G4VPH0_SCHMA Loading...

U5 small nuclear ribonucleoprotein 40 kDa protein

Required for pre-mRNA splicing as component of the activated spliceosome. Component of the U5 small nuclear ribonucleoprotein (snRNP) complex and the U4/U6-U5 tri-snRNP complex, building blocks of the spliceosome. As a component of the minor spliceosome, involved in the splicing of U12-type introns in pre-mRNAs.

AlphaFold DB , UniProt , Accession G4VPH0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 367 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	36.3	Very low	36	Very low	235 Å²	235	157.8 Å²	157.8	100%	1.158	87%	0.868	S	S	*	*				0	123.2	0	-73.7	179.8	-177.2	0	0	107.1
2	D	34.3	Very low	35.8	Very low	144 Å²	144	153.8 Å²	153.8	77%	0.77	86%	0.86	S	S	*	*			trans	43.3	113	165.1	-58.2	-44.5	0	0	0	119.9
3	F	38.1	Very low	35.5	Very low	214 Å²	214	155.1 Å²	155.1	94%	0.939	86%	0.858	S	S	*	*				-155.4	105.9	118.8	-99.8	-72.5	0	0	0	110.4
4	K	34.3	Very low	35.5	Very low	193 Å²	193	149.6 Å²	149.6	84%	0.839	84%	0.837	S	S	*	*			trans	-61	140.4	164.8	-93.5	173.7	170	172.5	0	110.9
5	K	43.6	Very low	35.7	Very low	205 Å²	205	146.2 Å²	146.2	89%	0.891	81%	0.813	S	S	*	*			trans	-162.4	117.6	135.8	-103.5	176.3	-172.1	-176.5	0	109.2
6	P	34.6	Very low	36	Very low	123 Å²	123	141.3 Å²	141.3	80%	0.799	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-89.5	129.9	168.8	33	-25.6	0	0	0	109.5
7	L	41	Very low	36.1	Very low	184 Å²	184	136.1 Å²	136.1	96%	0.963	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-83.4	137.2	169.1	-94.7	153.8	0	0	0	109.8
8	A	38	Very low	36	Very low	94 Å²	94	137.9 Å²	137.9	78%	0.777	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-77.9	149.8	-166.8	0	0	0	0	0	113.7
9	G	30.2	Very low	36.2	Very low	76 Å²	76	136.9 Å²	136.9	78%	0.784	77%	0.768	S	S	*	*			trans	71.3	79.8	136.9	0	0	0	0	0	117.9
10	V	33.8	Very low	36.5	Very low	141 Å²	141	135.7 Å²	135.7	86%	0.855	77%	0.77	S	S	*	*			trans	-113.9	96.1	150.2	-176.3	0	0	0	0	107.4	S12	V10-S12 PolarHBondContact O-N 3.16Å; V10-S12 VanDerWaalsContact O-N 3.14Å
11	T	32	Very low	36.4	Very low	127 Å²	127	139.3 Å²	139.3	78%	0.779	78%	0.777	S	S	*	*			trans	-63.5	106.3	165.4	39.2	0	0	0	0	108.8	M13	T11-M13 PolarHBondContact O-N 2.92Å; T11-M13 VanDerWaalsContact O-N 3.16Å
12	S	33.7	Very low	36.6	Very low	110 Å²	110	137.8 Å²	137.8	77%	0.769	76%	0.763	S	S	*	*			trans	-70.4	98.8	171.5	56.4	0	0	0	0	109.8	V10 S14	V10-S12 PolarHBondContact O-N 3.16Å; V10-S12 VanDerWaalsContact O-N 3.14Å; S12-S14 PolarHBondContact O-N 3.27Å
13	M	31	Very low	36.6	Very low	170 Å²	170	136.7 Å²	136.7	84%	0.837	77%	0.765	S	S	*	*			trans	-82.1	97.1	164.9	-75	-161.6	-178.1	0	0	108.7	T11 M15	T11-M13 PolarHBondContact O-N 2.92Å; T11-M13 VanDerWaalsContact O-N 3.16Å; M13-M15 PolarHBondContact O-N 3.18Å
14	S	35.9	Very low	36.1	Very low	79 Å²	79	138 Å²	138	55%	0.552	76%	0.763	S	S	*	*			trans	-66.4	121.4	166.1	120.5	0	0	0	0	108.1	S12 V16	S12-S14 PolarHBondContact O-N 3.27Å; S14-V16 VanDerWaalsContact C-N 3.33Å; S14-V16 PolarHBondContact O-N 2.86Å; S14-V16 VanDerWaalsContact O-N 3.11Å
15	M	39.4	Very low	36.3	Very low	98 Å²	98	138.9 Å²	138.9	48%	0.483	77%	0.767	S	S	.	*			trans	-89.5	66.8	-173.8	-62.5	-127.2	-60	0	0	111.9	M13 M261 K292	M13-M15 PolarHBondContact O-N 3.18Å; M15-M261 HydrophobicContact CE-CE 4.15Å; M15-K292 HydrophobicContact CE-CB 3.53Å; M15-K292 HydrophobicContact CE-CD 3.37Å; M15-K292 HydrophobicContact CE-CG 4.12Å; M15-K292 HydrophobicContact SD-CB 4.39Å; M15-K292 HydrophobicContact SD-CD 3.56Å; M15-K292 VanDerWaalsContact SD-CD 3.56Å
16	V	39.4	Very low	35.7	Very low	68 Å²	68	137 Å²	137	41%	0.412	77%	0.767	S	S	.	*			trans	-114.2	117.8	167.3	-178	0	0	0	0	108	S14 L18 F92	S14-V16 VanDerWaalsContact C-N 3.33Å; S14-V16 PolarHBondContact O-N 2.86Å; S14-V16 VanDerWaalsContact O-N 3.11Å; V16-L18 PolarHBondContact O-N 3.04Å; V16-F92 HydrophobicContact CG1-CE2 4.08Å
17	P	38.7	Very low	35.7	Very low	52 Å²	52	134.4 Å²	134.4	34%	0.338	76%	0.762	S	S	.	*	P	Polyproline II helix	trans	-69.6	127.9	177.4	-15.8	29.7	0	0	0	111.7
18	L	34.2	Very low	35.3	Very low	170 Å²	170	130.8 Å²	130.8	89%	0.89	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-88.9	117.6	166.3	-80.2	151	0	0	0	109	V16 S20	V16-L18 PolarHBondContact O-N 3.04Å; L18-S20 PolarHBondContact O-N 2.71Å
19	P	39.2	Very low	35	Very low	118 Å²	118	131.6 Å²	131.6	77%	0.766	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-77.3	118.4	176.1	26.8	-30.4	0	0	0	111.5
20	S	41.3	Very low	35.2	Very low	113 Å²	113	136.6 Å²	136.6	79%	0.79	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-80.4	132.8	171.4	57.2	0	0	0	0	111.3	L18 K22	L18-S20 PolarHBondContact O-N 2.71Å; S20-K22 PolarHBondContact O-N 3.46Å
21	K	36.1	Very low	35	Very low	212 Å²	212	133.6 Å²	133.6	92%	0.922	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-63.9	123.8	177.3	-76.3	-180	173.8	177.6	0	111.1
22	K	39.3	Very low	35.2	Very low	202 Å²	202	135.5 Å²	135.5	88%	0.878	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-89.9	136.7	163.3	-78.1	-175.8	178.7	177.2	0	111.1	S20	S20-K22 PolarHBondContact O-N 3.46Å
23	P	34.3	Very low	35.3	Very low	122 Å²	122	135.7 Å²	135.7	79%	0.792	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-85.9	148.3	169.3	33.2	-29.9	0	0	0	112
24	R	28.2	Very low	35.3	Very low	242 Å²	242	133.7 Å²	133.7	91%	0.913	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-63.7	141.5	174.2	-74.3	176.1	169.5	169.9	-4.7	111.9
25	K	38.5	Very low	35.2	Very low	211 Å²	211	139.6 Å²	139.6	92%	0.917	77%	0.774	S	S	*	*			trans	-142.7	127.6	152.3	-90.8	-169	175.6	-178.1	0	110.5
26	D	29.9	Very low	34.8	Very low	166 Å²	166	139.3 Å²	139.3	89%	0.888	78%	0.781	S	S	*	*			trans	-69.1	151.9	169.6	-60.4	-55.8	0	0	0	111.6
27	G	34.8	Very low	34.4	Very low	68 Å²	68	144 Å²	144	70%	0.701	80%	0.804	S	S	*	*			trans	-177.2	79.2	177.7	0	0	0	0	0	114.3
28	S	34	Very low	34.1	Very low	108 Å²	108	145 Å²	145	76%	0.755	82%	0.824	S	S	*	*			trans	26.1	113.9	142.3	59.2	0	0	0	0	121
29	S	30.2	Very low	33.8	Very low	111 Å²	111	145.5 Å²	145.5	78%	0.776	82%	0.824	S	S	*	*				38.1	111	127.9	64.9	0	0	0	0	120.3
30	L	35.3	Very low	33.6	Very low	181 Å²	181	150.2 Å²	150.2	95%	0.948	83%	0.828	S	S	*	*			trans	-143.7	118.4	144.3	-92	164.2	0	0	0	108.4
31	G	29.7	Very low	33.1	Very low	78 Å²	78	155 Å²	155	80%	0.804	83%	0.834	S	S	*	*			trans	-79.5	148.6	-177.5	0	0	0	0	0	113
32	I	37.1	Very low	33.1	Very low	166 Å²	166	152 Å²	152	85%	0.851	83%	0.828	S	S	*	*			trans	-133.2	126.2	163.6	-60.1	179.4	0	0	0	107.7
33	T	33.9	Very low	32.8	Very low	114 Å²	114	148.9 Å²	148.9	70%	0.699	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-62.9	144.6	-178.1	48.6	0	0	0	0	113.6
34	P	31.7	Very low	32.9	Very low	128 Å²	128	148.7 Å²	148.7	83%	0.831	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-88.2	133.5	173.8	33.8	-28.6	0	0	0	111.4
35	F	34.7	Very low	33.5	Very low	204 Å²	204	144.7 Å²	144.7	90%	0.895	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-75.5	133.1	170.2	-103.7	-92.7	0	0	0	110.9
36	S	30.1	Very low	33.6	Very low	92 Å²	92	142.6 Å²	142.6	64%	0.643	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-82.1	158	175	61	0	0	0	0	113.2
37	N	31.9	Very low	34.1	Very low	165 Å²	165	138.9 Å²	138.9	88%	0.882	79%	0.79	S	S	*	*			trans	95.7	105	157.3	-66	-12.3	0	0	0	118.1
38	G	31.2	Very low	34.4	Very low	74 Å²	74	139.2 Å²	139.2	76%	0.763	78%	0.78	S	S	*	*			trans	174.3	82.5	164	0	0	0	0	0	109.8	Y40	G38-Y40 PolarHBondContact O-N 2.94Å; G38-Y40 VanDerWaalsContact O-N 3.13Å
39	M	28.4	Very low	34.9	Very low	181 Å²	181	137.4 Å²	137.4	89%	0.892	77%	0.772	S	S	*	*			trans	-58.2	110	179.3	-71.3	-178.6	63.8	0	0	112.1
40	Y	34.5	Very low	35.9	Very low	217 Å²	217	135.6 Å²	135.6	85%	0.851	77%	0.771	S	S	*	*			trans	-141.8	101.5	143.9	-77.9	-79.4	0	0	0	107.3	G38 L42	G38-Y40 PolarHBondContact O-N 2.94Å; G38-Y40 VanDerWaalsContact O-N 3.13Å; Y40-L42 PolarHBondContact O-N 3.08Å
41	K	31.1	Very low	36.3	Very low	212 Å²	212	132.2 Å²	132.2	92%	0.922	75%	0.75	S	S	*	*			trans	-67	86.8	162	-86.7	-177.8	173.2	179.3	0	107	N43	K41-N43 PolarHBondContact O-N 2.75Å
42	L	36.2	Very low	37	Very low	149 Å²	149	134 Å²	134	78%	0.78	76%	0.757	S	S	*	*			trans	-77	113.1	155.7	-112.8	94.4	0	0	0	106.1	Y40 S44	Y40-L42 PolarHBondContact O-N 3.08Å; L42-S44 VanDerWaalsContact C-N 3.32Å; L42-S44 PolarHBondContact O-N 3.3Å
43	N	32.5	Very low	37.7	Very low	137 Å²	137	129.5 Å²	129.5	73%	0.733	75%	0.752	S	S	*	*			trans	-54.3	100.8	162.5	-87.4	-14.8	0	0	0	107.6	K41 Q45	K41-N43 PolarHBondContact O-N 2.75Å; N43-Q45 PolarHBondContact O-N 3.43Å
44	S	37.1	Very low	38.7	Very low	119 Å²	119	125.6 Å²	125.6	83%	0.832	73%	0.73	S	S	*	*			trans	-77.1	64.4	170.5	59.1	0	0	0	0	109	L42	L42-S44 VanDerWaalsContact C-N 3.32Å; L42-S44 PolarHBondContact O-N 3.3Å
45	Q	40.2	Very low	40.1	Very low	158 Å²	158	125.6 Å²	125.6	74%	0.738	72%	0.721	S	S	*	*			trans	-81.9	120.8	158.1	-77.2	-175.9	-12.4	0	0	106.6	N43 I47	N43-Q45 PolarHBondContact O-N 3.43Å; Q45-I47 PolarHBondContact O-N 2.59Å
46	I	42.2	Very low	41.3	Very low	166 Å²	166	120.6 Å²	120.6	85%	0.851	71%	0.709	S	S	*	*			trans	-64.3	104.1	170	-61.4	166.3	0	0	0	105.7	P48	I46-P48 VanDerWaalsContact O-CD 3.27Å; I46-P48 WeakPolarHBondContact O-CD 3.28Å
47	I	38.9	Very low	43.1	Very low	88 Å²	88	120 Å²	120	45%	0.451	69%	0.693	S	S	.	*			trans	-74.1	115	176.7	-61.1	176	0	0	0	106.7	Q45 Q51	Q45-I47 PolarHBondContact O-N 2.59Å; I47-Q51 HydrophobicContact CG2-CB 3.62Å; I47-Q51 HydrophobicContact CG2-CG 4.46Å
48	P	40.5	Very low	44.8	Very low	75 Å²	75	114.6 Å²	114.6	49%	0.487	67%	0.666	S	S	.	*			trans	-58.3	145	173.9	-19.3	31.7	0	0	0	110.6	I46 G50 Q51	I46-P48 VanDerWaalsContact O-CD 3.27Å; I46-P48 WeakPolarHBondContact O-CD 3.28Å; P48-G50 PolarHBondContact O-N 3.09Å; P48-Q51 PolarHBondContact O-N 2.89Å
49	A	44.8	Very low	46.9	Very low	71 Å²	71	111.5 Å²	111.5	59%	0.587	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.4	129.9	174.6	0	0	0	0	0	110.4	R57	A49-R57 HydrophobicContact CB-CG 3.91Å
50	G	51.5	Low	49.2	Very low	73 Å²	73	108.7 Å²	108.7	75%	0.753	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	106.2	-4	179.1	0	0	0	0	0	115.8	P48 S54	P48-G50 PolarHBondContact O-N 3.09Å; G50-S54 PolarHBondContact N-OG 2.99Å
51	Q	44.5	Very low	51.3	Low	110 Å²	110	98.7 Å²	98.7	51%	0.514	58%	0.583	S	S	.	*	S	Bend	trans	-85.4	149.7	170	-73.4	177.4	-1.4	0	0	111.7	I47 P48 G53 S54	I47-Q51 HydrophobicContact CG2-CB 3.62Å; I47-Q51 HydrophobicContact CG2-CG 4.46Å; P48-Q51 PolarHBondContact O-N 2.89Å; Q51-G53 PolarHBondContact O-N 3.21Å; Q51-S54 PolarHBondContact N-OG 2.8Å; Q51-S54 WeakPolarHBondContact O-CB 3.46Å; Q51-S54 PolarHBondContact O-N 2.9Å; Q51-S54 PolarHBondContact O-OG 3.19Å
52	A	44.5	Very low	53.6	Low	114 Å²	114	94.3 Å²	94.3	94%	0.942	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.3	106.3	177.6	0	0	0	0	0	110.3
53	G	51.5	Low	55.8	Low	73 Å²	73	88.8 Å²	88.8	75%	0.753	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	122.2	-14.5	-172.8	0	0	0	0	0	114.2	Q51	Q51-G53 PolarHBondContact O-N 3.21Å
54	S	55	Low	58.1	Low	32 Å²	32	85.5 Å²	85.5	22%	0.224	53%	0.529	C	S	.	.	S	Bend	trans	-78.3	141.2	168.8	68	0	0	0	0	110.8	G50 Q51	G50-S54 PolarHBondContact N-OG 2.99Å; Q51-S54 PolarHBondContact N-OG 2.8Å; Q51-S54 WeakPolarHBondContact O-CB 3.46Å; Q51-S54 PolarHBondContact O-N 2.9Å; Q51-S54 PolarHBondContact O-OG 3.19Å
55	I	61.1	Low	60.5	Low	128 Å²	128	85.2 Å²	85.2	66%	0.656	52%	0.518	S	S	*	.	P	Polyproline II helix	trans	-58.8	126.7	172.6	-59.7	163.5	0	0	0	106.9	R57 L363	I55-R57 PolarHBondContact O-N 3.04Å; I55-L363 HydrophobicContact CG2-CD2 3.95Å
56	P	60.7	Low	62.9	Low	98 Å²	98	78.9 Å²	78.9	64%	0.636	49%	0.488	S	S	*	.	P	Polyproline II helix	trans	-58.1	127.7	-178.5	24	-33.1	0	0	0	109.2	T58	P56-T58 PolarHBondContact O-N 3.19Å
57	R	66.1	Low	65.4	Low	80 Å²	80	74.3 Å²	74.3	30%	0.302	47%	0.465	S	S	.	.	P	Polyproline II helix	trans	-65.2	129.9	171.6	-57.9	-73.9	-69.4	140	4.4	107.5	A49 I55 L61 S63 P64 E361	A49-R57 HydrophobicContact CB-CG 3.91Å; I55-R57 PolarHBondContact O-N 3.04Å; R57-L61 PolarHBondContact NH2-O 2.85Å; R57-S63 PolarHBondContact NH2-O 3Å; R57-P64 VanDerWaalsContact NH1-CB 3.25Å; R57-E361 IonicContact CZ-OE2 3.75Å; R57-E361 IonicContact NE-OE2 2.59Å; R57-E361 IonicContact NH1-OE2 3.8Å; R57-E361 PolarHBondContact NH1-OE2 2.68Å; R57-E361 IonicContact NH2-OE2 3.13Å; R57-E361 PolarHBondContact NH2-OE2 3.23Å
58	T	69.3	Low	67.9	Low	51 Å²	51	70.3 Å²	70.3	31%	0.313	45%	0.445	S	S	.	.			trans	-111.5	-5	179.9	66.1	0	0	0	0	112.4	P56 P346 E361 P364	P56-T58 PolarHBondContact O-N 3.19Å; T58-P346 VanDerWaalsContact OG1-CG 3.3Å; T58-P346 WeakPolarHBondContact OG1-CG 3.43Å; T58-E361 WeakPolarHBondContact CA-OE1 3.19Å; T58-E361 WeakPolarHBondContact CB-OE1 3.02Å; T58-E361 PolarHBondContact N-OE1 2.91Å; T58-E361 PolarHBondContact OG1-OE1 3.4Å; T58-P364 HydrophobicContact CG2-CG 3.77Å
59	S	73.4	Confident	70.3	Confident	10 Å²	10	71.4 Å²	71.4	7%	0.07	45%	0.446	C	S	.	.	S	Bend	trans	-119.4	157.4	173.6	75.7	0	0	0	0	112.1	L61 E345 E361	S59-L61 PolarHBondContact O-N 3.5Å; S59-L61 WeakPolarHBondContact OG-CB 3.27Å; S59-L61 PolarHBondContact OG-N 2.83Å; S59-E345 WeakPolarHBondContact CA-OE2 3.47Å; S59-E345 VanDerWaalsContact CB-OE2 3.25Å; S59-E345 WeakPolarHBondContact CB-OE2 3.44Å; S59-E361 WeakPolarHBondContact CB-OE2 3.43Å; S59-E361 PolarHBondContact N-OE1 2.98Å; S59-E361 PolarHBondContact N-OE2 2.91Å; S59-E361 VanDerWaalsContact OG-CD 3.27Å; S59-E361 PolarHBondContact OG-OE2 2.85Å
60	N	77.3	Confident	72.4	Confident	121 Å²	121	70.1 Å²	70.1	65%	0.647	44%	0.441	S	S	*	.			trans	-83.9	11.8	173.2	-66.2	-48.6	0	0	0	112.7	Y102 E345	N60-Y102 HydrophobicContact CB-CD1 3.87Å; N60-Y102 HydrophobicContact CB-CE1 3.67Å; N60-E345 PolarHBondContact N-OE2 2.89Å; N60-E345 PolarHBondContact ND2-OE1 2.91Å
61	L	79.2	Confident	74.3	Confident	8 Å²	8	67.2 Å²	67.2	4%	0.042	41%	0.407	C	S	.	.			trans	-63.7	138.8	173.3	-69.9	173.5	0	0	0	110.8	R57 S59 S63 T101 I347	R57-L61 PolarHBondContact NH2-O 2.85Å; S59-L61 PolarHBondContact O-N 3.5Å; S59-L61 WeakPolarHBondContact OG-CB 3.27Å; S59-L61 PolarHBondContact OG-N 2.83Å; L61-S63 VanDerWaalsContact CB-O 3.29Å; L61-S63 WeakPolarHBondContact CB-O 3.5Å; L61-S63 PolarHBondContact O-N 2.67Å; L61-T101 WeakPolarHBondContact CD2-O 3.3Å; L61-I347 HydrophobicContact CD1-CB 4.4Å; L61-I347 HydrophobicContact CD1-CD1 3.84Å; L61-I347 HydrophobicContact CD1-CG1 3.74Å; L61-I347 HydrophobicContact CD1-CG2 3.83Å; L61-I347 HydrophobicContact CD2-CD1 4.02Å; L61-I347 HydrophobicContact CG-CD1 3.64Å; L61-I347 HydrophobicContact CG-CG1 4.1Å
62	L	79.4	Confident	76.6	Confident	119 Å²	119	67.3 Å²	67.3	62%	0.623	41%	0.408	S	S	*	.	S	Bend	trans	-57	-33.2	177.1	-174.1	67.3	0	0	0	112.2	G103 E104	L62-G103 VanDerWaalsContact CB-O 3.26Å; L62-G103 WeakPolarHBondContact CB-O 3.44Å; L62-E104 HydrophobicContact CD2-CG 4.38Å
63	S	81.1	Confident	78.9	Confident	33 Å²	33	62.9 Å²	62.9	23%	0.231	37%	0.37	C	S	.	.	S	Bend	trans	-138.9	159	176	89.3	0	0	0	0	111.4	R57 L61 N65 M66	R57-S63 PolarHBondContact NH2-O 3Å; L61-S63 VanDerWaalsContact CB-O 3.29Å; L61-S63 WeakPolarHBondContact CB-O 3.5Å; L61-S63 PolarHBondContact O-N 2.67Å; S63-N65 PolarHBondContact O-N 3.43Å; S63-N65 PolarHBondContact OG-O 3.07Å; S63-M66 PolarHBondContact OG-SD 2.85Å
64	P	81.2	Confident	81	Confident	69 Å²	69	61.6 Å²	61.6	45%	0.448	34%	0.344	S	S	.	.	S	Bend	trans	-60.4	-31.2	179.3	20.3	-31.5	0	0	0	114.6	R57 E361	R57-P64 VanDerWaalsContact NH1-CB 3.25Å; P64-E361 PolarHBondContact O-N 2.76Å
65	N	88.7	Confident	82.9	Confident	113 Å²	113	60.1 Å²	60.1	60%	0.604	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.2	111.4	179	-65.6	-39	0	0	0	108.4	S63 L359	S63-N65 PolarHBondContact O-N 3.43Å; S63-N65 PolarHBondContact OG-O 3.07Å; N65-L359 CarbonylContact C-O 3.56Å; N65-L359 VanDerWaalsContact CA-O 3.28Å; N65-L359 WeakPolarHBondContact CA-O 3.4Å
66	M	91	Very high	84.6	Confident	25 Å²	25	55.4 Å²	55.4	12%	0.123	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	143.3	173.5	-63	-67.3	-69.9	0	0	109.9	S63 C105 F358 L359	S63-M66 PolarHBondContact OG-SD 2.85Å; M66-C105 HydrophobicContact CE-CB 4.3Å; M66-F358 WeakPolarHBondContact O-CA 3.43Å; M66-L359 HydrophobicContact CB-CB 4.13Å; M66-L359 PolarHBondContact N-O 3.2Å; M66-L359 PolarHBondContact O-N 2.97Å
67	L	93	Very high	86.2	Confident	69 Å²	69	50.7 Å²	50.7	36%	0.361	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	119.8	174.8	169.1	65.5	0	0	0	108.5	K356 F358	L67-K356 HydrophobicContact CD1-CB 3.75Å; L67-K356 HydrophobicContact CD1-CD 3.87Å; L67-K356 HydrophobicContact CD1-CG 3.88Å; L67-F358 HydrophobicContact CB-CD1 4.39Å; L67-F358 HydrophobicContact CB-CE1 4.33Å; L67-F358 HydrophobicContact CD1-CD1 4.05Å; L67-F358 HydrophobicContact CD1-CD2 4.49Å; L67-F358 HydrophobicContact CD1-CE1 3.74Å; L67-F358 HydrophobicContact CD1-CE2 4.22Å; L67-F358 HydrophobicContact CD1-CG 4.44Å; L67-F358 HydrophobicContact CD1-CZ 3.84Å; L67-F358 HydrophobicContact CG-CE1 4.46Å
68	L	92	Very high	87.6	Confident	5 Å²	5	46.9 Å²	46.9	3%	0.026	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	123.4	174.1	-39.8	175	0	0	0	109.1	L87 W99 C105 I357 L359	L68-L87 HydrophobicContact CD1-CD1 4.13Å; L68-L87 HydrophobicContact CD1-CD2 3.75Å; L68-W99 HydrophobicContact CB-CD2 4.31Å; L68-W99 HydrophobicContact CB-CE3 4.09Å; L68-W99 HydrophobicContact CB-CH2 4.09Å; L68-W99 HydrophobicContact CB-CZ2 4.29Å; L68-W99 HydrophobicContact CB-CZ3 3.99Å; L68-W99 HydrophobicContact CD1-CB 4.27Å; L68-W99 HydrophobicContact CD1-CD2 3.96Å; L68-W99 HydrophobicContact CD1-CE3 4.27Å; L68-W99 HydrophobicContact CD1-CG 3.97Å; L68-W99 HydrophobicContact CD2-CE3 4.37Å; L68-W99 HydrophobicContact CG-CE3 4.48Å; L68-C105 HydrophobicContact CD2-CB 3.19Å; L68-I357 HydrophobicContact CB-CB 4.08Å; L68-I357 HydrophobicContact CD1-CB 4.29Å; L68-I357 HydrophobicContact CD1-CG2 3.97Å; L68-I357 HydrophobicContact CG-CB 4.38Å; L68-I357 HydrophobicContact CG-CG2 4.42Å; L68-I357 PolarHBondContact N-O 2.97Å; L68-I357 PolarHBondContact O-N 2.76Å; L68-L359 HydrophobicContact CD1-CD1 4.11Å; L68-L359 HydrophobicContact CD1-CG 4.48Å; L68-L359 HydrophobicContact CD2-CD1 4.48Å
69	N	91.1	Very high	88.8	Confident	97 Å²	97	46.7 Å²	46.7	52%	0.519	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	132	174.8	-64.4	-49.9	0	0	0	108.6	W99	N69-W99 WeakPolarHBondContact O-CH2 2.83Å
70	G	88	Confident	89.8	Confident	45 Å²	45	47.1 Å²	47.1	46%	0.464	26%	0.258	S	S	.	.			trans	173.8	-24.9	177.1	0	0	0	0	0	113.6
71	H	91.9	Very high	90.6	Very high	12 Å²	12	41.5 Å²	41.5	6%	0.056	23%	0.228	C	C	.	.			trans	-67.7	134.5	173.2	-76.3	-73.8	0	0	0	111.9	S73 V75 S89 D93	H71-S73 VanDerWaalsContact C-N 3.33Å; H71-V75 HydrophobicContact CB-CG2 3.59Å; H71-V75 WeakPolarHBondContact CD2-CG2 3.27Å; H71-V75 VanDerWaalsContact CG-CG2 3.45Å; H71-S89 WeakPolarHBondContact NE2-CB 3.26Å; H71-S89 PolarHBondContact NE2-OG 3.3Å; H71-D93 IonicContact CE1-OD2 3.01Å; H71-D93 IonicContact CG-OD2 3.39Å; H71-D93 IonicContact ND1-OD1 3.85Å; H71-D93 IonicContact ND1-OD2 2.71Å; H71-D93 PolarHBondContact ND1-OD2 2.77Å
72	E	92.8	Very high	91.1	Very high	112 Å²	112	44.3 Å²	44.3	52%	0.523	25%	0.249	S	C	.	.	S	Bend	trans	-80.9	-16.9	-179.5	-68.5	179	-174.6	0	0	112.4	D93 R95 K355	E72-D93 HydrophobicContact CB-CB 4.33Å; E72-R95 IonicContact OE1-CZ 2.71Å; E72-R95 VanDerWaalsContact OE1-CZ 3.22Å; E72-R95 IonicContact OE1-NH1 2.71Å; E72-R95 PolarHBondContact OE1-NH1 2.93Å; E72-R95 IonicContact OE1-NH2 3.19Å; E72-R95 PolarHBondContact OE1-NH2 2.73Å; E72-R95 IonicContact OE2-CZ 3.39Å; E72-R95 IonicContact OE2-NH1 3.97Å; E72-R95 IonicContact OE2-NH2 2.98Å; E72-R95 PolarHBondContact OE2-NH2 3.1Å; E72-K355 WeakPolarHBondContact O-CD 3.47Å; E72-K355 WeakPolarHBondContact O-CE 3.3Å; E72-K355 PolarHBondContact O-NZ 3.2Å
73	S	94	Very high	91.6	Very high	20 Å²	20	42.6 Å²	42.6	14%	0.14	24%	0.24	C	C	.	.	S	Bend	trans	-148.3	-170.4	-177.4	63.4	0	0	0	0	112	H71 V75 F92 D93 K355	H71-S73 VanDerWaalsContact C-N 3.33Å; S73-V75 PolarHBondContact O-N 3.29Å; S73-F92 WeakPolarHBondContact OG-CB 3.46Å; S73-D93 VanDerWaalsContact OG-CA 3.31Å; S73-D93 WeakPolarHBondContact OG-CA 3.4Å; S73-D93 WeakPolarHBondContact OG-CB 3.41Å; S73-D93 PolarHBondContact OG-N 3.32Å; S73-K355 WeakPolarHBondContact O-CB 3.32Å; S73-K355 WeakPolarHBondContact O-CG 3.47Å
74	E	94.4	Very high	92	Very high	47 Å²	47	41 Å²	41	22%	0.22	23%	0.229	C	C	.	.			trans	-51.4	135.3	179.5	-58.6	177	177.3	0	0	111.4	Y76 G91 F92 S353	E74-Y76 HydrophobicContact CB-CE1 4.04Å; E74-Y76 WeakPolarHBondContact OE2-CE1 3.35Å; E74-Y76 PolarHBondContact OE2-OH 3.22Å; E74-G91 WeakPolarHBondContact O-CA 3.38Å; E74-F92 HydrophobicContact CB-CB 4.26Å; E74-F92 PolarHBondContact O-N 3.39Å; E74-S353 WeakPolarHBondContact CG-O 3.49Å
75	V	95.9	Very high	92.5	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	124.8	176	-162	0	0	0	0	107.2	H71 S73 A90 N337 V351 G352 I357	H71-V75 HydrophobicContact CB-CG2 3.59Å; H71-V75 WeakPolarHBondContact CD2-CG2 3.27Å; H71-V75 VanDerWaalsContact CG-CG2 3.45Å; S73-V75 PolarHBondContact O-N 3.29Å; V75-A90 VanDerWaalsContact CG1-O 3.3Å; V75-A90 WeakPolarHBondContact CG1-O 3.29Å; V75-N337 PolarHBondContact O-ND2 2.9Å; V75-V351 HydrophobicContact CB-CG1 3.27Å; V75-V351 HydrophobicContact CG1-CG1 3.15Å; V75-V351 HydrophobicContact CG2-CG1 4.47Å; V75-V351 WeakPolarHBondContact O-CG1 3.27Å; V75-G352 PolarHBondContact N-O 2.79Å; V75-I357 HydrophobicContact CG1-CD1 4.47Å
76	Y	95.5	Very high	92.7	Very high	29 Å²	29	36 Å²	36	11%	0.114	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	-37.2	-175.5	-67	-46.9	0	0	0	111.8	E74 A90 F92 A117 I118 L119 N337 E338	E74-Y76 HydrophobicContact CB-CE1 4.04Å; E74-Y76 WeakPolarHBondContact OE2-CE1 3.35Å; E74-Y76 PolarHBondContact OE2-OH 3.22Å; Y76-A90 PolarHBondContact N-O 3.47Å; Y76-F92 HydrophobicContact CE2-CB 3.69Å; Y76-F92 HydrophobicContact CE2-CD2 4.07Å; Y76-F92 HydrophobicContact CE2-CG 4.4Å; Y76-F92 WeakPolarHBondContact OH-CD2 3.43Å; Y76-A117 HydrophobicContact CE2-CB 4.14Å; Y76-I118 WeakPolarHBondContact CD2-O 3.39Å; Y76-L119 HydrophobicContact CD2-CD2 3.95Å; Y76-L119 HydrophobicContact CE2-CD2 4.09Å; Y76-N337 WeakPolarHBondContact O-CB 3.44Å; Y76-E338 WeakPolarHBondContact O-CB 3.46Å
77	C	94.7	Very high	92.9	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	152	-175.2	54.3	0	0	0	0	113.1	S89 A90 L121 E338	C77-S89 WeakPolarHBondContact O-CA 3.33Å; C77-A90 PolarHBondContact N-O 2.93Å; C77-A90 PolarHBondContact O-N 3.4Å; C77-L121 HydrophobicContact CB-CB 4.16Å; C77-L121 WeakPolarHBondContact SG-CB 3.45Å; C77-E338 WeakPolarHBondContact CA-OE2 3.48Å; C77-E338 WeakPolarHBondContact CB-OE2 3.47Å
78	G	95	Very high	93	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	131.1	174.8	0	0	0	0	0	111.5	A88 E338 L349	G78-A88 CarbonylContact C-O 3.44Å; G78-A88 VanDerWaalsContact CA-O 3.25Å; G78-A88 WeakPolarHBondContact CA-O 3.45Å; G78-E338 PolarHBondContact N-OE2 3.1Å; G78-L349 VanDerWaalsContact C-CD2 3.47Å; G78-L349 WeakPolarHBondContact O-CD2 3.45Å
79	K	95.3	Very high	93.2	Very high	47 Å²	47	31.2 Å²	31.2	20%	0.204	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	144.2	-178.6	-61.8	-64.5	174.2	-169.1	0	110.7	L87 A88 L121 L123 E338	K79-L87 CarbonylContact O-C 3.53Å; K79-L87 WeakPolarHBondContact O-CA 3.43Å; K79-A88 PolarHBondContact N-O 3.19Å; K79-A88 PolarHBondContact O-N 3.27Å; K79-L121 HydrophobicContact CB-CD2 4.05Å; K79-L121 HydrophobicContact CG-CD2 4.06Å; K79-L121 VanDerWaalsContact CG-O 3.28Å; K79-L121 WeakPolarHBondContact CG-O 3.3Å; K79-L123 HydrophobicContact CB-CD1 4Å; K79-E338 WeakPolarHBondContact CE-OE1 3.41Å; K79-E338 VanDerWaalsContact NZ-CD 3.3Å; K79-E338 IonicContact NZ-OE1 3.74Å; K79-E338 PolarHBondContact NZ-OE1 2.89Å; K79-E338 IonicContact NZ-OE2 2.61Å
80	F	94.6	Very high	93.4	Very high	19 Å²	19	26.6 Å²	26.6	8%	0.083	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	151.6	166	-70.7	-73.5	0	0	0	110.6	L87 T101 L123 A340 F341 H342 I347 L349 L359	F80-L87 HydrophobicContact CD1-CB 3.87Å; F80-L87 HydrophobicContact CE1-CB 4.19Å; F80-L87 HydrophobicContact CE1-CD2 4.36Å; F80-T101 HydrophobicContact CD1-CG2 3.71Å; F80-T101 HydrophobicContact CE1-CG2 3.67Å; F80-L123 WeakPolarHBondContact O-CD1 3.2Å; F80-A340 HydrophobicContact CD2-CB 4.14Å; F80-A340 HydrophobicContact CE2-CB 4.5Å; F80-F341 WeakPolarHBondContact CD2-O 3.42Å; F80-H342 AromaticContact CD1-CD2 3.82Å; F80-H342 HydrophobicContact CD2-CB 4.19Å; F80-H342 AromaticContact CE1-CD2 3.87Å; F80-H342 HydrophobicContact CE2-CB 3.95Å; F80-H342 HydrophobicContact CZ-CB 4.12Å; F80-I347 HydrophobicContact CZ-CG2 4.12Å; F80-L349 HydrophobicContact CD2-CB 4.28Å; F80-L349 HydrophobicContact CE2-CB 3.41Å; F80-L349 VanDerWaalsContact CE2-CB 3.41Å; F80-L349 HydrophobicContact CE2-CD2 4.45Å; F80-L349 HydrophobicContact CE2-CG 4.45Å; F80-L349 HydrophobicContact CZ-CB 3.69Å; F80-L359 HydrophobicContact CE1-CD2 3.83Å; F80-L359 HydrophobicContact CZ-CD2 3.44Å; F80-L359 VanDerWaalsContact CZ-CD2 3.44Å
81	S	94.1	Very high	93.7	Very high	2 Å²	2	24.5 Å²	24.5	1%	0.014	13%	0.129	C	C	.	.			trans	-61.9	158	159.8	58.8	0	0	0	0	111.1	D83 G84 S85 F86 D127 P343	S81-D83 VanDerWaalsContact C-N 3.26Å; S81-D83 WeakPolarHBondContact CB-OD1 3.41Å; S81-D83 PolarHBondContact O-N 3.25Å; S81-D83 PolarHBondContact OG-OD1 3.46Å; S81-G84 PolarHBondContact O-N 2.54Å; S81-G84 VanDerWaalsContact O-N 3.11Å; S81-G84 WeakPolarHBondContact OG-CA 3.48Å; S81-G84 PolarHBondContact OG-N 2.89Å; S81-G84 VanDerWaalsContact OG-N 3.13Å; S81-S85 PolarHBondContact OG-N 3.13Å; S81-F86 VanDerWaalsContact CB-CE1 3.43Å; S81-F86 PolarHBondContact N-O 2.89Å; S81-F86 PolarHBondContact OG-N 3Å; S81-F86 PolarHBondContact OG-O 3.15Å; S81-D127 WeakPolarHBondContact CA-OD1 3.49Å; S81-P343 WeakPolarHBondContact O-CG 3.34Å
82	S	89.7	Confident	93.9	Very high	67 Å²	67	28.3 Å²	28.3	47%	0.469	15%	0.146	S	C	.	.	S	Bend	trans	-65.5	-29.5	177.1	77	0	0	0	0	112.9	D127 P343	S82-D127 WeakPolarHBondContact CA-OD2 3.13Å; S82-D127 VanDerWaalsContact CB-OD2 3.26Å; S82-D127 WeakPolarHBondContact CB-OD2 3.42Å; S82-D127 PolarHBondContact N-OD1 2.86Å; S82-D127 PolarHBondContact N-OD2 3.47Å; S82-D127 VanDerWaalsContact OG-CG 3.3Å; S82-D127 PolarHBondContact OG-OD2 2.96Å; S82-P343 WeakPolarHBondContact O-CB 3.22Å; S82-P343 VanDerWaalsContact O-CG 3.26Å; S82-P343 WeakPolarHBondContact O-CG 3.36Å
83	D	89.1	Confident	93.9	Very high	84 Å²	84	23.8 Å²	23.8	45%	0.449	13%	0.125	S	C	.	.	S	Bend	trans	-80.1	-18.9	171.4	72.4	-11.6	0	0	0	113.2	S81 S85 D127	S81-D83 VanDerWaalsContact C-N 3.26Å; S81-D83 WeakPolarHBondContact CB-OD1 3.41Å; S81-D83 PolarHBondContact O-N 3.25Å; S81-D83 PolarHBondContact OG-OD1 3.46Å; D83-S85 VanDerWaalsContact C-N 3.29Å; D83-S85 PolarHBondContact O-N 3.37Å; D83-S85 PolarHBondContact OD1-N 2.81Å; D83-S85 PolarHBondContact OD1-OG 2.77Å; D83-S85 VanDerWaalsContact OD2-CB 3.32Å; D83-S85 WeakPolarHBondContact OD2-CB 3.31Å; D83-S85 PolarHBondContact OD2-OG 2.85Å; D83-D127 PolarHBondContact N-OD2 3.11Å
84	G	89.7	Confident	93.9	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.143	C	C	.	.	S	Bend	trans	76.5	5.8	-176.9	0	0	0	0	0	115.1	S81 T101 H342	S81-G84 PolarHBondContact O-N 2.54Å; S81-G84 VanDerWaalsContact O-N 3.11Å; S81-G84 WeakPolarHBondContact OG-CA 3.48Å; S81-G84 PolarHBondContact OG-N 2.89Å; S81-G84 VanDerWaalsContact OG-N 3.13Å; G84-T101 WeakPolarHBondContact O-CB 3.37Å; G84-T101 WeakPolarHBondContact O-CG2 3.41Å; G84-T101 PolarHBondContact O-OG1 2.9Å; G84-H342 WeakPolarHBondContact CA-NE2 3.37Å; G84-H342 PolarHBondContact O-NE2 3.15Å
85	S	91.7	Very high	93.9	Very high	44 Å²	44	30.7 Å²	30.7	31%	0.308	15%	0.146	S	C	.	.	S	Bend	trans	-74.5	-27.4	-178.6	67.6	0	0	0	0	113.5	S81 D83 T101	S81-S85 PolarHBondContact OG-N 3.13Å; D83-S85 VanDerWaalsContact C-N 3.29Å; D83-S85 PolarHBondContact O-N 3.37Å; D83-S85 PolarHBondContact OD1-N 2.81Å; D83-S85 PolarHBondContact OD1-OG 2.77Å; D83-S85 VanDerWaalsContact OD2-CB 3.32Å; D83-S85 WeakPolarHBondContact OD2-CB 3.31Å; D83-S85 PolarHBondContact OD2-OG 2.85Å; S85-T101 VanDerWaalsContact C-OG1 3.24Å; S85-T101 PolarHBondContact O-N 2.9Å; S85-T101 PolarHBondContact O-OG1 2.92Å
86	F	93.5	Very high	93.9	Very high	31 Å²	31	30.7 Å²	30.7	14%	0.136	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	163.4	178.1	70.2	-91.7	0	0	0	111.8	S81 L98 W99 I108 L123 D127 T144	S81-F86 VanDerWaalsContact CB-CE1 3.43Å; S81-F86 PolarHBondContact N-O 2.89Å; S81-F86 PolarHBondContact OG-N 3Å; S81-F86 PolarHBondContact OG-O 3.15Å; F86-L98 HydrophobicContact CD2-CD2 4.25Å; F86-L98 HydrophobicContact CE2-CD2 4.38Å; F86-W99 CarbonylContact C-O 3.55Å; F86-W99 WeakPolarHBondContact CA-O 3.33Å; F86-W99 VanDerWaalsContact CB-O 3.29Å; F86-W99 WeakPolarHBondContact CB-O 3.35Å; F86-I108 HydrophobicContact CB-CD1 4.29Å; F86-L123 HydrophobicContact CE2-CD2 3.93Å; F86-L123 HydrophobicContact CZ-CD2 4.21Å; F86-D127 HydrophobicContact CE1-CB 4.11Å; F86-D127 HydrophobicContact CZ-CB 3.91Å; F86-T144 HydrophobicContact CZ-CG2 4.39Å
87	L	94.7	Very high	93.9	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	146	172.9	72.6	100.6	0	0	0	109.8	L68 K79 F80 L98 W99 T101 L349 L359	L68-L87 HydrophobicContact CD1-CD1 4.13Å; L68-L87 HydrophobicContact CD1-CD2 3.75Å; K79-L87 CarbonylContact O-C 3.53Å; K79-L87 WeakPolarHBondContact O-CA 3.43Å; F80-L87 HydrophobicContact CD1-CB 3.87Å; F80-L87 HydrophobicContact CE1-CB 4.19Å; F80-L87 HydrophobicContact CE1-CD2 4.36Å; L87-L98 CarbonylContact O-C 3.41Å; L87-L98 WeakPolarHBondContact O-CA 3.33Å; L87-W99 HydrophobicContact CD1-CB 4.11Å; L87-W99 HydrophobicContact CD1-CG 3.87Å; L87-W99 HydrophobicContact CD2-CB 3.99Å; L87-W99 HydrophobicContact CD2-CG 4.5Å; L87-W99 HydrophobicContact CG-CB 3.77Å; L87-W99 HydrophobicContact CG-CG 4.1Å; L87-W99 PolarHBondContact N-O 3.46Å; L87-W99 PolarHBondContact O-N 3.14Å; L87-T101 HydrophobicContact CB-CG2 4.27Å; L87-T101 HydrophobicContact CD2-CG2 4.1Å; L87-L349 HydrophobicContact CD1-CD1 4.23Å; L87-L349 HydrophobicContact CD2-CD1 4.43Å; L87-L359 HydrophobicContact CD2-CD1 3.9Å; L87-L359 HydrophobicContact CD2-CD2 4.27Å; L87-L359 HydrophobicContact CD2-CG 4.5Å
88	A	95.7	Very high	94	Very high	0 Å²	0	30 Å²	30	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	129.6	176.2	0	0	0	0	0	109.2	G78 K79 L97 L98 L121 L123 I130	G78-A88 CarbonylContact C-O 3.44Å; G78-A88 VanDerWaalsContact CA-O 3.25Å; G78-A88 WeakPolarHBondContact CA-O 3.45Å; K79-A88 PolarHBondContact N-O 3.19Å; K79-A88 PolarHBondContact O-N 3.27Å; A88-L97 WeakPolarHBondContact CA-O 3.45Å; A88-L98 HydrophobicContact CB-CD2 3.56Å; A88-L121 HydrophobicContact CB-CD1 4Å; A88-L121 HydrophobicContact CB-CD2 3.71Å; A88-L123 HydrophobicContact CB-CD1 4.42Å; A88-I130 HydrophobicContact CB-CD1 3.97Å
89	S	96.1	Very high	93.9	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	144.8	177.7	62.9	0	0	0	0	111.5	H71 C77 I96 L97 W99 I357	H71-S89 WeakPolarHBondContact NE2-CB 3.26Å; H71-S89 PolarHBondContact NE2-OG 3.3Å; C77-S89 WeakPolarHBondContact O-CA 3.33Å; S89-I96 CarbonylContact O-C 3.6Å; S89-I96 WeakPolarHBondContact O-CA 3.32Å; S89-L97 PolarHBondContact N-O 3.47Å; S89-L97 PolarHBondContact O-N 3.16Å; S89-W99 PolarHBondContact OG-NE1 2.97Å; S89-I357 VanDerWaalsContact OG-CD1 3.3Å; S89-I357 WeakPolarHBondContact OG-CD1 3.32Å
90	A	95.9	Very high	93.8	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	158.4	-179.1	0	0	0	0	0	111.8	V75 Y76 C77 I96 I118 L121	V75-A90 VanDerWaalsContact CG1-O 3.3Å; V75-A90 WeakPolarHBondContact CG1-O 3.29Å; Y76-A90 PolarHBondContact N-O 3.47Å; C77-A90 PolarHBondContact N-O 2.93Å; C77-A90 PolarHBondContact O-N 3.4Å; A90-I96 HydrophobicContact CB-CB 4.45Å; A90-I96 HydrophobicContact CB-CG1 4.08Å; A90-I96 HydrophobicContact CB-CG2 4.4Å; A90-I118 HydrophobicContact CB-CB 3.88Å; A90-I118 HydrophobicContact CB-CD1 3.91Å; A90-I118 HydrophobicContact CB-CG2 3.62Å; A90-L121 HydrophobicContact CB-CD1 3.9Å
91	G	94.4	Very high	93.6	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-169.4	-143.9	178.9	0	0	0	0	0	114.8	E74 D93 R94 I118	E74-G91 WeakPolarHBondContact O-CA 3.38Å; G91-D93 PolarHBondContact O-N 2.8Å; G91-R94 PolarHBondContact O-N 3.03Å; G91-I118 PolarHBondContact O-N 2.66Å
92	F	95	Very high	93.4	Very high	93 Å²	93	34.3 Å²	34.3	41%	0.408	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-18	-175	-170.1	-92.9	0	0	0	113.4	V16 S73 E74 Y76 R94 A117	V16-F92 HydrophobicContact CG1-CE2 4.08Å; S73-F92 WeakPolarHBondContact OG-CB 3.46Å; E74-F92 HydrophobicContact CB-CB 4.26Å; E74-F92 PolarHBondContact O-N 3.39Å; Y76-F92 HydrophobicContact CE2-CB 3.69Å; Y76-F92 HydrophobicContact CE2-CD2 4.07Å; Y76-F92 HydrophobicContact CE2-CG 4.4Å; Y76-F92 WeakPolarHBondContact OH-CD2 3.43Å; F92-R94 PolarHBondContact O-N 2.76Å; F92-A117 HydrophobicContact CD2-CB 3.85Å; F92-A117 HydrophobicContact CE2-CB 4.45Å; F92-A117 HydrophobicContact CG-CB 4.47Å
93	D	93.6	Very high	93.2	Very high	16 Å²	16	32.9 Å²	32.9	9%	0.086	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-7	-178.4	59.8	1.7	0	0	0	112.5	H71 E72 S73 G91 R95	H71-D93 IonicContact CE1-OD2 3.01Å; H71-D93 IonicContact CG-OD2 3.39Å; H71-D93 IonicContact ND1-OD1 3.85Å; H71-D93 IonicContact ND1-OD2 2.71Å; H71-D93 PolarHBondContact ND1-OD2 2.77Å; E72-D93 HydrophobicContact CB-CB 4.33Å; S73-D93 VanDerWaalsContact OG-CA 3.31Å; S73-D93 WeakPolarHBondContact OG-CA 3.4Å; S73-D93 WeakPolarHBondContact OG-CB 3.41Å; S73-D93 PolarHBondContact OG-N 3.32Å; G91-D93 PolarHBondContact O-N 2.8Å; D93-R95 PolarHBondContact O-N 2.85Å; D93-R95 PolarHBondContact OD1-N 3.32Å; D93-R95 VanDerWaalsContact OD1-N 3.1Å
94	R	94.5	Very high	93	Very high	138 Å²	138	35.7 Å²	35.7	52%	0.521	17%	0.169	S	C	.	.	S	Bend	trans	65.4	18.8	179.9	-41.1	173.4	-78.8	-167.9	-6.7	112.3	G91 F92 G116	G91-R94 PolarHBondContact O-N 3.03Å; F92-R94 PolarHBondContact O-N 2.76Å; R94-G116 WeakPolarHBondContact CG-O 3.39Å
95	R	94.2	Very high	92.8	Very high	75 Å²	75	36 Å²	36	28%	0.283	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	148.9	176.5	-59	-170.6	-175.7	149.2	12.1	109.1	E72 D93 L97 T110 M112	E72-R95 IonicContact OE1-CZ 2.71Å; E72-R95 VanDerWaalsContact OE1-CZ 3.22Å; E72-R95 IonicContact OE1-NH1 2.71Å; E72-R95 PolarHBondContact OE1-NH1 2.93Å; E72-R95 IonicContact OE1-NH2 3.19Å; E72-R95 PolarHBondContact OE1-NH2 2.73Å; E72-R95 IonicContact OE2-CZ 3.39Å; E72-R95 IonicContact OE2-NH1 3.97Å; E72-R95 IonicContact OE2-NH2 2.98Å; E72-R95 PolarHBondContact OE2-NH2 3.1Å; D93-R95 PolarHBondContact O-N 2.85Å; D93-R95 PolarHBondContact OD1-N 3.32Å; D93-R95 VanDerWaalsContact OD1-N 3.1Å; R95-L97 HydrophobicContact CB-CD2 4.47Å; R95-T110 HydrophobicContact CB-CG2 4.38Å; R95-M112 HydrophobicContact CG-CG 4.2Å
96	I	95.7	Very high	92.8	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	125.1	167.5	-49.1	158.6	0	0	0	105.6	S89 A90 T110 M111 I118 L121 T132 W142	S89-I96 CarbonylContact O-C 3.6Å; S89-I96 WeakPolarHBondContact O-CA 3.32Å; A90-I96 HydrophobicContact CB-CB 4.45Å; A90-I96 HydrophobicContact CB-CG1 4.08Å; A90-I96 HydrophobicContact CB-CG2 4.4Å; I96-T110 WeakPolarHBondContact O-CA 3.3Å; I96-M111 HydrophobicContact CB-CB 4.15Å; I96-M111 HydrophobicContact CB-CE 3.71Å; I96-M111 HydrophobicContact CD1-CB 4.29Å; I96-M111 HydrophobicContact CD1-CE 4.07Å; I96-M111 HydrophobicContact CD1-SD 4.48Å; I96-M111 HydrophobicContact CG2-CE 3.39Å; I96-M111 PolarHBondContact N-O 2.94Å; I96-M111 VanDerWaalsContact N-O 3.07Å; I96-M111 PolarHBondContact O-N 3.28Å; I96-I118 HydrophobicContact CD1-CD1 4.25Å; I96-I118 HydrophobicContact CG1-CD1 3.49Å; I96-I118 VanDerWaalsContact CG1-CD1 3.49Å; I96-L121 HydrophobicContact CG2-CD1 3.55Å; I96-T132 HydrophobicContact CD1-CG2 3.44Å; I96-T132 VanDerWaalsContact CD1-CG2 3.44Å; I96-T132 HydrophobicContact CG1-CG2 4.07Å; I96-W142 HydrophobicContact CD1-CD2 4.07Å; I96-W142 HydrophobicContact CD1-CG 4.16Å; I96-W142 HydrophobicContact CD1-CZ2 4.27Å
97	L	95.5	Very high	92.7	Very high	6 Å²	6	41.2 Å²	41.2	3%	0.031	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	132.1	176.8	-56	-177.1	0	0	0	108.2	A88 S89 R95 W99 T110	A88-L97 WeakPolarHBondContact CA-O 3.45Å; S89-L97 PolarHBondContact N-O 3.47Å; S89-L97 PolarHBondContact O-N 3.16Å; R95-L97 HydrophobicContact CB-CD2 4.47Å; L97-W99 HydrophobicContact CB-CZ2 3.98Å; L97-W99 HydrophobicContact CD1-CH2 4.25Å; L97-W99 HydrophobicContact CD1-CZ2 3.51Å; L97-W99 HydrophobicContact CG-CZ2 4.39Å; L97-T110 HydrophobicContact CD2-CG2 3.66Å; L97-T110 VanDerWaalsContact CD2-OG1 3.3Å; L97-T110 WeakPolarHBondContact CD2-OG1 3.39Å
98	L	95.4	Very high	92.6	Very high	8 Å²	8	46.2 Å²	46.2	4%	0.042	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	127.4	171.8	-67.5	-178.3	0	0	0	108.3	F86 L87 A88 N107 I108 A109 M111 I130	F86-L98 HydrophobicContact CD2-CD2 4.25Å; F86-L98 HydrophobicContact CE2-CD2 4.38Å; L87-L98 CarbonylContact O-C 3.41Å; L87-L98 WeakPolarHBondContact O-CA 3.33Å; A88-L98 HydrophobicContact CB-CD2 3.56Å; L98-N107 CarbonylContact O-C 3.6Å; L98-N107 WeakPolarHBondContact O-CA 3.46Å; L98-N107 PolarHBondContact O-OD1 2.97Å; L98-I108 HydrophobicContact CB-CB 4.46Å; L98-I108 PolarHBondContact O-N 2.85Å; L98-A109 HydrophobicContact CB-CB 4.34Å; L98-A109 HydrophobicContact CD1-CB 4.19Å; L98-A109 PolarHBondContact N-O 2.86Å; L98-A109 PolarHBondContact O-N 2.82Å; L98-M111 HydrophobicContact CD1-CE 4.03Å; L98-M111 HydrophobicContact CD2-CE 4.07Å; L98-M111 HydrophobicContact CG-CE 3.92Å; L98-I130 HydrophobicContact CD2-CD1 3.69Å
99	W	94.4	Very high	92.4	Very high	10 Å²	10	47.2 Å²	47.2	4%	0.038	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	144.7	-179.5	-41.9	72.1	0	0	0	110.2	L68 N69 F86 L87 S89 L97 E106 N107	L68-W99 HydrophobicContact CB-CD2 4.31Å; L68-W99 HydrophobicContact CB-CE3 4.09Å; L68-W99 HydrophobicContact CB-CH2 4.09Å; L68-W99 HydrophobicContact CB-CZ2 4.29Å; L68-W99 HydrophobicContact CB-CZ3 3.99Å; L68-W99 HydrophobicContact CD1-CB 4.27Å; L68-W99 HydrophobicContact CD1-CD2 3.96Å; L68-W99 HydrophobicContact CD1-CE3 4.27Å; L68-W99 HydrophobicContact CD1-CG 3.97Å; L68-W99 HydrophobicContact CD2-CE3 4.37Å; L68-W99 HydrophobicContact CG-CE3 4.48Å; N69-W99 WeakPolarHBondContact O-CH2 2.83Å; F86-W99 CarbonylContact C-O 3.55Å; F86-W99 WeakPolarHBondContact CA-O 3.33Å; F86-W99 VanDerWaalsContact CB-O 3.29Å; F86-W99 WeakPolarHBondContact CB-O 3.35Å; L87-W99 HydrophobicContact CD1-CB 4.11Å; L87-W99 HydrophobicContact CD1-CG 3.87Å; L87-W99 HydrophobicContact CD2-CB 3.99Å; L87-W99 HydrophobicContact CD2-CG 4.5Å; L87-W99 HydrophobicContact CG-CB 3.77Å; L87-W99 HydrophobicContact CG-CG 4.1Å; L87-W99 PolarHBondContact N-O 3.46Å; L87-W99 PolarHBondContact O-N 3.14Å; S89-W99 PolarHBondContact OG-NE1 2.97Å; L97-W99 HydrophobicContact CB-CZ2 3.98Å; L97-W99 HydrophobicContact CD1-CH2 4.25Å; L97-W99 HydrophobicContact CD1-CZ2 3.51Å; L97-W99 HydrophobicContact CG-CZ2 4.39Å; W99-E106 VanDerWaalsContact CA-O 3.3Å; W99-E106 WeakPolarHBondContact CA-O 3.31Å; W99-N107 HydrophobicContact CD2-CB 4.41Å; W99-N107 HydrophobicContact CE3-CB 3.9Å; W99-N107 HydrophobicContact CH2-CB 4.44Å; W99-N107 HydrophobicContact CZ3-CB 3.91Å
100	E	93.5	Very high	92.3	Very high	91 Å²	91	50.1 Å²	50.1	43%	0.425	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	136.7	164.7	-160.6	170.3	-177.1	0	0	108.9	C105 E106 I108	E100-C105 WeakPolarHBondContact O-CA 3.15Å; E100-C105 WeakPolarHBondContact O-CB 3.43Å; E100-E106 PolarHBondContact N-O 2.85Å; E100-I108 HydrophobicContact CB-CD1 3.96Å; E100-I108 HydrophobicContact CB-CG1 4.17Å
101	T	89.3	Confident	92.2	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.245	C	C	.	.	S	Bend	trans	-78.7	-35.1	177.3	53.6	0	0	0	0	111.6	L61 F80 G84 S85 L87 C105	L61-T101 WeakPolarHBondContact CD2-O 3.3Å; F80-T101 HydrophobicContact CD1-CG2 3.71Å; F80-T101 HydrophobicContact CE1-CG2 3.67Å; G84-T101 WeakPolarHBondContact O-CB 3.37Å; G84-T101 WeakPolarHBondContact O-CG2 3.41Å; G84-T101 PolarHBondContact O-OG1 2.9Å; S85-T101 VanDerWaalsContact C-OG1 3.24Å; S85-T101 PolarHBondContact O-N 2.9Å; S85-T101 PolarHBondContact O-OG1 2.92Å; L87-T101 HydrophobicContact CB-CG2 4.27Å; L87-T101 HydrophobicContact CD2-CG2 4.1Å; T101-C105 PolarHBondContact O-SG 2.81Å
102	Y	89.2	Confident	92.1	Very high	57 Å²	57	56.5 Å²	56.5	22%	0.224	28%	0.276	C	S	.	.	S	Bend	trans	-95.4	166.2	-177.7	-56.3	-67	0	0	0	111.6	N60 H342 E345	N60-Y102 HydrophobicContact CB-CD1 3.87Å; N60-Y102 HydrophobicContact CB-CE1 3.67Å; Y102-H342 PolarHBondContact OH-CE1 2.86Å; Y102-E345 WeakPolarHBondContact CE1-OE1 3.44Å; Y102-E345 PolarHBondContact OH-OE1 3.05Å
103	G	86.8	Confident	91.9	Very high	37 Å²	37	53.8 Å²	53.8	38%	0.381	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.9	-136.7	-178	0	0	0	0	0	113.2	L62 C105	L62-G103 VanDerWaalsContact CB-O 3.26Å; L62-G103 WeakPolarHBondContact CB-O 3.44Å; G103-C105 PolarHBondContact O-N 2.86Å
104	E	85.4	Confident	91.8	Very high	144 Å²	144	53.7 Å²	53.7	67%	0.673	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	0.6	179.7	-60.4	-166.9	173.9	0	0	113.2	L62 E106	L62-E104 HydrophobicContact CD2-CG 4.38Å; E104-E106 HydrophobicContact CB-CG 4.19Å
105	C	85.5	Confident	91.7	Very high	6 Å²	6	49.7 Å²	49.7	4%	0.041	28%	0.275	C	S	.	.			trans	54.1	52.7	-173.1	-50.9	0	0	0	0	112.7	M66 L68 E100 T101 G103	M66-C105 HydrophobicContact CE-CB 4.3Å; L68-C105 HydrophobicContact CD2-CB 3.19Å; E100-C105 WeakPolarHBondContact O-CA 3.15Å; E100-C105 WeakPolarHBondContact O-CB 3.43Å; T101-C105 PolarHBondContact O-SG 2.81Å; G103-C105 PolarHBondContact O-N 2.86Å
106	E	89.8	Confident	91.7	Very high	121 Å²	121	46.6 Å²	46.6	57%	0.565	27%	0.267	S	S	*	.			trans	-70.4	153.3	178.9	-61.8	-168.3	159.9	0	0	111.8	W99 E100 E104 I108	W99-E106 VanDerWaalsContact CA-O 3.3Å; W99-E106 WeakPolarHBondContact CA-O 3.31Å; E100-E106 PolarHBondContact N-O 2.85Å; E104-E106 HydrophobicContact CB-CG 4.19Å; E106-I108 PolarHBondContact O-N 2.75Å
107	N	92	Very high	91.7	Very high	63 Å²	63	47.1 Å²	47.1	34%	0.337	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	108	171.2	177.1	2.9	0	0	0	109.1	L98 W99 A109 T110	L98-N107 CarbonylContact O-C 3.6Å; L98-N107 WeakPolarHBondContact O-CA 3.46Å; L98-N107 PolarHBondContact O-OD1 2.97Å; W99-N107 HydrophobicContact CD2-CB 4.41Å; W99-N107 HydrophobicContact CE3-CB 3.9Å; W99-N107 HydrophobicContact CH2-CB 4.44Å; W99-N107 HydrophobicContact CZ3-CB 3.91Å; N107-A109 PolarHBondContact OD1-N 2.92Å; N107-A109 PolarHBondContact OD1-O 2.97Å; N107-T110 PolarHBondContact ND2-OG1 2.69Å
108	I	92.1	Very high	91.8	Very high	106 Å²	106	46.8 Å²	46.8	54%	0.544	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	-46.2	-179.2	-56.7	169.9	0	0	0	110.3	F86 L98 E100 E106	F86-I108 HydrophobicContact CB-CD1 4.29Å; L98-I108 HydrophobicContact CB-CB 4.46Å; L98-I108 PolarHBondContact O-N 2.85Å; E100-I108 HydrophobicContact CB-CD1 3.96Å; E100-I108 HydrophobicContact CB-CG1 4.17Å; E106-I108 PolarHBondContact O-N 2.75Å
109	A	92.8	Very high	91.8	Very high	21 Å²	21	47.7 Å²	47.7	17%	0.174	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	146.3	-172.3	0	0	0	0	0	112.6	L98 N107 A147	L98-A109 HydrophobicContact CB-CB 4.34Å; L98-A109 HydrophobicContact CD1-CB 4.19Å; L98-A109 PolarHBondContact N-O 2.86Å; L98-A109 PolarHBondContact O-N 2.82Å; N107-A109 PolarHBondContact OD1-N 2.92Å; N107-A109 PolarHBondContact OD1-O 2.97Å; A109-A147 HydrophobicContact CB-CB 3.88Å
110	T	94.1	Very high	91.8	Very high	60 Å²	60	47.7 Å²	47.7	37%	0.368	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	115.4	176.8	-61.9	0	0	0	0	109.9	R95 I96 L97 N107 M112	R95-T110 HydrophobicContact CB-CG2 4.38Å; I96-T110 WeakPolarHBondContact O-CA 3.3Å; L97-T110 HydrophobicContact CD2-CG2 3.66Å; L97-T110 VanDerWaalsContact CD2-OG1 3.3Å; L97-T110 WeakPolarHBondContact CD2-OG1 3.39Å; N107-T110 PolarHBondContact ND2-OG1 2.69Å; T110-M112 HydrophobicContact CG2-CG 4.27Å
111	M	93.7	Very high	91.9	Very high	2 Å²	2	43.3 Å²	43.3	1%	0.01	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	131	178	-56	179.8	-90.5	0	0	110.7	I96 L98 I130 W142 A147	I96-M111 HydrophobicContact CB-CB 4.15Å; I96-M111 HydrophobicContact CB-CE 3.71Å; I96-M111 HydrophobicContact CD1-CB 4.29Å; I96-M111 HydrophobicContact CD1-CE 4.07Å; I96-M111 HydrophobicContact CD1-SD 4.48Å; I96-M111 HydrophobicContact CG2-CE 3.39Å; I96-M111 PolarHBondContact N-O 2.94Å; I96-M111 VanDerWaalsContact N-O 3.07Å; I96-M111 PolarHBondContact O-N 3.28Å; L98-M111 HydrophobicContact CD1-CE 4.03Å; L98-M111 HydrophobicContact CD2-CE 4.07Å; L98-M111 HydrophobicContact CG-CE 3.92Å; M111-I130 HydrophobicContact CE-CD1 3.55Å; M111-W142 HydrophobicContact CB-CD2 4.45Å; M111-W142 HydrophobicContact CB-CE3 3.84Å; M111-W142 HydrophobicContact CB-CZ3 3.92Å; M111-W142 HydrophobicContact CG-CE3 4.27Å; M111-W142 HydrophobicContact SD-CB 3.66Å; M111-W142 HydrophobicContact SD-CD2 4.07Å; M111-W142 HydrophobicContact SD-CE3 3.9Å; M111-W142 HydrophobicContact SD-CG 3.98Å; M111-A147 HydrophobicContact CG-CB 3.9Å; M111-A147 WeakPolarHBondContact CG-O 3.27Å
112	M	92.9	Very high	92.2	Very high	132 Å²	132	44.7 Å²	44.7	65%	0.65	26%	0.263	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.4	143.4	-179.8	-62.8	-172.4	-71.3	0	0	110.9	R95 T110 W142	R95-M112 HydrophobicContact CG-CG 4.2Å; T110-M112 HydrophobicContact CG2-CG 4.27Å; M112-W142 WeakPolarHBondContact O-CH2 3.42Å
113	G	89.7	Confident	92.4	Very high	36 Å²	36	43 Å²	43	37%	0.371	26%	0.257	S	S	.	.			trans	152.1	0.5	173.8	0	0	0	0	0	116.1	R149	G113-R149 PolarHBondContact O-NH1 2.95Å
114	H	91.5	Very high	92.6	Very high	15 Å²	15	41.5 Å²	41.5	7%	0.069	24%	0.241	C	C	.	.			trans	-78.2	141.4	169.6	-82.7	-63.4	0	0	0	111.8	G116 I118 T132 S134 A140 W142	H114-G116 VanDerWaalsContact C-N 3.34Å; H114-I118 HydrophobicContact CB-CG1 4.3Å; H114-I118 VanDerWaalsContact CD2-CD1 3.48Å; H114-I118 WeakPolarHBondContact CD2-CD1 3.44Å; H114-T132 PolarHBondContact CE1-OG1 3.03Å; H114-T132 WeakPolarHBondContact NE2-CB 3.19Å; H114-T132 PolarHBondContact NE2-OG1 2.98Å; H114-S134 WeakPolarHBondContact ND1-CB 3.24Å; H114-A140 WeakPolarHBondContact CE1-CB 3.42Å; H114-W142 AromaticContact CD2-CZ2 3.68Å; H114-W142 AromaticContact NE2-CZ2 3.79Å; H114-W142 AromaticContact NE2-NE1 3.59Å
115	G	92.5	Very high	92.7	Very high	54 Å²	54	37.7 Å²	37.7	56%	0.557	23%	0.23	S	C	*	.	S	Bend	trans	-80.4	-16.1	176.7	0	0	0	0	0	113.8	D136	G115-D136 PolarHBondContact N-OD2 2.9Å; G115-D136 VanDerWaalsContact N-OD2 3.08Å
116	G	94.3	Very high	92.8	Very high	10 Å²	10	41.6 Å²	41.6	10%	0.103	25%	0.251	C	S	.	.	S	Bend	trans	-145.5	178.8	-172	0	0	0	0	0	112	R94 H114 S134	R94-G116 WeakPolarHBondContact CG-O 3.39Å; H114-G116 VanDerWaalsContact C-N 3.34Å; G116-S134 VanDerWaalsContact C-OG 3.31Å; G116-S134 PolarHBondContact O-OG 3.42Å; G116-S134 VanDerWaalsContact O-OG 3.1Å
117	A	95.4	Very high	92.8	Very high	10 Å²	10	36.7 Å²	36.7	8%	0.083	23%	0.228	C	C	.	.			trans	-57.7	145.1	178.8	0	0	0	0	0	110.9	Y76 F92 S134 S135	Y76-A117 HydrophobicContact CE2-CB 4.14Å; F92-A117 HydrophobicContact CD2-CB 3.85Å; F92-A117 HydrophobicContact CE2-CB 4.45Å; F92-A117 HydrophobicContact CG-CB 4.47Å; A117-S134 CarbonylContact O-C 3.55Å; A117-S134 WeakPolarHBondContact O-CA 3.19Å; A117-S134 WeakPolarHBondContact O-CB 3.46Å; A117-S134 PolarHBondContact O-OG 3.31Å; A117-S135 PolarHBondContact N-OG 2.98Å; A117-S135 PolarHBondContact O-N 3.14Å
118	I	96.5	Very high	92.9	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	113.1	177.5	-57.8	168	0	0	0	106.8	Y76 A90 G91 I96 H114 T132 A133	Y76-I118 WeakPolarHBondContact CD2-O 3.39Å; A90-I118 HydrophobicContact CB-CB 3.88Å; A90-I118 HydrophobicContact CB-CD1 3.91Å; A90-I118 HydrophobicContact CB-CG2 3.62Å; G91-I118 PolarHBondContact O-N 2.66Å; I96-I118 HydrophobicContact CD1-CD1 4.25Å; I96-I118 HydrophobicContact CG1-CD1 3.49Å; I96-I118 VanDerWaalsContact CG1-CD1 3.49Å; H114-I118 HydrophobicContact CB-CG1 4.3Å; H114-I118 VanDerWaalsContact CD2-CD1 3.48Å; H114-I118 WeakPolarHBondContact CD2-CD1 3.44Å; I118-T132 HydrophobicContact CG2-CG2 4.03Å; I118-A133 CarbonylContact C-O 3.57Å; I118-A133 WeakPolarHBondContact CA-O 3.46Å
119	L	95.6	Very high	92.9	Very high	27 Å²	27	30.3 Å²	30.3	14%	0.141	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	-23.6	-173	-62.3	-179.2	0	0	0	112.7	Y76 A133 I159	Y76-L119 HydrophobicContact CD2-CD2 3.95Å; Y76-L119 HydrophobicContact CE2-CD2 4.09Å; L119-A133 PolarHBondContact N-O 3.48Å; L119-I159 HydrophobicContact CD1-CG2 3.41Å; L119-I159 VanDerWaalsContact CD1-CG2 3.41Å
120	D	95.9	Very high	93.1	Very high	9 Å²	9	29.3 Å²	29.3	5%	0.048	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	148.8	-179.5	-158.6	3.8	0	0	0	110.9	T132 A133 S162 C163 R296	D120-T132 WeakPolarHBondContact O-CA 3.43Å; D120-A133 HydrophobicContact CB-CB 4.04Å; D120-A133 PolarHBondContact O-N 2.73Å; D120-S162 WeakPolarHBondContact OD2-CA 3.46Å; D120-S162 VanDerWaalsContact OD2-CB 3.29Å; D120-S162 WeakPolarHBondContact OD2-CB 3.46Å; D120-C163 PolarHBondContact OD2-N 3.39Å; D120-R296 IonicContact OD2-NH2 2.75Å
121	L	95.4	Very high	93.1	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	130.3	-178.1	-177.1	150	0	0	0	109.1	C77 K79 A88 A90 I96 I130 Y131 T132	C77-L121 HydrophobicContact CB-CB 4.16Å; C77-L121 WeakPolarHBondContact SG-CB 3.45Å; K79-L121 HydrophobicContact CB-CD2 4.05Å; K79-L121 HydrophobicContact CG-CD2 4.06Å; K79-L121 VanDerWaalsContact CG-O 3.28Å; K79-L121 WeakPolarHBondContact CG-O 3.3Å; A88-L121 HydrophobicContact CB-CD1 4Å; A88-L121 HydrophobicContact CB-CD2 3.71Å; A90-L121 HydrophobicContact CB-CD1 3.9Å; I96-L121 HydrophobicContact CG2-CD1 3.55Å; L121-I130 HydrophobicContact CD1-CG2 3.94Å; L121-I130 HydrophobicContact CD2-CG2 4.21Å; L121-I130 HydrophobicContact CG-CG2 3.8Å; L121-Y131 WeakPolarHBondContact CA-O 3.4Å; L121-T132 HydrophobicContact CB-CG2 4.37Å; L121-T132 HydrophobicContact CD1-CG2 3.98Å; L121-T132 HydrophobicContact CG-CG2 4.09Å
122	V	94.9	Very high	93.3	Very high	29 Å²	29	26.4 Å²	26.4	18%	0.176	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	132.2	178.2	-179.8	0	0	0	0	110.2	Y131 C163 V165	V122-Y131 PolarHBondContact N-O 3.37Å; V122-Y131 PolarHBondContact O-N 3.39Å; V122-C163 WeakPolarHBondContact CG2-O 3.49Å; V122-V165 HydrophobicContact CB-CG2 4.2Å; V122-V165 HydrophobicContact CG1-CB 4.09Å; V122-V165 HydrophobicContact CG1-CG2 3.62Å
123	L	93.4	Very high	93.4	Very high	22 Å²	22	20.1 Å²	20.1	12%	0.115	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	146.3	172.9	-76.3	150.1	0	0	0	110.3	K79 F80 F86 A88 I130 T144	K79-L123 HydrophobicContact CB-CD1 4Å; F80-L123 WeakPolarHBondContact O-CD1 3.2Å; F86-L123 HydrophobicContact CE2-CD2 3.93Å; F86-L123 HydrophobicContact CZ-CD2 4.21Å; A88-L123 HydrophobicContact CB-CD1 4.42Å; L123-I130 HydrophobicContact CD2-CD1 3.95Å; L123-I130 HydrophobicContact CD2-CG1 3.3Å; L123-I130 HydrophobicContact CG-CG1 4.06Å; L123-T144 HydrophobicContact CD2-CG2 4.22Å
124	S	92.1	Very high	93.7	Very high	4 Å²	4	18.4 Å²	18.4	3%	0.028	12%	0.123	C	C	.	.			trans	-69.1	160.7	167.2	59.4	0	0	0	0	110.8	D126 D127 V129	S124-D126 WeakPolarHBondContact CB-OD1 3.45Å; S124-D126 PolarHBondContact O-N 3.33Å; S124-D126 PolarHBondContact OG-OD1 3.15Å; S124-D127 PolarHBondContact O-N 3.13Å; S124-V129 PolarHBondContact N-O 2.79Å; S124-V129 PolarHBondContact OG-N 3.37Å; S124-V129 VanDerWaalsContact OG-N 3.14Å; S124-V129 PolarHBondContact OG-O 2.74Å
125	S	86.9	Confident	93.9	Very high	65 Å²	65	19.3 Å²	19.3	46%	0.455	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-15.3	-178.5	50	0	0	0	0	114.7
126	D	87.8	Confident	94	Very high	88 Å²	88	18.4 Å²	18.4	47%	0.471	11%	0.114	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.4	4.7	174.3	63.8	-28.8	0	0	0	112.7	S124 S128	S124-D126 WeakPolarHBondContact CB-OD1 3.45Å; S124-D126 PolarHBondContact O-N 3.33Å; S124-D126 PolarHBondContact OG-OD1 3.15Å; D126-S128 PolarHBondContact O-N 3.21Å; D126-S128 PolarHBondContact OD1-OG 2.95Å; D126-S128 PolarHBondContact OD2-OG 3.1Å
127	D	90.3	Very high	94.1	Very high	17 Å²	17	22.7 Å²	22.7	9%	0.091	13%	0.129	C	C	.	.	S	Bend	trans	56.8	3.1	-179.6	-62.7	-37.9	0	0	0	116.4	S81 S82 D83 F86 S124 V129 T144	S81-D127 WeakPolarHBondContact CA-OD1 3.49Å; S82-D127 WeakPolarHBondContact CA-OD2 3.13Å; S82-D127 VanDerWaalsContact CB-OD2 3.26Å; S82-D127 WeakPolarHBondContact CB-OD2 3.42Å; S82-D127 PolarHBondContact N-OD1 2.86Å; S82-D127 PolarHBondContact N-OD2 3.47Å; S82-D127 VanDerWaalsContact OG-CG 3.3Å; S82-D127 PolarHBondContact OG-OD2 2.96Å; D83-D127 PolarHBondContact N-OD2 3.11Å; F86-D127 HydrophobicContact CE1-CB 4.11Å; F86-D127 HydrophobicContact CZ-CB 3.91Å; S124-D127 PolarHBondContact O-N 3.13Å; D127-V129 VanDerWaalsContact C-N 3.32Å; D127-V129 PolarHBondContact O-N 2.58Å; D127-T144 WeakPolarHBondContact O-CB 3.21Å; D127-T144 WeakPolarHBondContact O-CG2 3.29Å; D127-T144 PolarHBondContact O-OG1 2.77Å
128	S	92.3	Very high	94.1	Very high	31 Å²	31	22.3 Å²	22.3	22%	0.217	13%	0.126	C	C	.	.	S	Bend	trans	-74	-23.6	-179.4	70.4	0	0	0	0	113	D126 T144	D126-S128 PolarHBondContact O-N 3.21Å; D126-S128 PolarHBondContact OD1-OG 2.95Å; D126-S128 PolarHBondContact OD2-OG 3.1Å; S128-T144 VanDerWaalsContact C-OG1 3.24Å; S128-T144 WeakPolarHBondContact CA-OG1 3.44Å; S128-T144 PolarHBondContact O-N 2.87Å; S128-T144 PolarHBondContact O-OG1 2.84Å
129	V	93.9	Very high	94	Very high	4 Å²	4	22.3 Å²	22.3	2%	0.024	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	136.8	-172	172.4	0	0	0	0	111.6	S124 D127 Y131 L141 W142 I150	S124-V129 PolarHBondContact N-O 2.79Å; S124-V129 PolarHBondContact OG-N 3.37Å; S124-V129 VanDerWaalsContact OG-N 3.14Å; S124-V129 PolarHBondContact OG-O 2.74Å; D127-V129 VanDerWaalsContact C-N 3.32Å; D127-V129 PolarHBondContact O-N 2.58Å; V129-Y131 HydrophobicContact CB-CE2 4.38Å; V129-Y131 HydrophobicContact CG1-CD2 4.08Å; V129-Y131 HydrophobicContact CG1-CE1 4.24Å; V129-Y131 HydrophobicContact CG1-CE2 3.59Å; V129-L141 HydrophobicContact CB-CD2 4.47Å; V129-L141 HydrophobicContact CG1-CD1 4.23Å; V129-L141 HydrophobicContact CG1-CD2 3.41Å; V129-L141 VanDerWaalsContact CG1-CD2 3.41Å; V129-L141 HydrophobicContact CG1-CG 3.49Å; V129-L141 VanDerWaalsContact CG1-CG 3.49Å; V129-L141 HydrophobicContact CG2-CD2 4.15Å; V129-W142 CarbonylContact C-O 3.59Å; V129-W142 VanDerWaalsContact CA-O 3.26Å; V129-W142 WeakPolarHBondContact CA-O 3.26Å; V129-W142 WeakPolarHBondContact CG1-O 3.42Å; V129-I150 HydrophobicContact CG2-CD1 4.46Å
130	I	95.4	Very high	94	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	132	169.7	-68.1	163.6	0	0	0	110.2	A88 L98 M111 L121 L123 T132 L141 W142 T144	A88-I130 HydrophobicContact CB-CD1 3.97Å; L98-I130 HydrophobicContact CD2-CD1 3.69Å; M111-I130 HydrophobicContact CE-CD1 3.55Å; L121-I130 HydrophobicContact CD1-CG2 3.94Å; L121-I130 HydrophobicContact CD2-CG2 4.21Å; L121-I130 HydrophobicContact CG-CG2 3.8Å; L123-I130 HydrophobicContact CD2-CD1 3.95Å; L123-I130 HydrophobicContact CD2-CG1 3.3Å; L123-I130 HydrophobicContact CG-CG1 4.06Å; I130-T132 HydrophobicContact CG2-CG2 3.83Å; I130-L141 WeakPolarHBondContact O-CA 3.1Å; I130-W142 HydrophobicContact CB-CB 4.24Å; I130-W142 PolarHBondContact N-O 3.2Å; I130-W142 PolarHBondContact O-N 2.95Å; I130-T144 HydrophobicContact CD1-CG2 3.54Å; I130-T144 HydrophobicContact CG1-CG2 3.54Å
131	Y	95.4	Very high	93.9	Very high	1 Å²	1	20.7 Å²	20.7	0%	0.004	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	138	167.9	-61.4	-87.6	0	0	0	109.6	L121 V122 V129 A140 L141 F153 V165 V173	L121-Y131 WeakPolarHBondContact CA-O 3.4Å; V122-Y131 PolarHBondContact N-O 3.37Å; V122-Y131 PolarHBondContact O-N 3.39Å; V129-Y131 HydrophobicContact CB-CE2 4.38Å; V129-Y131 HydrophobicContact CG1-CD2 4.08Å; V129-Y131 HydrophobicContact CG1-CE1 4.24Å; V129-Y131 HydrophobicContact CG1-CE2 3.59Å; Y131-A140 WeakPolarHBondContact CA-O 3.49Å; Y131-L141 HydrophobicContact CD1-CB 4.38Å; Y131-L141 HydrophobicContact CD1-CD1 4.33Å; Y131-L141 HydrophobicContact CD1-CG 4.15Å; Y131-L141 HydrophobicContact CE1-CB 4.25Å; Y131-L141 HydrophobicContact CE1-CD1 3.41Å; Y131-L141 VanDerWaalsContact CE1-CD1 3.41Å; Y131-L141 HydrophobicContact CE1-CG 3.64Å; Y131-F153 HydrophobicContact CE1-CE2 4.41Å; Y131-V165 HydrophobicContact CD2-CG2 3.26Å; Y131-V165 HydrophobicContact CE2-CG1 4.18Å; Y131-V165 HydrophobicContact CE2-CG2 3.66Å; Y131-V165 HydrophobicContact CG-CG2 3.9Å; Y131-V173 HydrophobicContact CD1-CG1 4.19Å; Y131-V173 HydrophobicContact CD1-CG2 3.6Å; Y131-V173 HydrophobicContact CE1-CG2 3.26Å; Y131-V173 HydrophobicContact CE2-CG2 4.24Å; Y131-V173 HydrophobicContact CG-CG2 4.2Å
132	T	96.5	Very high	93.9	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	132.4	-179.4	44.5	0	0	0	0	110.7	I96 H114 I118 D120 L121 I130 I139 A140 W142	I96-T132 HydrophobicContact CD1-CG2 3.44Å; I96-T132 VanDerWaalsContact CD1-CG2 3.44Å; I96-T132 HydrophobicContact CG1-CG2 4.07Å; H114-T132 PolarHBondContact CE1-OG1 3.03Å; H114-T132 WeakPolarHBondContact NE2-CB 3.19Å; H114-T132 PolarHBondContact NE2-OG1 2.98Å; I118-T132 HydrophobicContact CG2-CG2 4.03Å; D120-T132 WeakPolarHBondContact O-CA 3.43Å; L121-T132 HydrophobicContact CB-CG2 4.37Å; L121-T132 HydrophobicContact CD1-CG2 3.98Å; L121-T132 HydrophobicContact CG-CG2 4.09Å; I130-T132 HydrophobicContact CG2-CG2 3.83Å; T132-I139 CarbonylContact O-C 3.51Å; T132-I139 VanDerWaalsContact O-CA 3.22Å; T132-I139 WeakPolarHBondContact O-CA 3.32Å; T132-I139 WeakPolarHBondContact O-CG2 3.38Å; T132-A140 PolarHBondContact N-O 2.85Å; T132-A140 PolarHBondContact O-N 3.01Å; T132-A140 PolarHBondContact OG1-O 2.96Å; T132-W142 PolarHBondContact OG1-NE1 2.94Å
133	A	96	Very high	93.9	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	130.5	172.9	0	0	0	0	0	109.8	I118 L119 D120 V160 C163	I118-A133 CarbonylContact C-O 3.57Å; I118-A133 WeakPolarHBondContact CA-O 3.46Å; L119-A133 PolarHBondContact N-O 3.48Å; D120-A133 HydrophobicContact CB-CB 4.04Å; D120-A133 PolarHBondContact O-N 2.73Å; A133-V160 HydrophobicContact CB-CB 4.14Å; A133-V160 HydrophobicContact CB-CG1 3.7Å; A133-C163 HydrophobicContact CB-CB 4.08Å
134	S	96.5	Very high	93.9	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	154.7	-177.2	-179.4	0	0	0	0	112.9	H114 G116 A117 D136 K137 S138 V160	H114-S134 WeakPolarHBondContact ND1-CB 3.24Å; G116-S134 VanDerWaalsContact C-OG 3.31Å; G116-S134 PolarHBondContact O-OG 3.42Å; G116-S134 VanDerWaalsContact O-OG 3.1Å; A117-S134 CarbonylContact O-C 3.55Å; A117-S134 WeakPolarHBondContact O-CA 3.19Å; A117-S134 WeakPolarHBondContact O-CB 3.46Å; A117-S134 PolarHBondContact O-OG 3.31Å; S134-D136 WeakPolarHBondContact CB-OD1 3.23Å; S134-D136 PolarHBondContact O-N 2.64Å; S134-D136 PolarHBondContact OG-N 3.44Å; S134-D136 PolarHBondContact OG-OD1 3.16Å; S134-K137 PolarHBondContact O-N 2.79Å; S134-S138 PolarHBondContact N-O 2.55Å; S134-S138 VanDerWaalsContact N-O 3.15Å; S134-V160 PolarHBondContact O-N 3.11Å
135	S	95.6	Very high	93.8	Very high	34 Å²	34	29.3 Å²	29.3	24%	0.238	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-8.6	169.2	69.1	0	0	0	0	114.1	A117 K137	A117-S135 PolarHBondContact N-OG 2.98Å; A117-S135 PolarHBondContact O-N 3.14Å; S135-K137 PolarHBondContact O-N 2.55Å; S135-K137 VanDerWaalsContact O-N 3.15Å
136	D	94.9	Very high	94.1	Very high	36 Å²	36	28.8 Å²	28.8	19%	0.193	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76	13	170.3	84	-12.2	0	0	0	114.3	G115 S134 S138 K152	G115-D136 PolarHBondContact N-OD2 2.9Å; G115-D136 VanDerWaalsContact N-OD2 3.08Å; S134-D136 WeakPolarHBondContact CB-OD1 3.23Å; S134-D136 PolarHBondContact O-N 2.64Å; S134-D136 PolarHBondContact OG-N 3.44Å; S134-D136 PolarHBondContact OG-OD1 3.16Å; D136-S138 VanDerWaalsContact CG-OG 3.26Å; D136-S138 PolarHBondContact O-N 3.05Å; D136-S138 VanDerWaalsContact OD1-CB 3.29Å; D136-S138 WeakPolarHBondContact OD1-CB 3.48Å; D136-S138 PolarHBondContact OD1-N 3.22Å; D136-S138 VanDerWaalsContact OD1-N 3.13Å; D136-S138 PolarHBondContact OD1-OG 3.4Å; D136-S138 PolarHBondContact OD2-OG 3.28Å; D136-K152 IonicContact OD2-NZ 3.92Å; D136-K152 PolarHBondContact OD2-NZ 3.23Å
137	K	95.2	Very high	94.3	Very high	99 Å²	99	25.9 Å²	25.9	43%	0.43	14%	0.142	S	C	.	.	S	Bend	trans	68.8	19.1	176.9	-42.2	177.8	173.8	-163.4	0	113.7	S134 S135 E157 N158	S134-K137 PolarHBondContact O-N 2.79Å; S135-K137 PolarHBondContact O-N 2.55Å; S135-K137 VanDerWaalsContact O-N 3.15Å; K137-E157 WeakPolarHBondContact CD-O 3.44Å; K137-E157 WeakPolarHBondContact CE-O 3.12Å; K137-E157 PolarHBondContact NZ-O 3.41Å; K137-N158 WeakPolarHBondContact CA-O 3.4Å; K137-N158 WeakPolarHBondContact CB-O 3.23Å; K137-N158 WeakPolarHBondContact CG-O 3.4Å
138	S	94.7	Very high	94.5	Very high	2 Å²	2	31.6 Å²	31.6	1%	0.014	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	158.5	-176.5	83.4	0	0	0	0	112.3	S134 D136 K152 F153	S134-S138 PolarHBondContact N-O 2.55Å; S134-S138 VanDerWaalsContact N-O 3.15Å; D136-S138 VanDerWaalsContact CG-OG 3.26Å; D136-S138 PolarHBondContact O-N 3.05Å; D136-S138 VanDerWaalsContact OD1-CB 3.29Å; D136-S138 WeakPolarHBondContact OD1-CB 3.48Å; D136-S138 PolarHBondContact OD1-N 3.22Å; D136-S138 VanDerWaalsContact OD1-N 3.13Å; D136-S138 PolarHBondContact OD1-OG 3.4Å; D136-S138 PolarHBondContact OD2-OG 3.28Å; S138-K152 WeakPolarHBondContact OG-CE 3.34Å; S138-F153 WeakPolarHBondContact CA-O 3.41Å; S138-F153 WeakPolarHBondContact CB-O 3.25Å
139	I	95.2	Very high	94.5	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	132.7	167.9	-58.6	132.4	0	0	0	106.7	T132 K152 F153 V160 S175 W185	T132-I139 CarbonylContact O-C 3.51Å; T132-I139 VanDerWaalsContact O-CA 3.22Å; T132-I139 WeakPolarHBondContact O-CA 3.32Å; T132-I139 WeakPolarHBondContact O-CG2 3.38Å; I139-K152 CarbonylContact O-C 3.6Å; I139-F153 HydrophobicContact CB-CB 4.2Å; I139-F153 HydrophobicContact CB-CD2 4.13Å; I139-F153 HydrophobicContact CG2-CD2 4.07Å; I139-F153 PolarHBondContact N-O 2.73Å; I139-F153 PolarHBondContact O-N 3Å; I139-V160 HydrophobicContact CD1-CG1 4.28Å; I139-V160 HydrophobicContact CG1-CG1 3.97Å; I139-V160 HydrophobicContact CG1-CG2 4.49Å; I139-S175 WeakPolarHBondContact CD1-OG 3.26Å; I139-W185 HydrophobicContact CD1-CZ2 4.43Å
140	A	95.1	Very high	94.5	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	142.9	175.3	0	0	0	0	0	110.6	H114 Y131 T132 W142 R149 K151	H114-A140 WeakPolarHBondContact CE1-CB 3.42Å; Y131-A140 WeakPolarHBondContact CA-O 3.49Å; T132-A140 PolarHBondContact N-O 2.85Å; T132-A140 PolarHBondContact O-N 3.01Å; T132-A140 PolarHBondContact OG1-O 2.96Å; A140-W142 HydrophobicContact CB-CZ2 3.94Å; A140-W142 VanDerWaalsContact CB-NE1 3.31Å; A140-R149 HydrophobicContact CB-CG 4.31Å; A140-K151 WeakPolarHBondContact CA-O 3.22Å
141	L	95.1	Very high	94.4	Very high	2 Å²	2	41.9 Å²	41.9	1%	0.01	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	122.8	174.4	-166.2	161	0	0	0	107.1	V129 I130 Y131 I150 K151 F153 R187	V129-L141 HydrophobicContact CB-CD2 4.47Å; V129-L141 HydrophobicContact CG1-CD1 4.23Å; V129-L141 HydrophobicContact CG1-CD2 3.41Å; V129-L141 VanDerWaalsContact CG1-CD2 3.41Å; V129-L141 HydrophobicContact CG1-CG 3.49Å; V129-L141 VanDerWaalsContact CG1-CG 3.49Å; V129-L141 HydrophobicContact CG2-CD2 4.15Å; I130-L141 WeakPolarHBondContact O-CA 3.1Å; Y131-L141 HydrophobicContact CD1-CB 4.38Å; Y131-L141 HydrophobicContact CD1-CD1 4.33Å; Y131-L141 HydrophobicContact CD1-CG 4.15Å; Y131-L141 HydrophobicContact CE1-CB 4.25Å; Y131-L141 HydrophobicContact CE1-CD1 3.41Å; Y131-L141 VanDerWaalsContact CE1-CD1 3.41Å; Y131-L141 HydrophobicContact CE1-CG 3.64Å; L141-I150 HydrophobicContact CD2-CB 3.6Å; L141-I150 HydrophobicContact CD2-CD1 3.37Å; L141-I150 HydrophobicContact CD2-CG1 3.99Å; L141-I150 HydrophobicContact CD2-CG2 4Å; L141-I150 PolarHBondContact O-N 2.94Å; L141-K151 HydrophobicContact CB-CB 4.02Å; L141-K151 PolarHBondContact N-O 3.48Å; L141-K151 PolarHBondContact O-N 2.86Å; L141-F153 HydrophobicContact CB-CE2 4.16Å; L141-F153 HydrophobicContact CD1-CE2 4.2Å; L141-F153 HydrophobicContact CD1-CZ 4.27Å; L141-R187 HydrophobicContact CD1-CG 3.89Å
142	W	95.2	Very high	94.2	Very high	4 Å²	4	44.7 Å²	44.7	2%	0.015	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	143.6	-177.6	-53.9	85.7	0	0	0	109.9	I96 M111 M112 H114 V129 I130 T132 A140 Q148 R149	I96-W142 HydrophobicContact CD1-CD2 4.07Å; I96-W142 HydrophobicContact CD1-CG 4.16Å; I96-W142 HydrophobicContact CD1-CZ2 4.27Å; M111-W142 HydrophobicContact CB-CD2 4.45Å; M111-W142 HydrophobicContact CB-CE3 3.84Å; M111-W142 HydrophobicContact CB-CZ3 3.92Å; M111-W142 HydrophobicContact CG-CE3 4.27Å; M111-W142 HydrophobicContact SD-CB 3.66Å; M111-W142 HydrophobicContact SD-CD2 4.07Å; M111-W142 HydrophobicContact SD-CE3 3.9Å; M111-W142 HydrophobicContact SD-CG 3.98Å; M112-W142 WeakPolarHBondContact O-CH2 3.42Å; H114-W142 AromaticContact CD2-CZ2 3.68Å; H114-W142 AromaticContact NE2-CZ2 3.79Å; H114-W142 AromaticContact NE2-NE1 3.59Å; V129-W142 CarbonylContact C-O 3.59Å; V129-W142 VanDerWaalsContact CA-O 3.26Å; V129-W142 WeakPolarHBondContact CA-O 3.26Å; V129-W142 WeakPolarHBondContact CG1-O 3.42Å; I130-W142 HydrophobicContact CB-CB 4.24Å; I130-W142 PolarHBondContact N-O 3.2Å; I130-W142 PolarHBondContact O-N 2.95Å; T132-W142 PolarHBondContact OG1-NE1 2.94Å; A140-W142 HydrophobicContact CB-CZ2 3.94Å; A140-W142 VanDerWaalsContact CB-NE1 3.31Å; W142-Q148 WeakPolarHBondContact CA-O 3.46Å; W142-R149 HydrophobicContact CD2-CB 4.15Å; W142-R149 HydrophobicContact CD2-CG 4.3Å; W142-R149 HydrophobicContact CE3-CB 3.64Å; W142-R149 HydrophobicContact CE3-CG 4.28Å; W142-R149 HydrophobicContact CH2-CB 3.83Å; W142-R149 HydrophobicContact CH2-CG 4.19Å; W142-R149 HydrophobicContact CZ2-CB 4.32Å; W142-R149 HydrophobicContact CZ2-CG 4.21Å; W142-R149 HydrophobicContact CZ3-CB 3.49Å; W142-R149 VanDerWaalsContact CZ3-CB 3.49Å; W142-R149 HydrophobicContact CZ3-CG 4.25Å
143	D	94.8	Very high	94.1	Very high	39 Å²	39	44.9 Å²	44.9	21%	0.209	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	130.4	168.8	-167	26	0	0	0	108.9	S146 A147 Q148 I150	D143-S146 VanDerWaalsContact CB-OG 3.27Å; D143-S146 WeakPolarHBondContact CB-OG 3.46Å; D143-S146 VanDerWaalsContact OD2-CB 3.28Å; D143-S146 WeakPolarHBondContact OD2-CB 3.16Å; D143-S146 PolarHBondContact OD2-N 2.9Å; D143-S146 PolarHBondContact OD2-OG 3.13Å; D143-A147 VanDerWaalsContact O-CA 3.27Å; D143-A147 WeakPolarHBondContact O-CA 3.42Å; D143-A147 PolarHBondContact O-N 2.86Å; D143-A147 VanDerWaalsContact O-N 3.09Å; D143-Q148 PolarHBondContact N-O 2.9Å; D143-I150 HydrophobicContact CB-CD1 3.58Å; D143-I150 HydrophobicContact CB-CG1 3.86Å
144	T	92.4	Very high	93.9	Very high	18 Å²	18	54.1 Å²	54.1	11%	0.11	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-40.3	-178.6	52.1	0	0	0	0	112	F86 L123 D127 S128 I130	F86-T144 HydrophobicContact CZ-CG2 4.39Å; L123-T144 HydrophobicContact CD2-CG2 4.22Å; D127-T144 WeakPolarHBondContact O-CB 3.21Å; D127-T144 WeakPolarHBondContact O-CG2 3.29Å; D127-T144 PolarHBondContact O-OG1 2.77Å; S128-T144 VanDerWaalsContact C-OG1 3.24Å; S128-T144 WeakPolarHBondContact CA-OG1 3.44Å; S128-T144 PolarHBondContact O-N 2.87Å; S128-T144 PolarHBondContact O-OG1 2.84Å; I130-T144 HydrophobicContact CD1-CG2 3.54Å; I130-T144 HydrophobicContact CG1-CG2 3.54Å
145	E	91.5	Very high	93.6	Very high	175 Å²	175	55.5 Å²	55.5	82%	0.818	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-48	-177.9	-64.3	-174.9	172	0	0	112.4
146	S	92.6	Very high	93.5	Very high	54 Å²	54	54.4 Å²	54.4	38%	0.378	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-9.8	179.7	69.3	0	0	0	0	114	D143 Q148	D143-S146 VanDerWaalsContact CB-OG 3.27Å; D143-S146 WeakPolarHBondContact CB-OG 3.46Å; D143-S146 VanDerWaalsContact OD2-CB 3.28Å; D143-S146 WeakPolarHBondContact OD2-CB 3.16Å; D143-S146 PolarHBondContact OD2-N 2.9Å; D143-S146 PolarHBondContact OD2-OG 3.13Å; S146-Q148 WeakPolarHBondContact O-CG 3.33Å; S146-Q148 PolarHBondContact O-N 3.25Å; S146-Q148 VanDerWaalsContact O-N 3.16Å
147	A	92.1	Very high	93.5	Very high	27 Å²	27	59.8 Å²	59.8	22%	0.223	29%	0.286	C	S	.	.			trans	53.3	28.4	-174.1	0	0	0	0	0	113.7	A109 M111 D143	A109-A147 HydrophobicContact CB-CB 3.88Å; M111-A147 HydrophobicContact CG-CB 3.9Å; M111-A147 WeakPolarHBondContact CG-O 3.27Å; D143-A147 VanDerWaalsContact O-CA 3.27Å; D143-A147 WeakPolarHBondContact O-CA 3.42Å; D143-A147 PolarHBondContact O-N 2.86Å; D143-A147 VanDerWaalsContact O-N 3.09Å
148	Q	93.4	Very high	93.5	Very high	137 Å²	137	58 Å²	58	64%	0.64	28%	0.281	S	S	*	.			trans	-110.9	149.9	-178.1	-70.9	-178.2	21.6	0	0	112.5	W142 D143 S146 I150	W142-Q148 WeakPolarHBondContact CA-O 3.46Å; D143-Q148 PolarHBondContact N-O 2.9Å; S146-Q148 WeakPolarHBondContact O-CG 3.33Å; S146-Q148 PolarHBondContact O-N 3.25Å; S146-Q148 VanDerWaalsContact O-N 3.16Å; Q148-I150 PolarHBondContact O-N 2.87Å
149	R	93.5	Very high	93.6	Very high	115 Å²	115	58.9 Å²	58.9	43%	0.434	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	112.4	173.6	-168	179.3	63.4	-159	-6.4	110.2	G113 A140 W142	G113-R149 PolarHBondContact O-NH1 2.95Å; A140-R149 HydrophobicContact CB-CG 4.31Å; W142-R149 HydrophobicContact CD2-CB 4.15Å; W142-R149 HydrophobicContact CD2-CG 4.3Å; W142-R149 HydrophobicContact CE3-CB 3.64Å; W142-R149 HydrophobicContact CE3-CG 4.28Å; W142-R149 HydrophobicContact CH2-CB 3.83Å; W142-R149 HydrophobicContact CH2-CG 4.19Å; W142-R149 HydrophobicContact CZ2-CB 4.32Å; W142-R149 HydrophobicContact CZ2-CG 4.21Å; W142-R149 HydrophobicContact CZ3-CB 3.49Å; W142-R149 VanDerWaalsContact CZ3-CB 3.49Å; W142-R149 HydrophobicContact CZ3-CG 4.25Å
150	I	93.3	Very high	93.6	Very high	97 Å²	97	58.9 Å²	58.9	50%	0.497	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	-48.6	174.3	-62.3	165.6	0	0	0	110.6	V129 L141 D143 Q148	V129-I150 HydrophobicContact CG2-CD1 4.46Å; L141-I150 HydrophobicContact CD2-CB 3.6Å; L141-I150 HydrophobicContact CD2-CD1 3.37Å; L141-I150 HydrophobicContact CD2-CG1 3.99Å; L141-I150 HydrophobicContact CD2-CG2 4Å; L141-I150 PolarHBondContact O-N 2.94Å; D143-I150 HydrophobicContact CB-CD1 3.58Å; D143-I150 HydrophobicContact CB-CG1 3.86Å; Q148-I150 PolarHBondContact O-N 2.87Å
151	K	92.6	Very high	93.7	Very high	40 Å²	40	59.3 Å²	59.3	17%	0.174	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	150.7	-170.7	-164.6	175.4	178.6	-172.6	0	112.3	A140 L141 F153 R187 Q189	A140-K151 WeakPolarHBondContact CA-O 3.22Å; L141-K151 HydrophobicContact CB-CB 4.02Å; L141-K151 PolarHBondContact N-O 3.48Å; L141-K151 PolarHBondContact O-N 2.86Å; K151-F153 HydrophobicContact CD-CD1 4.47Å; K151-F153 HydrophobicContact CD-CE1 3.87Å; K151-F153 HydrophobicContact CD-CZ 3.9Å; K151-R187 PolarHBondContact NZ-O 2.88Å; K151-Q189 PolarHBondContact NZ-O 3.29Å
152	K	92.9	Very high	93.7	Very high	60 Å²	60	59.2 Å²	59.2	26%	0.261	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	114.5	171.7	-170.7	171.8	-168.4	168.8	0	108.9	D136 S138 I139 R154	D136-K152 IonicContact OD2-NZ 3.92Å; D136-K152 PolarHBondContact OD2-NZ 3.23Å; S138-K152 WeakPolarHBondContact OG-CE 3.34Å; I139-K152 CarbonylContact O-C 3.6Å; K152-R154 HydrophobicContact CG-CG 4.39Å
153	F	93.2	Very high	93.7	Very high	3 Å²	3	59 Å²	59	1%	0.013	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	121.9	173	-59.4	-79.7	0	0	0	109.1	Y131 S138 I139 L141 K151 W185	Y131-F153 HydrophobicContact CE1-CE2 4.41Å; S138-F153 WeakPolarHBondContact CA-O 3.41Å; S138-F153 WeakPolarHBondContact CB-O 3.25Å; I139-F153 HydrophobicContact CB-CB 4.2Å; I139-F153 HydrophobicContact CB-CD2 4.13Å; I139-F153 HydrophobicContact CG2-CD2 4.07Å; I139-F153 PolarHBondContact N-O 2.73Å; I139-F153 PolarHBondContact O-N 3Å; L141-F153 HydrophobicContact CB-CE2 4.16Å; L141-F153 HydrophobicContact CD1-CE2 4.2Å; L141-F153 HydrophobicContact CD1-CZ 4.27Å; K151-F153 HydrophobicContact CD-CD1 4.47Å; K151-F153 HydrophobicContact CD-CE1 3.87Å; K151-F153 HydrophobicContact CD-CZ 3.9Å; F153-W185 HydrophobicContact CB-CD2 4.17Å; F153-W185 HydrophobicContact CB-CE3 4.06Å; F153-W185 HydrophobicContact CB-CH2 4.39Å; F153-W185 HydrophobicContact CB-CZ3 4.17Å; F153-W185 HydrophobicContact CD1-CB 4.29Å; F153-W185 HydrophobicContact CD1-CD2 4.08Å; F153-W185 AromaticContact CD1-CE3 3.66Å; F153-W185 HydrophobicContact CD1-CE3 3.66Å; F153-W185 HydrophobicContact CD1-CG 4.36Å; F153-W185 HydrophobicContact CD1-CZ3 4.32Å; F153-W185 HydrophobicContact CE1-CB 4.18Å; F153-W185 HydrophobicContact CE1-CE3 4.47Å; F153-W185 HydrophobicContact CG-CD2 4.28Å; F153-W185 HydrophobicContact CG-CE3 4.18Å
154	R	92.4	Very high	93.7	Very high	194 Å²	194	57.7 Å²	57.7	73%	0.732	28%	0.281	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.9	133.1	176.2	-63.3	-176.2	-175.7	-175.2	0.4	108.4	K152	K152-R154 HydrophobicContact CG-CG 4.39Å
155	G	90.2	Very high	93.7	Very high	29 Å²	29	57.6 Å²	57.6	30%	0.299	28%	0.28	S	S	.	.			trans	175.1	-30.5	172.5	0	0	0	0	0	113.8	R183	G155-R183 VanDerWaalsContact CA-NH1 3.26Å; G155-R183 PolarHBondContact O-NH1 2.91Å; G155-R183 PolarHBondContact O-NH2 2.82Å
156	H	93.9	Very high	93.8	Very high	12 Å²	12	49.3 Å²	49.3	6%	0.056	24%	0.242	C	C	.	.			trans	-63.3	142.9	174.1	-75.9	-67.2	0	0	0	111.7	V160 S175 S177 D179 T181	H156-V160 HydrophobicContact CB-CG2 3.92Å; H156-S175 PolarHBondContact NE2-OG 2.77Å; H156-S177 WeakPolarHBondContact ND1-CB 3.43Å; H156-D179 WeakPolarHBondContact CA-OD2 3.28Å; H156-D179 IonicContact CG-OD2 2.94Å; H156-D179 IonicContact ND1-OD1 3.22Å; H156-D179 IonicContact ND1-OD2 3.46Å; H156-D179 PolarHBondContact ND1-OD2 2.91Å; H156-D179 VanDerWaalsContact ND1-OD2 3.13Å; H156-T181 PolarHBondContact CE1-OG1 3.01Å; H156-T181 PolarHBondContact ND1-OG1 3.34Å; H156-T181 VanDerWaalsContact ND1-OG1 3.15Å
157	E	94.3	Very high	93.3	Very high	148 Å²	148	51.7 Å²	51.7	69%	0.692	24%	0.243	S	C	*	.	S	Bend	trans	-89.9	-19.1	-179.1	-63.3	-173.7	173.3	0	0	111.7	K137 D179	K137-E157 WeakPolarHBondContact CD-O 3.44Å; K137-E157 WeakPolarHBondContact CE-O 3.12Å; K137-E157 PolarHBondContact NZ-O 3.41Å; E157-D179 HydrophobicContact CB-CB 4.19Å; E157-D179 PolarHBondContact N-OD2 3.03Å
158	N	95.5	Very high	92.8	Very high	62 Å²	62	58 Å²	58	33%	0.332	26%	0.261	S	S	.	.	S	Bend	trans	-133.2	-175.6	-179.1	-145.6	-9.6	0	0	0	112.2	K137 V160 S177 D178 D179	K137-N158 WeakPolarHBondContact CA-O 3.4Å; K137-N158 WeakPolarHBondContact CB-O 3.23Å; K137-N158 WeakPolarHBondContact CG-O 3.4Å; N158-V160 PolarHBondContact O-N 2.92Å; N158-S177 PolarHBondContact O-OG 2.79Å; N158-D178 HydrophobicContact CB-CB 3.88Å; N158-D178 WeakPolarHBondContact ND2-CB 3.32Å; N158-D179 HydrophobicContact CB-CB 4Å
159	I	95.9	Very high	92.2	Very high	21 Å²	21	54.5 Å²	54.5	11%	0.108	26%	0.261	C	S	.	.			trans	-53.9	131.7	-179	-63.5	174.8	0	0	0	110.2	L119 S177 D178	L119-I159 HydrophobicContact CD1-CG2 3.41Å; L119-I159 VanDerWaalsContact CD1-CG2 3.41Å; I159-S177 CarbonylContact O-C 3.57Å; I159-S177 VanDerWaalsContact O-CA 3.24Å; I159-S177 WeakPolarHBondContact O-CA 3.45Å; I159-S177 WeakPolarHBondContact O-CB 3.39Å; I159-S177 PolarHBondContact O-OG 2.95Å; I159-S177 VanDerWaalsContact O-OG 3.11Å; I159-D178 HydrophobicContact CB-CB 4.44Å; I159-D178 PolarHBondContact O-N 3.22Å
160	V	96.6	Very high	91.7	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	110.5	173	-169.7	0	0	0	0	108.4	A133 S134 I139 H156 N158 G176	A133-V160 HydrophobicContact CB-CB 4.14Å; A133-V160 HydrophobicContact CB-CG1 3.7Å; S134-V160 PolarHBondContact O-N 3.11Å; I139-V160 HydrophobicContact CD1-CG1 4.28Å; I139-V160 HydrophobicContact CG1-CG1 3.97Å; I139-V160 HydrophobicContact CG1-CG2 4.49Å; H156-V160 HydrophobicContact CB-CG2 3.92Å; N158-V160 PolarHBondContact O-N 2.92Å; V160-G176 WeakPolarHBondContact CG1-O 3.3Å
161	N	95.8	Very high	91.3	Very high	8 Å²	8	51.1 Å²	51.1	4%	0.043	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	-34.7	-174.6	-66.5	-49.8	0	0	0	113.1	G176 D178 V202 L203 L294 R296	N161-G176 PolarHBondContact N-O 2.85Å; N161-D178 PolarHBondContact ND2-OD1 3.33Å; N161-V202 PolarHBondContact ND2-O 3.32Å; N161-L203 WeakPolarHBondContact CB-O 3.37Å; N161-L294 HydrophobicContact CB-CD1 4.08Å; N161-R296 PolarHBondContact O-NH2 2.76Å
162	S	95.2	Very high	91.3	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	154.8	-175.3	53.8	0	0	0	0	112.3	D120 S175 G176 L203 S204 V205	D120-S162 WeakPolarHBondContact OD2-CA 3.46Å; D120-S162 VanDerWaalsContact OD2-CB 3.29Å; D120-S162 WeakPolarHBondContact OD2-CB 3.46Å; S162-S175 VanDerWaalsContact O-CA 3.31Å; S162-S175 WeakPolarHBondContact O-CA 3.22Å; S162-G176 PolarHBondContact N-O 3.13Å; S162-G176 PolarHBondContact O-N 2.91Å; S162-L203 WeakPolarHBondContact CB-O 3.43Å; S162-L203 PolarHBondContact OG-O 3.49Å; S162-S204 VanDerWaalsContact OG-C 3.31Å; S162-S204 WeakPolarHBondContact OG-CA 3.31Å; S162-V205 PolarHBondContact OG-N 2.81Å
163	C	95.1	Very high	91.3	Very high	1 Å²	1	48.1 Å²	48.1	1%	0.007	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	148.8	170.3	59.2	0	0	0	0	110	D120 V122 A133 C174	D120-C163 PolarHBondContact OD2-N 3.39Å; V122-C163 WeakPolarHBondContact CG2-O 3.49Å; A133-C163 HydrophobicContact CB-CB 4.08Å; C163-C174 CarbonylContact C-O 3.52Å; C163-C174 VanDerWaalsContact CA-O 3.23Å; C163-C174 WeakPolarHBondContact CA-O 3.29Å
164	A	94.9	Very high	91.3	Very high	11 Å²	11	48 Å²	48	9%	0.091	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	158.7	166.7	0	0	0	0	0	110.9	V173 C174 F207	A164-V173 CarbonylContact O-C 3.54Å; A164-V173 WeakPolarHBondContact O-CA 3.08Å; A164-C174 PolarHBondContact N-O 3.33Å; A164-C174 PolarHBondContact O-N 3.14Å; A164-F207 HydrophobicContact CB-CD2 4.25Å; A164-F207 WeakPolarHBondContact O-CE2 3.46Å
165	V	93.7	Very high	91.5	Very high	15 Å²	15	38.7 Å²	38.7	9%	0.091	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	141.2	-176.4	-177.1	0	0	0	0	109	V122 Y131 R167 F207	V122-V165 HydrophobicContact CB-CG2 4.2Å; V122-V165 HydrophobicContact CG1-CB 4.09Å; V122-V165 HydrophobicContact CG1-CG2 3.62Å; Y131-V165 HydrophobicContact CD2-CG2 3.26Å; Y131-V165 HydrophobicContact CE2-CG1 4.18Å; Y131-V165 HydrophobicContact CE2-CG2 3.66Å; Y131-V165 HydrophobicContact CG-CG2 3.9Å; V165-R167 PolarHBondContact O-N 2.85Å; V165-F207 VanDerWaalsContact C-CD2 3.41Å
166	A	92.1	Very high	91.8	Very high	2 Å²	2	37.3 Å²	37.3	2%	0.017	19%	0.193	C	C	.	.			trans	-67.2	124.8	172.1	0	0	0	0	0	109.8	H172 F207 S211	A166-H172 HydrophobicContact CB-CB 4.12Å; A166-H172 PolarHBondContact N-O 3.26Å; A166-F207 HydrophobicContact CB-CD2 4.35Å; A166-F207 HydrophobicContact CB-CE2 4.28Å; A166-F207 HydrophobicContact CB-CZ 4.47Å; A166-S211 WeakPolarHBondContact CB-OG 3.32Å
167	R	83.5	Confident	91.9	Very high	103 Å²	103	36.8 Å²	36.8	39%	0.389	19%	0.19	S	C	.	.	S	Bend	trans	-77.2	-25.2	-179.5	-68.8	-163.6	-72.4	-115.5	10.7	113.2	V165 D209 S211 S250	V165-R167 PolarHBondContact O-N 2.85Å; R167-D209 IonicContact CZ-OD1 2.9Å; R167-D209 IonicContact NE-OD1 3.66Å; R167-D209 PolarHBondContact NE-OD1 3.26Å; R167-D209 IonicContact NH2-OD1 3.64Å; R167-D209 PolarHBondContact NH2-OD1 2.9Å; R167-S211 PolarHBondContact N-OG 3.42Å; R167-S250 PolarHBondContact NH2-O 2.82Å
168	R	80.8	Confident	91.9	Very high	160 Å²	160	31.2 Å²	31.2	60%	0.604	17%	0.166	S	C	*	.	S	Bend	trans	-132	149.2	-176.8	-64.2	-171.8	-175.5	-169.9	4.6	110.8	D209 S211	R168-D209 IonicContact CZ-OD2 2.73Å; R168-D209 IonicContact NE-OD2 3.59Å; R168-D209 PolarHBondContact NE-OD2 2.7Å; R168-D209 IonicContact NH2-OD2 3.83Å; R168-D209 PolarHBondContact NH2-OD2 2.91Å; R168-S211 WeakPolarHBondContact O-CB 3.35Å; R168-S211 PolarHBondContact O-OG 3.02Å
169	G	80.7	Confident	91.9	Very high	63 Å²	63	29.9 Å²	29.9	65%	0.649	16%	0.158	S	C	*	.	S	Bend	trans	79.3	-146.2	174.8	0	0	0	0	0	113
170	P	82.9	Confident	91.8	Very high	82 Å²	82	29 Å²	29	53%	0.532	16%	0.155	S	C	.	.	S	Bend	trans	-62	141.1	-179.5	25.3	-32.6	0	0	0	111.2	H172	P170-H172 VanDerWaalsContact CG-CD2 3.46Å; P170-H172 WeakPolarHBondContact CG-CD2 3.2Å; P170-H172 VanDerWaalsContact CG-NE2 3.27Å; P170-H172 WeakPolarHBondContact CG-NE2 3.24Å; P170-H172 PolarHBondContact O-N 3.15Å
171	Q	85.6	Confident	91.7	Very high	60 Å²	60	29.4 Å²	29.4	28%	0.28	16%	0.157	S	C	.	.			trans	-70.9	77.4	-178.6	-67.9	-70.4	-16.1	0	0	110.7	R187	Q171-R187 PolarHBondContact O-N 2.9Å
172	H	91.4	Very high	91.7	Very high	36 Å²	36	29 Å²	29	17%	0.167	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	148	177.3	-69.6	-40.6	0	0	0	111.6	A166 P170 L184 W185 F207	A166-H172 HydrophobicContact CB-CB 4.12Å; A166-H172 PolarHBondContact N-O 3.26Å; P170-H172 VanDerWaalsContact CG-CD2 3.46Å; P170-H172 WeakPolarHBondContact CG-CD2 3.2Å; P170-H172 VanDerWaalsContact CG-NE2 3.27Å; P170-H172 WeakPolarHBondContact CG-NE2 3.24Å; P170-H172 PolarHBondContact O-N 3.15Å; H172-L184 HydrophobicContact CB-CD1 3.87Å; H172-W185 CarbonylContact C-O 3.57Å; H172-W185 VanDerWaalsContact CA-O 3.31Å; H172-W185 WeakPolarHBondContact CA-O 3.2Å; H172-F207 HydrophobicContact CB-CZ 4.25Å
173	V	93.5	Very high	91.7	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	131.7	176.3	-175.9	0	0	0	0	107.6	Y131 A164 L184 W185	Y131-V173 HydrophobicContact CD1-CG1 4.19Å; Y131-V173 HydrophobicContact CD1-CG2 3.6Å; Y131-V173 HydrophobicContact CE1-CG2 3.26Å; Y131-V173 HydrophobicContact CE2-CG2 4.24Å; Y131-V173 HydrophobicContact CG-CG2 4.2Å; A164-V173 CarbonylContact O-C 3.54Å; A164-V173 WeakPolarHBondContact O-CA 3.08Å; V173-L184 CarbonylContact O-C 3.5Å; V173-W185 HydrophobicContact CB-CB 4.26Å; V173-W185 PolarHBondContact N-O 2.59Å; V173-W185 PolarHBondContact O-N 2.96Å
174	C	94.5	Very high	91.7	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	150.1	170.4	63.5	0	0	0	0	109.7	C163 A164 R183 V205 F207 I214	C163-C174 CarbonylContact C-O 3.52Å; C163-C174 VanDerWaalsContact CA-O 3.23Å; C163-C174 WeakPolarHBondContact CA-O 3.29Å; A164-C174 PolarHBondContact N-O 3.33Å; A164-C174 PolarHBondContact O-N 3.14Å; C174-R183 CarbonylContact C-O 3.56Å; C174-R183 VanDerWaalsContact CA-O 3.3Å; C174-R183 WeakPolarHBondContact CA-O 3.49Å; C174-V205 HydrophobicContact CB-CG1 3.99Å; C174-V205 WeakPolarHBondContact SG-CG1 3.41Å; C174-F207 HydrophobicContact CB-CD2 4.35Å; C174-F207 HydrophobicContact CB-CE1 4.28Å; C174-F207 HydrophobicContact CB-CE2 3.57Å; C174-F207 HydrophobicContact CB-CZ 3.51Å; C174-F207 WeakPolarHBondContact SG-CD2 3.39Å; C174-F207 WeakPolarHBondContact SG-CE2 3.23Å; C174-I214 HydrophobicContact CB-CD1 3.9Å; C174-I214 HydrophobicContact CB-CG1 4.48Å
175	S	95.8	Very high	91.6	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	140.2	177.2	56.4	0	0	0	0	111.4	I139 H156 S162 I182 R183 W185	I139-S175 WeakPolarHBondContact CD1-OG 3.26Å; H156-S175 PolarHBondContact NE2-OG 2.77Å; S162-S175 VanDerWaalsContact O-CA 3.31Å; S162-S175 WeakPolarHBondContact O-CA 3.22Å; S175-I182 CarbonylContact O-C 3.6Å; S175-I182 VanDerWaalsContact O-CA 3.24Å; S175-I182 WeakPolarHBondContact O-CA 3.42Å; S175-R183 PolarHBondContact N-O 3.25Å; S175-R183 PolarHBondContact O-N 3.4Å; S175-R183 PolarHBondContact OG-O 3.28Å; S175-W185 PolarHBondContact OG-NE1 2.8Å
176	G	95.6	Very high	91.6	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	137.9	174.9	0	0	0	0	0	111.1	V160 N161 S162	V160-G176 WeakPolarHBondContact CG1-O 3.3Å; N161-G176 PolarHBondContact N-O 2.85Å; S162-G176 PolarHBondContact N-O 3.13Å; S162-G176 PolarHBondContact O-N 2.91Å
177	S	96.5	Very high	91.3	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	160.6	-174.8	168.2	0	0	0	0	112.3	H156 N158 I159 D179 G180 T181 V202	H156-S177 WeakPolarHBondContact ND1-CB 3.43Å; N158-S177 PolarHBondContact O-OG 2.79Å; I159-S177 CarbonylContact O-C 3.57Å; I159-S177 VanDerWaalsContact O-CA 3.24Å; I159-S177 WeakPolarHBondContact O-CA 3.45Å; I159-S177 WeakPolarHBondContact O-CB 3.39Å; I159-S177 PolarHBondContact O-OG 2.95Å; I159-S177 VanDerWaalsContact O-OG 3.11Å; S177-D179 WeakPolarHBondContact CB-OD1 3.24Å; S177-D179 PolarHBondContact O-N 3.5Å; S177-D179 PolarHBondContact OG-N 2.49Å; S177-D179 PolarHBondContact OG-OD1 3.45Å; S177-D179 VanDerWaalsContact OG-OD1 3.1Å; S177-D179 PolarHBondContact OG-OD2 2.62Å; S177-G180 PolarHBondContact O-N 3.22Å; S177-G180 VanDerWaalsContact O-N 3.14Å; S177-T181 PolarHBondContact N-O 3.44Å; S177-V202 PolarHBondContact O-N 2.91Å; S177-V202 VanDerWaalsContact O-N 3.15Å
178	D	95.4	Very high	91.5	Very high	32 Å²	32	41.8 Å²	41.8	17%	0.171	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-8.6	171.1	-81	-14.8	0	0	0	113.5	N158 I159 N161 G180 Q201	N158-D178 HydrophobicContact CB-CB 3.88Å; N158-D178 WeakPolarHBondContact ND2-CB 3.32Å; I159-D178 HydrophobicContact CB-CB 4.44Å; I159-D178 PolarHBondContact O-N 3.22Å; N161-D178 PolarHBondContact ND2-OD1 3.33Å; D178-G180 PolarHBondContact O-N 3Å; D178-Q201 HydrophobicContact CB-CG 4.15Å; D178-Q201 WeakPolarHBondContact O-CG 3.31Å
179	D	94.5	Very high	91.9	Very high	33 Å²	33	38.7 Å²	38.7	18%	0.176	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-1.5	169.4	59	26.3	0	0	0	112.9	H156 E157 N158 S177 T181	H156-D179 WeakPolarHBondContact CA-OD2 3.28Å; H156-D179 IonicContact CG-OD2 2.94Å; H156-D179 IonicContact ND1-OD1 3.22Å; H156-D179 IonicContact ND1-OD2 3.46Å; H156-D179 PolarHBondContact ND1-OD2 2.91Å; H156-D179 VanDerWaalsContact ND1-OD2 3.13Å; E157-D179 HydrophobicContact CB-CB 4.19Å; E157-D179 PolarHBondContact N-OD2 3.03Å; N158-D179 HydrophobicContact CB-CB 4Å; S177-D179 WeakPolarHBondContact CB-OD1 3.24Å; S177-D179 PolarHBondContact O-N 3.5Å; S177-D179 PolarHBondContact OG-N 2.49Å; S177-D179 PolarHBondContact OG-OD1 3.45Å; S177-D179 VanDerWaalsContact OG-OD1 3.1Å; S177-D179 PolarHBondContact OG-OD2 2.62Å; D179-T181 VanDerWaalsContact CG-OG1 3.23Å; D179-T181 PolarHBondContact O-N 3.29Å; D179-T181 WeakPolarHBondContact OD1-CA 3.46Å; D179-T181 VanDerWaalsContact OD1-CB 3.23Å; D179-T181 WeakPolarHBondContact OD1-CB 3.36Å; D179-T181 WeakPolarHBondContact OD1-CG2 3.33Å; D179-T181 PolarHBondContact OD1-N 3.11Å; D179-T181 PolarHBondContact OD1-OG1 3.43Å; D179-T181 PolarHBondContact OD2-OG1 2.98Å
180	G	93.7	Very high	92	Very high	3 Å²	3	44.8 Å²	44.8	3%	0.031	20%	0.202	C	C	.	.	S	Bend	trans	75.9	6.7	-176.6	0	0	0	0	0	113.4	S177 D178 N198 Y200	S177-G180 PolarHBondContact O-N 3.22Å; S177-G180 VanDerWaalsContact O-N 3.14Å; D178-G180 PolarHBondContact O-N 3Å; G180-N198 VanDerWaalsContact O-CA 3.32Å; G180-N198 WeakPolarHBondContact O-CA 3.14Å; G180-N198 VanDerWaalsContact O-CB 3.24Å; G180-N198 WeakPolarHBondContact O-CB 3.26Å; G180-N198 PolarHBondContact O-N 3.48Å; G180-Y200 VanDerWaalsContact CA-O 3.31Å; G180-Y200 WeakPolarHBondContact CA-O 3.49Å
181	T	95.5	Very high	92.2	Very high	9 Å²	9	43.8 Å²	43.8	6%	0.055	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	142.3	177	72.7	0	0	0	0	111.7	H156 S177 D179 T195 F196	H156-T181 PolarHBondContact CE1-OG1 3.01Å; H156-T181 PolarHBondContact ND1-OG1 3.34Å; H156-T181 VanDerWaalsContact ND1-OG1 3.15Å; S177-T181 PolarHBondContact N-O 3.44Å; D179-T181 VanDerWaalsContact CG-OG1 3.23Å; D179-T181 PolarHBondContact O-N 3.29Å; D179-T181 WeakPolarHBondContact OD1-CA 3.46Å; D179-T181 VanDerWaalsContact OD1-CB 3.23Å; D179-T181 WeakPolarHBondContact OD1-CB 3.36Å; D179-T181 WeakPolarHBondContact OD1-CG2 3.33Å; D179-T181 PolarHBondContact OD1-N 3.11Å; D179-T181 PolarHBondContact OD1-OG1 3.43Å; D179-T181 PolarHBondContact OD2-OG1 2.98Å; T181-T195 HydrophobicContact CG2-CG2 4.19Å; T181-F196 CarbonylContact C-O 3.46Å; T181-F196 WeakPolarHBondContact CA-O 3.37Å
182	I	95.5	Very high	92.4	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	120.8	165.1	-54.9	154.2	0	0	0	106.3	S175 T195 F196 V202 V205 I214 S216 W226	S175-I182 CarbonylContact O-C 3.6Å; S175-I182 VanDerWaalsContact O-CA 3.24Å; S175-I182 WeakPolarHBondContact O-CA 3.42Å; I182-T195 CarbonylContact O-C 3.6Å; I182-T195 WeakPolarHBondContact O-CA 3.44Å; I182-F196 HydrophobicContact CB-CB 4.17Å; I182-F196 HydrophobicContact CB-CD2 4.29Å; I182-F196 HydrophobicContact CD1-CB 4.47Å; I182-F196 HydrophobicContact CG2-CD2 4.3Å; I182-F196 PolarHBondContact N-O 2.98Å; I182-F196 PolarHBondContact O-N 2.9Å; I182-V202 HydrophobicContact CD1-CG2 4.31Å; I182-V202 HydrophobicContact CG1-CB 4.43Å; I182-V202 HydrophobicContact CG1-CG1 4.13Å; I182-V202 HydrophobicContact CG1-CG2 3.93Å; I182-V205 HydrophobicContact CG2-CG1 4.16Å; I182-V205 HydrophobicContact CG2-CG2 4.41Å; I182-I214 HydrophobicContact CG2-CG2 4.2Å; I182-S216 WeakPolarHBondContact CD1-OG 3.15Å; I182-W226 HydrophobicContact CD1-CZ2 4.22Å; I182-W226 VanDerWaalsContact CD1-NE1 3.25Å
183	R	94.9	Very high	92.4	Very high	32 Å²	32	44 Å²	44	12%	0.121	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	138.3	-178.8	-68.1	-176.7	-178	-148	8.2	110.5	G155 C174 S175 W185 T195	G155-R183 VanDerWaalsContact CA-NH1 3.26Å; G155-R183 PolarHBondContact O-NH1 2.91Å; G155-R183 PolarHBondContact O-NH2 2.82Å; C174-R183 CarbonylContact C-O 3.56Å; C174-R183 VanDerWaalsContact CA-O 3.3Å; C174-R183 WeakPolarHBondContact CA-O 3.49Å; S175-R183 PolarHBondContact N-O 3.25Å; S175-R183 PolarHBondContact O-N 3.4Å; S175-R183 PolarHBondContact OG-O 3.28Å; R183-W185 HydrophobicContact CB-CZ2 3.94Å; R183-W185 HydrophobicContact CG-CZ2 4.47Å; R183-T195 HydrophobicContact CG-CG2 4.07Å
184	L	95	Very high	92.3	Very high	5 Å²	5	46.5 Å²	46.5	3%	0.026	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	128.5	171.4	-173.8	66.7	0	0	0	109	H172 V173 V193 Q194 F207 I214 L228	H172-L184 HydrophobicContact CB-CD1 3.87Å; V173-L184 CarbonylContact O-C 3.5Å; L184-V193 HydrophobicContact CD2-CB 4.45Å; L184-V193 HydrophobicContact CD2-CG1 4.44Å; L184-V193 HydrophobicContact CG-CB 4.47Å; L184-V193 PolarHBondContact O-N 2.89Å; L184-Q194 HydrophobicContact CB-CB 4.06Å; L184-Q194 HydrophobicContact CD2-CB 4.37Å; L184-Q194 PolarHBondContact N-O 3.44Å; L184-F207 HydrophobicContact CD1-CE1 4.05Å; L184-F207 HydrophobicContact CD1-CZ 3.61Å; L184-I214 HydrophobicContact CD1-CD1 4.27Å; L184-L228 HydrophobicContact CD2-CD2 4.01Å
185	W	93.7	Very high	92.3	Very high	2 Å²	2	49.7 Å²	49.7	1%	0.008	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	138.5	-179.3	-53.2	92.4	0	0	0	109.7	I139 F153 H172 V173 S175 R183 C192	I139-W185 HydrophobicContact CD1-CZ2 4.43Å; F153-W185 HydrophobicContact CB-CD2 4.17Å; F153-W185 HydrophobicContact CB-CE3 4.06Å; F153-W185 HydrophobicContact CB-CH2 4.39Å; F153-W185 HydrophobicContact CB-CZ3 4.17Å; F153-W185 HydrophobicContact CD1-CB 4.29Å; F153-W185 HydrophobicContact CD1-CD2 4.08Å; F153-W185 AromaticContact CD1-CE3 3.66Å; F153-W185 HydrophobicContact CD1-CE3 3.66Å; F153-W185 HydrophobicContact CD1-CG 4.36Å; F153-W185 HydrophobicContact CD1-CZ3 4.32Å; F153-W185 HydrophobicContact CE1-CB 4.18Å; F153-W185 HydrophobicContact CE1-CE3 4.47Å; F153-W185 HydrophobicContact CG-CD2 4.28Å; F153-W185 HydrophobicContact CG-CE3 4.18Å; H172-W185 CarbonylContact C-O 3.57Å; H172-W185 VanDerWaalsContact CA-O 3.31Å; H172-W185 WeakPolarHBondContact CA-O 3.2Å; V173-W185 HydrophobicContact CB-CB 4.26Å; V173-W185 PolarHBondContact N-O 2.59Å; V173-W185 PolarHBondContact O-N 2.96Å; S175-W185 PolarHBondContact OG-NE1 2.8Å; R183-W185 HydrophobicContact CB-CZ2 3.94Å; R183-W185 HydrophobicContact CG-CZ2 4.47Å; W185-C192 HydrophobicContact CD2-CB 4.45Å; W185-C192 HydrophobicContact CE3-CB 3.98Å; W185-C192 HydrophobicContact CH2-CB 3.97Å; W185-C192 HydrophobicContact CZ2-CB 4.42Å; W185-C192 HydrophobicContact CZ3-CB 3.73Å
186	D	91.8	Very high	92.2	Very high	21 Å²	21	50 Å²	50	11%	0.112	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	131.3	166.5	175.6	-1.3	0	0	0	107.8	R188 Q189 V193	D186-R188 PolarHBondContact O-N 3.49Å; D186-R188 PolarHBondContact OD1-N 3.4Å; D186-Q189 HydrophobicContact CB-CB 4.18Å; D186-Q189 HydrophobicContact CB-CG 4.21Å; D186-Q189 PolarHBondContact O-N 2.77Å; D186-Q189 PolarHBondContact OD2-NE2 2.91Å; D186-V193 HydrophobicContact CB-CG2 3.52Å
187	R	86.4	Confident	92	Very high	112 Å²	112	56.1 Å²	56.1	42%	0.423	27%	0.271	S	S	.	.	S	Bend	trans	-53.9	-35.9	176.2	175.8	177.1	150.4	-170.5	-3.8	111.8	L141 K151 Q171	L141-R187 HydrophobicContact CD1-CG 3.89Å; K151-R187 PolarHBondContact NZ-O 2.88Å; Q171-R187 PolarHBondContact O-N 2.9Å
188	R	88	Confident	91.7	Very high	228 Å²	228	56.3 Å²	56.3	86%	0.86	27%	0.272	S	S	*	.	S	Bend	trans	-77	-30.5	-176.7	-60.1	177.6	-178.8	176.6	0.9	113	D186	D186-R188 PolarHBondContact O-N 3.49Å; D186-R188 PolarHBondContact OD1-N 3.4Å
189	Q	88.3	Confident	91.5	Very high	94 Å²	94	60.3 Å²	60.3	44%	0.439	30%	0.297	S	S	.	.			trans	-95.2	143.5	-176.2	-62.1	-178.7	51.4	0	0	111.6	K151 D186	K151-Q189 PolarHBondContact NZ-O 3.29Å; D186-Q189 HydrophobicContact CB-CB 4.18Å; D186-Q189 HydrophobicContact CB-CG 4.21Å; D186-Q189 PolarHBondContact O-N 2.77Å; D186-Q189 PolarHBondContact OD2-NE2 2.91Å
190	K	82.8	Confident	91.5	Very high	191 Å²	191	64.9 Å²	64.9	83%	0.83	31%	0.313	S	S	*	.	S	Bend	trans	-79.9	-25.3	178	-69.2	-176	-179.5	178.4	0	113
191	A	88.4	Confident	91.5	Very high	62 Å²	62	68.1 Å²	68.1	51%	0.512	33%	0.328	S	S	.	.	S	Bend	trans	-92.8	164.3	-180	0	0	0	0	0	111.7
192	C	89.3	Confident	91.5	Very high	45 Å²	45	67.7 Å²	67.7	30%	0.304	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	137.8	166.4	54.7	0	0	0	0	109.6	W185	W185-C192 HydrophobicContact CD2-CB 4.45Å; W185-C192 HydrophobicContact CE3-CB 3.98Å; W185-C192 HydrophobicContact CH2-CB 3.97Å; W185-C192 HydrophobicContact CZ2-CB 4.42Å; W185-C192 HydrophobicContact CZ3-CB 3.73Å
193	V	91.3	Very high	91.5	Very high	54 Å²	54	68.3 Å²	68.3	33%	0.327	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	-48.5	180	-177.7	0	0	0	0	109.8	L184 D186	L184-V193 HydrophobicContact CD2-CB 4.45Å; L184-V193 HydrophobicContact CD2-CG1 4.44Å; L184-V193 HydrophobicContact CG-CB 4.47Å; L184-V193 PolarHBondContact O-N 2.89Å; D186-V193 HydrophobicContact CB-CG2 3.52Å
194	Q	92.6	Very high	91.5	Very high	53 Å²	53	66.9 Å²	66.9	25%	0.248	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	152.7	-178.7	-72.4	167.8	2.1	0	0	109.9	L184 F196 L231	L184-Q194 HydrophobicContact CB-CB 4.06Å; L184-Q194 HydrophobicContact CD2-CB 4.37Å; L184-Q194 PolarHBondContact N-O 3.44Å; Q194-F196 HydrophobicContact CB-CE2 4.38Å; Q194-F196 HydrophobicContact CB-CZ 4.38Å; Q194-L231 HydrophobicContact CG-CD2 4.06Å; Q194-L231 VanDerWaalsContact OE1-CD2 3.29Å
195	T	93.4	Very high	91.6	Very high	68 Å²	68	66.9 Å²	66.9	42%	0.417	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	124	176	-57.2	0	0	0	0	108.1	T181 I182 R183	T181-T195 HydrophobicContact CG2-CG2 4.19Å; I182-T195 CarbonylContact O-C 3.6Å; I182-T195 WeakPolarHBondContact O-CA 3.44Å; R183-T195 HydrophobicContact CG-CG2 4.07Å
196	F	93.5	Very high	91.7	Very high	7 Å²	7	67.5 Å²	67.5	3%	0.031	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	127	171.2	-52.2	-81.7	0	0	0	108.6	T181 I182 Q194 I214 W226 L228 L231	T181-F196 CarbonylContact C-O 3.46Å; T181-F196 WeakPolarHBondContact CA-O 3.37Å; I182-F196 HydrophobicContact CB-CB 4.17Å; I182-F196 HydrophobicContact CB-CD2 4.29Å; I182-F196 HydrophobicContact CD1-CB 4.47Å; I182-F196 HydrophobicContact CG2-CD2 4.3Å; I182-F196 PolarHBondContact N-O 2.98Å; I182-F196 PolarHBondContact O-N 2.9Å; Q194-F196 HydrophobicContact CB-CE2 4.38Å; Q194-F196 HydrophobicContact CB-CZ 4.38Å; F196-I214 HydrophobicContact CE2-CD1 4.02Å; F196-W226 HydrophobicContact CB-CD2 4.2Å; F196-W226 HydrophobicContact CB-CE3 4.06Å; F196-W226 HydrophobicContact CB-CZ3 4.24Å; F196-W226 HydrophobicContact CD1-CB 4.47Å; F196-W226 HydrophobicContact CD1-CD2 4.31Å; F196-W226 AromaticContact CD1-CE3 3.82Å; F196-W226 HydrophobicContact CD1-CE3 3.82Å; F196-W226 HydrophobicContact CD1-CZ3 4.46Å; F196-W226 HydrophobicContact CG-CD2 4.31Å; F196-W226 HydrophobicContact CG-CE3 4.18Å; F196-L228 HydrophobicContact CE2-CD2 3.97Å; F196-L228 HydrophobicContact CZ-CD2 3.75Å; F196-L231 HydrophobicContact CE1-CB 4.31Å; F196-L231 HydrophobicContact CE1-CD2 3.79Å; F196-L231 HydrophobicContact CZ-CD2 3.93Å
197	Q	91.9	Very high	91.8	Very high	127 Å²	127	66.8 Å²	66.8	59%	0.593	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.9	118.9	178.3	-173.2	67.4	46.8	0	0	109.5
198	N	90.1	Very high	92.1	Very high	5 Å²	5	61.9 Å²	61.9	3%	0.027	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-99.7	158.2	164.1	-158.6	4.8	0	0	0	109.8	G180 V202 D220 K224	G180-N198 VanDerWaalsContact O-CA 3.32Å; G180-N198 WeakPolarHBondContact O-CA 3.14Å; G180-N198 VanDerWaalsContact O-CB 3.24Å; G180-N198 WeakPolarHBondContact O-CB 3.26Å; G180-N198 PolarHBondContact O-N 3.48Å; N198-V202 HydrophobicContact CB-CG2 4.11Å; N198-D220 PolarHBondContact ND2-OD2 2.83Å; N198-K224 PolarHBondContact OD1-NZ 3.46Å
199	T	90.6	Very high	92.2	Very high	115 Å²	115	52.2 Å²	52.2	71%	0.706	27%	0.271	S	S	*	.	S	Bend	trans	-78.1	-25.6	179.3	52.9	0	0	0	0	112.8
200	Y	94.3	Very high	92.2	Very high	129 Å²	129	51.7 Å²	51.7	51%	0.506	28%	0.275	S	S	.	.	S	Bend	trans	-125.5	165.8	-175.9	-61.8	-75.6	0	0	0	111.3	G180 D220	G180-Y200 VanDerWaalsContact CA-O 3.31Å; G180-Y200 WeakPolarHBondContact CA-O 3.49Å; Y200-D220 HydrophobicContact CD2-CB 3.78Å; Y200-D220 HydrophobicContact CG-CB 4.43Å
201	Q	94.6	Very high	92.5	Very high	72 Å²	72	43.4 Å²	43.4	34%	0.336	24%	0.241	S	C	.	.			trans	-57	138.2	179.7	-61.8	85.5	-7.6	0	0	111.6	D178 G218 I219	D178-Q201 HydrophobicContact CB-CG 4.15Å; D178-Q201 WeakPolarHBondContact O-CG 3.31Å; Q201-G218 WeakPolarHBondContact O-CA 3.5Å; Q201-I219 HydrophobicContact CB-CD1 3.93Å; Q201-I219 HydrophobicContact CB-CG1 4.19Å; Q201-I219 HydrophobicContact CG-CD1 4.25Å; Q201-I219 PolarHBondContact O-N 3.39Å
202	V	95.8	Very high	92.6	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	116.9	177.1	-177.7	0	0	0	0	108.8	N161 S177 I182 N198 V205	N161-V202 PolarHBondContact ND2-O 3.32Å; S177-V202 PolarHBondContact O-N 2.91Å; S177-V202 VanDerWaalsContact O-N 3.15Å; I182-V202 HydrophobicContact CD1-CG2 4.31Å; I182-V202 HydrophobicContact CG1-CB 4.43Å; I182-V202 HydrophobicContact CG1-CG1 4.13Å; I182-V202 HydrophobicContact CG1-CG2 3.93Å; N198-V202 HydrophobicContact CB-CG2 4.11Å; V202-V205 HydrophobicContact CG1-CG2 3.49Å; V202-V205 VanDerWaalsContact CG1-CG2 3.49Å
203	L	96	Very high	92.8	Very high	12 Å²	12	43.2 Å²	43.2	6%	0.063	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	-32.3	-174.5	-58.9	-176.5	0	0	0	112.1	N161 S162 G217 I219 V244 L294 R296	N161-L203 WeakPolarHBondContact CB-O 3.37Å; S162-L203 WeakPolarHBondContact CB-O 3.43Å; S162-L203 PolarHBondContact OG-O 3.49Å; L203-G217 PolarHBondContact N-O 3.24Å; L203-I219 HydrophobicContact CD1-CG1 4.09Å; L203-I219 HydrophobicContact CG-CG1 4.32Å; L203-V244 WeakPolarHBondContact CB-O 3.49Å; L203-L294 HydrophobicContact CB-CD2 4.12Å; L203-L294 HydrophobicContact CD1-CD2 4.15Å; L203-L294 HydrophobicContact CD2-CD2 4.1Å; L203-L294 HydrophobicContact CG-CD2 4.34Å; L203-R296 PolarHBondContact O-NH1 2.96Å
204	S	95	Very high	92.9	Very high	3 Å²	3	40.7 Å²	40.7	2%	0.021	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	140.5	-179.8	-160.2	0	0	0	0	111.4	S162 S216 G217 L247 R296	S162-S204 VanDerWaalsContact OG-C 3.31Å; S162-S204 WeakPolarHBondContact OG-CA 3.31Å; S204-S216 CarbonylContact O-C 3.49Å; S204-S216 WeakPolarHBondContact O-CA 3.41Å; S204-G217 PolarHBondContact N-O 3.36Å; S204-G217 PolarHBondContact O-N 2.82Å; S204-L247 WeakPolarHBondContact OG-CB 3.4Å; S204-L247 PolarHBondContact OG-N 2.89Å; S204-R296 PolarHBondContact OG-NH1 2.85Å
205	V	95.7	Very high	93.1	Very high	5 Å²	5	38.3 Å²	38.3	3%	0.03	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	143	175.3	-173	0	0	0	0	109.1	S162 C174 I182 V202 I214 F215	S162-V205 PolarHBondContact OG-N 2.81Å; C174-V205 HydrophobicContact CB-CG1 3.99Å; C174-V205 WeakPolarHBondContact SG-CG1 3.41Å; I182-V205 HydrophobicContact CG2-CG1 4.16Å; I182-V205 HydrophobicContact CG2-CG2 4.41Å; V202-V205 HydrophobicContact CG1-CG2 3.49Å; V202-V205 VanDerWaalsContact CG1-CG2 3.49Å; V205-I214 HydrophobicContact CG1-CG2 3.38Å; V205-F215 CarbonylContact C-O 3.6Å; V205-F215 VanDerWaalsContact CA-O 3.29Å; V205-F215 WeakPolarHBondContact CA-O 3.41Å
206	T	95.2	Very high	93.2	Very high	15 Å²	15	35 Å²	35	9%	0.092	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	150.8	173.2	-178.3	0	0	0	0	110.6	F215 L247 V249 L256	T206-F215 HydrophobicContact CG2-CB 3.84Å; T206-F215 HydrophobicContact CG2-CD2 4.32Å; T206-F215 PolarHBondContact N-O 2.87Å; T206-F215 PolarHBondContact O-N 2.86Å; T206-L247 HydrophobicContact CG2-CB 3.86Å; T206-L247 HydrophobicContact CG2-CD1 4.4Å; T206-V249 HydrophobicContact CG2-CG2 3.72Å; T206-L256 HydrophobicContact CG2-CD1 3.65Å
207	F	94.4	Very high	93.2	Very high	6 Å²	6	34.7 Å²	34.7	3%	0.026	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	154.3	169.8	-79.3	-75.9	0	0	0	111.5	A164 V165 A166 H172 C174 L184 I214 L228 V249	A164-F207 HydrophobicContact CB-CD2 4.25Å; A164-F207 WeakPolarHBondContact O-CE2 3.46Å; V165-F207 VanDerWaalsContact C-CD2 3.41Å; A166-F207 HydrophobicContact CB-CD2 4.35Å; A166-F207 HydrophobicContact CB-CE2 4.28Å; A166-F207 HydrophobicContact CB-CZ 4.47Å; H172-F207 HydrophobicContact CB-CZ 4.25Å; C174-F207 HydrophobicContact CB-CD2 4.35Å; C174-F207 HydrophobicContact CB-CE1 4.28Å; C174-F207 HydrophobicContact CB-CE2 3.57Å; C174-F207 HydrophobicContact CB-CZ 3.51Å; C174-F207 WeakPolarHBondContact SG-CD2 3.39Å; C174-F207 WeakPolarHBondContact SG-CE2 3.23Å; L184-F207 HydrophobicContact CD1-CE1 4.05Å; L184-F207 HydrophobicContact CD1-CZ 3.61Å; F207-I214 HydrophobicContact CD1-CD1 4.47Å; F207-I214 HydrophobicContact CD1-CG1 3.68Å; F207-I214 HydrophobicContact CE1-CD1 3.78Å; F207-I214 HydrophobicContact CE1-CG1 3.47Å; F207-I214 VanDerWaalsContact CE1-CG1 3.47Å; F207-I214 HydrophobicContact CZ-CD1 4.26Å; F207-I214 HydrophobicContact CZ-CG1 4.31Å; F207-L228 HydrophobicContact CE1-CD1 4.26Å; F207-V249 VanDerWaalsContact O-CG2 3.31Å; F207-V249 WeakPolarHBondContact O-CG2 3.22Å
208	S	93.1	Very high	93.4	Very high	9 Å²	9	28.7 Å²	28.7	6%	0.063	15%	0.149	C	C	.	.			trans	-68.2	159.9	158.5	69.7	0	0	0	0	110.9	T210 S211 E212 M213	S208-T210 VanDerWaalsContact C-N 3.25Å; S208-T210 PolarHBondContact O-N 2.87Å; S208-T210 PolarHBondContact OG-OG1 2.86Å; S208-T210 VanDerWaalsContact OG-OG1 3.06Å; S208-S211 WeakPolarHBondContact O-CA 3.48Å; S208-S211 PolarHBondContact O-N 3.36Å; S208-S211 PolarHBondContact OG-N 2.98Å; S208-E212 PolarHBondContact OG-N 3.03Å; S208-M213 PolarHBondContact N-O 2.88Å; S208-M213 PolarHBondContact OG-N 3.03Å; S208-M213 PolarHBondContact OG-O 2.84Å
209	D	89.7	Confident	93.6	Very high	24 Å²	24	31.4 Å²	31.4	13%	0.128	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-36.1	177.6	-166.5	63.3	0	0	0	112.8	R167 R168 S211	R167-D209 IonicContact CZ-OD1 2.9Å; R167-D209 IonicContact NE-OD1 3.66Å; R167-D209 PolarHBondContact NE-OD1 3.26Å; R167-D209 IonicContact NH2-OD1 3.64Å; R167-D209 PolarHBondContact NH2-OD1 2.9Å; R168-D209 IonicContact CZ-OD2 2.73Å; R168-D209 IonicContact NE-OD2 3.59Å; R168-D209 PolarHBondContact NE-OD2 2.7Å; R168-D209 IonicContact NH2-OD2 3.83Å; R168-D209 PolarHBondContact NH2-OD2 2.91Å; D209-S211 PolarHBondContact O-N 3.41Å
210	T	88.7	Confident	93.7	Very high	83 Å²	83	27.1 Å²	27.1	51%	0.509	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-11	174.5	58.2	0	0	0	0	113.6	S208 E212	S208-T210 VanDerWaalsContact C-N 3.25Å; S208-T210 PolarHBondContact O-N 2.87Å; S208-T210 PolarHBondContact OG-OG1 2.86Å; S208-T210 VanDerWaalsContact OG-OG1 3.06Å; T210-E212 PolarHBondContact O-N 2.98Å
211	S	89.1	Confident	93.7	Very high	18 Å²	18	23.3 Å²	23.3	13%	0.126	13%	0.125	C	C	.	.	S	Bend	trans	56.3	25.5	-176	-51.7	0	0	0	0	113.7	A166 R167 R168 S208 D209 L228	A166-S211 WeakPolarHBondContact CB-OG 3.32Å; R167-S211 PolarHBondContact N-OG 3.42Å; R168-S211 WeakPolarHBondContact O-CB 3.35Å; R168-S211 PolarHBondContact O-OG 3.02Å; S208-S211 WeakPolarHBondContact O-CA 3.48Å; S208-S211 PolarHBondContact O-N 3.36Å; S208-S211 PolarHBondContact OG-N 2.98Å; D209-S211 PolarHBondContact O-N 3.41Å; S211-L228 VanDerWaalsContact O-CD1 3.23Å; S211-L228 WeakPolarHBondContact O-CD1 3.35Å
212	E	90.4	Very high	93.7	Very high	78 Å²	78	21.6 Å²	21.6	36%	0.364	12%	0.119	S	C	.	.	S	Bend	trans	-96.9	-21.2	175.2	-64.3	-174.2	144.2	0	0	112.4	S208 T210 L228 R229	S208-E212 PolarHBondContact OG-N 3.03Å; T210-E212 PolarHBondContact O-N 2.98Å; E212-L228 WeakPolarHBondContact O-CB 3.37Å; E212-L228 WeakPolarHBondContact O-CG 3.47Å; E212-L228 PolarHBondContact O-N 3.43Å; E212-R229 IonicContact OE1-CZ 3.55Å; E212-R229 IonicContact OE1-NH1 3.39Å; E212-R229 PolarHBondContact OE1-NH1 2.92Å; E212-R229 IonicContact OE1-NH2 3.73Å; E212-R229 PolarHBondContact OE1-NH2 3.03Å
213	M	92.8	Very high	93.7	Very high	25 Å²	25	21.6 Å²	21.6	12%	0.123	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	143	-176.4	-66.1	-81.4	-67.5	0	0	110.3	S208 F215 W226 D227 S234 M235	S208-M213 PolarHBondContact N-O 2.88Å; S208-M213 PolarHBondContact OG-N 3.03Å; S208-M213 PolarHBondContact OG-O 2.84Å; M213-F215 HydrophobicContact CB-CZ 4.39Å; M213-W226 CarbonylContact C-O 3.51Å; M213-W226 VanDerWaalsContact CA-O 3.26Å; M213-W226 WeakPolarHBondContact CA-O 3.49Å; M213-D227 WeakPolarHBondContact SD-CA 3.48Å; M213-D227 HydrophobicContact SD-CB 3.67Å; M213-S234 WeakPolarHBondContact CE-OG 3.39Å; M213-M235 HydrophobicContact CE-CE 4.26Å; M213-M235 HydrophobicContact CE-CG 4.08Å; M213-M235 HydrophobicContact CE-SD 4.12Å
214	I	94.7	Very high	93.6	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	129.7	170	-64.4	174.2	0	0	0	108.5	C174 I182 L184 F196 V205 F207 G225 W226 L228	C174-I214 HydrophobicContact CB-CD1 3.9Å; C174-I214 HydrophobicContact CB-CG1 4.48Å; I182-I214 HydrophobicContact CG2-CG2 4.2Å; L184-I214 HydrophobicContact CD1-CD1 4.27Å; F196-I214 HydrophobicContact CE2-CD1 4.02Å; V205-I214 HydrophobicContact CG1-CG2 3.38Å; F207-I214 HydrophobicContact CD1-CD1 4.47Å; F207-I214 HydrophobicContact CD1-CG1 3.68Å; F207-I214 HydrophobicContact CE1-CD1 3.78Å; F207-I214 HydrophobicContact CE1-CG1 3.47Å; F207-I214 VanDerWaalsContact CE1-CG1 3.47Å; F207-I214 HydrophobicContact CZ-CD1 4.26Å; F207-I214 HydrophobicContact CZ-CG1 4.31Å; I214-G225 CarbonylContact O-C 3.56Å; I214-G225 WeakPolarHBondContact O-CA 3.41Å; I214-W226 HydrophobicContact CB-CB 4.35Å; I214-W226 PolarHBondContact N-O 2.61Å; I214-W226 PolarHBondContact O-N 3.03Å; I214-L228 HydrophobicContact CD1-CD2 3.56Å; I214-L228 HydrophobicContact CD1-CG 4.45Å; I214-L228 HydrophobicContact CG1-CD2 3.99Å; I214-L228 HydrophobicContact CG1-CG 4.39Å
215	F	95.3	Very high	93.6	Very high	3 Å²	3	22.3 Å²	22.3	1%	0.013	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	134.3	169.8	-58.6	-75.8	0	0	0	110	V205 T206 M213 V223 K224 M235 L247 V249 L256 I270	V205-F215 CarbonylContact C-O 3.6Å; V205-F215 VanDerWaalsContact CA-O 3.29Å; V205-F215 WeakPolarHBondContact CA-O 3.41Å; T206-F215 HydrophobicContact CG2-CB 3.84Å; T206-F215 HydrophobicContact CG2-CD2 4.32Å; T206-F215 PolarHBondContact N-O 2.87Å; T206-F215 PolarHBondContact O-N 2.86Å; M213-F215 HydrophobicContact CB-CZ 4.39Å; F215-V223 HydrophobicContact CB-CG1 4.41Å; F215-K224 CarbonylContact C-O 3.54Å; F215-K224 WeakPolarHBondContact CA-O 3.47Å; F215-M235 HydrophobicContact CE1-SD 4.38Å; F215-L247 HydrophobicContact CB-CD1 4.32Å; F215-V249 HydrophobicContact CD2-CG2 4.12Å; F215-V249 HydrophobicContact CE2-CG2 4.42Å; F215-L256 HydrophobicContact CB-CD1 4.43Å; F215-L256 HydrophobicContact CB-CD2 4Å; F215-L256 HydrophobicContact CD1-CD2 4.02Å; F215-L256 HydrophobicContact CD2-CD1 4.4Å; F215-L256 HydrophobicContact CD2-CD2 4.43Å; F215-L256 HydrophobicContact CG-CD1 4.47Å; F215-L256 HydrophobicContact CG-CD2 3.88Å; F215-I270 HydrophobicContact CE1-CB 4.36Å; F215-I270 HydrophobicContact CE1-CG2 3.8Å; F215-I270 HydrophobicContact CE2-CB 4.37Å; F215-I270 HydrophobicContact CE2-CD1 3.77Å; F215-I270 HydrophobicContact CE2-CG2 4.2Å; F215-I270 HydrophobicContact CZ-CB 3.75Å; F215-I270 HydrophobicContact CZ-CD1 4.03Å; F215-I270 HydrophobicContact CZ-CG2 3.59Å
216	S	95.7	Very high	93.5	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	137.1	177	65.4	0	0	0	0	111	I182 S204 V223 K224 W226	I182-S216 WeakPolarHBondContact CD1-OG 3.15Å; S204-S216 CarbonylContact O-C 3.49Å; S204-S216 WeakPolarHBondContact O-CA 3.41Å; S216-V223 WeakPolarHBondContact O-CA 3Å; S216-K224 PolarHBondContact N-O 3.47Å; S216-K224 PolarHBondContact O-N 3.27Å; S216-K224 PolarHBondContact OG-O 3.36Å; S216-W226 PolarHBondContact OG-NE1 3.46Å
217	G	95.1	Very high	93.4	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	136.9	174	0	0	0	0	0	109.5	L203 S204 L247	L203-G217 PolarHBondContact N-O 3.24Å; S204-G217 PolarHBondContact N-O 3.36Å; S204-G217 PolarHBondContact O-N 2.82Å; G217-L247 VanDerWaalsContact N-CD1 3.29Å
218	G	94.5	Very high	93.2	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	-156.8	-175.8	0	0	0	0	0	113.2	Q201 D220 T243 V244	Q201-G218 WeakPolarHBondContact O-CA 3.5Å; G218-D220 PolarHBondContact N-OD1 2.68Å; G218-D220 PolarHBondContact O-N 3.14Å; G218-T243 WeakPolarHBondContact O-CA 3.37Å; G218-V244 PolarHBondContact O-N 2.96Å
219	I	95.1	Very high	93.1	Very high	63 Å²	63	33 Å²	33	32%	0.323	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-4	178.7	-55.9	-171.2	0	0	0	111.7	Q201 L203 N221 T243	Q201-I219 HydrophobicContact CB-CD1 3.93Å; Q201-I219 HydrophobicContact CB-CG1 4.19Å; Q201-I219 HydrophobicContact CG-CD1 4.25Å; Q201-I219 PolarHBondContact O-N 3.39Å; L203-I219 HydrophobicContact CD1-CG1 4.09Å; L203-I219 HydrophobicContact CG-CG1 4.32Å; I219-N221 PolarHBondContact O-N 3.05Å; I219-N221 PolarHBondContact O-OD1 2.82Å; I219-T243 HydrophobicContact CB-CG2 3.94Å; I219-T243 HydrophobicContact CG1-CG2 3.95Å; I219-T243 HydrophobicContact CG2-CG2 3.7Å
220	D	92.7	Very high	93.1	Very high	24 Å²	24	38.7 Å²	38.7	13%	0.128	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	2.1	178.6	53.9	-4.8	0	0	0	114.5	N198 Y200 G218 V222 K224	N198-D220 PolarHBondContact ND2-OD2 2.83Å; Y200-D220 HydrophobicContact CD2-CB 3.78Å; Y200-D220 HydrophobicContact CG-CB 4.43Å; G218-D220 PolarHBondContact N-OD1 2.68Å; G218-D220 PolarHBondContact O-N 3.14Å; D220-V222 WeakPolarHBondContact O-CG2 3.45Å; D220-V222 PolarHBondContact O-N 3.45Å; D220-K224 VanDerWaalsContact OD2-CE 3.28Å; D220-K224 WeakPolarHBondContact OD2-CE 3.13Å; D220-K224 IonicContact OD2-NZ 3.87Å; D220-K224 PolarHBondContact OD2-NZ 3.43Å
221	N	94.2	Very high	93.1	Very high	50 Å²	50	39 Å²	39	27%	0.267	18%	0.183	S	C	.	.	S	Bend	trans	58	10.8	179.5	-51.7	-12.8	0	0	0	114.1	I219 H240 T241 D242 T243	I219-N221 PolarHBondContact O-N 3.05Å; I219-N221 PolarHBondContact O-OD1 2.82Å; N221-H240 WeakPolarHBondContact O-CB 3.25Å; N221-T241 PolarHBondContact ND2-O 2.78Å; N221-D242 WeakPolarHBondContact OD1-CA 3.03Å; N221-D242 PolarHBondContact OD1-O 3.26Å; N221-T243 PolarHBondContact OD1-N 2.71Å; N221-T243 VanDerWaalsContact OD1-N 3.12Å
222	V	94.7	Very high	93.2	Very high	35 Å²	35	44.5 Å²	44.5	21%	0.212	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	131	-175.8	176.3	0	0	0	0	108.1	D220 K224 L236	D220-V222 WeakPolarHBondContact O-CG2 3.45Å; D220-V222 PolarHBondContact O-N 3.45Å; V222-K224 HydrophobicContact CG1-CG 4.26Å; V222-L236 HydrophobicContact CG1-CB 4.26Å; V222-L236 HydrophobicContact CG1-CD2 4.2Å
223	V	95.4	Very high	93.1	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	119.4	171.3	-177	0	0	0	0	108.4	F215 S216 L237 V244 L247 L256	F215-V223 HydrophobicContact CB-CG1 4.41Å; S216-V223 WeakPolarHBondContact O-CA 3Å; V223-L237 HydrophobicContact CB-CB 4.01Å; V223-L237 HydrophobicContact CB-CD1 4.09Å; V223-L237 HydrophobicContact CG1-CD1 4.08Å; V223-L237 PolarHBondContact N-O 3.04Å; V223-L237 VanDerWaalsContact N-O 3.12Å; V223-L237 WeakPolarHBondContact O-CB 3.47Å; V223-L237 PolarHBondContact O-N 2.98Å; V223-V244 HydrophobicContact CG2-CG1 4.1Å; V223-V244 HydrophobicContact CG2-CG2 4.05Å; V223-L247 HydrophobicContact CG1-CD1 3.97Å; V223-L247 HydrophobicContact CG1-CD2 3.94Å; V223-L247 HydrophobicContact CG2-CD2 3.89Å; V223-L256 HydrophobicContact CG1-CD2 3.73Å
224	K	94.7	Very high	93	Very high	31 Å²	31	44.5 Å²	44.5	14%	0.135	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	129.6	-177.9	-59.9	-179.4	167.5	146	0	109.8	N198 F215 S216 D220 V222 W226 M235 L236	N198-K224 PolarHBondContact OD1-NZ 3.46Å; F215-K224 CarbonylContact C-O 3.54Å; F215-K224 WeakPolarHBondContact CA-O 3.47Å; S216-K224 PolarHBondContact N-O 3.47Å; S216-K224 PolarHBondContact O-N 3.27Å; S216-K224 PolarHBondContact OG-O 3.36Å; D220-K224 VanDerWaalsContact OD2-CE 3.28Å; D220-K224 WeakPolarHBondContact OD2-CE 3.13Å; D220-K224 IonicContact OD2-NZ 3.87Å; D220-K224 PolarHBondContact OD2-NZ 3.43Å; V222-K224 HydrophobicContact CG1-CG 4.26Å; K224-W226 HydrophobicContact CB-CZ2 4.31Å; K224-W226 HydrophobicContact CD-CZ2 4Å; K224-M235 CarbonylContact C-O 3.53Å; K224-M235 WeakPolarHBondContact CA-O 3.29Å; K224-L236 HydrophobicContact CB-CD2 4.43Å; K224-L236 HydrophobicContact CD-CD2 4.3Å; K224-L236 HydrophobicContact CG-CD2 3.76Å
225	G	94.5	Very high	92.7	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	122.1	170.3	0	0	0	0	0	110.2	I214 A233 S234 M235	I214-G225 CarbonylContact O-C 3.56Å; I214-G225 WeakPolarHBondContact O-CA 3.41Å; G225-A233 CarbonylContact O-C 3.59Å; G225-A233 WeakPolarHBondContact O-CA 3.49Å; G225-S234 PolarHBondContact O-N 3.41Å; G225-S234 PolarHBondContact O-OG 3.32Å; G225-M235 PolarHBondContact N-O 3.17Å; G225-M235 PolarHBondContact O-N 2.9Å; G225-M235 VanDerWaalsContact O-N 3.13Å
226	W	94.1	Very high	92.6	Very high	22 Å²	22	51.2 Å²	51.2	8%	0.083	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	124.9	-178.3	-56.4	90	0	0	0	109.7	I182 F196 M213 I214 S216 K224 A233	I182-W226 HydrophobicContact CD1-CZ2 4.22Å; I182-W226 VanDerWaalsContact CD1-NE1 3.25Å; F196-W226 HydrophobicContact CB-CD2 4.2Å; F196-W226 HydrophobicContact CB-CE3 4.06Å; F196-W226 HydrophobicContact CB-CZ3 4.24Å; F196-W226 HydrophobicContact CD1-CB 4.47Å; F196-W226 HydrophobicContact CD1-CD2 4.31Å; F196-W226 AromaticContact CD1-CE3 3.82Å; F196-W226 HydrophobicContact CD1-CE3 3.82Å; F196-W226 HydrophobicContact CD1-CZ3 4.46Å; F196-W226 HydrophobicContact CG-CD2 4.31Å; F196-W226 HydrophobicContact CG-CE3 4.18Å; M213-W226 CarbonylContact C-O 3.51Å; M213-W226 VanDerWaalsContact CA-O 3.26Å; M213-W226 WeakPolarHBondContact CA-O 3.49Å; I214-W226 HydrophobicContact CB-CB 4.35Å; I214-W226 PolarHBondContact N-O 2.61Å; I214-W226 PolarHBondContact O-N 3.03Å; S216-W226 PolarHBondContact OG-NE1 3.46Å; K224-W226 HydrophobicContact CB-CZ2 4.31Å; K224-W226 HydrophobicContact CD-CZ2 4Å; W226-A233 HydrophobicContact CD2-CB 4.28Å; W226-A233 HydrophobicContact CE3-CB 3.88Å; W226-A233 HydrophobicContact CH2-CB 4.14Å; W226-A233 HydrophobicContact CZ3-CB 3.81Å
227	D	93	Very high	92.4	Very high	25 Å²	25	51.4 Å²	51.4	13%	0.134	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	119.6	175	-176.6	-17.9	0	0	0	109.4	M213 R229 K230 L231 E232	M213-D227 WeakPolarHBondContact SD-CA 3.48Å; M213-D227 HydrophobicContact SD-CB 3.67Å; D227-R229 PolarHBondContact O-N 3.3Å; D227-R229 WeakPolarHBondContact OD1-CB 3.48Å; D227-R229 PolarHBondContact OD1-N 3.04Å; D227-K230 HydrophobicContact CB-CB 4.18Å; D227-K230 PolarHBondContact O-N 2.85Å; D227-K230 WeakPolarHBondContact OD2-CD 3.46Å; D227-K230 WeakPolarHBondContact OD2-CG 3.5Å; D227-L231 WeakPolarHBondContact O-CA 3.33Å; D227-L231 PolarHBondContact O-N 2.58Å; D227-E232 PolarHBondContact N-O 3.41Å
228	L	90.2	Very high	92.2	Very high	23 Å²	23	55.6 Å²	55.6	12%	0.12	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-21.1	-178.2	-69.5	177.4	0	0	0	113.5	L184 F196 F207 S211 E212 I214 L231	L184-L228 HydrophobicContact CD2-CD2 4.01Å; F196-L228 HydrophobicContact CE2-CD2 3.97Å; F196-L228 HydrophobicContact CZ-CD2 3.75Å; F207-L228 HydrophobicContact CE1-CD1 4.26Å; S211-L228 VanDerWaalsContact O-CD1 3.23Å; S211-L228 WeakPolarHBondContact O-CD1 3.35Å; E212-L228 WeakPolarHBondContact O-CB 3.37Å; E212-L228 WeakPolarHBondContact O-CG 3.47Å; E212-L228 PolarHBondContact O-N 3.43Å; I214-L228 HydrophobicContact CD1-CD2 3.56Å; I214-L228 HydrophobicContact CD1-CG 4.45Å; I214-L228 HydrophobicContact CG1-CD2 3.99Å; I214-L228 HydrophobicContact CG1-CG 4.39Å; L228-L231 WeakPolarHBondContact O-CD2 3.49Å
229	R	90.2	Very high	92	Very high	189 Å²	189	56.9 Å²	56.9	71%	0.713	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-45.4	177.9	-66.4	-174.9	175.6	130.8	7.7	111.7	E212 D227	E212-R229 IonicContact OE1-CZ 3.55Å; E212-R229 IonicContact OE1-NH1 3.39Å; E212-R229 PolarHBondContact OE1-NH1 2.92Å; E212-R229 IonicContact OE1-NH2 3.73Å; E212-R229 PolarHBondContact OE1-NH2 3.03Å; D227-R229 PolarHBondContact O-N 3.3Å; D227-R229 WeakPolarHBondContact OD1-CB 3.48Å; D227-R229 PolarHBondContact OD1-N 3.04Å
230	K	90.1	Very high	91.9	Very high	144 Å²	144	54.4 Å²	54.4	63%	0.626	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-21.3	-178.3	-64.9	-179.1	-176.5	177.3	0	113.1	D227 E232	D227-K230 HydrophobicContact CB-CB 4.18Å; D227-K230 PolarHBondContact O-N 2.85Å; D227-K230 WeakPolarHBondContact OD2-CD 3.46Å; D227-K230 WeakPolarHBondContact OD2-CG 3.5Å; K230-E232 PolarHBondContact O-N 3.48Å
231	L	89.4	Confident	92	Very high	89 Å²	89	58.4 Å²	58.4	47%	0.466	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	62	26.9	-174.9	-54.8	175	0	0	0	114.7	Q194 F196 D227 L228	Q194-L231 HydrophobicContact CG-CD2 4.06Å; Q194-L231 VanDerWaalsContact OE1-CD2 3.29Å; F196-L231 HydrophobicContact CE1-CB 4.31Å; F196-L231 HydrophobicContact CE1-CD2 3.79Å; F196-L231 HydrophobicContact CZ-CD2 3.93Å; D227-L231 WeakPolarHBondContact O-CA 3.33Å; D227-L231 PolarHBondContact O-N 2.58Å; L228-L231 WeakPolarHBondContact O-CD2 3.49Å
232	E	89.9	Confident	92	Very high	134 Å²	134	59.1 Å²	59.1	63%	0.626	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.2	157.7	-177.2	-68.6	-179.3	169.8	0	0	110.7	D227 K230 S234	D227-E232 PolarHBondContact N-O 3.41Å; K230-E232 PolarHBondContact O-N 3.48Å; E232-S234 PolarHBondContact O-N 2.89Å; E232-S234 VanDerWaalsContact O-N 3.14Å
233	A	89.3	Confident	92	Very high	43 Å²	43	58 Å²	58	36%	0.355	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	104.6	170.9	0	0	0	0	0	109	G225 W226	G225-A233 CarbonylContact O-C 3.59Å; G225-A233 WeakPolarHBondContact O-CA 3.49Å; W226-A233 HydrophobicContact CD2-CB 4.28Å; W226-A233 HydrophobicContact CE3-CB 3.88Å; W226-A233 HydrophobicContact CH2-CB 4.14Å; W226-A233 HydrophobicContact CZ3-CB 3.81Å
234	S	89.4	Confident	92	Very high	59 Å²	59	58 Å²	58	41%	0.413	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	-22.7	-178.3	65.6	0	0	0	0	112.9	M213 G225 E232	M213-S234 WeakPolarHBondContact CE-OG 3.39Å; G225-S234 PolarHBondContact O-N 3.41Å; G225-S234 PolarHBondContact O-OG 3.32Å; E232-S234 PolarHBondContact O-N 2.89Å; E232-S234 VanDerWaalsContact O-N 3.14Å
235	M	89	Confident	92	Very high	31 Å²	31	56.5 Å²	56.5	15%	0.153	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	133.4	-179.8	-61.8	-172.3	-178.5	0	0	111.2	M213 F215 K224 G225	M213-M235 HydrophobicContact CE-CE 4.26Å; M213-M235 HydrophobicContact CE-CG 4.08Å; M213-M235 HydrophobicContact CE-SD 4.12Å; F215-M235 HydrophobicContact CE1-SD 4.38Å; K224-M235 CarbonylContact C-O 3.53Å; K224-M235 WeakPolarHBondContact CA-O 3.29Å; G225-M235 PolarHBondContact N-O 3.17Å; G225-M235 PolarHBondContact O-N 2.9Å; G225-M235 VanDerWaalsContact O-N 3.13Å
236	L	92.7	Very high	92	Very high	114 Å²	114	56.5 Å²	56.5	60%	0.597	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.9	112.3	171.1	-63.1	175.3	0	0	0	108	V222 K224	V222-L236 HydrophobicContact CG1-CB 4.26Å; V222-L236 HydrophobicContact CG1-CD2 4.2Å; K224-L236 HydrophobicContact CB-CD2 4.43Å; K224-L236 HydrophobicContact CD-CD2 4.3Å; K224-L236 HydrophobicContact CG-CD2 3.76Å
237	L	92.3	Very high	92.1	Very high	3 Å²	3	56.1 Å²	56.1	2%	0.016	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	87.8	177.7	-56	173.8	0	0	0	108	V223 L256 W268 R278	V223-L237 HydrophobicContact CB-CB 4.01Å; V223-L237 HydrophobicContact CB-CD1 4.09Å; V223-L237 HydrophobicContact CG1-CD1 4.08Å; V223-L237 PolarHBondContact N-O 3.04Å; V223-L237 VanDerWaalsContact N-O 3.12Å; V223-L237 WeakPolarHBondContact O-CB 3.47Å; V223-L237 PolarHBondContact O-N 2.98Å; L237-L256 HydrophobicContact CD1-CD2 3.99Å; L237-W268 HydrophobicContact CB-CD2 4Å; L237-W268 HydrophobicContact CB-CE3 3.85Å; L237-W268 HydrophobicContact CB-CH2 4.26Å; L237-W268 HydrophobicContact CB-CZ2 4.4Å; L237-W268 HydrophobicContact CB-CZ3 3.98Å; L237-W268 HydrophobicContact CD1-CB 3.89Å; L237-W268 HydrophobicContact CD1-CD2 4.07Å; L237-W268 HydrophobicContact CD1-CE3 4.42Å; L237-W268 HydrophobicContact CD1-CG 3.83Å; L237-W268 HydrophobicContact CD2-CD2 4.36Å; L237-W268 HydrophobicContact CD2-CE3 3.89Å; L237-W268 HydrophobicContact CG-CD2 4.37Å; L237-W268 HydrophobicContact CG-CE3 4.27Å; L237-R278 HydrophobicContact CD2-CB 3.76Å; L237-R278 HydrophobicContact CD2-CG 4.18Å
238	S	91.5	Very high	92.2	Very high	88 Å²	88	56.2 Å²	56.2	62%	0.615	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.7	134.6	177.4	57.4	0	0	0	0	110.7
239	G	89.2	Confident	92.4	Very high	28 Å²	28	55.3 Å²	55.3	29%	0.289	30%	0.299	S	S	.	.			trans	169	-28.7	170.4	0	0	0	0	0	113.8	R266	G239-R266 VanDerWaalsContact CA-NH1 3.33Å; G239-R266 PolarHBondContact O-NH1 2.73Å; G239-R266 PolarHBondContact O-NH2 2.74Å
240	H	93.6	Very high	92.6	Very high	11 Å²	11	46.3 Å²	46.3	5%	0.051	27%	0.265	C	S	.	.			trans	-65	144.6	173.9	-76	-65.5	0	0	0	111.4	N221 V244 S258 S260 D262 R266	N221-H240 WeakPolarHBondContact O-CB 3.25Å; H240-V244 HydrophobicContact CB-CG2 4.34Å; H240-S258 WeakPolarHBondContact NE2-CB 3.43Å; H240-S258 PolarHBondContact NE2-OG 3.01Å; H240-S260 VanDerWaalsContact CE1-CB 3.41Å; H240-S260 WeakPolarHBondContact CE1-CB 3.45Å; H240-S260 WeakPolarHBondContact ND1-CB 3.48Å; H240-D262 WeakPolarHBondContact CA-OD2 3.38Å; H240-D262 IonicContact CG-OD2 3.23Å; H240-D262 IonicContact ND1-OD1 2.89Å; H240-D262 IonicContact ND1-OD2 3.85Å; H240-D262 PolarHBondContact ND1-OD2 2.96Å; H240-R266 VanDerWaalsContact CE1-CD 3.49Å; H240-R266 WeakPolarHBondContact CE1-CD 3.37Å
241	T	94.1	Very high	92.6	Very high	107 Å²	107	41.6 Å²	41.6	66%	0.656	25%	0.249	S	C	*	.	S	Bend	trans	-98.9	-7.7	178.7	58.2	0	0	0	0	112.7	N221 D262	N221-T241 PolarHBondContact ND2-O 2.78Å; T241-D262 PolarHBondContact N-OD2 3.27Å; T241-D262 VanDerWaalsContact N-OD2 3.1Å; T241-D262 WeakPolarHBondContact OG1-CB 3.28Å
242	D	94.3	Very high	92.6	Very high	65 Å²	65	40.8 Å²	40.8	35%	0.348	25%	0.245	S	C	.	.	S	Bend	trans	-145.1	176.1	179.8	-149.2	-33.2	0	0	0	110.2	N221 S260 M261 D262	N221-D242 WeakPolarHBondContact OD1-CA 3.03Å; N221-D242 PolarHBondContact OD1-O 3.26Å; D242-S260 PolarHBondContact O-OG 3.17Å; D242-M261 HydrophobicContact CB-CB 3.95Å; D242-D262 HydrophobicContact CB-CB 4.02Å
243	T	94.9	Very high	92.6	Very high	11 Å²	11	35.3 Å²	35.3	7%	0.067	22%	0.224	C	C	.	.			trans	-54	141.6	-175.3	61.7	0	0	0	0	112.9	G218 I219 N221 S260 M261	G218-T243 WeakPolarHBondContact O-CA 3.37Å; I219-T243 HydrophobicContact CB-CG2 3.94Å; I219-T243 HydrophobicContact CG1-CG2 3.95Å; I219-T243 HydrophobicContact CG2-CG2 3.7Å; N221-T243 PolarHBondContact OD1-N 2.71Å; N221-T243 VanDerWaalsContact OD1-N 3.12Å; T243-S260 CarbonylContact O-C 3.58Å; T243-S260 WeakPolarHBondContact O-CA 3.37Å; T243-S260 WeakPolarHBondContact O-CB 3.22Å; T243-S260 PolarHBondContact O-OG 3.01Å; T243-M261 HydrophobicContact CG2-CE 4.32Å; T243-M261 PolarHBondContact O-N 2.82Å; T243-M261 WeakPolarHBondContact OG1-CE 3.31Å; T243-M261 WeakPolarHBondContact OG1-CG 3.5Å; T243-M261 PolarHBondContact OG1-SD 3.29Å
244	V	95.8	Very high	92.8	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	111.7	179.3	-179.2	0	0	0	0	108.9	L203 G218 V223 H240 L247 N259	L203-V244 WeakPolarHBondContact CB-O 3.49Å; G218-V244 PolarHBondContact O-N 2.96Å; V223-V244 HydrophobicContact CG2-CG1 4.1Å; V223-V244 HydrophobicContact CG2-CG2 4.05Å; H240-V244 HydrophobicContact CB-CG2 4.34Å; V244-L247 HydrophobicContact CG1-CD2 3.9Å; V244-L247 HydrophobicContact CG1-CG 4.24Å; V244-N259 CarbonylContact C-O 3.56Å; V244-N259 WeakPolarHBondContact CA-O 3.4Å; V244-N259 WeakPolarHBondContact CG1-O 3.42Å
245	T	95.3	Very high	93	Very high	0 Å²	0	34 Å²	34	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	-30.5	-173.3	51.6	0	0	0	0	112.9	N259 M261 H288 L295 R296	T245-N259 PolarHBondContact N-O 2.83Å; T245-N259 PolarHBondContact OG1-O 2.81Å; T245-M261 HydrophobicContact CG2-CE 3.97Å; T245-M261 HydrophobicContact CG2-CG 3.82Å; T245-H288 PolarHBondContact OG1-NE2 2.91Å; T245-L295 PolarHBondContact OG1-O 2.93Å; T245-R296 PolarHBondContact O-NH1 3.46Å
246	G	94.3	Very high	93.3	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	142.2	-175.3	0	0	0	0	0	112.7	S258 N259 L295	G246-S258 WeakPolarHBondContact O-CA 3.43Å; G246-N259 PolarHBondContact N-O 2.8Å; G246-N259 PolarHBondContact O-N 3.29Å; G246-L295 WeakPolarHBondContact CA-O 3.24Å; G246-L295 PolarHBondContact N-O 2.49Å
247	L	95.9	Very high	93.4	Very high	15 Å²	15	27 Å²	27	8%	0.079	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	138.5	174.1	-69.1	179.1	0	0	0	109.8	S204 T206 F215 G217 V223 V244 L256 L257	S204-L247 WeakPolarHBondContact OG-CB 3.4Å; S204-L247 PolarHBondContact OG-N 2.89Å; T206-L247 HydrophobicContact CG2-CB 3.86Å; T206-L247 HydrophobicContact CG2-CD1 4.4Å; F215-L247 HydrophobicContact CB-CD1 4.32Å; G217-L247 VanDerWaalsContact N-CD1 3.29Å; V223-L247 HydrophobicContact CG1-CD1 3.97Å; V223-L247 HydrophobicContact CG1-CD2 3.94Å; V223-L247 HydrophobicContact CG2-CD2 3.89Å; V244-L247 HydrophobicContact CG1-CD2 3.9Å; V244-L247 HydrophobicContact CG1-CG 4.24Å; L247-L256 HydrophobicContact CB-CD1 4.36Å; L247-L256 HydrophobicContact CD2-CD1 4.41Å; L247-L256 HydrophobicContact CD2-CD2 4.26Å; L247-L256 HydrophobicContact CD2-CG 4.39Å; L247-L257 VanDerWaalsContact CA-O 3.32Å; L247-L257 WeakPolarHBondContact CA-O 3.33Å
248	S	95.2	Very high	93.6	Very high	26 Å²	26	26.9 Å²	26.9	18%	0.182	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	127.7	171	-170.6	0	0	0	0	110.5	L257 C297 W299	S248-L257 PolarHBondContact N-O 2.94Å; S248-L257 PolarHBondContact O-N 2.9Å; S248-C297 WeakPolarHBondContact CB-O 3.41Å; S248-W299 PolarHBondContact O-NE1 2.91Å
249	V	94.5	Very high	93.8	Very high	5 Å²	5	22.7 Å²	22.7	3%	0.03	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	141.2	172.4	173.8	0	0	0	0	109.6	T206 F207 F215 L256 I270	T206-V249 HydrophobicContact CG2-CG2 3.72Å; F207-V249 VanDerWaalsContact O-CG2 3.31Å; F207-V249 WeakPolarHBondContact O-CG2 3.22Å; F215-V249 HydrophobicContact CD2-CG2 4.12Å; F215-V249 HydrophobicContact CE2-CG2 4.42Å; V249-L256 HydrophobicContact CG2-CD1 3.48Å; V249-L256 VanDerWaalsContact CG2-CD1 3.48Å; V249-I270 HydrophobicContact CG1-CD1 3.99Å; V249-I270 HydrophobicContact CG2-CD1 4.27Å
250	S	93.7	Very high	94.1	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	13%	0.127	C	C	.	.			trans	-62.5	149.9	174.7	56.1	0	0	0	0	111.2	R167 D252 G253 S254 F255	R167-S250 PolarHBondContact NH2-O 2.82Å; S250-D252 VanDerWaalsContact CB-OD1 3.26Å; S250-D252 WeakPolarHBondContact CB-OD1 3.06Å; S250-D252 PolarHBondContact O-N 2.89Å; S250-D252 PolarHBondContact OG-OD1 3.39Å; S250-G253 PolarHBondContact O-N 3.03Å; S250-G253 PolarHBondContact OG-N 2.74Å; S250-S254 PolarHBondContact OG-N 3.29Å; S250-F255 PolarHBondContact N-O 3.24Å; S250-F255 PolarHBondContact OG-N 3.06Å; S250-F255 PolarHBondContact OG-O 3.45Å; S250-F255 VanDerWaalsContact OG-O 3.06Å
251	P	89.7	Confident	94.1	Very high	45 Å²	45	22 Å²	22	29%	0.292	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.5	-33.9	171	-28.7	25.9	0	0	0	115.1	G253 W299 I301 N303	P251-G253 VanDerWaalsContact C-N 3.29Å; P251-G253 PolarHBondContact O-N 3.03Å; P251-W299 HydrophobicContact CG-CB 4.45Å; P251-I301 HydrophobicContact CB-CD1 4.08Å; P251-I301 HydrophobicContact CG-CD1 4.16Å; P251-N303 WeakPolarHBondContact CD-OD1 3.25Å; P251-N303 WeakPolarHBondContact CG-OD1 3.47Å
252	D	89.7	Confident	94.1	Very high	72 Å²	72	18.1 Å²	18.1	39%	0.385	11%	0.106	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-5.7	176.8	67.2	7	0	0	0	114.2	S250 S254 N303	S250-D252 VanDerWaalsContact CB-OD1 3.26Å; S250-D252 WeakPolarHBondContact CB-OD1 3.06Å; S250-D252 PolarHBondContact O-N 2.89Å; S250-D252 PolarHBondContact OG-OD1 3.39Å; D252-S254 PolarHBondContact O-N 2.95Å; D252-S254 WeakPolarHBondContact OD1-CB 2.83Å; D252-S254 PolarHBondContact OD1-N 2.8Å; D252-N303 VanDerWaalsContact CB-ND2 3.35Å; D252-N303 WeakPolarHBondContact CB-ND2 3.26Å; D252-N303 PolarHBondContact OD2-ND2 2.93Å
253	G	91.1	Very high	94	Very high	18 Å²	18	18 Å²	18	19%	0.186	11%	0.105	C	C	.	.	S	Bend	trans	68	7.5	-178.2	0	0	0	0	0	115.4	S250 P251 I270	S250-G253 PolarHBondContact O-N 3.03Å; S250-G253 PolarHBondContact OG-N 2.74Å; P251-G253 VanDerWaalsContact C-N 3.29Å; P251-G253 PolarHBondContact O-N 3.03Å; G253-I270 VanDerWaalsContact O-CD1 3.29Å; G253-I270 WeakPolarHBondContact O-CD1 3.48Å; G253-I270 WeakPolarHBondContact O-CG1 3.15Å
254	S	92.2	Very high	94	Very high	28 Å²	28	18.6 Å²	18.6	20%	0.196	11%	0.109	C	C	.	.	S	Bend	trans	-87.8	-28.8	-177.2	-65.5	0	0	0	0	113.1	S250 D252 I270	S250-S254 PolarHBondContact OG-N 3.29Å; D252-S254 PolarHBondContact O-N 2.95Å; D252-S254 WeakPolarHBondContact OD1-CB 2.83Å; D252-S254 PolarHBondContact OD1-N 2.8Å; S254-I270 VanDerWaalsContact C-CG1 3.49Å; S254-I270 VanDerWaalsContact O-CG1 3.22Å; S254-I270 WeakPolarHBondContact O-CG1 3.4Å; S254-I270 PolarHBondContact O-N 3.28Å
255	F	94.3	Very high	94	Very high	46 Å²	46	18.6 Å²	18.6	20%	0.202	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	149.5	-173.7	-59.1	-74.3	0	0	0	112.3	S250 M267 W268 D269 T280 W299	S250-F255 PolarHBondContact N-O 3.24Å; S250-F255 PolarHBondContact OG-N 3.06Å; S250-F255 PolarHBondContact OG-O 3.45Å; S250-F255 VanDerWaalsContact OG-O 3.06Å; F255-M267 HydrophobicContact CB-CG 4.06Å; F255-M267 HydrophobicContact CD1-CE 3.97Å; F255-M267 HydrophobicContact CD1-CG 4.17Å; F255-M267 HydrophobicContact CD1-SD 4.43Å; F255-M267 HydrophobicContact CE1-CE 4.06Å; F255-M267 HydrophobicContact CG-CE 4.41Å; F255-M267 HydrophobicContact CG-CG 4.31Å; F255-M267 HydrophobicContact CG-SD 4.4Å; F255-W268 CarbonylContact C-O 3.56Å; F255-W268 VanDerWaalsContact CA-O 3.23Å; F255-W268 WeakPolarHBondContact CA-O 3.29Å; F255-D269 HydrophobicContact CE1-CB 4.46Å; F255-T280 HydrophobicContact CE1-CG2 4.31Å; F255-W299 HydrophobicContact CB-CH2 3.62Å; F255-W299 HydrophobicContact CB-CZ2 3.6Å; F255-W299 HydrophobicContact CG-CH2 4.3Å
256	L	95.3	Very high	94	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	128.8	171.8	177.2	73.4	0	0	0	108.8	T206 F215 V223 L237 L247 V249 M267 W268 I270	T206-L256 HydrophobicContact CG2-CD1 3.65Å; F215-L256 HydrophobicContact CB-CD1 4.43Å; F215-L256 HydrophobicContact CB-CD2 4Å; F215-L256 HydrophobicContact CD1-CD2 4.02Å; F215-L256 HydrophobicContact CD2-CD1 4.4Å; F215-L256 HydrophobicContact CD2-CD2 4.43Å; F215-L256 HydrophobicContact CG-CD1 4.47Å; F215-L256 HydrophobicContact CG-CD2 3.88Å; V223-L256 HydrophobicContact CG1-CD2 3.73Å; L237-L256 HydrophobicContact CD1-CD2 3.99Å; L247-L256 HydrophobicContact CB-CD1 4.36Å; L247-L256 HydrophobicContact CD2-CD1 4.41Å; L247-L256 HydrophobicContact CD2-CD2 4.26Å; L247-L256 HydrophobicContact CD2-CG 4.39Å; V249-L256 HydrophobicContact CG2-CD1 3.48Å; V249-L256 VanDerWaalsContact CG2-CD1 3.48Å; L256-M267 CarbonylContact O-C 3.57Å; L256-M267 WeakPolarHBondContact O-CA 3.25Å; L256-W268 HydrophobicContact CB-CB 4.29Å; L256-W268 PolarHBondContact N-O 2.9Å; L256-W268 PolarHBondContact O-N 3.42Å; L256-I270 HydrophobicContact CB-CD1 4.45Å; L256-I270 HydrophobicContact CB-CG2 3.61Å; L256-I270 HydrophobicContact CD2-CG2 4.29Å
257	L	95.7	Very high	94	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	138.8	166.7	-72.9	168.2	0	0	0	109.8	L247 S248 L265 R266 M267 W299 I306	L247-L257 VanDerWaalsContact CA-O 3.32Å; L247-L257 WeakPolarHBondContact CA-O 3.33Å; S248-L257 PolarHBondContact N-O 2.94Å; S248-L257 PolarHBondContact O-N 2.9Å; L257-L265 HydrophobicContact CD2-CD2 4.33Å; L257-L265 HydrophobicContact CD2-CG 4.29Å; L257-R266 WeakPolarHBondContact CA-O 3.21Å; L257-M267 HydrophobicContact CD2-CB 4.03Å; L257-M267 HydrophobicContact CD2-CG 4.22Å; L257-W299 HydrophobicContact CB-CZ2 4.44Å; L257-W299 HydrophobicContact CD1-CD2 3.63Å; L257-W299 HydrophobicContact CD1-CE3 4.37Å; L257-W299 HydrophobicContact CD1-CG 3.87Å; L257-W299 HydrophobicContact CD1-CZ2 3.81Å; L257-W299 HydrophobicContact CD2-CH2 4.41Å; L257-W299 HydrophobicContact CD2-CZ2 3.95Å; L257-W299 HydrophobicContact CG-CD2 4.16Å; L257-W299 HydrophobicContact CG-CH2 4.23Å; L257-W299 HydrophobicContact CG-CZ2 3.37Å; L257-W299 VanDerWaalsContact CG-NE1 3.29Å; L257-I306 HydrophobicContact CD1-CB 3.76Å; L257-I306 HydrophobicContact CD1-CG2 3.45Å; L257-I306 VanDerWaalsContact CD1-CG2 3.45Å; L257-I306 HydrophobicContact CD2-CD1 3.98Å; L257-I306 HydrophobicContact CD2-CG2 4.34Å; L257-I306 HydrophobicContact CG-CG2 4.42Å
258	S	95.8	Very high	93.9	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	130.2	169.4	58.1	0	0	0	0	110.9	H240 G246 L265 R266 W268	H240-S258 WeakPolarHBondContact NE2-CB 3.43Å; H240-S258 PolarHBondContact NE2-OG 3.01Å; G246-S258 WeakPolarHBondContact O-CA 3.43Å; S258-L265 WeakPolarHBondContact O-CA 3.26Å; S258-L265 WeakPolarHBondContact O-CD1 2.94Å; S258-R266 PolarHBondContact N-O 3.03Å; S258-R266 PolarHBondContact O-N 2.89Å; S258-R266 PolarHBondContact OG-O 3.33Å; S258-W268 PolarHBondContact OG-NE1 2.85Å
259	N	95.2	Very high	93.9	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	132.6	173.8	-167.7	24	0	0	0	109.2	V244 T245 G246 L265 H286 H288 L295 C297	V244-N259 CarbonylContact C-O 3.56Å; V244-N259 WeakPolarHBondContact CA-O 3.4Å; V244-N259 WeakPolarHBondContact CG1-O 3.42Å; T245-N259 PolarHBondContact N-O 2.83Å; T245-N259 PolarHBondContact OG1-O 2.81Å; G246-N259 PolarHBondContact N-O 2.8Å; G246-N259 PolarHBondContact O-N 3.29Å; N259-L265 HydrophobicContact CB-CD1 3.85Å; N259-H286 PolarHBondContact OD1-NE2 3.45Å; N259-H286 VanDerWaalsContact OD1-NE2 3.09Å; N259-H288 PolarHBondContact OD1-CE1 3.14Å; N259-L295 WeakPolarHBondContact ND2-CB 3.44Å; N259-L295 PolarHBondContact ND2-O 3.06Å; N259-C297 HydrophobicContact CB-CB 4.44Å
260	S	95.1	Very high	93.7	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	151.4	-174.8	171.1	0	0	0	0	111.9	H240 D242 T243 D262 N263 T264 H288	H240-S260 VanDerWaalsContact CE1-CB 3.41Å; H240-S260 WeakPolarHBondContact CE1-CB 3.45Å; H240-S260 WeakPolarHBondContact ND1-CB 3.48Å; D242-S260 PolarHBondContact O-OG 3.17Å; T243-S260 CarbonylContact O-C 3.58Å; T243-S260 WeakPolarHBondContact O-CA 3.37Å; T243-S260 WeakPolarHBondContact O-CB 3.22Å; T243-S260 PolarHBondContact O-OG 3.01Å; S260-D262 VanDerWaalsContact CB-OD1 3.32Å; S260-D262 WeakPolarHBondContact CB-OD1 3.18Å; S260-D262 PolarHBondContact O-N 3.13Å; S260-D262 VanDerWaalsContact OG-CG 3.25Å; S260-D262 PolarHBondContact OG-N 3.15Å; S260-D262 PolarHBondContact OG-OD1 3.13Å; S260-N263 PolarHBondContact O-N 3.23Å; S260-N263 VanDerWaalsContact O-N 3.08Å; S260-T264 PolarHBondContact N-O 2.89Å; S260-H288 PolarHBondContact O-CE1 3.2Å; S260-H288 PolarHBondContact O-ND1 2.81Å; S260-H288 VanDerWaalsContact O-ND1 3.11Å
261	M	94.5	Very high	93.5	Very high	25 Å²	25	24.8 Å²	24.8	12%	0.123	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-7.8	173.5	-66.8	-162.8	-138.4	0	0	113.5	M15 D242 T243 T245 N263 H288 K292	M15-M261 HydrophobicContact CE-CE 4.15Å; D242-M261 HydrophobicContact CB-CB 3.95Å; T243-M261 HydrophobicContact CG2-CE 4.32Å; T243-M261 PolarHBondContact O-N 2.82Å; T243-M261 WeakPolarHBondContact OG1-CE 3.31Å; T243-M261 WeakPolarHBondContact OG1-CG 3.5Å; T243-M261 PolarHBondContact OG1-SD 3.29Å; T245-M261 HydrophobicContact CG2-CE 3.97Å; T245-M261 HydrophobicContact CG2-CG 3.82Å; M261-N263 PolarHBondContact O-N 3.27Å; M261-H288 HydrophobicContact CB-CB 4.44Å; M261-H288 HydrophobicContact CG-CB 4.39Å; M261-K292 HydrophobicContact CE-CB 4.25Å; M261-K292 HydrophobicContact SD-CB 4.25Å; M261-K292 HydrophobicContact SD-CD 4.38Å; M261-K292 HydrophobicContact SD-CG 4.17Å
262	D	93.6	Very high	93.2	Very high	24 Å²	24	27.8 Å²	27.8	13%	0.128	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	2.5	169.4	69.6	13.1	0	0	0	114.1	H240 T241 D242 S260 T264	H240-D262 WeakPolarHBondContact CA-OD2 3.38Å; H240-D262 IonicContact CG-OD2 3.23Å; H240-D262 IonicContact ND1-OD1 2.89Å; H240-D262 IonicContact ND1-OD2 3.85Å; H240-D262 PolarHBondContact ND1-OD2 2.96Å; T241-D262 PolarHBondContact N-OD2 3.27Å; T241-D262 VanDerWaalsContact N-OD2 3.1Å; T241-D262 WeakPolarHBondContact OG1-CB 3.28Å; D242-D262 HydrophobicContact CB-CB 4.02Å; S260-D262 VanDerWaalsContact CB-OD1 3.32Å; S260-D262 WeakPolarHBondContact CB-OD1 3.18Å; S260-D262 PolarHBondContact O-N 3.13Å; S260-D262 VanDerWaalsContact OG-CG 3.25Å; S260-D262 PolarHBondContact OG-N 3.15Å; S260-D262 PolarHBondContact OG-OD1 3.13Å; D262-T264 PolarHBondContact O-N 3.39Å; D262-T264 WeakPolarHBondContact OD1-CA 3.17Å; D262-T264 VanDerWaalsContact OD1-CB 3.27Å; D262-T264 WeakPolarHBondContact OD1-CB 3.42Å; D262-T264 PolarHBondContact OD1-N 2.86Å; D262-T264 PolarHBondContact OD1-OG1 3.49Å; D262-T264 PolarHBondContact OD2-OG1 3.48Å
263	N	93.1	Very high	92.8	Very high	62 Å²	62	33.9 Å²	33.9	33%	0.332	17%	0.171	S	C	.	.	S	Bend	trans	63.3	22.4	-177.1	-55.5	-39.5	0	0	0	113.3	S260 M261 H286 Q287 H288	S260-N263 PolarHBondContact O-N 3.23Å; S260-N263 VanDerWaalsContact O-N 3.08Å; M261-N263 PolarHBondContact O-N 3.27Å; N263-H286 VanDerWaalsContact C-NE2 3.28Å; N263-H286 WeakPolarHBondContact CA-NE2 3.4Å; N263-H286 PolarHBondContact O-CE1 2.6Å; N263-Q287 WeakPolarHBondContact OD1-CA 3.47Å; N263-H288 PolarHBondContact OD1-N 3.22Å
264	T	94.7	Very high	92.2	Very high	24 Å²	24	34 Å²	34	15%	0.147	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	137	174.8	78.3	0	0	0	0	111.4	S260 D262 R266 I282	S260-T264 PolarHBondContact N-O 2.89Å; D262-T264 PolarHBondContact O-N 3.39Å; D262-T264 WeakPolarHBondContact OD1-CA 3.17Å; D262-T264 VanDerWaalsContact OD1-CB 3.27Å; D262-T264 WeakPolarHBondContact OD1-CB 3.42Å; D262-T264 PolarHBondContact OD1-N 2.86Å; D262-T264 PolarHBondContact OD1-OG1 3.49Å; D262-T264 PolarHBondContact OD2-OG1 3.48Å; T264-R266 PolarHBondContact OG1-NE 3.37Å; T264-I282 HydrophobicContact CG2-CG2 4.41Å
265	L	94.6	Very high	91.7	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	119.4	174.5	-177.3	80.5	0	0	0	105.3	L257 S258 N259 F283 H286 C297 I306 W318	L257-L265 HydrophobicContact CD2-CD2 4.33Å; L257-L265 HydrophobicContact CD2-CG 4.29Å; S258-L265 WeakPolarHBondContact O-CA 3.26Å; S258-L265 WeakPolarHBondContact O-CD1 2.94Å; N259-L265 HydrophobicContact CB-CD1 3.85Å; L265-F283 HydrophobicContact CB-CB 4.19Å; L265-F283 HydrophobicContact CD2-CB 4.44Å; L265-F283 HydrophobicContact CD2-CD2 4.34Å; L265-F283 PolarHBondContact N-O 2.68Å; L265-F283 WeakPolarHBondContact O-CD2 3.33Å; L265-F283 PolarHBondContact O-N 3.44Å; L265-H286 PolarHBondContact N-CE1 3.46Å; L265-C297 HydrophobicContact CD1-CB 3.94Å; L265-I306 HydrophobicContact CD2-CD1 3.61Å; L265-I306 HydrophobicContact CD2-CG1 4.24Å; L265-W318 HydrophobicContact CD2-CE3 4.18Å; L265-W318 HydrophobicContact CD2-CZ3 4.08Å
266	R	95.2	Very high	91	Very high	36 Å²	36	39.6 Å²	39.6	14%	0.136	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	141.8	-174.5	-63.4	-174	-177.1	-148.9	8.2	110.6	G239 H240 L257 S258 T264 W268 I282	G239-R266 VanDerWaalsContact CA-NH1 3.33Å; G239-R266 PolarHBondContact O-NH1 2.73Å; G239-R266 PolarHBondContact O-NH2 2.74Å; H240-R266 VanDerWaalsContact CE1-CD 3.49Å; H240-R266 WeakPolarHBondContact CE1-CD 3.37Å; L257-R266 WeakPolarHBondContact CA-O 3.21Å; S258-R266 PolarHBondContact N-O 3.03Å; S258-R266 PolarHBondContact O-N 2.89Å; S258-R266 PolarHBondContact OG-O 3.33Å; T264-R266 PolarHBondContact OG1-NE 3.37Å; R266-W268 HydrophobicContact CB-CZ2 4.05Å; R266-I282 HydrophobicContact CG-CG1 4.34Å
267	M	95.4	Very high	90.5	Very high	3 Å²	3	45 Å²	45	2%	0.015	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	119.9	176.3	-169	176.3	88.1	0	0	109.6	F255 L256 L257 T280 K281 F283 W299 V320	F255-M267 HydrophobicContact CB-CG 4.06Å; F255-M267 HydrophobicContact CD1-CE 3.97Å; F255-M267 HydrophobicContact CD1-CG 4.17Å; F255-M267 HydrophobicContact CD1-SD 4.43Å; F255-M267 HydrophobicContact CE1-CE 4.06Å; F255-M267 HydrophobicContact CG-CE 4.41Å; F255-M267 HydrophobicContact CG-CG 4.31Å; F255-M267 HydrophobicContact CG-SD 4.4Å; L256-M267 CarbonylContact O-C 3.57Å; L256-M267 WeakPolarHBondContact O-CA 3.25Å; L257-M267 HydrophobicContact CD2-CB 4.03Å; L257-M267 HydrophobicContact CD2-CG 4.22Å; M267-T280 WeakPolarHBondContact CE-OG1 3.48Å; M267-T280 PolarHBondContact O-N 2.88Å; M267-T280 PolarHBondContact O-OG1 3.11Å; M267-K281 HydrophobicContact CB-CB 4.14Å; M267-K281 HydrophobicContact CE-CB 4.18Å; M267-K281 HydrophobicContact CE-CD 3.46Å; M267-K281 VanDerWaalsContact CE-CD 3.46Å; M267-K281 HydrophobicContact CE-CG 3.68Å; M267-K281 PolarHBondContact N-O 2.61Å; M267-K281 HydrophobicContact SD-CD 4.25Å; M267-F283 HydrophobicContact CB-CE2 4.12Å; M267-W299 HydrophobicContact CG-CH2 3.9Å; M267-W299 HydrophobicContact CG-CZ2 4.19Å; M267-W299 HydrophobicContact SD-CH2 3.54Å; M267-W299 VanDerWaalsContact SD-CH2 3.54Å; M267-W299 HydrophobicContact SD-CZ2 4.39Å; M267-W299 HydrophobicContact SD-CZ3 4.32Å; M267-V320 HydrophobicContact CE-CG1 4.3Å; M267-V320 HydrophobicContact SD-CG1 3.85Å
268	W	94.4	Very high	90.1	Very high	3 Å²	3	47.3 Å²	47.3	1%	0.011	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	137.5	-176	-53.9	92.2	0	0	0	111.1	L237 F255 L256 S258 R266 I270 R278 C279	L237-W268 HydrophobicContact CB-CD2 4Å; L237-W268 HydrophobicContact CB-CE3 3.85Å; L237-W268 HydrophobicContact CB-CH2 4.26Å; L237-W268 HydrophobicContact CB-CZ2 4.4Å; L237-W268 HydrophobicContact CB-CZ3 3.98Å; L237-W268 HydrophobicContact CD1-CB 3.89Å; L237-W268 HydrophobicContact CD1-CD2 4.07Å; L237-W268 HydrophobicContact CD1-CE3 4.42Å; L237-W268 HydrophobicContact CD1-CG 3.83Å; L237-W268 HydrophobicContact CD2-CD2 4.36Å; L237-W268 HydrophobicContact CD2-CE3 3.89Å; L237-W268 HydrophobicContact CG-CD2 4.37Å; L237-W268 HydrophobicContact CG-CE3 4.27Å; F255-W268 CarbonylContact C-O 3.56Å; F255-W268 VanDerWaalsContact CA-O 3.23Å; F255-W268 WeakPolarHBondContact CA-O 3.29Å; L256-W268 HydrophobicContact CB-CB 4.29Å; L256-W268 PolarHBondContact N-O 2.9Å; L256-W268 PolarHBondContact O-N 3.42Å; S258-W268 PolarHBondContact OG-NE1 2.85Å; R266-W268 HydrophobicContact CB-CZ2 4.05Å; W268-I270 PolarHBondContact O-N 3.01Å; W268-R278 CarbonylContact C-O 3.54Å; W268-R278 VanDerWaalsContact CA-O 3.28Å; W268-R278 WeakPolarHBondContact CA-O 3.29Å; W268-R278 HydrophobicContact CE3-CB 4.16Å; W268-C279 HydrophobicContact CE3-CB 3.96Å; W268-C279 HydrophobicContact CH2-CB 4.18Å; W268-C279 HydrophobicContact CZ3-CB 3.65Å
269	D	93.5	Very high	89.9	Confident	4 Å²	4	48.5 Å²	48.5	2%	0.021	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	110.5	170	-167.7	-10.4	0	0	0	110.1	F255 R271 A274 R278 T280	F255-D269 HydrophobicContact CE1-CB 4.46Å; D269-R271 VanDerWaalsContact OD1-CB 3.27Å; D269-R271 WeakPolarHBondContact OD1-CB 3.43Å; D269-R271 VanDerWaalsContact OD1-CG 3.26Å; D269-R271 WeakPolarHBondContact OD1-CG 3.17Å; D269-R271 IonicContact OD1-CZ 3.45Å; D269-R271 PolarHBondContact OD1-N 2.89Å; D269-R271 VanDerWaalsContact OD1-N 3.07Å; D269-R271 IonicContact OD1-NE 2.89Å; D269-R271 PolarHBondContact OD1-NE 2.87Å; D269-R271 IonicContact OD1-NH2 3.04Å; D269-R271 IonicContact OD2-CZ 3.95Å; D269-R271 IonicContact OD2-NE 3.3Å; D269-R271 PolarHBondContact OD2-NE 3.27Å; D269-R271 IonicContact OD2-NH2 3.43Å; D269-R271 PolarHBondContact OD2-NH2 2.95Å; D269-A274 HydrophobicContact CB-CB 4.09Å; D269-R278 PolarHBondContact N-O 2.92Å; D269-R278 PolarHBondContact O-NH1 3.39Å; D269-R278 VanDerWaalsContact O-NH1 3.09Å; D269-T280 HydrophobicContact CB-CG2 3.86Å
270	I	92	Very high	89.7	Confident	14 Å²	14	50.6 Å²	50.6	7%	0.072	28%	0.279	C	S	.	.			trans	-98.1	6.5	-178.5	56	165.5	0	0	0	112.5	F215 V249 G253 S254 L256 W268	F215-I270 HydrophobicContact CE1-CB 4.36Å; F215-I270 HydrophobicContact CE1-CG2 3.8Å; F215-I270 HydrophobicContact CE2-CB 4.37Å; F215-I270 HydrophobicContact CE2-CD1 3.77Å; F215-I270 HydrophobicContact CE2-CG2 4.2Å; F215-I270 HydrophobicContact CZ-CB 3.75Å; F215-I270 HydrophobicContact CZ-CD1 4.03Å; F215-I270 HydrophobicContact CZ-CG2 3.59Å; V249-I270 HydrophobicContact CG1-CD1 3.99Å; V249-I270 HydrophobicContact CG2-CD1 4.27Å; G253-I270 VanDerWaalsContact O-CD1 3.29Å; G253-I270 WeakPolarHBondContact O-CD1 3.48Å; G253-I270 WeakPolarHBondContact O-CG1 3.15Å; S254-I270 VanDerWaalsContact C-CG1 3.49Å; S254-I270 VanDerWaalsContact O-CG1 3.22Å; S254-I270 WeakPolarHBondContact O-CG1 3.4Å; S254-I270 PolarHBondContact O-N 3.28Å; L256-I270 HydrophobicContact CB-CD1 4.45Å; L256-I270 HydrophobicContact CB-CG2 3.61Å; L256-I270 HydrophobicContact CD2-CG2 4.29Å; W268-I270 PolarHBondContact O-N 3.01Å
271	R	89.4	Confident	89.6	Confident	117 Å²	117	52.2 Å²	52.2	44%	0.442	29%	0.286	S	S	.	.	S	Bend	trans	-63.4	150.8	176.1	-64.9	177.3	-64.7	174.2	3.3	110.6	D269 F273 A274 R278	D269-R271 VanDerWaalsContact OD1-CB 3.27Å; D269-R271 WeakPolarHBondContact OD1-CB 3.43Å; D269-R271 VanDerWaalsContact OD1-CG 3.26Å; D269-R271 WeakPolarHBondContact OD1-CG 3.17Å; D269-R271 IonicContact OD1-CZ 3.45Å; D269-R271 PolarHBondContact OD1-N 2.89Å; D269-R271 VanDerWaalsContact OD1-N 3.07Å; D269-R271 IonicContact OD1-NE 2.89Å; D269-R271 PolarHBondContact OD1-NE 2.87Å; D269-R271 IonicContact OD1-NH2 3.04Å; D269-R271 IonicContact OD2-CZ 3.95Å; D269-R271 IonicContact OD2-NE 3.3Å; D269-R271 PolarHBondContact OD2-NE 3.27Å; D269-R271 IonicContact OD2-NH2 3.43Å; D269-R271 PolarHBondContact OD2-NH2 2.95Å; R271-F273 PolarHBondContact O-N 3.4Å; R271-A274 PolarHBondContact O-N 3.12Å; R271-R278 PolarHBondContact O-NH1 3.29Å
272	P	83.4	Confident	89.6	Confident	108 Å²	108	54.8 Å²	54.8	70%	0.701	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-38.1	175.6	-26.5	34.8	0	0	0	112.7	A274	P272-A274 PolarHBondContact O-N 3.37Å
273	F	80.9	Confident	89.6	Confident	199 Å²	199	53.7 Å²	53.7	87%	0.873	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.2	47.6	-177.2	-59.2	-74.7	0	0	0	113.1	R271	R271-F273 PolarHBondContact O-N 3.4Å
274	A	77.2	Confident	89.6	Confident	22 Å²	22	55.4 Å²	55.4	18%	0.182	31%	0.306	C	S	.	.			trans	-85.6	156.1	178.7	0	0	0	0	0	112.3	D269 R271 P272 R278	D269-A274 HydrophobicContact CB-CB 4.09Å; R271-A274 PolarHBondContact O-N 3.12Å; P272-A274 PolarHBondContact O-N 3.37Å; A274-R278 HydrophobicContact CB-CG 4.13Å
275	P	81.7	Confident	89.3	Confident	77 Å²	77	55.9 Å²	55.9	50%	0.5	32%	0.316	S	S	.	.			trans	-59.1	161.6	168	24.8	-33.9	0	0	0	112.4	D277 R278	P275-D277 VanDerWaalsContact C-N 3.32Å; P275-D277 WeakPolarHBondContact CG-O 3.41Å; P275-D277 PolarHBondContact O-N 2.71Å; P275-R278 WeakPolarHBondContact O-CG 3.32Å
276	A	79.7	Confident	89	Confident	113 Å²	113	56 Å²	56	93%	0.934	32%	0.316	S	S	*	.	S	Bend	trans	-59.8	-41.8	178.8	0	0	0	0	0	112.2	R278	A276-R278 PolarHBondContact O-N 3.22Å
277	D	84.6	Confident	88.8	Confident	113 Å²	113	59.2 Å²	59.2	60%	0.604	33%	0.333	S	S	*	.	S	Bend	trans	-86.2	104.3	166	-172.6	3.2	0	0	0	109.4	P275 C279	P275-D277 VanDerWaalsContact C-N 3.32Å; P275-D277 WeakPolarHBondContact CG-O 3.41Å; P275-D277 PolarHBondContact O-N 2.71Å; D277-C279 VanDerWaalsContact C-N 3.29Å; D277-C279 WeakPolarHBondContact OD1-CB 3.39Å; D277-C279 PolarHBondContact OD1-N 3.04Å
278	R	89.2	Confident	88.5	Confident	49 Å²	49	60.3 Å²	60.3	19%	0.185	34%	0.338	C	S	.	.			trans	-81.1	-9.2	-178.8	-66.9	179.5	178	-97.6	-0.4	112.6	L237 W268 D269 R271 A274 P275 A276 T280	L237-R278 HydrophobicContact CD2-CB 3.76Å; L237-R278 HydrophobicContact CD2-CG 4.18Å; W268-R278 CarbonylContact C-O 3.54Å; W268-R278 VanDerWaalsContact CA-O 3.28Å; W268-R278 WeakPolarHBondContact CA-O 3.29Å; W268-R278 HydrophobicContact CE3-CB 4.16Å; D269-R278 PolarHBondContact N-O 2.92Å; D269-R278 PolarHBondContact O-NH1 3.39Å; D269-R278 VanDerWaalsContact O-NH1 3.09Å; R271-R278 PolarHBondContact O-NH1 3.29Å; A274-R278 HydrophobicContact CB-CG 4.13Å; P275-R278 WeakPolarHBondContact O-CG 3.32Å; A276-R278 PolarHBondContact O-N 3.22Å; R278-T280 PolarHBondContact O-N 3.31Å
279	C	90.4	Very high	88.3	Confident	26 Å²	26	62.3 Å²	62.3	18%	0.176	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	105.8	179	-171.3	0	0	0	0	110	W268 D277	W268-C279 HydrophobicContact CE3-CB 3.96Å; W268-C279 HydrophobicContact CH2-CB 4.18Å; W268-C279 HydrophobicContact CZ3-CB 3.65Å; D277-C279 VanDerWaalsContact C-N 3.29Å; D277-C279 WeakPolarHBondContact OD1-CB 3.39Å; D277-C279 PolarHBondContact OD1-N 3.04Å
280	T	90.5	Very high	88	Confident	44 Å²	44	71 Å²	71	27%	0.27	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	-41.8	-174.9	57.9	0	0	0	0	112.8	F255 M267 D269 R278 R323	F255-T280 HydrophobicContact CE1-CG2 4.31Å; M267-T280 WeakPolarHBondContact CE-OG1 3.48Å; M267-T280 PolarHBondContact O-N 2.88Å; M267-T280 PolarHBondContact O-OG1 3.11Å; D269-T280 HydrophobicContact CB-CG2 3.86Å; R278-T280 PolarHBondContact O-N 3.31Å; T280-R323 PolarHBondContact O-NH2 3.41Å
281	K	93.2	Very high	87.7	Confident	34 Å²	34	73 Å²	73	15%	0.148	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	146.2	-175.3	-58.2	-176.8	-174.1	171.3	0	110.1	M267 F283 V320 R323	M267-K281 HydrophobicContact CB-CB 4.14Å; M267-K281 HydrophobicContact CE-CB 4.18Å; M267-K281 HydrophobicContact CE-CD 3.46Å; M267-K281 VanDerWaalsContact CE-CD 3.46Å; M267-K281 HydrophobicContact CE-CG 3.68Å; M267-K281 PolarHBondContact N-O 2.61Å; M267-K281 HydrophobicContact SD-CD 4.25Å; K281-F283 HydrophobicContact CB-CE2 3.81Å; K281-F283 HydrophobicContact CB-CZ 3.92Å; K281-F283 HydrophobicContact CD-CZ 4.09Å; K281-V320 HydrophobicContact CD-CG1 4.42Å; K281-V320 WeakPolarHBondContact CD-O 3.45Å; K281-V320 WeakPolarHBondContact CE-O 3.22Å; K281-V320 PolarHBondContact NZ-O 2.9Å; K281-R323 HydrophobicContact CD-CG 4.16Å
282	I	94.4	Very high	87.7	Confident	78 Å²	78	72.4 Å²	72.4	40%	0.4	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	129.4	174.5	-54.6	177.4	0	0	0	106.9	T264 R266	T264-I282 HydrophobicContact CG2-CG2 4.41Å; R266-I282 HydrophobicContact CG-CG1 4.34Å
283	F	94.4	Very high	88	Confident	2 Å²	2	68 Å²	68	1%	0.009	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	137.9	176.2	-49.9	-96.9	0	0	0	109	L265 M267 K281 I306 W318 R323	L265-F283 HydrophobicContact CB-CB 4.19Å; L265-F283 HydrophobicContact CD2-CB 4.44Å; L265-F283 HydrophobicContact CD2-CD2 4.34Å; L265-F283 PolarHBondContact N-O 2.68Å; L265-F283 WeakPolarHBondContact O-CD2 3.33Å; L265-F283 PolarHBondContact O-N 3.44Å; M267-F283 HydrophobicContact CB-CE2 4.12Å; K281-F283 HydrophobicContact CB-CE2 3.81Å; K281-F283 HydrophobicContact CB-CZ 3.92Å; K281-F283 HydrophobicContact CD-CZ 4.09Å; F283-I306 HydrophobicContact CD1-CD1 3.86Å; F283-I306 HydrophobicContact CD2-CD1 3.47Å; F283-I306 VanDerWaalsContact CD2-CD1 3.47Å; F283-I306 HydrophobicContact CE1-CD1 3.66Å; F283-I306 HydrophobicContact CE2-CD1 3.3Å; F283-I306 HydrophobicContact CG-CD1 3.76Å; F283-I306 HydrophobicContact CZ-CD1 3.41Å; F283-I306 VanDerWaalsContact CZ-CD1 3.41Å; F283-W318 HydrophobicContact CB-CD2 4.39Å; F283-W318 HydrophobicContact CB-CG 4.28Å; F283-W318 HydrophobicContact CD1-CB 3.84Å; F283-W318 AromaticContact CD1-CG 3.99Å; F283-W318 HydrophobicContact CD1-CG 3.99Å; F283-W318 HydrophobicContact CE1-CB 4.22Å; F283-W318 HydrophobicContact CG-CG 4.45Å; F283-R323 HydrophobicContact CD1-CB 4.23Å; F283-R323 HydrophobicContact CE1-CB 4.09Å; F283-R323 HydrophobicContact CE1-CG 4.16Å
284	T	92.6	Very high	88.4	Confident	97 Å²	97	60.2 Å²	60.2	60%	0.595	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.6	158	-179	56.9	0	0	0	0	109.8	W318	T284-W318 PolarHBondContact O-NE1 2.9Å; T284-W318 VanDerWaalsContact O-NE1 3.09Å
285	G	88.4	Confident	89.3	Confident	35 Å²	35	59.3 Å²	59.3	36%	0.361	33%	0.328	S	S	.	.			trans	133.6	-34.5	173.8	0	0	0	0	0	114.3
286	H	88.2	Confident	89.8	Confident	2 Å²	2	56 Å²	56	1%	0.009	31%	0.306	C	S	.	.			trans	-70.5	156.6	171.5	68.9	-81.1	0	0	0	110.4	N259 N263 L265 H288 W318	N259-H286 PolarHBondContact OD1-NE2 3.45Å; N259-H286 VanDerWaalsContact OD1-NE2 3.09Å; N263-H286 VanDerWaalsContact C-NE2 3.28Å; N263-H286 WeakPolarHBondContact CA-NE2 3.4Å; N263-H286 PolarHBondContact O-CE1 2.6Å; L265-H286 PolarHBondContact N-CE1 3.46Å; H286-H288 AromaticContact CD2-CE1 3.7Å; H286-H288 AromaticContact CD2-ND1 3.71Å; H286-H288 AromaticContact NE2-CE1 3.76Å; H286-H288 AromaticContact NE2-ND1 3.92Å; H286-W318 HydrophobicContact CB-CH2 4.01Å; H286-W318 HydrophobicContact CB-CZ2 4.38Å; H286-W318 AromaticContact ND1-CH2 3.94Å
287	Q	91.7	Very high	90.5	Very high	104 Å²	104	50.8 Å²	50.8	49%	0.486	26%	0.262	S	S	.	.			trans	-131.8	133.9	-178.8	-62	-175.4	-3.4	0	0	109.9	N263 S310 G311 D312	N263-Q287 WeakPolarHBondContact OD1-CA 3.47Å; Q287-S310 PolarHBondContact N-OG 2.75Å; Q287-G311 WeakPolarHBondContact O-CA 3.38Å; Q287-G311 PolarHBondContact O-N 2.95Å; Q287-D312 HydrophobicContact CB-CB 4.39Å
288	H	89.6	Confident	91	Very high	26 Å²	26	45.8 Å²	45.8	12%	0.12	24%	0.237	C	C	.	.			trans	-88.9	130.5	164.4	-70.5	75.4	0	0	0	108.3	T245 N259 S260 M261 N263 H286 L295	T245-H288 PolarHBondContact OG1-NE2 2.91Å; N259-H288 PolarHBondContact OD1-CE1 3.14Å; S260-H288 PolarHBondContact O-CE1 3.2Å; S260-H288 PolarHBondContact O-ND1 2.81Å; S260-H288 VanDerWaalsContact O-ND1 3.11Å; M261-H288 HydrophobicContact CB-CB 4.44Å; M261-H288 HydrophobicContact CG-CB 4.39Å; N263-H288 PolarHBondContact OD1-N 3.22Å; H286-H288 AromaticContact CD2-CE1 3.7Å; H286-H288 AromaticContact CD2-ND1 3.71Å; H286-H288 AromaticContact NE2-CE1 3.76Å; H286-H288 AromaticContact NE2-ND1 3.92Å; H288-L295 WeakPolarHBondContact NE2-CD1 3.17Å
289	T	88.9	Confident	91.2	Very high	45 Å²	45	44.4 Å²	44.4	28%	0.276	23%	0.231	S	C	.	.			trans	-98.1	177	178.3	54.1	0	0	0	0	110.6	E291 K292 G311	T289-E291 PolarHBondContact O-N 3.47Å; T289-K292 PolarHBondContact O-N 3Å; T289-K292 VanDerWaalsContact O-N 3.14Å; T289-G311 WeakPolarHBondContact CG2-O 3.3Å
290	F	88.2	Confident	91.3	Very high	185 Å²	185	43.5 Å²	43.5	81%	0.811	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-13.6	176.6	67.7	-90.4	0	0	0	114.1	K292	F290-K292 PolarHBondContact O-N 2.85Å
291	E	86.1	Confident	91.3	Very high	58 Å²	58	46.4 Å²	46.4	27%	0.271	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-27	176.2	-63.4	178.6	176	0	0	111.7	T289 N293 S335	T289-E291 PolarHBondContact O-N 3.47Å; E291-N293 PolarHBondContact O-N 2.91Å; E291-N293 PolarHBondContact O-OD1 3.03Å; E291-N293 PolarHBondContact OE2-ND2 3.18Å; E291-S335 VanDerWaalsContact OE2-CB 3.26Å; E291-S335 WeakPolarHBondContact OE2-CB 3.16Å; E291-S335 PolarHBondContact OE2-OG 3.38Å
292	K	88.2	Confident	91	Very high	103 Å²	103	48.1 Å²	48.1	45%	0.448	25%	0.249	S	C	.	.			trans	51.2	39.8	-179.2	-57.3	-172.2	-177.7	-174	0	113.3	M15 M261 T289 F290	M15-K292 HydrophobicContact CE-CB 3.53Å; M15-K292 HydrophobicContact CE-CD 3.37Å; M15-K292 HydrophobicContact CE-CG 4.12Å; M15-K292 HydrophobicContact SD-CB 4.39Å; M15-K292 HydrophobicContact SD-CD 3.56Å; M15-K292 VanDerWaalsContact SD-CD 3.56Å; M261-K292 HydrophobicContact CE-CB 4.25Å; M261-K292 HydrophobicContact SD-CB 4.25Å; M261-K292 HydrophobicContact SD-CD 4.38Å; M261-K292 HydrophobicContact SD-CG 4.17Å; T289-K292 PolarHBondContact O-N 3Å; T289-K292 VanDerWaalsContact O-N 3.14Å; F290-K292 PolarHBondContact O-N 2.85Å
293	N	89.9	Confident	90.8	Very high	15 Å²	15	46 Å²	46	8%	0.08	24%	0.239	C	C	.	.			trans	-65.5	154.8	176.4	-69.4	-2.2	0	0	0	111.7	E291 L295 S335 N337 S353	E291-N293 PolarHBondContact O-N 2.91Å; E291-N293 PolarHBondContact O-OD1 3.03Å; E291-N293 PolarHBondContact OE2-ND2 3.18Å; N293-L295 HydrophobicContact CB-CD2 4.03Å; N293-L295 PolarHBondContact O-N 3.47Å; N293-S335 PolarHBondContact ND2-OG 3.05Å; N293-N337 PolarHBondContact ND2-OD1 3.28Å; N293-S353 PolarHBondContact ND2-OG 3.48Å
294	L	90.5	Very high	90.6	Very high	36 Å²	36	50 Å²	50	19%	0.188	25%	0.253	C	S	.	.			trans	-77.3	87.2	173.8	-58.8	-177.3	0	0	0	109.7	N161 L203 R296	N161-L294 HydrophobicContact CB-CD1 4.08Å; L203-L294 HydrophobicContact CB-CD2 4.12Å; L203-L294 HydrophobicContact CD1-CD2 4.15Å; L203-L294 HydrophobicContact CD2-CD2 4.1Å; L203-L294 HydrophobicContact CG-CD2 4.34Å; L294-R296 PolarHBondContact O-N 3.32Å
295	L	94.1	Very high	90.6	Very high	3 Å²	3	46.4 Å²	46.4	2%	0.016	23%	0.229	C	C	.	.			trans	-78.2	117.2	-179.3	-58.4	-168.6	0	0	0	111	T245 G246 N259 H288 N293 V336 N337	T245-L295 PolarHBondContact OG1-O 2.93Å; G246-L295 WeakPolarHBondContact CA-O 3.24Å; G246-L295 PolarHBondContact N-O 2.49Å; N259-L295 WeakPolarHBondContact ND2-CB 3.44Å; N259-L295 PolarHBondContact ND2-O 3.06Å; H288-L295 WeakPolarHBondContact NE2-CD1 3.17Å; N293-L295 HydrophobicContact CB-CD2 4.03Å; N293-L295 PolarHBondContact O-N 3.47Å; L295-V336 WeakPolarHBondContact CD2-O 3.37Å; L295-N337 WeakPolarHBondContact CA-O 3.49Å
296	R	94	Very high	90.9	Very high	9 Å²	9	44.8 Å²	44.8	3%	0.034	21%	0.212	C	C	.	.			trans	-90.6	153.3	179	-55.4	-56.2	-170.2	-170.5	2.1	111.8	D120 N161 L203 S204 T245 L294 G309 N337 E338	D120-R296 IonicContact OD2-NH2 2.75Å; N161-R296 PolarHBondContact O-NH2 2.76Å; L203-R296 PolarHBondContact O-NH1 2.96Å; S204-R296 PolarHBondContact OG-NH1 2.85Å; T245-R296 PolarHBondContact O-NH1 3.46Å; L294-R296 PolarHBondContact O-N 3.32Å; R296-G309 PolarHBondContact O-N 3.43Å; R296-N337 PolarHBondContact N-O 3.01Å; R296-E338 HydrophobicContact CB-CB 4.07Å; R296-E338 HydrophobicContact CB-CG 3.84Å; R296-E338 WeakPolarHBondContact CB-OE1 3.4Å; R296-E338 HydrophobicContact CG-CB 4.31Å; R296-E338 HydrophobicContact CG-CG 4.31Å; R296-E338 WeakPolarHBondContact CG-OE1 3.41Å
297	C	93.5	Very high	91.2	Very high	3 Å²	3	44.7 Å²	44.7	2%	0.02	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	155.9	173.7	55.5	0	0	0	0	110.1	S248 N259 L265 T307	S248-C297 WeakPolarHBondContact CB-O 3.41Å; N259-C297 HydrophobicContact CB-CB 4.44Å; L265-C297 HydrophobicContact CD1-CB 3.94Å; C297-T307 VanDerWaalsContact CA-O 3.29Å; C297-T307 WeakPolarHBondContact CA-O 3.5Å; C297-T307 WeakPolarHBondContact CB-O 3.47Å
298	A	94.3	Very high	91.2	Very high	8 Å²	8	39.7 Å²	39.7	7%	0.066	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	152.7	174.2	0	0	0	0	0	111.2	I306 T307 T339 F341	A298-I306 WeakPolarHBondContact O-CA 3.46Å; A298-T307 PolarHBondContact N-O 2.93Å; A298-T307 PolarHBondContact O-N 3.34Å; A298-T307 PolarHBondContact O-OG1 3.49Å; A298-T339 WeakPolarHBondContact CB-O 3.34Å; A298-F341 HydrophobicContact CB-CD2 4.46Å
299	W	94.5	Very high	91.3	Very high	19 Å²	19	38.5 Å²	38.5	7%	0.072	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	145	172.9	-72.9	89	0	0	0	109.8	S248 P251 F255 L257 M267 I306 V320 F341	S248-W299 PolarHBondContact O-NE1 2.91Å; P251-W299 HydrophobicContact CG-CB 4.45Å; F255-W299 HydrophobicContact CB-CH2 3.62Å; F255-W299 HydrophobicContact CB-CZ2 3.6Å; F255-W299 HydrophobicContact CG-CH2 4.3Å; L257-W299 HydrophobicContact CB-CZ2 4.44Å; L257-W299 HydrophobicContact CD1-CD2 3.63Å; L257-W299 HydrophobicContact CD1-CE3 4.37Å; L257-W299 HydrophobicContact CD1-CG 3.87Å; L257-W299 HydrophobicContact CD1-CZ2 3.81Å; L257-W299 HydrophobicContact CD2-CH2 4.41Å; L257-W299 HydrophobicContact CD2-CZ2 3.95Å; L257-W299 HydrophobicContact CG-CD2 4.16Å; L257-W299 HydrophobicContact CG-CH2 4.23Å; L257-W299 HydrophobicContact CG-CZ2 3.37Å; L257-W299 VanDerWaalsContact CG-NE1 3.29Å; M267-W299 HydrophobicContact CG-CH2 3.9Å; M267-W299 HydrophobicContact CG-CZ2 4.19Å; M267-W299 HydrophobicContact SD-CH2 3.54Å; M267-W299 VanDerWaalsContact SD-CH2 3.54Å; M267-W299 HydrophobicContact SD-CZ2 4.39Å; M267-W299 HydrophobicContact SD-CZ3 4.32Å; W299-I306 HydrophobicContact CD2-CG2 3.91Å; W299-I306 HydrophobicContact CE3-CG2 3.5Å; W299-I306 VanDerWaalsContact CE3-CG2 3.5Å; W299-I306 HydrophobicContact CH2-CG2 4.41Å; W299-I306 HydrophobicContact CZ3-CG2 3.77Å; W299-V320 HydrophobicContact CZ3-CG2 3.98Å; W299-F341 VanDerWaalsContact C-CD2 3.42Å; W299-F341 WeakPolarHBondContact O-CD2 3.42Å
300	S	92.9	Very high	91.5	Very high	7 Å²	7	36.3 Å²	36.3	5%	0.049	17%	0.169	C	C	.	.			trans	-71.9	152.1	161.7	64.8	0	0	0	0	110.4	D302 N303 R304 R305	S300-D302 WeakPolarHBondContact CB-OD1 3.28Å; S300-D302 PolarHBondContact O-N 2.96Å; S300-D302 PolarHBondContact OG-OD1 2.89Å; S300-N303 PolarHBondContact O-N 2.81Å; S300-R304 PolarHBondContact OG-N 2.79Å; S300-R305 WeakPolarHBondContact CB-O 3.23Å; S300-R305 PolarHBondContact N-O 2.88Å; S300-R305 WeakPolarHBondContact OG-CA 3.36Å; S300-R305 PolarHBondContact OG-N 3.29Å; S300-R305 PolarHBondContact OG-O 2.92Å
301	I	89.1	Confident	91.7	Very high	106 Å²	106	28 Å²	28	54%	0.544	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-29.2	-178.7	-168.2	59.3	0	0	0	113.2	P251 N303 P343	P251-I301 HydrophobicContact CB-CD1 4.08Å; P251-I301 HydrophobicContact CG-CD1 4.16Å; I301-N303 VanDerWaalsContact C-N 3.3Å; I301-P343 WeakPolarHBondContact CG2-O 3.1Å
302	D	87.8	Confident	91.9	Very high	70 Å²	70	26.2 Å²	26.2	37%	0.374	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.5	1.4	178.4	68.9	-13.5	0	0	0	113.7	S300 R304 C365	S300-D302 WeakPolarHBondContact CB-OD1 3.28Å; S300-D302 PolarHBondContact O-N 2.96Å; S300-D302 PolarHBondContact OG-OD1 2.89Å; D302-R304 HydrophobicContact CB-CG 4.42Å; D302-R304 PolarHBondContact O-N 3.05Å; D302-R304 PolarHBondContact OD1-N 3.28Å; D302-R304 WeakPolarHBondContact OD2-CB 3.37Å; D302-R304 WeakPolarHBondContact OD2-CD 3.48Å; D302-C365 PolarHBondContact OD2-SG 3.42Å; D302-C365 VanDerWaalsContact OD2-SG 3.41Å
303	N	89.8	Confident	92.1	Very high	34 Å²	34	27.5 Å²	27.5	18%	0.182	13%	0.13	C	C	.	.	S	Bend	trans	57.2	11.8	-175.2	-57.6	-30.2	0	0	0	115.1	P251 D252 S300 I301 V320	P251-N303 WeakPolarHBondContact CD-OD1 3.25Å; P251-N303 WeakPolarHBondContact CG-OD1 3.47Å; D252-N303 VanDerWaalsContact CB-ND2 3.35Å; D252-N303 WeakPolarHBondContact CB-ND2 3.26Å; D252-N303 PolarHBondContact OD2-ND2 2.93Å; S300-N303 PolarHBondContact O-N 2.81Å; I301-N303 VanDerWaalsContact C-N 3.3Å; N303-V320 WeakPolarHBondContact O-CG2 3.15Å
304	R	90.6	Very high	92.3	Very high	84 Å²	84	30.9 Å²	30.9	32%	0.317	14%	0.142	S	C	.	.	S	Bend	trans	-89.1	-27.4	-178.6	-65.9	-174.9	175.9	-171.6	-2.6	112.6	S300 D302 D319 V320	S300-R304 PolarHBondContact OG-N 2.79Å; D302-R304 HydrophobicContact CB-CG 4.42Å; D302-R304 PolarHBondContact O-N 3.05Å; D302-R304 PolarHBondContact OD1-N 3.28Å; D302-R304 WeakPolarHBondContact OD2-CB 3.37Å; D302-R304 WeakPolarHBondContact OD2-CD 3.48Å; R304-D319 WeakPolarHBondContact O-CA 3.42Å; R304-V320 WeakPolarHBondContact O-CB 3.18Å; R304-V320 WeakPolarHBondContact O-CG2 3.49Å; R304-V320 PolarHBondContact O-N 3.28Å
305	R	92.2	Very high	92.5	Very high	23 Å²	23	29.3 Å²	29.3	9%	0.087	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	148.2	-177.5	-62.9	-176.3	-178.5	167.8	5.8	111.1	S300 V317 W318 F341 I362 L363 C365	S300-R305 WeakPolarHBondContact CB-O 3.23Å; S300-R305 PolarHBondContact N-O 2.88Å; S300-R305 WeakPolarHBondContact OG-CA 3.36Å; S300-R305 PolarHBondContact OG-N 3.29Å; S300-R305 PolarHBondContact OG-O 2.92Å; R305-V317 HydrophobicContact CB-CG1 4.1Å; R305-V317 HydrophobicContact CG-CG1 4.34Å; R305-W318 VanDerWaalsContact CA-O 3.27Å; R305-W318 WeakPolarHBondContact CA-O 3.08Å; R305-F341 HydrophobicContact CB-CE1 4.37Å; R305-F341 HydrophobicContact CB-CZ 3.93Å; R305-I362 VanDerWaalsContact NH1-CD1 3.3Å; R305-L363 VanDerWaalsContact CZ-O 3.25Å; R305-L363 PolarHBondContact NH1-O 3.26Å; R305-L363 PolarHBondContact NH2-O 3.03Å; R305-C365 PolarHBondContact NE-SG 3.42Å; R305-C365 VanDerWaalsContact NE-SG 3.42Å
306	I	94.6	Very high	92.5	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	148	175.3	60.2	178.8	0	0	0	108.7	L257 L265 F283 A298 W299 V317 W318 V320	L257-I306 HydrophobicContact CD1-CB 3.76Å; L257-I306 HydrophobicContact CD1-CG2 3.45Å; L257-I306 VanDerWaalsContact CD1-CG2 3.45Å; L257-I306 HydrophobicContact CD2-CD1 3.98Å; L257-I306 HydrophobicContact CD2-CG2 4.34Å; L257-I306 HydrophobicContact CG-CG2 4.42Å; L265-I306 HydrophobicContact CD2-CD1 3.61Å; L265-I306 HydrophobicContact CD2-CG1 4.24Å; F283-I306 HydrophobicContact CD1-CD1 3.86Å; F283-I306 HydrophobicContact CD2-CD1 3.47Å; F283-I306 VanDerWaalsContact CD2-CD1 3.47Å; F283-I306 HydrophobicContact CE1-CD1 3.66Å; F283-I306 HydrophobicContact CE2-CD1 3.3Å; F283-I306 HydrophobicContact CG-CD1 3.76Å; F283-I306 HydrophobicContact CZ-CD1 3.41Å; F283-I306 VanDerWaalsContact CZ-CD1 3.41Å; A298-I306 WeakPolarHBondContact O-CA 3.46Å; W299-I306 HydrophobicContact CD2-CG2 3.91Å; W299-I306 HydrophobicContact CE3-CG2 3.5Å; W299-I306 VanDerWaalsContact CE3-CG2 3.5Å; W299-I306 HydrophobicContact CH2-CG2 4.41Å; W299-I306 HydrophobicContact CZ3-CG2 3.77Å; I306-V317 CarbonylContact O-C 3.54Å; I306-V317 WeakPolarHBondContact O-CA 3.38Å; I306-W318 HydrophobicContact CD1-CB 4.21Å; I306-W318 HydrophobicContact CG1-CB 3.77Å; I306-W318 HydrophobicContact CG1-CE3 4.14Å; I306-W318 PolarHBondContact N-O 3.1Å; I306-W318 PolarHBondContact O-N 3.41Å; I306-V320 HydrophobicContact CB-CG2 4.4Å; I306-V320 HydrophobicContact CD1-CG2 4.45Å; I306-V320 HydrophobicContact CG1-CG2 4.31Å; I306-V320 HydrophobicContact CG2-CG2 3.43Å; I306-V320 VanDerWaalsContact CG2-CG2 3.43Å
307	T	94	Very high	92.5	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	156.7	175.2	51.6	0	0	0	0	110.7	C297 A298 H316 V317 T339 F341 L348	C297-T307 VanDerWaalsContact CA-O 3.29Å; C297-T307 WeakPolarHBondContact CA-O 3.5Å; C297-T307 WeakPolarHBondContact CB-O 3.47Å; A298-T307 PolarHBondContact N-O 2.93Å; A298-T307 PolarHBondContact O-N 3.34Å; A298-T307 PolarHBondContact O-OG1 3.49Å; T307-H316 WeakPolarHBondContact CA-O 3.46Å; T307-H316 WeakPolarHBondContact CG2-O 3.27Å; T307-V317 HydrophobicContact CG2-CB 4.23Å; T307-V317 HydrophobicContact CG2-CG1 4.31Å; T307-V317 HydrophobicContact CG2-CG2 3.66Å; T307-T339 WeakPolarHBondContact CB-OG1 3.32Å; T307-T339 PolarHBondContact OG1-OG1 3.09Å; T307-F341 HydrophobicContact CG2-CE1 4.13Å; T307-F341 HydrophobicContact CG2-CE2 3.47Å; T307-F341 VanDerWaalsContact CG2-CE2 3.47Å; T307-F341 HydrophobicContact CG2-CZ 3.24Å; T307-F341 WeakPolarHBondContact OG1-CE2 3.27Å; T307-L348 HydrophobicContact CG2-CD1 3.73Å; T307-L348 HydrophobicContact CG2-CD2 4.32Å
308	S	93.2	Very high	92.5	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	148.5	169.1	80.5	0	0	0	0	109.7	W318	S308-W318 WeakPolarHBondContact OG-CH2 3.32Å; S308-W318 WeakPolarHBondContact OG-CZ3 3.26Å
309	G	90.4	Very high	92.5	Very high	0 Å²	0	30 Å²	30	0%	0	14%	0.137	C	C	.	.			trans	-57.7	153.4	158.5	0	0	0	0	0	110.6	R296 V336	R296-G309 PolarHBondContact O-N 3.43Å; G309-V336 CarbonylContact C-O 3.56Å; G309-V336 WeakPolarHBondContact CA-O 3.44Å
310	S	93.7	Very high	92.4	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	14%	0.136	C	C	.	.	B	Isolated β-bridge	trans	-148.5	140	178.5	-174.1	0	0	0	0	110.2	Q287 D312 Y314 V336	Q287-S310 PolarHBondContact N-OG 2.75Å; S310-D312 VanDerWaalsContact C-N 3.28Å; S310-D312 VanDerWaalsContact CB-OD1 3.24Å; S310-D312 WeakPolarHBondContact CB-OD1 3.36Å; S310-D312 PolarHBondContact O-N 2.64Å; S310-D312 VanDerWaalsContact OG-CG 3.27Å; S310-D312 PolarHBondContact OG-N 3.12Å; S310-D312 PolarHBondContact OG-OD1 2.84Å; S310-Y314 WeakPolarHBondContact CB-O 3.27Å; S310-V336 PolarHBondContact N-O 2.96Å; S310-V336 PolarHBondContact O-N 2.49Å
311	G	91.5	Very high	92.4	Very high	10 Å²	10	34.4 Å²	34.4	10%	0.103	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-10.6	173.4	0	0	0	0	0	114	Q287 T289 R313	Q287-G311 WeakPolarHBondContact O-CA 3.38Å; Q287-G311 PolarHBondContact O-N 2.95Å; T289-G311 WeakPolarHBondContact CG2-O 3.3Å; G311-R313 PolarHBondContact O-N 2.57Å
312	D	91.8	Very high	92.5	Very high	20 Å²	20	32.9 Å²	32.9	11%	0.107	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.4	2.6	178.5	78.7	-22.5	0	0	0	114.3	Q287 S310 Y314 H316 K328	Q287-D312 HydrophobicContact CB-CB 4.39Å; S310-D312 VanDerWaalsContact C-N 3.28Å; S310-D312 VanDerWaalsContact CB-OD1 3.24Å; S310-D312 WeakPolarHBondContact CB-OD1 3.36Å; S310-D312 PolarHBondContact O-N 2.64Å; S310-D312 VanDerWaalsContact OG-CG 3.27Å; S310-D312 PolarHBondContact OG-N 3.12Å; S310-D312 PolarHBondContact OG-OD1 2.84Å; D312-Y314 VanDerWaalsContact C-N 3.29Å; D312-Y314 HydrophobicContact CB-CD2 4.38Å; D312-Y314 VanDerWaalsContact O-CD2 3.23Å; D312-Y314 WeakPolarHBondContact O-CD2 3.43Å; D312-Y314 PolarHBondContact OD1-N 3.2Å; D312-Y314 VanDerWaalsContact OD1-N 3.15Å; D312-Y314 WeakPolarHBondContact OD2-CD2 3.3Å; D312-H316 IonicContact OD1-CE1 3.88Å; D312-H316 PolarHBondContact OD1-CE1 2.84Å; D312-H316 VanDerWaalsContact OD1-CE1 3.29Å; D312-H316 IonicContact OD1-ND1 2.9Å; D312-H316 IonicContact OD2-CE1 3.41Å; D312-H316 PolarHBondContact OD2-CE1 3.08Å; D312-H316 VanDerWaalsContact OD2-CE1 3.28Å; D312-H316 IonicContact OD2-NE2 3.76Å; D312-K328 IonicContact OD2-NZ 2.7Å; D312-K328 PolarHBondContact OD2-NZ 2.83Å
313	R	92.6	Very high	92.6	Very high	131 Å²	131	35.8 Å²	35.8	49%	0.494	16%	0.163	S	C	.	.	S	Bend	trans	75.6	7.2	-179.9	-43.1	162.7	-73.1	-169.6	-1.7	115.1	G311 H332 T333 A334	G311-R313 PolarHBondContact O-N 2.57Å; R313-H332 WeakPolarHBondContact CB-O 3.37Å; R313-T333 VanDerWaalsContact CD-O 3.25Å; R313-T333 WeakPolarHBondContact CD-O 3.35Å; R313-A334 WeakPolarHBondContact CA-O 3.42Å; R313-A334 WeakPolarHBondContact CB-O 3.41Å; R313-A334 WeakPolarHBondContact CG-O 3.47Å
314	Y	94.1	Very high	92.7	Very high	85 Å²	85	40.6 Å²	40.6	33%	0.333	19%	0.185	S	C	.	.			trans	-105.9	143.6	177.3	-66.7	-92.5	0	0	0	111.3	S310 D312 H316 K328 L329 P330	S310-Y314 WeakPolarHBondContact CB-O 3.27Å; D312-Y314 VanDerWaalsContact C-N 3.29Å; D312-Y314 HydrophobicContact CB-CD2 4.38Å; D312-Y314 VanDerWaalsContact O-CD2 3.23Å; D312-Y314 WeakPolarHBondContact O-CD2 3.43Å; D312-Y314 PolarHBondContact OD1-N 3.2Å; D312-Y314 VanDerWaalsContact OD1-N 3.15Å; D312-Y314 WeakPolarHBondContact OD2-CD2 3.3Å; Y314-H316 PolarHBondContact O-ND1 3.32Å; Y314-H316 VanDerWaalsContact O-ND1 3.13Å; Y314-K328 HydrophobicContact CD1-CD 4.25Å; Y314-K328 HydrophobicContact CD1-CG 3.67Å; Y314-K328 HydrophobicContact CE1-CG 4.41Å; Y314-K328 HydrophobicContact CG-CD 4.26Å; Y314-K328 HydrophobicContact CG-CG 3.89Å; Y314-L329 WeakPolarHBondContact CA-O 3.34Å; Y314-P330 HydrophobicContact CD1-CB 4.15Å; Y314-P330 HydrophobicContact CE1-CB 3.84Å
315	V	93.8	Very high	92.8	Very high	4 Å²	4	39.9 Å²	39.9	2%	0.024	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	121.3	169.3	-173.6	0	0	0	0	108.3	K328 L329 V336 T339 L348 S350	V315-K328 WeakPolarHBondContact O-CA 3.21Å; V315-L329 HydrophobicContact CB-CB 4.15Å; V315-L329 PolarHBondContact N-O 3.42Å; V315-L329 PolarHBondContact O-N 3.43Å; V315-V336 HydrophobicContact CG2-CG1 4.31Å; V315-V336 HydrophobicContact CG2-CG2 4.2Å; V315-T339 HydrophobicContact CG1-CG2 3.8Å; V315-L348 HydrophobicContact CG1-CD2 3.63Å; V315-L348 HydrophobicContact CG1-CG 4.49Å; V315-S350 VanDerWaalsContact CG2-CB 3.42Å
316	H	94	Very high	92.8	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.005	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	129.7	-179.8	-68.4	74.7	0	0	0	110	T307 D312 Y314 W318 L325 K328	T307-H316 WeakPolarHBondContact CA-O 3.46Å; T307-H316 WeakPolarHBondContact CG2-O 3.27Å; D312-H316 IonicContact OD1-CE1 3.88Å; D312-H316 PolarHBondContact OD1-CE1 2.84Å; D312-H316 VanDerWaalsContact OD1-CE1 3.29Å; D312-H316 IonicContact OD1-ND1 2.9Å; D312-H316 IonicContact OD2-CE1 3.41Å; D312-H316 PolarHBondContact OD2-CE1 3.08Å; D312-H316 VanDerWaalsContact OD2-CE1 3.28Å; D312-H316 IonicContact OD2-NE2 3.76Å; Y314-H316 PolarHBondContact O-ND1 3.32Å; Y314-H316 VanDerWaalsContact O-ND1 3.13Å; H316-W318 HydrophobicContact CB-CE3 4.23Å; H316-W318 HydrophobicContact CB-CH2 3.19Å; H316-W318 HydrophobicContact CB-CZ2 3.59Å; H316-W318 HydrophobicContact CB-CZ3 3.55Å; H316-W318 AromaticContact CG-CH2 3.98Å; H316-L325 HydrophobicContact CB-CD1 3.85Å; H316-K328 PolarHBondContact NE2-NZ 3.19Å
317	V	94.5	Very high	92.6	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	121.5	174.1	-175.5	0	0	0	0	108	R305 I306 T307 V326 Y327 F341 L348	R305-V317 HydrophobicContact CB-CG1 4.1Å; R305-V317 HydrophobicContact CG-CG1 4.34Å; I306-V317 CarbonylContact O-C 3.54Å; I306-V317 WeakPolarHBondContact O-CA 3.38Å; T307-V317 HydrophobicContact CG2-CB 4.23Å; T307-V317 HydrophobicContact CG2-CG1 4.31Å; T307-V317 HydrophobicContact CG2-CG2 3.66Å; V317-V326 PolarHBondContact O-N 3.25Å; V317-Y327 HydrophobicContact CB-CD2 3.98Å; V317-Y327 HydrophobicContact CB-CG 4.46Å; V317-Y327 HydrophobicContact CG1-CD2 4.1Å; V317-Y327 HydrophobicContact CG2-CD2 4.21Å; V317-Y327 PolarHBondContact N-O 3.02Å; V317-Y327 PolarHBondContact O-N 2.79Å; V317-Y327 VanDerWaalsContact O-N 3.16Å; V317-F341 HydrophobicContact CG1-CZ 4.27Å; V317-L348 HydrophobicContact CG2-CD2 3.74Å
318	W	94.3	Very high	92.5	Very high	2 Å²	2	48.6 Å²	48.6	1%	0.008	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	151	173.9	-58.5	-98.5	0	0	0	110.8	L265 F283 T284 H286 R305 I306 S308 H316 Q324 L325	L265-W318 HydrophobicContact CD2-CE3 4.18Å; L265-W318 HydrophobicContact CD2-CZ3 4.08Å; F283-W318 HydrophobicContact CB-CD2 4.39Å; F283-W318 HydrophobicContact CB-CG 4.28Å; F283-W318 HydrophobicContact CD1-CB 3.84Å; F283-W318 AromaticContact CD1-CG 3.99Å; F283-W318 HydrophobicContact CD1-CG 3.99Å; F283-W318 HydrophobicContact CE1-CB 4.22Å; F283-W318 HydrophobicContact CG-CG 4.45Å; T284-W318 PolarHBondContact O-NE1 2.9Å; T284-W318 VanDerWaalsContact O-NE1 3.09Å; H286-W318 HydrophobicContact CB-CH2 4.01Å; H286-W318 HydrophobicContact CB-CZ2 4.38Å; H286-W318 AromaticContact ND1-CH2 3.94Å; R305-W318 VanDerWaalsContact CA-O 3.27Å; R305-W318 WeakPolarHBondContact CA-O 3.08Å; I306-W318 HydrophobicContact CD1-CB 4.21Å; I306-W318 HydrophobicContact CG1-CB 3.77Å; I306-W318 HydrophobicContact CG1-CE3 4.14Å; I306-W318 PolarHBondContact N-O 3.1Å; I306-W318 PolarHBondContact O-N 3.41Å; S308-W318 WeakPolarHBondContact OG-CH2 3.32Å; S308-W318 WeakPolarHBondContact OG-CZ3 3.26Å; H316-W318 HydrophobicContact CB-CE3 4.23Å; H316-W318 HydrophobicContact CB-CH2 3.19Å; H316-W318 HydrophobicContact CB-CZ2 3.59Å; H316-W318 HydrophobicContact CB-CZ3 3.55Å; H316-W318 AromaticContact CG-CH2 3.98Å; W318-Q324 VanDerWaalsContact CA-O 3.32Å; W318-Q324 WeakPolarHBondContact CA-O 3.36Å; W318-L325 HydrophobicContact CD2-CD1 4.12Å; W318-L325 HydrophobicContact CG-CD1 4.25Å; W318-L325 HydrophobicContact CZ2-CD1 4.23Å
319	D	93.7	Very high	92.5	Very high	35 Å²	35	51.3 Å²	51.3	19%	0.187	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	126.1	163.5	168.1	19.5	0	0	0	108.7	R304 N321 T322 R323 Q324 V326	R304-D319 WeakPolarHBondContact O-CA 3.42Å; D319-N321 VanDerWaalsContact C-N 3.29Å; D319-N321 PolarHBondContact O-N 3.36Å; D319-N321 PolarHBondContact OD1-N 3.39Å; D319-T322 WeakPolarHBondContact CB-OG1 3.29Å; D319-T322 VanDerWaalsContact CG-OG1 3.28Å; D319-T322 WeakPolarHBondContact OD2-CB 3.5Å; D319-T322 WeakPolarHBondContact OD2-CG2 3.43Å; D319-T322 PolarHBondContact OD2-N 3.41Å; D319-T322 PolarHBondContact OD2-OG1 2.82Å; D319-R323 VanDerWaalsContact O-CA 3.23Å; D319-R323 WeakPolarHBondContact O-CA 3.49Å; D319-R323 PolarHBondContact O-N 2.61Å; D319-Q324 PolarHBondContact N-O 3.17Å; D319-V326 HydrophobicContact CB-CG2 3.51Å
320	V	92.8	Very high	92.6	Very high	7 Å²	7	56.1 Å²	56.1	4%	0.042	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-38.6	-177.7	173.6	0	0	0	0	110.7	M267 K281 W299 N303 R304 I306	M267-V320 HydrophobicContact CE-CG1 4.3Å; M267-V320 HydrophobicContact SD-CG1 3.85Å; K281-V320 HydrophobicContact CD-CG1 4.42Å; K281-V320 WeakPolarHBondContact CD-O 3.45Å; K281-V320 WeakPolarHBondContact CE-O 3.22Å; K281-V320 PolarHBondContact NZ-O 2.9Å; W299-V320 HydrophobicContact CZ3-CG2 3.98Å; N303-V320 WeakPolarHBondContact O-CG2 3.15Å; R304-V320 WeakPolarHBondContact O-CB 3.18Å; R304-V320 WeakPolarHBondContact O-CG2 3.49Å; R304-V320 PolarHBondContact O-N 3.28Å; I306-V320 HydrophobicContact CB-CG2 4.4Å; I306-V320 HydrophobicContact CD1-CG2 4.45Å; I306-V320 HydrophobicContact CG1-CG2 4.31Å; I306-V320 HydrophobicContact CG2-CG2 3.43Å; I306-V320 VanDerWaalsContact CG2-CG2 3.43Å
321	N	91.3	Very high	92.4	Very high	110 Å²	110	58 Å²	58	59%	0.588	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-51.4	-173.4	-71.1	-31.4	0	0	0	112	D319	D319-N321 VanDerWaalsContact C-N 3.29Å; D319-N321 PolarHBondContact O-N 3.36Å; D319-N321 PolarHBondContact OD1-N 3.39Å
322	T	91.4	Very high	92.5	Very high	74 Å²	74	58.2 Å²	58.2	45%	0.454	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-17.7	-178.5	59.1	0	0	0	0	113.4	D319 Q324	D319-T322 WeakPolarHBondContact CB-OG1 3.29Å; D319-T322 VanDerWaalsContact CG-OG1 3.28Å; D319-T322 WeakPolarHBondContact OD2-CB 3.5Å; D319-T322 WeakPolarHBondContact OD2-CG2 3.43Å; D319-T322 PolarHBondContact OD2-N 3.41Å; D319-T322 PolarHBondContact OD2-OG1 2.82Å; T322-Q324 PolarHBondContact O-N 3.22Å; T322-Q324 PolarHBondContact OG1-N 3Å
323	R	91.1	Very high	92.6	Very high	131 Å²	131	61.8 Å²	61.8	49%	0.494	32%	0.316	S	S	.	.			trans	62.5	12.3	-171.6	-49.5	175.2	-172.7	-175.1	-3.8	114	T280 K281 F283 D319	T280-R323 PolarHBondContact O-NH2 3.41Å; K281-R323 HydrophobicContact CD-CG 4.16Å; F283-R323 HydrophobicContact CD1-CB 4.23Å; F283-R323 HydrophobicContact CE1-CB 4.09Å; F283-R323 HydrophobicContact CE1-CG 4.16Å; D319-R323 VanDerWaalsContact O-CA 3.23Å; D319-R323 WeakPolarHBondContact O-CA 3.49Å; D319-R323 PolarHBondContact O-N 2.61Å
324	Q	91.7	Very high	92.6	Very high	135 Å²	135	56.7 Å²	56.7	63%	0.631	30%	0.301	S	S	*	.			trans	-87	147.1	-179.1	-65.7	-176	-2.2	0	0	110.5	W318 D319 T322 V326	W318-Q324 VanDerWaalsContact CA-O 3.32Å; W318-Q324 WeakPolarHBondContact CA-O 3.36Å; D319-Q324 PolarHBondContact N-O 3.17Å; T322-Q324 PolarHBondContact O-N 3.22Å; T322-Q324 PolarHBondContact OG1-N 3Å; Q324-V326 PolarHBondContact O-N 2.84Å
325	L	92	Very high	92.5	Very high	70 Å²	70	52.8 Å²	52.8	37%	0.366	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	112.1	168.6	-175.8	71.1	0	0	0	108.2	H316 W318 Y327 K328	H316-L325 HydrophobicContact CB-CD1 3.85Å; W318-L325 HydrophobicContact CD2-CD1 4.12Å; W318-L325 HydrophobicContact CG-CD1 4.25Å; W318-L325 HydrophobicContact CZ2-CD1 4.23Å; L325-Y327 WeakPolarHBondContact CD1-O 3.45Å; L325-K328 HydrophobicContact CD2-CB 4.11Å; L325-K328 HydrophobicContact CD2-CD 4.49Å
326	V	91.6	Very high	92.6	Very high	64 Å²	64	52.6 Å²	52.6	39%	0.388	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	-47.4	-179.3	-176.2	0	0	0	0	110.2	V317 D319 Q324	V317-V326 PolarHBondContact O-N 3.25Å; D319-V326 HydrophobicContact CB-CG2 3.51Å; Q324-V326 PolarHBondContact O-N 2.84Å
327	Y	91.5	Very high	92.7	Very high	50 Å²	50	52.6 Å²	52.6	20%	0.196	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	137.5	180	-59.5	-79.4	0	0	0	111.4	V317 L325 L329 I362 L363	V317-Y327 HydrophobicContact CB-CD2 3.98Å; V317-Y327 HydrophobicContact CB-CG 4.46Å; V317-Y327 HydrophobicContact CG1-CD2 4.1Å; V317-Y327 HydrophobicContact CG2-CD2 4.21Å; V317-Y327 PolarHBondContact N-O 3.02Å; V317-Y327 PolarHBondContact O-N 2.79Å; V317-Y327 VanDerWaalsContact O-N 3.16Å; L325-Y327 WeakPolarHBondContact CD1-O 3.45Å; Y327-L329 HydrophobicContact CD1-CD2 4.15Å; Y327-L329 HydrophobicContact CG-CD2 4.38Å; Y327-I362 HydrophobicContact CE2-CB 4.25Å; Y327-L363 WeakPolarHBondContact OH-CB 3.38Å; Y327-L363 PolarHBondContact OH-N 3.23Å
328	K	92.6	Very high	92.7	Very high	92 Å²	92	52.7 Å²	52.7	40%	0.4	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	90.5	164.1	-174.5	167	-178.1	136.5	0	107.8	D312 Y314 V315 H316 L325 P330	D312-K328 IonicContact OD2-NZ 2.7Å; D312-K328 PolarHBondContact OD2-NZ 2.83Å; Y314-K328 HydrophobicContact CD1-CD 4.25Å; Y314-K328 HydrophobicContact CD1-CG 3.67Å; Y314-K328 HydrophobicContact CE1-CG 4.41Å; Y314-K328 HydrophobicContact CG-CD 4.26Å; Y314-K328 HydrophobicContact CG-CG 3.89Å; V315-K328 WeakPolarHBondContact O-CA 3.21Å; H316-K328 PolarHBondContact NE2-NZ 3.19Å; L325-K328 HydrophobicContact CD2-CB 4.11Å; L325-K328 HydrophobicContact CD2-CD 4.49Å; K328-P330 WeakPolarHBondContact O-CD 3.45Å
329	L	92.3	Very high	92.7	Very high	57 Å²	57	52.6 Å²	52.6	30%	0.298	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	122.4	-171.1	-53.1	171.9	0	0	0	110.3	Y314 V315 Y327 L348	Y314-L329 WeakPolarHBondContact CA-O 3.34Å; V315-L329 HydrophobicContact CB-CB 4.15Å; V315-L329 PolarHBondContact N-O 3.42Å; V315-L329 PolarHBondContact O-N 3.43Å; Y327-L329 HydrophobicContact CD1-CD2 4.15Å; Y327-L329 HydrophobicContact CG-CD2 4.38Å; L329-L348 HydrophobicContact CD1-CD2 3.85Å
330	P	93.4	Very high	92.7	Very high	101 Å²	101	51.2 Å²	51.2	66%	0.656	28%	0.279	S	S	*	.			trans	-82	159.4	170.2	33.7	-33	0	0	0	111.2	Y314 K328	Y314-P330 HydrophobicContact CD1-CB 4.15Å; Y314-P330 HydrophobicContact CE1-CB 3.84Å; K328-P330 WeakPolarHBondContact O-CD 3.45Å
331	G	89.5	Confident	92.8	Very high	40 Å²	40	52.1 Å²	52.1	41%	0.412	28%	0.282	S	S	.	.			trans	154.7	-39.7	170.4	0	0	0	0	0	112.7
332	H	92.7	Very high	92.8	Very high	13 Å²	13	47.1 Å²	47.1	6%	0.06	26%	0.255	C	S	.	.			trans	-70.4	142.9	175.7	-72.5	-83.2	0	0	0	111.6	R313 V336 S350 G352 D354 F358	R313-H332 WeakPolarHBondContact CB-O 3.37Å; H332-V336 HydrophobicContact CB-CG2 3.97Å; H332-V336 VanDerWaalsContact CD2-CG2 3.48Å; H332-V336 WeakPolarHBondContact CD2-CG2 3.37Å; H332-S350 VanDerWaalsContact NE2-CB 3.35Å; H332-S350 WeakPolarHBondContact NE2-CB 3.45Å; H332-S350 PolarHBondContact NE2-OG 2.87Å; H332-G352 PolarHBondContact CE1-N 3.41Å; H332-D354 VanDerWaalsContact CA-OD2 3.25Å; H332-D354 WeakPolarHBondContact CA-OD2 3.44Å; H332-D354 IonicContact CE1-OD1 3.75Å; H332-D354 IonicContact CG-OD1 2.83Å; H332-D354 IonicContact CG-OD2 3.29Å; H332-D354 IonicContact ND1-OD1 3.94Å; H332-D354 PolarHBondContact ND1-OD1 3.32Å; H332-D354 IonicContact ND1-OD2 3.28Å; H332-D354 PolarHBondContact ND1-OD2 2.98Å; H332-F358 AromaticContact CD2-CD2 3.86Å; H332-F358 AromaticContact CE1-CD2 3.47Å; H332-F358 VanDerWaalsContact CE1-CD2 3.47Å; H332-F358 WeakPolarHBondContact CE1-CD2 3.21Å; H332-F358 AromaticContact CE1-CE2 3.96Å; H332-F358 AromaticContact ND1-CD2 3.81Å; H332-F358 AromaticContact ND1-CE2 3.82Å; H332-F358 AromaticContact NE2-CD2 3.49Å; H332-F358 WeakPolarHBondContact NE2-CD2 3.43Å
333	T	93	Very high	92.7	Very high	96 Å²	96	45.1 Å²	45.1	59%	0.589	24%	0.243	S	C	*	.	S	Bend	trans	-96.2	-12.9	177.4	59	0	0	0	0	112.9	R313 D354	R313-T333 VanDerWaalsContact CD-O 3.25Å; R313-T333 WeakPolarHBondContact CD-O 3.35Å; T333-D354 PolarHBondContact N-OD2 2.9Å; T333-D354 WeakPolarHBondContact OG1-CB 3.45Å; T333-D354 PolarHBondContact OG1-OD2 3.18Å
334	A	92.7	Very high	92.5	Very high	24 Å²	24	43.8 Å²	43.8	20%	0.198	25%	0.25	C	S	.	.	S	Bend	trans	-134.2	-174.9	177.6	0	0	0	0	0	110.9	R313 D354	R313-A334 WeakPolarHBondContact CA-O 3.42Å; R313-A334 WeakPolarHBondContact CB-O 3.41Å; R313-A334 WeakPolarHBondContact CG-O 3.47Å; A334-D354 HydrophobicContact CB-CB 3.88Å
335	S	93.7	Very high	92.4	Very high	2 Å²	2	38.6 Å²	38.6	1%	0.014	23%	0.226	C	C	.	.			trans	-55.7	139.5	178.9	45.2	0	0	0	0	112.4	E291 N293 G352 S353	E291-S335 VanDerWaalsContact OE2-CB 3.26Å; E291-S335 WeakPolarHBondContact OE2-CB 3.16Å; E291-S335 PolarHBondContact OE2-OG 3.38Å; N293-S335 PolarHBondContact ND2-OG 3.05Å; S335-G352 CarbonylContact O-C 3.57Å; S335-G352 WeakPolarHBondContact O-CA 3.27Å; S335-S353 PolarHBondContact O-N 2.84Å; S335-S353 PolarHBondContact O-OG 3.22Å; S335-S353 WeakPolarHBondContact OG-CB 3.44Å; S335-S353 PolarHBondContact OG-OG 3.09Å
336	V	95.2	Very high	92.2	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	112.6	173	-177.5	0	0	0	0	107.5	L295 G309 S310 V315 H332 T339 V351	L295-V336 WeakPolarHBondContact CD2-O 3.37Å; G309-V336 CarbonylContact C-O 3.56Å; G309-V336 WeakPolarHBondContact CA-O 3.44Å; S310-V336 PolarHBondContact N-O 2.96Å; S310-V336 PolarHBondContact O-N 2.49Å; V315-V336 HydrophobicContact CG2-CG1 4.31Å; V315-V336 HydrophobicContact CG2-CG2 4.2Å; H332-V336 HydrophobicContact CB-CG2 3.97Å; H332-V336 VanDerWaalsContact CD2-CG2 3.48Å; H332-V336 WeakPolarHBondContact CD2-CG2 3.37Å; V336-T339 HydrophobicContact CG1-CG2 3.9Å; V336-V351 CarbonylContact C-O 3.58Å; V336-V351 WeakPolarHBondContact CA-O 3.42Å; V336-V351 WeakPolarHBondContact CG1-O 3.26Å
337	N	94.8	Very high	92.2	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.005	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	-44.6	-173.5	-64.2	-38.8	0	0	0	111.7	V75 Y76 N293 L295 R296 V351 S353	V75-N337 PolarHBondContact O-ND2 2.9Å; Y76-N337 WeakPolarHBondContact O-CB 3.44Å; N293-N337 PolarHBondContact ND2-OD1 3.28Å; L295-N337 WeakPolarHBondContact CA-O 3.49Å; R296-N337 PolarHBondContact N-O 3.01Å; N337-V351 PolarHBondContact N-O 2.79Å; N337-S353 PolarHBondContact ND2-OG 2.93Å; N337-S353 PolarHBondContact OD1-OG 2.8Å
338	E	95.4	Very high	92.3	Very high	3 Å²	3	31.3 Å²	31.3	1%	0.014	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	151.3	-178.9	-177	156.7	-124.6	0	0	111.6	Y76 C77 G78 K79 R296 V351	Y76-E338 WeakPolarHBondContact O-CB 3.46Å; C77-E338 WeakPolarHBondContact CA-OE2 3.48Å; C77-E338 WeakPolarHBondContact CB-OE2 3.47Å; G78-E338 PolarHBondContact N-OE2 3.1Å; K79-E338 WeakPolarHBondContact CE-OE1 3.41Å; K79-E338 VanDerWaalsContact NZ-CD 3.3Å; K79-E338 IonicContact NZ-OE1 3.74Å; K79-E338 PolarHBondContact NZ-OE1 2.89Å; K79-E338 IonicContact NZ-OE2 2.61Å; R296-E338 HydrophobicContact CB-CB 4.07Å; R296-E338 HydrophobicContact CB-CG 3.84Å; R296-E338 WeakPolarHBondContact CB-OE1 3.4Å; R296-E338 HydrophobicContact CG-CB 4.31Å; R296-E338 HydrophobicContact CG-CG 4.31Å; R296-E338 WeakPolarHBondContact CG-OE1 3.41Å; E338-V351 PolarHBondContact N-O 2.9Å; E338-V351 PolarHBondContact O-N 3.16Å
339	T	94.5	Very high	92.4	Very high	0 Å²	0	27 Å²	27	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	148.6	173.5	55.1	0	0	0	0	108.3	A298 T307 V315 V336 L349	A298-T339 WeakPolarHBondContact CB-O 3.34Å; T307-T339 WeakPolarHBondContact CB-OG1 3.32Å; T307-T339 PolarHBondContact OG1-OG1 3.09Å; V315-T339 HydrophobicContact CG1-CG2 3.8Å; V336-T339 HydrophobicContact CG1-CG2 3.9Å; T339-L349 CarbonylContact C-O 3.56Å; T339-L349 WeakPolarHBondContact CA-O 3.46Å
340	A	94.5	Very high	92.6	Very high	6 Å²	6	24.6 Å²	24.6	5%	0.05	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	142.3	174.9	0	0	0	0	0	110.4	F80 L349	F80-A340 HydrophobicContact CD2-CB 4.14Å; F80-A340 HydrophobicContact CE2-CB 4.5Å; A340-L349 HydrophobicContact CB-CB 4.24Å; A340-L349 HydrophobicContact CB-CD2 4.05Å; A340-L349 PolarHBondContact N-O 3.47Å; A340-L349 WeakPolarHBondContact O-CB 3.49Å; A340-L349 PolarHBondContact O-N 3.46Å
341	F	93.9	Very high	92.6	Very high	26 Å²	26	19.8 Å²	19.8	11%	0.114	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	144.9	170.7	-68.7	-83.7	0	0	0	109.9	F80 A298 W299 R305 T307 V317 L348 I362	F80-F341 WeakPolarHBondContact CD2-O 3.42Å; A298-F341 HydrophobicContact CB-CD2 4.46Å; W299-F341 VanDerWaalsContact C-CD2 3.42Å; W299-F341 WeakPolarHBondContact O-CD2 3.42Å; R305-F341 HydrophobicContact CB-CE1 4.37Å; R305-F341 HydrophobicContact CB-CZ 3.93Å; T307-F341 HydrophobicContact CG2-CE1 4.13Å; T307-F341 HydrophobicContact CG2-CE2 3.47Å; T307-F341 VanDerWaalsContact CG2-CE2 3.47Å; T307-F341 HydrophobicContact CG2-CZ 3.24Å; T307-F341 WeakPolarHBondContact OG1-CE2 3.27Å; V317-F341 HydrophobicContact CG1-CZ 4.27Å; F341-L348 HydrophobicContact CD1-CD1 3.94Å; F341-L348 HydrophobicContact CE1-CD1 3.86Å; F341-L348 HydrophobicContact CG-CD1 4.33Å; F341-L348 HydrophobicContact CZ-CD1 4.19Å; F341-I362 HydrophobicContact CD1-CD1 3.94Å; F341-I362 HydrophobicContact CE1-CD1 3.57Å
342	H	92.5	Very high	92.8	Very high	5 Å²	5	17.9 Å²	17.9	2%	0.023	11%	0.109	C	C	.	.			trans	-69.1	144.3	170.4	-175.5	-95.2	0	0	0	110.4	F80 G84 Y102 T344 E345 I347	F80-H342 AromaticContact CD1-CD2 3.82Å; F80-H342 HydrophobicContact CD2-CB 4.19Å; F80-H342 AromaticContact CE1-CD2 3.87Å; F80-H342 HydrophobicContact CE2-CB 3.95Å; F80-H342 HydrophobicContact CZ-CB 4.12Å; G84-H342 WeakPolarHBondContact CA-NE2 3.37Å; G84-H342 PolarHBondContact O-NE2 3.15Å; Y102-H342 PolarHBondContact OH-CE1 2.86Å; H342-T344 PolarHBondContact CE1-OG1 3.05Å; H342-T344 PolarHBondContact ND1-N 2.87Å; H342-T344 PolarHBondContact ND1-OG1 3.45Å; H342-T344 PolarHBondContact O-N 2.82Å; H342-E345 WeakPolarHBondContact CB-O 3.37Å; H342-E345 WeakPolarHBondContact ND1-CB 3.12Å; H342-E345 PolarHBondContact ND1-N 3.01Å; H342-I347 HydrophobicContact CB-CB 3.69Å; H342-I347 HydrophobicContact CB-CD1 4.46Å; H342-I347 HydrophobicContact CB-CG1 4.44Å; H342-I347 PolarHBondContact N-O 3.09Å
343	P	89	Confident	92.9	Very high	31 Å²	31	17.9 Å²	17.9	20%	0.201	11%	0.11	C	C	.	.	S	Bend	trans	-69.1	-27.5	-171.1	26	-37.5	0	0	0	114.5	S81 S82 I301	S81-P343 WeakPolarHBondContact O-CG 3.34Å; S82-P343 WeakPolarHBondContact O-CB 3.22Å; S82-P343 VanDerWaalsContact O-CG 3.26Å; S82-P343 WeakPolarHBondContact O-CG 3.36Å; I301-P343 WeakPolarHBondContact CG2-O 3.1Å
344	T	87	Confident	92.9	Very high	104 Å²	104	14.1 Å²	14.1	64%	0.638	9%	0.086	S	C	*	.	S	Bend	trans	-123.6	-32.7	-170.8	54.9	0	0	0	0	114.1	H342	H342-T344 PolarHBondContact CE1-OG1 3.05Å; H342-T344 PolarHBondContact ND1-N 2.87Å; H342-T344 PolarHBondContact ND1-OG1 3.45Å; H342-T344 PolarHBondContact O-N 2.82Å
345	E	87.9	Confident	92.9	Very high	25 Å²	25	17.8 Å²	17.8	12%	0.117	10%	0.098	C	C	.	.	S	Bend	trans	-111.3	152.8	-174.9	-63.1	-177.1	-160.8	0	0	109.2	S59 N60 Y102 H342 I347	S59-E345 WeakPolarHBondContact CA-OE2 3.47Å; S59-E345 VanDerWaalsContact CB-OE2 3.25Å; S59-E345 WeakPolarHBondContact CB-OE2 3.44Å; N60-E345 PolarHBondContact N-OE2 2.89Å; N60-E345 PolarHBondContact ND2-OE1 2.91Å; Y102-E345 WeakPolarHBondContact CE1-OE1 3.44Å; Y102-E345 PolarHBondContact OH-OE1 3.05Å; H342-E345 WeakPolarHBondContact CB-O 3.37Å; H342-E345 WeakPolarHBondContact ND1-CB 3.12Å; H342-E345 PolarHBondContact ND1-N 3.01Å; E345-I347 HydrophobicContact CB-CD1 3.97Å; E345-I347 HydrophobicContact CB-CG1 4.08Å; E345-I347 PolarHBondContact O-N 3.07Å
346	P	88.6	Confident	92.9	Very high	28 Å²	28	20.9 Å²	20.9	18%	0.182	11%	0.111	C	C	.	.	S	Bend	trans	-79.6	65.2	179.6	37.1	-38.1	0	0	0	110.2	T58 I362 P364	T58-P346 VanDerWaalsContact OG1-CG 3.3Å; T58-P346 WeakPolarHBondContact OG1-CG 3.43Å; P346-I362 HydrophobicContact CB-CG1 3.89Å; P346-I362 VanDerWaalsContact CB-O 3.27Å; P346-I362 WeakPolarHBondContact CB-O 3.35Å; P346-I362 WeakPolarHBondContact CG-O 3.43Å; P346-I362 VanDerWaalsContact O-CG1 3.3Å; P346-I362 WeakPolarHBondContact O-CG1 3.42Å; P346-I362 PolarHBondContact O-N 3.29Å; P346-P364 HydrophobicContact CG-CB 4.35Å
347	I	91.7	Very high	92.9	Very high	1 Å²	1	20.9 Å²	20.9	1%	0.005	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	137.4	174.6	-55.2	163.8	0	0	0	108.4	L61 F80 H342 E345 L359 G360	L61-I347 HydrophobicContact CD1-CB 4.4Å; L61-I347 HydrophobicContact CD1-CD1 3.84Å; L61-I347 HydrophobicContact CD1-CG1 3.74Å; L61-I347 HydrophobicContact CD1-CG2 3.83Å; L61-I347 HydrophobicContact CD2-CD1 4.02Å; L61-I347 HydrophobicContact CG-CD1 3.64Å; L61-I347 HydrophobicContact CG-CG1 4.1Å; F80-I347 HydrophobicContact CZ-CG2 4.12Å; H342-I347 HydrophobicContact CB-CB 3.69Å; H342-I347 HydrophobicContact CB-CD1 4.46Å; H342-I347 HydrophobicContact CB-CG1 4.44Å; H342-I347 PolarHBondContact N-O 3.09Å; E345-I347 HydrophobicContact CB-CD1 3.97Å; E345-I347 HydrophobicContact CB-CG1 4.08Å; E345-I347 PolarHBondContact O-N 3.07Å; I347-L359 HydrophobicContact CG2-CB 4.41Å; I347-L359 HydrophobicContact CG2-CD2 4.12Å; I347-G360 WeakPolarHBondContact CA-O 3.4Å
348	L	93.5	Very high	92.9	Very high	3 Å²	3	23 Å²	23	2%	0.016	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	123.5	175.2	-177.6	64.5	0	0	0	109.9	T307 V315 V317 L329 F341 L359 G360 I362	T307-L348 HydrophobicContact CG2-CD1 3.73Å; T307-L348 HydrophobicContact CG2-CD2 4.32Å; V315-L348 HydrophobicContact CG1-CD2 3.63Å; V315-L348 HydrophobicContact CG1-CG 4.49Å; V317-L348 HydrophobicContact CG2-CD2 3.74Å; L329-L348 HydrophobicContact CD1-CD2 3.85Å; F341-L348 HydrophobicContact CD1-CD1 3.94Å; F341-L348 HydrophobicContact CE1-CD1 3.86Å; F341-L348 HydrophobicContact CG-CD1 4.33Å; F341-L348 HydrophobicContact CZ-CD1 4.19Å; L348-L359 WeakPolarHBondContact O-CA 3.23Å; L348-G360 PolarHBondContact N-O 2.95Å; L348-G360 PolarHBondContact O-N 3.45Å; L348-I362 HydrophobicContact CB-CG2 4.13Å; L348-I362 HydrophobicContact CD2-CG2 4.45Å
349	L	94.9	Very high	92.8	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	133.3	167.7	-179.8	79.3	0	0	0	109.1	G78 F80 L87 T339 A340 V351 I357 F358 L359	G78-L349 VanDerWaalsContact C-CD2 3.47Å; G78-L349 WeakPolarHBondContact O-CD2 3.45Å; F80-L349 HydrophobicContact CD2-CB 4.28Å; F80-L349 HydrophobicContact CE2-CB 3.41Å; F80-L349 VanDerWaalsContact CE2-CB 3.41Å; F80-L349 HydrophobicContact CE2-CD2 4.45Å; F80-L349 HydrophobicContact CE2-CG 4.45Å; F80-L349 HydrophobicContact CZ-CB 3.69Å; L87-L349 HydrophobicContact CD1-CD1 4.23Å; L87-L349 HydrophobicContact CD2-CD1 4.43Å; T339-L349 CarbonylContact C-O 3.56Å; T339-L349 WeakPolarHBondContact CA-O 3.46Å; A340-L349 HydrophobicContact CB-CB 4.24Å; A340-L349 HydrophobicContact CB-CD2 4.05Å; A340-L349 PolarHBondContact N-O 3.47Å; A340-L349 WeakPolarHBondContact O-CB 3.49Å; A340-L349 PolarHBondContact O-N 3.46Å; L349-V351 HydrophobicContact CD2-CG2 4.21Å; L349-V351 HydrophobicContact CG-CG2 4.13Å; L349-I357 HydrophobicContact CD1-CG2 3.23Å; L349-I357 HydrophobicContact CG-CG2 4.26Å; L349-F358 CarbonylContact C-O 3.6Å; L349-F358 WeakPolarHBondContact CA-O 3.42Å; L349-L359 HydrophobicContact CB-CD2 4.02Å; L349-L359 HydrophobicContact CD1-CD2 3.45Å; L349-L359 VanDerWaalsContact CD1-CD2 3.45Å; L349-L359 HydrophobicContact CD1-CG 4.19Å; L349-L359 HydrophobicContact CG-CD2 4.37Å
350	S	95.3	Very high	92.6	Very high	8 Å²	8	23.3 Å²	23.3	6%	0.056	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	136.1	168.3	63.6	0	0	0	0	111.5	V315 H332 I357 F358	V315-S350 VanDerWaalsContact CG2-CB 3.42Å; H332-S350 VanDerWaalsContact NE2-CB 3.35Å; H332-S350 WeakPolarHBondContact NE2-CB 3.45Å; H332-S350 PolarHBondContact NE2-OG 2.87Å; S350-I357 WeakPolarHBondContact O-CA 3.28Å; S350-F358 PolarHBondContact N-O 2.69Å; S350-F358 PolarHBondContact O-N 3.45Å
351	V	95.3	Very high	92.3	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	124.9	-171.2	178.8	0	0	0	0	108.7	V75 V336 N337 E338 L349 I357	V75-V351 HydrophobicContact CB-CG1 3.27Å; V75-V351 HydrophobicContact CG1-CG1 3.15Å; V75-V351 HydrophobicContact CG2-CG1 4.47Å; V75-V351 WeakPolarHBondContact O-CG1 3.27Å; V336-V351 CarbonylContact C-O 3.58Å; V336-V351 WeakPolarHBondContact CA-O 3.42Å; V336-V351 WeakPolarHBondContact CG1-O 3.26Å; N337-V351 PolarHBondContact N-O 2.79Å; E338-V351 PolarHBondContact N-O 2.9Å; E338-V351 PolarHBondContact O-N 3.16Å; L349-V351 HydrophobicContact CD2-CG2 4.21Å; L349-V351 HydrophobicContact CG-CG2 4.13Å; V351-I357 HydrophobicContact CG2-CG1 4.37Å; V351-I357 HydrophobicContact CG2-CG2 4.36Å
352	G	93.3	Very high	91.9	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	160.1	-173.8	0	0	0	0	0	115.1	V75 H332 S335 D354 K355 K356	V75-G352 PolarHBondContact N-O 2.79Å; H332-G352 PolarHBondContact CE1-N 3.41Å; S335-G352 CarbonylContact O-C 3.57Å; S335-G352 WeakPolarHBondContact O-CA 3.27Å; G352-D354 WeakPolarHBondContact CA-OD1 3.23Å; G352-D354 PolarHBondContact O-N 2.73Å; G352-D354 VanDerWaalsContact O-N 3.13Å; G352-K355 PolarHBondContact O-N 3.45Å; G352-K356 PolarHBondContact N-O 2.89Å
353	S	93.7	Very high	91.1	Very high	12 Å²	12	27.9 Å²	27.9	8%	0.084	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-6.7	168.3	-54	0	0	0	0	112.3	E74 N293 S335 N337 K355	E74-S353 WeakPolarHBondContact CG-O 3.49Å; N293-S353 PolarHBondContact ND2-OG 3.48Å; S335-S353 PolarHBondContact O-N 2.84Å; S335-S353 PolarHBondContact O-OG 3.22Å; S335-S353 WeakPolarHBondContact OG-CB 3.44Å; S335-S353 PolarHBondContact OG-OG 3.09Å; N337-S353 PolarHBondContact ND2-OG 2.93Å; N337-S353 PolarHBondContact OD1-OG 2.8Å; S353-K355 PolarHBondContact O-N 2.7Å
354	D	93.1	Very high	89.8	Confident	18 Å²	18	28.8 Å²	28.8	10%	0.096	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	12	175	63.7	-18.2	0	0	0	114.2	H332 T333 A334 G352 K356	H332-D354 VanDerWaalsContact CA-OD2 3.25Å; H332-D354 WeakPolarHBondContact CA-OD2 3.44Å; H332-D354 IonicContact CE1-OD1 3.75Å; H332-D354 IonicContact CG-OD1 2.83Å; H332-D354 IonicContact CG-OD2 3.29Å; H332-D354 IonicContact ND1-OD1 3.94Å; H332-D354 PolarHBondContact ND1-OD1 3.32Å; H332-D354 IonicContact ND1-OD2 3.28Å; H332-D354 PolarHBondContact ND1-OD2 2.98Å; T333-D354 PolarHBondContact N-OD2 2.9Å; T333-D354 WeakPolarHBondContact OG1-CB 3.45Å; T333-D354 PolarHBondContact OG1-OD2 3.18Å; A334-D354 HydrophobicContact CB-CB 3.88Å; G352-D354 WeakPolarHBondContact CA-OD1 3.23Å; G352-D354 PolarHBondContact O-N 2.73Å; G352-D354 VanDerWaalsContact O-N 3.13Å; D354-K356 PolarHBondContact O-N 3.23Å
355	K	93.9	Very high	88.2	Confident	100 Å²	100	25.4 Å²	25.4	44%	0.435	13%	0.134	S	C	.	.	S	Bend	trans	68.1	9	178.6	-36.1	-176.1	179.8	-168.5	0	113.9	E72 S73 G352 S353	E72-K355 WeakPolarHBondContact O-CD 3.47Å; E72-K355 WeakPolarHBondContact O-CE 3.3Å; E72-K355 PolarHBondContact O-NZ 3.2Å; S73-K355 WeakPolarHBondContact O-CB 3.32Å; S73-K355 WeakPolarHBondContact O-CG 3.47Å; G352-K355 PolarHBondContact O-N 3.45Å; S353-K355 PolarHBondContact O-N 2.7Å
356	K	93.9	Very high	86.2	Confident	67 Å²	67	32.3 Å²	32.3	29%	0.291	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	145.8	-174.9	-68.8	-179.7	178.1	-177.1	0	109.9	L67 G352 D354 F358	L67-K356 HydrophobicContact CD1-CB 3.75Å; L67-K356 HydrophobicContact CD1-CD 3.87Å; L67-K356 HydrophobicContact CD1-CG 3.88Å; G352-K356 PolarHBondContact N-O 2.89Å; D354-K356 PolarHBondContact O-N 3.23Å; K356-F358 HydrophobicContact CB-CD2 4.49Å; K356-F358 HydrophobicContact CB-CE2 4Å; K356-F358 HydrophobicContact CD-CE2 4.31Å; K356-F358 HydrophobicContact CD-CZ 4.24Å
357	I	94.9	Very high	83.7	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	127	171	-58.5	169.6	0	0	0	106.6	L68 V75 S89 L349 S350 V351	L68-I357 HydrophobicContact CB-CB 4.08Å; L68-I357 HydrophobicContact CD1-CB 4.29Å; L68-I357 HydrophobicContact CD1-CG2 3.97Å; L68-I357 HydrophobicContact CG-CB 4.38Å; L68-I357 HydrophobicContact CG-CG2 4.42Å; L68-I357 PolarHBondContact N-O 2.97Å; L68-I357 PolarHBondContact O-N 2.76Å; V75-I357 HydrophobicContact CG1-CD1 4.47Å; S89-I357 VanDerWaalsContact OG-CD1 3.3Å; S89-I357 WeakPolarHBondContact OG-CD1 3.32Å; L349-I357 HydrophobicContact CD1-CG2 3.23Å; L349-I357 HydrophobicContact CG-CG2 4.26Å; S350-I357 WeakPolarHBondContact O-CA 3.28Å; V351-I357 HydrophobicContact CG2-CG1 4.37Å; V351-I357 HydrophobicContact CG2-CG2 4.36Å
358	F	94.5	Very high	83.3	Confident	45 Å²	45	46 Å²	46	20%	0.197	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	137.4	173	-68	-89.7	0	0	0	109.4	M66 L67 H332 L349 S350 K356	M66-F358 WeakPolarHBondContact O-CA 3.43Å; L67-F358 HydrophobicContact CB-CD1 4.39Å; L67-F358 HydrophobicContact CB-CE1 4.33Å; L67-F358 HydrophobicContact CD1-CD1 4.05Å; L67-F358 HydrophobicContact CD1-CD2 4.49Å; L67-F358 HydrophobicContact CD1-CE1 3.74Å; L67-F358 HydrophobicContact CD1-CE2 4.22Å; L67-F358 HydrophobicContact CD1-CG 4.44Å; L67-F358 HydrophobicContact CD1-CZ 3.84Å; L67-F358 HydrophobicContact CG-CE1 4.46Å; H332-F358 AromaticContact CD2-CD2 3.86Å; H332-F358 AromaticContact CE1-CD2 3.47Å; H332-F358 VanDerWaalsContact CE1-CD2 3.47Å; H332-F358 WeakPolarHBondContact CE1-CD2 3.21Å; H332-F358 AromaticContact CE1-CE2 3.96Å; H332-F358 AromaticContact ND1-CD2 3.81Å; H332-F358 AromaticContact ND1-CE2 3.82Å; H332-F358 AromaticContact NE2-CD2 3.49Å; H332-F358 WeakPolarHBondContact NE2-CD2 3.43Å; L349-F358 CarbonylContact C-O 3.6Å; L349-F358 WeakPolarHBondContact CA-O 3.42Å; S350-F358 PolarHBondContact N-O 2.69Å; S350-F358 PolarHBondContact O-N 3.45Å; K356-F358 HydrophobicContact CB-CD2 4.49Å; K356-F358 HydrophobicContact CB-CE2 4Å; K356-F358 HydrophobicContact CD-CE2 4.31Å; K356-F358 HydrophobicContact CD-CZ 4.24Å
359	L	93.2	Very high	82.8	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.005	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	116.4	166.2	-70	172.5	0	0	0	106.9	N65 M66 L68 F80 L87 I347 L348 L349	N65-L359 CarbonylContact C-O 3.56Å; N65-L359 VanDerWaalsContact CA-O 3.28Å; N65-L359 WeakPolarHBondContact CA-O 3.4Å; M66-L359 HydrophobicContact CB-CB 4.13Å; M66-L359 PolarHBondContact N-O 3.2Å; M66-L359 PolarHBondContact O-N 2.97Å; L68-L359 HydrophobicContact CD1-CD1 4.11Å; L68-L359 HydrophobicContact CD1-CG 4.48Å; L68-L359 HydrophobicContact CD2-CD1 4.48Å; F80-L359 HydrophobicContact CE1-CD2 3.83Å; F80-L359 HydrophobicContact CZ-CD2 3.44Å; F80-L359 VanDerWaalsContact CZ-CD2 3.44Å; L87-L359 HydrophobicContact CD2-CD1 3.9Å; L87-L359 HydrophobicContact CD2-CD2 4.27Å; L87-L359 HydrophobicContact CD2-CG 4.5Å; I347-L359 HydrophobicContact CG2-CB 4.41Å; I347-L359 HydrophobicContact CG2-CD2 4.12Å; L348-L359 WeakPolarHBondContact O-CA 3.23Å; L349-L359 HydrophobicContact CB-CD2 4.02Å; L349-L359 HydrophobicContact CD1-CD2 3.45Å; L349-L359 VanDerWaalsContact CD1-CD2 3.45Å; L349-L359 HydrophobicContact CD1-CG 4.19Å; L349-L359 HydrophobicContact CG-CD2 4.37Å
360	G	90	Very high	82.1	Confident	9 Å²	9	50.9 Å²	50.9	9%	0.093	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	133.6	179.7	0	0	0	0	0	111.1	I347 L348	I347-G360 WeakPolarHBondContact CA-O 3.4Å; L348-G360 PolarHBondContact N-O 2.95Å; L348-G360 PolarHBondContact O-N 3.45Å
361	E	88	Confident	81.4	Confident	35 Å²	35	53.5 Å²	53.5	16%	0.164	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	127.9	168	-171.4	-178.5	143.1	0	0	109.8	R57 T58 S59 P64	R57-E361 IonicContact CZ-OE2 3.75Å; R57-E361 IonicContact NE-OE2 2.59Å; R57-E361 IonicContact NH1-OE2 3.8Å; R57-E361 PolarHBondContact NH1-OE2 2.68Å; R57-E361 IonicContact NH2-OE2 3.13Å; R57-E361 PolarHBondContact NH2-OE2 3.23Å; T58-E361 WeakPolarHBondContact CA-OE1 3.19Å; T58-E361 WeakPolarHBondContact CB-OE1 3.02Å; T58-E361 PolarHBondContact N-OE1 2.91Å; T58-E361 PolarHBondContact OG1-OE1 3.4Å; S59-E361 WeakPolarHBondContact CB-OE2 3.43Å; S59-E361 PolarHBondContact N-OE1 2.98Å; S59-E361 PolarHBondContact N-OE2 2.91Å; S59-E361 VanDerWaalsContact OG-CD 3.27Å; S59-E361 PolarHBondContact OG-OE2 2.85Å; P64-E361 PolarHBondContact O-N 2.76Å
362	I	85.6	Confident	80.5	Confident	9 Å²	9	56.8 Å²	56.8	5%	0.046	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-103.9	150.7	171.2	61.3	-176.4	0	0	0	108.5	R305 Y327 F341 P346 L348	R305-I362 VanDerWaalsContact NH1-CD1 3.3Å; Y327-I362 HydrophobicContact CE2-CB 4.25Å; F341-I362 HydrophobicContact CD1-CD1 3.94Å; F341-I362 HydrophobicContact CE1-CD1 3.57Å; P346-I362 HydrophobicContact CB-CG1 3.89Å; P346-I362 VanDerWaalsContact CB-O 3.27Å; P346-I362 WeakPolarHBondContact CB-O 3.35Å; P346-I362 WeakPolarHBondContact CG-O 3.43Å; P346-I362 VanDerWaalsContact O-CG1 3.3Å; P346-I362 WeakPolarHBondContact O-CG1 3.42Å; P346-I362 PolarHBondContact O-N 3.29Å; L348-I362 HydrophobicContact CB-CG2 4.13Å; L348-I362 HydrophobicContact CD2-CG2 4.45Å
363	L	76.5	Confident	79.6	Confident	90 Å²	90	60.6 Å²	60.6	47%	0.471	29%	0.288	S	S	.	.	P	Polyproline II helix	trans	-61.2	137.1	176.3	-65.3	170.2	0	0	0	109.3	I55 R305 Y327	I55-L363 HydrophobicContact CG2-CD2 3.95Å; R305-L363 VanDerWaalsContact CZ-O 3.25Å; R305-L363 PolarHBondContact NH1-O 3.26Å; R305-L363 PolarHBondContact NH2-O 3.03Å; Y327-L363 WeakPolarHBondContact OH-CB 3.38Å; Y327-L363 PolarHBondContact OH-N 3.23Å
364	P	62	Low	78.6	Confident	50 Å²	50	64.1 Å²	64.1	33%	0.325	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-57.8	150.7	172.6	26.5	-33.9	0	0	0	108.6	T58 P346 M366	T58-P364 HydrophobicContact CG2-CG 3.77Å; P346-P364 HydrophobicContact CG-CB 4.35Å; P364-M366 PolarHBondContact O-N 3.13Å
365	C	53	Low	77.5	Confident	33 Å²	33	67.6 Å²	67.6	22%	0.223	32%	0.319	C	S	.	.			trans	-61.2	104.2	169.8	-65.4	0	0	0	0	107.8	D302 R305 Y367	D302-C365 PolarHBondContact OD2-SG 3.42Å; D302-C365 VanDerWaalsContact OD2-SG 3.41Å; R305-C365 PolarHBondContact NE-SG 3.42Å; R305-C365 VanDerWaalsContact NE-SG 3.42Å; C365-Y367 PolarHBondContact O-N 3.45Å
366	M	45.7	Very low	76.2	Confident	170 Å²	170	64.9 Å²	64.9	84%	0.837	31%	0.309	S	S	*	.			trans	-61.7	133	166.2	-66.6	-78.6	-86.4	0	0	107.4	P364	P364-M366 PolarHBondContact O-N 3.13Å
367	Y	36.6	Very low	74.5	Confident	270 Å²	270	64.7 Å²	64.7	100%	1.059	31%	0.311	S	S	*	.			trans	-63.7	0	-178.8	-76	-85.6	0	0	0	113.3	C365	C365-Y367 PolarHBondContact O-N 3.45Å

Retrieved 367 of 367 residues in 170.8 ms (Link to these results)

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