-176.7	0	0	0	0	108.7
449	G	44.9	Very low	59.4	Low	46 Å²	46	84.5 Å²	84.5	47%	0.474	50%	0.497	S	S	.	.			trans	-68.5	145.7	167	0	0	0	0	0	111.6	H447	H447-G449 VanDerWaalsContact C-N 3.27Å; H447-G449 PolarHBondContact O-N 3.48Å
450	D	33.1	Very low	57.1	Low	131 Å²	131	89.4 Å²	89.4	70%	0.701	53%	0.53	S	S	*	.			trans	-49.4	127.9	175.9	-169.9	-5.8	0	0	0	111.2	R452	D450-R452 PolarHBondContact O-N 2.91Å
451	P	36.3	Very low	53.9	Low	128 Å²	128	94.7 Å²	94.7	83%	0.831	57%	0.568	S	S	*	*	S	Bend	trans	-73	43.1	-175.9	30.7	-38	0	0	0	114.3
452	R	34.5	Very low	50.7	Low	222 Å²	222	94.9 Å²	94.9	84%	0.838	59%	0.585	S	S	*	*			trans	-134.8	58.5	175.5	-76	-171.3	172.9	150	-1.4	112.8	D450	D450-R452 PolarHBondContact O-N 2.91Å
453	A	29.2	Very low	47.5	Very low	86 Å²	86	99.8 Å²	99.8	71%	0.711	62%	0.62	S	S	*	*			trans	-141.3	75.4	159.2	0	0	0	0	0	110.5	S455	A453-S455 VanDerWaalsContact C-N 3.34Å; A453-S455 PolarHBondContact O-N 2.91Å
454	T	33.1	Very low	44.9	Very low	150 Å²	150	102 Å²	102	92%	0.92	64%	0.637	S	S	*	*			trans	-70.6	90.7	163.3	44.4	0	0	0	0	109.4
455	S	29.8	Very low	42	Very low	107 Å²	107	110.3 Å²	110.3	75%	0.748	68%	0.675	S	S	*	*			trans	-104.5	107	165.6	56.9	0	0	0	0	109.6	A453	A453-S455 VanDerWaalsContact C-N 3.34Å; A453-S455 PolarHBondContact O-N 2.91Å
456	N	30.3	Very low	39	Very low	152 Å²	152	116.5 Å²	116.5	81%	0.813	71%	0.713	S	S	*	*			trans	-61.5	154.4	172.7	-90.9	-4.5	0	0	0	111.4
457	P	31.8	Very low	36.9	Very low	116 Å²	116	120.7 Å²	120.7	75%	0.753	74%	0.74	S	S	*	*			trans	-79.8	138.5	-174	32.1	-35	0	0	0	112.5
458	S	28.1	Very low	34.3	Very low	120 Å²	120	122 Å²	122	84%	0.839	76%	0.76	S	S	*	*			trans	-137.4	114.6	156.6	39.3	0	0	0	0	109.6
459	S	31.1	Very low	32.5	Very low	111 Å²	111	120.2 Å²	120.2	78%	0.776	76%	0.757	S	S	*	*			trans	-91.9	-173.7	177.4	-46.2	0	0	0	0	110
460	P	44.3	Very low	31.7	Very low	120 Å²	120	126.9 Å²	126.9	78%	0.779	78%	0.781	S	S	*	*				-126.7	162.6	-97.3	36.5	-19.9	0	0	0	113.7
461	S	26.1	Very low	31.4	Very low	112 Å²	112	124 Å²	124	78%	0.783	78%	0.783	S	S	*	*			trans	-166.9	148.7	154.6	44.3	0	0	0	0	114.9
462	S	27.3	Very low	31	Very low	107 Å²	107	124.2 Å²	124.2	75%	0.748	79%	0.787	S	S	*	*			trans	55.1	103.3	155.1	49.6	0	0	0	0	120.3
463	S	28.1	Very low	30.7	Very low	109 Å²	109	117.4 Å²	117.4	76%	0.762	79%	0.786	S	S	*	*				-54.4	155.4	125.4	56.5	0	0	0	0	109.6
464	P	36.8	Very low	30.8	Very low	96 Å²	96	119.9 Å²	119.9	62%	0.623	79%	0.792	S	S	*	*				-151.4	-177.1	58	25.9	2.3	0	0	0	117.7
465	H	28.2	Very low	30.7	Very low	175 Å²	175	118.4 Å²	118.4	81%	0.81	79%	0.788	S	S	*	*			trans	86.6	111.5	158.4	-51.1	-58.4	0	0	0	121.2
466	T	28.7	Very low	30.8	Very low	131 Å²	131	120.5 Å²	120.5	80%	0.804	79%	0.791	S	S	*	*			trans	-80.1	174.3	135.1	48.3	0	0	0	0	109.2
467	P	45.2	Very low	31.7	Very low	111 Å²	111	118.4 Å²	118.4	72%	0.721	79%	0.785	S	S	*	*			cis	-138.7	-176.3	12	43.9	-26.3	0	0	0	116.4
468	S	28.4	Very low	31.5	Very low	117 Å²	117	118.3 Å²	118.3	82%	0.818	78%	0.782	S	S	*	*			trans	129.8	146.8	152.3	-60	0	0	0	0	111.6
469	A	28.2	Very low	31.6	Very low	78 Å²	78	119.6 Å²	119.6	65%	0.645	78%	0.779	S	S	*	*			cis	167	156.7	-21.7	0	0	0	0	0	105.8
470	L	27.8	Very low	31.4	Very low	185 Å²	185	122 Å²	122	97%	0.969	78%	0.783	S	S	*	*			trans	81.6	143.2	166.1	-64.3	129.7	0	0	0	120.6
471	G	26.5	Very low	30.5	Very low	72 Å²	72	119.9 Å²	119.9	74%	0.742	78%	0.783	S	S	*	*			trans	109.3	61.5	170.6	0	0	0	0	0	114.6
472	S	27.1	Very low	30.5	Very low	132 Å²	132	118.5 Å²	118.5	92%	0.923	79%	0.787	S	S	*	*				58.1	117.5	77	-145	0	0	0	0	114.6
473	G	28.1	Very low	30.5	Very low	79 Å²	79	121.1 Å²	121.1	81%	0.814	79%	0.792	S	S	*	*			trans	176.4	68.2	-177.5	0	0	0	0	0	114.3
474	V	31.6	Very low	30.5	Very low	137 Å²	137	122.4 Å²	122.4	83%	0.83	80%	0.799	S	S	*	*			trans	-74.2	139.3	173.9	170.5	0	0	0	0	110.8
475	S	30.5	Very low	30	Very low	120 Å²	120	122.9 Å²	122.9	84%	0.839	81%	0.805	S	S	*	*			trans	-175.7	98.8	140.3	-78.4	0	0	0	0	112.8
476	D	32.9	Very low	29.9	Very low	151 Å²	151	119.5 Å²	119.5	81%	0.807	81%	0.807	S	S	*	*			trans	-82.5	174.9	138.8	-112.1	-34.7	0	0	0	107.3
477	P	48.3	Very low	29.9	Very low	108 Å²	108	116.6 Å²	116.6	70%	0.701	80%	0.796	S	S	*	*			cis	-150.7	-166.3	32.9	26.9	1.9	0	0	0	117.1
478	V	29.3	Very low	28.9	Very low	114 Å²	114	121.7 Å²	121.7	69%	0.691	80%	0.802	S	S	*	*			trans	120	99.5	138.6	-176.7	0	0	0	0	118.8
479	L	29.1	Very low	28.8	Very low	147 Å²	147	122.1 Å²	122.1	77%	0.77	80%	0.804	S	S	*	*			trans	52.5	115	132.3	-53.1	178	0	0	0	122.8
480	N	27.1	Very low	28.7	Very low	160 Å²	160	124 Å²	124	86%	0.856	81%	0.812	S	S	*	*				172.1	145.9	99.9	-93.1	-27.1	0	0	0	108.3
481	G	25.1	Very low	28.8	Very low	77 Å²	77	120.4 Å²	120.4	79%	0.794	80%	0.803	S	S	*	*			cis	128.9	106.7	16.1	0	0	0	0	0	108.1
482	G	26.4	Very low	28.9	Very low	83 Å²	83	122 Å²	122	86%	0.856	81%	0.809	S	S	*	*			trans	162.8	79.9	-176.2	0	0	0	0	0	115.6
483	L	27.8	Very low	28.9	Very low	162 Å²	162	119.6 Å²	119.6	85%	0.848	81%	0.805	S	S	*	*			trans	-73.2	148.8	162.9	-79.4	140.8	0	0	0	110.7
484	C	26.7	Very low	28.7	Very low	135 Å²	135	119.6 Å²	119.6	91%	0.912	81%	0.805	S	S	*	*			trans	-163.3	125.8	145.2	-107	0	0	0	0	110.6
485	S	26.7	Very low	28.6	Very low	107 Å²	107	119.1 Å²	119.1	75%	0.748	80%	0.802	S	S	*	*			trans	-116.6	142.4	-176.4	-65.8	0	0	0	0	112.1
486	A	27	Very low	28.6	Very low	103 Å²	103	119.6 Å²	119.6	85%	0.851	80%	0.8	S	S	*	*			trans	62.7	169.1	156.9	0	0	0	0	0	116.2
487	A	27.4	Very low	29.3	Very low	70 Å²	70	117.9 Å²	117.9	58%	0.579	80%	0.798	S	S	*	*			cis	-159.9	171.1	11.3	0	0	0	0	0	113.5
488	Y	25.4	Very low	28.3	Very low	218 Å²	218	118.6 Å²	118.6	86%	0.855	81%	0.805	S	S	*	*			trans	58.5	125	155.2	-57.2	-61.8	0	0	0	122.6
489	C	26.4	Very low	28.3	Very low	126 Å²	126	118.9 Å²	118.9	85%	0.851	81%	0.812	S	S	*	*				-171.6	159	109.4	-93.6	0	0	0	0	113.9
490	S	25.8	Very low	28.9	Very low	118 Å²	118	117.4 Å²	117.4	83%	0.825	81%	0.812	S	S	*	*			trans	-150.9	178.1	-177.4	-45.2	0	0	0	0	109.4
491	S	28.6	Very low	29	Very low	110 Å²	110	116.2 Å²	116.2	77%	0.769	81%	0.81	S	S	*	*			cis	-161.6	157.9	5.7	-156.4	0	0	0	0	111.4
492	A	29.6	Very low	29.2	Very low	105 Å²	105	118.4 Å²	118.4	87%	0.868	81%	0.813	S	S	*	*			trans	60.8	167.4	165.5	0	0	0	0	0	116.8
493	G	26	Very low	29.4	Very low	81 Å²	81	121.1 Å²	121.1	84%	0.835	81%	0.807	S	S	*	*			cis	160.3	148.9	-6.4	0	0	0	0	0	110.4
494	G	25.6	Very low	29.5	Very low	79 Å²	79	118.9 Å²	118.9	81%	0.814	80%	0.802	S	S	*	*			trans	156.2	153.9	175.5	0	0	0	0	0	116.2
495	T	28.5	Very low	29.4	Very low	127 Å²	127	122.2 Å²	122.2	78%	0.779	80%	0.801	S	S	*	*			trans	-144	139.3	-158.5	48.9	0	0	0	0	117.3
496	T	31.2	Very low	29.4	Very low	130 Å²	130	122.7 Å²	122.7	80%	0.798	81%	0.805	S	S	*	*			trans	63.5	174.7	143.6	56.8	0	0	0	0	120.8
497	P	46.5	Very low	29.5	Very low	116 Å²	116	122.3 Å²	122.3	75%	0.753	79%	0.793	S	S	*	*			cis	-138.3	166.3	-45	36.1	-19.8	0	0	0	115.9
498	S	27.5	Very low	29.6	Very low	123 Å²	123	125.8 Å²	125.8	86%	0.86	81%	0.808	S	S	*	*			trans	-177.5	155.5	142.5	52.2	0	0	0	0	114.3
499	S	30.4	Very low	29.8	Very low	119 Å²	119	123.6 Å²	123.6	83%	0.832	80%	0.803	S	S	*	*			trans	-133.8	173.3	175.4	-51.8	0	0	0	0	110.1
500	P	41.8	Very low	30.1	Very low	117 Å²	117	123.3 Å²	123.3	76%	0.76	80%	0.8	S	S	*	*				-155.9	157.4	73	36.8	-13.5	0	0	0	120.4
501	V	29.2	Very low	30.4	Very low	135 Å²	135	123.5 Å²	123.5	82%	0.818	80%	0.801	S	S	*	*			trans	53.6	124.1	138.6	-179.4	0	0	0	0	123.7
502	S	28.5	Very low	30.4	Very low	122 Å²	122	121.7 Å²	121.7	85%	0.853	80%	0.799	S	S	*	*				-169.6	139.6	127.7	-80.4	0	0	0	0	112.3
503	L	30.2	Very low	30.6	Very low	140 Å²	140	128.9 Å²	128.9	73%	0.733	80%	0.804	S	S	*	*			trans	-121	152.9	178.9	-96.3	165.2	0	0	0	110.6
504	P	30.1	Very low	30.8	Very low	115 Å²	115	126.8 Å²	126.8	75%	0.747	78%	0.782	S	S	*	*				-148.3	145.6	120.4	34.6	-17.9	0	0	0	117.7
505	K	25.1	Very low	31.3	Very low	205 Å²	205	128.9 Å²	128.9	89%	0.891	78%	0.781	S	S	*	*			trans	58.6	119.9	146.8	-65.7	-178.2	178.1	178.9	0	121.2
506	S	27.4	Very low	31.7	Very low	118 Å²	118	133.4 Å²	133.4	83%	0.825	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-78.8	144.3	175.3	-29.1	0	0	0	0	113.7
507	P	28.7	Very low	32.6	Very low	95 Å²	95	130.1 Å²	130.1	62%	0.617	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-95.7	134.9	157	32.4	-25.2	0	0	0	111.6	F509	P507-F509 HydrophobicContact CG-CE2 4.01Å; P507-F509 HydrophobicContact CG-CZ 4.32Å
508	T	28.9	Very low	33.6	Very low	143 Å²	143	128.2 Å²	128.2	88%	0.877	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-74	143.4	173.7	-30.7	0	0	0	0	110.7
509	F	29.3	Very low	36.3	Very low	171 Å²	171	127.1 Å²	127.1	75%	0.75	74%	0.735	S	S	*	*			trans	-122.1	149.1	176.5	-74.3	-77.9	0	0	0	112.2	P507	P507-F509 HydrophobicContact CG-CE2 4.01Å; P507-F509 HydrophobicContact CG-CZ 4.32Å
510	P	33.6	Very low	38.9	Very low	121 Å²	121	121.5 Å²	121.5	79%	0.786	70%	0.696	S	S	*	*			trans	-84.5	148.8	-175.4	34.1	-35.3	0	0	0	113.3	G512	P510-G512 PolarHBondContact O-N 3.48Å
511	S	31.4	Very low	40.9	Very low	122 Å²	122	118 Å²	118	85%	0.853	67%	0.674	S	S	*	*			trans	-79.1	111.9	-179.4	-47.8	0	0	0	0	112.5
512	G	29.1	Very low	43.4	Very low	71 Å²	71	115.1 Å²	115.1	73%	0.732	65%	0.653	S	S	*	*			trans	-83.2	109	167.1	0	0	0	0	0	111	P510 G514	P510-G512 PolarHBondContact O-N 3.48Å; G512-G514 PolarHBondContact O-N 2.79Å
513	R	34.5	Very low	45.8	Very low	256 Å²	256	110.7 Å²	110.7	97%	0.966	62%	0.622	S	S	*	*			trans	-72.5	121.9	179.1	-76.1	-175.3	172.9	-146.1	-0.2	111.7
514	G	29.9	Very low	48	Very low	37 Å²	37	111.7 Å²	111.7	38%	0.381	62%	0.617	S	S	.	*			trans	-141.5	149.4	159.7	0	0	0	0	0	109.2	G512 W516 A517	G512-G514 PolarHBondContact O-N 2.79Å; G514-W516 PolarHBondContact O-N 3.4Å; G514-A517 PolarHBondContact O-N 2.93Å
515	P	35.3	Very low	50.3	Low	123 Å²	123	114.1 Å²	114.1	80%	0.799	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63	-18.3	-163.2	-25.2	35.4	0	0	0	116.4
516	W	36.4	Very low	53.1	Low	222 Å²	222	108 Å²	108	84%	0.841	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.2	9.4	-175.5	-54	-37.6	0	0	0	113.6	G514 D518	G514-W516 PolarHBondContact O-N 3.4Å; W516-D518 PolarHBondContact O-N 2.9Å
517	A	50.9	Low	55.9	Low	61 Å²	61	105.2 Å²	105.2	50%	0.504	58%	0.58	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.1	-7.3	178.4	0	0	0	0	0	113.5	G514	G514-A517 PolarHBondContact O-N 2.93Å
518	D	68.3	Low	58.9	Low	76 Å²	76	100.9 Å²	100.9	41%	0.406	55%	0.552	S	S	.	*	T	Hydrogen-bonded Turn	trans	-103.5	-2.4	-169.9	-88.9	-4.6	0	0	0	114.6	W516 A527 V528 R571	W516-D518 PolarHBondContact O-N 2.9Å; D518-A527 CarbonylContact O-C 3.54Å; D518-A527 WeakPolarHBondContact O-CA 3.25Å; D518-V528 PolarHBondContact O-N 2.81Å; D518-R571 IonicContact OD1-CZ 2.67Å; D518-R571 VanDerWaalsContact OD1-CZ 3.25Å; D518-R571 IonicContact OD1-NH1 2.85Å; D518-R571 PolarHBondContact OD1-NH1 2.9Å; D518-R571 IonicContact OD1-NH2 3.76Å; D518-R571 PolarHBondContact OD1-NH2 3.39Å; D518-R571 IonicContact OD2-CZ 3.21Å; D518-R571 IonicContact OD2-NH1 2.66Å; D518-R571 PolarHBondContact OD2-NH1 3.34Å; D518-R571 IonicContact OD2-NH2 2.93Å
519	E	83.6	Confident	61.8	Low	101 Å²	101	95.9 Å²	95.9	47%	0.472	52%	0.52	S	S	.	.	B	Isolated β-bridge	trans	-104.1	141.4	-175.3	-67.5	176.2	169.9	0	0	113.5	S521 V528	E519-S521 PolarHBondContact O-N 2.96Å; E519-V528 VanDerWaalsContact C-CG2 3.48Å; E519-V528 VanDerWaalsContact O-CG2 3.3Å; E519-V528 WeakPolarHBondContact O-CG2 3.49Å
520	C	85.5	Confident	64.6	Low	0 Å²	0	87.8 Å²	87.8	0%	0	48%	0.484	C	S	.	.			trans	-68.4	123	-178.5	171.7	0	0	0	0	112.7	I522 C523 Y524 N526 C541 C544	C520-I522 PolarHBondContact O-N 2.81Å; C520-I522 PolarHBondContact SG-N 3.04Å; C520-C523 PolarHBondContact O-N 2.82Å; C520-C523 VanDerWaalsContact SG-SG 3.7Å; C520-Y524 WeakPolarHBondContact O-CA 3.45Å; C520-Y524 PolarHBondContact O-N 3.34Å; C520-N526 WeakPolarHBondContact CB-O 3.41Å; C520-N526 PolarHBondContact N-O 2.85Å; C520-C541 HydrophobicContact CB-CB 3.87Å; C520-C541 VanDerWaalsContact CB-N 3.35Å; C520-C541 PolarHBondContact SG-N 2.88Å; C520-C544 VanDerWaalsContact SG-CB 3.57Å
521	S	82.9	Confident	67.2	Low	43 Å²	43	83.4 Å²	83.4	30%	0.301	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	20.9	178.6	-39.9	0	0	0	0	115.9	E519 C539	E519-S521 PolarHBondContact O-N 2.96Å; S521-C539 WeakPolarHBondContact CB-O 3.39Å; S521-C539 PolarHBondContact N-O 2.93Å; S521-C539 PolarHBondContact OG-O 2.66Å; S521-C539 VanDerWaalsContact OG-O 3.1Å
522	I	81	Confident	70	Confident	75 Å²	75	77.6 Å²	77.6	39%	0.385	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130	-49.4	174	-70.8	-176.7	0	0	0	111.2	C520 L540 C544 L548	C520-I522 PolarHBondContact O-N 2.81Å; C520-I522 PolarHBondContact SG-N 3.04Å; I522-L540 HydrophobicContact CB-CD2 4.2Å; I522-L540 HydrophobicContact CD1-CD2 3.46Å; I522-L540 VanDerWaalsContact CD1-CD2 3.46Å; I522-L540 HydrophobicContact CG1-CD2 3.53Å; I522-C544 HydrophobicContact CB-CB 3.95Å; I522-C544 HydrophobicContact CD1-CB 4.43Å; I522-C544 HydrophobicContact CG2-CB 4.03Å; I522-L548 HydrophobicContact CD1-CB 4.27Å; I522-L548 HydrophobicContact CD1-CD1 4.34Å; I522-L548 HydrophobicContact CD1-CD2 4.04Å; I522-L548 HydrophobicContact CD1-CG 4.46Å
523	C	80.8	Confident	72.4	Confident	30 Å²	30	80.3 Å²	80.3	20%	0.203	40%	0.404	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-24.5	178.3	59.2	0	0	0	0	113.6	C520 E525 C544	C520-C523 PolarHBondContact O-N 2.82Å; C520-C523 VanDerWaalsContact SG-SG 3.7Å; C523-E525 HydrophobicContact CB-CB 4.44Å; C523-E525 PolarHBondContact O-N 2.71Å; C523-C544 VanDerWaalsContact CB-SG 3.57Å
524	Y	75.4	Confident	74.4	Confident	160 Å²	160	69.6 Å²	69.6	63%	0.627	37%	0.366	S	S	*	.	S	Bend	trans	56.5	6.6	-173.9	-52.6	-88.1	0	0	0	115.1	C520	C520-Y524 WeakPolarHBondContact O-CA 3.45Å; C520-Y524 PolarHBondContact O-N 3.34Å
525	E	78.9	Confident	76.6	Confident	166 Å²	166	69 Å²	69	78%	0.776	36%	0.356	S	S	*	.	S	Bend	trans	-102.1	-41.4	178.6	-68.6	165.2	172.7	0	0	112.4	C523	C523-E525 HydrophobicContact CB-CB 4.44Å; C523-E525 PolarHBondContact O-N 2.71Å
526	N	83	Confident	78.5	Confident	78 Å²	78	65.4 Å²	65.4	42%	0.417	34%	0.342	S	S	.	.	S	Bend	trans	-101.5	144	-170.5	-69.7	-93.7	0	0	0	110.8	C520 C541	C520-N526 WeakPolarHBondContact CB-O 3.41Å; C520-N526 PolarHBondContact N-O 2.85Å; N526-C541 HydrophobicContact CB-CB 3.58Å
527	A	86.7	Confident	80.7	Confident	59 Å²	59	57.9 Å²	57.9	49%	0.488	32%	0.316	S	S	.	.	B	Isolated β-bridge	trans	-64.3	153	177.5	0	0	0	0	0	112.8	D518 D529 C541	D518-A527 CarbonylContact O-C 3.54Å; D518-A527 WeakPolarHBondContact O-CA 3.25Å; A527-D529 PolarHBondContact O-N 3.43Å; A527-C541 WeakPolarHBondContact O-CB 3.35Å
528	V	91.3	Very high	82.6	Confident	4 Å²	4	59.6 Å²	59.6	2%	0.024	32%	0.315	C	S	.	.			trans	-71.3	99.8	173.1	179.5	0	0	0	0	109.6	D518 E519 M538 R571	D518-V528 PolarHBondContact O-N 2.81Å; E519-V528 VanDerWaalsContact C-CG2 3.48Å; E519-V528 VanDerWaalsContact O-CG2 3.3Å; E519-V528 WeakPolarHBondContact O-CG2 3.49Å; V528-M538 VanDerWaalsContact CG1-C 3.46Å; V528-M538 HydrophobicContact CG1-CB 3.75Å; V528-R571 PolarHBondContact O-NH2 2.77Å
529	D	90.4	Very high	83.3	Confident	38 Å²	38	56.2 Å²	56.2	20%	0.203	30%	0.297	C	S	.	.			trans	-118.8	20.7	175.3	77.7	-33.7	0	0	0	112.7	A527 C541 Y542 K568 T569	A527-D529 PolarHBondContact O-N 3.43Å; D529-C541 WeakPolarHBondContact OD1-CA 3.16Å; D529-Y542 PolarHBondContact OD1-N 2.99Å; D529-K568 CarbonylContact O-C 3.57Å; D529-K568 WeakPolarHBondContact O-CA 3.45Å; D529-K568 WeakPolarHBondContact OD2-CE 3.48Å; D529-K568 IonicContact OD2-NZ 2.75Å; D529-K568 PolarHBondContact OD2-NZ 3.19Å; D529-T569 PolarHBondContact O-N 2.79Å; D529-T569 PolarHBondContact O-OG1 3.48Å
530	S	87.4	Confident	83.6	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.007	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	152.1	174.9	76.8	0	0	0	0	114.9	L540 I567	S530-L540 PolarHBondContact N-O 3.4Å; S530-L540 PolarHBondContact OG-O 2.87Å; S530-I567 CarbonylContact C-O 3.58Å; S530-I567 VanDerWaalsContact CA-O 3.28Å; S530-I567 WeakPolarHBondContact CA-O 3.26Å; S530-I567 WeakPolarHBondContact CB-O 3.26Å
531	V	89.4	Confident	84	Confident	28 Å²	28	51.6 Å²	51.6	17%	0.17	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	136.9	177.2	66.9	0	0	0	0	111.1	Y533 G536 M538 I566 I567 T569	V531-Y533 PolarHBondContact O-N 3.44Å; V531-G536 WeakPolarHBondContact CG2-O 3.43Å; V531-M538 HydrophobicContact CB-CG 3.77Å; V531-M538 HydrophobicContact CG2-CG 3.78Å; V531-I566 WeakPolarHBondContact O-CA 3.42Å; V531-I567 HydrophobicContact CG1-CB 3.88Å; V531-I567 HydrophobicContact CG1-CG2 4.5Å; V531-I567 PolarHBondContact N-O 3.05Å; V531-I567 PolarHBondContact O-N 3.31Å; V531-T569 HydrophobicContact CB-CG2 4.06Å; V531-T569 HydrophobicContact CG1-CG2 3.77Å
532	I	88.9	Confident	84.5	Confident	1 Å²	1	53.4 Å²	53.4	1%	0.005	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	111.1	176.2	-62.2	167.5	0	0	0	109.2	T534 C535 G536 H537 L540 C556 I563 I566	I532-T534 PolarHBondContact O-N 3.42Å; I532-T534 VanDerWaalsContact O-N 3.09Å; I532-C535 WeakPolarHBondContact CG2-SG 3.46Å; I532-C535 PolarHBondContact O-N 3.47Å; I532-C535 VanDerWaalsContact O-N 3.07Å; I532-G536 PolarHBondContact O-N 3.34Å; I532-H537 PolarHBondContact N-O 2.82Å; I532-H537 VanDerWaalsContact N-O 3.09Å; I532-L540 HydrophobicContact CD1-CD1 4.01Å; I532-L540 HydrophobicContact CG1-CD1 4.39Å; I532-C556 HydrophobicContact CD1-CB 3.83Å; I532-C556 HydrophobicContact CG2-CB 4.49Å; I532-I563 HydrophobicContact CD1-CD1 4.15Å; I532-I563 HydrophobicContact CG1-CD1 4.5Å; I532-I563 HydrophobicContact CG2-CB 4.48Å; I532-I563 HydrophobicContact CG2-CG1 3.88Å; I532-I563 HydrophobicContact CG2-CG2 4.36Å; I532-I566 HydrophobicContact CG1-CG1 4.43Å
533	Y	79.8	Confident	85	Confident	128 Å²	128	52.6 Å²	52.6	50%	0.502	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-36.4	-170.9	175.5	-110.7	0	0	0	113.9	V531 C535 D565 I567	V531-Y533 PolarHBondContact O-N 3.44Å; Y533-C535 VanDerWaalsContact C-N 3.3Å; Y533-C535 PolarHBondContact O-N 2.83Å; Y533-D565 WeakPolarHBondContact CB-O 3.39Å; Y533-D565 PolarHBondContact N-O 3.08Å; Y533-I567 HydrophobicContact CD2-CD1 3.77Å; Y533-I567 HydrophobicContact CG-CD1 4.39Å
534	T	75.7	Confident	85.4	Confident	30 Å²	30	51.6 Å²	51.6	18%	0.184	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-13.9	-175.9	52	0	0	0	0	114.6	I532 R561 Q562 K564	I532-T534 PolarHBondContact O-N 3.42Å; I532-T534 VanDerWaalsContact O-N 3.09Å; T534-R561 WeakPolarHBondContact O-CD 3.46Å; T534-R561 PolarHBondContact O-NH1 3.05Å; T534-Q562 WeakPolarHBondContact CB-O 3.25Å; T534-Q562 WeakPolarHBondContact CG2-O 3Å; T534-Q562 PolarHBondContact OG1-O 3.4Å; T534-K564 HydrophobicContact CG2-CB 3.59Å; T534-K564 HydrophobicContact CG2-CD 3.89Å; T534-K564 HydrophobicContact CG2-CG 3.63Å
535	C	77.6	Confident	86.2	Confident	24 Å²	24	44 Å²	44	16%	0.162	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-142.7	-8.1	-174.5	59.7	0	0	0	0	116.4	I532 Y533 H537 C559	I532-C535 WeakPolarHBondContact CG2-SG 3.46Å; I532-C535 PolarHBondContact O-N 3.47Å; I532-C535 VanDerWaalsContact O-N 3.07Å; Y533-C535 VanDerWaalsContact C-N 3.3Å; Y533-C535 PolarHBondContact O-N 2.83Å; C535-H537 WeakPolarHBondContact CB-ND1 3.41Å; C535-H537 PolarHBondContact O-N 3.49Å; C535-H537 PolarHBondContact SG-ND1 2.87Å; C535-C559 WeakPolarHBondContact CB-SG 3.21Å
536	G	74.1	Confident	86.8	Confident	49 Å²	49	39.3 Å²	39.3	51%	0.505	22%	0.224	S	C	.	.			trans	74.6	-3.9	179.1	0	0	0	0	0	115.5	V531 I532 M538	V531-G536 WeakPolarHBondContact CG2-O 3.43Å; I532-G536 PolarHBondContact O-N 3.34Å; G536-M538 PolarHBondContact O-N 3.18Å
537	H	83.3	Confident	87.1	Confident	64 Å²	64	42.5 Å²	42.5	30%	0.296	24%	0.235	S	C	.	.			trans	-66.6	126	177	-63.3	104.2	0	0	0	111.4	I532 C535 I558 C559	I532-H537 PolarHBondContact N-O 2.82Å; I532-H537 VanDerWaalsContact N-O 3.09Å; C535-H537 WeakPolarHBondContact CB-ND1 3.41Å; C535-H537 PolarHBondContact O-N 3.49Å; C535-H537 PolarHBondContact SG-ND1 2.87Å; H537-I558 HydrophobicContact CB-CB 4.39Å; H537-I558 HydrophobicContact CB-CG1 4.16Å; H537-C559 VanDerWaalsContact CE1-CB 3.49Å; H537-C559 WeakPolarHBondContact CE1-CB 3.22Å; H537-C559 PolarHBondContact CE1-SG 3.23Å; H537-C559 PolarHBondContact ND1-SG 3.13Å; H537-C559 VanDerWaalsContact ND1-SG 3.4Å
538	M	89.6	Confident	87.1	Confident	96 Å²	96	40.7 Å²	40.7	47%	0.473	22%	0.217	S	C	.	.			trans	-100.2	94.9	169.6	-65.4	-175.3	67.5	0	0	107.5	V528 V531 G536 T569	V528-M538 VanDerWaalsContact CG1-C 3.46Å; V528-M538 HydrophobicContact CG1-CB 3.75Å; V531-M538 HydrophobicContact CB-CG 3.77Å; V531-M538 HydrophobicContact CG2-CG 3.78Å; G536-M538 PolarHBondContact O-N 3.18Å; M538-T569 HydrophobicContact CE-CG2 3.97Å; M538-T569 WeakPolarHBondContact CE-OG1 3.33Å
539	C	84.2	Confident	86.9	Confident	6 Å²	6	44.4 Å²	44.4	4%	0.041	23%	0.232	C	C	.	.			trans	-137.9	2.8	-177.9	56	0	0	0	0	113.2	S521 I558	S521-C539 WeakPolarHBondContact CB-O 3.39Å; S521-C539 PolarHBondContact N-O 2.93Å; S521-C539 PolarHBondContact OG-O 2.66Å; S521-C539 VanDerWaalsContact OG-O 3.1Å; C539-I558 HydrophobicContact CB-CD1 3.97Å; C539-I558 HydrophobicContact CB-CG1 3.86Å
540	L	89	Confident	86.6	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.005	26%	0.262	C	S	.	.	B	Isolated β-bridge	trans	-131.4	142.8	-173.7	-61.1	177.4	0	0	0	110.5	I522 S530 I532 L548 P557	I522-L540 HydrophobicContact CB-CD2 4.2Å; I522-L540 HydrophobicContact CD1-CD2 3.46Å; I522-L540 VanDerWaalsContact CD1-CD2 3.46Å; I522-L540 HydrophobicContact CG1-CD2 3.53Å; S530-L540 PolarHBondContact N-O 3.4Å; S530-L540 PolarHBondContact OG-O 2.87Å; I532-L540 HydrophobicContact CD1-CD1 4.01Å; I532-L540 HydrophobicContact CG1-CD1 4.39Å; L540-L548 HydrophobicContact CD1-CD2 3.64Å; L540-P557 HydrophobicContact CD2-CG 4.2Å
541	C	94.2	Very high	86.5	Confident	3 Å²	3	56.9 Å²	56.9	2%	0.02	29%	0.288	C	S	.	.			trans	-71.4	153.5	156.3	77.3	0	0	0	0	109.2	C520 N526 A527 D529 A543 C544 G545	C520-C541 HydrophobicContact CB-CB 3.87Å; C520-C541 VanDerWaalsContact CB-N 3.35Å; C520-C541 PolarHBondContact SG-N 2.88Å; N526-C541 HydrophobicContact CB-CB 3.58Å; A527-C541 WeakPolarHBondContact O-CB 3.35Å; D529-C541 WeakPolarHBondContact OD1-CA 3.16Å; C541-A543 VanDerWaalsContact C-N 3.25Å; C541-A543 PolarHBondContact O-N 2.69Å; C541-C544 PolarHBondContact O-N 3.27Å; C541-C544 VanDerWaalsContact O-N 3.15Å; C541-C544 PolarHBondContact SG-N 2.92Å; C541-C544 VanDerWaalsContact SG-N 3.39Å; C541-C544 VanDerWaalsContact SG-SG 3.63Å; C541-G545 PolarHBondContact O-N 3.39Å
542	Y	92.8	Very high	85.6	Confident	80 Å²	80	61 Å²	61	31%	0.314	32%	0.318	S	S	.	.	H	α-helix	trans	-61.1	-34.6	-174.2	-171.7	-117.5	0	0	0	112.4	D529 G545 L546 I566 K568	D529-Y542 PolarHBondContact OD1-N 2.99Å; Y542-G545 PolarHBondContact O-N 2.76Å; Y542-L546 HydrophobicContact CD1-CD1 4.01Å; Y542-L546 HydrophobicContact CE1-CD1 3.58Å; Y542-L546 HydrophobicContact CE1-CG 4.25Å; Y542-L546 HydrophobicContact CE2-CD1 4.46Å; Y542-L546 HydrophobicContact CE2-CD2 4.38Å; Y542-L546 HydrophobicContact CE2-CG 4.28Å; Y542-L546 WeakPolarHBondContact O-CG 3.43Å; Y542-L546 PolarHBondContact O-N 2.59Å; Y542-I566 HydrophobicContact CD2-CG2 4.27Å; Y542-K568 HydrophobicContact CD1-CB 4.31Å; Y542-K568 HydrophobicContact CD1-CD 3.9Å; Y542-K568 HydrophobicContact CD1-CG 4.44Å; Y542-K568 HydrophobicContact CD2-CB 3.63Å; Y542-K568 HydrophobicContact CD2-CG 4.3Å; Y542-K568 HydrophobicContact CE1-CB 4.42Å; Y542-K568 HydrophobicContact CE1-CD 4.34Å; Y542-K568 HydrophobicContact CE2-CB 3.79Å; Y542-K568 HydrophobicContact CG-CB 3.91Å; Y542-K568 HydrophobicContact CG-CD 4.04Å; Y542-K568 HydrophobicContact CG-CG 4.11Å
543	A	91.9	Very high	85.1	Confident	58 Å²	58	67.6 Å²	67.6	48%	0.479	35%	0.353	S	S	.	.	H	α-helix	trans	-65	-45.5	175.6	0	0	0	0	0	112.6	C541 K547	C541-A543 VanDerWaalsContact C-N 3.25Å; C541-A543 PolarHBondContact O-N 2.69Å; A543-K547 WeakPolarHBondContact O-CG 3.35Å; A543-K547 PolarHBondContact O-N 3.09Å
544	C	90.7	Very high	85.2	Confident	9 Å²	9	61.8 Å²	61.8	6%	0.061	33%	0.332	C	S	.	.	H	α-helix	trans	-68.4	-37.4	174.6	-76.6	0	0	0	0	112	C520 I522 C523 C541 K547 L548	C520-C544 VanDerWaalsContact SG-CB 3.57Å; I522-C544 HydrophobicContact CB-CB 3.95Å; I522-C544 HydrophobicContact CD1-CB 4.43Å; I522-C544 HydrophobicContact CG2-CB 4.03Å; C523-C544 VanDerWaalsContact CB-SG 3.57Å; C541-C544 PolarHBondContact O-N 3.27Å; C541-C544 VanDerWaalsContact O-N 3.15Å; C541-C544 PolarHBondContact SG-N 2.92Å; C541-C544 VanDerWaalsContact SG-N 3.39Å; C541-C544 VanDerWaalsContact SG-SG 3.63Å; C544-K547 PolarHBondContact O-N 3.1Å; C544-L548 WeakPolarHBondContact O-CB 3.3Å; C544-L548 PolarHBondContact O-N 3.23Å
545	G	91.3	Very high	85.7	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-55.9	-55.1	172	0	0	0	0	0	112.2	C541 Y542 K547 L548 K549 I566	C541-G545 PolarHBondContact O-N 3.39Å; Y542-G545 PolarHBondContact O-N 2.76Å; G545-K547 VanDerWaalsContact C-N 3.26Å; G545-K547 PolarHBondContact O-N 3.4Å; G545-L548 PolarHBondContact O-N 2.81Å; G545-L548 VanDerWaalsContact O-N 3.08Å; G545-K549 PolarHBondContact O-N 3.08Å; G545-I566 WeakPolarHBondContact O-CD1 3.47Å
546	L	90.9	Very high	86.1	Confident	68 Å²	68	61.7 Å²	61.7	36%	0.356	33%	0.332	S	S	.	.	H	α-helix	trans	-60.9	-32.9	179.2	-71.8	178	0	0	0	113.3	Y542 K550	Y542-L546 HydrophobicContact CD1-CD1 4.01Å; Y542-L546 HydrophobicContact CE1-CD1 3.58Å; Y542-L546 HydrophobicContact CE1-CG 4.25Å; Y542-L546 HydrophobicContact CE2-CD1 4.46Å; Y542-L546 HydrophobicContact CE2-CD2 4.38Å; Y542-L546 HydrophobicContact CE2-CG 4.28Å; Y542-L546 WeakPolarHBondContact O-CG 3.43Å; Y542-L546 PolarHBondContact O-N 2.59Å; L546-K550 WeakPolarHBondContact O-CG 3.37Å
547	K	89.7	Confident	86.3	Confident	146 Å²	146	62.1 Å²	62.1	64%	0.635	33%	0.326	S	S	*	.	H	α-helix	trans	-66.3	-47.4	171.5	-71.9	174.1	-178.4	178.9	0	111.3	A543 C544 G545 K549 K550	A543-K547 WeakPolarHBondContact O-CG 3.35Å; A543-K547 PolarHBondContact O-N 3.09Å; C544-K547 PolarHBondContact O-N 3.1Å; G545-K547 VanDerWaalsContact C-N 3.26Å; G545-K547 PolarHBondContact O-N 3.4Å; K547-K549 PolarHBondContact O-N 2.86Å; K547-K550 PolarHBondContact O-N 3.1Å
548	L	86.6	Confident	86.1	Confident	21 Å²	21	63.8 Å²	63.8	11%	0.11	34%	0.336	C	S	.	.	H	α-helix	trans	-62.3	-42.1	179.2	-175	66.6	0	0	0	112.1	I522 L540 C544 G545 K550 M551 A554 P557 I563	I522-L548 HydrophobicContact CD1-CB 4.27Å; I522-L548 HydrophobicContact CD1-CD1 4.34Å; I522-L548 HydrophobicContact CD1-CD2 4.04Å; I522-L548 HydrophobicContact CD1-CG 4.46Å; L540-L548 HydrophobicContact CD1-CD2 3.64Å; C544-L548 WeakPolarHBondContact O-CB 3.3Å; C544-L548 PolarHBondContact O-N 3.23Å; G545-L548 PolarHBondContact O-N 2.81Å; G545-L548 VanDerWaalsContact O-N 3.08Å; L548-K550 PolarHBondContact O-N 3.39Å; L548-M551 HydrophobicContact CD1-SD 3.97Å; L548-M551 WeakPolarHBondContact O-CB 3.25Å; L548-M551 PolarHBondContact O-N 2.78Å; L548-M551 VanDerWaalsContact O-N 3.07Å; L548-A554 WeakPolarHBondContact O-CB 3.26Å; L548-P557 HydrophobicContact CD2-CG 4.38Å; L548-I563 HydrophobicContact CD2-CD1 3.36Å; L548-I563 HydrophobicContact CG-CD1 3.87Å
549	K	86.6	Confident	85.1	Confident	81 Å²	81	61.5 Å²	61.5	35%	0.352	33%	0.329	S	S	.	.	H	α-helix	trans	-60.1	-24.5	178	-172.8	-179.6	176.2	-174	0	113.4	G545 K547 M551 I563 K564 D565 I566	G545-K549 PolarHBondContact O-N 3.08Å; K547-K549 PolarHBondContact O-N 2.86Å; K549-M551 VanDerWaalsContact C-N 3.32Å; K549-I563 HydrophobicContact CG-CG2 4.45Å; K549-K564 VanDerWaalsContact CE-O 3.29Å; K549-K564 WeakPolarHBondContact CE-O 3.37Å; K549-D565 IonicContact NZ-OD1 2.82Å; K549-D565 PolarHBondContact NZ-OD1 3.43Å; K549-I566 HydrophobicContact CB-CD1 4.15Å
550	K	85.9	Confident	85.1	Confident	188 Å²	188	70.4 Å²	70.4	82%	0.817	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-8.6	177.8	-70.4	177.4	-179.7	-173.2	0	113.9	L546 K547 L548	L546-K550 WeakPolarHBondContact O-CG 3.37Å; K547-K550 PolarHBondContact O-N 3.1Å; L548-K550 PolarHBondContact O-N 3.39Å
551	M	84.3	Confident	84.5	Confident	114 Å²	114	77.1 Å²	77.1	56%	0.562	39%	0.387	S	S	*	.	S	Bend	trans	-80.8	142.5	178	-57.6	-177.7	-177.6	0	0	110.7	L548 K549 N553 A554	L548-M551 HydrophobicContact CD1-SD 3.97Å; L548-M551 WeakPolarHBondContact O-CB 3.25Å; L548-M551 PolarHBondContact O-N 2.78Å; L548-M551 VanDerWaalsContact O-N 3.07Å; K549-M551 VanDerWaalsContact C-N 3.32Å; M551-N553 PolarHBondContact O-N 2.94Å; M551-A554 WeakPolarHBondContact O-CB 3.23Å; M551-A554 PolarHBondContact O-N 2.76Å; M551-A554 VanDerWaalsContact O-N 3.17Å
552	S	71.4	Confident	84.2	Confident	115 Å²	115	82.9 Å²	82.9	80%	0.804	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-31.1	-177.5	47.9	0	0	0	0	113.9
553	N	77.1	Confident	84	Confident	138 Å²	138	79.7 Å²	79.7	74%	0.738	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.5	47.4	176	-70.8	-23	0	0	0	111.9	M551 C555	M551-N553 PolarHBondContact O-N 2.94Å; N553-C555 PolarHBondContact O-N 2.9Å
554	A	81.6	Confident	83.6	Confident	7 Å²	7	84.2 Å²	84.2	6%	0.058	41%	0.411	C	S	.	.			trans	-60.4	107.1	177.7	0	0	0	0	0	112.1	L548 M551 I563	L548-A554 WeakPolarHBondContact O-CB 3.26Å; M551-A554 WeakPolarHBondContact O-CB 3.23Å; M551-A554 PolarHBondContact O-N 2.76Å; M551-A554 VanDerWaalsContact O-N 3.17Å; A554-I563 HydrophobicContact CB-CB 4.11Å; A554-I563 PolarHBondContact O-N 2.8Å
555	C	87.3	Confident	83.4	Confident	50 Å²	50	87 Å²	87	34%	0.338	43%	0.425	S	S	.	.	B	Isolated β-bridge	trans	-126	146.9	-179.4	-74.4	0	0	0	0	111.4	N553 R560	N553-C555 PolarHBondContact O-N 2.9Å; C555-R560 PolarHBondContact SG-O 3.49Å
556	C	85	Confident	83.3	Confident	1 Å²	1	87.2 Å²	87.2	1%	0.007	43%	0.426	C	S	.	.			trans	-60.7	127.6	176.5	172.4	0	0	0	0	110.8	I532 I558 R560 R561	I532-C556 HydrophobicContact CD1-CB 3.83Å; I532-C556 HydrophobicContact CG2-CB 4.49Å; C556-I558 PolarHBondContact O-N 2.74Å; C556-I558 VanDerWaalsContact O-N 3.17Å; C556-I558 PolarHBondContact SG-N 2.86Å; C556-I558 VanDerWaalsContact SG-N 3.44Å; C556-R560 WeakPolarHBondContact O-CA 3.48Å; C556-R560 PolarHBondContact O-N 2.85Å; C556-R561 PolarHBondContact N-O 3.4Å
557	P	79.8	Confident	83.1	Confident	59 Å²	59	87.7 Å²	87.7	38%	0.383	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-33.1	178.6	-27.2	34.7	0	0	0	114.1	L540 L548	L540-P557 HydrophobicContact CD2-CG 4.2Å; L548-P557 HydrophobicContact CD2-CG 4.38Å
558	I	78.7	Confident	83.1	Confident	99 Å²	99	84.3 Å²	84.3	51%	0.508	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-46.6	-174.6	-49.8	-56.5	0	0	0	112.4	H537 C539 C556	H537-I558 HydrophobicContact CB-CB 4.39Å; H537-I558 HydrophobicContact CB-CG1 4.16Å; C539-I558 HydrophobicContact CB-CD1 3.97Å; C539-I558 HydrophobicContact CB-CG1 3.86Å; C556-I558 PolarHBondContact O-N 2.74Å; C556-I558 VanDerWaalsContact O-N 3.17Å; C556-I558 PolarHBondContact SG-N 2.86Å; C556-I558 VanDerWaalsContact SG-N 3.44Å
559	C	69	Low	82.8	Confident	48 Å²	48	85 Å²	85	32%	0.324	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.6	5.2	-170.3	71	0	0	0	0	114.8	C535 H537 R561	C535-C559 WeakPolarHBondContact CB-SG 3.21Å; H537-C559 VanDerWaalsContact CE1-CB 3.49Å; H537-C559 WeakPolarHBondContact CE1-CB 3.22Å; H537-C559 PolarHBondContact CE1-SG 3.23Å; H537-C559 PolarHBondContact ND1-SG 3.13Å; H537-C559 VanDerWaalsContact ND1-SG 3.4Å; C559-R561 PolarHBondContact O-N 2.87Å
560	R	83.1	Confident	82.3	Confident	193 Å²	193	90.3 Å²	90.3	73%	0.728	44%	0.438	S	S	*	.			trans	54.9	7.9	-179.3	-57.6	-177.1	177.6	-163.6	-5.4	115.7	C555 C556	C555-R560 PolarHBondContact SG-O 3.49Å; C556-R560 WeakPolarHBondContact O-CA 3.48Å; C556-R560 PolarHBondContact O-N 2.85Å
561	R	77.1	Confident	81.5	Confident	141 Å²	141	87.8 Å²	87.8	53%	0.532	42%	0.423	S	S	.	.			trans	-66.9	136.3	174.7	-168.6	177.1	-63.4	164.1	3.5	110.2	T534 C556 C559 I563	T534-R561 WeakPolarHBondContact O-CD 3.46Å; T534-R561 PolarHBondContact O-NH1 3.05Å; C556-R561 PolarHBondContact N-O 3.4Å; C559-R561 PolarHBondContact O-N 2.87Å; R561-I563 PolarHBondContact O-N 3.23Å
562	Q	87.9	Confident	79.4	Confident	125 Å²	125	88.1 Å²	88.1	58%	0.584	44%	0.437	S	S	*	.	B	Isolated β-bridge	trans	-56.2	135.6	179.1	-164.6	-179.2	21.1	0	0	111.5	T534 K564	T534-Q562 WeakPolarHBondContact CB-O 3.25Å; T534-Q562 WeakPolarHBondContact CG2-O 3Å; T534-Q562 PolarHBondContact OG1-O 3.4Å; Q562-K564 PolarHBondContact O-N 3.41Å
563	I	87.9	Confident	77.9	Confident	13 Å²	13	92.2 Å²	92.2	7%	0.067	46%	0.457	C	S	.	.			trans	-85.8	110	179.4	-61.6	179.7	0	0	0	108.3	I532 L548 K549 A554 R561 I566	I532-I563 HydrophobicContact CD1-CD1 4.15Å; I532-I563 HydrophobicContact CG1-CD1 4.5Å; I532-I563 HydrophobicContact CG2-CB 4.48Å; I532-I563 HydrophobicContact CG2-CG1 3.88Å; I532-I563 HydrophobicContact CG2-CG2 4.36Å; L548-I563 HydrophobicContact CD2-CD1 3.36Å; L548-I563 HydrophobicContact CG-CD1 3.87Å; K549-I563 HydrophobicContact CG-CG2 4.45Å; A554-I563 HydrophobicContact CB-CB 4.11Å; A554-I563 PolarHBondContact O-N 2.8Å; R561-I563 PolarHBondContact O-N 3.23Å; I563-I566 HydrophobicContact CD1-CD1 4.44Å; I563-I566 HydrophobicContact CG2-CD1 3.84Å; I563-I566 HydrophobicContact CG2-CG1 3.61Å
564	K	84.8	Confident	78	Confident	152 Å²	152	89.9 Å²	89.9	66%	0.661	44%	0.443	S	S	*	.	S	Bend	trans	-85.3	-41	168.3	-67	-180	179.7	-173.1	0	111.5	T534 K549 Q562	T534-K564 HydrophobicContact CG2-CB 3.59Å; T534-K564 HydrophobicContact CG2-CD 3.89Å; T534-K564 HydrophobicContact CG2-CG 3.63Å; K549-K564 VanDerWaalsContact CE-O 3.29Å; K549-K564 WeakPolarHBondContact CE-O 3.37Å; Q562-K564 PolarHBondContact O-N 3.41Å
565	D	85.9	Confident	77.8	Confident	68 Å²	68	94.3 Å²	94.3	36%	0.364	46%	0.463	S	S	.	.			trans	-153.3	162	178.9	-149.6	1.4	0	0	0	113.1	Y533 K549	Y533-D565 WeakPolarHBondContact CB-O 3.39Å; Y533-D565 PolarHBondContact N-O 3.08Å; K549-D565 IonicContact NZ-OD1 2.82Å; K549-D565 PolarHBondContact NZ-OD1 3.43Å
566	I	89.6	Confident	77.3	Confident	5 Å²	5	96.7 Å²	96.7	3%	0.026	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	121.2	-179.4	-62	178.7	0	0	0	108	V531 I532 Y542 G545 K549 I563	V531-I566 WeakPolarHBondContact O-CA 3.42Å; I532-I566 HydrophobicContact CG1-CG1 4.43Å; Y542-I566 HydrophobicContact CD2-CG2 4.27Å; G545-I566 WeakPolarHBondContact O-CD1 3.47Å; K549-I566 HydrophobicContact CB-CD1 4.15Å; I563-I566 HydrophobicContact CD1-CD1 4.44Å; I563-I566 HydrophobicContact CG2-CD1 3.84Å; I563-I566 HydrophobicContact CG2-CG1 3.61Å
567	I	86.7	Confident	76.8	Confident	77 Å²	77	102.4 Å²	102.4	40%	0.395	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	128.6	-174.2	-59.9	170.8	0	0	0	107.8	S530 V531 Y533	S530-I567 CarbonylContact C-O 3.58Å; S530-I567 VanDerWaalsContact CA-O 3.28Å; S530-I567 WeakPolarHBondContact CA-O 3.26Å; S530-I567 WeakPolarHBondContact CB-O 3.26Å; V531-I567 HydrophobicContact CG1-CB 3.88Å; V531-I567 HydrophobicContact CG1-CG2 4.5Å; V531-I567 PolarHBondContact N-O 3.05Å; V531-I567 PolarHBondContact O-N 3.31Å; Y533-I567 HydrophobicContact CD2-CD1 3.77Å; Y533-I567 HydrophobicContact CG-CD1 4.39Å
568	K	89.3	Confident	76.6	Confident	76 Å²	76	105.1 Å²	105.1	33%	0.33	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	132.3	171.8	-172.7	168.4	170.4	113.3	0	109.7	D529 Y542 Y570	D529-K568 CarbonylContact O-C 3.57Å; D529-K568 WeakPolarHBondContact O-CA 3.45Å; D529-K568 WeakPolarHBondContact OD2-CE 3.48Å; D529-K568 IonicContact OD2-NZ 2.75Å; D529-K568 PolarHBondContact OD2-NZ 3.19Å; Y542-K568 HydrophobicContact CD1-CB 4.31Å; Y542-K568 HydrophobicContact CD1-CD 3.9Å; Y542-K568 HydrophobicContact CD1-CG 4.44Å; Y542-K568 HydrophobicContact CD2-CB 3.63Å; Y542-K568 HydrophobicContact CD2-CG 4.3Å; Y542-K568 HydrophobicContact CE1-CB 4.42Å; Y542-K568 HydrophobicContact CE1-CD 4.34Å; Y542-K568 HydrophobicContact CE2-CB 3.79Å; Y542-K568 HydrophobicContact CG-CB 3.91Å; Y542-K568 HydrophobicContact CG-CD 4.04Å; Y542-K568 HydrophobicContact CG-CG 4.11Å; K568-Y570 HydrophobicContact CD-CE1 4.39Å; K568-Y570 HydrophobicContact CD-CE2 4.41Å; K568-Y570 HydrophobicContact CG-CE2 4.18Å
569	T	79.6	Confident	76.5	Confident	34 Å²	34	105.5 Å²	105.5	21%	0.209	50%	0.504	C	S	.	.			trans	-110.7	127.8	178.7	57	0	0	0	0	109.6	D529 V531 M538	D529-T569 PolarHBondContact O-N 2.79Å; D529-T569 PolarHBondContact O-OG1 3.48Å; V531-T569 HydrophobicContact CB-CG2 4.06Å; V531-T569 HydrophobicContact CG1-CG2 3.77Å; M538-T569 HydrophobicContact CE-CG2 3.97Å; M538-T569 WeakPolarHBondContact CE-OG1 3.33Å
570	Y	77.3	Confident	77	Confident	193 Å²	193	109.6 Å²	109.6	76%	0.757	52%	0.517	S	S	*	.	P	Polyproline II helix	trans	-97.9	129.1	174.3	-60.4	-94.2	0	0	0	108.7	K568	K568-Y570 HydrophobicContact CD-CE1 4.39Å; K568-Y570 HydrophobicContact CD-CE2 4.41Å; K568-Y570 HydrophobicContact CG-CE2 4.18Å
571	R	67.7	Low	76.6	Confident	136 Å²	136	103.2 Å²	103.2	51%	0.513	50%	0.501	S	S	.	.	P	Polyproline II helix	trans	-82.1	130.1	171.6	-60.7	-179.9	-175.2	-154.5	-3.9	107.6	D518 V528 T573	D518-R571 IonicContact OD1-CZ 2.67Å; D518-R571 VanDerWaalsContact OD1-CZ 3.25Å; D518-R571 IonicContact OD1-NH1 2.85Å; D518-R571 PolarHBondContact OD1-NH1 2.9Å; D518-R571 IonicContact OD1-NH2 3.76Å; D518-R571 PolarHBondContact OD1-NH2 3.39Å; D518-R571 IonicContact OD2-CZ 3.21Å; D518-R571 IonicContact OD2-NH1 2.66Å; D518-R571 PolarHBondContact OD2-NH1 3.34Å; D518-R571 IonicContact OD2-NH2 2.93Å; V528-R571 PolarHBondContact O-NH2 2.77Å; R571-T573 PolarHBondContact O-N 2.91Å
572	S	41.6	Very low	76.5	Confident	121 Å²	121	100 Å²	100	85%	0.846	50%	0.498	S	S	*	.	P	Polyproline II helix	trans	-69.6	122.2	162.2	-166.5	0	0	0	0	107.1
573	T	40	Very low	75.5	Confident	200 Å²	200	97.7 Å²	97.7	100%	1.227	49%	0.49	S	S	*	.			trans	-67.4	0	164.2	50.6	0	0	0	0	110.1	R571	R571-T573 PolarHBondContact O-N 2.91Å

Retrieved 573 of 573 residues in 85.3 ms (Link to these results)

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